NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
24229 | 2k1e | 15677 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 H SER 1 -24.516 -15.665 -4.558 2 HA SER 1 HA SER 1 -22.140 -16.013 -5.613 3 HB2 SER 1 2HB SER 1 -22.618 -14.520 -2.954 4 HB3 SER 1 1HB SER 1 -21.269 -14.203 -4.110 5 HG SER 1 1HG SER 1 -22.976 -12.767 -4.326 6 H ALA 2 H ALA 2 -19.920 -15.984 -4.395 7 HA ALA 2 HA ALA 2 -19.735 -18.556 -3.152 8 HB1 ALA 2 1HB ALA 2 -17.535 -16.452 -3.617 9 HB2 ALA 2 2HB ALA 2 -17.938 -17.809 -4.727 10 HB3 ALA 2 3HB ALA 2 -17.280 -18.161 -3.093 11 H ASP 3 H ASP 3 -18.865 -18.933 -1.075 12 HA ASP 3 HA ASP 3 -20.173 -17.490 0.887 13 HB2 ASP 3 2HB ASP 3 -17.796 -19.419 1.205 14 HB3 ASP 3 1HB ASP 3 -18.840 -18.910 2.534 15 H HIS 4 H HIS 4 -16.918 -17.210 -0.426 16 HA HIS 4 HA HIS 4 -16.151 -15.548 1.848 17 HB2 HIS 4 2HB HIS 4 -14.426 -16.688 -0.361 18 HB3 HIS 4 1HB HIS 4 -13.874 -15.534 0.905 19 HD1 HIS 4 1HD HIS 4 -15.335 -19.125 0.696 20 HD2 HIS 4 2HD HIS 4 -13.816 -16.445 3.585 21 HE1 HIS 4 1HE HIS 4 -15.196 -20.357 2.914 22 HE2 HIS 4 2HE HIS 4 -14.312 -18.649 4.611 23 H GLU 5 H GLU 5 -17.863 -14.872 -0.984 24 HA GLU 5 HA GLU 5 -16.640 -12.225 -1.177 25 HB2 GLU 5 2HB GLU 5 -19.000 -13.364 -2.750 26 HB3 GLU 5 1HB GLU 5 -18.283 -11.723 -2.888 27 HG2 GLU 5 2HG GLU 5 -15.982 -12.960 -3.240 28 HG3 GLU 5 1HG GLU 5 -16.959 -14.430 -3.572 29 H ARG 6 H ARG 6 -19.563 -13.887 0.160 30 HA ARG 6 HA ARG 6 -20.696 -11.440 1.040 31 HB2 ARG 6 2HB ARG 6 -22.078 -12.698 2.614 32 HB3 ARG 6 1HB ARG 6 -22.179 -13.392 0.969 33 HG2 ARG 6 2HG ARG 6 -20.843 -15.322 1.603 34 HG3 ARG 6 1HG ARG 6 -20.297 -14.528 3.115 35 HD2 ARG 6 2HD ARG 6 -22.767 -14.582 3.915 36 HD3 ARG 6 1HD ARG 6 -23.054 -15.752 2.571 37 HE ARG 6 HE ARG 6 -21.232 -16.036 4.962 38 HH11 ARG 6 1HH2 ARG 6 -23.114 -17.855 2.513 39 HH12 ARG 6 2HH2 ARG 6 -21.884 -19.058 2.239 40 HH21 ARG 6 1HH1 ARG 6 -19.671 -17.937 4.804 41 HH22 ARG 6 2HH1 ARG 6 -20.257 -19.340 4.058 42 H GLU 7 H GLU 7 -18.289 -13.658 2.418 43 HA GLU 7 HA GLU 7 -18.335 -12.473 4.981 44 HB2 GLU 7 2HB GLU 7 -17.608 -14.837 4.364 45 HB3 GLU 7 1HB GLU 7 -16.071 -14.145 3.744 46 HG2 GLU 7 2HG GLU 7 -15.513 -13.291 6.027 47 HG3 GLU 7 1HG GLU 7 -17.136 -13.800 6.633 48 H ALA 8 H ALA 8 -16.454 -11.964 2.002 49 HA ALA 8 HA ALA 8 -14.578 -10.166 3.043 50 HB1 ALA 8 1HB ALA 8 -14.304 -11.159 0.752 51 HB2 ALA 8 2HB ALA 8 -14.408 -9.369 0.612 52 HB3 ALA 8 3HB ALA 8 -15.835 -10.377 0.215 53 H GLN 9 H GLN 9 -17.777 -9.735 1.489 54 HA GLN 9 HA GLN 9 -17.873 -6.996 1.523 55 HB2 GLN 9 2HB GLN 9 -19.430 -8.574 0.311 56 HB3 GLN 9 1HB GLN 9 -20.211 -8.970 1.876 57 HG2 GLN 9 2HG GLN 9 -20.965 -6.549 2.077 58 HG3 GLN 9 1HG GLN 9 -20.133 -6.185 0.520 59 HE21 GLN 9 1HE2 GLN 9 -21.636 -6.149 -1.151 60 HE22 GLN 9 2HE2 GLN 9 -22.945 -7.281 -1.361 61 H LYS 10 H LYS 10 -18.785 -9.315 4.091 62 HA LYS 10 HA LYS 10 -19.978 -7.578 5.911 63 HB2 LYS 10 2HB LYS 10 -19.826 -10.125 6.191 64 HB3 LYS 10 1HB LYS 10 -18.080 -9.930 6.509 65 HG2 LYS 10 2HG LYS 10 -18.967 -8.295 8.500 66 HG3 LYS 10 1HG LYS 10 -20.482 -9.203 8.256 67 HD2 LYS 10 2HD LYS 10 -19.176 -10.089 10.099 68 HD3 LYS 10 1HD LYS 10 -19.257 -11.340 8.810 69 HE2 LYS 10 2HE LYS 10 -16.927 -11.041 8.214 70 HE3 LYS 10 1HE LYS 10 -16.829 -9.435 9.037 71 HZ1 LYS 10 3HZ LYS 10 -17.380 -11.818 10.712 72 HZ2 LYS 10 1HZ LYS 10 -16.519 -10.357 11.030 73 HZ3 LYS 10 2HZ LYS 10 -15.838 -11.587 10.099 74 H ALA 11 H ALA 11 -16.510 -8.255 5.265 75 HA ALA 11 HA ALA 11 -15.552 -7.001 7.593 76 HB1 ALA 11 1HB ALA 11 -13.317 -7.092 6.523 77 HB2 ALA 11 2HB ALA 11 -14.068 -7.422 4.923 78 HB3 ALA 11 3HB ALA 11 -14.183 -8.646 6.237 79 H GLU 12 H GLU 12 -16.386 -5.783 4.349 80 HA GLU 12 HA GLU 12 -15.038 -3.344 4.600 81 HB2 GLU 12 2HB GLU 12 -17.563 -3.872 2.933 82 HB3 GLU 12 1HB GLU 12 -16.350 -2.561 2.726 83 HG2 GLU 12 2HG GLU 12 -14.588 -4.486 2.381 84 HG3 GLU 12 1HG GLU 12 -16.002 -5.593 2.209 85 H GLU 13 H GLU 13 -18.120 -4.454 5.893 86 HA GLU 13 HA GLU 13 -19.223 -1.883 6.452 87 HB2 GLU 13 2HB GLU 13 -20.562 -4.044 6.440 88 HB3 GLU 13 1HB GLU 13 -19.690 -4.557 7.916 89 HG2 GLU 13 2HG GLU 13 -20.645 -2.592 9.173 90 HG3 GLU 13 1HG GLU 13 -21.521 -2.066 7.689 91 H GLU 14 H GLU 14 -17.071 -4.194 8.092 92 HA GLU 14 HA GLU 14 -17.221 -3.036 10.621 93 HB2 GLU 14 2HB GLU 14 -16.355 -5.372 10.104 94 HB3 GLU 14 1HB GLU 14 -14.825 -4.627 9.525 95 HG2 GLU 14 2HG GLU 14 -14.408 -3.683 11.810 96 HG3 GLU 14 1HG GLU 14 -16.024 -4.265 12.350 97 H LEU 15 H LEU 15 -15.132 -2.365 7.810 98 HA LEU 15 HA LEU 15 -13.350 -0.724 9.178 99 HB2 LEU 15 2HB LEU 15 -13.030 -1.606 6.804 100 HB3 LEU 15 1HB LEU 15 -14.199 -0.380 6.233 101 HG LEU 15 HG LEU 15 -12.687 1.447 6.937 102 HD11 LEU 15 1HD1 LEU 15 -10.336 0.875 7.819 103 HD12 LEU 15 2HD1 LEU 15 -10.939 -0.785 8.150 104 HD13 LEU 15 3HD1 LEU 15 -11.668 0.637 8.990 105 HD21 LEU 15 3HD2 LEU 15 -12.307 0.446 4.689 106 HD22 LEU 15 1HD2 LEU 15 -11.145 -0.739 5.389 107 HD23 LEU 15 2HD2 LEU 15 -10.760 1.019 5.409 108 H GLN 16 H GLN 16 -16.512 -0.050 7.749 109 HA GLN 16 HA GLN 16 -16.339 2.766 7.896 110 HB2 GLN 16 2HB GLN 16 -18.717 0.883 7.597 111 HB3 GLN 16 1HB GLN 16 -18.834 2.671 7.465 112 HG2 GLN 16 2HG GLN 16 -17.412 2.761 5.513 113 HG3 GLN 16 1HG GLN 16 -16.862 1.066 5.707 114 HE21 GLN 16 1HE2 GLN 16 -18.082 -0.608 4.852 115 HE22 GLN 16 2HE2 GLN 16 -19.548 -0.373 3.938 116 H LYS 17 H LYS 17 -17.012 0.309 10.281 117 HA LYS 17 HA LYS 17 -18.466 1.980 12.085 118 HB2 LYS 17 2HB LYS 17 -18.475 -0.581 12.214 119 HB3 LYS 17 1HB LYS 17 -16.754 -0.503 12.708 120 HG2 LYS 17 2HG LYS 17 -17.649 1.076 14.665 121 HG3 LYS 17 1HG LYS 17 -19.246 0.368 14.286 122 HD2 LYS 17 2HD LYS 17 -16.691 -1.270 14.907 123 HD3 LYS 17 1HD LYS 17 -17.806 -0.647 16.172 124 HE2 LYS 17 2HE LYS 17 -19.691 -1.966 15.280 125 HE3 LYS 17 1HE LYS 17 -18.663 -2.624 13.941 126 HZ1 LYS 17 3HZ LYS 17 -17.770 -2.935 16.743 127 HZ2 LYS 17 1HZ LYS 17 -17.505 -3.945 15.383 128 HZ3 LYS 17 2HZ LYS 17 -19.022 -3.906 16.145 129 H VAL 18 H VAL 18 -15.037 1.119 11.526 130 HA VAL 18 HA VAL 18 -14.036 2.296 13.866 131 HB VAL 18 HB VAL 18 -12.635 1.797 11.182 132 HG11 VAL 18 1HG1 VAL 18 -10.558 1.684 12.610 133 HG12 VAL 18 2HG1 VAL 18 -11.517 2.201 14.047 134 HG13 VAL 18 3HG1 VAL 18 -11.315 3.311 12.638 135 HG21 VAL 18 3HG2 VAL 18 -11.919 -0.364 12.299 136 HG22 VAL 18 1HG2 VAL 18 -13.685 -0.298 12.040 137 HG23 VAL 18 2HG2 VAL 18 -13.012 -0.001 13.683 138 H LEU 19 H LEU 19 -14.638 3.518 10.563 139 HA LEU 19 HA LEU 19 -13.483 6.011 10.775 140 HB2 LEU 19 2HB LEU 19 -16.179 5.510 9.370 141 HB3 LEU 19 1HB LEU 19 -14.992 6.807 9.028 142 HG LEU 19 HG LEU 19 -14.705 3.803 8.492 143 HD11 LEU 19 1HD1 LEU 19 -14.690 4.480 6.096 144 HD12 LEU 19 2HD1 LEU 19 -14.859 6.210 6.571 145 HD13 LEU 19 3HD1 LEU 19 -16.197 5.050 6.910 146 HD21 LEU 19 3HD2 LEU 19 -12.458 4.598 9.110 147 HD22 LEU 19 1HD2 LEU 19 -12.597 5.972 7.947 148 HD23 LEU 19 2HD2 LEU 19 -12.587 4.279 7.347 149 H GLU 20 H GLU 20 -16.776 4.953 11.789 150 HA GLU 20 HA GLU 20 -17.817 7.463 12.419 151 HB2 GLU 20 2HB GLU 20 -18.298 4.703 13.749 152 HB3 GLU 20 1HB GLU 20 -19.201 6.163 14.224 153 HG2 GLU 20 2HG GLU 20 -19.238 4.926 11.410 154 HG3 GLU 20 1HG GLU 20 -20.506 4.732 12.675 155 H GLU 21 H GLU 21 -16.180 5.054 14.501 156 HA GLU 21 HA GLU 21 -16.357 6.761 16.755 157 HB2 GLU 21 2HB GLU 21 -14.701 4.205 16.398 158 HB3 GLU 21 1HB GLU 21 -15.107 5.024 17.950 159 HG2 GLU 21 2HG GLU 21 -17.587 4.790 17.325 160 HG3 GLU 21 1HG GLU 21 -17.103 3.742 15.945 161 H ALA 22 H ALA 22 -13.919 6.226 14.253 162 HA ALA 22 HA ALA 22 -11.781 7.554 15.441 163 HB1 ALA 22 1HB ALA 22 -11.569 6.247 13.285 164 HB2 ALA 22 2HB ALA 22 -10.920 7.918 13.127 165 HB3 ALA 22 3HB ALA 22 -12.530 7.508 12.442 166 H SER 23 H SER 23 -14.458 8.749 13.384 167 HA SER 23 HA SER 23 -13.665 11.382 13.148 168 HB2 SER 23 2HB SER 23 -16.567 10.344 13.464 169 HB3 SER 23 1HB SER 23 -16.056 11.885 12.675 170 HG SER 23 1HG SER 23 -15.591 9.186 11.849 171 H LYS 24 H LYS 24 -15.391 9.789 15.780 172 HA LYS 24 HA LYS 24 -16.012 12.212 17.155 173 HB2 LYS 24 2HB LYS 24 -17.307 10.013 17.409 174 HB3 LYS 24 1HB LYS 24 -15.872 9.319 18.217 175 HG2 LYS 24 2HG LYS 24 -16.134 11.347 19.916 176 HG3 LYS 24 1HG LYS 24 -17.776 11.515 19.195 177 HD2 LYS 24 2HD LYS 24 -18.179 9.051 19.765 178 HD3 LYS 24 1HD LYS 24 -16.577 9.008 20.569 179 HE2 LYS 24 2HE LYS 24 -19.034 10.708 21.367 180 HE3 LYS 24 1HE LYS 24 -18.360 9.292 22.267 181 HZ1 LYS 24 3HZ LYS 24 -17.660 11.294 23.330 182 HZ2 LYS 24 1HZ LYS 24 -17.088 11.957 21.885 183 HZ3 LYS 24 2HZ LYS 24 -16.295 10.631 22.581 184 H LYS 25 H LYS 25 -13.588 9.558 17.672 185 HA LYS 25 HA LYS 25 -12.471 10.698 19.992 186 HB2 LYS 25 2HB LYS 25 -11.375 8.767 17.865 187 HB3 LYS 25 1HB LYS 25 -10.384 9.248 19.281 188 HG2 LYS 25 2HG LYS 25 -13.160 7.962 19.621 189 HG3 LYS 25 1HG LYS 25 -11.658 7.005 19.397 190 HD2 LYS 25 2HD LYS 25 -10.608 8.123 21.362 191 HD3 LYS 25 1HD LYS 25 -12.129 9.032 21.679 192 HE2 LYS 25 2HE LYS 25 -13.353 6.933 22.173 193 HE3 LYS 25 1HE LYS 25 -11.944 5.934 21.634 194 HZ1 LYS 25 3HZ LYS 25 -10.662 6.740 23.449 195 HZ2 LYS 25 1HZ LYS 25 -12.115 6.101 24.026 196 HZ3 LYS 25 2HZ LYS 25 -11.913 7.804 23.972 197 H ALA 26 H ALA 26 -11.742 11.068 16.510 198 HA ALA 26 HA ALA 26 -9.364 12.390 16.647 199 HB1 ALA 26 1HB ALA 26 -11.683 12.914 14.674 200 HB2 ALA 26 2HB ALA 26 -10.419 11.647 14.501 201 HB3 ALA 26 3HB ALA 26 -9.956 13.377 14.421 202 H VAL 27 H VAL 27 -12.697 13.864 16.906 203 HA VAL 27 HA VAL 27 -11.597 16.470 16.878 204 HB VAL 27 HB VAL 27 -13.715 17.347 17.701 205 HG11 VAL 27 1HG1 VAL 27 -13.271 16.862 15.276 206 HG12 VAL 27 2HG1 VAL 27 -15.011 16.713 15.701 207 HG13 VAL 27 3HG1 VAL 27 -14.014 15.229 15.477 208 HG21 VAL 27 3HG2 VAL 27 -14.403 15.331 19.195 209 HG22 VAL 27 1HG2 VAL 27 -14.771 14.447 17.660 210 HG23 VAL 27 2HG2 VAL 27 -15.667 15.935 18.077 211 H GLU 28 H GLU 28 -12.137 14.145 19.458 212 HA GLU 28 HA GLU 28 -11.937 16.036 21.602 213 HB2 GLU 28 2HB GLU 28 -13.075 13.722 21.767 214 HB3 GLU 28 1HB GLU 28 -11.478 12.972 21.498 215 HG2 GLU 28 2HG GLU 28 -10.729 14.247 23.693 216 HG3 GLU 28 1HG GLU 28 -12.493 14.488 23.970 217 H ALA 29 H ALA 29 -9.894 13.701 19.931 218 HA ALA 29 HA ALA 29 -7.691 13.873 21.598 219 HB1 ALA 29 1HB ALA 29 -7.828 12.982 18.647 220 HB2 ALA 29 2HB ALA 29 -8.397 11.977 20.033 221 HB3 ALA 29 3HB ALA 29 -6.687 12.391 19.918 222 H GLU 30 H GLU 30 -8.507 15.511 18.495 223 HA GLU 30 HA GLU 30 -6.100 17.074 18.561 224 HB2 GLU 30 2HB GLU 30 -8.584 16.952 16.835 225 HB3 GLU 30 1HB GLU 30 -7.521 18.383 16.716 226 HG2 GLU 30 2HG GLU 30 -6.151 15.651 16.634 227 HG3 GLU 30 1HG GLU 30 -7.101 16.138 15.190 228 H ARG 31 H ARG 31 -9.600 17.763 19.513 229 HA ARG 31 HA ARG 31 -8.869 20.523 19.723 230 HB2 ARG 31 2HB ARG 31 -11.214 19.832 19.107 231 HB3 ARG 31 1HB ARG 31 -11.419 19.233 20.778 232 HG2 ARG 31 2HG ARG 31 -12.476 21.380 20.618 233 HG3 ARG 31 1HG ARG 31 -11.019 21.573 21.650 234 HD2 ARG 31 2HD ARG 31 -9.793 22.645 19.688 235 HD3 ARG 31 1HD ARG 31 -11.276 22.374 18.665 236 HE ARG 31 HE ARG 31 -11.632 23.905 21.213 237 HH11 ARG 31 1HH2 ARG 31 -10.958 24.292 17.665 238 HH12 ARG 31 2HH2 ARG 31 -11.686 25.834 17.578 239 HH21 ARG 31 1HH1 ARG 31 -12.473 25.954 21.096 240 HH22 ARG 31 2HH1 ARG 31 -12.525 26.883 19.631 241 H GLY 32 H GLY 32 -7.206 20.734 21.176 242 HA2 GLY 32 2HA GLY 32 -7.378 21.599 23.551 243 HA3 GLY 32 1HA GLY 32 -7.635 19.842 23.922 244 H ALA 33 H ALA 33 -5.882 19.383 21.306 245 HA ALA 33 HA ALA 33 -3.500 19.071 22.871 246 HB1 ALA 33 1HB ALA 33 -2.652 17.832 20.830 247 HB2 ALA 33 2HB ALA 33 -4.153 18.293 19.958 248 HB3 ALA 33 3HB ALA 33 -4.244 17.204 21.383 249 HA PRO 34 HA PRO 34 -1.662 22.655 20.963 250 HB2 PRO 34 2HB PRO 34 1.078 22.165 21.261 251 HB3 PRO 34 1HB PRO 34 -0.009 22.510 22.662 252 HG2 PRO 34 2HG PRO 34 0.897 19.768 21.634 253 HG3 PRO 34 1HG PRO 34 0.913 20.378 23.339 254 HD2 PRO 34 2HD PRO 34 -1.137 18.805 22.317 255 HD3 PRO 34 1HD PRO 34 -1.477 20.119 23.530 256 H GLY 35 H GLY 35 -1.105 23.314 18.836 257 HA2 GLY 35 2HA GLY 35 -0.143 23.152 16.803 258 HA3 GLY 35 1HA GLY 35 0.383 21.468 17.150 259 H ALA 36 H ALA 36 -2.746 21.495 18.023 260 HA ALA 36 HA ALA 36 -3.527 19.837 15.954 261 HB1 ALA 36 1HB ALA 36 -5.242 21.306 18.059 262 HB2 ALA 36 2HB ALA 36 -4.505 19.669 18.209 263 HB3 ALA 36 3HB ALA 36 -5.806 19.945 17.017 264 H ALA 37 H ALA 37 -5.126 20.011 14.392 265 HA ALA 37 HA ALA 37 -5.715 22.748 13.412 266 HB1 ALA 37 1HB ALA 37 -3.610 21.974 12.260 267 HB2 ALA 37 2HB ALA 37 -4.985 22.049 11.100 268 HB3 ALA 37 3HB ALA 37 -4.444 20.460 11.769 269 H LEU 38 H LEU 38 -6.746 19.476 13.998 270 HA LEU 38 HA LEU 38 -8.446 19.235 11.785 271 HB2 LEU 38 2HB LEU 38 -7.475 17.361 13.065 272 HB3 LEU 38 1HB LEU 38 -8.479 17.763 14.470 273 HG LEU 38 HG LEU 38 -9.880 17.134 11.834 274 HD11 LEU 38 1HD1 LEU 38 -8.632 15.000 13.684 275 HD12 LEU 38 2HD1 LEU 38 -8.088 15.378 12.017 276 HD13 LEU 38 3HD1 LEU 38 -9.724 14.681 12.285 277 HD21 LEU 38 3HD2 LEU 38 -10.498 16.530 14.801 278 HD22 LEU 38 1HD2 LEU 38 -11.477 15.943 13.419 279 HD23 LEU 38 2HD2 LEU 38 -11.357 17.705 13.733 280 H ILE 39 H ILE 39 -9.342 19.505 15.191 281 HA ILE 39 HA ILE 39 -11.010 20.225 16.240 282 HB ILE 39 HB ILE 39 -11.655 22.544 16.121 283 HG12 ILE 39 2HG1 ILE 39 -9.717 22.732 13.717 284 HG13 ILE 39 1HG1 ILE 39 -11.488 22.893 13.573 285 HG21 ILE 39 1HG2 ILE 39 -9.575 21.526 17.251 286 HG22 ILE 39 2HG2 ILE 39 -9.329 23.243 16.759 287 HG23 ILE 39 3HG2 ILE 39 -8.631 21.921 15.776 288 HD11 ILE 39 3HD ILE 39 -9.645 24.776 15.184 289 HD12 ILE 39 1HD ILE 39 -10.468 25.118 13.628 290 HD13 ILE 39 2HD ILE 39 -11.451 24.888 15.112 291 H SER 40 H SER 40 -12.741 21.772 13.494 292 HA SER 40 HA SER 40 -15.070 21.299 14.712 293 HB2 SER 40 2HB SER 40 -14.583 21.638 11.705 294 HB3 SER 40 1HB SER 40 -16.145 21.967 12.535 295 HG SER 40 1HG SER 40 -14.852 23.777 12.138 296 H TYR 41 H TYR 41 -16.854 20.005 14.552 297 HA TYR 41 HA TYR 41 -16.508 17.336 14.256 298 HB2 TYR 41 2HB TYR 41 -19.155 18.918 14.180 299 HB3 TYR 41 1HB TYR 41 -19.060 17.129 14.263 300 HD1 TYR 41 1HD TYR 41 -17.903 16.025 16.186 301 HD2 TYR 41 2HD TYR 41 -18.975 20.190 16.197 302 HE1 TYR 41 1HE TYR 41 -17.943 16.003 18.642 303 HE2 TYR 41 2HE TYR 41 -19.009 20.181 18.654 304 HH TYR 41 HH TYR 41 -19.292 18.660 20.485 305 HA PRO 42 HA PRO 42 -18.783 16.808 10.296 306 HB2 PRO 42 2HB PRO 42 -19.284 18.794 8.427 307 HB3 PRO 42 1HB PRO 42 -20.351 18.555 9.857 308 HG2 PRO 42 2HG PRO 42 -18.012 20.540 9.572 309 HG3 PRO 42 1HG PRO 42 -19.698 20.903 10.119 310 HD2 PRO 42 2HD PRO 42 -17.642 20.425 11.895 311 HD3 PRO 42 1HD PRO 42 -19.330 19.817 12.241 312 H ASP 43 H ASP 43 -15.953 18.636 10.622 313 HA ASP 43 HA ASP 43 -14.928 17.960 7.964 314 HB2 ASP 43 2HB ASP 43 -13.782 19.824 10.137 315 HB3 ASP 43 1HB ASP 43 -13.202 19.657 8.429 316 H ALA 44 H ALA 44 -15.224 16.664 11.005 317 HA ALA 44 HA ALA 44 -12.529 15.584 11.235 318 HB1 ALA 44 1HB ALA 44 -13.876 16.186 13.275 319 HB2 ALA 44 2HB ALA 44 -13.432 14.435 13.247 320 HB3 ALA 44 3HB ALA 44 -15.108 14.955 12.837 321 H ILE 45 H ILE 45 -15.912 14.621 10.581 322 HA ILE 45 HA ILE 45 -15.379 11.934 10.153 323 HB ILE 45 HB ILE 45 -17.578 12.512 10.696 324 HG12 ILE 45 2HG1 ILE 45 -19.040 11.742 8.832 325 HG13 ILE 45 1HG1 ILE 45 -17.651 11.768 7.701 326 HG21 ILE 45 1HG2 ILE 45 -17.533 14.897 10.041 327 HG22 ILE 45 2HG2 ILE 45 -18.981 14.098 9.404 328 HG23 ILE 45 3HG2 ILE 45 -17.603 14.450 8.291 329 HD11 ILE 45 3HD ILE 45 -17.896 10.023 10.251 330 HD12 ILE 45 1HD ILE 45 -18.153 9.468 8.558 331 HD13 ILE 45 2HD ILE 45 -16.518 9.991 9.088 332 H TRP 46 H TRP 46 -15.005 14.669 7.991 333 HA TRP 46 HA TRP 46 -14.776 12.936 5.705 334 HB2 TRP 46 2HB TRP 46 -15.343 15.662 6.101 335 HB3 TRP 46 1HB TRP 46 -13.690 15.707 5.422 336 HD1 TRP 46 HD TRP 46 -13.764 15.790 2.789 337 HE1 TRP 46 1HE TRP 46 -15.614 15.527 1.042 338 HE3 TRP 46 3HE TRP 46 -17.258 13.515 5.728 339 HZ2 TRP 46 2HZ TRP 46 -18.127 14.153 0.842 340 HZ3 TRP 46 3HZ TRP 46 -19.333 12.660 4.687 341 HH2 TRP 46 HH TRP 46 -19.757 12.976 2.273 342 H TRP 47 H TRP 47 -12.649 13.670 8.280 343 HA TRP 47 HA TRP 47 -10.227 13.282 6.655 344 HB2 TRP 47 2HB TRP 47 -9.930 14.954 8.413 345 HB3 TRP 47 1HB TRP 47 -10.782 13.932 9.617 346 HD1 TRP 47 HD TRP 47 -7.210 14.341 8.122 347 HE1 TRP 47 1HE TRP 47 -5.617 13.346 9.895 348 HE3 TRP 47 3HE TRP 47 -10.643 11.901 10.976 349 HZ2 TRP 47 2HZ TRP 47 -5.765 11.331 11.920 350 HZ3 TRP 47 3HZ TRP 47 -9.874 10.349 12.725 351 HH2 TRP 47 HH TRP 47 -7.460 10.076 13.210 352 H SER 48 H SER 48 -12.677 11.653 8.620 353 HA SER 48 HA SER 48 -10.950 9.372 9.086 354 HB2 SER 48 2HB SER 48 -13.984 9.719 9.515 355 HB3 SER 48 1HB SER 48 -12.947 8.407 10.192 356 HG SER 48 1HG SER 48 -13.605 10.393 11.406 357 H VAL 49 H VAL 49 -10.967 9.661 6.296 358 HA VAL 49 HA VAL 49 -12.944 7.588 5.520 359 HB VAL 49 HB VAL 49 -12.271 10.083 3.846 360 HG11 VAL 49 1HG1 VAL 49 -14.248 7.724 3.408 361 HG12 VAL 49 2HG1 VAL 49 -12.741 8.023 2.465 362 HG13 VAL 49 3HG1 VAL 49 -14.107 9.182 2.360 363 HG21 VAL 49 3HG2 VAL 49 -14.805 9.373 5.457 364 HG22 VAL 49 1HG2 VAL 49 -14.675 10.705 4.241 365 HG23 VAL 49 2HG2 VAL 49 -13.679 10.749 5.732 366 H GLU 50 H GLU 50 -10.266 9.542 4.143 367 HA GLU 50 HA GLU 50 -9.558 7.391 2.427 368 HB2 GLU 50 2HB GLU 50 -7.945 8.936 1.471 369 HB3 GLU 50 1HB GLU 50 -9.566 9.707 1.590 370 HG2 GLU 50 2HG GLU 50 -7.115 10.271 3.379 371 HG3 GLU 50 1HG GLU 50 -7.794 11.294 2.072 372 H THR 51 H THR 51 -8.438 8.935 5.386 373 HA THR 51 HA THR 51 -5.996 7.790 5.699 374 HB THR 51 HB THR 51 -7.007 9.480 7.185 375 HG1 THR 51 1HG THR 51 -5.670 8.952 8.614 376 HG21 THR 51 3HG2 THR 51 -8.548 7.140 8.507 377 HG22 THR 51 1HG2 THR 51 -9.278 8.405 7.441 378 HG23 THR 51 2HG2 THR 51 -8.534 8.872 9.004 379 H ALA 52 H ALA 52 -9.126 6.119 6.065 380 HA ALA 52 HA ALA 52 -7.925 3.893 7.434 381 HB1 ALA 52 1HB ALA 52 -10.670 4.186 6.080 382 HB2 ALA 52 2HB ALA 52 -10.297 4.475 7.824 383 HB3 ALA 52 3HB ALA 52 -10.164 2.818 7.143 384 H THR 53 H THR 53 -8.084 4.860 4.095 385 HA THR 53 HA THR 53 -7.547 2.071 3.296 386 HB THR 53 HB THR 53 -9.578 2.754 2.239 387 HG1 THR 53 1HG THR 53 -7.303 2.851 0.601 388 HG21 THR 53 3HG2 THR 53 -9.485 5.195 2.455 389 HG22 THR 53 1HG2 THR 53 -9.716 4.755 0.731 390 HG23 THR 53 2HG2 THR 53 -8.095 5.296 1.309 391 H THR 54 H THR 54 -5.863 3.780 4.765 392 HA THR 54 HA THR 54 -3.918 4.492 4.937 393 HB THR 54 HB THR 54 -2.045 3.770 3.298 394 HG1 THR 54 1HG THR 54 -3.496 3.027 1.616 395 HG21 THR 54 3HG2 THR 54 -2.549 2.885 5.611 396 HG22 THR 54 1HG2 THR 54 -2.033 1.582 4.483 397 HG23 THR 54 2HG2 THR 54 -3.776 1.765 4.908 398 H VAL 55 H VAL 55 -2.957 5.040 1.606 399 HA VAL 55 HA VAL 55 -2.717 6.768 0.448 400 HB VAL 55 HB VAL 55 -4.803 8.427 1.903 401 HG11 VAL 55 1HG1 VAL 55 -5.017 9.435 -0.375 402 HG12 VAL 55 2HG1 VAL 55 -3.846 8.243 -1.046 403 HG13 VAL 55 3HG1 VAL 55 -3.283 9.486 0.116 404 HG21 VAL 55 3HG2 VAL 55 -5.295 6.217 -0.199 405 HG22 VAL 55 1HG2 VAL 55 -6.490 7.455 0.345 406 HG23 VAL 55 2HG2 VAL 55 -5.885 6.251 1.499 407 H GLY 56 H GLY 56 -3.449 8.149 3.652 408 HA2 GLY 56 2HA GLY 56 -1.889 9.084 5.079 409 HA3 GLY 56 1HA GLY 56 -0.755 9.369 3.696 410 H TYR 57 H TYR 57 -3.154 10.244 2.063 411 HA TYR 57 HA TYR 57 -2.951 13.037 2.675 412 HB2 TYR 57 2HB TYR 57 -4.547 11.465 0.544 413 HB3 TYR 57 1HB TYR 57 -4.773 13.226 0.768 414 HD1 TYR 57 2HD TYR 57 -1.328 13.237 1.211 415 HD2 TYR 57 1HD TYR 57 -4.417 12.503 -1.707 416 HE1 TYR 57 2HE TYR 57 0.021 14.345 -0.510 417 HE2 TYR 57 1HE TYR 57 -3.067 13.616 -3.422 418 HH TYR 57 HH TYR 57 -1.433 15.144 -3.687 419 H GLY 58 H GLY 58 -4.005 12.114 4.958 420 HA2 GLY 58 2HA GLY 58 -6.859 12.117 4.996 421 HA3 GLY 58 1HA GLY 58 -5.747 12.417 6.373 422 H ASP 59 H ASP 59 -4.591 14.519 4.392 423 HA ASP 59 HA ASP 59 -4.650 16.656 3.932 424 HB2 ASP 59 2HB ASP 59 -6.930 16.280 2.974 425 HB3 ASP 59 1HB ASP 59 -7.628 16.725 4.581 426 H ARG 60 H ARG 60 -4.408 15.379 6.761 427 HA ARG 60 HA ARG 60 -4.167 17.890 8.112 428 HB2 ARG 60 2HB ARG 60 -5.762 15.644 9.494 429 HB3 ARG 60 1HB ARG 60 -5.417 17.285 10.125 430 HG2 ARG 60 2HG ARG 60 -6.817 18.260 8.310 431 HG3 ARG 60 1HG ARG 60 -7.238 16.620 7.703 432 HD2 ARG 60 2HD ARG 60 -8.391 16.083 9.832 433 HD3 ARG 60 1HD ARG 60 -7.863 17.651 10.529 434 HE ARG 60 HE ARG 60 -10.122 17.144 8.779 435 HH11 ARG 60 1HH2 ARG 60 -8.014 19.995 8.649 436 HH12 ARG 60 2HH2 ARG 60 -8.895 20.929 9.768 437 HH21 ARG 60 1HH1 ARG 60 -11.629 18.544 9.883 438 HH22 ARG 60 2HH1 ARG 60 -11.075 20.022 10.567 439 H TYR 61 H TYR 61 -3.261 16.981 10.569 440 HA TYR 61 HA TYR 61 -1.663 14.658 10.113 441 HB2 TYR 61 2HB TYR 61 0.354 15.834 11.147 442 HB3 TYR 61 1HB TYR 61 -0.001 16.382 9.472 443 HD1 TYR 61 2HD TYR 61 -0.982 18.660 9.083 444 HD2 TYR 61 1HD TYR 61 0.065 17.329 13.029 445 HE1 TYR 61 2HE TYR 61 -1.171 20.981 9.920 446 HE2 TYR 61 1HE TYR 61 -0.150 19.612 13.877 447 HH TYR 61 HH TYR 61 -0.982 21.700 13.415 448 HA PRO 62 HA PRO 62 -3.061 15.090 14.507 449 HB2 PRO 62 2HB PRO 62 -2.140 12.640 15.481 450 HB3 PRO 62 1HB PRO 62 -3.561 12.705 14.364 451 HG2 PRO 62 2HG PRO 62 -0.641 12.049 13.719 452 HG3 PRO 62 1HG PRO 62 -2.129 11.199 13.136 453 HD2 PRO 62 2HD PRO 62 -0.683 13.234 11.753 454 HD3 PRO 62 1HD PRO 62 -2.427 12.810 11.414 455 H VAL 63 H VAL 63 -1.529 14.878 16.776 456 HA VAL 63 HA VAL 63 1.162 15.618 15.904 457 HB VAL 63 HB VAL 63 0.174 17.580 16.446 458 HG11 VAL 63 1HG1 VAL 63 -0.775 16.490 19.165 459 HG12 VAL 63 2HG1 VAL 63 -1.807 16.815 17.726 460 HG13 VAL 63 3HG1 VAL 63 -0.953 18.157 18.528 461 HG21 VAL 63 3HG2 VAL 63 1.934 16.730 18.843 462 HG22 VAL 63 1HG2 VAL 63 1.641 18.390 18.231 463 HG23 VAL 63 2HG2 VAL 63 2.526 17.203 17.204 464 H THR 64 H THR 64 -0.182 14.586 19.066 465 HA THR 64 HA THR 64 1.463 12.391 19.277 466 HB THR 64 HB THR 64 2.567 14.927 20.633 467 HG1 THR 64 1HG THR 64 3.180 14.072 18.446 468 HG21 THR 64 3HG2 THR 64 2.617 13.116 22.375 469 HG22 THR 64 1HG2 THR 64 4.269 13.470 21.767 470 HG23 THR 64 2HG2 THR 64 3.410 11.995 21.201 471 H GLU 65 H GLU 65 -0.213 15.093 20.877 472 HA GLU 65 HA GLU 65 -0.634 13.539 23.255 473 HB2 GLU 65 2HB GLU 65 -0.103 15.998 23.273 474 HB3 GLU 65 1HB GLU 65 -1.746 16.327 22.628 475 HG2 GLU 65 2HG GLU 65 -2.794 15.377 24.635 476 HG3 GLU 65 1HG GLU 65 -1.230 14.679 25.191 477 H GLU 66 H GLU 66 -2.368 14.210 20.244 478 HA GLU 66 HA GLU 66 -4.938 13.626 21.089 479 HB2 GLU 66 2HB GLU 66 -5.460 13.361 18.719 480 HB3 GLU 66 1HB GLU 66 -4.292 14.676 18.875 481 HG2 GLU 66 2HG GLU 66 -3.767 11.786 17.869 482 HG3 GLU 66 1HG GLU 66 -3.818 13.326 16.920 483 H GLY 67 H GLY 67 -2.143 11.739 20.169 484 HA2 GLY 67 2HA GLY 67 -1.595 9.704 21.191 485 HA3 GLY 67 1HA GLY 67 -3.382 9.292 21.261 486 H ARG 68 H ARG 68 -0.550 9.748 19.125 487 HA ARG 68 HA ARG 68 -1.861 9.895 16.765 488 HB2 ARG 68 2HB ARG 68 0.539 10.330 17.055 489 HB3 ARG 68 1HB ARG 68 0.874 8.575 17.269 490 HG2 ARG 68 2HG ARG 68 0.219 8.090 14.953 491 HG3 ARG 68 1HG ARG 68 -0.422 9.747 14.722 492 HD2 ARG 68 2HD ARG 68 2.570 9.035 15.143 493 HD3 ARG 68 1HD ARG 68 1.767 9.403 13.573 494 HE ARG 68 HE ARG 68 1.856 11.355 15.915 495 HH11 ARG 68 1HH2 ARG 68 2.139 10.816 12.251 496 HH12 ARG 68 2HH2 ARG 68 2.463 12.427 12.030 497 HH21 ARG 68 1HH1 ARG 68 2.279 13.572 15.381 498 HH22 ARG 68 2HH1 ARG 68 2.505 14.029 13.718 499 H LYS 69 H LYS 69 -1.538 7.271 18.827 500 HA LYS 69 HA LYS 69 -2.150 4.983 17.531 501 HB2 LYS 69 2HB LYS 69 -3.452 6.142 20.075 502 HB3 LYS 69 1HB LYS 69 -3.454 4.405 19.615 503 HG2 LYS 69 2HG LYS 69 -0.895 6.027 20.189 504 HG3 LYS 69 1HG LYS 69 -1.761 5.037 21.408 505 HD2 LYS 69 2HD LYS 69 -1.167 2.990 20.411 506 HD3 LYS 69 1HD LYS 69 -1.069 3.704 18.784 507 HE2 LYS 69 2HE LYS 69 1.069 4.980 19.606 508 HE3 LYS 69 1HE LYS 69 1.071 3.809 20.994 509 HZ1 LYS 69 3HZ LYS 69 1.017 2.018 19.287 510 HZ2 LYS 69 1HZ LYS 69 2.396 2.976 19.210 511 HZ3 LYS 69 2HZ LYS 69 1.099 3.206 18.069 512 H VAL 70 H VAL 70 -4.247 7.869 17.896 513 HA VAL 70 HA VAL 70 -6.666 6.553 17.304 514 HB VAL 70 HB VAL 70 -5.835 9.483 17.089 515 HG11 VAL 70 1HG1 VAL 70 -8.648 8.192 16.845 516 HG12 VAL 70 2HG1 VAL 70 -7.779 9.109 15.561 517 HG13 VAL 70 3HG1 VAL 70 -8.325 9.956 17.045 518 HG21 VAL 70 3HG2 VAL 70 -5.806 8.475 19.421 519 HG22 VAL 70 1HG2 VAL 70 -7.497 7.908 19.187 520 HG23 VAL 70 2HG2 VAL 70 -7.121 9.672 19.228 521 H ALA 71 H ALA 71 -4.100 8.029 15.257 522 HA ALA 71 HA ALA 71 -5.708 7.639 12.864 523 HB1 ALA 71 1HB ALA 71 -2.729 8.406 13.192 524 HB2 ALA 71 2HB ALA 71 -4.089 9.556 12.920 525 HB3 ALA 71 3HB ALA 71 -3.648 8.373 11.641 526 H GLU 72 H GLU 72 -2.772 6.311 14.421 527 HA GLU 72 HA GLU 72 -1.939 4.444 12.660 528 HB2 GLU 72 2HB GLU 72 -0.819 5.056 14.845 529 HB3 GLU 72 1HB GLU 72 -2.115 4.174 15.712 530 HG2 GLU 72 2HG GLU 72 -1.327 2.009 14.668 531 HG3 GLU 72 1HG GLU 72 0.038 2.908 13.904 532 H GLN 73 H GLN 73 -4.420 3.918 15.238 533 HA GLN 73 HA GLN 73 -4.682 1.198 14.529 534 HB2 GLN 73 2HB GLN 73 -5.103 2.094 16.812 535 HB3 GLN 73 1HB GLN 73 -6.615 2.870 16.221 536 HG2 GLN 73 2HG GLN 73 -7.611 0.655 15.735 537 HG3 GLN 73 1HG GLN 73 -6.019 -0.155 15.961 538 HE21 GLN 73 1HE2 GLN 73 -5.950 -1.254 17.901 539 HE22 GLN 73 2HE2 GLN 73 -6.734 -0.759 19.371 540 H VAL 74 H VAL 74 -6.234 4.136 13.298 541 HA VAL 74 HA VAL 74 -8.517 2.758 12.243 542 HB VAL 74 HB VAL 74 -7.326 5.515 11.683 543 HG11 VAL 74 1HG1 VAL 74 -9.972 4.252 10.666 544 HG12 VAL 74 2HG1 VAL 74 -8.583 4.813 9.660 545 HG13 VAL 74 3HG1 VAL 74 -9.555 6.007 10.577 546 HG21 VAL 74 3HG2 VAL 74 -9.898 4.696 13.201 547 HG22 VAL 74 1HG2 VAL 74 -9.115 6.316 13.132 548 HG23 VAL 74 2HG2 VAL 74 -8.335 4.970 14.023 549 H MET 75 H MET 75 -5.333 3.903 11.032 550 HA MET 75 HA MET 75 -5.704 3.041 8.399 551 HB2 MET 75 2HB MET 75 -3.089 3.263 10.005 552 HB3 MET 75 1HB MET 75 -3.213 3.102 8.215 553 HG2 MET 75 2HG MET 75 -4.588 5.213 8.160 554 HG3 MET 75 1HG MET 75 -4.315 5.459 9.887 555 HE1 MET 75 3HE MET 75 -0.515 6.265 10.163 556 HE2 MET 75 1HE MET 75 -1.254 4.643 10.365 557 HE3 MET 75 2HE MET 75 -2.097 6.107 10.993 558 H LYS 76 H LYS 76 -4.305 1.335 11.263 559 HA LYS 76 HA LYS 76 -3.578 -0.941 9.813 560 HB2 LYS 76 2HB LYS 76 -2.895 -0.306 12.283 561 HB3 LYS 76 1HB LYS 76 -4.410 -1.142 12.750 562 HG2 LYS 76 2HG LYS 76 -3.414 -3.101 11.165 563 HG3 LYS 76 1HG LYS 76 -1.867 -2.238 11.420 564 HD2 LYS 76 2HD LYS 76 -2.209 -2.567 13.942 565 HD3 LYS 76 1HD LYS 76 -3.720 -3.479 13.558 566 HE2 LYS 76 2HE LYS 76 -2.273 -5.072 12.107 567 HE3 LYS 76 1HE LYS 76 -0.818 -4.226 12.758 568 HZ1 LYS 76 3HZ LYS 76 -1.980 -4.924 15.045 569 HZ2 LYS 76 1HZ LYS 76 -0.942 -5.921 14.133 570 HZ3 LYS 76 2HZ LYS 76 -2.644 -6.120 14.054 571 H ALA 77 H ALA 77 -6.692 0.002 11.250 572 HA ALA 77 HA ALA 77 -7.893 -2.540 11.207 573 HB1 ALA 77 1HB ALA 77 -8.918 -0.576 12.426 574 HB2 ALA 77 2HB ALA 77 -10.075 -1.324 11.265 575 HB3 ALA 77 3HB ALA 77 -9.239 0.217 10.841 576 H GLY 78 H GLY 78 -7.426 -0.028 8.735 577 HA2 GLY 78 2HA GLY 78 -9.156 -1.086 6.783 578 HA3 GLY 78 1HA GLY 78 -7.732 0.004 6.566 579 H ILE 79 H ILE 79 -5.704 -1.591 7.535 580 HA ILE 79 HA ILE 79 -5.121 -3.188 5.329 581 HB ILE 79 HB ILE 79 -3.885 -3.304 8.127 582 HG12 ILE 79 2HG1 ILE 79 -3.754 -1.004 7.173 583 HG13 ILE 79 1HG1 ILE 79 -2.157 -1.791 7.302 584 HG21 ILE 79 1HG2 ILE 79 -1.860 -4.217 6.882 585 HG22 ILE 79 2HG2 ILE 79 -2.870 -4.356 5.398 586 HG23 ILE 79 3HG2 ILE 79 -3.270 -5.329 6.856 587 HD11 ILE 79 3HD ILE 79 -3.792 -1.449 4.695 588 HD12 ILE 79 1HD ILE 79 -2.326 -0.537 5.183 589 HD13 ILE 79 2HD ILE 79 -2.197 -2.286 4.818 590 H GLU 80 H GLU 80 -6.322 -4.095 8.639 591 HA GLU 80 HA GLU 80 -6.241 -6.843 8.092 592 HB2 GLU 80 2HB GLU 80 -8.168 -5.394 10.004 593 HB3 GLU 80 1HB GLU 80 -7.878 -7.167 9.925 594 HG2 GLU 80 2HG GLU 80 -5.368 -6.627 10.409 595 HG3 GLU 80 1HG GLU 80 -5.925 -4.971 10.862 596 H VAL 81 H VAL 81 -8.824 -4.439 7.477 597 HA VAL 81 HA VAL 81 -10.768 -6.345 6.713 598 HB VAL 81 HB VAL 81 -10.408 -3.355 6.230 599 HG11 VAL 81 1HG1 VAL 81 -12.833 -3.369 5.441 600 HG12 VAL 81 2HG1 VAL 81 -12.739 -5.161 5.291 601 HG13 VAL 81 3HG1 VAL 81 -11.693 -4.104 4.271 602 HG21 VAL 81 3HG2 VAL 81 -10.900 -4.193 8.576 603 HG22 VAL 81 1HG2 VAL 81 -12.365 -5.038 7.957 604 HG23 VAL 81 2HG2 VAL 81 -12.267 -3.245 7.911 605 H PHE 82 H PHE 82 -8.552 -4.237 4.727 606 HA PHE 82 HA PHE 82 -9.482 -5.487 2.350 607 HB2 PHE 82 2HB PHE 82 -7.034 -3.676 2.825 608 HB3 PHE 82 1HB PHE 82 -7.590 -4.230 1.197 609 HD1 PHE 82 1HD PHE 82 -10.354 -3.960 0.961 610 HD2 PHE 82 2HD PHE 82 -7.696 -1.466 3.253 611 HE1 PHE 82 1HE PHE 82 -11.986 -2.125 0.856 612 HE2 PHE 82 2HE PHE 82 -9.321 0.381 3.120 613 HZ PHE 82 HZ PHE 82 -11.474 0.067 1.926 614 H ALA 83 H ALA 83 -6.985 -6.365 4.641 615 HA ALA 83 HA ALA 83 -5.681 -8.097 2.761 616 HB1 ALA 83 1HB ALA 83 -4.436 -7.120 4.705 617 HB2 ALA 83 2HB ALA 83 -4.360 -8.901 4.662 618 HB3 ALA 83 3HB ALA 83 -5.470 -8.079 5.827 619 H LEU 84 H LEU 84 -8.319 -8.370 5.193 620 HA LEU 84 HA LEU 84 -8.263 -11.149 5.384 621 HB2 LEU 84 2HB LEU 84 -9.496 -9.764 7.018 622 HB3 LEU 84 1HB LEU 84 -10.620 -9.216 5.735 623 HG LEU 84 HG LEU 84 -11.529 -11.508 5.497 624 HD11 LEU 84 1HD1 LEU 84 -10.928 -13.381 6.965 625 HD12 LEU 84 2HD1 LEU 84 -9.690 -12.376 7.829 626 HD13 LEU 84 3HD1 LEU 84 -9.468 -12.844 6.103 627 HD21 LEU 84 3HD2 LEU 84 -12.523 -9.904 7.147 628 HD22 LEU 84 1HD2 LEU 84 -11.512 -10.628 8.454 629 HD23 LEU 84 2HD2 LEU 84 -12.767 -11.623 7.618 630 H VAL 85 H VAL 85 -9.879 -8.982 3.054 631 HA VAL 85 HA VAL 85 -11.458 -11.000 1.922 632 HB VAL 85 HB VAL 85 -11.970 -9.503 0.133 633 HG11 VAL 85 1HG1 VAL 85 -12.885 -7.670 1.473 634 HG12 VAL 85 2HG1 VAL 85 -11.598 -7.815 2.707 635 HG13 VAL 85 3HG1 VAL 85 -12.831 -9.106 2.561 636 HG21 VAL 85 3HG2 VAL 85 -9.635 -8.626 -0.382 637 HG22 VAL 85 1HG2 VAL 85 -9.685 -7.703 1.166 638 HG23 VAL 85 2HG2 VAL 85 -10.826 -7.306 -0.157 639 H THR 86 H THR 86 -8.059 -10.728 1.797 640 HA THR 86 HA THR 86 -7.497 -11.457 -0.807 641 HB THR 86 HB THR 86 -5.927 -12.326 1.663 642 HG1 THR 86 1HG THR 86 -5.990 -10.224 1.787 643 HG21 THR 86 3HG2 THR 86 -5.163 -13.473 -0.453 644 HG22 THR 86 1HG2 THR 86 -3.976 -12.227 0.045 645 HG23 THR 86 2HG2 THR 86 -5.111 -11.886 -1.307 646 H ALA 87 H ALA 87 -8.951 -13.348 1.774 647 HA ALA 87 HA ALA 87 -8.415 -15.908 0.742 648 HB1 ALA 87 1HB ALA 87 -9.384 -15.565 3.016 649 HB2 ALA 87 2HB ALA 87 -10.432 -16.648 2.035 650 HB3 ALA 87 3HB ALA 87 -10.895 -14.916 2.283 651 H ALA 88 H ALA 88 -10.714 -13.395 -0.294 652 HA ALA 88 HA ALA 88 -12.304 -15.206 -1.888 653 HB1 ALA 88 1HB ALA 88 -13.370 -13.127 -2.785 654 HB2 ALA 88 2HB ALA 88 -12.159 -12.121 -1.913 655 HB3 ALA 88 3HB ALA 88 -13.354 -13.093 -0.984 656 H LEU 89 H LEU 89 -9.618 -12.855 -2.282 657 HA LEU 89 HA LEU 89 -9.566 -13.022 -5.088 658 HB2 LEU 89 2HB LEU 89 -7.379 -12.186 -3.091 659 HB3 LEU 89 1HB LEU 89 -7.132 -12.194 -4.860 660 HG LEU 89 HG LEU 89 -7.544 -9.968 -4.207 661 HD11 LEU 89 1HD1 LEU 89 -10.108 -10.947 -5.622 662 HD12 LEU 89 2HD1 LEU 89 -8.492 -10.723 -6.399 663 HD13 LEU 89 3HD1 LEU 89 -9.363 -9.312 -5.696 664 HD21 LEU 89 3HD2 LEU 89 -9.591 -9.073 -3.188 665 HD22 LEU 89 1HD2 LEU 89 -8.786 -10.231 -2.082 666 HD23 LEU 89 2HD2 LEU 89 -10.272 -10.723 -2.983 667 H ALA 90 H ALA 90 -7.980 -14.939 -2.556 668 HA ALA 90 HA ALA 90 -6.213 -16.234 -4.290 669 HB1 ALA 90 1HB ALA 90 -5.932 -16.195 -1.809 670 HB2 ALA 90 2HB ALA 90 -5.898 -17.874 -2.457 671 HB3 ALA 90 3HB ALA 90 -7.385 -17.244 -1.637 672 H THR 91 H THR 91 -9.664 -16.920 -3.604 673 HA THR 91 HA THR 91 -9.351 -19.533 -4.818 674 HB THR 91 HB THR 91 -10.775 -19.328 -2.878 675 HG1 THR 91 1HG THR 91 -11.981 -20.096 -5.296 676 HG21 THR 91 3HG2 THR 91 -12.609 -17.621 -4.693 677 HG22 THR 91 1HG2 THR 91 -11.771 -17.113 -3.183 678 HG23 THR 91 2HG2 THR 91 -13.077 -18.339 -3.105 679 H ASP 92 H ASP 92 -9.227 -16.515 -6.136 680 HA ASP 92 HA ASP 92 -11.223 -16.724 -8.093 681 HB2 ASP 92 2HB ASP 92 -9.992 -14.559 -7.364 682 HB3 ASP 92 1HB ASP 92 -8.674 -15.049 -8.483 683 H PHE 93 H PHE 93 -7.707 -17.502 -8.132 684 HA PHE 93 HA PHE 93 -7.776 -18.335 -10.822 685 HB2 PHE 93 2HB PHE 93 -5.562 -19.087 -10.644 686 HB3 PHE 93 1HB PHE 93 -5.626 -17.725 -9.482 687 HD1 PHE 93 1HD PHE 93 -5.688 -18.248 -6.999 688 HD2 PHE 93 2HD PHE 93 -5.215 -21.362 -9.918 689 HE1 PHE 93 1HE PHE 93 -4.913 -19.784 -5.233 690 HE2 PHE 93 2HE PHE 93 -4.506 -22.919 -8.143 691 HZ PHE 93 HZ PHE 93 -4.312 -22.127 -5.795 692 H VAL 94 H VAL 94 -8.655 -19.946 -7.845 693 HA VAL 94 HA VAL 94 -8.181 -22.590 -8.577 694 HB VAL 94 HB VAL 94 -10.275 -21.470 -6.637 695 HG11 VAL 94 1HG1 VAL 94 -9.990 -23.714 -5.480 696 HG12 VAL 94 2HG1 VAL 94 -8.974 -24.276 -6.858 697 HG13 VAL 94 3HG1 VAL 94 -10.713 -23.884 -7.118 698 HG21 VAL 94 3HG2 VAL 94 -8.480 -21.799 -4.924 699 HG22 VAL 94 1HG2 VAL 94 -7.918 -20.641 -6.163 700 HG23 VAL 94 2HG2 VAL 94 -7.329 -22.336 -6.200 701 H ARG 95 H ARG 95 -10.750 -20.350 -9.291 702 HA ARG 95 HA ARG 95 -12.772 -22.033 -10.157 703 HB2 ARG 95 2HB ARG 95 -12.684 -19.463 -9.685 704 HB3 ARG 95 1HB ARG 95 -12.007 -19.288 -11.328 705 HG2 ARG 95 2HG ARG 95 -14.155 -20.431 -12.194 706 HG3 ARG 95 1HG ARG 95 -14.779 -20.383 -10.518 707 HD2 ARG 95 2HD ARG 95 -14.110 -17.983 -12.370 708 HD3 ARG 95 1HD ARG 95 -15.722 -18.501 -11.756 709 HE ARG 95 HE ARG 95 -15.097 -17.845 -9.497 710 HH11 ARG 95 1HH2 ARG 95 -12.632 -16.777 -11.988 711 HH12 ARG 95 2HH2 ARG 95 -11.811 -15.766 -10.897 712 HH21 ARG 95 1HH1 ARG 95 -14.240 -15.869 -8.260 713 HH22 ARG 95 2HH1 ARG 95 -12.892 -15.045 -8.950 714 H ARG 96 H ARG 96 -9.623 -21.380 -11.580 715 HA ARG 96 HA ARG 96 -10.207 -21.724 -14.288 716 HB2 ARG 96 2HB ARG 96 -7.914 -22.002 -14.754 717 HB3 ARG 96 1HB ARG 96 -7.910 -20.938 -13.315 718 HG2 ARG 96 2HG ARG 96 -7.414 -23.039 -11.896 719 HG3 ARG 96 1HG ARG 96 -7.332 -23.973 -13.436 720 HD2 ARG 96 2HD ARG 96 -5.373 -22.453 -14.143 721 HD3 ARG 96 1HD ARG 96 -5.341 -21.845 -12.429 722 HE ARG 96 HE ARG 96 -5.426 -24.757 -12.394 723 HH11 ARG 96 1HH2 ARG 96 -2.877 -22.261 -12.959 724 HH12 ARG 96 2HH2 ARG 96 -1.834 -23.362 -13.773 725 HH21 ARG 96 1HH1 ARG 96 -3.850 -26.215 -12.795 726 HH22 ARG 96 2HH1 ARG 96 -2.243 -25.808 -13.308 727 H GLU 97 H GLU 97 -9.778 -24.047 -11.597 728 HA GLU 97 HA GLU 97 -9.205 -26.173 -13.444 729 HB2 GLU 97 2HB GLU 97 -9.818 -26.231 -10.437 730 HB3 GLU 97 1HB GLU 97 -9.369 -27.678 -11.397 731 HG2 GLU 97 2HG GLU 97 -7.580 -25.199 -11.019 732 HG3 GLU 97 1HG GLU 97 -7.441 -26.739 -10.117 733 H GLU 98 H GLU 98 -12.019 -24.682 -12.214 734 HA GLU 98 HA GLU 98 -13.788 -26.896 -12.649 735 HB2 GLU 98 2HB GLU 98 -14.329 -23.883 -12.277 736 HB3 GLU 98 1HB GLU 98 -15.554 -25.185 -12.173 737 HG2 GLU 98 2HG GLU 98 -14.439 -26.137 -10.160 738 HG3 GLU 98 1HG GLU 98 -13.083 -24.961 -10.293 739 H GLU 99 H GLU 99 -12.557 -24.030 -14.357 740 HA GLU 99 HA GLU 99 -14.295 -23.964 -16.511 741 HB2 GLU 99 2HB GLU 99 -12.524 -22.246 -15.622 742 HB3 GLU 99 1HB GLU 99 -11.335 -23.101 -16.642 743 HG2 GLU 99 2HG GLU 99 -13.972 -21.903 -17.751 744 HG3 GLU 99 1HG GLU 99 -12.492 -20.919 -17.482 745 H ARG 100 H ARG 100 -11.172 -25.589 -16.019 746 HA ARG 100 HA ARG 100 -10.905 -26.524 -18.628 747 HB2 ARG 100 2HB ARG 100 -9.714 -27.645 -16.030 748 HB3 ARG 100 1HB ARG 100 -9.145 -28.064 -17.681 749 HG2 ARG 100 2HG ARG 100 -8.449 -25.755 -18.121 750 HG3 ARG 100 1HG ARG 100 -9.166 -25.169 -16.612 751 HD2 ARG 100 2HD ARG 100 -6.730 -25.372 -16.290 752 HD3 ARG 100 1HD ARG 100 -7.572 -26.605 -15.265 753 HE ARG 100 HE ARG 100 -6.580 -27.252 -18.040 754 HH11 ARG 100 1HH2 ARG 100 -6.392 -28.022 -14.438 755 HH12 ARG 100 2HH2 ARG 100 -5.255 -29.267 -14.700 756 HH21 ARG 100 1HH1 ARG 100 -5.132 -29.019 -18.287 757 HH22 ARG 100 2HH1 ARG 100 -4.550 -29.895 -16.946 758 H ARG 101 H ARG 101 -13.129 -27.648 -16.301 759 HA ARG 101 HA ARG 101 -13.387 -30.195 -17.792 760 HB2 ARG 101 2HB ARG 101 -14.457 -29.653 -14.969 761 HB3 ARG 101 1HB ARG 101 -14.418 -31.222 -15.849 762 HG2 ARG 101 2HG ARG 101 -12.024 -29.590 -14.796 763 HG3 ARG 101 1HG ARG 101 -12.682 -31.078 -14.043 764 HD2 ARG 101 2HD ARG 101 -11.837 -32.509 -15.818 765 HD3 ARG 101 1HD ARG 101 -11.505 -31.101 -16.912 766 HE ARG 101 HE ARG 101 -10.013 -30.603 -14.549 767 HH11 ARG 101 1HH2 ARG 101 -9.966 -32.875 -17.378 768 HH12 ARG 101 2HH2 ARG 101 -8.285 -32.858 -17.480 769 HH21 ARG 101 1HH1 ARG 101 -7.755 -30.750 -14.634 770 HH22 ARG 101 2HH1 ARG 101 -6.942 -31.773 -15.767 771 H GLY 102 H GLY 102 -14.600 -27.048 -17.235 772 HA2 GLY 102 2HA GLY 102 -16.402 -26.008 -17.868 773 HA3 GLY 102 1HA GLY 102 -16.903 -27.499 -18.759 774 H HIS 103 H HIS 103 -16.251 -27.249 -15.305 775 HA HIS 103 HA HIS 103 -18.966 -28.349 -14.840 776 HB2 HIS 103 2HB HIS 103 -17.019 -29.811 -14.261 777 HB3 HIS 103 1HB HIS 103 -16.365 -28.533 -13.194 778 HD1 HIS 103 1HD HIS 103 -18.017 -27.983 -11.033 779 HD2 HIS 103 2HD HIS 103 -18.643 -31.646 -13.029 780 HE1 HIS 103 1HE HIS 103 -19.154 -29.562 -9.411 781 HE2 HIS 103 2HE HIS 103 -19.521 -31.742 -10.632 782 H1 SER 1 H SER 1 -4.060 -16.528 -24.765 783 HA SER 1 HA SER 1 -1.873 -18.203 -23.819 784 HB2 SER 1 2HB SER 1 -1.179 -15.685 -22.869 785 HB3 SER 1 1HB SER 1 -0.534 -16.405 -24.378 786 HG SER 1 1HG SER 1 -2.931 -14.863 -24.337 787 H ALA 2 H ALA 2 -2.767 -19.197 -22.062 788 HA ALA 2 HA ALA 2 -3.823 -19.570 -20.234 789 HB1 ALA 2 1HB ALA 2 -3.153 -16.688 -19.436 790 HB2 ALA 2 2HB ALA 2 -2.015 -18.066 -19.333 791 HB3 ALA 2 3HB ALA 2 -3.476 -18.067 -18.306 792 H ASP 3 H ASP 3 -5.292 -17.861 -18.455 793 HA ASP 3 HA ASP 3 -7.660 -17.061 -19.984 794 HB2 ASP 3 2HB ASP 3 -8.902 -18.011 -17.767 795 HB3 ASP 3 1HB ASP 3 -8.588 -19.055 -19.179 796 H HIS 4 H HIS 4 -6.527 -17.386 -16.683 797 HA HIS 4 HA HIS 4 -7.427 -15.084 -15.635 798 HB2 HIS 4 2HB HIS 4 -5.688 -15.321 -13.797 799 HB3 HIS 4 1HB HIS 4 -6.626 -16.799 -14.147 800 HD1 HIS 4 1HD HIS 4 -5.392 -18.680 -15.612 801 HD2 HIS 4 2HD HIS 4 -2.921 -15.432 -14.634 802 HE1 HIS 4 1HE HIS 4 -2.996 -19.379 -16.089 803 HE2 HIS 4 2HE HIS 4 -1.653 -17.238 -15.872 804 H GLU 5 H GLU 5 -4.457 -15.248 -17.595 805 HA GLU 5 HA GLU 5 -3.420 -12.778 -16.579 806 HB2 GLU 5 2HB GLU 5 -2.702 -14.573 -18.954 807 HB3 GLU 5 1HB GLU 5 -1.870 -13.017 -18.661 808 HG2 GLU 5 2HG GLU 5 -0.741 -13.711 -16.788 809 HG3 GLU 5 1HG GLU 5 -2.026 -14.830 -16.256 810 H ARG 6 H ARG 6 -5.858 -13.627 -18.933 811 HA ARG 6 HA ARG 6 -5.579 -11.203 -20.462 812 HB2 ARG 6 2HB ARG 6 -6.482 -13.453 -21.338 813 HB3 ARG 6 1HB ARG 6 -7.927 -13.204 -20.310 814 HG2 ARG 6 2HG ARG 6 -8.389 -11.051 -21.618 815 HG3 ARG 6 1HG ARG 6 -6.968 -11.450 -22.656 816 HD2 ARG 6 2HD ARG 6 -8.094 -13.675 -23.249 817 HD3 ARG 6 1HD ARG 6 -9.549 -13.141 -22.300 818 HE ARG 6 HE ARG 6 -8.831 -11.094 -24.259 819 HH11 ARG 6 1HH2 ARG 6 -10.366 -14.371 -24.034 820 HH12 ARG 6 2HH2 ARG 6 -10.851 -14.388 -25.685 821 HH21 ARG 6 1HH1 ARG 6 -9.714 -11.020 -26.332 822 HH22 ARG 6 2HH1 ARG 6 -10.593 -12.334 -27.034 823 H GLU 7 H GLU 7 -7.626 -12.574 -17.844 824 HA GLU 7 HA GLU 7 -9.375 -10.374 -17.839 825 HB2 GLU 7 2HB GLU 7 -9.816 -12.776 -17.068 826 HB3 GLU 7 1HB GLU 7 -9.070 -12.321 -15.500 827 HG2 GLU 7 2HG GLU 7 -10.815 -10.613 -15.117 828 HG3 GLU 7 1HG GLU 7 -11.372 -10.732 -16.828 829 H ALA 8 H ALA 8 -6.393 -11.127 -16.098 830 HA ALA 8 HA ALA 8 -6.422 -9.063 -14.252 831 HB1 ALA 8 1HB ALA 8 -4.658 -10.857 -14.272 832 HB2 ALA 8 2HB ALA 8 -3.897 -9.227 -14.325 833 HB3 ALA 8 3HB ALA 8 -4.016 -10.209 -15.828 834 H GLN 9 H GLN 9 -5.432 -9.060 -17.699 835 HA GLN 9 HA GLN 9 -4.398 -6.421 -17.591 836 HB2 GLN 9 2HB GLN 9 -3.775 -8.291 -19.218 837 HB3 GLN 9 1HB GLN 9 -5.312 -7.971 -20.086 838 HG2 GLN 9 2HG GLN 9 -4.533 -5.611 -20.558 839 HG3 GLN 9 1HG GLN 9 -3.053 -5.905 -19.574 840 HE21 GLN 9 1HE2 GLN 9 -4.151 -5.917 -22.772 841 HE22 GLN 9 2HE2 GLN 9 -3.037 -7.047 -23.468 842 H LYS 10 H LYS 10 -7.541 -7.856 -18.249 843 HA LYS 10 HA LYS 10 -8.737 -5.626 -19.465 844 HB2 LYS 10 2HB LYS 10 -9.545 -8.114 -19.351 845 HB3 LYS 10 1HB LYS 10 -10.150 -7.708 -17.717 846 HG2 LYS 10 2HG LYS 10 -11.454 -5.746 -18.954 847 HG3 LYS 10 1HG LYS 10 -10.998 -6.586 -20.470 848 HD2 LYS 10 2HD LYS 10 -13.234 -7.228 -19.864 849 HD3 LYS 10 1HD LYS 10 -12.201 -8.678 -19.596 850 HE2 LYS 10 2HE LYS 10 -12.237 -8.338 -17.141 851 HE3 LYS 10 1HE LYS 10 -12.892 -6.670 -17.346 852 HZ1 LYS 10 3HZ LYS 10 -14.938 -7.632 -18.203 853 HZ2 LYS 10 1HZ LYS 10 -14.522 -8.021 -16.583 854 HZ3 LYS 10 2HZ LYS 10 -14.384 -9.211 -17.800 855 H ALA 11 H ALA 11 -8.222 -6.579 -16.066 856 HA ALA 11 HA ALA 11 -9.954 -4.690 -14.915 857 HB1 ALA 11 1HB ALA 11 -8.707 -5.089 -12.798 858 HB2 ALA 11 2HB ALA 11 -7.399 -5.928 -13.713 859 HB3 ALA 11 3HB ALA 11 -9.054 -6.641 -13.634 860 H GLU 12 H GLU 12 -6.542 -4.477 -16.023 861 HA GLU 12 HA GLU 12 -5.984 -2.017 -14.798 862 HB2 GLU 12 2HB GLU 12 -4.872 -2.998 -17.502 863 HB3 GLU 12 1HB GLU 12 -4.238 -1.652 -16.492 864 HG2 GLU 12 2HG GLU 12 -3.798 -3.433 -14.636 865 HG3 GLU 12 1HG GLU 12 -4.132 -4.678 -15.900 866 H GLU 13 H GLU 13 -7.614 -2.853 -17.839 867 HA GLU 13 HA GLU 13 -7.603 -0.256 -18.934 868 HB2 GLU 13 2HB GLU 13 -7.953 -2.374 -20.263 869 HB3 GLU 13 1HB GLU 13 -9.544 -2.581 -19.458 870 HG2 GLU 13 2HG GLU 13 -9.881 -1.698 -21.714 871 HG3 GLU 13 1HG GLU 13 -10.322 -0.411 -20.532 872 H GLU 14 H GLU 14 -9.778 -1.959 -16.650 873 HA GLU 14 HA GLU 14 -11.876 -0.090 -16.769 874 HB2 GLU 14 2HB GLU 14 -12.298 -2.253 -15.640 875 HB3 GLU 14 1HB GLU 14 -11.078 -1.864 -14.378 876 HG2 GLU 14 2HG GLU 14 -12.456 0.010 -13.533 877 HG3 GLU 14 1HG GLU 14 -13.610 -0.171 -14.894 878 H LEU 15 H LEU 15 -8.868 -0.234 -14.835 879 HA LEU 15 HA LEU 15 -9.552 1.863 -13.154 880 HB2 LEU 15 2HB LEU 15 -7.641 0.242 -12.786 881 HB3 LEU 15 1HB LEU 15 -6.707 1.096 -14.051 882 HG LEU 15 HG LEU 15 -6.633 3.145 -12.681 883 HD11 LEU 15 1HD1 LEU 15 -8.822 3.195 -11.596 884 HD12 LEU 15 2HD1 LEU 15 -7.585 3.156 -10.309 885 HD13 LEU 15 3HD1 LEU 15 -8.489 1.656 -10.715 886 HD21 LEU 15 3HD2 LEU 15 -5.950 0.647 -10.990 887 HD22 LEU 15 1HD2 LEU 15 -5.280 2.300 -10.754 888 HD23 LEU 15 2HD2 LEU 15 -4.911 1.390 -12.262 889 H GLN 16 H GLN 16 -7.976 1.867 -16.341 890 HA GLN 16 HA GLN 16 -7.302 4.584 -16.409 891 HB2 GLN 16 2HB GLN 16 -8.122 2.810 -18.788 892 HB3 GLN 16 1HB GLN 16 -7.287 4.399 -18.889 893 HG2 GLN 16 2HG GLN 16 -5.354 3.394 -17.534 894 HG3 GLN 16 1HG GLN 16 -6.143 1.785 -17.679 895 HE21 GLN 16 1HE2 GLN 16 -7.036 1.560 -20.298 896 HE22 GLN 16 2HE2 GLN 16 -5.724 1.713 -21.368 897 H LYS 17 H LYS 17 -10.373 2.915 -17.161 898 HA LYS 17 HA LYS 17 -11.657 5.116 -18.370 899 HB2 LYS 17 2HB LYS 17 -12.559 2.740 -18.439 900 HB3 LYS 17 1HB LYS 17 -12.890 2.845 -16.684 901 HG2 LYS 17 2HG LYS 17 -14.514 4.817 -17.225 902 HG3 LYS 17 1HG LYS 17 -14.216 4.449 -18.951 903 HD2 LYS 17 2HD LYS 17 -16.245 3.302 -18.454 904 HD3 LYS 17 1HD LYS 17 -14.982 2.035 -18.440 905 HE2 LYS 17 2HE LYS 17 -16.354 1.533 -16.545 906 HE3 LYS 17 1HE LYS 17 -14.907 2.330 -15.828 907 HZ1 LYS 17 3HZ LYS 17 -16.331 4.456 -15.808 908 HZ2 LYS 17 1HZ LYS 17 -16.786 3.178 -14.795 909 HZ3 LYS 17 2HZ LYS 17 -17.624 3.473 -16.249 910 H VAL 18 H VAL 18 -11.430 3.982 -14.973 911 HA VAL 18 HA VAL 18 -13.214 5.868 -13.919 912 HB VAL 18 HB VAL 18 -10.894 4.390 -12.571 913 HG11 VAL 18 1HG1 VAL 18 -12.198 4.808 -10.439 914 HG12 VAL 18 2HG1 VAL 18 -13.321 5.886 -11.352 915 HG13 VAL 18 3HG1 VAL 18 -11.582 6.329 -11.163 916 HG21 VAL 18 3HG2 VAL 18 -12.718 2.813 -11.840 917 HG22 VAL 18 1HG2 VAL 18 -12.608 2.861 -13.625 918 HG23 VAL 18 2HG2 VAL 18 -13.925 3.755 -12.791 919 H LEU 19 H LEU 19 -9.671 5.988 -14.510 920 HA LEU 19 HA LEU 19 -9.131 8.379 -13.216 921 HB2 LEU 19 2HB LEU 19 -7.949 7.420 -15.909 922 HB3 LEU 19 1HB LEU 19 -7.287 8.755 -14.918 923 HG LEU 19 HG LEU 19 -7.410 5.809 -14.057 924 HD11 LEU 19 1HD1 LEU 19 -5.794 6.234 -15.928 925 HD12 LEU 19 2HD1 LEU 19 -4.955 5.829 -14.385 926 HD13 LEU 19 3HD1 LEU 19 -5.017 7.538 -14.954 927 HD21 LEU 19 3HD2 LEU 19 -7.524 7.217 -12.056 928 HD22 LEU 19 1HD2 LEU 19 -6.259 8.317 -12.704 929 HD23 LEU 19 2HD2 LEU 19 -5.826 6.639 -12.230 930 H GLU 20 H GLU 20 -10.286 7.774 -16.540 931 HA GLU 20 HA GLU 20 -10.108 10.444 -17.379 932 HB2 GLU 20 2HB GLU 20 -11.654 8.030 -18.470 933 HB3 GLU 20 1HB GLU 20 -11.539 9.600 -19.337 934 HG2 GLU 20 2HG GLU 20 -9.095 9.429 -19.509 935 HG3 GLU 20 1HG GLU 20 -9.064 7.938 -18.508 936 H GLU 21 H GLU 21 -12.771 8.494 -15.985 937 HA GLU 21 HA GLU 21 -14.682 10.591 -16.336 938 HB2 GLU 21 2HB GLU 21 -14.797 8.125 -14.516 939 HB3 GLU 21 1HB GLU 21 -16.159 9.249 -14.875 940 HG2 GLU 21 2HG GLU 21 -15.823 8.746 -17.364 941 HG3 GLU 21 1HG GLU 21 -14.652 7.465 -16.921 942 H ALA 22 H ALA 22 -12.460 9.581 -13.742 943 HA ALA 22 HA ALA 22 -13.424 11.282 -11.772 944 HB1 ALA 22 1HB ALA 22 -11.827 9.456 -11.274 945 HB2 ALA 22 2HB ALA 22 -11.164 11.037 -10.708 946 HB3 ALA 22 3HB ALA 22 -10.560 10.280 -12.228 947 H SER 23 H SER 23 -11.033 11.925 -14.453 948 HA SER 23 HA SER 23 -10.382 14.456 -13.459 949 HB2 SER 23 2HB SER 23 -9.947 14.894 -16.114 950 HB3 SER 23 1HB SER 23 -8.863 13.941 -15.054 951 HG SER 23 1HG SER 23 -10.936 12.792 -16.630 952 H LYS 24 H LYS 24 -13.315 13.433 -15.187 953 HA LYS 24 HA LYS 24 -13.966 16.122 -16.003 954 HB2 LYS 24 2HB LYS 24 -14.966 14.148 -17.214 955 HB3 LYS 24 1HB LYS 24 -15.799 13.649 -15.707 956 HG2 LYS 24 2HG LYS 24 -17.062 15.835 -15.698 957 HG3 LYS 24 1HG LYS 24 -16.232 16.311 -17.216 958 HD2 LYS 24 2HD LYS 24 -17.350 14.474 -18.436 959 HD3 LYS 24 1HD LYS 24 -18.052 13.830 -16.905 960 HE2 LYS 24 2HE LYS 24 -19.412 15.833 -16.565 961 HE3 LYS 24 1HE LYS 24 -18.634 16.692 -17.946 962 HZ1 LYS 24 3HZ LYS 24 -20.848 15.787 -18.384 963 HZ2 LYS 24 1HZ LYS 24 -20.276 14.207 -18.204 964 HZ3 LYS 24 2HZ LYS 24 -19.710 15.183 -19.479 965 H LYS 25 H LYS 25 -15.057 13.794 -13.533 966 HA LYS 25 HA LYS 25 -16.793 15.447 -12.145 967 HB2 LYS 25 2HB LYS 25 -15.088 13.007 -11.366 968 HB3 LYS 25 1HB LYS 25 -16.179 13.774 -10.166 969 HG2 LYS 25 2HG LYS 25 -17.232 12.854 -12.898 970 HG3 LYS 25 1HG LYS 25 -17.092 11.736 -11.499 971 HD2 LYS 25 2HD LYS 25 -18.562 13.037 -10.124 972 HD3 LYS 25 1HD LYS 25 -18.549 14.435 -11.253 973 HE2 LYS 25 2HE LYS 25 -19.821 13.172 -12.962 974 HE3 LYS 25 1HE LYS 25 -19.780 11.679 -11.932 975 HZ1 LYS 25 3HZ LYS 25 -21.057 12.759 -10.284 976 HZ2 LYS 25 1HZ LYS 25 -21.875 12.996 -11.718 977 HZ3 LYS 25 2HZ LYS 25 -20.972 14.261 -10.985 978 H ALA 26 H ALA 26 -13.287 14.793 -11.555 979 HA ALA 26 HA ALA 26 -13.110 16.094 -9.167 980 HB1 ALA 26 1HB ALA 26 -10.665 16.296 -9.570 981 HB2 ALA 26 2HB ALA 26 -10.912 15.931 -11.322 982 HB3 ALA 26 3HB ALA 26 -11.260 14.680 -10.071 983 H VAL 27 H VAL 27 -12.723 17.516 -12.463 984 HA VAL 27 HA VAL 27 -11.901 20.038 -11.508 985 HB VAL 27 HB VAL 27 -13.371 19.256 -14.092 986 HG11 VAL 27 1HG1 VAL 27 -13.713 21.699 -13.732 987 HG12 VAL 27 2HG1 VAL 27 -12.451 21.461 -14.987 988 HG13 VAL 27 3HG1 VAL 27 -11.972 21.914 -13.305 989 HG21 VAL 27 3HG2 VAL 27 -10.391 19.853 -13.484 990 HG22 VAL 27 1HG2 VAL 27 -11.088 19.362 -15.075 991 HG23 VAL 27 2HG2 VAL 27 -11.088 18.216 -13.697 992 H GLU 28 H GLU 28 -15.155 18.682 -12.318 993 HA GLU 28 HA GLU 28 -16.284 21.268 -11.842 994 HB2 GLU 28 2HB GLU 28 -16.965 19.264 -13.504 995 HB3 GLU 28 1HB GLU 28 -18.141 18.930 -12.199 996 HG2 GLU 28 2HG GLU 28 -19.185 21.115 -12.485 997 HG3 GLU 28 1HG GLU 28 -17.743 21.775 -13.331 998 H ALA 29 H ALA 29 -15.615 18.466 -9.921 999 HA ALA 29 HA ALA 29 -17.389 18.985 -7.811 1000 HB1 ALA 29 1HB ALA 29 -16.182 16.784 -8.192 1001 HB2 ALA 29 2HB ALA 29 -16.000 17.409 -6.539 1002 HB3 ALA 29 3HB ALA 29 -14.640 17.586 -7.712 1003 H GLU 30 H GLU 30 -13.905 19.830 -8.384 1004 HA GLU 30 HA GLU 30 -13.699 21.297 -6.014 1005 HB2 GLU 30 2HB GLU 30 -12.008 21.159 -8.559 1006 HB3 GLU 30 1HB GLU 30 -11.559 22.239 -7.199 1007 HG2 GLU 30 2HG GLU 30 -11.998 19.205 -6.835 1008 HG3 GLU 30 1HG GLU 30 -10.405 19.981 -7.142 1009 H ARG 31 H ARG 31 -15.023 22.246 -9.081 1010 HA ARG 31 HA ARG 31 -14.569 25.045 -8.726 1011 HB2 ARG 31 2HB ARG 31 -16.629 23.477 -10.343 1012 HB3 ARG 31 1HB ARG 31 -16.540 25.259 -10.392 1013 HG2 ARG 31 2HG ARG 31 -13.979 23.662 -10.915 1014 HG3 ARG 31 1HG ARG 31 -15.255 23.606 -12.148 1015 HD2 ARG 31 2HD ARG 31 -13.704 26.074 -11.111 1016 HD3 ARG 31 1HD ARG 31 -13.663 25.390 -12.778 1017 HE ARG 31 HE ARG 31 -15.379 27.425 -11.844 1018 HH11 ARG 31 1HH2 ARG 31 -15.729 24.414 -13.793 1019 HH12 ARG 31 2HH2 ARG 31 -17.232 24.810 -14.469 1020 HH21 ARG 31 1HH1 ARG 31 -17.481 28.017 -12.789 1021 HH22 ARG 31 2HH1 ARG 31 -18.248 26.926 -13.870 1022 H GLY 32 H GLY 32 -15.132 25.532 -6.558 1023 HA2 GLY 32 2HA GLY 32 -17.215 26.831 -5.847 1024 HA3 GLY 32 1HA GLY 32 -17.920 25.161 -5.765 1025 H ALA 33 H ALA 33 -14.967 24.231 -5.172 1026 HA ALA 33 HA ALA 33 -15.549 24.155 -2.399 1027 HB1 ALA 33 1HB ALA 33 -13.583 22.548 -2.326 1028 HB2 ALA 33 2HB ALA 33 -13.267 22.969 -4.040 1029 HB3 ALA 33 3HB ALA 33 -14.776 22.105 -3.605 1030 HA PRO 34 HA PRO 34 -12.422 27.198 -1.433 1031 HB2 PRO 34 2HB PRO 34 -12.225 26.918 1.301 1032 HB3 PRO 34 1HB PRO 34 -13.761 27.451 0.511 1033 HG2 PRO 34 2HG PRO 34 -13.049 24.680 1.574 1034 HG3 PRO 34 1HG PRO 34 -14.622 25.572 1.697 1035 HD2 PRO 34 2HD PRO 34 -13.925 23.607 -0.283 1036 HD3 PRO 34 1HD PRO 34 -15.281 24.800 -0.418 1037 H GLY 35 H GLY 35 -10.152 27.099 -1.828 1038 HA2 GLY 35 2HA GLY 35 -8.051 26.496 -0.924 1039 HA3 GLY 35 1HA GLY 35 -8.702 24.860 -0.496 1040 H ALA 36 H ALA 36 -9.972 23.876 -2.430 1041 HA ALA 36 HA ALA 36 -9.787 22.722 -4.188 1042 HB1 ALA 36 1HB ALA 36 -9.886 23.900 -6.402 1043 HB2 ALA 36 2HB ALA 36 -9.493 25.462 -5.566 1044 HB3 ALA 36 3HB ALA 36 -11.019 24.575 -5.194 1045 H ALA 37 H ALA 37 -7.658 24.965 -5.733 1046 HA ALA 37 HA ALA 37 -5.537 25.015 -6.203 1047 HB1 ALA 37 1HB ALA 37 -3.754 23.558 -5.366 1048 HB2 ALA 37 2HB ALA 37 -4.966 22.411 -4.687 1049 HB3 ALA 37 3HB ALA 37 -4.810 24.059 -3.988 1050 H LEU 38 H LEU 38 -7.453 22.145 -6.574 1051 HA LEU 38 HA LEU 38 -6.073 21.355 -9.022 1052 HB2 LEU 38 2HB LEU 38 -6.672 19.581 -7.365 1053 HB3 LEU 38 1HB LEU 38 -8.357 20.161 -7.348 1054 HG LEU 38 HG LEU 38 -8.660 19.450 -9.719 1055 HD11 LEU 38 1HD1 LEU 38 -5.751 18.431 -9.488 1056 HD12 LEU 38 2HD1 LEU 38 -6.387 19.650 -10.659 1057 HD13 LEU 38 3HD1 LEU 38 -6.912 17.935 -10.770 1058 HD21 LEU 38 3HD2 LEU 38 -8.602 16.982 -9.274 1059 HD22 LEU 38 1HD2 LEU 38 -9.249 17.917 -7.875 1060 HD23 LEU 38 2HD2 LEU 38 -7.572 17.269 -7.825 1061 H ILE 39 H ILE 39 -6.899 22.143 -11.010 1062 HA ILE 39 HA ILE 39 -9.641 22.669 -11.310 1063 HB ILE 39 HB ILE 39 -9.102 25.007 -12.325 1064 HG12 ILE 39 2HG1 ILE 39 -6.677 24.807 -10.408 1065 HG13 ILE 39 1HG1 ILE 39 -6.582 24.768 -12.197 1066 HG21 ILE 39 1HG2 ILE 39 -10.466 24.591 -10.214 1067 HG22 ILE 39 2HG2 ILE 39 -9.643 26.191 -10.265 1068 HG23 ILE 39 3HG2 ILE 39 -8.974 24.861 -9.252 1069 HD11 ILE 39 3HD ILE 39 -7.559 27.128 -10.453 1070 HD12 ILE 39 1HD ILE 39 -6.042 27.028 -11.409 1071 HD13 ILE 39 2HD ILE 39 -7.632 27.093 -12.260 1072 H SER 40 H SER 40 -9.752 23.313 -13.741 1073 HA SER 40 HA SER 40 -9.250 23.202 -15.778 1074 HB2 SER 40 2HB SER 40 -6.910 24.173 -14.905 1075 HB3 SER 40 1HB SER 40 -6.296 22.611 -15.526 1076 HG SER 40 1HG SER 40 -6.315 24.380 -17.033 1077 H TYR 41 H TYR 41 -9.222 21.736 -17.461 1078 HA TYR 41 HA TYR 41 -9.608 19.033 -16.660 1079 HB2 TYR 41 2HB TYR 41 -10.639 20.608 -18.707 1080 HB3 TYR 41 1HB TYR 41 -9.422 19.668 -19.627 1081 HD1 TYR 41 2HD TYR 41 -9.488 17.036 -19.243 1082 HD2 TYR 41 1HD TYR 41 -12.730 19.704 -18.279 1083 HE1 TYR 41 2HE TYR 41 -11.087 15.183 -19.479 1084 HE2 TYR 41 1HE TYR 41 -14.330 17.860 -18.539 1085 HH TYR 41 HH TYR 41 -13.286 14.510 -19.284 1086 HA PRO 42 HA PRO 42 -5.958 18.100 -19.383 1087 HB2 PRO 42 2HB PRO 42 -3.777 19.902 -19.697 1088 HB3 PRO 42 1HB PRO 42 -5.175 19.760 -20.829 1089 HG2 PRO 42 2HG PRO 42 -4.863 21.733 -18.501 1090 HG3 PRO 42 1HG PRO 42 -5.349 22.083 -20.216 1091 HD2 PRO 42 2HD PRO 42 -7.216 21.807 -18.288 1092 HD3 PRO 42 1HD PRO 42 -7.506 20.997 -19.894 1093 H ASP 43 H ASP 43 -5.327 19.965 -16.375 1094 HA ASP 43 HA ASP 43 -3.302 17.928 -15.766 1095 HB2 ASP 43 2HB ASP 43 -2.526 19.374 -13.914 1096 HB3 ASP 43 1HB ASP 43 -2.237 20.011 -15.559 1097 H ALA 44 H ALA 44 -6.546 18.215 -15.491 1098 HA ALA 44 HA ALA 44 -6.849 17.373 -12.787 1099 HB1 ALA 44 1HB ALA 44 -8.812 18.219 -14.008 1100 HB2 ALA 44 2HB ALA 44 -9.112 16.536 -13.487 1101 HB3 ALA 44 3HB ALA 44 -8.696 16.888 -15.213 1102 H ILE 45 H ILE 45 -6.361 15.802 -15.931 1103 HA ILE 45 HA ILE 45 -6.692 13.174 -14.998 1104 HB ILE 45 HB ILE 45 -6.996 13.614 -17.291 1105 HG12 ILE 45 2HG1 ILE 45 -4.446 11.909 -16.985 1106 HG13 ILE 45 1HG1 ILE 45 -6.118 11.377 -16.608 1107 HG21 ILE 45 1HG2 ILE 45 -4.059 14.581 -17.409 1108 HG22 ILE 45 2HG2 ILE 45 -5.539 15.595 -17.582 1109 HG23 ILE 45 3HG2 ILE 45 -5.156 14.365 -18.813 1110 HD11 ILE 45 3HD ILE 45 -5.079 12.237 -19.396 1111 HD12 ILE 45 1HD ILE 45 -5.481 10.571 -18.852 1112 HD13 ILE 45 2HD ILE 45 -6.785 11.798 -19.012 1113 H TRP 46 H TRP 46 -3.907 15.403 -14.934 1114 HA TRP 46 HA TRP 46 -2.008 13.363 -14.370 1115 HB2 TRP 46 2HB TRP 46 -1.936 16.395 -14.090 1116 HB3 TRP 46 1HB TRP 46 -0.691 15.403 -13.307 1117 HD1 TRP 46 HD TRP 46 0.896 16.977 -14.835 1118 HE1 TRP 46 1HE TRP 46 1.976 16.481 -17.105 1119 HE3 TRP 46 3HE TRP 46 -2.262 13.237 -16.471 1120 HZ2 TRP 46 2HZ TRP 46 1.628 14.666 -19.256 1121 HZ3 TRP 46 3HZ TRP 46 -1.818 12.184 -18.620 1122 HH2 TRP 46 HH TRP 46 0.103 12.876 -20.010 1123 H TRP 47 H TRP 47 -4.019 15.443 -12.252 1124 HA TRP 47 HA TRP 47 -2.910 14.482 -9.832 1125 HB2 TRP 47 2HB TRP 47 -4.250 16.532 -9.816 1126 HB3 TRP 47 1HB TRP 47 -5.638 15.699 -10.596 1127 HD1 TRP 47 HD TRP 47 -3.856 15.835 -7.085 1128 HE1 TRP 47 1HE TRP 47 -5.423 14.759 -5.394 1129 HE3 TRP 47 3HE TRP 47 -7.579 14.425 -10.270 1130 HZ2 TRP 47 2HZ TRP 47 -8.093 13.649 -5.362 1131 HZ3 TRP 47 3HZ TRP 47 -9.578 13.286 -9.370 1132 HH2 TRP 47 HH TRP 47 -9.842 12.931 -6.940 1133 H SER 48 H SER 48 -5.540 13.426 -11.963 1134 HA SER 48 HA SER 48 -6.737 11.578 -10.357 1135 HB2 SER 48 2HB SER 48 -7.461 12.538 -12.675 1136 HB3 SER 48 1HB SER 48 -6.461 11.232 -13.407 1137 HG SER 48 1HG SER 48 -8.663 10.698 -13.187 1138 H VAL 49 H VAL 49 -3.838 11.118 -12.496 1139 HA VAL 49 HA VAL 49 -3.936 8.354 -12.343 1140 HB VAL 49 HB VAL 49 -1.213 9.623 -12.598 1141 HG11 VAL 49 1HG1 VAL 49 -1.525 7.125 -12.589 1142 HG12 VAL 49 2HG1 VAL 49 -0.977 7.702 -14.197 1143 HG13 VAL 49 3HG1 VAL 49 -2.705 7.250 -13.942 1144 HG21 VAL 49 3HG2 VAL 49 -3.513 9.740 -14.666 1145 HG22 VAL 49 1HG2 VAL 49 -1.767 9.875 -15.097 1146 HG23 VAL 49 2HG2 VAL 49 -2.506 11.100 -14.018 1147 H GLU 50 H GLU 50 -1.978 10.636 -10.223 1148 HA GLU 50 HA GLU 50 -1.088 8.312 -8.822 1149 HB2 GLU 50 2HB GLU 50 0.013 9.830 -7.172 1150 HB3 GLU 50 1HB GLU 50 0.531 9.748 -8.861 1151 HG2 GLU 50 2HG GLU 50 -0.877 11.961 -9.237 1152 HG3 GLU 50 1HG GLU 50 -0.874 12.092 -7.436 1153 H THR 51 H THR 51 -3.988 10.079 -8.662 1154 HA THR 51 HA THR 51 -4.563 9.504 -5.938 1155 HB THR 51 HB THR 51 -6.465 9.980 -8.289 1156 HG1 THR 51 1HG THR 51 -5.141 11.765 -7.916 1157 HG21 THR 51 3HG2 THR 51 -8.074 10.633 -6.461 1158 HG22 THR 51 1HG2 THR 51 -6.882 10.102 -5.216 1159 HG23 THR 51 2HG2 THR 51 -7.622 8.897 -6.335 1160 H ALA 52 H ALA 52 -5.038 7.701 -9.054 1161 HA ALA 52 HA ALA 52 -6.486 5.593 -7.838 1162 HB1 ALA 52 1HB ALA 52 -5.835 4.260 -9.888 1163 HB2 ALA 52 2HB ALA 52 -4.740 5.606 -10.377 1164 HB3 ALA 52 3HB ALA 52 -6.528 5.869 -10.286 1165 H THR 53 H THR 53 -3.030 6.274 -8.050 1166 HA THR 53 HA THR 53 -2.276 3.617 -7.332 1167 HB THR 53 HB THR 53 -0.026 4.472 -7.039 1168 HG1 THR 53 1HG THR 53 -1.314 7.006 -7.098 1169 HG21 THR 53 3HG2 THR 53 0.313 5.371 -9.337 1170 HG22 THR 53 1HG2 THR 53 -1.431 5.723 -9.516 1171 HG23 THR 53 2HG2 THR 53 -0.873 4.020 -9.357 1172 H THR 54 H THR 54 -3.600 6.235 -5.593 1173 HA THR 54 HA THR 54 -3.924 6.806 -3.614 1174 HB THR 54 HB THR 54 -4.302 5.366 -1.809 1175 HG1 THR 54 1HG THR 54 -2.616 4.023 -1.615 1176 HG21 THR 54 3HG2 THR 54 -5.820 3.789 -2.924 1177 HG22 THR 54 1HG2 THR 54 -4.804 3.731 -4.405 1178 HG23 THR 54 2HG2 THR 54 -5.690 5.235 -3.996 1179 H VAL 55 H VAL 55 -1.035 6.702 -4.808 1180 HA VAL 55 HA VAL 55 0.499 6.953 -2.387 1181 HB VAL 55 HB VAL 55 1.267 7.516 -5.301 1182 HG11 VAL 55 1HG1 VAL 55 2.901 7.307 -2.678 1183 HG12 VAL 55 2HG1 VAL 55 2.732 8.768 -3.720 1184 HG13 VAL 55 3HG1 VAL 55 3.624 7.336 -4.328 1185 HG21 VAL 55 3HG2 VAL 55 1.726 5.071 -3.443 1186 HG22 VAL 55 1HG2 VAL 55 2.417 5.284 -5.097 1187 HG23 VAL 55 2HG2 VAL 55 0.644 5.108 -4.879 1188 H GLY 56 H GLY 56 -0.636 9.141 -5.075 1189 HA2 GLY 56 2HA GLY 56 -1.363 11.250 -4.879 1190 HA3 GLY 56 1HA GLY 56 -1.046 11.210 -3.102 1191 H TYR 57 H TYR 57 1.551 10.631 -2.957 1192 HA TYR 57 HA TYR 57 3.636 11.078 -3.248 1193 HB2 TYR 57 2HB TYR 57 2.868 11.249 -5.878 1194 HB3 TYR 57 1HB TYR 57 3.418 12.931 -5.684 1195 HD1 TYR 57 1HD TYR 57 5.834 12.829 -4.029 1196 HD2 TYR 57 2HD TYR 57 4.373 9.981 -6.907 1197 HE1 TYR 57 1HE TYR 57 8.120 12.013 -4.366 1198 HE2 TYR 57 2HE TYR 57 6.662 9.147 -7.245 1199 HH TYR 57 HH TYR 57 9.489 10.656 -5.690 1200 H GLY 58 H GLY 58 1.901 13.967 -4.362 1201 HA2 GLY 58 2HA GLY 58 1.747 15.473 -2.259 1202 HA3 GLY 58 1HA GLY 58 3.522 15.632 -2.582 1203 H ASP 59 H ASP 59 1.178 15.230 -5.244 1204 HA ASP 59 HA ASP 59 1.939 17.763 -6.356 1205 HB2 ASP 59 2HB ASP 59 1.383 15.985 -7.973 1206 HB3 ASP 59 1HB ASP 59 -0.222 15.736 -7.241 1207 H ARG 60 H ARG 60 -1.469 16.649 -5.935 1208 HA ARG 60 HA ARG 60 -1.996 18.961 -4.216 1209 HB2 ARG 60 2HB ARG 60 -3.340 18.343 -6.911 1210 HB3 ARG 60 1HB ARG 60 -4.093 19.426 -5.695 1211 HG2 ARG 60 2HG ARG 60 -2.405 21.094 -5.875 1212 HG3 ARG 60 1HG ARG 60 -1.262 20.016 -6.730 1213 HD2 ARG 60 2HD ARG 60 -3.937 20.986 -7.937 1214 HD3 ARG 60 1HD ARG 60 -2.292 21.684 -8.298 1215 HE ARG 60 HE ARG 60 -2.006 18.886 -8.692 1216 HH11 ARG 60 1HH2 ARG 60 -3.692 21.614 -10.278 1217 HH12 ARG 60 2HH2 ARG 60 -3.931 20.837 -11.749 1218 HH21 ARG 60 1HH1 ARG 60 -2.278 17.830 -10.557 1219 HH22 ARG 60 2HH1 ARG 60 -3.294 18.398 -11.877 1220 H TYR 61 H TYR 61 -4.642 18.684 -3.712 1221 HA TYR 61 HA TYR 61 -5.383 15.992 -3.653 1222 HB2 TYR 61 2HB TYR 61 -5.720 16.060 -1.035 1223 HB3 TYR 61 1HB TYR 61 -4.089 15.661 -1.660 1224 HD1 TYR 61 1HD TYR 61 -6.158 18.457 -0.242 1225 HD2 TYR 61 2HD TYR 61 -2.217 16.964 -1.118 1226 HE1 TYR 61 1HE TYR 61 -5.191 20.244 1.117 1227 HE2 TYR 61 2HE TYR 61 -1.232 18.760 0.250 1228 HH TYR 61 HH TYR 61 -3.279 21.250 1.824 1229 HA PRO 62 HA PRO 62 -8.905 18.553 -3.717 1230 HB2 PRO 62 2HB PRO 62 -10.969 16.738 -3.345 1231 HB3 PRO 62 1HB PRO 62 -9.821 16.565 -4.715 1232 HG2 PRO 62 2HG PRO 62 -9.734 15.176 -1.970 1233 HG3 PRO 62 1HG PRO 62 -9.639 14.410 -3.613 1234 HD2 PRO 62 2HD PRO 62 -7.383 15.108 -2.097 1235 HD3 PRO 62 1HD PRO 62 -7.387 15.165 -3.924 1236 H VAL 63 H VAL 63 -11.010 19.155 -2.524 1237 HA VAL 63 HA VAL 63 -10.299 19.522 0.280 1238 HB VAL 63 HB VAL 63 -12.619 20.890 -1.138 1239 HG11 VAL 63 1HG1 VAL 63 -10.637 21.810 1.059 1240 HG12 VAL 63 2HG1 VAL 63 -12.234 21.152 1.499 1241 HG13 VAL 63 3HG1 VAL 63 -12.134 22.665 0.550 1242 HG21 VAL 63 3HG2 VAL 63 -9.626 21.626 -1.202 1243 HG22 VAL 63 1HG2 VAL 63 -11.007 22.681 -1.713 1244 HG23 VAL 63 2HG2 VAL 63 -10.662 21.182 -2.603 1245 H THR 64 H THR 64 -13.431 20.134 0.361 1246 HA THR 64 HA THR 64 -14.229 17.523 1.430 1247 HB THR 64 HB THR 64 -14.851 20.364 2.469 1248 HG1 THR 64 1HG THR 64 -12.762 18.578 3.057 1249 HG21 THR 64 3HG2 THR 64 -15.069 17.681 3.987 1250 HG22 THR 64 1HG2 THR 64 -16.461 18.544 3.241 1251 HG23 THR 64 2HG2 THR 64 -15.526 19.311 4.576 1252 H GLU 65 H GLU 65 -14.998 20.439 -0.386 1253 HA GLU 65 HA GLU 65 -17.844 19.931 -0.290 1254 HB2 GLU 65 2HB GLU 65 -16.418 22.246 -0.048 1255 HB3 GLU 65 1HB GLU 65 -16.601 22.238 -1.835 1256 HG2 GLU 65 2HG GLU 65 -19.100 22.094 -1.520 1257 HG3 GLU 65 1HG GLU 65 -18.879 22.110 0.267 1258 H GLU 66 H GLU 66 -15.190 18.860 -2.107 1259 HA GLU 66 HA GLU 66 -16.449 19.003 -4.696 1260 HB2 GLU 66 2HB GLU 66 -14.392 17.248 -5.040 1261 HB3 GLU 66 1HB GLU 66 -14.205 19.028 -5.106 1262 HG2 GLU 66 2HG GLU 66 -12.427 18.124 -3.826 1263 HG3 GLU 66 1HG GLU 66 -13.430 19.084 -2.707 1264 H GLY 67 H GLY 67 -15.828 16.862 -2.013 1265 HA2 GLY 67 2HA GLY 67 -17.603 15.666 -1.060 1266 HA3 GLY 67 1HA GLY 67 -18.189 15.251 -2.740 1267 H ARG 68 H ARG 68 -15.035 15.363 -1.040 1268 HA ARG 68 HA ARG 68 -13.423 13.888 -2.005 1269 HB2 ARG 68 2HB ARG 68 -13.215 14.934 0.224 1270 HB3 ARG 68 1HB ARG 68 -13.886 13.433 0.962 1271 HG2 ARG 68 2HG ARG 68 -11.970 12.121 0.126 1272 HG3 ARG 68 1HG ARG 68 -11.345 13.530 -0.794 1273 HD2 ARG 68 2HD ARG 68 -11.609 13.394 2.309 1274 HD3 ARG 68 1HD ARG 68 -10.117 13.015 1.347 1275 HE ARG 68 HE ARG 68 -11.177 15.652 0.631 1276 HH11 ARG 68 1HH2 ARG 68 -9.572 13.913 3.379 1277 HH12 ARG 68 2HH2 ARG 68 -8.691 15.248 3.898 1278 HH21 ARG 68 1HH1 ARG 68 -9.492 17.271 0.982 1279 HH22 ARG 68 2HH1 ARG 68 -8.793 17.447 2.509 1280 H LYS 69 H LYS 69 -16.236 12.277 -1.202 1281 HA LYS 69 HA LYS 69 -15.365 9.643 -1.525 1282 HB2 LYS 69 2HB LYS 69 -18.038 10.912 -2.262 1283 HB3 LYS 69 1HB LYS 69 -17.667 9.146 -2.173 1284 HG2 LYS 69 2HG LYS 69 -16.867 9.479 0.200 1285 HG3 LYS 69 1HG LYS 69 -17.489 11.161 0.186 1286 HD2 LYS 69 2HD LYS 69 -19.776 10.412 0.067 1287 HD3 LYS 69 1HD LYS 69 -19.286 8.742 -0.421 1288 HE2 LYS 69 2HE LYS 69 -18.272 8.279 1.760 1289 HE3 LYS 69 1HE LYS 69 -18.542 9.976 2.323 1290 HZ1 LYS 69 3HZ LYS 69 -20.744 9.622 2.619 1291 HZ2 LYS 69 1HZ LYS 69 -20.118 8.059 2.956 1292 HZ3 LYS 69 2HZ LYS 69 -20.868 8.360 1.458 1293 H VAL 70 H VAL 70 -15.375 12.363 -3.730 1294 HA VAL 70 HA VAL 70 -15.312 10.987 -6.178 1295 HB VAL 70 HB VAL 70 -13.833 13.545 -5.344 1296 HG11 VAL 70 1HG1 VAL 70 -12.734 12.539 -7.364 1297 HG12 VAL 70 2HG1 VAL 70 -13.717 13.961 -7.842 1298 HG13 VAL 70 3HG1 VAL 70 -14.348 12.298 -8.140 1299 HG21 VAL 70 3HG2 VAL 70 -15.708 14.656 -6.614 1300 HG22 VAL 70 1HG2 VAL 70 -16.326 13.774 -5.195 1301 HG23 VAL 70 2HG2 VAL 70 -16.507 13.059 -6.839 1302 H ALA 71 H ALA 71 -12.663 11.906 -3.890 1303 HA ALA 71 HA ALA 71 -10.669 10.555 -5.370 1304 HB1 ALA 71 1HB ALA 71 -9.244 10.826 -3.322 1305 HB2 ALA 71 2HB ALA 71 -10.693 11.357 -2.387 1306 HB3 ALA 71 3HB ALA 71 -10.075 12.361 -3.748 1307 H GLU 72 H GLU 72 -12.602 9.709 -2.474 1308 HA GLU 72 HA GLU 72 -11.512 7.334 -1.715 1309 HB2 GLU 72 2HB GLU 72 -13.529 8.573 -0.650 1310 HB3 GLU 72 1HB GLU 72 -14.515 7.885 -1.975 1311 HG2 GLU 72 2HG GLU 72 -13.427 5.556 -0.879 1312 HG3 GLU 72 1HG GLU 72 -13.507 6.613 0.572 1313 H GLN 73 H GLN 73 -13.918 7.875 -4.300 1314 HA GLN 73 HA GLN 73 -14.370 5.207 -4.991 1315 HB2 GLN 73 2HB GLN 73 -15.825 7.061 -5.728 1316 HB3 GLN 73 1HB GLN 73 -14.470 7.788 -6.659 1317 HG2 GLN 73 2HG GLN 73 -14.485 5.692 -8.172 1318 HG3 GLN 73 1HG GLN 73 -15.934 5.130 -7.261 1319 HE21 GLN 73 1HE2 GLN 73 -14.793 7.286 -9.807 1320 HE22 GLN 73 2HE2 GLN 73 -16.290 8.136 -10.049 1321 H VAL 74 H VAL 74 -12.033 7.625 -6.304 1322 HA VAL 74 HA VAL 74 -11.135 5.890 -8.354 1323 HB VAL 74 HB VAL 74 -9.831 8.384 -7.138 1324 HG11 VAL 74 1HG1 VAL 74 -8.671 8.541 -9.392 1325 HG12 VAL 74 2HG1 VAL 74 -9.342 6.930 -9.839 1326 HG13 VAL 74 3HG1 VAL 74 -8.171 7.080 -8.479 1327 HG21 VAL 74 3HG2 VAL 74 -11.676 8.047 -9.601 1328 HG22 VAL 74 1HG2 VAL 74 -10.932 9.580 -9.005 1329 HG23 VAL 74 2HG2 VAL 74 -12.191 8.760 -8.038 1330 H MET 75 H MET 75 -9.928 6.778 -5.110 1331 HA MET 75 HA MET 75 -7.514 5.376 -5.264 1332 HB2 MET 75 2HB MET 75 -9.261 6.184 -2.860 1333 HB3 MET 75 1HB MET 75 -7.609 5.493 -2.696 1334 HG2 MET 75 2HG MET 75 -6.693 7.311 -4.125 1335 HG3 MET 75 1HG MET 75 -8.287 8.078 -4.239 1336 HE1 MET 75 3HE MET 75 -9.639 8.457 -1.984 1337 HE2 MET 75 1HE MET 75 -8.914 9.237 -0.554 1338 HE3 MET 75 2HE MET 75 -8.916 7.440 -0.691 1339 H LYS 76 H LYS 76 -10.744 4.390 -3.943 1340 HA LYS 76 HA LYS 76 -9.761 1.852 -3.183 1341 HB2 LYS 76 2HB LYS 76 -11.890 3.107 -2.325 1342 HB3 LYS 76 1HB LYS 76 -12.695 2.465 -3.795 1343 HG2 LYS 76 2HG LYS 76 -11.838 0.105 -2.913 1344 HG3 LYS 76 1HG LYS 76 -11.514 0.968 -1.373 1345 HD2 LYS 76 2HD LYS 76 -13.976 1.682 -1.341 1346 HD3 LYS 76 1HD LYS 76 -14.197 0.780 -2.878 1347 HE2 LYS 76 2HE LYS 76 -13.210 -1.294 -1.481 1348 HE3 LYS 76 1HE LYS 76 -13.694 -0.321 -0.038 1349 HZ1 LYS 76 3HZ LYS 76 -16.011 -0.321 -1.003 1350 HZ2 LYS 76 1HZ LYS 76 -15.361 -1.838 -0.666 1351 HZ3 LYS 76 2HZ LYS 76 -15.409 -1.277 -2.277 1352 H ALA 77 H ALA 77 -11.072 3.149 -6.226 1353 HA ALA 77 HA ALA 77 -11.683 0.671 -7.419 1354 HB1 ALA 77 1HB ALA 77 -11.531 1.871 -9.613 1355 HB2 ALA 77 2HB ALA 77 -10.785 3.288 -8.782 1356 HB3 ALA 77 3HB ALA 77 -12.489 2.823 -8.421 1357 H GLY 78 H GLY 78 -8.705 2.635 -7.206 1358 HA2 GLY 78 2HA GLY 78 -7.144 1.126 -8.974 1359 HA3 GLY 78 1HA GLY 78 -6.587 2.168 -7.608 1360 H ILE 79 H ILE 79 -7.445 0.960 -5.395 1361 HA ILE 79 HA ILE 79 -5.653 -1.104 -5.040 1362 HB ILE 79 HB ILE 79 -8.097 -0.337 -3.384 1363 HG12 ILE 79 2HG1 ILE 79 -5.087 0.358 -3.171 1364 HG13 ILE 79 1HG1 ILE 79 -6.358 1.471 -3.753 1365 HG21 ILE 79 1HG2 ILE 79 -6.960 -1.559 -1.495 1366 HG22 ILE 79 2HG2 ILE 79 -5.673 -2.113 -2.625 1367 HG23 ILE 79 3HG2 ILE 79 -7.366 -2.689 -2.813 1368 HD11 ILE 79 3HD ILE 79 -6.113 0.338 -0.890 1369 HD12 ILE 79 1HD ILE 79 -5.818 2.021 -1.432 1370 HD13 ILE 79 2HD ILE 79 -7.489 1.344 -1.487 1371 H GLU 80 H GLU 80 -9.219 -1.324 -5.628 1372 HA GLU 80 HA GLU 80 -9.315 -4.125 -5.380 1373 HB2 GLU 80 2HB GLU 80 -11.065 -2.133 -6.901 1374 HB3 GLU 80 1HB GLU 80 -11.468 -3.879 -6.819 1375 HG2 GLU 80 2HG GLU 80 -11.018 -2.364 -4.185 1376 HG3 GLU 80 1HG GLU 80 -12.537 -2.131 -5.117 1377 H VAL 81 H VAL 81 -8.275 -2.089 -8.114 1378 HA VAL 81 HA VAL 81 -8.503 -4.220 -10.037 1379 HB VAL 81 HB VAL 81 -7.227 -1.458 -10.040 1380 HG11 VAL 81 1HG1 VAL 81 -5.673 -2.794 -11.410 1381 HG12 VAL 81 2HG1 VAL 81 -6.737 -1.852 -12.506 1382 HG13 VAL 81 3HG1 VAL 81 -7.040 -3.609 -12.257 1383 HG21 VAL 81 3HG2 VAL 81 -9.508 -2.779 -11.681 1384 HG22 VAL 81 1HG2 VAL 81 -9.019 -1.049 -11.732 1385 HG23 VAL 81 2HG2 VAL 81 -9.747 -1.728 -10.240 1386 H PHE 82 H PHE 82 -5.865 -2.728 -8.073 1387 HA PHE 82 HA PHE 82 -3.837 -4.412 -9.044 1388 HB2 PHE 82 2HB PHE 82 -4.000 -3.151 -6.231 1389 HB3 PHE 82 1HB PHE 82 -2.498 -3.682 -7.074 1390 HD1 PHE 82 2HD PHE 82 -3.231 -2.380 -9.882 1391 HD2 PHE 82 1HD PHE 82 -3.335 -0.951 -5.815 1392 HE1 PHE 82 2HE PHE 82 -3.003 -0.062 -10.678 1393 HE2 PHE 82 1HE PHE 82 -3.116 1.358 -6.624 1394 HZ PHE 82 HZ PHE 82 -2.959 1.820 -9.058 1395 H ALA 83 H ALA 83 -6.348 -4.898 -6.682 1396 HA ALA 83 HA ALA 83 -5.166 -7.170 -5.429 1397 HB1 ALA 83 1HB ALA 83 -6.830 -5.740 -4.237 1398 HB2 ALA 83 2HB ALA 83 -7.375 -7.448 -4.318 1399 HB3 ALA 83 3HB ALA 83 -8.098 -6.219 -5.422 1400 H LEU 84 H LEU 84 -7.675 -6.659 -7.964 1401 HA LEU 84 HA LEU 84 -8.624 -9.240 -8.140 1402 HB2 LEU 84 2HB LEU 84 -9.672 -7.256 -9.196 1403 HB3 LEU 84 1HB LEU 84 -8.364 -7.160 -10.408 1404 HG LEU 84 HG LEU 84 -10.113 -9.676 -10.127 1405 HD11 LEU 84 1HD1 LEU 84 -11.691 -7.781 -10.250 1406 HD12 LEU 84 2HD1 LEU 84 -11.732 -8.735 -11.772 1407 HD13 LEU 84 3HD1 LEU 84 -10.874 -7.147 -11.723 1408 HD21 LEU 84 3HD2 LEU 84 -8.269 -9.998 -11.745 1409 HD22 LEU 84 1HD2 LEU 84 -8.647 -8.439 -12.558 1410 HD23 LEU 84 2HD2 LEU 84 -9.798 -9.820 -12.650 1411 H VAL 85 H VAL 85 -5.825 -7.733 -9.772 1412 HA VAL 85 HA VAL 85 -5.377 -9.798 -11.573 1413 HB VAL 85 HB VAL 85 -3.146 -8.862 -11.940 1414 HG11 VAL 85 1HG1 VAL 85 -5.267 -7.810 -12.925 1415 HG12 VAL 85 2HG1 VAL 85 -3.918 -6.644 -12.704 1416 HG13 VAL 85 3HG1 VAL 85 -5.297 -6.655 -11.557 1417 HG21 VAL 85 3HG2 VAL 85 -2.355 -6.914 -10.620 1418 HG22 VAL 85 1HG2 VAL 85 -2.576 -8.310 -9.515 1419 HG23 VAL 85 2HG2 VAL 85 -3.808 -6.994 -9.568 1420 H THR 86 H THR 86 -5.040 -9.956 -8.203 1421 HA THR 86 HA THR 86 -2.878 -11.711 -8.012 1422 HB THR 86 HB THR 86 -5.259 -11.614 -6.122 1423 HG1 THR 86 1HG THR 86 -4.692 -9.623 -6.154 1424 HG21 THR 86 3HG2 THR 86 -2.232 -12.185 -5.676 1425 HG22 THR 86 1HG2 THR 86 -3.537 -13.433 -5.657 1426 HG23 THR 86 2HG2 THR 86 -3.498 -12.146 -4.407 1427 H ALA 87 H ALA 87 -6.012 -12.142 -9.434 1428 HA ALA 87 HA ALA 87 -6.290 -14.911 -9.198 1429 HB1 ALA 87 1HB ALA 87 -7.569 -14.770 -11.341 1430 HB2 ALA 87 2HB ALA 87 -6.880 -13.127 -11.653 1431 HB3 ALA 87 3HB ALA 87 -8.001 -13.396 -10.276 1432 H ALA 88 H ALA 88 -3.923 -12.983 -10.967 1433 HA ALA 88 HA ALA 88 -3.029 -15.293 -12.523 1434 HB1 ALA 88 1HB ALA 88 -3.048 -13.043 -13.680 1435 HB2 ALA 88 2HB ALA 88 -1.374 -13.696 -13.523 1436 HB3 ALA 88 3HB ALA 88 -1.947 -12.404 -12.413 1437 H LEU 89 H LEU 89 -2.096 -13.180 -9.791 1438 HA LEU 89 HA LEU 89 0.519 -14.230 -9.611 1439 HB2 LEU 89 2HB LEU 89 -1.101 -12.857 -7.397 1440 HB3 LEU 89 1HB LEU 89 0.676 -13.057 -7.437 1441 HG LEU 89 HG LEU 89 -0.933 -11.411 -9.495 1442 HD11 LEU 89 1HD1 LEU 89 0.633 -10.420 -7.030 1443 HD12 LEU 89 2HD1 LEU 89 -1.157 -10.444 -7.198 1444 HD13 LEU 89 3HD1 LEU 89 -0.176 -9.400 -8.280 1445 HD21 LEU 89 3HD2 LEU 89 2.104 -11.506 -8.921 1446 HD22 LEU 89 1HD2 LEU 89 1.272 -10.423 -10.095 1447 HD23 LEU 89 2HD2 LEU 89 1.285 -12.199 -10.371 1448 H ALA 90 H ALA 90 -2.572 -15.070 -7.998 1449 HA ALA 90 HA ALA 90 -1.336 -16.695 -6.050 1450 HB1 ALA 90 1HB ALA 90 -3.664 -17.512 -5.574 1451 HB2 ALA 90 2HB ALA 90 -4.237 -16.624 -7.043 1452 HB3 ALA 90 3HB ALA 90 -3.565 -15.718 -5.645 1453 H THR 91 H THR 91 -1.822 -17.267 -9.434 1454 HA THR 91 HA THR 91 -1.785 -20.166 -8.948 1455 HB THR 91 HB THR 91 -3.464 -19.585 -10.511 1456 HG1 THR 91 1HG THR 91 -1.203 -20.888 -11.460 1457 HG21 THR 91 3HG2 THR 91 -2.708 -17.440 -11.368 1458 HG22 THR 91 1HG2 THR 91 -2.942 -18.562 -12.741 1459 HG23 THR 91 2HG2 THR 91 -1.271 -18.186 -12.168 1460 H ASP 92 H ASP 92 0.484 -17.656 -8.950 1461 HA ASP 92 HA ASP 92 2.232 -18.768 -10.880 1462 HB2 ASP 92 2HB ASP 92 2.228 -16.316 -9.985 1463 HB3 ASP 92 1HB ASP 92 3.221 -16.946 -8.630 1464 H PHE 93 H PHE 93 1.818 -19.171 -7.349 1465 HA PHE 93 HA PHE 93 4.157 -20.706 -7.044 1466 HB2 PHE 93 2HB PHE 93 3.554 -21.242 -4.862 1467 HB3 PHE 93 1HB PHE 93 2.837 -19.628 -5.101 1468 HD1 PHE 93 2HD PHE 93 0.301 -19.455 -5.418 1469 HD2 PHE 93 1HD PHE 93 2.209 -23.180 -4.437 1470 HE1 PHE 93 2HE PHE 93 -1.851 -20.354 -4.618 1471 HE2 PHE 93 1HE PHE 93 0.056 -24.069 -3.617 1472 HZ PHE 93 HZ PHE 93 -1.982 -22.651 -3.693 1473 H VAL 94 H VAL 94 0.972 -21.496 -8.228 1474 HA VAL 94 HA VAL 94 1.046 -24.264 -7.740 1475 HB VAL 94 HB VAL 94 -0.623 -22.710 -9.788 1476 HG11 VAL 94 1HG1 VAL 94 -0.764 -25.191 -10.108 1477 HG12 VAL 94 2HG1 VAL 94 -2.286 -24.569 -9.390 1478 HG13 VAL 94 3HG1 VAL 94 -1.085 -25.419 -8.348 1479 HG21 VAL 94 3HG2 VAL 94 -1.044 -23.266 -6.766 1480 HG22 VAL 94 1HG2 VAL 94 -2.294 -22.617 -7.877 1481 HG23 VAL 94 2HG2 VAL 94 -0.841 -21.648 -7.526 1482 H ARG 95 H ARG 95 2.464 -22.199 -10.196 1483 HA ARG 95 HA ARG 95 2.674 -24.049 -12.280 1484 HB2 ARG 95 2HB ARG 95 4.598 -21.779 -11.504 1485 HB3 ARG 95 1HB ARG 95 4.697 -22.737 -13.021 1486 HG2 ARG 95 2HG ARG 95 2.399 -21.958 -13.660 1487 HG3 ARG 95 1HG ARG 95 2.374 -20.886 -12.208 1488 HD2 ARG 95 2HD ARG 95 4.365 -19.641 -13.037 1489 HD3 ARG 95 1HD ARG 95 4.534 -20.760 -14.431 1490 HE ARG 95 HE ARG 95 2.395 -19.993 -15.322 1491 HH11 ARG 95 1HH2 ARG 95 3.917 -17.767 -12.869 1492 HH12 ARG 95 2HH2 ARG 95 3.612 -16.363 -13.734 1493 HH21 ARG 95 1HH1 ARG 95 1.827 -17.991 -16.476 1494 HH22 ARG 95 2HH1 ARG 95 2.348 -16.509 -15.909 1495 H ARG 96 H ARG 96 4.388 -23.898 -9.167 1496 HA ARG 96 HA ARG 96 6.646 -25.338 -10.108 1497 HB2 ARG 96 2HB ARG 96 7.438 -25.510 -7.896 1498 HB3 ARG 96 1HB ARG 96 6.644 -23.914 -8.012 1499 HG2 ARG 96 2HG ARG 96 5.478 -24.421 -6.142 1500 HG3 ARG 96 1HG ARG 96 4.582 -25.639 -7.081 1501 HD2 ARG 96 2HD ARG 96 6.739 -27.212 -6.463 1502 HD3 ARG 96 1HD ARG 96 6.977 -25.995 -5.164 1503 HE ARG 96 HE ARG 96 4.927 -26.694 -4.130 1504 HH11 ARG 96 1HH2 ARG 96 5.425 -28.453 -7.269 1505 HH12 ARG 96 2HH2 ARG 96 4.079 -29.496 -6.950 1506 HH21 ARG 96 1HH1 ARG 96 3.023 -28.327 -3.863 1507 HH22 ARG 96 2HH1 ARG 96 2.791 -29.363 -5.216 1508 H GLU 97 H GLU 97 3.432 -26.398 -9.692 1509 HA GLU 97 HA GLU 97 4.160 -29.141 -9.003 1510 HB2 GLU 97 2HB GLU 97 1.925 -28.047 -8.283 1511 HB3 GLU 97 1HB GLU 97 1.474 -28.035 -10.013 1512 HG2 GLU 97 2HG GLU 97 0.421 -29.951 -8.942 1513 HG3 GLU 97 1HG GLU 97 1.699 -30.595 -10.032 1514 H GLU 98 H GLU 98 3.168 -27.133 -11.761 1515 HA GLU 98 HA GLU 98 2.869 -29.170 -13.608 1516 HB2 GLU 98 2HB GLU 98 3.752 -26.275 -14.136 1517 HB3 GLU 98 1HB GLU 98 2.946 -27.364 -15.303 1518 HG2 GLU 98 2HG GLU 98 1.591 -26.379 -12.677 1519 HG3 GLU 98 1HG GLU 98 1.536 -25.492 -14.233 1520 H GLU 99 H GLU 99 5.701 -27.095 -12.778 1521 HA GLU 99 HA GLU 99 7.335 -28.245 -14.766 1522 HB2 GLU 99 2HB GLU 99 8.316 -26.763 -12.286 1523 HB3 GLU 99 1HB GLU 99 9.184 -26.988 -13.847 1524 HG2 GLU 99 2HG GLU 99 6.615 -25.299 -13.438 1525 HG3 GLU 99 1HG GLU 99 8.289 -24.689 -13.523 1526 H ARG 100 H ARG 100 6.340 -29.569 -11.778 1527 HA ARG 100 HA ARG 100 8.777 -31.019 -11.241 1528 HB2 ARG 100 2HB ARG 100 7.105 -30.255 -9.487 1529 HB3 ARG 100 1HB ARG 100 5.959 -31.494 -10.099 1530 HG2 ARG 100 2HG ARG 100 7.449 -33.299 -9.357 1531 HG3 ARG 100 1HG ARG 100 8.824 -32.162 -9.181 1532 HD2 ARG 100 2HD ARG 100 7.940 -32.820 -6.949 1533 HD3 ARG 100 1HD ARG 100 7.773 -31.039 -7.235 1534 HE ARG 100 HE ARG 100 5.324 -32.216 -8.094 1535 HH11 ARG 100 1HH2 ARG 100 7.175 -31.936 -4.948 1536 HH12 ARG 100 2HH2 ARG 100 5.760 -32.213 -4.023 1537 HH21 ARG 100 1HH1 ARG 100 3.424 -32.257 -6.707 1538 HH22 ARG 100 2HH1 ARG 100 3.629 -32.428 -4.990 1539 H ARG 101 H ARG 101 5.668 -31.454 -12.907 1540 HA ARG 101 HA ARG 101 6.173 -34.228 -13.550 1541 HB2 ARG 101 2HB ARG 101 4.109 -32.178 -14.545 1542 HB3 ARG 101 1HB ARG 101 4.136 -33.888 -15.095 1543 HG2 ARG 101 2HG ARG 101 4.071 -33.351 -12.094 1544 HG3 ARG 101 1HG ARG 101 2.598 -33.003 -13.049 1545 HD2 ARG 101 2HD ARG 101 2.313 -35.320 -13.738 1546 HD3 ARG 101 1HD ARG 101 4.006 -35.737 -13.279 1547 HE ARG 101 HE ARG 101 3.259 -36.283 -11.216 1548 HH11 ARG 101 1HH2 ARG 101 0.773 -33.985 -12.500 1549 HH12 ARG 101 2HH2 ARG 101 -0.122 -33.924 -11.080 1550 HH21 ARG 101 1HH1 ARG 101 1.895 -36.264 -9.259 1551 HH22 ARG 101 2HH1 ARG 101 0.874 -34.906 -9.009 1552 H GLY 102 H GLY 102 6.533 -31.008 -15.044 1553 HA2 GLY 102 2HA GLY 102 8.158 -30.410 -16.474 1554 HA3 GLY 102 1HA GLY 102 8.522 -32.140 -16.834 1555 H HIS 103 H HIS 103 5.188 -31.261 -16.904 1556 HA HIS 103 HA HIS 103 5.185 -30.923 -19.800 1557 HB2 HIS 103 2HB HIS 103 3.931 -33.394 -18.429 1558 HB3 HIS 103 1HB HIS 103 3.631 -32.901 -20.125 1559 HD1 HIS 103 1HD HIS 103 5.066 -34.301 -21.776 1560 HD2 HIS 103 2HD HIS 103 7.046 -33.739 -18.081 1561 HE1 HIS 103 1HE HIS 103 7.381 -35.230 -21.997 1562 HE2 HIS 103 2HE HIS 103 8.589 -34.714 -19.820 1563 H1 SER 1 H SER 1 18.590 -21.322 -0.517 1564 HA SER 1 HA SER 1 16.627 -20.075 0.830 1565 HB2 SER 1 2HB SER 1 16.978 -18.776 -1.944 1566 HB3 SER 1 1HB SER 1 15.701 -18.443 -0.718 1567 HG SER 1 1HG SER 1 17.275 -16.840 -0.823 1568 H ALA 2 H ALA 2 14.526 -20.614 -0.533 1569 HA ALA 2 HA ALA 2 15.073 -23.102 -1.997 1570 HB1 ALA 2 1HB ALA 2 12.615 -23.508 -1.837 1571 HB2 ALA 2 2HB ALA 2 12.409 -21.867 -1.095 1572 HB3 ALA 2 3HB ALA 2 13.321 -23.140 -0.230 1573 H ASP 3 H ASP 3 13.386 -23.455 -3.908 1574 HA ASP 3 HA ASP 3 14.346 -22.015 -6.019 1575 HB2 ASP 3 2HB ASP 3 11.611 -23.480 -5.883 1576 HB3 ASP 3 1HB ASP 3 12.388 -22.888 -7.397 1577 H HIS 4 H HIS 4 11.157 -21.788 -4.496 1578 HA HIS 4 HA HIS 4 10.257 -19.653 -6.100 1579 HB2 HIS 4 2HB HIS 4 8.359 -19.387 -4.575 1580 HB3 HIS 4 1HB HIS 4 8.628 -21.124 -4.919 1581 HD1 HIS 4 1HD HIS 4 7.020 -20.427 -2.371 1582 HD2 HIS 4 2HD HIS 4 11.241 -20.682 -2.298 1583 HE1 HIS 4 1HE HIS 4 7.746 -20.707 0.013 1584 HE2 HIS 4 2HE HIS 4 10.344 -20.733 -0.015 1585 H GLU 5 H GLU 5 12.473 -19.561 -3.411 1586 HA GLU 5 HA GLU 5 11.662 -16.877 -2.586 1587 HB2 GLU 5 2HB GLU 5 13.772 -18.869 -1.632 1588 HB3 GLU 5 1HB GLU 5 13.751 -17.165 -1.075 1589 HG2 GLU 5 2HG GLU 5 12.020 -17.419 0.344 1590 HG3 GLU 5 1HG GLU 5 11.083 -18.468 -0.766 1591 H ARG 6 H ARG 6 14.234 -18.724 -4.356 1592 HA ARG 6 HA ARG 6 15.782 -16.428 -4.800 1593 HB2 ARG 6 2HB ARG 6 15.572 -19.040 -6.406 1594 HB3 ARG 6 1HB ARG 6 16.730 -17.735 -6.827 1595 HG2 ARG 6 2HG ARG 6 16.694 -19.257 -4.152 1596 HG3 ARG 6 1HG ARG 6 17.822 -19.519 -5.532 1597 HD2 ARG 6 2HD ARG 6 18.650 -17.128 -5.309 1598 HD3 ARG 6 1HD ARG 6 17.557 -16.910 -3.880 1599 HE ARG 6 HE ARG 6 19.439 -19.180 -3.676 1600 HH11 ARG 6 1HH2 ARG 6 18.710 -15.799 -2.656 1601 HH12 ARG 6 2HH2 ARG 6 20.212 -15.450 -2.023 1602 HH21 ARG 6 1HH1 ARG 6 21.500 -18.813 -2.484 1603 HH22 ARG 6 2HH1 ARG 6 21.916 -17.230 -2.004 1604 H GLU 7 H GLU 7 12.955 -17.622 -6.521 1605 HA GLU 7 HA GLU 7 13.146 -15.927 -8.722 1606 HB2 GLU 7 2HB GLU 7 11.554 -17.966 -8.206 1607 HB3 GLU 7 1HB GLU 7 10.510 -16.764 -7.388 1608 HG2 GLU 7 2HG GLU 7 9.654 -17.120 -9.626 1609 HG3 GLU 7 1HG GLU 7 10.406 -15.484 -9.636 1610 H ALA 8 H ALA 8 11.949 -15.384 -5.403 1611 HA ALA 8 HA ALA 8 10.699 -12.884 -5.977 1612 HB1 ALA 8 1HB ALA 8 9.978 -14.226 -3.993 1613 HB2 ALA 8 2HB ALA 8 10.629 -12.633 -3.459 1614 HB3 ALA 8 3HB ALA 8 11.636 -14.113 -3.306 1615 H GLN 9 H GLN 9 13.836 -13.940 -4.584 1616 HA GLN 9 HA GLN 9 14.733 -11.334 -4.049 1617 HB2 GLN 9 2HB GLN 9 16.399 -13.869 -4.521 1618 HB3 GLN 9 1HB GLN 9 16.986 -12.333 -3.775 1619 HG2 GLN 9 2HG GLN 9 15.236 -12.565 -1.964 1620 HG3 GLN 9 1HG GLN 9 14.742 -14.144 -2.622 1621 HE21 GLN 9 1HE2 GLN 9 17.018 -12.496 -0.629 1622 HE22 GLN 9 2HE2 GLN 9 18.075 -13.831 -0.276 1623 H LYS 10 H LYS 10 14.954 -13.330 -6.947 1624 HA LYS 10 HA LYS 10 16.697 -11.826 -8.511 1625 HB2 LYS 10 2HB LYS 10 15.968 -14.118 -8.994 1626 HB3 LYS 10 1HB LYS 10 14.257 -13.611 -8.989 1627 HG2 LYS 10 2HG LYS 10 14.548 -12.451 -11.161 1628 HG3 LYS 10 1HG LYS 10 16.269 -12.997 -11.229 1629 HD2 LYS 10 2HD LYS 10 15.561 -15.370 -11.124 1630 HD3 LYS 10 1HD LYS 10 13.868 -14.879 -10.771 1631 HE2 LYS 10 2HE LYS 10 13.625 -13.932 -13.080 1632 HE3 LYS 10 1HE LYS 10 15.293 -14.516 -13.490 1633 HZ1 LYS 10 3HZ LYS 10 13.445 -16.051 -14.134 1634 HZ2 LYS 10 1HZ LYS 10 13.051 -16.234 -12.499 1635 HZ3 LYS 10 2HZ LYS 10 14.582 -16.762 -13.108 1636 H ALA 11 H ALA 11 13.213 -11.435 -7.808 1637 HA ALA 11 HA ALA 11 12.785 -9.429 -9.778 1638 HB1 ALA 11 1HB ALA 11 10.900 -10.853 -8.901 1639 HB2 ALA 11 2HB ALA 11 10.580 -9.095 -8.689 1640 HB3 ALA 11 3HB ALA 11 11.100 -10.090 -7.281 1641 H GLU 12 H GLU 12 13.569 -9.433 -6.256 1642 HA GLU 12 HA GLU 12 13.176 -6.716 -5.835 1643 HB2 GLU 12 2HB GLU 12 15.201 -8.554 -4.427 1644 HB3 GLU 12 1HB GLU 12 14.748 -6.903 -3.884 1645 HG2 GLU 12 2HG GLU 12 12.348 -7.651 -3.612 1646 HG3 GLU 12 1HG GLU 12 12.838 -9.321 -4.060 1647 H GLU 13 H GLU 13 16.085 -8.442 -7.026 1648 HA GLU 13 HA GLU 13 17.701 -6.131 -7.050 1649 HB2 GLU 13 2HB GLU 13 17.997 -8.668 -8.741 1650 HB3 GLU 13 1HB GLU 13 19.288 -7.452 -8.435 1651 HG2 GLU 13 2HG GLU 13 17.952 -9.139 -6.202 1652 HG3 GLU 13 1HG GLU 13 19.435 -9.615 -7.088 1653 H GLU 14 H GLU 14 15.148 -7.123 -9.159 1654 HA GLU 14 HA GLU 14 16.155 -5.885 -11.529 1655 HB2 GLU 14 2HB GLU 14 14.371 -7.783 -11.414 1656 HB3 GLU 14 1HB GLU 14 13.225 -6.545 -10.819 1657 HG2 GLU 14 2HG GLU 14 12.844 -6.897 -13.200 1658 HG3 GLU 14 1HG GLU 14 13.538 -5.252 -12.974 1659 H LEU 15 H LEU 15 14.094 -5.038 -8.757 1660 HA LEU 15 HA LEU 15 13.121 -2.653 -9.816 1661 HB2 LEU 15 2HB LEU 15 12.164 -3.861 -7.805 1662 HB3 LEU 15 1HB LEU 15 13.577 -3.337 -6.844 1663 HG LEU 15 HG LEU 15 12.909 -0.962 -7.094 1664 HD11 LEU 15 1HD1 LEU 15 11.937 -0.877 -9.344 1665 HD12 LEU 15 2HD1 LEU 15 10.675 -0.372 -8.179 1666 HD13 LEU 15 3HD1 LEU 15 10.628 -2.029 -8.880 1667 HD21 LEU 15 3HD2 LEU 15 10.552 -2.769 -6.239 1668 HD22 LEU 15 1HD2 LEU 15 10.773 -1.042 -5.786 1669 HD23 LEU 15 2HD2 LEU 15 11.950 -2.278 -5.218 1670 H GLN 16 H GLN 16 16.056 -3.413 -7.965 1671 HA GLN 16 HA GLN 16 16.807 -0.797 -7.394 1672 HB2 GLN 16 2HB GLN 16 18.762 -3.115 -7.825 1673 HB3 GLN 16 1HB GLN 16 19.005 -1.601 -6.890 1674 HG2 GLN 16 2HG GLN 16 16.817 -2.482 -5.549 1675 HG3 GLN 16 1HG GLN 16 17.334 -4.085 -6.177 1676 HE21 GLN 16 1HE2 GLN 16 19.146 -5.116 -5.017 1677 HE22 GLN 16 2HE2 GLN 16 20.109 -4.256 -3.875 1678 H LYS 17 H LYS 17 16.982 -2.579 -10.364 1679 HA LYS 17 HA LYS 17 19.070 -1.037 -11.576 1680 HB2 LYS 17 2HB LYS 17 18.580 -3.476 -11.937 1681 HB3 LYS 17 1HB LYS 17 17.015 -3.045 -12.700 1682 HG2 LYS 17 2HG LYS 17 18.119 -2.171 -14.666 1683 HG3 LYS 17 1HG LYS 17 19.697 -2.066 -13.818 1684 HD2 LYS 17 2HD LYS 17 19.664 -3.990 -15.408 1685 HD3 LYS 17 1HD LYS 17 19.975 -4.447 -13.706 1686 HE2 LYS 17 2HE LYS 17 18.532 -6.136 -14.758 1687 HE3 LYS 17 1HE LYS 17 17.638 -5.302 -13.438 1688 HZ1 LYS 17 3HZ LYS 17 16.215 -5.525 -15.255 1689 HZ2 LYS 17 1HZ LYS 17 17.350 -4.919 -16.382 1690 HZ3 LYS 17 2HZ LYS 17 16.635 -3.892 -15.218 1691 H VAL 18 H VAL 18 15.583 -0.815 -11.160 1692 HA VAL 18 HA VAL 18 15.134 0.938 -13.388 1693 HB VAL 18 HB VAL 18 13.349 0.380 -10.955 1694 HG11 VAL 18 1HG1 VAL 18 11.511 1.149 -12.498 1695 HG12 VAL 18 2HG1 VAL 18 12.732 1.555 -13.760 1696 HG13 VAL 18 3HG1 VAL 18 12.696 2.459 -12.200 1697 HG21 VAL 18 3HG2 VAL 18 13.487 -1.005 -13.725 1698 HG22 VAL 18 1HG2 VAL 18 12.189 -1.250 -12.501 1699 HG23 VAL 18 2HG2 VAL 18 13.864 -1.754 -12.131 1700 H LEU 19 H LEU 19 15.811 1.153 -9.882 1701 HA LEU 19 HA LEU 19 15.190 3.814 -9.501 1702 HB2 LEU 19 2HB LEU 19 17.575 2.432 -8.141 1703 HB3 LEU 19 1HB LEU 19 16.612 3.818 -7.528 1704 HG LEU 19 HG LEU 19 15.720 0.899 -7.849 1705 HD11 LEU 19 1HD1 LEU 19 15.563 0.906 -5.370 1706 HD12 LEU 19 2HD1 LEU 19 16.102 2.625 -5.322 1707 HD13 LEU 19 3HD1 LEU 19 17.229 1.342 -5.905 1708 HD21 LEU 19 3HD2 LEU 19 13.591 1.494 -6.760 1709 HD22 LEU 19 1HD2 LEU 19 13.743 2.307 -8.349 1710 HD23 LEU 19 2HD2 LEU 19 14.009 3.244 -6.830 1711 H GLU 20 H GLU 20 18.106 2.328 -10.836 1712 HA GLU 20 HA GLU 20 19.802 4.534 -10.895 1713 HB2 GLU 20 2HB GLU 20 19.503 2.236 -12.928 1714 HB3 GLU 20 1HB GLU 20 20.910 3.341 -12.837 1715 HG2 GLU 20 2HG GLU 20 20.048 1.529 -10.472 1716 HG3 GLU 20 1HG GLU 20 21.135 0.993 -11.796 1717 H GLU 21 H GLU 21 17.431 3.315 -13.343 1718 HA GLU 21 HA GLU 21 17.909 5.381 -15.223 1719 HB2 GLU 21 2HB GLU 21 15.520 3.514 -14.739 1720 HB3 GLU 21 1HB GLU 21 15.467 4.766 -16.017 1721 HG2 GLU 21 2HG GLU 21 17.710 2.661 -15.954 1722 HG3 GLU 21 1HG GLU 21 16.102 2.370 -16.712 1723 H ALA 22 H ALA 22 15.591 4.931 -12.558 1724 HA ALA 22 HA ALA 22 14.011 7.150 -12.983 1725 HB1 ALA 22 1HB ALA 22 14.825 5.979 -10.247 1726 HB2 ALA 22 2HB ALA 22 13.494 5.359 -11.279 1727 HB3 ALA 22 3HB ALA 22 13.394 7.016 -10.578 1728 H SER 23 H SER 23 17.101 6.869 -11.168 1729 HA SER 23 HA SER 23 17.083 9.491 -10.184 1730 HB2 SER 23 2HB SER 23 19.434 9.229 -9.650 1731 HB3 SER 23 1HB SER 23 18.586 7.684 -9.292 1732 HG SER 23 1HG SER 23 19.403 6.965 -11.416 1733 H LYS 24 H LYS 24 18.039 8.232 -13.339 1734 HA LYS 24 HA LYS 24 19.471 10.637 -14.024 1735 HB2 LYS 24 2HB LYS 24 20.080 8.388 -15.055 1736 HB3 LYS 24 1HB LYS 24 18.488 8.386 -15.876 1737 HG2 LYS 24 2HG LYS 24 19.242 10.745 -16.864 1738 HG3 LYS 24 1HG LYS 24 20.881 10.280 -16.310 1739 HD2 LYS 24 2HD LYS 24 20.777 8.264 -17.767 1740 HD3 LYS 24 1HD LYS 24 19.063 8.638 -18.191 1741 HE2 LYS 24 2HE LYS 24 19.776 10.802 -19.276 1742 HE3 LYS 24 1HE LYS 24 21.487 10.458 -18.843 1743 HZ1 LYS 24 3HZ LYS 24 21.252 8.367 -20.112 1744 HZ2 LYS 24 1HZ LYS 24 21.244 9.794 -21.001 1745 HZ3 LYS 24 2HZ LYS 24 19.746 8.973 -20.735 1746 H LYS 25 H LYS 25 16.400 9.034 -15.049 1747 HA LYS 25 HA LYS 25 15.584 11.075 -16.794 1748 HB2 LYS 25 2HB LYS 25 14.148 8.834 -15.287 1749 HB3 LYS 25 1HB LYS 25 13.154 10.121 -16.033 1750 HG2 LYS 25 2HG LYS 25 13.274 8.200 -17.508 1751 HG3 LYS 25 1HG LYS 25 13.942 9.692 -18.251 1752 HD2 LYS 25 2HD LYS 25 16.250 8.889 -17.914 1753 HD3 LYS 25 1HD LYS 25 15.654 7.407 -17.075 1754 HE2 LYS 25 2HE LYS 25 14.538 6.613 -19.149 1755 HE3 LYS 25 1HE LYS 25 14.938 8.163 -19.997 1756 HZ1 LYS 25 3HZ LYS 25 17.246 7.659 -19.783 1757 HZ2 LYS 25 1HZ LYS 25 16.438 6.433 -20.602 1758 HZ3 LYS 25 2HZ LYS 25 16.904 6.166 -18.958 1759 H ALA 26 H ALA 26 15.317 10.715 -13.258 1760 HA ALA 26 HA ALA 26 13.500 12.679 -12.699 1761 HB1 ALA 26 1HB ALA 26 14.473 11.191 -10.934 1762 HB2 ALA 26 2HB ALA 26 14.657 12.914 -10.494 1763 HB3 ALA 26 3HB ALA 26 16.069 11.996 -11.129 1764 H VAL 27 H VAL 27 17.112 13.118 -13.200 1765 HA VAL 27 HA VAL 27 16.799 15.881 -12.534 1766 HB VAL 27 HB VAL 27 19.055 16.272 -13.490 1767 HG11 VAL 27 1HG1 VAL 27 18.552 15.751 -11.067 1768 HG12 VAL 27 2HG1 VAL 27 20.173 15.161 -11.587 1769 HG13 VAL 27 3HG1 VAL 27 18.803 14.001 -11.430 1770 HG21 VAL 27 3HG2 VAL 27 20.514 14.349 -14.043 1771 HG22 VAL 27 1HG2 VAL 27 19.105 14.314 -15.154 1772 HG23 VAL 27 2HG2 VAL 27 19.180 13.187 -13.746 1773 H GLU 28 H GLU 28 16.636 14.042 -15.548 1774 HA GLU 28 HA GLU 28 16.775 16.359 -17.203 1775 HB2 GLU 28 2HB GLU 28 15.401 13.689 -17.908 1776 HB3 GLU 28 1HB GLU 28 16.008 14.948 -19.037 1777 HG2 GLU 28 2HG GLU 28 18.394 14.413 -18.095 1778 HG3 GLU 28 1HG GLU 28 17.640 12.997 -17.282 1779 H ALA 29 H ALA 29 14.177 14.463 -15.644 1780 HA ALA 29 HA ALA 29 12.086 15.970 -16.913 1781 HB1 ALA 29 1HB ALA 29 11.866 13.483 -16.487 1782 HB2 ALA 29 2HB ALA 29 10.566 14.430 -15.680 1783 HB3 ALA 29 3HB ALA 29 11.956 13.817 -14.717 1784 H GLU 30 H GLU 30 13.761 17.651 -15.501 1785 HA GLU 30 HA GLU 30 11.757 18.870 -13.983 1786 HB2 GLU 30 2HB GLU 30 12.855 17.235 -12.271 1787 HB3 GLU 30 1HB GLU 30 14.220 18.366 -12.260 1788 HG2 GLU 30 2HG GLU 30 13.081 19.805 -10.908 1789 HG3 GLU 30 1HG GLU 30 11.720 19.928 -12.076 1790 H ARG 31 H ARG 31 15.167 18.759 -15.117 1791 HA ARG 31 HA ARG 31 15.604 21.527 -14.761 1792 HB2 ARG 31 2HB ARG 31 16.871 19.569 -16.738 1793 HB3 ARG 31 1HB ARG 31 17.453 21.249 -16.518 1794 HG2 ARG 31 2HG ARG 31 17.335 19.196 -14.226 1795 HG3 ARG 31 1HG ARG 31 18.729 19.350 -15.335 1796 HD2 ARG 31 2HD ARG 31 17.652 21.509 -13.388 1797 HD3 ARG 31 1HD ARG 31 19.127 20.500 -13.183 1798 HE ARG 31 HE ARG 31 18.809 22.900 -14.816 1799 HH11 ARG 31 1HH2 ARG 31 20.828 19.856 -14.525 1800 HH12 ARG 31 2HH2 ARG 31 22.228 20.614 -15.106 1801 HH21 ARG 31 1HH1 ARG 31 20.852 23.881 -15.673 1802 HH22 ARG 31 2HH1 ARG 31 22.240 22.910 -15.755 1803 H GLY 32 H GLY 32 13.578 22.451 -15.539 1804 HA2 GLY 32 2HA GLY 32 13.549 23.969 -17.656 1805 HA3 GLY 32 1HA GLY 32 13.083 22.381 -18.395 1806 H ALA 33 H ALA 33 12.011 22.084 -15.292 1807 HA ALA 33 HA ALA 33 9.429 22.206 -16.215 1808 HB1 ALA 33 1HB ALA 33 10.395 21.835 -13.294 1809 HB2 ALA 33 2HB ALA 33 10.384 20.539 -14.523 1810 HB3 ALA 33 3HB ALA 33 8.838 21.275 -13.985 1811 HA PRO 34 HA PRO 34 8.168 26.123 -14.501 1812 HB2 PRO 34 2HB PRO 34 5.414 25.847 -14.527 1813 HB3 PRO 34 1HB PRO 34 6.402 25.884 -16.033 1814 HG2 PRO 34 2HG PRO 34 5.365 23.406 -14.557 1815 HG3 PRO 34 1HG PRO 34 5.195 23.810 -16.318 1816 HD2 PRO 34 2HD PRO 34 7.235 22.192 -15.319 1817 HD3 PRO 34 1HD PRO 34 7.506 23.296 -16.736 1818 H GLY 35 H GLY 35 9.238 25.570 -12.348 1819 HA2 GLY 35 2HA GLY 35 8.688 26.145 -10.097 1820 HA3 GLY 35 1HA GLY 35 7.150 25.209 -10.251 1821 H ALA 36 H ALA 36 10.256 24.266 -11.591 1822 HA ALA 36 HA ALA 36 10.402 21.710 -10.709 1823 HB1 ALA 36 1HB ALA 36 11.948 22.792 -12.471 1824 HB2 ALA 36 2HB ALA 36 12.887 21.936 -11.207 1825 HB3 ALA 36 3HB ALA 36 12.729 23.723 -11.150 1826 H ALA 37 H ALA 37 11.418 20.617 -9.027 1827 HA ALA 37 HA ALA 37 12.465 22.234 -6.788 1828 HB1 ALA 37 1HB ALA 37 10.784 19.638 -6.757 1829 HB2 ALA 37 2HB ALA 37 10.220 21.256 -6.214 1830 HB3 ALA 37 3HB ALA 37 11.522 20.411 -5.296 1831 H LEU 38 H LEU 38 12.464 19.085 -8.588 1832 HA LEU 38 HA LEU 38 14.689 18.116 -7.063 1833 HB2 LEU 38 2HB LEU 38 12.768 16.762 -8.119 1834 HB3 LEU 38 1HB LEU 38 13.557 16.993 -9.689 1835 HG LEU 38 HG LEU 38 15.001 15.675 -7.307 1836 HD11 LEU 38 1HD1 LEU 38 14.245 13.481 -8.279 1837 HD12 LEU 38 2HD1 LEU 38 13.212 14.377 -9.459 1838 HD13 LEU 38 3HD1 LEU 38 12.860 14.478 -7.702 1839 HD21 LEU 38 3HD2 LEU 38 16.219 14.489 -9.244 1840 HD22 LEU 38 1HD2 LEU 38 16.581 16.244 -9.099 1841 HD23 LEU 38 2HD2 LEU 38 15.435 15.655 -10.366 1842 H ILE 39 H ILE 39 16.836 18.701 -7.437 1843 HA ILE 39 HA ILE 39 17.640 19.201 -10.172 1844 HB ILE 39 HB ILE 39 18.936 21.242 -9.395 1845 HG12 ILE 39 2HG1 ILE 39 17.030 21.081 -6.967 1846 HG13 ILE 39 1HG1 ILE 39 18.806 20.857 -6.928 1847 HG21 ILE 39 1HG2 ILE 39 16.783 21.305 -10.761 1848 HG22 ILE 39 2HG2 ILE 39 17.041 22.788 -9.777 1849 HG23 ILE 39 3HG2 ILE 39 15.862 21.538 -9.237 1850 HD11 ILE 39 3HD ILE 39 17.339 23.478 -7.696 1851 HD12 ILE 39 1HD ILE 39 18.244 23.141 -6.177 1852 HD13 ILE 39 2HD ILE 39 19.124 23.222 -7.743 1853 H SER 40 H SER 40 20.106 19.192 -10.117 1854 HA SER 40 HA SER 40 21.974 18.342 -9.568 1855 HB2 SER 40 2HB SER 40 21.395 19.398 -7.211 1856 HB3 SER 40 1HB SER 40 21.210 17.702 -6.673 1857 HG SER 40 1HG SER 40 23.318 18.565 -6.371 1858 H TYR 41 H TYR 41 22.954 16.365 -9.991 1859 HA TYR 41 HA TYR 41 21.282 14.074 -10.055 1860 HB2 TYR 41 2HB TYR 41 23.082 14.364 -11.769 1861 HB3 TYR 41 1HB TYR 41 24.327 14.131 -10.484 1862 HD1 TYR 41 2HD TYR 41 21.215 12.475 -11.925 1863 HD2 TYR 41 1HD TYR 41 25.020 11.928 -9.982 1864 HE1 TYR 41 2HE TYR 41 20.930 10.044 -12.047 1865 HE2 TYR 41 1HE TYR 41 24.723 9.490 -10.086 1866 HH TYR 41 HH TYR 41 21.656 8.027 -11.145 1867 HA PRO 42 HA PRO 42 23.728 12.355 -6.539 1868 HB2 PRO 42 2HB PRO 42 24.822 14.041 -4.518 1869 HB3 PRO 42 1HB PRO 42 25.726 13.335 -5.908 1870 HG2 PRO 42 2HG PRO 42 24.415 16.106 -5.756 1871 HG3 PRO 42 1HG PRO 42 26.095 15.690 -6.293 1872 HD2 PRO 42 2HD PRO 42 24.141 16.063 -8.132 1873 HD3 PRO 42 1HD PRO 42 25.229 14.615 -8.330 1874 H ASP 43 H ASP 43 21.391 14.977 -6.162 1875 HA ASP 43 HA ASP 43 20.481 13.492 -3.784 1876 HB2 ASP 43 2HB ASP 43 19.271 15.092 -2.839 1877 HB3 ASP 43 1HB ASP 43 20.821 15.873 -3.279 1878 H ALA 44 H ALA 44 19.837 14.094 -7.149 1879 HA ALA 44 HA ALA 44 17.188 13.383 -7.271 1880 HB1 ALA 44 1HB ALA 44 17.691 12.573 -9.595 1881 HB2 ALA 44 2HB ALA 44 19.455 12.596 -9.221 1882 HB3 ALA 44 3HB ALA 44 18.510 14.132 -9.243 1883 H ILE 45 H ILE 45 20.069 11.336 -6.911 1884 HA ILE 45 HA ILE 45 18.746 8.900 -7.394 1885 HB ILE 45 HB ILE 45 21.119 9.053 -7.678 1886 HG12 ILE 45 2HG1 ILE 45 22.034 7.210 -6.293 1887 HG13 ILE 45 1HG1 ILE 45 20.578 7.230 -5.251 1888 HG21 ILE 45 1HG2 ILE 45 21.288 9.829 -4.692 1889 HG22 ILE 45 2HG2 ILE 45 21.650 10.869 -6.118 1890 HG23 ILE 45 3HG2 ILE 45 22.681 9.456 -5.761 1891 HD11 ILE 45 3HD ILE 45 20.609 6.620 -8.291 1892 HD12 ILE 45 1HD ILE 45 20.508 5.401 -6.973 1893 HD13 ILE 45 2HD ILE 45 19.156 6.560 -7.214 1894 H TRP 46 H TRP 46 18.868 10.961 -4.556 1895 HA TRP 46 HA TRP 46 18.113 8.829 -2.779 1896 HB2 TRP 46 2HB TRP 46 19.159 11.503 -2.511 1897 HB3 TRP 46 1HB TRP 46 17.582 11.495 -1.674 1898 HD1 TRP 46 HD TRP 46 18.193 11.308 0.783 1899 HE1 TRP 46 1HE TRP 46 20.156 10.268 2.120 1900 HE3 TRP 46 3HE TRP 46 20.420 8.562 -2.888 1901 HZ2 TRP 46 2HZ TRP 46 21.787 7.932 1.880 1902 HZ3 TRP 46 3HZ TRP 46 22.098 6.878 -2.274 1903 HH2 TRP 46 HH TRP 46 22.735 6.527 0.101 1904 H TRP 47 H TRP 47 16.527 11.362 -4.664 1905 HA TRP 47 HA TRP 47 13.934 11.133 -3.611 1906 HB2 TRP 47 2HB TRP 47 14.504 12.965 -5.176 1907 HB3 TRP 47 1HB TRP 47 14.925 11.782 -6.455 1908 HD1 TRP 47 HD TRP 47 11.709 13.004 -4.535 1909 HE1 TRP 47 1HE TRP 47 9.780 12.849 -6.142 1910 HE3 TRP 47 3HE TRP 47 14.138 10.546 -8.283 1911 HZ2 TRP 47 2HZ TRP 47 9.221 11.377 -8.624 1912 HZ3 TRP 47 3HZ TRP 47 12.848 9.707 -10.214 1913 HH2 TRP 47 HH TRP 47 10.419 10.131 -10.395 1914 H SER 48 H SER 48 15.678 9.322 -6.205 1915 HA SER 48 HA SER 48 13.493 7.774 -6.913 1916 HB2 SER 48 2HB SER 48 16.469 6.994 -7.051 1917 HB3 SER 48 1HB SER 48 15.123 6.267 -8.012 1918 HG SER 48 1HG SER 48 16.108 7.818 -9.229 1919 H VAL 49 H VAL 49 15.210 7.578 -3.916 1920 HA VAL 49 HA VAL 49 14.865 4.706 -3.660 1921 HB VAL 49 HB VAL 49 15.513 6.809 -1.521 1922 HG11 VAL 49 1HG1 VAL 49 15.706 3.711 -1.504 1923 HG12 VAL 49 2HG1 VAL 49 14.557 4.713 -0.544 1924 HG13 VAL 49 3HG1 VAL 49 16.315 4.808 -0.207 1925 HG21 VAL 49 3HG2 VAL 49 17.878 5.971 -1.788 1926 HG22 VAL 49 1HG2 VAL 49 17.270 6.765 -3.274 1927 HG23 VAL 49 2HG2 VAL 49 17.356 4.968 -3.201 1928 H GLU 50 H GLU 50 13.341 7.781 -2.592 1929 HA GLU 50 HA GLU 50 11.418 6.422 -0.942 1930 HB2 GLU 50 2HB GLU 50 10.753 8.878 -0.460 1931 HB3 GLU 50 1HB GLU 50 12.417 8.397 -0.010 1932 HG2 GLU 50 2HG GLU 50 13.281 9.403 -2.187 1933 HG3 GLU 50 1HG GLU 50 11.618 9.999 -2.525 1934 H THR 51 H THR 51 10.775 5.375 -3.257 1935 HA THR 51 HA THR 51 8.294 6.642 -3.939 1936 HB THR 51 HB THR 51 9.893 8.051 -5.186 1937 HG1 THR 51 1HG THR 51 8.415 8.238 -6.454 1938 HG21 THR 51 3HG2 THR 51 11.192 7.304 -7.073 1939 HG22 THR 51 1HG2 THR 51 10.633 5.602 -6.902 1940 HG23 THR 51 2HG2 THR 51 11.671 6.358 -5.624 1941 H ALA 52 H ALA 52 10.813 4.292 -4.999 1942 HA ALA 52 HA ALA 52 8.908 2.653 -6.289 1943 HB1 ALA 52 1HB ALA 52 11.302 2.736 -7.002 1944 HB2 ALA 52 2HB ALA 52 10.808 1.058 -6.587 1945 HB3 ALA 52 3HB ALA 52 11.792 2.016 -5.418 1946 H THR 53 H THR 53 9.532 3.067 -3.003 1947 HA THR 53 HA THR 53 9.155 0.407 -2.076 1948 HB THR 53 HB THR 53 8.925 1.881 0.108 1949 HG1 THR 53 1HG THR 53 9.464 3.999 -0.170 1950 HG21 THR 53 3HG2 THR 53 11.395 2.298 0.137 1951 HG22 THR 53 1HG2 THR 53 11.483 2.111 -1.651 1952 HG23 THR 53 2HG2 THR 53 11.048 0.702 -0.613 1953 H THR 54 H THR 54 7.163 2.759 -3.488 1954 HA THR 54 HA THR 54 5.085 3.040 -3.749 1955 HB THR 54 HB THR 54 3.252 1.668 -3.044 1956 HG1 THR 54 1HG THR 54 5.205 0.542 -1.357 1957 HG21 THR 54 3HG2 THR 54 4.011 -0.459 -4.121 1958 HG22 THR 54 1HG2 THR 54 5.733 0.007 -3.917 1959 HG23 THR 54 2HG2 THR 54 4.664 0.968 -5.005 1960 H VAL 55 H VAL 55 6.826 4.208 -1.580 1961 HA VAL 55 HA VAL 55 4.626 5.441 -0.069 1962 HB VAL 55 HB VAL 55 7.518 5.167 0.899 1963 HG11 VAL 55 1HG1 VAL 55 6.228 7.161 1.749 1964 HG12 VAL 55 2HG1 VAL 55 6.486 5.959 3.061 1965 HG13 VAL 55 3HG1 VAL 55 4.878 6.082 2.257 1966 HG21 VAL 55 3HG2 VAL 55 6.525 2.887 0.851 1967 HG22 VAL 55 1HG2 VAL 55 5.012 3.501 1.612 1968 HG23 VAL 55 2HG2 VAL 55 6.557 3.482 2.546 1969 H GLY 56 H GLY 56 4.345 7.398 -1.061 1970 HA2 GLY 56 2HA GLY 56 6.735 8.779 -2.104 1971 HA3 GLY 56 1HA GLY 56 5.034 8.927 -2.723 1972 H TYR 57 H TYR 57 7.273 9.707 -0.144 1973 HA TYR 57 HA TYR 57 5.218 10.577 1.651 1974 HB2 TYR 57 2HB TYR 57 7.646 9.611 2.169 1975 HB3 TYR 57 1HB TYR 57 8.215 11.296 1.910 1976 HD1 TYR 57 1HD TYR 57 5.101 11.958 3.445 1977 HD2 TYR 57 2HD TYR 57 8.862 10.027 4.312 1978 HE1 TYR 57 1HE TYR 57 4.730 12.293 5.805 1979 HE2 TYR 57 2HE TYR 57 8.433 10.317 6.717 1980 HH TYR 57 HH TYR 57 5.351 11.147 7.973 1981 H GLY 58 H GLY 58 7.401 12.027 -0.799 1982 HA2 GLY 58 2HA GLY 58 6.228 13.953 -1.778 1983 HA3 GLY 58 1HA GLY 58 6.396 14.697 -0.127 1984 H ASP 59 H ASP 59 8.237 15.757 0.228 1985 HA ASP 59 HA ASP 59 10.145 16.670 0.011 1986 HB2 ASP 59 2HB ASP 59 11.181 14.500 0.604 1987 HB3 ASP 59 1HB ASP 59 11.404 14.141 -1.134 1988 H ARG 60 H ARG 60 10.281 14.739 -3.068 1989 HA ARG 60 HA ARG 60 10.081 17.284 -4.514 1990 HB2 ARG 60 2HB ARG 60 12.311 15.198 -4.786 1991 HB3 ARG 60 1HB ARG 60 11.875 16.280 -6.147 1992 HG2 ARG 60 2HG ARG 60 12.793 18.152 -5.197 1993 HG3 ARG 60 1HG ARG 60 12.391 17.682 -3.519 1994 HD2 ARG 60 2HD ARG 60 14.656 16.341 -5.157 1995 HD3 ARG 60 1HD ARG 60 14.908 17.739 -4.027 1996 HE ARG 60 HE ARG 60 13.635 16.182 -2.313 1997 HH11 ARG 60 1HH2 ARG 60 16.543 15.356 -4.318 1998 HH12 ARG 60 2HH2 ARG 60 16.669 13.799 -3.765 1999 HH21 ARG 60 1HH1 ARG 60 14.365 14.347 -1.105 2000 HH22 ARG 60 2HH1 ARG 60 14.410 13.067 -2.011 2001 H TYR 61 H TYR 61 9.326 16.804 -6.884 2002 HA TYR 61 HA TYR 61 8.415 14.204 -7.374 2003 HB2 TYR 61 2HB TYR 61 5.934 14.967 -7.628 2004 HB3 TYR 61 1HB TYR 61 6.484 14.695 -5.939 2005 HD1 TYR 61 1HD TYR 61 5.756 17.345 -8.483 2006 HD2 TYR 61 2HD TYR 61 6.527 16.499 -4.344 2007 HE1 TYR 61 1HE TYR 61 5.180 19.665 -7.913 2008 HE2 TYR 61 2HE TYR 61 5.906 18.814 -3.754 2009 HH TYR 61 HH TYR 61 4.415 20.697 -4.867 2010 HA PRO 62 HA PRO 62 9.043 16.626 -11.076 2011 HB2 PRO 62 2HB PRO 62 8.096 14.959 -13.106 2012 HB3 PRO 62 1HB PRO 62 9.586 14.595 -12.157 2013 HG2 PRO 62 2HG PRO 62 6.739 13.538 -11.638 2014 HG3 PRO 62 1HG PRO 62 8.280 12.580 -11.761 2015 HD2 PRO 62 2HD PRO 62 7.228 13.392 -9.314 2016 HD3 PRO 62 1HD PRO 62 9.034 13.392 -9.611 2017 H VAL 63 H VAL 63 7.825 17.729 -12.904 2018 HA VAL 63 HA VAL 63 5.257 18.414 -11.733 2019 HB VAL 63 HB VAL 63 6.895 20.114 -13.622 2020 HG11 VAL 63 1HG1 VAL 63 4.541 20.866 -13.498 2021 HG12 VAL 63 2HG1 VAL 63 5.533 21.935 -12.463 2022 HG13 VAL 63 3HG1 VAL 63 4.520 20.649 -11.705 2023 HG21 VAL 63 3HG2 VAL 63 6.910 19.867 -10.547 2024 HG22 VAL 63 1HG2 VAL 63 7.618 21.244 -11.470 2025 HG23 VAL 63 2HG2 VAL 63 8.292 19.600 -11.660 2026 H THR 64 H THR 64 5.842 19.141 -15.195 2027 HA THR 64 HA THR 64 3.401 17.535 -15.727 2028 HB THR 64 HB THR 64 3.781 20.543 -16.248 2029 HG1 THR 64 1HG THR 64 3.196 19.709 -14.107 2030 HG21 THR 64 3HG2 THR 64 1.433 20.498 -17.098 2031 HG22 THR 64 1HG2 THR 64 1.353 18.714 -16.892 2032 HG23 THR 64 2HG2 THR 64 2.463 19.444 -18.116 2033 H GLU 65 H GLU 65 5.880 19.806 -17.156 2034 HA GLU 65 HA GLU 65 5.302 18.780 -19.787 2035 HB2 GLU 65 2HB GLU 65 7.293 20.944 -18.885 2036 HB3 GLU 65 1HB GLU 65 6.816 20.560 -20.575 2037 HG2 GLU 65 2HG GLU 65 4.371 21.062 -19.890 2038 HG3 GLU 65 1HG GLU 65 5.009 21.668 -18.319 2039 H GLU 66 H GLU 66 7.097 18.084 -17.199 2040 HA GLU 66 HA GLU 66 9.474 16.995 -18.085 2041 HB2 GLU 66 2HB GLU 66 7.667 16.759 -15.585 2042 HB3 GLU 66 1HB GLU 66 9.321 16.086 -15.645 2043 HG2 GLU 66 2HG GLU 66 9.272 18.308 -14.496 2044 HG3 GLU 66 1HG GLU 66 10.309 18.303 -15.956 2045 H GLY 67 H GLY 67 6.199 15.948 -18.074 2046 HA2 GLY 67 2HA GLY 67 5.246 14.043 -18.853 2047 HA3 GLY 67 1HA GLY 67 6.887 13.246 -18.947 2048 H ARG 68 H ARG 68 4.310 14.411 -16.695 2049 HA ARG 68 HA ARG 68 5.515 13.874 -14.325 2050 HB2 ARG 68 2HB ARG 68 3.176 14.948 -14.737 2051 HB3 ARG 68 1HB ARG 68 2.543 13.274 -14.844 2052 HG2 ARG 68 2HG ARG 68 3.933 13.151 -12.448 2053 HG3 ARG 68 1HG ARG 68 3.570 14.879 -12.466 2054 HD2 ARG 68 2HD ARG 68 1.404 14.527 -11.818 2055 HD3 ARG 68 1HD ARG 68 1.097 13.330 -13.136 2056 HE ARG 68 HE ARG 68 1.863 12.853 -10.326 2057 HH11 ARG 68 1HH2 ARG 68 0.879 11.253 -13.349 2058 HH12 ARG 68 2HH2 ARG 68 1.219 9.672 -12.701 2059 HH21 ARG 68 1HH1 ARG 68 2.330 10.668 -9.628 2060 HH22 ARG 68 2HH1 ARG 68 1.997 9.340 -10.711 2061 H LYS 69 H LYS 69 4.309 11.650 -16.663 2062 HA LYS 69 HA LYS 69 4.000 9.373 -15.158 2063 HB2 LYS 69 2HB LYS 69 4.941 9.563 -18.062 2064 HB3 LYS 69 1HB LYS 69 4.368 8.079 -17.230 2065 HG2 LYS 69 2HG LYS 69 2.182 9.338 -16.705 2066 HG3 LYS 69 1HG LYS 69 2.678 10.574 -17.911 2067 HD2 LYS 69 2HD LYS 69 2.453 7.539 -18.425 2068 HD3 LYS 69 1HD LYS 69 1.119 8.699 -18.736 2069 HE2 LYS 69 2HE LYS 69 2.292 9.782 -20.554 2070 HE3 LYS 69 1HE LYS 69 3.870 9.006 -20.118 2071 HZ1 LYS 69 3HZ LYS 69 2.852 7.928 -21.993 2072 HZ2 LYS 69 1HZ LYS 69 1.457 7.523 -21.058 2073 HZ3 LYS 69 2HZ LYS 69 3.015 6.905 -20.668 2074 H VAL 70 H VAL 70 6.983 11.085 -15.630 2075 HA VAL 70 HA VAL 70 8.737 8.905 -15.590 2076 HB VAL 70 HB VAL 70 8.986 11.794 -14.667 2077 HG11 VAL 70 1HG1 VAL 70 10.581 10.542 -13.236 2078 HG12 VAL 70 2HG1 VAL 70 11.484 11.372 -14.541 2079 HG13 VAL 70 3HG1 VAL 70 11.173 9.597 -14.652 2080 HG21 VAL 70 3HG2 VAL 70 8.763 11.263 -17.153 2081 HG22 VAL 70 1HG2 VAL 70 10.170 10.151 -17.020 2082 HG23 VAL 70 2HG2 VAL 70 10.377 11.923 -16.744 2083 H ALA 71 H ALA 71 6.955 10.547 -12.908 2084 HA ALA 71 HA ALA 71 8.309 8.971 -10.905 2085 HB1 ALA 71 1HB ALA 71 5.637 10.539 -10.807 2086 HB2 ALA 71 2HB ALA 71 7.232 11.080 -10.173 2087 HB3 ALA 71 3HB ALA 71 6.390 9.709 -9.398 2088 H GLU 72 H GLU 72 5.126 8.983 -12.435 2089 HA GLU 72 HA GLU 72 3.811 6.949 -11.337 2090 HB2 GLU 72 2HB GLU 72 3.152 8.577 -13.246 2091 HB3 GLU 72 1HB GLU 72 3.964 7.457 -14.380 2092 HG2 GLU 72 2HG GLU 72 1.574 7.076 -14.489 2093 HG3 GLU 72 1HG GLU 72 2.334 5.632 -13.712 2094 H GLN 73 H GLN 73 6.040 6.641 -14.134 2095 HA GLN 73 HA GLN 73 5.488 3.895 -14.459 2096 HB2 GLN 73 2HB GLN 73 6.153 5.646 -16.203 2097 HB3 GLN 73 1HB GLN 73 7.846 5.464 -15.652 2098 HG2 GLN 73 2HG GLN 73 7.853 3.086 -16.407 2099 HG3 GLN 73 1HG GLN 73 6.075 3.138 -16.699 2100 HE21 GLN 73 1HE2 GLN 73 8.924 3.224 -18.451 2101 HE22 GLN 73 2HE2 GLN 73 8.496 4.346 -19.703 2102 H VAL 74 H VAL 74 7.877 5.686 -12.552 2103 HA VAL 74 HA VAL 74 9.614 3.420 -12.213 2104 HB VAL 74 HB VAL 74 9.371 6.111 -10.782 2105 HG11 VAL 74 1HG1 VAL 74 11.585 5.544 -9.720 2106 HG12 VAL 74 2HG1 VAL 74 11.466 3.860 -10.364 2107 HG13 VAL 74 3HG1 VAL 74 10.283 4.465 -9.143 2108 HG21 VAL 74 3HG2 VAL 74 11.503 4.963 -12.725 2109 HG22 VAL 74 1HG2 VAL 74 11.414 6.644 -12.067 2110 HG23 VAL 74 2HG2 VAL 74 10.173 6.066 -13.220 2111 H MET 75 H MET 75 7.010 5.072 -10.325 2112 HA MET 75 HA MET 75 7.134 3.418 -8.100 2113 HB2 MET 75 2HB MET 75 4.688 4.818 -9.337 2114 HB3 MET 75 1HB MET 75 4.689 4.011 -7.727 2115 HG2 MET 75 2HG MET 75 6.553 5.525 -6.989 2116 HG3 MET 75 1HG MET 75 6.404 6.447 -8.505 2117 HE1 MET 75 3HE MET 75 2.824 8.103 -8.209 2118 HE2 MET 75 1HE MET 75 3.167 6.553 -9.040 2119 HE3 MET 75 2HE MET 75 4.323 7.931 -9.180 2120 H LYS 76 H LYS 76 5.267 3.017 -11.149 2121 HA LYS 76 HA LYS 76 3.820 0.823 -10.232 2122 HB2 LYS 76 2HB LYS 76 3.409 2.278 -12.378 2123 HB3 LYS 76 1HB LYS 76 4.504 1.111 -13.192 2124 HG2 LYS 76 2HG LYS 76 2.952 -0.767 -12.332 2125 HG3 LYS 76 1HG LYS 76 1.878 0.512 -11.663 2126 HD2 LYS 76 2HD LYS 76 1.558 1.404 -14.018 2127 HD3 LYS 76 1HD LYS 76 2.588 0.047 -14.622 2128 HE2 LYS 76 2HE LYS 76 0.904 -1.593 -13.550 2129 HE3 LYS 76 1HE LYS 76 -0.171 -0.177 -13.205 2130 HZ1 LYS 76 3HZ LYS 76 -0.765 -1.324 -15.278 2131 HZ2 LYS 76 1HZ LYS 76 0.785 -1.141 -15.859 2132 HZ3 LYS 76 2HZ LYS 76 -0.200 0.239 -15.637 2133 H ALA 77 H ALA 77 7.128 1.007 -11.442 2134 HA ALA 77 HA ALA 77 7.354 -1.725 -12.163 2135 HB1 ALA 77 1HB ALA 77 9.041 0.022 -12.897 2136 HB2 ALA 77 2HB ALA 77 9.823 -1.366 -12.041 2137 HB3 ALA 77 3HB ALA 77 9.563 0.197 -11.183 2138 H GLY 78 H GLY 78 7.494 0.033 -9.093 2139 HA2 GLY 78 2HA GLY 78 8.737 -2.074 -7.611 2140 HA3 GLY 78 1HA GLY 78 7.852 -0.625 -6.995 2141 H ILE 79 H ILE 79 5.419 -1.115 -8.425 2142 HA ILE 79 HA ILE 79 4.075 -2.783 -6.630 2143 HB ILE 79 HB ILE 79 3.244 -1.795 -9.407 2144 HG12 ILE 79 2HG1 ILE 79 3.803 0.000 -7.624 2145 HG13 ILE 79 1HG1 ILE 79 2.198 0.071 -8.407 2146 HG21 ILE 79 1HG2 ILE 79 1.803 -3.699 -8.833 2147 HG22 ILE 79 2HG2 ILE 79 0.866 -2.190 -8.566 2148 HG23 ILE 79 3HG2 ILE 79 1.557 -3.084 -7.162 2149 HD11 ILE 79 3HD ILE 79 2.648 -1.216 -5.635 2150 HD12 ILE 79 1HD ILE 79 2.137 0.491 -5.903 2151 HD13 ILE 79 2HD ILE 79 1.077 -0.856 -6.428 2152 H GLU 80 H GLU 80 5.192 -3.319 -10.025 2153 HA GLU 80 HA GLU 80 4.166 -5.879 -10.352 2154 HB2 GLU 80 2HB GLU 80 6.821 -4.728 -11.443 2155 HB3 GLU 80 1HB GLU 80 6.042 -6.239 -12.023 2156 HG2 GLU 80 2HG GLU 80 4.089 -4.952 -12.870 2157 HG3 GLU 80 1HG GLU 80 4.817 -3.412 -12.272 2158 H VAL 81 H VAL 81 7.373 -4.851 -9.130 2159 HA VAL 81 HA VAL 81 8.434 -7.411 -8.810 2160 HB VAL 81 HB VAL 81 9.091 -4.669 -7.638 2161 HG11 VAL 81 1HG1 VAL 81 9.948 -6.216 -5.939 2162 HG12 VAL 81 2HG1 VAL 81 11.332 -5.704 -6.955 2163 HG13 VAL 81 3HG1 VAL 81 10.601 -7.330 -7.196 2164 HG21 VAL 81 3HG2 VAL 81 9.394 -5.068 -10.127 2165 HG22 VAL 81 1HG2 VAL 81 10.445 -6.484 -9.761 2166 HG23 VAL 81 2HG2 VAL 81 10.966 -4.826 -9.300 2167 H PHE 82 H PHE 82 6.926 -5.191 -6.340 2168 HA PHE 82 HA PHE 82 7.237 -7.273 -4.372 2169 HB2 PHE 82 2HB PHE 82 5.777 -4.565 -4.210 2170 HB3 PHE 82 1HB PHE 82 6.034 -5.684 -2.815 2171 HD1 PHE 82 2HD PHE 82 8.737 -6.611 -2.909 2172 HD2 PHE 82 1HD PHE 82 7.212 -2.736 -4.007 2173 HE1 PHE 82 2HE PHE 82 10.948 -5.618 -2.474 2174 HE2 PHE 82 1HE PHE 82 9.416 -1.742 -3.530 2175 HZ PHE 82 HZ PHE 82 11.296 -3.175 -2.770 2176 H ALA 83 H ALA 83 4.989 -6.898 -6.851 2177 HA ALA 83 HA ALA 83 2.824 -8.160 -5.356 2178 HB1 ALA 83 1HB ALA 83 1.685 -8.324 -7.584 2179 HB2 ALA 83 2HB ALA 83 3.153 -7.625 -8.374 2180 HB3 ALA 83 3HB ALA 83 2.184 -6.640 -7.217 2181 H LEU 84 H LEU 84 5.422 -8.912 -7.673 2182 HA LEU 84 HA LEU 84 4.629 -11.447 -8.398 2183 HB2 LEU 84 2HB LEU 84 6.358 -10.000 -9.497 2184 HB3 LEU 84 1HB LEU 84 7.510 -10.359 -8.181 2185 HG LEU 84 HG LEU 84 6.252 -12.657 -9.769 2186 HD11 LEU 84 1HD1 LEU 84 6.914 -11.019 -11.514 2187 HD12 LEU 84 2HD1 LEU 84 7.988 -12.464 -11.542 2188 HD13 LEU 84 3HD1 LEU 84 8.576 -10.918 -10.820 2189 HD21 LEU 84 3HD2 LEU 84 8.504 -13.724 -9.488 2190 HD22 LEU 84 1HD2 LEU 84 7.797 -13.294 -7.900 2191 HD23 LEU 84 2HD2 LEU 84 9.100 -12.271 -8.607 2192 H VAL 85 H VAL 85 6.474 -10.365 -5.560 2193 HA VAL 85 HA VAL 85 7.468 -12.822 -4.791 2194 HB VAL 85 HB VAL 85 7.849 -11.878 -2.582 2195 HG11 VAL 85 1HG1 VAL 85 8.298 -9.762 -4.809 2196 HG12 VAL 85 2HG1 VAL 85 9.287 -11.247 -4.611 2197 HG13 VAL 85 3HG1 VAL 85 9.264 -9.995 -3.318 2198 HG21 VAL 85 3HG2 VAL 85 5.675 -10.707 -2.193 2199 HG22 VAL 85 1HG2 VAL 85 6.003 -9.591 -3.560 2200 HG23 VAL 85 2HG2 VAL 85 7.016 -9.527 -2.078 2201 H THR 86 H THR 86 4.163 -11.942 -4.846 2202 HA THR 86 HA THR 86 3.147 -13.349 -2.693 2203 HB THR 86 HB THR 86 1.858 -13.004 -5.442 2204 HG1 THR 86 1HG THR 86 2.283 -11.015 -4.808 2205 HG21 THR 86 3HG2 THR 86 -0.277 -13.009 -4.065 2206 HG22 THR 86 1HG2 THR 86 0.676 -13.382 -2.588 2207 HG23 THR 86 2HG2 THR 86 0.580 -14.581 -3.934 2208 H ALA 87 H ALA 87 4.601 -14.510 -5.681 2209 HA ALA 87 HA ALA 87 3.564 -17.115 -5.713 2210 HB1 ALA 87 1HB ALA 87 6.392 -16.149 -6.509 2211 HB2 ALA 87 2HB ALA 87 4.959 -16.099 -7.584 2212 HB3 ALA 87 3HB ALA 87 5.609 -17.686 -7.039 2213 H ALA 88 H ALA 88 5.845 -15.538 -3.549 2214 HA ALA 88 HA ALA 88 6.858 -18.053 -2.510 2215 HB1 ALA 88 1HB ALA 88 8.144 -16.660 -0.899 2216 HB2 ALA 88 2HB ALA 88 7.335 -15.177 -1.516 2217 HB3 ALA 88 3HB ALA 88 8.444 -16.108 -2.586 2218 H LEU 89 H LEU 89 4.689 -15.332 -1.663 2219 HA LEU 89 HA LEU 89 4.279 -16.061 0.970 2220 HB2 LEU 89 2HB LEU 89 2.327 -14.492 -0.806 2221 HB3 LEU 89 1HB LEU 89 2.377 -14.497 0.986 2222 HG LEU 89 HG LEU 89 4.579 -13.413 -0.881 2223 HD11 LEU 89 1HD1 LEU 89 2.607 -11.889 0.933 2224 HD12 LEU 89 2HD1 LEU 89 2.500 -12.013 -0.861 2225 HD13 LEU 89 3HD1 LEU 89 3.894 -11.177 -0.099 2226 HD21 LEU 89 3HD2 LEU 89 5.653 -14.247 1.181 2227 HD22 LEU 89 1HD2 LEU 89 4.428 -13.402 2.199 2228 HD23 LEU 89 2HD2 LEU 89 5.592 -12.452 1.212 2229 H ALA 90 H ALA 90 2.335 -16.904 -1.930 2230 HA ALA 90 HA ALA 90 0.284 -18.121 -0.387 2231 HB1 ALA 90 1HB ALA 90 -0.511 -19.043 -2.572 2232 HB2 ALA 90 2HB ALA 90 1.034 -18.498 -3.339 2233 HB3 ALA 90 3HB ALA 90 -0.130 -17.286 -2.691 2234 H THR 91 H THR 91 3.464 -19.148 -0.906 2235 HA THR 91 HA THR 91 2.716 -21.977 -0.576 2236 HB THR 91 HB THR 91 5.475 -22.025 -0.564 2237 HG1 THR 91 1HG THR 91 5.240 -19.685 -1.234 2238 HG21 THR 91 3HG2 THR 91 3.933 -23.516 -1.816 2239 HG22 THR 91 1HG2 THR 91 5.188 -22.843 -2.925 2240 HG23 THR 91 2HG2 THR 91 3.514 -22.168 -2.930 2241 H ASP 92 H ASP 92 3.286 -19.204 1.369 2242 HA ASP 92 HA ASP 92 5.209 -20.409 3.018 2243 HB2 ASP 92 2HB ASP 92 4.570 -17.833 2.711 2244 HB3 ASP 92 1HB ASP 92 3.469 -18.152 4.094 2245 H PHE 93 H PHE 93 1.648 -20.212 3.182 2246 HA PHE 93 HA PHE 93 1.602 -21.639 5.672 2247 HB2 PHE 93 2HB PHE 93 -0.789 -21.615 5.534 2248 HB3 PHE 93 1HB PHE 93 -0.199 -20.023 4.982 2249 HD1 PHE 93 2HD PHE 93 -0.196 -19.550 2.391 2250 HD2 PHE 93 1HD PHE 93 -2.078 -22.962 4.194 2251 HE1 PHE 93 2HE PHE 93 -1.445 -19.982 0.302 2252 HE2 PHE 93 1HE PHE 93 -3.275 -23.428 2.094 2253 HZ PHE 93 HZ PHE 93 -2.972 -21.914 0.132 2254 H VAL 94 H VAL 94 2.055 -22.642 2.411 2255 HA VAL 94 HA VAL 94 0.599 -25.099 2.563 2256 HB VAL 94 HB VAL 94 2.782 -24.218 0.622 2257 HG11 VAL 94 1HG1 VAL 94 1.770 -25.991 -0.871 2258 HG12 VAL 94 2HG1 VAL 94 0.714 -26.527 0.486 2259 HG13 VAL 94 3HG1 VAL 94 2.503 -26.704 0.607 2260 HG21 VAL 94 3HG2 VAL 94 -0.321 -24.112 0.461 2261 HG22 VAL 94 1HG2 VAL 94 0.815 -23.649 -0.854 2262 HG23 VAL 94 2HG2 VAL 94 0.752 -22.688 0.653 2263 H ARG 95 H ARG 95 3.738 -23.886 3.460 2264 HA ARG 95 HA ARG 95 5.225 -26.169 3.825 2265 HB2 ARG 95 2HB ARG 95 5.963 -23.697 4.079 2266 HB3 ARG 95 1HB ARG 95 5.137 -23.689 5.662 2267 HG2 ARG 95 2HG ARG 95 6.728 -25.597 6.379 2268 HG3 ARG 95 1HG ARG 95 7.630 -25.319 4.858 2269 HD2 ARG 95 2HD ARG 95 7.151 -23.283 7.167 2270 HD3 ARG 95 1HD ARG 95 8.670 -24.180 6.843 2271 HE ARG 95 HE ARG 95 9.076 -22.891 4.883 2272 HH11 ARG 95 1HH2 ARG 95 6.287 -21.530 6.857 2273 HH12 ARG 95 2HH2 ARG 95 6.203 -20.110 5.943 2274 HH21 ARG 95 1HH1 ARG 95 9.051 -20.701 3.869 2275 HH22 ARG 95 2HH1 ARG 95 7.716 -19.663 4.204 2276 H ARG 96 H ARG 96 2.382 -25.082 5.651 2277 HA ARG 96 HA ARG 96 3.021 -26.130 8.126 2278 HB2 ARG 96 2HB ARG 96 0.753 -25.940 8.774 2279 HB3 ARG 96 1HB ARG 96 1.019 -24.630 7.577 2280 HG2 ARG 96 2HG ARG 96 0.091 -26.337 5.822 2281 HG3 ARG 96 1HG ARG 96 -0.457 -27.313 7.229 2282 HD2 ARG 96 2HD ARG 96 -1.908 -25.419 8.005 2283 HD3 ARG 96 1HD ARG 96 -1.403 -24.427 6.572 2284 HE ARG 96 HE ARG 96 -3.078 -26.918 6.608 2285 HH11 ARG 96 1HH2 ARG 96 -0.918 -25.015 4.466 2286 HH12 ARG 96 2HH2 ARG 96 -1.647 -25.622 3.033 2287 HH21 ARG 96 1HH1 ARG 96 -4.242 -27.467 4.648 2288 HH22 ARG 96 2HH1 ARG 96 -3.241 -27.492 3.283 2289 H GLU 97 H GLU 97 1.899 -27.816 5.200 2290 HA GLU 97 HA GLU 97 1.065 -30.149 6.651 2291 HB2 GLU 97 2HB GLU 97 0.238 -29.231 4.286 2292 HB3 GLU 97 1HB GLU 97 1.662 -30.103 3.657 2293 HG2 GLU 97 2HG GLU 97 -0.090 -31.654 3.392 2294 HG3 GLU 97 1HG GLU 97 0.664 -32.225 4.916 2295 H GLU 98 H GLU 98 4.022 -28.839 5.341 2296 HA GLU 98 HA GLU 98 5.443 -31.338 5.232 2297 HB2 GLU 98 2HB GLU 98 6.471 -28.437 5.283 2298 HB3 GLU 98 1HB GLU 98 7.512 -29.864 5.079 2299 HG2 GLU 98 2HG GLU 98 5.198 -29.351 3.099 2300 HG3 GLU 98 1HG GLU 98 6.740 -28.431 2.982 2301 H GLU 99 H GLU 99 5.124 -28.474 7.409 2302 HA GLU 99 HA GLU 99 6.919 -29.267 9.350 2303 HB2 GLU 99 2HB GLU 99 5.916 -26.953 9.135 2304 HB3 GLU 99 1HB GLU 99 4.373 -27.596 9.785 2305 HG2 GLU 99 2HG GLU 99 5.543 -28.171 11.951 2306 HG3 GLU 99 1HG GLU 99 7.095 -27.556 11.275 2307 H ARG 100 H ARG 100 3.503 -30.044 8.959 2308 HA ARG 100 HA ARG 100 2.786 -31.194 11.262 2309 HB2 ARG 100 2HB ARG 100 1.442 -30.833 9.133 2310 HB3 ARG 100 1HB ARG 100 2.203 -32.304 8.443 2311 HG2 ARG 100 2HG ARG 100 1.121 -33.679 10.236 2312 HG3 ARG 100 1HG ARG 100 0.413 -32.182 10.950 2313 HD2 ARG 100 2HD ARG 100 -0.883 -31.765 8.813 2314 HD3 ARG 100 1HD ARG 100 -0.149 -33.257 8.085 2315 HE ARG 100 HE ARG 100 -1.418 -33.825 10.661 2316 HH11 ARG 100 1HH2 ARG 100 -2.284 -33.106 7.194 2317 HH12 ARG 100 2HH2 ARG 100 -3.665 -34.115 7.238 2318 HH21 ARG 100 1HH1 ARG 100 -3.224 -35.158 10.672 2319 HH22 ARG 100 2HH1 ARG 100 -4.210 -35.447 9.290 2320 H ARG 101 H ARG 101 4.708 -32.857 8.697 2321 HA ARG 101 HA ARG 101 5.101 -35.107 10.592 2322 HB2 ARG 101 2HB ARG 101 5.668 -34.938 7.570 2323 HB3 ARG 101 1HB ARG 101 6.180 -36.281 8.649 2324 HG2 ARG 101 2HG ARG 101 3.741 -36.600 9.308 2325 HG3 ARG 101 1HG ARG 101 3.301 -35.518 7.934 2326 HD2 ARG 101 2HD ARG 101 4.500 -37.089 6.328 2327 HD3 ARG 101 1HD ARG 101 5.034 -38.087 7.723 2328 HE ARG 101 HE ARG 101 2.979 -38.991 8.023 2329 HH11 ARG 101 1HH2 ARG 101 2.835 -36.654 5.253 2330 HH12 ARG 101 2HH2 ARG 101 1.955 -37.774 4.307 2331 HH21 ARG 101 1HH1 ARG 101 0.827 -39.592 7.269 2332 HH22 ARG 101 2HH1 ARG 101 0.374 -39.224 5.656 2333 H GLY 102 H GLY 102 6.639 -32.365 9.032 2334 HA2 GLY 102 2HA GLY 102 8.685 -31.519 9.357 2335 HA3 GLY 102 1HA GLY 102 9.196 -33.009 10.251 2336 H HIS 103 H HIS 103 7.641 -32.511 7.054 2337 HA HIS 103 HA HIS 103 9.353 -34.517 5.885 2338 HB2 HIS 103 2HB HIS 103 6.993 -34.308 5.083 2339 HB3 HIS 103 1HB HIS 103 7.360 -32.655 4.489 2340 HD1 HIS 103 1HD HIS 103 8.789 -36.287 3.761 2341 HD2 HIS 103 2HD HIS 103 8.005 -32.588 1.848 2342 HE1 HIS 103 1HE HIS 103 9.250 -36.581 1.365 2343 HE2 HIS 103 2HE HIS 103 8.783 -34.379 0.201 2344 H1 SER 1 H SER 1 -3.181 -23.796 18.206 2345 HA SER 1 HA SER 1 -5.707 -22.341 18.267 2346 HB2 SER 1 2HB SER 1 -4.272 -20.504 19.379 2347 HB3 SER 1 1HB SER 1 -4.458 -22.001 20.354 2348 HG SER 1 1HG SER 1 -2.265 -21.078 18.888 2349 H ALA 2 H ALA 2 -4.268 -23.460 15.955 2350 HA ALA 2 HA ALA 2 -3.795 -22.946 13.894 2351 HB1 ALA 2 1HB ALA 2 -5.678 -21.346 13.824 2352 HB2 ALA 2 2HB ALA 2 -4.295 -20.759 12.831 2353 HB3 ALA 2 3HB ALA 2 -4.603 -20.049 14.450 2354 H ASP 3 H ASP 3 -1.626 -23.376 13.735 2355 HA ASP 3 HA ASP 3 0.357 -21.852 14.987 2356 HB2 ASP 3 2HB ASP 3 0.523 -23.751 12.577 2357 HB3 ASP 3 1HB ASP 3 1.979 -22.900 13.197 2358 H HIS 4 H HIS 4 -1.312 -21.251 11.996 2359 HA HIS 4 HA HIS 4 0.796 -19.597 10.943 2360 HB2 HIS 4 2HB HIS 4 -1.135 -18.758 9.332 2361 HB3 HIS 4 1HB HIS 4 -0.274 -20.300 9.122 2362 HD1 HIS 4 1HD HIS 4 -3.624 -19.120 10.642 2363 HD2 HIS 4 2HD HIS 4 -1.789 -22.569 9.009 2364 HE1 HIS 4 1HE HIS 4 -5.401 -20.896 10.401 2365 HE2 HIS 4 2HE HIS 4 -4.271 -22.992 9.479 2366 H GLU 5 H GLU 5 -1.853 -19.033 13.213 2367 HA GLU 5 HA GLU 5 -1.706 -16.186 12.833 2368 HB2 GLU 5 2HB GLU 5 -3.248 -18.049 14.693 2369 HB3 GLU 5 1HB GLU 5 -3.041 -16.320 15.114 2370 HG2 GLU 5 2HG GLU 5 -5.164 -16.482 14.075 2371 HG3 GLU 5 1HG GLU 5 -4.069 -15.598 12.965 2372 H ARG 6 H ARG 6 -0.179 -18.704 14.797 2373 HA ARG 6 HA ARG 6 1.008 -16.951 16.683 2374 HB2 ARG 6 2HB ARG 6 1.826 -19.759 15.731 2375 HB3 ARG 6 1HB ARG 6 2.638 -18.872 17.062 2376 HG2 ARG 6 2HG ARG 6 0.638 -18.855 18.428 2377 HG3 ARG 6 1HG ARG 6 -0.383 -19.511 17.106 2378 HD2 ARG 6 2HD ARG 6 0.373 -21.188 19.009 2379 HD3 ARG 6 1HD ARG 6 0.536 -21.710 17.290 2380 HE ARG 6 HE ARG 6 2.853 -21.476 17.334 2381 HH11 ARG 6 1HH2 ARG 6 1.576 -20.791 20.707 2382 HH12 ARG 6 2HH2 ARG 6 3.142 -20.485 21.304 2383 HH21 ARG 6 1HH1 ARG 6 4.921 -21.340 18.371 2384 HH22 ARG 6 2HH1 ARG 6 5.068 -20.774 20.002 2385 H GLU 7 H GLU 7 2.155 -18.333 13.541 2386 HA GLU 7 HA GLU 7 4.669 -17.082 13.780 2387 HB2 GLU 7 2HB GLU 7 4.045 -19.129 12.360 2388 HB3 GLU 7 1HB GLU 7 3.455 -17.980 11.113 2389 HG2 GLU 7 2HG GLU 7 5.722 -17.048 10.834 2390 HG3 GLU 7 1HG GLU 7 6.294 -17.856 12.336 2391 H ALA 8 H ALA 8 1.598 -16.096 12.229 2392 HA ALA 8 HA ALA 8 2.524 -13.759 11.017 2393 HB1 ALA 8 1HB ALA 8 0.255 -14.702 10.534 2394 HB2 ALA 8 2HB ALA 8 0.102 -13.014 11.148 2395 HB3 ALA 8 3HB ALA 8 -0.244 -14.403 12.238 2396 H GLN 9 H GLN 9 1.085 -14.284 14.308 2397 HA GLN 9 HA GLN 9 1.158 -11.572 14.992 2398 HB2 GLN 9 2HB GLN 9 -0.249 -13.328 16.140 2399 HB3 GLN 9 1HB GLN 9 1.240 -14.012 16.869 2400 HG2 GLN 9 2HG GLN 9 1.612 -11.850 18.120 2401 HG3 GLN 9 1HG GLN 9 0.166 -11.137 17.306 2402 HE21 GLN 9 1HE2 GLN 9 -1.283 -10.961 19.065 2403 HE22 GLN 9 2HE2 GLN 9 -1.845 -12.332 19.974 2404 H LYS 10 H LYS 10 3.542 -14.194 15.326 2405 HA LYS 10 HA LYS 10 5.301 -12.852 17.039 2406 HB2 LYS 10 2HB LYS 10 5.327 -15.280 16.657 2407 HB3 LYS 10 1HB LYS 10 5.792 -15.057 14.944 2408 HG2 LYS 10 2HG LYS 10 7.616 -13.933 17.135 2409 HG3 LYS 10 1HG LYS 10 7.541 -15.711 16.893 2410 HD2 LYS 10 2HD LYS 10 8.107 -15.468 14.494 2411 HD3 LYS 10 1HD LYS 10 8.245 -13.684 14.683 2412 HE2 LYS 10 2HE LYS 10 10.155 -13.952 16.271 2413 HE3 LYS 10 1HE LYS 10 9.991 -15.755 16.187 2414 HZ1 LYS 10 3HZ LYS 10 10.446 -15.625 13.813 2415 HZ2 LYS 10 1HZ LYS 10 11.711 -15.020 14.744 2416 HZ3 LYS 10 2HZ LYS 10 10.685 -13.921 13.930 2417 H ALA 11 H ALA 11 4.795 -12.661 13.532 2418 HA ALA 11 HA ALA 11 7.218 -11.401 12.900 2419 HB1 ALA 11 1HB ALA 11 5.648 -12.444 11.195 2420 HB2 ALA 11 2HB ALA 11 6.157 -10.775 10.771 2421 HB3 ALA 11 3HB ALA 11 4.518 -11.067 11.453 2422 H GLU 12 H GLU 12 4.015 -10.115 13.949 2423 HA GLU 12 HA GLU 12 4.662 -7.417 13.564 2424 HB2 GLU 12 2HB GLU 12 2.728 -8.535 15.685 2425 HB3 GLU 12 1HB GLU 12 2.857 -6.836 15.112 2426 HG2 GLU 12 2HG GLU 12 2.279 -7.798 12.724 2427 HG3 GLU 12 1HG GLU 12 1.748 -9.282 13.607 2428 H GLU 13 H GLU 13 5.441 -9.669 16.156 2429 HA GLU 13 HA GLU 13 5.975 -7.728 18.119 2430 HB2 GLU 13 2HB GLU 13 5.525 -10.317 18.338 2431 HB3 GLU 13 1HB GLU 13 7.287 -10.494 18.074 2432 HG2 GLU 13 2HG GLU 13 7.664 -8.991 20.105 2433 HG3 GLU 13 1HG GLU 13 5.878 -8.885 20.329 2434 H GLU 14 H GLU 14 7.897 -9.016 15.405 2435 HA GLU 14 HA GLU 14 10.305 -7.861 16.537 2436 HB2 GLU 14 2HB GLU 14 10.496 -9.953 15.249 2437 HB3 GLU 14 1HB GLU 14 10.101 -9.042 13.744 2438 HG2 GLU 14 2HG GLU 14 12.103 -7.656 13.969 2439 HG3 GLU 14 1HG GLU 14 12.321 -8.144 15.688 2440 H LEU 15 H LEU 15 7.659 -6.835 14.463 2441 HA LEU 15 HA LEU 15 9.016 -4.774 13.167 2442 HB2 LEU 15 2HB LEU 15 6.643 -5.557 12.663 2443 HB3 LEU 15 1HB LEU 15 6.081 -4.699 14.118 2444 HG LEU 15 HG LEU 15 6.782 -2.520 13.178 2445 HD11 LEU 15 1HD1 LEU 15 7.827 -4.142 10.769 2446 HD12 LEU 15 2HD1 LEU 15 8.772 -3.063 11.864 2447 HD13 LEU 15 3HD1 LEU 15 7.559 -2.363 10.753 2448 HD21 LEU 15 3HD2 LEU 15 5.121 -2.357 11.338 2449 HD22 LEU 15 1HD2 LEU 15 4.499 -3.399 12.666 2450 HD23 LEU 15 2HD2 LEU 15 5.113 -4.141 11.146 2451 H GLN 16 H GLN 16 7.369 -4.913 16.308 2452 HA GLN 16 HA GLN 16 7.601 -2.249 17.052 2453 HB2 GLN 16 2HB GLN 16 7.747 -4.738 18.865 2454 HB3 GLN 16 1HB GLN 16 7.398 -3.062 19.413 2455 HG2 GLN 16 2HG GLN 16 5.296 -3.056 18.012 2456 HG3 GLN 16 1HG GLN 16 5.620 -4.768 17.534 2457 HE21 GLN 16 1HE2 GLN 16 3.238 -4.351 18.823 2458 HE22 GLN 16 2HE2 GLN 16 3.288 -4.835 20.476 2459 H LYS 17 H LYS 17 9.958 -4.876 17.204 2460 HA LYS 17 HA LYS 17 11.791 -3.643 18.966 2461 HB2 LYS 17 2HB LYS 17 11.649 -6.155 18.322 2462 HB3 LYS 17 1HB LYS 17 12.315 -5.702 16.729 2463 HG2 LYS 17 2HG LYS 17 14.348 -4.702 18.195 2464 HG3 LYS 17 1HG LYS 17 13.656 -5.755 19.471 2465 HD2 LYS 17 2HD LYS 17 15.292 -7.117 18.431 2466 HD3 LYS 17 1HD LYS 17 13.755 -7.679 17.684 2467 HE2 LYS 17 2HE LYS 17 14.268 -6.099 15.687 2468 HE3 LYS 17 1HE LYS 17 15.838 -5.705 16.485 2469 HZ1 LYS 17 3HZ LYS 17 14.985 -8.308 15.271 2470 HZ2 LYS 17 1HZ LYS 17 16.361 -8.171 16.282 2471 HZ3 LYS 17 2HZ LYS 17 16.230 -7.245 14.878 2472 H VAL 18 H VAL 18 11.431 -3.819 15.397 2473 HA VAL 18 HA VAL 18 13.802 -2.449 14.786 2474 HB VAL 18 HB VAL 18 11.238 -2.814 13.154 2475 HG11 VAL 18 1HG1 VAL 18 12.742 -2.346 11.162 2476 HG12 VAL 18 2HG1 VAL 18 14.061 -1.862 12.289 2477 HG13 VAL 18 3HG1 VAL 18 12.534 -0.905 12.207 2478 HG21 VAL 18 3HG2 VAL 18 12.391 -4.969 13.832 2479 HG22 VAL 18 1HG2 VAL 18 13.942 -4.340 13.177 2480 HG23 VAL 18 2HG2 VAL 18 12.555 -4.662 12.075 2481 H LEU 19 H LEU 19 10.447 -1.332 15.413 2482 HA LEU 19 HA LEU 19 10.750 1.312 14.683 2483 HB2 LEU 19 2HB LEU 19 9.235 0.251 17.158 2484 HB3 LEU 19 1HB LEU 19 9.058 1.900 16.481 2485 HG LEU 19 HG LEU 19 8.293 -0.695 15.025 2486 HD11 LEU 19 1HD1 LEU 19 6.819 -0.203 16.986 2487 HD12 LEU 19 2HD1 LEU 19 5.951 0.043 15.422 2488 HD13 LEU 19 3HD1 LEU 19 6.549 1.463 16.363 2489 HD21 LEU 19 3HD2 LEU 19 8.005 2.268 14.249 2490 HD22 LEU 19 1HD2 LEU 19 7.112 0.926 13.457 2491 HD23 LEU 19 2HD2 LEU 19 8.908 0.993 13.357 2492 H GLU 20 H GLU 20 11.621 -0.252 17.827 2493 HA GLU 20 HA GLU 20 12.282 2.203 19.072 2494 HB2 GLU 20 2HB GLU 20 13.225 -0.614 19.863 2495 HB3 GLU 20 1HB GLU 20 13.439 0.901 20.796 2496 HG2 GLU 20 2HG GLU 20 10.810 1.110 20.706 2497 HG3 GLU 20 1HG GLU 20 10.832 -0.620 20.202 2498 H GLU 21 H GLU 21 14.222 -0.346 17.450 2499 HA GLU 21 HA GLU 21 16.734 0.817 17.928 2500 HB2 GLU 21 2HB GLU 21 15.706 -0.935 15.608 2501 HB3 GLU 21 1HB GLU 21 17.441 -0.560 15.873 2502 HG2 GLU 21 2HG GLU 21 15.684 -2.006 17.976 2503 HG3 GLU 21 1HG GLU 21 16.622 -2.859 16.699 2504 H ALA 22 H ALA 22 14.434 1.085 15.173 2505 HA ALA 22 HA ALA 22 16.124 2.719 13.639 2506 HB1 ALA 22 1HB ALA 22 14.282 1.371 12.597 2507 HB2 ALA 22 2HB ALA 22 14.140 3.119 12.190 2508 HB3 ALA 22 3HB ALA 22 13.067 2.393 13.443 2509 H SER 23 H SER 23 13.745 3.512 16.198 2510 HA SER 23 HA SER 23 13.521 6.218 15.276 2511 HB2 SER 23 2HB SER 23 12.537 6.666 17.624 2512 HB3 SER 23 1HB SER 23 11.638 5.604 16.492 2513 HG SER 23 1HG SER 23 12.284 3.835 17.566 2514 H LYS 24 H LYS 24 15.652 4.488 17.484 2515 HA LYS 24 HA LYS 24 16.959 6.712 18.611 2516 HB2 LYS 24 2HB LYS 24 17.185 4.330 19.410 2517 HB3 LYS 24 1HB LYS 24 18.010 3.887 17.891 2518 HG2 LYS 24 2HG LYS 24 19.137 5.794 20.046 2519 HG3 LYS 24 1HG LYS 24 19.480 4.044 19.854 2520 HD2 LYS 24 2HD LYS 24 20.318 4.618 17.452 2521 HD3 LYS 24 1HD LYS 24 20.355 6.326 18.028 2522 HE2 LYS 24 2HE LYS 24 21.896 5.543 19.947 2523 HE3 LYS 24 1HE LYS 24 21.966 3.925 19.130 2524 HZ1 LYS 24 3HZ LYS 24 22.849 6.580 18.110 2525 HZ2 LYS 24 1HZ LYS 24 22.675 5.253 17.084 2526 HZ3 LYS 24 2HZ LYS 24 23.807 5.172 18.358 2527 H LYS 25 H LYS 25 17.506 4.722 15.682 2528 HA LYS 25 HA LYS 25 19.748 6.146 14.806 2529 HB2 LYS 25 2HB LYS 25 17.770 4.548 13.083 2530 HB3 LYS 25 1HB LYS 25 19.356 5.200 12.544 2531 HG2 LYS 25 2HG LYS 25 20.430 3.860 14.476 2532 HG3 LYS 25 1HG LYS 25 18.881 2.973 14.617 2533 HD2 LYS 25 2HD LYS 25 20.704 3.175 12.129 2534 HD3 LYS 25 1HD LYS 25 20.603 1.787 13.266 2535 HE2 LYS 25 2HE LYS 25 18.208 1.376 12.574 2536 HE3 LYS 25 1HE LYS 25 18.311 2.754 11.405 2537 HZ1 LYS 25 3HZ LYS 25 20.069 1.578 10.228 2538 HZ2 LYS 25 1HZ LYS 25 18.671 0.615 10.333 2539 HZ3 LYS 25 2HZ LYS 25 19.997 0.301 11.334 2540 H ALA 26 H ALA 26 16.268 6.486 13.845 2541 HA ALA 26 HA ALA 26 16.588 8.308 11.879 2542 HB1 ALA 26 1HB ALA 26 14.411 7.201 12.474 2543 HB2 ALA 26 2HB ALA 26 14.239 8.971 12.244 2544 HB3 ALA 26 3HB ALA 26 14.271 8.281 13.915 2545 H VAL 27 H VAL 27 16.221 9.135 15.405 2546 HA VAL 27 HA VAL 27 16.247 11.913 14.790 2547 HB VAL 27 HB VAL 27 15.127 11.075 16.766 2548 HG11 VAL 27 1HG1 VAL 27 17.941 10.445 17.899 2549 HG12 VAL 27 2HG1 VAL 27 16.705 9.232 17.413 2550 HG13 VAL 27 3HG1 VAL 27 16.376 10.345 18.781 2551 HG21 VAL 27 3HG2 VAL 27 15.874 13.437 16.597 2552 HG22 VAL 27 1HG2 VAL 27 17.424 13.037 17.424 2553 HG23 VAL 27 2HG2 VAL 27 15.862 12.866 18.304 2554 H GLU 28 H GLU 28 18.812 9.531 15.499 2555 HA GLU 28 HA GLU 28 20.756 11.626 15.912 2556 HB2 GLU 28 2HB GLU 28 20.758 9.420 17.139 2557 HB3 GLU 28 1HB GLU 28 21.243 8.605 15.619 2558 HG2 GLU 28 2HG GLU 28 23.391 9.779 15.584 2559 HG3 GLU 28 1HG GLU 28 22.827 10.971 16.807 2560 H ALA 29 H ALA 29 19.490 9.731 13.316 2561 HA ALA 29 HA ALA 29 21.546 10.050 11.435 2562 HB1 ALA 29 1HB ALA 29 19.761 9.291 9.829 2563 HB2 ALA 29 2HB ALA 29 18.542 9.475 11.105 2564 HB3 ALA 29 3HB ALA 29 19.836 8.240 11.268 2565 H GLU 30 H GLU 30 18.358 11.637 11.956 2566 HA GLU 30 HA GLU 30 18.656 13.534 9.991 2567 HB2 GLU 30 2HB GLU 30 16.528 12.925 11.252 2568 HB3 GLU 30 1HB GLU 30 17.167 13.839 12.653 2569 HG2 GLU 30 2HG GLU 30 15.878 15.497 11.680 2570 HG3 GLU 30 1HG GLU 30 17.407 15.815 10.803 2571 H ARG 31 H ARG 31 19.829 13.538 13.353 2572 HA ARG 31 HA ARG 31 20.390 16.299 13.406 2573 HB2 ARG 31 2HB ARG 31 20.111 14.643 15.409 2574 HB3 ARG 31 1HB ARG 31 21.817 14.213 15.127 2575 HG2 ARG 31 2HG ARG 31 22.146 15.844 16.686 2576 HG3 ARG 31 1HG ARG 31 22.096 16.935 15.265 2577 HD2 ARG 31 2HD ARG 31 19.561 17.273 15.749 2578 HD3 ARG 31 1HD ARG 31 19.785 16.329 17.274 2579 HE ARG 31 HE ARG 31 20.432 19.120 16.830 2580 HH11 ARG 31 1HH2 ARG 31 21.226 16.462 19.087 2581 HH12 ARG 31 2HH2 ARG 31 22.663 17.228 19.683 2582 HH21 ARG 31 1HH1 ARG 31 22.541 20.061 17.578 2583 HH22 ARG 31 2HH1 ARG 31 23.313 19.304 18.940 2584 H GLY 32 H GLY 32 21.744 17.134 11.815 2585 HA2 GLY 32 2HA GLY 32 24.222 17.558 11.775 2586 HA3 GLY 32 1HA GLY 32 24.306 15.808 11.288 2587 H ALA 33 H ALA 33 21.506 16.123 10.079 2588 HA ALA 33 HA ALA 33 22.543 16.616 7.504 2589 HB1 ALA 33 1HB ALA 33 20.224 16.007 6.720 2590 HB2 ALA 33 2HB ALA 33 19.636 16.090 8.418 2591 HB3 ALA 33 3HB ALA 33 20.815 14.821 7.945 2592 HA PRO 34 HA PRO 34 21.089 20.819 7.326 2593 HB2 PRO 34 2HB PRO 34 20.893 21.252 4.561 2594 HB3 PRO 34 1HB PRO 34 22.467 21.110 5.441 2595 HG2 PRO 34 2HG PRO 34 20.981 18.911 3.915 2596 HG3 PRO 34 1HG PRO 34 22.735 19.363 3.797 2597 HD2 PRO 34 2HD PRO 34 21.846 17.277 5.386 2598 HD3 PRO 34 1HD PRO 34 23.216 18.342 5.935 2599 H GLY 35 H GLY 35 19.039 21.767 7.550 2600 HA2 GLY 35 2HA GLY 35 16.892 22.159 7.176 2601 HA3 GLY 35 1HA GLY 35 16.962 21.068 5.740 2602 H ALA 36 H ALA 36 17.987 19.995 8.876 2603 HA ALA 36 HA ALA 36 16.513 17.718 8.986 2604 HB1 ALA 36 1HB ALA 36 17.640 19.456 11.287 2605 HB2 ALA 36 2HB ALA 36 18.490 18.095 10.453 2606 HB3 ALA 36 3HB ALA 36 17.070 17.769 11.503 2607 H ALA 37 H ALA 37 14.536 17.071 9.797 2608 HA ALA 37 HA ALA 37 12.759 19.188 10.872 2609 HB1 ALA 37 1HB ALA 37 10.894 17.713 9.986 2610 HB2 ALA 37 2HB ALA 37 12.140 16.605 9.281 2611 HB3 ALA 37 3HB ALA 37 11.975 18.281 8.663 2612 H LEU 38 H LEU 38 13.770 15.723 10.941 2613 HA LEU 38 HA LEU 38 12.120 15.262 13.269 2614 HB2 LEU 38 2HB LEU 38 12.610 13.692 11.217 2615 HB3 LEU 38 1HB LEU 38 14.104 13.273 12.073 2616 HG LEU 38 HG LEU 38 11.187 12.893 13.021 2617 HD11 LEU 38 1HD1 LEU 38 11.920 11.318 11.275 2618 HD12 LEU 38 2HD1 LEU 38 11.806 10.453 12.855 2619 HD13 LEU 38 3HD1 LEU 38 13.416 10.936 12.196 2620 HD21 LEU 38 3HD2 LEU 38 12.102 11.572 14.963 2621 HD22 LEU 38 1HD2 LEU 38 12.496 13.315 15.098 2622 HD23 LEU 38 2HD2 LEU 38 13.757 12.145 14.562 2623 H ILE 39 H ILE 39 13.439 16.993 14.489 2624 HA ILE 39 HA ILE 39 16.038 16.009 15.381 2625 HB ILE 39 HB ILE 39 16.224 18.196 16.503 2626 HG12 ILE 39 2HG1 ILE 39 13.480 18.803 15.188 2627 HG13 ILE 39 1HG1 ILE 39 13.758 18.580 16.949 2628 HG21 ILE 39 1HG2 ILE 39 15.393 18.342 13.520 2629 HG22 ILE 39 2HG2 ILE 39 16.963 17.704 14.123 2630 HG23 ILE 39 3HG2 ILE 39 16.538 19.431 14.381 2631 HD11 ILE 39 3HD ILE 39 14.947 20.819 15.178 2632 HD12 ILE 39 1HD ILE 39 13.665 20.982 16.426 2633 HD13 ILE 39 2HD ILE 39 15.348 20.561 16.918 2634 H SER 40 H SER 40 12.819 15.441 16.436 2635 HA SER 40 HA SER 40 13.561 15.787 19.225 2636 HB2 SER 40 2HB SER 40 11.089 15.286 19.621 2637 HB3 SER 40 1HB SER 40 11.562 16.858 18.907 2638 HG SER 40 1HG SER 40 9.794 15.581 18.002 2639 H TYR 41 H TYR 41 13.557 14.218 20.716 2640 HA TYR 41 HA TYR 41 14.210 11.600 19.697 2641 HB2 TYR 41 2HB TYR 41 15.919 12.517 21.099 2642 HB3 TYR 41 1HB TYR 41 14.737 13.044 22.338 2643 HD1 TYR 41 1HD TYR 41 15.336 9.642 20.676 2644 HD2 TYR 41 2HD TYR 41 15.198 11.960 24.306 2645 HE1 TYR 41 1HE TYR 41 15.730 7.605 21.999 2646 HE2 TYR 41 2HE TYR 41 15.578 9.931 25.623 2647 HH TYR 41 HH TYR 41 15.811 7.683 25.608 2648 HA PRO 42 HA PRO 42 11.099 9.957 22.629 2649 HB2 PRO 42 2HB PRO 42 9.257 11.443 24.123 2650 HB3 PRO 42 1HB PRO 42 10.960 11.192 24.664 2651 HG2 PRO 42 2HG PRO 42 9.823 13.594 23.121 2652 HG3 PRO 42 1HG PRO 42 10.809 13.624 24.641 2653 HD2 PRO 42 2HD PRO 42 11.939 13.959 22.149 2654 HD3 PRO 42 1HD PRO 42 12.810 13.002 23.443 2655 H ASP 43 H ASP 43 10.340 12.423 20.438 2656 HA ASP 43 HA ASP 43 7.652 11.568 19.840 2657 HB2 ASP 43 2HB ASP 43 9.419 13.405 18.110 2658 HB3 ASP 43 1HB ASP 43 7.632 13.280 18.119 2659 H ALA 44 H ALA 44 10.967 10.775 19.027 2660 HA ALA 44 HA ALA 44 10.772 10.521 16.275 2661 HB1 ALA 44 1HB ALA 44 12.991 10.586 17.453 2662 HB2 ALA 44 2HB ALA 44 12.871 9.140 16.405 2663 HB3 ALA 44 3HB ALA 44 12.653 8.983 18.190 2664 H ILE 45 H ILE 45 9.951 8.332 18.864 2665 HA ILE 45 HA ILE 45 9.725 5.995 17.305 2666 HB ILE 45 HB ILE 45 10.092 5.856 19.654 2667 HG12 ILE 45 2HG1 ILE 45 7.309 4.722 18.971 2668 HG13 ILE 45 1HG1 ILE 45 8.881 4.026 18.457 2669 HG21 ILE 45 1HG2 ILE 45 8.390 6.531 21.342 2670 HG22 ILE 45 2HG2 ILE 45 7.327 7.188 20.056 2671 HG23 ILE 45 3HG2 ILE 45 8.923 7.947 20.395 2672 HD11 ILE 45 3HD ILE 45 7.913 4.350 21.380 2673 HD12 ILE 45 1HD ILE 45 8.059 2.821 20.444 2674 HD13 ILE 45 2HD ILE 45 9.539 3.743 20.886 2675 H TRP 46 H TRP 46 7.500 8.753 17.872 2676 HA TRP 46 HA TRP 46 5.201 7.294 16.954 2677 HB2 TRP 46 2HB TRP 46 5.760 10.229 17.576 2678 HB3 TRP 46 1HB TRP 46 4.382 9.823 16.541 2679 HD1 TRP 46 HD TRP 46 3.095 11.186 18.412 2680 HE1 TRP 46 1HE TRP 46 1.762 10.358 20.434 2681 HE3 TRP 46 3HE TRP 46 5.304 6.583 18.979 2682 HZ2 TRP 46 2HZ TRP 46 1.580 7.978 22.005 2683 HZ3 TRP 46 3HZ TRP 46 4.528 5.108 20.769 2684 HH2 TRP 46 HH TRP 46 2.694 5.787 22.277 2685 H TRP 47 H TRP 47 7.671 9.383 15.458 2686 HA TRP 47 HA TRP 47 6.391 9.433 12.923 2687 HB2 TRP 47 2HB TRP 47 8.209 11.028 13.571 2688 HB3 TRP 47 1HB TRP 47 9.384 9.665 13.644 2689 HD1 TRP 47 HD TRP 47 7.147 11.525 10.974 2690 HE1 TRP 47 1HE TRP 47 8.121 11.075 8.694 2691 HE3 TRP 47 3HE TRP 47 10.791 8.240 12.351 2692 HZ2 TRP 47 2HZ TRP 47 10.475 9.745 7.599 2693 HZ3 TRP 47 3HZ TRP 47 12.352 7.372 10.638 2694 HH2 TRP 47 HH TRP 47 12.207 8.139 8.305 2695 H SER 48 H SER 48 8.773 7.275 14.479 2696 HA SER 48 HA SER 48 9.346 5.666 12.302 2697 HB2 SER 48 2HB SER 48 10.507 5.813 14.613 2698 HB3 SER 48 1HB SER 48 9.230 4.703 15.233 2699 HG SER 48 1HG SER 48 11.120 3.616 14.625 2700 H VAL 49 H VAL 49 6.712 5.430 14.734 2701 HA VAL 49 HA VAL 49 5.645 2.988 14.056 2702 HB VAL 49 HB VAL 49 4.470 5.553 15.184 2703 HG11 VAL 49 1HG1 VAL 49 2.528 4.514 14.034 2704 HG12 VAL 49 2HG1 VAL 49 2.406 4.278 15.798 2705 HG13 VAL 49 3HG1 VAL 49 2.924 2.907 14.749 2706 HG21 VAL 49 3HG2 VAL 49 6.093 3.989 16.520 2707 HG22 VAL 49 1HG2 VAL 49 4.797 2.750 16.443 2708 HG23 VAL 49 2HG2 VAL 49 4.494 4.309 17.288 2709 H GLU 50 H GLU 50 4.743 6.233 12.644 2710 HA GLU 50 HA GLU 50 2.869 4.940 10.946 2711 HB2 GLU 50 2HB GLU 50 2.494 7.149 9.927 2712 HB3 GLU 50 1HB GLU 50 2.418 7.177 11.713 2713 HG2 GLU 50 2HG GLU 50 4.796 8.108 11.767 2714 HG3 GLU 50 1HG GLU 50 4.771 8.174 9.965 2715 H THR 51 H THR 51 6.274 5.399 10.758 2716 HA THR 51 HA THR 51 6.419 5.391 7.895 2717 HB THR 51 HB THR 51 8.594 4.814 9.967 2718 HG1 THR 51 1HG THR 51 7.778 6.917 10.170 2719 HG21 THR 51 3HG2 THR 51 10.134 5.437 8.073 2720 HG22 THR 51 1HG2 THR 51 8.725 5.593 6.962 2721 HG23 THR 51 2HG2 THR 51 9.170 3.985 7.639 2722 H ALA 52 H ALA 52 6.461 2.972 10.536 2723 HA ALA 52 HA ALA 52 7.185 0.794 8.877 2724 HB1 ALA 52 1HB ALA 52 5.616 0.834 11.528 2725 HB2 ALA 52 2HB ALA 52 7.403 0.637 11.336 2726 HB3 ALA 52 3HB ALA 52 6.291 -0.640 10.736 2727 H THR 53 H THR 53 4.040 2.401 9.562 2728 HA THR 53 HA THR 53 2.637 0.265 8.207 2729 HB THR 53 HB THR 53 0.640 1.799 8.582 2730 HG1 THR 53 1HG THR 53 1.754 3.734 8.861 2731 HG21 THR 53 3HG2 THR 53 0.588 1.242 11.019 2732 HG22 THR 53 1HG2 THR 53 2.367 0.966 11.027 2733 HG23 THR 53 2HG2 THR 53 1.288 -0.130 10.084 2734 H THR 54 H THR 54 4.749 2.266 6.950 2735 HA THR 54 HA THR 54 5.115 3.202 5.041 2736 HB THR 54 HB THR 54 4.321 1.917 3.017 2737 HG1 THR 54 1HG THR 54 2.345 1.252 4.246 2738 HG21 THR 54 3HG2 THR 54 6.393 1.392 4.385 2739 HG22 THR 54 1HG2 THR 54 5.643 -0.076 3.665 2740 HG23 THR 54 2HG2 THR 54 5.420 0.279 5.415 2741 H VAL 55 H VAL 55 3.470 4.977 6.198 2742 HA VAL 55 HA VAL 55 1.768 5.822 3.930 2743 HB VAL 55 HB VAL 55 0.370 6.995 5.796 2744 HG11 VAL 55 1HG1 VAL 55 0.243 3.947 5.293 2745 HG12 VAL 55 2HG1 VAL 55 -0.431 5.237 4.232 2746 HG13 VAL 55 3HG1 VAL 55 -1.111 4.985 5.882 2747 HG21 VAL 55 3HG2 VAL 55 0.252 5.656 7.924 2748 HG22 VAL 55 1HG2 VAL 55 1.861 6.402 7.767 2749 HG23 VAL 55 2HG2 VAL 55 1.625 4.646 7.401 2750 H GLY 56 H GLY 56 3.457 6.984 6.941 2751 HA2 GLY 56 2HA GLY 56 4.934 8.678 7.024 2752 HA3 GLY 56 1HA GLY 56 4.579 9.125 5.313 2753 H TYR 57 H TYR 57 1.844 9.356 5.390 2754 HA TYR 57 HA TYR 57 0.080 10.473 5.957 2755 HB2 TYR 57 2HB TYR 57 0.966 9.912 8.526 2756 HB3 TYR 57 1HB TYR 57 0.964 11.688 8.606 2757 HD1 TYR 57 2HD TYR 57 -1.296 12.857 7.682 2758 HD2 TYR 57 1HD TYR 57 -0.972 8.745 8.900 2759 HE1 TYR 57 2HE TYR 57 -3.721 12.786 8.074 2760 HE2 TYR 57 1HE TYR 57 -3.399 8.660 9.277 2761 HH TYR 57 HH TYR 57 -5.549 11.487 8.890 2762 H GLY 58 H GLY 58 2.579 12.471 7.519 2763 HA2 GLY 58 2HA GLY 58 3.425 14.068 5.599 2764 HA3 GLY 58 1HA GLY 58 1.781 14.760 5.914 2765 H ASP 59 H ASP 59 3.997 13.206 8.316 2766 HA ASP 59 HA ASP 59 3.529 15.538 9.952 2767 HB2 ASP 59 2HB ASP 59 3.462 13.029 10.732 2768 HB3 ASP 59 1HB ASP 59 5.238 13.110 10.793 2769 H ARG 60 H ARG 60 6.456 13.564 9.003 2770 HA ARG 60 HA ARG 60 8.005 16.050 8.941 2771 HB2 ARG 60 2HB ARG 60 8.824 13.510 10.443 2772 HB3 ARG 60 1HB ARG 60 9.914 14.908 10.145 2773 HG2 ARG 60 2HG ARG 60 8.630 16.382 11.564 2774 HG3 ARG 60 1HG ARG 60 7.213 15.301 11.493 2775 HD2 ARG 60 2HD ARG 60 8.646 13.562 12.835 2776 HD3 ARG 60 1HD ARG 60 9.683 14.989 13.272 2777 HE ARG 60 HE ARG 60 6.641 14.825 13.558 2778 HH11 ARG 60 1HH2 ARG 60 9.767 15.868 15.130 2779 HH12 ARG 60 2HH2 ARG 60 8.957 16.884 16.235 2780 HH21 ARG 60 1HH1 ARG 60 5.651 16.232 15.226 2781 HH22 ARG 60 2HH1 ARG 60 6.700 16.984 16.384 2782 H TYR 61 H TYR 61 10.511 14.540 8.251 2783 HA TYR 61 HA TYR 61 9.910 12.845 6.155 2784 HB2 TYR 61 2HB TYR 61 11.087 14.396 4.380 2785 HB3 TYR 61 1HB TYR 61 9.350 14.717 4.706 2786 HD1 TYR 61 1HD TYR 61 12.815 15.983 5.227 2787 HD2 TYR 61 2HD TYR 61 8.629 16.740 5.837 2788 HE1 TYR 61 1HE TYR 61 13.320 18.330 5.726 2789 HE2 TYR 61 2HE TYR 61 9.125 19.090 6.374 2790 HH TYR 61 HH TYR 61 12.392 20.445 5.935 2791 HA PRO 62 HA PRO 62 14.267 12.774 7.539 2792 HB2 PRO 62 2HB PRO 62 15.257 10.817 5.794 2793 HB3 PRO 62 1HB PRO 62 14.081 10.388 7.090 2794 HG2 PRO 62 2HG PRO 62 13.576 10.971 4.120 2795 HG3 PRO 62 1HG PRO 62 12.946 9.578 5.097 2796 HD2 PRO 62 2HD PRO 62 11.570 11.984 4.541 2797 HD3 PRO 62 1HD PRO 62 11.244 10.977 6.030 2798 H VAL 63 H VAL 63 16.405 13.609 6.660 2799 HA VAL 63 HA VAL 63 16.078 14.651 3.914 2800 HB VAL 63 HB VAL 63 18.357 15.647 5.572 2801 HG11 VAL 63 1HG1 VAL 63 18.056 16.274 3.051 2802 HG12 VAL 63 2HG1 VAL 63 17.852 17.678 4.146 2803 HG13 VAL 63 3HG1 VAL 63 16.412 16.863 3.460 2804 HG21 VAL 63 3HG2 VAL 63 16.805 17.484 6.364 2805 HG22 VAL 63 1HG2 VAL 63 16.444 15.901 7.113 2806 HG23 VAL 63 2HG2 VAL 63 15.397 16.514 5.790 2807 H THR 64 H THR 64 19.019 14.900 3.585 2808 HA THR 64 HA THR 64 19.165 12.387 2.267 2809 HB THR 64 HB THR 64 21.002 14.829 2.115 2810 HG1 THR 64 1HG THR 64 19.563 15.450 0.467 2811 HG21 THR 64 3HG2 THR 64 21.521 14.019 -0.164 2812 HG22 THR 64 1HG2 THR 64 20.369 12.654 -0.009 2813 HG23 THR 64 2HG2 THR 64 21.862 12.689 0.989 2814 H GLU 65 H GLU 65 21.183 14.241 4.522 2815 HA GLU 65 HA GLU 65 23.254 12.333 4.626 2816 HB2 GLU 65 2HB GLU 65 23.543 14.780 4.742 2817 HB3 GLU 65 1HB GLU 65 22.584 14.862 6.254 2818 HG2 GLU 65 2HG GLU 65 24.346 13.754 7.535 2819 HG3 GLU 65 1HG GLU 65 25.230 13.332 6.019 2820 H GLU 66 H GLU 66 20.166 12.272 5.992 2821 HA GLU 66 HA GLU 66 20.817 11.182 8.502 2822 HB2 GLU 66 2HB GLU 66 18.568 10.893 8.894 2823 HB3 GLU 66 1HB GLU 66 18.554 12.213 7.738 2824 HG2 GLU 66 2HG GLU 66 16.937 11.052 6.780 2825 HG3 GLU 66 1HG GLU 66 18.215 10.115 5.951 2826 H GLY 67 H GLY 67 20.692 10.130 5.227 2827 HA2 GLY 67 2HA GLY 67 21.604 8.303 4.274 2828 HA3 GLY 67 1HA GLY 67 21.737 7.494 5.911 2829 H ARG 68 H ARG 68 19.447 8.652 3.379 2830 HA ARG 68 HA ARG 68 17.174 8.271 4.821 2831 HB2 ARG 68 2HB ARG 68 17.615 9.694 2.766 2832 HB3 ARG 68 1HB ARG 68 17.262 8.237 1.772 2833 HG2 ARG 68 2HG ARG 68 14.962 8.177 2.749 2834 HG3 ARG 68 1HG ARG 68 15.398 9.475 3.899 2835 HD2 ARG 68 2HD ARG 68 15.185 9.806 0.811 2836 HD3 ARG 68 1HD ARG 68 13.966 10.307 2.045 2837 HE ARG 68 HE ARG 68 16.520 11.507 2.714 2838 HH11 ARG 68 1HH2 ARG 68 13.348 11.987 0.987 2839 HH12 ARG 68 2HH2 ARG 68 13.599 13.657 0.888 2840 HH21 ARG 68 1HH1 ARG 68 17.042 13.742 1.507 2841 HH22 ARG 68 2HH1 ARG 68 15.602 14.599 1.104 2842 H LYS 69 H LYS 69 19.134 5.871 3.931 2843 HA LYS 69 HA LYS 69 17.261 3.777 3.399 2844 HB2 LYS 69 2HB LYS 69 20.146 3.608 4.427 2845 HB3 LYS 69 1HB LYS 69 19.075 2.221 4.027 2846 HG2 LYS 69 2HG LYS 69 18.827 3.283 1.663 2847 HG3 LYS 69 1HG LYS 69 20.299 4.238 2.086 2848 HD2 LYS 69 2HD LYS 69 21.457 2.011 2.648 2849 HD3 LYS 69 1HD LYS 69 19.948 1.163 2.217 2850 HE2 LYS 69 2HE LYS 69 21.516 0.941 0.366 2851 HE3 LYS 69 1HE LYS 69 20.142 1.988 -0.171 2852 HZ1 LYS 69 3HZ LYS 69 21.628 3.521 -0.669 2853 HZ2 LYS 69 1HZ LYS 69 22.871 2.490 -0.137 2854 HZ3 LYS 69 2HZ LYS 69 22.198 3.589 0.964 2855 H VAL 70 H VAL 70 18.108 5.660 6.270 2856 HA VAL 70 HA VAL 70 17.554 3.536 8.093 2857 HB VAL 70 HB VAL 70 17.568 6.556 8.396 2858 HG11 VAL 70 1HG1 VAL 70 17.102 4.395 10.567 2859 HG12 VAL 70 2HG1 VAL 70 15.967 5.706 10.064 2860 HG13 VAL 70 3HG1 VAL 70 17.499 6.136 10.875 2861 HG21 VAL 70 3HG2 VAL 70 19.517 4.341 9.352 2862 HG22 VAL 70 1HG2 VAL 70 19.671 6.120 9.643 2863 HG23 VAL 70 2HG2 VAL 70 19.791 5.472 7.976 2864 H ALA 71 H ALA 71 15.658 6.385 6.882 2865 HA ALA 71 HA ALA 71 13.200 5.599 7.778 2866 HB1 ALA 71 1HB ALA 71 13.839 6.903 5.048 2867 HB2 ALA 71 2HB ALA 71 13.707 7.778 6.606 2868 HB3 ALA 71 3HB ALA 71 12.250 6.971 5.910 2869 H GLU 72 H GLU 72 14.722 4.713 4.646 2870 HA GLU 72 HA GLU 72 12.539 3.283 3.680 2871 HB2 GLU 72 2HB GLU 72 14.271 4.167 2.221 2872 HB3 GLU 72 1HB GLU 72 15.494 3.088 2.936 2873 HG2 GLU 72 2HG GLU 72 13.025 1.798 1.687 2874 HG3 GLU 72 1HG GLU 72 14.195 2.589 0.573 2875 H GLN 73 H GLN 73 15.252 2.173 5.748 2876 HA GLN 73 HA GLN 73 14.745 -0.547 5.438 2877 HB2 GLN 73 2HB GLN 73 16.821 0.365 6.467 2878 HB3 GLN 73 1HB GLN 73 15.882 0.895 7.904 2879 HG2 GLN 73 2HG GLN 73 15.381 -1.516 8.450 2880 HG3 GLN 73 1HG GLN 73 16.210 -2.032 6.938 2881 HE21 GLN 73 1HE2 GLN 73 18.255 -2.822 7.406 2882 HE22 GLN 73 2HE2 GLN 73 19.369 -2.141 8.526 2883 H VAL 74 H VAL 74 13.191 1.880 7.595 2884 HA VAL 74 HA VAL 74 11.895 -0.055 9.197 2885 HB VAL 74 HB VAL 74 10.719 2.716 8.672 2886 HG11 VAL 74 1HG1 VAL 74 9.414 1.106 10.110 2887 HG12 VAL 74 2HG1 VAL 74 10.043 2.481 11.078 2888 HG13 VAL 74 3HG1 VAL 74 10.854 0.874 11.169 2889 HG21 VAL 74 3HG2 VAL 74 13.015 3.260 9.017 2890 HG22 VAL 74 1HG2 VAL 74 13.237 1.999 10.293 2891 HG23 VAL 74 2HG2 VAL 74 12.235 3.470 10.609 2892 H MET 75 H MET 75 11.063 1.629 6.178 2893 HA MET 75 HA MET 75 8.368 0.875 6.037 2894 HB2 MET 75 2HB MET 75 10.354 1.349 3.723 2895 HB3 MET 75 1HB MET 75 8.567 1.292 3.562 2896 HG2 MET 75 2HG MET 75 8.332 3.307 4.974 2897 HG3 MET 75 1HG MET 75 10.091 3.337 5.286 2898 HE1 MET 75 3HE MET 75 10.412 5.714 4.664 2899 HE2 MET 75 1HE MET 75 8.637 5.856 4.418 2900 HE3 MET 75 2HE MET 75 9.769 6.515 3.189 2901 H LYS 76 H LYS 76 11.335 -0.642 4.634 2902 HA LYS 76 HA LYS 76 9.908 -2.763 3.437 2903 HB2 LYS 76 2HB LYS 76 12.193 -2.086 2.683 2904 HB3 LYS 76 1HB LYS 76 12.880 -2.676 4.231 2905 HG2 LYS 76 2HG LYS 76 12.294 -4.999 3.676 2906 HG3 LYS 76 1HG LYS 76 11.375 -4.482 2.220 2907 HD2 LYS 76 2HD LYS 76 13.437 -3.838 1.062 2908 HD3 LYS 76 1HD LYS 76 14.380 -3.920 2.584 2909 HE2 LYS 76 2HE LYS 76 14.906 -5.842 1.072 2910 HE3 LYS 76 1HE LYS 76 14.266 -6.362 2.676 2911 HZ1 LYS 76 3HZ LYS 76 13.347 -7.122 0.157 2912 HZ2 LYS 76 1HZ LYS 76 12.139 -6.132 0.812 2913 HZ3 LYS 76 2HZ LYS 76 12.696 -7.462 1.711 2914 H ALA 77 H ALA 77 11.236 -2.324 6.707 2915 HA ALA 77 HA ALA 77 11.096 -5.008 7.520 2916 HB1 ALA 77 1HB ALA 77 10.668 -2.487 9.238 2917 HB2 ALA 77 2HB ALA 77 12.261 -3.248 8.877 2918 HB3 ALA 77 3HB ALA 77 11.034 -4.143 9.848 2919 H GLY 78 H GLY 78 8.694 -2.355 7.566 2920 HA2 GLY 78 2HA GLY 78 6.653 -3.751 8.893 2921 HA3 GLY 78 1HA GLY 78 6.502 -2.316 7.809 2922 H ILE 79 H ILE 79 7.364 -3.303 5.405 2923 HA ILE 79 HA ILE 79 5.091 -4.596 4.475 2924 HB ILE 79 HB ILE 79 7.855 -4.327 3.208 2925 HG12 ILE 79 2HG1 ILE 79 5.224 -2.768 2.737 2926 HG13 ILE 79 1HG1 ILE 79 6.537 -2.194 3.797 2927 HG21 ILE 79 1HG2 ILE 79 6.625 -6.222 2.098 2928 HG22 ILE 79 2HG2 ILE 79 6.673 -4.806 1.011 2929 HG23 ILE 79 3HG2 ILE 79 5.166 -5.183 1.919 2930 HD11 ILE 79 3HD ILE 79 6.761 -2.658 0.749 2931 HD12 ILE 79 1HD ILE 79 6.714 -1.086 1.613 2932 HD13 ILE 79 2HD ILE 79 8.129 -2.180 1.828 2933 H GLU 80 H GLU 80 8.356 -5.991 5.262 2934 HA GLU 80 HA GLU 80 7.568 -8.502 4.243 2935 HB2 GLU 80 2HB GLU 80 9.877 -7.795 6.114 2936 HB3 GLU 80 1HB GLU 80 9.595 -9.413 5.369 2937 HG2 GLU 80 2HG GLU 80 9.659 -8.384 3.079 2938 HG3 GLU 80 1HG GLU 80 10.095 -6.793 3.795 2939 H VAL 81 H VAL 81 7.225 -7.135 7.554 2940 HA VAL 81 HA VAL 81 6.606 -9.732 8.595 2941 HB VAL 81 HB VAL 81 5.823 -8.589 10.623 2942 HG11 VAL 81 1HG1 VAL 81 8.222 -9.265 10.249 2943 HG12 VAL 81 2HG1 VAL 81 8.092 -7.782 11.263 2944 HG13 VAL 81 3HG1 VAL 81 8.572 -7.646 9.534 2945 HG21 VAL 81 3HG2 VAL 81 6.185 -6.132 10.852 2946 HG22 VAL 81 1HG2 VAL 81 4.920 -6.460 9.641 2947 HG23 VAL 81 2HG2 VAL 81 6.580 -5.998 9.118 2948 H PHE 82 H PHE 82 4.655 -6.948 7.353 2949 HA PHE 82 HA PHE 82 2.221 -8.243 8.063 2950 HB2 PHE 82 2HB PHE 82 2.745 -5.909 6.120 2951 HB3 PHE 82 1HB PHE 82 1.105 -6.482 6.608 2952 HD1 PHE 82 2HD PHE 82 1.364 -6.950 9.549 2953 HD2 PHE 82 1HD PHE 82 2.940 -3.792 7.075 2954 HE1 PHE 82 2HE PHE 82 1.393 -5.443 11.488 2955 HE2 PHE 82 1HE PHE 82 2.953 -2.282 9.020 2956 HZ PHE 82 HZ PHE 82 2.172 -3.099 11.237 2957 H ALA 83 H ALA 83 4.200 -8.107 5.059 2958 HA ALA 83 HA ALA 83 2.269 -9.437 3.489 2959 HB1 ALA 83 1HB ALA 83 4.130 -9.882 1.889 2960 HB2 ALA 83 2HB ALA 83 5.331 -9.376 3.139 2961 HB3 ALA 83 3HB ALA 83 4.175 -8.177 2.450 2962 H LEU 84 H LEU 84 4.583 -10.592 5.895 2963 HA LEU 84 HA LEU 84 4.637 -13.279 4.995 2964 HB2 LEU 84 2HB LEU 84 6.289 -12.295 6.575 2965 HB3 LEU 84 1HB LEU 84 5.039 -12.173 7.847 2966 HG LEU 84 HG LEU 84 5.585 -14.897 6.584 2967 HD11 LEU 84 1HD1 LEU 84 7.494 -13.592 8.629 2968 HD12 LEU 84 2HD1 LEU 84 7.870 -13.992 6.909 2969 HD13 LEU 84 3HD1 LEU 84 7.527 -15.311 8.082 2970 HD21 LEU 84 3HD2 LEU 84 5.228 -15.741 8.902 2971 HD22 LEU 84 1HD2 LEU 84 3.834 -14.739 8.386 2972 HD23 LEU 84 2HD2 LEU 84 5.055 -14.056 9.520 2973 H VAL 85 H VAL 85 2.367 -11.358 6.931 2974 HA VAL 85 HA VAL 85 0.956 -13.464 8.109 2975 HB VAL 85 HB VAL 85 -0.077 -10.678 7.360 2976 HG11 VAL 85 1HG1 VAL 85 -1.612 -11.042 9.363 2977 HG12 VAL 85 2HG1 VAL 85 -1.125 -12.780 9.373 2978 HG13 VAL 85 3HG1 VAL 85 -1.989 -12.086 7.956 2979 HG21 VAL 85 3HG2 VAL 85 1.959 -10.456 8.699 2980 HG22 VAL 85 1HG2 VAL 85 1.433 -11.720 9.858 2981 HG23 VAL 85 2HG2 VAL 85 0.570 -10.140 9.773 2982 H THR 86 H THR 86 1.047 -12.323 4.785 2983 HA THR 86 HA THR 86 -1.440 -13.153 3.960 2984 HB THR 86 HB THR 86 1.140 -13.153 2.363 2985 HG1 THR 86 1HG THR 86 -0.707 -11.029 2.795 2986 HG21 THR 86 3HG2 THR 86 -0.384 -12.527 0.453 2987 HG22 THR 86 1HG2 THR 86 -1.824 -12.741 1.513 2988 HG23 THR 86 2HG2 THR 86 -0.783 -14.151 1.097 2989 H ALA 87 H ALA 87 1.157 -15.105 5.145 2990 HA ALA 87 HA ALA 87 0.577 -17.546 3.938 2991 HB1 ALA 87 1HB ALA 87 2.474 -17.148 5.593 2992 HB2 ALA 87 2HB ALA 87 1.474 -18.571 6.053 2993 HB3 ALA 87 3HB ALA 87 1.287 -16.992 6.908 2994 H ALA 88 H ALA 88 -0.767 -16.164 6.981 2995 HA ALA 88 HA ALA 88 -2.622 -18.239 7.465 2996 HB1 ALA 88 1HB ALA 88 -1.882 -16.633 9.288 2997 HB2 ALA 88 2HB ALA 88 -3.664 -16.605 9.085 2998 HB3 ALA 88 3HB ALA 88 -2.658 -15.282 8.392 2999 H LEU 89 H LEU 89 -2.828 -15.034 5.896 3000 HA LEU 89 HA LEU 89 -5.601 -15.101 5.514 3001 HB2 LEU 89 2HB LEU 89 -3.480 -13.651 3.835 3002 HB3 LEU 89 1HB LEU 89 -5.231 -13.271 3.841 3003 HG LEU 89 HG LEU 89 -3.470 -13.098 6.372 3004 HD11 LEU 89 1HD1 LEU 89 -3.468 -10.608 5.957 3005 HD12 LEU 89 2HD1 LEU 89 -4.145 -10.925 4.310 3006 HD13 LEU 89 3HD1 LEU 89 -2.511 -11.533 4.758 3007 HD21 LEU 89 3HD2 LEU 89 -6.241 -11.916 5.699 3008 HD22 LEU 89 1HD2 LEU 89 -5.313 -11.637 7.217 3009 HD23 LEU 89 2HD2 LEU 89 -5.921 -13.284 6.831 3010 H ALA 90 H ALA 90 -2.901 -16.159 3.325 3011 HA ALA 90 HA ALA 90 -4.715 -16.811 1.232 3012 HB1 ALA 90 1HB ALA 90 -2.327 -16.291 0.728 3013 HB2 ALA 90 2HB ALA 90 -2.768 -17.942 0.157 3014 HB3 ALA 90 3HB ALA 90 -1.817 -17.729 1.679 3015 H THR 91 H THR 91 -4.028 -18.307 4.240 3016 HA THR 91 HA THR 91 -4.497 -21.014 3.388 3017 HB THR 91 HB THR 91 -4.973 -19.875 6.211 3018 HG1 THR 91 1HG THR 91 -2.785 -19.524 5.316 3019 HG21 THR 91 3HG2 THR 91 -4.287 -22.714 5.169 3020 HG22 THR 91 1HG2 THR 91 -5.851 -22.184 5.890 3021 HG23 THR 91 2HG2 THR 91 -4.380 -22.235 6.905 3022 H ASP 92 H ASP 92 -6.436 -18.116 4.168 3023 HA ASP 92 HA ASP 92 -8.497 -19.746 5.223 3024 HB2 ASP 92 2HB ASP 92 -8.080 -16.789 5.088 3025 HB3 ASP 92 1HB ASP 92 -9.784 -17.371 5.198 3026 H PHE 93 H PHE 93 -7.821 -19.255 1.999 3027 HA PHE 93 HA PHE 93 -10.632 -19.661 1.314 3028 HB2 PHE 93 2HB PHE 93 -10.176 -19.760 -0.931 3029 HB3 PHE 93 1HB PHE 93 -9.069 -18.483 -0.344 3030 HD1 PHE 93 2HD PHE 93 -6.609 -19.021 -0.125 3031 HD2 PHE 93 1HD PHE 93 -9.360 -21.724 -2.008 3032 HE1 PHE 93 2HE PHE 93 -4.724 -20.140 -1.256 3033 HE2 PHE 93 1HE PHE 93 -7.471 -22.853 -3.142 3034 HZ PHE 93 HZ PHE 93 -5.150 -22.047 -2.793 3035 H VAL 94 H VAL 94 -7.768 -21.518 2.219 3036 HA VAL 94 HA VAL 94 -8.638 -23.920 0.960 3037 HB VAL 94 HB VAL 94 -6.433 -23.529 3.048 3038 HG11 VAL 94 1HG1 VAL 94 -6.960 -25.719 0.915 3039 HG12 VAL 94 2HG1 VAL 94 -7.076 -25.927 2.701 3040 HG13 VAL 94 3HG1 VAL 94 -5.482 -25.593 1.944 3041 HG21 VAL 94 3HG2 VAL 94 -4.990 -23.433 0.876 3042 HG22 VAL 94 1HG2 VAL 94 -5.976 -21.973 1.208 3043 HG23 VAL 94 2HG2 VAL 94 -6.516 -23.175 -0.022 3044 H ARG 95 H ARG 95 -9.009 -22.361 4.110 3045 HA ARG 95 HA ARG 95 -9.855 -24.622 5.540 3046 HB2 ARG 95 2HB ARG 95 -10.905 -21.754 5.941 3047 HB3 ARG 95 1HB ARG 95 -11.037 -23.120 7.098 3048 HG2 ARG 95 2HG ARG 95 -8.442 -23.147 7.178 3049 HG3 ARG 95 1HG ARG 95 -8.511 -21.604 6.262 3050 HD2 ARG 95 2HD ARG 95 -10.170 -20.830 8.238 3051 HD3 ARG 95 1HD ARG 95 -9.454 -22.231 9.138 3052 HE ARG 95 HE ARG 95 -7.882 -19.931 7.895 3053 HH11 ARG 95 1HH2 ARG 95 -8.852 -21.547 11.016 3054 HH12 ARG 95 2HH2 ARG 95 -7.964 -20.413 11.909 3055 HH21 ARG 95 1HH1 ARG 95 -6.762 -18.599 9.074 3056 HH22 ARG 95 2HH1 ARG 95 -6.539 -18.718 10.787 3057 H ARG 96 H ARG 96 -11.364 -23.135 2.819 3058 HA ARG 96 HA ARG 96 -14.021 -23.519 3.621 3059 HB2 ARG 96 2HB ARG 96 -14.780 -22.934 1.575 3060 HB3 ARG 96 1HB ARG 96 -13.299 -21.950 1.789 3061 HG2 ARG 96 2HG ARG 96 -12.147 -23.723 0.224 3062 HG3 ARG 96 1HG ARG 96 -13.795 -24.368 -0.058 3063 HD2 ARG 96 2HD ARG 96 -14.562 -22.069 -0.846 3064 HD3 ARG 96 1HD ARG 96 -12.901 -21.438 -0.549 3065 HE ARG 96 HE ARG 96 -12.300 -22.214 -2.609 3066 HH11 ARG 96 1HH2 ARG 96 -15.376 -23.935 -1.703 3067 HH12 ARG 96 2HH2 ARG 96 -15.570 -24.653 -3.212 3068 HH21 ARG 96 1HH1 ARG 96 -12.596 -23.277 -4.711 3069 HH22 ARG 96 2HH1 ARG 96 -13.861 -24.401 -4.950 3070 H GLU 97 H GLU 97 -11.584 -25.833 2.686 3071 HA GLU 97 HA GLU 97 -13.473 -27.683 1.582 3072 HB2 GLU 97 2HB GLU 97 -10.983 -27.896 1.160 3073 HB3 GLU 97 1HB GLU 97 -10.800 -28.408 2.872 3074 HG2 GLU 97 2HG GLU 97 -12.492 -30.287 2.419 3075 HG3 GLU 97 1HG GLU 97 -12.542 -29.774 0.696 3076 H GLU 98 H GLU 98 -11.929 -27.262 4.816 3077 HA GLU 98 HA GLU 98 -13.366 -29.259 6.080 3078 HB2 GLU 98 2HB GLU 98 -11.778 -26.826 6.943 3079 HB3 GLU 98 1HB GLU 98 -12.853 -27.596 8.152 3080 HG2 GLU 98 2HG GLU 98 -10.689 -28.474 8.487 3081 HG3 GLU 98 1HG GLU 98 -11.751 -29.782 7.872 3082 H GLU 99 H GLU 99 -14.184 -25.857 5.459 3083 HA GLU 99 HA GLU 99 -16.556 -25.643 6.906 3084 HB2 GLU 99 2HB GLU 99 -15.237 -23.788 5.650 3085 HB3 GLU 99 1HB GLU 99 -15.935 -24.430 4.135 3086 HG2 GLU 99 2HG GLU 99 -18.248 -23.841 4.970 3087 HG3 GLU 99 1HG GLU 99 -17.502 -23.095 6.427 3088 H ARG 100 H ARG 100 -15.950 -26.714 3.525 3089 HA ARG 100 HA ARG 100 -18.571 -27.207 2.778 3090 HB2 ARG 100 2HB ARG 100 -16.662 -26.987 1.202 3091 HB3 ARG 100 1HB ARG 100 -15.950 -28.519 1.780 3092 HG2 ARG 100 2HG ARG 100 -18.771 -28.521 0.604 3093 HG3 ARG 100 1HG ARG 100 -17.388 -28.294 -0.501 3094 HD2 ARG 100 2HD ARG 100 -17.691 -30.735 1.384 3095 HD3 ARG 100 1HD ARG 100 -18.155 -30.698 -0.368 3096 HE ARG 100 HE ARG 100 -15.620 -29.934 -0.658 3097 HH11 ARG 100 1HH2 ARG 100 -17.065 -32.776 1.068 3098 HH12 ARG 100 2HH2 ARG 100 -15.664 -33.704 0.894 3099 HH21 ARG 100 1HH1 ARG 100 -13.645 -31.296 -0.765 3100 HH22 ARG 100 2HH1 ARG 100 -13.729 -32.905 -0.204 3101 H ARG 101 H ARG 101 -16.179 -29.234 4.385 3102 HA ARG 101 HA ARG 101 -17.634 -31.664 4.210 3103 HB2 ARG 101 2HB ARG 101 -15.115 -31.248 4.408 3104 HB3 ARG 101 1HB ARG 101 -15.368 -30.762 6.110 3105 HG2 ARG 101 2HG ARG 101 -16.129 -33.068 6.656 3106 HG3 ARG 101 1HG ARG 101 -15.944 -33.563 4.937 3107 HD2 ARG 101 2HD ARG 101 -13.665 -32.535 6.784 3108 HD3 ARG 101 1HD ARG 101 -13.961 -34.263 6.373 3109 HE ARG 101 HE ARG 101 -12.627 -32.215 4.724 3110 HH11 ARG 101 1HH2 ARG 101 -13.722 -35.609 4.760 3111 HH12 ARG 101 2HH2 ARG 101 -13.526 -35.844 3.081 3112 HH21 ARG 101 1HH1 ARG 101 -12.083 -32.667 2.424 3113 HH22 ARG 101 2HH1 ARG 101 -12.578 -34.105 1.721 3114 H GLY 102 H GLY 102 -17.600 -28.926 6.440 3115 HA2 GLY 102 2HA GLY 102 -19.217 -28.340 7.853 3116 HA3 GLY 102 1HA GLY 102 -19.929 -29.992 7.751 3117 H HIS 103 H HIS 103 -16.567 -30.217 8.333 3118 HA HIS 103 HA HIS 103 -16.481 -29.764 11.070 3119 HB2 HIS 103 2HB HIS 103 -16.426 -32.106 11.950 3120 HB3 HIS 103 1HB HIS 103 -18.061 -31.717 11.359 3121 HD1 HIS 103 1HD HIS 103 -18.285 -32.646 8.515 3122 HD2 HIS 103 2HD HIS 103 -15.585 -34.530 11.158 3123 HE1 HIS 103 1HE HIS 103 -17.824 -34.932 7.606 3124 HE2 HIS 103 2HE HIS 103 -16.064 -35.991 9.146 Start of MODEL 2 1 H1 SER 1 H SER 1 -21.740 -14.353 -4.132 2 HA SER 1 HA SER 1 -22.755 -15.697 -2.484 3 HB2 SER 1 2HB SER 1 -23.823 -17.589 -4.646 4 HB3 SER 1 1HB SER 1 -24.290 -17.479 -2.914 5 HG SER 1 1HG SER 1 -24.771 -15.661 -5.064 6 H ALA 2 H ALA 2 -20.735 -16.500 -1.832 7 HA ALA 2 HA ALA 2 -19.860 -18.873 -3.074 8 HB1 ALA 2 1HB ALA 2 -18.777 -17.307 -4.760 9 HB2 ALA 2 2HB ALA 2 -17.562 -18.173 -3.768 10 HB3 ALA 2 3HB ALA 2 -17.955 -16.453 -3.412 11 H ASP 3 H ASP 3 -20.804 -18.031 -0.577 12 HA ASP 3 HA ASP 3 -20.480 -18.009 1.534 13 HB2 ASP 3 2HB ASP 3 -18.124 -19.889 0.952 14 HB3 ASP 3 1HB ASP 3 -19.039 -19.738 2.503 15 H HIS 4 H HIS 4 -16.993 -18.177 0.857 16 HA HIS 4 HA HIS 4 -16.483 -16.164 2.751 17 HB2 HIS 4 2HB HIS 4 -14.148 -16.290 2.213 18 HB3 HIS 4 1HB HIS 4 -14.890 -17.895 2.444 19 HD1 HIS 4 1HD HIS 4 -15.985 -17.766 -0.868 20 HD2 HIS 4 2HD HIS 4 -12.103 -17.484 0.799 21 HE1 HIS 4 1HE HIS 4 -14.361 -18.358 -2.652 22 HE2 HIS 4 2HE HIS 4 -12.081 -18.026 -1.720 23 H GLU 5 H GLU 5 -17.562 -15.762 -0.473 24 HA GLU 5 HA GLU 5 -16.542 -13.135 -0.892 25 HB2 GLU 5 2HB GLU 5 -17.763 -14.518 -2.665 26 HB3 GLU 5 1HB GLU 5 -19.274 -14.318 -1.719 27 HG2 GLU 5 2HG GLU 5 -18.984 -11.753 -2.053 28 HG3 GLU 5 1HG GLU 5 -17.607 -12.132 -3.146 29 H ARG 6 H ARG 6 -19.321 -14.564 0.955 30 HA ARG 6 HA ARG 6 -20.460 -11.992 1.505 31 HB2 ARG 6 2HB ARG 6 -20.976 -14.779 2.726 32 HB3 ARG 6 1HB ARG 6 -21.799 -13.307 3.317 33 HG2 ARG 6 2HG ARG 6 -21.944 -14.260 0.416 34 HG3 ARG 6 1HG ARG 6 -23.152 -14.666 1.684 35 HD2 ARG 6 2HD ARG 6 -23.819 -12.334 1.987 36 HD3 ARG 6 1HD ARG 6 -22.484 -11.712 0.948 37 HE ARG 6 HE ARG 6 -25.001 -12.978 0.099 38 HH11 ARG 6 1HH2 ARG 6 -21.840 -11.657 -1.032 39 HH12 ARG 6 2HH2 ARG 6 -21.760 -12.579 -2.477 40 HH21 ARG 6 1HH1 ARG 6 -25.119 -13.913 -2.082 41 HH22 ARG 6 2HH1 ARG 6 -23.909 -13.586 -3.246 42 H GLU 7 H GLU 7 -18.220 -14.224 3.064 43 HA GLU 7 HA GLU 7 -18.227 -12.949 5.549 44 HB2 GLU 7 2HB GLU 7 -17.340 -15.277 4.867 45 HB3 GLU 7 1HB GLU 7 -15.818 -14.454 4.379 46 HG2 GLU 7 2HG GLU 7 -15.409 -13.762 6.710 47 HG3 GLU 7 1HG GLU 7 -17.072 -14.255 7.206 48 H ALA 8 H ALA 8 -16.358 -12.398 2.558 49 HA ALA 8 HA ALA 8 -14.672 -10.392 3.522 50 HB1 ALA 8 1HB ALA 8 -15.802 -10.873 0.675 51 HB2 ALA 8 2HB ALA 8 -14.269 -11.552 1.327 52 HB3 ALA 8 3HB ALA 8 -14.439 -9.780 1.048 53 H GLN 9 H GLN 9 -17.870 -10.324 2.038 54 HA GLN 9 HA GLN 9 -18.132 -7.609 1.676 55 HB2 GLN 9 2HB GLN 9 -19.421 -9.670 0.804 56 HB3 GLN 9 1HB GLN 9 -20.399 -9.593 2.306 57 HG2 GLN 9 2HG GLN 9 -21.221 -7.313 1.603 58 HG3 GLN 9 1HG GLN 9 -20.159 -7.383 0.143 59 HE21 GLN 9 1HE2 GLN 9 -23.328 -7.635 0.748 60 HE22 GLN 9 2HE2 GLN 9 -23.764 -8.958 -0.288 61 H LYS 10 H LYS 10 -18.797 -9.626 4.566 62 HA LYS 10 HA LYS 10 -20.029 -7.452 5.983 63 HB2 LYS 10 2HB LYS 10 -20.807 -9.604 6.633 64 HB3 LYS 10 1HB LYS 10 -19.139 -10.220 6.913 65 HG2 LYS 10 2HG LYS 10 -18.858 -9.045 8.882 66 HG3 LYS 10 1HG LYS 10 -20.088 -7.783 8.475 67 HD2 LYS 10 2HD LYS 10 -21.918 -9.128 9.113 68 HD3 LYS 10 1HD LYS 10 -20.947 -10.637 9.186 69 HE2 LYS 10 2HE LYS 10 -21.573 -9.336 11.463 70 HE3 LYS 10 1HE LYS 10 -19.958 -10.110 11.240 71 HZ1 LYS 10 3HZ LYS 10 -20.545 -7.175 10.964 72 HZ2 LYS 10 1HZ LYS 10 -19.079 -7.950 10.560 73 HZ3 LYS 10 2HZ LYS 10 -19.602 -7.972 12.135 74 H ALA 11 H ALA 11 -16.691 -8.460 5.392 75 HA ALA 11 HA ALA 11 -15.616 -7.169 7.677 76 HB1 ALA 11 1HB ALA 11 -14.225 -7.596 4.965 77 HB2 ALA 11 2HB ALA 11 -14.282 -8.807 6.299 78 HB3 ALA 11 3HB ALA 11 -13.441 -7.241 6.546 79 H GLU 12 H GLU 12 -16.477 -6.012 4.373 80 HA GLU 12 HA GLU 12 -15.336 -3.466 4.604 81 HB2 GLU 12 2HB GLU 12 -17.940 -4.210 3.136 82 HB3 GLU 12 1HB GLU 12 -17.102 -2.634 2.995 83 HG2 GLU 12 2HG GLU 12 -15.085 -3.810 1.996 84 HG3 GLU 12 1HG GLU 12 -16.040 -5.345 1.988 85 H GLU 13 H GLU 13 -18.398 -4.764 5.723 86 HA GLU 13 HA GLU 13 -19.755 -2.413 6.353 87 HB2 GLU 13 2HB GLU 13 -20.575 -4.852 6.047 88 HB3 GLU 13 1HB GLU 13 -19.915 -5.200 7.676 89 HG2 GLU 13 2HG GLU 13 -21.593 -3.619 8.685 90 HG3 GLU 13 1HG GLU 13 -22.278 -3.331 7.044 91 H GLU 14 H GLU 14 -17.311 -4.350 8.107 92 HA GLU 14 HA GLU 14 -17.817 -3.014 10.600 93 HB2 GLU 14 2HB GLU 14 -17.054 -5.380 10.498 94 HB3 GLU 14 1HB GLU 14 -15.444 -4.829 9.932 95 HG2 GLU 14 2HG GLU 14 -15.009 -3.684 12.056 96 HG3 GLU 14 1HG GLU 14 -16.729 -3.826 12.565 97 H LEU 15 H LEU 15 -15.660 -2.586 7.808 98 HA LEU 15 HA LEU 15 -13.832 -0.905 9.047 99 HB2 LEU 15 2HB LEU 15 -13.507 -1.922 6.784 100 HB3 LEU 15 1HB LEU 15 -14.746 -0.825 6.109 101 HG LEU 15 HG LEU 15 -13.337 1.129 6.488 102 HD11 LEU 15 1HD1 LEU 15 -11.376 -0.739 7.970 103 HD12 LEU 15 2HD1 LEU 15 -12.267 0.674 8.648 104 HD13 LEU 15 3HD1 LEU 15 -10.987 0.935 7.426 105 HD21 LEU 15 3HD2 LEU 15 -11.652 -1.177 5.301 106 HD22 LEU 15 1HD2 LEU 15 -11.396 0.576 5.008 107 HD23 LEU 15 2HD2 LEU 15 -12.904 -0.220 4.429 108 H GLN 16 H GLN 16 -16.929 -0.151 7.424 109 HA GLN 16 HA GLN 16 -16.730 2.621 7.568 110 HB2 GLN 16 2HB GLN 16 -19.304 0.949 7.759 111 HB3 GLN 16 1HB GLN 16 -19.189 2.695 7.347 112 HG2 GLN 16 2HG GLN 16 -17.759 2.035 5.300 113 HG3 GLN 16 1HG GLN 16 -18.089 0.310 5.693 114 HE21 GLN 16 1HE2 GLN 16 -19.807 3.473 5.092 115 HE22 GLN 16 2HE2 GLN 16 -21.164 2.765 4.285 116 H LYS 17 H LYS 17 -17.728 0.277 10.041 117 HA LYS 17 HA LYS 17 -18.930 2.138 11.783 118 HB2 LYS 17 2HB LYS 17 -19.204 -0.425 11.778 119 HB3 LYS 17 1HB LYS 17 -17.588 -0.537 12.527 120 HG2 LYS 17 2HG LYS 17 -19.214 1.345 14.100 121 HG3 LYS 17 1HG LYS 17 -20.223 -0.068 13.690 122 HD2 LYS 17 2HD LYS 17 -19.298 -0.701 15.741 123 HD3 LYS 17 1HD LYS 17 -18.318 -1.581 14.537 124 HE2 LYS 17 2HE LYS 17 -16.813 -0.721 16.261 125 HE3 LYS 17 1HE LYS 17 -16.512 0.275 14.783 126 HZ1 LYS 17 3HZ LYS 17 -16.658 1.580 16.810 127 HZ2 LYS 17 1HZ LYS 17 -18.204 1.006 17.135 128 HZ3 LYS 17 2HZ LYS 17 -17.947 1.999 15.770 129 H VAL 18 H VAL 18 -15.585 1.050 11.263 130 HA VAL 18 HA VAL 18 -14.553 2.118 13.689 131 HB VAL 18 HB VAL 18 -13.118 1.453 11.064 132 HG11 VAL 18 1HG1 VAL 18 -11.062 1.357 12.545 133 HG12 VAL 18 2HG1 VAL 18 -12.031 2.001 13.919 134 HG13 VAL 18 3HG1 VAL 18 -11.742 3.011 12.454 135 HG21 VAL 18 3HG2 VAL 18 -14.281 -0.534 12.086 136 HG22 VAL 18 1HG2 VAL 18 -13.522 -0.172 13.677 137 HG23 VAL 18 2HG2 VAL 18 -12.506 -0.667 12.274 138 H LEU 19 H LEU 19 -15.008 3.331 10.330 139 HA LEU 19 HA LEU 19 -13.507 5.652 10.686 140 HB2 LEU 19 2HB LEU 19 -15.963 5.491 8.855 141 HB3 LEU 19 1HB LEU 19 -14.541 6.576 8.712 142 HG LEU 19 HG LEU 19 -14.731 3.566 8.193 143 HD11 LEU 19 1HD1 LEU 19 -13.998 4.169 5.904 144 HD12 LEU 19 2HD1 LEU 19 -13.860 5.900 6.378 145 HD13 LEU 19 3HD1 LEU 19 -15.475 5.095 6.360 146 HD21 LEU 19 3HD2 LEU 19 -12.331 3.485 7.656 147 HD22 LEU 19 1HD2 LEU 19 -12.547 3.890 9.377 148 HD23 LEU 19 2HD2 LEU 19 -12.108 5.189 8.205 149 H GLU 20 H GLU 20 -16.960 4.966 11.367 150 HA GLU 20 HA GLU 20 -17.582 7.662 11.928 151 HB2 GLU 20 2HB GLU 20 -18.982 5.151 12.993 152 HB3 GLU 20 1HB GLU 20 -19.582 6.847 13.057 153 HG2 GLU 20 2HG GLU 20 -19.273 6.855 10.440 154 HG3 GLU 20 1HG GLU 20 -19.149 5.065 10.558 155 H GLU 21 H GLU 21 -16.367 5.004 13.962 156 HA GLU 21 HA GLU 21 -16.579 6.434 16.403 157 HB2 GLU 21 2HB GLU 21 -16.545 3.969 16.154 158 HB3 GLU 21 1HB GLU 21 -14.835 4.006 15.626 159 HG2 GLU 21 2HG GLU 21 -14.026 4.433 17.810 160 HG3 GLU 21 1HG GLU 21 -15.544 5.263 18.321 161 H ALA 22 H ALA 22 -14.042 5.968 13.950 162 HA ALA 22 HA ALA 22 -11.917 7.187 15.183 163 HB1 ALA 22 1HB ALA 22 -11.006 7.604 12.901 164 HB2 ALA 22 2HB ALA 22 -12.620 7.309 12.175 165 HB3 ALA 22 3HB ALA 22 -11.742 5.959 12.979 166 H SER 23 H SER 23 -14.560 8.604 13.293 167 HA SER 23 HA SER 23 -13.533 11.187 13.118 168 HB2 SER 23 2HB SER 23 -16.497 10.319 13.255 169 HB3 SER 23 1HB SER 23 -15.852 11.840 12.525 170 HG SER 23 1HG SER 23 -15.461 9.129 11.665 171 H LYS 24 H LYS 24 -15.252 9.559 15.763 172 HA LYS 24 HA LYS 24 -15.874 12.004 17.135 173 HB2 LYS 24 2HB LYS 24 -17.214 9.865 17.394 174 HB3 LYS 24 1HB LYS 24 -15.802 9.114 18.203 175 HG2 LYS 24 2HG LYS 24 -15.942 10.852 20.024 176 HG3 LYS 24 1HG LYS 24 -17.339 11.607 19.180 177 HD2 LYS 24 2HD LYS 24 -18.666 9.482 19.482 178 HD3 LYS 24 1HD LYS 24 -17.234 8.706 20.229 179 HE2 LYS 24 2HE LYS 24 -18.751 9.347 22.021 180 HE3 LYS 24 1HE LYS 24 -17.295 10.410 22.115 181 HZ1 LYS 24 3HZ LYS 24 -18.682 12.121 20.878 182 HZ2 LYS 24 1HZ LYS 24 -19.204 11.719 22.433 183 HZ3 LYS 24 2HZ LYS 24 -19.996 11.086 21.055 184 H LYS 25 H LYS 25 -13.462 9.359 17.437 185 HA LYS 25 HA LYS 25 -12.196 10.589 19.664 186 HB2 LYS 25 2HB LYS 25 -11.480 8.223 17.867 187 HB3 LYS 25 1HB LYS 25 -10.379 8.769 19.174 188 HG2 LYS 25 2HG LYS 25 -13.318 8.048 19.716 189 HG3 LYS 25 1HG LYS 25 -11.993 6.834 19.767 190 HD2 LYS 25 2HD LYS 25 -10.850 7.971 21.564 191 HD3 LYS 25 1HD LYS 25 -11.876 9.432 21.409 192 HE2 LYS 25 2HE LYS 25 -13.881 8.141 22.187 193 HE3 LYS 25 1HE LYS 25 -12.835 6.687 22.463 194 HZ1 LYS 25 3HZ LYS 25 -12.356 9.358 23.725 195 HZ2 LYS 25 1HZ LYS 25 -11.654 7.866 24.158 196 HZ3 LYS 25 2HZ LYS 25 -13.293 8.107 24.426 197 H ALA 26 H ALA 26 -11.748 10.882 16.169 198 HA ALA 26 HA ALA 26 -9.185 11.985 16.168 199 HB1 ALA 26 1HB ALA 26 -11.564 12.687 14.314 200 HB2 ALA 26 2HB ALA 26 -10.359 11.378 14.035 201 HB3 ALA 26 3HB ALA 26 -9.825 13.093 14.033 202 H VAL 27 H VAL 27 -12.397 13.718 16.160 203 HA VAL 27 HA VAL 27 -11.151 16.184 16.563 204 HB VAL 27 HB VAL 27 -13.998 15.391 17.379 205 HG11 VAL 27 1HG1 VAL 27 -12.717 18.128 16.671 206 HG12 VAL 27 2HG1 VAL 27 -13.373 17.652 18.280 207 HG13 VAL 27 3HG1 VAL 27 -14.486 17.843 16.879 208 HG21 VAL 27 3HG2 VAL 27 -13.524 14.761 15.013 209 HG22 VAL 27 1HG2 VAL 27 -12.775 16.365 14.705 210 HG23 VAL 27 2HG2 VAL 27 -14.537 16.235 15.046 211 H GLU 28 H GLU 28 -12.054 13.687 18.850 212 HA GLU 28 HA GLU 28 -11.915 15.257 21.210 213 HB2 GLU 28 2HB GLU 28 -12.988 12.915 20.947 214 HB3 GLU 28 1HB GLU 28 -11.332 12.250 20.849 215 HG2 GLU 28 2HG GLU 28 -10.906 13.158 23.213 216 HG3 GLU 28 1HG GLU 28 -12.634 13.656 23.276 217 H ALA 29 H ALA 29 -9.510 13.641 19.140 218 HA ALA 29 HA ALA 29 -7.446 13.484 21.102 219 HB1 ALA 29 1HB ALA 29 -7.403 11.817 19.307 220 HB2 ALA 29 2HB ALA 29 -6.057 12.952 18.979 221 HB3 ALA 29 3HB ALA 29 -7.568 13.081 18.057 222 H GLU 30 H GLU 30 -7.755 15.256 17.988 223 HA GLU 30 HA GLU 30 -5.957 17.182 18.378 224 HB2 GLU 30 2HB GLU 30 -8.600 17.156 16.849 225 HB3 GLU 30 1HB GLU 30 -7.472 18.547 16.789 226 HG2 GLU 30 2HG GLU 30 -6.921 17.372 14.882 227 HG3 GLU 30 1HG GLU 30 -5.623 16.900 16.024 228 H ARG 31 H ARG 31 -9.196 17.152 19.894 229 HA ARG 31 HA ARG 31 -8.941 19.907 20.647 230 HB2 ARG 31 2HB ARG 31 -11.193 18.807 20.380 231 HB3 ARG 31 1HB ARG 31 -10.848 17.842 21.847 232 HG2 ARG 31 2HG ARG 31 -12.304 19.701 22.431 233 HG3 ARG 31 1HG ARG 31 -10.703 19.987 23.186 234 HD2 ARG 31 2HD ARG 31 -10.149 21.643 21.326 235 HD3 ARG 31 1HD ARG 31 -11.763 21.292 20.582 236 HE ARG 31 HE ARG 31 -11.513 22.301 23.445 237 HH11 ARG 31 1HH2 ARG 31 -12.773 22.840 20.082 238 HH12 ARG 31 2HH2 ARG 31 -13.371 24.394 20.389 239 HH21 ARG 31 1HH1 ARG 31 -12.470 24.456 23.878 240 HH22 ARG 31 2HH1 ARG 31 -13.481 25.172 22.716 241 H GLY 32 H GLY 32 -6.843 19.964 21.637 242 HA2 GLY 32 2HA GLY 32 -6.795 20.397 24.226 243 HA3 GLY 32 1HA GLY 32 -6.549 18.603 24.186 244 H ALA 33 H ALA 33 -5.189 19.057 21.369 245 HA ALA 33 HA ALA 33 -2.626 19.244 22.703 246 HB1 ALA 33 1HB ALA 33 -3.046 17.270 21.302 247 HB2 ALA 33 2HB ALA 33 -1.729 18.265 20.569 248 HB3 ALA 33 3HB ALA 33 -3.395 18.358 19.908 249 HA PRO 34 HA PRO 34 -1.829 23.080 20.636 250 HB2 PRO 34 2HB PRO 34 0.962 23.214 20.675 251 HB3 PRO 34 1HB PRO 34 -0.060 23.352 22.153 252 HG2 PRO 34 2HG PRO 34 1.378 20.863 21.089 253 HG3 PRO 34 1HG PRO 34 1.336 21.497 22.787 254 HD2 PRO 34 2HD PRO 34 -0.333 19.463 21.890 255 HD3 PRO 34 1HD PRO 34 -0.880 20.683 23.131 256 H GLY 35 H GLY 35 -1.916 23.707 18.490 257 HA2 GLY 35 2HA GLY 35 -0.985 23.996 16.431 258 HA3 GLY 35 1HA GLY 35 0.061 22.539 16.658 259 H ALA 36 H ALA 36 -3.124 22.060 17.709 260 HA ALA 36 HA ALA 36 -3.599 19.989 15.992 261 HB1 ALA 36 1HB ALA 36 -5.922 19.990 16.904 262 HB2 ALA 36 2HB ALA 36 -5.649 21.627 17.614 263 HB3 ALA 36 3HB ALA 36 -4.714 20.198 18.202 264 H ALA 37 H ALA 37 -4.768 19.732 14.140 265 HA ALA 37 HA ALA 37 -5.424 22.208 12.675 266 HB1 ALA 37 1HB ALA 37 -5.149 20.808 10.610 267 HB2 ALA 37 2HB ALA 37 -4.775 19.368 11.639 268 HB3 ALA 37 3HB ALA 37 -3.661 20.776 11.621 269 H LEU 38 H LEU 38 -6.594 18.775 13.127 270 HA LEU 38 HA LEU 38 -9.036 19.495 11.753 271 HB2 LEU 38 2HB LEU 38 -7.940 17.315 11.236 272 HB3 LEU 38 1HB LEU 38 -8.042 16.863 12.958 273 HG LEU 38 HG LEU 38 -10.506 16.812 12.869 274 HD11 LEU 38 1HD1 LEU 38 -10.956 18.509 11.057 275 HD12 LEU 38 2HD1 LEU 38 -11.776 16.960 10.759 276 HD13 LEU 38 3HD1 LEU 38 -10.296 17.363 9.834 277 HD21 LEU 38 3HD2 LEU 38 -9.185 14.797 12.510 278 HD22 LEU 38 1HD2 LEU 38 -9.065 15.119 10.752 279 HD23 LEU 38 2HD2 LEU 38 -10.666 14.723 11.496 280 H ILE 39 H ILE 39 -10.078 20.929 13.241 281 HA ILE 39 HA ILE 39 -10.894 19.618 15.773 282 HB ILE 39 HB ILE 39 -11.002 21.955 16.704 283 HG12 ILE 39 2HG1 ILE 39 -9.232 22.631 14.247 284 HG13 ILE 39 1HG1 ILE 39 -10.931 23.176 14.468 285 HG21 ILE 39 1HG2 ILE 39 -8.229 20.892 15.834 286 HG22 ILE 39 2HG2 ILE 39 -9.211 20.232 17.185 287 HG23 ILE 39 3HG2 ILE 39 -8.579 21.914 17.272 288 HD11 ILE 39 3HD ILE 39 -8.520 23.910 16.261 289 HD12 ILE 39 1HD ILE 39 -9.384 24.983 15.109 290 HD13 ILE 39 2HD ILE 39 -10.231 24.391 16.584 291 H SER 40 H SER 40 -12.535 19.036 13.536 292 HA SER 40 HA SER 40 -14.818 20.163 14.728 293 HB2 SER 40 2HB SER 40 -14.005 21.182 11.988 294 HB3 SER 40 1HB SER 40 -15.733 20.756 12.197 295 HG SER 40 1HG SER 40 -14.214 22.445 13.904 296 H TYR 41 H TYR 41 -16.681 19.075 14.348 297 HA TYR 41 HA TYR 41 -16.280 16.349 13.742 298 HB2 TYR 41 2HB TYR 41 -18.984 17.763 14.152 299 HB3 TYR 41 1HB TYR 41 -18.687 15.989 14.160 300 HD1 TYR 41 1HD TYR 41 -16.706 15.232 15.863 301 HD2 TYR 41 2HD TYR 41 -19.103 18.790 16.215 302 HE1 TYR 41 1HE TYR 41 -16.251 15.293 18.275 303 HE2 TYR 41 2HE TYR 41 -18.677 18.843 18.626 304 HH TYR 41 HH TYR 41 -16.705 16.351 20.278 305 HA PRO 42 HA PRO 42 -18.973 16.843 10.032 306 HB2 PRO 42 2HB PRO 42 -18.945 19.267 8.487 307 HB3 PRO 42 1HB PRO 42 -20.225 18.761 9.649 308 HG2 PRO 42 2HG PRO 42 -17.804 20.571 10.166 309 HG3 PRO 42 1HG PRO 42 -19.527 20.834 10.670 310 HD2 PRO 42 2HD PRO 42 -17.711 19.849 12.437 311 HD3 PRO 42 1HD PRO 42 -19.358 19.078 12.361 312 H ASP 43 H ASP 43 -15.693 18.363 10.051 313 HA ASP 43 HA ASP 43 -15.262 17.069 7.472 314 HB2 ASP 43 2HB ASP 43 -13.185 18.274 7.246 315 HB3 ASP 43 1HB ASP 43 -14.594 19.378 7.386 316 H ALA 44 H ALA 44 -15.109 16.368 10.750 317 HA ALA 44 HA ALA 44 -12.696 15.042 11.000 318 HB1 ALA 44 1HB ALA 44 -13.757 13.693 12.791 319 HB2 ALA 44 2HB ALA 44 -15.405 14.152 12.204 320 HB3 ALA 44 3HB ALA 44 -14.317 15.395 12.895 321 H ILE 45 H ILE 45 -15.844 13.916 9.882 322 HA ILE 45 HA ILE 45 -15.057 11.262 9.456 323 HB ILE 45 HB ILE 45 -17.266 11.762 10.056 324 HG12 ILE 45 2HG1 ILE 45 -17.438 10.926 7.104 325 HG13 ILE 45 1HG1 ILE 45 -16.909 9.867 8.450 326 HG21 ILE 45 1HG2 ILE 45 -17.357 13.705 7.662 327 HG22 ILE 45 2HG2 ILE 45 -17.524 14.082 9.411 328 HG23 ILE 45 3HG2 ILE 45 -18.807 13.172 8.574 329 HD11 ILE 45 3HD ILE 45 -19.687 11.200 8.172 330 HD12 ILE 45 1HD ILE 45 -19.281 9.458 7.999 331 HD13 ILE 45 2HD ILE 45 -19.136 10.250 9.611 332 H TRP 46 H TRP 46 -14.521 14.096 7.581 333 HA TRP 46 HA TRP 46 -14.283 12.579 5.101 334 HB2 TRP 46 2HB TRP 46 -14.548 15.446 5.841 335 HB3 TRP 46 1HB TRP 46 -13.261 15.164 4.640 336 HD1 TRP 46 HD TRP 46 -14.241 15.889 2.444 337 HE1 TRP 46 1HE TRP 46 -16.347 15.546 1.132 338 HE3 TRP 46 3HE TRP 46 -16.766 12.951 5.790 339 HZ2 TRP 46 2HZ TRP 46 -18.715 13.892 1.295 340 HZ3 TRP 46 3HZ TRP 46 -18.942 12.021 5.160 341 HH2 TRP 46 HH TRP 46 -19.911 12.453 2.939 342 H TRP 47 H TRP 47 -12.286 13.794 7.764 343 HA TRP 47 HA TRP 47 -9.814 13.220 6.426 344 HB2 TRP 47 2HB TRP 47 -9.689 14.660 8.441 345 HB3 TRP 47 1HB TRP 47 -10.547 13.424 9.407 346 HD1 TRP 47 HD TRP 47 -7.059 13.600 7.533 347 HE1 TRP 47 1HE TRP 47 -5.521 11.912 8.638 348 HE3 TRP 47 3HE TRP 47 -10.335 11.724 10.952 349 HZ2 TRP 47 2HZ TRP 47 -5.589 10.144 10.897 350 HZ3 TRP 47 3HZ TRP 47 -9.583 9.936 12.474 351 HH2 TRP 47 HH TRP 47 -7.246 9.164 12.468 352 H SER 48 H SER 48 -12.022 11.463 8.674 353 HA SER 48 HA SER 48 -10.590 9.188 8.908 354 HB2 SER 48 2HB SER 48 -13.657 9.374 8.727 355 HB3 SER 48 1HB SER 48 -12.711 8.083 9.561 356 HG SER 48 1HG SER 48 -13.607 9.993 10.798 357 H VAL 49 H VAL 49 -11.993 10.263 5.961 358 HA VAL 49 HA VAL 49 -12.371 7.691 4.757 359 HB VAL 49 HB VAL 49 -11.936 10.483 3.541 360 HG11 VAL 49 1HG1 VAL 49 -11.267 8.740 1.881 361 HG12 VAL 49 2HG1 VAL 49 -12.861 9.435 1.442 362 HG13 VAL 49 3HG1 VAL 49 -12.777 7.812 2.223 363 HG21 VAL 49 3HG2 VAL 49 -14.409 10.360 3.110 364 HG22 VAL 49 1HG2 VAL 49 -14.051 10.279 4.866 365 HG23 VAL 49 2HG2 VAL 49 -14.484 8.775 3.967 366 H GLU 50 H GLU 50 -9.768 10.268 4.636 367 HA GLU 50 HA GLU 50 -8.163 8.476 3.007 368 HB2 GLU 50 2HB GLU 50 -7.500 11.237 4.113 369 HB3 GLU 50 1HB GLU 50 -6.436 10.266 3.050 370 HG2 GLU 50 2HG GLU 50 -8.053 10.406 1.172 371 HG3 GLU 50 1HG GLU 50 -9.205 11.328 2.218 372 H THR 51 H THR 51 -8.130 6.867 4.752 373 HA THR 51 HA THR 51 -5.625 6.911 5.992 374 HB THR 51 HB THR 51 -6.422 8.360 7.696 375 HG1 THR 51 1HG THR 51 -6.215 7.171 9.449 376 HG21 THR 51 3HG2 THR 51 -8.537 8.001 8.981 377 HG22 THR 51 1HG2 THR 51 -8.975 6.626 7.904 378 HG23 THR 51 2HG2 THR 51 -8.844 8.298 7.246 379 H ALA 52 H ALA 52 -8.993 5.685 5.924 380 HA ALA 52 HA ALA 52 -8.494 3.095 6.692 381 HB1 ALA 52 1HB ALA 52 -10.777 4.185 6.410 382 HB2 ALA 52 2HB ALA 52 -10.687 2.572 5.609 383 HB3 ALA 52 3HB ALA 52 -10.584 4.087 4.630 384 H THR 53 H THR 53 -8.290 4.586 3.415 385 HA THR 53 HA THR 53 -7.576 2.040 2.240 386 HB THR 53 HB THR 53 -7.645 3.582 0.138 387 HG1 THR 53 1HG THR 53 -7.615 5.579 0.957 388 HG21 THR 53 3HG2 THR 53 -10.166 3.231 1.917 389 HG22 THR 53 1HG2 THR 53 -9.463 1.983 0.824 390 HG23 THR 53 2HG2 THR 53 -10.145 3.503 0.135 391 H THR 54 H THR 54 -5.820 3.738 4.189 392 HA THR 54 HA THR 54 -3.774 4.378 4.434 393 HB THR 54 HB THR 54 -2.075 2.657 3.779 394 HG1 THR 54 1HG THR 54 -3.101 2.027 1.845 395 HG21 THR 54 3HG2 THR 54 -3.123 0.954 5.237 396 HG22 THR 54 1HG2 THR 54 -4.771 1.624 4.947 397 HG23 THR 54 2HG2 THR 54 -3.549 2.588 5.852 398 H VAL 55 H VAL 55 -4.180 6.395 3.077 399 HA VAL 55 HA VAL 55 -1.975 6.900 1.407 400 HB VAL 55 HB VAL 55 -4.911 6.841 0.452 401 HG11 VAL 55 1HG1 VAL 55 -4.368 9.164 -0.007 402 HG12 VAL 55 2HG1 VAL 55 -4.215 8.289 -1.564 403 HG13 VAL 55 3HG1 VAL 55 -2.737 8.737 -0.637 404 HG21 VAL 55 3HG2 VAL 55 -3.901 5.955 -1.702 405 HG22 VAL 55 1HG2 VAL 55 -3.582 4.906 -0.281 406 HG23 VAL 55 2HG2 VAL 55 -2.278 5.982 -0.908 407 H GLY 56 H GLY 56 -2.170 9.512 1.489 408 HA2 GLY 56 2HA GLY 56 -4.381 10.575 2.906 409 HA3 GLY 56 1HA GLY 56 -2.764 10.611 3.774 410 H TYR 57 H TYR 57 -4.628 12.418 1.555 411 HA TYR 57 HA TYR 57 -2.414 12.807 -0.317 412 HB2 TYR 57 2HB TYR 57 -5.183 14.160 -0.119 413 HB3 TYR 57 1HB TYR 57 -3.928 14.619 -1.329 414 HD1 TYR 57 2HD TYR 57 -5.845 11.617 -0.115 415 HD2 TYR 57 1HD TYR 57 -3.931 13.558 -3.426 416 HE1 TYR 57 2HE TYR 57 -6.997 10.108 -1.628 417 HE2 TYR 57 1HE TYR 57 -5.036 11.995 -4.978 418 HH TYR 57 HH TYR 57 -7.511 9.655 -3.766 419 H GLY 58 H GLY 58 -3.473 14.116 2.671 420 HA2 GLY 58 2HA GLY 58 -1.846 15.384 3.806 421 HA3 GLY 58 1HA GLY 58 -1.499 16.305 2.311 422 H ASP 59 H ASP 59 -4.871 15.741 3.135 423 HA ASP 59 HA ASP 59 -5.187 18.590 3.339 424 HB2 ASP 59 2HB ASP 59 -6.782 17.366 2.005 425 HB3 ASP 59 1HB ASP 59 -7.181 16.317 3.387 426 H ARG 60 H ARG 60 -5.382 15.897 5.810 427 HA ARG 60 HA ARG 60 -5.216 17.927 7.863 428 HB2 ARG 60 2HB ARG 60 -7.371 15.688 7.923 429 HB3 ARG 60 1HB ARG 60 -6.966 16.741 9.309 430 HG2 ARG 60 2HG ARG 60 -8.194 17.725 6.661 431 HG3 ARG 60 1HG ARG 60 -9.134 17.176 8.086 432 HD2 ARG 60 2HD ARG 60 -8.045 18.988 9.504 433 HD3 ARG 60 1HD ARG 60 -7.231 19.634 8.022 434 HE ARG 60 HE ARG 60 -10.156 19.721 8.703 435 HH11 ARG 60 1HH2 ARG 60 -7.784 19.914 5.978 436 HH12 ARG 60 2HH2 ARG 60 -8.934 20.215 4.855 437 HH21 ARG 60 1HH1 ARG 60 -11.591 20.513 7.349 438 HH22 ARG 60 2HH1 ARG 60 -11.235 21.084 5.718 439 H TYR 61 H TYR 61 -4.201 16.798 9.878 440 HA TYR 61 HA TYR 61 -4.134 14.008 9.858 441 HB2 TYR 61 2HB TYR 61 -2.155 14.610 8.251 442 HB3 TYR 61 1HB TYR 61 -1.422 15.516 9.614 443 HD1 TYR 61 1HD TYR 61 -3.024 12.066 9.197 444 HD2 TYR 61 2HD TYR 61 0.410 14.340 10.425 445 HE1 TYR 61 1HE TYR 61 -1.852 9.984 9.776 446 HE2 TYR 61 2HE TYR 61 1.597 12.243 10.954 447 HH TYR 61 HH TYR 61 1.575 9.957 10.926 448 HA PRO 62 HA PRO 62 -3.508 15.772 14.041 449 HB2 PRO 62 2HB PRO 62 -3.101 13.406 15.513 450 HB3 PRO 62 1HB PRO 62 -4.704 13.958 14.935 451 HG2 PRO 62 2HG PRO 62 -2.825 11.966 13.540 452 HG3 PRO 62 1HG PRO 62 -4.591 11.758 13.947 453 HD2 PRO 62 2HD PRO 62 -3.843 12.586 11.455 454 HD3 PRO 62 1HD PRO 62 -5.243 13.405 12.292 455 H VAL 63 H VAL 63 -1.836 15.473 15.881 456 HA VAL 63 HA VAL 63 0.830 14.845 14.766 457 HB VAL 63 HB VAL 63 0.472 17.202 14.823 458 HG11 VAL 63 1HG1 VAL 63 0.064 17.026 17.880 459 HG12 VAL 63 2HG1 VAL 63 -1.103 17.521 16.612 460 HG13 VAL 63 3HG1 VAL 63 0.340 18.521 16.920 461 HG21 VAL 63 3HG2 VAL 63 2.739 16.331 14.959 462 HG22 VAL 63 1HG2 VAL 63 2.712 16.341 16.763 463 HG23 VAL 63 2HG2 VAL 63 2.576 17.879 15.846 464 H THR 64 H THR 64 1.312 15.620 17.924 465 HA THR 64 HA THR 64 1.841 12.798 18.332 466 HB THR 64 HB THR 64 3.042 15.380 19.421 467 HG1 THR 64 1HG THR 64 4.811 14.584 18.272 468 HG21 THR 64 3HG2 THR 64 4.795 13.993 20.557 469 HG22 THR 64 1HG2 THR 64 3.869 12.496 20.221 470 HG23 THR 64 2HG2 THR 64 3.191 13.754 21.308 471 H GLU 65 H GLU 65 0.625 15.506 20.489 472 HA GLU 65 HA GLU 65 0.234 13.573 22.534 473 HB2 GLU 65 2HB GLU 65 0.878 15.976 23.000 474 HB3 GLU 65 1HB GLU 65 -0.807 16.453 22.594 475 HG2 GLU 65 2HG GLU 65 -1.681 15.084 24.460 476 HG3 GLU 65 1HG GLU 65 -0.057 14.367 24.759 477 H GLU 66 H GLU 66 -1.506 14.410 19.799 478 HA GLU 66 HA GLU 66 -4.138 13.972 20.657 479 HB2 GLU 66 2HB GLU 66 -2.735 13.955 17.915 480 HB3 GLU 66 1HB GLU 66 -4.511 14.045 18.149 481 HG2 GLU 66 2HG GLU 66 -4.315 16.128 19.455 482 HG3 GLU 66 1HG GLU 66 -2.518 16.096 19.367 483 H GLY 67 H GLY 67 -1.408 11.974 20.252 484 HA2 GLY 67 2HA GLY 67 -1.205 9.799 20.795 485 HA3 GLY 67 1HA GLY 67 -3.023 9.616 20.775 486 H ARG 68 H ARG 68 -0.092 9.990 18.727 487 HA ARG 68 HA ARG 68 -1.254 10.208 16.290 488 HB2 ARG 68 2HB ARG 68 1.146 10.440 16.814 489 HB3 ARG 68 1HB ARG 68 1.303 8.663 17.058 490 HG2 ARG 68 2HG ARG 68 0.728 8.307 14.603 491 HG3 ARG 68 1HG ARG 68 0.598 10.082 14.405 492 HD2 ARG 68 2HD ARG 68 3.123 8.467 15.197 493 HD3 ARG 68 1HD ARG 68 2.834 9.289 13.624 494 HE ARG 68 HE ARG 68 3.424 10.523 16.275 495 HH11 ARG 68 1HH2 ARG 68 2.825 11.142 12.735 496 HH12 ARG 68 2HH2 ARG 68 2.606 12.830 12.991 497 HH21 ARG 68 1HH1 ARG 68 3.438 13.045 16.404 498 HH22 ARG 68 2HH1 ARG 68 3.217 13.826 14.885 499 H LYS 69 H LYS 69 -1.184 7.410 18.315 500 HA LYS 69 HA LYS 69 -1.655 5.419 16.393 501 HB2 LYS 69 2HB LYS 69 -2.466 5.623 19.347 502 HB3 LYS 69 1HB LYS 69 -2.821 4.187 18.339 503 HG2 LYS 69 2HG LYS 69 0.036 5.221 18.849 504 HG3 LYS 69 1HG LYS 69 -0.791 3.912 19.768 505 HD2 LYS 69 2HD LYS 69 -1.104 2.613 17.632 506 HD3 LYS 69 1HD LYS 69 -0.194 3.881 16.742 507 HE2 LYS 69 2HE LYS 69 1.835 3.427 18.179 508 HE3 LYS 69 1HE LYS 69 0.945 2.073 18.986 509 HZ1 LYS 69 3HZ LYS 69 0.839 0.934 16.862 510 HZ2 LYS 69 1HZ LYS 69 2.427 1.415 17.155 511 HZ3 LYS 69 2HZ LYS 69 1.411 2.259 16.033 512 H VAL 70 H VAL 70 -3.758 8.090 17.359 513 HA VAL 70 HA VAL 70 -6.172 6.773 16.727 514 HB VAL 70 HB VAL 70 -5.376 9.722 16.688 515 HG11 VAL 70 1HG1 VAL 70 -7.857 10.182 16.679 516 HG12 VAL 70 2HG1 VAL 70 -8.177 8.439 16.333 517 HG13 VAL 70 3HG1 VAL 70 -7.304 9.467 15.134 518 HG21 VAL 70 3HG2 VAL 70 -5.345 8.569 18.942 519 HG22 VAL 70 1HG2 VAL 70 -7.020 7.977 18.658 520 HG23 VAL 70 2HG2 VAL 70 -6.692 9.742 18.814 521 H ALA 71 H ALA 71 -3.651 8.385 14.747 522 HA ALA 71 HA ALA 71 -5.200 8.255 12.345 523 HB1 ALA 71 1HB ALA 71 -3.281 9.860 12.496 524 HB2 ALA 71 2HB ALA 71 -3.010 8.674 11.175 525 HB3 ALA 71 3HB ALA 71 -2.141 8.490 12.739 526 H GLU 72 H GLU 72 -2.461 6.357 13.716 527 HA GLU 72 HA GLU 72 -2.371 4.489 11.664 528 HB2 GLU 72 2HB GLU 72 -1.644 4.070 14.629 529 HB3 GLU 72 1HB GLU 72 -1.462 2.822 13.363 530 HG2 GLU 72 2HG GLU 72 -0.026 4.660 12.072 531 HG3 GLU 72 1HG GLU 72 0.187 5.363 13.729 532 H GLN 73 H GLN 73 -4.447 4.462 14.618 533 HA GLN 73 HA GLN 73 -5.029 1.757 14.443 534 HB2 GLN 73 2HB GLN 73 -5.477 3.130 16.459 535 HB3 GLN 73 1HB GLN 73 -6.805 3.981 15.601 536 HG2 GLN 73 2HG GLN 73 -8.094 1.835 15.461 537 HG3 GLN 73 1HG GLN 73 -6.702 0.937 16.177 538 HE21 GLN 73 1HE2 GLN 73 -9.085 0.670 17.472 539 HE22 GLN 73 2HE2 GLN 73 -9.076 1.535 18.963 540 H VAL 74 H VAL 74 -6.470 4.545 12.726 541 HA VAL 74 HA VAL 74 -8.679 2.997 11.787 542 HB VAL 74 HB VAL 74 -7.569 5.579 10.607 543 HG11 VAL 74 1HG1 VAL 74 -9.987 5.831 9.847 544 HG12 VAL 74 2HG1 VAL 74 -10.341 4.181 10.475 545 HG13 VAL 74 3HG1 VAL 74 -9.189 4.403 9.106 546 HG21 VAL 74 3HG2 VAL 74 -9.237 6.710 12.073 547 HG22 VAL 74 1HG2 VAL 74 -8.030 5.847 13.061 548 HG23 VAL 74 2HG2 VAL 74 -9.658 5.129 12.844 549 H MET 75 H MET 75 -5.449 3.909 10.535 550 HA MET 75 HA MET 75 -5.691 2.818 7.989 551 HB2 MET 75 2HB MET 75 -3.195 2.983 9.795 552 HB3 MET 75 1HB MET 75 -3.165 2.679 8.028 553 HG2 MET 75 2HG MET 75 -4.090 4.879 7.542 554 HG3 MET 75 1HG MET 75 -4.457 5.163 9.262 555 HE1 MET 75 3HE MET 75 -2.083 7.970 8.690 556 HE2 MET 75 1HE MET 75 -3.686 7.378 9.240 557 HE3 MET 75 2HE MET 75 -3.233 7.264 7.506 558 H LYS 76 H LYS 76 -4.496 1.375 11.043 559 HA LYS 76 HA LYS 76 -3.804 -1.076 9.911 560 HB2 LYS 76 2HB LYS 76 -3.202 0.074 12.212 561 HB3 LYS 76 1HB LYS 76 -4.588 -0.839 12.870 562 HG2 LYS 76 2HG LYS 76 -2.339 -2.206 11.242 563 HG3 LYS 76 1HG LYS 76 -2.045 -1.689 12.931 564 HD2 LYS 76 2HD LYS 76 -3.875 -3.129 13.763 565 HD3 LYS 76 1HD LYS 76 -4.211 -3.713 12.091 566 HE2 LYS 76 2HE LYS 76 -1.968 -4.755 11.928 567 HE3 LYS 76 1HE LYS 76 -1.446 -3.977 13.471 568 HZ1 LYS 76 3HZ LYS 76 -1.926 -6.275 13.764 569 HZ2 LYS 76 1HZ LYS 76 -3.549 -6.105 13.240 570 HZ3 LYS 76 2HZ LYS 76 -2.987 -5.354 14.677 571 H ALA 77 H ALA 77 -6.875 0.122 11.238 572 HA ALA 77 HA ALA 77 -8.179 -2.385 11.308 573 HB1 ALA 77 1HB ALA 77 -9.115 -0.356 12.481 574 HB2 ALA 77 2HB ALA 77 -10.311 -1.057 11.325 575 HB3 ALA 77 3HB ALA 77 -9.386 0.426 10.884 576 H GLY 78 H GLY 78 -7.795 0.137 8.787 577 HA2 GLY 78 2HA GLY 78 -9.492 -1.021 6.870 578 HA3 GLY 78 1HA GLY 78 -8.111 0.113 6.603 579 H ILE 79 H ILE 79 -5.968 -1.316 7.431 580 HA ILE 79 HA ILE 79 -5.403 -3.010 5.324 581 HB ILE 79 HB ILE 79 -4.108 -2.803 8.085 582 HG12 ILE 79 2HG1 ILE 79 -3.224 -1.717 5.329 583 HG13 ILE 79 1HG1 ILE 79 -4.104 -0.749 6.537 584 HG21 ILE 79 1HG2 ILE 79 -3.072 -4.261 5.553 585 HG22 ILE 79 2HG2 ILE 79 -3.511 -5.039 7.118 586 HG23 ILE 79 3HG2 ILE 79 -2.100 -3.950 7.034 587 HD11 ILE 79 3HD ILE 79 -1.283 -1.963 6.901 588 HD12 ILE 79 1HD ILE 79 -1.712 -0.235 6.696 589 HD13 ILE 79 2HD ILE 79 -2.207 -1.103 8.192 590 H GLU 80 H GLU 80 -6.447 -3.897 8.709 591 HA GLU 80 HA GLU 80 -6.203 -6.645 8.114 592 HB2 GLU 80 2HB GLU 80 -7.778 -5.289 10.352 593 HB3 GLU 80 1HB GLU 80 -7.598 -7.070 10.159 594 HG2 GLU 80 2HG GLU 80 -5.085 -6.814 10.210 595 HG3 GLU 80 1HG GLU 80 -5.290 -5.066 10.592 596 H VAL 81 H VAL 81 -8.903 -4.386 7.597 597 HA VAL 81 HA VAL 81 -10.818 -6.404 7.024 598 HB VAL 81 HB VAL 81 -10.572 -3.440 6.353 599 HG11 VAL 81 1HG1 VAL 81 -12.995 -3.591 5.553 600 HG12 VAL 81 2HG1 VAL 81 -12.827 -5.380 5.507 601 HG13 VAL 81 3HG1 VAL 81 -11.815 -4.344 4.434 602 HG21 VAL 81 3HG2 VAL 81 -12.422 -3.285 8.023 603 HG22 VAL 81 1HG2 VAL 81 -11.050 -4.189 8.741 604 HG23 VAL 81 2HG2 VAL 81 -12.501 -5.078 8.149 605 H PHE 82 H PHE 82 -8.674 -4.384 4.882 606 HA PHE 82 HA PHE 82 -9.548 -5.801 2.585 607 HB2 PHE 82 2HB PHE 82 -7.049 -4.034 2.962 608 HB3 PHE 82 1HB PHE 82 -7.658 -4.635 1.375 609 HD1 PHE 82 1HD PHE 82 -10.493 -4.260 1.317 610 HD2 PHE 82 2HD PHE 82 -7.515 -1.758 3.163 611 HE1 PHE 82 1HE PHE 82 -12.012 -2.334 1.160 612 HE2 PHE 82 2HE PHE 82 -9.032 0.174 2.983 613 HZ PHE 82 HZ PHE 82 -11.289 -0.096 1.987 614 H ALA 83 H ALA 83 -7.112 -6.511 4.982 615 HA ALA 83 HA ALA 83 -5.664 -8.344 3.370 616 HB1 ALA 83 1HB ALA 83 -4.658 -7.416 5.466 617 HB2 ALA 83 2HB ALA 83 -4.719 -9.212 5.524 618 HB3 ALA 83 3HB ALA 83 -5.929 -8.238 6.443 619 H LEU 84 H LEU 84 -8.415 -8.630 5.663 620 HA LEU 84 HA LEU 84 -8.511 -11.376 5.877 621 HB2 LEU 84 2HB LEU 84 -9.767 -9.731 7.276 622 HB3 LEU 84 1HB LEU 84 -10.851 -9.353 5.911 623 HG LEU 84 HG LEU 84 -10.625 -12.232 6.931 624 HD11 LEU 84 1HD1 LEU 84 -12.332 -10.048 8.291 625 HD12 LEU 84 2HD1 LEU 84 -10.874 -10.849 8.990 626 HD13 LEU 84 3HD1 LEU 84 -12.357 -11.814 8.661 627 HD21 LEU 84 3HD2 LEU 84 -13.008 -10.630 5.784 628 HD22 LEU 84 1HD2 LEU 84 -13.069 -12.335 6.365 629 HD23 LEU 84 2HD2 LEU 84 -12.074 -11.921 4.937 630 H VAL 85 H VAL 85 -10.020 -9.216 3.454 631 HA VAL 85 HA VAL 85 -11.522 -11.256 2.280 632 HB VAL 85 HB VAL 85 -12.113 -9.725 0.551 633 HG11 VAL 85 1HG1 VAL 85 -12.902 -9.427 3.029 634 HG12 VAL 85 2HG1 VAL 85 -13.079 -7.984 1.962 635 HG13 VAL 85 3HG1 VAL 85 -11.740 -8.073 3.146 636 HG21 VAL 85 3HG2 VAL 85 -9.857 -7.885 1.583 637 HG22 VAL 85 1HG2 VAL 85 -11.046 -7.484 0.304 638 HG23 VAL 85 2HG2 VAL 85 -9.820 -8.761 0.011 639 H THR 86 H THR 86 -8.143 -10.908 2.131 640 HA THR 86 HA THR 86 -7.621 -11.529 -0.527 641 HB THR 86 HB THR 86 -5.938 -12.475 1.838 642 HG1 THR 86 1HG THR 86 -6.153 -10.387 2.161 643 HG21 THR 86 3HG2 THR 86 -4.060 -12.104 0.168 644 HG22 THR 86 1HG2 THR 86 -5.270 -11.687 -1.100 645 HG23 THR 86 2HG2 THR 86 -5.206 -13.355 -0.419 646 H ALA 87 H ALA 87 -8.982 -13.464 2.027 647 HA ALA 87 HA ALA 87 -8.520 -16.044 1.114 648 HB1 ALA 87 1HB ALA 87 -11.136 -14.892 2.315 649 HB2 ALA 87 2HB ALA 87 -9.722 -15.387 3.284 650 HB3 ALA 87 3HB ALA 87 -10.621 -16.623 2.336 651 H ALA 88 H ALA 88 -10.791 -13.533 -0.034 652 HA ALA 88 HA ALA 88 -12.315 -15.355 -1.670 653 HB1 ALA 88 1HB ALA 88 -12.252 -12.269 -1.587 654 HB2 ALA 88 2HB ALA 88 -13.428 -13.317 -0.711 655 HB3 ALA 88 3HB ALA 88 -13.427 -13.268 -2.509 656 H LEU 89 H LEU 89 -9.650 -12.988 -1.993 657 HA LEU 89 HA LEU 89 -9.692 -13.034 -4.813 658 HB2 LEU 89 2HB LEU 89 -7.499 -12.102 -2.875 659 HB3 LEU 89 1HB LEU 89 -7.342 -12.035 -4.656 660 HG LEU 89 HG LEU 89 -7.901 -9.878 -3.949 661 HD11 LEU 89 1HD1 LEU 89 -9.862 -9.344 -5.286 662 HD12 LEU 89 2HD1 LEU 89 -10.502 -11.023 -5.165 663 HD13 LEU 89 3HD1 LEU 89 -8.971 -10.694 -6.068 664 HD21 LEU 89 3HD2 LEU 89 -8.932 -10.264 -1.739 665 HD22 LEU 89 1HD2 LEU 89 -10.451 -10.858 -2.519 666 HD23 LEU 89 2HD2 LEU 89 -9.914 -9.158 -2.750 667 H ALA 90 H ALA 90 -8.011 -15.035 -2.421 668 HA ALA 90 HA ALA 90 -6.194 -16.176 -4.212 669 HB1 ALA 90 1HB ALA 90 -6.009 -16.445 -1.734 670 HB2 ALA 90 2HB ALA 90 -6.011 -18.045 -2.566 671 HB3 ALA 90 3HB ALA 90 -7.505 -17.449 -1.741 672 H THR 91 H THR 91 -9.634 -17.006 -3.548 673 HA THR 91 HA THR 91 -9.525 -19.334 -5.206 674 HB THR 91 HB THR 91 -12.197 -18.824 -4.967 675 HG1 THR 91 1HG THR 91 -11.732 -16.783 -3.957 676 HG21 THR 91 3HG2 THR 91 -10.953 -20.811 -4.106 677 HG22 THR 91 1HG2 THR 91 -12.046 -20.161 -2.838 678 HG23 THR 91 2HG2 THR 91 -10.269 -19.828 -2.767 679 H ASP 92 H ASP 92 -9.442 -15.980 -6.015 680 HA ASP 92 HA ASP 92 -11.582 -16.111 -7.835 681 HB2 ASP 92 2HB ASP 92 -10.421 -13.953 -6.764 682 HB3 ASP 92 1HB ASP 92 -9.456 -13.991 -8.281 683 H PHE 93 H PHE 93 -8.151 -16.901 -8.085 684 HA PHE 93 HA PHE 93 -8.297 -17.126 -10.944 685 HB2 PHE 93 2HB PHE 93 -6.140 -18.072 -11.013 686 HB3 PHE 93 1HB PHE 93 -6.090 -16.799 -9.764 687 HD1 PHE 93 1HD PHE 93 -5.994 -20.449 -10.424 688 HD2 PHE 93 2HD PHE 93 -5.690 -17.407 -7.406 689 HE1 PHE 93 1HE PHE 93 -5.035 -22.107 -8.854 690 HE2 PHE 93 2HE PHE 93 -4.735 -19.064 -5.845 691 HZ PHE 93 HZ PHE 93 -4.413 -21.408 -6.552 692 H VAL 94 H VAL 94 -9.181 -19.191 -8.255 693 HA VAL 94 HA VAL 94 -8.762 -21.658 -9.549 694 HB VAL 94 HB VAL 94 -10.601 -20.983 -7.199 695 HG11 VAL 94 1HG1 VAL 94 -10.228 -23.410 -6.588 696 HG12 VAL 94 2HG1 VAL 94 -9.349 -23.658 -8.145 697 HG13 VAL 94 3HG1 VAL 94 -11.102 -23.239 -8.150 698 HG21 VAL 94 3HG2 VAL 94 -8.610 -21.669 -5.804 699 HG22 VAL 94 1HG2 VAL 94 -8.201 -20.238 -6.801 700 HG23 VAL 94 2HG2 VAL 94 -7.629 -21.867 -7.295 701 H ARG 95 H ARG 95 -11.257 -19.209 -9.725 702 HA ARG 95 HA ARG 95 -13.325 -20.835 -10.704 703 HB2 ARG 95 2HB ARG 95 -13.685 -18.490 -9.902 704 HB3 ARG 95 1HB ARG 95 -12.813 -17.869 -11.341 705 HG2 ARG 95 2HG ARG 95 -14.549 -18.782 -12.850 706 HG3 ARG 95 1HG ARG 95 -15.361 -19.621 -11.494 707 HD2 ARG 95 2HD ARG 95 -15.116 -16.544 -11.836 708 HD3 ARG 95 1HD ARG 95 -16.575 -17.526 -12.239 709 HE ARG 95 HE ARG 95 -15.611 -16.677 -9.589 710 HH11 ARG 95 1HH2 ARG 95 -17.958 -18.904 -11.348 711 HH12 ARG 95 2HH2 ARG 95 -18.630 -19.462 -9.869 712 HH21 ARG 95 1HH1 ARG 95 -16.831 -17.430 -7.634 713 HH22 ARG 95 2HH1 ARG 95 -18.090 -18.612 -7.863 714 H ARG 96 H ARG 96 -10.298 -19.860 -12.232 715 HA ARG 96 HA ARG 96 -11.318 -19.932 -14.883 716 HB2 ARG 96 2HB ARG 96 -9.119 -19.695 -15.674 717 HB3 ARG 96 1HB ARG 96 -9.128 -18.815 -14.112 718 HG2 ARG 96 2HG ARG 96 -8.169 -21.064 -13.091 719 HG3 ARG 96 1HG ARG 96 -7.927 -21.563 -14.797 720 HD2 ARG 96 2HD ARG 96 -6.497 -19.494 -15.188 721 HD3 ARG 96 1HD ARG 96 -6.714 -19.066 -13.444 722 HE ARG 96 HE ARG 96 -5.265 -20.773 -12.821 723 HH11 ARG 96 1HH2 ARG 96 -6.186 -21.389 -16.322 724 HH12 ARG 96 2HH2 ARG 96 -4.963 -22.555 -16.524 725 HH21 ARG 96 1HH1 ARG 96 -3.569 -22.429 -13.233 726 HH22 ARG 96 2HH1 ARG 96 -3.427 -23.147 -14.770 727 H GLU 97 H GLU 97 -10.896 -22.445 -12.629 728 HA GLU 97 HA GLU 97 -10.125 -24.496 -14.502 729 HB2 GLU 97 2HB GLU 97 -11.510 -24.672 -11.752 730 HB3 GLU 97 1HB GLU 97 -10.843 -26.068 -12.679 731 HG2 GLU 97 2HG GLU 97 -8.525 -25.160 -12.385 732 HG3 GLU 97 1HG GLU 97 -9.193 -23.756 -11.467 733 H GLU 98 H GLU 98 -12.988 -22.700 -13.733 734 HA GLU 98 HA GLU 98 -14.762 -24.789 -14.767 735 HB2 GLU 98 2HB GLU 98 -15.468 -22.290 -13.093 736 HB3 GLU 98 1HB GLU 98 -16.579 -23.629 -13.557 737 HG2 GLU 98 2HG GLU 98 -15.161 -25.213 -12.145 738 HG3 GLU 98 1HG GLU 98 -14.151 -23.807 -11.631 739 H GLU 99 H GLU 99 -16.682 -23.263 -15.831 740 HA GLU 99 HA GLU 99 -17.328 -21.975 -17.418 741 HB2 GLU 99 2HB GLU 99 -14.947 -20.092 -17.143 742 HB3 GLU 99 1HB GLU 99 -16.559 -19.782 -17.867 743 HG2 GLU 99 2HG GLU 99 -17.443 -20.453 -15.408 744 HG3 GLU 99 1HG GLU 99 -15.743 -20.096 -14.920 745 H ARG 100 H ARG 100 -13.808 -22.013 -17.834 746 HA ARG 100 HA ARG 100 -13.841 -22.190 -20.667 747 HB2 ARG 100 2HB ARG 100 -11.972 -21.209 -19.305 748 HB3 ARG 100 1HB ARG 100 -11.660 -22.811 -18.570 749 HG2 ARG 100 2HG ARG 100 -10.910 -23.693 -20.770 750 HG3 ARG 100 1HG ARG 100 -11.393 -22.171 -21.583 751 HD2 ARG 100 2HD ARG 100 -8.861 -22.356 -21.152 752 HD3 ARG 100 1HD ARG 100 -9.648 -20.880 -20.470 753 HE ARG 100 HE ARG 100 -8.834 -21.511 -18.426 754 HH11 ARG 100 1HH2 ARG 100 -8.741 -24.591 -20.380 755 HH12 ARG 100 2HH2 ARG 100 -8.438 -25.528 -18.960 756 HH21 ARG 100 1HH1 ARG 100 -8.967 -23.037 -16.592 757 HH22 ARG 100 2HH1 ARG 100 -8.396 -24.658 -16.870 758 H ARG 101 H ARG 101 -13.579 -24.488 -17.949 759 HA ARG 101 HA ARG 101 -13.790 -26.763 -19.810 760 HB2 ARG 101 2HB ARG 101 -11.593 -26.530 -18.470 761 HB3 ARG 101 1HB ARG 101 -12.589 -26.471 -16.993 762 HG2 ARG 101 2HG ARG 101 -13.416 -28.884 -17.698 763 HG3 ARG 101 1HG ARG 101 -12.055 -28.843 -18.869 764 HD2 ARG 101 2HD ARG 101 -11.237 -29.927 -16.786 765 HD3 ARG 101 1HD ARG 101 -10.478 -28.300 -16.888 766 HE ARG 101 HE ARG 101 -11.975 -27.465 -15.172 767 HH11 ARG 101 1HH2 ARG 101 -12.748 -30.932 -15.981 768 HH12 ARG 101 2HH2 ARG 101 -13.996 -31.032 -14.844 769 HH21 ARG 101 1HH1 ARG 101 -13.022 -28.045 -13.043 770 HH22 ARG 101 2HH1 ARG 101 -13.778 -29.548 -12.912 771 H GLY 102 H GLY 102 -15.845 -27.794 -19.495 772 HA2 GLY 102 2HA GLY 102 -17.360 -28.772 -18.111 773 HA3 GLY 102 1HA GLY 102 -17.035 -27.558 -16.820 774 H HIS 103 H HIS 103 -17.189 -25.712 -19.563 775 HA HIS 103 HA HIS 103 -20.010 -25.715 -19.975 776 HB2 HIS 103 2HB HIS 103 -19.988 -24.339 -17.879 777 HB3 HIS 103 1HB HIS 103 -18.638 -23.357 -18.509 778 HD1 HIS 103 1HD HIS 103 -19.339 -21.796 -20.766 779 HD2 HIS 103 2HD HIS 103 -22.465 -23.220 -18.290 780 HE1 HIS 103 1HE HIS 103 -21.343 -20.389 -21.214 781 HE2 HIS 103 2HE HIS 103 -23.171 -21.151 -19.669 782 H1 SER 1 H SER 1 1.330 -16.417 -20.899 783 HA SER 1 HA SER 1 -0.197 -15.091 -22.305 784 HB2 SER 1 2HB SER 1 -1.734 -16.556 -23.806 785 HB3 SER 1 1HB SER 1 -0.085 -16.220 -24.440 786 HG SER 1 1HG SER 1 -0.976 -18.467 -24.492 787 H ALA 2 H ALA 2 -0.159 -18.259 -21.049 788 HA ALA 2 HA ALA 2 -1.896 -19.551 -20.687 789 HB1 ALA 2 1HB ALA 2 -0.391 -19.687 -18.795 790 HB2 ALA 2 2HB ALA 2 -2.081 -20.180 -18.417 791 HB3 ALA 2 3HB ALA 2 -1.455 -18.594 -17.868 792 H ASP 3 H ASP 3 -3.277 -17.383 -18.208 793 HA ASP 3 HA ASP 3 -5.864 -17.730 -19.607 794 HB2 ASP 3 2HB ASP 3 -5.178 -20.011 -18.648 795 HB3 ASP 3 1HB ASP 3 -5.134 -19.283 -17.016 796 H HIS 4 H HIS 4 -4.264 -17.329 -16.470 797 HA HIS 4 HA HIS 4 -6.369 -15.637 -15.442 798 HB2 HIS 4 2HB HIS 4 -4.920 -15.470 -13.374 799 HB3 HIS 4 1HB HIS 4 -5.297 -17.147 -13.843 800 HD1 HIS 4 1HD HIS 4 -2.322 -14.774 -13.655 801 HD2 HIS 4 2HD HIS 4 -3.109 -18.727 -14.834 802 HE1 HIS 4 1HE HIS 4 -0.099 -15.977 -13.820 803 HE2 HIS 4 2HE HIS 4 -0.589 -18.222 -14.728 804 H GLU 5 H GLU 5 -3.206 -15.282 -16.964 805 HA GLU 5 HA GLU 5 -2.606 -12.724 -16.116 806 HB2 GLU 5 2HB GLU 5 -1.828 -14.121 -18.758 807 HB3 GLU 5 1HB GLU 5 -1.020 -12.708 -18.006 808 HG2 GLU 5 2HG GLU 5 0.399 -14.343 -17.276 809 HG3 GLU 5 1HG GLU 5 -0.737 -14.349 -15.891 810 H ARG 6 H ARG 6 -4.694 -13.880 -18.753 811 HA ARG 6 HA ARG 6 -4.727 -11.396 -20.127 812 HB2 ARG 6 2HB ARG 6 -6.823 -13.651 -20.141 813 HB3 ARG 6 1HB ARG 6 -6.776 -12.242 -21.253 814 HG2 ARG 6 2HG ARG 6 -4.424 -13.006 -21.983 815 HG3 ARG 6 1HG ARG 6 -4.673 -14.495 -21.016 816 HD2 ARG 6 2HD ARG 6 -5.198 -14.924 -23.405 817 HD3 ARG 6 1HD ARG 6 -6.716 -15.047 -22.405 818 HE ARG 6 HE ARG 6 -6.301 -12.321 -23.428 819 HH11 ARG 6 1HH2 ARG 6 -7.164 -15.608 -24.568 820 HH12 ARG 6 2HH2 ARG 6 -7.966 -15.090 -25.969 821 HH21 ARG 6 1HH1 ARG 6 -7.833 -11.579 -25.144 822 HH22 ARG 6 2HH1 ARG 6 -8.676 -12.742 -26.086 823 H GLU 7 H GLU 7 -6.733 -12.856 -17.548 824 HA GLU 7 HA GLU 7 -8.664 -10.807 -17.576 825 HB2 GLU 7 2HB GLU 7 -8.828 -13.215 -16.541 826 HB3 GLU 7 1HB GLU 7 -7.974 -12.519 -15.129 827 HG2 GLU 7 2HG GLU 7 -10.341 -12.468 -14.630 828 HG3 GLU 7 1HG GLU 7 -9.892 -10.764 -14.997 829 H ALA 8 H ALA 8 -5.611 -11.324 -15.822 830 HA ALA 8 HA ALA 8 -5.773 -9.176 -14.052 831 HB1 ALA 8 1HB ALA 8 -3.990 -10.903 -13.824 832 HB2 ALA 8 2HB ALA 8 -3.238 -9.276 -14.016 833 HB3 ALA 8 3HB ALA 8 -3.282 -10.407 -15.408 834 H GLN 9 H GLN 9 -4.273 -9.322 -17.347 835 HA GLN 9 HA GLN 9 -3.492 -6.609 -17.283 836 HB2 GLN 9 2HB GLN 9 -3.963 -8.524 -19.628 837 HB3 GLN 9 1HB GLN 9 -3.292 -6.876 -19.838 838 HG2 GLN 9 2HG GLN 9 -1.829 -8.554 -17.780 839 HG3 GLN 9 1HG GLN 9 -1.804 -9.218 -19.447 840 HE21 GLN 9 1HE2 GLN 9 -1.351 -5.907 -17.787 841 HE22 GLN 9 2HE2 GLN 9 -0.123 -5.419 -18.868 842 H LYS 10 H LYS 10 -6.530 -8.212 -18.369 843 HA LYS 10 HA LYS 10 -7.418 -5.777 -19.585 844 HB2 LYS 10 2HB LYS 10 -8.064 -8.199 -20.233 845 HB3 LYS 10 1HB LYS 10 -9.245 -8.108 -18.885 846 HG2 LYS 10 2HG LYS 10 -10.247 -6.067 -19.965 847 HG3 LYS 10 1HG LYS 10 -9.027 -6.106 -21.260 848 HD2 LYS 10 2HD LYS 10 -9.976 -7.889 -22.373 849 HD3 LYS 10 1HD LYS 10 -10.633 -8.654 -20.888 850 HE2 LYS 10 2HE LYS 10 -11.786 -6.054 -22.134 851 HE3 LYS 10 1HE LYS 10 -12.428 -7.720 -22.446 852 HZ1 LYS 10 3HZ LYS 10 -12.772 -7.964 -20.062 853 HZ2 LYS 10 1HZ LYS 10 -13.660 -6.634 -20.697 854 HZ3 LYS 10 2HZ LYS 10 -12.259 -6.406 -19.751 855 H ALA 11 H ALA 11 -7.340 -6.960 -16.316 856 HA ALA 11 HA ALA 11 -9.512 -5.417 -15.336 857 HB1 ALA 11 1HB ALA 11 -8.549 -5.779 -13.091 858 HB2 ALA 11 2HB ALA 11 -6.998 -6.337 -13.809 859 HB3 ALA 11 3HB ALA 11 -8.492 -7.321 -14.015 860 H GLU 12 H GLU 12 -6.001 -4.847 -15.874 861 HA GLU 12 HA GLU 12 -5.834 -2.388 -14.603 862 HB2 GLU 12 2HB GLU 12 -4.276 -3.274 -17.107 863 HB3 GLU 12 1HB GLU 12 -3.822 -1.946 -15.982 864 HG2 GLU 12 2HG GLU 12 -3.562 -3.658 -14.119 865 HG3 GLU 12 1HG GLU 12 -3.934 -4.961 -15.306 866 H GLU 13 H GLU 13 -7.121 -3.228 -17.787 867 HA GLU 13 HA GLU 13 -7.150 -0.620 -18.857 868 HB2 GLU 13 2HB GLU 13 -7.491 -2.840 -20.186 869 HB3 GLU 13 1HB GLU 13 -9.176 -2.815 -19.576 870 HG2 GLU 13 2HG GLU 13 -9.379 -0.448 -20.644 871 HG3 GLU 13 1HG GLU 13 -7.758 -0.729 -21.372 872 H GLU 14 H GLU 14 -9.344 -2.436 -16.724 873 HA GLU 14 HA GLU 14 -11.571 -0.748 -17.106 874 HB2 GLU 14 2HB GLU 14 -11.727 -3.123 -16.256 875 HB3 GLU 14 1HB GLU 14 -10.894 -2.603 -14.752 876 HG2 GLU 14 2HG GLU 14 -13.184 -2.746 -14.182 877 HG3 GLU 14 1HG GLU 14 -12.871 -0.987 -14.340 878 H LEU 15 H LEU 15 -8.762 -0.722 -14.941 879 HA LEU 15 HA LEU 15 -9.749 1.240 -13.201 880 HB2 LEU 15 2HB LEU 15 -7.712 -0.080 -12.649 881 HB3 LEU 15 1HB LEU 15 -6.812 0.729 -13.969 882 HG LEU 15 HG LEU 15 -6.940 2.887 -12.787 883 HD11 LEU 15 1HD1 LEU 15 -9.161 2.877 -11.761 884 HD12 LEU 15 2HD1 LEU 15 -7.959 3.024 -10.443 885 HD13 LEU 15 3HD1 LEU 15 -8.756 1.439 -10.757 886 HD21 LEU 15 3HD2 LEU 15 -6.127 0.617 -10.858 887 HD22 LEU 15 1HD2 LEU 15 -5.606 2.336 -10.751 888 HD23 LEU 15 2HD2 LEU 15 -5.107 1.332 -12.158 889 H GLN 16 H GLN 16 -8.068 1.466 -16.354 890 HA GLN 16 HA GLN 16 -7.479 4.170 -16.377 891 HB2 GLN 16 2HB GLN 16 -8.566 2.601 -18.794 892 HB3 GLN 16 1HB GLN 16 -7.645 4.141 -18.845 893 HG2 GLN 16 2HG GLN 16 -5.600 2.989 -18.033 894 HG3 GLN 16 1HG GLN 16 -6.523 1.445 -17.834 895 HE21 GLN 16 1HE2 GLN 16 -4.979 0.511 -19.442 896 HE22 GLN 16 2HE2 GLN 16 -5.262 0.765 -21.134 897 H LYS 17 H LYS 17 -10.530 2.480 -17.110 898 HA LYS 17 HA LYS 17 -11.851 4.681 -18.214 899 HB2 LYS 17 2HB LYS 17 -12.491 2.207 -18.360 900 HB3 LYS 17 1HB LYS 17 -13.106 2.324 -16.685 901 HG2 LYS 17 2HG LYS 17 -14.800 4.059 -17.469 902 HG3 LYS 17 1HG LYS 17 -14.068 3.985 -19.112 903 HD2 LYS 17 2HD LYS 17 -15.996 2.579 -19.267 904 HD3 LYS 17 1HD LYS 17 -14.579 1.482 -19.136 905 HE2 LYS 17 2HE LYS 17 -15.190 1.531 -16.488 906 HE3 LYS 17 1HE LYS 17 -16.800 2.090 -17.089 907 HZ1 LYS 17 3HZ LYS 17 -15.365 -0.445 -17.434 908 HZ2 LYS 17 1HZ LYS 17 -16.475 0.003 -18.665 909 HZ3 LYS 17 2HZ LYS 17 -17.012 -0.166 -17.050 910 H VAL 18 H VAL 18 -11.573 3.508 -14.838 911 HA VAL 18 HA VAL 18 -13.463 5.465 -13.889 912 HB VAL 18 HB VAL 18 -11.587 3.704 -12.232 913 HG11 VAL 18 1HG1 VAL 18 -14.265 5.168 -11.645 914 HG12 VAL 18 2HG1 VAL 18 -12.651 5.592 -10.967 915 HG13 VAL 18 3HG1 VAL 18 -13.437 4.041 -10.514 916 HG21 VAL 18 3HG2 VAL 18 -13.582 2.140 -12.107 917 HG22 VAL 18 1HG2 VAL 18 -12.893 2.229 -13.757 918 HG23 VAL 18 2HG2 VAL 18 -14.411 3.123 -13.368 919 H LEU 19 H LEU 19 -9.934 4.940 -13.816 920 HA LEU 19 HA LEU 19 -9.041 7.053 -12.291 921 HB2 LEU 19 2HB LEU 19 -7.496 5.310 -12.976 922 HB3 LEU 19 1HB LEU 19 -8.013 5.454 -14.681 923 HG LEU 19 HG LEU 19 -6.789 7.547 -14.990 924 HD11 LEU 19 1HD1 LEU 19 -6.845 8.381 -12.572 925 HD12 LEU 19 2HD1 LEU 19 -5.237 8.447 -13.369 926 HD13 LEU 19 3HD1 LEU 19 -5.585 7.163 -12.177 927 HD21 LEU 19 3HD2 LEU 19 -4.501 6.588 -14.935 928 HD22 LEU 19 1HD2 LEU 19 -5.705 5.385 -15.527 929 HD23 LEU 19 2HD2 LEU 19 -5.060 5.268 -13.844 930 H GLU 20 H GLU 20 -9.551 6.889 -15.888 931 HA GLU 20 HA GLU 20 -8.844 9.619 -16.146 932 HB2 GLU 20 2HB GLU 20 -10.141 7.720 -18.165 933 HB3 GLU 20 1HB GLU 20 -9.710 9.431 -18.491 934 HG2 GLU 20 2HG GLU 20 -7.301 8.891 -17.772 935 HG3 GLU 20 1HG GLU 20 -7.758 7.148 -17.769 936 H GLU 21 H GLU 21 -12.031 7.900 -15.733 937 HA GLU 21 HA GLU 21 -13.402 10.276 -16.411 938 HB2 GLU 21 2HB GLU 21 -14.472 7.879 -16.220 939 HB3 GLU 21 1HB GLU 21 -14.758 8.352 -14.514 940 HG2 GLU 21 2HG GLU 21 -15.842 10.529 -15.456 941 HG3 GLU 21 1HG GLU 21 -15.645 9.829 -17.099 942 H ALA 22 H ALA 22 -11.893 9.104 -13.436 943 HA ALA 22 HA ALA 22 -12.990 10.931 -11.679 944 HB1 ALA 22 1HB ALA 22 -11.029 10.577 -10.231 945 HB2 ALA 22 2HB ALA 22 -10.119 9.833 -11.591 946 HB3 ALA 22 3HB ALA 22 -11.574 9.007 -10.929 947 H SER 23 H SER 23 -10.679 11.538 -14.278 948 HA SER 23 HA SER 23 -9.647 13.942 -13.097 949 HB2 SER 23 2HB SER 23 -8.718 14.530 -15.253 950 HB3 SER 23 1HB SER 23 -8.336 12.816 -14.873 951 HG SER 23 1HG SER 23 -10.049 12.219 -16.319 952 H LYS 24 H LYS 24 -12.322 13.163 -15.311 953 HA LYS 24 HA LYS 24 -13.114 15.848 -15.707 954 HB2 LYS 24 2HB LYS 24 -13.825 14.135 -17.295 955 HB3 LYS 24 1HB LYS 24 -14.674 13.207 -16.024 956 HG2 LYS 24 2HG LYS 24 -15.526 16.099 -16.532 957 HG3 LYS 24 1HG LYS 24 -15.919 14.877 -17.784 958 HD2 LYS 24 2HD LYS 24 -17.627 13.984 -16.608 959 HD3 LYS 24 1HD LYS 24 -16.630 13.830 -15.131 960 HE2 LYS 24 2HE LYS 24 -18.597 15.218 -14.634 961 HE3 LYS 24 1HE LYS 24 -17.099 16.202 -14.494 962 HZ1 LYS 24 3HZ LYS 24 -18.045 17.635 -15.819 963 HZ2 LYS 24 1HZ LYS 24 -19.371 16.626 -16.093 964 HZ3 LYS 24 2HZ LYS 24 -18.054 16.530 -17.128 965 H LYS 25 H LYS 25 -13.901 13.317 -13.311 966 HA LYS 25 HA LYS 25 -15.964 14.855 -12.097 967 HB2 LYS 25 2HB LYS 25 -14.299 12.618 -10.820 968 HB3 LYS 25 1HB LYS 25 -15.825 13.298 -10.167 969 HG2 LYS 25 2HG LYS 25 -15.555 11.755 -12.819 970 HG3 LYS 25 1HG LYS 25 -16.112 11.067 -11.265 971 HD2 LYS 25 2HD LYS 25 -18.148 12.458 -11.308 972 HD3 LYS 25 1HD LYS 25 -17.511 13.431 -12.661 973 HE2 LYS 25 2HE LYS 25 -19.140 11.961 -13.643 974 HE3 LYS 25 1HE LYS 25 -17.517 11.387 -14.161 975 HZ1 LYS 25 3HZ LYS 25 -18.149 9.450 -13.510 976 HZ2 LYS 25 1HZ LYS 25 -19.563 10.035 -12.758 977 HZ3 LYS 25 2HZ LYS 25 -18.095 9.938 -11.874 978 H ALA 26 H ALA 26 -12.432 14.610 -11.485 979 HA ALA 26 HA ALA 26 -12.380 15.932 -9.057 980 HB1 ALA 26 1HB ALA 26 -10.250 15.960 -11.298 981 HB2 ALA 26 2HB ALA 26 -10.373 14.743 -9.979 982 HB3 ALA 26 3HB ALA 26 -9.978 16.453 -9.588 983 H VAL 27 H VAL 27 -11.841 17.305 -12.362 984 HA VAL 27 HA VAL 27 -11.534 19.916 -11.496 985 HB VAL 27 HB VAL 27 -10.774 19.199 -13.662 986 HG11 VAL 27 1HG1 VAL 27 -12.602 17.512 -14.157 987 HG12 VAL 27 2HG1 VAL 27 -12.250 18.590 -15.536 988 HG13 VAL 27 3HG1 VAL 27 -13.726 18.855 -14.540 989 HG21 VAL 27 3HG2 VAL 27 -11.456 21.629 -13.405 990 HG22 VAL 27 1HG2 VAL 27 -13.023 21.245 -14.209 991 HG23 VAL 27 2HG2 VAL 27 -11.465 21.029 -15.089 992 H GLU 28 H GLU 28 -14.464 18.080 -12.134 993 HA GLU 28 HA GLU 28 -16.164 20.399 -12.164 994 HB2 GLU 28 2HB GLU 28 -16.430 18.037 -13.395 995 HB3 GLU 28 1HB GLU 28 -17.172 17.539 -11.846 996 HG2 GLU 28 2HG GLU 28 -19.039 18.217 -13.152 997 HG3 GLU 28 1HG GLU 28 -18.712 19.697 -12.190 998 H ALA 29 H ALA 29 -14.678 18.379 -9.754 999 HA ALA 29 HA ALA 29 -16.817 18.259 -7.904 1000 HB1 ALA 29 1HB ALA 29 -15.133 17.514 -6.269 1001 HB2 ALA 29 2HB ALA 29 -13.787 17.998 -7.359 1002 HB3 ALA 29 3HB ALA 29 -14.874 16.632 -7.814 1003 H GLU 30 H GLU 30 -13.988 20.413 -8.398 1004 HA GLU 30 HA GLU 30 -14.436 22.015 -6.155 1005 HB2 GLU 30 2HB GLU 30 -13.198 22.607 -8.900 1006 HB3 GLU 30 1HB GLU 30 -13.398 23.906 -7.680 1007 HG2 GLU 30 2HG GLU 30 -11.170 23.151 -7.401 1008 HG3 GLU 30 1HG GLU 30 -12.098 22.492 -6.007 1009 H ARG 31 H ARG 31 -16.265 21.805 -9.142 1010 HA ARG 31 HA ARG 31 -17.287 24.525 -8.898 1011 HB2 ARG 31 2HB ARG 31 -17.912 22.254 -10.866 1012 HB3 ARG 31 1HB ARG 31 -18.961 23.688 -10.695 1013 HG2 ARG 31 2HG ARG 31 -17.635 24.196 -12.533 1014 HG3 ARG 31 1HG ARG 31 -17.033 25.202 -11.171 1015 HD2 ARG 31 2HD ARG 31 -15.112 23.480 -10.894 1016 HD3 ARG 31 1HD ARG 31 -15.714 22.678 -12.414 1017 HE ARG 31 HE ARG 31 -15.522 25.338 -13.163 1018 HH11 ARG 31 1HH2 ARG 31 -13.300 22.736 -12.050 1019 HH12 ARG 31 2HH2 ARG 31 -11.896 23.491 -12.645 1020 HH21 ARG 31 1HH1 ARG 31 -13.498 26.517 -13.741 1021 HH22 ARG 31 2HH1 ARG 31 -11.989 25.710 -13.695 1022 H GLY 32 H GLY 32 -18.050 24.288 -6.699 1023 HA2 GLY 32 2HA GLY 32 -20.569 24.352 -6.226 1024 HA3 GLY 32 1HA GLY 32 -20.389 22.554 -6.382 1025 H ALA 33 H ALA 33 -17.500 22.887 -5.332 1026 HA ALA 33 HA ALA 33 -18.414 22.561 -2.588 1027 HB1 ALA 33 1HB ALA 33 -17.171 20.679 -3.624 1028 HB2 ALA 33 2HB ALA 33 -16.284 21.376 -2.218 1029 HB3 ALA 33 3HB ALA 33 -15.771 21.768 -3.908 1030 HA PRO 34 HA PRO 34 -16.349 26.465 -1.869 1031 HB2 PRO 34 2HB PRO 34 -16.470 26.675 0.897 1032 HB3 PRO 34 1HB PRO 34 -17.907 26.814 -0.184 1033 HG2 PRO 34 2HG PRO 34 -16.955 24.340 1.346 1034 HG3 PRO 34 1HG PRO 34 -18.632 25.029 1.256 1035 HD2 PRO 34 2HD PRO 34 -17.778 22.927 -0.355 1036 HD3 PRO 34 1HD PRO 34 -18.941 24.188 -0.970 1037 H GLY 35 H GLY 35 -14.173 26.355 -2.492 1038 HA2 GLY 35 2HA GLY 35 -12.126 26.943 -1.221 1039 HA3 GLY 35 1HA GLY 35 -12.275 25.299 -0.477 1040 H ALA 36 H ALA 36 -12.865 26.508 -3.818 1041 HA ALA 36 HA ALA 36 -11.863 24.220 -4.963 1042 HB1 ALA 36 1HB ALA 36 -11.947 25.556 -7.130 1043 HB2 ALA 36 2HB ALA 36 -12.187 27.051 -6.155 1044 HB3 ALA 36 3HB ALA 36 -13.445 25.759 -6.156 1045 H ALA 37 H ALA 37 -9.869 23.635 -5.880 1046 HA ALA 37 HA ALA 37 -7.714 25.598 -5.776 1047 HB1 ALA 37 1HB ALA 37 -7.684 24.603 -3.485 1048 HB2 ALA 37 2HB ALA 37 -6.263 24.024 -4.427 1049 HB3 ALA 37 3HB ALA 37 -7.696 22.953 -4.188 1050 H LEU 38 H LEU 38 -8.684 22.143 -6.436 1051 HA LEU 38 HA LEU 38 -6.460 21.642 -8.031 1052 HB2 LEU 38 2HB LEU 38 -7.825 19.959 -6.810 1053 HB3 LEU 38 1HB LEU 38 -9.171 20.203 -7.942 1054 HG LEU 38 HG LEU 38 -6.404 19.210 -8.835 1055 HD11 LEU 38 1HD1 LEU 38 -7.240 17.674 -7.104 1056 HD12 LEU 38 2HD1 LEU 38 -7.450 16.915 -8.721 1057 HD13 LEU 38 3HD1 LEU 38 -8.870 17.628 -7.875 1058 HD21 LEU 38 3HD2 LEU 38 -9.198 19.081 -10.151 1059 HD22 LEU 38 1HD2 LEU 38 -7.760 18.156 -10.722 1060 HD23 LEU 38 2HD2 LEU 38 -7.751 19.948 -10.778 1061 H ILE 39 H ILE 39 -9.918 21.853 -9.157 1062 HA ILE 39 HA ILE 39 -10.812 22.644 -10.828 1063 HB ILE 39 HB ILE 39 -10.349 24.927 -11.746 1064 HG12 ILE 39 2HG1 ILE 39 -8.268 25.101 -9.473 1065 HG13 ILE 39 1HG1 ILE 39 -7.816 24.975 -11.197 1066 HG21 ILE 39 1HG2 ILE 39 -11.901 24.312 -9.851 1067 HG22 ILE 39 2HG2 ILE 39 -11.237 25.977 -9.728 1068 HG23 ILE 39 3HG2 ILE 39 -10.559 24.667 -8.696 1069 HD11 ILE 39 3HD ILE 39 -9.443 27.272 -9.920 1070 HD12 ILE 39 1HD ILE 39 -7.748 27.331 -10.515 1071 HD13 ILE 39 2HD ILE 39 -9.098 27.106 -11.684 1072 H SER 40 H SER 40 -8.605 24.307 -12.699 1073 HA SER 40 HA SER 40 -9.234 23.756 -14.915 1074 HB2 SER 40 2HB SER 40 -6.284 23.747 -14.194 1075 HB3 SER 40 1HB SER 40 -6.982 24.297 -15.762 1076 HG SER 40 1HG SER 40 -6.570 25.929 -14.079 1077 H TYR 41 H TYR 41 -9.286 22.647 -16.709 1078 HA TYR 41 HA TYR 41 -9.521 19.949 -16.385 1079 HB2 TYR 41 2HB TYR 41 -9.462 21.344 -19.126 1080 HB3 TYR 41 1HB TYR 41 -10.227 19.778 -18.703 1081 HD1 TYR 41 2HD TYR 41 -10.436 23.469 -18.422 1082 HD2 TYR 41 1HD TYR 41 -12.369 19.735 -17.507 1083 HE1 TYR 41 2HE TYR 41 -12.510 24.674 -17.915 1084 HE2 TYR 41 1HE TYR 41 -14.458 20.937 -16.996 1085 HH TYR 41 HH TYR 41 -15.492 23.050 -16.757 1086 HA PRO 42 HA PRO 42 -6.006 18.795 -19.150 1087 HB2 PRO 42 2HB PRO 42 -3.959 20.490 -19.973 1088 HB3 PRO 42 1HB PRO 42 -5.565 20.493 -20.786 1089 HG2 PRO 42 2HG PRO 42 -4.597 22.373 -18.560 1090 HG3 PRO 42 1HG PRO 42 -5.353 22.829 -20.142 1091 HD2 PRO 42 2HD PRO 42 -6.777 22.592 -17.765 1092 HD3 PRO 42 1HD PRO 42 -7.524 22.151 -19.373 1093 H ASP 43 H ASP 43 -5.649 20.659 -16.337 1094 HA ASP 43 HA ASP 43 -3.089 19.643 -15.502 1095 HB2 ASP 43 2HB ASP 43 -5.345 21.027 -13.863 1096 HB3 ASP 43 1HB ASP 43 -3.678 20.693 -13.306 1097 H ALA 44 H ALA 44 -6.591 19.219 -14.944 1098 HA ALA 44 HA ALA 44 -6.505 17.656 -12.729 1099 HB1 ALA 44 1HB ALA 44 -8.632 17.595 -14.958 1100 HB2 ALA 44 2HB ALA 44 -8.583 18.742 -13.565 1101 HB3 ALA 44 3HB ALA 44 -8.853 16.988 -13.272 1102 H ILE 45 H ILE 45 -6.208 16.626 -16.112 1103 HA ILE 45 HA ILE 45 -6.523 13.875 -15.580 1104 HB ILE 45 HB ILE 45 -6.888 14.712 -17.773 1105 HG12 ILE 45 2HG1 ILE 45 -4.442 12.837 -17.796 1106 HG13 ILE 45 1HG1 ILE 45 -6.126 12.347 -17.423 1107 HG21 ILE 45 1HG2 ILE 45 -5.047 15.577 -19.219 1108 HG22 ILE 45 2HG2 ILE 45 -3.892 15.480 -17.847 1109 HG23 ILE 45 3HG2 ILE 45 -5.287 16.617 -17.786 1110 HD11 ILE 45 3HD ILE 45 -5.140 13.525 -20.111 1111 HD12 ILE 45 1HD ILE 45 -5.624 11.826 -19.780 1112 HD13 ILE 45 2HD ILE 45 -6.855 13.134 -19.717 1113 H TRP 46 H TRP 46 -3.788 16.055 -15.175 1114 HA TRP 46 HA TRP 46 -1.877 13.913 -15.008 1115 HB2 TRP 46 2HB TRP 46 -1.793 16.730 -15.428 1116 HB3 TRP 46 1HB TRP 46 -1.065 16.532 -13.815 1117 HD1 TRP 46 HD TRP 46 1.544 16.450 -14.109 1118 HE1 TRP 46 1HE TRP 46 3.184 15.809 -15.941 1119 HE3 TRP 46 3HE TRP 46 -1.830 14.549 -17.441 1120 HZ2 TRP 46 2HZ TRP 46 3.045 14.573 -18.547 1121 HZ3 TRP 46 3HZ TRP 46 -1.018 13.628 -19.583 1122 HH2 TRP 46 HH TRP 46 1.395 13.629 -20.129 1123 H TRP 47 H TRP 47 -3.995 15.744 -12.840 1124 HA TRP 47 HA TRP 47 -2.682 14.931 -10.439 1125 HB2 TRP 47 2HB TRP 47 -4.244 16.879 -10.432 1126 HB3 TRP 47 1HB TRP 47 -5.613 15.786 -10.840 1127 HD1 TRP 47 HD TRP 47 -3.046 16.332 -7.868 1128 HE1 TRP 47 1HE TRP 47 -4.155 15.496 -5.722 1129 HE3 TRP 47 3HE TRP 47 -7.225 14.276 -9.941 1130 HZ2 TRP 47 2HZ TRP 47 -6.605 14.198 -4.977 1131 HZ3 TRP 47 3HZ TRP 47 -8.867 13.151 -8.482 1132 HH2 TRP 47 HH TRP 47 -8.562 13.114 -6.026 1133 H SER 48 H SER 48 -5.595 13.666 -12.284 1134 HA SER 48 HA SER 48 -6.056 11.671 -10.453 1135 HB2 SER 48 2HB SER 48 -6.602 11.518 -13.465 1136 HB3 SER 48 1HB SER 48 -7.331 10.464 -12.189 1137 HG SER 48 1HG SER 48 -8.732 12.070 -12.459 1138 H VAL 49 H VAL 49 -3.678 11.675 -13.080 1139 HA VAL 49 HA VAL 49 -3.075 8.933 -13.025 1140 HB VAL 49 HB VAL 49 -1.656 11.472 -13.927 1141 HG11 VAL 49 1HG1 VAL 49 -0.010 10.004 -15.178 1142 HG12 VAL 49 2HG1 VAL 49 -0.611 8.581 -14.256 1143 HG13 VAL 49 3HG1 VAL 49 0.212 9.931 -13.402 1144 HG21 VAL 49 3HG2 VAL 49 -2.886 9.065 -15.451 1145 HG22 VAL 49 1HG2 VAL 49 -2.263 10.592 -16.181 1146 HG23 VAL 49 2HG2 VAL 49 -3.739 10.616 -15.159 1147 H GLU 50 H GLU 50 -2.238 11.470 -10.664 1148 HA GLU 50 HA GLU 50 0.111 10.015 -9.808 1149 HB2 GLU 50 2HB GLU 50 0.573 11.697 -8.276 1150 HB3 GLU 50 1HB GLU 50 -0.258 12.613 -9.573 1151 HG2 GLU 50 2HG GLU 50 -2.408 12.463 -8.099 1152 HG3 GLU 50 1HG GLU 50 -1.380 11.759 -6.815 1153 H THR 51 H THR 51 -3.282 9.722 -9.404 1154 HA THR 51 HA THR 51 -2.873 8.150 -6.975 1155 HB THR 51 HB THR 51 -4.025 10.182 -6.291 1156 HG1 THR 51 1HG THR 51 -5.732 9.225 -5.347 1157 HG21 THR 51 3HG2 THR 51 -6.092 9.467 -8.488 1158 HG22 THR 51 1HG2 THR 51 -5.005 10.900 -8.440 1159 HG23 THR 51 2HG2 THR 51 -6.307 10.735 -7.219 1160 H ALA 52 H ALA 52 -5.446 7.047 -7.188 1161 HA ALA 52 HA ALA 52 -6.425 5.247 -8.025 1162 HB1 ALA 52 1HB ALA 52 -6.646 6.282 -10.306 1163 HB2 ALA 52 2HB ALA 52 -6.385 4.498 -10.358 1164 HB3 ALA 52 3HB ALA 52 -5.025 5.615 -10.723 1165 H THR 53 H THR 53 -2.970 5.681 -8.210 1166 HA THR 53 HA THR 53 -2.320 2.927 -8.400 1167 HB THR 53 HB THR 53 0.012 4.158 -8.100 1168 HG1 THR 53 1HG THR 53 -0.234 6.415 -8.525 1169 HG21 THR 53 3HG2 THR 53 -1.915 4.920 -10.428 1170 HG22 THR 53 1HG2 THR 53 -0.986 3.379 -10.305 1171 HG23 THR 53 2HG2 THR 53 -0.116 4.946 -10.486 1172 H THR 54 H THR 54 -3.510 4.741 -5.907 1173 HA THR 54 HA THR 54 -3.425 4.761 -3.738 1174 HB THR 54 HB THR 54 -2.252 2.437 -2.704 1175 HG1 THR 54 1HG THR 54 -2.126 1.776 -4.911 1176 HG21 THR 54 3HG2 THR 54 -5.166 2.969 -3.607 1177 HG22 THR 54 1HG2 THR 54 -4.417 3.551 -2.065 1178 HG23 THR 54 2HG2 THR 54 -4.596 1.797 -2.354 1179 H VAL 55 H VAL 55 -1.840 6.563 -4.328 1180 HA VAL 55 HA VAL 55 0.325 6.200 -2.458 1181 HB VAL 55 HB VAL 55 1.414 5.649 -4.516 1182 HG11 VAL 55 1HG1 VAL 55 0.768 8.435 -5.657 1183 HG12 VAL 55 2HG1 VAL 55 -0.165 6.947 -6.074 1184 HG13 VAL 55 3HG1 VAL 55 1.585 7.047 -6.438 1185 HG21 VAL 55 3HG2 VAL 55 2.195 8.438 -3.434 1186 HG22 VAL 55 1HG2 VAL 55 3.264 7.323 -4.369 1187 HG23 VAL 55 2HG2 VAL 55 2.639 6.842 -2.749 1188 H GLY 56 H GLY 56 -0.902 8.763 -4.755 1189 HA2 GLY 56 2HA GLY 56 -2.116 10.607 -4.237 1190 HA3 GLY 56 1HA GLY 56 -2.283 10.012 -2.537 1191 H TYR 57 H TYR 57 0.068 11.482 -4.863 1192 HA TYR 57 HA TYR 57 2.040 11.781 -2.880 1193 HB2 TYR 57 2HB TYR 57 1.821 12.186 -5.771 1194 HB3 TYR 57 1HB TYR 57 2.417 13.726 -5.088 1195 HD1 TYR 57 1HD TYR 57 3.060 10.008 -5.100 1196 HD2 TYR 57 2HD TYR 57 4.682 13.921 -4.390 1197 HE1 TYR 57 1HE TYR 57 5.325 9.041 -4.964 1198 HE2 TYR 57 2HE TYR 57 6.937 12.974 -4.261 1199 HH TYR 57 HH TYR 57 8.241 11.108 -4.448 1200 H GLY 58 H GLY 58 -0.396 14.032 -4.284 1201 HA2 GLY 58 2HA GLY 58 -1.564 15.440 -2.846 1202 HA3 GLY 58 1HA GLY 58 -0.132 15.560 -1.756 1203 H ASP 59 H ASP 59 -0.456 15.771 -5.349 1204 HA ASP 59 HA ASP 59 1.154 18.119 -5.422 1205 HB2 ASP 59 2HB ASP 59 0.935 16.519 -7.365 1206 HB3 ASP 59 1HB ASP 59 -0.768 17.033 -7.575 1207 H ARG 60 H ARG 60 -2.385 17.526 -5.836 1208 HA ARG 60 HA ARG 60 -2.804 20.434 -5.481 1209 HB2 ARG 60 2HB ARG 60 -4.651 18.418 -6.874 1210 HB3 ARG 60 1HB ARG 60 -4.960 20.170 -6.698 1211 HG2 ARG 60 2HG ARG 60 -2.670 18.919 -8.369 1212 HG3 ARG 60 1HG ARG 60 -4.268 19.444 -8.985 1213 HD2 ARG 60 2HD ARG 60 -3.610 21.818 -7.954 1214 HD3 ARG 60 1HD ARG 60 -1.925 21.193 -7.992 1215 HE ARG 60 HE ARG 60 -3.712 21.923 -10.256 1216 HH11 ARG 60 1HH2 ARG 60 -0.554 20.262 -9.400 1217 HH12 ARG 60 2HH2 ARG 60 0.166 20.709 -10.859 1218 HH21 ARG 60 1HH1 ARG 60 -2.536 22.413 -12.419 1219 HH22 ARG 60 2HH1 ARG 60 -0.902 22.005 -12.451 1220 H TYR 61 H TYR 61 -5.026 20.883 -4.401 1221 HA TYR 61 HA TYR 61 -5.354 18.992 -2.185 1222 HB2 TYR 61 2HB TYR 61 -6.016 22.009 -2.345 1223 HB3 TYR 61 1HB TYR 61 -6.524 20.925 -1.002 1224 HD1 TYR 61 2HD TYR 61 -4.896 19.995 0.571 1225 HD2 TYR 61 1HD TYR 61 -3.673 22.670 -2.571 1226 HE1 TYR 61 2HE TYR 61 -2.778 20.415 1.756 1227 HE2 TYR 61 1HE TYR 61 -1.560 23.088 -1.397 1228 HH TYR 61 HH TYR 61 -0.247 22.562 0.340 1229 HA PRO 62 HA PRO 62 -9.470 19.048 -4.200 1230 HB2 PRO 62 2HB PRO 62 -10.654 16.999 -2.728 1231 HB3 PRO 62 1HB PRO 62 -9.441 16.649 -4.026 1232 HG2 PRO 62 2HG PRO 62 -9.003 16.826 -0.990 1233 HG3 PRO 62 1HG PRO 62 -8.425 15.536 -2.123 1234 HD2 PRO 62 2HD PRO 62 -6.860 17.702 -1.305 1235 HD3 PRO 62 1HD PRO 62 -6.672 16.956 -2.958 1236 H VAL 63 H VAL 63 -11.762 19.366 -3.275 1237 HA VAL 63 HA VAL 63 -11.625 21.039 -0.918 1238 HB VAL 63 HB VAL 63 -14.164 20.568 -2.525 1239 HG11 VAL 63 1HG1 VAL 63 -12.773 22.969 -1.122 1240 HG12 VAL 63 2HG1 VAL 63 -14.305 22.198 -0.594 1241 HG13 VAL 63 3HG1 VAL 63 -14.253 23.125 -2.124 1242 HG21 VAL 63 3HG2 VAL 63 -11.698 22.151 -3.485 1243 HG22 VAL 63 1HG2 VAL 63 -13.366 22.379 -4.117 1244 HG23 VAL 63 2HG2 VAL 63 -12.547 20.807 -4.346 1245 H THR 64 H THR 64 -14.289 20.675 -0.018 1246 HA THR 64 HA THR 64 -13.963 18.095 1.323 1247 HB THR 64 HB THR 64 -15.615 20.538 2.127 1248 HG1 THR 64 1HG THR 64 -13.273 20.784 2.033 1249 HG21 THR 64 3HG2 THR 64 -15.610 19.423 4.382 1250 HG22 THR 64 1HG2 THR 64 -14.696 18.026 3.709 1251 HG23 THR 64 2HG2 THR 64 -16.385 18.345 3.170 1252 H GLU 65 H GLU 65 -16.756 20.183 0.227 1253 HA GLU 65 HA GLU 65 -18.579 18.309 0.651 1254 HB2 GLU 65 2HB GLU 65 -18.716 20.831 0.116 1255 HB3 GLU 65 1HB GLU 65 -18.980 20.348 -1.591 1256 HG2 GLU 65 2HG GLU 65 -21.070 19.272 -1.047 1257 HG3 GLU 65 1HG GLU 65 -20.613 19.083 0.686 1258 H GLU 66 H GLU 66 -16.507 18.388 -2.151 1259 HA GLU 66 HA GLU 66 -17.089 15.707 -2.604 1260 HB2 GLU 66 2HB GLU 66 -17.275 17.707 -4.990 1261 HB3 GLU 66 1HB GLU 66 -16.890 15.968 -5.173 1262 HG2 GLU 66 2HG GLU 66 -19.137 15.388 -4.130 1263 HG3 GLU 66 1HG GLU 66 -19.575 17.129 -4.274 1264 H GLY 67 H GLY 67 -15.052 15.724 -4.764 1265 HA2 GLY 67 2HA GLY 67 -12.938 16.433 -5.194 1266 HA3 GLY 67 1HA GLY 67 -12.948 17.474 -3.713 1267 H ARG 68 H ARG 68 -13.069 16.316 -1.599 1268 HA ARG 68 HA ARG 68 -11.170 14.262 -1.513 1269 HB2 ARG 68 2HB ARG 68 -11.948 16.065 0.294 1270 HB3 ARG 68 1HB ARG 68 -13.034 14.750 0.856 1271 HG2 ARG 68 2HG ARG 68 -11.038 13.304 1.245 1272 HG3 ARG 68 1HG ARG 68 -10.007 14.485 0.367 1273 HD2 ARG 68 2HD ARG 68 -10.410 16.204 2.218 1274 HD3 ARG 68 1HD ARG 68 -11.294 14.907 3.152 1275 HE ARG 68 HE ARG 68 -8.686 14.043 2.085 1276 HH11 ARG 68 1HH2 ARG 68 -9.513 16.332 4.652 1277 HH12 ARG 68 2HH2 ARG 68 -8.982 15.428 5.947 1278 HH21 ARG 68 1HH1 ARG 68 -7.188 13.260 3.688 1279 HH22 ARG 68 2HH1 ARG 68 -7.436 13.483 5.351 1280 H LYS 69 H LYS 69 -14.741 14.241 -1.327 1281 HA LYS 69 HA LYS 69 -14.885 11.423 -0.880 1282 HB2 LYS 69 2HB LYS 69 -16.727 12.992 -0.218 1283 HB3 LYS 69 1HB LYS 69 -17.077 13.295 -1.960 1284 HG2 LYS 69 2HG LYS 69 -17.656 10.906 -2.276 1285 HG3 LYS 69 1HG LYS 69 -17.168 10.520 -0.605 1286 HD2 LYS 69 2HD LYS 69 -19.092 11.624 0.309 1287 HD3 LYS 69 1HD LYS 69 -19.496 12.444 -1.254 1288 HE2 LYS 69 2HE LYS 69 -20.185 10.374 -2.315 1289 HE3 LYS 69 1HE LYS 69 -19.362 9.378 -1.054 1290 HZ1 LYS 69 3HZ LYS 69 -21.871 10.964 -0.579 1291 HZ2 LYS 69 1HZ LYS 69 -20.979 10.014 0.540 1292 HZ3 LYS 69 2HZ LYS 69 -21.694 9.294 -0.820 1293 H VAL 70 H VAL 70 -14.125 13.321 -3.681 1294 HA VAL 70 HA VAL 70 -15.093 11.305 -5.554 1295 HB VAL 70 HB VAL 70 -13.450 13.844 -5.982 1296 HG11 VAL 70 1HG1 VAL 70 -13.840 13.403 -8.427 1297 HG12 VAL 70 2HG1 VAL 70 -14.536 11.786 -8.025 1298 HG13 VAL 70 3HG1 VAL 70 -12.799 12.139 -7.690 1299 HG21 VAL 70 3HG2 VAL 70 -15.924 14.100 -5.327 1300 HG22 VAL 70 1HG2 VAL 70 -16.365 13.048 -6.703 1301 HG23 VAL 70 2HG2 VAL 70 -15.600 14.640 -7.018 1302 H ALA 71 H ALA 71 -12.061 12.607 -4.157 1303 HA ALA 71 HA ALA 71 -10.228 10.932 -5.276 1304 HB1 ALA 71 1HB ALA 71 -9.687 12.935 -3.838 1305 HB2 ALA 71 2HB ALA 71 -8.793 11.475 -3.307 1306 HB3 ALA 71 3HB ALA 71 -10.229 12.021 -2.387 1307 H GLU 72 H GLU 72 -12.334 10.335 -2.476 1308 HA GLU 72 HA GLU 72 -11.407 8.005 -1.437 1309 HB2 GLU 72 2HB GLU 72 -13.452 9.255 -0.604 1310 HB3 GLU 72 1HB GLU 72 -14.368 8.660 -2.016 1311 HG2 GLU 72 2HG GLU 72 -13.998 6.267 -1.215 1312 HG3 GLU 72 1HG GLU 72 -13.146 6.915 0.226 1313 H GLN 73 H GLN 73 -13.590 8.392 -4.234 1314 HA GLN 73 HA GLN 73 -13.993 5.642 -4.627 1315 HB2 GLN 73 2HB GLN 73 -15.582 7.370 -5.470 1316 HB3 GLN 73 1HB GLN 73 -14.340 7.973 -6.619 1317 HG2 GLN 73 2HG GLN 73 -14.387 5.861 -7.889 1318 HG3 GLN 73 1HG GLN 73 -15.420 5.077 -6.642 1319 HE21 GLN 73 1HE2 GLN 73 -17.660 5.453 -6.681 1320 HE22 GLN 73 2HE2 GLN 73 -18.458 6.337 -7.954 1321 H VAL 74 H VAL 74 -11.606 7.989 -5.908 1322 HA VAL 74 HA VAL 74 -10.705 6.305 -7.959 1323 HB VAL 74 HB VAL 74 -8.894 8.365 -6.623 1324 HG11 VAL 74 1HG1 VAL 74 -7.964 6.933 -8.476 1325 HG12 VAL 74 2HG1 VAL 74 -8.128 8.641 -9.005 1326 HG13 VAL 74 3HG1 VAL 74 -9.328 7.412 -9.549 1327 HG21 VAL 74 3HG2 VAL 74 -11.328 8.857 -8.467 1328 HG22 VAL 74 1HG2 VAL 74 -9.992 10.044 -8.205 1329 HG23 VAL 74 2HG2 VAL 74 -11.017 9.546 -6.831 1330 H MET 75 H MET 75 -9.655 6.727 -4.556 1331 HA MET 75 HA MET 75 -7.388 5.059 -4.724 1332 HB2 MET 75 2HB MET 75 -9.224 5.630 -2.315 1333 HB3 MET 75 1HB MET 75 -7.640 4.781 -2.221 1334 HG2 MET 75 2HG MET 75 -6.489 6.791 -3.131 1335 HG3 MET 75 1HG MET 75 -8.038 7.679 -3.180 1336 HE1 MET 75 3HE MET 75 -8.966 8.232 0.584 1337 HE2 MET 75 1HE MET 75 -9.612 6.998 -0.539 1338 HE3 MET 75 2HE MET 75 -9.295 8.675 -1.124 1339 H LYS 76 H LYS 76 -10.769 4.350 -3.596 1340 HA LYS 76 HA LYS 76 -10.116 1.619 -3.193 1341 HB2 LYS 76 2HB LYS 76 -11.949 2.718 -1.932 1342 HB3 LYS 76 1HB LYS 76 -12.910 2.851 -3.442 1343 HG2 LYS 76 2HG LYS 76 -13.123 0.414 -3.597 1344 HG3 LYS 76 1HG LYS 76 -11.948 0.149 -2.269 1345 HD2 LYS 76 2HD LYS 76 -13.523 0.916 -0.592 1346 HD3 LYS 76 1HD LYS 76 -14.523 1.748 -1.822 1347 HE2 LYS 76 2HE LYS 76 -15.739 -0.207 -1.021 1348 HE3 LYS 76 1HE LYS 76 -15.320 -0.401 -2.761 1349 HZ1 LYS 76 3HZ LYS 76 -15.066 -2.302 -0.991 1350 HZ2 LYS 76 1HZ LYS 76 -13.518 -1.643 -0.796 1351 HZ3 LYS 76 2HZ LYS 76 -14.007 -2.198 -2.314 1352 H ALA 77 H ALA 77 -11.277 3.411 -6.050 1353 HA ALA 77 HA ALA 77 -12.127 1.201 -7.543 1354 HB1 ALA 77 1HB ALA 77 -11.650 2.588 -9.581 1355 HB2 ALA 77 2HB ALA 77 -10.785 3.787 -8.548 1356 HB3 ALA 77 3HB ALA 77 -12.554 3.526 -8.342 1357 H GLY 78 H GLY 78 -8.923 2.754 -7.164 1358 HA2 GLY 78 2HA GLY 78 -7.538 1.143 -8.998 1359 HA3 GLY 78 1HA GLY 78 -6.882 2.082 -7.603 1360 H ILE 79 H ILE 79 -7.905 0.918 -5.445 1361 HA ILE 79 HA ILE 79 -6.369 -1.322 -5.027 1362 HB ILE 79 HB ILE 79 -8.892 -0.347 -3.595 1363 HG12 ILE 79 2HG1 ILE 79 -5.908 -0.187 -2.816 1364 HG13 ILE 79 1HG1 ILE 79 -6.789 1.135 -3.626 1365 HG21 ILE 79 1HG2 ILE 79 -8.136 -1.826 -1.648 1366 HG22 ILE 79 2HG2 ILE 79 -6.903 -2.554 -2.735 1367 HG23 ILE 79 3HG2 ILE 79 -8.656 -2.775 -3.064 1368 HD11 ILE 79 3HD ILE 79 -7.428 -0.002 -0.818 1369 HD12 ILE 79 1HD ILE 79 -6.678 1.582 -1.204 1370 HD13 ILE 79 2HD ILE 79 -8.391 1.269 -1.665 1371 H GLU 80 H GLU 80 -9.901 -1.169 -5.828 1372 HA GLU 80 HA GLU 80 -10.142 -3.949 -5.509 1373 HB2 GLU 80 2HB GLU 80 -11.865 -1.799 -5.694 1374 HB3 GLU 80 1HB GLU 80 -12.218 -2.622 -7.225 1375 HG2 GLU 80 2HG GLU 80 -13.497 -4.175 -6.135 1376 HG3 GLU 80 1HG GLU 80 -12.146 -4.609 -5.033 1377 H VAL 81 H VAL 81 -8.988 -2.061 -8.217 1378 HA VAL 81 HA VAL 81 -9.409 -4.190 -10.144 1379 HB VAL 81 HB VAL 81 -7.891 -1.535 -10.225 1380 HG11 VAL 81 1HG1 VAL 81 -8.075 -3.794 -12.325 1381 HG12 VAL 81 2HG1 VAL 81 -6.576 -3.081 -11.624 1382 HG13 VAL 81 3HG1 VAL 81 -7.599 -2.114 -12.726 1383 HG21 VAL 81 3HG2 VAL 81 -10.413 -2.630 -11.671 1384 HG22 VAL 81 1HG2 VAL 81 -9.701 -0.990 -11.891 1385 HG23 VAL 81 2HG2 VAL 81 -10.412 -1.452 -10.308 1386 H PHE 82 H PHE 82 -6.593 -2.673 -8.378 1387 HA PHE 82 HA PHE 82 -4.817 -4.585 -9.450 1388 HB2 PHE 82 2HB PHE 82 -4.514 -2.725 -7.008 1389 HB3 PHE 82 1HB PHE 82 -3.187 -3.771 -7.639 1390 HD1 PHE 82 2HD PHE 82 -3.056 -3.602 -10.429 1391 HD2 PHE 82 1HD PHE 82 -4.210 -0.510 -7.666 1392 HE1 PHE 82 2HE PHE 82 -2.377 -1.890 -12.065 1393 HE2 PHE 82 1HE PHE 82 -3.522 1.200 -9.300 1394 HZ PHE 82 HZ PHE 82 -2.597 0.526 -11.504 1395 H ALA 83 H ALA 83 -6.772 -4.592 -6.455 1396 HA ALA 83 HA ALA 83 -5.432 -6.814 -5.331 1397 HB1 ALA 83 1HB ALA 83 -6.892 -5.330 -3.940 1398 HB2 ALA 83 2HB ALA 83 -7.414 -7.047 -3.846 1399 HB3 ALA 83 3HB ALA 83 -8.333 -5.879 -4.876 1400 H LEU 84 H LEU 84 -7.765 -6.514 -7.933 1401 HA LEU 84 HA LEU 84 -8.828 -9.150 -7.745 1402 HB2 LEU 84 2HB LEU 84 -9.591 -6.965 -9.111 1403 HB3 LEU 84 1HB LEU 84 -8.559 -7.633 -10.397 1404 HG LEU 84 HG LEU 84 -11.016 -8.937 -9.057 1405 HD11 LEU 84 1HD1 LEU 84 -12.134 -8.550 -11.256 1406 HD12 LEU 84 2HD1 LEU 84 -10.640 -7.769 -11.894 1407 HD13 LEU 84 3HD1 LEU 84 -11.550 -7.007 -10.537 1408 HD21 LEU 84 3HD2 LEU 84 -9.311 -10.059 -11.378 1409 HD22 LEU 84 1HD2 LEU 84 -10.933 -10.676 -10.885 1410 HD23 LEU 84 2HD2 LEU 84 -9.563 -10.797 -9.749 1411 H VAL 85 H VAL 85 -6.013 -7.587 -9.205 1412 HA VAL 85 HA VAL 85 -5.220 -9.662 -10.902 1413 HB VAL 85 HB VAL 85 -3.582 -7.406 -9.646 1414 HG11 VAL 85 1HG1 VAL 85 -2.100 -7.742 -11.706 1415 HG12 VAL 85 2HG1 VAL 85 -2.928 -9.330 -11.957 1416 HG13 VAL 85 3HG1 VAL 85 -1.985 -9.024 -10.457 1417 HG21 VAL 85 3HG2 VAL 85 -5.547 -6.577 -10.964 1418 HG22 VAL 85 1HG2 VAL 85 -5.099 -7.642 -12.342 1419 HG23 VAL 85 2HG2 VAL 85 -4.029 -6.279 -11.863 1420 H THR 86 H THR 86 -5.099 -9.409 -7.410 1421 HA THR 86 HA THR 86 -2.877 -10.984 -6.968 1422 HB THR 86 HB THR 86 -5.315 -10.765 -5.173 1423 HG1 THR 86 1HG THR 86 -3.300 -8.919 -5.902 1424 HG21 THR 86 3HG2 THR 86 -3.572 -10.896 -3.363 1425 HG22 THR 86 1HG2 THR 86 -2.278 -11.107 -4.597 1426 HG23 THR 86 2HG2 THR 86 -3.542 -12.379 -4.379 1427 H ALA 87 H ALA 87 -5.918 -11.834 -8.360 1428 HA ALA 87 HA ALA 87 -6.063 -14.553 -7.838 1429 HB1 ALA 87 1HB ALA 87 -7.732 -13.264 -9.237 1430 HB2 ALA 87 2HB ALA 87 -7.145 -14.721 -10.109 1431 HB3 ALA 87 3HB ALA 87 -6.512 -13.083 -10.529 1432 H ALA 88 H ALA 88 -4.077 -12.754 -10.220 1433 HA ALA 88 HA ALA 88 -2.985 -15.081 -11.441 1434 HB1 ALA 88 1HB ALA 88 -1.362 -13.392 -12.510 1435 HB2 ALA 88 2HB ALA 88 -2.041 -12.129 -11.432 1436 HB3 ALA 88 3HB ALA 88 -3.091 -12.873 -12.684 1437 H LEU 89 H LEU 89 -1.940 -12.807 -8.890 1438 HA LEU 89 HA LEU 89 0.660 -13.889 -8.664 1439 HB2 LEU 89 2HB LEU 89 -1.029 -12.243 -6.683 1440 HB3 LEU 89 1HB LEU 89 0.618 -12.823 -6.317 1441 HG LEU 89 HG LEU 89 0.785 -10.555 -6.919 1442 HD11 LEU 89 1HD1 LEU 89 2.618 -12.086 -7.683 1443 HD12 LEU 89 2HD1 LEU 89 2.472 -10.594 -8.679 1444 HD13 LEU 89 3HD1 LEU 89 1.868 -12.160 -9.326 1445 HD21 LEU 89 3HD2 LEU 89 -0.540 -11.080 -9.654 1446 HD22 LEU 89 1HD2 LEU 89 0.193 -9.543 -9.074 1447 HD23 LEU 89 2HD2 LEU 89 -1.260 -10.190 -8.256 1448 H ALA 90 H ALA 90 -2.439 -14.568 -6.952 1449 HA ALA 90 HA ALA 90 -1.293 -16.482 -5.231 1450 HB1 ALA 90 1HB ALA 90 -4.194 -16.212 -6.229 1451 HB2 ALA 90 2HB ALA 90 -3.516 -15.435 -4.759 1452 HB3 ALA 90 3HB ALA 90 -3.657 -17.230 -4.837 1453 H THR 91 H THR 91 -2.203 -16.576 -8.611 1454 HA THR 91 HA THR 91 -2.379 -19.439 -8.762 1455 HB THR 91 HB THR 91 -1.552 -17.634 -11.117 1456 HG1 THR 91 1HG THR 91 -3.618 -17.019 -9.957 1457 HG21 THR 91 3HG2 THR 91 -3.100 -20.313 -10.868 1458 HG22 THR 91 1HG2 THR 91 -1.451 -20.095 -11.559 1459 HG23 THR 91 2HG2 THR 91 -2.866 -19.410 -12.414 1460 H ASP 92 H ASP 92 0.287 -17.026 -8.638 1461 HA ASP 92 HA ASP 92 1.710 -18.414 -10.594 1462 HB2 ASP 92 2HB ASP 92 2.037 -15.908 -10.017 1463 HB3 ASP 92 1HB ASP 92 3.214 -16.499 -8.785 1464 H PHE 93 H PHE 93 1.583 -18.940 -7.142 1465 HA PHE 93 HA PHE 93 3.988 -20.481 -7.132 1466 HB2 PHE 93 2HB PHE 93 3.543 -21.239 -5.016 1467 HB3 PHE 93 1HB PHE 93 2.914 -19.564 -4.989 1468 HD1 PHE 93 2HD PHE 93 0.359 -19.260 -5.051 1469 HD2 PHE 93 1HD PHE 93 2.170 -23.128 -4.591 1470 HE1 PHE 93 2HE PHE 93 -1.754 -20.143 -4.135 1471 HE2 PHE 93 1HE PHE 93 0.045 -24.016 -3.693 1472 HZ PHE 93 HZ PHE 93 -1.915 -22.519 -3.436 1473 H VAL 94 H VAL 94 0.699 -21.104 -8.184 1474 HA VAL 94 HA VAL 94 0.786 -23.937 -7.859 1475 HB VAL 94 HB VAL 94 -1.139 -22.188 -9.496 1476 HG11 VAL 94 1HG1 VAL 94 -2.733 -24.139 -9.061 1477 HG12 VAL 94 2HG1 VAL 94 -1.337 -25.083 -8.428 1478 HG13 VAL 94 3HG1 VAL 94 -1.364 -24.554 -10.147 1479 HG21 VAL 94 3HG2 VAL 94 -2.588 -22.372 -7.412 1480 HG22 VAL 94 1HG2 VAL 94 -1.111 -21.393 -7.146 1481 HG23 VAL 94 2HG2 VAL 94 -1.191 -23.089 -6.539 1482 H ARG 95 H ARG 95 1.582 -21.559 -10.271 1483 HA ARG 95 HA ARG 95 1.657 -23.107 -12.591 1484 HB2 ARG 95 2HB ARG 95 1.786 -20.558 -12.418 1485 HB3 ARG 95 1HB ARG 95 3.414 -20.752 -11.697 1486 HG2 ARG 95 2HG ARG 95 4.145 -21.889 -13.866 1487 HG3 ARG 95 1HG ARG 95 2.552 -21.503 -14.572 1488 HD2 ARG 95 2HD ARG 95 4.478 -19.878 -15.180 1489 HD3 ARG 95 1HD ARG 95 3.007 -19.100 -14.474 1490 HE ARG 95 HE ARG 95 4.223 -18.372 -12.673 1491 HH11 ARG 95 1HH2 ARG 95 6.137 -21.134 -14.120 1492 HH12 ARG 95 2HH2 ARG 95 7.345 -21.101 -12.919 1493 HH21 ARG 95 1HH1 ARG 95 5.918 -18.224 -11.168 1494 HH22 ARG 95 2HH1 ARG 95 7.298 -19.273 -11.241 1495 H ARG 96 H ARG 96 3.872 -22.872 -9.815 1496 HA ARG 96 HA ARG 96 6.181 -23.779 -11.020 1497 HB2 ARG 96 2HB ARG 96 7.166 -24.064 -8.967 1498 HB3 ARG 96 1HB ARG 96 5.881 -22.886 -8.562 1499 HG2 ARG 96 2HG ARG 96 4.491 -24.892 -7.714 1500 HG3 ARG 96 1HG ARG 96 5.915 -25.943 -8.033 1501 HD2 ARG 96 2HD ARG 96 7.294 -24.612 -6.394 1502 HD3 ARG 96 1HD ARG 96 5.841 -23.602 -6.037 1503 HE ARG 96 HE ARG 96 4.698 -25.505 -5.123 1504 HH11 ARG 96 1HH2 ARG 96 8.064 -26.422 -6.029 1505 HH12 ARG 96 2HH2 ARG 96 8.125 -27.795 -5.008 1506 HH21 ARG 96 1HH1 ARG 96 4.846 -27.363 -3.620 1507 HH22 ARG 96 2HH1 ARG 96 6.294 -28.198 -3.405 1508 H GLU 97 H GLU 97 3.287 -25.572 -10.156 1509 HA GLU 97 HA GLU 97 4.570 -28.084 -9.831 1510 HB2 GLU 97 2HB GLU 97 1.692 -27.249 -10.390 1511 HB3 GLU 97 1HB GLU 97 2.146 -28.975 -10.306 1512 HG2 GLU 97 2HG GLU 97 2.799 -27.044 -7.981 1513 HG3 GLU 97 1HG GLU 97 1.199 -27.847 -8.154 1514 H GLU 98 H GLU 98 3.566 -26.201 -12.631 1515 HA GLU 98 HA GLU 98 3.585 -28.476 -14.398 1516 HB2 GLU 98 2HB GLU 98 3.616 -25.461 -15.039 1517 HB3 GLU 98 1HB GLU 98 3.254 -26.806 -16.175 1518 HG2 GLU 98 2HG GLU 98 1.264 -27.430 -14.700 1519 HG3 GLU 98 1HG GLU 98 1.560 -25.947 -13.717 1520 H GLU 99 H GLU 99 5.909 -26.246 -13.019 1521 HA GLU 99 HA GLU 99 7.926 -26.640 -15.033 1522 HB2 GLU 99 2HB GLU 99 8.315 -25.855 -12.063 1523 HB3 GLU 99 1HB GLU 99 9.524 -25.712 -13.370 1524 HG2 GLU 99 2HG GLU 99 8.217 -23.854 -14.403 1525 HG3 GLU 99 1HG GLU 99 6.921 -24.057 -13.166 1526 H ARG 100 H ARG 100 7.025 -27.825 -11.835 1527 HA ARG 100 HA ARG 100 9.155 -29.464 -11.294 1528 HB2 ARG 100 2HB ARG 100 7.433 -28.574 -9.680 1529 HB3 ARG 100 1HB ARG 100 6.228 -29.738 -10.314 1530 HG2 ARG 100 2HG ARG 100 7.391 -31.618 -9.317 1531 HG3 ARG 100 1HG ARG 100 8.915 -30.686 -9.219 1532 HD2 ARG 100 2HD ARG 100 8.187 -30.920 -6.995 1533 HD3 ARG 100 1HD ARG 100 7.902 -29.189 -7.423 1534 HE ARG 100 HE ARG 100 5.363 -30.142 -7.850 1535 HH11 ARG 100 1HH2 ARG 100 7.596 -30.580 -5.023 1536 HH12 ARG 100 2HH2 ARG 100 6.443 -31.380 -4.053 1537 HH21 ARG 100 1HH1 ARG 100 3.689 -30.569 -6.264 1538 HH22 ARG 100 2HH1 ARG 100 4.097 -31.243 -4.756 1539 H ARG 101 H ARG 101 6.010 -30.299 -12.884 1540 HA ARG 101 HA ARG 101 7.242 -32.859 -13.720 1541 HB2 ARG 101 2HB ARG 101 4.329 -32.136 -13.056 1542 HB3 ARG 101 1HB ARG 101 4.757 -33.581 -14.020 1543 HG2 ARG 101 2HG ARG 101 5.847 -34.678 -12.232 1544 HG3 ARG 101 1HG ARG 101 5.984 -33.201 -11.232 1545 HD2 ARG 101 2HD ARG 101 3.272 -34.485 -12.032 1546 HD3 ARG 101 1HD ARG 101 4.137 -34.849 -10.477 1547 HE ARG 101 HE ARG 101 4.117 -32.083 -10.518 1548 HH11 ARG 101 1HH2 ARG 101 1.322 -34.257 -11.272 1549 HH12 ARG 101 2HH2 ARG 101 0.273 -33.439 -10.203 1550 HH21 ARG 101 1HH1 ARG 101 2.625 -30.985 -9.055 1551 HH22 ARG 101 2HH1 ARG 101 0.961 -31.450 -9.074 1552 H GLY 102 H GLY 102 7.577 -32.797 -15.919 1553 HA2 GLY 102 2HA GLY 102 6.697 -32.612 -18.028 1554 HA3 GLY 102 1HA GLY 102 5.658 -31.237 -17.515 1555 H HIS 103 H HIS 103 7.669 -29.783 -16.079 1556 HA HIS 103 HA HIS 103 9.124 -28.205 -16.398 1557 HB2 HIS 103 2HB HIS 103 10.429 -30.218 -18.213 1558 HB3 HIS 103 1HB HIS 103 10.857 -28.501 -18.498 1559 HD1 HIS 103 1HD HIS 103 13.022 -30.572 -17.220 1560 HD2 HIS 103 2HD HIS 103 10.726 -27.644 -15.203 1561 HE1 HIS 103 1HE HIS 103 14.231 -29.971 -15.137 1562 HE2 HIS 103 2HE HIS 103 12.851 -28.127 -13.978 1563 H1 SER 1 H SER 1 18.496 -22.829 -1.100 1564 HA SER 1 HA SER 1 17.365 -21.036 0.563 1565 HB2 SER 1 2HB SER 1 16.823 -19.243 -1.266 1566 HB3 SER 1 1HB SER 1 18.435 -19.142 -0.493 1567 HG SER 1 1HG SER 1 19.134 -19.178 -2.434 1568 H ALA 2 H ALA 2 15.090 -20.563 -0.836 1569 HA ALA 2 HA ALA 2 14.488 -23.159 -2.135 1570 HB1 ALA 2 1HB ALA 2 12.838 -22.414 -0.389 1571 HB2 ALA 2 2HB ALA 2 12.097 -22.458 -2.028 1572 HB3 ALA 2 3HB ALA 2 12.588 -20.879 -1.290 1573 H ASP 3 H ASP 3 13.436 -23.072 -4.269 1574 HA ASP 3 HA ASP 3 14.808 -21.308 -5.971 1575 HB2 ASP 3 2HB ASP 3 12.475 -23.242 -6.502 1576 HB3 ASP 3 1HB ASP 3 13.200 -22.227 -7.796 1577 H HIS 4 H HIS 4 11.528 -21.267 -4.664 1578 HA HIS 4 HA HIS 4 10.623 -19.084 -6.199 1579 HB2 HIS 4 2HB HIS 4 8.811 -18.709 -4.633 1580 HB3 HIS 4 1HB HIS 4 8.993 -20.460 -4.889 1581 HD1 HIS 4 1HD HIS 4 10.473 -18.022 -2.149 1582 HD2 HIS 4 2HD HIS 4 8.134 -21.508 -2.480 1583 HE1 HIS 4 1HE HIS 4 9.963 -18.786 0.151 1584 HE2 HIS 4 2HE HIS 4 8.433 -20.731 -0.051 1585 H GLU 5 H GLU 5 12.837 -19.199 -3.522 1586 HA GLU 5 HA GLU 5 12.198 -16.617 -2.420 1587 HB2 GLU 5 2HB GLU 5 13.036 -18.703 -1.161 1588 HB3 GLU 5 1HB GLU 5 14.617 -18.495 -1.989 1589 HG2 GLU 5 2HG GLU 5 14.976 -16.337 -0.795 1590 HG3 GLU 5 1HG GLU 5 13.343 -16.484 -0.040 1591 H ARG 6 H ARG 6 14.506 -18.211 -4.576 1592 HA ARG 6 HA ARG 6 16.319 -16.123 -4.900 1593 HB2 ARG 6 2HB ARG 6 15.507 -18.352 -6.867 1594 HB3 ARG 6 1HB ARG 6 16.980 -17.337 -7.024 1595 HG2 ARG 6 2HG ARG 6 17.945 -18.242 -4.992 1596 HG3 ARG 6 1HG ARG 6 16.415 -19.049 -4.532 1597 HD2 ARG 6 2HD ARG 6 16.643 -20.595 -6.558 1598 HD3 ARG 6 1HD ARG 6 18.278 -19.876 -6.858 1599 HE ARG 6 HE ARG 6 18.292 -20.506 -4.123 1600 HH11 ARG 6 1HH2 ARG 6 16.991 -22.739 -6.691 1601 HH12 ARG 6 2HH2 ARG 6 17.752 -24.064 -6.047 1602 HH21 ARG 6 1HH1 ARG 6 19.681 -22.321 -3.570 1603 HH22 ARG 6 2HH1 ARG 6 19.294 -23.890 -4.191 1604 H GLU 7 H GLU 7 13.289 -16.942 -6.719 1605 HA GLU 7 HA GLU 7 13.730 -14.887 -8.590 1606 HB2 GLU 7 2HB GLU 7 11.031 -16.195 -7.982 1607 HB3 GLU 7 1HB GLU 7 11.504 -15.229 -9.419 1608 HG2 GLU 7 2HG GLU 7 13.445 -17.068 -9.669 1609 HG3 GLU 7 1HG GLU 7 12.360 -18.081 -8.654 1610 H ALA 8 H ALA 8 12.096 -14.943 -5.432 1611 HA ALA 8 HA ALA 8 10.847 -12.435 -5.649 1612 HB1 ALA 8 1HB ALA 8 10.801 -12.447 -3.140 1613 HB2 ALA 8 2HB ALA 8 11.941 -13.840 -3.123 1614 HB3 ALA 8 3HB ALA 8 10.283 -14.038 -3.803 1615 H GLN 9 H GLN 9 14.123 -13.400 -4.507 1616 HA GLN 9 HA GLN 9 14.759 -10.692 -3.818 1617 HB2 GLN 9 2HB GLN 9 16.587 -13.120 -4.131 1618 HB3 GLN 9 1HB GLN 9 17.069 -11.546 -3.408 1619 HG2 GLN 9 2HG GLN 9 14.820 -13.346 -2.239 1620 HG3 GLN 9 1HG GLN 9 16.540 -13.395 -1.741 1621 HE21 GLN 9 1HE2 GLN 9 13.704 -11.082 -1.966 1622 HE22 GLN 9 2HE2 GLN 9 14.299 -9.977 -0.795 1623 H LYS 10 H LYS 10 14.911 -12.484 -6.849 1624 HA LYS 10 HA LYS 10 16.806 -10.693 -8.027 1625 HB2 LYS 10 2HB LYS 10 16.294 -12.872 -9.161 1626 HB3 LYS 10 1HB LYS 10 14.620 -12.298 -9.475 1627 HG2 LYS 10 2HG LYS 10 15.571 -10.359 -10.817 1628 HG3 LYS 10 1HG LYS 10 17.224 -10.971 -10.512 1629 HD2 LYS 10 2HD LYS 10 16.782 -12.968 -11.862 1630 HD3 LYS 10 1HD LYS 10 15.037 -12.572 -12.004 1631 HE2 LYS 10 2HE LYS 10 17.358 -10.838 -13.157 1632 HE3 LYS 10 1HE LYS 10 16.359 -12.029 -14.080 1633 HZ1 LYS 10 3HZ LYS 10 14.486 -10.426 -12.975 1634 HZ2 LYS 10 1HZ LYS 10 15.115 -10.285 -14.535 1635 HZ3 LYS 10 2HZ LYS 10 15.692 -9.296 -13.294 1636 H ALA 11 H ALA 11 13.266 -10.733 -7.568 1637 HA ALA 11 HA ALA 11 12.633 -8.648 -9.280 1638 HB1 ALA 11 1HB ALA 11 11.236 -9.308 -6.611 1639 HB2 ALA 11 2HB ALA 11 10.957 -10.192 -8.155 1640 HB3 ALA 11 3HB ALA 11 10.522 -8.459 -8.025 1641 H GLU 12 H GLU 12 13.739 -8.572 -5.861 1642 HA GLU 12 HA GLU 12 13.427 -5.827 -5.482 1643 HB2 GLU 12 2HB GLU 12 15.667 -7.579 -4.292 1644 HB3 GLU 12 1HB GLU 12 15.139 -5.947 -3.734 1645 HG2 GLU 12 2HG GLU 12 12.860 -6.965 -3.164 1646 HG3 GLU 12 1HG GLU 12 13.553 -8.592 -3.524 1647 H GLU 13 H GLU 13 16.096 -7.657 -7.026 1648 HA GLU 13 HA GLU 13 17.991 -5.565 -6.982 1649 HB2 GLU 13 2HB GLU 13 18.589 -8.018 -7.485 1650 HB3 GLU 13 1HB GLU 13 17.745 -7.848 -9.054 1651 HG2 GLU 13 2HG GLU 13 19.403 -5.923 -9.593 1652 HG3 GLU 13 1HG GLU 13 20.323 -6.418 -8.128 1653 H GLU 14 H GLU 14 15.501 -6.640 -9.236 1654 HA GLU 14 HA GLU 14 16.144 -5.024 -11.391 1655 HB2 GLU 14 2HB GLU 14 14.504 -7.124 -11.111 1656 HB3 GLU 14 1HB GLU 14 13.281 -5.885 -10.753 1657 HG2 GLU 14 2HG GLU 14 12.940 -6.220 -13.036 1658 HG3 GLU 14 1HG GLU 14 14.047 -4.806 -13.078 1659 H LEU 15 H LEU 15 14.242 -4.435 -8.461 1660 HA LEU 15 HA LEU 15 12.918 -2.151 -9.318 1661 HB2 LEU 15 2HB LEU 15 12.419 -3.497 -7.199 1662 HB3 LEU 15 1HB LEU 15 13.838 -2.746 -6.432 1663 HG LEU 15 HG LEU 15 12.832 -0.489 -6.640 1664 HD11 LEU 15 1HD1 LEU 15 11.566 -0.600 -8.717 1665 HD12 LEU 15 2HD1 LEU 15 10.397 -0.258 -7.413 1666 HD13 LEU 15 3HD1 LEU 15 10.510 -1.917 -8.087 1667 HD21 LEU 15 3HD2 LEU 15 10.846 -2.501 -5.393 1668 HD22 LEU 15 1HD2 LEU 15 10.975 -0.751 -5.013 1669 HD23 LEU 15 2HD2 LEU 15 12.336 -1.858 -4.614 1670 H GLN 16 H GLN 16 16.089 -2.571 -7.668 1671 HA GLN 16 HA GLN 16 16.408 0.240 -7.390 1672 HB2 GLN 16 2HB GLN 16 18.550 -1.930 -7.196 1673 HB3 GLN 16 1HB GLN 16 18.721 -0.198 -6.729 1674 HG2 GLN 16 2HG GLN 16 16.676 -0.560 -5.144 1675 HG3 GLN 16 1HG GLN 16 16.850 -2.321 -5.463 1676 HE21 GLN 16 1HE2 GLN 16 18.831 0.591 -4.449 1677 HE22 GLN 16 2HE2 GLN 16 19.756 -0.253 -3.262 1678 H LYS 17 H LYS 17 16.988 -1.942 -10.032 1679 HA LYS 17 HA LYS 17 18.852 -0.335 -11.436 1680 HB2 LYS 17 2HB LYS 17 18.431 -2.745 -11.954 1681 HB3 LYS 17 1HB LYS 17 16.758 -2.335 -12.453 1682 HG2 LYS 17 2HG LYS 17 17.612 -1.024 -14.381 1683 HG3 LYS 17 1HG LYS 17 19.304 -1.268 -13.836 1684 HD2 LYS 17 2HD LYS 17 18.679 -2.743 -15.742 1685 HD3 LYS 17 1HD LYS 17 19.186 -3.676 -14.290 1686 HE2 LYS 17 2HE LYS 17 16.830 -4.240 -13.745 1687 HE3 LYS 17 1HE LYS 17 16.225 -3.189 -15.084 1688 HZ1 LYS 17 3HZ LYS 17 17.076 -4.673 -16.673 1689 HZ2 LYS 17 1HZ LYS 17 16.309 -5.619 -15.453 1690 HZ3 LYS 17 2HZ LYS 17 18.018 -5.539 -15.552 1691 H VAL 18 H VAL 18 15.211 -0.500 -11.461 1692 HA VAL 18 HA VAL 18 15.112 1.488 -13.492 1693 HB VAL 18 HB VAL 18 12.694 1.600 -13.123 1694 HG11 VAL 18 1HG1 VAL 18 12.310 -0.694 -14.031 1695 HG12 VAL 18 2HG1 VAL 18 13.920 -1.233 -13.434 1696 HG13 VAL 18 3HG1 VAL 18 13.805 0.018 -14.733 1697 HG21 VAL 18 3HG2 VAL 18 11.595 -0.012 -11.605 1698 HG22 VAL 18 1HG2 VAL 18 12.688 1.025 -10.627 1699 HG23 VAL 18 2HG2 VAL 18 13.174 -0.659 -11.059 1700 H LEU 19 H LEU 19 15.281 1.610 -9.963 1701 HA LEU 19 HA LEU 19 14.453 4.282 -9.693 1702 HB2 LEU 19 2HB LEU 19 16.527 2.690 -8.056 1703 HB3 LEU 19 1HB LEU 19 15.927 4.318 -7.607 1704 HG LEU 19 HG LEU 19 14.185 1.792 -7.809 1705 HD11 LEU 19 1HD1 LEU 19 14.028 1.978 -5.339 1706 HD12 LEU 19 2HD1 LEU 19 15.151 3.386 -5.353 1707 HD13 LEU 19 3HD1 LEU 19 15.740 1.761 -5.853 1708 HD21 LEU 19 3HD2 LEU 19 12.701 3.564 -8.358 1709 HD22 LEU 19 1HD2 LEU 19 13.525 4.735 -7.273 1710 HD23 LEU 19 2HD2 LEU 19 12.541 3.424 -6.565 1711 H GLU 20 H GLU 20 17.656 2.843 -10.432 1712 HA GLU 20 HA GLU 20 19.025 5.318 -10.378 1713 HB2 GLU 20 2HB GLU 20 19.692 2.588 -11.613 1714 HB3 GLU 20 1HB GLU 20 20.842 3.963 -11.624 1715 HG2 GLU 20 2HG GLU 20 20.833 4.062 -9.141 1716 HG3 GLU 20 1HG GLU 20 19.620 2.736 -9.060 1717 H GLU 21 H GLU 21 17.392 3.456 -12.921 1718 HA GLU 21 HA GLU 21 18.188 5.058 -15.114 1719 HB2 GLU 21 2HB GLU 21 15.707 3.336 -14.502 1720 HB3 GLU 21 1HB GLU 21 15.830 4.198 -16.048 1721 HG2 GLU 21 2HG GLU 21 17.940 2.143 -15.110 1722 HG3 GLU 21 1HG GLU 21 16.483 1.740 -16.092 1723 H ALA 22 H ALA 22 15.388 5.097 -12.884 1724 HA ALA 22 HA ALA 22 14.034 7.170 -14.192 1725 HB1 ALA 22 1HB ALA 22 13.687 6.125 -11.318 1726 HB2 ALA 22 2HB ALA 22 12.832 5.506 -12.776 1727 HB3 ALA 22 3HB ALA 22 12.532 7.184 -12.208 1728 H SER 23 H SER 23 16.466 7.153 -11.525 1729 HA SER 23 HA SER 23 15.799 9.726 -10.640 1730 HB2 SER 23 2HB SER 23 18.142 9.750 -9.644 1731 HB3 SER 23 1HB SER 23 17.118 8.340 -9.186 1732 HG SER 23 1HG SER 23 19.193 7.699 -9.732 1733 H LYS 24 H LYS 24 18.020 8.535 -13.122 1734 HA LYS 24 HA LYS 24 19.167 11.000 -13.808 1735 HB2 LYS 24 2HB LYS 24 20.020 8.712 -14.482 1736 HB3 LYS 24 1HB LYS 24 18.686 8.567 -15.664 1737 HG2 LYS 24 2HG LYS 24 20.704 10.895 -15.732 1738 HG3 LYS 24 1HG LYS 24 21.122 9.283 -16.406 1739 HD2 LYS 24 2HD LYS 24 19.320 9.419 -18.088 1740 HD3 LYS 24 1HD LYS 24 18.688 10.924 -17.359 1741 HE2 LYS 24 2HE LYS 24 19.898 11.562 -19.342 1742 HE3 LYS 24 1HE LYS 24 20.811 12.139 -17.900 1743 HZ1 LYS 24 3HZ LYS 24 21.462 9.940 -19.790 1744 HZ2 LYS 24 1HZ LYS 24 22.192 9.962 -18.280 1745 HZ3 LYS 24 2HZ LYS 24 22.366 11.284 -19.337 1746 H LYS 25 H LYS 25 16.263 9.261 -14.945 1747 HA LYS 25 HA LYS 25 15.611 11.147 -16.949 1748 HB2 LYS 25 2HB LYS 25 13.877 9.091 -15.477 1749 HB3 LYS 25 1HB LYS 25 13.298 10.064 -16.870 1750 HG2 LYS 25 2HG LYS 25 14.796 9.027 -18.418 1751 HG3 LYS 25 1HG LYS 25 15.849 8.411 -17.109 1752 HD2 LYS 25 2HD LYS 25 14.018 6.832 -16.379 1753 HD3 LYS 25 1HD LYS 25 12.989 7.397 -17.732 1754 HE2 LYS 25 2HE LYS 25 14.247 5.166 -18.099 1755 HE3 LYS 25 1HE LYS 25 14.485 6.401 -19.400 1756 HZ1 LYS 25 3HZ LYS 25 16.495 5.101 -18.245 1757 HZ2 LYS 25 1HZ LYS 25 16.405 6.439 -17.202 1758 HZ3 LYS 25 2HZ LYS 25 16.594 6.694 -18.886 1759 H ALA 26 H ALA 26 14.653 10.829 -13.489 1760 HA ALA 26 HA ALA 26 12.667 12.744 -13.544 1761 HB1 ALA 26 1HB ALA 26 14.509 12.029 -11.180 1762 HB2 ALA 26 2HB ALA 26 13.017 11.132 -11.650 1763 HB3 ALA 26 3HB ALA 26 12.891 12.832 -11.081 1764 H VAL 27 H VAL 27 16.203 13.178 -12.815 1765 HA VAL 27 HA VAL 27 15.821 15.943 -12.269 1766 HB VAL 27 HB VAL 27 17.688 14.785 -11.302 1767 HG11 VAL 27 1HG1 VAL 27 18.146 13.145 -13.158 1768 HG12 VAL 27 2HG1 VAL 27 19.618 13.994 -12.608 1769 HG13 VAL 27 3HG1 VAL 27 18.831 14.469 -14.159 1770 HG21 VAL 27 3HG2 VAL 27 17.846 17.246 -11.693 1771 HG22 VAL 27 1HG2 VAL 27 18.662 16.959 -13.274 1772 HG23 VAL 27 2HG2 VAL 27 19.456 16.450 -11.749 1773 H GLU 28 H GLU 28 16.340 14.079 -15.230 1774 HA GLU 28 HA GLU 28 16.942 16.390 -16.811 1775 HB2 GLU 28 2HB GLU 28 17.690 13.900 -17.156 1776 HB3 GLU 28 1HB GLU 28 16.072 13.655 -17.875 1777 HG2 GLU 28 2HG GLU 28 16.636 15.448 -19.601 1778 HG3 GLU 28 1HG GLU 28 18.237 15.679 -18.802 1779 H ALA 29 H ALA 29 14.106 14.767 -15.647 1780 HA ALA 29 HA ALA 29 12.306 15.549 -17.700 1781 HB1 ALA 29 1HB ALA 29 10.558 14.698 -16.114 1782 HB2 ALA 29 2HB ALA 29 11.767 14.592 -14.804 1783 HB3 ALA 29 3HB ALA 29 11.881 13.523 -16.253 1784 H GLU 30 H GLU 30 13.039 16.567 -14.336 1785 HA GLU 30 HA GLU 30 11.251 18.760 -14.519 1786 HB2 GLU 30 2HB GLU 30 12.480 17.265 -12.471 1787 HB3 GLU 30 1HB GLU 30 13.263 18.866 -12.341 1788 HG2 GLU 30 2HG GLU 30 11.295 18.825 -10.885 1789 HG3 GLU 30 1HG GLU 30 10.897 19.889 -12.289 1790 H ARG 31 H ARG 31 14.107 18.334 -16.008 1791 HA ARG 31 HA ARG 31 15.480 20.760 -15.456 1792 HB2 ARG 31 2HB ARG 31 16.261 18.366 -16.420 1793 HB3 ARG 31 1HB ARG 31 15.915 19.089 -17.995 1794 HG2 ARG 31 2HG ARG 31 18.220 19.315 -17.573 1795 HG3 ARG 31 1HG ARG 31 17.553 20.974 -17.329 1796 HD2 ARG 31 2HD ARG 31 17.724 20.750 -14.872 1797 HD3 ARG 31 1HD ARG 31 18.141 18.981 -15.010 1798 HE ARG 31 HE ARG 31 20.033 20.156 -16.611 1799 HH11 ARG 31 1HH2 ARG 31 19.109 20.739 -13.148 1800 HH12 ARG 31 2HH2 ARG 31 20.535 21.578 -12.758 1801 HH21 ARG 31 1HH1 ARG 31 22.144 20.736 -15.902 1802 HH22 ARG 31 2HH1 ARG 31 22.482 21.307 -14.358 1803 H GLY 32 H GLY 32 13.682 22.278 -15.791 1804 HA2 GLY 32 2HA GLY 32 13.471 24.087 -17.344 1805 HA3 GLY 32 1HA GLY 32 13.218 22.883 -18.658 1806 H ALA 33 H ALA 33 11.842 21.746 -15.735 1807 HA ALA 33 HA ALA 33 9.230 22.261 -16.777 1808 HB1 ALA 33 1HB ALA 33 8.413 21.010 -14.752 1809 HB2 ALA 33 2HB ALA 33 10.095 20.943 -14.137 1810 HB3 ALA 33 3HB ALA 33 9.662 20.083 -15.654 1811 HA PRO 34 HA PRO 34 9.064 25.982 -14.319 1812 HB2 PRO 34 2HB PRO 34 6.347 26.643 -14.461 1813 HB3 PRO 34 1HB PRO 34 7.475 26.776 -15.867 1814 HG2 PRO 34 2HG PRO 34 5.564 24.475 -15.195 1815 HG3 PRO 34 1HG PRO 34 5.786 25.310 -16.791 1816 HD2 PRO 34 2HD PRO 34 7.050 22.912 -16.163 1817 HD3 PRO 34 1HD PRO 34 7.890 24.183 -17.169 1818 H GLY 35 H GLY 35 8.908 26.445 -12.039 1819 HA2 GLY 35 2HA GLY 35 8.055 26.349 -9.985 1820 HA3 GLY 35 1HA GLY 35 6.746 25.258 -10.566 1821 H ALA 36 H ALA 36 9.669 24.055 -11.578 1822 HA ALA 36 HA ALA 36 9.574 21.681 -10.384 1823 HB1 ALA 36 1HB ALA 36 12.019 21.422 -10.992 1824 HB2 ALA 36 2HB ALA 36 12.118 23.200 -11.235 1825 HB3 ALA 36 3HB ALA 36 11.078 22.196 -12.308 1826 H ALA 37 H ALA 37 9.990 20.765 -8.451 1827 HA ALA 37 HA ALA 37 11.416 22.296 -6.400 1828 HB1 ALA 37 1HB ALA 37 9.296 21.176 -5.718 1829 HB2 ALA 37 2HB ALA 37 10.696 20.439 -4.871 1830 HB3 ALA 37 3HB ALA 37 9.936 19.588 -6.275 1831 H LEU 38 H LEU 38 11.630 19.367 -8.449 1832 HA LEU 38 HA LEU 38 14.106 18.557 -7.159 1833 HB2 LEU 38 2HB LEU 38 12.524 16.721 -7.758 1834 HB3 LEU 38 1HB LEU 38 12.478 17.316 -9.444 1835 HG LEU 38 HG LEU 38 14.884 16.778 -9.751 1836 HD11 LEU 38 1HD1 LEU 38 15.694 16.960 -7.353 1837 HD12 LEU 38 2HD1 LEU 38 16.168 15.430 -8.159 1838 HD13 LEU 38 3HD1 LEU 38 14.798 15.425 -6.982 1839 HD21 LEU 38 3HD2 LEU 38 14.630 14.319 -9.847 1840 HD22 LEU 38 1HD2 LEU 38 13.134 15.164 -10.385 1841 HD23 LEU 38 2HD2 LEU 38 13.193 14.406 -8.753 1842 H ILE 39 H ILE 39 16.006 19.346 -7.994 1843 HA ILE 39 HA ILE 39 16.142 19.878 -10.872 1844 HB ILE 39 HB ILE 39 17.499 21.999 -10.319 1845 HG12 ILE 39 2HG1 ILE 39 15.927 21.771 -7.653 1846 HG13 ILE 39 1HG1 ILE 39 17.705 21.573 -7.830 1847 HG21 ILE 39 1HG2 ILE 39 14.466 22.109 -9.750 1848 HG22 ILE 39 2HG2 ILE 39 15.194 21.923 -11.381 1849 HG23 ILE 39 3HG2 ILE 39 15.498 23.417 -10.433 1850 HD11 ILE 39 3HD ILE 39 16.089 24.149 -8.411 1851 HD12 ILE 39 1HD ILE 39 17.192 23.845 -7.020 1852 HD13 ILE 39 2HD ILE 39 17.855 23.949 -8.691 1853 H SER 40 H SER 40 17.586 18.914 -7.762 1854 HA SER 40 HA SER 40 20.224 19.239 -8.656 1855 HB2 SER 40 2HB SER 40 19.240 17.358 -6.450 1856 HB3 SER 40 1HB SER 40 20.858 18.137 -6.559 1857 HG SER 40 1HG SER 40 19.336 18.953 -5.050 1858 H TYR 41 H TYR 41 21.787 17.626 -9.159 1859 HA TYR 41 HA TYR 41 20.785 15.218 -10.358 1860 HB2 TYR 41 2HB TYR 41 23.553 16.533 -10.230 1861 HB3 TYR 41 1HB TYR 41 23.411 14.786 -10.626 1862 HD1 TYR 41 2HD TYR 41 22.007 14.021 -12.513 1863 HD2 TYR 41 1HD TYR 41 23.083 18.148 -11.983 1864 HE1 TYR 41 2HE TYR 41 21.518 14.440 -14.882 1865 HE2 TYR 41 1HE TYR 41 22.637 18.573 -14.360 1866 HH TYR 41 HH TYR 41 21.324 16.023 -16.529 1867 HA PRO 42 HA PRO 42 23.220 12.784 -7.340 1868 HB2 PRO 42 2HB PRO 42 24.354 13.754 -4.960 1869 HB3 PRO 42 1HB PRO 42 25.208 13.826 -6.550 1870 HG2 PRO 42 2HG PRO 42 23.557 16.048 -5.213 1871 HG3 PRO 42 1HG PRO 42 25.214 16.168 -5.933 1872 HD2 PRO 42 2HD PRO 42 22.962 16.887 -7.355 1873 HD3 PRO 42 1HD PRO 42 24.341 16.021 -8.177 1874 H ASP 43 H ASP 43 21.343 15.395 -5.762 1875 HA ASP 43 HA ASP 43 20.267 13.806 -3.756 1876 HB2 ASP 43 2HB ASP 43 18.540 16.014 -5.016 1877 HB3 ASP 43 1HB ASP 43 18.596 15.452 -3.316 1878 H ALA 44 H ALA 44 19.722 13.706 -7.184 1879 HA ALA 44 HA ALA 44 16.928 13.447 -7.243 1880 HB1 ALA 44 1HB ALA 44 18.259 13.988 -9.306 1881 HB2 ALA 44 2HB ALA 44 17.208 12.556 -9.555 1882 HB3 ALA 44 3HB ALA 44 18.975 12.344 -9.270 1883 H ILE 45 H ILE 45 19.586 11.090 -6.861 1884 HA ILE 45 HA ILE 45 17.837 8.877 -7.238 1885 HB ILE 45 HB ILE 45 20.226 8.817 -7.813 1886 HG12 ILE 45 2HG1 ILE 45 19.293 6.655 -5.826 1887 HG13 ILE 45 1HG1 ILE 45 18.824 6.759 -7.547 1888 HG21 ILE 45 1HG2 ILE 45 20.711 8.630 -4.767 1889 HG22 ILE 45 2HG2 ILE 45 21.093 10.056 -5.799 1890 HG23 ILE 45 3HG2 ILE 45 21.938 8.507 -6.069 1891 HD11 ILE 45 3HD ILE 45 21.694 6.337 -6.456 1892 HD12 ILE 45 1HD ILE 45 20.648 5.112 -7.236 1893 HD13 ILE 45 2HD ILE 45 21.273 6.503 -8.202 1894 H TRP 46 H TRP 46 18.534 10.936 -4.518 1895 HA TRP 46 HA TRP 46 17.682 9.021 -2.565 1896 HB2 TRP 46 2HB TRP 46 18.314 11.990 -2.548 1897 HB3 TRP 46 1HB TRP 46 17.188 11.396 -1.286 1898 HD1 TRP 46 HD TRP 46 18.222 10.452 0.864 1899 HE1 TRP 46 1HE TRP 46 20.556 9.949 1.660 1900 HE3 TRP 46 3HE TRP 46 20.647 10.973 -3.582 1901 HZ2 TRP 46 2HZ TRP 46 23.166 9.528 0.486 1902 HZ3 TRP 46 3HZ TRP 46 23.073 10.532 -3.693 1903 HH2 TRP 46 HH TRP 46 24.318 9.806 -1.693 1904 H TRP 47 H TRP 47 16.002 11.290 -4.753 1905 HA TRP 47 HA TRP 47 13.559 11.110 -3.208 1906 HB2 TRP 47 2HB TRP 47 14.033 13.071 -4.749 1907 HB3 TRP 47 1HB TRP 47 13.924 11.962 -6.149 1908 HD1 TRP 47 HD TRP 47 11.490 12.655 -3.046 1909 HE1 TRP 47 1HE TRP 47 9.218 13.322 -4.061 1910 HE3 TRP 47 3HE TRP 47 12.589 12.060 -8.002 1911 HZ2 TRP 47 2HZ TRP 47 7.901 13.029 -6.569 1912 HZ3 TRP 47 3HZ TRP 47 10.775 12.270 -9.669 1913 HH2 TRP 47 HH TRP 47 8.463 12.743 -8.963 1914 H SER 48 H SER 48 15.129 9.509 -5.947 1915 HA SER 48 HA SER 48 12.878 7.927 -6.680 1916 HB2 SER 48 2HB SER 48 14.934 8.761 -8.123 1917 HB3 SER 48 1HB SER 48 15.824 7.372 -7.411 1918 HG SER 48 1HG SER 48 14.985 6.589 -9.218 1919 H VAL 49 H VAL 49 12.717 7.390 -4.224 1920 HA VAL 49 HA VAL 49 13.743 4.687 -3.841 1921 HB VAL 49 HB VAL 49 13.918 6.860 -1.646 1922 HG11 VAL 49 1HG1 VAL 49 13.225 4.612 -0.729 1923 HG12 VAL 49 2HG1 VAL 49 14.928 4.974 -0.281 1924 HG13 VAL 49 3HG1 VAL 49 14.583 3.829 -1.617 1925 HG21 VAL 49 3HG2 VAL 49 16.394 6.354 -1.701 1926 HG22 VAL 49 1HG2 VAL 49 15.797 7.109 -3.221 1927 HG23 VAL 49 2HG2 VAL 49 16.132 5.343 -3.171 1928 H GLU 50 H GLU 50 11.941 7.347 -2.161 1929 HA GLU 50 HA GLU 50 10.206 5.600 -0.915 1930 HB2 GLU 50 2HB GLU 50 8.925 7.654 -0.263 1931 HB3 GLU 50 1HB GLU 50 10.674 7.747 0.071 1932 HG2 GLU 50 2HG GLU 50 10.996 9.195 -2.012 1933 HG3 GLU 50 1HG GLU 50 9.216 9.120 -2.291 1934 H THR 51 H THR 51 10.013 7.096 -4.075 1935 HA THR 51 HA THR 51 7.290 6.937 -4.499 1936 HB THR 51 HB THR 51 9.486 6.587 -6.609 1937 HG1 THR 51 1HG THR 51 8.725 9.005 -5.328 1938 HG21 THR 51 3HG2 THR 51 6.819 8.175 -6.608 1939 HG22 THR 51 1HG2 THR 51 7.109 6.594 -7.425 1940 HG23 THR 51 2HG2 THR 51 7.993 8.060 -7.974 1941 H ALA 52 H ALA 52 9.918 4.503 -4.772 1942 HA ALA 52 HA ALA 52 8.317 2.734 -6.407 1943 HB1 ALA 52 1HB ALA 52 11.011 2.368 -4.958 1944 HB2 ALA 52 2HB ALA 52 10.717 2.559 -6.739 1945 HB3 ALA 52 3HB ALA 52 10.190 1.070 -5.897 1946 H THR 53 H THR 53 8.899 3.325 -2.938 1947 HA THR 53 HA THR 53 7.586 0.827 -2.253 1948 HB THR 53 HB THR 53 7.934 1.827 0.114 1949 HG1 THR 53 1HG THR 53 8.268 3.962 -0.565 1950 HG21 THR 53 3HG2 THR 53 10.380 1.332 -1.735 1951 HG22 THR 53 1HG2 THR 53 9.392 0.058 -0.923 1952 HG23 THR 53 2HG2 THR 53 10.358 1.214 0.064 1953 H THR 54 H THR 54 6.422 3.444 -3.672 1954 HA THR 54 HA THR 54 4.690 4.730 -3.627 1955 HB THR 54 HB THR 54 2.463 3.495 -3.284 1956 HG1 THR 54 1HG THR 54 3.426 1.905 -1.908 1957 HG21 THR 54 3HG2 THR 54 3.660 3.844 -5.483 1958 HG22 THR 54 1HG2 THR 54 2.874 2.226 -5.399 1959 HG23 THR 54 2HG2 THR 54 4.656 2.368 -5.179 1960 H VAL 55 H VAL 55 5.847 5.860 -1.690 1961 HA VAL 55 HA VAL 55 3.701 6.202 0.305 1962 HB VAL 55 HB VAL 55 6.662 6.787 0.864 1963 HG11 VAL 55 1HG1 VAL 55 5.650 6.818 3.244 1964 HG12 VAL 55 2HG1 VAL 55 4.032 6.639 2.504 1965 HG13 VAL 55 3HG1 VAL 55 4.991 8.121 2.186 1966 HG21 VAL 55 3HG2 VAL 55 6.436 4.338 0.530 1967 HG22 VAL 55 1HG2 VAL 55 4.955 4.312 1.547 1968 HG23 VAL 55 2HG2 VAL 55 6.557 4.703 2.285 1969 H GLY 56 H GLY 56 6.600 8.259 -0.304 1970 HA2 GLY 56 2HA GLY 56 6.697 10.208 -1.471 1971 HA3 GLY 56 1HA GLY 56 4.915 10.151 -1.768 1972 H TYR 57 H TYR 57 7.436 10.641 0.774 1973 HA TYR 57 HA TYR 57 5.513 11.464 2.732 1974 HB2 TYR 57 2HB TYR 57 8.588 11.664 2.550 1975 HB3 TYR 57 1HB TYR 57 7.693 12.514 3.855 1976 HD1 TYR 57 1HD TYR 57 7.519 8.984 2.412 1977 HD2 TYR 57 2HD TYR 57 7.825 11.533 5.868 1978 HE1 TYR 57 1HE TYR 57 7.805 7.015 3.852 1979 HE2 TYR 57 2HE TYR 57 8.091 9.561 7.310 1980 HH TYR 57 HH TYR 57 8.339 7.242 7.380 1981 H GLY 58 H GLY 58 6.999 13.087 0.084 1982 HA2 GLY 58 2HA GLY 58 6.254 15.135 -0.597 1983 HA3 GLY 58 1HA GLY 58 5.901 15.617 1.096 1984 H ASP 59 H ASP 59 8.937 14.138 0.027 1985 HA ASP 59 HA ASP 59 10.549 16.306 0.925 1986 HB2 ASP 59 2HB ASP 59 11.381 13.975 0.889 1987 HB3 ASP 59 1HB ASP 59 11.138 13.864 -0.880 1988 H ARG 60 H ARG 60 9.536 15.078 -2.345 1989 HA ARG 60 HA ARG 60 9.693 17.725 -3.406 1990 HB2 ARG 60 2HB ARG 60 11.580 15.476 -4.274 1991 HB3 ARG 60 1HB ARG 60 10.993 16.629 -5.510 1992 HG2 ARG 60 2HG ARG 60 12.130 18.457 -4.660 1993 HG3 ARG 60 1HG ARG 60 12.188 17.839 -2.989 1994 HD2 ARG 60 2HD ARG 60 13.832 16.638 -5.304 1995 HD3 ARG 60 1HD ARG 60 14.453 17.860 -4.102 1996 HE ARG 60 HE ARG 60 13.504 16.032 -2.369 1997 HH11 ARG 60 1HH2 ARG 60 15.754 15.767 -5.149 1998 HH12 ARG 60 2HH2 ARG 60 16.614 14.415 -4.511 1999 HH21 ARG 60 1HH1 ARG 60 14.669 14.223 -1.484 2000 HH22 ARG 60 2HH1 ARG 60 16.047 13.599 -2.296 2001 H TYR 61 H TYR 61 8.810 17.475 -5.836 2002 HA TYR 61 HA TYR 61 6.996 15.298 -6.052 2003 HB2 TYR 61 2HB TYR 61 5.101 17.127 -6.505 2004 HB3 TYR 61 1HB TYR 61 5.452 16.653 -4.809 2005 HD1 TYR 61 1HD TYR 61 6.116 19.309 -7.383 2006 HD2 TYR 61 2HD TYR 61 6.287 18.219 -3.228 2007 HE1 TYR 61 1HE TYR 61 6.604 21.645 -6.798 2008 HE2 TYR 61 2HE TYR 61 6.785 20.551 -2.628 2009 HH TYR 61 HH TYR 61 7.103 22.688 -3.380 2010 HA PRO 62 HA PRO 62 8.245 16.642 -10.167 2011 HB2 PRO 62 2HB PRO 62 6.579 15.053 -11.704 2012 HB3 PRO 62 1HB PRO 62 7.756 14.303 -10.579 2013 HG2 PRO 62 2HG PRO 62 4.763 14.867 -10.149 2014 HG3 PRO 62 1HG PRO 62 5.634 13.302 -9.884 2015 HD2 PRO 62 2HD PRO 62 5.140 15.255 -7.891 2016 HD3 PRO 62 1HD PRO 62 6.533 14.080 -7.826 2017 H VAL 63 H VAL 63 7.319 18.004 -12.090 2018 HA VAL 63 HA VAL 63 4.960 19.469 -11.170 2019 HB VAL 63 HB VAL 63 6.816 20.184 -13.450 2020 HG11 VAL 63 1HG1 VAL 63 5.686 22.331 -13.404 2021 HG12 VAL 63 2HG1 VAL 63 4.873 21.982 -11.833 2022 HG13 VAL 63 3HG1 VAL 63 4.324 21.200 -13.349 2023 HG21 VAL 63 3HG2 VAL 63 8.056 20.139 -11.310 2024 HG22 VAL 63 1HG2 VAL 63 6.743 21.068 -10.490 2025 HG23 VAL 63 2HG2 VAL 63 7.722 21.834 -11.799 2026 H THR 64 H THR 64 5.646 19.272 -14.616 2027 HA THR 64 HA THR 64 3.311 17.703 -15.133 2028 HB THR 64 HB THR 64 3.258 20.697 -15.800 2029 HG1 THR 64 1HG THR 64 2.524 19.247 -13.626 2030 HG21 THR 64 3HG2 THR 64 0.857 20.267 -16.419 2031 HG22 THR 64 1HG2 THR 64 1.086 18.503 -16.113 2032 HG23 THR 64 2HG2 THR 64 1.971 19.306 -17.456 2033 H GLU 65 H GLU 65 6.105 19.677 -16.286 2034 HA GLU 65 HA GLU 65 5.746 18.367 -18.889 2035 HB2 GLU 65 2HB GLU 65 6.116 20.949 -18.760 2036 HB3 GLU 65 1HB GLU 65 7.839 20.506 -18.476 2037 HG2 GLU 65 2HG GLU 65 7.797 19.146 -20.609 2038 HG3 GLU 65 1HG GLU 65 6.056 19.533 -20.825 2039 H GLU 66 H GLU 66 6.760 17.388 -16.082 2040 HA GLU 66 HA GLU 66 9.416 16.504 -16.563 2041 HB2 GLU 66 2HB GLU 66 8.130 14.605 -14.832 2042 HB3 GLU 66 1HB GLU 66 9.118 16.009 -14.362 2043 HG2 GLU 66 2HG GLU 66 7.312 16.206 -13.070 2044 HG3 GLU 66 1HG GLU 66 7.055 17.459 -14.265 2045 H GLY 67 H GLY 67 6.117 15.437 -16.803 2046 HA2 GLY 67 2HA GLY 67 5.173 14.030 -18.397 2047 HA3 GLY 67 1HA GLY 67 6.800 13.213 -18.609 2048 H ARG 68 H ARG 68 4.240 14.019 -16.188 2049 HA ARG 68 HA ARG 68 5.206 12.930 -13.996 2050 HB2 ARG 68 2HB ARG 68 3.077 14.120 -14.207 2051 HB3 ARG 68 1HB ARG 68 2.288 12.717 -14.986 2052 HG2 ARG 68 2HG ARG 68 2.291 11.460 -12.936 2053 HG3 ARG 68 1HG ARG 68 3.568 12.482 -12.193 2054 HD2 ARG 68 2HD ARG 68 0.757 13.536 -12.929 2055 HD3 ARG 68 1HD ARG 68 1.239 12.915 -11.284 2056 HE ARG 68 HE ARG 68 3.119 14.951 -12.354 2057 HH11 ARG 68 1HH2 ARG 68 -0.124 14.544 -10.855 2058 HH12 ARG 68 2HH2 ARG 68 0.163 15.424 -9.489 2059 HH21 ARG 68 1HH1 ARG 68 3.274 16.859 -10.948 2060 HH22 ARG 68 2HH1 ARG 68 2.092 17.223 -9.775 2061 H LYS 69 H LYS 69 4.179 11.241 -16.740 2062 HA LYS 69 HA LYS 69 3.844 8.636 -16.008 2063 HB2 LYS 69 2HB LYS 69 5.092 9.991 -18.421 2064 HB3 LYS 69 1HB LYS 69 5.283 8.222 -18.229 2065 HG2 LYS 69 2HG LYS 69 3.380 8.634 -19.658 2066 HG3 LYS 69 1HG LYS 69 2.933 7.813 -18.120 2067 HD2 LYS 69 2HD LYS 69 2.028 9.982 -17.224 2068 HD3 LYS 69 1HD LYS 69 2.448 10.797 -18.774 2069 HE2 LYS 69 2HE LYS 69 0.011 10.178 -18.601 2070 HE3 LYS 69 1HE LYS 69 0.810 9.340 -19.991 2071 HZ1 LYS 69 3HZ LYS 69 0.488 8.052 -17.308 2072 HZ2 LYS 69 1HZ LYS 69 0.883 7.331 -18.758 2073 HZ3 LYS 69 2HZ LYS 69 -0.683 7.935 -18.588 2074 H VAL 70 H VAL 70 6.866 10.574 -15.801 2075 HA VAL 70 HA VAL 70 8.598 8.362 -15.593 2076 HB VAL 70 HB VAL 70 8.861 11.236 -14.587 2077 HG11 VAL 70 1HG1 VAL 70 11.346 10.723 -14.478 2078 HG12 VAL 70 2HG1 VAL 70 10.983 8.977 -14.750 2079 HG13 VAL 70 3HG1 VAL 70 10.412 9.802 -13.253 2080 HG21 VAL 70 3HG2 VAL 70 10.299 11.483 -16.620 2081 HG22 VAL 70 1HG2 VAL 70 8.664 10.940 -17.105 2082 HG23 VAL 70 2HG2 VAL 70 10.018 9.756 -17.058 2083 H ALA 71 H ALA 71 6.661 10.164 -13.150 2084 HA ALA 71 HA ALA 71 7.823 8.694 -10.961 2085 HB1 ALA 71 1HB ALA 71 6.018 9.750 -9.588 2086 HB2 ALA 71 2HB ALA 71 5.228 10.370 -11.087 2087 HB3 ALA 71 3HB ALA 71 6.846 10.991 -10.592 2088 H GLU 72 H GLU 72 4.860 8.632 -12.921 2089 HA GLU 72 HA GLU 72 3.330 6.718 -11.729 2090 HB2 GLU 72 2HB GLU 72 2.761 8.141 -13.799 2091 HB3 GLU 72 1HB GLU 72 3.841 7.063 -14.742 2092 HG2 GLU 72 2HG GLU 72 2.241 5.119 -14.181 2093 HG3 GLU 72 1HG GLU 72 1.114 6.368 -13.522 2094 H GLN 73 H GLN 73 5.931 6.250 -14.156 2095 HA GLN 73 HA GLN 73 5.631 3.513 -14.455 2096 HB2 GLN 73 2HB GLN 73 6.878 4.956 -16.048 2097 HB3 GLN 73 1HB GLN 73 8.138 5.271 -14.815 2098 HG2 GLN 73 2HG GLN 73 8.893 2.924 -14.875 2099 HG3 GLN 73 1HG GLN 73 7.484 2.453 -15.902 2100 HE21 GLN 73 1HE2 GLN 73 8.368 1.989 -17.917 2101 HE22 GLN 73 2HE2 GLN 73 9.298 3.118 -18.858 2102 H VAL 74 H VAL 74 7.630 5.389 -12.150 2103 HA VAL 74 HA VAL 74 9.108 3.167 -11.216 2104 HB VAL 74 HB VAL 74 8.509 5.892 -9.947 2105 HG11 VAL 74 1HG1 VAL 74 10.548 3.701 -9.140 2106 HG12 VAL 74 2HG1 VAL 74 9.194 4.338 -8.136 2107 HG13 VAL 74 3HG1 VAL 74 10.583 5.403 -8.543 2108 HG21 VAL 74 3HG2 VAL 74 9.754 5.924 -12.170 2109 HG22 VAL 74 1HG2 VAL 74 10.965 4.792 -11.482 2110 HG23 VAL 74 2HG2 VAL 74 10.785 6.451 -10.799 2111 H MET 75 H MET 75 6.086 4.764 -10.174 2112 HA MET 75 HA MET 75 5.718 3.394 -7.778 2113 HB2 MET 75 2HB MET 75 3.619 4.394 -9.802 2114 HB3 MET 75 1HB MET 75 3.236 3.867 -8.127 2115 HG2 MET 75 2HG MET 75 4.334 5.717 -7.131 2116 HG3 MET 75 1HG MET 75 5.265 6.098 -8.605 2117 HE1 MET 75 3HE MET 75 3.723 8.176 -6.791 2118 HE2 MET 75 1HE MET 75 3.130 9.286 -8.070 2119 HE3 MET 75 2HE MET 75 4.768 8.554 -8.203 2120 H LYS 76 H LYS 76 4.469 2.583 -11.105 2121 HA LYS 76 HA LYS 76 3.209 0.263 -10.093 2122 HB2 LYS 76 2HB LYS 76 2.614 1.414 -12.355 2123 HB3 LYS 76 1HB LYS 76 3.975 0.457 -13.034 2124 HG2 LYS 76 2HG LYS 76 2.797 -1.609 -11.874 2125 HG3 LYS 76 1HG LYS 76 1.366 -0.559 -11.701 2126 HD2 LYS 76 2HD LYS 76 2.776 -1.253 -14.372 2127 HD3 LYS 76 1HD LYS 76 1.479 -2.242 -13.627 2128 HE2 LYS 76 2HE LYS 76 -0.121 -0.281 -13.765 2129 HE3 LYS 76 1HE LYS 76 1.160 0.660 -14.639 2130 HZ1 LYS 76 3HZ LYS 76 1.189 -1.244 -16.268 2131 HZ2 LYS 76 1HZ LYS 76 -0.238 -0.330 -16.243 2132 HZ3 LYS 76 2HZ LYS 76 -0.241 -1.845 -15.517 2133 H ALA 77 H ALA 77 6.480 0.847 -11.361 2134 HA ALA 77 HA ALA 77 7.184 -1.832 -11.765 2135 HB1 ALA 77 1HB ALA 77 8.608 0.094 -12.554 2136 HB2 ALA 77 2HB ALA 77 9.553 -1.074 -11.553 2137 HB3 ALA 77 3HB ALA 77 8.995 0.488 -10.839 2138 H GLY 78 H GLY 78 7.145 0.194 -8.833 2139 HA2 GLY 78 2HA GLY 78 8.484 -1.605 -7.125 2140 HA3 GLY 78 1HA GLY 78 7.351 -0.267 -6.699 2141 H ILE 79 H ILE 79 5.028 -1.086 -7.910 2142 HA ILE 79 HA ILE 79 4.034 -2.894 -6.039 2143 HB ILE 79 HB ILE 79 2.848 -2.013 -8.712 2144 HG12 ILE 79 2HG1 ILE 79 2.370 -1.005 -5.825 2145 HG13 ILE 79 1HG1 ILE 79 3.376 -0.163 -7.031 2146 HG21 ILE 79 1HG2 ILE 79 1.747 -4.133 -7.904 2147 HG22 ILE 79 2HG2 ILE 79 0.638 -2.745 -7.725 2148 HG23 ILE 79 3HG2 ILE 79 1.498 -3.392 -6.284 2149 HD11 ILE 79 3HD ILE 79 0.333 -0.650 -7.238 2150 HD12 ILE 79 1HD ILE 79 1.177 0.903 -6.942 2151 HD13 ILE 79 2HD ILE 79 1.346 0.084 -8.539 2152 H GLU 80 H GLU 80 5.004 -3.392 -9.499 2153 HA GLU 80 HA GLU 80 4.149 -6.028 -9.634 2154 HB2 GLU 80 2HB GLU 80 6.518 -4.746 -11.124 2155 HB3 GLU 80 1HB GLU 80 5.857 -6.381 -11.458 2156 HG2 GLU 80 2HG GLU 80 3.594 -5.317 -11.954 2157 HG3 GLU 80 1HG GLU 80 4.386 -3.702 -11.868 2158 H VAL 81 H VAL 81 7.395 -4.786 -8.593 2159 HA VAL 81 HA VAL 81 8.408 -7.414 -8.411 2160 HB VAL 81 HB VAL 81 10.355 -6.434 -7.258 2161 HG11 VAL 81 1HG1 VAL 81 11.082 -5.109 -9.240 2162 HG12 VAL 81 2HG1 VAL 81 9.379 -4.919 -9.787 2163 HG13 VAL 81 3HG1 VAL 81 10.144 -6.554 -9.767 2164 HG21 VAL 81 3HG2 VAL 81 10.497 -3.957 -7.033 2165 HG22 VAL 81 1HG2 VAL 81 9.223 -4.598 -5.962 2166 HG23 VAL 81 2HG2 VAL 81 8.787 -3.784 -7.508 2167 H PHE 82 H PHE 82 6.937 -5.225 -5.950 2168 HA PHE 82 HA PHE 82 7.552 -7.059 -3.845 2169 HB2 PHE 82 2HB PHE 82 5.560 -4.702 -3.948 2170 HB3 PHE 82 1HB PHE 82 5.913 -5.667 -2.462 2171 HD1 PHE 82 1HD PHE 82 8.747 -6.032 -2.295 2172 HD2 PHE 82 2HD PHE 82 6.579 -2.608 -3.753 2173 HE1 PHE 82 1HE PHE 82 10.663 -4.586 -1.761 2174 HE2 PHE 82 2HE PHE 82 8.502 -1.169 -3.226 2175 HZ PHE 82 HZ PHE 82 10.557 -2.147 -2.222 2176 H ALA 83 H ALA 83 4.686 -6.478 -5.953 2177 HA ALA 83 HA ALA 83 2.993 -8.205 -4.542 2178 HB1 ALA 83 1HB ALA 83 2.092 -6.611 -6.246 2179 HB2 ALA 83 2HB ALA 83 1.598 -8.295 -6.622 2180 HB3 ALA 83 3HB ALA 83 2.942 -7.518 -7.547 2181 H LEU 84 H LEU 84 5.380 -8.745 -7.133 2182 HA LEU 84 HA LEU 84 4.774 -11.321 -7.860 2183 HB2 LEU 84 2HB LEU 84 6.396 -9.848 -9.003 2184 HB3 LEU 84 1HB LEU 84 7.556 -10.017 -7.657 2185 HG LEU 84 HG LEU 84 6.572 -12.511 -9.130 2186 HD11 LEU 84 1HD1 LEU 84 7.077 -10.892 -10.950 2187 HD12 LEU 84 2HD1 LEU 84 8.297 -12.217 -10.901 2188 HD13 LEU 84 3HD1 LEU 84 8.709 -10.584 -10.248 2189 HD21 LEU 84 3HD2 LEU 84 8.942 -13.293 -8.782 2190 HD22 LEU 84 1HD2 LEU 84 8.156 -12.886 -7.225 2191 HD23 LEU 84 2HD2 LEU 84 9.336 -11.742 -7.956 2192 H VAL 85 H VAL 85 6.580 -10.187 -4.998 2193 HA VAL 85 HA VAL 85 7.743 -12.585 -4.259 2194 HB VAL 85 HB VAL 85 6.748 -10.346 -2.418 2195 HG11 VAL 85 1HG1 VAL 85 8.883 -12.554 -2.001 2196 HG12 VAL 85 2HG1 VAL 85 7.373 -12.304 -1.051 2197 HG13 VAL 85 3HG1 VAL 85 8.694 -11.099 -0.954 2198 HG21 VAL 85 3HG2 VAL 85 9.376 -10.701 -4.022 2199 HG22 VAL 85 1HG2 VAL 85 9.155 -9.519 -2.678 2200 HG23 VAL 85 2HG2 VAL 85 8.160 -9.378 -4.152 2201 H THR 86 H THR 86 4.367 -11.712 -4.214 2202 HA THR 86 HA THR 86 3.479 -13.332 -2.142 2203 HB THR 86 HB THR 86 1.994 -12.757 -4.739 2204 HG1 THR 86 1HG THR 86 2.505 -10.844 -4.026 2205 HG21 THR 86 3HG2 THR 86 0.826 -14.432 -3.264 2206 HG22 THR 86 1HG2 THR 86 -0.035 -12.860 -3.212 2207 HG23 THR 86 2HG2 THR 86 1.029 -13.344 -1.840 2208 H ALA 87 H ALA 87 4.756 -14.258 -5.312 2209 HA ALA 87 HA ALA 87 3.590 -16.825 -5.450 2210 HB1 ALA 87 1HB ALA 87 6.345 -15.876 -6.477 2211 HB2 ALA 87 2HB ALA 87 4.805 -15.756 -7.389 2212 HB3 ALA 87 3HB ALA 87 5.481 -17.373 -6.999 2213 H ALA 88 H ALA 88 6.137 -15.463 -3.461 2214 HA ALA 88 HA ALA 88 7.187 -18.040 -2.637 2215 HB1 ALA 88 1HB ALA 88 7.658 -15.210 -1.469 2216 HB2 ALA 88 2HB ALA 88 8.749 -16.050 -2.624 2217 HB3 ALA 88 3HB ALA 88 8.499 -16.703 -0.960 2218 H LEU 89 H LEU 89 5.269 -15.307 -1.323 2219 HA LEU 89 HA LEU 89 4.926 -16.398 1.187 2220 HB2 LEU 89 2HB LEU 89 3.060 -14.438 -0.268 2221 HB3 LEU 89 1HB LEU 89 3.124 -14.689 1.506 2222 HG LEU 89 HG LEU 89 5.519 -13.685 -0.161 2223 HD11 LEU 89 1HD1 LEU 89 4.971 -11.418 0.682 2224 HD12 LEU 89 2HD1 LEU 89 3.460 -12.054 1.437 2225 HD13 LEU 89 3HD1 LEU 89 3.653 -12.065 -0.354 2226 HD21 LEU 89 3HD2 LEU 89 6.414 -12.932 2.046 2227 HD22 LEU 89 1HD2 LEU 89 6.189 -14.714 2.013 2228 HD23 LEU 89 2HD2 LEU 89 5.004 -13.671 2.883 2229 H ALA 90 H ALA 90 2.861 -16.799 -1.700 2230 HA ALA 90 HA ALA 90 0.717 -17.958 -0.261 2231 HB1 ALA 90 1HB ALA 90 -0.101 -18.707 -2.489 2232 HB2 ALA 90 2HB ALA 90 1.497 -18.269 -3.216 2233 HB3 ALA 90 3HB ALA 90 0.428 -16.986 -2.544 2234 H THR 91 H THR 91 3.886 -19.218 -1.016 2235 HA THR 91 HA THR 91 2.902 -21.960 -0.919 2236 HB THR 91 HB THR 91 5.169 -22.760 -1.009 2237 HG1 THR 91 1HG THR 91 5.816 -20.012 -0.835 2238 HG21 THR 91 3HG2 THR 91 3.853 -22.289 -3.088 2239 HG22 THR 91 1HG2 THR 91 5.625 -22.084 -3.348 2240 HG23 THR 91 2HG2 THR 91 4.569 -20.634 -3.164 2241 H ASP 92 H ASP 92 3.590 -19.465 1.386 2242 HA ASP 92 HA ASP 92 5.024 -21.155 3.144 2243 HB2 ASP 92 2HB ASP 92 3.896 -18.350 3.478 2244 HB3 ASP 92 1HB ASP 92 4.406 -19.300 4.920 2245 H PHE 93 H PHE 93 1.623 -20.938 2.509 2246 HA PHE 93 HA PHE 93 1.049 -22.244 5.047 2247 HB2 PHE 93 2HB PHE 93 -1.167 -22.396 4.551 2248 HB3 PHE 93 1HB PHE 93 -0.729 -20.781 3.910 2249 HD1 PHE 93 1HD PHE 93 -0.509 -20.560 1.350 2250 HD2 PHE 93 2HD PHE 93 -2.078 -24.103 3.201 2251 HE1 PHE 93 1HE PHE 93 -1.566 -21.206 -0.785 2252 HE2 PHE 93 2HE PHE 93 -3.109 -24.767 1.052 2253 HZ PHE 93 HZ PHE 93 -2.881 -23.306 -0.939 2254 H VAL 94 H VAL 94 1.794 -23.094 1.699 2255 HA VAL 94 HA VAL 94 0.695 -25.655 1.680 2256 HB VAL 94 HB VAL 94 3.028 -24.596 -0.010 2257 HG11 VAL 94 1HG1 VAL 94 2.120 -26.238 -1.716 2258 HG12 VAL 94 2HG1 VAL 94 0.934 -26.833 -0.500 2259 HG13 VAL 94 3HG1 VAL 94 2.698 -27.075 -0.233 2260 HG21 VAL 94 3HG2 VAL 94 1.235 -23.898 -1.627 2261 HG22 VAL 94 1HG2 VAL 94 1.060 -23.009 -0.087 2262 HG23 VAL 94 2HG2 VAL 94 -0.031 -24.390 -0.448 2263 H ARG 95 H ARG 95 3.812 -24.355 2.517 2264 HA ARG 95 HA ARG 95 5.482 -26.409 3.009 2265 HB2 ARG 95 2HB ARG 95 6.145 -24.111 3.353 2266 HB3 ARG 95 1HB ARG 95 4.753 -23.809 4.431 2267 HG2 ARG 95 2HG ARG 95 6.793 -23.682 5.699 2268 HG3 ARG 95 1HG ARG 95 5.754 -25.008 6.283 2269 HD2 ARG 95 2HD ARG 95 8.094 -25.651 6.342 2270 HD3 ARG 95 1HD ARG 95 7.263 -26.707 5.133 2271 HE ARG 95 HE ARG 95 8.339 -24.429 3.747 2272 HH11 ARG 95 1HH2 ARG 95 9.728 -27.025 5.902 2273 HH12 ARG 95 2HH2 ARG 95 11.212 -27.050 5.088 2274 HH21 ARG 95 1HH1 ARG 95 10.305 -24.464 2.722 2275 HH22 ARG 95 2HH1 ARG 95 11.579 -25.555 3.094 2276 H ARG 96 H ARG 96 2.500 -25.672 4.927 2277 HA ARG 96 HA ARG 96 3.372 -27.019 7.208 2278 HB2 ARG 96 2HB ARG 96 1.318 -26.743 8.186 2279 HB3 ARG 96 1HB ARG 96 1.357 -25.374 7.031 2280 HG2 ARG 96 2HG ARG 96 -0.127 -26.740 5.465 2281 HG3 ARG 96 1HG ARG 96 -0.094 -28.076 6.675 2282 HD2 ARG 96 2HD ARG 96 -1.049 -26.258 8.378 2283 HD3 ARG 96 1HD ARG 96 -1.510 -25.367 6.888 2284 HE ARG 96 HE ARG 96 -3.041 -27.116 6.313 2285 HH11 ARG 96 1HH2 ARG 96 -1.235 -27.973 9.378 2286 HH12 ARG 96 2HH2 ARG 96 -2.280 -29.285 9.733 2287 HH21 ARG 96 1HH1 ARG 96 -4.486 -28.998 6.944 2288 HH22 ARG 96 2HH1 ARG 96 -4.234 -29.676 8.481 2289 H GLU 97 H GLU 97 2.112 -28.218 4.201 2290 HA GLU 97 HA GLU 97 1.074 -30.669 5.172 2291 HB2 GLU 97 2HB GLU 97 0.877 -29.199 2.859 2292 HB3 GLU 97 1HB GLU 97 2.060 -30.404 2.298 2293 HG2 GLU 97 2HG GLU 97 -0.652 -31.134 3.642 2294 HG3 GLU 97 1HG GLU 97 -0.493 -30.791 1.881 2295 H GLU 98 H GLU 98 4.232 -29.498 3.973 2296 HA GLU 98 HA GLU 98 5.376 -32.109 3.896 2297 HB2 GLU 98 2HB GLU 98 6.817 -29.419 3.883 2298 HB3 GLU 98 1HB GLU 98 7.520 -31.008 3.433 2299 HG2 GLU 98 2HG GLU 98 5.197 -29.644 1.887 2300 HG3 GLU 98 1HG GLU 98 6.941 -29.457 1.517 2301 H GLU 99 H GLU 99 5.249 -29.403 6.254 2302 HA GLU 99 HA GLU 99 7.151 -30.562 7.985 2303 HB2 GLU 99 2HB GLU 99 4.942 -28.562 8.659 2304 HB3 GLU 99 1HB GLU 99 6.288 -29.021 9.754 2305 HG2 GLU 99 2HG GLU 99 6.639 -27.723 6.990 2306 HG3 GLU 99 1HG GLU 99 6.686 -26.838 8.556 2307 H ARG 100 H ARG 100 3.866 -31.428 7.369 2308 HA ARG 100 HA ARG 100 3.304 -32.662 9.841 2309 HB2 ARG 100 2HB ARG 100 1.609 -32.134 8.042 2310 HB3 ARG 100 1HB ARG 100 2.322 -33.438 7.029 2311 HG2 ARG 100 2HG ARG 100 1.632 -35.152 8.684 2312 HG3 ARG 100 1HG ARG 100 1.128 -33.876 9.838 2313 HD2 ARG 100 2HD ARG 100 -0.841 -34.907 8.725 2314 HD3 ARG 100 1HD ARG 100 -0.713 -33.150 8.343 2315 HE ARG 100 HE ARG 100 0.352 -33.781 6.146 2316 HH11 ARG 100 1HH2 ARG 100 -1.554 -36.463 7.683 2317 HH12 ARG 100 2HH2 ARG 100 -2.441 -36.807 6.309 2318 HH21 ARG 100 1HH1 ARG 100 -0.684 -34.449 4.158 2319 HH22 ARG 100 2HH1 ARG 100 -1.900 -35.667 4.185 2320 H ARG 101 H ARG 101 5.265 -33.636 7.030 2321 HA ARG 101 HA ARG 101 5.464 -36.394 7.910 2322 HB2 ARG 101 2HB ARG 101 7.247 -34.800 5.936 2323 HB3 ARG 101 1HB ARG 101 7.470 -36.528 6.369 2324 HG2 ARG 101 2HG ARG 101 6.285 -37.009 4.572 2325 HG3 ARG 101 1HG ARG 101 4.869 -36.639 5.613 2326 HD2 ARG 101 2HD ARG 101 4.937 -34.231 4.660 2327 HD3 ARG 101 1HD ARG 101 6.229 -34.775 3.502 2328 HE ARG 101 HE ARG 101 4.122 -36.682 3.407 2329 HH11 ARG 101 1HH2 ARG 101 4.644 -33.314 2.071 2330 HH12 ARG 101 2HH2 ARG 101 2.935 -33.100 1.841 2331 HH21 ARG 101 1HH1 ARG 101 1.789 -36.213 2.971 2332 HH22 ARG 101 2HH1 ARG 101 1.376 -34.623 2.492 2333 H GLY 102 H GLY 102 7.230 -33.326 8.232 2334 HA2 GLY 102 2HA GLY 102 8.766 -32.680 9.719 2335 HA3 GLY 102 1HA GLY 102 8.636 -34.292 10.535 2336 H HIS 103 H HIS 103 9.482 -33.332 7.138 2337 HA HIS 103 HA HIS 103 12.184 -34.311 7.590 2338 HB2 HIS 103 2HB HIS 103 10.265 -35.437 5.447 2339 HB3 HIS 103 1HB HIS 103 12.044 -35.623 5.389 2340 HD1 HIS 103 1HD HIS 103 13.139 -37.341 7.053 2341 HD2 HIS 103 2HD HIS 103 8.947 -37.060 7.498 2342 HE1 HIS 103 1HE HIS 103 12.377 -39.336 8.372 2343 HE2 HIS 103 2HE HIS 103 9.877 -39.190 8.606 2344 H1 SER 1 H SER 1 -3.796 -25.591 19.038 2345 HA SER 1 HA SER 1 -5.329 -25.070 17.551 2346 HB2 SER 1 2HB SER 1 -5.036 -22.095 18.292 2347 HB3 SER 1 1HB SER 1 -6.357 -22.837 17.302 2348 HG SER 1 1HG SER 1 -7.073 -22.571 19.361 2349 H ALA 2 H ALA 2 -4.937 -22.415 15.833 2350 HA ALA 2 HA ALA 2 -3.354 -23.945 14.080 2351 HB1 ALA 2 1HB ALA 2 -3.652 -22.033 12.457 2352 HB2 ALA 2 2HB ALA 2 -4.498 -21.136 13.784 2353 HB3 ALA 2 3HB ALA 2 -5.191 -22.665 13.146 2354 H ASP 3 H ASP 3 -1.386 -23.590 13.162 2355 HA ASP 3 HA ASP 3 0.596 -22.625 14.930 2356 HB2 ASP 3 2HB ASP 3 2.142 -23.499 13.115 2357 HB3 ASP 3 1HB ASP 3 1.022 -24.729 13.774 2358 H HIS 4 H HIS 4 -0.390 -21.997 11.620 2359 HA HIS 4 HA HIS 4 1.266 -19.922 11.006 2360 HB2 HIS 4 2HB HIS 4 -0.362 -19.212 9.218 2361 HB3 HIS 4 1HB HIS 4 -0.049 -20.966 9.256 2362 HD1 HIS 4 1HD HIS 4 -2.981 -18.565 10.541 2363 HD2 HIS 4 2HD HIS 4 -2.239 -22.492 9.114 2364 HE1 HIS 4 1HE HIS 4 -5.109 -19.596 10.247 2365 HE2 HIS 4 2HE HIS 4 -4.724 -21.917 9.271 2366 H GLU 5 H GLU 5 -1.664 -19.702 12.959 2367 HA GLU 5 HA GLU 5 -2.041 -16.897 12.677 2368 HB2 GLU 5 2HB GLU 5 -2.816 -18.794 14.998 2369 HB3 GLU 5 1HB GLU 5 -3.365 -17.087 14.833 2370 HG2 GLU 5 2HG GLU 5 -4.030 -19.347 12.843 2371 HG3 GLU 5 1HG GLU 5 -5.147 -18.674 14.092 2372 H ARG 6 H ARG 6 -0.130 -19.000 14.843 2373 HA ARG 6 HA ARG 6 0.415 -16.923 16.715 2374 HB2 ARG 6 2HB ARG 6 1.895 -19.573 16.177 2375 HB3 ARG 6 1HB ARG 6 2.237 -18.460 17.545 2376 HG2 ARG 6 2HG ARG 6 -0.056 -18.770 18.430 2377 HG3 ARG 6 1HG ARG 6 -0.458 -19.888 17.078 2378 HD2 ARG 6 2HD ARG 6 1.297 -21.524 17.876 2379 HD3 ARG 6 1HD ARG 6 1.811 -20.352 19.144 2380 HE ARG 6 HE ARG 6 0.018 -20.913 20.472 2381 HH11 ARG 6 1HH2 ARG 6 -0.848 -22.081 17.162 2382 HH12 ARG 6 2HH2 ARG 6 -1.735 -23.418 17.669 2383 HH21 ARG 6 1HH1 ARG 6 -1.503 -22.638 21.199 2384 HH22 ARG 6 2HH1 ARG 6 -2.313 -23.587 20.023 2385 H GLU 7 H GLU 7 1.965 -18.188 13.774 2386 HA GLU 7 HA GLU 7 4.361 -16.737 14.077 2387 HB2 GLU 7 2HB GLU 7 4.129 -18.750 12.674 2388 HB3 GLU 7 1HB GLU 7 3.054 -17.882 11.528 2389 HG2 GLU 7 2HG GLU 7 4.833 -16.556 10.653 2390 HG3 GLU 7 1HG GLU 7 5.792 -16.707 12.161 2391 H ALA 8 H ALA 8 1.243 -16.025 12.467 2392 HA ALA 8 HA ALA 8 2.029 -13.623 11.283 2393 HB1 ALA 8 1HB ALA 8 -0.435 -13.115 11.152 2394 HB2 ALA 8 2HB ALA 8 -0.766 -14.455 12.309 2395 HB3 ALA 8 3HB ALA 8 -0.101 -14.820 10.676 2396 H GLN 9 H GLN 9 0.684 -14.312 14.526 2397 HA GLN 9 HA GLN 9 0.427 -11.581 15.268 2398 HB2 GLN 9 2HB GLN 9 0.661 -14.143 16.948 2399 HB3 GLN 9 1HB GLN 9 0.291 -12.525 17.641 2400 HG2 GLN 9 2HG GLN 9 -1.811 -12.362 16.390 2401 HG3 GLN 9 1HG GLN 9 -1.455 -13.866 15.470 2402 HE21 GLN 9 1HE2 GLN 9 -3.700 -14.361 16.467 2403 HE22 GLN 9 2HE2 GLN 9 -3.724 -15.089 18.043 2404 H LYS 10 H LYS 10 3.024 -14.043 15.686 2405 HA LYS 10 HA LYS 10 4.662 -12.501 17.336 2406 HB2 LYS 10 2HB LYS 10 5.133 -14.911 16.996 2407 HB3 LYS 10 1HB LYS 10 5.436 -14.632 15.245 2408 HG2 LYS 10 2HG LYS 10 7.430 -13.267 15.736 2409 HG3 LYS 10 1HG LYS 10 7.083 -13.339 17.502 2410 HD2 LYS 10 2HD LYS 10 7.647 -15.744 17.525 2411 HD3 LYS 10 1HD LYS 10 7.728 -15.790 15.728 2412 HE2 LYS 10 2HE LYS 10 10.008 -15.700 16.892 2413 HE3 LYS 10 1HE LYS 10 9.736 -14.412 15.654 2414 HZ1 LYS 10 3HZ LYS 10 9.541 -12.789 17.259 2415 HZ2 LYS 10 1HZ LYS 10 10.759 -13.769 17.826 2416 HZ3 LYS 10 2HZ LYS 10 9.207 -13.914 18.538 2417 H ALA 11 H ALA 11 4.400 -12.697 13.777 2418 HA ALA 11 HA ALA 11 6.612 -11.257 13.093 2419 HB1 ALA 11 1HB ALA 11 3.882 -11.175 11.658 2420 HB2 ALA 11 2HB ALA 11 5.129 -12.461 11.453 2421 HB3 ALA 11 3HB ALA 11 5.485 -10.779 10.929 2422 H GLU 12 H GLU 12 3.416 -9.995 14.125 2423 HA GLU 12 HA GLU 12 3.968 -7.312 13.453 2424 HB2 GLU 12 2HB GLU 12 2.054 -8.417 15.600 2425 HB3 GLU 12 1HB GLU 12 2.223 -6.689 15.147 2426 HG2 GLU 12 2HG GLU 12 1.666 -7.400 12.707 2427 HG3 GLU 12 1HG GLU 12 1.116 -8.972 13.402 2428 H GLU 13 H GLU 13 4.730 -9.262 16.363 2429 HA GLU 13 HA GLU 13 5.421 -6.957 17.902 2430 HB2 GLU 13 2HB GLU 13 6.174 -9.891 18.410 2431 HB3 GLU 13 1HB GLU 13 6.300 -8.518 19.567 2432 HG2 GLU 13 2HG GLU 13 3.738 -8.184 19.233 2433 HG3 GLU 13 1HG GLU 13 3.724 -9.776 18.390 2434 H GLU 14 H GLU 14 7.079 -9.167 15.722 2435 HA GLU 14 HA GLU 14 9.678 -8.429 16.427 2436 HB2 GLU 14 2HB GLU 14 8.655 -10.440 14.949 2437 HB3 GLU 14 1HB GLU 14 9.006 -9.325 13.601 2438 HG2 GLU 14 2HG GLU 14 10.911 -10.770 13.791 2439 HG3 GLU 14 1HG GLU 14 11.443 -9.218 14.532 2440 H LEU 15 H LEU 15 7.302 -7.033 14.148 2441 HA LEU 15 HA LEU 15 9.030 -5.250 12.873 2442 HB2 LEU 15 2HB LEU 15 6.752 -5.758 12.027 2443 HB3 LEU 15 1HB LEU 15 6.021 -4.958 13.451 2444 HG LEU 15 HG LEU 15 6.846 -2.764 12.726 2445 HD11 LEU 15 1HD1 LEU 15 8.022 -2.460 10.504 2446 HD12 LEU 15 2HD1 LEU 15 8.266 -4.246 10.422 2447 HD13 LEU 15 3HD1 LEU 15 9.036 -3.277 11.730 2448 HD21 LEU 15 3HD2 LEU 15 5.509 -4.283 10.397 2449 HD22 LEU 15 1HD2 LEU 15 5.537 -2.498 10.623 2450 HD23 LEU 15 2HD2 LEU 15 4.681 -3.542 11.812 2451 H GLN 16 H GLN 16 7.214 -4.983 15.916 2452 HA GLN 16 HA GLN 16 7.529 -2.245 16.348 2453 HB2 GLN 16 2HB GLN 16 7.442 -4.497 18.442 2454 HB3 GLN 16 1HB GLN 16 7.187 -2.755 18.791 2455 HG2 GLN 16 2HG GLN 16 5.110 -2.721 17.449 2456 HG3 GLN 16 1HG GLN 16 5.395 -4.409 16.892 2457 HE21 GLN 16 1HE2 GLN 16 3.184 -4.804 17.872 2458 HE22 GLN 16 2HE2 GLN 16 3.104 -5.172 19.562 2459 H LYS 17 H LYS 17 9.696 -4.975 16.960 2460 HA LYS 17 HA LYS 17 11.598 -3.558 18.507 2461 HB2 LYS 17 2HB LYS 17 11.378 -6.045 18.504 2462 HB3 LYS 17 1HB LYS 17 11.828 -6.081 16.768 2463 HG2 LYS 17 2HG LYS 17 14.131 -5.339 17.296 2464 HG3 LYS 17 1HG LYS 17 13.695 -5.097 19.018 2465 HD2 LYS 17 2HD LYS 17 14.969 -7.193 18.663 2466 HD3 LYS 17 1HD LYS 17 13.332 -7.502 19.344 2467 HE2 LYS 17 2HE LYS 17 12.496 -8.197 17.076 2468 HE3 LYS 17 1HE LYS 17 14.128 -7.882 16.364 2469 HZ1 LYS 17 3HZ LYS 17 13.786 -9.784 18.628 2470 HZ2 LYS 17 1HZ LYS 17 14.994 -9.743 17.417 2471 HZ3 LYS 17 2HZ LYS 17 13.390 -10.209 17.036 2472 H VAL 18 H VAL 18 11.284 -4.270 14.977 2473 HA VAL 18 HA VAL 18 13.818 -3.267 14.317 2474 HB VAL 18 HB VAL 18 11.332 -3.505 12.544 2475 HG11 VAL 18 1HG1 VAL 18 13.060 -3.589 10.673 2476 HG12 VAL 18 2HG1 VAL 18 14.337 -3.144 11.857 2477 HG13 VAL 18 3HG1 VAL 18 13.003 -1.990 11.481 2478 HG21 VAL 18 3HG2 VAL 18 13.713 -5.425 13.056 2479 HG22 VAL 18 1HG2 VAL 18 12.405 -5.667 11.836 2480 HG23 VAL 18 2HG2 VAL 18 12.015 -5.694 13.585 2481 H LEU 19 H LEU 19 10.549 -1.722 14.297 2482 HA LEU 19 HA LEU 19 11.595 0.724 13.341 2483 HB2 LEU 19 2HB LEU 19 9.484 1.750 13.666 2484 HB3 LEU 19 1HB LEU 19 9.235 0.090 13.065 2485 HG LEU 19 HG LEU 19 8.928 -0.463 15.679 2486 HD11 LEU 19 1HD1 LEU 19 7.983 2.480 15.513 2487 HD12 LEU 19 2HD1 LEU 19 9.347 1.895 16.524 2488 HD13 LEU 19 3HD1 LEU 19 7.678 1.344 16.878 2489 HD21 LEU 19 3HD2 LEU 19 7.262 -0.886 13.884 2490 HD22 LEU 19 1HD2 LEU 19 6.727 0.835 13.955 2491 HD23 LEU 19 2HD2 LEU 19 6.470 -0.247 15.369 2492 H GLU 20 H GLU 20 11.107 -0.552 16.702 2493 HA GLU 20 HA GLU 20 11.678 1.966 17.811 2494 HB2 GLU 20 2HB GLU 20 11.269 -0.745 18.969 2495 HB3 GLU 20 1HB GLU 20 12.287 0.344 19.946 2496 HG2 GLU 20 2HG GLU 20 9.518 1.225 18.930 2497 HG3 GLU 20 1HG GLU 20 9.814 0.410 20.508 2498 H GLU 21 H GLU 21 13.870 -0.740 16.932 2499 HA GLU 21 HA GLU 21 16.094 0.480 18.259 2500 HB2 GLU 21 2HB GLU 21 16.100 -1.323 15.765 2501 HB3 GLU 21 1HB GLU 21 17.560 -0.720 16.631 2502 HG2 GLU 21 2HG GLU 21 16.742 -1.920 18.733 2503 HG3 GLU 21 1HG GLU 21 15.450 -2.676 17.730 2504 H ALA 22 H ALA 22 14.575 0.740 15.062 2505 HA ALA 22 HA ALA 22 16.517 2.402 13.914 2506 HB1 ALA 22 1HB ALA 22 14.824 1.145 12.545 2507 HB2 ALA 22 2HB ALA 22 14.846 2.910 12.179 2508 HB3 ALA 22 3HB ALA 22 13.533 2.215 13.197 2509 H SER 23 H SER 23 13.593 3.147 15.905 2510 HA SER 23 HA SER 23 13.305 5.784 15.545 2511 HB2 SER 23 2HB SER 23 13.405 4.391 18.321 2512 HB3 SER 23 1HB SER 23 12.603 5.959 17.963 2513 HG SER 23 1HG SER 23 11.373 3.922 18.077 2514 H LYS 24 H LYS 24 15.651 4.251 17.815 2515 HA LYS 24 HA LYS 24 16.574 6.716 18.817 2516 HB2 LYS 24 2HB LYS 24 16.835 4.604 20.079 2517 HB3 LYS 24 1HB LYS 24 17.954 3.951 18.846 2518 HG2 LYS 24 2HG LYS 24 18.580 6.582 20.288 2519 HG3 LYS 24 1HG LYS 24 18.819 5.031 21.147 2520 HD2 LYS 24 2HD LYS 24 20.602 4.336 19.901 2521 HD3 LYS 24 1HD LYS 24 20.080 5.135 18.404 2522 HE2 LYS 24 2HE LYS 24 21.472 6.510 20.803 2523 HE3 LYS 24 1HE LYS 24 22.152 6.174 19.161 2524 HZ1 LYS 24 3HZ LYS 24 20.317 8.253 20.048 2525 HZ2 LYS 24 1HZ LYS 24 20.015 7.610 18.496 2526 HZ3 LYS 24 2HZ LYS 24 21.523 8.325 18.884 2527 H LYS 25 H LYS 25 17.490 4.707 16.072 2528 HA LYS 25 HA LYS 25 19.931 6.180 15.599 2529 HB2 LYS 25 2HB LYS 25 18.546 3.969 14.002 2530 HB3 LYS 25 1HB LYS 25 20.156 4.679 13.624 2531 HG2 LYS 25 2HG LYS 25 21.025 3.985 15.854 2532 HG3 LYS 25 1HG LYS 25 19.456 3.214 16.269 2533 HD2 LYS 25 2HD LYS 25 21.180 2.398 13.849 2534 HD3 LYS 25 1HD LYS 25 21.349 1.686 15.493 2535 HE2 LYS 25 2HE LYS 25 18.997 0.867 15.452 2536 HE3 LYS 25 1HE LYS 25 18.749 1.580 13.806 2537 HZ1 LYS 25 3HZ LYS 25 20.805 -0.467 14.469 2538 HZ2 LYS 25 1HZ LYS 25 20.407 0.142 12.930 2539 HZ3 LYS 25 2HZ LYS 25 19.285 -0.812 13.818 2540 H ALA 26 H ALA 26 16.570 6.495 14.744 2541 HA ALA 26 HA ALA 26 16.867 7.570 12.196 2542 HB1 ALA 26 1HB ALA 26 14.545 8.392 12.457 2543 HB2 ALA 26 2HB ALA 26 14.616 8.133 14.241 2544 HB3 ALA 26 3HB ALA 26 14.672 6.726 13.120 2545 H VAL 27 H VAL 27 16.584 9.096 15.403 2546 HA VAL 27 HA VAL 27 16.871 11.773 14.529 2547 HB VAL 27 HB VAL 27 17.367 10.233 17.126 2548 HG11 VAL 27 1HG1 VAL 27 17.803 13.280 16.822 2549 HG12 VAL 27 2HG1 VAL 27 19.092 12.071 17.169 2550 HG13 VAL 27 3HG1 VAL 27 17.806 12.316 18.355 2551 HG21 VAL 27 3HG2 VAL 27 15.361 11.552 17.837 2552 HG22 VAL 27 1HG2 VAL 27 15.024 10.681 16.293 2553 HG23 VAL 27 2HG2 VAL 27 15.370 12.444 16.266 2554 H GLU 28 H GLU 28 19.126 9.195 15.368 2555 HA GLU 28 HA GLU 28 21.383 10.856 15.551 2556 HB2 GLU 28 2HB GLU 28 20.937 8.378 16.456 2557 HB3 GLU 28 1HB GLU 28 21.564 7.877 14.856 2558 HG2 GLU 28 2HG GLU 28 23.401 7.854 16.535 2559 HG3 GLU 28 1HG GLU 28 23.699 9.177 15.350 2560 H ALA 29 H ALA 29 19.754 9.176 12.950 2561 HA ALA 29 HA ALA 29 21.767 9.131 11.059 2562 HB1 ALA 29 1HB ALA 29 19.991 8.729 9.445 2563 HB2 ALA 29 2HB ALA 29 18.745 9.409 10.560 2564 HB3 ALA 29 3HB ALA 29 19.572 7.858 10.953 2565 H GLU 30 H GLU 30 19.376 11.671 11.919 2566 HA GLU 30 HA GLU 30 20.105 13.239 9.661 2567 HB2 GLU 30 2HB GLU 30 18.422 13.844 12.142 2568 HB3 GLU 30 1HB GLU 30 18.662 14.996 10.786 2569 HG2 GLU 30 2HG GLU 30 17.409 12.184 10.484 2570 HG3 GLU 30 1HG GLU 30 16.524 13.752 10.558 2571 H ARG 31 H ARG 31 21.890 12.696 12.474 2572 HA ARG 31 HA ARG 31 22.961 15.414 12.607 2573 HB2 ARG 31 2HB ARG 31 23.861 12.793 13.927 2574 HB3 ARG 31 1HB ARG 31 24.893 14.251 13.883 2575 HG2 ARG 31 2HG ARG 31 23.925 14.293 15.993 2576 HG3 ARG 31 1HG ARG 31 23.111 15.585 15.043 2577 HD2 ARG 31 2HD ARG 31 21.078 14.067 14.803 2578 HD3 ARG 31 1HD ARG 31 21.946 12.791 15.737 2579 HE ARG 31 HE ARG 31 21.031 15.488 16.755 2580 HH11 ARG 31 1HH2 ARG 31 22.308 12.146 17.629 2581 HH12 ARG 31 2HH2 ARG 31 21.817 12.304 19.224 2582 HH21 ARG 31 1HH1 ARG 31 20.741 15.726 19.063 2583 HH22 ARG 31 2HH1 ARG 31 21.048 14.422 20.115 2584 H GLY 32 H GLY 32 23.494 15.775 10.410 2585 HA2 GLY 32 2HA GLY 32 25.945 15.614 9.532 2586 HA3 GLY 32 1HA GLY 32 25.330 13.971 9.080 2587 H ALA 33 H ALA 33 22.511 15.060 8.834 2588 HA ALA 33 HA ALA 33 22.879 15.540 6.045 2589 HB1 ALA 33 1HB ALA 33 20.343 15.237 7.723 2590 HB2 ALA 33 2HB ALA 33 21.158 13.903 6.854 2591 HB3 ALA 33 3HB ALA 33 20.377 15.240 5.927 2592 HA PRO 34 HA PRO 34 22.006 19.876 6.457 2593 HB2 PRO 34 2HB PRO 34 21.373 20.612 3.863 2594 HB3 PRO 34 1HB PRO 34 23.016 20.067 4.367 2595 HG2 PRO 34 2HG PRO 34 20.806 18.391 3.057 2596 HG3 PRO 34 1HG PRO 34 22.552 18.498 2.581 2597 HD2 PRO 34 2HD PRO 34 21.557 16.467 4.205 2598 HD3 PRO 34 1HD PRO 34 23.228 17.159 4.462 2599 H GLY 35 H GLY 35 20.120 19.985 7.878 2600 HA2 GLY 35 2HA GLY 35 18.136 21.463 7.398 2601 HA3 GLY 35 1HA GLY 35 17.517 19.998 6.516 2602 H ALA 36 H ALA 36 18.693 18.021 8.028 2603 HA ALA 36 HA ALA 36 18.467 16.713 9.650 2604 HB1 ALA 36 1HB ALA 36 18.109 19.128 11.522 2605 HB2 ALA 36 2HB ALA 36 19.651 18.286 11.127 2606 HB3 ALA 36 3HB ALA 36 18.369 17.417 12.040 2607 H ALA 37 H ALA 37 16.108 19.117 10.808 2608 HA ALA 37 HA ALA 37 13.952 19.098 11.084 2609 HB1 ALA 37 1HB ALA 37 13.701 18.527 8.680 2610 HB2 ALA 37 2HB ALA 37 12.377 17.826 9.679 2611 HB3 ALA 37 3HB ALA 37 13.717 16.778 9.091 2612 H LEU 38 H LEU 38 14.716 15.594 10.874 2613 HA LEU 38 HA LEU 38 12.953 15.069 13.134 2614 HB2 LEU 38 2HB LEU 38 13.005 13.543 11.114 2615 HB3 LEU 38 1HB LEU 38 14.719 13.193 11.462 2616 HG LEU 38 HG LEU 38 14.092 12.107 13.619 2617 HD11 LEU 38 1HD1 LEU 38 11.170 12.524 12.723 2618 HD12 LEU 38 2HD1 LEU 38 11.961 13.271 14.175 2619 HD13 LEU 38 3HD1 LEU 38 11.723 11.491 14.092 2620 HD21 LEU 38 3HD2 LEU 38 14.395 10.793 11.556 2621 HD22 LEU 38 1HD2 LEU 38 12.659 11.005 11.125 2622 HD23 LEU 38 2HD2 LEU 38 13.113 10.068 12.595 2623 H ILE 39 H ILE 39 14.540 16.682 14.325 2624 HA ILE 39 HA ILE 39 16.655 15.040 15.559 2625 HB ILE 39 HB ILE 39 17.726 16.632 14.183 2626 HG12 ILE 39 2HG1 ILE 39 17.928 17.559 17.113 2627 HG13 ILE 39 1HG1 ILE 39 18.644 16.048 16.452 2628 HG21 ILE 39 1HG2 ILE 39 16.136 18.861 15.614 2629 HG22 ILE 39 2HG2 ILE 39 15.893 18.306 13.917 2630 HG23 ILE 39 3HG2 ILE 39 17.431 19.085 14.390 2631 HD11 ILE 39 3HD ILE 39 19.318 18.927 15.535 2632 HD12 ILE 39 1HD ILE 39 20.362 17.846 16.509 2633 HD13 ILE 39 2HD ILE 39 19.985 17.426 14.794 2634 H SER 40 H SER 40 16.000 14.439 17.583 2635 HA SER 40 HA SER 40 14.913 16.080 19.456 2636 HB2 SER 40 2HB SER 40 12.787 16.173 18.043 2637 HB3 SER 40 1HB SER 40 12.777 14.382 17.945 2638 HG SER 40 1HG SER 40 11.325 15.411 19.525 2639 H TYR 41 H TYR 41 13.232 13.596 20.181 2640 HA TYR 41 HA TYR 41 14.817 11.286 20.004 2641 HB2 TYR 41 2HB TYR 41 15.341 12.971 22.422 2642 HB3 TYR 41 1HB TYR 41 14.686 11.354 22.864 2643 HD1 TYR 41 1HD TYR 41 15.767 9.278 22.030 2644 HD2 TYR 41 2HD TYR 41 17.649 13.128 21.674 2645 HE1 TYR 41 1HE TYR 41 17.954 8.181 21.811 2646 HE2 TYR 41 2HE TYR 41 19.843 12.043 21.448 2647 HH TYR 41 HH TYR 41 21.026 10.038 21.683 2648 HA PRO 42 HA PRO 42 11.001 10.228 22.337 2649 HB2 PRO 42 2HB PRO 42 9.069 12.103 23.236 2650 HB3 PRO 42 1HB PRO 42 10.481 11.556 24.217 2651 HG2 PRO 42 2HG PRO 42 10.288 14.056 22.439 2652 HG3 PRO 42 1HG PRO 42 10.840 13.955 24.161 2653 HD2 PRO 42 2HD PRO 42 12.669 13.965 22.130 2654 HD3 PRO 42 1HD PRO 42 12.886 12.806 23.516 2655 H ASP 43 H ASP 43 10.817 12.763 19.955 2656 HA ASP 43 HA ASP 43 8.242 11.942 18.943 2657 HB2 ASP 43 2HB ASP 43 10.413 13.693 17.619 2658 HB3 ASP 43 1HB ASP 43 8.737 13.453 17.004 2659 H ALA 44 H ALA 44 11.423 10.684 18.841 2660 HA ALA 44 HA ALA 44 11.669 10.085 16.106 2661 HB1 ALA 44 1HB ALA 44 13.585 10.076 17.819 2662 HB2 ALA 44 2HB ALA 44 13.507 8.636 16.744 2663 HB3 ALA 44 3HB ALA 44 12.941 8.533 18.456 2664 H ILE 45 H ILE 45 10.462 8.265 18.940 2665 HA ILE 45 HA ILE 45 9.928 5.873 17.592 2666 HB ILE 45 HB ILE 45 10.087 5.770 19.936 2667 HG12 ILE 45 2HG1 ILE 45 7.125 5.353 19.167 2668 HG13 ILE 45 1HG1 ILE 45 8.490 4.205 18.980 2669 HG21 ILE 45 1HG2 ILE 45 8.578 7.034 21.498 2670 HG22 ILE 45 2HG2 ILE 45 7.856 7.913 20.121 2671 HG23 ILE 45 3HG2 ILE 45 9.601 8.119 20.525 2672 HD11 ILE 45 3HD ILE 45 7.320 5.257 21.647 2673 HD12 ILE 45 1HD ILE 45 7.212 3.591 20.975 2674 HD13 ILE 45 2HD ILE 45 8.806 4.241 21.498 2675 H TRP 46 H TRP 46 8.002 8.822 18.069 2676 HA TRP 46 HA TRP 46 5.608 7.658 17.120 2677 HB2 TRP 46 2HB TRP 46 6.537 10.280 18.105 2678 HB3 TRP 46 1HB TRP 46 5.490 10.506 16.694 2679 HD1 TRP 46 HD TRP 46 3.486 11.517 17.970 2680 HE1 TRP 46 1HE TRP 46 1.907 10.821 19.862 2681 HE3 TRP 46 3HE TRP 46 5.824 7.200 19.385 2682 HZ2 TRP 46 2HZ TRP 46 1.583 8.604 21.623 2683 HZ3 TRP 46 3HZ TRP 46 4.886 5.886 21.234 2684 HH2 TRP 46 HH TRP 46 2.801 6.581 22.354 2685 H TRP 47 H TRP 47 8.231 9.483 15.537 2686 HA TRP 47 HA TRP 47 7.055 9.500 12.961 2687 HB2 TRP 47 2HB TRP 47 8.984 10.960 13.540 2688 HB3 TRP 47 1HB TRP 47 9.988 9.525 13.893 2689 HD1 TRP 47 HD TRP 47 8.324 11.171 10.681 2690 HE1 TRP 47 1HE TRP 47 9.710 10.449 8.681 2691 HE3 TRP 47 3HE TRP 47 11.318 7.810 13.058 2692 HZ2 TRP 47 2HZ TRP 47 11.868 8.597 8.153 2693 HZ3 TRP 47 3HZ TRP 47 12.857 6.426 11.720 2694 HH2 TRP 47 HH TRP 47 13.175 6.853 9.323 2695 H SER 48 H SER 48 9.059 7.112 14.758 2696 HA SER 48 HA SER 48 9.657 5.619 12.476 2697 HB2 SER 48 2HB SER 48 10.804 5.648 14.888 2698 HB3 SER 48 1HB SER 48 9.672 4.303 15.232 2699 HG SER 48 1HG SER 48 11.528 3.469 14.438 2700 H VAL 49 H VAL 49 7.084 5.422 14.893 2701 HA VAL 49 HA VAL 49 5.874 3.056 14.196 2702 HB VAL 49 HB VAL 49 5.012 5.706 15.396 2703 HG11 VAL 49 1HG1 VAL 49 2.943 4.911 14.292 2704 HG12 VAL 49 2HG1 VAL 49 2.825 4.640 16.061 2705 HG13 VAL 49 3HG1 VAL 49 3.202 3.260 14.958 2706 HG21 VAL 49 3HG2 VAL 49 5.204 2.813 16.501 2707 HG22 VAL 49 1HG2 VAL 49 4.916 4.312 17.464 2708 HG23 VAL 49 2HG2 VAL 49 6.502 4.037 16.664 2709 H GLU 50 H GLU 50 5.114 6.353 12.857 2710 HA GLU 50 HA GLU 50 3.295 5.302 10.964 2711 HB2 GLU 50 2HB GLU 50 3.263 7.647 10.039 2712 HB3 GLU 50 1HB GLU 50 2.973 7.558 11.798 2713 HG2 GLU 50 2HG GLU 50 5.423 8.144 12.184 2714 HG3 GLU 50 1HG GLU 50 5.599 8.429 10.419 2715 H THR 51 H THR 51 6.746 5.493 10.965 2716 HA THR 51 HA THR 51 6.975 5.527 8.082 2717 HB THR 51 HB THR 51 8.971 5.217 10.376 2718 HG1 THR 51 1HG THR 51 8.367 7.243 10.175 2719 HG21 THR 51 3HG2 THR 51 9.552 5.198 7.329 2720 HG22 THR 51 1HG2 THR 51 9.909 3.906 8.513 2721 HG23 THR 51 2HG2 THR 51 10.777 5.471 8.623 2722 H ALA 52 H ALA 52 7.025 3.144 10.750 2723 HA ALA 52 HA ALA 52 7.861 0.981 9.174 2724 HB1 ALA 52 1HB ALA 52 5.982 0.956 11.622 2725 HB2 ALA 52 2HB ALA 52 7.781 0.934 11.694 2726 HB3 ALA 52 3HB ALA 52 6.893 -0.457 10.968 2727 H THR 53 H THR 53 4.638 2.508 9.675 2728 HA THR 53 HA THR 53 3.382 0.450 8.089 2729 HB THR 53 HB THR 53 1.358 2.053 8.747 2730 HG1 THR 53 1HG THR 53 2.095 2.871 10.964 2731 HG21 THR 53 3HG2 THR 53 1.246 0.779 10.928 2732 HG22 THR 53 1HG2 THR 53 2.974 0.296 10.733 2733 HG23 THR 53 2HG2 THR 53 1.735 -0.275 9.555 2734 H THR 54 H THR 54 5.364 2.754 7.182 2735 HA THR 54 HA THR 54 5.699 3.939 5.418 2736 HB THR 54 HB THR 54 5.332 2.883 3.325 2737 HG1 THR 54 1HG THR 54 3.117 2.517 3.486 2738 HG21 THR 54 3HG2 THR 54 6.660 1.710 5.285 2739 HG22 THR 54 1HG2 THR 54 6.186 0.678 3.882 2740 HG23 THR 54 2HG2 THR 54 5.269 0.595 5.425 2741 H VAL 55 H VAL 55 3.788 5.198 6.986 2742 HA VAL 55 HA VAL 55 1.530 5.868 5.355 2743 HB VAL 55 HB VAL 55 2.424 7.106 8.018 2744 HG11 VAL 55 1HG1 VAL 55 -0.338 6.954 6.623 2745 HG12 VAL 55 2HG1 VAL 55 0.702 8.417 6.625 2746 HG13 VAL 55 3HG1 VAL 55 0.052 7.782 8.180 2747 HG21 VAL 55 3HG2 VAL 55 2.213 4.652 8.271 2748 HG22 VAL 55 1HG2 VAL 55 0.631 4.664 7.417 2749 HG23 VAL 55 2HG2 VAL 55 0.810 5.461 9.025 2750 H GLY 56 H GLY 56 4.042 7.834 7.008 2751 HA2 GLY 56 2HA GLY 56 5.112 9.703 6.419 2752 HA3 GLY 56 1HA GLY 56 4.966 9.089 4.729 2753 H TYR 57 H TYR 57 2.306 10.057 6.872 2754 HA TYR 57 HA TYR 57 0.934 11.221 4.842 2755 HB2 TYR 57 2HB TYR 57 0.291 10.429 7.340 2756 HB3 TYR 57 1HB TYR 57 0.505 12.157 7.744 2757 HD1 TYR 57 1HD TYR 57 -0.798 13.827 6.096 2758 HD2 TYR 57 2HD TYR 57 -1.832 9.702 6.772 2759 HE1 TYR 57 1HE TYR 57 -3.108 14.334 5.581 2760 HE2 TYR 57 2HE TYR 57 -4.206 10.237 6.339 2761 HH TYR 57 HH TYR 57 -5.163 13.531 6.414 2762 H GLY 58 H GLY 58 3.228 12.702 7.031 2763 HA2 GLY 58 2HA GLY 58 4.517 14.307 5.732 2764 HA3 GLY 58 1HA GLY 58 3.001 15.252 5.527 2765 H ASP 59 H ASP 59 4.202 13.526 8.457 2766 HA ASP 59 HA ASP 59 3.931 16.075 9.831 2767 HB2 ASP 59 2HB ASP 59 2.839 13.967 10.754 2768 HB3 ASP 59 1HB ASP 59 4.494 13.387 11.170 2769 H ARG 60 H ARG 60 6.465 13.366 9.545 2770 HA ARG 60 HA ARG 60 8.406 15.500 9.273 2771 HB2 ARG 60 2HB ARG 60 8.715 13.191 11.272 2772 HB3 ARG 60 1HB ARG 60 10.107 14.148 10.689 2773 HG2 ARG 60 2HG ARG 60 9.520 16.091 11.867 2774 HG3 ARG 60 1HG ARG 60 7.794 15.643 11.949 2775 HD2 ARG 60 2HD ARG 60 10.035 14.322 13.611 2776 HD3 ARG 60 1HD ARG 60 8.790 15.472 14.225 2777 HE ARG 60 HE ARG 60 8.398 12.619 13.456 2778 HH11 ARG 60 1HH2 ARG 60 6.710 15.769 14.076 2779 HH12 ARG 60 2HH2 ARG 60 5.182 15.058 13.998 2780 HH21 ARG 60 1HH1 ARG 60 6.005 11.872 12.940 2781 HH22 ARG 60 2HH1 ARG 60 4.860 12.862 13.571 2782 H TYR 61 H TYR 61 10.525 14.417 8.392 2783 HA TYR 61 HA TYR 61 10.092 11.953 7.060 2784 HB2 TYR 61 2HB TYR 61 11.034 13.377 4.871 2785 HB3 TYR 61 1HB TYR 61 9.304 13.016 5.125 2786 HD1 TYR 61 1HD TYR 61 11.871 15.691 5.916 2787 HD2 TYR 61 2HD TYR 61 7.758 14.719 5.094 2788 HE1 TYR 61 1HE TYR 61 11.317 18.093 5.827 2789 HE2 TYR 61 2HE TYR 61 7.204 17.099 4.998 2790 HH TYR 61 HH TYR 61 8.134 19.219 4.721 2791 HA PRO 62 HA PRO 62 14.514 12.559 7.757 2792 HB2 PRO 62 2HB PRO 62 15.628 10.743 6.019 2793 HB3 PRO 62 1HB PRO 62 14.635 10.170 7.414 2794 HG2 PRO 62 2HG PRO 62 13.752 10.547 4.491 2795 HG3 PRO 62 1HG PRO 62 13.470 9.108 5.557 2796 HD2 PRO 62 2HD PRO 62 11.629 11.181 5.165 2797 HD3 PRO 62 1HD PRO 62 11.707 10.242 6.726 2798 H VAL 63 H VAL 63 16.536 13.248 6.500 2799 HA VAL 63 HA VAL 63 15.625 14.928 4.265 2800 HB VAL 63 HB VAL 63 18.088 15.228 6.003 2801 HG11 VAL 63 1HG1 VAL 63 18.052 17.555 4.950 2802 HG12 VAL 63 2HG1 VAL 63 16.816 16.993 3.775 2803 HG13 VAL 63 3HG1 VAL 63 18.482 16.293 3.758 2804 HG21 VAL 63 3HG2 VAL 63 16.010 15.549 7.271 2805 HG22 VAL 63 1HG2 VAL 63 15.286 16.547 5.955 2806 HG23 VAL 63 2HG2 VAL 63 16.695 17.158 6.902 2807 H THR 64 H THR 64 19.003 13.768 4.713 2808 HA THR 64 HA THR 64 18.792 12.522 2.067 2809 HB THR 64 HB THR 64 20.748 14.814 2.643 2810 HG1 THR 64 1HG THR 64 18.475 15.273 2.113 2811 HG21 THR 64 3HG2 THR 64 21.754 13.006 1.164 2812 HG22 THR 64 1HG2 THR 64 21.385 14.491 0.223 2813 HG23 THR 64 2HG2 THR 64 20.294 13.064 0.114 2814 H GLU 65 H GLU 65 21.606 13.602 4.122 2815 HA GLU 65 HA GLU 65 22.783 11.130 3.615 2816 HB2 GLU 65 2HB GLU 65 24.094 13.245 4.086 2817 HB3 GLU 65 1HB GLU 65 23.540 13.166 5.795 2818 HG2 GLU 65 2HG GLU 65 25.855 12.329 5.546 2819 HG3 GLU 65 1HG GLU 65 24.770 11.006 6.105 2820 H GLU 66 H GLU 66 22.830 9.310 4.730 2821 HA GLU 66 HA GLU 66 22.082 7.674 5.909 2822 HB2 GLU 66 2HB GLU 66 22.236 9.601 8.252 2823 HB3 GLU 66 1HB GLU 66 21.925 7.839 8.408 2824 HG2 GLU 66 2HG GLU 66 24.114 7.339 7.273 2825 HG3 GLU 66 1HG GLU 66 24.470 9.106 7.213 2826 H GLY 67 H GLY 67 20.054 10.385 7.134 2827 HA2 GLY 67 2HA GLY 67 18.084 9.237 8.402 2828 HA3 GLY 67 1HA GLY 67 17.838 10.578 7.241 2829 H ARG 68 H ARG 68 18.067 9.466 4.872 2830 HA ARG 68 HA ARG 68 15.542 8.194 4.648 2831 HB2 ARG 68 2HB ARG 68 16.357 9.877 3.037 2832 HB3 ARG 68 1HB ARG 68 17.699 8.785 2.538 2833 HG2 ARG 68 2HG ARG 68 16.140 7.166 1.594 2834 HG3 ARG 68 1HG ARG 68 14.737 7.974 2.354 2835 HD2 ARG 68 2HD ARG 68 16.527 9.203 0.132 2836 HD3 ARG 68 1HD ARG 68 14.944 8.406 -0.136 2837 HE ARG 68 HE ARG 68 15.382 11.142 0.857 2838 HH11 ARG 68 1HH2 ARG 68 13.156 8.416 1.322 2839 HH12 ARG 68 2HH2 ARG 68 11.768 9.377 1.357 2840 HH21 ARG 68 1HH1 ARG 68 13.335 12.456 0.400 2841 HH22 ARG 68 2HH1 ARG 68 11.894 11.546 0.241 2842 H LYS 69 H LYS 69 18.912 7.008 4.536 2843 HA LYS 69 HA LYS 69 18.198 4.516 3.290 2844 HB2 LYS 69 2HB LYS 69 20.751 5.246 4.859 2845 HB3 LYS 69 1HB LYS 69 20.501 3.830 3.778 2846 HG2 LYS 69 2HG LYS 69 20.033 5.487 1.878 2847 HG3 LYS 69 1HG LYS 69 20.590 6.813 2.959 2848 HD2 LYS 69 2HD LYS 69 22.848 5.711 3.135 2849 HD3 LYS 69 1HD LYS 69 22.226 4.329 2.161 2850 HE2 LYS 69 2HE LYS 69 21.719 6.009 0.266 2851 HE3 LYS 69 1HE LYS 69 22.664 7.244 1.189 2852 HZ1 LYS 69 3HZ LYS 69 24.642 5.964 0.873 2853 HZ2 LYS 69 1HZ LYS 69 23.787 5.905 -0.593 2854 HZ3 LYS 69 2HZ LYS 69 23.735 4.564 0.431 2855 H VAL 70 H VAL 70 18.597 5.871 6.549 2856 HA VAL 70 HA VAL 70 18.289 3.397 7.906 2857 HB VAL 70 HB VAL 70 17.719 6.259 8.845 2858 HG11 VAL 70 1HG1 VAL 70 16.506 4.608 10.288 2859 HG12 VAL 70 2HG1 VAL 70 17.936 5.261 11.158 2860 HG13 VAL 70 3HG1 VAL 70 18.001 3.610 10.434 2861 HG21 VAL 70 3HG2 VAL 70 20.001 5.958 9.942 2862 HG22 VAL 70 1HG2 VAL 70 20.104 5.905 8.153 2863 HG23 VAL 70 2HG2 VAL 70 20.175 4.379 9.102 2864 H ALA 71 H ALA 71 15.987 6.049 7.032 2865 HA ALA 71 HA ALA 71 13.702 4.881 8.020 2866 HB1 ALA 71 1HB ALA 71 13.915 6.630 5.486 2867 HB2 ALA 71 2HB ALA 71 13.850 7.266 7.167 2868 HB3 ALA 71 3HB ALA 71 12.436 6.378 6.488 2869 H GLU 72 H GLU 72 15.143 4.534 4.770 2870 HA GLU 72 HA GLU 72 13.210 3.187 3.426 2871 HB2 GLU 72 2HB GLU 72 15.481 4.032 2.518 2872 HB3 GLU 72 1HB GLU 72 16.231 2.594 3.268 2873 HG2 GLU 72 2HG GLU 72 14.538 1.212 1.770 2874 HG3 GLU 72 1HG GLU 72 14.248 2.768 0.911 2875 H GLN 73 H GLN 73 15.696 1.913 5.661 2876 HA GLN 73 HA GLN 73 15.163 -0.803 5.134 2877 HB2 GLN 73 2HB GLN 73 17.298 0.082 6.158 2878 HB3 GLN 73 1HB GLN 73 16.397 0.451 7.662 2879 HG2 GLN 73 2HG GLN 73 15.904 -2.007 7.966 2880 HG3 GLN 73 1HG GLN 73 16.772 -2.367 6.426 2881 HE21 GLN 73 1HE2 GLN 73 17.796 -3.700 8.620 2882 HE22 GLN 73 2HE2 GLN 73 19.195 -2.914 9.250 2883 H VAL 74 H VAL 74 13.825 1.544 7.497 2884 HA VAL 74 HA VAL 74 12.558 -0.380 9.112 2885 HB VAL 74 HB VAL 74 11.539 2.486 8.704 2886 HG11 VAL 74 1HG1 VAL 74 10.891 2.210 11.130 2887 HG12 VAL 74 2HG1 VAL 74 11.507 0.514 11.099 2888 HG13 VAL 74 3HG1 VAL 74 10.087 0.982 10.096 2889 HG21 VAL 74 3HG2 VAL 74 13.123 3.053 10.623 2890 HG22 VAL 74 1HG2 VAL 74 13.903 2.763 9.043 2891 HG23 VAL 74 2HG2 VAL 74 13.966 1.483 10.312 2892 H MET 75 H MET 75 11.412 1.650 6.376 2893 HA MET 75 HA MET 75 8.756 0.742 6.555 2894 HB2 MET 75 2HB MET 75 8.446 1.666 4.233 2895 HB3 MET 75 1HB MET 75 9.062 2.811 5.464 2896 HG2 MET 75 2HG MET 75 11.383 2.475 4.512 2897 HG3 MET 75 1HG MET 75 10.697 1.394 3.268 2898 HE1 MET 75 3HE MET 75 9.283 4.903 4.806 2899 HE2 MET 75 1HE MET 75 10.140 6.012 3.691 2900 HE3 MET 75 2HE MET 75 11.080 4.919 4.763 2901 H LYS 76 H LYS 76 11.586 -0.509 4.746 2902 HA LYS 76 HA LYS 76 10.102 -2.278 3.164 2903 HB2 LYS 76 2HB LYS 76 12.584 -1.639 2.831 2904 HB3 LYS 76 1HB LYS 76 12.963 -2.775 4.167 2905 HG2 LYS 76 2HG LYS 76 11.692 -4.585 2.755 2906 HG3 LYS 76 1HG LYS 76 11.698 -3.393 1.414 2907 HD2 LYS 76 2HD LYS 76 14.225 -3.368 1.507 2908 HD3 LYS 76 1HD LYS 76 14.160 -4.531 2.886 2909 HE2 LYS 76 2HE LYS 76 12.929 -6.186 1.339 2910 HE3 LYS 76 1HE LYS 76 13.246 -5.049 -0.032 2911 HZ1 LYS 76 3HZ LYS 76 14.889 -6.709 0.008 2912 HZ2 LYS 76 1HZ LYS 76 15.224 -6.466 1.677 2913 HZ3 LYS 76 2HZ LYS 76 15.649 -5.266 0.531 2914 H ALA 77 H ALA 77 11.556 -2.624 6.418 2915 HA ALA 77 HA ALA 77 11.063 -5.374 6.708 2916 HB1 ALA 77 1HB ALA 77 11.186 -3.185 8.886 2917 HB2 ALA 77 2HB ALA 77 12.599 -4.099 8.238 2918 HB3 ALA 77 3HB ALA 77 11.324 -4.965 9.165 2919 H GLY 78 H GLY 78 9.093 -2.474 7.380 2920 HA2 GLY 78 2HA GLY 78 6.996 -3.771 8.717 2921 HA3 GLY 78 1HA GLY 78 6.942 -2.198 7.832 2922 H ILE 79 H ILE 79 7.421 -2.973 5.250 2923 HA ILE 79 HA ILE 79 4.933 -3.882 4.421 2924 HB ILE 79 HB ILE 79 7.612 -3.742 2.962 2925 HG12 ILE 79 2HG1 ILE 79 5.123 -1.914 2.800 2926 HG13 ILE 79 1HG1 ILE 79 6.514 -1.586 3.863 2927 HG21 ILE 79 1HG2 ILE 79 4.790 -4.228 1.777 2928 HG22 ILE 79 2HG2 ILE 79 6.170 -5.388 1.741 2929 HG23 ILE 79 3HG2 ILE 79 6.269 -3.865 0.814 2930 HD11 ILE 79 3HD ILE 79 6.620 -1.740 0.776 2931 HD12 ILE 79 1HD ILE 79 6.726 -0.266 1.795 2932 HD13 ILE 79 2HD ILE 79 8.046 -1.492 1.859 2933 H GLU 80 H GLU 80 8.037 -5.672 4.813 2934 HA GLU 80 HA GLU 80 7.100 -8.040 3.649 2935 HB2 GLU 80 2HB GLU 80 9.571 -7.497 4.161 2936 HB3 GLU 80 1HB GLU 80 9.221 -7.892 5.873 2937 HG2 GLU 80 2HG GLU 80 8.474 -10.229 5.089 2938 HG3 GLU 80 1HG GLU 80 8.993 -9.785 3.424 2939 H VAL 81 H VAL 81 7.017 -6.859 7.034 2940 HA VAL 81 HA VAL 81 6.114 -9.236 8.190 2941 HB VAL 81 HB VAL 81 5.990 -6.304 8.991 2942 HG11 VAL 81 1HG1 VAL 81 5.275 -7.119 11.309 2943 HG12 VAL 81 2HG1 VAL 81 4.859 -8.707 10.576 2944 HG13 VAL 81 3HG1 VAL 81 3.983 -7.212 10.072 2945 HG21 VAL 81 3HG2 VAL 81 7.723 -7.072 10.619 2946 HG22 VAL 81 1HG2 VAL 81 8.200 -7.568 8.963 2947 HG23 VAL 81 2HG2 VAL 81 7.503 -8.778 10.096 2948 H PHE 82 H PHE 82 4.238 -6.418 6.902 2949 HA PHE 82 HA PHE 82 1.771 -7.635 7.649 2950 HB2 PHE 82 2HB PHE 82 2.300 -5.376 5.617 2951 HB3 PHE 82 1HB PHE 82 0.675 -5.847 6.250 2952 HD1 PHE 82 1HD PHE 82 0.866 -6.162 9.075 2953 HD2 PHE 82 2HD PHE 82 3.014 -3.380 6.585 2954 HE1 PHE 82 1HE PHE 82 1.201 -4.676 11.015 2955 HE2 PHE 82 2HE PHE 82 3.349 -1.906 8.522 2956 HZ PHE 82 HZ PHE 82 2.441 -2.540 10.748 2957 H ALA 83 H ALA 83 3.934 -8.307 5.112 2958 HA ALA 83 HA ALA 83 1.867 -9.405 3.381 2959 HB1 ALA 83 1HB ALA 83 3.702 -9.874 1.826 2960 HB2 ALA 83 2HB ALA 83 4.935 -9.517 3.098 2961 HB3 ALA 83 3HB ALA 83 3.903 -8.201 2.438 2962 H LEU 84 H LEU 84 4.360 -10.395 5.708 2963 HA LEU 84 HA LEU 84 4.565 -13.064 5.102 2964 HB2 LEU 84 2HB LEU 84 6.049 -11.632 6.561 2965 HB3 LEU 84 1HB LEU 84 4.866 -11.771 7.889 2966 HG LEU 84 HG LEU 84 6.059 -14.278 6.574 2967 HD11 LEU 84 1HD1 LEU 84 8.014 -14.198 8.110 2968 HD12 LEU 84 2HD1 LEU 84 7.503 -12.575 8.704 2969 HD13 LEU 84 3HD1 LEU 84 8.006 -12.793 6.986 2970 HD21 LEU 84 3HD2 LEU 84 4.310 -14.683 8.327 2971 HD22 LEU 84 1HD2 LEU 84 5.241 -13.683 9.502 2972 HD23 LEU 84 2HD2 LEU 84 5.920 -15.234 8.889 2973 H VAL 85 H VAL 85 2.162 -11.368 7.074 2974 HA VAL 85 HA VAL 85 1.061 -13.572 8.347 2975 HB VAL 85 HB VAL 85 -0.894 -12.200 8.807 2976 HG11 VAL 85 1HG1 VAL 85 1.319 -11.828 10.039 2977 HG12 VAL 85 2HG1 VAL 85 0.283 -10.361 9.966 2978 HG13 VAL 85 3HG1 VAL 85 1.707 -10.504 8.888 2979 HG21 VAL 85 3HG2 VAL 85 -1.035 -9.865 7.797 2980 HG22 VAL 85 1HG2 VAL 85 -1.271 -11.156 6.572 2981 HG23 VAL 85 2HG2 VAL 85 0.303 -10.294 6.679 2982 H THR 86 H THR 86 1.063 -12.994 5.001 2983 HA THR 86 HA THR 86 -1.423 -13.976 4.250 2984 HB THR 86 HB THR 86 1.217 -14.178 2.732 2985 HG1 THR 86 1HG THR 86 0.881 -12.106 3.063 2986 HG21 THR 86 3HG2 THR 86 -0.549 -15.607 1.660 2987 HG22 THR 86 1HG2 THR 86 -0.300 -14.116 0.696 2988 HG23 THR 86 2HG2 THR 86 -1.739 -14.252 1.771 2989 H ALA 87 H ALA 87 1.339 -15.667 5.630 2990 HA ALA 87 HA ALA 87 0.756 -18.255 4.727 2991 HB1 ALA 87 1HB ALA 87 1.875 -19.058 6.815 2992 HB2 ALA 87 2HB ALA 87 1.772 -17.396 7.513 2993 HB3 ALA 87 3HB ALA 87 2.808 -17.710 6.077 2994 H ALA 88 H ALA 88 -0.968 -16.142 6.937 2995 HA ALA 88 HA ALA 88 -2.668 -18.281 7.933 2996 HB1 ALA 88 1HB ALA 88 -2.838 -15.221 8.362 2997 HB2 ALA 88 2HB ALA 88 -2.112 -16.391 9.517 2998 HB3 ALA 88 3HB ALA 88 -3.871 -16.455 9.153 2999 H LEU 89 H LEU 89 -2.924 -15.249 5.994 3000 HA LEU 89 HA LEU 89 -5.575 -15.442 5.401 3001 HB2 LEU 89 2HB LEU 89 -3.461 -14.327 3.472 3002 HB3 LEU 89 1HB LEU 89 -5.204 -13.914 3.507 3003 HG LEU 89 HG LEU 89 -3.208 -13.314 5.784 3004 HD11 LEU 89 1HD1 LEU 89 -2.649 -12.039 3.720 3005 HD12 LEU 89 2HD1 LEU 89 -3.275 -10.967 5.017 3006 HD13 LEU 89 3HD1 LEU 89 -4.337 -11.418 3.633 3007 HD21 LEU 89 3HD2 LEU 89 -5.023 -11.804 6.644 3008 HD22 LEU 89 1HD2 LEU 89 -5.529 -13.527 6.649 3009 HD23 LEU 89 2HD2 LEU 89 -6.135 -12.418 5.366 3010 H ALA 90 H ALA 90 -2.872 -16.988 3.649 3011 HA ALA 90 HA ALA 90 -4.477 -17.791 1.464 3012 HB1 ALA 90 1HB ALA 90 -1.834 -18.976 2.485 3013 HB2 ALA 90 2HB ALA 90 -1.983 -17.605 1.328 3014 HB3 ALA 90 3HB ALA 90 -2.569 -19.238 0.852 3015 H THR 91 H THR 91 -4.134 -19.125 4.731 3016 HA THR 91 HA THR 91 -5.096 -21.727 3.863 3017 HB THR 91 HB THR 91 -5.390 -22.317 6.203 3018 HG1 THR 91 1HG THR 91 -4.776 -19.588 6.650 3019 HG21 THR 91 3HG2 THR 91 -2.646 -21.002 5.669 3020 HG22 THR 91 1HG2 THR 91 -3.189 -22.619 5.077 3021 HG23 THR 91 2HG2 THR 91 -2.992 -22.324 6.841 3022 H ASP 92 H ASP 92 -6.445 -18.585 4.452 3023 HA ASP 92 HA ASP 92 -8.749 -19.445 5.790 3024 HB2 ASP 92 2HB ASP 92 -7.750 -17.061 5.775 3025 HB3 ASP 92 1HB ASP 92 -8.525 -16.852 4.175 3026 H PHE 93 H PHE 93 -7.925 -19.042 2.342 3027 HA PHE 93 HA PHE 93 -10.608 -19.481 1.485 3028 HB2 PHE 93 2HB PHE 93 -9.967 -19.417 -0.707 3029 HB3 PHE 93 1HB PHE 93 -8.763 -18.349 0.066 3030 HD1 PHE 93 1HD PHE 93 -9.330 -21.616 -1.620 3031 HD2 PHE 93 2HD PHE 93 -6.394 -18.989 0.096 3032 HE1 PHE 93 1HE PHE 93 -7.538 -22.869 -2.768 3033 HE2 PHE 93 2HE PHE 93 -4.602 -20.257 -1.030 3034 HZ PHE 93 HZ PHE 93 -5.166 -22.191 -2.482 3035 H VAL 94 H VAL 94 -7.953 -21.547 2.439 3036 HA VAL 94 HA VAL 94 -8.738 -23.810 0.950 3037 HB VAL 94 HB VAL 94 -6.882 -23.586 3.369 3038 HG11 VAL 94 1HG1 VAL 94 -7.557 -25.969 3.009 3039 HG12 VAL 94 2HG1 VAL 94 -5.870 -25.724 2.444 3040 HG13 VAL 94 3HG1 VAL 94 -7.214 -25.825 1.248 3041 HG21 VAL 94 3HG2 VAL 94 -6.298 -23.599 0.321 3042 HG22 VAL 94 1HG2 VAL 94 -5.092 -23.434 1.649 3043 HG23 VAL 94 2HG2 VAL 94 -6.275 -22.131 1.341 3044 H ARG 95 H ARG 95 -9.618 -22.489 4.061 3045 HA ARG 95 HA ARG 95 -10.836 -24.672 5.288 3046 HB2 ARG 95 2HB ARG 95 -11.694 -21.705 5.128 3047 HB3 ARG 95 1HB ARG 95 -12.429 -22.890 6.247 3048 HG2 ARG 95 2HG ARG 95 -10.400 -23.145 7.516 3049 HG3 ARG 95 1HG ARG 95 -9.493 -22.036 6.415 3050 HD2 ARG 95 2HD ARG 95 -10.857 -20.136 6.985 3051 HD3 ARG 95 1HD ARG 95 -12.123 -21.142 7.771 3052 HE ARG 95 HE ARG 95 -10.536 -21.682 9.595 3053 HH11 ARG 95 1HH2 ARG 95 -10.255 -18.481 7.806 3054 HH12 ARG 95 2HH2 ARG 95 -9.890 -17.653 9.231 3055 HH21 ARG 95 1HH1 ARG 95 -9.925 -20.492 11.422 3056 HH22 ARG 95 2HH1 ARG 95 -9.474 -18.828 11.305 3057 H ARG 96 H ARG 96 -11.783 -23.110 2.280 3058 HA ARG 96 HA ARG 96 -14.581 -23.560 2.512 3059 HB2 ARG 96 2HB ARG 96 -13.442 -22.037 0.723 3060 HB3 ARG 96 1HB ARG 96 -12.943 -23.542 -0.106 3061 HG2 ARG 96 2HG ARG 96 -15.577 -24.121 -0.013 3062 HG3 ARG 96 1HG ARG 96 -15.760 -22.393 0.358 3063 HD2 ARG 96 2HD ARG 96 -16.171 -22.787 -2.015 3064 HD3 ARG 96 1HD ARG 96 -14.618 -21.851 -1.889 3065 HE ARG 96 HE ARG 96 -13.840 -24.577 -1.870 3066 HH11 ARG 96 1HH2 ARG 96 -16.020 -22.806 -4.223 3067 HH12 ARG 96 2HH2 ARG 96 -15.305 -23.580 -5.574 3068 HH21 ARG 96 1HH1 ARG 96 -13.295 -25.795 -3.595 3069 HH22 ARG 96 2HH1 ARG 96 -13.973 -25.609 -5.176 3070 H GLU 97 H GLU 97 -11.752 -25.466 1.561 3071 HA GLU 97 HA GLU 97 -13.365 -27.563 0.368 3072 HB2 GLU 97 2HB GLU 97 -10.344 -27.506 0.989 3073 HB3 GLU 97 1HB GLU 97 -11.183 -28.673 -0.091 3074 HG2 GLU 97 2HG GLU 97 -10.804 -25.633 -0.601 3075 HG3 GLU 97 1HG GLU 97 -9.864 -26.969 -1.347 3076 H GLU 98 H GLU 98 -12.834 -29.841 1.261 3077 HA GLU 98 HA GLU 98 -12.807 -31.325 2.823 3078 HB2 GLU 98 2HB GLU 98 -11.466 -29.401 4.775 3079 HB3 GLU 98 1HB GLU 98 -11.619 -31.182 4.925 3080 HG2 GLU 98 2HG GLU 98 -10.250 -31.431 2.782 3081 HG3 GLU 98 1HG GLU 98 -10.033 -29.637 2.764 3082 H GLU 99 H GLU 99 -13.881 -28.181 4.294 3083 HA GLU 99 HA GLU 99 -15.680 -29.480 6.013 3084 HB2 GLU 99 2HB GLU 99 -15.950 -26.599 4.995 3085 HB3 GLU 99 1HB GLU 99 -16.970 -27.404 6.235 3086 HG2 GLU 99 2HG GLU 99 -14.715 -27.859 7.529 3087 HG3 GLU 99 1HG GLU 99 -14.020 -26.603 6.440 3088 H ARG 100 H ARG 100 -16.143 -28.156 2.698 3089 HA ARG 100 HA ARG 100 -18.891 -28.848 2.670 3090 HB2 ARG 100 2HB ARG 100 -18.791 -28.371 0.236 3091 HB3 ARG 100 1HB ARG 100 -18.020 -27.083 1.215 3092 HG2 ARG 100 2HG ARG 100 -15.746 -28.109 0.727 3093 HG3 ARG 100 1HG ARG 100 -16.570 -29.308 -0.329 3094 HD2 ARG 100 2HD ARG 100 -17.418 -27.313 -1.761 3095 HD3 ARG 100 1HD ARG 100 -16.416 -26.235 -0.718 3096 HE ARG 100 HE ARG 100 -14.477 -27.006 -1.781 3097 HH11 ARG 100 1HH2 ARG 100 -17.215 -29.162 -2.866 3098 HH12 ARG 100 2HH2 ARG 100 -16.176 -30.211 -3.716 3099 HH21 ARG 100 1HH1 ARG 100 -13.159 -28.407 -3.151 3100 HH22 ARG 100 2HH1 ARG 100 -13.913 -29.791 -3.907 3101 H ARG 101 H ARG 101 -16.101 -30.890 2.468 3102 HA ARG 101 HA ARG 101 -17.612 -32.944 0.993 3103 HB2 ARG 101 2HB ARG 101 -15.868 -31.748 -0.468 3104 HB3 ARG 101 1HB ARG 101 -14.604 -32.345 0.657 3105 HG2 ARG 101 2HG ARG 101 -15.254 -34.712 0.086 3106 HG3 ARG 101 1HG ARG 101 -16.573 -34.094 -0.955 3107 HD2 ARG 101 2HD ARG 101 -14.722 -34.745 -2.421 3108 HD3 ARG 101 1HD ARG 101 -14.853 -32.952 -2.443 3109 HE ARG 101 HE ARG 101 -12.750 -32.787 -1.452 3110 HH11 ARG 101 1HH2 ARG 101 -13.824 -36.251 -1.204 3111 HH12 ARG 101 2HH2 ARG 101 -12.264 -36.848 -0.894 3112 HH21 ARG 101 1HH1 ARG 101 -10.586 -33.634 -1.065 3113 HH22 ARG 101 2HH1 ARG 101 -10.338 -35.312 -0.864 3114 H GLY 102 H GLY 102 -18.139 -33.742 3.200 3115 HA2 GLY 102 2HA GLY 102 -17.177 -35.794 4.222 3116 HA3 GLY 102 1HA GLY 102 -15.794 -34.727 4.697 3117 H HIS 103 H HIS 103 -17.589 -32.360 4.962 3118 HA HIS 103 HA HIS 103 -19.004 -33.096 7.443 3119 HB2 HIS 103 2HB HIS 103 -16.800 -32.103 8.051 3120 HB3 HIS 103 1HB HIS 103 -17.090 -30.723 6.970 3121 HD1 HIS 103 1HD HIS 103 -19.217 -29.007 7.868 3122 HD2 HIS 103 2HD HIS 103 -17.309 -31.568 10.649 3123 HE1 HIS 103 1HE HIS 103 -19.644 -28.099 10.119 3124 HE2 HIS 103 2HE HIS 103 -18.482 -29.597 11.798 Start of MODEL 3 1 H1 SER 1 H SER 1 -24.828 -13.792 -1.782 2 HA SER 1 HA SER 1 -24.596 -13.812 -4.645 3 HB2 SER 1 2HB SER 1 -22.102 -13.463 -4.088 4 HB3 SER 1 1HB SER 1 -23.192 -12.150 -3.545 5 HG SER 1 1HG SER 1 -21.639 -13.855 -2.081 6 H ALA 2 H ALA 2 -21.834 -15.372 -3.394 7 HA ALA 2 HA ALA 2 -23.069 -17.976 -3.870 8 HB1 ALA 2 1HB ALA 2 -20.952 -17.535 -5.150 9 HB2 ALA 2 2HB ALA 2 -20.858 -18.931 -4.019 10 HB3 ALA 2 3HB ALA 2 -20.085 -17.367 -3.586 11 H ASP 3 H ASP 3 -20.620 -16.516 -1.621 12 HA ASP 3 HA ASP 3 -22.069 -17.122 0.652 13 HB2 ASP 3 2HB ASP 3 -21.591 -19.612 0.186 14 HB3 ASP 3 1HB ASP 3 -19.841 -19.275 0.363 15 H HIS 4 H HIS 4 -18.734 -17.706 -0.330 16 HA HIS 4 HA HIS 4 -17.516 -16.441 1.744 17 HB2 HIS 4 2HB HIS 4 -15.419 -16.535 0.500 18 HB3 HIS 4 1HB HIS 4 -16.345 -18.036 0.214 19 HD1 HIS 4 1HD HIS 4 -17.743 -17.940 -2.330 20 HD2 HIS 4 2HD HIS 4 -14.870 -14.972 -1.622 21 HE1 HIS 4 1HE HIS 4 -17.430 -16.688 -4.465 22 HE2 HIS 4 2HE HIS 4 -15.631 -14.981 -4.092 23 H GLU 5 H GLU 5 -18.955 -14.792 -1.082 24 HA GLU 5 HA GLU 5 -17.345 -12.464 -0.795 25 HB2 GLU 5 2HB GLU 5 -20.142 -12.467 -2.046 26 HB3 GLU 5 1HB GLU 5 -18.763 -11.382 -2.346 27 HG2 GLU 5 2HG GLU 5 -18.900 -12.723 -4.292 28 HG3 GLU 5 1HG GLU 5 -17.529 -13.431 -3.372 29 H ARG 6 H ARG 6 -20.137 -13.829 0.880 30 HA ARG 6 HA ARG 6 -21.317 -11.371 1.656 31 HB2 ARG 6 2HB ARG 6 -22.513 -13.644 1.877 32 HB3 ARG 6 1HB ARG 6 -21.366 -14.045 3.188 33 HG2 ARG 6 2HG ARG 6 -22.290 -11.698 4.225 34 HG3 ARG 6 1HG ARG 6 -23.686 -12.050 3.178 35 HD2 ARG 6 2HD ARG 6 -22.479 -13.960 5.321 36 HD3 ARG 6 1HD ARG 6 -23.877 -12.870 5.609 37 HE ARG 6 HE ARG 6 -23.778 -15.326 3.871 38 HH11 ARG 6 1HH2 ARG 6 -25.873 -12.662 5.247 39 HH12 ARG 6 2HH2 ARG 6 -27.277 -13.645 5.219 40 HH21 ARG 6 1HH1 ARG 6 -25.638 -16.539 3.839 41 HH22 ARG 6 2HH1 ARG 6 -27.118 -16.009 4.537 42 H GLU 7 H GLU 7 -18.832 -13.548 3.001 43 HA GLU 7 HA GLU 7 -18.455 -12.299 5.461 44 HB2 GLU 7 2HB GLU 7 -17.554 -14.580 4.739 45 HB3 GLU 7 1HB GLU 7 -16.394 -13.748 3.666 46 HG2 GLU 7 2HG GLU 7 -15.227 -14.451 5.672 47 HG3 GLU 7 1HG GLU 7 -15.332 -12.655 5.714 48 H ALA 8 H ALA 8 -16.863 -11.864 2.301 49 HA ALA 8 HA ALA 8 -15.080 -9.843 3.075 50 HB1 ALA 8 1HB ALA 8 -14.906 -9.355 0.602 51 HB2 ALA 8 2HB ALA 8 -16.329 -10.415 0.303 52 HB3 ALA 8 3HB ALA 8 -14.793 -11.122 0.935 53 H GLN 9 H GLN 9 -18.392 -9.690 1.665 54 HA GLN 9 HA GLN 9 -18.543 -6.926 1.346 55 HB2 GLN 9 2HB GLN 9 -20.302 -8.542 0.444 56 HB3 GLN 9 1HB GLN 9 -20.814 -8.881 2.128 57 HG2 GLN 9 2HG GLN 9 -21.406 -6.353 2.347 58 HG3 GLN 9 1HG GLN 9 -21.081 -6.216 0.595 59 HE21 GLN 9 1HE2 GLN 9 -22.762 -6.836 -0.816 60 HE22 GLN 9 2HE2 GLN 9 -24.280 -7.501 -0.279 61 H LYS 10 H LYS 10 -19.369 -9.051 4.096 62 HA LYS 10 HA LYS 10 -20.543 -7.141 5.708 63 HB2 LYS 10 2HB LYS 10 -20.503 -9.753 5.967 64 HB3 LYS 10 1HB LYS 10 -18.876 -9.554 6.685 65 HG2 LYS 10 2HG LYS 10 -20.359 -9.730 8.543 66 HG3 LYS 10 1HG LYS 10 -20.001 -7.983 8.414 67 HD2 LYS 10 2HD LYS 10 -22.238 -7.929 6.914 68 HD3 LYS 10 1HD LYS 10 -22.543 -9.538 7.629 69 HE2 LYS 10 2HE LYS 10 -23.739 -7.800 8.907 70 HE3 LYS 10 1HE LYS 10 -22.421 -8.458 9.963 71 HZ1 LYS 10 3HZ LYS 10 -22.738 -5.999 9.866 72 HZ2 LYS 10 1HZ LYS 10 -22.147 -6.016 8.268 73 HZ3 LYS 10 2HZ LYS 10 -21.133 -6.547 9.581 74 H ALA 11 H ALA 11 -17.164 -8.079 5.258 75 HA ALA 11 HA ALA 11 -16.062 -6.787 7.446 76 HB1 ALA 11 1HB ALA 11 -14.847 -8.483 6.034 77 HB2 ALA 11 2HB ALA 11 -13.893 -6.982 6.304 78 HB3 ALA 11 3HB ALA 11 -14.716 -7.254 4.724 79 H GLU 12 H GLU 12 -17.085 -5.481 4.272 80 HA GLU 12 HA GLU 12 -15.579 -3.112 4.459 81 HB2 GLU 12 2HB GLU 12 -18.261 -3.467 2.987 82 HB3 GLU 12 1HB GLU 12 -17.050 -2.160 2.758 83 HG2 GLU 12 2HG GLU 12 -15.381 -4.136 2.152 84 HG3 GLU 12 1HG GLU 12 -16.872 -5.127 1.942 85 H GLU 13 H GLU 13 -18.646 -4.109 5.854 86 HA GLU 13 HA GLU 13 -19.543 -1.471 6.485 87 HB2 GLU 13 2HB GLU 13 -20.424 -4.140 7.723 88 HB3 GLU 13 1HB GLU 13 -21.365 -2.608 7.647 89 HG2 GLU 13 2HG GLU 13 -21.376 -2.829 5.092 90 HG3 GLU 13 1HG GLU 13 -20.529 -4.415 5.253 91 H GLU 14 H GLU 14 -17.446 -3.889 7.945 92 HA GLU 14 HA GLU 14 -17.550 -2.887 10.601 93 HB2 GLU 14 2HB GLU 14 -15.327 -4.502 9.217 94 HB3 GLU 14 1HB GLU 14 -15.435 -4.170 10.965 95 HG2 GLU 14 2HG GLU 14 -17.981 -5.365 10.037 96 HG3 GLU 14 1HG GLU 14 -16.616 -6.360 9.440 97 H LEU 15 H LEU 15 -15.553 -2.244 7.703 98 HA LEU 15 HA LEU 15 -13.631 -0.751 9.034 99 HB2 LEU 15 2HB LEU 15 -13.413 -1.670 6.706 100 HB3 LEU 15 1HB LEU 15 -14.544 -0.420 6.108 101 HG LEU 15 HG LEU 15 -12.941 1.356 6.590 102 HD11 LEU 15 1HD1 LEU 15 -10.641 0.861 7.571 103 HD12 LEU 15 2HD1 LEU 15 -11.229 -0.778 8.020 104 HD13 LEU 15 3HD1 LEU 15 -11.977 0.695 8.746 105 HD21 LEU 15 3HD2 LEU 15 -12.596 0.064 4.472 106 HD22 LEU 15 1HD2 LEU 15 -11.467 -1.053 5.322 107 HD23 LEU 15 2HD2 LEU 15 -11.032 0.677 5.113 108 H GLN 16 H GLN 16 -16.721 0.226 7.568 109 HA GLN 16 HA GLN 16 -16.381 2.987 7.869 110 HB2 GLN 16 2HB GLN 16 -18.979 1.352 7.878 111 HB3 GLN 16 1HB GLN 16 -18.877 3.139 7.698 112 HG2 GLN 16 2HG GLN 16 -17.563 2.899 5.596 113 HG3 GLN 16 1HG GLN 16 -17.603 1.105 5.733 114 HE21 GLN 16 1HE2 GLN 16 -19.299 0.126 4.635 115 HE22 GLN 16 2HE2 GLN 16 -20.807 0.887 4.229 116 H LYS 17 H LYS 17 -17.134 0.520 10.218 117 HA LYS 17 HA LYS 17 -18.440 2.155 12.119 118 HB2 LYS 17 2HB LYS 17 -18.208 -0.497 11.850 119 HB3 LYS 17 1HB LYS 17 -16.720 -0.296 12.817 120 HG2 LYS 17 2HG LYS 17 -18.191 0.855 14.609 121 HG3 LYS 17 1HG LYS 17 -19.621 0.368 13.641 122 HD2 LYS 17 2HD LYS 17 -17.507 -1.450 14.966 123 HD3 LYS 17 1HD LYS 17 -19.203 -1.239 15.487 124 HE2 LYS 17 2HE LYS 17 -18.240 -2.604 12.859 125 HE3 LYS 17 1HE LYS 17 -18.847 -3.424 14.342 126 HZ1 LYS 17 3HZ LYS 17 -20.465 -1.614 12.580 127 HZ2 LYS 17 1HZ LYS 17 -20.972 -2.433 14.028 128 HZ3 LYS 17 2HZ LYS 17 -20.512 -3.324 12.686 129 H VAL 18 H VAL 18 -15.061 1.209 11.457 130 HA VAL 18 HA VAL 18 -13.955 2.338 13.783 131 HB VAL 18 HB VAL 18 -12.579 1.781 11.095 132 HG11 VAL 18 1HG1 VAL 18 -10.539 1.498 12.553 133 HG12 VAL 18 2HG1 VAL 18 -11.500 1.981 13.998 134 HG13 VAL 18 3HG1 VAL 18 -11.193 3.163 12.670 135 HG21 VAL 18 3HG2 VAL 18 -13.777 -0.267 11.822 136 HG22 VAL 18 1HG2 VAL 18 -13.169 -0.073 13.509 137 HG23 VAL 18 2HG2 VAL 18 -12.036 -0.463 12.167 138 H LEU 19 H LEU 19 -14.545 3.536 10.455 139 HA LEU 19 HA LEU 19 -13.135 5.914 10.599 140 HB2 LEU 19 2HB LEU 19 -15.862 5.497 9.213 141 HB3 LEU 19 1HB LEU 19 -14.715 6.828 8.877 142 HG LEU 19 HG LEU 19 -14.227 3.839 8.338 143 HD11 LEU 19 1HD1 LEU 19 -14.448 4.417 5.951 144 HD12 LEU 19 2HD1 LEU 19 -14.732 6.146 6.356 145 HD13 LEU 19 3HD1 LEU 19 -15.945 4.907 6.830 146 HD21 LEU 19 3HD2 LEU 19 -12.056 4.927 8.808 147 HD22 LEU 19 1HD2 LEU 19 -12.474 6.286 7.696 148 HD23 LEU 19 2HD2 LEU 19 -12.228 4.633 7.041 149 H GLU 20 H GLU 20 -16.481 5.182 11.637 150 HA GLU 20 HA GLU 20 -17.149 7.863 12.243 151 HB2 GLU 20 2HB GLU 20 -18.364 5.194 13.161 152 HB3 GLU 20 1HB GLU 20 -19.143 6.788 13.430 153 HG2 GLU 20 2HG GLU 20 -18.461 5.836 10.574 154 HG3 GLU 20 1HG GLU 20 -19.932 5.267 11.432 155 H GLU 21 H GLU 21 -15.490 5.313 14.052 156 HA GLU 21 HA GLU 21 -15.865 6.781 16.556 157 HB2 GLU 21 2HB GLU 21 -14.212 4.267 15.968 158 HB3 GLU 21 1HB GLU 21 -14.420 5.067 17.574 159 HG2 GLU 21 2HG GLU 21 -16.937 4.727 17.352 160 HG3 GLU 21 1HG GLU 21 -16.642 3.729 15.882 161 H ALA 22 H ALA 22 -13.511 6.249 13.970 162 HA ALA 22 HA ALA 22 -11.294 7.416 15.165 163 HB1 ALA 22 1HB ALA 22 -12.031 7.368 12.168 164 HB2 ALA 22 2HB ALA 22 -11.164 6.055 13.043 165 HB3 ALA 22 3HB ALA 22 -10.398 7.676 12.854 166 H SER 23 H SER 23 -14.119 8.896 13.484 167 HA SER 23 HA SER 23 -12.871 11.383 13.072 168 HB2 SER 23 2HB SER 23 -15.306 12.207 12.884 169 HB3 SER 23 1HB SER 23 -14.847 10.847 11.800 170 HG SER 23 1HG SER 23 -16.878 10.793 13.264 171 H LYS 24 H LYS 24 -14.794 9.983 15.706 172 HA LYS 24 HA LYS 24 -14.931 12.300 17.312 173 HB2 LYS 24 2HB LYS 24 -16.362 10.267 17.786 174 HB3 LYS 24 1HB LYS 24 -14.885 9.358 18.242 175 HG2 LYS 24 2HG LYS 24 -14.465 11.095 20.085 176 HG3 LYS 24 1HG LYS 24 -16.051 11.826 19.701 177 HD2 LYS 24 2HD LYS 24 -15.595 8.896 20.595 178 HD3 LYS 24 1HD LYS 24 -15.903 10.276 21.707 179 HE2 LYS 24 2HE LYS 24 -18.131 10.692 20.567 180 HE3 LYS 24 1HE LYS 24 -17.858 9.218 19.552 181 HZ1 LYS 24 3HZ LYS 24 -19.259 8.829 21.527 182 HZ2 LYS 24 1HZ LYS 24 -17.980 9.233 22.536 183 HZ3 LYS 24 2HZ LYS 24 -17.890 7.864 21.536 184 H LYS 25 H LYS 25 -12.642 9.515 17.202 185 HA LYS 25 HA LYS 25 -11.056 10.532 19.285 186 HB2 LYS 25 2HB LYS 25 -10.264 8.603 17.032 187 HB3 LYS 25 1HB LYS 25 -9.221 9.002 18.435 188 HG2 LYS 25 2HG LYS 25 -11.959 7.595 18.569 189 HG3 LYS 25 1HG LYS 25 -10.344 6.842 18.774 190 HD2 LYS 25 2HD LYS 25 -9.971 8.334 20.818 191 HD3 LYS 25 1HD LYS 25 -11.654 8.944 20.610 192 HE2 LYS 25 2HE LYS 25 -12.464 6.504 20.786 193 HE3 LYS 25 1HE LYS 25 -10.790 6.051 21.293 194 HZ1 LYS 25 3HZ LYS 25 -12.390 6.440 23.093 195 HZ2 LYS 25 1HZ LYS 25 -12.495 8.096 22.647 196 HZ3 LYS 25 2HZ LYS 25 -11.042 7.484 23.238 197 H ALA 26 H ALA 26 -10.833 11.086 15.740 198 HA ALA 26 HA ALA 26 -8.382 12.376 15.803 199 HB1 ALA 26 1HB ALA 26 -9.525 11.660 13.683 200 HB2 ALA 26 2HB ALA 26 -9.089 13.402 13.626 201 HB3 ALA 26 3HB ALA 26 -10.794 12.906 13.944 202 H VAL 27 H VAL 27 -11.724 13.804 16.049 203 HA VAL 27 HA VAL 27 -10.611 16.398 16.244 204 HB VAL 27 HB VAL 27 -12.883 15.945 15.372 205 HG11 VAL 27 1HG1 VAL 27 -13.718 14.335 17.081 206 HG12 VAL 27 2HG1 VAL 27 -14.794 15.775 16.977 207 HG13 VAL 27 3HG1 VAL 27 -13.665 15.613 18.352 208 HG21 VAL 27 3HG2 VAL 27 -12.651 18.020 17.645 209 HG22 VAL 27 1HG2 VAL 27 -13.813 18.064 16.264 210 HG23 VAL 27 2HG2 VAL 27 -12.041 18.205 15.959 211 H GLU 28 H GLU 28 -11.680 13.981 18.747 212 HA GLU 28 HA GLU 28 -11.205 15.889 20.824 213 HB2 GLU 28 2HB GLU 28 -11.439 12.842 21.089 214 HB3 GLU 28 1HB GLU 28 -11.405 14.049 22.420 215 HG2 GLU 28 2HG GLU 28 -13.495 15.124 21.213 216 HG3 GLU 28 1HG GLU 28 -13.631 13.555 20.346 217 H ALA 29 H ALA 29 -9.130 13.753 19.007 218 HA ALA 29 HA ALA 29 -7.009 13.663 20.897 219 HB1 ALA 29 1HB ALA 29 -7.075 13.298 17.826 220 HB2 ALA 29 2HB ALA 29 -7.054 11.986 19.061 221 HB3 ALA 29 3HB ALA 29 -5.632 13.025 18.832 222 H GLU 30 H GLU 30 -7.747 15.598 17.924 223 HA GLU 30 HA GLU 30 -5.583 17.296 18.003 224 HB2 GLU 30 2HB GLU 30 -7.239 17.343 16.139 225 HB3 GLU 30 1HB GLU 30 -8.474 18.098 17.177 226 HG2 GLU 30 2HG GLU 30 -5.739 19.415 16.637 227 HG3 GLU 30 1HG GLU 30 -7.102 19.577 15.500 228 H ARG 31 H ARG 31 -8.787 17.598 19.519 229 HA ARG 31 HA ARG 31 -8.516 20.235 20.264 230 HB2 ARG 31 2HB ARG 31 -10.247 17.979 21.399 231 HB3 ARG 31 1HB ARG 31 -10.370 19.635 22.065 232 HG2 ARG 31 2HG ARG 31 -10.794 19.008 19.086 233 HG3 ARG 31 1HG ARG 31 -12.126 19.013 20.292 234 HD2 ARG 31 2HD ARG 31 -10.238 21.348 19.582 235 HD3 ARG 31 1HD ARG 31 -11.947 21.183 18.992 236 HE ARG 31 HE ARG 31 -12.191 21.001 21.774 237 HH11 ARG 31 1HH2 ARG 31 -10.670 23.453 19.567 238 HH12 ARG 31 2HH2 ARG 31 -10.965 24.774 20.604 239 HH21 ARG 31 1HH1 ARG 31 -12.237 22.656 23.292 240 HH22 ARG 31 2HH1 ARG 31 -11.546 24.192 23.030 241 H GLY 32 H GLY 32 -6.402 20.487 21.169 242 HA2 GLY 32 2HA GLY 32 -5.895 21.237 23.479 243 HA3 GLY 32 1HA GLY 32 -6.120 19.501 23.931 244 H ALA 33 H ALA 33 -4.883 19.549 20.792 245 HA ALA 33 HA ALA 33 -2.243 18.941 21.788 246 HB1 ALA 33 1HB ALA 33 -3.506 18.702 19.000 247 HB2 ALA 33 2HB ALA 33 -3.336 17.385 20.205 248 HB3 ALA 33 3HB ALA 33 -1.867 18.117 19.451 249 HA PRO 34 HA PRO 34 -1.172 23.016 20.069 250 HB2 PRO 34 2HB PRO 34 1.539 23.118 20.735 251 HB3 PRO 34 1HB PRO 34 0.239 23.314 21.969 252 HG2 PRO 34 2HG PRO 34 1.796 20.767 21.276 253 HG3 PRO 34 1HG PRO 34 1.470 21.462 22.918 254 HD2 PRO 34 2HD PRO 34 -0.071 19.433 21.772 255 HD3 PRO 34 1HD PRO 34 -0.821 20.694 22.859 256 H GLY 35 H GLY 35 -0.229 23.705 18.017 257 HA2 GLY 35 2HA GLY 35 1.102 23.523 16.240 258 HA3 GLY 35 1HA GLY 35 1.675 21.900 16.767 259 H ALA 36 H ALA 36 -1.379 21.333 17.069 260 HA ALA 36 HA ALA 36 -1.477 19.774 14.763 261 HB1 ALA 36 1HB ALA 36 -2.452 19.153 17.001 262 HB2 ALA 36 2HB ALA 36 -3.651 18.984 15.694 263 HB3 ALA 36 3HB ALA 36 -3.713 20.416 16.801 264 H ALA 37 H ALA 37 -3.414 19.581 13.310 265 HA ALA 37 HA ALA 37 -4.523 22.233 12.582 266 HB1 ALA 37 1HB ALA 37 -2.600 21.616 11.070 267 HB2 ALA 37 2HB ALA 37 -4.161 21.613 10.174 268 HB3 ALA 37 3HB ALA 37 -3.409 20.056 10.693 269 H LEU 38 H LEU 38 -5.467 19.258 13.724 270 HA LEU 38 HA LEU 38 -7.329 18.584 11.609 271 HB2 LEU 38 2HB LEU 38 -5.656 17.092 13.135 272 HB3 LEU 38 1HB LEU 38 -7.082 16.987 14.175 273 HG LEU 38 HG LEU 38 -6.872 16.155 11.222 274 HD11 LEU 38 1HD1 LEU 38 -7.007 14.469 13.792 275 HD12 LEU 38 2HD1 LEU 38 -5.556 14.740 12.773 276 HD13 LEU 38 3HD1 LEU 38 -6.956 13.830 12.102 277 HD21 LEU 38 3HD2 LEU 38 -9.233 16.814 11.668 278 HD22 LEU 38 1HD2 LEU 38 -9.252 15.791 13.148 279 HD23 LEU 38 2HD2 LEU 38 -9.092 15.024 11.521 280 H ILE 39 H ILE 39 -8.276 20.955 12.559 281 HA ILE 39 HA ILE 39 -9.925 20.606 14.882 282 HB ILE 39 HB ILE 39 -10.598 22.971 14.404 283 HG12 ILE 39 2HG1 ILE 39 -8.772 22.699 11.908 284 HG13 ILE 39 1HG1 ILE 39 -10.557 22.860 11.875 285 HG21 ILE 39 1HG2 ILE 39 -8.537 22.393 15.701 286 HG22 ILE 39 2HG2 ILE 39 -8.358 23.947 14.841 287 HG23 ILE 39 3HG2 ILE 39 -7.544 22.470 14.207 288 HD11 ILE 39 3HD ILE 39 -8.550 24.979 12.890 289 HD12 ILE 39 1HD ILE 39 -9.544 25.037 11.395 290 HD13 ILE 39 2HD ILE 39 -10.345 25.124 13.007 291 H SER 40 H SER 40 -12.298 21.088 14.831 292 HA SER 40 HA SER 40 -14.313 21.377 14.033 293 HB2 SER 40 2HB SER 40 -13.445 22.763 12.189 294 HB3 SER 40 1HB SER 40 -13.079 21.301 11.232 295 HG SER 40 1HG SER 40 -14.832 21.617 10.396 296 H TYR 41 H TYR 41 -15.998 19.881 14.094 297 HA TYR 41 HA TYR 41 -15.295 17.166 13.748 298 HB2 TYR 41 2HB TYR 41 -17.016 17.756 15.462 299 HB3 TYR 41 1HB TYR 41 -18.159 18.215 14.141 300 HD1 TYR 41 1HD TYR 41 -15.913 15.365 15.232 301 HD2 TYR 41 2HD TYR 41 -19.537 16.494 13.206 302 HE1 TYR 41 1HE TYR 41 -16.412 13.002 14.824 303 HE2 TYR 41 2HE TYR 41 -20.018 14.133 12.749 304 HH TYR 41 HH TYR 41 -19.299 11.952 12.978 305 HA PRO 42 HA PRO 42 -17.910 17.033 9.900 306 HB2 PRO 42 2HB PRO 42 -18.202 19.353 8.257 307 HB3 PRO 42 1HB PRO 42 -19.415 18.749 9.448 308 HG2 PRO 42 2HG PRO 42 -17.261 20.884 9.871 309 HG3 PRO 42 1HG PRO 42 -19.017 20.963 10.319 310 HD2 PRO 42 2HD PRO 42 -17.133 20.321 12.173 311 HD3 PRO 42 1HD PRO 42 -18.683 19.358 12.136 312 H ASP 43 H ASP 43 -15.008 18.824 10.254 313 HA ASP 43 HA ASP 43 -13.919 18.222 7.644 314 HB2 ASP 43 2HB ASP 43 -12.701 19.319 10.275 315 HB3 ASP 43 1HB ASP 43 -11.728 18.958 8.819 316 H ALA 44 H ALA 44 -13.532 17.260 11.092 317 HA ALA 44 HA ALA 44 -11.523 15.457 10.804 318 HB1 ALA 44 1HB ALA 44 -12.271 14.470 12.984 319 HB2 ALA 44 2HB ALA 44 -13.854 15.321 12.818 320 HB3 ALA 44 3HB ALA 44 -12.332 16.266 13.024 321 H ILE 45 H ILE 45 -15.029 14.869 10.390 322 HA ILE 45 HA ILE 45 -14.710 12.069 10.180 323 HB ILE 45 HB ILE 45 -16.841 12.985 10.832 324 HG12 ILE 45 2HG1 ILE 45 -18.424 11.835 9.309 325 HG13 ILE 45 1HG1 ILE 45 -17.129 11.597 8.093 326 HG21 ILE 45 1HG2 ILE 45 -16.964 14.291 8.035 327 HG22 ILE 45 2HG2 ILE 45 -16.758 15.131 9.613 328 HG23 ILE 45 3HG2 ILE 45 -18.282 14.259 9.258 329 HD11 ILE 45 3HD ILE 45 -17.167 10.420 10.959 330 HD12 ILE 45 1HD ILE 45 -17.522 9.517 9.458 331 HD13 ILE 45 2HD ILE 45 -15.865 10.144 9.736 332 H TRP 46 H TRP 46 -14.208 14.649 7.841 333 HA TRP 46 HA TRP 46 -14.362 12.814 5.606 334 HB2 TRP 46 2HB TRP 46 -14.258 15.715 5.969 335 HB3 TRP 46 1HB TRP 46 -12.926 15.233 4.891 336 HD1 TRP 46 HD TRP 46 -13.736 15.875 2.563 337 HE1 TRP 46 1HE TRP 46 -16.019 15.987 1.361 338 HE3 TRP 46 3HE TRP 46 -16.616 13.427 5.999 339 HZ2 TRP 46 2HZ TRP 46 -18.539 14.646 1.548 340 HZ3 TRP 46 3HZ TRP 46 -18.919 12.799 5.410 341 HH2 TRP 46 HH TRP 46 -19.883 13.415 3.219 342 H TRP 47 H TRP 47 -11.918 14.191 7.789 343 HA TRP 47 HA TRP 47 -9.677 13.259 6.354 344 HB2 TRP 47 2HB TRP 47 -9.437 14.947 8.169 345 HB3 TRP 47 1HB TRP 47 -9.995 13.737 9.378 346 HD1 TRP 47 HD TRP 47 -6.896 14.299 6.982 347 HE1 TRP 47 1HE TRP 47 -4.904 12.985 7.969 348 HE3 TRP 47 3HE TRP 47 -9.327 11.975 10.810 349 HZ2 TRP 47 2HZ TRP 47 -4.421 11.226 10.150 350 HZ3 TRP 47 3HZ TRP 47 -8.072 10.419 12.269 351 HH2 TRP 47 HH TRP 47 -5.648 10.061 11.947 352 H SER 48 H SER 48 -11.854 11.654 8.762 353 HA SER 48 HA SER 48 -10.361 9.384 9.140 354 HB2 SER 48 2HB SER 48 -13.426 9.478 8.750 355 HB3 SER 48 1HB SER 48 -12.496 8.129 9.503 356 HG SER 48 1HG SER 48 -13.294 9.370 11.094 357 H VAL 49 H VAL 49 -12.320 10.291 6.266 358 HA VAL 49 HA VAL 49 -12.112 7.593 5.231 359 HB VAL 49 HB VAL 49 -13.358 9.922 3.740 360 HG11 VAL 49 1HG1 VAL 49 -14.735 8.042 2.785 361 HG12 VAL 49 2HG1 VAL 49 -13.873 6.854 3.829 362 HG13 VAL 49 3HG1 VAL 49 -12.991 7.737 2.527 363 HG21 VAL 49 3HG2 VAL 49 -14.419 10.057 5.926 364 HG22 VAL 49 1HG2 VAL 49 -14.577 8.265 6.050 365 HG23 VAL 49 2HG2 VAL 49 -15.546 9.189 4.842 366 H GLU 50 H GLU 50 -9.610 8.254 5.468 367 HA GLU 50 HA GLU 50 -8.892 8.036 2.742 368 HB2 GLU 50 2HB GLU 50 -7.150 9.666 2.445 369 HB3 GLU 50 1HB GLU 50 -8.699 10.503 2.754 370 HG2 GLU 50 2HG GLU 50 -7.964 11.043 5.089 371 HG3 GLU 50 1HG GLU 50 -6.408 10.171 4.810 372 H THR 51 H THR 51 -7.934 8.320 6.161 373 HA THR 51 HA THR 51 -5.478 7.067 5.861 374 HB THR 51 HB THR 51 -5.770 8.467 7.714 375 HG1 THR 51 1HG THR 51 -4.582 6.867 8.481 376 HG21 THR 51 3HG2 THR 51 -7.534 8.038 9.492 377 HG22 THR 51 1HG2 THR 51 -8.293 6.825 8.399 378 HG23 THR 51 2HG2 THR 51 -8.197 8.566 7.924 379 H ALA 52 H ALA 52 -8.734 5.688 6.252 380 HA ALA 52 HA ALA 52 -7.884 3.081 6.870 381 HB1 ALA 52 1HB ALA 52 -10.231 3.788 7.225 382 HB2 ALA 52 2HB ALA 52 -10.175 2.374 6.121 383 HB3 ALA 52 3HB ALA 52 -10.451 4.020 5.443 384 H THR 53 H THR 53 -7.902 4.819 3.788 385 HA THR 53 HA THR 53 -7.640 2.343 2.301 386 HB THR 53 HB THR 53 -7.288 4.304 0.434 387 HG1 THR 53 1HG THR 53 -7.554 5.973 2.010 388 HG21 THR 53 3HG2 THR 53 -9.751 4.058 0.036 389 HG22 THR 53 1HG2 THR 53 -9.963 3.361 1.688 390 HG23 THR 53 2HG2 THR 53 -9.000 2.472 0.448 391 H THR 54 H THR 54 -5.641 3.916 4.318 392 HA THR 54 HA THR 54 -3.527 4.296 4.532 393 HB THR 54 HB THR 54 -2.031 2.379 4.042 394 HG1 THR 54 1HG THR 54 -3.113 1.813 2.100 395 HG21 THR 54 3HG2 THR 54 -3.565 2.524 6.060 396 HG22 THR 54 1HG2 THR 54 -3.281 0.828 5.533 397 HG23 THR 54 2HG2 THR 54 -4.844 1.637 5.154 398 H VAL 55 H VAL 55 -4.279 5.990 2.644 399 HA VAL 55 HA VAL 55 -2.150 5.895 0.615 400 HB VAL 55 HB VAL 55 -3.501 8.065 -0.141 401 HG11 VAL 55 1HG1 VAL 55 -4.726 6.543 -1.718 402 HG12 VAL 55 2HG1 VAL 55 -4.405 5.144 -0.619 403 HG13 VAL 55 3HG1 VAL 55 -3.036 5.995 -1.425 404 HG21 VAL 55 3HG2 VAL 55 -5.195 7.914 1.847 405 HG22 VAL 55 1HG2 VAL 55 -5.752 6.347 1.148 406 HG23 VAL 55 2HG2 VAL 55 -5.941 7.873 0.233 407 H GLY 56 H GLY 56 -3.804 8.420 2.599 408 HA2 GLY 56 2HA GLY 56 -2.857 9.751 4.194 409 HA3 GLY 56 1HA GLY 56 -1.223 9.066 3.807 410 H TYR 57 H TYR 57 -3.893 11.215 2.491 411 HA TYR 57 HA TYR 57 -2.161 11.884 0.277 412 HB2 TYR 57 2HB TYR 57 -5.025 12.004 0.851 413 HB3 TYR 57 1HB TYR 57 -4.512 13.694 0.573 414 HD1 TYR 57 1HD TYR 57 -3.110 14.202 -1.524 415 HD2 TYR 57 2HD TYR 57 -5.193 10.481 -0.973 416 HE1 TYR 57 1HE TYR 57 -3.019 13.794 -3.948 417 HE2 TYR 57 2HE TYR 57 -5.108 10.071 -3.389 418 HH TYR 57 HH TYR 57 -3.880 12.547 -5.684 419 H GLY 58 H GLY 58 -2.781 12.948 3.451 420 HA2 GLY 58 2HA GLY 58 -1.403 14.308 4.636 421 HA3 GLY 58 1HA GLY 58 -0.727 14.982 3.101 422 H ASP 59 H ASP 59 -4.160 14.657 4.070 423 HA ASP 59 HA ASP 59 -4.696 17.392 3.518 424 HB2 ASP 59 2HB ASP 59 -6.420 15.520 3.382 425 HB3 ASP 59 1HB ASP 59 -6.391 15.414 5.170 426 H ARG 60 H ARG 60 -4.147 15.451 6.543 427 HA ARG 60 HA ARG 60 -3.717 17.956 7.970 428 HB2 ARG 60 2HB ARG 60 -5.219 15.563 9.196 429 HB3 ARG 60 1HB ARG 60 -4.868 17.132 9.996 430 HG2 ARG 60 2HG ARG 60 -6.714 16.694 7.560 431 HG3 ARG 60 1HG ARG 60 -7.286 16.797 9.248 432 HD2 ARG 60 2HD ARG 60 -6.661 19.163 9.434 433 HD3 ARG 60 1HD ARG 60 -5.763 19.114 7.874 434 HE ARG 60 HE ARG 60 -7.904 18.489 6.741 435 HH11 ARG 60 1HH2 ARG 60 -8.204 20.198 9.930 436 HH12 ARG 60 2HH2 ARG 60 -9.815 20.711 9.627 437 HH21 ARG 60 1HH1 ARG 60 -9.861 19.722 6.181 438 HH22 ARG 60 2HH1 ARG 60 -10.778 20.512 7.412 439 H TYR 61 H TYR 61 -2.380 17.385 10.054 440 HA TYR 61 HA TYR 61 -1.129 14.838 9.885 441 HB2 TYR 61 2HB TYR 61 1.140 15.888 10.491 442 HB3 TYR 61 1HB TYR 61 0.667 15.944 8.757 443 HD1 TYR 61 1HD TYR 61 -0.211 18.051 7.763 444 HD2 TYR 61 2HD TYR 61 1.447 17.955 11.731 445 HE1 TYR 61 1HE TYR 61 0.019 20.480 7.712 446 HE2 TYR 61 2HE TYR 61 1.722 20.393 11.688 447 HH TYR 61 HH TYR 61 1.217 22.337 10.533 448 HA PRO 62 HA PRO 62 -2.066 16.160 14.128 449 HB2 PRO 62 2HB PRO 62 -1.725 13.743 15.424 450 HB3 PRO 62 1HB PRO 62 -3.085 13.972 14.267 451 HG2 PRO 62 2HG PRO 62 -0.363 12.625 13.745 452 HG3 PRO 62 1HG PRO 62 -2.007 12.021 13.292 453 HD2 PRO 62 2HD PRO 62 -0.261 13.525 11.636 454 HD3 PRO 62 1HD PRO 62 -2.073 13.448 11.397 455 H VAL 63 H VAL 63 -0.800 16.012 16.246 456 HA VAL 63 HA VAL 63 2.104 15.557 15.791 457 HB VAL 63 HB VAL 63 2.502 17.081 17.750 458 HG11 VAL 63 1HG1 VAL 63 2.726 17.818 15.373 459 HG12 VAL 63 2HG1 VAL 63 2.122 19.151 16.431 460 HG13 VAL 63 3HG1 VAL 63 0.987 18.275 15.342 461 HG21 VAL 63 3HG2 VAL 63 0.007 16.793 18.644 462 HG22 VAL 63 1HG2 VAL 63 -0.446 17.934 17.337 463 HG23 VAL 63 2HG2 VAL 63 0.691 18.450 18.627 464 H THR 64 H THR 64 2.182 15.740 18.936 465 HA THR 64 HA THR 64 2.295 12.907 19.069 466 HB THR 64 HB THR 64 3.618 13.523 21.184 467 HG1 THR 64 1HG THR 64 3.932 15.594 21.611 468 HG21 THR 64 3HG2 THR 64 5.541 14.461 19.876 469 HG22 THR 64 1HG2 THR 64 4.445 14.949 18.536 470 HG23 THR 64 2HG2 THR 64 4.708 13.213 18.894 471 H GLU 65 H GLU 65 0.748 15.571 20.780 472 HA GLU 65 HA GLU 65 -0.216 14.263 23.001 473 HB2 GLU 65 2HB GLU 65 0.031 16.789 22.590 474 HB3 GLU 65 1HB GLU 65 -1.411 16.693 21.534 475 HG2 GLU 65 2HG GLU 65 -2.111 17.598 23.650 476 HG3 GLU 65 1HG GLU 65 -2.776 15.933 23.572 477 H GLU 66 H GLU 66 -1.468 14.585 19.762 478 HA GLU 66 HA GLU 66 -4.096 13.847 20.125 479 HB2 GLU 66 2HB GLU 66 -2.212 13.571 17.690 480 HB3 GLU 66 1HB GLU 66 -4.008 13.526 17.626 481 HG2 GLU 66 2HG GLU 66 -4.061 15.814 18.738 482 HG3 GLU 66 1HG GLU 66 -2.271 15.893 18.611 483 H GLY 67 H GLY 67 -1.132 12.077 20.130 484 HA2 GLY 67 2HA GLY 67 -0.728 9.947 20.682 485 HA3 GLY 67 1HA GLY 67 -2.523 9.602 20.681 486 H ARG 68 H ARG 68 0.366 10.126 18.580 487 HA ARG 68 HA ARG 68 -0.783 10.092 16.165 488 HB2 ARG 68 2HB ARG 68 1.277 9.538 15.200 489 HB3 ARG 68 1HB ARG 68 1.681 10.409 16.692 490 HG2 ARG 68 2HG ARG 68 1.979 7.415 16.024 491 HG3 ARG 68 1HG ARG 68 3.235 8.650 16.335 492 HD2 ARG 68 2HD ARG 68 2.285 8.711 18.808 493 HD3 ARG 68 1HD ARG 68 1.427 7.182 18.366 494 HE ARG 68 HE ARG 68 4.214 7.039 17.630 495 HH11 ARG 68 1HH2 ARG 68 2.180 7.103 20.607 496 HH12 ARG 68 2HH2 ARG 68 3.201 6.102 21.519 497 HH21 ARG 68 1HH1 ARG 68 5.728 5.739 19.026 498 HH22 ARG 68 2HH1 ARG 68 5.143 5.102 20.489 499 H LYS 69 H LYS 69 -0.838 7.498 18.340 500 HA LYS 69 HA LYS 69 -1.081 5.300 16.609 501 HB2 LYS 69 2HB LYS 69 -2.241 5.674 19.437 502 HB3 LYS 69 1HB LYS 69 -2.204 4.153 18.489 503 HG2 LYS 69 2HG LYS 69 0.374 4.434 18.376 504 HG3 LYS 69 1HG LYS 69 0.199 5.693 19.649 505 HD2 LYS 69 2HD LYS 69 0.817 3.551 20.632 506 HD3 LYS 69 1HD LYS 69 -0.861 3.946 21.167 507 HE2 LYS 69 2HE LYS 69 -1.821 2.288 19.601 508 HE3 LYS 69 1HE LYS 69 -0.254 2.147 18.734 509 HZ1 LYS 69 3HZ LYS 69 0.591 1.275 21.028 510 HZ2 LYS 69 1HZ LYS 69 -0.251 0.316 19.924 511 HZ3 LYS 69 2HZ LYS 69 -1.074 0.953 21.286 512 H VAL 70 H VAL 70 -3.235 8.010 17.238 513 HA VAL 70 HA VAL 70 -5.665 6.656 16.883 514 HB VAL 70 HB VAL 70 -4.839 9.554 16.407 515 HG11 VAL 70 1HG1 VAL 70 -7.323 10.054 16.294 516 HG12 VAL 70 2HG1 VAL 70 -7.660 8.285 16.166 517 HG13 VAL 70 3HG1 VAL 70 -6.747 9.137 14.866 518 HG21 VAL 70 3HG2 VAL 70 -6.148 9.902 18.501 519 HG22 VAL 70 1HG2 VAL 70 -4.880 8.672 18.796 520 HG23 VAL 70 2HG2 VAL 70 -6.590 8.153 18.555 521 H ALA 71 H ALA 71 -3.321 8.086 14.525 522 HA ALA 71 HA ALA 71 -4.970 7.433 12.289 523 HB1 ALA 71 1HB ALA 71 -1.933 7.953 12.473 524 HB2 ALA 71 2HB ALA 71 -3.181 9.194 12.122 525 HB3 ALA 71 3HB ALA 71 -2.888 7.866 10.951 526 H GLU 72 H GLU 72 -2.157 5.948 13.923 527 HA GLU 72 HA GLU 72 -1.608 3.809 12.348 528 HB2 GLU 72 2HB GLU 72 -0.427 4.396 14.582 529 HB3 GLU 72 1HB GLU 72 -1.799 3.597 15.410 530 HG2 GLU 72 2HG GLU 72 -1.090 1.489 13.874 531 HG3 GLU 72 1HG GLU 72 0.471 2.376 13.770 532 H GLN 73 H GLN 73 -4.119 4.018 14.865 533 HA GLN 73 HA GLN 73 -4.919 1.373 14.754 534 HB2 GLN 73 2HB GLN 73 -5.370 3.114 16.585 535 HB3 GLN 73 1HB GLN 73 -6.681 3.767 15.553 536 HG2 GLN 73 2HG GLN 73 -7.822 1.486 15.675 537 HG3 GLN 73 1HG GLN 73 -6.467 0.889 16.699 538 HE21 GLN 73 1HE2 GLN 73 -9.593 1.995 16.960 539 HE22 GLN 73 2HE2 GLN 73 -9.535 2.721 18.529 540 H VAL 74 H VAL 74 -6.036 4.207 12.813 541 HA VAL 74 HA VAL 74 -8.318 2.783 11.841 542 HB VAL 74 HB VAL 74 -7.044 5.260 10.578 543 HG11 VAL 74 1HG1 VAL 74 -8.693 4.103 9.103 544 HG12 VAL 74 2HG1 VAL 74 -9.448 5.588 9.778 545 HG13 VAL 74 3HG1 VAL 74 -9.876 3.976 10.459 546 HG21 VAL 74 3HG2 VAL 74 -9.177 5.001 12.812 547 HG22 VAL 74 1HG2 VAL 74 -8.724 6.525 11.948 548 HG23 VAL 74 2HG2 VAL 74 -7.529 5.697 12.982 549 H MET 75 H MET 75 -5.019 3.507 10.664 550 HA MET 75 HA MET 75 -5.309 2.351 8.139 551 HB2 MET 75 2HB MET 75 -2.825 2.566 9.945 552 HB3 MET 75 1HB MET 75 -2.792 2.072 8.213 553 HG2 MET 75 2HG MET 75 -3.954 4.229 7.617 554 HG3 MET 75 1HG MET 75 -3.785 4.781 9.303 555 HE1 MET 75 3HE MET 75 -0.140 5.522 9.869 556 HE2 MET 75 1HE MET 75 -0.959 3.987 10.328 557 HE3 MET 75 2HE MET 75 -1.835 5.558 10.416 558 H LYS 76 H LYS 76 -4.222 0.892 11.268 559 HA LYS 76 HA LYS 76 -3.621 -1.574 10.116 560 HB2 LYS 76 2HB LYS 76 -3.039 -0.724 12.542 561 HB3 LYS 76 1HB LYS 76 -4.642 -1.386 12.994 562 HG2 LYS 76 2HG LYS 76 -3.805 -3.612 11.820 563 HG3 LYS 76 1HG LYS 76 -2.188 -2.836 11.817 564 HD2 LYS 76 2HD LYS 76 -2.474 -2.604 14.400 565 HD3 LYS 76 1HD LYS 76 -3.940 -3.640 14.215 566 HE2 LYS 76 2HE LYS 76 -2.388 -5.384 13.036 567 HE3 LYS 76 1HE LYS 76 -0.991 -4.370 13.570 568 HZ1 LYS 76 3HZ LYS 76 -2.931 -5.912 15.187 569 HZ2 LYS 76 1HZ LYS 76 -1.929 -4.703 15.896 570 HZ3 LYS 76 2HZ LYS 76 -1.234 -6.041 15.102 571 H ALA 77 H ALA 77 -6.682 -0.293 11.427 572 HA ALA 77 HA ALA 77 -8.104 -2.725 11.320 573 HB1 ALA 77 1HB ALA 77 -10.161 -1.299 11.400 574 HB2 ALA 77 2HB ALA 77 -9.162 0.163 11.044 575 HB3 ALA 77 3HB ALA 77 -8.943 -0.721 12.599 576 H GLY 78 H GLY 78 -7.534 -0.112 8.943 577 HA2 GLY 78 2HA GLY 78 -9.311 -1.003 6.965 578 HA3 GLY 78 1HA GLY 78 -7.830 0.012 6.755 579 H ILE 79 H ILE 79 -5.825 -1.643 7.478 580 HA ILE 79 HA ILE 79 -5.463 -3.260 5.264 581 HB ILE 79 HB ILE 79 -4.045 -3.250 7.968 582 HG12 ILE 79 2HG1 ILE 79 -3.223 -2.102 5.217 583 HG13 ILE 79 1HG1 ILE 79 -3.992 -1.137 6.495 584 HG21 ILE 79 1HG2 ILE 79 -2.167 -4.478 6.777 585 HG22 ILE 79 2HG2 ILE 79 -3.215 -4.648 5.325 586 HG23 ILE 79 3HG2 ILE 79 -3.645 -5.476 6.866 587 HD11 ILE 79 3HD ILE 79 -1.237 -2.526 6.714 588 HD12 ILE 79 1HD ILE 79 -1.566 -0.765 6.562 589 HD13 ILE 79 2HD ILE 79 -2.063 -1.643 8.056 590 H GLU 80 H GLU 80 -6.457 -4.182 8.653 591 HA GLU 80 HA GLU 80 -6.499 -6.918 8.073 592 HB2 GLU 80 2HB GLU 80 -8.142 -5.400 10.176 593 HB3 GLU 80 1HB GLU 80 -8.196 -7.177 9.948 594 HG2 GLU 80 2HG GLU 80 -5.599 -7.157 10.262 595 HG3 GLU 80 1HG GLU 80 -5.813 -5.492 10.921 596 H VAL 81 H VAL 81 -9.031 -4.444 7.532 597 HA VAL 81 HA VAL 81 -11.036 -6.329 6.855 598 HB VAL 81 HB VAL 81 -10.670 -3.354 6.290 599 HG11 VAL 81 1HG1 VAL 81 -12.002 -4.158 4.379 600 HG12 VAL 81 2HG1 VAL 81 -13.126 -3.399 5.545 601 HG13 VAL 81 3HG1 VAL 81 -13.019 -5.188 5.450 602 HG21 VAL 81 3HG2 VAL 81 -11.127 -4.143 8.668 603 HG22 VAL 81 1HG2 VAL 81 -12.619 -4.968 8.086 604 HG23 VAL 81 2HG2 VAL 81 -12.483 -3.175 8.001 605 H PHE 82 H PHE 82 -8.865 -4.289 4.768 606 HA PHE 82 HA PHE 82 -9.834 -5.392 2.376 607 HB2 PHE 82 2HB PHE 82 -7.159 -4.003 3.068 608 HB3 PHE 82 1HB PHE 82 -7.518 -4.593 1.404 609 HD1 PHE 82 1HD PHE 82 -9.885 -3.901 0.435 610 HD2 PHE 82 2HD PHE 82 -7.718 -1.735 3.456 611 HE1 PHE 82 1HE PHE 82 -11.065 -1.829 -0.203 612 HE2 PHE 82 2HE PHE 82 -8.916 0.326 2.838 613 HZ PHE 82 HZ PHE 82 -10.588 0.298 0.999 614 H ALA 83 H ALA 83 -7.075 -6.350 4.462 615 HA ALA 83 HA ALA 83 -6.063 -8.277 2.703 616 HB1 ALA 83 1HB ALA 83 -4.741 -7.391 4.637 617 HB2 ALA 83 2HB ALA 83 -4.867 -9.180 4.725 618 HB3 ALA 83 3HB ALA 83 -5.903 -8.152 5.783 619 H LEU 84 H LEU 84 -8.660 -8.419 5.176 620 HA LEU 84 HA LEU 84 -8.764 -11.224 5.326 621 HB2 LEU 84 2HB LEU 84 -9.703 -9.719 7.038 622 HB3 LEU 84 1HB LEU 84 -10.961 -9.147 5.907 623 HG LEU 84 HG LEU 84 -10.777 -12.136 6.479 624 HD11 LEU 84 1HD1 LEU 84 -10.428 -11.139 8.737 625 HD12 LEU 84 2HD1 LEU 84 -12.047 -11.922 8.613 626 HD13 LEU 84 3HD1 LEU 84 -11.905 -10.126 8.533 627 HD21 LEU 84 3HD2 LEU 84 -12.591 -11.316 4.952 628 HD22 LEU 84 1HD2 LEU 84 -13.185 -10.204 6.238 629 HD23 LEU 84 2HD2 LEU 84 -13.281 -11.986 6.469 630 H VAL 85 H VAL 85 -10.157 -8.901 3.056 631 HA VAL 85 HA VAL 85 -12.105 -10.533 1.905 632 HB VAL 85 HB VAL 85 -10.485 -8.206 0.767 633 HG11 VAL 85 1HG1 VAL 85 -12.421 -7.931 -0.864 634 HG12 VAL 85 2HG1 VAL 85 -12.989 -9.583 -0.408 635 HG13 VAL 85 3HG1 VAL 85 -11.383 -9.354 -1.192 636 HG21 VAL 85 3HG2 VAL 85 -12.551 -6.900 1.343 637 HG22 VAL 85 1HG2 VAL 85 -11.884 -7.684 2.804 638 HG23 VAL 85 2HG2 VAL 85 -13.327 -8.382 2.006 639 H THR 86 H THR 86 -8.663 -10.901 1.816 640 HA THR 86 HA THR 86 -8.302 -12.045 -0.654 641 HB THR 86 HB THR 86 -6.874 -12.797 1.928 642 HG1 THR 86 1HG THR 86 -6.546 -10.727 1.750 643 HG21 THR 86 3HG2 THR 86 -6.023 -12.935 -1.061 644 HG22 THR 86 1HG2 THR 86 -6.279 -14.351 0.032 645 HG23 THR 86 2HG2 THR 86 -4.930 -13.207 0.343 646 H ALA 87 H ALA 87 -10.040 -13.373 2.100 647 HA ALA 87 HA ALA 87 -9.959 -16.092 1.433 648 HB1 ALA 87 1HB ALA 87 -11.024 -15.215 3.542 649 HB2 ALA 87 2HB ALA 87 -12.165 -16.254 2.613 650 HB3 ALA 87 3HB ALA 87 -12.326 -14.457 2.559 651 H ALA 88 H ALA 88 -11.488 -13.372 -0.166 652 HA ALA 88 HA ALA 88 -13.085 -15.117 -1.876 653 HB1 ALA 88 1HB ALA 88 -12.924 -12.024 -1.752 654 HB2 ALA 88 2HB ALA 88 -14.216 -13.010 -0.983 655 HB3 ALA 88 3HB ALA 88 -14.054 -12.974 -2.781 656 H LEU 89 H LEU 89 -10.377 -12.767 -1.948 657 HA LEU 89 HA LEU 89 -10.183 -12.701 -4.737 658 HB2 LEU 89 2HB LEU 89 -7.871 -12.354 -2.735 659 HB3 LEU 89 1HB LEU 89 -7.871 -11.826 -4.446 660 HG LEU 89 HG LEU 89 -9.787 -10.729 -2.297 661 HD11 LEU 89 1HD1 LEU 89 -7.164 -9.514 -3.378 662 HD12 LEU 89 2HD1 LEU 89 -7.422 -10.178 -1.727 663 HD13 LEU 89 3HD1 LEU 89 -8.324 -8.718 -2.250 664 HD21 LEU 89 3HD2 LEU 89 -9.139 -9.714 -5.146 665 HD22 LEU 89 1HD2 LEU 89 -10.184 -8.883 -3.938 666 HD23 LEU 89 2HD2 LEU 89 -10.692 -10.467 -4.616 667 H ALA 90 H ALA 90 -8.657 -14.870 -2.326 668 HA ALA 90 HA ALA 90 -6.902 -16.031 -4.233 669 HB1 ALA 90 1HB ALA 90 -6.519 -17.777 -2.434 670 HB2 ALA 90 2HB ALA 90 -7.828 -16.973 -1.469 671 HB3 ALA 90 3HB ALA 90 -6.317 -16.083 -1.850 672 H THR 91 H THR 91 -10.310 -16.739 -3.298 673 HA THR 91 HA THR 91 -10.250 -19.297 -4.539 674 HB THR 91 HB THR 91 -12.839 -18.921 -4.585 675 HG1 THR 91 1HG THR 91 -12.464 -16.551 -4.071 676 HG21 THR 91 3HG2 THR 91 -11.523 -20.392 -2.977 677 HG22 THR 91 1HG2 THR 91 -12.942 -19.593 -2.209 678 HG23 THR 91 2HG2 THR 91 -11.294 -18.955 -1.905 679 H ASP 92 H ASP 92 -10.011 -16.138 -5.913 680 HA ASP 92 HA ASP 92 -11.844 -16.504 -7.985 681 HB2 ASP 92 2HB ASP 92 -10.778 -14.280 -7.172 682 HB3 ASP 92 1HB ASP 92 -9.412 -14.663 -8.266 683 H PHE 93 H PHE 93 -8.382 -17.401 -7.682 684 HA PHE 93 HA PHE 93 -8.348 -18.230 -10.455 685 HB2 PHE 93 2HB PHE 93 -6.103 -18.951 -10.190 686 HB3 PHE 93 1HB PHE 93 -6.273 -17.378 -9.367 687 HD1 PHE 93 1HD PHE 93 -6.166 -17.287 -6.827 688 HD2 PHE 93 2HD PHE 93 -5.471 -20.910 -9.024 689 HE1 PHE 93 1HE PHE 93 -5.108 -18.294 -4.844 690 HE2 PHE 93 2HE PHE 93 -4.401 -21.917 -7.031 691 HZ PHE 93 HZ PHE 93 -4.213 -20.602 -4.935 692 H VAL 94 H VAL 94 -9.583 -19.642 -7.603 693 HA VAL 94 HA VAL 94 -8.818 -22.343 -8.165 694 HB VAL 94 HB VAL 94 -10.998 -21.244 -6.330 695 HG11 VAL 94 1HG1 VAL 94 -11.407 -23.650 -6.871 696 HG12 VAL 94 2HG1 VAL 94 -10.790 -23.490 -5.194 697 HG13 VAL 94 3HG1 VAL 94 -9.687 -24.052 -6.503 698 HG21 VAL 94 3HG2 VAL 94 -8.060 -22.112 -5.790 699 HG22 VAL 94 1HG2 VAL 94 -9.257 -21.587 -4.554 700 HG23 VAL 94 2HG2 VAL 94 -8.657 -20.420 -5.771 701 H ARG 95 H ARG 95 -11.337 -20.091 -9.090 702 HA ARG 95 HA ARG 95 -13.292 -21.729 -10.114 703 HB2 ARG 95 2HB ARG 95 -12.192 -19.074 -11.252 704 HB3 ARG 95 1HB ARG 95 -13.712 -19.849 -11.796 705 HG2 ARG 95 2HG ARG 95 -14.733 -19.568 -9.597 706 HG3 ARG 95 1HG ARG 95 -13.232 -18.810 -8.937 707 HD2 ARG 95 2HD ARG 95 -13.407 -16.884 -10.400 708 HD3 ARG 95 1HD ARG 95 -14.679 -17.650 -11.417 709 HE ARG 95 HE ARG 95 -16.184 -17.624 -9.427 710 HH11 ARG 95 1HH2 ARG 95 -13.564 -15.081 -9.678 711 HH12 ARG 95 2HH2 ARG 95 -14.523 -13.858 -9.034 712 HH21 ARG 95 1HH1 ARG 95 -17.440 -15.899 -8.385 713 HH22 ARG 95 2HH1 ARG 95 -16.729 -14.369 -8.127 714 H ARG 96 H ARG 96 -10.047 -21.110 -11.429 715 HA ARG 96 HA ARG 96 -10.653 -21.501 -14.114 716 HB2 ARG 96 2HB ARG 96 -8.309 -21.567 -14.555 717 HB3 ARG 96 1HB ARG 96 -8.457 -20.554 -13.082 718 HG2 ARG 96 2HG ARG 96 -8.093 -22.844 -11.807 719 HG3 ARG 96 1HG ARG 96 -7.497 -23.457 -13.390 720 HD2 ARG 96 2HD ARG 96 -5.700 -21.670 -13.372 721 HD3 ARG 96 1HD ARG 96 -6.242 -21.143 -11.725 722 HE ARG 96 HE ARG 96 -4.671 -23.493 -12.426 723 HH11 ARG 96 1HH2 ARG 96 -7.103 -22.390 -9.988 724 HH12 ARG 96 2HH2 ARG 96 -6.795 -23.694 -8.913 725 HH21 ARG 96 1HH1 ARG 96 -4.272 -25.283 -10.871 726 HH22 ARG 96 2HH1 ARG 96 -5.343 -25.509 -9.581 727 H GLU 97 H GLU 97 -10.463 -23.748 -11.557 728 HA GLU 97 HA GLU 97 -9.773 -26.084 -13.106 729 HB2 GLU 97 2HB GLU 97 -9.020 -25.756 -10.740 730 HB3 GLU 97 1HB GLU 97 -10.712 -25.576 -10.195 731 HG2 GLU 97 2HG GLU 97 -11.052 -27.819 -9.994 732 HG3 GLU 97 1HG GLU 97 -10.327 -28.157 -11.591 733 H GLU 98 H GLU 98 -12.594 -24.286 -11.934 734 HA GLU 98 HA GLU 98 -14.399 -26.459 -12.698 735 HB2 GLU 98 2HB GLU 98 -15.139 -23.761 -11.394 736 HB3 GLU 98 1HB GLU 98 -16.239 -25.143 -11.754 737 HG2 GLU 98 2HG GLU 98 -14.937 -26.546 -10.074 738 HG3 GLU 98 1HG GLU 98 -14.048 -25.048 -9.602 739 H GLU 99 H GLU 99 -16.476 -24.588 -13.493 740 HA GLU 99 HA GLU 99 -17.295 -23.659 -15.240 741 HB2 GLU 99 2HB GLU 99 -16.015 -21.668 -14.397 742 HB3 GLU 99 1HB GLU 99 -14.685 -22.076 -15.516 743 HG2 GLU 99 2HG GLU 99 -16.363 -21.844 -17.466 744 HG3 GLU 99 1HG GLU 99 -17.596 -21.310 -16.265 745 H ARG 100 H ARG 100 -13.924 -23.920 -16.263 746 HA ARG 100 HA ARG 100 -14.466 -24.374 -18.963 747 HB2 ARG 100 2HB ARG 100 -12.257 -23.632 -17.470 748 HB3 ARG 100 1HB ARG 100 -11.807 -25.320 -17.835 749 HG2 ARG 100 2HG ARG 100 -12.164 -24.761 -20.330 750 HG3 ARG 100 1HG ARG 100 -12.597 -23.093 -19.823 751 HD2 ARG 100 2HD ARG 100 -10.245 -23.063 -20.559 752 HD3 ARG 100 1HD ARG 100 -10.314 -22.811 -18.765 753 HE ARG 100 HE ARG 100 -9.950 -25.578 -19.933 754 HH11 ARG 100 1HH2 ARG 100 -8.442 -22.846 -18.032 755 HH12 ARG 100 2HH2 ARG 100 -7.170 -23.775 -17.471 756 HH21 ARG 100 1HH1 ARG 100 -8.113 -26.786 -19.268 757 HH22 ARG 100 2HH1 ARG 100 -6.873 -26.108 -18.293 758 H ARG 101 H ARG 101 -13.791 -26.547 -16.210 759 HA ARG 101 HA ARG 101 -13.896 -28.865 -17.990 760 HB2 ARG 101 2HB ARG 101 -13.587 -28.812 -14.940 761 HB3 ARG 101 1HB ARG 101 -13.316 -30.208 -16.045 762 HG2 ARG 101 2HG ARG 101 -11.413 -28.882 -17.136 763 HG3 ARG 101 1HG ARG 101 -11.704 -27.583 -15.915 764 HD2 ARG 101 2HD ARG 101 -11.315 -29.363 -14.089 765 HD3 ARG 101 1HD ARG 101 -10.663 -30.453 -15.393 766 HE ARG 101 HE ARG 101 -9.335 -27.953 -15.675 767 HH11 ARG 101 1HH2 ARG 101 -9.657 -30.377 -13.015 768 HH12 ARG 101 2HH2 ARG 101 -8.522 -29.549 -12.019 769 HH21 ARG 101 1HH1 ARG 101 -7.427 -27.155 -14.383 770 HH22 ARG 101 2HH1 ARG 101 -7.184 -27.896 -12.848 771 H GLY 102 H GLY 102 -16.168 -26.845 -16.672 772 HA2 GLY 102 2HA GLY 102 -18.326 -26.940 -16.561 773 HA3 GLY 102 1HA GLY 102 -18.226 -28.582 -17.287 774 H HIS 103 H HIS 103 -16.550 -28.445 -14.233 775 HA HIS 103 HA HIS 103 -18.844 -29.258 -12.717 776 HB2 HIS 103 2HB HIS 103 -16.605 -31.318 -13.325 777 HB3 HIS 103 1HB HIS 103 -18.045 -31.567 -12.291 778 HD1 HIS 103 1HD HIS 103 -17.053 -31.204 -15.994 779 HD2 HIS 103 2HD HIS 103 -20.465 -32.221 -13.732 780 HE1 HIS 103 1HE HIS 103 -18.766 -32.116 -17.588 781 HE2 HIS 103 2HE HIS 103 -20.815 -32.617 -16.275 782 H1 SER 1 H SER 1 -0.956 -14.245 -19.945 783 HA SER 1 HA SER 1 -0.790 -15.102 -22.506 784 HB2 SER 1 2HB SER 1 0.924 -16.753 -20.939 785 HB3 SER 1 1HB SER 1 1.322 -15.175 -21.690 786 HG SER 1 1HG SER 1 0.461 -15.746 -19.049 787 H ALA 2 H ALA 2 -1.411 -17.118 -19.532 788 HA ALA 2 HA ALA 2 -2.633 -19.174 -21.187 789 HB1 ALA 2 1HB ALA 2 -1.372 -19.936 -19.205 790 HB2 ALA 2 2HB ALA 2 -3.103 -20.347 -19.008 791 HB3 ALA 2 3HB ALA 2 -2.383 -18.936 -18.120 792 H ASP 3 H ASP 3 -4.342 -18.761 -18.267 793 HA ASP 3 HA ASP 3 -6.607 -17.558 -19.697 794 HB2 ASP 3 2HB ASP 3 -8.001 -18.865 -17.975 795 HB3 ASP 3 1HB ASP 3 -7.165 -19.824 -19.229 796 H HIS 4 H HIS 4 -5.677 -18.167 -16.404 797 HA HIS 4 HA HIS 4 -6.976 -16.059 -15.200 798 HB2 HIS 4 2HB HIS 4 -5.682 -16.606 -13.143 799 HB3 HIS 4 1HB HIS 4 -6.306 -18.075 -13.952 800 HD1 HIS 4 1HD HIS 4 -4.217 -19.117 -15.770 801 HD2 HIS 4 2HD HIS 4 -3.199 -17.292 -12.121 802 HE1 HIS 4 1HE HIS 4 -1.721 -19.438 -15.414 803 HE2 HIS 4 2HE HIS 4 -1.199 -18.572 -13.121 804 H GLU 5 H GLU 5 -3.831 -16.073 -16.718 805 HA GLU 5 HA GLU 5 -2.800 -13.761 -15.423 806 HB2 GLU 5 2HB GLU 5 -2.099 -15.230 -18.023 807 HB3 GLU 5 1HB GLU 5 -1.063 -13.968 -17.283 808 HG2 GLU 5 2HG GLU 5 -0.226 -15.363 -15.646 809 HG3 GLU 5 1HG GLU 5 -1.781 -16.203 -15.378 810 H ARG 6 H ARG 6 -4.935 -14.375 -18.211 811 HA ARG 6 HA ARG 6 -4.419 -11.849 -19.446 812 HB2 ARG 6 2HB ARG 6 -6.800 -13.773 -19.779 813 HB3 ARG 6 1HB ARG 6 -6.432 -12.361 -20.830 814 HG2 ARG 6 2HG ARG 6 -4.263 -13.395 -21.491 815 HG3 ARG 6 1HG ARG 6 -4.602 -14.819 -20.445 816 HD2 ARG 6 2HD ARG 6 -6.604 -15.403 -21.799 817 HD3 ARG 6 1HD ARG 6 -6.367 -13.946 -22.837 818 HE ARG 6 HE ARG 6 -4.584 -16.355 -22.571 819 HH11 ARG 6 1HH2 ARG 6 -5.586 -13.467 -24.589 820 HH12 ARG 6 2HH2 ARG 6 -4.361 -13.745 -25.754 821 HH21 ARG 6 1HH1 ARG 6 -2.878 -16.570 -24.212 822 HH22 ARG 6 2HH1 ARG 6 -2.846 -15.510 -25.576 823 H GLU 7 H GLU 7 -6.742 -13.171 -17.098 824 HA GLU 7 HA GLU 7 -8.495 -10.982 -17.203 825 HB2 GLU 7 2HB GLU 7 -8.925 -13.398 -16.297 826 HB3 GLU 7 1HB GLU 7 -8.095 -12.855 -14.801 827 HG2 GLU 7 2HG GLU 7 -10.431 -12.661 -14.358 828 HG3 GLU 7 1HG GLU 7 -9.908 -10.972 -14.687 829 H ALA 8 H ALA 8 -5.526 -11.654 -15.452 830 HA ALA 8 HA ALA 8 -5.687 -9.542 -13.589 831 HB1 ALA 8 1HB ALA 8 -3.185 -9.865 -13.367 832 HB2 ALA 8 2HB ALA 8 -3.203 -10.925 -14.816 833 HB3 ALA 8 3HB ALA 8 -4.057 -11.441 -13.314 834 H GLN 9 H GLN 9 -4.358 -9.820 -16.905 835 HA GLN 9 HA GLN 9 -3.221 -7.230 -16.856 836 HB2 GLN 9 2HB GLN 9 -2.544 -9.237 -18.294 837 HB3 GLN 9 1HB GLN 9 -3.927 -8.848 -19.369 838 HG2 GLN 9 2HG GLN 9 -2.924 -6.656 -19.940 839 HG3 GLN 9 1HG GLN 9 -1.706 -6.819 -18.622 840 HE21 GLN 9 1HE2 GLN 9 -2.059 -7.197 -21.980 841 HE22 GLN 9 2HE2 GLN 9 -0.690 -8.232 -22.232 842 H LYS 10 H LYS 10 -6.334 -8.571 -17.937 843 HA LYS 10 HA LYS 10 -7.401 -6.385 -19.237 844 HB2 LYS 10 2HB LYS 10 -8.388 -8.764 -19.020 845 HB3 LYS 10 1HB LYS 10 -8.912 -8.325 -17.368 846 HG2 LYS 10 2HG LYS 10 -10.311 -6.408 -18.483 847 HG3 LYS 10 1HG LYS 10 -9.837 -7.135 -20.053 848 HD2 LYS 10 2HD LYS 10 -11.959 -8.092 -19.658 849 HD3 LYS 10 1HD LYS 10 -10.820 -9.370 -19.096 850 HE2 LYS 10 2HE LYS 10 -11.150 -8.367 -16.692 851 HE3 LYS 10 1HE LYS 10 -12.521 -7.414 -17.387 852 HZ1 LYS 10 3HZ LYS 10 -12.184 -10.369 -17.246 853 HZ2 LYS 10 1HZ LYS 10 -13.526 -9.640 -18.025 854 HZ3 LYS 10 2HZ LYS 10 -13.289 -9.401 -16.371 855 H ALA 11 H ALA 11 -7.127 -7.082 -15.761 856 HA ALA 11 HA ALA 11 -8.893 -5.120 -14.845 857 HB1 ALA 11 1HB ALA 11 -8.037 -7.014 -13.413 858 HB2 ALA 11 2HB ALA 11 -7.813 -5.408 -12.633 859 HB3 ALA 11 3HB ALA 11 -6.411 -6.239 -13.400 860 H GLU 12 H GLU 12 -5.375 -4.934 -15.703 861 HA GLU 12 HA GLU 12 -5.046 -2.348 -14.576 862 HB2 GLU 12 2HB GLU 12 -3.455 -3.575 -16.920 863 HB3 GLU 12 1HB GLU 12 -3.138 -1.995 -16.133 864 HG2 GLU 12 2HG GLU 12 -2.908 -3.360 -13.896 865 HG3 GLU 12 1HG GLU 12 -2.715 -4.795 -14.970 866 H GLU 13 H GLU 13 -6.155 -3.534 -17.744 867 HA GLU 13 HA GLU 13 -6.022 -1.053 -19.060 868 HB2 GLU 13 2HB GLU 13 -7.916 -3.420 -19.613 869 HB3 GLU 13 1HB GLU 13 -7.532 -2.087 -20.755 870 HG2 GLU 13 2HG GLU 13 -5.131 -2.826 -20.821 871 HG3 GLU 13 1HG GLU 13 -5.494 -4.146 -19.655 872 H GLU 14 H GLU 14 -8.502 -2.646 -17.093 873 HA GLU 14 HA GLU 14 -10.596 -0.840 -17.564 874 HB2 GLU 14 2HB GLU 14 -11.041 -3.037 -16.613 875 HB3 GLU 14 1HB GLU 14 -9.982 -2.702 -15.204 876 HG2 GLU 14 2HG GLU 14 -12.442 -2.654 -14.688 877 HG3 GLU 14 1HG GLU 14 -11.590 -1.127 -14.261 878 H LEU 15 H LEU 15 -7.957 -0.884 -15.119 879 HA LEU 15 HA LEU 15 -8.880 1.185 -13.586 880 HB2 LEU 15 2HB LEU 15 -6.906 -0.302 -13.029 881 HB3 LEU 15 1HB LEU 15 -5.919 0.608 -14.203 882 HG LEU 15 HG LEU 15 -6.089 2.658 -12.860 883 HD11 LEU 15 1HD1 LEU 15 -8.371 2.567 -11.957 884 HD12 LEU 15 2HD1 LEU 15 -7.220 2.663 -10.590 885 HD13 LEU 15 3HD1 LEU 15 -7.987 1.085 -11.000 886 HD21 LEU 15 3HD2 LEU 15 -4.306 1.023 -12.263 887 HD22 LEU 15 1HD2 LEU 15 -5.402 0.232 -11.073 888 HD23 LEU 15 2HD2 LEU 15 -4.865 1.930 -10.811 889 H GLN 16 H GLN 16 -7.057 1.348 -16.620 890 HA GLN 16 HA GLN 16 -6.504 4.113 -16.395 891 HB2 GLN 16 2HB GLN 16 -6.469 2.300 -18.854 892 HB3 GLN 16 1HB GLN 16 -5.803 3.973 -18.775 893 HG2 GLN 16 2HG GLN 16 -4.221 3.287 -16.953 894 HG3 GLN 16 1HG GLN 16 -4.877 1.617 -16.979 895 HE21 GLN 16 1HE2 GLN 16 -3.265 0.360 -17.891 896 HE22 GLN 16 2HE2 GLN 16 -2.461 0.699 -19.388 897 H LYS 17 H LYS 17 -9.415 2.411 -17.292 898 HA LYS 17 HA LYS 17 -10.519 4.640 -18.784 899 HB2 LYS 17 2HB LYS 17 -11.226 2.363 -19.362 900 HB3 LYS 17 1HB LYS 17 -11.775 2.064 -17.677 901 HG2 LYS 17 2HG LYS 17 -13.640 3.604 -17.929 902 HG3 LYS 17 1HG LYS 17 -12.937 4.321 -19.413 903 HD2 LYS 17 2HD LYS 17 -14.929 2.825 -19.839 904 HD3 LYS 17 1HD LYS 17 -13.450 2.444 -20.772 905 HE2 LYS 17 2HE LYS 17 -14.649 0.374 -19.971 906 HE3 LYS 17 1HE LYS 17 -12.946 0.481 -19.391 907 HZ1 LYS 17 3HZ LYS 17 -14.184 -0.213 -17.618 908 HZ2 LYS 17 1HZ LYS 17 -15.416 0.980 -17.744 909 HZ3 LYS 17 2HZ LYS 17 -13.829 1.323 -17.256 910 H VAL 18 H VAL 18 -10.345 3.426 -15.438 911 HA VAL 18 HA VAL 18 -12.431 5.052 -14.455 912 HB VAL 18 HB VAL 18 -10.022 4.011 -12.885 913 HG11 VAL 18 1HG1 VAL 18 -11.365 5.746 -11.661 914 HG12 VAL 18 2HG1 VAL 18 -11.656 4.124 -10.960 915 HG13 VAL 18 3HG1 VAL 18 -12.888 4.861 -12.046 916 HG21 VAL 18 3HG2 VAL 18 -11.103 2.108 -14.072 917 HG22 VAL 18 1HG2 VAL 18 -12.734 2.677 -13.579 918 HG23 VAL 18 2HG2 VAL 18 -11.567 2.065 -12.347 919 H LEU 19 H LEU 19 -8.972 5.602 -15.112 920 HA LEU 19 HA LEU 19 -8.646 8.004 -13.749 921 HB2 LEU 19 2HB LEU 19 -7.461 7.243 -16.489 922 HB3 LEU 19 1HB LEU 19 -6.863 8.570 -15.444 923 HG LEU 19 HG LEU 19 -6.826 5.582 -14.700 924 HD11 LEU 19 1HD1 LEU 19 -5.313 6.115 -16.633 925 HD12 LEU 19 2HD1 LEU 19 -4.387 5.679 -15.150 926 HD13 LEU 19 3HD1 LEU 19 -4.518 7.403 -15.654 927 HD21 LEU 19 3HD2 LEU 19 -6.881 7.021 -12.665 928 HD22 LEU 19 1HD2 LEU 19 -5.514 8.010 -13.314 929 HD23 LEU 19 2HD2 LEU 19 -5.258 6.286 -12.890 930 H GLU 20 H GLU 20 -10.118 7.334 -16.924 931 HA GLU 20 HA GLU 20 -10.258 9.968 -17.879 932 HB2 GLU 20 2HB GLU 20 -12.208 7.615 -18.402 933 HB3 GLU 20 1HB GLU 20 -12.113 9.120 -19.361 934 HG2 GLU 20 2HG GLU 20 -9.854 8.494 -20.187 935 HG3 GLU 20 1HG GLU 20 -9.863 7.006 -19.168 936 H GLU 21 H GLU 21 -12.488 7.889 -16.055 937 HA GLU 21 HA GLU 21 -14.647 9.723 -15.937 938 HB2 GLU 21 2HB GLU 21 -14.916 7.229 -15.764 939 HB3 GLU 21 1HB GLU 21 -13.930 7.237 -14.270 940 HG2 GLU 21 2HG GLU 21 -16.175 6.924 -13.588 941 HG3 GLU 21 1HG GLU 21 -15.772 8.614 -13.139 942 H ALA 22 H ALA 22 -11.970 8.796 -13.771 943 HA ALA 22 HA ALA 22 -12.585 10.139 -11.491 944 HB1 ALA 22 1HB ALA 22 -9.782 9.804 -12.759 945 HB2 ALA 22 2HB ALA 22 -10.604 8.600 -11.709 946 HB3 ALA 22 3HB ALA 22 -10.098 10.193 -11.037 947 H SER 23 H SER 23 -10.949 11.340 -14.384 948 HA SER 23 HA SER 23 -10.217 13.857 -13.480 949 HB2 SER 23 2HB SER 23 -9.531 12.644 -15.669 950 HB3 SER 23 1HB SER 23 -11.129 13.112 -16.347 951 HG SER 23 1HG SER 23 -9.697 14.639 -16.958 952 H LYS 24 H LYS 24 -13.290 12.742 -15.105 953 HA LYS 24 HA LYS 24 -14.339 15.371 -15.216 954 HB2 LYS 24 2HB LYS 24 -15.251 13.566 -16.742 955 HB3 LYS 24 1HB LYS 24 -15.998 12.784 -15.304 956 HG2 LYS 24 2HG LYS 24 -17.256 14.979 -14.859 957 HG3 LYS 24 1HG LYS 24 -16.557 15.648 -16.360 958 HD2 LYS 24 2HD LYS 24 -17.862 14.045 -17.706 959 HD3 LYS 24 1HD LYS 24 -18.406 13.180 -16.214 960 HE2 LYS 24 2HE LYS 24 -19.600 15.234 -15.409 961 HE3 LYS 24 1HE LYS 24 -19.018 16.157 -16.845 962 HZ1 LYS 24 3HZ LYS 24 -21.344 15.331 -16.942 963 HZ2 LYS 24 1HZ LYS 24 -20.798 13.755 -17.077 964 HZ3 LYS 24 2HZ LYS 24 -20.367 14.885 -18.267 965 H LYS 25 H LYS 25 -14.769 12.585 -12.986 966 HA LYS 25 HA LYS 25 -16.698 13.864 -11.432 967 HB2 LYS 25 2HB LYS 25 -14.697 11.715 -10.514 968 HB3 LYS 25 1HB LYS 25 -16.154 12.277 -9.617 969 HG2 LYS 25 2HG LYS 25 -17.291 11.707 -12.038 970 HG3 LYS 25 1HG LYS 25 -15.984 10.480 -12.045 971 HD2 LYS 25 2HD LYS 25 -16.788 9.633 -9.794 972 HD3 LYS 25 1HD LYS 25 -18.032 10.925 -9.766 973 HE2 LYS 25 2HE LYS 25 -17.930 8.465 -11.630 974 HE3 LYS 25 1HE LYS 25 -19.196 8.919 -10.416 975 HZ1 LYS 25 3HZ LYS 25 -19.385 11.025 -11.922 976 HZ2 LYS 25 1HZ LYS 25 -20.104 9.558 -12.416 977 HZ3 LYS 25 2HZ LYS 25 -18.618 9.988 -13.097 978 H ALA 26 H ALA 26 -13.101 13.804 -11.090 979 HA ALA 26 HA ALA 26 -13.023 15.242 -8.697 980 HB1 ALA 26 1HB ALA 26 -10.941 15.086 -10.973 981 HB2 ALA 26 2HB ALA 26 -11.041 13.990 -9.547 982 HB3 ALA 26 3HB ALA 26 -10.637 15.725 -9.312 983 H VAL 27 H VAL 27 -12.655 16.396 -12.148 984 HA VAL 27 HA VAL 27 -12.197 19.004 -11.217 985 HB VAL 27 HB VAL 27 -11.368 18.131 -13.373 986 HG11 VAL 27 1HG1 VAL 27 -13.685 17.140 -14.076 987 HG12 VAL 27 2HG1 VAL 27 -12.720 17.989 -15.330 988 HG13 VAL 27 3HG1 VAL 27 -14.121 18.815 -14.558 989 HG21 VAL 27 3HG2 VAL 27 -11.587 20.322 -14.547 990 HG22 VAL 27 1HG2 VAL 27 -11.332 20.558 -12.775 991 HG23 VAL 27 2HG2 VAL 27 -12.968 20.781 -13.492 992 H GLU 28 H GLU 28 -15.243 17.323 -12.173 993 HA GLU 28 HA GLU 28 -16.610 19.885 -11.926 994 HB2 GLU 28 2HB GLU 28 -17.828 17.219 -12.734 995 HB3 GLU 28 1HB GLU 28 -18.555 18.864 -12.847 996 HG2 GLU 28 2HG GLU 28 -16.490 19.499 -14.329 997 HG3 GLU 28 1HG GLU 28 -16.116 17.739 -14.371 998 H ALA 29 H ALA 29 -15.554 17.588 -9.743 999 HA ALA 29 HA ALA 29 -17.813 17.972 -7.935 1000 HB1 ALA 29 1HB ALA 29 -15.086 16.580 -7.557 1001 HB2 ALA 29 2HB ALA 29 -16.688 15.774 -7.774 1002 HB3 ALA 29 3HB ALA 29 -16.367 16.722 -6.316 1003 H GLU 30 H GLU 30 -14.289 18.827 -8.333 1004 HA GLU 30 HA GLU 30 -14.492 20.527 -6.095 1005 HB2 GLU 30 2HB GLU 30 -12.343 19.414 -7.266 1006 HB3 GLU 30 1HB GLU 30 -12.286 21.027 -8.040 1007 HG2 GLU 30 2HG GLU 30 -12.733 21.801 -5.422 1008 HG3 GLU 30 1HG GLU 30 -12.049 20.158 -5.091 1009 H ARG 31 H ARG 31 -15.235 21.016 -9.508 1010 HA ARG 31 HA ARG 31 -15.098 23.846 -9.278 1011 HB2 ARG 31 2HB ARG 31 -14.932 22.696 -11.467 1012 HB3 ARG 31 1HB ARG 31 -16.681 22.302 -11.375 1013 HG2 ARG 31 2HG ARG 31 -17.285 24.675 -11.509 1014 HG3 ARG 31 1HG ARG 31 -15.633 25.189 -11.072 1015 HD2 ARG 31 2HD ARG 31 -16.068 25.605 -13.469 1016 HD3 ARG 31 1HD ARG 31 -14.732 24.389 -13.265 1017 HE ARG 31 HE ARG 31 -17.078 22.860 -13.396 1018 HH11 ARG 31 1HH2 ARG 31 -15.442 25.299 -15.521 1019 HH12 ARG 31 2HH2 ARG 31 -16.401 24.951 -16.874 1020 HH21 ARG 31 1HH1 ARG 31 -18.013 22.050 -15.470 1021 HH22 ARG 31 2HH1 ARG 31 -17.526 22.755 -16.940 1022 H GLY 32 H GLY 32 -16.300 24.919 -7.842 1023 HA2 GLY 32 2HA GLY 32 -18.598 25.862 -7.792 1024 HA3 GLY 32 1HA GLY 32 -19.106 24.154 -7.456 1025 H ALA 33 H ALA 33 -16.302 23.807 -6.136 1026 HA ALA 33 HA ALA 33 -17.405 24.276 -3.543 1027 HB1 ALA 33 1HB ALA 33 -15.442 22.910 -2.756 1028 HB2 ALA 33 2HB ALA 33 -14.766 22.947 -4.425 1029 HB3 ALA 33 3HB ALA 33 -16.316 22.088 -4.102 1030 HA PRO 34 HA PRO 34 -14.718 27.773 -2.856 1031 HB2 PRO 34 2HB PRO 34 -14.556 27.894 -0.069 1032 HB3 PRO 34 1HB PRO 34 -16.080 28.249 -0.975 1033 HG2 PRO 34 2HG PRO 34 -15.268 25.598 0.347 1034 HG3 PRO 34 1HG PRO 34 -16.845 26.485 0.502 1035 HD2 PRO 34 2HD PRO 34 -16.482 24.396 -1.287 1036 HD3 PRO 34 1HD PRO 34 -17.521 25.829 -1.707 1037 H GLY 35 H GLY 35 -12.498 28.295 -2.545 1038 HA2 GLY 35 2HA GLY 35 -10.341 27.969 -2.267 1039 HA3 GLY 35 1HA GLY 35 -10.747 26.763 -0.985 1040 H ALA 36 H ALA 36 -11.675 26.618 -4.412 1041 HA ALA 36 HA ALA 36 -10.858 23.929 -4.590 1042 HB1 ALA 36 1HB ALA 36 -11.653 24.176 -6.984 1043 HB2 ALA 36 2HB ALA 36 -11.746 25.955 -6.750 1044 HB3 ALA 36 3HB ALA 36 -12.837 24.848 -5.828 1045 H ALA 37 H ALA 37 -9.060 23.020 -5.548 1046 HA ALA 37 HA ALA 37 -6.938 24.864 -6.499 1047 HB1 ALA 37 1HB ALA 37 -5.266 23.391 -5.316 1048 HB2 ALA 37 2HB ALA 37 -6.628 22.420 -4.630 1049 HB3 ALA 37 3HB ALA 37 -6.411 24.138 -4.144 1050 H LEU 38 H LEU 38 -8.461 21.642 -6.484 1051 HA LEU 38 HA LEU 38 -6.614 20.393 -8.209 1052 HB2 LEU 38 2HB LEU 38 -8.010 19.257 -6.460 1053 HB3 LEU 38 1HB LEU 38 -9.482 19.684 -7.370 1054 HG LEU 38 HG LEU 38 -8.930 18.181 -9.185 1055 HD11 LEU 38 1HD1 LEU 38 -6.953 16.683 -9.156 1056 HD12 LEU 38 2HD1 LEU 38 -6.291 17.528 -7.711 1057 HD13 LEU 38 3HD1 LEU 38 -6.447 18.400 -9.291 1058 HD21 LEU 38 3HD2 LEU 38 -10.080 17.236 -7.182 1059 HD22 LEU 38 1HD2 LEU 38 -8.499 16.860 -6.418 1060 HD23 LEU 38 2HD2 LEU 38 -8.993 15.998 -7.915 1061 H ILE 39 H ILE 39 -9.615 22.116 -8.527 1062 HA ILE 39 HA ILE 39 -10.750 21.601 -10.769 1063 HB ILE 39 HB ILE 39 -11.524 23.115 -9.117 1064 HG12 ILE 39 2HG1 ILE 39 -11.510 24.444 -11.887 1065 HG13 ILE 39 1HG1 ILE 39 -12.701 23.311 -11.177 1066 HG21 ILE 39 1HG2 ILE 39 -10.595 25.444 -8.844 1067 HG22 ILE 39 2HG2 ILE 39 -9.260 25.030 -9.973 1068 HG23 ILE 39 3HG2 ILE 39 -9.455 24.154 -8.428 1069 HD11 ILE 39 3HD ILE 39 -12.071 26.189 -10.207 1070 HD12 ILE 39 1HD ILE 39 -13.542 25.653 -11.078 1071 HD13 ILE 39 2HD ILE 39 -13.220 25.063 -9.399 1072 H SER 40 H SER 40 -8.884 20.869 -12.362 1073 HA SER 40 HA SER 40 -9.289 22.794 -14.414 1074 HB2 SER 40 2HB SER 40 -6.610 22.335 -15.036 1075 HB3 SER 40 1HB SER 40 -7.271 23.845 -14.338 1076 HG SER 40 1HG SER 40 -5.403 22.710 -13.301 1077 H TYR 41 H TYR 41 -9.513 21.717 -16.361 1078 HA TYR 41 HA TYR 41 -9.914 18.928 -16.171 1079 HB2 TYR 41 2HB TYR 41 -9.939 20.831 -18.593 1080 HB3 TYR 41 1HB TYR 41 -10.119 19.053 -18.780 1081 HD1 TYR 41 2HD TYR 41 -11.747 22.135 -17.493 1082 HD2 TYR 41 1HD TYR 41 -12.107 17.889 -18.093 1083 HE1 TYR 41 2HE TYR 41 -14.181 22.293 -17.167 1084 HE2 TYR 41 1HE TYR 41 -14.544 18.045 -17.764 1085 HH TYR 41 HH TYR 41 -16.310 19.420 -17.055 1086 HA PRO 42 HA PRO 42 -6.202 18.104 -18.787 1087 HB2 PRO 42 2HB PRO 42 -4.084 19.921 -19.172 1088 HB3 PRO 42 1HB PRO 42 -5.522 19.827 -20.260 1089 HG2 PRO 42 2HG PRO 42 -5.060 21.725 -17.901 1090 HG3 PRO 42 1HG PRO 42 -5.635 22.146 -19.568 1091 HD2 PRO 42 2HD PRO 42 -7.382 21.806 -17.469 1092 HD3 PRO 42 1HD PRO 42 -7.819 21.197 -19.133 1093 H ASP 43 H ASP 43 -5.904 19.960 -15.872 1094 HA ASP 43 HA ASP 43 -3.398 18.702 -15.140 1095 HB2 ASP 43 2HB ASP 43 -5.181 20.476 -13.387 1096 HB3 ASP 43 1HB ASP 43 -3.451 20.067 -13.119 1097 H ALA 44 H ALA 44 -6.897 18.329 -14.719 1098 HA ALA 44 HA ALA 44 -6.910 16.927 -12.306 1099 HB1 ALA 44 1HB ALA 44 -9.176 16.040 -13.019 1100 HB2 ALA 44 2HB ALA 44 -8.933 16.809 -14.630 1101 HB3 ALA 44 3HB ALA 44 -9.054 17.819 -13.142 1102 H ILE 45 H ILE 45 -6.796 15.863 -15.729 1103 HA ILE 45 HA ILE 45 -6.884 13.153 -15.088 1104 HB ILE 45 HB ILE 45 -7.483 14.004 -17.258 1105 HG12 ILE 45 2HG1 ILE 45 -5.166 11.988 -17.465 1106 HG13 ILE 45 1HG1 ILE 45 -6.834 11.611 -16.927 1107 HG21 ILE 45 1HG2 ILE 45 -5.780 14.746 -18.917 1108 HG22 ILE 45 2HG2 ILE 45 -4.477 14.590 -17.689 1109 HG23 ILE 45 3HG2 ILE 45 -5.785 15.809 -17.481 1110 HD11 ILE 45 3HD ILE 45 -6.029 12.668 -19.722 1111 HD12 ILE 45 1HD ILE 45 -6.575 11.006 -19.304 1112 HD13 ILE 45 2HD ILE 45 -7.726 12.385 -19.168 1113 H TRP 46 H TRP 46 -4.227 15.414 -14.993 1114 HA TRP 46 HA TRP 46 -2.188 13.393 -14.916 1115 HB2 TRP 46 2HB TRP 46 -2.298 16.207 -15.339 1116 HB3 TRP 46 1HB TRP 46 -1.463 16.058 -13.773 1117 HD1 TRP 46 HD TRP 46 0.998 16.594 -14.488 1118 HE1 TRP 46 1HE TRP 46 2.605 15.864 -16.364 1119 HE3 TRP 46 3HE TRP 46 -2.171 13.536 -17.107 1120 HZ2 TRP 46 2HZ TRP 46 2.579 14.075 -18.565 1121 HZ3 TRP 46 3HZ TRP 46 -1.317 12.332 -19.073 1122 HH2 TRP 46 HH TRP 46 1.035 12.592 -19.798 1123 H TRP 47 H TRP 47 -4.276 15.038 -12.594 1124 HA TRP 47 HA TRP 47 -2.748 14.195 -10.300 1125 HB2 TRP 47 2HB TRP 47 -4.211 16.228 -10.153 1126 HB3 TRP 47 1HB TRP 47 -5.644 15.222 -10.531 1127 HD1 TRP 47 HD TRP 47 -3.003 15.677 -7.623 1128 HE1 TRP 47 1HE TRP 47 -4.216 15.067 -5.449 1129 HE3 TRP 47 3HE TRP 47 -7.321 13.854 -9.639 1130 HZ2 TRP 47 2HZ TRP 47 -6.541 13.522 -4.710 1131 HZ3 TRP 47 3HZ TRP 47 -9.003 12.813 -8.156 1132 HH2 TRP 47 HH TRP 47 -8.614 12.650 -5.727 1133 H SER 48 H SER 48 -5.592 13.008 -12.220 1134 HA SER 48 HA SER 48 -6.472 11.078 -10.545 1135 HB2 SER 48 2HB SER 48 -6.086 10.713 -13.589 1136 HB3 SER 48 1HB SER 48 -7.223 9.783 -12.539 1137 HG SER 48 1HG SER 48 -8.275 11.437 -13.622 1138 H VAL 49 H VAL 49 -3.466 11.064 -12.383 1139 HA VAL 49 HA VAL 49 -2.899 8.324 -12.265 1140 HB VAL 49 HB VAL 49 -0.913 10.660 -12.337 1141 HG11 VAL 49 1HG1 VAL 49 0.138 8.412 -11.942 1142 HG12 VAL 49 2HG1 VAL 49 0.502 8.999 -13.601 1143 HG13 VAL 49 3HG1 VAL 49 -0.750 7.732 -13.354 1144 HG21 VAL 49 3HG2 VAL 49 -2.512 9.307 -14.621 1145 HG22 VAL 49 1HG2 VAL 49 -1.099 10.404 -14.858 1146 HG23 VAL 49 2HG2 VAL 49 -2.595 11.039 -14.113 1147 H GLU 50 H GLU 50 -2.324 11.047 -9.992 1148 HA GLU 50 HA GLU 50 -0.450 9.812 -8.320 1149 HB2 GLU 50 2HB GLU 50 -2.615 11.927 -7.673 1150 HB3 GLU 50 1HB GLU 50 -1.195 11.592 -6.646 1151 HG2 GLU 50 2HG GLU 50 -0.804 12.524 -9.563 1152 HG3 GLU 50 1HG GLU 50 -1.245 13.691 -8.262 1153 H THR 51 H THR 51 -3.881 9.406 -8.660 1154 HA THR 51 HA THR 51 -4.179 8.744 -5.824 1155 HB THR 51 HB THR 51 -5.495 10.522 -7.408 1156 HG1 THR 51 1HG THR 51 -5.670 10.557 -5.318 1157 HG21 THR 51 3HG2 THR 51 -7.366 8.071 -7.306 1158 HG22 THR 51 1HG2 THR 51 -6.622 8.752 -8.806 1159 HG23 THR 51 2HG2 THR 51 -7.783 9.736 -7.850 1160 H ALA 52 H ALA 52 -4.560 7.388 -9.112 1161 HA ALA 52 HA ALA 52 -6.074 5.170 -8.268 1162 HB1 ALA 52 1HB ALA 52 -4.339 5.522 -10.794 1163 HB2 ALA 52 2HB ALA 52 -6.083 5.963 -10.635 1164 HB3 ALA 52 3HB ALA 52 -5.582 4.237 -10.548 1165 H THR 53 H THR 53 -2.516 5.721 -8.464 1166 HA THR 53 HA THR 53 -2.027 2.908 -8.076 1167 HB THR 53 HB THR 53 0.390 3.772 -7.938 1168 HG1 THR 53 1HG THR 53 0.252 5.899 -7.616 1169 HG21 THR 53 3HG2 THR 53 0.442 4.093 -10.422 1170 HG22 THR 53 1HG2 THR 53 -1.337 4.373 -10.451 1171 HG23 THR 53 2HG2 THR 53 -0.685 2.757 -9.983 1172 H THR 54 H THR 54 -3.275 5.181 -6.053 1173 HA THR 54 HA THR 54 -3.232 5.679 -3.963 1174 HB THR 54 HB THR 54 -2.974 3.790 -2.286 1175 HG1 THR 54 1HG THR 54 -1.808 2.644 -4.359 1176 HG21 THR 54 3HG2 THR 54 -5.124 4.566 -3.388 1177 HG22 THR 54 1HG2 THR 54 -5.111 2.806 -3.031 1178 HG23 THR 54 2HG2 THR 54 -4.860 3.383 -4.722 1179 H VAL 55 H VAL 55 -1.196 6.873 -4.975 1180 HA VAL 55 HA VAL 55 1.095 6.260 -3.238 1181 HB VAL 55 HB VAL 55 2.452 7.576 -4.801 1182 HG11 VAL 55 1HG1 VAL 55 0.876 5.160 -5.966 1183 HG12 VAL 55 2HG1 VAL 55 2.257 5.088 -4.849 1184 HG13 VAL 55 3HG1 VAL 55 2.500 5.719 -6.514 1185 HG21 VAL 55 3HG2 VAL 55 -0.098 7.538 -6.577 1186 HG22 VAL 55 1HG2 VAL 55 1.537 7.940 -7.153 1187 HG23 VAL 55 2HG2 VAL 55 0.762 9.008 -5.962 1188 H GLY 56 H GLY 56 -0.753 9.094 -4.639 1189 HA2 GLY 56 2HA GLY 56 -1.455 10.920 -3.593 1190 HA3 GLY 56 1HA GLY 56 -1.295 10.010 -2.042 1191 H TYR 57 H TYR 57 1.129 11.170 -4.463 1192 HA TYR 57 HA TYR 57 3.084 11.420 -2.578 1193 HB2 TYR 57 2HB TYR 57 2.974 11.515 -5.361 1194 HB3 TYR 57 1HB TYR 57 3.289 13.243 -5.044 1195 HD1 TYR 57 1HD TYR 57 5.370 13.750 -3.422 1196 HD2 TYR 57 2HD TYR 57 4.666 9.962 -5.336 1197 HE1 TYR 57 1HE TYR 57 7.699 13.098 -2.981 1198 HE2 TYR 57 2HE TYR 57 7.011 9.335 -4.953 1199 HH TYR 57 HH TYR 57 9.216 11.297 -2.941 1200 H GLY 58 H GLY 58 0.678 13.722 -3.526 1201 HA2 GLY 58 2HA GLY 58 0.053 15.309 -1.906 1202 HA3 GLY 58 1HA GLY 58 1.786 15.638 -1.547 1203 H ASP 59 H ASP 59 0.601 15.218 -4.861 1204 HA ASP 59 HA ASP 59 1.555 17.723 -5.642 1205 HB2 ASP 59 2HB ASP 59 1.170 15.718 -7.182 1206 HB3 ASP 59 1HB ASP 59 -0.581 16.060 -7.152 1207 H ARG 60 H ARG 60 -1.893 16.553 -5.427 1208 HA ARG 60 HA ARG 60 -2.672 19.141 -4.451 1209 HB2 ARG 60 2HB ARG 60 -3.708 17.978 -7.077 1210 HB3 ARG 60 1HB ARG 60 -4.822 18.916 -6.036 1211 HG2 ARG 60 2HG ARG 60 -3.687 20.938 -6.262 1212 HG3 ARG 60 1HG ARG 60 -2.127 20.180 -6.681 1213 HD2 ARG 60 2HD ARG 60 -4.588 20.222 -8.551 1214 HD3 ARG 60 1HD ARG 60 -3.158 21.340 -8.660 1215 HE ARG 60 HE ARG 60 -1.821 19.011 -8.679 1216 HH11 ARG 60 1HH2 ARG 60 -4.930 19.606 -10.478 1217 HH12 ARG 60 2HH2 ARG 60 -4.529 18.441 -11.675 1218 HH21 ARG 60 1HH1 ARG 60 -1.330 17.653 -10.267 1219 HH22 ARG 60 2HH1 ARG 60 -2.374 17.317 -11.633 1220 H TYR 61 H TYR 61 -5.037 18.856 -3.643 1221 HA TYR 61 HA TYR 61 -5.378 16.173 -2.659 1222 HB2 TYR 61 2HB TYR 61 -5.975 17.419 -0.365 1223 HB3 TYR 61 1HB TYR 61 -4.258 17.042 -0.727 1224 HD1 TYR 61 1HD TYR 61 -6.792 19.844 -0.867 1225 HD2 TYR 61 2HD TYR 61 -2.634 18.747 -0.877 1226 HE1 TYR 61 1HE TYR 61 -6.175 22.210 -0.640 1227 HE2 TYR 61 2HE TYR 61 -2.005 21.112 -0.626 1228 HH TYR 61 HH TYR 61 -4.475 23.748 -0.520 1229 HA PRO 62 HA PRO 62 -9.428 17.865 -3.703 1230 HB2 PRO 62 2HB PRO 62 -11.082 15.991 -2.415 1231 HB3 PRO 62 1HB PRO 62 -10.131 15.590 -3.886 1232 HG2 PRO 62 2HG PRO 62 -9.419 15.035 -0.955 1233 HG3 PRO 62 1HG PRO 62 -9.344 13.898 -2.362 1234 HD2 PRO 62 2HD PRO 62 -7.147 15.316 -1.389 1235 HD3 PRO 62 1HD PRO 62 -7.333 14.926 -3.162 1236 H VAL 63 H VAL 63 -11.427 18.768 -2.578 1237 HA VAL 63 HA VAL 63 -10.731 19.708 0.112 1238 HB VAL 63 HB VAL 63 -12.400 21.487 -0.255 1239 HG11 VAL 63 1HG1 VAL 63 -11.058 22.718 -1.938 1240 HG12 VAL 63 2HG1 VAL 63 -10.331 21.198 -2.542 1241 HG13 VAL 63 3HG1 VAL 63 -9.970 21.756 -0.870 1242 HG21 VAL 63 3HG2 VAL 63 -13.983 20.296 -1.840 1243 HG22 VAL 63 1HG2 VAL 63 -12.681 20.203 -3.075 1244 HG23 VAL 63 2HG2 VAL 63 -13.331 21.798 -2.583 1245 H THR 64 H THR 64 -13.581 20.335 0.753 1246 HA THR 64 HA THR 64 -14.314 17.715 1.673 1247 HB THR 64 HB THR 64 -15.960 19.232 3.035 1248 HG1 THR 64 1HG THR 64 -15.563 21.323 2.973 1249 HG21 THR 64 3HG2 THR 64 -14.085 19.802 4.633 1250 HG22 THR 64 1HG2 THR 64 -12.872 19.490 3.337 1251 HG23 THR 64 2HG2 THR 64 -13.892 18.149 3.961 1252 H GLU 65 H GLU 65 -15.766 20.547 0.083 1253 HA GLU 65 HA GLU 65 -18.257 19.314 -0.239 1254 HB2 GLU 65 2HB GLU 65 -17.637 21.778 0.188 1255 HB3 GLU 65 1HB GLU 65 -17.324 21.917 -1.575 1256 HG2 GLU 65 2HG GLU 65 -19.679 21.500 -2.080 1257 HG3 GLU 65 1HG GLU 65 -20.009 20.928 -0.404 1258 H GLU 66 H GLU 66 -15.437 18.844 -2.061 1259 HA GLU 66 HA GLU 66 -16.660 18.503 -4.601 1260 HB2 GLU 66 2HB GLU 66 -14.730 17.220 -5.256 1261 HB3 GLU 66 1HB GLU 66 -14.167 18.687 -4.456 1262 HG2 GLU 66 2HG GLU 66 -13.123 17.508 -2.738 1263 HG3 GLU 66 1HG GLU 66 -14.359 16.213 -2.671 1264 H GLY 67 H GLY 67 -16.488 16.801 -1.582 1265 HA2 GLY 67 2HA GLY 67 -17.651 14.997 -0.874 1266 HA3 GLY 67 1HA GLY 67 -18.097 14.585 -2.596 1267 H ARG 68 H ARG 68 -15.430 14.563 -0.151 1268 HA ARG 68 HA ARG 68 -13.371 13.871 -1.843 1269 HB2 ARG 68 2HB ARG 68 -13.039 14.707 0.442 1270 HB3 ARG 68 1HB ARG 68 -13.774 13.224 1.138 1271 HG2 ARG 68 2HG ARG 68 -11.909 11.845 0.453 1272 HG3 ARG 68 1HG ARG 68 -11.226 13.130 -0.588 1273 HD2 ARG 68 2HD ARG 68 -11.425 13.269 2.518 1274 HD3 ARG 68 1HD ARG 68 -9.950 12.801 1.574 1275 HE ARG 68 HE ARG 68 -10.995 15.336 0.597 1276 HH11 ARG 68 1HH2 ARG 68 -8.736 13.939 3.177 1277 HH12 ARG 68 2HH2 ARG 68 -8.578 15.405 3.895 1278 HH21 ARG 68 1HH1 ARG 68 -9.487 17.214 0.985 1279 HH22 ARG 68 2HH1 ARG 68 -8.628 17.278 2.440 1280 H LYS 69 H LYS 69 -16.051 12.053 -1.000 1281 HA LYS 69 HA LYS 69 -15.291 9.397 -1.322 1282 HB2 LYS 69 2HB LYS 69 -17.806 10.936 -2.184 1283 HB3 LYS 69 1HB LYS 69 -17.654 9.147 -2.280 1284 HG2 LYS 69 2HG LYS 69 -17.409 8.899 0.084 1285 HG3 LYS 69 1HG LYS 69 -17.325 10.668 0.378 1286 HD2 LYS 69 2HD LYS 69 -19.603 10.935 0.330 1287 HD3 LYS 69 1HD LYS 69 -19.775 9.938 -1.141 1288 HE2 LYS 69 2HE LYS 69 -21.045 9.001 0.821 1289 HE3 LYS 69 1HE LYS 69 -19.843 7.846 0.126 1290 HZ1 LYS 69 3HZ LYS 69 -18.885 9.489 2.340 1291 HZ2 LYS 69 1HZ LYS 69 -18.630 7.851 1.927 1292 HZ3 LYS 69 2HZ LYS 69 -20.079 8.324 2.700 1293 H VAL 70 H VAL 70 -15.241 12.082 -3.646 1294 HA VAL 70 HA VAL 70 -15.427 10.503 -5.986 1295 HB VAL 70 HB VAL 70 -14.404 13.308 -5.372 1296 HG11 VAL 70 1HG1 VAL 70 -14.441 11.816 -8.082 1297 HG12 VAL 70 2HG1 VAL 70 -13.026 12.582 -7.260 1298 HG13 VAL 70 3HG1 VAL 70 -14.349 13.613 -7.884 1299 HG21 VAL 70 3HG2 VAL 70 -16.472 13.925 -6.628 1300 HG22 VAL 70 1HG2 VAL 70 -16.889 12.867 -5.246 1301 HG23 VAL 70 2HG2 VAL 70 -16.858 12.186 -6.913 1302 H ALA 71 H ALA 71 -12.656 11.939 -4.151 1303 HA ALA 71 HA ALA 71 -10.660 10.630 -5.572 1304 HB1 ALA 71 1HB ALA 71 -9.199 11.016 -3.578 1305 HB2 ALA 71 2HB ALA 71 -10.658 11.375 -2.575 1306 HB3 ALA 71 3HB ALA 71 -10.205 12.474 -3.926 1307 H GLU 72 H GLU 72 -12.432 9.635 -2.637 1308 HA GLU 72 HA GLU 72 -11.214 7.302 -1.967 1309 HB2 GLU 72 2HB GLU 72 -13.250 8.415 -0.802 1310 HB3 GLU 72 1HB GLU 72 -14.266 7.644 -2.057 1311 HG2 GLU 72 2HG GLU 72 -13.165 5.367 -1.176 1312 HG3 GLU 72 1HG GLU 72 -12.719 6.365 0.257 1313 H GLN 73 H GLN 73 -13.773 7.750 -4.419 1314 HA GLN 73 HA GLN 73 -14.126 5.062 -5.020 1315 HB2 GLN 73 2HB GLN 73 -15.785 6.797 -5.638 1316 HB3 GLN 73 1HB GLN 73 -14.586 7.592 -6.699 1317 HG2 GLN 73 2HG GLN 73 -16.237 6.447 -8.056 1318 HG3 GLN 73 1HG GLN 73 -14.654 5.641 -8.288 1319 HE21 GLN 73 1HE2 GLN 73 -14.302 3.569 -6.988 1320 HE22 GLN 73 2HE2 GLN 73 -15.681 2.548 -6.701 1321 H VAL 74 H VAL 74 -11.815 7.468 -6.353 1322 HA VAL 74 HA VAL 74 -11.129 5.728 -8.531 1323 HB VAL 74 HB VAL 74 -9.664 8.216 -7.566 1324 HG11 VAL 74 1HG1 VAL 74 -8.858 8.240 -9.969 1325 HG12 VAL 74 2HG1 VAL 74 -9.742 6.699 -10.288 1326 HG13 VAL 74 3HG1 VAL 74 -8.350 6.727 -9.147 1327 HG21 VAL 74 3HG2 VAL 74 -11.924 7.934 -9.668 1328 HG22 VAL 74 1HG2 VAL 74 -11.033 9.442 -9.225 1329 HG23 VAL 74 2HG2 VAL 74 -12.117 8.679 -8.046 1330 H MET 75 H MET 75 -9.716 6.648 -5.354 1331 HA MET 75 HA MET 75 -7.362 5.147 -5.616 1332 HB2 MET 75 2HB MET 75 -8.985 5.865 -3.102 1333 HB3 MET 75 1HB MET 75 -7.310 5.205 -3.091 1334 HG2 MET 75 2HG MET 75 -6.538 7.167 -4.450 1335 HG3 MET 75 1HG MET 75 -8.156 7.883 -4.381 1336 HE1 MET 75 3HE MET 75 -8.939 7.056 -1.171 1337 HE2 MET 75 1HE MET 75 -9.349 8.629 -1.950 1338 HE3 MET 75 2HE MET 75 -8.468 8.598 -0.392 1339 H LYS 76 H LYS 76 -10.604 4.292 -4.271 1340 HA LYS 76 HA LYS 76 -9.887 1.735 -3.464 1341 HB2 LYS 76 2HB LYS 76 -11.977 2.930 -2.732 1342 HB3 LYS 76 1HB LYS 76 -12.681 2.663 -4.362 1343 HG2 LYS 76 2HG LYS 76 -12.563 0.183 -4.017 1344 HG3 LYS 76 1HG LYS 76 -11.684 0.437 -2.473 1345 HD2 LYS 76 2HD LYS 76 -13.693 1.486 -1.473 1346 HD3 LYS 76 1HD LYS 76 -14.608 1.245 -3.010 1347 HE2 LYS 76 2HE LYS 76 -14.363 -1.237 -2.836 1348 HE3 LYS 76 1HE LYS 76 -13.265 -1.054 -1.417 1349 HZ1 LYS 76 3HZ LYS 76 -15.339 -1.667 -0.638 1350 HZ2 LYS 76 1HZ LYS 76 -16.211 -0.551 -1.498 1351 HZ3 LYS 76 2HZ LYS 76 -15.197 -0.035 -0.230 1352 H ALA 77 H ALA 77 -10.966 2.933 -6.635 1353 HA ALA 77 HA ALA 77 -11.485 0.423 -7.793 1354 HB1 ALA 77 1HB ALA 77 -10.512 3.014 -9.160 1355 HB2 ALA 77 2HB ALA 77 -12.235 2.580 -8.861 1356 HB3 ALA 77 3HB ALA 77 -11.241 1.592 -9.995 1357 H GLY 78 H GLY 78 -8.507 2.366 -7.430 1358 HA2 GLY 78 2HA GLY 78 -6.864 0.767 -9.077 1359 HA3 GLY 78 1HA GLY 78 -6.381 1.882 -7.740 1360 H ILE 79 H ILE 79 -7.535 0.756 -5.558 1361 HA ILE 79 HA ILE 79 -5.807 -1.310 -4.896 1362 HB ILE 79 HB ILE 79 -8.459 -0.508 -3.610 1363 HG12 ILE 79 2HG1 ILE 79 -5.552 0.202 -2.860 1364 HG13 ILE 79 1HG1 ILE 79 -6.662 1.283 -3.742 1365 HG21 ILE 79 1HG2 ILE 79 -7.615 -1.698 -1.546 1366 HG22 ILE 79 2HG2 ILE 79 -6.160 -2.239 -2.454 1367 HG23 ILE 79 3HG2 ILE 79 -7.787 -2.861 -2.893 1368 HD11 ILE 79 3HD ILE 79 -7.053 0.266 -0.850 1369 HD12 ILE 79 1HD ILE 79 -6.625 1.924 -1.376 1370 HD13 ILE 79 2HD ILE 79 -8.254 1.258 -1.764 1371 H GLU 80 H GLU 80 -9.230 -1.455 -6.074 1372 HA GLU 80 HA GLU 80 -9.531 -4.218 -5.679 1373 HB2 GLU 80 2HB GLU 80 -10.835 -2.450 -7.851 1374 HB3 GLU 80 1HB GLU 80 -11.250 -4.165 -7.543 1375 HG2 GLU 80 2HG GLU 80 -11.933 -3.541 -5.172 1376 HG3 GLU 80 1HG GLU 80 -11.743 -1.809 -5.623 1377 H VAL 81 H VAL 81 -8.208 -2.360 -8.447 1378 HA VAL 81 HA VAL 81 -7.941 -4.569 -10.165 1379 HB VAL 81 HB VAL 81 -6.713 -1.785 -10.019 1380 HG11 VAL 81 1HG1 VAL 81 -5.876 -2.182 -12.389 1381 HG12 VAL 81 2HG1 VAL 81 -6.159 -3.945 -12.157 1382 HG13 VAL 81 3HG1 VAL 81 -4.956 -3.075 -11.137 1383 HG21 VAL 81 3HG2 VAL 81 -9.180 -2.078 -10.550 1384 HG22 VAL 81 1HG2 VAL 81 -8.739 -3.144 -11.933 1385 HG23 VAL 81 2HG2 VAL 81 -8.270 -1.410 -11.939 1386 H PHE 82 H PHE 82 -5.527 -2.920 -8.017 1387 HA PHE 82 HA PHE 82 -3.524 -4.812 -8.729 1388 HB2 PHE 82 2HB PHE 82 -3.601 -2.863 -6.341 1389 HB3 PHE 82 1HB PHE 82 -2.147 -3.779 -6.893 1390 HD1 PHE 82 2HD PHE 82 -1.861 -3.559 -9.672 1391 HD2 PHE 82 1HD PHE 82 -3.558 -0.631 -7.012 1392 HE1 PHE 82 2HE PHE 82 -1.386 -1.783 -11.316 1393 HE2 PHE 82 1HE PHE 82 -3.109 1.129 -8.668 1394 HZ PHE 82 HZ PHE 82 -2.007 0.571 -10.824 1395 H ALA 83 H ALA 83 -6.149 -4.972 -6.493 1396 HA ALA 83 HA ALA 83 -4.911 -7.058 -4.911 1397 HB1 ALA 83 1HB ALA 83 -7.830 -6.074 -4.970 1398 HB2 ALA 83 2HB ALA 83 -6.555 -5.529 -3.819 1399 HB3 ALA 83 3HB ALA 83 -7.120 -7.233 -3.778 1400 H LEU 84 H LEU 84 -7.296 -6.725 -7.589 1401 HA LEU 84 HA LEU 84 -8.351 -9.268 -7.463 1402 HB2 LEU 84 2HB LEU 84 -9.337 -7.385 -8.729 1403 HB3 LEU 84 1HB LEU 84 -8.032 -7.465 -9.946 1404 HG LEU 84 HG LEU 84 -9.696 -9.970 -9.411 1405 HD11 LEU 84 1HD1 LEU 84 -10.807 -7.560 -10.987 1406 HD12 LEU 84 2HD1 LEU 84 -11.413 -8.179 -9.405 1407 HD13 LEU 84 3HD1 LEU 84 -11.549 -9.203 -10.878 1408 HD21 LEU 84 3HD2 LEU 84 -8.670 -8.696 -12.044 1409 HD22 LEU 84 1HD2 LEU 84 -9.533 -10.270 -11.890 1410 HD23 LEU 84 2HD2 LEU 84 -7.903 -10.071 -11.171 1411 H VAL 85 H VAL 85 -5.398 -8.089 -9.001 1412 HA VAL 85 HA VAL 85 -4.902 -10.354 -10.540 1413 HB VAL 85 HB VAL 85 -2.571 -9.600 -10.674 1414 HG11 VAL 85 1HG1 VAL 85 -4.482 -8.571 -12.055 1415 HG12 VAL 85 2HG1 VAL 85 -3.090 -7.463 -11.799 1416 HG13 VAL 85 3HG1 VAL 85 -4.596 -7.255 -10.852 1417 HG21 VAL 85 3HG2 VAL 85 -2.381 -8.776 -8.235 1418 HG22 VAL 85 1HG2 VAL 85 -3.454 -7.407 -8.682 1419 HG23 VAL 85 2HG2 VAL 85 -1.841 -7.564 -9.449 1420 H THR 86 H THR 86 -4.946 -10.152 -7.103 1421 HA THR 86 HA THR 86 -3.017 -12.026 -6.422 1422 HB THR 86 HB THR 86 -5.665 -11.509 -5.020 1423 HG1 THR 86 1HG THR 86 -4.676 -9.666 -4.982 1424 HG21 THR 86 3HG2 THR 86 -4.354 -12.253 -2.976 1425 HG22 THR 86 1HG2 THR 86 -2.974 -12.719 -4.036 1426 HG23 THR 86 2HG2 THR 86 -4.551 -13.590 -4.157 1427 H ALA 87 H ALA 87 -6.009 -12.428 -8.199 1428 HA ALA 87 HA ALA 87 -6.379 -15.166 -7.900 1429 HB1 ALA 87 1HB ALA 87 -7.852 -13.701 -9.337 1430 HB2 ALA 87 2HB ALA 87 -7.260 -15.130 -10.255 1431 HB3 ALA 87 3HB ALA 87 -6.522 -13.499 -10.510 1432 H ALA 88 H ALA 88 -4.343 -13.490 -10.361 1433 HA ALA 88 HA ALA 88 -3.075 -15.899 -11.161 1434 HB1 ALA 88 1HB ALA 88 -2.272 -12.975 -11.711 1435 HB2 ALA 88 2HB ALA 88 -3.328 -13.975 -12.773 1436 HB3 ALA 88 3HB ALA 88 -1.595 -14.414 -12.549 1437 H LEU 89 H LEU 89 -2.176 -13.140 -9.069 1438 HA LEU 89 HA LEU 89 0.496 -13.914 -8.840 1439 HB2 LEU 89 2HB LEU 89 -1.261 -11.944 -7.399 1440 HB3 LEU 89 1HB LEU 89 0.254 -12.432 -6.590 1441 HG LEU 89 HG LEU 89 1.623 -11.707 -8.435 1442 HD11 LEU 89 1HD1 LEU 89 0.250 -12.178 -10.437 1443 HD12 LEU 89 2HD1 LEU 89 0.727 -10.451 -10.413 1444 HD13 LEU 89 3HD1 LEU 89 -0.949 -10.919 -9.949 1445 HD21 LEU 89 3HD2 LEU 89 1.230 -9.267 -8.279 1446 HD22 LEU 89 1HD2 LEU 89 0.913 -10.057 -6.691 1447 HD23 LEU 89 2HD2 LEU 89 -0.463 -9.543 -7.723 1448 H ALA 90 H ALA 90 -2.363 -14.913 -6.868 1449 HA ALA 90 HA ALA 90 -0.595 -16.323 -5.065 1450 HB1 ALA 90 1HB ALA 90 -3.640 -16.523 -5.400 1451 HB2 ALA 90 2HB ALA 90 -2.779 -15.481 -4.212 1452 HB3 ALA 90 3HB ALA 90 -2.665 -17.275 -4.079 1453 H THR 91 H THR 91 -2.209 -16.994 -8.152 1454 HA THR 91 HA THR 91 -2.064 -19.852 -7.944 1455 HB THR 91 HB THR 91 -1.680 -18.333 -10.603 1456 HG1 THR 91 1HG THR 91 -3.649 -17.652 -9.353 1457 HG21 THR 91 3HG2 THR 91 -2.990 -20.325 -11.512 1458 HG22 THR 91 1HG2 THR 91 -3.040 -21.028 -9.851 1459 HG23 THR 91 2HG2 THR 91 -1.475 -20.849 -10.721 1460 H ASP 92 H ASP 92 0.217 -17.238 -8.425 1461 HA ASP 92 HA ASP 92 1.816 -18.295 -10.333 1462 HB2 ASP 92 2HB ASP 92 1.849 -15.902 -9.438 1463 HB3 ASP 92 1HB ASP 92 2.935 -16.486 -8.137 1464 H PHE 93 H PHE 93 2.011 -18.839 -6.808 1465 HA PHE 93 HA PHE 93 4.476 -20.172 -6.966 1466 HB2 PHE 93 2HB PHE 93 4.288 -20.827 -4.734 1467 HB3 PHE 93 1HB PHE 93 3.398 -19.272 -4.801 1468 HD1 PHE 93 2HD PHE 93 3.069 -22.953 -4.401 1469 HD2 PHE 93 1HD PHE 93 0.998 -19.201 -4.497 1470 HE1 PHE 93 2HE PHE 93 1.059 -24.049 -3.501 1471 HE2 PHE 93 1HE PHE 93 -1.015 -20.280 -3.549 1472 HZ PHE 93 HZ PHE 93 -0.996 -22.713 -3.050 1473 H VAL 94 H VAL 94 1.291 -21.244 -7.871 1474 HA VAL 94 HA VAL 94 1.779 -24.030 -7.391 1475 HB VAL 94 HB VAL 94 -0.432 -22.768 -9.101 1476 HG11 VAL 94 1HG1 VAL 94 -0.243 -25.410 -7.482 1477 HG12 VAL 94 2HG1 VAL 94 -0.227 -25.269 -9.275 1478 HG13 VAL 94 3HG1 VAL 94 -1.706 -24.827 -8.354 1479 HG21 VAL 94 3HG2 VAL 94 -0.453 -21.601 -6.881 1480 HG22 VAL 94 1HG2 VAL 94 -0.360 -23.191 -6.040 1481 HG23 VAL 94 2HG2 VAL 94 -1.820 -22.752 -6.992 1482 H ARG 95 H ARG 95 2.535 -21.656 -9.818 1483 HA ARG 95 HA ARG 95 2.408 -23.362 -12.073 1484 HB2 ARG 95 2HB ARG 95 2.500 -20.695 -11.979 1485 HB3 ARG 95 1HB ARG 95 4.265 -20.929 -11.859 1486 HG2 ARG 95 2HG ARG 95 3.815 -20.547 -14.175 1487 HG3 ARG 95 1HG ARG 95 4.105 -22.309 -14.039 1488 HD2 ARG 95 2HD ARG 95 1.464 -22.533 -13.895 1489 HD3 ARG 95 1HD ARG 95 1.419 -20.802 -14.410 1490 HE ARG 95 HE ARG 95 2.718 -23.095 -15.992 1491 HH11 ARG 95 1HH2 ARG 95 0.931 -19.863 -16.167 1492 HH12 ARG 95 2HH2 ARG 95 0.853 -19.978 -17.815 1493 HH21 ARG 95 1HH1 ARG 95 2.251 -23.277 -18.087 1494 HH22 ARG 95 2HH1 ARG 95 1.293 -22.109 -18.977 1495 H ARG 96 H ARG 96 4.618 -23.106 -9.397 1496 HA ARG 96 HA ARG 96 6.908 -23.846 -10.789 1497 HB2 ARG 96 2HB ARG 96 8.097 -24.222 -8.823 1498 HB3 ARG 96 1HB ARG 96 7.042 -22.802 -8.580 1499 HG2 ARG 96 2HG ARG 96 5.422 -24.423 -7.346 1500 HG3 ARG 96 1HG ARG 96 6.738 -25.636 -7.391 1501 HD2 ARG 96 2HD ARG 96 8.242 -24.214 -6.041 1502 HD3 ARG 96 1HD ARG 96 7.174 -22.790 -6.277 1503 HE ARG 96 HE ARG 96 5.608 -23.612 -4.744 1504 HH11 ARG 96 1HH2 ARG 96 8.291 -26.056 -5.025 1505 HH12 ARG 96 2HH2 ARG 96 8.005 -26.705 -3.457 1506 HH21 ARG 96 1HH1 ARG 96 5.581 -24.287 -2.431 1507 HH22 ARG 96 2HH1 ARG 96 6.405 -25.694 -1.956 1508 H GLU 97 H GLU 97 4.137 -25.720 -10.461 1509 HA GLU 97 HA GLU 97 5.185 -28.320 -10.369 1510 HB2 GLU 97 2HB GLU 97 2.951 -27.204 -12.206 1511 HB3 GLU 97 1HB GLU 97 3.402 -28.938 -12.090 1512 HG2 GLU 97 2HG GLU 97 2.758 -28.900 -9.638 1513 HG3 GLU 97 1HG GLU 97 2.085 -27.247 -9.882 1514 H GLU 98 H GLU 98 4.932 -25.925 -13.058 1515 HA GLU 98 HA GLU 98 5.945 -27.857 -14.934 1516 HB2 GLU 98 2HB GLU 98 5.455 -24.850 -15.364 1517 HB3 GLU 98 1HB GLU 98 5.720 -26.121 -16.611 1518 HG2 GLU 98 2HG GLU 98 3.654 -27.334 -15.561 1519 HG3 GLU 98 1HG GLU 98 3.301 -25.771 -14.716 1520 H GLU 99 H GLU 99 7.159 -25.082 -13.060 1521 HA GLU 99 HA GLU 99 9.644 -24.951 -14.371 1522 HB2 GLU 99 2HB GLU 99 8.631 -23.143 -12.884 1523 HB3 GLU 99 1HB GLU 99 9.098 -24.126 -11.459 1524 HG2 GLU 99 2HG GLU 99 11.507 -23.907 -12.072 1525 HG3 GLU 99 1HG GLU 99 11.064 -23.073 -13.606 1526 H ARG 100 H ARG 100 8.428 -26.987 -11.657 1527 HA ARG 100 HA ARG 100 10.939 -27.780 -10.800 1528 HB2 ARG 100 2HB ARG 100 8.769 -28.165 -9.534 1529 HB3 ARG 100 1HB ARG 100 8.442 -29.560 -10.617 1530 HG2 ARG 100 2HG ARG 100 10.622 -30.606 -9.819 1531 HG3 ARG 100 1HG ARG 100 10.931 -29.132 -8.838 1532 HD2 ARG 100 2HD ARG 100 8.832 -29.654 -7.475 1533 HD3 ARG 100 1HD ARG 100 8.671 -31.214 -8.382 1534 HE ARG 100 HE ARG 100 11.030 -30.340 -6.652 1535 HH11 ARG 100 1HH2 ARG 100 9.021 -33.141 -7.826 1536 HH12 ARG 100 2HH2 ARG 100 10.251 -34.274 -7.496 1537 HH21 ARG 100 1HH1 ARG 100 12.582 -31.983 -6.035 1538 HH22 ARG 100 2HH1 ARG 100 12.283 -33.622 -6.400 1539 H ARG 101 H ARG 101 8.838 -29.169 -13.328 1540 HA ARG 101 HA ARG 101 10.713 -31.332 -13.841 1541 HB2 ARG 101 2HB ARG 101 8.221 -30.354 -15.365 1542 HB3 ARG 101 1HB ARG 101 9.093 -31.875 -15.727 1543 HG2 ARG 101 2HG ARG 101 7.690 -31.252 -13.042 1544 HG3 ARG 101 1HG ARG 101 6.907 -32.068 -14.437 1545 HD2 ARG 101 2HD ARG 101 8.445 -33.976 -14.335 1546 HD3 ARG 101 1HD ARG 101 9.436 -33.167 -13.037 1547 HE ARG 101 HE ARG 101 6.594 -33.462 -12.300 1548 HH11 ARG 101 1HH2 ARG 101 9.388 -35.555 -12.948 1549 HH12 ARG 101 2HH2 ARG 101 8.968 -36.731 -11.837 1550 HH21 ARG 101 1HH1 ARG 101 6.232 -34.890 -10.400 1551 HH22 ARG 101 2HH1 ARG 101 7.201 -36.275 -10.174 1552 H GLY 102 H GLY 102 10.006 -28.066 -14.978 1553 HA2 GLY 102 2HA GLY 102 11.249 -26.747 -16.259 1554 HA3 GLY 102 1HA GLY 102 12.264 -28.145 -16.786 1555 H HIS 103 H HIS 103 8.770 -28.597 -16.843 1556 HA HIS 103 HA HIS 103 8.168 -27.455 -19.234 1557 HB2 HIS 103 2HB HIS 103 9.688 -29.324 -20.250 1558 HB3 HIS 103 1HB HIS 103 8.507 -30.510 -19.618 1559 HD1 HIS 103 1HD HIS 103 5.762 -29.694 -20.655 1560 HD2 HIS 103 2HD HIS 103 9.243 -28.436 -22.735 1561 HE1 HIS 103 1HE HIS 103 5.087 -29.141 -22.952 1562 HE2 HIS 103 2HE HIS 103 7.169 -28.372 -24.208 1563 H1 SER 1 H SER 1 15.145 -23.281 -6.842 1564 HA SER 1 HA SER 1 16.136 -24.630 -5.262 1565 HB2 SER 1 2HB SER 1 16.526 -22.095 -3.537 1566 HB3 SER 1 1HB SER 1 16.947 -23.785 -3.063 1567 HG SER 1 1HG SER 1 18.549 -23.811 -4.479 1568 H ALA 2 H ALA 2 14.395 -21.765 -3.935 1569 HA ALA 2 HA ALA 2 12.357 -23.562 -2.889 1570 HB1 ALA 2 1HB ALA 2 12.391 -20.492 -2.795 1571 HB2 ALA 2 2HB ALA 2 13.218 -21.527 -1.584 1572 HB3 ALA 2 3HB ALA 2 11.441 -21.634 -1.771 1573 H ASP 3 H ASP 3 13.053 -22.342 -5.824 1574 HA ASP 3 HA ASP 3 12.112 -21.486 -7.596 1575 HB2 ASP 3 2HB ASP 3 10.048 -23.669 -7.147 1576 HB3 ASP 3 1HB ASP 3 10.585 -22.951 -8.712 1577 H HIS 4 H HIS 4 11.723 -19.669 -5.982 1578 HA HIS 4 HA HIS 4 9.413 -18.329 -6.662 1579 HB2 HIS 4 2HB HIS 4 8.122 -18.117 -4.624 1580 HB3 HIS 4 1HB HIS 4 8.192 -19.834 -5.054 1581 HD1 HIS 4 1HD HIS 4 9.623 -17.432 -2.386 1582 HD2 HIS 4 2HD HIS 4 8.729 -21.503 -2.942 1583 HE1 HIS 4 1HE HIS 4 9.839 -18.556 -0.136 1584 HE2 HIS 4 2HE HIS 4 9.173 -20.901 -0.424 1585 H GLU 5 H GLU 5 11.754 -18.936 -4.033 1586 HA GLU 5 HA GLU 5 11.932 -16.321 -3.140 1587 HB2 GLU 5 2HB GLU 5 12.459 -18.444 -1.910 1588 HB3 GLU 5 1HB GLU 5 13.931 -18.667 -2.911 1589 HG2 GLU 5 2HG GLU 5 14.969 -16.662 -1.864 1590 HG3 GLU 5 1HG GLU 5 13.445 -16.324 -0.953 1591 H ARG 6 H ARG 6 13.870 -18.166 -5.417 1592 HA ARG 6 HA ARG 6 15.974 -16.498 -5.918 1593 HB2 ARG 6 2HB ARG 6 15.632 -18.885 -6.657 1594 HB3 ARG 6 1HB ARG 6 14.392 -18.345 -7.839 1595 HG2 ARG 6 2HG ARG 6 16.133 -17.120 -9.124 1596 HG3 ARG 6 1HG ARG 6 17.381 -17.578 -7.918 1597 HD2 ARG 6 2HD ARG 6 15.742 -19.563 -9.668 1598 HD3 ARG 6 1HD ARG 6 17.442 -19.061 -9.981 1599 HE ARG 6 HE ARG 6 16.441 -20.943 -7.914 1600 HH11 ARG 6 1HH2 ARG 6 19.360 -19.426 -9.392 1601 HH12 ARG 6 2HH2 ARG 6 20.404 -19.862 -8.147 1602 HH21 ARG 6 1HH1 ARG 6 18.079 -21.823 -6.254 1603 HH22 ARG 6 2HH1 ARG 6 19.710 -21.441 -6.516 1604 H GLU 7 H GLU 7 12.735 -16.576 -7.606 1605 HA GLU 7 HA GLU 7 13.508 -14.441 -9.298 1606 HB2 GLU 7 2HB GLU 7 11.873 -16.251 -9.968 1607 HB3 GLU 7 1HB GLU 7 10.678 -15.495 -8.858 1608 HG2 GLU 7 2HG GLU 7 10.189 -14.803 -11.122 1609 HG3 GLU 7 1HG GLU 7 10.834 -13.359 -10.273 1610 H ALA 8 H ALA 8 11.824 -14.703 -6.165 1611 HA ALA 8 HA ALA 8 10.784 -12.099 -6.120 1612 HB1 ALA 8 1HB ALA 8 10.107 -13.820 -4.430 1613 HB2 ALA 8 2HB ALA 8 10.740 -12.335 -3.629 1614 HB3 ALA 8 3HB ALA 8 11.779 -13.802 -3.744 1615 H GLN 9 H GLN 9 13.985 -13.390 -5.064 1616 HA GLN 9 HA GLN 9 14.880 -10.832 -4.157 1617 HB2 GLN 9 2HB GLN 9 16.465 -13.349 -4.943 1618 HB3 GLN 9 1HB GLN 9 17.188 -11.899 -4.171 1619 HG2 GLN 9 2HG GLN 9 14.996 -13.645 -2.838 1620 HG3 GLN 9 1HG GLN 9 16.766 -13.807 -2.571 1621 HE21 GLN 9 1HE2 GLN 9 13.956 -11.587 -2.128 1622 HE22 GLN 9 2HE2 GLN 9 14.787 -10.365 -1.274 1623 H LYS 10 H LYS 10 15.119 -12.589 -7.245 1624 HA LYS 10 HA LYS 10 16.911 -10.848 -8.501 1625 HB2 LYS 10 2HB LYS 10 16.306 -13.100 -9.357 1626 HB3 LYS 10 1HB LYS 10 14.604 -12.574 -9.578 1627 HG2 LYS 10 2HG LYS 10 15.228 -11.046 -11.375 1628 HG3 LYS 10 1HG LYS 10 16.977 -11.400 -11.157 1629 HD2 LYS 10 2HD LYS 10 16.750 -13.665 -11.927 1630 HD3 LYS 10 1HD LYS 10 14.977 -13.682 -11.671 1631 HE2 LYS 10 2HE LYS 10 16.397 -12.049 -13.891 1632 HE3 LYS 10 1HE LYS 10 15.558 -13.642 -14.081 1633 HZ1 LYS 10 3HZ LYS 10 13.983 -12.195 -14.669 1634 HZ2 LYS 10 1HZ LYS 10 14.372 -10.980 -13.591 1635 HZ3 LYS 10 2HZ LYS 10 13.559 -12.415 -13.042 1636 H ALA 11 H ALA 11 13.351 -10.755 -8.119 1637 HA ALA 11 HA ALA 11 12.864 -8.632 -9.840 1638 HB1 ALA 11 1HB ALA 11 11.050 -10.102 -8.886 1639 HB2 ALA 11 2HB ALA 11 10.701 -8.355 -8.636 1640 HB3 ALA 11 3HB ALA 11 11.319 -9.355 -7.271 1641 H GLU 12 H GLU 12 13.883 -8.634 -6.388 1642 HA GLU 12 HA GLU 12 13.437 -5.930 -5.883 1643 HB2 GLU 12 2HB GLU 12 15.733 -7.653 -4.748 1644 HB3 GLU 12 1HB GLU 12 15.259 -6.020 -4.180 1645 HG2 GLU 12 2HG GLU 12 12.947 -6.994 -3.577 1646 HG3 GLU 12 1HG GLU 12 13.655 -8.630 -3.869 1647 H GLU 13 H GLU 13 16.217 -7.602 -7.426 1648 HA GLU 13 HA GLU 13 17.879 -5.333 -7.375 1649 HB2 GLU 13 2HB GLU 13 18.074 -7.667 -9.370 1650 HB3 GLU 13 1HB GLU 13 19.351 -6.493 -8.895 1651 HG2 GLU 13 2HG GLU 13 18.982 -7.448 -6.443 1652 HG3 GLU 13 1HG GLU 13 18.164 -8.826 -7.275 1653 H GLU 14 H GLU 14 15.258 -6.273 -9.497 1654 HA GLU 14 HA GLU 14 16.220 -4.691 -11.689 1655 HB2 GLU 14 2HB GLU 14 14.804 -6.680 -12.034 1656 HB3 GLU 14 1HB GLU 14 13.410 -5.840 -11.280 1657 HG2 GLU 14 2HG GLU 14 13.109 -4.400 -13.132 1658 HG3 GLU 14 1HG GLU 14 14.855 -4.407 -13.561 1659 H LEU 15 H LEU 15 14.192 -4.207 -8.817 1660 HA LEU 15 HA LEU 15 13.097 -1.762 -9.639 1661 HB2 LEU 15 2HB LEU 15 12.245 -3.141 -7.705 1662 HB3 LEU 15 1HB LEU 15 13.702 -2.694 -6.766 1663 HG LEU 15 HG LEU 15 13.020 -0.325 -6.740 1664 HD11 LEU 15 1HD1 LEU 15 11.994 0.010 -8.932 1665 HD12 LEU 15 2HD1 LEU 15 10.754 0.377 -7.697 1666 HD13 LEU 15 3HD1 LEU 15 10.696 -1.192 -8.577 1667 HD21 LEU 15 3HD2 LEU 15 10.675 -2.202 -6.009 1668 HD22 LEU 15 1HD2 LEU 15 10.921 -0.533 -5.385 1669 HD23 LEU 15 2HD2 LEU 15 12.106 -1.827 -4.982 1670 H GLN 16 H GLN 16 16.121 -2.604 -7.946 1671 HA GLN 16 HA GLN 16 17.005 -0.046 -7.321 1672 HB2 GLN 16 2HB GLN 16 18.727 -2.437 -8.242 1673 HB3 GLN 16 1HB GLN 16 19.337 -0.971 -7.404 1674 HG2 GLN 16 2HG GLN 16 17.990 -1.586 -5.356 1675 HG3 GLN 16 1HG GLN 16 17.425 -3.078 -6.195 1676 HE21 GLN 16 1HE2 GLN 16 20.266 -1.464 -4.658 1677 HE22 GLN 16 2HE2 GLN 16 21.298 -2.843 -4.748 1678 H LYS 17 H LYS 17 17.214 -1.857 -10.381 1679 HA LYS 17 HA LYS 17 19.063 -0.138 -11.641 1680 HB2 LYS 17 2HB LYS 17 18.540 -2.502 -12.404 1681 HB3 LYS 17 1HB LYS 17 16.915 -1.941 -12.918 1682 HG2 LYS 17 2HG LYS 17 18.032 -0.352 -14.569 1683 HG3 LYS 17 1HG LYS 17 19.630 -0.946 -14.018 1684 HD2 LYS 17 2HD LYS 17 19.047 -1.942 -16.130 1685 HD3 LYS 17 1HD LYS 17 19.086 -3.239 -14.884 1686 HE2 LYS 17 2HE LYS 17 16.647 -3.441 -14.876 1687 HE3 LYS 17 1HE LYS 17 16.447 -1.875 -15.765 1688 HZ1 LYS 17 3HZ LYS 17 17.760 -4.301 -16.922 1689 HZ2 LYS 17 1HZ LYS 17 17.340 -2.823 -17.702 1690 HZ3 LYS 17 2HZ LYS 17 16.147 -3.915 -17.125 1691 H VAL 18 H VAL 18 15.493 -0.276 -11.506 1692 HA VAL 18 HA VAL 18 14.985 1.723 -13.384 1693 HB VAL 18 HB VAL 18 13.331 0.781 -10.986 1694 HG11 VAL 18 1HG1 VAL 18 12.509 3.035 -11.659 1695 HG12 VAL 18 2HG1 VAL 18 11.366 1.780 -12.236 1696 HG13 VAL 18 3HG1 VAL 18 12.512 2.550 -13.397 1697 HG21 VAL 18 3HG2 VAL 18 13.225 0.093 -14.011 1698 HG22 VAL 18 1HG2 VAL 18 12.120 -0.547 -12.739 1699 HG23 VAL 18 2HG2 VAL 18 13.857 -0.991 -12.726 1700 H LEU 19 H LEU 19 15.611 1.897 -9.844 1701 HA LEU 19 HA LEU 19 15.018 4.557 -9.436 1702 HB2 LEU 19 2HB LEU 19 17.421 3.026 -8.241 1703 HB3 LEU 19 1HB LEU 19 16.748 4.560 -7.601 1704 HG LEU 19 HG LEU 19 15.261 1.874 -7.697 1705 HD11 LEU 19 1HD1 LEU 19 17.185 1.862 -6.098 1706 HD12 LEU 19 2HD1 LEU 19 15.598 1.810 -5.249 1707 HD13 LEU 19 3HD1 LEU 19 16.538 3.344 -5.308 1708 HD21 LEU 19 3HD2 LEU 19 14.489 4.621 -6.543 1709 HD22 LEU 19 1HD2 LEU 19 13.669 3.080 -6.114 1710 HD23 LEU 19 2HD2 LEU 19 13.620 3.685 -7.808 1711 H GLU 20 H GLU 20 18.066 3.124 -10.707 1712 HA GLU 20 HA GLU 20 19.482 5.580 -10.592 1713 HB2 GLU 20 2HB GLU 20 20.099 3.053 -12.227 1714 HB3 GLU 20 1HB GLU 20 21.140 4.513 -12.133 1715 HG2 GLU 20 2HG GLU 20 21.182 4.202 -9.566 1716 HG3 GLU 20 1HG GLU 20 20.446 2.577 -9.825 1717 H GLU 21 H GLU 21 17.678 3.872 -13.175 1718 HA GLU 21 HA GLU 21 18.312 5.789 -15.162 1719 HB2 GLU 21 2HB GLU 21 16.070 3.684 -15.085 1720 HB3 GLU 21 1HB GLU 21 16.556 4.641 -16.527 1721 HG2 GLU 21 2HG GLU 21 18.889 3.674 -16.359 1722 HG3 GLU 21 1HG GLU 21 18.354 2.631 -14.996 1723 H ALA 22 H ALA 22 15.648 5.388 -12.836 1724 HA ALA 22 HA ALA 22 13.943 7.361 -13.729 1725 HB1 ALA 22 1HB ALA 22 13.291 5.716 -11.978 1726 HB2 ALA 22 2HB ALA 22 13.080 7.393 -11.345 1727 HB3 ALA 22 3HB ALA 22 14.497 6.406 -10.853 1728 H SER 23 H SER 23 16.806 7.579 -11.636 1729 HA SER 23 HA SER 23 16.400 10.226 -10.790 1730 HB2 SER 23 2HB SER 23 19.090 8.770 -11.251 1731 HB3 SER 23 1HB SER 23 18.815 10.211 -10.201 1732 HG SER 23 1HG SER 23 17.787 7.555 -9.878 1733 H LYS 24 H LYS 24 17.943 8.834 -13.698 1734 HA LYS 24 HA LYS 24 19.071 11.280 -14.605 1735 HB2 LYS 24 2HB LYS 24 19.629 8.735 -15.239 1736 HB3 LYS 24 1HB LYS 24 18.407 8.958 -16.508 1737 HG2 LYS 24 2HG LYS 24 20.940 10.696 -16.070 1738 HG3 LYS 24 1HG LYS 24 20.845 9.271 -17.150 1739 HD2 LYS 24 2HD LYS 24 19.131 10.425 -18.561 1740 HD3 LYS 24 1HD LYS 24 19.290 11.906 -17.542 1741 HE2 LYS 24 2HE LYS 24 21.708 12.108 -18.155 1742 HE3 LYS 24 1HE LYS 24 21.612 10.586 -19.119 1743 HZ1 LYS 24 3HZ LYS 24 20.132 13.134 -19.702 1744 HZ2 LYS 24 1HZ LYS 24 20.090 11.714 -20.638 1745 HZ3 LYS 24 2HZ LYS 24 21.518 12.583 -20.473 1746 H LYS 25 H LYS 25 16.123 9.346 -15.308 1747 HA LYS 25 HA LYS 25 15.192 11.158 -17.265 1748 HB2 LYS 25 2HB LYS 25 13.823 8.939 -15.694 1749 HB3 LYS 25 1HB LYS 25 12.891 9.993 -16.809 1750 HG2 LYS 25 2HG LYS 25 15.393 8.454 -17.732 1751 HG3 LYS 25 1HG LYS 25 13.745 7.745 -17.763 1752 HD2 LYS 25 2HD LYS 25 12.912 9.484 -19.261 1753 HD3 LYS 25 1HD LYS 25 14.472 10.377 -19.205 1754 HE2 LYS 25 2HE LYS 25 15.646 8.571 -20.413 1755 HE3 LYS 25 1HE LYS 25 14.186 7.507 -20.332 1756 HZ1 LYS 25 3HZ LYS 25 14.602 8.726 -22.488 1757 HZ2 LYS 25 1HZ LYS 25 14.132 10.156 -21.735 1758 HZ3 LYS 25 2HZ LYS 25 13.038 8.858 -21.805 1759 H ALA 26 H ALA 26 14.426 10.884 -13.723 1760 HA ALA 26 HA ALA 26 12.481 12.855 -13.734 1761 HB1 ALA 26 1HB ALA 26 12.858 11.336 -11.780 1762 HB2 ALA 26 2HB ALA 26 12.899 13.062 -11.276 1763 HB3 ALA 26 3HB ALA 26 14.439 12.135 -11.459 1764 H VAL 27 H VAL 27 16.069 13.172 -13.224 1765 HA VAL 27 HA VAL 27 15.809 15.911 -12.636 1766 HB VAL 27 HB VAL 27 17.777 14.540 -11.983 1767 HG11 VAL 27 1HG1 VAL 27 18.694 14.903 -14.926 1768 HG12 VAL 27 2HG1 VAL 27 18.204 13.351 -14.156 1769 HG13 VAL 27 3HG1 VAL 27 19.651 14.234 -13.575 1770 HG21 VAL 27 3HG2 VAL 27 18.287 17.148 -13.572 1771 HG22 VAL 27 1HG2 VAL 27 19.382 16.419 -12.357 1772 HG23 VAL 27 2HG2 VAL 27 17.750 17.016 -11.856 1773 H GLU 28 H GLU 28 16.320 14.131 -15.718 1774 HA GLU 28 HA GLU 28 16.819 16.577 -17.096 1775 HB2 GLU 28 2HB GLU 28 17.785 14.297 -17.607 1776 HB3 GLU 28 1HB GLU 28 16.229 13.860 -18.373 1777 HG2 GLU 28 2HG GLU 28 16.532 15.495 -20.140 1778 HG3 GLU 28 1HG GLU 28 17.730 16.442 -19.182 1779 H ALA 29 H ALA 29 14.010 14.678 -16.283 1780 HA ALA 29 HA ALA 29 12.222 15.742 -18.155 1781 HB1 ALA 29 1HB ALA 29 10.491 14.873 -16.595 1782 HB2 ALA 29 2HB ALA 29 11.712 14.683 -15.297 1783 HB3 ALA 29 3HB ALA 29 11.775 13.676 -16.793 1784 H GLU 30 H GLU 30 13.117 16.697 -14.782 1785 HA GLU 30 HA GLU 30 11.383 18.916 -14.732 1786 HB2 GLU 30 2HB GLU 30 13.823 18.140 -13.073 1787 HB3 GLU 30 1HB GLU 30 12.867 19.615 -12.723 1788 HG2 GLU 30 2HG GLU 30 11.261 17.052 -13.022 1789 HG3 GLU 30 1HG GLU 30 12.354 17.128 -11.616 1790 H ARG 31 H ARG 31 14.606 18.553 -16.121 1791 HA ARG 31 HA ARG 31 15.220 21.353 -16.092 1792 HB2 ARG 31 2HB ARG 31 16.264 19.067 -17.850 1793 HB3 ARG 31 1HB ARG 31 16.879 20.744 -17.987 1794 HG2 ARG 31 2HG ARG 31 16.971 19.175 -15.355 1795 HG3 ARG 31 1HG ARG 31 18.254 19.043 -16.613 1796 HD2 ARG 31 2HD ARG 31 18.800 21.459 -16.404 1797 HD3 ARG 31 1HD ARG 31 17.430 21.691 -15.233 1798 HE ARG 31 HE ARG 31 19.129 19.556 -14.313 1799 HH11 ARG 31 1HH2 ARG 31 19.555 23.099 -14.849 1800 HH12 ARG 31 2HH2 ARG 31 20.246 23.369 -13.321 1801 HH21 ARG 31 1HH1 ARG 31 20.216 19.979 -12.214 1802 HH22 ARG 31 2HH1 ARG 31 20.532 21.603 -11.753 1803 H GLY 32 H GLY 32 13.245 22.336 -16.811 1804 HA2 GLY 32 2HA GLY 32 13.078 23.436 -19.164 1805 HA3 GLY 32 1HA GLY 32 12.380 21.800 -19.521 1806 H ALA 33 H ALA 33 11.468 21.559 -16.629 1807 HA ALA 33 HA ALA 33 8.881 22.393 -17.347 1808 HB1 ALA 33 1HB ALA 33 9.270 20.198 -16.215 1809 HB2 ALA 33 2HB ALA 33 8.163 21.232 -15.237 1810 HB3 ALA 33 3HB ALA 33 9.888 21.059 -14.759 1811 HA PRO 34 HA PRO 34 9.061 26.063 -14.808 1812 HB2 PRO 34 2HB PRO 34 6.386 26.872 -14.815 1813 HB3 PRO 34 1HB PRO 34 7.456 26.981 -16.266 1814 HG2 PRO 34 2HG PRO 34 5.454 24.764 -15.572 1815 HG3 PRO 34 1HG PRO 34 5.655 25.630 -17.158 1816 HD2 PRO 34 2HD PRO 34 6.808 23.159 -16.652 1817 HD3 PRO 34 1HD PRO 34 7.664 24.407 -17.660 1818 H GLY 35 H GLY 35 9.128 26.385 -12.522 1819 HA2 GLY 35 2HA GLY 35 8.345 26.332 -10.423 1820 HA3 GLY 35 1HA GLY 35 6.934 25.332 -10.949 1821 H ALA 36 H ALA 36 10.093 24.405 -12.012 1822 HA ALA 36 HA ALA 36 9.831 21.841 -10.939 1823 HB1 ALA 36 1HB ALA 36 11.129 22.277 -13.036 1824 HB2 ALA 36 2HB ALA 36 12.141 21.452 -11.806 1825 HB3 ALA 36 3HB ALA 36 12.339 23.225 -12.088 1826 H ALA 37 H ALA 37 10.895 20.804 -9.320 1827 HA ALA 37 HA ALA 37 11.930 22.589 -7.170 1828 HB1 ALA 37 1HB ALA 37 11.030 20.857 -5.569 1829 HB2 ALA 37 2HB ALA 37 10.380 19.917 -6.971 1830 HB3 ALA 37 3HB ALA 37 9.716 21.541 -6.593 1831 H LEU 38 H LEU 38 12.101 19.469 -8.906 1832 HA LEU 38 HA LEU 38 14.274 18.436 -7.308 1833 HB2 LEU 38 2HB LEU 38 12.542 17.576 -9.670 1834 HB3 LEU 38 1HB LEU 38 13.975 16.587 -9.292 1835 HG LEU 38 HG LEU 38 12.102 17.173 -7.011 1836 HD11 LEU 38 1HD1 LEU 38 10.542 15.340 -7.652 1837 HD12 LEU 38 2HD1 LEU 38 11.352 15.191 -9.254 1838 HD13 LEU 38 3HD1 LEU 38 10.476 16.706 -8.825 1839 HD21 LEU 38 3HD2 LEU 38 14.249 15.766 -6.849 1840 HD22 LEU 38 1HD2 LEU 38 13.512 14.597 -8.006 1841 HD23 LEU 38 2HD2 LEU 38 12.740 14.876 -6.408 1842 H ILE 39 H ILE 39 14.490 20.897 -9.203 1843 HA ILE 39 HA ILE 39 16.035 19.958 -11.388 1844 HB ILE 39 HB ILE 39 14.534 21.722 -11.707 1845 HG12 ILE 39 2HG1 ILE 39 17.368 22.881 -11.970 1846 HG13 ILE 39 1HG1 ILE 39 16.686 21.584 -13.013 1847 HG21 ILE 39 1HG2 ILE 39 16.110 23.387 -9.636 1848 HG22 ILE 39 2HG2 ILE 39 14.454 22.716 -9.435 1849 HG23 ILE 39 3HG2 ILE 39 14.754 23.970 -10.664 1850 HD11 ILE 39 3HD ILE 39 15.498 24.425 -12.710 1851 HD12 ILE 39 1HD ILE 39 16.435 23.808 -14.114 1852 HD13 ILE 39 2HD ILE 39 14.820 23.101 -13.725 1853 H SER 40 H SER 40 17.521 18.714 -10.112 1854 HA SER 40 HA SER 40 19.937 20.230 -9.408 1855 HB2 SER 40 2HB SER 40 18.626 17.973 -7.752 1856 HB3 SER 40 1HB SER 40 20.265 18.666 -7.410 1857 HG SER 40 1HG SER 40 18.547 19.404 -6.138 1858 H TYR 41 H TYR 41 20.327 17.102 -8.459 1859 HA TYR 41 HA TYR 41 20.071 15.433 -10.363 1860 HB2 TYR 41 2HB TYR 41 21.700 16.618 -11.925 1861 HB3 TYR 41 1HB TYR 41 23.011 16.253 -10.757 1862 HD1 TYR 41 1HD TYR 41 20.395 13.547 -11.129 1863 HD2 TYR 41 2HD TYR 41 24.047 15.192 -12.758 1864 HE1 TYR 41 1HE TYR 41 20.748 11.509 -12.363 1865 HE2 TYR 41 2HE TYR 41 24.391 13.100 -14.011 1866 HH TYR 41 HH TYR 41 22.187 10.288 -13.697 1867 HA PRO 42 HA PRO 42 23.155 13.579 -7.482 1868 HB2 PRO 42 2HB PRO 42 24.220 14.963 -5.223 1869 HB3 PRO 42 1HB PRO 42 25.042 14.756 -6.811 1870 HG2 PRO 42 2HG PRO 42 23.347 17.126 -5.860 1871 HG3 PRO 42 1HG PRO 42 24.955 17.151 -6.698 1872 HD2 PRO 42 2HD PRO 42 22.649 17.571 -8.107 1873 HD3 PRO 42 1HD PRO 42 23.950 16.504 -8.809 1874 H ASP 43 H ASP 43 20.676 15.749 -6.142 1875 HA ASP 43 HA ASP 43 20.108 13.683 -4.148 1876 HB2 ASP 43 2HB ASP 43 18.670 15.351 -3.034 1877 HB3 ASP 43 1HB ASP 43 20.413 15.779 -3.065 1878 H ALA 44 H ALA 44 19.586 13.896 -7.264 1879 HA ALA 44 HA ALA 44 16.721 13.812 -7.382 1880 HB1 ALA 44 1HB ALA 44 18.030 14.331 -9.462 1881 HB2 ALA 44 2HB ALA 44 17.009 12.867 -9.676 1882 HB3 ALA 44 3HB ALA 44 18.779 12.691 -9.391 1883 H ILE 45 H ILE 45 19.394 11.517 -6.936 1884 HA ILE 45 HA ILE 45 17.832 9.205 -7.183 1885 HB ILE 45 HB ILE 45 20.226 9.217 -7.537 1886 HG12 ILE 45 2HG1 ILE 45 19.426 7.358 -5.214 1887 HG13 ILE 45 1HG1 ILE 45 19.017 7.124 -6.945 1888 HG21 ILE 45 1HG2 ILE 45 20.864 10.906 -5.768 1889 HG22 ILE 45 2HG2 ILE 45 21.850 9.422 -5.675 1890 HG23 ILE 45 3HG2 ILE 45 20.531 9.679 -4.490 1891 HD11 ILE 45 3HD ILE 45 21.871 7.177 -5.743 1892 HD12 ILE 45 1HD ILE 45 20.977 5.740 -6.351 1893 HD13 ILE 45 2HD ILE 45 21.487 7.030 -7.502 1894 H TRP 46 H TRP 46 18.317 11.485 -4.558 1895 HA TRP 46 HA TRP 46 17.673 9.756 -2.447 1896 HB2 TRP 46 2HB TRP 46 18.784 12.027 -2.186 1897 HB3 TRP 46 1HB TRP 46 17.214 12.802 -2.591 1898 HD1 TRP 46 HD TRP 46 19.047 11.048 0.352 1899 HE1 TRP 46 1HE TRP 46 17.696 11.484 2.461 1900 HE3 TRP 46 3HE TRP 46 14.841 12.993 -1.811 1901 HZ2 TRP 46 2HZ TRP 46 15.037 12.397 3.141 1902 HZ3 TRP 46 3HZ TRP 46 12.876 13.426 -0.417 1903 HH2 TRP 46 HH TRP 46 12.984 13.198 2.042 1904 H TRP 47 H TRP 47 15.717 11.955 -4.463 1905 HA TRP 47 HA TRP 47 13.244 11.408 -3.183 1906 HB2 TRP 47 2HB TRP 47 13.690 13.471 -4.494 1907 HB3 TRP 47 1HB TRP 47 13.969 12.493 -5.976 1908 HD1 TRP 47 HD TRP 47 10.958 13.447 -3.579 1909 HE1 TRP 47 1HE TRP 47 8.835 13.233 -4.966 1910 HE3 TRP 47 3HE TRP 47 12.973 11.550 -7.867 1911 HZ2 TRP 47 2HZ TRP 47 8.090 12.588 -7.641 1912 HZ3 TRP 47 3HZ TRP 47 11.492 11.097 -9.795 1913 HH2 TRP 47 HH TRP 47 9.082 11.622 -9.686 1914 H SER 48 H SER 48 15.046 10.049 -5.939 1915 HA SER 48 HA SER 48 13.083 8.531 -7.071 1916 HB2 SER 48 2HB SER 48 15.496 8.991 -7.909 1917 HB3 SER 48 1HB SER 48 16.021 7.624 -6.862 1918 HG SER 48 1HG SER 48 15.641 6.985 -8.985 1919 H VAL 49 H VAL 49 15.235 7.602 -4.277 1920 HA VAL 49 HA VAL 49 14.247 4.965 -4.324 1921 HB VAL 49 HB VAL 49 15.432 6.209 -1.850 1922 HG11 VAL 49 1HG1 VAL 49 14.452 3.904 -1.603 1923 HG12 VAL 49 2HG1 VAL 49 16.245 3.808 -1.565 1924 HG13 VAL 49 3HG1 VAL 49 15.354 3.346 -3.056 1925 HG21 VAL 49 3HG2 VAL 49 17.060 6.808 -3.470 1926 HG22 VAL 49 1HG2 VAL 49 16.799 5.319 -4.458 1927 HG23 VAL 49 2HG2 VAL 49 17.637 5.231 -2.865 1928 H GLU 50 H GLU 50 13.012 7.901 -2.541 1929 HA GLU 50 HA GLU 50 11.237 6.252 -1.000 1930 HB2 GLU 50 2HB GLU 50 9.845 8.305 -0.563 1931 HB3 GLU 50 1HB GLU 50 11.472 8.351 0.114 1932 HG2 GLU 50 2HG GLU 50 12.218 10.033 -1.483 1933 HG3 GLU 50 1HG GLU 50 10.851 9.654 -2.588 1934 H THR 51 H THR 51 11.151 7.748 -4.182 1935 HA THR 51 HA THR 51 8.424 7.719 -4.619 1936 HB THR 51 HB THR 51 10.687 7.288 -6.655 1937 HG1 THR 51 1HG THR 51 10.768 9.281 -5.391 1938 HG21 THR 51 3HG2 THR 51 8.450 6.731 -7.649 1939 HG22 THR 51 1HG2 THR 51 9.061 8.290 -8.297 1940 HG23 THR 51 2HG2 THR 51 7.780 8.288 -7.031 1941 H ALA 52 H ALA 52 10.878 5.133 -5.116 1942 HA ALA 52 HA ALA 52 9.089 3.396 -6.448 1943 HB1 ALA 52 1HB ALA 52 11.660 2.770 -4.872 1944 HB2 ALA 52 2HB ALA 52 11.528 3.083 -6.649 1945 HB3 ALA 52 3HB ALA 52 10.791 1.606 -5.941 1946 H THR 53 H THR 53 9.671 4.019 -2.995 1947 HA THR 53 HA THR 53 8.190 1.647 -2.245 1948 HB THR 53 HB THR 53 8.503 2.781 0.108 1949 HG1 THR 53 1HG THR 53 9.245 4.791 -0.989 1950 HG21 THR 53 3HG2 THR 53 10.892 1.781 -1.598 1951 HG22 THR 53 1HG2 THR 53 9.697 0.737 -0.738 1952 HG23 THR 53 2HG2 THR 53 10.806 1.800 0.204 1953 H THR 54 H THR 54 7.225 4.439 -3.662 1954 HA THR 54 HA THR 54 5.364 5.511 -3.812 1955 HB THR 54 HB THR 54 3.246 4.070 -3.482 1956 HG1 THR 54 1HG THR 54 4.346 2.651 -1.961 1957 HG21 THR 54 3HG2 THR 54 3.872 2.763 -5.509 1958 HG22 THR 54 1HG2 THR 54 5.626 2.966 -5.153 1959 HG23 THR 54 2HG2 THR 54 4.627 4.398 -5.595 1960 H VAL 55 H VAL 55 6.698 6.021 -1.308 1961 HA VAL 55 HA VAL 55 4.378 6.585 0.419 1962 HB VAL 55 HB VAL 55 6.360 7.560 1.913 1963 HG11 VAL 55 1HG1 VAL 55 6.274 5.375 3.120 1964 HG12 VAL 55 2HG1 VAL 55 5.628 4.566 1.637 1965 HG13 VAL 55 3HG1 VAL 55 4.654 5.819 2.483 1966 HG21 VAL 55 3HG2 VAL 55 7.732 5.204 0.423 1967 HG22 VAL 55 1HG2 VAL 55 8.419 6.191 1.750 1968 HG23 VAL 55 2HG2 VAL 55 8.171 6.933 0.135 1969 H GLY 56 H GLY 56 7.372 8.532 -0.150 1970 HA2 GLY 56 2HA GLY 56 7.506 10.526 -1.193 1971 HA3 GLY 56 1HA GLY 56 5.759 10.431 -1.661 1972 H TYR 57 H TYR 57 8.091 11.160 0.916 1973 HA TYR 57 HA TYR 57 6.055 11.587 2.910 1974 HB2 TYR 57 2HB TYR 57 9.039 12.391 2.738 1975 HB3 TYR 57 1HB TYR 57 7.995 12.867 4.131 1976 HD1 TYR 57 2HD TYR 57 8.829 9.656 2.214 1977 HD2 TYR 57 1HD TYR 57 8.128 11.563 6.009 1978 HE1 TYR 57 2HE TYR 57 9.311 7.555 3.352 1979 HE2 TYR 57 1HE TYR 57 8.631 9.451 7.160 1980 HH TYR 57 HH TYR 57 9.110 6.425 5.374 1981 H GLY 58 H GLY 58 7.331 13.420 0.309 1982 HA2 GLY 58 2HA GLY 58 6.251 15.278 -0.510 1983 HA3 GLY 58 1HA GLY 58 5.758 15.763 1.153 1984 H ASP 59 H ASP 59 9.062 14.731 0.147 1985 HA ASP 59 HA ASP 59 10.151 17.225 1.074 1986 HB2 ASP 59 2HB ASP 59 11.589 15.159 1.141 1987 HB3 ASP 59 1HB ASP 59 11.567 15.115 -0.657 1988 H ARG 60 H ARG 60 9.381 15.685 -2.143 1989 HA ARG 60 HA ARG 60 9.480 18.337 -3.329 1990 HB2 ARG 60 2HB ARG 60 10.849 15.933 -4.683 1991 HB3 ARG 60 1HB ARG 60 10.875 17.657 -5.199 1992 HG2 ARG 60 2HG ARG 60 12.132 18.209 -3.061 1993 HG3 ARG 60 1HG ARG 60 12.102 16.456 -2.642 1994 HD2 ARG 60 2HD ARG 60 13.494 15.878 -4.579 1995 HD3 ARG 60 1HD ARG 60 13.585 17.649 -5.048 1996 HE ARG 60 HE ARG 60 14.204 16.992 -2.212 1997 HH11 ARG 60 1HH2 ARG 60 15.637 16.966 -5.511 1998 HH12 ARG 60 2HH2 ARG 60 17.224 17.362 -5.026 1999 HH21 ARG 60 1HH1 ARG 60 16.359 17.791 -1.547 2000 HH22 ARG 60 2HH1 ARG 60 17.645 17.908 -2.743 2001 H TYR 61 H TYR 61 8.626 18.001 -5.793 2002 HA TYR 61 HA TYR 61 7.031 15.713 -6.084 2003 HB2 TYR 61 2HB TYR 61 4.952 17.250 -6.711 2004 HB3 TYR 61 1HB TYR 61 5.207 16.777 -4.999 2005 HD1 TYR 61 2HD TYR 61 5.696 19.608 -7.433 2006 HD2 TYR 61 1HD TYR 61 5.543 18.388 -3.314 2007 HE1 TYR 61 2HE TYR 61 5.629 21.968 -6.744 2008 HE2 TYR 61 1HE TYR 61 5.460 20.749 -2.611 2009 HH TYR 61 HH TYR 61 5.515 23.447 -4.998 2010 HA PRO 62 HA PRO 62 8.428 17.293 -10.057 2011 HB2 PRO 62 2HB PRO 62 7.104 15.567 -11.778 2012 HB3 PRO 62 1HB PRO 62 8.334 14.945 -10.623 2013 HG2 PRO 62 2HG PRO 62 5.280 14.958 -10.348 2014 HG3 PRO 62 1HG PRO 62 6.420 13.583 -10.050 2015 HD2 PRO 62 2HD PRO 62 5.434 15.331 -8.056 2016 HD3 PRO 62 1HD PRO 62 7.030 14.459 -7.919 2017 H VAL 63 H VAL 63 7.454 18.331 -12.126 2018 HA VAL 63 HA VAL 63 5.009 19.705 -11.371 2019 HB VAL 63 HB VAL 63 6.668 20.297 -13.836 2020 HG11 VAL 63 1HG1 VAL 63 5.512 22.479 -13.691 2021 HG12 VAL 63 2HG1 VAL 63 4.771 22.054 -12.112 2022 HG13 VAL 63 3HG1 VAL 63 4.205 21.266 -13.619 2023 HG21 VAL 63 3HG2 VAL 63 8.139 20.429 -11.849 2024 HG22 VAL 63 1HG2 VAL 63 6.894 21.355 -10.946 2025 HG23 VAL 63 2HG2 VAL 63 7.694 22.073 -12.387 2026 H THR 64 H THR 64 5.439 19.342 -14.805 2027 HA THR 64 HA THR 64 3.241 17.497 -15.092 2028 HB THR 64 HB THR 64 3.029 20.501 -15.748 2029 HG1 THR 64 1HG THR 64 2.439 19.309 -13.629 2030 HG21 THR 64 3HG2 THR 64 0.764 20.003 -16.706 2031 HG22 THR 64 1HG2 THR 64 1.049 18.240 -16.516 2032 HG23 THR 64 2HG2 THR 64 2.049 19.189 -17.668 2033 H GLU 65 H GLU 65 5.534 19.916 -16.446 2034 HA GLU 65 HA GLU 65 5.392 18.772 -19.045 2035 HB2 GLU 65 2HB GLU 65 5.814 21.258 -18.241 2036 HB3 GLU 65 1HB GLU 65 7.528 20.752 -18.093 2037 HG2 GLU 65 2HG GLU 65 7.590 20.230 -20.535 2038 HG3 GLU 65 1HG GLU 65 5.815 20.513 -20.662 2039 H GLU 66 H GLU 66 6.827 17.712 -16.196 2040 HA GLU 66 HA GLU 66 9.317 16.807 -17.270 2041 HB2 GLU 66 2HB GLU 66 9.140 15.388 -15.003 2042 HB3 GLU 66 1HB GLU 66 9.607 17.116 -15.019 2043 HG2 GLU 66 2HG GLU 66 8.071 16.747 -13.231 2044 HG3 GLU 66 1HG GLU 66 7.252 17.789 -14.431 2045 H GLY 67 H GLY 67 6.030 15.702 -16.720 2046 HA2 GLY 67 2HA GLY 67 4.925 14.638 -18.448 2047 HA3 GLY 67 1HA GLY 67 6.454 13.765 -18.903 2048 H ARG 68 H ARG 68 4.812 14.484 -15.825 2049 HA ARG 68 HA ARG 68 5.205 12.985 -14.093 2050 HB2 ARG 68 2HB ARG 68 3.325 14.509 -14.096 2051 HB3 ARG 68 1HB ARG 68 2.265 13.247 -14.818 2052 HG2 ARG 68 2HG ARG 68 2.420 11.855 -12.818 2053 HG3 ARG 68 1HG ARG 68 3.758 12.839 -12.145 2054 HD2 ARG 68 2HD ARG 68 0.869 13.877 -12.566 2055 HD3 ARG 68 1HD ARG 68 1.518 13.209 -11.023 2056 HE ARG 68 HE ARG 68 2.732 15.608 -12.473 2057 HH11 ARG 68 1HH2 ARG 68 2.114 13.879 -9.272 2058 HH12 ARG 68 2HH2 ARG 68 2.420 15.287 -8.407 2059 HH21 ARG 68 1HH1 ARG 68 3.166 17.463 -11.113 2060 HH22 ARG 68 2HH1 ARG 68 2.661 17.442 -9.458 2061 H LYS 69 H LYS 69 4.118 11.262 -16.827 2062 HA LYS 69 HA LYS 69 3.748 8.752 -15.562 2063 HB2 LYS 69 2HB LYS 69 4.425 9.613 -18.389 2064 HB3 LYS 69 1HB LYS 69 4.890 7.963 -17.883 2065 HG2 LYS 69 2HG LYS 69 2.820 7.593 -18.814 2066 HG3 LYS 69 1HG LYS 69 2.570 7.555 -17.033 2067 HD2 LYS 69 2HD LYS 69 1.845 10.132 -17.394 2068 HD3 LYS 69 1HD LYS 69 1.629 9.613 -19.099 2069 HE2 LYS 69 2HE LYS 69 0.225 8.623 -16.534 2070 HE3 LYS 69 1HE LYS 69 -0.551 9.329 -18.003 2071 HZ1 LYS 69 3HZ LYS 69 -0.649 6.831 -17.575 2072 HZ2 LYS 69 1HZ LYS 69 0.938 6.748 -18.045 2073 HZ3 LYS 69 2HZ LYS 69 -0.234 7.292 -19.165 2074 H VAL 70 H VAL 70 6.574 10.821 -15.944 2075 HA VAL 70 HA VAL 70 8.532 8.847 -15.667 2076 HB VAL 70 HB VAL 70 8.544 11.709 -14.562 2077 HG11 VAL 70 1HG1 VAL 70 11.063 11.424 -14.704 2078 HG12 VAL 70 2HG1 VAL 70 10.833 9.673 -15.067 2079 HG13 VAL 70 3HG1 VAL 70 10.327 10.345 -13.472 2080 HG21 VAL 70 3HG2 VAL 70 9.512 10.501 -17.252 2081 HG22 VAL 70 1HG2 VAL 70 9.857 12.176 -16.681 2082 HG23 VAL 70 2HG2 VAL 70 8.180 11.690 -17.026 2083 H ALA 71 H ALA 71 6.520 10.546 -13.198 2084 HA ALA 71 HA ALA 71 7.770 9.192 -11.014 2085 HB1 ALA 71 1HB ALA 71 6.570 11.373 -10.661 2086 HB2 ALA 71 2HB ALA 71 5.856 10.063 -9.657 2087 HB3 ALA 71 3HB ALA 71 5.022 10.601 -11.161 2088 H GLU 72 H GLU 72 4.719 8.811 -12.889 2089 HA GLU 72 HA GLU 72 3.538 6.799 -11.487 2090 HB2 GLU 72 2HB GLU 72 2.510 7.872 -13.618 2091 HB3 GLU 72 1HB GLU 72 3.538 6.757 -14.568 2092 HG2 GLU 72 2HG GLU 72 2.345 4.839 -13.111 2093 HG3 GLU 72 1HG GLU 72 1.160 6.121 -12.727 2094 H GLN 73 H GLN 73 5.985 6.424 -14.105 2095 HA GLN 73 HA GLN 73 5.728 3.646 -14.142 2096 HB2 GLN 73 2HB GLN 73 6.621 5.104 -16.007 2097 HB3 GLN 73 1HB GLN 73 8.175 5.215 -15.121 2098 HG2 GLN 73 2HG GLN 73 8.521 2.770 -15.336 2099 HG3 GLN 73 1HG GLN 73 6.836 2.543 -15.933 2100 HE21 GLN 73 1HE2 GLN 73 8.226 1.393 -17.676 2101 HE22 GLN 73 2HE2 GLN 73 8.638 2.363 -19.064 2102 H VAL 74 H VAL 74 7.788 5.752 -12.125 2103 HA VAL 74 HA VAL 74 9.513 3.612 -11.328 2104 HB VAL 74 HB VAL 74 8.979 6.351 -10.060 2105 HG11 VAL 74 1HG1 VAL 74 11.255 5.994 -8.994 2106 HG12 VAL 74 2HG1 VAL 74 11.281 4.305 -9.628 2107 HG13 VAL 74 3HG1 VAL 74 10.052 4.800 -8.405 2108 HG21 VAL 74 3HG2 VAL 74 9.809 6.392 -12.481 2109 HG22 VAL 74 1HG2 VAL 74 11.190 5.369 -11.991 2110 HG23 VAL 74 2HG2 VAL 74 10.997 7.040 -11.317 2111 H MET 75 H MET 75 6.647 5.266 -10.007 2112 HA MET 75 HA MET 75 6.538 3.881 -7.573 2113 HB2 MET 75 2HB MET 75 4.376 5.267 -9.278 2114 HB3 MET 75 1HB MET 75 4.109 4.691 -7.599 2115 HG2 MET 75 2HG MET 75 6.062 6.100 -6.844 2116 HG3 MET 75 1HG MET 75 6.224 6.767 -8.481 2117 HE1 MET 75 3HE MET 75 4.224 8.238 -9.669 2118 HE2 MET 75 1HE MET 75 2.799 8.856 -8.791 2119 HE3 MET 75 2HE MET 75 2.914 7.106 -9.178 2120 H LYS 76 H LYS 76 4.956 3.292 -10.750 2121 HA LYS 76 HA LYS 76 3.512 1.060 -9.906 2122 HB2 LYS 76 2HB LYS 76 3.161 2.424 -12.068 2123 HB3 LYS 76 1HB LYS 76 4.559 1.532 -12.756 2124 HG2 LYS 76 2HG LYS 76 3.262 -0.646 -12.234 2125 HG3 LYS 76 1HG LYS 76 1.862 0.386 -11.765 2126 HD2 LYS 76 2HD LYS 76 1.956 1.420 -14.116 2127 HD3 LYS 76 1HD LYS 76 3.244 0.232 -14.525 2128 HE2 LYS 76 2HE LYS 76 0.286 -0.363 -13.808 2129 HE3 LYS 76 1HE LYS 76 1.122 -0.602 -15.391 2130 HZ1 LYS 76 3HZ LYS 76 1.403 -2.182 -12.894 2131 HZ2 LYS 76 1HZ LYS 76 2.606 -2.239 -14.080 2132 HZ3 LYS 76 2HZ LYS 76 0.963 -2.675 -14.411 2133 H ALA 77 H ALA 77 6.823 1.350 -11.310 2134 HA ALA 77 HA ALA 77 7.264 -1.355 -11.725 2135 HB1 ALA 77 1HB ALA 77 8.827 0.406 -12.586 2136 HB2 ALA 77 2HB ALA 77 9.715 -0.810 -11.600 2137 HB3 ALA 77 3HB ALA 77 9.311 0.803 -10.896 2138 H GLY 78 H GLY 78 7.642 0.636 -8.776 2139 HA2 GLY 78 2HA GLY 78 8.895 -1.342 -7.210 2140 HA3 GLY 78 1HA GLY 78 7.947 0.089 -6.647 2141 H ILE 79 H ILE 79 5.453 -0.400 -7.578 2142 HA ILE 79 HA ILE 79 4.417 -2.184 -5.735 2143 HB ILE 79 HB ILE 79 3.172 -1.040 -8.278 2144 HG12 ILE 79 2HG1 ILE 79 2.872 -0.196 -5.318 2145 HG13 ILE 79 1HG1 ILE 79 3.970 0.601 -6.471 2146 HG21 ILE 79 1HG2 ILE 79 1.876 -3.076 -7.581 2147 HG22 ILE 79 2HG2 ILE 79 0.941 -1.599 -7.230 2148 HG23 ILE 79 3HG2 ILE 79 1.789 -2.451 -5.891 2149 HD11 ILE 79 3HD ILE 79 0.889 0.486 -6.713 2150 HD12 ILE 79 1HD ILE 79 1.894 1.903 -6.276 2151 HD13 ILE 79 2HD ILE 79 2.003 1.213 -7.937 2152 H GLU 80 H GLU 80 5.018 -2.629 -9.261 2153 HA GLU 80 HA GLU 80 3.913 -5.177 -9.472 2154 HB2 GLU 80 2HB GLU 80 6.258 -3.915 -11.016 2155 HB3 GLU 80 1HB GLU 80 5.492 -5.472 -11.475 2156 HG2 GLU 80 2HG GLU 80 3.326 -4.356 -11.918 2157 HG3 GLU 80 1HG GLU 80 3.984 -2.787 -11.348 2158 H VAL 81 H VAL 81 7.265 -4.180 -8.640 2159 HA VAL 81 HA VAL 81 8.339 -6.762 -8.557 2160 HB VAL 81 HB VAL 81 9.122 -4.075 -7.361 2161 HG11 VAL 81 1HG1 VAL 81 10.046 -5.650 -5.717 2162 HG12 VAL 81 2HG1 VAL 81 11.376 -5.124 -6.801 2163 HG13 VAL 81 3HG1 VAL 81 10.636 -6.750 -7.018 2164 HG21 VAL 81 3HG2 VAL 81 10.364 -5.894 -9.544 2165 HG22 VAL 81 1HG2 VAL 81 10.898 -4.233 -9.105 2166 HG23 VAL 81 2HG2 VAL 81 9.289 -4.483 -9.864 2167 H PHE 82 H PHE 82 7.028 -4.686 -5.892 2168 HA PHE 82 HA PHE 82 7.547 -6.617 -3.916 2169 HB2 PHE 82 2HB PHE 82 5.353 -4.442 -3.890 2170 HB3 PHE 82 1HB PHE 82 5.990 -5.308 -2.439 2171 HD1 PHE 82 1HD PHE 82 8.993 -5.207 -2.985 2172 HD2 PHE 82 2HD PHE 82 5.906 -2.234 -3.462 2173 HE1 PHE 82 1HE PHE 82 10.660 -3.419 -2.723 2174 HE2 PHE 82 2HE PHE 82 7.583 -0.455 -3.201 2175 HZ PHE 82 HZ PHE 82 9.968 -1.034 -2.831 2176 H ALA 83 H ALA 83 4.699 -6.030 -5.987 2177 HA ALA 83 HA ALA 83 2.990 -7.799 -4.610 2178 HB1 ALA 83 1HB ALA 83 2.160 -6.008 -6.180 2179 HB2 ALA 83 2HB ALA 83 1.524 -7.630 -6.612 2180 HB3 ALA 83 3HB ALA 83 2.885 -6.907 -7.560 2181 H LEU 84 H LEU 84 5.347 -8.238 -7.261 2182 HA LEU 84 HA LEU 84 4.545 -10.733 -8.140 2183 HB2 LEU 84 2HB LEU 84 6.165 -9.220 -9.269 2184 HB3 LEU 84 1HB LEU 84 7.397 -9.562 -8.025 2185 HG LEU 84 HG LEU 84 6.195 -11.879 -9.616 2186 HD11 LEU 84 1HD1 LEU 84 7.804 -11.518 -11.484 2187 HD12 LEU 84 2HD1 LEU 84 8.332 -9.958 -10.746 2188 HD13 LEU 84 3HD1 LEU 84 6.643 -10.151 -11.344 2189 HD21 LEU 84 3HD2 LEU 84 7.887 -12.452 -7.855 2190 HD22 LEU 84 1HD2 LEU 84 9.070 -11.318 -8.601 2191 HD23 LEU 84 2HD2 LEU 84 8.536 -12.789 -9.492 2192 H VAL 85 H VAL 85 6.503 -9.819 -5.338 2193 HA VAL 85 HA VAL 85 7.580 -12.292 -4.704 2194 HB VAL 85 HB VAL 85 6.787 -10.021 -2.808 2195 HG11 VAL 85 1HG1 VAL 85 7.369 -11.997 -1.458 2196 HG12 VAL 85 2HG1 VAL 85 8.755 -10.867 -1.430 2197 HG13 VAL 85 3HG1 VAL 85 8.818 -12.334 -2.475 2198 HG21 VAL 85 3HG2 VAL 85 9.212 -9.310 -3.170 2199 HG22 VAL 85 1HG2 VAL 85 8.194 -9.141 -4.624 2200 HG23 VAL 85 2HG2 VAL 85 9.339 -10.522 -4.496 2201 H THR 86 H THR 86 4.217 -11.419 -4.651 2202 HA THR 86 HA THR 86 3.341 -12.875 -2.474 2203 HB THR 86 HB THR 86 1.850 -12.479 -5.099 2204 HG1 THR 86 1HG THR 86 2.356 -10.516 -4.459 2205 HG21 THR 86 3HG2 THR 86 0.891 -12.905 -2.172 2206 HG22 THR 86 1HG2 THR 86 0.676 -14.074 -3.533 2207 HG23 THR 86 2HG2 THR 86 -0.171 -12.489 -3.559 2208 H ALA 87 H ALA 87 4.524 -14.037 -5.569 2209 HA ALA 87 HA ALA 87 3.494 -16.650 -5.511 2210 HB1 ALA 87 1HB ALA 87 4.779 -15.604 -7.469 2211 HB2 ALA 87 2HB ALA 87 5.438 -17.202 -6.995 2212 HB3 ALA 87 3HB ALA 87 6.274 -15.682 -6.491 2213 H ALA 88 H ALA 88 5.923 -15.039 -3.557 2214 HA ALA 88 HA ALA 88 7.118 -17.533 -2.654 2215 HB1 ALA 88 1HB ALA 88 8.628 -15.484 -2.951 2216 HB2 ALA 88 2HB ALA 88 8.564 -16.041 -1.225 2217 HB3 ALA 88 3HB ALA 88 7.621 -14.620 -1.742 2218 H LEU 89 H LEU 89 4.722 -15.106 -1.729 2219 HA LEU 89 HA LEU 89 4.860 -15.738 1.041 2220 HB2 LEU 89 2HB LEU 89 2.635 -14.289 -0.525 2221 HB3 LEU 89 1HB LEU 89 2.817 -14.314 1.260 2222 HG LEU 89 HG LEU 89 4.868 -13.102 -0.693 2223 HD11 LEU 89 1HD1 LEU 89 2.654 -11.885 -0.746 2224 HD12 LEU 89 2HD1 LEU 89 3.974 -10.897 -0.032 2225 HD13 LEU 89 3HD1 LEU 89 2.743 -11.678 1.030 2226 HD21 LEU 89 3HD2 LEU 89 4.646 -12.893 2.381 2227 HD22 LEU 89 1HD2 LEU 89 5.807 -11.990 1.345 2228 HD23 LEU 89 2HD2 LEU 89 5.926 -13.778 1.467 2229 H ALA 90 H ALA 90 2.504 -16.474 -1.578 2230 HA ALA 90 HA ALA 90 0.703 -17.674 0.217 2231 HB1 ALA 90 1HB ALA 90 -0.094 -16.756 -1.910 2232 HB2 ALA 90 2HB ALA 90 -0.481 -18.515 -1.853 2233 HB3 ALA 90 3HB ALA 90 0.921 -17.917 -2.828 2234 H THR 91 H THR 91 3.609 -19.028 -1.245 2235 HA THR 91 HA THR 91 2.613 -21.708 -1.047 2236 HB THR 91 HB THR 91 4.297 -21.251 -2.685 2237 HG1 THR 91 1HG THR 91 4.953 -22.992 -0.590 2238 HG21 THR 91 3HG2 THR 91 6.170 -20.609 -0.309 2239 HG22 THR 91 1HG2 THR 91 5.600 -19.490 -1.599 2240 HG23 THR 91 2HG2 THR 91 6.667 -20.859 -2.027 2241 H ASP 92 H ASP 92 3.606 -19.367 1.344 2242 HA ASP 92 HA ASP 92 4.685 -21.465 3.025 2243 HB2 ASP 92 2HB ASP 92 4.577 -18.456 3.358 2244 HB3 ASP 92 1HB ASP 92 5.014 -19.568 4.705 2245 H PHE 93 H PHE 93 1.563 -20.738 2.207 2246 HA PHE 93 HA PHE 93 0.670 -21.689 4.835 2247 HB2 PHE 93 2HB PHE 93 -1.474 -21.272 4.404 2248 HB3 PHE 93 1HB PHE 93 -0.786 -20.054 3.296 2249 HD1 PHE 93 1HD PHE 93 -2.330 -23.469 3.535 2250 HD2 PHE 93 2HD PHE 93 -1.225 -20.254 0.912 2251 HE1 PHE 93 1HE PHE 93 -3.581 -24.535 1.703 2252 HE2 PHE 93 2HE PHE 93 -2.507 -21.292 -0.912 2253 HZ PHE 93 HZ PHE 93 -3.714 -23.435 -0.524 2254 H VAL 94 H VAL 94 1.506 -22.790 1.551 2255 HA VAL 94 HA VAL 94 0.228 -25.286 1.832 2256 HB VAL 94 HB VAL 94 2.381 -24.429 -0.161 2257 HG11 VAL 94 1HG1 VAL 94 1.324 -26.240 -1.582 2258 HG12 VAL 94 2HG1 VAL 94 0.304 -26.736 -0.180 2259 HG13 VAL 94 3HG1 VAL 94 2.095 -26.919 -0.109 2260 HG21 VAL 94 3HG2 VAL 94 -0.695 -24.177 0.022 2261 HG22 VAL 94 1HG2 VAL 94 0.161 -24.120 -1.540 2262 HG23 VAL 94 2HG2 VAL 94 0.498 -22.863 -0.297 2263 H ARG 95 H ARG 95 3.455 -24.084 2.602 2264 HA ARG 95 HA ARG 95 4.692 -26.533 3.088 2265 HB2 ARG 95 2HB ARG 95 5.053 -23.843 4.539 2266 HB3 ARG 95 1HB ARG 95 6.097 -25.287 4.772 2267 HG2 ARG 95 2HG ARG 95 6.543 -25.283 2.267 2268 HG3 ARG 95 1HG ARG 95 5.830 -23.634 2.192 2269 HD2 ARG 95 2HD ARG 95 7.526 -22.691 3.628 2270 HD3 ARG 95 1HD ARG 95 8.019 -24.302 4.270 2271 HE ARG 95 HE ARG 95 9.014 -22.937 1.970 2272 HH11 ARG 95 1HH2 ARG 95 8.206 -26.464 2.485 2273 HH12 ARG 95 2HH2 ARG 95 9.817 -26.952 2.527 2274 HH21 ARG 95 1HH1 ARG 95 11.287 -23.748 1.935 2275 HH22 ARG 95 2HH1 ARG 95 11.620 -25.401 2.229 2276 H ARG 96 H ARG 96 1.942 -25.184 4.781 2277 HA ARG 96 HA ARG 96 2.626 -26.086 7.338 2278 HB2 ARG 96 2HB ARG 96 0.512 -25.575 8.102 2279 HB3 ARG 96 1HB ARG 96 0.734 -24.425 6.748 2280 HG2 ARG 96 2HG ARG 96 -0.655 -26.160 5.319 2281 HG3 ARG 96 1HG ARG 96 -0.980 -26.972 6.898 2282 HD2 ARG 96 2HD ARG 96 -1.788 -24.564 7.690 2283 HD3 ARG 96 1HD ARG 96 -1.859 -24.180 5.936 2284 HE ARG 96 HE ARG 96 -3.467 -26.083 5.628 2285 HH11 ARG 96 1HH2 ARG 96 -2.897 -25.239 9.133 2286 HH12 ARG 96 2HH2 ARG 96 -4.515 -25.492 9.557 2287 HH21 ARG 96 1HH1 ARG 96 -5.711 -26.429 6.305 2288 HH22 ARG 96 2HH1 ARG 96 -6.219 -25.999 7.865 2289 H GLU 97 H GLU 97 1.285 -27.791 4.492 2290 HA GLU 97 HA GLU 97 0.385 -29.987 6.098 2291 HB2 GLU 97 2HB GLU 97 -0.649 -29.554 3.882 2292 HB3 GLU 97 1HB GLU 97 0.925 -29.885 3.085 2293 HG2 GLU 97 2HG GLU 97 -0.554 -31.824 2.834 2294 HG3 GLU 97 1HG GLU 97 0.833 -32.266 3.883 2295 H GLU 98 H GLU 98 3.377 -29.065 4.448 2296 HA GLU 98 HA GLU 98 4.683 -31.551 4.651 2297 HB2 GLU 98 2HB GLU 98 6.024 -28.764 4.652 2298 HB3 GLU 98 1HB GLU 98 6.733 -30.333 4.146 2299 HG2 GLU 98 2HG GLU 98 4.956 -30.411 2.281 2300 HG3 GLU 98 1HG GLU 98 4.498 -28.721 2.709 2301 H GLU 99 H GLU 99 4.596 -28.598 6.752 2302 HA GLU 99 HA GLU 99 6.324 -29.757 8.660 2303 HB2 GLU 99 2HB GLU 99 5.756 -27.178 8.432 2304 HB3 GLU 99 1HB GLU 99 4.383 -27.580 9.512 2305 HG2 GLU 99 2HG GLU 99 6.383 -28.850 10.900 2306 HG3 GLU 99 1HG GLU 99 7.407 -27.660 10.021 2307 H ARG 100 H ARG 100 2.744 -29.609 8.376 2308 HA ARG 100 HA ARG 100 2.076 -30.504 10.861 2309 HB2 ARG 100 2HB ARG 100 0.467 -29.701 9.050 2310 HB3 ARG 100 1HB ARG 100 0.630 -31.299 8.251 2311 HG2 ARG 100 2HG ARG 100 -0.376 -32.351 10.358 2312 HG3 ARG 100 1HG ARG 100 -0.459 -30.712 11.081 2313 HD2 ARG 100 2HD ARG 100 -2.700 -31.229 10.241 2314 HD3 ARG 100 1HD ARG 100 -1.988 -29.983 9.151 2315 HE ARG 100 HE ARG 100 -1.843 -31.568 7.375 2316 HH11 ARG 100 1HH2 ARG 100 -3.192 -33.197 10.370 2317 HH12 ARG 100 2HH2 ARG 100 -3.227 -34.735 9.642 2318 HH21 ARG 100 1HH1 ARG 100 -2.222 -33.579 6.357 2319 HH22 ARG 100 2HH1 ARG 100 -2.971 -34.894 7.208 2320 H ARG 101 H ARG 101 2.996 -32.442 7.980 2321 HA ARG 101 HA ARG 101 2.495 -34.917 9.327 2322 HB2 ARG 101 2HB ARG 101 4.213 -34.334 6.847 2323 HB3 ARG 101 1HB ARG 101 3.778 -35.981 7.425 2324 HG2 ARG 101 2HG ARG 101 1.752 -33.836 6.540 2325 HG3 ARG 101 1HG ARG 101 2.421 -35.124 5.481 2326 HD2 ARG 101 2HD ARG 101 1.373 -36.897 6.891 2327 HD3 ARG 101 1HD ARG 101 0.697 -35.637 8.017 2328 HE ARG 101 HE ARG 101 -0.307 -34.635 5.766 2329 HH11 ARG 101 1HH2 ARG 101 -0.432 -38.135 6.698 2330 HH12 ARG 101 2HH2 ARG 101 -1.342 -38.592 5.318 2331 HH21 ARG 101 1HH1 ARG 101 -1.623 -35.167 4.125 2332 HH22 ARG 101 2HH1 ARG 101 -1.972 -36.801 3.646 2333 H GLY 102 H GLY 102 5.235 -32.697 9.179 2334 HA2 GLY 102 2HA GLY 102 6.974 -32.619 10.541 2335 HA3 GLY 102 1HA GLY 102 6.430 -34.149 11.323 2336 H HIS 103 H HIS 103 6.911 -33.954 7.837 2337 HA HIS 103 HA HIS 103 9.643 -34.593 7.827 2338 HB2 HIS 103 2HB HIS 103 8.921 -36.882 8.589 2339 HB3 HIS 103 1HB HIS 103 7.716 -36.955 7.263 2340 HD1 HIS 103 1HD HIS 103 8.663 -37.847 4.967 2341 HD2 HIS 103 2HD HIS 103 11.698 -36.936 7.763 2342 HE1 HIS 103 1HE HIS 103 10.831 -38.503 3.944 2343 HE2 HIS 103 2HE HIS 103 12.648 -38.010 5.628 2344 H1 SER 1 H SER 1 -6.125 -23.831 17.608 2345 HA SER 1 HA SER 1 -7.693 -21.847 17.161 2346 HB2 SER 1 2HB SER 1 -4.916 -20.499 17.389 2347 HB3 SER 1 1HB SER 1 -6.442 -19.730 16.802 2348 HG SER 1 1HG SER 1 -6.128 -19.222 18.923 2349 H ALA 2 H ALA 2 -4.512 -21.156 15.670 2350 HA ALA 2 HA ALA 2 -4.630 -23.506 14.094 2351 HB1 ALA 2 1HB ALA 2 -4.814 -20.790 12.665 2352 HB2 ALA 2 2HB ALA 2 -6.137 -21.997 12.721 2353 HB3 ALA 2 3HB ALA 2 -4.599 -22.403 11.877 2354 H ASP 3 H ASP 3 -2.815 -23.296 12.480 2355 HA ASP 3 HA ASP 3 -0.419 -23.158 13.952 2356 HB2 ASP 3 2HB ASP 3 0.443 -23.991 11.587 2357 HB3 ASP 3 1HB ASP 3 -0.679 -25.051 12.485 2358 H HIS 4 H HIS 4 -1.597 -21.905 10.944 2359 HA HIS 4 HA HIS 4 0.415 -20.179 10.242 2360 HB2 HIS 4 2HB HIS 4 -1.252 -19.173 8.643 2361 HB3 HIS 4 1HB HIS 4 -1.271 -20.955 8.652 2362 HD1 HIS 4 1HD HIS 4 -3.508 -18.028 9.840 2363 HD2 HIS 4 2HD HIS 4 -3.668 -22.204 9.255 2364 HE1 HIS 4 1HE HIS 4 -5.905 -18.693 9.985 2365 HE2 HIS 4 2HE HIS 4 -5.997 -21.189 9.627 2366 H GLU 5 H GLU 5 -2.338 -19.563 12.389 2367 HA GLU 5 HA GLU 5 -2.253 -16.740 12.301 2368 HB2 GLU 5 2HB GLU 5 -3.266 -18.684 14.483 2369 HB3 GLU 5 1HB GLU 5 -3.540 -16.911 14.500 2370 HG2 GLU 5 2HG GLU 5 -4.895 -17.007 12.458 2371 HG3 GLU 5 1HG GLU 5 -4.553 -18.762 12.258 2372 H ARG 6 H ARG 6 -0.550 -19.243 14.186 2373 HA ARG 6 HA ARG 6 0.307 -17.450 16.212 2374 HB2 ARG 6 2HB ARG 6 1.370 -20.179 15.338 2375 HB3 ARG 6 1HB ARG 6 1.887 -19.320 16.832 2376 HG2 ARG 6 2HG ARG 6 -0.326 -19.477 17.815 2377 HG3 ARG 6 1HG ARG 6 -1.059 -20.055 16.297 2378 HD2 ARG 6 2HD ARG 6 -0.740 -21.878 18.020 2379 HD3 ARG 6 1HD ARG 6 0.070 -22.240 16.456 2380 HE ARG 6 HE ARG 6 1.376 -21.322 19.027 2381 HH11 ARG 6 1HH2 ARG 6 1.887 -22.158 15.588 2382 HH12 ARG 6 2HH2 ARG 6 3.541 -22.429 15.702 2383 HH21 ARG 6 1HH1 ARG 6 3.559 -22.238 19.344 2384 HH22 ARG 6 2HH1 ARG 6 4.575 -22.414 17.945 2385 H GLU 7 H GLU 7 1.735 -18.629 13.125 2386 HA GLU 7 HA GLU 7 4.253 -17.434 13.709 2387 HB2 GLU 7 2HB GLU 7 3.604 -19.390 11.977 2388 HB3 GLU 7 1HB GLU 7 3.450 -18.009 10.853 2389 HG2 GLU 7 2HG GLU 7 5.665 -18.693 10.516 2390 HG3 GLU 7 1HG GLU 7 5.903 -17.361 11.697 2391 H ALA 8 H ALA 8 1.200 -16.300 12.317 2392 HA ALA 8 HA ALA 8 2.230 -13.934 11.152 2393 HB1 ALA 8 1HB ALA 8 -0.118 -13.099 11.199 2394 HB2 ALA 8 2HB ALA 8 -0.599 -14.467 12.265 2395 HB3 ALA 8 3HB ALA 8 -0.058 -14.786 10.577 2396 H GLN 9 H GLN 9 0.981 -14.731 14.433 2397 HA GLN 9 HA GLN 9 1.104 -12.052 15.355 2398 HB2 GLN 9 2HB GLN 9 1.168 -14.705 16.903 2399 HB3 GLN 9 1HB GLN 9 1.043 -13.100 17.696 2400 HG2 GLN 9 2HG GLN 9 -1.061 -14.161 15.682 2401 HG3 GLN 9 1HG GLN 9 -1.158 -14.352 17.465 2402 HE21 GLN 9 1HE2 GLN 9 -1.186 -11.937 14.795 2403 HE22 GLN 9 2HE2 GLN 9 -1.493 -10.544 15.725 2404 H LYS 10 H LYS 10 3.510 -14.581 15.121 2405 HA LYS 10 HA LYS 10 5.468 -13.483 16.815 2406 HB2 LYS 10 2HB LYS 10 5.402 -15.834 15.819 2407 HB3 LYS 10 1HB LYS 10 5.701 -15.109 14.213 2408 HG2 LYS 10 2HG LYS 10 7.972 -14.250 15.162 2409 HG3 LYS 10 1HG LYS 10 7.663 -15.356 16.550 2410 HD2 LYS 10 2HD LYS 10 7.215 -17.209 14.823 2411 HD3 LYS 10 1HD LYS 10 7.700 -16.046 13.540 2412 HE2 LYS 10 2HE LYS 10 10.034 -15.935 14.653 2413 HE3 LYS 10 1HE LYS 10 9.487 -17.267 15.755 2414 HZ1 LYS 10 3HZ LYS 10 8.820 -18.378 13.493 2415 HZ2 LYS 10 1HZ LYS 10 10.473 -18.368 14.030 2416 HZ3 LYS 10 2HZ LYS 10 9.963 -17.256 12.861 2417 H ALA 11 H ALA 11 4.668 -13.033 13.346 2418 HA ALA 11 HA ALA 11 6.883 -11.467 12.695 2419 HB1 ALA 11 1HB ALA 11 4.091 -11.447 11.385 2420 HB2 ALA 11 2HB ALA 11 5.445 -12.563 10.967 2421 HB3 ALA 11 3HB ALA 11 5.609 -10.800 10.660 2422 H GLU 12 H GLU 12 3.643 -10.576 13.975 2423 HA GLU 12 HA GLU 12 3.913 -7.820 13.680 2424 HB2 GLU 12 2HB GLU 12 2.458 -9.268 15.983 2425 HB3 GLU 12 1HB GLU 12 2.371 -7.517 15.603 2426 HG2 GLU 12 2HG GLU 12 1.476 -8.262 13.239 2427 HG3 GLU 12 1HG GLU 12 1.157 -9.854 14.029 2428 H GLU 13 H GLU 13 5.186 -9.992 16.263 2429 HA GLU 13 HA GLU 13 5.860 -7.815 17.962 2430 HB2 GLU 13 2HB GLU 13 5.654 -10.184 18.855 2431 HB3 GLU 13 1HB GLU 13 7.213 -10.568 18.043 2432 HG2 GLU 13 2HG GLU 13 8.335 -8.731 19.408 2433 HG3 GLU 13 1HG GLU 13 6.751 -8.349 20.158 2434 H GLU 14 H GLU 14 7.522 -9.563 15.352 2435 HA GLU 14 HA GLU 14 10.045 -8.493 15.932 2436 HB2 GLU 14 2HB GLU 14 9.639 -10.557 14.623 2437 HB3 GLU 14 1HB GLU 14 9.068 -9.580 13.236 2438 HG2 GLU 14 2HG GLU 14 11.233 -8.899 12.657 2439 HG3 GLU 14 1HG GLU 14 11.782 -8.832 14.370 2440 H LEU 15 H LEU 15 7.270 -7.123 14.217 2441 HA LEU 15 HA LEU 15 8.754 -5.082 12.951 2442 HB2 LEU 15 2HB LEU 15 6.410 -5.728 12.298 2443 HB3 LEU 15 1HB LEU 15 5.799 -5.013 13.818 2444 HG LEU 15 HG LEU 15 6.454 -2.763 13.100 2445 HD11 LEU 15 1HD1 LEU 15 8.593 -3.097 11.975 2446 HD12 LEU 15 2HD1 LEU 15 7.477 -2.361 10.788 2447 HD13 LEU 15 3HD1 LEU 15 7.836 -4.124 10.701 2448 HD21 LEU 15 3HD2 LEU 15 4.279 -3.637 12.247 2449 HD22 LEU 15 1HD2 LEU 15 5.090 -4.265 10.767 2450 HD23 LEU 15 2HD2 LEU 15 5.019 -2.495 11.069 2451 H GLN 16 H GLN 16 7.336 -5.425 16.178 2452 HA GLN 16 HA GLN 16 7.470 -2.720 16.936 2453 HB2 GLN 16 2HB GLN 16 7.591 -5.244 18.684 2454 HB3 GLN 16 1HB GLN 16 7.253 -3.588 19.283 2455 HG2 GLN 16 2HG GLN 16 5.127 -3.483 18.054 2456 HG3 GLN 16 1HG GLN 16 5.491 -5.011 17.176 2457 HE21 GLN 16 1HE2 GLN 16 3.717 -6.218 17.974 2458 HE22 GLN 16 2HE2 GLN 16 3.531 -6.677 19.633 2459 H LYS 17 H LYS 17 9.817 -5.342 16.916 2460 HA LYS 17 HA LYS 17 11.799 -4.197 18.543 2461 HB2 LYS 17 2HB LYS 17 11.697 -6.621 17.811 2462 HB3 LYS 17 1HB LYS 17 12.042 -6.102 16.131 2463 HG2 LYS 17 2HG LYS 17 14.302 -5.246 16.907 2464 HG3 LYS 17 1HG LYS 17 13.967 -5.938 18.532 2465 HD2 LYS 17 2HD LYS 17 13.810 -8.222 17.566 2466 HD3 LYS 17 1HD LYS 17 13.865 -7.540 15.903 2467 HE2 LYS 17 2HE LYS 17 16.234 -6.679 16.398 2468 HE3 LYS 17 1HE LYS 17 16.200 -7.620 17.944 2469 HZ1 LYS 17 3HZ LYS 17 15.705 -8.852 15.263 2470 HZ2 LYS 17 1HZ LYS 17 16.081 -9.653 16.714 2471 HZ3 LYS 17 2HZ LYS 17 17.255 -8.729 15.965 2472 H VAL 18 H VAL 18 11.020 -3.874 15.057 2473 HA VAL 18 HA VAL 18 13.416 -2.519 14.401 2474 HB VAL 18 HB VAL 18 10.752 -2.533 12.891 2475 HG11 VAL 18 1HG1 VAL 18 12.326 -0.741 12.089 2476 HG12 VAL 18 2HG1 VAL 18 12.226 -2.076 10.894 2477 HG13 VAL 18 3HG1 VAL 18 13.662 -1.945 11.975 2478 HG21 VAL 18 3HG2 VAL 18 11.837 -4.425 11.597 2479 HG22 VAL 18 1HG2 VAL 18 11.553 -4.863 13.305 2480 HG23 VAL 18 2HG2 VAL 18 13.211 -4.424 12.761 2481 H LEU 19 H LEU 19 10.194 -1.511 15.556 2482 HA LEU 19 HA LEU 19 10.411 1.217 15.037 2483 HB2 LEU 19 2HB LEU 19 9.132 -0.042 17.543 2484 HB3 LEU 19 1HB LEU 19 8.834 1.612 16.920 2485 HG LEU 19 HG LEU 19 8.078 -1.009 15.491 2486 HD11 LEU 19 1HD1 LEU 19 5.740 -0.439 16.097 2487 HD12 LEU 19 2HD1 LEU 19 6.299 1.035 16.972 2488 HD13 LEU 19 3HD1 LEU 19 6.750 -0.601 17.582 2489 HD21 LEU 19 3HD2 LEU 19 6.718 0.467 13.988 2490 HD22 LEU 19 1HD2 LEU 19 8.478 0.804 13.833 2491 HD23 LEU 19 2HD2 LEU 19 7.423 1.920 14.779 2492 H GLU 20 H GLU 20 11.636 -0.758 17.769 2493 HA GLU 20 HA GLU 20 12.393 1.439 19.343 2494 HB2 GLU 20 2HB GLU 20 13.665 -1.372 19.430 2495 HB3 GLU 20 1HB GLU 20 13.720 -0.096 20.691 2496 HG2 GLU 20 2HG GLU 20 11.053 -0.314 20.606 2497 HG3 GLU 20 1HG GLU 20 11.390 -1.910 19.845 2498 H GLU 21 H GLU 21 14.169 -0.622 17.020 2499 HA GLU 21 HA GLU 21 16.667 0.688 17.359 2500 HB2 GLU 21 2HB GLU 21 15.481 -1.138 15.230 2501 HB3 GLU 21 1HB GLU 21 16.960 -0.216 14.820 2502 HG2 GLU 21 2HG GLU 21 16.806 -2.030 17.296 2503 HG3 GLU 21 1HG GLU 21 17.392 -2.570 15.680 2504 H ALA 22 H ALA 22 13.852 1.199 15.201 2505 HA ALA 22 HA ALA 22 14.975 3.105 13.563 2506 HB1 ALA 22 1HB ALA 22 12.646 3.869 13.084 2507 HB2 ALA 22 2HB ALA 22 12.056 2.965 14.528 2508 HB3 ALA 22 3HB ALA 22 12.727 2.070 13.124 2509 H SER 23 H SER 23 13.480 3.541 16.853 2510 HA SER 23 HA SER 23 13.453 6.282 16.846 2511 HB2 SER 23 2HB SER 23 14.363 4.629 19.287 2512 HB3 SER 23 1HB SER 23 13.418 6.161 19.277 2513 HG SER 23 1HG SER 23 12.399 3.987 19.611 2514 H LYS 24 H LYS 24 16.059 4.026 17.661 2515 HA LYS 24 HA LYS 24 17.930 5.931 18.609 2516 HB2 LYS 24 2HB LYS 24 17.985 3.495 19.275 2517 HB3 LYS 24 1HB LYS 24 18.184 3.037 17.559 2518 HG2 LYS 24 2HG LYS 24 20.433 4.445 17.678 2519 HG3 LYS 24 1HG LYS 24 20.269 4.248 19.448 2520 HD2 LYS 24 2HD LYS 24 20.177 1.945 17.370 2521 HD3 LYS 24 1HD LYS 24 21.689 2.548 18.127 2522 HE2 LYS 24 2HE LYS 24 20.888 1.870 20.394 2523 HE3 LYS 24 1HE LYS 24 19.324 1.291 19.688 2524 HZ1 LYS 24 3HZ LYS 24 20.954 -0.474 20.074 2525 HZ2 LYS 24 1HZ LYS 24 22.006 0.213 18.932 2526 HZ3 LYS 24 2HZ LYS 24 20.432 -0.356 18.475 2527 H LYS 25 H LYS 25 17.520 4.027 15.583 2528 HA LYS 25 HA LYS 25 19.815 5.079 14.359 2529 HB2 LYS 25 2HB LYS 25 17.365 3.791 13.018 2530 HB3 LYS 25 1HB LYS 25 18.927 4.181 12.211 2531 HG2 LYS 25 2HG LYS 25 20.096 2.542 13.746 2532 HG3 LYS 25 1HG LYS 25 18.483 2.022 14.345 2533 HD2 LYS 25 2HD LYS 25 17.838 1.710 11.821 2534 HD3 LYS 25 1HD LYS 25 19.585 1.886 11.466 2535 HE2 LYS 25 2HE LYS 25 18.173 -0.367 13.056 2536 HE3 LYS 25 1HE LYS 25 19.049 -0.479 11.481 2537 HZ1 LYS 25 3HZ LYS 25 21.019 0.383 12.947 2538 HZ2 LYS 25 1HZ LYS 25 20.600 -1.238 12.876 2539 HZ3 LYS 25 2HZ LYS 25 20.060 -0.335 14.226 2540 H ALA 26 H ALA 26 16.294 6.035 14.116 2541 HA ALA 26 HA ALA 26 16.791 7.720 11.912 2542 HB1 ALA 26 1HB ALA 26 14.529 8.657 12.296 2543 HB2 ALA 26 2HB ALA 26 14.447 7.844 13.903 2544 HB3 ALA 26 3HB ALA 26 14.499 6.863 12.392 2545 H VAL 27 H VAL 27 16.681 8.305 15.485 2546 HA VAL 27 HA VAL 27 16.876 11.096 15.080 2547 HB VAL 27 HB VAL 27 16.004 9.988 17.163 2548 HG11 VAL 27 1HG1 VAL 27 17.582 9.425 18.974 2549 HG12 VAL 27 2HG1 VAL 27 19.000 9.723 17.913 2550 HG13 VAL 27 3HG1 VAL 27 17.877 8.354 17.570 2551 HG21 VAL 27 3HG2 VAL 27 16.368 12.356 16.968 2552 HG22 VAL 27 1HG2 VAL 27 18.139 12.211 17.263 2553 HG23 VAL 27 2HG2 VAL 27 16.985 11.856 18.591 2554 H GLU 28 H GLU 28 19.222 8.452 15.360 2555 HA GLU 28 HA GLU 28 21.421 10.194 15.664 2556 HB2 GLU 28 2HB GLU 28 21.192 7.756 16.482 2557 HB3 GLU 28 1HB GLU 28 21.603 7.281 14.803 2558 HG2 GLU 28 2HG GLU 28 23.587 7.186 16.253 2559 HG3 GLU 28 1HG GLU 28 23.807 8.541 15.105 2560 H ALA 29 H ALA 29 19.590 8.956 13.008 2561 HA ALA 29 HA ALA 29 21.408 8.952 10.956 2562 HB1 ALA 29 1HB ALA 29 18.430 9.750 10.724 2563 HB2 ALA 29 2HB ALA 29 18.994 8.049 10.880 2564 HB3 ALA 29 3HB ALA 29 19.475 9.012 9.461 2565 H GLU 30 H GLU 30 19.497 11.526 12.370 2566 HA GLU 30 HA GLU 30 19.980 13.350 10.304 2567 HB2 GLU 30 2HB GLU 30 18.169 13.040 12.373 2568 HB3 GLU 30 1HB GLU 30 19.212 14.330 13.042 2569 HG2 GLU 30 2HG GLU 30 17.617 15.521 11.885 2570 HG3 GLU 30 1HG GLU 30 18.912 15.395 10.611 2571 H ARG 31 H ARG 31 22.061 12.246 12.831 2572 HA ARG 31 HA ARG 31 23.421 14.828 13.113 2573 HB2 ARG 31 2HB ARG 31 23.990 12.160 14.476 2574 HB3 ARG 31 1HB ARG 31 25.055 13.602 14.586 2575 HG2 ARG 31 2HG ARG 31 23.788 13.573 16.572 2576 HG3 ARG 31 1HG ARG 31 23.130 14.925 15.576 2577 HD2 ARG 31 2HD ARG 31 21.163 13.468 14.934 2578 HD3 ARG 31 1HD ARG 31 21.904 12.088 15.801 2579 HE ARG 31 HE ARG 31 20.547 14.473 16.922 2580 HH11 ARG 31 1HH2 ARG 31 22.400 11.390 17.710 2581 HH12 ARG 31 2HH2 ARG 31 21.537 11.177 19.154 2582 HH21 ARG 31 1HH1 ARG 31 19.280 13.914 18.870 2583 HH22 ARG 31 2HH1 ARG 31 19.877 12.633 19.868 2584 H GLY 32 H GLY 32 23.969 15.058 10.943 2585 HA2 GLY 32 2HA GLY 32 26.455 14.531 10.127 2586 HA3 GLY 32 1HA GLY 32 25.498 13.078 9.584 2587 H ALA 33 H ALA 33 22.965 14.539 9.454 2588 HA ALA 33 HA ALA 33 23.262 15.290 6.761 2589 HB1 ALA 33 1HB ALA 33 20.760 15.275 8.561 2590 HB2 ALA 33 2HB ALA 33 21.333 13.891 7.573 2591 HB3 ALA 33 3HB ALA 33 20.760 15.391 6.763 2592 HA PRO 34 HA PRO 34 23.076 19.675 7.583 2593 HB2 PRO 34 2HB PRO 34 22.465 20.695 5.078 2594 HB3 PRO 34 1HB PRO 34 24.035 19.906 5.479 2595 HG2 PRO 34 2HG PRO 34 21.611 18.604 4.135 2596 HG3 PRO 34 1HG PRO 34 23.347 18.574 3.599 2597 HD2 PRO 34 2HD PRO 34 22.205 16.526 5.089 2598 HD3 PRO 34 1HD PRO 34 23.935 17.041 5.358 2599 H GLY 35 H GLY 35 21.275 19.909 9.081 2600 HA2 GLY 35 2HA GLY 35 19.632 21.620 9.197 2601 HA3 GLY 35 1HA GLY 35 18.824 20.905 7.744 2602 H ALA 36 H ALA 36 20.292 19.537 10.726 2603 HA ALA 36 HA ALA 36 18.784 17.331 10.630 2604 HB1 ALA 36 1HB ALA 36 20.021 18.604 13.145 2605 HB2 ALA 36 2HB ALA 36 20.848 17.473 12.006 2606 HB3 ALA 36 3HB ALA 36 19.488 16.883 13.023 2607 H ALA 37 H ALA 37 16.629 17.029 10.697 2608 HA ALA 37 HA ALA 37 14.990 18.983 12.055 2609 HB1 ALA 37 1HB ALA 37 14.302 16.700 10.082 2610 HB2 ALA 37 2HB ALA 37 14.502 18.434 9.660 2611 HB3 ALA 37 3HB ALA 37 13.138 17.922 10.718 2612 H LEU 38 H LEU 38 15.148 15.358 11.675 2613 HA LEU 38 HA LEU 38 13.443 14.996 13.976 2614 HB2 LEU 38 2HB LEU 38 13.517 13.690 11.685 2615 HB3 LEU 38 1HB LEU 38 14.922 12.844 12.353 2616 HG LEU 38 HG LEU 38 12.049 12.899 13.494 2617 HD11 LEU 38 1HD1 LEU 38 12.034 10.488 12.740 2618 HD12 LEU 38 2HD1 LEU 38 13.640 10.744 11.970 2619 HD13 LEU 38 3HD1 LEU 38 12.204 11.657 11.380 2620 HD21 LEU 38 3HD2 LEU 38 14.447 11.234 14.490 2621 HD22 LEU 38 1HD2 LEU 38 12.733 10.999 14.994 2622 HD23 LEU 38 2HD2 LEU 38 13.596 12.522 15.415 2623 H ILE 39 H ILE 39 15.318 16.307 15.103 2624 HA ILE 39 HA ILE 39 17.649 14.661 15.677 2625 HB ILE 39 HB ILE 39 17.715 17.065 14.956 2626 HG12 ILE 39 2HG1 ILE 39 19.111 16.376 17.609 2627 HG13 ILE 39 1HG1 ILE 39 19.640 15.945 15.940 2628 HG21 ILE 39 1HG2 ILE 39 15.759 17.898 16.249 2629 HG22 ILE 39 2HG2 ILE 39 17.230 18.848 16.613 2630 HG23 ILE 39 3HG2 ILE 39 16.640 17.640 17.801 2631 HD11 ILE 39 3HD ILE 39 19.416 18.799 17.112 2632 HD12 ILE 39 1HD ILE 39 20.921 17.901 16.720 2633 HD13 ILE 39 2HD ILE 39 19.814 18.424 15.398 2634 H SER 40 H SER 40 14.553 14.976 16.926 2635 HA SER 40 HA SER 40 15.252 15.104 19.700 2636 HB2 SER 40 2HB SER 40 12.508 14.636 18.414 2637 HB3 SER 40 1HB SER 40 12.846 15.196 20.098 2638 HG SER 40 1HG SER 40 12.578 17.035 19.115 2639 H TYR 41 H TYR 41 15.733 13.375 20.934 2640 HA TYR 41 HA TYR 41 15.448 10.752 19.934 2641 HB2 TYR 41 2HB TYR 41 17.450 11.212 21.170 2642 HB3 TYR 41 1HB TYR 41 16.530 11.828 22.581 2643 HD1 TYR 41 1HD TYR 41 15.990 8.572 20.631 2644 HD2 TYR 41 2HD TYR 41 17.233 10.453 24.306 2645 HE1 TYR 41 1HE TYR 41 16.025 6.386 21.738 2646 HE2 TYR 41 2HE TYR 41 17.279 8.257 25.412 2647 HH TYR 41 HH TYR 41 16.223 5.257 23.742 2648 HA PRO 42 HA PRO 42 12.450 9.627 23.234 2649 HB2 PRO 42 2HB PRO 42 10.921 11.494 24.709 2650 HB3 PRO 42 1HB PRO 42 12.531 10.876 25.238 2651 HG2 PRO 42 2HG PRO 42 11.915 13.467 23.710 2652 HG3 PRO 42 1HG PRO 42 12.952 13.268 25.180 2653 HD2 PRO 42 2HD PRO 42 14.033 13.376 22.649 2654 HD3 PRO 42 1HD PRO 42 14.708 12.204 23.876 2655 H ASP 43 H ASP 43 11.798 12.293 21.112 2656 HA ASP 43 HA ASP 43 9.020 11.613 20.701 2657 HB2 ASP 43 2HB ASP 43 10.869 13.406 18.983 2658 HB3 ASP 43 1HB ASP 43 9.084 13.235 18.818 2659 H ALA 44 H ALA 44 12.093 10.368 19.668 2660 HA ALA 44 HA ALA 44 11.540 10.128 16.920 2661 HB1 ALA 44 1HB ALA 44 13.487 8.590 16.823 2662 HB2 ALA 44 2HB ALA 44 13.505 8.482 18.626 2663 HB3 ALA 44 3HB ALA 44 13.872 10.039 17.805 2664 H ILE 45 H ILE 45 10.807 8.141 19.721 2665 HA ILE 45 HA ILE 45 10.080 5.830 18.229 2666 HB ILE 45 HB ILE 45 10.997 5.915 20.532 2667 HG12 ILE 45 2HG1 ILE 45 9.769 3.904 19.479 2668 HG13 ILE 45 1HG1 ILE 45 10.184 3.937 21.218 2669 HG21 ILE 45 1HG2 ILE 45 8.175 6.814 21.398 2670 HG22 ILE 45 2HG2 ILE 45 9.672 7.813 21.435 2671 HG23 ILE 45 3HG2 ILE 45 9.541 6.354 22.471 2672 HD11 ILE 45 3HD ILE 45 7.368 4.369 20.055 2673 HD12 ILE 45 1HD ILE 45 7.975 2.949 20.957 2674 HD13 ILE 45 2HD ILE 45 7.800 4.522 21.804 2675 H TRP 46 H TRP 46 8.646 8.894 18.770 2676 HA TRP 46 HA TRP 46 5.935 7.957 18.773 2677 HB2 TRP 46 2HB TRP 46 7.094 10.371 19.584 2678 HB3 TRP 46 1HB TRP 46 6.275 10.828 18.060 2679 HD1 TRP 46 HD TRP 46 3.621 11.264 18.413 2680 HE1 TRP 46 1HE TRP 46 2.075 11.120 20.504 2681 HE3 TRP 46 3HE TRP 46 6.649 8.522 21.449 2682 HZ2 TRP 46 2HZ TRP 46 1.997 9.626 22.928 2683 HZ3 TRP 46 3HZ TRP 46 5.761 7.660 23.585 2684 HH2 TRP 46 HH TRP 46 3.472 8.222 24.326 2685 H TRP 47 H TRP 47 8.183 9.667 16.641 2686 HA TRP 47 HA TRP 47 6.760 9.731 14.281 2687 HB2 TRP 47 2HB TRP 47 8.863 10.991 14.599 2688 HB3 TRP 47 1HB TRP 47 9.784 9.466 14.840 2689 HD1 TRP 47 HD TRP 47 8.033 11.437 11.915 2690 HE1 TRP 47 1HE TRP 47 9.010 10.651 9.735 2691 HE3 TRP 47 3HE TRP 47 10.981 7.716 13.765 2692 HZ2 TRP 47 2HZ TRP 47 10.946 8.683 8.857 2693 HZ3 TRP 47 3HZ TRP 47 12.307 6.342 12.197 2694 HH2 TRP 47 HH TRP 47 12.314 6.839 9.777 2695 H SER 48 H SER 48 8.960 7.084 15.556 2696 HA SER 48 HA SER 48 9.007 5.819 13.114 2697 HB2 SER 48 2HB SER 48 9.912 3.805 14.305 2698 HB3 SER 48 1HB SER 48 10.766 5.348 14.670 2699 HG SER 48 1HG SER 48 10.387 4.134 16.532 2700 H VAL 49 H VAL 49 6.402 5.876 15.308 2701 HA VAL 49 HA VAL 49 5.216 3.392 14.503 2702 HB VAL 49 HB VAL 49 4.130 5.900 15.845 2703 HG11 VAL 49 1HG1 VAL 49 2.230 4.976 14.549 2704 HG12 VAL 49 2HG1 VAL 49 2.029 4.535 16.273 2705 HG13 VAL 49 3HG1 VAL 49 2.616 3.306 15.103 2706 HG21 VAL 49 3HG2 VAL 49 3.975 4.211 17.763 2707 HG22 VAL 49 1HG2 VAL 49 5.681 4.426 17.179 2708 HG23 VAL 49 2HG2 VAL 49 4.723 2.974 16.699 2709 H GLU 50 H GLU 50 4.912 6.863 13.447 2710 HA GLU 50 HA GLU 50 3.231 5.956 11.247 2711 HB2 GLU 50 2HB GLU 50 3.961 8.753 12.241 2712 HB3 GLU 50 1HB GLU 50 3.105 8.430 10.706 2713 HG2 GLU 50 2HG GLU 50 1.342 7.104 12.019 2714 HG3 GLU 50 1HG GLU 50 2.109 7.701 13.538 2715 H THR 51 H THR 51 5.152 4.596 10.801 2716 HA THR 51 HA THR 51 6.600 5.709 8.589 2717 HB THR 51 HB THR 51 8.173 4.570 10.986 2718 HG1 THR 51 1HG THR 51 7.419 6.966 10.768 2719 HG21 THR 51 3HG2 THR 51 10.197 5.079 9.589 2720 HG22 THR 51 1HG2 THR 51 9.140 5.599 8.228 2721 HG23 THR 51 2HG2 THR 51 9.155 3.874 8.755 2722 H ALA 52 H ALA 52 6.381 3.020 11.035 2723 HA ALA 52 HA ALA 52 7.176 1.035 9.228 2724 HB1 ALA 52 1HB ALA 52 5.509 0.800 11.812 2725 HB2 ALA 52 2HB ALA 52 7.309 0.719 11.694 2726 HB3 ALA 52 3HB ALA 52 6.301 -0.575 10.957 2727 H THR 53 H THR 53 4.093 2.628 9.631 2728 HA THR 53 HA THR 53 2.527 0.570 8.428 2729 HB THR 53 HB THR 53 0.863 2.615 8.605 2730 HG1 THR 53 1HG THR 53 1.608 4.291 9.773 2731 HG21 THR 53 3HG2 THR 53 0.616 2.220 11.073 2732 HG22 THR 53 1HG2 THR 53 2.265 1.502 11.151 2733 HG23 THR 53 2HG2 THR 53 0.962 0.673 10.222 2734 H THR 54 H THR 54 4.830 2.723 7.203 2735 HA THR 54 HA THR 54 5.170 3.840 5.387 2736 HB THR 54 HB THR 54 4.120 2.846 3.167 2737 HG1 THR 54 1HG THR 54 2.646 1.551 4.567 2738 HG21 THR 54 3HG2 THR 54 6.060 1.315 5.032 2739 HG22 THR 54 1HG2 THR 54 6.483 2.665 3.902 2740 HG23 THR 54 2HG2 THR 54 5.900 1.097 3.248 2741 H VAL 55 H VAL 55 3.269 5.035 7.020 2742 HA VAL 55 HA VAL 55 1.002 5.776 5.497 2743 HB VAL 55 HB VAL 55 0.863 5.565 7.853 2744 HG11 VAL 55 1HG1 VAL 55 3.007 7.762 8.144 2745 HG12 VAL 55 2HG1 VAL 55 3.214 6.011 8.541 2746 HG13 VAL 55 3HG1 VAL 55 2.039 7.024 9.447 2747 HG21 VAL 55 3HG2 VAL 55 -0.196 7.715 8.478 2748 HG22 VAL 55 1HG2 VAL 55 -0.549 7.362 6.741 2749 HG23 VAL 55 2HG2 VAL 55 0.701 8.581 7.193 2750 H GLY 56 H GLY 56 4.158 7.364 6.209 2751 HA2 GLY 56 2HA GLY 56 5.101 8.609 4.458 2752 HA3 GLY 56 1HA GLY 56 3.474 9.263 4.042 2753 H TYR 57 H TYR 57 2.388 10.628 5.722 2754 HA TYR 57 HA TYR 57 4.310 12.435 6.795 2755 HB2 TYR 57 2HB TYR 57 2.497 13.845 7.549 2756 HB3 TYR 57 1HB TYR 57 1.988 13.180 5.952 2757 HD1 TYR 57 1HD TYR 57 1.570 12.999 9.628 2758 HD2 TYR 57 2HD TYR 57 0.127 11.497 5.857 2759 HE1 TYR 57 1HE TYR 57 0.036 11.529 10.804 2760 HE2 TYR 57 2HE TYR 57 -1.551 10.139 7.060 2761 HH TYR 57 HH TYR 57 -1.051 9.590 10.535 2762 H GLY 58 H GLY 58 5.038 12.589 9.057 2763 HA2 GLY 58 2HA GLY 58 3.594 10.935 10.972 2764 HA3 GLY 58 1HA GLY 58 5.316 10.503 10.589 2765 H ASP 59 H ASP 59 3.829 13.669 10.505 2766 HA ASP 59 HA ASP 59 4.280 15.612 11.348 2767 HB2 ASP 59 2HB ASP 59 3.740 14.906 13.621 2768 HB3 ASP 59 1HB ASP 59 5.414 14.284 13.856 2769 H ARG 60 H ARG 60 7.068 13.469 12.012 2770 HA ARG 60 HA ARG 60 8.818 15.672 11.168 2771 HB2 ARG 60 2HB ARG 60 9.798 13.102 12.479 2772 HB3 ARG 60 1HB ARG 60 10.594 14.709 12.363 2773 HG2 ARG 60 2HG ARG 60 8.482 15.565 13.738 2774 HG3 ARG 60 1HG ARG 60 8.202 13.837 14.104 2775 HD2 ARG 60 2HD ARG 60 10.570 13.756 15.119 2776 HD3 ARG 60 1HD ARG 60 10.694 15.542 14.863 2777 HE ARG 60 HE ARG 60 9.116 14.102 16.914 2778 HH11 ARG 60 1HH2 ARG 60 8.766 17.141 14.997 2779 HH12 ARG 60 2HH2 ARG 60 8.508 18.111 16.343 2780 HH21 ARG 60 1HH1 ARG 60 8.473 15.587 18.836 2781 HH22 ARG 60 2HH1 ARG 60 7.912 17.108 18.375 2782 H TYR 61 H TYR 61 10.709 15.082 9.639 2783 HA TYR 61 HA TYR 61 10.120 12.846 7.978 2784 HB2 TYR 61 2HB TYR 61 10.484 14.436 5.891 2785 HB3 TYR 61 1HB TYR 61 8.841 14.330 6.611 2786 HD1 TYR 61 1HD TYR 61 7.979 16.107 8.082 2787 HD2 TYR 61 2HD TYR 61 11.730 16.545 6.026 2788 HE1 TYR 61 1HE TYR 61 7.880 18.523 8.447 2789 HE2 TYR 61 2HE TYR 61 11.611 18.994 6.331 2790 HH TYR 61 HH TYR 61 8.673 20.515 7.733 2791 HA PRO 62 HA PRO 62 14.440 13.210 8.575 2792 HB2 PRO 62 2HB PRO 62 15.449 11.594 6.534 2793 HB3 PRO 62 1HB PRO 62 14.488 10.910 7.910 2794 HG2 PRO 62 2HG PRO 62 13.522 11.677 5.093 2795 HG3 PRO 62 1HG PRO 62 13.204 10.129 5.991 2796 HD2 PRO 62 2HD PRO 62 11.402 12.235 5.948 2797 HD3 PRO 62 1HD PRO 62 11.625 11.213 7.447 2798 H VAL 63 H VAL 63 16.555 13.922 7.567 2799 HA VAL 63 HA VAL 63 16.042 15.770 5.343 2800 HB VAL 63 HB VAL 63 18.545 15.574 7.072 2801 HG11 VAL 63 1HG1 VAL 63 18.684 18.060 6.433 2802 HG12 VAL 63 2HG1 VAL 63 17.303 17.830 5.309 2803 HG13 VAL 63 3HG1 VAL 63 18.883 17.023 4.992 2804 HG21 VAL 63 3HG2 VAL 63 16.063 17.382 7.464 2805 HG22 VAL 63 1HG2 VAL 63 17.575 17.355 8.448 2806 HG23 VAL 63 2HG2 VAL 63 16.458 15.977 8.498 2807 H THR 64 H THR 64 19.077 15.444 4.637 2808 HA THR 64 HA THR 64 18.326 13.600 2.610 2809 HB THR 64 HB THR 64 20.509 14.549 1.584 2810 HG1 THR 64 1HG THR 64 21.184 16.420 2.541 2811 HG21 THR 64 3HG2 THR 64 18.138 15.191 0.987 2812 HG22 THR 64 1HG2 THR 64 19.227 16.622 0.950 2813 HG23 THR 64 2HG2 THR 64 18.101 16.374 2.337 2814 H GLU 65 H GLU 65 21.255 13.983 4.663 2815 HA GLU 65 HA GLU 65 22.412 11.590 3.621 2816 HB2 GLU 65 2HB GLU 65 23.604 13.766 4.556 2817 HB3 GLU 65 1HB GLU 65 23.241 13.096 6.177 2818 HG2 GLU 65 2HG GLU 65 25.527 12.555 5.665 2819 HG3 GLU 65 1HG GLU 65 24.610 11.012 5.515 2820 H GLU 66 H GLU 66 22.251 9.515 4.531 2821 HA GLU 66 HA GLU 66 21.223 7.890 5.538 2822 HB2 GLU 66 2HB GLU 66 21.616 9.584 8.037 2823 HB3 GLU 66 1HB GLU 66 20.897 7.936 8.089 2824 HG2 GLU 66 2HG GLU 66 23.668 8.433 6.843 2825 HG3 GLU 66 1HG GLU 66 23.415 8.203 8.610 2826 H GLY 67 H GLY 67 19.611 9.875 7.855 2827 HA2 GLY 67 2HA GLY 67 17.463 10.077 8.391 2828 HA3 GLY 67 1HA GLY 67 17.525 10.995 6.848 2829 H ARG 68 H ARG 68 16.968 9.911 4.944 2830 HA ARG 68 HA ARG 68 14.581 8.408 5.158 2831 HB2 ARG 68 2HB ARG 68 15.145 10.268 3.500 2832 HB3 ARG 68 1HB ARG 68 16.261 9.131 2.710 2833 HG2 ARG 68 2HG ARG 68 13.916 7.642 2.667 2834 HG3 ARG 68 1HG ARG 68 13.202 9.272 2.769 2835 HD2 ARG 68 2HD ARG 68 13.483 8.432 0.351 2836 HD3 ARG 68 1HD ARG 68 14.358 9.972 0.671 2837 HE ARG 68 HE ARG 68 16.299 8.899 0.218 2838 HH11 ARG 68 1HH2 ARG 68 13.904 6.246 0.904 2839 HH12 ARG 68 2HH2 ARG 68 15.148 5.023 0.878 2840 HH21 ARG 68 1HH1 ARG 68 17.898 7.010 0.264 2841 HH22 ARG 68 2HH1 ARG 68 17.213 5.410 0.522 2842 H LYS 69 H LYS 69 18.005 7.595 4.414 2843 HA LYS 69 HA LYS 69 17.463 5.033 3.267 2844 HB2 LYS 69 2HB LYS 69 19.970 6.042 4.759 2845 HB3 LYS 69 1HB LYS 69 19.871 4.497 3.863 2846 HG2 LYS 69 2HG LYS 69 19.564 5.691 1.716 2847 HG3 LYS 69 1HG LYS 69 19.620 7.280 2.585 2848 HD2 LYS 69 2HD LYS 69 21.885 6.728 3.454 2849 HD3 LYS 69 1HD LYS 69 21.919 5.194 2.544 2850 HE2 LYS 69 2HE LYS 69 21.626 7.971 1.169 2851 HE3 LYS 69 1HE LYS 69 23.215 7.267 1.623 2852 HZ1 LYS 69 3HZ LYS 69 21.352 6.181 -0.409 2853 HZ2 LYS 69 1HZ LYS 69 22.684 5.330 0.222 2854 HZ3 LYS 69 2HZ LYS 69 22.913 6.810 -0.558 2855 H VAL 70 H VAL 70 17.547 6.320 6.524 2856 HA VAL 70 HA VAL 70 17.744 3.740 7.786 2857 HB VAL 70 HB VAL 70 17.087 6.534 8.853 2858 HG11 VAL 70 1HG1 VAL 70 17.413 3.844 10.343 2859 HG12 VAL 70 2HG1 VAL 70 15.915 4.852 10.263 2860 HG13 VAL 70 3HG1 VAL 70 17.363 5.485 11.103 2861 HG21 VAL 70 3HG2 VAL 70 19.581 4.688 8.955 2862 HG22 VAL 70 1HG2 VAL 70 19.415 6.230 9.861 2863 HG23 VAL 70 2HG2 VAL 70 19.441 6.238 8.066 2864 H ALA 71 H ALA 71 15.230 6.260 7.195 2865 HA ALA 71 HA ALA 71 13.073 4.896 8.215 2866 HB1 ALA 71 1HB ALA 71 11.634 6.335 6.801 2867 HB2 ALA 71 2HB ALA 71 13.033 6.740 5.742 2868 HB3 ALA 71 3HB ALA 71 12.996 7.308 7.452 2869 H GLU 72 H GLU 72 14.483 4.712 4.976 2870 HA GLU 72 HA GLU 72 12.836 3.182 3.519 2871 HB2 GLU 72 2HB GLU 72 15.081 4.208 2.911 2872 HB3 GLU 72 1HB GLU 72 15.891 2.868 3.775 2873 HG2 GLU 72 2HG GLU 72 14.952 1.243 2.080 2874 HG3 GLU 72 1HG GLU 72 14.174 2.620 1.214 2875 H GLN 73 H GLN 73 15.227 1.983 5.905 2876 HA GLN 73 HA GLN 73 14.749 -0.748 5.321 2877 HB2 GLN 73 2HB GLN 73 16.896 0.133 6.319 2878 HB3 GLN 73 1HB GLN 73 16.014 0.528 7.829 2879 HG2 GLN 73 2HG GLN 73 15.509 -1.920 8.176 2880 HG3 GLN 73 1HG GLN 73 16.342 -2.309 6.626 2881 HE21 GLN 73 1HE2 GLN 73 17.323 -3.639 8.724 2882 HE22 GLN 73 2HE2 GLN 73 18.860 -3.003 9.221 2883 H VAL 74 H VAL 74 13.440 1.579 7.681 2884 HA VAL 74 HA VAL 74 12.202 -0.329 9.351 2885 HB VAL 74 HB VAL 74 11.515 2.629 8.907 2886 HG11 VAL 74 1HG1 VAL 74 10.559 2.500 11.237 2887 HG12 VAL 74 2HG1 VAL 74 10.837 0.717 11.255 2888 HG13 VAL 74 3HG1 VAL 74 9.664 1.444 10.097 2889 HG21 VAL 74 3HG2 VAL 74 13.932 2.269 9.547 2890 HG22 VAL 74 1HG2 VAL 74 13.411 1.269 10.947 2891 HG23 VAL 74 2HG2 VAL 74 13.004 3.027 10.871 2892 H MET 75 H MET 75 11.087 1.655 6.600 2893 HA MET 75 HA MET 75 8.413 0.847 6.617 2894 HB2 MET 75 2HB MET 75 10.261 1.766 4.333 2895 HB3 MET 75 1HB MET 75 8.493 1.524 4.142 2896 HG2 MET 75 2HG MET 75 8.091 3.161 6.016 2897 HG3 MET 75 1HG MET 75 9.828 3.530 6.072 2898 HE1 MET 75 3HE MET 75 10.431 5.194 2.485 2899 HE2 MET 75 1HE MET 75 10.597 3.453 2.854 2900 HE3 MET 75 2HE MET 75 11.185 4.683 4.034 2901 H LYS 76 H LYS 76 11.274 -0.520 4.886 2902 HA LYS 76 HA LYS 76 9.863 -2.403 3.421 2903 HB2 LYS 76 2HB LYS 76 12.341 -1.777 3.111 2904 HB3 LYS 76 1HB LYS 76 12.710 -2.815 4.524 2905 HG2 LYS 76 2HG LYS 76 11.619 -4.778 3.236 2906 HG3 LYS 76 1HG LYS 76 11.451 -3.669 1.833 2907 HD2 LYS 76 2HD LYS 76 13.995 -3.399 1.847 2908 HD3 LYS 76 1HD LYS 76 14.065 -4.621 3.172 2909 HE2 LYS 76 2HE LYS 76 12.938 -6.313 1.622 2910 HE3 LYS 76 1HE LYS 76 12.955 -5.070 0.309 2911 HZ1 LYS 76 3HZ LYS 76 15.519 -5.070 0.822 2912 HZ2 LYS 76 1HZ LYS 76 14.786 -6.226 -0.168 2913 HZ3 LYS 76 2HZ LYS 76 15.192 -6.615 1.455 2914 H ALA 77 H ALA 77 11.232 -2.592 6.712 2915 HA ALA 77 HA ALA 77 10.760 -5.325 7.113 2916 HB1 ALA 77 1HB ALA 77 10.969 -4.816 9.555 2917 HB2 ALA 77 2HB ALA 77 10.801 -3.054 9.203 2918 HB3 ALA 77 3HB ALA 77 12.250 -3.955 8.622 2919 H GLY 78 H GLY 78 8.687 -2.456 7.529 2920 HA2 GLY 78 2HA GLY 78 6.598 -3.726 8.934 2921 HA3 GLY 78 1HA GLY 78 6.527 -2.215 7.948 2922 H ILE 79 H ILE 79 7.063 -3.032 5.439 2923 HA ILE 79 HA ILE 79 4.648 -4.084 4.591 2924 HB ILE 79 HB ILE 79 7.327 -3.984 3.117 2925 HG12 ILE 79 2HG1 ILE 79 4.929 -2.031 3.043 2926 HG13 ILE 79 1HG1 ILE 79 6.408 -1.754 3.997 2927 HG21 ILE 79 1HG2 ILE 79 5.747 -5.582 1.976 2928 HG22 ILE 79 2HG2 ILE 79 5.922 -4.092 1.011 2929 HG23 ILE 79 3HG2 ILE 79 4.447 -4.336 2.014 2930 HD11 ILE 79 3HD ILE 79 6.271 -1.973 0.918 2931 HD12 ILE 79 1HD ILE 79 6.568 -0.501 1.897 2932 HD13 ILE 79 2HD ILE 79 7.793 -1.819 1.877 2933 H GLU 80 H GLU 80 7.835 -5.691 4.956 2934 HA GLU 80 HA GLU 80 7.115 -8.206 3.997 2935 HB2 GLU 80 2HB GLU 80 9.189 -7.180 6.000 2936 HB3 GLU 80 1HB GLU 80 9.073 -8.938 5.672 2937 HG2 GLU 80 2HG GLU 80 9.272 -7.162 3.216 2938 HG3 GLU 80 1HG GLU 80 10.716 -7.229 4.282 2939 H VAL 81 H VAL 81 6.504 -6.737 7.185 2940 HA VAL 81 HA VAL 81 5.945 -9.260 8.462 2941 HB VAL 81 HB VAL 81 5.692 -6.335 9.247 2942 HG11 VAL 81 1HG1 VAL 81 3.668 -7.307 10.243 2943 HG12 VAL 81 2HG1 VAL 81 4.908 -7.164 11.530 2944 HG13 VAL 81 3HG1 VAL 81 4.570 -8.769 10.791 2945 HG21 VAL 81 3HG2 VAL 81 7.376 -7.057 10.945 2946 HG22 VAL 81 1HG2 VAL 81 7.935 -7.538 9.310 2947 HG23 VAL 81 2HG2 VAL 81 7.222 -8.768 10.423 2948 H PHE 82 H PHE 82 3.996 -6.503 7.164 2949 HA PHE 82 HA PHE 82 1.532 -7.655 7.800 2950 HB2 PHE 82 2HB PHE 82 2.100 -5.825 5.372 2951 HB3 PHE 82 1HB PHE 82 0.512 -6.056 6.190 2952 HD1 PHE 82 1HD PHE 82 1.457 -5.820 9.138 2953 HD2 PHE 82 2HD PHE 82 2.388 -3.543 5.601 2954 HE1 PHE 82 1HE PHE 82 2.017 -3.871 10.531 2955 HE2 PHE 82 2HE PHE 82 2.952 -1.597 7.008 2956 HZ PHE 82 HZ PHE 82 2.783 -1.755 9.474 2957 H ALA 83 H ALA 83 3.520 -7.804 4.829 2958 HA ALA 83 HA ALA 83 1.678 -9.303 3.333 2959 HB1 ALA 83 1HB ALA 83 4.748 -9.122 3.058 2960 HB2 ALA 83 2HB ALA 83 3.567 -7.973 2.327 2961 HB3 ALA 83 3HB ALA 83 3.599 -9.685 1.785 2962 H LEU 84 H LEU 84 3.957 -10.283 5.842 2963 HA LEU 84 HA LEU 84 4.251 -12.978 4.961 2964 HB2 LEU 84 2HB LEU 84 5.832 -11.865 6.537 2965 HB3 LEU 84 1HB LEU 84 4.578 -11.829 7.810 2966 HG LEU 84 HG LEU 84 5.408 -14.485 6.528 2967 HD11 LEU 84 1HD1 LEU 84 7.560 -13.347 6.965 2968 HD12 LEU 84 2HD1 LEU 84 7.321 -14.708 8.115 2969 HD13 LEU 84 3HD1 LEU 84 7.073 -13.008 8.668 2970 HD21 LEU 84 3HD2 LEU 84 4.607 -13.742 9.427 2971 HD22 LEU 84 1HD2 LEU 84 5.096 -15.380 8.870 2972 HD23 LEU 84 2HD2 LEU 84 3.597 -14.632 8.243 2973 H VAL 85 H VAL 85 1.848 -11.164 6.807 2974 HA VAL 85 HA VAL 85 0.603 -13.320 8.072 2975 HB VAL 85 HB VAL 85 -0.647 -10.663 7.217 2976 HG11 VAL 85 1HG1 VAL 85 -2.111 -11.052 9.263 2977 HG12 VAL 85 2HG1 VAL 85 -1.450 -12.725 9.389 2978 HG13 VAL 85 3HG1 VAL 85 -2.412 -12.229 7.948 2979 HG21 VAL 85 3HG2 VAL 85 0.982 -11.471 9.731 2980 HG22 VAL 85 1HG2 VAL 85 0.002 -9.964 9.588 2981 HG23 VAL 85 2HG2 VAL 85 1.399 -10.216 8.507 2982 H THR 86 H THR 86 0.693 -12.493 4.654 2983 HA THR 86 HA THR 86 -1.714 -13.552 3.893 2984 HB THR 86 HB THR 86 0.918 -13.526 2.376 2985 HG1 THR 86 1HG THR 86 -0.164 -11.624 1.513 2986 HG21 THR 86 3HG2 THR 86 -0.602 -13.535 0.344 2987 HG22 THR 86 1HG2 THR 86 -2.029 -13.796 1.412 2988 HG23 THR 86 2HG2 THR 86 -0.750 -15.065 1.267 2989 H ALA 87 H ALA 87 1.007 -15.281 5.264 2990 HA ALA 87 HA ALA 87 0.335 -17.846 4.281 2991 HB1 ALA 87 1HB ALA 87 1.559 -17.064 7.003 2992 HB2 ALA 87 2HB ALA 87 2.482 -17.403 5.496 2993 HB3 ALA 87 3HB ALA 87 1.554 -18.724 6.289 2994 H ALA 88 H ALA 88 -1.179 -15.730 6.649 2995 HA ALA 88 HA ALA 88 -2.812 -17.867 7.730 2996 HB1 ALA 88 1HB ALA 88 -2.872 -14.830 8.282 2997 HB2 ALA 88 2HB ALA 88 -2.073 -16.046 9.333 2998 HB3 ALA 88 3HB ALA 88 -3.866 -16.051 9.132 2999 H LEU 89 H LEU 89 -2.954 -15.120 5.487 3000 HA LEU 89 HA LEU 89 -5.765 -15.157 5.291 3001 HB2 LEU 89 2HB LEU 89 -3.759 -14.109 3.211 3002 HB3 LEU 89 1HB LEU 89 -5.498 -13.699 3.304 3003 HG LEU 89 HG LEU 89 -3.413 -13.017 5.465 3004 HD11 LEU 89 1HD1 LEU 89 -3.428 -10.735 4.596 3005 HD12 LEU 89 2HD1 LEU 89 -4.641 -11.165 3.330 3006 HD13 LEU 89 3HD1 LEU 89 -2.983 -11.850 3.271 3007 HD21 LEU 89 3HD2 LEU 89 -5.156 -11.452 6.342 3008 HD22 LEU 89 1HD2 LEU 89 -5.689 -13.166 6.443 3009 HD23 LEU 89 2HD2 LEU 89 -6.340 -12.093 5.145 3010 H ALA 90 H ALA 90 -3.206 -16.611 3.219 3011 HA ALA 90 HA ALA 90 -4.966 -17.243 1.145 3012 HB1 ALA 90 1HB ALA 90 -2.288 -18.544 1.897 3013 HB2 ALA 90 2HB ALA 90 -2.509 -17.125 0.815 3014 HB3 ALA 90 3HB ALA 90 -3.128 -18.740 0.306 3015 H THR 91 H THR 91 -4.257 -18.998 4.149 3016 HA THR 91 HA THR 91 -5.326 -21.439 3.127 3017 HB THR 91 HB THR 91 -3.634 -21.623 4.735 3018 HG1 THR 91 1HG THR 91 -6.180 -22.482 5.453 3019 HG21 THR 91 3HG2 THR 91 -3.885 -19.478 5.928 3020 HG22 THR 91 1HG2 THR 91 -3.868 -20.849 7.060 3021 HG23 THR 91 2HG2 THR 91 -5.432 -20.022 6.675 3022 H ASP 92 H ASP 92 -6.881 -18.468 3.930 3023 HA ASP 92 HA ASP 92 -9.254 -19.812 4.882 3024 HB2 ASP 92 2HB ASP 92 -8.571 -16.902 4.403 3025 HB3 ASP 92 1HB ASP 92 -10.295 -17.404 4.299 3026 H PHE 93 H PHE 93 -7.809 -19.364 1.755 3027 HA PHE 93 HA PHE 93 -10.315 -19.423 0.389 3028 HB2 PHE 93 2HB PHE 93 -9.218 -19.377 -1.585 3029 HB3 PHE 93 1HB PHE 93 -7.882 -18.818 -0.537 3030 HD1 PHE 93 1HD PHE 93 -9.296 -22.035 -2.020 3031 HD2 PHE 93 2HD PHE 93 -5.799 -19.732 -1.035 3032 HE1 PHE 93 1HE PHE 93 -7.877 -23.723 -3.109 3033 HE2 PHE 93 2HE PHE 93 -4.390 -21.398 -2.180 3034 HZ PHE 93 HZ PHE 93 -5.417 -23.413 -3.204 3035 H VAL 94 H VAL 94 -8.200 -21.767 1.905 3036 HA VAL 94 HA VAL 94 -9.240 -24.044 0.623 3037 HB VAL 94 HB VAL 94 -7.798 -23.869 3.323 3038 HG11 VAL 94 1HG1 VAL 94 -8.028 -26.126 1.206 3039 HG12 VAL 94 2HG1 VAL 94 -8.767 -26.128 2.849 3040 HG13 VAL 94 3HG1 VAL 94 -6.978 -26.167 2.671 3041 HG21 VAL 94 3HG2 VAL 94 -5.719 -24.184 1.921 3042 HG22 VAL 94 1HG2 VAL 94 -6.485 -22.598 1.612 3043 HG23 VAL 94 2HG2 VAL 94 -6.694 -23.934 0.425 3044 H ARG 95 H ARG 95 -10.247 -22.114 3.412 3045 HA ARG 95 HA ARG 95 -11.854 -24.145 4.558 3046 HB2 ARG 95 2HB ARG 95 -12.054 -21.109 4.952 3047 HB3 ARG 95 1HB ARG 95 -12.958 -22.365 5.864 3048 HG2 ARG 95 2HG ARG 95 -10.596 -23.399 6.386 3049 HG3 ARG 95 1HG ARG 95 -9.942 -21.802 5.928 3050 HD2 ARG 95 2HD ARG 95 -12.246 -21.502 7.809 3051 HD3 ARG 95 1HD ARG 95 -11.076 -22.715 8.459 3052 HE ARG 95 HE ARG 95 -10.298 -19.903 7.553 3053 HH11 ARG 95 1HH2 ARG 95 -10.078 -22.475 10.199 3054 HH12 ARG 95 2HH2 ARG 95 -9.630 -21.274 11.350 3055 HH21 ARG 95 1HH1 ARG 95 -9.473 -18.491 9.197 3056 HH22 ARG 95 2HH1 ARG 95 -9.234 -19.080 10.798 3057 H ARG 96 H ARG 96 -12.271 -22.339 1.651 3058 HA ARG 96 HA ARG 96 -15.078 -22.219 1.566 3059 HB2 ARG 96 2HB ARG 96 -13.694 -21.011 -0.052 3060 HB3 ARG 96 1HB ARG 96 -12.955 -22.536 -0.641 3061 HG2 ARG 96 2HG ARG 96 -15.967 -22.148 -0.908 3062 HG3 ARG 96 1HG ARG 96 -14.841 -21.285 -2.020 3063 HD2 ARG 96 2HD ARG 96 -13.762 -23.433 -2.686 3064 HD3 ARG 96 1HD ARG 96 -14.920 -24.369 -1.663 3065 HE ARG 96 HE ARG 96 -16.726 -23.110 -3.093 3066 HH11 ARG 96 1HH2 ARG 96 -14.000 -25.336 -3.742 3067 HH12 ARG 96 2HH2 ARG 96 -14.426 -25.656 -5.346 3068 HH21 ARG 96 1HH1 ARG 96 -17.248 -23.484 -5.535 3069 HH22 ARG 96 2HH1 ARG 96 -16.259 -24.537 -6.436 3070 H GLU 97 H GLU 97 -12.743 -24.891 1.001 3071 HA GLU 97 HA GLU 97 -14.785 -26.495 -0.209 3072 HB2 GLU 97 2HB GLU 97 -11.996 -26.505 -0.243 3073 HB3 GLU 97 1HB GLU 97 -12.355 -27.904 0.813 3074 HG2 GLU 97 2HG GLU 97 -12.180 -28.709 -1.486 3075 HG3 GLU 97 1HG GLU 97 -13.919 -28.769 -1.035 3076 H GLU 98 H GLU 98 -13.611 -25.881 3.035 3077 HA GLU 98 HA GLU 98 -14.851 -28.260 4.111 3078 HB2 GLU 98 2HB GLU 98 -13.540 -25.988 5.682 3079 HB3 GLU 98 1HB GLU 98 -13.986 -27.635 6.251 3080 HG2 GLU 98 2HG GLU 98 -12.451 -28.519 4.307 3081 HG3 GLU 98 1HG GLU 98 -11.805 -26.841 4.199 3082 H GLU 99 H GLU 99 -15.568 -24.809 3.716 3083 HA GLU 99 HA GLU 99 -17.878 -24.537 5.182 3084 HB2 GLU 99 2HB GLU 99 -16.862 -22.623 4.098 3085 HB3 GLU 99 1HB GLU 99 -16.972 -23.365 2.484 3086 HG2 GLU 99 2HG GLU 99 -19.527 -22.657 4.018 3087 HG3 GLU 99 1HG GLU 99 -18.575 -21.409 3.139 3088 H ARG 100 H ARG 100 -17.377 -25.829 1.910 3089 HA ARG 100 HA ARG 100 -19.949 -26.161 1.178 3090 HB2 ARG 100 2HB ARG 100 -17.599 -26.615 -0.084 3091 HB3 ARG 100 1HB ARG 100 -17.964 -28.321 0.324 3092 HG2 ARG 100 2HG ARG 100 -20.397 -27.512 -0.721 3093 HG3 ARG 100 1HG ARG 100 -19.326 -26.376 -1.590 3094 HD2 ARG 100 2HD ARG 100 -19.270 -29.483 -1.615 3095 HD3 ARG 100 1HD ARG 100 -19.777 -28.377 -2.962 3096 HE ARG 100 HE ARG 100 -17.041 -27.791 -2.224 3097 HH11 ARG 100 1HH2 ARG 100 -19.046 -30.213 -4.046 3098 HH12 ARG 100 2HH2 ARG 100 -17.706 -30.989 -4.739 3099 HH21 ARG 100 1HH1 ARG 100 -15.184 -28.749 -3.538 3100 HH22 ARG 100 2HH1 ARG 100 -15.485 -30.167 -4.401 3101 H ARG 101 H ARG 101 -18.208 -28.107 3.472 3102 HA ARG 101 HA ARG 101 -19.896 -30.433 3.348 3103 HB2 ARG 101 2HB ARG 101 -18.160 -29.404 5.699 3104 HB3 ARG 101 1HB ARG 101 -18.793 -31.073 5.507 3105 HG2 ARG 101 2HG ARG 101 -16.736 -29.705 3.638 3106 HG3 ARG 101 1HG ARG 101 -16.329 -30.684 5.086 3107 HD2 ARG 101 2HD ARG 101 -17.467 -32.678 4.109 3108 HD3 ARG 101 1HD ARG 101 -17.812 -31.755 2.581 3109 HE ARG 101 HE ARG 101 -15.191 -31.324 2.668 3110 HH11 ARG 101 1HH2 ARG 101 -16.833 -34.423 3.535 3111 HH12 ARG 101 2HH2 ARG 101 -15.525 -35.410 3.078 3112 HH21 ARG 101 1HH1 ARG 101 -13.339 -32.714 2.084 3113 HH22 ARG 101 2HH1 ARG 101 -13.501 -34.414 2.183 3114 H GLY 102 H GLY 102 -19.598 -27.455 5.331 3115 HA2 GLY 102 2HA GLY 102 -21.305 -26.330 6.264 3116 HA3 GLY 102 1HA GLY 102 -22.355 -27.793 6.252 3117 H HIS 103 H HIS 103 -19.555 -28.979 7.270 3118 HA HIS 103 HA HIS 103 -18.666 -29.624 9.146 3119 HB2 HIS 103 2HB HIS 103 -20.188 -27.708 10.961 3120 HB3 HIS 103 1HB HIS 103 -18.674 -28.601 11.281 3121 HD1 HIS 103 1HD HIS 103 -20.047 -25.672 9.362 3122 HD2 HIS 103 2HD HIS 103 -16.330 -27.118 10.683 3123 HE1 HIS 103 1HE HIS 103 -18.339 -23.793 9.040 3124 HE2 HIS 103 2HE HIS 103 -16.174 -24.630 9.985 Start of MODEL 4 1 H1 SER 1 H SER 1 -21.905 -12.412 -1.192 2 HA SER 1 HA SER 1 -23.998 -13.716 -1.582 3 HB2 SER 1 2HB SER 1 -22.151 -13.215 -3.990 4 HB3 SER 1 1HB SER 1 -23.928 -12.928 -3.853 5 HG SER 1 1HG SER 1 -22.506 -11.072 -3.728 6 H ALA 2 H ALA 2 -20.826 -14.886 -2.566 7 HA ALA 2 HA ALA 2 -21.920 -17.492 -3.377 8 HB1 ALA 2 1HB ALA 2 -20.111 -16.654 -4.845 9 HB2 ALA 2 2HB ALA 2 -19.549 -18.098 -3.944 10 HB3 ALA 2 3HB ALA 2 -19.007 -16.438 -3.445 11 H ASP 3 H ASP 3 -18.830 -17.126 -1.656 12 HA ASP 3 HA ASP 3 -20.122 -17.840 0.868 13 HB2 ASP 3 2HB ASP 3 -19.015 -19.908 -0.601 14 HB3 ASP 3 1HB ASP 3 -17.537 -19.357 0.241 15 H HIS 4 H HIS 4 -16.796 -17.642 -0.405 16 HA HIS 4 HA HIS 4 -15.790 -16.178 1.670 17 HB2 HIS 4 2HB HIS 4 -13.830 -15.582 0.113 18 HB3 HIS 4 1HB HIS 4 -14.250 -17.311 0.222 19 HD1 HIS 4 1HD HIS 4 -14.938 -14.385 -2.342 20 HD2 HIS 4 2HD HIS 4 -14.719 -18.588 -2.082 21 HE1 HIS 4 1HE HIS 4 -15.257 -15.261 -4.620 22 HE2 HIS 4 2HE HIS 4 -15.050 -17.811 -4.465 23 H GLU 5 H GLU 5 -17.623 -14.889 -1.014 24 HA GLU 5 HA GLU 5 -16.443 -12.279 -0.888 25 HB2 GLU 5 2HB GLU 5 -17.403 -13.251 -2.984 26 HB3 GLU 5 1HB GLU 5 -19.051 -13.137 -2.277 27 HG2 GLU 5 2HG GLU 5 -19.042 -10.743 -2.343 28 HG3 GLU 5 1HG GLU 5 -17.248 -10.648 -2.430 29 H ARG 6 H ARG 6 -19.012 -14.015 0.769 30 HA ARG 6 HA ARG 6 -20.508 -11.801 1.689 31 HB2 ARG 6 2HB ARG 6 -21.301 -14.223 1.716 32 HB3 ARG 6 1HB ARG 6 -20.014 -14.605 2.906 33 HG2 ARG 6 2HG ARG 6 -21.119 -13.008 4.542 34 HG3 ARG 6 1HG ARG 6 -22.473 -12.825 3.368 35 HD2 ARG 6 2HD ARG 6 -22.908 -15.330 3.511 36 HD3 ARG 6 1HD ARG 6 -21.524 -15.492 4.658 37 HE ARG 6 HE ARG 6 -22.713 -14.218 6.345 38 HH11 ARG 6 1HH2 ARG 6 -24.896 -15.592 3.888 39 HH12 ARG 6 2HH2 ARG 6 -26.271 -14.742 4.369 40 HH21 ARG 6 1HH1 ARG 6 -24.648 -13.394 7.277 41 HH22 ARG 6 2HH1 ARG 6 -26.138 -13.393 6.430 42 H GLU 7 H GLU 7 -17.755 -13.711 2.905 43 HA GLU 7 HA GLU 7 -17.533 -12.507 5.402 44 HB2 GLU 7 2HB GLU 7 -16.522 -14.756 4.353 45 HB3 GLU 7 1HB GLU 7 -15.163 -13.709 3.855 46 HG2 GLU 7 2HG GLU 7 -14.508 -14.732 5.919 47 HG3 GLU 7 1HG GLU 7 -14.947 -13.046 6.374 48 H ALA 8 H ALA 8 -16.023 -11.872 2.243 49 HA ALA 8 HA ALA 8 -14.205 -9.908 3.030 50 HB1 ALA 8 1HB ALA 8 -14.201 -9.209 0.616 51 HB2 ALA 8 2HB ALA 8 -15.664 -10.213 0.322 52 HB3 ALA 8 3HB ALA 8 -14.104 -11.001 0.774 53 H GLN 9 H GLN 9 -17.609 -9.636 1.857 54 HA GLN 9 HA GLN 9 -17.548 -6.821 1.877 55 HB2 GLN 9 2HB GLN 9 -19.141 -8.432 0.598 56 HB3 GLN 9 1HB GLN 9 -20.098 -8.502 2.112 57 HG2 GLN 9 2HG GLN 9 -20.387 -5.978 1.989 58 HG3 GLN 9 1HG GLN 9 -19.395 -5.943 0.486 59 HE21 GLN 9 1HE2 GLN 9 -20.533 -6.313 -1.506 60 HE22 GLN 9 2HE2 GLN 9 -22.155 -6.901 -1.571 61 H LYS 10 H LYS 10 -18.226 -9.239 4.368 62 HA LYS 10 HA LYS 10 -19.453 -7.467 6.181 63 HB2 LYS 10 2HB LYS 10 -19.593 -9.989 6.366 64 HB3 LYS 10 1HB LYS 10 -17.848 -10.032 6.768 65 HG2 LYS 10 2HG LYS 10 -19.169 -10.275 8.816 66 HG3 LYS 10 1HG LYS 10 -18.272 -8.726 8.851 67 HD2 LYS 10 2HD LYS 10 -20.441 -7.584 8.018 68 HD3 LYS 10 1HD LYS 10 -21.276 -9.146 8.335 69 HE2 LYS 10 2HE LYS 10 -20.536 -8.953 10.778 70 HE3 LYS 10 1HE LYS 10 -19.753 -7.366 10.382 71 HZ1 LYS 10 3HZ LYS 10 -21.903 -7.014 11.302 72 HZ2 LYS 10 1HZ LYS 10 -22.629 -8.078 10.177 73 HZ3 LYS 10 2HZ LYS 10 -21.966 -6.588 9.632 74 H ALA 11 H ALA 11 -16.073 -8.219 5.408 75 HA ALA 11 HA ALA 11 -14.954 -6.946 7.679 76 HB1 ALA 11 1HB ALA 11 -13.689 -7.327 4.888 77 HB2 ALA 11 2HB ALA 11 -13.646 -8.546 6.212 78 HB3 ALA 11 3HB ALA 11 -12.816 -6.969 6.418 79 H GLU 12 H GLU 12 -15.854 -5.796 4.378 80 HA GLU 12 HA GLU 12 -14.798 -3.227 4.663 81 HB2 GLU 12 2HB GLU 12 -17.326 -3.970 3.054 82 HB3 GLU 12 1HB GLU 12 -16.400 -2.435 2.959 83 HG2 GLU 12 2HG GLU 12 -14.362 -3.854 2.208 84 HG3 GLU 12 1HG GLU 12 -15.514 -5.223 1.991 85 H GLU 13 H GLU 13 -17.828 -4.614 5.859 86 HA GLU 13 HA GLU 13 -19.196 -2.212 6.390 87 HB2 GLU 13 2HB GLU 13 -20.182 -4.619 6.441 88 HB3 GLU 13 1HB GLU 13 -19.344 -4.839 8.004 89 HG2 GLU 13 2HG GLU 13 -20.731 -2.733 8.815 90 HG3 GLU 13 1HG GLU 13 -21.717 -2.997 7.329 91 H GLU 14 H GLU 14 -16.882 -4.190 8.221 92 HA GLU 14 HA GLU 14 -17.175 -2.886 10.674 93 HB2 GLU 14 2HB GLU 14 -16.212 -5.212 10.256 94 HB3 GLU 14 1HB GLU 14 -14.704 -4.437 9.676 95 HG2 GLU 14 2HG GLU 14 -14.306 -3.457 11.928 96 HG3 GLU 14 1HG GLU 14 -15.934 -4.002 12.478 97 H LEU 15 H LEU 15 -15.156 -2.282 7.828 98 HA LEU 15 HA LEU 15 -13.359 -0.521 8.965 99 HB2 LEU 15 2HB LEU 15 -13.279 -1.509 6.601 100 HB3 LEU 15 1HB LEU 15 -14.511 -0.325 6.105 101 HG LEU 15 HG LEU 15 -12.990 1.563 6.610 102 HD11 LEU 15 1HD1 LEU 15 -10.539 1.101 7.184 103 HD12 LEU 15 2HD1 LEU 15 -11.003 -0.592 7.571 104 HD13 LEU 15 3HD1 LEU 15 -11.688 0.782 8.515 105 HD21 LEU 15 3HD2 LEU 15 -12.923 0.518 4.344 106 HD22 LEU 15 1HD2 LEU 15 -11.591 -0.573 4.871 107 HD23 LEU 15 2HD2 LEU 15 -11.325 1.201 4.808 108 H GLN 16 H GLN 16 -16.582 0.095 7.532 109 HA GLN 16 HA GLN 16 -16.430 2.895 7.660 110 HB2 GLN 16 2HB GLN 16 -18.956 1.144 7.869 111 HB3 GLN 16 1HB GLN 16 -18.906 2.915 7.548 112 HG2 GLN 16 2HG GLN 16 -17.629 2.457 5.398 113 HG3 GLN 16 1HG GLN 16 -17.789 0.683 5.713 114 HE21 GLN 16 1HE2 GLN 16 -19.165 0.385 3.811 115 HE22 GLN 16 2HE2 GLN 16 -20.818 0.893 3.814 116 H LYS 17 H LYS 17 -17.447 0.456 10.025 117 HA LYS 17 HA LYS 17 -18.614 2.219 11.875 118 HB2 LYS 17 2HB LYS 17 -18.878 -0.322 11.776 119 HB3 LYS 17 1HB LYS 17 -17.205 -0.471 12.404 120 HG2 LYS 17 2HG LYS 17 -17.932 0.684 14.537 121 HG3 LYS 17 1HG LYS 17 -19.581 0.873 13.852 122 HD2 LYS 17 2HD LYS 17 -19.619 -0.974 15.394 123 HD3 LYS 17 1HD LYS 17 -19.804 -1.645 13.734 124 HE2 LYS 17 2HE LYS 17 -17.364 -2.335 13.761 125 HE3 LYS 17 1HE LYS 17 -17.182 -1.603 15.404 126 HZ1 LYS 17 3HZ LYS 17 -17.446 -3.982 15.442 127 HZ2 LYS 17 1HZ LYS 17 -18.956 -3.938 14.724 128 HZ3 LYS 17 2HZ LYS 17 -18.755 -3.245 16.259 129 H VAL 18 H VAL 18 -15.264 1.090 11.362 130 HA VAL 18 HA VAL 18 -14.205 2.234 13.721 131 HB VAL 18 HB VAL 18 -12.875 1.384 11.098 132 HG11 VAL 18 1HG1 VAL 18 -11.611 2.285 13.777 133 HG12 VAL 18 2HG1 VAL 18 -11.394 3.063 12.166 134 HG13 VAL 18 3HG1 VAL 18 -10.723 1.426 12.457 135 HG21 VAL 18 3HG2 VAL 18 -13.977 -0.456 12.462 136 HG22 VAL 18 1HG2 VAL 18 -13.045 0.064 13.904 137 HG23 VAL 18 2HG2 VAL 18 -12.191 -0.604 12.463 138 H LEU 19 H LEU 19 -14.595 3.415 10.334 139 HA LEU 19 HA LEU 19 -13.164 5.753 10.565 140 HB2 LEU 19 2HB LEU 19 -15.837 5.379 9.060 141 HB3 LEU 19 1HB LEU 19 -14.734 6.772 8.846 142 HG LEU 19 HG LEU 19 -14.028 3.864 8.160 143 HD11 LEU 19 1HD1 LEU 19 -15.817 4.815 6.677 144 HD12 LEU 19 2HD1 LEU 19 -14.262 4.587 5.796 145 HD13 LEU 19 3HD1 LEU 19 -14.767 6.234 6.325 146 HD21 LEU 19 3HD2 LEU 19 -11.973 5.105 8.710 147 HD22 LEU 19 1HD2 LEU 19 -12.525 6.518 7.742 148 HD23 LEU 19 2HD2 LEU 19 -12.110 4.981 6.917 149 H GLU 20 H GLU 20 -16.589 5.134 11.395 150 HA GLU 20 HA GLU 20 -17.133 7.835 12.052 151 HB2 GLU 20 2HB GLU 20 -18.707 5.293 12.777 152 HB3 GLU 20 1HB GLU 20 -19.307 6.983 12.900 153 HG2 GLU 20 2HG GLU 20 -19.032 7.242 10.393 154 HG3 GLU 20 1HG GLU 20 -18.498 5.534 10.282 155 H GLU 21 H GLU 21 -15.823 5.120 13.857 156 HA GLU 21 HA GLU 21 -16.371 6.350 16.413 157 HB2 GLU 21 2HB GLU 21 -16.002 3.779 15.810 158 HB3 GLU 21 1HB GLU 21 -14.270 4.162 15.985 159 HG2 GLU 21 2HG GLU 21 -14.754 5.009 18.347 160 HG3 GLU 21 1HG GLU 21 -16.493 4.611 18.112 161 H ALA 22 H ALA 22 -13.753 6.025 14.051 162 HA ALA 22 HA ALA 22 -11.700 7.126 15.549 163 HB1 ALA 22 1HB ALA 22 -11.281 5.798 13.503 164 HB2 ALA 22 2HB ALA 22 -10.555 7.443 13.325 165 HB3 ALA 22 3HB ALA 22 -12.108 7.036 12.509 166 H SER 23 H SER 23 -14.234 8.740 13.508 167 HA SER 23 HA SER 23 -12.894 11.225 13.542 168 HB2 SER 23 2HB SER 23 -15.331 12.118 13.116 169 HB3 SER 23 1HB SER 23 -14.559 11.051 11.888 170 HG SER 23 1HG SER 23 -16.745 10.461 12.497 171 H LYS 24 H LYS 24 -15.201 9.633 15.759 172 HA LYS 24 HA LYS 24 -15.523 11.904 17.405 173 HB2 LYS 24 2HB LYS 24 -17.066 9.906 17.398 174 HB3 LYS 24 1HB LYS 24 -15.782 8.943 18.198 175 HG2 LYS 24 2HG LYS 24 -15.850 10.509 20.171 176 HG3 LYS 24 1HG LYS 24 -17.084 11.510 19.334 177 HD2 LYS 24 2HD LYS 24 -18.642 9.559 19.283 178 HD3 LYS 24 1HD LYS 24 -17.405 8.541 20.109 179 HE2 LYS 24 2HE LYS 24 -17.513 10.050 22.138 180 HE3 LYS 24 1HE LYS 24 -18.758 11.070 21.303 181 HZ1 LYS 24 3HZ LYS 24 -19.014 8.166 21.970 182 HZ2 LYS 24 1HZ LYS 24 -20.145 9.081 21.131 183 HZ3 LYS 24 2HZ LYS 24 -19.809 9.489 22.756 184 H LYS 25 H LYS 25 -13.319 9.053 17.629 185 HA LYS 25 HA LYS 25 -12.048 9.929 19.979 186 HB2 LYS 25 2HB LYS 25 -10.809 8.264 17.709 187 HB3 LYS 25 1HB LYS 25 -10.107 8.495 19.343 188 HG2 LYS 25 2HG LYS 25 -12.158 7.344 20.343 189 HG3 LYS 25 1HG LYS 25 -12.718 7.021 18.664 190 HD2 LYS 25 2HD LYS 25 -10.303 5.978 18.332 191 HD3 LYS 25 1HD LYS 25 -10.257 5.859 20.112 192 HE2 LYS 25 2HE LYS 25 -12.412 4.640 18.231 193 HE3 LYS 25 1HE LYS 25 -10.996 3.741 18.882 194 HZ1 LYS 25 3HZ LYS 25 -11.925 3.590 20.937 195 HZ2 LYS 25 1HZ LYS 25 -13.261 3.513 19.906 196 HZ3 LYS 25 2HZ LYS 25 -12.975 4.932 20.779 197 H ALA 26 H ALA 26 -11.193 10.485 16.491 198 HA ALA 26 HA ALA 26 -8.812 11.782 16.944 199 HB1 ALA 26 1HB ALA 26 -9.046 12.722 14.646 200 HB2 ALA 26 2HB ALA 26 -10.783 12.225 14.615 201 HB3 ALA 26 3HB ALA 26 -9.478 10.980 14.679 202 H VAL 27 H VAL 27 -12.130 13.271 16.540 203 HA VAL 27 HA VAL 27 -11.136 15.892 16.669 204 HB VAL 27 HB VAL 27 -13.889 14.802 17.471 205 HG11 VAL 27 1HG1 VAL 27 -12.907 17.722 17.087 206 HG12 VAL 27 2HG1 VAL 27 -13.647 17.011 18.574 207 HG13 VAL 27 3HG1 VAL 27 -14.643 17.232 17.098 208 HG21 VAL 27 3HG2 VAL 27 -14.518 15.629 15.224 209 HG22 VAL 27 1HG2 VAL 27 -13.138 14.497 15.051 210 HG23 VAL 27 2HG2 VAL 27 -12.845 16.257 14.950 211 H GLU 28 H GLU 28 -12.251 13.657 19.246 212 HA GLU 28 HA GLU 28 -12.080 15.686 21.240 213 HB2 GLU 28 2HB GLU 28 -12.169 12.640 21.511 214 HB3 GLU 28 1HB GLU 28 -12.466 13.798 22.851 215 HG2 GLU 28 2HG GLU 28 -14.216 13.759 20.291 216 HG3 GLU 28 1HG GLU 28 -14.505 12.649 21.663 217 H ALA 29 H ALA 29 -9.858 13.273 19.899 218 HA ALA 29 HA ALA 29 -7.966 13.276 21.998 219 HB1 ALA 29 1HB ALA 29 -8.094 11.437 20.269 220 HB2 ALA 29 2HB ALA 29 -6.493 12.214 20.232 221 HB3 ALA 29 3HB ALA 29 -7.691 12.626 18.984 222 H GLU 30 H GLU 30 -8.296 14.968 18.897 223 HA GLU 30 HA GLU 30 -6.021 16.551 19.145 224 HB2 GLU 30 2HB GLU 30 -7.358 15.917 17.056 225 HB3 GLU 30 1HB GLU 30 -8.671 16.992 17.632 226 HG2 GLU 30 2HG GLU 30 -7.521 18.269 16.036 227 HG3 GLU 30 1HG GLU 30 -6.901 18.891 17.584 228 H ARG 31 H ARG 31 -9.318 16.857 20.394 229 HA ARG 31 HA ARG 31 -9.271 19.611 20.776 230 HB2 ARG 31 2HB ARG 31 -11.424 18.418 20.841 231 HB3 ARG 31 1HB ARG 31 -10.906 17.509 22.297 232 HG2 ARG 31 2HG ARG 31 -12.524 19.354 22.810 233 HG3 ARG 31 1HG ARG 31 -10.974 19.487 23.698 234 HD2 ARG 31 2HD ARG 31 -10.180 21.212 21.956 235 HD3 ARG 31 1HD ARG 31 -11.836 21.128 21.220 236 HE ARG 31 HE ARG 31 -12.124 21.674 24.040 237 HH11 ARG 31 1HH2 ARG 31 -9.945 23.298 21.735 238 HH12 ARG 31 2HH2 ARG 31 -10.718 24.764 21.678 239 HH21 ARG 31 1HH1 ARG 31 -13.061 23.918 24.310 240 HH22 ARG 31 2HH1 ARG 31 -12.549 25.176 23.233 241 H GLY 32 H GLY 32 -7.687 20.619 21.878 242 HA2 GLY 32 2HA GLY 32 -7.276 21.469 24.011 243 HA3 GLY 32 1HA GLY 32 -7.306 19.806 24.693 244 H ALA 33 H ALA 33 -5.890 19.234 21.801 245 HA ALA 33 HA ALA 33 -3.426 18.930 23.184 246 HB1 ALA 33 1HB ALA 33 -2.678 17.715 21.123 247 HB2 ALA 33 2HB ALA 33 -4.201 18.205 20.299 248 HB3 ALA 33 3HB ALA 33 -4.268 17.109 21.717 249 HA PRO 34 HA PRO 34 -1.601 22.552 21.255 250 HB2 PRO 34 2HB PRO 34 1.137 21.967 21.394 251 HB3 PRO 34 1HB PRO 34 0.158 22.320 22.866 252 HG2 PRO 34 2HG PRO 34 0.901 19.571 21.738 253 HG3 PRO 34 1HG PRO 34 1.057 20.152 23.452 254 HD2 PRO 34 2HD PRO 34 -1.114 18.665 22.560 255 HD3 PRO 34 1HD PRO 34 -1.322 19.976 23.806 256 H GLY 35 H GLY 35 -0.883 23.182 19.074 257 HA2 GLY 35 2HA GLY 35 0.110 22.886 17.072 258 HA3 GLY 35 1HA GLY 35 0.485 21.171 17.486 259 H ALA 36 H ALA 36 -2.238 20.725 18.257 260 HA ALA 36 HA ALA 36 -3.534 19.426 16.477 261 HB1 ALA 36 1HB ALA 36 -4.407 19.604 18.737 262 HB2 ALA 36 2HB ALA 36 -5.699 20.376 17.763 263 HB3 ALA 36 3HB ALA 36 -4.521 21.401 18.625 264 H ALA 37 H ALA 37 -4.893 19.575 14.798 265 HA ALA 37 HA ALA 37 -5.798 22.256 13.898 266 HB1 ALA 37 1HB ALA 37 -4.504 20.083 12.124 267 HB2 ALA 37 2HB ALA 37 -3.746 21.655 12.554 268 HB3 ALA 37 3HB ALA 37 -5.231 21.628 11.528 269 H LEU 38 H LEU 38 -6.268 18.731 14.153 270 HA LEU 38 HA LEU 38 -8.383 18.629 12.226 271 HB2 LEU 38 2HB LEU 38 -6.590 16.879 12.646 272 HB3 LEU 38 1HB LEU 38 -7.253 16.630 14.277 273 HG LEU 38 HG LEU 38 -9.324 15.653 13.357 274 HD11 LEU 38 1HD1 LEU 38 -9.576 16.886 11.209 275 HD12 LEU 38 2HD1 LEU 38 -9.519 15.105 10.932 276 HD13 LEU 38 3HD1 LEU 38 -8.067 16.096 10.583 277 HD21 LEU 38 3HD2 LEU 38 -7.318 14.245 13.836 278 HD22 LEU 38 1HD2 LEU 38 -6.792 14.401 12.122 279 HD23 LEU 38 2HD2 LEU 38 -8.341 13.568 12.521 280 H ILE 39 H ILE 39 -9.349 20.504 13.952 281 HA ILE 39 HA ILE 39 -10.820 19.062 16.061 282 HB ILE 39 HB ILE 39 -9.181 20.561 16.845 283 HG12 ILE 39 2HG1 ILE 39 -12.038 21.569 17.341 284 HG13 ILE 39 1HG1 ILE 39 -11.178 20.237 18.189 285 HG21 ILE 39 1HG2 ILE 39 -8.980 22.100 14.901 286 HG22 ILE 39 2HG2 ILE 39 -9.181 22.993 16.423 287 HG23 ILE 39 3HG2 ILE 39 -10.570 22.842 15.294 288 HD11 ILE 39 3HD ILE 39 -10.369 23.234 18.224 289 HD12 ILE 39 1HD ILE 39 -11.178 22.346 19.546 290 HD13 ILE 39 2HD ILE 39 -9.494 21.905 19.067 291 H SER 40 H SER 40 -12.419 18.333 14.254 292 HA SER 40 HA SER 40 -14.726 19.903 14.588 293 HB2 SER 40 2HB SER 40 -13.666 21.363 12.773 294 HB3 SER 40 1HB SER 40 -13.394 19.891 11.796 295 HG SER 40 1HG SER 40 -15.123 20.487 10.960 296 H TYR 41 H TYR 41 -16.462 18.463 14.225 297 HA TYR 41 HA TYR 41 -15.854 15.755 13.670 298 HB2 TYR 41 2HB TYR 41 -18.486 17.221 14.199 299 HB3 TYR 41 1HB TYR 41 -18.472 15.520 13.620 300 HD1 TYR 41 1HD TYR 41 -17.332 17.731 16.474 301 HD2 TYR 41 2HD TYR 41 -17.865 13.717 15.006 302 HE1 TYR 41 1HE TYR 41 -17.020 16.852 18.755 303 HE2 TYR 41 2HE TYR 41 -17.585 12.848 17.277 304 HH TYR 41 HH TYR 41 -16.624 14.827 20.062 305 HA PRO 42 HA PRO 42 -18.132 15.997 9.687 306 HB2 PRO 42 2HB PRO 42 -18.329 18.424 8.178 307 HB3 PRO 42 1HB PRO 42 -19.611 17.736 9.247 308 HG2 PRO 42 2HG PRO 42 -17.500 19.845 9.943 309 HG3 PRO 42 1HG PRO 42 -19.274 19.869 10.313 310 HD2 PRO 42 2HD PRO 42 -17.470 19.103 12.214 311 HD3 PRO 42 1HD PRO 42 -19.009 18.145 12.018 312 H ASP 43 H ASP 43 -15.229 18.040 10.005 313 HA ASP 43 HA ASP 43 -14.306 16.887 7.478 314 HB2 ASP 43 2HB ASP 43 -12.335 18.474 7.732 315 HB3 ASP 43 1HB ASP 43 -13.917 19.052 7.152 316 H ALA 44 H ALA 44 -14.076 16.227 10.874 317 HA ALA 44 HA ALA 44 -11.540 14.941 10.621 318 HB1 ALA 44 1HB ALA 44 -13.764 14.441 12.670 319 HB2 ALA 44 2HB ALA 44 -12.290 15.461 12.883 320 HB3 ALA 44 3HB ALA 44 -12.119 13.690 12.716 321 H ILE 45 H ILE 45 -14.912 14.001 9.983 322 HA ILE 45 HA ILE 45 -14.277 11.248 9.743 323 HB ILE 45 HB ILE 45 -16.511 11.821 10.230 324 HG12 ILE 45 2HG1 ILE 45 -17.817 10.655 8.467 325 HG13 ILE 45 1HG1 ILE 45 -16.395 10.657 7.379 326 HG21 ILE 45 1HG2 ILE 45 -17.986 13.048 8.619 327 HG22 ILE 45 2HG2 ILE 45 -16.553 13.446 7.614 328 HG23 ILE 45 3HG2 ILE 45 -16.678 14.058 9.298 329 HD11 ILE 45 3HD ILE 45 -16.507 9.299 10.170 330 HD12 ILE 45 1HD ILE 45 -16.714 8.467 8.588 331 HD13 ILE 45 2HD ILE 45 -15.135 9.214 9.002 332 H TRP 46 H TRP 46 -13.977 13.998 7.524 333 HA TRP 46 HA TRP 46 -13.586 12.353 5.230 334 HB2 TRP 46 2HB TRP 46 -13.731 15.210 5.827 335 HB3 TRP 46 1HB TRP 46 -12.254 14.921 4.870 336 HD1 TRP 46 HD TRP 46 -12.816 15.485 2.413 337 HE1 TRP 46 1HE TRP 46 -14.856 15.337 0.896 338 HE3 TRP 46 3HE TRP 46 -15.991 13.090 5.620 339 HZ2 TRP 46 2HZ TRP 46 -17.451 14.118 0.958 340 HZ3 TRP 46 3HZ TRP 46 -18.240 12.452 4.840 341 HH2 TRP 46 HH TRP 46 -18.964 12.962 2.539 342 H TRP 47 H TRP 47 -11.445 13.723 7.708 343 HA TRP 47 HA TRP 47 -9.006 13.018 6.466 344 HB2 TRP 47 2HB TRP 47 -9.197 14.624 8.365 345 HB3 TRP 47 1HB TRP 47 -9.759 13.304 9.440 346 HD1 TRP 47 HD TRP 47 -6.457 14.394 7.563 347 HE1 TRP 47 1HE TRP 47 -4.505 13.388 8.837 348 HE3 TRP 47 3HE TRP 47 -9.110 11.476 10.795 349 HZ2 TRP 47 2HZ TRP 47 -4.123 11.640 11.106 350 HZ3 TRP 47 3HZ TRP 47 -7.899 10.119 12.472 351 HH2 TRP 47 HH TRP 47 -5.443 10.224 12.641 352 H SER 48 H SER 48 -11.290 11.357 8.631 353 HA SER 48 HA SER 48 -9.823 9.080 9.156 354 HB2 SER 48 2HB SER 48 -12.092 9.986 10.152 355 HB3 SER 48 1HB SER 48 -12.884 9.084 8.809 356 HG SER 48 1HG SER 48 -12.738 7.935 10.764 357 H VAL 49 H VAL 49 -12.061 9.815 6.412 358 HA VAL 49 HA VAL 49 -12.059 7.312 5.243 359 HB VAL 49 HB VAL 49 -12.369 10.076 3.986 360 HG11 VAL 49 1HG1 VAL 49 -11.703 8.519 2.147 361 HG12 VAL 49 2HG1 VAL 49 -13.467 8.840 2.049 362 HG13 VAL 49 3HG1 VAL 49 -12.879 7.286 2.731 363 HG21 VAL 49 3HG2 VAL 49 -14.105 9.307 5.726 364 HG22 VAL 49 1HG2 VAL 49 -14.416 7.862 4.711 365 HG23 VAL 49 2HG2 VAL 49 -14.792 9.502 4.078 366 H GLU 50 H GLU 50 -9.757 10.063 4.638 367 HA GLU 50 HA GLU 50 -8.390 8.545 2.662 368 HB2 GLU 50 2HB GLU 50 -6.648 10.325 2.706 369 HB3 GLU 50 1HB GLU 50 -8.302 10.947 2.439 370 HG2 GLU 50 2HG GLU 50 -8.422 11.670 4.847 371 HG3 GLU 50 1HG GLU 50 -6.753 11.052 5.110 372 H THR 51 H THR 51 -8.318 8.454 6.103 373 HA THR 51 HA THR 51 -5.586 7.586 6.282 374 HB THR 51 HB THR 51 -7.799 7.510 8.393 375 HG1 THR 51 1HG THR 51 -7.367 9.616 7.776 376 HG21 THR 51 3HG2 THR 51 -5.820 7.445 9.979 377 HG22 THR 51 1HG2 THR 51 -4.706 7.295 8.569 378 HG23 THR 51 2HG2 THR 51 -5.875 5.979 8.943 379 H ALA 52 H ALA 52 -8.828 6.044 6.149 380 HA ALA 52 HA ALA 52 -7.850 3.453 6.804 381 HB1 ALA 52 1HB ALA 52 -10.056 2.652 5.843 382 HB2 ALA 52 2HB ALA 52 -10.394 4.341 5.307 383 HB3 ALA 52 3HB ALA 52 -10.246 3.954 7.069 384 H THR 53 H THR 53 -8.156 5.286 3.729 385 HA THR 53 HA THR 53 -7.514 2.944 2.174 386 HB THR 53 HB THR 53 -7.497 4.673 0.297 387 HG1 THR 53 1HG THR 53 -7.013 6.470 1.554 388 HG21 THR 53 3HG2 THR 53 -9.972 4.984 0.377 389 HG22 THR 53 1HG2 THR 53 -10.001 4.617 2.139 390 HG23 THR 53 2HG2 THR 53 -9.544 3.333 0.955 391 H THR 54 H THR 54 -5.715 4.565 4.303 392 HA THR 54 HA THR 54 -3.654 5.147 4.596 393 HB THR 54 HB THR 54 -1.952 3.443 3.843 394 HG1 THR 54 1HG THR 54 -3.124 2.960 1.890 395 HG21 THR 54 3HG2 THR 54 -2.979 1.657 5.228 396 HG22 THR 54 1HG2 THR 54 -4.630 2.326 4.962 397 HG23 THR 54 2HG2 THR 54 -3.424 3.267 5.912 398 H VAL 55 H VAL 55 -4.409 7.115 3.014 399 HA VAL 55 HA VAL 55 -2.078 7.331 1.223 400 HB VAL 55 HB VAL 55 -4.013 7.203 -0.202 401 HG11 VAL 55 1HG1 VAL 55 -5.735 8.948 -0.285 402 HG12 VAL 55 2HG1 VAL 55 -5.089 9.804 1.093 403 HG13 VAL 55 3HG1 VAL 55 -5.799 8.150 1.327 404 HG21 VAL 55 3HG2 VAL 55 -3.436 9.203 -1.531 405 HG22 VAL 55 1HG2 VAL 55 -1.962 8.527 -0.754 406 HG23 VAL 55 2HG2 VAL 55 -2.724 10.012 -0.084 407 H GLY 56 H GLY 56 -4.478 9.617 2.659 408 HA2 GLY 56 2HA GLY 56 -4.158 11.297 4.087 409 HA3 GLY 56 1HA GLY 56 -2.515 10.645 4.474 410 H TYR 57 H TYR 57 -4.412 12.690 2.209 411 HA TYR 57 HA TYR 57 -2.131 13.129 0.485 412 HB2 TYR 57 2HB TYR 57 -4.833 14.630 0.759 413 HB3 TYR 57 1HB TYR 57 -3.590 15.027 -0.494 414 HD1 TYR 57 2HD TYR 57 -2.838 13.248 -2.100 415 HD2 TYR 57 1HD TYR 57 -6.304 12.771 0.398 416 HE1 TYR 57 2HE TYR 57 -3.626 11.416 -3.551 417 HE2 TYR 57 1HE TYR 57 -7.092 10.927 -1.038 418 HH TYR 57 HH TYR 57 -6.247 9.314 -2.603 419 H GLY 58 H GLY 58 -3.062 14.334 3.494 420 HA2 GLY 58 2HA GLY 58 -1.587 15.572 4.763 421 HA3 GLY 58 1HA GLY 58 -0.993 16.423 3.292 422 H ASP 59 H ASP 59 -4.420 15.874 4.057 423 HA ASP 59 HA ASP 59 -4.956 18.659 3.881 424 HB2 ASP 59 2HB ASP 59 -6.556 16.808 3.152 425 HB3 ASP 59 1HB ASP 59 -6.798 16.401 4.880 426 H ARG 60 H ARG 60 -4.826 16.229 6.618 427 HA ARG 60 HA ARG 60 -4.235 18.444 8.366 428 HB2 ARG 60 2HB ARG 60 -6.221 16.303 9.343 429 HB3 ARG 60 1HB ARG 60 -5.592 17.726 10.228 430 HG2 ARG 60 2HG ARG 60 -7.622 18.595 9.669 431 HG3 ARG 60 1HG ARG 60 -6.713 19.081 8.201 432 HD2 ARG 60 2HD ARG 60 -7.578 16.702 7.244 433 HD3 ARG 60 1HD ARG 60 -8.825 16.834 8.537 434 HE ARG 60 HE ARG 60 -8.776 18.164 6.007 435 HH11 ARG 60 1HH2 ARG 60 -9.649 18.883 9.411 436 HH12 ARG 60 2HH2 ARG 60 -10.892 19.970 9.021 437 HH21 ARG 60 1HH1 ARG 60 -9.934 20.020 5.506 438 HH22 ARG 60 2HH1 ARG 60 -10.815 20.924 6.688 439 H TYR 61 H TYR 61 -3.416 17.322 10.592 440 HA TYR 61 HA TYR 61 -2.206 14.818 10.041 441 HB2 TYR 61 2HB TYR 61 0.080 15.653 10.739 442 HB3 TYR 61 1HB TYR 61 -0.427 16.321 9.151 443 HD1 TYR 61 2HD TYR 61 -1.316 18.743 9.068 444 HD2 TYR 61 1HD TYR 61 0.599 17.082 12.533 445 HE1 TYR 61 2HE TYR 61 -1.044 21.012 10.008 446 HE2 TYR 61 1HE TYR 61 0.837 19.318 13.500 447 HH TYR 61 HH TYR 61 -0.054 21.517 13.350 448 HA PRO 62 HA PRO 62 -3.351 15.211 14.414 449 HB2 PRO 62 2HB PRO 62 -2.394 12.763 15.371 450 HB3 PRO 62 1HB PRO 62 -3.725 12.840 14.169 451 HG2 PRO 62 2HG PRO 62 -0.753 12.314 13.686 452 HG3 PRO 62 1HG PRO 62 -2.178 11.434 13.000 453 HD2 PRO 62 2HD PRO 62 -0.747 13.549 11.729 454 HD3 PRO 62 1HD PRO 62 -2.470 13.096 11.337 455 H VAL 63 H VAL 63 -1.968 14.623 16.728 456 HA VAL 63 HA VAL 63 0.742 15.685 16.332 457 HB VAL 63 HB VAL 63 -0.786 17.472 16.785 458 HG11 VAL 63 1HG1 VAL 63 -1.242 16.212 19.567 459 HG12 VAL 63 2HG1 VAL 63 -2.436 16.378 18.222 460 HG13 VAL 63 3HG1 VAL 63 -1.759 17.835 18.991 461 HG21 VAL 63 3HG2 VAL 63 0.709 18.664 18.180 462 HG22 VAL 63 1HG2 VAL 63 1.690 17.500 17.250 463 HG23 VAL 63 2HG2 VAL 63 1.345 17.205 18.996 464 H THR 64 H THR 64 0.954 15.626 19.326 465 HA THR 64 HA THR 64 1.714 12.845 19.489 466 HB THR 64 HB THR 64 2.457 15.191 21.314 467 HG1 THR 64 1HG THR 64 4.288 15.295 19.984 468 HG21 THR 64 3HG2 THR 64 3.860 12.472 20.762 469 HG22 THR 64 1HG2 THR 64 2.921 12.864 22.246 470 HG23 THR 64 2HG2 THR 64 4.430 13.757 21.876 471 H GLU 65 H GLU 65 -0.063 15.365 21.381 472 HA GLU 65 HA GLU 65 -0.621 13.507 23.444 473 HB2 GLU 65 2HB GLU 65 -0.181 16.009 23.770 474 HB3 GLU 65 1HB GLU 65 -1.862 16.298 23.199 475 HG2 GLU 65 2HG GLU 65 -2.754 14.932 25.088 476 HG3 GLU 65 1HG GLU 65 -1.084 14.423 25.530 477 H GLU 66 H GLU 66 -2.151 14.170 20.424 478 HA GLU 66 HA GLU 66 -4.766 13.518 21.184 479 HB2 GLU 66 2HB GLU 66 -5.306 13.474 18.909 480 HB3 GLU 66 1HB GLU 66 -3.995 14.642 19.020 481 HG2 GLU 66 2HG GLU 66 -3.436 13.505 17.113 482 HG3 GLU 66 1HG GLU 66 -2.429 12.555 18.276 483 H GLY 67 H GLY 67 -1.837 11.786 20.624 484 HA2 GLY 67 2HA GLY 67 -1.247 9.792 21.549 485 HA3 GLY 67 1HA GLY 67 -3.010 9.309 21.649 486 H ARG 68 H ARG 68 -0.273 10.010 19.367 487 HA ARG 68 HA ARG 68 -1.736 9.939 17.083 488 HB2 ARG 68 2HB ARG 68 0.619 10.808 17.345 489 HB3 ARG 68 1HB ARG 68 1.208 9.119 17.211 490 HG2 ARG 68 2HG ARG 68 0.276 8.941 14.930 491 HG3 ARG 68 1HG ARG 68 -0.551 10.517 15.089 492 HD2 ARG 68 2HD ARG 68 2.537 10.119 15.051 493 HD3 ARG 68 1HD ARG 68 1.510 10.526 13.618 494 HE ARG 68 HE ARG 68 1.324 12.316 16.034 495 HH11 ARG 68 1HH2 ARG 68 2.374 12.113 12.417 496 HH12 ARG 68 2HH2 ARG 68 2.063 13.747 12.282 497 HH21 ARG 68 1HH1 ARG 68 1.097 14.888 14.630 498 HH22 ARG 68 2HH1 ARG 68 2.490 15.042 14.187 499 H LYS 69 H LYS 69 -1.245 7.336 19.062 500 HA LYS 69 HA LYS 69 -1.307 5.190 17.234 501 HB2 LYS 69 2HB LYS 69 -2.682 5.295 19.973 502 HB3 LYS 69 1HB LYS 69 -2.205 3.843 19.023 503 HG2 LYS 69 2HG LYS 69 0.248 4.703 19.246 504 HG3 LYS 69 1HG LYS 69 -0.368 5.812 20.519 505 HD2 LYS 69 2HD LYS 69 -0.500 2.737 20.432 506 HD3 LYS 69 1HD LYS 69 0.548 3.731 21.504 507 HE2 LYS 69 2HE LYS 69 -1.520 4.599 22.695 508 HE3 LYS 69 1HE LYS 69 -2.560 3.595 21.610 509 HZ1 LYS 69 3HZ LYS 69 -0.604 2.633 23.638 510 HZ2 LYS 69 1HZ LYS 69 -1.326 1.623 22.467 511 HZ3 LYS 69 2HZ LYS 69 -2.284 2.486 23.615 512 H VAL 70 H VAL 70 -3.731 7.715 17.965 513 HA VAL 70 HA VAL 70 -5.988 6.131 17.371 514 HB VAL 70 HB VAL 70 -5.566 9.128 17.044 515 HG11 VAL 70 1HG1 VAL 70 -7.389 8.428 15.499 516 HG12 VAL 70 2HG1 VAL 70 -8.084 9.237 16.936 517 HG13 VAL 70 3HG1 VAL 70 -8.157 7.435 16.798 518 HG21 VAL 70 3HG2 VAL 70 -5.455 8.255 19.408 519 HG22 VAL 70 1HG2 VAL 70 -7.046 7.432 19.185 520 HG23 VAL 70 2HG2 VAL 70 -6.917 9.244 19.112 521 H ALA 71 H ALA 71 -3.894 8.244 15.339 522 HA ALA 71 HA ALA 71 -5.075 7.634 12.910 523 HB1 ALA 71 1HB ALA 71 -2.076 8.151 13.443 524 HB2 ALA 71 2HB ALA 71 -3.326 9.422 13.214 525 HB3 ALA 71 3HB ALA 71 -2.915 8.315 11.852 526 H GLU 72 H GLU 72 -2.388 5.965 14.582 527 HA GLU 72 HA GLU 72 -1.698 4.124 12.670 528 HB2 GLU 72 2HB GLU 72 -0.512 4.439 14.953 529 HB3 GLU 72 1HB GLU 72 -1.838 3.471 15.666 530 HG2 GLU 72 2HG GLU 72 -1.028 1.780 13.595 531 HG3 GLU 72 1HG GLU 72 0.511 2.628 13.916 532 H GLN 73 H GLN 73 -4.234 3.893 15.177 533 HA GLN 73 HA GLN 73 -4.870 1.220 14.686 534 HB2 GLN 73 2HB GLN 73 -5.258 2.491 16.776 535 HB3 GLN 73 1HB GLN 73 -6.536 3.458 15.990 536 HG2 GLN 73 2HG GLN 73 -6.847 0.401 15.966 537 HG3 GLN 73 1HG GLN 73 -6.904 1.216 17.565 538 HE21 GLN 73 1HE2 GLN 73 -8.468 1.169 14.322 539 HE22 GLN 73 2HE2 GLN 73 -9.972 1.862 14.859 540 H VAL 74 H VAL 74 -6.062 4.244 13.193 541 HA VAL 74 HA VAL 74 -8.337 3.008 11.993 542 HB VAL 74 HB VAL 74 -6.868 5.586 11.234 543 HG11 VAL 74 1HG1 VAL 74 -9.669 4.501 10.432 544 HG12 VAL 74 2HG1 VAL 74 -8.282 4.792 9.319 545 HG13 VAL 74 3HG1 VAL 74 -9.087 6.175 10.128 546 HG21 VAL 74 3HG2 VAL 74 -8.698 6.668 12.544 547 HG22 VAL 74 1HG2 VAL 74 -7.773 5.555 13.596 548 HG23 VAL 74 2HG2 VAL 74 -9.368 5.042 12.971 549 H MET 75 H MET 75 -5.038 3.901 10.830 550 HA MET 75 HA MET 75 -5.526 2.946 8.219 551 HB2 MET 75 2HB MET 75 -3.029 3.000 7.901 552 HB3 MET 75 1HB MET 75 -3.796 4.530 8.421 553 HG2 MET 75 2HG MET 75 -3.076 3.891 10.826 554 HG3 MET 75 1HG MET 75 -2.129 2.567 10.111 555 HE1 MET 75 3HE MET 75 -2.785 6.451 10.306 556 HE2 MET 75 1HE MET 75 -2.571 6.347 8.526 557 HE3 MET 75 2HE MET 75 -1.338 7.174 9.525 558 H LYS 76 H LYS 76 -4.206 1.359 11.155 559 HA LYS 76 HA LYS 76 -3.413 -0.975 9.851 560 HB2 LYS 76 2HB LYS 76 -2.832 -0.206 12.252 561 HB3 LYS 76 1HB LYS 76 -4.429 -0.846 12.749 562 HG2 LYS 76 2HG LYS 76 -3.683 -3.140 11.875 563 HG3 LYS 76 1HG LYS 76 -2.097 -2.403 11.450 564 HD2 LYS 76 2HD LYS 76 -1.815 -1.770 13.926 565 HD3 LYS 76 1HD LYS 76 -3.351 -2.624 14.266 566 HE2 LYS 76 2HE LYS 76 -1.483 -4.096 14.869 567 HE3 LYS 76 1HE LYS 76 -2.313 -4.800 13.428 568 HZ1 LYS 76 3HZ LYS 76 0.123 -4.853 13.321 569 HZ2 LYS 76 1HZ LYS 76 0.174 -3.138 13.343 570 HZ3 LYS 76 2HZ LYS 76 -0.551 -3.978 12.050 571 H ALA 77 H ALA 77 -6.578 0.022 11.200 572 HA ALA 77 HA ALA 77 -7.816 -2.496 10.984 573 HB1 ALA 77 1HB ALA 77 -9.978 -1.235 11.096 574 HB2 ALA 77 2HB ALA 77 -9.092 0.310 10.805 575 HB3 ALA 77 3HB ALA 77 -8.816 -0.619 12.326 576 H GLY 78 H GLY 78 -7.340 0.186 8.691 577 HA2 GLY 78 2HA GLY 78 -9.006 -0.740 6.624 578 HA3 GLY 78 1HA GLY 78 -7.562 0.337 6.491 579 H ILE 79 H ILE 79 -5.539 -1.296 7.361 580 HA ILE 79 HA ILE 79 -5.026 -2.882 5.125 581 HB ILE 79 HB ILE 79 -3.698 -2.867 7.873 582 HG12 ILE 79 2HG1 ILE 79 -2.867 -1.553 5.198 583 HG13 ILE 79 1HG1 ILE 79 -3.681 -0.682 6.523 584 HG21 ILE 79 1HG2 ILE 79 -3.187 -5.026 6.686 585 HG22 ILE 79 2HG2 ILE 79 -1.743 -3.974 6.710 586 HG23 ILE 79 3HG2 ILE 79 -2.723 -4.110 5.206 587 HD11 ILE 79 3HD ILE 79 -0.883 -1.982 6.672 588 HD12 ILE 79 1HD ILE 79 -1.278 -0.232 6.631 589 HD13 ILE 79 2HD ILE 79 -1.742 -1.219 8.066 590 H GLU 80 H GLU 80 -6.207 -3.790 8.434 591 HA GLU 80 HA GLU 80 -6.054 -6.533 8.003 592 HB2 GLU 80 2HB GLU 80 -8.115 -5.094 9.787 593 HB3 GLU 80 1HB GLU 80 -7.785 -6.857 9.777 594 HG2 GLU 80 2HG GLU 80 -5.337 -6.286 10.417 595 HG3 GLU 80 1HG GLU 80 -5.918 -4.615 10.738 596 H VAL 81 H VAL 81 -8.836 -4.310 7.366 597 HA VAL 81 HA VAL 81 -10.515 -6.488 6.703 598 HB VAL 81 HB VAL 81 -12.135 -4.819 5.900 599 HG11 VAL 81 1HG1 VAL 81 -12.458 -3.761 8.138 600 HG12 VAL 81 2HG1 VAL 81 -10.770 -4.157 8.610 601 HG13 VAL 81 3HG1 VAL 81 -11.960 -5.479 8.318 602 HG21 VAL 81 3HG2 VAL 81 -10.588 -3.121 4.895 603 HG22 VAL 81 1HG2 VAL 81 -9.877 -2.795 6.514 604 HG23 VAL 81 2HG2 VAL 81 -11.578 -2.383 6.182 605 H PHE 82 H PHE 82 -8.474 -4.295 4.696 606 HA PHE 82 HA PHE 82 -9.548 -5.360 2.275 607 HB2 PHE 82 2HB PHE 82 -6.927 -3.811 2.779 608 HB3 PHE 82 1HB PHE 82 -7.564 -4.241 1.145 609 HD1 PHE 82 2HD PHE 82 -10.486 -3.658 1.354 610 HD2 PHE 82 1HD PHE 82 -7.089 -1.487 2.876 611 HE1 PHE 82 2HE PHE 82 -11.788 -1.578 1.306 612 HE2 PHE 82 1HE PHE 82 -8.396 0.596 2.810 613 HZ PHE 82 HZ PHE 82 -10.754 0.566 2.029 614 H ALA 83 H ALA 83 -6.680 -6.111 4.324 615 HA ALA 83 HA ALA 83 -5.550 -7.923 2.522 616 HB1 ALA 83 1HB ALA 83 -4.318 -8.868 4.488 617 HB2 ALA 83 2HB ALA 83 -5.406 -7.945 5.602 618 HB3 ALA 83 3HB ALA 83 -4.283 -7.072 4.496 619 H LEU 84 H LEU 84 -8.142 -8.280 4.918 620 HA LEU 84 HA LEU 84 -8.305 -11.045 5.061 621 HB2 LEU 84 2HB LEU 84 -9.482 -9.406 6.528 622 HB3 LEU 84 1HB LEU 84 -10.588 -8.974 5.193 623 HG LEU 84 HG LEU 84 -10.411 -11.872 6.180 624 HD11 LEU 84 1HD1 LEU 84 -12.007 -9.605 7.541 625 HD12 LEU 84 2HD1 LEU 84 -10.626 -10.527 8.245 626 HD13 LEU 84 3HD1 LEU 84 -12.181 -11.367 7.883 627 HD21 LEU 84 3HD2 LEU 84 -11.877 -11.544 4.205 628 HD22 LEU 84 1HD2 LEU 84 -12.747 -10.197 5.024 629 HD23 LEU 84 2HD2 LEU 84 -12.880 -11.885 5.642 630 H VAL 85 H VAL 85 -9.536 -8.794 2.583 631 HA VAL 85 HA VAL 85 -11.347 -10.502 1.357 632 HB VAL 85 HB VAL 85 -9.737 -8.231 0.075 633 HG11 VAL 85 1HG1 VAL 85 -12.427 -9.550 -0.717 634 HG12 VAL 85 2HG1 VAL 85 -10.912 -9.480 -1.693 635 HG13 VAL 85 3HG1 VAL 85 -11.828 -7.978 -1.363 636 HG21 VAL 85 3HG2 VAL 85 -10.797 -7.385 2.094 637 HG22 VAL 85 1HG2 VAL 85 -12.347 -8.228 1.744 638 HG23 VAL 85 2HG2 VAL 85 -11.796 -6.852 0.719 639 H THR 86 H THR 86 -7.913 -10.758 1.445 640 HA THR 86 HA THR 86 -7.408 -11.917 -1.017 641 HB THR 86 HB THR 86 -6.023 -12.653 1.590 642 HG1 THR 86 1HG THR 86 -5.863 -10.555 1.568 643 HG21 THR 86 3HG2 THR 86 -4.028 -12.882 0.046 644 HG22 THR 86 1HG2 THR 86 -5.072 -12.509 -1.370 645 HG23 THR 86 2HG2 THR 86 -5.332 -14.025 -0.425 646 H ALA 87 H ALA 87 -9.225 -13.183 1.709 647 HA ALA 87 HA ALA 87 -9.115 -15.914 1.119 648 HB1 ALA 87 1HB ALA 87 -11.274 -16.056 2.370 649 HB2 ALA 87 2HB ALA 87 -11.485 -14.267 2.224 650 HB3 ALA 87 3HB ALA 87 -10.149 -14.938 3.208 651 H ALA 88 H ALA 88 -10.730 -13.239 -0.501 652 HA ALA 88 HA ALA 88 -12.447 -15.005 -2.054 653 HB1 ALA 88 1HB ALA 88 -11.913 -11.969 -2.319 654 HB2 ALA 88 2HB ALA 88 -13.326 -12.693 -1.478 655 HB3 ALA 88 3HB ALA 88 -13.122 -12.900 -3.261 656 H LEU 89 H LEU 89 -9.585 -12.886 -2.394 657 HA LEU 89 HA LEU 89 -9.324 -13.132 -5.112 658 HB2 LEU 89 2HB LEU 89 -7.036 -12.749 -3.095 659 HB3 LEU 89 1HB LEU 89 -6.972 -12.361 -4.841 660 HG LEU 89 HG LEU 89 -8.827 -11.000 -2.795 661 HD11 LEU 89 1HD1 LEU 89 -6.389 -10.499 -2.409 662 HD12 LEU 89 2HD1 LEU 89 -7.320 -9.062 -2.940 663 HD13 LEU 89 3HD1 LEU 89 -6.252 -9.922 -4.107 664 HD21 LEU 89 3HD2 LEU 89 -9.829 -10.933 -5.078 665 HD22 LEU 89 1HD2 LEU 89 -8.279 -10.309 -5.756 666 HD23 LEU 89 2HD2 LEU 89 -9.226 -9.309 -4.598 667 H ALA 90 H ALA 90 -7.858 -15.214 -2.590 668 HA ALA 90 HA ALA 90 -6.199 -16.605 -4.400 669 HB1 ALA 90 1HB ALA 90 -7.334 -17.474 -1.684 670 HB2 ALA 90 2HB ALA 90 -5.780 -16.607 -1.946 671 HB3 ALA 90 3HB ALA 90 -5.978 -18.293 -2.554 672 H THR 91 H THR 91 -9.660 -16.767 -3.939 673 HA THR 91 HA THR 91 -9.762 -19.496 -4.943 674 HB THR 91 HB THR 91 -12.144 -19.412 -4.830 675 HG1 THR 91 1HG THR 91 -11.738 -16.654 -4.318 676 HG21 THR 91 3HG2 THR 91 -12.361 -19.232 -2.366 677 HG22 THR 91 1HG2 THR 91 -10.840 -18.269 -2.271 678 HG23 THR 91 2HG2 THR 91 -10.789 -19.990 -2.806 679 H ASP 92 H ASP 92 -9.426 -16.315 -6.271 680 HA ASP 92 HA ASP 92 -11.360 -16.729 -8.301 681 HB2 ASP 92 2HB ASP 92 -9.360 -14.492 -7.788 682 HB3 ASP 92 1HB ASP 92 -10.237 -14.602 -9.360 683 H PHE 93 H PHE 93 -8.128 -17.789 -8.022 684 HA PHE 93 HA PHE 93 -7.969 -18.204 -10.868 685 HB2 PHE 93 2HB PHE 93 -5.828 -19.061 -10.678 686 HB3 PHE 93 1HB PHE 93 -5.879 -17.883 -9.340 687 HD1 PHE 93 1HD PHE 93 -6.160 -18.770 -6.975 688 HD2 PHE 93 2HD PHE 93 -5.451 -21.364 -10.324 689 HE1 PHE 93 1HE PHE 93 -5.400 -20.542 -5.437 690 HE2 PHE 93 2HE PHE 93 -4.737 -23.157 -8.784 691 HZ PHE 93 HZ PHE 93 -4.697 -22.747 -6.329 692 H VAL 94 H VAL 94 -9.159 -19.887 -8.023 693 HA VAL 94 HA VAL 94 -8.890 -22.505 -8.995 694 HB VAL 94 HB VAL 94 -10.762 -21.586 -6.756 695 HG11 VAL 94 1HG1 VAL 94 -9.185 -24.222 -7.229 696 HG12 VAL 94 2HG1 VAL 94 -10.951 -24.028 -7.495 697 HG13 VAL 94 3HG1 VAL 94 -10.273 -23.867 -5.841 698 HG21 VAL 94 3HG2 VAL 94 -8.461 -20.603 -6.367 699 HG22 VAL 94 1HG2 VAL 94 -7.736 -22.222 -6.649 700 HG23 VAL 94 2HG2 VAL 94 -8.792 -21.939 -5.225 701 H ARG 95 H ARG 95 -11.241 -19.990 -9.358 702 HA ARG 95 HA ARG 95 -13.519 -21.301 -10.182 703 HB2 ARG 95 2HB ARG 95 -12.231 -18.849 -11.557 704 HB3 ARG 95 1HB ARG 95 -13.952 -19.348 -11.689 705 HG2 ARG 95 2HG ARG 95 -14.289 -18.788 -9.266 706 HG3 ARG 95 1HG ARG 95 -12.561 -18.277 -9.164 707 HD2 ARG 95 2HD ARG 95 -13.018 -16.584 -11.051 708 HD3 ARG 95 1HD ARG 95 -14.765 -17.061 -10.975 709 HE ARG 95 HE ARG 95 -13.375 -15.974 -8.485 710 HH11 ARG 95 1HH2 ARG 95 -15.493 -15.176 -11.342 711 HH12 ARG 95 2HH2 ARG 95 -15.832 -13.628 -10.754 712 HH21 ARG 95 1HH1 ARG 95 -13.756 -13.944 -7.841 713 HH22 ARG 95 2HH1 ARG 95 -14.888 -12.892 -8.619 714 H ARG 96 H ARG 96 -10.341 -21.222 -11.840 715 HA ARG 96 HA ARG 96 -11.418 -21.479 -14.420 716 HB2 ARG 96 2HB ARG 96 -9.375 -22.065 -15.365 717 HB3 ARG 96 1HB ARG 96 -9.058 -20.766 -14.189 718 HG2 ARG 96 2HG ARG 96 -7.727 -22.177 -12.831 719 HG3 ARG 96 1HG ARG 96 -8.568 -23.676 -13.333 720 HD2 ARG 96 2HD ARG 96 -7.484 -23.709 -15.535 721 HD3 ARG 96 1HD ARG 96 -6.791 -22.070 -15.274 722 HE ARG 96 HE ARG 96 -4.967 -23.089 -14.320 723 HH11 ARG 96 1HH2 ARG 96 -7.275 -25.722 -14.661 724 HH12 ARG 96 2HH2 ARG 96 -6.502 -26.770 -13.607 725 HH21 ARG 96 1HH1 ARG 96 -3.764 -24.567 -13.030 726 HH22 ARG 96 2HH1 ARG 96 -4.352 -26.125 -12.657 727 H GLU 97 H GLU 97 -11.321 -23.785 -11.868 728 HA GLU 97 HA GLU 97 -11.154 -26.135 -13.441 729 HB2 GLU 97 2HB GLU 97 -10.941 -25.920 -10.824 730 HB3 GLU 97 1HB GLU 97 -12.722 -25.799 -10.817 731 HG2 GLU 97 2HG GLU 97 -12.534 -28.117 -12.242 732 HG3 GLU 97 1HG GLU 97 -10.894 -28.174 -11.508 733 H GLU 98 H GLU 98 -13.683 -23.793 -12.659 734 HA GLU 98 HA GLU 98 -15.876 -25.433 -13.371 735 HB2 GLU 98 2HB GLU 98 -15.772 -22.355 -13.233 736 HB3 GLU 98 1HB GLU 98 -17.211 -23.399 -13.198 737 HG2 GLU 98 2HG GLU 98 -15.677 -24.406 -11.034 738 HG3 GLU 98 1HG GLU 98 -15.267 -22.655 -11.021 739 H GLU 99 H GLU 99 -13.975 -22.824 -14.940 740 HA GLU 99 HA GLU 99 -15.361 -22.779 -17.353 741 HB2 GLU 99 2HB GLU 99 -13.817 -20.980 -16.462 742 HB3 GLU 99 1HB GLU 99 -12.425 -22.069 -16.788 743 HG2 GLU 99 2HG GLU 99 -12.445 -20.467 -18.536 744 HG3 GLU 99 1HG GLU 99 -13.075 -21.967 -19.289 745 H ARG 100 H ARG 100 -12.579 -24.727 -16.274 746 HA ARG 100 HA ARG 100 -11.756 -25.821 -18.651 747 HB2 ARG 100 2HB ARG 100 -10.612 -26.053 -16.411 748 HB3 ARG 100 1HB ARG 100 -11.940 -27.127 -15.856 749 HG2 ARG 100 2HG ARG 100 -11.274 -28.793 -17.638 750 HG3 ARG 100 1HG ARG 100 -9.901 -27.717 -18.085 751 HD2 ARG 100 2HD ARG 100 -8.897 -28.033 -15.795 752 HD3 ARG 100 1HD ARG 100 -10.361 -28.976 -15.282 753 HE ARG 100 HE ARG 100 -8.744 -29.838 -17.687 754 HH11 ARG 100 1HH2 ARG 100 -9.132 -30.422 -14.152 755 HH12 ARG 100 2HH2 ARG 100 -9.156 -32.133 -14.275 756 HH21 ARG 100 1HH1 ARG 100 -8.699 -32.254 -17.841 757 HH22 ARG 100 2HH1 ARG 100 -8.668 -33.186 -16.430 758 H ARG 101 H ARG 101 -14.387 -26.868 -16.499 759 HA ARG 101 HA ARG 101 -15.017 -29.148 -18.237 760 HB2 ARG 101 2HB ARG 101 -16.148 -28.277 -15.495 761 HB3 ARG 101 1HB ARG 101 -16.530 -29.806 -16.364 762 HG2 ARG 101 2HG ARG 101 -14.106 -30.445 -16.249 763 HG3 ARG 101 1HG ARG 101 -13.750 -29.007 -15.242 764 HD2 ARG 101 2HD ARG 101 -15.836 -31.161 -14.503 765 HD3 ARG 101 1HD ARG 101 -14.102 -31.279 -13.999 766 HE ARG 101 HE ARG 101 -14.679 -28.836 -13.006 767 HH11 ARG 101 1HH2 ARG 101 -16.679 -31.900 -12.768 768 HH12 ARG 101 2HH2 ARG 101 -16.862 -31.755 -11.074 769 HH21 ARG 101 1HH1 ARG 101 -14.900 -28.830 -10.551 770 HH22 ARG 101 2HH1 ARG 101 -15.970 -29.927 -9.879 771 H GLY 102 H GLY 102 -16.023 -25.887 -17.516 772 HA2 GLY 102 2HA GLY 102 -17.694 -24.645 -18.234 773 HA3 GLY 102 1HA GLY 102 -18.319 -26.036 -19.208 774 H HIS 103 H HIS 103 -17.594 -26.128 -15.742 775 HA HIS 103 HA HIS 103 -20.337 -27.075 -15.231 776 HB2 HIS 103 2HB HIS 103 -18.728 -28.359 -13.917 777 HB3 HIS 103 1HB HIS 103 -17.815 -26.872 -13.502 778 HD1 HIS 103 1HD HIS 103 -21.386 -28.254 -12.669 779 HD2 HIS 103 2HD HIS 103 -18.426 -25.619 -11.179 780 HE1 HIS 103 1HE HIS 103 -22.142 -27.447 -10.420 781 HE2 HIS 103 2HE HIS 103 -20.397 -25.690 -9.664 782 H1 SER 1 H SER 1 -2.093 -19.513 -23.426 783 HA SER 1 HA SER 1 -1.057 -17.415 -21.983 784 HB2 SER 1 2HB SER 1 -3.068 -16.750 -24.242 785 HB3 SER 1 1HB SER 1 -2.741 -15.671 -22.826 786 HG SER 1 1HG SER 1 -0.725 -15.350 -23.472 787 H ALA 2 H ALA 2 -2.822 -16.762 -20.449 788 HA ALA 2 HA ALA 2 -4.970 -18.799 -20.361 789 HB1 ALA 2 1HB ALA 2 -3.187 -17.818 -18.036 790 HB2 ALA 2 2HB ALA 2 -3.096 -19.439 -18.802 791 HB3 ALA 2 3HB ALA 2 -4.570 -18.981 -17.879 792 H ASP 3 H ASP 3 -6.757 -18.219 -18.936 793 HA ASP 3 HA ASP 3 -7.632 -15.690 -19.614 794 HB2 ASP 3 2HB ASP 3 -8.855 -17.683 -17.613 795 HB3 ASP 3 1HB ASP 3 -9.674 -16.198 -18.228 796 H HIS 4 H HIS 4 -5.929 -16.738 -16.761 797 HA HIS 4 HA HIS 4 -6.881 -14.496 -15.198 798 HB2 HIS 4 2HB HIS 4 -4.442 -16.267 -14.646 799 HB3 HIS 4 1HB HIS 4 -5.237 -15.125 -13.500 800 HD1 HIS 4 1HD HIS 4 -5.121 -18.198 -12.794 801 HD2 HIS 4 2HD HIS 4 -8.387 -16.267 -14.648 802 HE1 HIS 4 1HE HIS 4 -7.174 -19.681 -12.501 803 HE2 HIS 4 2HE HIS 4 -9.136 -18.391 -13.601 804 H GLU 5 H GLU 5 -4.404 -14.954 -17.653 805 HA GLU 5 HA GLU 5 -2.873 -12.660 -16.783 806 HB2 GLU 5 2HB GLU 5 -2.813 -14.243 -19.421 807 HB3 GLU 5 1HB GLU 5 -1.592 -13.049 -18.866 808 HG2 GLU 5 2HG GLU 5 -0.889 -14.528 -17.012 809 HG3 GLU 5 1HG GLU 5 -2.206 -15.708 -17.380 810 H ARG 6 H ARG 6 -5.136 -13.679 -19.405 811 HA ARG 6 HA ARG 6 -5.266 -11.158 -20.599 812 HB2 ARG 6 2HB ARG 6 -7.365 -13.403 -20.626 813 HB3 ARG 6 1HB ARG 6 -7.340 -11.976 -21.725 814 HG2 ARG 6 2HG ARG 6 -5.027 -12.624 -22.489 815 HG3 ARG 6 1HG ARG 6 -5.132 -14.141 -21.550 816 HD2 ARG 6 2HD ARG 6 -7.025 -13.327 -23.882 817 HD3 ARG 6 1HD ARG 6 -5.591 -14.436 -23.968 818 HE ARG 6 HE ARG 6 -7.755 -15.118 -21.989 819 HH11 ARG 6 1HH2 ARG 6 -6.486 -15.635 -25.320 820 HH12 ARG 6 2HH2 ARG 6 -7.137 -17.200 -25.485 821 HH21 ARG 6 1HH1 ARG 6 -8.688 -17.244 -22.188 822 HH22 ARG 6 2HH1 ARG 6 -8.344 -18.232 -23.538 823 H GLU 7 H GLU 7 -7.336 -12.572 -17.975 824 HA GLU 7 HA GLU 7 -9.046 -10.318 -17.993 825 HB2 GLU 7 2HB GLU 7 -9.682 -12.617 -17.258 826 HB3 GLU 7 1HB GLU 7 -8.714 -12.399 -15.765 827 HG2 GLU 7 2HG GLU 7 -10.215 -10.638 -14.965 828 HG3 GLU 7 1HG GLU 7 -11.010 -10.491 -16.575 829 H ALA 8 H ALA 8 -5.933 -11.031 -16.446 830 HA ALA 8 HA ALA 8 -6.093 -8.972 -14.508 831 HB1 ALA 8 1HB ALA 8 -3.613 -10.233 -15.859 832 HB2 ALA 8 2HB ALA 8 -4.329 -10.720 -14.279 833 HB3 ALA 8 3HB ALA 8 -3.561 -9.107 -14.462 834 H GLN 9 H GLN 9 -4.720 -9.175 -17.831 835 HA GLN 9 HA GLN 9 -3.866 -6.521 -17.984 836 HB2 GLN 9 2HB GLN 9 -4.858 -8.410 -20.205 837 HB3 GLN 9 1HB GLN 9 -4.048 -6.835 -20.517 838 HG2 GLN 9 2HG GLN 9 -1.957 -7.590 -19.496 839 HG3 GLN 9 1HG GLN 9 -2.710 -9.117 -18.925 840 HE21 GLN 9 1HE2 GLN 9 -0.870 -10.080 -20.184 841 HE22 GLN 9 2HE2 GLN 9 -1.108 -10.407 -21.875 842 H LYS 10 H LYS 10 -7.046 -8.003 -18.690 843 HA LYS 10 HA LYS 10 -8.199 -5.759 -19.875 844 HB2 LYS 10 2HB LYS 10 -9.185 -8.165 -19.802 845 HB3 LYS 10 1HB LYS 10 -9.723 -7.787 -18.133 846 HG2 LYS 10 2HG LYS 10 -10.894 -5.679 -19.251 847 HG3 LYS 10 1HG LYS 10 -10.617 -6.529 -20.801 848 HD2 LYS 10 2HD LYS 10 -12.026 -8.457 -19.935 849 HD3 LYS 10 1HD LYS 10 -12.181 -7.595 -18.358 850 HE2 LYS 10 2HE LYS 10 -13.237 -5.619 -19.625 851 HE3 LYS 10 1HE LYS 10 -13.301 -6.662 -21.099 852 HZ1 LYS 10 3HZ LYS 10 -14.636 -7.248 -18.479 853 HZ2 LYS 10 1HZ LYS 10 -14.855 -8.135 -19.930 854 HZ3 LYS 10 2HZ LYS 10 -15.346 -6.536 -19.837 855 H ALA 11 H ALA 11 -7.829 -6.698 -16.448 856 HA ALA 11 HA ALA 11 -9.643 -4.868 -15.373 857 HB1 ALA 11 1HB ALA 11 -8.480 -5.230 -13.204 858 HB2 ALA 11 2HB ALA 11 -7.075 -5.960 -14.062 859 HB3 ALA 11 3HB ALA 11 -8.668 -6.799 -14.070 860 H GLU 12 H GLU 12 -6.303 -4.465 -16.507 861 HA GLU 12 HA GLU 12 -5.817 -2.022 -15.199 862 HB2 GLU 12 2HB GLU 12 -4.659 -2.971 -17.884 863 HB3 GLU 12 1HB GLU 12 -3.983 -1.697 -16.809 864 HG2 GLU 12 2HG GLU 12 -3.590 -3.462 -15.021 865 HG3 GLU 12 1HG GLU 12 -4.216 -4.716 -16.153 866 H GLU 13 H GLU 13 -7.622 -2.841 -18.175 867 HA GLU 13 HA GLU 13 -7.581 -0.140 -19.150 868 HB2 GLU 13 2HB GLU 13 -9.412 -2.463 -19.969 869 HB3 GLU 13 1HB GLU 13 -9.342 -0.835 -20.736 870 HG2 GLU 13 2HG GLU 13 -6.821 -1.278 -21.174 871 HG3 GLU 13 1HG GLU 13 -7.133 -2.994 -20.720 872 H GLU 14 H GLU 14 -9.538 -2.029 -16.937 873 HA GLU 14 HA GLU 14 -11.822 -0.393 -16.900 874 HB2 GLU 14 2HB GLU 14 -11.603 -2.752 -15.872 875 HB3 GLU 14 1HB GLU 14 -10.616 -2.015 -14.574 876 HG2 GLU 14 2HG GLU 14 -12.711 -2.227 -13.589 877 HG3 GLU 14 1HG GLU 14 -12.695 -0.492 -14.053 878 H LEU 15 H LEU 15 -8.747 -0.376 -15.058 879 HA LEU 15 HA LEU 15 -9.471 1.614 -13.271 880 HB2 LEU 15 2HB LEU 15 -7.485 0.104 -13.017 881 HB3 LEU 15 1HB LEU 15 -6.650 0.974 -14.339 882 HG LEU 15 HG LEU 15 -6.479 3.004 -12.985 883 HD11 LEU 15 1HD1 LEU 15 -8.619 3.111 -11.803 884 HD12 LEU 15 2HD1 LEU 15 -7.319 3.064 -10.573 885 HD13 LEU 15 3HD1 LEU 15 -8.273 1.577 -10.919 886 HD21 LEU 15 3HD2 LEU 15 -4.768 1.226 -12.599 887 HD22 LEU 15 1HD2 LEU 15 -5.771 0.518 -11.282 888 HD23 LEU 15 2HD2 LEU 15 -5.068 2.161 -11.092 889 H GLN 16 H GLN 16 -8.020 1.828 -16.506 890 HA GLN 16 HA GLN 16 -7.487 4.592 -16.397 891 HB2 GLN 16 2HB GLN 16 -7.859 2.694 -18.768 892 HB3 GLN 16 1HB GLN 16 -7.251 4.380 -18.919 893 HG2 GLN 16 2HG GLN 16 -5.269 3.902 -17.572 894 HG3 GLN 16 1HG GLN 16 -5.873 2.279 -17.102 895 HE21 GLN 16 1HE2 GLN 16 -5.437 0.543 -18.446 896 HE22 GLN 16 2HE2 GLN 16 -4.673 0.666 -20.005 897 H LYS 17 H LYS 17 -10.420 2.782 -17.102 898 HA LYS 17 HA LYS 17 -11.829 4.908 -18.358 899 HB2 LYS 17 2HB LYS 17 -12.467 2.429 -18.433 900 HB3 LYS 17 1HB LYS 17 -12.896 2.535 -16.702 901 HG2 LYS 17 2HG LYS 17 -14.671 4.318 -17.359 902 HG3 LYS 17 1HG LYS 17 -14.251 3.946 -19.069 903 HD2 LYS 17 2HD LYS 17 -16.127 2.557 -18.667 904 HD3 LYS 17 1HD LYS 17 -14.716 1.461 -18.471 905 HE2 LYS 17 2HE LYS 17 -14.942 1.969 -15.872 906 HE3 LYS 17 1HE LYS 17 -16.554 2.673 -16.294 907 HZ1 LYS 17 3HZ LYS 17 -16.762 0.318 -17.501 908 HZ2 LYS 17 1HZ LYS 17 -17.061 0.509 -15.815 909 HZ3 LYS 17 2HZ LYS 17 -15.564 -0.087 -16.379 910 H VAL 18 H VAL 18 -11.483 3.709 -14.987 911 HA VAL 18 HA VAL 18 -13.369 5.488 -13.883 912 HB VAL 18 HB VAL 18 -11.053 4.013 -12.528 913 HG11 VAL 18 1HG1 VAL 18 -12.477 4.324 -10.436 914 HG12 VAL 18 2HG1 VAL 18 -13.565 5.418 -11.366 915 HG13 VAL 18 3HG1 VAL 18 -11.846 5.876 -11.071 916 HG21 VAL 18 3HG2 VAL 18 -12.862 2.365 -11.921 917 HG22 VAL 18 1HG2 VAL 18 -12.680 2.476 -13.698 918 HG23 VAL 18 2HG2 VAL 18 -14.055 3.306 -12.889 919 H LEU 19 H LEU 19 -9.844 5.690 -14.462 920 HA LEU 19 HA LEU 19 -9.290 8.066 -13.164 921 HB2 LEU 19 2HB LEU 19 -8.304 7.197 -15.966 922 HB3 LEU 19 1HB LEU 19 -7.657 8.608 -15.078 923 HG LEU 19 HG LEU 19 -7.435 5.694 -14.134 924 HD11 LEU 19 1HD1 LEU 19 -6.071 6.198 -16.200 925 HD12 LEU 19 2HD1 LEU 19 -5.037 5.918 -14.753 926 HD13 LEU 19 3HD1 LEU 19 -5.320 7.593 -15.353 927 HD21 LEU 19 3HD2 LEU 19 -7.430 7.204 -12.185 928 HD22 LEU 19 1HD2 LEU 19 -6.299 8.336 -13.016 929 HD23 LEU 19 2HD2 LEU 19 -5.738 6.703 -12.529 930 H GLU 20 H GLU 20 -10.524 7.636 -16.556 931 HA GLU 20 HA GLU 20 -10.656 10.408 -16.976 932 HB2 GLU 20 2HB GLU 20 -12.090 8.152 -18.485 933 HB3 GLU 20 1HB GLU 20 -12.065 9.881 -18.964 934 HG2 GLU 20 2HG GLU 20 -9.479 9.745 -18.924 935 HG3 GLU 20 1HG GLU 20 -9.664 7.953 -18.849 936 H GLU 21 H GLU 21 -13.034 8.101 -15.660 937 HA GLU 21 HA GLU 21 -15.231 9.853 -15.814 938 HB2 GLU 21 2HB GLU 21 -15.279 7.294 -15.291 939 HB3 GLU 21 1HB GLU 21 -14.842 7.739 -13.612 940 HG2 GLU 21 2HG GLU 21 -16.971 9.351 -13.764 941 HG3 GLU 21 1HG GLU 21 -17.389 8.394 -15.226 942 H ALA 22 H ALA 22 -12.931 9.090 -13.146 943 HA ALA 22 HA ALA 22 -14.041 10.904 -11.310 944 HB1 ALA 22 1HB ALA 22 -12.571 8.986 -10.636 945 HB2 ALA 22 2HB ALA 22 -11.937 10.554 -10.014 946 HB3 ALA 22 3HB ALA 22 -11.175 9.775 -11.452 947 H SER 23 H SER 23 -11.386 11.198 -13.693 948 HA SER 23 HA SER 23 -10.477 13.720 -12.875 949 HB2 SER 23 2HB SER 23 -10.569 12.637 -15.778 950 HB3 SER 23 1HB SER 23 -9.547 13.999 -15.177 951 HG SER 23 1HG SER 23 -9.453 11.244 -14.493 952 H LYS 24 H LYS 24 -13.126 12.753 -15.128 953 HA LYS 24 HA LYS 24 -13.675 15.372 -16.023 954 HB2 LYS 24 2HB LYS 24 -14.573 13.368 -17.197 955 HB3 LYS 24 1HB LYS 24 -15.557 12.921 -15.775 956 HG2 LYS 24 2HG LYS 24 -15.951 15.624 -17.186 957 HG3 LYS 24 1HG LYS 24 -16.629 14.114 -17.884 958 HD2 LYS 24 2HD LYS 24 -18.025 13.701 -15.919 959 HD3 LYS 24 1HD LYS 24 -17.305 15.085 -15.039 960 HE2 LYS 24 2HE LYS 24 -18.190 16.655 -16.859 961 HE3 LYS 24 1HE LYS 24 -19.109 15.252 -17.525 962 HZ1 LYS 24 3HZ LYS 24 -20.476 16.521 -16.118 963 HZ2 LYS 24 1HZ LYS 24 -19.416 16.532 -14.824 964 HZ3 LYS 24 2HZ LYS 24 -20.154 15.081 -15.240 965 H LYS 25 H LYS 25 -14.781 13.407 -13.248 966 HA LYS 25 HA LYS 25 -16.730 15.273 -12.397 967 HB2 LYS 25 2HB LYS 25 -15.199 13.091 -10.875 968 HB3 LYS 25 1HB LYS 25 -16.526 14.048 -10.140 969 HG2 LYS 25 2HG LYS 25 -18.184 13.133 -11.613 970 HG3 LYS 25 1HG LYS 25 -16.962 12.416 -12.713 971 HD2 LYS 25 2HD LYS 25 -16.281 10.768 -11.077 972 HD3 LYS 25 1HD LYS 25 -17.268 11.537 -9.777 973 HE2 LYS 25 2HE LYS 25 -19.370 10.892 -10.871 974 HE3 LYS 25 1HE LYS 25 -18.499 10.303 -12.341 975 HZ1 LYS 25 3HZ LYS 25 -17.720 8.438 -11.228 976 HZ2 LYS 25 1HZ LYS 25 -19.289 8.627 -10.633 977 HZ3 LYS 25 2HZ LYS 25 -17.982 9.087 -9.660 978 H ALA 26 H ALA 26 -13.288 14.792 -11.583 979 HA ALA 26 HA ALA 26 -13.058 16.358 -9.393 980 HB1 ALA 26 1HB ALA 26 -11.218 14.897 -10.282 981 HB2 ALA 26 2HB ALA 26 -10.639 16.563 -9.923 982 HB3 ALA 26 3HB ALA 26 -10.959 16.069 -11.628 983 H VAL 27 H VAL 27 -13.046 17.503 -12.812 984 HA VAL 27 HA VAL 27 -12.056 20.050 -12.143 985 HB VAL 27 HB VAL 27 -12.562 20.762 -14.362 986 HG11 VAL 27 1HG1 VAL 27 -11.891 17.736 -14.392 987 HG12 VAL 27 2HG1 VAL 27 -10.744 19.087 -14.063 988 HG13 VAL 27 3HG1 VAL 27 -11.534 18.920 -15.680 989 HG21 VAL 27 3HG2 VAL 27 -14.587 18.450 -14.402 990 HG22 VAL 27 1HG2 VAL 27 -13.952 19.181 -15.915 991 HG23 VAL 27 2HG2 VAL 27 -14.869 20.189 -14.740 992 H GLU 28 H GLU 28 -15.175 18.647 -11.892 993 HA GLU 28 HA GLU 28 -16.624 21.166 -12.020 994 HB2 GLU 28 2HB GLU 28 -17.067 18.713 -13.047 995 HB3 GLU 28 1HB GLU 28 -17.766 18.347 -11.453 996 HG2 GLU 28 2HG GLU 28 -19.615 19.864 -11.831 997 HG3 GLU 28 1HG GLU 28 -18.721 20.770 -13.110 998 H ALA 29 H ALA 29 -15.538 18.564 -9.948 999 HA ALA 29 HA ALA 29 -16.871 19.191 -7.591 1000 HB1 ALA 29 1HB ALA 29 -15.748 16.973 -8.285 1001 HB2 ALA 29 2HB ALA 29 -15.371 17.502 -6.633 1002 HB3 ALA 29 3HB ALA 29 -14.158 17.750 -7.936 1003 H GLU 30 H GLU 30 -13.502 19.951 -8.725 1004 HA GLU 30 HA GLU 30 -13.159 21.759 -6.447 1005 HB2 GLU 30 2HB GLU 30 -11.310 20.611 -8.584 1006 HB3 GLU 30 1HB GLU 30 -10.774 21.930 -7.513 1007 HG2 GLU 30 2HG GLU 30 -11.938 19.461 -6.144 1008 HG3 GLU 30 1HG GLU 30 -10.334 19.306 -6.935 1009 H ARG 31 H ARG 31 -15.138 22.887 -7.974 1010 HA ARG 31 HA ARG 31 -13.601 25.190 -8.916 1011 HB2 ARG 31 2HB ARG 31 -15.660 23.706 -10.583 1012 HB3 ARG 31 1HB ARG 31 -15.669 25.501 -10.652 1013 HG2 ARG 31 2HG ARG 31 -13.184 23.793 -11.219 1014 HG3 ARG 31 1HG ARG 31 -14.337 24.369 -12.468 1015 HD2 ARG 31 2HD ARG 31 -13.877 26.774 -11.745 1016 HD3 ARG 31 1HD ARG 31 -12.612 26.162 -10.610 1017 HE ARG 31 HE ARG 31 -11.386 25.223 -12.540 1018 HH11 ARG 31 1HH2 ARG 31 -13.841 27.786 -13.366 1019 HH12 ARG 31 2HH2 ARG 31 -13.002 28.271 -14.768 1020 HH21 ARG 31 1HH1 ARG 31 -10.226 26.045 -14.402 1021 HH22 ARG 31 2HH1 ARG 31 -10.933 27.259 -15.386 1022 H GLY 32 H GLY 32 -13.987 26.408 -7.200 1023 HA2 GLY 32 2HA GLY 32 -15.324 28.134 -6.509 1024 HA3 GLY 32 1HA GLY 32 -16.810 27.141 -6.777 1025 H ALA 33 H ALA 33 -14.504 25.126 -5.457 1026 HA ALA 33 HA ALA 33 -16.033 25.084 -3.048 1027 HB1 ALA 33 1HB ALA 33 -13.718 23.278 -3.976 1028 HB2 ALA 33 2HB ALA 33 -15.471 22.937 -4.147 1029 HB3 ALA 33 3HB ALA 33 -14.722 22.993 -2.515 1030 HA PRO 34 HA PRO 34 -13.042 27.362 -0.735 1031 HB2 PRO 34 2HB PRO 34 -13.589 26.598 1.882 1032 HB3 PRO 34 1HB PRO 34 -14.746 27.534 0.857 1033 HG2 PRO 34 2HG PRO 34 -14.703 24.509 1.355 1034 HG3 PRO 34 1HG PRO 34 -16.116 25.636 1.476 1035 HD2 PRO 34 2HD PRO 34 -15.609 24.139 -0.797 1036 HD3 PRO 34 1HD PRO 34 -16.267 25.835 -0.915 1037 H GLY 35 H GLY 35 -10.810 26.906 -1.022 1038 HA2 GLY 35 2HA GLY 35 -8.868 26.188 -0.058 1039 HA3 GLY 35 1HA GLY 35 -9.733 24.858 0.803 1040 H ALA 36 H ALA 36 -10.445 25.608 -2.519 1041 HA ALA 36 HA ALA 36 -9.550 22.995 -3.354 1042 HB1 ALA 36 1HB ALA 36 -11.752 23.854 -4.152 1043 HB2 ALA 36 2HB ALA 36 -10.636 23.642 -5.536 1044 HB3 ALA 36 3HB ALA 36 -10.949 25.298 -4.874 1045 H ALA 37 H ALA 37 -8.353 22.823 -5.367 1046 HA ALA 37 HA ALA 37 -6.540 25.065 -5.996 1047 HB1 ALA 37 1HB ALA 37 -5.343 23.803 -4.161 1048 HB2 ALA 37 2HB ALA 37 -4.506 23.580 -5.739 1049 HB3 ALA 37 3HB ALA 37 -5.569 22.272 -5.074 1050 H LEU 38 H LEU 38 -8.152 21.965 -6.749 1051 HA LEU 38 HA LEU 38 -6.545 21.638 -9.139 1052 HB2 LEU 38 2HB LEU 38 -7.578 19.817 -7.399 1053 HB3 LEU 38 1HB LEU 38 -8.937 19.884 -8.533 1054 HG LEU 38 HG LEU 38 -6.040 19.011 -9.025 1055 HD11 LEU 38 1HD1 LEU 38 -7.222 16.886 -9.792 1056 HD12 LEU 38 2HD1 LEU 38 -8.785 17.645 -9.334 1057 HD13 LEU 38 3HD1 LEU 38 -7.546 17.317 -8.070 1058 HD21 LEU 38 3HD2 LEU 38 -6.605 20.356 -11.049 1059 HD22 LEU 38 1HD2 LEU 38 -8.132 19.422 -11.255 1060 HD23 LEU 38 2HD2 LEU 38 -6.534 18.605 -11.429 1061 H ILE 39 H ILE 39 -7.698 23.997 -9.389 1062 HA ILE 39 HA ILE 39 -10.321 23.901 -10.511 1063 HB ILE 39 HB ILE 39 -9.887 26.336 -10.934 1064 HG12 ILE 39 2HG1 ILE 39 -7.108 25.793 -9.666 1065 HG13 ILE 39 1HG1 ILE 39 -7.378 26.097 -11.410 1066 HG21 ILE 39 1HG2 ILE 39 -9.082 25.354 -8.104 1067 HG22 ILE 39 2HG2 ILE 39 -10.759 25.398 -8.751 1068 HG23 ILE 39 3HG2 ILE 39 -9.839 26.928 -8.533 1069 HD11 ILE 39 3HD ILE 39 -8.000 28.056 -9.107 1070 HD12 ILE 39 1HD ILE 39 -6.667 28.176 -10.309 1071 HD13 ILE 39 2HD ILE 39 -8.379 28.353 -10.847 1072 H SER 40 H SER 40 -8.374 22.179 -11.929 1073 HA SER 40 HA SER 40 -7.950 23.651 -14.456 1074 HB2 SER 40 2HB SER 40 -6.190 21.526 -13.099 1075 HB3 SER 40 1HB SER 40 -5.930 22.148 -14.772 1076 HG SER 40 1HG SER 40 -4.613 23.136 -13.313 1077 H TYR 41 H TYR 41 -8.448 22.595 -16.319 1078 HA TYR 41 HA TYR 41 -9.884 20.112 -16.055 1079 HB2 TYR 41 2HB TYR 41 -9.585 22.099 -18.373 1080 HB3 TYR 41 1HB TYR 41 -10.321 20.469 -18.577 1081 HD1 TYR 41 2HD TYR 41 -10.640 23.577 -16.354 1082 HD2 TYR 41 1HD TYR 41 -12.566 20.212 -18.219 1083 HE1 TYR 41 2HE TYR 41 -12.820 24.411 -15.593 1084 HE2 TYR 41 1HE TYR 41 -14.746 21.048 -17.468 1085 HH TYR 41 HH TYR 41 -15.123 23.992 -15.458 1086 HA PRO 42 HA PRO 42 -6.797 18.306 -18.914 1087 HB2 PRO 42 2HB PRO 42 -4.390 19.512 -19.717 1088 HB3 PRO 42 1HB PRO 42 -5.962 19.796 -20.559 1089 HG2 PRO 42 2HG PRO 42 -4.685 21.540 -18.374 1090 HG3 PRO 42 1HG PRO 42 -5.340 22.064 -19.981 1091 HD2 PRO 42 2HD PRO 42 -6.857 22.235 -17.694 1092 HD3 PRO 42 1HD PRO 42 -7.612 21.697 -19.267 1093 H ASP 43 H ASP 43 -5.709 20.022 -16.086 1094 HA ASP 43 HA ASP 43 -3.476 18.216 -15.634 1095 HB2 ASP 43 2HB ASP 43 -4.695 20.115 -13.538 1096 HB3 ASP 43 1HB ASP 43 -3.157 19.210 -13.432 1097 H ALA 44 H ALA 44 -6.882 18.080 -15.370 1098 HA ALA 44 HA ALA 44 -7.221 17.045 -12.812 1099 HB1 ALA 44 1HB ALA 44 -9.105 17.876 -14.205 1100 HB2 ALA 44 2HB ALA 44 -9.424 16.214 -13.602 1101 HB3 ALA 44 3HB ALA 44 -8.925 16.477 -15.318 1102 H ILE 45 H ILE 45 -6.559 15.473 -15.940 1103 HA ILE 45 HA ILE 45 -6.796 12.860 -14.943 1104 HB ILE 45 HB ILE 45 -7.103 13.308 -17.265 1105 HG12 ILE 45 2HG1 ILE 45 -4.656 11.490 -16.820 1106 HG13 ILE 45 1HG1 ILE 45 -6.369 11.058 -16.519 1107 HG21 ILE 45 1HG2 ILE 45 -4.117 14.102 -17.397 1108 HG22 ILE 45 2HG2 ILE 45 -5.519 15.219 -17.544 1109 HG23 ILE 45 3HG2 ILE 45 -5.249 13.962 -18.782 1110 HD11 ILE 45 3HD ILE 45 -5.127 11.787 -19.261 1111 HD12 ILE 45 1HD ILE 45 -5.651 10.161 -18.705 1112 HD13 ILE 45 2HD ILE 45 -6.878 11.454 -18.979 1113 H TRP 46 H TRP 46 -4.066 15.153 -14.972 1114 HA TRP 46 HA TRP 46 -2.223 13.045 -14.302 1115 HB2 TRP 46 2HB TRP 46 -2.033 16.004 -14.811 1116 HB3 TRP 46 1HB TRP 46 -0.826 15.314 -13.703 1117 HD1 TRP 46 HD TRP 46 1.044 15.963 -15.317 1118 HE1 TRP 46 1HE TRP 46 2.122 14.847 -17.292 1119 HE3 TRP 46 3HE TRP 46 -2.669 12.576 -16.380 1120 HZ2 TRP 46 2HZ TRP 46 1.513 12.689 -19.104 1121 HZ3 TRP 46 3HZ TRP 46 -2.330 10.990 -18.209 1122 HH2 TRP 46 HH TRP 46 -0.268 11.035 -19.563 1123 H TRP 47 H TRP 47 -4.388 15.065 -12.436 1124 HA TRP 47 HA TRP 47 -2.922 14.422 -10.009 1125 HB2 TRP 47 2HB TRP 47 -4.548 16.451 -10.164 1126 HB3 TRP 47 1HB TRP 47 -5.873 15.246 -10.120 1127 HD1 TRP 47 HD TRP 47 -2.706 16.209 -7.891 1128 HE1 TRP 47 1HE TRP 47 -3.194 15.531 -5.491 1129 HE3 TRP 47 3HE TRP 47 -7.298 14.082 -8.641 1130 HZ2 TRP 47 2HZ TRP 47 -5.170 13.983 -4.115 1131 HZ3 TRP 47 3HZ TRP 47 -8.410 12.955 -6.746 1132 HH2 TRP 47 HH TRP 47 -7.341 12.883 -4.513 1133 H SER 48 H SER 48 -6.006 13.336 -11.640 1134 HA SER 48 HA SER 48 -6.628 11.349 -9.944 1135 HB2 SER 48 2HB SER 48 -6.968 11.265 -12.984 1136 HB3 SER 48 1HB SER 48 -7.926 10.320 -11.777 1137 HG SER 48 1HG SER 48 -8.557 12.545 -12.726 1138 H VAL 49 H VAL 49 -4.209 11.163 -12.570 1139 HA VAL 49 HA VAL 49 -3.861 8.416 -12.612 1140 HB VAL 49 HB VAL 49 -2.046 10.762 -13.230 1141 HG11 VAL 49 1HG1 VAL 49 -0.421 9.053 -12.431 1142 HG12 VAL 49 2HG1 VAL 49 -0.379 9.117 -14.224 1143 HG13 VAL 49 3HG1 VAL 49 -1.242 7.772 -13.397 1144 HG21 VAL 49 3HG2 VAL 49 -2.388 9.953 -15.546 1145 HG22 VAL 49 1HG2 VAL 49 -4.008 9.999 -14.758 1146 HG23 VAL 49 2HG2 VAL 49 -3.156 8.436 -14.957 1147 H GLU 50 H GLU 50 -2.326 10.825 -10.290 1148 HA GLU 50 HA GLU 50 -0.833 8.563 -9.265 1149 HB2 GLU 50 2HB GLU 50 0.334 9.788 -7.805 1150 HB3 GLU 50 1HB GLU 50 0.268 10.794 -9.285 1151 HG2 GLU 50 2HG GLU 50 -1.320 12.372 -8.196 1152 HG3 GLU 50 1HG GLU 50 -1.475 11.298 -6.758 1153 H THR 51 H THR 51 -3.925 10.001 -8.699 1154 HA THR 51 HA THR 51 -4.315 9.227 -6.043 1155 HB THR 51 HB THR 51 -6.422 9.207 -8.274 1156 HG1 THR 51 1HG THR 51 -5.249 11.442 -6.972 1157 HG21 THR 51 3HG2 THR 51 -7.143 8.554 -5.900 1158 HG22 THR 51 1HG2 THR 51 -7.972 10.001 -6.576 1159 HG23 THR 51 2HG2 THR 51 -6.662 10.210 -5.369 1160 H ALA 52 H ALA 52 -4.690 7.555 -9.190 1161 HA ALA 52 HA ALA 52 -6.055 5.312 -8.171 1162 HB1 ALA 52 1HB ALA 52 -5.415 4.209 -10.351 1163 HB2 ALA 52 2HB ALA 52 -4.318 5.598 -10.705 1164 HB3 ALA 52 3HB ALA 52 -6.104 5.851 -10.591 1165 H THR 53 H THR 53 -2.569 6.117 -8.387 1166 HA THR 53 HA THR 53 -1.874 3.389 -7.779 1167 HB THR 53 HB THR 53 0.472 4.369 -7.753 1168 HG1 THR 53 1HG THR 53 -0.008 6.522 -7.424 1169 HG21 THR 53 3HG2 THR 53 -1.308 4.766 -10.269 1170 HG22 THR 53 1HG2 THR 53 -0.578 3.209 -9.712 1171 HG23 THR 53 2HG2 THR 53 0.484 4.562 -10.246 1172 H THR 54 H THR 54 -3.247 5.761 -5.910 1173 HA THR 54 HA THR 54 -3.214 6.389 -3.830 1174 HB THR 54 HB THR 54 -2.835 4.571 -2.056 1175 HG1 THR 54 1HG THR 54 -1.555 3.388 -3.847 1176 HG21 THR 54 3HG2 THR 54 -4.946 3.410 -2.746 1177 HG22 THR 54 1HG2 THR 54 -4.794 4.083 -4.414 1178 HG23 THR 54 2HG2 THR 54 -5.057 5.186 -3.006 1179 H VAL 55 H VAL 55 -0.916 7.158 -5.214 1180 HA VAL 55 HA VAL 55 1.317 6.760 -3.355 1181 HB VAL 55 HB VAL 55 1.066 8.253 -6.030 1182 HG11 VAL 55 1HG1 VAL 55 3.582 8.533 -5.850 1183 HG12 VAL 55 2HG1 VAL 55 3.519 7.900 -4.161 1184 HG13 VAL 55 3HG1 VAL 55 2.718 9.456 -4.575 1185 HG21 VAL 55 3HG2 VAL 55 2.423 6.359 -6.880 1186 HG22 VAL 55 1HG2 VAL 55 1.110 5.616 -5.908 1187 HG23 VAL 55 2HG2 VAL 55 2.745 5.795 -5.220 1188 H GLY 56 H GLY 56 -0.464 9.469 -4.952 1189 HA2 GLY 56 2HA GLY 56 -1.224 11.393 -4.134 1190 HA3 GLY 56 1HA GLY 56 -1.217 10.606 -2.501 1191 H TYR 57 H TYR 57 1.402 11.609 -4.875 1192 HA TYR 57 HA TYR 57 3.109 12.007 -2.684 1193 HB2 TYR 57 2HB TYR 57 3.745 11.462 -5.199 1194 HB3 TYR 57 1HB TYR 57 3.674 13.239 -5.455 1195 HD1 TYR 57 2HD TYR 57 5.039 14.612 -3.518 1196 HD2 TYR 57 1HD TYR 57 5.867 10.541 -4.632 1197 HE1 TYR 57 2HE TYR 57 7.082 14.689 -2.243 1198 HE2 TYR 57 1HE TYR 57 8.049 10.690 -3.478 1199 HH TYR 57 HH TYR 57 9.022 12.003 -1.431 1200 H GLY 58 H GLY 58 1.091 14.276 -4.683 1201 HA2 GLY 58 2HA GLY 58 0.422 15.827 -2.677 1202 HA3 GLY 58 1HA GLY 58 2.044 16.532 -3.119 1203 H ASP 59 H ASP 59 2.059 17.987 -4.768 1204 HA ASP 59 HA ASP 59 1.733 18.824 -6.743 1205 HB2 ASP 59 2HB ASP 59 1.524 16.311 -7.327 1206 HB3 ASP 59 1HB ASP 59 -0.226 16.605 -7.514 1207 H ARG 60 H ARG 60 -1.574 17.525 -5.920 1208 HA ARG 60 HA ARG 60 -2.448 20.225 -5.366 1209 HB2 ARG 60 2HB ARG 60 -3.961 18.417 -7.358 1210 HB3 ARG 60 1HB ARG 60 -4.822 19.556 -6.302 1211 HG2 ARG 60 2HG ARG 60 -4.733 20.724 -8.269 1212 HG3 ARG 60 1HG ARG 60 -3.518 21.492 -7.214 1213 HD2 ARG 60 2HD ARG 60 -2.793 21.301 -9.640 1214 HD3 ARG 60 1HD ARG 60 -1.678 20.467 -8.484 1215 HE ARG 60 HE ARG 60 -3.727 18.628 -9.425 1216 HH11 ARG 60 1HH2 ARG 60 -0.753 20.316 -10.557 1217 HH12 ARG 60 2HH2 ARG 60 0.139 18.917 -10.498 1218 HH21 ARG 60 1HH1 ARG 60 -2.539 16.598 -10.188 1219 HH22 ARG 60 2HH1 ARG 60 -0.868 16.803 -10.515 1220 H TYR 61 H TYR 61 -4.662 19.922 -4.032 1221 HA TYR 61 HA TYR 61 -4.799 17.287 -2.892 1222 HB2 TYR 61 2HB TYR 61 -5.153 18.487 -0.571 1223 HB3 TYR 61 1HB TYR 61 -3.487 18.119 -1.124 1224 HD1 TYR 61 2HD TYR 61 -1.998 19.876 -1.965 1225 HD2 TYR 61 1HD TYR 61 -5.883 20.850 -0.408 1226 HE1 TYR 61 2HE TYR 61 -1.294 22.209 -1.699 1227 HE2 TYR 61 1HE TYR 61 -5.185 23.198 -0.132 1228 HH TYR 61 HH TYR 61 -1.879 24.313 -1.022 1229 HA PRO 62 HA PRO 62 -8.863 19.162 -3.629 1230 HB2 PRO 62 2HB PRO 62 -10.458 16.903 -3.446 1231 HB3 PRO 62 1HB PRO 62 -9.290 17.098 -4.802 1232 HG2 PRO 62 2HG PRO 62 -8.906 15.551 -2.175 1233 HG3 PRO 62 1HG PRO 62 -8.619 14.957 -3.864 1234 HD2 PRO 62 2HD PRO 62 -6.596 16.026 -2.230 1235 HD3 PRO 62 1HD PRO 62 -6.590 16.242 -4.046 1236 H VAL 63 H VAL 63 -10.861 19.583 -2.351 1237 HA VAL 63 HA VAL 63 -10.192 19.373 0.481 1238 HB VAL 63 HB VAL 63 -10.295 21.503 -0.481 1239 HG11 VAL 63 1HG1 VAL 63 -13.338 21.165 -0.895 1240 HG12 VAL 63 2HG1 VAL 63 -12.065 21.280 -2.159 1241 HG13 VAL 63 3HG1 VAL 63 -12.361 22.663 -1.065 1242 HG21 VAL 63 3HG2 VAL 63 -10.617 21.005 1.967 1243 HG22 VAL 63 1HG2 VAL 63 -12.394 21.229 1.753 1244 HG23 VAL 63 2HG2 VAL 63 -11.264 22.575 1.411 1245 H THR 64 H THR 64 -13.378 20.031 0.533 1246 HA THR 64 HA THR 64 -14.026 17.285 1.343 1247 HB THR 64 HB THR 64 -15.308 19.881 2.388 1248 HG1 THR 64 1HG THR 64 -12.893 18.667 3.185 1249 HG21 THR 64 3HG2 THR 64 -15.797 18.563 4.417 1250 HG22 THR 64 1HG2 THR 64 -14.913 17.137 3.771 1251 HG23 THR 64 2HG2 THR 64 -16.430 17.685 2.981 1252 H GLU 65 H GLU 65 -15.120 20.249 -0.254 1253 HA GLU 65 HA GLU 65 -17.813 19.235 -0.535 1254 HB2 GLU 65 2HB GLU 65 -16.751 21.752 0.029 1255 HB3 GLU 65 1HB GLU 65 -17.128 21.903 -1.713 1256 HG2 GLU 65 2HG GLU 65 -19.511 21.090 -1.187 1257 HG3 GLU 65 1HG GLU 65 -19.049 21.008 0.559 1258 H GLU 66 H GLU 66 -15.041 18.635 -2.127 1259 HA GLU 66 HA GLU 66 -16.098 18.819 -4.814 1260 HB2 GLU 66 2HB GLU 66 -13.876 17.280 -5.079 1261 HB3 GLU 66 1HB GLU 66 -13.832 19.071 -5.021 1262 HG2 GLU 66 2HG GLU 66 -12.061 18.261 -3.671 1263 HG3 GLU 66 1HG GLU 66 -13.239 19.011 -2.569 1264 H GLY 67 H GLY 67 -15.697 16.788 -2.025 1265 HA2 GLY 67 2HA GLY 67 -17.193 15.260 -1.264 1266 HA3 GLY 67 1HA GLY 67 -17.839 15.024 -2.954 1267 H ARG 68 H ARG 68 -14.748 14.988 -1.155 1268 HA ARG 68 HA ARG 68 -13.113 13.682 -2.549 1269 HB2 ARG 68 2HB ARG 68 -12.842 14.644 -0.226 1270 HB3 ARG 68 1HB ARG 68 -13.317 13.036 0.431 1271 HG2 ARG 68 2HG ARG 68 -11.314 12.034 -0.759 1272 HG3 ARG 68 1HG ARG 68 -10.894 13.662 -1.395 1273 HD2 ARG 68 2HD ARG 68 -11.071 12.879 1.608 1274 HD3 ARG 68 1HD ARG 68 -9.533 12.968 0.641 1275 HE ARG 68 HE ARG 68 -10.829 15.489 0.310 1276 HH11 ARG 68 1HH2 ARG 68 -9.817 13.586 3.189 1277 HH12 ARG 68 2HH2 ARG 68 -8.660 14.636 3.693 1278 HH21 ARG 68 1HH1 ARG 68 -9.456 17.197 1.241 1279 HH22 ARG 68 2HH1 ARG 68 -9.105 17.103 2.941 1280 H LYS 69 H LYS 69 -15.884 12.133 -1.657 1281 HA LYS 69 HA LYS 69 -15.406 9.462 -2.054 1282 HB2 LYS 69 2HB LYS 69 -17.694 11.107 -3.234 1283 HB3 LYS 69 1HB LYS 69 -17.657 9.343 -2.867 1284 HG2 LYS 69 2HG LYS 69 -17.159 10.012 -0.409 1285 HG3 LYS 69 1HG LYS 69 -17.630 11.695 -0.854 1286 HD2 LYS 69 2HD LYS 69 -19.902 10.836 -1.559 1287 HD3 LYS 69 1HD LYS 69 -19.345 9.172 -1.164 1288 HE2 LYS 69 2HE LYS 69 -18.899 10.072 1.270 1289 HE3 LYS 69 1HE LYS 69 -19.881 11.514 0.786 1290 HZ1 LYS 69 3HZ LYS 69 -21.255 9.856 1.840 1291 HZ2 LYS 69 1HZ LYS 69 -20.701 8.656 0.777 1292 HZ3 LYS 69 2HZ LYS 69 -21.673 9.919 0.179 1293 H VAL 70 H VAL 70 -15.095 12.228 -4.283 1294 HA VAL 70 HA VAL 70 -15.003 10.760 -6.672 1295 HB VAL 70 HB VAL 70 -15.451 13.140 -6.663 1296 HG11 VAL 70 1HG1 VAL 70 -13.923 13.877 -4.782 1297 HG12 VAL 70 2HG1 VAL 70 -13.739 14.849 -6.266 1298 HG13 VAL 70 3HG1 VAL 70 -12.502 13.622 -5.857 1299 HG21 VAL 70 3HG2 VAL 70 -12.863 12.440 -8.210 1300 HG22 VAL 70 1HG2 VAL 70 -14.031 13.745 -8.603 1301 HG23 VAL 70 2HG2 VAL 70 -14.542 12.021 -8.713 1302 H ALA 71 H ALA 71 -12.451 11.773 -4.358 1303 HA ALA 71 HA ALA 71 -10.338 10.578 -5.842 1304 HB1 ALA 71 1HB ALA 71 -10.427 11.435 -2.881 1305 HB2 ALA 71 2HB ALA 71 -9.903 12.475 -4.253 1306 HB3 ALA 71 3HB ALA 71 -8.947 11.016 -3.817 1307 H GLU 72 H GLU 72 -12.274 9.717 -2.978 1308 HA GLU 72 HA GLU 72 -11.206 7.377 -2.100 1309 HB2 GLU 72 2HB GLU 72 -13.247 8.620 -1.136 1310 HB3 GLU 72 1HB GLU 72 -14.155 8.028 -2.561 1311 HG2 GLU 72 2HG GLU 72 -13.604 5.599 -1.624 1312 HG3 GLU 72 1HG GLU 72 -13.263 6.471 -0.083 1313 H GLN 73 H GLN 73 -13.562 7.871 -4.741 1314 HA GLN 73 HA GLN 73 -13.970 5.208 -5.352 1315 HB2 GLN 73 2HB GLN 73 -15.443 7.029 -6.238 1316 HB3 GLN 73 1HB GLN 73 -14.083 7.669 -7.207 1317 HG2 GLN 73 2HG GLN 73 -15.683 6.461 -8.633 1318 HG3 GLN 73 1HG GLN 73 -14.115 5.595 -8.644 1319 HE21 GLN 73 1HE2 GLN 73 -13.959 3.568 -7.290 1320 HE22 GLN 73 2HE2 GLN 73 -15.403 2.672 -6.932 1321 H VAL 74 H VAL 74 -11.483 7.526 -6.622 1322 HA VAL 74 HA VAL 74 -10.673 5.744 -8.664 1323 HB VAL 74 HB VAL 74 -8.648 7.710 -7.549 1324 HG11 VAL 74 1HG1 VAL 74 -8.140 7.947 -9.966 1325 HG12 VAL 74 2HG1 VAL 74 -9.557 6.919 -10.407 1326 HG13 VAL 74 3HG1 VAL 74 -8.158 6.205 -9.522 1327 HG21 VAL 74 3HG2 VAL 74 -9.808 9.515 -8.952 1328 HG22 VAL 74 1HG2 VAL 74 -10.573 9.101 -7.390 1329 HG23 VAL 74 2HG2 VAL 74 -11.285 8.470 -8.919 1330 H MET 75 H MET 75 -9.534 6.481 -5.360 1331 HA MET 75 HA MET 75 -7.261 4.853 -5.399 1332 HB2 MET 75 2HB MET 75 -9.136 5.562 -3.053 1333 HB3 MET 75 1HB MET 75 -7.541 4.746 -2.884 1334 HG2 MET 75 2HG MET 75 -6.465 6.711 -4.058 1335 HG3 MET 75 1HG MET 75 -8.017 7.590 -3.969 1336 HE1 MET 75 3HE MET 75 -9.322 6.900 -1.145 1337 HE2 MET 75 1HE MET 75 -9.111 8.522 -1.907 1338 HE3 MET 75 2HE MET 75 -8.599 8.235 -0.205 1339 H LYS 76 H LYS 76 -10.632 4.128 -4.217 1340 HA LYS 76 HA LYS 76 -9.881 1.526 -3.482 1341 HB2 LYS 76 2HB LYS 76 -12.043 2.778 -2.705 1342 HB3 LYS 76 1HB LYS 76 -12.767 2.179 -4.234 1343 HG2 LYS 76 2HG LYS 76 -11.894 -0.195 -3.463 1344 HG3 LYS 76 1HG LYS 76 -11.608 0.564 -1.866 1345 HD2 LYS 76 2HD LYS 76 -14.104 1.070 -1.743 1346 HD3 LYS 76 1HD LYS 76 -14.293 0.311 -3.371 1347 HE2 LYS 76 2HE LYS 76 -13.276 -1.848 -2.405 1348 HE3 LYS 76 1HE LYS 76 -13.367 -1.103 -0.770 1349 HZ1 LYS 76 3HZ LYS 76 -15.782 -1.009 -1.008 1350 HZ2 LYS 76 1HZ LYS 76 -15.212 -2.547 -1.240 1351 HZ3 LYS 76 2HZ LYS 76 -15.690 -1.623 -2.594 1352 H ALA 77 H ALA 77 -11.092 2.880 -6.556 1353 HA ALA 77 HA ALA 77 -11.619 0.394 -7.782 1354 HB1 ALA 77 1HB ALA 77 -12.436 2.536 -8.802 1355 HB2 ALA 77 2HB ALA 77 -11.411 1.622 -9.965 1356 HB3 ALA 77 3HB ALA 77 -10.729 3.046 -9.090 1357 H GLY 78 H GLY 78 -8.652 2.394 -7.491 1358 HA2 GLY 78 2HA GLY 78 -7.046 0.877 -9.218 1359 HA3 GLY 78 1HA GLY 78 -6.523 1.931 -7.844 1360 H ILE 79 H ILE 79 -7.532 0.719 -5.669 1361 HA ILE 79 HA ILE 79 -5.784 -1.365 -5.171 1362 HB ILE 79 HB ILE 79 -8.335 -0.498 -3.744 1363 HG12 ILE 79 2HG1 ILE 79 -5.349 -0.037 -3.075 1364 HG13 ILE 79 1HG1 ILE 79 -6.359 1.152 -3.943 1365 HG21 ILE 79 1HG2 ILE 79 -6.136 -2.457 -2.786 1366 HG22 ILE 79 2HG2 ILE 79 -7.859 -2.873 -3.100 1367 HG23 ILE 79 3HG2 ILE 79 -7.441 -1.786 -1.746 1368 HD11 ILE 79 3HD ILE 79 -6.826 0.166 -1.052 1369 HD12 ILE 79 1HD ILE 79 -6.230 1.777 -1.573 1370 HD13 ILE 79 2HD ILE 79 -7.922 1.282 -1.954 1371 H GLU 80 H GLU 80 -9.341 -1.544 -5.974 1372 HA GLU 80 HA GLU 80 -9.376 -4.341 -5.737 1373 HB2 GLU 80 2HB GLU 80 -11.269 -2.545 -7.350 1374 HB3 GLU 80 1HB GLU 80 -11.492 -4.309 -7.096 1375 HG2 GLU 80 2HG GLU 80 -11.503 -3.919 -4.584 1376 HG3 GLU 80 1HG GLU 80 -11.497 -2.146 -4.896 1377 H VAL 81 H VAL 81 -8.484 -2.271 -8.513 1378 HA VAL 81 HA VAL 81 -8.456 -4.400 -10.395 1379 HB VAL 81 HB VAL 81 -7.243 -1.613 -10.307 1380 HG11 VAL 81 1HG1 VAL 81 -6.635 -1.961 -12.763 1381 HG12 VAL 81 2HG1 VAL 81 -6.895 -3.727 -12.540 1382 HG13 VAL 81 3HG1 VAL 81 -5.595 -2.877 -11.626 1383 HG21 VAL 81 3HG2 VAL 81 -9.409 -2.957 -12.078 1384 HG22 VAL 81 1HG2 VAL 81 -8.963 -1.213 -12.072 1385 HG23 VAL 81 2HG2 VAL 81 -9.750 -1.940 -10.631 1386 H PHE 82 H PHE 82 -5.869 -2.855 -8.379 1387 HA PHE 82 HA PHE 82 -3.843 -4.589 -9.307 1388 HB2 PHE 82 2HB PHE 82 -4.051 -3.097 -6.604 1389 HB3 PHE 82 1HB PHE 82 -2.551 -3.880 -7.229 1390 HD1 PHE 82 1HD PHE 82 -2.333 -3.095 -10.025 1391 HD2 PHE 82 2HD PHE 82 -3.711 -0.805 -6.647 1392 HE1 PHE 82 1HE PHE 82 -1.666 -1.011 -11.157 1393 HE2 PHE 82 2HE PHE 82 -3.026 1.270 -7.778 1394 HZ PHE 82 HZ PHE 82 -2.010 1.183 -10.037 1395 H ALA 83 H ALA 83 -6.344 -4.975 -6.883 1396 HA ALA 83 HA ALA 83 -5.118 -7.196 -5.596 1397 HB1 ALA 83 1HB ALA 83 -6.829 -5.803 -4.435 1398 HB2 ALA 83 2HB ALA 83 -7.356 -7.519 -4.519 1399 HB3 ALA 83 3HB ALA 83 -8.070 -6.303 -5.643 1400 H LEU 84 H LEU 84 -7.525 -6.774 -8.220 1401 HA LEU 84 HA LEU 84 -8.448 -9.376 -8.296 1402 HB2 LEU 84 2HB LEU 84 -9.485 -7.362 -9.372 1403 HB3 LEU 84 1HB LEU 84 -8.246 -7.397 -10.657 1404 HG LEU 84 HG LEU 84 -9.920 -9.901 -10.140 1405 HD11 LEU 84 1HD1 LEU 84 -11.816 -9.066 -11.503 1406 HD12 LEU 84 2HD1 LEU 84 -11.033 -7.443 -11.637 1407 HD13 LEU 84 3HD1 LEU 84 -11.593 -8.050 -10.034 1408 HD21 LEU 84 3HD2 LEU 84 -8.958 -8.585 -12.773 1409 HD22 LEU 84 1HD2 LEU 84 -9.856 -10.141 -12.629 1410 HD23 LEU 84 2HD2 LEU 84 -8.199 -9.998 -11.963 1411 H VAL 85 H VAL 85 -5.560 -7.938 -9.820 1412 HA VAL 85 HA VAL 85 -5.102 -10.084 -11.560 1413 HB VAL 85 HB VAL 85 -2.926 -9.230 -12.003 1414 HG11 VAL 85 1HG1 VAL 85 -5.051 -8.031 -12.853 1415 HG12 VAL 85 2HG1 VAL 85 -3.588 -6.987 -12.768 1416 HG13 VAL 85 3HG1 VAL 85 -4.860 -6.853 -11.512 1417 HG21 VAL 85 3HG2 VAL 85 -1.958 -7.311 -10.722 1418 HG22 VAL 85 1HG2 VAL 85 -2.165 -8.724 -9.635 1419 HG23 VAL 85 2HG2 VAL 85 -3.341 -7.361 -9.585 1420 H THR 86 H THR 86 -4.939 -10.085 -8.176 1421 HA THR 86 HA THR 86 -2.871 -11.860 -7.688 1422 HB THR 86 HB THR 86 -5.558 -11.599 -6.262 1423 HG1 THR 86 1HG THR 86 -4.642 -9.734 -6.049 1424 HG21 THR 86 3HG2 THR 86 -4.453 -13.704 -5.520 1425 HG22 THR 86 1HG2 THR 86 -4.234 -12.454 -4.250 1426 HG23 THR 86 2HG2 THR 86 -2.869 -12.856 -5.352 1427 H ALA 87 H ALA 87 -5.942 -12.416 -9.354 1428 HA ALA 87 HA ALA 87 -6.032 -15.204 -8.897 1429 HB1 ALA 87 1HB ALA 87 -7.453 -15.311 -10.953 1430 HB2 ALA 87 2HB ALA 87 -6.944 -13.630 -11.391 1431 HB3 ALA 87 3HB ALA 87 -7.935 -13.918 -9.922 1432 H ALA 88 H ALA 88 -3.932 -13.235 -10.950 1433 HA ALA 88 HA ALA 88 -3.047 -15.459 -12.589 1434 HB1 ALA 88 1HB ALA 88 -1.246 -13.896 -13.350 1435 HB2 ALA 88 2HB ALA 88 -1.788 -12.670 -12.150 1436 HB3 ALA 88 3HB ALA 88 -2.861 -13.119 -13.519 1437 H LEU 89 H LEU 89 -1.833 -13.402 -9.919 1438 HA LEU 89 HA LEU 89 0.522 -14.716 -9.443 1439 HB2 LEU 89 2HB LEU 89 -1.257 -13.342 -7.337 1440 HB3 LEU 89 1HB LEU 89 0.497 -13.664 -7.180 1441 HG LEU 89 HG LEU 89 -0.756 -11.806 -9.303 1442 HD11 LEU 89 1HD1 LEU 89 0.625 -11.092 -6.640 1443 HD12 LEU 89 2HD1 LEU 89 -1.115 -10.902 -7.001 1444 HD13 LEU 89 3HD1 LEU 89 0.091 -9.930 -7.907 1445 HD21 LEU 89 3HD2 LEU 89 1.589 -10.981 -9.615 1446 HD22 LEU 89 1HD2 LEU 89 1.462 -12.727 -10.029 1447 HD23 LEU 89 2HD2 LEU 89 2.190 -12.220 -8.459 1448 H ALA 90 H ALA 90 -2.714 -15.443 -8.139 1449 HA ALA 90 HA ALA 90 -1.830 -17.246 -6.220 1450 HB1 ALA 90 1HB ALA 90 -4.061 -16.153 -6.099 1451 HB2 ALA 90 2HB ALA 90 -4.194 -17.945 -5.997 1452 HB3 ALA 90 3HB ALA 90 -4.586 -17.088 -7.546 1453 H THR 91 H THR 91 -1.939 -17.610 -9.584 1454 HA THR 91 HA THR 91 -2.395 -20.462 -9.552 1455 HB THR 91 HB THR 91 -1.235 -18.766 -11.827 1456 HG1 THR 91 1HG THR 91 -3.182 -17.880 -11.162 1457 HG21 THR 91 3HG2 THR 91 -2.302 -20.564 -13.246 1458 HG22 THR 91 1HG2 THR 91 -2.876 -21.409 -11.755 1459 HG23 THR 91 2HG2 THR 91 -1.114 -21.271 -12.102 1460 H ASP 92 H ASP 92 0.278 -18.160 -9.088 1461 HA ASP 92 HA ASP 92 2.280 -19.959 -10.018 1462 HB2 ASP 92 2HB ASP 92 2.475 -17.279 -8.533 1463 HB3 ASP 92 1HB ASP 92 3.911 -18.244 -9.045 1464 H PHE 93 H PHE 93 0.481 -19.804 -7.244 1465 HA PHE 93 HA PHE 93 2.385 -20.829 -5.417 1466 HB2 PHE 93 2HB PHE 93 -0.685 -21.241 -5.413 1467 HB3 PHE 93 1HB PHE 93 0.403 -21.369 -3.987 1468 HD1 PHE 93 2HD PHE 93 1.626 -18.342 -5.395 1469 HD2 PHE 93 1HD PHE 93 -1.967 -20.007 -3.678 1470 HE1 PHE 93 2HE PHE 93 0.836 -16.100 -4.864 1471 HE2 PHE 93 1HE PHE 93 -2.721 -17.731 -3.095 1472 HZ PHE 93 HZ PHE 93 -1.328 -15.765 -3.698 1473 H VAL 94 H VAL 94 0.223 -22.109 -7.899 1474 HA VAL 94 HA VAL 94 0.514 -24.852 -6.987 1475 HB VAL 94 HB VAL 94 -1.147 -23.719 -9.298 1476 HG11 VAL 94 1HG1 VAL 94 -2.415 -25.891 -8.999 1477 HG12 VAL 94 2HG1 VAL 94 -1.220 -26.415 -7.758 1478 HG13 VAL 94 3HG1 VAL 94 -0.707 -26.190 -9.469 1479 HG21 VAL 94 3HG2 VAL 94 -3.041 -24.000 -7.565 1480 HG22 VAL 94 1HG2 VAL 94 -1.922 -22.636 -7.228 1481 HG23 VAL 94 2HG2 VAL 94 -1.782 -24.182 -6.302 1482 H ARG 95 H ARG 95 1.506 -22.616 -9.605 1483 HA ARG 95 HA ARG 95 2.524 -24.565 -11.320 1484 HB2 ARG 95 2HB ARG 95 3.335 -21.620 -11.032 1485 HB3 ARG 95 1HB ARG 95 4.081 -22.738 -12.215 1486 HG2 ARG 95 2HG ARG 95 1.773 -23.323 -13.064 1487 HG3 ARG 95 1HG ARG 95 1.126 -21.902 -12.187 1488 HD2 ARG 95 2HD ARG 95 3.474 -21.724 -14.243 1489 HD3 ARG 95 1HD ARG 95 1.734 -21.692 -14.733 1490 HE ARG 95 HE ARG 95 2.362 -19.665 -12.642 1491 HH11 ARG 95 1HH2 ARG 95 3.062 -20.021 -16.153 1492 HH12 ARG 95 2HH2 ARG 95 2.317 -18.569 -16.580 1493 HH21 ARG 95 1HH1 ARG 95 1.961 -17.630 -13.127 1494 HH22 ARG 95 2HH1 ARG 95 2.080 -16.964 -14.691 1495 H ARG 96 H ARG 96 3.646 -23.985 -8.191 1496 HA ARG 96 HA ARG 96 6.403 -24.412 -8.563 1497 HB2 ARG 96 2HB ARG 96 6.527 -24.993 -6.213 1498 HB3 ARG 96 1HB ARG 96 5.394 -23.620 -6.377 1499 HG2 ARG 96 2HG ARG 96 3.445 -25.154 -6.152 1500 HG3 ARG 96 1HG ARG 96 4.503 -26.579 -6.076 1501 HD2 ARG 96 2HD ARG 96 4.536 -24.330 -3.952 1502 HD3 ARG 96 1HD ARG 96 3.659 -25.922 -3.824 1503 HE ARG 96 HE ARG 96 6.397 -26.413 -4.592 1504 HH11 ARG 96 1HH2 ARG 96 4.359 -25.838 -1.636 1505 HH12 ARG 96 2HH2 ARG 96 5.461 -26.700 -0.625 1506 HH21 ARG 96 1HH1 ARG 96 7.953 -27.313 -3.091 1507 HH22 ARG 96 2HH1 ARG 96 7.563 -27.477 -1.450 1508 H GLU 97 H GLU 97 3.653 -26.512 -8.839 1509 HA GLU 97 HA GLU 97 5.041 -28.985 -8.338 1510 HB2 GLU 97 2HB GLU 97 2.535 -28.559 -7.931 1511 HB3 GLU 97 1HB GLU 97 2.341 -28.349 -9.692 1512 HG2 GLU 97 2HG GLU 97 1.569 -30.526 -9.310 1513 HG3 GLU 97 1HG GLU 97 3.244 -30.844 -9.886 1514 H GLU 98 H GLU 98 4.362 -26.785 -11.015 1515 HA GLU 98 HA GLU 98 4.942 -28.777 -13.057 1516 HB2 GLU 98 2HB GLU 98 4.178 -25.792 -13.274 1517 HB3 GLU 98 1HB GLU 98 4.293 -26.952 -14.640 1518 HG2 GLU 98 2HG GLU 98 2.383 -28.259 -13.758 1519 HG3 GLU 98 1HG GLU 98 2.265 -27.189 -12.309 1520 H GLU 99 H GLU 99 6.445 -27.595 -14.849 1521 HA GLU 99 HA GLU 99 8.415 -27.072 -15.461 1522 HB2 GLU 99 2HB GLU 99 8.723 -25.191 -13.084 1523 HB3 GLU 99 1HB GLU 99 9.830 -25.354 -14.490 1524 HG2 GLU 99 2HG GLU 99 7.748 -24.873 -15.986 1525 HG3 GLU 99 1HG GLU 99 6.935 -24.300 -14.486 1526 H ARG 100 H ARG 100 8.737 -27.341 -11.941 1527 HA ARG 100 HA ARG 100 11.328 -28.520 -12.092 1528 HB2 ARG 100 2HB ARG 100 10.496 -27.061 -10.243 1529 HB3 ARG 100 1HB ARG 100 9.320 -28.328 -9.760 1530 HG2 ARG 100 2HG ARG 100 11.141 -29.813 -9.072 1531 HG3 ARG 100 1HG ARG 100 12.375 -28.768 -9.865 1532 HD2 ARG 100 2HD ARG 100 12.122 -26.978 -8.253 1533 HD3 ARG 100 1HD ARG 100 10.645 -27.699 -7.527 1534 HE ARG 100 HE ARG 100 13.448 -28.421 -7.039 1535 HH11 ARG 100 1HH2 ARG 100 10.046 -29.539 -6.755 1536 HH12 ARG 100 2HH2 ARG 100 10.297 -30.466 -5.327 1537 HH21 ARG 100 1HH1 ARG 100 13.870 -30.067 -5.390 1538 HH22 ARG 100 2HH1 ARG 100 12.589 -30.801 -4.528 1539 H ARG 101 H ARG 101 7.953 -29.753 -11.831 1540 HA ARG 101 HA ARG 101 9.061 -32.423 -12.374 1541 HB2 ARG 101 2HB ARG 101 6.290 -31.850 -11.172 1542 HB3 ARG 101 1HB ARG 101 7.026 -33.440 -11.496 1543 HG2 ARG 101 2HG ARG 101 8.687 -33.053 -9.652 1544 HG3 ARG 101 1HG ARG 101 8.091 -31.367 -9.459 1545 HD2 ARG 101 2HD ARG 101 7.075 -32.807 -7.684 1546 HD3 ARG 101 1HD ARG 101 5.842 -32.142 -8.846 1547 HE ARG 101 HE ARG 101 6.860 -34.759 -9.706 1548 HH11 ARG 101 1HH2 ARG 101 4.394 -33.022 -7.645 1549 HH12 ARG 101 2HH2 ARG 101 3.338 -34.331 -7.595 1550 HH21 ARG 101 1HH1 ARG 101 5.301 -36.652 -9.505 1551 HH22 ARG 101 2HH1 ARG 101 3.919 -36.456 -8.517 1552 H GLY 102 H GLY 102 8.044 -33.294 -14.267 1553 HA2 GLY 102 2HA GLY 102 6.620 -33.336 -16.001 1554 HA3 GLY 102 1HA GLY 102 5.775 -31.894 -15.353 1555 H HIS 103 H HIS 103 8.372 -30.376 -15.336 1556 HA HIS 103 HA HIS 103 9.224 -28.789 -16.597 1557 HB2 HIS 103 2HB HIS 103 9.603 -31.027 -18.605 1558 HB3 HIS 103 1HB HIS 103 9.952 -29.330 -19.044 1559 HD1 HIS 103 1HD HIS 103 11.086 -29.071 -15.719 1560 HD2 HIS 103 2HD HIS 103 12.578 -30.961 -19.192 1561 HE1 HIS 103 1HE HIS 103 13.572 -29.079 -15.559 1562 HE2 HIS 103 2HE HIS 103 14.460 -30.220 -17.669 1563 H1 SER 1 H SER 1 14.591 -25.342 -4.561 1564 HA SER 1 HA SER 1 14.650 -26.162 -2.071 1565 HB2 SER 1 2HB SER 1 17.167 -25.586 -1.960 1566 HB3 SER 1 1HB SER 1 16.718 -23.859 -2.152 1567 HG SER 1 1HG SER 1 16.916 -24.201 -0.032 1568 H ALA 2 H ALA 2 12.550 -25.502 -2.504 1569 HA ALA 2 HA ALA 2 10.794 -24.259 -2.422 1570 HB1 ALA 2 1HB ALA 2 12.518 -21.827 -1.743 1571 HB2 ALA 2 2HB ALA 2 11.672 -22.895 -0.586 1572 HB3 ALA 2 3HB ALA 2 10.716 -21.877 -1.721 1573 H ASP 3 H ASP 3 13.358 -22.475 -4.094 1574 HA ASP 3 HA ASP 3 13.716 -21.908 -6.149 1575 HB2 ASP 3 2HB ASP 3 11.343 -23.657 -6.987 1576 HB3 ASP 3 1HB ASP 3 12.469 -22.823 -8.113 1577 H HIS 4 H HIS 4 10.322 -21.685 -5.369 1578 HA HIS 4 HA HIS 4 9.450 -19.410 -6.581 1579 HB2 HIS 4 2HB HIS 4 7.910 -19.018 -4.748 1580 HB3 HIS 4 1HB HIS 4 8.088 -20.792 -4.907 1581 HD1 HIS 4 1HD HIS 4 7.147 -21.185 -2.436 1582 HD2 HIS 4 2HD HIS 4 10.227 -18.343 -2.341 1583 HE1 HIS 4 1HE HIS 4 7.754 -20.806 -0.066 1584 HE2 HIS 4 2HE HIS 4 9.458 -18.980 -0.043 1585 H GLU 5 H GLU 5 11.886 -19.645 -4.019 1586 HA GLU 5 HA GLU 5 11.533 -16.897 -3.198 1587 HB2 GLU 5 2HB GLU 5 13.538 -17.235 -1.774 1588 HB3 GLU 5 1HB GLU 5 12.267 -18.422 -1.397 1589 HG2 GLU 5 2HG GLU 5 13.526 -20.244 -2.487 1590 HG3 GLU 5 1HG GLU 5 14.686 -19.086 -3.216 1591 H ARG 6 H ARG 6 13.409 -18.733 -5.497 1592 HA ARG 6 HA ARG 6 15.658 -17.006 -5.550 1593 HB2 ARG 6 2HB ARG 6 15.485 -19.509 -6.289 1594 HB3 ARG 6 1HB ARG 6 14.598 -18.920 -7.729 1595 HG2 ARG 6 2HG ARG 6 16.754 -17.433 -8.153 1596 HG3 ARG 6 1HG ARG 6 17.520 -18.456 -6.901 1597 HD2 ARG 6 2HD ARG 6 18.055 -19.457 -9.093 1598 HD3 ARG 6 1HD ARG 6 16.859 -20.534 -8.287 1599 HE ARG 6 HE ARG 6 15.173 -19.835 -9.831 1600 HH11 ARG 6 1HH2 ARG 6 18.113 -17.797 -10.313 1601 HH12 ARG 6 2HH2 ARG 6 17.658 -17.301 -11.896 1602 HH21 ARG 6 1HH1 ARG 6 14.424 -18.875 -11.783 1603 HH22 ARG 6 2HH1 ARG 6 15.376 -17.772 -12.676 1604 H GLU 7 H GLU 7 12.622 -17.428 -7.379 1605 HA GLU 7 HA GLU 7 13.181 -15.471 -9.329 1606 HB2 GLU 7 2HB GLU 7 11.401 -17.402 -9.408 1607 HB3 GLU 7 1HB GLU 7 10.377 -16.323 -8.417 1608 HG2 GLU 7 2HG GLU 7 9.645 -15.955 -10.654 1609 HG3 GLU 7 1HG GLU 7 10.698 -14.537 -10.316 1610 H ALA 8 H ALA 8 11.670 -15.440 -6.099 1611 HA ALA 8 HA ALA 8 10.602 -12.847 -6.268 1612 HB1 ALA 8 1HB ALA 8 11.495 -14.413 -3.765 1613 HB2 ALA 8 2HB ALA 8 9.852 -14.484 -4.517 1614 HB3 ALA 8 3HB ALA 8 10.450 -12.957 -3.768 1615 H GLN 9 H GLN 9 13.693 -14.107 -4.971 1616 HA GLN 9 HA GLN 9 14.835 -11.753 -4.111 1617 HB2 GLN 9 2HB GLN 9 15.711 -14.088 -3.699 1618 HB3 GLN 9 1HB GLN 9 16.146 -14.217 -5.434 1619 HG2 GLN 9 2HG GLN 9 17.832 -12.328 -5.109 1620 HG3 GLN 9 1HG GLN 9 17.402 -12.301 -3.360 1621 HE21 GLN 9 1HE2 GLN 9 19.111 -13.324 -2.285 1622 HE22 GLN 9 2HE2 GLN 9 19.899 -14.773 -2.803 1623 H LYS 10 H LYS 10 14.659 -13.154 -7.343 1624 HA LYS 10 HA LYS 10 16.514 -11.495 -8.642 1625 HB2 LYS 10 2HB LYS 10 15.444 -13.749 -9.392 1626 HB3 LYS 10 1HB LYS 10 13.997 -12.800 -9.849 1627 HG2 LYS 10 2HG LYS 10 15.488 -11.460 -11.449 1628 HG3 LYS 10 1HG LYS 10 16.827 -12.582 -11.020 1629 HD2 LYS 10 2HD LYS 10 15.221 -14.529 -11.743 1630 HD3 LYS 10 1HD LYS 10 14.105 -13.262 -12.326 1631 HE2 LYS 10 2HE LYS 10 15.344 -14.021 -14.270 1632 HE3 LYS 10 1HE LYS 10 16.010 -12.397 -13.849 1633 HZ1 LYS 10 3HZ LYS 10 17.830 -13.703 -14.243 1634 HZ2 LYS 10 1HZ LYS 10 17.236 -15.079 -13.464 1635 HZ3 LYS 10 2HZ LYS 10 17.766 -13.769 -12.542 1636 H ALA 11 H ALA 11 12.989 -11.307 -8.071 1637 HA ALA 11 HA ALA 11 12.497 -9.078 -9.684 1638 HB1 ALA 11 1HB ALA 11 10.921 -10.002 -7.199 1639 HB2 ALA 11 2HB ALA 11 10.680 -10.618 -8.874 1640 HB3 ALA 11 3HB ALA 11 10.322 -8.898 -8.490 1641 H GLU 12 H GLU 12 13.340 -9.376 -6.217 1642 HA GLU 12 HA GLU 12 13.019 -6.769 -5.404 1643 HB2 GLU 12 2HB GLU 12 15.331 -8.680 -4.636 1644 HB3 GLU 12 1HB GLU 12 14.906 -7.176 -3.754 1645 HG2 GLU 12 2HG GLU 12 12.727 -8.142 -3.062 1646 HG3 GLU 12 1HG GLU 12 13.083 -9.660 -3.956 1647 H GLU 13 H GLU 13 15.697 -8.224 -7.223 1648 HA GLU 13 HA GLU 13 17.486 -6.042 -6.939 1649 HB2 GLU 13 2HB GLU 13 18.156 -8.433 -7.419 1650 HB3 GLU 13 1HB GLU 13 17.456 -8.269 -9.065 1651 HG2 GLU 13 2HG GLU 13 19.135 -6.407 -9.549 1652 HG3 GLU 13 1HG GLU 13 19.821 -6.644 -7.899 1653 H GLU 14 H GLU 14 15.023 -7.012 -9.306 1654 HA GLU 14 HA GLU 14 15.801 -5.369 -11.394 1655 HB2 GLU 14 2HB GLU 14 14.209 -7.282 -11.599 1656 HB3 GLU 14 1HB GLU 14 12.978 -6.335 -10.697 1657 HG2 GLU 14 2HG GLU 14 12.566 -6.364 -13.155 1658 HG3 GLU 14 1HG GLU 14 12.826 -4.696 -12.539 1659 H LEU 15 H LEU 15 13.715 -4.750 -8.571 1660 HA LEU 15 HA LEU 15 12.819 -2.255 -9.426 1661 HB2 LEU 15 2HB LEU 15 11.873 -3.596 -7.500 1662 HB3 LEU 15 1HB LEU 15 13.306 -3.168 -6.518 1663 HG LEU 15 HG LEU 15 12.649 -0.785 -6.537 1664 HD11 LEU 15 1HD1 LEU 15 10.432 -0.077 -7.619 1665 HD12 LEU 15 2HD1 LEU 15 10.412 -1.658 -8.473 1666 HD13 LEU 15 3HD1 LEU 15 11.731 -0.469 -8.780 1667 HD21 LEU 15 3HD2 LEU 15 10.496 -0.965 -5.263 1668 HD22 LEU 15 1HD2 LEU 15 11.628 -2.290 -4.819 1669 HD23 LEU 15 2HD2 LEU 15 10.237 -2.620 -5.912 1670 H GLN 16 H GLN 16 15.781 -3.205 -7.728 1671 HA GLN 16 HA GLN 16 16.524 -0.632 -6.861 1672 HB2 GLN 16 2HB GLN 16 18.160 -3.189 -7.301 1673 HB3 GLN 16 1HB GLN 16 18.801 -1.730 -6.477 1674 HG2 GLN 16 2HG GLN 16 17.261 -1.919 -4.636 1675 HG3 GLN 16 1HG GLN 16 16.209 -3.084 -5.506 1676 HE21 GLN 16 1HE2 GLN 16 16.376 -5.095 -4.691 1677 HE22 GLN 16 2HE2 GLN 16 17.717 -5.736 -3.802 1678 H LYS 17 H LYS 17 17.301 -2.487 -9.826 1679 HA LYS 17 HA LYS 17 19.163 -0.505 -10.729 1680 HB2 LYS 17 2HB LYS 17 19.016 -1.738 -12.962 1681 HB3 LYS 17 1HB LYS 17 19.632 -2.627 -11.540 1682 HG2 LYS 17 2HG LYS 17 17.315 -3.618 -11.196 1683 HG3 LYS 17 1HG LYS 17 16.831 -2.980 -12.788 1684 HD2 LYS 17 2HD LYS 17 19.322 -4.757 -12.324 1685 HD3 LYS 17 1HD LYS 17 17.697 -5.480 -12.463 1686 HE2 LYS 17 2HE LYS 17 18.925 -3.695 -14.671 1687 HE3 LYS 17 1HE LYS 17 19.067 -5.496 -14.616 1688 HZ1 LYS 17 3HZ LYS 17 17.290 -4.833 -16.017 1689 HZ2 LYS 17 1HZ LYS 17 16.472 -3.993 -14.772 1690 HZ3 LYS 17 2HZ LYS 17 16.593 -5.609 -14.650 1691 H VAL 18 H VAL 18 15.644 -0.958 -11.040 1692 HA VAL 18 HA VAL 18 15.346 0.919 -13.132 1693 HB VAL 18 HB VAL 18 13.410 -0.178 -11.056 1694 HG11 VAL 18 1HG1 VAL 18 12.838 1.755 -13.411 1695 HG12 VAL 18 2HG1 VAL 18 12.533 2.067 -11.659 1696 HG13 VAL 18 3HG1 VAL 18 11.584 0.816 -12.524 1697 HG21 VAL 18 3HG2 VAL 18 12.573 -1.464 -13.019 1698 HG22 VAL 18 1HG2 VAL 18 14.339 -1.734 -12.882 1699 HG23 VAL 18 2HG2 VAL 18 13.709 -0.601 -14.118 1700 H LEU 19 H LEU 19 15.562 1.239 -9.571 1701 HA LEU 19 HA LEU 19 14.815 3.908 -9.369 1702 HB2 LEU 19 2HB LEU 19 17.108 2.580 -7.791 1703 HB3 LEU 19 1HB LEU 19 16.226 4.069 -7.336 1704 HG LEU 19 HG LEU 19 15.145 1.205 -7.408 1705 HD11 LEU 19 1HD1 LEU 19 15.629 3.132 -5.060 1706 HD12 LEU 19 2HD1 LEU 19 16.631 1.695 -5.491 1707 HD13 LEU 19 3HD1 LEU 19 14.924 1.475 -4.949 1708 HD21 LEU 19 3HD2 LEU 19 13.602 3.777 -6.686 1709 HD22 LEU 19 1HD2 LEU 19 13.043 2.083 -6.427 1710 HD23 LEU 19 2HD2 LEU 19 13.285 2.691 -8.098 1711 H GLU 20 H GLU 20 17.948 2.455 -10.327 1712 HA GLU 20 HA GLU 20 19.418 4.846 -10.199 1713 HB2 GLU 20 2HB GLU 20 19.941 2.421 -12.031 1714 HB3 GLU 20 1HB GLU 20 21.058 3.796 -11.738 1715 HG2 GLU 20 2HG GLU 20 20.992 3.181 -9.232 1716 HG3 GLU 20 1HG GLU 20 20.150 1.657 -9.704 1717 H GLU 21 H GLU 21 17.636 3.254 -12.923 1718 HA GLU 21 HA GLU 21 18.276 5.308 -14.767 1719 HB2 GLU 21 2HB GLU 21 15.840 3.419 -14.782 1720 HB3 GLU 21 1HB GLU 21 16.283 4.574 -16.079 1721 HG2 GLU 21 2HG GLU 21 18.679 3.142 -15.788 1722 HG3 GLU 21 1HG GLU 21 17.448 1.874 -15.438 1723 H ALA 22 H ALA 22 15.624 4.833 -12.442 1724 HA ALA 22 HA ALA 22 13.962 6.877 -13.232 1725 HB1 ALA 22 1HB ALA 22 13.084 6.873 -10.889 1726 HB2 ALA 22 2HB ALA 22 14.519 5.946 -10.346 1727 HB3 ALA 22 3HB ALA 22 13.344 5.187 -11.475 1728 H SER 23 H SER 23 16.871 7.032 -11.139 1729 HA SER 23 HA SER 23 16.493 9.656 -10.312 1730 HB2 SER 23 2HB SER 23 18.849 9.725 -9.672 1731 HB3 SER 23 1HB SER 23 18.134 8.136 -9.238 1732 HG SER 23 1HG SER 23 19.128 7.277 -11.154 1733 H LYS 24 H LYS 24 18.065 8.369 -13.211 1734 HA LYS 24 HA LYS 24 19.065 10.817 -14.213 1735 HB2 LYS 24 2HB LYS 24 19.991 8.650 -14.933 1736 HB3 LYS 24 1HB LYS 24 18.412 8.121 -15.585 1737 HG2 LYS 24 2HG LYS 24 19.873 10.582 -16.715 1738 HG3 LYS 24 1HG LYS 24 20.319 8.914 -17.194 1739 HD2 LYS 24 2HD LYS 24 17.985 8.476 -17.994 1740 HD3 LYS 24 1HD LYS 24 17.535 10.172 -17.585 1741 HE2 LYS 24 2HE LYS 24 19.334 11.005 -19.164 1742 HE3 LYS 24 1HE LYS 24 19.586 9.302 -19.721 1743 HZ1 LYS 24 3HZ LYS 24 17.002 10.832 -19.828 1744 HZ2 LYS 24 1HZ LYS 24 17.269 9.301 -20.518 1745 HZ3 LYS 24 2HZ LYS 24 18.101 10.673 -21.081 1746 H LYS 25 H LYS 25 16.126 8.832 -14.876 1747 HA LYS 25 HA LYS 25 15.165 10.617 -16.830 1748 HB2 LYS 25 2HB LYS 25 13.528 8.649 -15.131 1749 HB3 LYS 25 1HB LYS 25 12.962 9.507 -16.611 1750 HG2 LYS 25 2HG LYS 25 14.723 8.347 -17.968 1751 HG3 LYS 25 1HG LYS 25 15.209 7.412 -16.516 1752 HD2 LYS 25 2HD LYS 25 12.758 6.593 -16.364 1753 HD3 LYS 25 1HD LYS 25 12.498 7.354 -17.976 1754 HE2 LYS 25 2HE LYS 25 14.382 5.873 -18.904 1755 HE3 LYS 25 1HE LYS 25 14.503 5.084 -17.286 1756 HZ1 LYS 25 3HZ LYS 25 12.199 5.025 -19.181 1757 HZ2 LYS 25 1HZ LYS 25 12.082 4.446 -17.607 1758 HZ3 LYS 25 2HZ LYS 25 13.240 3.754 -18.665 1759 H ALA 26 H ALA 26 14.522 10.397 -13.280 1760 HA ALA 26 HA ALA 26 12.465 12.315 -13.319 1761 HB1 ALA 26 1HB ALA 26 14.326 11.550 -10.982 1762 HB2 ALA 26 2HB ALA 26 12.775 10.729 -11.395 1763 HB3 ALA 26 3HB ALA 26 12.759 12.447 -10.860 1764 H VAL 27 H VAL 27 16.062 12.622 -12.694 1765 HA VAL 27 HA VAL 27 15.758 15.343 -12.051 1766 HB VAL 27 HB VAL 27 17.761 13.922 -11.467 1767 HG11 VAL 27 1HG1 VAL 27 18.326 12.921 -13.652 1768 HG12 VAL 27 2HG1 VAL 27 19.688 13.947 -13.082 1769 HG13 VAL 27 3HG1 VAL 27 18.628 14.541 -14.381 1770 HG21 VAL 27 3HG2 VAL 27 17.660 16.320 -11.058 1771 HG22 VAL 27 1HG2 VAL 27 18.171 16.703 -12.753 1772 HG23 VAL 27 2HG2 VAL 27 19.315 15.884 -11.634 1773 H GLU 28 H GLU 28 16.174 13.628 -15.101 1774 HA GLU 28 HA GLU 28 16.729 15.860 -16.735 1775 HB2 GLU 28 2HB GLU 28 17.212 13.440 -17.338 1776 HB3 GLU 28 1HB GLU 28 15.450 13.124 -17.358 1777 HG2 GLU 28 2HG GLU 28 15.220 14.716 -19.328 1778 HG3 GLU 28 1HG GLU 28 17.005 14.952 -19.314 1779 H ALA 29 H ALA 29 13.803 14.314 -15.484 1780 HA ALA 29 HA ALA 29 11.975 15.177 -17.337 1781 HB1 ALA 29 1HB ALA 29 11.448 14.786 -14.312 1782 HB2 ALA 29 2HB ALA 29 11.532 13.446 -15.511 1783 HB3 ALA 29 3HB ALA 29 10.252 14.694 -15.648 1784 H GLU 30 H GLU 30 12.832 16.653 -14.168 1785 HA GLU 30 HA GLU 30 11.210 18.927 -14.688 1786 HB2 GLU 30 2HB GLU 30 13.261 18.207 -12.562 1787 HB3 GLU 30 1HB GLU 30 12.690 19.908 -12.722 1788 HG2 GLU 30 2HG GLU 30 11.251 18.889 -11.071 1789 HG3 GLU 30 1HG GLU 30 10.309 19.107 -12.590 1790 H ARG 31 H ARG 31 14.340 18.085 -15.930 1791 HA ARG 31 HA ARG 31 14.975 20.938 -16.299 1792 HB2 ARG 31 2HB ARG 31 16.651 18.428 -16.714 1793 HB3 ARG 31 1HB ARG 31 17.165 20.083 -17.208 1794 HG2 ARG 31 2HG ARG 31 16.344 19.319 -14.337 1795 HG3 ARG 31 1HG ARG 31 18.036 19.279 -14.903 1796 HD2 ARG 31 2HD ARG 31 16.273 21.862 -14.999 1797 HD3 ARG 31 1HD ARG 31 17.359 21.412 -13.637 1798 HE ARG 31 HE ARG 31 18.770 21.237 -16.185 1799 HH11 ARG 31 1HH2 ARG 31 17.454 23.961 -14.259 1800 HH12 ARG 31 2HH2 ARG 31 18.955 24.300 -13.480 1801 HH21 ARG 31 1HH1 ARG 31 20.892 22.080 -15.542 1802 HH22 ARG 31 2HH1 ARG 31 21.017 23.691 -14.954 1803 H GLY 32 H GLY 32 13.153 21.242 -17.669 1804 HA2 GLY 32 2HA GLY 32 13.680 21.694 -20.185 1805 HA3 GLY 32 1HA GLY 32 13.229 19.935 -20.250 1806 H ALA 33 H ALA 33 11.465 20.217 -17.866 1807 HA ALA 33 HA ALA 33 9.152 21.165 -19.355 1808 HB1 ALA 33 1HB ALA 33 7.873 19.826 -17.594 1809 HB2 ALA 33 2HB ALA 33 9.470 19.356 -16.894 1810 HB3 ALA 33 3HB ALA 33 9.034 18.830 -18.554 1811 HA PRO 34 HA PRO 34 8.880 24.492 -16.468 1812 HB2 PRO 34 2HB PRO 34 6.148 25.125 -16.426 1813 HB3 PRO 34 1HB PRO 34 7.199 25.417 -17.864 1814 HG2 PRO 34 2HG PRO 34 5.383 23.000 -17.333 1815 HG3 PRO 34 1HG PRO 34 5.482 24.012 -18.836 1816 HD2 PRO 34 2HD PRO 34 6.844 21.616 -18.595 1817 HD3 PRO 34 1HD PRO 34 7.606 23.029 -19.449 1818 H GLY 35 H GLY 35 7.983 25.192 -14.306 1819 HA2 GLY 35 2HA GLY 35 7.146 24.822 -12.284 1820 HA3 GLY 35 1HA GLY 35 6.589 23.184 -12.786 1821 H ALA 36 H ALA 36 9.805 23.669 -13.594 1822 HA ALA 36 HA ALA 36 10.680 21.457 -12.448 1823 HB1 ALA 36 1HB ALA 36 11.907 22.765 -14.200 1824 HB2 ALA 36 2HB ALA 36 13.008 22.241 -12.883 1825 HB3 ALA 36 3HB ALA 36 12.424 23.949 -12.952 1826 H ALA 37 H ALA 37 11.111 20.706 -10.424 1827 HA ALA 37 HA ALA 37 11.894 22.647 -8.341 1828 HB1 ALA 37 1HB ALA 37 10.257 21.552 -6.809 1829 HB2 ALA 37 2HB ALA 37 9.743 20.438 -8.137 1830 HB3 ALA 37 3HB ALA 37 9.407 22.203 -8.261 1831 H LEU 38 H LEU 38 12.180 19.319 -9.633 1832 HA LEU 38 HA LEU 38 13.352 18.349 -7.232 1833 HB2 LEU 38 2HB LEU 38 12.090 17.004 -9.037 1834 HB3 LEU 38 1HB LEU 38 13.535 17.081 -10.041 1835 HG LEU 38 HG LEU 38 13.178 15.765 -7.280 1836 HD11 LEU 38 1HD1 LEU 38 12.115 14.580 -9.160 1837 HD12 LEU 38 2HD1 LEU 38 13.544 13.642 -8.578 1838 HD13 LEU 38 3HD1 LEU 38 13.640 14.612 -10.100 1839 HD21 LEU 38 3HD2 LEU 38 15.453 14.750 -7.526 1840 HD22 LEU 38 1HD2 LEU 38 15.562 16.532 -7.357 1841 HD23 LEU 38 2HD2 LEU 38 15.768 15.770 -8.974 1842 H ILE 39 H ILE 39 14.950 18.108 -10.391 1843 HA ILE 39 HA ILE 39 16.865 18.696 -11.183 1844 HB ILE 39 HB ILE 39 16.887 21.066 -9.272 1845 HG12 ILE 39 2HG1 ILE 39 15.573 20.759 -12.051 1846 HG13 ILE 39 1HG1 ILE 39 14.739 20.968 -10.477 1847 HG21 ILE 39 1HG2 ILE 39 18.246 22.170 -11.150 1848 HG22 ILE 39 2HG2 ILE 39 18.358 20.560 -11.952 1849 HG23 ILE 39 3HG2 ILE 39 19.092 20.848 -10.330 1850 HD11 ILE 39 3HD ILE 39 16.471 23.092 -11.884 1851 HD12 ILE 39 1HD ILE 39 14.703 23.117 -11.580 1852 HD13 ILE 39 2HD ILE 39 15.847 23.228 -10.197 1853 H SER 40 H SER 40 19.286 18.744 -10.719 1854 HA SER 40 HA SER 40 21.079 18.280 -9.682 1855 HB2 SER 40 2HB SER 40 20.030 19.420 -7.585 1856 HB3 SER 40 1HB SER 40 19.787 17.762 -6.975 1857 HG SER 40 1HG SER 40 21.664 18.127 -6.250 1858 H TYR 41 H TYR 41 22.111 16.490 -10.241 1859 HA TYR 41 HA TYR 41 20.716 14.040 -10.293 1860 HB2 TYR 41 2HB TYR 41 22.431 14.551 -12.068 1861 HB3 TYR 41 1HB TYR 41 23.733 14.405 -10.823 1862 HD1 TYR 41 1HD TYR 41 20.667 12.515 -12.012 1863 HD2 TYR 41 2HD TYR 41 24.725 12.231 -10.599 1864 HE1 TYR 41 1HE TYR 41 20.503 10.099 -12.068 1865 HE2 TYR 41 2HE TYR 41 24.551 9.777 -10.628 1866 HH TYR 41 HH TYR 41 21.355 8.224 -11.147 1867 HA PRO 42 HA PRO 42 23.525 12.340 -7.026 1868 HB2 PRO 42 2HB PRO 42 24.854 13.891 -5.104 1869 HB3 PRO 42 1HB PRO 42 25.561 13.551 -6.730 1870 HG2 PRO 42 2HG PRO 42 23.912 16.013 -5.893 1871 HG3 PRO 42 1HG PRO 42 25.551 15.982 -6.664 1872 HD2 PRO 42 2HD PRO 42 23.293 16.287 -8.189 1873 HD3 PRO 42 1HD PRO 42 24.616 15.171 -8.779 1874 H ASP 43 H ASP 43 21.301 14.866 -6.510 1875 HA ASP 43 HA ASP 43 20.545 13.990 -3.819 1876 HB2 ASP 43 2HB ASP 43 19.329 16.109 -5.718 1877 HB3 ASP 43 1HB ASP 43 18.695 15.718 -4.081 1878 H ALA 44 H ALA 44 19.657 13.817 -7.270 1879 HA ALA 44 HA ALA 44 17.001 13.170 -6.992 1880 HB1 ALA 44 1HB ALA 44 17.123 12.277 -9.342 1881 HB2 ALA 44 2HB ALA 44 18.923 12.343 -9.258 1882 HB3 ALA 44 3HB ALA 44 17.951 13.859 -9.186 1883 H ILE 45 H ILE 45 19.859 11.118 -6.879 1884 HA ILE 45 HA ILE 45 18.607 8.658 -7.165 1885 HB ILE 45 HB ILE 45 20.973 8.990 -7.463 1886 HG12 ILE 45 2HG1 ILE 45 20.376 6.954 -5.226 1887 HG13 ILE 45 1HG1 ILE 45 20.092 6.724 -6.981 1888 HG21 ILE 45 1HG2 ILE 45 22.526 9.373 -5.583 1889 HG22 ILE 45 2HG2 ILE 45 21.173 9.388 -4.401 1890 HG23 ILE 45 3HG2 ILE 45 21.322 10.688 -5.633 1891 HD11 ILE 45 3HD ILE 45 22.834 7.121 -5.602 1892 HD12 ILE 45 1HD ILE 45 22.200 5.617 -6.352 1893 HD13 ILE 45 2HD ILE 45 22.591 7.034 -7.390 1894 H TRP 46 H TRP 46 18.682 10.850 -4.402 1895 HA TRP 46 HA TRP 46 17.917 8.750 -2.546 1896 HB2 TRP 46 2HB TRP 46 19.081 11.416 -2.360 1897 HB3 TRP 46 1HB TRP 46 17.564 11.432 -1.438 1898 HD1 TRP 46 HD TRP 46 18.522 11.504 0.949 1899 HE1 TRP 46 1HE TRP 46 20.437 10.324 2.213 1900 HE3 TRP 46 3HE TRP 46 20.099 8.260 -2.673 1901 HZ2 TRP 46 2HZ TRP 46 21.953 7.922 1.957 1902 HZ3 TRP 46 3HZ TRP 46 21.775 6.571 -2.119 1903 HH2 TRP 46 HH TRP 46 22.698 6.391 0.177 1904 H TRP 47 H TRP 47 16.417 11.035 -4.703 1905 HA TRP 47 HA TRP 47 13.912 11.013 -3.263 1906 HB2 TRP 47 2HB TRP 47 14.688 12.952 -4.777 1907 HB3 TRP 47 1HB TRP 47 14.375 11.883 -6.188 1908 HD1 TRP 47 HD TRP 47 12.408 13.149 -3.005 1909 HE1 TRP 47 1HE TRP 47 9.921 13.296 -3.602 1910 HE3 TRP 47 3HE TRP 47 12.662 11.543 -7.834 1911 HZ2 TRP 47 2HZ TRP 47 8.309 13.141 -5.951 1912 HZ3 TRP 47 3HZ TRP 47 10.606 11.534 -9.213 1913 HH2 TRP 47 HH TRP 47 8.459 12.321 -8.285 1914 H SER 48 H SER 48 15.500 9.347 -6.049 1915 HA SER 48 HA SER 48 13.161 7.837 -6.664 1916 HB2 SER 48 2HB SER 48 14.803 6.503 -8.126 1917 HB3 SER 48 1HB SER 48 14.641 8.257 -8.500 1918 HG SER 48 1HG SER 48 16.641 7.055 -6.893 1919 H VAL 49 H VAL 49 13.266 7.496 -4.079 1920 HA VAL 49 HA VAL 49 14.091 4.695 -3.746 1921 HB VAL 49 HB VAL 49 14.305 6.918 -1.614 1922 HG11 VAL 49 1HG1 VAL 49 14.834 3.862 -1.461 1923 HG12 VAL 49 2HG1 VAL 49 13.494 4.740 -0.637 1924 HG13 VAL 49 3HG1 VAL 49 15.196 5.057 -0.161 1925 HG21 VAL 49 3HG2 VAL 49 16.186 6.999 -3.234 1926 HG22 VAL 49 1HG2 VAL 49 16.466 5.234 -3.050 1927 HG23 VAL 49 2HG2 VAL 49 16.753 6.353 -1.661 1928 H GLU 50 H GLU 50 12.285 7.394 -2.083 1929 HA GLU 50 HA GLU 50 10.473 5.600 -1.059 1930 HB2 GLU 50 2HB GLU 50 9.198 7.575 -0.246 1931 HB3 GLU 50 1HB GLU 50 10.938 7.581 0.147 1932 HG2 GLU 50 2HG GLU 50 11.345 9.225 -1.772 1933 HG3 GLU 50 1HG GLU 50 9.560 9.263 -2.054 1934 H THR 51 H THR 51 10.493 7.091 -4.136 1935 HA THR 51 HA THR 51 7.735 7.129 -4.632 1936 HB THR 51 HB THR 51 9.341 8.550 -5.792 1937 HG1 THR 51 1HG THR 51 7.489 8.029 -6.947 1938 HG21 THR 51 3HG2 THR 51 10.437 5.957 -7.081 1939 HG22 THR 51 1HG2 THR 51 11.294 6.965 -5.855 1940 HG23 THR 51 2HG2 THR 51 10.923 7.642 -7.478 1941 H ALA 52 H ALA 52 10.190 4.524 -4.852 1942 HA ALA 52 HA ALA 52 8.501 2.847 -6.473 1943 HB1 ALA 52 1HB ALA 52 10.192 1.063 -5.889 1944 HB2 ALA 52 2HB ALA 52 11.027 2.241 -4.809 1945 HB3 ALA 52 3HB ALA 52 10.941 2.536 -6.594 1946 H THR 53 H THR 53 8.898 3.569 -3.026 1947 HA THR 53 HA THR 53 7.369 1.212 -2.294 1948 HB THR 53 HB THR 53 7.760 2.292 0.055 1949 HG1 THR 53 1HG THR 53 8.474 4.292 -0.766 1950 HG21 THR 53 3HG2 THR 53 8.901 0.234 -0.834 1951 HG22 THR 53 1HG2 THR 53 10.043 1.268 0.101 1952 HG23 THR 53 2HG2 THR 53 10.103 1.263 -1.703 1953 H THR 54 H THR 54 6.429 3.797 -3.865 1954 HA THR 54 HA THR 54 4.626 4.953 -4.051 1955 HB THR 54 HB THR 54 3.897 2.862 -4.831 1956 HG1 THR 54 1HG THR 54 1.920 4.049 -3.206 1957 HG21 THR 54 3HG2 THR 54 2.601 1.226 -3.405 1958 HG22 THR 54 1HG2 THR 54 3.114 2.144 -1.938 1959 HG23 THR 54 2HG2 THR 54 4.340 1.328 -2.983 1960 H VAL 55 H VAL 55 5.634 6.271 -2.128 1961 HA VAL 55 HA VAL 55 3.367 7.093 -0.608 1962 HB VAL 55 HB VAL 55 4.837 7.493 1.435 1963 HG11 VAL 55 1HG1 VAL 55 3.169 5.639 1.364 1964 HG12 VAL 55 2HG1 VAL 55 4.594 5.231 2.380 1965 HG13 VAL 55 3HG1 VAL 55 4.425 4.514 0.733 1966 HG21 VAL 55 3HG2 VAL 55 7.092 7.193 0.250 1967 HG22 VAL 55 1HG2 VAL 55 6.730 5.435 0.068 1968 HG23 VAL 55 2HG2 VAL 55 6.924 6.159 1.705 1969 H GLY 56 H GLY 56 4.839 9.302 0.448 1970 HA2 GLY 56 2HA GLY 56 6.986 10.160 -1.053 1971 HA3 GLY 56 1HA GLY 56 5.399 10.780 -1.750 1972 H TYR 57 H TYR 57 7.711 11.180 0.811 1973 HA TYR 57 HA TYR 57 5.612 11.910 2.725 1974 HB2 TYR 57 2HB TYR 57 8.684 11.777 2.945 1975 HB3 TYR 57 1HB TYR 57 7.616 12.421 4.253 1976 HD1 TYR 57 1HD TYR 57 6.088 9.511 2.485 1977 HD2 TYR 57 2HD TYR 57 8.770 10.730 5.640 1978 HE1 TYR 57 1HE TYR 57 5.782 7.385 3.548 1979 HE2 TYR 57 2HE TYR 57 8.425 8.545 6.740 1980 HH TYR 57 HH TYR 57 5.919 6.332 5.534 1981 H GLY 58 H GLY 58 7.158 13.440 0.192 1982 HA2 GLY 58 2HA GLY 58 6.494 15.567 -0.416 1983 HA3 GLY 58 1HA GLY 58 6.321 16.028 1.309 1984 H ASP 59 H ASP 59 9.075 14.454 -0.398 1985 HA ASP 59 HA ASP 59 10.894 16.302 0.845 1986 HB2 ASP 59 2HB ASP 59 11.338 13.773 0.164 1987 HB3 ASP 59 1HB ASP 59 11.556 14.379 -1.484 1988 H ARG 60 H ARG 60 9.628 15.596 -2.479 1989 HA ARG 60 HA ARG 60 10.302 18.237 -3.375 1990 HB2 ARG 60 2HB ARG 60 11.281 15.753 -4.939 1991 HB3 ARG 60 1HB ARG 60 11.520 17.475 -5.410 1992 HG2 ARG 60 2HG ARG 60 13.007 17.802 -3.403 1993 HG3 ARG 60 1HG ARG 60 12.622 16.133 -2.885 1994 HD2 ARG 60 2HD ARG 60 13.745 15.287 -5.062 1995 HD3 ARG 60 1HD ARG 60 14.477 16.946 -5.194 1996 HE ARG 60 HE ARG 60 14.571 15.151 -2.750 1997 HH11 ARG 60 1HH2 ARG 60 16.382 17.739 -4.528 1998 HH12 ARG 60 2HH2 ARG 60 16.915 18.411 -3.031 1999 HH21 ARG 60 1HH1 ARG 60 15.397 15.933 -0.994 2000 HH22 ARG 60 2HH1 ARG 60 16.641 17.152 -0.949 2001 H TYR 61 H TYR 61 9.351 17.896 -6.075 2002 HA TYR 61 HA TYR 61 7.051 16.198 -5.846 2003 HB2 TYR 61 2HB TYR 61 6.796 19.260 -6.291 2004 HB3 TYR 61 1HB TYR 61 5.474 18.066 -6.570 2005 HD1 TYR 61 2HD TYR 61 4.577 16.734 -4.623 2006 HD2 TYR 61 1HD TYR 61 7.361 19.958 -4.032 2007 HE1 TYR 61 2HE TYR 61 4.049 16.749 -2.221 2008 HE2 TYR 61 1HE TYR 61 6.847 19.969 -1.627 2009 HH TYR 61 HH TYR 61 4.504 17.631 -0.196 2010 HA PRO 62 HA PRO 62 8.599 16.372 -10.087 2011 HB2 PRO 62 2HB PRO 62 6.806 14.660 -11.327 2012 HB3 PRO 62 1HB PRO 62 7.976 14.045 -10.098 2013 HG2 PRO 62 2HG PRO 62 5.022 14.817 -9.714 2014 HG3 PRO 62 1HG PRO 62 5.852 13.304 -9.156 2015 HD2 PRO 62 2HD PRO 62 5.458 15.578 -7.551 2016 HD3 PRO 62 1HD PRO 62 6.888 14.465 -7.335 2017 H VAL 63 H VAL 63 7.812 17.061 -12.333 2018 HA VAL 63 HA VAL 63 5.575 18.940 -12.017 2019 HB VAL 63 HB VAL 63 6.379 20.101 -13.980 2020 HG11 VAL 63 1HG1 VAL 63 7.192 20.694 -11.764 2021 HG12 VAL 63 2HG1 VAL 63 8.544 20.790 -12.959 2022 HG13 VAL 63 3HG1 VAL 63 8.453 19.422 -11.796 2023 HG21 VAL 63 3HG2 VAL 63 8.555 19.435 -15.004 2024 HG22 VAL 63 1HG2 VAL 63 7.278 18.214 -15.348 2025 HG23 VAL 63 2HG2 VAL 63 8.544 17.882 -14.113 2026 H THR 64 H THR 64 4.629 19.414 -14.430 2027 HA THR 64 HA THR 64 2.848 17.224 -14.595 2028 HB THR 64 HB THR 64 2.797 19.882 -16.123 2029 HG1 THR 64 1HG THR 64 1.974 19.317 -13.467 2030 HG21 THR 64 3HG2 THR 64 0.329 19.656 -15.892 2031 HG22 THR 64 1HG2 THR 64 0.510 18.118 -14.984 2032 HG23 THR 64 2HG2 THR 64 0.993 18.203 -16.718 2033 H GLU 65 H GLU 65 4.667 19.114 -17.136 2034 HA GLU 65 HA GLU 65 3.710 17.581 -19.188 2035 HB2 GLU 65 2HB GLU 65 4.734 19.882 -19.316 2036 HB3 GLU 65 1HB GLU 65 6.363 19.134 -19.228 2037 HG2 GLU 65 2HG GLU 65 6.026 18.004 -21.385 2038 HG3 GLU 65 1HG GLU 65 4.279 18.448 -21.409 2039 H GLU 66 H GLU 66 6.617 17.052 -17.197 2040 HA GLU 66 HA GLU 66 6.933 14.463 -18.556 2041 HB2 GLU 66 2HB GLU 66 9.220 16.158 -17.412 2042 HB3 GLU 66 1HB GLU 66 9.308 14.425 -17.861 2043 HG2 GLU 66 2HG GLU 66 8.333 15.313 -20.213 2044 HG3 GLU 66 1HG GLU 66 9.065 16.867 -19.681 2045 H GLY 67 H GLY 67 8.210 15.860 -15.496 2046 HA2 GLY 67 2HA GLY 67 8.812 13.990 -14.008 2047 HA3 GLY 67 1HA GLY 67 7.764 15.287 -13.375 2048 H ARG 68 H ARG 68 5.291 14.666 -14.064 2049 HA ARG 68 HA ARG 68 4.506 12.663 -12.395 2050 HB2 ARG 68 2HB ARG 68 3.071 14.550 -13.212 2051 HB3 ARG 68 1HB ARG 68 3.042 13.834 -14.848 2052 HG2 ARG 68 2HG ARG 68 0.921 13.440 -13.587 2053 HG3 ARG 68 1HG ARG 68 1.709 11.920 -14.091 2054 HD2 ARG 68 2HD ARG 68 0.759 11.852 -11.730 2055 HD3 ARG 68 1HD ARG 68 2.540 11.503 -11.795 2056 HE ARG 68 HE ARG 68 1.726 14.345 -11.373 2057 HH11 ARG 68 1HH2 ARG 68 2.834 11.333 -9.694 2058 HH12 ARG 68 2HH2 ARG 68 2.305 11.904 -8.162 2059 HH21 ARG 68 1HH1 ARG 68 1.361 15.180 -9.263 2060 HH22 ARG 68 2HH1 ARG 68 1.376 14.087 -7.937 2061 H LYS 69 H LYS 69 4.966 12.485 -15.947 2062 HA LYS 69 HA LYS 69 3.872 9.829 -16.113 2063 HB2 LYS 69 2HB LYS 69 3.658 11.462 -18.019 2064 HB3 LYS 69 1HB LYS 69 5.442 11.518 -18.157 2065 HG2 LYS 69 2HG LYS 69 4.477 10.135 -19.919 2066 HG3 LYS 69 1HG LYS 69 5.487 9.114 -18.842 2067 HD2 LYS 69 2HD LYS 69 3.417 8.228 -17.722 2068 HD3 LYS 69 1HD LYS 69 2.413 9.351 -18.696 2069 HE2 LYS 69 2HE LYS 69 2.224 7.131 -19.642 2070 HE3 LYS 69 1HE LYS 69 3.129 8.153 -20.812 2071 HZ1 LYS 69 3HZ LYS 69 5.167 7.102 -20.106 2072 HZ2 LYS 69 1HZ LYS 69 4.050 5.895 -20.503 2073 HZ3 LYS 69 2HZ LYS 69 4.385 6.197 -18.909 2074 H VAL 70 H VAL 70 6.967 11.415 -15.632 2075 HA VAL 70 HA VAL 70 8.542 9.106 -16.251 2076 HB VAL 70 HB VAL 70 9.160 11.669 -14.693 2077 HG11 VAL 70 1HG1 VAL 70 11.553 10.970 -15.085 2078 HG12 VAL 70 2HG1 VAL 70 10.973 9.345 -15.625 2079 HG13 VAL 70 3HG1 VAL 70 10.705 9.896 -13.926 2080 HG21 VAL 70 3HG2 VAL 70 8.601 12.031 -17.116 2081 HG22 VAL 70 1HG2 VAL 70 9.730 10.711 -17.591 2082 HG23 VAL 70 2HG2 VAL 70 10.367 12.223 -16.867 2083 H ALA 71 H ALA 71 7.437 10.699 -13.210 2084 HA ALA 71 HA ALA 71 8.465 8.780 -11.491 2085 HB1 ALA 71 1HB ALA 71 6.031 10.628 -11.072 2086 HB2 ALA 71 2HB ALA 71 7.745 11.067 -10.736 2087 HB3 ALA 71 3HB ALA 71 6.947 9.772 -9.771 2088 H GLU 72 H GLU 72 5.204 8.968 -13.106 2089 HA GLU 72 HA GLU 72 4.071 7.023 -11.516 2090 HB2 GLU 72 2HB GLU 72 2.239 6.761 -12.995 2091 HB3 GLU 72 1HB GLU 72 2.718 8.479 -12.999 2092 HG2 GLU 72 2HG GLU 72 2.450 8.288 -15.250 2093 HG3 GLU 72 1HG GLU 72 4.132 7.655 -15.203 2094 H GLN 73 H GLN 73 6.158 6.637 -14.310 2095 HA GLN 73 HA GLN 73 5.755 3.889 -14.714 2096 HB2 GLN 73 2HB GLN 73 6.938 5.443 -16.324 2097 HB3 GLN 73 1HB GLN 73 8.270 5.634 -15.142 2098 HG2 GLN 73 2HG GLN 73 8.824 3.172 -15.366 2099 HG3 GLN 73 1HG GLN 73 7.520 3.006 -16.596 2100 HE21 GLN 73 1HE2 GLN 73 7.695 4.583 -18.510 2101 HE22 GLN 73 2HE2 GLN 73 9.287 4.968 -19.108 2102 H VAL 74 H VAL 74 7.904 5.772 -12.566 2103 HA VAL 74 HA VAL 74 9.507 3.560 -11.812 2104 HB VAL 74 HB VAL 74 9.141 6.266 -10.417 2105 HG11 VAL 74 1HG1 VAL 74 11.406 4.146 -10.266 2106 HG12 VAL 74 2HG1 VAL 74 10.250 4.558 -8.948 2107 HG13 VAL 74 3HG1 VAL 74 11.440 5.781 -9.498 2108 HG21 VAL 74 3HG2 VAL 74 11.118 6.976 -11.759 2109 HG22 VAL 74 1HG2 VAL 74 9.811 6.475 -12.862 2110 HG23 VAL 74 2HG2 VAL 74 11.184 5.361 -12.570 2111 H MET 75 H MET 75 6.759 5.321 -10.308 2112 HA MET 75 HA MET 75 6.621 3.921 -7.909 2113 HB2 MET 75 2HB MET 75 4.414 5.152 -9.679 2114 HB3 MET 75 1HB MET 75 4.061 4.433 -8.073 2115 HG2 MET 75 2HG MET 75 4.717 6.222 -6.933 2116 HG3 MET 75 1HG MET 75 6.278 6.252 -7.770 2117 HE1 MET 75 3HE MET 75 2.648 8.387 -9.908 2118 HE2 MET 75 1HE MET 75 2.368 7.992 -8.190 2119 HE3 MET 75 2HE MET 75 2.658 6.676 -9.380 2120 H LYS 76 H LYS 76 5.104 3.248 -11.041 2121 HA LYS 76 HA LYS 76 3.571 1.067 -10.327 2122 HB2 LYS 76 2HB LYS 76 3.533 2.634 -12.325 2123 HB3 LYS 76 1HB LYS 76 4.876 1.697 -13.051 2124 HG2 LYS 76 2HG LYS 76 3.360 -0.296 -13.196 2125 HG3 LYS 76 1HG LYS 76 2.040 0.627 -12.394 2126 HD2 LYS 76 2HD LYS 76 3.413 1.408 -15.044 2127 HD3 LYS 76 1HD LYS 76 1.850 0.525 -14.939 2128 HE2 LYS 76 2HE LYS 76 0.699 2.453 -13.954 2129 HE3 LYS 76 1HE LYS 76 2.244 3.347 -13.699 2130 HZ1 LYS 76 3HZ LYS 76 1.182 4.238 -15.540 2131 HZ2 LYS 76 1HZ LYS 76 1.032 2.723 -16.360 2132 HZ3 LYS 76 2HZ LYS 76 2.539 3.507 -16.052 2133 H ALA 77 H ALA 77 6.988 1.282 -11.274 2134 HA ALA 77 HA ALA 77 7.366 -1.434 -11.884 2135 HB1 ALA 77 1HB ALA 77 9.417 0.600 -10.794 2136 HB2 ALA 77 2HB ALA 77 9.021 0.352 -12.535 2137 HB3 ALA 77 3HB ALA 77 9.809 -0.969 -11.591 2138 H GLY 78 H GLY 78 7.263 0.349 -8.821 2139 HA2 GLY 78 2HA GLY 78 8.474 -1.703 -7.244 2140 HA3 GLY 78 1HA GLY 78 7.451 -0.310 -6.706 2141 H ILE 79 H ILE 79 5.148 -0.795 -8.177 2142 HA ILE 79 HA ILE 79 3.852 -2.630 -6.545 2143 HB ILE 79 HB ILE 79 2.841 -1.640 -9.252 2144 HG12 ILE 79 2HG1 ILE 79 3.606 0.353 -8.057 2145 HG13 ILE 79 1HG1 ILE 79 1.828 0.272 -8.056 2146 HG21 ILE 79 1HG2 ILE 79 1.408 -2.537 -6.652 2147 HG22 ILE 79 2HG2 ILE 79 1.440 -3.423 -8.217 2148 HG23 ILE 79 3HG2 ILE 79 0.597 -1.838 -8.100 2149 HD11 ILE 79 3HD ILE 79 3.667 -0.399 -5.656 2150 HD12 ILE 79 1HD ILE 79 2.615 1.045 -5.869 2151 HD13 ILE 79 2HD ILE 79 1.870 -0.573 -5.666 2152 H GLU 80 H GLU 80 5.050 -2.928 -9.943 2153 HA GLU 80 HA GLU 80 4.129 -5.471 -10.542 2154 HB2 GLU 80 2HB GLU 80 6.968 -4.345 -11.153 2155 HB3 GLU 80 1HB GLU 80 6.300 -5.860 -11.844 2156 HG2 GLU 80 2HG GLU 80 4.601 -4.521 -13.109 2157 HG3 GLU 80 1HG GLU 80 5.359 -3.006 -12.482 2158 H VAL 81 H VAL 81 7.221 -4.531 -9.030 2159 HA VAL 81 HA VAL 81 8.231 -7.118 -8.790 2160 HB VAL 81 HB VAL 81 8.917 -4.415 -7.545 2161 HG11 VAL 81 1HG1 VAL 81 11.122 -5.512 -6.815 2162 HG12 VAL 81 2HG1 VAL 81 10.348 -7.113 -7.085 2163 HG13 VAL 81 3HG1 VAL 81 9.695 -5.987 -5.840 2164 HG21 VAL 81 3HG2 VAL 81 10.290 -6.223 -9.661 2165 HG22 VAL 81 1HG2 VAL 81 10.837 -4.586 -9.153 2166 HG23 VAL 81 2HG2 VAL 81 9.280 -4.776 -10.024 2167 H PHE 82 H PHE 82 6.662 -4.944 -6.354 2168 HA PHE 82 HA PHE 82 6.940 -6.883 -4.303 2169 HB2 PHE 82 2HB PHE 82 5.053 -4.448 -4.497 2170 HB3 PHE 82 1HB PHE 82 5.264 -5.453 -3.014 2171 HD1 PHE 82 2HD PHE 82 8.126 -5.894 -2.731 2172 HD2 PHE 82 1HD PHE 82 6.032 -2.380 -4.069 2173 HE1 PHE 82 2HE PHE 82 10.004 -4.486 -1.984 2174 HE2 PHE 82 1HE PHE 82 7.913 -0.976 -3.321 2175 HZ PHE 82 HZ PHE 82 9.909 -2.019 -2.275 2176 H ALA 83 H ALA 83 4.496 -6.421 -6.844 2177 HA ALA 83 HA ALA 83 2.549 -8.001 -5.475 2178 HB1 ALA 83 1HB ALA 83 1.842 -6.429 -7.278 2179 HB2 ALA 83 2HB ALA 83 1.369 -8.115 -7.680 2180 HB3 ALA 83 3HB ALA 83 2.806 -7.362 -8.480 2181 H LEU 84 H LEU 84 5.117 -8.602 -7.855 2182 HA LEU 84 HA LEU 84 4.402 -11.151 -8.636 2183 HB2 LEU 84 2HB LEU 84 6.075 -9.589 -9.686 2184 HB3 LEU 84 1HB LEU 84 7.248 -9.973 -8.399 2185 HG LEU 84 HG LEU 84 6.045 -12.197 -10.143 2186 HD11 LEU 84 1HD1 LEU 84 8.386 -10.374 -10.995 2187 HD12 LEU 84 2HD1 LEU 84 6.744 -10.424 -11.738 2188 HD13 LEU 84 3HD1 LEU 84 7.821 -11.860 -11.852 2189 HD21 LEU 84 3HD2 LEU 84 8.329 -13.241 -9.885 2190 HD22 LEU 84 1HD2 LEU 84 7.531 -12.985 -8.302 2191 HD23 LEU 84 2HD2 LEU 84 8.835 -11.867 -8.838 2192 H VAL 85 H VAL 85 6.278 -10.099 -5.767 2193 HA VAL 85 HA VAL 85 7.408 -12.616 -5.338 2194 HB VAL 85 HB VAL 85 8.120 -11.815 -3.121 2195 HG11 VAL 85 1HG1 VAL 85 9.627 -10.079 -4.049 2196 HG12 VAL 85 2HG1 VAL 85 8.537 -9.810 -5.451 2197 HG13 VAL 85 3HG1 VAL 85 9.392 -11.374 -5.272 2198 HG21 VAL 85 3HG2 VAL 85 6.039 -10.352 -2.663 2199 HG22 VAL 85 1HG2 VAL 85 6.658 -9.211 -3.909 2200 HG23 VAL 85 2HG2 VAL 85 7.608 -9.506 -2.419 2201 H THR 86 H THR 86 4.187 -11.979 -5.001 2202 HA THR 86 HA THR 86 3.497 -12.930 -2.565 2203 HB THR 86 HB THR 86 1.890 -13.105 -5.151 2204 HG1 THR 86 1HG THR 86 2.297 -11.016 -4.950 2205 HG21 THR 86 3HG2 THR 86 0.788 -14.347 -3.226 2206 HG22 THR 86 1HG2 THR 86 -0.061 -12.801 -3.574 2207 HG23 THR 86 2HG2 THR 86 1.047 -12.912 -2.162 2208 H ALA 87 H ALA 87 4.630 -14.931 -5.239 2209 HA ALA 87 HA ALA 87 3.380 -17.314 -4.356 2210 HB1 ALA 87 1HB ALA 87 5.071 -18.528 -5.738 2211 HB2 ALA 87 2HB ALA 87 6.038 -17.007 -5.892 2212 HB3 ALA 87 3HB ALA 87 4.404 -17.123 -6.635 2213 H ALA 88 H ALA 88 6.397 -15.689 -3.405 2214 HA ALA 88 HA ALA 88 7.446 -17.895 -1.949 2215 HB1 ALA 88 1HB ALA 88 9.018 -16.182 -0.939 2216 HB2 ALA 88 2HB ALA 88 8.057 -14.871 -1.709 2217 HB3 ALA 88 3HB ALA 88 8.974 -16.027 -2.737 2218 H LEU 89 H LEU 89 5.484 -15.003 -1.239 2219 HA LEU 89 HA LEU 89 5.375 -15.541 1.529 2220 HB2 LEU 89 2HB LEU 89 3.498 -13.819 -0.208 2221 HB3 LEU 89 1HB LEU 89 3.399 -13.974 1.573 2222 HG LEU 89 HG LEU 89 4.413 -11.939 1.181 2223 HD11 LEU 89 1HD1 LEU 89 6.519 -12.061 2.398 2224 HD12 LEU 89 2HD1 LEU 89 6.769 -13.782 1.933 2225 HD13 LEU 89 3HD1 LEU 89 5.406 -13.332 3.024 2226 HD21 LEU 89 3HD2 LEU 89 5.184 -12.170 -1.160 2227 HD22 LEU 89 1HD2 LEU 89 6.591 -13.167 -0.618 2228 HD23 LEU 89 2HD2 LEU 89 6.444 -11.454 -0.101 2229 H ALA 90 H ALA 90 3.116 -16.326 -1.176 2230 HA ALA 90 HA ALA 90 1.172 -17.211 0.676 2231 HB1 ALA 90 1HB ALA 90 -0.111 -17.978 -1.290 2232 HB2 ALA 90 2HB ALA 90 1.354 -17.751 -2.323 2233 HB3 ALA 90 3HB ALA 90 0.560 -16.329 -1.558 2234 H THR 91 H THR 91 3.565 -19.029 -1.353 2235 HA THR 91 HA THR 91 2.295 -21.501 -0.675 2236 HB THR 91 HB THR 91 4.352 -22.652 -1.509 2237 HG1 THR 91 1HG THR 91 5.064 -19.955 -2.143 2238 HG21 THR 91 3HG2 THR 91 3.009 -20.534 -3.325 2239 HG22 THR 91 1HG2 THR 91 2.374 -22.181 -2.955 2240 HG23 THR 91 2HG2 THR 91 3.897 -21.997 -3.893 2241 H ASP 92 H ASP 92 4.091 -19.369 1.276 2242 HA ASP 92 HA ASP 92 5.293 -21.424 2.835 2243 HB2 ASP 92 2HB ASP 92 5.083 -18.413 3.194 2244 HB3 ASP 92 1HB ASP 92 5.587 -19.468 4.559 2245 H PHE 93 H PHE 93 2.032 -20.586 2.434 2246 HA PHE 93 HA PHE 93 1.207 -21.373 5.045 2247 HB2 PHE 93 2HB PHE 93 -0.957 -21.188 4.383 2248 HB3 PHE 93 1HB PHE 93 -0.225 -20.204 3.094 2249 HD1 PHE 93 1HD PHE 93 -1.635 -23.603 3.907 2250 HD2 PHE 93 2HD PHE 93 -0.696 -20.816 0.776 2251 HE1 PHE 93 1HE PHE 93 -2.897 -24.982 2.291 2252 HE2 PHE 93 2HE PHE 93 -1.962 -22.185 -0.825 2253 HZ PHE 93 HZ PHE 93 -3.070 -24.276 -0.076 2254 H VAL 94 H VAL 94 2.173 -23.070 2.105 2255 HA VAL 94 HA VAL 94 0.737 -25.427 2.553 2256 HB VAL 94 HB VAL 94 3.220 -24.998 0.815 2257 HG11 VAL 94 1HG1 VAL 94 0.959 -27.126 0.752 2258 HG12 VAL 94 2HG1 VAL 94 2.705 -27.427 1.066 2259 HG13 VAL 94 3HG1 VAL 94 2.164 -26.892 -0.560 2260 HG21 VAL 94 3HG2 VAL 94 1.408 -23.315 0.297 2261 HG22 VAL 94 1HG2 VAL 94 0.196 -24.639 0.228 2262 HG23 VAL 94 2HG2 VAL 94 1.500 -24.548 -1.004 2263 H ARG 95 H ARG 95 3.586 -24.162 3.916 2264 HA ARG 95 HA ARG 95 4.996 -26.383 4.764 2265 HB2 ARG 95 2HB ARG 95 4.405 -23.776 6.300 2266 HB3 ARG 95 1HB ARG 95 5.694 -24.956 6.721 2267 HG2 ARG 95 2HG ARG 95 6.851 -24.489 4.563 2268 HG3 ARG 95 1HG ARG 95 5.549 -23.336 4.100 2269 HD2 ARG 95 2HD ARG 95 6.109 -21.892 6.110 2270 HD3 ARG 95 1HD ARG 95 7.423 -23.056 6.550 2271 HE ARG 95 HE ARG 95 7.361 -21.580 3.860 2272 HH11 ARG 95 1HH2 ARG 95 8.978 -21.796 7.057 2273 HH12 ARG 95 2HH2 ARG 95 10.548 -21.515 6.431 2274 HH21 ARG 95 1HH1 ARG 95 9.122 -20.422 3.291 2275 HH22 ARG 95 2HH1 ARG 95 10.592 -20.396 4.208 2276 H ARG 96 H ARG 96 1.837 -25.128 5.871 2277 HA ARG 96 HA ARG 96 1.740 -26.317 8.383 2278 HB2 ARG 96 2HB ARG 96 0.040 -24.649 7.353 2279 HB3 ARG 96 1HB ARG 96 -0.648 -26.031 6.444 2280 HG2 ARG 96 2HG ARG 96 -0.909 -27.133 8.901 2281 HG3 ARG 96 1HG ARG 96 -0.586 -25.473 9.461 2282 HD2 ARG 96 2HD ARG 96 -2.959 -25.560 9.422 2283 HD3 ARG 96 1HD ARG 96 -2.586 -24.759 7.860 2284 HE ARG 96 HE ARG 96 -3.001 -26.869 6.694 2285 HH11 ARG 96 1HH2 ARG 96 -3.945 -27.007 10.196 2286 HH12 ARG 96 2HH2 ARG 96 -5.285 -28.034 9.913 2287 HH21 ARG 96 1HH1 ARG 96 -4.796 -28.508 6.421 2288 HH22 ARG 96 2HH1 ARG 96 -5.716 -28.927 7.766 2289 H GLU 97 H GLU 97 1.085 -27.608 5.123 2290 HA GLU 97 HA GLU 97 -0.235 -29.948 6.024 2291 HB2 GLU 97 2HB GLU 97 1.194 -29.311 3.373 2292 HB3 GLU 97 1HB GLU 97 0.165 -30.754 3.650 2293 HG2 GLU 97 2HG GLU 97 -1.825 -29.270 4.046 2294 HG3 GLU 97 1HG GLU 97 -0.802 -27.811 3.741 2295 H GLU 98 H GLU 98 3.148 -28.991 5.458 2296 HA GLU 98 HA GLU 98 3.971 -31.767 5.840 2297 HB2 GLU 98 2HB GLU 98 5.727 -29.423 4.996 2298 HB3 GLU 98 1HB GLU 98 6.116 -31.179 5.007 2299 HG2 GLU 98 2HG GLU 98 3.897 -31.360 3.471 2300 HG3 GLU 98 1HG GLU 98 4.212 -29.611 3.164 2301 H GLU 99 H GLU 99 3.233 -29.177 7.815 2302 HA GLU 99 HA GLU 99 5.460 -29.297 9.554 2303 HB2 GLU 99 2HB GLU 99 3.979 -27.309 9.430 2304 HB3 GLU 99 1HB GLU 99 2.633 -28.248 10.158 2305 HG2 GLU 99 2HG GLU 99 3.833 -28.471 12.272 2306 HG3 GLU 99 1HG GLU 99 5.379 -27.922 11.528 2307 H ARG 100 H ARG 100 2.424 -31.056 9.232 2308 HA ARG 100 HA ARG 100 2.715 -32.405 11.738 2309 HB2 ARG 100 2HB ARG 100 0.803 -33.732 11.095 2310 HB3 ARG 100 1HB ARG 100 0.504 -32.012 10.698 2311 HG2 ARG 100 2HG ARG 100 1.228 -32.638 8.251 2312 HG3 ARG 100 1HG ARG 100 1.132 -34.345 8.807 2313 HD2 ARG 100 2HD ARG 100 -1.293 -33.655 9.675 2314 HD3 ARG 100 1HD ARG 100 -1.141 -32.254 8.551 2315 HE ARG 100 HE ARG 100 -1.462 -35.155 7.945 2316 HH11 ARG 100 1HH2 ARG 100 -0.038 -32.427 6.160 2317 HH12 ARG 100 2HH2 ARG 100 -1.151 -32.499 4.873 2318 HH21 ARG 100 1HH1 ARG 100 -3.054 -35.213 6.193 2319 HH22 ARG 100 2HH1 ARG 100 -2.969 -34.060 4.941 2320 H ARG 101 H ARG 101 4.171 -32.779 8.630 2321 HA ARG 101 HA ARG 101 4.692 -35.617 8.887 2322 HB2 ARG 101 2HB ARG 101 5.964 -33.473 7.050 2323 HB3 ARG 101 1HB ARG 101 6.290 -35.233 6.969 2324 HG2 ARG 101 2HG ARG 101 3.958 -35.703 6.386 2325 HG3 ARG 101 1HG ARG 101 3.523 -33.958 6.475 2326 HD2 ARG 101 2HD ARG 101 5.038 -33.417 4.573 2327 HD3 ARG 101 1HD ARG 101 5.694 -35.108 4.585 2328 HE ARG 101 HE ARG 101 2.951 -35.475 4.309 2329 HH11 ARG 101 1HH2 ARG 101 5.360 -33.486 2.375 2330 HH12 ARG 101 2HH2 ARG 101 5.010 -34.286 0.921 2331 HH21 ARG 101 1HH1 ARG 101 2.613 -36.595 2.255 2332 HH22 ARG 101 2HH1 ARG 101 3.419 -36.112 0.835 2333 H GLY 102 H GLY 102 6.230 -32.470 9.455 2334 HA2 GLY 102 2HA GLY 102 7.783 -31.934 10.934 2335 HA3 GLY 102 1HA GLY 102 8.024 -33.679 11.340 2336 H HIS 103 H HIS 103 8.117 -32.457 7.981 2337 HA HIS 103 HA HIS 103 10.874 -31.949 8.021 2338 HB2 HIS 103 2HB HIS 103 9.907 -34.331 6.283 2339 HB3 HIS 103 1HB HIS 103 11.512 -33.517 6.172 2340 HD1 HIS 103 1HD HIS 103 9.714 -36.166 8.126 2341 HD2 HIS 103 2HD HIS 103 13.188 -33.798 8.536 2342 HE1 HIS 103 1HE HIS 103 11.083 -37.143 10.013 2343 HE2 HIS 103 2HE HIS 103 13.199 -35.764 10.200 2344 H1 SER 1 H SER 1 -2.760 -18.752 16.569 2345 HA SER 1 HA SER 1 -3.788 -19.856 18.802 2346 HB2 SER 1 2HB SER 1 -5.969 -20.908 17.956 2347 HB3 SER 1 1HB SER 1 -6.083 -19.153 18.336 2348 HG SER 1 1HG SER 1 -6.944 -20.151 16.221 2349 H ALA 2 H ALA 2 -4.318 -20.307 15.345 2350 HA ALA 2 HA ALA 2 -3.315 -22.970 15.341 2351 HB1 ALA 2 1HB ALA 2 -3.737 -22.883 12.853 2352 HB2 ALA 2 2HB ALA 2 -4.007 -21.101 12.975 2353 HB3 ALA 2 3HB ALA 2 -5.142 -22.245 13.771 2354 H ASP 3 H ASP 3 -1.597 -23.715 13.784 2355 HA ASP 3 HA ASP 3 0.766 -22.728 14.618 2356 HB2 ASP 3 2HB ASP 3 0.320 -24.393 12.048 2357 HB3 ASP 3 1HB ASP 3 1.812 -24.346 13.041 2358 H HIS 4 H HIS 4 -0.901 -22.157 11.606 2359 HA HIS 4 HA HIS 4 1.278 -20.678 10.449 2360 HB2 HIS 4 2HB HIS 4 -0.352 -20.124 8.601 2361 HB3 HIS 4 1HB HIS 4 -0.142 -21.870 8.933 2362 HD1 HIS 4 1HD HIS 4 -2.745 -19.107 9.383 2363 HD2 HIS 4 2HD HIS 4 -2.420 -23.275 9.894 2364 HE1 HIS 4 1HE HIS 4 -5.028 -19.965 9.936 2365 HE2 HIS 4 2HE HIS 4 -4.874 -22.470 10.076 2366 H GLU 5 H GLU 5 -1.286 -19.831 12.690 2367 HA GLU 5 HA GLU 5 -1.150 -17.006 11.936 2368 HB2 GLU 5 2HB GLU 5 -3.010 -18.612 13.737 2369 HB3 GLU 5 1HB GLU 5 -2.942 -16.818 13.815 2370 HG2 GLU 5 2HG GLU 5 -3.681 -16.508 11.580 2371 HG3 GLU 5 1HG GLU 5 -3.262 -18.177 11.104 2372 H ARG 6 H ARG 6 0.111 -19.349 14.186 2373 HA ARG 6 HA ARG 6 1.070 -17.683 16.186 2374 HB2 ARG 6 2HB ARG 6 0.911 -20.241 16.104 2375 HB3 ARG 6 1HB ARG 6 2.309 -20.245 14.985 2376 HG2 ARG 6 2HG ARG 6 3.778 -19.372 16.799 2377 HG3 ARG 6 1HG ARG 6 2.361 -19.231 17.892 2378 HD2 ARG 6 2HD ARG 6 3.685 -21.335 18.356 2379 HD3 ARG 6 1HD ARG 6 1.985 -21.680 17.854 2380 HE ARG 6 HE ARG 6 4.301 -21.741 15.890 2381 HH11 ARG 6 1HH2 ARG 6 1.379 -23.466 17.263 2382 HH12 ARG 6 2HH2 ARG 6 1.557 -24.761 16.165 2383 HH21 ARG 6 1HH1 ARG 6 4.386 -23.625 14.399 2384 HH22 ARG 6 2HH1 ARG 6 3.445 -24.964 14.718 2385 H GLU 7 H GLU 7 2.495 -18.718 13.066 2386 HA GLU 7 HA GLU 7 4.957 -17.423 13.383 2387 HB2 GLU 7 2HB GLU 7 4.115 -19.335 11.703 2388 HB3 GLU 7 1HB GLU 7 3.660 -17.956 10.661 2389 HG2 GLU 7 2HG GLU 7 5.768 -18.494 9.823 2390 HG3 GLU 7 1HG GLU 7 6.232 -17.232 11.016 2391 H ALA 8 H ALA 8 1.786 -16.387 12.242 2392 HA ALA 8 HA ALA 8 2.619 -14.030 10.933 2393 HB1 ALA 8 1HB ALA 8 -0.143 -14.744 12.126 2394 HB2 ALA 8 2HB ALA 8 0.395 -15.115 10.445 2395 HB3 ALA 8 3HB ALA 8 0.180 -13.408 10.977 2396 H GLN 9 H GLN 9 1.639 -14.796 14.282 2397 HA GLN 9 HA GLN 9 1.393 -12.122 15.140 2398 HB2 GLN 9 2HB GLN 9 1.994 -14.743 16.626 2399 HB3 GLN 9 1HB GLN 9 1.893 -13.180 17.491 2400 HG2 GLN 9 2HG GLN 9 -0.414 -14.333 15.785 2401 HG3 GLN 9 1HG GLN 9 -0.258 -14.492 17.575 2402 HE21 GLN 9 1HE2 GLN 9 -1.968 -12.667 15.428 2403 HE22 GLN 9 2HE2 GLN 9 -1.964 -11.135 16.247 2404 H LYS 10 H LYS 10 4.216 -14.235 14.737 2405 HA LYS 10 HA LYS 10 6.032 -12.739 16.269 2406 HB2 LYS 10 2HB LYS 10 6.542 -14.248 13.624 2407 HB3 LYS 10 1HB LYS 10 7.822 -13.629 14.716 2408 HG2 LYS 10 2HG LYS 10 7.189 -15.197 16.482 2409 HG3 LYS 10 1HG LYS 10 5.795 -15.808 15.515 2410 HD2 LYS 10 2HD LYS 10 7.266 -16.592 13.737 2411 HD3 LYS 10 1HD LYS 10 8.712 -15.840 14.503 2412 HE2 LYS 10 2HE LYS 10 8.716 -17.478 16.335 2413 HE3 LYS 10 1HE LYS 10 7.098 -18.126 15.825 2414 HZ1 LYS 10 3HZ LYS 10 8.946 -19.525 15.032 2415 HZ2 LYS 10 1HZ LYS 10 9.556 -18.237 14.110 2416 HZ3 LYS 10 2HZ LYS 10 7.995 -18.865 13.803 2417 H ALA 11 H ALA 11 4.697 -12.267 13.012 2418 HA ALA 11 HA ALA 11 6.699 -10.569 12.039 2419 HB1 ALA 11 1HB ALA 11 3.713 -10.628 11.255 2420 HB2 ALA 11 2HB ALA 11 4.962 -11.752 10.607 2421 HB3 ALA 11 3HB ALA 11 5.067 -10.000 10.259 2422 H GLU 12 H GLU 12 3.648 -9.950 13.800 2423 HA GLU 12 HA GLU 12 3.779 -7.128 13.694 2424 HB2 GLU 12 2HB GLU 12 2.434 -9.044 15.683 2425 HB3 GLU 12 1HB GLU 12 2.182 -7.270 15.699 2426 HG2 GLU 12 2HG GLU 12 1.631 -8.743 13.070 2427 HG3 GLU 12 1HG GLU 12 0.499 -8.998 14.445 2428 H GLU 13 H GLU 13 5.038 -9.595 16.018 2429 HA GLU 13 HA GLU 13 5.942 -7.788 17.975 2430 HB2 GLU 13 2HB GLU 13 7.279 -10.454 17.139 2431 HB3 GLU 13 1HB GLU 13 7.676 -9.506 18.604 2432 HG2 GLU 13 2HG GLU 13 5.408 -9.975 19.546 2433 HG3 GLU 13 1HG GLU 13 5.016 -10.982 18.099 2434 H GLU 14 H GLU 14 7.486 -9.225 15.121 2435 HA GLU 14 HA GLU 14 10.021 -8.349 15.414 2436 HB2 GLU 14 2HB GLU 14 8.856 -9.973 13.639 2437 HB3 GLU 14 1HB GLU 14 8.712 -8.503 12.651 2438 HG2 GLU 14 2HG GLU 14 10.680 -9.444 11.839 2439 HG3 GLU 14 1HG GLU 14 11.375 -8.319 13.060 2440 H LEU 15 H LEU 15 7.250 -6.778 13.893 2441 HA LEU 15 HA LEU 15 8.551 -4.644 12.740 2442 HB2 LEU 15 2HB LEU 15 6.130 -5.406 12.361 2443 HB3 LEU 15 1HB LEU 15 5.689 -4.640 13.908 2444 HG LEU 15 HG LEU 15 6.312 -2.405 13.047 2445 HD11 LEU 15 1HD1 LEU 15 7.287 -3.923 10.545 2446 HD12 LEU 15 2HD1 LEU 15 8.212 -2.807 11.611 2447 HD13 LEU 15 3HD1 LEU 15 6.935 -2.167 10.541 2448 HD21 LEU 15 3HD2 LEU 15 4.525 -3.913 11.029 2449 HD22 LEU 15 1HD2 LEU 15 4.519 -2.148 11.352 2450 HD23 LEU 15 2HD2 LEU 15 4.008 -3.299 12.637 2451 H GLN 16 H GLN 16 7.243 -5.050 16.033 2452 HA GLN 16 HA GLN 16 7.511 -2.323 16.735 2453 HB2 GLN 16 2HB GLN 16 7.427 -4.806 18.540 2454 HB3 GLN 16 1HB GLN 16 7.292 -3.104 19.107 2455 HG2 GLN 16 2HG GLN 16 5.222 -2.804 17.694 2456 HG3 GLN 16 1HG GLN 16 5.315 -4.537 17.201 2457 HE21 GLN 16 1HE2 GLN 16 3.006 -3.704 18.502 2458 HE22 GLN 16 2HE2 GLN 16 2.975 -4.227 20.153 2459 H LYS 17 H LYS 17 9.821 -4.987 16.612 2460 HA LYS 17 HA LYS 17 11.643 -3.806 18.446 2461 HB2 LYS 17 2HB LYS 17 12.241 -5.846 16.239 2462 HB3 LYS 17 1HB LYS 17 13.324 -5.401 17.610 2463 HG2 LYS 17 2HG LYS 17 11.471 -6.131 19.219 2464 HG3 LYS 17 1HG LYS 17 10.554 -6.755 17.813 2465 HD2 LYS 17 2HD LYS 17 13.304 -7.760 18.803 2466 HD3 LYS 17 1HD LYS 17 11.698 -8.528 19.026 2467 HE2 LYS 17 2HE LYS 17 11.789 -8.232 16.240 2468 HE3 LYS 17 1HE LYS 17 13.522 -8.519 16.601 2469 HZ1 LYS 17 3HZ LYS 17 11.396 -10.298 17.718 2470 HZ2 LYS 17 1HZ LYS 17 13.062 -10.622 17.413 2471 HZ3 LYS 17 2HZ LYS 17 11.928 -10.436 16.128 2472 H VAL 18 H VAL 18 11.282 -3.658 14.847 2473 HA VAL 18 HA VAL 18 13.674 -2.123 14.628 2474 HB VAL 18 HB VAL 18 13.020 -1.686 12.291 2475 HG11 VAL 18 1HG1 VAL 18 13.390 -4.063 11.613 2476 HG12 VAL 18 2HG1 VAL 18 12.926 -4.635 13.254 2477 HG13 VAL 18 3HG1 VAL 18 14.416 -3.643 13.031 2478 HG21 VAL 18 3HG2 VAL 18 10.622 -3.551 12.920 2479 HG22 VAL 18 1HG2 VAL 18 11.076 -2.877 11.321 2480 HG23 VAL 18 2HG2 VAL 18 10.482 -1.780 12.612 2481 H LEU 19 H LEU 19 10.291 -1.298 15.279 2482 HA LEU 19 HA LEU 19 10.505 1.447 14.681 2483 HB2 LEU 19 2HB LEU 19 8.821 0.030 16.840 2484 HB3 LEU 19 1HB LEU 19 8.659 1.766 16.426 2485 HG LEU 19 HG LEU 19 8.130 -0.549 14.472 2486 HD11 LEU 19 1HD1 LEU 19 6.151 1.294 15.961 2487 HD12 LEU 19 2HD1 LEU 19 6.440 -0.447 16.327 2488 HD13 LEU 19 3HD1 LEU 19 5.731 0.035 14.742 2489 HD21 LEU 19 3HD2 LEU 19 7.741 2.489 14.215 2490 HD22 LEU 19 1HD2 LEU 19 7.051 1.285 13.081 2491 HD23 LEU 19 2HD2 LEU 19 8.835 1.453 13.222 2492 H GLU 20 H GLU 20 11.260 -0.433 17.632 2493 HA GLU 20 HA GLU 20 11.927 1.862 19.188 2494 HB2 GLU 20 2HB GLU 20 12.479 -1.130 19.517 2495 HB3 GLU 20 1HB GLU 20 12.958 0.081 20.750 2496 HG2 GLU 20 2HG GLU 20 10.025 -0.093 19.810 2497 HG3 GLU 20 1HG GLU 20 10.667 -1.265 21.001 2498 H GLU 21 H GLU 21 13.780 -0.366 17.042 2499 HA GLU 21 HA GLU 21 16.304 0.689 17.870 2500 HB2 GLU 21 2HB GLU 21 15.611 -0.405 15.056 2501 HB3 GLU 21 1HB GLU 21 17.231 -0.025 15.735 2502 HG2 GLU 21 2HG GLU 21 16.659 -1.878 17.540 2503 HG3 GLU 21 1HG GLU 21 15.434 -2.419 16.328 2504 H ALA 22 H ALA 22 13.885 1.506 15.413 2505 HA ALA 22 HA ALA 22 15.354 3.315 13.939 2506 HB1 ALA 22 1HB ALA 22 13.161 2.373 13.154 2507 HB2 ALA 22 2HB ALA 22 13.165 4.172 13.089 2508 HB3 ALA 22 3HB ALA 22 12.308 3.313 14.425 2509 H SER 23 H SER 23 13.421 3.821 16.981 2510 HA SER 23 HA SER 23 13.417 6.611 16.692 2511 HB2 SER 23 2HB SER 23 12.936 6.479 19.275 2512 HB3 SER 23 1HB SER 23 11.762 5.760 18.110 2513 HG SER 23 1HG SER 23 12.323 4.353 19.877 2514 H LYS 24 H LYS 24 15.743 4.344 18.206 2515 HA LYS 24 HA LYS 24 17.252 6.410 19.421 2516 HB2 LYS 24 2HB LYS 24 17.545 4.055 20.160 2517 HB3 LYS 24 1HB LYS 24 18.209 3.621 18.550 2518 HG2 LYS 24 2HG LYS 24 20.136 5.199 18.915 2519 HG3 LYS 24 1HG LYS 24 19.456 5.666 20.509 2520 HD2 LYS 24 2HD LYS 24 19.909 3.433 21.414 2521 HD3 LYS 24 1HD LYS 24 20.244 2.772 19.776 2522 HE2 LYS 24 2HE LYS 24 22.359 3.149 21.081 2523 HE3 LYS 24 1HE LYS 24 22.300 4.127 19.560 2524 HZ1 LYS 24 3HZ LYS 24 23.098 5.314 21.581 2525 HZ2 LYS 24 1HZ LYS 24 21.532 5.199 22.235 2526 HZ3 LYS 24 2HZ LYS 24 21.843 6.081 20.780 2527 H LYS 25 H LYS 25 17.651 4.585 16.366 2528 HA LYS 25 HA LYS 25 19.991 6.025 15.652 2529 HB2 LYS 25 2HB LYS 25 18.181 4.201 13.976 2530 HB3 LYS 25 1HB LYS 25 19.774 4.854 13.446 2531 HG2 LYS 25 2HG LYS 25 20.882 3.785 15.412 2532 HG3 LYS 25 1HG LYS 25 19.337 3.033 15.918 2533 HD2 LYS 25 2HD LYS 25 20.726 2.477 13.209 2534 HD3 LYS 25 1HD LYS 25 21.054 1.584 14.721 2535 HE2 LYS 25 2HE LYS 25 18.210 1.495 14.511 2536 HE3 LYS 25 1HE LYS 25 18.765 1.280 12.809 2537 HZ1 LYS 25 3HZ LYS 25 19.695 -0.335 15.163 2538 HZ2 LYS 25 1HZ LYS 25 20.119 -0.630 13.571 2539 HZ3 LYS 25 2HZ LYS 25 18.529 -0.839 14.087 2540 H ALA 26 H ALA 26 16.521 6.621 15.116 2541 HA ALA 26 HA ALA 26 16.780 8.430 13.020 2542 HB1 ALA 26 1HB ALA 26 14.702 8.446 15.303 2543 HB2 ALA 26 2HB ALA 26 14.519 7.636 13.702 2544 HB3 ALA 26 3HB ALA 26 14.604 9.425 13.788 2545 H VAL 27 H VAL 27 16.687 9.063 16.622 2546 HA VAL 27 HA VAL 27 17.067 11.826 16.239 2547 HB VAL 27 HB VAL 27 17.871 10.190 18.696 2548 HG11 VAL 27 1HG1 VAL 27 17.281 13.211 18.294 2549 HG12 VAL 27 2HG1 VAL 27 18.868 12.485 18.761 2550 HG13 VAL 27 3HG1 VAL 27 17.480 12.400 19.895 2551 HG21 VAL 27 3HG2 VAL 27 15.481 9.831 18.106 2552 HG22 VAL 27 1HG2 VAL 27 15.239 11.608 17.894 2553 HG23 VAL 27 2HG2 VAL 27 15.593 10.924 19.523 2554 H GLU 28 H GLU 28 19.388 9.119 16.642 2555 HA GLU 28 HA GLU 28 21.621 10.926 16.790 2556 HB2 GLU 28 2HB GLU 28 21.216 7.955 16.856 2557 HB3 GLU 28 1HB GLU 28 22.820 8.505 16.280 2558 HG2 GLU 28 2HG GLU 28 23.301 9.733 18.294 2559 HG3 GLU 28 1HG GLU 28 21.595 9.654 18.846 2560 H ALA 29 H ALA 29 19.677 10.029 14.170 2561 HA ALA 29 HA ALA 29 21.823 10.218 12.220 2562 HB1 ALA 29 1HB ALA 29 18.758 10.094 11.819 2563 HB2 ALA 29 2HB ALA 29 19.856 8.665 11.807 2564 HB3 ALA 29 3HB ALA 29 20.029 9.924 10.569 2565 H GLU 30 H GLU 30 18.821 11.832 13.209 2566 HA GLU 30 HA GLU 30 18.823 14.194 12.010 2567 HB2 GLU 30 2HB GLU 30 17.824 12.893 14.464 2568 HB3 GLU 30 1HB GLU 30 17.966 14.623 14.751 2569 HG2 GLU 30 2HG GLU 30 16.663 13.587 12.145 2570 HG3 GLU 30 1HG GLU 30 15.767 13.521 13.691 2571 H ARG 31 H ARG 31 20.449 13.536 15.146 2572 HA ARG 31 HA ARG 31 21.275 16.257 15.359 2573 HB2 ARG 31 2HB ARG 31 22.214 13.818 16.940 2574 HB3 ARG 31 1HB ARG 31 22.654 15.519 17.320 2575 HG2 ARG 31 2HG ARG 31 19.803 14.349 17.335 2576 HG3 ARG 31 1HG ARG 31 20.847 14.638 18.768 2577 HD2 ARG 31 2HD ARG 31 20.825 17.139 18.208 2578 HD3 ARG 31 1HD ARG 31 19.658 16.790 16.872 2579 HE ARG 31 HE ARG 31 18.056 15.936 18.488 2580 HH11 ARG 31 1HH2 ARG 31 20.621 18.085 19.930 2581 HH12 ARG 31 2HH2 ARG 31 19.863 18.153 21.457 2582 HH21 ARG 31 1HH1 ARG 31 16.970 16.263 20.475 2583 HH22 ARG 31 2HH1 ARG 31 17.648 17.163 21.779 2584 H GLY 32 H GLY 32 22.253 16.676 13.418 2585 HA2 GLY 32 2HA GLY 32 24.803 17.147 13.214 2586 HA3 GLY 32 1HA GLY 32 24.739 15.403 12.718 2587 H ALA 33 H ALA 33 21.767 16.107 11.776 2588 HA ALA 33 HA ALA 33 22.703 16.376 9.102 2589 HB1 ALA 33 1HB ALA 33 19.873 15.986 10.234 2590 HB2 ALA 33 2HB ALA 33 21.007 14.689 9.721 2591 HB3 ALA 33 3HB ALA 33 20.336 15.838 8.502 2592 HA PRO 34 HA PRO 34 21.298 20.658 9.024 2593 HB2 PRO 34 2HB PRO 34 21.652 21.290 6.341 2594 HB3 PRO 34 1HB PRO 34 23.033 21.017 7.470 2595 HG2 PRO 34 2HG PRO 34 21.804 19.024 5.499 2596 HG3 PRO 34 1HG PRO 34 23.557 19.400 5.763 2597 HD2 PRO 34 2HD PRO 34 22.217 17.244 6.957 2598 HD3 PRO 34 1HD PRO 34 23.601 18.102 7.787 2599 H GLY 35 H GLY 35 19.204 21.529 8.982 2600 HA2 GLY 35 2HA GLY 35 17.157 21.999 8.108 2601 HA3 GLY 35 1HA GLY 35 17.472 20.864 6.736 2602 H ALA 36 H ALA 36 18.032 19.969 10.016 2603 HA ALA 36 HA ALA 36 16.541 17.683 10.154 2604 HB1 ALA 36 1HB ALA 36 18.366 18.185 11.740 2605 HB2 ALA 36 2HB ALA 36 16.856 18.112 12.696 2606 HB3 ALA 36 3HB ALA 36 17.527 19.710 12.276 2607 H ALA 37 H ALA 37 14.741 17.203 11.567 2608 HA ALA 37 HA ALA 37 12.783 19.379 11.986 2609 HB1 ALA 37 1HB ALA 37 12.041 18.285 9.844 2610 HB2 ALA 37 2HB ALA 37 10.924 17.826 11.175 2611 HB3 ALA 37 3HB ALA 37 12.194 16.668 10.613 2612 H LEU 38 H LEU 38 14.110 16.124 12.769 2613 HA LEU 38 HA LEU 38 11.943 15.735 14.724 2614 HB2 LEU 38 2HB LEU 38 12.034 14.073 12.857 2615 HB3 LEU 38 1HB LEU 38 13.724 13.721 13.264 2616 HG LEU 38 HG LEU 38 13.005 12.789 15.498 2617 HD11 LEU 38 1HD1 LEU 38 10.888 14.096 15.845 2618 HD12 LEU 38 2HD1 LEU 38 10.611 12.328 15.969 2619 HD13 LEU 38 3HD1 LEU 38 10.145 13.196 14.472 2620 HD21 LEU 38 3HD2 LEU 38 12.043 10.691 14.570 2621 HD22 LEU 38 1HD2 LEU 38 13.386 11.346 13.563 2622 HD23 LEU 38 2HD2 LEU 38 11.690 11.550 13.019 2623 H ILE 39 H ILE 39 13.208 17.010 16.396 2624 HA ILE 39 HA ILE 39 15.820 15.974 16.894 2625 HB ILE 39 HB ILE 39 16.169 17.818 18.355 2626 HG12 ILE 39 2HG1 ILE 39 13.243 18.659 17.844 2627 HG13 ILE 39 1HG1 ILE 39 13.797 17.893 19.368 2628 HG21 ILE 39 1HG2 ILE 39 15.995 19.537 16.604 2629 HG22 ILE 39 2HG2 ILE 39 14.689 18.633 15.760 2630 HG23 ILE 39 3HG2 ILE 39 16.346 17.952 15.830 2631 HD11 ILE 39 3HD ILE 39 14.842 20.567 18.235 2632 HD12 ILE 39 1HD ILE 39 13.737 20.344 19.635 2633 HD13 ILE 39 2HD ILE 39 15.441 19.759 19.734 2634 H SER 40 H SER 40 12.945 14.798 18.526 2635 HA SER 40 HA SER 40 14.479 14.734 21.077 2636 HB2 SER 40 2HB SER 40 11.434 14.683 20.800 2637 HB3 SER 40 1HB SER 40 12.387 14.887 22.302 2638 HG SER 40 1HG SER 40 11.371 16.725 20.982 2639 H TYR 41 H TYR 41 14.642 12.747 22.195 2640 HA TYR 41 HA TYR 41 13.987 10.385 20.897 2641 HB2 TYR 41 2HB TYR 41 14.672 10.854 23.854 2642 HB3 TYR 41 1HB TYR 41 14.343 9.229 23.156 2643 HD1 TYR 41 1HD TYR 41 15.735 8.366 21.243 2644 HD2 TYR 41 2HD TYR 41 16.854 11.863 23.488 2645 HE1 TYR 41 1HE TYR 41 18.052 8.140 20.442 2646 HE2 TYR 41 2HE TYR 41 19.169 11.634 22.677 2647 HH TYR 41 HH TYR 41 20.228 8.947 20.554 2648 HA PRO 42 HA PRO 42 10.062 9.777 23.274 2649 HB2 PRO 42 2HB PRO 42 8.635 11.964 24.383 2650 HB3 PRO 42 1HB PRO 42 9.784 10.919 25.297 2651 HG2 PRO 42 2HG PRO 42 10.378 13.603 23.930 2652 HG3 PRO 42 1HG PRO 42 10.789 13.097 25.626 2653 HD2 PRO 42 2HD PRO 42 12.668 12.912 23.663 2654 HD3 PRO 42 1HD PRO 42 12.475 11.526 24.828 2655 H ASP 43 H ASP 43 10.755 12.245 20.999 2656 HA ASP 43 HA ASP 43 8.001 12.246 19.944 2657 HB2 ASP 43 2HB ASP 43 10.500 13.845 19.091 2658 HB3 ASP 43 1HB ASP 43 8.978 13.789 18.145 2659 H ALA 44 H ALA 44 11.334 11.123 19.449 2660 HA ALA 44 HA ALA 44 11.158 10.491 16.785 2661 HB1 ALA 44 1HB ALA 44 13.279 10.598 18.025 2662 HB2 ALA 44 2HB ALA 44 13.141 9.030 17.161 2663 HB3 ALA 44 3HB ALA 44 12.858 9.106 18.946 2664 H ILE 45 H ILE 45 10.170 8.624 19.613 2665 HA ILE 45 HA ILE 45 9.699 6.230 18.136 2666 HB ILE 45 HB ILE 45 10.243 6.055 20.432 2667 HG12 ILE 45 2HG1 ILE 45 7.257 5.362 20.188 2668 HG13 ILE 45 1HG1 ILE 45 8.594 4.427 19.443 2669 HG21 ILE 45 1HG2 ILE 45 9.593 8.268 21.273 2670 HG22 ILE 45 2HG2 ILE 45 8.806 7.015 22.262 2671 HG23 ILE 45 3HG2 ILE 45 7.846 7.905 21.036 2672 HD11 ILE 45 3HD ILE 45 8.202 4.906 22.478 2673 HD12 ILE 45 1HD ILE 45 7.949 3.369 21.575 2674 HD13 ILE 45 2HD ILE 45 9.602 4.047 21.734 2675 H TRP 46 H TRP 46 7.910 9.220 18.608 2676 HA TRP 46 HA TRP 46 5.390 7.981 17.920 2677 HB2 TRP 46 2HB TRP 46 6.224 10.509 19.078 2678 HB3 TRP 46 1HB TRP 46 5.329 10.886 17.583 2679 HD1 TRP 46 HD TRP 46 2.877 11.419 18.241 2680 HE1 TRP 46 1HE TRP 46 1.362 10.857 20.254 2681 HE3 TRP 46 3HE TRP 46 5.768 7.895 20.521 2682 HZ2 TRP 46 2HZ TRP 46 1.129 8.749 22.173 2683 HZ3 TRP 46 3HZ TRP 46 4.876 6.669 22.465 2684 HH2 TRP 46 HH TRP 46 2.584 7.085 23.282 2685 H TRP 47 H TRP 47 8.016 9.816 16.382 2686 HA TRP 47 HA TRP 47 6.841 10.074 13.847 2687 HB2 TRP 47 2HB TRP 47 8.920 11.296 14.447 2688 HB3 TRP 47 1HB TRP 47 9.809 9.750 14.606 2689 HD1 TRP 47 HD TRP 47 7.835 11.614 11.703 2690 HE1 TRP 47 1HE TRP 47 8.895 10.985 9.514 2691 HE3 TRP 47 3HE TRP 47 11.308 8.354 13.530 2692 HZ2 TRP 47 2HZ TRP 47 10.836 9.009 8.595 2693 HZ3 TRP 47 3HZ TRP 47 12.705 7.067 11.944 2694 HH2 TRP 47 HH TRP 47 12.472 7.391 9.508 2695 H SER 48 H SER 48 8.874 7.377 15.298 2696 HA SER 48 HA SER 48 9.038 6.109 12.811 2697 HB2 SER 48 2HB SER 48 9.751 4.034 14.065 2698 HB3 SER 48 1HB SER 48 10.740 5.514 14.320 2699 HG SER 48 1HG SER 48 10.218 4.298 16.231 2700 H VAL 49 H VAL 49 6.477 6.091 15.218 2701 HA VAL 49 HA VAL 49 5.147 3.797 14.220 2702 HB VAL 49 HB VAL 49 4.332 6.154 15.967 2703 HG11 VAL 49 1HG1 VAL 49 2.216 5.398 14.904 2704 HG12 VAL 49 2HG1 VAL 49 2.272 4.851 16.609 2705 HG13 VAL 49 3HG1 VAL 49 2.606 3.679 15.267 2706 HG21 VAL 49 3HG2 VAL 49 4.803 3.143 16.550 2707 HG22 VAL 49 1HG2 VAL 49 4.494 4.437 17.768 2708 HG23 VAL 49 2HG2 VAL 49 6.022 4.428 16.827 2709 H GLU 50 H GLU 50 5.415 7.066 12.942 2710 HA GLU 50 HA GLU 50 2.968 6.899 11.436 2711 HB2 GLU 50 2HB GLU 50 5.405 8.686 10.826 2712 HB3 GLU 50 1HB GLU 50 3.684 8.952 10.383 2713 HG2 GLU 50 2HG GLU 50 3.219 9.105 12.936 2714 HG3 GLU 50 1HG GLU 50 5.001 9.104 13.180 2715 H THR 51 H THR 51 6.027 5.484 11.305 2716 HA THR 51 HA THR 51 6.057 5.143 8.397 2717 HB THR 51 HB THR 51 8.294 4.513 10.415 2718 HG1 THR 51 1HG THR 51 7.706 6.753 10.434 2719 HG21 THR 51 3HG2 THR 51 9.762 4.848 8.357 2720 HG22 THR 51 1HG2 THR 51 8.291 5.056 7.351 2721 HG23 THR 51 2HG2 THR 51 8.644 3.472 8.143 2722 H ALA 52 H ALA 52 7.117 2.581 8.291 2723 HA ALA 52 HA ALA 52 6.772 0.451 8.582 2724 HB1 ALA 52 1HB ALA 52 7.037 0.506 11.016 2725 HB2 ALA 52 2HB ALA 52 5.689 -0.596 10.554 2726 HB3 ALA 52 3HB ALA 52 5.318 1.017 11.222 2727 H THR 53 H THR 53 4.012 2.638 8.926 2728 HA THR 53 HA THR 53 2.105 0.690 8.148 2729 HB THR 53 HB THR 53 0.638 2.786 8.358 2730 HG1 THR 53 1HG THR 53 1.849 4.536 9.376 2731 HG21 THR 53 3HG2 THR 53 2.594 2.179 10.714 2732 HG22 THR 53 1HG2 THR 53 1.149 1.192 10.281 2733 HG23 THR 53 2HG2 THR 53 0.951 2.886 10.845 2734 H THR 54 H THR 54 4.300 2.611 6.439 2735 HA THR 54 HA THR 54 4.481 3.460 4.427 2736 HB THR 54 HB THR 54 3.327 2.335 2.445 2737 HG1 THR 54 1HG THR 54 1.844 1.301 4.301 2738 HG21 THR 54 3HG2 THR 54 5.045 0.664 4.413 2739 HG22 THR 54 1HG2 THR 54 5.651 1.857 3.193 2740 HG23 THR 54 2HG2 THR 54 4.831 0.355 2.651 2741 H VAL 55 H VAL 55 2.579 4.718 6.241 2742 HA VAL 55 HA VAL 55 0.951 6.093 4.203 2743 HB VAL 55 HB VAL 55 0.831 6.289 7.265 2744 HG11 VAL 55 1HG1 VAL 55 0.233 8.463 6.081 2745 HG12 VAL 55 2HG1 VAL 55 -1.233 7.676 6.764 2746 HG13 VAL 55 3HG1 VAL 55 -0.878 7.557 5.003 2747 HG21 VAL 55 3HG2 VAL 55 -0.926 4.927 5.120 2748 HG22 VAL 55 1HG2 VAL 55 -1.435 5.156 6.830 2749 HG23 VAL 55 2HG2 VAL 55 -0.027 4.103 6.441 2750 H GLY 56 H GLY 56 2.564 7.333 7.193 2751 HA2 GLY 56 2HA GLY 56 4.306 8.767 7.346 2752 HA3 GLY 56 1HA GLY 56 4.568 8.652 5.564 2753 H TYR 57 H TYR 57 2.330 9.941 8.028 2754 HA TYR 57 HA TYR 57 0.769 11.336 6.199 2755 HB2 TYR 57 2HB TYR 57 0.861 10.949 9.126 2756 HB3 TYR 57 1HB TYR 57 0.679 12.708 8.825 2757 HD1 TYR 57 2HD TYR 57 -1.031 13.354 6.913 2758 HD2 TYR 57 1HD TYR 57 -1.129 9.659 9.118 2759 HE1 TYR 57 2HE TYR 57 -3.392 13.047 6.292 2760 HE2 TYR 57 1HE TYR 57 -3.502 9.356 8.501 2761 HH TYR 57 HH TYR 57 -5.362 10.335 7.486 2762 H GLY 58 H GLY 58 3.607 12.468 8.204 2763 HA2 GLY 58 2HA GLY 58 4.582 13.975 6.271 2764 HA3 GLY 58 1HA GLY 58 3.329 15.070 6.965 2765 H ASP 59 H ASP 59 3.424 14.893 9.572 2766 HA ASP 59 HA ASP 59 4.561 16.795 10.403 2767 HB2 ASP 59 2HB ASP 59 4.855 14.154 11.881 2768 HB3 ASP 59 1HB ASP 59 5.440 15.699 12.624 2769 H ARG 60 H ARG 60 6.953 14.057 10.418 2770 HA ARG 60 HA ARG 60 9.038 16.085 10.227 2771 HB2 ARG 60 2HB ARG 60 9.541 13.602 11.951 2772 HB3 ARG 60 1HB ARG 60 10.392 15.175 11.914 2773 HG2 ARG 60 2HG ARG 60 9.346 15.328 13.951 2774 HG3 ARG 60 1HG ARG 60 8.083 16.099 12.940 2775 HD2 ARG 60 2HD ARG 60 6.829 13.852 12.900 2776 HD3 ARG 60 1HD ARG 60 8.115 13.138 13.924 2777 HE ARG 60 HE ARG 60 7.453 15.266 15.480 2778 HH11 ARG 60 1HH2 ARG 60 5.338 12.638 13.929 2779 HH12 ARG 60 2HH2 ARG 60 4.109 12.912 15.016 2780 HH21 ARG 60 1HH1 ARG 60 5.517 15.705 16.766 2781 HH22 ARG 60 2HH1 ARG 60 4.225 14.613 16.750 2782 H TYR 61 H TYR 61 11.007 15.045 9.024 2783 HA TYR 61 HA TYR 61 10.715 12.348 8.393 2784 HB2 TYR 61 2HB TYR 61 10.817 12.640 5.834 2785 HB3 TYR 61 1HB TYR 61 9.216 12.975 6.578 2786 HD1 TYR 61 1HD TYR 61 12.306 14.644 5.224 2787 HD2 TYR 61 2HD TYR 61 8.172 15.072 6.332 2788 HE1 TYR 61 1HE TYR 61 12.265 16.871 4.180 2789 HE2 TYR 61 2HE TYR 61 8.114 17.286 5.279 2790 HH TYR 61 HH TYR 61 9.277 18.640 3.687 2791 HA PRO 62 HA PRO 62 14.967 13.375 8.375 2792 HB2 PRO 62 2HB PRO 62 16.165 11.138 7.170 2793 HB3 PRO 62 1HB PRO 62 15.345 11.071 8.767 2794 HG2 PRO 62 2HG PRO 62 14.119 10.352 6.044 2795 HG3 PRO 62 1HG PRO 62 14.130 9.368 7.577 2796 HD2 PRO 62 2HD PRO 62 11.981 10.966 6.903 2797 HD3 PRO 62 1HD PRO 62 12.556 10.866 8.636 2798 H VAL 63 H VAL 63 16.787 14.035 7.099 2799 HA VAL 63 HA VAL 63 16.151 14.509 4.254 2800 HB VAL 63 HB VAL 63 16.528 16.373 5.866 2801 HG11 VAL 63 1HG1 VAL 63 18.425 15.370 7.153 2802 HG12 VAL 63 2HG1 VAL 63 18.715 17.036 6.593 2803 HG13 VAL 63 3HG1 VAL 63 19.531 15.670 5.763 2804 HG21 VAL 63 3HG2 VAL 63 18.360 16.421 3.383 2805 HG22 VAL 63 1HG2 VAL 63 17.675 17.812 4.288 2806 HG23 VAL 63 2HG2 VAL 63 16.573 16.685 3.421 2807 H THR 64 H THR 64 19.074 14.917 3.668 2808 HA THR 64 HA THR 64 19.527 12.371 2.690 2809 HB THR 64 HB THR 64 21.556 14.676 2.753 2810 HG1 THR 64 1HG THR 64 20.404 15.501 0.979 2811 HG21 THR 64 3HG2 THR 64 22.105 13.878 0.475 2812 HG22 THR 64 1HG2 THR 64 20.752 12.697 0.501 2813 HG23 THR 64 2HG2 THR 64 22.166 12.477 1.593 2814 H GLU 65 H GLU 65 21.174 14.357 5.158 2815 HA GLU 65 HA GLU 65 23.446 12.695 5.259 2816 HB2 GLU 65 2HB GLU 65 23.386 15.229 5.540 2817 HB3 GLU 65 1HB GLU 65 22.570 14.977 7.124 2818 HG2 GLU 65 2HG GLU 65 24.909 15.502 7.500 2819 HG3 GLU 65 1HG GLU 65 24.657 13.781 7.946 2820 H GLU 66 H GLU 66 20.398 12.589 6.816 2821 HA GLU 66 HA GLU 66 21.155 11.295 9.205 2822 HB2 GLU 66 2HB GLU 66 18.558 11.404 7.548 2823 HB3 GLU 66 1HB GLU 66 18.667 10.738 9.209 2824 HG2 GLU 66 2HG GLU 66 19.571 12.930 10.051 2825 HG3 GLU 66 1HG GLU 66 19.443 13.629 8.394 2826 H GLY 67 H GLY 67 21.009 10.448 5.891 2827 HA2 GLY 67 2HA GLY 67 21.501 8.528 4.831 2828 HA3 GLY 67 1HA GLY 67 21.382 7.606 6.411 2829 H ARG 68 H ARG 68 19.446 9.248 3.789 2830 HA ARG 68 HA ARG 68 17.063 9.121 5.213 2831 HB2 ARG 68 2HB ARG 68 17.499 10.469 3.053 2832 HB3 ARG 68 1HB ARG 68 17.133 8.958 2.157 2833 HG2 ARG 68 2HG ARG 68 14.847 8.941 3.344 2834 HG3 ARG 68 1HG ARG 68 15.298 10.507 4.107 2835 HD2 ARG 68 2HD ARG 68 15.411 11.588 1.834 2836 HD3 ARG 68 1HD ARG 68 15.018 10.008 1.059 2837 HE ARG 68 HE ARG 68 12.763 10.160 1.756 2838 HH11 ARG 68 1HH2 ARG 68 14.124 13.119 3.525 2839 HH12 ARG 68 2HH2 ARG 68 13.386 14.090 2.286 2840 HH21 ARG 68 1HH1 ARG 68 11.032 11.444 1.610 2841 HH22 ARG 68 2HH1 ARG 68 11.040 13.106 2.142 2842 H LYS 69 H LYS 69 18.920 6.634 3.921 2843 HA LYS 69 HA LYS 69 17.039 4.628 3.488 2844 HB2 LYS 69 2HB LYS 69 19.838 4.336 4.703 2845 HB3 LYS 69 1HB LYS 69 18.800 3.007 4.083 2846 HG2 LYS 69 2HG LYS 69 18.813 4.150 1.799 2847 HG3 LYS 69 1HG LYS 69 20.099 5.254 2.425 2848 HD2 LYS 69 2HD LYS 69 21.474 3.200 3.038 2849 HD3 LYS 69 1HD LYS 69 20.210 2.161 2.293 2850 HE2 LYS 69 2HE LYS 69 22.032 4.214 0.853 2851 HE3 LYS 69 1HE LYS 69 22.101 2.413 0.747 2852 HZ1 LYS 69 3HZ LYS 69 19.962 4.190 -0.295 2853 HZ2 LYS 69 1HZ LYS 69 19.819 2.502 -0.232 2854 HZ3 LYS 69 2HZ LYS 69 21.058 3.236 -1.149 2855 H VAL 70 H VAL 70 17.799 6.319 6.508 2856 HA VAL 70 HA VAL 70 17.100 4.245 8.261 2857 HB VAL 70 HB VAL 70 16.946 7.284 8.509 2858 HG11 VAL 70 1HG1 VAL 70 16.723 6.882 10.999 2859 HG12 VAL 70 2HG1 VAL 70 16.432 5.130 10.681 2860 HG13 VAL 70 3HG1 VAL 70 15.259 6.372 10.098 2861 HG21 VAL 70 3HG2 VAL 70 18.865 5.157 9.706 2862 HG22 VAL 70 1HG2 VAL 70 18.974 6.945 9.916 2863 HG23 VAL 70 2HG2 VAL 70 19.254 6.218 8.307 2864 H ALA 71 H ALA 71 15.115 6.651 6.451 2865 HA ALA 71 HA ALA 71 12.667 5.782 7.657 2866 HB1 ALA 71 1HB ALA 71 13.154 7.235 4.970 2867 HB2 ALA 71 2HB ALA 71 12.727 8.011 6.541 2868 HB3 ALA 71 3HB ALA 71 11.539 6.952 5.721 2869 H GLU 72 H GLU 72 14.484 5.037 4.689 2870 HA GLU 72 HA GLU 72 12.653 3.381 3.451 2871 HB2 GLU 72 2HB GLU 72 14.807 4.229 2.412 2872 HB3 GLU 72 1HB GLU 72 15.714 3.020 3.385 2873 HG2 GLU 72 2HG GLU 72 13.480 1.864 1.724 2874 HG3 GLU 72 1HG GLU 72 14.758 2.688 0.770 2875 H GLN 73 H GLN 73 15.208 2.552 5.844 2876 HA GLN 73 HA GLN 73 14.930 -0.138 5.604 2877 HB2 GLN 73 2HB GLN 73 16.834 1.064 6.747 2878 HB3 GLN 73 1HB GLN 73 15.798 1.240 8.200 2879 HG2 GLN 73 2HG GLN 73 15.679 -1.259 8.417 2880 HG3 GLN 73 1HG GLN 73 16.568 -1.449 6.857 2881 HE21 GLN 73 1HE2 GLN 73 17.988 -2.802 8.451 2882 HE22 GLN 73 2HE2 GLN 73 19.201 -1.969 9.351 2883 H VAL 74 H VAL 74 13.219 2.040 7.847 2884 HA VAL 74 HA VAL 74 11.880 -0.065 9.210 2885 HB VAL 74 HB VAL 74 11.145 2.909 8.981 2886 HG11 VAL 74 1HG1 VAL 74 10.429 0.761 11.110 2887 HG12 VAL 74 2HG1 VAL 74 9.279 1.505 9.941 2888 HG13 VAL 74 3HG1 VAL 74 10.036 2.517 11.215 2889 HG21 VAL 74 3HG2 VAL 74 12.958 1.436 11.015 2890 HG22 VAL 74 1HG2 VAL 74 12.459 3.170 11.079 2891 HG23 VAL 74 2HG2 VAL 74 13.524 2.601 9.765 2892 H MET 75 H MET 75 11.141 2.075 6.452 2893 HA MET 75 HA MET 75 8.435 1.473 6.222 2894 HB2 MET 75 2HB MET 75 9.757 3.383 5.186 2895 HB3 MET 75 1HB MET 75 10.418 2.226 3.987 2896 HG2 MET 75 2HG MET 75 8.001 1.763 3.262 2897 HG3 MET 75 1HG MET 75 7.471 3.044 4.395 2898 HE1 MET 75 3HE MET 75 9.276 6.279 2.864 2899 HE2 MET 75 1HE MET 75 10.265 5.143 3.837 2900 HE3 MET 75 2HE MET 75 8.582 5.528 4.336 2901 H LYS 76 H LYS 76 11.315 0.055 4.608 2902 HA LYS 76 HA LYS 76 9.914 -1.784 3.040 2903 HB2 LYS 76 2HB LYS 76 12.376 -1.039 2.804 2904 HB3 LYS 76 1HB LYS 76 12.760 -2.136 4.167 2905 HG2 LYS 76 2HG LYS 76 11.838 -4.076 2.785 2906 HG3 LYS 76 1HG LYS 76 11.602 -2.951 1.408 2907 HD2 LYS 76 2HD LYS 76 14.277 -3.598 2.798 2908 HD3 LYS 76 1HD LYS 76 13.706 -4.394 1.307 2909 HE2 LYS 76 2HE LYS 76 14.330 -2.648 -0.085 2910 HE3 LYS 76 1HE LYS 76 13.747 -1.399 1.075 2911 HZ1 LYS 76 3HZ LYS 76 16.472 -2.646 1.042 2912 HZ2 LYS 76 1HZ LYS 76 15.763 -1.973 2.423 2913 HZ3 LYS 76 2HZ LYS 76 15.933 -1.021 1.080 2914 H ALA 77 H ALA 77 11.288 -2.012 6.353 2915 HA ALA 77 HA ALA 77 10.899 -4.747 6.712 2916 HB1 ALA 77 1HB ALA 77 12.311 -3.356 8.260 2917 HB2 ALA 77 2HB ALA 77 11.050 -4.271 9.164 2918 HB3 ALA 77 3HB ALA 77 10.827 -2.510 8.836 2919 H GLY 78 H GLY 78 8.710 -1.977 7.170 2920 HA2 GLY 78 2HA GLY 78 6.631 -3.305 8.489 2921 HA3 GLY 78 1HA GLY 78 6.525 -1.829 7.463 2922 H ILE 79 H ILE 79 7.433 -3.045 5.018 2923 HA ILE 79 HA ILE 79 4.952 -4.090 4.138 2924 HB ILE 79 HB ILE 79 7.666 -4.084 2.721 2925 HG12 ILE 79 2HG1 ILE 79 5.320 -2.077 2.576 2926 HG13 ILE 79 1HG1 ILE 79 6.860 -1.788 3.431 2927 HG21 ILE 79 1HG2 ILE 79 6.291 -4.316 0.618 2928 HG22 ILE 79 2HG2 ILE 79 4.790 -4.408 1.607 2929 HG23 ILE 79 3HG2 ILE 79 6.025 -5.713 1.699 2930 HD11 ILE 79 3HD ILE 79 6.531 -2.164 0.385 2931 HD12 ILE 79 1HD ILE 79 6.947 -0.655 1.270 2932 HD13 ILE 79 2HD ILE 79 8.116 -2.031 1.239 2933 H GLU 80 H GLU 80 8.153 -5.521 4.952 2934 HA GLU 80 HA GLU 80 7.583 -8.050 3.949 2935 HB2 GLU 80 2HB GLU 80 9.435 -7.538 6.352 2936 HB3 GLU 80 1HB GLU 80 9.441 -8.934 5.219 2937 HG2 GLU 80 2HG GLU 80 9.883 -7.102 3.350 2938 HG3 GLU 80 1HG GLU 80 10.330 -6.038 4.733 2939 H VAL 81 H VAL 81 7.000 -6.696 7.244 2940 HA VAL 81 HA VAL 81 6.212 -9.215 8.257 2941 HB VAL 81 HB VAL 81 5.388 -7.945 10.230 2942 HG11 VAL 81 1HG1 VAL 81 8.215 -7.202 9.178 2943 HG12 VAL 81 2HG1 VAL 81 7.763 -8.760 9.970 2944 HG13 VAL 81 3HG1 VAL 81 7.673 -7.217 10.893 2945 HG21 VAL 81 3HG2 VAL 81 5.840 -5.520 10.351 2946 HG22 VAL 81 1HG2 VAL 81 4.638 -5.831 9.072 2947 HG23 VAL 81 2HG2 VAL 81 6.352 -5.482 8.639 2948 H PHE 82 H PHE 82 4.324 -6.456 6.867 2949 HA PHE 82 HA PHE 82 1.858 -7.769 7.508 2950 HB2 PHE 82 2HB PHE 82 2.416 -5.456 5.558 2951 HB3 PHE 82 1HB PHE 82 0.773 -6.021 6.058 2952 HD1 PHE 82 2HD PHE 82 1.516 -6.479 9.136 2953 HD2 PHE 82 1HD PHE 82 2.166 -3.245 6.352 2954 HE1 PHE 82 2HE PHE 82 1.608 -4.903 10.989 2955 HE2 PHE 82 1HE PHE 82 2.204 -1.658 8.228 2956 HZ PHE 82 HZ PHE 82 1.923 -2.468 10.559 2957 H ALA 83 H ALA 83 4.148 -7.985 4.871 2958 HA ALA 83 HA ALA 83 2.292 -9.368 3.161 2959 HB1 ALA 83 1HB ALA 83 4.239 -8.103 2.204 2960 HB2 ALA 83 2HB ALA 83 4.291 -9.839 1.746 2961 HB3 ALA 83 3HB ALA 83 5.370 -9.215 3.054 2962 H LEU 84 H LEU 84 4.710 -10.211 5.643 2963 HA LEU 84 HA LEU 84 5.174 -12.841 5.053 2964 HB2 LEU 84 2HB LEU 84 6.367 -11.459 6.771 2965 HB3 LEU 84 1HB LEU 84 4.976 -11.609 7.879 2966 HG LEU 84 HG LEU 84 6.489 -14.058 6.789 2967 HD11 LEU 84 1HD1 LEU 84 8.033 -13.939 8.744 2968 HD12 LEU 84 2HD1 LEU 84 7.300 -12.370 9.245 2969 HD13 LEU 84 3HD1 LEU 84 8.199 -12.490 7.687 2970 HD21 LEU 84 3HD2 LEU 84 5.892 -15.088 9.021 2971 HD22 LEU 84 1HD2 LEU 84 4.436 -14.657 8.076 2972 HD23 LEU 84 2HD2 LEU 84 4.958 -13.614 9.449 2973 H VAL 85 H VAL 85 2.557 -11.381 6.962 2974 HA VAL 85 HA VAL 85 1.524 -13.822 7.856 2975 HB VAL 85 HB VAL 85 -0.380 -12.584 8.675 2976 HG11 VAL 85 1HG1 VAL 85 2.159 -10.823 8.948 2977 HG12 VAL 85 2HG1 VAL 85 1.982 -12.405 9.760 2978 HG13 VAL 85 3HG1 VAL 85 0.855 -11.057 10.149 2979 HG21 VAL 85 3HG2 VAL 85 -0.790 -11.080 6.653 2980 HG22 VAL 85 1HG2 VAL 85 0.719 -10.189 7.057 2981 HG23 VAL 85 2HG2 VAL 85 -0.673 -10.149 8.182 2982 H THR 86 H THR 86 1.500 -12.693 4.649 2983 HA THR 86 HA THR 86 -1.098 -13.319 3.886 2984 HB THR 86 HB THR 86 1.365 -13.576 2.119 2985 HG1 THR 86 1HG THR 86 1.452 -11.593 2.843 2986 HG21 THR 86 3HG2 THR 86 -1.626 -12.953 1.537 2987 HG22 THR 86 1HG2 THR 86 -0.757 -14.464 1.067 2988 HG23 THR 86 2HG2 THR 86 -0.295 -12.893 0.329 2989 H ALA 87 H ALA 87 1.541 -15.391 4.845 2990 HA ALA 87 HA ALA 87 0.663 -17.782 3.670 2991 HB1 ALA 87 1HB ALA 87 2.856 -17.596 4.848 2992 HB2 ALA 87 2HB ALA 87 1.869 -18.924 5.553 2993 HB3 ALA 87 3HB ALA 87 2.002 -17.342 6.414 2994 H ALA 88 H ALA 88 -0.555 -15.949 6.487 2995 HA ALA 88 HA ALA 88 -2.198 -18.150 7.393 2996 HB1 ALA 88 1HB ALA 88 -1.338 -16.507 9.096 2997 HB2 ALA 88 2HB ALA 88 -3.141 -16.474 9.023 2998 HB3 ALA 88 3HB ALA 88 -2.185 -15.179 8.225 2999 H LEU 89 H LEU 89 -2.450 -15.217 5.382 3000 HA LEU 89 HA LEU 89 -5.283 -15.295 5.221 3001 HB2 LEU 89 2HB LEU 89 -3.185 -13.932 3.439 3002 HB3 LEU 89 1HB LEU 89 -4.924 -13.916 3.045 3003 HG LEU 89 HG LEU 89 -4.355 -11.840 4.045 3004 HD11 LEU 89 1HD1 LEU 89 -6.082 -11.659 5.765 3005 HD12 LEU 89 2HD1 LEU 89 -6.071 -13.435 6.058 3006 HD13 LEU 89 3HD1 LEU 89 -6.629 -12.781 4.473 3007 HD21 LEU 89 3HD2 LEU 89 -3.456 -13.279 6.624 3008 HD22 LEU 89 1HD2 LEU 89 -3.632 -11.505 6.377 3009 HD23 LEU 89 2HD2 LEU 89 -2.401 -12.412 5.442 3010 H ALA 90 H ALA 90 -2.679 -16.862 3.379 3011 HA ALA 90 HA ALA 90 -4.317 -17.682 1.265 3012 HB1 ALA 90 1HB ALA 90 -1.828 -17.739 1.139 3013 HB2 ALA 90 2HB ALA 90 -2.544 -19.350 0.758 3014 HB3 ALA 90 3HB ALA 90 -1.806 -19.041 2.381 3015 H THR 91 H THR 91 -3.822 -19.117 4.528 3016 HA THR 91 HA THR 91 -5.329 -21.453 3.855 3017 HB THR 91 HB THR 91 -5.510 -21.450 6.551 3018 HG1 THR 91 1HG THR 91 -4.490 -19.262 6.543 3019 HG21 THR 91 3HG2 THR 91 -2.925 -21.934 4.936 3020 HG22 THR 91 1HG2 THR 91 -4.292 -23.096 5.105 3021 HG23 THR 91 2HG2 THR 91 -3.315 -22.639 6.550 3022 H ASP 92 H ASP 92 -6.344 -18.162 4.221 3023 HA ASP 92 HA ASP 92 -8.485 -18.711 5.972 3024 HB2 ASP 92 2HB ASP 92 -7.424 -16.396 5.631 3025 HB3 ASP 92 1HB ASP 92 -8.404 -16.267 4.128 3026 H PHE 93 H PHE 93 -8.172 -18.533 2.412 3027 HA PHE 93 HA PHE 93 -10.940 -18.916 1.982 3028 HB2 PHE 93 2HB PHE 93 -10.581 -19.147 -0.286 3029 HB3 PHE 93 1HB PHE 93 -9.244 -18.066 0.195 3030 HD1 PHE 93 2HD PHE 93 -6.891 -18.948 0.168 3031 HD2 PHE 93 1HD PHE 93 -10.185 -21.396 -1.098 3032 HE1 PHE 93 2HE PHE 93 -5.321 -20.477 -0.966 3033 HE2 PHE 93 1HE PHE 93 -8.614 -22.916 -2.256 3034 HZ PHE 93 HZ PHE 93 -6.178 -22.458 -2.202 3035 H VAL 94 H VAL 94 -8.321 -21.085 2.744 3036 HA VAL 94 HA VAL 94 -9.400 -23.423 1.623 3037 HB VAL 94 HB VAL 94 -7.335 -23.142 3.866 3038 HG11 VAL 94 1HG1 VAL 94 -7.956 -25.464 1.907 3039 HG12 VAL 94 2HG1 VAL 94 -8.180 -25.488 3.694 3040 HG13 VAL 94 3HG1 VAL 94 -6.525 -25.387 3.002 3041 HG21 VAL 94 3HG2 VAL 94 -6.706 -21.837 1.789 3042 HG22 VAL 94 1HG2 VAL 94 -7.013 -23.288 0.783 3043 HG23 VAL 94 2HG2 VAL 94 -5.663 -23.281 1.974 3044 H ARG 95 H ARG 95 -10.070 -21.637 4.536 3045 HA ARG 95 HA ARG 95 -11.097 -23.705 6.121 3046 HB2 ARG 95 2HB ARG 95 -11.810 -20.719 6.004 3047 HB3 ARG 95 1HB ARG 95 -12.375 -21.833 7.292 3048 HG2 ARG 95 2HG ARG 95 -10.125 -22.171 8.134 3049 HG3 ARG 95 1HG ARG 95 -9.386 -21.320 6.727 3050 HD2 ARG 95 2HD ARG 95 -10.279 -19.156 7.415 3051 HD3 ARG 95 1HD ARG 95 -11.261 -19.904 8.733 3052 HE ARG 95 HE ARG 95 -8.620 -20.628 9.374 3053 HH11 ARG 95 1HH2 ARG 95 -9.929 -17.343 8.626 3054 HH12 ARG 95 2HH2 ARG 95 -9.795 -16.777 10.219 3055 HH21 ARG 95 1HH1 ARG 95 -7.347 -19.153 11.097 3056 HH22 ARG 95 2HH1 ARG 95 -8.124 -17.781 11.522 3057 H ARG 96 H ARG 96 -12.274 -22.461 3.122 3058 HA ARG 96 HA ARG 96 -15.016 -22.832 3.482 3059 HB2 ARG 96 2HB ARG 96 -15.304 -22.802 1.130 3060 HB3 ARG 96 1HB ARG 96 -13.968 -21.663 1.465 3061 HG2 ARG 96 2HG ARG 96 -12.303 -23.369 0.649 3062 HG3 ARG 96 1HG ARG 96 -13.612 -24.564 0.461 3063 HD2 ARG 96 2HD ARG 96 -14.727 -22.880 -1.212 3064 HD3 ARG 96 1HD ARG 96 -13.093 -22.091 -1.264 3065 HE ARG 96 HE ARG 96 -13.001 -25.055 -1.647 3066 HH11 ARG 96 1HH2 ARG 96 -14.046 -22.051 -3.445 3067 HH12 ARG 96 2HH2 ARG 96 -13.707 -22.788 -4.964 3068 HH21 ARG 96 1HH1 ARG 96 -12.514 -25.890 -3.803 3069 HH22 ARG 96 2HH1 ARG 96 -12.881 -24.900 -5.171 3070 H GLU 97 H GLU 97 -12.405 -25.243 3.260 3071 HA GLU 97 HA GLU 97 -14.451 -27.311 3.090 3072 HB2 GLU 97 2HB GLU 97 -12.113 -27.019 1.146 3073 HB3 GLU 97 1HB GLU 97 -12.786 -28.638 1.556 3074 HG2 GLU 97 2HG GLU 97 -15.005 -28.050 0.776 3075 HG3 GLU 97 1HG GLU 97 -14.579 -26.336 0.540 3076 H GLU 98 H GLU 98 -13.290 -29.464 3.766 3077 HA GLU 98 HA GLU 98 -12.533 -30.515 5.436 3078 HB2 GLU 98 2HB GLU 98 -10.252 -28.492 5.691 3079 HB3 GLU 98 1HB GLU 98 -10.357 -30.100 6.485 3080 HG2 GLU 98 2HG GLU 98 -10.479 -31.171 4.178 3081 HG3 GLU 98 1HG GLU 98 -10.194 -29.548 3.445 3082 H GLU 99 H GLU 99 -11.895 -27.175 6.555 3083 HA GLU 99 HA GLU 99 -12.765 -27.581 9.211 3084 HB2 GLU 99 2HB GLU 99 -12.537 -25.071 7.453 3085 HB3 GLU 99 1HB GLU 99 -13.030 -24.972 9.167 3086 HG2 GLU 99 2HG GLU 99 -10.362 -26.293 8.353 3087 HG3 GLU 99 1HG GLU 99 -10.533 -24.509 8.521 3088 H ARG 100 H ARG 100 -14.397 -25.974 6.394 3089 HA ARG 100 HA ARG 100 -16.772 -25.638 7.855 3090 HB2 ARG 100 2HB ARG 100 -16.055 -24.303 5.816 3091 HB3 ARG 100 1HB ARG 100 -16.521 -25.723 4.814 3092 HG2 ARG 100 2HG ARG 100 -18.894 -25.436 5.488 3093 HG3 ARG 100 1HG ARG 100 -18.445 -24.183 6.684 3094 HD2 ARG 100 2HD ARG 100 -19.483 -23.253 4.532 3095 HD3 ARG 100 1HD ARG 100 -17.848 -22.565 4.908 3096 HE ARG 100 HE ARG 100 -16.950 -24.460 3.393 3097 HH11 ARG 100 1HH2 ARG 100 -19.674 -22.330 2.343 3098 HH12 ARG 100 2HH2 ARG 100 -20.044 -23.234 0.997 3099 HH21 ARG 100 1HH1 ARG 100 -17.057 -25.232 1.304 3100 HH22 ARG 100 2HH1 ARG 100 -18.353 -24.850 0.224 3101 H ARG 101 H ARG 101 -15.558 -28.445 6.064 3102 HA ARG 101 HA ARG 101 -18.158 -29.755 6.456 3103 HB2 ARG 101 2HB ARG 101 -16.481 -30.052 3.896 3104 HB3 ARG 101 1HB ARG 101 -18.040 -30.863 4.267 3105 HG2 ARG 101 2HG ARG 101 -19.171 -28.585 4.184 3106 HG3 ARG 101 1HG ARG 101 -17.575 -27.830 3.899 3107 HD2 ARG 101 2HD ARG 101 -18.586 -27.932 1.738 3108 HD3 ARG 101 1HD ARG 101 -17.323 -29.232 1.760 3109 HE ARG 101 HE ARG 101 -19.968 -30.205 2.588 3110 HH11 ARG 101 1HH2 ARG 101 -17.924 -29.696 -0.349 3111 HH12 ARG 101 2HH2 ARG 101 -19.134 -30.124 -1.429 3112 HH21 ARG 101 1HH1 ARG 101 -21.606 -30.894 1.063 3113 HH22 ARG 101 2HH1 ARG 101 -21.434 -30.441 -0.599 3114 H GLY 102 H GLY 102 -17.266 -30.864 8.269 3115 HA2 GLY 102 2HA GLY 102 -16.469 -32.975 8.827 3116 HA3 GLY 102 1HA GLY 102 -15.191 -32.842 7.562 3117 H HIS 103 H HIS 103 -16.126 -30.297 9.848 3118 HA HIS 103 HA HIS 103 -13.638 -29.543 10.526 3119 HB2 HIS 103 2HB HIS 103 -14.562 -28.458 12.571 3120 HB3 HIS 103 1HB HIS 103 -15.586 -28.151 11.164 3121 HD1 HIS 103 1HD HIS 103 -18.114 -28.451 11.584 3122 HD2 HIS 103 2HD HIS 103 -15.743 -30.748 14.236 3123 HE1 HIS 103 1HE HIS 103 -19.651 -29.521 13.220 3124 HE2 HIS 103 2HE HIS 103 -18.185 -30.952 14.795 Start of MODEL 5 1 H1 SER 1 H SER 1 -23.315 -13.559 -2.468 2 HA SER 1 HA SER 1 -24.518 -15.750 -3.568 3 HB2 SER 1 2HB SER 1 -24.652 -14.161 -5.592 4 HB3 SER 1 1HB SER 1 -22.873 -13.913 -5.456 5 HG SER 1 1HG SER 1 -23.638 -15.505 -6.994 6 H ALA 2 H ALA 2 -22.618 -17.251 -3.773 7 HA ALA 2 HA ALA 2 -20.981 -18.244 -2.826 8 HB1 ALA 2 1HB ALA 2 -18.709 -17.311 -2.919 9 HB2 ALA 2 2HB ALA 2 -19.425 -15.652 -3.069 10 HB3 ALA 2 3HB ALA 2 -19.633 -16.856 -4.388 11 H ASP 3 H ASP 3 -19.136 -18.022 -1.035 12 HA ASP 3 HA ASP 3 -20.481 -17.101 1.410 13 HB2 ASP 3 2HB ASP 3 -18.062 -18.984 0.967 14 HB3 ASP 3 1HB ASP 3 -18.783 -18.562 2.570 15 H HIS 4 H HIS 4 -17.451 -16.972 -0.441 16 HA HIS 4 HA HIS 4 -16.118 -15.373 1.468 17 HB2 HIS 4 2HB HIS 4 -14.345 -14.978 -0.227 18 HB3 HIS 4 1HB HIS 4 -14.732 -16.694 0.015 19 HD1 HIS 4 1HD HIS 4 -15.446 -13.901 -2.726 20 HD2 HIS 4 2HD HIS 4 -15.220 -18.133 -2.306 21 HE1 HIS 4 1HE HIS 4 -15.410 -14.845 -4.941 22 HE2 HIS 4 2HE HIS 4 -15.273 -17.350 -4.753 23 H GLU 5 H GLU 5 -18.220 -14.502 -1.300 24 HA GLU 5 HA GLU 5 -17.186 -11.859 -1.431 25 HB2 GLU 5 2HB GLU 5 -19.916 -12.831 -2.441 26 HB3 GLU 5 1HB GLU 5 -19.027 -11.361 -2.958 27 HG2 GLU 5 2HG GLU 5 -18.040 -14.262 -3.435 28 HG3 GLU 5 1HG GLU 5 -18.970 -13.270 -4.607 29 H ARG 6 H ARG 6 -19.995 -13.399 0.162 30 HA ARG 6 HA ARG 6 -21.083 -10.952 1.052 31 HB2 ARG 6 2HB ARG 6 -22.491 -12.308 2.589 32 HB3 ARG 6 1HB ARG 6 -22.542 -12.887 0.893 33 HG2 ARG 6 2HG ARG 6 -20.832 -14.662 1.498 34 HG3 ARG 6 1HG ARG 6 -20.981 -14.176 3.222 35 HD2 ARG 6 2HD ARG 6 -23.077 -15.505 1.385 36 HD3 ARG 6 1HD ARG 6 -22.310 -16.174 2.876 37 HE ARG 6 HE ARG 6 -24.230 -13.813 2.735 38 HH11 ARG 6 1HH2 ARG 6 -23.356 -16.998 4.327 39 HH12 ARG 6 2HH2 ARG 6 -24.522 -16.845 5.533 40 HH21 ARG 6 1HH1 ARG 6 -25.862 -13.706 4.284 41 HH22 ARG 6 2HH1 ARG 6 -26.142 -14.931 5.442 42 H GLU 7 H GLU 7 -18.571 -13.126 2.347 43 HA GLU 7 HA GLU 7 -18.610 -11.832 4.894 44 HB2 GLU 7 2HB GLU 7 -18.081 -14.251 4.539 45 HB3 GLU 7 1HB GLU 7 -16.506 -13.787 3.825 46 HG2 GLU 7 2HG GLU 7 -15.641 -13.045 5.909 47 HG3 GLU 7 1HG GLU 7 -17.271 -12.650 6.568 48 H ALA 8 H ALA 8 -16.766 -11.493 1.847 49 HA ALA 8 HA ALA 8 -14.805 -9.745 2.811 50 HB1 ALA 8 1HB ALA 8 -16.188 -9.834 0.038 51 HB2 ALA 8 2HB ALA 8 -14.699 -10.732 0.505 52 HB3 ALA 8 3HB ALA 8 -14.679 -8.932 0.413 53 H GLN 9 H GLN 9 -17.986 -9.158 1.347 54 HA GLN 9 HA GLN 9 -18.142 -6.418 1.441 55 HB2 GLN 9 2HB GLN 9 -19.710 -7.940 0.253 56 HB3 GLN 9 1HB GLN 9 -20.219 -8.659 1.813 57 HG2 GLN 9 2HG GLN 9 -21.322 -6.457 2.447 58 HG3 GLN 9 1HG GLN 9 -20.873 -5.800 0.832 59 HE21 GLN 9 1HE2 GLN 9 -22.036 -6.587 -1.020 60 HE22 GLN 9 2HE2 GLN 9 -23.399 -7.658 -0.905 61 H LYS 10 H LYS 10 -18.719 -8.800 4.012 62 HA LYS 10 HA LYS 10 -20.055 -7.130 5.839 63 HB2 LYS 10 2HB LYS 10 -19.975 -9.674 5.970 64 HB3 LYS 10 1HB LYS 10 -18.222 -9.560 6.311 65 HG2 LYS 10 2HG LYS 10 -18.862 -8.215 8.448 66 HG3 LYS 10 1HG LYS 10 -20.538 -8.793 8.164 67 HD2 LYS 10 2HD LYS 10 -19.701 -11.170 8.241 68 HD3 LYS 10 1HD LYS 10 -18.011 -10.558 8.341 69 HE2 LYS 10 2HE LYS 10 -18.641 -9.422 10.573 70 HE3 LYS 10 1HE LYS 10 -20.206 -10.333 10.509 71 HZ1 LYS 10 3HZ LYS 10 -18.846 -12.395 10.330 72 HZ2 LYS 10 1HZ LYS 10 -18.547 -11.544 11.792 73 HZ3 LYS 10 2HZ LYS 10 -17.444 -11.485 10.533 74 H ALA 11 H ALA 11 -16.604 -7.801 5.176 75 HA ALA 11 HA ALA 11 -15.628 -6.589 7.535 76 HB1 ALA 11 1HB ALA 11 -13.407 -6.744 6.470 77 HB2 ALA 11 2HB ALA 11 -14.159 -7.001 4.850 78 HB3 ALA 11 3HB ALA 11 -14.321 -8.253 6.133 79 H GLU 12 H GLU 12 -16.321 -5.421 4.228 80 HA GLU 12 HA GLU 12 -15.111 -2.922 4.439 81 HB2 GLU 12 2HB GLU 12 -17.670 -3.644 2.880 82 HB3 GLU 12 1HB GLU 12 -16.655 -2.186 2.625 83 HG2 GLU 12 2HG GLU 12 -14.730 -3.660 1.912 84 HG3 GLU 12 1HG GLU 12 -15.778 -5.115 2.113 85 H GLU 13 H GLU 13 -18.247 -4.100 5.580 86 HA GLU 13 HA GLU 13 -19.435 -1.616 6.134 87 HB2 GLU 13 2HB GLU 13 -20.532 -4.006 6.090 88 HB3 GLU 13 1HB GLU 13 -19.868 -4.214 7.733 89 HG2 GLU 13 2HG GLU 13 -22.072 -3.505 8.163 90 HG3 GLU 13 1HG GLU 13 -21.166 -1.961 8.323 91 H GLU 14 H GLU 14 -17.345 -3.831 8.038 92 HA GLU 14 HA GLU 14 -17.571 -2.489 10.487 93 HB2 GLU 14 2HB GLU 14 -16.616 -4.771 10.481 94 HB3 GLU 14 1HB GLU 14 -15.231 -4.228 9.475 95 HG2 GLU 14 2HG GLU 14 -14.330 -2.849 11.304 96 HG3 GLU 14 1HG GLU 14 -15.804 -3.111 12.296 97 H LEU 15 H LEU 15 -15.467 -2.004 7.671 98 HA LEU 15 HA LEU 15 -13.590 -0.394 8.849 99 HB2 LEU 15 2HB LEU 15 -13.585 -1.296 6.442 100 HB3 LEU 15 1HB LEU 15 -14.700 0.022 5.998 101 HG LEU 15 HG LEU 15 -12.982 1.723 6.668 102 HD11 LEU 15 1HD1 LEU 15 -10.584 0.907 7.103 103 HD12 LEU 15 2HD1 LEU 15 -11.249 -0.740 7.336 104 HD13 LEU 15 3HD1 LEU 15 -11.736 0.604 8.436 105 HD21 LEU 15 3HD2 LEU 15 -11.883 -0.371 4.681 106 HD22 LEU 15 1HD2 LEU 15 -11.397 1.357 4.795 107 HD23 LEU 15 2HD2 LEU 15 -13.076 0.928 4.307 108 H GLN 16 H GLN 16 -16.746 0.494 7.476 109 HA GLN 16 HA GLN 16 -16.437 3.269 7.646 110 HB2 GLN 16 2HB GLN 16 -19.084 1.712 7.856 111 HB3 GLN 16 1HB GLN 16 -18.842 3.418 7.344 112 HG2 GLN 16 2HG GLN 16 -17.347 2.431 5.411 113 HG3 GLN 16 1HG GLN 16 -18.049 0.825 5.835 114 HE21 GLN 16 1HE2 GLN 16 -20.535 0.649 5.752 115 HE22 GLN 16 2HE2 GLN 16 -21.420 1.777 4.790 116 H LYS 17 H LYS 17 -17.613 0.854 9.937 117 HA LYS 17 HA LYS 17 -18.701 2.613 11.833 118 HB2 LYS 17 2HB LYS 17 -19.222 0.184 11.635 119 HB3 LYS 17 1HB LYS 17 -17.533 -0.223 12.093 120 HG2 LYS 17 2HG LYS 17 -17.901 0.604 14.386 121 HG3 LYS 17 1HG LYS 17 -19.516 1.247 13.933 122 HD2 LYS 17 2HD LYS 17 -19.698 -0.879 15.202 123 HD3 LYS 17 1HD LYS 17 -20.410 -0.992 13.555 124 HE2 LYS 17 2HE LYS 17 -18.402 -2.248 12.730 125 HE3 LYS 17 1HE LYS 17 -17.615 -2.089 14.348 126 HZ1 LYS 17 3HZ LYS 17 -19.305 -3.496 15.291 127 HZ2 LYS 17 1HZ LYS 17 -18.679 -4.238 13.882 128 HZ3 LYS 17 2HZ LYS 17 -20.213 -3.518 13.883 129 H VAL 18 H VAL 18 -15.410 1.273 11.346 130 HA VAL 18 HA VAL 18 -14.382 2.265 13.784 131 HB VAL 18 HB VAL 18 -12.916 1.535 11.200 132 HG11 VAL 18 1HG1 VAL 18 -11.448 2.979 12.600 133 HG12 VAL 18 2HG1 VAL 18 -10.913 1.275 12.764 134 HG13 VAL 18 3HG1 VAL 18 -11.874 2.042 14.080 135 HG21 VAL 18 3HG2 VAL 18 -12.477 -0.624 12.418 136 HG22 VAL 18 1HG2 VAL 18 -14.238 -0.368 12.222 137 HG23 VAL 18 2HG2 VAL 18 -13.466 -0.053 13.813 138 H LEU 19 H LEU 19 -14.742 3.693 10.516 139 HA LEU 19 HA LEU 19 -13.123 5.926 10.893 140 HB2 LEU 19 2HB LEU 19 -15.805 5.914 9.370 141 HB3 LEU 19 1HB LEU 19 -14.473 7.083 9.175 142 HG LEU 19 HG LEU 19 -14.483 4.114 8.415 143 HD11 LEU 19 1HD1 LEU 19 -14.344 4.919 6.076 144 HD12 LEU 19 2HD1 LEU 19 -14.391 6.630 6.649 145 HD13 LEU 19 3HD1 LEU 19 -15.816 5.555 6.903 146 HD21 LEU 19 3HD2 LEU 19 -12.164 6.117 8.079 147 HD22 LEU 19 1HD2 LEU 19 -12.271 4.476 7.346 148 HD23 LEU 19 2HD2 LEU 19 -12.182 4.648 9.131 149 H GLU 20 H GLU 20 -16.569 5.379 11.680 150 HA GLU 20 HA GLU 20 -17.048 8.039 12.520 151 HB2 GLU 20 2HB GLU 20 -18.596 5.434 13.047 152 HB3 GLU 20 1HB GLU 20 -19.220 7.092 13.369 153 HG2 GLU 20 2HG GLU 20 -19.077 7.658 10.948 154 HG3 GLU 20 1HG GLU 20 -18.418 6.024 10.566 155 H GLU 21 H GLU 21 -15.772 5.195 14.124 156 HA GLU 21 HA GLU 21 -16.141 6.310 16.781 157 HB2 GLU 21 2HB GLU 21 -14.486 3.958 15.688 158 HB3 GLU 21 1HB GLU 21 -14.526 4.412 17.428 159 HG2 GLU 21 2HG GLU 21 -17.072 3.709 15.809 160 HG3 GLU 21 1HG GLU 21 -16.126 2.503 16.755 161 H ALA 22 H ALA 22 -13.593 5.978 14.308 162 HA ALA 22 HA ALA 22 -11.507 7.023 15.827 163 HB1 ALA 22 1HB ALA 22 -11.890 7.079 12.767 164 HB2 ALA 22 2HB ALA 22 -11.124 5.747 13.705 165 HB3 ALA 22 3HB ALA 22 -10.339 7.366 13.643 166 H SER 23 H SER 23 -14.035 8.661 13.830 167 HA SER 23 HA SER 23 -12.713 11.142 13.730 168 HB2 SER 23 2HB SER 23 -15.072 12.044 13.244 169 HB3 SER 23 1HB SER 23 -14.519 10.709 12.167 170 HG SER 23 1HG SER 23 -16.720 10.570 13.174 171 H LYS 24 H LYS 24 -14.950 9.660 16.023 172 HA LYS 24 HA LYS 24 -15.383 11.858 17.694 173 HB2 LYS 24 2HB LYS 24 -16.703 9.713 17.716 174 HB3 LYS 24 1HB LYS 24 -15.305 8.852 18.417 175 HG2 LYS 24 2HG LYS 24 -16.782 11.185 19.805 176 HG3 LYS 24 1HG LYS 24 -17.195 9.449 19.980 177 HD2 LYS 24 2HD LYS 24 -14.810 9.023 20.813 178 HD3 LYS 24 1HD LYS 24 -14.604 10.813 20.898 179 HE2 LYS 24 2HE LYS 24 -16.633 10.937 22.417 180 HE3 LYS 24 1HE LYS 24 -16.672 9.127 22.454 181 HZ1 LYS 24 3HZ LYS 24 -15.535 9.836 24.326 182 HZ2 LYS 24 1HZ LYS 24 -14.557 10.973 23.465 183 HZ3 LYS 24 2HZ LYS 24 -14.268 9.349 23.280 184 H LYS 25 H LYS 25 -12.925 9.239 17.730 185 HA LYS 25 HA LYS 25 -11.601 10.195 20.021 186 HB2 LYS 25 2HB LYS 25 -10.394 8.523 17.742 187 HB3 LYS 25 1HB LYS 25 -9.664 8.797 19.362 188 HG2 LYS 25 2HG LYS 25 -11.715 7.676 20.410 189 HG3 LYS 25 1HG LYS 25 -12.288 7.314 18.752 190 HD2 LYS 25 2HD LYS 25 -9.899 6.209 18.433 191 HD3 LYS 25 1HD LYS 25 -9.863 6.191 20.232 192 HE2 LYS 25 2HE LYS 25 -12.141 4.917 20.125 193 HE3 LYS 25 1HE LYS 25 -11.921 4.838 18.331 194 HZ1 LYS 25 3HZ LYS 25 -9.762 3.653 18.808 195 HZ2 LYS 25 1HZ LYS 25 -11.178 2.842 19.270 196 HZ3 LYS 25 2HZ LYS 25 -10.264 3.595 20.464 197 H ALA 26 H ALA 26 -10.950 10.707 16.504 198 HA ALA 26 HA ALA 26 -8.603 12.107 16.770 199 HB1 ALA 26 1HB ALA 26 -10.783 12.515 14.625 200 HB2 ALA 26 2HB ALA 26 -9.477 11.277 14.565 201 HB3 ALA 26 3HB ALA 26 -9.057 13.024 14.489 202 H VAL 27 H VAL 27 -11.989 13.422 16.780 203 HA VAL 27 HA VAL 27 -11.012 16.065 16.741 204 HB VAL 27 HB VAL 27 -13.235 15.404 15.903 205 HG11 VAL 27 1HG1 VAL 27 -13.999 13.905 17.717 206 HG12 VAL 27 2HG1 VAL 27 -15.156 15.257 17.491 207 HG13 VAL 27 3HG1 VAL 27 -14.037 15.269 18.892 208 HG21 VAL 27 3HG2 VAL 27 -14.350 17.505 16.620 209 HG22 VAL 27 1HG2 VAL 27 -12.600 17.768 16.271 210 HG23 VAL 27 2HG2 VAL 27 -13.186 17.694 17.978 211 H GLU 28 H GLU 28 -11.729 13.841 19.471 212 HA GLU 28 HA GLU 28 -11.453 16.040 21.351 213 HB2 GLU 28 2HB GLU 28 -11.793 14.397 23.117 214 HB3 GLU 28 1HB GLU 28 -13.060 14.233 21.857 215 HG2 GLU 28 2HG GLU 28 -11.766 12.271 20.886 216 HG3 GLU 28 1HG GLU 28 -10.594 12.406 22.238 217 H ALA 29 H ALA 29 -9.468 13.617 19.822 218 HA ALA 29 HA ALA 29 -7.398 13.716 21.780 219 HB1 ALA 29 1HB ALA 29 -6.184 12.223 20.239 220 HB2 ALA 29 2HB ALA 29 -7.365 12.570 18.924 221 HB3 ALA 29 3HB ALA 29 -7.861 11.661 20.399 222 H GLU 30 H GLU 30 -7.768 14.992 18.329 223 HA GLU 30 HA GLU 30 -5.319 16.423 18.687 224 HB2 GLU 30 2HB GLU 30 -7.276 16.360 16.394 225 HB3 GLU 30 1HB GLU 30 -6.225 17.789 16.604 226 HG2 GLU 30 2HG GLU 30 -4.197 16.188 16.800 227 HG3 GLU 30 1HG GLU 30 -5.290 14.908 16.148 228 H ARG 31 H ARG 31 -8.782 17.290 19.268 229 HA ARG 31 HA ARG 31 -7.977 20.025 19.451 230 HB2 ARG 31 2HB ARG 31 -10.348 19.470 18.950 231 HB3 ARG 31 1HB ARG 31 -10.525 18.808 20.604 232 HG2 ARG 31 2HG ARG 31 -11.495 21.059 20.410 233 HG3 ARG 31 1HG ARG 31 -10.153 21.033 21.607 234 HD2 ARG 31 2HD ARG 31 -8.604 22.110 19.956 235 HD3 ARG 31 1HD ARG 31 -9.894 22.016 18.677 236 HE ARG 31 HE ARG 31 -10.958 23.456 20.911 237 HH11 ARG 31 1HH2 ARG 31 -8.324 23.828 18.476 238 HH12 ARG 31 2HH2 ARG 31 -8.483 25.512 18.358 239 HH21 ARG 31 1HH1 ARG 31 -11.329 25.814 20.520 240 HH22 ARG 31 2HH1 ARG 31 -10.672 26.437 19.113 241 H GLY 32 H GLY 32 -6.489 20.584 20.923 242 HA2 GLY 32 2HA GLY 32 -6.644 21.337 23.322 243 HA3 GLY 32 1HA GLY 32 -6.684 19.549 23.650 244 H ALA 33 H ALA 33 -5.120 18.949 21.175 245 HA ALA 33 HA ALA 33 -2.691 18.873 22.571 246 HB1 ALA 33 1HB ALA 33 -1.833 17.632 20.537 247 HB2 ALA 33 2HB ALA 33 -3.348 18.060 19.671 248 HB3 ALA 33 3HB ALA 33 -3.414 16.982 21.106 249 HA PRO 34 HA PRO 34 -1.013 22.572 20.810 250 HB2 PRO 34 2HB PRO 34 1.742 22.228 21.142 251 HB3 PRO 34 1HB PRO 34 0.613 22.475 22.534 252 HG2 PRO 34 2HG PRO 34 1.660 19.815 21.420 253 HG3 PRO 34 1HG PRO 34 1.652 20.378 23.145 254 HD2 PRO 34 2HD PRO 34 -0.326 18.732 22.115 255 HD3 PRO 34 1HD PRO 34 -0.740 20.037 23.315 256 H GLY 35 H GLY 35 -0.508 23.301 18.698 257 HA2 GLY 35 2HA GLY 35 0.525 23.286 16.700 258 HA3 GLY 35 1HA GLY 35 1.246 21.674 17.065 259 H ALA 36 H ALA 36 -1.960 21.441 17.818 260 HA ALA 36 HA ALA 36 -2.411 19.597 15.821 261 HB1 ALA 36 1HB ALA 36 -4.752 19.453 16.661 262 HB2 ALA 36 2HB ALA 36 -4.512 20.968 17.609 263 HB3 ALA 36 3HB ALA 36 -3.582 19.479 18.016 264 H ALA 37 H ALA 37 -3.920 19.450 14.177 265 HA ALA 37 HA ALA 37 -4.300 22.021 12.752 266 HB1 ALA 37 1HB ALA 37 -3.832 19.153 11.679 267 HB2 ALA 37 2HB ALA 37 -2.637 20.492 11.629 268 HB3 ALA 37 3HB ALA 37 -4.144 20.612 10.651 269 H LEU 38 H LEU 38 -5.595 18.746 13.644 270 HA LEU 38 HA LEU 38 -8.012 19.232 12.134 271 HB2 LEU 38 2HB LEU 38 -6.912 16.964 12.247 272 HB3 LEU 38 1HB LEU 38 -7.243 16.917 13.988 273 HG LEU 38 HG LEU 38 -9.580 17.167 12.030 274 HD11 LEU 38 1HD1 LEU 38 -8.126 15.272 11.221 275 HD12 LEU 38 2HD1 LEU 38 -9.665 14.658 11.932 276 HD13 LEU 38 3HD1 LEU 38 -8.124 14.574 12.866 277 HD21 LEU 38 3HD2 LEU 38 -9.195 15.938 14.845 278 HD22 LEU 38 1HD2 LEU 38 -10.677 15.713 13.858 279 HD23 LEU 38 2HD2 LEU 38 -10.223 17.354 14.424 280 H ILE 39 H ILE 39 -9.995 19.872 13.003 281 HA ILE 39 HA ILE 39 -10.428 19.763 15.792 282 HB ILE 39 HB ILE 39 -11.188 22.180 15.883 283 HG12 ILE 39 2HG1 ILE 39 -9.594 22.509 13.251 284 HG13 ILE 39 1HG1 ILE 39 -11.384 22.547 13.379 285 HG21 ILE 39 1HG2 ILE 39 -8.990 23.148 16.354 286 HG22 ILE 39 2HG2 ILE 39 -8.173 21.975 15.264 287 HG23 ILE 39 3HG2 ILE 39 -8.919 21.389 16.786 288 HD11 ILE 39 3HD ILE 39 -9.423 24.561 14.657 289 HD12 ILE 39 1HD ILE 39 -10.549 24.841 13.288 290 HD13 ILE 39 2HD ILE 39 -11.208 24.543 14.940 291 H SER 40 H SER 40 -12.823 20.635 15.924 292 HA SER 40 HA SER 40 -14.867 20.610 15.379 293 HB2 SER 40 2HB SER 40 -13.968 21.167 12.516 294 HB3 SER 40 1HB SER 40 -15.646 21.387 13.132 295 HG SER 40 1HG SER 40 -14.164 23.234 13.064 296 H TYR 41 H TYR 41 -16.547 19.221 15.087 297 HA TYR 41 HA TYR 41 -15.735 16.611 14.345 298 HB2 TYR 41 2HB TYR 41 -17.360 16.874 16.179 299 HB3 TYR 41 1HB TYR 41 -18.587 17.505 15.014 300 HD1 TYR 41 1HD TYR 41 -16.468 14.471 15.863 301 HD2 TYR 41 2HD TYR 41 -19.716 16.051 13.541 302 HE1 TYR 41 1HE TYR 41 -16.979 12.207 15.041 303 HE2 TYR 41 2HE TYR 41 -20.198 13.818 12.675 304 HH TYR 41 HH TYR 41 -19.687 11.616 12.715 305 HA PRO 42 HA PRO 42 -18.435 16.872 10.565 306 HB2 PRO 42 2HB PRO 42 -18.824 19.371 9.216 307 HB3 PRO 42 1HB PRO 42 -19.998 18.588 10.338 308 HG2 PRO 42 2HG PRO 42 -17.896 20.721 10.986 309 HG3 PRO 42 1HG PRO 42 -19.644 20.679 11.475 310 HD2 PRO 42 2HD PRO 42 -17.703 19.883 13.209 311 HD3 PRO 42 1HD PRO 42 -19.219 18.878 13.075 312 H ASP 43 H ASP 43 -15.563 18.708 11.028 313 HA ASP 43 HA ASP 43 -14.577 18.398 8.321 314 HB2 ASP 43 2HB ASP 43 -13.128 19.269 10.928 315 HB3 ASP 43 1HB ASP 43 -12.414 19.292 9.278 316 H ALA 44 H ALA 44 -14.019 17.223 11.669 317 HA ALA 44 HA ALA 44 -11.943 15.540 11.279 318 HB1 ALA 44 1HB ALA 44 -14.307 15.107 13.222 319 HB2 ALA 44 2HB ALA 44 -12.860 16.125 13.547 320 HB3 ALA 44 3HB ALA 44 -12.677 14.346 13.361 321 H ILE 45 H ILE 45 -15.433 14.759 10.955 322 HA ILE 45 HA ILE 45 -15.028 12.016 10.587 323 HB ILE 45 HB ILE 45 -17.170 12.898 11.283 324 HG12 ILE 45 2HG1 ILE 45 -18.748 11.715 9.784 325 HG13 ILE 45 1HG1 ILE 45 -17.481 11.537 8.532 326 HG21 ILE 45 1HG2 ILE 45 -17.388 14.167 8.475 327 HG22 ILE 45 2HG2 ILE 45 -17.108 15.054 10.014 328 HG23 ILE 45 3HG2 ILE 45 -18.647 14.170 9.758 329 HD11 ILE 45 3HD ILE 45 -17.420 10.282 11.361 330 HD12 ILE 45 1HD ILE 45 -17.788 9.434 9.823 331 HD13 ILE 45 2HD ILE 45 -16.138 10.079 10.101 332 H TRP 46 H TRP 46 -14.607 14.675 8.366 333 HA TRP 46 HA TRP 46 -14.794 12.934 6.056 334 HB2 TRP 46 2HB TRP 46 -15.111 15.738 6.576 335 HB3 TRP 46 1HB TRP 46 -13.653 15.619 5.564 336 HD1 TRP 46 HD TRP 46 -14.444 16.260 3.229 337 HE1 TRP 46 1HE TRP 46 -16.583 15.979 1.786 338 HE3 TRP 46 3HE TRP 46 -17.076 13.207 6.350 339 HZ2 TRP 46 2HZ TRP 46 -18.904 14.302 1.822 340 HZ3 TRP 46 3HZ TRP 46 -19.209 12.238 5.574 341 HH2 TRP 46 HH TRP 46 -20.105 12.776 3.341 342 H TRP 47 H TRP 47 -12.368 14.038 8.336 343 HA TRP 47 HA TRP 47 -10.164 13.454 6.532 344 HB2 TRP 47 2HB TRP 47 -9.837 15.129 8.356 345 HB3 TRP 47 1HB TRP 47 -10.223 13.875 9.581 346 HD1 TRP 47 HD TRP 47 -7.318 14.671 6.985 347 HE1 TRP 47 1HE TRP 47 -5.137 13.872 8.153 348 HE3 TRP 47 3HE TRP 47 -9.384 12.107 10.886 349 HZ2 TRP 47 2HZ TRP 47 -4.427 12.042 10.203 350 HZ3 TRP 47 3HZ TRP 47 -7.916 10.808 12.389 351 HH2 TRP 47 HH TRP 47 -5.467 10.786 12.055 352 H SER 48 H SER 48 -12.098 11.822 9.098 353 HA SER 48 HA SER 48 -10.464 9.502 9.070 354 HB2 SER 48 2HB SER 48 -13.404 9.814 9.925 355 HB3 SER 48 1HB SER 48 -12.351 8.391 10.269 356 HG SER 48 1HG SER 48 -12.350 9.698 12.012 357 H VAL 49 H VAL 49 -10.581 9.766 6.453 358 HA VAL 49 HA VAL 49 -12.399 7.620 5.605 359 HB VAL 49 HB VAL 49 -11.924 10.221 4.022 360 HG11 VAL 49 1HG1 VAL 49 -13.530 7.643 3.348 361 HG12 VAL 49 2HG1 VAL 49 -12.051 8.229 2.506 362 HG13 VAL 49 3HG1 VAL 49 -13.566 9.178 2.390 363 HG21 VAL 49 3HG2 VAL 49 -14.409 10.539 4.302 364 HG22 VAL 49 1HG2 VAL 49 -13.533 10.592 5.863 365 HG23 VAL 49 2HG2 VAL 49 -14.454 9.116 5.424 366 H GLU 50 H GLU 50 -9.891 9.799 4.013 367 HA GLU 50 HA GLU 50 -8.966 7.654 2.546 368 HB2 GLU 50 2HB GLU 50 -7.156 9.125 1.785 369 HB3 GLU 50 1HB GLU 50 -8.719 9.989 1.744 370 HG2 GLU 50 2HG GLU 50 -6.750 10.314 4.130 371 HG3 GLU 50 1HG GLU 50 -6.596 11.230 2.606 372 H THR 51 H THR 51 -8.302 8.545 5.720 373 HA THR 51 HA THR 51 -5.661 7.716 6.044 374 HB THR 51 HB THR 51 -7.042 9.251 7.497 375 HG1 THR 51 1HG THR 51 -5.275 8.679 8.420 376 HG21 THR 51 3HG2 THR 51 -9.148 7.885 7.609 377 HG22 THR 51 1HG2 THR 51 -8.508 8.317 9.236 378 HG23 THR 51 2HG2 THR 51 -8.281 6.652 8.597 379 H ALA 52 H ALA 52 -8.789 5.997 5.953 380 HA ALA 52 HA ALA 52 -7.762 3.565 7.057 381 HB1 ALA 52 1HB ALA 52 -10.322 4.189 5.447 382 HB2 ALA 52 2HB ALA 52 -10.175 4.049 7.244 383 HB3 ALA 52 3HB ALA 52 -9.947 2.600 6.205 384 H THR 53 H THR 53 -7.926 5.050 3.811 385 HA THR 53 HA THR 53 -7.235 2.507 2.586 386 HB THR 53 HB THR 53 -7.118 4.065 0.492 387 HG1 THR 53 1HG THR 53 -7.142 5.997 1.783 388 HG21 THR 53 3HG2 THR 53 -8.943 2.416 0.995 389 HG22 THR 53 1HG2 THR 53 -9.614 3.935 0.299 390 HG23 THR 53 2HG2 THR 53 -9.754 3.617 2.070 391 H THR 54 H THR 54 -5.509 4.290 4.591 392 HA THR 54 HA THR 54 -3.410 4.632 4.947 393 HB THR 54 HB THR 54 -1.796 2.849 4.115 394 HG1 THR 54 1HG THR 54 -3.175 2.451 2.199 395 HG21 THR 54 3HG2 THR 54 -2.946 1.069 5.461 396 HG22 THR 54 1HG2 THR 54 -4.499 1.972 5.373 397 HG23 THR 54 2HG2 THR 54 -3.088 2.676 6.245 398 H VAL 55 H VAL 55 -4.064 6.638 3.381 399 HA VAL 55 HA VAL 55 -1.801 6.873 1.500 400 HB VAL 55 HB VAL 55 -4.502 8.355 1.367 401 HG11 VAL 55 1HG1 VAL 55 -2.122 8.050 -0.583 402 HG12 VAL 55 2HG1 VAL 55 -2.447 9.548 0.346 403 HG13 VAL 55 3HG1 VAL 55 -3.611 8.993 -0.913 404 HG21 VAL 55 3HG2 VAL 55 -3.432 5.812 0.004 405 HG22 VAL 55 1HG2 VAL 55 -4.712 6.821 -0.741 406 HG23 VAL 55 2HG2 VAL 55 -4.999 6.044 0.858 407 H GLY 56 H GLY 56 -3.638 9.661 2.364 408 HA2 GLY 56 2HA GLY 56 -3.383 10.957 4.370 409 HA3 GLY 56 1HA GLY 56 -1.693 10.323 4.499 410 H TYR 57 H TYR 57 -3.901 12.082 2.211 411 HA TYR 57 HA TYR 57 -1.850 12.844 0.475 412 HB2 TYR 57 2HB TYR 57 -4.624 14.157 1.008 413 HB3 TYR 57 1HB TYR 57 -3.519 14.681 -0.308 414 HD1 TYR 57 1HD TYR 57 -5.668 11.884 0.863 415 HD2 TYR 57 2HD TYR 57 -3.218 13.438 -2.300 416 HE1 TYR 57 1HE TYR 57 -6.464 10.090 -0.614 417 HE2 TYR 57 2HE TYR 57 -4.055 11.675 -3.816 418 HH TYR 57 HH TYR 57 -6.181 9.054 -2.647 419 H GLY 58 H GLY 58 -2.618 14.079 3.576 420 HA2 GLY 58 2HA GLY 58 -1.127 15.479 4.606 421 HA3 GLY 58 1HA GLY 58 -0.825 16.353 3.067 422 H ASP 59 H ASP 59 -4.154 15.631 3.879 423 HA ASP 59 HA ASP 59 -4.895 18.312 4.073 424 HB2 ASP 59 2HB ASP 59 -6.301 15.696 4.814 425 HB3 ASP 59 1HB ASP 59 -6.976 17.228 5.465 426 H ARG 60 H ARG 60 -4.424 15.848 6.779 427 HA ARG 60 HA ARG 60 -3.814 18.026 8.540 428 HB2 ARG 60 2HB ARG 60 -5.998 16.027 9.408 429 HB3 ARG 60 1HB ARG 60 -5.461 17.498 10.269 430 HG2 ARG 60 2HG ARG 60 -6.542 18.914 8.480 431 HG3 ARG 60 1HG ARG 60 -6.905 17.418 7.555 432 HD2 ARG 60 2HD ARG 60 -8.365 16.643 9.534 433 HD3 ARG 60 1HD ARG 60 -8.321 18.354 10.117 434 HE ARG 60 HE ARG 60 -9.528 17.269 7.594 435 HH11 ARG 60 1HH2 ARG 60 -8.629 20.383 9.321 436 HH12 ARG 60 2HH2 ARG 60 -9.497 21.313 8.243 437 HH21 ARG 60 1HH1 ARG 60 -10.339 18.671 5.981 438 HH22 ARG 60 2HH1 ARG 60 -10.379 20.384 6.245 439 H TYR 61 H TYR 61 -2.877 16.861 10.670 440 HA TYR 61 HA TYR 61 -2.407 14.127 10.314 441 HB2 TYR 61 2HB TYR 61 0.162 14.435 10.570 442 HB3 TYR 61 1HB TYR 61 -0.512 14.692 8.932 443 HD1 TYR 61 2HD TYR 61 0.914 16.380 11.916 444 HD2 TYR 61 1HD TYR 61 -0.480 16.850 7.885 445 HE1 TYR 61 2HE TYR 61 1.976 18.599 11.823 446 HE2 TYR 61 1HE TYR 61 0.558 19.070 7.774 447 HH TYR 61 HH TYR 61 1.807 20.621 8.830 448 HA PRO 62 HA PRO 62 -2.693 15.011 14.626 449 HB2 PRO 62 2HB PRO 62 -1.641 12.649 15.746 450 HB3 PRO 62 1HB PRO 62 -3.191 12.670 14.806 451 HG2 PRO 62 2HG PRO 62 -0.369 11.960 13.843 452 HG3 PRO 62 1HG PRO 62 -1.891 11.011 13.586 453 HD2 PRO 62 2HD PRO 62 -0.829 12.779 11.717 454 HD3 PRO 62 1HD PRO 62 -2.634 12.547 11.897 455 H VAL 63 H VAL 63 -1.133 14.922 16.873 456 HA VAL 63 HA VAL 63 1.505 15.781 15.954 457 HB VAL 63 HB VAL 63 0.064 16.792 18.438 458 HG11 VAL 63 1HG1 VAL 63 1.888 18.542 18.272 459 HG12 VAL 63 2HG1 VAL 63 2.566 17.708 16.833 460 HG13 VAL 63 3HG1 VAL 63 2.613 16.907 18.442 461 HG21 VAL 63 3HG2 VAL 63 -0.270 18.878 17.053 462 HG22 VAL 63 1HG2 VAL 63 -1.267 17.495 16.496 463 HG23 VAL 63 2HG2 VAL 63 0.217 17.954 15.583 464 H THR 64 H THR 64 0.523 15.166 19.270 465 HA THR 64 HA THR 64 2.151 12.805 19.403 466 HB THR 64 HB THR 64 2.962 15.182 21.169 467 HG1 THR 64 1HG THR 64 4.804 15.258 19.859 468 HG21 THR 64 3HG2 THR 64 3.397 12.870 22.139 469 HG22 THR 64 1HG2 THR 64 4.940 13.680 21.700 470 HG23 THR 64 2HG2 THR 64 4.260 12.404 20.631 471 H GLU 65 H GLU 65 0.152 15.318 20.975 472 HA GLU 65 HA GLU 65 -0.122 13.695 23.338 473 HB2 GLU 65 2HB GLU 65 0.346 16.205 23.348 474 HB3 GLU 65 1HB GLU 65 -1.352 16.460 22.828 475 HG2 GLU 65 2HG GLU 65 -2.189 15.463 24.919 476 HG3 GLU 65 1HG GLU 65 -0.545 14.867 25.350 477 H GLU 66 H GLU 66 -1.897 14.270 20.368 478 HA GLU 66 HA GLU 66 -4.447 13.533 21.266 479 HB2 GLU 66 2HB GLU 66 -4.999 13.225 18.901 480 HB3 GLU 66 1HB GLU 66 -3.995 14.686 19.089 481 HG2 GLU 66 2HG GLU 66 -3.154 11.949 17.931 482 HG3 GLU 66 1HG GLU 66 -3.353 13.537 17.090 483 H GLY 67 H GLY 67 -1.543 11.884 20.207 484 HA2 GLY 67 2HA GLY 67 -0.766 9.931 21.122 485 HA3 GLY 67 1HA GLY 67 -2.481 9.389 21.461 486 H ARG 68 H ARG 68 -0.296 10.474 18.827 487 HA ARG 68 HA ARG 68 -1.425 10.134 16.621 488 HB2 ARG 68 2HB ARG 68 0.951 10.574 16.840 489 HB3 ARG 68 1HB ARG 68 1.299 8.862 17.264 490 HG2 ARG 68 2HG ARG 68 0.629 8.103 14.979 491 HG3 ARG 68 1HG ARG 68 0.119 9.764 14.552 492 HD2 ARG 68 2HD ARG 68 3.004 8.822 15.161 493 HD3 ARG 68 1HD ARG 68 2.320 9.253 13.548 494 HE ARG 68 HE ARG 68 2.695 11.133 15.885 495 HH11 ARG 68 1HH2 ARG 68 1.893 10.781 12.269 496 HH12 ARG 68 2HH2 ARG 68 2.057 12.483 12.079 497 HH21 ARG 68 1HH1 ARG 68 2.448 13.394 15.481 498 HH22 ARG 68 2HH1 ARG 68 2.402 13.975 13.873 499 H LYS 69 H LYS 69 -0.827 7.338 18.616 500 HA LYS 69 HA LYS 69 -1.350 5.299 16.830 501 HB2 LYS 69 2HB LYS 69 -2.049 5.436 19.807 502 HB3 LYS 69 1HB LYS 69 -2.077 3.957 18.776 503 HG2 LYS 69 2HG LYS 69 0.338 4.407 18.167 504 HG3 LYS 69 1HG LYS 69 0.425 5.656 19.438 505 HD2 LYS 69 2HD LYS 69 0.281 4.087 21.195 506 HD3 LYS 69 1HD LYS 69 -0.607 2.881 20.212 507 HE2 LYS 69 2HE LYS 69 2.374 3.574 19.732 508 HE3 LYS 69 1HE LYS 69 1.792 2.206 20.765 509 HZ1 LYS 69 3HZ LYS 69 2.281 1.489 18.476 510 HZ2 LYS 69 1HZ LYS 69 1.116 2.534 17.849 511 HZ3 LYS 69 2HZ LYS 69 0.648 1.290 18.848 512 H VAL 70 H VAL 70 -3.585 7.762 17.922 513 HA VAL 70 HA VAL 70 -5.993 6.428 17.465 514 HB VAL 70 HB VAL 70 -5.187 9.355 17.162 515 HG11 VAL 70 1HG1 VAL 70 -7.133 9.031 15.637 516 HG12 VAL 70 2HG1 VAL 70 -7.676 9.856 17.132 517 HG13 VAL 70 3HG1 VAL 70 -8.015 8.102 16.905 518 HG21 VAL 70 3HG2 VAL 70 -6.914 7.839 19.250 519 HG22 VAL 70 1HG2 VAL 70 -6.447 9.578 19.301 520 HG23 VAL 70 2HG2 VAL 70 -5.198 8.306 19.499 521 H ALA 71 H ALA 71 -3.719 8.048 15.192 522 HA ALA 71 HA ALA 71 -5.399 7.653 12.912 523 HB1 ALA 71 1HB ALA 71 -3.674 9.488 12.935 524 HB2 ALA 71 2HB ALA 71 -3.389 8.331 11.591 525 HB3 ALA 71 3HB ALA 71 -2.370 8.254 13.074 526 H GLU 72 H GLU 72 -2.492 6.099 14.312 527 HA GLU 72 HA GLU 72 -1.927 4.176 12.487 528 HB2 GLU 72 2HB GLU 72 -0.676 4.564 14.707 529 HB3 GLU 72 1HB GLU 72 -1.994 3.662 15.523 530 HG2 GLU 72 2HG GLU 72 -1.343 1.650 13.946 531 HG3 GLU 72 1HG GLU 72 0.127 2.613 13.558 532 H GLN 73 H GLN 73 -4.432 4.005 15.041 533 HA GLN 73 HA GLN 73 -5.151 1.354 14.594 534 HB2 GLN 73 2HB GLN 73 -5.862 2.816 16.607 535 HB3 GLN 73 1HB GLN 73 -7.089 3.545 15.520 536 HG2 GLN 73 2HG GLN 73 -8.022 1.166 15.137 537 HG3 GLN 73 1HG GLN 73 -6.841 0.570 16.354 538 HE21 GLN 73 1HE2 GLN 73 -9.047 -0.196 17.205 539 HE22 GLN 73 2HE2 GLN 73 -9.977 0.861 18.212 540 H VAL 74 H VAL 74 -6.184 4.357 12.879 541 HA VAL 74 HA VAL 74 -8.429 3.027 11.711 542 HB VAL 74 HB VAL 74 -7.312 5.560 10.488 543 HG11 VAL 74 1HG1 VAL 74 -10.150 4.439 11.106 544 HG12 VAL 74 2HG1 VAL 74 -9.318 4.385 9.506 545 HG13 VAL 74 3HG1 VAL 74 -9.792 5.967 10.224 546 HG21 VAL 74 3HG2 VAL 74 -7.123 6.095 12.842 547 HG22 VAL 74 1HG2 VAL 74 -8.732 5.361 13.227 548 HG23 VAL 74 2HG2 VAL 74 -8.611 6.862 12.227 549 H MET 75 H MET 75 -5.075 3.868 10.752 550 HA MET 75 HA MET 75 -5.226 2.964 8.117 551 HB2 MET 75 2HB MET 75 -2.880 3.071 10.105 552 HB3 MET 75 1HB MET 75 -2.695 2.334 8.484 553 HG2 MET 75 2HG MET 75 -1.923 4.437 8.055 554 HG3 MET 75 1HG MET 75 -3.603 4.495 7.462 555 HE1 MET 75 3HE MET 75 -1.609 6.736 10.977 556 HE2 MET 75 1HE MET 75 -0.869 6.321 9.408 557 HE3 MET 75 2HE MET 75 -1.324 5.013 10.548 558 H LYS 76 H LYS 76 -4.514 1.163 11.156 559 HA LYS 76 HA LYS 76 -4.005 -1.266 9.862 560 HB2 LYS 76 2HB LYS 76 -3.361 -0.948 12.229 561 HB3 LYS 76 1HB LYS 76 -5.091 -0.880 12.715 562 HG2 LYS 76 2HG LYS 76 -5.443 -3.227 12.137 563 HG3 LYS 76 1HG LYS 76 -3.900 -3.292 11.224 564 HD2 LYS 76 2HD LYS 76 -2.614 -3.042 13.338 565 HD3 LYS 76 1HD LYS 76 -4.132 -3.069 14.298 566 HE2 LYS 76 2HE LYS 76 -3.322 -5.355 12.348 567 HE3 LYS 76 1HE LYS 76 -2.777 -5.302 14.069 568 HZ1 LYS 76 3HZ LYS 76 -4.701 -6.681 13.766 569 HZ2 LYS 76 1HZ LYS 76 -5.683 -5.387 13.246 570 HZ3 LYS 76 2HZ LYS 76 -4.982 -5.406 14.815 571 H ALA 77 H ALA 77 -7.083 0.251 10.811 572 HA ALA 77 HA ALA 77 -8.663 -2.037 10.641 573 HB1 ALA 77 1HB ALA 77 -9.492 0.846 9.935 574 HB2 ALA 77 2HB ALA 77 -9.483 0.138 11.593 575 HB3 ALA 77 3HB ALA 77 -10.601 -0.516 10.340 576 H GLY 78 H GLY 78 -7.517 0.204 8.100 577 HA2 GLY 78 2HA GLY 78 -9.093 -0.824 5.992 578 HA3 GLY 78 1HA GLY 78 -7.533 0.078 5.902 579 H ILE 79 H ILE 79 -5.694 -1.399 6.996 580 HA ILE 79 HA ILE 79 -5.092 -3.364 5.161 581 HB ILE 79 HB ILE 79 -4.070 -3.078 8.037 582 HG12 ILE 79 2HG1 ILE 79 -2.995 -1.926 5.381 583 HG13 ILE 79 1HG1 ILE 79 -3.834 -0.980 6.634 584 HG21 ILE 79 1HG2 ILE 79 -2.029 -4.303 7.178 585 HG22 ILE 79 2HG2 ILE 79 -2.835 -4.495 5.577 586 HG23 ILE 79 3HG2 ILE 79 -3.491 -5.324 7.036 587 HD11 ILE 79 3HD ILE 79 -1.086 -2.356 6.938 588 HD12 ILE 79 1HD ILE 79 -1.439 -0.598 6.853 589 HD13 ILE 79 2HD ILE 79 -1.982 -1.548 8.285 590 H GLU 80 H GLU 80 -6.728 -3.579 8.326 591 HA GLU 80 HA GLU 80 -6.663 -6.365 8.475 592 HB2 GLU 80 2HB GLU 80 -6.965 -4.662 10.355 593 HB3 GLU 80 1HB GLU 80 -8.688 -4.536 9.890 594 HG2 GLU 80 2HG GLU 80 -9.016 -6.942 10.474 595 HG3 GLU 80 1HG GLU 80 -7.237 -7.155 10.700 596 H VAL 81 H VAL 81 -9.316 -4.124 7.373 597 HA VAL 81 HA VAL 81 -11.047 -6.327 6.916 598 HB VAL 81 HB VAL 81 -12.569 -4.780 5.805 599 HG11 VAL 81 1HG1 VAL 81 -11.327 -3.742 8.451 600 HG12 VAL 81 2HG1 VAL 81 -12.583 -5.027 8.267 601 HG13 VAL 81 3HG1 VAL 81 -12.954 -3.330 7.815 602 HG21 VAL 81 3HG2 VAL 81 -12.018 -2.328 5.723 603 HG22 VAL 81 1HG2 VAL 81 -11.038 -3.275 4.580 604 HG23 VAL 81 2HG2 VAL 81 -10.309 -2.694 6.115 605 H PHE 82 H PHE 82 -8.915 -4.366 4.745 606 HA PHE 82 HA PHE 82 -9.905 -5.664 2.425 607 HB2 PHE 82 2HB PHE 82 -7.272 -4.095 2.816 608 HB3 PHE 82 1HB PHE 82 -7.961 -4.586 1.221 609 HD1 PHE 82 2HD PHE 82 -10.879 -3.904 1.534 610 HD2 PHE 82 1HD PHE 82 -7.331 -1.779 2.751 611 HE1 PHE 82 2HE PHE 82 -12.106 -1.777 1.422 612 HE2 PHE 82 1HE PHE 82 -8.569 0.344 2.636 613 HZ PHE 82 HZ PHE 82 -10.963 0.360 1.969 614 H ALA 83 H ALA 83 -7.215 -6.382 4.706 615 HA ALA 83 HA ALA 83 -6.026 -8.258 2.925 616 HB1 ALA 83 1HB ALA 83 -4.779 -9.150 4.866 617 HB2 ALA 83 2HB ALA 83 -5.810 -8.175 5.986 618 HB3 ALA 83 3HB ALA 83 -4.699 -7.359 4.826 619 H LEU 84 H LEU 84 -8.721 -8.392 5.241 620 HA LEU 84 HA LEU 84 -8.860 -11.176 5.503 621 HB2 LEU 84 2HB LEU 84 -10.180 -9.406 6.862 622 HB3 LEU 84 1HB LEU 84 -11.229 -9.221 5.429 623 HG LEU 84 HG LEU 84 -11.588 -11.855 5.654 624 HD11 LEU 84 1HD1 LEU 84 -9.854 -12.281 7.371 625 HD12 LEU 84 2HD1 LEU 84 -11.489 -12.692 7.994 626 HD13 LEU 84 3HD1 LEU 84 -10.677 -11.166 8.524 627 HD21 LEU 84 3HD2 LEU 84 -13.532 -11.450 7.172 628 HD22 LEU 84 1HD2 LEU 84 -13.377 -10.236 5.861 629 HD23 LEU 84 2HD2 LEU 84 -12.881 -9.790 7.531 630 H VAL 85 H VAL 85 -10.062 -8.936 3.024 631 HA VAL 85 HA VAL 85 -11.797 -10.653 1.703 632 HB VAL 85 HB VAL 85 -10.209 -8.308 0.534 633 HG11 VAL 85 1HG1 VAL 85 -11.249 -9.507 -1.321 634 HG12 VAL 85 2HG1 VAL 85 -12.280 -8.091 -0.971 635 HG13 VAL 85 3HG1 VAL 85 -12.782 -9.734 -0.421 636 HG21 VAL 85 3HG2 VAL 85 -12.340 -7.017 1.112 637 HG22 VAL 85 1HG2 VAL 85 -11.425 -7.567 2.538 638 HG23 VAL 85 2HG2 VAL 85 -12.912 -8.446 2.047 639 H THR 86 H THR 86 -8.374 -10.984 1.939 640 HA THR 86 HA THR 86 -7.759 -11.970 -0.570 641 HB THR 86 HB THR 86 -6.600 -12.984 2.053 642 HG1 THR 86 1HG THR 86 -6.294 -10.883 2.177 643 HG21 THR 86 3HG2 THR 86 -4.500 -13.213 0.643 644 HG22 THR 86 1HG2 THR 86 -5.439 -12.739 -0.819 645 HG23 THR 86 2HG2 THR 86 -5.818 -14.276 0.052 646 H ALA 87 H ALA 87 -9.715 -13.427 1.981 647 HA ALA 87 HA ALA 87 -9.616 -16.104 1.164 648 HB1 ALA 87 1HB ALA 87 -12.045 -14.525 2.248 649 HB2 ALA 87 2HB ALA 87 -10.789 -15.287 3.273 650 HB3 ALA 87 3HB ALA 87 -11.853 -16.322 2.265 651 H ALA 88 H ALA 88 -10.926 -13.301 -0.433 652 HA ALA 88 HA ALA 88 -12.613 -14.863 -2.227 653 HB1 ALA 88 1HB ALA 88 -12.147 -11.816 -2.102 654 HB2 ALA 88 2HB ALA 88 -13.562 -12.669 -1.391 655 HB3 ALA 88 3HB ALA 88 -13.301 -12.675 -3.173 656 H LEU 89 H LEU 89 -9.644 -12.772 -2.170 657 HA LEU 89 HA LEU 89 -9.375 -12.941 -4.979 658 HB2 LEU 89 2HB LEU 89 -7.318 -12.150 -2.835 659 HB3 LEU 89 1HB LEU 89 -6.931 -12.198 -4.580 660 HG LEU 89 HG LEU 89 -7.317 -9.953 -3.987 661 HD11 LEU 89 1HD1 LEU 89 -8.992 -9.260 -5.627 662 HD12 LEU 89 2HD1 LEU 89 -9.785 -10.874 -5.602 663 HD13 LEU 89 3HD1 LEU 89 -8.106 -10.698 -6.245 664 HD21 LEU 89 3HD2 LEU 89 -9.386 -8.990 -3.112 665 HD22 LEU 89 1HD2 LEU 89 -8.738 -10.202 -1.966 666 HD23 LEU 89 2HD2 LEU 89 -10.162 -10.609 -3.003 667 H ALA 90 H ALA 90 -7.893 -14.847 -2.322 668 HA ALA 90 HA ALA 90 -6.051 -16.078 -4.104 669 HB1 ALA 90 1HB ALA 90 -6.939 -16.860 -1.273 670 HB2 ALA 90 2HB ALA 90 -5.516 -15.850 -1.711 671 HB3 ALA 90 3HB ALA 90 -5.543 -17.591 -2.168 672 H THR 91 H THR 91 -9.414 -16.494 -3.884 673 HA THR 91 HA THR 91 -9.164 -19.294 -4.716 674 HB THR 91 HB THR 91 -10.744 -19.146 -3.002 675 HG1 THR 91 1HG THR 91 -11.664 -19.553 -5.603 676 HG21 THR 91 3HG2 THR 91 -11.371 -16.792 -3.053 677 HG22 THR 91 1HG2 THR 91 -12.842 -17.790 -3.222 678 HG23 THR 91 2HG2 THR 91 -12.154 -16.960 -4.671 679 H ASP 92 H ASP 92 -9.051 -16.144 -6.154 680 HA ASP 92 HA ASP 92 -10.806 -16.987 -8.289 681 HB2 ASP 92 2HB ASP 92 -9.410 -14.396 -7.703 682 HB3 ASP 92 1HB ASP 92 -9.762 -14.785 -9.425 683 H PHE 93 H PHE 93 -7.469 -17.544 -7.649 684 HA PHE 93 HA PHE 93 -7.038 -18.247 -10.429 685 HB2 PHE 93 2HB PHE 93 -4.867 -18.841 -9.977 686 HB3 PHE 93 1HB PHE 93 -5.123 -17.580 -8.742 687 HD1 PHE 93 2HD PHE 93 -5.494 -18.327 -6.311 688 HD2 PHE 93 1HD PHE 93 -4.471 -21.124 -9.411 689 HE1 PHE 93 2HE PHE 93 -4.857 -19.989 -4.605 690 HE2 PHE 93 1HE PHE 93 -3.865 -22.797 -7.702 691 HZ PHE 93 HZ PHE 93 -4.074 -22.244 -5.299 692 H VAL 94 H VAL 94 -8.339 -19.717 -7.501 693 HA VAL 94 HA VAL 94 -7.711 -22.375 -8.101 694 HB VAL 94 HB VAL 94 -9.918 -21.267 -6.286 695 HG11 VAL 94 1HG1 VAL 94 -10.345 -23.677 -6.770 696 HG12 VAL 94 2HG1 VAL 94 -9.692 -23.498 -5.107 697 HG13 VAL 94 3HG1 VAL 94 -8.621 -24.077 -6.433 698 HG21 VAL 94 3HG2 VAL 94 -7.010 -22.168 -5.703 699 HG22 VAL 94 1HG2 VAL 94 -8.200 -21.599 -4.480 700 HG23 VAL 94 2HG2 VAL 94 -7.572 -20.464 -5.715 701 H ARG 95 H ARG 95 -10.363 -20.268 -8.972 702 HA ARG 95 HA ARG 95 -12.238 -22.001 -10.018 703 HB2 ARG 95 2HB ARG 95 -11.195 -19.354 -11.236 704 HB3 ARG 95 1HB ARG 95 -12.736 -20.166 -11.690 705 HG2 ARG 95 2HG ARG 95 -13.646 -19.794 -9.436 706 HG3 ARG 95 1HG ARG 95 -12.123 -18.970 -8.921 707 HD2 ARG 95 2HD ARG 95 -12.421 -17.217 -10.662 708 HD3 ARG 95 1HD ARG 95 -13.882 -18.050 -11.318 709 HE ARG 95 HE ARG 95 -13.581 -16.436 -8.850 710 HH11 ARG 95 1HH2 ARG 95 -15.711 -18.821 -10.675 711 HH12 ARG 95 2HH2 ARG 95 -17.152 -18.248 -9.984 712 HH21 ARG 95 1HH1 ARG 95 -15.643 -15.701 -7.920 713 HH22 ARG 95 2HH1 ARG 95 -17.134 -16.320 -8.477 714 H ARG 96 H ARG 96 -8.977 -21.277 -11.236 715 HA ARG 96 HA ARG 96 -9.451 -21.624 -13.954 716 HB2 ARG 96 2HB ARG 96 -7.312 -20.657 -12.825 717 HB3 ARG 96 1HB ARG 96 -6.845 -22.346 -12.462 718 HG2 ARG 96 2HG ARG 96 -7.016 -22.712 -15.092 719 HG3 ARG 96 1HG ARG 96 -7.111 -20.925 -15.174 720 HD2 ARG 96 2HD ARG 96 -4.798 -21.451 -15.519 721 HD3 ARG 96 1HD ARG 96 -4.864 -20.898 -13.798 722 HE ARG 96 HE ARG 96 -5.254 -23.716 -13.664 723 HH11 ARG 96 1HH2 ARG 96 -2.685 -21.879 -15.502 724 HH12 ARG 96 2HH2 ARG 96 -1.450 -22.895 -14.891 725 HH21 ARG 96 1HH1 ARG 96 -3.486 -24.994 -12.884 726 HH22 ARG 96 2HH1 ARG 96 -1.881 -24.741 -13.555 727 H GLU 97 H GLU 97 -8.874 -23.955 -11.320 728 HA GLU 97 HA GLU 97 -8.440 -26.069 -13.295 729 HB2 GLU 97 2HB GLU 97 -7.666 -25.663 -10.489 730 HB3 GLU 97 1HB GLU 97 -8.442 -27.254 -10.734 731 HG2 GLU 97 2HG GLU 97 -6.083 -27.553 -11.064 732 HG3 GLU 97 1HG GLU 97 -6.873 -27.728 -12.663 733 H GLU 98 H GLU 98 -11.067 -24.501 -12.131 734 HA GLU 98 HA GLU 98 -12.801 -26.880 -12.229 735 HB2 GLU 98 2HB GLU 98 -13.121 -24.121 -10.900 736 HB3 GLU 98 1HB GLU 98 -14.514 -25.210 -11.158 737 HG2 GLU 98 2HG GLU 98 -12.084 -26.315 -9.634 738 HG3 GLU 98 1HG GLU 98 -13.162 -25.120 -8.830 739 H GLU 99 H GLU 99 -15.064 -25.637 -13.145 740 HA GLU 99 HA GLU 99 -16.114 -24.673 -14.708 741 HB2 GLU 99 2HB GLU 99 -13.954 -22.509 -14.780 742 HB3 GLU 99 1HB GLU 99 -15.685 -22.363 -15.232 743 HG2 GLU 99 2HG GLU 99 -16.274 -22.863 -12.767 744 HG3 GLU 99 1HG GLU 99 -14.506 -22.832 -12.406 745 H ARG 100 H ARG 100 -12.805 -24.223 -15.709 746 HA ARG 100 HA ARG 100 -12.928 -24.219 -18.426 747 HB2 ARG 100 2HB ARG 100 -11.063 -23.544 -16.855 748 HB3 ARG 100 1HB ARG 100 -10.735 -25.263 -16.506 749 HG2 ARG 100 2HG ARG 100 -9.970 -25.597 -18.863 750 HG3 ARG 100 1HG ARG 100 -10.508 -23.937 -19.287 751 HD2 ARG 100 2HD ARG 100 -8.023 -23.963 -18.927 752 HD3 ARG 100 1HD ARG 100 -8.868 -22.920 -17.731 753 HE ARG 100 HE ARG 100 -8.436 -24.448 -15.975 754 HH11 ARG 100 1HH2 ARG 100 -7.537 -26.024 -19.054 755 HH12 ARG 100 2HH2 ARG 100 -6.156 -26.800 -18.496 756 HH21 ARG 100 1HH1 ARG 100 -6.524 -25.695 -15.029 757 HH22 ARG 100 2HH1 ARG 100 -5.842 -26.919 -15.979 758 H ARG 101 H ARG 101 -12.323 -26.952 -16.200 759 HA ARG 101 HA ARG 101 -12.369 -28.848 -18.421 760 HB2 ARG 101 2HB ARG 101 -11.928 -29.309 -15.404 761 HB3 ARG 101 1HB ARG 101 -11.652 -30.499 -16.720 762 HG2 ARG 101 2HG ARG 101 -9.916 -28.978 -17.720 763 HG3 ARG 101 1HG ARG 101 -10.100 -27.835 -16.354 764 HD2 ARG 101 2HD ARG 101 -9.163 -30.788 -16.108 765 HD3 ARG 101 1HD ARG 101 -8.097 -29.318 -16.120 766 HE ARG 101 HE ARG 101 -10.048 -28.920 -14.057 767 HH11 ARG 101 1HH2 ARG 101 -7.050 -30.833 -14.796 768 HH12 ARG 101 2HH2 ARG 101 -6.540 -30.780 -13.188 769 HH21 ARG 101 1HH1 ARG 101 -9.408 -29.168 -11.835 770 HH22 ARG 101 2HH1 ARG 101 -8.023 -30.087 -11.413 771 H GLY 102 H GLY 102 -14.765 -27.314 -16.712 772 HA2 GLY 102 2HA GLY 102 -16.881 -27.748 -16.320 773 HA3 GLY 102 1HA GLY 102 -16.676 -29.218 -17.349 774 H HIS 103 H HIS 103 -14.880 -28.685 -14.338 775 HA HIS 103 HA HIS 103 -15.872 -31.262 -13.462 776 HB2 HIS 103 2HB HIS 103 -13.430 -30.721 -13.222 777 HB3 HIS 103 1HB HIS 103 -13.857 -29.417 -12.063 778 HD1 HIS 103 1HD HIS 103 -14.853 -33.202 -12.304 779 HD2 HIS 103 2HD HIS 103 -13.501 -30.318 -9.515 780 HE1 HIS 103 1HE HIS 103 -14.606 -34.358 -10.119 781 HE2 HIS 103 2HE HIS 103 -13.855 -32.595 -8.412 782 H1 SER 1 H SER 1 -0.421 -13.925 -21.077 783 HA SER 1 HA SER 1 -1.276 -14.579 -23.756 784 HB2 SER 1 2HB SER 1 0.432 -16.418 -23.602 785 HB3 SER 1 1HB SER 1 1.134 -14.817 -23.178 786 HG SER 1 1HG SER 1 0.915 -15.375 -20.950 787 H ALA 2 H ALA 2 -1.468 -15.725 -20.443 788 HA ALA 2 HA ALA 2 -3.235 -17.931 -21.193 789 HB1 ALA 2 1HB ALA 2 -2.041 -17.142 -18.465 790 HB2 ALA 2 2HB ALA 2 -1.441 -18.444 -19.550 791 HB3 ALA 2 3HB ALA 2 -3.049 -18.612 -18.770 792 H ASP 3 H ASP 3 -5.095 -18.235 -19.631 793 HA ASP 3 HA ASP 3 -7.041 -16.403 -20.050 794 HB2 ASP 3 2HB ASP 3 -8.194 -17.625 -18.024 795 HB3 ASP 3 1HB ASP 3 -7.822 -18.522 -19.516 796 H HIS 4 H HIS 4 -5.667 -17.102 -16.927 797 HA HIS 4 HA HIS 4 -6.681 -14.943 -15.543 798 HB2 HIS 4 2HB HIS 4 -4.996 -15.486 -13.769 799 HB3 HIS 4 1HB HIS 4 -5.785 -16.961 -14.404 800 HD1 HIS 4 1HD HIS 4 -4.233 -18.390 -16.235 801 HD2 HIS 4 2HD HIS 4 -2.227 -15.286 -14.186 802 HE1 HIS 4 1HE HIS 4 -1.727 -18.776 -16.491 803 HE2 HIS 4 2HE HIS 4 -0.596 -16.727 -15.370 804 H GLU 5 H GLU 5 -3.971 -14.954 -17.728 805 HA GLU 5 HA GLU 5 -2.595 -12.767 -16.422 806 HB2 GLU 5 2HB GLU 5 -1.501 -14.761 -17.590 807 HB3 GLU 5 1HB GLU 5 -2.043 -14.070 -19.156 808 HG2 GLU 5 2HG GLU 5 -0.573 -12.128 -18.883 809 HG3 GLU 5 1HG GLU 5 -0.297 -12.506 -17.139 810 H ARG 6 H ARG 6 -4.603 -13.455 -19.333 811 HA ARG 6 HA ARG 6 -4.520 -10.781 -20.270 812 HB2 ARG 6 2HB ARG 6 -6.571 -12.986 -20.814 813 HB3 ARG 6 1HB ARG 6 -6.476 -11.435 -21.710 814 HG2 ARG 6 2HG ARG 6 -4.216 -12.046 -22.581 815 HG3 ARG 6 1HG ARG 6 -4.185 -13.502 -21.562 816 HD2 ARG 6 2HD ARG 6 -4.766 -14.256 -23.792 817 HD3 ARG 6 1HD ARG 6 -6.255 -14.392 -22.764 818 HE ARG 6 HE ARG 6 -5.854 -11.845 -24.284 819 HH11 ARG 6 1HH2 ARG 6 -7.818 -14.879 -24.075 820 HH12 ARG 6 2HH2 ARG 6 -8.496 -14.692 -25.608 821 HH21 ARG 6 1HH1 ARG 6 -6.978 -11.533 -26.363 822 HH22 ARG 6 2HH1 ARG 6 -7.931 -12.812 -26.986 823 H GLU 7 H GLU 7 -6.709 -12.551 -18.035 824 HA GLU 7 HA GLU 7 -8.633 -10.539 -17.757 825 HB2 GLU 7 2HB GLU 7 -7.712 -12.848 -15.977 826 HB3 GLU 7 1HB GLU 7 -8.642 -11.532 -15.222 827 HG2 GLU 7 2HG GLU 7 -10.440 -12.690 -15.663 828 HG3 GLU 7 1HG GLU 7 -10.342 -11.956 -17.293 829 H ALA 8 H ALA 8 -5.435 -10.954 -16.200 830 HA ALA 8 HA ALA 8 -5.758 -8.911 -14.312 831 HB1 ALA 8 1HB ALA 8 -3.944 -10.634 -14.126 832 HB2 ALA 8 2HB ALA 8 -3.266 -8.965 -14.094 833 HB3 ALA 8 3HB ALA 8 -3.151 -9.953 -15.595 834 H GLN 9 H GLN 9 -4.527 -8.871 -17.683 835 HA GLN 9 HA GLN 9 -3.684 -6.155 -17.580 836 HB2 GLN 9 2HB GLN 9 -2.911 -7.785 -19.378 837 HB3 GLN 9 1HB GLN 9 -4.569 -7.753 -20.066 838 HG2 GLN 9 2HG GLN 9 -4.333 -5.255 -20.461 839 HG3 GLN 9 1HG GLN 9 -2.668 -5.319 -19.788 840 HE21 GLN 9 1HE2 GLN 9 -3.954 -4.805 -22.635 841 HE22 GLN 9 2HE2 GLN 9 -2.952 -5.763 -23.680 842 H LYS 10 H LYS 10 -6.744 -7.778 -18.440 843 HA LYS 10 HA LYS 10 -7.987 -5.580 -19.585 844 HB2 LYS 10 2HB LYS 10 -8.811 -7.966 -19.710 845 HB3 LYS 10 1HB LYS 10 -9.329 -7.846 -17.992 846 HG2 LYS 10 2HG LYS 10 -10.890 -5.973 -18.604 847 HG3 LYS 10 1HG LYS 10 -10.335 -6.064 -20.307 848 HD2 LYS 10 2HD LYS 10 -11.289 -8.366 -20.505 849 HD3 LYS 10 1HD LYS 10 -11.743 -8.322 -18.760 850 HE2 LYS 10 2HE LYS 10 -13.204 -6.289 -19.217 851 HE3 LYS 10 1HE LYS 10 -12.852 -6.452 -20.982 852 HZ1 LYS 10 3HZ LYS 10 -14.010 -8.530 -21.009 853 HZ2 LYS 10 1HZ LYS 10 -14.947 -7.384 -20.182 854 HZ3 LYS 10 2HZ LYS 10 -14.094 -8.575 -19.293 855 H ALA 11 H ALA 11 -7.678 -6.565 -16.192 856 HA ALA 11 HA ALA 11 -9.518 -4.801 -15.072 857 HB1 ALA 11 1HB ALA 11 -8.271 -5.133 -12.939 858 HB2 ALA 11 2HB ALA 11 -6.859 -5.787 -13.847 859 HB3 ALA 11 3HB ALA 11 -8.415 -6.694 -13.814 860 H GLU 12 H GLU 12 -6.116 -4.315 -16.079 861 HA GLU 12 HA GLU 12 -5.810 -1.815 -14.817 862 HB2 GLU 12 2HB GLU 12 -4.297 -2.930 -17.256 863 HB3 GLU 12 1HB GLU 12 -3.818 -1.501 -16.279 864 HG2 GLU 12 2HG GLU 12 -3.571 -3.003 -14.249 865 HG3 GLU 12 1HG GLU 12 -3.960 -4.426 -15.279 866 H GLU 13 H GLU 13 -7.230 -2.783 -17.951 867 HA GLU 13 HA GLU 13 -7.122 -0.145 -19.029 868 HB2 GLU 13 2HB GLU 13 -7.285 -2.094 -20.554 869 HB3 GLU 13 1HB GLU 13 -8.861 -2.535 -19.827 870 HG2 GLU 13 2HG GLU 13 -9.291 -1.542 -21.965 871 HG3 GLU 13 1HG GLU 13 -9.857 -0.383 -20.723 872 H GLU 14 H GLU 14 -9.474 -1.971 -17.048 873 HA GLU 14 HA GLU 14 -11.518 -0.067 -17.432 874 HB2 GLU 14 2HB GLU 14 -11.872 -2.442 -16.627 875 HB3 GLU 14 1HB GLU 14 -11.344 -1.911 -14.995 876 HG2 GLU 14 2HG GLU 14 -13.248 -0.336 -14.846 877 HG3 GLU 14 1HG GLU 14 -13.598 -0.524 -16.601 878 H LEU 15 H LEU 15 -8.758 -0.227 -15.247 879 HA LEU 15 HA LEU 15 -9.578 1.721 -13.450 880 HB2 LEU 15 2HB LEU 15 -7.493 0.247 -13.270 881 HB3 LEU 15 1HB LEU 15 -6.689 1.300 -14.457 882 HG LEU 15 HG LEU 15 -6.882 3.256 -12.939 883 HD11 LEU 15 1HD1 LEU 15 -8.968 2.851 -11.737 884 HD12 LEU 15 2HD1 LEU 15 -7.658 2.906 -10.525 885 HD13 LEU 15 3HD1 LEU 15 -8.338 1.319 -11.027 886 HD21 LEU 15 3HD2 LEU 15 -5.669 0.815 -11.490 887 HD22 LEU 15 1HD2 LEU 15 -5.254 2.539 -11.218 888 HD23 LEU 15 2HD2 LEU 15 -4.879 1.767 -12.799 889 H GLN 16 H GLN 16 -7.936 1.996 -16.609 890 HA GLN 16 HA GLN 16 -7.396 4.739 -16.419 891 HB2 GLN 16 2HB GLN 16 -7.823 3.128 -19.004 892 HB3 GLN 16 1HB GLN 16 -6.971 4.707 -18.818 893 HG2 GLN 16 2HG GLN 16 -5.395 3.431 -17.132 894 HG3 GLN 16 1HG GLN 16 -6.106 1.918 -17.794 895 HE21 GLN 16 1HE2 GLN 16 -6.059 1.805 -20.388 896 HE22 GLN 16 2HE2 GLN 16 -4.583 2.377 -21.087 897 H LYS 17 H LYS 17 -10.247 2.941 -17.473 898 HA LYS 17 HA LYS 17 -11.558 5.139 -18.664 899 HB2 LYS 17 2HB LYS 17 -12.014 2.665 -19.005 900 HB3 LYS 17 1HB LYS 17 -12.827 2.631 -17.406 901 HG2 LYS 17 2HG LYS 17 -14.632 4.072 -18.232 902 HG3 LYS 17 1HG LYS 17 -13.636 4.610 -19.618 903 HD2 LYS 17 2HD LYS 17 -15.278 3.094 -20.525 904 HD3 LYS 17 1HD LYS 17 -13.659 2.338 -20.606 905 HE2 LYS 17 2HE LYS 17 -15.108 0.580 -19.947 906 HE3 LYS 17 1HE LYS 17 -14.276 1.033 -18.415 907 HZ1 LYS 17 3HZ LYS 17 -16.988 1.918 -19.288 908 HZ2 LYS 17 1HZ LYS 17 -16.292 2.282 -17.772 909 HZ3 LYS 17 2HZ LYS 17 -16.619 0.665 -18.180 910 H VAL 18 H VAL 18 -11.499 3.813 -15.336 911 HA VAL 18 HA VAL 18 -13.475 5.536 -14.300 912 HB VAL 18 HB VAL 18 -11.166 4.079 -12.921 913 HG11 VAL 18 1HG1 VAL 18 -13.619 5.534 -11.705 914 HG12 VAL 18 2HG1 VAL 18 -11.883 5.963 -11.460 915 HG13 VAL 18 3HG1 VAL 18 -12.521 4.421 -10.807 916 HG21 VAL 18 3HG2 VAL 18 -12.866 2.591 -14.074 917 HG22 VAL 18 1HG2 VAL 18 -14.190 3.434 -13.201 918 HG23 VAL 18 2HG2 VAL 18 -12.979 2.459 -12.291 919 H LEU 19 H LEU 19 -9.901 5.851 -14.683 920 HA LEU 19 HA LEU 19 -9.575 8.219 -13.281 921 HB2 LEU 19 2HB LEU 19 -8.170 7.498 -15.941 922 HB3 LEU 19 1HB LEU 19 -7.642 8.766 -14.793 923 HG LEU 19 HG LEU 19 -7.662 5.745 -14.246 924 HD11 LEU 19 1HD1 LEU 19 -5.344 7.714 -14.726 925 HD12 LEU 19 2HD1 LEU 19 -5.924 6.468 -15.889 926 HD13 LEU 19 3HD1 LEU 19 -5.190 5.963 -14.322 927 HD21 LEU 19 3HD2 LEU 19 -6.854 8.137 -12.495 928 HD22 LEU 19 1HD2 LEU 19 -6.292 6.456 -12.204 929 HD23 LEU 19 2HD2 LEU 19 -8.049 6.846 -12.113 930 H GLU 20 H GLU 20 -10.531 7.723 -16.702 931 HA GLU 20 HA GLU 20 -10.491 10.443 -17.435 932 HB2 GLU 20 2HB GLU 20 -12.085 8.097 -18.648 933 HB3 GLU 20 1HB GLU 20 -11.914 9.723 -19.395 934 HG2 GLU 20 2HG GLU 20 -9.427 9.394 -19.568 935 HG3 GLU 20 1HG GLU 20 -9.598 7.743 -18.877 936 H GLU 21 H GLU 21 -13.015 8.291 -16.135 937 HA GLU 21 HA GLU 21 -15.120 10.163 -16.479 938 HB2 GLU 21 2HB GLU 21 -15.154 7.528 -16.091 939 HB3 GLU 21 1HB GLU 21 -15.042 7.929 -14.358 940 HG2 GLU 21 2HG GLU 21 -17.385 7.615 -14.892 941 HG3 GLU 21 1HG GLU 21 -17.175 9.395 -14.688 942 H ALA 22 H ALA 22 -13.015 9.159 -13.777 943 HA ALA 22 HA ALA 22 -14.214 10.715 -11.814 944 HB1 ALA 22 1HB ALA 22 -12.759 8.760 -11.281 945 HB2 ALA 22 2HB ALA 22 -12.174 10.259 -10.467 946 HB3 ALA 22 3HB ALA 22 -11.332 9.639 -11.935 947 H SER 23 H SER 23 -11.801 11.562 -14.262 948 HA SER 23 HA SER 23 -10.836 13.800 -12.756 949 HB2 SER 23 2HB SER 23 -9.963 14.522 -15.143 950 HB3 SER 23 1HB SER 23 -9.230 13.146 -14.248 951 HG SER 23 1HG SER 23 -10.269 11.717 -15.501 952 H LYS 24 H LYS 24 -13.512 13.229 -15.009 953 HA LYS 24 HA LYS 24 -14.122 16.007 -15.295 954 HB2 LYS 24 2HB LYS 24 -14.835 14.167 -16.901 955 HB3 LYS 24 1HB LYS 24 -16.007 13.586 -15.680 956 HG2 LYS 24 2HG LYS 24 -15.980 16.482 -16.730 957 HG3 LYS 24 1HG LYS 24 -16.784 15.176 -17.659 958 HD2 LYS 24 2HD LYS 24 -18.589 15.011 -16.194 959 HD3 LYS 24 1HD LYS 24 -17.588 15.328 -14.763 960 HE2 LYS 24 2HE LYS 24 -18.941 17.226 -14.819 961 HE3 LYS 24 1HE LYS 24 -17.386 17.792 -15.508 962 HZ1 LYS 24 3HZ LYS 24 -19.933 17.149 -16.883 963 HZ2 LYS 24 1HZ LYS 24 -18.473 17.409 -17.763 964 HZ3 LYS 24 2HZ LYS 24 -19.125 18.642 -16.812 965 H LYS 25 H LYS 25 -15.081 13.317 -13.161 966 HA LYS 25 HA LYS 25 -17.020 14.655 -11.694 967 HB2 LYS 25 2HB LYS 25 -15.053 12.500 -10.726 968 HB3 LYS 25 1HB LYS 25 -16.472 13.034 -9.793 969 HG2 LYS 25 2HG LYS 25 -16.950 11.932 -12.621 970 HG3 LYS 25 1HG LYS 25 -16.466 10.825 -11.299 971 HD2 LYS 25 2HD LYS 25 -18.794 10.710 -11.199 972 HD3 LYS 25 1HD LYS 25 -18.313 11.790 -9.855 973 HE2 LYS 25 2HE LYS 25 -18.864 13.748 -11.668 974 HE3 LYS 25 1HE LYS 25 -19.791 12.429 -12.482 975 HZ1 LYS 25 3HZ LYS 25 -20.842 12.087 -10.201 976 HZ2 LYS 25 1HZ LYS 25 -21.237 13.537 -11.021 977 HZ3 LYS 25 2HZ LYS 25 -20.092 13.569 -9.764 978 H ALA 26 H ALA 26 -13.491 14.342 -10.953 979 HA ALA 26 HA ALA 26 -13.531 15.629 -8.552 980 HB1 ALA 26 1HB ALA 26 -11.101 16.092 -8.905 981 HB2 ALA 26 2HB ALA 26 -11.284 15.740 -10.669 982 HB3 ALA 26 3HB ALA 26 -11.525 14.429 -9.450 983 H VAL 27 H VAL 27 -13.041 17.214 -11.798 984 HA VAL 27 HA VAL 27 -12.640 19.694 -10.453 985 HB VAL 27 HB VAL 27 -12.638 20.745 -12.662 986 HG11 VAL 27 1HG1 VAL 27 -10.635 19.719 -11.512 987 HG12 VAL 27 2HG1 VAL 27 -10.520 19.598 -13.308 988 HG13 VAL 27 3HG1 VAL 27 -10.964 18.153 -12.332 989 HG21 VAL 27 3HG2 VAL 27 -14.302 19.308 -13.862 990 HG22 VAL 27 1HG2 VAL 27 -13.234 17.873 -13.692 991 HG23 VAL 27 2HG2 VAL 27 -12.710 19.269 -14.695 992 H GLU 28 H GLU 28 -15.499 18.040 -11.696 993 HA GLU 28 HA GLU 28 -17.035 20.480 -11.575 994 HB2 GLU 28 2HB GLU 28 -17.228 18.277 -13.159 995 HB3 GLU 28 1HB GLU 28 -18.387 17.804 -11.883 996 HG2 GLU 28 2HG GLU 28 -19.621 18.959 -13.658 997 HG3 GLU 28 1HG GLU 28 -19.542 20.080 -12.257 998 H ALA 29 H ALA 29 -16.171 17.845 -9.517 999 HA ALA 29 HA ALA 29 -18.281 17.805 -7.726 1000 HB1 ALA 29 1HB ALA 29 -15.263 17.224 -7.349 1001 HB2 ALA 29 2HB ALA 29 -16.527 16.019 -7.768 1002 HB3 ALA 29 3HB ALA 29 -16.512 16.801 -6.173 1003 H GLU 30 H GLU 30 -15.236 19.740 -7.811 1004 HA GLU 30 HA GLU 30 -15.868 21.084 -5.403 1005 HB2 GLU 30 2HB GLU 30 -13.957 22.006 -7.637 1006 HB3 GLU 30 1HB GLU 30 -14.160 22.763 -6.004 1007 HG2 GLU 30 2HG GLU 30 -13.547 20.397 -5.060 1008 HG3 GLU 30 1HG GLU 30 -13.004 20.006 -6.734 1009 H ARG 31 H ARG 31 -15.207 23.307 -7.944 1010 HA ARG 31 HA ARG 31 -16.203 25.078 -8.706 1011 HB2 ARG 31 2HB ARG 31 -18.865 23.602 -8.787 1012 HB3 ARG 31 1HB ARG 31 -18.362 24.983 -9.813 1013 HG2 ARG 31 2HG ARG 31 -17.249 22.123 -9.837 1014 HG3 ARG 31 1HG ARG 31 -18.403 22.804 -11.017 1015 HD2 ARG 31 2HD ARG 31 -15.466 23.741 -10.645 1016 HD3 ARG 31 1HD ARG 31 -16.062 22.569 -11.862 1017 HE ARG 31 HE ARG 31 -16.944 25.492 -11.776 1018 HH11 ARG 31 1HH2 ARG 31 -16.970 22.672 -13.852 1019 HH12 ARG 31 2HH2 ARG 31 -16.238 23.399 -15.194 1020 HH21 ARG 31 1HH1 ARG 31 -15.750 26.580 -13.589 1021 HH22 ARG 31 2HH1 ARG 31 -15.267 25.658 -14.937 1022 H GLY 32 H GLY 32 -16.913 24.457 -5.563 1023 HA2 GLY 32 2HA GLY 32 -17.614 27.077 -5.003 1024 HA3 GLY 32 1HA GLY 32 -19.128 26.065 -5.101 1025 H ALA 33 H ALA 33 -15.824 25.035 -4.231 1026 HA ALA 33 HA ALA 33 -16.965 23.826 -1.846 1027 HB1 ALA 33 1HB ALA 33 -14.213 23.443 -3.218 1028 HB2 ALA 33 2HB ALA 33 -15.600 22.299 -3.326 1029 HB3 ALA 33 3HB ALA 33 -14.779 22.568 -1.749 1030 HA PRO 34 HA PRO 34 -14.889 27.156 0.238 1031 HB2 PRO 34 2HB PRO 34 -14.570 26.171 2.833 1032 HB3 PRO 34 1HB PRO 34 -16.154 26.686 2.136 1033 HG2 PRO 34 2HG PRO 34 -15.009 23.855 2.332 1034 HG3 PRO 34 1HG PRO 34 -16.686 24.418 2.748 1035 HD2 PRO 34 2HD PRO 34 -16.047 23.223 0.317 1036 HD3 PRO 34 1HD PRO 34 -17.292 24.557 0.417 1037 H GLY 35 H GLY 35 -12.776 27.614 -0.459 1038 HA2 GLY 35 2HA GLY 35 -10.511 27.576 0.309 1039 HA3 GLY 35 1HA GLY 35 -10.643 25.773 0.464 1040 H ALA 36 H ALA 36 -11.719 24.768 -1.471 1041 HA ALA 36 HA ALA 36 -11.770 24.137 -3.543 1042 HB1 ALA 36 1HB ALA 36 -11.337 25.388 -5.541 1043 HB2 ALA 36 2HB ALA 36 -10.567 26.718 -4.609 1044 HB3 ALA 36 3HB ALA 36 -12.337 26.408 -4.442 1045 H ALA 37 H ALA 37 -10.179 23.245 -5.200 1046 HA ALA 37 HA ALA 37 -7.398 23.585 -4.407 1047 HB1 ALA 37 1HB ALA 37 -8.818 20.863 -4.041 1048 HB2 ALA 37 2HB ALA 37 -8.225 21.911 -2.725 1049 HB3 ALA 37 3HB ALA 37 -7.051 21.172 -3.867 1050 H LEU 38 H LEU 38 -9.439 21.077 -6.050 1051 HA LEU 38 HA LEU 38 -7.546 21.259 -8.317 1052 HB2 LEU 38 2HB LEU 38 -7.490 19.017 -7.282 1053 HB3 LEU 38 1HB LEU 38 -9.270 18.891 -7.429 1054 HG LEU 38 HG LEU 38 -9.177 18.752 -9.840 1055 HD11 LEU 38 1HD1 LEU 38 -7.448 20.368 -10.479 1056 HD12 LEU 38 2HD1 LEU 38 -7.003 18.770 -11.158 1057 HD13 LEU 38 3HD1 LEU 38 -6.163 19.385 -9.698 1058 HD21 LEU 38 3HD2 LEU 38 -8.743 16.665 -8.608 1059 HD22 LEU 38 1HD2 LEU 38 -6.973 16.981 -8.628 1060 HD23 LEU 38 2HD2 LEU 38 -7.853 16.666 -10.176 1061 H ILE 39 H ILE 39 -8.759 23.145 -9.014 1062 HA ILE 39 HA ILE 39 -11.299 22.366 -10.294 1063 HB ILE 39 HB ILE 39 -11.865 23.746 -8.492 1064 HG12 ILE 39 2HG1 ILE 39 -11.865 25.468 -11.048 1065 HG13 ILE 39 1HG1 ILE 39 -13.002 24.121 -10.687 1066 HG21 ILE 39 1HG2 ILE 39 -9.686 24.723 -7.910 1067 HG22 ILE 39 2HG2 ILE 39 -10.915 26.000 -8.064 1068 HG23 ILE 39 3HG2 ILE 39 -9.713 25.775 -9.380 1069 HD11 ILE 39 3HD ILE 39 -12.716 26.773 -9.120 1070 HD12 ILE 39 1HD ILE 39 -14.094 26.263 -10.156 1071 HD13 ILE 39 2HD ILE 39 -13.757 25.396 -8.604 1072 H SER 40 H SER 40 -10.493 21.786 -12.312 1073 HA SER 40 HA SER 40 -9.073 23.787 -13.842 1074 HB2 SER 40 2HB SER 40 -7.865 20.964 -13.299 1075 HB3 SER 40 1HB SER 40 -7.129 22.304 -14.265 1076 HG SER 40 1HG SER 40 -6.239 21.907 -12.220 1077 H TYR 41 H TYR 41 -8.159 21.580 -15.643 1078 HA TYR 41 HA TYR 41 -10.184 19.719 -16.016 1079 HB2 TYR 41 2HB TYR 41 -10.409 22.150 -17.748 1080 HB3 TYR 41 1HB TYR 41 -10.170 20.648 -18.712 1081 HD1 TYR 41 2HD TYR 41 -11.710 18.744 -18.499 1082 HD2 TYR 41 1HD TYR 41 -12.518 22.446 -16.468 1083 HE1 TYR 41 2HE TYR 41 -14.019 18.004 -18.067 1084 HE2 TYR 41 1HE TYR 41 -14.807 21.685 -15.982 1085 HH TYR 41 HH TYR 41 -16.273 19.790 -15.978 1086 HA PRO 42 HA PRO 42 -6.721 18.730 -18.910 1087 HB2 PRO 42 2HB PRO 42 -4.314 20.264 -19.021 1088 HB3 PRO 42 1HB PRO 42 -5.712 20.438 -20.145 1089 HG2 PRO 42 2HG PRO 42 -5.137 22.063 -17.607 1090 HG3 PRO 42 1HG PRO 42 -5.614 22.667 -19.249 1091 HD2 PRO 42 2HD PRO 42 -7.500 22.406 -17.311 1092 HD3 PRO 42 1HD PRO 42 -7.876 21.824 -18.996 1093 H ASP 43 H ASP 43 -5.612 20.236 -15.826 1094 HA ASP 43 HA ASP 43 -3.851 17.994 -15.358 1095 HB2 ASP 43 2HB ASP 43 -3.322 19.173 -13.172 1096 HB3 ASP 43 1HB ASP 43 -2.866 20.062 -14.657 1097 H ALA 44 H ALA 44 -7.087 18.123 -15.333 1098 HA ALA 44 HA ALA 44 -7.713 17.327 -12.680 1099 HB1 ALA 44 1HB ALA 44 -9.855 16.528 -13.626 1100 HB2 ALA 44 2HB ALA 44 -9.190 16.619 -15.303 1101 HB3 ALA 44 3HB ALA 44 -9.450 18.116 -14.359 1102 H ILE 45 H ILE 45 -6.837 15.625 -15.689 1103 HA ILE 45 HA ILE 45 -7.176 13.042 -14.564 1104 HB ILE 45 HB ILE 45 -7.532 13.481 -16.916 1105 HG12 ILE 45 2HG1 ILE 45 -5.236 11.478 -16.465 1106 HG13 ILE 45 1HG1 ILE 45 -6.961 11.199 -16.059 1107 HG21 ILE 45 1HG2 ILE 45 -5.751 15.228 -17.261 1108 HG22 ILE 45 2HG2 ILE 45 -5.648 13.915 -18.469 1109 HG23 ILE 45 3HG2 ILE 45 -4.479 13.956 -17.109 1110 HD11 ILE 45 3HD ILE 45 -5.831 11.718 -18.893 1111 HD12 ILE 45 1HD ILE 45 -6.439 10.160 -18.235 1112 HD13 ILE 45 2HD ILE 45 -7.580 11.529 -18.490 1113 H TRP 46 H TRP 46 -4.656 15.402 -14.480 1114 HA TRP 46 HA TRP 46 -2.378 13.829 -14.310 1115 HB2 TRP 46 2HB TRP 46 -2.633 16.415 -14.540 1116 HB3 TRP 46 1HB TRP 46 -2.857 16.479 -12.770 1117 HD1 TRP 46 HD TRP 46 -0.255 16.548 -15.438 1118 HE1 TRP 46 1HE TRP 46 1.954 17.033 -14.315 1119 HE3 TRP 46 3HE TRP 46 -1.529 15.613 -10.586 1120 HZ2 TRP 46 2HZ TRP 46 3.244 16.472 -11.787 1121 HZ3 TRP 46 3HZ TRP 46 0.222 15.583 -8.878 1122 HH2 TRP 46 HH TRP 46 2.581 16.062 -9.453 1123 H TRP 47 H TRP 47 -4.382 15.281 -11.708 1124 HA TRP 47 HA TRP 47 -2.977 13.946 -9.640 1125 HB2 TRP 47 2HB TRP 47 -4.234 16.131 -9.378 1126 HB3 TRP 47 1HB TRP 47 -5.775 15.228 -9.575 1127 HD1 TRP 47 HD TRP 47 -2.640 15.160 -7.118 1128 HE1 TRP 47 1HE TRP 47 -3.574 14.726 -4.744 1129 HE3 TRP 47 3HE TRP 47 -7.549 14.399 -8.318 1130 HZ2 TRP 47 2HZ TRP 47 -6.029 13.960 -3.579 1131 HZ3 TRP 47 3HZ TRP 47 -9.152 13.825 -6.527 1132 HH2 TRP 47 HH TRP 47 -8.400 13.600 -4.191 1133 H SER 48 H SER 48 -5.884 13.274 -11.571 1134 HA SER 48 HA SER 48 -6.998 11.268 -10.078 1135 HB2 SER 48 2HB SER 48 -7.920 12.427 -12.211 1136 HB3 SER 48 1HB SER 48 -6.954 11.231 -13.155 1137 HG SER 48 1HG SER 48 -9.099 10.573 -12.861 1138 H VAL 49 H VAL 49 -4.358 11.016 -12.528 1139 HA VAL 49 HA VAL 49 -4.111 8.270 -12.588 1140 HB VAL 49 HB VAL 49 -2.063 10.510 -12.906 1141 HG11 VAL 49 1HG1 VAL 49 -0.572 8.772 -14.036 1142 HG12 VAL 49 2HG1 VAL 49 -1.664 7.481 -13.444 1143 HG13 VAL 49 3HG1 VAL 49 -0.736 8.476 -12.272 1144 HG21 VAL 49 3HG2 VAL 49 -3.349 8.599 -14.977 1145 HG22 VAL 49 1HG2 VAL 49 -2.365 10.065 -15.317 1146 HG23 VAL 49 2HG2 VAL 49 -4.010 10.221 -14.607 1147 H GLU 50 H GLU 50 -2.495 10.578 -10.248 1148 HA GLU 50 HA GLU 50 -1.139 8.325 -9.098 1149 HB2 GLU 50 2HB GLU 50 -0.159 9.737 -7.470 1150 HB3 GLU 50 1HB GLU 50 0.008 10.498 -9.066 1151 HG2 GLU 50 2HG GLU 50 -1.739 12.181 -8.487 1152 HG3 GLU 50 1HG GLU 50 -2.076 11.341 -6.926 1153 H THR 51 H THR 51 -4.199 9.887 -8.609 1154 HA THR 51 HA THR 51 -4.639 9.201 -5.922 1155 HB THR 51 HB THR 51 -6.654 9.543 -8.216 1156 HG1 THR 51 1HG THR 51 -5.307 11.379 -7.832 1157 HG21 THR 51 3HG2 THR 51 -7.677 8.455 -6.150 1158 HG22 THR 51 1HG2 THR 51 -8.287 10.121 -6.438 1159 HG23 THR 51 2HG2 THR 51 -7.061 9.828 -5.162 1160 H ALA 52 H ALA 52 -5.171 7.453 -9.019 1161 HA ALA 52 HA ALA 52 -6.625 5.330 -7.851 1162 HB1 ALA 52 1HB ALA 52 -4.958 5.429 -10.438 1163 HB2 ALA 52 2HB ALA 52 -6.740 5.706 -10.271 1164 HB3 ALA 52 3HB ALA 52 -6.053 4.076 -9.966 1165 H THR 53 H THR 53 -3.133 5.975 -8.051 1166 HA THR 53 HA THR 53 -2.552 3.233 -7.323 1167 HB THR 53 HB THR 53 -0.149 4.311 -7.220 1168 HG1 THR 53 1HG THR 53 -1.004 6.475 -7.359 1169 HG21 THR 53 3HG2 THR 53 -1.003 2.715 -8.961 1170 HG22 THR 53 1HG2 THR 53 -0.004 4.018 -9.703 1171 HG23 THR 53 2HG2 THR 53 -1.803 4.077 -9.834 1172 H THR 54 H THR 54 -3.937 5.635 -5.557 1173 HA THR 54 HA THR 54 -4.014 6.150 -3.437 1174 HB THR 54 HB THR 54 -3.535 4.169 -1.777 1175 HG1 THR 54 1HG THR 54 -2.264 3.101 -3.553 1176 HG21 THR 54 3HG2 THR 54 -5.565 3.941 -4.100 1177 HG22 THR 54 1HG2 THR 54 -5.762 4.867 -2.556 1178 HG23 THR 54 2HG2 THR 54 -5.656 3.073 -2.522 1179 H VAL 55 H VAL 55 -1.496 6.963 -4.724 1180 HA VAL 55 HA VAL 55 0.446 6.481 -2.595 1181 HB VAL 55 HB VAL 55 1.392 6.252 -4.711 1182 HG11 VAL 55 1HG1 VAL 55 0.599 9.174 -5.368 1183 HG12 VAL 55 2HG1 VAL 55 -0.104 7.681 -6.112 1184 HG13 VAL 55 3HG1 VAL 55 1.623 8.097 -6.354 1185 HG21 VAL 55 3HG2 VAL 55 2.710 7.238 -2.806 1186 HG22 VAL 55 1HG2 VAL 55 2.355 8.888 -3.408 1187 HG23 VAL 55 2HG2 VAL 55 3.327 7.755 -4.414 1188 H GLY 56 H GLY 56 -1.086 9.297 -4.249 1189 HA2 GLY 56 2HA GLY 56 -1.695 11.269 -3.459 1190 HA3 GLY 56 1HA GLY 56 -1.801 10.503 -1.820 1191 H TYR 57 H TYR 57 0.659 11.672 -4.222 1192 HA TYR 57 HA TYR 57 2.701 11.599 -2.240 1193 HB2 TYR 57 2HB TYR 57 3.042 11.285 -4.778 1194 HB3 TYR 57 1HB TYR 57 2.712 13.039 -4.994 1195 HD1 TYR 57 1HD TYR 57 4.272 14.687 -3.790 1196 HD2 TYR 57 2HD TYR 57 5.258 10.523 -4.194 1197 HE1 TYR 57 1HE TYR 57 6.511 15.148 -3.020 1198 HE2 TYR 57 2HE TYR 57 7.598 11.026 -3.588 1199 HH TYR 57 HH TYR 57 8.866 12.691 -2.207 1200 H GLY 58 H GLY 58 0.365 13.886 -3.335 1201 HA2 GLY 58 2HA GLY 58 -0.438 15.486 -1.871 1202 HA3 GLY 58 1HA GLY 58 1.184 15.652 -1.112 1203 H ASP 59 H ASP 59 0.227 15.629 -4.565 1204 HA ASP 59 HA ASP 59 1.374 18.283 -4.922 1205 HB2 ASP 59 2HB ASP 59 1.671 16.751 -6.805 1206 HB3 ASP 59 1HB ASP 59 -0.103 16.478 -6.902 1207 H ARG 60 H ARG 60 -1.934 16.689 -4.865 1208 HA ARG 60 HA ARG 60 -3.014 19.317 -4.251 1209 HB2 ARG 60 2HB ARG 60 -4.494 17.542 -6.264 1210 HB3 ARG 60 1HB ARG 60 -4.793 19.266 -5.848 1211 HG2 ARG 60 2HG ARG 60 -2.467 19.788 -6.844 1212 HG3 ARG 60 1HG ARG 60 -2.386 18.052 -7.314 1213 HD2 ARG 60 2HD ARG 60 -4.402 18.476 -8.867 1214 HD3 ARG 60 1HD ARG 60 -4.170 20.259 -8.543 1215 HE ARG 60 HE ARG 60 -1.751 18.637 -9.162 1216 HH11 ARG 60 1HH2 ARG 60 -3.747 21.013 -11.091 1217 HH12 ARG 60 2HH2 ARG 60 -2.420 22.062 -11.156 1218 HH21 ARG 60 1HH1 ARG 60 -0.111 19.843 -9.590 1219 HH22 ARG 60 2HH1 ARG 60 -0.211 21.296 -10.573 1220 H TYR 61 H TYR 61 -5.542 18.801 -3.572 1221 HA TYR 61 HA TYR 61 -5.675 16.343 -2.140 1222 HB2 TYR 61 2HB TYR 61 -6.293 17.640 0.020 1223 HB3 TYR 61 1HB TYR 61 -4.544 17.681 -0.384 1224 HD1 TYR 61 2HD TYR 61 -3.508 19.759 -1.282 1225 HD2 TYR 61 1HD TYR 61 -7.637 19.664 -0.112 1226 HE1 TYR 61 2HE TYR 61 -3.612 22.208 -1.477 1227 HE2 TYR 61 1HE TYR 61 -7.769 22.106 -0.326 1228 HH TYR 61 HH TYR 61 -6.731 23.978 -1.149 1229 HA PRO 62 HA PRO 62 -9.762 17.886 -3.421 1230 HB2 PRO 62 2HB PRO 62 -11.439 15.969 -2.277 1231 HB3 PRO 62 1HB PRO 62 -10.311 15.551 -3.613 1232 HG2 PRO 62 2HG PRO 62 -9.990 15.035 -0.628 1233 HG3 PRO 62 1HG PRO 62 -9.558 13.963 -2.010 1234 HD2 PRO 62 2HD PRO 62 -7.798 15.755 -0.583 1235 HD3 PRO 62 1HD PRO 62 -7.448 14.993 -2.199 1236 H VAL 63 H VAL 63 -11.834 18.752 -2.352 1237 HA VAL 63 HA VAL 63 -11.154 19.829 0.274 1238 HB VAL 63 HB VAL 63 -13.569 20.710 -1.348 1239 HG11 VAL 63 1HG1 VAL 63 -12.957 22.912 -0.295 1240 HG12 VAL 63 2HG1 VAL 63 -11.484 22.189 0.433 1241 HG13 VAL 63 3HG1 VAL 63 -13.107 21.696 1.015 1242 HG21 VAL 63 3HG2 VAL 63 -11.784 20.660 -3.040 1243 HG22 VAL 63 1HG2 VAL 63 -10.626 21.452 -1.911 1244 HG23 VAL 63 2HG2 VAL 63 -12.064 22.337 -2.531 1245 H THR 64 H THR 64 -14.183 20.308 0.663 1246 HA THR 64 HA THR 64 -14.766 17.727 1.848 1247 HB THR 64 HB THR 64 -16.370 19.264 3.217 1248 HG1 THR 64 1HG THR 64 -15.838 21.428 3.122 1249 HG21 THR 64 3HG2 THR 64 -14.185 18.397 4.097 1250 HG22 THR 64 1HG2 THR 64 -14.443 20.085 4.636 1251 HG23 THR 64 2HG2 THR 64 -13.294 19.736 3.294 1252 H GLU 65 H GLU 65 -16.396 20.475 0.462 1253 HA GLU 65 HA GLU 65 -18.845 19.479 -0.188 1254 HB2 GLU 65 2HB GLU 65 -18.022 21.898 -0.015 1255 HB3 GLU 65 1HB GLU 65 -17.142 21.639 -1.557 1256 HG2 GLU 65 2HG GLU 65 -19.001 22.889 -2.206 1257 HG3 GLU 65 1HG GLU 65 -19.526 21.238 -2.631 1258 H GLU 66 H GLU 66 -15.828 18.846 -1.818 1259 HA GLU 66 HA GLU 66 -16.909 18.439 -4.388 1260 HB2 GLU 66 2HB GLU 66 -14.776 17.825 -5.067 1261 HB3 GLU 66 1HB GLU 66 -14.470 18.930 -3.729 1262 HG2 GLU 66 2HG GLU 66 -12.952 17.310 -3.184 1263 HG3 GLU 66 1HG GLU 66 -14.337 16.639 -2.250 1264 H GLY 67 H GLY 67 -16.919 16.769 -1.412 1265 HA2 GLY 67 2HA GLY 67 -18.196 15.031 -0.799 1266 HA3 GLY 67 1HA GLY 67 -18.561 14.668 -2.548 1267 H ARG 68 H ARG 68 -15.857 14.968 -0.282 1268 HA ARG 68 HA ARG 68 -13.720 14.118 -1.365 1269 HB2 ARG 68 2HB ARG 68 -14.195 14.850 1.012 1270 HB3 ARG 68 1HB ARG 68 -14.503 13.126 1.414 1271 HG2 ARG 68 2HG ARG 68 -12.125 12.611 0.688 1272 HG3 ARG 68 1HG ARG 68 -11.919 14.341 0.241 1273 HD2 ARG 68 2HD ARG 68 -12.367 14.969 2.705 1274 HD3 ARG 68 1HD ARG 68 -12.489 13.200 3.059 1275 HE ARG 68 HE ARG 68 -10.203 12.984 2.944 1276 HH11 ARG 68 1HH2 ARG 68 -11.001 16.252 1.419 1277 HH12 ARG 68 2HH2 ARG 68 -9.395 16.796 1.580 1278 HH21 ARG 68 1HH1 ARG 68 -8.087 13.856 3.064 1279 HH22 ARG 68 2HH1 ARG 68 -7.656 15.351 2.293 1280 H LYS 69 H LYS 69 -16.319 11.995 -0.832 1281 HA LYS 69 HA LYS 69 -15.139 9.486 -1.163 1282 HB2 LYS 69 2HB LYS 69 -17.874 10.536 -2.121 1283 HB3 LYS 69 1HB LYS 69 -17.398 8.811 -2.022 1284 HG2 LYS 69 2HG LYS 69 -17.777 10.729 0.380 1285 HG3 LYS 69 1HG LYS 69 -18.818 9.364 -0.140 1286 HD2 LYS 69 2HD LYS 69 -16.727 7.867 0.101 1287 HD3 LYS 69 1HD LYS 69 -15.971 9.223 1.014 1288 HE2 LYS 69 2HE LYS 69 -17.893 9.082 2.702 1289 HE3 LYS 69 1HE LYS 69 -18.589 7.717 1.736 1290 HZ1 LYS 69 3HZ LYS 69 -17.373 6.676 3.360 1291 HZ2 LYS 69 1HZ LYS 69 -16.073 7.770 3.296 1292 HZ3 LYS 69 2HZ LYS 69 -16.282 6.672 2.023 1293 H VAL 70 H VAL 70 -15.269 12.179 -3.493 1294 HA VAL 70 HA VAL 70 -15.325 10.520 -5.791 1295 HB VAL 70 HB VAL 70 -13.921 13.222 -5.504 1296 HG11 VAL 70 1HG1 VAL 70 -14.120 13.308 -7.995 1297 HG12 VAL 70 2HG1 VAL 70 -14.745 11.617 -8.024 1298 HG13 VAL 70 3HG1 VAL 70 -13.055 11.965 -7.480 1299 HG21 VAL 70 3HG2 VAL 70 -16.751 12.526 -6.557 1300 HG22 VAL 70 1HG2 VAL 70 -15.931 14.131 -6.652 1301 HG23 VAL 70 2HG2 VAL 70 -16.336 13.476 -5.057 1302 H ALA 71 H ALA 71 -12.723 11.824 -3.677 1303 HA ALA 71 HA ALA 71 -10.626 10.549 -5.054 1304 HB1 ALA 71 1HB ALA 71 -10.788 11.241 -2.049 1305 HB2 ALA 71 2HB ALA 71 -10.223 12.343 -3.354 1306 HB3 ALA 71 3HB ALA 71 -9.283 10.855 -2.973 1307 H GLU 72 H GLU 72 -12.653 9.506 -2.271 1308 HA GLU 72 HA GLU 72 -11.354 7.121 -1.730 1309 HB2 GLU 72 2HB GLU 72 -13.320 8.111 -0.321 1310 HB3 GLU 72 1HB GLU 72 -14.398 7.297 -1.499 1311 HG2 GLU 72 2HG GLU 72 -12.686 5.195 -0.807 1312 HG3 GLU 72 1HG GLU 72 -12.647 6.148 0.709 1313 H GLN 73 H GLN 73 -14.017 7.737 -3.983 1314 HA GLN 73 HA GLN 73 -14.551 5.217 -4.904 1315 HB2 GLN 73 2HB GLN 73 -15.909 7.226 -5.379 1316 HB3 GLN 73 1HB GLN 73 -14.510 7.998 -6.159 1317 HG2 GLN 73 2HG GLN 73 -14.737 6.264 -8.083 1318 HG3 GLN 73 1HG GLN 73 -16.282 5.753 -7.301 1319 HE21 GLN 73 1HE2 GLN 73 -14.503 8.843 -8.140 1320 HE22 GLN 73 2HE2 GLN 73 -15.904 9.685 -8.716 1321 H VAL 74 H VAL 74 -12.037 7.537 -6.078 1322 HA VAL 74 HA VAL 74 -11.290 5.852 -8.258 1323 HB VAL 74 HB VAL 74 -9.864 8.240 -6.975 1324 HG11 VAL 74 1HG1 VAL 74 -8.231 6.890 -8.296 1325 HG12 VAL 74 2HG1 VAL 74 -8.660 8.366 -9.218 1326 HG13 VAL 74 3HG1 VAL 74 -9.383 6.781 -9.677 1327 HG21 VAL 74 3HG2 VAL 74 -12.165 8.745 -7.922 1328 HG22 VAL 74 1HG2 VAL 74 -11.673 7.972 -9.465 1329 HG23 VAL 74 2HG2 VAL 74 -10.854 9.482 -8.897 1330 H MET 75 H MET 75 -9.978 6.552 -4.991 1331 HA MET 75 HA MET 75 -7.666 5.009 -5.184 1332 HB2 MET 75 2HB MET 75 -9.491 5.678 -2.792 1333 HB3 MET 75 1HB MET 75 -7.940 4.799 -2.613 1334 HG2 MET 75 2HG MET 75 -6.764 6.725 -3.764 1335 HG3 MET 75 1HG MET 75 -8.275 7.663 -3.705 1336 HE1 MET 75 3HE MET 75 -9.498 8.384 -1.468 1337 HE2 MET 75 1HE MET 75 -8.867 8.120 0.189 1338 HE3 MET 75 2HE MET 75 -9.479 6.728 -0.742 1339 H LYS 76 H LYS 76 -10.959 4.132 -4.010 1340 HA LYS 76 HA LYS 76 -10.262 1.519 -3.343 1341 HB2 LYS 76 2HB LYS 76 -12.357 2.809 -2.610 1342 HB3 LYS 76 1HB LYS 76 -13.050 2.459 -4.226 1343 HG2 LYS 76 2HG LYS 76 -12.743 -0.048 -3.716 1344 HG3 LYS 76 1HG LYS 76 -12.128 0.418 -2.091 1345 HD2 LYS 76 2HD LYS 76 -14.334 1.628 -1.684 1346 HD3 LYS 76 1HD LYS 76 -14.923 0.977 -3.258 1347 HE2 LYS 76 2HE LYS 76 -14.513 -1.401 -2.349 1348 HE3 LYS 76 1HE LYS 76 -14.095 -0.661 -0.750 1349 HZ1 LYS 76 3HZ LYS 76 -16.675 -0.540 -2.204 1350 HZ2 LYS 76 1HZ LYS 76 -16.311 0.401 -0.805 1351 HZ3 LYS 76 2HZ LYS 76 -16.318 -1.322 -0.727 1352 H ALA 77 H ALA 77 -11.503 2.923 -6.409 1353 HA ALA 77 HA ALA 77 -11.950 0.476 -7.710 1354 HB1 ALA 77 1HB ALA 77 -11.833 1.790 -9.839 1355 HB2 ALA 77 2HB ALA 77 -11.119 3.183 -8.939 1356 HB3 ALA 77 3HB ALA 77 -12.813 2.666 -8.608 1357 H GLY 78 H GLY 78 -9.014 2.429 -7.238 1358 HA2 GLY 78 2HA GLY 78 -7.354 1.053 -9.059 1359 HA3 GLY 78 1HA GLY 78 -6.888 2.038 -7.621 1360 H ILE 79 H ILE 79 -8.024 0.642 -5.560 1361 HA ILE 79 HA ILE 79 -6.205 -1.433 -5.158 1362 HB ILE 79 HB ILE 79 -8.824 -0.819 -3.708 1363 HG12 ILE 79 2HG1 ILE 79 -5.900 -0.146 -2.969 1364 HG13 ILE 79 1HG1 ILE 79 -7.015 1.012 -3.736 1365 HG21 ILE 79 1HG2 ILE 79 -7.844 -2.180 -1.808 1366 HG22 ILE 79 2HG2 ILE 79 -6.456 -2.631 -2.863 1367 HG23 ILE 79 3HG2 ILE 79 -8.122 -3.192 -3.255 1368 HD11 ILE 79 3HD ILE 79 -7.368 -0.257 -0.942 1369 HD12 ILE 79 1HD ILE 79 -6.952 1.444 -1.327 1370 HD13 ILE 79 2HD ILE 79 -8.584 0.806 -1.748 1371 H GLU 80 H GLU 80 -9.645 -1.477 -6.222 1372 HA GLU 80 HA GLU 80 -10.055 -4.207 -6.101 1373 HB2 GLU 80 2HB GLU 80 -11.143 -2.204 -8.169 1374 HB3 GLU 80 1HB GLU 80 -11.747 -3.886 -7.988 1375 HG2 GLU 80 2HG GLU 80 -12.628 -3.421 -5.745 1376 HG3 GLU 80 1HG GLU 80 -11.945 -1.762 -5.763 1377 H VAL 81 H VAL 81 -8.786 -2.296 -8.900 1378 HA VAL 81 HA VAL 81 -8.702 -4.601 -10.538 1379 HB VAL 81 HB VAL 81 -7.478 -3.182 -12.161 1380 HG11 VAL 81 1HG1 VAL 81 -9.992 -3.291 -12.016 1381 HG12 VAL 81 2HG1 VAL 81 -9.422 -1.667 -12.538 1382 HG13 VAL 81 3HG1 VAL 81 -9.990 -1.911 -10.850 1383 HG21 VAL 81 3HG2 VAL 81 -7.732 -1.005 -9.971 1384 HG22 VAL 81 1HG2 VAL 81 -7.179 -0.768 -11.648 1385 HG23 VAL 81 2HG2 VAL 81 -6.180 -1.729 -10.534 1386 H PHE 82 H PHE 82 -6.202 -2.907 -8.559 1387 HA PHE 82 HA PHE 82 -4.141 -4.601 -9.581 1388 HB2 PHE 82 2HB PHE 82 -4.183 -2.812 -7.069 1389 HB3 PHE 82 1HB PHE 82 -2.714 -3.623 -7.727 1390 HD1 PHE 82 1HD PHE 82 -3.010 -3.154 -10.704 1391 HD2 PHE 82 2HD PHE 82 -3.728 -0.553 -7.343 1392 HE1 PHE 82 1HE PHE 82 -2.580 -1.196 -12.124 1393 HE2 PHE 82 2HE PHE 82 -3.285 1.404 -8.769 1394 HZ PHE 82 HZ PHE 82 -2.694 1.097 -11.163 1395 H ALA 83 H ALA 83 -6.409 -4.797 -6.835 1396 HA ALA 83 HA ALA 83 -5.034 -6.905 -5.550 1397 HB1 ALA 83 1HB ALA 83 -6.813 -5.621 -4.351 1398 HB2 ALA 83 2HB ALA 83 -7.207 -7.375 -4.383 1399 HB3 ALA 83 3HB ALA 83 -8.045 -6.236 -5.510 1400 H LEU 84 H LEU 84 -7.430 -6.730 -8.188 1401 HA LEU 84 HA LEU 84 -8.090 -9.431 -8.277 1402 HB2 LEU 84 2HB LEU 84 -9.301 -7.551 -9.408 1403 HB3 LEU 84 1HB LEU 84 -8.005 -7.441 -10.631 1404 HG LEU 84 HG LEU 84 -9.407 -10.118 -10.187 1405 HD11 LEU 84 1HD1 LEU 84 -10.686 -7.774 -11.735 1406 HD12 LEU 84 2HD1 LEU 84 -11.287 -8.496 -10.199 1407 HD13 LEU 84 3HD1 LEU 84 -11.284 -9.475 -11.710 1408 HD21 LEU 84 3HD2 LEU 84 -9.168 -10.330 -12.682 1409 HD22 LEU 84 1HD2 LEU 84 -7.579 -10.033 -11.907 1410 HD23 LEU 84 2HD2 LEU 84 -8.425 -8.694 -12.758 1411 H VAL 85 H VAL 85 -5.325 -7.661 -9.635 1412 HA VAL 85 HA VAL 85 -4.351 -9.607 -11.354 1413 HB VAL 85 HB VAL 85 -2.787 -7.540 -9.724 1414 HG11 VAL 85 1HG1 VAL 85 -1.965 -9.176 -12.226 1415 HG12 VAL 85 2HG1 VAL 85 -1.187 -9.212 -10.600 1416 HG13 VAL 85 3HG1 VAL 85 -1.084 -7.731 -11.602 1417 HG21 VAL 85 3HG2 VAL 85 -4.038 -7.460 -12.566 1418 HG22 VAL 85 1HG2 VAL 85 -2.942 -6.208 -11.882 1419 HG23 VAL 85 2HG2 VAL 85 -4.541 -6.494 -11.143 1420 H THR 86 H THR 86 -4.411 -9.576 -7.830 1421 HA THR 86 HA THR 86 -2.280 -11.278 -7.386 1422 HB THR 86 HB THR 86 -4.776 -11.312 -5.654 1423 HG1 THR 86 1HG THR 86 -4.457 -9.246 -5.816 1424 HG21 THR 86 3HG2 THR 86 -3.028 -11.532 -3.841 1425 HG22 THR 86 1HG2 THR 86 -1.720 -11.467 -5.072 1426 HG23 THR 86 2HG2 THR 86 -2.854 -12.865 -5.025 1427 H ALA 87 H ALA 87 -5.322 -11.990 -8.968 1428 HA ALA 87 HA ALA 87 -5.394 -14.758 -8.347 1429 HB1 ALA 87 1HB ALA 87 -7.341 -13.591 -9.409 1430 HB2 ALA 87 2HB ALA 87 -6.794 -14.983 -10.410 1431 HB3 ALA 87 3HB ALA 87 -6.357 -13.295 -10.886 1432 H ALA 88 H ALA 88 -3.519 -12.800 -10.668 1433 HA ALA 88 HA ALA 88 -2.581 -15.110 -12.125 1434 HB1 ALA 88 1HB ALA 88 -2.703 -12.873 -13.299 1435 HB2 ALA 88 2HB ALA 88 -1.007 -13.484 -13.234 1436 HB3 ALA 88 3HB ALA 88 -1.545 -12.198 -12.095 1437 H LEU 89 H LEU 89 -1.603 -13.045 -9.416 1438 HA LEU 89 HA LEU 89 1.033 -14.146 -9.277 1439 HB2 LEU 89 2HB LEU 89 -0.505 -12.579 -7.127 1440 HB3 LEU 89 1HB LEU 89 1.258 -12.905 -7.157 1441 HG LEU 89 HG LEU 89 -0.258 -11.207 -9.236 1442 HD11 LEU 89 1HD1 LEU 89 0.842 -9.254 -8.144 1443 HD12 LEU 89 2HD1 LEU 89 1.556 -10.338 -6.894 1444 HD13 LEU 89 3HD1 LEU 89 -0.230 -10.124 -6.990 1445 HD21 LEU 89 3HD2 LEU 89 2.775 -11.672 -8.844 1446 HD22 LEU 89 1HD2 LEU 89 2.031 -10.483 -9.974 1447 HD23 LEU 89 2HD2 LEU 89 1.781 -12.243 -10.234 1448 H ALA 90 H ALA 90 -2.103 -15.001 -7.839 1449 HA ALA 90 HA ALA 90 -1.021 -16.553 -5.767 1450 HB1 ALA 90 1HB ALA 90 -3.721 -16.859 -7.194 1451 HB2 ALA 90 2HB ALA 90 -3.400 -15.815 -5.762 1452 HB3 ALA 90 3HB ALA 90 -3.264 -17.604 -5.606 1453 H THR 91 H THR 91 -1.573 -17.200 -9.231 1454 HA THR 91 HA THR 91 -1.039 -19.952 -9.051 1455 HB THR 91 HB THR 91 -0.204 -19.122 -11.646 1456 HG1 THR 91 1HG THR 91 -1.015 -17.052 -11.244 1457 HG21 THR 91 3HG2 THR 91 -1.632 -21.099 -11.006 1458 HG22 THR 91 1HG2 THR 91 -2.391 -20.105 -12.302 1459 HG23 THR 91 2HG2 THR 91 -2.987 -19.976 -10.607 1460 H ASP 92 H ASP 92 1.117 -17.318 -8.418 1461 HA ASP 92 HA ASP 92 3.288 -18.361 -9.881 1462 HB2 ASP 92 2HB ASP 92 3.128 -16.192 -7.744 1463 HB3 ASP 92 1HB ASP 92 4.707 -16.883 -8.208 1464 H PHE 93 H PHE 93 1.936 -19.234 -6.779 1465 HA PHE 93 HA PHE 93 4.326 -20.611 -5.965 1466 HB2 PHE 93 2HB PHE 93 3.160 -21.586 -4.155 1467 HB3 PHE 93 1HB PHE 93 2.641 -19.874 -4.244 1468 HD1 PHE 93 1HD PHE 93 1.620 -23.431 -4.873 1469 HD2 PHE 93 2HD PHE 93 0.315 -19.377 -4.291 1470 HE1 PHE 93 1HE PHE 93 -0.663 -24.234 -4.443 1471 HE2 PHE 93 2HE PHE 93 -1.971 -20.182 -3.854 1472 HZ PHE 93 HZ PHE 93 -2.458 -22.623 -3.883 1473 H VAL 94 H VAL 94 1.613 -21.258 -8.084 1474 HA VAL 94 HA VAL 94 1.657 -24.075 -7.798 1475 HB VAL 94 HB VAL 94 0.457 -22.366 -10.039 1476 HG11 VAL 94 1HG1 VAL 94 -0.070 -25.268 -9.102 1477 HG12 VAL 94 2HG1 VAL 94 0.643 -24.768 -10.684 1478 HG13 VAL 94 3HG1 VAL 94 -1.069 -24.369 -10.309 1479 HG21 VAL 94 3HG2 VAL 94 -1.655 -22.552 -8.682 1480 HG22 VAL 94 1HG2 VAL 94 -0.400 -21.670 -7.756 1481 HG23 VAL 94 2HG2 VAL 94 -0.751 -23.389 -7.371 1482 H ARG 95 H ARG 95 3.110 -21.708 -10.108 1483 HA ARG 95 HA ARG 95 4.117 -23.591 -11.898 1484 HB2 ARG 95 2HB ARG 95 5.527 -20.979 -11.099 1485 HB3 ARG 95 1HB ARG 95 5.969 -22.022 -12.486 1486 HG2 ARG 95 2HG ARG 95 3.665 -21.596 -13.487 1487 HG3 ARG 95 1HG ARG 95 3.444 -20.340 -12.208 1488 HD2 ARG 95 2HD ARG 95 5.771 -19.361 -13.035 1489 HD3 ARG 95 1HD ARG 95 5.628 -20.494 -14.422 1490 HE ARG 95 HE ARG 95 4.115 -19.043 -15.397 1491 HH11 ARG 95 1HH2 ARG 95 4.541 -18.123 -11.923 1492 HH12 ARG 95 2HH2 ARG 95 3.427 -16.843 -11.927 1493 HH21 ARG 95 1HH1 ARG 95 2.858 -16.984 -15.531 1494 HH22 ARG 95 2HH1 ARG 95 2.630 -16.072 -14.093 1495 H ARG 96 H ARG 96 5.230 -22.846 -8.652 1496 HA ARG 96 HA ARG 96 7.900 -23.585 -8.727 1497 HB2 ARG 96 2HB ARG 96 6.752 -22.747 -6.609 1498 HB3 ARG 96 1HB ARG 96 5.787 -24.257 -6.566 1499 HG2 ARG 96 2HG ARG 96 7.897 -25.598 -6.178 1500 HG3 ARG 96 1HG ARG 96 8.821 -24.068 -6.152 1501 HD2 ARG 96 2HD ARG 96 8.419 -24.923 -3.861 1502 HD3 ARG 96 1HD ARG 96 7.531 -23.356 -4.076 1503 HE ARG 96 HE ARG 96 5.482 -24.936 -4.622 1504 HH11 ARG 96 1HH2 ARG 96 7.908 -25.756 -2.007 1505 HH12 ARG 96 2HH2 ARG 96 6.707 -26.463 -1.032 1506 HH21 ARG 96 1HH1 ARG 96 4.000 -25.862 -3.289 1507 HH22 ARG 96 2HH1 ARG 96 4.403 -26.510 -1.723 1508 H GLU 97 H GLU 97 4.935 -25.609 -8.492 1509 HA GLU 97 HA GLU 97 6.502 -27.983 -8.063 1510 HB2 GLU 97 2HB GLU 97 3.523 -27.432 -8.374 1511 HB3 GLU 97 1HB GLU 97 4.171 -29.106 -8.281 1512 HG2 GLU 97 2HG GLU 97 5.081 -28.807 -6.078 1513 HG3 GLU 97 1HG GLU 97 4.892 -27.019 -6.133 1514 H GLU 98 H GLU 98 5.100 -26.286 -10.811 1515 HA GLU 98 HA GLU 98 5.214 -28.466 -12.614 1516 HB2 GLU 98 2HB GLU 98 5.503 -25.455 -13.205 1517 HB3 GLU 98 1HB GLU 98 5.109 -26.719 -14.408 1518 HG2 GLU 98 2HG GLU 98 3.260 -26.037 -12.006 1519 HG3 GLU 98 1HG GLU 98 3.207 -25.202 -13.597 1520 H GLU 99 H GLU 99 7.515 -25.944 -11.541 1521 HA GLU 99 HA GLU 99 9.469 -26.515 -13.499 1522 HB2 GLU 99 2HB GLU 99 9.139 -24.451 -11.757 1523 HB3 GLU 99 1HB GLU 99 10.322 -25.392 -10.799 1524 HG2 GLU 99 2HG GLU 99 10.690 -24.334 -13.693 1525 HG3 GLU 99 1HG GLU 99 11.406 -23.633 -12.197 1526 H ARG 100 H ARG 100 8.950 -27.510 -10.133 1527 HA ARG 100 HA ARG 100 11.168 -28.996 -9.661 1528 HB2 ARG 100 2HB ARG 100 9.162 -28.372 -8.117 1529 HB3 ARG 100 1HB ARG 100 8.338 -29.831 -8.751 1530 HG2 ARG 100 2HG ARG 100 10.311 -31.212 -7.845 1531 HG3 ARG 100 1HG ARG 100 11.000 -29.677 -7.213 1532 HD2 ARG 100 2HD ARG 100 8.799 -29.397 -5.833 1533 HD3 ARG 100 1HD ARG 100 8.387 -31.101 -6.318 1534 HE ARG 100 HE ARG 100 11.117 -30.629 -5.182 1535 HH11 ARG 100 1HH2 ARG 100 7.638 -31.389 -4.195 1536 HH12 ARG 100 2HH2 ARG 100 8.127 -32.099 -2.751 1537 HH21 ARG 100 1HH1 ARG 100 11.658 -31.631 -3.112 1538 HH22 ARG 100 2HH1 ARG 100 10.406 -32.155 -2.059 1539 H ARG 101 H ARG 101 8.200 -30.085 -11.404 1540 HA ARG 101 HA ARG 101 9.637 -32.569 -12.105 1541 HB2 ARG 101 2HB ARG 101 6.640 -32.175 -11.521 1542 HB3 ARG 101 1HB ARG 101 7.321 -33.624 -12.331 1543 HG2 ARG 101 2HG ARG 101 7.959 -32.717 -9.454 1544 HG3 ARG 101 1HG ARG 101 6.843 -34.035 -9.960 1545 HD2 ARG 101 2HD ARG 101 8.926 -35.129 -11.151 1546 HD3 ARG 101 1HD ARG 101 9.928 -33.941 -10.243 1547 HE ARG 101 HE ARG 101 9.497 -35.105 -8.254 1548 HH11 ARG 101 1HH2 ARG 101 7.342 -36.453 -10.867 1549 HH12 ARG 101 2HH2 ARG 101 6.792 -37.755 -9.923 1550 HH21 ARG 101 1HH1 ARG 101 8.904 -37.069 -7.052 1551 HH22 ARG 101 2HH1 ARG 101 7.759 -38.161 -7.710 1552 H GLY 102 H GLY 102 10.317 -32.167 -14.121 1553 HA2 GLY 102 2HA GLY 102 9.448 -32.461 -16.352 1554 HA3 GLY 102 1HA GLY 102 8.363 -31.043 -16.032 1555 H HIS 103 H HIS 103 9.948 -29.411 -14.565 1556 HA HIS 103 HA HIS 103 11.271 -27.753 -14.735 1557 HB2 HIS 103 2HB HIS 103 13.213 -29.406 -16.410 1558 HB3 HIS 103 1HB HIS 103 13.511 -27.754 -15.756 1559 HD1 HIS 103 1HD HIS 103 14.124 -31.180 -14.835 1560 HD2 HIS 103 2HD HIS 103 13.330 -27.565 -12.823 1561 HE1 HIS 103 1HE HIS 103 14.992 -31.414 -12.455 1562 HE2 HIS 103 2HE HIS 103 14.570 -29.138 -11.324 1563 H1 SER 1 H SER 1 16.664 -21.727 0.728 1564 HA SER 1 HA SER 1 17.894 -21.233 -1.149 1565 HB2 SER 1 2HB SER 1 18.710 -24.215 -1.045 1566 HB3 SER 1 1HB SER 1 19.062 -23.143 -2.452 1567 HG SER 1 1HG SER 1 20.729 -23.391 -0.730 1568 H ALA 2 H ALA 2 15.239 -21.385 -0.763 1569 HA ALA 2 HA ALA 2 14.207 -23.519 -2.472 1570 HB1 ALA 2 1HB ALA 2 12.727 -21.174 -1.144 1571 HB2 ALA 2 2HB ALA 2 12.830 -22.851 -0.513 1572 HB3 ALA 2 3HB ALA 2 11.955 -22.532 -2.052 1573 H ASP 3 H ASP 3 13.325 -23.158 -4.549 1574 HA ASP 3 HA ASP 3 14.504 -21.371 -6.218 1575 HB2 ASP 3 2HB ASP 3 13.115 -23.516 -6.748 1576 HB3 ASP 3 1HB ASP 3 11.646 -22.479 -6.674 1577 H HIS 4 H HIS 4 11.331 -21.177 -4.682 1578 HA HIS 4 HA HIS 4 10.475 -18.745 -5.652 1579 HB2 HIS 4 2HB HIS 4 8.834 -18.582 -3.969 1580 HB3 HIS 4 1HB HIS 4 8.945 -20.301 -4.374 1581 HD1 HIS 4 1HD HIS 4 10.882 -18.416 -1.517 1582 HD2 HIS 4 2HD HIS 4 7.641 -21.026 -2.034 1583 HE1 HIS 4 1HE HIS 4 9.933 -18.937 0.788 1584 HE2 HIS 4 2HE HIS 4 7.880 -20.325 0.404 1585 H GLU 5 H GLU 5 12.903 -19.322 -3.246 1586 HA GLU 5 HA GLU 5 12.488 -16.856 -1.774 1587 HB2 GLU 5 2HB GLU 5 13.198 -19.166 -0.792 1588 HB3 GLU 5 1HB GLU 5 14.747 -18.978 -1.668 1589 HG2 GLU 5 2HG GLU 5 15.304 -16.991 -0.246 1590 HG3 GLU 5 1HG GLU 5 13.730 -17.188 0.620 1591 H ARG 6 H ARG 6 14.710 -18.464 -4.064 1592 HA ARG 6 HA ARG 6 16.579 -16.377 -4.179 1593 HB2 ARG 6 2HB ARG 6 15.897 -18.594 -6.210 1594 HB3 ARG 6 1HB ARG 6 17.341 -17.542 -6.311 1595 HG2 ARG 6 2HG ARG 6 16.723 -19.496 -4.006 1596 HG3 ARG 6 1HG ARG 6 17.827 -19.809 -5.393 1597 HD2 ARG 6 2HD ARG 6 19.357 -17.982 -4.659 1598 HD3 ARG 6 1HD ARG 6 18.219 -17.543 -3.311 1599 HE ARG 6 HE ARG 6 19.075 -20.365 -3.273 1600 HH11 ARG 6 1HH2 ARG 6 20.126 -16.999 -2.437 1601 HH12 ARG 6 2HH2 ARG 6 21.488 -17.546 -1.573 1602 HH21 ARG 6 1HH1 ARG 6 20.452 -20.999 -1.351 1603 HH22 ARG 6 2HH1 ARG 6 21.445 -19.854 -0.664 1604 H GLU 7 H GLU 7 13.711 -17.151 -6.200 1605 HA GLU 7 HA GLU 7 14.163 -15.141 -8.067 1606 HB2 GLU 7 2HB GLU 7 12.596 -17.099 -8.353 1607 HB3 GLU 7 1HB GLU 7 11.478 -16.336 -7.174 1608 HG2 GLU 7 2HG GLU 7 10.624 -15.960 -9.405 1609 HG3 GLU 7 1HG GLU 7 11.207 -14.375 -8.788 1610 H ALA 8 H ALA 8 12.549 -15.054 -4.886 1611 HA ALA 8 HA ALA 8 11.399 -12.502 -5.168 1612 HB1 ALA 8 1HB ALA 8 12.370 -13.920 -2.601 1613 HB2 ALA 8 2HB ALA 8 10.719 -14.053 -3.317 1614 HB3 ALA 8 3HB ALA 8 11.295 -12.476 -2.662 1615 H GLN 9 H GLN 9 14.595 -13.608 -3.971 1616 HA GLN 9 HA GLN 9 15.406 -10.997 -3.209 1617 HB2 GLN 9 2HB GLN 9 17.130 -13.457 -3.832 1618 HB3 GLN 9 1HB GLN 9 17.681 -11.924 -3.076 1619 HG2 GLN 9 2HG GLN 9 15.409 -12.653 -1.501 1620 HG3 GLN 9 1HG GLN 9 16.174 -14.241 -1.871 1621 HE21 GLN 9 1HE2 GLN 9 16.914 -10.848 -0.777 1622 HE22 GLN 9 2HE2 GLN 9 18.312 -11.263 0.174 1623 H LYS 10 H LYS 10 15.594 -12.833 -6.229 1624 HA LYS 10 HA LYS 10 17.415 -11.132 -7.567 1625 HB2 LYS 10 2HB LYS 10 16.597 -13.505 -8.267 1626 HB3 LYS 10 1HB LYS 10 15.075 -12.728 -8.786 1627 HG2 LYS 10 2HG LYS 10 16.523 -11.281 -10.407 1628 HG3 LYS 10 1HG LYS 10 17.918 -12.290 -9.896 1629 HD2 LYS 10 2HD LYS 10 17.191 -13.333 -11.903 1630 HD3 LYS 10 1HD LYS 10 16.483 -14.350 -10.597 1631 HE2 LYS 10 2HE LYS 10 14.302 -12.893 -10.912 1632 HE3 LYS 10 1HE LYS 10 15.075 -12.271 -12.420 1633 HZ1 LYS 10 3HZ LYS 10 15.204 -14.700 -13.135 1634 HZ2 LYS 10 1HZ LYS 10 13.628 -14.103 -12.863 1635 HZ3 LYS 10 2HZ LYS 10 14.304 -15.039 -11.684 1636 H ALA 11 H ALA 11 13.893 -11.068 -7.036 1637 HA ALA 11 HA ALA 11 13.282 -9.088 -8.899 1638 HB1 ALA 11 1HB ALA 11 11.132 -8.836 -7.713 1639 HB2 ALA 11 2HB ALA 11 11.802 -9.657 -6.257 1640 HB3 ALA 11 3HB ALA 11 11.564 -10.582 -7.783 1641 H GLU 12 H GLU 12 14.527 -8.863 -5.574 1642 HA GLU 12 HA GLU 12 13.989 -6.186 -5.063 1643 HB2 GLU 12 2HB GLU 12 16.540 -7.756 -4.291 1644 HB3 GLU 12 1HB GLU 12 15.962 -6.243 -3.525 1645 HG2 GLU 12 2HG GLU 12 13.952 -7.464 -2.632 1646 HG3 GLU 12 1HG GLU 12 14.523 -8.988 -3.406 1647 H GLU 13 H GLU 13 16.607 -7.757 -6.876 1648 HA GLU 13 HA GLU 13 18.250 -5.466 -7.097 1649 HB2 GLU 13 2HB GLU 13 18.303 -7.990 -8.861 1650 HB3 GLU 13 1HB GLU 13 19.667 -6.882 -8.479 1651 HG2 GLU 13 2HG GLU 13 19.465 -7.657 -6.016 1652 HG3 GLU 13 1HG GLU 13 18.201 -8.824 -6.549 1653 H GLU 14 H GLU 14 15.572 -6.802 -8.892 1654 HA GLU 14 HA GLU 14 16.072 -5.528 -11.376 1655 HB2 GLU 14 2HB GLU 14 14.610 -7.602 -11.036 1656 HB3 GLU 14 1HB GLU 14 13.422 -6.556 -10.196 1657 HG2 GLU 14 2HG GLU 14 12.525 -6.848 -12.339 1658 HG3 GLU 14 1HG GLU 14 13.241 -5.205 -12.430 1659 H LEU 15 H LEU 15 14.281 -4.729 -8.387 1660 HA LEU 15 HA LEU 15 12.946 -2.509 -9.418 1661 HB2 LEU 15 2HB LEU 15 12.335 -3.575 -7.269 1662 HB3 LEU 15 1HB LEU 15 13.875 -3.040 -6.529 1663 HG LEU 15 HG LEU 15 13.183 -0.707 -6.588 1664 HD11 LEU 15 1HD1 LEU 15 12.041 -0.487 -8.749 1665 HD12 LEU 15 2HD1 LEU 15 10.897 -0.001 -7.463 1666 HD13 LEU 15 3HD1 LEU 15 10.742 -1.622 -8.239 1667 HD21 LEU 15 3HD2 LEU 15 10.826 -2.466 -5.640 1668 HD22 LEU 15 1HD2 LEU 15 11.155 -0.774 -5.128 1669 HD23 LEU 15 2HD2 LEU 15 12.315 -2.087 -4.701 1670 H GLN 16 H GLN 16 16.154 -2.802 -7.851 1671 HA GLN 16 HA GLN 16 16.579 -0.030 -7.754 1672 HB2 GLN 16 2HB GLN 16 18.766 -2.164 -7.724 1673 HB3 GLN 16 1HB GLN 16 18.858 -0.465 -7.147 1674 HG2 GLN 16 2HG GLN 16 16.698 -1.218 -5.674 1675 HG3 GLN 16 1HG GLN 16 17.380 -2.864 -5.910 1676 HE21 GLN 16 1HE2 GLN 16 19.848 -3.044 -5.256 1677 HE22 GLN 16 2HE2 GLN 16 20.280 -2.181 -3.818 1678 H LYS 17 H LYS 17 16.919 -2.281 -10.405 1679 HA LYS 17 HA LYS 17 18.650 -0.823 -12.060 1680 HB2 LYS 17 2HB LYS 17 17.849 -3.201 -12.473 1681 HB3 LYS 17 1HB LYS 17 16.210 -2.552 -12.796 1682 HG2 LYS 17 2HG LYS 17 17.169 -1.242 -14.758 1683 HG3 LYS 17 1HG LYS 17 18.700 -2.154 -14.550 1684 HD2 LYS 17 2HD LYS 17 15.914 -3.450 -14.873 1685 HD3 LYS 17 1HD LYS 17 16.959 -3.038 -16.277 1686 HE2 LYS 17 2HE LYS 17 18.611 -4.684 -15.737 1687 HE3 LYS 17 1HE LYS 17 18.007 -4.895 -14.046 1688 HZ1 LYS 17 3HZ LYS 17 16.061 -5.517 -16.153 1689 HZ2 LYS 17 1HZ LYS 17 16.363 -6.212 -14.662 1690 HZ3 LYS 17 2HZ LYS 17 17.368 -6.581 -15.973 1691 H VAL 18 H VAL 18 15.107 -0.674 -11.491 1692 HA VAL 18 HA VAL 18 14.570 1.153 -13.556 1693 HB VAL 18 HB VAL 18 12.932 0.662 -11.009 1694 HG11 VAL 18 1HG1 VAL 18 12.153 1.665 -13.842 1695 HG12 VAL 18 2HG1 VAL 18 12.185 2.662 -12.339 1696 HG13 VAL 18 3HG1 VAL 18 11.007 1.316 -12.498 1697 HG21 VAL 18 3HG2 VAL 18 13.417 -1.528 -12.053 1698 HG22 VAL 18 1HG2 VAL 18 13.024 -0.885 -13.691 1699 HG23 VAL 18 2HG2 VAL 18 11.737 -1.064 -12.448 1700 H LEU 19 H LEU 19 15.320 1.491 -10.070 1701 HA LEU 19 HA LEU 19 14.797 4.232 -9.868 1702 HB2 LEU 19 2HB LEU 19 16.744 2.437 -8.309 1703 HB3 LEU 19 1HB LEU 19 16.625 4.197 -7.995 1704 HG LEU 19 HG LEU 19 14.234 4.019 -7.428 1705 HD11 LEU 19 1HD1 LEU 19 13.543 1.908 -8.578 1706 HD12 LEU 19 2HD1 LEU 19 13.241 1.808 -6.816 1707 HD13 LEU 19 3HD1 LEU 19 14.655 0.970 -7.506 1708 HD21 LEU 19 3HD2 LEU 19 15.996 4.050 -5.692 1709 HD22 LEU 19 1HD2 LEU 19 16.133 2.245 -5.759 1710 HD23 LEU 19 2HD2 LEU 19 14.610 3.018 -5.184 1711 H GLU 20 H GLU 20 17.785 2.480 -10.882 1712 HA GLU 20 HA GLU 20 19.253 4.937 -10.957 1713 HB2 GLU 20 2HB GLU 20 20.017 2.182 -12.033 1714 HB3 GLU 20 1HB GLU 20 21.093 3.622 -11.889 1715 HG2 GLU 20 2HG GLU 20 20.578 3.631 -9.356 1716 HG3 GLU 20 1HG GLU 20 19.796 2.028 -9.577 1717 H GLU 21 H GLU 21 17.288 3.137 -13.240 1718 HA GLU 21 HA GLU 21 18.337 4.544 -15.517 1719 HB2 GLU 21 2HB GLU 21 16.965 2.211 -15.327 1720 HB3 GLU 21 1HB GLU 21 15.572 3.303 -15.540 1721 HG2 GLU 21 2HG GLU 21 16.120 2.573 -17.740 1722 HG3 GLU 21 1HG GLU 21 16.885 4.204 -17.670 1723 H ALA 22 H ALA 22 15.483 4.714 -13.368 1724 HA ALA 22 HA ALA 22 14.367 6.923 -14.695 1725 HB1 ALA 22 1HB ALA 22 12.743 6.992 -12.829 1726 HB2 ALA 22 2HB ALA 22 13.764 5.831 -11.896 1727 HB3 ALA 22 3HB ALA 22 12.965 5.309 -13.424 1728 H SER 23 H SER 23 16.861 6.746 -12.147 1729 HA SER 23 HA SER 23 16.326 9.300 -11.098 1730 HB2 SER 23 2HB SER 23 18.766 9.214 -10.343 1731 HB3 SER 23 1HB SER 23 17.757 7.819 -9.827 1732 HG SER 23 1HG SER 23 19.742 7.143 -10.647 1733 H LYS 24 H LYS 24 18.261 8.103 -13.832 1734 HA LYS 24 HA LYS 24 19.337 10.638 -14.507 1735 HB2 LYS 24 2HB LYS 24 20.267 8.406 -15.316 1736 HB3 LYS 24 1HB LYS 24 18.841 8.262 -16.396 1737 HG2 LYS 24 2HG LYS 24 19.545 10.540 -17.432 1738 HG3 LYS 24 1HG LYS 24 21.068 10.412 -16.492 1739 HD2 LYS 24 2HD LYS 24 19.976 8.410 -18.563 1740 HD3 LYS 24 1HD LYS 24 21.238 9.644 -18.891 1741 HE2 LYS 24 2HE LYS 24 22.819 8.515 -17.313 1742 HE3 LYS 24 1HE LYS 24 21.539 7.344 -16.834 1743 HZ1 LYS 24 3HZ LYS 24 21.462 6.778 -19.314 1744 HZ2 LYS 24 1HZ LYS 24 22.790 6.238 -18.345 1745 HZ3 LYS 24 2HZ LYS 24 22.959 7.534 -19.431 1746 H LYS 25 H LYS 25 16.484 8.743 -15.601 1747 HA LYS 25 HA LYS 25 15.576 10.569 -17.495 1748 HB2 LYS 25 2HB LYS 25 13.825 8.786 -15.699 1749 HB3 LYS 25 1HB LYS 25 13.266 9.661 -17.157 1750 HG2 LYS 25 2HG LYS 25 14.795 8.331 -18.606 1751 HG3 LYS 25 1HG LYS 25 15.396 7.441 -17.171 1752 HD2 LYS 25 2HD LYS 25 12.978 6.691 -16.728 1753 HD3 LYS 25 1HD LYS 25 12.535 7.405 -18.320 1754 HE2 LYS 25 2HE LYS 25 14.167 5.831 -19.466 1755 HE3 LYS 25 1HE LYS 25 14.633 5.169 -17.849 1756 HZ1 LYS 25 3HZ LYS 25 13.132 3.674 -18.704 1757 HZ2 LYS 25 1HZ LYS 25 12.073 4.820 -19.323 1758 HZ3 LYS 25 2HZ LYS 25 12.146 4.595 -17.644 1759 H ALA 26 H ALA 26 14.940 10.411 -13.944 1760 HA ALA 26 HA ALA 26 13.061 12.385 -13.813 1761 HB1 ALA 26 1HB ALA 26 13.691 12.667 -11.422 1762 HB2 ALA 26 2HB ALA 26 15.227 11.764 -11.706 1763 HB3 ALA 26 3HB ALA 26 13.639 10.926 -11.864 1764 H VAL 27 H VAL 27 16.676 12.823 -13.449 1765 HA VAL 27 HA VAL 27 16.246 15.633 -13.175 1766 HB VAL 27 HB VAL 27 18.695 15.899 -13.411 1767 HG11 VAL 27 1HG1 VAL 27 17.496 15.571 -11.249 1768 HG12 VAL 27 2HG1 VAL 27 19.110 14.753 -11.226 1769 HG13 VAL 27 3HG1 VAL 27 17.602 13.787 -11.430 1770 HG21 VAL 27 3HG2 VAL 27 19.166 13.934 -14.941 1771 HG22 VAL 27 1HG2 VAL 27 18.688 12.800 -13.628 1772 HG23 VAL 27 2HG2 VAL 27 20.124 13.860 -13.422 1773 H GLU 28 H GLU 28 16.715 13.522 -15.966 1774 HA GLU 28 HA GLU 28 17.429 15.627 -17.735 1775 HB2 GLU 28 2HB GLU 28 17.852 13.110 -18.052 1776 HB3 GLU 28 1HB GLU 28 16.104 12.918 -18.395 1777 HG2 GLU 28 2HG GLU 28 16.378 14.473 -20.388 1778 HG3 GLU 28 1HG GLU 28 18.131 14.633 -19.990 1779 H ALA 29 H ALA 29 14.428 14.077 -16.669 1780 HA ALA 29 HA ALA 29 12.714 15.319 -18.524 1781 HB1 ALA 29 1HB ALA 29 10.933 14.272 -17.154 1782 HB2 ALA 29 2HB ALA 29 12.109 13.911 -15.851 1783 HB3 ALA 29 3HB ALA 29 12.236 13.102 -17.452 1784 H GLU 30 H GLU 30 13.374 15.816 -14.977 1785 HA GLU 30 HA GLU 30 11.691 18.051 -14.744 1786 HB2 GLU 30 2HB GLU 30 13.979 16.923 -13.097 1787 HB3 GLU 30 1HB GLU 30 13.309 18.512 -12.661 1788 HG2 GLU 30 2HG GLU 30 11.314 16.236 -13.056 1789 HG3 GLU 30 1HG GLU 30 12.354 16.218 -11.594 1790 H ARG 31 H ARG 31 15.155 17.784 -15.721 1791 HA ARG 31 HA ARG 31 15.610 20.568 -15.499 1792 HB2 ARG 31 2HB ARG 31 17.480 18.948 -15.718 1793 HB3 ARG 31 1HB ARG 31 16.885 18.478 -17.336 1794 HG2 ARG 31 2HG ARG 31 17.416 20.890 -18.119 1795 HG3 ARG 31 1HG ARG 31 18.088 21.195 -16.481 1796 HD2 ARG 31 2HD ARG 31 19.911 20.623 -18.091 1797 HD3 ARG 31 1HD ARG 31 19.752 19.321 -16.832 1798 HE ARG 31 HE ARG 31 18.076 18.773 -19.172 1799 HH11 ARG 31 1HH2 ARG 31 21.564 18.715 -18.103 1800 HH12 ARG 31 2HH2 ARG 31 21.997 17.473 -19.200 1801 HH21 ARG 31 1HH1 ARG 31 18.731 17.075 -20.680 1802 HH22 ARG 31 2HH1 ARG 31 20.296 16.427 -20.653 1803 H GLY 32 H GLY 32 14.696 22.194 -16.691 1804 HA2 GLY 32 2HA GLY 32 14.306 23.283 -18.665 1805 HA3 GLY 32 1HA GLY 32 14.153 21.709 -19.534 1806 H ALA 33 H ALA 33 12.541 21.568 -16.505 1807 HA ALA 33 HA ALA 33 10.007 22.063 -17.855 1808 HB1 ALA 33 1HB ALA 33 8.991 20.680 -16.052 1809 HB2 ALA 33 2HB ALA 33 10.601 20.488 -15.281 1810 HB3 ALA 33 3HB ALA 33 10.295 19.762 -16.896 1811 HA PRO 34 HA PRO 34 9.717 25.520 -15.059 1812 HB2 PRO 34 2HB PRO 34 6.957 26.017 -15.089 1813 HB3 PRO 34 1HB PRO 34 8.034 26.339 -16.502 1814 HG2 PRO 34 2HG PRO 34 6.275 23.887 -15.994 1815 HG3 PRO 34 1HG PRO 34 6.408 24.878 -17.507 1816 HD2 PRO 34 2HD PRO 34 7.822 22.514 -17.129 1817 HD3 PRO 34 1HD PRO 34 8.552 23.917 -18.040 1818 H GLY 35 H GLY 35 9.771 25.637 -12.785 1819 HA2 GLY 35 2HA GLY 35 8.918 25.453 -10.720 1820 HA3 GLY 35 1HA GLY 35 7.635 24.340 -11.319 1821 H ALA 36 H ALA 36 10.477 23.286 -12.620 1822 HA ALA 36 HA ALA 36 10.534 20.900 -11.322 1823 HB1 ALA 36 1HB ALA 36 11.659 21.307 -13.516 1824 HB2 ALA 36 2HB ALA 36 12.787 20.564 -12.336 1825 HB3 ALA 36 3HB ALA 36 12.899 22.331 -12.700 1826 H ALA 37 H ALA 37 11.390 20.154 -9.533 1827 HA ALA 37 HA ALA 37 12.859 22.051 -7.767 1828 HB1 ALA 37 1HB ALA 37 10.585 21.481 -6.859 1829 HB2 ALA 37 2HB ALA 37 11.864 20.711 -5.853 1830 HB3 ALA 37 3HB ALA 37 10.934 19.731 -7.058 1831 H LEU 38 H LEU 38 12.656 18.861 -9.371 1832 HA LEU 38 HA LEU 38 14.927 17.914 -7.757 1833 HB2 LEU 38 2HB LEU 38 13.029 16.325 -7.886 1834 HB3 LEU 38 1HB LEU 38 13.044 16.444 -9.655 1835 HG LEU 38 HG LEU 38 15.145 15.288 -9.859 1836 HD11 LEU 38 1HD1 LEU 38 15.485 15.043 -6.803 1837 HD12 LEU 38 2HD1 LEU 38 16.381 16.232 -7.826 1838 HD13 LEU 38 3HD1 LEU 38 16.578 14.486 -8.101 1839 HD21 LEU 38 3HD2 LEU 38 14.569 13.062 -8.905 1840 HD22 LEU 38 1HD2 LEU 38 13.130 13.906 -9.592 1841 HD23 LEU 38 2HD2 LEU 38 13.362 13.846 -7.814 1842 H ILE 39 H ILE 39 16.394 19.457 -8.829 1843 HA ILE 39 HA ILE 39 17.198 18.359 -11.462 1844 HB ILE 39 HB ILE 39 18.122 20.722 -11.860 1845 HG12 ILE 39 2HG1 ILE 39 15.954 21.453 -9.759 1846 HG13 ILE 39 1HG1 ILE 39 17.726 21.543 -9.458 1847 HG21 ILE 39 1HG2 ILE 39 15.062 20.258 -11.819 1848 HG22 ILE 39 2HG2 ILE 39 16.192 19.616 -13.058 1849 HG23 ILE 39 3HG2 ILE 39 15.954 21.390 -12.897 1850 HD11 ILE 39 3HD ILE 39 16.141 23.167 -11.556 1851 HD12 ILE 39 1HD ILE 39 16.848 23.768 -10.014 1852 HD13 ILE 39 2HD ILE 39 17.937 23.213 -11.346 1853 H SER 40 H SER 40 18.318 16.841 -9.690 1854 HA SER 40 HA SER 40 20.945 17.978 -9.208 1855 HB2 SER 40 2HB SER 40 19.629 18.722 -7.191 1856 HB3 SER 40 1HB SER 40 18.977 17.066 -7.003 1857 HG SER 40 1HG SER 40 20.524 17.214 -5.552 1858 H TYR 41 H TYR 41 22.273 16.267 -9.858 1859 HA TYR 41 HA TYR 41 21.273 13.693 -10.285 1860 HB2 TYR 41 2HB TYR 41 24.134 14.750 -10.098 1861 HB3 TYR 41 1HB TYR 41 23.850 12.978 -10.111 1862 HD1 TYR 41 2HD TYR 41 22.093 12.116 -11.964 1863 HD2 TYR 41 1HD TYR 41 24.535 15.639 -12.194 1864 HE1 TYR 41 2HE TYR 41 22.162 11.897 -14.414 1865 HE2 TYR 41 1HE TYR 41 24.577 15.458 -14.653 1866 HH TYR 41 HH TYR 41 23.157 12.688 -16.405 1867 HA PRO 42 HA PRO 42 23.023 12.002 -6.363 1868 HB2 PRO 42 2HB PRO 42 23.333 13.594 -4.038 1869 HB3 PRO 42 1HB PRO 42 24.651 13.216 -5.214 1870 HG2 PRO 42 2HG PRO 42 22.852 15.693 -5.140 1871 HG3 PRO 42 1HG PRO 42 24.657 15.628 -5.307 1872 HD2 PRO 42 2HD PRO 42 23.048 15.935 -7.494 1873 HD3 PRO 42 1HD PRO 42 24.475 14.802 -7.600 1874 H ASP 43 H ASP 43 20.641 14.657 -6.146 1875 HA ASP 43 HA ASP 43 19.131 13.187 -4.153 1876 HB2 ASP 43 2HB ASP 43 18.265 15.662 -5.719 1877 HB3 ASP 43 1HB ASP 43 17.369 14.890 -4.377 1878 H ALA 44 H ALA 44 19.581 12.974 -7.532 1879 HA ALA 44 HA ALA 44 16.970 12.458 -8.398 1880 HB1 ALA 44 1HB ALA 44 19.577 11.265 -9.553 1881 HB2 ALA 44 2HB ALA 44 18.980 12.914 -9.910 1882 HB3 ALA 44 3HB ALA 44 17.997 11.495 -10.396 1883 H ILE 45 H ILE 45 19.569 10.341 -7.203 1884 HA ILE 45 HA ILE 45 17.992 7.968 -7.579 1885 HB ILE 45 HB ILE 45 20.319 7.762 -7.924 1886 HG12 ILE 45 2HG1 ILE 45 19.681 6.413 -5.231 1887 HG13 ILE 45 1HG1 ILE 45 19.113 5.856 -6.838 1888 HG21 ILE 45 1HG2 ILE 45 22.035 8.242 -6.143 1889 HG22 ILE 45 2HG2 ILE 45 20.758 8.950 -5.105 1890 HG23 ILE 45 3HG2 ILE 45 21.178 9.711 -6.676 1891 HD11 ILE 45 3HD ILE 45 22.065 6.055 -5.919 1892 HD12 ILE 45 1HD ILE 45 21.103 4.559 -6.166 1893 HD13 ILE 45 2HD ILE 45 21.531 5.588 -7.578 1894 H TRP 46 H TRP 46 18.611 10.301 -4.979 1895 HA TRP 46 HA TRP 46 17.562 8.524 -2.995 1896 HB2 TRP 46 2HB TRP 46 19.048 11.007 -3.047 1897 HB3 TRP 46 1HB TRP 46 17.573 11.309 -2.090 1898 HD1 TRP 46 HD TRP 46 18.349 11.120 0.351 1899 HE1 TRP 46 1HE TRP 46 19.971 9.620 1.712 1900 HE3 TRP 46 3HE TRP 46 19.851 7.972 -3.367 1901 HZ2 TRP 46 2HZ TRP 46 21.358 7.165 1.329 1902 HZ3 TRP 46 3HZ TRP 46 21.285 6.051 -2.822 1903 HH2 TRP 46 HH TRP 46 21.994 5.634 -0.500 1904 H TRP 47 H TRP 47 16.185 11.010 -5.116 1905 HA TRP 47 HA TRP 47 13.715 11.070 -3.737 1906 HB2 TRP 47 2HB TRP 47 14.472 12.818 -5.429 1907 HB3 TRP 47 1HB TRP 47 14.132 11.622 -6.727 1908 HD1 TRP 47 HD TRP 47 12.207 13.280 -3.677 1909 HE1 TRP 47 1HE TRP 47 9.711 13.381 -4.270 1910 HE3 TRP 47 3HE TRP 47 12.416 11.110 -8.292 1911 HZ2 TRP 47 2HZ TRP 47 8.062 12.813 -6.513 1912 HZ3 TRP 47 3HZ TRP 47 10.338 10.908 -9.623 1913 HH2 TRP 47 HH TRP 47 8.193 11.749 -8.747 1914 H SER 48 H SER 48 15.032 9.078 -6.533 1915 HA SER 48 HA SER 48 12.549 7.860 -6.897 1916 HB2 SER 48 2HB SER 48 13.732 6.154 -8.300 1917 HB3 SER 48 1HB SER 48 13.955 7.872 -8.779 1918 HG SER 48 1HG SER 48 15.886 6.667 -8.822 1919 H VAL 49 H VAL 49 15.001 7.203 -4.514 1920 HA VAL 49 HA VAL 49 14.205 4.622 -3.775 1921 HB VAL 49 HB VAL 49 15.405 6.935 -2.201 1922 HG11 VAL 49 1HG1 VAL 49 14.781 4.083 -1.167 1923 HG12 VAL 49 2HG1 VAL 49 14.138 5.630 -0.503 1924 HG13 VAL 49 3HG1 VAL 49 15.883 5.248 -0.356 1925 HG21 VAL 49 3HG2 VAL 49 16.534 4.170 -3.024 1926 HG22 VAL 49 1HG2 VAL 49 17.454 5.568 -2.342 1927 HG23 VAL 49 2HG2 VAL 49 16.763 5.653 -4.002 1928 H GLU 50 H GLU 50 12.842 7.849 -2.737 1929 HA GLU 50 HA GLU 50 11.066 6.462 -0.965 1930 HB2 GLU 50 2HB GLU 50 10.024 8.540 -0.383 1931 HB3 GLU 50 1HB GLU 50 11.801 8.728 -0.328 1932 HG2 GLU 50 2HG GLU 50 11.704 9.956 -2.553 1933 HG3 GLU 50 1HG GLU 50 9.911 9.785 -2.546 1934 H THR 51 H THR 51 10.969 7.552 -4.341 1935 HA THR 51 HA THR 51 8.183 7.437 -4.595 1936 HB THR 51 HB THR 51 10.076 6.757 -6.891 1937 HG1 THR 51 1HG THR 51 9.739 9.291 -5.668 1938 HG21 THR 51 3HG2 THR 51 7.593 6.833 -7.340 1939 HG22 THR 51 1HG2 THR 51 8.456 8.164 -8.186 1940 HG23 THR 51 2HG2 THR 51 7.517 8.507 -6.683 1941 H ALA 52 H ALA 52 10.739 4.961 -4.889 1942 HA ALA 52 HA ALA 52 9.167 3.065 -6.246 1943 HB1 ALA 52 1HB ALA 52 11.590 2.634 -4.377 1944 HB2 ALA 52 2HB ALA 52 11.681 3.016 -6.133 1945 HB3 ALA 52 3HB ALA 52 10.963 1.449 -5.594 1946 H THR 53 H THR 53 9.521 3.873 -2.799 1947 HA THR 53 HA THR 53 8.127 1.478 -1.991 1948 HB THR 53 HB THR 53 8.406 2.713 0.300 1949 HG1 THR 53 1HG THR 53 8.883 4.767 -0.755 1950 HG21 THR 53 3HG2 THR 53 10.858 1.921 -1.431 1951 HG22 THR 53 1HG2 THR 53 9.786 0.776 -0.531 1952 HG23 THR 53 2HG2 THR 53 10.799 1.966 0.368 1953 H THR 54 H THR 54 7.048 4.142 -3.540 1954 HA THR 54 HA THR 54 5.205 5.054 -3.858 1955 HB THR 54 HB THR 54 3.054 4.584 -3.113 1956 HG1 THR 54 1HG THR 54 2.543 3.699 -1.334 1957 HG21 THR 54 3HG2 THR 54 4.650 1.921 -3.197 1958 HG22 THR 54 1HG2 THR 54 4.271 2.914 -4.645 1959 HG23 THR 54 2HG2 THR 54 2.937 2.175 -3.685 1960 H VAL 55 H VAL 55 5.418 4.720 -0.382 1961 HA VAL 55 HA VAL 55 4.707 6.429 1.057 1962 HB VAL 55 HB VAL 55 7.740 6.324 0.759 1963 HG11 VAL 55 1HG1 VAL 55 7.157 8.326 2.178 1964 HG12 VAL 55 2HG1 VAL 55 7.798 6.996 3.197 1965 HG13 VAL 55 3HG1 VAL 55 6.032 7.318 3.143 1966 HG21 VAL 55 3HG2 VAL 55 5.623 4.796 2.427 1967 HG22 VAL 55 1HG2 VAL 55 7.397 4.664 2.698 1968 HG23 VAL 55 2HG2 VAL 55 6.681 4.105 1.146 1969 H GLY 56 H GLY 56 7.425 8.034 -0.669 1970 HA2 GLY 56 2HA GLY 56 7.567 10.126 -1.446 1971 HA3 GLY 56 1HA GLY 56 5.770 10.029 -1.653 1972 H TYR 57 H TYR 57 8.299 10.619 0.864 1973 HA TYR 57 HA TYR 57 6.463 11.572 2.767 1974 HB2 TYR 57 2HB TYR 57 9.504 12.098 2.407 1975 HB3 TYR 57 1HB TYR 57 8.575 12.749 3.807 1976 HD1 TYR 57 1HD TYR 57 7.241 11.138 5.259 1977 HD2 TYR 57 2HD TYR 57 10.396 9.912 2.607 1978 HE1 TYR 57 1HE TYR 57 7.651 9.162 6.678 1979 HE2 TYR 57 2HE TYR 57 10.816 7.935 4.025 1980 HH TYR 57 HH TYR 57 9.069 7.329 7.093 1981 H GLY 58 H GLY 58 8.092 13.124 0.107 1982 HA2 GLY 58 2HA GLY 58 7.067 14.992 -0.828 1983 HA3 GLY 58 1HA GLY 58 6.661 15.628 0.797 1984 H ASP 59 H ASP 59 9.738 14.241 -0.435 1985 HA ASP 59 HA ASP 59 11.309 16.424 0.478 1986 HB2 ASP 59 2HB ASP 59 12.330 14.171 0.109 1987 HB3 ASP 59 1HB ASP 59 11.917 14.242 -1.627 1988 H ARG 60 H ARG 60 9.787 15.536 -2.694 1989 HA ARG 60 HA ARG 60 10.298 18.263 -3.605 1990 HB2 ARG 60 2HB ARG 60 10.988 15.861 -5.407 1991 HB3 ARG 60 1HB ARG 60 11.243 17.619 -5.754 1992 HG2 ARG 60 2HG ARG 60 12.755 17.707 -3.702 1993 HG3 ARG 60 1HG ARG 60 12.545 15.918 -3.565 1994 HD2 ARG 60 2HD ARG 60 13.652 15.597 -5.777 1995 HD3 ARG 60 1HD ARG 60 13.984 17.390 -5.856 1996 HE ARG 60 HE ARG 60 14.721 15.574 -3.547 1997 HH11 ARG 60 1HH2 ARG 60 15.462 18.655 -5.320 1998 HH12 ARG 60 2HH2 ARG 60 16.480 19.198 -4.048 1999 HH21 ARG 60 1HH1 ARG 60 15.842 16.432 -1.918 2000 HH22 ARG 60 2HH1 ARG 60 16.938 17.754 -2.132 2001 H TYR 61 H TYR 61 9.340 17.488 -6.401 2002 HA TYR 61 HA TYR 61 7.049 16.000 -6.139 2003 HB2 TYR 61 2HB TYR 61 5.419 17.840 -6.926 2004 HB3 TYR 61 1HB TYR 61 5.866 17.939 -5.185 2005 HD1 TYR 61 1HD TYR 61 6.438 19.430 -8.554 2006 HD2 TYR 61 2HD TYR 61 7.132 19.838 -4.328 2007 HE1 TYR 61 1HE TYR 61 7.380 21.642 -8.938 2008 HE2 TYR 61 2HE TYR 61 8.067 22.092 -4.705 2009 HH TYR 61 HH TYR 61 8.727 23.241 -8.029 2010 HA PRO 62 HA PRO 62 8.550 16.726 -10.439 2011 HB2 PRO 62 2HB PRO 62 7.158 14.736 -11.768 2012 HB3 PRO 62 1HB PRO 62 8.321 14.277 -10.473 2013 HG2 PRO 62 2HG PRO 62 5.270 14.594 -10.235 2014 HG3 PRO 62 1HG PRO 62 6.291 13.205 -9.682 2015 HD2 PRO 62 2HD PRO 62 5.503 15.399 -8.053 2016 HD3 PRO 62 1HD PRO 62 6.991 14.385 -7.748 2017 H VAL 63 H VAL 63 7.174 16.888 -12.762 2018 HA VAL 63 HA VAL 63 4.624 18.226 -12.209 2019 HB VAL 63 HB VAL 63 6.498 19.826 -12.196 2020 HG11 VAL 63 1HG1 VAL 63 6.919 19.090 -15.164 2021 HG12 VAL 63 2HG1 VAL 63 8.027 18.738 -13.782 2022 HG13 VAL 63 3HG1 VAL 63 7.695 20.433 -14.243 2023 HG21 VAL 63 3HG2 VAL 63 4.166 20.541 -12.774 2024 HG22 VAL 63 1HG2 VAL 63 4.586 20.447 -14.534 2025 HG23 VAL 63 2HG2 VAL 63 5.470 21.567 -13.455 2026 H THR 64 H THR 64 3.837 18.859 -14.759 2027 HA THR 64 HA THR 64 3.198 16.383 -15.915 2028 HB THR 64 HB THR 64 2.937 19.149 -17.267 2029 HG1 THR 64 1HG THR 64 1.284 19.614 -15.971 2030 HG21 THR 64 3HG2 THR 64 0.732 18.157 -18.007 2031 HG22 THR 64 1HG2 THR 64 1.126 16.627 -17.131 2032 HG23 THR 64 2HG2 THR 64 2.117 17.148 -18.535 2033 H GLU 65 H GLU 65 5.438 19.032 -16.680 2034 HA GLU 65 HA GLU 65 5.778 18.251 -19.363 2035 HB2 GLU 65 2HB GLU 65 5.971 20.640 -18.484 2036 HB3 GLU 65 1HB GLU 65 7.519 20.162 -17.704 2037 HG2 GLU 65 2HG GLU 65 7.988 21.352 -19.790 2038 HG3 GLU 65 1HG GLU 65 8.460 19.635 -20.004 2039 H GLU 66 H GLU 66 7.366 17.351 -16.325 2040 HA GLU 66 HA GLU 66 9.713 16.357 -17.460 2041 HB2 GLU 66 2HB GLU 66 10.204 15.286 -15.425 2042 HB3 GLU 66 1HB GLU 66 9.316 16.746 -14.977 2043 HG2 GLU 66 2HG GLU 66 8.515 15.145 -13.509 2044 HG3 GLU 66 1HG GLU 66 7.221 15.128 -14.761 2045 H GLY 67 H GLY 67 6.532 15.016 -16.823 2046 HA2 GLY 67 2HA GLY 67 5.402 13.887 -18.612 2047 HA3 GLY 67 1HA GLY 67 6.944 12.919 -18.842 2048 H ARG 68 H ARG 68 4.481 13.931 -16.460 2049 HA ARG 68 HA ARG 68 5.467 13.117 -14.179 2050 HB2 ARG 68 2HB ARG 68 3.401 13.153 -13.149 2051 HB3 ARG 68 1HB ARG 68 3.184 14.275 -14.521 2052 HG2 ARG 68 2HG ARG 68 1.938 12.441 -15.786 2053 HG3 ARG 68 1HG ARG 68 2.202 11.322 -14.412 2054 HD2 ARG 68 2HD ARG 68 0.320 13.691 -14.510 2055 HD3 ARG 68 1HD ARG 68 -0.026 11.983 -14.053 2056 HE ARG 68 HE ARG 68 1.088 14.162 -12.421 2057 HH11 ARG 68 1HH2 ARG 68 0.657 10.578 -12.498 2058 HH12 ARG 68 2HH2 ARG 68 0.955 10.405 -10.819 2059 HH21 ARG 68 1HH1 ARG 68 1.450 13.872 -10.159 2060 HH22 ARG 68 2HH1 ARG 68 1.212 12.459 -9.356 2061 H LYS 69 H LYS 69 4.585 11.022 -16.568 2062 HA LYS 69 HA LYS 69 4.062 8.579 -15.359 2063 HB2 LYS 69 2HB LYS 69 5.458 9.476 -17.958 2064 HB3 LYS 69 1HB LYS 69 5.223 7.748 -17.567 2065 HG2 LYS 69 2HG LYS 69 2.865 9.704 -17.816 2066 HG3 LYS 69 1HG LYS 69 3.513 8.685 -19.149 2067 HD2 LYS 69 2HD LYS 69 3.176 6.626 -17.760 2068 HD3 LYS 69 1HD LYS 69 2.476 7.640 -16.451 2069 HE2 LYS 69 2HE LYS 69 0.591 8.324 -18.016 2070 HE3 LYS 69 1HE LYS 69 1.256 7.182 -19.261 2071 HZ1 LYS 69 3HZ LYS 69 -0.512 6.179 -17.825 2072 HZ2 LYS 69 1HZ LYS 69 0.496 6.455 -16.470 2073 HZ3 LYS 69 2HZ LYS 69 0.982 5.384 -17.671 2074 H VAL 70 H VAL 70 7.145 10.511 -15.216 2075 HA VAL 70 HA VAL 70 8.611 8.061 -14.856 2076 HB VAL 70 HB VAL 70 9.424 10.899 -14.394 2077 HG11 VAL 70 1HG1 VAL 70 10.468 9.700 -12.500 2078 HG12 VAL 70 2HG1 VAL 70 11.697 9.990 -13.774 2079 HG13 VAL 70 3HG1 VAL 70 10.973 8.345 -13.585 2080 HG21 VAL 70 3HG2 VAL 70 10.989 10.272 -16.208 2081 HG22 VAL 70 1HG2 VAL 70 9.327 9.780 -16.695 2082 HG23 VAL 70 2HG2 VAL 70 10.490 8.536 -16.113 2083 H ALA 71 H ALA 71 6.912 10.330 -12.673 2084 HA ALA 71 HA ALA 71 7.670 8.979 -10.321 2085 HB1 ALA 71 1HB ALA 71 5.626 9.963 -9.267 2086 HB2 ALA 71 2HB ALA 71 4.986 10.393 -10.901 2087 HB3 ALA 71 3HB ALA 71 6.478 11.183 -10.282 2088 H GLU 72 H GLU 72 4.948 8.481 -12.555 2089 HA GLU 72 HA GLU 72 3.698 6.394 -11.161 2090 HB2 GLU 72 2HB GLU 72 2.694 7.706 -13.166 2091 HB3 GLU 72 1HB GLU 72 3.718 6.677 -14.220 2092 HG2 GLU 72 2HG GLU 72 2.513 4.625 -13.122 2093 HG3 GLU 72 1HG GLU 72 1.384 5.819 -12.385 2094 H GLN 73 H GLN 73 6.224 6.347 -13.720 2095 HA GLN 73 HA GLN 73 6.222 3.642 -14.219 2096 HB2 GLN 73 2HB GLN 73 7.357 5.189 -15.710 2097 HB3 GLN 73 1HB GLN 73 8.488 5.713 -14.420 2098 HG2 GLN 73 2HG GLN 73 9.707 3.601 -14.475 2099 HG3 GLN 73 1HG GLN 73 8.457 2.820 -15.501 2100 HE21 GLN 73 1HE2 GLN 73 8.063 3.871 -17.696 2101 HE22 GLN 73 2HE2 GLN 73 9.274 4.840 -18.470 2102 H VAL 74 H VAL 74 8.289 5.481 -11.896 2103 HA VAL 74 HA VAL 74 9.730 3.181 -11.104 2104 HB VAL 74 HB VAL 74 9.268 5.811 -9.583 2105 HG11 VAL 74 1HG1 VAL 74 11.449 5.222 -8.441 2106 HG12 VAL 74 2HG1 VAL 74 11.453 3.622 -9.275 2107 HG13 VAL 74 3HG1 VAL 74 10.175 4.022 -8.072 2108 HG21 VAL 74 3HG2 VAL 74 11.474 6.457 -10.611 2109 HG22 VAL 74 1HG2 VAL 74 10.245 6.169 -11.881 2110 HG23 VAL 74 2HG2 VAL 74 11.480 4.908 -11.542 2111 H MET 75 H MET 75 6.869 4.876 -9.816 2112 HA MET 75 HA MET 75 6.583 3.458 -7.451 2113 HB2 MET 75 2HB MET 75 5.372 5.536 -7.870 2114 HB3 MET 75 1HB MET 75 4.594 4.840 -9.331 2115 HG2 MET 75 2HG MET 75 3.211 3.337 -7.978 2116 HG3 MET 75 1HG MET 75 4.140 3.741 -6.506 2117 HE1 MET 75 3HE MET 75 1.509 6.927 -8.724 2118 HE2 MET 75 1HE MET 75 2.125 5.422 -9.480 2119 HE3 MET 75 2HE MET 75 3.262 6.758 -9.050 2120 H LYS 76 H LYS 76 5.103 2.865 -10.717 2121 HA LYS 76 HA LYS 76 3.588 0.715 -9.774 2122 HB2 LYS 76 2HB LYS 76 3.266 2.032 -12.006 2123 HB3 LYS 76 1HB LYS 76 4.481 0.904 -12.692 2124 HG2 LYS 76 2HG LYS 76 2.966 -1.032 -11.874 2125 HG3 LYS 76 1HG LYS 76 1.759 0.216 -11.392 2126 HD2 LYS 76 2HD LYS 76 1.844 1.031 -13.860 2127 HD3 LYS 76 1HD LYS 76 2.802 -0.442 -14.218 2128 HE2 LYS 76 2HE LYS 76 -0.119 -0.323 -13.183 2129 HE3 LYS 76 1HE LYS 76 0.448 -0.800 -14.829 2130 HZ1 LYS 76 3HZ LYS 76 0.044 -2.743 -13.878 2131 HZ2 LYS 76 1HZ LYS 76 0.576 -2.321 -12.313 2132 HZ3 LYS 76 2HZ LYS 76 1.727 -2.650 -13.498 2133 H ALA 77 H ALA 77 6.855 0.863 -11.225 2134 HA ALA 77 HA ALA 77 7.239 -1.898 -11.475 2135 HB1 ALA 77 1HB ALA 77 9.691 -1.372 -11.450 2136 HB2 ALA 77 2HB ALA 77 9.327 0.291 -10.846 2137 HB3 ALA 77 3HB ALA 77 8.799 -0.206 -12.496 2138 H GLY 78 H GLY 78 7.710 0.330 -8.706 2139 HA2 GLY 78 2HA GLY 78 8.978 -1.501 -6.998 2140 HA3 GLY 78 1HA GLY 78 8.034 -0.028 -6.548 2141 H ILE 79 H ILE 79 5.517 -0.635 -7.356 2142 HA ILE 79 HA ILE 79 4.606 -2.285 -5.297 2143 HB ILE 79 HB ILE 79 3.196 -1.326 -7.834 2144 HG12 ILE 79 2HG1 ILE 79 3.099 -0.238 -4.941 2145 HG13 ILE 79 1HG1 ILE 79 4.116 0.460 -6.228 2146 HG21 ILE 79 1HG2 ILE 79 1.963 -3.295 -6.872 2147 HG22 ILE 79 2HG2 ILE 79 1.045 -1.794 -6.569 2148 HG23 ILE 79 3HG2 ILE 79 2.002 -2.537 -5.239 2149 HD11 ILE 79 3HD ILE 79 1.029 0.345 -6.235 2150 HD12 ILE 79 1HD ILE 79 2.070 1.790 -6.020 2151 HD13 ILE 79 2HD ILE 79 2.045 0.937 -7.607 2152 H GLU 80 H GLU 80 5.034 -2.913 -8.812 2153 HA GLU 80 HA GLU 80 3.952 -5.478 -8.820 2154 HB2 GLU 80 2HB GLU 80 6.018 -4.113 -10.637 2155 HB3 GLU 80 1HB GLU 80 5.388 -5.761 -10.968 2156 HG2 GLU 80 2HG GLU 80 3.096 -4.957 -11.182 2157 HG3 GLU 80 1HG GLU 80 3.552 -3.305 -10.648 2158 H VAL 81 H VAL 81 7.331 -4.397 -8.183 2159 HA VAL 81 HA VAL 81 8.398 -6.986 -8.030 2160 HB VAL 81 HB VAL 81 9.278 -4.275 -6.968 2161 HG11 VAL 81 1HG1 VAL 81 10.731 -6.984 -6.612 2162 HG12 VAL 81 2HG1 VAL 81 10.238 -5.829 -5.317 2163 HG13 VAL 81 3HG1 VAL 81 11.537 -5.385 -6.471 2164 HG21 VAL 81 3HG2 VAL 81 9.328 -4.792 -9.469 2165 HG22 VAL 81 1HG2 VAL 81 10.393 -6.201 -9.133 2166 HG23 VAL 81 2HG2 VAL 81 10.970 -4.532 -8.790 2167 H PHE 82 H PHE 82 7.136 -4.831 -5.394 2168 HA PHE 82 HA PHE 82 7.837 -6.693 -3.389 2169 HB2 PHE 82 2HB PHE 82 5.661 -4.505 -3.294 2170 HB3 PHE 82 1HB PHE 82 6.298 -5.395 -1.859 2171 HD1 PHE 82 2HD PHE 82 9.187 -5.439 -2.134 2172 HD2 PHE 82 1HD PHE 82 6.425 -2.317 -3.206 2173 HE1 PHE 82 2HE PHE 82 10.984 -3.774 -1.919 2174 HE2 PHE 82 1HE PHE 82 8.220 -0.651 -2.984 2175 HZ PHE 82 HZ PHE 82 10.510 -1.360 -2.351 2176 H ALA 83 H ALA 83 4.879 -6.284 -5.332 2177 HA ALA 83 HA ALA 83 3.318 -8.100 -3.836 2178 HB1 ALA 83 1HB ALA 83 1.836 -8.159 -5.844 2179 HB2 ALA 83 2HB ALA 83 3.123 -7.356 -6.827 2180 HB3 ALA 83 3HB ALA 83 2.327 -6.469 -5.477 2181 H LEU 84 H LEU 84 5.604 -8.471 -6.557 2182 HA LEU 84 HA LEU 84 4.939 -11.064 -7.279 2183 HB2 LEU 84 2HB LEU 84 6.250 -9.405 -8.609 2184 HB3 LEU 84 1HB LEU 84 7.665 -9.651 -7.548 2185 HG LEU 84 HG LEU 84 6.430 -12.081 -8.916 2186 HD11 LEU 84 1HD1 LEU 84 7.606 -11.596 -11.067 2187 HD12 LEU 84 2HD1 LEU 84 8.092 -9.975 -10.448 2188 HD13 LEU 84 3HD1 LEU 84 6.352 -10.363 -10.706 2189 HD21 LEU 84 3HD2 LEU 84 9.377 -11.213 -8.517 2190 HD22 LEU 84 1HD2 LEU 84 8.803 -12.789 -9.192 2191 HD23 LEU 84 2HD2 LEU 84 8.482 -12.377 -7.477 2192 H VAL 85 H VAL 85 6.855 -9.898 -4.581 2193 HA VAL 85 HA VAL 85 8.348 -12.176 -4.006 2194 HB VAL 85 HB VAL 85 7.162 -10.083 -2.112 2195 HG11 VAL 85 1HG1 VAL 85 7.863 -11.989 -0.736 2196 HG12 VAL 85 2HG1 VAL 85 9.105 -10.708 -0.597 2197 HG13 VAL 85 3HG1 VAL 85 9.415 -12.149 -1.638 2198 HG21 VAL 85 3HG2 VAL 85 9.472 -9.056 -2.329 2199 HG22 VAL 85 1HG2 VAL 85 8.590 -9.074 -3.883 2200 HG23 VAL 85 2HG2 VAL 85 9.890 -10.281 -3.583 2201 H THR 86 H THR 86 4.878 -11.712 -3.861 2202 HA THR 86 HA THR 86 4.359 -13.543 -1.855 2203 HB THR 86 HB THR 86 2.775 -11.829 -2.841 2204 HG1 THR 86 1HG THR 86 1.976 -14.502 -2.390 2205 HG21 THR 86 3HG2 THR 86 1.308 -12.498 -4.678 2206 HG22 THR 86 1HG2 THR 86 2.089 -14.111 -4.842 2207 HG23 THR 86 2HG2 THR 86 2.996 -12.621 -5.274 2208 H ALA 87 H ALA 87 5.689 -14.167 -4.990 2209 HA ALA 87 HA ALA 87 4.732 -16.778 -5.414 2210 HB1 ALA 87 1HB ALA 87 6.142 -15.492 -7.086 2211 HB2 ALA 87 2HB ALA 87 6.856 -17.104 -6.720 2212 HB3 ALA 87 3HB ALA 87 7.544 -15.610 -5.973 2213 H ALA 88 H ALA 88 6.794 -15.414 -2.980 2214 HA ALA 88 HA ALA 88 7.768 -18.002 -2.074 2215 HB1 ALA 88 1HB ALA 88 9.384 -16.074 -1.891 2216 HB2 ALA 88 2HB ALA 88 8.896 -16.653 -0.249 2217 HB3 ALA 88 3HB ALA 88 8.181 -15.156 -0.929 2218 H LEU 89 H LEU 89 5.962 -15.181 -0.807 2219 HA LEU 89 HA LEU 89 5.366 -16.494 1.546 2220 HB2 LEU 89 2HB LEU 89 3.930 -14.056 0.357 2221 HB3 LEU 89 1HB LEU 89 4.009 -14.509 2.092 2222 HG LEU 89 HG LEU 89 6.450 -13.767 0.328 2223 HD11 LEU 89 1HD1 LEU 89 5.013 -12.058 2.422 2224 HD12 LEU 89 2HD1 LEU 89 4.945 -11.828 0.635 2225 HD13 LEU 89 3HD1 LEU 89 6.501 -11.618 1.508 2226 HD21 LEU 89 3HD2 LEU 89 6.260 -14.196 3.384 2227 HD22 LEU 89 1HD2 LEU 89 7.701 -13.592 2.487 2228 HD23 LEU 89 2HD2 LEU 89 7.115 -15.269 2.217 2229 H ALA 90 H ALA 90 3.523 -16.464 -1.494 2230 HA ALA 90 HA ALA 90 1.118 -17.371 -0.225 2231 HB1 ALA 90 1HB ALA 90 0.955 -16.190 -2.421 2232 HB2 ALA 90 2HB ALA 90 0.272 -17.847 -2.507 2233 HB3 ALA 90 3HB ALA 90 1.905 -17.514 -3.195 2234 H THR 91 H THR 91 4.180 -18.952 -0.894 2235 HA THR 91 HA THR 91 2.812 -21.472 -1.341 2236 HB THR 91 HB THR 91 4.630 -22.534 -1.867 2237 HG1 THR 91 1HG THR 91 5.948 -21.207 0.188 2238 HG21 THR 91 3HG2 THR 91 5.950 -21.226 -3.374 2239 HG22 THR 91 1HG2 THR 91 5.927 -19.785 -2.300 2240 HG23 THR 91 2HG2 THR 91 4.473 -20.221 -3.196 2241 H ASP 92 H ASP 92 3.522 -19.380 1.284 2242 HA ASP 92 HA ASP 92 4.482 -21.571 2.874 2243 HB2 ASP 92 2HB ASP 92 4.525 -18.599 3.372 2244 HB3 ASP 92 1HB ASP 92 5.226 -19.860 4.450 2245 H PHE 93 H PHE 93 1.469 -20.887 2.077 2246 HA PHE 93 HA PHE 93 0.532 -21.934 4.665 2247 HB2 PHE 93 2HB PHE 93 -1.679 -21.545 4.145 2248 HB3 PHE 93 1HB PHE 93 -0.859 -20.046 3.601 2249 HD1 PHE 93 1HD PHE 93 -0.460 -19.716 1.092 2250 HD2 PHE 93 2HD PHE 93 -2.925 -22.891 2.624 2251 HE1 PHE 93 1HE PHE 93 -1.455 -20.027 -1.142 2252 HE2 PHE 93 2HE PHE 93 -3.937 -23.182 0.387 2253 HZ PHE 93 HZ PHE 93 -3.185 -21.764 -1.508 2254 H VAL 94 H VAL 94 1.623 -22.833 1.483 2255 HA VAL 94 HA VAL 94 -0.023 -25.173 1.291 2256 HB VAL 94 HB VAL 94 2.415 -24.483 -0.405 2257 HG11 VAL 94 1HG1 VAL 94 -0.170 -26.126 -0.933 2258 HG12 VAL 94 2HG1 VAL 94 1.464 -26.820 -0.643 2259 HG13 VAL 94 3HG1 VAL 94 1.158 -25.836 -2.113 2260 HG21 VAL 94 3HG2 VAL 94 0.761 -23.353 -1.951 2261 HG22 VAL 94 1HG2 VAL 94 0.900 -22.473 -0.406 2262 HG23 VAL 94 2HG2 VAL 94 -0.523 -23.529 -0.705 2263 H ARG 95 H ARG 95 3.100 -24.160 2.542 2264 HA ARG 95 HA ARG 95 4.186 -26.748 2.843 2265 HB2 ARG 95 2HB ARG 95 4.837 -24.300 4.565 2266 HB3 ARG 95 1HB ARG 95 5.848 -25.758 4.261 2267 HG2 ARG 95 2HG ARG 95 5.786 -25.110 1.738 2268 HG3 ARG 95 1HG ARG 95 5.029 -23.568 2.250 2269 HD2 ARG 95 2HD ARG 95 7.348 -23.074 2.044 2270 HD3 ARG 95 1HD ARG 95 7.028 -23.187 3.827 2271 HE ARG 95 HE ARG 95 7.770 -25.831 2.842 2272 HH11 ARG 95 1HH2 ARG 95 9.137 -22.735 4.051 2273 HH12 ARG 95 2HH2 ARG 95 10.730 -23.010 3.617 2274 HH21 ARG 95 1HH1 ARG 95 10.141 -26.352 2.392 2275 HH22 ARG 95 2HH1 ARG 95 11.327 -25.118 2.565 2276 H ARG 96 H ARG 96 1.446 -25.431 4.372 2277 HA ARG 96 HA ARG 96 1.815 -26.313 6.987 2278 HB2 ARG 96 2HB ARG 96 -0.514 -26.112 7.353 2279 HB3 ARG 96 1HB ARG 96 -0.139 -24.871 6.125 2280 HG2 ARG 96 2HG ARG 96 -0.876 -26.655 4.363 2281 HG3 ARG 96 1HG ARG 96 -1.521 -27.598 5.753 2282 HD2 ARG 96 2HD ARG 96 -2.947 -25.474 6.323 2283 HD3 ARG 96 1HD ARG 96 -2.507 -24.852 4.685 2284 HE ARG 96 HE ARG 96 -4.493 -26.870 5.330 2285 HH11 ARG 96 1HH2 ARG 96 -2.063 -26.187 2.747 2286 HH12 ARG 96 2HH2 ARG 96 -2.530 -27.527 1.783 2287 HH21 ARG 96 1HH1 ARG 96 -5.343 -28.396 3.845 2288 HH22 ARG 96 2HH1 ARG 96 -4.647 -28.634 2.281 2289 H GLU 97 H GLU 97 1.300 -28.046 4.006 2290 HA GLU 97 HA GLU 97 0.250 -30.429 5.164 2291 HB2 GLU 97 2HB GLU 97 1.528 -29.929 2.402 2292 HB3 GLU 97 1HB GLU 97 0.495 -31.325 2.858 2293 HG2 GLU 97 2HG GLU 97 -1.424 -29.746 3.311 2294 HG3 GLU 97 1HG GLU 97 -0.377 -28.343 2.875 2295 H GLU 98 H GLU 98 3.426 -29.064 4.467 2296 HA GLU 98 HA GLU 98 4.905 -31.493 4.683 2297 HB2 GLU 98 2HB GLU 98 5.778 -28.517 4.750 2298 HB3 GLU 98 1HB GLU 98 6.875 -29.906 4.514 2299 HG2 GLU 98 2HG GLU 98 5.924 -30.412 2.328 2300 HG3 GLU 98 1HG GLU 98 4.552 -29.284 2.567 2301 H GLU 99 H GLU 99 3.966 -28.728 6.712 2302 HA GLU 99 HA GLU 99 5.541 -29.513 8.922 2303 HB2 GLU 99 2HB GLU 99 3.144 -27.596 8.615 2304 HB3 GLU 99 1HB GLU 99 4.025 -27.806 10.164 2305 HG2 GLU 99 2HG GLU 99 5.323 -26.832 7.521 2306 HG3 GLU 99 1HG GLU 99 4.877 -25.815 8.946 2307 H ARG 100 H ARG 100 2.092 -30.021 8.081 2308 HA ARG 100 HA ARG 100 1.691 -31.202 10.699 2309 HB2 ARG 100 2HB ARG 100 -0.245 -30.767 8.392 2310 HB3 ARG 100 1HB ARG 100 -0.673 -31.337 10.047 2311 HG2 ARG 100 2HG ARG 100 0.178 -29.210 11.039 2312 HG3 ARG 100 1HG ARG 100 0.751 -28.640 9.453 2313 HD2 ARG 100 2HD ARG 100 -1.351 -27.499 10.009 2314 HD3 ARG 100 1HD ARG 100 -1.598 -28.577 8.569 2315 HE ARG 100 HE ARG 100 -2.246 -29.283 11.451 2316 HH11 ARG 100 1HH2 ARG 100 -3.412 -29.225 8.010 2317 HH12 ARG 100 2HH2 ARG 100 -4.674 -30.371 8.338 2318 HH21 ARG 100 1HH1 ARG 100 -3.977 -30.897 11.733 2319 HH22 ARG 100 2HH1 ARG 100 -5.046 -31.212 10.404 2320 H ARG 101 H ARG 101 2.731 -32.398 7.581 2321 HA ARG 101 HA ARG 101 2.314 -35.100 8.664 2322 HB2 ARG 101 2HB ARG 101 2.363 -34.289 5.694 2323 HB3 ARG 101 1HB ARG 101 2.307 -35.967 6.330 2324 HG2 ARG 101 2HG ARG 101 0.061 -35.584 7.264 2325 HG3 ARG 101 1HG ARG 101 0.123 -33.839 6.824 2326 HD2 ARG 101 2HD ARG 101 0.175 -34.326 4.423 2327 HD3 ARG 101 1HD ARG 101 0.313 -36.100 4.718 2328 HE ARG 101 HE ARG 101 -2.108 -34.442 4.799 2329 HH11 ARG 101 1HH2 ARG 101 -0.677 -37.581 5.823 2330 HH12 ARG 101 2HH2 ARG 101 -2.143 -38.444 5.619 2331 HH21 ARG 101 1HH1 ARG 101 -4.094 -35.524 4.865 2332 HH22 ARG 101 2HH1 ARG 101 -4.237 -37.168 5.349 2333 H GLY 102 H GLY 102 4.377 -35.675 9.356 2334 HA2 GLY 102 2HA GLY 102 6.447 -36.378 8.688 2335 HA3 GLY 102 1HA GLY 102 6.588 -35.009 7.524 2336 H HIS 103 H HIS 103 5.192 -33.520 10.039 2337 HA HIS 103 HA HIS 103 7.497 -33.337 11.779 2338 HB2 HIS 103 2HB HIS 103 8.152 -31.828 9.847 2339 HB3 HIS 103 1HB HIS 103 6.620 -30.935 10.048 2340 HD1 HIS 103 1HD HIS 103 7.291 -28.652 11.079 2341 HD2 HIS 103 2HD HIS 103 9.514 -31.858 12.755 2342 HE1 HIS 103 1HE HIS 103 8.765 -27.710 12.830 2343 HE2 HIS 103 2HE HIS 103 10.039 -29.594 13.902 2344 H1 SER 1 H SER 1 -6.079 -21.656 18.371 2345 HA SER 1 HA SER 1 -6.090 -19.724 16.444 2346 HB2 SER 1 2HB SER 1 -3.495 -19.644 16.173 2347 HB3 SER 1 1HB SER 1 -4.216 -18.563 17.411 2348 HG SER 1 1HG SER 1 -2.823 -19.447 18.634 2349 H ALA 2 H ALA 2 -5.003 -20.882 14.438 2350 HA ALA 2 HA ALA 2 -5.703 -23.683 14.831 2351 HB1 ALA 2 1HB ALA 2 -6.806 -22.505 12.928 2352 HB2 ALA 2 2HB ALA 2 -5.725 -23.833 12.371 2353 HB3 ALA 2 3HB ALA 2 -5.194 -22.117 12.235 2354 H ASP 3 H ASP 3 -3.164 -21.630 13.279 2355 HA ASP 3 HA ASP 3 -1.061 -23.557 13.814 2356 HB2 ASP 3 2HB ASP 3 -2.224 -24.976 12.204 2357 HB3 ASP 3 1HB ASP 3 -2.784 -23.571 11.259 2358 H HIS 4 H HIS 4 -1.538 -22.012 10.820 2359 HA HIS 4 HA HIS 4 0.623 -20.457 10.732 2360 HB2 HIS 4 2HB HIS 4 -0.675 -19.234 8.785 2361 HB3 HIS 4 1HB HIS 4 -0.414 -21.005 8.703 2362 HD1 HIS 4 1HD HIS 4 -3.283 -18.674 9.884 2363 HD2 HIS 4 2HD HIS 4 -2.583 -22.663 8.741 2364 HE1 HIS 4 1HE HIS 4 -5.493 -19.826 9.885 2365 HE2 HIS 4 2HE HIS 4 -5.088 -22.204 9.245 2366 H GLU 5 H GLU 5 -2.372 -19.469 12.418 2367 HA GLU 5 HA GLU 5 -1.962 -16.698 12.162 2368 HB2 GLU 5 2HB GLU 5 -3.315 -18.166 14.511 2369 HB3 GLU 5 1HB GLU 5 -3.485 -16.447 14.042 2370 HG2 GLU 5 2HG GLU 5 -5.491 -17.421 13.313 2371 HG3 GLU 5 1HG GLU 5 -4.521 -17.273 11.810 2372 H ARG 6 H ARG 6 -0.514 -19.219 14.146 2373 HA ARG 6 HA ARG 6 0.276 -17.545 16.294 2374 HB2 ARG 6 2HB ARG 6 1.440 -20.228 15.329 2375 HB3 ARG 6 1HB ARG 6 1.757 -19.476 16.932 2376 HG2 ARG 6 2HG ARG 6 -0.595 -19.719 17.582 2377 HG3 ARG 6 1HG ARG 6 -1.058 -20.235 15.920 2378 HD2 ARG 6 2HD ARG 6 0.332 -22.310 16.149 2379 HD3 ARG 6 1HD ARG 6 0.659 -21.888 17.890 2380 HE ARG 6 HE ARG 6 -2.102 -21.673 17.722 2381 HH11 ARG 6 1HH2 ARG 6 0.270 -24.357 16.999 2382 HH12 ARG 6 2HH2 ARG 6 -0.964 -25.565 17.052 2383 HH21 ARG 6 1HH1 ARG 6 -3.730 -23.492 17.649 2384 HH22 ARG 6 2HH1 ARG 6 -3.125 -25.096 17.525 2385 H GLU 7 H GLU 7 1.766 -18.536 13.188 2386 HA GLU 7 HA GLU 7 4.275 -17.328 13.904 2387 HB2 GLU 7 2HB GLU 7 4.021 -19.359 12.323 2388 HB3 GLU 7 1HB GLU 7 3.415 -18.193 11.099 2389 HG2 GLU 7 2HG GLU 7 5.715 -18.506 10.592 2390 HG3 GLU 7 1HG GLU 7 5.691 -16.919 11.437 2391 H ALA 8 H ALA 8 1.337 -16.492 12.092 2392 HA ALA 8 HA ALA 8 2.255 -14.125 10.958 2393 HB1 ALA 8 1HB ALA 8 -0.588 -14.832 11.964 2394 HB2 ALA 8 2HB ALA 8 0.055 -15.186 10.320 2395 HB3 ALA 8 3HB ALA 8 -0.201 -13.485 10.849 2396 H GLN 9 H GLN 9 0.675 -14.750 14.129 2397 HA GLN 9 HA GLN 9 0.609 -12.034 14.843 2398 HB2 GLN 9 2HB GLN 9 -0.805 -13.969 15.794 2399 HB3 GLN 9 1HB GLN 9 0.606 -14.389 16.801 2400 HG2 GLN 9 2HG GLN 9 -0.103 -12.868 18.361 2401 HG3 GLN 9 1HG GLN 9 0.196 -11.545 17.188 2402 HE21 GLN 9 1HE2 GLN 9 -1.636 -10.414 16.378 2403 HE22 GLN 9 2HE2 GLN 9 -3.242 -10.750 16.911 2404 H LYS 10 H LYS 10 3.097 -14.540 15.174 2405 HA LYS 10 HA LYS 10 4.720 -13.266 17.078 2406 HB2 LYS 10 2HB LYS 10 4.937 -15.697 16.292 2407 HB3 LYS 10 1HB LYS 10 5.539 -15.087 14.722 2408 HG2 LYS 10 2HG LYS 10 7.473 -13.985 15.981 2409 HG3 LYS 10 1HG LYS 10 6.916 -14.822 17.471 2410 HD2 LYS 10 2HD LYS 10 7.363 -17.021 16.440 2411 HD3 LYS 10 1HD LYS 10 7.586 -16.261 14.824 2412 HE2 LYS 10 2HE LYS 10 9.580 -14.977 15.698 2413 HE3 LYS 10 1HE LYS 10 9.440 -15.838 17.277 2414 HZ1 LYS 10 3HZ LYS 10 10.067 -17.835 16.293 2415 HZ2 LYS 10 1HZ LYS 10 11.058 -16.636 15.559 2416 HZ3 LYS 10 2HZ LYS 10 9.785 -17.299 14.686 2417 H ALA 11 H ALA 11 4.364 -12.925 13.559 2418 HA ALA 11 HA ALA 11 6.725 -11.500 13.099 2419 HB1 ALA 11 1HB ALA 11 4.094 -11.356 11.503 2420 HB2 ALA 11 2HB ALA 11 5.388 -12.586 11.264 2421 HB3 ALA 11 3HB ALA 11 5.724 -10.852 10.925 2422 H GLU 12 H GLU 12 3.570 -10.457 14.384 2423 HA GLU 12 HA GLU 12 3.825 -7.723 13.791 2424 HB2 GLU 12 2HB GLU 12 2.425 -9.053 16.192 2425 HB3 GLU 12 1HB GLU 12 2.296 -7.312 15.761 2426 HG2 GLU 12 2HG GLU 12 1.259 -7.907 13.560 2427 HG3 GLU 12 1HG GLU 12 1.329 -9.657 14.006 2428 H GLU 13 H GLU 13 4.954 -9.685 16.574 2429 HA GLU 13 HA GLU 13 5.972 -7.568 18.101 2430 HB2 GLU 13 2HB GLU 13 6.318 -10.571 17.999 2431 HB3 GLU 13 1HB GLU 13 7.632 -9.667 18.811 2432 HG2 GLU 13 2HG GLU 13 6.003 -10.447 20.452 2433 HG3 GLU 13 1HG GLU 13 6.104 -8.651 20.416 2434 H GLU 14 H GLU 14 7.258 -9.178 15.237 2435 HA GLU 14 HA GLU 14 9.974 -8.446 15.768 2436 HB2 GLU 14 2HB GLU 14 9.330 -10.404 14.276 2437 HB3 GLU 14 1HB GLU 14 8.680 -9.227 13.092 2438 HG2 GLU 14 2HG GLU 14 10.875 -9.958 12.342 2439 HG3 GLU 14 1HG GLU 14 11.001 -8.236 12.840 2440 H LEU 15 H LEU 15 7.177 -7.035 14.047 2441 HA LEU 15 HA LEU 15 8.641 -5.034 12.751 2442 HB2 LEU 15 2HB LEU 15 6.283 -5.658 12.172 2443 HB3 LEU 15 1HB LEU 15 5.710 -4.942 13.709 2444 HG LEU 15 HG LEU 15 6.319 -2.689 12.961 2445 HD11 LEU 15 1HD1 LEU 15 7.650 -4.078 10.558 2446 HD12 LEU 15 2HD1 LEU 15 8.429 -3.009 11.782 2447 HD13 LEU 15 3HD1 LEU 15 7.276 -2.319 10.604 2448 HD21 LEU 15 3HD2 LEU 15 4.814 -2.462 10.975 2449 HD22 LEU 15 1HD2 LEU 15 4.131 -3.613 12.178 2450 HD23 LEU 15 2HD2 LEU 15 4.913 -4.234 10.679 2451 H GLN 16 H GLN 16 7.077 -5.165 15.928 2452 HA GLN 16 HA GLN 16 7.393 -2.522 16.713 2453 HB2 GLN 16 2HB GLN 16 7.511 -5.053 18.460 2454 HB3 GLN 16 1HB GLN 16 7.243 -3.387 19.076 2455 HG2 GLN 16 2HG GLN 16 5.078 -3.210 17.970 2456 HG3 GLN 16 1HG GLN 16 5.323 -4.762 17.086 2457 HE21 GLN 16 1HE2 GLN 16 3.733 -6.111 18.048 2458 HE22 GLN 16 2HE2 GLN 16 3.812 -6.611 19.687 2459 H LYS 17 H LYS 17 9.717 -5.168 16.667 2460 HA LYS 17 HA LYS 17 11.625 -4.095 18.462 2461 HB2 LYS 17 2HB LYS 17 11.601 -6.499 17.800 2462 HB3 LYS 17 1HB LYS 17 11.832 -6.044 16.085 2463 HG2 LYS 17 2HG LYS 17 14.132 -5.086 16.696 2464 HG3 LYS 17 1HG LYS 17 13.944 -5.876 18.292 2465 HD2 LYS 17 2HD LYS 17 13.759 -7.247 15.518 2466 HD3 LYS 17 1HD LYS 17 15.223 -7.221 16.566 2467 HE2 LYS 17 2HE LYS 17 14.066 -8.497 18.333 2468 HE3 LYS 17 1HE LYS 17 12.511 -8.454 17.419 2469 HZ1 LYS 17 3HZ LYS 17 14.093 -10.491 17.335 2470 HZ2 LYS 17 1HZ LYS 17 14.769 -9.680 16.005 2471 HZ3 LYS 17 2HZ LYS 17 13.114 -9.984 16.020 2472 H VAL 18 H VAL 18 11.202 -4.041 14.891 2473 HA VAL 18 HA VAL 18 13.587 -2.646 14.415 2474 HB VAL 18 HB VAL 18 11.112 -2.850 12.626 2475 HG11 VAL 18 1HG1 VAL 18 12.678 -1.060 11.852 2476 HG12 VAL 18 2HG1 VAL 18 12.844 -2.488 10.784 2477 HG13 VAL 18 3HG1 VAL 18 14.086 -2.169 12.044 2478 HG21 VAL 18 3HG2 VAL 18 13.621 -4.653 12.941 2479 HG22 VAL 18 1HG2 VAL 18 12.413 -4.797 11.618 2480 HG23 VAL 18 2HG2 VAL 18 11.923 -5.120 13.307 2481 H LEU 19 H LEU 19 10.272 -1.586 15.207 2482 HA LEU 19 HA LEU 19 10.553 1.097 14.560 2483 HB2 LEU 19 2HB LEU 19 9.151 0.021 17.090 2484 HB3 LEU 19 1HB LEU 19 8.945 1.654 16.389 2485 HG LEU 19 HG LEU 19 8.103 -0.988 15.065 2486 HD11 LEU 19 1HD1 LEU 19 6.425 1.245 16.372 2487 HD12 LEU 19 2HD1 LEU 19 6.738 -0.379 17.077 2488 HD13 LEU 19 3HD1 LEU 19 5.784 -0.231 15.553 2489 HD21 LEU 19 3HD2 LEU 19 8.665 0.652 13.304 2490 HD22 LEU 19 1HD2 LEU 19 7.714 1.927 14.145 2491 HD23 LEU 19 2HD2 LEU 19 6.880 0.499 13.438 2492 H GLU 20 H GLU 20 11.495 -0.636 17.572 2493 HA GLU 20 HA GLU 20 12.318 1.644 19.002 2494 HB2 GLU 20 2HB GLU 20 13.277 -1.278 19.250 2495 HB3 GLU 20 1HB GLU 20 13.567 0.001 20.470 2496 HG2 GLU 20 2HG GLU 20 10.739 -0.939 19.639 2497 HG3 GLU 20 1HG GLU 20 11.694 -1.703 20.951 2498 H GLU 21 H GLU 21 14.058 -0.826 17.092 2499 HA GLU 21 HA GLU 21 16.611 0.218 17.490 2500 HB2 GLU 21 2HB GLU 21 15.522 -2.103 16.393 2501 HB3 GLU 21 1HB GLU 21 16.123 -1.290 14.921 2502 HG2 GLU 21 2HG GLU 21 17.849 -2.809 15.771 2503 HG3 GLU 21 1HG GLU 21 18.428 -1.130 16.082 2504 H ALA 22 H ALA 22 14.132 0.878 14.981 2505 HA ALA 22 HA ALA 22 15.881 2.478 13.411 2506 HB1 ALA 22 1HB ALA 22 12.807 2.352 13.431 2507 HB2 ALA 22 2HB ALA 22 13.892 1.385 12.377 2508 HB3 ALA 22 3HB ALA 22 13.820 3.175 12.189 2509 H SER 23 H SER 23 13.827 3.089 16.223 2510 HA SER 23 HA SER 23 13.445 5.836 15.779 2511 HB2 SER 23 2HB SER 23 13.653 4.360 18.484 2512 HB3 SER 23 1HB SER 23 13.042 6.043 18.247 2513 HG SER 23 1HG SER 23 11.949 3.638 17.156 2514 H LYS 24 H LYS 24 16.048 4.028 17.457 2515 HA LYS 24 HA LYS 24 17.398 6.394 18.259 2516 HB2 LYS 24 2HB LYS 24 19.333 4.836 18.762 2517 HB3 LYS 24 1HB LYS 24 17.784 4.418 19.560 2518 HG2 LYS 24 2HG LYS 24 17.339 2.709 17.729 2519 HG3 LYS 24 1HG LYS 24 18.963 3.076 17.053 2520 HD2 LYS 24 2HD LYS 24 19.195 1.090 18.230 2521 HD3 LYS 24 1HD LYS 24 19.918 2.294 19.347 2522 HE2 LYS 24 2HE LYS 24 17.960 2.163 20.848 2523 HE3 LYS 24 1HE LYS 24 16.971 1.348 19.571 2524 HZ1 LYS 24 3HZ LYS 24 19.351 0.152 20.920 2525 HZ2 LYS 24 1HZ LYS 24 18.427 -0.563 19.703 2526 HZ3 LYS 24 2HZ LYS 24 17.705 -0.218 21.210 2527 H LYS 25 H LYS 25 17.405 4.457 15.298 2528 HA LYS 25 HA LYS 25 19.788 5.553 14.222 2529 HB2 LYS 25 2HB LYS 25 17.311 4.417 12.791 2530 HB3 LYS 25 1HB LYS 25 18.825 4.915 11.972 2531 HG2 LYS 25 2HG LYS 25 20.124 3.220 13.144 2532 HG3 LYS 25 1HG LYS 25 18.700 2.677 14.090 2533 HD2 LYS 25 2HD LYS 25 17.541 1.936 12.012 2534 HD3 LYS 25 1HD LYS 25 18.796 2.758 11.033 2535 HE2 LYS 25 2HE LYS 25 20.469 1.081 12.327 2536 HE3 LYS 25 1HE LYS 25 18.979 0.073 12.532 2537 HZ1 LYS 25 3HZ LYS 25 19.864 1.244 9.949 2538 HZ2 LYS 25 1HZ LYS 25 18.795 -0.075 10.125 2539 HZ3 LYS 25 2HZ LYS 25 20.469 -0.215 10.493 2540 H ALA 26 H ALA 26 16.294 6.350 13.830 2541 HA ALA 26 HA ALA 26 16.555 8.417 12.058 2542 HB1 ALA 26 1HB ALA 26 14.309 9.091 12.803 2543 HB2 ALA 26 2HB ALA 26 14.518 8.204 14.365 2544 HB3 ALA 26 3HB ALA 26 14.405 7.300 12.814 2545 H VAL 27 H VAL 27 16.621 8.615 15.677 2546 HA VAL 27 HA VAL 27 16.839 11.429 15.685 2547 HB VAL 27 HB VAL 27 17.729 9.461 17.871 2548 HG11 VAL 27 1HG1 VAL 27 17.034 12.489 17.921 2549 HG12 VAL 27 2HG1 VAL 27 18.605 11.736 18.392 2550 HG13 VAL 27 3HG1 VAL 27 17.146 11.460 19.393 2551 HG21 VAL 27 3HG2 VAL 27 15.294 9.202 17.139 2552 HG22 VAL 27 1HG2 VAL 27 15.055 10.950 17.453 2553 HG23 VAL 27 2HG2 VAL 27 15.470 9.831 18.804 2554 H GLU 28 H GLU 28 19.253 8.873 15.287 2555 HA GLU 28 HA GLU 28 21.433 10.659 15.990 2556 HB2 GLU 28 2HB GLU 28 21.234 8.171 16.542 2557 HB3 GLU 28 1HB GLU 28 21.602 7.823 14.828 2558 HG2 GLU 28 2HG GLU 28 23.864 8.715 15.062 2559 HG3 GLU 28 1HG GLU 28 23.452 9.583 16.583 2560 H ALA 29 H ALA 29 19.793 9.292 13.189 2561 HA ALA 29 HA ALA 29 21.559 10.070 11.188 2562 HB1 ALA 29 1HB ALA 29 19.729 8.334 10.969 2563 HB2 ALA 29 2HB ALA 29 19.594 9.576 9.700 2564 HB3 ALA 29 3HB ALA 29 18.494 9.634 11.104 2565 H GLU 30 H GLU 30 18.575 11.636 12.556 2566 HA GLU 30 HA GLU 30 18.722 13.810 10.842 2567 HB2 GLU 30 2HB GLU 30 16.774 13.202 12.451 2568 HB3 GLU 30 1HB GLU 30 17.640 14.117 13.713 2569 HG2 GLU 30 2HG GLU 30 17.577 15.596 11.154 2570 HG3 GLU 30 1HG GLU 30 15.919 15.091 11.591 2571 H ARG 31 H ARG 31 20.374 13.172 13.876 2572 HA ARG 31 HA ARG 31 20.774 15.920 14.428 2573 HB2 ARG 31 2HB ARG 31 20.306 14.109 15.967 2574 HB3 ARG 31 1HB ARG 31 21.950 13.412 15.737 2575 HG2 ARG 31 2HG ARG 31 22.924 15.100 17.075 2576 HG3 ARG 31 1HG ARG 31 21.657 16.316 16.695 2577 HD2 ARG 31 2HD ARG 31 21.613 15.263 19.132 2578 HD3 ARG 31 1HD ARG 31 20.075 15.388 18.204 2579 HE ARG 31 HE ARG 31 20.127 13.063 17.657 2580 HH11 ARG 31 1HH2 ARG 31 23.084 13.882 19.573 2581 HH12 ARG 31 2HH2 ARG 31 23.433 12.281 19.960 2582 HH21 ARG 31 1HH1 ARG 31 20.512 10.841 18.415 2583 HH22 ARG 31 2HH1 ARG 31 21.939 10.487 19.284 2584 H GLY 32 H GLY 32 21.890 16.814 12.700 2585 HA2 GLY 32 2HA GLY 32 24.333 17.491 12.532 2586 HA3 GLY 32 1HA GLY 32 24.543 15.757 12.051 2587 H ALA 33 H ALA 33 21.534 16.172 11.055 2588 HA ALA 33 HA ALA 33 22.329 16.781 8.342 2589 HB1 ALA 33 1HB ALA 33 20.926 14.743 8.800 2590 HB2 ALA 33 2HB ALA 33 20.004 15.954 7.824 2591 HB3 ALA 33 3HB ALA 33 19.679 15.776 9.574 2592 HA PRO 34 HA PRO 34 20.208 20.668 9.458 2593 HB2 PRO 34 2HB PRO 34 21.118 22.352 7.433 2594 HB3 PRO 34 1HB PRO 34 22.131 21.877 8.848 2595 HG2 PRO 34 2HG PRO 34 22.112 20.583 6.064 2596 HG3 PRO 34 1HG PRO 34 23.542 21.159 7.011 2597 HD2 PRO 34 2HD PRO 34 22.740 18.508 7.038 2598 HD3 PRO 34 1HD PRO 34 23.362 19.310 8.552 2599 H GLY 35 H GLY 35 18.165 21.453 8.830 2600 HA2 GLY 35 2HA GLY 35 16.522 22.019 7.405 2601 HA3 GLY 35 1HA GLY 35 17.337 21.136 6.059 2602 H ALA 36 H ALA 36 17.383 19.152 8.752 2603 HA ALA 36 HA ALA 36 15.184 17.577 7.660 2604 HB1 ALA 36 1HB ALA 36 17.424 16.488 8.074 2605 HB2 ALA 36 2HB ALA 36 16.161 15.776 9.143 2606 HB3 ALA 36 3HB ALA 36 17.336 17.007 9.776 2607 H ALA 37 H ALA 37 13.830 16.381 9.494 2608 HA ALA 37 HA ALA 37 13.611 17.955 11.910 2609 HB1 ALA 37 1HB ALA 37 11.242 17.602 9.946 2610 HB2 ALA 37 2HB ALA 37 11.997 19.169 10.402 2611 HB3 ALA 37 3HB ALA 37 11.097 18.213 11.639 2612 H LEU 38 H LEU 38 14.321 16.031 12.960 2613 HA LEU 38 HA LEU 38 12.276 14.073 13.393 2614 HB2 LEU 38 2HB LEU 38 13.738 13.602 11.094 2615 HB3 LEU 38 1HB LEU 38 14.780 12.774 12.258 2616 HG LEU 38 HG LEU 38 11.815 12.240 11.658 2617 HD11 LEU 38 1HD1 LEU 38 14.374 10.602 11.118 2618 HD12 LEU 38 2HD1 LEU 38 13.407 11.514 9.909 2619 HD13 LEU 38 3HD1 LEU 38 12.688 10.095 10.736 2620 HD21 LEU 38 3HD2 LEU 38 13.610 10.895 13.764 2621 HD22 LEU 38 1HD2 LEU 38 12.041 10.221 13.172 2622 HD23 LEU 38 2HD2 LEU 38 12.081 11.790 14.053 2623 H ILE 39 H ILE 39 13.185 15.564 15.388 2624 HA ILE 39 HA ILE 39 15.605 14.397 16.530 2625 HB ILE 39 HB ILE 39 15.294 16.201 18.273 2626 HG12 ILE 39 2HG1 ILE 39 13.047 17.213 16.402 2627 HG13 ILE 39 1HG1 ILE 39 12.771 16.438 17.997 2628 HG21 ILE 39 1HG2 ILE 39 16.719 16.413 16.143 2629 HG22 ILE 39 2HG2 ILE 39 16.155 17.976 16.849 2630 HG23 ILE 39 3HG2 ILE 39 15.336 17.293 15.412 2631 HD11 ILE 39 3HD ILE 39 14.270 19.096 17.488 2632 HD12 ILE 39 1HD ILE 39 12.653 18.879 18.241 2633 HD13 ILE 39 2HD ILE 39 14.123 18.285 19.095 2634 H SER 40 H SER 40 15.295 14.356 19.116 2635 HA SER 40 HA SER 40 14.598 13.432 20.878 2636 HB2 SER 40 2HB SER 40 11.661 13.424 20.141 2637 HB3 SER 40 1HB SER 40 12.421 13.725 21.727 2638 HG SER 40 1HG SER 40 11.395 15.383 20.255 2639 H TYR 41 H TYR 41 14.401 11.389 21.799 2640 HA TYR 41 HA TYR 41 13.821 9.212 20.052 2641 HB2 TYR 41 2HB TYR 41 14.258 9.250 23.093 2642 HB3 TYR 41 1HB TYR 41 13.993 7.761 22.108 2643 HD1 TYR 41 2HD TYR 41 16.265 10.805 22.346 2644 HD2 TYR 41 1HD TYR 41 15.845 6.729 21.039 2645 HE1 TYR 41 2HE TYR 41 18.593 10.814 21.615 2646 HE2 TYR 41 1HE TYR 41 18.223 6.716 20.387 2647 HH TYR 41 HH TYR 41 20.160 7.945 20.147 2648 HA PRO 42 HA PRO 42 9.632 8.913 22.041 2649 HB2 PRO 42 2HB PRO 42 8.439 11.176 23.303 2650 HB3 PRO 42 1HB PRO 42 9.270 9.818 24.147 2651 HG2 PRO 42 2HG PRO 42 10.464 12.507 23.282 2652 HG3 PRO 42 1HG PRO 42 10.607 11.689 24.896 2653 HD2 PRO 42 2HD PRO 42 12.610 11.483 23.071 2654 HD3 PRO 42 1HD PRO 42 12.090 9.980 23.960 2655 H ASP 43 H ASP 43 10.707 11.673 20.180 2656 HA ASP 43 HA ASP 43 8.027 12.054 19.014 2657 HB2 ASP 43 2HB ASP 43 10.735 13.355 18.295 2658 HB3 ASP 43 1HB ASP 43 9.297 13.470 17.252 2659 H ALA 44 H ALA 44 11.395 10.899 18.264 2660 HA ALA 44 HA ALA 44 10.889 10.390 15.619 2661 HB1 ALA 44 1HB ALA 44 12.934 8.943 15.642 2662 HB2 ALA 44 2HB ALA 44 12.925 8.994 17.447 2663 HB3 ALA 44 3HB ALA 44 13.183 10.506 16.492 2664 H ILE 45 H ILE 45 10.299 8.315 18.443 2665 HA ILE 45 HA ILE 45 9.866 5.975 16.980 2666 HB ILE 45 HB ILE 45 10.269 5.969 19.361 2667 HG12 ILE 45 2HG1 ILE 45 7.548 4.695 18.667 2668 HG13 ILE 45 1HG1 ILE 45 9.161 4.043 18.224 2669 HG21 ILE 45 1HG2 ILE 45 8.957 8.040 19.936 2670 HG22 ILE 45 2HG2 ILE 45 8.573 6.663 21.010 2671 HG23 ILE 45 3HG2 ILE 45 7.422 7.134 19.712 2672 HD11 ILE 45 3HD ILE 45 8.113 4.454 21.110 2673 HD12 ILE 45 1HD ILE 45 8.323 2.889 20.244 2674 HD13 ILE 45 2HD ILE 45 9.764 3.874 20.665 2675 H TRP 46 H TRP 46 7.797 8.830 17.467 2676 HA TRP 46 HA TRP 46 5.404 7.482 16.648 2677 HB2 TRP 46 2HB TRP 46 6.171 10.343 17.253 2678 HB3 TRP 46 1HB TRP 46 4.830 10.103 16.130 2679 HD1 TRP 46 HD TRP 46 3.594 11.563 18.053 2680 HE1 TRP 46 1HE TRP 46 2.102 10.792 19.973 2681 HE3 TRP 46 3HE TRP 46 5.369 6.757 18.580 2682 HZ2 TRP 46 2HZ TRP 46 1.619 8.401 21.440 2683 HZ3 TRP 46 3HZ TRP 46 4.373 5.313 20.273 2684 HH2 TRP 46 HH TRP 46 2.514 6.108 21.697 2685 H TRP 47 H TRP 47 7.978 9.247 14.943 2686 HA TRP 47 HA TRP 47 6.616 9.136 12.417 2687 HB2 TRP 47 2HB TRP 47 8.431 10.753 12.698 2688 HB3 TRP 47 1HB TRP 47 9.573 9.463 13.197 2689 HD1 TRP 47 HD TRP 47 7.789 10.674 9.863 2690 HE1 TRP 47 1HE TRP 47 9.367 10.059 7.947 2691 HE3 TRP 47 3HE TRP 47 11.091 7.811 12.502 2692 HZ2 TRP 47 2HZ TRP 47 11.745 8.519 7.597 2693 HZ3 TRP 47 3HZ TRP 47 12.945 6.698 11.297 2694 HH2 TRP 47 HH TRP 47 13.306 7.096 8.895 2695 H SER 48 H SER 48 8.818 7.011 14.229 2696 HA SER 48 HA SER 48 9.463 5.263 12.182 2697 HB2 SER 48 2HB SER 48 10.452 5.511 14.598 2698 HB3 SER 48 1HB SER 48 9.122 4.426 15.134 2699 HG SER 48 1HG SER 48 11.085 3.365 14.678 2700 H VAL 49 H VAL 49 6.705 5.276 14.478 2701 HA VAL 49 HA VAL 49 5.503 2.886 13.746 2702 HB VAL 49 HB VAL 49 4.380 5.516 14.821 2703 HG11 VAL 49 1HG1 VAL 49 2.872 2.836 14.428 2704 HG12 VAL 49 2HG1 VAL 49 2.471 4.417 13.665 2705 HG13 VAL 49 3HG1 VAL 49 2.297 4.216 15.434 2706 HG21 VAL 49 3HG2 VAL 49 4.331 4.284 16.965 2707 HG22 VAL 49 1HG2 VAL 49 5.981 4.099 16.271 2708 HG23 VAL 49 2HG2 VAL 49 4.806 2.748 16.148 2709 H GLU 50 H GLU 50 4.859 6.204 12.468 2710 HA GLU 50 HA GLU 50 2.978 5.639 10.548 2711 HB2 GLU 50 2HB GLU 50 5.392 7.577 10.485 2712 HB3 GLU 50 1HB GLU 50 4.129 7.610 9.254 2713 HG2 GLU 50 2HG GLU 50 3.157 7.762 12.126 2714 HG3 GLU 50 1HG GLU 50 4.212 9.126 11.606 2715 H THR 51 H THR 51 6.521 5.574 10.346 2716 HA THR 51 HA THR 51 6.643 5.217 7.579 2717 HB THR 51 HB THR 51 8.709 4.673 9.775 2718 HG1 THR 51 1HG THR 51 8.183 6.786 9.753 2719 HG21 THR 51 3HG2 THR 51 10.367 4.957 7.863 2720 HG22 THR 51 1HG2 THR 51 8.984 4.965 6.704 2721 HG23 THR 51 2HG2 THR 51 9.342 3.494 7.651 2722 H ALA 52 H ALA 52 6.595 2.881 10.290 2723 HA ALA 52 HA ALA 52 7.180 0.610 8.743 2724 HB1 ALA 52 1HB ALA 52 6.015 -0.660 10.604 2725 HB2 ALA 52 2HB ALA 52 5.450 0.911 11.280 2726 HB3 ALA 52 3HB ALA 52 7.215 0.534 11.221 2727 H THR 53 H THR 53 4.125 2.423 9.282 2728 HA THR 53 HA THR 53 2.618 0.413 7.871 2729 HB THR 53 HB THR 53 0.782 2.302 8.149 2730 HG1 THR 53 1HG THR 53 2.469 3.822 8.903 2731 HG21 THR 53 3HG2 THR 53 2.042 0.739 10.511 2732 HG22 THR 53 1HG2 THR 53 0.863 0.077 9.314 2733 HG23 THR 53 2HG2 THR 53 0.362 1.392 10.441 2734 H THR 54 H THR 54 4.826 2.527 6.650 2735 HA THR 54 HA THR 54 5.152 3.433 4.699 2736 HB THR 54 HB THR 54 4.317 2.228 2.674 2737 HG1 THR 54 1HG THR 54 2.433 1.444 4.375 2738 HG21 THR 54 3HG2 THR 54 5.294 0.421 5.009 2739 HG22 THR 54 1HG2 THR 54 6.333 1.489 4.001 2740 HG23 THR 54 2HG2 THR 54 5.476 0.104 3.243 2741 H VAL 55 H VAL 55 3.483 5.119 6.044 2742 HA VAL 55 HA VAL 55 1.687 6.076 3.900 2743 HB VAL 55 HB VAL 55 0.684 7.453 5.879 2744 HG11 VAL 55 1HG1 VAL 55 -0.479 5.766 4.479 2745 HG12 VAL 55 2HG1 VAL 55 -1.001 5.641 6.197 2746 HG13 VAL 55 3HG1 VAL 55 0.152 4.426 5.507 2747 HG21 VAL 55 3HG2 VAL 55 2.381 6.596 7.675 2748 HG22 VAL 55 1HG2 VAL 55 1.685 4.949 7.435 2749 HG23 VAL 55 2HG2 VAL 55 0.671 6.289 8.062 2750 H GLY 56 H GLY 56 2.833 7.938 6.670 2751 HA2 GLY 56 2HA GLY 56 4.810 9.180 6.747 2752 HA3 GLY 56 1HA GLY 56 4.878 9.172 4.930 2753 H TYR 57 H TYR 57 2.549 9.994 7.649 2754 HA TYR 57 HA TYR 57 0.898 11.439 6.017 2755 HB2 TYR 57 2HB TYR 57 1.174 10.961 8.926 2756 HB3 TYR 57 1HB TYR 57 0.769 12.674 8.689 2757 HD1 TYR 57 2HD TYR 57 -1.185 13.237 7.112 2758 HD2 TYR 57 1HD TYR 57 -0.538 9.342 8.801 2759 HE1 TYR 57 2HE TYR 57 -3.573 12.732 6.827 2760 HE2 TYR 57 1HE TYR 57 -2.933 8.811 8.507 2761 HH TYR 57 HH TYR 57 -5.277 11.315 7.498 2762 H GLY 58 H GLY 58 3.895 12.525 7.438 2763 HA2 GLY 58 2HA GLY 58 4.828 14.267 6.072 2764 HA3 GLY 58 1HA GLY 58 3.326 15.224 6.325 2765 H ASP 59 H ASP 59 3.882 13.690 9.221 2766 HA ASP 59 HA ASP 59 4.512 16.023 10.493 2767 HB2 ASP 59 2HB ASP 59 4.796 13.089 11.394 2768 HB3 ASP 59 1HB ASP 59 5.294 14.441 12.488 2769 H ARG 60 H ARG 60 6.819 13.488 9.402 2770 HA ARG 60 HA ARG 60 8.942 15.365 10.064 2771 HB2 ARG 60 2HB ARG 60 9.076 12.370 10.725 2772 HB3 ARG 60 1HB ARG 60 10.390 13.551 10.929 2773 HG2 ARG 60 2HG ARG 60 7.717 13.501 12.486 2774 HG3 ARG 60 1HG ARG 60 9.277 12.822 13.067 2775 HD2 ARG 60 2HD ARG 60 10.315 15.048 13.160 2776 HD3 ARG 60 1HD ARG 60 8.887 15.825 12.411 2777 HE ARG 60 HE ARG 60 9.064 14.604 15.177 2778 HH11 ARG 60 1HH2 ARG 60 7.076 16.534 12.837 2779 HH12 ARG 60 2HH2 ARG 60 6.269 17.383 14.062 2780 HH21 ARG 60 1HH1 ARG 60 7.850 15.825 16.894 2781 HH22 ARG 60 2HH1 ARG 60 7.005 17.192 16.344 2782 H TYR 61 H TYR 61 10.614 15.167 8.437 2783 HA TYR 61 HA TYR 61 10.006 13.261 6.344 2784 HB2 TYR 61 2HB TYR 61 10.628 14.881 4.571 2785 HB3 TYR 61 1HB TYR 61 9.098 15.322 5.400 2786 HD1 TYR 61 1HD TYR 61 9.050 17.263 6.992 2787 HD2 TYR 61 2HD TYR 61 12.571 16.274 4.732 2788 HE1 TYR 61 1HE TYR 61 10.019 19.467 7.538 2789 HE2 TYR 61 2HE TYR 61 13.538 18.464 5.260 2790 HH TYR 61 HH TYR 61 13.405 20.240 6.687 2791 HA PRO 62 HA PRO 62 14.431 13.052 7.365 2792 HB2 PRO 62 2HB PRO 62 15.155 10.906 5.716 2793 HB3 PRO 62 1HB PRO 62 14.170 10.669 7.201 2794 HG2 PRO 62 2HG PRO 62 13.159 10.954 4.310 2795 HG3 PRO 62 1HG PRO 62 12.726 9.678 5.525 2796 HD2 PRO 62 2HD PRO 62 11.192 11.952 5.067 2797 HD3 PRO 62 1HD PRO 62 11.327 11.217 6.733 2798 H VAL 63 H VAL 63 16.566 13.107 5.881 2799 HA VAL 63 HA VAL 63 15.974 14.409 3.330 2800 HB VAL 63 HB VAL 63 17.804 16.070 3.710 2801 HG11 VAL 63 1HG1 VAL 63 16.444 17.592 5.138 2802 HG12 VAL 63 2HG1 VAL 63 15.468 16.204 5.730 2803 HG13 VAL 63 3HG1 VAL 63 15.391 16.672 4.000 2804 HG21 VAL 63 3HG2 VAL 63 17.660 15.017 6.628 2805 HG22 VAL 63 1HG2 VAL 63 18.559 16.475 6.077 2806 HG23 VAL 63 2HG2 VAL 63 19.065 14.844 5.529 2807 H THR 64 H THR 64 18.608 14.737 2.487 2808 HA THR 64 HA THR 64 19.320 12.083 1.967 2809 HB THR 64 HB THR 64 20.691 14.747 1.294 2810 HG1 THR 64 1HG THR 64 19.363 14.556 -0.609 2811 HG21 THR 64 3HG2 THR 64 22.116 12.750 0.784 2812 HG22 THR 64 1HG2 THR 64 21.510 13.504 -0.726 2813 HG23 THR 64 2HG2 THR 64 20.773 11.983 -0.128 2814 H GLU 65 H GLU 65 20.557 14.647 4.069 2815 HA GLU 65 HA GLU 65 23.008 13.503 4.609 2816 HB2 GLU 65 2HB GLU 65 21.534 15.354 6.525 2817 HB3 GLU 65 1HB GLU 65 23.283 15.299 6.156 2818 HG2 GLU 65 2HG GLU 65 20.978 16.397 4.367 2819 HG3 GLU 65 1HG GLU 65 22.235 17.328 5.230 2820 H GLU 66 H GLU 66 19.827 12.839 5.981 2821 HA GLU 66 HA GLU 66 20.886 11.716 8.390 2822 HB2 GLU 66 2HB GLU 66 18.680 11.344 9.105 2823 HB3 GLU 66 1HB GLU 66 18.642 12.869 8.218 2824 HG2 GLU 66 2HG GLU 66 16.722 11.898 7.425 2825 HG3 GLU 66 1HG GLU 66 17.845 11.240 6.167 2826 H GLY 67 H GLY 67 20.294 10.842 5.151 2827 HA2 GLY 67 2HA GLY 67 21.306 9.157 4.057 2828 HA3 GLY 67 1HA GLY 67 21.536 8.263 5.617 2829 H ARG 68 H ARG 68 18.884 9.779 3.820 2830 HA ARG 68 HA ARG 68 16.706 8.986 4.610 2831 HB2 ARG 68 2HB ARG 68 17.296 10.211 2.405 2832 HB3 ARG 68 1HB ARG 68 17.030 8.628 1.608 2833 HG2 ARG 68 2HG ARG 68 14.683 8.615 2.717 2834 HG3 ARG 68 1HG ARG 68 15.030 10.272 3.298 2835 HD2 ARG 68 2HD ARG 68 14.842 9.329 0.344 2836 HD3 ARG 68 1HD ARG 68 13.638 10.350 1.245 2837 HE ARG 68 HE ARG 68 16.144 11.663 1.459 2838 HH11 ARG 68 2HH2 ARG 68 13.190 11.653 -0.761 2839 HH12 ARG 68 1HH2 ARG 68 14.260 10.763 -1.555 2840 HH21 ARG 68 1HH1 ARG 68 16.617 13.557 -0.096 2841 HH22 ARG 68 2HH1 ARG 68 15.345 13.876 -1.226 2842 H LYS 69 H LYS 69 18.772 6.554 3.378 2843 HA LYS 69 HA LYS 69 16.778 4.535 3.082 2844 HB2 LYS 69 2HB LYS 69 19.818 4.384 3.322 2845 HB3 LYS 69 1HB LYS 69 18.743 2.952 3.118 2846 HG2 LYS 69 2HG LYS 69 17.810 3.906 1.033 2847 HG3 LYS 69 1HG LYS 69 18.907 5.318 1.139 2848 HD2 LYS 69 2HD LYS 69 20.872 3.964 0.824 2849 HD3 LYS 69 1HD LYS 69 19.984 2.425 1.046 2850 HE2 LYS 69 2HE LYS 69 19.249 4.384 -1.234 2851 HE3 LYS 69 1HE LYS 69 20.589 3.184 -1.408 2852 HZ1 LYS 69 3HZ LYS 69 19.147 1.428 -1.134 2853 HZ2 LYS 69 1HZ LYS 69 18.440 2.439 -2.258 2854 HZ3 LYS 69 2HZ LYS 69 17.779 2.380 -0.671 2855 H VAL 70 H VAL 70 17.778 6.235 5.888 2856 HA VAL 70 HA VAL 70 17.666 4.040 7.684 2857 HB VAL 70 HB VAL 70 16.879 6.961 8.170 2858 HG11 VAL 70 1HG1 VAL 70 17.326 4.598 10.120 2859 HG12 VAL 70 2HG1 VAL 70 15.776 5.478 9.833 2860 HG13 VAL 70 3HG1 VAL 70 17.155 6.338 10.586 2861 HG21 VAL 70 3HG2 VAL 70 19.129 6.987 9.344 2862 HG22 VAL 70 1HG2 VAL 70 19.246 6.816 7.580 2863 HG23 VAL 70 2HG2 VAL 70 19.498 5.365 8.639 2864 H ALA 71 H ALA 71 15.283 6.381 6.401 2865 HA ALA 71 HA ALA 71 12.979 5.267 7.446 2866 HB1 ALA 71 1HB ALA 71 13.339 6.591 4.668 2867 HB2 ALA 71 2HB ALA 71 13.045 7.468 6.207 2868 HB3 ALA 71 3HB ALA 71 11.784 6.366 5.544 2869 H GLU 72 H GLU 72 14.552 4.643 4.309 2870 HA GLU 72 HA GLU 72 12.746 2.938 3.232 2871 HB2 GLU 72 2HB GLU 72 14.949 3.871 2.144 2872 HB3 GLU 72 1HB GLU 72 15.730 2.408 2.828 2873 HG2 GLU 72 2HG GLU 72 13.640 1.206 1.530 2874 HG3 GLU 72 1HG GLU 72 13.678 2.730 0.577 2875 H GLN 73 H GLN 73 15.323 2.022 5.577 2876 HA GLN 73 HA GLN 73 14.933 -0.753 5.167 2877 HB2 GLN 73 2HB GLN 73 17.001 0.343 6.365 2878 HB3 GLN 73 1HB GLN 73 15.951 0.383 7.817 2879 HG2 GLN 73 2HG GLN 73 15.551 -2.211 7.270 2880 HG3 GLN 73 1HG GLN 73 16.978 -2.044 6.195 2881 HE21 GLN 73 1HE2 GLN 73 17.197 -3.879 8.095 2882 HE22 GLN 73 2HE2 GLN 73 18.154 -3.385 9.449 2883 H VAL 74 H VAL 74 13.294 1.679 7.226 2884 HA VAL 74 HA VAL 74 12.130 -0.244 8.960 2885 HB VAL 74 HB VAL 74 11.028 2.534 8.341 2886 HG11 VAL 74 1HG1 VAL 74 9.521 1.051 9.713 2887 HG12 VAL 74 2HG1 VAL 74 10.204 2.369 10.723 2888 HG13 VAL 74 3HG1 VAL 74 10.880 0.705 10.847 2889 HG21 VAL 74 3HG2 VAL 74 13.360 2.891 8.831 2890 HG22 VAL 74 1HG2 VAL 74 13.351 1.694 10.178 2891 HG23 VAL 74 2HG2 VAL 74 12.457 3.259 10.326 2892 H MET 75 H MET 75 11.155 1.348 5.901 2893 HA MET 75 HA MET 75 8.542 0.372 5.826 2894 HB2 MET 75 2HB MET 75 10.449 1.083 3.516 2895 HB3 MET 75 1HB MET 75 8.770 0.503 3.262 2896 HG2 MET 75 2HG MET 75 8.209 2.643 3.222 2897 HG3 MET 75 1HG MET 75 8.136 2.440 4.988 2898 HE1 MET 75 3HE MET 75 9.511 4.442 1.991 2899 HE2 MET 75 1HE MET 75 10.820 3.221 2.100 2900 HE3 MET 75 2HE MET 75 11.159 4.942 2.475 2901 H LYS 76 H LYS 76 11.605 -1.177 4.829 2902 HA LYS 76 HA LYS 76 10.503 -3.424 3.564 2903 HB2 LYS 76 2HB LYS 76 13.157 -2.779 4.883 2904 HB3 LYS 76 1HB LYS 76 12.758 -4.514 4.766 2905 HG2 LYS 76 2HG LYS 76 14.106 -3.958 2.916 2906 HG3 LYS 76 1HG LYS 76 12.466 -4.422 2.363 2907 HD2 LYS 76 2HD LYS 76 11.934 -2.013 1.908 2908 HD3 LYS 76 1HD LYS 76 13.559 -1.533 2.531 2909 HE2 LYS 76 2HE LYS 76 14.678 -2.927 0.783 2910 HE3 LYS 76 1HE LYS 76 13.075 -3.472 0.156 2911 HZ1 LYS 76 3HZ LYS 76 13.980 -1.856 -1.209 2912 HZ2 LYS 76 1HZ LYS 76 14.283 -0.745 0.023 2913 HZ3 LYS 76 2HZ LYS 76 12.663 -1.086 -0.426 2914 H ALA 77 H ALA 77 11.316 -2.859 7.012 2915 HA ALA 77 HA ALA 77 10.722 -5.454 7.860 2916 HB1 ALA 77 1HB ALA 77 11.958 -3.833 9.308 2917 HB2 ALA 77 2HB ALA 77 10.506 -4.471 10.163 2918 HB3 ALA 77 3HB ALA 77 10.474 -2.816 9.446 2919 H GLY 78 H GLY 78 8.663 -2.546 7.549 2920 HA2 GLY 78 2HA GLY 78 6.361 -3.691 8.727 2921 HA3 GLY 78 1HA GLY 78 6.457 -2.273 7.613 2922 H ILE 79 H ILE 79 7.356 -3.289 5.286 2923 HA ILE 79 HA ILE 79 5.064 -4.436 4.211 2924 HB ILE 79 HB ILE 79 7.898 -4.174 3.123 2925 HG12 ILE 79 2HG1 ILE 79 5.295 -2.642 2.452 2926 HG13 ILE 79 1HG1 ILE 79 6.501 -2.070 3.635 2927 HG21 ILE 79 1HG2 ILE 79 6.809 -6.069 1.897 2928 HG22 ILE 79 2HG2 ILE 79 6.891 -4.636 0.835 2929 HG23 ILE 79 3HG2 ILE 79 5.333 -5.072 1.628 2930 HD11 ILE 79 3HD ILE 79 7.014 -2.492 0.614 2931 HD12 ILE 79 1HD ILE 79 6.865 -0.930 1.487 2932 HD13 ILE 79 2HD ILE 79 8.264 -2.015 1.828 2933 H GLU 80 H GLU 80 8.249 -5.995 5.078 2934 HA GLU 80 HA GLU 80 7.402 -8.479 4.071 2935 HB2 GLU 80 2HB GLU 80 9.570 -7.902 6.163 2936 HB3 GLU 80 1HB GLU 80 9.249 -9.505 5.418 2937 HG2 GLU 80 2HG GLU 80 9.664 -8.412 3.110 2938 HG3 GLU 80 1HG GLU 80 10.260 -6.962 3.988 2939 H VAL 81 H VAL 81 7.007 -7.024 7.350 2940 HA VAL 81 HA VAL 81 6.095 -9.439 8.522 2941 HB VAL 81 HB VAL 81 5.897 -6.493 9.255 2942 HG11 VAL 81 1HG1 VAL 81 4.603 -8.865 10.762 2943 HG12 VAL 81 2HG1 VAL 81 3.790 -7.375 10.153 2944 HG13 VAL 81 3HG1 VAL 81 4.959 -7.269 11.507 2945 HG21 VAL 81 3HG2 VAL 81 7.445 -7.239 11.073 2946 HG22 VAL 81 1HG2 VAL 81 8.094 -7.752 9.478 2947 HG23 VAL 81 2HG2 VAL 81 7.283 -8.952 10.550 2948 H PHE 82 H PHE 82 4.326 -6.587 7.121 2949 HA PHE 82 HA PHE 82 1.809 -7.790 7.620 2950 HB2 PHE 82 2HB PHE 82 2.578 -5.560 5.625 2951 HB3 PHE 82 1HB PHE 82 0.882 -6.024 6.032 2952 HD1 PHE 82 2HD PHE 82 0.788 -6.314 8.924 2953 HD2 PHE 82 1HD PHE 82 2.967 -3.462 6.547 2954 HE1 PHE 82 2HE PHE 82 0.756 -4.717 10.799 2955 HE2 PHE 82 1HE PHE 82 2.932 -1.871 8.424 2956 HZ PHE 82 HZ PHE 82 1.823 -2.485 10.559 2957 H ALA 83 H ALA 83 4.133 -8.163 5.007 2958 HA ALA 83 HA ALA 83 2.181 -9.344 3.259 2959 HB1 ALA 83 1HB ALA 83 4.064 -9.856 1.760 2960 HB2 ALA 83 2HB ALA 83 5.246 -9.388 3.048 2961 HB3 ALA 83 3HB ALA 83 4.162 -8.154 2.309 2962 H LEU 84 H LEU 84 4.616 -10.494 5.646 2963 HA LEU 84 HA LEU 84 4.736 -13.136 4.848 2964 HB2 LEU 84 2HB LEU 84 6.281 -12.095 6.471 2965 HB3 LEU 84 1HB LEU 84 4.986 -11.959 7.694 2966 HG LEU 84 HG LEU 84 5.733 -14.705 6.561 2967 HD11 LEU 84 1HD1 LEU 84 7.391 -13.217 8.697 2968 HD12 LEU 84 2HD1 LEU 84 7.925 -13.633 7.025 2969 HD13 LEU 84 3HD1 LEU 84 7.585 -14.944 8.211 2970 HD21 LEU 84 3HD2 LEU 84 5.293 -15.469 8.927 2971 HD22 LEU 84 1HD2 LEU 84 3.859 -14.662 8.216 2972 HD23 LEU 84 2HD2 LEU 84 4.892 -13.778 9.396 2973 H VAL 85 H VAL 85 2.419 -11.466 6.969 2974 HA VAL 85 HA VAL 85 1.166 -13.815 7.841 2975 HB VAL 85 HB VAL 85 -0.591 -12.442 8.745 2976 HG11 VAL 85 1HG1 VAL 85 0.816 -11.124 10.255 2977 HG12 VAL 85 2HG1 VAL 85 2.097 -10.920 9.019 2978 HG13 VAL 85 3HG1 VAL 85 1.821 -12.526 9.746 2979 HG21 VAL 85 3HG2 VAL 85 -0.687 -9.982 8.350 2980 HG22 VAL 85 1HG2 VAL 85 -0.886 -10.827 6.777 2981 HG23 VAL 85 2HG2 VAL 85 0.696 -10.087 7.215 2982 H THR 86 H THR 86 1.138 -12.510 4.683 2983 HA THR 86 HA THR 86 -1.521 -12.912 3.994 2984 HB THR 86 HB THR 86 0.800 -13.266 2.054 2985 HG1 THR 86 1HG THR 86 1.143 -11.365 2.914 2986 HG21 THR 86 3HG2 THR 86 -2.146 -12.298 1.745 2987 HG22 THR 86 1HG2 THR 86 -1.479 -13.857 1.131 2988 HG23 THR 86 2HG2 THR 86 -0.908 -12.312 0.439 2989 H ALA 87 H ALA 87 0.945 -15.252 4.798 2990 HA ALA 87 HA ALA 87 -0.129 -17.467 3.454 2991 HB1 ALA 87 1HB ALA 87 0.953 -18.851 5.250 2992 HB2 ALA 87 2HB ALA 87 1.221 -17.354 6.225 2993 HB3 ALA 87 3HB ALA 87 2.057 -17.569 4.647 2994 H ALA 88 H ALA 88 -1.092 -15.889 6.528 2995 HA ALA 88 HA ALA 88 -2.901 -17.987 7.282 2996 HB1 ALA 88 1HB ALA 88 -3.684 -16.339 9.038 2997 HB2 ALA 88 2HB ALA 88 -2.663 -15.071 8.281 2998 HB3 ALA 88 3HB ALA 88 -1.889 -16.496 9.052 2999 H LEU 89 H LEU 89 -3.050 -14.822 5.629 3000 HA LEU 89 HA LEU 89 -5.896 -14.887 5.467 3001 HB2 LEU 89 2HB LEU 89 -3.849 -13.142 3.982 3002 HB3 LEU 89 1HB LEU 89 -5.621 -13.014 3.798 3003 HG LEU 89 HG LEU 89 -4.993 -11.277 5.197 3004 HD11 LEU 89 1HD1 LEU 89 -7.119 -12.462 5.769 3005 HD12 LEU 89 2HD1 LEU 89 -6.398 -11.591 7.171 3006 HD13 LEU 89 3HD1 LEU 89 -6.266 -13.386 7.056 3007 HD21 LEU 89 3HD2 LEU 89 -3.607 -13.170 7.194 3008 HD22 LEU 89 1HD2 LEU 89 -3.842 -11.395 7.356 3009 HD23 LEU 89 2HD2 LEU 89 -2.798 -12.039 6.043 3010 H ALA 90 H ALA 90 -3.293 -16.161 3.430 3011 HA ALA 90 HA ALA 90 -4.902 -16.553 1.161 3012 HB1 ALA 90 1HB ALA 90 -3.143 -18.189 0.423 3013 HB2 ALA 90 2HB ALA 90 -2.393 -18.101 2.065 3014 HB3 ALA 90 3HB ALA 90 -2.417 -16.648 1.002 3015 H THR 91 H THR 91 -3.984 -18.767 3.884 3016 HA THR 91 HA THR 91 -5.554 -20.860 2.787 3017 HB THR 91 HB THR 91 -3.615 -21.236 4.220 3018 HG1 THR 91 1HG THR 91 -6.083 -22.305 4.996 3019 HG21 THR 91 3HG2 THR 91 -4.028 -19.381 5.876 3020 HG22 THR 91 1HG2 THR 91 -3.697 -20.965 6.639 3021 HG23 THR 91 2HG2 THR 91 -5.385 -20.320 6.582 3022 H ASP 92 H ASP 92 -6.672 -17.960 3.984 3023 HA ASP 92 HA ASP 92 -8.799 -18.881 5.601 3024 HB2 ASP 92 2HB ASP 92 -7.714 -16.407 5.176 3025 HB3 ASP 92 1HB ASP 92 -9.114 -16.279 4.070 3026 H PHE 93 H PHE 93 -8.159 -18.793 2.134 3027 HA PHE 93 HA PHE 93 -10.865 -18.923 1.356 3028 HB2 PHE 93 2HB PHE 93 -10.280 -19.383 -0.850 3029 HB3 PHE 93 1HB PHE 93 -8.984 -18.320 -0.251 3030 HD1 PHE 93 1HD PHE 93 -9.756 -22.013 -0.916 3031 HD2 PHE 93 2HD PHE 93 -6.781 -18.936 -0.715 3032 HE1 PHE 93 1HE PHE 93 -8.113 -23.541 -1.926 3033 HE2 PHE 93 2HE PHE 93 -5.145 -20.443 -1.741 3034 HZ PHE 93 HZ PHE 93 -5.797 -22.767 -2.348 3035 H VAL 94 H VAL 94 -8.974 -21.345 3.011 3036 HA VAL 94 HA VAL 94 -10.091 -23.515 1.539 3037 HB VAL 94 HB VAL 94 -9.097 -25.051 2.967 3038 HG11 VAL 94 1HG1 VAL 94 -6.732 -24.304 2.861 3039 HG12 VAL 94 2HG1 VAL 94 -7.231 -22.590 2.688 3040 HG13 VAL 94 3HG1 VAL 94 -7.624 -23.769 1.389 3041 HG21 VAL 94 3HG2 VAL 94 -7.897 -24.314 5.117 3042 HG22 VAL 94 1HG2 VAL 94 -9.688 -24.345 5.191 3043 HG23 VAL 94 2HG2 VAL 94 -8.837 -22.778 5.039 3044 H ARG 95 H ARG 95 -11.269 -21.493 4.090 3045 HA ARG 95 HA ARG 95 -13.045 -23.373 5.278 3046 HB2 ARG 95 2HB ARG 95 -13.106 -20.297 5.262 3047 HB3 ARG 95 1HB ARG 95 -14.000 -21.366 6.400 3048 HG2 ARG 95 2HG ARG 95 -11.855 -22.173 7.364 3049 HG3 ARG 95 1HG ARG 95 -10.918 -21.194 6.169 3050 HD2 ARG 95 2HD ARG 95 -11.912 -19.097 7.028 3051 HD3 ARG 95 1HD ARG 95 -12.822 -20.012 8.306 3052 HE ARG 95 HE ARG 95 -10.373 -20.899 8.897 3053 HH11 ARG 95 1HH2 ARG 95 -11.000 -17.462 7.793 3054 HH12 ARG 95 2HH2 ARG 95 -10.486 -16.784 9.174 3055 HH21 ARG 95 1HH1 ARG 95 -8.519 -19.688 9.978 3056 HH22 ARG 95 2HH1 ARG 95 -8.574 -17.986 9.999 3057 H ARG 96 H ARG 96 -13.091 -22.191 2.188 3058 HA ARG 96 HA ARG 96 -15.961 -21.798 1.978 3059 HB2 ARG 96 2HB ARG 96 -13.925 -22.501 -0.201 3060 HB3 ARG 96 1HB ARG 96 -15.580 -21.883 -0.477 3061 HG2 ARG 96 2HG ARG 96 -15.006 -19.667 0.378 3062 HG3 ARG 96 1HG ARG 96 -13.431 -20.230 0.998 3063 HD2 ARG 96 2HD ARG 96 -14.198 -19.829 -1.969 3064 HD3 ARG 96 1HD ARG 96 -12.917 -19.015 -1.010 3065 HE ARG 96 HE ARG 96 -11.798 -21.219 -0.784 3066 HH11 ARG 96 1HH2 ARG 96 -14.473 -21.285 -3.209 3067 HH12 ARG 96 2HH2 ARG 96 -13.808 -22.574 -4.088 3068 HH21 ARG 96 1HH1 ARG 96 -10.754 -22.837 -2.293 3069 HH22 ARG 96 2HH1 ARG 96 -11.758 -23.551 -3.487 3070 H GLU 97 H GLU 97 -13.501 -24.347 1.760 3071 HA GLU 97 HA GLU 97 -15.418 -26.256 0.647 3072 HB2 GLU 97 2HB GLU 97 -12.421 -26.558 1.317 3073 HB3 GLU 97 1HB GLU 97 -13.437 -27.751 0.448 3074 HG2 GLU 97 2HG GLU 97 -12.744 -24.896 -0.577 3075 HG3 GLU 97 1HG GLU 97 -11.920 -26.422 -1.061 3076 H GLU 98 H GLU 98 -13.218 -25.659 3.424 3077 HA GLU 98 HA GLU 98 -14.240 -27.916 4.930 3078 HB2 GLU 98 2HB GLU 98 -12.344 -25.587 5.699 3079 HB3 GLU 98 1HB GLU 98 -12.549 -27.091 6.650 3080 HG2 GLU 98 2HG GLU 98 -11.436 -27.111 3.750 3081 HG3 GLU 98 1HG GLU 98 -10.417 -26.746 5.183 3082 H GLU 99 H GLU 99 -14.760 -27.235 7.364 3083 HA GLU 99 HA GLU 99 -15.960 -26.213 8.878 3084 HB2 GLU 99 2HB GLU 99 -15.784 -23.632 7.237 3085 HB3 GLU 99 1HB GLU 99 -16.426 -23.756 8.900 3086 HG2 GLU 99 2HG GLU 99 -13.515 -24.474 8.126 3087 HG3 GLU 99 1HG GLU 99 -14.061 -22.828 8.589 3088 H ARG 100 H ARG 100 -16.986 -24.731 5.858 3089 HA ARG 100 HA ARG 100 -19.713 -24.520 6.241 3090 HB2 ARG 100 2HB ARG 100 -18.191 -23.447 4.414 3091 HB3 ARG 100 1HB ARG 100 -18.196 -25.016 3.581 3092 HG2 ARG 100 2HG ARG 100 -20.918 -24.627 3.759 3093 HG3 ARG 100 1HG ARG 100 -20.360 -22.927 3.901 3094 HD2 ARG 100 2HD ARG 100 -18.900 -23.552 1.724 3095 HD3 ARG 100 1HD ARG 100 -20.090 -24.896 1.518 3096 HE ARG 100 HE ARG 100 -20.404 -22.043 1.014 3097 HH11 ARG 100 1HH2 ARG 100 -22.545 -24.868 1.782 3098 HH12 ARG 100 2HH2 ARG 100 -23.873 -23.889 2.221 3099 HH21 ARG 100 1HH1 ARG 100 -22.174 -20.782 1.535 3100 HH22 ARG 100 2HH1 ARG 100 -23.708 -21.408 1.898 3101 H ARG 101 H ARG 101 -17.718 -27.017 4.550 3102 HA ARG 101 HA ARG 101 -19.968 -28.902 4.691 3103 HB2 ARG 101 2HB ARG 101 -17.634 -28.804 2.677 3104 HB3 ARG 101 1HB ARG 101 -18.905 -30.064 2.734 3105 HG2 ARG 101 2HG ARG 101 -20.610 -28.513 2.034 3106 HG3 ARG 101 1HG ARG 101 -19.548 -27.083 2.304 3107 HD2 ARG 101 2HD ARG 101 -18.086 -27.704 0.416 3108 HD3 ARG 101 1HD ARG 101 -19.067 -29.206 0.109 3109 HE ARG 101 HE ARG 101 -20.929 -27.105 0.117 3110 HH11 ARG 101 1HH2 ARG 101 -17.972 -27.972 -1.819 3111 HH12 ARG 101 2HH2 ARG 101 -18.546 -27.232 -3.256 3112 HH21 ARG 101 1HH1 ARG 101 -21.721 -26.176 -1.973 3113 HH22 ARG 101 2HH1 ARG 101 -20.775 -26.415 -3.382 3114 H GLY 102 H GLY 102 -19.411 -30.710 5.908 3115 HA2 GLY 102 2HA GLY 102 -17.991 -32.338 6.599 3116 HA3 GLY 102 1HA GLY 102 -16.562 -31.325 6.188 3117 H HIS 103 H HIS 103 -17.684 -28.984 7.646 3118 HA HIS 103 HA HIS 103 -17.212 -28.014 9.523 3119 HB2 HIS 103 2HB HIS 103 -18.139 -28.683 11.658 3120 HB3 HIS 103 1HB HIS 103 -19.321 -28.827 10.330 3121 HD1 HIS 103 1HD HIS 103 -17.129 -31.094 12.569 3122 HD2 HIS 103 2HD HIS 103 -20.466 -31.278 9.985 3123 HE1 HIS 103 1HE HIS 103 -18.136 -33.397 12.779 3124 HE2 HIS 103 2HE HIS 103 -20.166 -33.472 11.224 Start of MODEL 6 1 H1 SER 1 H SER 1 -22.148 -14.896 -3.930 2 HA SER 1 HA SER 1 -22.137 -14.618 -1.720 3 HB2 SER 1 2HB SER 1 -24.141 -16.223 -1.358 4 HB3 SER 1 1HB SER 1 -22.971 -17.580 -1.357 5 HG SER 1 1HG SER 1 -23.465 -16.898 0.718 6 H ALA 2 H ALA 2 -21.341 -17.820 -3.065 7 HA ALA 2 HA ALA 2 -19.584 -19.066 -3.161 8 HB1 ALA 2 1HB ALA 2 -18.967 -17.348 -4.853 9 HB2 ALA 2 2HB ALA 2 -17.517 -18.096 -4.096 10 HB3 ALA 2 3HB ALA 2 -18.056 -16.441 -3.589 11 H ASP 3 H ASP 3 -20.222 -18.053 -0.446 12 HA ASP 3 HA ASP 3 -19.574 -18.289 1.622 13 HB2 ASP 3 2HB ASP 3 -16.976 -19.687 0.801 14 HB3 ASP 3 1HB ASP 3 -17.901 -19.877 2.328 15 H HIS 4 H HIS 4 -18.260 -16.087 -0.229 16 HA HIS 4 HA HIS 4 -16.203 -15.220 1.662 17 HB2 HIS 4 2HB HIS 4 -14.337 -15.140 0.123 18 HB3 HIS 4 1HB HIS 4 -14.926 -16.815 0.216 19 HD1 HIS 4 1HD HIS 4 -15.313 -13.806 -2.288 20 HD2 HIS 4 2HD HIS 4 -15.079 -18.016 -2.221 21 HE1 HIS 4 1HE HIS 4 -15.161 -14.538 -4.638 22 HE2 HIS 4 2HE HIS 4 -15.005 -17.083 -4.610 23 H GLU 5 H GLU 5 -18.120 -14.638 -1.305 24 HA GLU 5 HA GLU 5 -17.067 -12.060 -1.838 25 HB2 GLU 5 2HB GLU 5 -18.184 -13.389 -3.631 26 HB3 GLU 5 1HB GLU 5 -19.615 -13.624 -2.587 27 HG2 GLU 5 2HG GLU 5 -20.209 -11.193 -2.797 28 HG3 GLU 5 1HG GLU 5 -18.854 -11.007 -3.970 29 H ARG 6 H ARG 6 -19.919 -13.416 -0.247 30 HA ARG 6 HA ARG 6 -21.208 -11.064 0.405 31 HB2 ARG 6 2HB ARG 6 -21.996 -13.591 0.552 32 HB3 ARG 6 1HB ARG 6 -21.285 -13.576 2.193 33 HG2 ARG 6 2HG ARG 6 -22.874 -11.591 2.720 34 HG3 ARG 6 1HG ARG 6 -23.560 -11.837 1.077 35 HD2 ARG 6 2HD ARG 6 -23.990 -14.342 1.868 36 HD3 ARG 6 1HD ARG 6 -23.686 -13.708 3.536 37 HE ARG 6 HE ARG 6 -25.729 -12.404 1.698 38 HH11 ARG 6 1HH2 ARG 6 -25.107 -14.152 4.860 39 HH12 ARG 6 2HH2 ARG 6 -26.753 -14.271 5.232 40 HH21 ARG 6 1HH1 ARG 6 -28.027 -12.773 2.236 41 HH22 ARG 6 2HH1 ARG 6 -28.465 -13.271 3.797 42 H GLU 7 H GLU 7 -18.641 -12.851 2.069 43 HA GLU 7 HA GLU 7 -18.863 -11.414 4.516 44 HB2 GLU 7 2HB GLU 7 -18.085 -13.817 4.222 45 HB3 GLU 7 1HB GLU 7 -16.562 -13.197 3.496 46 HG2 GLU 7 2HG GLU 7 -15.979 -12.070 5.644 47 HG3 GLU 7 1HG GLU 7 -17.576 -12.525 6.347 48 H ALA 8 H ALA 8 -16.817 -11.297 1.575 49 HA ALA 8 HA ALA 8 -14.944 -9.470 2.453 50 HB1 ALA 8 1HB ALA 8 -16.122 -9.825 -0.385 51 HB2 ALA 8 2HB ALA 8 -14.700 -10.703 0.291 52 HB3 ALA 8 3HB ALA 8 -14.611 -8.925 0.005 53 H GLN 9 H GLN 9 -18.108 -8.876 0.831 54 HA GLN 9 HA GLN 9 -17.732 -6.035 0.920 55 HB2 GLN 9 2HB GLN 9 -20.096 -5.849 0.217 56 HB3 GLN 9 1HB GLN 9 -19.177 -6.975 -0.827 57 HG2 GLN 9 2HG GLN 9 -20.207 -8.945 0.263 58 HG3 GLN 9 1HG GLN 9 -20.975 -7.921 1.519 59 HE21 GLN 9 1HE2 GLN 9 -20.777 -7.799 -2.138 60 HE22 GLN 9 2HE2 GLN 9 -22.482 -7.607 -2.360 61 H LYS 10 H LYS 10 -18.739 -8.366 3.301 62 HA LYS 10 HA LYS 10 -20.413 -6.571 4.801 63 HB2 LYS 10 2HB LYS 10 -20.589 -9.136 5.013 64 HB3 LYS 10 1HB LYS 10 -18.956 -9.117 5.748 65 HG2 LYS 10 2HG LYS 10 -20.111 -7.379 7.466 66 HG3 LYS 10 1HG LYS 10 -21.617 -8.180 6.926 67 HD2 LYS 10 2HD LYS 10 -20.730 -10.374 7.733 68 HD3 LYS 10 1HD LYS 10 -19.103 -9.636 7.964 69 HE2 LYS 10 2HE LYS 10 -20.113 -8.061 9.712 70 HE3 LYS 10 1HE LYS 10 -21.637 -9.033 9.647 71 HZ1 LYS 10 3HZ LYS 10 -20.486 -10.900 10.551 72 HZ2 LYS 10 1HZ LYS 10 -19.900 -9.554 11.410 73 HZ3 LYS 10 2HZ LYS 10 -18.956 -10.230 10.193 74 H ALA 11 H ALA 11 -17.030 -7.639 4.663 75 HA ALA 11 HA ALA 11 -16.129 -6.600 7.044 76 HB1 ALA 11 1HB ALA 11 -14.517 -6.831 4.425 77 HB2 ALA 11 2HB ALA 11 -14.868 -8.209 5.529 78 HB3 ALA 11 3HB ALA 11 -13.866 -6.842 6.105 79 H GLU 12 H GLU 12 -16.513 -4.998 3.860 80 HA GLU 12 HA GLU 12 -15.228 -2.606 4.387 81 HB2 GLU 12 2HB GLU 12 -17.873 -3.003 2.833 82 HB3 GLU 12 1HB GLU 12 -16.897 -1.498 2.843 83 HG2 GLU 12 2HG GLU 12 -14.964 -2.786 1.811 84 HG3 GLU 12 1HG GLU 12 -16.070 -4.195 1.592 85 H GLU 13 H GLU 13 -18.536 -3.640 5.252 86 HA GLU 13 HA GLU 13 -19.439 -1.119 6.072 87 HB2 GLU 13 2HB GLU 13 -20.435 -3.868 7.015 88 HB3 GLU 13 1HB GLU 13 -21.362 -2.325 7.018 89 HG2 GLU 13 2HG GLU 13 -20.367 -3.806 4.470 90 HG3 GLU 13 1HG GLU 13 -22.009 -3.933 5.174 91 H GLU 14 H GLU 14 -17.599 -3.676 7.661 92 HA GLU 14 HA GLU 14 -18.148 -2.821 10.312 93 HB2 GLU 14 2HB GLU 14 -17.355 -5.081 10.020 94 HB3 GLU 14 1HB GLU 14 -15.850 -4.539 9.219 95 HG2 GLU 14 2HG GLU 14 -14.830 -3.794 11.196 96 HG3 GLU 14 1HG GLU 14 -16.381 -3.532 12.056 97 H LEU 15 H LEU 15 -15.654 -2.033 7.882 98 HA LEU 15 HA LEU 15 -14.096 -0.485 9.617 99 HB2 LEU 15 2HB LEU 15 -13.277 -1.323 7.452 100 HB3 LEU 15 1HB LEU 15 -14.436 -0.278 6.565 101 HG LEU 15 HG LEU 15 -13.261 1.751 7.363 102 HD11 LEU 15 1HD1 LEU 15 -11.563 -0.210 9.014 103 HD12 LEU 15 2HD1 LEU 15 -12.491 1.220 9.580 104 HD13 LEU 15 3HD1 LEU 15 -11.002 1.452 8.610 105 HD21 LEU 15 3HD2 LEU 15 -11.083 1.417 6.141 106 HD22 LEU 15 1HD2 LEU 15 -12.511 0.770 5.262 107 HD23 LEU 15 2HD2 LEU 15 -11.396 -0.353 6.106 108 H GLN 16 H GLN 16 -16.886 0.336 7.533 109 HA GLN 16 HA GLN 16 -16.708 3.075 7.675 110 HB2 GLN 16 2HB GLN 16 -19.350 1.494 7.684 111 HB3 GLN 16 1HB GLN 16 -19.135 3.238 7.312 112 HG2 GLN 16 2HG GLN 16 -17.509 2.436 5.400 113 HG3 GLN 16 1HG GLN 16 -18.240 0.809 5.630 114 HE21 GLN 16 1HE2 GLN 16 -20.254 0.450 4.403 115 HE22 GLN 16 2HE2 GLN 16 -21.240 1.729 3.870 116 H LYS 17 H LYS 17 -18.312 0.892 10.072 117 HA LYS 17 HA LYS 17 -19.121 3.147 11.644 118 HB2 LYS 17 2HB LYS 17 -19.699 1.476 13.435 119 HB3 LYS 17 1HB LYS 17 -20.535 1.282 11.866 120 HG2 LYS 17 2HG LYS 17 -19.081 -0.605 11.235 121 HG3 LYS 17 1HG LYS 17 -18.154 -0.462 12.773 122 HD2 LYS 17 2HD LYS 17 -20.181 -1.078 14.088 123 HD3 LYS 17 1HD LYS 17 -21.196 -0.892 12.628 124 HE2 LYS 17 2HE LYS 17 -21.041 -3.247 12.976 125 HE3 LYS 17 1HE LYS 17 -20.025 -2.861 11.540 126 HZ1 LYS 17 3HZ LYS 17 -18.873 -4.392 12.805 127 HZ2 LYS 17 1HZ LYS 17 -19.178 -3.679 14.274 128 HZ3 LYS 17 2HZ LYS 17 -18.081 -2.936 13.196 129 H VAL 18 H VAL 18 -16.209 1.094 11.590 130 HA VAL 18 HA VAL 18 -15.405 1.795 14.224 131 HB VAL 18 HB VAL 18 -13.886 0.599 11.865 132 HG11 VAL 18 1HG1 VAL 18 -12.112 0.004 13.601 133 HG12 VAL 18 2HG1 VAL 18 -12.919 1.114 14.767 134 HG13 VAL 18 3HG1 VAL 18 -12.185 1.762 13.252 135 HG21 VAL 18 3HG2 VAL 18 -14.881 -0.586 14.556 136 HG22 VAL 18 1HG2 VAL 18 -14.106 -1.490 13.203 137 HG23 VAL 18 2HG2 VAL 18 -15.740 -0.775 12.993 138 H LEU 19 H LEU 19 -14.654 3.128 10.951 139 HA LEU 19 HA LEU 19 -12.790 4.976 12.008 140 HB2 LEU 19 2HB LEU 19 -12.704 6.049 9.868 141 HB3 LEU 19 1HB LEU 19 -12.790 4.282 9.641 142 HG LEU 19 HG LEU 19 -15.417 4.760 9.386 143 HD11 LEU 19 1HD1 LEU 19 -14.203 7.422 8.389 144 HD12 LEU 19 2HD1 LEU 19 -15.331 7.262 9.777 145 HD13 LEU 19 3HD1 LEU 19 -15.894 6.855 8.131 146 HD21 LEU 19 3HD2 LEU 19 -14.023 3.655 7.708 147 HD22 LEU 19 1HD2 LEU 19 -13.353 5.230 7.155 148 HD23 LEU 19 2HD2 LEU 19 -15.100 4.855 6.913 149 H GLU 20 H GLU 20 -16.357 5.053 11.675 150 HA GLU 20 HA GLU 20 -16.641 7.817 12.037 151 HB2 GLU 20 2HB GLU 20 -18.571 5.523 12.694 152 HB3 GLU 20 1HB GLU 20 -18.951 7.241 13.039 153 HG2 GLU 20 2HG GLU 20 -18.612 7.825 10.630 154 HG3 GLU 20 1HG GLU 20 -18.446 6.081 10.234 155 H GLU 21 H GLU 21 -16.471 5.130 14.407 156 HA GLU 21 HA GLU 21 -16.823 6.681 16.739 157 HB2 GLU 21 2HB GLU 21 -15.374 4.060 16.081 158 HB3 GLU 21 1HB GLU 21 -15.197 4.753 17.711 159 HG2 GLU 21 2HG GLU 21 -18.018 4.280 16.576 160 HG3 GLU 21 1HG GLU 21 -17.042 2.911 17.211 161 H ALA 22 H ALA 22 -13.915 5.700 14.899 162 HA ALA 22 HA ALA 22 -12.047 6.875 16.598 163 HB1 ALA 22 1HB ALA 22 -11.444 5.185 14.830 164 HB2 ALA 22 2HB ALA 22 -10.441 6.680 14.739 165 HB3 ALA 22 3HB ALA 22 -11.784 6.426 13.568 166 H SER 23 H SER 23 -13.996 8.278 14.037 167 HA SER 23 HA SER 23 -12.548 10.627 13.599 168 HB2 SER 23 2HB SER 23 -15.637 10.307 13.595 169 HB3 SER 23 1HB SER 23 -14.697 11.596 12.762 170 HG SER 23 1HG SER 23 -14.553 8.770 12.236 171 H LYS 24 H LYS 24 -14.778 9.688 16.201 172 HA LYS 24 HA LYS 24 -15.164 12.364 17.134 173 HB2 LYS 24 2HB LYS 24 -16.770 10.407 17.512 174 HB3 LYS 24 1HB LYS 24 -15.617 9.739 18.701 175 HG2 LYS 24 2HG LYS 24 -16.713 12.614 18.903 176 HG3 LYS 24 1HG LYS 24 -17.704 11.216 19.426 177 HD2 LYS 24 2HD LYS 24 -16.132 10.577 21.152 178 HD3 LYS 24 1HD LYS 24 -14.913 11.780 20.605 179 HE2 LYS 24 2HE LYS 24 -16.453 13.667 21.162 180 HE3 LYS 24 1HE LYS 24 -17.697 12.490 21.749 181 HZ1 LYS 24 3HZ LYS 24 -16.351 13.479 23.513 182 HZ2 LYS 24 1HZ LYS 24 -14.928 12.765 22.911 183 HZ3 LYS 24 2HZ LYS 24 -16.233 11.825 23.499 184 H LYS 25 H LYS 25 -12.971 9.648 17.692 185 HA LYS 25 HA LYS 25 -11.709 10.746 19.978 186 HB2 LYS 25 2HB LYS 25 -10.472 8.810 17.942 187 HB3 LYS 25 1HB LYS 25 -9.923 9.100 19.622 188 HG2 LYS 25 2HG LYS 25 -12.086 8.054 20.462 189 HG3 LYS 25 1HG LYS 25 -12.593 7.805 18.756 190 HD2 LYS 25 2HD LYS 25 -10.322 6.545 18.445 191 HD3 LYS 25 1HD LYS 25 -10.241 6.465 20.230 192 HE2 LYS 25 2HE LYS 25 -12.520 5.341 18.426 193 HE3 LYS 25 1HE LYS 25 -11.177 4.380 19.159 194 HZ1 LYS 25 3HZ LYS 25 -13.143 4.137 20.376 195 HZ2 LYS 25 1HZ LYS 25 -13.397 5.768 20.607 196 HZ3 LYS 25 2HZ LYS 25 -12.033 4.999 21.362 197 H ALA 26 H ALA 26 -10.919 10.699 16.470 198 HA ALA 26 HA ALA 26 -8.502 11.920 16.515 199 HB1 ALA 26 1HB ALA 26 -10.690 12.300 14.367 200 HB2 ALA 26 2HB ALA 26 -9.626 10.852 14.523 201 HB3 ALA 26 3HB ALA 26 -8.903 12.446 14.146 202 H VAL 27 H VAL 27 -11.710 13.598 16.257 203 HA VAL 27 HA VAL 27 -10.485 16.140 16.039 204 HB VAL 27 HB VAL 27 -12.717 15.728 15.184 205 HG11 VAL 27 1HG1 VAL 27 -14.697 15.487 16.661 206 HG12 VAL 27 2HG1 VAL 27 -13.647 15.439 18.123 207 HG13 VAL 27 3HG1 VAL 27 -13.558 14.124 16.904 208 HG21 VAL 27 3HG2 VAL 27 -12.008 18.038 15.797 209 HG22 VAL 27 1HG2 VAL 27 -12.755 17.853 17.429 210 HG23 VAL 27 2HG2 VAL 27 -13.794 17.799 15.962 211 H GLU 28 H GLU 28 -11.297 14.114 18.803 212 HA GLU 28 HA GLU 28 -11.222 16.257 20.716 213 HB2 GLU 28 2HB GLU 28 -12.564 14.070 20.946 214 HB3 GLU 28 1HB GLU 28 -11.012 13.206 21.140 215 HG2 GLU 28 2HG GLU 28 -10.548 14.565 23.235 216 HG3 GLU 28 1HG GLU 28 -12.143 15.385 23.025 217 H ALA 29 H ALA 29 -9.160 13.664 19.501 218 HA ALA 29 HA ALA 29 -6.995 13.867 21.192 219 HB1 ALA 29 1HB ALA 29 -7.193 12.949 18.235 220 HB2 ALA 29 2HB ALA 29 -7.505 11.917 19.672 221 HB3 ALA 29 3HB ALA 29 -5.871 12.538 19.345 222 H GLU 30 H GLU 30 -7.495 15.123 17.872 223 HA GLU 30 HA GLU 30 -5.184 16.610 17.726 224 HB2 GLU 30 2HB GLU 30 -6.744 15.891 15.832 225 HB3 GLU 30 1HB GLU 30 -7.906 17.134 16.379 226 HG2 GLU 30 2HG GLU 30 -6.795 18.282 14.692 227 HG3 GLU 30 1HG GLU 30 -5.804 18.784 16.099 228 H ARG 31 H ARG 31 -8.543 17.651 18.693 229 HA ARG 31 HA ARG 31 -7.608 20.356 18.794 230 HB2 ARG 31 2HB ARG 31 -9.904 19.663 18.017 231 HB3 ARG 31 1HB ARG 31 -10.272 19.266 19.719 232 HG2 ARG 31 2HG ARG 31 -9.665 21.790 20.222 233 HG3 ARG 31 1HG ARG 31 -9.648 22.030 18.449 234 HD2 ARG 31 2HD ARG 31 -11.883 22.675 19.512 235 HD3 ARG 31 1HD ARG 31 -12.049 21.355 18.298 236 HE ARG 31 HE ARG 31 -12.483 19.810 19.977 237 HH11 ARG 31 1HH2 ARG 31 -11.762 22.928 21.676 238 HH12 ARG 31 2HH2 ARG 31 -11.368 22.168 23.165 239 HH21 ARG 31 1HH1 ARG 31 -11.820 18.808 22.022 240 HH22 ARG 31 2HH1 ARG 31 -11.300 19.755 23.295 241 H GLY 32 H GLY 32 -6.155 20.758 20.386 242 HA2 GLY 32 2HA GLY 32 -6.539 21.586 22.814 243 HA3 GLY 32 1HA GLY 32 -6.552 19.782 23.068 244 H ALA 33 H ALA 33 -4.903 19.408 20.572 245 HA ALA 33 HA ALA 33 -2.475 19.344 21.988 246 HB1 ALA 33 1HB ALA 33 -3.240 17.452 20.538 247 HB2 ALA 33 2HB ALA 33 -1.680 18.110 19.915 248 HB3 ALA 33 3HB ALA 33 -3.222 18.537 19.105 249 HA PRO 34 HA PRO 34 -0.697 22.895 19.964 250 HB2 PRO 34 2HB PRO 34 2.042 22.416 20.225 251 HB3 PRO 34 1HB PRO 34 0.954 22.882 21.587 252 HG2 PRO 34 2HG PRO 34 1.867 20.065 20.804 253 HG3 PRO 34 1HG PRO 34 1.851 20.819 22.450 254 HD2 PRO 34 2HD PRO 34 -0.172 19.157 21.564 255 HD3 PRO 34 1HD PRO 34 -0.537 20.592 22.620 256 H GLY 35 H GLY 35 -1.212 22.938 17.759 257 HA2 GLY 35 2HA GLY 35 -0.071 23.208 15.742 258 HA3 GLY 35 1HA GLY 35 0.748 21.622 15.975 259 H ALA 36 H ALA 36 -2.442 21.632 17.066 260 HA ALA 36 HA ALA 36 -3.520 19.699 15.691 261 HB1 ALA 36 1HB ALA 36 -4.894 22.319 16.599 262 HB2 ALA 36 2HB ALA 36 -4.618 20.851 17.612 263 HB3 ALA 36 3HB ALA 36 -5.784 20.802 16.243 264 H ALA 37 H ALA 37 -4.437 19.182 13.659 265 HA ALA 37 HA ALA 37 -4.690 21.408 11.774 266 HB1 ALA 37 1HB ALA 37 -4.394 19.703 9.998 267 HB2 ALA 37 2HB ALA 37 -4.290 18.418 11.262 268 HB3 ALA 37 3HB ALA 37 -3.003 19.657 11.145 269 H LEU 38 H LEU 38 -6.164 18.163 12.529 270 HA LEU 38 HA LEU 38 -8.461 18.978 10.923 271 HB2 LEU 38 2HB LEU 38 -9.294 16.613 11.357 272 HB3 LEU 38 1HB LEU 38 -7.808 16.802 10.385 273 HG LEU 38 HG LEU 38 -7.121 16.480 13.226 274 HD11 LEU 38 1HD1 LEU 38 -8.827 14.222 12.020 275 HD12 LEU 38 2HD1 LEU 38 -9.246 15.265 13.442 276 HD13 LEU 38 3HD1 LEU 38 -7.832 14.157 13.524 277 HD21 LEU 38 3HD2 LEU 38 -5.745 14.618 12.307 278 HD22 LEU 38 1HD2 LEU 38 -5.517 16.138 11.388 279 HD23 LEU 38 2HD2 LEU 38 -6.525 14.808 10.697 280 H ILE 39 H ILE 39 -9.952 20.293 11.924 281 HA ILE 39 HA ILE 39 -10.827 19.513 14.607 282 HB ILE 39 HB ILE 39 -11.628 21.752 14.915 283 HG12 ILE 39 2HG1 ILE 39 -12.275 22.378 12.581 284 HG13 ILE 39 1HG1 ILE 39 -11.314 23.599 13.453 285 HG21 ILE 39 1HG2 ILE 39 -9.418 22.870 15.070 286 HG22 ILE 39 2HG2 ILE 39 -8.695 21.682 13.930 287 HG23 ILE 39 3HG2 ILE 39 -9.293 21.130 15.530 288 HD11 ILE 39 3HD ILE 39 -10.299 21.811 11.150 289 HD12 ILE 39 1HD ILE 39 -10.575 23.580 11.150 290 HD13 ILE 39 2HD ILE 39 -9.243 22.892 12.137 291 H SER 40 H SER 40 -13.178 20.121 14.988 292 HA SER 40 HA SER 40 -15.284 19.951 14.712 293 HB2 SER 40 2HB SER 40 -14.842 20.321 11.712 294 HB3 SER 40 1HB SER 40 -16.429 20.444 12.548 295 HG SER 40 1HG SER 40 -15.170 22.410 12.154 296 H TYR 41 H TYR 41 -17.028 18.439 14.389 297 HA TYR 41 HA TYR 41 -15.999 15.819 14.041 298 HB2 TYR 41 2HB TYR 41 -17.714 16.333 15.806 299 HB3 TYR 41 1HB TYR 41 -18.931 16.617 14.512 300 HD1 TYR 41 1HD TYR 41 -16.261 13.939 15.143 301 HD2 TYR 41 2HD TYR 41 -20.425 14.827 14.451 302 HE1 TYR 41 1HE TYR 41 -16.783 11.546 15.154 303 HE2 TYR 41 2HE TYR 41 -20.935 12.421 14.479 304 HH TYR 41 HH TYR 41 -18.384 9.925 14.789 305 HA PRO 42 HA PRO 42 -18.680 15.397 10.266 306 HB2 PRO 42 2HB PRO 42 -19.530 17.619 8.725 307 HB3 PRO 42 1HB PRO 42 -20.504 16.868 10.046 308 HG2 PRO 42 2HG PRO 42 -18.626 19.288 10.232 309 HG3 PRO 42 1HG PRO 42 -20.331 19.150 10.835 310 HD2 PRO 42 2HD PRO 42 -18.215 18.787 12.518 311 HD3 PRO 42 1HD PRO 42 -19.648 17.661 12.636 312 H ASP 43 H ASP 43 -16.150 17.731 10.493 313 HA ASP 43 HA ASP 43 -15.242 17.273 7.776 314 HB2 ASP 43 2HB ASP 43 -13.936 18.910 10.034 315 HB3 ASP 43 1HB ASP 43 -13.460 18.875 8.288 316 H ALA 44 H ALA 44 -14.508 16.378 11.184 317 HA ALA 44 HA ALA 44 -12.036 15.188 10.744 318 HB1 ALA 44 1HB ALA 44 -14.167 14.420 12.831 319 HB2 ALA 44 2HB ALA 44 -12.817 15.594 13.055 320 HB3 ALA 44 3HB ALA 44 -12.453 13.853 12.836 321 H ILE 45 H ILE 45 -15.347 13.848 10.472 322 HA ILE 45 HA ILE 45 -14.516 11.229 10.054 323 HB ILE 45 HB ILE 45 -16.744 11.609 10.684 324 HG12 ILE 45 2HG1 ILE 45 -16.723 10.506 7.803 325 HG13 ILE 45 1HG1 ILE 45 -16.341 9.607 9.307 326 HG21 ILE 45 1HG2 ILE 45 -17.070 13.864 9.778 327 HG22 ILE 45 2HG2 ILE 45 -18.406 12.815 9.251 328 HG23 ILE 45 3HG2 ILE 45 -17.103 13.253 8.092 329 HD11 ILE 45 3HD ILE 45 -19.075 10.849 8.543 330 HD12 ILE 45 1HD ILE 45 -18.652 9.106 8.633 331 HD13 ILE 45 2HD ILE 45 -18.708 10.091 10.136 332 H TRP 46 H TRP 46 -14.526 13.943 7.746 333 HA TRP 46 HA TRP 46 -14.347 12.200 5.484 334 HB2 TRP 46 2HB TRP 46 -14.181 15.162 5.940 335 HB3 TRP 46 1HB TRP 46 -13.178 14.576 4.602 336 HD1 TRP 46 HD TRP 46 -14.429 15.647 2.678 337 HE1 TRP 46 1HE TRP 46 -16.817 15.589 1.719 338 HE3 TRP 46 3HE TRP 46 -16.600 12.551 6.134 339 HZ2 TRP 46 2HZ TRP 46 -19.249 14.212 2.241 340 HZ3 TRP 46 3HZ TRP 46 -18.936 11.876 5.835 341 HH2 TRP 46 HH TRP 46 -20.257 12.695 3.914 342 H TRP 47 H TRP 47 -12.052 13.471 7.799 343 HA TRP 47 HA TRP 47 -9.714 12.796 6.243 344 HB2 TRP 47 2HB TRP 47 -9.549 14.628 7.849 345 HB3 TRP 47 1HB TRP 47 -10.205 13.602 9.176 346 HD1 TRP 47 HD TRP 47 -6.871 13.957 7.105 347 HE1 TRP 47 1HE TRP 47 -5.068 12.769 8.375 348 HE3 TRP 47 3HE TRP 47 -9.754 11.911 10.785 349 HZ2 TRP 47 2HZ TRP 47 -4.794 11.333 10.890 350 HZ3 TRP 47 3HZ TRP 47 -8.673 10.521 12.512 351 HH2 TRP 47 HH TRP 47 -6.219 10.295 12.608 352 H SER 48 H SER 48 -11.683 11.403 8.958 353 HA SER 48 HA SER 48 -10.057 9.250 9.417 354 HB2 SER 48 2HB SER 48 -13.119 9.261 9.618 355 HB3 SER 48 1HB SER 48 -11.979 8.195 10.525 356 HG SER 48 1HG SER 48 -12.873 10.169 11.501 357 H VAL 49 H VAL 49 -12.528 9.655 6.845 358 HA VAL 49 HA VAL 49 -12.521 6.896 6.189 359 HB VAL 49 HB VAL 49 -13.281 9.247 4.416 360 HG11 VAL 49 1HG1 VAL 49 -14.611 7.376 3.219 361 HG12 VAL 49 2HG1 VAL 49 -13.689 6.174 4.185 362 HG13 VAL 49 3HG1 VAL 49 -12.832 7.242 3.016 363 HG21 VAL 49 3HG2 VAL 49 -15.046 7.277 6.026 364 HG22 VAL 49 1HG2 VAL 49 -15.608 8.684 5.061 365 HG23 VAL 49 2HG2 VAL 49 -14.688 8.939 6.580 366 H GLU 50 H GLU 50 -10.396 9.652 5.176 367 HA GLU 50 HA GLU 50 -9.006 8.127 3.211 368 HB2 GLU 50 2HB GLU 50 -7.932 10.463 4.944 369 HB3 GLU 50 1HB GLU 50 -7.020 9.622 3.652 370 HG2 GLU 50 2HG GLU 50 -8.819 10.337 1.999 371 HG3 GLU 50 1HG GLU 50 -9.510 11.387 3.301 372 H THR 51 H THR 51 -8.182 9.054 6.566 373 HA THR 51 HA THR 51 -5.984 7.586 6.937 374 HB THR 51 HB THR 51 -8.140 7.989 9.084 375 HG1 THR 51 1HG THR 51 -7.795 9.960 8.082 376 HG21 THR 51 3HG2 THR 51 -5.035 7.901 9.193 377 HG22 THR 51 1HG2 THR 51 -6.138 6.633 9.846 378 HG23 THR 51 2HG2 THR 51 -6.122 8.273 10.581 379 H ALA 52 H ALA 52 -9.322 6.359 7.244 380 HA ALA 52 HA ALA 52 -8.762 3.916 8.432 381 HB1 ALA 52 1HB ALA 52 -11.088 4.820 8.169 382 HB2 ALA 52 2HB ALA 52 -10.972 3.192 7.426 383 HB3 ALA 52 3HB ALA 52 -10.955 4.659 6.382 384 H THR 53 H THR 53 -8.730 4.866 4.932 385 HA THR 53 HA THR 53 -8.027 2.090 4.302 386 HB THR 53 HB THR 53 -9.822 3.148 2.979 387 HG1 THR 53 1HG THR 53 -7.410 2.466 1.698 388 HG21 THR 53 3HG2 THR 53 -7.608 5.086 2.007 389 HG22 THR 53 1HG2 THR 53 -9.087 5.506 2.937 390 HG23 THR 53 2HG2 THR 53 -9.239 4.884 1.264 391 H THR 54 H THR 54 -6.529 4.681 5.527 392 HA THR 54 HA THR 54 -4.569 5.416 5.729 393 HB THR 54 HB THR 54 -2.559 4.192 5.313 394 HG1 THR 54 1HG THR 54 -4.224 2.715 3.580 395 HG21 THR 54 3HG2 THR 54 -3.094 2.210 6.644 396 HG22 THR 54 1HG2 THR 54 -4.810 2.204 6.095 397 HG23 THR 54 2HG2 THR 54 -4.223 3.520 7.158 398 H VAL 55 H VAL 55 -2.604 4.841 3.211 399 HA VAL 55 HA VAL 55 -1.880 6.020 1.561 400 HB VAL 55 HB VAL 55 -4.711 7.027 1.014 401 HG11 VAL 55 1HG1 VAL 55 -3.775 7.361 -1.314 402 HG12 VAL 55 2HG1 VAL 55 -2.138 6.893 -0.705 403 HG13 VAL 55 3HG1 VAL 55 -2.931 8.384 -0.104 404 HG21 VAL 55 3HG2 VAL 55 -4.772 5.110 -0.638 405 HG22 VAL 55 1HG2 VAL 55 -4.696 4.548 1.064 406 HG23 VAL 55 2HG2 VAL 55 -3.214 4.501 0.040 407 H GLY 56 H GLY 56 -4.464 8.213 2.676 408 HA2 GLY 56 2HA GLY 56 -4.366 10.163 3.751 409 HA3 GLY 56 1HA GLY 56 -2.607 9.863 4.104 410 H TYR 57 H TYR 57 -4.964 11.278 1.822 411 HA TYR 57 HA TYR 57 -3.002 11.464 -0.267 412 HB2 TYR 57 2HB TYR 57 -5.456 11.255 -0.798 413 HB3 TYR 57 1HB TYR 57 -5.764 12.834 0.013 414 HD1 TYR 57 2HD TYR 57 -3.654 11.279 -2.759 415 HD2 TYR 57 1HD TYR 57 -5.665 14.775 -1.273 416 HE1 TYR 57 2HE TYR 57 -2.935 12.538 -4.752 417 HE2 TYR 57 1HE TYR 57 -4.906 16.040 -3.245 418 HH TYR 57 HH TYR 57 -2.407 14.864 -5.425 419 H GLY 58 H GLY 58 -4.170 13.473 2.357 420 HA2 GLY 58 2HA GLY 58 -2.310 14.705 3.299 421 HA3 GLY 58 1HA GLY 58 -2.053 15.463 1.693 422 H ASP 59 H ASP 59 -5.383 14.915 2.584 423 HA ASP 59 HA ASP 59 -5.985 17.614 2.472 424 HB2 ASP 59 2HB ASP 59 -7.753 15.855 2.149 425 HB3 ASP 59 1HB ASP 59 -7.661 15.441 3.891 426 H ARG 60 H ARG 60 -5.623 15.496 5.458 427 HA ARG 60 HA ARG 60 -4.668 17.847 6.808 428 HB2 ARG 60 2HB ARG 60 -6.911 16.174 8.110 429 HB3 ARG 60 1HB ARG 60 -5.925 17.435 8.906 430 HG2 ARG 60 2HG ARG 60 -7.535 18.938 8.392 431 HG3 ARG 60 1HG ARG 60 -6.979 18.818 6.708 432 HD2 ARG 60 2HD ARG 60 -9.301 18.405 6.434 433 HD3 ARG 60 1HD ARG 60 -8.652 16.746 6.515 434 HE ARG 60 HE ARG 60 -9.515 16.485 8.696 435 HH11 ARG 60 1HH2 ARG 60 -10.301 19.824 7.469 436 HH12 ARG 60 2HH2 ARG 60 -11.426 20.138 8.689 437 HH21 ARG 60 1HH1 ARG 60 -11.082 17.023 10.415 438 HH22 ARG 60 2HH1 ARG 60 -11.745 18.572 10.558 439 H TYR 61 H TYR 61 -3.593 16.942 9.009 440 HA TYR 61 HA TYR 61 -2.938 14.185 8.762 441 HB2 TYR 61 2HB TYR 61 -0.403 14.850 9.161 442 HB3 TYR 61 1HB TYR 61 -1.029 14.862 7.477 443 HD1 TYR 61 2HD TYR 61 -0.098 17.056 10.364 444 HD2 TYR 61 1HD TYR 61 -1.288 16.877 6.237 445 HE1 TYR 61 2HE TYR 61 0.343 19.464 10.146 446 HE2 TYR 61 1HE TYR 61 -0.853 19.284 5.998 447 HH TYR 61 HH TYR 61 0.434 21.261 8.711 448 HA PRO 62 HA PRO 62 -3.554 15.442 12.954 449 HB2 PRO 62 2HB PRO 62 -2.940 13.160 14.342 450 HB3 PRO 62 1HB PRO 62 -4.264 13.147 13.134 451 HG2 PRO 62 2HG PRO 62 -1.364 12.220 12.743 452 HG3 PRO 62 1HG PRO 62 -2.885 11.331 12.313 453 HD2 PRO 62 2HD PRO 62 -1.410 12.939 10.508 454 HD3 PRO 62 1HD PRO 62 -3.216 12.719 10.371 455 H VAL 63 H VAL 63 -2.435 15.956 15.062 456 HA VAL 63 HA VAL 63 0.450 16.236 14.571 457 HB VAL 63 HB VAL 63 -1.208 18.182 14.960 458 HG11 VAL 63 1HG1 VAL 63 -1.532 18.905 17.263 459 HG12 VAL 63 2HG1 VAL 63 -0.630 17.495 17.917 460 HG13 VAL 63 3HG1 VAL 63 -2.209 17.250 17.080 461 HG21 VAL 63 3HG2 VAL 63 0.638 19.526 15.928 462 HG22 VAL 63 1HG2 VAL 63 1.214 18.417 14.641 463 HG23 VAL 63 2HG2 VAL 63 1.535 18.051 16.376 464 H THR 64 H THR 64 1.682 16.353 16.851 465 HA THR 64 HA THR 64 2.088 13.796 17.412 466 HB THR 64 HB THR 64 3.002 15.925 19.367 467 HG1 THR 64 1HG THR 64 3.409 17.134 17.803 468 HG21 THR 64 3HG2 THR 64 3.919 13.555 19.459 469 HG22 THR 64 1HG2 THR 64 5.189 14.753 19.014 470 HG23 THR 64 2HG2 THR 64 4.450 13.709 17.745 471 H GLU 65 H GLU 65 0.362 16.134 19.549 472 HA GLU 65 HA GLU 65 0.364 14.258 21.724 473 HB2 GLU 65 2HB GLU 65 0.642 16.789 21.943 474 HB3 GLU 65 1HB GLU 65 -1.101 16.942 21.553 475 HG2 GLU 65 2HG GLU 65 -1.689 15.701 23.639 476 HG3 GLU 65 1HG GLU 65 0.064 15.485 24.007 477 H GLU 66 H GLU 66 -1.483 14.316 18.904 478 HA GLU 66 HA GLU 66 -4.054 13.940 19.880 479 HB2 GLU 66 2HB GLU 66 -4.707 13.418 17.739 480 HB3 GLU 66 1HB GLU 66 -3.217 14.277 17.390 481 HG2 GLU 66 2HG GLU 66 -2.571 12.558 16.120 482 HG3 GLU 66 1HG GLU 66 -2.326 11.557 17.538 483 H GLY 67 H GLY 67 -1.239 11.986 19.617 484 HA2 GLY 67 2HA GLY 67 -0.664 10.107 20.789 485 HA3 GLY 67 1HA GLY 67 -2.409 9.876 21.277 486 H ARG 68 H ARG 68 -0.045 9.645 18.549 487 HA ARG 68 HA ARG 68 -1.803 9.276 16.559 488 HB2 ARG 68 2HB ARG 68 0.740 9.559 16.416 489 HB3 ARG 68 1HB ARG 68 0.852 7.819 16.653 490 HG2 ARG 68 2HG ARG 68 -0.536 7.563 14.486 491 HG3 ARG 68 1HG ARG 68 -0.668 9.338 14.395 492 HD2 ARG 68 2HD ARG 68 1.098 8.136 12.861 493 HD3 ARG 68 1HD ARG 68 1.606 9.602 13.762 494 HE ARG 68 HE ARG 68 3.302 8.356 14.562 495 HH11 ARG 68 1HH2 ARG 68 0.619 5.958 14.470 496 HH12 ARG 68 2HH2 ARG 68 1.319 4.852 15.559 497 HH21 ARG 68 1HH1 ARG 68 4.372 6.812 15.765 498 HH22 ARG 68 2HH1 ARG 68 3.630 5.411 16.340 499 H LYS 69 H LYS 69 -1.388 7.123 19.081 500 HA LYS 69 HA LYS 69 -2.089 4.629 18.102 501 HB2 LYS 69 2HB LYS 69 -3.148 6.147 20.571 502 HB3 LYS 69 1HB LYS 69 -3.460 4.415 20.218 503 HG2 LYS 69 2HG LYS 69 -0.999 3.961 20.261 504 HG3 LYS 69 1HG LYS 69 -0.698 5.635 20.860 505 HD2 LYS 69 2HD LYS 69 -1.931 5.182 22.945 506 HD3 LYS 69 1HD LYS 69 -2.747 3.783 22.192 507 HE2 LYS 69 2HE LYS 69 -1.294 2.687 23.594 508 HE3 LYS 69 1HE LYS 69 -0.411 2.626 22.026 509 HZ1 LYS 69 3HZ LYS 69 1.157 3.186 23.565 510 HZ2 LYS 69 1HZ LYS 69 0.153 4.233 24.453 511 HZ3 LYS 69 2HZ LYS 69 0.794 4.727 22.962 512 H VAL 70 H VAL 70 -4.044 7.671 18.363 513 HA VAL 70 HA VAL 70 -6.522 6.390 17.982 514 HB VAL 70 HB VAL 70 -5.612 9.261 17.536 515 HG11 VAL 70 1HG1 VAL 70 -8.073 9.804 17.591 516 HG12 VAL 70 2HG1 VAL 70 -8.451 8.035 17.449 517 HG13 VAL 70 3HG1 VAL 70 -7.584 8.910 16.124 518 HG21 VAL 70 3HG2 VAL 70 -7.144 7.882 19.849 519 HG22 VAL 70 1HG2 VAL 70 -6.777 9.648 19.705 520 HG23 VAL 70 2HG2 VAL 70 -5.438 8.478 19.896 521 H ALA 71 H ALA 71 -4.519 8.367 15.634 522 HA ALA 71 HA ALA 71 -5.859 7.562 13.394 523 HB1 ALA 71 1HB ALA 71 -2.834 8.093 13.621 524 HB2 ALA 71 2HB ALA 71 -4.100 9.350 13.439 525 HB3 ALA 71 3HB ALA 71 -3.816 8.176 12.101 526 H GLU 72 H GLU 72 -3.034 5.978 14.869 527 HA GLU 72 HA GLU 72 -2.470 4.031 12.999 528 HB2 GLU 72 2HB GLU 72 -1.091 4.740 15.025 529 HB3 GLU 72 1HB GLU 72 -2.269 3.898 16.071 530 HG2 GLU 72 2HG GLU 72 -1.554 1.700 14.959 531 HG3 GLU 72 1HG GLU 72 -0.291 2.624 14.062 532 H GLN 73 H GLN 73 -4.843 3.991 15.719 533 HA GLN 73 HA GLN 73 -5.264 1.215 15.500 534 HB2 GLN 73 2HB GLN 73 -5.780 2.647 17.558 535 HB3 GLN 73 1HB GLN 73 -7.269 3.182 16.713 536 HG2 GLN 73 2HG GLN 73 -7.952 0.689 16.600 537 HG3 GLN 73 1HG GLN 73 -6.442 0.289 17.493 538 HE21 GLN 73 1HE2 GLN 73 -9.734 0.871 17.946 539 HE22 GLN 73 2HE2 GLN 73 -9.733 1.408 19.581 540 H VAL 74 H VAL 74 -6.666 4.013 13.798 541 HA VAL 74 HA VAL 74 -8.877 2.528 12.771 542 HB VAL 74 HB VAL 74 -7.739 4.892 11.229 543 HG11 VAL 74 1HG1 VAL 74 -9.786 3.607 10.447 544 HG12 VAL 74 2HG1 VAL 74 -10.160 5.317 10.866 545 HG13 VAL 74 3HG1 VAL 74 -10.604 3.988 12.006 546 HG21 VAL 74 3HG2 VAL 74 -9.049 5.039 14.012 547 HG22 VAL 74 1HG2 VAL 74 -9.040 6.406 12.825 548 HG23 VAL 74 2HG2 VAL 74 -7.499 5.763 13.445 549 H MET 75 H MET 75 -5.580 3.362 11.700 550 HA MET 75 HA MET 75 -5.689 2.470 9.100 551 HB2 MET 75 2HB MET 75 -3.301 2.282 11.042 552 HB3 MET 75 1HB MET 75 -3.196 2.115 9.259 553 HG2 MET 75 2HG MET 75 -3.892 4.443 8.924 554 HG3 MET 75 1HG MET 75 -4.231 4.654 10.644 555 HE1 MET 75 3HE MET 75 -1.207 7.010 9.897 556 HE2 MET 75 1HE MET 75 -2.897 6.866 10.499 557 HE3 MET 75 2HE MET 75 -2.519 6.525 8.777 558 H LYS 76 H LYS 76 -4.760 0.578 12.065 559 HA LYS 76 HA LYS 76 -4.301 -1.744 10.535 560 HB2 LYS 76 2HB LYS 76 -3.525 -1.369 13.008 561 HB3 LYS 76 1HB LYS 76 -5.148 -2.003 13.454 562 HG2 LYS 76 2HG LYS 76 -4.556 -4.023 11.849 563 HG3 LYS 76 1HG LYS 76 -2.895 -3.364 11.835 564 HD2 LYS 76 2HD LYS 76 -2.802 -3.714 14.359 565 HD3 LYS 76 1HD LYS 76 -4.456 -4.437 14.268 566 HE2 LYS 76 2HE LYS 76 -3.537 -6.193 12.634 567 HE3 LYS 76 1HE LYS 76 -1.886 -5.504 12.889 568 HZ1 LYS 76 3HZ LYS 76 -2.055 -7.337 14.308 569 HZ2 LYS 76 1HZ LYS 76 -3.618 -6.910 14.869 570 HZ3 LYS 76 2HZ LYS 76 -2.232 -6.014 15.315 571 H ALA 77 H ALA 77 -7.271 -0.466 12.060 572 HA ALA 77 HA ALA 77 -8.776 -2.846 11.780 573 HB1 ALA 77 1HB ALA 77 -10.785 -1.382 12.077 574 HB2 ALA 77 2HB ALA 77 -9.760 0.082 11.823 575 HB3 ALA 77 3HB ALA 77 -9.511 -0.949 13.279 576 H GLY 78 H GLY 78 -8.155 -0.049 9.638 577 HA2 GLY 78 2HA GLY 78 -10.029 -0.841 7.669 578 HA3 GLY 78 1HA GLY 78 -8.656 0.316 7.525 579 H ILE 79 H ILE 79 -6.531 -1.426 8.127 580 HA ILE 79 HA ILE 79 -6.327 -2.773 5.644 581 HB ILE 79 HB ILE 79 -4.532 -2.736 8.088 582 HG12 ILE 79 2HG1 ILE 79 -4.414 -1.377 5.305 583 HG13 ILE 79 1HG1 ILE 79 -4.913 -0.563 6.813 584 HG21 ILE 79 1HG2 ILE 79 -4.134 -4.873 6.798 585 HG22 ILE 79 2HG2 ILE 79 -2.777 -3.731 6.547 586 HG23 ILE 79 3HG2 ILE 79 -4.025 -3.930 5.269 587 HD11 ILE 79 3HD ILE 79 -2.108 -1.679 6.193 588 HD12 ILE 79 1HD ILE 79 -2.600 0.039 6.320 589 HD13 ILE 79 2HD ILE 79 -2.610 -1.005 7.792 590 H GLU 80 H GLU 80 -7.167 -3.911 8.995 591 HA GLU 80 HA GLU 80 -6.948 -6.605 8.329 592 HB2 GLU 80 2HB GLU 80 -8.721 -5.365 10.497 593 HB3 GLU 80 1HB GLU 80 -8.653 -7.125 10.152 594 HG2 GLU 80 2HG GLU 80 -6.069 -6.930 10.395 595 HG3 GLU 80 1HG GLU 80 -6.387 -5.382 11.246 596 H VAL 81 H VAL 81 -9.739 -4.401 7.763 597 HA VAL 81 HA VAL 81 -11.409 -6.590 7.103 598 HB VAL 81 HB VAL 81 -12.940 -4.966 6.068 599 HG11 VAL 81 1HG1 VAL 81 -13.001 -5.579 8.505 600 HG12 VAL 81 2HG1 VAL 81 -13.478 -3.862 8.255 601 HG13 VAL 81 3HG1 VAL 81 -11.839 -4.252 8.882 602 HG21 VAL 81 3HG2 VAL 81 -10.998 -2.777 7.008 603 HG22 VAL 81 1HG2 VAL 81 -12.537 -2.605 6.091 604 HG23 VAL 81 2HG2 VAL 81 -11.110 -3.295 5.287 605 H PHE 82 H PHE 82 -9.190 -4.566 5.143 606 HA PHE 82 HA PHE 82 -10.140 -5.771 2.719 607 HB2 PHE 82 2HB PHE 82 -7.612 -4.084 3.180 608 HB3 PHE 82 1HB PHE 82 -8.314 -4.526 1.574 609 HD1 PHE 82 2HD PHE 82 -11.314 -4.087 2.168 610 HD2 PHE 82 1HD PHE 82 -7.827 -1.751 3.161 611 HE1 PHE 82 2HE PHE 82 -12.709 -2.080 2.365 612 HE2 PHE 82 1HE PHE 82 -9.231 0.263 3.301 613 HZ PHE 82 HZ PHE 82 -11.678 0.112 2.931 614 H ALA 83 H ALA 83 -7.517 -6.405 5.024 615 HA ALA 83 HA ALA 83 -6.143 -8.265 3.458 616 HB1 ALA 83 1HB ALA 83 -5.231 -7.383 5.629 617 HB2 ALA 83 2HB ALA 83 -5.272 -9.183 5.622 618 HB3 ALA 83 3HB ALA 83 -6.532 -8.252 6.521 619 H LEU 84 H LEU 84 -9.037 -8.591 5.537 620 HA LEU 84 HA LEU 84 -9.193 -11.378 5.502 621 HB2 LEU 84 2HB LEU 84 -10.354 -9.754 7.045 622 HB3 LEU 84 1HB LEU 84 -11.497 -9.336 5.739 623 HG LEU 84 HG LEU 84 -11.176 -12.258 6.606 624 HD11 LEU 84 1HD1 LEU 84 -11.317 -11.015 8.751 625 HD12 LEU 84 2HD1 LEU 84 -12.825 -11.953 8.447 626 HD13 LEU 84 3HD1 LEU 84 -12.807 -10.168 8.187 627 HD21 LEU 84 3HD2 LEU 84 -12.759 -11.799 4.712 628 HD22 LEU 84 1HD2 LEU 84 -13.660 -10.622 5.736 629 HD23 LEU 84 2HD2 LEU 84 -13.638 -12.373 6.165 630 H VAL 85 H VAL 85 -10.186 -8.960 3.115 631 HA VAL 85 HA VAL 85 -11.973 -10.519 1.627 632 HB VAL 85 HB VAL 85 -10.191 -8.187 0.750 633 HG11 VAL 85 1HG1 VAL 85 -10.922 -9.250 -1.312 634 HG12 VAL 85 2HG1 VAL 85 -11.973 -7.827 -1.045 635 HG13 VAL 85 3HG1 VAL 85 -12.596 -9.484 -0.688 636 HG21 VAL 85 3HG2 VAL 85 -12.290 -6.838 1.114 637 HG22 VAL 85 1HG2 VAL 85 -11.733 -7.615 2.620 638 HG23 VAL 85 2HG2 VAL 85 -13.127 -8.304 1.739 639 H THR 86 H THR 86 -8.581 -10.899 2.051 640 HA THR 86 HA THR 86 -7.699 -11.883 -0.333 641 HB THR 86 HB THR 86 -6.406 -11.496 1.781 642 HG1 THR 86 1HG THR 86 -6.092 -14.037 0.579 643 HG21 THR 86 3HG2 THR 86 -7.300 -14.322 2.695 644 HG22 THR 86 1HG2 THR 86 -8.193 -12.842 3.202 645 HG23 THR 86 2HG2 THR 86 -6.492 -12.999 3.618 646 H ALA 87 H ALA 87 -10.028 -13.348 1.907 647 HA ALA 87 HA ALA 87 -9.719 -16.010 1.029 648 HB1 ALA 87 1HB ALA 87 -12.186 -14.616 2.264 649 HB2 ALA 87 2HB ALA 87 -10.884 -15.449 3.181 650 HB3 ALA 87 3HB ALA 87 -11.966 -16.399 2.104 651 H ALA 88 H ALA 88 -11.126 -13.187 -0.418 652 HA ALA 88 HA ALA 88 -12.689 -14.724 -2.342 653 HB1 ALA 88 1HB ALA 88 -12.031 -11.698 -2.254 654 HB2 ALA 88 2HB ALA 88 -13.564 -12.423 -1.665 655 HB3 ALA 88 3HB ALA 88 -13.132 -12.501 -3.417 656 H LEU 89 H LEU 89 -9.799 -12.614 -2.116 657 HA LEU 89 HA LEU 89 -9.215 -12.715 -4.811 658 HB2 LEU 89 2HB LEU 89 -7.257 -12.179 -2.505 659 HB3 LEU 89 1HB LEU 89 -7.011 -11.729 -4.220 660 HG LEU 89 HG LEU 89 -9.287 -10.649 -2.437 661 HD11 LEU 89 1HD1 LEU 89 -7.987 -8.543 -2.319 662 HD12 LEU 89 2HD1 LEU 89 -6.646 -9.286 -3.261 663 HD13 LEU 89 3HD1 LEU 89 -7.042 -9.904 -1.619 664 HD21 LEU 89 3HD2 LEU 89 -9.557 -8.926 -4.238 665 HD22 LEU 89 1HD2 LEU 89 -9.882 -10.579 -4.873 666 HD23 LEU 89 2HD2 LEU 89 -8.313 -9.761 -5.231 667 H ALA 90 H ALA 90 -7.715 -14.651 -2.144 668 HA ALA 90 HA ALA 90 -5.902 -15.913 -3.960 669 HB1 ALA 90 1HB ALA 90 -6.732 -16.713 -1.103 670 HB2 ALA 90 2HB ALA 90 -5.323 -15.673 -1.545 671 HB3 ALA 90 3HB ALA 90 -5.344 -17.401 -2.035 672 H THR 91 H THR 91 -9.264 -16.319 -3.325 673 HA THR 91 HA THR 91 -9.313 -19.117 -4.142 674 HB THR 91 HB THR 91 -11.673 -17.137 -3.915 675 HG1 THR 91 1HG THR 91 -11.157 -17.458 -1.872 676 HG21 THR 91 3HG2 THR 91 -11.540 -20.226 -4.177 677 HG22 THR 91 1HG2 THR 91 -12.276 -19.087 -5.363 678 HG23 THR 91 2HG2 THR 91 -13.036 -19.306 -3.756 679 H ASP 92 H ASP 92 -9.367 -15.830 -5.539 680 HA ASP 92 HA ASP 92 -11.316 -16.339 -7.399 681 HB2 ASP 92 2HB ASP 92 -9.989 -14.050 -6.640 682 HB3 ASP 92 1HB ASP 92 -9.280 -14.275 -8.270 683 H PHE 93 H PHE 93 -7.868 -16.921 -7.571 684 HA PHE 93 HA PHE 93 -7.695 -17.344 -10.322 685 HB2 PHE 93 2HB PHE 93 -5.526 -18.112 -10.045 686 HB3 PHE 93 1HB PHE 93 -5.743 -17.164 -8.543 687 HD1 PHE 93 2HD PHE 93 -6.139 -18.366 -6.380 688 HD2 PHE 93 1HD PHE 93 -5.141 -20.480 -9.970 689 HE1 PHE 93 2HE PHE 93 -5.457 -20.317 -5.030 690 HE2 PHE 93 1HE PHE 93 -4.436 -22.441 -8.624 691 HZ PHE 93 HZ PHE 93 -4.583 -22.358 -6.148 692 H VAL 94 H VAL 94 -9.007 -19.419 -7.786 693 HA VAL 94 HA VAL 94 -8.480 -21.890 -8.984 694 HB VAL 94 HB VAL 94 -10.684 -21.149 -6.994 695 HG11 VAL 94 1HG1 VAL 94 -11.101 -23.396 -8.004 696 HG12 VAL 94 2HG1 VAL 94 -10.503 -23.589 -6.325 697 HG13 VAL 94 3HG1 VAL 94 -9.389 -23.875 -7.711 698 HG21 VAL 94 3HG2 VAL 94 -7.765 -22.107 -6.572 699 HG22 VAL 94 1HG2 VAL 94 -8.998 -21.916 -5.273 700 HG23 VAL 94 2HG2 VAL 94 -8.404 -20.479 -6.158 701 H ARG 95 H ARG 95 -10.840 -19.398 -9.594 702 HA ARG 95 HA ARG 95 -12.826 -20.886 -10.889 703 HB2 ARG 95 2HB ARG 95 -11.809 -18.028 -11.397 704 HB3 ARG 95 1HB ARG 95 -13.243 -18.732 -12.221 705 HG2 ARG 95 2HG ARG 95 -14.421 -19.030 -10.105 706 HG3 ARG 95 1HG ARG 95 -13.016 -18.387 -9.171 707 HD2 ARG 95 2HD ARG 95 -13.215 -16.180 -10.140 708 HD3 ARG 95 1HD ARG 95 -14.380 -16.735 -11.402 709 HE ARG 95 HE ARG 95 -16.005 -17.284 -9.541 710 HH11 ARG 95 1HH2 ARG 95 -13.533 -14.564 -9.124 711 HH12 ARG 95 2HH2 ARG 95 -14.657 -13.498 -8.501 712 HH21 ARG 95 1HH1 ARG 95 -17.435 -15.817 -8.371 713 HH22 ARG 95 2HH1 ARG 95 -16.858 -14.295 -7.798 714 H ARG 96 H ARG 96 -9.516 -20.113 -11.922 715 HA ARG 96 HA ARG 96 -10.076 -20.208 -14.674 716 HB2 ARG 96 2HB ARG 96 -7.800 -20.280 -15.171 717 HB3 ARG 96 1HB ARG 96 -7.907 -19.283 -13.682 718 HG2 ARG 96 2HG ARG 96 -7.183 -21.336 -12.344 719 HG3 ARG 96 1HG ARG 96 -7.115 -22.258 -13.881 720 HD2 ARG 96 2HD ARG 96 -5.314 -20.662 -14.742 721 HD3 ARG 96 1HD ARG 96 -5.297 -19.887 -13.101 722 HE ARG 96 HE ARG 96 -4.237 -21.792 -12.226 723 HH11 ARG 96 1HH2 ARG 96 -4.972 -22.501 -15.716 724 HH12 ARG 96 2HH2 ARG 96 -4.391 -24.040 -15.606 725 HH21 ARG 96 1HH1 ARG 96 -4.222 -24.225 -12.024 726 HH22 ARG 96 2HH1 ARG 96 -4.834 -25.108 -13.337 727 H GLU 97 H GLU 97 -9.755 -22.786 -12.234 728 HA GLU 97 HA GLU 97 -9.185 -24.776 -14.239 729 HB2 GLU 97 2HB GLU 97 -9.931 -24.970 -11.297 730 HB3 GLU 97 1HB GLU 97 -9.852 -26.423 -12.343 731 HG2 GLU 97 2HG GLU 97 -7.453 -24.501 -12.041 732 HG3 GLU 97 1HG GLU 97 -7.753 -25.915 -10.964 733 H GLU 98 H GLU 98 -12.074 -23.179 -13.017 734 HA GLU 98 HA GLU 98 -13.825 -25.249 -13.953 735 HB2 GLU 98 2HB GLU 98 -14.551 -22.341 -13.290 736 HB3 GLU 98 1HB GLU 98 -15.643 -23.762 -13.403 737 HG2 GLU 98 2HG GLU 98 -14.252 -24.816 -11.466 738 HG3 GLU 98 1HG GLU 98 -13.439 -23.219 -11.289 739 H GLU 99 H GLU 99 -12.578 -22.087 -15.146 740 HA GLU 99 HA GLU 99 -14.050 -22.233 -17.557 741 HB2 GLU 99 2HB GLU 99 -13.115 -20.091 -16.549 742 HB3 GLU 99 1HB GLU 99 -11.493 -20.609 -17.110 743 HG2 GLU 99 2HG GLU 99 -12.479 -18.986 -18.677 744 HG3 GLU 99 1HG GLU 99 -12.350 -20.572 -19.509 745 H ARG 100 H ARG 100 -10.838 -23.438 -16.579 746 HA ARG 100 HA ARG 100 -9.891 -23.975 -19.135 747 HB2 ARG 100 2HB ARG 100 -8.571 -23.975 -16.939 748 HB3 ARG 100 1HB ARG 100 -9.261 -25.598 -16.607 749 HG2 ARG 100 2HG ARG 100 -8.147 -26.397 -18.768 750 HG3 ARG 100 1HG ARG 100 -7.507 -24.741 -19.014 751 HD2 ARG 100 2HD ARG 100 -5.745 -26.225 -17.990 752 HD3 ARG 100 1HD ARG 100 -6.201 -24.878 -16.884 753 HE ARG 100 HE ARG 100 -6.863 -26.443 -15.338 754 HH11 ARG 100 1HH2 ARG 100 -6.616 -28.097 -18.488 755 HH12 ARG 100 2HH2 ARG 100 -7.059 -29.643 -17.945 756 HH21 ARG 100 1HH1 ARG 100 -7.543 -28.455 -14.507 757 HH22 ARG 100 2HH1 ARG 100 -7.372 -29.899 -15.439 758 H ARG 101 H ARG 101 -12.123 -25.816 -17.055 759 HA ARG 101 HA ARG 101 -12.060 -28.143 -18.747 760 HB2 ARG 101 2HB ARG 101 -14.172 -27.217 -16.712 761 HB3 ARG 101 1HB ARG 101 -14.202 -28.790 -17.590 762 HG2 ARG 101 2HG ARG 101 -12.015 -29.424 -16.547 763 HG3 ARG 101 1HG ARG 101 -11.998 -27.871 -15.645 764 HD2 ARG 101 2HD ARG 101 -14.201 -28.569 -14.509 765 HD3 ARG 101 1HD ARG 101 -14.066 -30.155 -15.384 766 HE ARG 101 HE ARG 101 -11.715 -29.340 -13.735 767 HH11 ARG 101 1HH2 ARG 101 -14.919 -31.068 -13.683 768 HH12 ARG 101 2HH2 ARG 101 -14.459 -32.148 -12.437 769 HH21 ARG 101 1HH1 ARG 101 -11.196 -30.760 -11.802 770 HH22 ARG 101 2HH1 ARG 101 -12.349 -31.872 -11.285 771 H GLY 102 H GLY 102 -14.004 -25.143 -18.507 772 HA2 GLY 102 2HA GLY 102 -14.992 -24.055 -20.194 773 HA3 GLY 102 1HA GLY 102 -14.671 -25.440 -21.300 774 H HIS 103 H HIS 103 -16.215 -25.895 -18.187 775 HA HIS 103 HA HIS 103 -18.214 -26.615 -17.581 776 HB2 HIS 103 2HB HIS 103 -19.348 -25.059 -19.973 777 HB3 HIS 103 1HB HIS 103 -20.336 -25.818 -18.687 778 HD1 HIS 103 1HD HIS 103 -20.682 -24.448 -16.515 779 HD2 HIS 103 2HD HIS 103 -17.797 -22.739 -19.100 780 HE1 HIS 103 1HE HIS 103 -20.073 -22.192 -15.591 781 HE2 HIS 103 2HE HIS 103 -18.341 -21.171 -17.163 782 H1 SER 1 H SER 1 1.818 -13.043 -18.982 783 HA SER 1 HA SER 1 0.979 -13.159 -21.700 784 HB2 SER 1 2HB SER 1 3.379 -13.504 -20.871 785 HB3 SER 1 1HB SER 1 2.862 -15.067 -20.156 786 HG SER 1 1HG SER 1 3.846 -15.053 -22.302 787 H ALA 2 H ALA 2 0.766 -15.253 -18.791 788 HA ALA 2 HA ALA 2 -0.821 -17.189 -20.227 789 HB1 ALA 2 1HB ALA 2 -0.146 -17.126 -17.221 790 HB2 ALA 2 2HB ALA 2 0.808 -17.975 -18.486 791 HB3 ALA 2 3HB ALA 2 -0.864 -18.512 -18.129 792 H ASP 3 H ASP 3 -2.866 -18.052 -18.941 793 HA ASP 3 HA ASP 3 -4.894 -16.486 -19.447 794 HB2 ASP 3 2HB ASP 3 -4.883 -18.462 -17.049 795 HB3 ASP 3 1HB ASP 3 -6.300 -17.964 -18.031 796 H HIS 4 H HIS 4 -3.486 -16.958 -16.254 797 HA HIS 4 HA HIS 4 -5.347 -15.265 -14.907 798 HB2 HIS 4 2HB HIS 4 -3.827 -15.541 -12.890 799 HB3 HIS 4 1HB HIS 4 -4.410 -17.062 -13.615 800 HD1 HIS 4 1HD HIS 4 -1.053 -14.939 -13.688 801 HD2 HIS 4 2HD HIS 4 -2.442 -18.886 -14.420 802 HE1 HIS 4 1HE HIS 4 0.882 -16.335 -13.955 803 HE2 HIS 4 2HE HIS 4 0.131 -18.669 -14.545 804 H GLU 5 H GLU 5 -2.457 -14.591 -16.722 805 HA GLU 5 HA GLU 5 -1.703 -12.302 -15.130 806 HB2 GLU 5 2HB GLU 5 -0.766 -13.030 -17.944 807 HB3 GLU 5 1HB GLU 5 0.107 -12.046 -16.727 808 HG2 GLU 5 2HG GLU 5 -0.488 -15.087 -16.407 809 HG3 GLU 5 1HG GLU 5 0.935 -14.436 -17.246 810 H ARG 6 H ARG 6 -3.503 -13.222 -18.059 811 HA ARG 6 HA ARG 6 -3.765 -10.577 -19.044 812 HB2 ARG 6 2HB ARG 6 -5.338 -13.138 -19.654 813 HB3 ARG 6 1HB ARG 6 -5.532 -11.581 -20.540 814 HG2 ARG 6 2HG ARG 6 -3.122 -11.589 -21.142 815 HG3 ARG 6 1HG ARG 6 -2.874 -13.155 -20.312 816 HD2 ARG 6 2HD ARG 6 -4.249 -14.375 -21.905 817 HD3 ARG 6 1HD ARG 6 -4.886 -12.868 -22.651 818 HE ARG 6 HE ARG 6 -2.226 -14.118 -23.066 819 HH11 ARG 6 1HH2 ARG 6 -3.850 -10.934 -23.108 820 HH12 ARG 6 2HH2 ARG 6 -3.097 -10.311 -24.459 821 HH21 ARG 6 1HH1 ARG 6 -1.485 -13.458 -25.348 822 HH22 ARG 6 2HH1 ARG 6 -1.691 -11.836 -25.811 823 H GLU 7 H GLU 7 -5.508 -12.462 -16.652 824 HA GLU 7 HA GLU 7 -7.828 -10.887 -16.457 825 HB2 GLU 7 2HB GLU 7 -7.212 -13.197 -15.307 826 HB3 GLU 7 1HB GLU 7 -6.357 -12.218 -14.092 827 HG2 GLU 7 2HG GLU 7 -8.434 -12.574 -13.068 828 HG3 GLU 7 1HG GLU 7 -8.690 -10.948 -13.794 829 H ALA 8 H ALA 8 -4.661 -10.802 -14.812 830 HA ALA 8 HA ALA 8 -5.117 -8.555 -13.217 831 HB1 ALA 8 1HB ALA 8 -3.255 -10.176 -12.755 832 HB2 ALA 8 2HB ALA 8 -2.590 -8.517 -12.982 833 HB3 ALA 8 3HB ALA 8 -2.464 -9.721 -14.308 834 H GLN 9 H GLN 9 -3.518 -8.929 -16.421 835 HA GLN 9 HA GLN 9 -2.793 -6.268 -16.732 836 HB2 GLN 9 2HB GLN 9 -1.993 -8.201 -18.203 837 HB3 GLN 9 1HB GLN 9 -3.602 -8.191 -19.002 838 HG2 GLN 9 2HG GLN 9 -3.167 -5.791 -19.752 839 HG3 GLN 9 1HG GLN 9 -1.547 -5.874 -18.978 840 HE21 GLN 9 1HE2 GLN 9 -0.010 -6.100 -20.650 841 HE22 GLN 9 2HE2 GLN 9 -0.213 -7.079 -22.047 842 H LYS 10 H LYS 10 -5.906 -7.914 -17.497 843 HA LYS 10 HA LYS 10 -6.976 -5.741 -18.935 844 HB2 LYS 10 2HB LYS 10 -7.826 -8.202 -18.893 845 HB3 LYS 10 1HB LYS 10 -8.569 -7.807 -17.313 846 HG2 LYS 10 2HG LYS 10 -9.701 -5.805 -18.751 847 HG3 LYS 10 1HG LYS 10 -9.288 -6.850 -20.142 848 HD2 LYS 10 2HD LYS 10 -10.628 -8.721 -19.071 849 HD3 LYS 10 1HD LYS 10 -10.909 -7.655 -17.645 850 HE2 LYS 10 2HE LYS 10 -12.073 -5.985 -19.263 851 HE3 LYS 10 1HE LYS 10 -12.043 -7.300 -20.506 852 HZ1 LYS 10 3HZ LYS 10 -13.307 -7.349 -17.809 853 HZ2 LYS 10 1HZ LYS 10 -13.281 -8.695 -18.846 854 HZ3 LYS 10 2HZ LYS 10 -14.125 -7.245 -19.270 855 H ALA 11 H ALA 11 -6.634 -6.407 -15.491 856 HA ALA 11 HA ALA 11 -8.701 -4.666 -14.609 857 HB1 ALA 11 1HB ALA 11 -7.696 -4.881 -12.361 858 HB2 ALA 11 2HB ALA 11 -6.198 -5.588 -13.063 859 HB3 ALA 11 3HB ALA 11 -7.748 -6.500 -13.149 860 H GLU 12 H GLU 12 -5.236 -4.321 -15.375 861 HA GLU 12 HA GLU 12 -4.745 -1.812 -14.327 862 HB2 GLU 12 2HB GLU 12 -3.709 -3.102 -16.927 863 HB3 GLU 12 1HB GLU 12 -2.999 -1.641 -16.219 864 HG2 GLU 12 2HG GLU 12 -3.185 -4.150 -14.439 865 HG3 GLU 12 1HG GLU 12 -1.968 -4.095 -15.769 866 H GLU 13 H GLU 13 -6.223 -2.790 -17.398 867 HA GLU 13 HA GLU 13 -6.328 -0.303 -18.678 868 HB2 GLU 13 2HB GLU 13 -8.306 -2.622 -18.962 869 HB3 GLU 13 1HB GLU 13 -7.991 -1.332 -20.172 870 HG2 GLU 13 2HG GLU 13 -5.817 -3.365 -19.293 871 HG3 GLU 13 1HG GLU 13 -7.029 -3.706 -20.561 872 H GLU 14 H GLU 14 -8.283 -1.832 -16.210 873 HA GLU 14 HA GLU 14 -10.625 -0.335 -16.661 874 HB2 GLU 14 2HB GLU 14 -10.332 -2.672 -15.531 875 HB3 GLU 14 1HB GLU 14 -9.892 -1.772 -14.054 876 HG2 GLU 14 2HG GLU 14 -12.272 -2.533 -14.073 877 HG3 GLU 14 1HG GLU 14 -12.139 -0.739 -13.978 878 H LEU 15 H LEU 15 -7.840 -0.116 -14.456 879 HA LEU 15 HA LEU 15 -8.781 2.002 -12.926 880 HB2 LEU 15 2HB LEU 15 -6.816 0.558 -12.312 881 HB3 LEU 15 1HB LEU 15 -5.857 1.316 -13.619 882 HG LEU 15 HG LEU 15 -5.927 3.500 -12.459 883 HD11 LEU 15 1HD1 LEU 15 -6.941 3.651 -10.106 884 HD12 LEU 15 2HD1 LEU 15 -7.790 2.100 -10.441 885 HD13 LEU 15 3HD1 LEU 15 -8.137 3.563 -11.437 886 HD21 LEU 15 3HD2 LEU 15 -4.613 2.887 -10.412 887 HD22 LEU 15 1HD2 LEU 15 -4.131 1.911 -11.846 888 HD23 LEU 15 2HD2 LEU 15 -5.161 1.181 -10.567 889 H GLN 16 H GLN 16 -7.000 1.964 -16.004 890 HA GLN 16 HA GLN 16 -6.375 4.693 -16.046 891 HB2 GLN 16 2HB GLN 16 -6.723 2.669 -18.319 892 HB3 GLN 16 1HB GLN 16 -6.090 4.335 -18.565 893 HG2 GLN 16 2HG GLN 16 -4.126 3.933 -17.192 894 HG3 GLN 16 1HG GLN 16 -4.751 2.357 -16.601 895 HE21 GLN 16 1HE2 GLN 16 -4.658 0.514 -17.971 896 HE22 GLN 16 2HE2 GLN 16 -4.021 0.491 -19.567 897 H LYS 17 H LYS 17 -9.397 3.002 -16.850 898 HA LYS 17 HA LYS 17 -10.481 5.269 -18.252 899 HB2 LYS 17 2HB LYS 17 -11.835 2.807 -17.042 900 HB3 LYS 17 1HB LYS 17 -12.689 4.069 -18.002 901 HG2 LYS 17 2HG LYS 17 -11.338 3.620 -19.987 902 HG3 LYS 17 1HG LYS 17 -10.334 2.409 -19.124 903 HD2 LYS 17 2HD LYS 17 -13.380 2.144 -19.456 904 HD3 LYS 17 1HD LYS 17 -12.212 1.503 -20.667 905 HE2 LYS 17 2HE LYS 17 -11.255 -0.102 -19.103 906 HE3 LYS 17 1HE LYS 17 -12.006 0.745 -17.697 907 HZ1 LYS 17 3HZ LYS 17 -13.134 -1.210 -18.063 908 HZ2 LYS 17 1HZ LYS 17 -13.492 -0.867 -19.712 909 HZ3 LYS 17 2HZ LYS 17 -14.148 0.079 -18.434 910 H VAL 18 H VAL 18 -10.309 4.188 -14.872 911 HA VAL 18 HA VAL 18 -12.373 5.874 -13.920 912 HB VAL 18 HB VAL 18 -9.949 4.744 -12.421 913 HG11 VAL 18 1HG1 VAL 18 -10.981 6.636 -11.165 914 HG12 VAL 18 2HG1 VAL 18 -11.406 5.081 -10.381 915 HG13 VAL 18 3HG1 VAL 18 -12.625 5.934 -11.402 916 HG21 VAL 18 3HG2 VAL 18 -11.600 2.972 -11.694 917 HG22 VAL 18 1HG2 VAL 18 -11.333 2.937 -13.463 918 HG23 VAL 18 2HG2 VAL 18 -12.836 3.675 -12.803 919 H LEU 19 H LEU 19 -8.847 6.249 -14.454 920 HA LEU 19 HA LEU 19 -8.481 8.717 -13.296 921 HB2 LEU 19 2HB LEU 19 -7.272 7.706 -15.951 922 HB3 LEU 19 1HB LEU 19 -6.677 9.132 -15.048 923 HG LEU 19 HG LEU 19 -6.667 6.256 -13.952 924 HD11 LEU 19 1HD1 LEU 19 -4.224 6.303 -14.378 925 HD12 LEU 19 2HD1 LEU 19 -4.352 7.946 -15.110 926 HD13 LEU 19 3HD1 LEU 19 -5.125 6.539 -15.923 927 HD21 LEU 19 3HD2 LEU 19 -6.736 7.899 -12.106 928 HD22 LEU 19 1HD2 LEU 19 -5.494 8.917 -12.912 929 HD23 LEU 19 2HD2 LEU 19 -5.047 7.300 -12.274 930 H GLU 20 H GLU 20 -9.668 7.930 -16.590 931 HA GLU 20 HA GLU 20 -9.717 10.597 -17.471 932 HB2 GLU 20 2HB GLU 20 -11.374 8.244 -18.575 933 HB3 GLU 20 1HB GLU 20 -11.128 9.847 -19.346 934 HG2 GLU 20 2HG GLU 20 -8.559 9.296 -19.250 935 HG3 GLU 20 1HG GLU 20 -9.063 7.599 -18.929 936 H GLU 21 H GLU 21 -12.360 8.445 -16.161 937 HA GLU 21 HA GLU 21 -14.204 10.606 -16.412 938 HB2 GLU 21 2HB GLU 21 -14.597 8.008 -14.857 939 HB3 GLU 21 1HB GLU 21 -15.838 9.270 -15.176 940 HG2 GLU 21 2HG GLU 21 -15.315 8.945 -17.716 941 HG3 GLU 21 1HG GLU 21 -14.433 7.452 -17.230 942 H ALA 22 H ALA 22 -11.929 9.653 -13.891 943 HA ALA 22 HA ALA 22 -13.079 11.196 -11.844 944 HB1 ALA 22 1HB ALA 22 -10.789 11.074 -10.779 945 HB2 ALA 22 2HB ALA 22 -10.198 10.296 -12.299 946 HB3 ALA 22 3HB ALA 22 -11.438 9.474 -11.308 947 H SER 23 H SER 23 -11.057 12.031 -14.612 948 HA SER 23 HA SER 23 -10.191 14.552 -13.722 949 HB2 SER 23 2HB SER 23 -9.363 13.255 -15.801 950 HB3 SER 23 1HB SER 23 -10.893 13.716 -16.624 951 HG SER 23 1HG SER 23 -9.428 15.221 -17.188 952 H LYS 24 H LYS 24 -13.079 13.409 -15.486 953 HA LYS 24 HA LYS 24 -14.299 15.921 -15.821 954 HB2 LYS 24 2HB LYS 24 -14.814 13.811 -17.131 955 HB3 LYS 24 1HB LYS 24 -15.642 13.136 -15.698 956 HG2 LYS 24 2HG LYS 24 -16.485 15.787 -17.046 957 HG3 LYS 24 1HG LYS 24 -17.024 14.180 -17.633 958 HD2 LYS 24 2HD LYS 24 -18.066 13.691 -15.405 959 HD3 LYS 24 1HD LYS 24 -17.654 15.355 -14.854 960 HE2 LYS 24 2HE LYS 24 -19.028 16.332 -16.718 961 HE3 LYS 24 1HE LYS 24 -19.448 14.663 -17.271 962 HZ1 LYS 24 3HZ LYS 24 -21.158 15.744 -15.913 963 HZ2 LYS 24 1HZ LYS 24 -20.139 15.826 -14.589 964 HZ3 LYS 24 2HZ LYS 24 -20.635 14.314 -15.171 965 H LYS 25 H LYS 25 -14.626 13.317 -13.363 966 HA LYS 25 HA LYS 25 -16.617 14.553 -11.854 967 HB2 LYS 25 2HB LYS 25 -14.418 12.584 -11.050 968 HB3 LYS 25 1HB LYS 25 -15.575 13.233 -9.848 969 HG2 LYS 25 2HG LYS 25 -17.487 12.311 -10.948 970 HG3 LYS 25 1HG LYS 25 -16.533 11.769 -12.371 971 HD2 LYS 25 2HD LYS 25 -15.519 10.007 -11.249 972 HD3 LYS 25 1HD LYS 25 -15.700 10.721 -9.618 973 HE2 LYS 25 2HE LYS 25 -18.208 9.917 -11.202 974 HE3 LYS 25 1HE LYS 25 -17.231 8.644 -10.383 975 HZ1 LYS 25 3HZ LYS 25 -19.172 9.750 -9.125 976 HZ2 LYS 25 1HZ LYS 25 -18.118 11.022 -8.824 977 HZ3 LYS 25 2HZ LYS 25 -17.686 9.432 -8.349 978 H ALA 26 H ALA 26 -13.011 14.618 -11.252 979 HA ALA 26 HA ALA 26 -13.327 16.162 -8.968 980 HB1 ALA 26 1HB ALA 26 -10.838 15.972 -10.765 981 HB2 ALA 26 2HB ALA 26 -11.316 14.764 -9.512 982 HB3 ALA 26 3HB ALA 26 -10.905 16.435 -9.012 983 H VAL 27 H VAL 27 -12.790 17.185 -12.412 984 HA VAL 27 HA VAL 27 -12.388 19.871 -11.591 985 HB VAL 27 HB VAL 27 -11.557 18.885 -13.747 986 HG11 VAL 27 1HG1 VAL 27 -12.989 18.938 -15.734 987 HG12 VAL 27 2HG1 VAL 27 -14.405 19.520 -14.784 988 HG13 VAL 27 3HG1 VAL 27 -13.754 17.867 -14.510 989 HG21 VAL 27 3HG2 VAL 27 -11.393 21.274 -13.167 990 HG22 VAL 27 1HG2 VAL 27 -13.067 21.583 -13.774 991 HG23 VAL 27 2HG2 VAL 27 -11.765 21.085 -14.920 992 H GLU 28 H GLU 28 -15.310 17.950 -12.391 993 HA GLU 28 HA GLU 28 -16.963 20.279 -12.566 994 HB2 GLU 28 2HB GLU 28 -17.557 18.158 -13.774 995 HB3 GLU 28 1HB GLU 28 -17.765 17.326 -12.200 996 HG2 GLU 28 2HG GLU 28 -19.697 18.792 -11.632 997 HG3 GLU 28 1HG GLU 28 -19.428 19.769 -13.125 998 H ALA 29 H ALA 29 -16.098 17.860 -10.149 999 HA ALA 29 HA ALA 29 -17.961 18.457 -8.197 1000 HB1 ALA 29 1HB ALA 29 -16.353 17.151 -6.748 1001 HB2 ALA 29 2HB ALA 29 -15.109 17.275 -8.011 1002 HB3 ALA 29 3HB ALA 29 -16.616 16.335 -8.306 1003 H GLU 30 H GLU 30 -14.506 19.536 -8.590 1004 HA GLU 30 HA GLU 30 -14.762 21.211 -6.327 1005 HB2 GLU 30 2HB GLU 30 -12.593 20.234 -7.272 1006 HB3 GLU 30 1HB GLU 30 -12.656 21.529 -8.506 1007 HG2 GLU 30 2HG GLU 30 -11.577 22.846 -7.002 1008 HG3 GLU 30 1HG GLU 30 -13.102 22.947 -6.063 1009 H ARG 31 H ARG 31 -15.296 21.777 -9.854 1010 HA ARG 31 HA ARG 31 -15.278 24.620 -9.522 1011 HB2 ARG 31 2HB ARG 31 -16.191 22.821 -11.784 1012 HB3 ARG 31 1HB ARG 31 -16.608 24.557 -11.818 1013 HG2 ARG 31 2HG ARG 31 -13.697 23.643 -11.536 1014 HG3 ARG 31 1HG ARG 31 -14.553 23.810 -13.111 1015 HD2 ARG 31 2HD ARG 31 -15.204 26.209 -12.401 1016 HD3 ARG 31 1HD ARG 31 -13.972 26.078 -11.074 1017 HE ARG 31 HE ARG 31 -12.361 25.437 -13.043 1018 HH11 ARG 31 1HH2 ARG 31 -14.875 28.070 -13.030 1019 HH12 ARG 31 2HH2 ARG 31 -14.199 28.885 -14.355 1020 HH21 ARG 31 1HH1 ARG 31 -11.409 26.708 -14.952 1021 HH22 ARG 31 2HH1 ARG 31 -11.998 28.283 -15.166 1022 H GLY 32 H GLY 32 -16.660 25.246 -7.905 1023 HA2 GLY 32 2HA GLY 32 -18.976 26.300 -8.201 1024 HA3 GLY 32 1HA GLY 32 -19.479 24.558 -8.099 1025 H ALA 33 H ALA 33 -16.756 24.343 -6.404 1026 HA ALA 33 HA ALA 33 -18.173 24.587 -3.930 1027 HB1 ALA 33 1HB ALA 33 -15.334 23.570 -4.567 1028 HB2 ALA 33 2HB ALA 33 -16.806 22.547 -4.432 1029 HB3 ALA 33 3HB ALA 33 -16.173 23.406 -2.982 1030 HA PRO 34 HA PRO 34 -15.927 28.329 -2.899 1031 HB2 PRO 34 2HB PRO 34 -16.061 28.355 -0.105 1032 HB3 PRO 34 1HB PRO 34 -17.517 28.605 -1.144 1033 HG2 PRO 34 2HG PRO 34 -16.598 26.012 0.209 1034 HG3 PRO 34 1HG PRO 34 -18.261 26.728 0.170 1035 HD2 PRO 34 2HD PRO 34 -17.390 24.721 -1.575 1036 HD3 PRO 34 1HD PRO 34 -18.616 25.968 -2.075 1037 H GLY 35 H GLY 35 -13.770 29.040 -2.141 1038 HA2 GLY 35 2HA GLY 35 -11.677 28.696 -1.328 1039 HA3 GLY 35 1HA GLY 35 -12.049 26.955 -1.014 1040 H ALA 36 H ALA 36 -12.527 25.642 -2.860 1041 HA ALA 36 HA ALA 36 -11.979 24.542 -4.583 1042 HB1 ALA 36 1HB ALA 36 -13.129 26.223 -5.986 1043 HB2 ALA 36 2HB ALA 36 -11.712 25.512 -6.840 1044 HB3 ALA 36 3HB ALA 36 -11.590 27.162 -6.121 1045 H ALA 37 H ALA 37 -10.129 23.353 -5.267 1046 HA ALA 37 HA ALA 37 -7.577 24.811 -5.086 1047 HB1 ALA 37 1HB ALA 37 -7.827 23.145 -3.202 1048 HB2 ALA 37 2HB ALA 37 -6.542 22.677 -4.375 1049 HB3 ALA 37 3HB ALA 37 -8.156 21.872 -4.421 1050 H LEU 38 H LEU 38 -9.528 22.202 -6.637 1051 HA LEU 38 HA LEU 38 -7.537 22.133 -8.779 1052 HB2 LEU 38 2HB LEU 38 -8.435 19.999 -7.745 1053 HB3 LEU 38 1HB LEU 38 -10.035 20.414 -8.415 1054 HG LEU 38 HG LEU 38 -9.074 20.327 -10.747 1055 HD11 LEU 38 1HD1 LEU 38 -6.493 19.307 -9.384 1056 HD12 LEU 38 2HD1 LEU 38 -6.665 20.854 -10.314 1057 HD13 LEU 38 3HD1 LEU 38 -6.837 19.284 -11.151 1058 HD21 LEU 38 3HD2 LEU 38 -8.876 17.844 -10.836 1059 HD22 LEU 38 1HD2 LEU 38 -10.186 18.381 -9.720 1060 HD23 LEU 38 2HD2 LEU 38 -8.621 17.791 -9.050 1061 H ILE 39 H ILE 39 -7.954 22.731 -10.955 1062 HA ILE 39 HA ILE 39 -10.540 23.437 -11.784 1063 HB ILE 39 HB ILE 39 -9.677 25.635 -12.821 1064 HG12 ILE 39 2HG1 ILE 39 -7.529 25.399 -10.610 1065 HG13 ILE 39 1HG1 ILE 39 -7.218 25.180 -12.366 1066 HG21 ILE 39 1HG2 ILE 39 -9.896 25.672 -9.744 1067 HG22 ILE 39 2HG2 ILE 39 -11.300 25.485 -10.842 1068 HG23 ILE 39 3HG2 ILE 39 -10.320 26.998 -10.877 1069 HD11 ILE 39 3HD ILE 39 -8.219 27.772 -11.007 1070 HD12 ILE 39 1HD ILE 39 -6.577 27.457 -11.660 1071 HD13 ILE 39 2HD ILE 39 -7.981 27.555 -12.785 1072 H SER 40 H SER 40 -9.953 24.071 -14.307 1073 HA SER 40 HA SER 40 -9.135 23.501 -16.203 1074 HB2 SER 40 2HB SER 40 -6.693 22.227 -14.889 1075 HB3 SER 40 1HB SER 40 -6.853 22.664 -16.617 1076 HG SER 40 1HG SER 40 -5.617 23.941 -15.133 1077 H TYR 41 H TYR 41 -9.818 21.845 -17.523 1078 HA TYR 41 HA TYR 41 -10.089 19.196 -16.520 1079 HB2 TYR 41 2HB TYR 41 -11.624 19.964 -18.285 1080 HB3 TYR 41 1HB TYR 41 -10.251 20.308 -19.387 1081 HD1 TYR 41 2HD TYR 41 -11.844 17.463 -17.441 1082 HD2 TYR 41 1HD TYR 41 -9.531 18.654 -20.873 1083 HE1 TYR 41 2HE TYR 41 -11.947 15.163 -18.315 1084 HE2 TYR 41 1HE TYR 41 -9.603 16.353 -21.725 1085 HH TYR 41 HH TYR 41 -10.249 14.205 -21.342 1086 HA PRO 42 HA PRO 42 -6.298 18.138 -18.959 1087 HB2 PRO 42 2HB PRO 42 -4.265 20.080 -19.513 1088 HB3 PRO 42 1HB PRO 42 -5.527 19.511 -20.665 1089 HG2 PRO 42 2HG PRO 42 -5.611 21.986 -18.857 1090 HG3 PRO 42 1HG PRO 42 -6.048 21.864 -20.614 1091 HD2 PRO 42 2HD PRO 42 -8.000 21.816 -18.723 1092 HD3 PRO 42 1HD PRO 42 -8.076 20.610 -20.085 1093 H ASP 43 H ASP 43 -6.196 20.274 -16.198 1094 HA ASP 43 HA ASP 43 -3.630 19.137 -15.349 1095 HB2 ASP 43 2HB ASP 43 -5.394 21.142 -13.819 1096 HB3 ASP 43 1HB ASP 43 -3.810 20.496 -13.306 1097 H ALA 44 H ALA 44 -7.135 18.776 -15.002 1098 HA ALA 44 HA ALA 44 -7.153 17.605 -12.476 1099 HB1 ALA 44 1HB ALA 44 -9.446 16.773 -13.084 1100 HB2 ALA 44 2HB ALA 44 -9.157 17.287 -14.787 1101 HB3 ALA 44 3HB ALA 44 -9.227 18.512 -13.469 1102 H ILE 45 H ILE 45 -6.718 16.209 -15.727 1103 HA ILE 45 HA ILE 45 -6.888 13.559 -14.782 1104 HB ILE 45 HB ILE 45 -7.329 14.135 -17.082 1105 HG12 ILE 45 2HG1 ILE 45 -5.031 12.104 -16.803 1106 HG13 ILE 45 1HG1 ILE 45 -6.738 11.814 -16.334 1107 HG21 ILE 45 1HG2 ILE 45 -5.541 14.653 -18.695 1108 HG22 ILE 45 2HG2 ILE 45 -4.291 14.564 -17.410 1109 HG23 ILE 45 3HG2 ILE 45 -5.526 15.878 -17.387 1110 HD11 ILE 45 3HD ILE 45 -5.726 12.441 -19.189 1111 HD12 ILE 45 1HD ILE 45 -6.313 10.856 -18.566 1112 HD13 ILE 45 2HD ILE 45 -7.462 12.242 -18.720 1113 H TRP 46 H TRP 46 -4.205 15.882 -14.910 1114 HA TRP 46 HA TRP 46 -2.182 13.914 -14.501 1115 HB2 TRP 46 2HB TRP 46 -2.344 16.855 -14.835 1116 HB3 TRP 46 1HB TRP 46 -1.220 16.442 -13.512 1117 HD1 TRP 46 HD TRP 46 1.120 15.377 -14.160 1118 HE1 TRP 46 1HE TRP 46 2.396 15.372 -16.309 1119 HE3 TRP 46 3HE TRP 46 -2.761 16.280 -17.309 1120 HZ2 TRP 46 2HZ TRP 46 1.793 15.389 -19.166 1121 HZ3 TRP 46 3HZ TRP 46 -2.361 16.328 -19.751 1122 HH2 TRP 46 HH TRP 46 -0.106 15.888 -20.666 1123 H TRP 47 H TRP 47 -4.158 15.975 -12.416 1124 HA TRP 47 HA TRP 47 -2.949 15.370 -9.946 1125 HB2 TRP 47 2HB TRP 47 -4.500 17.284 -10.332 1126 HB3 TRP 47 1HB TRP 47 -5.819 16.158 -10.778 1127 HD1 TRP 47 HD TRP 47 -3.806 17.200 -7.559 1128 HE1 TRP 47 1HE TRP 47 -5.067 16.274 -5.604 1129 HE3 TRP 47 3HE TRP 47 -7.607 14.839 -10.009 1130 HZ2 TRP 47 2HZ TRP 47 -7.710 15.242 -5.029 1131 HZ3 TRP 47 3HZ TRP 47 -9.427 13.810 -8.690 1132 HH2 TRP 47 HH TRP 47 -9.495 14.038 -6.235 1133 H SER 48 H SER 48 -5.618 13.912 -11.794 1134 HA SER 48 HA SER 48 -6.486 12.028 -10.020 1135 HB2 SER 48 2HB SER 48 -7.526 12.806 -12.245 1136 HB3 SER 48 1HB SER 48 -6.367 11.720 -13.093 1137 HG SER 48 1HG SER 48 -8.396 10.821 -12.784 1138 H VAL 49 H VAL 49 -3.772 11.815 -12.369 1139 HA VAL 49 HA VAL 49 -3.261 9.123 -12.242 1140 HB VAL 49 HB VAL 49 -1.392 11.492 -12.659 1141 HG11 VAL 49 1HG1 VAL 49 -0.741 8.477 -12.924 1142 HG12 VAL 49 2HG1 VAL 49 0.079 9.656 -11.835 1143 HG13 VAL 49 3HG1 VAL 49 0.255 9.803 -13.614 1144 HG21 VAL 49 3HG2 VAL 49 -2.540 9.333 -14.566 1145 HG22 VAL 49 1HG2 VAL 49 -1.556 10.761 -15.039 1146 HG23 VAL 49 2HG2 VAL 49 -3.219 10.984 -14.393 1147 H GLU 50 H GLU 50 -1.930 11.670 -9.985 1148 HA GLU 50 HA GLU 50 -0.368 9.667 -8.693 1149 HB2 GLU 50 2HB GLU 50 0.201 11.263 -6.954 1150 HB3 GLU 50 1HB GLU 50 0.508 11.932 -8.580 1151 HG2 GLU 50 2HG GLU 50 -1.425 13.463 -8.398 1152 HG3 GLU 50 1HG GLU 50 -2.007 12.620 -6.923 1153 H THR 51 H THR 51 -3.643 10.673 -8.430 1154 HA THR 51 HA THR 51 -4.020 9.991 -5.694 1155 HB THR 51 HB THR 51 -6.092 10.328 -7.935 1156 HG1 THR 51 1HG THR 51 -4.845 12.224 -7.738 1157 HG21 THR 51 3HG2 THR 51 -6.267 10.584 -4.846 1158 HG22 THR 51 1HG2 THR 51 -7.004 9.270 -5.839 1159 HG23 THR 51 2HG2 THR 51 -7.591 10.963 -6.007 1160 H ALA 52 H ALA 52 -4.442 8.364 -8.864 1161 HA ALA 52 HA ALA 52 -5.757 6.086 -7.780 1162 HB1 ALA 52 1HB ALA 52 -4.201 6.427 -10.419 1163 HB2 ALA 52 2HB ALA 52 -5.975 6.689 -10.193 1164 HB3 ALA 52 3HB ALA 52 -5.281 5.038 -10.019 1165 H THR 53 H THR 53 -2.312 6.966 -8.246 1166 HA THR 53 HA THR 53 -1.475 4.255 -7.788 1167 HB THR 53 HB THR 53 0.823 5.388 -7.781 1168 HG1 THR 53 1HG THR 53 0.094 7.472 -7.244 1169 HG21 THR 53 3HG2 THR 53 0.740 5.759 -10.248 1170 HG22 THR 53 1HG2 THR 53 -1.057 5.870 -10.208 1171 HG23 THR 53 2HG2 THR 53 -0.239 4.311 -9.808 1172 H THR 54 H THR 54 -2.910 6.374 -5.769 1173 HA THR 54 HA THR 54 -2.888 6.866 -3.674 1174 HB THR 54 HB THR 54 -2.454 4.944 -2.060 1175 HG1 THR 54 1HG THR 54 -1.022 3.771 -3.439 1176 HG21 THR 54 3HG2 THR 54 -4.676 5.584 -3.102 1177 HG22 THR 54 1HG2 THR 54 -4.527 3.803 -2.890 1178 HG23 THR 54 2HG2 THR 54 -4.311 4.535 -4.522 1179 H VAL 55 H VAL 55 -1.014 8.278 -4.655 1180 HA VAL 55 HA VAL 55 1.090 8.186 -2.612 1181 HB VAL 55 HB VAL 55 1.403 9.407 -5.432 1182 HG11 VAL 55 1HG1 VAL 55 3.829 9.498 -4.695 1183 HG12 VAL 55 2HG1 VAL 55 3.367 8.783 -3.105 1184 HG13 VAL 55 3HG1 VAL 55 2.805 10.430 -3.543 1185 HG21 VAL 55 3HG2 VAL 55 2.266 6.679 -4.303 1186 HG22 VAL 55 1HG2 VAL 55 2.989 7.417 -5.775 1187 HG23 VAL 55 2HG2 VAL 55 1.246 6.981 -5.740 1188 H GLY 56 H GLY 56 0.814 10.991 -4.634 1189 HA2 GLY 56 2HA GLY 56 -0.691 12.788 -4.359 1190 HA3 GLY 56 1HA GLY 56 -1.127 12.154 -2.729 1191 H TYR 57 H TYR 57 1.571 13.461 -4.708 1192 HA TYR 57 HA TYR 57 3.327 13.497 -2.401 1193 HB2 TYR 57 2HB TYR 57 3.558 14.939 -5.132 1194 HB3 TYR 57 1HB TYR 57 4.804 15.020 -3.836 1195 HD1 TYR 57 2HD TYR 57 6.260 13.147 -3.318 1196 HD2 TYR 57 1HD TYR 57 3.328 12.874 -6.447 1197 HE1 TYR 57 2HE TYR 57 7.531 11.307 -4.341 1198 HE2 TYR 57 1HE TYR 57 4.598 11.042 -7.484 1199 HH TYR 57 HH TYR 57 7.751 9.913 -6.228 1200 H GLY 58 H GLY 58 0.788 15.485 -3.560 1201 HA2 GLY 58 2HA GLY 58 -0.119 17.056 -2.119 1202 HA3 GLY 58 1HA GLY 58 1.527 17.581 -1.607 1203 H ASP 59 H ASP 59 -0.162 17.045 -4.781 1204 HA ASP 59 HA ASP 59 1.060 19.436 -5.819 1205 HB2 ASP 59 2HB ASP 59 0.382 17.299 -7.193 1206 HB3 ASP 59 1HB ASP 59 -1.284 17.911 -7.134 1207 H ARG 60 H ARG 60 -2.332 18.318 -4.984 1208 HA ARG 60 HA ARG 60 -3.069 20.992 -4.233 1209 HB2 ARG 60 2HB ARG 60 -4.538 19.354 -6.405 1210 HB3 ARG 60 1HB ARG 60 -5.270 20.778 -5.600 1211 HG2 ARG 60 2HG ARG 60 -3.928 22.325 -6.769 1212 HG3 ARG 60 1HG ARG 60 -2.581 21.169 -6.896 1213 HD2 ARG 60 2HD ARG 60 -4.253 19.831 -8.542 1214 HD3 ARG 60 1HD ARG 60 -4.963 21.475 -8.789 1215 HE ARG 60 HE ARG 60 -2.062 20.619 -9.123 1216 HH11 ARG 60 1HH2 ARG 60 -4.408 23.311 -9.524 1217 HH12 ARG 60 2HH2 ARG 60 -3.268 24.339 -10.258 1218 HH21 ARG 60 1HH1 ARG 60 -0.622 21.903 -10.359 1219 HH22 ARG 60 2HH1 ARG 60 -0.999 23.527 -10.688 1220 H TYR 61 H TYR 61 -5.611 20.543 -3.327 1221 HA TYR 61 HA TYR 61 -5.745 17.842 -2.369 1222 HB2 TYR 61 2HB TYR 61 -5.807 20.305 -0.494 1223 HB3 TYR 61 1HB TYR 61 -6.300 18.637 -0.016 1224 HD1 TYR 61 1HD TYR 61 -4.334 16.837 -1.025 1225 HD2 TYR 61 2HD TYR 61 -3.723 20.806 0.516 1226 HE1 TYR 61 1HE TYR 61 -2.025 16.284 -0.569 1227 HE2 TYR 61 2HE TYR 61 -1.388 20.209 1.077 1228 HH TYR 61 HH TYR 61 -0.081 16.897 0.473 1229 HA PRO 62 HA PRO 62 -9.788 19.301 -3.669 1230 HB2 PRO 62 2HB PRO 62 -11.314 17.013 -3.145 1231 HB3 PRO 62 1HB PRO 62 -10.051 17.022 -4.432 1232 HG2 PRO 62 2HG PRO 62 -9.833 16.013 -1.538 1233 HG3 PRO 62 1HG PRO 62 -9.335 15.153 -3.057 1234 HD2 PRO 62 2HD PRO 62 -7.579 16.631 -1.444 1235 HD3 PRO 62 1HD PRO 62 -7.359 16.500 -3.251 1236 H VAL 63 H VAL 63 -12.042 19.742 -2.715 1237 HA VAL 63 HA VAL 63 -11.753 20.066 0.187 1238 HB VAL 63 HB VAL 63 -12.039 21.966 -1.456 1239 HG11 VAL 63 1HG1 VAL 63 -14.214 22.636 -2.177 1240 HG12 VAL 63 2HG1 VAL 63 -15.044 21.306 -1.296 1241 HG13 VAL 63 3HG1 VAL 63 -13.993 20.941 -2.712 1242 HG21 VAL 63 3HG2 VAL 63 -13.858 21.915 1.043 1243 HG22 VAL 63 1HG2 VAL 63 -13.175 23.341 0.198 1244 HG23 VAL 63 2HG2 VAL 63 -12.076 22.176 1.018 1245 H THR 64 H THR 64 -14.455 20.304 0.959 1246 HA THR 64 HA THR 64 -15.069 17.543 1.188 1247 HB THR 64 HB THR 64 -16.780 18.700 2.837 1248 HG1 THR 64 1HG THR 64 -15.945 20.833 3.367 1249 HG21 THR 64 3HG2 THR 64 -13.705 19.123 3.116 1250 HG22 THR 64 1HG2 THR 64 -14.579 17.604 3.489 1251 HG23 THR 64 2HG2 THR 64 -14.893 19.061 4.467 1252 H GLU 65 H GLU 65 -16.430 20.479 -0.203 1253 HA GLU 65 HA GLU 65 -18.953 19.340 -0.786 1254 HB2 GLU 65 2HB GLU 65 -18.485 21.703 -0.077 1255 HB3 GLU 65 1HB GLU 65 -17.809 22.042 -1.705 1256 HG2 GLU 65 2HG GLU 65 -19.950 21.973 -2.735 1257 HG3 GLU 65 1HG GLU 65 -20.629 20.869 -1.492 1258 H GLU 66 H GLU 66 -15.921 19.117 -2.412 1259 HA GLU 66 HA GLU 66 -17.021 18.794 -5.016 1260 HB2 GLU 66 2HB GLU 66 -14.860 18.228 -5.742 1261 HB3 GLU 66 1HB GLU 66 -14.575 19.353 -4.417 1262 HG2 GLU 66 2HG GLU 66 -12.986 17.807 -4.007 1263 HG3 GLU 66 1HG GLU 66 -14.256 17.100 -2.946 1264 H GLY 67 H GLY 67 -16.811 17.080 -2.081 1265 HA2 GLY 67 2HA GLY 67 -18.046 15.355 -1.384 1266 HA3 GLY 67 1HA GLY 67 -18.460 14.935 -3.107 1267 H ARG 68 H ARG 68 -15.772 15.179 -0.778 1268 HA ARG 68 HA ARG 68 -13.665 14.316 -2.026 1269 HB2 ARG 68 2HB ARG 68 -13.897 15.109 0.427 1270 HB3 ARG 68 1HB ARG 68 -14.080 13.368 0.829 1271 HG2 ARG 68 2HG ARG 68 -11.784 13.190 -0.615 1272 HG3 ARG 68 1HG ARG 68 -11.692 14.940 -0.322 1273 HD2 ARG 68 2HD ARG 68 -10.309 13.521 1.304 1274 HD3 ARG 68 1HD ARG 68 -11.514 14.576 2.125 1275 HE ARG 68 HE ARG 68 -12.159 12.573 3.129 1276 HH11 ARG 68 1HH2 ARG 68 -10.417 11.419 0.436 1277 HH12 ARG 68 2HH2 ARG 68 -11.260 9.943 0.221 1278 HH21 ARG 68 1HH1 ARG 68 -13.775 10.740 2.671 1279 HH22 ARG 68 2HH1 ARG 68 -13.439 9.589 1.504 1280 H LYS 69 H LYS 69 -16.281 12.347 -1.527 1281 HA LYS 69 HA LYS 69 -15.319 9.753 -1.785 1282 HB2 LYS 69 2HB LYS 69 -17.812 11.176 -2.867 1283 HB3 LYS 69 1HB LYS 69 -17.549 9.409 -3.042 1284 HG2 LYS 69 2HG LYS 69 -17.569 10.787 -0.289 1285 HG3 LYS 69 1HG LYS 69 -19.057 10.159 -1.083 1286 HD2 LYS 69 2HD LYS 69 -18.198 7.891 -1.141 1287 HD3 LYS 69 1HD LYS 69 -16.564 8.420 -0.629 1288 HE2 LYS 69 2HE LYS 69 -17.408 9.054 1.631 1289 HE3 LYS 69 1HE LYS 69 -19.083 8.536 1.158 1290 HZ1 LYS 69 3HZ LYS 69 -18.148 6.321 0.719 1291 HZ2 LYS 69 1HZ LYS 69 -17.981 6.758 2.336 1292 HZ3 LYS 69 2HZ LYS 69 -16.630 6.830 1.249 1293 H VAL 70 H VAL 70 -15.064 12.511 -4.122 1294 HA VAL 70 HA VAL 70 -14.809 10.786 -6.368 1295 HB VAL 70 HB VAL 70 -13.440 13.507 -6.025 1296 HG11 VAL 70 1HG1 VAL 70 -12.388 12.155 -7.822 1297 HG12 VAL 70 2HG1 VAL 70 -13.396 13.453 -8.528 1298 HG13 VAL 70 3HG1 VAL 70 -14.005 11.750 -8.513 1299 HG21 VAL 70 3HG2 VAL 70 -15.363 14.337 -7.414 1300 HG22 VAL 70 1HG2 VAL 70 -15.816 13.832 -5.769 1301 HG23 VAL 70 2HG2 VAL 70 -16.199 12.742 -7.175 1302 H ALA 71 H ALA 71 -12.439 12.388 -4.182 1303 HA ALA 71 HA ALA 71 -10.186 11.176 -5.254 1304 HB1 ALA 71 1HB ALA 71 -9.035 11.682 -3.082 1305 HB2 ALA 71 2HB ALA 71 -10.638 12.006 -2.315 1306 HB3 ALA 71 3HB ALA 71 -10.035 13.072 -3.633 1307 H GLU 72 H GLU 72 -12.242 10.146 -2.564 1308 HA GLU 72 HA GLU 72 -10.901 7.852 -1.770 1309 HB2 GLU 72 2HB GLU 72 -12.968 9.133 -0.765 1310 HB3 GLU 72 1HB GLU 72 -13.961 8.180 -1.900 1311 HG2 GLU 72 2HG GLU 72 -13.140 6.043 -0.782 1312 HG3 GLU 72 1HG GLU 72 -12.224 7.056 0.402 1313 H GLN 73 H GLN 73 -13.392 8.293 -4.337 1314 HA GLN 73 HA GLN 73 -13.784 5.573 -4.857 1315 HB2 GLN 73 2HB GLN 73 -15.387 7.378 -5.554 1316 HB3 GLN 73 1HB GLN 73 -14.183 7.994 -6.730 1317 HG2 GLN 73 2HG GLN 73 -14.387 5.856 -8.033 1318 HG3 GLN 73 1HG GLN 73 -15.522 5.205 -6.787 1319 HE21 GLN 73 1HE2 GLN 73 -16.710 5.090 -9.075 1320 HE22 GLN 73 2HE2 GLN 73 -17.799 6.394 -9.396 1321 H VAL 74 H VAL 74 -11.522 8.003 -6.212 1322 HA VAL 74 HA VAL 74 -10.566 6.319 -8.279 1323 HB VAL 74 HB VAL 74 -9.316 8.766 -6.918 1324 HG11 VAL 74 1HG1 VAL 74 -7.524 7.485 -8.071 1325 HG12 VAL 74 2HG1 VAL 74 -7.940 8.924 -9.054 1326 HG13 VAL 74 3HG1 VAL 74 -8.545 7.299 -9.545 1327 HG21 VAL 74 3HG2 VAL 74 -10.897 8.411 -9.554 1328 HG22 VAL 74 1HG2 VAL 74 -10.200 9.955 -8.925 1329 HG23 VAL 74 2HG2 VAL 74 -11.558 9.162 -8.066 1330 H MET 75 H MET 75 -9.377 7.111 -4.977 1331 HA MET 75 HA MET 75 -7.049 5.595 -5.040 1332 HB2 MET 75 2HB MET 75 -8.965 6.209 -2.706 1333 HB3 MET 75 1HB MET 75 -7.329 5.492 -2.491 1334 HG2 MET 75 2HG MET 75 -6.203 7.467 -3.133 1335 HG3 MET 75 1HG MET 75 -7.612 8.132 -3.987 1336 HE1 MET 75 3HE MET 75 -8.044 6.513 -0.297 1337 HE2 MET 75 1HE MET 75 -7.337 7.844 0.677 1338 HE3 MET 75 2HE MET 75 -6.320 6.964 -0.507 1339 H LYS 76 H LYS 76 -10.360 4.700 -3.946 1340 HA LYS 76 HA LYS 76 -9.729 2.119 -3.136 1341 HB2 LYS 76 2HB LYS 76 -11.792 3.283 -2.460 1342 HB3 LYS 76 1HB LYS 76 -12.392 3.284 -4.149 1343 HG2 LYS 76 2HG LYS 76 -12.807 0.909 -4.120 1344 HG3 LYS 76 1HG LYS 76 -11.794 0.659 -2.660 1345 HD2 LYS 76 2HD LYS 76 -13.408 1.789 -1.218 1346 HD3 LYS 76 1HD LYS 76 -14.356 2.370 -2.624 1347 HE2 LYS 76 2HE LYS 76 -15.464 0.475 -1.385 1348 HE3 LYS 76 1HE LYS 76 -15.185 0.121 -3.133 1349 HZ1 LYS 76 3HZ LYS 76 -14.675 -1.605 -1.315 1350 HZ2 LYS 76 1HZ LYS 76 -13.153 -0.800 -1.182 1351 HZ3 LYS 76 2HZ LYS 76 -13.674 -1.436 -2.691 1352 H ALA 77 H ALA 77 -10.761 3.365 -6.338 1353 HA ALA 77 HA ALA 77 -11.103 0.855 -7.534 1354 HB1 ALA 77 1HB ALA 77 -11.918 2.993 -8.597 1355 HB2 ALA 77 2HB ALA 77 -10.849 2.067 -9.718 1356 HB3 ALA 77 3HB ALA 77 -10.209 3.508 -8.840 1357 H GLY 78 H GLY 78 -8.219 2.927 -7.097 1358 HA2 GLY 78 2HA GLY 78 -6.494 1.443 -8.758 1359 HA3 GLY 78 1HA GLY 78 -6.055 2.555 -7.403 1360 H ILE 79 H ILE 79 -7.067 1.369 -5.217 1361 HA ILE 79 HA ILE 79 -5.228 -0.643 -4.675 1362 HB ILE 79 HB ILE 79 -7.791 0.135 -3.209 1363 HG12 ILE 79 2HG1 ILE 79 -4.844 0.874 -2.648 1364 HG13 ILE 79 1HG1 ILE 79 -5.966 1.936 -3.538 1365 HG21 ILE 79 1HG2 ILE 79 -6.728 -0.992 -1.197 1366 HG22 ILE 79 2HG2 ILE 79 -5.381 -1.563 -2.243 1367 HG23 ILE 79 3HG2 ILE 79 -7.056 -2.173 -2.500 1368 HD11 ILE 79 3HD ILE 79 -6.278 1.043 -0.597 1369 HD12 ILE 79 1HD ILE 79 -5.838 2.674 -1.203 1370 HD13 ILE 79 2HD ILE 79 -7.490 2.023 -1.513 1371 H GLU 80 H GLU 80 -8.757 -0.867 -5.490 1372 HA GLU 80 HA GLU 80 -8.855 -3.651 -5.150 1373 HB2 GLU 80 2HB GLU 80 -10.580 -1.771 -6.849 1374 HB3 GLU 80 1HB GLU 80 -10.917 -3.531 -6.679 1375 HG2 GLU 80 2HG GLU 80 -11.146 -3.310 -4.220 1376 HG3 GLU 80 1HG GLU 80 -10.799 -1.547 -4.315 1377 H VAL 81 H VAL 81 -7.967 -1.680 -8.031 1378 HA VAL 81 HA VAL 81 -7.855 -3.898 -9.786 1379 HB VAL 81 HB VAL 81 -6.732 -1.073 -9.789 1380 HG11 VAL 81 1HG1 VAL 81 -5.969 -1.506 -12.195 1381 HG12 VAL 81 2HG1 VAL 81 -6.114 -3.270 -11.874 1382 HG13 VAL 81 3HG1 VAL 81 -4.940 -2.268 -10.946 1383 HG21 VAL 81 3HG2 VAL 81 -8.733 -2.611 -11.597 1384 HG22 VAL 81 1HG2 VAL 81 -8.358 -0.852 -11.680 1385 HG23 VAL 81 2HG2 VAL 81 -9.188 -1.521 -10.234 1386 H PHE 82 H PHE 82 -5.300 -2.169 -7.883 1387 HA PHE 82 HA PHE 82 -3.288 -3.946 -8.782 1388 HB2 PHE 82 2HB PHE 82 -3.304 -2.080 -6.323 1389 HB3 PHE 82 1HB PHE 82 -1.838 -2.867 -7.015 1390 HD1 PHE 82 1HD PHE 82 -2.258 -2.417 -9.996 1391 HD2 PHE 82 2HD PHE 82 -2.837 0.168 -6.597 1392 HE1 PHE 82 1HE PHE 82 -1.841 -0.462 -11.406 1393 HE2 PHE 82 2HE PHE 82 -2.397 2.127 -8.013 1394 HZ PHE 82 HZ PHE 82 -1.880 1.830 -10.426 1395 H ALA 83 H ALA 83 -5.689 -4.327 -6.309 1396 HA ALA 83 HA ALA 83 -4.116 -6.419 -4.989 1397 HB1 ALA 83 1HB ALA 83 -6.007 -6.586 -3.399 1398 HB2 ALA 83 2HB ALA 83 -6.949 -5.386 -4.372 1399 HB3 ALA 83 3HB ALA 83 -5.444 -4.881 -3.522 1400 H LEU 84 H LEU 84 -6.644 -6.000 -7.442 1401 HA LEU 84 HA LEU 84 -7.798 -8.557 -7.115 1402 HB2 LEU 84 2HB LEU 84 -8.953 -6.726 -8.298 1403 HB3 LEU 84 1HB LEU 84 -7.743 -6.750 -9.613 1404 HG LEU 84 HG LEU 84 -9.216 -9.337 -8.984 1405 HD11 LEU 84 1HD1 LEU 84 -11.035 -7.665 -8.733 1406 HD12 LEU 84 2HD1 LEU 84 -11.267 -8.661 -10.215 1407 HD13 LEU 84 3HD1 LEU 84 -10.649 -6.971 -10.351 1408 HD21 LEU 84 3HD2 LEU 84 -9.295 -9.572 -11.469 1409 HD22 LEU 84 1HD2 LEU 84 -7.614 -9.249 -10.925 1410 HD23 LEU 84 2HD2 LEU 84 -8.585 -7.929 -11.667 1411 H VAL 85 H VAL 85 -4.947 -7.329 -8.729 1412 HA VAL 85 HA VAL 85 -4.446 -9.455 -10.435 1413 HB VAL 85 HB VAL 85 -2.157 -8.732 -10.566 1414 HG11 VAL 85 1HG1 VAL 85 -4.046 -7.268 -11.558 1415 HG12 VAL 85 2HG1 VAL 85 -2.505 -6.402 -11.213 1416 HG13 VAL 85 3HG1 VAL 85 -3.895 -6.219 -10.105 1417 HG21 VAL 85 3HG2 VAL 85 -1.480 -8.497 -8.233 1418 HG22 VAL 85 1HG2 VAL 85 -2.754 -7.278 -7.910 1419 HG23 VAL 85 2HG2 VAL 85 -1.350 -6.859 -8.955 1420 H THR 86 H THR 86 -4.391 -9.443 -6.936 1421 HA THR 86 HA THR 86 -2.496 -11.339 -6.463 1422 HB THR 86 HB THR 86 -5.054 -10.713 -4.936 1423 HG1 THR 86 1HG THR 86 -3.830 -9.243 -3.942 1424 HG21 THR 86 3HG2 THR 86 -4.064 -12.887 -4.115 1425 HG22 THR 86 1HG2 THR 86 -3.795 -11.573 -2.927 1426 HG23 THR 86 2HG2 THR 86 -2.443 -12.110 -3.985 1427 H ALA 87 H ALA 87 -5.414 -11.758 -8.234 1428 HA ALA 87 HA ALA 87 -5.770 -14.525 -7.839 1429 HB1 ALA 87 1HB ALA 87 -6.148 -12.876 -10.420 1430 HB2 ALA 87 2HB ALA 87 -7.392 -13.112 -9.142 1431 HB3 ALA 87 3HB ALA 87 -6.826 -14.521 -10.111 1432 H ALA 88 H ALA 88 -3.224 -12.709 -9.515 1433 HA ALA 88 HA ALA 88 -2.261 -15.051 -10.942 1434 HB1 ALA 88 1HB ALA 88 -0.351 -13.565 -11.601 1435 HB2 ALA 88 2HB ALA 88 -1.001 -12.267 -10.534 1436 HB3 ALA 88 3HB ALA 88 -1.930 -12.791 -11.983 1437 H LEU 89 H LEU 89 -1.828 -13.315 -7.911 1438 HA LEU 89 HA LEU 89 0.732 -14.478 -7.263 1439 HB2 LEU 89 2HB LEU 89 -1.251 -12.738 -5.692 1440 HB3 LEU 89 1HB LEU 89 0.308 -13.278 -5.044 1441 HG LEU 89 HG LEU 89 1.612 -11.972 -6.417 1442 HD11 LEU 89 1HD1 LEU 89 0.521 -12.055 -8.644 1443 HD12 LEU 89 2HD1 LEU 89 0.883 -10.374 -8.157 1444 HD13 LEU 89 3HD1 LEU 89 -0.799 -10.978 -8.041 1445 HD21 LEU 89 3HD2 LEU 89 0.866 -9.712 -5.645 1446 HD22 LEU 89 1HD2 LEU 89 0.418 -10.945 -4.429 1447 HD23 LEU 89 2HD2 LEU 89 -0.829 -10.271 -5.532 1448 H ALA 90 H ALA 90 -1.629 -16.248 -7.678 1449 HA ALA 90 HA ALA 90 -1.237 -17.694 -5.164 1450 HB1 ALA 90 1HB ALA 90 -3.461 -16.570 -4.862 1451 HB2 ALA 90 2HB ALA 90 -3.671 -18.345 -5.072 1452 HB3 ALA 90 3HB ALA 90 -4.003 -17.217 -6.450 1453 H THR 91 H THR 91 -0.970 -17.541 -8.488 1454 HA THR 91 HA THR 91 -1.126 -20.473 -8.639 1455 HB THR 91 HB THR 91 -2.914 -19.687 -9.975 1456 HG1 THR 91 1HG THR 91 -0.605 -20.391 -11.393 1457 HG21 THR 91 3HG2 THR 91 -2.344 -17.300 -10.156 1458 HG22 THR 91 1HG2 THR 91 -2.676 -17.997 -11.756 1459 HG23 THR 91 2HG2 THR 91 -0.964 -17.667 -11.256 1460 H ASP 92 H ASP 92 0.751 -18.249 -7.650 1461 HA ASP 92 HA ASP 92 2.919 -18.272 -9.512 1462 HB2 ASP 92 2HB ASP 92 4.012 -16.875 -7.669 1463 HB3 ASP 92 1HB ASP 92 2.561 -16.163 -8.441 1464 H PHE 93 H PHE 93 2.123 -19.324 -6.198 1465 HA PHE 93 HA PHE 93 4.378 -20.915 -5.851 1466 HB2 PHE 93 2HB PHE 93 3.317 -21.999 -3.967 1467 HB3 PHE 93 1HB PHE 93 2.910 -20.253 -3.944 1468 HD1 PHE 93 2HD PHE 93 0.557 -19.542 -4.400 1469 HD2 PHE 93 1HD PHE 93 1.665 -23.696 -4.265 1470 HE1 PHE 93 2HE PHE 93 -1.786 -20.157 -3.949 1471 HE2 PHE 93 1HE PHE 93 -0.697 -24.313 -3.860 1472 HZ PHE 93 HZ PHE 93 -2.430 -22.534 -3.684 1473 H VAL 94 H VAL 94 1.636 -21.497 -7.793 1474 HA VAL 94 HA VAL 94 1.823 -24.355 -7.816 1475 HB VAL 94 HB VAL 94 0.298 -22.461 -9.680 1476 HG11 VAL 94 1HG1 VAL 94 -1.179 -24.482 -10.034 1477 HG12 VAL 94 2HG1 VAL 94 -0.042 -25.477 -9.048 1478 HG13 VAL 94 3HG1 VAL 94 0.494 -24.772 -10.618 1479 HG21 VAL 94 3HG2 VAL 94 -0.338 -22.064 -7.266 1480 HG22 VAL 94 1HG2 VAL 94 -0.525 -23.832 -7.017 1481 HG23 VAL 94 2HG2 VAL 94 -1.643 -22.943 -8.112 1482 H ARG 95 H ARG 95 3.276 -21.668 -9.591 1483 HA ARG 95 HA ARG 95 3.708 -22.974 -12.026 1484 HB2 ARG 95 2HB ARG 95 3.756 -20.465 -11.693 1485 HB3 ARG 95 1HB ARG 95 5.287 -20.647 -10.770 1486 HG2 ARG 95 2HG ARG 95 6.397 -21.568 -12.838 1487 HG3 ARG 95 1HG ARG 95 4.878 -21.349 -13.758 1488 HD2 ARG 95 2HD ARG 95 6.552 -19.082 -12.414 1489 HD3 ARG 95 1HD ARG 95 6.664 -19.585 -14.131 1490 HE ARG 95 HE ARG 95 4.482 -18.816 -14.614 1491 HH11 ARG 95 1HH2 ARG 95 5.374 -18.020 -11.201 1492 HH12 ARG 95 2HH2 ARG 95 4.536 -16.520 -11.156 1493 HH21 ARG 95 1HH1 ARG 95 3.439 -16.605 -14.552 1494 HH22 ARG 95 2HH1 ARG 95 3.329 -15.772 -13.087 1495 H ARG 96 H ARG 96 5.393 -23.278 -8.966 1496 HA ARG 96 HA ARG 96 7.890 -24.031 -10.104 1497 HB2 ARG 96 2HB ARG 96 8.539 -24.860 -7.910 1498 HB3 ARG 96 1HB ARG 96 7.783 -23.255 -7.754 1499 HG2 ARG 96 2HG ARG 96 6.210 -24.043 -6.316 1500 HG3 ARG 96 1HG ARG 96 5.689 -25.288 -7.468 1501 HD2 ARG 96 2HD ARG 96 6.340 -26.518 -5.543 1502 HD3 ARG 96 1HD ARG 96 7.720 -26.749 -6.676 1503 HE ARG 96 HE ARG 96 7.584 -24.943 -4.256 1504 HH11 ARG 96 1HH2 ARG 96 9.779 -26.501 -6.763 1505 HH12 ARG 96 2HH2 ARG 96 11.133 -26.290 -5.762 1506 HH21 ARG 96 1HH1 ARG 96 9.511 -24.710 -3.052 1507 HH22 ARG 96 2HH1 ARG 96 11.039 -24.765 -3.865 1508 H GLU 97 H GLU 97 4.830 -25.669 -9.949 1509 HA GLU 97 HA GLU 97 6.182 -28.266 -10.231 1510 HB2 GLU 97 2HB GLU 97 3.193 -27.773 -9.809 1511 HB3 GLU 97 1HB GLU 97 4.048 -29.353 -9.936 1512 HG2 GLU 97 2HG GLU 97 5.522 -28.422 -7.920 1513 HG3 GLU 97 1HG GLU 97 4.157 -27.270 -7.671 1514 H GLU 98 H GLU 98 4.630 -29.561 -11.945 1515 HA GLU 98 HA GLU 98 4.338 -29.935 -14.022 1516 HB2 GLU 98 2HB GLU 98 3.665 -27.020 -14.556 1517 HB3 GLU 98 1HB GLU 98 3.396 -28.434 -15.629 1518 HG2 GLU 98 2HG GLU 98 2.113 -29.428 -13.463 1519 HG3 GLU 98 1HG GLU 98 1.998 -27.694 -12.983 1520 H GLU 99 H GLU 99 6.277 -26.883 -13.947 1521 HA GLU 99 HA GLU 99 7.888 -27.601 -16.136 1522 HB2 GLU 99 2HB GLU 99 9.284 -25.757 -15.666 1523 HB3 GLU 99 1HB GLU 99 7.644 -25.260 -15.165 1524 HG2 GLU 99 2HG GLU 99 8.801 -24.426 -13.372 1525 HG3 GLU 99 1HG GLU 99 8.496 -26.060 -12.706 1526 H ARG 100 H ARG 100 8.015 -28.319 -12.733 1527 HA ARG 100 HA ARG 100 10.477 -29.329 -12.346 1528 HB2 ARG 100 2HB ARG 100 8.693 -29.053 -10.598 1529 HB3 ARG 100 1HB ARG 100 7.826 -30.482 -11.257 1530 HG2 ARG 100 2HG ARG 100 9.798 -31.937 -10.584 1531 HG3 ARG 100 1HG ARG 100 10.664 -30.465 -10.047 1532 HD2 ARG 100 2HD ARG 100 9.745 -31.709 -8.107 1533 HD3 ARG 100 1HD ARG 100 8.987 -30.067 -8.245 1534 HE ARG 100 HE ARG 100 7.406 -32.077 -9.653 1535 HH11 ARG 100 1HH2 ARG 100 8.267 -31.379 -6.232 1536 HH12 ARG 100 2HH2 ARG 100 6.664 -31.118 -5.700 1537 HH21 ARG 100 1HH1 ARG 100 5.179 -32.489 -8.715 1538 HH22 ARG 100 2HH1 ARG 100 4.868 -31.961 -7.138 1539 H ARG 101 H ARG 101 7.861 -30.911 -14.163 1540 HA ARG 101 HA ARG 101 9.552 -33.338 -14.437 1541 HB2 ARG 101 2HB ARG 101 6.503 -32.999 -14.756 1542 HB3 ARG 101 1HB ARG 101 7.419 -34.495 -15.138 1543 HG2 ARG 101 2HG ARG 101 8.111 -34.753 -12.796 1544 HG3 ARG 101 1HG ARG 101 7.292 -33.219 -12.334 1545 HD2 ARG 101 2HD ARG 101 5.065 -34.182 -12.854 1546 HD3 ARG 101 1HD ARG 101 5.801 -35.685 -13.499 1547 HE ARG 101 HE ARG 101 5.522 -34.838 -10.645 1548 HH11 ARG 101 1HH2 ARG 101 6.456 -37.457 -12.984 1549 HH12 ARG 101 2HH2 ARG 101 6.539 -38.622 -11.740 1550 HH21 ARG 101 1HH1 ARG 101 6.245 -36.460 -8.938 1551 HH22 ARG 101 2HH1 ARG 101 6.780 -37.978 -9.470 1552 H GLY 102 H GLY 102 8.906 -30.430 -15.876 1553 HA2 GLY 102 2HA GLY 102 9.217 -29.685 -17.906 1554 HA3 GLY 102 1HA GLY 102 9.623 -31.358 -18.435 1555 H HIS 103 H HIS 103 6.581 -31.053 -16.924 1556 HA HIS 103 HA HIS 103 4.574 -31.567 -17.574 1557 HB2 HIS 103 2HB HIS 103 4.656 -29.217 -18.620 1558 HB3 HIS 103 1HB HIS 103 4.890 -30.022 -20.201 1559 HD1 HIS 103 1HD HIS 103 2.697 -31.911 -20.718 1560 HD2 HIS 103 2HD HIS 103 2.116 -28.930 -17.764 1561 HE1 HIS 103 1HE HIS 103 0.253 -31.817 -20.203 1562 HE2 HIS 103 2HE HIS 103 -0.046 -30.032 -18.364 1563 H1 SER 1 H SER 1 17.415 -23.076 -5.774 1564 HA SER 1 HA SER 1 18.226 -24.625 -3.929 1565 HB2 SER 1 2HB SER 1 20.250 -22.842 -3.696 1566 HB3 SER 1 1HB SER 1 19.114 -22.038 -2.563 1567 HG SER 1 1HG SER 1 20.533 -24.443 -2.411 1568 H ALA 2 H ALA 2 16.287 -25.031 -3.079 1569 HA ALA 2 HA ALA 2 14.330 -24.913 -2.291 1570 HB1 ALA 2 1HB ALA 2 14.726 -21.974 -1.526 1571 HB2 ALA 2 2HB ALA 2 15.256 -23.382 -0.540 1572 HB3 ALA 2 3HB ALA 2 13.506 -23.143 -0.855 1573 H ASP 3 H ASP 3 15.170 -23.202 -4.951 1574 HA ASP 3 HA ASP 3 14.280 -21.660 -6.249 1575 HB2 ASP 3 2HB ASP 3 13.019 -24.300 -7.041 1576 HB3 ASP 3 1HB ASP 3 13.060 -22.831 -8.082 1577 H HIS 4 H HIS 4 13.271 -20.359 -4.677 1578 HA HIS 4 HA HIS 4 10.783 -19.598 -5.676 1579 HB2 HIS 4 2HB HIS 4 9.324 -19.539 -3.744 1580 HB3 HIS 4 1HB HIS 4 9.771 -21.247 -4.023 1581 HD1 HIS 4 1HD HIS 4 11.702 -22.167 -2.319 1582 HD2 HIS 4 2HD HIS 4 10.256 -18.332 -1.389 1583 HE1 HIS 4 1HE HIS 4 12.610 -21.524 -0.006 1584 HE2 HIS 4 2HE HIS 4 11.979 -19.108 0.305 1585 H GLU 5 H GLU 5 13.070 -19.559 -2.949 1586 HA GLU 5 HA GLU 5 12.903 -16.993 -2.097 1587 HB2 GLU 5 2HB GLU 5 14.213 -19.176 -1.278 1588 HB3 GLU 5 1HB GLU 5 15.513 -18.639 -2.356 1589 HG2 GLU 5 2HG GLU 5 16.215 -17.763 -0.340 1590 HG3 GLU 5 1HG GLU 5 15.313 -16.334 -0.974 1591 H ARG 6 H ARG 6 15.016 -18.416 -4.620 1592 HA ARG 6 HA ARG 6 16.335 -15.958 -5.150 1593 HB2 ARG 6 2HB ARG 6 16.384 -18.632 -6.648 1594 HB3 ARG 6 1HB ARG 6 17.536 -17.282 -6.878 1595 HG2 ARG 6 2HG ARG 6 17.237 -18.902 -4.232 1596 HG3 ARG 6 1HG ARG 6 18.408 -19.178 -5.544 1597 HD2 ARG 6 2HD ARG 6 19.737 -17.958 -4.086 1598 HD3 ARG 6 1HD ARG 6 19.146 -16.698 -5.244 1599 HE ARG 6 HE ARG 6 17.463 -16.909 -2.829 1600 HH11 ARG 6 1HH2 ARG 6 20.537 -15.441 -4.163 1601 HH12 ARG 6 2HH2 ARG 6 20.816 -14.546 -2.714 1602 HH21 ARG 6 1HH1 ARG 6 17.958 -15.441 -0.851 1603 HH22 ARG 6 2HH1 ARG 6 19.330 -14.464 -0.997 1604 H GLU 7 H GLU 7 13.262 -17.078 -6.074 1605 HA GLU 7 HA GLU 7 13.359 -15.953 -8.747 1606 HB2 GLU 7 2HB GLU 7 11.891 -18.014 -7.971 1607 HB3 GLU 7 1HB GLU 7 10.840 -16.783 -7.202 1608 HG2 GLU 7 2HG GLU 7 9.882 -17.299 -9.350 1609 HG3 GLU 7 1HG GLU 7 10.644 -15.680 -9.554 1610 H ALA 8 H ALA 8 11.964 -15.384 -5.492 1611 HA ALA 8 HA ALA 8 10.838 -12.893 -6.000 1612 HB1 ALA 8 1HB ALA 8 10.319 -14.179 -3.912 1613 HB2 ALA 8 2HB ALA 8 10.946 -12.541 -3.510 1614 HB3 ALA 8 3HB ALA 8 12.025 -13.973 -3.357 1615 H GLN 9 H GLN 9 14.060 -13.770 -4.727 1616 HA GLN 9 HA GLN 9 15.094 -11.258 -4.359 1617 HB2 GLN 9 2HB GLN 9 16.217 -13.344 -3.595 1618 HB3 GLN 9 1HB GLN 9 16.415 -13.871 -5.296 1619 HG2 GLN 9 2HG GLN 9 18.572 -13.176 -4.347 1620 HG3 GLN 9 1HG GLN 9 18.107 -12.156 -5.744 1621 HE21 GLN 9 1HE2 GLN 9 16.557 -11.616 -2.517 1622 HE22 GLN 9 2HE2 GLN 9 17.086 -10.027 -2.427 1623 H LYS 10 H LYS 10 14.803 -13.092 -7.443 1624 HA LYS 10 HA LYS 10 16.604 -11.334 -8.753 1625 HB2 LYS 10 2HB LYS 10 15.927 -13.836 -9.378 1626 HB3 LYS 10 1HB LYS 10 14.571 -13.062 -10.251 1627 HG2 LYS 10 2HG LYS 10 16.391 -13.472 -11.826 1628 HG3 LYS 10 1HG LYS 10 16.321 -11.696 -11.545 1629 HD2 LYS 10 2HD LYS 10 18.192 -11.944 -9.847 1630 HD3 LYS 10 1HD LYS 10 18.299 -13.692 -10.241 1631 HE2 LYS 10 2HE LYS 10 19.106 -13.175 -12.522 1632 HE3 LYS 10 1HE LYS 10 18.708 -11.417 -12.311 1633 HZ1 LYS 10 3HZ LYS 10 21.087 -11.931 -11.998 1634 HZ2 LYS 10 1HZ LYS 10 20.713 -12.901 -10.667 1635 HZ3 LYS 10 2HZ LYS 10 20.334 -11.223 -10.625 1636 H ALA 11 H ALA 11 13.160 -11.332 -8.102 1637 HA ALA 11 HA ALA 11 12.476 -9.386 -10.061 1638 HB1 ALA 11 1HB ALA 11 11.059 -10.008 -7.389 1639 HB2 ALA 11 2HB ALA 11 10.745 -10.857 -8.946 1640 HB3 ALA 11 3HB ALA 11 10.368 -9.105 -8.784 1641 H GLU 12 H GLU 12 13.528 -9.288 -6.620 1642 HA GLU 12 HA GLU 12 13.214 -6.548 -6.241 1643 HB2 GLU 12 2HB GLU 12 15.378 -8.350 -4.988 1644 HB3 GLU 12 1HB GLU 12 14.901 -6.718 -4.413 1645 HG2 GLU 12 2HG GLU 12 12.573 -7.604 -3.906 1646 HG3 GLU 12 1HG GLU 12 13.130 -9.247 -4.392 1647 H GLU 13 H GLU 13 15.965 -8.416 -7.597 1648 HA GLU 13 HA GLU 13 17.796 -6.344 -7.749 1649 HB2 GLU 13 2HB GLU 13 17.475 -8.677 -9.739 1650 HB3 GLU 13 1HB GLU 13 18.878 -7.559 -9.681 1651 HG2 GLU 13 2HG GLU 13 19.430 -8.368 -7.354 1652 HG3 GLU 13 1HG GLU 13 18.072 -9.542 -7.468 1653 H GLU 14 H GLU 14 15.158 -7.212 -9.946 1654 HA GLU 14 HA GLU 14 15.937 -5.653 -12.134 1655 HB2 GLU 14 2HB GLU 14 14.221 -7.596 -12.077 1656 HB3 GLU 14 1HB GLU 14 13.083 -6.457 -11.304 1657 HG2 GLU 14 2HG GLU 14 12.441 -6.532 -13.573 1658 HG3 GLU 14 1HG GLU 14 13.317 -4.968 -13.436 1659 H LEU 15 H LEU 15 13.908 -4.994 -9.256 1660 HA LEU 15 HA LEU 15 12.877 -2.575 -10.176 1661 HB2 LEU 15 2HB LEU 15 11.934 -3.890 -8.261 1662 HB3 LEU 15 1HB LEU 15 13.356 -3.458 -7.265 1663 HG LEU 15 HG LEU 15 12.708 -1.082 -7.275 1664 HD11 LEU 15 1HD1 LEU 15 10.503 -0.346 -8.340 1665 HD12 LEU 15 2HD1 LEU 15 10.463 -1.917 -9.219 1666 HD13 LEU 15 3HD1 LEU 15 11.793 -0.738 -9.516 1667 HD21 LEU 15 3HD2 LEU 15 10.291 -2.905 -6.654 1668 HD22 LEU 15 1HD2 LEU 15 10.554 -1.242 -6.017 1669 HD23 LEU 15 2HD2 LEU 15 11.681 -2.568 -5.562 1670 H GLN 16 H GLN 16 15.848 -3.339 -8.382 1671 HA GLN 16 HA GLN 16 16.582 -0.727 -7.715 1672 HB2 GLN 16 2HB GLN 16 18.425 -3.071 -8.409 1673 HB3 GLN 16 1HB GLN 16 18.908 -1.593 -7.500 1674 HG2 GLN 16 2HG GLN 16 17.346 -2.175 -5.638 1675 HG3 GLN 16 1HG GLN 16 16.824 -3.665 -6.498 1676 HE21 GLN 16 1HE2 GLN 16 19.189 -4.666 -7.552 1677 HE22 GLN 16 2HE2 GLN 16 20.351 -5.015 -6.309 1678 H LYS 17 H LYS 17 16.906 -2.524 -10.737 1679 HA LYS 17 HA LYS 17 18.863 -0.866 -11.952 1680 HB2 LYS 17 2HB LYS 17 18.225 -3.232 -12.699 1681 HB3 LYS 17 1HB LYS 17 16.637 -2.591 -13.200 1682 HG2 LYS 17 2HG LYS 17 17.945 -1.042 -14.869 1683 HG3 LYS 17 1HG LYS 17 19.385 -2.032 -14.442 1684 HD2 LYS 17 2HD LYS 17 18.513 -3.076 -16.406 1685 HD3 LYS 17 1HD LYS 17 17.942 -4.101 -15.043 1686 HE2 LYS 17 2HE LYS 17 15.723 -2.568 -15.199 1687 HE3 LYS 17 1HE LYS 17 16.354 -2.146 -16.840 1688 HZ1 LYS 17 3HZ LYS 17 16.441 -4.657 -17.217 1689 HZ2 LYS 17 1HZ LYS 17 14.890 -4.035 -17.018 1690 HZ3 LYS 17 2HZ LYS 17 15.658 -4.827 -15.732 1691 H VAL 18 H VAL 18 15.301 -0.896 -11.764 1692 HA VAL 18 HA VAL 18 14.875 1.083 -13.725 1693 HB VAL 18 HB VAL 18 13.057 0.181 -11.429 1694 HG11 VAL 18 1HG1 VAL 18 12.291 2.366 -12.373 1695 HG12 VAL 18 2HG1 VAL 18 11.206 1.048 -12.919 1696 HG13 VAL 18 3HG1 VAL 18 12.439 1.721 -14.051 1697 HG21 VAL 18 3HG2 VAL 18 13.734 -1.724 -12.923 1698 HG22 VAL 18 1HG2 VAL 18 13.298 -0.758 -14.377 1699 HG23 VAL 18 2HG2 VAL 18 12.025 -1.280 -13.212 1700 H LEU 19 H LEU 19 15.529 1.170 -10.209 1701 HA LEU 19 HA LEU 19 14.830 3.807 -9.715 1702 HB2 LEU 19 2HB LEU 19 17.311 2.379 -8.564 1703 HB3 LEU 19 1HB LEU 19 16.521 3.844 -7.893 1704 HG LEU 19 HG LEU 19 15.290 1.029 -8.041 1705 HD11 LEU 19 1HD1 LEU 19 15.557 1.024 -5.569 1706 HD12 LEU 19 2HD1 LEU 19 16.335 2.649 -5.629 1707 HD13 LEU 19 3HD1 LEU 19 17.155 1.228 -6.380 1708 HD21 LEU 19 3HD2 LEU 19 13.511 1.998 -6.537 1709 HD22 LEU 19 1HD2 LEU 19 13.475 2.681 -8.200 1710 HD23 LEU 19 2HD2 LEU 19 14.180 3.639 -6.846 1711 H GLU 20 H GLU 20 17.893 2.453 -10.989 1712 HA GLU 20 HA GLU 20 19.255 4.923 -10.989 1713 HB2 GLU 20 2HB GLU 20 19.782 2.344 -12.545 1714 HB3 GLU 20 1HB GLU 20 20.921 3.728 -12.484 1715 HG2 GLU 20 2HG GLU 20 19.961 2.225 -9.947 1716 HG3 GLU 20 1HG GLU 20 21.407 1.739 -10.893 1717 H GLU 21 H GLU 21 17.284 3.208 -13.490 1718 HA GLU 21 HA GLU 21 17.799 5.136 -15.523 1719 HB2 GLU 21 2HB GLU 21 15.300 3.349 -15.170 1720 HB3 GLU 21 1HB GLU 21 15.561 4.489 -16.530 1721 HG2 GLU 21 2HG GLU 21 17.720 3.175 -17.088 1722 HG3 GLU 21 1HG GLU 21 17.103 1.902 -15.969 1723 H ALA 22 H ALA 22 15.306 4.781 -12.985 1724 HA ALA 22 HA ALA 22 13.658 6.842 -13.716 1725 HB1 ALA 22 1HB ALA 22 12.836 6.833 -11.347 1726 HB2 ALA 22 2HB ALA 22 14.260 5.840 -10.869 1727 HB3 ALA 22 3HB ALA 22 13.025 5.156 -11.980 1728 H SER 23 H SER 23 16.650 6.973 -11.703 1729 HA SER 23 HA SER 23 16.445 9.577 -10.871 1730 HB2 SER 23 2HB SER 23 19.011 8.143 -11.834 1731 HB3 SER 23 1HB SER 23 18.916 9.490 -10.634 1732 HG SER 23 1HG SER 23 19.020 7.128 -9.962 1733 H LYS 24 H LYS 24 17.762 8.277 -13.923 1734 HA LYS 24 HA LYS 24 18.687 10.767 -14.928 1735 HB2 LYS 24 2HB LYS 24 19.710 8.630 -15.565 1736 HB3 LYS 24 1HB LYS 24 18.170 8.025 -16.236 1737 HG2 LYS 24 2HG LYS 24 19.623 10.491 -17.412 1738 HG3 LYS 24 1HG LYS 24 20.059 8.795 -17.814 1739 HD2 LYS 24 2HD LYS 24 17.356 8.645 -18.221 1740 HD3 LYS 24 1HD LYS 24 17.602 10.355 -18.671 1741 HE2 LYS 24 2HE LYS 24 19.177 7.917 -19.802 1742 HE3 LYS 24 1HE LYS 24 17.743 8.669 -20.601 1743 HZ1 LYS 24 3HZ LYS 24 20.070 10.417 -20.015 1744 HZ2 LYS 24 1HZ LYS 24 18.903 10.430 -21.257 1745 HZ3 LYS 24 2HZ LYS 24 20.156 9.259 -21.243 1746 H LYS 25 H LYS 25 15.794 8.706 -15.437 1747 HA LYS 25 HA LYS 25 14.673 10.419 -17.381 1748 HB2 LYS 25 2HB LYS 25 13.290 8.341 -15.603 1749 HB3 LYS 25 1HB LYS 25 12.554 9.173 -17.022 1750 HG2 LYS 25 2HG LYS 25 14.360 8.225 -18.507 1751 HG3 LYS 25 1HG LYS 25 15.052 7.354 -17.110 1752 HD2 LYS 25 2HD LYS 25 13.820 5.756 -18.305 1753 HD3 LYS 25 1HD LYS 25 12.820 6.108 -16.853 1754 HE2 LYS 25 2HE LYS 25 11.263 7.514 -18.216 1755 HE3 LYS 25 1HE LYS 25 12.401 7.451 -19.617 1756 HZ1 LYS 25 3HZ LYS 25 12.005 4.982 -19.622 1757 HZ2 LYS 25 1HZ LYS 25 10.724 6.050 -20.076 1758 HZ3 LYS 25 2HZ LYS 25 10.657 5.272 -18.580 1759 H ALA 26 H ALA 26 14.363 10.306 -13.792 1760 HA ALA 26 HA ALA 26 12.221 12.131 -13.708 1761 HB1 ALA 26 1HB ALA 26 12.714 10.654 -11.753 1762 HB2 ALA 26 2HB ALA 26 12.768 12.387 -11.271 1763 HB3 ALA 26 3HB ALA 26 14.303 11.470 -11.527 1764 H VAL 27 H VAL 27 15.818 12.535 -13.396 1765 HA VAL 27 HA VAL 27 15.507 15.242 -12.690 1766 HB VAL 27 HB VAL 27 17.472 13.807 -12.122 1767 HG11 VAL 27 1HG1 VAL 27 18.415 14.446 -15.001 1768 HG12 VAL 27 2HG1 VAL 27 17.896 12.833 -14.395 1769 HG13 VAL 27 3HG1 VAL 27 19.353 13.622 -13.704 1770 HG21 VAL 27 3HG2 VAL 27 19.069 15.709 -12.189 1771 HG22 VAL 27 1HG2 VAL 27 17.411 16.252 -11.745 1772 HG23 VAL 27 2HG2 VAL 27 18.042 16.559 -13.404 1773 H GLU 28 H GLU 28 15.728 13.599 -15.866 1774 HA GLU 28 HA GLU 28 16.004 16.174 -17.149 1775 HB2 GLU 28 2HB GLU 28 16.024 15.155 -19.241 1776 HB3 GLU 28 1HB GLU 28 17.100 14.196 -18.180 1777 HG2 GLU 28 2HG GLU 28 15.352 12.427 -17.960 1778 HG3 GLU 28 1HG GLU 28 14.211 13.380 -18.967 1779 H ALA 29 H ALA 29 13.382 14.373 -15.836 1780 HA ALA 29 HA ALA 29 11.448 14.959 -17.785 1781 HB1 ALA 29 1HB ALA 29 11.115 13.222 -15.968 1782 HB2 ALA 29 2HB ALA 29 9.778 14.405 -16.087 1783 HB3 ALA 29 3HB ALA 29 10.998 14.553 -14.762 1784 H GLU 30 H GLU 30 12.478 16.603 -14.768 1785 HA GLU 30 HA GLU 30 10.642 18.751 -15.214 1786 HB2 GLU 30 2HB GLU 30 12.904 18.330 -13.207 1787 HB3 GLU 30 1HB GLU 30 11.814 19.754 -13.205 1788 HG2 GLU 30 2HG GLU 30 10.804 16.833 -12.974 1789 HG3 GLU 30 1HG GLU 30 11.107 17.936 -11.585 1790 H ARG 31 H ARG 31 13.620 17.989 -16.632 1791 HA ARG 31 HA ARG 31 14.486 20.755 -16.961 1792 HB2 ARG 31 2HB ARG 31 15.433 18.147 -18.259 1793 HB3 ARG 31 1HB ARG 31 16.087 19.744 -18.710 1794 HG2 ARG 31 2HG ARG 31 16.122 18.729 -15.804 1795 HG3 ARG 31 1HG ARG 31 17.395 18.249 -16.962 1796 HD2 ARG 31 2HD ARG 31 16.721 21.177 -16.167 1797 HD3 ARG 31 1HD ARG 31 18.098 20.173 -15.530 1798 HE ARG 31 HE ARG 31 18.088 20.206 -18.442 1799 HH11 ARG 31 1HH2 ARG 31 18.929 22.287 -15.620 1800 HH12 ARG 31 2HH2 ARG 31 20.193 23.120 -16.414 1801 HH21 ARG 31 1HH1 ARG 31 19.956 21.297 -19.517 1802 HH22 ARG 31 2HH1 ARG 31 20.823 22.475 -18.674 1803 H GLY 32 H GLY 32 12.414 21.500 -17.734 1804 HA2 GLY 32 2HA GLY 32 12.077 22.404 -20.054 1805 HA3 GLY 32 1HA GLY 32 11.757 20.675 -20.483 1806 H ALA 33 H ALA 33 10.769 21.095 -17.257 1807 HA ALA 33 HA ALA 33 8.020 21.456 -18.152 1808 HB1 ALA 33 1HB ALA 33 7.377 20.199 -16.100 1809 HB2 ALA 33 2HB ALA 33 9.092 20.121 -15.596 1810 HB3 ALA 33 3HB ALA 33 8.549 19.226 -17.056 1811 HA PRO 34 HA PRO 34 8.361 25.011 -15.451 1812 HB2 PRO 34 2HB PRO 34 5.732 25.842 -15.262 1813 HB3 PRO 34 1HB PRO 34 6.649 25.853 -16.817 1814 HG2 PRO 34 2HG PRO 34 4.677 23.733 -15.817 1815 HG3 PRO 34 1HG PRO 34 4.742 24.513 -17.450 1816 HD2 PRO 34 2HD PRO 34 5.914 22.024 -16.862 1817 HD3 PRO 34 1HD PRO 34 6.600 23.168 -18.106 1818 H GLY 35 H GLY 35 9.034 24.640 -13.268 1819 HA2 GLY 35 2HA GLY 35 7.575 25.096 -11.143 1820 HA3 GLY 35 1HA GLY 35 7.249 23.321 -11.435 1821 H ALA 36 H ALA 36 9.428 22.399 -12.602 1822 HA ALA 36 HA ALA 36 11.454 21.836 -12.577 1823 HB1 ALA 36 1HB ALA 36 12.205 24.218 -10.776 1824 HB2 ALA 36 2HB ALA 36 12.383 24.117 -12.563 1825 HB3 ALA 36 3HB ALA 36 13.359 23.035 -11.506 1826 H ALA 37 H ALA 37 11.511 23.057 -9.242 1827 HA ALA 37 HA ALA 37 11.633 22.048 -7.307 1828 HB1 ALA 37 1HB ALA 37 10.275 20.060 -6.747 1829 HB2 ALA 37 2HB ALA 37 10.004 19.742 -8.496 1830 HB3 ALA 37 3HB ALA 37 9.341 21.229 -7.745 1831 H LEU 38 H LEU 38 12.043 19.221 -9.519 1832 HA LEU 38 HA LEU 38 14.356 18.404 -7.881 1833 HB2 LEU 38 2HB LEU 38 12.410 16.792 -8.129 1834 HB3 LEU 38 1HB LEU 38 12.713 16.734 -9.884 1835 HG LEU 38 HG LEU 38 14.940 16.030 -7.881 1836 HD11 LEU 38 1HD1 LEU 38 14.180 13.652 -7.886 1837 HD12 LEU 38 2HD1 LEU 38 12.725 14.111 -8.840 1838 HD13 LEU 38 3HD1 LEU 38 12.926 14.721 -7.165 1839 HD21 LEU 38 3HD2 LEU 38 14.303 14.990 -10.717 1840 HD22 LEU 38 1HD2 LEU 38 15.675 14.447 -9.686 1841 HD23 LEU 38 2HD2 LEU 38 15.623 16.134 -10.297 1842 H ILE 39 H ILE 39 16.343 18.968 -8.814 1843 HA ILE 39 HA ILE 39 16.575 18.604 -11.686 1844 HB ILE 39 HB ILE 39 15.699 20.910 -11.261 1845 HG12 ILE 39 2HG1 ILE 39 18.519 20.880 -12.475 1846 HG13 ILE 39 1HG1 ILE 39 17.005 20.324 -13.278 1847 HG21 ILE 39 1HG2 ILE 39 18.401 21.428 -9.847 1848 HG22 ILE 39 2HG2 ILE 39 16.801 21.276 -9.025 1849 HG23 ILE 39 3HG2 ILE 39 17.099 22.621 -10.166 1850 HD11 ILE 39 3HD ILE 39 17.591 23.199 -12.281 1851 HD12 ILE 39 1HD ILE 39 17.516 22.653 -13.991 1852 HD13 ILE 39 2HD ILE 39 16.025 22.647 -12.982 1853 H SER 40 H SER 40 17.549 17.431 -8.971 1854 HA SER 40 HA SER 40 20.403 18.153 -9.164 1855 HB2 SER 40 2HB SER 40 19.203 18.837 -7.023 1856 HB3 SER 40 1HB SER 40 18.755 17.119 -6.775 1857 HG SER 40 1HG SER 40 20.486 17.475 -5.584 1858 H TYR 41 H TYR 41 21.709 16.472 -9.722 1859 HA TYR 41 HA TYR 41 20.591 13.957 -10.469 1860 HB2 TYR 41 2HB TYR 41 23.380 15.188 -10.547 1861 HB3 TYR 41 1HB TYR 41 23.280 13.399 -10.527 1862 HD1 TYR 41 1HD TYR 41 22.013 16.408 -12.440 1863 HD2 TYR 41 2HD TYR 41 22.796 12.178 -12.415 1864 HE1 TYR 41 1HE TYR 41 21.699 16.335 -14.879 1865 HE2 TYR 41 2HE TYR 41 22.499 12.097 -14.849 1866 HH TYR 41 HH TYR 41 21.460 14.907 -16.738 1867 HA PRO 42 HA PRO 42 22.813 11.970 -6.952 1868 HB2 PRO 42 2HB PRO 42 23.813 13.329 -4.706 1869 HB3 PRO 42 1HB PRO 42 24.771 13.067 -6.213 1870 HG2 PRO 42 2HG PRO 42 23.144 15.556 -5.443 1871 HG3 PRO 42 1HG PRO 42 24.852 15.480 -6.044 1872 HD2 PRO 42 2HD PRO 42 22.742 16.003 -7.728 1873 HD3 PRO 42 1HD PRO 42 24.123 14.946 -8.287 1874 H ASP 43 H ASP 43 20.528 14.549 -6.413 1875 HA ASP 43 HA ASP 43 19.454 13.209 -4.037 1876 HB2 ASP 43 2HB ASP 43 18.192 15.553 -5.565 1877 HB3 ASP 43 1HB ASP 43 17.619 14.823 -4.026 1878 H ALA 44 H ALA 44 19.150 13.173 -7.539 1879 HA ALA 44 HA ALA 44 16.405 12.627 -7.719 1880 HB1 ALA 44 1HB ALA 44 16.894 11.780 -10.025 1881 HB2 ALA 44 2HB ALA 44 18.660 11.785 -9.655 1882 HB3 ALA 44 3HB ALA 44 17.745 13.332 -9.731 1883 H ILE 45 H ILE 45 19.262 10.628 -7.247 1884 HA ILE 45 HA ILE 45 17.947 8.151 -7.589 1885 HB ILE 45 HB ILE 45 20.188 8.184 -8.155 1886 HG12 ILE 45 2HG1 ILE 45 20.162 6.839 -5.387 1887 HG13 ILE 45 1HG1 ILE 45 19.473 6.150 -6.889 1888 HG21 ILE 45 1HG2 ILE 45 20.953 10.244 -7.133 1889 HG22 ILE 45 2HG2 ILE 45 22.028 8.950 -6.557 1890 HG23 ILE 45 3HG2 ILE 45 20.754 9.581 -5.470 1891 HD11 ILE 45 3HD ILE 45 22.454 6.835 -6.407 1892 HD12 ILE 45 1HD ILE 45 21.715 5.204 -6.496 1893 HD13 ILE 45 2HD ILE 45 21.762 6.228 -7.967 1894 H TRP 46 H TRP 46 18.193 10.392 -4.908 1895 HA TRP 46 HA TRP 46 17.653 8.361 -2.915 1896 HB2 TRP 46 2HB TRP 46 18.290 11.269 -2.949 1897 HB3 TRP 46 1HB TRP 46 16.940 10.918 -1.840 1898 HD1 TRP 46 HD TRP 46 17.879 10.881 0.526 1899 HE1 TRP 46 1HE TRP 46 20.023 10.096 1.695 1900 HE3 TRP 46 3HE TRP 46 20.288 8.923 -3.522 1901 HZ2 TRP 46 2HZ TRP 46 22.370 8.628 1.010 1902 HZ3 TRP 46 3HZ TRP 46 22.500 7.877 -3.220 1903 HH2 TRP 46 HH TRP 46 23.535 7.733 -0.980 1904 H TRP 47 H TRP 47 15.930 10.870 -4.754 1905 HA TRP 47 HA TRP 47 13.433 10.456 -3.512 1906 HB2 TRP 47 2HB TRP 47 14.141 12.536 -4.741 1907 HB3 TRP 47 1HB TRP 47 14.131 11.612 -6.285 1908 HD1 TRP 47 HD TRP 47 11.543 12.514 -3.408 1909 HE1 TRP 47 1HE TRP 47 9.341 13.065 -4.528 1910 HE3 TRP 47 3HE TRP 47 12.820 11.187 -8.166 1911 HZ2 TRP 47 2HZ TRP 47 8.147 12.609 -7.134 1912 HZ3 TRP 47 3HZ TRP 47 11.081 11.217 -9.933 1913 HH2 TRP 47 HH TRP 47 8.783 11.955 -9.426 1914 H SER 48 H SER 48 15.082 8.895 -6.345 1915 HA SER 48 HA SER 48 12.696 7.783 -7.299 1916 HB2 SER 48 2HB SER 48 14.099 6.250 -8.672 1917 HB3 SER 48 1HB SER 48 14.476 8.001 -8.875 1918 HG SER 48 1HG SER 48 16.361 6.838 -8.701 1919 H VAL 49 H VAL 49 14.870 6.762 -4.671 1920 HA VAL 49 HA VAL 49 14.074 4.095 -4.636 1921 HB VAL 49 HB VAL 49 14.633 5.567 -2.028 1922 HG11 VAL 49 1HG1 VAL 49 15.218 2.703 -3.084 1923 HG12 VAL 49 2HG1 VAL 49 13.870 3.141 -1.980 1924 HG13 VAL 49 3HG1 VAL 49 15.565 3.318 -1.424 1925 HG21 VAL 49 3HG2 VAL 49 16.633 4.728 -4.230 1926 HG22 VAL 49 1HG2 VAL 49 17.088 4.997 -2.501 1927 HG23 VAL 49 2HG2 VAL 49 16.405 6.343 -3.457 1928 H GLU 50 H GLU 50 12.697 6.928 -2.845 1929 HA GLU 50 HA GLU 50 10.670 5.315 -1.683 1930 HB2 GLU 50 2HB GLU 50 9.785 7.541 -0.835 1931 HB3 GLU 50 1HB GLU 50 11.481 7.161 -0.426 1932 HG2 GLU 50 2HG GLU 50 12.220 8.636 -2.421 1933 HG3 GLU 50 1HG GLU 50 10.513 9.187 -2.548 1934 H THR 51 H THR 51 10.984 6.619 -4.799 1935 HA THR 51 HA THR 51 8.151 7.008 -5.232 1936 HB THR 51 HB THR 51 10.526 6.994 -7.151 1937 HG1 THR 51 1HG THR 51 10.543 8.756 -5.779 1938 HG21 THR 51 3HG2 THR 51 8.880 8.120 -8.739 1939 HG22 THR 51 1HG2 THR 51 7.544 7.715 -7.599 1940 HG23 THR 51 2HG2 THR 51 8.460 6.403 -8.413 1941 H ALA 52 H ALA 52 10.571 4.394 -5.584 1942 HA ALA 52 HA ALA 52 8.939 2.806 -7.293 1943 HB1 ALA 52 1HB ALA 52 11.371 2.394 -7.163 1944 HB2 ALA 52 2HB ALA 52 10.488 0.928 -6.610 1945 HB3 ALA 52 3HB ALA 52 11.244 2.029 -5.398 1946 H THR 53 H THR 53 9.324 3.067 -3.677 1947 HA THR 53 HA THR 53 7.468 0.921 -3.339 1948 HB THR 53 HB THR 53 7.782 1.949 -0.837 1949 HG1 THR 53 1HG THR 53 10.159 2.387 -0.886 1950 HG21 THR 53 3HG2 THR 53 9.792 0.184 -2.391 1951 HG22 THR 53 1HG2 THR 53 8.215 -0.378 -1.709 1952 HG23 THR 53 2HG2 THR 53 9.499 0.209 -0.603 1953 H THR 54 H THR 54 7.001 3.961 -4.440 1954 HA THR 54 HA THR 54 5.280 5.202 -4.741 1955 HB THR 54 HB THR 54 3.068 4.296 -4.868 1956 HG1 THR 54 1HG THR 54 4.084 2.454 -3.012 1957 HG21 THR 54 3HG2 THR 54 4.961 3.485 -6.444 1958 HG22 THR 54 1HG2 THR 54 3.538 2.382 -6.321 1959 HG23 THR 54 2HG2 THR 54 5.068 1.991 -5.463 1960 H VAL 55 H VAL 55 6.587 5.210 -2.018 1961 HA VAL 55 HA VAL 55 4.374 5.748 -0.247 1962 HB VAL 55 HB VAL 55 7.355 6.249 0.269 1963 HG11 VAL 55 1HG1 VAL 55 5.767 7.446 1.829 1964 HG12 VAL 55 2HG1 VAL 55 6.573 6.076 2.675 1965 HG13 VAL 55 3HG1 VAL 55 4.870 5.918 2.107 1966 HG21 VAL 55 3HG2 VAL 55 5.566 3.749 0.628 1967 HG22 VAL 55 1HG2 VAL 55 7.160 3.962 1.435 1968 HG23 VAL 55 2HG2 VAL 55 7.072 3.898 -0.351 1969 H GLY 56 H GLY 56 7.110 7.595 -1.709 1970 HA2 GLY 56 2HA GLY 56 7.240 9.754 -2.298 1971 HA3 GLY 56 1HA GLY 56 5.447 9.679 -2.489 1972 H TYR 57 H TYR 57 7.490 9.391 0.412 1973 HA TYR 57 HA TYR 57 5.723 10.557 2.096 1974 HB2 TYR 57 2HB TYR 57 8.010 9.193 2.479 1975 HB3 TYR 57 1HB TYR 57 8.757 10.812 2.645 1976 HD1 TYR 57 1HD TYR 57 7.109 12.412 4.371 1977 HD2 TYR 57 2HD TYR 57 7.551 8.133 4.447 1978 HE1 TYR 57 1HE TYR 57 6.322 12.374 6.675 1979 HE2 TYR 57 2HE TYR 57 6.822 8.111 6.805 1980 HH TYR 57 HH TYR 57 5.671 9.342 8.452 1981 H GLY 58 H GLY 58 8.373 12.165 0.240 1982 HA2 GLY 58 2HA GLY 58 7.186 14.437 -0.203 1983 HA3 GLY 58 1HA GLY 58 7.885 14.713 1.462 1984 H ASP 59 H ASP 59 9.857 15.541 1.365 1985 HA ASP 59 HA ASP 59 11.769 16.193 0.796 1986 HB2 ASP 59 2HB ASP 59 12.522 13.719 0.707 1987 HB3 ASP 59 1HB ASP 59 12.545 13.902 -1.062 1988 H ARG 60 H ARG 60 10.967 14.647 -2.379 1989 HA ARG 60 HA ARG 60 10.803 17.389 -3.440 1990 HB2 ARG 60 2HB ARG 60 12.225 15.077 -4.856 1991 HB3 ARG 60 1HB ARG 60 11.848 16.684 -5.572 1992 HG2 ARG 60 2HG ARG 60 13.226 17.768 -3.717 1993 HG3 ARG 60 1HG ARG 60 13.709 16.124 -3.176 1994 HD2 ARG 60 2HD ARG 60 14.800 15.678 -5.372 1995 HD3 ARG 60 1HD ARG 60 14.271 17.287 -5.994 1996 HE ARG 60 HE ARG 60 16.373 16.725 -3.921 1997 HH11 ARG 60 1HH2 ARG 60 14.426 19.410 -5.331 1998 HH12 ARG 60 2HH2 ARG 60 15.717 20.497 -5.451 1999 HH21 ARG 60 1HH1 ARG 60 18.244 18.236 -4.206 2000 HH22 ARG 60 2HH1 ARG 60 17.891 19.879 -4.418 2001 H TYR 61 H TYR 61 9.598 17.248 -5.735 2002 HA TYR 61 HA TYR 61 7.675 15.171 -5.768 2003 HB2 TYR 61 2HB TYR 61 5.807 17.106 -5.836 2004 HB3 TYR 61 1HB TYR 61 6.335 16.441 -4.249 2005 HD1 TYR 61 1HD TYR 61 6.611 19.396 -6.512 2006 HD2 TYR 61 2HD TYR 61 7.608 17.721 -2.676 2007 HE1 TYR 61 1HE TYR 61 7.280 21.629 -5.711 2008 HE2 TYR 61 2HE TYR 61 8.293 19.940 -1.874 2009 HH TYR 61 HH TYR 61 7.827 22.893 -3.796 2010 HA PRO 62 HA PRO 62 8.438 16.967 -9.852 2011 HB2 PRO 62 2HB PRO 62 6.585 15.634 -11.374 2012 HB3 PRO 62 1HB PRO 62 7.901 14.702 -10.558 2013 HG2 PRO 62 2HG PRO 62 4.987 15.031 -9.689 2014 HG3 PRO 62 1HG PRO 62 6.009 13.532 -9.658 2015 HD2 PRO 62 2HD PRO 62 5.564 15.381 -7.492 2016 HD3 PRO 62 1HD PRO 62 6.892 14.145 -7.551 2017 H VAL 63 H VAL 63 7.033 18.176 -11.639 2018 HA VAL 63 HA VAL 63 4.733 19.426 -10.257 2019 HB VAL 63 HB VAL 63 6.541 20.902 -10.870 2020 HG11 VAL 63 1HG1 VAL 63 6.926 19.688 -13.213 2021 HG12 VAL 63 2HG1 VAL 63 7.258 21.424 -12.991 2022 HG13 VAL 63 3HG1 VAL 63 5.750 20.918 -13.811 2023 HG21 VAL 63 3HG2 VAL 63 3.796 21.510 -12.156 2024 HG22 VAL 63 1HG2 VAL 63 5.019 22.705 -11.599 2025 HG23 VAL 63 2HG2 VAL 63 4.210 21.632 -10.409 2026 H THR 64 H THR 64 4.445 19.846 -13.565 2027 HA THR 64 HA THR 64 2.324 17.807 -13.547 2028 HB THR 64 HB THR 64 2.424 20.333 -15.265 2029 HG1 THR 64 1HG THR 64 0.992 21.127 -13.726 2030 HG21 THR 64 3HG2 THR 64 0.897 18.434 -16.030 2031 HG22 THR 64 1HG2 THR 64 -0.042 19.853 -15.459 2032 HG23 THR 64 2HG2 THR 64 0.141 18.412 -14.398 2033 H GLU 65 H GLU 65 3.966 19.545 -16.250 2034 HA GLU 65 HA GLU 65 3.615 17.484 -17.999 2035 HB2 GLU 65 2HB GLU 65 4.265 20.055 -18.358 2036 HB3 GLU 65 1HB GLU 65 5.939 19.470 -18.236 2037 HG2 GLU 65 2HG GLU 65 5.695 19.404 -20.528 2038 HG3 GLU 65 1HG GLU 65 5.176 17.729 -20.156 2039 H GLU 66 H GLU 66 4.644 15.521 -18.162 2040 HA GLU 66 HA GLU 66 6.164 14.052 -18.305 2041 HB2 GLU 66 2HB GLU 66 7.484 16.058 -19.282 2042 HB3 GLU 66 1HB GLU 66 8.519 15.907 -17.839 2043 HG2 GLU 66 2HG GLU 66 9.206 13.631 -18.517 2044 HG3 GLU 66 1HG GLU 66 7.873 13.532 -19.722 2045 H GLY 67 H GLY 67 7.445 16.094 -15.594 2046 HA2 GLY 67 2HA GLY 67 8.785 14.353 -14.130 2047 HA3 GLY 67 1HA GLY 67 7.732 15.627 -13.437 2048 H ARG 68 H ARG 68 5.285 14.708 -13.847 2049 HA ARG 68 HA ARG 68 5.027 12.810 -11.773 2050 HB2 ARG 68 2HB ARG 68 3.643 14.870 -12.301 2051 HB3 ARG 68 1HB ARG 68 2.905 13.998 -13.675 2052 HG2 ARG 68 2HG ARG 68 1.765 12.451 -12.200 2053 HG3 ARG 68 1HG ARG 68 2.816 12.881 -10.814 2054 HD2 ARG 68 2HD ARG 68 0.729 14.775 -12.129 2055 HD3 ARG 68 1HD ARG 68 0.505 13.904 -10.578 2056 HE ARG 68 HE ARG 68 2.237 16.316 -11.059 2057 HH11 ARG 68 1HH2 ARG 68 2.060 13.445 -9.019 2058 HH12 ARG 68 2HH2 ARG 68 1.882 14.214 -7.565 2059 HH21 ARG 68 1HH1 ARG 68 2.133 17.540 -8.917 2060 HH22 ARG 68 2HH1 ARG 68 2.681 16.662 -7.576 2061 H LYS 69 H LYS 69 4.725 12.626 -15.339 2062 HA LYS 69 HA LYS 69 3.339 10.092 -15.217 2063 HB2 LYS 69 2HB LYS 69 3.145 11.953 -17.085 2064 HB3 LYS 69 1HB LYS 69 4.602 11.173 -17.777 2065 HG2 LYS 69 2HG LYS 69 1.831 9.889 -17.212 2066 HG3 LYS 69 1HG LYS 69 2.450 10.426 -18.810 2067 HD2 LYS 69 2HD LYS 69 4.353 8.704 -18.510 2068 HD3 LYS 69 1HD LYS 69 3.432 8.050 -17.114 2069 HE2 LYS 69 2HE LYS 69 2.306 8.197 -19.990 2070 HE3 LYS 69 1HE LYS 69 3.166 6.775 -19.283 2071 HZ1 LYS 69 3HZ LYS 69 1.393 6.735 -17.518 2072 HZ2 LYS 69 1HZ LYS 69 0.910 6.391 -19.104 2073 HZ3 LYS 69 2HZ LYS 69 0.553 7.902 -18.362 2074 H VAL 70 H VAL 70 6.661 11.350 -15.531 2075 HA VAL 70 HA VAL 70 7.831 8.868 -16.232 2076 HB VAL 70 HB VAL 70 8.936 11.319 -14.778 2077 HG11 VAL 70 1HG1 VAL 70 10.416 8.798 -15.805 2078 HG12 VAL 70 2HG1 VAL 70 10.333 9.377 -14.098 2079 HG13 VAL 70 3HG1 VAL 70 11.199 10.352 -15.325 2080 HG21 VAL 70 3HG2 VAL 70 10.018 11.681 -17.048 2081 HG22 VAL 70 1HG2 VAL 70 8.227 11.676 -17.166 2082 HG23 VAL 70 2HG2 VAL 70 9.164 10.230 -17.679 2083 H ALA 71 H ALA 71 7.085 10.421 -13.080 2084 HA ALA 71 HA ALA 71 8.170 8.433 -11.467 2085 HB1 ALA 71 1HB ALA 71 5.716 10.188 -10.825 2086 HB2 ALA 71 2HB ALA 71 7.423 10.735 -10.678 2087 HB3 ALA 71 3HB ALA 71 6.823 9.396 -9.643 2088 H GLU 72 H GLU 72 4.878 8.809 -12.811 2089 HA GLU 72 HA GLU 72 3.488 6.800 -11.681 2090 HB2 GLU 72 2HB GLU 72 2.663 8.487 -13.436 2091 HB3 GLU 72 1HB GLU 72 3.509 7.513 -14.672 2092 HG2 GLU 72 2HG GLU 72 1.929 5.528 -13.877 2093 HG3 GLU 72 1HG GLU 72 0.966 6.839 -13.103 2094 H GLN 73 H GLN 73 5.738 6.498 -14.457 2095 HA GLN 73 HA GLN 73 5.157 3.808 -15.028 2096 HB2 GLN 73 2HB GLN 73 6.313 5.241 -16.683 2097 HB3 GLN 73 1HB GLN 73 7.719 5.438 -15.584 2098 HG2 GLN 73 2HG GLN 73 8.356 3.078 -15.830 2099 HG3 GLN 73 1HG GLN 73 6.811 2.702 -16.670 2100 HE21 GLN 73 1HE2 GLN 73 7.283 2.260 -18.787 2101 HE22 GLN 73 2HE2 GLN 73 8.142 3.295 -19.862 2102 H VAL 74 H VAL 74 7.476 5.324 -12.794 2103 HA VAL 74 HA VAL 74 9.011 2.979 -12.361 2104 HB VAL 74 HB VAL 74 8.741 5.518 -10.662 2105 HG11 VAL 74 1HG1 VAL 74 10.944 3.333 -10.729 2106 HG12 VAL 74 2HG1 VAL 74 9.818 3.673 -9.366 2107 HG13 VAL 74 3HG1 VAL 74 11.047 4.894 -9.830 2108 HG21 VAL 74 3HG2 VAL 74 10.742 4.796 -12.917 2109 HG22 VAL 74 1HG2 VAL 74 10.744 6.300 -11.918 2110 HG23 VAL 74 2HG2 VAL 74 9.408 5.992 -13.058 2111 H MET 75 H MET 75 6.250 4.542 -10.745 2112 HA MET 75 HA MET 75 6.164 3.035 -8.426 2113 HB2 MET 75 2HB MET 75 3.872 4.212 -10.122 2114 HB3 MET 75 1HB MET 75 3.665 3.606 -8.446 2115 HG2 MET 75 2HG MET 75 5.117 5.328 -7.532 2116 HG3 MET 75 1HG MET 75 5.664 5.835 -9.143 2117 HE1 MET 75 3HE MET 75 5.295 8.257 -8.705 2118 HE2 MET 75 1HE MET 75 4.825 7.830 -7.029 2119 HE3 MET 75 2HE MET 75 3.813 8.969 -7.976 2120 H LYS 76 H LYS 76 4.686 2.422 -11.619 2121 HA LYS 76 HA LYS 76 3.299 0.101 -10.879 2122 HB2 LYS 76 2HB LYS 76 2.836 1.447 -12.938 2123 HB3 LYS 76 1HB LYS 76 4.401 0.922 -13.638 2124 HG2 LYS 76 2HG LYS 76 3.669 -1.418 -13.729 2125 HG3 LYS 76 1HG LYS 76 2.168 -1.067 -12.844 2126 HD2 LYS 76 2HD LYS 76 2.928 0.024 -15.647 2127 HD3 LYS 76 1HD LYS 76 1.901 -1.406 -15.329 2128 HE2 LYS 76 2HE LYS 76 1.202 1.527 -14.608 2129 HE3 LYS 76 1HE LYS 76 0.451 0.487 -15.885 2130 HZ1 LYS 76 3HZ LYS 76 -0.230 -1.049 -14.090 2131 HZ2 LYS 76 1HZ LYS 76 -0.967 0.455 -14.016 2132 HZ3 LYS 76 2HZ LYS 76 0.289 0.065 -12.932 2133 H ALA 77 H ALA 77 6.616 0.612 -12.077 2134 HA ALA 77 HA ALA 77 7.224 -2.097 -12.524 2135 HB1 ALA 77 1HB ALA 77 8.663 -0.218 -13.413 2136 HB2 ALA 77 2HB ALA 77 9.621 -1.400 -12.443 2137 HB3 ALA 77 3HB ALA 77 9.145 0.181 -11.721 2138 H GLY 78 H GLY 78 7.142 -0.104 -9.602 2139 HA2 GLY 78 2HA GLY 78 8.596 -1.971 -7.988 2140 HA3 GLY 78 1HA GLY 78 7.628 -0.535 -7.480 2141 H ILE 79 H ILE 79 5.123 -1.072 -8.342 2142 HA ILE 79 HA ILE 79 4.173 -2.726 -6.357 2143 HB ILE 79 HB ILE 79 2.817 -1.781 -8.920 2144 HG12 ILE 79 2HG1 ILE 79 2.627 -0.761 -6.004 2145 HG13 ILE 79 1HG1 ILE 79 3.668 -0.020 -7.248 2146 HG21 ILE 79 1HG2 ILE 79 0.631 -2.282 -7.740 2147 HG22 ILE 79 2HG2 ILE 79 1.542 -3.044 -6.391 2148 HG23 ILE 79 3HG2 ILE 79 1.561 -3.775 -8.038 2149 HD11 ILE 79 3HD ILE 79 0.580 -0.178 -7.329 2150 HD12 ILE 79 1HD ILE 79 1.591 1.274 -7.042 2151 HD13 ILE 79 2HD ILE 79 1.614 0.474 -8.659 2152 H GLU 80 H GLU 80 4.642 -3.495 -9.853 2153 HA GLU 80 HA GLU 80 3.526 -6.061 -9.652 2154 HB2 GLU 80 2HB GLU 80 5.578 -4.945 -11.648 2155 HB3 GLU 80 1HB GLU 80 4.772 -6.545 -11.797 2156 HG2 GLU 80 2HG GLU 80 2.520 -5.403 -11.854 2157 HG3 GLU 80 1HG GLU 80 3.339 -3.799 -11.814 2158 H VAL 81 H VAL 81 6.800 -4.893 -8.904 2159 HA VAL 81 HA VAL 81 8.005 -7.475 -8.934 2160 HB VAL 81 HB VAL 81 8.802 -4.728 -7.907 2161 HG11 VAL 81 1HG1 VAL 81 11.067 -5.733 -7.304 2162 HG12 VAL 81 2HG1 VAL 81 10.320 -7.368 -7.384 2163 HG13 VAL 81 3HG1 VAL 81 9.752 -6.167 -6.167 2164 HG21 VAL 81 3HG2 VAL 81 8.921 -5.331 -10.374 2165 HG22 VAL 81 1HG2 VAL 81 10.031 -6.692 -9.968 2166 HG23 VAL 81 2HG2 VAL 81 10.537 -4.990 -9.668 2167 H PHE 82 H PHE 82 6.731 -5.319 -6.323 2168 HA PHE 82 HA PHE 82 7.368 -7.151 -4.290 2169 HB2 PHE 82 2HB PHE 82 5.243 -4.909 -4.304 2170 HB3 PHE 82 1HB PHE 82 5.766 -5.812 -2.830 2171 HD1 PHE 82 1HD PHE 82 8.492 -5.980 -2.627 2172 HD2 PHE 82 2HD PHE 82 6.288 -2.825 -4.553 2173 HE1 PHE 82 1HE PHE 82 10.405 -4.447 -2.319 2174 HE2 PHE 82 2HE PHE 82 8.207 -1.305 -4.257 2175 HZ PHE 82 HZ PHE 82 10.274 -2.111 -3.134 2176 H ALA 83 H ALA 83 4.488 -6.758 -6.297 2177 HA ALA 83 HA ALA 83 2.763 -8.468 -4.981 2178 HB1 ALA 83 1HB ALA 83 2.141 -7.000 -6.935 2179 HB2 ALA 83 2HB ALA 83 1.662 -8.697 -7.250 2180 HB3 ALA 83 3HB ALA 83 3.141 -8.026 -8.023 2181 H LEU 84 H LEU 84 5.274 -9.179 -7.444 2182 HA LEU 84 HA LEU 84 4.613 -11.878 -7.749 2183 HB2 LEU 84 2HB LEU 84 5.843 -10.380 -9.366 2184 HB3 LEU 84 1HB LEU 84 7.299 -10.490 -8.340 2185 HG LEU 84 HG LEU 84 6.056 -13.119 -9.187 2186 HD11 LEU 84 1HD1 LEU 84 6.953 -13.031 -11.507 2187 HD12 LEU 84 2HD1 LEU 84 7.417 -11.303 -11.278 2188 HD13 LEU 84 3HD1 LEU 84 5.679 -11.784 -11.250 2189 HD21 LEU 84 3HD2 LEU 84 8.970 -12.095 -9.312 2190 HD22 LEU 84 1HD2 LEU 84 8.418 -13.786 -9.598 2191 HD23 LEU 84 2HD2 LEU 84 8.256 -13.052 -7.965 2192 H VAL 85 H VAL 85 6.506 -10.286 -5.258 2193 HA VAL 85 HA VAL 85 8.185 -12.383 -4.508 2194 HB VAL 85 HB VAL 85 6.943 -10.147 -2.829 2195 HG11 VAL 85 1HG1 VAL 85 9.302 -12.035 -2.153 2196 HG12 VAL 85 2HG1 VAL 85 7.750 -11.868 -1.252 2197 HG13 VAL 85 3HG1 VAL 85 8.916 -10.508 -1.279 2198 HG21 VAL 85 3HG2 VAL 85 9.195 -9.060 -3.219 2199 HG22 VAL 85 1HG2 VAL 85 8.319 -9.335 -4.753 2200 HG23 VAL 85 2HG2 VAL 85 9.669 -10.427 -4.290 2201 H THR 86 H THR 86 4.743 -12.048 -4.225 2202 HA THR 86 HA THR 86 4.223 -13.663 -2.079 2203 HB THR 86 HB THR 86 2.494 -13.448 -4.565 2204 HG1 THR 86 1HG THR 86 2.834 -11.423 -4.061 2205 HG21 THR 86 3HG2 THR 86 1.890 -13.876 -1.539 2206 HG22 THR 86 1HG2 THR 86 1.648 -15.064 -2.886 2207 HG23 THR 86 2HG2 THR 86 0.650 -13.582 -2.816 2208 H ALA 87 H ALA 87 5.485 -14.633 -5.218 2209 HA ALA 87 HA ALA 87 4.722 -17.299 -5.217 2210 HB1 ALA 87 1HB ALA 87 7.458 -16.124 -6.059 2211 HB2 ALA 87 2HB ALA 87 5.995 -16.164 -7.099 2212 HB3 ALA 87 3HB ALA 87 6.777 -17.710 -6.598 2213 H ALA 88 H ALA 88 6.825 -15.639 -3.029 2214 HA ALA 88 HA ALA 88 7.974 -18.138 -1.996 2215 HB1 ALA 88 1HB ALA 88 8.513 -15.187 -1.252 2216 HB2 ALA 88 2HB ALA 88 9.570 -16.197 -2.298 2217 HB3 ALA 88 3HB ALA 88 9.370 -16.602 -0.548 2218 H LEU 89 H LEU 89 5.629 -15.575 -1.305 2219 HA LEU 89 HA LEU 89 5.531 -16.183 1.510 2220 HB2 LEU 89 2HB LEU 89 3.633 -14.419 -0.132 2221 HB3 LEU 89 1HB LEU 89 3.817 -14.427 1.648 2222 HG LEU 89 HG LEU 89 6.033 -13.622 -0.353 2223 HD11 LEU 89 1HD1 LEU 89 4.122 -12.040 -0.481 2224 HD12 LEU 89 2HD1 LEU 89 5.552 -11.274 0.295 2225 HD13 LEU 89 3HD1 LEU 89 4.166 -11.830 1.303 2226 HD21 LEU 89 3HD2 LEU 89 5.898 -13.269 2.713 2227 HD22 LEU 89 1HD2 LEU 89 7.181 -12.633 1.625 2228 HD23 LEU 89 2HD2 LEU 89 6.980 -14.407 1.823 2229 H ALA 90 H ALA 90 3.499 -16.727 -1.415 2230 HA ALA 90 HA ALA 90 1.309 -17.812 -0.035 2231 HB1 ALA 90 1HB ALA 90 1.057 -16.985 -2.367 2232 HB2 ALA 90 2HB ALA 90 0.598 -18.707 -2.262 2233 HB3 ALA 90 3HB ALA 90 2.198 -18.233 -2.960 2234 H THR 91 H THR 91 4.387 -19.209 -1.256 2235 HA THR 91 HA THR 91 3.608 -21.886 -0.890 2236 HB THR 91 HB THR 91 6.226 -22.198 -0.498 2237 HG1 THR 91 1HG THR 91 6.516 -19.821 -0.243 2238 HG21 THR 91 3HG2 THR 91 5.174 -21.094 -3.174 2239 HG22 THR 91 1HG2 THR 91 4.913 -22.791 -2.592 2240 HG23 THR 91 2HG2 THR 91 6.578 -22.181 -2.920 2241 H ASP 92 H ASP 92 4.103 -19.396 1.537 2242 HA ASP 92 HA ASP 92 5.508 -21.167 3.247 2243 HB2 ASP 92 2HB ASP 92 5.871 -18.699 3.318 2244 HB3 ASP 92 1HB ASP 92 4.282 -18.525 4.117 2245 H PHE 93 H PHE 93 2.082 -20.641 2.635 2246 HA PHE 93 HA PHE 93 1.325 -21.978 5.075 2247 HB2 PHE 93 2HB PHE 93 -0.861 -21.689 4.597 2248 HB3 PHE 93 1HB PHE 93 -0.210 -20.379 3.576 2249 HD1 PHE 93 1HD PHE 93 -1.848 -23.691 3.643 2250 HD2 PHE 93 2HD PHE 93 -0.366 -20.547 1.122 2251 HE1 PHE 93 1HE PHE 93 -3.139 -24.604 1.743 2252 HE2 PHE 93 2HE PHE 93 -1.616 -21.476 -0.787 2253 HZ PHE 93 HZ PHE 93 -3.028 -23.496 -0.483 2254 H VAL 94 H VAL 94 2.052 -22.868 1.722 2255 HA VAL 94 HA VAL 94 0.875 -25.353 1.683 2256 HB VAL 94 HB VAL 94 3.354 -24.446 0.125 2257 HG11 VAL 94 1HG1 VAL 94 2.446 -26.019 -1.643 2258 HG12 VAL 94 2HG1 VAL 94 1.178 -26.571 -0.486 2259 HG13 VAL 94 3HG1 VAL 94 2.921 -26.892 -0.147 2260 HG21 VAL 94 3HG2 VAL 94 0.328 -24.045 -0.429 2261 HG22 VAL 94 1HG2 VAL 94 1.651 -23.674 -1.590 2262 HG23 VAL 94 2HG2 VAL 94 1.515 -22.746 -0.069 2263 H ARG 95 H ARG 95 3.899 -24.292 3.035 2264 HA ARG 95 HA ARG 95 5.215 -26.728 3.323 2265 HB2 ARG 95 2HB ARG 95 5.241 -24.228 5.093 2266 HB3 ARG 95 1HB ARG 95 6.358 -25.612 5.325 2267 HG2 ARG 95 2HG ARG 95 7.358 -25.297 3.126 2268 HG3 ARG 95 1HG ARG 95 6.224 -23.951 2.731 2269 HD2 ARG 95 2HD ARG 95 7.150 -22.522 4.487 2270 HD3 ARG 95 1HD ARG 95 8.162 -23.869 5.144 2271 HE ARG 95 HE ARG 95 9.291 -23.859 2.815 2272 HH11 ARG 95 1HH2 ARG 95 8.217 -20.769 4.512 2273 HH12 ARG 95 2HH2 ARG 95 9.702 -20.013 4.168 2274 HH21 ARG 95 1HH1 ARG 95 11.171 -22.770 2.406 2275 HH22 ARG 95 2HH1 ARG 95 11.397 -21.078 2.808 2276 H ARG 96 H ARG 96 2.265 -25.614 5.085 2277 HA ARG 96 HA ARG 96 2.969 -27.149 7.359 2278 HB2 ARG 96 2HB ARG 96 0.855 -26.947 8.309 2279 HB3 ARG 96 1HB ARG 96 1.434 -25.354 7.752 2280 HG2 ARG 96 2HG ARG 96 -0.218 -25.258 5.992 2281 HG3 ARG 96 1HG ARG 96 -0.456 -27.034 6.056 2282 HD2 ARG 96 2HD ARG 96 -1.402 -26.646 8.494 2283 HD3 ARG 96 1HD ARG 96 -1.440 -24.895 8.083 2284 HE ARG 96 HE ARG 96 -3.272 -25.314 6.647 2285 HH11 ARG 96 1HH2 ARG 96 -2.256 -28.509 7.871 2286 HH12 ARG 96 2HH2 ARG 96 -2.429 -29.354 6.364 2287 HH21 ARG 96 1HH1 ARG 96 -4.200 -26.616 4.795 2288 HH22 ARG 96 2HH1 ARG 96 -3.778 -28.293 4.677 2289 H GLU 97 H GLU 97 1.487 -28.081 4.253 2290 HA GLU 97 HA GLU 97 0.605 -30.585 5.405 2291 HB2 GLU 97 2HB GLU 97 0.940 -29.928 2.450 2292 HB3 GLU 97 1HB GLU 97 0.078 -31.343 3.146 2293 HG2 GLU 97 2HG GLU 97 -0.807 -28.404 3.555 2294 HG3 GLU 97 1HG GLU 97 -1.382 -29.484 2.242 2295 H GLU 98 H GLU 98 3.654 -29.299 4.455 2296 HA GLU 98 HA GLU 98 4.838 -31.917 3.921 2297 HB2 GLU 98 2HB GLU 98 6.217 -29.185 4.242 2298 HB3 GLU 98 1HB GLU 98 6.966 -30.729 3.699 2299 HG2 GLU 98 2HG GLU 98 5.486 -30.700 1.652 2300 HG3 GLU 98 1HG GLU 98 4.826 -29.096 2.170 2301 H GLU 99 H GLU 99 4.642 -29.324 6.368 2302 HA GLU 99 HA GLU 99 6.383 -30.121 8.304 2303 HB2 GLU 99 2HB GLU 99 5.099 -28.005 8.424 2304 HB3 GLU 99 1HB GLU 99 3.563 -28.897 8.612 2305 HG2 GLU 99 2HG GLU 99 5.747 -29.163 10.747 2306 HG3 GLU 99 1HG GLU 99 4.685 -27.717 10.657 2307 H ARG 100 H ARG 100 3.071 -31.111 7.761 2308 HA ARG 100 HA ARG 100 2.427 -32.825 9.646 2309 HB2 ARG 100 2HB ARG 100 1.175 -32.070 7.596 2310 HB3 ARG 100 1HB ARG 100 2.144 -33.203 6.594 2311 HG2 ARG 100 2HG ARG 100 1.022 -35.138 7.634 2312 HG3 ARG 100 1HG ARG 100 0.324 -34.082 8.906 2313 HD2 ARG 100 2HD ARG 100 -1.414 -34.639 7.243 2314 HD3 ARG 100 1HD ARG 100 -1.057 -32.860 7.234 2315 HE ARG 100 HE ARG 100 0.567 -33.665 5.214 2316 HH11 ARG 100 1HH2 ARG 100 -2.974 -33.665 5.790 2317 HH12 ARG 100 2HH2 ARG 100 -3.369 -34.551 4.368 2318 HH21 ARG 100 1HH1 ARG 100 -0.097 -34.115 2.922 2319 HH22 ARG 100 2HH1 ARG 100 -1.784 -34.200 2.575 2320 H ARG 101 H ARG 101 4.798 -33.570 7.072 2321 HA ARG 101 HA ARG 101 4.886 -36.398 7.839 2322 HB2 ARG 101 2HB ARG 101 6.338 -34.739 5.683 2323 HB3 ARG 101 1HB ARG 101 6.614 -36.492 5.934 2324 HG2 ARG 101 2HG ARG 101 3.867 -35.307 5.175 2325 HG3 ARG 101 1HG ARG 101 5.123 -35.834 4.006 2326 HD2 ARG 101 2HD ARG 101 5.076 -38.182 5.149 2327 HD3 ARG 101 1HD ARG 101 3.615 -37.617 6.040 2328 HE ARG 101 HE ARG 101 2.367 -37.798 4.075 2329 HH11 ARG 101 1HH2 ARG 101 5.887 -38.063 3.188 2330 HH12 ARG 101 2HH2 ARG 101 5.558 -38.442 1.548 2331 HH21 ARG 101 1HH1 ARG 101 1.982 -38.448 1.761 2332 HH22 ARG 101 2HH1 ARG 101 3.294 -38.607 0.736 2333 H GLY 102 H GLY 102 6.332 -33.432 8.771 2334 HA2 GLY 102 2HA GLY 102 7.945 -33.028 10.187 2335 HA3 GLY 102 1HA GLY 102 8.320 -34.789 10.267 2336 H HIS 103 H HIS 103 8.294 -33.589 7.109 2337 HA HIS 103 HA HIS 103 9.824 -33.554 5.559 2338 HB2 HIS 103 2HB HIS 103 11.611 -32.049 7.523 2339 HB3 HIS 103 1HB HIS 103 11.983 -32.295 5.786 2340 HD1 HIS 103 1HD HIS 103 9.536 -31.520 4.258 2341 HD2 HIS 103 2HD HIS 103 10.702 -29.482 7.772 2342 HE1 HIS 103 1HE HIS 103 8.558 -29.190 4.135 2343 HE2 HIS 103 2HE HIS 103 9.266 -27.988 6.324 2344 H1 SER 1 H SER 1 -2.313 -24.490 18.204 2345 HA SER 1 HA SER 1 -4.550 -23.083 17.851 2346 HB2 SER 1 2HB SER 1 -2.022 -21.285 17.926 2347 HB3 SER 1 1HB SER 1 -3.684 -20.767 17.444 2348 HG SER 1 1HG SER 1 -3.200 -20.156 19.566 2349 H ALA 2 H ALA 2 -3.933 -21.917 15.436 2350 HA ALA 2 HA ALA 2 -2.752 -24.104 14.016 2351 HB1 ALA 2 1HB ALA 2 -4.698 -22.891 13.019 2352 HB2 ALA 2 2HB ALA 2 -3.252 -22.789 11.957 2353 HB3 ALA 2 3HB ALA 2 -3.729 -21.369 12.971 2354 H ASP 3 H ASP 3 -0.880 -24.063 12.816 2355 HA ASP 3 HA ASP 3 1.340 -22.899 13.915 2356 HB2 ASP 3 2HB ASP 3 2.590 -23.807 11.986 2357 HB3 ASP 3 1HB ASP 3 1.358 -25.002 12.507 2358 H HIS 4 H HIS 4 -0.476 -22.023 11.005 2359 HA HIS 4 HA HIS 4 1.394 -19.953 10.464 2360 HB2 HIS 4 2HB HIS 4 -0.823 -21.151 8.917 2361 HB3 HIS 4 1HB HIS 4 -0.575 -19.389 8.628 2362 HD1 HIS 4 1HD HIS 4 1.611 -22.621 8.721 2363 HD2 HIS 4 2HD HIS 4 1.893 -18.530 7.765 2364 HE1 HIS 4 1HE HIS 4 3.817 -22.275 7.664 2365 HE2 HIS 4 2HE HIS 4 4.033 -19.800 7.122 2366 H GLU 5 H GLU 5 -1.384 -19.836 12.503 2367 HA GLU 5 HA GLU 5 -1.432 -16.928 12.214 2368 HB2 GLU 5 2HB GLU 5 -2.891 -18.690 14.244 2369 HB3 GLU 5 1HB GLU 5 -2.874 -16.893 14.202 2370 HG2 GLU 5 2HG GLU 5 -3.640 -17.134 11.682 2371 HG3 GLU 5 1HG GLU 5 -4.121 -18.810 12.137 2372 H ARG 6 H ARG 6 0.084 -19.489 14.182 2373 HA ARG 6 HA ARG 6 1.042 -17.776 16.178 2374 HB2 ARG 6 2HB ARG 6 1.079 -20.347 16.236 2375 HB3 ARG 6 1HB ARG 6 2.479 -20.284 15.122 2376 HG2 ARG 6 2HG ARG 6 3.696 -18.848 16.912 2377 HG3 ARG 6 1HG ARG 6 2.273 -19.096 17.967 2378 HD2 ARG 6 2HD ARG 6 4.057 -20.679 18.604 2379 HD3 ARG 6 1HD ARG 6 2.670 -21.612 17.890 2380 HE ARG 6 HE ARG 6 4.515 -20.922 15.779 2381 HH11 ARG 6 1HH2 ARG 6 4.433 -23.041 18.740 2382 HH12 ARG 6 2HH2 ARG 6 5.390 -24.249 18.014 2383 HH21 ARG 6 1HH1 ARG 6 6.038 -22.515 14.949 2384 HH22 ARG 6 2HH1 ARG 6 6.399 -23.932 15.894 2385 H GLU 7 H GLU 7 2.488 -18.835 13.044 2386 HA GLU 7 HA GLU 7 4.847 -17.339 13.472 2387 HB2 GLU 7 2HB GLU 7 4.462 -19.359 11.837 2388 HB3 GLU 7 1HB GLU 7 3.847 -18.116 10.701 2389 HG2 GLU 7 2HG GLU 7 6.096 -18.294 10.062 2390 HG3 GLU 7 1HG GLU 7 6.181 -16.895 11.187 2391 H ALA 8 H ALA 8 1.684 -16.526 12.063 2392 HA ALA 8 HA ALA 8 2.452 -14.132 10.796 2393 HB1 ALA 8 1HB ALA 8 -0.267 -14.924 12.041 2394 HB2 ALA 8 2HB ALA 8 0.228 -15.199 10.330 2395 HB3 ALA 8 3HB ALA 8 0.008 -13.523 10.953 2396 H GLN 9 H GLN 9 1.066 -14.812 14.070 2397 HA GLN 9 HA GLN 9 1.170 -12.084 14.818 2398 HB2 GLN 9 2HB GLN 9 0.870 -14.685 16.413 2399 HB3 GLN 9 1HB GLN 9 0.916 -13.086 17.224 2400 HG2 GLN 9 2HG GLN 9 -1.143 -13.850 15.035 2401 HG3 GLN 9 1HG GLN 9 -1.443 -13.897 16.807 2402 HE21 GLN 9 1HE2 GLN 9 -1.805 -11.859 14.109 2403 HE22 GLN 9 2HE2 GLN 9 -1.453 -10.297 14.789 2404 H LYS 10 H LYS 10 3.540 -14.705 15.031 2405 HA LYS 10 HA LYS 10 5.320 -13.492 16.794 2406 HB2 LYS 10 2HB LYS 10 5.495 -15.868 15.861 2407 HB3 LYS 10 1HB LYS 10 5.987 -15.168 14.287 2408 HG2 LYS 10 2HG LYS 10 8.009 -14.114 15.492 2409 HG3 LYS 10 1HG LYS 10 7.517 -15.024 16.959 2410 HD2 LYS 10 2HD LYS 10 7.721 -17.177 15.602 2411 HD3 LYS 10 1HD LYS 10 8.282 -16.195 14.201 2412 HE2 LYS 10 2HE LYS 10 10.249 -15.365 15.606 2413 HE3 LYS 10 1HE LYS 10 9.672 -16.407 16.965 2414 HZ1 LYS 10 3HZ LYS 10 11.090 -17.118 14.519 2415 HZ2 LYS 10 1HZ LYS 10 9.864 -18.214 14.998 2416 HZ3 LYS 10 2HZ LYS 10 11.123 -17.805 16.064 2417 H ALA 11 H ALA 11 4.811 -13.073 13.280 2418 HA ALA 11 HA ALA 11 7.094 -11.537 12.799 2419 HB1 ALA 11 1HB ALA 11 5.756 -12.656 10.976 2420 HB2 ALA 11 2HB ALA 11 6.014 -10.903 10.654 2421 HB3 ALA 11 3HB ALA 11 4.421 -11.482 11.263 2422 H GLU 12 H GLU 12 3.792 -10.601 13.886 2423 HA GLU 12 HA GLU 12 4.090 -7.841 13.518 2424 HB2 GLU 12 2HB GLU 12 2.401 -9.338 15.619 2425 HB3 GLU 12 1HB GLU 12 2.478 -7.553 15.501 2426 HG2 GLU 12 2HG GLU 12 1.717 -7.753 13.053 2427 HG3 GLU 12 1HG GLU 12 1.275 -9.461 13.420 2428 H GLU 13 H GLU 13 5.176 -9.975 16.170 2429 HA GLU 13 HA GLU 13 5.801 -7.837 17.920 2430 HB2 GLU 13 2HB GLU 13 6.866 -10.717 17.917 2431 HB3 GLU 13 1HB GLU 13 7.001 -9.534 19.264 2432 HG2 GLU 13 2HG GLU 13 4.459 -9.443 19.387 2433 HG3 GLU 13 1HG GLU 13 4.375 -10.724 18.123 2434 H GLU 14 H GLU 14 7.494 -9.351 15.246 2435 HA GLU 14 HA GLU 14 10.071 -8.431 16.060 2436 HB2 GLU 14 2HB GLU 14 9.670 -10.479 14.671 2437 HB3 GLU 14 1HB GLU 14 9.209 -9.436 13.288 2438 HG2 GLU 14 2HG GLU 14 11.466 -8.497 13.146 2439 HG3 GLU 14 1HG GLU 14 11.922 -9.175 14.750 2440 H LEU 15 H LEU 15 7.403 -7.234 14.039 2441 HA LEU 15 HA LEU 15 8.790 -5.186 12.797 2442 HB2 LEU 15 2HB LEU 15 6.484 -5.977 12.170 2443 HB3 LEU 15 1HB LEU 15 5.823 -5.197 13.634 2444 HG LEU 15 HG LEU 15 6.382 -2.968 12.781 2445 HD11 LEU 15 1HD1 LEU 15 8.543 -3.321 11.664 2446 HD12 LEU 15 2HD1 LEU 15 7.399 -2.655 10.467 2447 HD13 LEU 15 3HD1 LEU 15 7.789 -4.411 10.440 2448 HD21 LEU 15 3HD2 LEU 15 4.252 -4.039 12.018 2449 HD22 LEU 15 1HD2 LEU 15 5.086 -4.692 10.564 2450 HD23 LEU 15 2HD2 LEU 15 4.897 -2.918 10.770 2451 H GLN 16 H GLN 16 7.177 -5.305 15.944 2452 HA GLN 16 HA GLN 16 7.357 -2.599 16.584 2453 HB2 GLN 16 2HB GLN 16 7.482 -5.002 18.493 2454 HB3 GLN 16 1HB GLN 16 7.143 -3.296 18.958 2455 HG2 GLN 16 2HG GLN 16 5.077 -3.320 17.497 2456 HG3 GLN 16 1HG GLN 16 5.381 -5.045 17.093 2457 HE21 GLN 16 1HE2 GLN 16 4.202 -6.462 18.429 2458 HE22 GLN 16 2HE2 GLN 16 3.845 -6.192 20.104 2459 H LYS 17 H LYS 17 9.834 -5.168 16.766 2460 HA LYS 17 HA LYS 17 11.576 -3.680 18.447 2461 HB2 LYS 17 2HB LYS 17 11.891 -6.084 18.337 2462 HB3 LYS 17 1HB LYS 17 12.136 -6.039 16.555 2463 HG2 LYS 17 2HG LYS 17 14.281 -5.012 16.735 2464 HG3 LYS 17 1HG LYS 17 13.948 -4.424 18.401 2465 HD2 LYS 17 2HD LYS 17 14.186 -6.661 19.340 2466 HD3 LYS 17 1HD LYS 17 14.313 -7.413 17.716 2467 HE2 LYS 17 2HE LYS 17 16.536 -7.060 19.046 2468 HE3 LYS 17 1HE LYS 17 16.516 -6.509 17.322 2469 HZ1 LYS 17 3HZ LYS 17 16.543 -4.361 17.882 2470 HZ2 LYS 17 1HZ LYS 17 17.493 -4.982 19.100 2471 HZ3 LYS 17 2HZ LYS 17 15.860 -4.572 19.468 2472 H VAL 18 H VAL 18 11.144 -3.916 14.900 2473 HA VAL 18 HA VAL 18 13.484 -2.534 14.213 2474 HB VAL 18 HB VAL 18 10.813 -2.607 12.696 2475 HG11 VAL 18 1HG1 VAL 18 12.287 -2.293 10.671 2476 HG12 VAL 18 2HG1 VAL 18 13.723 -2.108 11.743 2477 HG13 VAL 18 3HG1 VAL 18 12.395 -0.890 11.783 2478 HG21 VAL 18 3HG2 VAL 18 11.530 -4.926 13.230 2479 HG22 VAL 18 1HG2 VAL 18 13.212 -4.568 12.689 2480 HG23 VAL 18 2HG2 VAL 18 11.855 -4.588 11.505 2481 H LEU 19 H LEU 19 10.191 -1.485 15.050 2482 HA LEU 19 HA LEU 19 10.520 1.218 14.392 2483 HB2 LEU 19 2HB LEU 19 8.681 -0.156 16.442 2484 HB3 LEU 19 1HB LEU 19 8.508 1.552 15.926 2485 HG LEU 19 HG LEU 19 8.379 -0.863 13.995 2486 HD11 LEU 19 1HD1 LEU 19 5.921 -0.435 13.908 2487 HD12 LEU 19 2HD1 LEU 19 6.093 0.739 15.268 2488 HD13 LEU 19 3HD1 LEU 19 6.473 -0.992 15.525 2489 HD21 LEU 19 3HD2 LEU 19 9.044 0.967 12.681 2490 HD22 LEU 19 1HD2 LEU 19 8.147 2.153 13.687 2491 HD23 LEU 19 2HD2 LEU 19 7.248 1.067 12.566 2492 H GLU 20 H GLU 20 11.213 -0.567 17.426 2493 HA GLU 20 HA GLU 20 11.705 1.725 18.987 2494 HB2 GLU 20 2HB GLU 20 13.044 -1.053 19.273 2495 HB3 GLU 20 1HB GLU 20 13.019 0.248 20.510 2496 HG2 GLU 20 2HG GLU 20 10.465 -0.019 20.609 2497 HG3 GLU 20 1HG GLU 20 10.651 -1.472 19.563 2498 H GLU 21 H GLU 21 13.719 -0.164 16.745 2499 HA GLU 21 HA GLU 21 16.136 1.185 17.598 2500 HB2 GLU 21 2HB GLU 21 15.612 -0.592 15.143 2501 HB3 GLU 21 1HB GLU 21 17.197 0.103 15.635 2502 HG2 GLU 21 2HG GLU 21 16.968 -1.120 17.876 2503 HG3 GLU 21 1HG GLU 21 15.498 -1.936 17.219 2504 H ALA 22 H ALA 22 13.724 1.387 15.004 2505 HA ALA 22 HA ALA 22 14.995 3.111 13.297 2506 HB1 ALA 22 1HB ALA 22 11.980 3.029 13.955 2507 HB2 ALA 22 2HB ALA 22 12.814 1.962 12.769 2508 HB3 ALA 22 3HB ALA 22 12.721 3.738 12.471 2509 H SER 23 H SER 23 13.064 3.918 16.275 2510 HA SER 23 HA SER 23 12.950 6.670 15.717 2511 HB2 SER 23 2HB SER 23 12.530 6.705 18.338 2512 HB3 SER 23 1HB SER 23 11.356 5.843 17.280 2513 HG SER 23 1HG SER 23 12.126 4.631 19.172 2514 H LYS 24 H LYS 24 15.196 4.612 17.498 2515 HA LYS 24 HA LYS 24 16.775 6.685 18.584 2516 HB2 LYS 24 2HB LYS 24 16.541 4.322 19.417 2517 HB3 LYS 24 1HB LYS 24 17.488 3.726 18.025 2518 HG2 LYS 24 2HG LYS 24 18.660 5.817 19.968 2519 HG3 LYS 24 1HG LYS 24 18.503 4.097 20.439 2520 HD2 LYS 24 2HD LYS 24 19.825 3.510 18.259 2521 HD3 LYS 24 1HD LYS 24 20.184 5.267 18.150 2522 HE2 LYS 24 2HE LYS 24 22.086 4.162 19.243 2523 HE3 LYS 24 1HE LYS 24 21.225 5.178 20.463 2524 HZ1 LYS 24 3HZ LYS 24 21.273 2.201 20.215 2525 HZ2 LYS 24 1HZ LYS 24 20.022 2.966 21.038 2526 HZ3 LYS 24 2HZ LYS 24 21.603 3.199 21.551 2527 H LYS 25 H LYS 25 16.926 4.723 15.614 2528 HA LYS 25 HA LYS 25 19.421 5.830 14.813 2529 HB2 LYS 25 2HB LYS 25 17.383 4.084 13.373 2530 HB3 LYS 25 1HB LYS 25 18.912 4.652 12.604 2531 HG2 LYS 25 2HG LYS 25 20.293 3.606 14.310 2532 HG3 LYS 25 1HG LYS 25 18.875 3.224 15.337 2533 HD2 LYS 25 2HD LYS 25 18.109 1.493 13.766 2534 HD3 LYS 25 1HD LYS 25 19.486 1.856 12.649 2535 HE2 LYS 25 2HE LYS 25 21.138 1.253 14.398 2536 HE3 LYS 25 1HE LYS 25 19.834 1.026 15.621 2537 HZ1 LYS 25 3HZ LYS 25 20.128 -0.758 13.217 2538 HZ2 LYS 25 1HZ LYS 25 19.184 -1.004 14.637 2539 HZ3 LYS 25 2HZ LYS 25 20.866 -0.949 14.717 2540 H ALA 26 H ALA 26 15.982 6.631 14.021 2541 HA ALA 26 HA ALA 26 16.453 8.448 12.036 2542 HB1 ALA 26 1HB ALA 26 14.306 8.647 14.244 2543 HB2 ALA 26 2HB ALA 26 14.162 7.707 12.713 2544 HB3 ALA 26 3HB ALA 26 14.279 9.497 12.649 2545 H VAL 27 H VAL 27 16.450 9.120 15.624 2546 HA VAL 27 HA VAL 27 16.844 11.877 15.176 2547 HB VAL 27 HB VAL 27 17.594 12.077 17.537 2548 HG11 VAL 27 1HG1 VAL 27 15.180 12.158 16.724 2549 HG12 VAL 27 2HG1 VAL 27 15.350 11.549 18.421 2550 HG13 VAL 27 3HG1 VAL 27 15.069 10.392 17.073 2551 HG21 VAL 27 3HG2 VAL 27 17.358 10.080 19.040 2552 HG22 VAL 27 1HG2 VAL 27 18.686 9.817 17.861 2553 HG23 VAL 27 2HG2 VAL 27 17.092 9.015 17.621 2554 H GLU 28 H GLU 28 19.182 9.187 15.477 2555 HA GLU 28 HA GLU 28 21.351 11.086 15.639 2556 HB2 GLU 28 2HB GLU 28 21.471 8.039 15.363 2557 HB3 GLU 28 1HB GLU 28 22.859 9.149 15.646 2558 HG2 GLU 28 2HG GLU 28 21.546 10.007 17.737 2559 HG3 GLU 28 1HG GLU 28 20.485 8.566 17.530 2560 H ALA 29 H ALA 29 19.602 9.383 13.155 2561 HA ALA 29 HA ALA 29 21.481 9.566 11.089 2562 HB1 ALA 29 1HB ALA 29 19.537 9.038 9.624 2563 HB2 ALA 29 2HB ALA 29 18.399 9.410 10.950 2564 HB3 ALA 29 3HB ALA 29 19.509 7.997 11.060 2565 H GLU 30 H GLU 30 18.578 11.525 11.979 2566 HA GLU 30 HA GLU 30 18.866 13.411 10.033 2567 HB2 GLU 30 2HB GLU 30 16.857 13.046 11.515 2568 HB3 GLU 30 1HB GLU 30 17.753 13.831 12.856 2569 HG2 GLU 30 2HG GLU 30 16.392 15.563 12.009 2570 HG3 GLU 30 1HG GLU 30 17.967 15.891 11.219 2571 H ARG 31 H ARG 31 20.581 13.235 13.132 2572 HA ARG 31 HA ARG 31 21.649 15.883 13.017 2573 HB2 ARG 31 2HB ARG 31 22.548 13.337 14.462 2574 HB3 ARG 31 1HB ARG 31 23.531 14.828 14.560 2575 HG2 ARG 31 2HG ARG 31 20.604 14.728 15.455 2576 HG3 ARG 31 1HG ARG 31 22.012 14.340 16.510 2577 HD2 ARG 31 2HD ARG 31 22.982 16.670 15.997 2578 HD3 ARG 31 1HD ARG 31 21.412 17.057 15.163 2579 HE ARG 31 HE ARG 31 21.190 16.013 17.953 2580 HH11 ARG 31 1HH2 ARG 31 21.893 19.029 16.109 2581 HH12 ARG 31 2HH2 ARG 31 21.140 20.063 17.195 2582 HH21 ARG 31 1HH1 ARG 31 19.803 17.454 19.334 2583 HH22 ARG 31 2HH1 ARG 31 19.818 19.135 19.046 2584 H GLY 32 H GLY 32 22.721 16.434 11.101 2585 HA2 GLY 32 2HA GLY 32 25.276 16.327 10.751 2586 HA3 GLY 32 1HA GLY 32 24.826 14.677 10.128 2587 H ALA 33 H ALA 33 22.120 15.503 9.399 2588 HA ALA 33 HA ALA 33 22.809 16.205 6.754 2589 HB1 ALA 33 1HB ALA 33 20.049 15.745 8.074 2590 HB2 ALA 33 2HB ALA 33 21.033 14.481 7.261 2591 HB3 ALA 33 3HB ALA 33 20.341 15.845 6.302 2592 HA PRO 34 HA PRO 34 21.612 20.469 7.229 2593 HB2 PRO 34 2HB PRO 34 21.042 21.226 4.595 2594 HB3 PRO 34 1HB PRO 34 22.722 20.894 5.178 2595 HG2 PRO 34 2HG PRO 34 20.838 18.984 3.691 2596 HG3 PRO 34 1HG PRO 34 22.588 19.318 3.340 2597 HD2 PRO 34 2HD PRO 34 21.726 17.135 4.834 2598 HD3 PRO 34 1HD PRO 34 23.291 17.982 5.226 2599 H GLY 35 H GLY 35 19.636 21.690 7.577 2600 HA2 GLY 35 2HA GLY 35 17.469 22.178 7.408 2601 HA3 GLY 35 1HA GLY 35 17.285 20.911 6.140 2602 H ALA 36 H ALA 36 18.761 19.881 9.042 2603 HA ALA 36 HA ALA 36 17.175 17.819 9.534 2604 HB1 ALA 36 1HB ALA 36 18.157 17.833 11.902 2605 HB2 ALA 36 2HB ALA 36 18.747 19.503 11.594 2606 HB3 ALA 36 3HB ALA 36 19.383 18.116 10.621 2607 H ALA 37 H ALA 37 15.231 17.337 10.398 2608 HA ALA 37 HA ALA 37 13.798 19.407 11.961 2609 HB1 ALA 37 1HB ALA 37 11.728 18.709 10.699 2610 HB2 ALA 37 2HB ALA 37 12.730 17.579 9.705 2611 HB3 ALA 37 3HB ALA 37 12.979 19.354 9.571 2612 H LEU 38 H LEU 38 14.283 15.943 11.108 2613 HA LEU 38 HA LEU 38 12.295 15.002 12.912 2614 HB2 LEU 38 2HB LEU 38 13.559 14.096 10.624 2615 HB3 LEU 38 1HB LEU 38 14.435 13.141 11.835 2616 HG LEU 38 HG LEU 38 11.378 13.234 11.398 2617 HD11 LEU 38 1HD1 LEU 38 13.445 11.074 10.630 2618 HD12 LEU 38 2HD1 LEU 38 12.632 12.225 9.509 2619 HD13 LEU 38 3HD1 LEU 38 11.662 10.991 10.379 2620 HD21 LEU 38 3HD2 LEU 38 13.022 11.396 13.255 2621 HD22 LEU 38 1HD2 LEU 38 11.288 11.159 12.832 2622 HD23 LEU 38 2HD2 LEU 38 11.796 12.615 13.761 2623 H ILE 39 H ILE 39 14.823 16.543 13.985 2624 HA ILE 39 HA ILE 39 16.009 14.411 15.606 2625 HB ILE 39 HB ILE 39 17.707 15.528 14.527 2626 HG12 ILE 39 2HG1 ILE 39 18.941 16.784 16.216 2627 HG13 ILE 39 1HG1 ILE 39 17.506 16.955 17.260 2628 HG21 ILE 39 1HG2 ILE 39 16.301 18.200 15.177 2629 HG22 ILE 39 2HG2 ILE 39 16.489 17.428 13.555 2630 HG23 ILE 39 3HG2 ILE 39 17.926 18.030 14.431 2631 HD11 ILE 39 3HD ILE 39 18.775 14.246 16.456 2632 HD12 ILE 39 1HD ILE 39 19.110 15.110 17.997 2633 HD13 ILE 39 2HD ILE 39 17.471 14.474 17.664 2634 H SER 40 H SER 40 15.203 14.091 17.589 2635 HA SER 40 HA SER 40 15.283 16.093 19.449 2636 HB2 SER 40 2HB SER 40 12.897 16.120 20.293 2637 HB3 SER 40 1HB SER 40 13.101 16.971 18.736 2638 HG SER 40 1HG SER 40 11.267 15.630 18.762 2639 H TYR 41 H TYR 41 12.770 13.820 19.756 2640 HA TYR 41 HA TYR 41 13.940 11.435 20.194 2641 HB2 TYR 41 2HB TYR 41 14.670 13.070 22.469 2642 HB3 TYR 41 1HB TYR 41 13.370 11.979 23.061 2643 HD1 TYR 41 2HD TYR 41 13.569 9.453 22.335 2644 HD2 TYR 41 1HD TYR 41 16.859 12.222 22.376 2645 HE1 TYR 41 2HE TYR 41 15.137 7.573 22.490 2646 HE2 TYR 41 1HE TYR 41 18.445 10.334 22.548 2647 HH TYR 41 HH TYR 41 17.299 6.947 22.889 2648 HA PRO 42 HA PRO 42 9.736 11.085 22.076 2649 HB2 PRO 42 2HB PRO 42 8.007 13.255 22.588 2650 HB3 PRO 42 1HB PRO 42 9.239 12.677 23.776 2651 HG2 PRO 42 2HG PRO 42 9.513 14.970 21.749 2652 HG3 PRO 42 1HG PRO 42 9.895 15.001 23.520 2653 HD2 PRO 42 2HD PRO 42 11.848 14.592 21.631 2654 HD3 PRO 42 1HD PRO 42 11.878 13.655 23.193 2655 H ASP 43 H ASP 43 10.209 13.534 19.630 2656 HA ASP 43 HA ASP 43 7.715 13.035 18.326 2657 HB2 ASP 43 2HB ASP 43 10.199 14.490 17.241 2658 HB3 ASP 43 1HB ASP 43 8.531 14.559 16.609 2659 H ALA 44 H ALA 44 10.922 11.605 18.358 2660 HA ALA 44 HA ALA 44 10.905 10.789 15.621 2661 HB1 ALA 44 1HB ALA 44 12.896 9.422 16.226 2662 HB2 ALA 44 2HB ALA 44 12.604 9.761 17.977 2663 HB3 ALA 44 3HB ALA 44 13.014 11.105 16.841 2664 H ILE 45 H ILE 45 9.890 9.326 18.700 2665 HA ILE 45 HA ILE 45 9.422 6.758 17.471 2666 HB ILE 45 HB ILE 45 10.172 6.817 19.757 2667 HG12 ILE 45 2HG1 ILE 45 8.483 5.498 20.946 2668 HG13 ILE 45 1HG1 ILE 45 7.220 5.950 19.757 2669 HG21 ILE 45 1HG2 ILE 45 9.427 9.065 20.443 2670 HG22 ILE 45 2HG2 ILE 45 8.788 7.843 21.583 2671 HG23 ILE 45 3HG2 ILE 45 7.695 8.566 20.352 2672 HD11 ILE 45 3HD ILE 45 9.796 4.365 19.077 2673 HD12 ILE 45 1HD ILE 45 8.174 3.644 19.371 2674 HD13 ILE 45 2HD ILE 45 8.426 4.719 17.954 2675 H TRP 46 H TRP 46 7.790 9.779 17.758 2676 HA TRP 46 HA TRP 46 5.158 8.671 17.468 2677 HB2 TRP 46 2HB TRP 46 5.789 10.979 18.527 2678 HB3 TRP 46 1HB TRP 46 5.996 11.565 16.840 2679 HD1 TRP 46 HD TRP 46 3.310 10.556 19.403 2680 HE1 TRP 46 1HE TRP 46 1.192 11.649 18.530 2681 HE3 TRP 46 3HE TRP 46 4.708 11.741 14.634 2682 HZ2 TRP 46 2HZ TRP 46 -0.100 12.045 15.973 2683 HZ3 TRP 46 3HZ TRP 46 2.978 12.389 13.019 2684 HH2 TRP 46 HH TRP 46 0.621 12.635 13.689 2685 H TRP 47 H TRP 47 7.690 10.185 15.455 2686 HA TRP 47 HA TRP 47 6.392 10.165 13.021 2687 HB2 TRP 47 2HB TRP 47 8.516 11.373 13.370 2688 HB3 TRP 47 1HB TRP 47 9.366 9.835 13.740 2689 HD1 TRP 47 HD TRP 47 7.527 11.423 10.607 2690 HE1 TRP 47 1HE TRP 47 8.504 10.406 8.545 2691 HE3 TRP 47 3HE TRP 47 10.824 8.268 12.876 2692 HZ2 TRP 47 2HZ TRP 47 10.690 8.581 7.883 2693 HZ3 TRP 47 3HZ TRP 47 12.338 6.893 11.476 2694 HH2 TRP 47 HH TRP 47 12.287 7.066 9.020 2695 H SER 48 H SER 48 8.323 7.524 14.644 2696 HA SER 48 HA SER 48 7.953 5.900 12.332 2697 HB2 SER 48 2HB SER 48 9.074 4.095 13.565 2698 HB3 SER 48 1HB SER 48 9.988 5.634 13.588 2699 HG SER 48 1HG SER 48 9.915 4.601 15.627 2700 H VAL 49 H VAL 49 7.149 3.425 13.397 2701 HA VAL 49 HA VAL 49 5.467 2.196 13.604 2702 HB VAL 49 HB VAL 49 3.617 4.115 14.917 2703 HG11 VAL 49 1HG1 VAL 49 2.817 1.990 15.978 2704 HG12 VAL 49 2HG1 VAL 49 4.009 1.056 15.013 2705 HG13 VAL 49 3HG1 VAL 49 2.691 1.962 14.186 2706 HG21 VAL 49 3HG2 VAL 49 5.979 2.576 16.222 2707 HG22 VAL 49 1HG2 VAL 49 4.615 3.309 17.133 2708 HG23 VAL 49 2HG2 VAL 49 5.748 4.354 16.206 2709 H GLU 50 H GLU 50 4.103 5.455 12.706 2710 HA GLU 50 HA GLU 50 2.226 4.274 10.964 2711 HB2 GLU 50 2HB GLU 50 1.755 6.470 10.050 2712 HB3 GLU 50 1HB GLU 50 1.862 6.506 11.829 2713 HG2 GLU 50 2HG GLU 50 3.044 8.448 11.363 2714 HG3 GLU 50 1HG GLU 50 4.414 7.293 11.353 2715 H THR 51 H THR 51 5.602 5.285 10.604 2716 HA THR 51 HA THR 51 5.769 5.116 7.886 2717 HB THR 51 HB THR 51 8.063 4.258 9.685 2718 HG1 THR 51 1HG THR 51 6.796 6.810 9.600 2719 HG21 THR 51 3HG2 THR 51 9.351 5.770 8.156 2720 HG22 THR 51 1HG2 THR 51 7.840 6.181 7.266 2721 HG23 THR 51 2HG2 THR 51 8.482 4.499 7.223 2722 H ALA 52 H ALA 52 5.563 2.503 10.280 2723 HA ALA 52 HA ALA 52 6.736 0.542 8.473 2724 HB1 ALA 52 1HB ALA 52 7.062 0.029 10.836 2725 HB2 ALA 52 2HB ALA 52 5.912 -1.154 10.152 2726 HB3 ALA 52 3HB ALA 52 5.283 0.196 11.166 2727 H THR 53 H THR 53 3.510 1.874 9.345 2728 HA THR 53 HA THR 53 2.215 -0.198 7.815 2729 HB THR 53 HB THR 53 0.194 1.435 8.204 2730 HG1 THR 53 1HG THR 53 1.589 3.154 8.938 2731 HG21 THR 53 3HG2 THR 53 1.673 -0.023 10.510 2732 HG22 THR 53 1HG2 THR 53 0.551 -0.784 9.316 2733 HG23 THR 53 2HG2 THR 53 -0.074 0.433 10.486 2734 H THR 54 H THR 54 4.203 2.194 6.897 2735 HA THR 54 HA THR 54 4.596 3.370 5.156 2736 HB THR 54 HB THR 54 4.264 2.388 2.954 2737 HG1 THR 54 1HG THR 54 2.155 1.606 3.425 2738 HG21 THR 54 3HG2 THR 54 4.876 0.249 5.132 2739 HG22 THR 54 1HG2 THR 54 6.008 1.560 4.648 2740 HG23 THR 54 2HG2 THR 54 5.513 0.308 3.451 2741 H VAL 55 H VAL 55 3.002 4.931 6.333 2742 HA VAL 55 HA VAL 55 0.956 5.718 4.366 2743 HB VAL 55 HB VAL 55 1.139 6.528 7.332 2744 HG11 VAL 55 1HG1 VAL 55 -1.060 6.838 5.159 2745 HG12 VAL 55 2HG1 VAL 55 -0.021 8.164 5.777 2746 HG13 VAL 55 3HG1 VAL 55 -1.194 7.364 6.882 2747 HG21 VAL 55 3HG2 VAL 55 0.707 4.122 7.269 2748 HG22 VAL 55 1HG2 VAL 55 -0.446 4.298 5.903 2749 HG23 VAL 55 2HG2 VAL 55 -0.872 4.939 7.535 2750 H GLY 56 H GLY 56 2.594 7.709 6.949 2751 HA2 GLY 56 2HA GLY 56 4.219 9.114 6.711 2752 HA3 GLY 56 1HA GLY 56 4.333 8.833 4.923 2753 H TYR 57 H TYR 57 1.981 9.957 7.393 2754 HA TYR 57 HA TYR 57 0.504 11.303 5.387 2755 HB2 TYR 57 2HB TYR 57 -0.061 10.457 7.970 2756 HB3 TYR 57 1HB TYR 57 -0.013 12.234 8.228 2757 HD1 TYR 57 1HD TYR 57 -1.256 12.880 5.275 2758 HD2 TYR 57 2HD TYR 57 -2.329 10.222 8.495 2759 HE1 TYR 57 1HE TYR 57 -3.582 12.951 4.561 2760 HE2 TYR 57 2HE TYR 57 -4.668 10.287 7.749 2761 HH TYR 57 HH TYR 57 -5.741 11.854 4.732 2762 H GLY 58 H GLY 58 3.362 12.249 6.855 2763 HA2 GLY 58 2HA GLY 58 4.525 14.015 6.028 2764 HA3 GLY 58 1HA GLY 58 3.001 14.889 5.658 2765 H ASP 59 H ASP 59 3.863 13.398 8.763 2766 HA ASP 59 HA ASP 59 3.562 15.887 10.152 2767 HB2 ASP 59 2HB ASP 59 2.934 13.894 11.370 2768 HB3 ASP 59 1HB ASP 59 4.536 13.127 11.075 2769 H ARG 60 H ARG 60 6.448 13.629 9.693 2770 HA ARG 60 HA ARG 60 8.057 16.005 9.312 2771 HB2 ARG 60 2HB ARG 60 8.282 14.120 11.687 2772 HB3 ARG 60 1HB ARG 60 9.806 14.676 10.913 2773 HG2 ARG 60 2HG ARG 60 9.527 16.899 11.473 2774 HG3 ARG 60 1HG ARG 60 7.744 16.821 11.548 2775 HD2 ARG 60 2HD ARG 60 9.524 15.522 13.720 2776 HD3 ARG 60 1HD ARG 60 8.933 17.238 13.765 2777 HE ARG 60 HE ARG 60 6.848 15.094 13.345 2778 HH11 ARG 60 1HH2 ARG 60 8.215 17.519 15.693 2779 HH12 ARG 60 2HH2 ARG 60 7.339 16.818 16.981 2780 HH21 ARG 60 1HH1 ARG 60 5.368 14.727 14.822 2781 HH22 ARG 60 2HH1 ARG 60 5.285 15.526 16.376 2782 H TYR 61 H TYR 61 10.118 15.318 8.160 2783 HA TYR 61 HA TYR 61 9.734 12.760 6.891 2784 HB2 TYR 61 2HB TYR 61 10.543 14.143 4.676 2785 HB3 TYR 61 1HB TYR 61 8.819 13.827 5.055 2786 HD1 TYR 61 1HD TYR 61 11.494 16.459 5.247 2787 HD2 TYR 61 2HD TYR 61 7.318 15.528 5.685 2788 HE1 TYR 61 1HE TYR 61 10.960 18.872 5.302 2789 HE2 TYR 61 2HE TYR 61 6.785 17.906 5.792 2790 HH TYR 61 HH TYR 61 7.535 20.002 5.438 2791 HA PRO 62 HA PRO 62 14.045 13.129 7.845 2792 HB2 PRO 62 2HB PRO 62 15.082 11.038 6.205 2793 HB3 PRO 62 1HB PRO 62 14.160 10.742 7.726 2794 HG2 PRO 62 2HG PRO 62 13.176 10.768 4.823 2795 HG3 PRO 62 1HG PRO 62 12.844 9.534 6.104 2796 HD2 PRO 62 2HD PRO 62 11.026 11.525 5.526 2797 HD3 PRO 62 1HD PRO 62 11.314 11.011 7.253 2798 H VAL 63 H VAL 63 16.235 13.657 6.825 2799 HA VAL 63 HA VAL 63 15.822 14.819 4.162 2800 HB VAL 63 HB VAL 63 18.086 15.550 6.037 2801 HG11 VAL 63 1HG1 VAL 63 16.828 16.664 3.429 2802 HG12 VAL 63 2HG1 VAL 63 18.576 16.474 3.829 2803 HG13 VAL 63 3HG1 VAL 63 17.619 17.767 4.590 2804 HG21 VAL 63 3HG2 VAL 63 15.236 16.730 5.800 2805 HG22 VAL 63 1HG2 VAL 63 16.624 17.519 6.640 2806 HG23 VAL 63 2HG2 VAL 63 15.976 15.978 7.254 2807 H THR 64 H THR 64 18.787 14.847 3.700 2808 HA THR 64 HA THR 64 18.593 12.451 2.195 2809 HB THR 64 HB THR 64 20.965 14.360 2.027 2810 HG1 THR 64 1HG THR 64 18.392 15.096 1.116 2811 HG21 THR 64 3HG2 THR 64 20.540 14.145 -0.418 2812 HG22 THR 64 1HG2 THR 64 19.070 13.159 -0.110 2813 HG23 THR 64 2HG2 THR 64 20.693 12.519 0.336 2814 H GLU 65 H GLU 65 21.003 13.940 4.380 2815 HA GLU 65 HA GLU 65 22.843 11.788 4.031 2816 HB2 GLU 65 2HB GLU 65 23.225 14.367 4.142 2817 HB3 GLU 65 1HB GLU 65 23.087 14.196 5.924 2818 HG2 GLU 65 2HG GLU 65 25.092 12.761 5.972 2819 HG3 GLU 65 1HG GLU 65 25.151 12.698 4.169 2820 H GLU 66 H GLU 66 20.078 12.021 5.813 2821 HA GLU 66 HA GLU 66 20.952 10.832 8.230 2822 HB2 GLU 66 2HB GLU 66 18.664 10.754 8.839 2823 HB3 GLU 66 1HB GLU 66 18.804 12.206 7.852 2824 HG2 GLU 66 2HG GLU 66 16.887 11.357 7.034 2825 HG3 GLU 66 1HG GLU 66 17.967 10.537 5.857 2826 H GLY 67 H GLY 67 20.265 9.961 4.996 2827 HA2 GLY 67 2HA GLY 67 21.213 8.199 3.939 2828 HA3 GLY 67 1HA GLY 67 21.322 7.295 5.515 2829 H ARG 68 H ARG 68 18.788 9.056 3.771 2830 HA ARG 68 HA ARG 68 16.531 8.468 4.372 2831 HB2 ARG 68 2HB ARG 68 16.971 9.711 2.374 2832 HB3 ARG 68 1HB ARG 68 17.381 8.215 1.454 2833 HG2 ARG 68 2HG ARG 68 15.052 7.463 1.514 2834 HG3 ARG 68 1HG ARG 68 14.601 8.744 2.675 2835 HD2 ARG 68 2HD ARG 68 15.519 9.256 -0.251 2836 HD3 ARG 68 1HD ARG 68 13.811 9.174 0.302 2837 HE ARG 68 HE ARG 68 15.715 11.391 0.755 2838 HH11 ARG 68 1HH2 ARG 68 12.368 10.238 1.403 2839 HH12 ARG 68 2HH2 ARG 68 12.075 11.349 2.582 2840 HH21 ARG 68 1HH1 ARG 68 14.677 13.420 1.800 2841 HH22 ARG 68 2HH1 ARG 68 13.847 13.015 3.219 2842 H LYS 69 H LYS 69 18.387 5.854 3.202 2843 HA LYS 69 HA LYS 69 16.462 3.825 2.958 2844 HB2 LYS 69 2HB LYS 69 19.359 3.707 3.946 2845 HB3 LYS 69 1HB LYS 69 18.370 2.278 3.504 2846 HG2 LYS 69 2HG LYS 69 19.135 4.510 1.501 2847 HG3 LYS 69 1HG LYS 69 20.113 3.042 1.827 2848 HD2 LYS 69 2HD LYS 69 18.203 1.576 1.104 2849 HD3 LYS 69 1HD LYS 69 17.227 3.037 0.760 2850 HE2 LYS 69 2HE LYS 69 18.111 2.170 -1.352 2851 HE3 LYS 69 1HE LYS 69 18.902 3.753 -1.000 2852 HZ1 LYS 69 3HZ LYS 69 20.453 2.129 -1.849 2853 HZ2 LYS 69 1HZ LYS 69 20.127 1.037 -0.613 2854 HZ3 LYS 69 2HZ LYS 69 20.884 2.500 -0.241 2855 H VAL 70 H VAL 70 17.485 5.687 5.865 2856 HA VAL 70 HA VAL 70 17.016 3.582 7.670 2857 HB VAL 70 HB VAL 70 16.572 6.553 8.233 2858 HG11 VAL 70 1HG1 VAL 70 17.182 4.137 10.083 2859 HG12 VAL 70 2HG1 VAL 70 15.612 5.025 9.972 2860 HG13 VAL 70 3HG1 VAL 70 17.071 5.872 10.581 2861 HG21 VAL 70 3HG2 VAL 70 19.151 4.835 8.314 2862 HG22 VAL 70 1HG2 VAL 70 18.949 6.451 9.109 2863 HG23 VAL 70 2HG2 VAL 70 18.822 6.328 7.344 2864 H ALA 71 H ALA 71 14.907 6.134 6.286 2865 HA ALA 71 HA ALA 71 12.564 5.248 7.592 2866 HB1 ALA 71 1HB ALA 71 12.843 6.767 4.915 2867 HB2 ALA 71 2HB ALA 71 12.751 7.511 6.553 2868 HB3 ALA 71 3HB ALA 71 11.333 6.625 5.896 2869 H GLU 72 H GLU 72 13.897 4.614 4.354 2870 HA GLU 72 HA GLU 72 11.837 3.077 3.350 2871 HB2 GLU 72 2HB GLU 72 14.335 4.015 2.497 2872 HB3 GLU 72 1HB GLU 72 14.539 2.242 2.373 2873 HG2 GLU 72 2HG GLU 72 12.162 3.811 1.135 2874 HG3 GLU 72 1HG GLU 72 13.732 3.559 0.296 2875 H GLN 73 H GLN 73 14.651 2.054 5.320 2876 HA GLN 73 HA GLN 73 14.245 -0.687 4.949 2877 HB2 GLN 73 2HB GLN 73 16.342 0.482 5.727 2878 HB3 GLN 73 1HB GLN 73 15.580 0.721 7.332 2879 HG2 GLN 73 2HG GLN 73 15.584 -1.815 7.623 2880 HG3 GLN 73 1HG GLN 73 16.209 -1.993 5.941 2881 HE21 GLN 73 1HE2 GLN 73 16.968 -0.177 9.002 2882 HE22 GLN 73 2HE2 GLN 73 18.692 -0.289 8.853 2883 H VAL 74 H VAL 74 12.697 1.626 7.140 2884 HA VAL 74 HA VAL 74 11.634 -0.378 8.902 2885 HB VAL 74 HB VAL 74 10.856 2.549 8.408 2886 HG11 VAL 74 1HG1 VAL 74 8.918 1.359 9.407 2887 HG12 VAL 74 2HG1 VAL 74 9.711 2.364 10.665 2888 HG13 VAL 74 3HG1 VAL 74 9.982 0.576 10.633 2889 HG21 VAL 74 3HG2 VAL 74 13.215 2.149 9.285 2890 HG22 VAL 74 1HG2 VAL 74 12.526 1.217 10.653 2891 HG23 VAL 74 2HG2 VAL 74 12.161 2.978 10.466 2892 H MET 75 H MET 75 10.570 1.453 6.029 2893 HA MET 75 HA MET 75 7.906 0.646 5.992 2894 HB2 MET 75 2HB MET 75 9.802 1.337 3.658 2895 HB3 MET 75 1HB MET 75 8.024 1.216 3.511 2896 HG2 MET 75 2HG MET 75 7.653 3.134 4.923 2897 HG3 MET 75 1HG MET 75 9.337 3.145 5.502 2898 HE1 MET 75 3HE MET 75 7.885 5.705 4.596 2899 HE2 MET 75 1HE MET 75 9.216 6.508 3.691 2900 HE3 MET 75 2HE MET 75 9.576 5.584 5.190 2901 H LYS 76 H LYS 76 10.803 -0.720 4.321 2902 HA LYS 76 HA LYS 76 9.348 -2.732 3.072 2903 HB2 LYS 76 2HB LYS 76 11.771 -1.948 2.538 2904 HB3 LYS 76 1HB LYS 76 12.288 -3.091 3.825 2905 HG2 LYS 76 2HG LYS 76 10.867 -4.887 2.506 2906 HG3 LYS 76 1HG LYS 76 10.769 -3.659 1.197 2907 HD2 LYS 76 2HD LYS 76 13.304 -3.637 1.115 2908 HD3 LYS 76 1HD LYS 76 13.316 -4.906 2.401 2909 HE2 LYS 76 2HE LYS 76 11.912 -6.398 0.825 2910 HE3 LYS 76 1HE LYS 76 12.172 -5.164 -0.473 2911 HZ1 LYS 76 3HZ LYS 76 14.575 -5.484 -0.162 2912 HZ2 LYS 76 1HZ LYS 76 13.746 -6.935 -0.613 2913 HZ3 LYS 76 2HZ LYS 76 14.230 -6.715 1.007 2914 H ALA 77 H ALA 77 10.934 -2.680 6.269 2915 HA ALA 77 HA ALA 77 10.657 -5.419 6.832 2916 HB1 ALA 77 1HB ALA 77 10.610 -3.029 8.791 2917 HB2 ALA 77 2HB ALA 77 12.093 -3.883 8.230 2918 HB3 ALA 77 3HB ALA 77 10.882 -4.755 9.244 2919 H GLY 78 H GLY 78 8.460 -2.630 7.223 2920 HA2 GLY 78 2HA GLY 78 6.455 -3.954 8.685 2921 HA3 GLY 78 1HA GLY 78 6.303 -2.474 7.657 2922 H ILE 79 H ILE 79 6.810 -3.307 5.174 2923 HA ILE 79 HA ILE 79 4.461 -4.526 4.383 2924 HB ILE 79 HB ILE 79 7.115 -4.226 2.904 2925 HG12 ILE 79 2HG1 ILE 79 4.496 -2.592 2.730 2926 HG13 ILE 79 1HG1 ILE 79 5.899 -2.105 3.712 2927 HG21 ILE 79 1HG2 ILE 79 5.758 -4.561 0.789 2928 HG22 ILE 79 2HG2 ILE 79 4.316 -4.964 1.791 2929 HG23 ILE 79 3HG2 ILE 79 5.768 -6.034 1.796 2930 HD11 ILE 79 3HD ILE 79 5.901 -2.422 0.637 2931 HD12 ILE 79 1HD ILE 79 5.942 -0.892 1.574 2932 HD13 ILE 79 2HD ILE 79 7.344 -2.020 1.644 2933 H GLU 80 H GLU 80 7.774 -5.995 4.722 2934 HA GLU 80 HA GLU 80 6.914 -8.492 3.781 2935 HB2 GLU 80 2HB GLU 80 9.319 -7.863 5.577 2936 HB3 GLU 80 1HB GLU 80 8.956 -9.471 4.857 2937 HG2 GLU 80 2HG GLU 80 9.054 -8.391 2.538 2938 HG3 GLU 80 1HG GLU 80 9.682 -6.895 3.316 2939 H VAL 81 H VAL 81 6.718 -7.089 7.065 2940 HA VAL 81 HA VAL 81 6.174 -9.551 8.354 2941 HB VAL 81 HB VAL 81 5.769 -6.622 9.034 2942 HG11 VAL 81 1HG1 VAL 81 4.726 -9.020 10.682 2943 HG12 VAL 81 2HG1 VAL 81 3.789 -7.601 10.086 2944 HG13 VAL 81 3HG1 VAL 81 5.028 -7.381 11.361 2945 HG21 VAL 81 3HG2 VAL 81 7.395 -8.923 10.326 2946 HG22 VAL 81 1HG2 VAL 81 7.498 -7.175 10.733 2947 HG23 VAL 81 2HG2 VAL 81 8.053 -7.751 9.127 2948 H PHE 82 H PHE 82 3.975 -6.940 7.144 2949 HA PHE 82 HA PHE 82 1.657 -8.399 7.828 2950 HB2 PHE 82 2HB PHE 82 1.962 -6.182 5.690 2951 HB3 PHE 82 1HB PHE 82 0.405 -6.738 6.417 2952 HD1 PHE 82 2HD PHE 82 0.599 -6.808 9.202 2953 HD2 PHE 82 1HD PHE 82 2.696 -4.148 6.543 2954 HE1 PHE 82 2HE PHE 82 0.880 -5.189 11.037 2955 HE2 PHE 82 1HE PHE 82 2.996 -2.544 8.384 2956 HZ PHE 82 HZ PHE 82 2.084 -3.049 10.641 2957 H ALA 83 H ALA 83 3.582 -8.161 4.810 2958 HA ALA 83 HA ALA 83 1.719 -9.604 3.261 2959 HB1 ALA 83 1HB ALA 83 3.471 -8.105 2.252 2960 HB2 ALA 83 2HB ALA 83 3.490 -9.758 1.555 2961 HB3 ALA 83 3HB ALA 83 4.739 -9.273 2.771 2962 H LEU 84 H LEU 84 4.361 -10.634 5.457 2963 HA LEU 84 HA LEU 84 4.574 -13.260 4.478 2964 HB2 LEU 84 2HB LEU 84 6.263 -12.273 5.954 2965 HB3 LEU 84 1HB LEU 84 5.098 -12.155 7.304 2966 HG LEU 84 HG LEU 84 5.632 -14.899 6.092 2967 HD11 LEU 84 1HD1 LEU 84 7.676 -13.462 7.904 2968 HD12 LEU 84 2HD1 LEU 84 7.908 -13.901 6.173 2969 HD13 LEU 84 3HD1 LEU 84 7.728 -15.197 7.410 2970 HD21 LEU 84 3HD2 LEU 84 5.523 -15.646 8.488 2971 HD22 LEU 84 1HD2 LEU 84 4.052 -14.718 8.042 2972 HD23 LEU 84 2HD2 LEU 84 5.341 -13.936 9.023 2973 H VAL 85 H VAL 85 2.258 -11.670 6.614 2974 HA VAL 85 HA VAL 85 1.092 -13.946 7.728 2975 HB VAL 85 HB VAL 85 -0.210 -11.240 7.130 2976 HG11 VAL 85 1HG1 VAL 85 -2.003 -12.782 7.688 2977 HG12 VAL 85 2HG1 VAL 85 -1.649 -11.827 9.160 2978 HG13 VAL 85 3HG1 VAL 85 -1.055 -13.525 9.027 2979 HG21 VAL 85 3HG2 VAL 85 0.430 -10.773 9.558 2980 HG22 VAL 85 1HG2 VAL 85 1.825 -10.913 8.459 2981 HG23 VAL 85 2HG2 VAL 85 1.420 -12.278 9.554 2982 H THR 86 H THR 86 1.090 -12.905 4.413 2983 HA THR 86 HA THR 86 -1.350 -13.713 3.536 2984 HB THR 86 HB THR 86 1.263 -14.061 2.026 2985 HG1 THR 86 1HG THR 86 1.114 -11.998 2.423 2986 HG21 THR 86 3HG2 THR 86 -1.686 -13.829 1.066 2987 HG22 THR 86 1HG2 THR 86 -0.626 -15.278 0.881 2988 HG23 THR 86 2HG2 THR 86 -0.235 -13.767 0.000 2989 H ALA 87 H ALA 87 1.173 -15.722 4.857 2990 HA ALA 87 HA ALA 87 0.233 -18.142 3.690 2991 HB1 ALA 87 1HB ALA 87 2.510 -17.814 4.505 2992 HB2 ALA 87 2HB ALA 87 1.741 -19.208 5.349 2993 HB3 ALA 87 3HB ALA 87 1.928 -17.594 6.179 2994 H ALA 88 H ALA 88 -1.031 -16.220 6.357 2995 HA ALA 88 HA ALA 88 -2.571 -18.493 7.414 2996 HB1 ALA 88 1HB ALA 88 -3.634 -16.768 8.896 2997 HB2 ALA 88 2HB ALA 88 -2.670 -15.476 8.091 2998 HB3 ALA 88 3HB ALA 88 -1.843 -16.737 9.076 2999 H LEU 89 H LEU 89 -2.760 -15.481 5.541 3000 HA LEU 89 HA LEU 89 -5.468 -15.382 5.099 3001 HB2 LEU 89 2HB LEU 89 -3.177 -14.489 3.256 3002 HB3 LEU 89 1HB LEU 89 -4.827 -13.946 3.109 3003 HG LEU 89 HG LEU 89 -2.835 -13.314 5.342 3004 HD11 LEU 89 1HD1 LEU 89 -3.210 -10.964 4.684 3005 HD12 LEU 89 2HD1 LEU 89 -4.449 -11.467 3.477 3006 HD13 LEU 89 3HD1 LEU 89 -2.725 -11.938 3.252 3007 HD21 LEU 89 3HD2 LEU 89 -4.505 -11.986 6.560 3008 HD22 LEU 89 1HD2 LEU 89 -4.967 -13.718 6.560 3009 HD23 LEU 89 2HD2 LEU 89 -5.818 -12.549 5.479 3010 H ALA 90 H ALA 90 -2.949 -17.024 3.152 3011 HA ALA 90 HA ALA 90 -4.647 -17.712 1.054 3012 HB1 ALA 90 1HB ALA 90 -2.071 -19.085 2.005 3013 HB2 ALA 90 2HB ALA 90 -2.174 -17.726 0.828 3014 HB3 ALA 90 3HB ALA 90 -2.856 -19.332 0.394 3015 H THR 91 H THR 91 -4.297 -19.231 4.256 3016 HA THR 91 HA THR 91 -5.624 -21.614 3.189 3017 HB THR 91 HB THR 91 -3.683 -22.023 4.552 3018 HG1 THR 91 1HG THR 91 -6.180 -22.831 5.576 3019 HG21 THR 91 3HG2 THR 91 -3.818 -21.700 7.057 3020 HG22 THR 91 1HG2 THR 91 -5.270 -20.656 6.828 3021 HG23 THR 91 2HG2 THR 91 -3.679 -20.174 6.131 3022 H ASP 92 H ASP 92 -6.539 -18.496 4.115 3023 HA ASP 92 HA ASP 92 -8.557 -19.256 5.931 3024 HB2 ASP 92 2HB ASP 92 -7.449 -16.877 5.659 3025 HB3 ASP 92 1HB ASP 92 -8.749 -16.597 4.445 3026 H PHE 93 H PHE 93 -8.403 -18.987 2.413 3027 HA PHE 93 HA PHE 93 -11.273 -19.242 2.197 3028 HB2 PHE 93 2HB PHE 93 -11.113 -19.297 -0.116 3029 HB3 PHE 93 1HB PHE 93 -9.932 -18.060 0.404 3030 HD1 PHE 93 2HD PHE 93 -7.449 -18.566 0.207 3031 HD2 PHE 93 1HD PHE 93 -10.461 -21.222 -1.324 3032 HE1 PHE 93 2HE PHE 93 -5.773 -19.635 -1.255 3033 HE2 PHE 93 1HE PHE 93 -8.778 -22.288 -2.792 3034 HZ PHE 93 HZ PHE 93 -6.427 -21.481 -2.767 3035 H VAL 94 H VAL 94 -8.488 -21.398 2.289 3036 HA VAL 94 HA VAL 94 -9.634 -23.614 1.068 3037 HB VAL 94 HB VAL 94 -7.422 -23.533 3.184 3038 HG11 VAL 94 1HG1 VAL 94 -8.240 -25.862 2.814 3039 HG12 VAL 94 2HG1 VAL 94 -6.644 -25.649 2.019 3040 HG13 VAL 94 3HG1 VAL 94 -8.149 -25.646 1.029 3041 HG21 VAL 94 3HG2 VAL 94 -5.899 -23.426 1.166 3042 HG22 VAL 94 1HG2 VAL 94 -6.946 -21.981 1.253 3043 HG23 VAL 94 2HG2 VAL 94 -7.337 -23.286 0.090 3044 H ARG 95 H ARG 95 -10.012 -22.252 4.256 3045 HA ARG 95 HA ARG 95 -11.068 -24.263 5.769 3046 HB2 ARG 95 2HB ARG 95 -12.185 -21.400 5.428 3047 HB3 ARG 95 1HB ARG 95 -12.625 -22.514 6.770 3048 HG2 ARG 95 2HG ARG 95 -10.312 -22.443 7.637 3049 HG3 ARG 95 1HG ARG 95 -9.817 -21.364 6.282 3050 HD2 ARG 95 2HD ARG 95 -11.444 -19.611 7.024 3051 HD3 ARG 95 1HD ARG 95 -12.005 -20.655 8.383 3052 HE ARG 95 HE ARG 95 -9.577 -19.024 8.178 3053 HH11 ARG 95 1HH2 ARG 95 -11.434 -21.381 10.192 3054 HH12 ARG 95 2HH2 ARG 95 -10.268 -21.491 11.409 3055 HH21 ARG 95 1HH1 ARG 95 -7.960 -19.139 9.992 3056 HH22 ARG 95 2HH1 ARG 95 -8.326 -20.040 11.365 3057 H ARG 96 H ARG 96 -12.628 -22.600 2.965 3058 HA ARG 96 HA ARG 96 -15.228 -23.385 3.776 3059 HB2 ARG 96 2HB ARG 96 -16.117 -22.426 1.843 3060 HB3 ARG 96 1HB ARG 96 -14.726 -21.392 2.302 3061 HG2 ARG 96 2HG ARG 96 -13.370 -22.767 0.512 3062 HG3 ARG 96 1HG ARG 96 -14.967 -23.430 0.017 3063 HD2 ARG 96 2HD ARG 96 -15.765 -20.977 -0.319 3064 HD3 ARG 96 1HD ARG 96 -14.056 -20.470 -0.050 3065 HE ARG 96 HE ARG 96 -13.396 -21.599 -2.050 3066 HH11 ARG 96 1HH2 ARG 96 -17.050 -21.810 -1.563 3067 HH12 ARG 96 2HH2 ARG 96 -17.253 -22.496 -3.127 3068 HH21 ARG 96 1HH1 ARG 96 -13.895 -22.632 -4.181 3069 HH22 ARG 96 2HH1 ARG 96 -15.501 -22.840 -4.651 3070 H GLU 97 H GLU 97 -12.656 -25.113 2.309 3071 HA GLU 97 HA GLU 97 -14.302 -27.081 0.982 3072 HB2 GLU 97 2HB GLU 97 -11.944 -26.597 0.212 3073 HB3 GLU 97 1HB GLU 97 -11.338 -27.099 1.820 3074 HG2 GLU 97 2HG GLU 97 -10.882 -28.891 0.315 3075 HG3 GLU 97 1HG GLU 97 -12.208 -29.451 1.388 3076 H GLU 98 H GLU 98 -12.522 -26.614 4.091 3077 HA GLU 98 HA GLU 98 -12.951 -29.239 4.992 3078 HB2 GLU 98 2HB GLU 98 -12.312 -26.734 6.661 3079 HB3 GLU 98 1HB GLU 98 -12.293 -28.433 7.233 3080 HG2 GLU 98 2HG GLU 98 -10.586 -28.877 5.271 3081 HG3 GLU 98 1HG GLU 98 -10.386 -27.084 5.217 3082 H GLU 99 H GLU 99 -14.730 -26.142 5.660 3083 HA GLU 99 HA GLU 99 -16.506 -27.555 7.395 3084 HB2 GLU 99 2HB GLU 99 -17.977 -25.633 7.465 3085 HB3 GLU 99 1HB GLU 99 -16.291 -25.261 7.914 3086 HG2 GLU 99 2HG GLU 99 -15.899 -24.085 5.780 3087 HG3 GLU 99 1HG GLU 99 -17.505 -24.617 5.142 3088 H ARG 100 H ARG 100 -16.265 -27.589 3.975 3089 HA ARG 100 HA ARG 100 -19.044 -27.819 3.469 3090 HB2 ARG 100 2HB ARG 100 -17.083 -27.435 1.726 3091 HB3 ARG 100 1HB ARG 100 -16.986 -29.225 1.710 3092 HG2 ARG 100 2HG ARG 100 -19.580 -29.156 1.212 3093 HG3 ARG 100 1HG ARG 100 -19.374 -27.390 1.026 3094 HD2 ARG 100 2HD ARG 100 -19.362 -28.320 -1.197 3095 HD3 ARG 100 1HD ARG 100 -17.649 -27.875 -0.868 3096 HE ARG 100 HE ARG 100 -18.899 -30.606 -1.002 3097 HH11 ARG 100 1HH2 ARG 100 -15.829 -28.721 -0.624 3098 HH12 ARG 100 2HH2 ARG 100 -14.796 -30.022 -0.910 3099 HH21 ARG 100 1HH1 ARG 100 -17.525 -32.411 -1.333 3100 HH22 ARG 100 2HH1 ARG 100 -15.806 -32.212 -1.401 3101 H ARG 101 H ARG 101 -16.523 -30.042 4.580 3102 HA ARG 101 HA ARG 101 -18.170 -32.401 4.234 3103 HB2 ARG 101 2HB ARG 101 -15.700 -32.045 6.057 3104 HB3 ARG 101 1HB ARG 101 -16.464 -33.591 5.549 3105 HG2 ARG 101 2HG ARG 101 -15.774 -33.025 3.140 3106 HG3 ARG 101 1HG ARG 101 -14.862 -31.619 3.810 3107 HD2 ARG 101 2HD ARG 101 -13.561 -33.281 5.305 3108 HD3 ARG 101 1HD ARG 101 -14.435 -34.626 4.459 3109 HE ARG 101 HE ARG 101 -12.855 -32.648 2.816 3110 HH11 ARG 101 1HH2 ARG 101 -12.974 -36.022 4.220 3111 HH12 ARG 101 2HH2 ARG 101 -11.640 -36.544 3.340 3112 HH21 ARG 101 1HH1 ARG 101 -10.912 -33.390 1.752 3113 HH22 ARG 101 2HH1 ARG 101 -10.394 -35.025 1.913 3114 H GLY 102 H GLY 102 -17.816 -29.795 6.508 3115 HA2 GLY 102 2HA GLY 102 -18.984 -29.323 8.337 3116 HA3 GLY 102 1HA GLY 102 -19.724 -30.966 8.311 3117 H HIS 103 H HIS 103 -16.302 -30.780 8.013 3118 HA HIS 103 HA HIS 103 -14.702 -31.745 9.160 3119 HB2 HIS 103 2HB HIS 103 -14.956 -29.371 10.155 3120 HB3 HIS 103 1HB HIS 103 -15.619 -30.154 11.616 3121 HD1 HIS 103 1HD HIS 103 -13.718 -31.780 12.872 3122 HD2 HIS 103 2HD HIS 103 -12.266 -29.454 9.691 3123 HE1 HIS 103 1HE HIS 103 -11.191 -31.667 13.118 3124 HE2 HIS 103 2HE HIS 103 -10.371 -30.300 11.065 Start of MODEL 7 1 H1 SER 1 H SER 1 -23.482 -15.617 -5.416 2 HA SER 1 HA SER 1 -21.487 -14.380 -3.796 3 HB2 SER 1 2HB SER 1 -24.345 -14.684 -2.673 4 HB3 SER 1 1HB SER 1 -22.887 -14.151 -1.739 5 HG SER 1 1HG SER 1 -23.548 -12.935 -4.167 6 H ALA 2 H ALA 2 -20.305 -16.253 -4.006 7 HA ALA 2 HA ALA 2 -21.495 -18.800 -3.860 8 HB1 ALA 2 1HB ALA 2 -19.395 -18.485 -5.137 9 HB2 ALA 2 2HB ALA 2 -19.167 -19.693 -3.831 10 HB3 ALA 2 3HB ALA 2 -18.518 -18.029 -3.635 11 H ASP 3 H ASP 3 -18.954 -17.439 -1.602 12 HA ASP 3 HA ASP 3 -20.540 -18.511 0.638 13 HB2 ASP 3 2HB ASP 3 -19.111 -20.370 -0.499 14 HB3 ASP 3 1HB ASP 3 -17.646 -19.504 -0.008 15 H HIS 4 H HIS 4 -17.107 -17.847 0.208 16 HA HIS 4 HA HIS 4 -17.191 -16.106 2.446 17 HB2 HIS 4 2HB HIS 4 -14.741 -15.916 2.253 18 HB3 HIS 4 1HB HIS 4 -15.357 -17.590 2.345 19 HD1 HIS 4 1HD HIS 4 -15.852 -16.812 -1.267 20 HD2 HIS 4 2HD HIS 4 -12.504 -17.541 1.261 21 HE1 HIS 4 1HE HIS 4 -13.996 -17.551 -2.677 22 HE2 HIS 4 2HE HIS 4 -11.988 -17.819 -1.247 23 H GLU 5 H GLU 5 -17.865 -15.412 -0.730 24 HA GLU 5 HA GLU 5 -16.735 -12.864 -0.995 25 HB2 GLU 5 2HB GLU 5 -19.427 -13.029 -2.241 26 HB3 GLU 5 1HB GLU 5 -17.837 -12.778 -2.974 27 HG2 GLU 5 2HG GLU 5 -19.264 -15.414 -2.332 28 HG3 GLU 5 1HG GLU 5 -18.867 -14.739 -3.959 29 H ARG 6 H ARG 6 -19.480 -14.175 0.770 30 HA ARG 6 HA ARG 6 -20.854 -11.744 1.212 31 HB2 ARG 6 2HB ARG 6 -20.826 -14.242 3.019 32 HB3 ARG 6 1HB ARG 6 -22.039 -12.922 3.031 33 HG2 ARG 6 2HG ARG 6 -22.718 -13.608 0.660 34 HG3 ARG 6 1HG ARG 6 -21.526 -14.943 0.753 35 HD2 ARG 6 2HD ARG 6 -23.673 -15.941 1.268 36 HD3 ARG 6 1HD ARG 6 -22.756 -15.844 2.827 37 HE ARG 6 HE ARG 6 -24.478 -13.469 2.243 38 HH11 ARG 6 1HH2 ARG 6 -24.612 -16.846 3.596 39 HH12 ARG 6 2HH2 ARG 6 -25.886 -16.527 4.649 40 HH21 ARG 6 1HH1 ARG 6 -26.196 -13.031 3.614 41 HH22 ARG 6 2HH1 ARG 6 -26.899 -14.186 4.668 42 H GLU 7 H GLU 7 -18.165 -13.465 2.841 43 HA GLU 7 HA GLU 7 -18.322 -11.700 5.089 44 HB2 GLU 7 2HB GLU 7 -17.552 -14.235 4.969 45 HB3 GLU 7 1HB GLU 7 -15.926 -13.511 4.720 46 HG2 GLU 7 2HG GLU 7 -16.119 -12.286 6.875 47 HG3 GLU 7 1HG GLU 7 -17.863 -12.711 7.015 48 H ALA 8 H ALA 8 -16.531 -11.892 2.052 49 HA ALA 8 HA ALA 8 -14.541 -10.051 2.651 50 HB1 ALA 8 1HB ALA 8 -14.517 -11.418 0.539 51 HB2 ALA 8 2HB ALA 8 -14.382 -9.663 0.169 52 HB3 ALA 8 3HB ALA 8 -15.953 -10.509 -0.063 53 H GLN 9 H GLN 9 -17.812 -9.523 1.229 54 HA GLN 9 HA GLN 9 -17.427 -6.691 1.197 55 HB2 GLN 9 2HB GLN 9 -19.775 -6.514 0.501 56 HB3 GLN 9 1HB GLN 9 -18.860 -7.717 -0.454 57 HG2 GLN 9 2HG GLN 9 -19.891 -9.520 1.199 58 HG3 GLN 9 1HG GLN 9 -21.014 -8.214 1.709 59 HE21 GLN 9 1HE2 GLN 9 -19.680 -9.899 -1.205 60 HE22 GLN 9 2HE2 GLN 9 -21.013 -9.620 -2.261 61 H LYS 10 H LYS 10 -18.548 -8.984 3.636 62 HA LYS 10 HA LYS 10 -19.942 -7.091 5.204 63 HB2 LYS 10 2HB LYS 10 -20.164 -9.600 5.547 64 HB3 LYS 10 1HB LYS 10 -18.497 -9.608 6.227 65 HG2 LYS 10 2HG LYS 10 -19.256 -7.965 8.008 66 HG3 LYS 10 1HG LYS 10 -20.893 -7.970 7.285 67 HD2 LYS 10 2HD LYS 10 -21.046 -10.454 7.852 68 HD3 LYS 10 1HD LYS 10 -19.438 -10.309 8.671 69 HE2 LYS 10 2HE LYS 10 -20.410 -8.450 10.141 70 HE3 LYS 10 1HE LYS 10 -22.004 -8.695 9.329 71 HZ1 LYS 10 3HZ LYS 10 -21.669 -11.140 10.172 72 HZ2 LYS 10 1HZ LYS 10 -22.198 -9.901 11.203 73 HZ3 LYS 10 2HZ LYS 10 -20.565 -10.417 11.247 74 H ALA 11 H ALA 11 -16.518 -8.108 4.950 75 HA ALA 11 HA ALA 11 -15.596 -6.880 7.248 76 HB1 ALA 11 1HB ALA 11 -14.086 -7.185 4.578 77 HB2 ALA 11 2HB ALA 11 -14.225 -8.457 5.849 78 HB3 ALA 11 3HB ALA 11 -13.344 -6.930 6.202 79 H GLU 12 H GLU 12 -16.363 -5.468 4.066 80 HA GLU 12 HA GLU 12 -15.090 -2.996 4.526 81 HB2 GLU 12 2HB GLU 12 -17.539 -3.472 2.724 82 HB3 GLU 12 1HB GLU 12 -16.396 -2.090 2.680 83 HG2 GLU 12 2HG GLU 12 -14.534 -3.792 2.090 84 HG3 GLU 12 1HG GLU 12 -15.831 -5.027 1.903 85 H GLU 13 H GLU 13 -18.112 -4.333 5.756 86 HA GLU 13 HA GLU 13 -19.393 -1.828 6.288 87 HB2 GLU 13 2HB GLU 13 -19.778 -4.511 7.760 88 HB3 GLU 13 1HB GLU 13 -20.878 -3.101 7.810 89 HG2 GLU 13 2HG GLU 13 -21.473 -3.460 5.408 90 HG3 GLU 13 1HG GLU 13 -20.277 -4.813 5.305 91 H GLU 14 H GLU 14 -17.317 -4.149 8.032 92 HA GLU 14 HA GLU 14 -17.517 -3.002 10.569 93 HB2 GLU 14 2HB GLU 14 -16.663 -5.315 10.254 94 HB3 GLU 14 1HB GLU 14 -15.261 -4.675 9.338 95 HG2 GLU 14 2HG GLU 14 -14.450 -5.315 11.488 96 HG3 GLU 14 1HG GLU 14 -14.444 -3.525 11.466 97 H LEU 15 H LEU 15 -15.300 -2.414 7.839 98 HA LEU 15 HA LEU 15 -13.534 -0.789 9.166 99 HB2 LEU 15 2HB LEU 15 -13.256 -1.710 6.830 100 HB3 LEU 15 1HB LEU 15 -14.415 -0.490 6.224 101 HG LEU 15 HG LEU 15 -12.874 1.334 6.760 102 HD11 LEU 15 1HD1 LEU 15 -10.573 0.888 7.756 103 HD12 LEU 15 2HD1 LEU 15 -11.111 -0.779 8.161 104 HD13 LEU 15 3HD1 LEU 15 -11.912 0.656 8.909 105 HD21 LEU 15 3HD2 LEU 15 -10.958 0.753 5.267 106 HD22 LEU 15 1HD2 LEU 15 -12.494 0.081 4.622 107 HD23 LEU 15 2HD2 LEU 15 -11.314 -0.997 5.453 108 H GLN 16 H GLN 16 -16.623 0.077 7.624 109 HA GLN 16 HA GLN 16 -16.309 2.866 7.857 110 HB2 GLN 16 2HB GLN 16 -18.818 1.131 7.605 111 HB3 GLN 16 1HB GLN 16 -18.823 2.927 7.479 112 HG2 GLN 16 2HG GLN 16 -17.449 2.916 5.481 113 HG3 GLN 16 1HG GLN 16 -17.056 1.172 5.645 114 HE21 GLN 16 1HE2 GLN 16 -18.440 -0.341 4.770 115 HE22 GLN 16 2HE2 GLN 16 -19.977 0.019 4.032 116 H LYS 17 H LYS 17 -17.416 0.400 10.146 117 HA LYS 17 HA LYS 17 -18.666 2.245 11.935 118 HB2 LYS 17 2HB LYS 17 -19.176 -0.204 11.989 119 HB3 LYS 17 1HB LYS 17 -17.459 -0.528 12.338 120 HG2 LYS 17 2HG LYS 17 -17.921 0.984 14.540 121 HG3 LYS 17 1HG LYS 17 -19.639 0.687 14.140 122 HD2 LYS 17 2HD LYS 17 -18.782 -0.911 15.819 123 HD3 LYS 17 1HD LYS 17 -19.201 -1.782 14.294 124 HE2 LYS 17 2HE LYS 17 -16.754 -1.864 13.666 125 HE3 LYS 17 1HE LYS 17 -16.329 -0.928 15.149 126 HZ1 LYS 17 3HZ LYS 17 -16.177 -3.470 14.989 127 HZ2 LYS 17 1HZ LYS 17 -17.832 -3.465 15.337 128 HZ3 LYS 17 2HZ LYS 17 -16.724 -2.706 16.456 129 H VAL 18 H VAL 18 -15.341 0.893 11.556 130 HA VAL 18 HA VAL 18 -14.337 1.938 13.962 131 HB VAL 18 HB VAL 18 -12.858 1.294 11.358 132 HG11 VAL 18 1HG1 VAL 18 -10.841 1.062 12.873 133 HG12 VAL 18 2HG1 VAL 18 -11.810 1.709 14.248 134 HG13 VAL 18 3HG1 VAL 18 -11.445 2.750 12.821 135 HG21 VAL 18 3HG2 VAL 18 -12.359 -0.883 12.532 136 HG22 VAL 18 1HG2 VAL 18 -14.121 -0.675 12.296 137 HG23 VAL 18 2HG2 VAL 18 -13.397 -0.380 13.915 138 H LEU 19 H LEU 19 -14.633 3.289 10.659 139 HA LEU 19 HA LEU 19 -13.212 5.628 11.045 140 HB2 LEU 19 2HB LEU 19 -15.827 5.420 9.426 141 HB3 LEU 19 1HB LEU 19 -14.551 6.665 9.257 142 HG LEU 19 HG LEU 19 -14.341 3.688 8.553 143 HD11 LEU 19 1HD1 LEU 19 -14.323 6.186 6.757 144 HD12 LEU 19 2HD1 LEU 19 -15.697 5.036 6.959 145 HD13 LEU 19 3HD1 LEU 19 -14.150 4.478 6.214 146 HD21 LEU 19 3HD2 LEU 19 -12.111 4.240 7.564 147 HD22 LEU 19 1HD2 LEU 19 -12.125 4.359 9.357 148 HD23 LEU 19 2HD2 LEU 19 -12.162 5.856 8.351 149 H GLU 20 H GLU 20 -16.637 4.875 11.793 150 HA GLU 20 HA GLU 20 -17.313 7.522 12.537 151 HB2 GLU 20 2HB GLU 20 -18.707 4.845 13.118 152 HB3 GLU 20 1HB GLU 20 -19.398 6.456 13.518 153 HG2 GLU 20 2HG GLU 20 -19.371 7.104 11.105 154 HG3 GLU 20 1HG GLU 20 -18.713 5.491 10.662 155 H GLU 21 H GLU 21 -15.980 4.740 14.332 156 HA GLU 21 HA GLU 21 -16.396 5.986 16.898 157 HB2 GLU 21 2HB GLU 21 -14.263 3.897 16.085 158 HB3 GLU 21 1HB GLU 21 -14.581 4.518 17.744 159 HG2 GLU 21 2HG GLU 21 -16.918 3.521 17.622 160 HG3 GLU 21 1HG GLU 21 -16.436 2.722 16.076 161 H ALA 22 H ALA 22 -13.763 5.723 14.498 162 HA ALA 22 HA ALA 22 -11.829 7.022 15.994 163 HB1 ALA 22 1HB ALA 22 -11.228 5.557 14.109 164 HB2 ALA 22 2HB ALA 22 -10.556 7.208 13.842 165 HB3 ALA 22 3HB ALA 22 -12.033 6.672 12.960 166 H SER 23 H SER 23 -14.396 8.426 13.902 167 HA SER 23 HA SER 23 -13.100 10.933 13.726 168 HB2 SER 23 2HB SER 23 -15.468 11.755 13.120 169 HB3 SER 23 1HB SER 23 -14.739 10.478 12.078 170 HG SER 23 1HG SER 23 -16.845 9.929 12.602 171 H LYS 24 H LYS 24 -15.285 9.448 16.127 172 HA LYS 24 HA LYS 24 -15.692 11.847 17.614 173 HB2 LYS 24 2HB LYS 24 -17.198 9.919 17.907 174 HB3 LYS 24 1HB LYS 24 -15.868 8.902 18.541 175 HG2 LYS 24 2HG LYS 24 -16.696 11.529 19.920 176 HG3 LYS 24 1HG LYS 24 -17.641 10.021 20.152 177 HD2 LYS 24 2HD LYS 24 -15.709 8.847 21.105 178 HD3 LYS 24 1HD LYS 24 -14.642 10.269 20.850 179 HE2 LYS 24 2HE LYS 24 -16.026 11.657 22.399 180 HE3 LYS 24 1HE LYS 24 -17.114 10.241 22.681 181 HZ1 LYS 24 3HZ LYS 24 -15.157 9.050 23.598 182 HZ2 LYS 24 1HZ LYS 24 -15.583 10.460 24.425 183 HZ3 LYS 24 2HZ LYS 24 -14.222 10.499 23.440 184 H LYS 25 H LYS 25 -13.398 9.127 17.739 185 HA LYS 25 HA LYS 25 -11.998 9.989 20.016 186 HB2 LYS 25 2HB LYS 25 -11.023 8.328 17.615 187 HB3 LYS 25 1HB LYS 25 -10.101 8.525 19.139 188 HG2 LYS 25 2HG LYS 25 -11.768 7.323 20.435 189 HG3 LYS 25 1HG LYS 25 -12.948 7.345 19.089 190 HD2 LYS 25 2HD LYS 25 -11.504 5.837 17.739 191 HD3 LYS 25 1HD LYS 25 -10.296 5.766 19.070 192 HE2 LYS 25 2HE LYS 25 -11.931 4.629 20.557 193 HE3 LYS 25 1HE LYS 25 -13.256 4.878 19.363 194 HZ1 LYS 25 3HZ LYS 25 -12.761 2.933 18.507 195 HZ2 LYS 25 1HZ LYS 25 -11.470 2.738 19.592 196 HZ3 LYS 25 2HZ LYS 25 -11.164 3.431 18.092 197 H ALA 26 H ALA 26 -11.480 10.615 16.515 198 HA ALA 26 HA ALA 26 -9.160 12.007 16.628 199 HB1 ALA 26 1HB ALA 26 -9.822 13.066 14.465 200 HB2 ALA 26 2HB ALA 26 -11.529 12.555 14.733 201 HB3 ALA 26 3HB ALA 26 -10.244 11.320 14.475 202 H VAL 27 H VAL 27 -12.515 13.476 16.925 203 HA VAL 27 HA VAL 27 -11.420 16.065 16.991 204 HB VAL 27 HB VAL 27 -13.571 16.842 17.963 205 HG11 VAL 27 1HG1 VAL 27 -13.152 16.577 15.502 206 HG12 VAL 27 2HG1 VAL 27 -14.862 16.212 15.947 207 HG13 VAL 27 3HG1 VAL 27 -13.731 14.868 15.591 208 HG21 VAL 27 3HG2 VAL 27 -14.395 13.856 17.808 209 HG22 VAL 27 1HG2 VAL 27 -15.458 15.245 18.208 210 HG23 VAL 27 2HG2 VAL 27 -14.164 14.768 19.347 211 H GLU 28 H GLU 28 -11.943 13.707 19.515 212 HA GLU 28 HA GLU 28 -11.651 15.530 21.688 213 HB2 GLU 28 2HB GLU 28 -13.039 13.386 21.614 214 HB3 GLU 28 1HB GLU 28 -11.525 12.437 21.529 215 HG2 GLU 28 2HG GLU 28 -10.926 13.125 23.840 216 HG3 GLU 28 1HG GLU 28 -12.337 14.249 23.904 217 H ALA 29 H ALA 29 -9.656 13.291 19.826 218 HA ALA 29 HA ALA 29 -7.439 13.375 21.576 219 HB1 ALA 29 1HB ALA 29 -7.665 12.419 18.652 220 HB2 ALA 29 2HB ALA 29 -8.085 11.431 20.101 221 HB3 ALA 29 3HB ALA 29 -6.407 11.934 19.852 222 H GLU 30 H GLU 30 -8.204 14.841 18.365 223 HA GLU 30 HA GLU 30 -5.708 16.080 18.126 224 HB2 GLU 30 2HB GLU 30 -7.682 15.385 16.445 225 HB3 GLU 30 1HB GLU 30 -8.153 17.101 16.637 226 HG2 GLU 30 2HG GLU 30 -5.329 16.033 15.834 227 HG3 GLU 30 1HG GLU 30 -6.626 16.401 14.646 228 H ARG 31 H ARG 31 -8.858 17.230 19.465 229 HA ARG 31 HA ARG 31 -7.827 19.893 19.769 230 HB2 ARG 31 2HB ARG 31 -10.285 19.461 19.482 231 HB3 ARG 31 1HB ARG 31 -10.282 18.590 21.026 232 HG2 ARG 31 2HG ARG 31 -9.225 21.068 21.836 233 HG3 ARG 31 1HG ARG 31 -10.176 21.578 20.415 234 HD2 ARG 31 2HD ARG 31 -11.459 21.741 22.616 235 HD3 ARG 31 1HD ARG 31 -12.251 20.587 21.452 236 HE ARG 31 HE ARG 31 -10.305 19.164 23.021 237 HH11 ARG 31 1HH2 ARG 31 -13.427 20.793 23.874 238 HH12 ARG 31 2HH2 ARG 31 -14.128 19.335 24.444 239 HH21 ARG 31 1HH1 ARG 31 -11.214 17.374 24.254 240 HH22 ARG 31 2HH1 ARG 31 -12.845 17.436 24.772 241 H GLY 32 H GLY 32 -6.073 20.101 21.108 242 HA2 GLY 32 2HA GLY 32 -6.047 20.570 23.631 243 HA3 GLY 32 1HA GLY 32 -6.037 18.751 23.678 244 H ALA 33 H ALA 33 -4.737 18.846 20.880 245 HA ALA 33 HA ALA 33 -2.131 18.572 21.851 246 HB1 ALA 33 1HB ALA 33 -3.034 17.188 19.947 247 HB2 ALA 33 2HB ALA 33 -1.589 18.110 19.393 248 HB3 ALA 33 3HB ALA 33 -3.238 18.677 18.964 249 HA PRO 34 HA PRO 34 -0.611 22.638 21.047 250 HB2 PRO 34 2HB PRO 34 2.046 22.188 20.186 251 HB3 PRO 34 1HB PRO 34 1.494 22.045 21.896 252 HG2 PRO 34 2HG PRO 34 1.803 19.808 19.829 253 HG3 PRO 34 1HG PRO 34 2.370 19.827 21.554 254 HD2 PRO 34 2HD PRO 34 0.023 18.595 20.810 255 HD3 PRO 34 1HD PRO 34 0.096 19.537 22.371 256 H GLY 35 H GLY 35 -1.097 24.024 19.362 257 HA2 GLY 35 2HA GLY 35 -1.054 24.826 17.258 258 HA3 GLY 35 1HA GLY 35 -0.291 23.299 16.650 259 H ALA 36 H ALA 36 -1.694 21.332 17.123 260 HA ALA 36 HA ALA 36 -3.355 20.108 16.537 261 HB1 ALA 36 1HB ALA 36 -5.312 22.381 17.179 262 HB2 ALA 36 2HB ALA 36 -4.638 21.220 18.395 263 HB3 ALA 36 3HB ALA 36 -5.675 20.613 17.067 264 H ALA 37 H ALA 37 -5.576 20.313 14.930 265 HA ALA 37 HA ALA 37 -5.028 22.190 12.757 266 HB1 ALA 37 1HB ALA 37 -4.478 20.388 11.073 267 HB2 ALA 37 2HB ALA 37 -4.493 19.159 12.408 268 HB3 ALA 37 3HB ALA 37 -3.242 20.441 12.368 269 H LEU 38 H LEU 38 -6.777 19.330 14.017 270 HA LEU 38 HA LEU 38 -8.639 19.395 11.808 271 HB2 LEU 38 2HB LEU 38 -7.898 17.212 12.834 272 HB3 LEU 38 1HB LEU 38 -8.654 17.711 14.370 273 HG LEU 38 HG LEU 38 -10.903 17.795 13.188 274 HD11 LEU 38 1HD1 LEU 38 -10.171 18.126 10.820 275 HD12 LEU 38 2HD1 LEU 38 -11.150 16.632 10.979 276 HD13 LEU 38 3HD1 LEU 38 -9.360 16.515 10.829 277 HD21 LEU 38 3HD2 LEU 38 -10.144 15.831 14.535 278 HD22 LEU 38 1HD2 LEU 38 -9.402 15.102 13.064 279 HD23 LEU 38 2HD2 LEU 38 -11.189 15.325 13.159 280 H ILE 39 H ILE 39 -8.789 19.588 15.351 281 HA ILE 39 HA ILE 39 -10.562 20.146 16.626 282 HB ILE 39 HB ILE 39 -10.474 22.571 17.108 283 HG12 ILE 39 2HG1 ILE 39 -8.533 22.640 14.693 284 HG13 ILE 39 1HG1 ILE 39 -10.160 23.390 14.736 285 HG21 ILE 39 1HG2 ILE 39 -7.754 21.174 16.631 286 HG22 ILE 39 2HG2 ILE 39 -8.879 20.782 17.974 287 HG23 ILE 39 3HG2 ILE 39 -8.127 22.413 17.882 288 HD11 ILE 39 3HD ILE 39 -7.730 24.157 16.494 289 HD12 ILE 39 1HD ILE 39 -8.454 25.113 15.157 290 HD13 ILE 39 2HD ILE 39 -9.388 24.854 16.680 291 H SER 40 H SER 40 -11.909 19.315 14.277 292 HA SER 40 HA SER 40 -14.190 21.076 14.397 293 HB2 SER 40 2HB SER 40 -12.699 21.892 12.453 294 HB3 SER 40 1HB SER 40 -12.894 20.269 11.721 295 HG SER 40 1HG SER 40 -14.578 21.130 10.874 296 H TYR 41 H TYR 41 -15.984 19.931 14.295 297 HA TYR 41 HA TYR 41 -15.746 17.068 14.420 298 HB2 TYR 41 2HB TYR 41 -17.151 18.256 16.118 299 HB3 TYR 41 1HB TYR 41 -18.237 18.835 14.812 300 HD1 TYR 41 1HD TYR 41 -16.945 15.741 16.545 301 HD2 TYR 41 2HD TYR 41 -19.936 17.404 13.940 302 HE1 TYR 41 1HE TYR 41 -18.261 13.666 16.734 303 HE2 TYR 41 2HE TYR 41 -21.242 15.343 14.117 304 HH TYR 41 HH TYR 41 -21.575 13.481 15.475 305 HA PRO 42 HA PRO 42 -18.558 16.975 10.784 306 HB2 PRO 42 2HB PRO 42 -18.787 19.099 8.920 307 HB3 PRO 42 1HB PRO 42 -19.872 18.888 10.346 308 HG2 PRO 42 2HG PRO 42 -17.350 20.628 10.130 309 HG3 PRO 42 1HG PRO 42 -18.980 21.105 10.761 310 HD2 PRO 42 2HD PRO 42 -16.946 20.364 12.438 311 HD3 PRO 42 1HD PRO 42 -18.644 19.798 12.791 312 H ASP 43 H ASP 43 -15.466 18.534 10.617 313 HA ASP 43 HA ASP 43 -14.709 17.557 8.039 314 HB2 ASP 43 2HB ASP 43 -12.947 18.458 10.428 315 HB3 ASP 43 1HB ASP 43 -12.346 18.115 8.772 316 H ALA 44 H ALA 44 -14.793 16.371 11.365 317 HA ALA 44 HA ALA 44 -12.486 14.819 11.310 318 HB1 ALA 44 1HB ALA 44 -15.024 14.408 13.021 319 HB2 ALA 44 2HB ALA 44 -13.649 15.501 13.408 320 HB3 ALA 44 3HB ALA 44 -13.388 13.722 13.366 321 H ILE 45 H ILE 45 -15.792 14.116 10.349 322 HA ILE 45 HA ILE 45 -15.384 11.299 10.100 323 HB ILE 45 HB ILE 45 -17.548 12.112 10.653 324 HG12 ILE 45 2HG1 ILE 45 -17.682 11.108 7.745 325 HG13 ILE 45 1HG1 ILE 45 -17.380 10.080 9.180 326 HG21 ILE 45 1HG2 ILE 45 -17.426 13.828 8.086 327 HG22 ILE 45 2HG2 ILE 45 -17.452 14.410 9.788 328 HG23 ILE 45 3HG2 ILE 45 -18.883 13.599 9.107 329 HD11 ILE 45 3HD ILE 45 -19.939 11.741 8.637 330 HD12 ILE 45 1HD ILE 45 -19.764 9.956 8.553 331 HD13 ILE 45 2HD ILE 45 -19.619 10.792 10.140 332 H TRP 46 H TRP 46 -14.584 14.071 8.093 333 HA TRP 46 HA TRP 46 -14.532 12.436 5.671 334 HB2 TRP 46 2HB TRP 46 -14.567 15.339 6.269 335 HB3 TRP 46 1HB TRP 46 -13.243 14.934 5.154 336 HD1 TRP 46 HD TRP 46 -14.044 15.776 2.901 337 HE1 TRP 46 1HE TRP 46 -16.301 15.853 1.623 338 HE3 TRP 46 3HE TRP 46 -16.916 13.013 6.094 339 HZ2 TRP 46 2HZ TRP 46 -18.755 14.407 1.659 340 HZ3 TRP 46 3HZ TRP 46 -19.194 12.374 5.420 341 HH2 TRP 46 HH TRP 46 -20.102 13.047 3.224 342 H TRP 47 H TRP 47 -12.386 13.829 8.142 343 HA TRP 47 HA TRP 47 -9.989 13.116 6.810 344 HB2 TRP 47 2HB TRP 47 -10.147 14.797 8.699 345 HB3 TRP 47 1HB TRP 47 -10.531 13.457 9.833 346 HD1 TRP 47 HD TRP 47 -7.609 13.998 7.184 347 HE1 TRP 47 1HE TRP 47 -5.439 13.302 8.282 348 HE3 TRP 47 3HE TRP 47 -9.475 12.722 11.761 349 HZ2 TRP 47 2HZ TRP 47 -4.575 12.382 10.852 350 HZ3 TRP 47 3HZ TRP 47 -7.917 11.887 13.502 351 HH2 TRP 47 HH TRP 47 -5.495 11.732 13.057 352 H SER 48 H SER 48 -12.227 11.436 9.001 353 HA SER 48 HA SER 48 -10.536 9.129 9.243 354 HB2 SER 48 2HB SER 48 -12.280 10.089 10.949 355 HB3 SER 48 1HB SER 48 -13.539 9.339 9.911 356 HG SER 48 1HG SER 48 -13.054 7.884 11.421 357 H VAL 49 H VAL 49 -10.500 9.302 6.594 358 HA VAL 49 HA VAL 49 -12.130 7.033 5.827 359 HB VAL 49 HB VAL 49 -11.938 9.372 3.846 360 HG11 VAL 49 1HG1 VAL 49 -13.545 6.714 3.925 361 HG12 VAL 49 2HG1 VAL 49 -12.083 7.038 2.923 362 HG13 VAL 49 3HG1 VAL 49 -13.589 7.949 2.602 363 HG21 VAL 49 3HG2 VAL 49 -14.365 8.575 5.589 364 HG22 VAL 49 1HG2 VAL 49 -14.360 9.770 4.225 365 HG23 VAL 49 2HG2 VAL 49 -13.424 10.098 5.718 366 H GLU 50 H GLU 50 -9.993 9.443 4.262 367 HA GLU 50 HA GLU 50 -8.415 8.069 2.763 368 HB2 GLU 50 2HB GLU 50 -6.675 10.007 3.442 369 HB3 GLU 50 1HB GLU 50 -8.245 10.384 2.670 370 HG2 GLU 50 2HG GLU 50 -9.284 11.041 4.810 371 HG3 GLU 50 1HG GLU 50 -7.851 10.460 5.723 372 H THR 51 H THR 51 -8.031 8.283 6.234 373 HA THR 51 HA THR 51 -5.457 7.222 6.398 374 HB THR 51 HB THR 51 -6.398 8.702 8.081 375 HG1 THR 51 1HG THR 51 -4.905 7.347 8.893 376 HG21 THR 51 3HG2 THR 51 -8.799 8.069 7.941 377 HG22 THR 51 1HG2 THR 51 -8.212 7.969 9.629 378 HG23 THR 51 2HG2 THR 51 -8.442 6.461 8.676 379 H ALA 52 H ALA 52 -8.688 5.683 6.216 380 HA ALA 52 HA ALA 52 -7.688 3.122 7.103 381 HB1 ALA 52 1HB ALA 52 -9.931 2.281 6.329 382 HB2 ALA 52 2HB ALA 52 -10.319 3.923 5.702 383 HB3 ALA 52 3HB ALA 52 -10.084 3.656 7.475 384 H THR 53 H THR 53 -8.092 4.940 4.104 385 HA THR 53 HA THR 53 -7.619 2.752 2.382 386 HB THR 53 HB THR 53 -7.283 5.741 1.777 387 HG1 THR 53 1HG THR 53 -9.481 5.895 1.537 388 HG21 THR 53 3HG2 THR 53 -6.735 4.100 -0.071 389 HG22 THR 53 1HG2 THR 53 -8.229 5.026 -0.458 390 HG23 THR 53 2HG2 THR 53 -8.346 3.323 0.133 391 H THR 54 H THR 54 -5.647 4.472 4.543 392 HA THR 54 HA THR 54 -3.568 4.934 4.821 393 HB THR 54 HB THR 54 -1.858 3.108 4.020 394 HG1 THR 54 1HG THR 54 -3.694 2.287 2.608 395 HG21 THR 54 3HG2 THR 54 -2.713 3.483 6.348 396 HG22 THR 54 1HG2 THR 54 -2.619 1.725 5.968 397 HG23 THR 54 2HG2 THR 54 -4.217 2.560 5.959 398 H VAL 55 H VAL 55 -4.130 6.799 3.302 399 HA VAL 55 HA VAL 55 -2.141 6.791 1.114 400 HB VAL 55 HB VAL 55 -4.645 8.545 1.389 401 HG11 VAL 55 1HG1 VAL 55 -2.747 9.582 0.066 402 HG12 VAL 55 2HG1 VAL 55 -4.079 9.063 -1.031 403 HG13 VAL 55 3HG1 VAL 55 -2.580 8.072 -0.888 404 HG21 VAL 55 3HG2 VAL 55 -5.579 7.080 -0.383 405 HG22 VAL 55 1HG2 VAL 55 -5.244 6.119 1.072 406 HG23 VAL 55 2HG2 VAL 55 -4.118 6.027 -0.328 407 H GLY 56 H GLY 56 -3.779 9.524 2.844 408 HA2 GLY 56 2HA GLY 56 -2.511 10.567 4.661 409 HA3 GLY 56 1HA GLY 56 -1.061 10.425 3.571 410 H TYR 57 H TYR 57 -1.152 11.394 1.486 411 HA TYR 57 HA TYR 57 -1.453 12.899 0.065 412 HB2 TYR 57 2HB TYR 57 -4.096 11.904 0.386 413 HB3 TYR 57 1HB TYR 57 -4.306 13.681 0.324 414 HD1 TYR 57 2HD TYR 57 -2.098 14.435 -1.595 415 HD2 TYR 57 1HD TYR 57 -4.950 11.232 -1.703 416 HE1 TYR 57 2HE TYR 57 -1.878 14.326 -4.045 417 HE2 TYR 57 1HE TYR 57 -4.824 11.205 -4.169 418 HH TYR 57 HH TYR 57 -2.348 13.003 -5.999 419 H GLY 58 H GLY 58 -3.649 14.135 2.632 420 HA2 GLY 58 2HA GLY 58 -2.367 15.298 4.246 421 HA3 GLY 58 1HA GLY 58 -1.723 16.364 2.963 422 H ASP 59 H ASP 59 -5.093 15.441 4.025 423 HA ASP 59 HA ASP 59 -5.883 18.213 3.832 424 HB2 ASP 59 2HB ASP 59 -7.495 16.296 3.513 425 HB3 ASP 59 1HB ASP 59 -7.335 15.864 5.234 426 H ARG 60 H ARG 60 -5.588 15.809 6.562 427 HA ARG 60 HA ARG 60 -4.591 17.946 8.242 428 HB2 ARG 60 2HB ARG 60 -7.302 16.962 8.429 429 HB3 ARG 60 1HB ARG 60 -6.420 16.158 9.754 430 HG2 ARG 60 2HG ARG 60 -7.400 18.233 10.557 431 HG3 ARG 60 1HG ARG 60 -5.617 18.382 10.577 432 HD2 ARG 60 2HD ARG 60 -6.637 20.523 9.733 433 HD3 ARG 60 1HD ARG 60 -5.725 19.747 8.418 434 HE ARG 60 HE ARG 60 -7.769 19.025 7.358 435 HH11 ARG 60 1HH2 ARG 60 -8.524 21.017 10.330 436 HH12 ARG 60 2HH2 ARG 60 -10.181 21.117 9.918 437 HH21 ARG 60 1HH1 ARG 60 -9.841 19.253 6.855 438 HH22 ARG 60 2HH1 ARG 60 -11.034 20.108 7.842 439 H TYR 61 H TYR 61 -4.037 16.582 10.557 440 HA TYR 61 HA TYR 61 -2.803 14.140 9.867 441 HB2 TYR 61 2HB TYR 61 -0.443 15.183 10.532 442 HB3 TYR 61 1HB TYR 61 -1.019 15.420 8.846 443 HD1 TYR 61 2HD TYR 61 -0.653 17.083 12.174 444 HD2 TYR 61 1HD TYR 61 -1.549 17.619 8.005 445 HE1 TYR 61 2HE TYR 61 -0.576 19.496 12.485 446 HE2 TYR 61 1HE TYR 61 -1.466 20.064 8.299 447 HH TYR 61 HH TYR 61 -0.802 21.542 11.533 448 HA PRO 62 HA PRO 62 -3.221 14.546 14.392 449 HB2 PRO 62 2HB PRO 62 -1.770 12.330 15.253 450 HB3 PRO 62 1HB PRO 62 -3.289 12.104 14.296 451 HG2 PRO 62 2HG PRO 62 -0.387 12.005 13.331 452 HG3 PRO 62 1HG PRO 62 -1.734 10.866 12.922 453 HD2 PRO 62 2HD PRO 62 -0.876 13.125 11.395 454 HD3 PRO 62 1HD PRO 62 -2.504 12.337 11.225 455 H VAL 63 H VAL 63 -1.516 14.712 16.451 456 HA VAL 63 HA VAL 63 0.961 15.846 15.425 457 HB VAL 63 HB VAL 63 -0.581 16.764 17.897 458 HG11 VAL 63 1HG1 VAL 63 1.931 17.191 17.904 459 HG12 VAL 63 2HG1 VAL 63 1.006 18.726 17.713 460 HG13 VAL 63 3HG1 VAL 63 1.795 17.960 16.285 461 HG21 VAL 63 3HG2 VAL 63 -1.151 18.794 16.485 462 HG22 VAL 63 1HG2 VAL 63 -1.994 17.304 15.969 463 HG23 VAL 63 2HG2 VAL 63 -0.577 17.896 15.028 464 H THR 64 H THR 64 0.025 15.191 18.783 465 HA THR 64 HA THR 64 1.817 12.994 18.950 466 HB THR 64 HB THR 64 2.554 15.476 20.604 467 HG1 THR 64 1HG THR 64 4.509 15.314 19.302 468 HG21 THR 64 3HG2 THR 64 3.947 12.714 20.275 469 HG22 THR 64 1HG2 THR 64 3.035 13.249 21.733 470 HG23 THR 64 2HG2 THR 64 4.551 14.087 21.267 471 H GLU 65 H GLU 65 -0.204 15.470 20.565 472 HA GLU 65 HA GLU 65 -0.432 13.817 22.893 473 HB2 GLU 65 2HB GLU 65 -0.266 16.444 22.745 474 HB3 GLU 65 1HB GLU 65 -2.044 16.371 22.495 475 HG2 GLU 65 2HG GLU 65 -2.246 15.101 24.692 476 HG3 GLU 65 1HG GLU 65 -0.454 15.142 24.860 477 H GLU 66 H GLU 66 -2.207 14.143 19.903 478 HA GLU 66 HA GLU 66 -4.724 13.384 20.841 479 HB2 GLU 66 2HB GLU 66 -5.279 12.885 18.502 480 HB3 GLU 66 1HB GLU 66 -4.308 14.374 18.564 481 HG2 GLU 66 2HG GLU 66 -3.388 11.557 17.661 482 HG3 GLU 66 1HG GLU 66 -3.655 13.036 16.656 483 H GLY 67 H GLY 67 -1.788 11.736 19.947 484 HA2 GLY 67 2HA GLY 67 -1.048 9.817 21.023 485 HA3 GLY 67 1HA GLY 67 -2.786 9.244 21.182 486 H ARG 68 H ARG 68 -0.043 9.756 18.918 487 HA ARG 68 HA ARG 68 -1.444 9.785 16.596 488 HB2 ARG 68 2HB ARG 68 1.013 10.243 16.827 489 HB3 ARG 68 1HB ARG 68 1.317 8.478 16.988 490 HG2 ARG 68 2HG ARG 68 0.288 8.204 14.624 491 HG3 ARG 68 1HG ARG 68 0.171 9.991 14.548 492 HD2 ARG 68 2HD ARG 68 2.755 8.294 14.774 493 HD3 ARG 68 1HD ARG 68 2.179 9.183 13.314 494 HE ARG 68 HE ARG 68 3.482 10.278 15.727 495 HH11 ARG 68 1HH2 ARG 68 2.327 11.034 12.378 496 HH12 ARG 68 2HH2 ARG 68 2.285 12.689 12.683 497 HH21 ARG 68 1HH1 ARG 68 2.943 13.021 15.783 498 HH22 ARG 68 2HH1 ARG 68 3.673 13.497 14.386 499 H LYS 69 H LYS 69 -1.040 7.210 18.768 500 HA LYS 69 HA LYS 69 -1.471 4.985 17.145 501 HB2 LYS 69 2HB LYS 69 -2.442 5.365 20.022 502 HB3 LYS 69 1HB LYS 69 -2.194 3.807 19.172 503 HG2 LYS 69 2HG LYS 69 0.021 5.839 19.887 504 HG3 LYS 69 1HG LYS 69 -0.391 4.405 20.864 505 HD2 LYS 69 2HD LYS 69 0.375 3.949 17.929 506 HD3 LYS 69 1HD LYS 69 1.633 4.489 19.071 507 HE2 LYS 69 2HE LYS 69 1.690 2.062 18.872 508 HE3 LYS 69 1HE LYS 69 1.242 2.528 20.561 509 HZ1 LYS 69 3HZ LYS 69 -0.736 1.776 18.455 510 HZ2 LYS 69 1HZ LYS 69 -1.000 1.825 20.163 511 HZ3 LYS 69 2HZ LYS 69 -0.021 0.658 19.425 512 H VAL 70 H VAL 70 -3.629 7.655 17.760 513 HA VAL 70 HA VAL 70 -6.048 6.208 17.408 514 HB VAL 70 HB VAL 70 -5.346 9.152 17.000 515 HG11 VAL 70 1HG1 VAL 70 -7.861 9.512 16.968 516 HG12 VAL 70 2HG1 VAL 70 -8.100 7.729 16.856 517 HG13 VAL 70 3HG1 VAL 70 -7.288 8.622 15.519 518 HG21 VAL 70 3HG2 VAL 70 -6.618 9.402 19.144 519 HG22 VAL 70 1HG2 VAL 70 -5.252 8.267 19.380 520 HG23 VAL 70 2HG2 VAL 70 -6.922 7.627 19.198 521 H ALA 71 H ALA 71 -3.707 7.829 15.178 522 HA ALA 71 HA ALA 71 -5.276 7.290 12.856 523 HB1 ALA 71 1HB ALA 71 -2.247 7.860 13.116 524 HB2 ALA 71 2HB ALA 71 -3.531 9.091 12.816 525 HB3 ALA 71 3HB ALA 71 -3.187 7.837 11.576 526 H GLU 72 H GLU 72 -2.491 5.749 14.477 527 HA GLU 72 HA GLU 72 -1.884 3.705 12.779 528 HB2 GLU 72 2HB GLU 72 -0.726 4.217 15.030 529 HB3 GLU 72 1HB GLU 72 -2.121 3.415 15.824 530 HG2 GLU 72 2HG GLU 72 -1.427 1.306 14.319 531 HG3 GLU 72 1HG GLU 72 0.139 2.175 14.147 532 H GLN 73 H GLN 73 -4.465 3.745 15.251 533 HA GLN 73 HA GLN 73 -5.307 1.125 15.006 534 HB2 GLN 73 2HB GLN 73 -6.013 2.585 16.879 535 HB3 GLN 73 1HB GLN 73 -6.896 3.662 15.748 536 HG2 GLN 73 2HG GLN 73 -8.570 1.909 15.265 537 HG3 GLN 73 1HG GLN 73 -7.651 0.705 16.233 538 HE21 GLN 73 1HE2 GLN 73 -7.511 1.032 18.587 539 HE22 GLN 73 2HE2 GLN 73 -8.759 1.914 19.411 540 H VAL 74 H VAL 74 -6.409 4.069 13.174 541 HA VAL 74 HA VAL 74 -8.498 2.595 11.939 542 HB VAL 74 HB VAL 74 -7.376 5.174 10.762 543 HG11 VAL 74 1HG1 VAL 74 -9.824 5.463 10.194 544 HG12 VAL 74 2HG1 VAL 74 -10.196 3.882 10.969 545 HG13 VAL 74 3HG1 VAL 74 -9.158 3.944 9.496 546 HG21 VAL 74 3HG2 VAL 74 -7.548 5.705 13.119 547 HG22 VAL 74 1HG2 VAL 74 -9.122 4.832 13.290 548 HG23 VAL 74 2HG2 VAL 74 -9.007 6.354 12.322 549 H MET 75 H MET 75 -5.214 3.616 11.012 550 HA MET 75 HA MET 75 -5.283 2.742 8.367 551 HB2 MET 75 2HB MET 75 -2.925 2.948 10.338 552 HB3 MET 75 1HB MET 75 -2.755 2.716 8.559 553 HG2 MET 75 2HG MET 75 -4.063 4.812 8.182 554 HG3 MET 75 1HG MET 75 -4.147 5.120 9.914 555 HE1 MET 75 3HE MET 75 -1.634 5.397 11.385 556 HE2 MET 75 1HE MET 75 -0.084 5.633 10.520 557 HE3 MET 75 2HE MET 75 -0.881 4.030 10.481 558 H LYS 76 H LYS 76 -4.220 1.018 11.382 559 HA LYS 76 HA LYS 76 -3.516 -1.284 9.922 560 HB2 LYS 76 2HB LYS 76 -2.748 -0.665 12.326 561 HB3 LYS 76 1HB LYS 76 -4.305 -1.375 12.872 562 HG2 LYS 76 2HG LYS 76 -3.646 -3.518 11.582 563 HG3 LYS 76 1HG LYS 76 -2.066 -2.744 11.225 564 HD2 LYS 76 2HD LYS 76 -1.630 -2.622 13.735 565 HD3 LYS 76 1HD LYS 76 -3.205 -3.465 13.994 566 HE2 LYS 76 2HE LYS 76 -2.324 -5.391 12.520 567 HE3 LYS 76 1HE LYS 76 -0.710 -4.575 12.511 568 HZ1 LYS 76 3HZ LYS 76 -2.212 -5.579 14.873 569 HZ2 LYS 76 1HZ LYS 76 -0.671 -4.782 14.940 570 HZ3 LYS 76 2HZ LYS 76 -0.863 -6.295 14.141 571 H ALA 77 H ALA 77 -6.573 -0.245 11.472 572 HA ALA 77 HA ALA 77 -7.899 -2.702 11.252 573 HB1 ALA 77 1HB ALA 77 -8.827 -0.794 12.602 574 HB2 ALA 77 2HB ALA 77 -10.024 -1.370 11.383 575 HB3 ALA 77 3HB ALA 77 -9.086 0.143 11.086 576 H GLY 78 H GLY 78 -7.516 0.031 8.963 577 HA2 GLY 78 2HA GLY 78 -9.230 -0.922 6.962 578 HA3 GLY 78 1HA GLY 78 -7.827 0.202 6.784 579 H ILE 79 H ILE 79 -5.699 -1.331 7.434 580 HA ILE 79 HA ILE 79 -5.258 -2.863 5.167 581 HB ILE 79 HB ILE 79 -3.820 -2.812 7.856 582 HG12 ILE 79 2HG1 ILE 79 -3.072 -1.566 5.125 583 HG13 ILE 79 1HG1 ILE 79 -3.910 -0.670 6.413 584 HG21 ILE 79 1HG2 ILE 79 -1.875 -3.898 6.638 585 HG22 ILE 79 2HG2 ILE 79 -2.925 -4.122 5.192 586 HG23 ILE 79 3HG2 ILE 79 -3.283 -4.989 6.731 587 HD11 ILE 79 3HD ILE 79 -1.081 -1.903 6.646 588 HD12 ILE 79 1HD ILE 79 -1.503 -0.166 6.477 589 HD13 ILE 79 2HD ILE 79 -1.967 -1.053 7.972 590 H GLU 80 H GLU 80 -6.193 -3.934 8.515 591 HA GLU 80 HA GLU 80 -6.041 -6.657 7.841 592 HB2 GLU 80 2HB GLU 80 -7.621 -5.293 10.084 593 HB3 GLU 80 1HB GLU 80 -7.519 -7.078 9.866 594 HG2 GLU 80 2HG GLU 80 -5.005 -6.945 10.021 595 HG3 GLU 80 1HG GLU 80 -5.130 -5.197 10.406 596 H VAL 81 H VAL 81 -8.693 -4.314 7.375 597 HA VAL 81 HA VAL 81 -10.643 -6.269 6.701 598 HB VAL 81 HB VAL 81 -10.352 -3.270 6.260 599 HG11 VAL 81 1HG1 VAL 81 -12.774 -3.300 5.447 600 HG12 VAL 81 2HG1 VAL 81 -12.635 -5.079 5.228 601 HG13 VAL 81 3HG1 VAL 81 -11.600 -3.961 4.268 602 HG21 VAL 81 3HG2 VAL 81 -10.854 -4.204 8.571 603 HG22 VAL 81 1HG2 VAL 81 -12.323 -5.012 7.906 604 HG23 VAL 81 2HG2 VAL 81 -12.205 -3.217 7.928 605 H PHE 82 H PHE 82 -8.517 -4.139 4.666 606 HA PHE 82 HA PHE 82 -9.437 -5.359 2.274 607 HB2 PHE 82 2HB PHE 82 -6.893 -3.691 2.809 608 HB3 PHE 82 1HB PHE 82 -7.504 -4.150 1.174 609 HD1 PHE 82 2HD PHE 82 -10.296 -3.691 1.081 610 HD2 PHE 82 1HD PHE 82 -7.321 -1.421 3.211 611 HE1 PHE 82 2HE PHE 82 -11.771 -1.714 1.049 612 HE2 PHE 82 1HE PHE 82 -8.777 0.560 3.128 613 HZ PHE 82 HZ PHE 82 -11.007 0.431 2.059 614 H ALA 83 H ALA 83 -6.924 -6.248 4.567 615 HA ALA 83 HA ALA 83 -5.632 -8.039 2.746 616 HB1 ALA 83 1HB ALA 83 -4.468 -8.953 4.761 617 HB2 ALA 83 2HB ALA 83 -5.558 -7.980 5.826 618 HB3 ALA 83 3HB ALA 83 -4.394 -7.155 4.729 619 H LEU 84 H LEU 84 -8.307 -8.261 5.122 620 HA LEU 84 HA LEU 84 -8.345 -11.011 5.443 621 HB2 LEU 84 2HB LEU 84 -9.594 -9.422 6.865 622 HB3 LEU 84 1HB LEU 84 -10.707 -9.028 5.526 623 HG LEU 84 HG LEU 84 -10.443 -11.922 6.492 624 HD11 LEU 84 1HD1 LEU 84 -10.611 -10.586 8.583 625 HD12 LEU 84 2HD1 LEU 84 -12.109 -11.535 8.296 626 HD13 LEU 84 3HD1 LEU 84 -12.092 -9.766 7.959 627 HD21 LEU 84 3HD2 LEU 84 -12.921 -11.995 6.025 628 HD22 LEU 84 1HD2 LEU 84 -11.993 -11.539 4.560 629 HD23 LEU 84 2HD2 LEU 84 -12.872 -10.276 5.495 630 H VAL 85 H VAL 85 -9.845 -8.940 2.961 631 HA VAL 85 HA VAL 85 -11.454 -10.957 1.909 632 HB VAL 85 HB VAL 85 -11.940 -9.523 0.059 633 HG11 VAL 85 1HG1 VAL 85 -11.547 -7.754 2.572 634 HG12 VAL 85 2HG1 VAL 85 -12.779 -9.047 2.492 635 HG13 VAL 85 3HG1 VAL 85 -12.850 -7.655 1.351 636 HG21 VAL 85 3HG2 VAL 85 -9.634 -7.719 1.045 637 HG22 VAL 85 1HG2 VAL 85 -10.756 -7.353 -0.298 638 HG23 VAL 85 2HG2 VAL 85 -9.580 -8.697 -0.465 639 H THR 86 H THR 86 -8.079 -10.801 1.773 640 HA THR 86 HA THR 86 -7.443 -11.758 -0.728 641 HB THR 86 HB THR 86 -6.182 -12.598 1.935 642 HG1 THR 86 1HG THR 86 -5.975 -10.492 1.837 643 HG21 THR 86 3HG2 THR 86 -4.104 -12.922 0.512 644 HG22 THR 86 1HG2 THR 86 -5.075 -12.602 -0.971 645 HG23 THR 86 2HG2 THR 86 -5.402 -14.063 0.037 646 H ALA 87 H ALA 87 -9.158 -13.336 1.907 647 HA ALA 87 HA ALA 87 -8.922 -15.994 1.187 648 HB1 ALA 87 1HB ALA 87 -11.490 -14.548 2.134 649 HB2 ALA 87 2HB ALA 87 -10.170 -15.080 3.218 650 HB3 ALA 87 3HB ALA 87 -11.122 -16.311 2.314 651 H ALA 88 H ALA 88 -10.995 -13.438 -0.238 652 HA ALA 88 HA ALA 88 -12.525 -15.271 -1.851 653 HB1 ALA 88 1HB ALA 88 -13.498 -13.198 -2.858 654 HB2 ALA 88 2HB ALA 88 -12.320 -12.196 -1.938 655 HB3 ALA 88 3HB ALA 88 -13.584 -13.139 -1.065 656 H LEU 89 H LEU 89 -9.830 -12.924 -2.253 657 HA LEU 89 HA LEU 89 -9.672 -13.236 -5.040 658 HB2 LEU 89 2HB LEU 89 -7.539 -12.293 -3.031 659 HB3 LEU 89 1HB LEU 89 -7.270 -12.367 -4.796 660 HG LEU 89 HG LEU 89 -7.701 -10.129 -4.262 661 HD11 LEU 89 1HD1 LEU 89 -9.540 -9.542 -5.755 662 HD12 LEU 89 2HD1 LEU 89 -10.280 -11.176 -5.604 663 HD13 LEU 89 3HD1 LEU 89 -8.676 -10.975 -6.408 664 HD21 LEU 89 3HD2 LEU 89 -10.407 -10.830 -2.963 665 HD22 LEU 89 1HD2 LEU 89 -9.711 -9.193 -3.228 666 HD23 LEU 89 2HD2 LEU 89 -8.897 -10.330 -2.105 667 H ALA 90 H ALA 90 -8.149 -15.031 -2.360 668 HA ALA 90 HA ALA 90 -6.302 -16.397 -3.912 669 HB1 ALA 90 1HB ALA 90 -6.221 -18.063 -2.056 670 HB2 ALA 90 2HB ALA 90 -7.746 -17.366 -1.375 671 HB3 ALA 90 3HB ALA 90 -6.239 -16.381 -1.416 672 H THR 91 H THR 91 -9.794 -17.085 -3.401 673 HA THR 91 HA THR 91 -9.606 -19.626 -4.731 674 HB THR 91 HB THR 91 -12.267 -19.061 -4.930 675 HG1 THR 91 1HG THR 91 -11.791 -16.895 -4.051 676 HG21 THR 91 3HG2 THR 91 -11.247 -20.951 -3.701 677 HG22 THR 91 1HG2 THR 91 -12.462 -20.130 -2.659 678 HG23 THR 91 2HG2 THR 91 -10.692 -19.842 -2.402 679 H ASP 92 H ASP 92 -9.469 -16.360 -5.915 680 HA ASP 92 HA ASP 92 -11.359 -16.670 -7.955 681 HB2 ASP 92 2HB ASP 92 -10.352 -14.442 -7.018 682 HB3 ASP 92 1HB ASP 92 -9.007 -14.712 -8.176 683 H PHE 93 H PHE 93 -7.876 -17.375 -7.753 684 HA PHE 93 HA PHE 93 -7.693 -17.947 -10.541 685 HB2 PHE 93 2HB PHE 93 -5.502 -18.606 -10.289 686 HB3 PHE 93 1HB PHE 93 -5.675 -17.350 -9.033 687 HD1 PHE 93 1HD PHE 93 -5.124 -20.943 -9.718 688 HD2 PHE 93 2HD PHE 93 -5.648 -18.017 -6.621 689 HE1 PHE 93 1HE PHE 93 -4.159 -22.518 -8.069 690 HE2 PHE 93 2HE PHE 93 -4.699 -19.589 -4.977 691 HZ PHE 93 HZ PHE 93 -3.920 -21.833 -5.697 692 H VAL 94 H VAL 94 -8.514 -19.839 -7.676 693 HA VAL 94 HA VAL 94 -7.880 -22.371 -8.616 694 HB VAL 94 HB VAL 94 -10.009 -21.607 -6.546 695 HG11 VAL 94 1HG1 VAL 94 -8.378 -24.215 -6.978 696 HG12 VAL 94 2HG1 VAL 94 -10.156 -24.023 -7.195 697 HG13 VAL 94 3HG1 VAL 94 -9.433 -23.874 -5.559 698 HG21 VAL 94 3HG2 VAL 94 -8.128 -21.854 -4.886 699 HG22 VAL 94 1HG2 VAL 94 -7.772 -20.536 -6.042 700 HG23 VAL 94 2HG2 VAL 94 -6.970 -22.130 -6.236 701 H ARG 95 H ARG 95 -10.598 -20.287 -9.152 702 HA ARG 95 HA ARG 95 -12.546 -22.024 -9.974 703 HB2 ARG 95 2HB ARG 95 -12.780 -19.556 -9.545 704 HB3 ARG 95 1HB ARG 95 -11.828 -19.212 -11.022 705 HG2 ARG 95 2HG ARG 95 -14.231 -18.821 -11.331 706 HG3 ARG 95 1HG ARG 95 -13.605 -20.065 -12.454 707 HD2 ARG 95 2HD ARG 95 -14.631 -21.891 -10.935 708 HD3 ARG 95 1HD ARG 95 -15.251 -20.579 -9.865 709 HE ARG 95 HE ARG 95 -16.901 -20.102 -11.402 710 HH11 ARG 95 1HH2 ARG 95 -14.397 -22.060 -13.089 711 HH12 ARG 95 2HH2 ARG 95 -15.287 -22.283 -14.536 712 HH21 ARG 95 1HH1 ARG 95 -18.193 -20.458 -13.338 713 HH22 ARG 95 2HH1 ARG 95 -17.576 -21.405 -14.651 714 H ARG 96 H ARG 96 -9.544 -21.191 -11.649 715 HA ARG 96 HA ARG 96 -10.537 -21.960 -14.223 716 HB2 ARG 96 2HB ARG 96 -8.434 -21.512 -15.122 717 HB3 ARG 96 1HB ARG 96 -8.637 -20.313 -13.802 718 HG2 ARG 96 2HG ARG 96 -7.263 -22.090 -12.347 719 HG3 ARG 96 1HG ARG 96 -6.859 -22.794 -13.953 720 HD2 ARG 96 2HD ARG 96 -6.102 -20.339 -14.598 721 HD3 ARG 96 1HD ARG 96 -6.161 -19.994 -12.830 722 HE ARG 96 HE ARG 96 -4.509 -21.746 -12.449 723 HH11 ARG 96 1HH2 ARG 96 -4.769 -20.787 -15.974 724 HH12 ARG 96 2HH2 ARG 96 -3.761 -22.022 -16.511 725 HH21 ARG 96 1HH1 ARG 96 -2.954 -23.386 -13.262 726 HH22 ARG 96 2HH1 ARG 96 -2.639 -23.523 -14.918 727 H GLU 97 H GLU 97 -9.502 -23.757 -11.406 728 HA GLU 97 HA GLU 97 -8.424 -25.966 -12.875 729 HB2 GLU 97 2HB GLU 97 -7.714 -25.570 -10.540 730 HB3 GLU 97 1HB GLU 97 -9.377 -25.877 -9.948 731 HG2 GLU 97 2HG GLU 97 -9.250 -28.220 -10.433 732 HG3 GLU 97 1HG GLU 97 -7.959 -27.971 -11.657 733 H GLU 98 H GLU 98 -11.574 -24.843 -11.793 734 HA GLU 98 HA GLU 98 -12.981 -27.221 -12.281 735 HB2 GLU 98 2HB GLU 98 -14.007 -24.327 -12.447 736 HB3 GLU 98 1HB GLU 98 -15.003 -25.812 -12.306 737 HG2 GLU 98 2HG GLU 98 -13.878 -26.315 -10.078 738 HG3 GLU 98 1HG GLU 98 -12.978 -24.757 -10.191 739 H GLU 99 H GLU 99 -12.097 -24.423 -14.383 740 HA GLU 99 HA GLU 99 -13.619 -25.207 -16.586 741 HB2 GLU 99 2HB GLU 99 -10.960 -23.660 -16.584 742 HB3 GLU 99 1HB GLU 99 -12.123 -23.739 -17.949 743 HG2 GLU 99 2HG GLU 99 -12.790 -22.517 -15.187 744 HG3 GLU 99 1HG GLU 99 -12.213 -21.585 -16.608 745 H ARG 100 H ARG 100 -10.433 -26.257 -15.439 746 HA ARG 100 HA ARG 100 -9.552 -27.412 -17.831 747 HB2 ARG 100 2HB ARG 100 -8.171 -26.874 -15.712 748 HB3 ARG 100 1HB ARG 100 -8.810 -28.393 -15.007 749 HG2 ARG 100 2HG ARG 100 -7.746 -29.663 -16.954 750 HG3 ARG 100 1HG ARG 100 -7.199 -28.103 -17.632 751 HD2 ARG 100 2HD ARG 100 -5.319 -29.269 -16.481 752 HD3 ARG 100 1HD ARG 100 -5.720 -27.698 -15.665 753 HE ARG 100 HE ARG 100 -6.989 -30.252 -14.654 754 HH11 ARG 100 1HH2 ARG 100 -4.089 -28.092 -14.193 755 HH12 ARG 100 2HH2 ARG 100 -4.027 -28.365 -12.544 756 HH21 ARG 100 1HH1 ARG 100 -6.998 -30.334 -12.292 757 HH22 ARG 100 2HH1 ARG 100 -5.975 -29.336 -11.384 758 H ARG 101 H ARG 101 -11.565 -28.658 -15.161 759 HA ARG 101 HA ARG 101 -11.753 -31.279 -16.473 760 HB2 ARG 101 2HB ARG 101 -12.782 -30.329 -13.741 761 HB3 ARG 101 1HB ARG 101 -12.953 -31.991 -14.416 762 HG2 ARG 101 2HG ARG 101 -10.470 -32.156 -14.629 763 HG3 ARG 101 1HG ARG 101 -10.290 -30.562 -13.800 764 HD2 ARG 101 2HD ARG 101 -11.292 -31.537 -11.705 765 HD3 ARG 101 1HD ARG 101 -11.544 -33.123 -12.563 766 HE ARG 101 HE ARG 101 -8.850 -32.543 -12.979 767 HH11 ARG 101 1HH2 ARG 101 -11.013 -33.454 -10.189 768 HH12 ARG 101 2HH2 ARG 101 -9.779 -33.961 -9.190 769 HH21 ARG 101 1HH1 ARG 101 -7.112 -33.386 -11.544 770 HH22 ARG 101 2HH1 ARG 101 -7.476 -33.892 -9.952 771 H GLY 102 H GLY 102 -13.317 -28.284 -16.566 772 HA2 GLY 102 2HA GLY 102 -15.098 -27.662 -17.727 773 HA3 GLY 102 1HA GLY 102 -15.495 -29.392 -18.052 774 H HIS 103 H HIS 103 -15.007 -28.145 -14.815 775 HA HIS 103 HA HIS 103 -16.149 -28.557 -12.993 776 HB2 HIS 103 2HB HIS 103 -17.274 -26.366 -13.639 777 HB3 HIS 103 1HB HIS 103 -18.630 -27.338 -14.295 778 HD1 HIS 103 1HD HIS 103 -17.171 -26.043 -10.966 779 HD2 HIS 103 2HD HIS 103 -20.047 -28.923 -12.197 780 HE1 HIS 103 1HE HIS 103 -18.304 -26.862 -8.958 781 HE2 HIS 103 2HE HIS 103 -19.985 -28.596 -9.628 782 H1 SER 1 H SER 1 0.387 -16.625 -23.262 783 HA SER 1 HA SER 1 0.538 -14.821 -21.340 784 HB2 SER 1 2HB SER 1 -1.975 -13.880 -21.536 785 HB3 SER 1 1HB SER 1 -0.645 -13.036 -22.371 786 HG SER 1 1HG SER 1 -2.554 -14.829 -23.522 787 H ALA 2 H ALA 2 -2.171 -15.380 -20.252 788 HA ALA 2 HA ALA 2 -2.716 -18.079 -20.958 789 HB1 ALA 2 1HB ALA 2 -2.663 -18.938 -18.601 790 HB2 ALA 2 2HB ALA 2 -1.967 -17.373 -18.033 791 HB3 ALA 2 3HB ALA 2 -1.011 -18.454 -19.109 792 H ASP 3 H ASP 3 -4.641 -18.640 -19.493 793 HA ASP 3 HA ASP 3 -6.815 -17.147 -19.889 794 HB2 ASP 3 2HB ASP 3 -7.704 -18.508 -17.732 795 HB3 ASP 3 1HB ASP 3 -7.264 -19.344 -19.244 796 H HIS 4 H HIS 4 -5.337 -17.445 -16.689 797 HA HIS 4 HA HIS 4 -6.677 -15.361 -15.496 798 HB2 HIS 4 2HB HIS 4 -4.800 -15.314 -13.752 799 HB3 HIS 4 1HB HIS 4 -5.582 -16.885 -14.055 800 HD1 HIS 4 1HD HIS 4 -2.076 -15.183 -14.838 801 HD2 HIS 4 2HD HIS 4 -4.016 -18.968 -14.876 802 HE1 HIS 4 1HE HIS 4 -0.365 -16.840 -14.949 803 HE2 HIS 4 2HE HIS 4 -1.452 -19.121 -15.036 804 H GLU 5 H GLU 5 -3.797 -15.082 -17.545 805 HA GLU 5 HA GLU 5 -3.026 -12.532 -16.556 806 HB2 GLU 5 2HB GLU 5 -2.430 -13.725 -19.324 807 HB3 GLU 5 1HB GLU 5 -1.524 -12.414 -18.500 808 HG2 GLU 5 2HG GLU 5 -1.682 -15.329 -17.445 809 HG3 GLU 5 1HG GLU 5 -0.369 -14.696 -18.494 810 H ARG 6 H ARG 6 -5.240 -13.726 -19.103 811 HA ARG 6 HA ARG 6 -5.420 -11.190 -20.408 812 HB2 ARG 6 2HB ARG 6 -7.256 -13.645 -20.476 813 HB3 ARG 6 1HB ARG 6 -7.577 -12.172 -21.436 814 HG2 ARG 6 2HG ARG 6 -5.027 -13.903 -21.662 815 HG3 ARG 6 1HG ARG 6 -6.467 -14.064 -22.707 816 HD2 ARG 6 2HD ARG 6 -4.611 -11.574 -22.572 817 HD3 ARG 6 1HD ARG 6 -4.711 -12.824 -23.885 818 HE ARG 6 HE ARG 6 -7.281 -11.515 -23.268 819 HH11 ARG 6 1HH2 ARG 6 -4.240 -11.175 -25.282 820 HH12 ARG 6 2HH2 ARG 6 -4.986 -10.082 -26.370 821 HH21 ARG 6 1HH1 ARG 6 -8.298 -10.232 -25.069 822 HH22 ARG 6 2HH1 ARG 6 -7.337 -9.759 -26.339 823 H GLU 7 H GLU 7 -7.209 -12.764 -17.740 824 HA GLU 7 HA GLU 7 -9.280 -10.820 -17.807 825 HB2 GLU 7 2HB GLU 7 -9.124 -13.301 -16.688 826 HB3 GLU 7 1HB GLU 7 -8.721 -12.316 -15.251 827 HG2 GLU 7 2HG GLU 7 -11.027 -12.571 -15.059 828 HG3 GLU 7 1HG GLU 7 -10.946 -10.967 -15.863 829 H ALA 8 H ALA 8 -6.148 -11.158 -16.114 830 HA ALA 8 HA ALA 8 -6.377 -8.918 -14.439 831 HB1 ALA 8 1HB ALA 8 -4.569 -10.624 -14.127 832 HB2 ALA 8 2HB ALA 8 -3.859 -8.985 -14.368 833 HB3 ALA 8 3HB ALA 8 -3.858 -10.170 -15.719 834 H GLN 9 H GLN 9 -4.989 -9.285 -17.754 835 HA GLN 9 HA GLN 9 -4.175 -6.620 -17.954 836 HB2 GLN 9 2HB GLN 9 -3.413 -8.590 -19.404 837 HB3 GLN 9 1HB GLN 9 -4.947 -8.419 -20.329 838 HG2 GLN 9 2HG GLN 9 -4.264 -6.049 -20.947 839 HG3 GLN 9 1HG GLN 9 -2.742 -6.252 -20.008 840 HE21 GLN 9 1HE2 GLN 9 -1.533 -8.528 -20.709 841 HE22 GLN 9 2HE2 GLN 9 -1.410 -8.739 -22.413 842 H LYS 10 H LYS 10 -7.287 -8.200 -18.688 843 HA LYS 10 HA LYS 10 -8.508 -6.066 -20.029 844 HB2 LYS 10 2HB LYS 10 -9.479 -8.431 -19.850 845 HB3 LYS 10 1HB LYS 10 -9.802 -8.119 -18.118 846 HG2 LYS 10 2HG LYS 10 -11.267 -6.097 -18.909 847 HG3 LYS 10 1HG LYS 10 -11.105 -6.771 -20.561 848 HD2 LYS 10 2HD LYS 10 -12.197 -8.889 -19.766 849 HD3 LYS 10 1HD LYS 10 -12.245 -8.245 -18.087 850 HE2 LYS 10 2HE LYS 10 -13.723 -6.328 -18.864 851 HE3 LYS 10 1HE LYS 10 -13.669 -6.998 -20.535 852 HZ1 LYS 10 3HZ LYS 10 -15.212 -7.905 -18.212 853 HZ2 LYS 10 1HZ LYS 10 -14.581 -9.120 -19.210 854 HZ3 LYS 10 2HZ LYS 10 -15.556 -7.836 -19.856 855 H ALA 11 H ALA 11 -8.165 -6.871 -16.559 856 HA ALA 11 HA ALA 11 -9.952 -4.971 -15.592 857 HB1 ALA 11 1HB ALA 11 -9.059 -6.897 -14.226 858 HB2 ALA 11 2HB ALA 11 -8.887 -5.316 -13.383 859 HB3 ALA 11 3HB ALA 11 -7.456 -6.080 -14.166 860 H GLU 12 H GLU 12 -6.458 -4.695 -16.435 861 HA GLU 12 HA GLU 12 -6.129 -2.164 -15.268 862 HB2 GLU 12 2HB GLU 12 -4.618 -3.244 -17.722 863 HB3 GLU 12 1HB GLU 12 -4.245 -1.749 -16.801 864 HG2 GLU 12 2HG GLU 12 -3.985 -3.314 -14.701 865 HG3 GLU 12 1HG GLU 12 -3.897 -4.664 -15.891 866 H GLU 13 H GLU 13 -7.575 -3.103 -18.378 867 HA GLU 13 HA GLU 13 -7.445 -0.498 -19.527 868 HB2 GLU 13 2HB GLU 13 -7.650 -2.505 -20.954 869 HB3 GLU 13 1HB GLU 13 -9.201 -2.926 -20.160 870 HG2 GLU 13 2HG GLU 13 -9.685 -2.070 -22.344 871 HG3 GLU 13 1HG GLU 13 -10.260 -0.857 -21.151 872 H GLU 14 H GLU 14 -9.697 -2.222 -17.410 873 HA GLU 14 HA GLU 14 -11.871 -0.443 -17.649 874 HB2 GLU 14 2HB GLU 14 -11.882 -2.813 -16.598 875 HB3 GLU 14 1HB GLU 14 -11.062 -2.096 -15.182 876 HG2 GLU 14 2HG GLU 14 -13.300 -2.196 -14.502 877 HG3 GLU 14 1HG GLU 14 -13.117 -0.480 -14.990 878 H LEU 15 H LEU 15 -8.904 -0.478 -15.697 879 HA LEU 15 HA LEU 15 -9.656 1.538 -13.913 880 HB2 LEU 15 2HB LEU 15 -7.751 -0.068 -13.561 881 HB3 LEU 15 1HB LEU 15 -6.810 0.790 -14.817 882 HG LEU 15 HG LEU 15 -6.690 2.813 -13.435 883 HD11 LEU 15 1HD1 LEU 15 -7.643 2.818 -11.056 884 HD12 LEU 15 2HD1 LEU 15 -8.610 1.367 -11.503 885 HD13 LEU 15 3HD1 LEU 15 -8.862 2.934 -12.357 886 HD21 LEU 15 3HD2 LEU 15 -6.095 0.308 -11.720 887 HD22 LEU 15 1HD2 LEU 15 -5.375 1.940 -11.502 888 HD23 LEU 15 2HD2 LEU 15 -5.022 0.997 -12.994 889 H GLN 16 H GLN 16 -8.136 1.610 -17.129 890 HA GLN 16 HA GLN 16 -7.374 4.291 -17.217 891 HB2 GLN 16 2HB GLN 16 -8.543 2.623 -19.537 892 HB3 GLN 16 1HB GLN 16 -7.588 4.124 -19.713 893 HG2 GLN 16 2HG GLN 16 -6.512 1.475 -18.522 894 HG3 GLN 16 1HG GLN 16 -6.335 1.996 -20.227 895 HE21 GLN 16 1HE2 GLN 16 -4.750 2.044 -17.240 896 HE22 GLN 16 2HE2 GLN 16 -3.652 3.351 -17.556 897 H LYS 17 H LYS 17 -10.501 2.730 -17.722 898 HA LYS 17 HA LYS 17 -11.781 4.861 -19.021 899 HB2 LYS 17 2HB LYS 17 -12.565 2.456 -18.989 900 HB3 LYS 17 1HB LYS 17 -12.960 2.641 -17.250 901 HG2 LYS 17 2HG LYS 17 -14.724 4.347 -17.835 902 HG3 LYS 17 1HG LYS 17 -14.264 4.211 -19.565 903 HD2 LYS 17 2HD LYS 17 -16.276 2.890 -19.192 904 HD3 LYS 17 1HD LYS 17 -14.897 1.792 -19.554 905 HE2 LYS 17 2HE LYS 17 -14.670 1.354 -17.025 906 HE3 LYS 17 1HE LYS 17 -16.166 2.333 -16.769 907 HZ1 LYS 17 3HZ LYS 17 -15.969 -0.059 -18.531 908 HZ2 LYS 17 1HZ LYS 17 -17.410 0.704 -18.032 909 HZ3 LYS 17 2HZ LYS 17 -16.385 -0.133 -16.910 910 H VAL 18 H VAL 18 -11.542 3.931 -15.539 911 HA VAL 18 HA VAL 18 -13.285 6.086 -14.818 912 HB VAL 18 HB VAL 18 -12.818 5.521 -12.482 913 HG11 VAL 18 1HG1 VAL 18 -14.058 3.356 -12.604 914 HG12 VAL 18 2HG1 VAL 18 -13.611 3.160 -14.336 915 HG13 VAL 18 3HG1 VAL 18 -14.696 4.512 -13.831 916 HG21 VAL 18 3HG2 VAL 18 -11.142 3.201 -13.670 917 HG22 VAL 18 1HG2 VAL 18 -11.525 3.477 -11.938 918 HG23 VAL 18 2HG2 VAL 18 -10.451 4.626 -12.806 919 H LEU 19 H LEU 19 -9.824 5.801 -15.398 920 HA LEU 19 HA LEU 19 -8.989 8.036 -13.912 921 HB2 LEU 19 2HB LEU 19 -7.994 7.226 -16.731 922 HB3 LEU 19 1HB LEU 19 -7.206 8.418 -15.655 923 HG LEU 19 HG LEU 19 -7.462 5.415 -15.100 924 HD11 LEU 19 1HD1 LEU 19 -5.912 5.964 -16.997 925 HD12 LEU 19 2HD1 LEU 19 -5.028 5.340 -15.555 926 HD13 LEU 19 3HD1 LEU 19 -5.020 7.105 -15.925 927 HD21 LEU 19 3HD2 LEU 19 -7.399 6.655 -12.959 928 HD22 LEU 19 1HD2 LEU 19 -6.006 7.637 -13.543 929 HD23 LEU 19 2HD2 LEU 19 -5.808 5.874 -13.261 930 H GLU 20 H GLU 20 -10.257 7.759 -17.307 931 HA GLU 20 HA GLU 20 -9.978 10.517 -17.789 932 HB2 GLU 20 2HB GLU 20 -11.906 8.592 -19.205 933 HB3 GLU 20 1HB GLU 20 -11.518 10.273 -19.695 934 HG2 GLU 20 2HG GLU 20 -8.955 9.062 -19.482 935 HG3 GLU 20 1HG GLU 20 -9.984 7.751 -20.153 936 H GLU 21 H GLU 21 -12.726 8.572 -16.578 937 HA GLU 21 HA GLU 21 -14.607 10.661 -16.433 938 HB2 GLU 21 2HB GLU 21 -14.200 8.085 -14.818 939 HB3 GLU 21 1HB GLU 21 -15.584 9.154 -14.490 940 HG2 GLU 21 2HG GLU 21 -15.093 8.073 -17.334 941 HG3 GLU 21 1HG GLU 21 -15.883 7.058 -16.081 942 H ALA 22 H ALA 22 -12.109 9.511 -14.115 943 HA ALA 22 HA ALA 22 -12.885 10.974 -11.908 944 HB1 ALA 22 1HB ALA 22 -11.138 9.169 -11.764 945 HB2 ALA 22 2HB ALA 22 -10.511 10.721 -11.104 946 HB3 ALA 22 3HB ALA 22 -10.018 10.180 -12.741 947 H SER 23 H SER 23 -10.688 11.735 -14.556 948 HA SER 23 HA SER 23 -9.714 14.157 -13.715 949 HB2 SER 23 2HB SER 23 -10.426 13.423 -16.634 950 HB3 SER 23 1HB SER 23 -9.143 14.560 -16.076 951 HG SER 23 1HG SER 23 -9.272 11.709 -15.814 952 H LYS 24 H LYS 24 -12.855 13.444 -15.238 953 HA LYS 24 HA LYS 24 -13.369 16.218 -15.780 954 HB2 LYS 24 2HB LYS 24 -14.356 14.589 -17.288 955 HB3 LYS 24 1HB LYS 24 -15.181 13.758 -15.930 956 HG2 LYS 24 2HG LYS 24 -16.709 15.132 -17.347 957 HG3 LYS 24 1HG LYS 24 -16.736 15.595 -15.617 958 HD2 LYS 24 2HD LYS 24 -15.390 17.610 -16.062 959 HD3 LYS 24 1HD LYS 24 -15.195 17.147 -17.793 960 HE2 LYS 24 2HE LYS 24 -17.589 17.492 -18.234 961 HE3 LYS 24 1HE LYS 24 -17.953 17.606 -16.468 962 HZ1 LYS 24 3HZ LYS 24 -17.926 19.753 -17.616 963 HZ2 LYS 24 1HZ LYS 24 -16.258 19.602 -17.914 964 HZ3 LYS 24 2HZ LYS 24 -16.841 19.663 -16.321 965 H LYS 25 H LYS 25 -14.616 13.812 -13.364 966 HA LYS 25 HA LYS 25 -16.275 15.760 -12.112 967 HB2 LYS 25 2HB LYS 25 -15.306 12.976 -11.429 968 HB3 LYS 25 1HB LYS 25 -15.983 13.967 -10.097 969 HG2 LYS 25 2HG LYS 25 -18.101 14.083 -10.928 970 HG3 LYS 25 1HG LYS 25 -17.608 13.976 -12.643 971 HD2 LYS 25 2HD LYS 25 -17.612 11.551 -10.723 972 HD3 LYS 25 1HD LYS 25 -18.984 12.079 -11.753 973 HE2 LYS 25 2HE LYS 25 -17.132 12.020 -13.727 974 HE3 LYS 25 1HE LYS 25 -16.308 10.853 -12.630 975 HZ1 LYS 25 3HZ LYS 25 -17.792 9.902 -14.330 976 HZ2 LYS 25 1HZ LYS 25 -19.133 10.607 -13.610 977 HZ3 LYS 25 2HZ LYS 25 -18.287 9.427 -12.762 978 H ALA 26 H ALA 26 -12.849 14.918 -11.769 979 HA ALA 26 HA ALA 26 -12.327 16.224 -9.401 980 HB1 ALA 26 1HB ALA 26 -10.662 14.789 -10.644 981 HB2 ALA 26 2HB ALA 26 -9.987 16.379 -10.173 982 HB3 ALA 26 3HB ALA 26 -10.496 16.087 -11.880 983 H VAL 27 H VAL 27 -12.536 17.621 -12.759 984 HA VAL 27 HA VAL 27 -11.617 20.150 -11.754 985 HB VAL 27 HB VAL 27 -10.920 19.461 -13.926 986 HG11 VAL 27 1HG1 VAL 27 -12.569 19.445 -15.859 987 HG12 VAL 27 2HG1 VAL 27 -13.919 19.444 -14.666 988 HG13 VAL 27 3HG1 VAL 27 -12.734 18.079 -14.719 989 HG21 VAL 27 3HG2 VAL 27 -11.156 21.908 -13.427 990 HG22 VAL 27 1HG2 VAL 27 -12.798 21.900 -14.157 991 HG23 VAL 27 2HG2 VAL 27 -11.366 21.524 -15.172 992 H GLU 28 H GLU 28 -14.681 18.551 -11.776 993 HA GLU 28 HA GLU 28 -16.143 21.089 -11.682 994 HB2 GLU 28 2HB GLU 28 -17.193 18.290 -11.035 995 HB3 GLU 28 1HB GLU 28 -18.163 19.774 -11.333 996 HG2 GLU 28 2HG GLU 28 -16.393 18.318 -13.409 997 HG3 GLU 28 1HG GLU 28 -18.171 18.125 -13.238 998 H ALA 29 H ALA 29 -14.913 18.461 -9.603 999 HA ALA 29 HA ALA 29 -16.003 19.506 -7.169 1000 HB1 ALA 29 1HB ALA 29 -14.635 17.594 -6.189 1001 HB2 ALA 29 2HB ALA 29 -13.942 17.298 -7.812 1002 HB3 ALA 29 3HB ALA 29 -15.701 17.033 -7.523 1003 H GLU 30 H GLU 30 -14.906 21.673 -7.825 1004 HA GLU 30 HA GLU 30 -12.778 22.216 -6.128 1005 HB2 GLU 30 2HB GLU 30 -11.053 23.020 -7.846 1006 HB3 GLU 30 1HB GLU 30 -11.118 21.272 -7.519 1007 HG2 GLU 30 2HG GLU 30 -11.095 20.917 -9.676 1008 HG3 GLU 30 1HG GLU 30 -12.804 21.429 -9.726 1009 H ARG 31 H ARG 31 -14.577 22.829 -8.989 1010 HA ARG 31 HA ARG 31 -14.119 25.259 -9.733 1011 HB2 ARG 31 2HB ARG 31 -15.845 23.237 -10.417 1012 HB3 ARG 31 1HB ARG 31 -17.054 24.384 -9.803 1013 HG2 ARG 31 2HG ARG 31 -16.936 24.888 -12.117 1014 HG3 ARG 31 1HG ARG 31 -15.772 26.083 -11.434 1015 HD2 ARG 31 2HD ARG 31 -14.018 24.036 -11.807 1016 HD3 ARG 31 1HD ARG 31 -15.247 23.446 -12.970 1017 HE ARG 31 HE ARG 31 -15.109 25.623 -14.147 1018 HH11 ARG 31 1HH2 ARG 31 -12.268 24.653 -11.963 1019 HH12 ARG 31 2HH2 ARG 31 -11.171 25.495 -12.913 1020 HH21 ARG 31 1HH1 ARG 31 -13.523 27.093 -15.110 1021 HH22 ARG 31 2HH1 ARG 31 -11.835 26.908 -14.708 1022 H GLY 32 H GLY 32 -14.424 25.568 -6.823 1023 HA2 GLY 32 2HA GLY 32 -15.033 27.973 -6.277 1024 HA3 GLY 32 1HA GLY 32 -16.724 27.368 -6.513 1025 H ALA 33 H ALA 33 -13.919 25.525 -5.082 1026 HA ALA 33 HA ALA 33 -15.639 25.208 -2.727 1027 HB1 ALA 33 1HB ALA 33 -13.405 23.564 -3.941 1028 HB2 ALA 33 2HB ALA 33 -15.127 23.090 -3.793 1029 HB3 ALA 33 3HB ALA 33 -14.088 23.195 -2.320 1030 HA PRO 34 HA PRO 34 -12.544 27.516 -0.603 1031 HB2 PRO 34 2HB PRO 34 -12.910 26.788 2.046 1032 HB3 PRO 34 1HB PRO 34 -14.138 27.705 1.090 1033 HG2 PRO 34 2HG PRO 34 -14.051 24.687 1.631 1034 HG3 PRO 34 1HG PRO 34 -15.467 25.810 1.796 1035 HD2 PRO 34 2HD PRO 34 -15.026 24.240 -0.465 1036 HD3 PRO 34 1HD PRO 34 -15.763 25.906 -0.581 1037 H GLY 35 H GLY 35 -10.326 27.200 -0.848 1038 HA2 GLY 35 2HA GLY 35 -8.300 26.503 -0.176 1039 HA3 GLY 35 1HA GLY 35 -9.054 25.252 0.885 1040 H ALA 36 H ALA 36 -9.882 25.763 -2.520 1041 HA ALA 36 HA ALA 36 -9.495 23.054 -3.146 1042 HB1 ALA 36 1HB ALA 36 -9.878 25.484 -5.026 1043 HB2 ALA 36 2HB ALA 36 -11.199 24.466 -4.330 1044 HB3 ALA 36 3HB ALA 36 -10.042 23.746 -5.485 1045 H ALA 37 H ALA 37 -7.820 22.070 -4.216 1046 HA ALA 37 HA ALA 37 -5.346 23.628 -4.511 1047 HB1 ALA 37 1HB ALA 37 -5.230 21.553 -3.110 1048 HB2 ALA 37 2HB ALA 37 -4.213 21.394 -4.582 1049 HB3 ALA 37 3HB ALA 37 -5.824 20.576 -4.497 1050 H LEU 38 H LEU 38 -7.711 21.663 -6.366 1051 HA LEU 38 HA LEU 38 -6.038 21.823 -8.771 1052 HB2 LEU 38 2HB LEU 38 -7.080 19.563 -8.231 1053 HB3 LEU 38 1HB LEU 38 -8.688 20.352 -8.213 1054 HG LEU 38 HG LEU 38 -8.492 20.894 -10.626 1055 HD11 LEU 38 1HD1 LEU 38 -6.023 21.049 -10.949 1056 HD12 LEU 38 2HD1 LEU 38 -6.714 19.794 -12.036 1057 HD13 LEU 38 3HD1 LEU 38 -5.834 19.301 -10.544 1058 HD21 LEU 38 3HD2 LEU 38 -8.842 18.607 -11.468 1059 HD22 LEU 38 1HD2 LEU 38 -9.571 18.804 -9.838 1060 HD23 LEU 38 2HD2 LEU 38 -8.019 17.907 -10.019 1061 H ILE 39 H ILE 39 -6.877 23.171 -10.533 1062 HA ILE 39 HA ILE 39 -9.352 24.577 -10.141 1063 HB ILE 39 HB ILE 39 -8.191 26.858 -10.349 1064 HG12 ILE 39 2HG1 ILE 39 -5.769 25.248 -9.315 1065 HG13 ILE 39 1HG1 ILE 39 -5.904 25.932 -10.967 1066 HG21 ILE 39 1HG2 ILE 39 -9.305 25.977 -8.249 1067 HG22 ILE 39 2HG2 ILE 39 -8.015 27.207 -7.967 1068 HG23 ILE 39 3HG2 ILE 39 -7.686 25.469 -7.659 1069 HD11 ILE 39 3HD ILE 39 -5.801 27.569 -8.344 1070 HD12 ILE 39 1HD ILE 39 -4.503 27.413 -9.581 1071 HD13 ILE 39 2HD ILE 39 -6.034 28.257 -9.998 1072 H SER 40 H SER 40 -8.659 22.856 -12.310 1073 HA SER 40 HA SER 40 -7.583 24.723 -14.376 1074 HB2 SER 40 2HB SER 40 -6.182 22.107 -13.666 1075 HB3 SER 40 1HB SER 40 -5.771 23.191 -15.065 1076 HG SER 40 1HG SER 40 -4.493 23.405 -13.167 1077 H TYR 41 H TYR 41 -7.090 21.574 -15.336 1078 HA TYR 41 HA TYR 41 -9.294 20.441 -16.141 1079 HB2 TYR 41 2HB TYR 41 -9.062 22.866 -17.831 1080 HB3 TYR 41 1HB TYR 41 -8.811 21.402 -18.832 1081 HD1 TYR 41 2HD TYR 41 -10.511 19.444 -18.544 1082 HD2 TYR 41 1HD TYR 41 -11.291 23.522 -17.443 1083 HE1 TYR 41 2HE TYR 41 -12.926 19.053 -18.830 1084 HE2 TYR 41 1HE TYR 41 -13.705 23.142 -17.703 1085 HH TYR 41 HH TYR 41 -15.344 21.651 -18.151 1086 HA PRO 42 HA PRO 42 -5.864 18.792 -18.768 1087 HB2 PRO 42 2HB PRO 42 -3.383 20.074 -19.194 1088 HB3 PRO 42 1HB PRO 42 -4.834 20.348 -20.232 1089 HG2 PRO 42 2HG PRO 42 -3.907 22.032 -17.833 1090 HG3 PRO 42 1HG PRO 42 -4.356 22.608 -19.494 1091 HD2 PRO 42 2HD PRO 42 -6.192 22.683 -17.456 1092 HD3 PRO 42 1HD PRO 42 -6.698 22.133 -19.116 1093 H ASP 43 H ASP 43 -4.829 20.582 -15.921 1094 HA ASP 43 HA ASP 43 -2.823 18.858 -15.040 1095 HB2 ASP 43 2HB ASP 43 -4.820 20.399 -13.244 1096 HB3 ASP 43 1HB ASP 43 -3.234 19.738 -12.743 1097 H ALA 44 H ALA 44 -6.325 18.549 -15.151 1098 HA ALA 44 HA ALA 44 -6.677 17.194 -12.710 1099 HB1 ALA 44 1HB ALA 44 -8.531 17.195 -15.176 1100 HB2 ALA 44 2HB ALA 44 -8.565 18.415 -13.850 1101 HB3 ALA 44 3HB ALA 44 -8.970 16.702 -13.501 1102 H ILE 45 H ILE 45 -6.065 16.127 -16.057 1103 HA ILE 45 HA ILE 45 -6.589 13.405 -15.427 1104 HB ILE 45 HB ILE 45 -7.041 14.051 -17.618 1105 HG12 ILE 45 2HG1 ILE 45 -4.466 12.369 -17.750 1106 HG13 ILE 45 1HG1 ILE 45 -6.085 11.769 -17.258 1107 HG21 ILE 45 1HG2 ILE 45 -5.282 14.969 -19.188 1108 HG22 ILE 45 2HG2 ILE 45 -4.152 15.126 -17.800 1109 HG23 ILE 45 3HG2 ILE 45 -5.683 16.070 -17.845 1110 HD11 ILE 45 3HD ILE 45 -5.364 12.939 -20.032 1111 HD12 ILE 45 1HD ILE 45 -5.696 11.218 -19.629 1112 HD13 ILE 45 2HD ILE 45 -7.016 12.433 -19.515 1113 H TRP 46 H TRP 46 -3.758 15.472 -15.070 1114 HA TRP 46 HA TRP 46 -1.922 13.272 -14.891 1115 HB2 TRP 46 2HB TRP 46 -1.784 16.244 -14.424 1116 HB3 TRP 46 1HB TRP 46 -0.748 15.285 -13.343 1117 HD1 TRP 46 HD TRP 46 1.578 15.840 -14.171 1118 HE1 TRP 46 1HE TRP 46 2.834 15.795 -16.434 1119 HE3 TRP 46 3HE TRP 46 -2.259 14.336 -17.200 1120 HZ2 TRP 46 2HZ TRP 46 2.305 15.024 -19.109 1121 HZ3 TRP 46 3HZ TRP 46 -1.829 13.958 -19.589 1122 HH2 TRP 46 HH TRP 46 0.430 14.299 -20.537 1123 H TRP 47 H TRP 47 -3.867 15.198 -12.592 1124 HA TRP 47 HA TRP 47 -3.007 13.982 -10.228 1125 HB2 TRP 47 2HB TRP 47 -4.393 16.028 -10.179 1126 HB3 TRP 47 1HB TRP 47 -5.736 15.186 -11.020 1127 HD1 TRP 47 HD TRP 47 -3.873 14.828 -7.546 1128 HE1 TRP 47 1HE TRP 47 -5.422 13.703 -5.981 1129 HE3 TRP 47 3HE TRP 47 -7.773 14.043 -10.732 1130 HZ2 TRP 47 2HZ TRP 47 -8.199 12.867 -5.891 1131 HZ3 TRP 47 3HZ TRP 47 -9.785 12.893 -9.883 1132 HH2 TRP 47 HH TRP 47 -10.008 12.323 -7.490 1133 H SER 48 H SER 48 -5.777 13.120 -12.430 1134 HA SER 48 HA SER 48 -6.760 11.075 -10.955 1135 HB2 SER 48 2HB SER 48 -6.544 11.186 -14.031 1136 HB3 SER 48 1HB SER 48 -7.728 10.194 -13.092 1137 HG SER 48 1HG SER 48 -8.247 12.435 -13.955 1138 H VAL 49 H VAL 49 -3.957 10.967 -13.159 1139 HA VAL 49 HA VAL 49 -3.813 8.161 -13.338 1140 HB VAL 49 HB VAL 49 -1.767 10.371 -13.781 1141 HG11 VAL 49 1HG1 VAL 49 -0.506 8.344 -13.190 1142 HG12 VAL 49 2HG1 VAL 49 -0.384 8.603 -14.955 1143 HG13 VAL 49 3HG1 VAL 49 -1.497 7.325 -14.290 1144 HG21 VAL 49 3HG2 VAL 49 -3.292 8.503 -15.742 1145 HG22 VAL 49 1HG2 VAL 49 -2.248 9.914 -16.175 1146 HG23 VAL 49 2HG2 VAL 49 -3.819 10.165 -15.347 1147 H GLU 50 H GLU 50 -2.029 10.502 -11.169 1148 HA GLU 50 HA GLU 50 -0.722 8.441 -9.784 1149 HB2 GLU 50 2HB GLU 50 -0.093 10.172 -8.110 1150 HB3 GLU 50 1HB GLU 50 0.232 10.714 -9.780 1151 HG2 GLU 50 2HG GLU 50 -1.789 12.155 -9.754 1152 HG3 GLU 50 1HG GLU 50 -2.234 11.568 -8.110 1153 H THR 51 H THR 51 -3.928 9.728 -9.524 1154 HA THR 51 HA THR 51 -4.317 9.130 -6.770 1155 HB THR 51 HB THR 51 -6.374 9.531 -9.008 1156 HG1 THR 51 1HG THR 51 -5.020 11.331 -8.591 1157 HG21 THR 51 3HG2 THR 51 -7.933 10.114 -7.105 1158 HG22 THR 51 1HG2 THR 51 -6.669 9.621 -5.917 1159 HG23 THR 51 2HG2 THR 51 -7.423 8.396 -7.006 1160 H ALA 52 H ALA 52 -4.825 7.336 -9.828 1161 HA ALA 52 HA ALA 52 -6.467 5.344 -8.651 1162 HB1 ALA 52 1HB ALA 52 -5.898 3.993 -10.724 1163 HB2 ALA 52 2HB ALA 52 -4.696 5.266 -11.170 1164 HB3 ALA 52 3HB ALA 52 -6.458 5.663 -11.094 1165 H THR 53 H THR 53 -2.905 5.785 -8.793 1166 HA THR 53 HA THR 53 -2.451 3.070 -8.043 1167 HB THR 53 HB THR 53 -0.018 4.151 -7.959 1168 HG1 THR 53 1HG THR 53 -0.071 5.885 -9.608 1169 HG21 THR 53 3HG2 THR 53 -1.727 3.762 -10.520 1170 HG22 THR 53 1HG2 THR 53 -0.901 2.451 -9.588 1171 HG23 THR 53 2HG2 THR 53 0.073 3.714 -10.428 1172 H THR 54 H THR 54 -3.663 5.671 -6.386 1173 HA THR 54 HA THR 54 -4.049 6.063 -4.322 1174 HB THR 54 HB THR 54 -4.161 4.320 -2.666 1175 HG1 THR 54 1HG THR 54 -2.365 3.058 -4.421 1176 HG21 THR 54 3HG2 THR 54 -4.843 3.140 -5.457 1177 HG22 THR 54 1HG2 THR 54 -5.763 4.470 -4.688 1178 HG23 THR 54 2HG2 THR 54 -5.682 2.858 -3.891 1179 H VAL 55 H VAL 55 -1.253 6.476 -5.455 1180 HA VAL 55 HA VAL 55 0.463 6.229 -3.195 1181 HB VAL 55 HB VAL 55 0.899 7.910 -5.738 1182 HG11 VAL 55 1HG1 VAL 55 2.806 6.765 -3.574 1183 HG12 VAL 55 2HG1 VAL 55 2.437 8.498 -3.847 1184 HG13 VAL 55 3HG1 VAL 55 3.332 7.569 -5.104 1185 HG21 VAL 55 3HG2 VAL 55 2.186 5.833 -6.490 1186 HG22 VAL 55 1HG2 VAL 55 0.411 5.623 -6.420 1187 HG23 VAL 55 2HG2 VAL 55 1.443 4.930 -5.116 1188 H GLY 56 H GLY 56 -0.976 8.983 -5.018 1189 HA2 GLY 56 2HA GLY 56 -1.674 10.932 -4.323 1190 HA3 GLY 56 1HA GLY 56 -1.999 10.147 -2.724 1191 H TYR 57 H TYR 57 0.821 11.199 -4.644 1192 HA TYR 57 HA TYR 57 2.540 11.327 -2.547 1193 HB2 TYR 57 2HB TYR 57 3.023 11.391 -5.133 1194 HB3 TYR 57 1HB TYR 57 2.821 13.175 -5.027 1195 HD1 TYR 57 2HD TYR 57 4.319 14.357 -3.157 1196 HD2 TYR 57 1HD TYR 57 5.145 10.445 -4.763 1197 HE1 TYR 57 2HE TYR 57 6.520 14.395 -2.121 1198 HE2 TYR 57 1HE TYR 57 7.417 10.546 -3.814 1199 HH TYR 57 HH TYR 57 8.686 11.541 -2.125 1200 H GLY 58 H GLY 58 0.428 13.906 -3.790 1201 HA2 GLY 58 2HA GLY 58 -0.230 15.265 -1.769 1202 HA3 GLY 58 1HA GLY 58 1.502 15.726 -1.709 1203 H ASP 59 H ASP 59 0.430 15.283 -4.990 1204 HA ASP 59 HA ASP 59 1.118 17.988 -5.248 1205 HB2 ASP 59 2HB ASP 59 1.773 16.253 -6.942 1206 HB3 ASP 59 1HB ASP 59 0.072 16.257 -7.528 1207 H ARG 60 H ARG 60 -2.093 16.278 -5.916 1208 HA ARG 60 HA ARG 60 -3.343 18.825 -5.256 1209 HB2 ARG 60 2HB ARG 60 -4.206 17.073 -7.648 1210 HB3 ARG 60 1HB ARG 60 -5.115 18.481 -7.021 1211 HG2 ARG 60 2HG ARG 60 -2.304 18.544 -8.290 1212 HG3 ARG 60 1HG ARG 60 -3.840 18.899 -9.145 1213 HD2 ARG 60 2HD ARG 60 -4.283 20.850 -7.689 1214 HD3 ARG 60 1HD ARG 60 -2.793 20.557 -6.719 1215 HE ARG 60 HE ARG 60 -3.048 21.659 -9.451 1216 HH11 ARG 60 1HH2 ARG 60 -0.822 20.311 -6.947 1217 HH12 ARG 60 2HH2 ARG 60 0.537 20.299 -7.869 1218 HH21 ARG 60 1HH1 ARG 60 -1.008 21.944 -10.725 1219 HH22 ARG 60 2HH1 ARG 60 0.502 21.576 -9.997 1220 H TYR 61 H TYR 61 -5.632 18.323 -4.346 1221 HA TYR 61 HA TYR 61 -6.200 15.584 -4.015 1222 HB2 TYR 61 2HB TYR 61 -4.417 16.023 -2.187 1223 HB3 TYR 61 1HB TYR 61 -5.446 17.367 -1.571 1224 HD1 TYR 61 2HD TYR 61 -6.441 13.872 -2.723 1225 HD2 TYR 61 1HD TYR 61 -5.921 16.569 0.595 1226 HE1 TYR 61 2HE TYR 61 -7.423 12.212 -1.218 1227 HE2 TYR 61 1HE TYR 61 -6.828 14.844 2.118 1228 HH TYR 61 HH TYR 61 -7.722 12.737 2.310 1229 HA PRO 62 HA PRO 62 -9.678 18.397 -3.746 1230 HB2 PRO 62 2HB PRO 62 -11.866 16.608 -3.513 1231 HB3 PRO 62 1HB PRO 62 -11.006 16.981 -5.047 1232 HG2 PRO 62 2HG PRO 62 -10.505 14.632 -3.129 1233 HG3 PRO 62 1HG PRO 62 -10.694 14.575 -4.936 1234 HD2 PRO 62 2HD PRO 62 -8.210 14.604 -3.744 1235 HD3 PRO 62 1HD PRO 62 -8.503 15.559 -5.267 1236 H VAL 63 H VAL 63 -11.310 19.185 -2.245 1237 HA VAL 63 HA VAL 63 -10.861 18.215 0.513 1238 HB VAL 63 HB VAL 63 -11.434 20.380 1.413 1239 HG11 VAL 63 1HG1 VAL 63 -9.295 21.440 0.718 1240 HG12 VAL 63 2HG1 VAL 63 -9.186 20.349 -0.704 1241 HG13 VAL 63 3HG1 VAL 63 -9.084 19.667 0.962 1242 HG21 VAL 63 3HG2 VAL 63 -11.640 22.351 -0.045 1243 HG22 VAL 63 1HG2 VAL 63 -12.874 21.174 -0.629 1244 HG23 VAL 63 2HG2 VAL 63 -11.314 21.381 -1.506 1245 H THR 64 H THR 64 -13.185 19.849 1.509 1246 HA THR 64 HA THR 64 -14.711 17.554 1.833 1247 HB THR 64 HB THR 64 -16.037 19.255 3.319 1248 HG1 THR 64 1HG THR 64 -14.859 21.172 3.637 1249 HG21 THR 64 3HG2 THR 64 -14.123 19.317 4.976 1250 HG22 THR 64 1HG2 THR 64 -12.964 18.859 3.677 1251 HG23 THR 64 2HG2 THR 64 -14.249 17.714 4.190 1252 H GLU 65 H GLU 65 -15.482 20.763 0.513 1253 HA GLU 65 HA GLU 65 -18.121 20.137 -0.269 1254 HB2 GLU 65 2HB GLU 65 -17.156 22.477 0.231 1255 HB3 GLU 65 1HB GLU 65 -16.266 22.350 -1.322 1256 HG2 GLU 65 2HG GLU 65 -18.093 23.726 -1.816 1257 HG3 GLU 65 1HG GLU 65 -18.601 22.131 -2.477 1258 H GLU 66 H GLU 66 -15.045 19.403 -1.619 1259 HA GLU 66 HA GLU 66 -15.927 19.221 -4.334 1260 HB2 GLU 66 2HB GLU 66 -13.336 18.454 -2.885 1261 HB3 GLU 66 1HB GLU 66 -13.545 18.491 -4.655 1262 HG2 GLU 66 2HG GLU 66 -14.158 20.919 -4.576 1263 HG3 GLU 66 1HG GLU 66 -13.965 20.942 -2.786 1264 H GLY 67 H GLY 67 -16.042 17.370 -1.455 1265 HA2 GLY 67 2HA GLY 67 -17.108 15.438 -1.067 1266 HA3 GLY 67 1HA GLY 67 -17.238 15.138 -2.863 1267 H ARG 68 H ARG 68 -15.095 14.884 0.015 1268 HA ARG 68 HA ARG 68 -12.721 14.310 -1.183 1269 HB2 ARG 68 2HB ARG 68 -12.830 14.480 1.240 1270 HB3 ARG 68 1HB ARG 68 -13.988 13.127 1.364 1271 HG2 ARG 68 2HG ARG 68 -12.369 11.506 1.368 1272 HG3 ARG 68 1HG ARG 68 -11.385 12.293 0.102 1273 HD2 ARG 68 2HD ARG 68 -11.370 13.086 3.061 1274 HD3 ARG 68 1HD ARG 68 -10.094 12.165 2.157 1275 HE ARG 68 HE ARG 68 -10.087 14.236 0.552 1276 HH11 ARG 68 1HH2 ARG 68 -9.443 14.229 3.956 1277 HH12 ARG 68 2HH2 ARG 68 -9.691 15.890 4.219 1278 HH21 ARG 68 1HH1 ARG 68 -9.599 16.598 0.785 1279 HH22 ARG 68 2HH1 ARG 68 -9.454 17.218 2.433 1280 H LYS 69 H LYS 69 -15.591 12.322 -0.991 1281 HA LYS 69 HA LYS 69 -14.443 9.875 -1.660 1282 HB2 LYS 69 2HB LYS 69 -17.263 10.964 -1.864 1283 HB3 LYS 69 1HB LYS 69 -16.841 9.492 -2.786 1284 HG2 LYS 69 2HG LYS 69 -17.723 8.678 -0.796 1285 HG3 LYS 69 1HG LYS 69 -15.955 8.388 -0.733 1286 HD2 LYS 69 2HD LYS 69 -15.762 10.413 0.844 1287 HD3 LYS 69 1HD LYS 69 -17.563 10.541 0.771 1288 HE2 LYS 69 2HE LYS 69 -17.559 8.000 1.486 1289 HE3 LYS 69 1HE LYS 69 -15.832 8.247 1.945 1290 HZ1 LYS 69 3HZ LYS 69 -16.601 9.937 3.552 1291 HZ2 LYS 69 1HZ LYS 69 -17.402 8.431 3.733 1292 HZ3 LYS 69 2HZ LYS 69 -18.217 9.686 3.012 1293 H VAL 70 H VAL 70 -14.538 12.715 -3.701 1294 HA VAL 70 HA VAL 70 -14.577 11.297 -6.146 1295 HB VAL 70 HB VAL 70 -13.416 14.008 -5.358 1296 HG11 VAL 70 1HG1 VAL 70 -13.382 14.478 -7.844 1297 HG12 VAL 70 2HG1 VAL 70 -13.720 12.737 -8.172 1298 HG13 VAL 70 3HG1 VAL 70 -12.180 13.233 -7.377 1299 HG21 VAL 70 3HG2 VAL 70 -15.462 14.840 -6.542 1300 HG22 VAL 70 1HG2 VAL 70 -15.932 13.769 -5.189 1301 HG23 VAL 70 2HG2 VAL 70 -15.987 13.151 -6.880 1302 H ALA 71 H ALA 71 -12.047 11.894 -3.679 1303 HA ALA 71 HA ALA 71 -9.966 10.824 -5.395 1304 HB1 ALA 71 1HB ALA 71 -9.299 12.432 -3.590 1305 HB2 ALA 71 2HB ALA 71 -8.559 10.821 -3.315 1306 HB3 ALA 71 3HB ALA 71 -9.984 11.334 -2.340 1307 H GLU 72 H GLU 72 -11.648 9.828 -2.369 1308 HA GLU 72 HA GLU 72 -10.602 7.369 -2.075 1309 HB2 GLU 72 2HB GLU 72 -13.554 7.941 -1.497 1310 HB3 GLU 72 1HB GLU 72 -12.491 6.752 -0.672 1311 HG2 GLU 72 2HG GLU 72 -12.000 9.808 -0.550 1312 HG3 GLU 72 1HG GLU 72 -13.045 8.919 0.599 1313 H GLN 73 H GLN 73 -13.398 8.209 -4.184 1314 HA GLN 73 HA GLN 73 -14.049 5.461 -4.565 1315 HB2 GLN 73 2HB GLN 73 -15.655 7.410 -4.598 1316 HB3 GLN 73 1HB GLN 73 -15.028 7.841 -6.221 1317 HG2 GLN 73 2HG GLN 73 -15.888 5.670 -7.126 1318 HG3 GLN 73 1HG GLN 73 -16.286 5.109 -5.459 1319 HE21 GLN 73 1HE2 GLN 73 -17.545 6.868 -8.199 1320 HE22 GLN 73 2HE2 GLN 73 -18.973 7.470 -7.436 1321 H VAL 74 H VAL 74 -11.786 7.682 -6.119 1322 HA VAL 74 HA VAL 74 -11.602 6.043 -8.509 1323 HB VAL 74 HB VAL 74 -9.963 8.408 -7.471 1324 HG11 VAL 74 1HG1 VAL 74 -9.774 6.881 -10.168 1325 HG12 VAL 74 2HG1 VAL 74 -8.496 6.966 -8.898 1326 HG13 VAL 74 3HG1 VAL 74 -8.962 8.447 -9.792 1327 HG21 VAL 74 3HG2 VAL 74 -12.385 8.856 -8.185 1328 HG22 VAL 74 1HG2 VAL 74 -11.996 8.163 -9.799 1329 HG23 VAL 74 2HG2 VAL 74 -11.168 9.661 -9.219 1330 H MET 75 H MET 75 -9.834 6.724 -5.462 1331 HA MET 75 HA MET 75 -7.695 5.030 -5.904 1332 HB2 MET 75 2HB MET 75 -9.030 5.880 -3.264 1333 HB3 MET 75 1HB MET 75 -7.455 5.025 -3.374 1334 HG2 MET 75 2HG MET 75 -6.640 6.849 -4.924 1335 HG3 MET 75 1HG MET 75 -8.097 7.794 -4.586 1336 HE1 MET 75 3HE MET 75 -7.568 8.583 -0.665 1337 HE2 MET 75 1HE MET 75 -8.423 7.151 -1.304 1338 HE3 MET 75 2HE MET 75 -8.682 8.765 -2.052 1339 H LYS 76 H LYS 76 -10.840 4.280 -4.223 1340 HA LYS 76 HA LYS 76 -9.993 1.614 -3.844 1341 HB2 LYS 76 2HB LYS 76 -11.882 2.923 -2.546 1342 HB3 LYS 76 1HB LYS 76 -12.946 2.285 -3.844 1343 HG2 LYS 76 2HG LYS 76 -11.593 -0.018 -3.184 1344 HG3 LYS 76 1HG LYS 76 -11.412 0.824 -1.623 1345 HD2 LYS 76 2HD LYS 76 -13.861 0.878 -1.326 1346 HD3 LYS 76 1HD LYS 76 -14.103 0.475 -3.067 1347 HE2 LYS 76 2HE LYS 76 -12.975 -1.788 -2.656 1348 HE3 LYS 76 1HE LYS 76 -13.021 -1.441 -0.883 1349 HZ1 LYS 76 3HZ LYS 76 -15.415 -1.454 -0.955 1350 HZ2 LYS 76 1HZ LYS 76 -14.893 -2.790 -1.698 1351 HZ3 LYS 76 2HZ LYS 76 -15.429 -1.470 -2.664 1352 H ALA 77 H ALA 77 -11.179 3.161 -6.709 1353 HA ALA 77 HA ALA 77 -12.288 0.769 -7.879 1354 HB1 ALA 77 1HB ALA 77 -11.220 3.307 -9.271 1355 HB2 ALA 77 2HB ALA 77 -12.930 3.042 -8.775 1356 HB3 ALA 77 3HB ALA 77 -12.184 1.992 -10.038 1357 H GLY 78 H GLY 78 -9.162 2.501 -7.757 1358 HA2 GLY 78 2HA GLY 78 -7.765 0.880 -9.573 1359 HA3 GLY 78 1HA GLY 78 -7.096 1.931 -8.266 1360 H ILE 79 H ILE 79 -8.010 0.795 -6.003 1361 HA ILE 79 HA ILE 79 -6.346 -1.308 -5.505 1362 HB ILE 79 HB ILE 79 -8.957 -0.538 -4.113 1363 HG12 ILE 79 2HG1 ILE 79 -5.993 0.056 -3.459 1364 HG13 ILE 79 1HG1 ILE 79 -7.103 1.213 -4.229 1365 HG21 ILE 79 1HG2 ILE 79 -6.681 -2.395 -3.136 1366 HG22 ILE 79 2HG2 ILE 79 -8.370 -2.908 -3.485 1367 HG23 ILE 79 3HG2 ILE 79 -8.044 -1.814 -2.121 1368 HD11 ILE 79 3HD ILE 79 -7.357 0.079 -1.370 1369 HD12 ILE 79 1HD ILE 79 -6.917 1.745 -1.848 1370 HD13 ILE 79 2HD ILE 79 -8.590 1.142 -2.152 1371 H GLU 80 H GLU 80 -9.875 -1.513 -6.351 1372 HA GLU 80 HA GLU 80 -9.870 -4.327 -6.050 1373 HB2 GLU 80 2HB GLU 80 -11.853 -2.574 -7.606 1374 HB3 GLU 80 1HB GLU 80 -12.038 -4.333 -7.294 1375 HG2 GLU 80 2HG GLU 80 -11.860 -3.806 -4.775 1376 HG3 GLU 80 1HG GLU 80 -12.068 -2.071 -5.195 1377 H VAL 81 H VAL 81 -8.792 -2.302 -8.697 1378 HA VAL 81 HA VAL 81 -9.022 -4.374 -10.687 1379 HB VAL 81 HB VAL 81 -7.627 -1.658 -10.569 1380 HG11 VAL 81 1HG1 VAL 81 -7.440 -3.778 -12.805 1381 HG12 VAL 81 2HG1 VAL 81 -6.084 -3.019 -11.897 1382 HG13 VAL 81 3HG1 VAL 81 -7.063 -2.034 -13.027 1383 HG21 VAL 81 3HG2 VAL 81 -9.916 -2.807 -12.312 1384 HG22 VAL 81 1HG2 VAL 81 -9.311 -1.111 -12.324 1385 HG23 VAL 81 2HG2 VAL 81 -10.140 -1.756 -10.866 1386 H PHE 82 H PHE 82 -6.375 -2.880 -8.714 1387 HA PHE 82 HA PHE 82 -4.385 -4.592 -9.661 1388 HB2 PHE 82 2HB PHE 82 -4.514 -3.281 -6.865 1389 HB3 PHE 82 1HB PHE 82 -3.024 -3.873 -7.691 1390 HD1 PHE 82 1HD PHE 82 -3.468 -2.723 -10.508 1391 HD2 PHE 82 2HD PHE 82 -4.061 -1.049 -6.584 1392 HE1 PHE 82 1HE PHE 82 -3.144 -0.456 -11.415 1393 HE2 PHE 82 2HE PHE 82 -3.722 1.205 -7.492 1394 HZ PHE 82 HZ PHE 82 -3.279 1.524 -9.913 1395 H ALA 83 H ALA 83 -6.549 -4.835 -6.817 1396 HA ALA 83 HA ALA 83 -5.383 -7.112 -5.726 1397 HB1 ALA 83 1HB ALA 83 -8.337 -6.230 -5.580 1398 HB2 ALA 83 2HB ALA 83 -7.025 -5.693 -4.470 1399 HB3 ALA 83 3HB ALA 83 -7.530 -7.415 -4.478 1400 H LEU 84 H LEU 84 -7.678 -6.763 -8.427 1401 HA LEU 84 HA LEU 84 -8.575 -9.459 -8.391 1402 HB2 LEU 84 2HB LEU 84 -9.801 -7.551 -9.442 1403 HB3 LEU 84 1HB LEU 84 -8.564 -7.447 -10.727 1404 HG LEU 84 HG LEU 84 -9.974 -10.116 -10.253 1405 HD11 LEU 84 1HD1 LEU 84 -11.833 -8.483 -10.100 1406 HD12 LEU 84 2HD1 LEU 84 -11.939 -9.442 -11.618 1407 HD13 LEU 84 3HD1 LEU 84 -11.341 -7.738 -11.669 1408 HD21 LEU 84 3HD2 LEU 84 -9.892 -10.283 -12.750 1409 HD22 LEU 84 1HD2 LEU 84 -8.257 -9.994 -12.077 1410 HD23 LEU 84 2HD2 LEU 84 -9.154 -8.643 -12.853 1411 H VAL 85 H VAL 85 -5.759 -7.777 -9.746 1412 HA VAL 85 HA VAL 85 -4.979 -9.733 -11.589 1413 HB VAL 85 HB VAL 85 -3.236 -7.761 -10.026 1414 HG11 VAL 85 1HG1 VAL 85 -1.706 -7.949 -12.052 1415 HG12 VAL 85 2HG1 VAL 85 -2.664 -9.375 -12.602 1416 HG13 VAL 85 3HG1 VAL 85 -1.762 -9.430 -11.046 1417 HG21 VAL 85 3HG2 VAL 85 -3.502 -6.351 -12.125 1418 HG22 VAL 85 1HG2 VAL 85 -5.039 -6.577 -11.242 1419 HG23 VAL 85 2HG2 VAL 85 -4.724 -7.525 -12.738 1420 H THR 86 H THR 86 -5.051 -9.843 -8.112 1421 HA THR 86 HA THR 86 -2.968 -11.596 -7.648 1422 HB THR 86 HB THR 86 -5.603 -11.573 -6.124 1423 HG1 THR 86 1HG THR 86 -5.061 -9.570 -6.006 1424 HG21 THR 86 3HG2 THR 86 -4.062 -12.088 -4.178 1425 HG22 THR 86 1HG2 THR 86 -2.660 -12.160 -5.301 1426 HG23 THR 86 2HG2 THR 86 -3.980 -13.387 -5.418 1427 H ALA 87 H ALA 87 -6.007 -12.179 -9.308 1428 HA ALA 87 HA ALA 87 -6.137 -14.969 -8.962 1429 HB1 ALA 87 1HB ALA 87 -8.004 -13.613 -9.988 1430 HB2 ALA 87 2HB ALA 87 -7.497 -14.959 -11.066 1431 HB3 ALA 87 3HB ALA 87 -6.957 -13.268 -11.404 1432 H ALA 88 H ALA 88 -3.849 -12.966 -10.634 1433 HA ALA 88 HA ALA 88 -2.805 -15.194 -12.220 1434 HB1 ALA 88 1HB ALA 88 -2.853 -12.962 -13.383 1435 HB2 ALA 88 2HB ALA 88 -1.162 -13.501 -13.084 1436 HB3 ALA 88 3HB ALA 88 -1.896 -12.245 -12.039 1437 H LEU 89 H LEU 89 -1.921 -12.873 -9.591 1438 HA LEU 89 HA LEU 89 0.659 -13.760 -9.281 1439 HB2 LEU 89 2HB LEU 89 -1.145 -12.663 -7.048 1440 HB3 LEU 89 1HB LEU 89 0.645 -12.711 -7.017 1441 HG LEU 89 HG LEU 89 -1.006 -11.113 -9.076 1442 HD11 LEU 89 1HD1 LEU 89 0.379 -10.117 -6.507 1443 HD12 LEU 89 2HD1 LEU 89 -1.397 -10.243 -6.766 1444 HD13 LEU 89 3HD1 LEU 89 -0.430 -9.099 -7.755 1445 HD21 LEU 89 3HD2 LEU 89 1.154 -9.929 -9.520 1446 HD22 LEU 89 1HD2 LEU 89 1.285 -11.679 -9.908 1447 HD23 LEU 89 2HD2 LEU 89 2.004 -11.035 -8.382 1448 H ALA 90 H ALA 90 -2.299 -15.010 -7.710 1449 HA ALA 90 HA ALA 90 -0.818 -16.780 -6.016 1450 HB1 ALA 90 1HB ALA 90 -3.055 -17.763 -5.491 1451 HB2 ALA 90 2HB ALA 90 -3.778 -16.754 -6.810 1452 HB3 ALA 90 3HB ALA 90 -3.067 -15.967 -5.359 1453 H THR 91 H THR 91 -1.131 -16.841 -9.380 1454 HA THR 91 HA THR 91 -1.068 -19.774 -9.392 1455 HB THR 91 HB THR 91 -1.166 -19.819 -11.745 1456 HG1 THR 91 1HG THR 91 -0.948 -17.009 -11.584 1457 HG21 THR 91 3HG2 THR 91 -3.320 -17.923 -10.591 1458 HG22 THR 91 1HG2 THR 91 -3.283 -19.713 -10.420 1459 HG23 THR 91 2HG2 THR 91 -3.492 -18.964 -12.050 1460 H ASP 92 H ASP 92 1.036 -17.002 -9.169 1461 HA ASP 92 HA ASP 92 2.848 -18.040 -11.075 1462 HB2 ASP 92 2HB ASP 92 2.772 -15.559 -9.407 1463 HB3 ASP 92 1HB ASP 92 4.415 -16.170 -9.821 1464 H PHE 93 H PHE 93 2.385 -18.842 -7.758 1465 HA PHE 93 HA PHE 93 4.991 -20.177 -7.713 1466 HB2 PHE 93 2HB PHE 93 4.553 -20.870 -5.493 1467 HB3 PHE 93 1HB PHE 93 4.118 -19.141 -5.612 1468 HD1 PHE 93 2HD PHE 93 1.595 -18.517 -5.704 1469 HD2 PHE 93 1HD PHE 93 3.009 -22.482 -4.821 1470 HE1 PHE 93 2HE PHE 93 -0.614 -19.116 -4.769 1471 HE2 PHE 93 1HE PHE 93 0.791 -23.074 -3.908 1472 HZ PHE 93 HZ PHE 93 -1.022 -21.377 -3.866 1473 H VAL 94 H VAL 94 1.788 -20.823 -8.816 1474 HA VAL 94 HA VAL 94 1.738 -23.597 -8.113 1475 HB VAL 94 HB VAL 94 -0.004 -22.043 -10.075 1476 HG11 VAL 94 1HG1 VAL 94 -1.614 -23.964 -9.682 1477 HG12 VAL 94 2HG1 VAL 94 -0.348 -24.818 -8.730 1478 HG13 VAL 94 3HG1 VAL 94 -0.100 -24.513 -10.486 1479 HG21 VAL 94 3HG2 VAL 94 -0.377 -22.772 -7.077 1480 HG22 VAL 94 1HG2 VAL 94 -1.605 -21.972 -8.117 1481 HG23 VAL 94 2HG2 VAL 94 -0.088 -21.121 -7.711 1482 H ARG 95 H ARG 95 2.893 -21.554 -10.699 1483 HA ARG 95 HA ARG 95 3.420 -23.271 -12.768 1484 HB2 ARG 95 2HB ARG 95 5.298 -21.127 -11.552 1485 HB3 ARG 95 1HB ARG 95 5.482 -21.839 -13.193 1486 HG2 ARG 95 2HG ARG 95 3.368 -20.842 -13.921 1487 HG3 ARG 95 1HG ARG 95 3.115 -20.100 -12.293 1488 HD2 ARG 95 2HD ARG 95 5.199 -18.775 -12.495 1489 HD3 ARG 95 1HD ARG 95 5.635 -19.565 -14.051 1490 HE ARG 95 HE ARG 95 3.760 -17.417 -13.549 1491 HH11 ARG 95 1HH2 ARG 95 4.945 -19.873 -15.927 1492 HH12 ARG 95 2HH2 ARG 95 4.093 -19.264 -17.255 1493 HH21 ARG 95 1HH1 ARG 95 2.459 -16.605 -15.354 1494 HH22 ARG 95 2HH1 ARG 95 2.796 -17.142 -16.964 1495 H ARG 96 H ARG 96 4.930 -23.313 -9.568 1496 HA ARG 96 HA ARG 96 7.438 -24.257 -10.418 1497 HB2 ARG 96 2HB ARG 96 7.994 -24.658 -8.139 1498 HB3 ARG 96 1HB ARG 96 6.872 -23.256 -8.102 1499 HG2 ARG 96 2HG ARG 96 5.016 -25.098 -7.747 1500 HG3 ARG 96 1HG ARG 96 6.373 -26.186 -7.311 1501 HD2 ARG 96 2HD ARG 96 6.996 -24.605 -5.422 1502 HD3 ARG 96 1HD ARG 96 5.568 -23.568 -5.827 1503 HE ARG 96 HE ARG 96 5.590 -26.180 -4.447 1504 HH11 ARG 96 1HH2 ARG 96 3.504 -24.178 -6.642 1505 HH12 ARG 96 2HH2 ARG 96 2.151 -25.229 -6.416 1506 HH21 ARG 96 1HH1 ARG 96 3.486 -27.299 -3.893 1507 HH22 ARG 96 2HH1 ARG 96 2.366 -27.209 -5.190 1508 H GLU 97 H GLU 97 4.320 -25.842 -10.082 1509 HA GLU 97 HA GLU 97 5.559 -28.491 -9.911 1510 HB2 GLU 97 2HB GLU 97 2.595 -27.673 -9.887 1511 HB3 GLU 97 1HB GLU 97 3.205 -29.361 -9.784 1512 HG2 GLU 97 2HG GLU 97 4.436 -28.772 -7.648 1513 HG3 GLU 97 1HG GLU 97 3.738 -27.115 -7.743 1514 H GLU 98 H GLU 98 4.365 -30.080 -11.555 1515 HA GLU 98 HA GLU 98 4.244 -30.814 -13.548 1516 HB2 GLU 98 2HB GLU 98 3.373 -28.059 -14.511 1517 HB3 GLU 98 1HB GLU 98 3.419 -29.549 -15.509 1518 HG2 GLU 98 2HG GLU 98 1.865 -30.685 -13.856 1519 HG3 GLU 98 1HG GLU 98 1.710 -29.123 -12.968 1520 H GLU 99 H GLU 99 6.019 -27.694 -13.683 1521 HA GLU 99 HA GLU 99 7.826 -28.721 -15.619 1522 HB2 GLU 99 2HB GLU 99 8.346 -26.337 -13.767 1523 HB3 GLU 99 1HB GLU 99 9.129 -26.745 -15.331 1524 HG2 GLU 99 2HG GLU 99 6.606 -26.619 -16.276 1525 HG3 GLU 99 1HG GLU 99 6.285 -25.691 -14.765 1526 H ARG 100 H ARG 100 7.931 -28.338 -12.010 1527 HA ARG 100 HA ARG 100 10.478 -29.574 -11.866 1528 HB2 ARG 100 2HB ARG 100 9.613 -27.916 -10.222 1529 HB3 ARG 100 1HB ARG 100 8.459 -29.128 -9.593 1530 HG2 ARG 100 2HG ARG 100 11.416 -29.877 -9.709 1531 HG3 ARG 100 1HG ARG 100 10.983 -28.570 -8.581 1532 HD2 ARG 100 2HD ARG 100 9.708 -31.391 -8.549 1533 HD3 ARG 100 1HD ARG 100 11.045 -30.820 -7.459 1534 HE ARG 100 HE ARG 100 9.088 -28.876 -7.141 1535 HH11 ARG 100 1HH2 ARG 100 9.182 -32.461 -6.758 1536 HH12 ARG 100 2HH2 ARG 100 8.087 -32.514 -5.446 1537 HH21 ARG 100 1HH1 ARG 100 7.551 -28.979 -5.206 1538 HH22 ARG 100 2HH1 ARG 100 7.181 -30.474 -4.524 1539 H ARG 101 H ARG 101 7.178 -30.904 -11.875 1540 HA ARG 101 HA ARG 101 8.318 -33.555 -11.200 1541 HB2 ARG 101 2HB ARG 101 6.710 -32.890 -9.404 1542 HB3 ARG 101 1HB ARG 101 5.489 -32.482 -10.654 1543 HG2 ARG 101 2HG ARG 101 5.394 -34.898 -11.359 1544 HG3 ARG 101 1HG ARG 101 6.656 -35.303 -10.152 1545 HD2 ARG 101 2HD ARG 101 4.312 -35.900 -9.415 1546 HD3 ARG 101 1HD ARG 101 5.139 -34.763 -8.299 1547 HE ARG 101 HE ARG 101 3.052 -34.045 -10.375 1548 HH11 ARG 101 1HH2 ARG 101 4.472 -33.460 -7.071 1549 HH12 ARG 101 2HH2 ARG 101 3.538 -32.042 -6.826 1550 HH21 ARG 101 1HH1 ARG 101 1.738 -32.033 -9.881 1551 HH22 ARG 101 2HH1 ARG 101 2.085 -31.168 -8.433 1552 H GLY 102 H GLY 102 8.596 -34.450 -13.230 1553 HA2 GLY 102 2HA GLY 102 7.272 -35.678 -14.823 1554 HA3 GLY 102 1HA GLY 102 6.390 -34.132 -15.171 1555 H HIS 103 H HIS 103 8.298 -32.270 -15.081 1556 HA HIS 103 HA HIS 103 9.939 -32.985 -17.437 1557 HB2 HIS 103 2HB HIS 103 7.894 -31.413 -17.675 1558 HB3 HIS 103 1HB HIS 103 8.763 -30.267 -16.625 1559 HD1 HIS 103 1HD HIS 103 8.419 -31.319 -20.178 1560 HD2 HIS 103 2HD HIS 103 11.051 -28.988 -17.839 1561 HE1 HIS 103 1HE HIS 103 9.744 -29.887 -21.745 1562 HE2 HIS 103 2HE HIS 103 11.273 -28.432 -20.320 1563 H1 SER 1 H SER 1 17.081 -25.133 -3.906 1564 HA SER 1 HA SER 1 15.355 -26.414 -2.499 1565 HB2 SER 1 2HB SER 1 15.817 -23.428 -1.890 1566 HB3 SER 1 1HB SER 1 15.811 -24.811 -0.740 1567 HG SER 1 1HG SER 1 17.825 -25.346 -1.388 1568 H ALA 2 H ALA 2 14.701 -23.316 -4.209 1569 HA ALA 2 HA ALA 2 11.922 -23.928 -4.340 1570 HB1 ALA 2 1HB ALA 2 11.304 -21.592 -3.345 1571 HB2 ALA 2 2HB ALA 2 13.000 -21.505 -2.740 1572 HB3 ALA 2 3HB ALA 2 11.890 -22.753 -2.103 1573 H ASP 3 H ASP 3 11.138 -22.919 -6.193 1574 HA ASP 3 HA ASP 3 13.091 -21.351 -7.718 1575 HB2 ASP 3 2HB ASP 3 10.233 -22.257 -8.472 1576 HB3 ASP 3 1HB ASP 3 11.366 -21.345 -9.536 1577 H HIS 4 H HIS 4 9.732 -21.107 -6.636 1578 HA HIS 4 HA HIS 4 9.174 -18.541 -6.963 1579 HB2 HIS 4 2HB HIS 4 7.557 -18.667 -5.030 1580 HB3 HIS 4 1HB HIS 4 7.477 -20.045 -6.151 1581 HD1 HIS 4 1HD HIS 4 8.399 -19.316 -2.509 1582 HD2 HIS 4 2HD HIS 4 8.478 -22.542 -5.207 1583 HE1 HIS 4 1HE HIS 4 8.970 -21.355 -1.184 1584 HE2 HIS 4 2HE HIS 4 9.112 -23.281 -2.839 1585 H GLU 5 H GLU 5 11.282 -19.660 -4.253 1586 HA GLU 5 HA GLU 5 11.160 -17.032 -3.036 1587 HB2 GLU 5 2HB GLU 5 12.870 -19.486 -2.433 1588 HB3 GLU 5 1HB GLU 5 13.075 -17.934 -1.582 1589 HG2 GLU 5 2HG GLU 5 11.095 -18.037 -0.408 1590 HG3 GLU 5 1HG GLU 5 10.249 -19.007 -1.646 1591 H ARG 6 H ARG 6 13.256 -18.774 -5.362 1592 HA ARG 6 HA ARG 6 15.386 -16.864 -5.068 1593 HB2 ARG 6 2HB ARG 6 14.811 -18.960 -7.248 1594 HB3 ARG 6 1HB ARG 6 16.283 -17.929 -7.177 1595 HG2 ARG 6 2HG ARG 6 16.878 -18.861 -4.954 1596 HG3 ARG 6 1HG ARG 6 15.458 -19.943 -4.983 1597 HD2 ARG 6 2HD ARG 6 17.814 -19.926 -6.984 1598 HD3 ARG 6 1HD ARG 6 17.588 -21.134 -5.649 1599 HE ARG 6 HE ARG 6 15.276 -21.553 -6.917 1600 HH11 ARG 6 1HH2 ARG 6 18.662 -21.327 -8.189 1601 HH12 ARG 6 2HH2 ARG 6 18.286 -21.955 -9.732 1602 HH21 ARG 6 1HH1 ARG 6 14.838 -22.823 -9.065 1603 HH22 ARG 6 2HH1 ARG 6 16.209 -23.167 -10.008 1604 H GLU 7 H GLU 7 12.518 -17.321 -7.031 1605 HA GLU 7 HA GLU 7 12.884 -15.339 -8.957 1606 HB2 GLU 7 2HB GLU 7 11.248 -17.323 -8.816 1607 HB3 GLU 7 1HB GLU 7 10.302 -16.401 -7.613 1608 HG2 GLU 7 2HG GLU 7 9.716 -14.713 -9.371 1609 HG3 GLU 7 1HG GLU 7 10.754 -15.595 -10.558 1610 H ALA 8 H ALA 8 11.200 -15.370 -5.781 1611 HA ALA 8 HA ALA 8 10.382 -12.742 -5.739 1612 HB1 ALA 8 1HB ALA 8 10.151 -13.032 -3.252 1613 HB2 ALA 8 2HB ALA 8 11.146 -14.528 -3.340 1614 HB3 ALA 8 3HB ALA 8 9.527 -14.473 -4.131 1615 H GLN 9 H GLN 9 13.457 -14.176 -4.617 1616 HA GLN 9 HA GLN 9 14.473 -11.976 -3.306 1617 HB2 GLN 9 2HB GLN 9 15.400 -14.361 -3.346 1618 HB3 GLN 9 1HB GLN 9 16.080 -14.014 -4.971 1619 HG2 GLN 9 2HG GLN 9 17.494 -12.169 -3.936 1620 HG3 GLN 9 1HG GLN 9 16.779 -12.560 -2.324 1621 HE21 GLN 9 1HE2 GLN 9 19.350 -12.833 -2.094 1622 HE22 GLN 9 2HE2 GLN 9 19.957 -14.445 -2.341 1623 H LYS 10 H LYS 10 14.418 -12.700 -6.815 1624 HA LYS 10 HA LYS 10 16.275 -10.609 -7.452 1625 HB2 LYS 10 2HB LYS 10 14.242 -11.981 -9.312 1626 HB3 LYS 10 1HB LYS 10 15.636 -10.941 -9.795 1627 HG2 LYS 10 2HG LYS 10 17.131 -12.598 -8.505 1628 HG3 LYS 10 1HG LYS 10 15.707 -13.703 -8.475 1629 HD2 LYS 10 2HD LYS 10 15.602 -13.504 -11.043 1630 HD3 LYS 10 1HD LYS 10 17.135 -12.582 -10.965 1631 HE2 LYS 10 2HE LYS 10 16.647 -15.541 -10.226 1632 HE3 LYS 10 1HE LYS 10 17.763 -14.858 -11.478 1633 HZ1 LYS 10 3HZ LYS 10 19.086 -15.442 -9.699 1634 HZ2 LYS 10 1HZ LYS 10 18.029 -14.809 -8.521 1635 HZ3 LYS 10 2HZ LYS 10 18.919 -13.751 -9.500 1636 H ALA 11 H ALA 11 12.870 -10.712 -6.698 1637 HA ALA 11 HA ALA 11 12.065 -8.566 -8.355 1638 HB1 ALA 11 1HB ALA 11 10.030 -8.440 -6.970 1639 HB2 ALA 11 2HB ALA 11 10.813 -9.411 -5.671 1640 HB3 ALA 11 3HB ALA 11 10.426 -10.170 -7.255 1641 H GLU 12 H GLU 12 13.395 -8.836 -5.070 1642 HA GLU 12 HA GLU 12 13.153 -6.169 -4.295 1643 HB2 GLU 12 2HB GLU 12 15.430 -8.124 -3.541 1644 HB3 GLU 12 1HB GLU 12 14.835 -6.716 -2.590 1645 HG2 GLU 12 2HG GLU 12 12.612 -7.980 -2.287 1646 HG3 GLU 12 1HG GLU 12 13.349 -9.395 -3.133 1647 H GLU 13 H GLU 13 15.663 -7.915 -6.147 1648 HA GLU 13 HA GLU 13 17.563 -5.812 -6.098 1649 HB2 GLU 13 2HB GLU 13 17.301 -8.151 -8.095 1650 HB3 GLU 13 1HB GLU 13 18.748 -7.108 -7.863 1651 HG2 GLU 13 2HG GLU 13 18.925 -7.968 -5.476 1652 HG3 GLU 13 1HG GLU 13 17.553 -9.086 -5.790 1653 H GLU 14 H GLU 14 15.014 -6.869 -8.359 1654 HA GLU 14 HA GLU 14 15.695 -5.177 -10.457 1655 HB2 GLU 14 2HB GLU 14 14.158 -7.239 -10.523 1656 HB3 GLU 14 1HB GLU 14 12.894 -6.210 -9.789 1657 HG2 GLU 14 2HG GLU 14 12.392 -6.244 -12.099 1658 HG3 GLU 14 1HG GLU 14 13.165 -4.639 -11.867 1659 H LEU 15 H LEU 15 13.748 -4.677 -7.546 1660 HA LEU 15 HA LEU 15 12.432 -2.345 -8.118 1661 HB2 LEU 15 2HB LEU 15 12.268 -3.753 -5.986 1662 HB3 LEU 15 1HB LEU 15 13.829 -3.062 -5.464 1663 HG LEU 15 HG LEU 15 12.772 -0.751 -5.487 1664 HD11 LEU 15 1HD1 LEU 15 10.863 -1.114 -7.040 1665 HD12 LEU 15 2HD1 LEU 15 10.255 -0.614 -5.423 1666 HD13 LEU 15 3HD1 LEU 15 10.152 -2.336 -5.920 1667 HD21 LEU 15 3HD2 LEU 15 11.426 -2.840 -3.657 1668 HD22 LEU 15 1HD2 LEU 15 11.548 -1.066 -3.352 1669 HD23 LEU 15 2HD2 LEU 15 13.041 -2.079 -3.391 1670 H GLN 16 H GLN 16 15.762 -2.803 -6.904 1671 HA GLN 16 HA GLN 16 16.345 -0.054 -6.642 1672 HB2 GLN 16 2HB GLN 16 18.284 -2.405 -7.071 1673 HB3 GLN 16 1HB GLN 16 18.720 -0.762 -6.471 1674 HG2 GLN 16 2HG GLN 16 17.192 -1.134 -4.468 1675 HG3 GLN 16 1HG GLN 16 16.876 -2.814 -5.043 1676 HE21 GLN 16 1HE2 GLN 16 18.863 -1.041 -2.945 1677 HE22 GLN 16 2HE2 GLN 16 20.186 -2.163 -2.836 1678 H LYS 17 H LYS 17 16.588 -2.362 -9.310 1679 HA LYS 17 HA LYS 17 18.301 -0.828 -10.935 1680 HB2 LYS 17 2HB LYS 17 17.698 -3.364 -11.145 1681 HB3 LYS 17 1HB LYS 17 16.164 -2.834 -11.871 1682 HG2 LYS 17 2HG LYS 17 17.895 -1.458 -13.518 1683 HG3 LYS 17 1HG LYS 17 19.010 -2.740 -12.951 1684 HD2 LYS 17 2HD LYS 17 18.028 -3.439 -15.045 1685 HD3 LYS 17 1HD LYS 17 17.346 -4.485 -13.748 1686 HE2 LYS 17 2HE LYS 17 15.229 -3.019 -13.775 1687 HE3 LYS 17 1HE LYS 17 15.955 -2.074 -15.137 1688 HZ1 LYS 17 3HZ LYS 17 14.937 -4.842 -15.051 1689 HZ2 LYS 17 1HZ LYS 17 16.124 -4.423 -16.225 1690 HZ3 LYS 17 2HZ LYS 17 14.631 -3.635 -16.199 1691 H VAL 18 H VAL 18 14.686 -1.186 -10.860 1692 HA VAL 18 HA VAL 18 14.358 0.377 -13.178 1693 HB VAL 18 HB VAL 18 11.937 0.417 -12.655 1694 HG11 VAL 18 1HG1 VAL 18 11.663 -2.044 -12.972 1695 HG12 VAL 18 2HG1 VAL 18 13.352 -2.331 -12.428 1696 HG13 VAL 18 3HG1 VAL 18 13.036 -1.422 -13.958 1697 HG21 VAL 18 3HG2 VAL 18 12.783 -1.156 -10.120 1698 HG22 VAL 18 1HG2 VAL 18 11.111 -0.997 -10.730 1699 HG23 VAL 18 2HG2 VAL 18 11.982 0.456 -10.151 1700 H LEU 19 H LEU 19 14.236 1.195 -9.691 1701 HA LEU 19 HA LEU 19 13.390 3.840 -10.215 1702 HB2 LEU 19 2HB LEU 19 13.750 4.347 -7.893 1703 HB3 LEU 19 1HB LEU 19 12.963 2.761 -8.078 1704 HG LEU 19 HG LEU 19 15.448 1.812 -7.814 1705 HD11 LEU 19 1HD1 LEU 19 16.655 4.030 -7.675 1706 HD12 LEU 19 2HD1 LEU 19 16.778 3.127 -6.132 1707 HD13 LEU 19 3HD1 LEU 19 15.625 4.500 -6.287 1708 HD21 LEU 19 3HD2 LEU 19 15.007 1.632 -5.332 1709 HD22 LEU 19 1HD2 LEU 19 13.559 1.268 -6.339 1710 HD23 LEU 19 2HD2 LEU 19 13.687 2.850 -5.510 1711 H GLU 20 H GLU 20 16.628 2.276 -10.004 1712 HA GLU 20 HA GLU 20 17.974 4.685 -9.707 1713 HB2 GLU 20 2HB GLU 20 18.903 2.206 -9.414 1714 HB3 GLU 20 1HB GLU 20 19.380 2.396 -11.125 1715 HG2 GLU 20 2HG GLU 20 20.459 4.709 -10.132 1716 HG3 GLU 20 1HG GLU 20 20.276 3.850 -8.562 1717 H GLU 21 H GLU 21 17.022 2.873 -12.629 1718 HA GLU 21 HA GLU 21 18.464 4.675 -14.368 1719 HB2 GLU 21 2HB GLU 21 17.364 2.092 -14.599 1720 HB3 GLU 21 1HB GLU 21 16.329 3.051 -15.683 1721 HG2 GLU 21 2HG GLU 21 19.434 3.105 -15.788 1722 HG3 GLU 21 1HG GLU 21 18.447 1.866 -16.639 1723 H ALA 22 H ALA 22 15.376 4.604 -12.751 1724 HA ALA 22 HA ALA 22 14.111 6.502 -14.499 1725 HB1 ALA 22 1HB ALA 22 12.349 6.643 -12.800 1726 HB2 ALA 22 2HB ALA 22 13.336 5.680 -11.645 1727 HB3 ALA 22 3HB ALA 22 12.710 4.912 -13.148 1728 H SER 23 H SER 23 16.040 6.586 -11.423 1729 HA SER 23 HA SER 23 15.653 9.099 -10.593 1730 HB2 SER 23 2HB SER 23 18.538 7.989 -10.916 1731 HB3 SER 23 1HB SER 23 17.901 9.085 -9.634 1732 HG SER 23 1HG SER 23 18.210 6.860 -9.074 1733 H LYS 24 H LYS 24 17.845 8.016 -13.119 1734 HA LYS 24 HA LYS 24 19.136 10.395 -13.770 1735 HB2 LYS 24 2HB LYS 24 19.863 8.070 -14.491 1736 HB3 LYS 24 1HB LYS 24 18.375 7.929 -15.483 1737 HG2 LYS 24 2HG LYS 24 19.287 9.987 -16.828 1738 HG3 LYS 24 1HG LYS 24 20.850 9.680 -16.000 1739 HD2 LYS 24 2HD LYS 24 19.250 7.603 -17.645 1740 HD3 LYS 24 1HD LYS 24 20.540 8.653 -18.336 1741 HE2 LYS 24 2HE LYS 24 22.272 7.601 -16.939 1742 HE3 LYS 24 1HE LYS 24 21.034 6.652 -16.022 1743 HZ1 LYS 24 3HZ LYS 24 21.681 6.341 -18.929 1744 HZ2 LYS 24 1HZ LYS 24 20.462 5.488 -18.021 1745 HZ3 LYS 24 2HZ LYS 24 22.107 5.318 -17.644 1746 H LYS 25 H LYS 25 16.117 8.876 -14.893 1747 HA LYS 25 HA LYS 25 15.713 10.764 -16.997 1748 HB2 LYS 25 2HB LYS 25 13.706 8.817 -15.726 1749 HB3 LYS 25 1HB LYS 25 13.425 9.808 -17.198 1750 HG2 LYS 25 2HG LYS 25 15.348 8.651 -18.345 1751 HG3 LYS 25 1HG LYS 25 15.587 7.651 -16.881 1752 HD2 LYS 25 2HD LYS 25 13.053 6.923 -17.226 1753 HD3 LYS 25 1HD LYS 25 13.199 7.699 -18.833 1754 HE2 LYS 25 2HE LYS 25 13.643 5.284 -19.103 1755 HE3 LYS 25 1HE LYS 25 15.200 6.177 -19.340 1756 HZ1 LYS 25 3HZ LYS 25 14.333 4.522 -17.049 1757 HZ2 LYS 25 1HZ LYS 25 15.506 5.728 -16.827 1758 HZ3 LYS 25 2HZ LYS 25 15.799 4.501 -17.918 1759 H ALA 26 H ALA 26 14.489 10.328 -13.623 1760 HA ALA 26 HA ALA 26 12.564 12.288 -13.681 1761 HB1 ALA 26 1HB ALA 26 12.845 10.712 -11.757 1762 HB2 ALA 26 2HB ALA 26 12.792 12.424 -11.209 1763 HB3 ALA 26 3HB ALA 26 14.373 11.551 -11.291 1764 H VAL 27 H VAL 27 16.037 12.663 -12.704 1765 HA VAL 27 HA VAL 27 15.673 15.435 -12.297 1766 HB VAL 27 HB VAL 27 17.385 14.214 -11.126 1767 HG11 VAL 27 1HG1 VAL 27 18.913 14.037 -13.814 1768 HG12 VAL 27 2HG1 VAL 27 18.120 12.659 -12.975 1769 HG13 VAL 27 3HG1 VAL 27 19.495 13.507 -12.193 1770 HG21 VAL 27 3HG2 VAL 27 19.121 15.966 -11.252 1771 HG22 VAL 27 1HG2 VAL 27 17.484 16.686 -11.403 1772 HG23 VAL 27 2HG2 VAL 27 18.518 16.506 -12.863 1773 H GLU 28 H GLU 28 16.658 13.556 -15.214 1774 HA GLU 28 HA GLU 28 17.417 15.950 -16.593 1775 HB2 GLU 28 2HB GLU 28 18.471 13.832 -17.199 1776 HB3 GLU 28 1HB GLU 28 16.874 13.122 -17.611 1777 HG2 GLU 28 2HG GLU 28 18.192 13.693 -19.641 1778 HG3 GLU 28 1HG GLU 28 16.659 14.613 -19.565 1779 H ALA 29 H ALA 29 14.436 14.164 -16.103 1780 HA ALA 29 HA ALA 29 12.991 15.196 -18.258 1781 HB1 ALA 29 1HB ALA 29 12.105 14.094 -15.516 1782 HB2 ALA 29 2HB ALA 29 12.259 13.157 -17.048 1783 HB3 ALA 29 3HB ALA 29 11.020 14.420 -16.898 1784 H GLU 30 H GLU 30 13.277 16.221 -14.770 1785 HA GLU 30 HA GLU 30 11.697 18.548 -15.484 1786 HB2 GLU 30 2HB GLU 30 11.491 19.072 -13.233 1787 HB3 GLU 30 1HB GLU 30 11.255 17.312 -13.388 1788 HG2 GLU 30 2HG GLU 30 12.750 16.997 -11.737 1789 HG3 GLU 30 1HG GLU 30 14.050 17.521 -12.860 1790 H ARG 31 H ARG 31 14.944 17.766 -15.845 1791 HA ARG 31 HA ARG 31 16.149 20.116 -14.934 1792 HB2 ARG 31 2HB ARG 31 17.562 18.174 -15.469 1793 HB3 ARG 31 1HB ARG 31 17.044 18.237 -17.184 1794 HG2 ARG 31 2HG ARG 31 19.298 18.994 -16.949 1795 HG3 ARG 31 1HG ARG 31 18.285 20.370 -17.484 1796 HD2 ARG 31 2HD ARG 31 18.349 21.356 -15.172 1797 HD3 ARG 31 1HD ARG 31 19.300 19.920 -14.577 1798 HE ARG 31 HE ARG 31 20.652 20.901 -16.871 1799 HH11 ARG 31 1HH2 ARG 31 19.729 22.399 -13.709 1800 HH12 ARG 31 2HH2 ARG 31 21.100 23.384 -13.634 1801 HH21 ARG 31 1HH1 ARG 31 22.685 22.113 -16.600 1802 HH22 ARG 31 2HH1 ARG 31 22.857 23.220 -15.336 1803 H GLY 32 H GLY 32 14.994 21.902 -15.519 1804 HA2 GLY 32 2HA GLY 32 15.346 23.780 -16.939 1805 HA3 GLY 32 1HA GLY 32 15.189 22.688 -18.369 1806 H ALA 33 H ALA 33 13.050 21.700 -15.859 1807 HA ALA 33 HA ALA 33 10.859 22.633 -17.434 1808 HB1 ALA 33 1HB ALA 33 9.437 21.369 -15.773 1809 HB2 ALA 33 2HB ALA 33 10.917 21.048 -14.797 1810 HB3 ALA 33 3HB ALA 33 10.756 20.351 -16.454 1811 HA PRO 34 HA PRO 34 10.202 26.110 -14.803 1812 HB2 PRO 34 2HB PRO 34 7.470 26.663 -15.136 1813 HB3 PRO 34 1HB PRO 34 8.710 26.941 -16.423 1814 HG2 PRO 34 2HG PRO 34 6.882 24.505 -16.072 1815 HG3 PRO 34 1HG PRO 34 7.190 25.462 -17.583 1816 HD2 PRO 34 2HD PRO 34 8.533 23.102 -17.033 1817 HD3 PRO 34 1HD PRO 34 9.400 24.500 -17.825 1818 H GLY 35 H GLY 35 9.857 26.463 -12.595 1819 HA2 GLY 35 2HA GLY 35 9.025 26.204 -10.527 1820 HA3 GLY 35 1HA GLY 35 7.606 25.348 -11.255 1821 H ALA 36 H ALA 36 10.859 24.330 -11.826 1822 HA ALA 36 HA ALA 36 10.542 21.698 -11.099 1823 HB1 ALA 36 1HB ALA 36 13.046 23.497 -11.372 1824 HB2 ALA 36 2HB ALA 36 12.306 22.479 -12.673 1825 HB3 ALA 36 3HB ALA 36 13.105 21.710 -11.270 1826 H ALA 37 H ALA 37 11.691 20.495 -9.444 1827 HA ALA 37 HA ALA 37 12.216 21.973 -6.936 1828 HB1 ALA 37 1HB ALA 37 9.774 21.305 -6.791 1829 HB2 ALA 37 2HB ALA 37 10.778 20.380 -5.613 1830 HB3 ALA 37 3HB ALA 37 10.234 19.605 -7.155 1831 H LEU 38 H LEU 38 12.714 19.302 -9.151 1832 HA LEU 38 HA LEU 38 14.245 17.740 -7.210 1833 HB2 LEU 38 2HB LEU 38 12.447 17.202 -9.581 1834 HB3 LEU 38 1HB LEU 38 13.850 16.114 -9.448 1835 HG LEU 38 HG LEU 38 12.071 16.570 -7.034 1836 HD11 LEU 38 1HD1 LEU 38 11.492 14.568 -9.310 1837 HD12 LEU 38 2HD1 LEU 38 10.501 15.996 -8.846 1838 HD13 LEU 38 3HD1 LEU 38 10.669 14.611 -7.707 1839 HD21 LEU 38 3HD2 LEU 38 14.344 15.321 -6.924 1840 HD22 LEU 38 1HD2 LEU 38 13.633 14.084 -8.013 1841 HD23 LEU 38 2HD2 LEU 38 12.911 14.358 -6.387 1842 H ILE 39 H ILE 39 15.246 20.202 -8.421 1843 HA ILE 39 HA ILE 39 16.557 19.747 -10.776 1844 HB ILE 39 HB ILE 39 17.844 21.798 -10.292 1845 HG12 ILE 39 2HG1 ILE 39 16.929 22.941 -7.997 1846 HG13 ILE 39 1HG1 ILE 39 16.986 21.250 -7.408 1847 HG21 ILE 39 1HG2 ILE 39 15.487 21.843 -11.104 1848 HG22 ILE 39 2HG2 ILE 39 15.870 23.276 -10.085 1849 HG23 ILE 39 3HG2 ILE 39 14.875 21.930 -9.423 1850 HD11 ILE 39 3HD ILE 39 19.344 22.808 -8.691 1851 HD12 ILE 39 1HD ILE 39 19.112 22.538 -6.927 1852 HD13 ILE 39 2HD ILE 39 19.440 21.145 -8.004 1853 H SER 40 H SER 40 17.418 18.424 -7.775 1854 HA SER 40 HA SER 40 20.260 18.648 -8.158 1855 HB2 SER 40 2HB SER 40 18.640 17.336 -5.930 1856 HB3 SER 40 1HB SER 40 20.434 17.555 -5.936 1857 HG SER 40 1HG SER 40 19.711 19.246 -4.889 1858 H TYR 41 H TYR 41 21.458 17.236 -9.169 1859 HA TYR 41 HA TYR 41 20.607 14.797 -10.168 1860 HB2 TYR 41 2HB TYR 41 22.285 16.174 -11.298 1861 HB3 TYR 41 1HB TYR 41 23.411 16.033 -9.926 1862 HD1 TYR 41 2HD TYR 41 21.807 14.146 -12.737 1863 HD2 TYR 41 1HD TYR 41 24.904 14.168 -9.751 1864 HE1 TYR 41 2HE TYR 41 22.984 12.338 -13.937 1865 HE2 TYR 41 1HE TYR 41 26.063 12.351 -10.925 1866 HH TYR 41 HH TYR 41 26.011 10.853 -12.689 1867 HA PRO 42 HA PRO 42 23.101 12.217 -7.281 1868 HB2 PRO 42 2HB PRO 42 24.267 13.100 -4.891 1869 HB3 PRO 42 1HB PRO 42 25.089 13.283 -6.486 1870 HG2 PRO 42 2HG PRO 42 23.398 15.373 -4.995 1871 HG3 PRO 42 1HG PRO 42 25.042 15.587 -5.726 1872 HD2 PRO 42 2HD PRO 42 22.720 16.315 -7.055 1873 HD3 PRO 42 1HD PRO 42 24.141 15.604 -7.953 1874 H ASP 43 H ASP 43 20.914 14.590 -6.008 1875 HA ASP 43 HA ASP 43 19.989 13.040 -3.771 1876 HB2 ASP 43 2HB ASP 43 18.707 15.401 -5.303 1877 HB3 ASP 43 1HB ASP 43 17.955 14.626 -3.879 1878 H ALA 44 H ALA 44 19.548 13.005 -7.231 1879 HA ALA 44 HA ALA 44 16.819 12.685 -7.400 1880 HB1 ALA 44 1HB ALA 44 18.951 11.527 -9.305 1881 HB2 ALA 44 2HB ALA 44 18.282 13.195 -9.367 1882 HB3 ALA 44 3HB ALA 44 17.204 11.792 -9.692 1883 H ILE 45 H ILE 45 19.341 10.332 -6.713 1884 HA ILE 45 HA ILE 45 17.685 8.055 -7.101 1885 HB ILE 45 HB ILE 45 19.997 7.802 -7.480 1886 HG12 ILE 45 2HG1 ILE 45 19.312 6.312 -4.873 1887 HG13 ILE 45 1HG1 ILE 45 18.733 5.866 -6.506 1888 HG21 ILE 45 1HG2 ILE 45 20.913 9.633 -6.122 1889 HG22 ILE 45 2HG2 ILE 45 21.727 8.114 -5.682 1890 HG23 ILE 45 3HG2 ILE 45 20.473 8.793 -4.594 1891 HD11 ILE 45 3HD ILE 45 21.679 5.914 -5.550 1892 HD12 ILE 45 1HD ILE 45 20.679 4.472 -5.934 1893 HD13 ILE 45 2HD ILE 45 21.167 5.601 -7.250 1894 H TRP 46 H TRP 46 18.238 10.290 -4.398 1895 HA TRP 46 HA TRP 46 17.319 8.416 -2.418 1896 HB2 TRP 46 2HB TRP 46 18.248 11.258 -2.471 1897 HB3 TRP 46 1HB TRP 46 16.892 11.014 -1.355 1898 HD1 TRP 46 HD TRP 46 18.107 11.398 0.829 1899 HE1 TRP 46 1HE TRP 46 20.176 10.425 2.039 1900 HE3 TRP 46 3HE TRP 46 19.598 8.034 -2.728 1901 HZ2 TRP 46 2HZ TRP 46 22.017 8.293 1.637 1902 HZ3 TRP 46 3HZ TRP 46 21.497 6.553 -2.254 1903 HH2 TRP 46 HH TRP 46 22.698 6.678 -0.101 1904 H TRP 47 H TRP 47 15.882 10.874 -4.524 1905 HA TRP 47 HA TRP 47 13.340 10.758 -3.221 1906 HB2 TRP 47 2HB TRP 47 14.115 12.715 -4.634 1907 HB3 TRP 47 1HB TRP 47 13.990 11.669 -6.092 1908 HD1 TRP 47 HD TRP 47 11.600 12.792 -3.121 1909 HE1 TRP 47 1HE TRP 47 9.221 12.867 -4.022 1910 HE3 TRP 47 3HE TRP 47 12.574 11.348 -7.922 1911 HZ2 TRP 47 2HZ TRP 47 7.891 12.330 -6.478 1912 HZ3 TRP 47 3HZ TRP 47 10.690 11.161 -9.523 1913 HH2 TRP 47 HH TRP 47 8.382 11.643 -8.809 1914 H SER 48 H SER 48 14.862 9.098 -6.111 1915 HA SER 48 HA SER 48 12.418 7.921 -6.805 1916 HB2 SER 48 2HB SER 48 13.721 6.476 -8.345 1917 HB3 SER 48 1HB SER 48 14.123 8.224 -8.499 1918 HG SER 48 1HG SER 48 15.987 6.966 -8.426 1919 H VAL 49 H VAL 49 14.962 6.914 -4.535 1920 HA VAL 49 HA VAL 49 14.179 4.291 -4.157 1921 HB VAL 49 HB VAL 49 15.436 6.316 -2.290 1922 HG11 VAL 49 1HG1 VAL 49 15.900 4.368 -0.704 1923 HG12 VAL 49 2HG1 VAL 49 14.723 3.371 -1.627 1924 HG13 VAL 49 3HG1 VAL 49 14.169 4.837 -0.738 1925 HG21 VAL 49 3HG2 VAL 49 16.430 3.648 -3.521 1926 HG22 VAL 49 1HG2 VAL 49 17.426 4.880 -2.663 1927 HG23 VAL 49 2HG2 VAL 49 16.712 5.247 -4.276 1928 H GLU 50 H GLU 50 12.850 7.239 -2.445 1929 HA GLU 50 HA GLU 50 11.078 5.471 -1.068 1930 HB2 GLU 50 2HB GLU 50 10.207 7.321 0.147 1931 HB3 GLU 50 1HB GLU 50 11.985 7.309 0.140 1932 HG2 GLU 50 2HG GLU 50 11.784 9.540 -0.249 1933 HG3 GLU 50 1HG GLU 50 11.583 9.059 -1.974 1934 H THR 51 H THR 51 10.944 7.252 -4.042 1935 HA THR 51 HA THR 51 8.150 7.325 -4.345 1936 HB THR 51 HB THR 51 10.336 7.161 -6.490 1937 HG1 THR 51 1HG THR 51 10.487 8.979 -5.047 1938 HG21 THR 51 3HG2 THR 51 8.061 6.681 -7.463 1939 HG22 THR 51 1HG2 THR 51 8.613 8.322 -7.941 1940 HG23 THR 51 2HG2 THR 51 7.395 8.132 -6.628 1941 H ALA 52 H ALA 52 10.611 4.801 -5.072 1942 HA ALA 52 HA ALA 52 8.817 3.163 -6.536 1943 HB1 ALA 52 1HB ALA 52 11.376 2.363 -5.012 1944 HB2 ALA 52 2HB ALA 52 11.338 3.004 -6.695 1945 HB3 ALA 52 3HB ALA 52 10.567 1.418 -6.325 1946 H THR 53 H THR 53 9.395 3.618 -3.052 1947 HA THR 53 HA THR 53 7.913 1.187 -2.458 1948 HB THR 53 HB THR 53 8.308 2.090 -0.044 1949 HG1 THR 53 1HG THR 53 8.987 4.194 -0.771 1950 HG21 THR 53 3HG2 THR 53 10.651 1.277 -1.909 1951 HG22 THR 53 1HG2 THR 53 9.493 0.152 -1.099 1952 HG23 THR 53 2HG2 THR 53 10.629 1.141 -0.110 1953 H THR 54 H THR 54 6.992 4.060 -3.674 1954 HA THR 54 HA THR 54 5.355 5.446 -3.531 1955 HB THR 54 HB THR 54 3.051 4.498 -3.383 1956 HG1 THR 54 1HG THR 54 3.787 2.802 -1.892 1957 HG21 THR 54 3HG2 THR 54 5.098 2.915 -5.106 1958 HG22 THR 54 1HG2 THR 54 4.415 4.535 -5.508 1959 HG23 THR 54 2HG2 THR 54 3.337 3.096 -5.434 1960 H VAL 55 H VAL 55 6.854 5.768 -1.274 1961 HA VAL 55 HA VAL 55 4.958 5.812 0.954 1962 HB VAL 55 HB VAL 55 7.879 6.747 0.858 1963 HG11 VAL 55 1HG1 VAL 55 5.793 6.402 3.134 1964 HG12 VAL 55 2HG1 VAL 55 6.533 7.948 2.590 1965 HG13 VAL 55 3HG1 VAL 55 7.554 6.703 3.394 1966 HG21 VAL 55 3HG2 VAL 55 7.563 4.253 0.508 1967 HG22 VAL 55 1HG2 VAL 55 6.513 4.190 1.952 1968 HG23 VAL 55 2HG2 VAL 55 8.261 4.594 2.128 1969 H GLY 56 H GLY 56 7.238 8.257 -0.584 1970 HA2 GLY 56 2HA GLY 56 6.721 10.163 -1.483 1971 HA3 GLY 56 1HA GLY 56 4.948 9.776 -1.398 1972 H TYR 57 H TYR 57 7.686 10.217 0.867 1973 HA TYR 57 HA TYR 57 5.862 11.038 2.888 1974 HB2 TYR 57 2HB TYR 57 8.522 10.037 2.804 1975 HB3 TYR 57 1HB TYR 57 8.742 11.679 3.485 1976 HD1 TYR 57 1HD TYR 57 6.434 12.123 5.264 1977 HD2 TYR 57 2HD TYR 57 8.569 8.475 4.471 1978 HE1 TYR 57 1HE TYR 57 5.632 11.203 7.379 1979 HE2 TYR 57 2HE TYR 57 7.755 7.540 6.605 1980 HH TYR 57 HH TYR 57 5.307 9.264 8.587 1981 H GLY 58 H GLY 58 7.344 12.798 0.376 1982 HA2 GLY 58 2HA GLY 58 6.496 14.894 -0.062 1983 HA3 GLY 58 1HA GLY 58 6.386 15.260 1.688 1984 H ASP 59 H ASP 59 9.231 13.833 0.135 1985 HA ASP 59 HA ASP 59 10.889 15.932 1.149 1986 HB2 ASP 59 2HB ASP 59 11.689 13.526 0.856 1987 HB3 ASP 59 1HB ASP 59 11.669 13.774 -0.918 1988 H ARG 60 H ARG 60 9.920 14.867 -2.248 1989 HA ARG 60 HA ARG 60 10.114 17.644 -3.035 1990 HB2 ARG 60 2HB ARG 60 11.585 15.434 -4.597 1991 HB3 ARG 60 1HB ARG 60 11.425 17.163 -5.071 1992 HG2 ARG 60 2HG ARG 60 12.739 17.828 -3.027 1993 HG3 ARG 60 1HG ARG 60 12.941 16.090 -2.608 1994 HD2 ARG 60 2HD ARG 60 14.160 15.729 -4.789 1995 HD3 ARG 60 1HD ARG 60 14.061 17.502 -5.134 1996 HE ARG 60 HE ARG 60 15.672 16.099 -3.028 1997 HH11 ARG 60 1HH2 ARG 60 14.604 19.335 -4.260 1998 HH12 ARG 60 2HH2 ARG 60 15.835 20.176 -3.416 1999 HH21 ARG 60 1HH1 ARG 60 17.691 17.252 -2.416 2000 HH22 ARG 60 2HH1 ARG 60 17.649 18.931 -2.330 2001 H TYR 61 H TYR 61 9.136 17.550 -5.598 2002 HA TYR 61 HA TYR 61 7.311 15.369 -5.704 2003 HB2 TYR 61 2HB TYR 61 5.276 16.766 -5.999 2004 HB3 TYR 61 1HB TYR 61 5.944 16.926 -4.343 2005 HD1 TYR 61 2HD TYR 61 7.368 19.031 -3.810 2006 HD2 TYR 61 1HD TYR 61 4.943 18.671 -7.344 2007 HE1 TYR 61 2HE TYR 61 7.390 21.480 -4.070 2008 HE2 TYR 61 1HE TYR 61 4.944 21.113 -7.601 2009 HH TYR 61 HH TYR 61 6.695 23.275 -5.320 2010 HA PRO 62 HA PRO 62 8.618 16.388 -9.823 2011 HB2 PRO 62 2HB PRO 62 7.015 14.694 -11.332 2012 HB3 PRO 62 1HB PRO 62 8.216 14.040 -10.170 2013 HG2 PRO 62 2HG PRO 62 5.196 14.409 -9.749 2014 HG3 PRO 62 1HG PRO 62 6.223 12.972 -9.349 2015 HD2 PRO 62 2HD PRO 62 5.507 15.025 -7.530 2016 HD3 PRO 62 1HD PRO 62 7.002 14.002 -7.362 2017 H VAL 63 H VAL 63 7.790 17.289 -11.945 2018 HA VAL 63 HA VAL 63 5.418 18.956 -11.441 2019 HB VAL 63 HB VAL 63 6.373 20.450 -13.216 2020 HG11 VAL 63 1HG1 VAL 63 6.637 20.846 -10.748 2021 HG12 VAL 63 2HG1 VAL 63 8.059 21.414 -11.686 2022 HG13 VAL 63 3HG1 VAL 63 8.155 19.883 -10.751 2023 HG21 VAL 63 3HG2 VAL 63 7.852 18.690 -14.351 2024 HG22 VAL 63 1HG2 VAL 63 8.889 18.645 -12.877 2025 HG23 VAL 63 2HG2 VAL 63 8.760 20.151 -13.830 2026 H THR 64 H THR 64 4.894 19.636 -14.159 2027 HA THR 64 HA THR 64 3.537 17.266 -15.015 2028 HB THR 64 HB THR 64 2.601 19.117 -16.643 2029 HG1 THR 64 1HG THR 64 3.025 21.195 -15.945 2030 HG21 THR 64 3HG2 THR 64 1.376 18.256 -14.623 2031 HG22 THR 64 1HG2 THR 64 1.143 20.029 -14.784 2032 HG23 THR 64 2HG2 THR 64 2.291 19.375 -13.556 2033 H GLU 65 H GLU 65 5.858 19.721 -16.177 2034 HA GLU 65 HA GLU 65 6.225 18.495 -18.694 2035 HB2 GLU 65 2HB GLU 65 6.932 21.031 -17.470 2036 HB3 GLU 65 1HB GLU 65 8.412 20.353 -18.204 2037 HG2 GLU 65 2HG GLU 65 5.743 20.730 -19.720 2038 HG3 GLU 65 1HG GLU 65 7.129 21.880 -19.721 2039 H GLU 66 H GLU 66 7.371 17.352 -15.752 2040 HA GLU 66 HA GLU 66 9.885 16.433 -16.799 2041 HB2 GLU 66 2HB GLU 66 9.950 14.760 -15.069 2042 HB3 GLU 66 1HB GLU 66 9.625 16.330 -14.324 2043 HG2 GLU 66 2HG GLU 66 7.538 15.668 -13.518 2044 HG3 GLU 66 1HG GLU 66 7.191 14.581 -14.902 2045 H GLY 67 H GLY 67 6.496 15.793 -17.053 2046 HA2 GLY 67 2HA GLY 67 5.353 14.435 -18.419 2047 HA3 GLY 67 1HA GLY 67 6.889 13.548 -18.862 2048 H ARG 68 H ARG 68 4.482 14.127 -16.243 2049 HA ARG 68 HA ARG 68 5.772 12.853 -14.233 2050 HB2 ARG 68 2HB ARG 68 3.827 14.370 -13.963 2051 HB3 ARG 68 1HB ARG 68 2.733 13.048 -14.502 2052 HG2 ARG 68 2HG ARG 68 3.293 11.698 -12.534 2053 HG3 ARG 68 1HG ARG 68 4.627 12.798 -12.072 2054 HD2 ARG 68 2HD ARG 68 1.604 13.545 -12.069 2055 HD3 ARG 68 1HD ARG 68 2.557 13.021 -10.623 2056 HE ARG 68 HE ARG 68 4.008 15.174 -11.822 2057 HH11 ARG 68 1HH2 ARG 68 0.898 14.633 -9.868 2058 HH12 ARG 68 2HH2 ARG 68 0.708 16.300 -9.692 2059 HH21 ARG 68 1HH1 ARG 68 3.929 17.208 -10.380 2060 HH22 ARG 68 2HH1 ARG 68 2.345 17.715 -9.941 2061 H LYS 69 H LYS 69 4.705 11.301 -16.977 2062 HA LYS 69 HA LYS 69 4.206 8.733 -15.848 2063 HB2 LYS 69 2HB LYS 69 4.985 9.650 -18.654 2064 HB3 LYS 69 1HB LYS 69 4.899 7.916 -18.229 2065 HG2 LYS 69 2HG LYS 69 2.513 9.821 -17.844 2066 HG3 LYS 69 1HG LYS 69 2.825 8.885 -19.350 2067 HD2 LYS 69 2HD LYS 69 2.752 6.746 -18.097 2068 HD3 LYS 69 1HD LYS 69 2.456 7.632 -16.555 2069 HE2 LYS 69 2HE LYS 69 0.280 8.500 -17.435 2070 HE3 LYS 69 1HE LYS 69 0.543 7.636 -19.003 2071 HZ1 LYS 69 3HZ LYS 69 -0.906 6.565 -17.253 2072 HZ2 LYS 69 1HZ LYS 69 0.512 6.174 -16.416 2073 HZ3 LYS 69 2HZ LYS 69 0.237 5.578 -17.995 2074 H VAL 70 H VAL 70 7.136 10.652 -16.017 2075 HA VAL 70 HA VAL 70 8.863 8.366 -16.035 2076 HB VAL 70 HB VAL 70 9.350 11.226 -15.053 2077 HG11 VAL 70 1HG1 VAL 70 11.776 10.548 -15.177 2078 HG12 VAL 70 2HG1 VAL 70 11.277 8.831 -15.450 2079 HG13 VAL 70 3HG1 VAL 70 10.891 9.665 -13.895 2080 HG21 VAL 70 3HG2 VAL 70 10.083 9.754 -17.685 2081 HG22 VAL 70 1HG2 VAL 70 10.667 11.393 -17.198 2082 HG23 VAL 70 2HG2 VAL 70 8.927 11.130 -17.499 2083 H ALA 71 H ALA 71 7.762 10.682 -13.430 2084 HA ALA 71 HA ALA 71 8.472 9.167 -11.288 2085 HB1 ALA 71 1HB ALA 71 5.929 10.887 -11.571 2086 HB2 ALA 71 2HB ALA 71 7.564 11.498 -11.143 2087 HB3 ALA 71 3HB ALA 71 6.693 10.390 -10.013 2088 H GLU 72 H GLU 72 5.284 9.051 -12.964 2089 HA GLU 72 HA GLU 72 4.094 7.203 -11.292 2090 HB2 GLU 72 2HB GLU 72 2.935 8.622 -13.076 2091 HB3 GLU 72 1HB GLU 72 3.570 7.482 -14.307 2092 HG2 GLU 72 2HG GLU 72 1.245 6.904 -13.828 2093 HG3 GLU 72 1HG GLU 72 2.249 5.594 -13.105 2094 H GLN 73 H GLN 73 6.279 6.658 -14.089 2095 HA GLN 73 HA GLN 73 5.588 3.942 -14.425 2096 HB2 GLN 73 2HB GLN 73 6.778 5.171 -16.204 2097 HB3 GLN 73 1HB GLN 73 8.210 5.384 -15.143 2098 HG2 GLN 73 2HG GLN 73 8.687 2.966 -15.206 2099 HG3 GLN 73 1HG GLN 73 7.111 2.623 -15.997 2100 HE21 GLN 73 1HE2 GLN 73 7.206 2.404 -18.213 2101 HE22 GLN 73 2HE2 GLN 73 8.438 3.037 -19.252 2102 H VAL 74 H VAL 74 7.806 5.626 -12.206 2103 HA VAL 74 HA VAL 74 9.198 3.286 -11.412 2104 HB VAL 74 HB VAL 74 8.764 5.722 -9.601 2105 HG11 VAL 74 1HG1 VAL 74 11.085 5.113 -8.857 2106 HG12 VAL 74 2HG1 VAL 74 11.115 3.742 -10.036 2107 HG13 VAL 74 3HG1 VAL 74 9.964 3.726 -8.651 2108 HG21 VAL 74 3HG2 VAL 74 10.865 6.651 -10.776 2109 HG22 VAL 74 1HG2 VAL 74 9.321 6.777 -11.664 2110 HG23 VAL 74 2HG2 VAL 74 10.503 5.496 -12.124 2111 H MET 75 H MET 75 6.325 5.061 -10.262 2112 HA MET 75 HA MET 75 5.977 3.725 -7.856 2113 HB2 MET 75 2HB MET 75 3.864 5.022 -9.687 2114 HB3 MET 75 1HB MET 75 3.589 4.536 -7.983 2115 HG2 MET 75 2HG MET 75 5.256 6.136 -7.172 2116 HG3 MET 75 1HG MET 75 5.754 6.552 -8.837 2117 HE1 MET 75 3HE MET 75 4.184 9.874 -7.664 2118 HE2 MET 75 1HE MET 75 5.614 9.019 -8.337 2119 HE3 MET 75 2HE MET 75 5.078 8.688 -6.651 2120 H LYS 76 H LYS 76 4.496 3.080 -11.094 2121 HA LYS 76 HA LYS 76 3.052 0.879 -10.125 2122 HB2 LYS 76 2HB LYS 76 2.688 2.123 -12.392 2123 HB3 LYS 76 1HB LYS 76 3.952 1.022 -13.038 2124 HG2 LYS 76 2HG LYS 76 2.467 -0.908 -11.976 2125 HG3 LYS 76 1HG LYS 76 1.189 0.338 -11.834 2126 HD2 LYS 76 2HD LYS 76 1.285 0.635 -14.360 2127 HD3 LYS 76 1HD LYS 76 2.622 -0.573 -14.408 2128 HE2 LYS 76 2HE LYS 76 0.982 -2.260 -13.286 2129 HE3 LYS 76 1HE LYS 76 -0.339 -1.076 -13.630 2130 HZ1 LYS 76 3HZ LYS 76 -0.206 -2.719 -15.334 2131 HZ2 LYS 76 1HZ LYS 76 1.462 -2.412 -15.596 2132 HZ3 LYS 76 2HZ LYS 76 0.266 -1.252 -16.010 2133 H ALA 77 H ALA 77 6.371 1.114 -11.395 2134 HA ALA 77 HA ALA 77 6.761 -1.670 -11.697 2135 HB1 ALA 77 1HB ALA 77 8.280 0.055 -12.756 2136 HB2 ALA 77 2HB ALA 77 9.191 -1.139 -11.758 2137 HB3 ALA 77 3HB ALA 77 8.857 0.517 -11.114 2138 H GLY 78 H GLY 78 7.069 0.584 -8.966 2139 HA2 GLY 78 2HA GLY 78 8.400 -1.165 -7.219 2140 HA3 GLY 78 1HA GLY 78 7.407 0.296 -6.829 2141 H ILE 79 H ILE 79 4.922 -0.391 -7.686 2142 HA ILE 79 HA ILE 79 3.942 -1.967 -5.633 2143 HB ILE 79 HB ILE 79 2.681 -1.215 -8.312 2144 HG12 ILE 79 2HG1 ILE 79 2.248 0.011 -5.515 2145 HG13 ILE 79 1HG1 ILE 79 3.444 0.664 -6.659 2146 HG21 ILE 79 1HG2 ILE 79 0.463 -1.671 -7.150 2147 HG22 ILE 79 2HG2 ILE 79 1.357 -2.327 -5.736 2148 HG23 ILE 79 3HG2 ILE 79 1.432 -3.164 -7.332 2149 HD11 ILE 79 3HD ILE 79 0.402 0.492 -7.174 2150 HD12 ILE 79 1HD ILE 79 1.349 1.960 -6.776 2151 HD13 ILE 79 2HD ILE 79 1.630 1.116 -8.344 2152 H GLU 80 H GLU 80 4.627 -2.839 -9.080 2153 HA GLU 80 HA GLU 80 3.577 -5.421 -8.784 2154 HB2 GLU 80 2HB GLU 80 5.589 -4.486 -10.885 2155 HB3 GLU 80 1HB GLU 80 4.764 -6.086 -10.855 2156 HG2 GLU 80 2HG GLU 80 2.514 -4.813 -10.863 2157 HG3 GLU 80 1HG GLU 80 3.445 -3.320 -11.228 2158 H VAL 81 H VAL 81 6.728 -4.178 -7.749 2159 HA VAL 81 HA VAL 81 7.985 -6.738 -7.615 2160 HB VAL 81 HB VAL 81 8.485 -4.037 -6.286 2161 HG11 VAL 81 1HG1 VAL 81 9.229 -5.614 -4.567 2162 HG12 VAL 81 2HG1 VAL 81 10.667 -5.001 -5.428 2163 HG13 VAL 81 3HG1 VAL 81 10.051 -6.648 -5.791 2164 HG21 VAL 81 3HG2 VAL 81 9.009 -4.342 -8.746 2165 HG22 VAL 81 1HG2 VAL 81 10.087 -5.726 -8.329 2166 HG23 VAL 81 2HG2 VAL 81 10.489 -4.067 -7.761 2167 H PHE 82 H PHE 82 6.280 -4.675 -5.183 2168 HA PHE 82 HA PHE 82 6.602 -6.629 -3.151 2169 HB2 PHE 82 2HB PHE 82 4.711 -4.190 -3.296 2170 HB3 PHE 82 1HB PHE 82 4.969 -5.198 -1.819 2171 HD1 PHE 82 2HD PHE 82 7.456 -5.569 -1.086 2172 HD2 PHE 82 1HD PHE 82 6.168 -2.342 -3.621 2173 HE1 PHE 82 2HE PHE 82 9.504 -4.309 -0.525 2174 HE2 PHE 82 1HE PHE 82 8.224 -1.099 -3.090 2175 HZ PHE 82 HZ PHE 82 9.904 -2.074 -1.534 2176 H ALA 83 H ALA 83 4.208 -6.152 -5.645 2177 HA ALA 83 HA ALA 83 2.293 -7.951 -4.466 2178 HB1 ALA 83 1HB ALA 83 2.571 -6.946 -7.366 2179 HB2 ALA 83 2HB ALA 83 1.600 -6.149 -6.078 2180 HB3 ALA 83 3HB ALA 83 1.137 -7.786 -6.659 2181 H LEU 84 H LEU 84 5.018 -8.194 -6.836 2182 HA LEU 84 HA LEU 84 4.212 -10.665 -7.864 2183 HB2 LEU 84 2HB LEU 84 5.755 -9.198 -9.066 2184 HB3 LEU 84 1HB LEU 84 7.029 -9.430 -7.832 2185 HG LEU 84 HG LEU 84 5.883 -11.885 -9.235 2186 HD11 LEU 84 1HD1 LEU 84 6.064 -10.261 -11.101 2187 HD12 LEU 84 2HD1 LEU 84 7.298 -11.561 -11.251 2188 HD13 LEU 84 3HD1 LEU 84 7.783 -9.922 -10.669 2189 HD21 LEU 84 3HD2 LEU 84 8.250 -12.670 -9.226 2190 HD22 LEU 84 1HD2 LEU 84 7.751 -12.189 -7.572 2191 HD23 LEU 84 2HD2 LEU 84 8.796 -11.092 -8.546 2192 H VAL 85 H VAL 85 6.257 -9.815 -5.076 2193 HA VAL 85 HA VAL 85 7.299 -12.385 -4.712 2194 HB VAL 85 HB VAL 85 7.825 -11.693 -2.387 2195 HG11 VAL 85 1HG1 VAL 85 9.402 -9.905 -3.083 2196 HG12 VAL 85 2HG1 VAL 85 8.451 -9.581 -4.572 2197 HG13 VAL 85 3HG1 VAL 85 9.302 -11.152 -4.373 2198 HG21 VAL 85 3HG2 VAL 85 5.746 -10.264 -1.982 2199 HG22 VAL 85 1HG2 VAL 85 6.374 -9.070 -3.176 2200 HG23 VAL 85 2HG2 VAL 85 7.275 -9.378 -1.657 2201 H THR 86 H THR 86 4.029 -11.395 -4.370 2202 HA THR 86 HA THR 86 3.309 -13.020 -2.240 2203 HB THR 86 HB THR 86 1.585 -12.002 -4.524 2204 HG1 THR 86 1HG THR 86 2.324 -10.884 -2.006 2205 HG21 THR 86 3HG2 THR 86 0.872 -12.854 -1.618 2206 HG22 THR 86 1HG2 THR 86 0.352 -13.678 -3.135 2207 HG23 THR 86 2HG2 THR 86 -0.238 -12.024 -2.772 2208 H ALA 87 H ALA 87 4.436 -13.974 -5.325 2209 HA ALA 87 HA ALA 87 3.143 -16.438 -5.576 2210 HB1 ALA 87 1HB ALA 87 6.116 -15.765 -6.101 2211 HB2 ALA 87 2HB ALA 87 4.774 -15.610 -7.280 2212 HB3 ALA 87 3HB ALA 87 5.260 -17.237 -6.697 2213 H ALA 88 H ALA 88 6.148 -15.633 -3.734 2214 HA ALA 88 HA ALA 88 6.405 -18.243 -2.645 2215 HB1 ALA 88 1HB ALA 88 8.136 -17.196 -1.127 2216 HB2 ALA 88 2HB ALA 88 7.609 -15.568 -1.678 2217 HB3 ALA 88 3HB ALA 88 8.392 -16.692 -2.843 2218 H LEU 89 H LEU 89 4.933 -15.194 -1.506 2219 HA LEU 89 HA LEU 89 4.488 -16.069 1.124 2220 HB2 LEU 89 2HB LEU 89 2.803 -14.047 -0.452 2221 HB3 LEU 89 1HB LEU 89 2.878 -14.214 1.329 2222 HG LEU 89 HG LEU 89 5.291 -13.437 -0.430 2223 HD11 LEU 89 1HD1 LEU 89 3.504 -11.706 -0.587 2224 HD12 LEU 89 2HD1 LEU 89 4.922 -11.120 0.342 2225 HD13 LEU 89 3HD1 LEU 89 3.416 -11.624 1.206 2226 HD21 LEU 89 3HD2 LEU 89 6.307 -12.678 1.726 2227 HD22 LEU 89 1HD2 LEU 89 5.994 -14.443 1.735 2228 HD23 LEU 89 2HD2 LEU 89 4.894 -13.328 2.631 2229 H ALA 90 H ALA 90 2.417 -16.261 -1.850 2230 HA ALA 90 HA ALA 90 0.265 -17.446 -0.405 2231 HB1 ALA 90 1HB ALA 90 -0.151 -16.207 -2.531 2232 HB2 ALA 90 2HB ALA 90 -0.704 -17.918 -2.657 2233 HB3 ALA 90 3HB ALA 90 0.853 -17.406 -3.421 2234 H THR 91 H THR 91 3.315 -18.628 -1.451 2235 HA THR 91 HA THR 91 2.468 -21.391 -1.731 2236 HB THR 91 HB THR 91 5.342 -20.442 -1.140 2237 HG1 THR 91 1HG THR 91 4.280 -19.432 -3.077 2238 HG21 THR 91 3HG2 THR 91 4.982 -22.923 -1.056 2239 HG22 THR 91 1HG2 THR 91 5.929 -22.490 -2.512 2240 HG23 THR 91 2HG2 THR 91 4.175 -22.882 -2.665 2241 H ASP 92 H ASP 92 3.307 -19.066 0.812 2242 HA ASP 92 HA ASP 92 4.923 -20.778 2.228 2243 HB2 ASP 92 2HB ASP 92 4.775 -18.193 2.489 2244 HB3 ASP 92 1HB ASP 92 3.417 -18.506 3.627 2245 H PHE 93 H PHE 93 1.438 -20.268 2.421 2246 HA PHE 93 HA PHE 93 1.091 -21.766 4.778 2247 HB2 PHE 93 2HB PHE 93 -1.191 -21.741 4.468 2248 HB3 PHE 93 1HB PHE 93 -0.700 -20.207 3.688 2249 HD1 PHE 93 1HD PHE 93 -0.644 -20.172 1.093 2250 HD2 PHE 93 2HD PHE 93 -2.302 -23.470 3.284 2251 HE1 PHE 93 1HE PHE 93 -1.910 -20.866 -0.907 2252 HE2 PHE 93 2HE PHE 93 -3.533 -24.196 1.265 2253 HZ PHE 93 HZ PHE 93 -3.370 -22.872 -0.826 2254 H VAL 94 H VAL 94 1.761 -22.763 1.490 2255 HA VAL 94 HA VAL 94 0.403 -25.258 1.631 2256 HB VAL 94 HB VAL 94 2.593 -24.403 -0.330 2257 HG11 VAL 94 1HG1 VAL 94 2.065 -26.856 -0.383 2258 HG12 VAL 94 2HG1 VAL 94 1.415 -26.047 -1.847 2259 HG13 VAL 94 3HG1 VAL 94 0.309 -26.498 -0.496 2260 HG21 VAL 94 3HG2 VAL 94 -0.468 -23.953 -0.403 2261 HG22 VAL 94 1HG2 VAL 94 0.646 -23.684 -1.788 2262 HG23 VAL 94 2HG2 VAL 94 0.789 -22.666 -0.324 2263 H ARG 95 H ARG 95 3.556 -23.985 2.563 2264 HA ARG 95 HA ARG 95 5.027 -26.378 2.665 2265 HB2 ARG 95 2HB ARG 95 5.144 -23.880 4.473 2266 HB3 ARG 95 1HB ARG 95 6.342 -25.212 4.536 2267 HG2 ARG 95 2HG ARG 95 7.117 -24.768 2.285 2268 HG3 ARG 95 1HG ARG 95 5.889 -23.464 2.045 2269 HD2 ARG 95 2HD ARG 95 6.910 -22.018 3.679 2270 HD3 ARG 95 1HD ARG 95 7.878 -23.332 4.405 2271 HE ARG 95 HE ARG 95 8.431 -21.765 1.950 2272 HH11 ARG 95 1HH2 ARG 95 9.520 -24.387 4.233 2273 HH12 ARG 95 2HH2 ARG 95 11.097 -24.478 3.608 2274 HH21 ARG 95 1HH1 ARG 95 10.714 -21.922 1.061 2275 HH22 ARG 95 2HH1 ARG 95 11.841 -22.795 1.990 2276 H ARG 96 H ARG 96 2.267 -25.417 4.547 2277 HA ARG 96 HA ARG 96 2.900 -26.661 6.969 2278 HB2 ARG 96 2HB ARG 96 0.551 -26.560 7.535 2279 HB3 ARG 96 1HB ARG 96 0.893 -25.108 6.541 2280 HG2 ARG 96 2HG ARG 96 0.123 -26.512 4.513 2281 HG3 ARG 96 1HG ARG 96 -0.538 -27.712 5.670 2282 HD2 ARG 96 2HD ARG 96 -2.215 -26.080 6.503 2283 HD3 ARG 96 1HD ARG 96 -1.435 -24.751 5.542 2284 HE ARG 96 HE ARG 96 -1.841 -26.109 3.492 2285 HH11 ARG 96 1HH2 ARG 96 -4.241 -26.608 6.157 2286 HH12 ARG 96 2HH2 ARG 96 -5.070 -27.853 5.360 2287 HH21 ARG 96 1HH1 ARG 96 -2.981 -27.808 2.389 2288 HH22 ARG 96 2HH1 ARG 96 -4.494 -28.319 2.927 2289 H GLU 97 H GLU 97 2.113 -28.017 3.810 2290 HA GLU 97 HA GLU 97 0.874 -30.371 4.858 2291 HB2 GLU 97 2HB GLU 97 0.639 -31.155 2.598 2292 HB3 GLU 97 1HB GLU 97 0.301 -29.398 2.601 2293 HG2 GLU 97 2HG GLU 97 2.820 -29.132 1.821 2294 HG3 GLU 97 1HG GLU 97 2.757 -30.894 1.510 2295 H GLU 98 H GLU 98 1.862 -32.376 5.135 2296 HA GLU 98 HA GLU 98 3.389 -33.766 5.702 2297 HB2 GLU 98 2HB GLU 98 5.419 -32.344 3.931 2298 HB3 GLU 98 1HB GLU 98 5.675 -33.874 4.825 2299 HG2 GLU 98 2HG GLU 98 3.553 -34.791 3.636 2300 HG3 GLU 98 1HG GLU 98 3.635 -33.343 2.559 2301 H GLU 99 H GLU 99 4.940 -30.485 5.836 2302 HA GLU 99 HA GLU 99 6.556 -31.227 7.980 2303 HB2 GLU 99 2HB GLU 99 5.611 -28.395 7.283 2304 HB3 GLU 99 1HB GLU 99 6.904 -28.848 8.444 2305 HG2 GLU 99 2HG GLU 99 8.045 -30.104 6.443 2306 HG3 GLU 99 1HG GLU 99 6.896 -29.195 5.382 2307 H ARG 100 H ARG 100 3.164 -29.953 8.029 2308 HA ARG 100 HA ARG 100 3.364 -29.678 10.886 2309 HB2 ARG 100 2HB ARG 100 1.836 -28.278 9.427 2310 HB3 ARG 100 1HB ARG 100 0.755 -29.714 9.328 2311 HG2 ARG 100 2HG ARG 100 0.557 -29.674 11.860 2312 HG3 ARG 100 1HG ARG 100 1.733 -28.326 11.933 2313 HD2 ARG 100 2HD ARG 100 -0.676 -27.577 12.235 2314 HD3 ARG 100 1HD ARG 100 0.155 -26.792 10.834 2315 HE ARG 100 HE ARG 100 -1.058 -28.121 9.310 2316 HH11 ARG 100 1HH2 ARG 100 -1.950 -29.211 12.699 2317 HH12 ARG 100 2HH2 ARG 100 -3.405 -29.939 12.189 2318 HH21 ARG 100 1HH1 ARG 100 -2.945 -29.453 8.668 2319 HH22 ARG 100 2HH1 ARG 100 -3.827 -30.302 9.832 2320 H ARG 101 H ARG 101 2.884 -32.393 8.795 2321 HA ARG 101 HA ARG 101 1.599 -33.970 10.926 2322 HB2 ARG 101 2HB ARG 101 2.768 -34.872 8.216 2323 HB3 ARG 101 1HB ARG 101 2.080 -35.962 9.467 2324 HG2 ARG 101 2HG ARG 101 -0.114 -34.768 9.299 2325 HG3 ARG 101 1HG ARG 101 0.520 -33.809 7.916 2326 HD2 ARG 101 2HD ARG 101 0.843 -35.936 6.580 2327 HD3 ARG 101 1HD ARG 101 0.316 -36.912 8.006 2328 HE ARG 101 HE ARG 101 -1.924 -36.000 7.860 2329 HH11 ARG 101 1HH2 ARG 101 -0.035 -35.728 4.733 2330 HH12 ARG 101 2HH2 ARG 101 -1.288 -34.918 3.935 2331 HH21 ARG 101 1HH1 ARG 101 -3.690 -35.339 6.563 2332 HH22 ARG 101 2HH1 ARG 101 -3.491 -34.921 4.916 2333 H GLY 102 H GLY 102 4.697 -33.307 9.324 2334 HA2 GLY 102 2HA GLY 102 6.757 -33.401 10.268 2335 HA3 GLY 102 1HA GLY 102 6.176 -34.597 11.493 2336 H HIS 103 H HIS 103 5.275 -34.791 8.099 2337 HA HIS 103 HA HIS 103 5.304 -36.509 6.727 2338 HB2 HIS 103 2HB HIS 103 7.593 -35.624 6.146 2339 HB3 HIS 103 1HB HIS 103 8.294 -36.781 7.324 2340 HD1 HIS 103 1HD HIS 103 6.601 -36.646 3.858 2341 HD2 HIS 103 2HD HIS 103 8.173 -39.586 6.494 2342 HE1 HIS 103 1HE HIS 103 6.569 -38.856 2.674 2343 HE2 HIS 103 2HE HIS 103 7.415 -40.603 4.294 2344 H1 SER 1 H SER 1 -3.558 -22.874 19.150 2345 HA SER 1 HA SER 1 -3.952 -20.750 17.463 2346 HB2 SER 1 2HB SER 1 -1.398 -20.212 17.223 2347 HB3 SER 1 1HB SER 1 -2.282 -19.436 18.584 2348 HG SER 1 1HG SER 1 -0.474 -20.191 19.434 2349 H ALA 2 H ALA 2 -3.029 -21.525 15.288 2350 HA ALA 2 HA ALA 2 -2.968 -24.439 15.448 2351 HB1 ALA 2 1HB ALA 2 -4.680 -23.498 13.920 2352 HB2 ALA 2 2HB ALA 2 -3.441 -24.473 13.056 2353 HB3 ALA 2 3HB ALA 2 -3.389 -22.681 12.972 2354 H ASP 3 H ASP 3 -1.334 -21.828 13.480 2355 HA ASP 3 HA ASP 3 1.224 -23.130 13.912 2356 HB2 ASP 3 2HB ASP 3 -0.001 -24.703 12.320 2357 HB3 ASP 3 1HB ASP 3 -0.252 -23.361 11.177 2358 H HIS 4 H HIS 4 0.274 -21.704 10.896 2359 HA HIS 4 HA HIS 4 2.180 -19.729 10.973 2360 HB2 HIS 4 2HB HIS 4 0.793 -18.680 8.958 2361 HB3 HIS 4 1HB HIS 4 1.641 -20.234 8.807 2362 HD1 HIS 4 1HD HIS 4 -1.913 -19.304 10.061 2363 HD2 HIS 4 2HD HIS 4 0.156 -22.363 8.053 2364 HE1 HIS 4 1HE HIS 4 -3.570 -21.062 9.556 2365 HE2 HIS 4 2HE HIS 4 -2.328 -22.966 8.492 2366 H GLU 5 H GLU 5 -0.989 -19.553 12.488 2367 HA GLU 5 HA GLU 5 -1.189 -16.723 12.419 2368 HB2 GLU 5 2HB GLU 5 -2.312 -18.652 14.551 2369 HB3 GLU 5 1HB GLU 5 -2.861 -16.989 14.166 2370 HG2 GLU 5 2HG GLU 5 -4.517 -18.411 13.218 2371 HG3 GLU 5 1HG GLU 5 -3.528 -17.882 11.814 2372 H ARG 6 H ARG 6 0.573 -19.135 14.421 2373 HA ARG 6 HA ARG 6 1.035 -17.230 16.534 2374 HB2 ARG 6 2HB ARG 6 1.071 -19.698 17.045 2375 HB3 ARG 6 1HB ARG 6 2.525 -19.867 16.004 2376 HG2 ARG 6 2HG ARG 6 3.764 -18.267 17.489 2377 HG3 ARG 6 1HG ARG 6 2.298 -18.069 18.509 2378 HD2 ARG 6 2HD ARG 6 2.476 -20.460 19.257 2379 HD3 ARG 6 1HD ARG 6 3.832 -20.719 18.078 2380 HE ARG 6 HE ARG 6 4.254 -18.450 19.979 2381 HH11 ARG 6 1HH2 ARG 6 4.846 -22.001 19.519 2382 HH12 ARG 6 2HH2 ARG 6 6.504 -21.887 19.928 2383 HH21 ARG 6 1HH1 ARG 6 6.267 -18.401 20.930 2384 HH22 ARG 6 2HH1 ARG 6 7.287 -19.808 21.057 2385 H GLU 7 H GLU 7 2.715 -18.443 13.641 2386 HA GLU 7 HA GLU 7 5.158 -17.159 14.072 2387 HB2 GLU 7 2HB GLU 7 4.784 -18.982 12.414 2388 HB3 GLU 7 1HB GLU 7 3.771 -17.890 11.412 2389 HG2 GLU 7 2HG GLU 7 5.672 -16.505 10.820 2390 HG3 GLU 7 1HG GLU 7 6.707 -17.250 12.097 2391 H ALA 8 H ALA 8 2.167 -16.116 12.418 2392 HA ALA 8 HA ALA 8 2.973 -13.633 11.550 2393 HB1 ALA 8 1HB ALA 8 0.773 -14.648 10.917 2394 HB2 ALA 8 2HB ALA 8 0.532 -13.010 11.632 2395 HB3 ALA 8 3HB ALA 8 0.197 -14.474 12.617 2396 H GLN 9 H GLN 9 1.563 -14.534 14.745 2397 HA GLN 9 HA GLN 9 1.431 -11.941 15.774 2398 HB2 GLN 9 2HB GLN 9 1.895 -14.615 17.237 2399 HB3 GLN 9 1HB GLN 9 1.622 -13.055 18.087 2400 HG2 GLN 9 2HG GLN 9 -0.616 -12.815 17.089 2401 HG3 GLN 9 1HG GLN 9 -0.404 -14.328 16.143 2402 HE21 GLN 9 1HE2 GLN 9 -2.568 -14.375 17.688 2403 HE22 GLN 9 2HE2 GLN 9 -2.346 -15.322 19.129 2404 H LYS 10 H LYS 10 4.151 -14.299 15.770 2405 HA LYS 10 HA LYS 10 5.804 -12.743 17.480 2406 HB2 LYS 10 2HB LYS 10 6.236 -15.155 17.075 2407 HB3 LYS 10 1HB LYS 10 6.647 -14.823 15.364 2408 HG2 LYS 10 2HG LYS 10 8.189 -13.446 17.646 2409 HG3 LYS 10 1HG LYS 10 8.508 -15.168 17.251 2410 HD2 LYS 10 2HD LYS 10 9.043 -14.587 14.896 2411 HD3 LYS 10 1HD LYS 10 8.849 -12.843 15.239 2412 HE2 LYS 10 2HE LYS 10 10.911 -14.686 16.622 2413 HE3 LYS 10 1HE LYS 10 11.256 -13.631 15.199 2414 HZ1 LYS 10 3HZ LYS 10 10.146 -12.325 17.620 2415 HZ2 LYS 10 1HZ LYS 10 11.262 -11.759 16.490 2416 HZ3 LYS 10 2HZ LYS 10 11.709 -12.912 17.658 2417 H ALA 11 H ALA 11 5.287 -12.824 13.951 2418 HA ALA 11 HA ALA 11 7.462 -11.216 13.266 2419 HB1 ALA 11 1HB ALA 11 6.298 -10.799 11.118 2420 HB2 ALA 11 2HB ALA 11 4.744 -11.376 11.822 2421 HB3 ALA 11 3HB ALA 11 6.107 -12.528 11.582 2422 H GLU 12 H GLU 12 4.119 -10.342 14.290 2423 HA GLU 12 HA GLU 12 4.360 -7.605 13.774 2424 HB2 GLU 12 2HB GLU 12 2.647 -8.921 15.973 2425 HB3 GLU 12 1HB GLU 12 2.504 -7.233 15.380 2426 HG2 GLU 12 2HG GLU 12 1.975 -8.207 13.044 2427 HG3 GLU 12 1HG GLU 12 1.856 -9.819 13.832 2428 H GLU 13 H GLU 13 5.369 -9.557 16.587 2429 HA GLU 13 HA GLU 13 5.943 -7.435 18.342 2430 HB2 GLU 13 2HB GLU 13 7.412 -10.141 18.140 2431 HB3 GLU 13 1HB GLU 13 7.410 -9.058 19.571 2432 HG2 GLU 13 2HG GLU 13 5.020 -9.620 20.016 2433 HG3 GLU 13 1HG GLU 13 4.954 -10.576 18.500 2434 H GLU 14 H GLU 14 7.668 -8.863 15.637 2435 HA GLU 14 HA GLU 14 10.261 -8.001 16.394 2436 HB2 GLU 14 2HB GLU 14 9.606 -10.005 14.861 2437 HB3 GLU 14 1HB GLU 14 9.309 -8.790 13.583 2438 HG2 GLU 14 2HG GLU 14 11.505 -9.674 13.183 2439 HG3 GLU 14 1HG GLU 14 11.760 -8.031 13.868 2440 H LEU 15 H LEU 15 7.635 -6.781 14.303 2441 HA LEU 15 HA LEU 15 9.079 -4.786 13.044 2442 HB2 LEU 15 2HB LEU 15 6.800 -5.536 12.335 2443 HB3 LEU 15 1HB LEU 15 6.085 -4.764 13.784 2444 HG LEU 15 HG LEU 15 6.689 -2.528 12.963 2445 HD11 LEU 15 1HD1 LEU 15 8.875 -2.875 11.911 2446 HD12 LEU 15 2HD1 LEU 15 7.770 -2.218 10.672 2447 HD13 LEU 15 3HD1 LEU 15 8.167 -3.974 10.670 2448 HD21 LEU 15 3HD2 LEU 15 4.573 -3.545 12.138 2449 HD22 LEU 15 1HD2 LEU 15 5.429 -4.234 10.712 2450 HD23 LEU 15 2HD2 LEU 15 5.280 -2.450 10.899 2451 H GLN 16 H GLN 16 7.198 -4.696 16.064 2452 HA GLN 16 HA GLN 16 7.476 -2.009 16.666 2453 HB2 GLN 16 2HB GLN 16 7.339 -4.435 18.544 2454 HB3 GLN 16 1HB GLN 16 7.157 -2.748 19.101 2455 HG2 GLN 16 2HG GLN 16 5.286 -4.189 17.085 2456 HG3 GLN 16 1HG GLN 16 4.952 -3.947 18.831 2457 HE21 GLN 16 1HE2 GLN 16 5.901 -1.237 19.144 2458 HE22 GLN 16 2HE2 GLN 16 4.851 -0.198 18.232 2459 H LYS 17 H LYS 17 9.842 -4.622 17.019 2460 HA LYS 17 HA LYS 17 11.485 -3.270 18.915 2461 HB2 LYS 17 2HB LYS 17 11.525 -5.765 18.572 2462 HB3 LYS 17 1HB LYS 17 12.146 -5.501 16.911 2463 HG2 LYS 17 2HG LYS 17 14.258 -4.493 17.863 2464 HG3 LYS 17 1HG LYS 17 13.595 -4.711 19.518 2465 HD2 LYS 17 2HD LYS 17 15.153 -6.530 19.091 2466 HD3 LYS 17 1HD LYS 17 13.481 -7.190 19.123 2467 HE2 LYS 17 2HE LYS 17 13.534 -7.040 16.502 2468 HE3 LYS 17 1HE LYS 17 15.303 -6.710 16.646 2469 HZ1 LYS 17 3HZ LYS 17 13.992 -9.053 17.924 2470 HZ2 LYS 17 1HZ LYS 17 15.644 -8.886 17.464 2471 HZ3 LYS 17 2HZ LYS 17 14.386 -9.050 16.297 2472 H VAL 18 H VAL 18 11.371 -3.523 15.335 2473 HA VAL 18 HA VAL 18 13.821 -2.244 14.861 2474 HB VAL 18 HB VAL 18 11.335 -2.397 13.065 2475 HG11 VAL 18 1HG1 VAL 18 13.024 -2.150 11.194 2476 HG12 VAL 18 2HG1 VAL 18 14.321 -1.868 12.416 2477 HG13 VAL 18 3HG1 VAL 18 12.970 -0.688 12.235 2478 HG21 VAL 18 3HG2 VAL 18 13.783 -4.274 13.388 2479 HG22 VAL 18 1HG2 VAL 18 12.537 -4.407 12.092 2480 HG23 VAL 18 2HG2 VAL 18 12.076 -4.673 13.801 2481 H LEU 19 H LEU 19 10.504 -1.055 15.388 2482 HA LEU 19 HA LEU 19 10.877 1.588 14.609 2483 HB2 LEU 19 2HB LEU 19 9.155 0.678 16.997 2484 HB3 LEU 19 1HB LEU 19 8.961 2.167 16.031 2485 HG LEU 19 HG LEU 19 8.460 -0.734 15.181 2486 HD11 LEU 19 1HD1 LEU 19 6.715 0.302 16.628 2487 HD12 LEU 19 2HD1 LEU 19 6.096 -0.073 14.976 2488 HD13 LEU 19 3HD1 LEU 19 6.501 1.624 15.427 2489 HD21 LEU 19 3HD2 LEU 19 9.384 0.410 13.182 2490 HD22 LEU 19 1HD2 LEU 19 8.175 1.742 13.374 2491 HD23 LEU 19 2HD2 LEU 19 7.635 0.060 13.008 2492 H GLU 20 H GLU 20 11.620 -0.081 17.666 2493 HA GLU 20 HA GLU 20 12.216 2.377 19.025 2494 HB2 GLU 20 2HB GLU 20 12.533 -0.543 19.914 2495 HB3 GLU 20 1HB GLU 20 12.862 0.898 20.931 2496 HG2 GLU 20 2HG GLU 20 10.442 1.652 20.532 2497 HG3 GLU 20 1HG GLU 20 10.127 0.067 19.743 2498 H GLU 21 H GLU 21 14.002 0.126 17.020 2499 HA GLU 21 HA GLU 21 16.595 1.045 17.930 2500 HB2 GLU 21 2HB GLU 21 15.765 -0.188 15.201 2501 HB3 GLU 21 1HB GLU 21 17.428 0.261 15.691 2502 HG2 GLU 21 2HG GLU 21 17.273 -1.517 17.548 2503 HG3 GLU 21 1HG GLU 21 15.723 -2.048 16.779 2504 H ALA 22 H ALA 22 14.268 1.616 15.321 2505 HA ALA 22 HA ALA 22 15.669 3.385 13.788 2506 HB1 ALA 22 1HB ALA 22 13.530 2.259 13.069 2507 HB2 ALA 22 2HB ALA 22 13.468 4.042 12.808 2508 HB3 ALA 22 3HB ALA 22 12.613 3.300 14.211 2509 H SER 23 H SER 23 13.658 4.047 16.705 2510 HA SER 23 HA SER 23 13.463 6.791 16.320 2511 HB2 SER 23 2HB SER 23 13.164 6.750 18.933 2512 HB3 SER 23 1HB SER 23 12.002 5.808 17.930 2513 HG SER 23 1HG SER 23 12.995 4.695 19.797 2514 H LYS 24 H LYS 24 15.933 4.798 17.966 2515 HA LYS 24 HA LYS 24 17.395 7.022 18.947 2516 HB2 LYS 24 2HB LYS 24 17.606 4.678 19.896 2517 HB3 LYS 24 1HB LYS 24 18.410 4.165 18.375 2518 HG2 LYS 24 2HG LYS 24 20.234 5.886 18.821 2519 HG3 LYS 24 1HG LYS 24 19.410 6.306 20.362 2520 HD2 LYS 24 2HD LYS 24 19.850 4.027 21.254 2521 HD3 LYS 24 1HD LYS 24 20.455 3.489 19.649 2522 HE2 LYS 24 2HE LYS 24 22.384 3.924 21.151 2523 HE3 LYS 24 1HE LYS 24 22.370 5.102 19.781 2524 HZ1 LYS 24 3HZ LYS 24 22.856 6.267 21.693 2525 HZ2 LYS 24 1HZ LYS 24 21.628 5.556 22.620 2526 HZ3 LYS 24 2HZ LYS 24 21.233 6.673 21.396 2527 H LYS 25 H LYS 25 17.767 4.867 16.111 2528 HA LYS 25 HA LYS 25 20.093 6.084 15.137 2529 HB2 LYS 25 2HB LYS 25 17.897 4.568 13.620 2530 HB3 LYS 25 1HB LYS 25 19.496 5.009 12.926 2531 HG2 LYS 25 2HG LYS 25 20.677 3.593 14.565 2532 HG3 LYS 25 1HG LYS 25 19.138 3.225 15.416 2533 HD2 LYS 25 2HD LYS 25 18.233 2.177 13.325 2534 HD3 LYS 25 1HD LYS 25 19.821 2.386 12.520 2535 HE2 LYS 25 2HE LYS 25 19.362 0.778 15.145 2536 HE3 LYS 25 1HE LYS 25 19.331 0.050 13.497 2537 HZ1 LYS 25 3HZ LYS 25 21.668 0.798 13.235 2538 HZ2 LYS 25 1HZ LYS 25 21.389 -0.308 14.496 2539 HZ3 LYS 25 2HZ LYS 25 21.654 1.284 14.894 2540 H ALA 26 H ALA 26 16.601 6.767 14.449 2541 HA ALA 26 HA ALA 26 17.018 8.540 12.380 2542 HB1 ALA 26 1HB ALA 26 14.762 7.612 12.881 2543 HB2 ALA 26 2HB ALA 26 14.727 9.405 12.845 2544 HB3 ALA 26 3HB ALA 26 14.715 8.535 14.431 2545 H VAL 27 H VAL 27 16.828 9.203 15.959 2546 HA VAL 27 HA VAL 27 16.929 12.003 15.556 2547 HB VAL 27 HB VAL 27 17.811 10.362 17.991 2548 HG11 VAL 27 1HG1 VAL 27 17.356 13.415 17.633 2549 HG12 VAL 27 2HG1 VAL 27 18.895 12.605 18.118 2550 HG13 VAL 27 3HG1 VAL 27 17.483 12.583 19.226 2551 HG21 VAL 27 3HG2 VAL 27 15.227 11.944 17.332 2552 HG22 VAL 27 1HG2 VAL 27 15.572 11.036 18.852 2553 HG23 VAL 27 2HG2 VAL 27 15.379 10.160 17.299 2554 H GLU 28 H GLU 28 19.491 9.529 16.097 2555 HA GLU 28 HA GLU 28 21.557 11.472 16.190 2556 HB2 GLU 28 2HB GLU 28 21.705 8.488 15.516 2557 HB3 GLU 28 1HB GLU 28 23.101 9.512 15.958 2558 HG2 GLU 28 2HG GLU 28 20.698 8.908 17.836 2559 HG3 GLU 28 1HG GLU 28 22.221 7.966 17.778 2560 H ALA 29 H ALA 29 19.898 9.794 13.590 2561 HA ALA 29 HA ALA 29 21.779 10.231 11.531 2562 HB1 ALA 29 1HB ALA 29 18.717 9.785 11.324 2563 HB2 ALA 29 2HB ALA 29 19.909 8.461 11.437 2564 HB3 ALA 29 3HB ALA 29 19.922 9.526 10.039 2565 H GLU 30 H GLU 30 18.588 11.763 12.339 2566 HA GLU 30 HA GLU 30 18.813 13.812 10.467 2567 HB2 GLU 30 2HB GLU 30 17.161 13.406 12.985 2568 HB3 GLU 30 1HB GLU 30 17.072 14.972 12.129 2569 HG2 GLU 30 2HG GLU 30 16.644 12.409 10.510 2570 HG3 GLU 30 1HG GLU 30 15.337 13.032 11.576 2571 H ARG 31 H ARG 31 20.030 13.621 13.840 2572 HA ARG 31 HA ARG 31 20.581 16.404 14.008 2573 HB2 ARG 31 2HB ARG 31 21.804 13.986 15.432 2574 HB3 ARG 31 1HB ARG 31 22.466 15.619 15.700 2575 HG2 ARG 31 2HG ARG 31 19.613 14.712 16.380 2576 HG3 ARG 31 1HG ARG 31 20.971 14.972 17.516 2577 HD2 ARG 31 2HD ARG 31 19.400 17.089 15.914 2578 HD3 ARG 31 1HD ARG 31 19.505 16.876 17.704 2579 HE ARG 31 HE ARG 31 22.050 17.480 16.184 2580 HH11 ARG 31 1HH2 ARG 31 19.744 18.724 18.647 2581 HH12 ARG 31 2HH2 ARG 31 19.948 20.376 18.213 2582 HH21 ARG 31 1HH1 ARG 31 22.612 19.707 15.885 2583 HH22 ARG 31 2HH1 ARG 31 21.851 20.961 16.777 2584 H GLY 32 H GLY 32 21.681 17.317 12.316 2585 HA2 GLY 32 2HA GLY 32 24.133 17.859 12.102 2586 HA3 GLY 32 1HA GLY 32 24.259 16.136 11.554 2587 H ALA 33 H ALA 33 21.417 16.288 10.509 2588 HA ALA 33 HA ALA 33 22.331 16.773 7.903 2589 HB1 ALA 33 1HB ALA 33 19.513 16.044 8.911 2590 HB2 ALA 33 2HB ALA 33 20.786 14.874 8.415 2591 HB3 ALA 33 3HB ALA 33 20.044 15.977 7.194 2592 HA PRO 34 HA PRO 34 20.603 20.866 7.654 2593 HB2 PRO 34 2HB PRO 34 20.545 21.302 4.886 2594 HB3 PRO 34 1HB PRO 34 22.076 21.245 5.846 2595 HG2 PRO 34 2HG PRO 34 20.783 18.986 4.228 2596 HG3 PRO 34 1HG PRO 34 22.517 19.517 4.214 2597 HD2 PRO 34 2HD PRO 34 21.605 17.375 5.742 2598 HD3 PRO 34 1HD PRO 34 22.926 18.474 6.355 2599 H GLY 35 H GLY 35 18.510 21.743 7.678 2600 HA2 GLY 35 2HA GLY 35 16.384 22.055 7.085 2601 HA3 GLY 35 1HA GLY 35 16.564 20.811 5.789 2602 H ALA 36 H ALA 36 17.601 19.769 8.888 2603 HA ALA 36 HA ALA 36 15.930 17.631 8.925 2604 HB1 ALA 36 1HB ALA 36 17.347 18.857 11.367 2605 HB2 ALA 36 2HB ALA 36 18.091 17.707 10.186 2606 HB3 ALA 36 3HB ALA 36 16.728 17.166 11.214 2607 H ALA 37 H ALA 37 14.276 16.935 10.283 2608 HA ALA 37 HA ALA 37 12.494 19.137 11.208 2609 HB1 ALA 37 1HB ALA 37 10.574 17.752 10.324 2610 HB2 ALA 37 2HB ALA 37 11.762 16.550 9.675 2611 HB3 ALA 37 3HB ALA 37 11.705 18.210 8.994 2612 H LEU 38 H LEU 38 13.686 15.732 11.540 2613 HA LEU 38 HA LEU 38 12.001 15.483 13.962 2614 HB2 LEU 38 2HB LEU 38 11.587 13.724 12.217 2615 HB3 LEU 38 1HB LEU 38 13.328 13.349 12.217 2616 HG LEU 38 HG LEU 38 13.177 12.626 14.629 2617 HD11 LEU 38 1HD1 LEU 38 11.011 12.209 15.719 2618 HD12 LEU 38 2HD1 LEU 38 10.115 12.865 14.318 2619 HD13 LEU 38 3HD1 LEU 38 11.130 13.954 15.337 2620 HD21 LEU 38 3HD2 LEU 38 11.329 11.177 12.653 2621 HD22 LEU 38 1HD2 LEU 38 12.039 10.460 14.150 2622 HD23 LEU 38 2HD2 LEU 38 13.108 10.999 12.803 2623 H ILE 39 H ILE 39 13.428 16.541 15.488 2624 HA ILE 39 HA ILE 39 15.898 14.984 15.934 2625 HB ILE 39 HB ILE 39 16.989 17.198 16.575 2626 HG12 ILE 39 2HG1 ILE 39 14.745 18.370 14.782 2627 HG13 ILE 39 1HG1 ILE 39 14.843 18.575 16.567 2628 HG21 ILE 39 1HG2 ILE 39 17.755 17.551 14.234 2629 HG22 ILE 39 2HG2 ILE 39 16.295 16.720 13.599 2630 HG23 ILE 39 3HG2 ILE 39 17.513 15.795 14.536 2631 HD11 ILE 39 3HD ILE 39 16.909 19.586 14.494 2632 HD12 ILE 39 1HD ILE 39 15.748 20.578 15.433 2633 HD13 ILE 39 2HD ILE 39 17.087 19.725 16.286 2634 H SER 40 H SER 40 13.848 14.102 17.424 2635 HA SER 40 HA SER 40 14.442 15.268 20.012 2636 HB2 SER 40 2HB SER 40 12.452 16.630 19.290 2637 HB3 SER 40 1HB SER 40 11.615 15.134 18.762 2638 HG SER 40 1HG SER 40 10.785 15.535 20.665 2639 H TYR 41 H TYR 41 14.492 13.544 21.459 2640 HA TYR 41 HA TYR 41 14.097 10.903 20.468 2641 HB2 TYR 41 2HB TYR 41 15.037 12.047 23.126 2642 HB3 TYR 41 1HB TYR 41 14.356 10.389 23.120 2643 HD1 TYR 41 2HD TYR 41 15.381 8.566 21.930 2644 HD2 TYR 41 1HD TYR 41 17.232 12.446 21.957 2645 HE1 TYR 41 2HE TYR 41 17.499 7.553 21.220 2646 HE2 TYR 41 1HE TYR 41 19.353 11.442 21.196 2647 HH TYR 41 HH TYR 41 20.400 9.460 20.365 2648 HA PRO 42 HA PRO 42 10.255 10.719 23.046 2649 HB2 PRO 42 2HB PRO 42 8.724 13.164 23.344 2650 HB3 PRO 42 1HB PRO 42 9.608 12.252 24.633 2651 HG2 PRO 42 2HG PRO 42 10.519 14.654 23.000 2652 HG3 PRO 42 1HG PRO 42 10.862 14.283 24.738 2653 HD2 PRO 42 2HD PRO 42 12.738 13.886 22.776 2654 HD3 PRO 42 1HD PRO 42 12.580 12.682 24.136 2655 H ASP 43 H ASP 43 10.452 13.155 20.429 2656 HA ASP 43 HA ASP 43 7.921 12.255 19.372 2657 HB2 ASP 43 2HB ASP 43 9.950 14.107 18.008 2658 HB3 ASP 43 1HB ASP 43 8.264 13.766 17.493 2659 H ALA 44 H ALA 44 11.252 11.309 19.149 2660 HA ALA 44 HA ALA 44 11.452 10.342 16.601 2661 HB1 ALA 44 1HB ALA 44 13.225 8.839 17.407 2662 HB2 ALA 44 2HB ALA 44 12.640 8.991 19.114 2663 HB3 ALA 44 3HB ALA 44 13.347 10.399 18.264 2664 H ILE 45 H ILE 45 10.196 8.693 19.492 2665 HA ILE 45 HA ILE 45 9.826 6.226 18.088 2666 HB ILE 45 HB ILE 45 10.555 6.357 20.413 2667 HG12 ILE 45 2HG1 ILE 45 7.885 4.867 20.136 2668 HG13 ILE 45 1HG1 ILE 45 9.459 4.322 19.480 2669 HG21 ILE 45 1HG2 ILE 45 8.963 6.985 22.237 2670 HG22 ILE 45 2HG2 ILE 45 7.694 7.366 21.030 2671 HG23 ILE 45 3HG2 ILE 45 9.180 8.371 21.115 2672 HD11 ILE 45 3HD ILE 45 8.800 4.761 22.476 2673 HD12 ILE 45 1HD ILE 45 9.020 3.190 21.630 2674 HD13 ILE 45 2HD ILE 45 10.423 4.300 21.827 2675 H TRP 46 H TRP 46 8.048 9.139 18.270 2676 HA TRP 46 HA TRP 46 5.476 7.801 17.932 2677 HB2 TRP 46 2HB TRP 46 6.229 10.244 19.107 2678 HB3 TRP 46 1HB TRP 46 5.601 10.777 17.527 2679 HD1 TRP 46 HD TRP 46 3.088 11.505 17.970 2680 HE1 TRP 46 1HE TRP 46 1.389 11.036 19.810 2681 HE3 TRP 46 3HE TRP 46 5.466 7.631 20.293 2682 HZ2 TRP 46 2HZ TRP 46 0.853 8.931 21.710 2683 HZ3 TRP 46 3HZ TRP 46 4.317 6.422 22.109 2684 HH2 TRP 46 HH TRP 46 2.036 7.066 22.814 2685 H TRP 47 H TRP 47 8.025 9.555 16.165 2686 HA TRP 47 HA TRP 47 6.573 9.614 13.727 2687 HB2 TRP 47 2HB TRP 47 8.461 11.188 14.198 2688 HB3 TRP 47 1HB TRP 47 9.609 9.801 14.173 2689 HD1 TRP 47 HD TRP 47 7.364 11.922 11.749 2690 HE1 TRP 47 1HE TRP 47 7.950 11.291 9.311 2691 HE3 TRP 47 3HE TRP 47 10.731 8.220 12.719 2692 HZ2 TRP 47 2HZ TRP 47 9.571 9.357 7.992 2693 HZ3 TRP 47 3HZ TRP 47 11.784 7.011 10.828 2694 HH2 TRP 47 HH TRP 47 11.187 7.556 8.497 2695 H SER 48 H SER 48 8.954 7.270 15.245 2696 HA SER 48 HA SER 48 8.934 5.714 12.869 2697 HB2 SER 48 2HB SER 48 10.143 3.954 14.214 2698 HB3 SER 48 1HB SER 48 10.961 5.540 14.010 2699 HG SER 48 1HG SER 48 10.811 4.417 16.176 2700 H VAL 49 H VAL 49 6.434 5.972 13.050 2701 HA VAL 49 HA VAL 49 5.435 3.325 13.861 2702 HB VAL 49 HB VAL 49 3.897 5.984 14.143 2703 HG11 VAL 49 1HG1 VAL 49 3.072 3.048 14.739 2704 HG12 VAL 49 2HG1 VAL 49 2.417 4.072 13.409 2705 HG13 VAL 49 3HG1 VAL 49 2.093 4.507 15.122 2706 HG21 VAL 49 3HG2 VAL 49 3.914 5.429 16.603 2707 HG22 VAL 49 1HG2 VAL 49 5.563 5.720 15.966 2708 HG23 VAL 49 2HG2 VAL 49 5.016 4.037 16.270 2709 H GLU 50 H GLU 50 4.537 6.387 12.082 2710 HA GLU 50 HA GLU 50 2.990 4.969 10.252 2711 HB2 GLU 50 2HB GLU 50 3.266 7.304 8.934 2712 HB3 GLU 50 1HB GLU 50 2.199 7.109 10.351 2713 HG2 GLU 50 2HG GLU 50 3.812 8.150 11.868 2714 HG3 GLU 50 1HG GLU 50 5.084 8.193 10.594 2715 H THR 51 H THR 51 6.403 5.649 10.295 2716 HA THR 51 HA THR 51 6.815 5.380 7.541 2717 HB THR 51 HB THR 51 8.386 6.480 9.059 2718 HG1 THR 51 1HG THR 51 9.269 4.324 7.486 2719 HG21 THR 51 3HG2 THR 51 9.055 3.644 10.117 2720 HG22 THR 51 1HG2 THR 51 8.168 4.923 11.024 2721 HG23 THR 51 2HG2 THR 51 9.880 5.185 10.542 2722 H ALA 52 H ALA 52 6.210 2.959 10.081 2723 HA ALA 52 HA ALA 52 7.417 0.814 8.551 2724 HB1 ALA 52 1HB ALA 52 5.591 0.797 11.042 2725 HB2 ALA 52 2HB ALA 52 7.394 0.650 11.019 2726 HB3 ALA 52 3HB ALA 52 6.376 -0.652 10.309 2727 H THR 53 H THR 53 4.240 2.423 8.909 2728 HA THR 53 HA THR 53 2.991 0.279 7.392 2729 HB THR 53 HB THR 53 0.936 1.757 7.686 2730 HG1 THR 53 1HG THR 53 1.875 3.682 8.190 2731 HG21 THR 53 3HG2 THR 53 0.683 1.047 10.076 2732 HG22 THR 53 1HG2 THR 53 2.460 0.775 10.211 2733 HG23 THR 53 2HG2 THR 53 1.469 -0.252 9.108 2734 H THR 54 H THR 54 5.078 2.659 6.611 2735 HA THR 54 HA THR 54 5.557 3.865 4.866 2736 HB THR 54 HB THR 54 5.081 2.712 2.598 2737 HG1 THR 54 1HG THR 54 3.246 1.536 3.444 2738 HG21 THR 54 3HG2 THR 54 7.145 2.491 4.000 2739 HG22 THR 54 1HG2 THR 54 6.733 0.942 3.178 2740 HG23 THR 54 2HG2 THR 54 6.389 1.142 4.934 2741 H VAL 55 H VAL 55 3.061 4.695 6.096 2742 HA VAL 55 HA VAL 55 1.321 5.314 3.860 2743 HB VAL 55 HB VAL 55 0.314 4.490 5.878 2744 HG11 VAL 55 1HG1 VAL 55 2.139 5.451 7.482 2745 HG12 VAL 55 2HG1 VAL 55 0.458 5.513 8.048 2746 HG13 VAL 55 3HG1 VAL 55 1.229 7.002 7.411 2747 HG21 VAL 55 3HG2 VAL 55 -1.445 6.223 6.137 2748 HG22 VAL 55 1HG2 VAL 55 -0.892 6.135 4.421 2749 HG23 VAL 55 2HG2 VAL 55 -0.345 7.485 5.459 2750 H GLY 56 H GLY 56 3.219 7.097 6.363 2751 HA2 GLY 56 2HA GLY 56 4.264 9.036 6.211 2752 HA3 GLY 56 1HA GLY 56 4.064 8.978 4.413 2753 H TYR 57 H TYR 57 2.372 9.823 7.539 2754 HA TYR 57 HA TYR 57 0.171 10.804 5.956 2755 HB2 TYR 57 2HB TYR 57 0.356 9.923 8.628 2756 HB3 TYR 57 1HB TYR 57 0.224 11.703 8.849 2757 HD1 TYR 57 1HD TYR 57 -1.738 12.913 7.614 2758 HD2 TYR 57 2HD TYR 57 -1.451 8.625 7.852 2759 HE1 TYR 57 1HE TYR 57 -4.056 12.716 6.814 2760 HE2 TYR 57 2HE TYR 57 -3.776 8.432 7.090 2761 HH TYR 57 HH TYR 57 -5.709 11.280 6.053 2762 H GLY 58 H GLY 58 3.101 12.036 7.225 2763 HA2 GLY 58 2HA GLY 58 4.012 13.914 6.183 2764 HA3 GLY 58 1HA GLY 58 2.390 14.696 6.130 2765 H ASP 59 H ASP 59 3.772 12.965 8.921 2766 HA ASP 59 HA ASP 59 3.516 15.160 10.678 2767 HB2 ASP 59 2HB ASP 59 3.740 12.707 11.403 2768 HB3 ASP 59 1HB ASP 59 5.436 12.712 10.939 2769 H ARG 60 H ARG 60 6.443 13.509 9.299 2770 HA ARG 60 HA ARG 60 7.822 15.942 8.855 2771 HB2 ARG 60 2HB ARG 60 8.878 13.828 10.856 2772 HB3 ARG 60 1HB ARG 60 9.891 15.153 10.189 2773 HG2 ARG 60 2HG ARG 60 8.670 16.841 11.469 2774 HG3 ARG 60 1HG ARG 60 7.352 15.683 11.785 2775 HD2 ARG 60 2HD ARG 60 9.363 14.242 12.912 2776 HD3 ARG 60 1HD ARG 60 10.015 15.903 13.214 2777 HE ARG 60 HE ARG 60 7.253 14.831 13.879 2778 HH11 ARG 60 1HH2 ARG 60 9.876 17.247 14.575 2779 HH12 ARG 60 2HH2 ARG 60 9.259 17.784 16.062 2780 HH21 ARG 60 1HH1 ARG 60 6.254 15.748 15.796 2781 HH22 ARG 60 2HH1 ARG 60 7.008 16.945 16.760 2782 H TYR 61 H TYR 61 10.199 14.954 8.002 2783 HA TYR 61 HA TYR 61 9.905 12.287 7.088 2784 HB2 TYR 61 2HB TYR 61 10.623 12.977 4.695 2785 HB3 TYR 61 1HB TYR 61 8.893 13.197 5.126 2786 HD1 TYR 61 1HD TYR 61 12.126 15.047 4.654 2787 HD2 TYR 61 2HD TYR 61 7.860 15.312 5.116 2788 HE1 TYR 61 1HE TYR 61 12.220 17.423 4.048 2789 HE2 TYR 61 2HE TYR 61 7.944 17.704 4.529 2790 HH TYR 61 HH TYR 61 11.039 19.347 3.703 2791 HA PRO 62 HA PRO 62 14.128 13.330 8.095 2792 HB2 PRO 62 2HB PRO 62 14.880 10.729 6.650 2793 HB3 PRO 62 1HB PRO 62 15.353 11.279 8.307 2794 HG2 PRO 62 2HG PRO 62 13.427 9.384 8.016 2795 HG3 PRO 62 1HG PRO 62 13.178 10.739 9.192 2796 HD2 PRO 62 2HD PRO 62 12.060 10.539 6.325 2797 HD3 PRO 62 1HD PRO 62 11.231 10.992 7.884 2798 H VAL 63 H VAL 63 16.300 13.840 7.048 2799 HA VAL 63 HA VAL 63 15.806 14.484 4.223 2800 HB VAL 63 HB VAL 63 18.084 15.732 5.737 2801 HG11 VAL 63 1HG1 VAL 63 16.061 16.701 3.573 2802 HG12 VAL 63 2HG1 VAL 63 17.737 16.183 3.193 2803 HG13 VAL 63 3HG1 VAL 63 17.459 17.635 4.210 2804 HG21 VAL 63 3HG2 VAL 63 16.191 16.011 7.286 2805 HG22 VAL 63 1HG2 VAL 63 15.080 16.435 5.935 2806 HG23 VAL 63 2HG2 VAL 63 16.429 17.536 6.391 2807 H THR 64 H THR 64 18.832 14.895 3.919 2808 HA THR 64 HA THR 64 19.042 12.436 2.512 2809 HB THR 64 HB THR 64 20.989 14.810 2.539 2810 HG1 THR 64 1HG THR 64 18.561 14.500 1.099 2811 HG21 THR 64 3HG2 THR 64 20.236 12.846 0.263 2812 HG22 THR 64 1HG2 THR 64 21.747 12.778 1.242 2813 HG23 THR 64 2HG2 THR 64 21.421 14.197 0.187 2814 H GLU 65 H GLU 65 21.124 14.267 4.831 2815 HA GLU 65 HA GLU 65 23.040 12.119 4.775 2816 HB2 GLU 65 2HB GLU 65 23.532 14.733 4.744 2817 HB3 GLU 65 1HB GLU 65 23.346 14.589 6.526 2818 HG2 GLU 65 2HG GLU 65 25.113 12.666 6.380 2819 HG3 GLU 65 1HG GLU 65 25.339 13.120 4.656 2820 H GLU 66 H GLU 66 20.208 12.146 6.157 2821 HA GLU 66 HA GLU 66 20.921 11.248 8.775 2822 HB2 GLU 66 2HB GLU 66 18.617 10.876 9.101 2823 HB3 GLU 66 1HB GLU 66 18.626 12.225 7.980 2824 HG2 GLU 66 2HG GLU 66 17.087 11.063 6.851 2825 HG3 GLU 66 1HG GLU 66 18.420 10.136 6.141 2826 H GLY 67 H GLY 67 20.722 10.256 5.481 2827 HA2 GLY 67 2HA GLY 67 21.607 8.463 4.420 2828 HA3 GLY 67 1HA GLY 67 21.742 7.576 6.019 2829 H ARG 68 H ARG 68 19.405 8.906 3.590 2830 HA ARG 68 HA ARG 68 17.061 8.415 4.825 2831 HB2 ARG 68 2HB ARG 68 17.177 9.670 2.751 2832 HB3 ARG 68 1HB ARG 68 17.715 8.220 1.834 2833 HG2 ARG 68 2HG ARG 68 15.558 7.161 2.018 2834 HG3 ARG 68 1HG ARG 68 14.994 8.293 3.258 2835 HD2 ARG 68 2HD ARG 68 15.401 8.778 0.240 2836 HD3 ARG 68 1HD ARG 68 13.850 8.793 1.148 2837 HE ARG 68 HE ARG 68 15.084 11.042 0.465 2838 HH11 ARG 68 1HH2 ARG 68 14.822 9.864 3.879 2839 HH12 ARG 68 2HH2 ARG 68 14.285 11.398 4.425 2840 HH21 ARG 68 1HH1 ARG 68 14.394 13.125 1.348 2841 HH22 ARG 68 2HH1 ARG 68 14.124 13.189 3.051 2842 H LYS 69 H LYS 69 19.250 6.133 3.716 2843 HA LYS 69 HA LYS 69 17.798 3.829 3.314 2844 HB2 LYS 69 2HB LYS 69 20.305 4.294 2.916 2845 HB3 LYS 69 1HB LYS 69 20.545 4.155 4.688 2846 HG2 LYS 69 2HG LYS 69 21.229 2.107 3.518 2847 HG3 LYS 69 1HG LYS 69 19.826 1.755 4.584 2848 HD2 LYS 69 2HD LYS 69 18.273 1.815 2.686 2849 HD3 LYS 69 1HD LYS 69 19.558 2.302 1.544 2850 HE2 LYS 69 2HE LYS 69 19.503 -0.363 3.133 2851 HE3 LYS 69 1HE LYS 69 18.847 -0.159 1.463 2852 HZ1 LYS 69 3HZ LYS 69 20.878 -0.090 0.571 2853 HZ2 LYS 69 1HZ LYS 69 21.305 -0.933 2.012 2854 HZ3 LYS 69 2HZ LYS 69 21.612 0.727 1.836 2855 H VAL 70 H VAL 70 18.486 5.598 6.360 2856 HA VAL 70 HA VAL 70 18.052 3.387 8.081 2857 HB VAL 70 HB VAL 70 17.897 6.407 8.541 2858 HG11 VAL 70 1HG1 VAL 70 17.857 4.083 10.600 2859 HG12 VAL 70 2HG1 VAL 70 16.522 5.257 10.268 2860 HG13 VAL 70 3HG1 VAL 70 18.053 5.844 10.981 2861 HG21 VAL 70 3HG2 VAL 70 20.131 6.095 9.577 2862 HG22 VAL 70 1HG2 VAL 70 20.172 5.543 7.879 2863 HG23 VAL 70 2HG2 VAL 70 20.096 4.323 9.209 2864 H ALA 71 H ALA 71 15.995 6.205 7.046 2865 HA ALA 71 HA ALA 71 13.618 5.230 8.046 2866 HB1 ALA 71 1HB ALA 71 14.011 6.803 5.422 2867 HB2 ALA 71 2HB ALA 71 13.983 7.532 7.060 2868 HB3 ALA 71 3HB ALA 71 12.503 6.729 6.417 2869 H GLU 72 H GLU 72 15.075 4.649 4.806 2870 HA GLU 72 HA GLU 72 13.126 3.201 3.557 2871 HB2 GLU 72 2HB GLU 72 15.428 3.737 2.475 2872 HB3 GLU 72 1HB GLU 72 16.109 2.399 3.447 2873 HG2 GLU 72 2HG GLU 72 14.125 0.990 2.171 2874 HG3 GLU 72 1HG GLU 72 14.333 2.300 0.974 2875 H GLN 73 H GLN 73 15.621 1.980 5.805 2876 HA GLN 73 HA GLN 73 15.100 -0.709 5.408 2877 HB2 GLN 73 2HB GLN 73 17.160 0.316 6.537 2878 HB3 GLN 73 1HB GLN 73 16.169 0.567 8.007 2879 HG2 GLN 73 2HG GLN 73 15.799 -1.933 8.156 2880 HG3 GLN 73 1HG GLN 73 16.739 -2.146 6.630 2881 HE21 GLN 73 1HE2 GLN 73 17.889 -3.650 8.235 2882 HE22 GLN 73 2HE2 GLN 73 19.213 -3.000 9.153 2883 H VAL 74 H VAL 74 13.597 1.639 7.629 2884 HA VAL 74 HA VAL 74 12.291 -0.356 9.203 2885 HB VAL 74 HB VAL 74 11.639 2.630 8.951 2886 HG11 VAL 74 1HG1 VAL 74 11.056 0.524 11.165 2887 HG12 VAL 74 2HG1 VAL 74 9.833 1.306 10.097 2888 HG13 VAL 74 3HG1 VAL 74 10.734 2.293 11.300 2889 HG21 VAL 74 3HG2 VAL 74 13.561 1.177 10.902 2890 HG22 VAL 74 1HG2 VAL 74 13.151 2.936 10.881 2891 HG23 VAL 74 2HG2 VAL 74 14.075 2.224 9.538 2892 H MET 75 H MET 75 11.468 1.713 6.432 2893 HA MET 75 HA MET 75 8.737 1.207 6.245 2894 HB2 MET 75 2HB MET 75 10.871 1.695 4.068 2895 HB3 MET 75 1HB MET 75 9.124 1.720 3.738 2896 HG2 MET 75 2HG MET 75 8.770 3.675 5.094 2897 HG3 MET 75 1HG MET 75 10.377 3.546 5.858 2898 HE1 MET 75 3HE MET 75 10.702 5.994 5.583 2899 HE2 MET 75 1HE MET 75 9.110 6.122 4.779 2900 HE3 MET 75 2HE MET 75 10.544 6.917 4.044 2901 H LYS 76 H LYS 76 11.496 -0.445 4.656 2902 HA LYS 76 HA LYS 76 9.908 -2.346 3.354 2903 HB2 LYS 76 2HB LYS 76 12.303 -1.830 2.745 2904 HB3 LYS 76 1HB LYS 76 12.845 -2.672 4.233 2905 HG2 LYS 76 2HG LYS 76 11.893 -4.834 3.362 2906 HG3 LYS 76 1HG LYS 76 11.214 -3.963 1.946 2907 HD2 LYS 76 2HD LYS 76 13.562 -3.304 1.281 2908 HD3 LYS 76 1HD LYS 76 14.220 -4.335 2.589 2909 HE2 LYS 76 2HE LYS 76 12.394 -5.391 0.291 2910 HE3 LYS 76 1HE LYS 76 14.195 -5.321 0.208 2911 HZ1 LYS 76 3HZ LYS 76 13.814 -7.386 0.787 2912 HZ2 LYS 76 1HZ LYS 76 12.518 -7.161 1.860 2913 HZ3 LYS 76 2HZ LYS 76 14.124 -6.767 2.317 2914 H ALA 77 H ALA 77 11.419 -2.346 6.587 2915 HA ALA 77 HA ALA 77 11.087 -5.045 7.162 2916 HB1 ALA 77 1HB ALA 77 12.468 -3.492 8.597 2917 HB2 ALA 77 2HB ALA 77 11.251 -4.396 9.573 2918 HB3 ALA 77 3HB ALA 77 10.957 -2.674 9.134 2919 H GLY 78 H GLY 78 8.798 -2.315 7.422 2920 HA2 GLY 78 2HA GLY 78 6.837 -3.721 8.902 2921 HA3 GLY 78 1HA GLY 78 6.636 -2.244 7.884 2922 H ILE 79 H ILE 79 7.312 -3.148 5.399 2923 HA ILE 79 HA ILE 79 4.984 -4.391 4.548 2924 HB ILE 79 HB ILE 79 7.674 -4.215 3.097 2925 HG12 ILE 79 2HG1 ILE 79 5.232 -2.318 3.030 2926 HG13 ILE 79 1HG1 ILE 79 6.763 -1.977 3.878 2927 HG21 ILE 79 1HG2 ILE 79 6.121 -5.899 2.039 2928 HG22 ILE 79 2HG2 ILE 79 6.275 -4.451 1.007 2929 HG23 ILE 79 3HG2 ILE 79 4.803 -4.671 2.015 2930 HD11 ILE 79 3HD ILE 79 6.433 -2.315 0.823 2931 HD12 ILE 79 1HD ILE 79 6.748 -0.801 1.731 2932 HD13 ILE 79 2HD ILE 79 8.009 -2.087 1.676 2933 H GLU 80 H GLU 80 8.294 -5.716 5.008 2934 HA GLU 80 HA GLU 80 7.857 -8.300 4.153 2935 HB2 GLU 80 2HB GLU 80 9.661 -7.178 6.369 2936 HB3 GLU 80 1HB GLU 80 9.785 -8.876 5.819 2937 HG2 GLU 80 2HG GLU 80 10.074 -6.518 3.850 2938 HG3 GLU 80 1HG GLU 80 11.452 -7.129 4.833 2939 H VAL 81 H VAL 81 7.315 -6.891 7.407 2940 HA VAL 81 HA VAL 81 6.741 -9.335 8.685 2941 HB VAL 81 HB VAL 81 6.267 -6.397 9.322 2942 HG11 VAL 81 1HG1 VAL 81 5.287 -8.811 10.985 2943 HG12 VAL 81 2HG1 VAL 81 4.310 -7.430 10.373 2944 HG13 VAL 81 3HG1 VAL 81 5.530 -7.162 11.653 2945 HG21 VAL 81 3HG2 VAL 81 7.956 -8.640 10.643 2946 HG22 VAL 81 1HG2 VAL 81 7.979 -6.892 11.070 2947 HG23 VAL 81 2HG2 VAL 81 8.588 -7.429 9.466 2948 H PHE 82 H PHE 82 4.551 -6.729 7.411 2949 HA PHE 82 HA PHE 82 2.243 -8.190 8.120 2950 HB2 PHE 82 2HB PHE 82 2.557 -5.982 5.980 2951 HB3 PHE 82 1HB PHE 82 0.980 -6.579 6.628 2952 HD1 PHE 82 2HD PHE 82 1.272 -6.732 9.508 2953 HD2 PHE 82 1HD PHE 82 2.934 -3.838 6.784 2954 HE1 PHE 82 2HE PHE 82 1.389 -5.080 11.327 2955 HE2 PHE 82 1HE PHE 82 3.037 -2.185 8.604 2956 HZ PHE 82 HZ PHE 82 2.258 -2.791 10.885 2957 H ALA 83 H ALA 83 4.203 -8.077 5.158 2958 HA ALA 83 HA ALA 83 2.455 -9.504 3.513 2959 HB1 ALA 83 1HB ALA 83 4.518 -9.956 2.129 2960 HB2 ALA 83 2HB ALA 83 5.541 -9.375 3.490 2961 HB3 ALA 83 3HB ALA 83 4.435 -8.240 2.637 2962 H LEU 84 H LEU 84 4.869 -10.564 5.929 2963 HA LEU 84 HA LEU 84 5.018 -13.246 5.163 2964 HB2 LEU 84 2HB LEU 84 6.502 -11.890 6.787 2965 HB3 LEU 84 1HB LEU 84 5.291 -12.205 8.055 2966 HG LEU 84 HG LEU 84 6.766 -14.391 6.445 2967 HD11 LEU 84 1HD1 LEU 84 8.409 -14.533 8.306 2968 HD12 LEU 84 2HD1 LEU 84 7.602 -13.156 9.149 2969 HD13 LEU 84 3HD1 LEU 84 8.418 -12.896 7.564 2970 HD21 LEU 84 3HD2 LEU 84 6.327 -15.851 8.472 2971 HD22 LEU 84 1HD2 LEU 84 4.826 -15.357 7.649 2972 HD23 LEU 84 2HD2 LEU 84 5.316 -14.538 9.178 2973 H VAL 85 H VAL 85 2.781 -11.455 7.270 2974 HA VAL 85 HA VAL 85 1.441 -13.604 8.404 2975 HB VAL 85 HB VAL 85 0.351 -10.814 7.759 2976 HG11 VAL 85 1HG1 VAL 85 -1.074 -11.242 9.851 2977 HG12 VAL 85 2HG1 VAL 85 -0.602 -12.979 9.749 2978 HG13 VAL 85 3HG1 VAL 85 -1.535 -12.217 8.418 2979 HG21 VAL 85 3HG2 VAL 85 1.087 -10.335 10.162 2980 HG22 VAL 85 1HG2 VAL 85 2.441 -10.606 9.034 2981 HG23 VAL 85 2HG2 VAL 85 1.959 -11.909 10.169 2982 H THR 86 H THR 86 1.415 -12.603 5.068 2983 HA THR 86 HA THR 86 -1.181 -13.339 4.396 2984 HB THR 86 HB THR 86 1.224 -13.650 2.561 2985 HG1 THR 86 1HG THR 86 1.417 -11.667 3.222 2986 HG21 THR 86 3HG2 THR 86 -0.490 -12.957 0.821 2987 HG22 THR 86 1HG2 THR 86 -1.769 -12.940 2.086 2988 HG23 THR 86 2HG2 THR 86 -0.971 -14.491 1.622 2989 H ALA 87 H ALA 87 1.547 -15.337 5.337 2990 HA ALA 87 HA ALA 87 0.774 -17.785 4.221 2991 HB1 ALA 87 1HB ALA 87 2.014 -17.233 7.003 2992 HB2 ALA 87 2HB ALA 87 2.947 -17.416 5.486 2993 HB3 ALA 87 3HB ALA 87 2.032 -18.816 6.133 2994 H ALA 88 H ALA 88 -0.602 -15.840 6.822 2995 HA ALA 88 HA ALA 88 -2.228 -18.000 7.852 2996 HB1 ALA 88 1HB ALA 88 -2.386 -14.978 8.444 2997 HB2 ALA 88 2HB ALA 88 -1.502 -16.184 9.442 2998 HB3 ALA 88 3HB ALA 88 -3.296 -16.275 9.293 2999 H LEU 89 H LEU 89 -2.634 -14.974 5.916 3000 HA LEU 89 HA LEU 89 -5.389 -15.237 5.667 3001 HB2 LEU 89 2HB LEU 89 -3.375 -13.713 3.915 3002 HB3 LEU 89 1HB LEU 89 -5.133 -13.693 3.599 3003 HG LEU 89 HG LEU 89 -4.557 -11.687 4.701 3004 HD11 LEU 89 1HD1 LEU 89 -6.780 -12.713 5.194 3005 HD12 LEU 89 2HD1 LEU 89 -6.190 -11.656 6.525 3006 HD13 LEU 89 3HD1 LEU 89 -6.120 -13.445 6.703 3007 HD21 LEU 89 3HD2 LEU 89 -3.690 -11.465 6.986 3008 HD22 LEU 89 1HD2 LEU 89 -2.506 -12.326 5.948 3009 HD23 LEU 89 2HD2 LEU 89 -3.500 -13.244 7.144 3010 H ALA 90 H ALA 90 -2.817 -16.604 3.622 3011 HA ALA 90 HA ALA 90 -4.564 -17.264 1.507 3012 HB1 ALA 90 1HB ALA 90 -2.752 -18.772 0.738 3013 HB2 ALA 90 2HB ALA 90 -1.929 -18.598 2.341 3014 HB3 ALA 90 3HB ALA 90 -2.083 -17.179 1.245 3015 H THR 91 H THR 91 -4.242 -18.650 4.704 3016 HA THR 91 HA THR 91 -5.355 -21.188 3.820 3017 HB THR 91 HB THR 91 -5.545 -21.878 6.132 3018 HG1 THR 91 1HG THR 91 -4.428 -19.299 6.664 3019 HG21 THR 91 3HG2 THR 91 -3.169 -22.210 6.461 3020 HG22 THR 91 1HG2 THR 91 -2.753 -20.734 5.505 3021 HG23 THR 91 2HG2 THR 91 -3.473 -22.179 4.698 3022 H ASP 92 H ASP 92 -6.620 -18.027 4.414 3023 HA ASP 92 HA ASP 92 -8.842 -18.765 5.926 3024 HB2 ASP 92 2HB ASP 92 -8.247 -16.306 4.209 3025 HB3 ASP 92 1HB ASP 92 -9.903 -16.588 4.852 3026 H PHE 93 H PHE 93 -8.304 -18.922 2.433 3027 HA PHE 93 HA PHE 93 -11.100 -19.399 1.947 3028 HB2 PHE 93 2HB PHE 93 -10.676 -19.639 -0.323 3029 HB3 PHE 93 1HB PHE 93 -9.461 -18.421 0.186 3030 HD1 PHE 93 2HD PHE 93 -7.040 -19.056 0.283 3031 HD2 PHE 93 1HD PHE 93 -10.014 -21.810 -1.154 3032 HE1 PHE 93 2HE PHE 93 -5.278 -20.399 -0.794 3033 HE2 PHE 93 1HE PHE 93 -8.249 -23.144 -2.248 3034 HZ PHE 93 HZ PHE 93 -5.873 -22.437 -2.081 3035 H VAL 94 H VAL 94 -8.255 -21.330 2.662 3036 HA VAL 94 HA VAL 94 -9.073 -23.753 1.573 3037 HB VAL 94 HB VAL 94 -7.181 -23.241 3.937 3038 HG11 VAL 94 1HG1 VAL 94 -7.390 -25.596 1.935 3039 HG12 VAL 94 2HG1 VAL 94 -7.737 -25.668 3.699 3040 HG13 VAL 94 3HG1 VAL 94 -6.062 -25.365 3.126 3041 HG21 VAL 94 3HG2 VAL 94 -6.570 -21.835 1.918 3042 HG22 VAL 94 1HG2 VAL 94 -6.642 -23.304 0.884 3043 HG23 VAL 94 2HG2 VAL 94 -5.398 -23.156 2.176 3044 H ARG 95 H ARG 95 -9.832 -22.083 4.526 3045 HA ARG 95 HA ARG 95 -10.805 -24.252 6.025 3046 HB2 ARG 95 2HB ARG 95 -11.578 -21.278 6.121 3047 HB3 ARG 95 1HB ARG 95 -11.997 -22.483 7.389 3048 HG2 ARG 95 2HG ARG 95 -9.641 -22.795 7.987 3049 HG3 ARG 95 1HG ARG 95 -9.118 -21.873 6.542 3050 HD2 ARG 95 2HD ARG 95 -10.367 -19.813 7.582 3051 HD3 ARG 95 1HD ARG 95 -10.358 -20.748 9.141 3052 HE ARG 95 HE ARG 95 -7.733 -20.885 8.018 3053 HH11 ARG 95 1HH2 ARG 95 -9.880 -18.121 9.073 3054 HH12 ARG 95 2HH2 ARG 95 -8.570 -17.094 9.305 3055 HH21 ARG 95 1HH1 ARG 95 -6.093 -19.198 7.907 3056 HH22 ARG 95 2HH1 ARG 95 -6.690 -17.624 7.915 3057 H ARG 96 H ARG 96 -12.084 -23.030 3.070 3058 HA ARG 96 HA ARG 96 -14.824 -23.341 3.735 3059 HB2 ARG 96 2HB ARG 96 -15.412 -23.294 1.467 3060 HB3 ARG 96 1HB ARG 96 -14.086 -22.102 1.638 3061 HG2 ARG 96 2HG ARG 96 -12.516 -23.611 0.479 3062 HG3 ARG 96 1HG ARG 96 -13.663 -24.989 0.589 3063 HD2 ARG 96 2HD ARG 96 -15.330 -23.743 -0.824 3064 HD3 ARG 96 1HD ARG 96 -14.073 -22.469 -1.140 3065 HE ARG 96 HE ARG 96 -13.010 -25.137 -1.695 3066 HH11 ARG 96 1HH2 ARG 96 -15.694 -23.032 -2.953 3067 HH12 ARG 96 2HH2 ARG 96 -15.595 -23.644 -4.529 3068 HH21 ARG 96 1HH1 ARG 96 -12.841 -25.865 -3.936 3069 HH22 ARG 96 2HH1 ARG 96 -13.798 -25.132 -5.165 3070 H GLU 97 H GLU 97 -12.242 -25.642 3.384 3071 HA GLU 97 HA GLU 97 -14.197 -27.802 2.916 3072 HB2 GLU 97 2HB GLU 97 -12.202 -27.300 1.140 3073 HB3 GLU 97 1HB GLU 97 -11.193 -28.050 2.384 3074 HG2 GLU 97 2HG GLU 97 -11.656 -29.910 1.095 3075 HG3 GLU 97 1HG GLU 97 -13.024 -30.059 2.238 3076 H GLU 98 H GLU 98 -13.507 -29.745 4.246 3077 HA GLU 98 HA GLU 98 -13.016 -30.745 6.107 3078 HB2 GLU 98 2HB GLU 98 -10.507 -29.029 5.990 3079 HB3 GLU 98 1HB GLU 98 -10.765 -30.268 7.259 3080 HG2 GLU 98 2HG GLU 98 -10.899 -31.001 4.264 3081 HG3 GLU 98 1HG GLU 98 -9.353 -30.897 5.177 3082 H GLU 99 H GLU 99 -11.701 -27.597 6.989 3083 HA GLU 99 HA GLU 99 -12.491 -27.598 9.641 3084 HB2 GLU 99 2HB GLU 99 -10.665 -26.156 8.551 3085 HB3 GLU 99 1HB GLU 99 -11.972 -25.171 7.820 3086 HG2 GLU 99 2HG GLU 99 -11.128 -23.990 9.778 3087 HG3 GLU 99 1HG GLU 99 -12.776 -24.587 10.177 3088 H ARG 100 H ARG 100 -14.089 -26.303 6.682 3089 HA ARG 100 HA ARG 100 -16.088 -24.931 7.982 3090 HB2 ARG 100 2HB ARG 100 -15.663 -24.768 5.516 3091 HB3 ARG 100 1HB ARG 100 -16.447 -26.369 5.292 3092 HG2 ARG 100 2HG ARG 100 -18.614 -25.416 6.072 3093 HG3 ARG 100 1HG ARG 100 -17.816 -23.879 6.524 3094 HD2 ARG 100 2HD ARG 100 -19.146 -23.722 4.375 3095 HD3 ARG 100 1HD ARG 100 -17.409 -23.304 4.154 3096 HE ARG 100 HE ARG 100 -16.967 -25.433 3.143 3097 HH11 ARG 100 1HH2 ARG 100 -20.507 -24.639 3.108 3098 HH12 ARG 100 2HH2 ARG 100 -20.984 -26.264 2.735 3099 HH21 ARG 100 1HH1 ARG 100 -17.668 -27.372 1.979 3100 HH22 ARG 100 2HH1 ARG 100 -19.316 -27.663 1.679 3101 H ARG 101 H ARG 101 -15.769 -28.424 7.690 3102 HA ARG 101 HA ARG 101 -18.617 -28.845 8.184 3103 HB2 ARG 101 2HB ARG 101 -16.350 -30.936 8.202 3104 HB3 ARG 101 1HB ARG 101 -18.116 -31.235 8.303 3105 HG2 ARG 101 2HG ARG 101 -17.624 -31.801 6.119 3106 HG3 ARG 101 1HG ARG 101 -18.293 -30.139 5.946 3107 HD2 ARG 101 2HD ARG 101 -15.930 -29.250 5.703 3108 HD3 ARG 101 1HD ARG 101 -15.275 -30.894 6.016 3109 HE ARG 101 HE ARG 101 -16.736 -29.940 3.548 3110 HH11 ARG 101 1HH2 ARG 101 -14.878 -32.676 5.157 3111 HH12 ARG 101 2HH2 ARG 101 -14.919 -33.615 3.738 3112 HH21 ARG 101 1HH1 ARG 101 -16.353 -31.070 1.624 3113 HH22 ARG 101 2HH1 ARG 101 -15.597 -32.609 1.583 3114 H GLY 102 H GLY 102 -15.643 -28.286 9.948 3115 HA2 GLY 102 2HA GLY 102 -15.313 -28.002 12.090 3116 HA3 GLY 102 1HA GLY 102 -17.060 -28.333 12.377 3117 H HIS 103 H HIS 103 -15.735 -30.830 10.703 3118 HA HIS 103 HA HIS 103 -15.534 -32.933 11.079 3119 HB2 HIS 103 2HB HIS 103 -13.323 -32.252 12.249 3120 HB3 HIS 103 1HB HIS 103 -14.181 -32.620 13.783 3121 HD1 HIS 103 1HD HIS 103 -12.743 -34.233 10.615 3122 HD2 HIS 103 2HD HIS 103 -15.099 -35.461 13.921 3123 HE1 HIS 103 1HE HIS 103 -12.988 -36.731 10.512 3124 HE2 HIS 103 2HE HIS 103 -14.479 -37.419 12.405 Start of MODEL 8 1 H1 SER 1 H SER 1 -24.232 -14.508 -6.106 2 HA SER 1 HA SER 1 -22.475 -13.979 -4.154 3 HB2 SER 1 2HB SER 1 -24.777 -12.911 -4.438 4 HB3 SER 1 1HB SER 1 -25.509 -14.394 -3.732 5 HG SER 1 1HG SER 1 -25.283 -12.737 -2.252 6 H ALA 2 H ALA 2 -21.204 -15.707 -3.512 7 HA ALA 2 HA ALA 2 -22.585 -18.002 -2.268 8 HB1 ALA 2 1HB ALA 2 -20.669 -18.558 -3.790 9 HB2 ALA 2 2HB ALA 2 -20.386 -19.103 -2.101 10 HB3 ALA 2 3HB ALA 2 -19.571 -17.621 -2.715 11 H ASP 3 H ASP 3 -21.547 -18.753 -0.235 12 HA ASP 3 HA ASP 3 -21.908 -17.231 1.945 13 HB2 ASP 3 2HB ASP 3 -20.455 -18.900 3.157 14 HB3 ASP 3 1HB ASP 3 -21.663 -19.668 2.087 15 H HIS 4 H HIS 4 -18.780 -17.988 0.564 16 HA HIS 4 HA HIS 4 -17.323 -16.237 2.235 17 HB2 HIS 4 2HB HIS 4 -15.359 -16.744 0.884 18 HB3 HIS 4 1HB HIS 4 -16.325 -18.208 1.157 19 HD1 HIS 4 1HD HIS 4 -15.208 -15.858 -1.601 20 HD2 HIS 4 2HD HIS 4 -17.534 -19.344 -1.223 21 HE1 HIS 4 1HE HIS 4 -15.488 -16.805 -3.924 22 HE2 HIS 4 2HE HIS 4 -16.810 -18.974 -3.665 23 H GLU 5 H GLU 5 -19.052 -15.582 -0.738 24 HA GLU 5 HA GLU 5 -17.199 -13.496 -1.552 25 HB2 GLU 5 2HB GLU 5 -20.038 -14.094 -2.549 26 HB3 GLU 5 1HB GLU 5 -18.901 -12.886 -3.237 27 HG2 GLU 5 2HG GLU 5 -17.250 -14.740 -3.753 28 HG3 GLU 5 1HG GLU 5 -18.442 -15.947 -3.147 29 H ARG 6 H ARG 6 -20.299 -13.921 0.157 30 HA ARG 6 HA ARG 6 -20.889 -11.246 0.626 31 HB2 ARG 6 2HB ARG 6 -21.318 -13.705 2.429 32 HB3 ARG 6 1HB ARG 6 -22.084 -12.102 2.716 33 HG2 ARG 6 2HG ARG 6 -23.525 -12.297 0.836 34 HG3 ARG 6 1HG ARG 6 -22.558 -13.586 0.066 35 HD2 ARG 6 2HD ARG 6 -24.801 -14.315 1.222 36 HD3 ARG 6 1HD ARG 6 -23.303 -15.284 1.561 37 HE ARG 6 HE ARG 6 -23.394 -13.243 3.522 38 HH11 ARG 6 1HH2 ARG 6 -25.382 -16.159 2.632 39 HH12 ARG 6 2HH2 ARG 6 -25.652 -16.612 4.252 40 HH21 ARG 6 1HH1 ARG 6 -23.772 -13.964 5.805 41 HH22 ARG 6 2HH1 ARG 6 -24.800 -15.275 6.085 42 H GLU 7 H GLU 7 -18.696 -13.457 2.269 43 HA GLU 7 HA GLU 7 -18.255 -12.134 4.645 44 HB2 GLU 7 2HB GLU 7 -17.747 -14.501 3.770 45 HB3 GLU 7 1HB GLU 7 -16.253 -13.849 3.028 46 HG2 GLU 7 2HG GLU 7 -15.219 -13.519 5.184 47 HG3 GLU 7 1HG GLU 7 -16.805 -13.607 6.045 48 H ALA 8 H ALA 8 -16.665 -11.820 1.453 49 HA ALA 8 HA ALA 8 -14.703 -9.941 2.296 50 HB1 ALA 8 1HB ALA 8 -14.372 -9.522 -0.166 51 HB2 ALA 8 2HB ALA 8 -15.845 -10.491 -0.526 52 HB3 ALA 8 3HB ALA 8 -14.396 -11.286 0.195 53 H GLN 9 H GLN 9 -17.942 -9.721 0.825 54 HA GLN 9 HA GLN 9 -17.858 -6.959 0.343 55 HB2 GLN 9 2HB GLN 9 -20.183 -8.924 0.693 56 HB3 GLN 9 1HB GLN 9 -20.381 -7.259 0.053 57 HG2 GLN 9 2HG GLN 9 -19.073 -7.726 -1.933 58 HG3 GLN 9 1HG GLN 9 -18.439 -9.270 -1.276 59 HE21 GLN 9 1HE2 GLN 9 -19.373 -10.061 -3.488 60 HE22 GLN 9 2HE2 GLN 9 -21.050 -10.476 -3.541 61 H LYS 10 H LYS 10 -18.853 -8.853 3.171 62 HA LYS 10 HA LYS 10 -19.941 -6.650 4.621 63 HB2 LYS 10 2HB LYS 10 -19.199 -9.530 5.186 64 HB3 LYS 10 1HB LYS 10 -19.201 -8.440 6.601 65 HG2 LYS 10 2HG LYS 10 -21.362 -9.637 6.292 66 HG3 LYS 10 1HG LYS 10 -21.468 -7.846 6.394 67 HD2 LYS 10 2HD LYS 10 -21.685 -7.742 3.881 68 HD3 LYS 10 1HD LYS 10 -21.750 -9.537 3.826 69 HE2 LYS 10 2HE LYS 10 -23.903 -9.559 5.013 70 HE3 LYS 10 1HE LYS 10 -23.666 -7.858 5.583 71 HZ1 LYS 10 3HZ LYS 10 -23.820 -7.108 3.296 72 HZ2 LYS 10 1HZ LYS 10 -25.229 -7.876 3.839 73 HZ3 LYS 10 2HZ LYS 10 -24.213 -8.665 2.757 74 H ALA 11 H ALA 11 -16.665 -7.976 4.200 75 HA ALA 11 HA ALA 11 -15.523 -6.738 6.421 76 HB1 ALA 11 1HB ALA 11 -14.338 -8.502 5.041 77 HB2 ALA 11 2HB ALA 11 -13.333 -7.033 5.309 78 HB3 ALA 11 3HB ALA 11 -14.136 -7.294 3.722 79 H GLU 12 H GLU 12 -15.951 -5.614 3.054 80 HA GLU 12 HA GLU 12 -14.725 -3.153 3.194 81 HB2 GLU 12 2HB GLU 12 -17.363 -3.877 1.756 82 HB3 GLU 12 1HB GLU 12 -16.347 -2.447 1.382 83 HG2 GLU 12 2HG GLU 12 -14.536 -3.894 0.518 84 HG3 GLU 12 1HG GLU 12 -15.420 -5.383 1.023 85 H GLU 13 H GLU 13 -18.029 -4.098 4.188 86 HA GLU 13 HA GLU 13 -18.818 -1.386 4.584 87 HB2 GLU 13 2HB GLU 13 -20.309 -3.437 3.920 88 HB3 GLU 13 1HB GLU 13 -20.383 -3.771 5.678 89 HG2 GLU 13 2HG GLU 13 -21.371 -1.463 6.038 90 HG3 GLU 13 1HG GLU 13 -21.146 -1.102 4.287 91 H GLU 14 H GLU 14 -17.442 -3.988 6.599 92 HA GLU 14 HA GLU 14 -18.122 -2.728 9.023 93 HB2 GLU 14 2HB GLU 14 -17.451 -5.198 8.758 94 HB3 GLU 14 1HB GLU 14 -15.751 -4.629 8.812 95 HG2 GLU 14 2HG GLU 14 -16.208 -3.557 11.054 96 HG3 GLU 14 1HG GLU 14 -17.944 -4.028 10.928 97 H LEU 15 H LEU 15 -15.428 -2.315 6.754 98 HA LEU 15 HA LEU 15 -13.779 -0.819 8.402 99 HB2 LEU 15 2HB LEU 15 -13.093 -1.591 6.138 100 HB3 LEU 15 1HB LEU 15 -14.236 -0.441 5.382 101 HG LEU 15 HG LEU 15 -12.935 1.478 6.193 102 HD11 LEU 15 1HD1 LEU 15 -11.222 -0.579 7.721 103 HD12 LEU 15 2HD1 LEU 15 -12.169 0.789 8.406 104 HD13 LEU 15 3HD1 LEU 15 -10.715 1.123 7.418 105 HD21 LEU 15 3HD2 LEU 15 -12.218 0.431 4.064 106 HD22 LEU 15 1HD2 LEU 15 -11.101 -0.669 4.944 107 HD23 LEU 15 2HD2 LEU 15 -10.799 1.106 4.945 108 H GLN 16 H GLN 16 -16.628 0.244 6.467 109 HA GLN 16 HA GLN 16 -16.201 2.984 6.933 110 HB2 GLN 16 2HB GLN 16 -18.887 1.622 6.380 111 HB3 GLN 16 1HB GLN 16 -18.559 3.390 6.401 112 HG2 GLN 16 2HG GLN 16 -16.658 2.772 4.608 113 HG3 GLN 16 1HG GLN 16 -17.650 1.291 4.353 114 HE21 GLN 16 1HE2 GLN 16 -17.211 4.452 3.235 115 HE22 GLN 16 2HE2 GLN 16 -18.829 4.874 2.778 116 H LYS 17 H LYS 17 -17.588 0.491 9.001 117 HA LYS 17 HA LYS 17 -18.912 2.344 10.722 118 HB2 LYS 17 2HB LYS 17 -19.549 -0.069 10.463 119 HB3 LYS 17 1HB LYS 17 -18.050 -0.550 11.319 120 HG2 LYS 17 2HG LYS 17 -19.867 1.499 12.650 121 HG3 LYS 17 1HG LYS 17 -20.543 -0.140 12.487 122 HD2 LYS 17 2HD LYS 17 -17.751 0.303 13.712 123 HD3 LYS 17 1HD LYS 17 -19.225 0.562 14.687 124 HE2 LYS 17 2HE LYS 17 -18.574 -2.108 13.243 125 HE3 LYS 17 1HE LYS 17 -18.226 -1.748 14.982 126 HZ1 LYS 17 3HZ LYS 17 -20.923 -1.837 13.693 127 HZ2 LYS 17 1HZ LYS 17 -20.621 -1.301 15.267 128 HZ3 LYS 17 2HZ LYS 17 -20.265 -2.913 14.803 129 H VAL 18 H VAL 18 -15.620 1.017 10.463 130 HA VAL 18 HA VAL 18 -14.769 1.743 13.053 131 HB VAL 18 HB VAL 18 -13.131 1.393 10.487 132 HG11 VAL 18 1HG1 VAL 18 -12.283 1.542 13.459 133 HG12 VAL 18 2HG1 VAL 18 -11.810 2.685 12.148 134 HG13 VAL 18 3HG1 VAL 18 -11.218 0.991 12.117 135 HG21 VAL 18 3HG2 VAL 18 -14.431 -0.665 11.121 136 HG22 VAL 18 1HG2 VAL 18 -13.803 -0.553 12.806 137 HG23 VAL 18 2HG2 VAL 18 -12.685 -0.895 11.438 138 H LEU 19 H LEU 19 -14.807 3.437 9.890 139 HA LEU 19 HA LEU 19 -13.376 5.704 10.635 140 HB2 LEU 19 2HB LEU 19 -15.698 5.410 8.638 141 HB3 LEU 19 1HB LEU 19 -14.896 6.979 8.948 142 HG LEU 19 HG LEU 19 -12.710 6.096 8.216 143 HD11 LEU 19 1HD1 LEU 19 -12.642 4.037 6.765 144 HD12 LEU 19 2HD1 LEU 19 -14.284 3.608 7.315 145 HD13 LEU 19 3HD1 LEU 19 -12.921 3.645 8.495 146 HD21 LEU 19 3HD2 LEU 19 -15.034 5.931 6.189 147 HD22 LEU 19 1HD2 LEU 19 -13.291 6.151 5.781 148 HD23 LEU 19 2HD2 LEU 19 -14.158 7.417 6.725 149 H GLU 20 H GLU 20 -16.897 4.963 11.027 150 HA GLU 20 HA GLU 20 -17.586 7.530 11.867 151 HB2 GLU 20 2HB GLU 20 -18.942 4.909 12.743 152 HB3 GLU 20 1HB GLU 20 -19.603 6.575 12.870 153 HG2 GLU 20 2HG GLU 20 -19.353 6.695 10.263 154 HG3 GLU 20 1HG GLU 20 -19.110 4.910 10.314 155 H GLU 21 H GLU 21 -16.490 4.687 13.765 156 HA GLU 21 HA GLU 21 -16.854 6.003 16.269 157 HB2 GLU 21 2HB GLU 21 -16.778 3.460 15.926 158 HB3 GLU 21 1HB GLU 21 -15.022 3.629 15.618 159 HG2 GLU 21 2HG GLU 21 -15.073 2.987 17.858 160 HG3 GLU 21 1HG GLU 21 -14.950 4.774 18.028 161 H ALA 22 H ALA 22 -14.145 5.545 13.979 162 HA ALA 22 HA ALA 22 -12.078 6.558 15.494 163 HB1 ALA 22 1HB ALA 22 -10.927 7.044 13.333 164 HB2 ALA 22 2HB ALA 22 -12.485 6.877 12.450 165 HB3 ALA 22 3HB ALA 22 -11.759 5.443 13.253 166 H SER 23 H SER 23 -14.489 8.234 13.531 167 HA SER 23 HA SER 23 -13.280 10.757 13.563 168 HB2 SER 23 2HB SER 23 -16.274 10.056 13.331 169 HB3 SER 23 1HB SER 23 -15.473 11.581 12.771 170 HG SER 23 1HG SER 23 -15.135 8.898 11.834 171 H LYS 24 H LYS 24 -15.361 9.091 15.900 172 HA LYS 24 HA LYS 24 -16.013 11.438 17.376 173 HB2 LYS 24 2HB LYS 24 -17.261 9.193 17.336 174 HB3 LYS 24 1HB LYS 24 -15.934 8.507 18.323 175 HG2 LYS 24 2HG LYS 24 -16.473 10.245 20.136 176 HG3 LYS 24 1HG LYS 24 -17.821 10.825 19.087 177 HD2 LYS 24 2HD LYS 24 -18.562 8.350 18.967 178 HD3 LYS 24 1HD LYS 24 -17.448 8.029 20.332 179 HE2 LYS 24 2HE LYS 24 -18.793 9.332 21.877 180 HE3 LYS 24 1HE LYS 24 -19.635 10.206 20.529 181 HZ1 LYS 24 3HZ LYS 24 -20.686 8.225 19.870 182 HZ2 LYS 24 1HZ LYS 24 -21.005 8.496 21.523 183 HZ3 LYS 24 2HZ LYS 24 -19.876 7.273 21.018 184 H LYS 25 H LYS 25 -13.630 8.787 17.692 185 HA LYS 25 HA LYS 25 -12.358 9.687 20.021 186 HB2 LYS 25 2HB LYS 25 -11.066 8.222 17.625 187 HB3 LYS 25 1HB LYS 25 -10.376 8.346 19.275 188 HG2 LYS 25 2HG LYS 25 -12.206 6.899 20.168 189 HG3 LYS 25 1HG LYS 25 -12.971 6.848 18.538 190 HD2 LYS 25 2HD LYS 25 -10.769 5.928 17.619 191 HD3 LYS 25 1HD LYS 25 -10.184 5.741 19.299 192 HE2 LYS 25 2HE LYS 25 -12.692 4.339 18.092 193 HE3 LYS 25 1HE LYS 25 -11.039 3.632 18.200 194 HZ1 LYS 25 3HZ LYS 25 -13.025 3.951 20.322 195 HZ2 LYS 25 1HZ LYS 25 -11.373 4.222 20.746 196 HZ3 LYS 25 2HZ LYS 25 -11.847 2.782 19.990 197 H ALA 26 H ALA 26 -11.606 10.217 16.532 198 HA ALA 26 HA ALA 26 -9.284 11.625 16.837 199 HB1 ALA 26 1HB ALA 26 -11.391 11.978 14.610 200 HB2 ALA 26 2HB ALA 26 -10.089 10.731 14.637 201 HB3 ALA 26 3HB ALA 26 -9.655 12.473 14.516 202 H VAL 27 H VAL 27 -12.651 12.947 16.693 203 HA VAL 27 HA VAL 27 -11.843 15.636 16.696 204 HB VAL 27 HB VAL 27 -14.402 14.272 17.677 205 HG11 VAL 27 1HG1 VAL 27 -14.285 16.411 18.938 206 HG12 VAL 27 2HG1 VAL 27 -15.455 16.595 17.594 207 HG13 VAL 27 3HG1 VAL 27 -13.801 17.307 17.448 208 HG21 VAL 27 3HG2 VAL 27 -13.774 16.028 15.198 209 HG22 VAL 27 1HG2 VAL 27 -15.314 15.156 15.555 210 HG23 VAL 27 2HG2 VAL 27 -13.816 14.238 15.185 211 H GLU 28 H GLU 28 -12.629 13.389 19.450 212 HA GLU 28 HA GLU 28 -12.230 15.527 21.306 213 HB2 GLU 28 2HB GLU 28 -12.354 12.517 21.894 214 HB3 GLU 28 1HB GLU 28 -12.281 13.851 23.097 215 HG2 GLU 28 2HG GLU 28 -14.443 14.785 21.972 216 HG3 GLU 28 1HG GLU 28 -14.595 13.175 21.177 217 H ALA 29 H ALA 29 -10.179 13.053 19.869 218 HA ALA 29 HA ALA 29 -8.091 13.087 21.671 219 HB1 ALA 29 1HB ALA 29 -8.395 11.431 19.769 220 HB2 ALA 29 2HB ALA 29 -6.757 12.115 19.824 221 HB3 ALA 29 3HB ALA 29 -7.930 12.730 18.607 222 H GLU 30 H GLU 30 -8.660 15.154 18.751 223 HA GLU 30 HA GLU 30 -6.263 16.632 19.182 224 HB2 GLU 30 2HB GLU 30 -8.706 17.090 17.424 225 HB3 GLU 30 1HB GLU 30 -7.387 18.292 17.508 226 HG2 GLU 30 2HG GLU 30 -6.534 15.427 16.959 227 HG3 GLU 30 1HG GLU 30 -7.466 16.263 15.682 228 H ARG 31 H ARG 31 -9.406 16.825 20.699 229 HA ARG 31 HA ARG 31 -9.232 19.649 21.262 230 HB2 ARG 31 2HB ARG 31 -11.012 17.401 22.303 231 HB3 ARG 31 1HB ARG 31 -11.061 19.034 23.024 232 HG2 ARG 31 2HG ARG 31 -11.414 18.647 20.001 233 HG3 ARG 31 1HG ARG 31 -12.783 18.382 21.119 234 HD2 ARG 31 2HD ARG 31 -11.160 21.031 20.944 235 HD3 ARG 31 1HD ARG 31 -12.774 20.730 20.166 236 HE ARG 31 HE ARG 31 -12.850 20.052 23.021 237 HH11 ARG 31 1HH2 ARG 31 -12.445 23.077 21.018 238 HH12 ARG 31 2HH2 ARG 31 -13.517 23.989 21.969 239 HH21 ARG 31 1HH1 ARG 31 -14.137 21.451 24.440 240 HH22 ARG 31 2HH1 ARG 31 -14.285 23.108 24.073 241 H GLY 32 H GLY 32 -7.150 19.862 22.138 242 HA2 GLY 32 2HA GLY 32 -6.667 20.351 24.591 243 HA3 GLY 32 1HA GLY 32 -6.612 18.540 24.687 244 H ALA 33 H ALA 33 -5.741 18.749 21.645 245 HA ALA 33 HA ALA 33 -3.032 18.385 22.335 246 HB1 ALA 33 1HB ALA 33 -2.714 17.840 19.893 247 HB2 ALA 33 2HB ALA 33 -4.394 18.384 19.573 248 HB3 ALA 33 3HB ALA 33 -4.106 16.941 20.603 249 HA PRO 34 HA PRO 34 -1.940 22.565 21.142 250 HB2 PRO 34 2HB PRO 34 0.846 22.407 21.121 251 HB3 PRO 34 1HB PRO 34 -0.124 22.363 22.640 252 HG2 PRO 34 2HG PRO 34 1.019 19.993 21.070 253 HG3 PRO 34 1HG PRO 34 1.095 20.289 22.855 254 HD2 PRO 34 2HD PRO 34 -0.821 18.649 21.646 255 HD3 PRO 34 1HD PRO 34 -1.202 19.629 23.138 256 H GLY 35 H GLY 35 -1.746 23.647 19.119 257 HA2 GLY 35 2HA GLY 35 -1.259 23.953 16.984 258 HA3 GLY 35 1HA GLY 35 -0.117 22.562 17.075 259 H ALA 36 H ALA 36 -3.457 22.174 18.014 260 HA ALA 36 HA ALA 36 -3.853 20.041 16.279 261 HB1 ALA 36 1HB ALA 36 -6.235 20.091 17.008 262 HB2 ALA 36 2HB ALA 36 -5.977 21.707 17.770 263 HB3 ALA 36 3HB ALA 36 -5.133 20.243 18.413 264 H ALA 37 H ALA 37 -5.189 19.779 14.523 265 HA ALA 37 HA ALA 37 -5.651 22.259 12.935 266 HB1 ALA 37 1HB ALA 37 -4.884 20.965 10.905 267 HB2 ALA 37 2HB ALA 37 -4.476 19.561 11.972 268 HB3 ALA 37 3HB ALA 37 -3.562 21.101 12.121 269 H LEU 38 H LEU 38 -6.564 18.913 13.875 270 HA LEU 38 HA LEU 38 -8.793 18.983 11.982 271 HB2 LEU 38 2HB LEU 38 -7.475 16.916 11.978 272 HB3 LEU 38 1HB LEU 38 -7.556 16.794 13.744 273 HG LEU 38 HG LEU 38 -10.165 16.743 12.146 274 HD11 LEU 38 1HD1 LEU 38 -8.621 15.194 10.932 275 HD12 LEU 38 2HD1 LEU 38 -9.918 14.283 11.790 276 HD13 LEU 38 3HD1 LEU 38 -8.253 14.339 12.468 277 HD21 LEU 38 3HD2 LEU 38 -10.331 16.655 14.669 278 HD22 LEU 38 1HD2 LEU 38 -9.232 15.240 14.691 279 HD23 LEU 38 2HD2 LEU 38 -10.855 15.102 13.939 280 H ILE 39 H ILE 39 -10.921 19.329 12.745 281 HA ILE 39 HA ILE 39 -11.470 19.064 15.500 282 HB ILE 39 HB ILE 39 -12.618 21.397 15.500 283 HG12 ILE 39 2HG1 ILE 39 -10.537 21.972 13.282 284 HG13 ILE 39 1HG1 ILE 39 -12.308 21.841 13.023 285 HG21 ILE 39 1HG2 ILE 39 -10.583 20.772 16.885 286 HG22 ILE 39 2HG2 ILE 39 -10.670 22.522 16.472 287 HG23 ILE 39 3HG2 ILE 39 -9.537 21.437 15.588 288 HD11 ILE 39 3HD ILE 39 -10.869 23.966 14.751 289 HD12 ILE 39 1HD ILE 39 -11.656 24.213 13.156 290 HD13 ILE 39 2HD ILE 39 -12.661 23.800 14.595 291 H SER 40 H SER 40 -13.960 19.419 15.546 292 HA SER 40 HA SER 40 -15.980 19.413 14.775 293 HB2 SER 40 2HB SER 40 -15.459 21.241 13.277 294 HB3 SER 40 1HB SER 40 -14.712 20.128 12.096 295 HG SER 40 1HG SER 40 -16.490 20.268 11.210 296 H TYR 41 H TYR 41 -17.449 17.770 14.367 297 HA TYR 41 HA TYR 41 -16.381 15.234 13.723 298 HB2 TYR 41 2HB TYR 41 -18.295 15.534 15.345 299 HB3 TYR 41 1HB TYR 41 -19.359 15.952 13.965 300 HD1 TYR 41 1HD TYR 41 -17.372 13.223 15.581 301 HD2 TYR 41 2HD TYR 41 -20.142 14.225 12.447 302 HE1 TYR 41 1HE TYR 41 -17.911 10.827 15.281 303 HE2 TYR 41 2HE TYR 41 -20.649 11.850 12.124 304 HH TYR 41 HH TYR 41 -20.245 9.682 12.789 305 HA PRO 42 HA PRO 42 -18.555 15.443 9.631 306 HB2 PRO 42 2HB PRO 42 -19.079 17.957 8.368 307 HB3 PRO 42 1HB PRO 42 -20.283 16.929 9.237 308 HG2 PRO 42 2HG PRO 42 -18.662 19.284 10.333 309 HG3 PRO 42 1HG PRO 42 -20.427 18.939 10.556 310 HD2 PRO 42 2HD PRO 42 -18.624 18.303 12.506 311 HD3 PRO 42 1HD PRO 42 -19.939 17.107 12.094 312 H ASP 43 H ASP 43 -16.034 17.636 10.545 313 HA ASP 43 HA ASP 43 -14.743 17.566 7.939 314 HB2 ASP 43 2HB ASP 43 -13.884 18.592 10.714 315 HB3 ASP 43 1HB ASP 43 -12.795 18.606 9.296 316 H ALA 44 H ALA 44 -14.421 16.176 11.253 317 HA ALA 44 HA ALA 44 -12.046 14.826 10.806 318 HB1 ALA 44 1HB ALA 44 -12.604 13.495 12.849 319 HB2 ALA 44 2HB ALA 44 -14.305 14.098 12.767 320 HB3 ALA 44 3HB ALA 44 -12.953 15.243 13.090 321 H ILE 45 H ILE 45 -15.421 13.828 10.218 322 HA ILE 45 HA ILE 45 -14.717 11.128 9.807 323 HB ILE 45 HB ILE 45 -16.896 11.849 10.603 324 HG12 ILE 45 2HG1 ILE 45 -17.132 10.245 7.987 325 HG13 ILE 45 1HG1 ILE 45 -16.523 9.599 9.542 326 HG21 ILE 45 1HG2 ILE 45 -17.071 13.887 9.073 327 HG22 ILE 45 2HG2 ILE 45 -18.562 12.897 9.182 328 HG23 ILE 45 3HG2 ILE 45 -17.512 12.786 7.730 329 HD11 ILE 45 3HD ILE 45 -19.359 10.741 9.052 330 HD12 ILE 45 1HD ILE 45 -18.909 9.009 9.260 331 HD13 ILE 45 2HD ILE 45 -18.727 10.157 10.641 332 H TRP 46 H TRP 46 -14.251 13.864 7.841 333 HA TRP 46 HA TRP 46 -14.175 12.198 5.438 334 HB2 TRP 46 2HB TRP 46 -14.646 15.001 5.972 335 HB3 TRP 46 1HB TRP 46 -13.189 14.868 4.949 336 HD1 TRP 46 HD TRP 46 -13.999 15.309 2.569 337 HE1 TRP 46 1HE TRP 46 -16.027 14.860 1.161 338 HE3 TRP 46 3HE TRP 46 -16.590 12.458 5.899 339 HZ2 TRP 46 2HZ TRP 46 -18.396 13.180 1.301 340 HZ3 TRP 46 3HZ TRP 46 -18.728 11.440 5.214 341 HH2 TRP 46 HH TRP 46 -19.625 11.803 2.935 342 H TRP 47 H TRP 47 -12.062 13.688 7.873 343 HA TRP 47 HA TRP 47 -9.628 13.186 6.525 344 HB2 TRP 47 2HB TRP 47 -9.603 14.652 8.472 345 HB3 TRP 47 1HB TRP 47 -10.340 13.381 9.505 346 HD1 TRP 47 HD TRP 47 -6.890 13.878 7.605 347 HE1 TRP 47 1HE TRP 47 -5.181 12.479 8.783 348 HE3 TRP 47 3HE TRP 47 -9.949 11.746 11.086 349 HZ2 TRP 47 2HZ TRP 47 -5.044 10.772 11.124 350 HZ3 TRP 47 3HZ TRP 47 -8.981 10.165 12.727 351 HH2 TRP 47 HH TRP 47 -6.559 9.704 12.760 352 H SER 48 H SER 48 -11.734 11.104 8.630 353 HA SER 48 HA SER 48 -9.805 9.103 8.846 354 HB2 SER 48 2HB SER 48 -11.803 7.665 9.597 355 HB3 SER 48 1HB SER 48 -11.412 9.151 10.538 356 HG SER 48 1HG SER 48 -13.516 9.383 10.213 357 H VAL 49 H VAL 49 -11.802 9.975 6.150 358 HA VAL 49 HA VAL 49 -11.874 7.473 4.839 359 HB VAL 49 HB VAL 49 -11.833 10.292 3.628 360 HG11 VAL 49 1HG1 VAL 49 -12.720 7.563 2.481 361 HG12 VAL 49 2HG1 VAL 49 -11.331 8.561 1.910 362 HG13 VAL 49 3HG1 VAL 49 -13.012 9.161 1.707 363 HG21 VAL 49 3HG2 VAL 49 -13.688 9.994 5.300 364 HG22 VAL 49 1HG2 VAL 49 -14.187 8.471 4.484 365 HG23 VAL 49 2HG2 VAL 49 -14.325 10.059 3.627 366 H GLU 50 H GLU 50 -9.593 10.280 4.701 367 HA GLU 50 HA GLU 50 -7.776 9.007 2.889 368 HB2 GLU 50 2HB GLU 50 -7.485 11.332 4.891 369 HB3 GLU 50 1HB GLU 50 -6.152 10.824 3.807 370 HG2 GLU 50 2HG GLU 50 -7.308 11.552 1.807 371 HG3 GLU 50 1HG GLU 50 -8.802 11.923 2.759 372 H THR 51 H THR 51 -8.475 8.463 6.189 373 HA THR 51 HA THR 51 -5.679 7.865 6.868 374 HB THR 51 HB THR 51 -8.228 7.571 8.545 375 HG1 THR 51 1HG THR 51 -7.667 9.775 7.838 376 HG21 THR 51 3HG2 THR 51 -6.263 6.212 9.382 377 HG22 THR 51 1HG2 THR 51 -6.603 7.608 10.462 378 HG23 THR 51 2HG2 THR 51 -5.226 7.683 9.306 379 H ALA 52 H ALA 52 -8.913 6.320 6.450 380 HA ALA 52 HA ALA 52 -8.060 3.807 7.321 381 HB1 ALA 52 1HB ALA 52 -10.444 4.567 5.515 382 HB2 ALA 52 2HB ALA 52 -10.457 4.518 7.316 383 HB3 ALA 52 3HB ALA 52 -10.242 2.995 6.380 384 H THR 53 H THR 53 -8.051 5.297 4.088 385 HA THR 53 HA THR 53 -7.397 2.709 2.900 386 HB THR 53 HB THR 53 -9.041 4.254 1.818 387 HG1 THR 53 1HG THR 53 -6.660 3.551 0.506 388 HG21 THR 53 3HG2 THR 53 -8.308 6.288 0.682 389 HG22 THR 53 1HG2 THR 53 -6.597 6.048 1.186 390 HG23 THR 53 2HG2 THR 53 -7.842 6.443 2.411 391 H THR 54 H THR 54 -5.734 4.814 4.776 392 HA THR 54 HA THR 54 -3.828 5.702 4.981 393 HB THR 54 HB THR 54 -1.739 4.678 4.142 394 HG1 THR 54 1HG THR 54 -3.555 3.389 2.498 395 HG21 THR 54 3HG2 THR 54 -2.842 3.904 6.239 396 HG22 THR 54 1HG2 THR 54 -2.031 2.546 5.386 397 HG23 THR 54 2HG2 THR 54 -3.826 2.708 5.312 398 H VAL 55 H VAL 55 -1.819 5.805 2.459 399 HA VAL 55 HA VAL 55 -1.399 7.233 0.883 400 HB VAL 55 HB VAL 55 -4.384 7.958 0.714 401 HG11 VAL 55 1HG1 VAL 55 -2.840 9.713 -0.257 402 HG12 VAL 55 2HG1 VAL 55 -3.837 8.870 -1.501 403 HG13 VAL 55 3HG1 VAL 55 -2.111 8.440 -1.289 404 HG21 VAL 55 3HG2 VAL 55 -2.648 5.899 -0.783 405 HG22 VAL 55 1HG2 VAL 55 -4.310 6.400 -1.298 406 HG23 VAL 55 2HG2 VAL 55 -4.065 5.549 0.268 407 H GLY 56 H GLY 56 -4.080 9.116 2.291 408 HA2 GLY 56 2HA GLY 56 -4.034 10.922 3.624 409 HA3 GLY 56 1HA GLY 56 -2.311 10.545 4.032 410 H TYR 57 H TYR 57 -4.459 12.491 1.982 411 HA TYR 57 HA TYR 57 -2.253 13.083 0.146 412 HB2 TYR 57 2HB TYR 57 -5.220 13.879 0.295 413 HB3 TYR 57 1HB TYR 57 -4.088 14.998 -0.563 414 HD1 TYR 57 1HD TYR 57 -2.589 14.185 -2.347 415 HD2 TYR 57 2HD TYR 57 -5.785 11.760 -0.795 416 HE1 TYR 57 1HE TYR 57 -2.309 12.641 -4.230 417 HE2 TYR 57 2HE TYR 57 -5.520 10.204 -2.686 418 HH TYR 57 HH TYR 57 -2.820 10.508 -5.008 419 H GLY 58 H GLY 58 -3.566 14.225 3.107 420 HA2 GLY 58 2HA GLY 58 -2.042 15.450 4.407 421 HA3 GLY 58 1HA GLY 58 -1.558 16.405 2.972 422 H ASP 59 H ASP 59 -5.035 15.713 3.590 423 HA ASP 59 HA ASP 59 -5.376 18.557 3.696 424 HB2 ASP 59 2HB ASP 59 -7.186 17.288 2.651 425 HB3 ASP 59 1HB ASP 59 -7.465 16.432 4.207 426 H ARG 60 H ARG 60 -5.556 15.915 6.280 427 HA ARG 60 HA ARG 60 -5.043 18.093 8.139 428 HB2 ARG 60 2HB ARG 60 -7.204 15.973 8.729 429 HB3 ARG 60 1HB ARG 60 -6.619 17.260 9.837 430 HG2 ARG 60 2HG ARG 60 -7.521 18.983 8.184 431 HG3 ARG 60 1HG ARG 60 -8.177 17.633 7.210 432 HD2 ARG 60 2HD ARG 60 -9.705 16.935 9.024 433 HD3 ARG 60 1HD ARG 60 -9.031 18.182 10.131 434 HE ARG 60 HE ARG 60 -11.004 18.566 7.999 435 HH11 ARG 60 1HH2 ARG 60 -8.361 20.333 9.724 436 HH12 ARG 60 2HH2 ARG 60 -8.994 21.861 9.362 437 HH21 ARG 60 1HH1 ARG 60 -12.198 20.721 8.183 438 HH22 ARG 60 2HH1 ARG 60 -11.314 22.051 8.674 439 H TYR 61 H TYR 61 -3.783 17.147 10.060 440 HA TYR 61 HA TYR 61 -3.548 14.346 9.920 441 HB2 TYR 61 2HB TYR 61 -1.495 15.149 8.533 442 HB3 TYR 61 1HB TYR 61 -0.911 15.960 10.040 443 HD1 TYR 61 2HD TYR 61 -2.460 12.615 9.091 444 HD2 TYR 61 1HD TYR 61 0.720 14.634 11.175 445 HE1 TYR 61 2HE TYR 61 -1.546 10.447 9.793 446 HE2 TYR 61 1HE TYR 61 1.675 12.447 11.798 447 HH TYR 61 HH TYR 61 1.695 10.136 11.132 448 HA PRO 62 HA PRO 62 -3.870 15.939 14.069 449 HB2 PRO 62 2HB PRO 62 -3.786 13.516 15.506 450 HB3 PRO 62 1HB PRO 62 -5.206 14.070 14.553 451 HG2 PRO 62 2HG PRO 62 -2.922 12.179 13.760 452 HG3 PRO 62 1HG PRO 62 -4.707 11.889 13.595 453 HD2 PRO 62 2HD PRO 62 -3.209 12.808 11.504 454 HD3 PRO 62 1HD PRO 62 -4.863 13.515 11.785 455 H VAL 63 H VAL 63 -2.697 15.952 16.241 456 HA VAL 63 HA VAL 63 0.081 16.222 15.528 457 HB VAL 63 HB VAL 63 -1.156 17.173 18.124 458 HG11 VAL 63 1HG1 VAL 63 0.735 18.850 17.922 459 HG12 VAL 63 2HG1 VAL 63 1.292 18.052 16.411 460 HG13 VAL 63 3HG1 VAL 63 1.415 17.192 17.981 461 HG21 VAL 63 3HG2 VAL 63 -1.415 19.346 16.865 462 HG22 VAL 63 1HG2 VAL 63 -2.514 18.075 16.263 463 HG23 VAL 63 2HG2 VAL 63 -1.035 18.483 15.329 464 H THR 64 H THR 64 -0.213 15.736 18.909 465 HA THR 64 HA THR 64 1.171 13.146 18.703 466 HB THR 64 HB THR 64 2.033 15.499 20.493 467 HG1 THR 64 1HG THR 64 3.795 15.644 19.016 468 HG21 THR 64 3HG2 THR 64 3.519 12.894 19.705 469 HG22 THR 64 1HG2 THR 64 2.720 13.174 21.290 470 HG23 THR 64 2HG2 THR 64 4.125 14.179 20.803 471 H GLU 65 H GLU 65 -0.688 15.477 20.697 472 HA GLU 65 HA GLU 65 -0.665 13.809 23.007 473 HB2 GLU 65 2HB GLU 65 -0.789 16.415 22.927 474 HB3 GLU 65 1HB GLU 65 -2.508 16.192 22.453 475 HG2 GLU 65 2HG GLU 65 -2.548 16.599 24.802 476 HG3 GLU 65 1HG GLU 65 -2.778 14.824 24.666 477 H GLU 66 H GLU 66 -2.541 14.076 20.131 478 HA GLU 66 HA GLU 66 -5.064 13.269 21.038 479 HB2 GLU 66 2HB GLU 66 -5.152 12.708 18.396 480 HB3 GLU 66 1HB GLU 66 -5.177 14.388 19.018 481 HG2 GLU 66 2HG GLU 66 -3.677 14.370 17.216 482 HG3 GLU 66 1HG GLU 66 -2.654 14.586 18.628 483 H GLY 67 H GLY 67 -2.170 11.685 19.878 484 HA2 GLY 67 2HA GLY 67 -1.300 9.886 21.023 485 HA3 GLY 67 1HA GLY 67 -2.984 9.291 21.390 486 H ARG 68 H ARG 68 -1.193 10.511 18.546 487 HA ARG 68 HA ARG 68 -2.030 9.808 16.455 488 HB2 ARG 68 2HB ARG 68 0.271 10.580 16.790 489 HB3 ARG 68 1HB ARG 68 0.825 8.894 17.060 490 HG2 ARG 68 2HG ARG 68 0.227 8.273 14.729 491 HG3 ARG 68 1HG ARG 68 -0.519 9.880 14.453 492 HD2 ARG 68 2HD ARG 68 2.496 9.345 14.996 493 HD3 ARG 68 1HD ARG 68 1.739 9.709 13.391 494 HE ARG 68 HE ARG 68 0.951 11.743 15.295 495 HH11 ARG 68 1HH2 ARG 68 3.597 10.878 12.941 496 HH12 ARG 68 2HH2 ARG 68 4.490 12.282 13.350 497 HH21 ARG 68 1HH1 ARG 68 2.108 13.752 15.479 498 HH22 ARG 68 2HH1 ARG 68 3.602 13.970 14.587 499 H LYS 69 H LYS 69 -1.281 7.162 18.525 500 HA LYS 69 HA LYS 69 -1.696 5.023 16.831 501 HB2 LYS 69 2HB LYS 69 -2.474 5.379 19.758 502 HB3 LYS 69 1HB LYS 69 -2.617 3.834 18.841 503 HG2 LYS 69 2HG LYS 69 -0.195 3.952 18.258 504 HG3 LYS 69 1HG LYS 69 0.028 5.360 19.335 505 HD2 LYS 69 2HD LYS 69 -0.179 4.093 21.289 506 HD3 LYS 69 1HD LYS 69 -1.327 2.928 20.557 507 HE2 LYS 69 2HE LYS 69 1.710 2.970 19.933 508 HE3 LYS 69 1HE LYS 69 0.888 1.870 21.113 509 HZ1 LYS 69 3HZ LYS 69 -0.543 1.158 19.179 510 HZ2 LYS 69 1HZ LYS 69 1.106 0.713 19.091 511 HZ3 LYS 69 2HZ LYS 69 0.494 1.968 18.141 512 H VAL 70 H VAL 70 -3.985 7.517 17.838 513 HA VAL 70 HA VAL 70 -6.368 6.163 17.283 514 HB VAL 70 HB VAL 70 -5.631 9.120 16.981 515 HG11 VAL 70 1HG1 VAL 70 -7.624 8.703 15.548 516 HG12 VAL 70 2HG1 VAL 70 -8.133 9.530 17.055 517 HG13 VAL 70 3HG1 VAL 70 -8.417 7.758 16.865 518 HG21 VAL 70 3HG2 VAL 70 -7.168 7.553 19.178 519 HG22 VAL 70 1HG2 VAL 70 -6.843 9.329 19.160 520 HG23 VAL 70 2HG2 VAL 70 -5.490 8.179 19.328 521 H ALA 71 H ALA 71 -4.020 7.795 15.109 522 HA ALA 71 HA ALA 71 -5.658 7.394 12.778 523 HB1 ALA 71 1HB ALA 71 -2.646 8.061 13.012 524 HB2 ALA 71 2HB ALA 71 -3.965 9.274 12.878 525 HB3 ALA 71 3HB ALA 71 -3.641 8.150 11.513 526 H GLU 72 H GLU 72 -2.710 5.952 14.219 527 HA GLU 72 HA GLU 72 -2.028 4.008 12.465 528 HB2 GLU 72 2HB GLU 72 -0.823 4.402 14.706 529 HB3 GLU 72 1HB GLU 72 -2.225 3.626 15.515 530 HG2 GLU 72 2HG GLU 72 -1.583 1.486 14.052 531 HG3 GLU 72 1HG GLU 72 0.005 2.309 13.906 532 H GLN 73 H GLN 73 -4.454 3.670 15.117 533 HA GLN 73 HA GLN 73 -4.898 0.977 14.666 534 HB2 GLN 73 2HB GLN 73 -5.563 2.271 16.766 535 HB3 GLN 73 1HB GLN 73 -6.953 2.934 15.851 536 HG2 GLN 73 2HG GLN 73 -7.765 0.507 15.496 537 HG3 GLN 73 1HG GLN 73 -6.375 -0.046 16.498 538 HE21 GLN 73 1HE2 GLN 73 -7.379 -0.735 18.428 539 HE22 GLN 73 2HE2 GLN 73 -8.453 0.240 19.373 540 H VAL 74 H VAL 74 -6.368 3.825 13.144 541 HA VAL 74 HA VAL 74 -8.571 2.374 12.025 542 HB VAL 74 HB VAL 74 -7.387 5.125 11.390 543 HG11 VAL 74 1HG1 VAL 74 -10.090 3.851 10.545 544 HG12 VAL 74 2HG1 VAL 74 -8.742 4.327 9.448 545 HG13 VAL 74 3HG1 VAL 74 -9.649 5.589 10.343 546 HG21 VAL 74 3HG2 VAL 74 -9.177 5.969 12.842 547 HG22 VAL 74 1HG2 VAL 74 -8.266 4.757 13.779 548 HG23 VAL 74 2HG2 VAL 74 -9.855 4.306 13.074 549 H MET 75 H MET 75 -5.296 3.371 10.993 550 HA MET 75 HA MET 75 -5.544 2.673 8.292 551 HB2 MET 75 2HB MET 75 -3.076 2.589 10.132 552 HB3 MET 75 1HB MET 75 -3.019 2.455 8.343 553 HG2 MET 75 2HG MET 75 -3.815 4.710 8.032 554 HG3 MET 75 1HG MET 75 -4.266 4.889 9.743 555 HE1 MET 75 3HE MET 75 -3.071 7.226 9.643 556 HE2 MET 75 1HE MET 75 -2.568 6.899 7.951 557 HE3 MET 75 2HE MET 75 -1.362 7.470 9.156 558 H LYS 76 H LYS 76 -4.460 0.774 11.172 559 HA LYS 76 HA LYS 76 -3.872 -1.486 9.623 560 HB2 LYS 76 2HB LYS 76 -3.243 -0.978 12.177 561 HB3 LYS 76 1HB LYS 76 -4.739 -1.910 12.501 562 HG2 LYS 76 2HG LYS 76 -3.495 -3.515 10.580 563 HG3 LYS 76 1HG LYS 76 -2.060 -2.763 11.348 564 HD2 LYS 76 2HD LYS 76 -2.934 -3.657 13.603 565 HD3 LYS 76 1HD LYS 76 -4.296 -4.412 12.689 566 HE2 LYS 76 2HE LYS 76 -2.469 -5.620 11.252 567 HE3 LYS 76 1HE LYS 76 -1.275 -5.087 12.503 568 HZ1 LYS 76 3HZ LYS 76 -3.636 -6.869 12.813 569 HZ2 LYS 76 1HZ LYS 76 -2.707 -6.285 14.154 570 HZ3 LYS 76 2HZ LYS 76 -1.950 -7.238 12.992 571 H ALA 77 H ALA 77 -6.912 -0.379 11.087 572 HA ALA 77 HA ALA 77 -8.341 -2.782 10.758 573 HB1 ALA 77 1HB ALA 77 -9.414 0.111 10.664 574 HB2 ALA 77 2HB ALA 77 -9.210 -0.871 12.160 575 HB3 ALA 77 3HB ALA 77 -10.403 -1.376 10.906 576 H GLY 78 H GLY 78 -7.748 0.010 8.584 577 HA2 GLY 78 2HA GLY 78 -9.453 -0.875 6.511 578 HA3 GLY 78 1HA GLY 78 -8.075 0.291 6.409 579 H ILE 79 H ILE 79 -5.935 -1.234 7.071 580 HA ILE 79 HA ILE 79 -5.417 -2.644 4.728 581 HB ILE 79 HB ILE 79 -4.003 -2.646 7.431 582 HG12 ILE 79 2HG1 ILE 79 -3.307 -1.236 4.768 583 HG13 ILE 79 1HG1 ILE 79 -4.189 -0.441 6.097 584 HG21 ILE 79 1HG2 ILE 79 -3.032 -3.778 4.713 585 HG22 ILE 79 2HG2 ILE 79 -3.363 -4.738 6.201 586 HG23 ILE 79 3HG2 ILE 79 -2.004 -3.579 6.176 587 HD11 ILE 79 3HD ILE 79 -1.302 -1.530 6.259 588 HD12 ILE 79 1HD ILE 79 -1.821 0.187 6.208 589 HD13 ILE 79 2HD ILE 79 -2.226 -0.825 7.643 590 H GLU 80 H GLU 80 -6.333 -3.891 8.039 591 HA GLU 80 HA GLU 80 -6.126 -6.570 7.228 592 HB2 GLU 80 2HB GLU 80 -7.799 -5.415 9.522 593 HB3 GLU 80 1HB GLU 80 -7.684 -7.165 9.132 594 HG2 GLU 80 2HG GLU 80 -5.155 -7.027 9.424 595 HG3 GLU 80 1HG GLU 80 -5.377 -5.363 10.071 596 H VAL 81 H VAL 81 -8.864 -4.251 6.904 597 HA VAL 81 HA VAL 81 -10.731 -6.207 6.106 598 HB VAL 81 HB VAL 81 -10.488 -3.198 5.800 599 HG11 VAL 81 1HG1 VAL 81 -11.569 -3.744 3.684 600 HG12 VAL 81 2HG1 VAL 81 -12.859 -3.231 4.815 601 HG13 VAL 81 3HG1 VAL 81 -12.625 -4.979 4.465 602 HG21 VAL 81 3HG2 VAL 81 -12.529 -5.080 7.184 603 HG22 VAL 81 1HG2 VAL 81 -12.470 -3.289 7.321 604 HG23 VAL 81 2HG2 VAL 81 -11.136 -4.280 8.001 605 H PHE 82 H PHE 82 -8.576 -4.054 4.144 606 HA PHE 82 HA PHE 82 -9.507 -5.176 1.715 607 HB2 PHE 82 2HB PHE 82 -6.893 -3.629 2.279 608 HB3 PHE 82 1HB PHE 82 -7.537 -3.997 0.639 609 HD1 PHE 82 2HD PHE 82 -10.315 -3.389 0.593 610 HD2 PHE 82 1HD PHE 82 -7.205 -1.383 2.785 611 HE1 PHE 82 2HE PHE 82 -11.660 -1.322 0.612 612 HE2 PHE 82 1HE PHE 82 -8.553 0.680 2.809 613 HZ PHE 82 HZ PHE 82 -10.782 0.726 1.716 614 H ALA 83 H ALA 83 -7.029 -6.188 3.994 615 HA ALA 83 HA ALA 83 -5.808 -8.009 2.128 616 HB1 ALA 83 1HB ALA 83 -4.488 -7.071 4.047 617 HB2 ALA 83 2HB ALA 83 -4.559 -8.869 4.113 618 HB3 ALA 83 3HB ALA 83 -5.607 -7.877 5.203 619 H LEU 84 H LEU 84 -8.376 -8.138 4.626 620 HA LEU 84 HA LEU 84 -8.364 -10.872 5.022 621 HB2 LEU 84 2HB LEU 84 -9.436 -9.294 6.560 622 HB3 LEU 84 1HB LEU 84 -10.701 -8.902 5.358 623 HG LEU 84 HG LEU 84 -10.377 -11.817 6.152 624 HD11 LEU 84 1HD1 LEU 84 -11.494 -9.750 8.151 625 HD12 LEU 84 2HD1 LEU 84 -9.974 -10.705 8.332 626 HD13 LEU 84 3HD1 LEU 84 -11.565 -11.547 8.319 627 HD21 LEU 84 3HD2 LEU 84 -12.880 -10.008 5.938 628 HD22 LEU 84 1HD2 LEU 84 -12.870 -11.793 6.183 629 HD23 LEU 84 2HD2 LEU 84 -12.266 -11.097 4.640 630 H VAL 85 H VAL 85 -9.695 -9.001 2.393 631 HA VAL 85 HA VAL 85 -11.648 -10.765 1.564 632 HB VAL 85 HB VAL 85 -11.612 -9.715 -0.609 633 HG11 VAL 85 1HG1 VAL 85 -12.011 -7.402 0.136 634 HG12 VAL 85 2HG1 VAL 85 -11.039 -7.643 1.624 635 HG13 VAL 85 3HG1 VAL 85 -12.598 -8.523 1.415 636 HG21 VAL 85 3HG2 VAL 85 -8.863 -8.651 0.312 637 HG22 VAL 85 1HG2 VAL 85 -9.788 -7.925 -1.050 638 HG23 VAL 85 2HG2 VAL 85 -9.226 -9.625 -1.140 639 H THR 86 H THR 86 -8.268 -11.338 1.593 640 HA THR 86 HA THR 86 -7.741 -13.046 -0.428 641 HB THR 86 HB THR 86 -6.966 -13.386 2.499 642 HG1 THR 86 1HG THR 86 -6.260 -11.404 1.862 643 HG21 THR 86 3HG2 THR 86 -4.916 -14.465 1.534 644 HG22 THR 86 1HG2 THR 86 -5.561 -14.257 -0.125 645 HG23 THR 86 2HG2 THR 86 -6.367 -15.396 1.034 646 H ALA 87 H ALA 87 -9.955 -13.610 2.274 647 HA ALA 87 HA ALA 87 -10.418 -16.301 2.137 648 HB1 ALA 87 1HB ALA 87 -11.511 -14.743 3.769 649 HB2 ALA 87 2HB ALA 87 -12.746 -15.729 2.921 650 HB3 ALA 87 3HB ALA 87 -12.474 -14.018 2.437 651 H ALA 88 H ALA 88 -11.556 -13.785 -0.105 652 HA ALA 88 HA ALA 88 -13.031 -15.794 -1.683 653 HB1 ALA 88 1HB ALA 88 -14.404 -13.843 -0.764 654 HB2 ALA 88 2HB ALA 88 -14.327 -13.840 -2.565 655 HB3 ALA 88 3HB ALA 88 -13.297 -12.719 -1.622 656 H LEU 89 H LEU 89 -10.656 -13.162 -1.668 657 HA LEU 89 HA LEU 89 -10.380 -12.965 -4.425 658 HB2 LEU 89 2HB LEU 89 -9.867 -11.147 -2.810 659 HB3 LEU 89 1HB LEU 89 -8.546 -12.128 -2.107 660 HG LEU 89 HG LEU 89 -7.301 -12.031 -4.250 661 HD11 LEU 89 1HD1 LEU 89 -9.214 -11.772 -5.861 662 HD12 LEU 89 2HD1 LEU 89 -7.987 -10.495 -6.068 663 HD13 LEU 89 3HD1 LEU 89 -9.528 -10.114 -5.216 664 HD21 LEU 89 3HD2 LEU 89 -8.110 -9.256 -3.166 665 HD22 LEU 89 1HD2 LEU 89 -6.579 -9.682 -3.999 666 HD23 LEU 89 2HD2 LEU 89 -6.936 -10.377 -2.393 667 H ALA 90 H ALA 90 -8.498 -14.879 -1.939 668 HA ALA 90 HA ALA 90 -6.544 -15.497 -3.961 669 HB1 ALA 90 1HB ALA 90 -5.613 -17.151 -2.294 670 HB2 ALA 90 2HB ALA 90 -6.911 -16.625 -1.154 671 HB3 ALA 90 3HB ALA 90 -5.675 -15.451 -1.740 672 H THR 91 H THR 91 -9.500 -17.071 -2.732 673 HA THR 91 HA THR 91 -8.888 -19.533 -4.055 674 HB THR 91 HB THR 91 -10.356 -19.506 -2.137 675 HG1 THR 91 1HG THR 91 -11.501 -20.400 -4.514 676 HG21 THR 91 3HG2 THR 91 -12.357 -17.925 -3.878 677 HG22 THR 91 1HG2 THR 91 -11.509 -17.358 -2.392 678 HG23 THR 91 2HG2 THR 91 -12.721 -18.672 -2.281 679 H ASP 92 H ASP 92 -9.461 -16.475 -5.345 680 HA ASP 92 HA ASP 92 -11.454 -17.123 -7.195 681 HB2 ASP 92 2HB ASP 92 -10.631 -14.742 -6.449 682 HB3 ASP 92 1HB ASP 92 -9.412 -14.922 -7.749 683 H PHE 93 H PHE 93 -7.964 -17.720 -7.104 684 HA PHE 93 HA PHE 93 -7.848 -18.290 -9.907 685 HB2 PHE 93 2HB PHE 93 -5.676 -18.893 -9.762 686 HB3 PHE 93 1HB PHE 93 -5.772 -17.760 -8.382 687 HD1 PHE 93 2HD PHE 93 -5.443 -21.313 -9.450 688 HD2 PHE 93 1HD PHE 93 -5.454 -18.638 -6.093 689 HE1 PHE 93 2HE PHE 93 -4.542 -23.110 -8.020 690 HE2 PHE 93 1HE PHE 93 -4.525 -20.422 -4.663 691 HZ PHE 93 HZ PHE 93 -4.072 -22.670 -5.620 692 H VAL 94 H VAL 94 -8.753 -20.077 -7.018 693 HA VAL 94 HA VAL 94 -8.258 -22.650 -7.995 694 HB VAL 94 HB VAL 94 -10.161 -21.778 -5.757 695 HG11 VAL 94 1HG1 VAL 94 -8.700 -24.454 -6.315 696 HG12 VAL 94 2HG1 VAL 94 -10.480 -24.178 -6.371 697 HG13 VAL 94 3HG1 VAL 94 -9.609 -24.057 -4.808 698 HG21 VAL 94 3HG2 VAL 94 -8.163 -22.108 -4.269 699 HG22 VAL 94 1HG2 VAL 94 -7.829 -20.807 -5.452 700 HG23 VAL 94 2HG2 VAL 94 -7.136 -22.445 -5.706 701 H ARG 95 H ARG 95 -10.832 -20.377 -8.458 702 HA ARG 95 HA ARG 95 -12.972 -21.940 -9.238 703 HB2 ARG 95 2HB ARG 95 -11.935 -19.358 -10.567 704 HB3 ARG 95 1HB ARG 95 -13.564 -20.066 -10.819 705 HG2 ARG 95 2HG ARG 95 -14.198 -19.602 -8.491 706 HG3 ARG 95 1HG ARG 95 -12.546 -18.976 -8.127 707 HD2 ARG 95 2HD ARG 95 -12.815 -17.155 -9.813 708 HD3 ARG 95 1HD ARG 95 -14.429 -17.767 -10.292 709 HE ARG 95 HE ARG 95 -13.648 -16.142 -7.977 710 HH11 ARG 95 1HH2 ARG 95 -16.272 -17.778 -9.723 711 HH12 ARG 95 2HH2 ARG 95 -17.439 -16.716 -9.148 712 HH21 ARG 95 1HH1 ARG 95 -15.361 -15.406 -6.481 713 HH22 ARG 95 2HH1 ARG 95 -16.987 -15.546 -6.940 714 H ARG 96 H ARG 96 -9.871 -21.367 -10.921 715 HA ARG 96 HA ARG 96 -10.819 -21.868 -13.505 716 HB2 ARG 96 2HB ARG 96 -8.538 -21.947 -14.244 717 HB3 ARG 96 1HB ARG 96 -8.561 -20.777 -12.881 718 HG2 ARG 96 2HG ARG 96 -7.833 -22.755 -11.373 719 HG3 ARG 96 1HG ARG 96 -7.591 -23.695 -12.889 720 HD2 ARG 96 2HD ARG 96 -5.741 -22.192 -13.589 721 HD3 ARG 96 1HD ARG 96 -5.983 -21.190 -12.075 722 HE ARG 96 HE ARG 96 -5.843 -23.888 -11.186 723 HH11 ARG 96 1HH2 ARG 96 -3.465 -21.798 -12.988 724 HH12 ARG 96 2HH2 ARG 96 -2.149 -22.474 -12.170 725 HH21 ARG 96 1HH1 ARG 96 -4.176 -24.957 -10.460 726 HH22 ARG 96 2HH1 ARG 96 -2.522 -24.586 -10.823 727 H GLU 97 H GLU 97 -9.845 -24.050 -10.865 728 HA GLU 97 HA GLU 97 -9.546 -26.246 -12.778 729 HB2 GLU 97 2HB GLU 97 -8.477 -25.748 -10.023 730 HB3 GLU 97 1HB GLU 97 -8.841 -27.452 -10.458 731 HG2 GLU 97 2HG GLU 97 -7.331 -27.511 -12.279 732 HG3 GLU 97 1HG GLU 97 -7.251 -25.717 -12.425 733 H GLU 98 H GLU 98 -10.595 -28.262 -12.308 734 HA GLU 98 HA GLU 98 -12.382 -29.403 -12.305 735 HB2 GLU 98 2HB GLU 98 -13.326 -27.734 -9.955 736 HB3 GLU 98 1HB GLU 98 -14.285 -29.069 -10.655 737 HG2 GLU 98 2HG GLU 98 -11.376 -29.433 -9.661 738 HG3 GLU 98 1HG GLU 98 -12.834 -29.727 -8.645 739 H GLU 99 H GLU 99 -13.347 -25.959 -12.160 740 HA GLU 99 HA GLU 99 -15.612 -26.044 -13.734 741 HB2 GLU 99 2HB GLU 99 -14.903 -24.026 -12.509 742 HB3 GLU 99 1HB GLU 99 -13.356 -24.002 -13.415 743 HG2 GLU 99 2HG GLU 99 -14.725 -22.162 -14.092 744 HG3 GLU 99 1HG GLU 99 -14.510 -23.270 -15.479 745 H ARG 100 H ARG 100 -12.161 -25.651 -14.747 746 HA ARG 100 HA ARG 100 -12.725 -25.480 -17.444 747 HB2 ARG 100 2HB ARG 100 -10.374 -25.880 -17.892 748 HB3 ARG 100 1HB ARG 100 -10.579 -24.786 -16.494 749 HG2 ARG 100 2HG ARG 100 -10.163 -26.799 -14.951 750 HG3 ARG 100 1HG ARG 100 -9.794 -27.761 -16.429 751 HD2 ARG 100 2HD ARG 100 -8.011 -25.904 -16.991 752 HD3 ARG 100 1HD ARG 100 -8.290 -25.278 -15.330 753 HE ARG 100 HE ARG 100 -7.036 -27.054 -14.488 754 HH11 ARG 100 1HH2 ARG 100 -7.888 -27.833 -17.895 755 HH12 ARG 100 2HH2 ARG 100 -6.708 -29.045 -18.079 756 HH21 ARG 100 1HH1 ARG 100 -5.354 -28.690 -14.725 757 HH22 ARG 100 2HH1 ARG 100 -5.045 -29.301 -16.300 758 H ARG 101 H ARG 101 -12.789 -28.351 -15.442 759 HA ARG 101 HA ARG 101 -12.284 -30.146 -17.668 760 HB2 ARG 101 2HB ARG 101 -13.254 -30.735 -14.803 761 HB3 ARG 101 1HB ARG 101 -12.802 -31.952 -16.048 762 HG2 ARG 101 2HG ARG 101 -10.494 -31.007 -16.136 763 HG3 ARG 101 1HG ARG 101 -10.887 -29.881 -14.787 764 HD2 ARG 101 2HD ARG 101 -11.247 -31.755 -13.227 765 HD3 ARG 101 1HD ARG 101 -11.148 -32.964 -14.571 766 HE ARG 101 HE ARG 101 -8.764 -32.173 -14.942 767 HH11 ARG 101 1HH2 ARG 101 -10.183 -32.102 -11.544 768 HH12 ARG 101 2HH2 ARG 101 -8.742 -32.728 -10.875 769 HH21 ARG 101 1HH1 ARG 101 -6.908 -32.869 -13.987 770 HH22 ARG 101 2HH1 ARG 101 -6.747 -33.171 -12.302 771 H GLY 102 H GLY 102 -14.953 -28.409 -16.238 772 HA2 GLY 102 2HA GLY 102 -17.057 -28.245 -16.861 773 HA3 GLY 102 1HA GLY 102 -16.655 -29.270 -18.292 774 H HIS 103 H HIS 103 -16.414 -30.137 -14.817 775 HA HIS 103 HA HIS 103 -18.398 -32.279 -15.341 776 HB2 HIS 103 2HB HIS 103 -15.976 -32.310 -13.448 777 HB3 HIS 103 1HB HIS 103 -17.293 -33.536 -13.463 778 HD1 HIS 103 1HD HIS 103 -15.028 -35.112 -13.945 779 HD2 HIS 103 2HD HIS 103 -16.336 -32.657 -17.140 780 HE1 HIS 103 1HE HIS 103 -14.122 -36.085 -16.076 781 HE2 HIS 103 2HE HIS 103 -14.843 -34.605 -17.961 782 H1 SER 1 H SER 1 -3.744 -15.218 -23.851 783 HA SER 1 HA SER 1 -1.684 -14.730 -22.126 784 HB2 SER 1 2HB SER 1 -3.129 -13.062 -20.645 785 HB3 SER 1 1HB SER 1 -2.149 -12.385 -21.986 786 HG SER 1 1HG SER 1 -4.033 -11.495 -22.328 787 H ALA 2 H ALA 2 -2.443 -15.713 -20.013 788 HA ALA 2 HA ALA 2 -4.323 -17.795 -20.712 789 HB1 ALA 2 1HB ALA 2 -2.891 -17.357 -18.026 790 HB2 ALA 2 2HB ALA 2 -2.272 -18.357 -19.383 791 HB3 ALA 2 3HB ALA 2 -3.784 -18.838 -18.547 792 H ASP 3 H ASP 3 -6.068 -18.414 -18.953 793 HA ASP 3 HA ASP 3 -7.937 -16.506 -19.188 794 HB2 ASP 3 2HB ASP 3 -7.972 -18.793 -17.106 795 HB3 ASP 3 1HB ASP 3 -9.402 -17.922 -17.778 796 H HIS 4 H HIS 4 -5.842 -17.086 -16.433 797 HA HIS 4 HA HIS 4 -7.312 -15.248 -14.731 798 HB2 HIS 4 2HB HIS 4 -5.684 -15.683 -13.018 799 HB3 HIS 4 1HB HIS 4 -6.094 -17.254 -13.759 800 HD1 HIS 4 1HD HIS 4 -3.814 -18.672 -14.215 801 HD2 HIS 4 2HD HIS 4 -3.197 -14.488 -14.103 802 HE1 HIS 4 1HE HIS 4 -1.376 -18.273 -14.184 803 HE2 HIS 4 2HE HIS 4 -0.983 -15.809 -14.049 804 H GLU 5 H GLU 5 -4.788 -15.039 -17.139 805 HA GLU 5 HA GLU 5 -3.445 -12.766 -15.916 806 HB2 GLU 5 2HB GLU 5 -3.061 -14.142 -18.649 807 HB3 GLU 5 1HB GLU 5 -1.992 -12.883 -17.960 808 HG2 GLU 5 2HG GLU 5 -1.273 -14.401 -16.149 809 HG3 GLU 5 1HG GLU 5 -2.453 -15.665 -16.684 810 H ARG 6 H ARG 6 -5.598 -13.695 -18.578 811 HA ARG 6 HA ARG 6 -5.671 -11.306 -19.933 812 HB2 ARG 6 2HB ARG 6 -6.473 -13.575 -20.678 813 HB3 ARG 6 1HB ARG 6 -7.911 -13.401 -19.622 814 HG2 ARG 6 2HG ARG 6 -8.655 -11.403 -20.908 815 HG3 ARG 6 1HG ARG 6 -7.188 -11.476 -21.940 816 HD2 ARG 6 2HD ARG 6 -9.354 -13.681 -21.704 817 HD3 ARG 6 1HD ARG 6 -9.193 -12.518 -23.069 818 HE ARG 6 HE ARG 6 -6.665 -13.864 -22.610 819 HH11 ARG 6 1HH2 ARG 6 -9.826 -14.352 -24.227 820 HH12 ARG 6 2HH2 ARG 6 -9.694 -16.038 -24.385 821 HH21 ARG 6 1HH1 ARG 6 -6.258 -16.160 -23.133 822 HH22 ARG 6 2HH1 ARG 6 -7.490 -17.085 -23.898 823 H GLU 7 H GLU 7 -7.946 -12.529 -17.367 824 HA GLU 7 HA GLU 7 -9.431 -10.160 -17.371 825 HB2 GLU 7 2HB GLU 7 -9.324 -12.642 -15.744 826 HB3 GLU 7 1HB GLU 7 -9.827 -11.199 -14.804 827 HG2 GLU 7 2HG GLU 7 -11.765 -12.453 -15.761 828 HG3 GLU 7 1HG GLU 7 -11.694 -10.732 -16.276 829 H ALA 8 H ALA 8 -6.350 -10.915 -15.832 830 HA ALA 8 HA ALA 8 -6.456 -8.754 -13.979 831 HB1 ALA 8 1HB ALA 8 -3.991 -9.037 -13.778 832 HB2 ALA 8 2HB ALA 8 -3.988 -10.156 -15.184 833 HB3 ALA 8 3HB ALA 8 -4.828 -10.628 -13.659 834 H GLN 9 H GLN 9 -5.440 -9.124 -17.376 835 HA GLN 9 HA GLN 9 -4.225 -6.591 -17.643 836 HB2 GLN 9 2HB GLN 9 -3.890 -8.470 -19.252 837 HB3 GLN 9 1HB GLN 9 -5.597 -8.368 -19.769 838 HG2 GLN 9 2HG GLN 9 -3.621 -6.015 -20.087 839 HG3 GLN 9 1HG GLN 9 -3.752 -7.347 -21.292 840 HE21 GLN 9 1HE2 GLN 9 -4.707 -4.234 -21.024 841 HE22 GLN 9 2HE2 GLN 9 -6.219 -4.274 -21.810 842 H LYS 10 H LYS 10 -7.559 -7.787 -18.218 843 HA LYS 10 HA LYS 10 -8.572 -5.361 -19.162 844 HB2 LYS 10 2HB LYS 10 -10.084 -7.571 -17.645 845 HB3 LYS 10 1HB LYS 10 -10.844 -6.220 -18.554 846 HG2 LYS 10 2HG LYS 10 -9.688 -7.060 -20.665 847 HG3 LYS 10 1HG LYS 10 -9.151 -8.502 -19.737 848 HD2 LYS 10 2HD LYS 10 -11.596 -8.959 -19.140 849 HD3 LYS 10 1HD LYS 10 -12.072 -7.623 -20.238 850 HE2 LYS 10 2HE LYS 10 -10.685 -10.294 -20.972 851 HE3 LYS 10 1HE LYS 10 -12.361 -9.771 -21.389 852 HZ1 LYS 10 3HZ LYS 10 -9.767 -8.874 -22.508 853 HZ2 LYS 10 1HZ LYS 10 -11.086 -7.844 -22.617 854 HZ3 LYS 10 2HZ LYS 10 -11.194 -9.400 -23.289 855 H ALA 11 H ALA 11 -8.090 -6.557 -15.858 856 HA ALA 11 HA ALA 11 -9.684 -4.668 -14.549 857 HB1 ALA 11 1HB ALA 11 -8.398 -5.276 -12.510 858 HB2 ALA 11 2HB ALA 11 -7.117 -6.036 -13.512 859 HB3 ALA 11 3HB ALA 11 -8.767 -6.755 -13.456 860 H GLU 12 H GLU 12 -6.153 -4.611 -15.429 861 HA GLU 12 HA GLU 12 -5.779 -2.103 -14.185 862 HB2 GLU 12 2HB GLU 12 -3.939 -3.884 -15.110 863 HB3 GLU 12 1HB GLU 12 -3.949 -2.774 -16.511 864 HG2 GLU 12 2HG GLU 12 -3.849 -1.067 -14.186 865 HG3 GLU 12 1HG GLU 12 -2.818 -2.471 -13.762 866 H GLU 13 H GLU 13 -6.570 -3.086 -17.496 867 HA GLU 13 HA GLU 13 -6.452 -0.663 -18.826 868 HB2 GLU 13 2HB GLU 13 -6.777 -2.964 -19.841 869 HB3 GLU 13 1HB GLU 13 -8.398 -3.035 -19.102 870 HG2 GLU 13 2HG GLU 13 -8.847 -2.608 -21.334 871 HG3 GLU 13 1HG GLU 13 -9.036 -0.990 -20.584 872 H GLU 14 H GLU 14 -9.093 -2.136 -16.906 873 HA GLU 14 HA GLU 14 -11.070 -0.258 -17.438 874 HB2 GLU 14 2HB GLU 14 -11.362 -2.581 -16.331 875 HB3 GLU 14 1HB GLU 14 -10.672 -1.870 -14.843 876 HG2 GLU 14 2HG GLU 14 -12.980 -1.840 -14.439 877 HG3 GLU 14 1HG GLU 14 -12.680 -0.148 -14.955 878 H LEU 15 H LEU 15 -8.476 -0.350 -14.988 879 HA LEU 15 HA LEU 15 -9.435 1.617 -13.315 880 HB2 LEU 15 2HB LEU 15 -7.406 0.079 -12.942 881 HB3 LEU 15 1HB LEU 15 -6.464 1.135 -14.008 882 HG LEU 15 HG LEU 15 -6.760 3.065 -12.485 883 HD11 LEU 15 1HD1 LEU 15 -7.750 2.747 -10.173 884 HD12 LEU 15 2HD1 LEU 15 -8.385 1.150 -10.683 885 HD13 LEU 15 3HD1 LEU 15 -8.964 2.659 -11.479 886 HD21 LEU 15 3HD2 LEU 15 -4.819 1.522 -12.231 887 HD22 LEU 15 1HD2 LEU 15 -5.724 0.557 -11.014 888 HD23 LEU 15 2HD2 LEU 15 -5.283 2.262 -10.665 889 H GLN 16 H GLN 16 -7.478 1.845 -16.236 890 HA GLN 16 HA GLN 16 -6.757 4.537 -16.035 891 HB2 GLN 16 2HB GLN 16 -7.094 2.744 -18.500 892 HB3 GLN 16 1HB GLN 16 -6.152 4.274 -18.460 893 HG2 GLN 16 2HG GLN 16 -4.500 3.310 -16.906 894 HG3 GLN 16 1HG GLN 16 -5.499 1.843 -16.633 895 HE21 GLN 16 1HE2 GLN 16 -3.473 0.597 -17.376 896 HE22 GLN 16 2HE2 GLN 16 -3.306 0.380 -19.067 897 H LYS 17 H LYS 17 -9.699 2.956 -17.142 898 HA LYS 17 HA LYS 17 -10.731 5.205 -18.578 899 HB2 LYS 17 2HB LYS 17 -11.248 2.676 -18.892 900 HB3 LYS 17 1HB LYS 17 -12.252 2.802 -17.417 901 HG2 LYS 17 2HG LYS 17 -13.666 4.579 -18.647 902 HG3 LYS 17 1HG LYS 17 -12.617 4.328 -20.082 903 HD2 LYS 17 2HD LYS 17 -14.521 2.944 -20.495 904 HD3 LYS 17 1HD LYS 17 -13.228 1.822 -19.937 905 HE2 LYS 17 2HE LYS 17 -14.347 2.161 -17.515 906 HE3 LYS 17 1HE LYS 17 -15.746 2.816 -18.445 907 HZ1 LYS 17 3HZ LYS 17 -15.295 0.489 -19.731 908 HZ2 LYS 17 1HZ LYS 17 -16.278 0.664 -18.327 909 HZ3 LYS 17 2HZ LYS 17 -14.659 0.126 -18.204 910 H VAL 18 H VAL 18 -10.809 3.980 -15.243 911 HA VAL 18 HA VAL 18 -12.948 5.643 -14.368 912 HB VAL 18 HB VAL 18 -10.709 4.330 -12.736 913 HG11 VAL 18 1HG1 VAL 18 -13.447 5.513 -11.895 914 HG12 VAL 18 2HG1 VAL 18 -11.824 6.165 -11.453 915 HG13 VAL 18 3HG1 VAL 18 -12.346 4.565 -10.827 916 HG21 VAL 18 3HG2 VAL 18 -12.466 2.563 -12.296 917 HG22 VAL 18 1HG2 VAL 18 -12.028 2.640 -14.032 918 HG23 VAL 18 2HG2 VAL 18 -13.568 3.378 -13.468 919 H LEU 19 H LEU 19 -9.395 5.923 -14.666 920 HA LEU 19 HA LEU 19 -9.124 8.267 -13.204 921 HB2 LEU 19 2HB LEU 19 -7.437 7.548 -15.664 922 HB3 LEU 19 1HB LEU 19 -7.014 8.701 -14.358 923 HG LEU 19 HG LEU 19 -7.212 5.647 -14.203 924 HD11 LEU 19 1HD1 LEU 19 -4.889 7.598 -13.672 925 HD12 LEU 19 2HD1 LEU 19 -5.110 6.588 -15.149 926 HD13 LEU 19 3HD1 LEU 19 -4.817 5.803 -13.551 927 HD21 LEU 19 3HD2 LEU 19 -8.204 6.374 -12.086 928 HD22 LEU 19 1HD2 LEU 19 -6.883 7.578 -11.826 929 HD23 LEU 19 2HD2 LEU 19 -6.524 5.817 -11.792 930 H GLU 20 H GLU 20 -9.908 7.842 -16.719 931 HA GLU 20 HA GLU 20 -9.818 10.558 -17.329 932 HB2 GLU 20 2HB GLU 20 -11.705 8.501 -18.631 933 HB3 GLU 20 1HB GLU 20 -11.230 10.107 -19.278 934 HG2 GLU 20 2HG GLU 20 -8.765 9.217 -19.230 935 HG3 GLU 20 1HG GLU 20 -9.480 7.585 -18.975 936 H GLU 21 H GLU 21 -12.529 8.540 -16.129 937 HA GLU 21 HA GLU 21 -14.422 10.622 -16.223 938 HB2 GLU 21 2HB GLU 21 -14.772 8.018 -16.053 939 HB3 GLU 21 1HB GLU 21 -14.598 8.252 -14.287 940 HG2 GLU 21 2HG GLU 21 -16.516 10.029 -14.524 941 HG3 GLU 21 1HG GLU 21 -16.702 9.448 -16.221 942 H ALA 22 H ALA 22 -12.272 9.363 -13.668 943 HA ALA 22 HA ALA 22 -13.221 10.930 -11.565 944 HB1 ALA 22 1HB ALA 22 -11.048 10.393 -10.439 945 HB2 ALA 22 2HB ALA 22 -10.393 9.779 -12.001 946 HB3 ALA 22 3HB ALA 22 -11.757 8.923 -11.200 947 H SER 23 H SER 23 -10.873 11.605 -14.142 948 HA SER 23 HA SER 23 -9.687 13.871 -12.976 949 HB2 SER 23 2HB SER 23 -10.173 13.331 -15.988 950 HB3 SER 23 1HB SER 23 -8.990 14.498 -15.285 951 HG SER 23 1HG SER 23 -9.038 11.651 -15.027 952 H LYS 24 H LYS 24 -12.496 13.440 -15.128 953 HA LYS 24 HA LYS 24 -13.165 16.136 -15.481 954 HB2 LYS 24 2HB LYS 24 -14.022 14.174 -16.836 955 HB3 LYS 24 1HB LYS 24 -14.952 13.605 -15.424 956 HG2 LYS 24 2HG LYS 24 -15.459 16.214 -17.006 957 HG3 LYS 24 1HG LYS 24 -16.331 14.656 -17.166 958 HD2 LYS 24 2HD LYS 24 -16.843 14.957 -14.571 959 HD3 LYS 24 1HD LYS 24 -16.441 16.684 -14.899 960 HE2 LYS 24 2HE LYS 24 -18.251 16.624 -16.756 961 HE3 LYS 24 1HE LYS 24 -18.705 14.983 -16.139 962 HZ1 LYS 24 3HZ LYS 24 -18.833 17.616 -14.791 963 HZ2 LYS 24 1HZ LYS 24 -18.890 16.195 -13.872 964 HZ3 LYS 24 2HZ LYS 24 -20.090 16.447 -15.066 965 H LYS 25 H LYS 25 -14.251 13.638 -13.146 966 HA LYS 25 HA LYS 25 -16.015 15.270 -11.721 967 HB2 LYS 25 2HB LYS 25 -14.387 12.826 -10.810 968 HB3 LYS 25 1HB LYS 25 -15.653 13.610 -9.800 969 HG2 LYS 25 2HG LYS 25 -17.415 13.036 -11.293 970 HG3 LYS 25 1HG LYS 25 -16.284 12.437 -12.562 971 HD2 LYS 25 2HD LYS 25 -15.659 10.499 -11.268 972 HD3 LYS 25 1HD LYS 25 -16.269 11.211 -9.738 973 HE2 LYS 25 2HE LYS 25 -17.738 9.332 -10.619 974 HE3 LYS 25 1HE LYS 25 -18.592 10.904 -10.356 975 HZ1 LYS 25 3HZ LYS 25 -18.212 9.416 -12.792 976 HZ2 LYS 25 1HZ LYS 25 -17.748 11.044 -12.937 977 HZ3 LYS 25 2HZ LYS 25 -19.298 10.675 -12.376 978 H ALA 26 H ALA 26 -12.517 14.611 -11.228 979 HA ALA 26 HA ALA 26 -12.299 15.715 -8.726 980 HB1 ALA 26 1HB ALA 26 -10.161 15.651 -10.953 981 HB2 ALA 26 2HB ALA 26 -10.472 14.342 -9.756 982 HB3 ALA 26 3HB ALA 26 -9.833 15.933 -9.203 983 H VAL 27 H VAL 27 -11.859 17.365 -11.933 984 HA VAL 27 HA VAL 27 -11.095 19.777 -10.606 985 HB VAL 27 HB VAL 27 -10.241 19.380 -12.797 986 HG11 VAL 27 1HG1 VAL 27 -12.140 18.054 -13.777 987 HG12 VAL 27 2HG1 VAL 27 -11.640 19.406 -14.841 988 HG13 VAL 27 3HG1 VAL 27 -13.140 19.547 -13.863 989 HG21 VAL 27 3HG2 VAL 27 -12.171 21.797 -12.768 990 HG22 VAL 27 1HG2 VAL 27 -10.705 21.605 -13.787 991 HG23 VAL 27 2HG2 VAL 27 -10.545 21.715 -11.995 992 H GLU 28 H GLU 28 -14.230 18.486 -11.892 993 HA GLU 28 HA GLU 28 -15.454 21.011 -11.291 994 HB2 GLU 28 2HB GLU 28 -16.837 18.431 -12.119 995 HB3 GLU 28 1HB GLU 28 -17.594 20.049 -11.889 996 HG2 GLU 28 2HG GLU 28 -15.745 20.926 -13.549 997 HG3 GLU 28 1HG GLU 28 -15.535 19.205 -14.024 998 H ALA 29 H ALA 29 -14.557 18.368 -9.322 999 HA ALA 29 HA ALA 29 -16.646 18.495 -7.446 1000 HB1 ALA 29 1HB ALA 29 -13.678 17.754 -7.000 1001 HB2 ALA 29 2HB ALA 29 -14.975 16.605 -7.503 1002 HB3 ALA 29 3HB ALA 29 -15.050 17.382 -5.887 1003 H GLU 30 H GLU 30 -13.990 20.612 -8.153 1004 HA GLU 30 HA GLU 30 -14.013 21.715 -5.455 1005 HB2 GLU 30 2HB GLU 30 -12.114 22.423 -7.726 1006 HB3 GLU 30 1HB GLU 30 -11.870 22.582 -5.955 1007 HG2 GLU 30 2HG GLU 30 -12.400 19.736 -6.464 1008 HG3 GLU 30 1HG GLU 30 -11.368 20.312 -7.812 1009 H ARG 31 H ARG 31 -15.811 22.007 -8.216 1010 HA ARG 31 HA ARG 31 -16.202 24.906 -7.976 1011 HB2 ARG 31 2HB ARG 31 -17.261 22.884 -10.031 1012 HB3 ARG 31 1HB ARG 31 -17.603 24.643 -10.043 1013 HG2 ARG 31 2HG ARG 31 -14.774 23.383 -10.244 1014 HG3 ARG 31 1HG ARG 31 -15.760 23.835 -11.658 1015 HD2 ARG 31 2HD ARG 31 -14.858 25.854 -9.458 1016 HD3 ARG 31 1HD ARG 31 -14.008 25.578 -11.035 1017 HE ARG 31 HE ARG 31 -16.528 26.000 -11.932 1018 HH11 ARG 31 1HH2 ARG 31 -14.937 28.065 -9.408 1019 HH12 ARG 31 2HH2 ARG 31 -15.093 29.492 -10.288 1020 HH21 ARG 31 1HH1 ARG 31 -16.968 27.864 -12.964 1021 HH22 ARG 31 2HH1 ARG 31 -16.468 29.428 -12.443 1022 H GLY 32 H GLY 32 -17.049 24.565 -5.798 1023 HA2 GLY 32 2HA GLY 32 -19.630 24.767 -5.431 1024 HA3 GLY 32 1HA GLY 32 -19.435 22.961 -5.548 1025 H ALA 33 H ALA 33 -16.796 22.767 -4.556 1026 HA ALA 33 HA ALA 33 -17.535 22.703 -1.826 1027 HB1 ALA 33 1HB ALA 33 -14.889 21.981 -3.199 1028 HB2 ALA 33 2HB ALA 33 -16.257 20.840 -2.914 1029 HB3 ALA 33 3HB ALA 33 -15.333 21.515 -1.515 1030 HA PRO 34 HA PRO 34 -15.093 26.260 -0.629 1031 HB2 PRO 34 2HB PRO 34 -14.606 25.762 2.082 1032 HB3 PRO 34 1HB PRO 34 -16.232 26.211 1.435 1033 HG2 PRO 34 2HG PRO 34 -15.166 23.400 2.022 1034 HG3 PRO 34 1HG PRO 34 -16.759 24.116 2.521 1035 HD2 PRO 34 2HD PRO 34 -16.487 22.518 0.269 1036 HD3 PRO 34 1HD PRO 34 -17.632 23.929 0.274 1037 H GLY 35 H GLY 35 -12.871 26.919 -0.307 1038 HA2 GLY 35 2HA GLY 35 -10.675 26.715 -0.089 1039 HA3 GLY 35 1HA GLY 35 -10.947 25.113 0.699 1040 H ALA 36 H ALA 36 -11.791 26.193 -2.604 1041 HA ALA 36 HA ALA 36 -11.131 23.793 -3.786 1042 HB1 ALA 36 1HB ALA 36 -11.292 24.963 -5.979 1043 HB2 ALA 36 2HB ALA 36 -11.256 26.550 -5.121 1044 HB3 ALA 36 3HB ALA 36 -12.649 25.418 -4.892 1045 H ALA 37 H ALA 37 -9.335 22.893 -4.829 1046 HA ALA 37 HA ALA 37 -6.862 24.492 -4.588 1047 HB1 ALA 37 1HB ALA 37 -5.715 22.247 -4.410 1048 HB2 ALA 37 2HB ALA 37 -7.341 21.454 -4.402 1049 HB3 ALA 37 3HB ALA 37 -6.863 22.538 -3.058 1050 H LEU 38 H LEU 38 -8.541 21.857 -6.421 1051 HA LEU 38 HA LEU 38 -6.694 22.344 -8.666 1052 HB2 LEU 38 2HB LEU 38 -6.995 20.006 -7.999 1053 HB3 LEU 38 1HB LEU 38 -8.769 20.142 -8.210 1054 HG LEU 38 HG LEU 38 -8.390 20.512 -10.684 1055 HD11 LEU 38 1HD1 LEU 38 -5.438 19.777 -10.085 1056 HD12 LEU 38 2HD1 LEU 38 -6.022 21.379 -10.653 1057 HD13 LEU 38 3HD1 LEU 38 -6.198 19.937 -11.706 1058 HD21 LEU 38 3HD2 LEU 38 -8.012 18.144 -11.151 1059 HD22 LEU 38 1HD2 LEU 38 -8.961 18.314 -9.639 1060 HD23 LEU 38 2HD2 LEU 38 -7.206 17.897 -9.558 1061 H ILE 39 H ILE 39 -7.495 24.229 -9.569 1062 HA ILE 39 HA ILE 39 -10.262 24.064 -10.581 1063 HB ILE 39 HB ILE 39 -10.049 26.497 -10.953 1064 HG12 ILE 39 2HG1 ILE 39 -7.416 26.246 -9.330 1065 HG13 ILE 39 1HG1 ILE 39 -7.521 26.616 -11.087 1066 HG21 ILE 39 1HG2 ILE 39 -11.096 25.408 -8.906 1067 HG22 ILE 39 2HG2 ILE 39 -10.429 27.042 -8.561 1068 HG23 ILE 39 3HG2 ILE 39 -9.529 25.574 -8.038 1069 HD11 ILE 39 3HD ILE 39 -8.618 28.356 -8.779 1070 HD12 ILE 39 1HD ILE 39 -7.199 28.697 -9.822 1071 HD13 ILE 39 2HD ILE 39 -8.851 28.704 -10.538 1072 H SER 40 H SER 40 -7.515 22.817 -11.575 1073 HA SER 40 HA SER 40 -7.576 24.085 -14.231 1074 HB2 SER 40 2HB SER 40 -5.307 24.091 -13.109 1075 HB3 SER 40 1HB SER 40 -5.371 22.297 -13.091 1076 HG SER 40 1HG SER 40 -4.263 23.087 -14.872 1077 H TYR 41 H TYR 41 -8.366 22.942 -15.803 1078 HA TYR 41 HA TYR 41 -9.423 20.295 -15.450 1079 HB2 TYR 41 2HB TYR 41 -10.938 21.705 -16.592 1080 HB3 TYR 41 1HB TYR 41 -9.628 22.546 -17.473 1081 HD1 TYR 41 1HD TYR 41 -10.416 18.796 -17.447 1082 HD2 TYR 41 2HD TYR 41 -10.299 22.506 -19.636 1083 HE1 TYR 41 1HE TYR 41 -10.948 17.596 -19.532 1084 HE2 TYR 41 2HE TYR 41 -10.829 21.317 -21.701 1085 HH TYR 41 HH TYR 41 -11.460 19.359 -22.642 1086 HA PRO 42 HA PRO 42 -6.412 19.040 -18.686 1087 HB2 PRO 42 2HB PRO 42 -4.174 20.556 -19.500 1088 HB3 PRO 42 1HB PRO 42 -5.801 20.658 -20.279 1089 HG2 PRO 42 2HG PRO 42 -4.655 22.469 -18.080 1090 HG3 PRO 42 1HG PRO 42 -5.474 22.964 -19.623 1091 HD2 PRO 42 2HD PRO 42 -6.835 22.852 -17.244 1092 HD3 PRO 42 1HD PRO 42 -7.638 22.265 -18.779 1093 H ASP 43 H ASP 43 -5.244 20.680 -15.814 1094 HA ASP 43 HA ASP 43 -2.939 18.879 -15.665 1095 HB2 ASP 43 2HB ASP 43 -3.879 20.838 -13.508 1096 HB3 ASP 43 1HB ASP 43 -2.343 19.916 -13.554 1097 H ALA 44 H ALA 44 -6.298 18.797 -14.993 1098 HA ALA 44 HA ALA 44 -6.322 17.542 -12.477 1099 HB1 ALA 44 1HB ALA 44 -8.373 17.271 -14.787 1100 HB2 ALA 44 2HB ALA 44 -8.396 18.559 -13.537 1101 HB3 ALA 44 3HB ALA 44 -8.668 16.847 -13.063 1102 H ILE 45 H ILE 45 -6.032 16.412 -15.796 1103 HA ILE 45 HA ILE 45 -6.422 13.680 -15.140 1104 HB ILE 45 HB ILE 45 -7.246 14.627 -17.197 1105 HG12 ILE 45 2HG1 ILE 45 -5.103 12.513 -17.814 1106 HG13 ILE 45 1HG1 ILE 45 -6.671 12.186 -17.010 1107 HG21 ILE 45 1HG2 ILE 45 -4.288 15.060 -17.978 1108 HG22 ILE 45 2HG2 ILE 45 -5.487 16.346 -17.600 1109 HG23 ILE 45 3HG2 ILE 45 -5.712 15.316 -19.041 1110 HD11 ILE 45 3HD ILE 45 -6.311 13.332 -19.865 1111 HD12 ILE 45 1HD ILE 45 -6.844 11.673 -19.424 1112 HD13 ILE 45 2HD ILE 45 -7.895 13.083 -19.038 1113 H TRP 46 H TRP 46 -3.796 15.770 -14.683 1114 HA TRP 46 HA TRP 46 -1.776 13.699 -15.100 1115 HB2 TRP 46 2HB TRP 46 -1.781 16.634 -14.729 1116 HB3 TRP 46 1HB TRP 46 -0.688 15.873 -13.550 1117 HD1 TRP 46 HD TRP 46 1.603 16.575 -14.519 1118 HE1 TRP 46 1HE TRP 46 2.827 16.346 -16.768 1119 HE3 TRP 46 3HE TRP 46 -2.213 14.598 -17.299 1120 HZ2 TRP 46 2HZ TRP 46 2.268 15.379 -19.367 1121 HZ3 TRP 46 3HZ TRP 46 -1.821 14.091 -19.675 1122 HH2 TRP 46 HH TRP 46 0.395 14.481 -20.707 1123 H TRP 47 H TRP 47 -3.580 15.375 -12.516 1124 HA TRP 47 HA TRP 47 -2.189 14.135 -10.387 1125 HB2 TRP 47 2HB TRP 47 -3.428 16.223 -9.989 1126 HB3 TRP 47 1HB TRP 47 -4.962 15.457 -10.534 1127 HD1 TRP 47 HD TRP 47 -2.442 15.125 -7.471 1128 HE1 TRP 47 1HE TRP 47 -3.730 14.117 -5.530 1129 HE3 TRP 47 3HE TRP 47 -6.839 14.206 -9.888 1130 HZ2 TRP 47 2HZ TRP 47 -6.354 13.056 -5.039 1131 HZ3 TRP 47 3HZ TRP 47 -8.665 13.059 -8.669 1132 HH2 TRP 47 HH TRP 47 -8.423 12.494 -6.274 1133 H SER 48 H SER 48 -5.010 13.092 -12.387 1134 HA SER 48 HA SER 48 -5.954 11.279 -10.468 1135 HB2 SER 48 2HB SER 48 -7.146 10.248 -12.532 1136 HB3 SER 48 1HB SER 48 -7.508 11.966 -12.128 1137 HG SER 48 1HG SER 48 -7.061 11.948 -14.253 1138 H VAL 49 H VAL 49 -3.157 11.154 -12.538 1139 HA VAL 49 HA VAL 49 -3.049 8.283 -12.543 1140 HB VAL 49 HB VAL 49 -0.723 10.134 -13.206 1141 HG11 VAL 49 1HG1 VAL 49 -0.246 8.276 -14.856 1142 HG12 VAL 49 2HG1 VAL 49 -1.713 7.393 -14.293 1143 HG13 VAL 49 3HG1 VAL 49 -0.324 7.639 -13.181 1144 HG21 VAL 49 3HG2 VAL 49 -3.219 9.532 -14.939 1145 HG22 VAL 49 1HG2 VAL 49 -1.662 10.174 -15.581 1146 HG23 VAL 49 2HG2 VAL 49 -2.606 11.146 -14.419 1147 H GLU 50 H GLU 50 -2.286 10.809 -10.252 1148 HA GLU 50 HA GLU 50 -0.145 9.188 -9.058 1149 HB2 GLU 50 2HB GLU 50 -0.007 11.783 -9.530 1150 HB3 GLU 50 1HB GLU 50 -1.041 11.931 -8.076 1151 HG2 GLU 50 2HG GLU 50 0.759 10.562 -6.810 1152 HG3 GLU 50 1HG GLU 50 1.777 10.637 -8.300 1153 H THR 51 H THR 51 -3.273 8.826 -9.080 1154 HA THR 51 HA THR 51 -3.418 8.210 -6.254 1155 HB THR 51 HB THR 51 -4.860 10.277 -6.742 1156 HG1 THR 51 1HG THR 51 -5.393 9.186 -5.050 1157 HG21 THR 51 3HG2 THR 51 -5.602 9.753 -9.005 1158 HG22 THR 51 1HG2 THR 51 -7.022 9.935 -7.917 1159 HG23 THR 51 2HG2 THR 51 -6.501 8.297 -8.451 1160 H ALA 52 H ALA 52 -5.630 6.612 -6.494 1161 HA ALA 52 HA ALA 52 -6.356 4.660 -7.170 1162 HB1 ALA 52 1HB ALA 52 -4.822 4.895 -9.811 1163 HB2 ALA 52 2HB ALA 52 -6.507 5.459 -9.527 1164 HB3 ALA 52 3HB ALA 52 -6.107 3.710 -9.387 1165 H THR 53 H THR 53 -2.842 5.135 -7.801 1166 HA THR 53 HA THR 53 -2.180 2.429 -7.290 1167 HB THR 53 HB THR 53 0.171 3.587 -7.398 1168 HG1 THR 53 1HG THR 53 -0.019 5.709 -8.299 1169 HG21 THR 53 3HG2 THR 53 -0.982 2.432 -9.331 1170 HG22 THR 53 1HG2 THR 53 -0.072 3.883 -9.882 1171 HG23 THR 53 2HG2 THR 53 -1.864 3.955 -9.727 1172 H THR 54 H THR 54 -3.336 4.611 -5.213 1173 HA THR 54 HA THR 54 -3.148 5.201 -3.110 1174 HB THR 54 HB THR 54 -2.789 3.397 -1.425 1175 HG1 THR 54 1HG THR 54 -1.286 2.268 -2.745 1176 HG21 THR 54 3HG2 THR 54 -4.607 2.691 -3.849 1177 HG22 THR 54 1HG2 THR 54 -5.026 3.843 -2.521 1178 HG23 THR 54 2HG2 THR 54 -4.795 2.097 -2.162 1179 H VAL 55 H VAL 55 -1.257 6.588 -4.063 1180 HA VAL 55 HA VAL 55 1.071 6.101 -2.336 1181 HB VAL 55 HB VAL 55 1.142 7.431 -5.116 1182 HG11 VAL 55 1HG1 VAL 55 3.311 6.526 -3.097 1183 HG12 VAL 55 2HG1 VAL 55 2.871 8.229 -3.444 1184 HG13 VAL 55 3HG1 VAL 55 3.629 7.218 -4.728 1185 HG21 VAL 55 3HG2 VAL 55 2.427 5.260 -5.699 1186 HG22 VAL 55 1HG2 VAL 55 0.656 5.079 -5.484 1187 HG23 VAL 55 2HG2 VAL 55 1.767 4.565 -4.173 1188 H GLY 56 H GLY 56 -0.095 8.806 -4.448 1189 HA2 GLY 56 2HA GLY 56 -0.881 10.811 -3.891 1190 HA3 GLY 56 1HA GLY 56 -1.071 10.268 -2.169 1191 H TYR 57 H TYR 57 1.466 11.191 -4.643 1192 HA TYR 57 HA TYR 57 3.415 11.278 -2.537 1193 HB2 TYR 57 2HB TYR 57 3.979 10.617 -4.979 1194 HB3 TYR 57 1HB TYR 57 3.705 12.338 -5.442 1195 HD1 TYR 57 2HD TYR 57 5.108 14.124 -4.197 1196 HD2 TYR 57 1HD TYR 57 6.112 9.942 -4.105 1197 HE1 TYR 57 2HE TYR 57 7.180 14.636 -3.035 1198 HE2 TYR 57 1HE TYR 57 8.285 10.497 -3.053 1199 HH TYR 57 HH TYR 57 9.314 12.171 -1.676 1200 H GLY 58 H GLY 58 1.597 13.613 -4.634 1201 HA2 GLY 58 2HA GLY 58 0.909 15.247 -2.622 1202 HA3 GLY 58 1HA GLY 58 2.549 15.855 -3.110 1203 H ASP 59 H ASP 59 2.768 16.974 -4.902 1204 HA ASP 59 HA ASP 59 2.329 18.494 -6.276 1205 HB2 ASP 59 2HB ASP 59 1.482 16.681 -8.003 1206 HB3 ASP 59 1HB ASP 59 -0.136 17.288 -7.645 1207 H ARG 60 H ARG 60 -0.970 17.330 -5.513 1208 HA ARG 60 HA ARG 60 -1.645 20.046 -4.650 1209 HB2 ARG 60 2HB ARG 60 -3.769 20.046 -5.874 1210 HB3 ARG 60 1HB ARG 60 -2.416 19.948 -7.034 1211 HG2 ARG 60 2HG ARG 60 -2.911 17.805 -7.736 1212 HG3 ARG 60 1HG ARG 60 -3.505 17.278 -6.139 1213 HD2 ARG 60 2HD ARG 60 -5.386 19.268 -6.902 1214 HD3 ARG 60 1HD ARG 60 -5.043 18.387 -8.440 1215 HE ARG 60 HE ARG 60 -5.504 16.250 -7.051 1216 HH11 ARG 60 1HH2 ARG 60 -7.087 19.108 -5.575 1217 HH12 ARG 60 2HH2 ARG 60 -8.669 18.735 -5.970 1218 HH21 ARG 60 1HH1 ARG 60 -7.790 15.440 -7.196 1219 HH22 ARG 60 2HH1 ARG 60 -9.073 16.502 -6.725 1220 H TYR 61 H TYR 61 -4.448 19.425 -4.098 1221 HA TYR 61 HA TYR 61 -4.476 16.935 -2.772 1222 HB2 TYR 61 2HB TYR 61 -5.238 17.988 -0.537 1223 HB3 TYR 61 1HB TYR 61 -3.484 18.107 -0.880 1224 HD1 TYR 61 1HD TYR 61 -6.674 20.024 -0.669 1225 HD2 TYR 61 2HD TYR 61 -2.420 20.243 -1.236 1226 HE1 TYR 61 1HE TYR 61 -6.752 22.439 -0.246 1227 HE2 TYR 61 2HE TYR 61 -2.477 22.660 -0.809 1228 HH TYR 61 HH TYR 61 -3.789 24.491 -0.323 1229 HA PRO 62 HA PRO 62 -8.662 18.144 -3.989 1230 HB2 PRO 62 2HB PRO 62 -10.146 16.128 -2.865 1231 HB3 PRO 62 1HB PRO 62 -8.931 15.741 -4.145 1232 HG2 PRO 62 2HG PRO 62 -8.624 15.528 -1.094 1233 HG3 PRO 62 1HG PRO 62 -8.192 14.285 -2.343 1234 HD2 PRO 62 2HD PRO 62 -6.396 16.150 -1.226 1235 HD3 PRO 62 1HD PRO 62 -6.184 15.453 -2.900 1236 H VAL 63 H VAL 63 -10.792 18.815 -3.153 1237 HA VAL 63 HA VAL 63 -10.596 20.156 -0.651 1238 HB VAL 63 HB VAL 63 -13.007 20.862 -1.224 1239 HG11 VAL 63 1HG1 VAL 63 -12.262 22.214 -3.164 1240 HG12 VAL 63 2HG1 VAL 63 -10.725 21.269 -3.238 1241 HG13 VAL 63 3HG1 VAL 63 -11.113 22.234 -1.776 1242 HG21 VAL 63 3HG2 VAL 63 -13.702 18.846 -2.532 1243 HG22 VAL 63 1HG2 VAL 63 -12.412 19.161 -3.767 1244 HG23 VAL 63 2HG2 VAL 63 -13.751 20.300 -3.580 1245 H THR 64 H THR 64 -12.694 20.177 0.746 1246 HA THR 64 HA THR 64 -12.940 17.601 1.892 1247 HB THR 64 HB THR 64 -14.286 20.243 2.690 1248 HG1 THR 64 1HG THR 64 -12.474 20.594 3.828 1249 HG21 THR 64 3HG2 THR 64 -13.667 17.629 4.272 1250 HG22 THR 64 1HG2 THR 64 -15.296 18.241 3.837 1251 HG23 THR 64 2HG2 THR 64 -14.279 19.160 4.991 1252 H GLU 65 H GLU 65 -15.538 19.952 0.917 1253 HA GLU 65 HA GLU 65 -17.528 18.303 1.615 1254 HB2 GLU 65 2HB GLU 65 -17.507 20.778 1.108 1255 HB3 GLU 65 1HB GLU 65 -17.710 20.390 -0.634 1256 HG2 GLU 65 2HG GLU 65 -19.967 19.518 -0.221 1257 HG3 GLU 65 1HG GLU 65 -19.691 19.480 1.561 1258 H GLU 66 H GLU 66 -15.922 18.366 -1.563 1259 HA GLU 66 HA GLU 66 -17.163 15.752 -2.031 1260 HB2 GLU 66 2HB GLU 66 -16.641 17.815 -4.252 1261 HB3 GLU 66 1HB GLU 66 -16.888 16.042 -4.490 1262 HG2 GLU 66 2HG GLU 66 -19.088 16.431 -3.030 1263 HG3 GLU 66 1HG GLU 66 -18.892 18.146 -3.532 1264 H GLY 67 H GLY 67 -14.855 16.867 -4.272 1265 HA2 GLY 67 2HA GLY 67 -12.817 16.203 -4.792 1266 HA3 GLY 67 1HA GLY 67 -12.466 17.006 -3.226 1267 H ARG 68 H ARG 68 -12.544 15.659 -1.317 1268 HA ARG 68 HA ARG 68 -10.843 13.470 -1.409 1269 HB2 ARG 68 2HB ARG 68 -11.382 15.250 0.381 1270 HB3 ARG 68 1HB ARG 68 -12.842 14.274 0.785 1271 HG2 ARG 68 2HG ARG 68 -11.114 12.320 1.225 1272 HG3 ARG 68 1HG ARG 68 -9.846 13.588 1.072 1273 HD2 ARG 68 2HD ARG 68 -12.102 13.362 3.144 1274 HD3 ARG 68 1HD ARG 68 -10.322 13.426 3.443 1275 HE ARG 68 HE ARG 68 -11.830 15.746 2.176 1276 HH11 ARG 68 1HH2 ARG 68 -9.117 14.825 4.283 1277 HH12 ARG 68 2HH2 ARG 68 -9.222 16.188 5.231 1278 HH21 ARG 68 1HH1 ARG 68 -11.547 17.937 3.355 1279 HH22 ARG 68 2HH1 ARG 68 -10.299 17.950 4.485 1280 H LYS 69 H LYS 69 -14.414 13.784 -1.216 1281 HA LYS 69 HA LYS 69 -14.818 10.983 -0.804 1282 HB2 LYS 69 2HB LYS 69 -16.479 12.790 -0.140 1283 HB3 LYS 69 1HB LYS 69 -16.808 13.086 -1.875 1284 HG2 LYS 69 2HG LYS 69 -18.564 11.709 -0.790 1285 HG3 LYS 69 1HG LYS 69 -17.759 10.806 -2.117 1286 HD2 LYS 69 2HD LYS 69 -16.418 9.511 -0.504 1287 HD3 LYS 69 1HD LYS 69 -17.057 10.482 0.877 1288 HE2 LYS 69 2HE LYS 69 -19.336 9.554 0.525 1289 HE3 LYS 69 1HE LYS 69 -18.789 8.724 -0.988 1290 HZ1 LYS 69 3HZ LYS 69 -17.667 8.187 1.721 1291 HZ2 LYS 69 1HZ LYS 69 -17.327 7.343 0.297 1292 HZ3 LYS 69 2HZ LYS 69 -18.897 7.261 0.993 1293 H VAL 70 H VAL 70 -14.315 13.092 -3.567 1294 HA VAL 70 HA VAL 70 -15.230 11.186 -5.510 1295 HB VAL 70 HB VAL 70 -13.436 13.644 -5.847 1296 HG11 VAL 70 1HG1 VAL 70 -13.135 11.984 -7.709 1297 HG12 VAL 70 2HG1 VAL 70 -14.031 13.439 -8.255 1298 HG13 VAL 70 3HG1 VAL 70 -14.923 11.902 -7.923 1299 HG21 VAL 70 3HG2 VAL 70 -15.606 14.674 -6.686 1300 HG22 VAL 70 1HG2 VAL 70 -15.711 14.216 -4.953 1301 HG23 VAL 70 2HG2 VAL 70 -16.484 13.185 -6.202 1302 H ALA 71 H ALA 71 -12.097 12.280 -4.138 1303 HA ALA 71 HA ALA 71 -10.431 10.555 -5.492 1304 HB1 ALA 71 1HB ALA 71 -10.076 11.537 -2.591 1305 HB2 ALA 71 2HB ALA 71 -9.605 12.469 -4.060 1306 HB3 ALA 71 3HB ALA 71 -8.780 10.913 -3.674 1307 H GLU 72 H GLU 72 -12.221 10.007 -2.420 1308 HA GLU 72 HA GLU 72 -11.282 7.629 -1.583 1309 HB2 GLU 72 2HB GLU 72 -13.246 8.887 -0.505 1310 HB3 GLU 72 1HB GLU 72 -14.299 8.273 -1.816 1311 HG2 GLU 72 2HG GLU 72 -13.658 5.858 -1.023 1312 HG3 GLU 72 1HG GLU 72 -12.883 6.641 0.388 1313 H GLN 73 H GLN 73 -13.657 8.167 -4.150 1314 HA GLN 73 HA GLN 73 -14.310 5.495 -4.628 1315 HB2 GLN 73 2HB GLN 73 -15.601 7.618 -5.217 1316 HB3 GLN 73 1HB GLN 73 -14.419 7.913 -6.537 1317 HG2 GLN 73 2HG GLN 73 -15.195 5.798 -7.674 1318 HG3 GLN 73 1HG GLN 73 -16.371 5.525 -6.320 1319 HE21 GLN 73 1HE2 GLN 73 -17.744 5.744 -8.598 1320 HE22 GLN 73 2HE2 GLN 73 -18.437 7.315 -8.807 1321 H VAL 74 H VAL 74 -11.724 7.631 -5.874 1322 HA VAL 74 HA VAL 74 -11.071 5.882 -8.033 1323 HB VAL 74 HB VAL 74 -9.175 8.005 -6.946 1324 HG11 VAL 74 1HG1 VAL 74 -8.573 8.104 -9.406 1325 HG12 VAL 74 2HG1 VAL 74 -9.784 6.820 -9.757 1326 HG13 VAL 74 3HG1 VAL 74 -8.345 6.452 -8.741 1327 HG21 VAL 74 3HG2 VAL 74 -11.338 9.156 -7.108 1328 HG22 VAL 74 1HG2 VAL 74 -11.683 8.412 -8.715 1329 HG23 VAL 74 2HG2 VAL 74 -10.342 9.608 -8.517 1330 H MET 75 H MET 75 -9.763 6.537 -4.729 1331 HA MET 75 HA MET 75 -7.580 4.780 -4.937 1332 HB2 MET 75 2HB MET 75 -9.185 5.699 -2.484 1333 HB3 MET 75 1HB MET 75 -7.923 4.440 -2.349 1334 HG2 MET 75 2HG MET 75 -6.671 6.208 -1.776 1335 HG3 MET 75 1HG MET 75 -6.295 6.068 -3.513 1336 HE1 MET 75 3HE MET 75 -9.075 7.629 -1.154 1337 HE2 MET 75 1HE MET 75 -8.668 9.375 -1.253 1338 HE3 MET 75 2HE MET 75 -7.483 8.215 -0.561 1339 H LYS 76 H LYS 76 -10.972 4.186 -3.851 1340 HA LYS 76 HA LYS 76 -10.474 1.536 -3.157 1341 HB2 LYS 76 2HB LYS 76 -12.592 2.897 -2.574 1342 HB3 LYS 76 1HB LYS 76 -13.182 2.500 -4.223 1343 HG2 LYS 76 2HG LYS 76 -12.783 0.000 -3.610 1344 HG3 LYS 76 1HG LYS 76 -12.444 0.547 -1.935 1345 HD2 LYS 76 2HD LYS 76 -14.798 1.489 -1.831 1346 HD3 LYS 76 1HD LYS 76 -15.054 0.931 -3.530 1347 HE2 LYS 76 2HE LYS 76 -14.546 -1.468 -2.758 1348 HE3 LYS 76 1HE LYS 76 -14.511 -0.862 -1.053 1349 HZ1 LYS 76 3HZ LYS 76 -16.610 -1.768 -1.542 1350 HZ2 LYS 76 1HZ LYS 76 -16.775 -0.859 -2.974 1351 HZ3 LYS 76 2HZ LYS 76 -16.827 -0.050 -1.457 1352 H ALA 77 H ALA 77 -11.380 2.971 -6.307 1353 HA ALA 77 HA ALA 77 -11.922 0.586 -7.645 1354 HB1 ALA 77 1HB ALA 77 -12.434 2.857 -8.621 1355 HB2 ALA 77 2HB ALA 77 -11.444 1.862 -9.756 1356 HB3 ALA 77 3HB ALA 77 -10.667 3.169 -8.787 1357 H GLY 78 H GLY 78 -8.859 2.236 -6.932 1358 HA2 GLY 78 2HA GLY 78 -7.193 0.694 -8.607 1359 HA3 GLY 78 1HA GLY 78 -6.754 1.665 -7.152 1360 H ILE 79 H ILE 79 -8.158 0.423 -5.153 1361 HA ILE 79 HA ILE 79 -6.528 -1.748 -4.545 1362 HB ILE 79 HB ILE 79 -9.219 -0.964 -3.336 1363 HG12 ILE 79 2HG1 ILE 79 -6.320 -0.352 -2.447 1364 HG13 ILE 79 1HG1 ILE 79 -7.382 0.815 -3.280 1365 HG21 ILE 79 1HG2 ILE 79 -8.617 -3.352 -2.769 1366 HG22 ILE 79 2HG2 ILE 79 -8.447 -2.300 -1.334 1367 HG23 ILE 79 3HG2 ILE 79 -6.983 -2.814 -2.237 1368 HD11 ILE 79 3HD ILE 79 -7.855 -0.392 -0.482 1369 HD12 ILE 79 1HD ILE 79 -7.427 1.303 -0.889 1370 HD13 ILE 79 2HD ILE 79 -9.040 0.652 -1.352 1371 H GLU 80 H GLU 80 -9.856 -1.619 -5.918 1372 HA GLU 80 HA GLU 80 -10.274 -4.379 -5.799 1373 HB2 GLU 80 2HB GLU 80 -11.470 -2.335 -7.759 1374 HB3 GLU 80 1HB GLU 80 -12.041 -4.025 -7.580 1375 HG2 GLU 80 2HG GLU 80 -12.668 -3.592 -5.191 1376 HG3 GLU 80 1HG GLU 80 -12.098 -1.893 -5.350 1377 H VAL 81 H VAL 81 -8.997 -2.402 -8.566 1378 HA VAL 81 HA VAL 81 -8.958 -4.689 -10.234 1379 HB VAL 81 HB VAL 81 -7.795 -3.244 -11.870 1380 HG11 VAL 81 1HG1 VAL 81 -10.226 -1.941 -10.449 1381 HG12 VAL 81 2HG1 VAL 81 -10.302 -3.309 -11.624 1382 HG13 VAL 81 3HG1 VAL 81 -9.710 -1.695 -12.156 1383 HG21 VAL 81 3HG2 VAL 81 -7.756 -1.244 -9.512 1384 HG22 VAL 81 1HG2 VAL 81 -7.572 -0.781 -11.217 1385 HG23 VAL 81 2HG2 VAL 81 -6.355 -1.850 -10.460 1386 H PHE 82 H PHE 82 -6.375 -3.029 -8.324 1387 HA PHE 82 HA PHE 82 -4.334 -4.659 -9.484 1388 HB2 PHE 82 2HB PHE 82 -4.347 -2.934 -6.914 1389 HB3 PHE 82 1HB PHE 82 -2.898 -3.813 -7.524 1390 HD1 PHE 82 1HD PHE 82 -2.654 -3.400 -10.310 1391 HD2 PHE 82 2HD PHE 82 -4.124 -0.652 -7.340 1392 HE1 PHE 82 1HE PHE 82 -1.987 -1.500 -11.732 1393 HE2 PHE 82 2HE PHE 82 -3.482 1.242 -8.779 1394 HZ PHE 82 HZ PHE 82 -2.399 0.829 -10.978 1395 H ALA 83 H ALA 83 -6.381 -4.800 -6.497 1396 HA ALA 83 HA ALA 83 -4.953 -6.996 -5.462 1397 HB1 ALA 83 1HB ALA 83 -7.888 -6.282 -4.900 1398 HB2 ALA 83 2HB ALA 83 -6.468 -5.641 -3.998 1399 HB3 ALA 83 3HB ALA 83 -6.841 -7.388 -3.931 1400 H LEU 84 H LEU 84 -7.670 -6.714 -7.778 1401 HA LEU 84 HA LEU 84 -8.517 -9.323 -7.832 1402 HB2 LEU 84 2HB LEU 84 -9.575 -7.430 -9.047 1403 HB3 LEU 84 1HB LEU 84 -8.261 -7.444 -10.257 1404 HG LEU 84 HG LEU 84 -9.842 -10.008 -9.770 1405 HD11 LEU 84 1HD1 LEU 84 -11.694 -9.276 -11.265 1406 HD12 LEU 84 2HD1 LEU 84 -10.988 -7.616 -11.350 1407 HD13 LEU 84 3HD1 LEU 84 -11.610 -8.258 -9.783 1408 HD21 LEU 84 3HD2 LEU 84 -8.025 -10.050 -11.503 1409 HD22 LEU 84 1HD2 LEU 84 -8.805 -8.681 -12.370 1410 HD23 LEU 84 2HD2 LEU 84 -9.638 -10.272 -12.254 1411 H VAL 85 H VAL 85 -5.549 -7.939 -9.173 1412 HA VAL 85 HA VAL 85 -4.876 -10.043 -10.878 1413 HB VAL 85 HB VAL 85 -2.961 -8.150 -9.430 1414 HG11 VAL 85 1HG1 VAL 85 -2.718 -9.752 -12.074 1415 HG12 VAL 85 2HG1 VAL 85 -1.719 -9.944 -10.585 1416 HG13 VAL 85 3HG1 VAL 85 -1.590 -8.445 -11.552 1417 HG21 VAL 85 3HG2 VAL 85 -4.688 -6.783 -10.486 1418 HG22 VAL 85 1HG2 VAL 85 -4.664 -7.767 -11.992 1419 HG23 VAL 85 2HG2 VAL 85 -3.255 -6.735 -11.544 1420 H THR 86 H THR 86 -5.043 -10.038 -7.398 1421 HA THR 86 HA THR 86 -2.939 -11.798 -6.878 1422 HB THR 86 HB THR 86 -5.560 -11.618 -5.350 1423 HG1 THR 86 1HG THR 86 -4.839 -9.630 -5.405 1424 HG21 THR 86 3HG2 THR 86 -4.061 -13.523 -4.623 1425 HG22 THR 86 1HG2 THR 86 -4.053 -12.204 -3.398 1426 HG23 THR 86 2HG2 THR 86 -2.664 -12.385 -4.527 1427 H ALA 87 H ALA 87 -6.088 -12.334 -8.385 1428 HA ALA 87 HA ALA 87 -6.210 -15.144 -8.034 1429 HB1 ALA 87 1HB ALA 87 -7.802 -15.077 -9.965 1430 HB2 ALA 87 2HB ALA 87 -7.240 -13.413 -10.385 1431 HB3 ALA 87 3HB ALA 87 -8.144 -13.694 -8.866 1432 H ALA 88 H ALA 88 -4.168 -13.070 -9.945 1433 HA ALA 88 HA ALA 88 -3.457 -15.183 -11.813 1434 HB1 ALA 88 1HB ALA 88 -1.944 -13.446 -12.852 1435 HB2 ALA 88 2HB ALA 88 -2.370 -12.289 -11.558 1436 HB3 ALA 88 3HB ALA 88 -3.631 -12.806 -12.731 1437 H LEU 89 H LEU 89 -2.203 -13.229 -9.108 1438 HA LEU 89 HA LEU 89 0.401 -14.302 -9.356 1439 HB2 LEU 89 2HB LEU 89 -0.892 -12.714 -7.076 1440 HB3 LEU 89 1HB LEU 89 0.855 -13.082 -7.200 1441 HG LEU 89 HG LEU 89 -0.705 -11.552 -9.373 1442 HD11 LEU 89 1HD1 LEU 89 0.277 -9.462 -8.445 1443 HD12 LEU 89 2HD1 LEU 89 0.954 -10.396 -7.055 1444 HD13 LEU 89 3HD1 LEU 89 -0.825 -10.265 -7.273 1445 HD21 LEU 89 3HD2 LEU 89 1.398 -12.571 -10.230 1446 HD22 LEU 89 1HD2 LEU 89 2.322 -11.858 -8.859 1447 HD23 LEU 89 2HD2 LEU 89 1.572 -10.787 -10.099 1448 H ALA 90 H ALA 90 -2.415 -15.198 -7.357 1449 HA ALA 90 HA ALA 90 -1.011 -16.851 -5.608 1450 HB1 ALA 90 1HB ALA 90 -3.359 -16.157 -5.187 1451 HB2 ALA 90 2HB ALA 90 -3.226 -17.953 -5.173 1452 HB3 ALA 90 3HB ALA 90 -3.903 -17.098 -6.617 1453 H THR 91 H THR 91 -1.802 -17.356 -9.013 1454 HA THR 91 HA THR 91 -1.441 -20.214 -8.697 1455 HB THR 91 HB THR 91 -2.838 -20.456 -10.246 1456 HG1 THR 91 1HG THR 91 -0.913 -19.231 -11.929 1457 HG21 THR 91 3HG2 THR 91 -3.652 -18.099 -9.836 1458 HG22 THR 91 1HG2 THR 91 -3.927 -18.683 -11.499 1459 HG23 THR 91 2HG2 THR 91 -2.595 -17.532 -11.174 1460 H ASP 92 H ASP 92 0.715 -17.534 -8.810 1461 HA ASP 92 HA ASP 92 2.527 -18.969 -10.555 1462 HB2 ASP 92 2HB ASP 92 2.768 -16.207 -9.311 1463 HB3 ASP 92 1HB ASP 92 4.161 -17.058 -10.073 1464 H PHE 93 H PHE 93 1.780 -19.434 -7.344 1465 HA PHE 93 HA PHE 93 4.457 -20.582 -6.953 1466 HB2 PHE 93 2HB PHE 93 4.087 -21.012 -4.761 1467 HB3 PHE 93 1HB PHE 93 3.118 -19.530 -4.956 1468 HD1 PHE 93 2HD PHE 93 0.638 -19.667 -4.841 1469 HD2 PHE 93 1HD PHE 93 3.075 -23.163 -4.295 1470 HE1 PHE 93 2HE PHE 93 -1.267 -20.831 -3.788 1471 HE2 PHE 93 1HE PHE 93 1.167 -24.331 -3.248 1472 HZ PHE 93 HZ PHE 93 -1.002 -23.166 -2.973 1473 H VAL 94 H VAL 94 1.120 -21.399 -7.836 1474 HA VAL 94 HA VAL 94 1.296 -24.120 -7.319 1475 HB VAL 94 HB VAL 94 -0.615 -22.738 -9.263 1476 HG11 VAL 94 1HG1 VAL 94 -0.707 -25.256 -9.366 1477 HG12 VAL 94 2HG1 VAL 94 -2.151 -24.633 -8.478 1478 HG13 VAL 94 3HG1 VAL 94 -0.773 -25.343 -7.572 1479 HG21 VAL 94 3HG2 VAL 94 -2.079 -22.516 -7.218 1480 HG22 VAL 94 1HG2 VAL 94 -0.592 -21.547 -7.036 1481 HG23 VAL 94 2HG2 VAL 94 -0.739 -23.124 -6.190 1482 H ARG 95 H ARG 95 2.311 -22.182 -10.082 1483 HA ARG 95 HA ARG 95 2.502 -24.272 -11.936 1484 HB2 ARG 95 2HB ARG 95 4.444 -21.893 -11.827 1485 HB3 ARG 95 1HB ARG 95 4.062 -22.950 -13.222 1486 HG2 ARG 95 2HG ARG 95 1.593 -21.986 -12.972 1487 HG3 ARG 95 1HG ARG 95 2.394 -20.730 -11.961 1488 HD2 ARG 95 2HD ARG 95 4.048 -20.453 -14.035 1489 HD3 ARG 95 1HD ARG 95 2.792 -21.371 -14.954 1490 HE ARG 95 HE ARG 95 2.305 -18.765 -13.442 1491 HH11 ARG 95 1HH2 ARG 95 2.379 -20.448 -16.667 1492 HH12 ARG 95 2HH2 ARG 95 1.731 -19.090 -17.480 1493 HH21 ARG 95 1HH1 ARG 95 1.242 -17.031 -14.612 1494 HH22 ARG 95 2HH1 ARG 95 0.874 -17.171 -16.275 1495 H ARG 96 H ARG 96 4.243 -23.982 -8.977 1496 HA ARG 96 HA ARG 96 6.702 -25.107 -9.802 1497 HB2 ARG 96 2HB ARG 96 7.171 -25.574 -7.473 1498 HB3 ARG 96 1HB ARG 96 6.290 -24.003 -7.518 1499 HG2 ARG 96 2HG ARG 96 4.144 -25.339 -7.041 1500 HG3 ARG 96 1HG ARG 96 5.191 -26.780 -6.765 1501 HD2 ARG 96 2HD ARG 96 6.239 -25.704 -4.793 1502 HD3 ARG 96 1HD ARG 96 5.193 -24.223 -5.029 1503 HE ARG 96 HE ARG 96 3.297 -26.166 -5.083 1504 HH11 ARG 96 1HH2 ARG 96 5.939 -25.767 -2.653 1505 HH12 ARG 96 2HH2 ARG 96 5.248 -26.809 -1.517 1506 HH21 ARG 96 1HH1 ARG 96 2.370 -27.616 -3.663 1507 HH22 ARG 96 2HH1 ARG 96 2.937 -27.858 -2.079 1508 H GLU 97 H GLU 97 3.467 -26.444 -9.247 1509 HA GLU 97 HA GLU 97 4.525 -29.126 -8.845 1510 HB2 GLU 97 2HB GLU 97 1.586 -28.212 -8.928 1511 HB3 GLU 97 1HB GLU 97 2.214 -29.797 -8.358 1512 HG2 GLU 97 2HG GLU 97 3.504 -28.509 -6.526 1513 HG3 GLU 97 1HG GLU 97 2.647 -27.016 -7.088 1514 H GLU 98 H GLU 98 3.556 -30.858 -10.266 1515 HA GLU 98 HA GLU 98 3.273 -31.809 -12.147 1516 HB2 GLU 98 2HB GLU 98 1.448 -29.799 -12.470 1517 HB3 GLU 98 1HB GLU 98 2.513 -29.456 -13.857 1518 HG2 GLU 98 2HG GLU 98 0.822 -30.874 -14.708 1519 HG3 GLU 98 1HG GLU 98 2.205 -32.013 -14.480 1520 H GLU 99 H GLU 99 4.560 -28.580 -12.891 1521 HA GLU 99 HA GLU 99 6.286 -29.280 -14.936 1522 HB2 GLU 99 2HB GLU 99 5.439 -26.906 -14.062 1523 HB3 GLU 99 1HB GLU 99 6.833 -26.992 -12.967 1524 HG2 GLU 99 2HG GLU 99 7.586 -25.716 -14.833 1525 HG3 GLU 99 1HG GLU 99 8.314 -27.337 -15.104 1526 H ARG 100 H ARG 100 6.672 -29.414 -11.376 1527 HA ARG 100 HA ARG 100 9.420 -29.697 -11.331 1528 HB2 ARG 100 2HB ARG 100 7.916 -29.489 -9.227 1529 HB3 ARG 100 1HB ARG 100 7.658 -31.262 -9.368 1530 HG2 ARG 100 2HG ARG 100 10.314 -31.403 -9.390 1531 HG3 ARG 100 1HG ARG 100 10.272 -29.686 -8.925 1532 HD2 ARG 100 2HD ARG 100 10.640 -31.129 -6.938 1533 HD3 ARG 100 1HD ARG 100 9.050 -30.297 -6.801 1534 HE ARG 100 HE ARG 100 8.043 -32.373 -6.754 1535 HH11 ARG 100 1HH2 ARG 100 11.379 -32.946 -8.125 1536 HH12 ARG 100 2HH2 ARG 100 11.148 -34.616 -8.226 1537 HH21 ARG 100 1HH1 ARG 100 7.899 -34.667 -6.719 1538 HH22 ARG 100 2HH1 ARG 100 9.192 -35.649 -7.357 1539 H ARG 101 H ARG 101 6.922 -32.182 -12.034 1540 HA ARG 101 HA ARG 101 8.894 -34.313 -11.895 1541 HB2 ARG 101 2HB ARG 101 6.095 -34.451 -13.177 1542 HB3 ARG 101 1HB ARG 101 7.138 -35.814 -12.655 1543 HG2 ARG 101 2HG ARG 101 6.854 -34.904 -10.226 1544 HG3 ARG 101 1HG ARG 101 5.644 -33.764 -10.902 1545 HD2 ARG 101 2HD ARG 101 4.400 -35.660 -9.993 1546 HD3 ARG 101 1HD ARG 101 4.307 -35.757 -11.797 1547 HE ARG 101 HE ARG 101 6.460 -37.290 -10.303 1548 HH11 ARG 101 1HH2 ARG 101 3.202 -37.636 -11.929 1549 HH12 ARG 101 2HH2 ARG 101 3.680 -39.129 -12.659 1550 HH21 ARG 101 1HH1 ARG 101 6.611 -39.528 -10.680 1551 HH22 ARG 101 2HH1 ARG 101 5.482 -40.363 -11.646 1552 H GLY 102 H GLY 102 7.588 -32.003 -14.154 1553 HA2 GLY 102 2HA GLY 102 8.206 -31.471 -16.232 1554 HA3 GLY 102 1HA GLY 102 9.379 -32.849 -16.233 1555 H HIS 103 H HIS 103 5.943 -33.046 -15.389 1556 HA HIS 103 HA HIS 103 4.279 -34.283 -16.204 1557 HB2 HIS 103 2HB HIS 103 4.168 -32.402 -17.770 1558 HB3 HIS 103 1HB HIS 103 5.423 -33.136 -18.807 1559 HD1 HIS 103 1HD HIS 103 1.837 -34.195 -17.655 1560 HD2 HIS 103 2HD HIS 103 4.456 -34.332 -20.970 1561 HE1 HIS 103 1HE HIS 103 0.597 -35.273 -19.563 1562 HE2 HIS 103 2HE HIS 103 2.185 -35.286 -21.568 1563 H1 SER 1 H SER 1 16.937 -24.415 -2.434 1564 HA SER 1 HA SER 1 15.955 -22.006 -1.332 1565 HB2 SER 1 2HB SER 1 17.883 -22.136 -3.759 1566 HB3 SER 1 1HB SER 1 16.818 -20.726 -3.378 1567 HG SER 1 1HG SER 1 18.798 -20.323 -2.602 1568 H ALA 2 H ALA 2 13.953 -21.693 -2.431 1569 HA ALA 2 HA ALA 2 13.290 -23.832 -4.325 1570 HB1 ALA 2 1HB ALA 2 11.476 -21.747 -2.953 1571 HB2 ALA 2 2HB ALA 2 11.672 -23.447 -2.419 1572 HB3 ALA 2 3HB ALA 2 10.930 -23.105 -4.018 1573 H ASP 3 H ASP 3 12.252 -23.187 -6.362 1574 HA ASP 3 HA ASP 3 13.483 -21.176 -7.744 1575 HB2 ASP 3 2HB ASP 3 10.757 -22.568 -8.201 1576 HB3 ASP 3 1HB ASP 3 11.354 -21.295 -9.327 1577 H HIS 4 H HIS 4 10.307 -21.149 -6.169 1578 HA HIS 4 HA HIS 4 9.618 -18.573 -7.112 1579 HB2 HIS 4 2HB HIS 4 7.820 -18.643 -5.221 1580 HB3 HIS 4 1HB HIS 4 7.722 -19.803 -6.575 1581 HD1 HIS 4 1HD HIS 4 9.118 -19.816 -2.905 1582 HD2 HIS 4 2HD HIS 4 7.457 -22.455 -5.792 1583 HE1 HIS 4 1HE HIS 4 9.065 -22.008 -1.899 1584 HE2 HIS 4 2HE HIS 4 8.032 -23.647 -3.537 1585 H GLU 5 H GLU 5 11.553 -19.597 -4.339 1586 HA GLU 5 HA GLU 5 11.371 -17.081 -2.971 1587 HB2 GLU 5 2HB GLU 5 13.084 -19.606 -2.710 1588 HB3 GLU 5 1HB GLU 5 13.651 -18.091 -1.947 1589 HG2 GLU 5 2HG GLU 5 12.564 -19.519 -0.297 1590 HG3 GLU 5 1HG GLU 5 11.744 -17.931 -0.483 1591 H ARG 6 H ARG 6 13.620 -18.708 -5.288 1592 HA ARG 6 HA ARG 6 15.546 -16.648 -5.226 1593 HB2 ARG 6 2HB ARG 6 14.965 -18.752 -7.399 1594 HB3 ARG 6 1HB ARG 6 16.346 -17.603 -7.451 1595 HG2 ARG 6 2HG ARG 6 17.163 -18.456 -5.253 1596 HG3 ARG 6 1HG ARG 6 15.852 -19.667 -5.222 1597 HD2 ARG 6 2HD ARG 6 18.104 -20.624 -5.930 1598 HD3 ARG 6 1HD ARG 6 16.776 -20.888 -7.121 1599 HE ARG 6 HE ARG 6 18.178 -19.970 -8.643 1600 HH11 ARG 6 1HH2 ARG 6 19.193 -18.452 -5.495 1601 HH12 ARG 6 2HH2 ARG 6 20.324 -17.422 -6.259 1602 HH21 ARG 6 1HH1 ARG 6 19.884 -18.559 -9.593 1603 HH22 ARG 6 2HH1 ARG 6 20.660 -17.426 -8.570 1604 H GLU 7 H GLU 7 12.664 -17.199 -7.235 1605 HA GLU 7 HA GLU 7 13.165 -15.184 -9.071 1606 HB2 GLU 7 2HB GLU 7 11.446 -17.165 -9.133 1607 HB3 GLU 7 1HB GLU 7 10.354 -16.086 -8.207 1608 HG2 GLU 7 2HG GLU 7 9.817 -15.999 -10.624 1609 HG3 GLU 7 1HG GLU 7 10.510 -14.407 -10.141 1610 H ALA 8 H ALA 8 11.728 -15.096 -5.836 1611 HA ALA 8 HA ALA 8 10.611 -12.516 -6.003 1612 HB1 ALA 8 1HB ALA 8 10.648 -12.575 -3.484 1613 HB2 ALA 8 2HB ALA 8 11.691 -14.032 -3.530 1614 HB3 ALA 8 3HB ALA 8 10.004 -14.121 -4.154 1615 H GLN 9 H GLN 9 13.797 -13.738 -4.813 1616 HA GLN 9 HA GLN 9 14.657 -11.119 -4.129 1617 HB2 GLN 9 2HB GLN 9 16.428 -13.576 -4.644 1618 HB3 GLN 9 1HB GLN 9 16.915 -12.064 -3.810 1619 HG2 GLN 9 2HG GLN 9 14.894 -14.182 -2.818 1620 HG3 GLN 9 1HG GLN 9 16.503 -13.789 -2.120 1621 HE21 GLN 9 1HE2 GLN 9 16.562 -11.013 -1.854 1622 HE22 GLN 9 2HE2 GLN 9 15.182 -10.385 -1.078 1623 H LYS 10 H LYS 10 14.789 -12.974 -7.091 1624 HA LYS 10 HA LYS 10 16.666 -11.425 -8.515 1625 HB2 LYS 10 2HB LYS 10 15.690 -13.715 -9.203 1626 HB3 LYS 10 1HB LYS 10 14.129 -12.903 -9.465 1627 HG2 LYS 10 2HG LYS 10 14.802 -13.037 -11.578 1628 HG3 LYS 10 1HG LYS 10 15.480 -11.415 -11.243 1629 HD2 LYS 10 2HD LYS 10 17.751 -12.433 -10.872 1630 HD3 LYS 10 1HD LYS 10 17.050 -14.076 -11.042 1631 HE2 LYS 10 2HE LYS 10 17.317 -11.953 -13.276 1632 HE3 LYS 10 1HE LYS 10 18.187 -13.533 -13.125 1633 HZ1 LYS 10 3HZ LYS 10 15.666 -14.385 -13.094 1634 HZ2 LYS 10 1HZ LYS 10 16.567 -14.157 -14.511 1635 HZ3 LYS 10 2HZ LYS 10 15.469 -12.952 -14.010 1636 H ALA 11 H ALA 11 13.155 -11.163 -7.884 1637 HA ALA 11 HA ALA 11 12.649 -9.150 -9.771 1638 HB1 ALA 11 1HB ALA 11 10.467 -8.852 -8.626 1639 HB2 ALA 11 2HB ALA 11 11.052 -9.813 -7.219 1640 HB3 ALA 11 3HB ALA 11 10.824 -10.603 -8.821 1641 H GLU 12 H GLU 12 13.503 -9.052 -6.262 1642 HA GLU 12 HA GLU 12 13.126 -6.357 -5.790 1643 HB2 GLU 12 2HB GLU 12 15.571 -7.995 -4.807 1644 HB3 GLU 12 1HB GLU 12 15.088 -6.358 -4.227 1645 HG2 GLU 12 2HG GLU 12 12.970 -7.328 -3.266 1646 HG3 GLU 12 1HG GLU 12 13.536 -8.964 -3.756 1647 H GLU 13 H GLU 13 15.845 -8.025 -7.307 1648 HA GLU 13 HA GLU 13 17.694 -5.967 -7.284 1649 HB2 GLU 13 2HB GLU 13 17.993 -8.526 -7.824 1650 HB3 GLU 13 1HB GLU 13 17.414 -8.145 -9.467 1651 HG2 GLU 13 2HG GLU 13 19.873 -8.259 -9.456 1652 HG3 GLU 13 1HG GLU 13 19.372 -6.552 -9.758 1653 H GLU 14 H GLU 14 15.152 -6.857 -9.565 1654 HA GLU 14 HA GLU 14 16.003 -5.201 -11.679 1655 HB2 GLU 14 2HB GLU 14 14.514 -7.231 -11.949 1656 HB3 GLU 14 1HB GLU 14 13.224 -6.356 -11.059 1657 HG2 GLU 14 2HG GLU 14 12.619 -6.233 -13.341 1658 HG3 GLU 14 1HG GLU 14 13.244 -4.598 -12.951 1659 H LEU 15 H LEU 15 13.928 -4.706 -8.821 1660 HA LEU 15 HA LEU 15 12.749 -2.337 -9.766 1661 HB2 LEU 15 2HB LEU 15 11.863 -3.681 -7.831 1662 HB3 LEU 15 1HB LEU 15 13.274 -3.183 -6.849 1663 HG LEU 15 HG LEU 15 12.541 -0.816 -6.929 1664 HD11 LEU 15 1HD1 LEU 15 10.279 -1.835 -8.760 1665 HD12 LEU 15 2HD1 LEU 15 11.547 -0.616 -9.156 1666 HD13 LEU 15 3HD1 LEU 15 10.279 -0.222 -7.961 1667 HD21 LEU 15 3HD2 LEU 15 11.670 -2.277 -5.130 1668 HD22 LEU 15 1HD2 LEU 15 10.269 -2.757 -6.148 1669 HD23 LEU 15 2HD2 LEU 15 10.434 -1.053 -5.590 1670 H GLN 16 H GLN 16 15.730 -3.001 -7.930 1671 HA GLN 16 HA GLN 16 16.262 -0.308 -7.303 1672 HB2 GLN 16 2HB GLN 16 18.250 -2.635 -7.533 1673 HB3 GLN 16 1HB GLN 16 18.548 -1.048 -6.738 1674 HG2 GLN 16 2HG GLN 16 16.601 -1.550 -5.141 1675 HG3 GLN 16 1HG GLN 16 16.463 -3.182 -5.879 1676 HE21 GLN 16 1HE2 GLN 16 19.068 -1.010 -4.479 1677 HE22 GLN 16 2HE2 GLN 16 19.789 -2.247 -3.513 1678 H LYS 17 H LYS 17 16.840 -2.212 -10.197 1679 HA LYS 17 HA LYS 17 18.768 -0.540 -11.394 1680 HB2 LYS 17 2HB LYS 17 18.139 -2.917 -12.105 1681 HB3 LYS 17 1HB LYS 17 16.591 -2.266 -12.718 1682 HG2 LYS 17 2HG LYS 17 18.025 -0.761 -14.320 1683 HG3 LYS 17 1HG LYS 17 19.438 -1.716 -13.753 1684 HD2 LYS 17 2HD LYS 17 18.750 -2.786 -15.776 1685 HD3 LYS 17 1HD LYS 17 18.118 -3.825 -14.447 1686 HE2 LYS 17 2HE LYS 17 15.856 -2.443 -14.751 1687 HE3 LYS 17 1HE LYS 17 16.574 -1.896 -16.314 1688 HZ1 LYS 17 3HZ LYS 17 16.779 -4.316 -16.879 1689 HZ2 LYS 17 1HZ LYS 17 15.171 -3.826 -16.575 1690 HZ3 LYS 17 2HZ LYS 17 16.016 -4.674 -15.391 1691 H VAL 18 H VAL 18 15.184 -0.525 -11.321 1692 HA VAL 18 HA VAL 18 14.825 1.436 -13.303 1693 HB VAL 18 HB VAL 18 12.997 0.667 -10.961 1694 HG11 VAL 18 1HG1 VAL 18 12.400 2.183 -13.600 1695 HG12 VAL 18 2HG1 VAL 18 12.293 2.857 -11.930 1696 HG13 VAL 18 3HG1 VAL 18 11.157 1.568 -12.446 1697 HG21 VAL 18 3HG2 VAL 18 13.571 -1.294 -12.415 1698 HG22 VAL 18 1HG2 VAL 18 13.158 -0.346 -13.888 1699 HG23 VAL 18 2HG2 VAL 18 11.879 -0.785 -12.697 1700 H LEU 19 H LEU 19 15.442 1.585 -9.787 1701 HA LEU 19 HA LEU 19 14.751 4.253 -9.417 1702 HB2 LEU 19 2HB LEU 19 16.998 2.711 -7.980 1703 HB3 LEU 19 1HB LEU 19 16.236 4.233 -7.410 1704 HG LEU 19 HG LEU 19 14.838 1.506 -7.700 1705 HD11 LEU 19 1HD1 LEU 19 14.785 1.510 -5.222 1706 HD12 LEU 19 2HD1 LEU 19 15.657 3.083 -5.178 1707 HD13 LEU 19 3HD1 LEU 19 16.487 1.612 -5.814 1708 HD21 LEU 19 3HD2 LEU 19 13.750 4.212 -6.688 1709 HD22 LEU 19 1HD2 LEU 19 12.952 2.627 -6.430 1710 HD23 LEU 19 2HD2 LEU 19 13.160 3.260 -8.099 1711 H GLU 20 H GLU 20 17.753 2.780 -10.632 1712 HA GLU 20 HA GLU 20 19.249 5.210 -10.493 1713 HB2 GLU 20 2HB GLU 20 19.819 2.614 -12.025 1714 HB3 GLU 20 1HB GLU 20 20.951 3.996 -11.806 1715 HG2 GLU 20 2HG GLU 20 20.728 3.696 -9.270 1716 HG3 GLU 20 1HG GLU 20 19.775 2.194 -9.569 1717 H GLU 21 H GLU 21 17.210 3.577 -12.927 1718 HA GLU 21 HA GLU 21 18.065 5.376 -14.979 1719 HB2 GLU 21 2HB GLU 21 16.715 2.971 -15.128 1720 HB3 GLU 21 1HB GLU 21 15.360 4.120 -15.313 1721 HG2 GLU 21 2HG GLU 21 17.025 5.311 -17.060 1722 HG3 GLU 21 1HG GLU 21 17.882 3.729 -17.051 1723 H ALA 22 H ALA 22 15.325 5.159 -12.706 1724 HA ALA 22 HA ALA 22 13.819 7.265 -13.614 1725 HB1 ALA 22 1HB ALA 22 13.000 5.614 -11.927 1726 HB2 ALA 22 2HB ALA 22 12.798 7.301 -11.325 1727 HB3 ALA 22 3HB ALA 22 14.148 6.276 -10.716 1728 H SER 23 H SER 23 16.672 7.309 -11.455 1729 HA SER 23 HA SER 23 16.239 10.014 -10.681 1730 HB2 SER 23 2HB SER 23 18.825 9.791 -10.063 1731 HB3 SER 23 1HB SER 23 17.535 8.992 -9.096 1732 HG SER 23 1HG SER 23 17.969 7.064 -10.024 1733 H LYS 24 H LYS 24 18.007 8.435 -13.361 1734 HA LYS 24 HA LYS 24 19.230 10.812 -14.266 1735 HB2 LYS 24 2HB LYS 24 20.004 8.553 -14.943 1736 HB3 LYS 24 1HB LYS 24 18.486 8.257 -15.835 1737 HG2 LYS 24 2HG LYS 24 20.158 10.704 -16.557 1738 HG3 LYS 24 1HG LYS 24 20.801 9.093 -16.998 1739 HD2 LYS 24 2HD LYS 24 18.982 8.543 -18.422 1740 HD3 LYS 24 1HD LYS 24 17.941 9.870 -17.830 1741 HE2 LYS 24 2HE LYS 24 20.568 10.315 -19.408 1742 HE3 LYS 24 1HE LYS 24 18.915 10.293 -20.143 1743 HZ1 LYS 24 3HZ LYS 24 20.182 12.463 -19.171 1744 HZ2 LYS 24 1HZ LYS 24 19.102 12.078 -17.893 1745 HZ3 LYS 24 2HZ LYS 24 18.515 12.319 -19.470 1746 H LYS 25 H LYS 25 16.077 9.275 -14.909 1747 HA LYS 25 HA LYS 25 15.306 11.041 -16.993 1748 HB2 LYS 25 2HB LYS 25 13.366 9.700 -15.007 1749 HB3 LYS 25 1HB LYS 25 12.956 10.402 -16.603 1750 HG2 LYS 25 2HG LYS 25 14.663 7.911 -16.055 1751 HG3 LYS 25 1HG LYS 25 12.946 7.905 -16.516 1752 HD2 LYS 25 2HD LYS 25 13.403 8.578 -18.761 1753 HD3 LYS 25 1HD LYS 25 15.095 9.090 -18.384 1754 HE2 LYS 25 2HE LYS 25 15.820 6.822 -17.932 1755 HE3 LYS 25 1HE LYS 25 14.128 6.202 -17.918 1756 HZ1 LYS 25 3HZ LYS 25 15.312 5.541 -19.781 1757 HZ2 LYS 25 1HZ LYS 25 15.577 7.118 -20.394 1758 HZ3 LYS 25 2HZ LYS 25 13.983 6.491 -20.260 1759 H ALA 26 H ALA 26 14.526 10.930 -13.442 1760 HA ALA 26 HA ALA 26 12.942 13.150 -13.372 1761 HB1 ALA 26 1HB ALA 26 13.334 13.259 -10.980 1762 HB2 ALA 26 2HB ALA 26 14.842 12.260 -11.118 1763 HB3 ALA 26 3HB ALA 26 13.221 11.533 -11.460 1764 H VAL 27 H VAL 27 16.528 13.038 -13.127 1765 HA VAL 27 HA VAL 27 16.868 15.752 -12.532 1766 HB VAL 27 HB VAL 27 18.590 13.714 -14.024 1767 HG11 VAL 27 1HG1 VAL 27 19.418 16.584 -13.209 1768 HG12 VAL 27 2HG1 VAL 27 19.387 15.918 -14.882 1769 HG13 VAL 27 3HG1 VAL 27 20.560 15.276 -13.688 1770 HG21 VAL 27 3HG2 VAL 27 18.069 13.476 -11.521 1771 HG22 VAL 27 1HG2 VAL 27 18.894 15.040 -11.242 1772 HG23 VAL 27 2HG2 VAL 27 19.818 13.631 -11.896 1773 H GLU 28 H GLU 28 16.382 14.153 -15.686 1774 HA GLU 28 HA GLU 28 17.126 16.596 -17.080 1775 HB2 GLU 28 2HB GLU 28 17.888 14.322 -17.803 1776 HB3 GLU 28 1HB GLU 28 16.182 13.850 -18.100 1777 HG2 GLU 28 2HG GLU 28 15.993 15.449 -19.958 1778 HG3 GLU 28 1HG GLU 28 17.592 16.188 -19.570 1779 H ALA 29 H ALA 29 14.318 14.644 -16.218 1780 HA ALA 29 HA ALA 29 12.480 15.761 -17.985 1781 HB1 ALA 29 1HB ALA 29 12.275 13.505 -16.817 1782 HB2 ALA 29 2HB ALA 29 10.820 14.516 -16.624 1783 HB3 ALA 29 3HB ALA 29 11.990 14.378 -15.267 1784 H GLU 30 H GLU 30 13.018 16.360 -14.400 1785 HA GLU 30 HA GLU 30 11.227 18.502 -14.445 1786 HB2 GLU 30 2HB GLU 30 13.388 17.663 -12.479 1787 HB3 GLU 30 1HB GLU 30 12.474 19.192 -12.267 1788 HG2 GLU 30 2HG GLU 30 11.238 17.798 -10.941 1789 HG3 GLU 30 1HG GLU 30 10.298 17.689 -12.471 1790 H ARG 31 H ARG 31 14.546 18.361 -15.517 1791 HA ARG 31 HA ARG 31 15.011 21.189 -15.175 1792 HB2 ARG 31 2HB ARG 31 16.868 19.542 -15.031 1793 HB3 ARG 31 1HB ARG 31 16.596 19.086 -16.738 1794 HG2 ARG 31 2HG ARG 31 17.223 21.454 -17.433 1795 HG3 ARG 31 1HG ARG 31 17.413 21.887 -15.704 1796 HD2 ARG 31 2HD ARG 31 19.602 21.486 -16.794 1797 HD3 ARG 31 1HD ARG 31 19.311 20.275 -15.476 1798 HE ARG 31 HE ARG 31 18.371 19.204 -17.979 1799 HH11 ARG 31 1HH2 ARG 31 21.472 20.087 -16.339 1800 HH12 ARG 31 2HH2 ARG 31 22.353 18.754 -16.912 1801 HH21 ARG 31 1HH1 ARG 31 19.856 17.708 -19.246 1802 HH22 ARG 31 2HH1 ARG 31 21.354 17.320 -18.565 1803 H GLY 32 H GLY 32 13.434 22.319 -16.415 1804 HA2 GLY 32 2HA GLY 32 13.759 23.426 -18.645 1805 HA3 GLY 32 1HA GLY 32 13.408 21.776 -19.312 1806 H ALA 33 H ALA 33 11.775 21.695 -16.531 1807 HA ALA 33 HA ALA 33 9.313 22.292 -17.858 1808 HB1 ALA 33 1HB ALA 33 8.283 21.174 -15.857 1809 HB2 ALA 33 2HB ALA 33 9.912 21.101 -15.078 1810 HB3 ALA 33 3HB ALA 33 9.590 20.155 -16.571 1811 HA PRO 34 HA PRO 34 8.989 26.161 -15.794 1812 HB2 PRO 34 2HB PRO 34 6.240 26.686 -15.845 1813 HB3 PRO 34 1HB PRO 34 7.300 26.683 -17.306 1814 HG2 PRO 34 2HG PRO 34 5.547 24.396 -16.258 1815 HG3 PRO 34 1HG PRO 34 5.641 25.049 -17.948 1816 HD2 PRO 34 2HD PRO 34 7.064 22.813 -17.181 1817 HD3 PRO 34 1HD PRO 34 7.808 24.045 -18.304 1818 H GLY 35 H GLY 35 9.688 25.945 -13.605 1819 HA2 GLY 35 2HA GLY 35 8.408 26.756 -11.546 1820 HA3 GLY 35 1HA GLY 35 7.717 25.070 -11.629 1821 H ALA 36 H ALA 36 9.618 23.609 -12.631 1822 HA ALA 36 HA ALA 36 11.302 22.362 -12.190 1823 HB1 ALA 36 1HB ALA 36 12.821 24.266 -12.708 1824 HB2 ALA 36 2HB ALA 36 13.514 23.173 -11.457 1825 HB3 ALA 36 3HB ALA 36 12.785 24.748 -10.970 1826 H ALA 37 H ALA 37 12.601 21.240 -10.337 1827 HA ALA 37 HA ALA 37 11.755 21.905 -7.709 1828 HB1 ALA 37 1HB ALA 37 10.536 19.736 -7.260 1829 HB2 ALA 37 2HB ALA 37 10.493 19.417 -9.039 1830 HB3 ALA 37 3HB ALA 37 9.623 20.820 -8.349 1831 H LEU 38 H LEU 38 12.226 18.553 -8.929 1832 HA LEU 38 HA LEU 38 14.635 18.418 -7.345 1833 HB2 LEU 38 2HB LEU 38 13.184 16.400 -7.382 1834 HB3 LEU 38 1HB LEU 38 13.214 16.403 -9.167 1835 HG LEU 38 HG LEU 38 15.574 15.821 -9.244 1836 HD11 LEU 38 1HD1 LEU 38 16.949 15.214 -7.315 1837 HD12 LEU 38 2HD1 LEU 38 15.619 15.559 -6.161 1838 HD13 LEU 38 3HD1 LEU 38 16.412 16.901 -7.076 1839 HD21 LEU 38 3HD2 LEU 38 14.004 13.963 -7.369 1840 HD22 LEU 38 1HD2 LEU 38 15.333 13.487 -8.502 1841 HD23 LEU 38 2HD2 LEU 38 13.768 14.115 -9.135 1842 H ILE 39 H ILE 39 16.710 18.848 -8.218 1843 HA ILE 39 HA ILE 39 17.224 18.043 -10.857 1844 HB ILE 39 HB ILE 39 16.264 19.983 -11.701 1845 HG12 ILE 39 2HG1 ILE 39 17.988 21.286 -12.717 1846 HG13 ILE 39 1HG1 ILE 39 19.170 20.930 -11.426 1847 HG21 ILE 39 1HG2 ILE 39 16.652 22.294 -10.807 1848 HG22 ILE 39 2HG2 ILE 39 17.588 21.606 -9.433 1849 HG23 ILE 39 3HG2 ILE 39 15.836 21.224 -9.623 1850 HD11 ILE 39 3HD ILE 39 18.043 18.833 -13.400 1851 HD12 ILE 39 1HD ILE 39 19.657 19.639 -13.514 1852 HD13 ILE 39 2HD ILE 39 19.308 18.539 -12.156 1853 H SER 40 H SER 40 18.623 16.718 -9.403 1854 HA SER 40 HA SER 40 21.167 17.872 -9.551 1855 HB2 SER 40 2HB SER 40 21.229 16.930 -6.796 1856 HB3 SER 40 1HB SER 40 21.620 18.561 -7.405 1857 HG SER 40 1HG SER 40 19.862 18.182 -5.739 1858 H TYR 41 H TYR 41 22.485 16.042 -10.012 1859 HA TYR 41 HA TYR 41 21.140 13.564 -10.168 1860 HB2 TYR 41 2HB TYR 41 23.201 14.494 -11.618 1861 HB3 TYR 41 1HB TYR 41 24.189 13.667 -10.366 1862 HD1 TYR 41 2HD TYR 41 23.678 11.158 -9.916 1863 HD2 TYR 41 1HD TYR 41 22.104 13.292 -13.307 1864 HE1 TYR 41 2HE TYR 41 23.189 9.023 -11.025 1865 HE2 TYR 41 1HE TYR 41 21.651 11.152 -14.440 1866 HH TYR 41 HH TYR 41 22.106 8.013 -12.829 1867 HA PRO 42 HA PRO 42 23.612 12.097 -6.510 1868 HB2 PRO 42 2HB PRO 42 24.722 13.861 -4.602 1869 HB3 PRO 42 1HB PRO 42 25.618 13.237 -6.037 1870 HG2 PRO 42 2HG PRO 42 24.093 15.887 -5.782 1871 HG3 PRO 42 1HG PRO 42 25.781 15.628 -6.386 1872 HD2 PRO 42 2HD PRO 42 23.694 15.861 -8.119 1873 HD3 PRO 42 1HD PRO 42 24.969 14.595 -8.436 1874 H ASP 43 H ASP 43 21.277 14.591 -6.494 1875 HA ASP 43 HA ASP 43 20.335 13.858 -3.798 1876 HB2 ASP 43 2HB ASP 43 19.138 15.925 -5.737 1877 HB3 ASP 43 1HB ASP 43 18.575 15.569 -4.068 1878 H ALA 44 H ALA 44 19.771 13.535 -7.303 1879 HA ALA 44 HA ALA 44 17.073 12.992 -7.192 1880 HB1 ALA 44 1HB ALA 44 17.322 12.019 -9.500 1881 HB2 ALA 44 2HB ALA 44 19.118 12.080 -9.305 1882 HB3 ALA 44 3HB ALA 44 18.140 13.595 -9.320 1883 H ILE 45 H ILE 45 19.836 10.831 -6.836 1884 HA ILE 45 HA ILE 45 18.394 8.431 -7.037 1885 HB ILE 45 HB ILE 45 20.734 8.397 -7.310 1886 HG12 ILE 45 2HG1 ILE 45 20.082 6.980 -4.649 1887 HG13 ILE 45 1HG1 ILE 45 19.678 6.389 -6.293 1888 HG21 ILE 45 1HG2 ILE 45 21.388 10.407 -6.022 1889 HG22 ILE 45 2HG2 ILE 45 22.363 9.010 -5.514 1890 HG23 ILE 45 3HG2 ILE 45 21.025 9.579 -4.465 1891 HD11 ILE 45 3HD ILE 45 22.530 6.839 -5.170 1892 HD12 ILE 45 1HD ILE 45 21.722 5.266 -5.503 1893 HD13 ILE 45 2HD ILE 45 22.154 6.359 -6.866 1894 H TRP 46 H TRP 46 18.804 10.747 -4.332 1895 HA TRP 46 HA TRP 46 17.818 8.865 -2.392 1896 HB2 TRP 46 2HB TRP 46 18.835 11.683 -2.380 1897 HB3 TRP 46 1HB TRP 46 17.501 11.412 -1.245 1898 HD1 TRP 46 HD TRP 46 18.828 11.784 0.851 1899 HE1 TRP 46 1HE TRP 46 20.880 10.717 1.999 1900 HE3 TRP 46 3HE TRP 46 20.122 8.407 -2.758 1901 HZ2 TRP 46 2HZ TRP 46 22.565 8.453 1.601 1902 HZ3 TRP 46 3HZ TRP 46 22.007 6.882 -2.360 1903 HH2 TRP 46 HH TRP 46 23.217 6.901 -0.198 1904 H TRP 47 H TRP 47 16.424 11.341 -4.522 1905 HA TRP 47 HA TRP 47 13.869 11.273 -3.234 1906 HB2 TRP 47 2HB TRP 47 14.712 13.154 -4.749 1907 HB3 TRP 47 1HB TRP 47 14.469 12.044 -6.147 1908 HD1 TRP 47 HD TRP 47 12.307 13.380 -3.105 1909 HE1 TRP 47 1HE TRP 47 9.887 13.351 -3.819 1910 HE3 TRP 47 3HE TRP 47 12.894 11.700 -7.891 1911 HZ2 TRP 47 2HZ TRP 47 8.376 13.070 -6.239 1912 HZ3 TRP 47 3HZ TRP 47 10.918 11.572 -9.368 1913 HH2 TRP 47 HH TRP 47 8.688 12.231 -8.554 1914 H SER 48 H SER 48 15.520 9.425 -5.754 1915 HA SER 48 HA SER 48 13.278 8.085 -6.722 1916 HB2 SER 48 2HB SER 48 15.772 8.300 -7.633 1917 HB3 SER 48 1HB SER 48 16.071 6.804 -6.679 1918 HG SER 48 1HG SER 48 15.494 6.395 -8.835 1919 H VAL 49 H VAL 49 15.562 7.296 -4.064 1920 HA VAL 49 HA VAL 49 14.612 4.697 -3.646 1921 HB VAL 49 HB VAL 49 16.243 6.664 -1.990 1922 HG11 VAL 49 1HG1 VAL 49 16.968 4.688 -0.561 1923 HG12 VAL 49 2HG1 VAL 49 15.655 3.701 -1.305 1924 HG13 VAL 49 3HG1 VAL 49 15.248 5.137 -0.306 1925 HG21 VAL 49 3HG2 VAL 49 18.134 5.235 -2.750 1926 HG22 VAL 49 1HG2 VAL 49 17.171 5.677 -4.200 1927 HG23 VAL 49 2HG2 VAL 49 16.992 4.049 -3.481 1928 H GLU 50 H GLU 50 13.127 7.749 -2.594 1929 HA GLU 50 HA GLU 50 11.790 6.373 -0.394 1930 HB2 GLU 50 2HB GLU 50 10.518 8.498 -0.070 1931 HB3 GLU 50 1HB GLU 50 12.284 8.683 0.113 1932 HG2 GLU 50 2HG GLU 50 12.498 9.757 -2.066 1933 HG3 GLU 50 1HG GLU 50 10.797 9.379 -2.508 1934 H THR 51 H THR 51 11.353 6.583 -3.795 1935 HA THR 51 HA THR 51 8.482 6.084 -3.446 1936 HB THR 51 HB THR 51 8.787 8.092 -4.788 1937 HG1 THR 51 1HG THR 51 7.537 7.472 -6.439 1938 HG21 THR 51 3HG2 THR 51 11.039 7.722 -5.701 1939 HG22 THR 51 1HG2 THR 51 9.896 7.936 -7.062 1940 HG23 THR 51 2HG2 THR 51 10.494 6.287 -6.639 1941 H ALA 52 H ALA 52 8.142 4.627 -5.713 1942 HA ALA 52 HA ALA 52 8.268 2.562 -6.512 1943 HB1 ALA 52 1HB ALA 52 10.755 2.595 -6.778 1944 HB2 ALA 52 2HB ALA 52 10.123 0.986 -6.286 1945 HB3 ALA 52 3HB ALA 52 10.926 2.041 -5.075 1946 H THR 53 H THR 53 8.959 3.062 -3.041 1947 HA THR 53 HA THR 53 7.963 0.511 -2.277 1948 HB THR 53 HB THR 53 8.438 1.715 0.023 1949 HG1 THR 53 1HG THR 53 9.560 3.626 -0.209 1950 HG21 THR 53 3HG2 THR 53 10.010 0.100 -1.136 1951 HG22 THR 53 1HG2 THR 53 10.908 1.438 -0.329 1952 HG23 THR 53 2HG2 THR 53 10.685 1.458 -2.114 1953 H THR 54 H THR 54 6.327 3.061 -3.397 1954 HA THR 54 HA THR 54 4.486 4.174 -3.056 1955 HB THR 54 HB THR 54 2.421 2.963 -2.387 1956 HG1 THR 54 1HG THR 54 3.690 1.441 -1.060 1957 HG21 THR 54 3HG2 THR 54 4.279 1.549 -4.446 1958 HG22 THR 54 1HG2 THR 54 3.395 3.090 -4.755 1959 HG23 THR 54 2HG2 THR 54 2.476 1.578 -4.445 1960 H VAL 55 H VAL 55 5.872 5.438 -1.543 1961 HA VAL 55 HA VAL 55 4.269 5.901 0.819 1962 HB VAL 55 HB VAL 55 7.364 5.960 0.804 1963 HG11 VAL 55 1HG1 VAL 55 5.316 6.402 3.091 1964 HG12 VAL 55 2HG1 VAL 55 6.167 7.745 2.267 1965 HG13 VAL 55 3HG1 VAL 55 7.104 6.540 3.228 1966 HG21 VAL 55 3HG2 VAL 55 6.649 3.621 0.887 1967 HG22 VAL 55 1HG2 VAL 55 5.330 4.006 2.045 1968 HG23 VAL 55 2HG2 VAL 55 7.049 4.100 2.575 1969 H GLY 56 H GLY 56 7.173 7.737 0.133 1970 HA2 GLY 56 2HA GLY 56 7.474 9.561 -1.180 1971 HA3 GLY 56 1HA GLY 56 5.759 9.443 -1.774 1972 H TYR 57 H TYR 57 7.903 10.559 0.811 1973 HA TYR 57 HA TYR 57 5.787 11.173 2.650 1974 HB2 TYR 57 2HB TYR 57 8.062 10.850 3.554 1975 HB3 TYR 57 1HB TYR 57 8.755 12.027 2.388 1976 HD1 TYR 57 2HD TYR 57 6.660 11.716 5.485 1977 HD2 TYR 57 1HD TYR 57 8.750 14.372 2.831 1978 HE1 TYR 57 2HE TYR 57 6.531 13.493 7.156 1979 HE2 TYR 57 1HE TYR 57 8.519 16.202 4.454 1980 HH TYR 57 HH TYR 57 6.943 15.741 7.651 1981 H GLY 58 H GLY 58 7.684 12.969 0.230 1982 HA2 GLY 58 2HA GLY 58 6.504 14.744 -0.920 1983 HA3 GLY 58 1HA GLY 58 5.885 15.299 0.674 1984 H ASP 59 H ASP 59 9.138 14.196 -0.469 1985 HA ASP 59 HA ASP 59 10.406 16.335 0.989 1986 HB2 ASP 59 2HB ASP 59 11.566 14.120 0.637 1987 HB3 ASP 59 1HB ASP 59 11.542 14.395 -1.129 1988 H ARG 60 H ARG 60 9.538 15.512 -2.409 1989 HA ARG 60 HA ARG 60 9.995 18.317 -3.127 1990 HB2 ARG 60 2HB ARG 60 10.928 16.029 -4.958 1991 HB3 ARG 60 1HB ARG 60 11.184 17.806 -5.177 1992 HG2 ARG 60 2HG ARG 60 12.501 17.781 -2.977 1993 HG3 ARG 60 1HG ARG 60 12.279 15.995 -2.957 1994 HD2 ARG 60 2HD ARG 60 13.637 15.812 -5.085 1995 HD3 ARG 60 1HD ARG 60 14.014 17.596 -4.945 1996 HE ARG 60 HE ARG 60 14.286 15.788 -2.562 1997 HH11 ARG 60 1HH2 ARG 60 16.297 17.842 -4.734 1998 HH12 ARG 60 2HH2 ARG 60 17.149 18.568 -3.441 1999 HH21 ARG 60 1HH1 ARG 60 15.310 16.670 -0.953 2000 HH22 ARG 60 2HH1 ARG 60 16.744 17.641 -1.118 2001 H TYR 61 H TYR 61 9.230 17.712 -6.011 2002 HA TYR 61 HA TYR 61 7.094 16.019 -6.032 2003 HB2 TYR 61 2HB TYR 61 5.234 17.601 -6.626 2004 HB3 TYR 61 1HB TYR 61 5.687 17.723 -4.891 2005 HD1 TYR 61 1HD TYR 61 7.414 19.670 -4.289 2006 HD2 TYR 61 2HD TYR 61 5.017 19.561 -7.865 2007 HE1 TYR 61 1HE TYR 61 7.681 22.088 -4.533 2008 HE2 TYR 61 2HE TYR 61 5.263 21.993 -8.101 2009 HH TYR 61 HH TYR 61 7.059 23.956 -5.686 2010 HA PRO 62 HA PRO 62 8.858 17.304 -10.001 2011 HB2 PRO 62 2HB PRO 62 7.769 15.463 -11.725 2012 HB3 PRO 62 1HB PRO 62 8.925 15.004 -10.447 2013 HG2 PRO 62 2HG PRO 62 5.866 14.852 -10.343 2014 HG3 PRO 62 1HG PRO 62 7.058 13.539 -9.977 2015 HD2 PRO 62 2HD PRO 62 5.993 15.149 -7.960 2016 HD3 PRO 62 1HD PRO 62 7.716 14.570 -7.914 2017 H VAL 63 H VAL 63 7.631 17.779 -12.422 2018 HA VAL 63 HA VAL 63 5.812 19.918 -11.597 2019 HB VAL 63 HB VAL 63 7.541 19.915 -14.111 2020 HG11 VAL 63 1HG1 VAL 63 6.317 22.168 -12.348 2021 HG12 VAL 63 2HG1 VAL 63 5.646 21.661 -13.928 2022 HG13 VAL 63 3HG1 VAL 63 7.274 22.416 -13.851 2023 HG21 VAL 63 3HG2 VAL 63 8.289 20.812 -11.255 2024 HG22 VAL 63 1HG2 VAL 63 9.178 21.286 -12.753 2025 HG23 VAL 63 2HG2 VAL 63 9.123 19.570 -12.264 2026 H THR 64 H THR 64 5.889 19.707 -14.966 2027 HA THR 64 HA THR 64 3.554 17.950 -15.149 2028 HB THR 64 HB THR 64 3.731 20.796 -16.333 2029 HG1 THR 64 1HG THR 64 3.286 20.744 -14.054 2030 HG21 THR 64 3HG2 THR 64 1.386 18.764 -16.325 2031 HG22 THR 64 1HG2 THR 64 2.382 19.189 -17.760 2032 HG23 THR 64 2HG2 THR 64 1.341 20.430 -17.001 2033 H GLU 65 H GLU 65 6.217 19.802 -16.741 2034 HA GLU 65 HA GLU 65 5.781 18.450 -19.234 2035 HB2 GLU 65 2HB GLU 65 6.413 20.872 -19.131 2036 HB3 GLU 65 1HB GLU 65 7.965 20.424 -18.337 2037 HG2 GLU 65 2HG GLU 65 8.191 21.017 -20.771 2038 HG3 GLU 65 1HG GLU 65 8.778 19.358 -20.400 2039 H GLU 66 H GLU 66 7.148 17.453 -16.335 2040 HA GLU 66 HA GLU 66 9.596 16.315 -17.279 2041 HB2 GLU 66 2HB GLU 66 8.766 14.755 -15.058 2042 HB3 GLU 66 1HB GLU 66 9.875 16.134 -15.038 2043 HG2 GLU 66 2HG GLU 66 8.393 16.502 -13.337 2044 HG3 GLU 66 1HG GLU 66 7.938 17.710 -14.575 2045 H GLY 67 H GLY 67 6.277 15.522 -16.785 2046 HA2 GLY 67 2HA GLY 67 4.984 14.389 -18.337 2047 HA3 GLY 67 1HA GLY 67 6.425 13.344 -18.770 2048 H ARG 68 H ARG 68 4.870 14.603 -15.817 2049 HA ARG 68 HA ARG 68 5.413 13.382 -13.859 2050 HB2 ARG 68 2HB ARG 68 3.437 14.907 -14.256 2051 HB3 ARG 68 1HB ARG 68 2.407 13.441 -14.459 2052 HG2 ARG 68 2HG ARG 68 3.057 12.750 -12.101 2053 HG3 ARG 68 1HG ARG 68 4.208 14.136 -12.063 2054 HD2 ARG 68 2HD ARG 68 2.169 15.718 -12.333 2055 HD3 ARG 68 1HD ARG 68 1.109 14.265 -12.082 2056 HE ARG 68 HE ARG 68 1.954 14.045 -9.817 2057 HH11 ARG 68 1HH2 ARG 68 3.735 16.804 -11.491 2058 HH12 ARG 68 2HH2 ARG 68 4.417 17.327 -10.061 2059 HH21 ARG 68 1HH1 ARG 68 2.931 14.662 -8.071 2060 HH22 ARG 68 2HH1 ARG 68 3.850 16.153 -7.946 2061 H LYS 69 H LYS 69 3.943 11.449 -16.276 2062 HA LYS 69 HA LYS 69 3.522 9.099 -14.860 2063 HB2 LYS 69 2HB LYS 69 4.576 9.420 -17.725 2064 HB3 LYS 69 1HB LYS 69 3.881 7.920 -17.005 2065 HG2 LYS 69 2HG LYS 69 1.683 9.085 -16.691 2066 HG3 LYS 69 1HG LYS 69 2.346 10.558 -17.491 2067 HD2 LYS 69 2HD LYS 69 2.840 9.181 -19.549 2068 HD3 LYS 69 1HD LYS 69 2.112 7.748 -18.734 2069 HE2 LYS 69 2HE LYS 69 -0.120 8.916 -18.644 2070 HE3 LYS 69 1HE LYS 69 0.605 10.369 -19.452 2071 HZ1 LYS 69 3HZ LYS 69 -0.517 8.884 -21.057 2072 HZ2 LYS 69 1HZ LYS 69 0.452 7.609 -20.573 2073 HZ3 LYS 69 2HZ LYS 69 1.149 8.975 -21.353 2074 H VAL 70 H VAL 70 6.520 10.805 -15.517 2075 HA VAL 70 HA VAL 70 8.335 8.711 -15.311 2076 HB VAL 70 HB VAL 70 8.503 11.589 -14.264 2077 HG11 VAL 70 1HG1 VAL 70 11.003 11.240 -14.242 2078 HG12 VAL 70 2HG1 VAL 70 10.755 9.473 -14.528 2079 HG13 VAL 70 3HG1 VAL 70 10.180 10.247 -13.003 2080 HG21 VAL 70 3HG2 VAL 70 9.650 10.211 -16.799 2081 HG22 VAL 70 1HG2 VAL 70 9.877 11.937 -16.328 2082 HG23 VAL 70 2HG2 VAL 70 8.254 11.339 -16.776 2083 H ALA 71 H ALA 71 6.513 10.462 -12.760 2084 HA ALA 71 HA ALA 71 7.831 9.113 -10.621 2085 HB1 ALA 71 1HB ALA 71 6.020 10.096 -9.195 2086 HB2 ALA 71 2HB ALA 71 5.114 10.588 -10.675 2087 HB3 ALA 71 3HB ALA 71 6.702 11.343 -10.294 2088 H GLU 72 H GLU 72 4.681 8.690 -12.398 2089 HA GLU 72 HA GLU 72 3.841 6.630 -10.693 2090 HB2 GLU 72 2HB GLU 72 2.025 6.035 -12.057 2091 HB3 GLU 72 1HB GLU 72 2.169 7.807 -12.105 2092 HG2 GLU 72 2HG GLU 72 1.952 7.658 -14.329 2093 HG3 GLU 72 1HG GLU 72 3.623 7.006 -14.399 2094 H GLN 73 H GLN 73 5.815 6.539 -13.643 2095 HA GLN 73 HA GLN 73 5.578 3.863 -14.175 2096 HB2 GLN 73 2HB GLN 73 6.783 5.608 -15.622 2097 HB3 GLN 73 1HB GLN 73 8.186 5.469 -14.514 2098 HG2 GLN 73 2HG GLN 73 8.260 2.939 -15.137 2099 HG3 GLN 73 1HG GLN 73 6.925 3.257 -16.295 2100 HE21 GLN 73 1HE2 GLN 73 10.284 4.369 -15.436 2101 HE22 GLN 73 2HE2 GLN 73 10.831 4.524 -17.066 2102 H VAL 74 H VAL 74 7.612 5.492 -11.757 2103 HA VAL 74 HA VAL 74 9.178 3.183 -11.165 2104 HB VAL 74 HB VAL 74 8.708 5.718 -9.502 2105 HG11 VAL 74 1HG1 VAL 74 10.941 3.559 -9.456 2106 HG12 VAL 74 2HG1 VAL 74 9.744 3.909 -8.156 2107 HG13 VAL 74 3HG1 VAL 74 10.999 5.123 -8.561 2108 HG21 VAL 74 3HG2 VAL 74 10.822 6.512 -10.596 2109 HG22 VAL 74 1HG2 VAL 74 9.530 6.276 -11.806 2110 HG23 VAL 74 2HG2 VAL 74 10.834 5.047 -11.653 2111 H MET 75 H MET 75 6.168 4.638 -9.940 2112 HA MET 75 HA MET 75 5.993 3.115 -7.573 2113 HB2 MET 75 2HB MET 75 3.741 4.351 -9.268 2114 HB3 MET 75 1HB MET 75 3.557 3.743 -7.588 2115 HG2 MET 75 2HG MET 75 4.986 5.492 -6.693 2116 HG3 MET 75 1HG MET 75 5.538 5.976 -8.318 2117 HE1 MET 75 3HE MET 75 4.739 8.140 -6.362 2118 HE2 MET 75 1HE MET 75 3.729 9.197 -7.403 2119 HE3 MET 75 2HE MET 75 5.187 8.393 -8.083 2120 H LYS 76 H LYS 76 4.611 2.687 -10.875 2121 HA LYS 76 HA LYS 76 3.195 0.370 -10.271 2122 HB2 LYS 76 2HB LYS 76 2.895 1.799 -12.358 2123 HB3 LYS 76 1HB LYS 76 4.395 1.068 -13.016 2124 HG2 LYS 76 2HG LYS 76 3.335 -1.214 -12.859 2125 HG3 LYS 76 1HG LYS 76 1.842 -0.484 -12.191 2126 HD2 LYS 76 2HD LYS 76 2.988 0.037 -15.018 2127 HD3 LYS 76 1HD LYS 76 1.724 -1.163 -14.577 2128 HE2 LYS 76 2HE LYS 76 0.338 0.841 -13.634 2129 HE3 LYS 76 1HE LYS 76 1.474 1.920 -14.541 2130 HZ1 LYS 76 3HZ LYS 76 -0.549 1.336 -15.773 2131 HZ2 LYS 76 1HZ LYS 76 -0.229 -0.284 -15.662 2132 HZ3 LYS 76 2HZ LYS 76 0.787 0.720 -16.598 2133 H ALA 77 H ALA 77 6.567 0.802 -11.379 2134 HA ALA 77 HA ALA 77 7.153 -1.874 -11.855 2135 HB1 ALA 77 1HB ALA 77 9.040 0.330 -10.782 2136 HB2 ALA 77 2HB ALA 77 8.688 0.009 -12.521 2137 HB3 ALA 77 3HB ALA 77 9.561 -1.225 -11.537 2138 H GLY 78 H GLY 78 7.282 0.053 -8.840 2139 HA2 GLY 78 2HA GLY 78 8.497 -1.977 -7.285 2140 HA3 GLY 78 1HA GLY 78 7.602 -0.515 -6.728 2141 H ILE 79 H ILE 79 5.096 -0.992 -7.813 2142 HA ILE 79 HA ILE 79 3.964 -2.700 -5.941 2143 HB ILE 79 HB ILE 79 2.857 -1.580 -8.550 2144 HG12 ILE 79 2HG1 ILE 79 2.318 -0.816 -5.601 2145 HG13 ILE 79 1HG1 ILE 79 3.518 0.013 -6.626 2146 HG21 ILE 79 1HG2 ILE 79 0.568 -2.186 -7.653 2147 HG22 ILE 79 2HG2 ILE 79 1.343 -3.062 -6.286 2148 HG23 ILE 79 3HG2 ILE 79 1.541 -3.644 -7.982 2149 HD11 ILE 79 3HD ILE 79 0.472 -0.091 -7.147 2150 HD12 ILE 79 1HD ILE 79 1.429 1.314 -6.578 2151 HD13 ILE 79 2HD ILE 79 1.687 0.674 -8.244 2152 H GLU 80 H GLU 80 4.663 -3.268 -9.468 2153 HA GLU 80 HA GLU 80 3.590 -5.864 -9.358 2154 HB2 GLU 80 2HB GLU 80 5.538 -4.734 -11.436 2155 HB3 GLU 80 1HB GLU 80 4.670 -6.309 -11.538 2156 HG2 GLU 80 2HG GLU 80 2.467 -4.954 -11.239 2157 HG3 GLU 80 1HG GLU 80 3.438 -3.482 -11.578 2158 H VAL 81 H VAL 81 6.963 -4.700 -8.829 2159 HA VAL 81 HA VAL 81 8.100 -7.266 -8.686 2160 HB VAL 81 HB VAL 81 8.854 -4.531 -7.588 2161 HG11 VAL 81 1HG1 VAL 81 10.374 -7.183 -7.124 2162 HG12 VAL 81 2HG1 VAL 81 9.812 -6.003 -5.883 2163 HG13 VAL 81 3HG1 VAL 81 11.132 -5.557 -7.009 2164 HG21 VAL 81 3HG2 VAL 81 9.020 -5.033 -10.073 2165 HG22 VAL 81 1HG2 VAL 81 10.108 -6.422 -9.706 2166 HG23 VAL 81 2HG2 VAL 81 10.630 -4.742 -9.334 2167 H PHE 82 H PHE 82 6.873 -5.122 -6.010 2168 HA PHE 82 HA PHE 82 7.441 -7.167 -4.099 2169 HB2 PHE 82 2HB PHE 82 5.738 -4.601 -3.851 2170 HB3 PHE 82 1HB PHE 82 6.191 -5.664 -2.466 2171 HD1 PHE 82 2HD PHE 82 8.955 -6.289 -2.662 2172 HD2 PHE 82 1HD PHE 82 6.954 -2.626 -3.731 2173 HE1 PHE 82 2HE PHE 82 11.024 -5.029 -2.232 2174 HE2 PHE 82 1HE PHE 82 9.025 -1.372 -3.294 2175 HZ PHE 82 HZ PHE 82 11.070 -2.561 -2.535 2176 H ALA 83 H ALA 83 4.741 -6.664 -6.227 2177 HA ALA 83 HA ALA 83 2.888 -8.144 -4.547 2178 HB1 ALA 83 1HB ALA 83 1.402 -8.166 -6.549 2179 HB2 ALA 83 2HB ALA 83 2.716 -7.437 -7.551 2180 HB3 ALA 83 3HB ALA 83 1.956 -6.500 -6.216 2181 H LEU 84 H LEU 84 5.117 -8.662 -7.316 2182 HA LEU 84 HA LEU 84 4.257 -11.146 -8.088 2183 HB2 LEU 84 2HB LEU 84 5.774 -9.732 -9.400 2184 HB3 LEU 84 1HB LEU 84 7.097 -9.962 -8.221 2185 HG LEU 84 HG LEU 84 5.870 -12.416 -9.558 2186 HD11 LEU 84 1HD1 LEU 84 7.807 -10.501 -11.012 2187 HD12 LEU 84 2HD1 LEU 84 6.078 -10.802 -11.436 2188 HD13 LEU 84 3HD1 LEU 84 7.285 -12.130 -11.588 2189 HD21 LEU 84 3HD2 LEU 84 8.254 -13.222 -9.585 2190 HD22 LEU 84 1HD2 LEU 84 7.747 -12.776 -7.923 2191 HD23 LEU 84 2HD2 LEU 84 8.797 -11.661 -8.868 2192 H VAL 85 H VAL 85 6.444 -10.273 -5.424 2193 HA VAL 85 HA VAL 85 7.476 -12.827 -5.032 2194 HB VAL 85 HB VAL 85 8.312 -12.126 -2.920 2195 HG11 VAL 85 1HG1 VAL 85 8.265 -9.623 -4.738 2196 HG12 VAL 85 2HG1 VAL 85 9.238 -11.089 -5.105 2197 HG13 VAL 85 3HG1 VAL 85 9.553 -10.142 -3.607 2198 HG21 VAL 85 3HG2 VAL 85 7.599 -9.876 -1.920 2199 HG22 VAL 85 1HG2 VAL 85 6.333 -11.146 -1.835 2200 HG23 VAL 85 2HG2 VAL 85 6.225 -9.857 -3.083 2201 H THR 86 H THR 86 4.230 -11.932 -4.664 2202 HA THR 86 HA THR 86 3.492 -13.374 -2.420 2203 HB THR 86 HB THR 86 1.802 -12.930 -4.915 2204 HG1 THR 86 1HG THR 86 2.419 -10.990 -4.231 2205 HG21 THR 86 3HG2 THR 86 -0.094 -13.009 -3.232 2206 HG22 THR 86 1HG2 THR 86 1.074 -13.438 -1.932 2207 HG23 THR 86 2HG2 THR 86 0.768 -14.576 -3.300 2208 H ALA 87 H ALA 87 4.705 -14.543 -5.455 2209 HA ALA 87 HA ALA 87 3.612 -17.133 -5.337 2210 HB1 ALA 87 1HB ALA 87 5.544 -17.820 -6.756 2211 HB2 ALA 87 2HB ALA 87 6.381 -16.263 -6.376 2212 HB3 ALA 87 3HB ALA 87 4.857 -16.264 -7.334 2213 H ALA 88 H ALA 88 6.144 -15.604 -3.390 2214 HA ALA 88 HA ALA 88 7.143 -18.140 -2.354 2215 HB1 ALA 88 1HB ALA 88 8.759 -16.236 -2.628 2216 HB2 ALA 88 2HB ALA 88 8.568 -16.691 -0.904 2217 HB3 ALA 88 3HB ALA 88 7.745 -15.215 -1.539 2218 H LEU 89 H LEU 89 5.219 -15.269 -1.432 2219 HA LEU 89 HA LEU 89 4.810 -15.962 1.226 2220 HB2 LEU 89 2HB LEU 89 2.825 -14.398 -0.524 2221 HB3 LEU 89 1HB LEU 89 2.986 -14.313 1.259 2222 HG LEU 89 HG LEU 89 5.134 -13.410 -0.768 2223 HD11 LEU 89 1HD1 LEU 89 4.447 -11.109 -0.285 2224 HD12 LEU 89 2HD1 LEU 89 3.169 -11.684 0.850 2225 HD13 LEU 89 3HD1 LEU 89 3.034 -12.023 -0.898 2226 HD21 LEU 89 3HD2 LEU 89 6.190 -12.252 1.176 2227 HD22 LEU 89 1HD2 LEU 89 6.163 -14.037 1.406 2228 HD23 LEU 89 2HD2 LEU 89 4.979 -12.996 2.279 2229 H ALA 90 H ALA 90 2.914 -16.749 -1.705 2230 HA ALA 90 HA ALA 90 0.716 -17.769 -0.302 2231 HB1 ALA 90 1HB ALA 90 0.547 -17.016 -2.669 2232 HB2 ALA 90 2HB ALA 90 0.005 -18.726 -2.500 2233 HB3 ALA 90 3HB ALA 90 1.643 -18.351 -3.172 2234 H THR 91 H THR 91 3.854 -19.200 -0.909 2235 HA THR 91 HA THR 91 2.701 -21.853 -0.383 2236 HB THR 91 HB THR 91 4.011 -21.796 -2.372 2237 HG1 THR 91 1HG THR 91 5.015 -23.132 -0.142 2238 HG21 THR 91 3HG2 THR 91 6.350 -20.757 -0.633 2239 HG22 THR 91 1HG2 THR 91 5.458 -19.850 -1.904 2240 HG23 THR 91 2HG2 THR 91 6.414 -21.271 -2.365 2241 H ASP 92 H ASP 92 3.518 -19.179 1.430 2242 HA ASP 92 HA ASP 92 5.330 -20.462 3.206 2243 HB2 ASP 92 2HB ASP 92 5.202 -17.954 3.195 2244 HB3 ASP 92 1HB ASP 92 3.557 -18.071 3.914 2245 H PHE 93 H PHE 93 1.768 -19.956 3.124 2246 HA PHE 93 HA PHE 93 1.320 -21.190 5.574 2247 HB2 PHE 93 2HB PHE 93 -0.986 -21.155 5.183 2248 HB3 PHE 93 1HB PHE 93 -0.393 -19.805 4.175 2249 HD1 PHE 93 2HD PHE 93 -1.870 -23.203 4.161 2250 HD2 PHE 93 1HD PHE 93 -0.498 -19.960 1.705 2251 HE1 PHE 93 2HE PHE 93 -3.129 -24.129 2.242 2252 HE2 PHE 93 1HE PHE 93 -1.740 -20.887 -0.213 2253 HZ PHE 93 HZ PHE 93 -3.084 -22.961 0.053 2254 H VAL 94 H VAL 94 1.770 -22.550 2.377 2255 HA VAL 94 HA VAL 94 0.624 -25.039 2.750 2256 HB VAL 94 HB VAL 94 2.929 -24.219 0.898 2257 HG11 VAL 94 1HG1 VAL 94 2.668 -26.705 0.955 2258 HG12 VAL 94 2HG1 VAL 94 2.014 -26.057 -0.585 2259 HG13 VAL 94 3HG1 VAL 94 0.887 -26.548 0.728 2260 HG21 VAL 94 3HG2 VAL 94 1.057 -23.788 -0.750 2261 HG22 VAL 94 1HG2 VAL 94 0.917 -22.698 0.661 2262 HG23 VAL 94 2HG2 VAL 94 -0.152 -24.137 0.534 2263 H ARG 95 H ARG 95 3.641 -23.723 3.911 2264 HA ARG 95 HA ARG 95 5.082 -26.129 4.178 2265 HB2 ARG 95 2HB ARG 95 5.293 -23.479 5.707 2266 HB3 ARG 95 1HB ARG 95 6.503 -24.802 5.799 2267 HG2 ARG 95 2HG ARG 95 7.148 -24.530 3.486 2268 HG3 ARG 95 1HG ARG 95 5.718 -23.501 3.126 2269 HD2 ARG 95 2HD ARG 95 6.586 -21.678 4.587 2270 HD3 ARG 95 1HD ARG 95 8.075 -22.649 4.938 2271 HE ARG 95 HE ARG 95 7.916 -22.547 2.116 2272 HH11 ARG 95 1HH2 ARG 95 7.681 -19.846 4.529 2273 HH12 ARG 95 2HH2 ARG 95 9.044 -19.029 3.965 2274 HH21 ARG 95 1HH1 ARG 95 9.481 -20.912 0.939 2275 HH22 ARG 95 2HH1 ARG 95 9.763 -19.482 1.758 2276 H ARG 96 H ARG 96 2.318 -24.896 5.919 2277 HA ARG 96 HA ARG 96 2.855 -25.995 8.417 2278 HB2 ARG 96 2HB ARG 96 0.554 -25.727 8.952 2279 HB3 ARG 96 1HB ARG 96 0.984 -24.358 7.884 2280 HG2 ARG 96 2HG ARG 96 -0.105 -25.546 5.933 2281 HG3 ARG 96 1HG ARG 96 -0.416 -26.954 6.974 2282 HD2 ARG 96 2HD ARG 96 -1.959 -25.643 8.427 2283 HD3 ARG 96 1HD ARG 96 -1.714 -24.193 7.368 2284 HE ARG 96 HE ARG 96 -3.063 -25.187 5.741 2285 HH11 ARG 96 1HH2 ARG 96 -2.227 -27.761 8.160 2286 HH12 ARG 96 2HH2 ARG 96 -2.976 -29.013 7.253 2287 HH21 ARG 96 1HH1 ARG 96 -3.844 -27.021 4.399 2288 HH22 ARG 96 2HH1 ARG 96 -3.480 -28.549 4.931 2289 H GLU 97 H GLU 97 1.933 -27.562 5.387 2290 HA GLU 97 HA GLU 97 0.844 -29.931 6.608 2291 HB2 GLU 97 2HB GLU 97 1.908 -29.363 3.786 2292 HB3 GLU 97 1HB GLU 97 1.173 -30.928 4.259 2293 HG2 GLU 97 2HG GLU 97 -0.407 -28.314 4.645 2294 HG3 GLU 97 1HG GLU 97 -0.226 -29.029 3.010 2295 H GLU 98 H GLU 98 4.026 -28.709 5.599 2296 HA GLU 98 HA GLU 98 5.286 -31.279 5.801 2297 HB2 GLU 98 2HB GLU 98 6.569 -28.485 5.723 2298 HB3 GLU 98 1HB GLU 98 7.409 -30.063 5.532 2299 HG2 GLU 98 2HG GLU 98 5.923 -30.494 3.471 2300 HG3 GLU 98 1HG GLU 98 5.333 -28.798 3.615 2301 H GLU 99 H GLU 99 5.019 -28.283 7.784 2302 HA GLU 99 HA GLU 99 6.627 -29.124 9.885 2303 HB2 GLU 99 2HB GLU 99 5.971 -26.739 9.538 2304 HB3 GLU 99 1HB GLU 99 4.292 -27.123 10.033 2305 HG2 GLU 99 2HG GLU 99 5.037 -27.678 12.319 2306 HG3 GLU 99 1HG GLU 99 6.770 -27.525 11.844 2307 H ARG 100 H ARG 100 3.300 -29.893 9.099 2308 HA ARG 100 HA ARG 100 2.294 -30.749 11.466 2309 HB2 ARG 100 2HB ARG 100 1.238 -30.639 9.068 2310 HB3 ARG 100 1HB ARG 100 1.855 -32.293 8.833 2311 HG2 ARG 100 2HG ARG 100 -0.259 -31.313 10.874 2312 HG3 ARG 100 1HG ARG 100 -0.524 -32.225 9.351 2313 HD2 ARG 100 2HD ARG 100 0.959 -34.121 10.434 2314 HD3 ARG 100 1HD ARG 100 0.705 -33.204 11.985 2315 HE ARG 100 HE ARG 100 -1.751 -33.865 10.447 2316 HH11 ARG 100 1HH2 ARG 100 0.628 -35.094 12.954 2317 HH12 ARG 100 2HH2 ARG 100 -0.121 -36.633 13.025 2318 HH21 ARG 100 1HH1 ARG 100 -3.178 -35.521 11.460 2319 HH22 ARG 100 2HH1 ARG 100 -2.450 -36.761 12.386 2320 H ARG 101 H ARG 101 4.434 -32.579 9.234 2321 HA ARG 101 HA ARG 101 4.536 -34.809 11.173 2322 HB2 ARG 101 2HB ARG 101 5.680 -34.573 8.320 2323 HB3 ARG 101 1HB ARG 101 5.855 -36.002 9.401 2324 HG2 ARG 101 2HG ARG 101 3.370 -36.257 9.465 2325 HG3 ARG 101 1HG ARG 101 3.196 -34.902 8.290 2326 HD2 ARG 101 2HD ARG 101 4.421 -36.197 6.540 2327 HD3 ARG 101 1HD ARG 101 4.749 -37.530 7.717 2328 HE ARG 101 HE ARG 101 2.310 -37.935 7.890 2329 HH11 ARG 101 1HH2 ARG 101 3.470 -36.449 4.783 2330 HH12 ARG 101 2HH2 ARG 101 1.960 -36.530 4.055 2331 HH21 ARG 101 1HH1 ARG 101 0.394 -38.379 6.687 2332 HH22 ARG 101 2HH1 ARG 101 0.137 -37.652 5.134 2333 H GLY 102 H GLY 102 6.308 -32.052 9.899 2334 HA2 GLY 102 2HA GLY 102 8.225 -31.137 10.531 2335 HA3 GLY 102 1HA GLY 102 8.478 -32.474 11.729 2336 H HIS 103 H HIS 103 7.767 -32.768 8.237 2337 HA HIS 103 HA HIS 103 10.291 -34.314 8.036 2338 HB2 HIS 103 2HB HIS 103 8.108 -35.486 7.323 2339 HB3 HIS 103 1HB HIS 103 8.071 -34.347 5.934 2340 HD1 HIS 103 1HD HIS 103 10.130 -37.235 7.440 2341 HD2 HIS 103 2HD HIS 103 9.956 -34.972 3.875 2342 HE1 HIS 103 1HE HIS 103 11.845 -38.168 5.873 2343 HE2 HIS 103 2HE HIS 103 11.615 -36.866 3.663 2344 H1 SER 1 H SER 1 -3.403 -24.913 17.580 2345 HA SER 1 HA SER 1 -4.773 -22.590 17.225 2346 HB2 SER 1 2HB SER 1 -1.816 -22.297 18.113 2347 HB3 SER 1 1HB SER 1 -2.858 -20.982 17.451 2348 HG SER 1 1HG SER 1 -2.597 -21.028 19.765 2349 H ALA 2 H ALA 2 -3.557 -21.643 15.130 2350 HA ALA 2 HA ALA 2 -2.772 -24.037 13.653 2351 HB1 ALA 2 1HB ALA 2 -3.525 -21.177 12.835 2352 HB2 ALA 2 2HB ALA 2 -4.430 -22.692 12.518 2353 HB3 ALA 2 3HB ALA 2 -2.866 -22.390 11.680 2354 H ASP 3 H ASP 3 -0.837 -24.123 12.448 2355 HA ASP 3 HA ASP 3 1.388 -23.366 13.846 2356 HB2 ASP 3 2HB ASP 3 1.220 -24.185 10.857 2357 HB3 ASP 3 1HB ASP 3 2.676 -24.311 11.894 2358 H HIS 4 H HIS 4 0.014 -22.122 10.880 2359 HA HIS 4 HA HIS 4 1.951 -20.169 10.310 2360 HB2 HIS 4 2HB HIS 4 0.360 -19.286 8.675 2361 HB3 HIS 4 1HB HIS 4 0.326 -21.064 8.596 2362 HD1 HIS 4 1HD HIS 4 -2.178 -22.152 9.149 2363 HD2 HIS 4 2HD HIS 4 -1.812 -18.060 10.134 2364 HE1 HIS 4 1HE HIS 4 -4.447 -21.304 9.598 2365 HE2 HIS 4 2HE HIS 4 -4.229 -18.845 10.270 2366 H GLU 5 H GLU 5 -0.499 -20.220 12.734 2367 HA GLU 5 HA GLU 5 -1.241 -17.444 12.593 2368 HB2 GLU 5 2HB GLU 5 -2.697 -19.433 13.289 2369 HB3 GLU 5 1HB GLU 5 -1.770 -19.517 14.822 2370 HG2 GLU 5 2HG GLU 5 -2.650 -17.292 15.487 2371 HG3 GLU 5 1HG GLU 5 -3.390 -17.074 13.856 2372 H ARG 6 H ARG 6 0.834 -19.634 14.492 2373 HA ARG 6 HA ARG 6 1.799 -17.912 16.429 2374 HB2 ARG 6 2HB ARG 6 3.369 -20.098 14.856 2375 HB3 ARG 6 1HB ARG 6 3.938 -19.299 16.358 2376 HG2 ARG 6 2HG ARG 6 1.981 -20.283 17.583 2377 HG3 ARG 6 1HG ARG 6 1.549 -21.231 16.119 2378 HD2 ARG 6 2HD ARG 6 4.358 -21.336 17.453 2379 HD3 ARG 6 1HD ARG 6 3.019 -22.396 17.981 2380 HE ARG 6 HE ARG 6 4.591 -22.602 15.435 2381 HH11 ARG 6 1HH2 ARG 6 1.848 -23.908 17.436 2382 HH12 ARG 6 2HH2 ARG 6 1.603 -25.236 16.378 2383 HH21 ARG 6 1HH1 ARG 6 4.303 -24.678 14.176 2384 HH22 ARG 6 2HH1 ARG 6 2.803 -25.440 14.323 2385 H GLU 7 H GLU 7 3.027 -18.604 13.134 2386 HA GLU 7 HA GLU 7 5.344 -17.104 13.401 2387 HB2 GLU 7 2HB GLU 7 4.823 -18.981 11.676 2388 HB3 GLU 7 1HB GLU 7 3.956 -17.725 10.738 2389 HG2 GLU 7 2HG GLU 7 6.062 -17.777 9.713 2390 HG3 GLU 7 1HG GLU 7 6.258 -16.393 10.841 2391 H ALA 8 H ALA 8 2.111 -16.267 12.176 2392 HA ALA 8 HA ALA 8 2.744 -13.754 11.131 2393 HB1 ALA 8 1HB ALA 8 0.283 -13.258 11.372 2394 HB2 ALA 8 2HB ALA 8 0.099 -14.725 12.404 2395 HB3 ALA 8 3HB ALA 8 0.556 -14.894 10.666 2396 H GLN 9 H GLN 9 1.866 -14.788 14.453 2397 HA GLN 9 HA GLN 9 1.567 -12.151 15.443 2398 HB2 GLN 9 2HB GLN 9 2.203 -14.769 16.925 2399 HB3 GLN 9 1HB GLN 9 1.818 -13.207 17.733 2400 HG2 GLN 9 2HG GLN 9 -0.429 -13.163 16.639 2401 HG3 GLN 9 1HG GLN 9 -0.092 -14.736 15.841 2402 HE21 GLN 9 1HE2 GLN 9 -1.961 -13.655 18.205 2403 HE22 GLN 9 2HE2 GLN 9 -1.826 -14.940 19.366 2404 H LYS 10 H LYS 10 4.352 -14.361 15.144 2405 HA LYS 10 HA LYS 10 6.043 -12.801 16.793 2406 HB2 LYS 10 2HB LYS 10 6.760 -14.816 14.586 2407 HB3 LYS 10 1HB LYS 10 7.937 -14.059 15.718 2408 HG2 LYS 10 2HG LYS 10 6.573 -14.945 17.656 2409 HG3 LYS 10 1HG LYS 10 5.578 -15.890 16.499 2410 HD2 LYS 10 2HD LYS 10 7.624 -17.103 15.706 2411 HD3 LYS 10 1HD LYS 10 8.637 -16.123 16.814 2412 HE2 LYS 10 2HE LYS 10 6.476 -18.182 17.643 2413 HE3 LYS 10 1HE LYS 10 8.271 -18.339 17.811 2414 HZ1 LYS 10 3HZ LYS 10 8.080 -16.252 19.252 2415 HZ2 LYS 10 1HZ LYS 10 7.450 -17.730 19.885 2416 HZ3 LYS 10 2HZ LYS 10 6.404 -16.543 19.272 2417 H ALA 11 H ALA 11 5.260 -12.743 13.339 2418 HA ALA 11 HA ALA 11 7.277 -11.034 12.494 2419 HB1 ALA 11 1HB ALA 11 4.406 -11.209 11.380 2420 HB2 ALA 11 2HB ALA 11 5.745 -12.337 10.953 2421 HB3 ALA 11 3HB ALA 11 5.867 -10.600 10.513 2422 H GLU 12 H GLU 12 4.007 -10.278 13.871 2423 HA GLU 12 HA GLU 12 4.297 -7.513 13.433 2424 HB2 GLU 12 2HB GLU 12 2.496 -8.855 15.524 2425 HB3 GLU 12 1HB GLU 12 2.483 -7.123 15.049 2426 HG2 GLU 12 2HG GLU 12 2.043 -7.939 12.610 2427 HG3 GLU 12 1HG GLU 12 1.671 -9.546 13.332 2428 H GLU 13 H GLU 13 5.347 -9.580 16.169 2429 HA GLU 13 HA GLU 13 5.994 -7.330 17.807 2430 HB2 GLU 13 2HB GLU 13 7.099 -10.173 17.909 2431 HB3 GLU 13 1HB GLU 13 7.332 -8.921 19.182 2432 HG2 GLU 13 2HG GLU 13 4.804 -8.845 19.490 2433 HG3 GLU 13 1HG GLU 13 4.658 -10.218 18.326 2434 H GLU 14 H GLU 14 7.747 -9.227 15.355 2435 HA GLU 14 HA GLU 14 10.317 -8.252 15.877 2436 HB2 GLU 14 2HB GLU 14 9.700 -10.291 14.458 2437 HB3 GLU 14 1HB GLU 14 9.114 -9.162 13.198 2438 HG2 GLU 14 2HG GLU 14 11.262 -9.885 12.478 2439 HG3 GLU 14 1HG GLU 14 11.519 -8.212 13.078 2440 H LEU 15 H LEU 15 7.573 -7.045 13.938 2441 HA LEU 15 HA LEU 15 8.933 -5.025 12.640 2442 HB2 LEU 15 2HB LEU 15 6.601 -5.837 12.098 2443 HB3 LEU 15 1HB LEU 15 5.984 -4.972 13.535 2444 HG LEU 15 HG LEU 15 6.584 -2.798 12.557 2445 HD11 LEU 15 1HD1 LEU 15 7.537 -2.631 10.204 2446 HD12 LEU 15 2HD1 LEU 15 7.871 -4.398 10.249 2447 HD13 LEU 15 3HD1 LEU 15 8.693 -3.276 11.397 2448 HD21 LEU 15 3HD2 LEU 15 5.180 -4.567 10.444 2449 HD22 LEU 15 1HD2 LEU 15 5.059 -2.780 10.582 2450 HD23 LEU 15 2HD2 LEU 15 4.395 -3.827 11.887 2451 H GLN 16 H GLN 16 7.436 -5.063 15.896 2452 HA GLN 16 HA GLN 16 7.777 -2.269 16.233 2453 HB2 GLN 16 2HB GLN 16 7.479 -4.313 18.484 2454 HB3 GLN 16 1HB GLN 16 7.226 -2.529 18.554 2455 HG2 GLN 16 2HG GLN 16 5.468 -2.959 16.594 2456 HG3 GLN 16 1HG GLN 16 5.492 -4.668 17.152 2457 HE21 GLN 16 1HE2 GLN 16 5.826 -4.101 20.041 2458 HE22 GLN 16 2HE2 GLN 16 4.401 -3.284 20.589 2459 H LYS 17 H LYS 17 10.000 -4.916 16.433 2460 HA LYS 17 HA LYS 17 11.820 -3.703 18.245 2461 HB2 LYS 17 2HB LYS 17 11.682 -6.176 17.737 2462 HB3 LYS 17 1HB LYS 17 12.329 -5.819 16.101 2463 HG2 LYS 17 2HG LYS 17 14.465 -4.988 17.146 2464 HG3 LYS 17 1HG LYS 17 13.765 -5.245 18.780 2465 HD2 LYS 17 2HD LYS 17 15.289 -7.103 18.185 2466 HD3 LYS 17 1HD LYS 17 13.593 -7.680 18.368 2467 HE2 LYS 17 2HE LYS 17 13.333 -7.634 15.831 2468 HE3 LYS 17 1HE LYS 17 15.068 -7.159 15.678 2469 HZ1 LYS 17 3HZ LYS 17 14.357 -9.522 15.423 2470 HZ2 LYS 17 1HZ LYS 17 14.182 -9.632 17.094 2471 HZ3 LYS 17 2HZ LYS 17 15.729 -9.255 16.425 2472 H VAL 18 H VAL 18 11.367 -3.622 14.651 2473 HA VAL 18 HA VAL 18 13.860 -2.186 14.382 2474 HB VAL 18 HB VAL 18 13.278 -1.848 12.025 2475 HG11 VAL 18 1HG1 VAL 18 13.648 -4.259 11.459 2476 HG12 VAL 18 2HG1 VAL 18 13.138 -4.752 13.111 2477 HG13 VAL 18 3HG1 VAL 18 14.640 -3.782 12.884 2478 HG21 VAL 18 3HG2 VAL 18 10.865 -3.689 12.642 2479 HG22 VAL 18 1HG2 VAL 18 11.364 -3.060 11.041 2480 HG23 VAL 18 2HG2 VAL 18 10.728 -1.926 12.279 2481 H LEU 19 H LEU 19 10.475 -1.354 14.916 2482 HA LEU 19 HA LEU 19 10.595 1.316 14.112 2483 HB2 LEU 19 2HB LEU 19 8.970 0.032 16.398 2484 HB3 LEU 19 1HB LEU 19 8.744 1.724 15.850 2485 HG LEU 19 HG LEU 19 8.337 -0.735 14.050 2486 HD11 LEU 19 1HD1 LEU 19 6.625 -0.575 15.942 2487 HD12 LEU 19 2HD1 LEU 19 5.928 -0.379 14.294 2488 HD13 LEU 19 3HD1 LEU 19 6.184 1.055 15.343 2489 HD21 LEU 19 3HD2 LEU 19 7.111 1.009 12.616 2490 HD22 LEU 19 1HD2 LEU 19 8.901 1.208 12.675 2491 HD23 LEU 19 2HD2 LEU 19 7.836 2.273 13.660 2492 H GLU 20 H GLU 20 11.345 -0.183 17.309 2493 HA GLU 20 HA GLU 20 11.892 2.299 18.544 2494 HB2 GLU 20 2HB GLU 20 13.005 0.929 20.359 2495 HB3 GLU 20 1HB GLU 20 11.310 0.510 19.974 2496 HG2 GLU 20 2HG GLU 20 12.179 -1.394 18.498 2497 HG3 GLU 20 1HG GLU 20 13.827 -1.080 19.138 2498 H GLU 21 H GLU 21 13.955 -0.062 16.823 2499 HA GLU 21 HA GLU 21 16.415 1.158 17.346 2500 HB2 GLU 21 2HB GLU 21 15.323 -0.926 15.559 2501 HB3 GLU 21 1HB GLU 21 16.615 -0.031 14.735 2502 HG2 GLU 21 2HG GLU 21 17.143 -1.011 17.595 2503 HG3 GLU 21 1HG GLU 21 17.077 -2.222 16.266 2504 H ALA 22 H ALA 22 14.009 1.731 14.765 2505 HA ALA 22 HA ALA 22 15.582 3.488 13.274 2506 HB1 ALA 22 1HB ALA 22 13.448 4.225 12.227 2507 HB2 ALA 22 2HB ALA 22 12.522 3.450 13.560 2508 HB3 ALA 22 3HB ALA 22 13.468 2.431 12.431 2509 H SER 23 H SER 23 13.567 4.010 16.127 2510 HA SER 23 HA SER 23 13.360 6.803 15.950 2511 HB2 SER 23 2HB SER 23 13.407 5.084 18.524 2512 HB3 SER 23 1HB SER 23 12.625 6.692 18.295 2513 HG SER 23 1HG SER 23 11.918 4.185 17.086 2514 H LYS 24 H LYS 24 15.695 4.627 17.539 2515 HA LYS 24 HA LYS 24 17.192 6.589 18.881 2516 HB2 LYS 24 2HB LYS 24 17.193 4.139 19.447 2517 HB3 LYS 24 1HB LYS 24 17.887 3.769 17.840 2518 HG2 LYS 24 2HG LYS 24 19.967 5.113 18.515 2519 HG3 LYS 24 1HG LYS 24 19.292 5.212 20.177 2520 HD2 LYS 24 2HD LYS 24 19.315 2.726 20.349 2521 HD3 LYS 24 1HD LYS 24 19.709 2.597 18.597 2522 HE2 LYS 24 2HE LYS 24 21.914 3.805 19.040 2523 HE3 LYS 24 1HE LYS 24 21.570 3.706 20.812 2524 HZ1 LYS 24 3HZ LYS 24 22.995 1.965 19.979 2525 HZ2 LYS 24 1HZ LYS 24 21.766 1.399 18.925 2526 HZ3 LYS 24 2HZ LYS 24 21.545 1.302 20.622 2527 H LYS 25 H LYS 25 17.748 4.811 15.799 2528 HA LYS 25 HA LYS 25 20.098 6.229 15.173 2529 HB2 LYS 25 2HB LYS 25 18.181 4.673 13.335 2530 HB3 LYS 25 1HB LYS 25 19.769 5.356 12.832 2531 HG2 LYS 25 2HG LYS 25 20.879 4.002 14.670 2532 HG3 LYS 25 1HG LYS 25 19.343 3.116 14.926 2533 HD2 LYS 25 2HD LYS 25 20.668 3.363 12.155 2534 HD3 LYS 25 1HD LYS 25 21.252 2.146 13.322 2535 HE2 LYS 25 2HE LYS 25 18.266 2.253 12.508 2536 HE3 LYS 25 1HE LYS 25 19.511 1.402 11.507 2537 HZ1 LYS 25 3HZ LYS 25 18.489 -0.136 12.989 2538 HZ2 LYS 25 1HZ LYS 25 18.925 0.762 14.392 2539 HZ3 LYS 25 2HZ LYS 25 20.082 0.055 13.429 2540 H ALA 26 H ALA 26 16.618 6.826 14.367 2541 HA ALA 26 HA ALA 26 17.037 8.752 12.451 2542 HB1 ALA 26 1HB ALA 26 14.762 9.658 13.030 2543 HB2 ALA 26 2HB ALA 26 14.742 8.620 14.504 2544 HB3 ALA 26 3HB ALA 26 14.757 7.873 12.863 2545 H VAL 27 H VAL 27 16.719 9.201 16.043 2546 HA VAL 27 HA VAL 27 16.849 11.989 15.923 2547 HB VAL 27 HB VAL 27 17.804 10.089 18.140 2548 HG11 VAL 27 1HG1 VAL 27 17.373 13.161 18.166 2549 HG12 VAL 27 2HG1 VAL 27 18.911 12.287 18.516 2550 HG13 VAL 27 3HG1 VAL 27 17.527 12.143 19.650 2551 HG21 VAL 27 3HG2 VAL 27 15.349 9.985 17.508 2552 HG22 VAL 27 1HG2 VAL 27 15.219 11.757 17.755 2553 HG23 VAL 27 2HG2 VAL 27 15.600 10.673 19.144 2554 H GLU 28 H GLU 28 19.495 9.565 16.334 2555 HA GLU 28 HA GLU 28 21.440 11.609 16.599 2556 HB2 GLU 28 2HB GLU 28 21.810 8.661 15.849 2557 HB3 GLU 28 1HB GLU 28 23.110 9.764 16.414 2558 HG2 GLU 28 2HG GLU 28 20.638 9.012 18.142 2559 HG3 GLU 28 1HG GLU 28 22.175 8.090 18.111 2560 H ALA 29 H ALA 29 20.113 9.806 13.843 2561 HA ALA 29 HA ALA 29 22.173 10.453 12.041 2562 HB1 ALA 29 1HB ALA 29 20.611 9.663 10.301 2563 HB2 ALA 29 2HB ALA 29 19.236 9.715 11.467 2564 HB3 ALA 29 3HB ALA 29 20.590 8.540 11.677 2565 H GLU 30 H GLU 30 18.986 11.893 12.826 2566 HA GLU 30 HA GLU 30 19.010 13.937 10.925 2567 HB2 GLU 30 2HB GLU 30 17.030 13.088 12.278 2568 HB3 GLU 30 1HB GLU 30 17.689 13.895 13.730 2569 HG2 GLU 30 2HG GLU 30 17.343 15.552 11.198 2570 HG3 GLU 30 1HG GLU 30 15.860 14.960 11.999 2571 H ARG 31 H ARG 31 20.153 13.688 14.270 2572 HA ARG 31 HA ARG 31 20.578 16.290 14.789 2573 HB2 ARG 31 2HB ARG 31 20.682 14.343 16.416 2574 HB3 ARG 31 1HB ARG 31 22.310 13.946 15.796 2575 HG2 ARG 31 2HG ARG 31 22.464 15.036 17.905 2576 HG3 ARG 31 1HG ARG 31 23.134 16.181 16.699 2577 HD2 ARG 31 2HD ARG 31 21.344 17.725 16.938 2578 HD3 ARG 31 1HD ARG 31 20.158 16.434 17.397 2579 HE ARG 31 HE ARG 31 21.744 16.239 19.528 2580 HH11 ARG 31 1HH2 ARG 31 20.695 19.375 18.080 2581 HH12 ARG 31 2HH2 ARG 31 19.877 19.895 19.484 2582 HH21 ARG 31 1HH1 ARG 31 20.933 17.130 21.530 2583 HH22 ARG 31 2HH1 ARG 31 19.995 18.542 21.546 2584 H GLY 32 H GLY 32 21.503 17.423 13.046 2585 HA2 GLY 32 2HA GLY 32 23.700 18.573 12.987 2586 HA3 GLY 32 1HA GLY 32 24.375 16.953 12.561 2587 H ALA 33 H ALA 33 21.344 16.908 11.190 2588 HA ALA 33 HA ALA 33 22.572 17.188 8.667 2589 HB1 ALA 33 1HB ALA 33 19.681 16.514 9.452 2590 HB2 ALA 33 2HB ALA 33 20.983 15.341 9.088 2591 HB3 ALA 33 3HB ALA 33 20.335 16.399 7.788 2592 HA PRO 34 HA PRO 34 20.923 21.240 7.876 2593 HB2 PRO 34 2HB PRO 34 21.121 21.422 5.100 2594 HB3 PRO 34 1HB PRO 34 22.569 21.374 6.179 2595 HG2 PRO 34 2HG PRO 34 21.283 19.045 4.655 2596 HG3 PRO 34 1HG PRO 34 23.041 19.489 4.738 2597 HD2 PRO 34 2HD PRO 34 21.859 17.541 6.366 2598 HD3 PRO 34 1HD PRO 34 23.235 18.581 6.957 2599 H GLY 35 H GLY 35 18.866 22.183 7.604 2600 HA2 GLY 35 2HA GLY 35 16.748 22.396 7.031 2601 HA3 GLY 35 1HA GLY 35 17.051 21.245 5.670 2602 H ALA 36 H ALA 36 17.747 20.267 8.906 2603 HA ALA 36 HA ALA 36 16.169 17.996 8.676 2604 HB1 ALA 36 1HB ALA 36 17.051 17.499 10.901 2605 HB2 ALA 36 2HB ALA 36 17.557 19.194 11.156 2606 HB3 ALA 36 3HB ALA 36 18.363 18.172 9.906 2607 H ALA 37 H ALA 37 14.649 17.255 10.587 2608 HA ALA 37 HA ALA 37 13.152 19.303 11.821 2609 HB1 ALA 37 1HB ALA 37 12.239 19.629 9.484 2610 HB2 ALA 37 2HB ALA 37 10.969 19.002 10.591 2611 HB3 ALA 37 3HB ALA 37 11.789 17.882 9.432 2612 H LEU 38 H LEU 38 14.469 16.759 12.668 2613 HA LEU 38 HA LEU 38 12.113 15.422 13.708 2614 HB2 LEU 38 2HB LEU 38 12.393 14.199 11.596 2615 HB3 LEU 38 1HB LEU 38 14.134 13.997 11.894 2616 HG LEU 38 HG LEU 38 13.797 12.397 13.642 2617 HD11 LEU 38 1HD1 LEU 38 10.750 12.794 13.423 2618 HD12 LEU 38 2HD1 LEU 38 11.790 13.272 14.823 2619 HD13 LEU 38 3HD1 LEU 38 11.599 11.541 14.384 2620 HD21 LEU 38 3HD2 LEU 38 13.722 11.603 11.287 2621 HD22 LEU 38 1HD2 LEU 38 11.923 11.749 11.274 2622 HD23 LEU 38 2HD2 LEU 38 12.725 10.565 12.368 2623 H ILE 39 H ILE 39 13.086 16.666 15.542 2624 HA ILE 39 HA ILE 39 15.598 15.519 16.514 2625 HB ILE 39 HB ILE 39 15.460 17.403 18.203 2626 HG12 ILE 39 2HG1 ILE 39 13.206 18.462 16.364 2627 HG13 ILE 39 1HG1 ILE 39 12.931 17.769 17.997 2628 HG21 ILE 39 1HG2 ILE 39 15.492 18.233 15.230 2629 HG22 ILE 39 2HG2 ILE 39 16.845 17.456 16.099 2630 HG23 ILE 39 3HG2 ILE 39 16.295 19.095 16.592 2631 HD11 ILE 39 3HD ILE 39 14.579 20.304 17.347 2632 HD12 ILE 39 1HD ILE 39 12.961 20.224 18.122 2633 HD13 ILE 39 2HD ILE 39 14.400 19.576 18.990 2634 H SER 40 H SER 40 15.653 15.036 18.851 2635 HA SER 40 HA SER 40 14.965 14.621 20.846 2636 HB2 SER 40 2HB SER 40 13.129 16.446 20.365 2637 HB3 SER 40 1HB SER 40 11.995 15.059 20.287 2638 HG SER 40 1HG SER 40 12.089 15.900 22.351 2639 H TYR 41 H TYR 41 14.752 12.682 21.886 2640 HA TYR 41 HA TYR 41 14.038 10.384 20.457 2641 HB2 TYR 41 2HB TYR 41 14.012 10.349 23.511 2642 HB3 TYR 41 1HB TYR 41 14.490 9.067 22.366 2643 HD1 TYR 41 2HD TYR 41 16.703 9.599 20.935 2644 HD2 TYR 41 1HD TYR 41 15.603 11.597 24.588 2645 HE1 TYR 41 2HE TYR 41 19.066 10.163 21.341 2646 HE2 TYR 41 1HE TYR 41 17.950 12.144 25.006 2647 HH TYR 41 HH TYR 41 20.095 11.993 24.290 2648 HA PRO 42 HA PRO 42 10.106 10.155 22.975 2649 HB2 PRO 42 2HB PRO 42 8.737 12.603 23.629 2650 HB3 PRO 42 1HB PRO 42 9.653 11.533 24.759 2651 HG2 PRO 42 2HG PRO 42 10.634 14.002 23.242 2652 HG3 PRO 42 1HG PRO 42 10.949 13.558 24.969 2653 HD2 PRO 42 2HD PRO 42 12.836 13.104 23.084 2654 HD3 PRO 42 1HD PRO 42 12.491 11.785 24.287 2655 H ASP 43 H ASP 43 10.557 12.748 20.660 2656 HA ASP 43 HA ASP 43 7.935 12.494 19.514 2657 HB2 ASP 43 2HB ASP 43 10.474 14.030 18.629 2658 HB3 ASP 43 1HB ASP 43 8.918 14.057 17.732 2659 H ALA 44 H ALA 44 11.256 11.348 18.947 2660 HA ALA 44 HA ALA 44 10.998 10.662 16.315 2661 HB1 ALA 44 1HB ALA 44 12.987 9.185 16.629 2662 HB2 ALA 44 2HB ALA 44 12.770 9.293 18.422 2663 HB3 ALA 44 3HB ALA 44 13.170 10.766 17.459 2664 H ILE 45 H ILE 45 9.980 8.768 19.135 2665 HA ILE 45 HA ILE 45 9.693 6.370 17.639 2666 HB ILE 45 HB ILE 45 10.072 6.286 20.004 2667 HG12 ILE 45 2HG1 ILE 45 7.315 5.113 19.285 2668 HG13 ILE 45 1HG1 ILE 45 8.906 4.430 18.812 2669 HG21 ILE 45 1HG2 ILE 45 8.878 8.366 20.687 2670 HG22 ILE 45 2HG2 ILE 45 8.338 6.955 21.648 2671 HG23 ILE 45 3HG2 ILE 45 7.289 7.592 20.340 2672 HD11 ILE 45 3HD ILE 45 7.873 4.780 21.710 2673 HD12 ILE 45 1HD ILE 45 8.057 3.240 20.803 2674 HD13 ILE 45 2HD ILE 45 9.517 4.191 21.262 2675 H TRP 46 H TRP 46 7.634 9.209 18.123 2676 HA TRP 46 HA TRP 46 5.242 7.916 17.252 2677 HB2 TRP 46 2HB TRP 46 6.028 10.571 18.221 2678 HB3 TRP 46 1HB TRP 46 5.125 10.777 16.704 2679 HD1 TRP 46 HD TRP 46 2.845 11.654 17.511 2680 HE1 TRP 46 1HE TRP 46 1.121 11.030 19.294 2681 HE3 TRP 46 3HE TRP 46 5.300 7.679 19.592 2682 HZ2 TRP 46 2HZ TRP 46 0.803 9.021 21.303 2683 HZ3 TRP 46 3HZ TRP 46 4.241 6.447 21.442 2684 HH2 TRP 46 HH TRP 46 2.015 7.105 22.291 2685 H TRP 47 H TRP 47 7.887 9.700 15.679 2686 HA TRP 47 HA TRP 47 6.732 9.766 13.089 2687 HB2 TRP 47 2HB TRP 47 8.691 11.185 13.502 2688 HB3 TRP 47 1HB TRP 47 9.643 9.788 14.104 2689 HD1 TRP 47 HD TRP 47 8.141 10.931 10.631 2690 HE1 TRP 47 1HE TRP 47 9.462 9.803 8.805 2691 HE3 TRP 47 3HE TRP 47 11.231 8.160 13.578 2692 HZ2 TRP 47 2HZ TRP 47 11.667 7.951 8.599 2693 HZ3 TRP 47 3HZ TRP 47 12.829 6.607 12.516 2694 HH2 TRP 47 HH TRP 47 13.057 6.510 10.055 2695 H SER 48 H SER 48 8.594 7.344 14.896 2696 HA SER 48 HA SER 48 9.243 5.789 12.681 2697 HB2 SER 48 2HB SER 48 10.252 5.733 15.074 2698 HB3 SER 48 1HB SER 48 8.864 4.679 15.524 2699 HG SER 48 1HG SER 48 10.754 3.565 14.857 2700 H VAL 49 H VAL 49 6.422 5.696 14.943 2701 HA VAL 49 HA VAL 49 5.345 3.405 13.594 2702 HB VAL 49 HB VAL 49 3.828 5.086 15.610 2703 HG11 VAL 49 1HG1 VAL 49 3.764 2.087 14.789 2704 HG12 VAL 49 2HG1 VAL 49 2.549 3.334 14.310 2705 HG13 VAL 49 3HG1 VAL 49 2.732 2.885 16.032 2706 HG21 VAL 49 3HG2 VAL 49 6.027 2.961 16.066 2707 HG22 VAL 49 1HG2 VAL 49 4.750 3.331 17.282 2708 HG23 VAL 49 2HG2 VAL 49 5.894 4.604 16.779 2709 H GLU 50 H GLU 50 5.627 4.804 11.550 2710 HA GLU 50 HA GLU 50 2.992 4.878 10.630 2711 HB2 GLU 50 2HB GLU 50 2.956 7.092 9.413 2712 HB3 GLU 50 1HB GLU 50 2.631 7.129 11.167 2713 HG2 GLU 50 2HG GLU 50 4.853 8.042 11.655 2714 HG3 GLU 50 1HG GLU 50 5.317 7.987 9.911 2715 H THR 51 H THR 51 6.453 5.366 10.167 2716 HA THR 51 HA THR 51 6.456 5.138 7.403 2717 HB THR 51 HB THR 51 8.680 4.388 9.380 2718 HG1 THR 51 1HG THR 51 8.127 6.487 9.825 2719 HG21 THR 51 3HG2 THR 51 9.152 3.718 6.980 2720 HG22 THR 51 1HG2 THR 51 10.169 5.115 7.466 2721 HG23 THR 51 2HG2 THR 51 8.716 5.377 6.432 2722 H ALA 52 H ALA 52 6.497 2.614 9.939 2723 HA ALA 52 HA ALA 52 7.184 0.484 8.200 2724 HB1 ALA 52 1HB ALA 52 7.437 0.185 10.639 2725 HB2 ALA 52 2HB ALA 52 6.253 -1.008 10.010 2726 HB3 ALA 52 3HB ALA 52 5.661 0.451 10.881 2727 H THR 53 H THR 53 4.110 2.166 8.867 2728 HA THR 53 HA THR 53 2.609 0.037 7.597 2729 HB THR 53 HB THR 53 0.717 1.793 8.219 2730 HG1 THR 53 1HG THR 53 2.134 3.462 8.803 2731 HG21 THR 53 3HG2 THR 53 2.375 0.231 10.328 2732 HG22 THR 53 1HG2 THR 53 1.077 -0.452 9.278 2733 HG23 THR 53 2HG2 THR 53 0.671 0.792 10.517 2734 H THR 54 H THR 54 4.663 2.040 6.282 2735 HA THR 54 HA THR 54 4.857 3.191 4.430 2736 HB THR 54 HB THR 54 3.893 2.044 2.383 2737 HG1 THR 54 1HG THR 54 2.045 1.253 3.503 2738 HG21 THR 54 3HG2 THR 54 6.088 1.459 3.430 2739 HG22 THR 54 1HG2 THR 54 5.275 0.011 2.749 2740 HG23 THR 54 2HG2 THR 54 5.279 0.277 4.532 2741 H VAL 55 H VAL 55 3.378 4.905 5.764 2742 HA VAL 55 HA VAL 55 1.397 5.769 3.760 2743 HB VAL 55 HB VAL 55 0.039 5.090 5.512 2744 HG11 VAL 55 1HG1 VAL 55 1.934 6.384 7.579 2745 HG12 VAL 55 2HG1 VAL 55 1.647 4.628 7.274 2746 HG13 VAL 55 3HG1 VAL 55 0.333 5.664 7.903 2747 HG21 VAL 55 3HG2 VAL 55 0.472 8.125 5.923 2748 HG22 VAL 55 1HG2 VAL 55 -1.016 7.177 6.276 2749 HG23 VAL 55 2HG2 VAL 55 -0.440 7.359 4.583 2750 H GLY 56 H GLY 56 2.825 7.402 6.632 2751 HA2 GLY 56 2HA GLY 56 4.442 8.962 6.718 2752 HA3 GLY 56 1HA GLY 56 4.790 8.703 4.955 2753 H TYR 57 H TYR 57 2.235 9.956 7.175 2754 HA TYR 57 HA TYR 57 0.765 10.999 4.994 2755 HB2 TYR 57 2HB TYR 57 0.103 10.220 7.491 2756 HB3 TYR 57 1HB TYR 57 0.383 11.940 7.890 2757 HD1 TYR 57 2HD TYR 57 -0.963 13.619 6.094 2758 HD2 TYR 57 1HD TYR 57 -2.074 9.612 7.196 2759 HE1 TYR 57 2HE TYR 57 -3.302 14.127 5.591 2760 HE2 TYR 57 1HE TYR 57 -4.438 10.148 6.727 2761 HH TYR 57 HH TYR 57 -5.430 12.886 4.925 2762 H GLY 58 H GLY 58 3.251 12.281 7.085 2763 HA2 GLY 58 2HA GLY 58 4.413 13.944 5.638 2764 HA3 GLY 58 1HA GLY 58 2.929 14.939 5.784 2765 H ASP 59 H ASP 59 4.249 13.020 8.526 2766 HA ASP 59 HA ASP 59 4.212 15.486 9.938 2767 HB2 ASP 59 2HB ASP 59 3.368 13.377 10.954 2768 HB3 ASP 59 1HB ASP 59 5.056 12.802 11.125 2769 H ARG 60 H ARG 60 6.939 12.991 9.867 2770 HA ARG 60 HA ARG 60 8.774 15.276 9.637 2771 HB2 ARG 60 2HB ARG 60 9.485 12.843 11.347 2772 HB3 ARG 60 1HB ARG 60 10.267 14.452 11.314 2773 HG2 ARG 60 2HG ARG 60 7.467 13.803 12.425 2774 HG3 ARG 60 1HG ARG 60 8.936 13.873 13.426 2775 HD2 ARG 60 2HD ARG 60 9.155 16.217 13.328 2776 HD3 ARG 60 1HD ARG 60 8.176 16.363 11.802 2777 HE ARG 60 HE ARG 60 6.352 15.246 13.518 2778 HH11 ARG 60 1HH2 ARG 60 8.403 18.221 13.997 2779 HH12 ARG 60 2HH2 ARG 60 7.051 19.235 14.275 2780 HH21 ARG 60 1HH1 ARG 60 4.616 16.709 13.594 2781 HH22 ARG 60 2HH1 ARG 60 4.817 18.311 14.204 2782 H TYR 61 H TYR 61 10.964 14.451 8.597 2783 HA TYR 61 HA TYR 61 10.852 11.777 7.751 2784 HB2 TYR 61 2HB TYR 61 9.540 13.191 5.941 2785 HB3 TYR 61 1HB TYR 61 11.130 13.862 5.471 2786 HD1 TYR 61 2HD TYR 61 9.414 10.557 6.213 2787 HD2 TYR 61 1HD TYR 61 12.230 12.676 3.751 2788 HE1 TYR 61 2HE TYR 61 9.764 8.521 4.876 2789 HE2 TYR 61 1HE TYR 61 12.546 10.667 2.379 2790 HH TYR 61 HH TYR 61 10.660 7.719 2.845 2791 HA PRO 62 HA PRO 62 15.151 13.054 8.048 2792 HB2 PRO 62 2HB PRO 62 16.373 10.889 6.624 2793 HB3 PRO 62 1HB PRO 62 15.802 10.802 8.335 2794 HG2 PRO 62 2HG PRO 62 14.313 9.953 5.793 2795 HG3 PRO 62 1HG PRO 62 14.543 9.013 7.335 2796 HD2 PRO 62 2HD PRO 62 12.255 10.402 6.871 2797 HD3 PRO 62 1HD PRO 62 13.006 10.497 8.525 2798 H VAL 63 H VAL 63 16.801 14.142 6.772 2799 HA VAL 63 HA VAL 63 15.846 14.851 4.176 2800 HB VAL 63 HB VAL 63 18.215 15.964 5.738 2801 HG11 VAL 63 1HG1 VAL 63 16.601 16.923 3.271 2802 HG12 VAL 63 2HG1 VAL 63 18.393 16.659 3.390 2803 HG13 VAL 63 3HG1 VAL 63 17.638 18.001 4.284 2804 HG21 VAL 63 3HG2 VAL 63 16.546 17.749 6.341 2805 HG22 VAL 63 1HG2 VAL 63 16.185 16.170 7.093 2806 HG23 VAL 63 2HG2 VAL 63 15.220 16.726 5.671 2807 H THR 64 H THR 64 19.321 14.311 5.012 2808 HA THR 64 HA THR 64 19.552 12.660 2.604 2809 HB THR 64 HB THR 64 21.083 15.307 2.896 2810 HG1 THR 64 1HG THR 64 18.790 15.320 2.401 2811 HG21 THR 64 3HG2 THR 64 21.800 14.846 0.535 2812 HG22 THR 64 1HG2 THR 64 20.911 13.285 0.542 2813 HG23 THR 64 2HG2 THR 64 22.340 13.517 1.614 2814 H GLU 65 H GLU 65 21.184 14.363 5.344 2815 HA GLU 65 HA GLU 65 23.545 12.756 4.931 2816 HB2 GLU 65 2HB GLU 65 23.468 15.351 5.482 2817 HB3 GLU 65 1HB GLU 65 23.210 14.809 7.175 2818 HG2 GLU 65 2HG GLU 65 25.321 13.387 6.933 2819 HG3 GLU 65 1HG GLU 65 25.541 14.040 5.272 2820 H GLU 66 H GLU 66 20.657 12.859 6.843 2821 HA GLU 66 HA GLU 66 21.532 11.147 8.906 2822 HB2 GLU 66 2HB GLU 66 18.948 10.745 9.058 2823 HB3 GLU 66 1HB GLU 66 19.623 12.350 9.452 2824 HG2 GLU 66 2HG GLU 66 18.530 11.832 6.637 2825 HG3 GLU 66 1HG GLU 66 17.543 12.238 8.093 2826 H GLY 67 H GLY 67 21.243 10.614 5.613 2827 HA2 GLY 67 2HA GLY 67 21.555 8.733 4.435 2828 HA3 GLY 67 1HA GLY 67 21.491 7.762 5.983 2829 H ARG 68 H ARG 68 19.507 9.401 3.444 2830 HA ARG 68 HA ARG 68 17.096 9.204 4.792 2831 HB2 ARG 68 2HB ARG 68 17.505 10.530 2.705 2832 HB3 ARG 68 1HB ARG 68 17.581 9.001 1.765 2833 HG2 ARG 68 2HG ARG 68 15.170 8.507 2.466 2834 HG3 ARG 68 1HG ARG 68 15.120 10.092 3.298 2835 HD2 ARG 68 2HD ARG 68 15.721 9.615 0.289 2836 HD3 ARG 68 1HD ARG 68 14.112 10.102 0.978 2837 HE ARG 68 HE ARG 68 16.151 11.918 1.956 2838 HH11 ARG 68 1HH2 ARG 68 14.484 11.097 -1.089 2839 HH12 ARG 68 2HH2 ARG 68 13.414 12.304 -0.894 2840 HH21 ARG 68 1HH1 ARG 68 15.552 14.115 1.461 2841 HH22 ARG 68 2HH1 ARG 68 14.660 14.475 0.026 2842 H LYS 69 H LYS 69 19.003 6.741 3.316 2843 HA LYS 69 HA LYS 69 17.156 4.700 2.937 2844 HB2 LYS 69 2HB LYS 69 20.072 4.561 3.905 2845 HB3 LYS 69 1HB LYS 69 19.073 3.128 3.504 2846 HG2 LYS 69 2HG LYS 69 18.788 3.900 1.174 2847 HG3 LYS 69 1HG LYS 69 19.886 5.301 1.469 2848 HD2 LYS 69 2HD LYS 69 21.799 3.794 1.868 2849 HD3 LYS 69 1HD LYS 69 20.700 2.405 2.096 2850 HE2 LYS 69 2HE LYS 69 21.769 2.001 0.017 2851 HE3 LYS 69 1HE LYS 69 20.067 2.460 -0.354 2852 HZ1 LYS 69 3HZ LYS 69 21.488 3.469 -1.882 2853 HZ2 LYS 69 1HZ LYS 69 22.550 4.089 -0.734 2854 HZ3 LYS 69 2HZ LYS 69 20.972 4.734 -0.864 2855 H VAL 70 H VAL 70 18.058 6.247 6.002 2856 HA VAL 70 HA VAL 70 17.487 4.047 7.651 2857 HB VAL 70 HB VAL 70 17.346 7.056 8.140 2858 HG11 VAL 70 1HG1 VAL 70 17.311 6.454 10.601 2859 HG12 VAL 70 2HG1 VAL 70 17.023 4.727 10.164 2860 HG13 VAL 70 3HG1 VAL 70 15.792 5.984 9.773 2861 HG21 VAL 70 3HG2 VAL 70 19.368 4.853 8.981 2862 HG22 VAL 70 1HG2 VAL 70 19.480 6.615 9.361 2863 HG23 VAL 70 2HG2 VAL 70 19.630 6.055 7.669 2864 H ALA 71 H ALA 71 15.383 6.450 5.995 2865 HA ALA 71 HA ALA 71 13.025 5.512 7.357 2866 HB1 ALA 71 1HB ALA 71 13.310 7.090 4.716 2867 HB2 ALA 71 2HB ALA 71 12.943 7.779 6.341 2868 HB3 ALA 71 3HB ALA 71 11.753 6.715 5.541 2869 H GLU 72 H GLU 72 14.751 4.805 4.274 2870 HA GLU 72 HA GLU 72 12.729 3.308 3.133 2871 HB2 GLU 72 2HB GLU 72 14.009 2.647 1.400 2872 HB3 GLU 72 1HB GLU 72 14.906 4.080 1.939 2873 HG2 GLU 72 2HG GLU 72 16.702 2.726 1.634 2874 HG3 GLU 72 1HG GLU 72 16.354 2.080 3.265 2875 H GLN 73 H GLN 73 15.267 2.371 5.400 2876 HA GLN 73 HA GLN 73 14.864 -0.375 5.131 2877 HB2 GLN 73 2HB GLN 73 16.892 0.812 6.099 2878 HB3 GLN 73 1HB GLN 73 15.958 1.110 7.591 2879 HG2 GLN 73 2HG GLN 73 15.852 -1.776 6.797 2880 HG3 GLN 73 1HG GLN 73 17.545 -1.205 6.810 2881 HE21 GLN 73 1HE2 GLN 73 14.556 -1.481 8.776 2882 HE22 GLN 73 2HE2 GLN 73 15.328 -1.400 10.333 2883 H VAL 74 H VAL 74 13.128 2.045 7.082 2884 HA VAL 74 HA VAL 74 12.014 0.092 8.869 2885 HB VAL 74 HB VAL 74 11.097 2.955 8.281 2886 HG11 VAL 74 1HG1 VAL 74 9.292 1.604 9.391 2887 HG12 VAL 74 2HG1 VAL 74 10.017 2.745 10.576 2888 HG13 VAL 74 3HG1 VAL 74 10.468 1.003 10.615 2889 HG21 VAL 74 3HG2 VAL 74 13.478 2.814 9.100 2890 HG22 VAL 74 1HG2 VAL 74 12.942 1.789 10.469 2891 HG23 VAL 74 2HG2 VAL 74 12.390 3.506 10.343 2892 H MET 75 H MET 75 10.919 1.885 5.938 2893 HA MET 75 HA MET 75 8.323 0.774 6.012 2894 HB2 MET 75 2HB MET 75 8.119 1.510 3.604 2895 HB3 MET 75 1HB MET 75 8.515 2.790 4.789 2896 HG2 MET 75 2HG MET 75 10.951 2.567 4.107 2897 HG3 MET 75 1HG MET 75 10.466 1.396 2.851 2898 HE1 MET 75 3HE MET 75 9.545 5.974 2.947 2899 HE2 MET 75 1HE MET 75 10.568 5.076 4.128 2900 HE3 MET 75 2HE MET 75 8.785 4.842 4.104 2901 H LYS 76 H LYS 76 11.350 -0.236 4.400 2902 HA LYS 76 HA LYS 76 10.272 -2.263 2.861 2903 HB2 LYS 76 2HB LYS 76 12.577 -1.312 2.703 2904 HB3 LYS 76 1HB LYS 76 13.031 -2.124 4.228 2905 HG2 LYS 76 2HG LYS 76 12.829 -4.339 3.224 2906 HG3 LYS 76 1HG LYS 76 12.007 -3.696 1.767 2907 HD2 LYS 76 2HD LYS 76 14.859 -2.877 2.570 2908 HD3 LYS 76 1HD LYS 76 14.512 -4.300 1.521 2909 HE2 LYS 76 2HE LYS 76 13.578 -2.901 -0.248 2910 HE3 LYS 76 1HE LYS 76 13.514 -1.443 0.822 2911 HZ1 LYS 76 3HZ LYS 76 15.358 -1.296 -0.601 2912 HZ2 LYS 76 1HZ LYS 76 15.984 -2.825 -0.081 2913 HZ3 LYS 76 2HZ LYS 76 15.845 -1.414 0.966 2914 H ALA 77 H ALA 77 11.558 -2.373 6.220 2915 HA ALA 77 HA ALA 77 11.203 -5.134 6.547 2916 HB1 ALA 77 1HB ALA 77 11.196 -2.893 8.671 2917 HB2 ALA 77 2HB ALA 77 12.656 -3.771 8.070 2918 HB3 ALA 77 3HB ALA 77 11.398 -4.659 9.006 2919 H GLY 78 H GLY 78 8.982 -2.384 6.883 2920 HA2 GLY 78 2HA GLY 78 6.955 -3.751 8.315 2921 HA3 GLY 78 1HA GLY 78 6.813 -2.258 7.308 2922 H ILE 79 H ILE 79 7.538 -3.192 4.822 2923 HA ILE 79 HA ILE 79 5.189 -4.364 3.909 2924 HB ILE 79 HB ILE 79 7.942 -4.158 2.591 2925 HG12 ILE 79 2HG1 ILE 79 5.374 -2.497 2.160 2926 HG13 ILE 79 1HG1 ILE 79 6.686 -1.995 3.250 2927 HG21 ILE 79 1HG2 ILE 79 6.633 -5.976 1.454 2928 HG22 ILE 79 2HG2 ILE 79 6.714 -4.530 0.404 2929 HG23 ILE 79 3HG2 ILE 79 5.205 -4.879 1.330 2930 HD11 ILE 79 3HD ILE 79 6.943 -2.391 0.195 2931 HD12 ILE 79 1HD ILE 79 6.932 -0.840 1.097 2932 HD13 ILE 79 2HD ILE 79 8.310 -1.987 1.305 2933 H GLU 80 H GLU 80 8.432 -5.780 4.539 2934 HA GLU 80 HA GLU 80 7.997 -8.361 3.695 2935 HB2 GLU 80 2HB GLU 80 9.616 -7.374 6.133 2936 HB3 GLU 80 1HB GLU 80 9.722 -9.038 5.474 2937 HG2 GLU 80 2HG GLU 80 10.690 -8.244 3.370 2938 HG3 GLU 80 1HG GLU 80 10.462 -6.527 3.837 2939 H VAL 81 H VAL 81 7.255 -6.905 6.884 2940 HA VAL 81 HA VAL 81 6.454 -9.286 8.120 2941 HB VAL 81 HB VAL 81 6.038 -6.330 8.703 2942 HG11 VAL 81 1HG1 VAL 81 5.186 -7.044 11.004 2943 HG12 VAL 81 2HG1 VAL 81 4.939 -8.702 10.357 2944 HG13 VAL 81 3HG1 VAL 81 4.016 -7.315 9.676 2945 HG21 VAL 81 3HG2 VAL 81 7.670 -6.844 10.520 2946 HG22 VAL 81 1HG2 VAL 81 8.330 -7.404 8.950 2947 HG23 VAL 81 2HG2 VAL 81 7.631 -8.594 10.105 2948 H PHE 82 H PHE 82 4.410 -6.614 6.725 2949 HA PHE 82 HA PHE 82 2.048 -8.019 7.371 2950 HB2 PHE 82 2HB PHE 82 2.478 -5.784 5.279 2951 HB3 PHE 82 1HB PHE 82 0.864 -6.379 5.834 2952 HD1 PHE 82 1HD PHE 82 0.812 -6.581 8.621 2953 HD2 PHE 82 2HD PHE 82 3.077 -3.763 6.280 2954 HE1 PHE 82 1HE PHE 82 0.889 -5.039 10.545 2955 HE2 PHE 82 2HE PHE 82 3.139 -2.226 8.199 2956 HZ PHE 82 HZ PHE 82 2.047 -2.848 10.341 2957 H ALA 83 H ALA 83 4.081 -7.948 4.462 2958 HA ALA 83 HA ALA 83 2.358 -9.396 2.799 2959 HB1 ALA 83 1HB ALA 83 5.444 -9.291 2.850 2960 HB2 ALA 83 2HB ALA 83 4.370 -8.160 1.954 2961 HB3 ALA 83 3HB ALA 83 4.450 -9.886 1.473 2962 H LEU 84 H LEU 84 4.899 -10.449 5.151 2963 HA LEU 84 HA LEU 84 4.867 -13.154 4.465 2964 HB2 LEU 84 2HB LEU 84 6.621 -12.023 5.818 2965 HB3 LEU 84 1HB LEU 84 5.500 -11.879 7.201 2966 HG LEU 84 HG LEU 84 6.139 -14.624 5.991 2967 HD11 LEU 84 1HD1 LEU 84 8.347 -13.524 6.226 2968 HD12 LEU 84 2HD1 LEU 84 8.154 -14.824 7.459 2969 HD13 LEU 84 3HD1 LEU 84 7.979 -13.091 7.938 2970 HD21 LEU 84 3HD2 LEU 84 5.578 -13.721 8.902 2971 HD22 LEU 84 1HD2 LEU 84 5.956 -15.405 8.387 2972 HD23 LEU 84 2HD2 LEU 84 4.447 -14.624 7.829 2973 H VAL 85 H VAL 85 2.907 -11.274 6.745 2974 HA VAL 85 HA VAL 85 1.621 -13.392 8.006 2975 HB VAL 85 HB VAL 85 0.890 -10.469 7.557 2976 HG11 VAL 85 1HG1 VAL 85 -0.698 -10.718 9.521 2977 HG12 VAL 85 2HG1 VAL 85 -0.542 -12.514 9.388 2978 HG13 VAL 85 3HG1 VAL 85 -1.261 -11.556 8.040 2979 HG21 VAL 85 3HG2 VAL 85 2.988 -11.082 8.938 2980 HG22 VAL 85 1HG2 VAL 85 1.925 -11.980 10.058 2981 HG23 VAL 85 2HG2 VAL 85 1.733 -10.203 9.869 2982 H THR 86 H THR 86 1.233 -12.274 4.730 2983 HA THR 86 HA THR 86 -1.399 -12.945 4.289 2984 HB THR 86 HB THR 86 0.782 -13.331 2.205 2985 HG1 THR 86 1HG THR 86 1.165 -11.383 2.901 2986 HG21 THR 86 3HG2 THR 86 -1.066 -12.476 0.689 2987 HG22 THR 86 1HG2 THR 86 -2.194 -12.422 2.088 2988 HG23 THR 86 2HG2 THR 86 -1.558 -14.001 1.495 2989 H ALA 87 H ALA 87 1.200 -15.069 5.136 2990 HA ALA 87 HA ALA 87 0.326 -17.475 4.056 2991 HB1 ALA 87 1HB ALA 87 1.435 -18.535 6.025 2992 HB2 ALA 87 2HB ALA 87 1.431 -16.959 6.903 2993 HB3 ALA 87 3HB ALA 87 2.435 -17.161 5.443 2994 H ALA 88 H ALA 88 -0.748 -15.743 7.014 2995 HA ALA 88 HA ALA 88 -2.479 -17.851 7.859 2996 HB1 ALA 88 1HB ALA 88 -1.548 -16.124 9.506 2997 HB2 ALA 88 2HB ALA 88 -3.355 -16.125 9.510 2998 HB3 ALA 88 3HB ALA 88 -2.451 -14.844 8.626 2999 H LEU 89 H LEU 89 -2.768 -14.911 5.943 3000 HA LEU 89 HA LEU 89 -5.608 -14.986 5.798 3001 HB2 LEU 89 2HB LEU 89 -3.499 -13.517 4.099 3002 HB3 LEU 89 1HB LEU 89 -5.244 -13.422 3.773 3003 HG LEU 89 HG LEU 89 -4.614 -11.449 4.889 3004 HD11 LEU 89 1HD1 LEU 89 -6.212 -13.153 6.907 3005 HD12 LEU 89 2HD1 LEU 89 -6.868 -12.446 5.390 3006 HD13 LEU 89 3HD1 LEU 89 -6.258 -11.366 6.697 3007 HD21 LEU 89 3HD2 LEU 89 -3.596 -13.063 7.312 3008 HD22 LEU 89 1HD2 LEU 89 -3.736 -11.276 7.181 3009 HD23 LEU 89 2HD2 LEU 89 -2.585 -12.159 6.121 3010 H ALA 90 H ALA 90 -2.954 -16.355 3.822 3011 HA ALA 90 HA ALA 90 -4.550 -17.029 1.637 3012 HB1 ALA 90 1HB ALA 90 -2.750 -18.679 1.065 3013 HB2 ALA 90 2HB ALA 90 -2.042 -18.441 2.714 3014 HB3 ALA 90 3HB ALA 90 -2.057 -17.082 1.533 3015 H THR 91 H THR 91 -3.971 -18.721 4.765 3016 HA THR 91 HA THR 91 -5.454 -20.996 4.008 3017 HB THR 91 HB THR 91 -5.807 -20.957 6.746 3018 HG1 THR 91 1HG THR 91 -4.612 -18.918 6.812 3019 HG21 THR 91 3HG2 THR 91 -3.252 -21.724 5.207 3020 HG22 THR 91 1HG2 THR 91 -4.747 -22.734 5.309 3021 HG23 THR 91 2HG2 THR 91 -3.790 -22.388 6.798 3022 H ASP 92 H ASP 92 -6.645 -17.739 4.563 3023 HA ASP 92 HA ASP 92 -8.911 -18.480 6.056 3024 HB2 ASP 92 2HB ASP 92 -8.215 -15.951 4.495 3025 HB3 ASP 92 1HB ASP 92 -9.946 -16.252 4.831 3026 H PHE 93 H PHE 93 -8.278 -18.558 2.594 3027 HA PHE 93 HA PHE 93 -11.077 -18.886 2.037 3028 HB2 PHE 93 2HB PHE 93 -10.586 -19.158 -0.220 3029 HB3 PHE 93 1HB PHE 93 -9.462 -17.893 0.346 3030 HD1 PHE 93 2HD PHE 93 -9.721 -21.455 -0.813 3031 HD2 PHE 93 1HD PHE 93 -7.076 -18.233 0.232 3032 HE1 PHE 93 2HE PHE 93 -7.858 -22.626 -1.925 3033 HE2 PHE 93 1HE PHE 93 -5.215 -19.401 -0.889 3034 HZ PHE 93 HZ PHE 93 -5.597 -21.598 -1.983 3035 H VAL 94 H VAL 94 -8.419 -20.969 2.896 3036 HA VAL 94 HA VAL 94 -9.326 -23.316 1.642 3037 HB VAL 94 HB VAL 94 -7.423 -23.006 4.028 3038 HG11 VAL 94 1HG1 VAL 94 -6.432 -25.160 3.128 3039 HG12 VAL 94 2HG1 VAL 94 -7.769 -25.256 1.920 3040 HG13 VAL 94 3HG1 VAL 94 -8.127 -25.378 3.681 3041 HG21 VAL 94 3HG2 VAL 94 -5.618 -22.972 2.253 3042 HG22 VAL 94 1HG2 VAL 94 -6.692 -21.549 2.101 3043 HG23 VAL 94 2HG2 VAL 94 -6.882 -22.933 0.974 3044 H ARG 95 H ARG 95 -10.093 -21.645 4.586 3045 HA ARG 95 HA ARG 95 -11.126 -23.679 6.142 3046 HB2 ARG 95 2HB ARG 95 -11.939 -20.724 5.945 3047 HB3 ARG 95 1HB ARG 95 -12.523 -21.842 7.224 3048 HG2 ARG 95 2HG ARG 95 -10.227 -22.261 7.992 3049 HG3 ARG 95 1HG ARG 95 -9.553 -21.152 6.751 3050 HD2 ARG 95 2HD ARG 95 -10.551 -19.175 7.806 3051 HD3 ARG 95 1HD ARG 95 -11.583 -20.202 8.879 3052 HE ARG 95 HE ARG 95 -9.681 -20.919 10.145 3053 HH11 ARG 95 1HH2 ARG 95 -9.081 -17.815 8.238 3054 HH12 ARG 95 2HH2 ARG 95 -7.611 -17.568 8.938 3055 HH21 ARG 95 1HH1 ARG 95 -7.490 -20.526 10.971 3056 HH22 ARG 95 2HH1 ARG 95 -6.729 -19.020 10.604 3057 H ARG 96 H ARG 96 -12.412 -22.624 3.100 3058 HA ARG 96 HA ARG 96 -15.131 -23.217 3.762 3059 HB2 ARG 96 2HB ARG 96 -15.665 -23.098 1.451 3060 HB3 ARG 96 1HB ARG 96 -14.503 -21.802 1.904 3061 HG2 ARG 96 2HG ARG 96 -12.642 -23.189 0.791 3062 HG3 ARG 96 1HG ARG 96 -13.888 -24.379 0.311 3063 HD2 ARG 96 2HD ARG 96 -13.372 -23.003 -1.620 3064 HD3 ARG 96 1HD ARG 96 -15.056 -22.634 -1.110 3065 HE ARG 96 HE ARG 96 -12.627 -20.901 -0.925 3066 HH11 ARG 96 1HH2 ARG 96 -16.103 -21.226 -0.148 3067 HH12 ARG 96 2HH2 ARG 96 -16.093 -20.114 1.097 3068 HH21 ARG 96 1HH1 ARG 96 -12.777 -18.805 0.346 3069 HH22 ARG 96 2HH1 ARG 96 -14.074 -18.626 1.380 3070 H GLU 97 H GLU 97 -12.300 -25.099 2.820 3071 HA GLU 97 HA GLU 97 -13.921 -27.388 2.036 3072 HB2 GLU 97 2HB GLU 97 -10.927 -26.821 2.180 3073 HB3 GLU 97 1HB GLU 97 -11.507 -28.492 1.962 3074 HG2 GLU 97 2HG GLU 97 -12.556 -26.332 0.042 3075 HG3 GLU 97 1HG GLU 97 -10.885 -26.974 -0.142 3076 H GLU 98 H GLU 98 -12.965 -29.481 3.167 3077 HA GLU 98 HA GLU 98 -13.113 -30.773 4.871 3078 HB2 GLU 98 2HB GLU 98 -12.032 -28.505 6.588 3079 HB3 GLU 98 1HB GLU 98 -12.540 -30.085 7.244 3080 HG2 GLU 98 2HG GLU 98 -10.261 -30.361 7.009 3081 HG3 GLU 98 1HG GLU 98 -10.928 -31.230 5.590 3082 H GLU 99 H GLU 99 -14.494 -27.655 5.981 3083 HA GLU 99 HA GLU 99 -16.678 -28.696 7.404 3084 HB2 GLU 99 2HB GLU 99 -16.196 -26.060 5.889 3085 HB3 GLU 99 1HB GLU 99 -17.695 -26.343 6.833 3086 HG2 GLU 99 2HG GLU 99 -14.941 -26.655 8.197 3087 HG3 GLU 99 1HG GLU 99 -15.655 -25.033 7.896 3088 H ARG 100 H ARG 100 -16.442 -27.423 4.031 3089 HA ARG 100 HA ARG 100 -19.085 -28.019 3.386 3090 HB2 ARG 100 2HB ARG 100 -17.487 -26.380 2.235 3091 HB3 ARG 100 1HB ARG 100 -16.676 -27.798 1.501 3092 HG2 ARG 100 2HG ARG 100 -19.071 -28.340 0.527 3093 HG3 ARG 100 1HG ARG 100 -19.537 -26.704 1.078 3094 HD2 ARG 100 2HD ARG 100 -18.864 -26.750 -1.385 3095 HD3 ARG 100 1HD ARG 100 -17.782 -25.684 -0.404 3096 HE ARG 100 HE ARG 100 -16.029 -27.027 -0.975 3097 HH11 ARG 100 1HH2 ARG 100 -19.038 -28.960 -1.600 3098 HH12 ARG 100 2HH2 ARG 100 -18.207 -30.288 -2.255 3099 HH21 ARG 100 1HH1 ARG 100 -14.910 -29.141 -1.279 3100 HH22 ARG 100 2HH1 ARG 100 -15.786 -30.400 -2.102 3101 H ARG 101 H ARG 101 -16.240 -30.052 3.461 3102 HA ARG 101 HA ARG 101 -17.273 -32.067 1.668 3103 HB2 ARG 101 2HB ARG 101 -15.090 -32.269 3.833 3104 HB3 ARG 101 1HB ARG 101 -15.399 -33.487 2.547 3105 HG2 ARG 101 2HG ARG 101 -14.499 -30.590 1.948 3106 HG3 ARG 101 1HG ARG 101 -13.383 -31.947 2.321 3107 HD2 ARG 101 2HD ARG 101 -14.423 -33.236 0.314 3108 HD3 ARG 101 1HD ARG 101 -15.259 -31.696 -0.116 3109 HE ARG 101 HE ARG 101 -13.127 -30.580 -0.397 3110 HH11 ARG 101 1HH2 ARG 101 -12.662 -34.140 0.265 3111 HH12 ARG 101 2HH2 ARG 101 -11.047 -34.134 -0.295 3112 HH21 ARG 101 1HH1 ARG 101 -10.991 -30.627 -1.089 3113 HH22 ARG 101 2HH1 ARG 101 -9.989 -32.072 -1.071 3114 H GLY 102 H GLY 102 -17.594 -31.190 5.069 3115 HA2 GLY 102 2HA GLY 102 -18.828 -32.032 6.681 3116 HA3 GLY 102 1HA GLY 102 -19.514 -33.214 5.501 3117 H HIS 103 H HIS 103 -16.102 -32.717 6.470 3118 HA HIS 103 HA HIS 103 -15.739 -35.546 6.850 3119 HB2 HIS 103 2HB HIS 103 -13.951 -33.199 7.773 3120 HB3 HIS 103 1HB HIS 103 -13.500 -34.935 7.888 3121 HD1 HIS 103 1HD HIS 103 -11.557 -33.334 6.426 3122 HD2 HIS 103 2HD HIS 103 -14.829 -35.175 4.518 3123 HE1 HIS 103 1HE HIS 103 -11.012 -33.463 3.936 3124 HE2 HIS 103 2HE HIS 103 -12.961 -34.724 2.858 Start of MODEL 9 1 H1 SER 1 H SER 1 -22.262 -12.835 -2.665 2 HA SER 1 HA SER 1 -24.125 -14.401 -2.760 3 HB2 SER 1 2HB SER 1 -23.344 -13.505 -4.928 4 HB3 SER 1 1HB SER 1 -21.957 -14.645 -4.952 5 HG SER 1 1HG SER 1 -24.737 -15.359 -5.124 6 H ALA 2 H ALA 2 -20.926 -15.973 -3.408 7 HA ALA 2 HA ALA 2 -22.090 -18.522 -3.030 8 HB1 ALA 2 1HB ALA 2 -19.107 -17.882 -3.333 9 HB2 ALA 2 2HB ALA 2 -20.253 -18.241 -4.667 10 HB3 ALA 2 3HB ALA 2 -19.883 -19.498 -3.438 11 H ASP 3 H ASP 3 -19.397 -16.896 -1.165 12 HA ASP 3 HA ASP 3 -20.614 -17.623 1.308 13 HB2 ASP 3 2HB ASP 3 -19.875 -19.948 0.718 14 HB3 ASP 3 1HB ASP 3 -18.210 -19.382 0.416 15 H HIS 4 H HIS 4 -17.383 -17.635 -0.032 16 HA HIS 4 HA HIS 4 -16.077 -16.243 1.923 17 HB2 HIS 4 2HB HIS 4 -14.774 -15.824 -0.726 18 HB3 HIS 4 1HB HIS 4 -14.221 -16.755 0.687 19 HD1 HIS 4 1HD HIS 4 -16.829 -17.174 -2.196 20 HD2 HIS 4 2HD HIS 4 -13.878 -19.386 -0.112 21 HE1 HIS 4 1HE HIS 4 -16.675 -19.435 -3.278 22 HE2 HIS 4 2HE HIS 4 -14.877 -20.708 -2.115 23 H GLU 5 H GLU 5 -17.525 -14.999 -1.132 24 HA GLU 5 HA GLU 5 -16.399 -12.421 -0.845 25 HB2 GLU 5 2HB GLU 5 -18.303 -11.789 -2.537 26 HB3 GLU 5 1HB GLU 5 -16.941 -12.796 -3.062 27 HG2 GLU 5 2HG GLU 5 -19.557 -14.089 -2.056 28 HG3 GLU 5 1HG GLU 5 -19.380 -13.511 -3.751 29 H ARG 6 H ARG 6 -19.228 -13.962 0.558 30 HA ARG 6 HA ARG 6 -20.617 -11.520 1.007 31 HB2 ARG 6 2HB ARG 6 -21.527 -13.966 1.014 32 HB3 ARG 6 1HB ARG 6 -20.908 -14.069 2.691 33 HG2 ARG 6 2HG ARG 6 -22.335 -12.008 3.252 34 HG3 ARG 6 1HG ARG 6 -22.974 -12.045 1.578 35 HD2 ARG 6 2HD ARG 6 -23.306 -14.187 3.779 36 HD3 ARG 6 1HD ARG 6 -24.610 -13.157 3.059 37 HE ARG 6 HE ARG 6 -24.096 -14.309 0.834 38 HH11 ARG 6 1HH2 ARG 6 -23.478 -16.060 3.955 39 HH12 ARG 6 2HH2 ARG 6 -23.911 -17.569 3.355 40 HH21 ARG 6 1HH1 ARG 6 -24.008 -16.557 -0.110 41 HH22 ARG 6 2HH1 ARG 6 -24.159 -17.869 0.959 42 H GLU 7 H GLU 7 -18.184 -13.480 2.748 43 HA GLU 7 HA GLU 7 -18.321 -11.931 5.108 44 HB2 GLU 7 2HB GLU 7 -17.390 -14.376 4.764 45 HB3 GLU 7 1HB GLU 7 -15.859 -13.547 4.329 46 HG2 GLU 7 2HG GLU 7 -15.763 -14.143 6.691 47 HG3 GLU 7 1HG GLU 7 -15.996 -12.359 6.630 48 H ALA 8 H ALA 8 -16.428 -11.761 2.116 49 HA ALA 8 HA ALA 8 -14.633 -9.769 2.934 50 HB1 ALA 8 1HB ALA 8 -15.781 -10.239 0.109 51 HB2 ALA 8 2HB ALA 8 -14.322 -11.050 0.795 52 HB3 ALA 8 3HB ALA 8 -14.318 -9.272 0.505 53 H GLN 9 H GLN 9 -17.943 -9.546 1.530 54 HA GLN 9 HA GLN 9 -17.866 -6.714 1.365 55 HB2 GLN 9 2HB GLN 9 -20.252 -8.639 1.443 56 HB3 GLN 9 1HB GLN 9 -20.380 -6.868 1.166 57 HG2 GLN 9 2HG GLN 9 -18.939 -7.074 -0.902 58 HG3 GLN 9 1HG GLN 9 -18.846 -8.847 -0.660 59 HE21 GLN 9 1HE2 GLN 9 -21.311 -6.177 -0.839 60 HE22 GLN 9 2HE2 GLN 9 -22.541 -7.106 -1.617 61 H LYS 10 H LYS 10 -18.682 -8.955 4.005 62 HA LYS 10 HA LYS 10 -19.943 -6.980 5.630 63 HB2 LYS 10 2HB LYS 10 -18.580 -9.645 6.291 64 HB3 LYS 10 1HB LYS 10 -19.343 -8.607 7.544 65 HG2 LYS 10 2HG LYS 10 -21.551 -8.907 6.652 66 HG3 LYS 10 1HG LYS 10 -20.934 -9.515 5.086 67 HD2 LYS 10 2HD LYS 10 -21.909 -11.367 6.350 68 HD3 LYS 10 1HD LYS 10 -20.152 -11.592 6.079 69 HE2 LYS 10 2HE LYS 10 -19.773 -10.729 8.496 70 HE3 LYS 10 1HE LYS 10 -21.559 -10.850 8.742 71 HZ1 LYS 10 3HZ LYS 10 -19.813 -13.091 7.804 72 HZ2 LYS 10 1HZ LYS 10 -21.393 -13.243 8.412 73 HZ3 LYS 10 2HZ LYS 10 -20.097 -12.742 9.423 74 H ALA 11 H ALA 11 -16.587 -8.106 5.161 75 HA ALA 11 HA ALA 11 -15.431 -6.759 7.285 76 HB1 ALA 11 1HB ALA 11 -14.257 -8.505 5.892 77 HB2 ALA 11 2HB ALA 11 -13.277 -7.015 6.099 78 HB3 ALA 11 3HB ALA 11 -14.135 -7.317 4.544 79 H GLU 12 H GLU 12 -16.036 -5.599 3.906 80 HA GLU 12 HA GLU 12 -14.779 -3.126 4.268 81 HB2 GLU 12 2HB GLU 12 -17.132 -3.757 2.379 82 HB3 GLU 12 1HB GLU 12 -16.201 -2.226 2.404 83 HG2 GLU 12 2HG GLU 12 -14.077 -3.583 1.938 84 HG3 GLU 12 1HG GLU 12 -15.141 -5.000 1.600 85 H GLU 13 H GLU 13 -18.123 -4.151 5.085 86 HA GLU 13 HA GLU 13 -18.947 -1.469 5.668 87 HB2 GLU 13 2HB GLU 13 -20.226 -4.148 6.392 88 HB3 GLU 13 1HB GLU 13 -20.878 -2.549 6.889 89 HG2 GLU 13 2HG GLU 13 -20.970 -1.816 4.485 90 HG3 GLU 13 1HG GLU 13 -20.459 -3.465 3.967 91 H GLU 14 H GLU 14 -17.493 -4.139 7.579 92 HA GLU 14 HA GLU 14 -17.915 -2.856 10.037 93 HB2 GLU 14 2HB GLU 14 -17.414 -5.185 10.125 94 HB3 GLU 14 1HB GLU 14 -15.836 -4.969 9.298 95 HG2 GLU 14 2HG GLU 14 -14.746 -4.205 11.206 96 HG3 GLU 14 1HG GLU 14 -16.207 -3.438 11.898 97 H LEU 15 H LEU 15 -15.377 -2.390 7.573 98 HA LEU 15 HA LEU 15 -13.670 -0.925 9.197 99 HB2 LEU 15 2HB LEU 15 -13.107 -1.723 6.884 100 HB3 LEU 15 1HB LEU 15 -14.177 -0.468 6.194 101 HG LEU 15 HG LEU 15 -12.714 1.322 7.029 102 HD11 LEU 15 1HD1 LEU 15 -10.520 0.788 8.208 103 HD12 LEU 15 2HD1 LEU 15 -11.107 -0.897 8.452 104 HD13 LEU 15 3HD1 LEU 15 -11.972 0.494 9.211 105 HD21 LEU 15 3HD2 LEU 15 -12.111 0.252 4.860 106 HD22 LEU 15 1HD2 LEU 15 -11.048 -0.926 5.713 107 HD23 LEU 15 2HD2 LEU 15 -10.642 0.827 5.723 108 H GLN 16 H GLN 16 -16.531 0.122 7.370 109 HA GLN 16 HA GLN 16 -16.169 2.886 7.700 110 HB2 GLN 16 2HB GLN 16 -18.661 1.203 7.135 111 HB3 GLN 16 1HB GLN 16 -18.624 2.997 7.026 112 HG2 GLN 16 2HG GLN 16 -17.049 2.993 5.198 113 HG3 GLN 16 1HG GLN 16 -16.620 1.270 5.431 114 HE21 GLN 16 1HE2 GLN 16 -17.647 -0.207 4.167 115 HE22 GLN 16 2HE2 GLN 16 -19.077 0.093 3.224 116 H LYS 17 H LYS 17 -17.478 0.411 9.796 117 HA LYS 17 HA LYS 17 -18.903 2.100 11.562 118 HB2 LYS 17 2HB LYS 17 -19.170 -0.414 11.210 119 HB3 LYS 17 1HB LYS 17 -17.593 -0.635 12.038 120 HG2 LYS 17 2HG LYS 17 -18.590 0.239 14.166 121 HG3 LYS 17 1HG LYS 17 -20.136 0.564 13.307 122 HD2 LYS 17 2HD LYS 17 -20.350 -1.538 14.553 123 HD3 LYS 17 1HD LYS 17 -20.400 -1.851 12.785 124 HE2 LYS 17 2HE LYS 17 -17.918 -2.528 12.893 125 HE3 LYS 17 1HE LYS 17 -18.001 -2.367 14.693 126 HZ1 LYS 17 3HZ LYS 17 -19.691 -4.192 13.027 127 HZ2 LYS 17 1HZ LYS 17 -19.585 -4.184 14.738 128 HZ3 LYS 17 2HZ LYS 17 -18.249 -4.616 13.731 129 H VAL 18 H VAL 18 -15.483 1.070 11.304 130 HA VAL 18 HA VAL 18 -14.764 1.930 13.919 131 HB VAL 18 HB VAL 18 -12.955 1.521 11.477 132 HG11 VAL 18 1HG1 VAL 18 -11.814 2.751 13.345 133 HG12 VAL 18 2HG1 VAL 18 -11.202 1.066 13.243 134 HG13 VAL 18 3HG1 VAL 18 -12.383 1.505 14.528 135 HG21 VAL 18 3HG2 VAL 18 -14.275 -0.546 11.879 136 HG22 VAL 18 1HG2 VAL 18 -13.922 -0.470 13.646 137 HG23 VAL 18 2HG2 VAL 18 -12.602 -0.789 12.465 138 H LEU 19 H LEU 19 -15.120 3.453 10.739 139 HA LEU 19 HA LEU 19 -13.466 5.659 11.283 140 HB2 LEU 19 2HB LEU 19 -15.812 5.639 9.318 141 HB3 LEU 19 1HB LEU 19 -14.375 6.714 9.300 142 HG LEU 19 HG LEU 19 -14.495 3.698 8.752 143 HD11 LEU 19 1HD1 LEU 19 -13.652 6.035 6.948 144 HD12 LEU 19 2HD1 LEU 19 -15.235 5.171 6.879 145 HD13 LEU 19 3HD1 LEU 19 -13.706 4.296 6.484 146 HD21 LEU 19 3HD2 LEU 19 -12.371 4.048 9.976 147 HD22 LEU 19 1HD2 LEU 19 -11.941 5.416 8.880 148 HD23 LEU 19 2HD2 LEU 19 -12.069 3.739 8.241 149 H GLU 20 H GLU 20 -16.840 4.965 11.960 150 HA GLU 20 HA GLU 20 -17.626 7.574 12.764 151 HB2 GLU 20 2HB GLU 20 -18.649 4.737 13.324 152 HB3 GLU 20 1HB GLU 20 -19.448 6.160 14.037 153 HG2 GLU 20 2HG GLU 20 -19.057 5.996 10.978 154 HG3 GLU 20 1HG GLU 20 -20.365 5.074 11.796 155 H GLU 21 H GLU 21 -16.032 4.790 14.414 156 HA GLU 21 HA GLU 21 -16.273 5.967 17.028 157 HB2 GLU 21 2HB GLU 21 -14.053 4.025 16.059 158 HB3 GLU 21 1HB GLU 21 -14.409 4.548 17.746 159 HG2 GLU 21 2HG GLU 21 -16.633 3.325 17.579 160 HG3 GLU 21 1HG GLU 21 -16.079 2.653 15.995 161 H ALA 22 H ALA 22 -13.850 5.784 14.452 162 HA ALA 22 HA ALA 22 -11.699 6.941 15.718 163 HB1 ALA 22 1HB ALA 22 -11.559 5.716 13.510 164 HB2 ALA 22 2HB ALA 22 -10.790 7.346 13.424 165 HB3 ALA 22 3HB ALA 22 -12.426 7.081 12.723 166 H SER 23 H SER 23 -14.389 8.512 13.874 167 HA SER 23 HA SER 23 -13.138 11.024 13.817 168 HB2 SER 23 2HB SER 23 -15.563 11.816 13.339 169 HB3 SER 23 1HB SER 23 -14.838 10.619 12.205 170 HG SER 23 1HG SER 23 -16.891 9.945 12.761 171 H LYS 24 H LYS 24 -15.317 9.416 16.134 172 HA LYS 24 HA LYS 24 -15.743 11.684 17.750 173 HB2 LYS 24 2HB LYS 24 -17.114 9.541 17.733 174 HB3 LYS 24 1HB LYS 24 -15.819 8.734 18.662 175 HG2 LYS 24 2HG LYS 24 -17.094 11.336 19.682 176 HG3 LYS 24 1HG LYS 24 -18.004 9.790 19.792 177 HD2 LYS 24 2HD LYS 24 -16.339 8.785 21.272 178 HD3 LYS 24 1HD LYS 24 -15.193 10.133 20.997 179 HE2 LYS 24 2HE LYS 24 -16.184 10.426 23.204 180 HE3 LYS 24 1HE LYS 24 -16.711 11.754 22.106 181 HZ1 LYS 24 3HZ LYS 24 -18.661 11.246 23.011 182 HZ2 LYS 24 1HZ LYS 24 -18.265 9.630 23.382 183 HZ3 LYS 24 2HZ LYS 24 -18.758 10.041 21.816 184 H LYS 25 H LYS 25 -13.248 9.154 17.668 185 HA LYS 25 HA LYS 25 -11.963 9.937 20.072 186 HB2 LYS 25 2HB LYS 25 -10.828 8.506 17.598 187 HB3 LYS 25 1HB LYS 25 -9.930 8.718 19.135 188 HG2 LYS 25 2HG LYS 25 -11.438 7.263 20.353 189 HG3 LYS 25 1HG LYS 25 -12.635 7.268 19.019 190 HD2 LYS 25 2HD LYS 25 -10.962 6.117 17.533 191 HD3 LYS 25 1HD LYS 25 -9.841 5.950 18.928 192 HE2 LYS 25 2HE LYS 25 -11.357 4.412 20.086 193 HE3 LYS 25 1HE LYS 25 -12.734 4.880 19.022 194 HZ1 LYS 25 3HZ LYS 25 -10.448 3.099 18.376 195 HZ2 LYS 25 1HZ LYS 25 -11.333 3.873 17.163 196 HZ3 LYS 25 2HZ LYS 25 -12.163 2.875 18.223 197 H ALA 26 H ALA 26 -11.225 10.637 16.602 198 HA ALA 26 HA ALA 26 -8.995 12.149 16.971 199 HB1 ALA 26 1HB ALA 26 -9.416 13.089 14.709 200 HB2 ALA 26 2HB ALA 26 -11.129 12.515 14.777 201 HB3 ALA 26 3HB ALA 26 -9.771 11.327 14.741 202 H VAL 27 H VAL 27 -12.433 13.345 16.987 203 HA VAL 27 HA VAL 27 -11.646 16.044 17.017 204 HB VAL 27 HB VAL 27 -13.920 16.591 17.889 205 HG11 VAL 27 1HG1 VAL 27 -13.700 14.612 15.537 206 HG12 VAL 27 2HG1 VAL 27 -13.395 16.384 15.489 207 HG13 VAL 27 3HG1 VAL 27 -15.052 15.763 15.816 208 HG21 VAL 27 3HG2 VAL 27 -14.401 14.586 19.317 209 HG22 VAL 27 1HG2 VAL 27 -14.279 13.515 17.878 210 HG23 VAL 27 2HG2 VAL 27 -15.610 14.702 17.997 211 H GLU 28 H GLU 28 -12.085 13.714 19.675 212 HA GLU 28 HA GLU 28 -11.932 15.803 21.669 213 HB2 GLU 28 2HB GLU 28 -11.780 12.738 21.947 214 HB3 GLU 28 1HB GLU 28 -11.818 13.914 23.309 215 HG2 GLU 28 2HG GLU 28 -14.101 14.709 22.494 216 HG3 GLU 28 1HG GLU 28 -14.082 13.380 21.272 217 H ALA 29 H ALA 29 -9.906 13.400 20.065 218 HA ALA 29 HA ALA 29 -7.688 13.528 21.731 219 HB1 ALA 29 1HB ALA 29 -8.177 11.702 20.067 220 HB2 ALA 29 2HB ALA 29 -6.554 12.385 19.838 221 HB3 ALA 29 3HB ALA 29 -7.863 12.862 18.727 222 H GLU 30 H GLU 30 -8.363 15.151 18.540 223 HA GLU 30 HA GLU 30 -6.135 16.928 18.908 224 HB2 GLU 30 2HB GLU 30 -8.220 16.639 16.691 225 HB3 GLU 30 1HB GLU 30 -7.117 18.042 16.771 226 HG2 GLU 30 2HG GLU 30 -5.131 16.434 16.796 227 HG3 GLU 30 1HG GLU 30 -6.286 15.109 16.392 228 H ARG 31 H ARG 31 -8.821 16.991 20.681 229 HA ARG 31 HA ARG 31 -9.851 19.589 20.155 230 HB2 ARG 31 2HB ARG 31 -11.179 17.877 21.468 231 HB3 ARG 31 1HB ARG 31 -9.935 17.933 22.746 232 HG2 ARG 31 2HG ARG 31 -11.710 19.191 23.577 233 HG3 ARG 31 1HG ARG 31 -10.518 20.419 23.077 234 HD2 ARG 31 2HD ARG 31 -11.944 20.648 20.859 235 HD3 ARG 31 1HD ARG 31 -13.163 19.604 21.684 236 HE ARG 31 HE ARG 31 -13.423 21.270 23.442 237 HH11 ARG 31 1HH2 ARG 31 -11.397 22.495 20.707 238 HH12 ARG 31 2HH2 ARG 31 -11.444 24.123 21.172 239 HH21 ARG 31 1HH1 ARG 31 -13.494 23.465 24.100 240 HH22 ARG 31 2HH1 ARG 31 -12.761 24.728 23.179 241 H GLY 32 H GLY 32 -8.046 21.045 20.076 242 HA2 GLY 32 2HA GLY 32 -6.925 22.733 21.082 243 HA3 GLY 32 1HA GLY 32 -7.380 22.067 22.701 244 H ALA 33 H ALA 33 -5.884 20.125 20.144 245 HA ALA 33 HA ALA 33 -3.634 19.643 21.912 246 HB1 ALA 33 1HB ALA 33 -4.610 17.649 20.828 247 HB2 ALA 33 2HB ALA 33 -2.962 17.935 20.160 248 HB3 ALA 33 3HB ALA 33 -4.415 18.405 19.211 249 HA PRO 34 HA PRO 34 -1.352 22.677 19.640 250 HB2 PRO 34 2HB PRO 34 1.319 21.872 19.945 251 HB3 PRO 34 1HB PRO 34 0.331 22.497 21.318 252 HG2 PRO 34 2HG PRO 34 0.850 19.572 20.563 253 HG3 PRO 34 1HG PRO 34 0.979 20.341 22.204 254 HD2 PRO 34 2HD PRO 34 -1.277 18.950 21.377 255 HD3 PRO 34 1HD PRO 34 -1.422 20.434 22.425 256 H GLY 35 H GLY 35 -0.483 23.051 17.496 257 HA2 GLY 35 2HA GLY 35 0.215 22.527 15.447 258 HA3 GLY 35 1HA GLY 35 0.602 20.857 16.009 259 H ALA 36 H ALA 36 -2.307 20.820 16.975 260 HA ALA 36 HA ALA 36 -3.288 19.292 14.839 261 HB1 ALA 36 1HB ALA 36 -3.767 18.748 17.222 262 HB2 ALA 36 2HB ALA 36 -5.314 19.075 16.378 263 HB3 ALA 36 3HB ALA 36 -4.626 20.331 17.427 264 H ALA 37 H ALA 37 -5.327 19.558 13.762 265 HA ALA 37 HA ALA 37 -6.261 22.310 13.459 266 HB1 ALA 37 1HB ALA 37 -5.744 22.367 10.997 267 HB2 ALA 37 2HB ALA 37 -4.914 20.770 11.136 268 HB3 ALA 37 3HB ALA 37 -4.220 22.221 11.950 269 H LEU 38 H LEU 38 -6.981 19.019 13.742 270 HA LEU 38 HA LEU 38 -8.966 18.922 11.710 271 HB2 LEU 38 2HB LEU 38 -7.933 16.914 12.714 272 HB3 LEU 38 1HB LEU 38 -8.671 17.273 14.288 273 HG LEU 38 HG LEU 38 -10.558 17.058 11.915 274 HD11 LEU 38 1HD1 LEU 38 -8.953 15.224 11.416 275 HD12 LEU 38 2HD1 LEU 38 -10.509 14.531 12.007 276 HD13 LEU 38 3HD1 LEU 38 -9.072 14.622 13.100 277 HD21 LEU 38 3HD2 LEU 38 -11.949 15.825 13.602 278 HD22 LEU 38 1HD2 LEU 38 -11.445 17.428 14.225 279 HD23 LEU 38 2HD2 LEU 38 -10.608 15.935 14.801 280 H ILE 39 H ILE 39 -9.089 19.332 15.224 281 HA ILE 39 HA ILE 39 -10.651 20.167 16.546 282 HB ILE 39 HB ILE 39 -10.425 22.581 16.658 283 HG12 ILE 39 2HG1 ILE 39 -9.153 22.329 13.848 284 HG13 ILE 39 1HG1 ILE 39 -10.689 23.148 14.234 285 HG21 ILE 39 1HG2 ILE 39 -8.624 20.929 17.363 286 HG22 ILE 39 2HG2 ILE 39 -7.973 22.537 16.907 287 HG23 ILE 39 3HG2 ILE 39 -7.818 21.159 15.769 288 HD11 ILE 39 3HD ILE 39 -7.869 23.995 15.187 289 HD12 ILE 39 1HD ILE 39 -8.911 24.828 13.983 290 HD13 ILE 39 2HD ILE 39 -9.405 24.783 15.717 291 H SER 40 H SER 40 -12.407 19.208 14.204 292 HA SER 40 HA SER 40 -14.684 20.571 15.188 293 HB2 SER 40 2HB SER 40 -13.601 21.125 12.389 294 HB3 SER 40 1HB SER 40 -15.379 21.088 12.640 295 HG SER 40 1HG SER 40 -13.586 22.580 14.234 296 H TYR 41 H TYR 41 -16.616 19.590 14.372 297 HA TYR 41 HA TYR 41 -16.252 16.758 14.430 298 HB2 TYR 41 2HB TYR 41 -18.865 18.401 14.536 299 HB3 TYR 41 1HB TYR 41 -18.699 16.647 14.882 300 HD1 TYR 41 1HD TYR 41 -17.190 15.922 16.794 301 HD2 TYR 41 2HD TYR 41 -18.480 19.990 16.280 302 HE1 TYR 41 1HE TYR 41 -16.782 16.352 19.184 303 HE2 TYR 41 2HE TYR 41 -18.124 20.415 18.674 304 HH TYR 41 HH TYR 41 -17.755 19.430 20.728 305 HA PRO 42 HA PRO 42 -18.935 16.654 10.673 306 HB2 PRO 42 2HB PRO 42 -19.150 18.722 8.796 307 HB3 PRO 42 1HB PRO 42 -20.205 18.587 10.256 308 HG2 PRO 42 2HG PRO 42 -17.643 20.254 9.933 309 HG3 PRO 42 1HG PRO 42 -19.246 20.799 10.584 310 HD2 PRO 42 2HD PRO 42 -17.162 20.017 12.202 311 HD3 PRO 42 1HD PRO 42 -18.882 19.590 12.658 312 H ASP 43 H ASP 43 -15.752 18.256 10.468 313 HA ASP 43 HA ASP 43 -15.201 16.994 7.939 314 HB2 ASP 43 2HB ASP 43 -12.996 18.169 8.143 315 HB3 ASP 43 1HB ASP 43 -14.417 19.273 8.129 316 H ALA 44 H ALA 44 -14.999 16.345 11.317 317 HA ALA 44 HA ALA 44 -12.717 14.815 11.464 318 HB1 ALA 44 1HB ALA 44 -13.759 13.708 13.429 319 HB2 ALA 44 2HB ALA 44 -15.402 14.246 12.896 320 HB3 ALA 44 3HB ALA 44 -14.182 15.457 13.406 321 H ILE 45 H ILE 45 -16.000 13.914 10.455 322 HA ILE 45 HA ILE 45 -15.299 11.151 10.138 323 HB ILE 45 HB ILE 45 -17.449 11.886 11.032 324 HG12 ILE 45 2HG1 ILE 45 -17.765 10.293 8.422 325 HG13 ILE 45 1HG1 ILE 45 -17.103 9.640 9.950 326 HG21 ILE 45 1HG2 ILE 45 -18.075 12.898 8.186 327 HG22 ILE 45 2HG2 ILE 45 -17.746 13.955 9.609 328 HG23 ILE 45 3HG2 ILE 45 -19.185 12.889 9.594 329 HD11 ILE 45 3HD ILE 45 -19.962 10.770 9.564 330 HD12 ILE 45 1HD ILE 45 -19.499 9.043 9.738 331 HD13 ILE 45 2HD ILE 45 -19.286 10.163 11.124 332 H TRP 46 H TRP 46 -14.764 13.941 8.291 333 HA TRP 46 HA TRP 46 -14.967 12.545 5.733 334 HB2 TRP 46 2HB TRP 46 -15.091 15.308 6.510 335 HB3 TRP 46 1HB TRP 46 -13.547 15.152 5.628 336 HD1 TRP 46 HD TRP 46 -13.997 15.726 3.042 337 HE1 TRP 46 1HE TRP 46 -16.002 15.618 1.468 338 HE3 TRP 46 3HE TRP 46 -17.376 13.687 6.267 339 HZ2 TRP 46 2HZ TRP 46 -18.719 14.742 1.565 340 HZ3 TRP 46 3HZ TRP 46 -19.694 13.288 5.494 341 HH2 TRP 46 HH TRP 46 -20.356 13.818 3.170 342 H TRP 47 H TRP 47 -12.555 13.857 8.115 343 HA TRP 47 HA TRP 47 -10.465 12.923 6.450 344 HB2 TRP 47 2HB TRP 47 -10.203 14.823 8.185 345 HB3 TRP 47 1HB TRP 47 -9.943 13.511 9.391 346 HD1 TRP 47 HD TRP 47 -8.631 14.223 5.708 347 HE1 TRP 47 1HE TRP 47 -6.225 13.458 5.535 348 HE3 TRP 47 3HE TRP 47 -7.957 12.785 10.562 349 HZ2 TRP 47 2HZ TRP 47 -4.121 12.696 7.350 350 HZ3 TRP 47 3HZ TRP 47 -5.725 11.989 11.274 351 HH2 TRP 47 HH TRP 47 -3.840 11.919 9.675 352 H SER 48 H SER 48 -12.372 11.320 9.057 353 HA SER 48 HA SER 48 -10.463 9.263 9.298 354 HB2 SER 48 2HB SER 48 -12.261 7.827 10.256 355 HB3 SER 48 1HB SER 48 -11.969 9.390 11.097 356 HG SER 48 1HG SER 48 -14.193 8.780 10.736 357 H VAL 49 H VAL 49 -12.660 10.000 6.704 358 HA VAL 49 HA VAL 49 -12.545 7.319 5.615 359 HB VAL 49 HB VAL 49 -13.739 9.954 4.619 360 HG11 VAL 49 1HG1 VAL 49 -13.242 8.563 2.620 361 HG12 VAL 49 2HG1 VAL 49 -15.005 8.499 2.954 362 HG13 VAL 49 3HG1 VAL 49 -13.950 7.109 3.410 363 HG21 VAL 49 3HG2 VAL 49 -15.896 8.933 5.280 364 HG22 VAL 49 1HG2 VAL 49 -14.802 8.863 6.698 365 HG23 VAL 49 2HG2 VAL 49 -15.084 7.388 5.718 366 H GLU 50 H GLU 50 -10.544 10.187 5.588 367 HA GLU 50 HA GLU 50 -9.441 9.655 2.977 368 HB2 GLU 50 2HB GLU 50 -9.247 11.965 3.919 369 HB3 GLU 50 1HB GLU 50 -8.250 11.340 5.269 370 HG2 GLU 50 2HG GLU 50 -6.415 10.740 3.762 371 HG3 GLU 50 1HG GLU 50 -7.436 11.015 2.305 372 H THR 51 H THR 51 -8.719 8.900 6.382 373 HA THR 51 HA THR 51 -6.404 7.335 5.586 374 HB THR 51 HB THR 51 -6.197 8.770 7.560 375 HG1 THR 51 1HG THR 51 -5.341 7.273 8.925 376 HG21 THR 51 3HG2 THR 51 -8.468 7.026 8.746 377 HG22 THR 51 1HG2 THR 51 -8.534 8.776 8.347 378 HG23 THR 51 2HG2 THR 51 -7.469 8.213 9.671 379 H ALA 52 H ALA 52 -6.726 5.214 7.401 380 HA ALA 52 HA ALA 52 -7.566 3.179 7.629 381 HB1 ALA 52 1HB ALA 52 -10.110 3.931 6.095 382 HB2 ALA 52 2HB ALA 52 -9.900 4.046 7.877 383 HB3 ALA 52 3HB ALA 52 -9.819 2.440 7.061 384 H THR 53 H THR 53 -7.667 4.707 4.498 385 HA THR 53 HA THR 53 -7.507 2.545 2.768 386 HB THR 53 HB THR 53 -6.575 4.553 1.349 387 HG1 THR 53 1HG THR 53 -6.977 6.579 2.805 388 HG21 THR 53 3HG2 THR 53 -9.164 5.011 3.045 389 HG22 THR 53 1HG2 THR 53 -9.056 4.024 1.544 390 HG23 THR 53 2HG2 THR 53 -8.772 5.801 1.492 391 H THR 54 H THR 54 -5.371 4.087 4.897 392 HA THR 54 HA THR 54 -3.335 4.170 5.458 393 HB THR 54 HB THR 54 -1.662 2.519 5.293 394 HG1 THR 54 1HG THR 54 -1.977 1.833 3.207 395 HG21 THR 54 3HG2 THR 54 -3.679 2.315 6.865 396 HG22 THR 54 1HG2 THR 54 -2.907 0.746 6.452 397 HG23 THR 54 2HG2 THR 54 -4.461 1.217 5.669 398 H VAL 55 H VAL 55 -4.309 5.710 3.448 399 HA VAL 55 HA VAL 55 -1.779 6.508 2.316 400 HB VAL 55 HB VAL 55 -4.573 6.656 0.985 401 HG11 VAL 55 1HG1 VAL 55 -3.243 7.814 -0.896 402 HG12 VAL 55 2HG1 VAL 55 -1.840 7.893 0.220 403 HG13 VAL 55 3HG1 VAL 55 -3.357 8.779 0.614 404 HG21 VAL 55 3HG2 VAL 55 -1.990 5.182 0.122 405 HG22 VAL 55 1HG2 VAL 55 -3.482 5.338 -0.877 406 HG23 VAL 55 2HG2 VAL 55 -3.524 4.411 0.665 407 H GLY 56 H GLY 56 -1.802 8.923 2.763 408 HA2 GLY 56 2HA GLY 56 -4.241 9.961 3.905 409 HA3 GLY 56 1HA GLY 56 -2.620 10.164 4.766 410 H TYR 57 H TYR 57 -4.430 11.908 2.622 411 HA TYR 57 HA TYR 57 -2.326 12.079 0.580 412 HB2 TYR 57 2HB TYR 57 -4.922 12.062 0.043 413 HB3 TYR 57 1HB TYR 57 -4.919 13.761 0.649 414 HD1 TYR 57 1HD TYR 57 -3.121 15.340 -0.436 415 HD2 TYR 57 2HD TYR 57 -4.331 11.618 -2.223 416 HE1 TYR 57 1HE TYR 57 -2.089 16.005 -2.529 417 HE2 TYR 57 2HE TYR 57 -3.325 12.331 -4.369 418 HH TYR 57 HH TYR 57 -1.441 13.847 -5.191 419 H GLY 58 H GLY 58 -3.972 13.765 3.264 420 HA2 GLY 58 2HA GLY 58 -2.370 14.673 4.797 421 HA3 GLY 58 1HA GLY 58 -1.588 15.539 3.421 422 H ASP 59 H ASP 59 -5.117 15.057 4.275 423 HA ASP 59 HA ASP 59 -5.472 17.895 3.987 424 HB2 ASP 59 2HB ASP 59 -7.354 16.117 3.770 425 HB3 ASP 59 1HB ASP 59 -7.478 16.208 5.552 426 H ARG 60 H ARG 60 -5.447 15.622 6.860 427 HA ARG 60 HA ARG 60 -4.923 18.029 8.505 428 HB2 ARG 60 2HB ARG 60 -6.148 15.392 9.460 429 HB3 ARG 60 1HB ARG 60 -5.918 16.879 10.425 430 HG2 ARG 60 2HG ARG 60 -7.884 16.448 8.088 431 HG3 ARG 60 1HG ARG 60 -8.255 16.608 9.841 432 HD2 ARG 60 2HD ARG 60 -7.272 19.023 9.693 433 HD3 ARG 60 1HD ARG 60 -7.240 18.790 7.895 434 HE ARG 60 HE ARG 60 -9.773 18.503 9.560 435 HH11 ARG 60 1HH2 ARG 60 -8.391 19.906 6.530 436 HH12 ARG 60 2HH2 ARG 60 -9.216 21.395 6.713 437 HH21 ARG 60 1HH1 ARG 60 -11.286 20.170 9.437 438 HH22 ARG 60 2HH1 ARG 60 -11.054 21.496 8.348 439 H TYR 61 H TYR 61 -3.710 17.300 10.656 440 HA TYR 61 HA TYR 61 -1.665 15.358 9.985 441 HB2 TYR 61 2HB TYR 61 -0.934 18.150 11.064 442 HB3 TYR 61 1HB TYR 61 0.186 16.815 10.590 443 HD1 TYR 61 2HD TYR 61 -0.102 15.993 8.034 444 HD2 TYR 61 1HD TYR 61 -1.425 19.808 9.527 445 HE1 TYR 61 2HE TYR 61 -0.342 16.801 5.737 446 HE2 TYR 61 1HE TYR 61 -1.629 20.639 7.223 447 HH TYR 61 HH TYR 61 -1.595 18.451 4.490 448 HA PRO 62 HA PRO 62 -3.131 15.161 14.324 449 HB2 PRO 62 2HB PRO 62 -2.368 12.528 14.916 450 HB3 PRO 62 1HB PRO 62 -3.772 12.908 13.855 451 HG2 PRO 62 2HG PRO 62 -0.895 12.243 12.988 452 HG3 PRO 62 1HG PRO 62 -2.439 11.493 12.400 453 HD2 PRO 62 2HD PRO 62 -1.166 13.573 11.068 454 HD3 PRO 62 1HD PRO 62 -2.989 13.461 11.115 455 H VAL 63 H VAL 63 -1.822 14.345 16.518 456 HA VAL 63 HA VAL 63 0.995 14.964 16.215 457 HB VAL 63 HB VAL 63 -0.245 17.129 16.342 458 HG11 VAL 63 1HG1 VAL 63 -1.188 16.159 19.127 459 HG12 VAL 63 2HG1 VAL 63 -2.209 16.370 17.654 460 HG13 VAL 63 3HG1 VAL 63 -1.430 17.787 18.410 461 HG21 VAL 63 3HG2 VAL 63 1.173 18.225 17.929 462 HG22 VAL 63 1HG2 VAL 63 2.116 16.896 17.182 463 HG23 VAL 63 2HG2 VAL 63 1.478 16.732 18.868 464 H THR 64 H THR 64 1.963 14.791 18.642 465 HA THR 64 HA THR 64 1.502 12.302 19.573 466 HB THR 64 HB THR 64 2.689 14.640 21.167 467 HG1 THR 64 1HG THR 64 4.529 14.335 19.917 468 HG21 THR 64 3HG2 THR 64 3.529 11.660 20.881 469 HG22 THR 64 1HG2 THR 64 2.677 12.369 22.294 470 HG23 THR 64 2HG2 THR 64 4.344 12.898 21.896 471 H GLU 65 H GLU 65 0.069 15.372 20.690 472 HA GLU 65 HA GLU 65 -0.773 14.368 23.206 473 HB2 GLU 65 2HB GLU 65 -0.369 16.833 22.713 474 HB3 GLU 65 1HB GLU 65 -1.816 16.799 21.650 475 HG2 GLU 65 2HG GLU 65 -2.490 17.813 23.724 476 HG3 GLU 65 1HG GLU 65 -3.225 16.180 23.723 477 H GLU 66 H GLU 66 -2.174 14.352 19.921 478 HA GLU 66 HA GLU 66 -4.816 13.819 20.778 479 HB2 GLU 66 2HB GLU 66 -5.413 13.644 18.532 480 HB3 GLU 66 1HB GLU 66 -3.990 14.681 18.438 481 HG2 GLU 66 2HG GLU 66 -3.526 13.283 16.691 482 HG3 GLU 66 1HG GLU 66 -2.733 12.288 17.967 483 H GLY 67 H GLY 67 -1.891 12.130 20.298 484 HA2 GLY 67 2HA GLY 67 -1.207 10.186 21.274 485 HA3 GLY 67 1HA GLY 67 -2.947 9.713 21.554 486 H ARG 68 H ARG 68 -0.617 10.582 18.964 487 HA ARG 68 HA ARG 68 -1.844 10.135 16.751 488 HB2 ARG 68 2HB ARG 68 0.670 10.746 17.204 489 HB3 ARG 68 1HB ARG 68 0.971 8.986 16.985 490 HG2 ARG 68 2HG ARG 68 -0.439 9.438 14.710 491 HG3 ARG 68 1HG ARG 68 0.056 11.127 14.997 492 HD2 ARG 68 2HD ARG 68 1.928 8.659 14.704 493 HD3 ARG 68 1HD ARG 68 1.586 9.881 13.439 494 HE ARG 68 HE ARG 68 3.583 10.018 15.438 495 HH11 ARG 68 1HH2 ARG 68 2.116 11.825 12.849 496 HH12 ARG 68 2HH2 ARG 68 2.492 13.362 13.398 497 HH21 ARG 68 1HH1 ARG 68 4.736 12.142 15.860 498 HH22 ARG 68 2HH1 ARG 68 4.418 13.411 14.752 499 H LYS 69 H LYS 69 -1.375 7.668 18.929 500 HA LYS 69 HA LYS 69 -1.560 5.355 17.445 501 HB2 LYS 69 2HB LYS 69 -2.740 5.924 20.213 502 HB3 LYS 69 1HB LYS 69 -2.361 4.327 19.503 503 HG2 LYS 69 2HG LYS 69 0.127 5.442 19.273 504 HG3 LYS 69 1HG LYS 69 -0.510 6.456 20.610 505 HD2 LYS 69 2HD LYS 69 0.571 4.717 21.765 506 HD3 LYS 69 1HD LYS 69 -1.146 4.219 21.796 507 HE2 LYS 69 2HE LYS 69 0.347 2.274 21.342 508 HE3 LYS 69 1HE LYS 69 -0.704 2.586 19.905 509 HZ1 LYS 69 3HZ LYS 69 1.082 3.626 18.804 510 HZ2 LYS 69 1HZ LYS 69 1.656 2.160 19.348 511 HZ3 LYS 69 2HZ LYS 69 2.120 3.510 20.206 512 H VAL 70 H VAL 70 -3.966 7.979 17.875 513 HA VAL 70 HA VAL 70 -6.192 6.270 17.406 514 HB VAL 70 HB VAL 70 -6.058 9.252 16.833 515 HG11 VAL 70 1HG1 VAL 70 -7.924 8.099 15.630 516 HG12 VAL 70 2HG1 VAL 70 -8.535 9.106 16.977 517 HG13 VAL 70 3HG1 VAL 70 -8.444 7.309 17.170 518 HG21 VAL 70 3HG2 VAL 70 -5.564 8.879 19.195 519 HG22 VAL 70 1HG2 VAL 70 -6.920 7.680 19.367 520 HG23 VAL 70 2HG2 VAL 70 -7.245 9.439 19.049 521 H ALA 71 H ALA 71 -4.276 8.509 15.295 522 HA ALA 71 HA ALA 71 -5.392 7.702 12.901 523 HB1 ALA 71 1HB ALA 71 -3.794 9.623 13.099 524 HB2 ALA 71 2HB ALA 71 -3.300 8.486 11.793 525 HB3 ALA 71 3HB ALA 71 -2.445 8.469 13.386 526 H GLU 72 H GLU 72 -2.566 6.319 14.583 527 HA GLU 72 HA GLU 72 -1.775 4.315 12.879 528 HB2 GLU 72 2HB GLU 72 -0.651 4.949 15.120 529 HB3 GLU 72 1HB GLU 72 -2.040 4.167 15.931 530 HG2 GLU 72 2HG GLU 72 -1.244 1.953 14.699 531 HG3 GLU 72 1HG GLU 72 0.309 2.837 14.489 532 H GLN 73 H GLN 73 -4.354 4.177 15.417 533 HA GLN 73 HA GLN 73 -4.778 1.421 15.214 534 HB2 GLN 73 2HB GLN 73 -5.621 2.625 17.190 535 HB3 GLN 73 1HB GLN 73 -6.720 3.617 16.174 536 HG2 GLN 73 2HG GLN 73 -8.132 1.671 15.657 537 HG3 GLN 73 1HG GLN 73 -6.912 0.544 16.328 538 HE21 GLN 73 1HE2 GLN 73 -7.683 -0.347 18.169 539 HE22 GLN 73 2HE2 GLN 73 -8.447 0.493 19.479 540 H VAL 74 H VAL 74 -6.238 4.193 13.510 541 HA VAL 74 HA VAL 74 -8.270 2.658 12.281 542 HB VAL 74 HB VAL 74 -7.071 5.363 11.508 543 HG11 VAL 74 1HG1 VAL 74 -9.698 3.952 10.641 544 HG12 VAL 74 2HG1 VAL 74 -8.326 4.437 9.580 545 HG13 VAL 74 3HG1 VAL 74 -9.334 5.695 10.363 546 HG21 VAL 74 3HG2 VAL 74 -9.004 6.277 12.771 547 HG22 VAL 74 1HG2 VAL 74 -8.050 5.235 13.866 548 HG23 VAL 74 2HG2 VAL 74 -9.579 4.609 13.166 549 H MET 75 H MET 75 -4.910 3.498 11.360 550 HA MET 75 HA MET 75 -4.998 2.600 8.715 551 HB2 MET 75 2HB MET 75 -2.661 2.280 10.715 552 HB3 MET 75 1HB MET 75 -2.537 2.057 8.943 553 HG2 MET 75 2HG MET 75 -2.960 4.447 8.555 554 HG3 MET 75 1HG MET 75 -3.257 4.715 10.299 555 HE1 MET 75 3HE MET 75 -1.561 6.586 10.565 556 HE2 MET 75 1HE MET 75 -1.224 6.521 8.803 557 HE3 MET 75 2HE MET 75 0.136 6.557 9.971 558 H LYS 76 H LYS 76 -4.129 0.856 11.737 559 HA LYS 76 HA LYS 76 -3.609 -1.578 10.458 560 HB2 LYS 76 2HB LYS 76 -2.809 -1.100 12.781 561 HB3 LYS 76 1HB LYS 76 -4.507 -1.127 13.370 562 HG2 LYS 76 2HG LYS 76 -4.730 -3.518 12.718 563 HG3 LYS 76 1HG LYS 76 -3.084 -3.501 11.998 564 HD2 LYS 76 2HD LYS 76 -2.073 -3.281 14.243 565 HD3 LYS 76 1HD LYS 76 -3.672 -2.937 14.980 566 HE2 LYS 76 2HE LYS 76 -2.904 -5.303 15.419 567 HE3 LYS 76 1HE LYS 76 -4.486 -5.221 14.545 568 HZ1 LYS 76 3HZ LYS 76 -2.171 -6.563 13.816 569 HZ2 LYS 76 1HZ LYS 76 -2.369 -5.336 12.668 570 HZ3 LYS 76 2HZ LYS 76 -3.633 -6.431 12.936 571 H ALA 77 H ALA 77 -6.597 -0.245 11.885 572 HA ALA 77 HA ALA 77 -8.123 -2.541 11.783 573 HB1 ALA 77 1HB ALA 77 -10.127 -1.031 11.790 574 HB2 ALA 77 2HB ALA 77 -9.072 0.362 11.342 575 HB3 ALA 77 3HB ALA 77 -8.877 -0.442 12.944 576 H GLY 78 H GLY 78 -7.415 -0.135 9.254 577 HA2 GLY 78 2HA GLY 78 -9.215 -1.148 7.314 578 HA3 GLY 78 1HA GLY 78 -7.798 -0.053 7.090 579 H ILE 79 H ILE 79 -5.701 -1.614 7.933 580 HA ILE 79 HA ILE 79 -5.182 -3.218 5.739 581 HB ILE 79 HB ILE 79 -3.903 -3.285 8.514 582 HG12 ILE 79 2HG1 ILE 79 -2.967 -1.983 5.872 583 HG13 ILE 79 1HG1 ILE 79 -3.790 -1.105 7.185 584 HG21 ILE 79 1HG2 ILE 79 -2.914 -4.539 5.858 585 HG22 ILE 79 2HG2 ILE 79 -3.405 -5.449 7.333 586 HG23 ILE 79 3HG2 ILE 79 -1.943 -4.427 7.369 587 HD11 ILE 79 3HD ILE 79 -1.032 -2.490 7.393 588 HD12 ILE 79 1HD ILE 79 -1.367 -0.730 7.353 589 HD13 ILE 79 2HD ILE 79 -1.900 -1.708 8.770 590 H GLU 80 H GLU 80 -6.323 -4.184 9.029 591 HA GLU 80 HA GLU 80 -6.285 -6.940 8.644 592 HB2 GLU 80 2HB GLU 80 -8.371 -5.262 10.156 593 HB3 GLU 80 1HB GLU 80 -8.220 -7.047 10.323 594 HG2 GLU 80 2HG GLU 80 -5.892 -5.163 11.052 595 HG3 GLU 80 1HG GLU 80 -7.260 -5.469 12.173 596 H VAL 81 H VAL 81 -8.783 -4.526 7.788 597 HA VAL 81 HA VAL 81 -10.751 -6.392 7.007 598 HB VAL 81 HB VAL 81 -10.311 -3.407 6.593 599 HG11 VAL 81 1HG1 VAL 81 -12.571 -5.113 5.371 600 HG12 VAL 81 2HG1 VAL 81 -11.429 -4.019 4.513 601 HG13 VAL 81 3HG1 VAL 81 -12.669 -3.335 5.609 602 HG21 VAL 81 3HG2 VAL 81 -12.453 -5.076 8.087 603 HG22 VAL 81 1HG2 VAL 81 -12.276 -3.286 8.125 604 HG23 VAL 81 2HG2 VAL 81 -11.006 -4.324 8.855 605 H PHE 82 H PHE 82 -8.387 -4.400 5.110 606 HA PHE 82 HA PHE 82 -9.268 -5.436 2.649 607 HB2 PHE 82 2HB PHE 82 -6.458 -4.339 3.300 608 HB3 PHE 82 1HB PHE 82 -7.180 -4.494 1.654 609 HD1 PHE 82 2HD PHE 82 -10.029 -3.396 2.287 610 HD2 PHE 82 1HD PHE 82 -6.079 -2.063 3.371 611 HE1 PHE 82 2HE PHE 82 -10.866 -1.096 2.533 612 HE2 PHE 82 1HE PHE 82 -6.915 0.231 3.590 613 HZ PHE 82 HZ PHE 82 -9.316 0.734 3.194 614 H ALA 83 H ALA 83 -6.692 -6.469 4.891 615 HA ALA 83 HA ALA 83 -5.508 -8.376 3.264 616 HB1 ALA 83 1HB ALA 83 -4.709 -9.424 5.429 617 HB2 ALA 83 2HB ALA 83 -5.865 -8.376 6.332 618 HB3 ALA 83 3HB ALA 83 -4.494 -7.638 5.428 619 H LEU 84 H LEU 84 -8.344 -8.590 5.442 620 HA LEU 84 HA LEU 84 -8.653 -11.349 5.379 621 HB2 LEU 84 2HB LEU 84 -9.686 -9.732 6.988 622 HB3 LEU 84 1HB LEU 84 -10.841 -9.205 5.733 623 HG LEU 84 HG LEU 84 -10.651 -12.168 6.497 624 HD11 LEU 84 1HD1 LEU 84 -12.128 -10.054 8.192 625 HD12 LEU 84 2HD1 LEU 84 -10.660 -10.983 8.677 626 HD13 LEU 84 3HD1 LEU 84 -12.217 -11.844 8.402 627 HD21 LEU 84 3HD2 LEU 84 -12.265 -11.577 4.667 628 HD22 LEU 84 1HD2 LEU 84 -13.069 -10.380 5.745 629 HD23 LEU 84 2HD2 LEU 84 -13.137 -12.137 6.130 630 H VAL 85 H VAL 85 -9.714 -8.852 3.072 631 HA VAL 85 HA VAL 85 -11.610 -10.349 1.687 632 HB VAL 85 HB VAL 85 -9.797 -8.094 0.697 633 HG11 VAL 85 1HG1 VAL 85 -11.627 -7.699 -1.020 634 HG12 VAL 85 2HG1 VAL 85 -12.363 -9.282 -0.565 635 HG13 VAL 85 3HG1 VAL 85 -10.716 -9.217 -1.296 636 HG21 VAL 85 3HG2 VAL 85 -11.213 -7.470 2.666 637 HG22 VAL 85 1HG2 VAL 85 -12.677 -8.123 1.858 638 HG23 VAL 85 2HG2 VAL 85 -11.832 -6.681 1.186 639 H THR 86 H THR 86 -8.165 -10.739 1.806 640 HA THR 86 HA THR 86 -7.688 -11.911 -0.646 641 HB THR 86 HB THR 86 -6.352 -12.686 1.975 642 HG1 THR 86 1HG THR 86 -6.123 -10.598 1.917 643 HG21 THR 86 3HG2 THR 86 -5.668 -14.119 0.006 644 HG22 THR 86 1HG2 THR 86 -4.338 -13.001 0.464 645 HG23 THR 86 2HG2 THR 86 -5.358 -12.633 -0.974 646 H ALA 87 H ALA 87 -9.531 -13.192 2.084 647 HA ALA 87 HA ALA 87 -9.321 -15.926 1.483 648 HB1 ALA 87 1HB ALA 87 -11.741 -14.374 2.615 649 HB2 ALA 87 2HB ALA 87 -10.389 -15.033 3.592 650 HB3 ALA 87 3HB ALA 87 -11.487 -16.160 2.720 651 H ALA 88 H ALA 88 -10.975 -13.305 -0.164 652 HA ALA 88 HA ALA 88 -12.627 -15.119 -1.752 653 HB1 ALA 88 1HB ALA 88 -13.640 -12.920 -1.089 654 HB2 ALA 88 2HB ALA 88 -13.441 -13.043 -2.875 655 HB3 ALA 88 3HB ALA 88 -12.286 -12.057 -1.904 656 H LEU 89 H LEU 89 -9.795 -12.910 -1.999 657 HA LEU 89 HA LEU 89 -9.486 -13.140 -4.753 658 HB2 LEU 89 2HB LEU 89 -7.238 -12.715 -2.695 659 HB3 LEU 89 1HB LEU 89 -7.157 -12.329 -4.442 660 HG LEU 89 HG LEU 89 -9.033 -10.981 -2.398 661 HD11 LEU 89 1HD1 LEU 89 -7.547 -9.013 -2.592 662 HD12 LEU 89 2HD1 LEU 89 -6.460 -9.901 -3.717 663 HD13 LEU 89 3HD1 LEU 89 -6.619 -10.432 -2.008 664 HD21 LEU 89 3HD2 LEU 89 -9.455 -9.301 -4.209 665 HD22 LEU 89 1HD2 LEU 89 -10.054 -10.932 -4.664 666 HD23 LEU 89 2HD2 LEU 89 -8.514 -10.306 -5.368 667 H ALA 90 H ALA 90 -8.155 -15.108 -2.106 668 HA ALA 90 HA ALA 90 -6.369 -16.560 -3.703 669 HB1 ALA 90 1HB ALA 90 -6.175 -16.382 -1.211 670 HB2 ALA 90 2HB ALA 90 -6.213 -18.103 -1.746 671 HB3 ALA 90 3HB ALA 90 -7.691 -17.335 -1.036 672 H THR 91 H THR 91 -9.883 -16.935 -3.290 673 HA THR 91 HA THR 91 -9.668 -19.662 -4.330 674 HB THR 91 HB THR 91 -11.200 -19.527 -2.528 675 HG1 THR 91 1HG THR 91 -12.261 -19.828 -5.093 676 HG21 THR 91 3HG2 THR 91 -12.578 -17.267 -4.120 677 HG22 THR 91 1HG2 THR 91 -11.813 -17.184 -2.489 678 HG23 THR 91 2HG2 THR 91 -13.319 -18.119 -2.731 679 H ASP 92 H ASP 92 -9.503 -16.489 -5.615 680 HA ASP 92 HA ASP 92 -11.491 -16.823 -7.597 681 HB2 ASP 92 2HB ASP 92 -10.523 -14.519 -7.032 682 HB3 ASP 92 1HB ASP 92 -9.065 -14.994 -7.972 683 H PHE 93 H PHE 93 -7.964 -17.484 -7.500 684 HA PHE 93 HA PHE 93 -7.896 -18.220 -10.223 685 HB2 PHE 93 2HB PHE 93 -5.725 -18.871 -10.006 686 HB3 PHE 93 1HB PHE 93 -5.840 -17.600 -8.752 687 HD1 PHE 93 1HD PHE 93 -6.066 -18.381 -6.289 688 HD2 PHE 93 2HD PHE 93 -5.018 -21.078 -9.465 689 HE1 PHE 93 1HE PHE 93 -5.145 -19.967 -4.641 690 HE2 PHE 93 2HE PHE 93 -4.074 -22.661 -7.810 691 HZ PHE 93 HZ PHE 93 -4.131 -22.105 -5.395 692 H VAL 94 H VAL 94 -9.047 -19.920 -7.442 693 HA VAL 94 HA VAL 94 -8.335 -22.533 -8.213 694 HB VAL 94 HB VAL 94 -10.519 -21.555 -6.307 695 HG11 VAL 94 1HG1 VAL 94 -10.925 -23.943 -6.911 696 HG12 VAL 94 2HG1 VAL 94 -10.273 -23.832 -5.246 697 HG13 VAL 94 3HG1 VAL 94 -9.198 -24.347 -6.596 698 HG21 VAL 94 3HG2 VAL 94 -8.200 -20.721 -5.729 699 HG22 VAL 94 1HG2 VAL 94 -7.559 -22.392 -5.871 700 HG23 VAL 94 2HG2 VAL 94 -8.732 -21.975 -4.572 701 H ARG 95 H ARG 95 -10.871 -20.330 -9.113 702 HA ARG 95 HA ARG 95 -12.785 -22.006 -10.244 703 HB2 ARG 95 2HB ARG 95 -11.675 -19.288 -11.221 704 HB3 ARG 95 1HB ARG 95 -13.200 -20.039 -11.809 705 HG2 ARG 95 2HG ARG 95 -14.212 -19.857 -9.594 706 HG3 ARG 95 1HG ARG 95 -12.716 -19.111 -8.915 707 HD2 ARG 95 2HD ARG 95 -12.893 -17.130 -10.181 708 HD3 ARG 95 1HD ARG 95 -13.969 -17.849 -11.434 709 HE ARG 95 HE ARG 95 -14.652 -16.746 -8.771 710 HH11 ARG 95 1HH2 ARG 95 -15.953 -18.804 -11.546 711 HH12 ARG 95 2HH2 ARG 95 -17.540 -18.802 -10.918 712 HH21 ARG 95 1HH1 ARG 95 -16.898 -16.274 -8.448 713 HH22 ARG 95 2HH1 ARG 95 -18.124 -17.282 -9.091 714 H ARG 96 H ARG 96 -9.476 -21.362 -11.265 715 HA ARG 96 HA ARG 96 -9.984 -21.693 -14.046 716 HB2 ARG 96 2HB ARG 96 -7.908 -20.544 -13.033 717 HB3 ARG 96 1HB ARG 96 -7.352 -22.175 -12.564 718 HG2 ARG 96 2HG ARG 96 -7.685 -22.673 -15.225 719 HG3 ARG 96 1HG ARG 96 -7.684 -20.898 -15.354 720 HD2 ARG 96 2HD ARG 96 -5.404 -21.932 -15.792 721 HD3 ARG 96 1HD ARG 96 -5.369 -20.843 -14.348 722 HE ARG 96 HE ARG 96 -5.288 -22.707 -12.897 723 HH11 ARG 96 1HH2 ARG 96 -5.109 -23.914 -16.324 724 HH12 ARG 96 2HH2 ARG 96 -5.038 -25.534 -15.858 725 HH21 ARG 96 1HH1 ARG 96 -5.314 -25.016 -12.334 726 HH22 ARG 96 2HH1 ARG 96 -5.584 -26.168 -13.531 727 H GLU 97 H GLU 97 -9.586 -23.914 -11.312 728 HA GLU 97 HA GLU 97 -9.272 -26.105 -13.279 729 HB2 GLU 97 2HB GLU 97 -7.363 -25.833 -11.547 730 HB3 GLU 97 1HB GLU 97 -8.547 -26.392 -10.325 731 HG2 GLU 97 2HG GLU 97 -7.144 -28.287 -11.172 732 HG3 GLU 97 1HG GLU 97 -8.860 -28.524 -11.662 733 H GLU 98 H GLU 98 -10.714 -25.319 -10.043 734 HA GLU 98 HA GLU 98 -12.686 -27.409 -10.416 735 HB2 GLU 98 2HB GLU 98 -12.352 -25.217 -8.254 736 HB3 GLU 98 1HB GLU 98 -13.733 -26.339 -8.322 737 HG2 GLU 98 2HG GLU 98 -12.026 -28.289 -8.112 738 HG3 GLU 98 1HG GLU 98 -10.791 -27.040 -7.711 739 H GLU 99 H GLU 99 -15.026 -26.776 -10.443 740 HA GLU 99 HA GLU 99 -16.744 -25.675 -11.013 741 HB2 GLU 99 2HB GLU 99 -15.557 -23.757 -9.593 742 HB3 GLU 99 1HB GLU 99 -15.463 -22.946 -11.185 743 HG2 GLU 99 2HG GLU 99 -17.463 -22.168 -10.129 744 HG3 GLU 99 1HG GLU 99 -18.062 -23.347 -11.349 745 H ARG 100 H ARG 100 -13.902 -24.631 -12.859 746 HA ARG 100 HA ARG 100 -15.012 -23.924 -15.235 747 HB2 ARG 100 2HB ARG 100 -12.566 -23.828 -14.720 748 HB3 ARG 100 1HB ARG 100 -12.471 -25.613 -14.793 749 HG2 ARG 100 2HG ARG 100 -13.108 -25.525 -17.246 750 HG3 ARG 100 1HG ARG 100 -13.249 -23.742 -17.131 751 HD2 ARG 100 2HD ARG 100 -11.053 -24.440 -18.169 752 HD3 ARG 100 1HD ARG 100 -10.820 -23.541 -16.626 753 HE ARG 100 HE ARG 100 -9.963 -25.370 -15.607 754 HH11 ARG 100 1HH2 ARG 100 -11.393 -26.434 -18.743 755 HH12 ARG 100 2HH2 ARG 100 -10.392 -27.770 -18.948 756 HH21 ARG 100 1HH1 ARG 100 -8.886 -27.609 -15.621 757 HH22 ARG 100 2HH1 ARG 100 -8.968 -28.501 -17.042 758 H ARG 101 H ARG 101 -14.000 -27.273 -14.339 759 HA ARG 101 HA ARG 101 -15.392 -28.321 -16.661 760 HB2 ARG 101 2HB ARG 101 -13.711 -29.649 -14.459 761 HB3 ARG 101 1HB ARG 101 -14.579 -30.571 -15.722 762 HG2 ARG 101 2HG ARG 101 -13.407 -29.401 -17.517 763 HG3 ARG 101 1HG ARG 101 -12.436 -28.443 -16.360 764 HD2 ARG 101 2HD ARG 101 -12.402 -31.554 -16.315 765 HD3 ARG 101 1HD ARG 101 -11.431 -30.621 -17.526 766 HE ARG 101 HE ARG 101 -10.894 -29.536 -14.908 767 HH11 ARG 101 1HH2 ARG 101 -10.144 -32.524 -16.893 768 HH12 ARG 101 2HH2 ARG 101 -8.865 -32.978 -15.860 769 HH21 ARG 101 1HH1 ARG 101 -8.682 -29.915 -14.106 770 HH22 ARG 101 2HH1 ARG 101 -8.042 -31.502 -14.187 771 H GLY 102 H GLY 102 -16.568 -27.255 -13.727 772 HA2 GLY 102 2HA GLY 102 -18.641 -27.478 -12.977 773 HA3 GLY 102 1HA GLY 102 -18.918 -28.845 -14.113 774 H HIS 103 H HIS 103 -16.324 -29.982 -12.801 775 HA HIS 103 HA HIS 103 -15.688 -31.303 -11.178 776 HB2 HIS 103 2HB HIS 103 -18.232 -30.874 -9.505 777 HB3 HIS 103 1HB HIS 103 -16.751 -31.753 -9.032 778 HD1 HIS 103 1HD HIS 103 -18.261 -28.312 -9.099 779 HD2 HIS 103 2HD HIS 103 -14.658 -30.155 -7.948 780 HE1 HIS 103 1HE HIS 103 -16.924 -26.596 -7.858 781 HE2 HIS 103 2HE HIS 103 -14.824 -27.766 -7.016 782 H1 SER 1 H SER 1 -1.901 -17.119 -24.579 783 HA SER 1 HA SER 1 -0.663 -18.459 -22.753 784 HB2 SER 1 2HB SER 1 -0.896 -15.389 -22.702 785 HB3 SER 1 1HB SER 1 0.535 -16.382 -22.241 786 HG SER 1 1HG SER 1 0.737 -15.524 -24.325 787 H ALA 2 H ALA 2 -1.594 -19.441 -21.023 788 HA ALA 2 HA ALA 2 -2.567 -19.817 -19.158 789 HB1 ALA 2 1HB ALA 2 -1.001 -18.110 -18.212 790 HB2 ALA 2 2HB ALA 2 -2.520 -18.239 -17.269 791 HB3 ALA 2 3HB ALA 2 -2.259 -16.860 -18.430 792 H ASP 3 H ASP 3 -4.284 -17.615 -17.777 793 HA ASP 3 HA ASP 3 -6.631 -17.611 -19.484 794 HB2 ASP 3 2HB ASP 3 -6.741 -19.823 -18.188 795 HB3 ASP 3 1HB ASP 3 -6.698 -18.908 -16.646 796 H HIS 4 H HIS 4 -5.820 -17.316 -16.017 797 HA HIS 4 HA HIS 4 -7.071 -15.040 -15.461 798 HB2 HIS 4 2HB HIS 4 -5.467 -14.622 -13.542 799 HB3 HIS 4 1HB HIS 4 -6.098 -16.274 -13.632 800 HD1 HIS 4 1HD HIS 4 -2.828 -14.582 -15.009 801 HD2 HIS 4 2HD HIS 4 -4.251 -18.048 -13.102 802 HE1 HIS 4 1HE HIS 4 -0.832 -16.039 -14.547 803 HE2 HIS 4 2HE HIS 4 -1.733 -18.071 -13.269 804 H GLU 5 H GLU 5 -4.132 -15.068 -17.387 805 HA GLU 5 HA GLU 5 -3.241 -12.465 -16.631 806 HB2 GLU 5 2HB GLU 5 -2.594 -14.150 -19.132 807 HB3 GLU 5 1HB GLU 5 -1.792 -12.614 -18.663 808 HG2 GLU 5 2HG GLU 5 -0.935 -13.624 -16.566 809 HG3 GLU 5 1HG GLU 5 -1.725 -15.200 -16.974 810 H ARG 6 H ARG 6 -5.689 -13.795 -18.825 811 HA ARG 6 HA ARG 6 -5.742 -11.409 -20.422 812 HB2 ARG 6 2HB ARG 6 -7.774 -13.712 -20.312 813 HB3 ARG 6 1HB ARG 6 -7.591 -12.483 -21.608 814 HG2 ARG 6 2HG ARG 6 -5.699 -14.814 -20.907 815 HG3 ARG 6 1HG ARG 6 -6.671 -14.542 -22.391 816 HD2 ARG 6 2HD ARG 6 -5.188 -12.393 -22.764 817 HD3 ARG 6 1HD ARG 6 -4.101 -13.069 -21.472 818 HE ARG 6 HE ARG 6 -4.701 -15.087 -23.486 819 HH11 ARG 6 1HH2 ARG 6 -2.489 -12.290 -22.858 820 HH12 ARG 6 2HH2 ARG 6 -1.837 -12.278 -24.417 821 HH21 ARG 6 1HH1 ARG 6 -3.657 -15.276 -25.440 822 HH22 ARG 6 2HH1 ARG 6 -2.450 -14.168 -26.005 823 H GLU 7 H GLU 7 -7.266 -12.532 -17.468 824 HA GLU 7 HA GLU 7 -9.391 -10.575 -17.650 825 HB2 GLU 7 2HB GLU 7 -9.496 -12.905 -16.413 826 HB3 GLU 7 1HB GLU 7 -8.576 -12.090 -15.106 827 HG2 GLU 7 2HG GLU 7 -10.986 -12.004 -14.584 828 HG3 GLU 7 1HG GLU 7 -10.463 -10.332 -15.012 829 H ALA 8 H ALA 8 -6.275 -11.129 -15.984 830 HA ALA 8 HA ALA 8 -6.225 -8.825 -14.449 831 HB1 ALA 8 1HB ALA 8 -3.843 -10.313 -15.734 832 HB2 ALA 8 2HB ALA 8 -4.616 -10.745 -14.158 833 HB3 ALA 8 3HB ALA 8 -3.749 -9.181 -14.341 834 H GLN 9 H GLN 9 -5.254 -9.350 -17.850 835 HA GLN 9 HA GLN 9 -4.092 -6.876 -18.349 836 HB2 GLN 9 2HB GLN 9 -4.033 -8.764 -19.997 837 HB3 GLN 9 1HB GLN 9 -5.812 -8.685 -20.168 838 HG2 GLN 9 2HG GLN 9 -4.810 -7.705 -22.141 839 HG3 GLN 9 1HG GLN 9 -5.589 -6.369 -21.242 840 HE21 GLN 9 1HE2 GLN 9 -4.189 -4.614 -20.507 841 HE22 GLN 9 2HE2 GLN 9 -2.491 -4.614 -20.774 842 H LYS 10 H LYS 10 -7.544 -7.923 -18.549 843 HA LYS 10 HA LYS 10 -8.476 -5.516 -19.681 844 HB2 LYS 10 2HB LYS 10 -9.946 -7.647 -18.006 845 HB3 LYS 10 1HB LYS 10 -10.771 -6.300 -18.859 846 HG2 LYS 10 2HG LYS 10 -10.114 -7.138 -21.042 847 HG3 LYS 10 1HG LYS 10 -9.031 -8.365 -20.311 848 HD2 LYS 10 2HD LYS 10 -11.075 -9.444 -19.205 849 HD3 LYS 10 1HD LYS 10 -12.110 -8.235 -20.016 850 HE2 LYS 10 2HE LYS 10 -12.176 -10.375 -21.270 851 HE3 LYS 10 1HE LYS 10 -11.368 -9.100 -22.272 852 HZ1 LYS 10 3HZ LYS 10 -9.821 -10.672 -22.512 853 HZ2 LYS 10 1HZ LYS 10 -10.322 -11.558 -21.146 854 HZ3 LYS 10 2HZ LYS 10 -9.298 -10.230 -20.936 855 H ALA 11 H ALA 11 -8.072 -6.675 -16.354 856 HA ALA 11 HA ALA 11 -9.467 -4.677 -15.039 857 HB1 ALA 11 1HB ALA 11 -8.147 -5.291 -13.030 858 HB2 ALA 11 2HB ALA 11 -6.910 -6.104 -14.058 859 HB3 ALA 11 3HB ALA 11 -8.578 -6.778 -13.941 860 H GLU 12 H GLU 12 -6.019 -4.756 -16.098 861 HA GLU 12 HA GLU 12 -5.293 -2.292 -14.965 862 HB2 GLU 12 2HB GLU 12 -4.250 -3.717 -17.488 863 HB3 GLU 12 1HB GLU 12 -3.467 -2.270 -16.766 864 HG2 GLU 12 2HG GLU 12 -2.953 -3.494 -14.692 865 HG3 GLU 12 1HG GLU 12 -3.803 -4.963 -15.292 866 H GLU 13 H GLU 13 -6.580 -3.166 -18.185 867 HA GLU 13 HA GLU 13 -6.335 -0.627 -19.328 868 HB2 GLU 13 2HB GLU 13 -8.371 -2.844 -19.921 869 HB3 GLU 13 1HB GLU 13 -8.079 -1.423 -20.979 870 HG2 GLU 13 2HG GLU 13 -6.028 -3.616 -20.253 871 HG3 GLU 13 1HG GLU 13 -6.937 -3.517 -21.797 872 H GLU 14 H GLU 14 -9.023 -2.151 -17.433 873 HA GLU 14 HA GLU 14 -10.593 0.167 -17.966 874 HB2 GLU 14 2HB GLU 14 -11.419 -2.327 -17.406 875 HB3 GLU 14 1HB GLU 14 -11.643 -1.555 -15.798 876 HG2 GLU 14 2HG GLU 14 -12.872 0.348 -16.955 877 HG3 GLU 14 1HG GLU 14 -12.645 -0.468 -18.540 878 H LEU 15 H LEU 15 -8.079 -0.361 -15.690 879 HA LEU 15 HA LEU 15 -9.046 1.504 -13.782 880 HB2 LEU 15 2HB LEU 15 -7.155 -0.097 -13.321 881 HB3 LEU 15 1HB LEU 15 -6.124 0.816 -14.460 882 HG LEU 15 HG LEU 15 -6.184 2.808 -13.023 883 HD11 LEU 15 1HD1 LEU 15 -8.472 2.766 -12.107 884 HD12 LEU 15 2HD1 LEU 15 -7.301 2.789 -10.759 885 HD13 LEU 15 3HD1 LEU 15 -8.125 1.248 -11.193 886 HD21 LEU 15 3HD2 LEU 15 -5.605 0.277 -11.347 887 HD22 LEU 15 1HD2 LEU 15 -4.978 1.931 -11.024 888 HD23 LEU 15 2HD2 LEU 15 -4.479 1.059 -12.518 889 H GLN 16 H GLN 16 -7.318 1.735 -16.883 890 HA GLN 16 HA GLN 16 -6.509 4.409 -16.721 891 HB2 GLN 16 2HB GLN 16 -7.466 2.919 -19.249 892 HB3 GLN 16 1HB GLN 16 -6.495 4.426 -19.217 893 HG2 GLN 16 2HG GLN 16 -4.555 3.196 -18.247 894 HG3 GLN 16 1HG GLN 16 -5.535 1.681 -18.163 895 HE21 GLN 16 1HE2 GLN 16 -4.519 0.387 -19.789 896 HE22 GLN 16 2HE2 GLN 16 -4.502 0.813 -21.446 897 H LYS 17 H LYS 17 -9.581 2.903 -17.568 898 HA LYS 17 HA LYS 17 -10.883 5.125 -18.688 899 HB2 LYS 17 2HB LYS 17 -11.649 2.664 -18.780 900 HB3 LYS 17 1HB LYS 17 -12.085 2.806 -17.053 901 HG2 LYS 17 2HG LYS 17 -13.677 4.796 -17.885 902 HG3 LYS 17 1HG LYS 17 -13.387 4.100 -19.508 903 HD2 LYS 17 2HD LYS 17 -15.425 3.131 -18.727 904 HD3 LYS 17 1HD LYS 17 -14.196 1.829 -18.529 905 HE2 LYS 17 2HE LYS 17 -14.015 2.521 -16.035 906 HE3 LYS 17 1HE LYS 17 -15.334 3.717 -16.335 907 HZ1 LYS 17 3HZ LYS 17 -16.238 1.842 -15.376 908 HZ2 LYS 17 1HZ LYS 17 -15.505 0.730 -16.445 909 HZ3 LYS 17 2HZ LYS 17 -16.758 1.766 -16.972 910 H VAL 18 H VAL 18 -10.482 3.963 -15.320 911 HA VAL 18 HA VAL 18 -12.392 5.734 -14.214 912 HB VAL 18 HB VAL 18 -10.074 4.285 -12.838 913 HG11 VAL 18 1HG1 VAL 18 -11.526 4.549 -10.777 914 HG12 VAL 18 2HG1 VAL 18 -12.657 5.590 -11.717 915 HG13 VAL 18 3HG1 VAL 18 -10.965 6.128 -11.406 916 HG21 VAL 18 3HG2 VAL 18 -11.849 2.590 -12.256 917 HG22 VAL 18 1HG2 VAL 18 -11.604 2.692 -14.024 918 HG23 VAL 18 2HG2 VAL 18 -13.038 3.480 -13.278 919 H LEU 19 H LEU 19 -8.906 5.970 -14.968 920 HA LEU 19 HA LEU 19 -8.367 8.285 -13.475 921 HB2 LEU 19 2HB LEU 19 -7.224 7.516 -16.239 922 HB3 LEU 19 1HB LEU 19 -6.543 8.764 -15.152 923 HG LEU 19 HG LEU 19 -6.715 5.765 -14.478 924 HD11 LEU 19 1HD1 LEU 19 -4.294 7.439 -15.422 925 HD12 LEU 19 2HD1 LEU 19 -5.179 6.223 -16.415 926 HD13 LEU 19 3HD1 LEU 19 -4.276 5.703 -14.944 927 HD21 LEU 19 3HD2 LEU 19 -5.272 8.115 -13.079 928 HD22 LEU 19 1HD2 LEU 19 -5.050 6.379 -12.685 929 HD23 LEU 19 2HD2 LEU 19 -6.651 7.158 -12.419 930 H GLU 20 H GLU 20 -9.743 7.831 -16.783 931 HA GLU 20 HA GLU 20 -9.676 10.588 -17.402 932 HB2 GLU 20 2HB GLU 20 -11.621 8.503 -18.564 933 HB3 GLU 20 1HB GLU 20 -11.280 10.148 -19.190 934 HG2 GLU 20 2HG GLU 20 -8.764 9.317 -19.373 935 HG3 GLU 20 1HG GLU 20 -9.470 7.661 -19.223 936 H GLU 21 H GLU 21 -12.159 8.425 -16.061 937 HA GLU 21 HA GLU 21 -14.226 10.269 -15.812 938 HB2 GLU 21 2HB GLU 21 -14.490 7.796 -15.637 939 HB3 GLU 21 1HB GLU 21 -13.507 7.789 -14.136 940 HG2 GLU 21 2HG GLU 21 -15.882 7.517 -13.599 941 HG3 GLU 21 1HG GLU 21 -15.290 9.088 -12.947 942 H ALA 22 H ALA 22 -11.543 9.418 -13.619 943 HA ALA 22 HA ALA 22 -12.273 10.810 -11.375 944 HB1 ALA 22 1HB ALA 22 -9.416 10.434 -12.484 945 HB2 ALA 22 2HB ALA 22 -10.294 9.233 -11.485 946 HB3 ALA 22 3HB ALA 22 -9.829 10.829 -10.787 947 H SER 23 H SER 23 -10.688 11.925 -14.313 948 HA SER 23 HA SER 23 -9.889 14.436 -13.350 949 HB2 SER 23 2HB SER 23 -10.557 13.677 -16.267 950 HB3 SER 23 1HB SER 23 -9.433 14.962 -15.694 951 HG SER 23 1HG SER 23 -9.169 12.108 -15.497 952 H LYS 24 H LYS 24 -12.843 13.290 -15.057 953 HA LYS 24 HA LYS 24 -14.071 15.831 -15.296 954 HB2 LYS 24 2HB LYS 24 -14.814 13.785 -16.632 955 HB3 LYS 24 1HB LYS 24 -15.360 13.031 -15.109 956 HG2 LYS 24 2HG LYS 24 -16.823 15.333 -14.941 957 HG3 LYS 24 1HG LYS 24 -16.612 15.300 -16.713 958 HD2 LYS 24 2HD LYS 24 -17.621 13.003 -16.790 959 HD3 LYS 24 1HD LYS 24 -17.699 12.955 -15.000 960 HE2 LYS 24 2HE LYS 24 -19.302 14.860 -16.850 961 HE3 LYS 24 1HE LYS 24 -19.940 13.439 -15.928 962 HZ1 LYS 24 3HZ LYS 24 -18.916 16.038 -14.873 963 HZ2 LYS 24 1HZ LYS 24 -19.170 14.689 -13.856 964 HZ3 LYS 24 2HZ LYS 24 -20.448 15.394 -14.707 965 H LYS 25 H LYS 25 -14.474 13.082 -13.020 966 HA LYS 25 HA LYS 25 -16.390 14.226 -11.400 967 HB2 LYS 25 2HB LYS 25 -14.236 12.118 -10.901 968 HB3 LYS 25 1HB LYS 25 -15.357 12.589 -9.582 969 HG2 LYS 25 2HG LYS 25 -16.570 11.808 -12.262 970 HG3 LYS 25 1HG LYS 25 -15.885 10.514 -11.223 971 HD2 LYS 25 2HD LYS 25 -17.370 10.989 -9.390 972 HD3 LYS 25 1HD LYS 25 -17.841 12.578 -10.063 973 HE2 LYS 25 2HE LYS 25 -19.640 10.799 -10.232 974 HE3 LYS 25 1HE LYS 25 -19.224 11.615 -11.790 975 HZ1 LYS 25 3HZ LYS 25 -19.531 9.253 -12.005 976 HZ2 LYS 25 1HZ LYS 25 -18.202 8.926 -10.988 977 HZ3 LYS 25 2HZ LYS 25 -18.012 9.750 -12.490 978 H ALA 26 H ALA 26 -12.789 14.291 -11.031 979 HA ALA 26 HA ALA 26 -12.885 15.699 -8.596 980 HB1 ALA 26 1HB ALA 26 -10.912 14.280 -9.204 981 HB2 ALA 26 2HB ALA 26 -10.427 15.974 -8.849 982 HB3 ALA 26 3HB ALA 26 -10.531 15.402 -10.557 983 H VAL 27 H VAL 27 -12.393 16.792 -12.055 984 HA VAL 27 HA VAL 27 -11.715 19.367 -11.152 985 HB VAL 27 HB VAL 27 -11.102 18.481 -13.396 986 HG11 VAL 27 1HG1 VAL 27 -12.589 18.638 -15.279 987 HG12 VAL 27 2HG1 VAL 27 -13.895 19.421 -14.316 988 HG13 VAL 27 3HG1 VAL 27 -13.473 17.693 -14.046 989 HG21 VAL 27 3HG2 VAL 27 -11.299 20.759 -14.463 990 HG22 VAL 27 1HG2 VAL 27 -10.740 20.834 -12.754 991 HG23 VAL 27 2HG2 VAL 27 -12.446 21.257 -13.186 992 H GLU 28 H GLU 28 -14.861 17.879 -12.209 993 HA GLU 28 HA GLU 28 -16.179 20.376 -11.795 994 HB2 GLU 28 2HB GLU 28 -17.388 17.634 -12.368 995 HB3 GLU 28 1HB GLU 28 -18.243 19.219 -12.393 996 HG2 GLU 28 2HG GLU 28 -16.503 20.008 -14.142 997 HG3 GLU 28 1HG GLU 28 -15.945 18.297 -14.243 998 H ALA 29 H ALA 29 -14.946 18.208 -9.626 999 HA ALA 29 HA ALA 29 -16.997 18.097 -7.706 1000 HB1 ALA 29 1HB ALA 29 -15.387 17.158 -6.255 1001 HB2 ALA 29 2HB ALA 29 -13.992 17.990 -7.054 1002 HB3 ALA 29 3HB ALA 29 -14.831 16.610 -7.816 1003 H GLU 30 H GLU 30 -14.128 20.224 -8.197 1004 HA GLU 30 HA GLU 30 -14.948 21.924 -6.013 1005 HB2 GLU 30 2HB GLU 30 -12.747 22.330 -8.118 1006 HB3 GLU 30 1HB GLU 30 -13.089 23.421 -6.716 1007 HG2 GLU 30 2HG GLU 30 -12.606 21.477 -5.159 1008 HG3 GLU 30 1HG GLU 30 -12.074 20.505 -6.594 1009 H ARG 31 H ARG 31 -13.843 23.731 -8.695 1010 HA ARG 31 HA ARG 31 -14.646 25.248 -9.983 1011 HB2 ARG 31 2HB ARG 31 -17.452 24.030 -9.855 1012 HB3 ARG 31 1HB ARG 31 -16.918 25.354 -10.937 1013 HG2 ARG 31 2HG ARG 31 -16.211 22.393 -11.081 1014 HG3 ARG 31 1HG ARG 31 -17.046 23.443 -12.252 1015 HD2 ARG 31 2HD ARG 31 -14.935 23.203 -13.285 1016 HD3 ARG 31 1HD ARG 31 -14.751 24.787 -12.426 1017 HE ARG 31 HE ARG 31 -14.033 22.131 -11.181 1018 HH11 ARG 31 1HH2 ARG 31 -12.695 25.382 -12.215 1019 HH12 ARG 31 2HH2 ARG 31 -11.088 24.813 -12.013 1020 HH21 ARG 31 1HH1 ARG 31 -12.027 21.729 -10.361 1021 HH22 ARG 31 2HH1 ARG 31 -10.734 22.769 -10.453 1022 H GLY 32 H GLY 32 -16.602 24.743 -7.081 1023 HA2 GLY 32 2HA GLY 32 -16.370 27.572 -6.518 1024 HA3 GLY 32 1HA GLY 32 -18.033 26.914 -6.828 1025 H ALA 33 H ALA 33 -15.198 25.329 -5.312 1026 HA ALA 33 HA ALA 33 -16.906 24.712 -3.010 1027 HB1 ALA 33 1HB ALA 33 -15.147 23.046 -2.383 1028 HB2 ALA 33 2HB ALA 33 -14.171 23.533 -3.817 1029 HB3 ALA 33 3HB ALA 33 -15.782 22.749 -4.035 1030 HA PRO 34 HA PRO 34 -14.374 27.673 -0.802 1031 HB2 PRO 34 2HB PRO 34 -14.820 27.008 1.856 1032 HB3 PRO 34 1HB PRO 34 -16.090 27.710 0.784 1033 HG2 PRO 34 2HG PRO 34 -15.648 24.755 1.467 1034 HG3 PRO 34 1HG PRO 34 -17.204 25.690 1.484 1035 HD2 PRO 34 2HD PRO 34 -16.453 24.120 -0.676 1036 HD3 PRO 34 1HD PRO 34 -17.343 25.687 -0.902 1037 H GLY 35 H GLY 35 -12.104 27.768 -0.700 1038 HA2 GLY 35 2HA GLY 35 -10.093 27.299 0.141 1039 HA3 GLY 35 1HA GLY 35 -10.772 25.899 1.053 1040 H ALA 36 H ALA 36 -11.453 26.317 -2.279 1041 HA ALA 36 HA ALA 36 -10.572 23.776 -3.067 1042 HB1 ALA 36 1HB ALA 36 -12.477 24.984 -4.168 1043 HB2 ALA 36 2HB ALA 36 -11.189 24.719 -5.392 1044 HB3 ALA 36 3HB ALA 36 -11.356 26.330 -4.629 1045 H ALA 37 H ALA 37 -9.055 23.315 -4.856 1046 HA ALA 37 HA ALA 37 -6.810 25.207 -5.068 1047 HB1 ALA 37 1HB ALA 37 -6.280 23.824 -3.029 1048 HB2 ALA 37 2HB ALA 37 -5.162 23.422 -4.388 1049 HB3 ALA 37 3HB ALA 37 -6.545 22.325 -3.980 1050 H LEU 38 H LEU 38 -8.509 22.208 -6.065 1051 HA LEU 38 HA LEU 38 -6.569 21.598 -8.119 1052 HB2 LEU 38 2HB LEU 38 -7.880 19.962 -6.530 1053 HB3 LEU 38 1HB LEU 38 -9.256 20.196 -7.630 1054 HG LEU 38 HG LEU 38 -6.453 19.163 -8.438 1055 HD11 LEU 38 1HD1 LEU 38 -7.469 16.881 -8.453 1056 HD12 LEU 38 2HD1 LEU 38 -9.005 17.558 -7.799 1057 HD13 LEU 38 3HD1 LEU 38 -7.496 17.619 -6.815 1058 HD21 LEU 38 3HD2 LEU 38 -9.103 19.071 -10.016 1059 HD22 LEU 38 1HD2 LEU 38 -7.582 18.225 -10.480 1060 HD23 LEU 38 2HD2 LEU 38 -7.636 20.022 -10.446 1061 H ILE 39 H ILE 39 -7.202 23.945 -8.778 1062 HA ILE 39 HA ILE 39 -9.753 24.387 -9.826 1063 HB ILE 39 HB ILE 39 -8.373 26.050 -8.719 1064 HG12 ILE 39 2HG1 ILE 39 -9.146 26.934 -11.564 1065 HG13 ILE 39 1HG1 ILE 39 -10.304 26.648 -10.217 1066 HG21 ILE 39 1HG2 ILE 39 -6.141 25.426 -9.670 1067 HG22 ILE 39 2HG2 ILE 39 -6.488 27.167 -9.924 1068 HG23 ILE 39 3HG2 ILE 39 -6.646 26.020 -11.293 1069 HD11 ILE 39 3HD ILE 39 -8.033 28.749 -10.240 1070 HD12 ILE 39 1HD ILE 39 -9.792 29.062 -10.419 1071 HD13 ILE 39 2HD ILE 39 -9.148 28.431 -8.858 1072 H SER 40 H SER 40 -7.060 22.821 -11.335 1073 HA SER 40 HA SER 40 -7.567 23.983 -13.936 1074 HB2 SER 40 2HB SER 40 -5.592 21.835 -12.997 1075 HB3 SER 40 1HB SER 40 -5.510 22.730 -14.563 1076 HG SER 40 1HG SER 40 -4.107 23.391 -12.802 1077 H TYR 41 H TYR 41 -8.700 22.945 -15.589 1078 HA TYR 41 HA TYR 41 -9.476 20.204 -15.415 1079 HB2 TYR 41 2HB TYR 41 -10.888 21.791 -16.724 1080 HB3 TYR 41 1HB TYR 41 -9.520 22.132 -17.824 1081 HD1 TYR 41 1HD TYR 41 -8.693 20.371 -19.404 1082 HD2 TYR 41 2HD TYR 41 -12.243 19.809 -17.042 1083 HE1 TYR 41 1HE TYR 41 -9.327 18.480 -20.828 1084 HE2 TYR 41 2HE TYR 41 -12.897 17.916 -18.476 1085 HH TYR 41 HH TYR 41 -10.752 16.679 -21.084 1086 HA PRO 42 HA PRO 42 -6.226 19.294 -18.534 1087 HB2 PRO 42 2HB PRO 42 -3.943 20.893 -19.014 1088 HB3 PRO 42 1HB PRO 42 -5.506 21.083 -19.897 1089 HG2 PRO 42 2HG PRO 42 -4.550 22.629 -17.421 1090 HG3 PRO 42 1HG PRO 42 -5.225 23.303 -18.963 1091 HD2 PRO 42 2HD PRO 42 -6.838 22.961 -16.791 1092 HD3 PRO 42 1HD PRO 42 -7.448 22.485 -18.440 1093 H ASP 43 H ASP 43 -5.359 20.642 -15.459 1094 HA ASP 43 HA ASP 43 -3.031 18.895 -15.237 1095 HB2 ASP 43 2HB ASP 43 -4.097 20.447 -12.848 1096 HB3 ASP 43 1HB ASP 43 -2.463 19.816 -13.156 1097 H ALA 44 H ALA 44 -6.458 18.750 -14.862 1098 HA ALA 44 HA ALA 44 -6.661 17.482 -12.373 1099 HB1 ALA 44 1HB ALA 44 -8.568 17.251 -14.794 1100 HB2 ALA 44 2HB ALA 44 -8.681 18.476 -13.482 1101 HB3 ALA 44 3HB ALA 44 -8.943 16.744 -13.105 1102 H ILE 45 H ILE 45 -6.302 16.290 -15.697 1103 HA ILE 45 HA ILE 45 -6.518 13.577 -15.042 1104 HB ILE 45 HB ILE 45 -6.988 14.419 -17.248 1105 HG12 ILE 45 2HG1 ILE 45 -4.589 12.491 -17.342 1106 HG13 ILE 45 1HG1 ILE 45 -6.281 12.051 -16.939 1107 HG21 ILE 45 1HG2 ILE 45 -5.214 15.265 -18.775 1108 HG22 ILE 45 2HG2 ILE 45 -3.980 15.098 -17.482 1109 HG23 ILE 45 3HG2 ILE 45 -5.315 16.298 -17.321 1110 HD11 ILE 45 3HD ILE 45 -5.304 13.210 -19.640 1111 HD12 ILE 45 1HD ILE 45 -5.827 11.521 -19.309 1112 HD13 ILE 45 2HD ILE 45 -7.025 12.862 -19.221 1113 H TRP 46 H TRP 46 -3.876 15.815 -14.721 1114 HA TRP 46 HA TRP 46 -1.825 13.812 -14.679 1115 HB2 TRP 46 2HB TRP 46 -1.898 16.629 -14.939 1116 HB3 TRP 46 1HB TRP 46 -1.236 16.424 -13.297 1117 HD1 TRP 46 HD TRP 46 1.445 16.052 -13.324 1118 HE1 TRP 46 1HE TRP 46 3.174 15.866 -15.209 1119 HE3 TRP 46 3HE TRP 46 -1.768 15.259 -17.202 1120 HZ2 TRP 46 2HZ TRP 46 3.162 15.313 -18.023 1121 HZ3 TRP 46 3HZ TRP 46 -0.862 14.932 -19.482 1122 HH2 TRP 46 HH TRP 46 1.577 14.962 -19.886 1123 H TRP 47 H TRP 47 -3.868 15.591 -12.353 1124 HA TRP 47 HA TRP 47 -2.571 14.675 -10.019 1125 HB2 TRP 47 2HB TRP 47 -4.122 16.651 -10.029 1126 HB3 TRP 47 1HB TRP 47 -5.500 15.565 -10.420 1127 HD1 TRP 47 HD TRP 47 -2.984 16.212 -7.445 1128 HE1 TRP 47 1HE TRP 47 -4.044 15.317 -5.303 1129 HE3 TRP 47 3HE TRP 47 -7.160 14.124 -9.493 1130 HZ2 TRP 47 2HZ TRP 47 -6.486 14.034 -4.533 1131 HZ3 TRP 47 3HZ TRP 47 -8.802 13.016 -8.014 1132 HH2 TRP 47 HH TRP 47 -8.472 12.971 -5.563 1133 H SER 48 H SER 48 -5.398 13.478 -11.907 1134 HA SER 48 HA SER 48 -6.221 11.446 -10.351 1135 HB2 SER 48 2HB SER 48 -5.980 11.433 -13.424 1136 HB3 SER 48 1HB SER 48 -7.083 10.384 -12.456 1137 HG SER 48 1HG SER 48 -7.881 12.476 -13.407 1138 H VAL 49 H VAL 49 -3.260 11.480 -12.326 1139 HA VAL 49 HA VAL 49 -2.868 8.743 -12.567 1140 HB VAL 49 HB VAL 49 -0.705 10.897 -12.289 1141 HG11 VAL 49 1HG1 VAL 49 0.627 9.292 -13.736 1142 HG12 VAL 49 2HG1 VAL 49 -0.700 8.089 -13.612 1143 HG13 VAL 49 3HG1 VAL 49 0.222 8.570 -12.143 1144 HG21 VAL 49 3HG2 VAL 49 -2.273 11.583 -14.049 1145 HG22 VAL 49 1HG2 VAL 49 -2.324 9.918 -14.743 1146 HG23 VAL 49 2HG2 VAL 49 -0.818 10.906 -14.837 1147 H GLU 50 H GLU 50 -2.289 10.937 -9.773 1148 HA GLU 50 HA GLU 50 -0.444 9.125 -8.566 1149 HB2 GLU 50 2HB GLU 50 -2.037 11.436 -7.270 1150 HB3 GLU 50 1HB GLU 50 -0.668 10.540 -6.525 1151 HG2 GLU 50 2HG GLU 50 0.812 11.347 -8.441 1152 HG3 GLU 50 1HG GLU 50 -0.550 12.412 -8.971 1153 H THR 51 H THR 51 -3.937 9.662 -8.275 1154 HA THR 51 HA THR 51 -4.005 8.491 -5.673 1155 HB THR 51 HB THR 51 -5.433 10.298 -5.952 1156 HG1 THR 51 1HG THR 51 -6.484 8.577 -4.921 1157 HG21 THR 51 3HG2 THR 51 -5.514 10.532 -8.374 1158 HG22 THR 51 1HG2 THR 51 -7.194 10.415 -7.777 1159 HG23 THR 51 2HG2 THR 51 -6.429 8.985 -8.562 1160 H ALA 52 H ALA 52 -4.646 7.332 -8.987 1161 HA ALA 52 HA ALA 52 -5.966 4.973 -8.145 1162 HB1 ALA 52 1HB ALA 52 -5.574 4.165 -10.485 1163 HB2 ALA 52 2HB ALA 52 -4.446 5.543 -10.761 1164 HB3 ALA 52 3HB ALA 52 -6.204 5.850 -10.473 1165 H THR 53 H THR 53 -2.488 5.809 -8.494 1166 HA THR 53 HA THR 53 -1.743 3.025 -8.292 1167 HB THR 53 HB THR 53 0.604 4.167 -8.224 1168 HG1 THR 53 1HG THR 53 -0.191 6.272 -7.732 1169 HG21 THR 53 3HG2 THR 53 -1.291 4.564 -10.651 1170 HG22 THR 53 1HG2 THR 53 -0.421 3.037 -10.232 1171 HG23 THR 53 2HG2 THR 53 0.509 4.509 -10.699 1172 H THR 54 H THR 54 -3.112 4.947 -6.056 1173 HA THR 54 HA THR 54 -2.985 5.322 -3.935 1174 HB THR 54 HB THR 54 -1.998 3.342 -2.465 1175 HG1 THR 54 1HG THR 54 -1.091 2.423 -4.456 1176 HG21 THR 54 3HG2 THR 54 -4.196 2.226 -2.750 1177 HG22 THR 54 1HG2 THR 54 -4.504 3.141 -4.278 1178 HG23 THR 54 2HG2 THR 54 -4.388 4.009 -2.694 1179 H VAL 55 H VAL 55 -1.466 7.078 -4.656 1180 HA VAL 55 HA VAL 55 1.020 6.840 -3.095 1181 HB VAL 55 HB VAL 55 0.542 8.509 -5.650 1182 HG11 VAL 55 1HG1 VAL 55 3.031 8.806 -5.524 1183 HG12 VAL 55 2HG1 VAL 55 3.104 7.789 -4.041 1184 HG13 VAL 55 3HG1 VAL 55 2.306 9.391 -3.986 1185 HG21 VAL 55 3HG2 VAL 55 1.891 6.827 -6.825 1186 HG22 VAL 55 1HG2 VAL 55 0.466 6.033 -6.134 1187 HG23 VAL 55 2HG2 VAL 55 2.046 5.845 -5.319 1188 H GLY 56 H GLY 56 0.130 9.857 -4.518 1189 HA2 GLY 56 2HA GLY 56 -1.262 11.500 -3.722 1190 HA3 GLY 56 1HA GLY 56 -1.357 10.669 -2.101 1191 H TYR 57 H TYR 57 0.790 12.375 -4.447 1192 HA TYR 57 HA TYR 57 3.004 12.257 -2.580 1193 HB2 TYR 57 2HB TYR 57 2.604 13.163 -5.418 1194 HB3 TYR 57 1HB TYR 57 3.570 14.363 -4.502 1195 HD1 TYR 57 2HD TYR 57 5.668 13.696 -3.334 1196 HD2 TYR 57 1HD TYR 57 3.529 11.009 -5.914 1197 HE1 TYR 57 2HE TYR 57 7.608 12.171 -3.339 1198 HE2 TYR 57 1HE TYR 57 5.455 9.462 -5.892 1199 HH TYR 57 HH TYR 57 8.538 10.092 -4.727 1200 H GLY 58 H GLY 58 0.445 14.479 -3.497 1201 HA2 GLY 58 2HA GLY 58 -0.237 16.007 -1.759 1202 HA3 GLY 58 1HA GLY 58 1.474 16.370 -1.452 1203 H ASP 59 H ASP 59 -0.183 16.007 -4.668 1204 HA ASP 59 HA ASP 59 1.158 18.431 -5.450 1205 HB2 ASP 59 2HB ASP 59 0.587 16.390 -7.029 1206 HB3 ASP 59 1HB ASP 59 -1.031 17.115 -7.161 1207 H ARG 60 H ARG 60 -2.285 17.344 -4.889 1208 HA ARG 60 HA ARG 60 -3.001 20.162 -4.595 1209 HB2 ARG 60 2HB ARG 60 -4.739 18.144 -6.142 1210 HB3 ARG 60 1HB ARG 60 -5.102 19.879 -5.872 1211 HG2 ARG 60 2HG ARG 60 -2.779 18.732 -7.543 1212 HG3 ARG 60 1HG ARG 60 -4.335 19.291 -8.216 1213 HD2 ARG 60 2HD ARG 60 -3.885 21.630 -7.629 1214 HD3 ARG 60 1HD ARG 60 -2.407 21.179 -6.678 1215 HE ARG 60 HE ARG 60 -1.494 20.149 -8.806 1216 HH11 ARG 60 1HH2 ARG 60 -2.917 23.362 -8.466 1217 HH12 ARG 60 2HH2 ARG 60 -2.569 23.902 -10.026 1218 HH21 ARG 60 1HH1 ARG 60 -1.064 20.814 -11.033 1219 HH22 ARG 60 2HH1 ARG 60 -1.829 22.177 -11.726 1220 H TYR 61 H TYR 61 -5.210 20.242 -3.346 1221 HA TYR 61 HA TYR 61 -5.275 17.927 -1.556 1222 HB2 TYR 61 2HB TYR 61 -5.228 20.897 -0.723 1223 HB3 TYR 61 1HB TYR 61 -5.515 19.492 0.370 1224 HD1 TYR 61 2HD TYR 61 -3.000 21.122 -1.878 1225 HD2 TYR 61 1HD TYR 61 -3.655 18.095 1.110 1226 HE1 TYR 61 2HE TYR 61 -0.580 20.681 -1.802 1227 HE2 TYR 61 1HE TYR 61 -1.234 17.688 1.230 1228 HH TYR 61 HH TYR 61 0.924 18.844 -1.198 1229 HA PRO 62 HA PRO 62 -9.492 19.134 -2.889 1230 HB2 PRO 62 2HB PRO 62 -10.824 16.793 -2.111 1231 HB3 PRO 62 1HB PRO 62 -9.758 16.830 -3.565 1232 HG2 PRO 62 2HG PRO 62 -9.088 15.890 -0.720 1233 HG3 PRO 62 1HG PRO 62 -8.765 15.030 -2.284 1234 HD2 PRO 62 2HD PRO 62 -6.882 16.614 -0.948 1235 HD3 PRO 62 1HD PRO 62 -6.896 16.470 -2.767 1236 H VAL 63 H VAL 63 -11.726 19.092 -1.538 1237 HA VAL 63 HA VAL 63 -11.058 19.752 1.241 1238 HB VAL 63 HB VAL 63 -12.925 21.506 1.080 1239 HG11 VAL 63 1HG1 VAL 63 -10.228 21.878 -0.369 1240 HG12 VAL 63 2HG1 VAL 63 -10.523 21.977 1.403 1241 HG13 VAL 63 3HG1 VAL 63 -11.274 23.179 0.305 1242 HG21 VAL 63 3HG2 VAL 63 -13.191 22.557 -1.165 1243 HG22 VAL 63 1HG2 VAL 63 -13.809 20.873 -1.269 1244 HG23 VAL 63 2HG2 VAL 63 -12.189 21.294 -1.943 1245 H THR 64 H THR 64 -14.343 20.106 0.358 1246 HA THR 64 HA THR 64 -14.993 17.517 1.585 1247 HB THR 64 HB THR 64 -16.059 20.270 2.468 1248 HG1 THR 64 1HG THR 64 -13.899 19.678 3.125 1249 HG21 THR 64 3HG2 THR 64 -17.188 19.043 4.317 1250 HG22 THR 64 1HG2 THR 64 -16.589 17.473 3.691 1251 HG23 THR 64 2HG2 THR 64 -17.785 18.423 2.740 1252 H GLU 65 H GLU 65 -16.054 20.489 -0.137 1253 HA GLU 65 HA GLU 65 -18.595 19.375 -0.717 1254 HB2 GLU 65 2HB GLU 65 -17.809 21.848 -0.219 1255 HB3 GLU 65 1HB GLU 65 -17.498 21.932 -1.983 1256 HG2 GLU 65 2HG GLU 65 -19.847 21.666 -2.481 1257 HG3 GLU 65 1HG GLU 65 -20.204 20.960 -0.862 1258 H GLU 66 H GLU 66 -15.584 18.666 -1.896 1259 HA GLU 66 HA GLU 66 -16.308 18.394 -4.671 1260 HB2 GLU 66 2HB GLU 66 -13.983 17.071 -4.577 1261 HB3 GLU 66 1HB GLU 66 -14.063 18.859 -4.652 1262 HG2 GLU 66 2HG GLU 66 -12.378 18.223 -3.062 1263 HG3 GLU 66 1HG GLU 66 -13.731 18.977 -2.144 1264 H GLY 67 H GLY 67 -16.041 16.623 -1.667 1265 HA2 GLY 67 2HA GLY 67 -17.576 15.090 -0.964 1266 HA3 GLY 67 1HA GLY 67 -17.961 14.665 -2.691 1267 H ARG 68 H ARG 68 -15.073 14.961 -0.559 1268 HA ARG 68 HA ARG 68 -13.223 13.696 -1.510 1269 HB2 ARG 68 2HB ARG 68 -13.450 14.537 0.897 1270 HB3 ARG 68 1HB ARG 68 -13.854 12.835 1.346 1271 HG2 ARG 68 2HG ARG 68 -11.562 12.210 0.206 1272 HG3 ARG 68 1HG ARG 68 -11.264 13.968 0.089 1273 HD2 ARG 68 2HD ARG 68 -11.602 12.275 2.669 1274 HD3 ARG 68 1HD ARG 68 -10.077 13.016 2.047 1275 HE ARG 68 HE ARG 68 -12.453 14.410 3.251 1276 HH11 ARG 68 1HH2 ARG 68 -8.839 14.620 2.531 1277 HH12 ARG 68 2HH2 ARG 68 -8.890 16.301 2.714 1278 HH21 ARG 68 1HH1 ARG 68 -11.991 17.036 2.975 1279 HH22 ARG 68 2HH1 ARG 68 -10.507 17.333 3.674 1280 H LYS 69 H LYS 69 -16.023 11.786 -0.984 1281 HA LYS 69 HA LYS 69 -14.943 9.220 -1.361 1282 HB2 LYS 69 2HB LYS 69 -17.573 10.460 -2.337 1283 HB3 LYS 69 1HB LYS 69 -17.079 8.774 -2.709 1284 HG2 LYS 69 2HG LYS 69 -16.867 8.283 -0.255 1285 HG3 LYS 69 1HG LYS 69 -17.698 9.847 0.094 1286 HD2 LYS 69 2HD LYS 69 -19.659 9.108 -1.274 1287 HD3 LYS 69 1HD LYS 69 -18.734 7.670 -1.829 1288 HE2 LYS 69 2HE LYS 69 -18.722 6.776 0.558 1289 HE3 LYS 69 1HE LYS 69 -19.831 8.135 1.025 1290 HZ1 LYS 69 3HZ LYS 69 -21.125 6.177 0.455 1291 HZ2 LYS 69 1HZ LYS 69 -20.288 6.016 -1.014 1292 HZ3 LYS 69 2HZ LYS 69 -21.334 7.354 -0.755 1293 H VAL 70 H VAL 70 -15.001 12.039 -3.494 1294 HA VAL 70 HA VAL 70 -14.714 10.694 -5.907 1295 HB VAL 70 HB VAL 70 -13.755 13.436 -4.993 1296 HG11 VAL 70 1HG1 VAL 70 -12.218 12.766 -6.840 1297 HG12 VAL 70 2HG1 VAL 70 -13.430 13.936 -7.451 1298 HG13 VAL 70 3HG1 VAL 70 -13.613 12.187 -7.832 1299 HG21 VAL 70 3HG2 VAL 70 -16.261 13.025 -5.183 1300 HG22 VAL 70 1HG2 VAL 70 -16.033 12.470 -6.876 1301 HG23 VAL 70 2HG2 VAL 70 -15.674 14.179 -6.421 1302 H ALA 71 H ALA 71 -12.318 11.683 -3.436 1303 HA ALA 71 HA ALA 71 -10.060 10.733 -4.887 1304 HB1 ALA 71 1HB ALA 71 -8.839 10.963 -2.704 1305 HB2 ALA 71 2HB ALA 71 -10.403 11.248 -1.855 1306 HB3 ALA 71 3HB ALA 71 -9.797 12.446 -3.055 1307 H GLU 72 H GLU 72 -12.088 9.495 -2.191 1308 HA GLU 72 HA GLU 72 -10.793 7.102 -1.786 1309 HB2 GLU 72 2HB GLU 72 -12.631 8.006 -0.318 1310 HB3 GLU 72 1HB GLU 72 -13.828 7.561 -1.573 1311 HG2 GLU 72 2HG GLU 72 -12.034 5.291 -0.718 1312 HG3 GLU 72 1HG GLU 72 -12.980 6.008 0.628 1313 H GLN 73 H GLN 73 -13.526 7.777 -4.086 1314 HA GLN 73 HA GLN 73 -13.698 5.103 -4.765 1315 HB2 GLN 73 2HB GLN 73 -15.543 6.763 -5.118 1316 HB3 GLN 73 1HB GLN 73 -14.615 7.474 -6.475 1317 HG2 GLN 73 2HG GLN 73 -16.432 5.952 -7.260 1318 HG3 GLN 73 1HG GLN 73 -14.826 5.313 -7.758 1319 HE21 GLN 73 1HE2 GLN 73 -14.020 3.361 -6.673 1320 HE22 GLN 73 2HE2 GLN 73 -15.075 2.352 -5.736 1321 H VAL 74 H VAL 74 -11.706 7.696 -6.249 1322 HA VAL 74 HA VAL 74 -11.036 6.059 -8.524 1323 HB VAL 74 HB VAL 74 -9.696 8.565 -7.376 1324 HG11 VAL 74 1HG1 VAL 74 -8.087 7.286 -8.804 1325 HG12 VAL 74 2HG1 VAL 74 -8.648 8.749 -9.671 1326 HG13 VAL 74 3HG1 VAL 74 -9.320 7.133 -10.107 1327 HG21 VAL 74 3HG2 VAL 74 -10.970 9.764 -9.114 1328 HG22 VAL 74 1HG2 VAL 74 -12.126 8.811 -8.139 1329 HG23 VAL 74 2HG2 VAL 74 -11.643 8.216 -9.765 1330 H MET 75 H MET 75 -9.562 6.948 -5.367 1331 HA MET 75 HA MET 75 -7.161 5.639 -5.731 1332 HB2 MET 75 2HB MET 75 -7.765 7.332 -3.943 1333 HB3 MET 75 1HB MET 75 -8.714 6.077 -3.101 1334 HG2 MET 75 2HG MET 75 -6.711 4.825 -2.546 1335 HG3 MET 75 1HG MET 75 -5.745 5.689 -3.773 1336 HE1 MET 75 3HE MET 75 -7.886 6.107 -0.545 1337 HE2 MET 75 1HE MET 75 -8.320 7.668 -1.329 1338 HE3 MET 75 2HE MET 75 -7.329 7.659 0.166 1339 H LYS 76 H LYS 76 -10.197 4.500 -4.118 1340 HA LYS 76 HA LYS 76 -9.149 1.977 -3.492 1341 HB2 LYS 76 2HB LYS 76 -11.195 3.023 -2.382 1342 HB3 LYS 76 1HB LYS 76 -12.118 2.678 -3.877 1343 HG2 LYS 76 2HG LYS 76 -11.647 0.194 -3.535 1344 HG3 LYS 76 1HG LYS 76 -10.755 0.609 -2.025 1345 HD2 LYS 76 2HD LYS 76 -12.902 1.692 -1.159 1346 HD3 LYS 76 1HD LYS 76 -13.757 1.087 -2.609 1347 HE2 LYS 76 2HE LYS 76 -12.395 -0.665 -0.434 1348 HE3 LYS 76 1HE LYS 76 -14.159 -0.332 -0.594 1349 HZ1 LYS 76 3HZ LYS 76 -13.850 -1.395 -2.944 1350 HZ2 LYS 76 1HZ LYS 76 -13.911 -2.378 -1.543 1351 HZ3 LYS 76 2HZ LYS 76 -12.440 -2.016 -2.300 1352 H ALA 77 H ALA 77 -10.686 3.285 -6.430 1353 HA ALA 77 HA ALA 77 -11.373 0.807 -7.560 1354 HB1 ALA 77 1HB ALA 77 -11.330 1.962 -9.788 1355 HB2 ALA 77 2HB ALA 77 -10.546 3.392 -9.017 1356 HB3 ALA 77 3HB ALA 77 -12.230 2.928 -8.568 1357 H GLY 78 H GLY 78 -8.296 2.576 -7.383 1358 HA2 GLY 78 2HA GLY 78 -6.899 1.017 -9.293 1359 HA3 GLY 78 1HA GLY 78 -6.237 1.994 -7.926 1360 H ILE 79 H ILE 79 -7.305 0.786 -5.748 1361 HA ILE 79 HA ILE 79 -5.618 -1.380 -5.369 1362 HB ILE 79 HB ILE 79 -8.139 -0.772 -3.738 1363 HG12 ILE 79 2HG1 ILE 79 -5.302 0.413 -3.487 1364 HG13 ILE 79 1HG1 ILE 79 -6.764 1.302 -4.011 1365 HG21 ILE 79 1HG2 ILE 79 -5.453 -2.141 -2.998 1366 HG22 ILE 79 2HG2 ILE 79 -7.011 -3.001 -3.252 1367 HG23 ILE 79 3HG2 ILE 79 -6.834 -1.871 -1.879 1368 HD11 ILE 79 3HD ILE 79 -6.254 0.130 -1.206 1369 HD12 ILE 79 1HD ILE 79 -6.348 1.856 -1.681 1370 HD13 ILE 79 2HD ILE 79 -7.830 0.832 -1.741 1371 H GLU 80 H GLU 80 -9.163 -1.264 -6.063 1372 HA GLU 80 HA GLU 80 -9.541 -4.029 -5.795 1373 HB2 GLU 80 2HB GLU 80 -11.143 -2.018 -7.483 1374 HB3 GLU 80 1HB GLU 80 -11.655 -3.710 -7.149 1375 HG2 GLU 80 2HG GLU 80 -11.695 -3.241 -4.692 1376 HG3 GLU 80 1HG GLU 80 -11.210 -1.538 -5.010 1377 H VAL 81 H VAL 81 -8.288 -2.142 -8.505 1378 HA VAL 81 HA VAL 81 -8.553 -4.240 -10.429 1379 HB VAL 81 HB VAL 81 -7.052 -1.596 -10.284 1380 HG11 VAL 81 1HG1 VAL 81 -6.780 -3.734 -12.494 1381 HG12 VAL 81 2HG1 VAL 81 -5.464 -2.995 -11.513 1382 HG13 VAL 81 3HG1 VAL 81 -6.359 -1.999 -12.702 1383 HG21 VAL 81 3HG2 VAL 81 -8.641 -1.027 -12.115 1384 HG22 VAL 81 1HG2 VAL 81 -9.547 -1.660 -10.702 1385 HG23 VAL 81 2HG2 VAL 81 -9.268 -2.714 -12.139 1386 H PHE 82 H PHE 82 -5.803 -2.929 -8.456 1387 HA PHE 82 HA PHE 82 -3.958 -4.807 -9.377 1388 HB2 PHE 82 2HB PHE 82 -3.965 -3.481 -6.586 1389 HB3 PHE 82 1HB PHE 82 -2.534 -4.173 -7.429 1390 HD1 PHE 82 1HD PHE 82 -3.102 -2.926 -10.262 1391 HD2 PHE 82 2HD PHE 82 -3.176 -1.322 -6.261 1392 HE1 PHE 82 1HE PHE 82 -2.685 -0.670 -11.150 1393 HE2 PHE 82 2HE PHE 82 -2.752 0.931 -7.162 1394 HZ PHE 82 HZ PHE 82 -2.526 1.271 -9.610 1395 H ALA 83 H ALA 83 -6.104 -4.831 -6.522 1396 HA ALA 83 HA ALA 83 -5.157 -7.139 -5.336 1397 HB1 ALA 83 1HB ALA 83 -7.367 -7.234 -4.152 1398 HB2 ALA 83 2HB ALA 83 -8.046 -6.044 -5.333 1399 HB3 ALA 83 3HB ALA 83 -6.739 -5.552 -4.198 1400 H LEU 84 H LEU 84 -7.506 -6.697 -7.997 1401 HA LEU 84 HA LEU 84 -8.536 -9.323 -7.922 1402 HB2 LEU 84 2HB LEU 84 -9.658 -7.402 -9.032 1403 HB3 LEU 84 1HB LEU 84 -8.387 -7.346 -10.284 1404 HG LEU 84 HG LEU 84 -9.894 -9.964 -9.867 1405 HD11 LEU 84 1HD1 LEU 84 -11.163 -7.529 -11.278 1406 HD12 LEU 84 2HD1 LEU 84 -11.719 -8.283 -9.738 1407 HD13 LEU 84 3HD1 LEU 84 -11.809 -9.206 -11.278 1408 HD21 LEU 84 3HD2 LEU 84 -8.985 -8.474 -12.426 1409 HD22 LEU 84 1HD2 LEU 84 -9.774 -10.090 -12.372 1410 HD23 LEU 84 2HD2 LEU 84 -8.140 -9.869 -11.662 1411 H VAL 85 H VAL 85 -5.680 -7.843 -9.426 1412 HA VAL 85 HA VAL 85 -5.069 -9.979 -11.150 1413 HB VAL 85 HB VAL 85 -3.255 -7.816 -9.978 1414 HG11 VAL 85 1HG1 VAL 85 -1.838 -8.256 -12.045 1415 HG12 VAL 85 2HG1 VAL 85 -2.797 -9.751 -12.352 1416 HG13 VAL 85 3HG1 VAL 85 -1.801 -9.594 -10.855 1417 HG21 VAL 85 3HG2 VAL 85 -5.196 -6.896 -11.274 1418 HG22 VAL 85 1HG2 VAL 85 -4.847 -8.007 -12.636 1419 HG23 VAL 85 2HG2 VAL 85 -3.682 -6.702 -12.205 1420 H THR 86 H THR 86 -4.968 -9.832 -7.685 1421 HA THR 86 HA THR 86 -2.843 -11.541 -7.216 1422 HB THR 86 HB THR 86 -5.416 -11.485 -5.590 1423 HG1 THR 86 1HG THR 86 -4.871 -9.473 -5.595 1424 HG21 THR 86 3HG2 THR 86 -3.792 -11.928 -3.698 1425 HG22 THR 86 1HG2 THR 86 -2.436 -12.026 -4.875 1426 HG23 THR 86 2HG2 THR 86 -3.748 -13.267 -4.898 1427 H ALA 87 H ALA 87 -5.965 -12.208 -8.682 1428 HA ALA 87 HA ALA 87 -6.041 -14.996 -8.313 1429 HB1 ALA 87 1HB ALA 87 -7.942 -13.632 -9.290 1430 HB2 ALA 87 2HB ALA 87 -7.486 -14.989 -10.370 1431 HB3 ALA 87 3HB ALA 87 -6.951 -13.307 -10.743 1432 H ALA 88 H ALA 88 -4.034 -12.920 -10.337 1433 HA ALA 88 HA ALA 88 -3.175 -15.093 -12.047 1434 HB1 ALA 88 1HB ALA 88 -1.567 -13.422 -13.015 1435 HB2 ALA 88 2HB ALA 88 -2.048 -12.224 -11.773 1436 HB3 ALA 88 3HB ALA 88 -3.239 -12.737 -13.016 1437 H LEU 89 H LEU 89 -2.007 -13.051 -9.380 1438 HA LEU 89 HA LEU 89 0.561 -14.073 -9.260 1439 HB2 LEU 89 2HB LEU 89 -1.123 -12.960 -6.939 1440 HB3 LEU 89 1HB LEU 89 0.658 -13.151 -6.933 1441 HG LEU 89 HG LEU 89 -0.917 -11.305 -8.838 1442 HD11 LEU 89 1HD1 LEU 89 -0.036 -9.435 -7.473 1443 HD12 LEU 89 2HD1 LEU 89 0.736 -10.595 -6.332 1444 HD13 LEU 89 3HD1 LEU 89 -1.055 -10.521 -6.471 1445 HD21 LEU 89 3HD2 LEU 89 2.123 -11.593 -8.379 1446 HD22 LEU 89 1HD2 LEU 89 1.327 -10.305 -9.352 1447 HD23 LEU 89 2HD2 LEU 89 1.223 -12.016 -9.886 1448 H ALA 90 H ALA 90 -2.415 -15.181 -7.649 1449 HA ALA 90 HA ALA 90 -1.161 -16.951 -5.911 1450 HB1 ALA 90 1HB ALA 90 -3.410 -17.966 -5.617 1451 HB2 ALA 90 2HB ALA 90 -3.991 -17.098 -7.097 1452 HB3 ALA 90 3HB ALA 90 -3.514 -16.169 -5.629 1453 H THR 91 H THR 91 -1.692 -17.318 -9.411 1454 HA THR 91 HA THR 91 -1.304 -20.202 -9.055 1455 HB THR 91 HB THR 91 -2.169 -20.745 -10.936 1456 HG1 THR 91 1HG THR 91 -0.476 -19.844 -12.158 1457 HG21 THR 91 3HG2 THR 91 -3.105 -17.791 -11.035 1458 HG22 THR 91 1HG2 THR 91 -3.700 -19.014 -9.874 1459 HG23 THR 91 2HG2 THR 91 -3.993 -19.256 -11.629 1460 H ASP 92 H ASP 92 0.680 -17.408 -9.101 1461 HA ASP 92 HA ASP 92 2.355 -18.548 -11.113 1462 HB2 ASP 92 2HB ASP 92 2.100 -15.893 -10.276 1463 HB3 ASP 92 1HB ASP 92 3.753 -16.362 -9.734 1464 H PHE 93 H PHE 93 2.036 -19.159 -7.812 1465 HA PHE 93 HA PHE 93 4.712 -20.208 -7.588 1466 HB2 PHE 93 2HB PHE 93 4.236 -21.030 -5.476 1467 HB3 PHE 93 1HB PHE 93 3.263 -19.539 -5.544 1468 HD1 PHE 93 2HD PHE 93 3.181 -23.241 -5.424 1469 HD2 PHE 93 1HD PHE 93 0.784 -19.686 -5.596 1470 HE1 PHE 93 2HE PHE 93 1.214 -24.535 -4.650 1471 HE2 PHE 93 1HE PHE 93 -1.184 -20.973 -4.851 1472 HZ PHE 93 HZ PHE 93 -0.972 -23.399 -4.356 1473 H VAL 94 H VAL 94 1.588 -21.306 -8.819 1474 HA VAL 94 HA VAL 94 2.024 -24.060 -8.492 1475 HB VAL 94 HB VAL 94 0.126 -22.662 -10.443 1476 HG11 VAL 94 1HG1 VAL 94 0.105 -25.491 -9.168 1477 HG12 VAL 94 2HG1 VAL 94 0.364 -25.112 -10.909 1478 HG13 VAL 94 3HG1 VAL 94 -1.227 -24.786 -10.148 1479 HG21 VAL 94 3HG2 VAL 94 -0.195 -21.812 -8.071 1480 HG22 VAL 94 1HG2 VAL 94 -0.251 -23.506 -7.482 1481 HG23 VAL 94 2HG2 VAL 94 -1.547 -22.883 -8.556 1482 H ARG 95 H ARG 95 3.075 -21.700 -10.785 1483 HA ARG 95 HA ARG 95 3.741 -23.192 -13.020 1484 HB2 ARG 95 2HB ARG 95 5.387 -20.948 -11.702 1485 HB3 ARG 95 1HB ARG 95 5.539 -21.457 -13.408 1486 HG2 ARG 95 2HG ARG 95 2.887 -20.305 -12.336 1487 HG3 ARG 95 1HG ARG 95 4.306 -19.262 -12.666 1488 HD2 ARG 95 2HD ARG 95 4.356 -20.075 -15.066 1489 HD3 ARG 95 1HD ARG 95 2.795 -20.959 -14.762 1490 HE ARG 95 HE ARG 95 2.698 -18.124 -13.897 1491 HH11 ARG 95 1HH2 ARG 95 2.908 -19.998 -16.983 1492 HH12 ARG 95 2HH2 ARG 95 2.163 -18.793 -17.894 1493 HH21 ARG 95 1HH1 ARG 95 1.577 -16.532 -15.195 1494 HH22 ARG 95 2HH1 ARG 95 1.259 -16.754 -16.852 1495 H ARG 96 H ARG 96 5.209 -23.243 -9.771 1496 HA ARG 96 HA ARG 96 7.762 -24.103 -10.533 1497 HB2 ARG 96 2HB ARG 96 8.185 -24.682 -8.262 1498 HB3 ARG 96 1HB ARG 96 7.094 -23.264 -8.202 1499 HG2 ARG 96 2HG ARG 96 5.144 -24.949 -7.880 1500 HG3 ARG 96 1HG ARG 96 6.395 -26.227 -7.692 1501 HD2 ARG 96 2HD ARG 96 7.368 -24.936 -5.716 1502 HD3 ARG 96 1HD ARG 96 6.021 -23.745 -5.884 1503 HE ARG 96 HE ARG 96 4.394 -25.557 -5.451 1504 HH11 ARG 96 1HH2 ARG 96 7.791 -26.369 -4.495 1505 HH12 ARG 96 2HH2 ARG 96 7.343 -27.592 -3.397 1506 HH21 ARG 96 1HH1 ARG 96 3.775 -27.324 -3.953 1507 HH22 ARG 96 2HH1 ARG 96 5.004 -28.215 -3.184 1508 H GLU 97 H GLU 97 4.674 -25.763 -10.547 1509 HA GLU 97 HA GLU 97 5.746 -28.367 -10.138 1510 HB2 GLU 97 2HB GLU 97 3.335 -27.855 -9.685 1511 HB3 GLU 97 1HB GLU 97 3.064 -27.658 -11.448 1512 HG2 GLU 97 2HG GLU 97 3.616 -30.035 -11.857 1513 HG3 GLU 97 1HG GLU 97 4.219 -30.234 -10.176 1514 H GLU 98 H GLU 98 5.120 -26.250 -12.905 1515 HA GLU 98 HA GLU 98 5.608 -28.129 -14.931 1516 HB2 GLU 98 2HB GLU 98 6.076 -25.077 -14.889 1517 HB3 GLU 98 1HB GLU 98 6.123 -26.088 -16.361 1518 HG2 GLU 98 2HG GLU 98 3.596 -25.863 -14.575 1519 HG3 GLU 98 1HG GLU 98 3.975 -24.723 -15.915 1520 H GLU 99 H GLU 99 7.733 -25.632 -13.338 1521 HA GLU 99 HA GLU 99 10.011 -26.246 -14.698 1522 HB2 GLU 99 2HB GLU 99 9.891 -25.236 -11.799 1523 HB3 GLU 99 1HB GLU 99 11.371 -25.377 -12.795 1524 HG2 GLU 99 2HG GLU 99 9.859 -23.886 -14.547 1525 HG3 GLU 99 1HG GLU 99 9.155 -23.322 -12.988 1526 H ARG 100 H ARG 100 8.754 -28.070 -11.914 1527 HA ARG 100 HA ARG 100 11.136 -29.442 -11.337 1528 HB2 ARG 100 2HB ARG 100 8.208 -30.299 -11.037 1529 HB3 ARG 100 1HB ARG 100 9.574 -31.285 -10.406 1530 HG2 ARG 100 2HG ARG 100 10.217 -29.633 -8.793 1531 HG3 ARG 100 1HG ARG 100 9.294 -28.347 -9.615 1532 HD2 ARG 100 2HD ARG 100 8.080 -28.947 -7.582 1533 HD3 ARG 100 1HD ARG 100 7.129 -29.456 -9.034 1534 HE ARG 100 HE ARG 100 8.910 -31.411 -7.534 1535 HH11 ARG 100 1HH2 ARG 100 5.573 -30.636 -8.665 1536 HH12 ARG 100 2HH2 ARG 100 4.820 -31.815 -7.713 1537 HH21 ARG 100 1HH1 ARG 100 7.948 -32.895 -6.212 1538 HH22 ARG 100 2HH1 ARG 100 6.247 -33.049 -6.042 1539 H ARG 101 H ARG 101 8.607 -30.123 -13.785 1540 HA ARG 101 HA ARG 101 10.098 -32.531 -14.623 1541 HB2 ARG 101 2HB ARG 101 7.416 -31.340 -15.516 1542 HB3 ARG 101 1HB ARG 101 8.157 -32.804 -16.243 1543 HG2 ARG 101 2HG ARG 101 8.023 -33.952 -14.020 1544 HG3 ARG 101 1HG ARG 101 7.233 -32.499 -13.311 1545 HD2 ARG 101 2HD ARG 101 5.262 -32.721 -14.734 1546 HD3 ARG 101 1HD ARG 101 6.052 -33.942 -15.787 1547 HE ARG 101 HE ARG 101 4.635 -34.424 -13.316 1548 HH11 ARG 101 1HH2 ARG 101 7.307 -35.695 -15.319 1549 HH12 ARG 101 2HH2 ARG 101 6.724 -37.296 -15.322 1550 HH21 ARG 101 1HH1 ARG 101 3.980 -36.688 -13.098 1551 HH22 ARG 101 2HH1 ARG 101 4.942 -37.920 -13.797 1552 H GLY 102 H GLY 102 9.575 -29.174 -15.339 1553 HA2 GLY 102 2HA GLY 102 10.679 -27.869 -16.770 1554 HA3 GLY 102 1HA GLY 102 11.227 -29.300 -17.721 1555 H HIS 103 H HIS 103 7.830 -29.221 -16.762 1556 HA HIS 103 HA HIS 103 6.667 -27.594 -18.538 1557 HB2 HIS 103 2HB HIS 103 5.724 -29.166 -20.303 1558 HB3 HIS 103 1HB HIS 103 7.443 -28.789 -20.567 1559 HD1 HIS 103 1HD HIS 103 9.171 -30.697 -19.820 1560 HD2 HIS 103 2HD HIS 103 5.150 -31.892 -19.874 1561 HE1 HIS 103 1HE HIS 103 9.138 -33.254 -19.705 1562 HE2 HIS 103 2HE HIS 103 6.658 -33.920 -19.771 1563 H1 SER 1 H SER 1 17.516 -23.996 0.043 1564 HA SER 1 HA SER 1 16.487 -21.588 -1.047 1565 HB2 SER 1 2HB SER 1 16.541 -22.739 -3.397 1566 HB3 SER 1 1HB SER 1 18.123 -22.124 -2.791 1567 HG SER 1 1HG SER 1 18.447 -24.181 -3.524 1568 H ALA 2 H ALA 2 14.315 -22.184 -2.066 1569 HA ALA 2 HA ALA 2 13.427 -24.852 -1.970 1570 HB1 ALA 2 1HB ALA 2 11.947 -22.599 -0.379 1571 HB2 ALA 2 2HB ALA 2 12.520 -24.149 0.326 1572 HB3 ALA 2 3HB ALA 2 11.181 -24.159 -0.884 1573 H ASP 3 H ASP 3 12.780 -24.686 -4.195 1574 HA ASP 3 HA ASP 3 13.189 -22.323 -5.465 1575 HB2 ASP 3 2HB ASP 3 11.730 -24.786 -6.535 1576 HB3 ASP 3 1HB ASP 3 12.203 -23.360 -7.527 1577 H HIS 4 H HIS 4 12.139 -20.648 -4.768 1578 HA HIS 4 HA HIS 4 9.743 -19.905 -5.824 1579 HB2 HIS 4 2HB HIS 4 8.254 -19.546 -4.002 1580 HB3 HIS 4 1HB HIS 4 8.583 -21.293 -4.097 1581 HD1 HIS 4 1HD HIS 4 7.291 -20.291 -1.683 1582 HD2 HIS 4 2HD HIS 4 11.482 -20.281 -1.877 1583 HE1 HIS 4 1HE HIS 4 8.172 -20.055 0.691 1584 HE2 HIS 4 2HE HIS 4 10.717 -19.847 0.441 1585 H GLU 5 H GLU 5 12.275 -19.594 -3.249 1586 HA GLU 5 HA GLU 5 11.944 -16.846 -2.885 1587 HB2 GLU 5 2HB GLU 5 14.687 -18.243 -2.651 1588 HB3 GLU 5 1HB GLU 5 14.064 -16.819 -1.756 1589 HG2 GLU 5 2HG GLU 5 13.201 -19.764 -1.341 1590 HG3 GLU 5 1HG GLU 5 14.352 -18.816 -0.357 1591 H ARG 6 H ARG 6 13.791 -18.798 -5.129 1592 HA ARG 6 HA ARG 6 15.751 -17.090 -5.935 1593 HB2 ARG 6 2HB ARG 6 14.296 -19.190 -7.679 1594 HB3 ARG 6 1HB ARG 6 15.954 -18.567 -7.952 1595 HG2 ARG 6 2HG ARG 6 16.786 -19.688 -5.925 1596 HG3 ARG 6 1HG ARG 6 15.132 -20.140 -5.419 1597 HD2 ARG 6 2HD ARG 6 16.214 -22.136 -6.357 1598 HD3 ARG 6 1HD ARG 6 14.860 -21.599 -7.422 1599 HE ARG 6 HE ARG 6 17.792 -20.934 -7.944 1600 HH11 ARG 6 1HH2 ARG 6 15.012 -23.005 -8.927 1601 HH12 ARG 6 2HH2 ARG 6 15.173 -22.700 -10.619 1602 HH21 ARG 6 1HH1 ARG 6 18.374 -21.074 -10.261 1603 HH22 ARG 6 2HH1 ARG 6 17.382 -21.970 -11.341 1604 H GLU 7 H GLU 7 12.407 -17.350 -7.021 1605 HA GLU 7 HA GLU 7 12.713 -15.767 -9.353 1606 HB2 GLU 7 2HB GLU 7 10.947 -17.695 -8.603 1607 HB3 GLU 7 1HB GLU 7 10.024 -16.297 -7.978 1608 HG2 GLU 7 2HG GLU 7 9.236 -16.883 -10.213 1609 HG3 GLU 7 1HG GLU 7 10.105 -15.312 -10.356 1610 H ALA 8 H ALA 8 11.539 -15.336 -6.002 1611 HA ALA 8 HA ALA 8 10.599 -12.694 -6.284 1612 HB1 ALA 8 1HB ALA 8 11.637 -14.209 -3.791 1613 HB2 ALA 8 2HB ALA 8 9.925 -14.151 -4.346 1614 HB3 ALA 8 3HB ALA 8 10.736 -12.657 -3.751 1615 H GLN 9 H GLN 9 13.712 -14.124 -5.370 1616 HA GLN 9 HA GLN 9 15.032 -11.824 -4.559 1617 HB2 GLN 9 2HB GLN 9 15.721 -14.247 -4.225 1618 HB3 GLN 9 1HB GLN 9 16.171 -14.329 -5.959 1619 HG2 GLN 9 2HG GLN 9 17.988 -12.636 -5.569 1620 HG3 GLN 9 1HG GLN 9 17.471 -12.475 -3.844 1621 HE21 GLN 9 1HE2 GLN 9 19.925 -13.217 -3.684 1622 HE22 GLN 9 2HE2 GLN 9 20.114 -14.928 -3.417 1623 H LYS 10 H LYS 10 14.556 -13.241 -7.793 1624 HA LYS 10 HA LYS 10 16.343 -11.535 -9.176 1625 HB2 LYS 10 2HB LYS 10 15.412 -13.744 -10.091 1626 HB3 LYS 10 1HB LYS 10 13.803 -12.963 -10.195 1627 HG2 LYS 10 2HG LYS 10 14.876 -11.225 -11.778 1628 HG3 LYS 10 1HG LYS 10 16.335 -12.267 -11.819 1629 HD2 LYS 10 2HD LYS 10 15.000 -14.106 -12.841 1630 HD3 LYS 10 1HD LYS 10 13.480 -13.193 -12.539 1631 HE2 LYS 10 2HE LYS 10 14.345 -11.329 -14.059 1632 HE3 LYS 10 1HE LYS 10 15.731 -12.395 -14.523 1633 HZ1 LYS 10 3HZ LYS 10 14.210 -13.905 -15.559 1634 HZ2 LYS 10 1HZ LYS 10 13.759 -12.374 -16.043 1635 HZ3 LYS 10 2HZ LYS 10 12.854 -13.174 -14.853 1636 H ALA 11 H ALA 11 12.939 -11.357 -8.173 1637 HA ALA 11 HA ALA 11 12.148 -9.267 -9.818 1638 HB1 ALA 11 1HB ALA 11 11.030 -9.857 -7.011 1639 HB2 ALA 11 2HB ALA 11 10.544 -10.736 -8.507 1640 HB3 ALA 11 3HB ALA 11 10.209 -8.974 -8.341 1641 H GLU 12 H GLU 12 13.648 -9.178 -6.507 1642 HA GLU 12 HA GLU 12 13.273 -6.400 -6.301 1643 HB2 GLU 12 2HB GLU 12 15.326 -8.068 -4.778 1644 HB3 GLU 12 1HB GLU 12 15.007 -6.319 -4.548 1645 HG2 GLU 12 2HG GLU 12 12.427 -7.225 -4.367 1646 HG3 GLU 12 1HG GLU 12 13.274 -8.678 -3.737 1647 H GLU 13 H GLU 13 15.767 -8.199 -8.083 1648 HA GLU 13 HA GLU 13 17.562 -6.003 -8.322 1649 HB2 GLU 13 2HB GLU 13 18.265 -8.348 -9.029 1650 HB3 GLU 13 1HB GLU 13 17.112 -8.250 -10.395 1651 HG2 GLU 13 2HG GLU 13 18.450 -6.219 -11.277 1652 HG3 GLU 13 1HG GLU 13 19.603 -6.478 -9.925 1653 H GLU 14 H GLU 14 14.573 -6.980 -9.966 1654 HA GLU 14 HA GLU 14 14.869 -5.451 -12.284 1655 HB2 GLU 14 2HB GLU 14 13.121 -7.298 -11.896 1656 HB3 GLU 14 1HB GLU 14 12.213 -6.111 -10.914 1657 HG2 GLU 14 2HG GLU 14 11.163 -6.113 -13.039 1658 HG3 GLU 14 1HG GLU 14 12.115 -4.592 -13.026 1659 H LEU 15 H LEU 15 13.438 -4.716 -9.103 1660 HA LEU 15 HA LEU 15 12.515 -2.179 -9.816 1661 HB2 LEU 15 2HB LEU 15 11.753 -3.482 -7.807 1662 HB3 LEU 15 1HB LEU 15 13.334 -3.189 -7.020 1663 HG LEU 15 HG LEU 15 12.870 -0.788 -6.856 1664 HD11 LEU 15 1HD1 LEU 15 10.592 0.140 -7.670 1665 HD12 LEU 15 2HD1 LEU 15 10.433 -1.354 -8.655 1666 HD13 LEU 15 3HD1 LEU 15 11.795 -0.212 -8.946 1667 HD21 LEU 15 3HD2 LEU 15 11.896 -2.274 -5.115 1668 HD22 LEU 15 1HD2 LEU 15 10.385 -2.455 -6.069 1669 HD23 LEU 15 2HD2 LEU 15 10.831 -0.853 -5.388 1670 H GLN 16 H GLN 16 15.617 -3.263 -8.352 1671 HA GLN 16 HA GLN 16 16.701 -0.775 -7.827 1672 HB2 GLN 16 2HB GLN 16 18.205 -3.280 -8.800 1673 HB3 GLN 16 1HB GLN 16 18.975 -1.816 -8.102 1674 HG2 GLN 16 2HG GLN 16 17.708 -2.207 -5.945 1675 HG3 GLN 16 1HG GLN 16 17.099 -3.766 -6.613 1676 HE21 GLN 16 1HE2 GLN 16 19.171 -3.031 -4.369 1677 HE22 GLN 16 2HE2 GLN 16 20.611 -3.893 -4.785 1678 H LYS 17 H LYS 17 16.678 -2.606 -10.905 1679 HA LYS 17 HA LYS 17 18.489 -0.788 -12.157 1680 HB2 LYS 17 2HB LYS 17 16.537 -2.798 -13.382 1681 HB3 LYS 17 1HB LYS 17 17.814 -1.909 -14.301 1682 HG2 LYS 17 2HG LYS 17 19.602 -2.915 -12.936 1683 HG3 LYS 17 1HG LYS 17 18.411 -3.772 -11.913 1684 HD2 LYS 17 2HD LYS 17 18.988 -4.330 -14.898 1685 HD3 LYS 17 1HD LYS 17 19.478 -5.280 -13.469 1686 HE2 LYS 17 2HE LYS 17 17.632 -6.555 -13.956 1687 HE3 LYS 17 1HE LYS 17 16.810 -5.300 -12.965 1688 HZ1 LYS 17 3HZ LYS 17 16.862 -5.676 -15.895 1689 HZ2 LYS 17 1HZ LYS 17 16.512 -4.140 -15.279 1690 HZ3 LYS 17 2HZ LYS 17 15.516 -5.449 -14.858 1691 H VAL 18 H VAL 18 14.979 -0.842 -11.714 1692 HA VAL 18 HA VAL 18 14.448 1.122 -13.723 1693 HB VAL 18 HB VAL 18 12.800 0.147 -11.342 1694 HG11 VAL 18 1HG1 VAL 18 10.870 1.290 -12.504 1695 HG12 VAL 18 2HG1 VAL 18 12.029 2.036 -13.677 1696 HG13 VAL 18 3HG1 VAL 18 12.091 2.473 -11.935 1697 HG21 VAL 18 3HG2 VAL 18 12.608 -0.386 -14.396 1698 HG22 VAL 18 1HG2 VAL 18 11.538 -1.079 -13.119 1699 HG23 VAL 18 2HG2 VAL 18 13.268 -1.546 -13.197 1700 H LEU 19 H LEU 19 15.233 1.122 -10.210 1701 HA LEU 19 HA LEU 19 14.806 3.778 -9.664 1702 HB2 LEU 19 2HB LEU 19 17.255 2.184 -8.677 1703 HB3 LEU 19 1HB LEU 19 16.644 3.713 -7.980 1704 HG LEU 19 HG LEU 19 15.152 1.027 -7.969 1705 HD11 LEU 19 1HD1 LEU 19 16.597 2.549 -5.717 1706 HD12 LEU 19 2HD1 LEU 19 17.178 1.040 -6.507 1707 HD13 LEU 19 3HD1 LEU 19 15.660 1.019 -5.532 1708 HD21 LEU 19 3HD2 LEU 19 13.505 2.863 -7.973 1709 HD22 LEU 19 1HD2 LEU 19 14.442 3.748 -6.708 1710 HD23 LEU 19 2HD2 LEU 19 13.646 2.186 -6.311 1711 H GLU 20 H GLU 20 17.821 2.297 -11.057 1712 HA GLU 20 HA GLU 20 19.208 4.699 -11.075 1713 HB2 GLU 20 2HB GLU 20 19.639 2.374 -13.030 1714 HB3 GLU 20 1HB GLU 20 20.756 3.732 -12.700 1715 HG2 GLU 20 2HG GLU 20 20.193 2.673 -10.100 1716 HG3 GLU 20 1HG GLU 20 20.283 1.211 -11.145 1717 H GLU 21 H GLU 21 17.186 3.260 -13.686 1718 HA GLU 21 HA GLU 21 17.722 5.386 -15.483 1719 HB2 GLU 21 2HB GLU 21 16.105 2.938 -15.550 1720 HB3 GLU 21 1HB GLU 21 15.127 4.310 -16.134 1721 HG2 GLU 21 2HG GLU 21 16.131 3.464 -18.096 1722 HG3 GLU 21 1HG GLU 21 17.083 4.940 -17.706 1723 H ALA 22 H ALA 22 15.112 4.784 -13.080 1724 HA ALA 22 HA ALA 22 13.529 6.974 -13.762 1725 HB1 ALA 22 1HB ALA 22 12.470 6.685 -11.519 1726 HB2 ALA 22 2HB ALA 22 13.830 5.610 -11.014 1727 HB3 ALA 22 3HB ALA 22 12.710 5.090 -12.322 1728 H SER 23 H SER 23 16.291 6.661 -11.524 1729 HA SER 23 HA SER 23 16.115 9.168 -10.288 1730 HB2 SER 23 2HB SER 23 18.740 7.690 -11.079 1731 HB3 SER 23 1HB SER 23 18.549 8.949 -9.804 1732 HG SER 23 1HG SER 23 17.455 6.319 -9.907 1733 H LYS 24 H LYS 24 17.894 8.031 -13.186 1734 HA LYS 24 HA LYS 24 19.109 10.501 -13.707 1735 HB2 LYS 24 2HB LYS 24 19.825 8.145 -14.433 1736 HB3 LYS 24 1HB LYS 24 18.596 8.224 -15.729 1737 HG2 LYS 24 2HG LYS 24 20.793 10.379 -15.388 1738 HG3 LYS 24 1HG LYS 24 21.148 8.803 -16.160 1739 HD2 LYS 24 2HD LYS 24 19.483 9.180 -17.912 1740 HD3 LYS 24 1HD LYS 24 19.000 10.761 -17.188 1741 HE2 LYS 24 2HE LYS 24 21.230 11.728 -17.608 1742 HE3 LYS 24 1HE LYS 24 21.873 10.136 -18.171 1743 HZ1 LYS 24 3HZ LYS 24 19.675 11.696 -19.477 1744 HZ2 LYS 24 1HZ LYS 24 20.389 10.228 -20.048 1745 HZ3 LYS 24 2HZ LYS 24 21.290 11.642 -19.977 1746 H LYS 25 H LYS 25 16.150 8.890 -14.896 1747 HA LYS 25 HA LYS 25 15.340 10.856 -16.708 1748 HB2 LYS 25 2HB LYS 25 13.791 8.853 -14.987 1749 HB3 LYS 25 1HB LYS 25 12.917 9.990 -16.053 1750 HG2 LYS 25 2HG LYS 25 15.099 8.237 -17.273 1751 HG3 LYS 25 1HG LYS 25 13.500 7.540 -16.848 1752 HD2 LYS 25 2HD LYS 25 12.335 9.295 -18.171 1753 HD3 LYS 25 1HD LYS 25 13.915 9.947 -18.738 1754 HE2 LYS 25 2HE LYS 25 14.425 7.857 -19.940 1755 HE3 LYS 25 1HE LYS 25 13.065 6.995 -19.122 1756 HZ1 LYS 25 3HZ LYS 25 12.803 9.080 -21.256 1757 HZ2 LYS 25 1HZ LYS 25 11.534 8.540 -20.278 1758 HZ3 LYS 25 2HZ LYS 25 12.396 7.436 -21.249 1759 H ALA 26 H ALA 26 14.578 10.486 -13.172 1760 HA ALA 26 HA ALA 26 12.700 12.446 -13.028 1761 HB1 ALA 26 1HB ALA 26 14.772 11.714 -10.861 1762 HB2 ALA 26 2HB ALA 26 13.191 10.894 -11.129 1763 HB3 ALA 26 3HB ALA 26 13.228 12.604 -10.583 1764 H VAL 27 H VAL 27 16.246 12.840 -12.534 1765 HA VAL 27 HA VAL 27 15.930 15.605 -12.005 1766 HB VAL 27 HB VAL 27 17.765 14.445 -11.060 1767 HG11 VAL 27 1HG1 VAL 27 19.651 13.534 -12.337 1768 HG12 VAL 27 2HG1 VAL 27 18.910 14.028 -13.906 1769 HG13 VAL 27 3HG1 VAL 27 18.152 12.747 -12.904 1770 HG21 VAL 27 3HG2 VAL 27 18.778 16.531 -13.101 1771 HG22 VAL 27 1HG2 VAL 27 19.487 16.127 -11.495 1772 HG23 VAL 27 2HG2 VAL 27 17.863 16.894 -11.595 1773 H GLU 28 H GLU 28 16.679 13.778 -15.068 1774 HA GLU 28 HA GLU 28 17.107 16.247 -16.438 1775 HB2 GLU 28 2HB GLU 28 16.554 13.476 -17.617 1776 HB3 GLU 28 1HB GLU 28 16.893 14.969 -18.558 1777 HG2 GLU 28 2HG GLU 28 19.113 15.165 -17.201 1778 HG3 GLU 28 1HG GLU 28 18.817 13.451 -16.716 1779 H ALA 29 H ALA 29 14.252 14.387 -15.639 1780 HA ALA 29 HA ALA 29 12.536 15.437 -17.597 1781 HB1 ALA 29 1HB ALA 29 11.886 14.392 -14.760 1782 HB2 ALA 29 2HB ALA 29 12.031 13.368 -16.236 1783 HB3 ALA 29 3HB ALA 29 10.723 14.570 -16.121 1784 H GLU 30 H GLU 30 13.364 16.342 -14.237 1785 HA GLU 30 HA GLU 30 11.569 18.483 -14.133 1786 HB2 GLU 30 2HB GLU 30 12.707 17.092 -12.235 1787 HB3 GLU 30 1HB GLU 30 14.111 18.173 -12.471 1788 HG2 GLU 30 2HG GLU 30 13.043 19.440 -10.884 1789 HG3 GLU 30 1HG GLU 30 12.082 20.035 -12.294 1790 H ARG 31 H ARG 31 14.873 18.181 -15.344 1791 HA ARG 31 HA ARG 31 15.486 20.955 -15.339 1792 HB2 ARG 31 2HB ARG 31 16.629 18.578 -16.885 1793 HB3 ARG 31 1HB ARG 31 17.299 20.235 -17.051 1794 HG2 ARG 31 2HG ARG 31 17.013 18.977 -14.276 1795 HG3 ARG 31 1HG ARG 31 18.395 18.535 -15.341 1796 HD2 ARG 31 2HD ARG 31 19.148 20.828 -15.495 1797 HD3 ARG 31 1HD ARG 31 17.698 21.464 -14.593 1798 HE ARG 31 HE ARG 31 18.876 19.597 -12.854 1799 HH11 ARG 31 1HH2 ARG 31 19.971 22.586 -14.579 1800 HH12 ARG 31 2HH2 ARG 31 21.265 22.891 -13.491 1801 HH21 ARG 31 1HH1 ARG 31 20.387 20.240 -11.218 1802 HH22 ARG 31 2HH1 ARG 31 21.438 21.598 -11.442 1803 H GLY 32 H GLY 32 13.873 22.170 -16.244 1804 HA2 GLY 32 2HA GLY 32 13.719 23.299 -18.427 1805 HA3 GLY 32 1HA GLY 32 13.206 21.686 -19.067 1806 H ALA 33 H ALA 33 12.032 21.503 -16.018 1807 HA ALA 33 HA ALA 33 9.425 22.259 -16.992 1808 HB1 ALA 33 1HB ALA 33 10.248 20.756 -14.438 1809 HB2 ALA 33 2HB ALA 33 9.725 19.990 -15.980 1810 HB3 ALA 33 3HB ALA 33 8.565 20.994 -15.034 1811 HA PRO 34 HA PRO 34 9.731 25.843 -14.387 1812 HB2 PRO 34 2HB PRO 34 7.096 26.777 -14.354 1813 HB3 PRO 34 1HB PRO 34 8.157 26.831 -15.813 1814 HG2 PRO 34 2HG PRO 34 6.063 24.712 -15.086 1815 HG3 PRO 34 1HG PRO 34 6.279 25.566 -16.674 1816 HD2 PRO 34 2HD PRO 34 7.329 23.040 -16.183 1817 HD3 PRO 34 1HD PRO 34 8.238 24.256 -17.196 1818 H GLY 35 H GLY 35 9.940 26.106 -12.143 1819 HA2 GLY 35 2HA GLY 35 9.223 26.128 -9.981 1820 HA3 GLY 35 1HA GLY 35 7.689 25.309 -10.469 1821 H ALA 36 H ALA 36 10.710 24.130 -11.544 1822 HA ALA 36 HA ALA 36 10.567 21.551 -10.732 1823 HB1 ALA 36 1HB ALA 36 12.152 22.411 -12.470 1824 HB2 ALA 36 2HB ALA 36 13.104 21.617 -11.178 1825 HB3 ALA 36 3HB ALA 36 13.001 23.400 -11.219 1826 H ALA 37 H ALA 37 11.326 20.321 -9.027 1827 HA ALA 37 HA ALA 37 12.488 21.804 -6.732 1828 HB1 ALA 37 1HB ALA 37 10.132 20.884 -6.351 1829 HB2 ALA 37 2HB ALA 37 11.375 20.132 -5.294 1830 HB3 ALA 37 3HB ALA 37 10.748 19.250 -6.750 1831 H LEU 38 H LEU 38 12.302 18.786 -8.675 1832 HA LEU 38 HA LEU 38 14.543 17.657 -7.224 1833 HB2 LEU 38 2HB LEU 38 12.284 16.560 -7.944 1834 HB3 LEU 38 1HB LEU 38 12.994 16.424 -9.565 1835 HG LEU 38 HG LEU 38 14.215 15.261 -6.962 1836 HD11 LEU 38 1HD1 LEU 38 13.300 13.073 -7.800 1837 HD12 LEU 38 2HD1 LEU 38 12.397 13.961 -9.083 1838 HD13 LEU 38 3HD1 LEU 38 12.018 14.254 -7.350 1839 HD21 LEU 38 3HD2 LEU 38 15.985 15.412 -8.680 1840 HD22 LEU 38 1HD2 LEU 38 14.883 14.724 -9.928 1841 HD23 LEU 38 2HD2 LEU 38 15.444 13.699 -8.561 1842 H ILE 39 H ILE 39 15.816 19.638 -8.225 1843 HA ILE 39 HA ILE 39 16.562 19.180 -11.009 1844 HB ILE 39 HB ILE 39 17.837 21.303 -10.737 1845 HG12 ILE 39 2HG1 ILE 39 16.596 21.370 -7.893 1846 HG13 ILE 39 1HG1 ILE 39 18.333 21.088 -8.242 1847 HG21 ILE 39 1HG2 ILE 39 15.425 21.137 -11.497 1848 HG22 ILE 39 2HG2 ILE 39 15.804 22.699 -10.697 1849 HG23 ILE 39 3HG2 ILE 39 14.895 21.433 -9.800 1850 HD11 ILE 39 3HD ILE 39 16.737 23.652 -8.896 1851 HD12 ILE 39 1HD ILE 39 17.978 23.437 -7.616 1852 HD13 ILE 39 2HD ILE 39 18.459 23.362 -9.351 1853 H SER 40 H SER 40 17.689 18.088 -7.979 1854 HA SER 40 HA SER 40 20.500 18.386 -8.716 1855 HB2 SER 40 2HB SER 40 19.203 17.543 -6.077 1856 HB3 SER 40 1HB SER 40 20.975 17.687 -6.357 1857 HG SER 40 1HG SER 40 19.908 19.523 -5.414 1858 H TYR 41 H TYR 41 21.641 16.785 -9.521 1859 HA TYR 41 HA TYR 41 20.613 14.318 -10.127 1860 HB2 TYR 41 2HB TYR 41 23.630 14.922 -10.034 1861 HB3 TYR 41 1HB TYR 41 22.756 13.763 -11.084 1862 HD1 TYR 41 2HD TYR 41 21.401 14.630 -12.996 1863 HD2 TYR 41 1HD TYR 41 23.711 17.289 -10.535 1864 HE1 TYR 41 2HE TYR 41 21.113 16.423 -14.666 1865 HE2 TYR 41 1HE TYR 41 23.460 19.071 -12.208 1866 HH TYR 41 HH TYR 41 22.561 19.681 -14.254 1867 HA PRO 42 HA PRO 42 23.054 12.196 -6.781 1868 HB2 PRO 42 2HB PRO 42 24.073 13.493 -4.503 1869 HB3 PRO 42 1HB PRO 42 24.989 13.336 -6.048 1870 HG2 PRO 42 2HG PRO 42 23.264 15.716 -5.137 1871 HG3 PRO 42 1HG PRO 42 24.971 15.747 -5.758 1872 HD2 PRO 42 2HD PRO 42 22.861 16.254 -7.416 1873 HD3 PRO 42 1HD PRO 42 24.246 15.223 -8.003 1874 H ASP 43 H ASP 43 20.662 14.580 -6.149 1875 HA ASP 43 HA ASP 43 19.697 13.313 -3.717 1876 HB2 ASP 43 2HB ASP 43 18.537 15.560 -5.492 1877 HB3 ASP 43 1HB ASP 43 17.689 14.874 -4.071 1878 H ALA 44 H ALA 44 19.299 13.215 -7.215 1879 HA ALA 44 HA ALA 44 16.632 12.442 -7.292 1880 HB1 ALA 44 1HB ALA 44 17.076 11.771 -9.639 1881 HB2 ALA 44 2HB ALA 44 18.855 11.776 -9.332 1882 HB3 ALA 44 3HB ALA 44 17.923 13.316 -9.277 1883 H ILE 45 H ILE 45 19.597 10.598 -6.895 1884 HA ILE 45 HA ILE 45 18.367 8.055 -7.231 1885 HB ILE 45 HB ILE 45 20.576 8.182 -7.898 1886 HG12 ILE 45 2HG1 ILE 45 20.710 6.806 -5.147 1887 HG13 ILE 45 1HG1 ILE 45 19.955 6.119 -6.621 1888 HG21 ILE 45 1HG2 ILE 45 21.221 9.549 -5.209 1889 HG22 ILE 45 2HG2 ILE 45 21.316 10.259 -6.864 1890 HG23 ILE 45 3HG2 ILE 45 22.457 8.982 -6.381 1891 HD11 ILE 45 3HD ILE 45 22.943 6.858 -6.285 1892 HD12 ILE 45 1HD ILE 45 22.226 5.211 -6.382 1893 HD13 ILE 45 2HD ILE 45 22.183 6.295 -7.822 1894 H TRP 46 H TRP 46 18.609 10.322 -4.560 1895 HA TRP 46 HA TRP 46 18.151 8.229 -2.573 1896 HB2 TRP 46 2HB TRP 46 18.749 11.158 -2.520 1897 HB3 TRP 46 1HB TRP 46 17.434 10.722 -1.397 1898 HD1 TRP 46 HD TRP 46 18.330 10.489 0.968 1899 HE1 TRP 46 1HE TRP 46 20.608 9.903 2.048 1900 HE3 TRP 46 3HE TRP 46 20.812 8.939 -3.210 1901 HZ2 TRP 46 2HZ TRP 46 23.038 8.649 1.254 1902 HZ3 TRP 46 3HZ TRP 46 23.095 8.026 -2.997 1903 HH2 TRP 46 HH TRP 46 24.199 7.894 -0.790 1904 H TRP 47 H TRP 47 16.430 10.868 -4.266 1905 HA TRP 47 HA TRP 47 13.949 10.472 -3.069 1906 HB2 TRP 47 2HB TRP 47 14.589 12.510 -4.394 1907 HB3 TRP 47 1HB TRP 47 14.548 11.527 -5.898 1908 HD1 TRP 47 HD TRP 47 12.134 13.116 -3.248 1909 HE1 TRP 47 1HE TRP 47 9.796 13.344 -4.367 1910 HE3 TRP 47 3HE TRP 47 13.034 10.423 -7.486 1911 HZ2 TRP 47 2HZ TRP 47 8.512 12.420 -6.718 1912 HZ3 TRP 47 3HZ TRP 47 11.218 10.121 -9.140 1913 HH2 TRP 47 HH TRP 47 8.986 11.111 -8.759 1914 H SER 48 H SER 48 15.469 8.848 -5.941 1915 HA SER 48 HA SER 48 13.041 7.755 -6.806 1916 HB2 SER 48 2HB SER 48 14.480 6.183 -8.158 1917 HB3 SER 48 1HB SER 48 14.922 7.923 -8.345 1918 HG SER 48 1HG SER 48 16.801 6.948 -7.974 1919 H VAL 49 H VAL 49 15.474 6.623 -4.453 1920 HA VAL 49 HA VAL 49 14.641 3.982 -4.278 1921 HB VAL 49 HB VAL 49 15.965 5.815 -2.228 1922 HG11 VAL 49 1HG1 VAL 49 16.622 3.665 -1.028 1923 HG12 VAL 49 2HG1 VAL 49 15.475 2.753 -2.076 1924 HG13 VAL 49 3HG1 VAL 49 14.865 3.996 -0.924 1925 HG21 VAL 49 3HG2 VAL 49 18.021 4.729 -2.967 1926 HG22 VAL 49 1HG2 VAL 49 17.141 5.148 -4.478 1927 HG23 VAL 49 2HG2 VAL 49 17.118 3.462 -3.870 1928 H GLU 50 H GLU 50 13.610 6.823 -2.279 1929 HA GLU 50 HA GLU 50 11.734 5.244 -0.856 1930 HB2 GLU 50 2HB GLU 50 10.938 7.441 0.066 1931 HB3 GLU 50 1HB GLU 50 12.704 7.177 0.175 1932 HG2 GLU 50 2HG GLU 50 12.821 8.501 -2.125 1933 HG3 GLU 50 1HG GLU 50 11.166 9.071 -1.705 1934 H THR 51 H THR 51 11.569 7.152 -3.865 1935 HA THR 51 HA THR 51 8.789 7.280 -4.038 1936 HB THR 51 HB THR 51 10.888 7.207 -6.260 1937 HG1 THR 51 1HG THR 51 11.138 8.963 -4.953 1938 HG21 THR 51 3HG2 THR 51 9.101 8.369 -7.641 1939 HG22 THR 51 1HG2 THR 51 7.895 8.026 -6.347 1940 HG23 THR 51 2HG2 THR 51 8.654 6.674 -7.243 1941 H ALA 52 H ALA 52 11.031 4.629 -4.917 1942 HA ALA 52 HA ALA 52 9.140 3.143 -6.373 1943 HB1 ALA 52 1HB ALA 52 10.663 1.188 -5.885 1944 HB2 ALA 52 2HB ALA 52 11.574 2.221 -4.724 1945 HB3 ALA 52 3HB ALA 52 11.546 2.634 -6.484 1946 H THR 53 H THR 53 9.277 3.771 -2.958 1947 HA THR 53 HA THR 53 7.837 1.308 -2.355 1948 HB THR 53 HB THR 53 7.940 1.920 -0.038 1949 HG1 THR 53 1HG THR 53 9.132 4.334 -1.005 1950 HG21 THR 53 3HG2 THR 53 10.686 2.253 -1.457 1951 HG22 THR 53 1HG2 THR 53 9.847 0.691 -1.137 1952 HG23 THR 53 2HG2 THR 53 10.403 1.713 0.236 1953 H THR 54 H THR 54 7.069 4.242 -3.698 1954 HA THR 54 HA THR 54 5.334 5.319 -4.124 1955 HB THR 54 HB THR 54 3.204 4.394 -4.397 1956 HG1 THR 54 1HG THR 54 2.748 3.428 -2.500 1957 HG21 THR 54 3HG2 THR 54 5.220 2.040 -4.601 1958 HG22 THR 54 1HG2 THR 54 5.276 3.465 -5.689 1959 HG23 THR 54 2HG2 THR 54 3.821 2.400 -5.671 1960 H VAL 55 H VAL 55 6.269 4.970 -1.101 1961 HA VAL 55 HA VAL 55 4.176 6.030 0.413 1962 HB VAL 55 HB VAL 55 7.232 6.064 0.828 1963 HG11 VAL 55 1HG1 VAL 55 4.939 6.540 2.838 1964 HG12 VAL 55 2HG1 VAL 55 6.115 7.791 2.306 1965 HG13 VAL 55 3HG1 VAL 55 6.681 6.387 3.269 1966 HG21 VAL 55 3HG2 VAL 55 6.686 4.085 2.335 1967 HG22 VAL 55 1HG2 VAL 55 6.287 3.761 0.622 1968 HG23 VAL 55 2HG2 VAL 55 4.970 4.172 1.770 1969 H GLY 56 H GLY 56 7.115 7.560 -1.044 1970 HA2 GLY 56 2HA GLY 56 7.287 9.593 -1.953 1971 HA3 GLY 56 1HA GLY 56 5.564 9.944 -1.548 1972 H TYR 57 H TYR 57 5.268 9.900 0.969 1973 HA TYR 57 HA TYR 57 5.534 10.675 2.945 1974 HB2 TYR 57 2HB TYR 57 8.101 9.722 2.548 1975 HB3 TYR 57 1HB TYR 57 8.478 11.446 2.869 1976 HD1 TYR 57 1HD TYR 57 6.850 12.381 4.991 1977 HD2 TYR 57 2HD TYR 57 8.220 8.345 4.379 1978 HE1 TYR 57 1HE TYR 57 6.467 11.891 7.362 1979 HE2 TYR 57 2HE TYR 57 7.871 7.871 6.771 1980 HH TYR 57 HH TYR 57 7.236 8.732 8.839 1981 H GLY 58 H GLY 58 7.338 12.460 0.548 1982 HA2 GLY 58 2HA GLY 58 6.339 14.516 -0.219 1983 HA3 GLY 58 1HA GLY 58 6.172 15.010 1.515 1984 H ASP 59 H ASP 59 8.961 13.265 -0.035 1985 HA ASP 59 HA ASP 59 10.734 15.154 1.123 1986 HB2 ASP 59 2HB ASP 59 11.543 12.831 0.650 1987 HB3 ASP 59 1HB ASP 59 11.422 13.146 -1.104 1988 H ARG 60 H ARG 60 9.684 14.579 -2.356 1989 HA ARG 60 HA ARG 60 9.801 17.400 -2.727 1990 HB2 ARG 60 2HB ARG 60 11.985 15.658 -3.820 1991 HB3 ARG 60 1HB ARG 60 11.242 16.736 -5.032 1992 HG2 ARG 60 2HG ARG 60 11.843 18.719 -3.928 1993 HG3 ARG 60 1HG ARG 60 12.047 17.953 -2.345 1994 HD2 ARG 60 2HD ARG 60 13.989 17.488 -4.700 1995 HD3 ARG 60 1HD ARG 60 14.215 18.678 -3.347 1996 HE ARG 60 HE ARG 60 13.617 15.948 -2.373 1997 HH11 ARG 60 1HH2 ARG 60 16.280 18.318 -2.927 1998 HH12 ARG 60 2HH2 ARG 60 17.511 17.117 -2.727 1999 HH21 ARG 60 1HH1 ARG 60 15.238 14.656 -1.588 2000 HH22 ARG 60 2HH1 ARG 60 16.948 15.061 -1.781 2001 H TYR 61 H TYR 61 9.102 17.795 -5.204 2002 HA TYR 61 HA TYR 61 6.866 15.982 -5.608 2003 HB2 TYR 61 2HB TYR 61 6.734 19.082 -5.536 2004 HB3 TYR 61 1HB TYR 61 5.372 17.963 -5.880 2005 HD1 TYR 61 1HD TYR 61 7.734 19.200 -3.252 2006 HD2 TYR 61 2HD TYR 61 4.176 16.911 -4.046 2007 HE1 TYR 61 1HE TYR 61 7.230 19.152 -0.841 2008 HE2 TYR 61 2HE TYR 61 3.651 16.911 -1.651 2009 HH TYR 61 HH TYR 61 4.481 17.279 0.460 2010 HA PRO 62 HA PRO 62 8.735 17.292 -9.580 2011 HB2 PRO 62 2HB PRO 62 7.479 15.467 -11.251 2012 HB3 PRO 62 1HB PRO 62 8.707 14.962 -10.044 2013 HG2 PRO 62 2HG PRO 62 5.652 14.903 -9.817 2014 HG3 PRO 62 1HG PRO 62 6.810 13.552 -9.475 2015 HD2 PRO 62 2HD PRO 62 5.792 15.296 -7.516 2016 HD3 PRO 62 1HD PRO 62 7.448 14.534 -7.385 2017 H VAL 63 H VAL 63 7.802 18.152 -11.761 2018 HA VAL 63 HA VAL 63 5.596 19.903 -11.077 2019 HB VAL 63 HB VAL 63 7.385 20.035 -13.529 2020 HG11 VAL 63 1HG1 VAL 63 5.757 22.257 -12.094 2021 HG12 VAL 63 2HG1 VAL 63 5.103 21.414 -13.536 2022 HG13 VAL 63 3HG1 VAL 63 6.615 22.359 -13.672 2023 HG21 VAL 63 3HG2 VAL 63 8.616 21.775 -12.192 2024 HG22 VAL 63 1HG2 VAL 63 8.774 20.135 -11.484 2025 HG23 VAL 63 2HG2 VAL 63 7.652 21.325 -10.736 2026 H THR 64 H THR 64 5.992 19.255 -14.524 2027 HA THR 64 HA THR 64 3.598 17.732 -14.724 2028 HB THR 64 HB THR 64 3.510 20.618 -15.791 2029 HG1 THR 64 1HG THR 64 2.903 19.573 -13.345 2030 HG21 THR 64 3HG2 THR 64 1.081 20.103 -16.158 2031 HG22 THR 64 1HG2 THR 64 1.321 18.432 -15.524 2032 HG23 THR 64 2HG2 THR 64 2.110 18.933 -17.061 2033 H GLU 65 H GLU 65 6.118 19.872 -16.179 2034 HA GLU 65 HA GLU 65 5.850 18.434 -18.682 2035 HB2 GLU 65 2HB GLU 65 6.268 21.020 -18.401 2036 HB3 GLU 65 1HB GLU 65 7.988 20.540 -18.177 2037 HG2 GLU 65 2HG GLU 65 7.917 19.393 -20.424 2038 HG3 GLU 65 1HG GLU 65 6.171 19.802 -20.584 2039 H GLU 66 H GLU 66 6.951 17.380 -15.876 2040 HA GLU 66 HA GLU 66 9.592 16.485 -16.596 2041 HB2 GLU 66 2HB GLU 66 8.568 14.746 -14.576 2042 HB3 GLU 66 1HB GLU 66 9.653 16.143 -14.357 2043 HG2 GLU 66 2HG GLU 66 8.057 16.473 -12.787 2044 HG3 GLU 66 1HG GLU 66 7.618 17.648 -14.024 2045 H GLY 67 H GLY 67 6.250 15.506 -16.359 2046 HA2 GLY 67 2HA GLY 67 5.102 14.171 -17.898 2047 HA3 GLY 67 1HA GLY 67 6.655 13.233 -18.191 2048 H ARG 68 H ARG 68 4.146 14.094 -15.694 2049 HA ARG 68 HA ARG 68 5.535 13.036 -13.596 2050 HB2 ARG 68 2HB ARG 68 3.538 14.456 -13.312 2051 HB3 ARG 68 1HB ARG 68 2.470 13.076 -13.736 2052 HG2 ARG 68 2HG ARG 68 3.151 11.840 -11.744 2053 HG3 ARG 68 1HG ARG 68 4.566 12.912 -11.477 2054 HD2 ARG 68 2HD ARG 68 1.607 13.760 -11.120 2055 HD3 ARG 68 1HD ARG 68 2.769 13.307 -9.802 2056 HE ARG 68 HE ARG 68 3.899 15.378 -11.562 2057 HH11 ARG 68 1HH2 ARG 68 1.976 14.743 -8.413 2058 HH12 ARG 68 2HH2 ARG 68 2.003 16.405 -8.085 2059 HH21 ARG 68 1HH1 ARG 68 3.477 17.712 -10.949 2060 HH22 ARG 68 2HH1 ARG 68 2.632 18.017 -9.444 2061 H LYS 69 H LYS 69 4.137 11.449 -16.156 2062 HA LYS 69 HA LYS 69 3.794 8.846 -15.456 2063 HB2 LYS 69 2HB LYS 69 5.440 9.939 -17.812 2064 HB3 LYS 69 1HB LYS 69 4.746 8.280 -17.684 2065 HG2 LYS 69 2HG LYS 69 2.455 9.198 -17.647 2066 HG3 LYS 69 1HG LYS 69 3.073 10.878 -17.766 2067 HD2 LYS 69 2HD LYS 69 4.125 10.399 -19.953 2068 HD3 LYS 69 1HD LYS 69 3.570 8.694 -19.902 2069 HE2 LYS 69 2HE LYS 69 1.625 11.112 -19.786 2070 HE3 LYS 69 1HE LYS 69 2.180 10.375 -21.338 2071 HZ1 LYS 69 3HZ LYS 69 1.115 8.403 -20.876 2072 HZ2 LYS 69 1HZ LYS 69 0.029 9.620 -20.481 2073 HZ3 LYS 69 2HZ LYS 69 0.809 8.729 -19.226 2074 H VAL 70 H VAL 70 6.816 10.747 -15.226 2075 HA VAL 70 HA VAL 70 8.561 8.528 -15.192 2076 HB VAL 70 HB VAL 70 8.855 11.372 -14.138 2077 HG11 VAL 70 1HG1 VAL 70 10.967 9.108 -14.332 2078 HG12 VAL 70 2HG1 VAL 70 10.425 9.947 -12.830 2079 HG13 VAL 70 3HG1 VAL 70 11.341 10.853 -14.081 2080 HG21 VAL 70 3HG2 VAL 70 10.257 11.631 -16.192 2081 HG22 VAL 70 1HG2 VAL 70 8.617 11.082 -16.656 2082 HG23 VAL 70 2HG2 VAL 70 9.977 9.906 -16.635 2083 H ALA 71 H ALA 71 6.665 10.205 -12.650 2084 HA ALA 71 HA ALA 71 7.868 8.694 -10.527 2085 HB1 ALA 71 1HB ALA 71 5.193 10.239 -10.580 2086 HB2 ALA 71 2HB ALA 71 6.779 10.930 -10.078 2087 HB3 ALA 71 3HB ALA 71 6.040 9.614 -9.110 2088 H GLU 72 H GLU 72 4.850 8.621 -12.438 2089 HA GLU 72 HA GLU 72 3.497 6.532 -11.361 2090 HB2 GLU 72 2HB GLU 72 2.757 8.049 -13.288 2091 HB3 GLU 72 1HB GLU 72 3.875 7.134 -14.350 2092 HG2 GLU 72 2HG GLU 72 2.475 5.049 -13.972 2093 HG3 GLU 72 1HG GLU 72 1.288 6.075 -13.075 2094 H GLN 73 H GLN 73 6.006 6.348 -13.925 2095 HA GLN 73 HA GLN 73 5.730 3.641 -14.388 2096 HB2 GLN 73 2HB GLN 73 6.798 5.367 -15.882 2097 HB3 GLN 73 1HB GLN 73 8.269 5.330 -14.870 2098 HG2 GLN 73 2HG GLN 73 7.165 2.725 -16.128 2099 HG3 GLN 73 1HG GLN 73 7.962 3.946 -17.169 2100 HE21 GLN 73 1HE2 GLN 73 8.559 1.777 -14.352 2101 HE22 GLN 73 2HE2 GLN 73 10.272 1.669 -14.637 2102 H VAL 74 H VAL 74 8.004 5.336 -12.122 2103 HA VAL 74 HA VAL 74 9.379 2.882 -11.610 2104 HB VAL 74 HB VAL 74 10.644 4.881 -11.462 2105 HG11 VAL 74 1HG1 VAL 74 10.287 6.581 -9.653 2106 HG12 VAL 74 2HG1 VAL 74 8.756 5.763 -9.185 2107 HG13 VAL 74 3HG1 VAL 74 8.916 6.520 -10.806 2108 HG21 VAL 74 3HG2 VAL 74 11.247 2.918 -9.969 2109 HG22 VAL 74 1HG2 VAL 74 10.327 3.682 -8.628 2110 HG23 VAL 74 2HG2 VAL 74 11.773 4.509 -9.301 2111 H MET 75 H MET 75 6.717 4.686 -10.081 2112 HA MET 75 HA MET 75 6.600 3.095 -7.768 2113 HB2 MET 75 2HB MET 75 4.507 4.826 -9.201 2114 HB3 MET 75 1HB MET 75 4.233 4.048 -7.602 2115 HG2 MET 75 2HG MET 75 6.349 5.131 -6.765 2116 HG3 MET 75 1HG MET 75 6.478 6.075 -8.256 2117 HE1 MET 75 3HE MET 75 3.294 6.736 -8.806 2118 HE2 MET 75 1HE MET 75 4.621 7.932 -9.002 2119 HE3 MET 75 2HE MET 75 3.189 8.343 -8.018 2120 H LYS 76 H LYS 76 4.865 2.866 -10.921 2121 HA LYS 76 HA LYS 76 3.284 0.680 -10.273 2122 HB2 LYS 76 2HB LYS 76 2.928 1.969 -12.347 2123 HB3 LYS 76 1HB LYS 76 4.545 1.500 -12.955 2124 HG2 LYS 76 2HG LYS 76 3.848 -0.848 -13.214 2125 HG3 LYS 76 1HG LYS 76 2.247 -0.510 -12.468 2126 HD2 LYS 76 2HD LYS 76 1.547 0.822 -14.391 2127 HD3 LYS 76 1HD LYS 76 3.234 1.000 -14.959 2128 HE2 LYS 76 2HE LYS 76 2.000 -0.526 -16.440 2129 HE3 LYS 76 1HE LYS 76 3.372 -1.369 -15.638 2130 HZ1 LYS 76 3HZ LYS 76 1.967 -2.699 -14.435 2131 HZ2 LYS 76 1HZ LYS 76 1.098 -2.466 -15.853 2132 HZ3 LYS 76 2HZ LYS 76 0.666 -1.594 -14.463 2133 H ALA 77 H ALA 77 6.640 0.799 -11.509 2134 HA ALA 77 HA ALA 77 6.911 -1.969 -11.903 2135 HB1 ALA 77 1HB ALA 77 8.551 -0.304 -12.849 2136 HB2 ALA 77 2HB ALA 77 9.388 -1.550 -11.848 2137 HB3 ALA 77 3HB ALA 77 9.089 0.097 -11.175 2138 H GLY 78 H GLY 78 7.462 0.120 -9.046 2139 HA2 GLY 78 2HA GLY 78 8.674 -1.823 -7.431 2140 HA3 GLY 78 1HA GLY 78 7.794 -0.333 -6.908 2141 H ILE 79 H ILE 79 5.243 -0.812 -7.747 2142 HA ILE 79 HA ILE 79 4.233 -2.484 -5.777 2143 HB ILE 79 HB ILE 79 2.941 -1.441 -8.344 2144 HG12 ILE 79 2HG1 ILE 79 2.697 -0.469 -5.416 2145 HG13 ILE 79 1HG1 ILE 79 3.794 0.262 -6.616 2146 HG21 ILE 79 1HG2 ILE 79 1.595 -2.733 -5.866 2147 HG22 ILE 79 2HG2 ILE 79 1.634 -3.430 -7.529 2148 HG23 ILE 79 3HG2 ILE 79 0.725 -1.927 -7.217 2149 HD11 ILE 79 3HD ILE 79 0.709 0.187 -6.812 2150 HD12 ILE 79 1HD ILE 79 1.743 1.605 -6.452 2151 HD13 ILE 79 2HD ILE 79 1.816 0.842 -8.082 2152 H GLU 80 H GLU 80 4.699 -3.093 -9.312 2153 HA GLU 80 HA GLU 80 3.587 -5.672 -9.180 2154 HB2 GLU 80 2HB GLU 80 5.525 -4.492 -11.244 2155 HB3 GLU 80 1HB GLU 80 4.721 -6.095 -11.392 2156 HG2 GLU 80 2HG GLU 80 2.464 -4.960 -11.225 2157 HG3 GLU 80 1HG GLU 80 3.285 -3.364 -11.249 2158 H VAL 81 H VAL 81 6.980 -4.551 -8.725 2159 HA VAL 81 HA VAL 81 8.104 -7.127 -8.677 2160 HB VAL 81 HB VAL 81 8.916 -4.405 -7.591 2161 HG11 VAL 81 1HG1 VAL 81 10.425 -7.066 -7.138 2162 HG12 VAL 81 2HG1 VAL 81 9.900 -5.870 -5.898 2163 HG13 VAL 81 3HG1 VAL 81 11.200 -5.447 -7.052 2164 HG21 VAL 81 3HG2 VAL 81 10.637 -4.633 -9.384 2165 HG22 VAL 81 1HG2 VAL 81 9.010 -4.950 -10.081 2166 HG23 VAL 81 2HG2 VAL 81 10.115 -6.323 -9.715 2167 H PHE 82 H PHE 82 6.966 -5.019 -5.957 2168 HA PHE 82 HA PHE 82 7.574 -6.968 -4.012 2169 HB2 PHE 82 2HB PHE 82 5.524 -4.656 -3.881 2170 HB3 PHE 82 1HB PHE 82 6.109 -5.598 -2.456 2171 HD1 PHE 82 1HD PHE 82 9.042 -5.776 -2.844 2172 HD2 PHE 82 2HD PHE 82 6.341 -2.503 -3.608 2173 HE1 PHE 82 1HE PHE 82 10.875 -4.182 -2.516 2174 HE2 PHE 82 2HE PHE 82 8.187 -0.909 -3.266 2175 HZ PHE 82 HZ PHE 82 10.461 -1.737 -2.706 2176 H ALA 83 H ALA 83 4.618 -6.323 -5.932 2177 HA ALA 83 HA ALA 83 3.014 -8.102 -4.408 2178 HB1 ALA 83 1HB ALA 83 2.655 -7.171 -7.326 2179 HB2 ALA 83 2HB ALA 83 2.001 -6.332 -5.877 2180 HB3 ALA 83 3HB ALA 83 1.396 -7.971 -6.304 2181 H LEU 84 H LEU 84 5.164 -8.486 -7.253 2182 HA LEU 84 HA LEU 84 4.191 -10.925 -8.121 2183 HB2 LEU 84 2HB LEU 84 5.671 -9.493 -9.463 2184 HB3 LEU 84 1HB LEU 84 7.053 -9.828 -8.380 2185 HG LEU 84 HG LEU 84 5.635 -12.188 -9.687 2186 HD11 LEU 84 1HD1 LEU 84 6.836 -11.888 -11.845 2187 HD12 LEU 84 2HD1 LEU 84 7.456 -10.285 -11.294 2188 HD13 LEU 84 3HD1 LEU 84 5.686 -10.535 -11.540 2189 HD21 LEU 84 3HD2 LEU 84 8.640 -11.539 -9.324 2190 HD22 LEU 84 1HD2 LEU 84 7.954 -13.077 -9.961 2191 HD23 LEU 84 2HD2 LEU 84 7.666 -12.608 -8.252 2192 H VAL 85 H VAL 85 6.468 -10.197 -5.469 2193 HA VAL 85 HA VAL 85 7.470 -12.810 -5.322 2194 HB VAL 85 HB VAL 85 8.546 -12.322 -3.331 2195 HG11 VAL 85 1HG1 VAL 85 8.296 -9.591 -4.758 2196 HG12 VAL 85 2HG1 VAL 85 9.223 -10.981 -5.434 2197 HG13 VAL 85 3HG1 VAL 85 9.706 -10.237 -3.868 2198 HG21 VAL 85 3HG2 VAL 85 7.992 -10.218 -1.954 2199 HG22 VAL 85 1HG2 VAL 85 6.815 -11.567 -1.829 2200 HG23 VAL 85 2HG2 VAL 85 6.433 -10.143 -2.846 2201 H THR 86 H THR 86 4.309 -11.875 -4.788 2202 HA THR 86 HA THR 86 3.543 -13.431 -2.634 2203 HB THR 86 HB THR 86 1.961 -12.755 -5.153 2204 HG1 THR 86 1HG THR 86 2.452 -10.902 -4.250 2205 HG21 THR 86 3HG2 THR 86 -0.030 -12.969 -3.595 2206 HG22 THR 86 1HG2 THR 86 1.063 -13.600 -2.303 2207 HG23 THR 86 2HG2 THR 86 0.799 -14.550 -3.822 2208 H ALA 87 H ALA 87 4.773 -14.421 -5.727 2209 HA ALA 87 HA ALA 87 3.751 -17.022 -5.834 2210 HB1 ALA 87 1HB ALA 87 5.808 -17.593 -7.138 2211 HB2 ALA 87 2HB ALA 87 6.577 -16.049 -6.604 2212 HB3 ALA 87 3HB ALA 87 5.133 -16.016 -7.678 2213 H ALA 88 H ALA 88 6.203 -15.578 -3.688 2214 HA ALA 88 HA ALA 88 7.113 -18.158 -2.748 2215 HB1 ALA 88 1HB ALA 88 8.476 -16.848 -1.108 2216 HB2 ALA 88 2HB ALA 88 7.689 -15.328 -1.667 2217 HB3 ALA 88 3HB ALA 88 8.752 -16.258 -2.782 2218 H LEU 89 H LEU 89 5.113 -15.399 -1.672 2219 HA LEU 89 HA LEU 89 4.633 -16.272 0.900 2220 HB2 LEU 89 2HB LEU 89 2.686 -14.650 -0.840 2221 HB3 LEU 89 1HB LEU 89 2.708 -14.721 0.952 2222 HG LEU 89 HG LEU 89 4.949 -13.553 -0.823 2223 HD11 LEU 89 1HD1 LEU 89 2.818 -12.212 -0.881 2224 HD12 LEU 89 2HD1 LEU 89 4.173 -11.346 -0.088 2225 HD13 LEU 89 3HD1 LEU 89 2.868 -12.083 0.914 2226 HD21 LEU 89 3HD2 LEU 89 5.861 -12.610 1.313 2227 HD22 LEU 89 1HD2 LEU 89 5.902 -14.404 1.313 2228 HD23 LEU 89 2HD2 LEU 89 4.633 -13.531 2.250 2229 H ALA 90 H ALA 90 2.800 -16.943 -2.102 2230 HA ALA 90 HA ALA 90 0.624 -18.167 -0.891 2231 HB1 ALA 90 1HB ALA 90 0.628 -17.463 -3.278 2232 HB2 ALA 90 2HB ALA 90 0.187 -19.201 -3.127 2233 HB3 ALA 90 3HB ALA 90 1.852 -18.729 -3.656 2234 H THR 91 H THR 91 3.740 -19.617 -2.005 2235 HA THR 91 HA THR 91 3.019 -22.247 -1.302 2236 HB THR 91 HB THR 91 5.779 -22.281 -1.047 2237 HG1 THR 91 1HG THR 91 5.492 -19.867 -1.467 2238 HG21 THR 91 3HG2 THR 91 4.388 -23.619 -2.637 2239 HG22 THR 91 1HG2 THR 91 5.792 -22.849 -3.468 2240 HG23 THR 91 2HG2 THR 91 4.141 -22.145 -3.643 2241 H ASP 92 H ASP 92 3.792 -19.539 0.841 2242 HA ASP 92 HA ASP 92 5.348 -21.215 2.539 2243 HB2 ASP 92 2HB ASP 92 4.685 -18.312 2.557 2244 HB3 ASP 92 1HB ASP 92 4.755 -19.053 4.189 2245 H PHE 93 H PHE 93 1.929 -20.757 2.251 2246 HA PHE 93 HA PHE 93 1.552 -21.924 4.887 2247 HB2 PHE 93 2HB PHE 93 -0.651 -21.638 4.778 2248 HB3 PHE 93 1HB PHE 93 -0.173 -20.327 3.664 2249 HD1 PHE 93 2HD PHE 93 -0.564 -20.647 1.190 2250 HD2 PHE 93 1HD PHE 93 -1.913 -23.542 4.056 2251 HE1 PHE 93 2HE PHE 93 -2.100 -21.592 -0.496 2252 HE2 PHE 93 1HE PHE 93 -3.467 -24.487 2.372 2253 HZ PHE 93 HZ PHE 93 -3.571 -23.506 0.096 2254 H VAL 94 H VAL 94 1.923 -22.986 1.554 2255 HA VAL 94 HA VAL 94 0.645 -25.462 1.783 2256 HB VAL 94 HB VAL 94 2.837 -24.611 -0.177 2257 HG11 VAL 94 1HG1 VAL 94 2.414 -27.073 -0.276 2258 HG12 VAL 94 2HG1 VAL 94 1.690 -26.272 -1.710 2259 HG13 VAL 94 3HG1 VAL 94 0.638 -26.794 -0.345 2260 HG21 VAL 94 3HG2 VAL 94 0.882 -23.939 -1.644 2261 HG22 VAL 94 1HG2 VAL 94 0.941 -22.953 -0.151 2262 HG23 VAL 94 2HG2 VAL 94 -0.246 -24.294 -0.286 2263 H ARG 95 H ARG 95 3.748 -24.317 2.883 2264 HA ARG 95 HA ARG 95 5.036 -26.815 2.952 2265 HB2 ARG 95 2HB ARG 95 6.040 -24.375 3.358 2266 HB3 ARG 95 1HB ARG 95 5.590 -24.685 5.059 2267 HG2 ARG 95 2HG ARG 95 7.871 -25.361 4.905 2268 HG3 ARG 95 1HG ARG 95 6.940 -26.891 4.860 2269 HD2 ARG 95 2HD ARG 95 7.134 -26.553 2.170 2270 HD3 ARG 95 1HD ARG 95 8.498 -25.448 2.626 2271 HE ARG 95 HE ARG 95 8.415 -28.240 3.795 2272 HH11 ARG 95 1HH2 ARG 95 10.027 -26.192 1.284 2273 HH12 ARG 95 2HH2 ARG 95 10.703 -27.576 0.491 2274 HH21 ARG 95 1HH1 ARG 95 9.395 -29.890 2.874 2275 HH22 ARG 95 2HH1 ARG 95 10.500 -29.747 1.522 2276 H ARG 96 H ARG 96 2.316 -25.660 4.809 2277 HA ARG 96 HA ARG 96 2.833 -27.253 7.106 2278 HB2 ARG 96 2HB ARG 96 0.696 -26.768 7.886 2279 HB3 ARG 96 1HB ARG 96 1.148 -25.297 6.975 2280 HG2 ARG 96 2HG ARG 96 -0.282 -26.172 5.021 2281 HG3 ARG 96 1HG ARG 96 -0.729 -27.576 6.053 2282 HD2 ARG 96 2HD ARG 96 -1.651 -25.980 7.785 2283 HD3 ARG 96 1HD ARG 96 -1.451 -24.622 6.582 2284 HE ARG 96 HE ARG 96 -2.840 -26.511 5.110 2285 HH11 ARG 96 1HH2 ARG 96 -3.453 -25.313 8.474 2286 HH12 ARG 96 2HH2 ARG 96 -5.149 -25.572 8.365 2287 HH21 ARG 96 1HH1 ARG 96 -5.209 -26.988 5.113 2288 HH22 ARG 96 2HH1 ARG 96 -6.119 -26.520 6.473 2289 H GLU 97 H GLU 97 2.018 -28.105 3.866 2290 HA GLU 97 HA GLU 97 0.011 -29.970 4.306 2291 HB2 GLU 97 2HB GLU 97 0.807 -28.860 2.084 2292 HB3 GLU 97 1HB GLU 97 2.047 -30.150 2.009 2293 HG2 GLU 97 2HG GLU 97 0.128 -31.856 1.981 2294 HG3 GLU 97 1HG GLU 97 -1.040 -30.481 2.039 2295 H GLU 98 H GLU 98 3.548 -30.256 4.261 2296 HA GLU 98 HA GLU 98 3.553 -33.082 4.526 2297 HB2 GLU 98 2HB GLU 98 6.083 -32.604 5.046 2298 HB3 GLU 98 1HB GLU 98 5.407 -32.315 3.415 2299 HG2 GLU 98 2HG GLU 98 5.159 -29.813 4.005 2300 HG3 GLU 98 1HG GLU 98 6.064 -30.162 5.524 2301 H GLU 99 H GLU 99 3.595 -30.326 6.785 2302 HA GLU 99 HA GLU 99 4.250 -31.937 9.035 2303 HB2 GLU 99 2HB GLU 99 3.496 -29.060 8.571 2304 HB3 GLU 99 1HB GLU 99 3.258 -29.709 10.221 2305 HG2 GLU 99 2HG GLU 99 5.939 -30.155 8.761 2306 HG3 GLU 99 1HG GLU 99 5.599 -28.642 9.675 2307 H ARG 100 H ARG 100 1.316 -31.567 7.281 2308 HA ARG 100 HA ARG 100 -0.460 -31.993 9.437 2309 HB2 ARG 100 2HB ARG 100 -1.043 -31.270 7.018 2310 HB3 ARG 100 1HB ARG 100 -0.863 -32.989 6.549 2311 HG2 ARG 100 2HG ARG 100 -2.741 -33.537 8.240 2312 HG3 ARG 100 1HG ARG 100 -2.884 -31.777 8.552 2313 HD2 ARG 100 2HD ARG 100 -3.376 -31.438 6.052 2314 HD3 ARG 100 1HD ARG 100 -3.413 -33.224 5.841 2315 HE ARG 100 HE ARG 100 -5.406 -31.448 7.230 2316 HH11 ARG 100 1HH2 ARG 100 -4.554 -34.918 6.802 2317 HH12 ARG 100 2HH2 ARG 100 -6.167 -35.426 6.498 2318 HH21 ARG 100 1HH1 ARG 100 -7.644 -32.153 6.827 2319 HH22 ARG 100 2HH1 ARG 100 -7.967 -33.803 6.797 2320 H ARG 101 H ARG 101 1.645 -34.152 7.573 2321 HA ARG 101 HA ARG 101 0.608 -36.467 9.131 2322 HB2 ARG 101 2HB ARG 101 2.019 -36.343 6.399 2323 HB3 ARG 101 1HB ARG 101 1.851 -37.859 7.356 2324 HG2 ARG 101 2HG ARG 101 -0.570 -37.752 7.295 2325 HG3 ARG 101 1HG ARG 101 -0.546 -36.204 6.374 2326 HD2 ARG 101 2HD ARG 101 0.440 -37.248 4.417 2327 HD3 ARG 101 1HD ARG 101 0.809 -38.784 5.313 2328 HE ARG 101 HE ARG 101 -1.723 -39.007 5.638 2329 HH11 ARG 101 1HH2 ARG 101 0.014 -37.998 2.611 2330 HH12 ARG 101 2HH2 ARG 101 -1.272 -38.430 1.578 2331 HH21 ARG 101 1HH1 ARG 101 -3.459 -39.690 4.153 2332 HH22 ARG 101 2HH1 ARG 101 -3.072 -39.761 2.487 2333 H GLY 102 H GLY 102 3.033 -34.146 9.040 2334 HA2 GLY 102 2HA GLY 102 5.044 -33.983 9.910 2335 HA3 GLY 102 1HA GLY 102 4.709 -35.520 10.786 2336 H HIS 103 H HIS 103 4.802 -35.056 7.264 2337 HA HIS 103 HA HIS 103 7.215 -36.810 7.197 2338 HB2 HIS 103 2HB HIS 103 4.828 -36.951 5.268 2339 HB3 HIS 103 1HB HIS 103 6.425 -37.736 5.014 2340 HD1 HIS 103 1HD HIS 103 5.240 -40.112 4.987 2341 HD2 HIS 103 2HD HIS 103 5.001 -38.114 8.705 2342 HE1 HIS 103 1HE HIS 103 4.421 -41.744 6.662 2343 HE2 HIS 103 2HE HIS 103 4.300 -40.562 8.893 2344 H1 SER 1 H SER 1 -3.145 -24.051 17.313 2345 HA SER 1 HA SER 1 -5.818 -24.558 16.471 2346 HB2 SER 1 2HB SER 1 -5.190 -22.000 18.101 2347 HB3 SER 1 1HB SER 1 -6.747 -22.372 17.280 2348 HG SER 1 1HG SER 1 -6.498 -22.764 19.620 2349 H ALA 2 H ALA 2 -5.100 -24.427 14.366 2350 HA ALA 2 HA ALA 2 -4.499 -23.631 12.462 2351 HB1 ALA 2 1HB ALA 2 -5.801 -21.588 12.930 2352 HB2 ALA 2 2HB ALA 2 -4.337 -21.191 11.962 2353 HB3 ALA 2 3HB ALA 2 -4.383 -20.853 13.739 2354 H ASP 3 H ASP 3 -2.505 -22.260 14.990 2355 HA ASP 3 HA ASP 3 -0.466 -21.877 15.387 2356 HB2 ASP 3 2HB ASP 3 0.074 -24.220 13.578 2357 HB3 ASP 3 1HB ASP 3 1.456 -23.133 13.941 2358 H HIS 4 H HIS 4 -1.207 -21.638 12.000 2359 HA HIS 4 HA HIS 4 0.837 -19.776 11.414 2360 HB2 HIS 4 2HB HIS 4 -0.374 -19.071 9.409 2361 HB3 HIS 4 1HB HIS 4 -0.326 -20.845 9.549 2362 HD1 HIS 4 1HD HIS 4 -3.060 -18.145 10.611 2363 HD2 HIS 4 2HD HIS 4 -2.566 -21.735 8.450 2364 HE1 HIS 4 1HE HIS 4 -5.244 -18.705 9.649 2365 HE2 HIS 4 2HE HIS 4 -4.874 -20.803 8.191 2366 H GLU 5 H GLU 5 -2.182 -19.327 13.183 2367 HA GLU 5 HA GLU 5 -2.580 -16.568 12.725 2368 HB2 GLU 5 2HB GLU 5 -3.077 -18.281 15.266 2369 HB3 GLU 5 1HB GLU 5 -3.537 -16.552 15.130 2370 HG2 GLU 5 2HG GLU 5 -5.196 -17.019 13.398 2371 HG3 GLU 5 1HG GLU 5 -4.746 -18.764 13.376 2372 H ARG 6 H ARG 6 -0.644 -18.449 15.034 2373 HA ARG 6 HA ARG 6 0.030 -16.317 16.712 2374 HB2 ARG 6 2HB ARG 6 1.493 -18.992 16.231 2375 HB3 ARG 6 1HB ARG 6 1.711 -17.927 17.657 2376 HG2 ARG 6 2HG ARG 6 -0.570 -18.390 18.444 2377 HG3 ARG 6 1HG ARG 6 -1.018 -19.190 16.910 2378 HD2 ARG 6 2HD ARG 6 -0.600 -20.900 18.661 2379 HD3 ARG 6 1HD ARG 6 0.586 -21.030 17.289 2380 HE ARG 6 HE ARG 6 1.512 -19.332 19.538 2381 HH11 ARG 6 1HH2 ARG 6 1.515 -22.699 18.107 2382 HH12 ARG 6 2HH2 ARG 6 2.563 -23.304 19.305 2383 HH21 ARG 6 1HH1 ARG 6 3.078 -20.155 20.983 2384 HH22 ARG 6 2HH1 ARG 6 3.526 -21.840 20.999 2385 H GLU 7 H GLU 7 1.653 -17.826 13.885 2386 HA GLU 7 HA GLU 7 4.035 -16.377 14.318 2387 HB2 GLU 7 2HB GLU 7 3.355 -18.531 12.672 2388 HB3 GLU 7 1HB GLU 7 3.606 -17.216 11.493 2389 HG2 GLU 7 2HG GLU 7 5.742 -18.329 11.785 2390 HG3 GLU 7 1HG GLU 7 5.866 -16.742 12.631 2391 H ALA 8 H ALA 8 1.061 -15.740 12.471 2392 HA ALA 8 HA ALA 8 2.022 -13.459 11.107 2393 HB1 ALA 8 1HB ALA 8 -0.112 -14.598 10.422 2394 HB2 ALA 8 2HB ALA 8 -0.422 -12.871 10.835 2395 HB3 ALA 8 3HB ALA 8 -0.855 -14.164 12.005 2396 H GLN 9 H GLN 9 0.318 -13.951 14.202 2397 HA GLN 9 HA GLN 9 0.015 -11.321 14.975 2398 HB2 GLN 9 2HB GLN 9 -1.080 -13.344 16.021 2399 HB3 GLN 9 1HB GLN 9 0.507 -13.835 16.694 2400 HG2 GLN 9 2HG GLN 9 0.522 -11.731 18.119 2401 HG3 GLN 9 1HG GLN 9 -1.103 -11.308 17.457 2402 HE21 GLN 9 1HE2 GLN 9 -2.698 -11.918 18.957 2403 HE22 GLN 9 2HE2 GLN 9 -2.742 -13.446 19.783 2404 H LYS 10 H LYS 10 2.810 -13.559 15.466 2405 HA LYS 10 HA LYS 10 4.141 -11.678 17.135 2406 HB2 LYS 10 2HB LYS 10 4.646 -14.108 17.324 2407 HB3 LYS 10 1HB LYS 10 5.444 -14.054 15.712 2408 HG2 LYS 10 2HG LYS 10 7.109 -12.442 16.515 2409 HG3 LYS 10 1HG LYS 10 6.193 -12.177 18.037 2410 HD2 LYS 10 2HD LYS 10 6.857 -14.409 18.869 2411 HD3 LYS 10 1HD LYS 10 7.573 -14.826 17.274 2412 HE2 LYS 10 2HE LYS 10 9.371 -14.135 18.900 2413 HE3 LYS 10 1HE LYS 10 9.267 -13.039 17.472 2414 HZ1 LYS 10 3HZ LYS 10 9.489 -11.651 19.248 2415 HZ2 LYS 10 1HZ LYS 10 8.474 -12.473 20.276 2416 HZ3 LYS 10 2HZ LYS 10 7.799 -11.574 19.047 2417 H ALA 11 H ALA 11 4.050 -12.225 13.618 2418 HA ALA 11 HA ALA 11 6.346 -10.778 12.979 2419 HB1 ALA 11 1HB ALA 11 5.367 -10.469 10.723 2420 HB2 ALA 11 2HB ALA 11 3.734 -10.906 11.345 2421 HB3 ALA 11 3HB ALA 11 5.043 -12.143 11.300 2422 H GLU 12 H GLU 12 3.020 -9.685 13.720 2423 HA GLU 12 HA GLU 12 3.373 -7.008 13.022 2424 HB2 GLU 12 2HB GLU 12 1.646 -7.997 15.377 2425 HB3 GLU 12 1HB GLU 12 1.464 -6.480 14.430 2426 HG2 GLU 12 2HG GLU 12 0.887 -7.951 12.386 2427 HG3 GLU 12 1HG GLU 12 0.933 -9.380 13.484 2428 H GLU 13 H GLU 13 4.238 -8.797 15.957 2429 HA GLU 13 HA GLU 13 4.695 -6.553 17.649 2430 HB2 GLU 13 2HB GLU 13 4.375 -8.961 18.520 2431 HB3 GLU 13 1HB GLU 13 5.932 -9.377 17.745 2432 HG2 GLU 13 2HG GLU 13 6.898 -7.396 19.301 2433 HG3 GLU 13 1HG GLU 13 5.411 -7.687 20.254 2434 H GLU 14 H GLU 14 6.646 -8.620 15.512 2435 HA GLU 14 HA GLU 14 9.168 -7.773 16.153 2436 HB2 GLU 14 2HB GLU 14 8.601 -9.746 14.679 2437 HB3 GLU 14 1HB GLU 14 8.093 -8.607 13.392 2438 HG2 GLU 14 2HG GLU 14 10.244 -9.424 12.767 2439 HG3 GLU 14 1HG GLU 14 10.486 -7.721 13.287 2440 H LEU 15 H LEU 15 6.883 -6.405 13.743 2441 HA LEU 15 HA LEU 15 8.639 -4.566 12.674 2442 HB2 LEU 15 2HB LEU 15 6.405 -5.142 11.691 2443 HB3 LEU 15 1HB LEU 15 5.586 -4.261 13.020 2444 HG LEU 15 HG LEU 15 6.526 -2.116 12.234 2445 HD11 LEU 15 1HD1 LEU 15 8.758 -2.703 11.470 2446 HD12 LEU 15 2HD1 LEU 15 7.894 -2.045 10.058 2447 HD13 LEU 15 3HD1 LEU 15 8.115 -3.822 10.216 2448 HD21 LEU 15 3HD2 LEU 15 5.384 -1.970 10.006 2449 HD22 LEU 15 1HD2 LEU 15 4.411 -2.870 11.222 2450 HD23 LEU 15 2HD2 LEU 15 5.291 -3.767 9.937 2451 H GLN 16 H GLN 16 6.674 -4.363 15.595 2452 HA GLN 16 HA GLN 16 6.843 -1.566 15.928 2453 HB2 GLN 16 2HB GLN 16 6.369 -3.785 17.992 2454 HB3 GLN 16 1HB GLN 16 6.075 -2.038 18.275 2455 HG2 GLN 16 2HG GLN 16 4.275 -1.954 16.647 2456 HG3 GLN 16 1HG GLN 16 4.705 -3.550 15.954 2457 HE21 GLN 16 1HE2 GLN 16 2.798 -4.664 16.358 2458 HE22 GLN 16 2HE2 GLN 16 2.059 -4.857 17.916 2459 H LYS 17 H LYS 17 9.000 -4.288 16.833 2460 HA LYS 17 HA LYS 17 10.554 -2.567 18.528 2461 HB2 LYS 17 2HB LYS 17 11.793 -4.352 19.171 2462 HB3 LYS 17 1HB LYS 17 10.317 -5.209 18.620 2463 HG2 LYS 17 2HG LYS 17 11.623 -5.481 16.326 2464 HG3 LYS 17 1HG LYS 17 13.063 -4.958 17.261 2465 HD2 LYS 17 2HD LYS 17 12.508 -6.933 18.890 2466 HD3 LYS 17 1HD LYS 17 11.285 -7.426 17.659 2467 HE2 LYS 17 2HE LYS 17 13.306 -7.327 15.938 2468 HE3 LYS 17 1HE LYS 17 14.368 -7.350 17.398 2469 HZ1 LYS 17 3HZ LYS 17 14.048 -9.535 16.574 2470 HZ2 LYS 17 1HZ LYS 17 12.369 -9.343 16.482 2471 HZ3 LYS 17 2HZ LYS 17 13.135 -9.462 18.012 2472 H VAL 18 H VAL 18 10.513 -3.390 15.090 2473 HA VAL 18 HA VAL 18 13.218 -2.681 14.614 2474 HB VAL 18 HB VAL 18 10.856 -3.005 12.702 2475 HG11 VAL 18 1HG1 VAL 18 13.869 -2.553 12.114 2476 HG12 VAL 18 2HG1 VAL 18 12.497 -1.505 11.593 2477 HG13 VAL 18 3HG1 VAL 18 12.673 -3.154 10.912 2478 HG21 VAL 18 3HG2 VAL 18 11.983 -5.184 12.199 2479 HG22 VAL 18 1HG2 VAL 18 11.640 -5.088 13.955 2480 HG23 VAL 18 2HG2 VAL 18 13.305 -4.799 13.359 2481 H LEU 19 H LEU 19 10.090 -0.948 14.170 2482 HA LEU 19 HA LEU 19 11.329 1.380 13.172 2483 HB2 LEU 19 2HB LEU 19 9.160 2.499 13.448 2484 HB3 LEU 19 1HB LEU 19 9.001 0.886 12.726 2485 HG LEU 19 HG LEU 19 8.461 0.087 15.201 2486 HD11 LEU 19 1HD1 LEU 19 7.519 3.031 15.338 2487 HD12 LEU 19 2HD1 LEU 19 8.824 2.331 16.356 2488 HD13 LEU 19 3HD1 LEU 19 7.145 1.729 16.518 2489 HD21 LEU 19 3HD2 LEU 19 6.466 1.632 13.425 2490 HD22 LEU 19 1HD2 LEU 19 6.033 0.440 14.705 2491 HD23 LEU 19 2HD2 LEU 19 6.950 -0.098 13.252 2492 H GLU 20 H GLU 20 10.718 0.215 16.482 2493 HA GLU 20 HA GLU 20 11.267 2.682 17.706 2494 HB2 GLU 20 2HB GLU 20 11.317 -0.147 18.824 2495 HB3 GLU 20 1HB GLU 20 11.775 1.300 19.790 2496 HG2 GLU 20 2HG GLU 20 9.563 2.363 19.323 2497 HG3 GLU 20 1HG GLU 20 9.037 0.916 18.408 2498 H GLU 21 H GLU 21 13.462 -0.092 16.874 2499 HA GLU 21 HA GLU 21 15.734 1.147 17.987 2500 HB2 GLU 21 2HB GLU 21 15.212 -1.132 16.127 2501 HB3 GLU 21 1HB GLU 21 16.767 -0.318 15.798 2502 HG2 GLU 21 2HG GLU 21 15.945 -1.424 18.554 2503 HG3 GLU 21 1HG GLU 21 17.034 -2.233 17.367 2504 H ALA 22 H ALA 22 14.235 1.392 14.771 2505 HA ALA 22 HA ALA 22 16.241 2.951 13.597 2506 HB1 ALA 22 1HB ALA 22 13.222 2.995 13.001 2507 HB2 ALA 22 2HB ALA 22 14.404 1.834 12.292 2508 HB3 ALA 22 3HB ALA 22 14.534 3.593 11.921 2509 H SER 23 H SER 23 13.722 3.820 15.879 2510 HA SER 23 HA SER 23 13.541 6.575 15.305 2511 HB2 SER 23 2HB SER 23 13.243 5.219 18.081 2512 HB3 SER 23 1HB SER 23 12.549 6.794 17.560 2513 HG SER 23 1HG SER 23 11.938 4.223 16.417 2514 H LYS 24 H LYS 24 15.599 4.642 17.490 2515 HA LYS 24 HA LYS 24 16.827 6.822 18.813 2516 HB2 LYS 24 2HB LYS 24 16.821 4.585 19.832 2517 HB3 LYS 24 1HB LYS 24 17.659 3.863 18.426 2518 HG2 LYS 24 2HG LYS 24 19.039 6.108 19.960 2519 HG3 LYS 24 1HG LYS 24 18.910 4.504 20.749 2520 HD2 LYS 24 2HD LYS 24 20.393 3.467 19.347 2521 HD3 LYS 24 1HD LYS 24 19.933 4.440 17.912 2522 HE2 LYS 24 2HE LYS 24 21.218 6.397 18.687 2523 HE3 LYS 24 1HE LYS 24 21.633 5.566 20.238 2524 HZ1 LYS 24 3HZ LYS 24 23.002 4.042 19.067 2525 HZ2 LYS 24 1HZ LYS 24 23.390 5.596 18.510 2526 HZ3 LYS 24 2HZ LYS 24 22.511 4.572 17.540 2527 H LYS 25 H LYS 25 17.404 4.998 15.873 2528 HA LYS 25 HA LYS 25 19.993 6.106 15.389 2529 HB2 LYS 25 2HB LYS 25 18.079 4.585 13.538 2530 HB3 LYS 25 1HB LYS 25 19.776 5.020 13.149 2531 HG2 LYS 25 2HG LYS 25 20.582 3.657 15.090 2532 HG3 LYS 25 1HG LYS 25 18.899 3.177 15.491 2533 HD2 LYS 25 2HD LYS 25 18.701 1.984 13.285 2534 HD3 LYS 25 1HD LYS 25 20.320 2.598 12.832 2535 HE2 LYS 25 2HE LYS 25 20.833 0.420 13.427 2536 HE3 LYS 25 1HE LYS 25 21.240 1.303 14.944 2537 HZ1 LYS 25 3HZ LYS 25 20.090 -0.795 15.250 2538 HZ2 LYS 25 1HZ LYS 25 18.750 -0.283 14.427 2539 HZ3 LYS 25 2HZ LYS 25 19.157 0.407 15.945 2540 H ALA 26 H ALA 26 16.675 6.677 14.029 2541 HA ALA 26 HA ALA 26 17.288 8.491 12.139 2542 HB1 ALA 26 1HB ALA 26 14.927 9.244 12.259 2543 HB2 ALA 26 2HB ALA 26 14.741 8.455 13.874 2544 HB3 ALA 26 3HB ALA 26 15.037 7.461 12.397 2545 H VAL 27 H VAL 27 16.614 9.206 15.601 2546 HA VAL 27 HA VAL 27 16.630 12.001 15.182 2547 HB VAL 27 HB VAL 27 15.492 10.928 17.032 2548 HG11 VAL 27 1HG1 VAL 27 16.609 9.939 18.933 2549 HG12 VAL 27 2HG1 VAL 27 18.249 10.342 18.289 2550 HG13 VAL 27 3HG1 VAL 27 17.218 9.117 17.472 2551 HG21 VAL 27 3HG2 VAL 27 16.114 13.331 17.176 2552 HG22 VAL 27 1HG2 VAL 27 17.665 12.906 17.996 2553 HG23 VAL 27 2HG2 VAL 27 16.093 12.551 18.803 2554 H GLU 28 H GLU 28 19.226 9.663 15.632 2555 HA GLU 28 HA GLU 28 21.155 11.732 16.303 2556 HB2 GLU 28 2HB GLU 28 21.037 9.341 17.298 2557 HB3 GLU 28 1HB GLU 28 21.655 8.741 15.737 2558 HG2 GLU 28 2HG GLU 28 23.202 10.971 17.205 2559 HG3 GLU 28 1HG GLU 28 23.239 9.308 17.893 2560 H ALA 29 H ALA 29 20.046 9.694 13.661 2561 HA ALA 29 HA ALA 29 22.020 10.156 11.790 2562 HB1 ALA 29 1HB ALA 29 19.028 9.564 11.396 2563 HB2 ALA 29 2HB ALA 29 20.294 8.323 11.708 2564 HB3 ALA 29 3HB ALA 29 20.317 9.277 10.206 2565 H GLU 30 H GLU 30 18.779 11.737 12.209 2566 HA GLU 30 HA GLU 30 19.344 13.644 10.227 2567 HB2 GLU 30 2HB GLU 30 17.040 12.951 10.915 2568 HB3 GLU 30 1HB GLU 30 17.260 13.840 12.455 2569 HG2 GLU 30 2HG GLU 30 16.585 15.755 11.434 2570 HG3 GLU 30 1HG GLU 30 18.016 15.683 10.351 2571 H ARG 31 H ARG 31 19.846 13.680 13.802 2572 HA ARG 31 HA ARG 31 20.358 16.464 13.911 2573 HB2 ARG 31 2HB ARG 31 21.048 14.152 15.744 2574 HB3 ARG 31 1HB ARG 31 21.816 15.732 16.044 2575 HG2 ARG 31 2HG ARG 31 18.802 15.689 15.664 2576 HG3 ARG 31 1HG ARG 31 19.461 15.041 17.195 2577 HD2 ARG 31 2HD ARG 31 20.140 17.855 16.080 2578 HD3 ARG 31 1HD ARG 31 18.872 17.535 17.333 2579 HE ARG 31 HE ARG 31 20.985 16.280 18.496 2580 HH11 ARG 31 1HH2 ARG 31 21.059 19.529 16.862 2581 HH12 ARG 31 2HH2 ARG 31 21.947 20.273 18.099 2582 HH21 ARG 31 1HH1 ARG 31 22.481 17.218 19.965 2583 HH22 ARG 31 2HH1 ARG 31 22.903 18.869 19.905 2584 H GLY 32 H GLY 32 21.812 17.377 12.614 2585 HA2 GLY 32 2HA GLY 32 24.222 17.909 12.876 2586 HA3 GLY 32 1HA GLY 32 24.485 16.178 12.398 2587 H ALA 33 H ALA 33 21.885 16.370 10.763 2588 HA ALA 33 HA ALA 33 23.340 16.787 8.376 2589 HB1 ALA 33 1HB ALA 33 20.371 16.093 8.821 2590 HB2 ALA 33 2HB ALA 33 21.707 14.901 8.657 2591 HB3 ALA 33 3HB ALA 33 21.259 15.949 7.259 2592 HA PRO 34 HA PRO 34 21.579 20.824 7.578 2593 HB2 PRO 34 2HB PRO 34 21.843 21.097 4.824 2594 HB3 PRO 34 1HB PRO 34 23.257 21.104 5.949 2595 HG2 PRO 34 2HG PRO 34 22.165 18.734 4.340 2596 HG3 PRO 34 1HG PRO 34 23.876 19.310 4.483 2597 HD2 PRO 34 2HD PRO 34 22.846 17.232 6.029 2598 HD3 PRO 34 1HD PRO 34 24.078 18.388 6.701 2599 H GLY 35 H GLY 35 19.465 21.601 7.359 2600 HA2 GLY 35 2HA GLY 35 17.406 21.793 6.498 2601 HA3 GLY 35 1HA GLY 35 17.745 20.443 5.351 2602 H ALA 36 H ALA 36 18.547 19.769 8.582 2603 HA ALA 36 HA ALA 36 16.935 17.601 8.886 2604 HB1 ALA 36 1HB ALA 36 18.198 19.441 11.034 2605 HB2 ALA 36 2HB ALA 36 18.971 17.992 10.285 2606 HB3 ALA 36 3HB ALA 36 17.552 17.797 11.370 2607 H ALA 37 H ALA 37 14.920 17.175 9.690 2608 HA ALA 37 HA ALA 37 13.329 19.449 10.742 2609 HB1 ALA 37 1HB ALA 37 12.473 17.021 9.028 2610 HB2 ALA 37 2HB ALA 37 12.509 18.733 8.484 2611 HB3 ALA 37 3HB ALA 37 11.330 18.229 9.749 2612 H LEU 38 H LEU 38 14.315 16.030 10.911 2613 HA LEU 38 HA LEU 38 12.459 15.383 13.001 2614 HB2 LEU 38 2HB LEU 38 13.312 13.947 11.026 2615 HB3 LEU 38 1HB LEU 38 14.790 13.709 11.979 2616 HG LEU 38 HG LEU 38 11.937 12.973 12.924 2617 HD11 LEU 38 1HD1 LEU 38 12.576 10.619 12.287 2618 HD12 LEU 38 2HD1 LEU 38 14.089 11.251 11.540 2619 HD13 LEU 38 3HD1 LEU 38 12.487 11.728 10.874 2620 HD21 LEU 38 3HD2 LEU 38 14.712 12.149 14.006 2621 HD22 LEU 38 1HD2 LEU 38 13.153 11.394 14.496 2622 HD23 LEU 38 2HD2 LEU 38 13.464 13.119 14.882 2623 H ILE 39 H ILE 39 12.908 15.632 15.289 2624 HA ILE 39 HA ILE 39 15.626 15.505 16.132 2625 HB ILE 39 HB ILE 39 15.361 17.647 17.517 2626 HG12 ILE 39 2HG1 ILE 39 13.140 18.312 15.471 2627 HG13 ILE 39 1HG1 ILE 39 12.843 17.855 17.183 2628 HG21 ILE 39 1HG2 ILE 39 16.234 19.128 15.781 2629 HG22 ILE 39 2HG2 ILE 39 15.481 18.137 14.479 2630 HG23 ILE 39 3HG2 ILE 39 16.827 17.460 15.453 2631 HD11 ILE 39 3HD ILE 39 14.370 20.360 16.203 2632 HD12 ILE 39 1HD ILE 39 12.766 20.297 17.021 2633 HD13 ILE 39 2HD ILE 39 14.252 19.844 17.925 2634 H SER 40 H SER 40 15.420 15.828 18.650 2635 HA SER 40 HA SER 40 14.696 15.270 20.565 2636 HB2 SER 40 2HB SER 40 11.924 15.858 19.446 2637 HB3 SER 40 1HB SER 40 12.239 15.507 21.180 2638 HG SER 40 1HG SER 40 12.245 17.762 20.393 2639 H TYR 41 H TYR 41 14.838 13.401 21.577 2640 HA TYR 41 HA TYR 41 14.402 11.027 20.305 2641 HB2 TYR 41 2HB TYR 41 14.492 11.205 23.368 2642 HB3 TYR 41 1HB TYR 41 15.094 9.899 22.293 2643 HD1 TYR 41 2HD TYR 41 17.175 10.333 20.908 2644 HD2 TYR 41 1HD TYR 41 15.795 13.156 23.837 2645 HE1 TYR 41 2HE TYR 41 19.324 11.539 20.753 2646 HE2 TYR 41 1HE TYR 41 17.932 14.352 23.706 2647 HH TYR 41 HH TYR 41 20.038 14.354 22.851 2648 HA PRO 42 HA PRO 42 10.458 10.090 22.569 2649 HB2 PRO 42 2HB PRO 42 8.838 12.032 23.782 2650 HB3 PRO 42 1HB PRO 42 10.177 11.184 24.643 2651 HG2 PRO 42 2HG PRO 42 10.282 13.913 23.239 2652 HG3 PRO 42 1HG PRO 42 10.833 13.507 24.918 2653 HD2 PRO 42 2HD PRO 42 12.596 13.594 22.816 2654 HD3 PRO 42 1HD PRO 42 12.742 12.273 24.069 2655 H ASP 43 H ASP 43 10.825 12.873 20.542 2656 HA ASP 43 HA ASP 43 8.111 12.734 19.523 2657 HB2 ASP 43 2HB ASP 43 10.517 14.439 18.609 2658 HB3 ASP 43 1HB ASP 43 8.857 14.512 17.927 2659 H ALA 44 H ALA 44 11.476 11.908 18.683 2660 HA ALA 44 HA ALA 44 11.172 11.107 16.105 2661 HB1 ALA 44 1HB ALA 44 13.384 11.329 17.238 2662 HB2 ALA 44 2HB ALA 44 13.236 9.723 16.439 2663 HB3 ALA 44 3HB ALA 44 13.036 9.864 18.228 2664 H ILE 45 H ILE 45 10.594 9.166 19.069 2665 HA ILE 45 HA ILE 45 10.205 6.769 17.640 2666 HB ILE 45 HB ILE 45 10.812 6.653 19.921 2667 HG12 ILE 45 2HG1 ILE 45 7.938 5.579 19.632 2668 HG13 ILE 45 1HG1 ILE 45 9.412 4.822 18.945 2669 HG21 ILE 45 1HG2 ILE 45 9.846 8.769 20.745 2670 HG22 ILE 45 2HG2 ILE 45 9.313 7.418 21.778 2671 HG23 ILE 45 3HG2 ILE 45 8.175 8.126 20.580 2672 HD11 ILE 45 3HD ILE 45 8.858 5.275 21.960 2673 HD12 ILE 45 1HD ILE 45 8.779 3.717 21.073 2674 HD13 ILE 45 2HD ILE 45 10.360 4.553 21.269 2675 H TRP 46 H TRP 46 8.094 9.511 18.211 2676 HA TRP 46 HA TRP 46 5.755 7.949 17.576 2677 HB2 TRP 46 2HB TRP 46 6.257 10.293 19.053 2678 HB3 TRP 46 1HB TRP 46 5.447 10.924 17.597 2679 HD1 TRP 46 HD TRP 46 2.834 11.019 18.066 2680 HE1 TRP 46 1HE TRP 46 1.189 9.791 19.638 2681 HE3 TRP 46 3HE TRP 46 6.053 7.606 20.073 2682 HZ2 TRP 46 2HZ TRP 46 1.277 7.692 21.556 2683 HZ3 TRP 46 3HZ TRP 46 5.217 5.996 21.751 2684 HH2 TRP 46 HH TRP 46 2.864 6.046 22.491 2685 H TRP 47 H TRP 47 8.170 9.718 15.846 2686 HA TRP 47 HA TRP 47 6.637 10.191 13.460 2687 HB2 TRP 47 2HB TRP 47 8.681 11.524 13.878 2688 HB3 TRP 47 1HB TRP 47 9.658 10.032 14.064 2689 HD1 TRP 47 HD TRP 47 7.871 12.014 11.177 2690 HE1 TRP 47 1HE TRP 47 8.885 11.262 8.993 2691 HE3 TRP 47 3HE TRP 47 10.903 8.342 13.003 2692 HZ2 TRP 47 2HZ TRP 47 10.864 9.349 8.111 2693 HZ3 TRP 47 3HZ TRP 47 12.308 7.049 11.441 2694 HH2 TRP 47 HH TRP 47 12.300 7.555 9.020 2695 H SER 48 H SER 48 8.910 7.685 14.747 2696 HA SER 48 HA SER 48 8.861 6.098 12.527 2697 HB2 SER 48 2HB SER 48 9.206 5.194 15.432 2698 HB3 SER 48 1HB SER 48 9.846 4.376 13.955 2699 HG SER 48 1HG SER 48 11.184 5.896 15.268 2700 H VAL 49 H VAL 49 6.451 6.332 15.099 2701 HA VAL 49 HA VAL 49 5.172 3.866 14.607 2702 HB VAL 49 HB VAL 49 4.261 6.485 15.886 2703 HG11 VAL 49 1HG1 VAL 49 2.699 3.813 15.741 2704 HG12 VAL 49 2HG1 VAL 49 2.174 5.396 15.063 2705 HG13 VAL 49 3HG1 VAL 49 2.302 5.187 16.839 2706 HG21 VAL 49 3HG2 VAL 49 4.570 5.207 17.995 2707 HG22 VAL 49 1HG2 VAL 49 6.070 5.029 17.024 2708 HG23 VAL 49 2HG2 VAL 49 4.887 3.689 17.078 2709 H GLU 50 H GLU 50 4.845 7.099 12.956 2710 HA GLU 50 HA GLU 50 2.551 5.992 11.505 2711 HB2 GLU 50 2HB GLU 50 2.308 8.085 10.322 2712 HB3 GLU 50 1HB GLU 50 2.223 8.325 12.083 2713 HG2 GLU 50 2HG GLU 50 4.503 9.347 12.091 2714 HG3 GLU 50 1HG GLU 50 4.698 8.978 10.337 2715 H THR 51 H THR 51 5.806 5.690 11.398 2716 HA THR 51 HA THR 51 5.958 5.535 8.475 2717 HB THR 51 HB THR 51 8.215 5.395 10.559 2718 HG1 THR 51 1HG THR 51 7.349 7.424 10.622 2719 HG21 THR 51 3HG2 THR 51 8.215 5.758 7.471 2720 HG22 THR 51 1HG2 THR 51 8.947 4.395 8.407 2721 HG23 THR 51 2HG2 THR 51 9.645 6.034 8.526 2722 H ALA 52 H ALA 52 7.431 3.282 8.128 2723 HA ALA 52 HA ALA 52 7.597 1.101 8.344 2724 HB1 ALA 52 1HB ALA 52 6.892 -0.272 10.217 2725 HB2 ALA 52 2HB ALA 52 5.899 1.054 10.899 2726 HB3 ALA 52 3HB ALA 52 7.685 1.203 10.880 2727 H THR 53 H THR 53 4.362 2.501 9.052 2728 HA THR 53 HA THR 53 2.968 0.306 7.928 2729 HB THR 53 HB THR 53 1.032 1.993 8.412 2730 HG1 THR 53 1HG THR 53 1.678 3.786 9.575 2731 HG21 THR 53 3HG2 THR 53 1.791 0.152 9.991 2732 HG22 THR 53 1HG2 THR 53 1.282 1.632 10.881 2733 HG23 THR 53 2HG2 THR 53 3.031 1.264 10.686 2734 H THR 54 H THR 54 4.744 2.534 6.377 2735 HA THR 54 HA THR 54 4.800 3.526 4.432 2736 HB THR 54 HB THR 54 3.666 2.455 2.444 2737 HG1 THR 54 1HG THR 54 2.242 1.327 4.340 2738 HG21 THR 54 3HG2 THR 54 5.350 0.667 4.347 2739 HG22 THR 54 1HG2 THR 54 6.007 1.942 3.247 2740 HG23 THR 54 2HG2 THR 54 5.187 0.499 2.560 2741 H VAL 55 H VAL 55 3.518 5.179 5.988 2742 HA VAL 55 HA VAL 55 1.556 6.317 4.166 2743 HB VAL 55 HB VAL 55 1.268 6.429 7.234 2744 HG11 VAL 55 1HG1 VAL 55 0.384 8.434 5.922 2745 HG12 VAL 55 2HG1 VAL 55 -0.953 7.465 6.633 2746 HG13 VAL 55 3HG1 VAL 55 -0.560 7.313 4.880 2747 HG21 VAL 55 3HG2 VAL 55 0.783 4.127 6.565 2748 HG22 VAL 55 1HG2 VAL 55 -0.185 4.684 5.154 2749 HG23 VAL 55 2HG2 VAL 55 -0.779 4.974 6.836 2750 H GLY 56 H GLY 56 2.561 7.721 7.291 2751 HA2 GLY 56 2HA GLY 56 4.060 9.348 7.713 2752 HA3 GLY 56 1HA GLY 56 4.655 9.266 6.004 2753 H TYR 57 H TYR 57 2.670 11.048 8.227 2754 HA TYR 57 HA TYR 57 0.850 11.953 6.097 2755 HB2 TYR 57 2HB TYR 57 1.083 12.674 9.097 2756 HB3 TYR 57 1HB TYR 57 -0.087 13.464 7.963 2757 HD1 TYR 57 1HD TYR 57 -1.540 11.789 6.505 2758 HD2 TYR 57 2HD TYR 57 0.253 10.824 10.285 2759 HE1 TYR 57 1HE TYR 57 -3.198 9.996 6.831 2760 HE2 TYR 57 2HE TYR 57 -1.389 9.023 10.614 2761 HH TYR 57 HH TYR 57 -3.676 8.121 8.010 2762 H GLY 58 H GLY 58 3.895 12.705 7.412 2763 HA2 GLY 58 2HA GLY 58 5.279 14.185 6.277 2764 HA3 GLY 58 1HA GLY 58 3.870 15.226 5.865 2765 H ASP 59 H ASP 59 4.352 13.876 9.082 2766 HA ASP 59 HA ASP 59 4.304 16.392 10.331 2767 HB2 ASP 59 2HB ASP 59 3.614 14.180 11.431 2768 HB3 ASP 59 1HB ASP 59 5.343 13.723 11.511 2769 H ARG 60 H ARG 60 7.003 13.992 9.777 2770 HA ARG 60 HA ARG 60 8.812 16.210 9.553 2771 HB2 ARG 60 2HB ARG 60 9.503 13.854 11.408 2772 HB3 ARG 60 1HB ARG 60 10.563 15.235 10.966 2773 HG2 ARG 60 2HG ARG 60 8.795 16.793 11.995 2774 HG3 ARG 60 1HG ARG 60 7.932 15.334 12.592 2775 HD2 ARG 60 2HD ARG 60 9.907 14.731 14.024 2776 HD3 ARG 60 1HD ARG 60 10.780 16.200 13.420 2777 HE ARG 60 HE ARG 60 8.322 16.122 15.129 2778 HH11 ARG 60 1HH2 ARG 60 10.797 18.200 13.419 2779 HH12 ARG 60 2HH2 ARG 60 10.154 19.646 14.052 2780 HH21 ARG 60 1HH1 ARG 60 7.815 18.091 16.294 2781 HH22 ARG 60 2HH1 ARG 60 8.460 19.607 15.794 2782 H TYR 61 H TYR 61 10.850 15.296 8.340 2783 HA TYR 61 HA TYR 61 10.092 13.019 6.746 2784 HB2 TYR 61 2HB TYR 61 11.020 14.183 4.691 2785 HB3 TYR 61 1HB TYR 61 9.495 14.940 5.256 2786 HD1 TYR 61 1HD TYR 61 13.236 15.330 5.220 2787 HD2 TYR 61 2HD TYR 61 9.461 17.274 5.875 2788 HE1 TYR 61 1HE TYR 61 14.401 17.465 5.467 2789 HE2 TYR 61 2HE TYR 61 10.614 19.445 6.042 2790 HH TYR 61 HH TYR 61 14.176 19.618 6.290 2791 HA PRO 62 HA PRO 62 14.503 12.970 7.879 2792 HB2 PRO 62 2HB PRO 62 15.311 10.597 6.630 2793 HB3 PRO 62 1HB PRO 62 14.270 10.629 8.091 2794 HG2 PRO 62 2HG PRO 62 13.450 10.114 5.207 2795 HG3 PRO 62 1HG PRO 62 12.775 9.437 6.739 2796 HD2 PRO 62 2HD PRO 62 11.727 11.653 5.212 2797 HD3 PRO 62 1HD PRO 62 11.241 11.167 6.902 2798 H VAL 63 H VAL 63 16.550 13.587 6.927 2799 HA VAL 63 HA VAL 63 16.341 14.285 4.070 2800 HB VAL 63 HB VAL 63 16.552 15.984 5.970 2801 HG11 VAL 63 1HG1 VAL 63 19.548 15.261 5.782 2802 HG12 VAL 63 2HG1 VAL 63 18.452 14.873 7.162 2803 HG13 VAL 63 3HG1 VAL 63 18.780 16.584 6.729 2804 HG21 VAL 63 3HG2 VAL 63 17.727 17.565 4.536 2805 HG22 VAL 63 1HG2 VAL 63 16.634 16.532 3.548 2806 HG23 VAL 63 2HG2 VAL 63 18.424 16.255 3.524 2807 H THR 64 H THR 64 18.853 14.550 3.193 2808 HA THR 64 HA THR 64 19.380 12.023 2.426 2809 HB THR 64 HB THR 64 21.259 14.456 2.307 2810 HG1 THR 64 1HG THR 64 18.932 13.876 0.794 2811 HG21 THR 64 3HG2 THR 64 22.149 12.341 1.217 2812 HG22 THR 64 1HG2 THR 64 21.844 13.668 0.043 2813 HG23 THR 64 2HG2 THR 64 20.697 12.292 0.160 2814 H GLU 65 H GLU 65 21.263 14.010 4.748 2815 HA GLU 65 HA GLU 65 23.415 12.129 4.761 2816 HB2 GLU 65 2HB GLU 65 23.642 14.664 4.709 2817 HB3 GLU 65 1HB GLU 65 23.090 14.699 6.420 2818 HG2 GLU 65 2HG GLU 65 25.086 13.468 7.144 2819 HG3 GLU 65 1HG GLU 65 25.543 13.111 5.446 2820 H GLU 66 H GLU 66 20.409 12.098 6.290 2821 HA GLU 66 HA GLU 66 21.232 11.120 8.813 2822 HB2 GLU 66 2HB GLU 66 18.988 10.747 9.289 2823 HB3 GLU 66 1HB GLU 66 18.874 12.035 8.099 2824 HG2 GLU 66 2HG GLU 66 17.305 10.801 7.135 2825 HG3 GLU 66 1HG GLU 66 18.604 9.814 6.418 2826 H GLY 67 H GLY 67 20.979 10.030 5.583 2827 HA2 GLY 67 2HA GLY 67 21.988 8.261 4.591 2828 HA3 GLY 67 1HA GLY 67 22.218 7.470 6.224 2829 H ARG 68 H ARG 68 19.706 8.634 3.894 2830 HA ARG 68 HA ARG 68 17.555 7.891 5.303 2831 HB2 ARG 68 2HB ARG 68 17.837 8.541 2.383 2832 HB3 ARG 68 1HB ARG 68 16.349 7.702 2.900 2833 HG2 ARG 68 2HG ARG 68 16.199 9.414 4.842 2834 HG3 ARG 68 1HG ARG 68 17.293 10.433 3.859 2835 HD2 ARG 68 2HD ARG 68 14.546 9.277 2.956 2836 HD3 ARG 68 1HD ARG 68 14.778 10.914 3.640 2837 HE ARG 68 HE ARG 68 15.366 9.869 0.997 2838 HH11 ARG 68 1HH2 ARG 68 14.929 12.762 3.051 2839 HH12 ARG 68 2HH2 ARG 68 14.507 13.687 1.714 2840 HH21 ARG 68 1HH1 ARG 68 14.434 11.360 -0.545 2841 HH22 ARG 68 2HH1 ARG 68 14.659 12.889 -0.442 2842 H LYS 69 H LYS 69 19.628 5.627 4.340 2843 HA LYS 69 HA LYS 69 17.842 3.412 4.042 2844 HB2 LYS 69 2HB LYS 69 20.713 3.457 5.087 2845 HB3 LYS 69 1HB LYS 69 19.757 2.015 4.591 2846 HG2 LYS 69 2HG LYS 69 19.731 2.803 2.245 2847 HG3 LYS 69 1HG LYS 69 20.699 4.256 2.703 2848 HD2 LYS 69 2HD LYS 69 22.478 2.717 3.654 2849 HD3 LYS 69 1HD LYS 69 21.527 1.306 3.063 2850 HE2 LYS 69 2HE LYS 69 21.838 2.068 0.682 2851 HE3 LYS 69 1HE LYS 69 22.735 3.527 1.275 2852 HZ1 LYS 69 3HZ LYS 69 24.189 1.695 2.450 2853 HZ2 LYS 69 1HZ LYS 69 24.415 2.111 0.816 2854 HZ3 LYS 69 2HZ LYS 69 23.583 0.692 1.247 2855 H VAL 70 H VAL 70 18.301 5.608 6.717 2856 HA VAL 70 HA VAL 70 17.848 3.459 8.630 2857 HB VAL 70 HB VAL 70 17.428 6.438 9.104 2858 HG11 VAL 70 1HG1 VAL 70 17.628 4.010 11.013 2859 HG12 VAL 70 2HG1 VAL 70 16.129 4.941 10.623 2860 HG13 VAL 70 3HG1 VAL 70 17.472 5.749 11.487 2861 HG21 VAL 70 3HG2 VAL 70 19.797 6.122 8.601 2862 HG22 VAL 70 1HG2 VAL 70 19.894 4.648 9.648 2863 HG23 VAL 70 2HG2 VAL 70 19.608 6.289 10.361 2864 H ALA 71 H ALA 71 16.084 6.334 7.336 2865 HA ALA 71 HA ALA 71 13.570 5.630 7.972 2866 HB1 ALA 71 1HB ALA 71 14.474 6.994 5.361 2867 HB2 ALA 71 2HB ALA 71 14.266 7.796 6.951 2868 HB3 ALA 71 3HB ALA 71 12.827 7.109 6.099 2869 H GLU 72 H GLU 72 15.069 4.792 4.724 2870 HA GLU 72 HA GLU 72 12.635 3.581 3.978 2871 HB2 GLU 72 2HB GLU 72 13.562 2.760 1.932 2872 HB3 GLU 72 1HB GLU 72 13.923 4.488 2.220 2873 HG2 GLU 72 2HG GLU 72 15.854 3.605 1.215 2874 HG3 GLU 72 1HG GLU 72 16.281 3.790 2.932 2875 H GLN 73 H GLN 73 15.379 2.316 5.703 2876 HA GLN 73 HA GLN 73 14.793 -0.393 5.238 2877 HB2 GLN 73 2HB GLN 73 16.954 0.451 6.071 2878 HB3 GLN 73 1HB GLN 73 16.193 0.902 7.635 2879 HG2 GLN 73 2HG GLN 73 15.786 -1.546 8.116 2880 HG3 GLN 73 1HG GLN 73 16.366 -1.968 6.467 2881 HE21 GLN 73 1HE2 GLN 73 17.552 0.168 9.185 2882 HE22 GLN 73 2HE2 GLN 73 19.181 -0.438 9.180 2883 H VAL 74 H VAL 74 13.402 2.024 7.474 2884 HA VAL 74 HA VAL 74 12.090 0.133 9.132 2885 HB VAL 74 HB VAL 74 10.993 2.937 8.527 2886 HG11 VAL 74 1HG1 VAL 74 9.585 1.386 9.919 2887 HG12 VAL 74 2HG1 VAL 74 10.234 2.732 10.920 2888 HG13 VAL 74 3HG1 VAL 74 10.978 1.088 11.012 2889 HG21 VAL 74 3HG2 VAL 74 13.427 2.142 10.217 2890 HG22 VAL 74 1HG2 VAL 74 12.458 3.639 10.533 2891 HG23 VAL 74 2HG2 VAL 74 13.271 3.424 8.960 2892 H MET 75 H MET 75 11.217 1.939 6.185 2893 HA MET 75 HA MET 75 8.519 1.102 6.105 2894 HB2 MET 75 2HB MET 75 10.415 2.150 3.933 2895 HB3 MET 75 1HB MET 75 8.674 1.834 3.640 2896 HG2 MET 75 2HG MET 75 7.978 3.722 4.656 2897 HG3 MET 75 1HG MET 75 9.035 3.472 6.069 2898 HE1 MET 75 3HE MET 75 10.360 3.794 2.272 2899 HE2 MET 75 1HE MET 75 10.470 5.576 2.133 2900 HE3 MET 75 2HE MET 75 8.872 4.796 2.331 2901 H LYS 76 H LYS 76 11.495 -0.153 4.480 2902 HA LYS 76 HA LYS 76 10.143 -2.119 3.038 2903 HB2 LYS 76 2HB LYS 76 12.416 -1.320 2.500 2904 HB3 LYS 76 1HB LYS 76 13.068 -2.081 3.982 2905 HG2 LYS 76 2HG LYS 76 12.882 -4.272 3.090 2906 HG3 LYS 76 1HG LYS 76 11.629 -3.810 1.884 2907 HD2 LYS 76 2HD LYS 76 13.201 -2.709 0.447 2908 HD3 LYS 76 1HD LYS 76 14.426 -2.579 1.737 2909 HE2 LYS 76 2HE LYS 76 15.099 -4.194 -0.029 2910 HE3 LYS 76 1HE LYS 76 15.002 -4.952 1.607 2911 HZ1 LYS 76 3HZ LYS 76 14.071 -6.207 -0.388 2912 HZ2 LYS 76 1HZ LYS 76 12.797 -5.213 -0.411 2913 HZ3 LYS 76 2HZ LYS 76 13.112 -6.132 1.017 2914 H ALA 77 H ALA 77 11.511 -2.195 6.348 2915 HA ALA 77 HA ALA 77 11.164 -4.940 6.778 2916 HB1 ALA 77 1HB ALA 77 12.503 -3.480 8.326 2917 HB2 ALA 77 2HB ALA 77 11.222 -4.379 9.221 2918 HB3 ALA 77 3HB ALA 77 10.992 -2.632 8.820 2919 H GLY 78 H GLY 78 8.941 -2.162 7.110 2920 HA2 GLY 78 2HA GLY 78 6.903 -3.603 8.430 2921 HA3 GLY 78 1HA GLY 78 6.770 -2.035 7.545 2922 H ILE 79 H ILE 79 7.511 -2.900 4.993 2923 HA ILE 79 HA ILE 79 5.105 -3.890 4.022 2924 HB ILE 79 HB ILE 79 7.884 -3.818 2.752 2925 HG12 ILE 79 2HG1 ILE 79 5.421 -1.995 2.343 2926 HG13 ILE 79 1HG1 ILE 79 6.759 -1.606 3.453 2927 HG21 ILE 79 1HG2 ILE 79 6.690 -4.057 0.532 2928 HG22 ILE 79 2HG2 ILE 79 5.142 -4.349 1.405 2929 HG23 ILE 79 3HG2 ILE 79 6.505 -5.523 1.531 2930 HD11 ILE 79 3HD ILE 79 6.996 -1.923 0.388 2931 HD12 ILE 79 1HD ILE 79 7.108 -0.409 1.343 2932 HD13 ILE 79 2HD ILE 79 8.388 -1.667 1.507 2933 H GLU 80 H GLU 80 8.236 -5.647 4.647 2934 HA GLU 80 HA GLU 80 7.125 -8.024 3.559 2935 HB2 GLU 80 2HB GLU 80 9.063 -9.254 4.362 2936 HB3 GLU 80 1HB GLU 80 9.505 -7.799 3.423 2937 HG2 GLU 80 2HG GLU 80 10.120 -6.570 5.476 2938 HG3 GLU 80 1HG GLU 80 9.604 -7.949 6.514 2939 H VAL 81 H VAL 81 7.024 -6.626 6.794 2940 HA VAL 81 HA VAL 81 6.330 -8.996 8.164 2941 HB VAL 81 HB VAL 81 5.976 -6.019 8.681 2942 HG11 VAL 81 1HG1 VAL 81 4.787 -8.309 10.385 2943 HG12 VAL 81 2HG1 VAL 81 3.917 -6.898 9.676 2944 HG13 VAL 81 3HG1 VAL 81 5.091 -6.649 11.000 2945 HG21 VAL 81 3HG2 VAL 81 7.472 -8.300 10.166 2946 HG22 VAL 81 1HG2 VAL 81 7.596 -6.536 10.499 2947 HG23 VAL 81 2HG2 VAL 81 8.220 -7.199 8.955 2948 H PHE 82 H PHE 82 4.305 -6.405 6.645 2949 HA PHE 82 HA PHE 82 1.907 -7.822 7.282 2950 HB2 PHE 82 2HB PHE 82 2.380 -5.510 5.292 2951 HB3 PHE 82 1HB PHE 82 0.757 -6.114 5.807 2952 HD1 PHE 82 2HD PHE 82 0.623 -6.377 8.566 2953 HD2 PHE 82 1HD PHE 82 2.994 -3.535 6.368 2954 HE1 PHE 82 2HE PHE 82 0.645 -4.874 10.522 2955 HE2 PHE 82 1HE PHE 82 3.011 -2.038 8.321 2956 HZ PHE 82 HZ PHE 82 1.834 -2.693 10.409 2957 H ALA 83 H ALA 83 4.258 -8.492 4.996 2958 HA ALA 83 HA ALA 83 2.385 -9.624 3.046 2959 HB1 ALA 83 1HB ALA 83 4.461 -8.443 2.205 2960 HB2 ALA 83 2HB ALA 83 4.441 -10.186 1.751 2961 HB3 ALA 83 3HB ALA 83 5.474 -9.624 3.113 2962 H LEU 84 H LEU 84 4.603 -10.514 5.678 2963 HA LEU 84 HA LEU 84 4.859 -13.226 5.034 2964 HB2 LEU 84 2HB LEU 84 6.354 -11.875 6.527 2965 HB3 LEU 84 1HB LEU 84 5.084 -11.825 7.780 2966 HG LEU 84 HG LEU 84 6.084 -14.524 6.736 2967 HD11 LEU 84 1HD1 LEU 84 8.170 -13.240 7.097 2968 HD12 LEU 84 2HD1 LEU 84 7.984 -14.508 8.359 2969 HD13 LEU 84 3HD1 LEU 84 7.635 -12.783 8.758 2970 HD21 LEU 84 3HD2 LEU 84 5.760 -15.237 9.132 2971 HD22 LEU 84 1HD2 LEU 84 4.243 -14.579 8.436 2972 HD23 LEU 84 2HD2 LEU 84 5.227 -13.573 9.558 2973 H VAL 85 H VAL 85 2.465 -11.383 6.869 2974 HA VAL 85 HA VAL 85 1.219 -13.512 8.150 2975 HB VAL 85 HB VAL 85 -0.665 -12.025 8.548 2976 HG11 VAL 85 1HG1 VAL 85 0.565 -10.247 9.726 2977 HG12 VAL 85 2HG1 VAL 85 2.004 -10.446 8.675 2978 HG13 VAL 85 3HG1 VAL 85 1.545 -11.749 9.821 2979 HG21 VAL 85 3HG2 VAL 85 -0.935 -10.986 6.294 2980 HG22 VAL 85 1HG2 VAL 85 0.676 -10.206 6.435 2981 HG23 VAL 85 2HG2 VAL 85 -0.669 -9.700 7.517 2982 H THR 86 H THR 86 1.238 -12.773 4.744 2983 HA THR 86 HA THR 86 -1.307 -13.651 4.148 2984 HB THR 86 HB THR 86 1.145 -13.553 2.361 2985 HG1 THR 86 1HG THR 86 -0.124 -11.445 1.970 2986 HG21 THR 86 3HG2 THR 86 -0.573 -13.127 0.565 2987 HG22 THR 86 1HG2 THR 86 -1.902 -13.374 1.753 2988 HG23 THR 86 2HG2 THR 86 -0.823 -14.750 1.299 2989 H ALA 87 H ALA 87 1.409 -15.498 5.218 2990 HA ALA 87 HA ALA 87 0.630 -17.975 4.051 2991 HB1 ALA 87 1HB ALA 87 1.960 -19.031 5.893 2992 HB2 ALA 87 2HB ALA 87 2.061 -17.432 6.728 2993 HB3 ALA 87 3HB ALA 87 2.867 -17.673 5.139 2994 H ALA 88 H ALA 88 -0.845 -15.950 6.465 2995 HA ALA 88 HA ALA 88 -2.434 -18.121 7.588 2996 HB1 ALA 88 1HB ALA 88 -3.560 -16.312 8.904 2997 HB2 ALA 88 2HB ALA 88 -2.608 -15.066 8.047 2998 HB3 ALA 88 3HB ALA 88 -1.774 -16.228 9.137 2999 H LEU 89 H LEU 89 -2.734 -15.136 5.622 3000 HA LEU 89 HA LEU 89 -5.434 -15.271 5.179 3001 HB2 LEU 89 2HB LEU 89 -3.342 -14.146 3.237 3002 HB3 LEU 89 1HB LEU 89 -5.083 -13.728 3.281 3003 HG LEU 89 HG LEU 89 -3.065 -13.149 5.543 3004 HD11 LEU 89 1HD1 LEU 89 -3.140 -10.803 4.812 3005 HD12 LEU 89 2HD1 LEU 89 -4.282 -11.207 3.479 3006 HD13 LEU 89 3HD1 LEU 89 -2.596 -11.832 3.454 3007 HD21 LEU 89 3HD2 LEU 89 -6.004 -12.254 5.208 3008 HD22 LEU 89 1HD2 LEU 89 -4.864 -11.671 6.471 3009 HD23 LEU 89 2HD2 LEU 89 -5.373 -13.392 6.453 3010 H ALA 90 H ALA 90 -2.801 -16.825 3.343 3011 HA ALA 90 HA ALA 90 -4.420 -17.620 1.199 3012 HB1 ALA 90 1HB ALA 90 -1.935 -17.550 1.068 3013 HB2 ALA 90 2HB ALA 90 -2.568 -19.177 0.630 3014 HB3 ALA 90 3HB ALA 90 -1.838 -18.895 2.262 3015 H THR 91 H THR 91 -4.176 -18.985 4.482 3016 HA THR 91 HA THR 91 -5.398 -21.448 3.479 3017 HB THR 91 HB THR 91 -4.423 -22.603 4.984 3018 HG1 THR 91 1HG THR 91 -6.173 -21.942 6.386 3019 HG21 THR 91 3HG2 THR 91 -2.626 -20.828 4.749 3020 HG22 THR 91 1HG2 THR 91 -2.592 -21.657 6.332 3021 HG23 THR 91 2HG2 THR 91 -3.276 -19.995 6.195 3022 H ASP 92 H ASP 92 -6.398 -18.317 4.234 3023 HA ASP 92 HA ASP 92 -8.378 -19.029 6.088 3024 HB2 ASP 92 2HB ASP 92 -7.305 -16.597 5.253 3025 HB3 ASP 92 1HB ASP 92 -8.942 -16.508 4.535 3026 H PHE 93 H PHE 93 -8.308 -18.889 2.557 3027 HA PHE 93 HA PHE 93 -11.140 -19.274 2.375 3028 HB2 PHE 93 2HB PHE 93 -11.011 -19.351 0.069 3029 HB3 PHE 93 1HB PHE 93 -9.650 -18.271 0.486 3030 HD1 PHE 93 2HD PHE 93 -7.267 -19.249 0.405 3031 HD2 PHE 93 1HD PHE 93 -10.684 -21.389 -1.086 3032 HE1 PHE 93 2HE PHE 93 -5.783 -20.683 -0.943 3033 HE2 PHE 93 1HE PHE 93 -9.197 -22.830 -2.430 3034 HZ PHE 93 HZ PHE 93 -6.740 -22.469 -2.381 3035 H VAL 94 H VAL 94 -8.380 -21.371 2.845 3036 HA VAL 94 HA VAL 94 -9.515 -23.724 1.773 3037 HB VAL 94 HB VAL 94 -7.226 -23.470 3.791 3038 HG11 VAL 94 1HG1 VAL 94 -7.972 -25.655 1.716 3039 HG12 VAL 94 2HG1 VAL 94 -8.016 -25.828 3.508 3040 HG13 VAL 94 3HG1 VAL 94 -6.445 -25.612 2.668 3041 HG21 VAL 94 3HG2 VAL 94 -5.762 -23.443 1.712 3042 HG22 VAL 94 1HG2 VAL 94 -6.794 -21.984 1.802 3043 HG23 VAL 94 2HG2 VAL 94 -7.240 -23.325 0.694 3044 H ARG 95 H ARG 95 -9.949 -21.946 4.665 3045 HA ARG 95 HA ARG 95 -10.831 -23.884 6.452 3046 HB2 ARG 95 2HB ARG 95 -10.384 -21.316 6.822 3047 HB3 ARG 95 1HB ARG 95 -11.977 -21.048 6.063 3048 HG2 ARG 95 2HG ARG 95 -12.424 -20.932 8.347 3049 HG3 ARG 95 1HG ARG 95 -12.951 -22.588 7.927 3050 HD2 ARG 95 2HD ARG 95 -10.553 -23.352 8.784 3051 HD3 ARG 95 1HD ARG 95 -10.405 -21.671 9.435 3052 HE ARG 95 HE ARG 95 -12.361 -22.015 10.805 3053 HH11 ARG 95 1HH2 ARG 95 -11.085 -25.137 9.450 3054 HH12 ARG 95 2HH2 ARG 95 -12.521 -26.027 9.857 3055 HH21 ARG 95 1HH1 ARG 95 -14.161 -23.451 11.668 3056 HH22 ARG 95 2HH1 ARG 95 -14.210 -25.062 11.124 3057 H ARG 96 H ARG 96 -12.314 -22.681 3.462 3058 HA ARG 96 HA ARG 96 -15.001 -23.228 4.012 3059 HB2 ARG 96 2HB ARG 96 -15.407 -23.277 1.627 3060 HB3 ARG 96 1HB ARG 96 -14.090 -22.082 1.842 3061 HG2 ARG 96 2HG ARG 96 -12.424 -23.886 1.154 3062 HG3 ARG 96 1HG ARG 96 -13.816 -25.016 0.931 3063 HD2 ARG 96 2HD ARG 96 -14.671 -23.675 -0.987 3064 HD3 ARG 96 1HD ARG 96 -13.156 -22.663 -0.913 3065 HE ARG 96 HE ARG 96 -12.186 -25.269 -0.792 3066 HH11 ARG 96 1HH2 ARG 96 -14.120 -23.629 -3.389 3067 HH12 ARG 96 2HH2 ARG 96 -14.026 -25.018 -4.413 3068 HH21 ARG 96 1HH1 ARG 96 -11.953 -26.952 -2.248 3069 HH22 ARG 96 2HH1 ARG 96 -12.481 -26.806 -3.897 3070 H GLU 97 H GLU 97 -12.246 -25.323 3.487 3071 HA GLU 97 HA GLU 97 -13.900 -27.417 2.307 3072 HB2 GLU 97 2HB GLU 97 -11.739 -26.441 1.204 3073 HB3 GLU 97 1HB GLU 97 -10.819 -27.325 2.452 3074 HG2 GLU 97 2HG GLU 97 -11.592 -29.487 1.542 3075 HG3 GLU 97 1HG GLU 97 -12.837 -28.675 0.515 3076 H GLU 98 H GLU 98 -13.539 -29.592 3.225 3077 HA GLU 98 HA GLU 98 -13.582 -31.014 4.849 3078 HB2 GLU 98 2HB GLU 98 -11.939 -29.213 6.683 3079 HB3 GLU 98 1HB GLU 98 -12.442 -30.895 7.011 3080 HG2 GLU 98 2HG GLU 98 -11.177 -31.594 4.858 3081 HG3 GLU 98 1HG GLU 98 -10.497 -29.925 4.820 3082 H GLU 99 H GLU 99 -14.249 -27.689 6.057 3083 HA GLU 99 HA GLU 99 -16.084 -28.404 7.988 3084 HB2 GLU 99 2HB GLU 99 -16.073 -25.846 6.280 3085 HB3 GLU 99 1HB GLU 99 -16.936 -26.064 7.846 3086 HG2 GLU 99 2HG GLU 99 -13.867 -26.233 7.463 3087 HG3 GLU 99 1HG GLU 99 -14.784 -24.807 8.045 3088 H ARG 100 H ARG 100 -16.600 -27.804 4.490 3089 HA ARG 100 HA ARG 100 -19.390 -27.866 4.737 3090 HB2 ARG 100 2HB ARG 100 -17.770 -27.124 2.688 3091 HB3 ARG 100 1HB ARG 100 -18.271 -28.740 2.078 3092 HG2 ARG 100 2HG ARG 100 -20.718 -27.994 2.524 3093 HG3 ARG 100 1HG ARG 100 -20.062 -26.386 2.970 3094 HD2 ARG 100 2HD ARG 100 -20.852 -26.224 0.676 3095 HD3 ARG 100 1HD ARG 100 -19.046 -26.188 0.630 3096 HE ARG 100 HE ARG 100 -20.857 -28.577 0.060 3097 HH11 ARG 100 1HH2 ARG 100 -18.169 -26.512 -1.011 3098 HH12 ARG 100 2HH2 ARG 100 -17.876 -27.394 -2.410 3099 HH21 ARG 100 1HH1 ARG 100 -20.170 -30.052 -1.689 3100 HH22 ARG 100 2HH1 ARG 100 -18.907 -29.615 -2.701 3101 H ARG 101 H ARG 101 -17.085 -30.513 4.723 3102 HA ARG 101 HA ARG 101 -19.204 -32.466 4.138 3103 HB2 ARG 101 2HB ARG 101 -16.322 -32.968 5.127 3104 HB3 ARG 101 1HB ARG 101 -17.563 -34.211 4.770 3105 HG2 ARG 101 2HG ARG 101 -17.582 -33.231 2.325 3106 HG3 ARG 101 1HG ARG 101 -15.995 -32.514 2.795 3107 HD2 ARG 101 2HD ARG 101 -15.450 -34.986 3.673 3108 HD3 ARG 101 1HD ARG 101 -16.883 -35.497 2.717 3109 HE ARG 101 HE ARG 101 -14.283 -34.315 1.700 3110 HH11 ARG 101 1HH2 ARG 101 -17.371 -35.941 0.664 3111 HH12 ARG 101 2HH2 ARG 101 -16.559 -36.967 -0.440 3112 HH21 ARG 101 1HH1 ARG 101 -13.230 -35.844 0.223 3113 HH22 ARG 101 2HH1 ARG 101 -14.219 -36.989 -0.567 3114 H GLY 102 H GLY 102 -17.740 -30.683 6.764 3115 HA2 GLY 102 2HA GLY 102 -18.243 -30.629 8.923 3116 HA3 GLY 102 1HA GLY 102 -19.382 -32.015 8.706 3117 H HIS 103 H HIS 103 -15.980 -31.927 7.662 3118 HA HIS 103 HA HIS 103 -15.449 -34.226 9.422 3119 HB2 HIS 103 2HB HIS 103 -14.532 -34.392 7.092 3120 HB3 HIS 103 1HB HIS 103 -13.581 -32.891 7.377 3121 HD1 HIS 103 1HD HIS 103 -13.916 -36.448 8.847 3122 HD2 HIS 103 2HD HIS 103 -11.124 -33.281 8.679 3123 HE1 HIS 103 1HE HIS 103 -11.768 -37.246 9.948 3124 HE2 HIS 103 2HE HIS 103 -10.114 -35.326 9.845 Start of MODEL 10 1 H1 SER 1 H SER 1 -21.216 -14.351 -3.063 2 HA SER 1 HA SER 1 -23.549 -14.446 -1.320 3 HB2 SER 1 2HB SER 1 -24.600 -15.264 -3.591 4 HB3 SER 1 1HB SER 1 -24.070 -13.556 -3.494 5 HG SER 1 1HG SER 1 -23.265 -14.280 -5.332 6 H ALA 2 H ALA 2 -20.964 -16.289 -2.794 7 HA ALA 2 HA ALA 2 -22.096 -18.862 -2.522 8 HB1 ALA 2 1HB ALA 2 -20.086 -18.511 -3.961 9 HB2 ALA 2 2HB ALA 2 -19.695 -19.701 -2.687 10 HB3 ALA 2 3HB ALA 2 -19.117 -18.000 -2.566 11 H ASP 3 H ASP 3 -19.237 -17.759 -0.783 12 HA ASP 3 HA ASP 3 -20.247 -18.402 1.837 13 HB2 ASP 3 2HB ASP 3 -18.342 -20.045 2.275 14 HB3 ASP 3 1HB ASP 3 -19.671 -20.668 1.260 15 H HIS 4 H HIS 4 -17.167 -18.390 0.219 16 HA HIS 4 HA HIS 4 -15.717 -16.888 1.980 17 HB2 HIS 4 2HB HIS 4 -13.966 -16.712 0.220 18 HB3 HIS 4 1HB HIS 4 -14.663 -18.357 0.279 19 HD1 HIS 4 1HD HIS 4 -16.757 -18.656 -1.671 20 HD2 HIS 4 2HD HIS 4 -13.752 -15.772 -2.375 21 HE1 HIS 4 1HE HIS 4 -17.026 -17.764 -4.065 22 HE2 HIS 4 2HE HIS 4 -15.121 -16.146 -4.463 23 H GLU 5 H GLU 5 -17.619 -15.719 -0.786 24 HA GLU 5 HA GLU 5 -16.542 -13.125 -0.890 25 HB2 GLU 5 2HB GLU 5 -19.269 -14.289 -1.630 26 HB3 GLU 5 1HB GLU 5 -18.727 -12.668 -2.172 27 HG2 GLU 5 2HG GLU 5 -17.292 -13.509 -3.794 28 HG3 GLU 5 1HG GLU 5 -16.856 -14.957 -2.836 29 H ARG 6 H ARG 6 -19.077 -14.629 1.127 30 HA ARG 6 HA ARG 6 -20.364 -12.223 1.891 31 HB2 ARG 6 2HB ARG 6 -20.125 -14.913 3.399 32 HB3 ARG 6 1HB ARG 6 -21.231 -13.576 3.854 33 HG2 ARG 6 2HG ARG 6 -22.618 -13.906 1.905 34 HG3 ARG 6 1HG ARG 6 -21.390 -14.926 1.096 35 HD2 ARG 6 2HD ARG 6 -23.308 -16.276 1.944 36 HD3 ARG 6 1HD ARG 6 -21.725 -16.782 2.676 37 HE ARG 6 HE ARG 6 -22.795 -14.916 4.492 38 HH11 ARG 6 1HH2 ARG 6 -23.746 -18.178 3.205 39 HH12 ARG 6 2HH2 ARG 6 -24.938 -18.444 4.364 40 HH21 ARG 6 1HH1 ARG 6 -24.103 -15.637 6.435 41 HH22 ARG 6 2HH1 ARG 6 -25.090 -17.007 6.284 42 H GLU 7 H GLU 7 -17.638 -14.154 3.118 43 HA GLU 7 HA GLU 7 -17.423 -12.797 5.570 44 HB2 GLU 7 2HB GLU 7 -16.572 -15.184 4.856 45 HB3 GLU 7 1HB GLU 7 -15.154 -14.319 4.182 46 HG2 GLU 7 2HG GLU 7 -14.538 -15.132 6.373 47 HG3 GLU 7 1HG GLU 7 -14.774 -13.360 6.559 48 H ALA 8 H ALA 8 -16.094 -12.276 2.334 49 HA ALA 8 HA ALA 8 -14.153 -10.336 3.090 50 HB1 ALA 8 1HB ALA 8 -15.562 -10.756 0.372 51 HB2 ALA 8 2HB ALA 8 -14.004 -11.517 0.878 52 HB3 ALA 8 3HB ALA 8 -14.108 -9.732 0.661 53 H GLN 9 H GLN 9 -17.579 -10.191 1.948 54 HA GLN 9 HA GLN 9 -17.581 -7.379 1.824 55 HB2 GLN 9 2HB GLN 9 -19.273 -8.956 0.684 56 HB3 GLN 9 1HB GLN 9 -20.094 -9.066 2.278 57 HG2 GLN 9 2HG GLN 9 -20.294 -6.496 2.251 58 HG3 GLN 9 1HG GLN 9 -19.561 -6.491 0.611 59 HE21 GLN 9 1HE2 GLN 9 -20.805 -7.688 -1.153 60 HE22 GLN 9 2HE2 GLN 9 -22.491 -8.015 -0.976 61 H LYS 10 H LYS 10 -18.366 -9.682 4.437 62 HA LYS 10 HA LYS 10 -19.413 -7.934 6.306 63 HB2 LYS 10 2HB LYS 10 -19.330 -10.437 6.563 64 HB3 LYS 10 1HB LYS 10 -17.545 -10.341 6.694 65 HG2 LYS 10 2HG LYS 10 -17.930 -8.865 8.808 66 HG3 LYS 10 1HG LYS 10 -19.640 -9.390 8.751 67 HD2 LYS 10 2HD LYS 10 -18.998 -11.697 9.208 68 HD3 LYS 10 1HD LYS 10 -17.348 -11.405 8.577 69 HE2 LYS 10 2HE LYS 10 -16.948 -9.813 10.590 70 HE3 LYS 10 1HE LYS 10 -18.454 -10.506 11.315 71 HZ1 LYS 10 3HZ LYS 10 -17.413 -12.701 11.192 72 HZ2 LYS 10 1HZ LYS 10 -16.480 -11.609 12.074 73 HZ3 LYS 10 2HZ LYS 10 -16.015 -12.019 10.483 74 H ALA 11 H ALA 11 -15.993 -8.590 5.446 75 HA ALA 11 HA ALA 11 -14.874 -7.191 7.613 76 HB1 ALA 11 1HB ALA 11 -13.547 -8.804 6.213 77 HB2 ALA 11 2HB ALA 11 -12.757 -7.193 6.310 78 HB3 ALA 11 3HB ALA 11 -13.654 -7.663 4.820 79 H GLU 12 H GLU 12 -15.901 -6.153 4.319 80 HA GLU 12 HA GLU 12 -14.809 -3.572 4.499 81 HB2 GLU 12 2HB GLU 12 -17.234 -4.507 2.851 82 HB3 GLU 12 1HB GLU 12 -16.461 -2.892 2.724 83 HG2 GLU 12 2HG GLU 12 -14.285 -4.016 2.039 84 HG3 GLU 12 1HG GLU 12 -15.170 -5.587 1.983 85 H GLU 13 H GLU 13 -17.782 -4.945 5.858 86 HA GLU 13 HA GLU 13 -19.064 -2.441 6.309 87 HB2 GLU 13 2HB GLU 13 -19.433 -5.084 7.838 88 HB3 GLU 13 1HB GLU 13 -20.544 -3.669 7.871 89 HG2 GLU 13 2HG GLU 13 -21.007 -3.978 5.416 90 HG3 GLU 13 1HG GLU 13 -19.884 -5.380 5.381 91 H GLU 14 H GLU 14 -16.729 -4.455 8.103 92 HA GLU 14 HA GLU 14 -17.070 -3.077 10.535 93 HB2 GLU 14 2HB GLU 14 -16.093 -5.389 10.379 94 HB3 GLU 14 1HB GLU 14 -14.619 -4.686 9.632 95 HG2 GLU 14 2HG GLU 14 -14.280 -5.174 12.052 96 HG3 GLU 14 1HG GLU 14 -14.169 -3.401 11.746 97 H LEU 15 H LEU 15 -14.886 -2.613 7.741 98 HA LEU 15 HA LEU 15 -13.254 -0.719 8.929 99 HB2 LEU 15 2HB LEU 15 -12.803 -1.789 6.705 100 HB3 LEU 15 1HB LEU 15 -14.115 -0.816 5.973 101 HG LEU 15 HG LEU 15 -12.849 1.268 6.381 102 HD11 LEU 15 1HD1 LEU 15 -10.460 1.163 7.290 103 HD12 LEU 15 2HD1 LEU 15 -10.799 -0.517 7.839 104 HD13 LEU 15 3HD1 LEU 15 -11.732 0.870 8.517 105 HD21 LEU 15 3HD2 LEU 15 -11.064 -0.922 5.128 106 HD22 LEU 15 1HD2 LEU 15 -10.886 0.851 4.885 107 HD23 LEU 15 2HD2 LEU 15 -12.363 0.005 4.294 108 H GLN 16 H GLN 16 -16.437 -0.323 7.409 109 HA GLN 16 HA GLN 16 -16.320 2.512 7.354 110 HB2 GLN 16 2HB GLN 16 -18.680 0.575 7.153 111 HB3 GLN 16 1HB GLN 16 -18.778 2.342 6.824 112 HG2 GLN 16 2HG GLN 16 -17.169 2.179 4.972 113 HG3 GLN 16 1HG GLN 16 -16.824 0.455 5.316 114 HE21 GLN 16 1HE2 GLN 16 -18.239 -1.135 4.556 115 HE22 GLN 16 2HE2 GLN 16 -19.634 -0.809 3.564 116 H LYS 17 H LYS 17 -17.199 0.164 9.812 117 HA LYS 17 HA LYS 17 -18.654 2.001 11.437 118 HB2 LYS 17 2HB LYS 17 -18.911 -0.471 11.524 119 HB3 LYS 17 1HB LYS 17 -17.247 -0.638 12.186 120 HG2 LYS 17 2HG LYS 17 -17.888 0.178 14.321 121 HG3 LYS 17 1HG LYS 17 -19.184 1.201 13.625 122 HD2 LYS 17 2HD LYS 17 -20.291 -0.442 14.894 123 HD3 LYS 17 1HD LYS 17 -20.602 -0.810 13.178 124 HE2 LYS 17 2HE LYS 17 -18.662 -2.307 15.101 125 HE3 LYS 17 1HE LYS 17 -20.290 -2.853 14.534 126 HZ1 LYS 17 3HZ LYS 17 -17.749 -2.687 13.039 127 HZ2 LYS 17 1HZ LYS 17 -19.273 -2.783 12.221 128 HZ3 LYS 17 2HZ LYS 17 -18.711 -3.995 13.267 129 H VAL 18 H VAL 18 -15.268 0.895 11.187 130 HA VAL 18 HA VAL 18 -14.286 2.223 13.436 131 HB VAL 18 HB VAL 18 -12.894 1.396 10.843 132 HG11 VAL 18 1HG1 VAL 18 -10.760 1.517 12.196 133 HG12 VAL 18 2HG1 VAL 18 -11.666 2.295 13.548 134 HG13 VAL 18 3HG1 VAL 18 -11.497 3.132 11.961 135 HG21 VAL 18 3HG2 VAL 18 -13.958 -0.483 12.193 136 HG22 VAL 18 1HG2 VAL 18 -13.068 0.078 13.648 137 HG23 VAL 18 2HG2 VAL 18 -12.168 -0.566 12.223 138 H LEU 19 H LEU 19 -14.922 3.379 10.100 139 HA LEU 19 HA LEU 19 -13.583 5.810 10.284 140 HB2 LEU 19 2HB LEU 19 -16.298 5.316 8.904 141 HB3 LEU 19 1HB LEU 19 -15.240 6.733 8.627 142 HG LEU 19 HG LEU 19 -14.515 3.819 7.966 143 HD11 LEU 19 1HD1 LEU 19 -15.386 6.118 6.101 144 HD12 LEU 19 2HD1 LEU 19 -16.383 4.689 6.548 145 HD13 LEU 19 3HD1 LEU 19 -14.869 4.469 5.594 146 HD21 LEU 19 3HD2 LEU 19 -13.045 6.449 7.306 147 HD22 LEU 19 1HD2 LEU 19 -12.643 4.828 6.643 148 HD23 LEU 19 2HD2 LEU 19 -12.460 5.140 8.402 149 H GLU 20 H GLU 20 -16.963 5.000 11.247 150 HA GLU 20 HA GLU 20 -17.624 7.637 12.023 151 HB2 GLU 20 2HB GLU 20 -18.800 4.881 12.547 152 HB3 GLU 20 1HB GLU 20 -19.469 6.294 13.413 153 HG2 GLU 20 2HG GLU 20 -19.188 6.347 10.340 154 HG3 GLU 20 1HG GLU 20 -20.569 5.544 11.151 155 H GLU 21 H GLU 21 -16.415 4.793 13.840 156 HA GLU 21 HA GLU 21 -16.431 5.911 16.400 157 HB2 GLU 21 2HB GLU 21 -14.592 3.876 15.009 158 HB3 GLU 21 1HB GLU 21 -14.420 4.241 16.740 159 HG2 GLU 21 2HG GLU 21 -17.119 3.253 15.602 160 HG3 GLU 21 1HG GLU 21 -15.767 2.122 15.951 161 H ALA 22 H ALA 22 -13.868 5.817 13.882 162 HA ALA 22 HA ALA 22 -11.877 7.080 15.315 163 HB1 ALA 22 1HB ALA 22 -12.345 7.098 12.262 164 HB2 ALA 22 2HB ALA 22 -11.478 5.820 13.184 165 HB3 ALA 22 3HB ALA 22 -10.794 7.485 13.097 166 H SER 23 H SER 23 -14.427 8.412 13.213 167 HA SER 23 HA SER 23 -13.461 11.023 13.076 168 HB2 SER 23 2HB SER 23 -16.429 10.134 13.194 169 HB3 SER 23 1HB SER 23 -15.801 11.689 12.525 170 HG SER 23 1HG SER 23 -15.416 9.024 11.563 171 H LYS 24 H LYS 24 -15.556 9.437 15.489 172 HA LYS 24 HA LYS 24 -16.137 11.759 16.980 173 HB2 LYS 24 2HB LYS 24 -17.449 9.603 17.003 174 HB3 LYS 24 1HB LYS 24 -16.114 8.791 17.870 175 HG2 LYS 24 2HG LYS 24 -17.562 11.271 19.015 176 HG3 LYS 24 1HG LYS 24 -18.264 9.626 19.116 177 HD2 LYS 24 2HD LYS 24 -16.203 8.814 20.321 178 HD3 LYS 24 1HD LYS 24 -15.608 10.515 20.394 179 HE2 LYS 24 2HE LYS 24 -17.655 11.187 21.690 180 HE3 LYS 24 1HE LYS 24 -18.272 9.488 21.611 181 HZ1 LYS 24 3HZ LYS 24 -16.276 8.803 22.856 182 HZ2 LYS 24 1HZ LYS 24 -17.203 9.932 23.712 183 HZ3 LYS 24 2HZ LYS 24 -15.774 10.448 22.945 184 H LYS 25 H LYS 25 -13.605 9.250 17.118 185 HA LYS 25 HA LYS 25 -12.525 10.231 19.567 186 HB2 LYS 25 2HB LYS 25 -11.413 8.283 17.483 187 HB3 LYS 25 1HB LYS 25 -10.621 8.626 19.064 188 HG2 LYS 25 2HG LYS 25 -12.512 7.761 20.328 189 HG3 LYS 25 1HG LYS 25 -13.549 7.712 18.871 190 HD2 LYS 25 2HD LYS 25 -11.964 5.955 17.887 191 HD3 LYS 25 1HD LYS 25 -11.227 5.823 19.532 192 HE2 LYS 25 2HE LYS 25 -13.510 5.290 20.493 193 HE3 LYS 25 1HE LYS 25 -14.246 5.518 18.859 194 HZ1 LYS 25 3HZ LYS 25 -12.548 3.613 18.230 195 HZ2 LYS 25 1HZ LYS 25 -14.072 3.331 18.950 196 HZ3 LYS 25 2HZ LYS 25 -12.605 3.303 19.873 197 H ALA 26 H ALA 26 -11.559 10.574 16.100 198 HA ALA 26 HA ALA 26 -9.132 11.809 16.554 199 HB1 ALA 26 1HB ALA 26 -11.060 12.190 14.173 200 HB2 ALA 26 2HB ALA 26 -9.793 10.918 14.307 201 HB3 ALA 26 3HB ALA 26 -9.314 12.650 14.192 202 H VAL 27 H VAL 27 -12.428 13.215 16.221 203 HA VAL 27 HA VAL 27 -11.439 15.851 16.207 204 HB VAL 27 HB VAL 27 -13.625 15.200 15.288 205 HG11 VAL 27 1HG1 VAL 27 -14.410 13.675 17.099 206 HG12 VAL 27 2HG1 VAL 27 -15.597 14.962 16.733 207 HG13 VAL 27 3HG1 VAL 27 -14.588 15.072 18.224 208 HG21 VAL 27 3HG2 VAL 27 -13.013 17.552 15.712 209 HG22 VAL 27 1HG2 VAL 27 -13.610 17.448 17.411 210 HG23 VAL 27 2HG2 VAL 27 -14.765 17.272 16.047 211 H GLU 28 H GLU 28 -12.414 13.639 18.900 212 HA GLU 28 HA GLU 28 -12.169 15.624 20.931 213 HB2 GLU 28 2HB GLU 28 -11.566 12.589 21.145 214 HB3 GLU 28 1HB GLU 28 -11.616 13.752 22.522 215 HG2 GLU 28 2HG GLU 28 -14.070 14.056 22.198 216 HG3 GLU 28 1HG GLU 28 -14.026 12.845 20.859 217 H ALA 29 H ALA 29 -10.027 13.305 19.348 218 HA ALA 29 HA ALA 29 -7.922 13.376 21.098 219 HB1 ALA 29 1HB ALA 29 -7.770 12.873 18.059 220 HB2 ALA 29 2HB ALA 29 -8.358 11.659 19.256 221 HB3 ALA 29 3HB ALA 29 -6.680 12.210 19.325 222 H GLU 30 H GLU 30 -8.432 15.300 18.062 223 HA GLU 30 HA GLU 30 -6.095 16.896 18.640 224 HB2 GLU 30 2HB GLU 30 -8.235 17.029 16.468 225 HB3 GLU 30 1HB GLU 30 -7.182 18.436 16.788 226 HG2 GLU 30 2HG GLU 30 -5.133 16.926 16.503 227 HG3 GLU 30 1HG GLU 30 -6.250 15.666 15.851 228 H ARG 31 H ARG 31 -9.217 16.896 20.038 229 HA ARG 31 HA ARG 31 -9.607 19.721 20.035 230 HB2 ARG 31 2HB ARG 31 -11.525 18.046 20.272 231 HB3 ARG 31 1HB ARG 31 -10.898 17.635 21.888 232 HG2 ARG 31 2HG ARG 31 -12.692 19.067 22.295 233 HG3 ARG 31 1HG ARG 31 -11.286 20.164 22.458 234 HD2 ARG 31 2HD ARG 31 -11.762 20.852 19.952 235 HD3 ARG 31 1HD ARG 31 -13.251 19.854 20.066 236 HE ARG 31 HE ARG 31 -14.262 21.462 21.321 237 HH11 ARG 31 1HH2 ARG 31 -10.731 22.218 21.352 238 HH12 ARG 31 2HH2 ARG 31 -10.921 23.886 21.646 239 HH21 ARG 31 1HH1 ARG 31 -14.502 23.665 22.146 240 HH22 ARG 31 2HH1 ARG 31 -13.172 24.753 22.158 241 H GLY 32 H GLY 32 -7.423 20.318 20.832 242 HA2 GLY 32 2HA GLY 32 -7.162 21.657 22.928 243 HA3 GLY 32 1HA GLY 32 -7.196 20.058 23.770 244 H ALA 33 H ALA 33 -5.850 19.142 20.988 245 HA ALA 33 HA ALA 33 -3.345 18.950 22.231 246 HB1 ALA 33 1HB ALA 33 -2.588 17.861 20.083 247 HB2 ALA 33 2HB ALA 33 -4.136 18.357 19.314 248 HB3 ALA 33 3HB ALA 33 -4.149 17.176 20.673 249 HA PRO 34 HA PRO 34 -1.659 22.731 20.702 250 HB2 PRO 34 2HB PRO 34 1.114 22.236 20.628 251 HB3 PRO 34 1HB PRO 34 0.181 22.436 22.161 252 HG2 PRO 34 2HG PRO 34 0.957 19.825 20.755 253 HG3 PRO 34 1HG PRO 34 1.139 20.241 22.509 254 HD2 PRO 34 2HD PRO 34 -1.003 18.763 21.569 255 HD3 PRO 34 1HD PRO 34 -1.249 20.002 22.885 256 H GLY 35 H GLY 35 -0.945 23.766 18.606 257 HA2 GLY 35 2HA GLY 35 -0.462 23.769 16.450 258 HA3 GLY 35 1HA GLY 35 0.217 22.115 16.639 259 H ALA 36 H ALA 36 -2.978 22.080 17.664 260 HA ALA 36 HA ALA 36 -3.647 20.399 15.492 261 HB1 ALA 36 1HB ALA 36 -5.360 21.401 17.855 262 HB2 ALA 36 2HB ALA 36 -4.384 19.892 17.819 263 HB3 ALA 36 3HB ALA 36 -5.802 20.060 16.737 264 H ALA 37 H ALA 37 -5.694 20.454 14.363 265 HA ALA 37 HA ALA 37 -6.485 23.190 13.546 266 HB1 ALA 37 1HB ALA 37 -5.630 20.867 11.691 267 HB2 ALA 37 2HB ALA 37 -4.702 22.385 11.952 268 HB3 ALA 37 3HB ALA 37 -6.310 22.451 11.137 269 H LEU 38 H LEU 38 -7.196 19.650 13.828 270 HA LEU 38 HA LEU 38 -9.731 19.949 12.475 271 HB2 LEU 38 2HB LEU 38 -8.266 17.836 12.395 272 HB3 LEU 38 1HB LEU 38 -8.626 17.578 14.099 273 HG LEU 38 HG LEU 38 -10.819 16.921 13.753 274 HD11 LEU 38 1HD1 LEU 38 -11.762 18.708 12.414 275 HD12 LEU 38 2HD1 LEU 38 -12.142 17.157 11.638 276 HD13 LEU 38 3HD1 LEU 38 -10.855 18.210 10.951 277 HD21 LEU 38 3HD2 LEU 38 -9.416 15.833 11.238 278 HD22 LEU 38 1HD2 LEU 38 -10.710 15.052 12.223 279 HD23 LEU 38 2HD2 LEU 38 -9.077 15.318 12.923 280 H ILE 39 H ILE 39 -9.570 21.707 14.595 281 HA ILE 39 HA ILE 39 -10.852 20.503 16.915 282 HB ILE 39 HB ILE 39 -10.244 23.456 16.353 283 HG12 ILE 39 2HG1 ILE 39 -8.367 21.259 17.437 284 HG13 ILE 39 1HG1 ILE 39 -8.124 22.304 16.002 285 HG21 ILE 39 1HG2 ILE 39 -10.312 21.929 19.021 286 HG22 ILE 39 2HG2 ILE 39 -11.790 22.720 18.334 287 HG23 ILE 39 3HG2 ILE 39 -10.359 23.711 18.765 288 HD11 ILE 39 3HD ILE 39 -8.036 23.184 18.954 289 HD12 ILE 39 1HD ILE 39 -6.714 23.190 17.739 290 HD13 ILE 39 2HD ILE 39 -8.092 24.338 17.567 291 H SER 40 H SER 40 -12.723 19.776 15.383 292 HA SER 40 HA SER 40 -14.705 21.871 15.165 293 HB2 SER 40 2HB SER 40 -13.138 22.313 13.263 294 HB3 SER 40 1HB SER 40 -13.375 20.660 12.685 295 HG SER 40 1HG SER 40 -14.777 21.665 11.543 296 H TYR 41 H TYR 41 -15.228 19.346 12.834 297 HA TYR 41 HA TYR 41 -16.003 17.253 14.303 298 HB2 TYR 41 2HB TYR 41 -17.676 18.799 15.573 299 HB3 TYR 41 1HB TYR 41 -18.608 18.899 14.052 300 HD1 TYR 41 1HD TYR 41 -17.277 16.625 16.690 301 HD2 TYR 41 2HD TYR 41 -19.926 16.977 13.323 302 HE1 TYR 41 1HE TYR 41 -18.225 14.401 17.203 303 HE2 TYR 41 2HE TYR 41 -20.873 14.766 13.828 304 HH TYR 41 HH TYR 41 -20.811 12.941 15.155 305 HA PRO 42 HA PRO 42 -18.541 16.719 10.487 306 HB2 PRO 42 2HB PRO 42 -19.038 18.647 8.536 307 HB3 PRO 42 1HB PRO 42 -19.956 18.619 10.091 308 HG2 PRO 42 2HG PRO 42 -17.473 20.319 9.430 309 HG3 PRO 42 1HG PRO 42 -19.051 20.879 10.132 310 HD2 PRO 42 2HD PRO 42 -16.818 20.262 11.671 311 HD3 PRO 42 1HD PRO 42 -18.510 19.943 12.268 312 H ASP 43 H ASP 43 -15.562 18.282 10.413 313 HA ASP 43 HA ASP 43 -14.712 17.504 7.773 314 HB2 ASP 43 2HB ASP 43 -12.544 18.751 9.016 315 HB3 ASP 43 1HB ASP 43 -13.808 19.636 8.105 316 H ALA 44 H ALA 44 -14.974 16.328 10.969 317 HA ALA 44 HA ALA 44 -12.518 14.933 11.137 318 HB1 ALA 44 1HB ALA 44 -13.550 13.649 12.991 319 HB2 ALA 44 2HB ALA 44 -15.184 14.276 12.551 320 HB3 ALA 44 3HB ALA 44 -13.925 15.400 13.172 321 H ILE 45 H ILE 45 -15.861 14.036 10.140 322 HA ILE 45 HA ILE 45 -15.169 11.409 9.535 323 HB ILE 45 HB ILE 45 -17.433 11.986 9.979 324 HG12 ILE 45 2HG1 ILE 45 -17.152 10.925 7.098 325 HG13 ILE 45 1HG1 ILE 45 -16.866 9.985 8.598 326 HG21 ILE 45 1HG2 ILE 45 -17.486 14.284 9.007 327 HG22 ILE 45 2HG2 ILE 45 -18.836 13.292 8.389 328 HG23 ILE 45 3HG2 ILE 45 -17.413 13.606 7.339 329 HD11 ILE 45 3HD ILE 45 -19.556 11.262 7.757 330 HD12 ILE 45 1HD ILE 45 -19.123 9.514 7.734 331 HD13 ILE 45 2HD ILE 45 -19.255 10.380 9.307 332 H TRP 46 H TRP 46 -14.937 14.326 7.521 333 HA TRP 46 HA TRP 46 -14.306 12.774 5.182 334 HB2 TRP 46 2HB TRP 46 -14.506 15.690 5.851 335 HB3 TRP 46 1HB TRP 46 -13.262 15.306 4.643 336 HD1 TRP 46 HD TRP 46 -14.448 16.629 2.807 337 HE1 TRP 46 1HE TRP 46 -16.623 16.333 1.444 338 HE3 TRP 46 3HE TRP 46 -16.482 12.624 5.300 339 HZ2 TRP 46 2HZ TRP 46 -18.586 14.291 1.090 340 HZ3 TRP 46 3HZ TRP 46 -18.452 11.519 4.365 341 HH2 TRP 46 HH TRP 46 -19.501 12.338 2.283 342 H TRP 47 H TRP 47 -12.420 13.639 7.980 343 HA TRP 47 HA TRP 47 -9.939 13.329 6.463 344 HB2 TRP 47 2HB TRP 47 -9.952 14.968 8.371 345 HB3 TRP 47 1HB TRP 47 -10.337 13.619 9.499 346 HD1 TRP 47 HD TRP 47 -7.555 14.181 6.695 347 HE1 TRP 47 1HE TRP 47 -5.338 13.375 7.626 348 HE3 TRP 47 3HE TRP 47 -9.212 12.613 11.267 349 HZ2 TRP 47 2HZ TRP 47 -4.416 11.993 9.982 350 HZ3 TRP 47 3HZ TRP 47 -7.615 11.519 12.810 351 HH2 TRP 47 HH TRP 47 -5.252 11.224 12.180 352 H SER 48 H SER 48 -12.053 11.610 8.897 353 HA SER 48 HA SER 48 -10.492 9.408 9.223 354 HB2 SER 48 2HB SER 48 -13.566 9.422 8.979 355 HB3 SER 48 1HB SER 48 -12.565 8.196 9.851 356 HG SER 48 1HG SER 48 -13.588 10.080 11.007 357 H VAL 49 H VAL 49 -12.773 10.118 6.583 358 HA VAL 49 HA VAL 49 -12.575 7.649 5.249 359 HB VAL 49 HB VAL 49 -13.323 10.499 4.445 360 HG11 VAL 49 1HG1 VAL 49 -14.359 9.508 2.351 361 HG12 VAL 49 2HG1 VAL 49 -13.531 7.954 2.704 362 HG13 VAL 49 3HG1 VAL 49 -12.566 9.426 2.330 363 HG21 VAL 49 3HG2 VAL 49 -15.002 7.919 4.815 364 HG22 VAL 49 1HG2 VAL 49 -15.635 9.579 4.532 365 HG23 VAL 49 2HG2 VAL 49 -14.818 9.175 6.082 366 H GLU 50 H GLU 50 -10.285 10.321 5.511 367 HA GLU 50 HA GLU 50 -9.139 9.925 2.925 368 HB2 GLU 50 2HB GLU 50 -9.291 12.144 4.339 369 HB3 GLU 50 1HB GLU 50 -7.901 11.497 5.260 370 HG2 GLU 50 2HG GLU 50 -6.577 11.424 3.074 371 HG3 GLU 50 1HG GLU 50 -7.990 12.165 2.238 372 H THR 51 H THR 51 -8.703 8.526 6.116 373 HA THR 51 HA THR 51 -5.919 7.878 5.481 374 HB THR 51 HB THR 51 -6.280 9.298 7.384 375 HG1 THR 51 1HG THR 51 -4.607 7.822 7.522 376 HG21 THR 51 3HG2 THR 51 -7.437 8.428 9.443 377 HG22 THR 51 1HG2 THR 51 -8.019 7.002 8.510 378 HG23 THR 51 2HG2 THR 51 -8.561 8.669 8.071 379 H ALA 52 H ALA 52 -9.039 6.290 5.842 380 HA ALA 52 HA ALA 52 -8.033 3.779 6.672 381 HB1 ALA 52 1HB ALA 52 -10.251 2.875 5.902 382 HB2 ALA 52 2HB ALA 52 -10.601 4.450 5.093 383 HB3 ALA 52 3HB ALA 52 -10.451 4.364 6.892 384 H THR 53 H THR 53 -8.115 5.380 3.534 385 HA THR 53 HA THR 53 -7.645 2.964 2.058 386 HB THR 53 HB THR 53 -7.343 4.891 0.239 387 HG1 THR 53 1HG THR 53 -7.247 6.682 1.545 388 HG21 THR 53 3HG2 THR 53 -9.838 5.024 0.052 389 HG22 THR 53 1HG2 THR 53 -10.020 4.397 1.731 390 HG23 THR 53 2HG2 THR 53 -9.315 3.345 0.445 391 H THR 54 H THR 54 -5.748 4.614 4.194 392 HA THR 54 HA THR 54 -3.680 5.071 4.490 393 HB THR 54 HB THR 54 -1.946 3.413 3.547 394 HG1 THR 54 1HG THR 54 -3.531 2.758 1.856 395 HG21 THR 54 3HG2 THR 54 -2.784 1.717 5.190 396 HG22 THR 54 1HG2 THR 54 -4.424 2.461 5.169 397 HG23 THR 54 2HG2 THR 54 -3.022 3.380 5.835 398 H VAL 55 H VAL 55 -4.163 7.155 3.408 399 HA VAL 55 HA VAL 55 -2.261 7.736 1.389 400 HB VAL 55 HB VAL 55 -5.163 8.741 1.013 401 HG11 VAL 55 1HG1 VAL 55 -2.836 8.325 -0.976 402 HG12 VAL 55 2HG1 VAL 55 -3.198 9.908 -0.219 403 HG13 VAL 55 3HG1 VAL 55 -4.382 9.160 -1.338 404 HG21 VAL 55 3HG2 VAL 55 -5.438 6.312 0.794 405 HG22 VAL 55 1HG2 VAL 55 -3.985 6.183 -0.258 406 HG23 VAL 55 2HG2 VAL 55 -5.463 7.030 -0.848 407 H GLY 56 H GLY 56 -3.182 10.454 1.368 408 HA2 GLY 56 2HA GLY 56 -4.312 11.621 3.498 409 HA3 GLY 56 1HA GLY 56 -2.592 11.218 3.992 410 H TYR 57 H TYR 57 -4.568 13.309 2.106 411 HA TYR 57 HA TYR 57 -2.488 13.789 0.094 412 HB2 TYR 57 2HB TYR 57 -5.442 14.242 0.420 413 HB3 TYR 57 1HB TYR 57 -4.618 15.739 -0.106 414 HD1 TYR 57 2HD TYR 57 -2.800 15.447 -1.998 415 HD2 TYR 57 1HD TYR 57 -6.029 12.689 -1.280 416 HE1 TYR 57 2HE TYR 57 -2.551 14.570 -4.277 417 HE2 TYR 57 1HE TYR 57 -5.794 11.822 -3.585 418 HH TYR 57 HH TYR 57 -4.785 12.297 -5.739 419 H GLY 58 H GLY 58 -3.778 15.015 3.079 420 HA2 GLY 58 2HA GLY 58 -2.303 16.214 4.433 421 HA3 GLY 58 1HA GLY 58 -1.757 17.174 3.010 422 H ASP 59 H ASP 59 -5.180 16.301 3.792 423 HA ASP 59 HA ASP 59 -5.681 19.164 3.754 424 HB2 ASP 59 2HB ASP 59 -7.238 17.636 2.550 425 HB3 ASP 59 1HB ASP 59 -7.754 16.970 4.144 426 H ARG 60 H ARG 60 -5.143 16.601 6.170 427 HA ARG 60 HA ARG 60 -5.618 18.666 8.189 428 HB2 ARG 60 2HB ARG 60 -7.313 16.441 8.096 429 HB3 ARG 60 1HB ARG 60 -5.994 15.818 9.111 430 HG2 ARG 60 2HG ARG 60 -7.543 16.717 10.645 431 HG3 ARG 60 1HG ARG 60 -6.269 17.949 10.576 432 HD2 ARG 60 2HD ARG 60 -8.486 19.061 10.533 433 HD3 ARG 60 1HD ARG 60 -7.682 19.326 8.949 434 HE ARG 60 HE ARG 60 -9.792 17.216 9.546 435 HH11 ARG 60 1HH2 ARG 60 -8.130 19.294 7.057 436 HH12 ARG 60 2HH2 ARG 60 -9.282 19.042 5.879 437 HH21 ARG 60 1HH1 ARG 60 -11.391 16.844 7.767 438 HH22 ARG 60 2HH1 ARG 60 -11.050 17.562 6.229 439 H TYR 61 H TYR 61 -4.330 17.619 10.332 440 HA TYR 61 HA TYR 61 -2.227 15.921 9.598 441 HB2 TYR 61 2HB TYR 61 -1.565 18.859 10.304 442 HB3 TYR 61 1HB TYR 61 -0.426 17.498 10.623 443 HD1 TYR 61 1HD TYR 61 0.326 16.027 8.695 444 HD2 TYR 61 2HD TYR 61 -1.697 19.767 8.060 445 HE1 TYR 61 1HE TYR 61 1.081 16.029 6.353 446 HE2 TYR 61 2HE TYR 61 -0.955 19.773 5.716 447 HH TYR 61 HH TYR 61 0.676 16.990 4.225 448 HA PRO 62 HA PRO 62 -3.763 15.899 13.907 449 HB2 PRO 62 2HB PRO 62 -2.980 13.307 14.603 450 HB3 PRO 62 1HB PRO 62 -4.346 13.619 13.463 451 HG2 PRO 62 2HG PRO 62 -1.419 12.970 12.810 452 HG3 PRO 62 1HG PRO 62 -2.900 12.173 12.142 453 HD2 PRO 62 2HD PRO 62 -1.532 14.265 10.876 454 HD3 PRO 62 1HD PRO 62 -3.338 14.055 10.703 455 H VAL 63 H VAL 63 -2.503 15.308 16.141 456 HA VAL 63 HA VAL 63 0.112 16.602 15.838 457 HB VAL 63 HB VAL 63 -1.607 16.652 18.349 458 HG11 VAL 63 1HG1 VAL 63 0.531 18.638 17.318 459 HG12 VAL 63 2HG1 VAL 63 1.032 17.237 18.307 460 HG13 VAL 63 3HG1 VAL 63 -0.094 18.444 18.992 461 HG21 VAL 63 3HG2 VAL 63 -2.993 17.637 16.556 462 HG22 VAL 63 1HG2 VAL 63 -1.588 18.580 15.944 463 HG23 VAL 63 2HG2 VAL 63 -2.294 18.949 17.553 464 H THR 64 H THR 64 -0.266 15.600 18.998 465 HA THR 64 HA THR 64 1.058 13.023 18.631 466 HB THR 64 HB THR 64 2.091 15.035 20.696 467 HG1 THR 64 1HG THR 64 2.789 14.942 17.964 468 HG21 THR 64 3HG2 THR 64 2.864 12.616 20.744 469 HG22 THR 64 1HG2 THR 64 4.210 13.769 20.426 470 HG23 THR 64 2HG2 THR 64 3.511 12.805 19.080 471 H GLU 65 H GLU 65 -0.653 15.438 20.677 472 HA GLU 65 HA GLU 65 -1.082 13.485 22.756 473 HB2 GLU 65 2HB GLU 65 -0.618 16.066 23.097 474 HB3 GLU 65 1HB GLU 65 -2.360 16.267 22.708 475 HG2 GLU 65 2HG GLU 65 -2.893 14.694 24.652 476 HG3 GLU 65 1HG GLU 65 -1.129 14.553 24.979 477 H GLU 66 H GLU 66 -2.244 13.523 19.772 478 HA GLU 66 HA GLU 66 -5.075 13.422 20.316 479 HB2 GLU 66 2HB GLU 66 -4.626 11.976 17.911 480 HB3 GLU 66 1HB GLU 66 -5.188 13.657 18.080 481 HG2 GLU 66 2HG GLU 66 -3.533 13.764 16.504 482 HG3 GLU 66 1HG GLU 66 -2.758 14.446 17.967 483 H GLY 67 H GLY 67 -2.258 11.463 19.708 484 HA2 GLY 67 2HA GLY 67 -1.673 9.537 20.902 485 HA3 GLY 67 1HA GLY 67 -3.459 9.113 21.027 486 H ARG 68 H ARG 68 -0.686 9.617 18.735 487 HA ARG 68 HA ARG 68 -2.222 9.632 16.495 488 HB2 ARG 68 2HB ARG 68 0.121 10.317 16.479 489 HB3 ARG 68 1HB ARG 68 0.663 8.603 16.585 490 HG2 ARG 68 2HG ARG 68 -0.194 8.094 14.390 491 HG3 ARG 68 1HG ARG 68 -1.291 9.516 14.400 492 HD2 ARG 68 2HD ARG 68 1.778 9.667 14.095 493 HD3 ARG 68 1HD ARG 68 0.518 9.796 12.792 494 HE ARG 68 HE ARG 68 -0.079 11.683 14.956 495 HH11 ARG 68 1HH2 ARG 68 1.788 11.107 11.833 496 HH12 ARG 68 2HH2 ARG 68 2.313 12.766 11.814 497 HH21 ARG 68 1HH1 ARG 68 0.884 13.919 14.764 498 HH22 ARG 68 2HH1 ARG 68 1.807 14.295 13.320 499 H LYS 69 H LYS 69 -1.609 6.990 18.523 500 HA LYS 69 HA LYS 69 -2.131 4.807 16.984 501 HB2 LYS 69 2HB LYS 69 -3.524 5.435 19.650 502 HB3 LYS 69 1HB LYS 69 -3.410 3.833 18.834 503 HG2 LYS 69 2HG LYS 69 -0.807 4.200 18.957 504 HG3 LYS 69 1HG LYS 69 -1.184 5.408 20.229 505 HD2 LYS 69 2HD LYS 69 -2.541 3.620 21.426 506 HD3 LYS 69 1HD LYS 69 -2.042 2.438 20.158 507 HE2 LYS 69 2HE LYS 69 0.404 2.801 20.888 508 HE3 LYS 69 1HE LYS 69 -0.219 3.834 22.236 509 HZ1 LYS 69 3HZ LYS 69 -0.139 1.857 23.284 510 HZ2 LYS 69 1HZ LYS 69 -0.314 0.929 21.881 511 HZ3 LYS 69 2HZ LYS 69 -1.678 1.649 22.612 512 H VAL 70 H VAL 70 -4.356 7.548 17.611 513 HA VAL 70 HA VAL 70 -6.692 6.177 16.791 514 HB VAL 70 HB VAL 70 -6.030 9.160 16.865 515 HG11 VAL 70 1HG1 VAL 70 -8.742 7.698 16.484 516 HG12 VAL 70 2HG1 VAL 70 -7.939 8.793 15.300 517 HG13 VAL 70 3HG1 VAL 70 -8.556 9.454 16.850 518 HG21 VAL 70 3HG2 VAL 70 -5.939 8.001 19.113 519 HG22 VAL 70 1HG2 VAL 70 -7.568 7.296 18.816 520 HG23 VAL 70 2HG2 VAL 70 -7.365 9.080 18.997 521 H ALA 71 H ALA 71 -4.105 7.920 14.994 522 HA ALA 71 HA ALA 71 -5.598 7.839 12.517 523 HB1 ALA 71 1HB ALA 71 -3.480 8.590 11.451 524 HB2 ALA 71 2HB ALA 71 -2.579 8.319 12.982 525 HB3 ALA 71 3HB ALA 71 -3.818 9.618 12.890 526 H GLU 72 H GLU 72 -2.778 6.190 14.011 527 HA GLU 72 HA GLU 72 -2.107 4.367 12.099 528 HB2 GLU 72 2HB GLU 72 -2.344 3.824 15.134 529 HB3 GLU 72 1HB GLU 72 -1.492 2.755 13.981 530 HG2 GLU 72 2HG GLU 72 0.270 4.441 13.606 531 HG3 GLU 72 1HG GLU 72 -0.578 5.616 14.680 532 H GLN 73 H GLN 73 -4.660 4.053 14.612 533 HA GLN 73 HA GLN 73 -5.096 1.348 14.180 534 HB2 GLN 73 2HB GLN 73 -5.746 2.629 16.231 535 HB3 GLN 73 1HB GLN 73 -7.109 3.376 15.341 536 HG2 GLN 73 2HG GLN 73 -6.763 0.310 15.644 537 HG3 GLN 73 1HG GLN 73 -7.425 1.316 16.981 538 HE21 GLN 73 1HE2 GLN 73 -8.449 -0.613 14.465 539 HE22 GLN 73 2HE2 GLN 73 -9.982 0.137 14.129 540 H VAL 74 H VAL 74 -6.495 4.234 12.587 541 HA VAL 74 HA VAL 74 -8.588 2.733 11.350 542 HB VAL 74 HB VAL 74 -7.424 5.454 10.555 543 HG11 VAL 74 1HG1 VAL 74 -8.795 4.428 8.728 544 HG12 VAL 74 2HG1 VAL 74 -9.721 5.756 9.504 545 HG13 VAL 74 3HG1 VAL 74 -10.114 4.038 9.892 546 HG21 VAL 74 3HG2 VAL 74 -8.252 5.359 12.956 547 HG22 VAL 74 1HG2 VAL 74 -9.812 4.699 12.377 548 HG23 VAL 74 2HG2 VAL 74 -9.294 6.369 11.910 549 H MET 75 H MET 75 -5.329 3.889 10.438 550 HA MET 75 HA MET 75 -5.319 3.035 7.793 551 HB2 MET 75 2HB MET 75 -3.029 3.138 9.852 552 HB3 MET 75 1HB MET 75 -2.794 2.981 8.084 553 HG2 MET 75 2HG MET 75 -3.485 5.198 7.641 554 HG3 MET 75 1HG MET 75 -4.378 5.366 9.174 555 HE1 MET 75 3HE MET 75 -1.205 7.978 9.118 556 HE2 MET 75 1HE MET 75 -3.000 7.922 9.158 557 HE3 MET 75 2HE MET 75 -2.102 7.340 7.705 558 H LYS 76 H LYS 76 -4.201 1.355 10.781 559 HA LYS 76 HA LYS 76 -3.432 -1.004 9.491 560 HB2 LYS 76 2HB LYS 76 -2.698 -0.337 11.805 561 HB3 LYS 76 1HB LYS 76 -4.350 -0.679 12.416 562 HG2 LYS 76 2HG LYS 76 -4.088 -3.098 11.885 563 HG3 LYS 76 1HG LYS 76 -2.555 -2.759 11.011 564 HD2 LYS 76 2HD LYS 76 -1.549 -1.916 13.163 565 HD3 LYS 76 1HD LYS 76 -3.005 -2.457 14.059 566 HE2 LYS 76 2HE LYS 76 -1.273 -4.363 12.310 567 HE3 LYS 76 1HE LYS 76 -0.889 -4.002 14.033 568 HZ1 LYS 76 3HZ LYS 76 -3.427 -5.320 13.084 569 HZ2 LYS 76 1HZ LYS 76 -3.027 -4.894 14.670 570 HZ3 LYS 76 2HZ LYS 76 -2.024 -5.999 13.863 571 H ALA 77 H ALA 77 -6.568 0.005 10.910 572 HA ALA 77 HA ALA 77 -7.804 -2.500 10.752 573 HB1 ALA 77 1HB ALA 77 -9.983 -1.244 10.790 574 HB2 ALA 77 2HB ALA 77 -9.094 0.293 10.463 575 HB3 ALA 77 3HB ALA 77 -8.835 -0.584 12.012 576 H GLY 78 H GLY 78 -7.447 0.157 8.378 577 HA2 GLY 78 2HA GLY 78 -9.115 -0.925 6.396 578 HA3 GLY 78 1HA GLY 78 -7.743 0.234 6.186 579 H ILE 79 H ILE 79 -5.574 -1.172 6.930 580 HA ILE 79 HA ILE 79 -5.036 -2.785 4.743 581 HB ILE 79 HB ILE 79 -3.623 -2.594 7.443 582 HG12 ILE 79 2HG1 ILE 79 -2.937 -1.336 4.703 583 HG13 ILE 79 1HG1 ILE 79 -3.810 -0.469 5.992 584 HG21 ILE 79 1HG2 ILE 79 -2.647 -3.864 4.789 585 HG22 ILE 79 2HG2 ILE 79 -2.976 -4.752 6.323 586 HG23 ILE 79 3HG2 ILE 79 -1.622 -3.590 6.242 587 HD11 ILE 79 3HD ILE 79 -0.924 -1.559 6.197 588 HD12 ILE 79 1HD ILE 79 -1.432 0.155 6.061 589 HD13 ILE 79 2HD ILE 79 -1.837 -0.779 7.548 590 H GLU 80 H GLU 80 -5.887 -3.772 8.151 591 HA GLU 80 HA GLU 80 -5.632 -6.511 7.590 592 HB2 GLU 80 2HB GLU 80 -7.280 -5.097 9.756 593 HB3 GLU 80 1HB GLU 80 -7.175 -6.886 9.600 594 HG2 GLU 80 2HG GLU 80 -4.678 -6.781 9.831 595 HG3 GLU 80 1HG GLU 80 -4.786 -5.004 10.114 596 H VAL 81 H VAL 81 -8.456 -4.319 7.256 597 HA VAL 81 HA VAL 81 -10.284 -6.365 6.613 598 HB VAL 81 HB VAL 81 -10.183 -3.358 6.181 599 HG11 VAL 81 1HG1 VAL 81 -12.620 -3.525 5.408 600 HG12 VAL 81 2HG1 VAL 81 -12.366 -5.286 5.144 601 HG13 VAL 81 3HG1 VAL 81 -11.422 -4.078 4.197 602 HG21 VAL 81 3HG2 VAL 81 -10.597 -4.346 8.483 603 HG22 VAL 81 1HG2 VAL 81 -12.013 -5.248 7.829 604 HG23 VAL 81 2HG2 VAL 81 -12.029 -3.450 7.872 605 H PHE 82 H PHE 82 -8.318 -4.171 4.486 606 HA PHE 82 HA PHE 82 -9.305 -5.302 2.113 607 HB2 PHE 82 2HB PHE 82 -6.577 -3.928 2.569 608 HB3 PHE 82 1HB PHE 82 -7.334 -4.223 0.963 609 HD1 PHE 82 2HD PHE 82 -10.275 -3.357 1.810 610 HD2 PHE 82 1HD PHE 82 -6.369 -1.620 2.356 611 HE1 PHE 82 2HE PHE 82 -11.280 -1.119 1.943 612 HE2 PHE 82 1HE PHE 82 -7.385 0.614 2.491 613 HZ PHE 82 HZ PHE 82 -9.842 0.884 2.290 614 H ALA 83 H ALA 83 -6.408 -6.055 4.100 615 HA ALA 83 HA ALA 83 -5.291 -7.845 2.278 616 HB1 ALA 83 1HB ALA 83 -3.998 -6.909 4.212 617 HB2 ALA 83 2HB ALA 83 -3.934 -8.705 4.191 618 HB3 ALA 83 3HB ALA 83 -5.028 -7.850 5.349 619 H LEU 84 H LEU 84 -7.840 -8.256 4.722 620 HA LEU 84 HA LEU 84 -7.795 -11.066 4.785 621 HB2 LEU 84 2HB LEU 84 -8.851 -9.571 6.486 622 HB3 LEU 84 1HB LEU 84 -10.151 -9.153 5.338 623 HG LEU 84 HG LEU 84 -9.642 -12.091 6.026 624 HD11 LEU 84 1HD1 LEU 84 -11.092 -10.130 7.922 625 HD12 LEU 84 2HD1 LEU 84 -9.512 -10.941 8.227 626 HD13 LEU 84 3HD1 LEU 84 -11.014 -11.924 8.101 627 HD21 LEU 84 3HD2 LEU 84 -12.257 -10.487 5.583 628 HD22 LEU 84 1HD2 LEU 84 -12.148 -12.256 5.913 629 HD23 LEU 84 2HD2 LEU 84 -11.481 -11.586 4.389 630 H VAL 85 H VAL 85 -9.224 -8.737 2.512 631 HA VAL 85 HA VAL 85 -11.149 -10.397 1.384 632 HB VAL 85 HB VAL 85 -9.595 -8.139 0.026 633 HG11 VAL 85 1HG1 VAL 85 -10.813 -9.443 -1.693 634 HG12 VAL 85 2HG1 VAL 85 -11.700 -7.918 -1.377 635 HG13 VAL 85 3HG1 VAL 85 -12.306 -9.466 -0.678 636 HG21 VAL 85 3HG2 VAL 85 -11.624 -6.769 0.737 637 HG22 VAL 85 1HG2 VAL 85 -10.643 -7.347 2.110 638 HG23 VAL 85 2HG2 VAL 85 -12.196 -8.168 1.719 639 H THR 86 H THR 86 -7.692 -10.557 1.167 640 HA THR 86 HA THR 86 -7.336 -11.775 -1.243 641 HB THR 86 HB THR 86 -5.724 -12.471 1.234 642 HG1 THR 86 1HG THR 86 -5.626 -10.394 1.318 643 HG21 THR 86 3HG2 THR 86 -5.025 -12.130 -1.785 644 HG22 THR 86 1HG2 THR 86 -5.134 -13.703 -0.914 645 HG23 THR 86 2HG2 THR 86 -3.857 -12.516 -0.475 646 H ALA 87 H ALA 87 -8.768 -13.130 1.674 647 HA ALA 87 HA ALA 87 -8.534 -15.850 1.136 648 HB1 ALA 87 1HB ALA 87 -9.445 -14.939 3.291 649 HB2 ALA 87 2HB ALA 87 -10.606 -16.093 2.543 650 HB3 ALA 87 3HB ALA 87 -10.885 -14.311 2.418 651 H ALA 88 H ALA 88 -10.488 -13.345 -0.368 652 HA ALA 88 HA ALA 88 -12.179 -15.281 -1.712 653 HB1 ALA 88 1HB ALA 88 -13.295 -13.173 -0.931 654 HB2 ALA 88 2HB ALA 88 -13.321 -13.288 -2.732 655 HB3 ALA 88 3HB ALA 88 -12.141 -12.204 -1.913 656 H LEU 89 H LEU 89 -9.679 -12.834 -2.360 657 HA LEU 89 HA LEU 89 -9.715 -12.721 -5.039 658 HB2 LEU 89 2HB LEU 89 -7.304 -12.585 -3.148 659 HB3 LEU 89 1HB LEU 89 -7.232 -12.078 -4.831 660 HG LEU 89 HG LEU 89 -8.972 -10.772 -2.684 661 HD11 LEU 89 1HD1 LEU 89 -7.465 -8.831 -2.961 662 HD12 LEU 89 2HD1 LEU 89 -6.526 -9.696 -4.232 663 HD13 LEU 89 3HD1 LEU 89 -6.494 -10.279 -2.533 664 HD21 LEU 89 3HD2 LEU 89 -8.681 -9.986 -5.656 665 HD22 LEU 89 1HD2 LEU 89 -9.502 -9.021 -4.381 666 HD23 LEU 89 2HD2 LEU 89 -10.181 -10.611 -4.862 667 H ALA 90 H ALA 90 -7.791 -15.145 -3.185 668 HA ALA 90 HA ALA 90 -6.722 -16.247 -5.581 669 HB1 ALA 90 1HB ALA 90 -5.603 -16.625 -3.382 670 HB2 ALA 90 2HB ALA 90 -5.974 -18.181 -4.204 671 HB3 ALA 90 3HB ALA 90 -7.012 -17.608 -2.847 672 H THR 91 H THR 91 -9.436 -17.278 -3.437 673 HA THR 91 HA THR 91 -10.006 -19.626 -4.834 674 HB THR 91 HB THR 91 -12.158 -19.594 -3.577 675 HG1 THR 91 1HG THR 91 -11.546 -16.923 -3.418 676 HG21 THR 91 3HG2 THR 91 -10.004 -20.400 -2.528 677 HG22 THR 91 1HG2 THR 91 -11.108 -19.645 -1.322 678 HG23 THR 91 2HG2 THR 91 -9.682 -18.735 -1.908 679 H ASP 92 H ASP 92 -10.434 -16.453 -5.937 680 HA ASP 92 HA ASP 92 -12.840 -16.826 -7.409 681 HB2 ASP 92 2HB ASP 92 -11.774 -14.552 -6.758 682 HB3 ASP 92 1HB ASP 92 -10.587 -14.807 -8.061 683 H PHE 93 H PHE 93 -9.483 -16.362 -8.611 684 HA PHE 93 HA PHE 93 -10.232 -17.794 -10.994 685 HB2 PHE 93 2HB PHE 93 -7.538 -16.478 -10.263 686 HB3 PHE 93 1HB PHE 93 -8.079 -16.974 -11.915 687 HD1 PHE 93 2HD PHE 93 -10.053 -15.804 -12.974 688 HD2 PHE 93 1HD PHE 93 -8.312 -14.413 -9.289 689 HE1 PHE 93 2HE PHE 93 -11.148 -13.614 -13.275 690 HE2 PHE 93 1HE PHE 93 -9.411 -12.223 -9.601 691 HZ PHE 93 HZ PHE 93 -10.832 -11.819 -11.590 692 H VAL 94 H VAL 94 -8.956 -18.945 -8.056 693 HA VAL 94 HA VAL 94 -7.063 -20.831 -9.054 694 HB VAL 94 HB VAL 94 -8.650 -20.586 -6.498 695 HG11 VAL 94 1HG1 VAL 94 -6.946 -23.048 -7.290 696 HG12 VAL 94 2HG1 VAL 94 -8.694 -23.045 -6.845 697 HG13 VAL 94 3HG1 VAL 94 -7.451 -22.640 -5.615 698 HG21 VAL 94 3HG2 VAL 94 -5.621 -20.848 -7.121 699 HG22 VAL 94 1HG2 VAL 94 -6.366 -20.392 -5.548 700 HG23 VAL 94 2HG2 VAL 94 -6.492 -19.277 -6.956 701 H ARG 95 H ARG 95 -10.540 -20.648 -9.000 702 HA ARG 95 HA ARG 95 -11.202 -23.317 -9.251 703 HB2 ARG 95 2HB ARG 95 -12.552 -20.803 -10.411 704 HB3 ARG 95 1HB ARG 95 -13.328 -22.423 -10.341 705 HG2 ARG 95 2HG ARG 95 -13.248 -22.444 -7.900 706 HG3 ARG 95 1HG ARG 95 -12.297 -20.917 -7.856 707 HD2 ARG 95 2HD ARG 95 -14.156 -19.595 -8.748 708 HD3 ARG 95 1HD ARG 95 -15.176 -21.060 -9.004 709 HE ARG 95 HE ARG 95 -14.377 -19.767 -6.442 710 HH11 ARG 95 1HH2 ARG 95 -15.891 -22.656 -7.971 711 HH12 ARG 95 2HH2 ARG 95 -16.674 -23.230 -6.594 712 HH21 ARG 95 1HH1 ARG 95 -15.809 -20.351 -4.562 713 HH22 ARG 95 2HH1 ARG 95 -16.892 -21.655 -4.661 714 H ARG 96 H ARG 96 -9.640 -21.273 -11.604 715 HA ARG 96 HA ARG 96 -10.494 -22.280 -14.007 716 HB2 ARG 96 2HB ARG 96 -8.322 -21.589 -14.933 717 HB3 ARG 96 1HB ARG 96 -8.807 -20.387 -13.691 718 HG2 ARG 96 2HG ARG 96 -7.354 -21.700 -12.014 719 HG3 ARG 96 1HG ARG 96 -6.780 -22.688 -13.410 720 HD2 ARG 96 2HD ARG 96 -5.708 -20.720 -14.447 721 HD3 ARG 96 1HD ARG 96 -6.206 -19.685 -13.041 722 HE ARG 96 HE ARG 96 -4.274 -22.012 -13.036 723 HH11 ARG 96 1HH2 ARG 96 -6.119 -19.684 -10.981 724 HH12 ARG 96 2HH2 ARG 96 -5.008 -19.785 -9.678 725 HH21 ARG 96 1HH1 ARG 96 -3.004 -22.377 -11.157 726 HH22 ARG 96 2HH1 ARG 96 -3.178 -21.373 -9.756 727 H GLU 97 H GLU 97 -8.364 -23.765 -11.583 728 HA GLU 97 HA GLU 97 -7.296 -25.764 -13.341 729 HB2 GLU 97 2HB GLU 97 -5.971 -25.065 -11.345 730 HB3 GLU 97 1HB GLU 97 -7.348 -25.455 -10.265 731 HG2 GLU 97 2HG GLU 97 -5.625 -27.169 -10.070 732 HG3 GLU 97 1HG GLU 97 -7.081 -27.917 -10.803 733 H GLU 98 H GLU 98 -9.740 -25.562 -10.696 734 HA GLU 98 HA GLU 98 -10.371 -28.291 -10.982 735 HB2 GLU 98 2HB GLU 98 -12.089 -26.232 -9.515 736 HB3 GLU 98 1HB GLU 98 -12.106 -28.022 -9.380 737 HG2 GLU 98 2HG GLU 98 -9.484 -27.665 -8.810 738 HG3 GLU 98 1HG GLU 98 -10.037 -26.029 -8.306 739 H GLU 99 H GLU 99 -11.631 -25.364 -12.635 740 HA GLU 99 HA GLU 99 -13.854 -26.782 -13.702 741 HB2 GLU 99 2HB GLU 99 -12.528 -24.225 -14.731 742 HB3 GLU 99 1HB GLU 99 -13.956 -25.015 -15.476 743 HG2 GLU 99 2HG GLU 99 -15.145 -24.854 -13.205 744 HG3 GLU 99 1HG GLU 99 -13.829 -23.744 -12.671 745 H ARG 100 H ARG 100 -10.457 -26.623 -14.589 746 HA ARG 100 HA ARG 100 -10.823 -27.683 -17.224 747 HB2 ARG 100 2HB ARG 100 -8.849 -26.288 -16.489 748 HB3 ARG 100 1HB ARG 100 -8.368 -27.593 -15.366 749 HG2 ARG 100 2HG ARG 100 -7.913 -29.109 -17.308 750 HG3 ARG 100 1HG ARG 100 -8.543 -27.873 -18.437 751 HD2 ARG 100 2HD ARG 100 -6.006 -27.959 -18.349 752 HD3 ARG 100 1HD ARG 100 -6.694 -26.332 -17.946 753 HE ARG 100 HE ARG 100 -6.395 -27.725 -15.458 754 HH11 ARG 100 1HH2 ARG 100 -4.228 -26.498 -18.110 755 HH12 ARG 100 2HH2 ARG 100 -2.968 -26.103 -17.055 756 HH21 ARG 100 1HH1 ARG 100 -4.660 -27.246 -14.058 757 HH22 ARG 100 2HH1 ARG 100 -3.238 -26.468 -14.584 758 H ARG 101 H ARG 101 -9.955 -28.926 -13.954 759 HA ARG 101 HA ARG 101 -10.434 -31.680 -14.897 760 HB2 ARG 101 2HB ARG 101 -8.232 -30.638 -12.991 761 HB3 ARG 101 1HB ARG 101 -8.530 -32.361 -13.415 762 HG2 ARG 101 2HG ARG 101 -8.089 -31.791 -15.836 763 HG3 ARG 101 1HG ARG 101 -7.665 -30.116 -15.368 764 HD2 ARG 101 2HD ARG 101 -6.147 -32.593 -14.291 765 HD3 ARG 101 1HD ARG 101 -5.736 -31.733 -15.833 766 HE ARG 101 HE ARG 101 -5.838 -29.761 -13.691 767 HH11 ARG 101 1HH2 ARG 101 -3.759 -32.418 -15.103 768 HH12 ARG 101 2HH2 ARG 101 -2.359 -31.853 -14.291 769 HH21 ARG 101 1HH1 ARG 101 -3.779 -28.997 -12.721 770 HH22 ARG 101 2HH1 ARG 101 -2.335 -29.901 -13.003 771 H GLY 102 H GLY 102 -12.651 -31.518 -13.956 772 HA2 GLY 102 2HA GLY 102 -13.116 -32.593 -11.608 773 HA3 GLY 102 1HA GLY 102 -12.789 -30.871 -11.130 774 H HIS 103 H HIS 103 -13.748 -29.379 -12.951 775 HA HIS 103 HA HIS 103 -15.516 -28.231 -13.296 776 HB2 HIS 103 2HB HIS 103 -17.052 -28.756 -15.082 777 HB3 HIS 103 1HB HIS 103 -15.359 -29.112 -15.502 778 HD1 HIS 103 1HD HIS 103 -18.346 -31.330 -14.186 779 HD2 HIS 103 2HD HIS 103 -15.288 -31.216 -17.107 780 HE1 HIS 103 1HE HIS 103 -18.670 -33.300 -15.697 781 HE2 HIS 103 2HE HIS 103 -16.826 -33.189 -17.475 782 H1 SER 1 H SER 1 0.361 -13.415 -23.850 783 HA SER 1 HA SER 1 1.538 -15.211 -23.162 784 HB2 SER 1 2HB SER 1 2.264 -13.163 -21.923 785 HB3 SER 1 1HB SER 1 1.085 -13.523 -20.623 786 HG SER 1 1HG SER 1 3.289 -14.137 -20.231 787 H ALA 2 H ALA 2 -1.424 -14.625 -21.172 788 HA ALA 2 HA ALA 2 -2.181 -17.268 -21.415 789 HB1 ALA 2 1HB ALA 2 -2.155 -17.979 -18.970 790 HB2 ALA 2 2HB ALA 2 -1.183 -16.492 -18.583 791 HB3 ALA 2 3HB ALA 2 -0.489 -17.801 -19.605 792 H ASP 3 H ASP 3 -4.207 -17.553 -20.042 793 HA ASP 3 HA ASP 3 -5.905 -15.478 -20.566 794 HB2 ASP 3 2HB ASP 3 -6.597 -17.858 -20.286 795 HB3 ASP 3 1HB ASP 3 -6.348 -17.737 -18.506 796 H HIS 4 H HIS 4 -4.274 -16.306 -17.604 797 HA HIS 4 HA HIS 4 -5.583 -14.387 -15.948 798 HB2 HIS 4 2HB HIS 4 -3.817 -14.856 -14.293 799 HB3 HIS 4 1HB HIS 4 -4.516 -16.375 -14.906 800 HD1 HIS 4 1HD HIS 4 -2.730 -17.960 -16.331 801 HD2 HIS 4 2HD HIS 4 -1.117 -14.365 -14.803 802 HE1 HIS 4 1HE HIS 4 -0.259 -18.171 -16.387 803 HE2 HIS 4 2HE HIS 4 0.682 -15.953 -15.474 804 H GLU 5 H GLU 5 -2.836 -14.198 -18.199 805 HA GLU 5 HA GLU 5 -1.685 -11.917 -16.827 806 HB2 GLU 5 2HB GLU 5 -1.028 -13.194 -19.552 807 HB3 GLU 5 1HB GLU 5 -0.179 -11.776 -18.853 808 HG2 GLU 5 2HG GLU 5 -0.262 -14.572 -17.559 809 HG3 GLU 5 1HG GLU 5 1.108 -13.893 -18.500 810 H ARG 6 H ARG 6 -3.580 -12.692 -19.810 811 HA ARG 6 HA ARG 6 -3.560 -10.045 -20.715 812 HB2 ARG 6 2HB ARG 6 -5.504 -10.565 -22.135 813 HB3 ARG 6 1HB ARG 6 -4.188 -11.764 -22.312 814 HG2 ARG 6 2HG ARG 6 -5.408 -13.416 -21.012 815 HG3 ARG 6 1HG ARG 6 -6.703 -12.232 -20.585 816 HD2 ARG 6 2HD ARG 6 -7.401 -12.073 -22.982 817 HD3 ARG 6 1HD ARG 6 -6.108 -13.268 -23.438 818 HE ARG 6 HE ARG 6 -7.665 -14.449 -21.345 819 HH11 ARG 6 1HH2 ARG 6 -8.359 -13.350 -24.752 820 HH12 ARG 6 2HH2 ARG 6 -9.495 -14.592 -25.008 821 HH21 ARG 6 1HH1 ARG 6 -9.150 -16.001 -21.715 822 HH22 ARG 6 2HH1 ARG 6 -10.046 -16.200 -23.191 823 H GLU 7 H GLU 7 -5.735 -11.737 -18.441 824 HA GLU 7 HA GLU 7 -7.589 -9.633 -18.379 825 HB2 GLU 7 2HB GLU 7 -7.704 -12.228 -17.578 826 HB3 GLU 7 1HB GLU 7 -7.332 -11.487 -15.993 827 HG2 GLU 7 2HG GLU 7 -9.748 -11.633 -16.158 828 HG3 GLU 7 1HG GLU 7 -9.350 -9.897 -16.426 829 H ALA 8 H ALA 8 -4.644 -10.363 -16.520 830 HA ALA 8 HA ALA 8 -5.036 -8.516 -14.445 831 HB1 ALA 8 1HB ALA 8 -2.396 -9.526 -15.703 832 HB2 ALA 8 2HB ALA 8 -3.257 -10.281 -14.310 833 HB3 ALA 8 3HB ALA 8 -2.534 -8.636 -14.144 834 H GLN 9 H GLN 9 -3.330 -8.244 -17.619 835 HA GLN 9 HA GLN 9 -2.660 -5.517 -17.057 836 HB2 GLN 9 2HB GLN 9 -2.431 -7.050 -19.697 837 HB3 GLN 9 1HB GLN 9 -1.697 -5.450 -19.303 838 HG2 GLN 9 2HG GLN 9 -0.505 -6.561 -17.321 839 HG3 GLN 9 1HG GLN 9 -1.069 -8.157 -17.927 840 HE21 GLN 9 1HE2 GLN 9 1.485 -5.906 -18.067 841 HE22 GLN 9 2HE2 GLN 9 2.259 -6.484 -19.509 842 H LYS 10 H LYS 10 -5.533 -7.018 -18.181 843 HA LYS 10 HA LYS 10 -6.425 -4.763 -19.687 844 HB2 LYS 10 2HB LYS 10 -7.262 -7.224 -19.921 845 HB3 LYS 10 1HB LYS 10 -8.200 -6.942 -18.422 846 HG2 LYS 10 2HG LYS 10 -9.599 -6.670 -20.430 847 HG3 LYS 10 1HG LYS 10 -9.442 -5.081 -19.602 848 HD2 LYS 10 2HD LYS 10 -7.738 -4.338 -21.239 849 HD3 LYS 10 1HD LYS 10 -7.717 -5.966 -22.011 850 HE2 LYS 10 2HE LYS 10 -10.063 -5.645 -22.793 851 HE3 LYS 10 1HE LYS 10 -10.170 -4.074 -21.898 852 HZ1 LYS 10 3HZ LYS 10 -9.749 -3.761 -24.208 853 HZ2 LYS 10 1HZ LYS 10 -8.269 -4.624 -24.152 854 HZ3 LYS 10 2HZ LYS 10 -8.433 -3.186 -23.280 855 H ALA 11 H ALA 11 -6.421 -5.794 -16.316 856 HA ALA 11 HA ALA 11 -8.449 -4.082 -15.394 857 HB1 ALA 11 1HB ALA 11 -7.531 -4.506 -13.141 858 HB2 ALA 11 2HB ALA 11 -5.972 -5.076 -13.840 859 HB3 ALA 11 3HB ALA 11 -7.476 -6.038 -14.078 860 H GLU 12 H GLU 12 -4.943 -3.666 -15.917 861 HA GLU 12 HA GLU 12 -4.772 -1.120 -14.749 862 HB2 GLU 12 2HB GLU 12 -2.965 -2.371 -16.903 863 HB3 GLU 12 1HB GLU 12 -2.572 -0.968 -15.847 864 HG2 GLU 12 2HG GLU 12 -2.855 -2.484 -13.814 865 HG3 GLU 12 1HG GLU 12 -3.042 -3.894 -14.921 866 H GLU 13 H GLU 13 -5.975 -2.165 -17.877 867 HA GLU 13 HA GLU 13 -5.694 0.358 -19.202 868 HB2 GLU 13 2HB GLU 13 -6.005 -1.888 -20.402 869 HB3 GLU 13 1HB GLU 13 -7.699 -1.898 -19.816 870 HG2 GLU 13 2HG GLU 13 -8.066 0.309 -21.085 871 HG3 GLU 13 1HG GLU 13 -6.391 0.146 -21.732 872 H GLU 14 H GLU 14 -8.210 -1.399 -17.399 873 HA GLU 14 HA GLU 14 -10.274 0.439 -17.755 874 HB2 GLU 14 2HB GLU 14 -10.379 -2.039 -16.947 875 HB3 GLU 14 1HB GLU 14 -9.903 -1.417 -15.341 876 HG2 GLU 14 2HG GLU 14 -12.230 -1.609 -15.170 877 HG3 GLU 14 1HG GLU 14 -12.053 0.138 -15.543 878 H LEU 15 H LEU 15 -7.663 0.199 -15.358 879 HA LEU 15 HA LEU 15 -8.576 1.937 -13.466 880 HB2 LEU 15 2HB LEU 15 -6.457 0.538 -13.336 881 HB3 LEU 15 1HB LEU 15 -5.648 1.680 -14.435 882 HG LEU 15 HG LEU 15 -5.765 3.490 -12.818 883 HD11 LEU 15 1HD1 LEU 15 -7.555 1.641 -11.124 884 HD12 LEU 15 2HD1 LEU 15 -7.935 3.276 -11.772 885 HD13 LEU 15 3HD1 LEU 15 -6.732 3.089 -10.462 886 HD21 LEU 15 3HD2 LEU 15 -3.882 1.899 -12.557 887 HD22 LEU 15 1HD2 LEU 15 -4.832 0.928 -11.376 888 HD23 LEU 15 2HD2 LEU 15 -4.362 2.615 -10.978 889 H GLN 16 H GLN 16 -6.787 2.671 -16.448 890 HA GLN 16 HA GLN 16 -6.357 5.393 -15.964 891 HB2 GLN 16 2HB GLN 16 -6.579 3.817 -18.581 892 HB3 GLN 16 1HB GLN 16 -5.971 5.506 -18.479 893 HG2 GLN 16 2HG GLN 16 -4.015 4.873 -17.216 894 HG3 GLN 16 1HG GLN 16 -4.668 3.252 -16.810 895 HE21 GLN 16 1HE2 GLN 16 -4.074 1.570 -18.101 896 HE22 GLN 16 2HE2 GLN 16 -3.542 1.676 -19.752 897 H LYS 17 H LYS 17 -9.041 3.606 -17.431 898 HA LYS 17 HA LYS 17 -10.422 5.799 -18.472 899 HB2 LYS 17 2HB LYS 17 -10.739 3.252 -18.912 900 HB3 LYS 17 1HB LYS 17 -11.656 3.200 -17.380 901 HG2 LYS 17 2HG LYS 17 -13.224 5.015 -18.472 902 HG3 LYS 17 1HG LYS 17 -12.317 4.692 -19.988 903 HD2 LYS 17 2HD LYS 17 -14.218 3.277 -20.167 904 HD3 LYS 17 1HD LYS 17 -12.916 2.173 -19.586 905 HE2 LYS 17 2HE LYS 17 -13.838 2.690 -17.163 906 HE3 LYS 17 1HE LYS 17 -15.258 3.432 -18.001 907 HZ1 LYS 17 3HZ LYS 17 -15.560 1.140 -17.297 908 HZ2 LYS 17 1HZ LYS 17 -14.271 0.633 -18.285 909 HZ3 LYS 17 2HZ LYS 17 -15.742 1.257 -18.979 910 H VAL 18 H VAL 18 -10.491 4.223 -15.246 911 HA VAL 18 HA VAL 18 -12.810 5.601 -14.370 912 HB VAL 18 HB VAL 18 -10.701 4.015 -12.830 913 HG11 VAL 18 1HG1 VAL 18 -13.398 5.241 -11.916 914 HG12 VAL 18 2HG1 VAL 18 -11.770 5.545 -11.211 915 HG13 VAL 18 3HG1 VAL 18 -12.534 3.936 -11.024 916 HG21 VAL 18 3HG2 VAL 18 -13.573 3.349 -13.807 917 HG22 VAL 18 1HG2 VAL 18 -12.494 2.256 -12.862 918 HG23 VAL 18 2HG2 VAL 18 -12.057 2.719 -14.537 919 H LEU 19 H LEU 19 -9.283 6.061 -13.719 920 HA LEU 19 HA LEU 19 -9.732 8.268 -12.018 921 HB2 LEU 19 2HB LEU 19 -7.325 8.683 -12.142 922 HB3 LEU 19 1HB LEU 19 -7.694 6.961 -11.923 923 HG LEU 19 HG LEU 19 -7.410 6.843 -14.569 924 HD11 LEU 19 1HD1 LEU 19 -5.632 9.279 -13.882 925 HD12 LEU 19 2HD1 LEU 19 -7.013 9.285 -15.028 926 HD13 LEU 19 3HD1 LEU 19 -5.557 8.314 -15.401 927 HD21 LEU 19 3HD2 LEU 19 -6.101 5.582 -12.921 928 HD22 LEU 19 1HD2 LEU 19 -5.055 7.005 -12.592 929 HD23 LEU 19 2HD2 LEU 19 -5.021 6.216 -14.214 930 H GLU 20 H GLU 20 -9.320 7.971 -15.597 931 HA GLU 20 HA GLU 20 -9.266 10.736 -16.035 932 HB2 GLU 20 2HB GLU 20 -10.145 8.493 -17.921 933 HB3 GLU 20 1HB GLU 20 -10.273 10.227 -18.338 934 HG2 GLU 20 2HG GLU 20 -7.717 10.404 -17.789 935 HG3 GLU 20 1HG GLU 20 -7.707 8.608 -17.910 936 H GLU 21 H GLU 21 -12.102 8.485 -15.644 937 HA GLU 21 HA GLU 21 -13.944 10.458 -16.445 938 HB2 GLU 21 2HB GLU 21 -14.476 7.920 -16.113 939 HB3 GLU 21 1HB GLU 21 -14.663 8.310 -14.375 940 HG2 GLU 21 2HG GLU 21 -16.383 10.142 -15.152 941 HG3 GLU 21 1HG GLU 21 -16.262 9.405 -16.788 942 H ALA 22 H ALA 22 -12.443 9.639 -13.350 943 HA ALA 22 HA ALA 22 -13.961 11.378 -11.752 944 HB1 ALA 22 1HB ALA 22 -12.164 11.122 -10.062 945 HB2 ALA 22 2HB ALA 22 -11.064 10.435 -11.313 946 HB3 ALA 22 3HB ALA 22 -12.542 9.531 -10.823 947 H SER 23 H SER 23 -11.313 12.013 -13.997 948 HA SER 23 HA SER 23 -10.458 14.392 -12.740 949 HB2 SER 23 2HB SER 23 -9.225 14.969 -14.698 950 HB3 SER 23 1HB SER 23 -9.019 13.209 -14.403 951 HG SER 23 1HG SER 23 -10.608 12.880 -16.086 952 H LYS 24 H LYS 24 -13.007 13.699 -15.159 953 HA LYS 24 HA LYS 24 -13.527 16.409 -15.765 954 HB2 LYS 24 2HB LYS 24 -14.449 14.634 -17.233 955 HB3 LYS 24 1HB LYS 24 -15.426 13.976 -15.869 956 HG2 LYS 24 2HG LYS 24 -16.725 16.124 -15.773 957 HG3 LYS 24 1HG LYS 24 -15.719 16.800 -17.091 958 HD2 LYS 24 2HD LYS 24 -16.593 15.031 -18.653 959 HD3 LYS 24 1HD LYS 24 -17.619 14.375 -17.331 960 HE2 LYS 24 2HE LYS 24 -17.819 17.176 -18.655 961 HE3 LYS 24 1HE LYS 24 -19.017 15.823 -18.759 962 HZ1 LYS 24 3HZ LYS 24 -18.712 16.291 -16.069 963 HZ2 LYS 24 1HZ LYS 24 -19.987 16.795 -17.033 964 HZ3 LYS 24 2HZ LYS 24 -18.660 17.837 -16.725 965 H LYS 25 H LYS 25 -14.836 14.113 -13.421 966 HA LYS 25 HA LYS 25 -16.803 15.786 -12.323 967 HB2 LYS 25 2HB LYS 25 -15.337 13.338 -11.175 968 HB3 LYS 25 1HB LYS 25 -16.812 14.088 -10.464 969 HG2 LYS 25 2HG LYS 25 -18.106 13.652 -12.504 970 HG3 LYS 25 1HG LYS 25 -16.674 12.976 -13.358 971 HD2 LYS 25 2HD LYS 25 -16.613 11.029 -11.868 972 HD3 LYS 25 1HD LYS 25 -17.942 11.722 -10.860 973 HE2 LYS 25 2HE LYS 25 -19.528 11.595 -12.777 974 HE3 LYS 25 1HE LYS 25 -18.230 10.958 -13.861 975 HZ1 LYS 25 3HZ LYS 25 -19.907 9.387 -12.806 976 HZ2 LYS 25 1HZ LYS 25 -19.041 9.552 -11.378 977 HZ3 LYS 25 2HZ LYS 25 -18.272 8.908 -12.816 978 H ALA 26 H ALA 26 -13.359 15.149 -11.422 979 HA ALA 26 HA ALA 26 -13.259 16.667 -9.154 980 HB1 ALA 26 1HB ALA 26 -11.391 15.170 -9.903 981 HB2 ALA 26 2HB ALA 26 -10.812 16.819 -9.489 982 HB3 ALA 26 3HB ALA 26 -10.999 16.340 -11.217 983 H VAL 27 H VAL 27 -12.800 17.821 -12.555 984 HA VAL 27 HA VAL 27 -12.003 20.418 -11.848 985 HB VAL 27 HB VAL 27 -13.620 19.502 -14.301 986 HG11 VAL 27 1HG1 VAL 27 -12.701 21.608 -15.396 987 HG12 VAL 27 2HG1 VAL 27 -12.062 22.140 -13.795 988 HG13 VAL 27 3HG1 VAL 27 -13.838 21.988 -14.063 989 HG21 VAL 27 3HG2 VAL 27 -10.591 20.024 -13.947 990 HG22 VAL 27 1HG2 VAL 27 -11.435 19.478 -15.451 991 HG23 VAL 27 2HG2 VAL 27 -11.348 18.402 -14.024 992 H GLU 28 H GLU 28 -15.245 19.007 -12.416 993 HA GLU 28 HA GLU 28 -16.483 21.581 -12.111 994 HB2 GLU 28 2HB GLU 28 -17.679 18.771 -12.413 995 HB3 GLU 28 1HB GLU 28 -18.578 20.323 -12.498 996 HG2 GLU 28 2HG GLU 28 -17.121 21.030 -14.465 997 HG3 GLU 28 1HG GLU 28 -16.271 19.447 -14.380 998 H ALA 29 H ALA 29 -15.619 18.933 -10.049 999 HA ALA 29 HA ALA 29 -17.392 19.437 -7.938 1000 HB1 ALA 29 1HB ALA 29 -16.156 17.262 -8.237 1001 HB2 ALA 29 2HB ALA 29 -15.840 17.973 -6.640 1002 HB3 ALA 29 3HB ALA 29 -14.597 18.118 -7.924 1003 H GLU 30 H GLU 30 -13.898 20.382 -8.494 1004 HA GLU 30 HA GLU 30 -13.996 21.952 -6.101 1005 HB2 GLU 30 2HB GLU 30 -11.789 21.560 -8.150 1006 HB3 GLU 30 1HB GLU 30 -11.695 22.794 -6.854 1007 HG2 GLU 30 2HG GLU 30 -12.155 21.017 -5.127 1008 HG3 GLU 30 1HG GLU 30 -12.017 19.763 -6.409 1009 H ARG 31 H ARG 31 -14.920 22.645 -9.395 1010 HA ARG 31 HA ARG 31 -14.562 25.481 -9.118 1011 HB2 ARG 31 2HB ARG 31 -16.214 23.793 -11.038 1012 HB3 ARG 31 1HB ARG 31 -16.330 25.582 -11.051 1013 HG2 ARG 31 2HG ARG 31 -13.631 24.162 -11.340 1014 HG3 ARG 31 1HG ARG 31 -14.728 24.432 -12.741 1015 HD2 ARG 31 2HD ARG 31 -14.675 26.894 -12.396 1016 HD3 ARG 31 1HD ARG 31 -13.598 26.699 -10.949 1017 HE ARG 31 HE ARG 31 -12.198 25.351 -12.910 1018 HH11 ARG 31 1HH2 ARG 31 -13.709 28.601 -13.235 1019 HH12 ARG 31 2HH2 ARG 31 -12.259 29.409 -13.546 1020 HH21 ARG 31 1HH1 ARG 31 -10.350 26.381 -13.830 1021 HH22 ARG 31 2HH1 ARG 31 -10.296 28.093 -14.104 1022 H GLY 32 H GLY 32 -15.394 25.934 -7.053 1023 HA2 GLY 32 2HA GLY 32 -17.544 27.274 -6.666 1024 HA3 GLY 32 1HA GLY 32 -18.267 25.610 -6.653 1025 H ALA 33 H ALA 33 -15.255 24.927 -5.580 1026 HA ALA 33 HA ALA 33 -16.345 24.710 -2.968 1027 HB1 ALA 33 1HB ALA 33 -15.330 22.737 -3.909 1028 HB2 ALA 33 2HB ALA 33 -14.244 23.303 -2.596 1029 HB3 ALA 33 3HB ALA 33 -13.831 23.623 -4.311 1030 HA PRO 34 HA PRO 34 -13.873 28.069 -1.437 1031 HB2 PRO 34 2HB PRO 34 -14.203 27.797 1.291 1032 HB3 PRO 34 1HB PRO 34 -15.586 28.178 0.191 1033 HG2 PRO 34 2HG PRO 34 -14.796 25.439 1.327 1034 HG3 PRO 34 1HG PRO 34 -16.445 26.198 1.261 1035 HD2 PRO 34 2HD PRO 34 -15.448 24.372 -0.652 1036 HD3 PRO 34 1HD PRO 34 -16.682 25.657 -1.044 1037 H GLY 35 H GLY 35 -11.614 28.270 -1.391 1038 HA2 GLY 35 2HA GLY 35 -9.539 27.993 -0.635 1039 HA3 GLY 35 1HA GLY 35 -10.145 26.834 0.607 1040 H ALA 36 H ALA 36 -10.994 26.413 -2.729 1041 HA ALA 36 HA ALA 36 -9.782 23.851 -2.848 1042 HB1 ALA 36 1HB ALA 36 -11.994 24.304 -3.858 1043 HB2 ALA 36 2HB ALA 36 -10.847 23.776 -5.120 1044 HB3 ALA 36 3HB ALA 36 -11.275 25.521 -4.978 1045 H ALA 37 H ALA 37 -8.614 23.266 -4.989 1046 HA ALA 37 HA ALA 37 -6.395 25.232 -5.295 1047 HB1 ALA 37 1HB ALA 37 -5.781 23.469 -3.601 1048 HB2 ALA 37 2HB ALA 37 -4.818 23.278 -5.110 1049 HB3 ALA 37 3HB ALA 37 -6.229 22.189 -4.781 1050 H LEU 38 H LEU 38 -8.284 22.416 -6.597 1051 HA LEU 38 HA LEU 38 -6.656 22.501 -9.029 1052 HB2 LEU 38 2HB LEU 38 -7.073 20.260 -7.961 1053 HB3 LEU 38 1HB LEU 38 -8.820 20.592 -8.018 1054 HG LEU 38 HG LEU 38 -8.880 20.525 -10.441 1055 HD11 LEU 38 1HD1 LEU 38 -5.895 19.715 -10.420 1056 HD12 LEU 38 2HD1 LEU 38 -6.499 21.337 -10.931 1057 HD13 LEU 38 3HD1 LEU 38 -6.990 19.882 -11.841 1058 HD21 LEU 38 3HD2 LEU 38 -9.196 18.494 -9.013 1059 HD22 LEU 38 1HD2 LEU 38 -7.472 18.052 -9.240 1060 HD23 LEU 38 2HD2 LEU 38 -8.596 18.083 -10.656 1061 H ILE 39 H ILE 39 -7.506 23.432 -10.912 1062 HA ILE 39 HA ILE 39 -10.371 24.084 -10.846 1063 HB ILE 39 HB ILE 39 -9.795 26.381 -11.623 1064 HG12 ILE 39 2HG1 ILE 39 -6.899 25.695 -10.777 1065 HG13 ILE 39 1HG1 ILE 39 -7.444 25.820 -12.482 1066 HG21 ILE 39 1HG2 ILE 39 -8.584 25.743 -8.869 1067 HG22 ILE 39 2HG2 ILE 39 -10.345 25.829 -9.223 1068 HG23 ILE 39 3HG2 ILE 39 -9.318 27.293 -9.418 1069 HD11 ILE 39 3HD ILE 39 -7.443 28.096 -10.393 1070 HD12 ILE 39 1HD ILE 39 -6.375 27.929 -11.826 1071 HD13 ILE 39 2HD ILE 39 -8.137 28.232 -12.050 1072 H SER 40 H SER 40 -8.135 22.327 -12.619 1073 HA SER 40 HA SER 40 -9.113 23.457 -15.151 1074 HB2 SER 40 2HB SER 40 -6.437 23.125 -15.720 1075 HB3 SER 40 1HB SER 40 -7.157 24.678 -15.174 1076 HG SER 40 1HG SER 40 -5.247 23.415 -14.037 1077 H TYR 41 H TYR 41 -9.388 22.043 -16.741 1078 HA TYR 41 HA TYR 41 -9.492 19.351 -16.320 1079 HB2 TYR 41 2HB TYR 41 -9.992 21.214 -18.522 1080 HB3 TYR 41 1HB TYR 41 -9.045 19.854 -19.195 1081 HD1 TYR 41 2HD TYR 41 -10.023 17.487 -17.668 1082 HD2 TYR 41 1HD TYR 41 -12.120 20.876 -19.325 1083 HE1 TYR 41 2HE TYR 41 -12.000 16.085 -18.036 1084 HE2 TYR 41 1HE TYR 41 -14.087 19.462 -19.719 1085 HH TYR 41 HH TYR 41 -14.615 17.151 -20.077 1086 HA PRO 42 HA PRO 42 -5.510 18.458 -18.521 1087 HB2 PRO 42 2HB PRO 42 -3.440 20.377 -18.763 1088 HB3 PRO 42 1HB PRO 42 -4.724 20.119 -20.005 1089 HG2 PRO 42 2HG PRO 42 -4.711 22.196 -17.747 1090 HG3 PRO 42 1HG PRO 42 -5.030 22.465 -19.513 1091 HD2 PRO 42 2HD PRO 42 -7.103 22.165 -17.773 1092 HD3 PRO 42 1HD PRO 42 -7.167 21.303 -19.377 1093 H ASP 43 H ASP 43 -5.617 20.446 -15.652 1094 HA ASP 43 HA ASP 43 -3.201 19.307 -14.511 1095 HB2 ASP 43 2HB ASP 43 -5.468 21.014 -13.269 1096 HB3 ASP 43 1HB ASP 43 -4.072 20.368 -12.345 1097 H ALA 44 H ALA 44 -6.771 19.070 -14.360 1098 HA ALA 44 HA ALA 44 -6.966 17.546 -12.092 1099 HB1 ALA 44 1HB ALA 44 -8.887 17.582 -14.509 1100 HB2 ALA 44 2HB ALA 44 -8.934 18.703 -13.095 1101 HB3 ALA 44 3HB ALA 44 -9.289 16.961 -12.861 1102 H ILE 45 H ILE 45 -6.552 16.502 -15.458 1103 HA ILE 45 HA ILE 45 -7.021 13.779 -14.949 1104 HB ILE 45 HB ILE 45 -7.189 14.583 -17.164 1105 HG12 ILE 45 2HG1 ILE 45 -4.756 12.693 -17.010 1106 HG13 ILE 45 1HG1 ILE 45 -6.466 12.210 -16.768 1107 HG21 ILE 45 1HG2 ILE 45 -4.183 15.318 -17.038 1108 HG22 ILE 45 2HG2 ILE 45 -5.564 16.470 -17.060 1109 HG23 ILE 45 3HG2 ILE 45 -5.248 15.435 -18.479 1110 HD11 ILE 45 3HD ILE 45 -5.293 13.414 -19.371 1111 HD12 ILE 45 1HD ILE 45 -5.750 11.698 -19.083 1112 HD13 ILE 45 2HD ILE 45 -7.022 12.963 -19.102 1113 H TRP 46 H TRP 46 -4.103 15.784 -14.539 1114 HA TRP 46 HA TRP 46 -2.390 13.523 -14.175 1115 HB2 TRP 46 2HB TRP 46 -2.120 16.495 -14.156 1116 HB3 TRP 46 1HB TRP 46 -1.140 15.722 -12.893 1117 HD1 TRP 46 HD TRP 46 1.118 16.345 -13.892 1118 HE1 TRP 46 1HE TRP 46 2.402 15.840 -16.053 1119 HE3 TRP 46 3HE TRP 46 -2.534 13.792 -16.421 1120 HZ2 TRP 46 2HZ TRP 46 2.053 14.192 -18.362 1121 HZ3 TRP 46 3HZ TRP 46 -1.995 12.768 -18.584 1122 HH2 TRP 46 HH TRP 46 0.273 12.963 -19.555 1123 H TRP 47 H TRP 47 -4.251 15.669 -12.023 1124 HA TRP 47 HA TRP 47 -3.217 14.667 -9.606 1125 HB2 TRP 47 2HB TRP 47 -4.542 16.752 -9.668 1126 HB3 TRP 47 1HB TRP 47 -5.971 15.863 -10.299 1127 HD1 TRP 47 HD TRP 47 -3.859 16.003 -6.941 1128 HE1 TRP 47 1HE TRP 47 -5.324 15.142 -5.082 1129 HE3 TRP 47 3HE TRP 47 -7.922 14.728 -9.755 1130 HZ2 TRP 47 2HZ TRP 47 -8.000 14.074 -4.797 1131 HZ3 TRP 47 3HZ TRP 47 -9.881 13.720 -8.649 1132 HH2 TRP 47 HH TRP 47 -9.932 13.406 -6.200 1133 H SER 48 H SER 48 -6.032 13.602 -11.640 1134 HA SER 48 HA SER 48 -6.854 11.644 -9.875 1135 HB2 SER 48 2HB SER 48 -7.076 11.614 -12.938 1136 HB3 SER 48 1HB SER 48 -8.006 10.586 -11.776 1137 HG SER 48 1HG SER 48 -9.239 12.251 -12.300 1138 H VAL 49 H VAL 49 -4.158 11.527 -12.225 1139 HA VAL 49 HA VAL 49 -3.909 8.742 -12.356 1140 HB VAL 49 HB VAL 49 -1.775 10.909 -12.634 1141 HG11 VAL 49 1HG1 VAL 49 -0.606 8.792 -12.027 1142 HG12 VAL 49 2HG1 VAL 49 -0.403 9.094 -13.780 1143 HG13 VAL 49 3HG1 VAL 49 -1.590 7.867 -13.215 1144 HG21 VAL 49 3HG2 VAL 49 -3.241 9.163 -14.735 1145 HG22 VAL 49 1HG2 VAL 49 -2.053 10.478 -15.065 1146 HG23 VAL 49 2HG2 VAL 49 -3.660 10.868 -14.367 1147 H GLU 50 H GLU 50 -2.294 11.121 -10.085 1148 HA GLU 50 HA GLU 50 -0.944 8.937 -8.867 1149 HB2 GLU 50 2HB GLU 50 -0.065 10.484 -7.227 1150 HB3 GLU 50 1HB GLU 50 0.087 11.166 -8.876 1151 HG2 GLU 50 2HG GLU 50 -1.961 12.607 -8.449 1152 HG3 GLU 50 1HG GLU 50 -2.060 11.932 -6.778 1153 H THR 51 H THR 51 -4.076 10.300 -8.449 1154 HA THR 51 HA THR 51 -4.489 9.550 -5.749 1155 HB THR 51 HB THR 51 -6.565 9.886 -7.991 1156 HG1 THR 51 1HG THR 51 -5.391 11.799 -7.755 1157 HG21 THR 51 3HG2 THR 51 -8.094 10.460 -6.056 1158 HG22 THR 51 1HG2 THR 51 -6.771 10.062 -4.895 1159 HG23 THR 51 2HG2 THR 51 -7.490 8.772 -5.922 1160 H ALA 52 H ALA 52 -4.769 7.888 -8.881 1161 HA ALA 52 HA ALA 52 -6.252 5.659 -7.963 1162 HB1 ALA 52 1HB ALA 52 -6.117 6.269 -10.392 1163 HB2 ALA 52 2HB ALA 52 -5.454 4.614 -10.133 1164 HB3 ALA 52 3HB ALA 52 -4.336 5.995 -10.365 1165 H THR 53 H THR 53 -2.743 6.432 -8.058 1166 HA THR 53 HA THR 53 -2.049 3.726 -7.428 1167 HB THR 53 HB THR 53 0.275 4.903 -7.124 1168 HG1 THR 53 1HG THR 53 -0.624 7.028 -7.007 1169 HG21 THR 53 3HG2 THR 53 0.518 4.935 -9.621 1170 HG22 THR 53 1HG2 THR 53 -1.272 4.952 -9.819 1171 HG23 THR 53 2HG2 THR 53 -0.455 3.514 -9.099 1172 H THR 54 H THR 54 -3.619 5.911 -5.571 1173 HA THR 54 HA THR 54 -3.859 6.319 -3.461 1174 HB THR 54 HB THR 54 -3.623 4.349 -1.854 1175 HG1 THR 54 1HG THR 54 -2.003 3.398 -3.389 1176 HG21 THR 54 3HG2 THR 54 -5.179 3.979 -4.517 1177 HG22 THR 54 1HG2 THR 54 -5.709 4.984 -3.114 1178 HG23 THR 54 2HG2 THR 54 -5.553 3.201 -2.936 1179 H VAL 55 H VAL 55 -1.784 7.775 -4.034 1180 HA VAL 55 HA VAL 55 -0.046 7.417 -1.690 1181 HB VAL 55 HB VAL 55 0.854 8.065 -4.553 1182 HG11 VAL 55 1HG1 VAL 55 1.960 9.692 -2.992 1183 HG12 VAL 55 2HG1 VAL 55 3.126 8.422 -3.494 1184 HG13 VAL 55 3HG1 VAL 55 2.352 8.341 -1.863 1185 HG21 VAL 55 3HG2 VAL 55 1.517 5.883 -2.449 1186 HG22 VAL 55 1HG2 VAL 55 2.463 6.127 -3.954 1187 HG23 VAL 55 2HG2 VAL 55 0.735 5.636 -4.047 1188 H GLY 56 H GLY 56 -0.603 9.826 -4.393 1189 HA2 GLY 56 2HA GLY 56 -1.307 11.929 -4.250 1190 HA3 GLY 56 1HA GLY 56 -1.948 11.580 -2.595 1191 H TYR 57 H TYR 57 0.934 12.506 -4.498 1192 HA TYR 57 HA TYR 57 2.761 12.645 -2.298 1193 HB2 TYR 57 2HB TYR 57 2.644 14.006 -5.088 1194 HB3 TYR 57 1HB TYR 57 3.939 14.425 -3.915 1195 HD1 TYR 57 2HD TYR 57 2.585 11.661 -6.035 1196 HD2 TYR 57 1HD TYR 57 5.818 13.055 -3.566 1197 HE1 TYR 57 2HE TYR 57 4.062 9.944 -6.995 1198 HE2 TYR 57 1HE TYR 57 7.303 11.351 -4.526 1199 HH TYR 57 HH TYR 57 7.459 9.488 -5.957 1200 H GLY 58 H GLY 58 0.560 14.926 -3.968 1201 HA2 GLY 58 2HA GLY 58 -0.250 16.442 -2.018 1202 HA3 GLY 58 1HA GLY 58 1.399 17.154 -2.369 1203 H ASP 59 H ASP 59 1.325 18.686 -3.858 1204 HA ASP 59 HA ASP 59 0.902 19.906 -5.461 1205 HB2 ASP 59 2HB ASP 59 0.789 17.372 -6.829 1206 HB3 ASP 59 1HB ASP 59 -0.409 18.451 -7.606 1207 H ARG 60 H ARG 60 -2.156 17.937 -5.279 1208 HA ARG 60 HA ARG 60 -3.490 20.512 -4.890 1209 HB2 ARG 60 2HB ARG 60 -4.719 18.304 -6.656 1210 HB3 ARG 60 1HB ARG 60 -5.456 19.886 -6.269 1211 HG2 ARG 60 2HG ARG 60 -2.926 19.436 -7.976 1212 HG3 ARG 60 1HG ARG 60 -4.590 19.576 -8.624 1213 HD2 ARG 60 2HD ARG 60 -4.790 21.925 -7.864 1214 HD3 ARG 60 1HD ARG 60 -3.188 21.860 -7.049 1215 HE ARG 60 HE ARG 60 -3.714 22.014 -9.987 1216 HH11 ARG 60 1HH2 ARG 60 -1.279 21.400 -7.393 1217 HH12 ARG 60 2HH2 ARG 60 0.015 21.132 -8.428 1218 HH21 ARG 60 1HH1 ARG 60 -1.850 21.967 -11.487 1219 HH22 ARG 60 2HH1 ARG 60 -0.296 21.620 -10.831 1220 H TYR 61 H TYR 61 -5.767 19.949 -3.764 1221 HA TYR 61 HA TYR 61 -6.063 17.268 -3.196 1222 HB2 TYR 61 2HB TYR 61 -6.215 17.563 -0.599 1223 HB3 TYR 61 1HB TYR 61 -4.649 17.231 -1.414 1224 HD1 TYR 61 2HD TYR 61 -2.873 18.762 -1.515 1225 HD2 TYR 61 1HD TYR 61 -6.521 19.792 0.517 1226 HE1 TYR 61 2HE TYR 61 -1.682 20.513 -0.294 1227 HE2 TYR 61 1HE TYR 61 -5.325 21.528 1.783 1228 HH TYR 61 HH TYR 61 -1.771 22.068 1.286 1229 HA PRO 62 HA PRO 62 -9.958 19.341 -3.245 1230 HB2 PRO 62 2HB PRO 62 -11.696 17.167 -2.872 1231 HB3 PRO 62 1HB PRO 62 -10.710 17.404 -4.370 1232 HG2 PRO 62 2HG PRO 62 -10.038 15.662 -1.921 1233 HG3 PRO 62 1HG PRO 62 -10.028 15.179 -3.677 1234 HD2 PRO 62 2HD PRO 62 -7.725 15.994 -2.372 1235 HD3 PRO 62 1HD PRO 62 -8.046 16.488 -4.101 1236 H VAL 63 H VAL 63 -11.638 20.200 -1.810 1237 HA VAL 63 HA VAL 63 -11.064 19.723 0.980 1238 HB VAL 63 HB VAL 63 -12.876 21.875 -0.163 1239 HG11 VAL 63 1HG1 VAL 63 -12.140 23.038 1.956 1240 HG12 VAL 63 2HG1 VAL 63 -11.166 21.599 2.426 1241 HG13 VAL 63 3HG1 VAL 63 -12.965 21.499 2.361 1242 HG21 VAL 63 3HG2 VAL 63 -9.806 21.844 0.152 1243 HG22 VAL 63 1HG2 VAL 63 -10.816 23.326 -0.084 1244 HG23 VAL 63 2HG2 VAL 63 -10.754 22.085 -1.364 1245 H THR 64 H THR 64 -14.273 20.800 0.512 1246 HA THR 64 HA THR 64 -15.204 18.202 1.554 1247 HB THR 64 HB THR 64 -16.974 19.626 2.755 1248 HG1 THR 64 1HG THR 64 -16.383 21.526 1.430 1249 HG21 THR 64 3HG2 THR 64 -15.047 18.590 3.941 1250 HG22 THR 64 1HG2 THR 64 -15.376 20.228 4.605 1251 HG23 THR 64 2HG2 THR 64 -13.983 19.969 3.495 1252 H GLU 65 H GLU 65 -15.936 20.835 -0.727 1253 HA GLU 65 HA GLU 65 -18.766 20.128 -0.744 1254 HB2 GLU 65 2HB GLU 65 -18.207 22.520 -0.429 1255 HB3 GLU 65 1HB GLU 65 -17.256 22.527 -1.955 1256 HG2 GLU 65 2HG GLU 65 -19.218 22.240 -3.312 1257 HG3 GLU 65 1HG GLU 65 -20.218 21.706 -1.910 1258 H GLU 66 H GLU 66 -15.761 19.988 -2.491 1259 HA GLU 66 HA GLU 66 -16.717 19.145 -4.960 1260 HB2 GLU 66 2HB GLU 66 -14.278 18.105 -4.982 1261 HB3 GLU 66 1HB GLU 66 -14.514 19.873 -5.004 1262 HG2 GLU 66 2HG GLU 66 -14.018 18.415 -2.333 1263 HG3 GLU 66 1HG GLU 66 -12.733 18.897 -3.492 1264 H GLY 67 H GLY 67 -16.808 17.625 -1.908 1265 HA2 GLY 67 2HA GLY 67 -17.752 15.676 -1.322 1266 HA3 GLY 67 1HA GLY 67 -17.962 15.266 -3.086 1267 H ARG 68 H ARG 68 -15.623 15.283 -0.326 1268 HA ARG 68 HA ARG 68 -13.382 14.616 -1.772 1269 HB2 ARG 68 2HB ARG 68 -13.350 15.253 0.608 1270 HB3 ARG 68 1HB ARG 68 -14.175 13.736 1.073 1271 HG2 ARG 68 2HG ARG 68 -12.283 12.342 0.483 1272 HG3 ARG 68 1HG ARG 68 -11.470 13.673 -0.402 1273 HD2 ARG 68 2HD ARG 68 -11.983 13.575 2.642 1274 HD3 ARG 68 1HD ARG 68 -10.378 13.275 1.825 1275 HE ARG 68 HE ARG 68 -11.364 15.745 0.814 1276 HH11 ARG 68 1HH2 ARG 68 -10.597 14.498 4.063 1277 HH12 ARG 68 2HH2 ARG 68 -9.225 15.271 4.029 1278 HH21 ARG 68 1HH1 ARG 68 -10.290 17.675 1.472 1279 HH22 ARG 68 2HH1 ARG 68 -9.942 17.917 3.147 1280 H LYS 69 H LYS 69 -16.141 12.669 -1.020 1281 HA LYS 69 HA LYS 69 -15.118 10.123 -1.341 1282 HB2 LYS 69 2HB LYS 69 -17.870 11.199 -2.149 1283 HB3 LYS 69 1HB LYS 69 -17.384 9.467 -2.132 1284 HG2 LYS 69 2HG LYS 69 -16.682 9.747 0.289 1285 HG3 LYS 69 1HG LYS 69 -17.533 11.321 0.329 1286 HD2 LYS 69 2HD LYS 69 -19.667 10.313 0.032 1287 HD3 LYS 69 1HD LYS 69 -19.002 8.840 -0.733 1288 HE2 LYS 69 2HE LYS 69 -18.564 9.541 2.248 1289 HE3 LYS 69 1HE LYS 69 -19.903 8.503 1.621 1290 HZ1 LYS 69 3HZ LYS 69 -16.986 7.844 1.187 1291 HZ2 LYS 69 1HZ LYS 69 -18.356 6.885 0.897 1292 HZ3 LYS 69 2HZ LYS 69 -17.988 7.329 2.480 1293 H VAL 70 H VAL 70 -15.301 12.671 -3.779 1294 HA VAL 70 HA VAL 70 -15.382 10.967 -6.015 1295 HB VAL 70 HB VAL 70 -14.201 13.758 -5.634 1296 HG11 VAL 70 1HG1 VAL 70 -13.033 12.696 -7.575 1297 HG12 VAL 70 2HG1 VAL 70 -14.239 13.886 -8.161 1298 HG13 VAL 70 3HG1 VAL 70 -14.611 12.125 -8.242 1299 HG21 VAL 70 3HG2 VAL 70 -16.816 12.729 -6.956 1300 HG22 VAL 70 1HG2 VAL 70 -16.284 14.448 -6.825 1301 HG23 VAL 70 2HG2 VAL 70 -16.713 13.534 -5.349 1302 H ALA 71 H ALA 71 -12.735 12.105 -3.878 1303 HA ALA 71 HA ALA 71 -10.673 10.932 -5.477 1304 HB1 ALA 71 1HB ALA 71 -10.603 11.777 -2.506 1305 HB2 ALA 71 2HB ALA 71 -10.212 12.856 -3.895 1306 HB3 ALA 71 3HB ALA 71 -9.180 11.426 -3.558 1307 H GLU 72 H GLU 72 -12.489 10.067 -2.539 1308 HA GLU 72 HA GLU 72 -11.227 7.758 -1.773 1309 HB2 GLU 72 2HB GLU 72 -13.207 9.032 -0.618 1310 HB3 GLU 72 1HB GLU 72 -14.281 8.174 -1.767 1311 HG2 GLU 72 2HG GLU 72 -13.037 5.992 -0.668 1312 HG3 GLU 72 1HG GLU 72 -12.759 7.149 0.671 1313 H GLN 73 H GLN 73 -13.785 8.220 -4.204 1314 HA GLN 73 HA GLN 73 -14.298 5.541 -4.774 1315 HB2 GLN 73 2HB GLN 73 -15.866 7.250 -5.307 1316 HB3 GLN 73 1HB GLN 73 -14.712 8.181 -6.273 1317 HG2 GLN 73 2HG GLN 73 -15.637 5.336 -7.094 1318 HG3 GLN 73 1HG GLN 73 -16.663 6.775 -7.408 1319 HE21 GLN 73 1HE2 GLN 73 -14.127 8.515 -7.922 1320 HE22 GLN 73 2HE2 GLN 73 -13.711 8.084 -9.548 1321 H VAL 74 H VAL 74 -11.844 7.814 -6.110 1322 HA VAL 74 HA VAL 74 -11.093 6.059 -8.229 1323 HB VAL 74 HB VAL 74 -9.509 8.350 -6.932 1324 HG11 VAL 74 1HG1 VAL 74 -8.016 6.853 -8.261 1325 HG12 VAL 74 2HG1 VAL 74 -8.281 8.380 -9.156 1326 HG13 VAL 74 3HG1 VAL 74 -9.161 6.882 -9.649 1327 HG21 VAL 74 3HG2 VAL 74 -10.353 9.692 -8.868 1328 HG22 VAL 74 1HG2 VAL 74 -11.713 9.113 -7.858 1329 HG23 VAL 74 2HG2 VAL 74 -11.346 8.283 -9.414 1330 H MET 75 H MET 75 -9.906 6.768 -4.931 1331 HA MET 75 HA MET 75 -7.599 5.243 -4.982 1332 HB2 MET 75 2HB MET 75 -9.546 5.806 -2.661 1333 HB3 MET 75 1HB MET 75 -7.915 5.088 -2.442 1334 HG2 MET 75 2HG MET 75 -6.796 7.074 -3.220 1335 HG3 MET 75 1HG MET 75 -8.306 7.797 -3.829 1336 HE1 MET 75 3HE MET 75 -6.269 9.315 -2.234 1337 HE2 MET 75 1HE MET 75 -7.237 10.230 -1.028 1338 HE3 MET 75 2HE MET 75 -7.830 10.047 -2.718 1339 H LYS 76 H LYS 76 -10.932 4.255 -3.958 1340 HA LYS 76 HA LYS 76 -10.143 1.627 -3.332 1341 HB2 LYS 76 2HB LYS 76 -12.237 2.579 -2.437 1342 HB3 LYS 76 1HB LYS 76 -12.935 2.674 -4.085 1343 HG2 LYS 76 2HG LYS 76 -13.073 0.254 -4.269 1344 HG3 LYS 76 1HG LYS 76 -12.042 0.008 -2.818 1345 HD2 LYS 76 2HD LYS 76 -13.804 0.811 -1.323 1346 HD3 LYS 76 1HD LYS 76 -14.772 1.432 -2.696 1347 HE2 LYS 76 2HE LYS 76 -15.726 -0.681 -1.693 1348 HE3 LYS 76 1HE LYS 76 -15.364 -0.819 -3.455 1349 HZ1 LYS 76 3HZ LYS 76 -13.962 -2.422 -3.116 1350 HZ2 LYS 76 1HZ LYS 76 -14.618 -2.565 -1.518 1351 HZ3 LYS 76 2HZ LYS 76 -13.190 -1.696 -1.777 1352 H ALA 77 H ALA 77 -11.270 3.104 -6.392 1353 HA ALA 77 HA ALA 77 -11.660 0.687 -7.760 1354 HB1 ALA 77 1HB ALA 77 -10.807 3.427 -8.897 1355 HB2 ALA 77 2HB ALA 77 -12.507 2.893 -8.624 1356 HB3 ALA 77 3HB ALA 77 -11.485 2.051 -9.850 1357 H GLY 78 H GLY 78 -8.788 2.737 -7.252 1358 HA2 GLY 78 2HA GLY 78 -7.035 1.425 -8.996 1359 HA3 GLY 78 1HA GLY 78 -6.629 2.407 -7.538 1360 H ILE 79 H ILE 79 -7.769 0.894 -5.526 1361 HA ILE 79 HA ILE 79 -5.851 -1.100 -5.157 1362 HB ILE 79 HB ILE 79 -8.514 -0.628 -3.739 1363 HG12 ILE 79 2HG1 ILE 79 -5.609 0.097 -2.961 1364 HG13 ILE 79 1HG1 ILE 79 -6.767 1.249 -3.677 1365 HG21 ILE 79 1HG2 ILE 79 -7.539 -2.032 -1.868 1366 HG22 ILE 79 2HG2 ILE 79 -6.116 -2.403 -2.900 1367 HG23 ILE 79 3HG2 ILE 79 -7.750 -3.004 -3.353 1368 HD11 ILE 79 3HD ILE 79 -7.050 -0.140 -0.931 1369 HD12 ILE 79 1HD ILE 79 -6.688 1.586 -1.253 1370 HD13 ILE 79 2HD ILE 79 -8.308 0.917 -1.681 1371 H GLU 80 H GLU 80 -9.271 -1.288 -6.278 1372 HA GLU 80 HA GLU 80 -9.264 -4.097 -6.149 1373 HB2 GLU 80 2HB GLU 80 -11.148 -2.205 -7.613 1374 HB3 GLU 80 1HB GLU 80 -11.375 -3.998 -7.515 1375 HG2 GLU 80 2HG GLU 80 -11.339 -3.860 -5.000 1376 HG3 GLU 80 1HG GLU 80 -11.249 -2.067 -5.103 1377 H VAL 81 H VAL 81 -8.212 -1.957 -8.835 1378 HA VAL 81 HA VAL 81 -8.232 -4.174 -10.659 1379 HB VAL 81 HB VAL 81 -6.884 -2.705 -12.161 1380 HG11 VAL 81 1HG1 VAL 81 -9.508 -1.525 -10.999 1381 HG12 VAL 81 2HG1 VAL 81 -9.404 -2.870 -12.203 1382 HG13 VAL 81 3HG1 VAL 81 -8.824 -1.222 -12.639 1383 HG21 VAL 81 3HG2 VAL 81 -6.679 -0.314 -11.559 1384 HG22 VAL 81 1HG2 VAL 81 -5.746 -1.289 -10.395 1385 HG23 VAL 81 2HG2 VAL 81 -7.352 -0.608 -9.935 1386 H PHE 82 H PHE 82 -5.733 -2.631 -8.551 1387 HA PHE 82 HA PHE 82 -3.662 -4.285 -9.568 1388 HB2 PHE 82 2HB PHE 82 -3.874 -2.735 -6.904 1389 HB3 PHE 82 1HB PHE 82 -2.393 -3.612 -7.444 1390 HD1 PHE 82 2HD PHE 82 -1.929 -3.031 -10.190 1391 HD2 PHE 82 1HD PHE 82 -3.565 -0.431 -7.168 1392 HE1 PHE 82 2HE PHE 82 -1.165 -1.074 -11.460 1393 HE2 PHE 82 1HE PHE 82 -2.793 1.530 -8.444 1394 HZ PHE 82 HZ PHE 82 -1.584 1.221 -10.597 1395 H ALA 83 H ALA 83 -5.933 -4.553 -6.798 1396 HA ALA 83 HA ALA 83 -4.817 -6.915 -5.788 1397 HB1 ALA 83 1HB ALA 83 -6.432 -5.522 -4.480 1398 HB2 ALA 83 2HB ALA 83 -7.003 -7.223 -4.607 1399 HB3 ALA 83 3HB ALA 83 -7.739 -5.942 -5.648 1400 H LEU 84 H LEU 84 -7.110 -6.327 -8.458 1401 HA LEU 84 HA LEU 84 -8.087 -8.955 -8.615 1402 HB2 LEU 84 2HB LEU 84 -9.148 -6.893 -9.692 1403 HB3 LEU 84 1HB LEU 84 -7.881 -6.974 -10.948 1404 HG LEU 84 HG LEU 84 -9.076 -9.613 -10.764 1405 HD11 LEU 84 1HD1 LEU 84 -11.235 -7.416 -10.786 1406 HD12 LEU 84 2HD1 LEU 84 -10.957 -8.632 -9.492 1407 HD13 LEU 84 3HD1 LEU 84 -11.496 -9.179 -11.120 1408 HD21 LEU 84 3HD2 LEU 84 -9.501 -7.399 -12.873 1409 HD22 LEU 84 1HD2 LEU 84 -9.839 -9.162 -13.085 1410 HD23 LEU 84 2HD2 LEU 84 -8.154 -8.594 -12.823 1411 H VAL 85 H VAL 85 -5.000 -7.630 -9.481 1412 HA VAL 85 HA VAL 85 -4.310 -9.413 -11.544 1413 HB VAL 85 HB VAL 85 -2.540 -7.936 -9.535 1414 HG11 VAL 85 1HG1 VAL 85 -1.148 -9.661 -10.573 1415 HG12 VAL 85 2HG1 VAL 85 -0.788 -8.104 -11.381 1416 HG13 VAL 85 3HG1 VAL 85 -1.830 -9.322 -12.208 1417 HG21 VAL 85 3HG2 VAL 85 -3.997 -6.386 -10.817 1418 HG22 VAL 85 1HG2 VAL 85 -3.576 -7.196 -12.367 1419 HG23 VAL 85 2HG2 VAL 85 -2.330 -6.279 -11.446 1420 H THR 86 H THR 86 -5.080 -10.059 -8.295 1421 HA THR 86 HA THR 86 -3.533 -12.130 -7.520 1422 HB THR 86 HB THR 86 -5.406 -11.167 -6.238 1423 HG1 THR 86 1HG THR 86 -5.467 -13.962 -6.664 1424 HG21 THR 86 3HG2 THR 86 -7.053 -11.049 -8.188 1425 HG22 THR 86 1HG2 THR 86 -7.756 -11.773 -6.731 1426 HG23 THR 86 2HG2 THR 86 -7.273 -12.832 -8.082 1427 H ALA 87 H ALA 87 -5.726 -12.075 -10.261 1428 HA ALA 87 HA ALA 87 -6.151 -14.784 -10.691 1429 HB1 ALA 87 1HB ALA 87 -6.472 -14.143 -13.107 1430 HB2 ALA 87 2HB ALA 87 -5.666 -12.557 -12.794 1431 HB3 ALA 87 3HB ALA 87 -7.252 -12.927 -12.042 1432 H ALA 88 H ALA 88 -3.350 -12.707 -11.331 1433 HA ALA 88 HA ALA 88 -1.949 -14.744 -12.830 1434 HB1 ALA 88 1HB ALA 88 -0.056 -13.111 -12.854 1435 HB2 ALA 88 2HB ALA 88 -0.967 -12.028 -11.738 1436 HB3 ALA 88 3HB ALA 88 -1.567 -12.316 -13.411 1437 H LEU 89 H LEU 89 -1.960 -13.245 -9.571 1438 HA LEU 89 HA LEU 89 0.406 -14.409 -8.738 1439 HB2 LEU 89 2HB LEU 89 -1.950 -13.686 -6.910 1440 HB3 LEU 89 1HB LEU 89 -0.230 -13.860 -6.434 1441 HG LEU 89 HG LEU 89 -1.395 -11.716 -8.322 1442 HD11 LEU 89 1HD1 LEU 89 -1.991 -11.397 -5.899 1443 HD12 LEU 89 2HD1 LEU 89 -0.907 -10.111 -6.533 1444 HD13 LEU 89 3HD1 LEU 89 -0.242 -11.406 -5.481 1445 HD21 LEU 89 3HD2 LEU 89 0.881 -10.645 -8.188 1446 HD22 LEU 89 1HD2 LEU 89 0.901 -12.204 -9.076 1447 HD23 LEU 89 2HD2 LEU 89 1.511 -12.124 -7.380 1448 H ALA 90 H ALA 90 -2.928 -15.663 -8.386 1449 HA ALA 90 HA ALA 90 -2.090 -17.888 -6.814 1450 HB1 ALA 90 1HB ALA 90 -4.385 -18.742 -7.157 1451 HB2 ALA 90 2HB ALA 90 -4.673 -17.505 -8.451 1452 HB3 ALA 90 3HB ALA 90 -4.428 -16.996 -6.742 1453 H THR 91 H THR 91 -1.445 -17.264 -10.065 1454 HA THR 91 HA THR 91 -1.539 -20.084 -10.809 1455 HB THR 91 HB THR 91 -0.670 -19.574 -12.950 1456 HG1 THR 91 1HG THR 91 -0.415 -16.899 -12.016 1457 HG21 THR 91 3HG2 THR 91 -3.078 -19.450 -12.719 1458 HG22 THR 91 1HG2 THR 91 -2.599 -18.098 -13.767 1459 HG23 THR 91 2HG2 THR 91 -3.029 -17.781 -12.055 1460 H ASP 92 H ASP 92 0.759 -17.460 -9.813 1461 HA ASP 92 HA ASP 92 2.867 -19.193 -10.537 1462 HB2 ASP 92 2HB ASP 92 2.869 -16.537 -10.513 1463 HB3 ASP 92 1HB ASP 92 3.502 -16.768 -8.851 1464 H PHE 93 H PHE 93 1.148 -18.580 -7.626 1465 HA PHE 93 HA PHE 93 2.486 -20.011 -5.693 1466 HB2 PHE 93 2HB PHE 93 0.402 -18.884 -5.176 1467 HB3 PHE 93 1HB PHE 93 -0.408 -19.615 -6.602 1468 HD1 PHE 93 1HD PHE 93 1.352 -21.445 -3.795 1469 HD2 PHE 93 2HD PHE 93 -2.349 -20.444 -5.723 1470 HE1 PHE 93 1HE PHE 93 0.165 -23.118 -2.395 1471 HE2 PHE 93 2HE PHE 93 -3.528 -22.112 -4.334 1472 HZ PHE 93 HZ PHE 93 -2.273 -23.464 -2.687 1473 H VAL 94 H VAL 94 0.494 -21.301 -8.401 1474 HA VAL 94 HA VAL 94 0.797 -24.005 -7.449 1475 HB VAL 94 HB VAL 94 -0.673 -22.889 -9.889 1476 HG11 VAL 94 1HG1 VAL 94 -1.910 -25.105 -9.790 1477 HG12 VAL 94 2HG1 VAL 94 -0.783 -25.660 -8.499 1478 HG13 VAL 94 3HG1 VAL 94 -0.169 -25.328 -10.156 1479 HG21 VAL 94 3HG2 VAL 94 -2.715 -23.224 -8.378 1480 HG22 VAL 94 1HG2 VAL 94 -1.595 -21.965 -7.742 1481 HG23 VAL 94 2HG2 VAL 94 -1.607 -23.607 -7.018 1482 H ARG 95 H ARG 95 2.122 -21.861 -9.986 1483 HA ARG 95 HA ARG 95 3.218 -23.782 -11.658 1484 HB2 ARG 95 2HB ARG 95 4.360 -21.006 -10.936 1485 HB3 ARG 95 1HB ARG 95 5.088 -22.095 -12.155 1486 HG2 ARG 95 2HG ARG 95 2.765 -22.083 -13.343 1487 HG3 ARG 95 1HG ARG 95 2.506 -20.552 -12.420 1488 HD2 ARG 95 2HD ARG 95 4.836 -19.771 -13.326 1489 HD3 ARG 95 1HD ARG 95 4.877 -21.277 -14.294 1490 HE ARG 95 HE ARG 95 3.445 -20.406 -15.800 1491 HH11 ARG 95 1HH2 ARG 95 3.736 -18.074 -13.000 1492 HH12 ARG 95 2HH2 ARG 95 3.093 -16.790 -13.899 1493 HH21 ARG 95 1HH1 ARG 95 2.651 -18.496 -16.971 1494 HH22 ARG 95 2HH1 ARG 95 2.601 -16.986 -16.138 1495 H ARG 96 H ARG 96 4.087 -23.196 -8.397 1496 HA ARG 96 HA ARG 96 6.782 -23.815 -8.410 1497 HB2 ARG 96 2HB ARG 96 6.571 -24.492 -6.102 1498 HB3 ARG 96 1HB ARG 96 5.422 -23.129 -6.350 1499 HG2 ARG 96 2HG ARG 96 3.531 -24.833 -6.548 1500 HG3 ARG 96 1HG ARG 96 4.748 -26.130 -6.294 1501 HD2 ARG 96 2HD ARG 96 5.255 -24.878 -4.005 1502 HD3 ARG 96 1HD ARG 96 3.579 -24.208 -4.229 1503 HE ARG 96 HE ARG 96 3.064 -26.815 -4.769 1504 HH11 ARG 96 1HH2 ARG 96 5.084 -25.698 -2.004 1505 HH12 ARG 96 2HH2 ARG 96 5.432 -27.270 -1.442 1506 HH21 ARG 96 1HH1 ARG 96 3.293 -28.800 -3.963 1507 HH22 ARG 96 2HH1 ARG 96 4.265 -29.198 -2.555 1508 H GLU 97 H GLU 97 3.968 -25.899 -9.041 1509 HA GLU 97 HA GLU 97 5.732 -28.231 -9.179 1510 HB2 GLU 97 2HB GLU 97 3.845 -29.678 -8.370 1511 HB3 GLU 97 1HB GLU 97 4.479 -28.559 -7.128 1512 HG2 GLU 97 2HG GLU 97 2.492 -26.985 -7.640 1513 HG3 GLU 97 1HG GLU 97 1.825 -28.297 -8.671 1514 H GLU 98 H GLU 98 4.229 -29.906 -10.527 1515 HA GLU 98 HA GLU 98 3.683 -30.462 -12.519 1516 HB2 GLU 98 2HB GLU 98 2.348 -27.777 -13.052 1517 HB3 GLU 98 1HB GLU 98 2.179 -29.299 -13.987 1518 HG2 GLU 98 2HG GLU 98 1.392 -30.357 -11.675 1519 HG3 GLU 98 1HG GLU 98 1.164 -28.647 -11.152 1520 H GLU 99 H GLU 99 5.102 -27.210 -12.485 1521 HA GLU 99 HA GLU 99 5.997 -27.376 -15.107 1522 HB2 GLU 99 2HB GLU 99 5.402 -25.290 -13.808 1523 HB3 GLU 99 1HB GLU 99 7.022 -25.347 -13.054 1524 HG2 GLU 99 2HG GLU 99 8.113 -25.022 -15.230 1525 HG3 GLU 99 1HG GLU 99 6.602 -25.440 -16.115 1526 H ARG 100 H ARG 100 7.960 -27.663 -12.033 1527 HA ARG 100 HA ARG 100 10.266 -27.977 -13.658 1528 HB2 ARG 100 2HB ARG 100 11.578 -28.189 -11.635 1529 HB3 ARG 100 1HB ARG 100 10.477 -26.788 -11.654 1530 HG2 ARG 100 2HG ARG 100 8.856 -28.404 -10.213 1531 HG3 ARG 100 1HG ARG 100 10.410 -29.255 -9.902 1532 HD2 ARG 100 2HD ARG 100 11.237 -26.676 -9.426 1533 HD3 ARG 100 1HD ARG 100 9.493 -26.425 -9.064 1534 HE ARG 100 HE ARG 100 11.390 -27.421 -7.312 1535 HH11 ARG 100 1HH2 ARG 100 7.942 -27.701 -7.892 1536 HH12 ARG 100 2HH2 ARG 100 7.638 -28.716 -6.565 1537 HH21 ARG 100 1HH1 ARG 100 11.046 -28.879 -5.510 1538 HH22 ARG 100 2HH1 ARG 100 9.452 -29.351 -5.122 1539 H ARG 101 H ARG 101 7.938 -30.180 -13.434 1540 HA ARG 101 HA ARG 101 9.717 -32.526 -13.535 1541 HB2 ARG 101 2HB ARG 101 6.673 -32.175 -13.959 1542 HB3 ARG 101 1HB ARG 101 7.542 -33.674 -14.419 1543 HG2 ARG 101 2HG ARG 101 8.275 -34.031 -12.089 1544 HG3 ARG 101 1HG ARG 101 7.264 -32.638 -11.551 1545 HD2 ARG 101 2HD ARG 101 5.201 -33.763 -12.384 1546 HD3 ARG 101 1HD ARG 101 6.184 -35.086 -13.144 1547 HE ARG 101 HE ARG 101 6.987 -35.342 -10.564 1548 HH11 ARG 101 1HH2 ARG 101 3.662 -35.248 -12.059 1549 HH12 ARG 101 2HH2 ARG 101 3.078 -36.485 -11.059 1550 HH21 ARG 101 1HH1 ARG 101 6.163 -36.953 -9.263 1551 HH22 ARG 101 2HH1 ARG 101 4.515 -37.474 -9.328 1552 H GLY 102 H GLY 102 8.193 -30.013 -15.524 1553 HA2 GLY 102 2HA GLY 102 8.209 -29.623 -17.670 1554 HA3 GLY 102 1HA GLY 102 9.441 -30.932 -17.856 1555 H HIS 103 H HIS 103 6.070 -31.071 -16.664 1556 HA HIS 103 HA HIS 103 5.584 -33.502 -18.031 1557 HB2 HIS 103 2HB HIS 103 4.458 -32.633 -15.850 1558 HB3 HIS 103 1HB HIS 103 3.467 -31.567 -16.882 1559 HD1 HIS 103 1HD HIS 103 4.319 -35.291 -16.532 1560 HD2 HIS 103 2HD HIS 103 0.979 -32.832 -17.314 1561 HE1 HIS 103 1HE HIS 103 2.279 -36.780 -16.576 1562 HE2 HIS 103 2HE HIS 103 0.281 -35.299 -16.988 1563 H1 SER 1 H SER 1 17.105 -21.398 -0.925 1564 HA SER 1 HA SER 1 15.594 -23.347 0.540 1565 HB2 SER 1 2HB SER 1 15.663 -20.275 0.845 1566 HB3 SER 1 1HB SER 1 15.103 -21.476 2.065 1567 HG SER 1 1HG SER 1 17.406 -20.414 1.898 1568 H ALA 2 H ALA 2 13.811 -24.000 -0.553 1569 HA ALA 2 HA ALA 2 12.021 -24.090 -1.717 1570 HB1 ALA 2 1HB ALA 2 10.244 -22.390 -1.548 1571 HB2 ALA 2 2HB ALA 2 11.446 -21.198 -0.923 1572 HB3 ALA 2 3HB ALA 2 11.037 -22.651 0.046 1573 H ASP 3 H ASP 3 11.441 -24.201 -3.817 1574 HA ASP 3 HA ASP 3 13.035 -23.020 -5.706 1575 HB2 ASP 3 2HB ASP 3 10.233 -24.122 -6.350 1576 HB3 ASP 3 1HB ASP 3 11.738 -24.234 -7.321 1577 H HIS 4 H HIS 4 9.976 -22.101 -4.314 1578 HA HIS 4 HA HIS 4 9.282 -20.228 -6.392 1579 HB2 HIS 4 2HB HIS 4 7.356 -19.571 -4.848 1580 HB3 HIS 4 1HB HIS 4 7.372 -21.225 -5.509 1581 HD1 HIS 4 1HD HIS 4 8.718 -19.696 -2.036 1582 HD2 HIS 4 2HD HIS 4 6.631 -23.053 -3.631 1583 HE1 HIS 4 1HE HIS 4 8.032 -21.034 -0.208 1584 HE2 HIS 4 2HE HIS 4 6.851 -23.058 -1.008 1585 H GLU 5 H GLU 5 11.230 -20.036 -3.473 1586 HA GLU 5 HA GLU 5 10.760 -17.251 -3.046 1587 HB2 GLU 5 2HB GLU 5 12.532 -19.373 -1.877 1588 HB3 GLU 5 1HB GLU 5 13.307 -17.773 -1.971 1589 HG2 GLU 5 2HG GLU 5 12.440 -17.863 0.196 1590 HG3 GLU 5 1HG GLU 5 11.350 -16.755 -0.708 1591 H ARG 6 H ARG 6 12.867 -19.251 -5.047 1592 HA ARG 6 HA ARG 6 14.859 -17.402 -5.625 1593 HB2 ARG 6 2HB ARG 6 14.842 -19.905 -6.189 1594 HB3 ARG 6 1HB ARG 6 13.684 -19.542 -7.506 1595 HG2 ARG 6 2HG ARG 6 15.493 -17.995 -8.520 1596 HG3 ARG 6 1HG ARG 6 16.616 -18.643 -7.266 1597 HD2 ARG 6 2HD ARG 6 16.109 -21.002 -8.150 1598 HD3 ARG 6 1HD ARG 6 15.120 -20.246 -9.475 1599 HE ARG 6 HE ARG 6 17.482 -18.913 -9.793 1600 HH11 ARG 6 1HH2 ARG 6 16.408 -22.351 -9.971 1601 HH12 ARG 6 2HH2 ARG 6 17.885 -22.932 -10.618 1602 HH21 ARG 6 1HH1 ARG 6 19.616 -19.771 -10.506 1603 HH22 ARG 6 2HH1 ARG 6 19.709 -21.326 -11.138 1604 H GLU 7 H GLU 7 11.669 -17.955 -7.135 1605 HA GLU 7 HA GLU 7 12.037 -16.227 -9.316 1606 HB2 GLU 7 2HB GLU 7 9.908 -17.921 -8.234 1607 HB3 GLU 7 1HB GLU 7 9.208 -16.314 -8.556 1608 HG2 GLU 7 2HG GLU 7 8.911 -17.698 -10.526 1609 HG3 GLU 7 1HG GLU 7 10.075 -16.387 -10.908 1610 H ALA 8 H ALA 8 11.091 -15.729 -5.964 1611 HA ALA 8 HA ALA 8 9.985 -13.156 -6.354 1612 HB1 ALA 8 1HB ALA 8 9.413 -14.548 -4.328 1613 HB2 ALA 8 2HB ALA 8 10.140 -12.977 -3.830 1614 HB3 ALA 8 3HB ALA 8 11.130 -14.467 -3.792 1615 H GLN 9 H GLN 9 13.217 -14.416 -5.633 1616 HA GLN 9 HA GLN 9 14.338 -11.938 -4.857 1617 HB2 GLN 9 2HB GLN 9 15.596 -14.513 -5.937 1618 HB3 GLN 9 1HB GLN 9 16.559 -13.142 -5.277 1619 HG2 GLN 9 2HG GLN 9 15.611 -13.386 -3.049 1620 HG3 GLN 9 1HG GLN 9 14.357 -14.545 -3.616 1621 HE21 GLN 9 1HE2 GLN 9 16.196 -15.156 -1.472 1622 HE22 GLN 9 2HE2 GLN 9 17.087 -16.545 -2.008 1623 H LYS 10 H LYS 10 13.882 -13.547 -7.926 1624 HA LYS 10 HA LYS 10 15.487 -11.959 -9.578 1625 HB2 LYS 10 2HB LYS 10 14.348 -14.242 -9.966 1626 HB3 LYS 10 1HB LYS 10 12.802 -13.359 -10.155 1627 HG2 LYS 10 2HG LYS 10 13.670 -12.278 -12.238 1628 HG3 LYS 10 1HG LYS 10 15.274 -13.042 -11.967 1629 HD2 LYS 10 2HD LYS 10 14.110 -14.387 -13.624 1630 HD3 LYS 10 1HD LYS 10 14.205 -15.323 -12.090 1631 HE2 LYS 10 2HE LYS 10 11.752 -14.544 -11.610 1632 HE3 LYS 10 1HE LYS 10 11.737 -13.883 -13.288 1633 HZ1 LYS 10 3HZ LYS 10 10.780 -15.972 -13.370 1634 HZ2 LYS 10 1HZ LYS 10 11.923 -16.728 -12.384 1635 HZ3 LYS 10 2HZ LYS 10 12.337 -16.300 -13.963 1636 H ALA 11 H ALA 11 12.221 -11.526 -8.226 1637 HA ALA 11 HA ALA 11 11.398 -9.495 -9.995 1638 HB1 ALA 11 1HB ALA 11 10.379 -10.031 -7.138 1639 HB2 ALA 11 2HB ALA 11 9.789 -10.877 -8.616 1640 HB3 ALA 11 3HB ALA 11 9.531 -9.108 -8.431 1641 H GLU 12 H GLU 12 13.158 -9.434 -6.842 1642 HA GLU 12 HA GLU 12 12.844 -6.610 -6.622 1643 HB2 GLU 12 2HB GLU 12 14.882 -8.356 -5.149 1644 HB3 GLU 12 1HB GLU 12 14.600 -6.601 -4.898 1645 HG2 GLU 12 2HG GLU 12 12.109 -7.211 -4.404 1646 HG3 GLU 12 1HG GLU 12 12.682 -8.910 -4.252 1647 H GLU 13 H GLU 13 14.922 -8.516 -8.678 1648 HA GLU 13 HA GLU 13 17.003 -6.558 -8.805 1649 HB2 GLU 13 2HB GLU 13 17.459 -8.877 -9.557 1650 HB3 GLU 13 1HB GLU 13 16.288 -8.687 -10.904 1651 HG2 GLU 13 2HG GLU 13 17.666 -6.945 -11.957 1652 HG3 GLU 13 1HG GLU 13 18.713 -6.823 -10.497 1653 H GLU 14 H GLU 14 13.972 -7.209 -10.604 1654 HA GLU 14 HA GLU 14 14.364 -5.247 -12.546 1655 HB2 GLU 14 2HB GLU 14 11.762 -6.418 -11.418 1656 HB3 GLU 14 1HB GLU 14 11.842 -5.402 -12.893 1657 HG2 GLU 14 2HG GLU 14 13.426 -8.052 -12.659 1658 HG3 GLU 14 1HG GLU 14 11.711 -7.983 -13.196 1659 H LEU 15 H LEU 15 12.969 -5.069 -9.269 1660 HA LEU 15 HA LEU 15 11.921 -2.490 -9.604 1661 HB2 LEU 15 2HB LEU 15 11.302 -4.048 -7.731 1662 HB3 LEU 15 1HB LEU 15 12.914 -3.787 -6.991 1663 HG LEU 15 HG LEU 15 12.387 -1.421 -6.563 1664 HD11 LEU 15 1HD1 LEU 15 10.040 -0.509 -7.094 1665 HD12 LEU 15 2HD1 LEU 15 9.806 -1.931 -8.169 1666 HD13 LEU 15 3HD1 LEU 15 11.103 -0.729 -8.517 1667 HD21 LEU 15 3HD2 LEU 15 10.011 -3.234 -5.765 1668 HD22 LEU 15 1HD2 LEU 15 10.483 -1.695 -4.965 1669 HD23 LEU 15 2HD2 LEU 15 11.589 -3.115 -4.905 1670 H GLN 16 H GLN 16 15.136 -3.629 -8.504 1671 HA GLN 16 HA GLN 16 16.073 -1.058 -7.782 1672 HB2 GLN 16 2HB GLN 16 17.565 -3.623 -8.551 1673 HB3 GLN 16 1HB GLN 16 18.379 -2.152 -7.911 1674 HG2 GLN 16 2HG GLN 16 17.208 -2.304 -5.769 1675 HG3 GLN 16 1HG GLN 16 16.143 -3.626 -6.355 1676 HE21 GLN 16 1HE2 GLN 16 16.963 -5.748 -6.465 1677 HE22 GLN 16 2HE2 GLN 16 18.550 -6.207 -5.912 1678 H LYS 17 H LYS 17 16.127 -2.905 -10.809 1679 HA LYS 17 HA LYS 17 17.837 -1.298 -12.311 1680 HB2 LYS 17 2HB LYS 17 16.926 -3.566 -12.982 1681 HB3 LYS 17 1HB LYS 17 15.296 -2.852 -13.130 1682 HG2 LYS 17 2HG LYS 17 16.209 -1.374 -15.048 1683 HG3 LYS 17 1HG LYS 17 17.748 -2.282 -14.886 1684 HD2 LYS 17 2HD LYS 17 16.632 -3.395 -16.646 1685 HD3 LYS 17 1HD LYS 17 16.333 -4.442 -15.210 1686 HE2 LYS 17 2HE LYS 17 14.023 -3.235 -14.983 1687 HE3 LYS 17 1HE LYS 17 14.363 -2.479 -16.590 1688 HZ1 LYS 17 3HZ LYS 17 13.976 -5.336 -15.875 1689 HZ2 LYS 17 1HZ LYS 17 14.622 -4.901 -17.379 1690 HZ3 LYS 17 2HZ LYS 17 13.071 -4.370 -16.978 1691 H VAL 18 H VAL 18 14.286 -1.130 -11.775 1692 HA VAL 18 HA VAL 18 13.843 1.029 -13.500 1693 HB VAL 18 HB VAL 18 12.225 -0.115 -11.183 1694 HG11 VAL 18 1HG1 VAL 18 10.271 1.189 -12.146 1695 HG12 VAL 18 2HG1 VAL 18 11.415 2.093 -13.205 1696 HG13 VAL 18 3HG1 VAL 18 11.508 2.259 -11.410 1697 HG21 VAL 18 3HG2 VAL 18 10.882 -1.083 -13.054 1698 HG22 VAL 18 1HG2 VAL 18 12.600 -1.551 -13.271 1699 HG23 VAL 18 2HG2 VAL 18 11.901 -0.233 -14.269 1700 H LEU 19 H LEU 19 14.639 0.911 -9.991 1701 HA LEU 19 HA LEU 19 14.267 3.602 -9.430 1702 HB2 LEU 19 2HB LEU 19 16.484 1.719 -8.403 1703 HB3 LEU 19 1HB LEU 19 16.180 3.346 -7.723 1704 HG LEU 19 HG LEU 19 14.127 1.059 -7.691 1705 HD11 LEU 19 1HD1 LEU 19 15.956 2.103 -5.428 1706 HD12 LEU 19 2HD1 LEU 19 16.156 0.538 -6.296 1707 HD13 LEU 19 3HD1 LEU 19 14.691 0.826 -5.288 1708 HD21 LEU 19 3HD2 LEU 19 13.032 2.538 -5.932 1709 HD22 LEU 19 1HD2 LEU 19 13.004 3.260 -7.579 1710 HD23 LEU 19 2HD2 LEU 19 14.193 3.836 -6.346 1711 H GLU 20 H GLU 20 17.170 1.966 -10.825 1712 HA GLU 20 HA GLU 20 18.736 4.325 -10.817 1713 HB2 GLU 20 2HB GLU 20 19.095 1.797 -12.552 1714 HB3 GLU 20 1HB GLU 20 20.208 3.202 -12.510 1715 HG2 GLU 20 2HG GLU 20 20.286 2.704 -9.877 1716 HG3 GLU 20 1HG GLU 20 19.785 1.050 -10.387 1717 H GLU 21 H GLU 21 16.558 2.822 -13.282 1718 HA GLU 21 HA GLU 21 17.461 4.738 -15.206 1719 HB2 GLU 21 2HB GLU 21 16.361 2.510 -15.864 1720 HB3 GLU 21 1HB GLU 21 14.788 3.301 -15.513 1721 HG2 GLU 21 2HG GLU 21 15.474 5.192 -17.099 1722 HG3 GLU 21 1HG GLU 21 17.019 4.329 -17.400 1723 H ALA 22 H ALA 22 14.744 4.523 -12.914 1724 HA ALA 22 HA ALA 22 13.314 6.730 -13.775 1725 HB1 ALA 22 1HB ALA 22 13.586 5.614 -10.914 1726 HB2 ALA 22 2HB ALA 22 12.409 5.056 -12.154 1727 HB3 ALA 22 3HB ALA 22 12.289 6.729 -11.493 1728 H SER 23 H SER 23 16.230 6.568 -11.622 1729 HA SER 23 HA SER 23 15.809 9.200 -10.653 1730 HB2 SER 23 2HB SER 23 18.306 8.978 -9.980 1731 HB3 SER 23 1HB SER 23 17.121 7.833 -9.261 1732 HG SER 23 1HG SER 23 18.767 6.608 -9.943 1733 H LYS 24 H LYS 24 17.559 7.808 -13.423 1734 HA LYS 24 HA LYS 24 18.783 10.232 -14.230 1735 HB2 LYS 24 2HB LYS 24 19.367 7.846 -14.993 1736 HB3 LYS 24 1HB LYS 24 17.945 7.891 -16.070 1737 HG2 LYS 24 2HG LYS 24 20.290 9.915 -16.189 1738 HG3 LYS 24 1HG LYS 24 20.286 8.347 -17.062 1739 HD2 LYS 24 2HD LYS 24 18.254 9.026 -18.344 1740 HD3 LYS 24 1HD LYS 24 18.290 10.642 -17.550 1741 HE2 LYS 24 2HE LYS 24 20.574 11.086 -18.517 1742 HE3 LYS 24 1HE LYS 24 20.516 9.478 -19.347 1743 HZ1 LYS 24 3HZ LYS 24 18.612 11.765 -19.811 1744 HZ2 LYS 24 1HZ LYS 24 18.546 10.249 -20.549 1745 HZ3 LYS 24 2HZ LYS 24 19.855 11.299 -20.820 1746 H LYS 25 H LYS 25 15.662 8.637 -14.943 1747 HA LYS 25 HA LYS 25 14.827 10.575 -16.826 1748 HB2 LYS 25 2HB LYS 25 13.088 8.777 -15.045 1749 HB3 LYS 25 1HB LYS 25 12.473 9.761 -16.413 1750 HG2 LYS 25 2HG LYS 25 14.565 7.519 -16.687 1751 HG3 LYS 25 1HG LYS 25 12.797 7.295 -16.910 1752 HD2 LYS 25 2HD LYS 25 12.798 8.697 -18.912 1753 HD3 LYS 25 1HD LYS 25 14.448 9.313 -18.569 1754 HE2 LYS 25 2HE LYS 25 14.506 7.619 -20.412 1755 HE3 LYS 25 1HE LYS 25 15.465 7.108 -18.964 1756 HZ1 LYS 25 3HZ LYS 25 14.296 5.247 -19.603 1757 HZ2 LYS 25 1HZ LYS 25 12.807 6.102 -19.861 1758 HZ3 LYS 25 2HZ LYS 25 13.415 5.841 -18.302 1759 H ALA 26 H ALA 26 14.250 10.281 -13.275 1760 HA ALA 26 HA ALA 26 12.533 12.329 -12.926 1761 HB1 ALA 26 1HB ALA 26 13.348 12.459 -10.580 1762 HB2 ALA 26 2HB ALA 26 14.861 11.591 -11.039 1763 HB3 ALA 26 3HB ALA 26 13.272 10.748 -11.109 1764 H VAL 27 H VAL 27 16.157 12.631 -12.924 1765 HA VAL 27 HA VAL 27 16.026 15.381 -12.338 1766 HB VAL 27 HB VAL 27 18.397 15.538 -12.998 1767 HG11 VAL 27 1HG1 VAL 27 19.169 13.998 -11.202 1768 HG12 VAL 27 2HG1 VAL 27 17.617 13.086 -11.299 1769 HG13 VAL 27 3HG1 VAL 27 17.629 14.794 -10.733 1770 HG21 VAL 27 3HG2 VAL 27 18.115 12.533 -13.727 1771 HG22 VAL 27 1HG2 VAL 27 19.645 13.470 -13.639 1772 HG23 VAL 27 2HG2 VAL 27 18.439 13.853 -14.911 1773 H GLU 28 H GLU 28 15.907 13.632 -15.439 1774 HA GLU 28 HA GLU 28 16.410 16.126 -16.839 1775 HB2 GLU 28 2HB GLU 28 17.326 13.830 -17.564 1776 HB3 GLU 28 1HB GLU 28 15.680 13.500 -18.195 1777 HG2 GLU 28 2HG GLU 28 15.842 15.536 -19.667 1778 HG3 GLU 28 1HG GLU 28 17.431 15.963 -18.927 1779 H ALA 29 H ALA 29 13.752 14.130 -15.786 1780 HA ALA 29 HA ALA 29 11.801 15.257 -17.486 1781 HB1 ALA 29 1HB ALA 29 11.634 12.996 -16.358 1782 HB2 ALA 29 2HB ALA 29 10.221 14.022 -16.054 1783 HB3 ALA 29 3HB ALA 29 11.476 13.836 -14.770 1784 H GLU 30 H GLU 30 12.829 15.854 -14.049 1785 HA GLU 30 HA GLU 30 11.169 18.133 -13.731 1786 HB2 GLU 30 2HB GLU 30 13.515 16.881 -12.271 1787 HB3 GLU 30 1HB GLU 30 13.058 18.550 -11.835 1788 HG2 GLU 30 2HG GLU 30 10.763 16.554 -12.012 1789 HG3 GLU 30 1HG GLU 30 11.896 16.359 -10.630 1790 H ARG 31 H ARG 31 13.869 17.765 -15.735 1791 HA ARG 31 HA ARG 31 15.007 20.380 -15.234 1792 HB2 ARG 31 2HB ARG 31 16.418 18.419 -16.046 1793 HB3 ARG 31 1HB ARG 31 15.459 18.415 -17.555 1794 HG2 ARG 31 2HG ARG 31 17.491 19.398 -18.070 1795 HG3 ARG 31 1HG ARG 31 16.333 20.761 -18.056 1796 HD2 ARG 31 2HD ARG 31 17.251 21.661 -15.985 1797 HD3 ARG 31 1HD ARG 31 18.091 20.118 -15.574 1798 HE ARG 31 HE ARG 31 18.912 22.168 -17.613 1799 HH11 ARG 31 1HH2 ARG 31 19.541 18.874 -16.245 1800 HH12 ARG 31 2HH2 ARG 31 21.047 18.672 -17.023 1801 HH21 ARG 31 1HH1 ARG 31 21.008 21.851 -18.721 1802 HH22 ARG 31 2HH1 ARG 31 21.706 20.286 -18.687 1803 H GLY 32 H GLY 32 13.620 22.055 -15.778 1804 HA2 GLY 32 2HA GLY 32 12.972 23.517 -17.404 1805 HA3 GLY 32 1HA GLY 32 12.802 22.178 -18.593 1806 H ALA 33 H ALA 33 11.548 21.570 -15.383 1807 HA ALA 33 HA ALA 33 8.860 21.789 -16.449 1808 HB1 ALA 33 1HB ALA 33 8.170 20.498 -14.408 1809 HB2 ALA 33 2HB ALA 33 9.877 20.480 -13.859 1810 HB3 ALA 33 3HB ALA 33 9.415 19.625 -15.367 1811 HA PRO 34 HA PRO 34 8.725 25.536 -14.059 1812 HB2 PRO 34 2HB PRO 34 6.022 26.202 -14.169 1813 HB3 PRO 34 1HB PRO 34 7.136 26.266 -15.590 1814 HG2 PRO 34 2HG PRO 34 5.216 24.005 -14.822 1815 HG3 PRO 34 1HG PRO 34 5.431 24.790 -16.447 1816 HD2 PRO 34 2HD PRO 34 6.688 22.408 -15.765 1817 HD3 PRO 34 1HD PRO 34 7.516 23.653 -16.812 1818 H GLY 35 H GLY 35 9.254 25.238 -11.840 1819 HA2 GLY 35 2HA GLY 35 8.320 25.719 -9.721 1820 HA3 GLY 35 1HA GLY 35 6.956 24.585 -10.084 1821 H ALA 36 H ALA 36 9.733 23.405 -11.478 1822 HA ALA 36 HA ALA 36 9.909 21.123 -10.093 1823 HB1 ALA 36 1HB ALA 36 10.946 21.482 -12.330 1824 HB2 ALA 36 2HB ALA 36 12.147 20.824 -11.186 1825 HB3 ALA 36 3HB ALA 36 12.177 22.581 -11.600 1826 H ALA 37 H ALA 37 11.353 20.202 -8.673 1827 HA ALA 37 HA ALA 37 12.657 22.096 -6.780 1828 HB1 ALA 37 1HB ALA 37 10.910 19.645 -6.105 1829 HB2 ALA 37 2HB ALA 37 10.480 21.364 -5.808 1830 HB3 ALA 37 3HB ALA 37 11.842 20.626 -4.900 1831 H LEU 38 H LEU 38 12.816 19.176 -8.687 1832 HA LEU 38 HA LEU 38 14.615 17.856 -6.878 1833 HB2 LEU 38 2HB LEU 38 12.701 16.885 -8.301 1834 HB3 LEU 38 1HB LEU 38 13.813 16.926 -9.679 1835 HG LEU 38 HG LEU 38 14.386 15.471 -7.021 1836 HD11 LEU 38 1HD1 LEU 38 13.091 14.371 -9.588 1837 HD12 LEU 38 2HD1 LEU 38 12.295 14.583 -7.990 1838 HD13 LEU 38 3HD1 LEU 38 13.616 13.377 -8.173 1839 HD21 LEU 38 3HD2 LEU 38 16.457 15.799 -8.301 1840 HD22 LEU 38 1HD2 LEU 38 15.671 15.189 -9.805 1841 HD23 LEU 38 2HD2 LEU 38 15.961 14.078 -8.418 1842 H ILE 39 H ILE 39 14.974 18.307 -10.396 1843 HA ILE 39 HA ILE 39 16.812 18.171 -11.571 1844 HB ILE 39 HB ILE 39 18.103 20.328 -11.681 1845 HG12 ILE 39 2HG1 ILE 39 16.017 21.113 -9.513 1846 HG13 ILE 39 1HG1 ILE 39 17.786 21.063 -9.273 1847 HG21 ILE 39 1HG2 ILE 39 16.123 21.399 -12.733 1848 HG22 ILE 39 2HG2 ILE 39 15.007 20.371 -11.772 1849 HG23 ILE 39 3HG2 ILE 39 16.068 19.627 -13.020 1850 HD11 ILE 39 3HD ILE 39 16.145 22.972 -11.075 1851 HD12 ILE 39 1HD ILE 39 17.113 23.390 -9.626 1852 HD13 ILE 39 2HD ILE 39 17.940 22.891 -11.154 1853 H SER 40 H SER 40 19.455 19.726 -10.158 1854 HA SER 40 HA SER 40 21.247 18.968 -9.229 1855 HB2 SER 40 2HB SER 40 19.675 18.890 -7.223 1856 HB3 SER 40 1HB SER 40 19.467 17.137 -7.508 1857 HG SER 40 1HG SER 40 21.033 17.343 -6.015 1858 H TYR 41 H TYR 41 21.144 15.944 -8.153 1859 HA TYR 41 HA TYR 41 21.114 14.336 -10.425 1860 HB2 TYR 41 2HB TYR 41 23.078 15.593 -11.226 1861 HB3 TYR 41 1HB TYR 41 23.923 15.389 -9.674 1862 HD1 TYR 41 2HD TYR 41 22.132 13.153 -12.166 1863 HD2 TYR 41 1HD TYR 41 25.686 13.869 -9.842 1864 HE1 TYR 41 2HE TYR 41 23.183 11.204 -13.186 1865 HE2 TYR 41 1HE TYR 41 26.759 11.920 -10.877 1866 HH TYR 41 HH TYR 41 25.121 10.011 -13.471 1867 HA PRO 42 HA PRO 42 22.881 11.704 -7.095 1868 HB2 PRO 42 2HB PRO 42 23.852 12.573 -4.612 1869 HB3 PRO 42 1HB PRO 42 24.865 12.611 -6.105 1870 HG2 PRO 42 2HG PRO 42 23.207 14.922 -4.928 1871 HG3 PRO 42 1HG PRO 42 24.955 14.936 -5.415 1872 HD2 PRO 42 2HD PRO 42 23.009 15.824 -7.143 1873 HD3 PRO 42 1HD PRO 42 24.397 14.813 -7.749 1874 H ASP 43 H ASP 43 20.911 14.401 -5.985 1875 HA ASP 43 HA ASP 43 19.572 13.200 -3.871 1876 HB2 ASP 43 2HB ASP 43 18.399 15.173 -5.973 1877 HB3 ASP 43 1HB ASP 43 17.674 14.790 -4.372 1878 H ALA 44 H ALA 44 19.448 12.668 -7.301 1879 HA ALA 44 HA ALA 44 16.748 12.240 -7.679 1880 HB1 ALA 44 1HB ALA 44 19.083 10.917 -9.217 1881 HB2 ALA 44 2HB ALA 44 18.551 12.603 -9.438 1882 HB3 ALA 44 3HB ALA 44 17.414 11.261 -9.835 1883 H ILE 45 H ILE 45 19.354 9.949 -6.840 1884 HA ILE 45 HA ILE 45 17.672 7.673 -7.176 1885 HB ILE 45 HB ILE 45 19.990 7.375 -7.543 1886 HG12 ILE 45 2HG1 ILE 45 19.257 5.941 -4.916 1887 HG13 ILE 45 1HG1 ILE 45 18.674 5.483 -6.549 1888 HG21 ILE 45 1HG2 ILE 45 20.470 8.387 -4.663 1889 HG22 ILE 45 2HG2 ILE 45 20.932 9.205 -6.198 1890 HG23 ILE 45 3HG2 ILE 45 21.715 7.673 -5.739 1891 HD11 ILE 45 3HD ILE 45 21.621 5.481 -5.594 1892 HD12 ILE 45 1HD ILE 45 20.581 4.052 -5.919 1893 HD13 ILE 45 2HD ILE 45 21.085 5.120 -7.279 1894 H TRP 46 H TRP 46 18.362 9.910 -4.506 1895 HA TRP 46 HA TRP 46 17.261 8.192 -2.510 1896 HB2 TRP 46 2HB TRP 46 18.140 11.090 -2.623 1897 HB3 TRP 46 1HB TRP 46 16.955 10.653 -1.378 1898 HD1 TRP 46 HD TRP 46 18.651 11.385 0.433 1899 HE1 TRP 46 1HE TRP 46 20.528 10.147 1.665 1900 HE3 TRP 46 3HE TRP 46 19.352 7.500 -2.860 1901 HZ2 TRP 46 2HZ TRP 46 22.113 7.822 1.289 1902 HZ3 TRP 46 3HZ TRP 46 21.063 5.824 -2.368 1903 HH2 TRP 46 HH TRP 46 22.439 5.972 -0.326 1904 H TRP 47 H TRP 47 15.916 10.801 -4.578 1905 HA TRP 47 HA TRP 47 13.349 10.745 -3.428 1906 HB2 TRP 47 2HB TRP 47 14.049 12.554 -4.994 1907 HB3 TRP 47 1HB TRP 47 14.184 11.364 -6.334 1908 HD1 TRP 47 HD TRP 47 11.370 12.864 -4.005 1909 HE1 TRP 47 1HE TRP 47 9.180 12.872 -5.304 1910 HE3 TRP 47 3HE TRP 47 13.000 10.392 -8.152 1911 HZ2 TRP 47 2HZ TRP 47 8.200 11.763 -7.786 1912 HZ3 TRP 47 3HZ TRP 47 11.381 9.831 -9.935 1913 HH2 TRP 47 HH TRP 47 9.014 10.518 -9.757 1914 H SER 48 H SER 48 14.761 8.887 -6.224 1915 HA SER 48 HA SER 48 12.444 7.607 -6.931 1916 HB2 SER 48 2HB SER 48 15.289 6.427 -7.046 1917 HB3 SER 48 1HB SER 48 13.850 5.792 -7.934 1918 HG SER 48 1HG SER 48 15.005 7.085 -9.278 1919 H VAL 49 H VAL 49 14.706 6.768 -4.290 1920 HA VAL 49 HA VAL 49 13.741 4.184 -3.823 1921 HB VAL 49 HB VAL 49 15.166 6.211 -2.057 1922 HG11 VAL 49 1HG1 VAL 49 14.356 3.312 -1.318 1923 HG12 VAL 49 2HG1 VAL 49 13.862 4.823 -0.471 1924 HG13 VAL 49 3HG1 VAL 49 15.575 4.307 -0.431 1925 HG21 VAL 49 3HG2 VAL 49 16.361 5.081 -4.053 1926 HG22 VAL 49 1HG2 VAL 49 16.041 3.496 -3.286 1927 HG23 VAL 49 2HG2 VAL 49 17.098 4.706 -2.459 1928 H GLU 50 H GLU 50 12.660 7.370 -2.493 1929 HA GLU 50 HA GLU 50 10.826 6.182 -0.701 1930 HB2 GLU 50 2HB GLU 50 10.950 9.003 -1.879 1931 HB3 GLU 50 1HB GLU 50 9.998 8.530 -0.425 1932 HG2 GLU 50 2HG GLU 50 13.079 8.194 -0.559 1933 HG3 GLU 50 1HG GLU 50 12.262 9.706 -0.062 1934 H THR 51 H THR 51 10.668 6.093 -3.972 1935 HA THR 51 HA THR 51 7.767 6.604 -4.098 1936 HB THR 51 HB THR 51 9.841 6.329 -6.325 1937 HG1 THR 51 1HG THR 51 10.076 8.243 -5.148 1938 HG21 THR 51 3HG2 THR 51 6.835 7.093 -6.309 1939 HG22 THR 51 1HG2 THR 51 7.554 5.631 -7.053 1940 HG23 THR 51 2HG2 THR 51 7.930 7.254 -7.731 1941 H ALA 52 H ALA 52 10.314 4.087 -4.476 1942 HA ALA 52 HA ALA 52 8.557 2.249 -5.772 1943 HB1 ALA 52 1HB ALA 52 10.370 0.548 -5.240 1944 HB2 ALA 52 2HB ALA 52 11.226 1.817 -4.289 1945 HB3 ALA 52 3HB ALA 52 10.993 2.011 -6.073 1946 H THR 53 H THR 53 9.156 3.108 -2.387 1947 HA THR 53 HA THR 53 7.954 0.711 -1.363 1948 HB THR 53 HB THR 53 8.283 2.192 0.797 1949 HG1 THR 53 1HG THR 53 9.472 3.998 0.488 1950 HG21 THR 53 3HG2 THR 53 10.707 1.402 -0.979 1951 HG22 THR 53 1HG2 THR 53 9.781 0.288 0.095 1952 HG23 THR 53 2HG2 THR 53 10.732 1.641 0.807 1953 H THR 54 H THR 54 6.766 3.387 -2.954 1954 HA THR 54 HA THR 54 5.005 4.603 -2.989 1955 HB THR 54 HB THR 54 2.755 3.436 -2.432 1956 HG1 THR 54 1HG THR 54 4.090 1.807 -1.157 1957 HG21 THR 54 3HG2 THR 54 3.000 2.109 -4.541 1958 HG22 THR 54 1HG2 THR 54 4.793 2.288 -4.468 1959 HG23 THR 54 2HG2 THR 54 3.744 3.738 -4.703 1960 H VAL 55 H VAL 55 6.569 5.234 -0.698 1961 HA VAL 55 HA VAL 55 4.587 5.585 1.396 1962 HB VAL 55 HB VAL 55 6.434 6.497 2.727 1963 HG11 VAL 55 1HG1 VAL 55 5.653 4.138 2.655 1964 HG12 VAL 55 2HG1 VAL 55 7.396 4.229 3.054 1965 HG13 VAL 55 3HG1 VAL 55 6.872 3.736 1.401 1966 HG21 VAL 55 3HG2 VAL 55 8.178 5.766 0.261 1967 HG22 VAL 55 1HG2 VAL 55 8.777 6.283 1.870 1968 HG23 VAL 55 2HG2 VAL 55 7.860 7.427 0.863 1969 H GLY 56 H GLY 56 5.940 7.479 -1.226 1970 HA2 GLY 56 2HA GLY 56 4.743 9.225 -2.027 1971 HA3 GLY 56 1HA GLY 56 3.949 9.470 -0.431 1972 H TYR 57 H TYR 57 5.922 9.943 1.298 1973 HA TYR 57 HA TYR 57 6.532 12.597 0.503 1974 HB2 TYR 57 2HB TYR 57 7.363 12.968 2.830 1975 HB3 TYR 57 1HB TYR 57 5.701 12.289 2.747 1976 HD1 TYR 57 2HD TYR 57 5.343 9.811 3.197 1977 HD2 TYR 57 1HD TYR 57 9.084 11.776 3.987 1978 HE1 TYR 57 2HE TYR 57 6.145 7.819 4.401 1979 HE2 TYR 57 1HE TYR 57 9.883 9.790 5.196 1980 HH TYR 57 HH TYR 57 9.226 7.144 4.925 1981 H GLY 58 H GLY 58 8.043 11.957 -1.328 1982 HA2 GLY 58 2HA GLY 58 10.603 10.969 -0.483 1983 HA3 GLY 58 1HA GLY 58 10.061 11.397 -2.137 1984 H ASP 59 H ASP 59 9.600 13.934 0.020 1985 HA ASP 59 HA ASP 59 10.540 15.844 0.446 1986 HB2 ASP 59 2HB ASP 59 12.309 14.402 1.458 1987 HB3 ASP 59 1HB ASP 59 13.272 14.575 -0.048 1988 H ARG 60 H ARG 60 10.453 14.607 -2.647 1989 HA ARG 60 HA ARG 60 10.720 17.275 -3.700 1990 HB2 ARG 60 2HB ARG 60 11.784 14.880 -5.304 1991 HB3 ARG 60 1HB ARG 60 11.819 16.594 -5.785 1992 HG2 ARG 60 2HG ARG 60 13.376 15.401 -3.390 1993 HG3 ARG 60 1HG ARG 60 14.037 15.525 -5.039 1994 HD2 ARG 60 2HD ARG 60 13.838 18.024 -4.983 1995 HD3 ARG 60 1HD ARG 60 13.153 17.974 -3.335 1996 HE ARG 60 HE ARG 60 15.967 17.591 -4.144 1997 HH11 ARG 60 1HH2 ARG 60 13.529 17.472 -1.484 1998 HH12 ARG 60 2HH2 ARG 60 14.600 17.091 -0.263 1999 HH21 ARG 60 1HH1 ARG 60 17.528 16.730 -2.398 2000 HH22 ARG 60 2HH1 ARG 60 16.907 16.697 -0.789 2001 H TYR 61 H TYR 61 9.371 17.192 -5.935 2002 HA TYR 61 HA TYR 61 7.262 15.254 -5.711 2003 HB2 TYR 61 2HB TYR 61 5.597 17.210 -6.104 2004 HB3 TYR 61 1HB TYR 61 6.237 17.075 -4.432 2005 HD1 TYR 61 1HD TYR 61 6.623 18.968 -7.658 2006 HD2 TYR 61 2HD TYR 61 7.410 18.942 -3.434 2007 HE1 TYR 61 1HE TYR 61 7.322 21.279 -7.801 2008 HE2 TYR 61 2HE TYR 61 8.112 21.305 -3.561 2009 HH TYR 61 HH TYR 61 8.372 22.963 -6.758 2010 HA PRO 62 HA PRO 62 8.053 16.314 -10.123 2011 HB2 PRO 62 2HB PRO 62 5.963 14.896 -11.330 2012 HB3 PRO 62 1HB PRO 62 7.365 14.028 -10.587 2013 HG2 PRO 62 2HG PRO 62 4.596 14.551 -9.387 2014 HG3 PRO 62 1HG PRO 62 5.532 13.000 -9.388 2015 HD2 PRO 62 2HD PRO 62 5.463 14.880 -7.276 2016 HD3 PRO 62 1HD PRO 62 6.865 13.744 -7.551 2017 H VAL 63 H VAL 63 6.552 17.531 -11.971 2018 HA VAL 63 HA VAL 63 4.482 19.026 -10.556 2019 HB VAL 63 HB VAL 63 6.191 20.086 -12.833 2020 HG11 VAL 63 1HG1 VAL 63 4.209 21.374 -10.807 2021 HG12 VAL 63 2HG1 VAL 63 3.856 21.100 -12.552 2022 HG13 VAL 63 3HG1 VAL 63 5.143 22.254 -12.070 2023 HG21 VAL 63 3HG2 VAL 63 6.431 20.450 -9.779 2024 HG22 VAL 63 1HG2 VAL 63 7.276 21.461 -11.015 2025 HG23 VAL 63 2HG2 VAL 63 7.651 19.715 -10.880 2026 H THR 64 H THR 64 5.237 18.777 -14.037 2027 HA THR 64 HA THR 64 2.710 17.595 -14.575 2028 HB THR 64 HB THR 64 3.137 20.401 -15.753 2029 HG1 THR 64 1HG THR 64 1.709 21.146 -14.343 2030 HG21 THR 64 3HG2 THR 64 0.738 20.090 -16.501 2031 HG22 THR 64 1HG2 THR 64 0.711 18.456 -15.745 2032 HG23 THR 64 2HG2 THR 64 1.779 18.781 -17.156 2033 H GLU 65 H GLU 65 5.511 19.471 -15.803 2034 HA GLU 65 HA GLU 65 5.160 18.358 -18.427 2035 HB2 GLU 65 2HB GLU 65 5.717 20.813 -17.952 2036 HB3 GLU 65 1HB GLU 65 7.344 20.254 -17.440 2037 HG2 GLU 65 2HG GLU 65 7.593 21.087 -19.649 2038 HG3 GLU 65 1HG GLU 65 7.641 19.306 -19.827 2039 H GLU 66 H GLU 66 6.963 17.513 -15.537 2040 HA GLU 66 HA GLU 66 9.093 16.184 -16.760 2041 HB2 GLU 66 2HB GLU 66 9.479 15.152 -14.578 2042 HB3 GLU 66 1HB GLU 66 9.019 16.846 -14.326 2043 HG2 GLU 66 2HG GLU 66 7.282 14.323 -13.867 2044 HG3 GLU 66 1HG GLU 66 8.007 15.441 -12.642 2045 H GLY 67 H GLY 67 5.755 15.463 -16.049 2046 HA2 GLY 67 2HA GLY 67 4.438 14.099 -17.376 2047 HA3 GLY 67 1HA GLY 67 5.898 13.048 -17.737 2048 H ARG 68 H ARG 68 3.496 14.009 -15.257 2049 HA ARG 68 HA ARG 68 4.815 13.092 -13.073 2050 HB2 ARG 68 2HB ARG 68 2.812 14.491 -12.988 2051 HB3 ARG 68 1HB ARG 68 1.775 13.128 -13.534 2052 HG2 ARG 68 2HG ARG 68 2.164 11.897 -11.448 2053 HG3 ARG 68 1HG ARG 68 3.455 13.031 -10.948 2054 HD2 ARG 68 2HD ARG 68 0.441 13.753 -11.166 2055 HD3 ARG 68 1HD ARG 68 1.350 13.380 -9.651 2056 HE ARG 68 HE ARG 68 2.112 15.662 -11.521 2057 HH11 ARG 68 1HH2 ARG 68 1.221 14.771 -8.086 2058 HH12 ARG 68 2HH2 ARG 68 2.205 15.980 -7.470 2059 HH21 ARG 68 1HH1 ARG 68 2.838 17.565 -10.554 2060 HH22 ARG 68 2HH1 ARG 68 2.901 17.764 -8.834 2061 H LYS 69 H LYS 69 3.498 11.251 -15.615 2062 HA LYS 69 HA LYS 69 3.169 8.769 -14.390 2063 HB2 LYS 69 2HB LYS 69 4.065 9.366 -17.259 2064 HB3 LYS 69 1HB LYS 69 3.559 7.772 -16.593 2065 HG2 LYS 69 2HG LYS 69 1.380 8.951 -15.831 2066 HG3 LYS 69 1HG LYS 69 1.767 10.240 -17.029 2067 HD2 LYS 69 2HD LYS 69 1.707 8.538 -18.860 2068 HD3 LYS 69 1HD LYS 69 1.752 7.225 -17.628 2069 HE2 LYS 69 2HE LYS 69 -0.549 8.082 -16.774 2070 HE3 LYS 69 1HE LYS 69 -0.648 9.027 -18.317 2071 HZ1 LYS 69 3HZ LYS 69 -1.661 6.959 -18.767 2072 HZ2 LYS 69 1HZ LYS 69 -0.465 6.094 -17.900 2073 HZ3 LYS 69 2HZ LYS 69 -0.100 6.791 -19.407 2074 H VAL 70 H VAL 70 6.123 10.605 -14.727 2075 HA VAL 70 HA VAL 70 7.896 8.414 -14.811 2076 HB VAL 70 HB VAL 70 8.184 11.258 -13.749 2077 HG11 VAL 70 1HG1 VAL 70 9.825 9.876 -12.481 2078 HG12 VAL 70 2HG1 VAL 70 10.681 10.811 -13.750 2079 HG13 VAL 70 3HG1 VAL 70 10.353 9.053 -13.995 2080 HG21 VAL 70 3HG2 VAL 70 9.284 9.812 -16.267 2081 HG22 VAL 70 1HG2 VAL 70 9.502 11.553 -15.844 2082 HG23 VAL 70 2HG2 VAL 70 7.876 10.930 -16.258 2083 H ALA 71 H ALA 71 6.084 10.004 -12.153 2084 HA ALA 71 HA ALA 71 7.400 8.522 -10.084 2085 HB1 ALA 71 1HB ALA 71 4.646 9.938 -10.144 2086 HB2 ALA 71 2HB ALA 71 6.187 10.634 -9.517 2087 HB3 ALA 71 3HB ALA 71 5.430 9.240 -8.680 2088 H GLU 72 H GLU 72 4.391 8.263 -11.961 2089 HA GLU 72 HA GLU 72 3.199 6.106 -10.789 2090 HB2 GLU 72 2HB GLU 72 2.264 7.586 -12.707 2091 HB3 GLU 72 1HB GLU 72 3.242 6.572 -13.817 2092 HG2 GLU 72 2HG GLU 72 1.879 4.535 -12.850 2093 HG3 GLU 72 1HG GLU 72 0.809 5.773 -12.098 2094 H GLN 73 H GLN 73 5.665 6.092 -13.406 2095 HA GLN 73 HA GLN 73 5.539 3.368 -13.856 2096 HB2 GLN 73 2HB GLN 73 6.598 4.953 -15.438 2097 HB3 GLN 73 1HB GLN 73 7.921 5.255 -14.265 2098 HG2 GLN 73 2HG GLN 73 8.651 3.757 -16.101 2099 HG3 GLN 73 1HG GLN 73 8.725 2.889 -14.534 2100 HE21 GLN 73 1HE2 GLN 73 7.105 1.183 -14.125 2101 HE22 GLN 73 2HE2 GLN 73 6.344 0.387 -15.457 2102 H VAL 74 H VAL 74 7.428 5.127 -11.360 2103 HA VAL 74 HA VAL 74 9.060 2.850 -10.771 2104 HB VAL 74 HB VAL 74 8.435 5.231 -8.957 2105 HG11 VAL 74 1HG1 VAL 74 9.556 3.296 -7.796 2106 HG12 VAL 74 2HG1 VAL 74 10.699 4.668 -7.981 2107 HG13 VAL 74 3HG1 VAL 74 10.819 3.242 -9.079 2108 HG21 VAL 74 3HG2 VAL 74 9.212 6.134 -11.083 2109 HG22 VAL 74 1HG2 VAL 74 10.503 4.886 -11.207 2110 HG23 VAL 74 2HG2 VAL 74 10.588 6.178 -9.941 2111 H MET 75 H MET 75 6.074 4.325 -9.468 2112 HA MET 75 HA MET 75 5.789 2.591 -7.285 2113 HB2 MET 75 2HB MET 75 3.628 4.121 -8.859 2114 HB3 MET 75 1HB MET 75 3.385 3.316 -7.267 2115 HG2 MET 75 2HG MET 75 5.221 4.751 -6.302 2116 HG3 MET 75 1HG MET 75 5.309 5.659 -7.833 2117 HE1 MET 75 3HE MET 75 2.009 7.702 -7.980 2118 HE2 MET 75 1HE MET 75 2.335 6.145 -8.802 2119 HE3 MET 75 2HE MET 75 3.634 7.390 -8.677 2120 H LYS 76 H LYS 76 4.538 2.438 -10.649 2121 HA LYS 76 HA LYS 76 2.906 0.249 -10.377 2122 HB2 LYS 76 2HB LYS 76 3.140 1.750 -12.444 2123 HB3 LYS 76 1HB LYS 76 4.662 0.882 -12.826 2124 HG2 LYS 76 2HG LYS 76 3.232 -1.294 -12.861 2125 HG3 LYS 76 1HG LYS 76 1.783 -0.231 -12.800 2126 HD2 LYS 76 2HD LYS 76 2.655 0.947 -14.905 2127 HD3 LYS 76 1HD LYS 76 4.019 -0.210 -14.930 2128 HE2 LYS 76 2HE LYS 76 1.054 -0.703 -15.548 2129 HE3 LYS 76 1HE LYS 76 2.515 -1.093 -16.540 2130 HZ1 LYS 76 3HZ LYS 76 1.179 -2.520 -14.407 2131 HZ2 LYS 76 1HZ LYS 76 2.893 -2.734 -14.413 2132 HZ3 LYS 76 2HZ LYS 76 1.932 -3.132 -15.754 2133 H ALA 77 H ALA 77 6.406 0.353 -11.142 2134 HA ALA 77 HA ALA 77 6.724 -2.418 -11.463 2135 HB1 ALA 77 1HB ALA 77 9.180 -1.975 -11.120 2136 HB2 ALA 77 2HB ALA 77 8.789 -0.313 -10.531 2137 HB3 ALA 77 3HB ALA 77 8.455 -0.768 -12.244 2138 H GLY 78 H GLY 78 6.948 -0.269 -8.597 2139 HA2 GLY 78 2HA GLY 78 7.990 -2.194 -6.832 2140 HA3 GLY 78 1HA GLY 78 7.081 -0.689 -6.423 2141 H ILE 79 H ILE 79 4.618 -1.130 -7.463 2142 HA ILE 79 HA ILE 79 3.397 -2.795 -5.592 2143 HB ILE 79 HB ILE 79 2.422 -1.544 -8.202 2144 HG12 ILE 79 2HG1 ILE 79 1.864 -0.804 -5.250 2145 HG13 ILE 79 1HG1 ILE 79 3.135 -0.038 -6.242 2146 HG21 ILE 79 1HG2 ILE 79 0.717 -2.957 -6.036 2147 HG22 ILE 79 2HG2 ILE 79 0.955 -3.527 -7.731 2148 HG23 ILE 79 3HG2 ILE 79 0.075 -2.007 -7.422 2149 HD11 ILE 79 3HD ILE 79 0.101 0.072 -6.821 2150 HD12 ILE 79 1HD ILE 79 1.145 1.403 -6.221 2151 HD13 ILE 79 2HD ILE 79 1.387 0.756 -7.886 2152 H GLU 80 H GLU 80 4.062 -3.300 -9.128 2153 HA GLU 80 HA GLU 80 2.925 -5.848 -9.210 2154 HB2 GLU 80 2HB GLU 80 5.088 -4.581 -10.991 2155 HB3 GLU 80 1HB GLU 80 4.412 -6.225 -11.276 2156 HG2 GLU 80 2HG GLU 80 2.107 -5.260 -11.487 2157 HG3 GLU 80 1HG GLU 80 2.784 -3.605 -11.331 2158 H VAL 81 H VAL 81 6.354 -4.865 -8.540 2159 HA VAL 81 HA VAL 81 7.331 -7.487 -8.462 2160 HB VAL 81 HB VAL 81 8.290 -4.816 -7.393 2161 HG11 VAL 81 1HG1 VAL 81 10.506 -5.939 -6.822 2162 HG12 VAL 81 2HG1 VAL 81 9.678 -7.534 -6.905 2163 HG13 VAL 81 3HG1 VAL 81 9.181 -6.313 -5.677 2164 HG21 VAL 81 3HG2 VAL 81 10.012 -5.169 -9.173 2165 HG22 VAL 81 1HG2 VAL 81 8.371 -5.386 -9.873 2166 HG23 VAL 81 2HG2 VAL 81 9.384 -6.824 -9.493 2167 H PHE 82 H PHE 82 6.232 -5.346 -5.721 2168 HA PHE 82 HA PHE 82 6.785 -7.445 -3.875 2169 HB2 PHE 82 2HB PHE 82 5.099 -4.889 -3.535 2170 HB3 PHE 82 1HB PHE 82 5.511 -6.022 -2.191 2171 HD1 PHE 82 2HD PHE 82 8.299 -6.713 -2.488 2172 HD2 PHE 82 1HD PHE 82 6.368 -2.943 -3.276 2173 HE1 PHE 82 2HE PHE 82 10.426 -5.545 -2.111 2174 HE2 PHE 82 1HE PHE 82 8.491 -1.773 -2.858 2175 HZ PHE 82 HZ PHE 82 10.534 -3.061 -2.275 2176 H ALA 83 H ALA 83 3.994 -6.725 -5.892 2177 HA ALA 83 HA ALA 83 2.251 -8.425 -4.367 2178 HB1 ALA 83 1HB ALA 83 2.026 -7.471 -7.293 2179 HB2 ALA 83 2HB ALA 83 1.279 -6.669 -5.868 2180 HB3 ALA 83 3HB ALA 83 0.729 -8.310 -6.355 2181 H LEU 84 H LEU 84 4.416 -8.776 -7.216 2182 HA LEU 84 HA LEU 84 3.516 -11.174 -8.170 2183 HB2 LEU 84 2HB LEU 84 5.135 -9.676 -9.310 2184 HB3 LEU 84 1HB LEU 84 6.427 -10.152 -8.174 2185 HG LEU 84 HG LEU 84 4.969 -12.249 -9.877 2186 HD11 LEU 84 1HD1 LEU 84 7.257 -10.444 -10.892 2187 HD12 LEU 84 2HD1 LEU 84 5.544 -10.417 -11.454 2188 HD13 LEU 84 3HD1 LEU 84 6.566 -11.872 -11.753 2189 HD21 LEU 84 3HD2 LEU 84 6.630 -13.172 -8.254 2190 HD22 LEU 84 1HD2 LEU 84 7.900 -12.069 -8.893 2191 HD23 LEU 84 2HD2 LEU 84 7.222 -13.378 -9.927 2192 H VAL 85 H VAL 85 5.885 -10.536 -5.597 2193 HA VAL 85 HA VAL 85 6.702 -13.205 -5.363 2194 HB VAL 85 HB VAL 85 7.862 -12.541 -3.347 2195 HG11 VAL 85 1HG1 VAL 85 7.981 -10.209 -5.386 2196 HG12 VAL 85 2HG1 VAL 85 8.582 -11.843 -5.774 2197 HG13 VAL 85 3HG1 VAL 85 9.321 -10.896 -4.423 2198 HG21 VAL 85 3HG2 VAL 85 6.365 -9.846 -3.607 2199 HG22 VAL 85 1HG2 VAL 85 7.643 -10.234 -2.412 2200 HG23 VAL 85 2HG2 VAL 85 6.049 -11.057 -2.316 2201 H THR 86 H THR 86 3.646 -11.998 -4.590 2202 HA THR 86 HA THR 86 3.164 -13.250 -2.155 2203 HB THR 86 HB THR 86 1.098 -12.754 -4.340 2204 HG1 THR 86 1HG THR 86 2.002 -10.856 -3.971 2205 HG21 THR 86 3HG2 THR 86 -0.436 -12.456 -2.338 2206 HG22 THR 86 1HG2 THR 86 0.906 -12.947 -1.242 2207 HG23 THR 86 2HG2 THR 86 0.207 -14.127 -2.414 2208 H ALA 87 H ALA 87 3.848 -14.646 -5.205 2209 HA ALA 87 HA ALA 87 2.602 -17.129 -5.008 2210 HB1 ALA 87 1HB ALA 87 5.497 -16.518 -5.937 2211 HB2 ALA 87 2HB ALA 87 4.037 -16.372 -6.953 2212 HB3 ALA 87 3HB ALA 87 4.540 -17.990 -6.345 2213 H ALA 88 H ALA 88 5.776 -16.075 -3.708 2214 HA ALA 88 HA ALA 88 6.476 -18.489 -2.464 2215 HB1 ALA 88 1HB ALA 88 7.342 -15.556 -1.973 2216 HB2 ALA 88 2HB ALA 88 8.205 -16.773 -2.986 2217 HB3 ALA 88 3HB ALA 88 8.131 -16.970 -1.202 2218 H LEU 89 H LEU 89 5.068 -15.425 -1.253 2219 HA LEU 89 HA LEU 89 4.922 -16.295 1.401 2220 HB2 LEU 89 2HB LEU 89 3.271 -14.103 0.007 2221 HB3 LEU 89 1HB LEU 89 3.231 -14.462 1.758 2222 HG LEU 89 HG LEU 89 4.541 -12.554 1.494 2223 HD11 LEU 89 1HD1 LEU 89 6.634 -13.146 2.615 2224 HD12 LEU 89 2HD1 LEU 89 6.532 -14.850 2.041 2225 HD13 LEU 89 3HD1 LEU 89 5.309 -14.209 3.205 2226 HD21 LEU 89 3HD2 LEU 89 6.597 -12.295 0.196 2227 HD22 LEU 89 1HD2 LEU 89 5.220 -12.716 -0.881 2228 HD23 LEU 89 2HD2 LEU 89 6.459 -13.963 -0.462 2229 H ALA 90 H ALA 90 2.619 -16.690 -1.307 2230 HA ALA 90 HA ALA 90 0.478 -17.470 0.326 2231 HB1 ALA 90 1HB ALA 90 -0.521 -18.504 -1.749 2232 HB2 ALA 90 2HB ALA 90 1.041 -18.217 -2.611 2233 HB3 ALA 90 3HB ALA 90 0.057 -16.824 -2.034 2234 H THR 91 H THR 91 2.955 -19.469 -1.463 2235 HA THR 91 HA THR 91 1.657 -21.819 -0.467 2236 HB THR 91 HB THR 91 2.460 -22.618 -2.305 2237 HG1 THR 91 1HG THR 91 4.027 -23.369 -0.420 2238 HG21 THR 91 3HG2 THR 91 4.560 -21.844 -3.491 2239 HG22 THR 91 1HG2 THR 91 4.800 -20.622 -2.177 2240 HG23 THR 91 2HG2 THR 91 3.329 -20.589 -3.232 2241 H ASP 92 H ASP 92 3.445 -19.563 1.350 2242 HA ASP 92 HA ASP 92 4.768 -21.664 2.761 2243 HB2 ASP 92 2HB ASP 92 5.296 -18.949 2.725 2244 HB3 ASP 92 1HB ASP 92 4.591 -19.189 4.365 2245 H PHE 93 H PHE 93 1.529 -21.062 2.537 2246 HA PHE 93 HA PHE 93 0.939 -21.911 5.213 2247 HB2 PHE 93 2HB PHE 93 -1.294 -22.277 4.700 2248 HB3 PHE 93 1HB PHE 93 -0.853 -20.819 3.759 2249 HD1 PHE 93 2HD PHE 93 -1.510 -24.540 3.531 2250 HD2 PHE 93 1HD PHE 93 -1.321 -20.808 1.414 2251 HE1 PHE 93 2HE PHE 93 -2.441 -25.626 1.536 2252 HE2 PHE 93 1HE PHE 93 -2.288 -21.880 -0.573 2253 HZ PHE 93 HZ PHE 93 -2.840 -24.311 -0.531 2254 H VAL 94 H VAL 94 2.250 -23.558 2.348 2255 HA VAL 94 HA VAL 94 1.005 -26.036 3.030 2256 HB VAL 94 HB VAL 94 2.110 -27.091 1.278 2257 HG11 VAL 94 1HG1 VAL 94 1.533 -24.166 0.424 2258 HG12 VAL 94 2HG1 VAL 94 0.320 -25.472 0.651 2259 HG13 VAL 94 3HG1 VAL 94 1.564 -25.615 -0.640 2260 HG21 VAL 94 3HG2 VAL 94 3.978 -25.826 -0.027 2261 HG22 VAL 94 1HG2 VAL 94 4.416 -26.610 1.527 2262 HG23 VAL 94 2HG2 VAL 94 4.204 -24.842 1.463 2263 H ARG 95 H ARG 95 3.620 -24.305 4.285 2264 HA ARG 95 HA ARG 95 5.184 -26.523 5.201 2265 HB2 ARG 95 2HB ARG 95 5.854 -23.979 4.705 2266 HB3 ARG 95 1HB ARG 95 5.165 -23.660 6.316 2267 HG2 ARG 95 2HG ARG 95 6.868 -25.775 6.902 2268 HG3 ARG 95 1HG ARG 95 7.715 -25.083 5.480 2269 HD2 ARG 95 2HD ARG 95 6.895 -23.643 8.094 2270 HD3 ARG 95 1HD ARG 95 8.583 -24.091 7.590 2271 HE ARG 95 HE ARG 95 7.174 -22.279 5.651 2272 HH11 ARG 95 1HH2 ARG 95 8.632 -22.230 8.925 2273 HH12 ARG 95 2HH2 ARG 95 9.370 -20.712 8.776 2274 HH21 ARG 95 1HH1 ARG 95 8.126 -20.205 5.366 2275 HH22 ARG 95 2HH1 ARG 95 9.137 -19.489 6.549 2276 H ARG 96 H ARG 96 2.112 -25.306 6.010 2277 HA ARG 96 HA ARG 96 2.239 -25.615 8.869 2278 HB2 ARG 96 2HB ARG 96 0.510 -24.176 7.644 2279 HB3 ARG 96 1HB ARG 96 -0.110 -25.661 6.863 2280 HG2 ARG 96 2HG ARG 96 -0.782 -26.502 9.216 2281 HG3 ARG 96 1HG ARG 96 -0.282 -24.906 9.842 2282 HD2 ARG 96 2HD ARG 96 -2.722 -25.011 9.524 2283 HD3 ARG 96 1HD ARG 96 -2.031 -23.803 8.364 2284 HE ARG 96 HE ARG 96 -2.069 -25.761 6.650 2285 HH11 ARG 96 1HH2 ARG 96 -4.725 -25.107 9.057 2286 HH12 ARG 96 2HH2 ARG 96 -5.835 -26.069 8.204 2287 HH21 ARG 96 1HH1 ARG 96 -3.717 -27.083 5.516 2288 HH22 ARG 96 2HH1 ARG 96 -5.298 -27.147 6.213 2289 H GLU 97 H GLU 97 1.961 -27.686 6.057 2290 HA GLU 97 HA GLU 97 0.577 -29.765 7.598 2291 HB2 GLU 97 2HB GLU 97 0.823 -29.609 4.549 2292 HB3 GLU 97 1HB GLU 97 -0.350 -30.545 5.538 2293 HG2 GLU 97 2HG GLU 97 -1.150 -28.138 6.404 2294 HG3 GLU 97 1HG GLU 97 -0.185 -27.488 5.034 2295 H GLU 98 H GLU 98 1.423 -31.990 7.056 2296 HA GLU 98 HA GLU 98 2.970 -33.434 7.249 2297 HB2 GLU 98 2HB GLU 98 5.105 -31.714 5.948 2298 HB3 GLU 98 1HB GLU 98 5.097 -33.480 6.251 2299 HG2 GLU 98 2HG GLU 98 2.780 -33.373 4.827 2300 HG3 GLU 98 1HG GLU 98 3.468 -31.816 4.239 2301 H GLU 99 H GLU 99 4.182 -30.231 8.181 2302 HA GLU 99 HA GLU 99 5.905 -31.071 10.134 2303 HB2 GLU 99 2HB GLU 99 4.353 -28.420 9.971 2304 HB3 GLU 99 1HB GLU 99 5.847 -28.714 10.925 2305 HG2 GLU 99 2HG GLU 99 5.591 -28.804 7.836 2306 HG3 GLU 99 1HG GLU 99 6.384 -27.538 8.830 2307 H ARG 100 H ARG 100 2.406 -30.465 10.496 2308 HA ARG 100 HA ARG 100 2.437 -30.080 13.254 2309 HB2 ARG 100 2HB ARG 100 0.262 -31.101 11.360 2310 HB3 ARG 100 1HB ARG 100 -0.053 -30.915 13.116 2311 HG2 ARG 100 2HG ARG 100 0.332 -28.576 13.127 2312 HG3 ARG 100 1HG ARG 100 1.016 -28.555 11.479 2313 HD2 ARG 100 2HD ARG 100 -1.927 -29.313 12.143 2314 HD3 ARG 100 1HD ARG 100 -1.370 -27.678 11.614 2315 HE ARG 100 HE ARG 100 -0.428 -28.735 9.570 2316 HH11 ARG 100 1HH2 ARG 100 -3.026 -30.707 11.248 2317 HH12 ARG 100 2HH2 ARG 100 -3.731 -31.255 9.802 2318 HH21 ARG 100 1HH1 ARG 100 -1.594 -29.452 7.555 2319 HH22 ARG 100 2HH1 ARG 100 -2.867 -30.568 7.655 2320 H ARG 101 H ARG 101 2.916 -33.096 11.572 2321 HA ARG 101 HA ARG 101 2.145 -34.642 13.952 2322 HB2 ARG 101 2HB ARG 101 3.450 -35.639 11.348 2323 HB3 ARG 101 1HB ARG 101 2.795 -36.631 12.700 2324 HG2 ARG 101 2HG ARG 101 0.492 -35.548 12.190 2325 HG3 ARG 101 1HG ARG 101 1.238 -34.927 10.674 2326 HD2 ARG 101 2HD ARG 101 1.880 -37.354 10.090 2327 HD3 ARG 101 1HD ARG 101 0.981 -37.908 11.552 2328 HE ARG 101 HE ARG 101 -0.095 -36.914 8.980 2329 HH11 ARG 101 1HH2 ARG 101 -1.123 -37.564 12.445 2330 HH12 ARG 101 2HH2 ARG 101 -2.532 -38.385 11.902 2331 HH21 ARG 101 1HH1 ARG 101 -2.109 -37.914 8.422 2332 HH22 ARG 101 2HH1 ARG 101 -3.143 -38.496 9.705 2333 H GLY 102 H GLY 102 4.865 -33.002 12.521 2334 HA2 GLY 102 2HA GLY 102 6.954 -32.810 13.093 2335 HA3 GLY 102 1HA GLY 102 6.584 -33.756 14.583 2336 H HIS 103 H HIS 103 6.201 -34.961 11.217 2337 HA HIS 103 HA HIS 103 8.637 -36.584 11.637 2338 HB2 HIS 103 2HB HIS 103 5.965 -37.594 10.491 2339 HB3 HIS 103 1HB HIS 103 7.538 -38.404 10.209 2340 HD1 HIS 103 1HD HIS 103 8.927 -38.941 12.661 2341 HD2 HIS 103 2HD HIS 103 4.693 -38.878 12.648 2342 HE1 HIS 103 1HE HIS 103 8.149 -40.244 14.631 2343 HE2 HIS 103 2HE HIS 103 5.661 -40.268 14.622 2344 H1 SER 1 H SER 1 -3.872 -17.747 20.367 2345 HA SER 1 HA SER 1 -4.495 -17.896 17.888 2346 HB2 SER 1 2HB SER 1 -1.702 -18.624 18.972 2347 HB3 SER 1 1HB SER 1 -2.095 -17.718 17.459 2348 HG SER 1 1HG SER 1 -1.596 -16.191 18.972 2349 H ALA 2 H ALA 2 -5.086 -19.451 16.428 2350 HA ALA 2 HA ALA 2 -5.463 -22.041 17.349 2351 HB1 ALA 2 1HB ALA 2 -6.866 -20.994 15.557 2352 HB2 ALA 2 2HB ALA 2 -6.204 -22.579 15.016 2353 HB3 ALA 2 3HB ALA 2 -5.471 -21.034 14.428 2354 H ASP 3 H ASP 3 -2.963 -20.727 15.186 2355 HA ASP 3 HA ASP 3 -1.218 -22.968 15.393 2356 HB2 ASP 3 2HB ASP 3 -2.907 -24.179 14.063 2357 HB3 ASP 3 1HB ASP 3 -3.243 -22.741 13.064 2358 H HIS 4 H HIS 4 -1.542 -21.689 12.310 2359 HA HIS 4 HA HIS 4 0.642 -20.224 12.048 2360 HB2 HIS 4 2HB HIS 4 -0.615 -19.062 10.053 2361 HB3 HIS 4 1HB HIS 4 -0.473 -20.839 10.053 2362 HD1 HIS 4 1HD HIS 4 -2.567 -22.261 10.655 2363 HD2 HIS 4 2HD HIS 4 -3.413 -18.130 10.453 2364 HE1 HIS 4 1HE HIS 4 -5.108 -21.994 10.519 2365 HE2 HIS 4 2HE HIS 4 -5.565 -19.483 10.574 2366 H GLU 5 H GLU 5 -2.190 -19.061 13.645 2367 HA GLU 5 HA GLU 5 -1.901 -16.319 13.165 2368 HB2 GLU 5 2HB GLU 5 -3.261 -17.721 15.537 2369 HB3 GLU 5 1HB GLU 5 -3.657 -16.113 14.850 2370 HG2 GLU 5 2HG GLU 5 -4.371 -17.236 12.694 2371 HG3 GLU 5 1HG GLU 5 -4.015 -18.861 13.400 2372 H ARG 6 H ARG 6 -0.347 -18.590 15.397 2373 HA ARG 6 HA ARG 6 0.535 -16.674 17.298 2374 HB2 ARG 6 2HB ARG 6 0.414 -19.204 17.706 2375 HB3 ARG 6 1HB ARG 6 1.720 -19.402 16.500 2376 HG2 ARG 6 2HG ARG 6 3.144 -17.832 18.068 2377 HG3 ARG 6 1HG ARG 6 1.854 -18.041 19.270 2378 HD2 ARG 6 2HD ARG 6 3.843 -19.607 19.603 2379 HD3 ARG 6 1HD ARG 6 2.282 -20.486 19.384 2380 HE ARG 6 HE ARG 6 3.167 -21.464 17.463 2381 HH11 ARG 6 1HH2 ARG 6 5.227 -18.481 18.039 2382 HH12 ARG 6 2HH2 ARG 6 5.912 -18.612 16.442 2383 HH21 ARG 6 1HH1 ARG 6 4.404 -21.724 15.611 2384 HH22 ARG 6 2HH1 ARG 6 5.612 -20.554 15.122 2385 H GLU 7 H GLU 7 1.927 -18.100 14.278 2386 HA GLU 7 HA GLU 7 4.441 -16.883 14.786 2387 HB2 GLU 7 2HB GLU 7 3.837 -19.026 13.295 2388 HB3 GLU 7 1HB GLU 7 3.679 -17.802 11.994 2389 HG2 GLU 7 2HG GLU 7 5.928 -18.639 11.871 2390 HG3 GLU 7 1HG GLU 7 6.103 -17.031 12.663 2391 H ALA 8 H ALA 8 1.516 -15.970 13.028 2392 HA ALA 8 HA ALA 8 2.582 -13.712 11.701 2393 HB1 ALA 8 1HB ALA 8 0.324 -14.633 11.106 2394 HB2 ALA 8 2HB ALA 8 0.181 -12.916 11.633 2395 HB3 ALA 8 3HB ALA 8 -0.278 -14.238 12.763 2396 H GLN 9 H GLN 9 1.102 -14.204 14.909 2397 HA GLN 9 HA GLN 9 1.019 -11.533 15.710 2398 HB2 GLN 9 2HB GLN 9 -0.247 -13.523 16.650 2399 HB3 GLN 9 1HB GLN 9 1.285 -14.126 17.361 2400 HG2 GLN 9 2HG GLN 9 1.356 -12.120 18.876 2401 HG3 GLN 9 1HG GLN 9 -0.143 -11.484 18.088 2402 HE21 GLN 9 1HE2 GLN 9 -1.253 -11.690 20.239 2403 HE22 GLN 9 2HE2 GLN 9 -1.833 -13.249 20.734 2404 H LYS 10 H LYS 10 3.513 -14.081 16.039 2405 HA LYS 10 HA LYS 10 5.297 -12.690 17.680 2406 HB2 LYS 10 2HB LYS 10 5.558 -15.129 17.180 2407 HB3 LYS 10 1HB LYS 10 5.818 -14.755 15.449 2408 HG2 LYS 10 2HG LYS 10 7.940 -13.520 16.028 2409 HG3 LYS 10 1HG LYS 10 7.738 -13.990 17.743 2410 HD2 LYS 10 2HD LYS 10 7.800 -16.006 15.413 2411 HD3 LYS 10 1HD LYS 10 9.320 -15.381 16.110 2412 HE2 LYS 10 2HE LYS 10 7.181 -16.704 17.905 2413 HE3 LYS 10 1HE LYS 10 8.377 -17.687 16.977 2414 HZ1 LYS 10 3HZ LYS 10 10.124 -16.775 18.068 2415 HZ2 LYS 10 1HZ LYS 10 9.013 -17.131 19.289 2416 HZ3 LYS 10 2HZ LYS 10 9.251 -15.497 18.819 2417 H ALA 11 H ALA 11 4.883 -12.761 14.127 2418 HA ALA 11 HA ALA 11 7.173 -11.354 13.472 2419 HB1 ALA 11 1HB ALA 11 5.757 -12.615 11.801 2420 HB2 ALA 11 2HB ALA 11 6.127 -10.937 11.267 2421 HB3 ALA 11 3HB ALA 11 4.500 -11.329 11.936 2422 H GLU 12 H GLU 12 3.905 -10.133 14.368 2423 HA GLU 12 HA GLU 12 4.323 -7.455 13.721 2424 HB2 GLU 12 2HB GLU 12 2.602 -8.654 15.981 2425 HB3 GLU 12 1HB GLU 12 2.666 -6.900 15.616 2426 HG2 GLU 12 2HG GLU 12 1.765 -7.319 13.310 2427 HG3 GLU 12 1HG GLU 12 1.579 -9.066 13.722 2428 H GLU 13 H GLU 13 5.326 -9.325 16.592 2429 HA GLU 13 HA GLU 13 6.012 -7.021 18.103 2430 HB2 GLU 13 2HB GLU 13 5.405 -9.230 19.100 2431 HB3 GLU 13 1HB GLU 13 6.958 -9.916 18.520 2432 HG2 GLU 13 2HG GLU 13 8.248 -8.463 20.024 2433 HG3 GLU 13 1HG GLU 13 6.822 -7.408 20.313 2434 H GLU 14 H GLU 14 7.688 -9.026 15.709 2435 HA GLU 14 HA GLU 14 10.275 -8.178 16.436 2436 HB2 GLU 14 2HB GLU 14 9.643 -10.207 14.880 2437 HB3 GLU 14 1HB GLU 14 9.616 -8.984 13.567 2438 HG2 GLU 14 2HG GLU 14 12.006 -8.299 14.395 2439 HG3 GLU 14 1HG GLU 14 11.948 -9.748 15.466 2440 H LEU 15 H LEU 15 7.739 -6.806 14.367 2441 HA LEU 15 HA LEU 15 9.352 -4.909 13.096 2442 HB2 LEU 15 2HB LEU 15 7.046 -5.471 12.337 2443 HB3 LEU 15 1HB LEU 15 6.362 -4.702 13.802 2444 HG LEU 15 HG LEU 15 7.106 -2.491 13.066 2445 HD11 LEU 15 1HD1 LEU 15 8.235 -2.165 10.796 2446 HD12 LEU 15 2HD1 LEU 15 8.559 -3.936 10.762 2447 HD13 LEU 15 3HD1 LEU 15 9.287 -2.902 12.043 2448 HD21 LEU 15 3HD2 LEU 15 5.776 -2.243 10.960 2449 HD22 LEU 15 1HD2 LEU 15 4.951 -3.305 12.159 2450 HD23 LEU 15 2HD2 LEU 15 5.785 -4.029 10.739 2451 H GLN 16 H GLN 16 7.559 -4.807 16.195 2452 HA GLN 16 HA GLN 16 7.928 -2.133 16.832 2453 HB2 GLN 16 2HB GLN 16 8.015 -4.472 18.844 2454 HB3 GLN 16 1HB GLN 16 7.655 -2.750 19.209 2455 HG2 GLN 16 2HG GLN 16 5.548 -2.966 17.752 2456 HG3 GLN 16 1HG GLN 16 5.906 -4.720 17.588 2457 HE21 GLN 16 1HE2 GLN 16 4.806 -2.153 19.802 2458 HE22 GLN 16 2HE2 GLN 16 4.343 -3.208 21.098 2459 H LYS 17 H LYS 17 10.140 -4.851 17.058 2460 HA LYS 17 HA LYS 17 12.031 -3.672 18.792 2461 HB2 LYS 17 2HB LYS 17 11.619 -6.178 18.259 2462 HB3 LYS 17 1HB LYS 17 12.434 -5.901 16.701 2463 HG2 LYS 17 2HG LYS 17 14.256 -4.938 18.743 2464 HG3 LYS 17 1HG LYS 17 13.513 -6.423 19.385 2465 HD2 LYS 17 2HD LYS 17 15.505 -7.123 18.243 2466 HD3 LYS 17 1HD LYS 17 14.114 -7.664 17.254 2467 HE2 LYS 17 2HE LYS 17 16.035 -6.745 15.875 2468 HE3 LYS 17 1HE LYS 17 14.513 -5.801 15.616 2469 HZ1 LYS 17 3HZ LYS 17 15.307 -4.121 17.083 2470 HZ2 LYS 17 1HZ LYS 17 16.564 -4.398 16.011 2471 HZ3 LYS 17 2HZ LYS 17 16.651 -5.055 17.549 2472 H VAL 18 H VAL 18 11.391 -3.372 15.335 2473 HA VAL 18 HA VAL 18 14.052 -2.455 14.681 2474 HB VAL 18 HB VAL 18 11.463 -2.321 13.036 2475 HG11 VAL 18 1HG1 VAL 18 14.450 -2.021 12.251 2476 HG12 VAL 18 2HG1 VAL 18 13.212 -0.709 12.244 2477 HG13 VAL 18 3HG1 VAL 18 13.064 -2.086 11.102 2478 HG21 VAL 18 3HG2 VAL 18 13.724 -4.444 13.108 2479 HG22 VAL 18 1HG2 VAL 18 12.401 -4.365 11.889 2480 HG23 VAL 18 2HG2 VAL 18 12.008 -4.687 13.604 2481 H LEU 19 H LEU 19 10.759 -1.144 15.280 2482 HA LEU 19 HA LEU 19 11.211 1.512 14.706 2483 HB2 LEU 19 2HB LEU 19 9.376 0.203 16.794 2484 HB3 LEU 19 1HB LEU 19 9.476 1.978 16.622 2485 HG LEU 19 HG LEU 19 8.785 1.845 14.241 2486 HD11 LEU 19 1HD1 LEU 19 8.068 -1.085 14.821 2487 HD12 LEU 19 2HD1 LEU 19 9.306 -0.515 13.634 2488 HD13 LEU 19 3HD1 LEU 19 7.572 -0.131 13.390 2489 HD21 LEU 19 3HD2 LEU 19 6.822 0.656 16.307 2490 HD22 LEU 19 1HD2 LEU 19 6.389 1.527 14.788 2491 HD23 LEU 19 2HD2 LEU 19 7.241 2.400 16.112 2492 H GLU 20 H GLU 20 11.846 -0.256 17.757 2493 HA GLU 20 HA GLU 20 12.575 1.828 19.394 2494 HB2 GLU 20 2HB GLU 20 13.607 -1.046 19.096 2495 HB3 GLU 20 1HB GLU 20 14.301 0.019 20.357 2496 HG2 GLU 20 2HG GLU 20 11.255 -0.297 20.213 2497 HG3 GLU 20 1HG GLU 20 12.275 -1.602 20.931 2498 H GLU 21 H GLU 21 14.665 -0.041 17.165 2499 HA GLU 21 HA GLU 21 16.993 1.472 17.791 2500 HB2 GLU 21 2HB GLU 21 16.322 -0.541 15.574 2501 HB3 GLU 21 1HB GLU 21 17.958 0.177 15.792 2502 HG2 GLU 21 2HG GLU 21 18.216 -0.778 18.011 2503 HG3 GLU 21 1HG GLU 21 16.504 -1.335 18.066 2504 H ALA 22 H ALA 22 14.532 1.469 15.215 2505 HA ALA 22 HA ALA 22 15.640 3.229 13.446 2506 HB1 ALA 22 1HB ALA 22 13.442 2.001 13.075 2507 HB2 ALA 22 2HB ALA 22 13.333 3.758 12.698 2508 HB3 ALA 22 3HB ALA 22 12.653 3.132 14.231 2509 H SER 23 H SER 23 13.670 3.949 16.332 2510 HA SER 23 HA SER 23 13.499 6.692 15.967 2511 HB2 SER 23 2HB SER 23 13.574 5.172 18.660 2512 HB3 SER 23 1HB SER 23 12.817 6.779 18.346 2513 HG SER 23 1HG SER 23 12.057 4.193 17.403 2514 H LYS 24 H LYS 24 15.973 4.703 17.594 2515 HA LYS 24 HA LYS 24 17.364 6.910 18.718 2516 HB2 LYS 24 2HB LYS 24 17.457 4.437 19.476 2517 HB3 LYS 24 1HB LYS 24 18.563 4.135 18.105 2518 HG2 LYS 24 2HG LYS 24 19.019 6.184 20.380 2519 HG3 LYS 24 1HG LYS 24 19.602 4.483 20.417 2520 HD2 LYS 24 2HD LYS 24 20.997 4.878 18.381 2521 HD3 LYS 24 1HD LYS 24 20.519 6.603 18.365 2522 HE2 LYS 24 2HE LYS 24 22.078 5.194 20.625 2523 HE3 LYS 24 1HE LYS 24 22.781 6.288 19.370 2524 HZ1 LYS 24 3HZ LYS 24 20.617 7.253 21.138 2525 HZ2 LYS 24 1HZ LYS 24 21.819 8.144 20.325 2526 HZ3 LYS 24 2HZ LYS 24 22.220 7.163 21.671 2527 H LYS 25 H LYS 25 17.720 4.878 15.756 2528 HA LYS 25 HA LYS 25 20.003 6.221 14.825 2529 HB2 LYS 25 2HB LYS 25 17.838 4.741 13.230 2530 HB3 LYS 25 1HB LYS 25 19.390 5.334 12.541 2531 HG2 LYS 25 2HG LYS 25 20.664 3.822 14.132 2532 HG3 LYS 25 1HG LYS 25 19.122 3.279 14.820 2533 HD2 LYS 25 2HD LYS 25 19.242 1.560 13.400 2534 HD3 LYS 25 1HD LYS 25 18.621 2.696 12.170 2535 HE2 LYS 25 2HE LYS 25 21.562 1.818 12.682 2536 HE3 LYS 25 1HE LYS 25 20.531 1.451 11.244 2537 HZ1 LYS 25 3HZ LYS 25 20.511 4.081 11.147 2538 HZ2 LYS 25 1HZ LYS 25 21.723 3.138 10.438 2539 HZ3 LYS 25 2HZ LYS 25 21.988 3.886 11.973 2540 H ALA 26 H ALA 26 16.502 6.756 14.079 2541 HA ALA 26 HA ALA 26 16.838 8.665 12.137 2542 HB1 ALA 26 1HB ALA 26 14.473 9.339 12.610 2543 HB2 ALA 26 2HB ALA 26 14.522 8.416 14.159 2544 HB3 ALA 26 3HB ALA 26 14.641 7.549 12.586 2545 H VAL 27 H VAL 27 16.452 9.168 15.730 2546 HA VAL 27 HA VAL 27 16.385 11.959 15.370 2547 HB VAL 27 HB VAL 27 15.440 10.813 17.347 2548 HG11 VAL 27 1HG1 VAL 27 16.904 10.252 19.276 2549 HG12 VAL 27 2HG1 VAL 27 18.376 10.617 18.320 2550 HG13 VAL 27 3HG1 VAL 27 17.322 9.231 17.856 2551 HG21 VAL 27 3HG2 VAL 27 17.456 13.091 17.907 2552 HG22 VAL 27 1HG2 VAL 27 16.032 12.653 18.917 2553 HG23 VAL 27 2HG2 VAL 27 15.791 13.272 17.242 2554 H GLU 28 H GLU 28 19.091 9.665 15.861 2555 HA GLU 28 HA GLU 28 20.993 11.764 16.269 2556 HB2 GLU 28 2HB GLU 28 21.437 8.873 15.359 2557 HB3 GLU 28 1HB GLU 28 22.736 9.989 15.907 2558 HG2 GLU 28 2HG GLU 28 20.371 9.129 17.705 2559 HG3 GLU 28 1HG GLU 28 21.891 8.178 17.537 2560 H ALA 29 H ALA 29 19.718 9.941 13.527 2561 HA ALA 29 HA ALA 29 21.622 10.636 11.621 2562 HB1 ALA 29 1HB ALA 29 20.025 8.704 11.418 2563 HB2 ALA 29 2HB ALA 29 19.980 9.759 9.996 2564 HB3 ALA 29 3HB ALA 29 18.663 9.871 11.217 2565 H GLU 30 H GLU 30 18.302 11.966 12.253 2566 HA GLU 30 HA GLU 30 18.499 14.022 10.366 2567 HB2 GLU 30 2HB GLU 30 16.740 13.502 12.785 2568 HB3 GLU 30 1HB GLU 30 16.658 15.105 12.006 2569 HG2 GLU 30 2HG GLU 30 16.378 12.622 10.237 2570 HG3 GLU 30 1HG GLU 30 15.000 13.176 11.247 2571 H ARG 31 H ARG 31 19.614 13.846 13.753 2572 HA ARG 31 HA ARG 31 19.894 16.664 13.917 2573 HB2 ARG 31 2HB ARG 31 19.580 15.206 15.923 2574 HB3 ARG 31 1HB ARG 31 21.200 14.504 15.641 2575 HG2 ARG 31 2HG ARG 31 21.314 16.142 17.418 2576 HG3 ARG 31 1HG ARG 31 22.239 16.749 16.003 2577 HD2 ARG 31 2HD ARG 31 20.224 18.252 15.417 2578 HD3 ARG 31 1HD ARG 31 19.429 17.684 16.936 2579 HE ARG 31 HE ARG 31 21.372 18.579 18.207 2580 HH11 ARG 31 1HH2 ARG 31 20.928 19.978 14.851 2581 HH12 ARG 31 2HH2 ARG 31 22.057 21.223 15.123 2582 HH21 ARG 31 1HH1 ARG 31 22.806 20.323 18.543 2583 HH22 ARG 31 2HH1 ARG 31 23.129 21.476 17.317 2584 H GLY 32 H GLY 32 21.167 17.601 12.371 2585 HA2 GLY 32 2HA GLY 32 23.553 18.295 12.357 2586 HA3 GLY 32 1HA GLY 32 23.886 16.554 11.972 2587 H ALA 33 H ALA 33 21.073 16.559 10.591 2588 HA ALA 33 HA ALA 33 22.258 17.001 8.058 2589 HB1 ALA 33 1HB ALA 33 20.022 16.211 7.143 2590 HB2 ALA 33 2HB ALA 33 19.417 16.140 8.836 2591 HB3 ALA 33 3HB ALA 33 20.761 15.072 8.333 2592 HA PRO 34 HA PRO 34 20.484 21.111 7.687 2593 HB2 PRO 34 2HB PRO 34 20.876 21.644 4.991 2594 HB3 PRO 34 1HB PRO 34 22.276 21.461 6.122 2595 HG2 PRO 34 2HG PRO 34 21.073 19.312 4.290 2596 HG3 PRO 34 1HG PRO 34 22.807 19.799 4.434 2597 HD2 PRO 34 2HD PRO 34 21.711 17.645 5.824 2598 HD3 PRO 34 1HD PRO 34 23.009 18.683 6.573 2599 H GLY 35 H GLY 35 18.331 21.929 7.324 2600 HA2 GLY 35 2HA GLY 35 16.372 22.125 6.241 2601 HA3 GLY 35 1HA GLY 35 16.810 20.761 5.147 2602 H ALA 36 H ALA 36 17.557 19.533 7.994 2603 HA ALA 36 HA ALA 36 15.550 17.685 8.132 2604 HB1 ALA 36 1HB ALA 36 17.522 18.628 10.321 2605 HB2 ALA 36 2HB ALA 36 17.786 17.311 9.118 2606 HB3 ALA 36 3HB ALA 36 16.557 17.106 10.392 2607 H ALA 37 H ALA 37 14.012 17.223 9.783 2608 HA ALA 37 HA ALA 37 12.834 19.666 11.004 2609 HB1 ALA 37 1HB ALA 37 10.565 18.926 10.210 2610 HB2 ALA 37 2HB ALA 37 11.338 17.558 9.309 2611 HB3 ALA 37 3HB ALA 37 11.659 19.257 8.820 2612 H LEU 38 H LEU 38 13.403 16.102 11.069 2613 HA LEU 38 HA LEU 38 11.570 15.914 13.362 2614 HB2 LEU 38 2HB LEU 38 11.402 14.072 11.739 2615 HB3 LEU 38 1HB LEU 38 13.151 13.774 11.881 2616 HG LEU 38 HG LEU 38 12.928 13.044 14.209 2617 HD11 LEU 38 1HD1 LEU 38 10.727 12.739 15.347 2618 HD12 LEU 38 2HD1 LEU 38 9.893 13.614 14.019 2619 HD13 LEU 38 3HD1 LEU 38 11.079 14.473 15.068 2620 HD21 LEU 38 3HD2 LEU 38 11.641 10.952 13.844 2621 HD22 LEU 38 1HD2 LEU 38 12.622 11.387 12.398 2622 HD23 LEU 38 2HD2 LEU 38 10.847 11.678 12.396 2623 H ILE 39 H ILE 39 12.712 17.178 14.898 2624 HA ILE 39 HA ILE 39 15.404 16.160 15.553 2625 HB ILE 39 HB ILE 39 15.440 18.267 14.378 2626 HG12 ILE 39 2HG1 ILE 39 16.218 18.639 17.332 2627 HG13 ILE 39 1HG1 ILE 39 17.149 17.737 16.092 2628 HG21 ILE 39 1HG2 ILE 39 13.659 19.414 16.628 2629 HG22 ILE 39 2HG2 ILE 39 13.177 19.130 14.916 2630 HG23 ILE 39 3HG2 ILE 39 14.427 20.344 15.294 2631 HD11 ILE 39 3HD ILE 39 16.481 20.763 16.010 2632 HD12 ILE 39 1HD ILE 39 18.082 20.024 16.362 2633 HD13 ILE 39 2HD ILE 39 17.350 19.856 14.723 2634 H SER 40 H SER 40 13.458 14.656 16.765 2635 HA SER 40 HA SER 40 13.723 15.604 19.461 2636 HB2 SER 40 2HB SER 40 11.594 16.760 18.616 2637 HB3 SER 40 1HB SER 40 10.942 15.143 18.203 2638 HG SER 40 1HG SER 40 10.134 15.729 20.080 2639 H TYR 41 H TYR 41 13.668 13.885 20.895 2640 HA TYR 41 HA TYR 41 13.761 11.268 19.673 2641 HB2 TYR 41 2HB TYR 41 15.519 11.678 21.347 2642 HB3 TYR 41 1HB TYR 41 14.278 12.004 22.608 2643 HD1 TYR 41 1HD TYR 41 15.008 9.277 20.011 2644 HD2 TYR 41 2HD TYR 41 13.829 10.229 24.042 2645 HE1 TYR 41 1HE TYR 41 14.851 6.877 20.532 2646 HE2 TYR 41 2HE TYR 41 13.664 7.827 24.553 2647 HH TYR 41 HH TYR 41 14.068 5.250 22.154 2648 HA PRO 42 HA PRO 42 10.103 10.380 22.372 2649 HB2 PRO 42 2HB PRO 42 8.296 12.487 23.132 2650 HB3 PRO 42 1HB PRO 42 9.556 11.746 24.193 2651 HG2 PRO 42 2HG PRO 42 9.763 14.277 22.491 2652 HG3 PRO 42 1HG PRO 42 10.291 14.031 24.207 2653 HD2 PRO 42 2HD PRO 42 12.092 13.914 22.167 2654 HD3 PRO 42 1HD PRO 42 12.191 12.666 23.492 2655 H ASP 43 H ASP 43 10.078 12.803 19.881 2656 HA ASP 43 HA ASP 43 7.466 11.918 18.936 2657 HB2 ASP 43 2HB ASP 43 9.278 13.975 17.580 2658 HB3 ASP 43 1HB ASP 43 7.531 13.661 17.300 2659 H ALA 44 H ALA 44 10.798 11.063 18.653 2660 HA ALA 44 HA ALA 44 10.837 10.350 15.908 2661 HB1 ALA 44 1HB ALA 44 12.996 10.651 17.142 2662 HB2 ALA 44 2HB ALA 44 12.873 8.999 16.457 2663 HB3 ALA 44 3HB ALA 44 12.579 9.266 18.218 2664 H ILE 45 H ILE 45 10.048 8.668 18.963 2665 HA ILE 45 HA ILE 45 9.710 6.154 17.728 2666 HB ILE 45 HB ILE 45 10.286 6.295 20.033 2667 HG12 ILE 45 2HG1 ILE 45 7.467 5.084 19.767 2668 HG13 ILE 45 1HG1 ILE 45 8.989 4.332 19.188 2669 HG21 ILE 45 1HG2 ILE 45 7.563 7.691 20.492 2670 HG22 ILE 45 2HG2 ILE 45 9.196 8.442 20.633 2671 HG23 ILE 45 3HG2 ILE 45 8.707 7.157 21.771 2672 HD11 ILE 45 3HD ILE 45 8.317 5.015 22.132 2673 HD12 ILE 45 1HD ILE 45 8.373 3.381 21.384 2674 HD13 ILE 45 2HD ILE 45 9.888 4.341 21.553 2675 H TRP 46 H TRP 46 7.631 8.935 18.030 2676 HA TRP 46 HA TRP 46 5.189 7.602 17.431 2677 HB2 TRP 46 2HB TRP 46 6.006 10.216 18.212 2678 HB3 TRP 46 1HB TRP 46 5.410 10.479 16.557 2679 HD1 TRP 46 HD TRP 46 2.837 11.167 16.646 2680 HE1 TRP 46 1HE TRP 46 0.989 11.037 18.404 2681 HE3 TRP 46 3HE TRP 46 5.252 8.204 20.029 2682 HZ2 TRP 46 2HZ TRP 46 0.578 9.736 20.932 2683 HZ3 TRP 46 3HZ TRP 46 4.075 7.516 22.091 2684 HH2 TRP 46 HH TRP 46 1.759 8.254 22.529 2685 H TRP 47 H TRP 47 7.647 9.450 15.558 2686 HA TRP 47 HA TRP 47 6.364 9.119 13.090 2687 HB2 TRP 47 2HB TRP 47 8.077 10.896 13.501 2688 HB3 TRP 47 1HB TRP 47 9.348 9.629 13.624 2689 HD1 TRP 47 HD TRP 47 6.661 10.744 10.918 2690 HE1 TRP 47 1HE TRP 47 7.527 9.904 8.656 2691 HE3 TRP 47 3HE TRP 47 11.097 8.703 12.384 2692 HZ2 TRP 47 2HZ TRP 47 10.014 9.106 7.519 2693 HZ3 TRP 47 3HZ TRP 47 12.671 7.875 10.664 2694 HH2 TRP 47 HH TRP 47 12.135 8.076 8.259 2695 H SER 48 H SER 48 8.786 7.082 14.814 2696 HA SER 48 HA SER 48 9.386 5.399 12.756 2697 HB2 SER 48 2HB SER 48 9.079 4.732 15.728 2698 HB3 SER 48 1HB SER 48 9.853 3.652 14.501 2699 HG SER 48 1HG SER 48 11.080 5.438 15.835 2700 H VAL 49 H VAL 49 6.249 5.607 14.437 2701 HA VAL 49 HA VAL 49 5.463 3.036 13.371 2702 HB VAL 49 HB VAL 49 3.359 4.903 14.435 2703 HG11 VAL 49 1HG1 VAL 49 2.651 2.666 15.410 2704 HG12 VAL 49 2HG1 VAL 49 4.086 1.889 14.667 2705 HG13 VAL 49 3HG1 VAL 49 2.812 2.614 13.615 2706 HG21 VAL 49 3HG2 VAL 49 3.918 4.246 16.780 2707 HG22 VAL 49 1HG2 VAL 49 5.131 5.353 16.085 2708 HG23 VAL 49 2HG2 VAL 49 5.507 3.598 16.237 2709 H GLU 50 H GLU 50 4.960 6.487 12.735 2710 HA GLU 50 HA GLU 50 3.051 6.450 10.739 2711 HB2 GLU 50 2HB GLU 50 3.929 8.476 11.989 2712 HB3 GLU 50 1HB GLU 50 5.508 8.262 11.168 2713 HG2 GLU 50 2HG GLU 50 4.484 10.110 10.126 2714 HG3 GLU 50 1HG GLU 50 4.367 8.770 8.939 2715 H THR 51 H THR 51 6.498 5.694 10.635 2716 HA THR 51 HA THR 51 6.484 5.670 7.723 2717 HB THR 51 HB THR 51 8.213 6.885 9.062 2718 HG1 THR 51 1HG THR 51 8.752 6.438 7.017 2719 HG21 THR 51 3HG2 THR 51 10.062 5.652 10.089 2720 HG22 THR 51 1HG2 THR 51 9.339 4.059 9.651 2721 HG23 THR 51 2HG2 THR 51 8.523 5.128 10.850 2722 H ALA 52 H ALA 52 6.714 3.343 10.473 2723 HA ALA 52 HA ALA 52 7.730 1.275 8.854 2724 HB1 ALA 52 1HB ALA 52 8.054 1.287 11.326 2725 HB2 ALA 52 2HB ALA 52 7.224 -0.220 10.802 2726 HB3 ALA 52 3HB ALA 52 6.275 1.112 11.565 2727 H THR 53 H THR 53 4.529 2.525 9.117 2728 HA THR 53 HA THR 53 3.383 -0.018 8.195 2729 HB THR 53 HB THR 53 1.205 1.336 8.500 2730 HG1 THR 53 1HG THR 53 2.919 2.864 10.240 2731 HG21 THR 53 3HG2 THR 53 1.166 0.737 10.918 2732 HG22 THR 53 1HG2 THR 53 2.968 0.598 10.947 2733 HG23 THR 53 2HG2 THR 53 1.985 -0.545 9.962 2734 H THR 54 H THR 54 5.068 2.448 6.901 2735 HA THR 54 HA THR 54 5.232 3.507 5.070 2736 HB THR 54 HB THR 54 4.833 2.274 2.934 2737 HG1 THR 54 1HG THR 54 3.042 1.098 3.561 2738 HG21 THR 54 3HG2 THR 54 6.133 0.669 5.261 2739 HG22 THR 54 1HG2 THR 54 6.890 2.073 4.427 2740 HG23 THR 54 2HG2 THR 54 6.537 0.563 3.511 2741 H VAL 55 H VAL 55 2.889 4.212 6.598 2742 HA VAL 55 HA VAL 55 0.860 4.745 4.650 2743 HB VAL 55 HB VAL 55 -0.290 5.922 6.538 2744 HG11 VAL 55 1HG1 VAL 55 -0.663 3.527 5.893 2745 HG12 VAL 55 2HG1 VAL 55 -0.798 3.748 7.681 2746 HG13 VAL 55 3HG1 VAL 55 0.675 3.011 6.976 2747 HG21 VAL 55 3HG2 VAL 55 1.579 6.623 8.002 2748 HG22 VAL 55 1HG2 VAL 55 2.178 4.925 8.149 2749 HG23 VAL 55 2HG2 VAL 55 0.627 5.400 8.879 2750 H GLY 56 H GLY 56 3.095 6.745 6.674 2751 HA2 GLY 56 2HA GLY 56 4.216 8.576 6.131 2752 HA3 GLY 56 1HA GLY 56 3.957 8.102 4.402 2753 H TYR 57 H TYR 57 1.951 9.535 7.146 2754 HA TYR 57 HA TYR 57 0.298 10.758 5.245 2755 HB2 TYR 57 2HB TYR 57 -0.285 10.161 7.692 2756 HB3 TYR 57 1HB TYR 57 0.593 11.645 8.189 2757 HD1 TYR 57 2HD TYR 57 -0.247 13.870 7.371 2758 HD2 TYR 57 1HD TYR 57 -2.524 10.287 6.713 2759 HE1 TYR 57 2HE TYR 57 -2.092 15.206 6.560 2760 HE2 TYR 57 1HE TYR 57 -4.476 11.652 6.054 2761 HH TYR 57 HH TYR 57 -4.972 13.933 5.046 2762 H GLY 58 H GLY 58 3.411 11.582 6.258 2763 HA2 GLY 58 2HA GLY 58 4.697 13.207 5.267 2764 HA3 GLY 58 1HA GLY 58 3.219 14.173 4.870 2765 H ASP 59 H ASP 59 4.010 12.654 7.994 2766 HA ASP 59 HA ASP 59 3.692 15.109 9.386 2767 HB2 ASP 59 2HB ASP 59 3.399 12.732 10.412 2768 HB3 ASP 59 1HB ASP 59 5.176 12.656 10.549 2769 H ARG 60 H ARG 60 6.564 13.012 8.550 2770 HA ARG 60 HA ARG 60 8.218 15.407 8.811 2771 HB2 ARG 60 2HB ARG 60 9.051 12.608 9.776 2772 HB3 ARG 60 1HB ARG 60 10.066 14.087 9.819 2773 HG2 ARG 60 2HG ARG 60 7.450 13.627 11.377 2774 HG3 ARG 60 1HG ARG 60 9.096 13.436 12.053 2775 HD2 ARG 60 2HD ARG 60 9.563 15.831 11.903 2776 HD3 ARG 60 1HD ARG 60 8.099 16.139 10.883 2777 HE ARG 60 HE ARG 60 6.714 15.245 12.778 2778 HH11 ARG 60 1HH2 ARG 60 9.766 17.179 13.353 2779 HH12 ARG 60 2HH2 ARG 60 9.326 17.663 14.929 2780 HH21 ARG 60 1HH1 ARG 60 6.042 16.233 14.813 2781 HH22 ARG 60 2HH1 ARG 60 7.174 16.980 15.871 2782 H TYR 61 H TYR 61 10.436 14.928 7.711 2783 HA TYR 61 HA TYR 61 10.224 13.048 5.589 2784 HB2 TYR 61 2HB TYR 61 11.158 14.889 3.976 2785 HB3 TYR 61 1HB TYR 61 9.386 14.889 4.275 2786 HD1 TYR 61 1HD TYR 61 8.327 16.634 5.659 2787 HD2 TYR 61 2HD TYR 61 12.549 16.714 4.849 2788 HE1 TYR 61 1HE TYR 61 8.432 18.946 6.484 2789 HE2 TYR 61 2HE TYR 61 12.679 19.012 5.691 2790 HH TYR 61 HH TYR 61 11.575 20.690 6.748 2791 HA PRO 62 HA PRO 62 14.421 13.571 7.342 2792 HB2 PRO 62 2HB PRO 62 15.639 11.316 6.249 2793 HB3 PRO 62 1HB PRO 62 14.425 11.175 7.571 2794 HG2 PRO 62 2HG PRO 62 14.001 10.833 4.555 2795 HG3 PRO 62 1HG PRO 62 13.435 9.748 5.885 2796 HD2 PRO 62 2HD PRO 62 11.834 11.735 4.711 2797 HD3 PRO 62 1HD PRO 62 11.646 11.229 6.454 2798 H VAL 63 H VAL 63 16.729 13.623 6.154 2799 HA VAL 63 HA VAL 63 16.286 14.892 3.544 2800 HB VAL 63 HB VAL 63 18.683 15.464 5.311 2801 HG11 VAL 63 1HG1 VAL 63 18.708 16.164 2.803 2802 HG12 VAL 63 2HG1 VAL 63 18.649 17.570 3.923 2803 HG13 VAL 63 3HG1 VAL 63 17.154 17.022 3.089 2804 HG21 VAL 63 3HG2 VAL 63 16.714 15.932 6.704 2805 HG22 VAL 63 1HG2 VAL 63 15.869 16.726 5.326 2806 HG23 VAL 63 2HG2 VAL 63 17.335 17.472 6.053 2807 H THR 64 H THR 64 19.560 14.486 4.035 2808 HA THR 64 HA THR 64 19.671 12.065 2.353 2809 HB THR 64 HB THR 64 21.365 14.640 2.091 2810 HG1 THR 64 1HG THR 64 20.135 15.059 0.278 2811 HG21 THR 64 3HG2 THR 64 21.041 12.286 0.100 2812 HG22 THR 64 1HG2 THR 64 22.452 12.519 1.188 2813 HG23 THR 64 2HG2 THR 64 22.098 13.724 -0.089 2814 H GLU 65 H GLU 65 21.137 14.260 4.683 2815 HA GLU 65 HA GLU 65 23.630 12.911 4.788 2816 HB2 GLU 65 2HB GLU 65 23.046 15.442 4.893 2817 HB3 GLU 65 1HB GLU 65 22.565 15.181 6.597 2818 HG2 GLU 65 2HG GLU 65 24.854 14.689 7.256 2819 HG3 GLU 65 1HG GLU 65 25.348 14.395 5.553 2820 H GLU 66 H GLU 66 20.546 12.479 6.176 2821 HA GLU 66 HA GLU 66 21.368 11.576 8.756 2822 HB2 GLU 66 2HB GLU 66 18.818 10.718 8.610 2823 HB3 GLU 66 1HB GLU 66 19.248 12.426 8.937 2824 HG2 GLU 66 2HG GLU 66 17.416 12.362 7.405 2825 HG3 GLU 66 1HG GLU 66 18.841 13.041 6.545 2826 H GLY 67 H GLY 67 20.582 10.345 5.573 2827 HA2 GLY 67 2HA GLY 67 22.007 8.817 4.550 2828 HA3 GLY 67 1HA GLY 67 22.217 7.953 6.143 2829 H ARG 68 H ARG 68 19.514 9.328 4.274 2830 HA ARG 68 HA ARG 68 17.410 8.344 4.836 2831 HB2 ARG 68 2HB ARG 68 17.836 9.717 2.859 2832 HB3 ARG 68 1HB ARG 68 18.221 8.239 1.904 2833 HG2 ARG 68 2HG ARG 68 15.892 7.430 2.164 2834 HG3 ARG 68 1HG ARG 68 15.495 8.769 3.280 2835 HD2 ARG 68 2HD ARG 68 16.383 9.167 0.342 2836 HD3 ARG 68 1HD ARG 68 14.672 9.037 0.843 2837 HE ARG 68 HE ARG 68 16.587 11.183 1.836 2838 HH11 ARG 68 1HH2 ARG 68 13.208 9.983 1.986 2839 HH12 ARG 68 2HH2 ARG 68 12.522 11.544 2.011 2840 HH21 ARG 68 1HH1 ARG 68 15.700 13.235 1.963 2841 HH22 ARG 68 2HH1 ARG 68 14.126 13.455 2.428 2842 H LYS 69 H LYS 69 19.694 6.003 3.921 2843 HA LYS 69 HA LYS 69 17.994 3.797 3.580 2844 HB2 LYS 69 2HB LYS 69 20.747 3.932 4.890 2845 HB3 LYS 69 1HB LYS 69 19.859 2.415 4.497 2846 HG2 LYS 69 2HG LYS 69 19.865 2.990 2.071 2847 HG3 LYS 69 1HG LYS 69 20.761 4.509 2.432 2848 HD2 LYS 69 2HD LYS 69 22.540 3.093 3.565 2849 HD3 LYS 69 1HD LYS 69 21.736 1.615 2.924 2850 HE2 LYS 69 2HE LYS 69 22.234 2.254 0.594 2851 HE3 LYS 69 1HE LYS 69 22.656 3.941 1.105 2852 HZ1 LYS 69 3HZ LYS 69 24.662 3.012 0.841 2853 HZ2 LYS 69 1HZ LYS 69 24.251 1.465 1.512 2854 HZ3 LYS 69 2HZ LYS 69 24.440 2.841 2.498 2855 H VAL 70 H VAL 70 18.688 5.847 6.364 2856 HA VAL 70 HA VAL 70 17.945 4.059 8.397 2857 HB VAL 70 HB VAL 70 17.703 7.106 8.250 2858 HG11 VAL 70 1HG1 VAL 70 17.569 6.955 10.786 2859 HG12 VAL 70 2HG1 VAL 70 17.342 5.168 10.650 2860 HG13 VAL 70 3HG1 VAL 70 16.113 6.298 9.975 2861 HG21 VAL 70 3HG2 VAL 70 19.771 6.983 9.702 2862 HG22 VAL 70 1HG2 VAL 70 20.056 6.241 8.103 2863 HG23 VAL 70 2HG2 VAL 70 19.780 5.183 9.524 2864 H ALA 71 H ALA 71 15.995 6.199 6.246 2865 HA ALA 71 HA ALA 71 13.527 5.419 7.478 2866 HB1 ALA 71 1HB ALA 71 14.063 6.713 4.715 2867 HB2 ALA 71 2HB ALA 71 13.680 7.593 6.235 2868 HB3 ALA 71 3HB ALA 71 12.453 6.512 5.488 2869 H GLU 72 H GLU 72 15.175 4.718 4.362 2870 HA GLU 72 HA GLU 72 13.563 3.041 3.087 2871 HB2 GLU 72 2HB GLU 72 15.917 3.587 2.273 2872 HB3 GLU 72 1HB GLU 72 16.544 2.468 3.515 2873 HG2 GLU 72 2HG GLU 72 14.893 0.718 2.103 2874 HG3 GLU 72 1HG GLU 72 15.368 1.855 0.808 2875 H GLN 73 H GLN 73 15.956 1.872 5.477 2876 HA GLN 73 HA GLN 73 15.221 -0.804 5.105 2877 HB2 GLN 73 2HB GLN 73 17.481 0.079 5.891 2878 HB3 GLN 73 1HB GLN 73 16.736 0.407 7.495 2879 HG2 GLN 73 2HG GLN 73 16.200 -2.088 7.683 2880 HG3 GLN 73 1HG GLN 73 17.012 -2.339 6.090 2881 HE21 GLN 73 1HE2 GLN 73 17.881 -3.643 8.458 2882 HE22 GLN 73 2HE2 GLN 73 19.438 -3.029 8.938 2883 H VAL 74 H VAL 74 14.118 1.712 7.379 2884 HA VAL 74 HA VAL 74 12.964 -0.167 9.212 2885 HB VAL 74 HB VAL 74 12.746 2.864 8.919 2886 HG11 VAL 74 1HG1 VAL 74 11.726 2.816 11.225 2887 HG12 VAL 74 2HG1 VAL 74 11.651 1.013 11.160 2888 HG13 VAL 74 3HG1 VAL 74 10.665 2.012 10.030 2889 HG21 VAL 74 3HG2 VAL 74 14.309 2.857 10.839 2890 HG22 VAL 74 1HG2 VAL 74 15.020 1.857 9.542 2891 HG23 VAL 74 2HG2 VAL 74 14.243 1.053 10.952 2892 H MET 75 H MET 75 11.830 1.955 6.546 2893 HA MET 75 HA MET 75 9.110 1.338 6.753 2894 HB2 MET 75 2HB MET 75 10.849 1.981 4.299 2895 HB3 MET 75 1HB MET 75 9.051 1.938 4.269 2896 HG2 MET 75 2HG MET 75 8.969 3.702 6.019 2897 HG3 MET 75 1HG MET 75 10.737 3.831 6.028 2898 HE1 MET 75 3HE MET 75 11.170 4.998 2.062 2899 HE2 MET 75 1HE MET 75 11.188 3.331 2.704 2900 HE3 MET 75 2HE MET 75 12.135 4.641 3.514 2901 H LYS 76 H LYS 76 11.734 -0.201 4.775 2902 HA LYS 76 HA LYS 76 9.941 -2.012 3.607 2903 HB2 LYS 76 2HB LYS 76 12.401 -1.388 2.814 2904 HB3 LYS 76 1HB LYS 76 12.883 -2.757 3.860 2905 HG2 LYS 76 2HG LYS 76 10.760 -3.883 2.430 2906 HG3 LYS 76 1HG LYS 76 11.366 -2.697 1.231 2907 HD2 LYS 76 2HD LYS 76 13.681 -3.799 1.461 2908 HD3 LYS 76 1HD LYS 76 12.937 -4.958 2.626 2909 HE2 LYS 76 2HE LYS 76 11.262 -5.601 0.739 2910 HE3 LYS 76 1HE LYS 76 12.320 -4.677 -0.401 2911 HZ1 LYS 76 3HZ LYS 76 12.888 -6.985 -0.459 2912 HZ2 LYS 76 1HZ LYS 76 12.993 -7.055 1.259 2913 HZ3 LYS 76 2HZ LYS 76 14.152 -6.197 0.338 2914 H ALA 77 H ALA 77 11.669 -2.097 6.674 2915 HA ALA 77 HA ALA 77 11.543 -4.857 7.147 2916 HB1 ALA 77 1HB ALA 77 11.701 -4.265 9.592 2917 HB2 ALA 77 2HB ALA 77 11.370 -2.545 9.188 2918 HB3 ALA 77 3HB ALA 77 12.893 -3.320 8.622 2919 H GLY 78 H GLY 78 9.143 -2.240 7.530 2920 HA2 GLY 78 2HA GLY 78 7.273 -3.759 9.012 2921 HA3 GLY 78 1HA GLY 78 6.993 -2.269 8.031 2922 H ILE 79 H ILE 79 7.708 -3.104 5.535 2923 HA ILE 79 HA ILE 79 5.406 -4.337 4.649 2924 HB ILE 79 HB ILE 79 8.098 -4.228 3.188 2925 HG12 ILE 79 2HG1 ILE 79 5.796 -2.166 3.285 2926 HG13 ILE 79 1HG1 ILE 79 7.412 -1.966 4.020 2927 HG21 ILE 79 1HG2 ILE 79 5.197 -4.427 2.114 2928 HG22 ILE 79 2HG2 ILE 79 6.394 -5.772 2.116 2929 HG23 ILE 79 3HG2 ILE 79 6.686 -4.327 1.107 2930 HD11 ILE 79 3HD ILE 79 6.794 -2.151 1.003 2931 HD12 ILE 79 1HD ILE 79 7.374 -0.727 1.920 2932 HD13 ILE 79 2HD ILE 79 8.461 -2.148 1.699 2933 H GLU 80 H GLU 80 8.708 -5.758 5.172 2934 HA GLU 80 HA GLU 80 7.897 -8.259 4.134 2935 HB2 GLU 80 2HB GLU 80 10.305 -7.714 5.944 2936 HB3 GLU 80 1HB GLU 80 9.955 -9.226 5.042 2937 HG2 GLU 80 2HG GLU 80 9.923 -7.774 2.878 2938 HG3 GLU 80 1HG GLU 80 10.638 -6.453 3.874 2939 H VAL 81 H VAL 81 7.693 -6.885 7.400 2940 HA VAL 81 HA VAL 81 7.170 -9.320 8.730 2941 HB VAL 81 HB VAL 81 6.622 -6.384 9.317 2942 HG11 VAL 81 1HG1 VAL 81 4.683 -7.461 10.362 2943 HG12 VAL 81 2HG1 VAL 81 5.883 -7.132 11.650 2944 HG13 VAL 81 3HG1 VAL 81 5.706 -8.799 11.008 2945 HG21 VAL 81 3HG2 VAL 81 8.334 -6.802 11.078 2946 HG22 VAL 81 1HG2 VAL 81 8.969 -7.357 9.492 2947 HG23 VAL 81 2HG2 VAL 81 8.359 -8.558 10.686 2948 H PHE 82 H PHE 82 4.965 -6.802 7.325 2949 HA PHE 82 HA PHE 82 2.667 -8.302 8.002 2950 HB2 PHE 82 2HB PHE 82 2.977 -6.115 5.845 2951 HB3 PHE 82 1HB PHE 82 1.405 -6.741 6.479 2952 HD1 PHE 82 1HD PHE 82 1.632 -6.864 9.351 2953 HD2 PHE 82 2HD PHE 82 3.349 -3.967 6.662 2954 HE1 PHE 82 1HE PHE 82 1.742 -5.221 11.182 2955 HE2 PHE 82 2HE PHE 82 3.460 -2.338 8.489 2956 HZ PHE 82 HZ PHE 82 2.657 -2.946 10.765 2957 H ALA 83 H ALA 83 4.750 -8.272 5.127 2958 HA ALA 83 HA ALA 83 3.073 -9.746 3.459 2959 HB1 ALA 83 1HB ALA 83 5.174 -8.622 2.647 2960 HB2 ALA 83 2HB ALA 83 5.144 -10.364 2.192 2961 HB3 ALA 83 3HB ALA 83 6.156 -9.810 3.581 2962 H LEU 84 H LEU 84 5.266 -10.778 6.068 2963 HA LEU 84 HA LEU 84 5.321 -13.514 5.450 2964 HB2 LEU 84 2HB LEU 84 6.872 -12.189 6.963 2965 HB3 LEU 84 1HB LEU 84 5.607 -12.176 8.218 2966 HG LEU 84 HG LEU 84 6.652 -14.813 7.042 2967 HD11 LEU 84 1HD1 LEU 84 8.447 -14.877 8.759 2968 HD12 LEU 84 2HD1 LEU 84 7.997 -13.221 9.320 2969 HD13 LEU 84 3HD1 LEU 84 8.664 -13.463 7.664 2970 HD21 LEU 84 3HD2 LEU 84 5.567 -14.080 9.851 2971 HD22 LEU 84 1HD2 LEU 84 6.192 -15.696 9.362 2972 HD23 LEU 84 2HD2 LEU 84 4.708 -15.047 8.598 2973 H VAL 85 H VAL 85 3.074 -11.477 7.290 2974 HA VAL 85 HA VAL 85 1.626 -13.475 8.576 2975 HB VAL 85 HB VAL 85 0.773 -10.676 7.681 2976 HG11 VAL 85 1HG1 VAL 85 -0.580 -12.628 9.651 2977 HG12 VAL 85 2HG1 VAL 85 -1.282 -11.890 8.168 2978 HG13 VAL 85 3HG1 VAL 85 -0.909 -10.855 9.583 2979 HG21 VAL 85 3HG2 VAL 85 1.356 -10.079 10.062 2980 HG22 VAL 85 1HG2 VAL 85 2.786 -10.683 9.174 2981 HG23 VAL 85 2HG2 VAL 85 1.944 -11.754 10.343 2982 H THR 86 H THR 86 1.705 -12.583 5.203 2983 HA THR 86 HA THR 86 -0.846 -13.241 4.480 2984 HB THR 86 HB THR 86 1.541 -13.746 2.682 2985 HG1 THR 86 1HG THR 86 1.936 -11.799 3.321 2986 HG21 THR 86 3HG2 THR 86 -0.083 -12.876 0.937 2987 HG22 THR 86 1HG2 THR 86 -1.363 -12.744 2.192 2988 HG23 THR 86 2HG2 THR 86 -0.716 -14.362 1.721 2989 H ALA 87 H ALA 87 1.657 -15.514 5.529 2990 HA ALA 87 HA ALA 87 0.595 -17.772 4.196 2991 HB1 ALA 87 1HB ALA 87 1.981 -17.632 6.947 2992 HB2 ALA 87 2HB ALA 87 2.801 -17.839 5.358 2993 HB3 ALA 87 3HB ALA 87 1.716 -19.132 5.971 2994 H ALA 88 H ALA 88 -0.437 -15.972 7.063 2995 HA ALA 88 HA ALA 88 -2.259 -18.022 7.980 2996 HB1 ALA 88 1HB ALA 88 -3.000 -16.262 9.635 2997 HB2 ALA 88 2HB ALA 88 -1.949 -15.063 8.807 2998 HB3 ALA 88 3HB ALA 88 -1.202 -16.459 9.666 2999 H LEU 89 H LEU 89 -2.225 -15.420 5.666 3000 HA LEU 89 HA LEU 89 -5.138 -15.255 5.566 3001 HB2 LEU 89 2HB LEU 89 -3.005 -13.969 3.754 3002 HB3 LEU 89 1HB LEU 89 -4.766 -13.625 3.728 3003 HG LEU 89 HG LEU 89 -2.892 -13.065 6.116 3004 HD11 LEU 89 1HD1 LEU 89 -2.316 -11.621 4.160 3005 HD12 LEU 89 2HD1 LEU 89 -3.075 -10.666 5.480 3006 HD13 LEU 89 3HD1 LEU 89 -4.035 -11.110 4.021 3007 HD21 LEU 89 3HD2 LEU 89 -4.794 -11.681 6.991 3008 HD22 LEU 89 1HD2 LEU 89 -5.262 -13.414 6.842 3009 HD23 LEU 89 2HD2 LEU 89 -5.824 -12.221 5.617 3010 H ALA 90 H ALA 90 -2.367 -16.748 3.967 3011 HA ALA 90 HA ALA 90 -3.746 -17.384 1.607 3012 HB1 ALA 90 1HB ALA 90 -1.154 -18.632 2.705 3013 HB2 ALA 90 2HB ALA 90 -1.252 -17.134 1.711 3014 HB3 ALA 90 3HB ALA 90 -1.751 -18.707 1.001 3015 H THR 91 H THR 91 -3.337 -19.038 4.685 3016 HA THR 91 HA THR 91 -4.170 -21.565 3.717 3017 HB THR 91 HB THR 91 -2.919 -21.229 5.828 3018 HG1 THR 91 1HG THR 91 -5.391 -22.566 5.884 3019 HG21 THR 91 3HG2 THR 91 -4.094 -19.180 6.632 3020 HG22 THR 91 1HG2 THR 91 -4.065 -20.472 7.873 3021 HG23 THR 91 2HG2 THR 91 -5.582 -20.122 6.966 3022 H ASP 92 H ASP 92 -5.891 -18.553 4.034 3023 HA ASP 92 HA ASP 92 -8.339 -19.678 4.833 3024 HB2 ASP 92 2HB ASP 92 -7.776 -16.924 3.657 3025 HB3 ASP 92 1HB ASP 92 -9.399 -17.502 4.187 3026 H PHE 93 H PHE 93 -6.708 -19.482 1.801 3027 HA PHE 93 HA PHE 93 -8.905 -19.648 0.076 3028 HB2 PHE 93 2HB PHE 93 -6.234 -21.152 -0.327 3029 HB3 PHE 93 1HB PHE 93 -7.335 -20.538 -1.613 3030 HD1 PHE 93 2HD PHE 93 -7.418 -17.606 0.124 3031 HD2 PHE 93 1HD PHE 93 -4.448 -20.224 -1.600 3032 HE1 PHE 93 2HE PHE 93 -5.843 -15.744 -0.019 3033 HE2 PHE 93 1HE PHE 93 -2.903 -18.314 -1.803 3034 HZ PHE 93 HZ PHE 93 -3.594 -16.062 -1.007 3035 H VAL 94 H VAL 94 -7.243 -21.916 2.151 3036 HA VAL 94 HA VAL 94 -8.541 -24.274 1.084 3037 HB VAL 94 HB VAL 94 -6.676 -24.054 3.510 3038 HG11 VAL 94 1HG1 VAL 94 -6.201 -26.448 2.925 3039 HG12 VAL 94 2HG1 VAL 94 -7.375 -26.369 1.563 3040 HG13 VAL 94 3HG1 VAL 94 -7.949 -26.211 3.264 3041 HG21 VAL 94 3HG2 VAL 94 -5.455 -22.999 1.636 3042 HG22 VAL 94 1HG2 VAL 94 -5.957 -24.322 0.510 3043 HG23 VAL 94 2HG2 VAL 94 -4.841 -24.660 1.880 3044 H ARG 95 H ARG 95 -8.496 -22.134 3.960 3045 HA ARG 95 HA ARG 95 -9.901 -23.617 5.729 3046 HB2 ARG 95 2HB ARG 95 -8.764 -21.384 6.160 3047 HB3 ARG 95 1HB ARG 95 -10.171 -20.575 5.394 3048 HG2 ARG 95 2HG ARG 95 -11.642 -21.484 7.242 3049 HG3 ARG 95 1HG ARG 95 -10.186 -22.220 8.002 3050 HD2 ARG 95 2HD ARG 95 -9.132 -19.954 8.244 3051 HD3 ARG 95 1HD ARG 95 -10.506 -19.177 7.402 3052 HE ARG 95 HE ARG 95 -10.327 -19.877 10.174 3053 HH11 ARG 95 1HH2 ARG 95 -12.610 -19.287 7.493 3054 HH12 ARG 95 2HH2 ARG 95 -13.862 -18.669 8.450 3055 HH21 ARG 95 1HH1 ARG 95 -12.034 -19.069 11.553 3056 HH22 ARG 95 2HH1 ARG 95 -13.533 -18.602 10.882 3057 H ARG 96 H ARG 96 -11.284 -21.615 3.094 3058 HA ARG 96 HA ARG 96 -13.936 -21.871 3.994 3059 HB2 ARG 96 2HB ARG 96 -14.681 -21.239 1.696 3060 HB3 ARG 96 1HB ARG 96 -13.494 -20.140 2.463 3061 HG2 ARG 96 2HG ARG 96 -12.630 -20.193 0.348 3062 HG3 ARG 96 1HG ARG 96 -11.671 -21.477 1.138 3063 HD2 ARG 96 2HD ARG 96 -13.559 -23.115 0.104 3064 HD3 ARG 96 1HD ARG 96 -13.948 -21.695 -0.956 3065 HE ARG 96 HE ARG 96 -11.076 -22.183 -0.789 3066 HH11 ARG 96 1HH2 ARG 96 -13.958 -23.709 -2.394 3067 HH12 ARG 96 2HH2 ARG 96 -12.991 -24.917 -3.158 3068 HH21 ARG 96 1HH1 ARG 96 -9.889 -23.841 -1.788 3069 HH22 ARG 96 2HH1 ARG 96 -10.710 -25.186 -2.409 3070 H GLU 97 H GLU 97 -11.875 -24.349 2.572 3071 HA GLU 97 HA GLU 97 -14.170 -25.905 1.745 3072 HB2 GLU 97 2HB GLU 97 -11.264 -26.838 2.041 3073 HB3 GLU 97 1HB GLU 97 -12.647 -27.803 1.438 3074 HG2 GLU 97 2HG GLU 97 -12.968 -25.900 -0.351 3075 HG3 GLU 97 1HG GLU 97 -11.323 -25.356 0.158 3076 H GLU 98 H GLU 98 -12.103 -25.477 4.654 3077 HA GLU 98 HA GLU 98 -13.025 -27.839 5.942 3078 HB2 GLU 98 2HB GLU 98 -11.962 -25.256 7.265 3079 HB3 GLU 98 1HB GLU 98 -12.438 -26.752 8.125 3080 HG2 GLU 98 2HG GLU 98 -10.639 -28.009 6.774 3081 HG3 GLU 98 1HG GLU 98 -10.016 -26.389 6.277 3082 H GLU 99 H GLU 99 -14.156 -24.507 5.695 3083 HA GLU 99 HA GLU 99 -16.086 -24.417 7.624 3084 HB2 GLU 99 2HB GLU 99 -15.291 -22.497 6.196 3085 HB3 GLU 99 1HB GLU 99 -16.148 -23.215 4.792 3086 HG2 GLU 99 2HG GLU 99 -17.483 -21.401 5.558 3087 HG3 GLU 99 1HG GLU 99 -18.352 -22.896 6.059 3088 H ARG 100 H ARG 100 -16.329 -25.770 4.310 3089 HA ARG 100 HA ARG 100 -19.082 -26.309 4.337 3090 HB2 ARG 100 2HB ARG 100 -16.770 -27.783 2.941 3091 HB3 ARG 100 1HB ARG 100 -18.500 -28.131 2.617 3092 HG2 ARG 100 2HG ARG 100 -18.905 -25.981 1.655 3093 HG3 ARG 100 1HG ARG 100 -17.326 -25.320 2.175 3094 HD2 ARG 100 2HD ARG 100 -17.669 -26.067 -0.348 3095 HD3 ARG 100 1HD ARG 100 -16.118 -26.443 0.475 3096 HE ARG 100 HE ARG 100 -18.313 -28.380 -0.254 3097 HH11 ARG 100 1HH2 ARG 100 -15.132 -28.052 1.472 3098 HH12 ARG 100 2HH2 ARG 100 -14.493 -29.449 0.678 3099 HH21 ARG 100 1HH1 ARG 100 -17.489 -30.521 -0.857 3100 HH22 ARG 100 2HH1 ARG 100 -16.097 -31.114 -0.060 3101 H ARG 101 H ARG 101 -16.275 -28.188 5.458 3102 HA ARG 101 HA ARG 101 -17.730 -30.599 5.903 3103 HB2 ARG 101 2HB ARG 101 -15.074 -29.686 7.167 3104 HB3 ARG 101 1HB ARG 101 -15.661 -31.375 7.073 3105 HG2 ARG 101 2HG ARG 101 -15.031 -29.671 4.566 3106 HG3 ARG 101 1HG ARG 101 -13.777 -30.556 5.483 3107 HD2 ARG 101 2HD ARG 101 -14.859 -32.750 4.994 3108 HD3 ARG 101 1HD ARG 101 -16.217 -31.908 4.148 3109 HE ARG 101 HE ARG 101 -14.892 -31.857 2.256 3110 HH11 ARG 101 1HH2 ARG 101 -12.631 -32.610 5.001 3111 HH12 ARG 101 2HH2 ARG 101 -11.268 -32.632 3.935 3112 HH21 ARG 101 1HH1 ARG 101 -12.843 -31.506 0.987 3113 HH22 ARG 101 2HH1 ARG 101 -11.409 -32.089 1.718 3114 H GLY 102 H GLY 102 -16.998 -27.654 7.729 3115 HA2 GLY 102 2HA GLY 102 -18.185 -26.846 9.448 3116 HA3 GLY 102 1HA GLY 102 -18.898 -28.472 9.776 3117 H HIS 103 H HIS 103 -15.554 -28.416 9.205 3118 HA HIS 103 HA HIS 103 -13.837 -29.101 10.370 3119 HB2 HIS 103 2HB HIS 103 -13.861 -26.617 10.926 3120 HB3 HIS 103 1HB HIS 103 -14.648 -27.033 12.476 3121 HD1 HIS 103 1HD HIS 103 -11.202 -27.074 10.731 3122 HD2 HIS 103 2HD HIS 103 -12.944 -28.241 14.426 3123 HE1 HIS 103 1HE HIS 103 -9.369 -27.664 12.266 3124 HE2 HIS 103 2HE HIS 103 -10.362 -28.310 14.491 Start of MODEL 11 1 H1 SER 1 H SER 1 -23.773 -13.699 -5.156 2 HA SER 1 HA SER 1 -21.971 -13.465 -3.527 3 HB2 SER 1 2HB SER 1 -24.730 -14.103 -2.293 4 HB3 SER 1 1HB SER 1 -23.560 -12.820 -1.808 5 HG SER 1 1HG SER 1 -25.557 -12.389 -3.200 6 H ALA 2 H ALA 2 -20.717 -15.562 -3.749 7 HA ALA 2 HA ALA 2 -21.713 -17.868 -2.404 8 HB1 ALA 2 1HB ALA 2 -18.811 -17.304 -3.266 9 HB2 ALA 2 2HB ALA 2 -20.069 -18.101 -4.281 10 HB3 ALA 2 3HB ALA 2 -19.496 -18.903 -2.787 11 H ASP 3 H ASP 3 -20.046 -18.931 -0.685 12 HA ASP 3 HA ASP 3 -20.767 -17.733 1.607 13 HB2 ASP 3 2HB ASP 3 -18.234 -19.434 1.778 14 HB3 ASP 3 1HB ASP 3 -19.731 -19.481 2.752 15 H HIS 4 H HIS 4 -17.540 -17.790 0.135 16 HA HIS 4 HA HIS 4 -16.418 -16.112 2.142 17 HB2 HIS 4 2HB HIS 4 -14.363 -16.085 0.796 18 HB3 HIS 4 1HB HIS 4 -14.988 -17.754 0.959 19 HD1 HIS 4 1HD HIS 4 -15.912 -18.879 -1.376 20 HD2 HIS 4 2HD HIS 4 -14.877 -14.803 -1.705 21 HE1 HIS 4 1HE HIS 4 -15.955 -18.284 -3.807 22 HE2 HIS 4 2HE HIS 4 -15.560 -15.727 -3.905 23 H GLU 5 H GLU 5 -18.385 -15.335 -0.594 24 HA GLU 5 HA GLU 5 -17.086 -12.794 -1.145 25 HB2 GLU 5 2HB GLU 5 -19.830 -13.768 -2.082 26 HB3 GLU 5 1HB GLU 5 -18.880 -12.427 -2.775 27 HG2 GLU 5 2HG GLU 5 -17.835 -15.349 -2.874 28 HG3 GLU 5 1HG GLU 5 -19.098 -14.762 -3.996 29 H ARG 6 H ARG 6 -19.766 -14.278 0.690 30 HA ARG 6 HA ARG 6 -21.088 -11.910 1.423 31 HB2 ARG 6 2HB ARG 6 -20.855 -14.575 2.951 32 HB3 ARG 6 1HB ARG 6 -22.008 -13.276 3.366 33 HG2 ARG 6 2HG ARG 6 -21.994 -14.665 0.609 34 HG3 ARG 6 1HG ARG 6 -22.878 -15.326 2.008 35 HD2 ARG 6 2HD ARG 6 -23.348 -12.509 0.802 36 HD3 ARG 6 1HD ARG 6 -24.356 -13.988 0.468 37 HE ARG 6 HE ARG 6 -24.540 -14.025 3.131 38 HH11 ARG 6 1HH2 ARG 6 -25.168 -11.334 0.825 39 HH12 ARG 6 2HH2 ARG 6 -26.340 -10.627 1.823 40 HH21 ARG 6 1HH1 ARG 6 -25.938 -12.946 4.504 41 HH22 ARG 6 2HH1 ARG 6 -26.549 -11.356 4.152 42 H GLU 7 H GLU 7 -18.458 -13.787 3.036 43 HA GLU 7 HA GLU 7 -18.262 -12.037 5.209 44 HB2 GLU 7 2HB GLU 7 -16.594 -14.276 4.120 45 HB3 GLU 7 1HB GLU 7 -15.692 -13.044 5.058 46 HG2 GLU 7 2HG GLU 7 -16.325 -14.773 6.600 47 HG3 GLU 7 1HG GLU 7 -17.258 -13.285 6.984 48 H ALA 8 H ALA 8 -16.813 -11.845 1.960 49 HA ALA 8 HA ALA 8 -14.991 -9.782 2.596 50 HB1 ALA 8 1HB ALA 8 -14.930 -9.345 0.130 51 HB2 ALA 8 2HB ALA 8 -16.357 -10.414 -0.100 52 HB3 ALA 8 3HB ALA 8 -14.792 -11.108 0.472 53 H GLN 9 H GLN 9 -18.424 -9.818 1.621 54 HA GLN 9 HA GLN 9 -18.597 -7.061 1.172 55 HB2 GLN 9 2HB GLN 9 -20.280 -8.743 0.336 56 HB3 GLN 9 1HB GLN 9 -20.824 -9.015 2.024 57 HG2 GLN 9 2HG GLN 9 -22.403 -7.556 0.779 58 HG3 GLN 9 1HG GLN 9 -21.670 -6.641 2.138 59 HE21 GLN 9 1HE2 GLN 9 -20.034 -5.013 1.641 60 HE22 GLN 9 2HE2 GLN 9 -19.781 -4.384 0.064 61 H LYS 10 H LYS 10 -19.059 -9.060 4.089 62 HA LYS 10 HA LYS 10 -20.022 -7.023 5.783 63 HB2 LYS 10 2HB LYS 10 -18.230 -9.446 6.453 64 HB3 LYS 10 1HB LYS 10 -19.055 -8.422 7.678 65 HG2 LYS 10 2HG LYS 10 -21.258 -9.164 6.940 66 HG3 LYS 10 1HG LYS 10 -20.553 -10.088 5.565 67 HD2 LYS 10 2HD LYS 10 -19.258 -11.510 7.122 68 HD3 LYS 10 1HD LYS 10 -19.868 -10.569 8.530 69 HE2 LYS 10 2HE LYS 10 -22.169 -11.398 8.178 70 HE3 LYS 10 1HE LYS 10 -21.682 -12.217 6.631 71 HZ1 LYS 10 3HZ LYS 10 -20.413 -12.858 9.254 72 HZ2 LYS 10 1HZ LYS 10 -20.333 -13.699 7.764 73 HZ3 LYS 10 2HZ LYS 10 -21.812 -13.645 8.639 74 H ALA 11 H ALA 11 -16.752 -8.015 4.787 75 HA ALA 11 HA ALA 11 -15.304 -6.709 6.745 76 HB1 ALA 11 1HB ALA 11 -14.416 -7.100 3.817 77 HB2 ALA 11 2HB ALA 11 -14.334 -8.376 5.083 78 HB3 ALA 11 3HB ALA 11 -13.352 -6.880 5.250 79 H GLU 12 H GLU 12 -16.457 -5.494 3.539 80 HA GLU 12 HA GLU 12 -15.258 -2.992 3.650 81 HB2 GLU 12 2HB GLU 12 -18.096 -3.511 2.521 82 HB3 GLU 12 1HB GLU 12 -17.042 -2.101 2.191 83 HG2 GLU 12 2HG GLU 12 -15.379 -3.797 1.108 84 HG3 GLU 12 1HG GLU 12 -16.727 -4.994 1.192 85 H GLU 13 H GLU 13 -18.434 -4.083 4.902 86 HA GLU 13 HA GLU 13 -19.239 -1.504 5.719 87 HB2 GLU 13 2HB GLU 13 -20.239 -4.244 6.699 88 HB3 GLU 13 1HB GLU 13 -21.052 -2.652 6.930 89 HG2 GLU 13 2HG GLU 13 -21.115 -2.388 4.402 90 HG3 GLU 13 1HG GLU 13 -20.531 -4.086 4.227 91 H GLU 14 H GLU 14 -17.514 -4.150 7.309 92 HA GLU 14 HA GLU 14 -17.733 -3.294 9.934 93 HB2 GLU 14 2HB GLU 14 -16.839 -5.553 9.158 94 HB3 GLU 14 1HB GLU 14 -15.356 -4.721 8.621 95 HG2 GLU 14 2HG GLU 14 -14.468 -5.241 10.600 96 HG3 GLU 14 1HG GLU 14 -15.480 -3.959 11.339 97 H LEU 15 H LEU 15 -15.581 -2.248 7.284 98 HA LEU 15 HA LEU 15 -13.855 -0.780 8.937 99 HB2 LEU 15 2HB LEU 15 -13.354 -1.520 6.590 100 HB3 LEU 15 1HB LEU 15 -14.487 -0.291 5.960 101 HG LEU 15 HG LEU 15 -13.039 1.523 6.747 102 HD11 LEU 15 1HD1 LEU 15 -11.358 -0.659 8.146 103 HD12 LEU 15 2HD1 LEU 15 -12.242 0.712 8.919 104 HD13 LEU 15 3HD1 LEU 15 -10.813 1.037 7.900 105 HD21 LEU 15 3HD2 LEU 15 -12.467 0.422 4.572 106 HD22 LEU 15 1HD2 LEU 15 -11.352 -0.708 5.420 107 HD23 LEU 15 2HD2 LEU 15 -10.989 1.049 5.376 108 H GLN 16 H GLN 16 -16.862 0.101 7.210 109 HA GLN 16 HA GLN 16 -16.588 2.863 7.655 110 HB2 GLN 16 2HB GLN 16 -19.125 1.270 7.054 111 HB3 GLN 16 1HB GLN 16 -18.959 3.060 6.995 112 HG2 GLN 16 2HG GLN 16 -17.123 2.811 5.248 113 HG3 GLN 16 1HG GLN 16 -17.390 1.029 5.254 114 HE21 GLN 16 1HE2 GLN 16 -18.022 1.100 2.981 115 HE22 GLN 16 2HE2 GLN 16 -19.658 1.495 2.577 116 H LYS 17 H LYS 17 -17.801 0.285 9.648 117 HA LYS 17 HA LYS 17 -19.170 1.850 11.561 118 HB2 LYS 17 2HB LYS 17 -19.406 -0.616 11.148 119 HB3 LYS 17 1HB LYS 17 -17.730 -0.854 11.748 120 HG2 LYS 17 2HG LYS 17 -18.406 -0.239 14.028 121 HG3 LYS 17 1HG LYS 17 -20.046 0.243 13.471 122 HD2 LYS 17 2HD LYS 17 -19.909 -2.034 14.606 123 HD3 LYS 17 1HD LYS 17 -20.689 -2.029 12.984 124 HE2 LYS 17 2HE LYS 17 -18.703 -3.005 11.909 125 HE3 LYS 17 1HE LYS 17 -17.724 -2.794 13.412 126 HZ1 LYS 17 3HZ LYS 17 -20.050 -4.680 13.136 127 HZ2 LYS 17 1HZ LYS 17 -19.055 -4.430 14.497 128 HZ3 LYS 17 2HZ LYS 17 -18.399 -5.022 13.010 129 H VAL 18 H VAL 18 -15.745 0.823 11.181 130 HA VAL 18 HA VAL 18 -14.901 1.814 13.704 131 HB VAL 18 HB VAL 18 -13.291 1.198 11.169 132 HG11 VAL 18 1HG1 VAL 18 -12.365 1.645 14.096 133 HG12 VAL 18 2HG1 VAL 18 -11.980 2.695 12.681 134 HG13 VAL 18 3HG1 VAL 18 -11.331 1.026 12.753 135 HG21 VAL 18 3HG2 VAL 18 -12.792 -0.962 12.354 136 HG22 VAL 18 1HG2 VAL 18 -14.553 -0.790 12.074 137 HG23 VAL 18 2HG2 VAL 18 -13.879 -0.481 13.711 138 H LEU 19 H LEU 19 -15.114 3.159 10.387 139 HA LEU 19 HA LEU 19 -13.705 5.504 10.771 140 HB2 LEU 19 2HB LEU 19 -16.327 5.250 9.161 141 HB3 LEU 19 1HB LEU 19 -15.145 6.587 9.026 142 HG LEU 19 HG LEU 19 -14.670 3.661 8.226 143 HD11 LEU 19 1HD1 LEU 19 -14.646 4.545 5.906 144 HD12 LEU 19 2HD1 LEU 19 -14.971 6.210 6.513 145 HD13 LEU 19 3HD1 LEU 19 -16.217 4.924 6.703 146 HD21 LEU 19 3HD2 LEU 19 -12.524 4.594 8.994 147 HD22 LEU 19 1HD2 LEU 19 -12.806 6.091 8.026 148 HD23 LEU 19 2HD2 LEU 19 -12.551 4.518 7.197 149 H GLU 20 H GLU 20 -17.168 4.830 11.558 150 HA GLU 20 HA GLU 20 -17.738 7.504 12.267 151 HB2 GLU 20 2HB GLU 20 -19.110 4.872 12.677 152 HB3 GLU 20 1HB GLU 20 -19.523 6.134 13.875 153 HG2 GLU 20 2HG GLU 20 -19.650 6.689 10.851 154 HG3 GLU 20 1HG GLU 20 -21.021 5.999 11.789 155 H GLU 21 H GLU 21 -16.641 4.692 14.270 156 HA GLU 21 HA GLU 21 -16.663 6.250 16.628 157 HB2 GLU 21 2HB GLU 21 -14.914 3.782 16.074 158 HB3 GLU 21 1HB GLU 21 -15.223 4.590 17.657 159 HG2 GLU 21 2HG GLU 21 -17.782 4.186 17.082 160 HG3 GLU 21 1HG GLU 21 -17.169 2.946 15.929 161 H ALA 22 H ALA 22 -14.240 5.728 14.104 162 HA ALA 22 HA ALA 22 -12.040 6.857 15.356 163 HB1 ALA 22 1HB ALA 22 -12.757 7.038 12.359 164 HB2 ALA 22 2HB ALA 22 -11.931 5.641 13.132 165 HB3 ALA 22 3HB ALA 22 -11.130 7.256 13.078 166 H SER 23 H SER 23 -14.779 8.350 13.663 167 HA SER 23 HA SER 23 -13.696 10.919 13.456 168 HB2 SER 23 2HB SER 23 -16.669 10.147 13.773 169 HB3 SER 23 1HB SER 23 -16.015 11.652 13.029 170 HG SER 23 1HG SER 23 -15.791 8.946 12.112 171 H LYS 24 H LYS 24 -15.693 9.369 16.006 172 HA LYS 24 HA LYS 24 -15.872 11.691 17.609 173 HB2 LYS 24 2HB LYS 24 -17.384 9.649 17.738 174 HB3 LYS 24 1HB LYS 24 -16.036 8.731 18.478 175 HG2 LYS 24 2HG LYS 24 -16.057 10.325 20.449 176 HG3 LYS 24 1HG LYS 24 -17.341 11.281 19.624 177 HD2 LYS 24 2HD LYS 24 -18.719 9.120 19.524 178 HD3 LYS 24 1HD LYS 24 -17.573 8.378 20.672 179 HE2 LYS 24 2HE LYS 24 -19.123 11.023 21.212 180 HE3 LYS 24 1HE LYS 24 -19.767 9.389 21.628 181 HZ1 LYS 24 3HZ LYS 24 -17.197 10.483 22.747 182 HZ2 LYS 24 1HZ LYS 24 -17.993 9.022 23.117 183 HZ3 LYS 24 2HZ LYS 24 -18.719 10.546 23.453 184 H LYS 25 H LYS 25 -13.746 8.814 17.695 185 HA LYS 25 HA LYS 25 -12.361 9.616 20.013 186 HB2 LYS 25 2HB LYS 25 -11.625 7.652 17.776 187 HB3 LYS 25 1HB LYS 25 -10.664 7.843 19.285 188 HG2 LYS 25 2HG LYS 25 -12.475 7.040 20.682 189 HG3 LYS 25 1HG LYS 25 -13.660 7.138 19.338 190 HD2 LYS 25 2HD LYS 25 -12.489 5.355 18.103 191 HD3 LYS 25 1HD LYS 25 -11.281 5.180 19.434 192 HE2 LYS 25 2HE LYS 25 -13.025 4.384 21.007 193 HE3 LYS 25 1HE LYS 25 -14.333 4.808 19.835 194 HZ1 LYS 25 3HZ LYS 25 -12.627 3.042 18.520 195 HZ2 LYS 25 1HZ LYS 25 -14.213 2.801 19.073 196 HZ3 LYS 25 2HZ LYS 25 -12.888 2.389 20.060 197 H ALA 26 H ALA 26 -11.773 10.236 16.506 198 HA ALA 26 HA ALA 26 -9.195 11.284 16.872 199 HB1 ALA 26 1HB ALA 26 -9.978 10.630 14.590 200 HB2 ALA 26 2HB ALA 26 -9.492 12.360 14.624 201 HB3 ALA 26 3HB ALA 26 -11.240 11.910 14.647 202 H VAL 27 H VAL 27 -12.467 12.899 16.660 203 HA VAL 27 HA VAL 27 -11.453 15.490 16.835 204 HB VAL 27 HB VAL 27 -14.111 14.303 17.790 205 HG11 VAL 27 1HG1 VAL 27 -13.280 17.287 17.606 206 HG12 VAL 27 2HG1 VAL 27 -13.824 16.406 19.082 207 HG13 VAL 27 3HG1 VAL 27 -14.981 16.700 17.746 208 HG21 VAL 27 3HG2 VAL 27 -13.496 14.276 15.295 209 HG22 VAL 27 1HG2 VAL 27 -13.388 16.064 15.346 210 HG23 VAL 27 2HG2 VAL 27 -14.959 15.237 15.694 211 H GLU 28 H GLU 28 -12.428 13.214 19.428 212 HA GLU 28 HA GLU 28 -11.707 15.187 21.416 213 HB2 GLU 28 2HB GLU 28 -12.675 12.304 21.649 214 HB3 GLU 28 1HB GLU 28 -12.428 13.421 23.029 215 HG2 GLU 28 2HG GLU 28 -14.419 13.892 20.694 216 HG3 GLU 28 1HG GLU 28 -14.844 13.227 22.302 217 H ALA 29 H ALA 29 -9.785 13.205 19.494 218 HA ALA 29 HA ALA 29 -8.022 12.253 21.569 219 HB1 ALA 29 1HB ALA 29 -7.488 12.603 18.534 220 HB2 ALA 29 2HB ALA 29 -8.008 11.074 19.327 221 HB3 ALA 29 3HB ALA 29 -6.417 11.778 19.717 222 H GLU 30 H GLU 30 -8.247 14.845 19.186 223 HA GLU 30 HA GLU 30 -5.829 16.113 19.763 224 HB2 GLU 30 2HB GLU 30 -8.436 17.261 18.597 225 HB3 GLU 30 1HB GLU 30 -6.775 17.894 18.317 226 HG2 GLU 30 2HG GLU 30 -7.729 15.065 17.422 227 HG3 GLU 30 1HG GLU 30 -7.782 16.522 16.421 228 H ARG 31 H ARG 31 -9.184 16.542 20.916 229 HA ARG 31 HA ARG 31 -8.646 18.835 22.506 230 HB2 ARG 31 2HB ARG 31 -10.897 16.745 22.617 231 HB3 ARG 31 1HB ARG 31 -10.871 18.180 23.676 232 HG2 ARG 31 2HG ARG 31 -10.785 18.409 20.608 233 HG3 ARG 31 1HG ARG 31 -12.318 18.275 21.514 234 HD2 ARG 31 2HD ARG 31 -10.193 20.492 21.991 235 HD3 ARG 31 1HD ARG 31 -11.711 20.683 21.018 236 HE ARG 31 HE ARG 31 -12.727 19.721 23.361 237 HH11 ARG 31 1HH2 ARG 31 -10.153 22.214 23.193 238 HH12 ARG 31 2HH2 ARG 31 -11.075 23.475 23.870 239 HH21 ARG 31 1HH1 ARG 31 -13.812 21.232 24.752 240 HH22 ARG 31 2HH1 ARG 31 -13.162 22.802 25.076 241 H GLY 32 H GLY 32 -6.698 18.204 23.705 242 HA2 GLY 32 2HA GLY 32 -6.889 17.993 26.269 243 HA3 GLY 32 1HA GLY 32 -7.138 16.249 25.836 244 H ALA 33 H ALA 33 -5.388 16.742 23.334 245 HA ALA 33 HA ALA 33 -2.967 16.053 24.803 246 HB1 ALA 33 1HB ALA 33 -3.814 15.579 21.902 247 HB2 ALA 33 2HB ALA 33 -3.832 14.345 23.208 248 HB3 ALA 33 3HB ALA 33 -2.257 15.006 22.614 249 HA PRO 34 HA PRO 34 -1.283 19.829 23.288 250 HB2 PRO 34 2HB PRO 34 1.469 19.426 23.451 251 HB3 PRO 34 1HB PRO 34 0.398 19.534 24.905 252 HG2 PRO 34 2HG PRO 34 1.398 16.997 23.503 253 HG3 PRO 34 1HG PRO 34 1.418 17.372 25.282 254 HD2 PRO 34 2HD PRO 34 -0.591 15.859 24.091 255 HD3 PRO 34 1HD PRO 34 -0.948 17.004 25.464 256 H GLY 35 H GLY 35 -1.041 20.749 21.237 257 HA2 GLY 35 2HA GLY 35 0.060 20.997 19.236 258 HA3 GLY 35 1HA GLY 35 0.459 19.239 19.213 259 H ALA 36 H ALA 36 -2.725 20.047 20.212 260 HA ALA 36 HA ALA 36 -4.011 18.466 18.467 261 HB1 ALA 36 1HB ALA 36 -4.959 19.407 20.608 262 HB2 ALA 36 2HB ALA 36 -6.102 19.654 19.239 263 HB3 ALA 36 3HB ALA 36 -5.094 21.023 19.827 264 H ALA 37 H ALA 37 -4.937 18.544 16.475 265 HA ALA 37 HA ALA 37 -4.798 21.106 15.006 266 HB1 ALA 37 1HB ALA 37 -3.066 19.431 14.318 267 HB2 ALA 37 2HB ALA 37 -4.279 19.656 13.000 268 HB3 ALA 37 3HB ALA 37 -4.326 18.196 14.063 269 H LEU 38 H LEU 38 -6.339 17.816 15.025 270 HA LEU 38 HA LEU 38 -8.309 18.835 13.147 271 HB2 LEU 38 2HB LEU 38 -7.328 16.684 12.616 272 HB3 LEU 38 1HB LEU 38 -7.785 16.027 14.210 273 HG LEU 38 HG LEU 38 -10.125 15.958 13.672 274 HD11 LEU 38 1HD1 LEU 38 -10.543 18.028 12.403 275 HD12 LEU 38 2HD1 LEU 38 -11.075 16.623 11.427 276 HD13 LEU 38 3HD1 LEU 38 -9.520 17.446 11.047 277 HD21 LEU 38 3HD2 LEU 38 -8.525 14.904 11.262 278 HD22 LEU 38 1HD2 LEU 38 -10.152 14.348 11.800 279 HD23 LEU 38 2HD2 LEU 38 -8.718 14.099 12.856 280 H ILE 39 H ILE 39 -9.744 20.198 14.329 281 HA ILE 39 HA ILE 39 -11.339 18.749 16.369 282 HB ILE 39 HB ILE 39 -11.671 21.056 17.376 283 HG12 ILE 39 2HG1 ILE 39 -9.089 21.691 15.781 284 HG13 ILE 39 1HG1 ILE 39 -10.709 22.314 15.324 285 HG21 ILE 39 1HG2 ILE 39 -8.847 19.794 17.406 286 HG22 ILE 39 2HG2 ILE 39 -10.271 19.173 18.311 287 HG23 ILE 39 3HG2 ILE 39 -9.590 20.794 18.705 288 HD11 ILE 39 3HD ILE 39 -9.216 22.889 17.971 289 HD12 ILE 39 1HD ILE 39 -9.480 24.024 16.607 290 HD13 ILE 39 2HD ILE 39 -10.883 23.457 17.578 291 H SER 40 H SER 40 -12.488 18.227 13.970 292 HA SER 40 HA SER 40 -14.879 19.733 14.478 293 HB2 SER 40 2HB SER 40 -15.301 20.079 11.910 294 HB3 SER 40 1HB SER 40 -14.320 21.277 12.814 295 HG SER 40 1HG SER 40 -13.638 20.214 10.652 296 H TYR 41 H TYR 41 -16.399 18.155 14.799 297 HA TYR 41 HA TYR 41 -16.019 15.567 13.939 298 HB2 TYR 41 2HB TYR 41 -17.691 16.406 15.761 299 HB3 TYR 41 1HB TYR 41 -18.858 16.624 14.414 300 HD1 TYR 41 2HD TYR 41 -19.243 14.446 12.869 301 HD2 TYR 41 1HD TYR 41 -17.470 14.334 16.790 302 HE1 TYR 41 2HE TYR 41 -19.712 12.046 13.003 303 HE2 TYR 41 1HE TYR 41 -18.032 11.947 16.959 304 HH TYR 41 HH TYR 41 -19.344 10.017 14.252 305 HA PRO 42 HA PRO 42 -18.789 16.015 10.264 306 HB2 PRO 42 2HB PRO 42 -19.124 18.468 8.888 307 HB3 PRO 42 1HB PRO 42 -20.226 17.870 10.182 308 HG2 PRO 42 2HG PRO 42 -17.834 19.773 10.498 309 HG3 PRO 42 1HG PRO 42 -19.527 20.001 11.091 310 HD2 PRO 42 2HD PRO 42 -17.616 19.032 12.772 311 HD3 PRO 42 1HD PRO 42 -19.253 18.233 12.766 312 H ASP 43 H ASP 43 -15.682 17.524 10.570 313 HA ASP 43 HA ASP 43 -15.050 16.898 7.748 314 HB2 ASP 43 2HB ASP 43 -13.292 18.249 9.886 315 HB3 ASP 43 1HB ASP 43 -12.739 17.788 8.243 316 H ALA 44 H ALA 44 -14.730 15.895 11.131 317 HA ALA 44 HA ALA 44 -12.343 14.562 10.989 318 HB1 ALA 44 1HB ALA 44 -13.465 14.988 13.155 319 HB2 ALA 44 2HB ALA 44 -13.101 13.240 12.983 320 HB3 ALA 44 3HB ALA 44 -14.786 13.836 12.729 321 H ILE 45 H ILE 45 -15.629 13.430 10.329 322 HA ILE 45 HA ILE 45 -15.013 10.776 9.834 323 HB ILE 45 HB ILE 45 -17.245 11.545 10.291 324 HG12 ILE 45 2HG1 ILE 45 -17.142 10.323 7.467 325 HG13 ILE 45 1HG1 ILE 45 -16.908 9.441 9.010 326 HG21 ILE 45 1HG2 ILE 45 -17.162 13.032 7.578 327 HG22 ILE 45 2HG2 ILE 45 -17.144 13.799 9.209 328 HG23 ILE 45 3HG2 ILE 45 -18.580 12.879 8.672 329 HD11 ILE 45 3HD ILE 45 -19.491 10.917 8.150 330 HD12 ILE 45 1HD ILE 45 -19.230 9.141 8.237 331 HD13 ILE 45 2HD ILE 45 -19.234 10.117 9.746 332 H TRP 46 H TRP 46 -14.494 13.605 7.784 333 HA TRP 46 HA TRP 46 -14.199 12.000 5.393 334 HB2 TRP 46 2HB TRP 46 -13.903 14.945 6.050 335 HB3 TRP 46 1HB TRP 46 -12.927 14.306 4.716 336 HD1 TRP 46 HD TRP 46 -14.184 16.039 3.278 337 HE1 TRP 46 1HE TRP 46 -16.431 15.957 1.988 338 HE3 TRP 46 3HE TRP 46 -16.313 11.963 5.550 339 HZ2 TRP 46 2HZ TRP 46 -18.552 14.105 1.632 340 HZ3 TRP 46 3HZ TRP 46 -18.415 11.092 4.694 341 HH2 TRP 46 HH TRP 46 -19.546 12.151 2.771 342 H TRP 47 H TRP 47 -12.062 13.488 7.857 343 HA TRP 47 HA TRP 47 -9.716 12.662 6.505 344 HB2 TRP 47 2HB TRP 47 -9.697 14.430 8.271 345 HB3 TRP 47 1HB TRP 47 -10.084 13.180 9.510 346 HD1 TRP 47 HD TRP 47 -7.261 13.742 6.765 347 HE1 TRP 47 1HE TRP 47 -5.022 13.060 7.848 348 HE3 TRP 47 3HE TRP 47 -9.048 11.933 11.187 349 HZ2 TRP 47 2HZ TRP 47 -4.183 11.535 10.108 350 HZ3 TRP 47 3HZ TRP 47 -7.487 10.848 12.769 351 HH2 TRP 47 HH TRP 47 -5.083 10.654 12.233 352 H SER 48 H SER 48 -11.839 11.093 8.963 353 HA SER 48 HA SER 48 -10.330 8.897 9.510 354 HB2 SER 48 2HB SER 48 -13.383 8.952 9.078 355 HB3 SER 48 1HB SER 48 -12.472 7.670 9.956 356 HG SER 48 1HG SER 48 -13.498 9.486 11.180 357 H VAL 49 H VAL 49 -12.209 9.541 6.501 358 HA VAL 49 HA VAL 49 -12.163 6.896 5.562 359 HB VAL 49 HB VAL 49 -12.096 9.421 3.818 360 HG11 VAL 49 1HG1 VAL 49 -13.289 7.926 2.184 361 HG12 VAL 49 2HG1 VAL 49 -13.116 6.535 3.310 362 HG13 VAL 49 3HG1 VAL 49 -11.654 7.283 2.566 363 HG21 VAL 49 3HG2 VAL 49 -13.956 9.698 5.347 364 HG22 VAL 49 1HG2 VAL 49 -14.456 7.971 5.193 365 HG23 VAL 49 2HG2 VAL 49 -14.640 9.106 3.806 366 H GLU 50 H GLU 50 -9.970 9.679 5.096 367 HA GLU 50 HA GLU 50 -8.201 8.541 3.317 368 HB2 GLU 50 2HB GLU 50 -7.420 10.584 5.498 369 HB3 GLU 50 1HB GLU 50 -6.753 10.417 3.839 370 HG2 GLU 50 2HG GLU 50 -9.046 11.127 2.943 371 HG3 GLU 50 1HG GLU 50 -9.591 11.390 4.639 372 H THR 51 H THR 51 -8.354 8.536 6.812 373 HA THR 51 HA THR 51 -5.822 7.524 7.429 374 HB THR 51 HB THR 51 -8.476 7.293 8.972 375 HG1 THR 51 1HG THR 51 -7.946 9.466 8.450 376 HG21 THR 51 3HG2 THR 51 -7.038 7.236 11.010 377 HG22 THR 51 1HG2 THR 51 -5.556 7.272 9.996 378 HG23 THR 51 2HG2 THR 51 -6.649 5.842 9.944 379 H ALA 52 H ALA 52 -9.010 5.929 6.879 380 HA ALA 52 HA ALA 52 -8.068 3.356 7.622 381 HB1 ALA 52 1HB ALA 52 -10.216 2.556 6.582 382 HB2 ALA 52 2HB ALA 52 -10.504 4.217 5.941 383 HB3 ALA 52 3HB ALA 52 -10.475 3.919 7.724 384 H THR 53 H THR 53 -8.168 5.174 4.533 385 HA THR 53 HA THR 53 -7.435 2.807 3.060 386 HB THR 53 HB THR 53 -7.172 4.547 1.201 387 HG1 THR 53 1HG THR 53 -6.965 6.288 2.902 388 HG21 THR 53 3HG2 THR 53 -9.855 4.369 2.751 389 HG22 THR 53 1HG2 THR 53 -9.226 3.142 1.585 390 HG23 THR 53 2HG2 THR 53 -9.654 4.797 1.015 391 H THR 54 H THR 54 -5.753 4.548 5.275 392 HA THR 54 HA THR 54 -3.787 4.723 5.874 393 HB THR 54 HB THR 54 -1.889 3.507 5.215 394 HG1 THR 54 1HG THR 54 -1.823 3.515 3.052 395 HG21 THR 54 3HG2 THR 54 -3.847 2.315 6.382 396 HG22 THR 54 1HG2 THR 54 -2.828 1.225 5.375 397 HG23 THR 54 2HG2 THR 54 -4.431 1.774 4.772 398 H VAL 55 H VAL 55 -4.169 5.416 2.484 399 HA VAL 55 HA VAL 55 -2.121 6.717 1.738 400 HB VAL 55 HB VAL 55 -4.737 8.131 1.105 401 HG11 VAL 55 1HG1 VAL 55 -3.611 8.134 -1.183 402 HG12 VAL 55 2HG1 VAL 55 -2.238 7.226 -0.478 403 HG13 VAL 55 3HG1 VAL 55 -2.560 8.910 0.056 404 HG21 VAL 55 3HG2 VAL 55 -5.406 5.787 1.051 405 HG22 VAL 55 1HG2 VAL 55 -3.855 5.282 0.272 406 HG23 VAL 55 2HG2 VAL 55 -5.058 6.263 -0.638 407 H GLY 56 H GLY 56 -4.583 8.549 3.621 408 HA2 GLY 56 2HA GLY 56 -4.406 10.480 4.760 409 HA3 GLY 56 1HA GLY 56 -2.807 9.765 5.180 410 H TYR 57 H TYR 57 -4.323 11.734 2.544 411 HA TYR 57 HA TYR 57 -1.900 12.466 1.435 412 HB2 TYR 57 2HB TYR 57 -4.665 13.844 1.250 413 HB3 TYR 57 1HB TYR 57 -3.266 14.268 0.198 414 HD1 TYR 57 2HD TYR 57 -5.396 11.290 1.206 415 HD2 TYR 57 1HD TYR 57 -3.030 13.208 -1.836 416 HE1 TYR 57 2HE TYR 57 -6.028 9.548 -0.361 417 HE2 TYR 57 1HE TYR 57 -3.726 11.477 -3.455 418 HH TYR 57 HH TYR 57 -5.642 8.646 -2.380 419 H GLY 58 H GLY 58 -3.145 13.633 4.315 420 HA2 GLY 58 2HA GLY 58 -1.952 14.979 5.677 421 HA3 GLY 58 1HA GLY 58 -1.153 15.751 4.265 422 H ASP 59 H ASP 59 -4.659 15.386 4.474 423 HA ASP 59 HA ASP 59 -4.985 18.228 4.326 424 HB2 ASP 59 2HB ASP 59 -6.576 16.672 3.196 425 HB3 ASP 59 1HB ASP 59 -7.066 16.022 4.795 426 H ARG 60 H ARG 60 -5.488 15.704 6.891 427 HA ARG 60 HA ARG 60 -5.265 17.864 8.836 428 HB2 ARG 60 2HB ARG 60 -7.005 15.398 9.342 429 HB3 ARG 60 1HB ARG 60 -6.820 16.832 10.390 430 HG2 ARG 60 2HG ARG 60 -8.112 16.780 7.592 431 HG3 ARG 60 1HG ARG 60 -9.040 16.671 9.105 432 HD2 ARG 60 2HD ARG 60 -8.830 18.968 9.622 433 HD3 ARG 60 1HD ARG 60 -7.203 19.099 8.832 434 HE ARG 60 HE ARG 60 -8.804 18.522 6.693 435 HH11 ARG 60 1HH2 ARG 60 -9.410 21.222 8.964 436 HH12 ARG 60 2HH2 ARG 60 -9.107 22.390 7.773 437 HH21 ARG 60 1HH1 ARG 60 -8.329 20.096 5.167 438 HH22 ARG 60 2HH1 ARG 60 -8.144 21.736 5.637 439 H TYR 61 H TYR 61 -4.249 16.791 10.918 440 HA TYR 61 HA TYR 61 -2.754 14.458 10.233 441 HB2 TYR 61 2HB TYR 61 -0.627 15.479 11.176 442 HB3 TYR 61 1HB TYR 61 -1.089 16.193 9.595 443 HD1 TYR 61 2HD TYR 61 -2.287 18.464 9.584 444 HD2 TYR 61 1HD TYR 61 -0.387 16.868 13.096 445 HE1 TYR 61 2HE TYR 61 -2.276 20.709 10.593 446 HE2 TYR 61 1HE TYR 61 -0.314 19.112 14.090 447 HH TYR 61 HH TYR 61 -0.805 21.370 13.810 448 HA PRO 62 HA PRO 62 -4.290 14.343 14.422 449 HB2 PRO 62 2HB PRO 62 -3.015 12.103 15.421 450 HB3 PRO 62 1HB PRO 62 -4.193 11.955 14.059 451 HG2 PRO 62 2HG PRO 62 -1.126 12.066 13.941 452 HG3 PRO 62 1HG PRO 62 -2.237 10.916 13.075 453 HD2 PRO 62 2HD PRO 62 -1.177 13.305 11.972 454 HD3 PRO 62 1HD PRO 62 -2.751 12.560 11.426 455 H VAL 63 H VAL 63 -3.637 14.575 16.657 456 HA VAL 63 HA VAL 63 -1.253 16.008 17.107 457 HB VAL 63 HB VAL 63 -3.489 16.278 18.203 458 HG11 VAL 63 1HG1 VAL 63 -2.728 13.761 19.840 459 HG12 VAL 63 2HG1 VAL 63 -4.004 13.868 18.560 460 HG13 VAL 63 3HG1 VAL 63 -4.185 14.804 20.057 461 HG21 VAL 63 3HG2 VAL 63 -1.288 17.182 19.186 462 HG22 VAL 63 1HG2 VAL 63 -1.399 15.875 20.415 463 HG23 VAL 63 2HG2 VAL 63 -2.717 17.085 20.280 464 H THR 64 H THR 64 0.072 15.280 19.210 465 HA THR 64 HA THR 64 1.436 12.948 18.531 466 HB THR 64 HB THR 64 1.684 14.742 20.999 467 HG1 THR 64 1HG THR 64 2.638 14.988 18.332 468 HG21 THR 64 3HG2 THR 64 3.849 13.100 19.511 469 HG22 THR 64 1HG2 THR 64 3.089 12.597 21.066 470 HG23 THR 64 2HG2 THR 64 4.068 14.104 20.980 471 H GLU 65 H GLU 65 0.219 13.611 21.932 472 HA GLU 65 HA GLU 65 0.734 11.020 22.482 473 HB2 GLU 65 2HB GLU 65 0.516 12.868 24.213 474 HB3 GLU 65 1HB GLU 65 -1.255 12.540 24.223 475 HG2 GLU 65 2HG GLU 65 -0.776 10.142 24.834 476 HG3 GLU 65 1HG GLU 65 0.991 10.461 24.740 477 H GLU 66 H GLU 66 -2.659 12.261 21.982 478 HA GLU 66 HA GLU 66 -3.539 9.496 22.136 479 HB2 GLU 66 2HB GLU 66 -5.113 12.079 21.763 480 HB3 GLU 66 1HB GLU 66 -5.852 10.448 21.881 481 HG2 GLU 66 2HG GLU 66 -4.058 11.548 24.138 482 HG3 GLU 66 1HG GLU 66 -5.794 11.991 23.996 483 H GLY 67 H GLY 67 -3.817 12.161 19.652 484 HA2 GLY 67 2HA GLY 67 -5.302 10.794 17.869 485 HA3 GLY 67 1HA GLY 67 -4.141 12.108 17.474 486 H ARG 68 H ARG 68 -1.728 10.643 18.161 487 HA ARG 68 HA ARG 68 -1.416 9.259 15.758 488 HB2 ARG 68 2HB ARG 68 0.413 10.470 17.082 489 HB3 ARG 68 1HB ARG 68 0.399 9.093 18.226 490 HG2 ARG 68 2HG ARG 68 2.254 8.750 16.705 491 HG3 ARG 68 1HG ARG 68 1.004 7.543 16.313 492 HD2 ARG 68 2HD ARG 68 1.944 8.403 14.240 493 HD3 ARG 68 1HD ARG 68 0.237 8.997 14.354 494 HE ARG 68 HE ARG 68 2.193 10.892 15.472 495 HH11 ARG 68 1HH2 ARG 68 0.619 9.973 12.384 496 HH12 ARG 68 2HH2 ARG 68 1.864 10.656 11.397 497 HH21 ARG 68 1HH1 ARG 68 3.545 12.437 13.931 498 HH22 ARG 68 2HH1 ARG 68 3.701 11.765 12.371 499 H LYS 69 H LYS 69 -2.156 8.146 19.082 500 HA LYS 69 HA LYS 69 -1.784 5.364 18.506 501 HB2 LYS 69 2HB LYS 69 -3.380 6.798 20.722 502 HB3 LYS 69 1HB LYS 69 -3.213 5.015 20.587 503 HG2 LYS 69 2HG LYS 69 -0.792 5.145 20.874 504 HG3 LYS 69 1HG LYS 69 -0.840 6.941 21.002 505 HD2 LYS 69 2HD LYS 69 -2.022 6.924 23.065 506 HD3 LYS 69 1HD LYS 69 -2.606 5.244 22.849 507 HE2 LYS 69 2HE LYS 69 0.328 6.023 23.482 508 HE3 LYS 69 1HE LYS 69 -0.895 5.375 24.648 509 HZ1 LYS 69 3HZ LYS 69 0.590 4.009 22.525 510 HZ2 LYS 69 1HZ LYS 69 -0.997 3.497 22.737 511 HZ3 LYS 69 2HZ LYS 69 0.068 3.434 24.050 512 H VAL 70 H VAL 70 -4.502 7.698 18.505 513 HA VAL 70 HA VAL 70 -6.493 5.770 17.977 514 HB VAL 70 HB VAL 70 -6.446 8.768 17.352 515 HG11 VAL 70 1HG1 VAL 70 -8.807 6.758 17.387 516 HG12 VAL 70 2HG1 VAL 70 -8.189 7.656 15.950 517 HG13 VAL 70 3HG1 VAL 70 -8.963 8.554 17.295 518 HG21 VAL 70 3HG2 VAL 70 -6.183 8.229 19.799 519 HG22 VAL 70 1HG2 VAL 70 -7.589 7.114 19.719 520 HG23 VAL 70 2HG2 VAL 70 -7.824 8.882 19.480 521 H ALA 71 H ALA 71 -4.550 7.897 15.816 522 HA ALA 71 HA ALA 71 -5.665 7.094 13.418 523 HB1 ALA 71 1HB ALA 71 -3.567 7.912 12.334 524 HB2 ALA 71 2HB ALA 71 -2.740 7.933 13.942 525 HB3 ALA 71 3HB ALA 71 -4.106 9.059 13.614 526 H GLU 72 H GLU 72 -2.813 5.783 15.178 527 HA GLU 72 HA GLU 72 -1.985 3.786 13.514 528 HB2 GLU 72 2HB GLU 72 -0.608 4.117 15.378 529 HB3 GLU 72 1HB GLU 72 -2.011 4.364 16.451 530 HG2 GLU 72 2HG GLU 72 -0.969 2.544 17.334 531 HG3 GLU 72 1HG GLU 72 -2.396 1.842 16.521 532 H GLN 73 H GLN 73 -4.578 3.570 16.010 533 HA GLN 73 HA GLN 73 -5.004 0.849 15.455 534 HB2 GLN 73 2HB GLN 73 -5.521 2.090 17.626 535 HB3 GLN 73 1HB GLN 73 -7.006 2.716 16.844 536 HG2 GLN 73 2HG GLN 73 -7.846 0.366 16.553 537 HG3 GLN 73 1HG GLN 73 -6.268 -0.276 17.160 538 HE21 GLN 73 1HE2 GLN 73 -7.661 -1.399 18.806 539 HE22 GLN 73 2HE2 GLN 73 -8.137 -0.544 20.234 540 H VAL 74 H VAL 74 -6.715 3.796 14.333 541 HA VAL 74 HA VAL 74 -8.822 2.369 13.054 542 HB VAL 74 HB VAL 74 -7.744 5.222 12.768 543 HG11 VAL 74 1HG1 VAL 74 -9.938 5.770 11.662 544 HG12 VAL 74 2HG1 VAL 74 -10.366 4.017 11.631 545 HG13 VAL 74 3HG1 VAL 74 -8.979 4.640 10.667 546 HG21 VAL 74 3HG2 VAL 74 -9.653 5.807 14.235 547 HG22 VAL 74 1HG2 VAL 74 -8.688 4.539 15.048 548 HG23 VAL 74 2HG2 VAL 74 -10.231 4.096 14.238 549 H MET 75 H MET 75 -5.695 3.771 11.964 550 HA MET 75 HA MET 75 -6.038 3.345 9.232 551 HB2 MET 75 2HB MET 75 -4.283 4.813 10.198 552 HB3 MET 75 1HB MET 75 -3.537 3.396 11.013 553 HG2 MET 75 2HG MET 75 -2.890 2.438 8.809 554 HG3 MET 75 1HG MET 75 -3.797 3.735 7.969 555 HE1 MET 75 3HE MET 75 -0.077 4.705 10.677 556 HE2 MET 75 1HE MET 75 -1.055 3.213 10.809 557 HE3 MET 75 2HE MET 75 -1.755 4.797 11.299 558 H LYS 76 H LYS 76 -4.479 1.326 11.801 559 HA LYS 76 HA LYS 76 -3.700 -0.740 10.123 560 HB2 LYS 76 2HB LYS 76 -2.906 -0.476 12.490 561 HB3 LYS 76 1HB LYS 76 -4.534 -0.933 13.085 562 HG2 LYS 76 2HG LYS 76 -4.261 -3.236 12.152 563 HG3 LYS 76 1HG LYS 76 -2.731 -2.740 11.351 564 HD2 LYS 76 2HD LYS 76 -1.733 -2.261 13.612 565 HD3 LYS 76 1HD LYS 76 -3.191 -2.932 14.407 566 HE2 LYS 76 2HE LYS 76 -1.456 -4.538 12.388 567 HE3 LYS 76 1HE LYS 76 -1.082 -4.474 14.150 568 HZ1 LYS 76 3HZ LYS 76 -2.320 -6.438 13.406 569 HZ2 LYS 76 1HZ LYS 76 -3.733 -5.484 13.139 570 HZ3 LYS 76 2HZ LYS 76 -3.016 -5.634 14.670 571 H ALA 77 H ALA 77 -6.830 -0.058 11.668 572 HA ALA 77 HA ALA 77 -7.955 -2.589 11.278 573 HB1 ALA 77 1HB ALA 77 -9.431 0.115 11.342 574 HB2 ALA 77 2HB ALA 77 -8.985 -0.856 12.795 575 HB3 ALA 77 3HB ALA 77 -10.169 -1.509 11.597 576 H GLY 78 H GLY 78 -7.535 0.150 9.058 577 HA2 GLY 78 2HA GLY 78 -9.399 -0.747 7.106 578 HA3 GLY 78 1HA GLY 78 -8.013 0.394 6.910 579 H ILE 79 H ILE 79 -5.925 -1.282 7.684 580 HA ILE 79 HA ILE 79 -5.399 -2.629 5.295 581 HB ILE 79 HB ILE 79 -4.003 -3.063 7.990 582 HG12 ILE 79 2HG1 ILE 79 -3.500 -0.918 5.831 583 HG13 ILE 79 1HG1 ILE 79 -4.142 -0.620 7.475 584 HG21 ILE 79 1HG2 ILE 79 -3.015 -3.375 5.065 585 HG22 ILE 79 2HG2 ILE 79 -3.434 -4.735 6.165 586 HG23 ILE 79 3HG2 ILE 79 -2.040 -3.681 6.546 587 HD11 ILE 79 3HD ILE 79 -1.307 -1.624 6.790 588 HD12 ILE 79 1HD ILE 79 -1.781 -0.025 7.452 589 HD13 ILE 79 2HD ILE 79 -1.974 -1.506 8.463 590 H GLU 80 H GLU 80 -6.357 -3.789 8.569 591 HA GLU 80 HA GLU 80 -6.256 -6.507 7.933 592 HB2 GLU 80 2HB GLU 80 -8.005 -5.100 10.034 593 HB3 GLU 80 1HB GLU 80 -7.727 -6.873 9.935 594 HG2 GLU 80 2HG GLU 80 -5.253 -6.508 10.264 595 HG3 GLU 80 1HG GLU 80 -5.543 -4.740 10.412 596 H VAL 81 H VAL 81 -8.814 -4.106 7.375 597 HA VAL 81 HA VAL 81 -10.816 -6.015 6.731 598 HB VAL 81 HB VAL 81 -10.489 -3.021 6.323 599 HG11 VAL 81 1HG1 VAL 81 -12.913 -3.061 5.422 600 HG12 VAL 81 2HG1 VAL 81 -12.704 -4.816 5.143 601 HG13 VAL 81 3HG1 VAL 81 -11.672 -3.624 4.272 602 HG21 VAL 81 3HG2 VAL 81 -11.080 -4.007 8.590 603 HG22 VAL 81 1HG2 VAL 81 -12.533 -4.779 7.854 604 HG23 VAL 81 2HG2 VAL 81 -12.398 -2.986 7.923 605 H PHE 82 H PHE 82 -8.797 -3.857 4.604 606 HA PHE 82 HA PHE 82 -9.874 -4.944 2.256 607 HB2 PHE 82 2HB PHE 82 -7.124 -3.586 2.687 608 HB3 PHE 82 1HB PHE 82 -7.838 -3.948 1.071 609 HD1 PHE 82 1HD PHE 82 -10.455 -3.118 0.891 610 HD2 PHE 82 2HD PHE 82 -7.382 -1.356 3.334 611 HE1 PHE 82 1HE PHE 82 -11.678 -0.975 0.891 612 HE2 PHE 82 2HE PHE 82 -8.612 0.777 3.347 613 HZ PHE 82 HZ PHE 82 -10.764 0.984 2.122 614 H ALA 83 H ALA 83 -7.029 -5.865 4.220 615 HA ALA 83 HA ALA 83 -6.053 -7.743 2.371 616 HB1 ALA 83 1HB ALA 83 -4.640 -6.858 4.233 617 HB2 ALA 83 2HB ALA 83 -4.712 -8.655 4.267 618 HB3 ALA 83 3HB ALA 83 -5.701 -7.685 5.430 619 H LEU 84 H LEU 84 -8.747 -7.916 4.677 620 HA LEU 84 HA LEU 84 -8.686 -10.756 4.917 621 HB2 LEU 84 2HB LEU 84 -9.724 -9.272 6.612 622 HB3 LEU 84 1HB LEU 84 -11.001 -8.802 5.457 623 HG LEU 84 HG LEU 84 -10.631 -11.772 5.929 624 HD11 LEU 84 1HD1 LEU 84 -10.224 -10.913 8.213 625 HD12 LEU 84 2HD1 LEU 84 -11.818 -11.765 8.107 626 HD13 LEU 84 3HD1 LEU 84 -11.758 -9.956 8.154 627 HD21 LEU 84 3HD2 LEU 84 -12.540 -10.888 4.524 628 HD22 LEU 84 1HD2 LEU 84 -13.168 -10.000 5.959 629 HD23 LEU 84 2HD2 LEU 84 -13.116 -11.799 5.962 630 H VAL 85 H VAL 85 -9.957 -8.476 2.573 631 HA VAL 85 HA VAL 85 -11.949 -10.040 1.418 632 HB VAL 85 HB VAL 85 -10.172 -7.909 0.121 633 HG11 VAL 85 1HG1 VAL 85 -12.193 -7.533 -1.369 634 HG12 VAL 85 2HG1 VAL 85 -12.943 -9.026 -0.697 635 HG13 VAL 85 3HG1 VAL 85 -11.412 -9.122 -1.643 636 HG21 VAL 85 3HG2 VAL 85 -12.092 -6.373 0.760 637 HG22 VAL 85 1HG2 VAL 85 -11.255 -7.042 2.190 638 HG23 VAL 85 2HG2 VAL 85 -12.846 -7.720 1.687 639 H THR 86 H THR 86 -8.522 -10.461 1.400 640 HA THR 86 HA THR 86 -8.046 -11.810 -0.922 641 HB THR 86 HB THR 86 -6.862 -12.488 1.805 642 HG1 THR 86 1HG THR 86 -6.468 -10.448 1.677 643 HG21 THR 86 3HG2 THR 86 -4.793 -12.954 0.403 644 HG22 THR 86 1HG2 THR 86 -5.746 -12.667 -1.095 645 HG23 THR 86 2HG2 THR 86 -6.139 -14.061 -0.016 646 H ALA 87 H ALA 87 -9.999 -12.907 1.809 647 HA ALA 87 HA ALA 87 -9.942 -15.662 1.272 648 HB1 ALA 87 1HB ALA 87 -11.012 -14.638 3.325 649 HB2 ALA 87 2HB ALA 87 -12.147 -15.733 2.455 650 HB3 ALA 87 3HB ALA 87 -12.301 -13.942 2.285 651 H ALA 88 H ALA 88 -11.346 -13.003 -0.525 652 HA ALA 88 HA ALA 88 -12.960 -14.798 -2.170 653 HB1 ALA 88 1HB ALA 88 -14.020 -12.576 -1.573 654 HB2 ALA 88 2HB ALA 88 -13.731 -12.738 -3.343 655 HB3 ALA 88 3HB ALA 88 -12.624 -11.735 -2.337 656 H LEU 89 H LEU 89 -10.220 -12.502 -2.344 657 HA LEU 89 HA LEU 89 -9.821 -12.784 -5.064 658 HB2 LEU 89 2HB LEU 89 -7.620 -12.176 -3.003 659 HB3 LEU 89 1HB LEU 89 -7.644 -11.683 -4.723 660 HG LEU 89 HG LEU 89 -9.695 -10.715 -2.624 661 HD11 LEU 89 1HD1 LEU 89 -7.419 -10.005 -1.927 662 HD12 LEU 89 2HD1 LEU 89 -8.404 -8.615 -2.491 663 HD13 LEU 89 3HD1 LEU 89 -7.125 -9.313 -3.554 664 HD21 LEU 89 3HD2 LEU 89 -10.495 -10.526 -4.993 665 HD22 LEU 89 1HD2 LEU 89 -9.003 -9.603 -5.406 666 HD23 LEU 89 2HD2 LEU 89 -10.193 -8.915 -4.247 667 H ALA 90 H ALA 90 -8.360 -14.640 -2.350 668 HA ALA 90 HA ALA 90 -6.404 -15.847 -4.010 669 HB1 ALA 90 1HB ALA 90 -7.461 -16.703 -1.255 670 HB2 ALA 90 2HB ALA 90 -6.041 -15.642 -1.569 671 HB3 ALA 90 3HB ALA 90 -5.987 -17.368 -2.068 672 H THR 91 H THR 91 -9.825 -16.457 -3.686 673 HA THR 91 HA THR 91 -9.388 -19.203 -4.637 674 HB THR 91 HB THR 91 -10.782 -19.213 -2.787 675 HG1 THR 91 1HG THR 91 -12.045 -19.681 -5.231 676 HG21 THR 91 3HG2 THR 91 -11.654 -16.934 -2.730 677 HG22 THR 91 1HG2 THR 91 -13.004 -18.101 -2.710 678 HG23 THR 91 2HG2 THR 91 -12.617 -17.199 -4.227 679 H ASP 92 H ASP 92 -9.232 -16.233 -6.041 680 HA ASP 92 HA ASP 92 -11.071 -16.803 -8.186 681 HB2 ASP 92 2HB ASP 92 -9.033 -14.596 -7.769 682 HB3 ASP 92 1HB ASP 92 -9.714 -14.922 -9.402 683 H PHE 93 H PHE 93 -7.675 -17.581 -7.476 684 HA PHE 93 HA PHE 93 -7.311 -18.475 -10.190 685 HB2 PHE 93 2HB PHE 93 -5.152 -19.057 -9.773 686 HB3 PHE 93 1HB PHE 93 -5.365 -17.700 -8.625 687 HD1 PHE 93 1HD PHE 93 -5.702 -18.257 -6.162 688 HD2 PHE 93 2HD PHE 93 -4.568 -21.243 -9.032 689 HE1 PHE 93 1HE PHE 93 -4.980 -19.740 -4.327 690 HE2 PHE 93 2HE PHE 93 -3.828 -22.727 -7.192 691 HZ PHE 93 HZ PHE 93 -4.028 -21.980 -4.839 692 H VAL 94 H VAL 94 -8.636 -19.820 -7.257 693 HA VAL 94 HA VAL 94 -8.031 -22.503 -7.773 694 HB VAL 94 HB VAL 94 -10.237 -21.279 -6.043 695 HG11 VAL 94 1HG1 VAL 94 -8.970 -24.109 -6.025 696 HG12 VAL 94 2HG1 VAL 94 -10.677 -23.716 -6.452 697 HG13 VAL 94 3HG1 VAL 94 -10.089 -23.453 -4.773 698 HG21 VAL 94 3HG2 VAL 94 -7.344 -22.206 -5.389 699 HG22 VAL 94 1HG2 VAL 94 -8.546 -21.533 -4.228 700 HG23 VAL 94 2HG2 VAL 94 -7.855 -20.490 -5.502 701 H ARG 95 H ARG 95 -10.666 -20.392 -8.773 702 HA ARG 95 HA ARG 95 -12.457 -22.326 -9.743 703 HB2 ARG 95 2HB ARG 95 -11.865 -19.438 -10.648 704 HB3 ARG 95 1HB ARG 95 -13.298 -20.374 -11.180 705 HG2 ARG 95 2HG ARG 95 -14.271 -20.364 -8.977 706 HG3 ARG 95 1HG ARG 95 -12.779 -19.726 -8.205 707 HD2 ARG 95 2HD ARG 95 -13.028 -17.524 -9.333 708 HD3 ARG 95 1HD ARG 95 -14.339 -18.184 -10.367 709 HE ARG 95 HE ARG 95 -15.872 -17.817 -8.782 710 HH11 ARG 95 1HH2 ARG 95 -12.831 -17.564 -6.957 711 HH12 ARG 95 2HH2 ARG 95 -13.067 -15.959 -6.721 712 HH21 ARG 95 1HH1 ARG 95 -16.376 -15.756 -7.737 713 HH22 ARG 95 2HH1 ARG 95 -15.651 -15.376 -6.264 714 H ARG 96 H ARG 96 -9.318 -21.406 -10.902 715 HA ARG 96 HA ARG 96 -9.778 -21.698 -13.687 716 HB2 ARG 96 2HB ARG 96 -7.779 -20.466 -12.586 717 HB3 ARG 96 1HB ARG 96 -7.191 -22.066 -12.056 718 HG2 ARG 96 2HG ARG 96 -7.261 -22.594 -14.714 719 HG3 ARG 96 1HG ARG 96 -7.228 -20.832 -14.851 720 HD2 ARG 96 2HD ARG 96 -4.940 -22.018 -14.998 721 HD3 ARG 96 1HD ARG 96 -5.039 -20.719 -13.749 722 HE ARG 96 HE ARG 96 -4.290 -22.277 -12.291 723 HH11 ARG 96 1HH2 ARG 96 -6.698 -24.192 -14.193 724 HH12 ARG 96 2HH2 ARG 96 -6.037 -25.693 -13.751 725 HH21 ARG 96 1HH1 ARG 96 -3.575 -24.443 -11.532 726 HH22 ARG 96 2HH1 ARG 96 -4.399 -25.823 -12.103 727 H GLU 97 H GLU 97 -9.181 -23.979 -11.008 728 HA GLU 97 HA GLU 97 -8.386 -26.040 -12.958 729 HB2 GLU 97 2HB GLU 97 -7.067 -25.618 -10.670 730 HB3 GLU 97 1HB GLU 97 -8.443 -26.497 -9.949 731 HG2 GLU 97 2HG GLU 97 -6.691 -28.096 -10.319 732 HG3 GLU 97 1HG GLU 97 -7.880 -28.457 -11.610 733 H GLU 98 H GLU 98 -9.611 -28.114 -12.716 734 HA GLU 98 HA GLU 98 -11.445 -29.278 -12.785 735 HB2 GLU 98 2HB GLU 98 -12.643 -27.321 -10.788 736 HB3 GLU 98 1HB GLU 98 -13.523 -28.725 -11.433 737 HG2 GLU 98 2HG GLU 98 -10.753 -29.277 -10.250 738 HG3 GLU 98 1HG GLU 98 -12.061 -28.824 -9.105 739 H GLU 99 H GLU 99 -12.180 -25.750 -12.990 740 HA GLU 99 HA GLU 99 -14.391 -26.084 -14.614 741 HB2 GLU 99 2HB GLU 99 -13.748 -23.892 -13.506 742 HB3 GLU 99 1HB GLU 99 -12.516 -23.661 -14.784 743 HG2 GLU 99 2HG GLU 99 -14.392 -23.764 -16.531 744 HG3 GLU 99 1HG GLU 99 -15.576 -23.971 -15.189 745 H ARG 100 H ARG 100 -10.935 -25.722 -15.558 746 HA ARG 100 HA ARG 100 -11.659 -25.785 -18.347 747 HB2 ARG 100 2HB ARG 100 -8.905 -26.104 -17.040 748 HB3 ARG 100 1HB ARG 100 -9.228 -25.757 -18.780 749 HG2 ARG 100 2HG ARG 100 -10.260 -23.568 -18.194 750 HG3 ARG 100 1HG ARG 100 -10.122 -23.926 -16.455 751 HD2 ARG 100 2HD ARG 100 -8.400 -22.417 -16.849 752 HD3 ARG 100 1HD ARG 100 -7.542 -23.999 -16.728 753 HE ARG 100 HE ARG 100 -7.826 -22.123 -18.960 754 HH11 ARG 100 1HH2 ARG 100 -6.675 -25.392 -18.004 755 HH12 ARG 100 2HH2 ARG 100 -5.394 -25.424 -19.091 756 HH21 ARG 100 1HH1 ARG 100 -6.604 -22.456 -20.892 757 HH22 ARG 100 2HH1 ARG 100 -5.570 -23.791 -21.094 758 H ARG 101 H ARG 101 -11.550 -28.240 -15.997 759 HA ARG 101 HA ARG 101 -10.803 -30.299 -17.947 760 HB2 ARG 101 2HB ARG 101 -9.864 -30.147 -14.998 761 HB3 ARG 101 1HB ARG 101 -9.493 -31.467 -16.158 762 HG2 ARG 101 2HG ARG 101 -8.542 -28.536 -16.356 763 HG3 ARG 101 1HG ARG 101 -7.566 -29.923 -15.769 764 HD2 ARG 101 2HD ARG 101 -7.598 -31.007 -17.972 765 HD3 ARG 101 1HD ARG 101 -8.795 -29.798 -18.607 766 HE ARG 101 HE ARG 101 -6.301 -28.591 -17.600 767 HH11 ARG 101 1HH2 ARG 101 -7.821 -30.354 -20.392 768 HH12 ARG 101 2HH2 ARG 101 -6.751 -29.690 -21.553 769 HH21 ARG 101 1HH1 ARG 101 -4.777 -27.793 -19.264 770 HH22 ARG 101 2HH1 ARG 101 -4.809 -28.491 -20.822 771 H GLY 102 H GLY 102 -13.317 -30.314 -17.960 772 HA2 GLY 102 2HA GLY 102 -14.505 -32.368 -17.082 773 HA3 GLY 102 1HA GLY 102 -14.397 -31.491 -15.495 774 H HIS 103 H HIS 103 -14.411 -28.858 -16.941 775 HA HIS 103 HA HIS 103 -17.196 -28.796 -17.887 776 HB2 HIS 103 2HB HIS 103 -16.782 -27.865 -15.439 777 HB3 HIS 103 1HB HIS 103 -15.938 -26.514 -16.241 778 HD1 HIS 103 1HD HIS 103 -17.972 -25.558 -18.450 779 HD2 HIS 103 2HD HIS 103 -19.176 -27.111 -14.700 780 HE1 HIS 103 1HE HIS 103 -20.233 -24.697 -17.979 781 HE2 HIS 103 2HE HIS 103 -20.992 -25.696 -15.756 782 H1 SER 1 H SER 1 -3.583 -17.549 -24.823 783 HA SER 1 HA SER 1 -1.360 -18.245 -23.303 784 HB2 SER 1 2HB SER 1 -1.445 -15.501 -23.277 785 HB3 SER 1 1HB SER 1 -0.901 -16.454 -24.697 786 HG SER 1 1HG SER 1 -2.417 -14.964 -25.346 787 H ALA 2 H ALA 2 -2.728 -19.383 -21.684 788 HA ALA 2 HA ALA 2 -3.564 -19.610 -19.700 789 HB1 ALA 2 1HB ALA 2 -2.578 -16.792 -18.996 790 HB2 ALA 2 2HB ALA 2 -1.567 -18.260 -18.947 791 HB3 ALA 2 3HB ALA 2 -2.957 -18.127 -17.830 792 H ASP 3 H ASP 3 -4.836 -17.646 -17.931 793 HA ASP 3 HA ASP 3 -7.127 -16.758 -19.534 794 HB2 ASP 3 2HB ASP 3 -7.437 -18.670 -17.109 795 HB3 ASP 3 1HB ASP 3 -8.770 -17.722 -17.872 796 H HIS 4 H HIS 4 -6.102 -17.294 -16.196 797 HA HIS 4 HA HIS 4 -7.027 -15.104 -15.005 798 HB2 HIS 4 2HB HIS 4 -5.312 -15.319 -13.259 799 HB3 HIS 4 1HB HIS 4 -5.827 -16.939 -13.800 800 HD1 HIS 4 1HD HIS 4 -2.788 -14.813 -13.418 801 HD2 HIS 4 2HD HIS 4 -3.795 -18.088 -15.851 802 HE1 HIS 4 1HE HIS 4 -0.657 -15.821 -14.229 803 HE2 HIS 4 2HE HIS 4 -1.300 -17.378 -15.968 804 H GLU 5 H GLU 5 -4.066 -15.055 -17.044 805 HA GLU 5 HA GLU 5 -3.084 -12.580 -16.131 806 HB2 GLU 5 2HB GLU 5 -2.657 -14.337 -18.619 807 HB3 GLU 5 1HB GLU 5 -1.869 -12.737 -18.496 808 HG2 GLU 5 2HG GLU 5 -0.401 -13.327 -16.849 809 HG3 GLU 5 1HG GLU 5 -1.526 -14.473 -16.073 810 H ARG 6 H ARG 6 -5.536 -13.546 -18.501 811 HA ARG 6 HA ARG 6 -5.295 -11.100 -19.959 812 HB2 ARG 6 2HB ARG 6 -7.296 -13.424 -20.200 813 HB3 ARG 6 1HB ARG 6 -7.029 -12.115 -21.403 814 HG2 ARG 6 2HG ARG 6 -4.618 -12.847 -21.626 815 HG3 ARG 6 1HG ARG 6 -4.904 -14.213 -20.513 816 HD2 ARG 6 2HD ARG 6 -6.267 -13.839 -23.257 817 HD3 ARG 6 1HD ARG 6 -4.847 -14.890 -22.919 818 HE ARG 6 HE ARG 6 -6.171 -16.370 -21.564 819 HH11 ARG 6 1HH2 ARG 6 -8.016 -14.311 -23.831 820 HH12 ARG 6 2HH2 ARG 6 -9.501 -15.065 -23.546 821 HH21 ARG 6 1HH1 ARG 6 -8.330 -17.487 -21.192 822 HH22 ARG 6 2HH1 ARG 6 -9.715 -16.664 -21.691 823 H GLU 7 H GLU 7 -7.095 -12.239 -17.175 824 HA GLU 7 HA GLU 7 -8.983 -10.043 -17.502 825 HB2 GLU 7 2HB GLU 7 -9.478 -12.534 -16.735 826 HB3 GLU 7 1HB GLU 7 -9.214 -11.845 -15.104 827 HG2 GLU 7 2HG GLU 7 -11.142 -10.467 -15.263 828 HG3 GLU 7 1HG GLU 7 -10.975 -10.260 -17.039 829 H ALA 8 H ALA 8 -6.073 -10.948 -15.731 830 HA ALA 8 HA ALA 8 -6.115 -8.854 -13.863 831 HB1 ALA 8 1HB ALA 8 -3.611 -9.160 -13.794 832 HB2 ALA 8 2HB ALA 8 -3.703 -10.217 -15.244 833 HB3 ALA 8 3HB ALA 8 -4.468 -10.740 -13.696 834 H GLN 9 H GLN 9 -4.746 -9.063 -17.220 835 HA GLN 9 HA GLN 9 -3.783 -6.422 -17.021 836 HB2 GLN 9 2HB GLN 9 -3.191 -8.460 -18.742 837 HB3 GLN 9 1HB GLN 9 -4.257 -7.483 -19.798 838 HG2 GLN 9 2HG GLN 9 -1.933 -6.767 -20.142 839 HG3 GLN 9 1HG GLN 9 -2.773 -5.442 -19.256 840 HE21 GLN 9 1HE2 GLN 9 -1.333 -4.600 -17.606 841 HE22 GLN 9 2HE2 GLN 9 -0.248 -5.591 -16.717 842 H LYS 10 H LYS 10 -6.885 -7.734 -17.986 843 HA LYS 10 HA LYS 10 -7.892 -5.470 -19.317 844 HB2 LYS 10 2HB LYS 10 -8.987 -7.724 -19.406 845 HB3 LYS 10 1HB LYS 10 -9.352 -7.614 -17.648 846 HG2 LYS 10 2HG LYS 10 -10.829 -5.646 -18.070 847 HG3 LYS 10 1HG LYS 10 -10.435 -5.713 -19.823 848 HD2 LYS 10 2HD LYS 10 -11.440 -7.978 -19.983 849 HD3 LYS 10 1HD LYS 10 -11.807 -7.984 -18.226 850 HE2 LYS 10 2HE LYS 10 -12.955 -5.972 -20.299 851 HE3 LYS 10 1HE LYS 10 -13.801 -7.444 -19.686 852 HZ1 LYS 10 3HZ LYS 10 -13.032 -5.008 -18.104 853 HZ2 LYS 10 1HZ LYS 10 -13.595 -6.451 -17.414 854 HZ3 LYS 10 2HZ LYS 10 -14.572 -5.615 -18.527 855 H ALA 11 H ALA 11 -7.760 -6.468 -15.873 856 HA ALA 11 HA ALA 11 -9.393 -4.506 -14.839 857 HB1 ALA 11 1HB ALA 11 -6.942 -5.752 -13.457 858 HB2 ALA 11 2HB ALA 11 -8.571 -6.517 -13.554 859 HB3 ALA 11 3HB ALA 11 -8.360 -4.975 -12.658 860 H GLU 12 H GLU 12 -5.934 -4.371 -15.707 861 HA GLU 12 HA GLU 12 -5.409 -1.873 -14.513 862 HB2 GLU 12 2HB GLU 12 -3.612 -3.520 -15.415 863 HB3 GLU 12 1HB GLU 12 -4.045 -2.946 -17.053 864 HG2 GLU 12 2HG GLU 12 -3.486 -0.530 -16.147 865 HG3 GLU 12 1HG GLU 12 -2.793 -1.361 -14.712 866 H GLU 13 H GLU 13 -6.737 -2.827 -17.707 867 HA GLU 13 HA GLU 13 -6.411 -0.324 -18.943 868 HB2 GLU 13 2HB GLU 13 -8.504 -2.499 -19.555 869 HB3 GLU 13 1HB GLU 13 -8.117 -1.100 -20.612 870 HG2 GLU 13 2HG GLU 13 -5.802 -1.960 -20.971 871 HG3 GLU 13 1HG GLU 13 -6.125 -3.326 -19.843 872 H GLU 14 H GLU 14 -9.198 -1.818 -17.209 873 HA GLU 14 HA GLU 14 -10.790 0.504 -17.619 874 HB2 GLU 14 2HB GLU 14 -12.345 -0.552 -15.835 875 HB3 GLU 14 1HB GLU 14 -12.156 -1.235 -17.458 876 HG2 GLU 14 2HG GLU 14 -10.228 -2.737 -16.110 877 HG3 GLU 14 1HG GLU 14 -11.376 -2.419 -14.787 878 H LEU 15 H LEU 15 -8.379 -0.318 -15.155 879 HA LEU 15 HA LEU 15 -9.245 1.577 -13.296 880 HB2 LEU 15 2HB LEU 15 -7.506 -0.110 -12.764 881 HB3 LEU 15 1HB LEU 15 -6.360 0.693 -13.878 882 HG LEU 15 HG LEU 15 -6.284 2.700 -12.456 883 HD11 LEU 15 1HD1 LEU 15 -8.590 2.858 -11.591 884 HD12 LEU 15 2HD1 LEU 15 -7.442 2.794 -10.221 885 HD13 LEU 15 3HD1 LEU 15 -8.386 1.325 -10.664 886 HD21 LEU 15 3HD2 LEU 15 -4.743 0.814 -11.900 887 HD22 LEU 15 1HD2 LEU 15 -5.952 0.160 -10.736 888 HD23 LEU 15 2HD2 LEU 15 -5.194 1.762 -10.437 889 H GLN 16 H GLN 16 -7.212 1.921 -16.224 890 HA GLN 16 HA GLN 16 -6.454 4.596 -15.736 891 HB2 GLN 16 2HB GLN 16 -6.885 3.260 -18.465 892 HB3 GLN 16 1HB GLN 16 -5.998 4.794 -18.177 893 HG2 GLN 16 2HG GLN 16 -5.116 2.005 -17.145 894 HG3 GLN 16 1HG GLN 16 -4.526 2.811 -18.630 895 HE21 GLN 16 1HE2 GLN 16 -4.445 2.891 -15.063 896 HE22 GLN 16 2HE2 GLN 16 -3.104 3.985 -14.926 897 H LYS 17 H LYS 17 -9.333 3.150 -17.263 898 HA LYS 17 HA LYS 17 -10.503 5.528 -18.189 899 HB2 LYS 17 2HB LYS 17 -11.217 3.172 -18.796 900 HB3 LYS 17 1HB LYS 17 -11.918 2.967 -17.174 901 HG2 LYS 17 2HG LYS 17 -12.853 5.022 -19.287 902 HG3 LYS 17 1HG LYS 17 -13.522 3.374 -19.078 903 HD2 LYS 17 2HD LYS 17 -13.810 5.732 -17.130 904 HD3 LYS 17 1HD LYS 17 -15.055 4.976 -18.158 905 HE2 LYS 17 2HE LYS 17 -14.850 2.822 -16.802 906 HE3 LYS 17 1HE LYS 17 -13.654 3.649 -15.734 907 HZ1 LYS 17 3HZ LYS 17 -16.547 3.956 -15.911 908 HZ2 LYS 17 1HZ LYS 17 -15.716 5.389 -15.628 909 HZ3 LYS 17 2HZ LYS 17 -15.566 4.065 -14.561 910 H VAL 18 H VAL 18 -10.801 3.782 -15.028 911 HA VAL 18 HA VAL 18 -12.830 5.444 -14.041 912 HB VAL 18 HB VAL 18 -10.775 3.793 -12.478 913 HG11 VAL 18 1HG1 VAL 18 -12.578 3.934 -10.636 914 HG12 VAL 18 2HG1 VAL 18 -13.395 5.209 -11.591 915 HG13 VAL 18 3HG1 VAL 18 -11.734 5.483 -10.938 916 HG21 VAL 18 3HG2 VAL 18 -13.715 3.201 -13.249 917 HG22 VAL 18 1HG2 VAL 18 -12.618 2.130 -12.313 918 HG23 VAL 18 2HG2 VAL 18 -12.295 2.456 -14.043 919 H LEU 19 H LEU 19 -9.247 5.591 -13.586 920 HA LEU 19 HA LEU 19 -9.450 7.846 -11.894 921 HB2 LEU 19 2HB LEU 19 -7.086 8.044 -11.962 922 HB3 LEU 19 1HB LEU 19 -7.513 6.317 -11.896 923 HG LEU 19 HG LEU 19 -7.183 6.445 -14.547 924 HD11 LEU 19 1HD1 LEU 19 -6.645 8.932 -14.687 925 HD12 LEU 19 2HD1 LEU 19 -5.274 7.906 -15.215 926 HD13 LEU 19 3HD1 LEU 19 -5.249 8.663 -13.584 927 HD21 LEU 19 3HD2 LEU 19 -5.934 4.972 -12.998 928 HD22 LEU 19 1HD2 LEU 19 -4.844 6.340 -12.550 929 HD23 LEU 19 2HD2 LEU 19 -4.831 5.697 -14.230 930 H GLU 20 H GLU 20 -9.117 7.508 -15.478 931 HA GLU 20 HA GLU 20 -8.666 10.225 -15.958 932 HB2 GLU 20 2HB GLU 20 -10.074 8.154 -17.730 933 HB3 GLU 20 1HB GLU 20 -9.943 9.884 -18.171 934 HG2 GLU 20 2HG GLU 20 -7.368 9.637 -17.868 935 HG3 GLU 20 1HG GLU 20 -7.654 7.866 -17.985 936 H GLU 21 H GLU 21 -11.709 8.362 -15.570 937 HA GLU 21 HA GLU 21 -13.379 10.486 -16.273 938 HB2 GLU 21 2HB GLU 21 -13.997 8.104 -16.305 939 HB3 GLU 21 1HB GLU 21 -13.985 8.030 -14.516 940 HG2 GLU 21 2HG GLU 21 -16.015 9.274 -14.330 941 HG3 GLU 21 1HG GLU 21 -15.781 10.077 -15.928 942 H ALA 22 H ALA 22 -11.987 9.476 -13.171 943 HA ALA 22 HA ALA 22 -13.336 11.329 -11.541 944 HB1 ALA 22 1HB ALA 22 -11.515 10.944 -9.890 945 HB2 ALA 22 2HB ALA 22 -10.496 10.185 -11.165 946 HB3 ALA 22 3HB ALA 22 -12.013 9.377 -10.631 947 H SER 23 H SER 23 -10.496 11.620 -13.628 948 HA SER 23 HA SER 23 -9.409 13.974 -12.601 949 HB2 SER 23 2HB SER 23 -9.476 13.279 -15.621 950 HB3 SER 23 1HB SER 23 -8.278 14.298 -14.754 951 HG SER 23 1HG SER 23 -8.728 11.489 -14.419 952 H LYS 24 H LYS 24 -12.089 13.473 -14.927 953 HA LYS 24 HA LYS 24 -12.185 16.220 -15.692 954 HB2 LYS 24 2HB LYS 24 -13.190 14.530 -17.178 955 HB3 LYS 24 1HB LYS 24 -14.292 13.985 -15.876 956 HG2 LYS 24 2HG LYS 24 -15.430 15.336 -17.636 957 HG3 LYS 24 1HG LYS 24 -15.609 16.028 -15.991 958 HD2 LYS 24 2HD LYS 24 -13.960 17.800 -16.481 959 HD3 LYS 24 1HD LYS 24 -13.543 17.034 -18.048 960 HE2 LYS 24 2HE LYS 24 -14.989 19.064 -18.318 961 HE3 LYS 24 1HE LYS 24 -15.756 17.573 -18.986 962 HZ1 LYS 24 3HZ LYS 24 -17.234 19.056 -17.751 963 HZ2 LYS 24 1HZ LYS 24 -16.470 18.744 -16.302 964 HZ3 LYS 24 2HZ LYS 24 -17.242 17.482 -17.149 965 H LYS 25 H LYS 25 -13.810 14.231 -13.208 966 HA LYS 25 HA LYS 25 -15.489 16.366 -12.324 967 HB2 LYS 25 2HB LYS 25 -14.559 13.729 -11.045 968 HB3 LYS 25 1HB LYS 25 -15.632 14.854 -10.164 969 HG2 LYS 25 2HG LYS 25 -16.514 13.788 -12.913 970 HG3 LYS 25 1HG LYS 25 -16.600 12.773 -11.439 971 HD2 LYS 25 2HD LYS 25 -18.741 13.691 -11.475 972 HD3 LYS 25 1HD LYS 25 -17.852 14.670 -10.271 973 HE2 LYS 25 2HE LYS 25 -17.479 16.210 -12.580 974 HE3 LYS 25 1HE LYS 25 -19.045 15.437 -12.980 975 HZ1 LYS 25 3HZ LYS 25 -20.086 16.684 -11.378 976 HZ2 LYS 25 1HZ LYS 25 -18.754 17.656 -11.707 977 HZ3 LYS 25 2HZ LYS 25 -18.770 16.670 -10.297 978 H ALA 26 H ALA 26 -12.175 15.390 -11.659 979 HA ALA 26 HA ALA 26 -11.868 16.584 -9.197 980 HB1 ALA 26 1HB ALA 26 -9.437 16.584 -9.613 981 HB2 ALA 26 2HB ALA 26 -9.714 16.345 -11.374 982 HB3 ALA 26 3HB ALA 26 -10.153 15.043 -10.206 983 H VAL 27 H VAL 27 -11.631 18.052 -12.483 984 HA VAL 27 HA VAL 27 -10.864 20.595 -11.267 985 HB VAL 27 HB VAL 27 -9.622 19.845 -13.188 986 HG11 VAL 27 1HG1 VAL 27 -11.296 18.466 -14.358 987 HG12 VAL 27 2HG1 VAL 27 -10.688 19.741 -15.467 988 HG13 VAL 27 3HG1 VAL 27 -12.312 19.909 -14.711 989 HG21 VAL 27 3HG2 VAL 27 -9.750 21.962 -14.500 990 HG22 VAL 27 1HG2 VAL 27 -9.807 22.237 -12.722 991 HG23 VAL 27 2HG2 VAL 27 -11.291 22.392 -13.715 992 H GLU 28 H GLU 28 -13.242 19.720 -10.352 993 HA GLU 28 HA GLU 28 -14.957 21.857 -11.170 994 HB2 GLU 28 2HB GLU 28 -15.838 19.910 -12.596 995 HB3 GLU 28 1HB GLU 28 -16.088 18.979 -11.084 996 HG2 GLU 28 2HG GLU 28 -17.650 20.819 -10.258 997 HG3 GLU 28 1HG GLU 28 -17.435 21.683 -11.823 998 H ALA 29 H ALA 29 -14.308 18.825 -9.428 999 HA ALA 29 HA ALA 29 -15.254 19.652 -6.929 1000 HB1 ALA 29 1HB ALA 29 -13.194 17.499 -7.724 1001 HB2 ALA 29 2HB ALA 29 -14.977 17.240 -7.597 1002 HB3 ALA 29 3HB ALA 29 -14.007 17.597 -6.127 1003 H GLU 30 H GLU 30 -14.074 21.856 -7.386 1004 HA GLU 30 HA GLU 30 -12.167 22.338 -5.569 1005 HB2 GLU 30 2HB GLU 30 -10.062 22.768 -6.815 1006 HB3 GLU 30 1HB GLU 30 -10.501 21.059 -6.856 1007 HG2 GLU 30 2HG GLU 30 -9.909 21.305 -9.053 1008 HG3 GLU 30 1HG GLU 30 -11.656 21.643 -9.199 1009 H ARG 31 H ARG 31 -13.821 23.088 -8.575 1010 HA ARG 31 HA ARG 31 -12.890 25.775 -8.706 1011 HB2 ARG 31 2HB ARG 31 -15.195 24.415 -10.187 1012 HB3 ARG 31 1HB ARG 31 -14.612 26.069 -10.552 1013 HG2 ARG 31 2HG ARG 31 -12.772 23.631 -10.880 1014 HG3 ARG 31 1HG ARG 31 -14.039 24.031 -12.062 1015 HD2 ARG 31 2HD ARG 31 -12.075 24.999 -12.960 1016 HD3 ARG 31 1HD ARG 31 -13.041 26.397 -12.332 1017 HE ARG 31 HE ARG 31 -10.818 24.956 -10.869 1018 HH11 ARG 31 1HH2 ARG 31 -11.760 28.258 -11.938 1019 HH12 ARG 31 2HH2 ARG 31 -11.795 28.959 -10.364 1020 HH21 ARG 31 1HH1 ARG 31 -10.380 25.912 -8.881 1021 HH22 ARG 31 2HH1 ARG 31 -10.519 27.621 -8.567 1022 H GLY 32 H GLY 32 -13.597 26.152 -6.347 1023 HA2 GLY 32 2HA GLY 32 -15.322 28.159 -6.163 1024 HA3 GLY 32 1HA GLY 32 -16.400 26.706 -6.007 1025 H ALA 33 H ALA 33 -14.427 24.956 -4.684 1026 HA ALA 33 HA ALA 33 -14.991 25.981 -2.112 1027 HB1 ALA 33 1HB ALA 33 -15.223 23.602 -2.608 1028 HB2 ALA 33 2HB ALA 33 -14.078 23.851 -1.245 1029 HB3 ALA 33 3HB ALA 33 -13.444 23.489 -2.896 1030 HA PRO 34 HA PRO 34 -10.963 27.485 -1.103 1031 HB2 PRO 34 2HB PRO 34 -10.819 27.116 1.683 1032 HB3 PRO 34 1HB PRO 34 -11.877 28.351 0.901 1033 HG2 PRO 34 2HG PRO 34 -12.664 25.529 1.804 1034 HG3 PRO 34 1HG PRO 34 -13.512 27.095 2.166 1035 HD2 PRO 34 2HD PRO 34 -14.345 25.481 0.112 1036 HD3 PRO 34 1HD PRO 34 -14.284 27.287 -0.123 1037 H GLY 35 H GLY 35 -8.770 26.816 -0.575 1038 HA2 GLY 35 2HA GLY 35 -7.091 25.368 -0.385 1039 HA3 GLY 35 1HA GLY 35 -8.222 24.305 0.537 1040 H ALA 36 H ALA 36 -8.380 25.469 -2.806 1041 HA ALA 36 HA ALA 36 -9.324 22.998 -3.746 1042 HB1 ALA 36 1HB ALA 36 -9.955 24.987 -4.978 1043 HB2 ALA 36 2HB ALA 36 -8.849 24.108 -6.078 1044 HB3 ALA 36 3HB ALA 36 -8.240 25.519 -5.169 1045 H ALA 37 H ALA 37 -6.261 24.737 -4.381 1046 HA ALA 37 HA ALA 37 -4.252 24.107 -4.970 1047 HB1 ALA 37 1HB ALA 37 -4.198 22.764 -2.882 1048 HB2 ALA 37 2HB ALA 37 -3.225 21.993 -4.188 1049 HB3 ALA 37 3HB ALA 37 -4.860 21.351 -3.777 1050 H LEU 38 H LEU 38 -6.894 22.631 -6.409 1051 HA LEU 38 HA LEU 38 -5.329 21.130 -8.376 1052 HB2 LEU 38 2HB LEU 38 -7.069 20.182 -6.522 1053 HB3 LEU 38 1HB LEU 38 -8.284 20.639 -7.732 1054 HG LEU 38 HG LEU 38 -5.925 18.703 -8.185 1055 HD11 LEU 38 1HD1 LEU 38 -7.477 17.882 -6.423 1056 HD12 LEU 38 2HD1 LEU 38 -7.565 16.861 -7.903 1057 HD13 LEU 38 3HD1 LEU 38 -8.869 18.061 -7.554 1058 HD21 LEU 38 3HD2 LEU 38 -6.716 19.549 -10.375 1059 HD22 LEU 38 1HD2 LEU 38 -8.419 19.179 -9.930 1060 HD23 LEU 38 2HD2 LEU 38 -7.232 17.839 -10.154 1061 H ILE 39 H ILE 39 -5.924 24.009 -8.508 1062 HA ILE 39 HA ILE 39 -8.253 24.575 -9.894 1063 HB ILE 39 HB ILE 39 -7.227 26.816 -10.111 1064 HG12 ILE 39 2HG1 ILE 39 -4.722 25.518 -8.801 1065 HG13 ILE 39 1HG1 ILE 39 -4.826 26.017 -10.518 1066 HG21 ILE 39 1HG2 ILE 39 -7.180 27.248 -7.697 1067 HG22 ILE 39 2HG2 ILE 39 -6.749 25.543 -7.324 1068 HG23 ILE 39 3HG2 ILE 39 -8.369 25.933 -7.993 1069 HD11 ILE 39 3HD ILE 39 -5.053 27.896 -8.075 1070 HD12 ILE 39 1HD ILE 39 -3.685 27.763 -9.233 1071 HD13 ILE 39 2HD ILE 39 -5.275 28.395 -9.793 1072 H SER 40 H SER 40 -7.106 22.490 -11.587 1073 HA SER 40 HA SER 40 -6.936 23.975 -14.006 1074 HB2 SER 40 2HB SER 40 -4.557 24.259 -12.972 1075 HB3 SER 40 1HB SER 40 -4.351 22.501 -13.223 1076 HG SER 40 1HG SER 40 -3.753 22.995 -15.082 1077 H TYR 41 H TYR 41 -7.234 22.741 -15.765 1078 HA TYR 41 HA TYR 41 -8.345 20.151 -15.374 1079 HB2 TYR 41 2HB TYR 41 -9.627 21.512 -16.851 1080 HB3 TYR 41 1HB TYR 41 -8.169 22.090 -17.714 1081 HD1 TYR 41 1HD TYR 41 -9.257 18.477 -17.055 1082 HD2 TYR 41 2HD TYR 41 -8.578 21.623 -19.918 1083 HE1 TYR 41 1HE TYR 41 -9.451 16.853 -18.887 1084 HE2 TYR 41 2HE TYR 41 -8.796 20.004 -21.752 1085 HH TYR 41 HH TYR 41 -9.104 16.497 -21.213 1086 HA PRO 42 HA PRO 42 -5.173 18.415 -18.184 1087 HB2 PRO 42 2HB PRO 42 -2.673 19.650 -18.752 1088 HB3 PRO 42 1HB PRO 42 -4.158 19.814 -19.765 1089 HG2 PRO 42 2HG PRO 42 -3.135 21.701 -17.581 1090 HG3 PRO 42 1HG PRO 42 -3.737 22.132 -19.236 1091 HD2 PRO 42 2HD PRO 42 -5.356 22.327 -17.017 1092 HD3 PRO 42 1HD PRO 42 -6.038 21.688 -18.586 1093 H ASP 43 H ASP 43 -4.226 20.081 -15.358 1094 HA ASP 43 HA ASP 43 -2.113 18.297 -14.624 1095 HB2 ASP 43 2HB ASP 43 -3.480 20.443 -12.895 1096 HB3 ASP 43 1HB ASP 43 -1.833 19.739 -12.712 1097 H ALA 44 H ALA 44 -5.525 18.206 -14.609 1098 HA ALA 44 HA ALA 44 -5.983 17.096 -12.046 1099 HB1 ALA 44 1HB ALA 44 -7.711 16.882 -14.593 1100 HB2 ALA 44 2HB ALA 44 -7.826 18.176 -13.345 1101 HB3 ALA 44 3HB ALA 44 -8.227 16.479 -12.914 1102 H ILE 45 H ILE 45 -5.371 15.776 -15.291 1103 HA ILE 45 HA ILE 45 -5.651 13.053 -14.411 1104 HB ILE 45 HB ILE 45 -6.421 13.915 -16.587 1105 HG12 ILE 45 2HG1 ILE 45 -4.322 11.686 -16.859 1106 HG13 ILE 45 1HG1 ILE 45 -6.020 11.510 -16.309 1107 HG21 ILE 45 1HG2 ILE 45 -3.441 14.199 -17.333 1108 HG22 ILE 45 2HG2 ILE 45 -4.550 15.576 -16.965 1109 HG23 ILE 45 3HG2 ILE 45 -4.861 14.536 -18.380 1110 HD11 ILE 45 3HD ILE 45 -5.113 12.490 -19.110 1111 HD12 ILE 45 1HD ILE 45 -5.779 10.878 -18.707 1112 HD13 ILE 45 2HD ILE 45 -6.823 12.335 -18.557 1113 H TRP 46 H TRP 46 -3.455 15.075 -13.387 1114 HA TRP 46 HA TRP 46 -1.144 13.274 -13.739 1115 HB2 TRP 46 2HB TRP 46 -1.064 16.029 -13.727 1116 HB3 TRP 46 1HB TRP 46 -0.989 15.758 -11.963 1117 HD1 TRP 46 HD TRP 46 1.235 16.006 -14.931 1118 HE1 TRP 46 1HE TRP 46 3.597 15.022 -14.428 1119 HE3 TRP 46 3HE TRP 46 0.258 13.809 -10.416 1120 HZ2 TRP 46 2HZ TRP 46 4.746 13.288 -12.564 1121 HZ3 TRP 46 3HZ TRP 46 2.059 12.526 -9.310 1122 HH2 TRP 46 HH TRP 46 4.238 12.254 -10.357 1123 H TRP 47 H TRP 47 -3.048 15.113 -11.321 1124 HA TRP 47 HA TRP 47 -2.435 13.703 -9.081 1125 HB2 TRP 47 2HB TRP 47 -3.642 15.850 -8.991 1126 HB3 TRP 47 1HB TRP 47 -5.043 15.145 -9.873 1127 HD1 TRP 47 HD TRP 47 -3.269 14.642 -6.377 1128 HE1 TRP 47 1HE TRP 47 -4.990 13.751 -4.741 1129 HE3 TRP 47 3HE TRP 47 -7.174 14.210 -9.623 1130 HZ2 TRP 47 2HZ TRP 47 -7.723 12.814 -4.851 1131 HZ3 TRP 47 3HZ TRP 47 -9.301 13.243 -8.828 1132 HH2 TRP 47 HH TRP 47 -9.579 12.560 -6.471 1133 H SER 48 H SER 48 -5.135 13.005 -11.417 1134 HA SER 48 HA SER 48 -6.255 11.073 -9.851 1135 HB2 SER 48 2HB SER 48 -6.240 11.104 -12.889 1136 HB3 SER 48 1HB SER 48 -7.428 10.279 -11.802 1137 HG SER 48 1HG SER 48 -7.802 12.490 -12.697 1138 H VAL 49 H VAL 49 -3.248 10.807 -11.656 1139 HA VAL 49 HA VAL 49 -3.329 7.964 -11.951 1140 HB VAL 49 HB VAL 49 -0.938 9.886 -11.945 1141 HG11 VAL 49 1HG1 VAL 49 -1.265 6.963 -12.926 1142 HG12 VAL 49 2HG1 VAL 49 -0.255 7.519 -11.540 1143 HG13 VAL 49 3HG1 VAL 49 0.166 8.011 -13.215 1144 HG21 VAL 49 3HG2 VAL 49 -2.588 10.515 -13.709 1145 HG22 VAL 49 1HG2 VAL 49 -2.701 8.796 -14.251 1146 HG23 VAL 49 2HG2 VAL 49 -1.163 9.716 -14.451 1147 H GLU 50 H GLU 50 -1.694 10.301 -9.740 1148 HA GLU 50 HA GLU 50 -0.409 8.712 -7.997 1149 HB2 GLU 50 2HB GLU 50 -2.065 11.280 -7.570 1150 HB3 GLU 50 1HB GLU 50 -1.236 10.545 -6.191 1151 HG2 GLU 50 2HG GLU 50 0.248 11.368 -8.762 1152 HG3 GLU 50 1HG GLU 50 0.022 12.440 -7.324 1153 H THR 51 H THR 51 -3.801 9.729 -7.743 1154 HA THR 51 HA THR 51 -4.154 8.495 -5.230 1155 HB THR 51 HB THR 51 -5.274 10.571 -5.947 1156 HG1 THR 51 1HG THR 51 -6.251 9.423 -4.355 1157 HG21 THR 51 3HG2 THR 51 -7.176 10.516 -7.537 1158 HG22 THR 51 1HG2 THR 51 -6.915 8.755 -7.835 1159 HG23 THR 51 2HG2 THR 51 -5.661 9.941 -8.312 1160 H ALA 52 H ALA 52 -4.510 7.391 -8.571 1161 HA ALA 52 HA ALA 52 -6.187 5.163 -7.920 1162 HB1 ALA 52 1HB ALA 52 -4.423 5.653 -10.399 1163 HB2 ALA 52 2HB ALA 52 -6.139 6.166 -10.233 1164 HB3 ALA 52 3HB ALA 52 -5.723 4.410 -10.247 1165 H THR 53 H THR 53 -2.640 5.797 -8.144 1166 HA THR 53 HA THR 53 -2.045 3.004 -7.865 1167 HB THR 53 HB THR 53 0.345 4.070 -7.484 1168 HG1 THR 53 1HG THR 53 -0.399 6.222 -7.204 1169 HG21 THR 53 3HG2 THR 53 -0.451 2.857 -9.543 1170 HG22 THR 53 1HG2 THR 53 0.547 4.297 -9.968 1171 HG23 THR 53 2HG2 THR 53 -1.247 4.370 -10.130 1172 H THR 54 H THR 54 -3.357 5.128 -5.734 1173 HA THR 54 HA THR 54 -3.385 5.486 -3.618 1174 HB THR 54 HB THR 54 -3.157 3.408 -2.066 1175 HG1 THR 54 1HG THR 54 -2.078 2.312 -3.950 1176 HG21 THR 54 3HG2 THR 54 -5.258 4.569 -2.867 1177 HG22 THR 54 1HG2 THR 54 -5.447 2.789 -2.773 1178 HG23 THR 54 2HG2 THR 54 -5.221 3.583 -4.378 1179 H VAL 55 H VAL 55 -1.333 6.767 -4.303 1180 HA VAL 55 HA VAL 55 0.628 6.178 -2.187 1181 HB VAL 55 HB VAL 55 1.198 7.580 -4.865 1182 HG11 VAL 55 1HG1 VAL 55 2.962 6.836 -2.423 1183 HG12 VAL 55 2HG1 VAL 55 2.533 8.502 -2.957 1184 HG13 VAL 55 3HG1 VAL 55 3.578 7.478 -3.990 1185 HG21 VAL 55 3HG2 VAL 55 2.659 5.499 -5.204 1186 HG22 VAL 55 1HG2 VAL 55 0.896 5.148 -5.230 1187 HG23 VAL 55 2HG2 VAL 55 1.862 4.766 -3.762 1188 H GLY 56 H GLY 56 -0.100 9.070 -4.311 1189 HA2 GLY 56 2HA GLY 56 -1.408 10.817 -3.745 1190 HA3 GLY 56 1HA GLY 56 -1.605 10.172 -2.066 1191 H TYR 57 H TYR 57 1.090 11.181 -4.235 1192 HA TYR 57 HA TYR 57 2.887 11.806 -2.354 1193 HB2 TYR 57 2HB TYR 57 2.557 12.194 -5.197 1194 HB3 TYR 57 1HB TYR 57 3.109 13.778 -4.612 1195 HD1 TYR 57 2HD TYR 57 5.123 13.259 -2.566 1196 HD2 TYR 57 1HD TYR 57 4.241 11.029 -6.139 1197 HE1 TYR 57 2HE TYR 57 7.476 12.545 -2.706 1198 HE2 TYR 57 1HE TYR 57 6.582 10.293 -6.260 1199 HH TYR 57 HH TYR 57 9.017 11.210 -3.783 1200 H GLY 58 H GLY 58 0.085 13.745 -2.816 1201 HA2 GLY 58 2HA GLY 58 -0.541 15.551 -1.591 1202 HA3 GLY 58 1HA GLY 58 1.145 15.727 -0.980 1203 H ASP 59 H ASP 59 0.447 15.397 -4.322 1204 HA ASP 59 HA ASP 59 1.539 17.874 -5.168 1205 HB2 ASP 59 2HB ASP 59 1.740 15.818 -6.515 1206 HB3 ASP 59 1HB ASP 59 -0.035 15.564 -6.494 1207 H ARG 60 H ARG 60 -1.840 16.475 -5.394 1208 HA ARG 60 HA ARG 60 -2.902 19.097 -4.792 1209 HB2 ARG 60 2HB ARG 60 -4.308 17.571 -7.027 1210 HB3 ARG 60 1HB ARG 60 -4.314 19.331 -6.638 1211 HG2 ARG 60 2HG ARG 60 -1.819 19.289 -7.421 1212 HG3 ARG 60 1HG ARG 60 -2.165 17.633 -8.022 1213 HD2 ARG 60 2HD ARG 60 -4.109 18.811 -9.417 1214 HD3 ARG 60 1HD ARG 60 -3.207 20.347 -9.082 1215 HE ARG 60 HE ARG 60 -2.528 18.223 -10.956 1216 HH11 ARG 60 1HH2 ARG 60 -0.777 20.549 -8.848 1217 HH12 ARG 60 2HH2 ARG 60 0.555 19.544 -8.874 1218 HH21 ARG 60 1HH1 ARG 60 0.019 17.265 -10.286 1219 HH22 ARG 60 2HH1 ARG 60 0.924 18.320 -10.988 1220 H TYR 61 H TYR 61 -5.463 18.681 -4.321 1221 HA TYR 61 HA TYR 61 -6.225 16.043 -3.968 1222 HB2 TYR 61 2HB TYR 61 -4.514 16.400 -1.970 1223 HB3 TYR 61 1HB TYR 61 -5.639 17.662 -1.367 1224 HD1 TYR 61 1HD TYR 61 -6.244 14.202 -2.872 1225 HD2 TYR 61 2HD TYR 61 -6.436 16.732 0.610 1226 HE1 TYR 61 1HE TYR 61 -7.313 12.395 -1.621 1227 HE2 TYR 61 2HE TYR 61 -7.418 14.872 1.887 1228 HH TYR 61 HH TYR 61 -7.591 12.570 1.864 1229 HA PRO 62 HA PRO 62 -9.635 19.073 -3.724 1230 HB2 PRO 62 2HB PRO 62 -11.883 17.391 -3.659 1231 HB3 PRO 62 1HB PRO 62 -10.878 17.626 -5.131 1232 HG2 PRO 62 2HG PRO 62 -10.655 15.357 -3.070 1233 HG3 PRO 62 1HG PRO 62 -10.776 15.220 -4.877 1234 HD2 PRO 62 2HD PRO 62 -8.347 15.167 -3.551 1235 HD3 PRO 62 1HD PRO 62 -8.508 15.996 -5.163 1236 H VAL 63 H VAL 63 -11.836 19.300 -2.257 1237 HA VAL 63 HA VAL 63 -10.984 18.759 0.496 1238 HB VAL 63 HB VAL 63 -10.427 21.027 -0.347 1239 HG11 VAL 63 1HG1 VAL 63 -12.263 22.650 -0.726 1240 HG12 VAL 63 2HG1 VAL 63 -13.493 21.349 -0.620 1241 HG13 VAL 63 3HG1 VAL 63 -12.262 21.344 -1.942 1242 HG21 VAL 63 3HG2 VAL 63 -11.119 22.263 1.574 1243 HG22 VAL 63 1HG2 VAL 63 -10.780 20.584 2.105 1244 HG23 VAL 63 2HG2 VAL 63 -12.486 21.168 1.944 1245 H THR 64 H THR 64 -12.960 19.272 2.023 1246 HA THR 64 HA THR 64 -14.807 17.418 1.828 1247 HB THR 64 HB THR 64 -15.081 20.173 3.183 1248 HG1 THR 64 1HG THR 64 -14.051 19.009 4.941 1249 HG21 THR 64 3HG2 THR 64 -17.152 18.696 3.359 1250 HG22 THR 64 1HG2 THR 64 -16.366 19.018 4.938 1251 HG23 THR 64 2HG2 THR 64 -16.156 17.426 4.150 1252 H GLU 65 H GLU 65 -15.242 20.826 0.841 1253 HA GLU 65 HA GLU 65 -17.996 20.557 0.347 1254 HB2 GLU 65 2HB GLU 65 -16.763 22.643 1.049 1255 HB3 GLU 65 1HB GLU 65 -16.044 22.742 -0.595 1256 HG2 GLU 65 2HG GLU 65 -18.216 23.212 -1.594 1257 HG3 GLU 65 1HG GLU 65 -19.094 22.757 -0.090 1258 H GLU 66 H GLU 66 -15.260 19.445 -1.363 1259 HA GLU 66 HA GLU 66 -16.670 19.553 -3.907 1260 HB2 GLU 66 2HB GLU 66 -13.745 19.069 -3.255 1261 HB3 GLU 66 1HB GLU 66 -14.484 19.126 -4.874 1262 HG2 GLU 66 2HG GLU 66 -14.516 21.473 -2.871 1263 HG3 GLU 66 1HG GLU 66 -13.326 21.265 -4.189 1264 H GLY 67 H GLY 67 -16.652 17.654 -1.331 1265 HA2 GLY 67 2HA GLY 67 -17.377 15.556 -1.079 1266 HA3 GLY 67 1HA GLY 67 -17.440 15.379 -2.888 1267 H ARG 68 H ARG 68 -15.222 15.351 -0.018 1268 HA ARG 68 HA ARG 68 -12.897 14.842 -1.422 1269 HB2 ARG 68 2HB ARG 68 -12.820 15.422 0.945 1270 HB3 ARG 68 1HB ARG 68 -13.742 13.948 1.396 1271 HG2 ARG 68 2HG ARG 68 -11.947 12.493 1.103 1272 HG3 ARG 68 1HG ARG 68 -11.099 13.544 -0.070 1273 HD2 ARG 68 2HD ARG 68 -11.365 14.172 2.941 1274 HD3 ARG 68 1HD ARG 68 -9.919 13.433 2.135 1275 HE ARG 68 HE ARG 68 -10.166 15.570 0.545 1276 HH11 ARG 68 1HH2 ARG 68 -9.581 15.103 4.039 1277 HH12 ARG 68 2HH2 ARG 68 -9.471 16.736 4.410 1278 HH21 ARG 68 1HH1 ARG 68 -9.245 17.679 0.946 1279 HH22 ARG 68 2HH1 ARG 68 -8.863 18.169 2.560 1280 H LYS 69 H LYS 69 -15.587 12.814 -0.811 1281 HA LYS 69 HA LYS 69 -14.578 10.282 -1.172 1282 HB2 LYS 69 2HB LYS 69 -17.276 11.436 -2.064 1283 HB3 LYS 69 1HB LYS 69 -16.868 9.687 -1.921 1284 HG2 LYS 69 2HG LYS 69 -16.406 9.935 0.497 1285 HG3 LYS 69 1HG LYS 69 -16.729 11.693 0.440 1286 HD2 LYS 69 2HD LYS 69 -18.538 10.515 1.464 1287 HD3 LYS 69 1HD LYS 69 -19.117 11.315 -0.043 1288 HE2 LYS 69 2HE LYS 69 -19.316 9.146 -1.183 1289 HE3 LYS 69 1HE LYS 69 -18.364 8.314 0.107 1290 HZ1 LYS 69 3HZ LYS 69 -20.965 8.203 0.110 1291 HZ2 LYS 69 1HZ LYS 69 -20.857 9.697 0.881 1292 HZ3 LYS 69 2HZ LYS 69 -20.069 8.364 1.554 1293 H VAL 70 H VAL 70 -14.569 12.910 -3.503 1294 HA VAL 70 HA VAL 70 -14.546 11.395 -5.849 1295 HB VAL 70 HB VAL 70 -13.271 14.056 -5.084 1296 HG11 VAL 70 1HG1 VAL 70 -12.921 14.431 -7.566 1297 HG12 VAL 70 2HG1 VAL 70 -13.300 12.696 -7.873 1298 HG13 VAL 70 3HG1 VAL 70 -11.843 13.156 -6.917 1299 HG21 VAL 70 3HG2 VAL 70 -15.822 13.865 -5.231 1300 HG22 VAL 70 1HG2 VAL 70 -15.640 13.302 -6.934 1301 HG23 VAL 70 2HG2 VAL 70 -15.124 14.966 -6.460 1302 H ALA 71 H ALA 71 -11.994 12.009 -3.401 1303 HA ALA 71 HA ALA 71 -9.930 10.795 -4.999 1304 HB1 ALA 71 1HB ALA 71 -9.363 12.461 -3.187 1305 HB2 ALA 71 2HB ALA 71 -8.580 10.865 -2.909 1306 HB3 ALA 71 3HB ALA 71 -10.034 11.335 -1.954 1307 H GLU 72 H GLU 72 -11.915 9.881 -2.171 1308 HA GLU 72 HA GLU 72 -11.049 7.362 -1.649 1309 HB2 GLU 72 2HB GLU 72 -12.898 8.609 -0.353 1310 HB3 GLU 72 1HB GLU 72 -14.004 8.235 -1.714 1311 HG2 GLU 72 2HG GLU 72 -13.522 5.704 -1.203 1312 HG3 GLU 72 1HG GLU 72 -12.745 6.286 0.311 1313 H GLN 73 H GLN 73 -13.483 8.361 -4.066 1314 HA GLN 73 HA GLN 73 -14.303 5.903 -4.933 1315 HB2 GLN 73 2HB GLN 73 -15.330 8.111 -5.485 1316 HB3 GLN 73 1HB GLN 73 -13.980 8.492 -6.584 1317 HG2 GLN 73 2HG GLN 73 -15.915 6.078 -6.907 1318 HG3 GLN 73 1HG GLN 73 -16.246 7.700 -7.601 1319 HE21 GLN 73 1HE2 GLN 73 -13.582 8.383 -8.513 1320 HE22 GLN 73 2HE2 GLN 73 -13.235 7.339 -9.858 1321 H VAL 74 H VAL 74 -11.456 7.830 -6.109 1322 HA VAL 74 HA VAL 74 -10.972 5.995 -8.234 1323 HB VAL 74 HB VAL 74 -8.736 7.732 -7.093 1324 HG11 VAL 74 1HG1 VAL 74 -8.193 7.881 -9.544 1325 HG12 VAL 74 2HG1 VAL 74 -9.659 6.896 -9.934 1326 HG13 VAL 74 3HG1 VAL 74 -8.298 6.170 -9.005 1327 HG21 VAL 74 3HG2 VAL 74 -11.230 8.766 -8.562 1328 HG22 VAL 74 1HG2 VAL 74 -9.637 9.623 -8.547 1329 HG23 VAL 74 2HG2 VAL 74 -10.488 9.321 -7.007 1330 H MET 75 H MET 75 -9.669 6.591 -4.981 1331 HA MET 75 HA MET 75 -7.573 4.785 -5.003 1332 HB2 MET 75 2HB MET 75 -9.414 5.735 -2.734 1333 HB3 MET 75 1HB MET 75 -7.917 4.780 -2.439 1334 HG2 MET 75 2HG MET 75 -6.477 6.499 -3.031 1335 HG3 MET 75 1HG MET 75 -7.634 7.253 -4.145 1336 HE1 MET 75 3HE MET 75 -9.146 6.377 -0.552 1337 HE2 MET 75 1HE MET 75 -8.356 7.622 0.458 1338 HE3 MET 75 2HE MET 75 -7.367 6.334 -0.304 1339 H LYS 76 H LYS 76 -11.012 4.319 -4.008 1340 HA LYS 76 HA LYS 76 -10.662 1.700 -3.127 1341 HB2 LYS 76 2HB LYS 76 -12.673 3.164 -2.651 1342 HB3 LYS 76 1HB LYS 76 -13.237 2.889 -4.331 1343 HG2 LYS 76 2HG LYS 76 -13.483 0.443 -3.864 1344 HG3 LYS 76 1HG LYS 76 -12.698 0.656 -2.265 1345 HD2 LYS 76 2HD LYS 76 -14.580 2.197 -1.571 1346 HD3 LYS 76 1HD LYS 76 -15.445 1.812 -3.094 1347 HE2 LYS 76 2HE LYS 76 -14.571 -0.279 -0.960 1348 HE3 LYS 76 1HE LYS 76 -16.201 0.496 -1.021 1349 HZ1 LYS 76 3HZ LYS 76 -15.054 -1.231 -3.216 1350 HZ2 LYS 76 1HZ LYS 76 -16.619 -0.528 -3.117 1351 HZ3 LYS 76 2HZ LYS 76 -16.107 -1.686 -1.974 1352 H ALA 77 H ALA 77 -11.500 2.995 -6.364 1353 HA ALA 77 HA ALA 77 -11.945 0.478 -7.553 1354 HB1 ALA 77 1HB ALA 77 -10.937 3.088 -8.857 1355 HB2 ALA 77 2HB ALA 77 -12.665 2.640 -8.635 1356 HB3 ALA 77 3HB ALA 77 -11.618 1.667 -9.736 1357 H GLY 78 H GLY 78 -9.012 2.511 -7.194 1358 HA2 GLY 78 2HA GLY 78 -7.294 0.956 -8.752 1359 HA3 GLY 78 1HA GLY 78 -6.857 2.071 -7.401 1360 H ILE 79 H ILE 79 -7.943 0.848 -5.218 1361 HA ILE 79 HA ILE 79 -6.110 -1.154 -4.627 1362 HB ILE 79 HB ILE 79 -8.765 -0.431 -3.297 1363 HG12 ILE 79 2HG1 ILE 79 -5.847 0.120 -2.437 1364 HG13 ILE 79 1HG1 ILE 79 -6.836 1.273 -3.366 1365 HG21 ILE 79 1HG2 ILE 79 -6.535 -2.329 -2.271 1366 HG22 ILE 79 2HG2 ILE 79 -8.231 -2.798 -2.664 1367 HG23 ILE 79 3HG2 ILE 79 -7.910 -1.722 -1.278 1368 HD11 ILE 79 3HD ILE 79 -7.492 0.248 -0.521 1369 HD12 ILE 79 1HD ILE 79 -6.895 1.879 -0.980 1370 HD13 ILE 79 2HD ILE 79 -8.537 1.347 -1.501 1371 H GLU 80 H GLU 80 -9.623 -1.433 -5.504 1372 HA GLU 80 HA GLU 80 -9.644 -4.209 -5.195 1373 HB2 GLU 80 2HB GLU 80 -11.472 -2.446 -6.915 1374 HB3 GLU 80 1HB GLU 80 -11.731 -4.196 -6.604 1375 HG2 GLU 80 2HG GLU 80 -11.834 -3.704 -4.100 1376 HG3 GLU 80 1HG GLU 80 -11.712 -1.954 -4.472 1377 H VAL 81 H VAL 81 -8.704 -2.213 -7.994 1378 HA VAL 81 HA VAL 81 -8.654 -4.322 -9.857 1379 HB VAL 81 HB VAL 81 -7.392 -1.568 -9.696 1380 HG11 VAL 81 1HG1 VAL 81 -6.831 -3.687 -11.875 1381 HG12 VAL 81 2HG1 VAL 81 -5.634 -2.770 -10.891 1382 HG13 VAL 81 3HG1 VAL 81 -6.620 -1.921 -12.119 1383 HG21 VAL 81 3HG2 VAL 81 -8.977 -1.154 -11.567 1384 HG22 VAL 81 1HG2 VAL 81 -9.865 -1.908 -10.200 1385 HG23 VAL 81 2HG2 VAL 81 -9.414 -2.899 -11.634 1386 H PHE 82 H PHE 82 -5.901 -2.837 -7.984 1387 HA PHE 82 HA PHE 82 -4.067 -4.726 -8.999 1388 HB2 PHE 82 2HB PHE 82 -3.936 -3.070 -6.386 1389 HB3 PHE 82 1HB PHE 82 -2.555 -4.014 -7.063 1390 HD1 PHE 82 1HD PHE 82 -2.114 -3.531 -9.694 1391 HD2 PHE 82 2HD PHE 82 -3.913 -0.786 -6.911 1392 HE1 PHE 82 1HE PHE 82 -1.448 -1.633 -11.128 1393 HE2 PHE 82 2HE PHE 82 -3.261 1.099 -8.346 1394 HZ PHE 82 HZ PHE 82 -2.021 0.694 -10.458 1395 H ALA 83 H ALA 83 -6.160 -4.701 -6.118 1396 HA ALA 83 HA ALA 83 -5.046 -6.937 -4.878 1397 HB1 ALA 83 1HB ALA 83 -7.183 -7.066 -3.602 1398 HB2 ALA 83 2HB ALA 83 -7.968 -5.958 -4.792 1399 HB3 ALA 83 3HB ALA 83 -6.638 -5.364 -3.735 1400 H LEU 84 H LEU 84 -7.569 -6.645 -7.432 1401 HA LEU 84 HA LEU 84 -8.412 -9.318 -7.379 1402 HB2 LEU 84 2HB LEU 84 -9.648 -7.447 -8.430 1403 HB3 LEU 84 1HB LEU 84 -8.412 -7.303 -9.710 1404 HG LEU 84 HG LEU 84 -9.844 -9.975 -9.303 1405 HD11 LEU 84 1HD1 LEU 84 -11.677 -8.300 -9.162 1406 HD12 LEU 84 2HD1 LEU 84 -11.769 -9.233 -10.697 1407 HD13 LEU 84 3HD1 LEU 84 -11.135 -7.543 -10.704 1408 HD21 LEU 84 3HD2 LEU 84 -8.088 -9.849 -11.095 1409 HD22 LEU 84 1HD2 LEU 84 -8.947 -8.459 -11.853 1410 HD23 LEU 84 2HD2 LEU 84 -9.718 -10.087 -11.807 1411 H VAL 85 H VAL 85 -5.710 -7.692 -8.982 1412 HA VAL 85 HA VAL 85 -5.023 -9.750 -10.740 1413 HB VAL 85 HB VAL 85 -3.359 -7.498 -9.525 1414 HG11 VAL 85 1HG1 VAL 85 -1.848 -7.827 -11.547 1415 HG12 VAL 85 2HG1 VAL 85 -2.665 -9.407 -11.856 1416 HG13 VAL 85 3HG1 VAL 85 -1.741 -9.139 -10.334 1417 HG21 VAL 85 3HG2 VAL 85 -5.381 -6.810 -10.916 1418 HG22 VAL 85 1HG2 VAL 85 -4.773 -7.805 -12.270 1419 HG23 VAL 85 2HG2 VAL 85 -3.835 -6.377 -11.707 1420 H THR 86 H THR 86 -4.718 -9.610 -7.268 1421 HA THR 86 HA THR 86 -2.512 -11.220 -6.932 1422 HB THR 86 HB THR 86 -4.922 -11.311 -5.086 1423 HG1 THR 86 1HG THR 86 -4.608 -9.247 -5.241 1424 HG21 THR 86 3HG2 THR 86 -2.976 -12.869 -4.555 1425 HG22 THR 86 1HG2 THR 86 -3.089 -11.524 -3.378 1426 HG23 THR 86 2HG2 THR 86 -1.838 -11.473 -4.669 1427 H ALA 87 H ALA 87 -5.619 -12.086 -8.269 1428 HA ALA 87 HA ALA 87 -5.574 -14.852 -7.807 1429 HB1 ALA 87 1HB ALA 87 -7.494 -13.560 -8.859 1430 HB2 ALA 87 2HB ALA 87 -7.018 -14.992 -9.846 1431 HB3 ALA 87 3HB ALA 87 -6.509 -13.325 -10.332 1432 H ALA 88 H ALA 88 -3.742 -12.795 -10.050 1433 HA ALA 88 HA ALA 88 -2.862 -15.032 -11.626 1434 HB1 ALA 88 1HB ALA 88 -1.355 -13.300 -12.775 1435 HB2 ALA 88 2HB ALA 88 -1.868 -12.094 -11.556 1436 HB3 ALA 88 3HB ALA 88 -3.068 -12.719 -12.732 1437 H LEU 89 H LEU 89 -1.674 -12.946 -9.006 1438 HA LEU 89 HA LEU 89 0.912 -14.085 -9.004 1439 HB2 LEU 89 2HB LEU 89 -0.605 -12.564 -6.799 1440 HB3 LEU 89 1HB LEU 89 1.059 -13.186 -6.615 1441 HG LEU 89 HG LEU 89 1.228 -10.895 -7.057 1442 HD11 LEU 89 1HD1 LEU 89 2.036 -12.307 -9.685 1443 HD12 LEU 89 2HD1 LEU 89 2.935 -12.392 -8.124 1444 HD13 LEU 89 3HD1 LEU 89 2.743 -10.815 -8.967 1445 HD21 LEU 89 3HD2 LEU 89 -0.917 -10.368 -8.140 1446 HD22 LEU 89 1HD2 LEU 89 -0.377 -11.157 -9.677 1447 HD23 LEU 89 2HD2 LEU 89 0.465 -9.693 -9.055 1448 H ALA 90 H ALA 90 -2.141 -14.946 -7.389 1449 HA ALA 90 HA ALA 90 -1.006 -16.739 -5.599 1450 HB1 ALA 90 1HB ALA 90 -3.291 -17.673 -5.334 1451 HB2 ALA 90 2HB ALA 90 -3.817 -16.819 -6.840 1452 HB3 ALA 90 3HB ALA 90 -3.338 -15.876 -5.381 1453 H THR 91 H THR 91 -1.742 -17.156 -9.053 1454 HA THR 91 HA THR 91 -1.344 -20.038 -8.756 1455 HB THR 91 HB THR 91 -3.176 -19.338 -10.150 1456 HG1 THR 91 1HG THR 91 -1.024 -20.654 -11.356 1457 HG21 THR 91 3HG2 THR 91 -2.363 -17.203 -11.040 1458 HG22 THR 91 1HG2 THR 91 -2.758 -18.301 -12.402 1459 HG23 THR 91 2HG2 THR 91 -1.035 -18.015 -11.946 1460 H ASP 92 H ASP 92 0.707 -17.416 -8.681 1461 HA ASP 92 HA ASP 92 2.436 -18.166 -10.796 1462 HB2 ASP 92 2HB ASP 92 2.126 -15.823 -9.623 1463 HB3 ASP 92 1HB ASP 92 3.364 -16.405 -8.473 1464 H PHE 93 H PHE 93 2.159 -18.921 -7.341 1465 HA PHE 93 HA PHE 93 4.672 -20.201 -7.176 1466 HB2 PHE 93 2HB PHE 93 4.133 -20.968 -5.058 1467 HB3 PHE 93 1HB PHE 93 3.200 -19.450 -5.175 1468 HD1 PHE 93 1HD PHE 93 2.958 -23.174 -5.119 1469 HD2 PHE 93 2HD PHE 93 0.799 -19.467 -4.989 1470 HE1 PHE 93 1HE PHE 93 0.953 -24.371 -4.289 1471 HE2 PHE 93 2HE PHE 93 -1.200 -20.653 -4.173 1472 HZ PHE 93 HZ PHE 93 -1.130 -23.109 -3.799 1473 H VAL 94 H VAL 94 1.540 -21.220 -8.349 1474 HA VAL 94 HA VAL 94 1.820 -23.965 -7.933 1475 HB VAL 94 HB VAL 94 0.076 -22.507 -9.987 1476 HG11 VAL 94 1HG1 VAL 94 -0.166 -25.298 -8.650 1477 HG12 VAL 94 2HG1 VAL 94 0.131 -24.973 -10.395 1478 HG13 VAL 94 3HG1 VAL 94 -1.443 -24.527 -9.655 1479 HG21 VAL 94 3HG2 VAL 94 -0.448 -23.244 -7.019 1480 HG22 VAL 94 1HG2 VAL 94 -1.654 -22.541 -8.153 1481 HG23 VAL 94 2HG2 VAL 94 -0.238 -21.574 -7.642 1482 H ARG 95 H ARG 95 3.111 -21.801 -10.308 1483 HA ARG 95 HA ARG 95 3.581 -23.552 -12.417 1484 HB2 ARG 95 2HB ARG 95 5.145 -21.092 -11.460 1485 HB3 ARG 95 1HB ARG 95 5.427 -21.941 -13.009 1486 HG2 ARG 95 2HG ARG 95 3.148 -21.463 -13.783 1487 HG3 ARG 95 1HG ARG 95 2.760 -20.597 -12.247 1488 HD2 ARG 95 2HD ARG 95 4.428 -18.859 -12.703 1489 HD3 ARG 95 1HD ARG 95 5.086 -19.772 -14.108 1490 HE ARG 95 HE ARG 95 3.103 -19.403 -15.382 1491 HH11 ARG 95 1HH2 ARG 95 3.646 -17.127 -12.574 1492 HH12 ARG 95 2HH2 ARG 95 2.779 -15.878 -13.260 1493 HH21 ARG 95 1HH1 ARG 95 1.808 -17.560 -16.292 1494 HH22 ARG 95 2HH1 ARG 95 1.550 -16.182 -15.336 1495 H ARG 96 H ARG 96 5.219 -23.342 -9.211 1496 HA ARG 96 HA ARG 96 7.577 -24.542 -10.213 1497 HB2 ARG 96 2HB ARG 96 8.358 -25.052 -8.043 1498 HB3 ARG 96 1HB ARG 96 7.767 -23.373 -8.075 1499 HG2 ARG 96 2HG ARG 96 6.019 -23.822 -6.588 1500 HG3 ARG 96 1HG ARG 96 5.839 -25.521 -7.132 1501 HD2 ARG 96 2HD ARG 96 8.051 -26.088 -5.929 1502 HD3 ARG 96 1HD ARG 96 8.054 -24.412 -5.265 1503 HE ARG 96 HE ARG 96 6.130 -24.918 -3.957 1504 HH11 ARG 96 1HH2 ARG 96 7.135 -28.108 -5.215 1505 HH12 ARG 96 2HH2 ARG 96 5.552 -28.567 -5.763 1506 HH21 ARG 96 1HH1 ARG 96 3.906 -25.968 -3.961 1507 HH22 ARG 96 2HH1 ARG 96 3.751 -27.522 -4.694 1508 H GLU 97 H GLU 97 4.420 -25.920 -9.468 1509 HA GLU 97 HA GLU 97 5.429 -28.571 -9.045 1510 HB2 GLU 97 2HB GLU 97 2.635 -27.704 -10.002 1511 HB3 GLU 97 1HB GLU 97 3.084 -29.339 -9.409 1512 HG2 GLU 97 2HG GLU 97 3.116 -26.767 -7.683 1513 HG3 GLU 97 1HG GLU 97 1.758 -27.937 -7.800 1514 H GLU 98 H GLU 98 4.296 -26.592 -11.764 1515 HA GLU 98 HA GLU 98 4.322 -28.706 -13.642 1516 HB2 GLU 98 2HB GLU 98 4.533 -25.691 -14.231 1517 HB3 GLU 98 1HB GLU 98 4.025 -27.010 -15.330 1518 HG2 GLU 98 2HG GLU 98 2.099 -27.424 -13.506 1519 HG3 GLU 98 1HG GLU 98 2.520 -25.760 -12.946 1520 H GLU 99 H GLU 99 6.587 -26.074 -12.757 1521 HA GLU 99 HA GLU 99 8.588 -26.482 -14.569 1522 HB2 GLU 99 2HB GLU 99 8.297 -24.601 -12.809 1523 HB3 GLU 99 1HB GLU 99 8.923 -25.744 -11.592 1524 HG2 GLU 99 2HG GLU 99 10.754 -24.337 -12.167 1525 HG3 GLU 99 1HG GLU 99 11.099 -25.890 -13.005 1526 H ARG 100 H ARG 100 8.064 -28.003 -11.390 1527 HA ARG 100 HA ARG 100 10.420 -29.372 -11.120 1528 HB2 ARG 100 2HB ARG 100 8.759 -28.966 -9.324 1529 HB3 ARG 100 1HB ARG 100 7.599 -30.094 -10.102 1530 HG2 ARG 100 2HG ARG 100 9.006 -32.014 -9.517 1531 HG3 ARG 100 1HG ARG 100 10.386 -30.943 -9.102 1532 HD2 ARG 100 2HD ARG 100 9.308 -31.852 -7.061 1533 HD3 ARG 100 1HD ARG 100 9.213 -30.052 -7.114 1534 HE ARG 100 HE ARG 100 6.824 -30.326 -7.977 1535 HH11 ARG 100 1HH2 ARG 100 8.161 -32.540 -5.486 1536 HH12 ARG 100 2HH2 ARG 100 6.779 -33.512 -5.366 1537 HH21 ARG 100 1HH1 ARG 100 4.831 -30.987 -6.969 1538 HH22 ARG 100 2HH1 ARG 100 4.737 -32.483 -6.148 1539 H ARG 101 H ARG 101 7.377 -30.459 -12.706 1540 HA ARG 101 HA ARG 101 8.685 -32.985 -13.450 1541 HB2 ARG 101 2HB ARG 101 5.813 -31.970 -13.858 1542 HB3 ARG 101 1HB ARG 101 6.450 -33.509 -14.544 1543 HG2 ARG 101 2HG ARG 101 7.093 -34.271 -12.265 1544 HG3 ARG 101 1HG ARG 101 6.278 -32.835 -11.545 1545 HD2 ARG 101 2HD ARG 101 4.069 -33.598 -12.306 1546 HD3 ARG 101 1HD ARG 101 4.804 -34.888 -13.355 1547 HE ARG 101 HE ARG 101 5.779 -35.885 -11.246 1548 HH11 ARG 101 1HH2 ARG 101 2.420 -34.606 -11.484 1549 HH12 ARG 101 2HH2 ARG 101 1.933 -35.191 -9.956 1550 HH21 ARG 101 1HH1 ARG 101 5.128 -36.660 -9.118 1551 HH22 ARG 101 2HH1 ARG 101 3.505 -36.567 -8.619 1552 H GLY 102 H GLY 102 8.242 -29.808 -14.734 1553 HA2 GLY 102 2HA GLY 102 8.940 -28.953 -16.646 1554 HA3 GLY 102 1HA GLY 102 9.438 -30.591 -17.212 1555 H HIS 103 H HIS 103 6.227 -30.054 -15.999 1556 HA HIS 103 HA HIS 103 4.229 -30.295 -16.888 1557 HB2 HIS 103 2HB HIS 103 5.281 -28.098 -18.163 1558 HB3 HIS 103 1HB HIS 103 4.837 -29.072 -19.588 1559 HD1 HIS 103 1HD HIS 103 2.007 -29.938 -19.266 1560 HD2 HIS 103 2HD HIS 103 3.351 -26.544 -17.121 1561 HE1 HIS 103 1HE HIS 103 -0.022 -28.664 -18.460 1562 HE2 HIS 103 2HE HIS 103 0.914 -26.750 -16.972 1563 H1 SER 1 H SER 1 17.898 -22.671 -1.711 1564 HA SER 1 HA SER 1 15.978 -21.047 -0.474 1565 HB2 SER 1 2HB SER 1 18.125 -19.544 -0.943 1566 HB3 SER 1 1HB SER 1 17.768 -19.823 -2.679 1567 HG SER 1 1HG SER 1 16.832 -17.935 -2.071 1568 H ALA 2 H ALA 2 14.145 -21.370 -1.880 1569 HA ALA 2 HA ALA 2 14.577 -23.545 -3.727 1570 HB1 ALA 2 1HB ALA 2 12.685 -23.646 -2.053 1571 HB2 ALA 2 2HB ALA 2 12.109 -23.793 -3.743 1572 HB3 ALA 2 3HB ALA 2 11.925 -22.230 -2.868 1573 H ASP 3 H ASP 3 12.871 -23.427 -5.621 1574 HA ASP 3 HA ASP 3 13.713 -22.009 -7.712 1575 HB2 ASP 3 2HB ASP 3 11.157 -22.382 -8.502 1576 HB3 ASP 3 1HB ASP 3 12.211 -23.786 -8.175 1577 H HIS 4 H HIS 4 10.654 -21.264 -6.166 1578 HA HIS 4 HA HIS 4 10.457 -18.705 -7.241 1579 HB2 HIS 4 2HB HIS 4 8.473 -18.425 -5.775 1580 HB3 HIS 4 1HB HIS 4 8.469 -20.037 -6.562 1581 HD1 HIS 4 1HD HIS 4 9.072 -22.090 -4.981 1582 HD2 HIS 4 2HD HIS 4 9.261 -18.416 -3.012 1583 HE1 HIS 4 1HE HIS 4 9.043 -22.565 -2.432 1584 HE2 HIS 4 2HE HIS 4 9.422 -20.200 -1.363 1585 H GLU 5 H GLU 5 12.318 -19.662 -4.436 1586 HA GLU 5 HA GLU 5 11.879 -17.189 -2.990 1587 HB2 GLU 5 2HB GLU 5 14.129 -19.244 -2.682 1588 HB3 GLU 5 1HB GLU 5 13.759 -17.919 -1.538 1589 HG2 GLU 5 2HG GLU 5 11.792 -20.233 -2.119 1590 HG3 GLU 5 1HG GLU 5 13.084 -20.303 -0.873 1591 H ARG 6 H ARG 6 14.315 -18.690 -5.199 1592 HA ARG 6 HA ARG 6 16.047 -16.429 -5.020 1593 HB2 ARG 6 2HB ARG 6 15.979 -18.629 -7.156 1594 HB3 ARG 6 1HB ARG 6 17.260 -17.376 -6.957 1595 HG2 ARG 6 2HG ARG 6 17.604 -18.205 -4.570 1596 HG3 ARG 6 1HG ARG 6 16.508 -19.584 -4.950 1597 HD2 ARG 6 2HD ARG 6 18.114 -20.267 -6.819 1598 HD3 ARG 6 1HD ARG 6 19.235 -18.941 -6.323 1599 HE ARG 6 HE ARG 6 18.524 -21.434 -4.806 1600 HH11 ARG 6 1HH2 ARG 6 20.256 -18.224 -4.585 1601 HH12 ARG 6 2HH2 ARG 6 21.381 -18.791 -3.429 1602 HH21 ARG 6 1HH1 ARG 6 20.049 -22.139 -3.165 1603 HH22 ARG 6 2HH1 ARG 6 21.116 -21.067 -2.446 1604 H GLU 7 H GLU 7 13.301 -17.287 -7.154 1605 HA GLU 7 HA GLU 7 13.960 -15.179 -8.941 1606 HB2 GLU 7 2HB GLU 7 12.631 -17.356 -9.394 1607 HB3 GLU 7 1HB GLU 7 11.186 -16.414 -8.913 1608 HG2 GLU 7 2HG GLU 7 11.445 -14.916 -10.802 1609 HG3 GLU 7 1HG GLU 7 13.190 -15.305 -10.980 1610 H ALA 8 H ALA 8 12.118 -15.372 -5.944 1611 HA ALA 8 HA ALA 8 10.899 -12.839 -6.091 1612 HB1 ALA 8 1HB ALA 8 10.216 -14.521 -4.365 1613 HB2 ALA 8 2HB ALA 8 10.832 -13.043 -3.541 1614 HB3 ALA 8 3HB ALA 8 11.870 -14.493 -3.658 1615 H GLN 9 H GLN 9 14.023 -13.985 -4.767 1616 HA GLN 9 HA GLN 9 14.937 -11.545 -3.792 1617 HB2 GLN 9 2HB GLN 9 15.932 -13.857 -3.321 1618 HB3 GLN 9 1HB GLN 9 16.619 -13.850 -4.980 1619 HG2 GLN 9 2HG GLN 9 17.961 -11.768 -4.364 1620 HG3 GLN 9 1HG GLN 9 17.252 -11.855 -2.711 1621 HE21 GLN 9 1HE2 GLN 9 19.389 -12.119 -1.825 1622 HE22 GLN 9 2HE2 GLN 9 20.348 -13.544 -2.015 1623 H LYS 10 H LYS 10 15.259 -13.057 -7.008 1624 HA LYS 10 HA LYS 10 17.016 -11.251 -8.163 1625 HB2 LYS 10 2HB LYS 10 16.268 -13.474 -9.161 1626 HB3 LYS 10 1HB LYS 10 14.673 -12.733 -9.520 1627 HG2 LYS 10 2HG LYS 10 15.854 -11.021 -10.997 1628 HG3 LYS 10 1HG LYS 10 17.397 -11.885 -10.714 1629 HD2 LYS 10 2HD LYS 10 14.855 -13.034 -12.071 1630 HD3 LYS 10 1HD LYS 10 16.304 -12.359 -12.888 1631 HE2 LYS 10 2HE LYS 10 17.673 -14.203 -11.582 1632 HE3 LYS 10 1HE LYS 10 16.072 -15.000 -11.296 1633 HZ1 LYS 10 3HZ LYS 10 17.239 -15.795 -13.289 1634 HZ2 LYS 10 1HZ LYS 10 17.241 -14.235 -13.929 1635 HZ3 LYS 10 2HZ LYS 10 15.772 -15.046 -13.757 1636 H ALA 11 H ALA 11 13.497 -11.070 -7.675 1637 HA ALA 11 HA ALA 11 12.995 -9.012 -9.492 1638 HB1 ALA 11 1HB ALA 11 11.441 -9.642 -6.905 1639 HB2 ALA 11 2HB ALA 11 11.221 -10.510 -8.469 1640 HB3 ALA 11 3HB ALA 11 10.824 -8.764 -8.351 1641 H GLU 12 H GLU 12 14.146 -8.958 -6.108 1642 HA GLU 12 HA GLU 12 13.651 -6.232 -5.631 1643 HB2 GLU 12 2HB GLU 12 15.856 -8.029 -4.435 1644 HB3 GLU 12 1HB GLU 12 15.328 -6.440 -3.788 1645 HG2 GLU 12 2HG GLU 12 13.012 -7.405 -3.398 1646 HG3 GLU 12 1HG GLU 12 13.613 -9.016 -3.939 1647 H GLU 13 H GLU 13 16.297 -7.968 -7.209 1648 HA GLU 13 HA GLU 13 18.152 -5.829 -7.173 1649 HB2 GLU 13 2HB GLU 13 17.949 -8.309 -8.983 1650 HB3 GLU 13 1HB GLU 13 19.409 -7.288 -8.812 1651 HG2 GLU 13 2HG GLU 13 18.116 -8.745 -6.379 1652 HG3 GLU 13 1HG GLU 13 19.308 -9.529 -7.457 1653 H GLU 14 H GLU 14 15.585 -6.891 -9.328 1654 HA GLU 14 HA GLU 14 16.265 -5.359 -11.597 1655 HB2 GLU 14 2HB GLU 14 14.613 -7.407 -11.335 1656 HB3 GLU 14 1HB GLU 14 13.438 -6.219 -10.731 1657 HG2 GLU 14 2HG GLU 14 12.762 -6.017 -12.889 1658 HG3 GLU 14 1HG GLU 14 14.229 -5.010 -13.149 1659 H LEU 15 H LEU 15 14.443 -4.785 -8.603 1660 HA LEU 15 HA LEU 15 13.097 -2.502 -9.417 1661 HB2 LEU 15 2HB LEU 15 12.630 -3.885 -7.312 1662 HB3 LEU 15 1HB LEU 15 14.049 -3.125 -6.548 1663 HG LEU 15 HG LEU 15 13.008 -0.874 -6.740 1664 HD11 LEU 15 1HD1 LEU 15 11.691 -1.020 -8.784 1665 HD12 LEU 15 2HD1 LEU 15 10.553 -0.688 -7.451 1666 HD13 LEU 15 3HD1 LEU 15 10.672 -2.349 -8.119 1667 HD21 LEU 15 3HD2 LEU 15 12.602 -2.238 -4.699 1668 HD22 LEU 15 1HD2 LEU 15 11.107 -2.926 -5.427 1669 HD23 LEU 15 2HD2 LEU 15 11.199 -1.173 -5.061 1670 H GLN 16 H GLN 16 16.278 -2.928 -7.838 1671 HA GLN 16 HA GLN 16 16.793 -0.191 -7.481 1672 HB2 GLN 16 2HB GLN 16 18.702 -2.567 -7.885 1673 HB3 GLN 16 1HB GLN 16 19.297 -0.907 -7.566 1674 HG2 GLN 16 2HG GLN 16 17.424 -2.462 -5.663 1675 HG3 GLN 16 1HG GLN 16 19.218 -2.322 -5.497 1676 HE21 GLN 16 1HE2 GLN 16 17.525 -1.346 -3.449 1677 HE22 GLN 16 2HE2 GLN 16 17.540 0.392 -3.439 1678 H LYS 17 H LYS 17 17.197 -2.275 -10.306 1679 HA LYS 17 HA LYS 17 18.931 -0.642 -11.752 1680 HB2 LYS 17 2HB LYS 17 18.403 -3.026 -12.309 1681 HB3 LYS 17 1HB LYS 17 16.733 -2.540 -12.752 1682 HG2 LYS 17 2HG LYS 17 17.605 -1.219 -14.686 1683 HG3 LYS 17 1HG LYS 17 19.292 -1.574 -14.172 1684 HD2 LYS 17 2HD LYS 17 18.657 -3.022 -16.055 1685 HD3 LYS 17 1HD LYS 17 18.962 -3.985 -14.566 1686 HE2 LYS 17 2HE LYS 17 16.443 -4.147 -14.189 1687 HE3 LYS 17 1HE LYS 17 16.170 -3.275 -15.748 1688 HZ1 LYS 17 3HZ LYS 17 16.832 -5.149 -16.937 1689 HZ2 LYS 17 1HZ LYS 17 16.173 -5.846 -15.513 1690 HZ3 LYS 17 2HZ LYS 17 17.850 -5.716 -15.679 1691 H VAL 18 H VAL 18 15.314 -0.665 -11.587 1692 HA VAL 18 HA VAL 18 15.172 1.300 -13.663 1693 HB VAL 18 HB VAL 18 12.760 1.440 -13.157 1694 HG11 VAL 18 1HG1 VAL 18 13.936 -1.411 -13.519 1695 HG12 VAL 18 2HG1 VAL 18 13.769 -0.170 -14.819 1696 HG13 VAL 18 3HG1 VAL 18 12.302 -0.858 -14.027 1697 HG21 VAL 18 3HG2 VAL 18 12.913 0.866 -10.659 1698 HG22 VAL 18 1HG2 VAL 18 13.336 -0.826 -11.122 1699 HG23 VAL 18 2HG2 VAL 18 11.739 -0.145 -11.565 1700 H LEU 19 H LEU 19 15.598 1.436 -10.180 1701 HA LEU 19 HA LEU 19 14.698 4.106 -9.862 1702 HB2 LEU 19 2HB LEU 19 16.729 2.444 -8.247 1703 HB3 LEU 19 1HB LEU 19 16.158 4.065 -7.753 1704 HG LEU 19 HG LEU 19 14.291 1.653 -8.176 1705 HD11 LEU 19 1HD1 LEU 19 15.902 1.262 -6.264 1706 HD12 LEU 19 2HD1 LEU 19 14.188 1.413 -5.736 1707 HD13 LEU 19 3HD1 LEU 19 15.328 2.785 -5.504 1708 HD21 LEU 19 3HD2 LEU 19 12.713 3.127 -6.796 1709 HD22 LEU 19 1HD2 LEU 19 13.082 3.779 -8.430 1710 HD23 LEU 19 2HD2 LEU 19 13.901 4.450 -6.970 1711 H GLU 20 H GLU 20 17.835 2.603 -10.664 1712 HA GLU 20 HA GLU 20 19.393 4.932 -10.619 1713 HB2 GLU 20 2HB GLU 20 19.668 2.482 -12.478 1714 HB3 GLU 20 1HB GLU 20 20.961 3.683 -12.157 1715 HG2 GLU 20 2HG GLU 20 19.748 1.879 -9.955 1716 HG3 GLU 20 1HG GLU 20 21.118 1.393 -11.008 1717 H GLU 21 H GLU 21 17.393 3.395 -13.182 1718 HA GLU 21 HA GLU 21 18.249 5.317 -15.135 1719 HB2 GLU 21 2HB GLU 21 15.720 3.578 -15.275 1720 HB3 GLU 21 1HB GLU 21 16.433 4.618 -16.560 1721 HG2 GLU 21 2HG GLU 21 18.601 3.132 -16.256 1722 HG3 GLU 21 1HG GLU 21 17.502 1.967 -15.435 1723 H ALA 22 H ALA 22 15.511 4.985 -12.864 1724 HA ALA 22 HA ALA 22 13.895 6.967 -13.835 1725 HB1 ALA 22 1HB ALA 22 14.288 6.209 -10.874 1726 HB2 ALA 22 2HB ALA 22 13.157 5.401 -12.018 1727 HB3 ALA 22 3HB ALA 22 12.893 7.117 -11.553 1728 H SER 23 H SER 23 16.782 7.297 -11.650 1729 HA SER 23 HA SER 23 16.213 9.975 -11.006 1730 HB2 SER 23 2HB SER 23 18.923 9.845 -10.639 1731 HB3 SER 23 1HB SER 23 17.730 9.118 -9.513 1732 HG SER 23 1HG SER 23 19.427 7.696 -10.169 1733 H LYS 24 H LYS 24 18.146 8.409 -13.569 1734 HA LYS 24 HA LYS 24 19.168 10.843 -14.595 1735 HB2 LYS 24 2HB LYS 24 20.141 8.538 -15.132 1736 HB3 LYS 24 1HB LYS 24 18.707 8.231 -16.166 1737 HG2 LYS 24 2HG LYS 24 19.345 10.375 -17.487 1738 HG3 LYS 24 1HG LYS 24 20.832 10.441 -16.489 1739 HD2 LYS 24 2HD LYS 24 21.519 8.196 -17.418 1740 HD3 LYS 24 1HD LYS 24 19.990 8.125 -18.361 1741 HE2 LYS 24 2HE LYS 24 21.910 8.850 -19.789 1742 HE3 LYS 24 1HE LYS 24 20.660 10.151 -19.683 1743 HZ1 LYS 24 3HZ LYS 24 22.051 11.482 -18.498 1744 HZ2 LYS 24 1HZ LYS 24 23.189 10.581 -19.380 1745 HZ3 LYS 24 2HZ LYS 24 22.905 10.168 -17.762 1746 H LYS 25 H LYS 25 16.413 8.746 -15.557 1747 HA LYS 25 HA LYS 25 15.556 10.311 -17.710 1748 HB2 LYS 25 2HB LYS 25 13.838 8.553 -15.849 1749 HB3 LYS 25 1HB LYS 25 13.274 9.283 -17.391 1750 HG2 LYS 25 2HG LYS 25 14.985 7.898 -18.651 1751 HG3 LYS 25 1HG LYS 25 15.409 7.092 -17.105 1752 HD2 LYS 25 2HD LYS 25 12.775 6.706 -16.917 1753 HD3 LYS 25 1HD LYS 25 12.775 6.969 -18.685 1754 HE2 LYS 25 2HE LYS 25 14.324 4.797 -17.095 1755 HE3 LYS 25 1HE LYS 25 12.811 4.539 -18.028 1756 HZ1 LYS 25 3HZ LYS 25 15.332 4.142 -18.860 1757 HZ2 LYS 25 1HZ LYS 25 14.929 5.589 -19.703 1758 HZ3 LYS 25 2HZ LYS 25 13.965 4.184 -19.826 1759 H ALA 26 H ALA 26 14.611 10.398 -14.187 1760 HA ALA 26 HA ALA 26 12.567 12.224 -14.523 1761 HB1 ALA 26 1HB ALA 26 14.333 11.834 -12.030 1762 HB2 ALA 26 2HB ALA 26 12.830 10.919 -12.415 1763 HB3 ALA 26 3HB ALA 26 12.735 12.678 -12.080 1764 H VAL 27 H VAL 27 16.073 12.812 -13.844 1765 HA VAL 27 HA VAL 27 15.576 15.599 -13.533 1766 HB VAL 27 HB VAL 27 18.154 14.036 -13.958 1767 HG11 VAL 27 1HG1 VAL 27 18.588 16.338 -14.741 1768 HG12 VAL 27 2HG1 VAL 27 19.212 16.206 -13.056 1769 HG13 VAL 27 3HG1 VAL 27 17.640 17.023 -13.374 1770 HG21 VAL 27 3HG2 VAL 27 18.326 14.627 -11.486 1771 HG22 VAL 27 1HG2 VAL 27 16.919 13.563 -11.833 1772 HG23 VAL 27 2HG2 VAL 27 16.665 15.316 -11.541 1773 H GLU 28 H GLU 28 16.328 13.533 -16.315 1774 HA GLU 28 HA GLU 28 16.852 15.716 -18.050 1775 HB2 GLU 28 2HB GLU 28 17.412 13.082 -18.205 1776 HB3 GLU 28 1HB GLU 28 15.828 13.015 -19.016 1777 HG2 GLU 28 2HG GLU 28 17.238 13.256 -20.835 1778 HG3 GLU 28 1HG GLU 28 16.867 14.989 -20.539 1779 H ALA 29 H ALA 29 14.009 13.891 -17.022 1780 HA ALA 29 HA ALA 29 12.206 14.642 -18.967 1781 HB1 ALA 29 1HB ALA 29 10.509 13.770 -17.404 1782 HB2 ALA 29 2HB ALA 29 11.648 13.893 -16.026 1783 HB3 ALA 29 3HB ALA 29 11.922 12.708 -17.359 1784 H GLU 30 H GLU 30 12.884 16.028 -15.727 1785 HA GLU 30 HA GLU 30 10.963 18.057 -16.055 1786 HB2 GLU 30 2HB GLU 30 12.307 17.002 -13.911 1787 HB3 GLU 30 1HB GLU 30 13.273 18.495 -14.140 1788 HG2 GLU 30 2HG GLU 30 11.439 19.021 -12.577 1789 HG3 GLU 30 1HG GLU 30 10.970 19.745 -14.172 1790 H ARG 31 H ARG 31 14.011 17.722 -17.516 1791 HA ARG 31 HA ARG 31 14.786 20.476 -17.322 1792 HB2 ARG 31 2HB ARG 31 16.357 18.456 -17.417 1793 HB3 ARG 31 1HB ARG 31 16.034 18.389 -19.176 1794 HG2 ARG 31 2HG ARG 31 16.960 20.694 -19.421 1795 HG3 ARG 31 1HG ARG 31 17.083 20.851 -17.627 1796 HD2 ARG 31 2HD ARG 31 18.809 19.011 -17.564 1797 HD3 ARG 31 1HD ARG 31 18.670 18.833 -19.363 1798 HE ARG 31 HE ARG 31 19.403 21.482 -18.055 1799 HH11 ARG 31 1HH2 ARG 31 20.560 18.773 -20.180 1800 HH12 ARG 31 2HH2 ARG 31 21.601 19.788 -21.052 1801 HH21 ARG 31 1HH1 ARG 31 20.866 22.807 -19.313 1802 HH22 ARG 31 2HH1 ARG 31 21.458 22.200 -20.824 1803 H GLY 32 H GLY 32 12.768 21.350 -18.153 1804 HA2 GLY 32 2HA GLY 32 12.657 22.570 -20.453 1805 HA3 GLY 32 1HA GLY 32 12.139 20.904 -20.949 1806 H ALA 33 H ALA 33 11.192 20.870 -17.835 1807 HA ALA 33 HA ALA 33 8.515 21.343 -18.639 1808 HB1 ALA 33 1HB ALA 33 9.675 20.461 -15.918 1809 HB2 ALA 33 2HB ALA 33 9.168 19.341 -17.219 1810 HB3 ALA 33 3HB ALA 33 7.950 20.375 -16.397 1811 HA PRO 34 HA PRO 34 8.417 25.290 -16.550 1812 HB2 PRO 34 2HB PRO 34 5.683 25.769 -16.358 1813 HB3 PRO 34 1HB PRO 34 6.575 25.769 -17.929 1814 HG2 PRO 34 2HG PRO 34 4.945 23.489 -16.687 1815 HG3 PRO 34 1HG PRO 34 4.878 24.101 -18.391 1816 HD2 PRO 34 2HD PRO 34 6.378 21.882 -17.603 1817 HD3 PRO 34 1HD PRO 34 6.933 22.988 -18.945 1818 H GLY 35 H GLY 35 8.958 25.629 -14.344 1819 HA2 GLY 35 2HA GLY 35 8.405 25.863 -12.148 1820 HA3 GLY 35 1HA GLY 35 6.926 24.855 -12.387 1821 H ALA 36 H ALA 36 10.017 23.906 -13.632 1822 HA ALA 36 HA ALA 36 9.968 21.364 -12.619 1823 HB1 ALA 36 1HB ALA 36 12.328 23.114 -13.612 1824 HB2 ALA 36 2HB ALA 36 11.285 22.061 -14.637 1825 HB3 ALA 36 3HB ALA 36 12.402 21.323 -13.446 1826 H ALA 37 H ALA 37 10.423 20.565 -10.587 1827 HA ALA 37 HA ALA 37 12.317 22.082 -8.883 1828 HB1 ALA 37 1HB ALA 37 11.091 21.073 -6.953 1829 HB2 ALA 37 2HB ALA 37 10.005 20.189 -8.093 1830 HB3 ALA 37 3HB ALA 37 9.955 21.985 -8.009 1831 H LEU 38 H LEU 38 11.597 19.013 -10.434 1832 HA LEU 38 HA LEU 38 12.844 17.301 -8.668 1833 HB2 LEU 38 2HB LEU 38 11.275 17.042 -10.895 1834 HB3 LEU 38 1HB LEU 38 12.834 16.681 -11.661 1835 HG LEU 38 HG LEU 38 11.674 14.676 -11.079 1836 HD11 LEU 38 1HD1 LEU 38 13.252 13.414 -9.677 1837 HD12 LEU 38 2HD1 LEU 38 13.943 14.924 -8.991 1838 HD13 LEU 38 3HD1 LEU 38 14.155 14.549 -10.745 1839 HD21 LEU 38 3HD2 LEU 38 11.539 15.516 -8.117 1840 HD22 LEU 38 1HD2 LEU 38 10.841 14.055 -8.897 1841 HD23 LEU 38 2HD2 LEU 38 10.196 15.672 -9.315 1842 H ILE 39 H ILE 39 13.996 19.193 -11.345 1843 HA ILE 39 HA ILE 39 16.253 18.032 -12.166 1844 HB ILE 39 HB ILE 39 15.310 19.715 -13.450 1845 HG12 ILE 39 2HG1 ILE 39 16.938 21.506 -13.835 1846 HG13 ILE 39 1HG1 ILE 39 17.809 21.127 -12.324 1847 HG21 ILE 39 1HG2 ILE 39 15.005 22.101 -12.613 1848 HG22 ILE 39 2HG2 ILE 39 15.436 21.530 -10.963 1849 HG23 ILE 39 3HG2 ILE 39 13.968 20.901 -11.796 1850 HD11 ILE 39 3HD ILE 39 17.474 19.131 -14.672 1851 HD12 ILE 39 1HD ILE 39 18.892 20.225 -14.446 1852 HD13 ILE 39 2HD ILE 39 18.550 18.956 -13.226 1853 H SER 40 H SER 40 17.484 17.065 -10.511 1854 HA SER 40 HA SER 40 19.672 18.663 -9.715 1855 HB2 SER 40 2HB SER 40 17.719 17.539 -7.601 1856 HB3 SER 40 1HB SER 40 19.465 17.835 -7.232 1857 HG SER 40 1HG SER 40 17.706 19.784 -8.316 1858 H TYR 41 H TYR 41 21.049 17.198 -10.751 1859 HA TYR 41 HA TYR 41 20.472 14.460 -10.871 1860 HB2 TYR 41 2HB TYR 41 22.800 16.154 -11.726 1861 HB3 TYR 41 1HB TYR 41 23.207 14.466 -11.304 1862 HD1 TYR 41 1HD TYR 41 22.005 12.568 -12.369 1863 HD2 TYR 41 2HD TYR 41 21.677 16.577 -13.892 1864 HE1 TYR 41 1HE TYR 41 21.347 11.681 -14.559 1865 HE2 TYR 41 2HE TYR 41 20.992 15.688 -16.088 1866 HH TYR 41 HH TYR 41 20.242 13.691 -17.278 1867 HA PRO 42 HA PRO 42 23.271 13.599 -7.248 1868 HB2 PRO 42 2HB PRO 42 23.275 15.420 -5.062 1869 HB3 PRO 42 1HB PRO 42 24.578 15.259 -6.301 1870 HG2 PRO 42 2HG PRO 42 22.258 17.255 -6.257 1871 HG3 PRO 42 1HG PRO 42 24.001 17.564 -6.628 1872 HD2 PRO 42 2HD PRO 42 22.166 17.280 -8.626 1873 HD3 PRO 42 1HD PRO 42 23.795 16.496 -8.818 1874 H ASP 43 H ASP 43 20.584 15.816 -6.258 1875 HA ASP 43 HA ASP 43 19.558 14.084 -4.338 1876 HB2 ASP 43 2HB ASP 43 18.023 16.270 -5.877 1877 HB3 ASP 43 1HB ASP 43 17.564 15.553 -4.306 1878 H ALA 44 H ALA 44 19.453 13.791 -7.699 1879 HA ALA 44 HA ALA 44 16.874 13.202 -8.342 1880 HB1 ALA 44 1HB ALA 44 18.825 13.398 -9.983 1881 HB2 ALA 44 2HB ALA 44 17.763 11.992 -10.303 1882 HB3 ALA 44 3HB ALA 44 19.367 11.773 -9.500 1883 H ILE 45 H ILE 45 19.475 10.931 -7.282 1884 HA ILE 45 HA ILE 45 17.746 8.711 -7.444 1885 HB ILE 45 HB ILE 45 20.163 8.556 -7.737 1886 HG12 ILE 45 2HG1 ILE 45 19.092 6.771 -5.466 1887 HG13 ILE 45 1HG1 ILE 45 18.706 6.588 -7.207 1888 HG21 ILE 45 1HG2 ILE 45 20.332 8.993 -4.679 1889 HG22 ILE 45 2HG2 ILE 45 20.884 10.155 -5.945 1890 HG23 ILE 45 3HG2 ILE 45 21.690 8.563 -5.763 1891 HD11 ILE 45 3HD ILE 45 21.508 6.327 -5.924 1892 HD12 ILE 45 1HD ILE 45 20.486 5.012 -6.599 1893 HD13 ILE 45 2HD ILE 45 21.172 6.256 -7.700 1894 H TRP 46 H TRP 46 18.181 11.143 -4.993 1895 HA TRP 46 HA TRP 46 17.183 9.528 -2.851 1896 HB2 TRP 46 2HB TRP 46 17.694 12.510 -3.220 1897 HB3 TRP 46 1HB TRP 46 16.566 11.992 -1.938 1898 HD1 TRP 46 HD TRP 46 17.618 11.255 0.337 1899 HE1 TRP 46 1HE TRP 46 19.915 10.800 1.200 1900 HE3 TRP 46 3HE TRP 46 20.143 11.665 -4.071 1901 HZ2 TRP 46 2HZ TRP 46 22.580 10.425 0.117 1902 HZ3 TRP 46 3HZ TRP 46 22.586 11.312 -4.087 1903 HH2 TRP 46 HH TRP 46 23.790 10.694 -2.020 1904 H TRP 47 H TRP 47 15.738 11.815 -5.235 1905 HA TRP 47 HA TRP 47 13.102 11.481 -4.278 1906 HB2 TRP 47 2HB TRP 47 13.713 13.326 -5.844 1907 HB3 TRP 47 1HB TRP 47 14.088 12.122 -7.127 1908 HD1 TRP 47 HD TRP 47 10.930 13.366 -5.085 1909 HE1 TRP 47 1HE TRP 47 8.882 12.540 -6.301 1910 HE3 TRP 47 3HE TRP 47 13.181 10.803 -8.875 1911 HZ2 TRP 47 2HZ TRP 47 8.212 11.385 -8.845 1912 HZ3 TRP 47 3HZ TRP 47 11.777 9.774 -10.628 1913 HH2 TRP 47 HH TRP 47 9.324 10.072 -10.624 1914 H SER 48 H SER 48 15.016 9.631 -6.763 1915 HA SER 48 HA SER 48 12.963 8.016 -7.595 1916 HB2 SER 48 2HB SER 48 15.878 7.085 -7.156 1917 HB3 SER 48 1HB SER 48 14.651 6.292 -8.212 1918 HG SER 48 1HG SER 48 15.948 7.547 -9.442 1919 H VAL 49 H VAL 49 15.122 7.534 -4.729 1920 HA VAL 49 HA VAL 49 13.835 5.021 -4.136 1921 HB VAL 49 HB VAL 49 15.842 6.591 -2.470 1922 HG11 VAL 49 1HG1 VAL 49 14.570 4.886 -1.114 1923 HG12 VAL 49 2HG1 VAL 49 16.247 4.334 -1.399 1924 HG13 VAL 49 3HG1 VAL 49 14.901 3.628 -2.360 1925 HG21 VAL 49 3HG2 VAL 49 16.283 4.242 -4.441 1926 HG22 VAL 49 1HG2 VAL 49 17.536 5.033 -3.430 1927 HG23 VAL 49 2HG2 VAL 49 16.759 5.938 -4.766 1928 H GLU 50 H GLU 50 11.675 6.136 -4.173 1929 HA GLU 50 HA GLU 50 10.851 5.797 -1.535 1930 HB2 GLU 50 2HB GLU 50 9.304 7.832 -1.298 1931 HB3 GLU 50 1HB GLU 50 11.002 7.983 -0.838 1932 HG2 GLU 50 2HG GLU 50 11.491 9.209 -3.014 1933 HG3 GLU 50 1HG GLU 50 9.751 9.063 -3.448 1934 H THR 51 H THR 51 10.030 6.919 -4.813 1935 HA THR 51 HA THR 51 7.341 6.323 -4.604 1936 HB THR 51 HB THR 51 7.850 7.939 -6.137 1937 HG1 THR 51 1HG THR 51 6.512 6.686 -7.279 1938 HG21 THR 51 3HG2 THR 51 10.269 7.774 -6.272 1939 HG22 THR 51 1HG2 THR 51 9.647 7.671 -7.934 1940 HG23 THR 51 2HG2 THR 51 10.184 6.168 -7.103 1941 H ALA 52 H ALA 52 10.071 4.214 -5.428 1942 HA ALA 52 HA ALA 52 8.526 2.114 -6.513 1943 HB1 ALA 52 1HB ALA 52 11.275 2.086 -5.118 1944 HB2 ALA 52 2HB ALA 52 10.936 2.105 -6.901 1945 HB3 ALA 52 3HB ALA 52 10.535 0.659 -5.924 1946 H THR 53 H THR 53 9.078 3.124 -3.152 1947 HA THR 53 HA THR 53 8.042 0.582 -2.166 1948 HB THR 53 HB THR 53 8.452 1.974 0.087 1949 HG1 THR 53 1HG THR 53 9.034 3.896 -1.102 1950 HG21 THR 53 3HG2 THR 53 10.782 1.049 0.078 1951 HG22 THR 53 1HG2 THR 53 10.697 0.814 -1.711 1952 HG23 THR 53 2HG2 THR 53 9.613 -0.131 -0.621 1953 H THR 54 H THR 54 6.669 3.110 -3.660 1954 HA THR 54 HA THR 54 4.805 4.161 -3.638 1955 HB THR 54 HB THR 54 2.728 2.843 -2.879 1956 HG1 THR 54 1HG THR 54 4.220 1.506 -1.505 1957 HG21 THR 54 3HG2 THR 54 2.990 1.349 -4.869 1958 HG22 THR 54 1HG2 THR 54 4.771 1.635 -4.884 1959 HG23 THR 54 2HG2 THR 54 3.633 2.991 -5.226 1960 H VAL 55 H VAL 55 6.166 5.511 -1.968 1961 HA VAL 55 HA VAL 55 4.181 6.503 -0.224 1962 HB VAL 55 HB VAL 55 7.022 6.318 0.948 1963 HG11 VAL 55 1HG1 VAL 55 4.197 6.611 2.214 1964 HG12 VAL 55 2HG1 VAL 55 5.293 7.989 1.893 1965 HG13 VAL 55 3HG1 VAL 55 5.764 6.732 3.087 1966 HG21 VAL 55 3HG2 VAL 55 4.790 4.222 1.291 1967 HG22 VAL 55 1HG2 VAL 55 6.183 4.394 2.407 1968 HG23 VAL 55 2HG2 VAL 55 6.465 3.946 0.690 1969 H GLY 56 H GLY 56 6.235 8.556 0.506 1970 HA2 GLY 56 2HA GLY 56 7.933 9.511 -1.242 1971 HA3 GLY 56 1HA GLY 56 6.318 9.800 -2.053 1972 H TYR 57 H TYR 57 8.467 10.862 0.476 1973 HA TYR 57 HA TYR 57 6.363 11.591 2.304 1974 HB2 TYR 57 2HB TYR 57 9.340 12.408 2.134 1975 HB3 TYR 57 1HB TYR 57 8.227 13.103 3.367 1976 HD1 TYR 57 1HD TYR 57 7.173 11.709 5.085 1977 HD2 TYR 57 2HD TYR 57 10.088 10.078 2.371 1978 HE1 TYR 57 1HE TYR 57 7.535 9.819 6.623 1979 HE2 TYR 57 2HE TYR 57 10.455 8.186 3.913 1980 HH TYR 57 HH TYR 57 8.702 7.853 7.029 1981 H GLY 58 H GLY 58 7.882 13.104 -0.432 1982 HA2 GLY 58 2HA GLY 58 6.737 14.813 -1.575 1983 HA3 GLY 58 1HA GLY 58 6.188 15.509 -0.003 1984 H ASP 59 H ASP 59 9.349 14.323 -1.165 1985 HA ASP 59 HA ASP 59 10.764 16.559 -0.070 1986 HB2 ASP 59 2HB ASP 59 11.614 14.203 -0.118 1987 HB3 ASP 59 1HB ASP 59 11.575 14.207 -1.915 1988 H ARG 60 H ARG 60 9.917 15.272 -3.373 1989 HA ARG 60 HA ARG 60 10.053 17.972 -4.378 1990 HB2 ARG 60 2HB ARG 60 11.510 15.638 -5.766 1991 HB3 ARG 60 1HB ARG 60 11.252 17.278 -6.462 1992 HG2 ARG 60 2HG ARG 60 12.585 18.265 -4.565 1993 HG3 ARG 60 1HG ARG 60 12.903 16.610 -3.948 1994 HD2 ARG 60 2HD ARG 60 14.124 16.030 -6.073 1995 HD3 ARG 60 1HD ARG 60 13.823 17.694 -6.713 1996 HE ARG 60 HE ARG 60 15.385 16.999 -4.190 1997 HH11 ARG 60 1HH2 ARG 60 14.610 19.521 -6.749 1998 HH12 ARG 60 2HH2 ARG 60 15.875 20.541 -6.234 1999 HH21 ARG 60 1HH1 ARG 60 17.337 18.297 -3.850 2000 HH22 ARG 60 2HH1 ARG 60 17.565 19.706 -4.737 2001 H TYR 61 H TYR 61 9.108 17.753 -6.810 2002 HA TYR 61 HA TYR 61 6.930 15.880 -6.797 2003 HB2 TYR 61 2HB TYR 61 5.708 18.384 -7.443 2004 HB3 TYR 61 1HB TYR 61 5.424 17.401 -5.973 2005 HD1 TYR 61 1HD TYR 61 6.496 17.953 -3.832 2006 HD2 TYR 61 2HD TYR 61 7.269 20.329 -7.329 2007 HE1 TYR 61 1HE TYR 61 7.621 19.627 -2.429 2008 HE2 TYR 61 2HE TYR 61 8.375 22.032 -5.925 2009 HH TYR 61 HH TYR 61 8.593 21.747 -2.354 2010 HA PRO 62 HA PRO 62 8.496 16.858 -10.984 2011 HB2 PRO 62 2HB PRO 62 7.011 14.871 -12.380 2012 HB3 PRO 62 1HB PRO 62 8.560 14.563 -11.510 2013 HG2 PRO 62 2HG PRO 62 5.678 14.210 -10.546 2014 HG3 PRO 62 1HG PRO 62 7.035 13.010 -10.405 2015 HD2 PRO 62 2HD PRO 62 6.227 14.664 -8.349 2016 HD3 PRO 62 1HD PRO 62 8.009 14.309 -8.591 2017 H VAL 63 H VAL 63 7.393 17.536 -13.199 2018 HA VAL 63 HA VAL 63 5.068 19.093 -12.384 2019 HB VAL 63 HB VAL 63 6.848 19.432 -14.805 2020 HG11 VAL 63 1HG1 VAL 63 4.749 21.365 -13.579 2021 HG12 VAL 63 2HG1 VAL 63 4.461 20.437 -15.090 2022 HG13 VAL 63 3HG1 VAL 63 5.770 21.633 -15.036 2023 HG21 VAL 63 3HG2 VAL 63 6.724 20.859 -12.059 2024 HG22 VAL 63 1HG2 VAL 63 7.729 21.371 -13.465 2025 HG23 VAL 63 2HG2 VAL 63 8.055 19.801 -12.654 2026 H THR 64 H THR 64 5.668 17.969 -15.762 2027 HA THR 64 HA THR 64 3.225 16.587 -15.947 2028 HB THR 64 HB THR 64 3.191 19.338 -17.346 2029 HG1 THR 64 1HG THR 64 2.525 18.743 -14.787 2030 HG21 THR 64 3HG2 THR 64 0.771 18.820 -17.706 2031 HG22 THR 64 1HG2 THR 64 0.968 17.252 -16.833 2032 HG23 THR 64 2HG2 THR 64 1.801 17.521 -18.410 2033 H GLU 65 H GLU 65 5.541 18.769 -17.512 2034 HA GLU 65 HA GLU 65 5.384 17.628 -20.070 2035 HB2 GLU 65 2HB GLU 65 6.253 20.013 -19.224 2036 HB3 GLU 65 1HB GLU 65 7.788 19.151 -18.922 2037 HG2 GLU 65 2HG GLU 65 8.055 20.204 -21.036 2038 HG3 GLU 65 1HG GLU 65 7.770 18.470 -21.420 2039 H GLU 66 H GLU 66 6.925 16.696 -17.104 2040 HA GLU 66 HA GLU 66 9.230 15.507 -18.088 2041 HB2 GLU 66 2HB GLU 66 9.023 14.157 -15.806 2042 HB3 GLU 66 1HB GLU 66 9.457 15.893 -15.837 2043 HG2 GLU 66 2HG GLU 66 7.958 15.503 -14.057 2044 HG3 GLU 66 1HG GLU 66 7.152 16.553 -15.246 2045 H GLY 67 H GLY 67 5.893 14.360 -17.650 2046 HA2 GLY 67 2HA GLY 67 5.676 12.923 -19.786 2047 HA3 GLY 67 1HA GLY 67 6.691 11.793 -18.798 2048 H ARG 68 H ARG 68 5.224 13.238 -16.367 2049 HA ARG 68 HA ARG 68 3.928 12.769 -14.934 2050 HB2 ARG 68 2HB ARG 68 1.607 12.395 -15.009 2051 HB3 ARG 68 1HB ARG 68 2.057 13.622 -16.229 2052 HG2 ARG 68 2HG ARG 68 1.720 11.973 -18.055 2053 HG3 ARG 68 1HG ARG 68 1.433 10.668 -16.873 2054 HD2 ARG 68 2HD ARG 68 -0.696 11.655 -17.963 2055 HD3 ARG 68 1HD ARG 68 -0.668 11.504 -16.168 2056 HE ARG 68 HE ARG 68 -1.234 13.653 -16.116 2057 HH11 ARG 68 1HH2 ARG 68 1.227 13.543 -18.717 2058 HH12 ARG 68 2HH2 ARG 68 0.794 15.013 -19.469 2059 HH21 ARG 68 1HH1 ARG 68 -1.720 15.890 -17.042 2060 HH22 ARG 68 2HH1 ARG 68 -0.832 16.401 -18.379 2061 H LYS 69 H LYS 69 3.909 10.206 -17.304 2062 HA LYS 69 HA LYS 69 3.591 8.194 -15.272 2063 HB2 LYS 69 2HB LYS 69 4.170 7.917 -18.268 2064 HB3 LYS 69 1HB LYS 69 4.034 6.535 -17.128 2065 HG2 LYS 69 2HG LYS 69 1.722 7.283 -16.493 2066 HG3 LYS 69 1HG LYS 69 1.780 8.517 -17.797 2067 HD2 LYS 69 2HD LYS 69 2.058 6.769 -19.511 2068 HD3 LYS 69 1HD LYS 69 2.191 5.483 -18.271 2069 HE2 LYS 69 2HE LYS 69 -0.364 7.197 -18.689 2070 HE3 LYS 69 1HE LYS 69 -0.054 5.619 -19.511 2071 HZ1 LYS 69 3HZ LYS 69 -0.246 6.010 -16.539 2072 HZ2 LYS 69 1HZ LYS 69 0.107 4.607 -17.256 2073 HZ3 LYS 69 2HZ LYS 69 -1.419 5.279 -17.540 2074 H VAL 70 H VAL 70 6.086 10.201 -15.541 2075 HA VAL 70 HA VAL 70 8.253 8.328 -15.578 2076 HB VAL 70 HB VAL 70 8.099 11.133 -14.327 2077 HG11 VAL 70 1HG1 VAL 70 10.007 9.758 -13.433 2078 HG12 VAL 70 2HG1 VAL 70 10.599 11.043 -14.536 2079 HG13 VAL 70 3HG1 VAL 70 10.509 9.335 -15.114 2080 HG21 VAL 70 3HG2 VAL 70 7.569 11.269 -16.717 2081 HG22 VAL 70 1HG2 VAL 70 8.949 10.178 -17.149 2082 HG23 VAL 70 2HG2 VAL 70 9.246 11.822 -16.467 2083 H ALA 71 H ALA 71 6.237 10.028 -13.104 2084 HA ALA 71 HA ALA 71 7.398 8.672 -10.906 2085 HB1 ALA 71 1HB ALA 71 6.119 10.804 -10.592 2086 HB2 ALA 71 2HB ALA 71 5.391 9.481 -9.618 2087 HB3 ALA 71 3HB ALA 71 4.614 9.993 -11.159 2088 H GLU 72 H GLU 72 4.345 8.178 -12.748 2089 HA GLU 72 HA GLU 72 3.338 6.052 -11.367 2090 HB2 GLU 72 2HB GLU 72 2.142 7.154 -13.366 2091 HB3 GLU 72 1HB GLU 72 3.228 6.226 -14.450 2092 HG2 GLU 72 2HG GLU 72 2.254 4.058 -13.375 2093 HG3 GLU 72 1HG GLU 72 1.061 5.126 -12.557 2094 H GLN 73 H GLN 73 5.822 5.944 -14.006 2095 HA GLN 73 HA GLN 73 5.600 3.168 -14.271 2096 HB2 GLN 73 2HB GLN 73 6.553 4.703 -16.033 2097 HB3 GLN 73 1HB GLN 73 8.059 4.814 -15.062 2098 HG2 GLN 73 2HG GLN 73 8.348 2.308 -15.304 2099 HG3 GLN 73 1HG GLN 73 6.779 2.211 -16.180 2100 HE21 GLN 73 1HE2 GLN 73 9.965 2.014 -16.834 2101 HE22 GLN 73 2HE2 GLN 73 9.992 2.695 -18.432 2102 H VAL 74 H VAL 74 7.529 5.163 -12.024 2103 HA VAL 74 HA VAL 74 9.238 2.977 -11.317 2104 HB VAL 74 HB VAL 74 8.676 5.548 -9.760 2105 HG11 VAL 74 1HG1 VAL 74 10.934 3.417 -9.622 2106 HG12 VAL 74 2HG1 VAL 74 9.726 3.800 -8.339 2107 HG13 VAL 74 3HG1 VAL 74 10.973 5.013 -8.784 2108 HG21 VAL 74 3HG2 VAL 74 10.778 6.361 -10.858 2109 HG22 VAL 74 1HG2 VAL 74 9.523 6.022 -12.086 2110 HG23 VAL 74 2HG2 VAL 74 10.866 4.851 -11.846 2111 H MET 75 H MET 75 6.238 4.459 -10.004 2112 HA MET 75 HA MET 75 6.020 2.922 -7.705 2113 HB2 MET 75 2HB MET 75 3.745 3.931 -9.535 2114 HB3 MET 75 1HB MET 75 3.529 3.323 -7.855 2115 HG2 MET 75 2HG MET 75 4.899 5.146 -6.961 2116 HG3 MET 75 1HG MET 75 5.255 5.745 -8.614 2117 HE1 MET 75 3HE MET 75 3.020 8.408 -6.762 2118 HE2 MET 75 1HE MET 75 4.515 8.203 -7.719 2119 HE3 MET 75 2HE MET 75 4.302 7.322 -6.157 2120 H LYS 76 H LYS 76 4.787 2.329 -10.993 2121 HA LYS 76 HA LYS 76 3.398 -0.005 -10.436 2122 HB2 LYS 76 2HB LYS 76 3.296 1.487 -12.502 2123 HB3 LYS 76 1HB LYS 76 4.784 0.688 -13.102 2124 HG2 LYS 76 2HG LYS 76 3.616 -1.509 -13.180 2125 HG3 LYS 76 1HG LYS 76 2.159 -0.799 -12.410 2126 HD2 LYS 76 2HD LYS 76 3.263 -0.090 -15.205 2127 HD3 LYS 76 1HD LYS 76 1.845 -1.137 -14.843 2128 HE2 LYS 76 2HE LYS 76 0.707 0.868 -13.717 2129 HE3 LYS 76 1HE LYS 76 2.092 1.896 -14.255 2130 HZ1 LYS 76 3HZ LYS 76 0.500 2.229 -15.762 2131 HZ2 LYS 76 1HZ LYS 76 0.035 0.545 -15.933 2132 HZ3 LYS 76 2HZ LYS 76 1.477 1.104 -16.590 2133 H ALA 77 H ALA 77 6.819 0.492 -11.359 2134 HA ALA 77 HA ALA 77 7.439 -2.217 -11.753 2135 HB1 ALA 77 1HB ALA 77 9.824 -1.510 -11.493 2136 HB2 ALA 77 2HB ALA 77 9.283 0.076 -10.819 2137 HB3 ALA 77 3HB ALA 77 8.930 -0.342 -12.536 2138 H GLY 78 H GLY 78 7.376 -0.152 -8.851 2139 HA2 GLY 78 2HA GLY 78 8.660 -1.951 -7.091 2140 HA3 GLY 78 1HA GLY 78 7.541 -0.591 -6.699 2141 H ILE 79 H ILE 79 5.226 -1.365 -7.915 2142 HA ILE 79 HA ILE 79 4.181 -3.184 -6.074 2143 HB ILE 79 HB ILE 79 3.054 -2.185 -8.729 2144 HG12 ILE 79 2HG1 ILE 79 2.468 -1.321 -5.816 2145 HG13 ILE 79 1HG1 ILE 79 3.582 -0.451 -6.903 2146 HG21 ILE 79 1HG2 ILE 79 1.891 -4.316 -8.060 2147 HG22 ILE 79 2HG2 ILE 79 0.805 -2.915 -7.826 2148 HG23 ILE 79 3HG2 ILE 79 1.622 -3.659 -6.405 2149 HD11 ILE 79 3HD ILE 79 0.548 -0.813 -7.359 2150 HD12 ILE 79 1HD ILE 79 1.413 0.689 -6.894 2151 HD13 ILE 79 2HD ILE 79 1.686 -0.030 -8.523 2152 H GLU 80 H GLU 80 5.230 -3.627 -9.504 2153 HA GLU 80 HA GLU 80 4.380 -6.245 -9.798 2154 HB2 GLU 80 2HB GLU 80 6.896 -4.896 -10.966 2155 HB3 GLU 80 1HB GLU 80 6.332 -6.536 -11.436 2156 HG2 GLU 80 2HG GLU 80 4.186 -5.590 -12.283 2157 HG3 GLU 80 1HG GLU 80 4.757 -3.927 -11.896 2158 H VAL 81 H VAL 81 7.618 -5.097 -8.603 2159 HA VAL 81 HA VAL 81 8.514 -7.764 -8.371 2160 HB VAL 81 HB VAL 81 10.497 -6.853 -7.249 2161 HG11 VAL 81 1HG1 VAL 81 9.558 -5.263 -9.748 2162 HG12 VAL 81 2HG1 VAL 81 10.261 -6.927 -9.759 2163 HG13 VAL 81 3HG1 VAL 81 11.254 -5.527 -9.219 2164 HG21 VAL 81 3HG2 VAL 81 9.004 -4.147 -7.433 2165 HG22 VAL 81 1HG2 VAL 81 10.725 -4.376 -7.014 2166 HG23 VAL 81 2HG2 VAL 81 9.468 -4.996 -5.912 2167 H PHE 82 H PHE 82 7.133 -5.457 -5.952 2168 HA PHE 82 HA PHE 82 7.629 -7.311 -3.832 2169 HB2 PHE 82 2HB PHE 82 5.806 -4.825 -3.956 2170 HB3 PHE 82 1HB PHE 82 6.075 -5.805 -2.463 2171 HD1 PHE 82 1HD PHE 82 8.879 -6.387 -2.302 2172 HD2 PHE 82 2HD PHE 82 6.969 -2.800 -3.732 2173 HE1 PHE 82 1HE PHE 82 10.895 -5.095 -1.760 2174 HE2 PHE 82 2HE PHE 82 8.987 -1.509 -3.172 2175 HZ PHE 82 HZ PHE 82 10.963 -2.641 -2.184 2176 H ALA 83 H ALA 83 4.972 -6.879 -6.159 2177 HA ALA 83 HA ALA 83 3.223 -8.564 -4.623 2178 HB1 ALA 83 1HB ALA 83 3.075 -7.814 -7.606 2179 HB2 ALA 83 2HB ALA 83 2.258 -6.939 -6.260 2180 HB3 ALA 83 3HB ALA 83 1.778 -8.627 -6.640 2181 H LEU 84 H LEU 84 5.630 -8.970 -7.232 2182 HA LEU 84 HA LEU 84 4.994 -11.457 -8.158 2183 HB2 LEU 84 2HB LEU 84 6.698 -9.961 -9.145 2184 HB3 LEU 84 1HB LEU 84 7.813 -10.265 -7.783 2185 HG LEU 84 HG LEU 84 6.796 -12.594 -9.495 2186 HD11 LEU 84 1HD1 LEU 84 9.066 -10.674 -10.334 2187 HD12 LEU 84 2HD1 LEU 84 7.459 -10.846 -11.137 2188 HD13 LEU 84 3HD1 LEU 84 8.622 -12.221 -11.149 2189 HD21 LEU 84 3HD2 LEU 84 9.127 -13.496 -9.114 2190 HD22 LEU 84 1HD2 LEU 84 8.266 -13.215 -7.567 2191 HD23 LEU 84 2HD2 LEU 84 9.523 -12.049 -8.120 2192 H VAL 85 H VAL 85 6.931 -10.598 -5.276 2193 HA VAL 85 HA VAL 85 7.791 -13.215 -4.817 2194 HB VAL 85 HB VAL 85 8.664 -12.537 -2.734 2195 HG11 VAL 85 1HG1 VAL 85 10.077 -10.703 -3.464 2196 HG12 VAL 85 2HG1 VAL 85 8.793 -10.001 -4.486 2197 HG13 VAL 85 3HG1 VAL 85 9.589 -11.526 -4.991 2198 HG21 VAL 85 3HG2 VAL 85 6.685 -11.350 -1.729 2199 HG22 VAL 85 1HG2 VAL 85 6.880 -10.025 -2.925 2200 HG23 VAL 85 2HG2 VAL 85 8.145 -10.308 -1.687 2201 H THR 86 H THR 86 4.609 -12.009 -4.486 2202 HA THR 86 HA THR 86 3.805 -13.373 -2.191 2203 HB THR 86 HB THR 86 2.057 -12.788 -4.622 2204 HG1 THR 86 1HG THR 86 2.842 -10.900 -4.134 2205 HG21 THR 86 3HG2 THR 86 0.277 -12.555 -2.835 2206 HG22 THR 86 1HG2 THR 86 1.469 -13.043 -1.576 2207 HG23 THR 86 2HG2 THR 86 0.953 -14.219 -2.845 2208 H ALA 87 H ALA 87 4.785 -14.544 -5.311 2209 HA ALA 87 HA ALA 87 3.534 -17.048 -5.320 2210 HB1 ALA 87 1HB ALA 87 5.460 -17.767 -6.747 2211 HB2 ALA 87 2HB ALA 87 6.418 -16.337 -6.194 2212 HB3 ALA 87 3HB ALA 87 4.971 -16.097 -7.212 2213 H ALA 88 H ALA 88 6.290 -15.787 -3.429 2214 HA ALA 88 HA ALA 88 7.093 -18.419 -2.532 2215 HB1 ALA 88 1HB ALA 88 8.652 -17.167 -1.000 2216 HB2 ALA 88 2HB ALA 88 7.878 -15.611 -1.461 2217 HB3 ALA 88 3HB ALA 88 8.829 -16.524 -2.675 2218 H LEU 89 H LEU 89 5.544 -15.475 -1.170 2219 HA LEU 89 HA LEU 89 5.105 -16.649 1.313 2220 HB2 LEU 89 2HB LEU 89 3.585 -14.320 -0.010 2221 HB3 LEU 89 1HB LEU 89 3.305 -14.868 1.669 2222 HG LEU 89 HG LEU 89 4.628 -12.938 1.782 2223 HD11 LEU 89 1HD1 LEU 89 6.534 -15.298 2.368 2224 HD12 LEU 89 2HD1 LEU 89 5.168 -14.763 3.417 2225 HD13 LEU 89 3HD1 LEU 89 6.560 -13.661 3.109 2226 HD21 LEU 89 3HD2 LEU 89 5.630 -12.907 -0.500 2227 HD22 LEU 89 1HD2 LEU 89 6.823 -14.168 0.004 2228 HD23 LEU 89 2HD2 LEU 89 6.825 -12.558 0.797 2229 H ALA 90 H ALA 90 3.121 -16.825 -1.638 2230 HA ALA 90 HA ALA 90 0.826 -17.808 -0.359 2231 HB1 ALA 90 1HB ALA 90 0.170 -18.691 -2.616 2232 HB2 ALA 90 2HB ALA 90 1.840 -18.333 -3.215 2233 HB3 ALA 90 3HB ALA 90 0.751 -16.989 -2.712 2234 H THR 91 H THR 91 3.949 -19.349 -0.967 2235 HA THR 91 HA THR 91 2.754 -21.984 -0.782 2236 HB THR 91 HB THR 91 4.975 -22.937 -0.725 2237 HG1 THR 91 1HG THR 91 5.829 -20.279 -0.480 2238 HG21 THR 91 3HG2 THR 91 5.562 -22.349 -3.083 2239 HG22 THR 91 1HG2 THR 91 4.546 -20.868 -2.970 2240 HG23 THR 91 2HG2 THR 91 3.772 -22.490 -2.871 2241 H ASP 92 H ASP 92 3.488 -19.466 1.486 2242 HA ASP 92 HA ASP 92 4.651 -21.276 3.343 2243 HB2 ASP 92 2HB ASP 92 4.101 -18.321 3.461 2244 HB3 ASP 92 1HB ASP 92 4.360 -19.234 4.992 2245 H PHE 93 H PHE 93 1.367 -20.731 2.533 2246 HA PHE 93 HA PHE 93 0.511 -21.788 5.107 2247 HB2 PHE 93 2HB PHE 93 -1.710 -21.727 4.468 2248 HB3 PHE 93 1HB PHE 93 -1.028 -20.256 3.721 2249 HD1 PHE 93 1HD PHE 93 -2.486 -23.607 3.127 2250 HD2 PHE 93 2HD PHE 93 -0.804 -20.133 1.243 2251 HE1 PHE 93 1HE PHE 93 -3.399 -24.343 0.948 2252 HE2 PHE 93 2HE PHE 93 -1.729 -20.856 -0.924 2253 HZ PHE 93 HZ PHE 93 -3.037 -22.965 -1.081 2254 H VAL 94 H VAL 94 1.878 -22.976 2.170 2255 HA VAL 94 HA VAL 94 0.530 -25.526 2.261 2256 HB VAL 94 HB VAL 94 2.780 -24.627 0.392 2257 HG11 VAL 94 1HG1 VAL 94 0.621 -26.845 0.205 2258 HG12 VAL 94 2HG1 VAL 94 2.383 -27.104 0.468 2259 HG13 VAL 94 3HG1 VAL 94 1.801 -26.420 -1.089 2260 HG21 VAL 94 3HG2 VAL 94 0.880 -22.995 0.214 2261 HG22 VAL 94 1HG2 VAL 94 -0.290 -24.352 0.089 2262 HG23 VAL 94 2HG2 VAL 94 0.908 -24.063 -1.221 2263 H ARG 95 H ARG 95 3.722 -24.054 2.878 2264 HA ARG 95 HA ARG 95 5.327 -26.203 3.258 2265 HB2 ARG 95 2HB ARG 95 5.182 -23.657 4.998 2266 HB3 ARG 95 1HB ARG 95 6.533 -24.839 5.073 2267 HG2 ARG 95 2HG ARG 95 7.158 -24.365 2.737 2268 HG3 ARG 95 1HG ARG 95 5.811 -23.186 2.584 2269 HD2 ARG 95 2HD ARG 95 6.772 -21.780 4.411 2270 HD3 ARG 95 1HD ARG 95 8.133 -22.923 4.641 2271 HE ARG 95 HE ARG 95 7.675 -20.925 2.532 2272 HH11 ARG 95 1HH2 ARG 95 9.625 -23.749 3.630 2273 HH12 ARG 95 2HH2 ARG 95 10.991 -23.461 2.661 2274 HH21 ARG 95 1HH1 ARG 95 9.694 -20.464 1.135 2275 HH22 ARG 95 2HH1 ARG 95 11.007 -21.511 1.225 2276 H ARG 96 H ARG 96 2.777 -25.117 5.436 2277 HA ARG 96 HA ARG 96 3.706 -26.292 7.772 2278 HB2 ARG 96 2HB ARG 96 1.538 -25.965 8.735 2279 HB3 ARG 96 1HB ARG 96 1.788 -24.599 7.597 2280 HG2 ARG 96 2HG ARG 96 0.468 -25.990 5.861 2281 HG3 ARG 96 1HG ARG 96 0.106 -27.141 7.200 2282 HD2 ARG 96 2HD ARG 96 -1.109 -25.299 8.427 2283 HD3 ARG 96 1HD ARG 96 -0.896 -24.230 6.961 2284 HE ARG 96 HE ARG 96 -1.910 -26.489 5.806 2285 HH11 ARG 96 1HH2 ARG 96 -3.148 -24.717 8.706 2286 HH12 ARG 96 2HH2 ARG 96 -4.734 -25.348 8.565 2287 HH21 ARG 96 1HH1 ARG 96 -3.939 -27.424 5.703 2288 HH22 ARG 96 2HH1 ARG 96 -5.240 -26.949 6.746 2289 H GLU 97 H GLU 97 2.178 -27.780 4.936 2290 HA GLU 97 HA GLU 97 1.359 -30.086 6.517 2291 HB2 GLU 97 2HB GLU 97 0.887 -29.528 3.540 2292 HB3 GLU 97 1HB GLU 97 0.148 -30.839 4.532 2293 HG2 GLU 97 2HG GLU 97 -0.810 -29.006 6.068 2294 HG3 GLU 97 1HG GLU 97 -0.197 -27.787 4.881 2295 H GLU 98 H GLU 98 2.210 -32.190 6.038 2296 HA GLU 98 HA GLU 98 3.750 -33.619 5.846 2297 HB2 GLU 98 2HB GLU 98 5.352 -32.030 3.827 2298 HB3 GLU 98 1HB GLU 98 5.413 -33.790 4.171 2299 HG2 GLU 98 2HG GLU 98 3.054 -32.243 2.892 2300 HG3 GLU 98 1HG GLU 98 4.209 -33.335 2.056 2301 H GLU 99 H GLU 99 5.146 -30.293 6.269 2302 HA GLU 99 HA GLU 99 7.341 -31.379 7.723 2303 HB2 GLU 99 2HB GLU 99 7.333 -29.014 6.730 2304 HB3 GLU 99 1HB GLU 99 6.283 -28.530 8.099 2305 HG2 GLU 99 2HG GLU 99 8.090 -29.383 9.702 2306 HG3 GLU 99 1HG GLU 99 9.107 -29.805 8.273 2307 H ARG 100 H ARG 100 4.096 -30.097 8.632 2308 HA ARG 100 HA ARG 100 4.469 -30.288 11.368 2309 HB2 ARG 100 2HB ARG 100 2.558 -29.109 10.221 2310 HB3 ARG 100 1HB ARG 100 1.809 -30.707 9.880 2311 HG2 ARG 100 2HG ARG 100 1.605 -31.048 12.402 2312 HG3 ARG 100 1HG ARG 100 2.403 -29.454 12.643 2313 HD2 ARG 100 2HD ARG 100 0.519 -28.331 11.368 2314 HD3 ARG 100 1HD ARG 100 -0.305 -29.940 11.212 2315 HE ARG 100 HE ARG 100 0.410 -28.675 13.894 2316 HH11 ARG 100 1HH2 ARG 100 -2.158 -30.200 11.839 2317 HH12 ARG 100 2HH2 ARG 100 -3.419 -29.861 12.952 2318 HH21 ARG 100 1HH1 ARG 100 -1.321 -28.328 15.420 2319 HH22 ARG 100 2HH1 ARG 100 -2.926 -28.705 15.034 2320 H ARG 101 H ARG 101 3.636 -32.853 9.003 2321 HA ARG 101 HA ARG 101 3.912 -34.806 11.142 2322 HB2 ARG 101 2HB ARG 101 1.577 -34.691 9.151 2323 HB3 ARG 101 1HB ARG 101 2.000 -36.144 10.113 2324 HG2 ARG 101 2HG ARG 101 1.630 -34.903 12.223 2325 HG3 ARG 101 1HG ARG 101 1.123 -33.442 11.315 2326 HD2 ARG 101 2HD ARG 101 -0.265 -36.216 11.099 2327 HD3 ARG 101 1HD ARG 101 -0.787 -34.871 12.203 2328 HE ARG 101 HE ARG 101 -0.562 -34.286 9.234 2329 HH11 ARG 101 1HH2 ARG 101 -2.667 -35.969 11.455 2330 HH12 ARG 101 2HH2 ARG 101 -4.131 -35.320 10.893 2331 HH21 ARG 101 1HH1 ARG 101 -2.594 -33.013 8.583 2332 HH22 ARG 101 2HH1 ARG 101 -4.087 -33.543 9.239 2333 H GLY 102 H GLY 102 5.690 -35.854 10.408 2334 HA2 GLY 102 2HA GLY 102 6.658 -37.380 9.052 2335 HA3 GLY 102 1HA GLY 102 5.599 -36.900 7.681 2336 H HIS 103 H HIS 103 7.588 -34.748 9.731 2337 HA HIS 103 HA HIS 103 8.677 -33.453 7.500 2338 HB2 HIS 103 2HB HIS 103 10.238 -32.274 8.941 2339 HB3 HIS 103 1HB HIS 103 8.665 -32.320 9.761 2340 HD1 HIS 103 1HD HIS 103 8.561 -33.989 11.947 2341 HD2 HIS 103 2HD HIS 103 12.353 -33.631 10.148 2342 HE1 HIS 103 1HE HIS 103 10.228 -35.113 13.468 2343 HE2 HIS 103 2HE HIS 103 12.511 -34.862 12.341 2344 H1 SER 1 H SER 1 -5.688 -23.516 17.791 2345 HA SER 1 HA SER 1 -4.795 -20.841 17.580 2346 HB2 SER 1 2HB SER 1 -3.691 -21.701 19.775 2347 HB3 SER 1 1HB SER 1 -2.998 -23.059 18.825 2348 HG SER 1 1HG SER 1 -2.502 -20.255 18.671 2349 H ALA 2 H ALA 2 -4.017 -20.811 15.439 2350 HA ALA 2 HA ALA 2 -3.730 -23.460 14.141 2351 HB1 ALA 2 1HB ALA 2 -5.421 -21.994 12.995 2352 HB2 ALA 2 2HB ALA 2 -3.963 -22.243 11.972 2353 HB3 ALA 2 3HB ALA 2 -4.196 -20.689 12.868 2354 H ASP 3 H ASP 3 -1.667 -23.879 13.261 2355 HA ASP 3 HA ASP 3 0.394 -22.534 14.514 2356 HB2 ASP 3 2HB ASP 3 0.348 -24.976 13.648 2357 HB3 ASP 3 1HB ASP 3 0.802 -24.303 12.036 2358 H HIS 4 H HIS 4 -1.047 -22.037 11.358 2359 HA HIS 4 HA HIS 4 0.995 -20.388 10.280 2360 HB2 HIS 4 2HB HIS 4 -0.584 -19.677 8.575 2361 HB3 HIS 4 1HB HIS 4 -0.849 -21.417 8.858 2362 HD1 HIS 4 1HD HIS 4 -2.410 -18.041 9.884 2363 HD2 HIS 4 2HD HIS 4 -3.546 -22.064 9.414 2364 HE1 HIS 4 1HE HIS 4 -4.916 -18.162 10.236 2365 HE2 HIS 4 2HE HIS 4 -5.585 -20.490 10.037 2366 H GLU 5 H GLU 5 -1.364 -19.822 12.776 2367 HA GLU 5 HA GLU 5 -1.710 -17.001 12.218 2368 HB2 GLU 5 2HB GLU 5 -3.571 -18.547 13.014 2369 HB3 GLU 5 1HB GLU 5 -2.660 -18.806 14.542 2370 HG2 GLU 5 2HG GLU 5 -2.976 -16.466 15.209 2371 HG3 GLU 5 1HG GLU 5 -3.729 -16.075 13.616 2372 H ARG 6 H ARG 6 -0.032 -19.284 14.375 2373 HA ARG 6 HA ARG 6 0.938 -17.451 16.225 2374 HB2 ARG 6 2HB ARG 6 2.199 -20.083 15.245 2375 HB3 ARG 6 1HB ARG 6 2.681 -19.205 16.730 2376 HG2 ARG 6 2HG ARG 6 0.441 -19.589 17.733 2377 HG3 ARG 6 1HG ARG 6 -0.158 -20.321 16.221 2378 HD2 ARG 6 2HD ARG 6 0.367 -22.092 17.860 2379 HD3 ARG 6 1HD ARG 6 1.443 -22.215 16.415 2380 HE ARG 6 HE ARG 6 2.208 -20.944 19.071 2381 HH11 ARG 6 1HH2 ARG 6 3.133 -23.118 16.213 2382 HH12 ARG 6 2HH2 ARG 6 4.676 -23.380 16.816 2383 HH21 ARG 6 1HH1 ARG 6 4.477 -21.437 19.820 2384 HH22 ARG 6 2HH1 ARG 6 5.327 -22.666 18.998 2385 H GLU 7 H GLU 7 2.279 -18.608 13.133 2386 HA GLU 7 HA GLU 7 4.713 -17.312 13.237 2387 HB2 GLU 7 2HB GLU 7 3.624 -19.097 11.537 2388 HB3 GLU 7 1HB GLU 7 3.157 -17.643 10.614 2389 HG2 GLU 7 2HG GLU 7 5.201 -18.383 9.641 2390 HG3 GLU 7 1HG GLU 7 5.704 -16.996 10.674 2391 H ALA 8 H ALA 8 1.503 -16.176 12.236 2392 HA ALA 8 HA ALA 8 2.363 -13.782 11.015 2393 HB1 ALA 8 1HB ALA 8 -0.060 -13.114 11.098 2394 HB2 ALA 8 2HB ALA 8 -0.404 -14.490 12.200 2395 HB3 ALA 8 3HB ALA 8 0.118 -14.803 10.501 2396 H GLN 9 H GLN 9 1.434 -14.668 14.331 2397 HA GLN 9 HA GLN 9 1.197 -12.024 15.295 2398 HB2 GLN 9 2HB GLN 9 1.928 -14.636 16.737 2399 HB3 GLN 9 1HB GLN 9 1.608 -13.097 17.597 2400 HG2 GLN 9 2HG GLN 9 -0.513 -14.371 15.726 2401 HG3 GLN 9 1HG GLN 9 -0.321 -14.834 17.452 2402 HE21 GLN 9 1HE2 GLN 9 -1.050 -11.992 15.295 2403 HE22 GLN 9 2HE2 GLN 9 -1.717 -11.013 16.560 2404 H LYS 10 H LYS 10 3.972 -14.265 15.057 2405 HA LYS 10 HA LYS 10 5.752 -12.573 16.437 2406 HB2 LYS 10 2HB LYS 10 6.015 -14.965 14.604 2407 HB3 LYS 10 1HB LYS 10 7.492 -13.994 14.883 2408 HG2 LYS 10 2HG LYS 10 5.871 -14.715 17.338 2409 HG3 LYS 10 1HG LYS 10 6.753 -16.049 16.525 2410 HD2 LYS 10 2HD LYS 10 8.835 -15.263 17.035 2411 HD3 LYS 10 1HD LYS 10 8.396 -13.539 16.916 2412 HE2 LYS 10 2HE LYS 10 7.407 -15.249 19.295 2413 HE3 LYS 10 1HE LYS 10 9.062 -14.517 19.263 2414 HZ1 LYS 10 3HZ LYS 10 8.129 -12.353 19.041 2415 HZ2 LYS 10 1HZ LYS 10 7.433 -13.085 20.371 2416 HZ3 LYS 10 2HZ LYS 10 6.518 -12.927 18.978 2417 H ALA 11 H ALA 11 4.686 -12.609 13.056 2418 HA ALA 11 HA ALA 11 6.706 -10.884 12.104 2419 HB1 ALA 11 1HB ALA 11 5.190 -12.211 10.577 2420 HB2 ALA 11 2HB ALA 11 5.214 -10.460 10.173 2421 HB3 ALA 11 3HB ALA 11 3.813 -11.157 11.067 2422 H GLU 12 H GLU 12 3.393 -10.258 13.445 2423 HA GLU 12 HA GLU 12 3.492 -7.471 13.168 2424 HB2 GLU 12 2HB GLU 12 2.017 -9.090 15.355 2425 HB3 GLU 12 1HB GLU 12 1.898 -7.313 15.129 2426 HG2 GLU 12 2HG GLU 12 1.049 -7.765 12.745 2427 HG3 GLU 12 1HG GLU 12 0.818 -9.482 13.242 2428 H GLU 13 H GLU 13 4.368 -9.568 15.965 2429 HA GLU 13 HA GLU 13 5.080 -7.498 17.693 2430 HB2 GLU 13 2HB GLU 13 6.137 -10.387 17.503 2431 HB3 GLU 13 1HB GLU 13 6.504 -9.283 18.875 2432 HG2 GLU 13 2HG GLU 13 4.121 -9.163 19.508 2433 HG3 GLU 13 1HG GLU 13 3.653 -10.211 18.122 2434 H GLU 14 H GLU 14 6.986 -9.148 15.136 2435 HA GLU 14 HA GLU 14 9.399 -8.068 16.115 2436 HB2 GLU 14 2HB GLU 14 9.215 -10.225 14.789 2437 HB3 GLU 14 1HB GLU 14 8.948 -9.211 13.332 2438 HG2 GLU 14 2HG GLU 14 11.271 -9.905 13.360 2439 HG3 GLU 14 1HG GLU 14 11.253 -8.157 13.760 2440 H LEU 15 H LEU 15 6.983 -6.907 13.815 2441 HA LEU 15 HA LEU 15 8.594 -4.905 12.712 2442 HB2 LEU 15 2HB LEU 15 6.364 -5.571 11.785 2443 HB3 LEU 15 1HB LEU 15 5.552 -4.853 13.208 2444 HG LEU 15 HG LEU 15 6.261 -2.593 12.556 2445 HD11 LEU 15 1HD1 LEU 15 7.511 -2.191 10.371 2446 HD12 LEU 15 2HD1 LEU 15 7.880 -3.953 10.308 2447 HD13 LEU 15 3HD1 LEU 15 8.512 -2.934 11.652 2448 HD21 LEU 15 3HD2 LEU 15 5.132 -4.135 10.129 2449 HD22 LEU 15 1HD2 LEU 15 5.030 -2.357 10.395 2450 HD23 LEU 15 2HD2 LEU 15 4.188 -3.484 11.518 2451 H GLN 16 H GLN 16 6.675 -5.034 15.705 2452 HA GLN 16 HA GLN 16 6.962 -2.253 16.190 2453 HB2 GLN 16 2HB GLN 16 6.088 -4.436 18.145 2454 HB3 GLN 16 1HB GLN 16 5.865 -2.658 18.327 2455 HG2 GLN 16 2HG GLN 16 4.578 -2.696 16.081 2456 HG3 GLN 16 1HG GLN 16 4.612 -4.487 16.162 2457 HE21 GLN 16 1HE2 GLN 16 2.731 -1.778 16.926 2458 HE22 GLN 16 2HE2 GLN 16 1.795 -2.434 18.218 2459 H LYS 17 H LYS 17 9.205 -4.767 16.493 2460 HA LYS 17 HA LYS 17 10.726 -3.531 18.642 2461 HB2 LYS 17 2HB LYS 17 10.800 -5.941 18.482 2462 HB3 LYS 17 1HB LYS 17 11.233 -5.906 16.754 2463 HG2 LYS 17 2HG LYS 17 13.093 -4.610 18.818 2464 HG3 LYS 17 1HG LYS 17 13.006 -6.387 18.737 2465 HD2 LYS 17 2HD LYS 17 13.792 -4.542 16.387 2466 HD3 LYS 17 1HD LYS 17 14.917 -5.452 17.432 2467 HE2 LYS 17 2HE LYS 17 12.822 -6.702 15.519 2468 HE3 LYS 17 1HE LYS 17 14.606 -6.621 15.260 2469 HZ1 LYS 17 3HZ LYS 17 13.687 -8.764 16.118 2470 HZ2 LYS 17 1HZ LYS 17 13.323 -8.015 17.550 2471 HZ3 LYS 17 2HZ LYS 17 14.973 -8.092 17.050 2472 H VAL 18 H VAL 18 10.613 -3.733 15.057 2473 HA VAL 18 HA VAL 18 13.042 -2.414 14.594 2474 HB VAL 18 HB VAL 18 10.546 -2.537 12.822 2475 HG11 VAL 18 1HG1 VAL 18 12.104 -0.742 12.041 2476 HG12 VAL 18 2HG1 VAL 18 12.189 -2.155 10.942 2477 HG13 VAL 18 3HG1 VAL 18 13.500 -1.879 12.144 2478 HG21 VAL 18 3HG2 VAL 18 11.759 -4.465 11.744 2479 HG22 VAL 18 1HG2 VAL 18 11.383 -4.820 13.456 2480 HG23 VAL 18 2HG2 VAL 18 13.056 -4.351 12.986 2481 H LEU 19 H LEU 19 9.704 -1.247 15.089 2482 HA LEU 19 HA LEU 19 9.976 1.423 14.550 2483 HB2 LEU 19 2HB LEU 19 8.496 0.103 16.916 2484 HB3 LEU 19 1HB LEU 19 8.315 1.834 16.489 2485 HG LEU 19 HG LEU 19 7.542 -0.501 14.646 2486 HD11 LEU 19 1HD1 LEU 19 6.068 -0.298 16.691 2487 HD12 LEU 19 2HD1 LEU 19 5.199 0.152 15.178 2488 HD13 LEU 19 3HD1 LEU 19 5.780 1.432 16.297 2489 HD21 LEU 19 3HD2 LEU 19 6.350 1.359 13.371 2490 HD22 LEU 19 1HD2 LEU 19 8.144 1.476 13.290 2491 HD23 LEU 19 2HD2 LEU 19 7.210 2.561 14.390 2492 H GLU 20 H GLU 20 10.999 -0.295 17.532 2493 HA GLU 20 HA GLU 20 11.498 2.050 19.003 2494 HB2 GLU 20 2HB GLU 20 12.612 -0.784 19.419 2495 HB3 GLU 20 1HB GLU 20 12.686 0.558 20.609 2496 HG2 GLU 20 2HG GLU 20 10.168 0.619 20.712 2497 HG3 GLU 20 1HG GLU 20 10.096 -0.722 19.510 2498 H GLU 21 H GLU 21 13.605 -0.128 17.033 2499 HA GLU 21 HA GLU 21 15.953 1.363 17.696 2500 HB2 GLU 21 2HB GLU 21 15.980 -1.059 16.913 2501 HB3 GLU 21 1HB GLU 21 15.546 -0.466 15.278 2502 HG2 GLU 21 2HG GLU 21 17.900 -0.841 15.244 2503 HG3 GLU 21 1HG GLU 21 17.740 0.944 15.354 2504 H ALA 22 H ALA 22 13.557 1.394 15.034 2505 HA ALA 22 HA ALA 22 14.752 3.213 13.352 2506 HB1 ALA 22 1HB ALA 22 12.442 3.694 12.496 2507 HB2 ALA 22 2HB ALA 22 11.742 2.877 13.942 2508 HB3 ALA 22 3HB ALA 22 12.688 1.927 12.745 2509 H SER 23 H SER 23 12.866 3.780 16.281 2510 HA SER 23 HA SER 23 12.389 6.519 16.098 2511 HB2 SER 23 2HB SER 23 13.272 5.008 18.677 2512 HB3 SER 23 1HB SER 23 12.279 6.501 18.583 2513 HG SER 23 1HG SER 23 11.473 3.966 17.482 2514 H LYS 24 H LYS 24 15.171 4.685 17.344 2515 HA LYS 24 HA LYS 24 16.501 6.936 18.442 2516 HB2 LYS 24 2HB LYS 24 16.599 4.523 19.291 2517 HB3 LYS 24 1HB LYS 24 17.490 4.074 17.801 2518 HG2 LYS 24 2HG LYS 24 19.320 5.682 18.470 2519 HG3 LYS 24 1HG LYS 24 18.435 6.022 20.004 2520 HD2 LYS 24 2HD LYS 24 18.656 3.570 20.615 2521 HD3 LYS 24 1HD LYS 24 19.476 3.286 19.039 2522 HE2 LYS 24 2HE LYS 24 21.219 5.091 19.791 2523 HE3 LYS 24 1HE LYS 24 20.511 4.945 21.449 2524 HZ1 LYS 24 3HZ LYS 24 22.475 3.604 21.036 2525 HZ2 LYS 24 1HZ LYS 24 21.641 2.701 19.834 2526 HZ3 LYS 24 2HZ LYS 24 21.156 2.590 21.449 2527 H LYS 25 H LYS 25 16.798 4.879 15.535 2528 HA LYS 25 HA LYS 25 19.117 6.200 14.584 2529 HB2 LYS 25 2HB LYS 25 17.120 4.390 13.103 2530 HB3 LYS 25 1HB LYS 25 18.698 4.932 12.437 2531 HG2 LYS 25 2HG LYS 25 18.351 3.245 14.992 2532 HG3 LYS 25 1HG LYS 25 18.741 2.574 13.379 2533 HD2 LYS 25 2HD LYS 25 20.952 3.334 13.436 2534 HD3 LYS 25 1HD LYS 25 20.554 4.789 14.389 2535 HE2 LYS 25 2HE LYS 25 20.121 3.249 16.427 2536 HE3 LYS 25 1HE LYS 25 20.905 1.926 15.470 2537 HZ1 LYS 25 3HZ LYS 25 22.073 4.573 16.240 2538 HZ2 LYS 25 1HZ LYS 25 22.822 3.466 15.203 2539 HZ3 LYS 25 2HZ LYS 25 22.533 3.015 16.814 2540 H ALA 26 H ALA 26 15.629 6.765 14.091 2541 HA ALA 26 HA ALA 26 15.753 8.335 11.838 2542 HB1 ALA 26 1HB ALA 26 13.677 9.449 12.695 2543 HB2 ALA 26 2HB ALA 26 13.975 8.766 14.339 2544 HB3 ALA 26 3HB ALA 26 13.591 7.677 12.966 2545 H VAL 27 H VAL 27 16.096 9.361 15.270 2546 HA VAL 27 HA VAL 27 16.532 12.093 14.734 2547 HB VAL 27 HB VAL 27 17.697 10.311 16.986 2548 HG11 VAL 27 1HG1 VAL 27 17.336 13.385 16.875 2549 HG12 VAL 27 2HG1 VAL 27 18.905 12.511 16.874 2550 HG13 VAL 27 3HG1 VAL 27 17.863 12.424 18.313 2551 HG21 VAL 27 3HG2 VAL 27 15.243 10.117 16.896 2552 HG22 VAL 27 1HG2 VAL 27 15.063 11.913 16.848 2553 HG23 VAL 27 2HG2 VAL 27 15.739 11.095 18.310 2554 H GLU 28 H GLU 28 18.635 9.282 14.993 2555 HA GLU 28 HA GLU 28 21.081 10.588 15.203 2556 HB2 GLU 28 2HB GLU 28 20.304 8.069 15.615 2557 HB3 GLU 28 1HB GLU 28 20.722 7.822 13.900 2558 HG2 GLU 28 2HG GLU 28 23.093 8.495 14.401 2559 HG3 GLU 28 1HG GLU 28 22.647 8.815 16.121 2560 H ALA 29 H ALA 29 19.083 9.578 12.499 2561 HA ALA 29 HA ALA 29 20.890 9.641 10.440 2562 HB1 ALA 29 1HB ALA 29 18.452 8.731 10.499 2563 HB2 ALA 29 2HB ALA 29 18.924 9.615 9.024 2564 HB3 ALA 29 3HB ALA 29 17.901 10.419 10.264 2565 H GLU 30 H GLU 30 18.617 12.189 11.579 2566 HA GLU 30 HA GLU 30 19.642 14.040 9.702 2567 HB2 GLU 30 2HB GLU 30 17.488 13.955 11.740 2568 HB3 GLU 30 1HB GLU 30 18.200 15.577 11.492 2569 HG2 GLU 30 2HG GLU 30 16.251 15.295 10.049 2570 HG3 GLU 30 1HG GLU 30 17.737 15.439 9.033 2571 H ARG 31 H ARG 31 20.954 12.974 12.647 2572 HA ARG 31 HA ARG 31 22.208 15.493 13.359 2573 HB2 ARG 31 2HB ARG 31 22.513 12.618 14.362 2574 HB3 ARG 31 1HB ARG 31 23.533 13.952 14.976 2575 HG2 ARG 31 2HG ARG 31 20.487 14.163 15.121 2576 HG3 ARG 31 1HG ARG 31 21.457 13.257 16.322 2577 HD2 ARG 31 2HD ARG 31 22.927 15.438 16.578 2578 HD3 ARG 31 1HD ARG 31 21.632 16.275 15.637 2579 HE ARG 31 HE ARG 31 20.398 16.348 17.598 2580 HH11 ARG 31 1HH2 ARG 31 22.885 13.735 18.063 2581 HH12 ARG 31 2HH2 ARG 31 22.357 13.387 19.642 2582 HH21 ARG 31 1HH1 ARG 31 19.762 15.844 19.710 2583 HH22 ARG 31 2HH1 ARG 31 20.490 14.552 20.621 2584 H GLY 32 H GLY 32 22.976 15.640 11.008 2585 HA2 GLY 32 2HA GLY 32 25.651 15.605 10.765 2586 HA3 GLY 32 1HA GLY 32 25.143 13.940 10.239 2587 H ALA 33 H ALA 33 22.472 14.850 9.420 2588 HA ALA 33 HA ALA 33 23.129 15.329 6.759 2589 HB1 ALA 33 1HB ALA 33 20.681 15.148 6.352 2590 HB2 ALA 33 2HB ALA 33 20.350 15.423 8.098 2591 HB3 ALA 33 3HB ALA 33 21.166 13.917 7.563 2592 HA PRO 34 HA PRO 34 22.266 19.766 6.880 2593 HB2 PRO 34 2HB PRO 34 22.051 20.362 4.167 2594 HB3 PRO 34 1HB PRO 34 23.621 19.878 4.912 2595 HG2 PRO 34 2HG PRO 34 21.656 18.124 3.353 2596 HG3 PRO 34 1HG PRO 34 23.459 18.208 3.181 2597 HD2 PRO 34 2HD PRO 34 22.079 16.284 4.724 2598 HD3 PRO 34 1HD PRO 34 23.772 16.833 5.113 2599 H GLY 35 H GLY 35 20.371 21.116 6.937 2600 HA2 GLY 35 2HA GLY 35 18.245 21.728 6.569 2601 HA3 GLY 35 1HA GLY 35 18.150 20.507 5.240 2602 H ALA 36 H ALA 36 19.051 19.819 8.581 2603 HA ALA 36 HA ALA 36 17.379 17.647 8.770 2604 HB1 ALA 36 1HB ALA 36 17.937 17.673 11.248 2605 HB2 ALA 36 2HB ALA 36 18.659 19.306 11.038 2606 HB3 ALA 36 3HB ALA 36 19.398 17.874 10.222 2607 H ALA 37 H ALA 37 15.521 17.221 9.969 2608 HA ALA 37 HA ALA 37 13.855 19.556 10.669 2609 HB1 ALA 37 1HB ALA 37 13.021 18.548 8.513 2610 HB2 ALA 37 2HB ALA 37 11.872 18.221 9.857 2611 HB3 ALA 37 3HB ALA 37 12.980 16.923 9.275 2612 H LEU 38 H LEU 38 14.357 15.962 10.976 2613 HA LEU 38 HA LEU 38 12.884 15.995 13.451 2614 HB2 LEU 38 2HB LEU 38 12.659 14.303 11.485 2615 HB3 LEU 38 1HB LEU 38 14.188 13.587 12.054 2616 HG LEU 38 HG LEU 38 11.568 13.879 13.676 2617 HD11 LEU 38 1HD1 LEU 38 11.368 11.392 13.332 2618 HD12 LEU 38 2HD1 LEU 38 12.822 11.437 12.268 2619 HD13 LEU 38 3HD1 LEU 38 11.326 12.302 11.776 2620 HD21 LEU 38 3HD2 LEU 38 14.157 12.366 14.406 2621 HD22 LEU 38 1HD2 LEU 38 12.581 12.207 15.268 2622 HD23 LEU 38 2HD2 LEU 38 13.443 13.776 15.285 2623 H ILE 39 H ILE 39 14.288 16.932 15.077 2624 HA ILE 39 HA ILE 39 16.435 15.105 15.787 2625 HB ILE 39 HB ILE 39 17.709 17.201 16.685 2626 HG12 ILE 39 2HG1 ILE 39 16.255 18.467 14.256 2627 HG13 ILE 39 1HG1 ILE 39 15.937 18.886 15.972 2628 HG21 ILE 39 1HG2 ILE 39 17.757 16.469 13.683 2629 HG22 ILE 39 2HG2 ILE 39 18.499 15.492 14.994 2630 HG23 ILE 39 3HG2 ILE 39 19.124 17.143 14.644 2631 HD11 ILE 39 3HD ILE 39 18.607 19.300 14.467 2632 HD12 ILE 39 1HD ILE 39 17.433 20.564 14.974 2633 HD13 ILE 39 2HD ILE 39 18.341 19.634 16.221 2634 H SER 40 H SER 40 15.772 14.284 17.723 2635 HA SER 40 HA SER 40 15.274 15.773 19.909 2636 HB2 SER 40 2HB SER 40 13.053 16.456 18.794 2637 HB3 SER 40 1HB SER 40 12.630 14.733 18.699 2638 HG SER 40 1HG SER 40 11.701 15.393 20.417 2639 H TYR 41 H TYR 41 13.027 13.382 20.243 2640 HA TYR 41 HA TYR 41 14.339 10.980 19.869 2641 HB2 TYR 41 2HB TYR 41 16.021 11.366 21.538 2642 HB3 TYR 41 1HB TYR 41 14.857 12.165 22.642 2643 HD1 TYR 41 2HD TYR 41 14.620 8.800 20.834 2644 HD2 TYR 41 1HD TYR 41 14.842 10.898 24.592 2645 HE1 TYR 41 2HE TYR 41 14.008 6.740 22.020 2646 HE2 TYR 41 1HE TYR 41 14.261 8.828 25.780 2647 HH TYR 41 HH TYR 41 12.967 6.048 24.119 2648 HA PRO 42 HA PRO 42 10.721 10.005 22.465 2649 HB2 PRO 42 2HB PRO 42 8.980 11.900 23.652 2650 HB3 PRO 42 1HB PRO 42 10.450 11.226 24.457 2651 HG2 PRO 42 2HG PRO 42 10.233 13.847 22.858 2652 HG3 PRO 42 1HG PRO 42 10.943 13.607 24.513 2653 HD2 PRO 42 2HD PRO 42 12.553 13.662 22.307 2654 HD3 PRO 42 1HD PRO 42 12.842 12.400 23.587 2655 H ASP 43 H ASP 43 10.312 12.773 20.287 2656 HA ASP 43 HA ASP 43 7.728 11.828 19.410 2657 HB2 ASP 43 2HB ASP 43 8.012 13.775 17.723 2658 HB3 ASP 43 1HB ASP 43 7.852 14.223 19.452 2659 H ALA 44 H ALA 44 10.969 10.952 18.867 2660 HA ALA 44 HA ALA 44 10.886 10.833 16.027 2661 HB1 ALA 44 1HB ALA 44 12.702 9.263 17.956 2662 HB2 ALA 44 2HB ALA 44 13.019 10.929 17.346 2663 HB3 ALA 44 3HB ALA 44 12.970 9.547 16.193 2664 H ILE 45 H ILE 45 9.888 8.723 18.635 2665 HA ILE 45 HA ILE 45 9.609 6.374 17.085 2666 HB ILE 45 HB ILE 45 9.853 6.162 19.443 2667 HG12 ILE 45 2HG1 ILE 45 6.980 5.360 18.680 2668 HG13 ILE 45 1HG1 ILE 45 8.478 4.474 18.272 2669 HG21 ILE 45 1HG2 ILE 45 9.075 8.316 20.226 2670 HG22 ILE 45 2HG2 ILE 45 8.176 7.043 21.088 2671 HG23 ILE 45 3HG2 ILE 45 7.372 7.957 19.771 2672 HD11 ILE 45 3HD ILE 45 7.397 4.995 21.129 2673 HD12 ILE 45 1HD ILE 45 7.388 3.439 20.234 2674 HD13 ILE 45 2HD ILE 45 8.953 4.167 20.744 2675 H TRP 46 H TRP 46 7.592 9.277 17.579 2676 HA TRP 46 HA TRP 46 5.233 7.901 16.658 2677 HB2 TRP 46 2HB TRP 46 5.882 10.756 17.430 2678 HB3 TRP 46 1HB TRP 46 4.477 10.453 16.385 2679 HD1 TRP 46 HD TRP 46 3.007 11.474 18.198 2680 HE1 TRP 46 1HE TRP 46 1.611 10.350 20.001 2681 HE3 TRP 46 3HE TRP 46 5.588 7.063 18.657 2682 HZ2 TRP 46 2HZ TRP 46 1.828 8.122 21.762 2683 HZ3 TRP 46 3HZ TRP 46 4.945 5.489 20.413 2684 HH2 TRP 46 HH TRP 46 3.102 6.008 21.969 2685 H TRP 47 H TRP 47 7.867 9.686 15.175 2686 HA TRP 47 HA TRP 47 6.598 9.907 12.630 2687 HB2 TRP 47 2HB TRP 47 8.587 11.282 13.167 2688 HB3 TRP 47 1HB TRP 47 9.574 9.798 13.401 2689 HD1 TRP 47 HD TRP 47 7.519 11.434 10.413 2690 HE1 TRP 47 1HE TRP 47 8.792 10.964 8.267 2691 HE3 TRP 47 3HE TRP 47 11.176 8.482 12.384 2692 HZ2 TRP 47 2HZ TRP 47 11.110 9.401 7.472 2693 HZ3 TRP 47 3HZ TRP 47 12.867 7.477 10.865 2694 HH2 TRP 47 HH TRP 47 12.850 7.968 8.463 2695 H SER 48 H SER 48 8.680 7.350 14.262 2696 HA SER 48 HA SER 48 8.819 5.886 11.855 2697 HB2 SER 48 2HB SER 48 9.637 3.954 13.234 2698 HB3 SER 48 1HB SER 48 10.602 5.472 13.334 2699 HG SER 48 1HG SER 48 10.158 4.405 15.370 2700 H VAL 49 H VAL 49 6.520 5.901 14.562 2701 HA VAL 49 HA VAL 49 5.058 3.642 13.946 2702 HB VAL 49 HB VAL 49 4.336 6.302 15.213 2703 HG11 VAL 49 1HG1 VAL 49 2.161 5.279 15.983 2704 HG12 VAL 49 2HG1 VAL 49 2.421 3.890 14.877 2705 HG13 VAL 49 3HG1 VAL 49 2.175 5.545 14.209 2706 HG21 VAL 49 3HG2 VAL 49 4.336 4.916 17.273 2707 HG22 VAL 49 1HG2 VAL 49 5.854 4.554 16.375 2708 HG23 VAL 49 2HG2 VAL 49 4.480 3.405 16.304 2709 H GLU 50 H GLU 50 4.697 6.959 12.477 2710 HA GLU 50 HA GLU 50 2.531 5.963 10.842 2711 HB2 GLU 50 2HB GLU 50 2.538 8.166 9.753 2712 HB3 GLU 50 1HB GLU 50 2.487 8.307 11.537 2713 HG2 GLU 50 2HG GLU 50 4.900 8.900 11.601 2714 HG3 GLU 50 1HG GLU 50 5.035 8.725 9.810 2715 H THR 51 H THR 51 5.799 5.406 10.690 2716 HA THR 51 HA THR 51 5.978 5.724 7.773 2717 HB THR 51 HB THR 51 8.063 5.318 9.961 2718 HG1 THR 51 1HG THR 51 7.449 7.402 9.835 2719 HG21 THR 51 3HG2 THR 51 8.426 5.452 6.901 2720 HG22 THR 51 1HG2 THR 51 8.870 4.077 7.978 2721 HG23 THR 51 2HG2 THR 51 9.758 5.633 8.100 2722 H ALA 52 H ALA 52 6.203 3.244 10.404 2723 HA ALA 52 HA ALA 52 7.076 1.203 8.682 2724 HB1 ALA 52 1HB ALA 52 6.319 -0.380 10.484 2725 HB2 ALA 52 2HB ALA 52 5.456 0.977 11.296 2726 HB3 ALA 52 3HB ALA 52 7.260 0.996 11.161 2727 H THR 53 H THR 53 3.884 2.586 9.217 2728 HA THR 53 HA THR 53 2.498 0.382 7.993 2729 HB THR 53 HB THR 53 0.554 2.025 8.456 2730 HG1 THR 53 1HG THR 53 1.592 3.937 8.567 2731 HG21 THR 53 3HG2 THR 53 0.672 1.642 10.934 2732 HG22 THR 53 1HG2 THR 53 2.423 1.260 10.826 2733 HG23 THR 53 2HG2 THR 53 1.215 0.177 10.045 2734 H THR 54 H THR 54 4.484 2.706 6.740 2735 HA THR 54 HA THR 54 4.634 3.965 5.005 2736 HB THR 54 HB THR 54 3.826 3.004 2.798 2737 HG1 THR 54 1HG THR 54 2.115 1.818 3.963 2738 HG21 THR 54 3HG2 THR 54 5.406 1.167 4.747 2739 HG22 THR 54 1HG2 THR 54 6.093 2.580 3.863 2740 HG23 THR 54 2HG2 THR 54 5.490 1.154 2.947 2741 H VAL 55 H VAL 55 3.308 5.688 6.177 2742 HA VAL 55 HA VAL 55 1.352 6.520 4.183 2743 HB VAL 55 HB VAL 55 -0.184 5.971 5.818 2744 HG11 VAL 55 1HG1 VAL 55 1.526 7.288 8.027 2745 HG12 VAL 55 2HG1 VAL 55 1.333 5.515 7.742 2746 HG13 VAL 55 3HG1 VAL 55 -0.071 6.538 8.192 2747 HG21 VAL 55 3HG2 VAL 55 -0.356 8.280 4.812 2748 HG22 VAL 55 1HG2 VAL 55 0.405 8.978 6.283 2749 HG23 VAL 55 2HG2 VAL 55 -1.169 8.120 6.399 2750 H GLY 56 H GLY 56 2.754 7.955 7.172 2751 HA2 GLY 56 2HA GLY 56 4.226 9.665 7.350 2752 HA3 GLY 56 1HA GLY 56 4.454 9.665 5.551 2753 H TYR 57 H TYR 57 2.248 10.709 8.257 2754 HA TYR 57 HA TYR 57 0.380 11.853 6.401 2755 HB2 TYR 57 2HB TYR 57 0.702 12.124 9.467 2756 HB3 TYR 57 1HB TYR 57 -0.578 12.986 8.536 2757 HD1 TYR 57 2HD TYR 57 -2.433 11.827 7.517 2758 HD2 TYR 57 1HD TYR 57 0.535 9.646 9.727 2759 HE1 TYR 57 2HE TYR 57 -3.955 9.883 7.650 2760 HE2 TYR 57 1HE TYR 57 -0.976 7.714 9.869 2761 HH TYR 57 HH TYR 57 -2.853 6.748 8.672 2762 H GLY 58 H GLY 58 3.384 12.884 7.676 2763 HA2 GLY 58 2HA GLY 58 4.414 14.658 6.614 2764 HA3 GLY 58 1HA GLY 58 2.852 15.540 6.500 2765 H ASP 59 H ASP 59 3.784 13.954 9.485 2766 HA ASP 59 HA ASP 59 3.870 16.397 10.963 2767 HB2 ASP 59 2HB ASP 59 3.106 14.171 11.896 2768 HB3 ASP 59 1HB ASP 59 4.775 13.542 11.707 2769 H ARG 60 H ARG 60 6.335 13.860 10.020 2770 HA ARG 60 HA ARG 60 8.358 15.942 9.974 2771 HB2 ARG 60 2HB ARG 60 8.833 13.313 11.518 2772 HB3 ARG 60 1HB ARG 60 9.921 14.746 11.411 2773 HG2 ARG 60 2HG ARG 60 8.018 16.110 12.446 2774 HG3 ARG 60 1HG ARG 60 7.131 14.557 12.696 2775 HD2 ARG 60 2HD ARG 60 8.665 13.856 14.474 2776 HD3 ARG 60 1HD ARG 60 9.698 15.334 14.195 2777 HE ARG 60 HE ARG 60 6.732 15.706 14.510 2778 HH11 ARG 60 1HH2 ARG 60 9.697 15.954 16.630 2779 HH12 ARG 60 2HH2 ARG 60 9.465 17.630 16.864 2780 HH21 ARG 60 1HH1 ARG 60 6.357 17.949 15.245 2781 HH22 ARG 60 2HH1 ARG 60 7.569 18.694 16.241 2782 H TYR 61 H TYR 61 10.408 14.953 8.766 2783 HA TYR 61 HA TYR 61 9.822 12.742 7.137 2784 HB2 TYR 61 2HB TYR 61 10.282 14.362 4.994 2785 HB3 TYR 61 1HB TYR 61 8.612 14.060 5.585 2786 HD1 TYR 61 1HD TYR 61 11.466 16.525 5.851 2787 HD2 TYR 61 2HD TYR 61 7.253 15.801 6.313 2788 HE1 TYR 61 1HE TYR 61 11.087 18.942 6.187 2789 HE2 TYR 61 2HE TYR 61 6.864 18.200 6.639 2790 HH TYR 61 HH TYR 61 7.804 20.306 6.299 2791 HA PRO 62 HA PRO 62 14.244 13.357 7.424 2792 HB2 PRO 62 2HB PRO 62 15.172 11.678 5.448 2793 HB3 PRO 62 1HB PRO 62 14.277 11.014 6.873 2794 HG2 PRO 62 2HG PRO 62 13.205 11.616 4.057 2795 HG3 PRO 62 1HG PRO 62 12.950 10.122 5.054 2796 HD2 PRO 62 2HD PRO 62 11.166 12.299 4.920 2797 HD3 PRO 62 1HD PRO 62 11.285 11.207 6.370 2798 H VAL 63 H VAL 63 16.214 13.918 5.904 2799 HA VAL 63 HA VAL 63 15.228 15.531 3.621 2800 HB VAL 63 HB VAL 63 15.874 16.934 5.399 2801 HG11 VAL 63 1HG1 VAL 63 18.114 17.069 6.359 2802 HG12 VAL 63 2HG1 VAL 63 18.682 15.650 5.420 2803 HG13 VAL 63 3HG1 VAL 63 17.397 15.470 6.660 2804 HG21 VAL 63 3HG2 VAL 63 17.336 18.451 4.236 2805 HG22 VAL 63 1HG2 VAL 63 16.248 17.658 3.042 2806 HG23 VAL 63 2HG2 VAL 63 17.985 17.171 3.166 2807 H THR 64 H THR 64 18.616 15.263 3.680 2808 HA THR 64 HA THR 64 18.361 13.403 1.414 2809 HB THR 64 HB THR 64 20.570 15.451 1.928 2810 HG1 THR 64 1HG THR 64 18.002 15.692 1.125 2811 HG21 THR 64 3HG2 THR 64 19.645 13.941 -0.624 2812 HG22 THR 64 1HG2 THR 64 21.143 13.586 0.302 2813 HG23 THR 64 2HG2 THR 64 20.962 15.166 -0.532 2814 H GLU 65 H GLU 65 21.293 14.261 3.352 2815 HA GLU 65 HA GLU 65 22.372 11.746 2.966 2816 HB2 GLU 65 2HB GLU 65 23.556 14.009 3.554 2817 HB3 GLU 65 1HB GLU 65 23.053 13.699 5.244 2818 HG2 GLU 65 2HG GLU 65 25.305 12.995 5.155 2819 HG3 GLU 65 1HG GLU 65 24.391 11.448 5.071 2820 H GLU 66 H GLU 66 22.162 9.819 4.120 2821 HA GLU 66 HA GLU 66 21.290 8.364 5.383 2822 HB2 GLU 66 2HB GLU 66 21.406 10.296 7.741 2823 HB3 GLU 66 1HB GLU 66 21.102 8.522 7.804 2824 HG2 GLU 66 2HG GLU 66 23.379 8.247 6.545 2825 HG3 GLU 66 1HG GLU 66 23.660 9.993 6.907 2826 H GLY 67 H GLY 67 19.362 10.380 7.411 2827 HA2 GLY 67 2HA GLY 67 17.151 10.334 7.728 2828 HA3 GLY 67 1HA GLY 67 17.307 11.319 6.242 2829 H ARG 68 H ARG 68 17.050 10.255 4.242 2830 HA ARG 68 HA ARG 68 14.756 8.715 3.933 2831 HB2 ARG 68 2HB ARG 68 15.627 10.317 2.286 2832 HB3 ARG 68 1HB ARG 68 17.151 9.382 2.111 2833 HG2 ARG 68 2HG ARG 68 15.925 7.479 1.071 2834 HG3 ARG 68 1HG ARG 68 14.362 8.301 1.362 2835 HD2 ARG 68 2HD ARG 68 16.661 9.282 -0.471 2836 HD3 ARG 68 1HD ARG 68 15.113 8.564 -1.013 2837 HE ARG 68 HE ARG 68 15.530 11.351 -0.061 2838 HH11 ARG 68 1HH2 ARG 68 13.117 8.730 -0.645 2839 HH12 ARG 68 2HH2 ARG 68 11.776 9.786 -0.423 2840 HH21 ARG 68 1HH1 ARG 68 13.603 12.818 -0.544 2841 HH22 ARG 68 2HH1 ARG 68 12.083 12.032 -0.598 2842 H LYS 69 H LYS 69 18.229 7.851 3.892 2843 HA LYS 69 HA LYS 69 17.802 5.208 2.909 2844 HB2 LYS 69 2HB LYS 69 20.209 6.665 4.079 2845 HB3 LYS 69 1HB LYS 69 20.226 4.890 3.862 2846 HG2 LYS 69 2HG LYS 69 21.270 5.671 1.957 2847 HG3 LYS 69 1HG LYS 69 19.633 5.135 1.447 2848 HD2 LYS 69 2HD LYS 69 18.915 7.609 1.479 2849 HD3 LYS 69 1HD LYS 69 20.627 8.040 1.805 2850 HE2 LYS 69 2HE LYS 69 19.442 6.636 -0.698 2851 HE3 LYS 69 1HE LYS 69 20.180 8.283 -0.617 2852 HZ1 LYS 69 3HZ LYS 69 21.475 5.625 -0.446 2853 HZ2 LYS 69 1HZ LYS 69 22.315 7.058 0.040 2854 HZ3 LYS 69 2HZ LYS 69 21.792 6.854 -1.535 2855 H VAL 70 H VAL 70 17.421 6.749 5.993 2856 HA VAL 70 HA VAL 70 17.619 4.244 7.458 2857 HB VAL 70 HB VAL 70 16.743 7.014 8.431 2858 HG11 VAL 70 1HG1 VAL 70 17.180 6.019 10.684 2859 HG12 VAL 70 2HG1 VAL 70 17.523 4.413 9.929 2860 HG13 VAL 70 3HG1 VAL 70 15.869 5.131 9.834 2861 HG21 VAL 70 3HG2 VAL 70 19.078 7.140 7.653 2862 HG22 VAL 70 1HG2 VAL 70 19.480 5.554 8.412 2863 HG23 VAL 70 2HG2 VAL 70 19.115 6.983 9.437 2864 H ALA 71 H ALA 71 15.238 6.689 6.320 2865 HA ALA 71 HA ALA 71 12.958 5.518 7.253 2866 HB1 ALA 71 1HB ALA 71 11.705 6.755 5.523 2867 HB2 ALA 71 2HB ALA 71 13.210 6.991 4.560 2868 HB3 ALA 71 3HB ALA 71 13.030 7.790 6.164 2869 H GLU 72 H GLU 72 14.461 4.908 4.005 2870 HA GLU 72 HA GLU 72 12.479 3.215 3.076 2871 HB2 GLU 72 2HB GLU 72 14.113 2.284 1.456 2872 HB3 GLU 72 1HB GLU 72 14.175 4.072 1.514 2873 HG2 GLU 72 2HG GLU 72 16.213 4.017 2.891 2874 HG3 GLU 72 1HG GLU 72 16.173 2.228 2.998 2875 H GLN 73 H GLN 73 15.183 2.504 5.218 2876 HA GLN 73 HA GLN 73 15.098 -0.309 4.948 2877 HB2 GLN 73 2HB GLN 73 17.083 0.981 5.882 2878 HB3 GLN 73 1HB GLN 73 16.093 1.414 7.310 2879 HG2 GLN 73 2HG GLN 73 15.904 -1.071 7.884 2880 HG3 GLN 73 1HG GLN 73 16.990 -1.433 6.490 2881 HE21 GLN 73 1HE2 GLN 73 17.990 -2.309 8.813 2882 HE22 GLN 73 2HE2 GLN 73 19.264 -1.277 9.392 2883 H VAL 74 H VAL 74 13.659 2.045 7.226 2884 HA VAL 74 HA VAL 74 12.533 0.106 8.943 2885 HB VAL 74 HB VAL 74 11.864 3.059 8.467 2886 HG11 VAL 74 1HG1 VAL 74 9.922 1.958 9.592 2887 HG12 VAL 74 2HG1 VAL 74 10.816 2.973 10.768 2888 HG13 VAL 74 3HG1 VAL 74 11.022 1.179 10.787 2889 HG21 VAL 74 3HG2 VAL 74 14.253 2.541 9.213 2890 HG22 VAL 74 1HG2 VAL 74 13.596 1.651 10.621 2891 HG23 VAL 74 2HG2 VAL 74 13.321 3.430 10.452 2892 H MET 75 H MET 75 11.266 1.985 6.155 2893 HA MET 75 HA MET 75 8.619 1.085 6.356 2894 HB2 MET 75 2HB MET 75 10.213 1.966 3.873 2895 HB3 MET 75 1HB MET 75 8.439 1.666 3.889 2896 HG2 MET 75 2HG MET 75 8.175 3.371 5.696 2897 HG3 MET 75 1HG MET 75 9.899 3.798 5.563 2898 HE1 MET 75 3HE MET 75 11.000 4.910 3.341 2899 HE2 MET 75 1HE MET 75 10.060 5.370 1.883 2900 HE3 MET 75 2HE MET 75 10.316 3.638 2.258 2901 H LYS 76 H LYS 76 11.447 -0.263 4.563 2902 HA LYS 76 HA LYS 76 9.999 -2.146 3.149 2903 HB2 LYS 76 2HB LYS 76 12.392 -1.455 2.701 2904 HB3 LYS 76 1HB LYS 76 12.909 -2.461 4.096 2905 HG2 LYS 76 2HG LYS 76 12.081 -4.509 2.938 2906 HG3 LYS 76 1HG LYS 76 11.363 -3.511 1.632 2907 HD2 LYS 76 2HD LYS 76 13.661 -2.664 1.038 2908 HD3 LYS 76 1HD LYS 76 14.384 -3.792 2.231 2909 HE2 LYS 76 2HE LYS 76 12.615 -4.671 -0.176 2910 HE3 LYS 76 1HE LYS 76 14.418 -4.562 -0.233 2911 HZ1 LYS 76 3HZ LYS 76 13.673 -6.789 0.141 2912 HZ2 LYS 76 1HZ LYS 76 12.869 -6.365 1.607 2913 HZ3 LYS 76 2HZ LYS 76 14.550 -6.236 1.480 2914 H ALA 77 H ALA 77 11.370 -2.311 6.427 2915 HA ALA 77 HA ALA 77 10.934 -5.052 6.845 2916 HB1 ALA 77 1HB ALA 77 10.876 -2.754 8.907 2917 HB2 ALA 77 2HB ALA 77 12.352 -3.650 8.387 2918 HB3 ALA 77 3HB ALA 77 11.050 -4.509 9.292 2919 H GLY 78 H GLY 78 8.793 -2.220 7.132 2920 HA2 GLY 78 2HA GLY 78 6.698 -3.589 8.492 2921 HA3 GLY 78 1HA GLY 78 6.637 -2.005 7.623 2922 H ILE 79 H ILE 79 7.311 -2.711 5.072 2923 HA ILE 79 HA ILE 79 4.918 -3.630 4.037 2924 HB ILE 79 HB ILE 79 7.690 -3.533 2.758 2925 HG12 ILE 79 2HG1 ILE 79 5.294 -1.591 2.550 2926 HG13 ILE 79 1HG1 ILE 79 6.675 -1.335 3.646 2927 HG21 ILE 79 1HG2 ILE 79 6.454 -3.559 0.546 2928 HG22 ILE 79 2HG2 ILE 79 4.907 -3.837 1.423 2929 HG23 ILE 79 3HG2 ILE 79 6.209 -5.085 1.438 2930 HD11 ILE 79 3HD ILE 79 6.809 -1.429 0.561 2931 HD12 ILE 79 1HD ILE 79 7.005 0.005 1.617 2932 HD13 ILE 79 2HD ILE 79 8.246 -1.302 1.649 2933 H GLU 80 H GLU 80 8.026 -5.413 4.500 2934 HA GLU 80 HA GLU 80 7.052 -7.784 3.354 2935 HB2 GLU 80 2HB GLU 80 9.380 -7.294 5.288 2936 HB3 GLU 80 1HB GLU 80 9.027 -8.891 4.539 2937 HG2 GLU 80 2HG GLU 80 9.296 -7.946 2.259 2938 HG3 GLU 80 1HG GLU 80 9.629 -6.314 2.946 2939 H VAL 81 H VAL 81 6.621 -6.478 6.617 2940 HA VAL 81 HA VAL 81 5.942 -8.987 7.795 2941 HB VAL 81 HB VAL 81 5.740 -6.080 8.615 2942 HG11 VAL 81 1HG1 VAL 81 4.817 -6.861 10.855 2943 HG12 VAL 81 2HG1 VAL 81 4.421 -8.446 10.105 2944 HG13 VAL 81 3HG1 VAL 81 3.628 -6.937 9.516 2945 HG21 VAL 81 3HG2 VAL 81 7.907 -7.406 8.752 2946 HG22 VAL 81 1HG2 VAL 81 7.093 -8.585 9.844 2947 HG23 VAL 81 2HG2 VAL 81 7.320 -6.878 10.364 2948 H PHE 82 H PHE 82 4.043 -6.268 6.357 2949 HA PHE 82 HA PHE 82 1.538 -7.439 6.915 2950 HB2 PHE 82 2HB PHE 82 2.343 -5.532 4.611 2951 HB3 PHE 82 1HB PHE 82 0.644 -5.971 5.018 2952 HD1 PHE 82 2HD PHE 82 -0.005 -5.655 7.596 2953 HD2 PHE 82 1HD PHE 82 3.143 -3.548 5.560 2954 HE1 PHE 82 2HE PHE 82 -0.127 -3.842 9.274 2955 HE2 PHE 82 1HE PHE 82 3.033 -1.752 7.238 2956 HZ PHE 82 HZ PHE 82 1.400 -1.890 9.108 2957 H ALA 83 H ALA 83 3.823 -7.788 4.225 2958 HA ALA 83 HA ALA 83 2.119 -9.379 2.631 2959 HB1 ALA 83 1HB ALA 83 4.142 -8.218 1.703 2960 HB2 ALA 83 2HB ALA 83 4.190 -9.984 1.368 2961 HB3 ALA 83 3HB ALA 83 5.203 -9.288 2.690 2962 H LEU 84 H LEU 84 4.385 -10.138 5.288 2963 HA LEU 84 HA LEU 84 4.713 -12.846 4.769 2964 HB2 LEU 84 2HB LEU 84 6.034 -11.361 6.373 2965 HB3 LEU 84 1HB LEU 84 4.722 -11.533 7.566 2966 HG LEU 84 HG LEU 84 6.286 -13.905 6.351 2967 HD11 LEU 84 1HD1 LEU 84 7.802 -13.833 8.303 2968 HD12 LEU 84 2HD1 LEU 84 6.977 -12.350 8.927 2969 HD13 LEU 84 3HD1 LEU 84 7.891 -12.294 7.375 2970 HD21 LEU 84 3HD2 LEU 84 4.281 -14.717 7.539 2971 HD22 LEU 84 1HD2 LEU 84 4.650 -13.687 8.972 2972 HD23 LEU 84 2HD2 LEU 84 5.721 -15.069 8.536 2973 H VAL 85 H VAL 85 2.286 -11.092 6.742 2974 HA VAL 85 HA VAL 85 1.166 -13.463 7.765 2975 HB VAL 85 HB VAL 85 -0.621 -12.114 8.680 2976 HG11 VAL 85 1HG1 VAL 85 0.821 -10.733 10.132 2977 HG12 VAL 85 2HG1 VAL 85 2.117 -10.661 8.893 2978 HG13 VAL 85 3HG1 VAL 85 1.742 -12.218 9.700 2979 HG21 VAL 85 3HG2 VAL 85 0.637 -9.731 7.161 2980 HG22 VAL 85 1HG2 VAL 85 -0.768 -9.679 8.272 2981 HG23 VAL 85 2HG2 VAL 85 -0.916 -10.511 6.685 2982 H THR 86 H THR 86 1.024 -12.322 4.601 2983 HA THR 86 HA THR 86 -1.568 -12.882 3.835 2984 HB THR 86 HB THR 86 0.949 -13.410 2.179 2985 HG1 THR 86 1HG THR 86 1.124 -11.405 2.663 2986 HG21 THR 86 3HG2 THR 86 -1.145 -14.320 1.113 2987 HG22 THR 86 1HG2 THR 86 -0.594 -12.849 0.256 2988 HG23 THR 86 2HG2 THR 86 -1.984 -12.751 1.394 2989 H ALA 87 H ALA 87 1.016 -15.095 4.838 2990 HA ALA 87 HA ALA 87 -0.031 -17.420 3.661 2991 HB1 ALA 87 1HB ALA 87 2.228 -17.351 4.731 2992 HB2 ALA 87 2HB ALA 87 1.223 -18.664 5.437 2993 HB3 ALA 87 3HB ALA 87 1.465 -17.119 6.344 2994 H ALA 88 H ALA 88 -1.009 -15.604 6.559 2995 HA ALA 88 HA ALA 88 -2.629 -17.723 7.599 2996 HB1 ALA 88 1HB ALA 88 -2.673 -14.687 8.216 2997 HB2 ALA 88 2HB ALA 88 -1.751 -15.906 9.157 2998 HB3 ALA 88 3HB ALA 88 -3.560 -15.936 9.152 2999 H LEU 89 H LEU 89 -3.068 -14.772 5.645 3000 HA LEU 89 HA LEU 89 -5.878 -15.071 5.426 3001 HB2 LEU 89 2HB LEU 89 -3.880 -13.454 3.721 3002 HB3 LEU 89 1HB LEU 89 -5.644 -13.468 3.441 3003 HG LEU 89 HG LEU 89 -5.130 -11.468 4.551 3004 HD11 LEU 89 1HD1 LEU 89 -7.267 -12.604 5.184 3005 HD12 LEU 89 2HD1 LEU 89 -6.648 -11.512 6.474 3006 HD13 LEU 89 3HD1 LEU 89 -6.478 -13.300 6.643 3007 HD21 LEU 89 3HD2 LEU 89 -4.114 -11.196 6.761 3008 HD22 LEU 89 1HD2 LEU 89 -2.975 -12.017 5.643 3009 HD23 LEU 89 2HD2 LEU 89 -3.837 -12.969 6.913 3010 H ALA 90 H ALA 90 -3.137 -16.326 3.548 3011 HA ALA 90 HA ALA 90 -4.599 -17.065 1.298 3012 HB1 ALA 90 1HB ALA 90 -2.733 -18.644 0.798 3013 HB2 ALA 90 2HB ALA 90 -2.109 -18.442 2.483 3014 HB3 ALA 90 3HB ALA 90 -2.090 -17.053 1.337 3015 H THR 91 H THR 91 -4.080 -18.725 4.447 3016 HA THR 91 HA THR 91 -5.389 -21.073 3.665 3017 HB THR 91 HB THR 91 -5.948 -20.701 6.470 3018 HG1 THR 91 1HG THR 91 -4.474 -18.981 6.414 3019 HG21 THR 91 3HG2 THR 91 -5.346 -22.828 5.318 3020 HG22 THR 91 1HG2 THR 91 -4.197 -22.491 6.663 3021 HG23 THR 91 2HG2 THR 91 -3.704 -22.194 4.952 3022 H ASP 92 H ASP 92 -6.820 -17.899 3.951 3023 HA ASP 92 HA ASP 92 -9.110 -18.814 5.340 3024 HB2 ASP 92 2HB ASP 92 -8.416 -16.164 4.062 3025 HB3 ASP 92 1HB ASP 92 -10.151 -16.553 4.264 3026 H PHE 93 H PHE 93 -8.280 -18.905 1.902 3027 HA PHE 93 HA PHE 93 -11.047 -19.483 1.256 3028 HB2 PHE 93 2HB PHE 93 -10.493 -19.935 -0.956 3029 HB3 PHE 93 1HB PHE 93 -9.547 -18.472 -0.518 3030 HD1 PHE 93 1HD PHE 93 -7.044 -18.695 -0.252 3031 HD2 PHE 93 2HD PHE 93 -9.448 -22.001 -1.570 3032 HE1 PHE 93 1HE PHE 93 -5.026 -19.813 -1.119 3033 HE2 PHE 93 2HE PHE 93 -7.420 -23.130 -2.429 3034 HZ PHE 93 HZ PHE 93 -5.205 -22.035 -2.217 3035 H VAL 94 H VAL 94 -8.278 -21.190 2.462 3036 HA VAL 94 HA VAL 94 -9.054 -23.760 1.470 3037 HB VAL 94 HB VAL 94 -6.993 -23.046 3.628 3038 HG11 VAL 94 1HG1 VAL 94 -7.374 -25.535 1.821 3039 HG12 VAL 94 2HG1 VAL 94 -7.561 -25.470 3.605 3040 HG13 VAL 94 3HG1 VAL 94 -5.938 -25.230 2.870 3041 HG21 VAL 94 3HG2 VAL 94 -6.676 -23.258 0.554 3042 HG22 VAL 94 1HG2 VAL 94 -5.337 -23.078 1.743 3043 HG23 VAL 94 2HG2 VAL 94 -6.511 -21.754 1.526 3044 H ARG 95 H ARG 95 -9.265 -21.899 4.474 3045 HA ARG 95 HA ARG 95 -10.067 -23.775 6.279 3046 HB2 ARG 95 2HB ARG 95 -9.561 -21.238 6.647 3047 HB3 ARG 95 1HB ARG 95 -11.219 -20.923 6.052 3048 HG2 ARG 95 2HG ARG 95 -11.858 -22.689 7.991 3049 HG3 ARG 95 1HG ARG 95 -10.287 -22.182 8.679 3050 HD2 ARG 95 2HD ARG 95 -11.058 -19.816 8.814 3051 HD3 ARG 95 1HD ARG 95 -12.530 -20.192 7.852 3052 HE ARG 95 HE ARG 95 -12.160 -20.663 10.728 3053 HH11 ARG 95 1HH2 ARG 95 -14.467 -21.162 7.995 3054 HH12 ARG 95 2HH2 ARG 95 -15.130 -22.584 8.694 3055 HH21 ARG 95 1HH1 ARG 95 -13.735 -22.324 11.835 3056 HH22 ARG 95 2HH1 ARG 95 -14.935 -23.010 10.786 3057 H ARG 96 H ARG 96 -11.927 -22.241 3.709 3058 HA ARG 96 HA ARG 96 -14.484 -22.716 4.656 3059 HB2 ARG 96 2HB ARG 96 -15.302 -21.994 2.598 3060 HB3 ARG 96 1HB ARG 96 -13.664 -21.258 2.580 3061 HG2 ARG 96 2HG ARG 96 -12.917 -23.391 1.265 3062 HG3 ARG 96 1HG ARG 96 -14.663 -23.822 1.197 3063 HD2 ARG 96 2HD ARG 96 -15.076 -21.626 -0.073 3064 HD3 ARG 96 1HD ARG 96 -13.271 -21.461 -0.209 3065 HE ARG 96 HE ARG 96 -13.220 -23.751 -1.187 3066 HH11 ARG 96 1HH2 ARG 96 -16.440 -22.150 -1.454 3067 HH12 ARG 96 2HH2 ARG 96 -17.227 -23.542 -2.037 3068 HH21 ARG 96 1HH1 ARG 96 -14.389 -25.706 -1.702 3069 HH22 ARG 96 2HH1 ARG 96 -15.968 -25.577 -2.378 3070 H GLU 97 H GLU 97 -12.145 -24.981 3.293 3071 HA GLU 97 HA GLU 97 -14.024 -26.713 2.102 3072 HB2 GLU 97 2HB GLU 97 -11.147 -27.188 3.017 3073 HB3 GLU 97 1HB GLU 97 -12.125 -28.424 2.158 3074 HG2 GLU 97 2HG GLU 97 -11.580 -25.622 0.967 3075 HG3 GLU 97 1HG GLU 97 -10.510 -27.044 0.695 3076 H GLU 98 H GLU 98 -13.090 -26.150 5.407 3077 HA GLU 98 HA GLU 98 -14.181 -28.699 6.266 3078 HB2 GLU 98 2HB GLU 98 -13.198 -26.373 8.004 3079 HB3 GLU 98 1HB GLU 98 -13.557 -28.061 8.499 3080 HG2 GLU 98 2HG GLU 98 -11.747 -28.758 6.713 3081 HG3 GLU 98 1HG GLU 98 -11.260 -27.026 6.701 3082 H GLU 99 H GLU 99 -15.016 -25.214 6.154 3083 HA GLU 99 HA GLU 99 -17.262 -25.463 7.779 3084 HB2 GLU 99 2HB GLU 99 -15.878 -23.308 6.919 3085 HB3 GLU 99 1HB GLU 99 -17.204 -23.239 5.729 3086 HG2 GLU 99 2HG GLU 99 -17.888 -21.816 7.520 3087 HG3 GLU 99 1HG GLU 99 -18.843 -23.319 7.787 3088 H ARG 100 H ARG 100 -16.860 -25.821 4.238 3089 HA ARG 100 HA ARG 100 -19.638 -25.777 3.730 3090 HB2 ARG 100 2HB ARG 100 -19.186 -26.649 1.521 3091 HB3 ARG 100 1HB ARG 100 -18.062 -25.323 1.930 3092 HG2 ARG 100 2HG ARG 100 -16.245 -26.951 2.373 3093 HG3 ARG 100 1HG ARG 100 -17.366 -28.327 2.084 3094 HD2 ARG 100 2HD ARG 100 -17.703 -27.598 -0.309 3095 HD3 ARG 100 1HD ARG 100 -16.639 -26.175 -0.012 3096 HE ARG 100 HE ARG 100 -14.765 -27.507 -0.175 3097 HH11 ARG 100 1HH2 ARG 100 -17.682 -29.739 0.003 3098 HH12 ARG 100 2HH2 ARG 100 -16.725 -31.137 -0.290 3099 HH21 ARG 100 1HH1 ARG 100 -13.567 -29.420 -0.423 3100 HH22 ARG 100 2HH1 ARG 100 -14.318 -30.975 -0.576 3101 H ARG 101 H ARG 101 -17.652 -28.250 5.154 3102 HA ARG 101 HA ARG 101 -19.422 -30.416 4.408 3103 HB2 ARG 101 2HB ARG 101 -17.281 -30.228 6.601 3104 HB3 ARG 101 1HB ARG 101 -18.127 -31.735 6.113 3105 HG2 ARG 101 2HG ARG 101 -17.014 -31.798 3.971 3106 HG3 ARG 101 1HG ARG 101 -16.457 -30.088 4.115 3107 HD2 ARG 101 2HD ARG 101 -15.057 -30.629 6.045 3108 HD3 ARG 101 1HD ARG 101 -15.491 -32.392 5.952 3109 HE ARG 101 HE ARG 101 -14.492 -31.678 3.403 3110 HH11 ARG 101 1HH2 ARG 101 -13.229 -31.317 6.773 3111 HH12 ARG 101 2HH2 ARG 101 -11.586 -31.414 6.322 3112 HH21 ARG 101 1HH1 ARG 101 -12.257 -32.011 2.798 3113 HH22 ARG 101 2HH1 ARG 101 -11.004 -31.997 3.970 3114 H GLY 102 H GLY 102 -19.147 -27.943 6.936 3115 HA2 GLY 102 2HA GLY 102 -20.698 -27.289 8.367 3116 HA3 GLY 102 1HA GLY 102 -21.763 -28.644 7.837 3117 H HIS 103 H HIS 103 -18.570 -29.566 8.836 3118 HA HIS 103 HA HIS 103 -19.118 -29.848 11.617 3119 HB2 HIS 103 2HB HIS 103 -20.254 -31.938 11.198 3120 HB3 HIS 103 1HB HIS 103 -19.348 -32.198 9.680 3121 HD1 HIS 103 1HD HIS 103 -17.860 -32.025 13.348 3122 HD2 HIS 103 2HD HIS 103 -18.056 -34.504 9.923 3123 HE1 HIS 103 1HE HIS 103 -16.463 -34.016 13.791 3124 HE2 HIS 103 2HE HIS 103 -16.655 -35.547 11.744 Start of MODEL 12 1 H1 SER 1 H SER 1 -23.319 -14.797 -5.845 2 HA SER 1 HA SER 1 -23.127 -14.207 -3.064 3 HB2 SER 1 2HB SER 1 -24.958 -16.146 -3.062 4 HB3 SER 1 1HB SER 1 -25.374 -14.550 -3.773 5 HG SER 1 1HG SER 1 -24.480 -16.847 -5.179 6 H ALA 2 H ALA 2 -21.178 -15.085 -2.112 7 HA ALA 2 HA ALA 2 -21.217 -17.886 -1.899 8 HB1 ALA 2 1HB ALA 2 -18.819 -18.290 -2.580 9 HB2 ALA 2 2HB ALA 2 -18.773 -16.627 -3.281 10 HB3 ALA 2 3HB ALA 2 -19.861 -17.868 -3.979 11 H ASP 3 H ASP 3 -19.435 -18.512 -0.301 12 HA ASP 3 HA ASP 3 -19.837 -17.107 1.967 13 HB2 ASP 3 2HB ASP 3 -17.318 -18.852 1.449 14 HB3 ASP 3 1HB ASP 3 -18.032 -18.422 3.043 15 H HIS 4 H HIS 4 -17.098 -16.990 -0.263 16 HA HIS 4 HA HIS 4 -15.403 -15.525 1.466 17 HB2 HIS 4 2HB HIS 4 -14.742 -15.022 -1.390 18 HB3 HIS 4 1HB HIS 4 -13.791 -15.780 -0.087 19 HD1 HIS 4 1HD HIS 4 -16.280 -16.509 -2.818 20 HD2 HIS 4 2HD HIS 4 -13.856 -18.638 -0.096 21 HE1 HIS 4 1HE HIS 4 -16.433 -19.005 -3.428 22 HE2 HIS 4 2HE HIS 4 -15.057 -20.244 -1.782 23 H GLU 5 H GLU 5 -17.468 -14.539 -1.367 24 HA GLU 5 HA GLU 5 -16.833 -11.853 -1.116 25 HB2 GLU 5 2HB GLU 5 -19.501 -11.899 -2.150 26 HB3 GLU 5 1HB GLU 5 -17.976 -11.670 -3.023 27 HG2 GLU 5 2HG GLU 5 -19.166 -14.457 -2.441 28 HG3 GLU 5 1HG GLU 5 -19.569 -13.495 -3.901 29 H ARG 6 H ARG 6 -19.377 -13.824 0.480 30 HA ARG 6 HA ARG 6 -20.698 -11.608 1.615 31 HB2 ARG 6 2HB ARG 6 -20.535 -14.565 2.399 32 HB3 ARG 6 1HB ARG 6 -21.444 -13.400 3.415 33 HG2 ARG 6 2HG ARG 6 -21.982 -13.678 0.418 34 HG3 ARG 6 1HG ARG 6 -22.792 -14.728 1.631 35 HD2 ARG 6 2HD ARG 6 -23.978 -12.936 2.669 36 HD3 ARG 6 1HD ARG 6 -22.902 -11.660 1.963 37 HE ARG 6 HE ARG 6 -24.076 -13.000 -0.236 38 HH11 ARG 6 1HH2 ARG 6 -25.262 -11.056 2.612 39 HH12 ARG 6 2HH2 ARG 6 -26.634 -10.477 1.771 40 HH21 ARG 6 1HH1 ARG 6 -25.681 -11.749 -1.469 41 HH22 ARG 6 2HH1 ARG 6 -26.788 -10.750 -0.647 42 H GLU 7 H GLU 7 -18.018 -13.690 2.906 43 HA GLU 7 HA GLU 7 -18.070 -12.199 5.307 44 HB2 GLU 7 2HB GLU 7 -17.317 -14.614 4.951 45 HB3 GLU 7 1HB GLU 7 -15.712 -13.947 4.506 46 HG2 GLU 7 2HG GLU 7 -15.386 -13.026 6.731 47 HG3 GLU 7 1HG GLU 7 -17.149 -13.041 7.088 48 H ALA 8 H ALA 8 -16.273 -11.840 2.258 49 HA ALA 8 HA ALA 8 -14.478 -9.873 3.197 50 HB1 ALA 8 1HB ALA 8 -14.158 -10.995 0.973 51 HB2 ALA 8 2HB ALA 8 -14.268 -9.206 0.781 52 HB3 ALA 8 3HB ALA 8 -15.684 -10.246 0.377 53 H GLN 9 H GLN 9 -17.809 -9.687 1.802 54 HA GLN 9 HA GLN 9 -17.840 -6.880 1.723 55 HB2 GLN 9 2HB GLN 9 -19.403 -8.408 0.434 56 HB3 GLN 9 1HB GLN 9 -20.265 -8.757 1.969 57 HG2 GLN 9 2HG GLN 9 -20.853 -6.292 2.156 58 HG3 GLN 9 1HG GLN 9 -19.959 -5.978 0.619 59 HE21 GLN 9 1HE2 GLN 9 -22.437 -5.160 0.348 60 HE22 GLN 9 2HE2 GLN 9 -23.541 -6.311 -0.324 61 H LYS 10 H LYS 10 -18.731 -9.249 4.213 62 HA LYS 10 HA LYS 10 -19.932 -7.540 6.054 63 HB2 LYS 10 2HB LYS 10 -19.854 -10.111 6.092 64 HB3 LYS 10 1HB LYS 10 -18.142 -9.988 6.601 65 HG2 LYS 10 2HG LYS 10 -18.955 -8.724 8.689 66 HG3 LYS 10 1HG LYS 10 -20.638 -9.118 8.191 67 HD2 LYS 10 2HD LYS 10 -20.031 -11.587 8.243 68 HD3 LYS 10 1HD LYS 10 -18.347 -11.120 8.678 69 HE2 LYS 10 2HE LYS 10 -19.375 -9.979 10.803 70 HE3 LYS 10 1HE LYS 10 -20.897 -10.891 10.423 71 HZ1 LYS 10 3HZ LYS 10 -19.376 -12.067 11.982 72 HZ2 LYS 10 1HZ LYS 10 -18.174 -12.028 10.807 73 HZ3 LYS 10 2HZ LYS 10 -19.600 -12.957 10.553 74 H ALA 11 H ALA 11 -16.500 -8.299 5.390 75 HA ALA 11 HA ALA 11 -15.432 -7.048 7.643 76 HB1 ALA 11 1HB ALA 11 -14.141 -8.648 6.178 77 HB2 ALA 11 2HB ALA 11 -13.260 -7.108 6.476 78 HB3 ALA 11 3HB ALA 11 -14.078 -7.385 4.896 79 H GLU 12 H GLU 12 -16.313 -5.705 4.398 80 HA GLU 12 HA GLU 12 -15.047 -3.224 4.863 81 HB2 GLU 12 2HB GLU 12 -17.446 -3.801 3.028 82 HB3 GLU 12 1HB GLU 12 -16.704 -2.183 3.255 83 HG2 GLU 12 2HG GLU 12 -14.433 -3.300 2.587 84 HG3 GLU 12 1HG GLU 12 -15.443 -4.622 1.895 85 H GLU 13 H GLU 13 -18.141 -4.511 6.032 86 HA GLU 13 HA GLU 13 -19.222 -1.973 6.721 87 HB2 GLU 13 2HB GLU 13 -19.819 -4.685 8.058 88 HB3 GLU 13 1HB GLU 13 -20.795 -3.182 8.167 89 HG2 GLU 13 2HG GLU 13 -21.088 -3.311 5.614 90 HG3 GLU 13 1HG GLU 13 -20.346 -4.951 5.668 91 H GLU 14 H GLU 14 -16.928 -4.207 8.245 92 HA GLU 14 HA GLU 14 -17.144 -3.047 10.827 93 HB2 GLU 14 2HB GLU 14 -16.351 -5.418 10.371 94 HB3 GLU 14 1HB GLU 14 -14.810 -4.737 9.760 95 HG2 GLU 14 2HG GLU 14 -14.331 -3.749 11.990 96 HG3 GLU 14 1HG GLU 14 -15.962 -4.222 12.587 97 H LEU 15 H LEU 15 -15.272 -2.355 7.902 98 HA LEU 15 HA LEU 15 -13.390 -0.700 9.161 99 HB2 LEU 15 2HB LEU 15 -13.156 -1.609 6.824 100 HB3 LEU 15 1HB LEU 15 -14.425 -0.476 6.267 101 HG LEU 15 HG LEU 15 -12.984 1.457 6.774 102 HD11 LEU 15 1HD1 LEU 15 -10.556 1.063 7.559 103 HD12 LEU 15 2HD1 LEU 15 -11.062 -0.598 8.034 104 HD13 LEU 15 3HD1 LEU 15 -11.820 0.843 8.805 105 HD21 LEU 15 3HD2 LEU 15 -11.380 -0.732 5.293 106 HD22 LEU 15 1HD2 LEU 15 -11.111 1.041 5.175 107 HD23 LEU 15 2HD2 LEU 15 -12.651 0.324 4.573 108 H GLN 16 H GLN 16 -16.671 -0.115 7.908 109 HA GLN 16 HA GLN 16 -16.515 2.693 8.133 110 HB2 GLN 16 2HB GLN 16 -19.006 0.908 8.156 111 HB3 GLN 16 1HB GLN 16 -18.997 2.700 8.001 112 HG2 GLN 16 2HG GLN 16 -17.577 2.486 5.902 113 HG3 GLN 16 1HG GLN 16 -17.739 0.697 6.003 114 HE21 GLN 16 1HE2 GLN 16 -19.297 0.049 4.473 115 HE22 GLN 16 2HE2 GLN 16 -20.790 0.853 4.186 116 H LYS 17 H LYS 17 -17.080 0.196 10.529 117 HA LYS 17 HA LYS 17 -18.347 1.798 12.484 118 HB2 LYS 17 2HB LYS 17 -18.320 -0.682 12.652 119 HB3 LYS 17 1HB LYS 17 -16.529 -0.676 12.698 120 HG2 LYS 17 2HG LYS 17 -16.563 0.468 14.922 121 HG3 LYS 17 1HG LYS 17 -18.359 0.376 14.939 122 HD2 LYS 17 2HD LYS 17 -18.291 -2.068 14.981 123 HD3 LYS 17 1HD LYS 17 -16.548 -2.084 14.529 124 HE2 LYS 17 2HE LYS 17 -15.918 -1.101 16.750 125 HE3 LYS 17 1HE LYS 17 -17.657 -1.106 17.256 126 HZ1 LYS 17 3HZ LYS 17 -16.296 -3.077 17.988 127 HZ2 LYS 17 1HZ LYS 17 -16.156 -3.547 16.387 128 HZ3 LYS 17 2HZ LYS 17 -17.692 -3.484 17.067 129 H VAL 18 H VAL 18 -14.873 0.969 11.873 130 HA VAL 18 HA VAL 18 -14.064 2.580 14.082 131 HB VAL 18 HB VAL 18 -11.746 2.177 13.296 132 HG11 VAL 18 1HG1 VAL 18 -12.956 0.696 14.934 133 HG12 VAL 18 2HG1 VAL 18 -11.820 -0.245 13.901 134 HG13 VAL 18 3HG1 VAL 18 -13.588 -0.307 13.572 135 HG21 VAL 18 3HG2 VAL 18 -13.129 0.411 11.150 136 HG22 VAL 18 1HG2 VAL 18 -11.372 0.557 11.452 137 HG23 VAL 18 2HG2 VAL 18 -12.275 1.964 10.809 138 H LEU 19 H LEU 19 -14.667 3.221 10.651 139 HA LEU 19 HA LEU 19 -13.276 5.651 10.491 140 HB2 LEU 19 2HB LEU 19 -15.981 4.868 9.222 141 HB3 LEU 19 1HB LEU 19 -15.165 6.426 8.893 142 HG LEU 19 HG LEU 19 -13.973 3.681 8.211 143 HD11 LEU 19 1HD1 LEU 19 -14.504 4.266 5.856 144 HD12 LEU 19 2HD1 LEU 19 -15.265 5.814 6.382 145 HD13 LEU 19 3HD1 LEU 19 -16.017 4.247 6.832 146 HD21 LEU 19 3HD2 LEU 19 -12.382 5.059 6.822 147 HD22 LEU 19 1HD2 LEU 19 -12.181 5.351 8.584 148 HD23 LEU 19 2HD2 LEU 19 -13.055 6.553 7.556 149 H GLU 20 H GLU 20 -16.666 4.954 11.604 150 HA GLU 20 HA GLU 20 -17.222 7.658 12.056 151 HB2 GLU 20 2HB GLU 20 -18.563 5.221 13.359 152 HB3 GLU 20 1HB GLU 20 -19.161 6.917 13.413 153 HG2 GLU 20 2HG GLU 20 -19.204 6.906 10.843 154 HG3 GLU 20 1HG GLU 20 -18.856 5.143 10.903 155 H GLU 21 H GLU 21 -15.948 5.116 14.286 156 HA GLU 21 HA GLU 21 -15.957 6.894 16.487 157 HB2 GLU 21 2HB GLU 21 -15.771 4.346 16.744 158 HB3 GLU 21 1HB GLU 21 -14.037 4.517 16.300 159 HG2 GLU 21 2HG GLU 21 -13.789 6.172 18.238 160 HG3 GLU 21 1HG GLU 21 -15.512 5.885 18.663 161 H ALA 22 H ALA 22 -13.399 6.044 14.050 162 HA ALA 22 HA ALA 22 -11.350 7.442 15.270 163 HB1 ALA 22 1HB ALA 22 -11.770 7.015 12.247 164 HB2 ALA 22 2HB ALA 22 -10.973 5.858 13.373 165 HB3 ALA 22 3HB ALA 22 -10.215 7.460 13.050 166 H SER 23 H SER 23 -13.835 8.554 12.990 167 HA SER 23 HA SER 23 -12.766 11.109 12.509 168 HB2 SER 23 2HB SER 23 -15.762 10.293 12.654 169 HB3 SER 23 1HB SER 23 -15.064 11.700 11.762 170 HG SER 23 1HG SER 23 -14.771 8.900 11.270 171 H LYS 24 H LYS 24 -15.038 9.844 14.949 172 HA LYS 24 HA LYS 24 -15.682 12.323 16.121 173 HB2 LYS 24 2HB LYS 24 -17.087 10.269 16.310 174 HB3 LYS 24 1HB LYS 24 -15.814 9.449 17.257 175 HG2 LYS 24 2HG LYS 24 -17.097 12.072 18.237 176 HG3 LYS 24 1HG LYS 24 -17.932 10.493 18.427 177 HD2 LYS 24 2HD LYS 24 -16.031 9.568 19.716 178 HD3 LYS 24 1HD LYS 24 -15.143 11.126 19.568 179 HE2 LYS 24 2HE LYS 24 -16.977 12.309 20.825 180 HE3 LYS 24 1HE LYS 24 -17.828 10.725 21.046 181 HZ1 LYS 24 3HZ LYS 24 -15.879 9.915 22.253 182 HZ2 LYS 24 1HZ LYS 24 -16.446 11.337 22.959 183 HZ3 LYS 24 2HZ LYS 24 -15.071 11.402 21.962 184 H LYS 25 H LYS 25 -13.292 9.763 16.798 185 HA LYS 25 HA LYS 25 -12.162 10.931 19.075 186 HB2 LYS 25 2HB LYS 25 -11.029 9.069 16.904 187 HB3 LYS 25 1HB LYS 25 -10.061 9.534 18.337 188 HG2 LYS 25 2HG LYS 25 -12.800 8.150 18.612 189 HG3 LYS 25 1HG LYS 25 -11.260 7.260 18.369 190 HD2 LYS 25 2HD LYS 25 -10.309 8.540 20.361 191 HD3 LYS 25 1HD LYS 25 -11.979 9.121 20.715 192 HE2 LYS 25 2HE LYS 25 -12.762 6.771 21.062 193 HE3 LYS 25 1HE LYS 25 -11.177 6.125 20.473 194 HZ1 LYS 25 3HZ LYS 25 -11.654 7.737 22.934 195 HZ2 LYS 25 1HZ LYS 25 -10.114 7.327 22.343 196 HZ3 LYS 25 2HZ LYS 25 -11.228 6.121 22.855 197 H ALA 26 H ALA 26 -11.185 11.125 15.597 198 HA ALA 26 HA ALA 26 -8.839 12.473 15.953 199 HB1 ALA 26 1HB ALA 26 -10.804 12.733 13.580 200 HB2 ALA 26 2HB ALA 26 -9.553 11.456 13.777 201 HB3 ALA 26 3HB ALA 26 -9.048 13.166 13.560 202 H VAL 27 H VAL 27 -12.157 13.834 15.504 203 HA VAL 27 HA VAL 27 -11.138 16.468 15.392 204 HB VAL 27 HB VAL 27 -13.266 15.900 14.396 205 HG11 VAL 27 1HG1 VAL 27 -14.175 14.305 16.050 206 HG12 VAL 27 2HG1 VAL 27 -15.327 15.649 15.778 207 HG13 VAL 27 3HG1 VAL 27 -14.342 15.603 17.284 208 HG21 VAL 27 3HG2 VAL 27 -13.383 18.075 16.588 209 HG22 VAL 27 1HG2 VAL 27 -14.453 17.955 15.143 210 HG23 VAL 27 2HG2 VAL 27 -12.684 18.240 14.939 211 H GLU 28 H GLU 28 -12.183 14.403 18.162 212 HA GLU 28 HA GLU 28 -12.034 16.525 20.066 213 HB2 GLU 28 2HB GLU 28 -11.692 13.476 20.429 214 HB3 GLU 28 1HB GLU 28 -11.748 14.657 21.783 215 HG2 GLU 28 2HG GLU 28 -14.090 15.266 21.202 216 HG3 GLU 28 1HG GLU 28 -14.074 14.077 19.844 217 H ALA 29 H ALA 29 -9.813 14.123 18.754 218 HA ALA 29 HA ALA 29 -7.760 14.401 20.620 219 HB1 ALA 29 1HB ALA 29 -6.490 13.034 18.954 220 HB2 ALA 29 2HB ALA 29 -7.654 13.462 17.677 221 HB3 ALA 29 3HB ALA 29 -8.162 12.424 19.048 222 H GLU 30 H GLU 30 -8.213 15.753 17.299 223 HA GLU 30 HA GLU 30 -5.914 17.378 17.360 224 HB2 GLU 30 2HB GLU 30 -8.486 17.322 15.714 225 HB3 GLU 30 1HB GLU 30 -7.318 18.654 15.483 226 HG2 GLU 30 2HG GLU 30 -6.253 15.781 15.392 227 HG3 GLU 30 1HG GLU 30 -7.158 16.416 13.980 228 H ARG 31 H ARG 31 -9.338 17.971 18.352 229 HA ARG 31 HA ARG 31 -8.941 20.754 18.566 230 HB2 ARG 31 2HB ARG 31 -11.076 18.857 19.558 231 HB3 ARG 31 1HB ARG 31 -11.064 20.503 20.220 232 HG2 ARG 31 2HG ARG 31 -11.037 20.055 17.188 233 HG3 ARG 31 1HG ARG 31 -12.541 20.080 18.166 234 HD2 ARG 31 2HD ARG 31 -11.903 22.383 19.084 235 HD3 ARG 31 1HD ARG 31 -10.463 22.386 18.000 236 HE ARG 31 HE ARG 31 -11.835 23.049 16.291 237 HH11 ARG 31 1HH2 ARG 31 -14.014 21.655 18.838 238 HH12 ARG 31 2HH2 ARG 31 -15.421 21.941 17.908 239 HH21 ARG 31 1HH1 ARG 31 -13.732 23.571 15.200 240 HH22 ARG 31 2HH1 ARG 31 -15.302 23.261 15.845 241 H GLY 32 H GLY 32 -7.209 21.360 19.765 242 HA2 GLY 32 2HA GLY 32 -7.029 22.483 21.890 243 HA3 GLY 32 1HA GLY 32 -7.437 20.906 22.678 244 H ALA 33 H ALA 33 -5.738 20.091 19.895 245 HA ALA 33 HA ALA 33 -3.377 19.686 21.502 246 HB1 ALA 33 1HB ALA 33 -4.076 18.660 18.689 247 HB2 ALA 33 2HB ALA 33 -4.346 17.757 20.220 248 HB3 ALA 33 3HB ALA 33 -2.674 18.153 19.701 249 HA PRO 34 HA PRO 34 -1.474 22.996 19.216 250 HB2 PRO 34 2HB PRO 34 1.260 22.505 19.599 251 HB3 PRO 34 1HB PRO 34 0.170 23.030 20.937 252 HG2 PRO 34 2HG PRO 34 1.036 20.175 20.240 253 HG3 PRO 34 1HG PRO 34 1.051 20.976 21.868 254 HD2 PRO 34 2HD PRO 34 -1.023 19.324 21.009 255 HD3 PRO 34 1HD PRO 34 -1.347 20.780 22.062 256 H GLY 35 H GLY 35 -0.666 23.429 17.065 257 HA2 GLY 35 2HA GLY 35 0.370 22.938 15.106 258 HA3 GLY 35 1HA GLY 35 0.744 21.276 15.695 259 H ALA 36 H ALA 36 -2.357 21.507 16.418 260 HA ALA 36 HA ALA 36 -3.207 19.720 14.514 261 HB1 ALA 36 1HB ALA 36 -4.260 19.890 16.758 262 HB2 ALA 36 2HB ALA 36 -5.502 20.100 15.491 263 HB3 ALA 36 3HB ALA 36 -4.873 21.544 16.377 264 H ALA 37 H ALA 37 -4.742 19.845 12.894 265 HA ALA 37 HA ALA 37 -4.986 22.533 11.612 266 HB1 ALA 37 1HB ALA 37 -4.526 19.800 10.261 267 HB2 ALA 37 2HB ALA 37 -3.316 21.122 10.377 268 HB3 ALA 37 3HB ALA 37 -4.805 21.363 9.391 269 H LEU 38 H LEU 38 -6.437 19.398 12.526 270 HA LEU 38 HA LEU 38 -8.790 19.884 10.889 271 HB2 LEU 38 2HB LEU 38 -7.501 17.606 11.464 272 HB3 LEU 38 1HB LEU 38 -8.493 17.638 12.930 273 HG LEU 38 HG LEU 38 -9.472 17.586 10.008 274 HD11 LEU 38 1HD1 LEU 38 -10.174 15.255 10.560 275 HD12 LEU 38 2HD1 LEU 38 -9.586 15.458 12.251 276 HD13 LEU 38 3HD1 LEU 38 -8.421 15.472 10.881 277 HD21 LEU 38 3HD2 LEU 38 -11.772 17.274 10.820 278 HD22 LEU 38 1HD2 LEU 38 -11.133 18.849 11.362 279 HD23 LEU 38 2HD2 LEU 38 -11.229 17.483 12.533 280 H ILE 39 H ILE 39 -8.765 22.022 12.384 281 HA ILE 39 HA ILE 39 -9.842 21.512 15.021 282 HB ILE 39 HB ILE 39 -9.744 23.991 15.264 283 HG12 ILE 39 2HG1 ILE 39 -8.329 23.905 12.506 284 HG13 ILE 39 1HG1 ILE 39 -9.989 24.537 12.779 285 HG21 ILE 39 1HG2 ILE 39 -7.936 22.344 15.941 286 HG22 ILE 39 2HG2 ILE 39 -7.280 23.955 15.488 287 HG23 ILE 39 3HG2 ILE 39 -7.145 22.574 14.342 288 HD11 ILE 39 3HD ILE 39 -7.396 25.665 14.034 289 HD12 ILE 39 1HD ILE 39 -8.381 26.408 12.726 290 HD13 ILE 39 2HD ILE 39 -9.065 26.254 14.384 291 H SER 40 H SER 40 -11.607 20.496 13.099 292 HA SER 40 HA SER 40 -13.822 22.438 13.173 293 HB2 SER 40 2HB SER 40 -14.220 21.546 10.700 294 HB3 SER 40 1HB SER 40 -13.035 22.843 11.054 295 HG SER 40 1HG SER 40 -12.611 20.431 10.016 296 H TYR 41 H TYR 41 -14.464 19.565 11.348 297 HA TYR 41 HA TYR 41 -15.269 17.763 13.109 298 HB2 TYR 41 2HB TYR 41 -16.675 19.217 14.501 299 HB3 TYR 41 1HB TYR 41 -17.498 19.891 13.071 300 HD1 TYR 41 2HD TYR 41 -16.799 16.208 13.830 301 HD2 TYR 41 1HD TYR 41 -19.729 19.365 13.575 302 HE1 TYR 41 2HE TYR 41 -18.601 14.555 13.975 303 HE2 TYR 41 1HE TYR 41 -21.525 17.706 13.744 304 HH TYR 41 HH TYR 41 -22.047 15.480 14.174 305 HA PRO 42 HA PRO 42 -18.246 17.053 9.727 306 HB2 PRO 42 2HB PRO 42 -18.884 18.792 7.634 307 HB3 PRO 42 1HB PRO 42 -19.596 18.986 9.284 308 HG2 PRO 42 2HG PRO 42 -17.136 20.420 8.129 309 HG3 PRO 42 1HG PRO 42 -18.575 21.168 8.939 310 HD2 PRO 42 2HD PRO 42 -16.225 20.588 10.301 311 HD3 PRO 42 1HD PRO 42 -17.855 20.391 11.100 312 H ASP 43 H ASP 43 -15.148 18.296 9.070 313 HA ASP 43 HA ASP 43 -14.855 16.886 6.561 314 HB2 ASP 43 2HB ASP 43 -12.580 18.098 6.668 315 HB3 ASP 43 1HB ASP 43 -14.038 19.076 6.302 316 H ALA 44 H ALA 44 -14.557 16.469 9.942 317 HA ALA 44 HA ALA 44 -12.130 15.004 9.981 318 HB1 ALA 44 1HB ALA 44 -12.858 14.184 12.221 319 HB2 ALA 44 2HB ALA 44 -14.523 14.808 11.927 320 HB3 ALA 44 3HB ALA 44 -13.146 15.954 12.100 321 H ILE 45 H ILE 45 -15.437 14.293 9.124 322 HA ILE 45 HA ILE 45 -15.332 11.529 9.509 323 HB ILE 45 HB ILE 45 -17.400 12.797 9.441 324 HG12 ILE 45 2HG1 ILE 45 -17.257 10.532 7.358 325 HG13 ILE 45 1HG1 ILE 45 -17.354 10.334 9.138 326 HG21 ILE 45 1HG2 ILE 45 -16.745 14.332 7.502 327 HG22 ILE 45 2HG2 ILE 45 -18.384 13.625 7.361 328 HG23 ILE 45 3HG2 ILE 45 -17.039 12.958 6.378 329 HD11 ILE 45 3HD ILE 45 -19.505 11.627 7.322 330 HD12 ILE 45 1HD ILE 45 -19.603 10.039 8.157 331 HD13 ILE 45 2HD ILE 45 -19.588 11.560 9.123 332 H TRP 46 H TRP 46 -14.414 13.594 6.813 333 HA TRP 46 HA TRP 46 -14.040 11.344 5.059 334 HB2 TRP 46 2HB TRP 46 -13.295 14.304 4.688 335 HB3 TRP 46 1HB TRP 46 -13.244 13.023 3.423 336 HD1 TRP 46 HD TRP 46 -15.652 15.610 4.759 337 HE1 TRP 46 1HE TRP 46 -18.039 15.144 3.892 338 HE3 TRP 46 3HE TRP 46 -14.903 10.897 2.936 339 HZ2 TRP 46 2HZ TRP 46 -19.405 13.044 2.558 340 HZ3 TRP 46 3HZ TRP 46 -16.788 9.696 1.890 341 HH2 TRP 46 HH TRP 46 -19.023 10.758 1.720 342 H TRP 47 H TRP 47 -12.092 13.420 7.187 343 HA TRP 47 HA TRP 47 -9.572 12.839 6.240 344 HB2 TRP 47 2HB TRP 47 -10.012 14.530 8.026 345 HB3 TRP 47 1HB TRP 47 -10.480 13.216 9.158 346 HD1 TRP 47 HD TRP 47 -7.245 14.643 7.434 347 HE1 TRP 47 1HE TRP 47 -5.215 13.762 8.747 348 HE3 TRP 47 3HE TRP 47 -9.685 11.484 10.620 349 HZ2 TRP 47 2HZ TRP 47 -4.734 12.095 11.016 350 HZ3 TRP 47 3HZ TRP 47 -8.382 10.217 12.288 351 HH2 TRP 47 HH TRP 47 -5.951 10.553 12.520 352 H SER 48 H SER 48 -11.623 10.953 8.525 353 HA SER 48 HA SER 48 -9.800 8.987 9.102 354 HB2 SER 48 2HB SER 48 -12.852 8.761 8.822 355 HB3 SER 48 1HB SER 48 -11.783 7.661 9.788 356 HG SER 48 1HG SER 48 -12.910 9.819 10.609 357 H VAL 49 H VAL 49 -11.695 9.462 6.129 358 HA VAL 49 HA VAL 49 -11.476 6.736 5.287 359 HB VAL 49 HB VAL 49 -12.141 9.204 3.604 360 HG11 VAL 49 1HG1 VAL 49 -12.676 6.172 3.216 361 HG12 VAL 49 2HG1 VAL 49 -11.553 7.197 2.244 362 HG13 VAL 49 3HG1 VAL 49 -13.322 7.492 2.169 363 HG21 VAL 49 3HG2 VAL 49 -13.968 7.323 5.260 364 HG22 VAL 49 1HG2 VAL 49 -14.548 8.539 4.064 365 HG23 VAL 49 2HG2 VAL 49 -13.703 9.080 5.549 366 H GLU 50 H GLU 50 -9.722 9.808 4.859 367 HA GLU 50 HA GLU 50 -8.007 9.008 2.827 368 HB2 GLU 50 2HB GLU 50 -7.363 10.963 5.120 369 HB3 GLU 50 1HB GLU 50 -6.567 10.897 3.510 370 HG2 GLU 50 2HG GLU 50 -9.535 11.644 3.994 371 HG3 GLU 50 1HG GLU 50 -8.180 12.792 3.734 372 H THR 51 H THR 51 -8.043 8.034 6.178 373 HA THR 51 HA THR 51 -5.223 7.171 5.957 374 HB THR 51 HB THR 51 -5.460 8.733 7.724 375 HG1 THR 51 1HG THR 51 -4.866 7.412 9.474 376 HG21 THR 51 3HG2 THR 51 -7.862 8.664 8.138 377 HG22 THR 51 1HG2 THR 51 -7.018 8.316 9.669 378 HG23 THR 51 2HG2 THR 51 -7.782 6.970 8.741 379 H ALA 52 H ALA 52 -8.602 6.055 6.459 380 HA ALA 52 HA ALA 52 -7.928 3.487 7.297 381 HB1 ALA 52 1HB ALA 52 -10.378 4.450 5.686 382 HB2 ALA 52 2HB ALA 52 -10.235 4.415 7.484 383 HB3 ALA 52 3HB ALA 52 -10.262 2.876 6.555 384 H THR 53 H THR 53 -7.707 4.918 4.118 385 HA THR 53 HA THR 53 -7.602 2.280 2.840 386 HB THR 53 HB THR 53 -7.420 3.811 0.753 387 HG1 THR 53 1HG THR 53 -8.630 5.716 2.527 388 HG21 THR 53 3HG2 THR 53 -9.992 3.799 2.492 389 HG22 THR 53 1HG2 THR 53 -9.449 2.492 1.379 390 HG23 THR 53 2HG2 THR 53 -9.907 4.100 0.713 391 H THR 54 H THR 54 -5.615 4.051 4.667 392 HA THR 54 HA THR 54 -3.593 4.544 4.906 393 HB THR 54 HB THR 54 -1.927 2.906 4.711 394 HG1 THR 54 1HG THR 54 -2.152 2.353 2.586 395 HG21 THR 54 3HG2 THR 54 -4.648 1.409 4.904 396 HG22 THR 54 1HG2 THR 54 -4.030 2.486 6.196 397 HG23 THR 54 2HG2 THR 54 -3.100 1.021 5.730 398 H VAL 55 H VAL 55 -4.812 5.790 2.533 399 HA VAL 55 HA VAL 55 -2.629 6.003 0.683 400 HB VAL 55 HB VAL 55 -4.038 7.757 -0.407 401 HG11 VAL 55 1HG1 VAL 55 -5.624 6.069 -1.281 402 HG12 VAL 55 2HG1 VAL 55 -5.397 5.031 0.173 403 HG13 VAL 55 3HG1 VAL 55 -4.029 5.290 -0.964 404 HG21 VAL 55 3HG2 VAL 55 -6.536 7.690 0.377 405 HG22 VAL 55 1HG2 VAL 55 -5.432 8.673 1.382 406 HG23 VAL 55 2HG2 VAL 55 -5.972 7.035 1.917 407 H GLY 56 H GLY 56 -4.230 8.194 3.083 408 HA2 GLY 56 2HA GLY 56 -3.333 9.728 4.379 409 HA3 GLY 56 1HA GLY 56 -1.706 9.021 4.029 410 H TYR 57 H TYR 57 -4.227 10.752 2.124 411 HA TYR 57 HA TYR 57 -2.411 11.810 0.380 412 HB2 TYR 57 2HB TYR 57 -5.206 11.733 0.544 413 HB3 TYR 57 1HB TYR 57 -4.933 13.480 0.814 414 HD1 TYR 57 2HD TYR 57 -3.374 14.695 -0.975 415 HD2 TYR 57 1HD TYR 57 -5.129 10.816 -1.566 416 HE1 TYR 57 2HE TYR 57 -2.972 14.888 -3.387 417 HE2 TYR 57 1HE TYR 57 -4.798 11.040 -3.997 418 HH TYR 57 HH TYR 57 -2.907 13.687 -5.419 419 H GLY 58 H GLY 58 -2.968 12.822 3.595 420 HA2 GLY 58 2HA GLY 58 -1.754 14.333 4.742 421 HA3 GLY 58 1HA GLY 58 -1.066 14.930 3.196 422 H ASP 59 H ASP 59 -4.491 14.634 4.131 423 HA ASP 59 HA ASP 59 -5.089 17.227 3.188 424 HB2 ASP 59 2HB ASP 59 -6.728 15.227 3.355 425 HB3 ASP 59 1HB ASP 59 -6.849 15.571 5.114 426 H ARG 60 H ARG 60 -4.563 15.829 6.457 427 HA ARG 60 HA ARG 60 -4.353 18.568 7.515 428 HB2 ARG 60 2HB ARG 60 -5.549 16.204 9.060 429 HB3 ARG 60 1HB ARG 60 -5.350 17.875 9.674 430 HG2 ARG 60 2HG ARG 60 -7.117 17.035 7.305 431 HG3 ARG 60 1HG ARG 60 -7.702 17.316 8.965 432 HD2 ARG 60 2HD ARG 60 -7.391 19.708 8.834 433 HD3 ARG 60 1HD ARG 60 -6.228 19.580 7.463 434 HE ARG 60 HE ARG 60 -7.981 18.837 5.965 435 HH11 ARG 60 1HH2 ARG 60 -9.288 20.805 8.785 436 HH12 ARG 60 2HH2 ARG 60 -10.871 20.335 8.435 437 HH21 ARG 60 1HH1 ARG 60 -10.226 19.040 5.245 438 HH22 ARG 60 2HH1 ARG 60 -11.379 19.738 6.334 439 H TYR 61 H TYR 61 -3.376 17.842 10.110 440 HA TYR 61 HA TYR 61 -1.095 16.187 9.555 441 HB2 TYR 61 2HB TYR 61 -0.251 18.490 8.959 442 HB3 TYR 61 1HB TYR 61 -0.934 19.132 10.503 443 HD1 TYR 61 2HD TYR 61 1.042 15.960 9.795 444 HD2 TYR 61 1HD TYR 61 0.924 19.762 11.819 445 HE1 TYR 61 2HE TYR 61 2.974 15.338 11.079 446 HE2 TYR 61 1HE TYR 61 2.992 19.171 13.026 447 HH TYR 61 HH TYR 61 4.632 15.971 12.545 448 HA PRO 62 HA PRO 62 -2.901 15.848 13.781 449 HB2 PRO 62 2HB PRO 62 -2.168 13.205 14.311 450 HB3 PRO 62 1HB PRO 62 -3.519 13.587 13.178 451 HG2 PRO 62 2HG PRO 62 -0.585 12.959 12.504 452 HG3 PRO 62 1HG PRO 62 -2.071 12.225 11.769 453 HD2 PRO 62 2HD PRO 62 -0.651 14.387 10.674 454 HD3 PRO 62 1HD PRO 62 -2.451 14.191 10.432 455 H VAL 63 H VAL 63 -1.667 15.046 15.964 456 HA VAL 63 HA VAL 63 1.192 15.553 15.695 457 HB VAL 63 HB VAL 63 -0.057 17.712 15.936 458 HG11 VAL 63 1HG1 VAL 63 -1.201 18.248 18.064 459 HG12 VAL 63 2HG1 VAL 63 -0.979 16.569 18.661 460 HG13 VAL 63 3HG1 VAL 63 -2.002 16.908 17.209 461 HG21 VAL 63 3HG2 VAL 63 1.394 18.729 17.541 462 HG22 VAL 63 1HG2 VAL 63 2.314 17.437 16.713 463 HG23 VAL 63 2HG2 VAL 63 1.714 17.198 18.405 464 H THR 64 H THR 64 1.972 15.382 18.251 465 HA THR 64 HA THR 64 1.560 12.723 18.911 466 HB THR 64 HB THR 64 2.826 15.050 20.451 467 HG1 THR 64 1HG THR 64 4.033 14.700 18.734 468 HG21 THR 64 3HG2 THR 64 4.077 13.321 21.760 469 HG22 THR 64 1HG2 THR 64 3.109 12.012 21.009 470 HG23 THR 64 2HG2 THR 64 2.321 13.211 22.094 471 H GLU 65 H GLU 65 0.135 15.706 20.450 472 HA GLU 65 HA GLU 65 -0.846 14.075 22.580 473 HB2 GLU 65 2HB GLU 65 -0.060 16.484 22.892 474 HB3 GLU 65 1HB GLU 65 -1.640 16.994 22.203 475 HG2 GLU 65 2HG GLU 65 -2.836 15.791 24.026 476 HG3 GLU 65 1HG GLU 65 -1.290 15.086 24.624 477 H GLU 66 H GLU 66 -2.009 14.567 19.405 478 HA GLU 66 HA GLU 66 -4.770 14.329 20.005 479 HB2 GLU 66 2HB GLU 66 -5.163 14.164 17.736 480 HB3 GLU 66 1HB GLU 66 -3.618 15.008 17.735 481 HG2 GLU 66 2HG GLU 66 -3.413 13.478 16.019 482 HG3 GLU 66 1HG GLU 66 -2.547 12.586 17.317 483 H GLY 67 H GLY 67 -1.971 12.345 19.746 484 HA2 GLY 67 2HA GLY 67 -1.505 10.505 20.970 485 HA3 GLY 67 1HA GLY 67 -3.282 10.152 21.144 486 H ARG 68 H ARG 68 -0.855 10.778 18.602 487 HA ARG 68 HA ARG 68 -1.659 10.245 16.353 488 HB2 ARG 68 2HB ARG 68 0.789 10.481 16.947 489 HB3 ARG 68 1HB ARG 68 0.834 8.719 17.295 490 HG2 ARG 68 2HG ARG 68 0.072 8.376 14.810 491 HG3 ARG 68 1HG ARG 68 0.350 10.123 14.589 492 HD2 ARG 68 2HD ARG 68 2.429 7.990 15.489 493 HD3 ARG 68 1HD ARG 68 2.261 8.638 13.833 494 HE ARG 68 HE ARG 68 3.833 9.681 15.778 495 HH11 ARG 68 1HH2 ARG 68 2.336 10.434 12.721 496 HH12 ARG 68 2HH2 ARG 68 2.774 12.090 12.770 497 HH21 ARG 68 1HH1 ARG 68 4.391 12.197 15.815 498 HH22 ARG 68 2HH1 ARG 68 4.040 12.933 14.263 499 H LYS 69 H LYS 69 -1.513 7.597 18.591 500 HA LYS 69 HA LYS 69 -2.094 5.442 16.943 501 HB2 LYS 69 2HB LYS 69 -3.017 6.028 19.804 502 HB3 LYS 69 1HB LYS 69 -3.264 4.465 18.953 503 HG2 LYS 69 2HG LYS 69 -0.830 4.139 18.725 504 HG3 LYS 69 1HG LYS 69 -0.504 5.674 19.605 505 HD2 LYS 69 2HD LYS 69 -1.583 4.769 21.657 506 HD3 LYS 69 1HD LYS 69 -2.146 3.321 20.760 507 HE2 LYS 69 2HE LYS 69 -0.211 2.804 22.259 508 HE3 LYS 69 1HE LYS 69 0.157 2.455 20.531 509 HZ1 LYS 69 3HZ LYS 69 1.985 3.565 21.624 510 HZ2 LYS 69 1HZ LYS 69 0.978 4.873 22.053 511 HZ3 LYS 69 2HZ LYS 69 1.363 4.504 20.387 512 H VAL 70 H VAL 70 -4.176 8.344 17.317 513 HA VAL 70 HA VAL 70 -6.582 6.801 16.960 514 HB VAL 70 HB VAL 70 -6.163 9.715 16.169 515 HG11 VAL 70 1HG1 VAL 70 -8.123 8.648 15.059 516 HG12 VAL 70 2HG1 VAL 70 -8.646 9.806 16.315 517 HG13 VAL 70 3HG1 VAL 70 -8.715 8.028 16.647 518 HG21 VAL 70 3HG2 VAL 70 -7.225 8.537 18.833 519 HG22 VAL 70 1HG2 VAL 70 -7.262 10.271 18.314 520 HG23 VAL 70 2HG2 VAL 70 -5.688 9.480 18.577 521 H ALA 71 H ALA 71 -4.315 8.674 14.923 522 HA ALA 71 HA ALA 71 -5.454 8.002 12.455 523 HB1 ALA 71 1HB ALA 71 -2.483 8.573 13.094 524 HB2 ALA 71 2HB ALA 71 -3.718 9.820 12.711 525 HB3 ALA 71 3HB ALA 71 -3.232 8.622 11.455 526 H GLU 72 H GLU 72 -2.905 6.397 14.407 527 HA GLU 72 HA GLU 72 -2.284 4.458 12.486 528 HB2 GLU 72 2HB GLU 72 -0.893 4.910 14.630 529 HB3 GLU 72 1HB GLU 72 -2.127 3.938 15.496 530 HG2 GLU 72 2HG GLU 72 -1.515 2.121 13.530 531 HG3 GLU 72 1HG GLU 72 0.010 3.063 13.486 532 H GLN 73 H GLN 73 -4.705 4.358 15.188 533 HA GLN 73 HA GLN 73 -5.169 1.632 14.934 534 HB2 GLN 73 2HB GLN 73 -5.826 3.080 16.911 535 HB3 GLN 73 1HB GLN 73 -7.195 3.714 15.940 536 HG2 GLN 73 2HG GLN 73 -8.105 1.310 15.810 537 HG3 GLN 73 1HG GLN 73 -6.685 0.761 16.765 538 HE21 GLN 73 1HE2 GLN 73 -9.524 3.025 16.885 539 HE22 GLN 73 2HE2 GLN 73 -9.745 2.925 18.598 540 H VAL 74 H VAL 74 -6.759 4.428 13.296 541 HA VAL 74 HA VAL 74 -8.706 2.691 12.102 542 HB VAL 74 HB VAL 74 -9.263 4.968 12.624 543 HG11 VAL 74 1HG1 VAL 74 -7.198 5.780 10.479 544 HG12 VAL 74 2HG1 VAL 74 -7.091 6.096 12.239 545 HG13 VAL 74 3HG1 VAL 74 -8.382 6.879 11.276 546 HG21 VAL 74 3HG2 VAL 74 -9.350 4.405 9.586 547 HG22 VAL 74 1HG2 VAL 74 -10.426 5.521 10.499 548 HG23 VAL 74 2HG2 VAL 74 -10.492 3.748 10.817 549 H MET 75 H MET 75 -5.523 3.981 11.201 550 HA MET 75 HA MET 75 -5.540 3.295 8.513 551 HB2 MET 75 2HB MET 75 -3.920 4.795 9.712 552 HB3 MET 75 1HB MET 75 -3.189 3.367 10.510 553 HG2 MET 75 2HG MET 75 -2.539 2.525 8.193 554 HG3 MET 75 1HG MET 75 -3.203 4.045 7.510 555 HE1 MET 75 3HE MET 75 -2.296 6.411 7.906 556 HE2 MET 75 1HE MET 75 -0.841 6.853 8.864 557 HE3 MET 75 2HE MET 75 -2.337 6.325 9.699 558 H LYS 76 H LYS 76 -4.311 1.463 11.401 559 HA LYS 76 HA LYS 76 -3.549 -0.723 9.788 560 HB2 LYS 76 2HB LYS 76 -2.728 -0.147 12.243 561 HB3 LYS 76 1HB LYS 76 -4.127 -1.137 12.753 562 HG2 LYS 76 2HG LYS 76 -2.843 -2.665 10.689 563 HG3 LYS 76 1HG LYS 76 -1.486 -1.918 11.590 564 HD2 LYS 76 2HD LYS 76 -2.437 -2.935 13.729 565 HD3 LYS 76 1HD LYS 76 -3.750 -3.674 12.742 566 HE2 LYS 76 2HE LYS 76 -1.926 -4.879 11.365 567 HE3 LYS 76 1HE LYS 76 -0.710 -4.275 12.559 568 HZ1 LYS 76 3HZ LYS 76 -3.000 -6.127 13.031 569 HZ2 LYS 76 1HZ LYS 76 -1.991 -5.528 14.281 570 HZ3 LYS 76 2HZ LYS 76 -1.347 -6.503 13.053 571 H ALA 77 H ALA 77 -6.567 0.098 11.487 572 HA ALA 77 HA ALA 77 -7.748 -2.433 11.353 573 HB1 ALA 77 1HB ALA 77 -9.110 0.326 11.180 574 HB2 ALA 77 2HB ALA 77 -8.737 -0.566 12.703 575 HB3 ALA 77 3HB ALA 77 -9.939 -1.240 11.542 576 H GLY 78 H GLY 78 -7.442 0.174 8.938 577 HA2 GLY 78 2HA GLY 78 -9.188 -0.892 7.010 578 HA3 GLY 78 1HA GLY 78 -7.778 0.209 6.768 579 H ILE 79 H ILE 79 -5.686 -1.352 7.585 580 HA ILE 79 HA ILE 79 -5.189 -2.923 5.348 581 HB ILE 79 HB ILE 79 -3.806 -3.112 8.081 582 HG12 ILE 79 2HG1 ILE 79 -3.167 -1.342 5.636 583 HG13 ILE 79 1HG1 ILE 79 -3.843 -0.766 7.188 584 HG21 ILE 79 1HG2 ILE 79 -3.277 -5.049 6.543 585 HG22 ILE 79 2HG2 ILE 79 -1.853 -3.987 6.741 586 HG23 ILE 79 3HG2 ILE 79 -2.844 -3.883 5.239 587 HD11 ILE 79 3HD ILE 79 -1.036 -1.968 6.752 588 HD12 ILE 79 1HD ILE 79 -1.461 -0.276 7.168 589 HD13 ILE 79 2HD ILE 79 -1.736 -1.589 8.374 590 H GLU 80 H GLU 80 -6.178 -3.842 8.707 591 HA GLU 80 HA GLU 80 -5.997 -6.592 8.104 592 HB2 GLU 80 2HB GLU 80 -7.523 -5.307 10.424 593 HB3 GLU 80 1HB GLU 80 -7.106 -7.048 10.240 594 HG2 GLU 80 2HG GLU 80 -4.620 -6.303 10.064 595 HG3 GLU 80 1HG GLU 80 -5.163 -4.676 10.596 596 H VAL 81 H VAL 81 -8.648 -4.266 7.681 597 HA VAL 81 HA VAL 81 -10.622 -6.231 7.120 598 HB VAL 81 HB VAL 81 -10.335 -3.261 6.508 599 HG11 VAL 81 1HG1 VAL 81 -11.604 -4.084 4.572 600 HG12 VAL 81 2HG1 VAL 81 -12.771 -3.360 5.721 601 HG13 VAL 81 3HG1 VAL 81 -12.618 -5.147 5.618 602 HG21 VAL 81 3HG2 VAL 81 -12.292 -4.905 8.267 603 HG22 VAL 81 1HG2 VAL 81 -12.182 -3.111 8.178 604 HG23 VAL 81 2HG2 VAL 81 -10.826 -4.056 8.877 605 H PHE 82 H PHE 82 -8.511 -4.203 4.945 606 HA PHE 82 HA PHE 82 -9.549 -5.477 2.654 607 HB2 PHE 82 2HB PHE 82 -6.935 -3.869 2.983 608 HB3 PHE 82 1HB PHE 82 -7.612 -4.403 1.395 609 HD1 PHE 82 1HD PHE 82 -10.414 -3.909 1.401 610 HD2 PHE 82 2HD PHE 82 -7.314 -1.580 3.275 611 HE1 PHE 82 1HE PHE 82 -11.879 -1.942 1.371 612 HE2 PHE 82 2HE PHE 82 -8.780 0.397 3.228 613 HZ PHE 82 HZ PHE 82 -11.067 0.240 2.273 614 H ALA 83 H ALA 83 -6.732 -6.221 4.707 615 HA ALA 83 HA ALA 83 -5.637 -8.098 2.927 616 HB1 ALA 83 1HB ALA 83 -5.431 -8.072 5.999 617 HB2 ALA 83 2HB ALA 83 -4.368 -7.148 4.879 618 HB3 ALA 83 3HB ALA 83 -4.336 -8.941 4.849 619 H LEU 84 H LEU 84 -8.275 -8.319 5.331 620 HA LEU 84 HA LEU 84 -8.338 -11.112 5.524 621 HB2 LEU 84 2HB LEU 84 -9.415 -9.500 7.098 622 HB3 LEU 84 1HB LEU 84 -10.664 -9.119 5.883 623 HG LEU 84 HG LEU 84 -10.250 -12.022 6.749 624 HD11 LEU 84 1HD1 LEU 84 -11.694 -11.701 8.765 625 HD12 LEU 84 2HD1 LEU 84 -11.715 -9.919 8.472 626 HD13 LEU 84 3HD1 LEU 84 -10.167 -10.748 8.886 627 HD21 LEU 84 3HD2 LEU 84 -12.756 -12.140 6.546 628 HD22 LEU 84 1HD2 LEU 84 -12.021 -11.553 5.020 629 HD23 LEU 84 2HD2 LEU 84 -12.811 -10.389 6.137 630 H VAL 85 H VAL 85 -9.587 -8.880 3.102 631 HA VAL 85 HA VAL 85 -11.455 -10.512 1.857 632 HB VAL 85 HB VAL 85 -9.685 -8.344 0.615 633 HG11 VAL 85 1HG1 VAL 85 -11.666 -8.021 -0.943 634 HG12 VAL 85 2HG1 VAL 85 -12.371 -9.561 -0.321 635 HG13 VAL 85 3HG1 VAL 85 -10.798 -9.563 -1.198 636 HG21 VAL 85 3HG2 VAL 85 -11.672 -6.856 1.157 637 HG22 VAL 85 1HG2 VAL 85 -10.865 -7.478 2.621 638 HG23 VAL 85 2HG2 VAL 85 -12.418 -8.211 2.082 639 H THR 86 H THR 86 -8.043 -10.983 2.061 640 HA THR 86 HA THR 86 -7.400 -12.252 -0.276 641 HB THR 86 HB THR 86 -6.569 -13.042 2.561 642 HG1 THR 86 1HG THR 86 -5.934 -11.015 2.221 643 HG21 THR 86 3HG2 THR 86 -5.956 -14.865 0.942 644 HG22 THR 86 1HG2 THR 86 -4.500 -13.954 1.429 645 HG23 THR 86 2HG2 THR 86 -5.243 -13.643 -0.183 646 H ALA 87 H ALA 87 -9.579 -13.446 2.282 647 HA ALA 87 HA ALA 87 -9.564 -16.154 1.588 648 HB1 ALA 87 1HB ALA 87 -11.932 -14.458 2.605 649 HB2 ALA 87 2HB ALA 87 -10.704 -15.267 3.641 650 HB3 ALA 87 3HB ALA 87 -11.829 -16.261 2.652 651 H ALA 88 H ALA 88 -10.843 -13.395 -0.103 652 HA ALA 88 HA ALA 88 -12.452 -14.978 -1.958 653 HB1 ALA 88 1HB ALA 88 -11.845 -11.944 -1.787 654 HB2 ALA 88 2HB ALA 88 -13.402 -12.737 -1.370 655 HB3 ALA 88 3HB ALA 88 -12.810 -12.722 -3.070 656 H LEU 89 H LEU 89 -9.667 -12.680 -1.950 657 HA LEU 89 HA LEU 89 -9.132 -12.879 -4.616 658 HB2 LEU 89 2HB LEU 89 -6.970 -12.489 -2.467 659 HB3 LEU 89 1HB LEU 89 -6.908 -11.954 -4.175 660 HG LEU 89 HG LEU 89 -8.803 -10.884 -1.993 661 HD11 LEU 89 1HD1 LEU 89 -6.437 -10.194 -1.671 662 HD12 LEU 89 2HD1 LEU 89 -7.472 -8.806 -2.146 663 HD13 LEU 89 3HD1 LEU 89 -6.378 -9.562 -3.357 664 HD21 LEU 89 3HD2 LEU 89 -9.431 -9.114 -3.653 665 HD22 LEU 89 1HD2 LEU 89 -9.976 -10.746 -4.171 666 HD23 LEU 89 2HD2 LEU 89 -8.525 -9.995 -4.934 667 H ALA 90 H ALA 90 -7.872 -14.981 -2.007 668 HA ALA 90 HA ALA 90 -6.015 -16.279 -3.741 669 HB1 ALA 90 1HB ALA 90 -5.631 -16.151 -1.280 670 HB2 ALA 90 2HB ALA 90 -5.685 -17.859 -1.845 671 HB3 ALA 90 3HB ALA 90 -7.111 -17.136 -1.001 672 H THR 91 H THR 91 -9.459 -16.564 -3.399 673 HA THR 91 HA THR 91 -9.375 -19.351 -4.254 674 HB THR 91 HB THR 91 -11.040 -18.088 -2.482 675 HG1 THR 91 1HG THR 91 -10.784 -20.282 -2.811 676 HG21 THR 91 3HG2 THR 91 -13.296 -17.873 -3.444 677 HG22 THR 91 1HG2 THR 91 -12.708 -18.270 -5.091 678 HG23 THR 91 2HG2 THR 91 -12.210 -16.746 -4.298 679 H ASP 92 H ASP 92 -9.120 -16.198 -5.572 680 HA ASP 92 HA ASP 92 -10.925 -16.561 -7.684 681 HB2 ASP 92 2HB ASP 92 -9.985 -14.277 -6.880 682 HB3 ASP 92 1HB ASP 92 -8.564 -14.641 -7.922 683 H PHE 93 H PHE 93 -7.458 -17.293 -7.304 684 HA PHE 93 HA PHE 93 -7.167 -17.972 -10.040 685 HB2 PHE 93 2HB PHE 93 -5.017 -18.672 -9.652 686 HB3 PHE 93 1HB PHE 93 -5.224 -17.386 -8.426 687 HD1 PHE 93 1HD PHE 93 -5.370 -18.012 -5.998 688 HD2 PHE 93 2HD PHE 93 -4.773 -21.013 -9.018 689 HE1 PHE 93 1HE PHE 93 -4.687 -19.628 -4.263 690 HE2 PHE 93 2HE PHE 93 -4.152 -22.644 -7.272 691 HZ PHE 93 HZ PHE 93 -4.081 -21.951 -4.891 692 H VAL 94 H VAL 94 -8.513 -19.678 -7.316 693 HA VAL 94 HA VAL 94 -7.959 -22.302 -8.201 694 HB VAL 94 HB VAL 94 -10.147 -21.335 -6.288 695 HG11 VAL 94 1HG1 VAL 94 -8.740 -24.078 -6.633 696 HG12 VAL 94 2HG1 VAL 94 -10.463 -23.721 -7.008 697 HG13 VAL 94 3HG1 VAL 94 -9.884 -23.656 -5.309 698 HG21 VAL 94 3HG2 VAL 94 -8.417 -21.787 -4.509 699 HG22 VAL 94 1HG2 VAL 94 -7.864 -20.479 -5.597 700 HG23 VAL 94 2HG2 VAL 94 -7.192 -22.134 -5.779 701 H ARG 95 H ARG 95 -10.312 -19.864 -9.006 702 HA ARG 95 HA ARG 95 -12.315 -21.503 -10.125 703 HB2 ARG 95 2HB ARG 95 -11.464 -18.665 -10.974 704 HB3 ARG 95 1HB ARG 95 -13.040 -19.450 -11.330 705 HG2 ARG 95 2HG ARG 95 -13.624 -19.410 -8.909 706 HG3 ARG 95 1HG ARG 95 -11.998 -18.728 -8.517 707 HD2 ARG 95 2HD ARG 95 -12.503 -16.680 -9.898 708 HD3 ARG 95 1HD ARG 95 -14.150 -17.353 -10.253 709 HE ARG 95 HE ARG 95 -13.246 -16.924 -7.404 710 HH11 ARG 95 1HH2 ARG 95 -14.849 -15.383 -10.215 711 HH12 ARG 95 2HH2 ARG 95 -15.970 -14.496 -9.272 712 HH21 ARG 95 1HH1 ARG 95 -14.532 -15.303 -6.102 713 HH22 ARG 95 2HH1 ARG 95 -15.486 -14.221 -6.958 714 H ARG 96 H ARG 96 -9.043 -20.818 -11.178 715 HA ARG 96 HA ARG 96 -9.307 -20.848 -13.948 716 HB2 ARG 96 2HB ARG 96 -7.061 -21.985 -12.155 717 HB3 ARG 96 1HB ARG 96 -7.052 -22.261 -13.918 718 HG2 ARG 96 2HG ARG 96 -7.253 -19.680 -14.186 719 HG3 ARG 96 1HG ARG 96 -6.561 -19.627 -12.533 720 HD2 ARG 96 2HD ARG 96 -5.436 -21.146 -15.012 721 HD3 ARG 96 1HD ARG 96 -4.778 -19.588 -14.376 722 HE ARG 96 HE ARG 96 -4.538 -21.103 -12.158 723 HH11 ARG 96 1HH2 ARG 96 -3.705 -22.216 -15.576 724 HH12 ARG 96 2HH2 ARG 96 -2.386 -23.132 -15.023 725 HH21 ARG 96 1HH1 ARG 96 -2.649 -22.394 -11.577 726 HH22 ARG 96 2HH1 ARG 96 -2.113 -23.619 -12.677 727 H GLU 97 H GLU 97 -9.357 -23.616 -11.573 728 HA GLU 97 HA GLU 97 -9.041 -25.375 -13.818 729 HB2 GLU 97 2HB GLU 97 -9.347 -27.283 -12.377 730 HB3 GLU 97 1HB GLU 97 -7.963 -26.194 -12.001 731 HG2 GLU 97 2HG GLU 97 -9.061 -25.337 -9.988 732 HG3 GLU 97 1HG GLU 97 -10.570 -26.263 -10.360 733 H GLU 98 H GLU 98 -11.751 -23.803 -12.354 734 HA GLU 98 HA GLU 98 -13.637 -25.626 -13.470 735 HB2 GLU 98 2HB GLU 98 -14.052 -22.692 -12.631 736 HB3 GLU 98 1HB GLU 98 -15.310 -23.765 -13.321 737 HG2 GLU 98 2HG GLU 98 -14.718 -25.430 -11.390 738 HG3 GLU 98 1HG GLU 98 -13.923 -24.029 -10.588 739 H GLU 99 H GLU 99 -12.087 -22.547 -14.513 740 HA GLU 99 HA GLU 99 -13.473 -22.317 -16.915 741 HB2 GLU 99 2HB GLU 99 -11.742 -20.754 -15.552 742 HB3 GLU 99 1HB GLU 99 -10.574 -21.350 -16.758 743 HG2 GLU 99 2HG GLU 99 -13.295 -20.135 -17.612 744 HG3 GLU 99 1HG GLU 99 -11.974 -19.073 -17.017 745 H ARG 100 H ARG 100 -10.431 -23.928 -16.114 746 HA ARG 100 HA ARG 100 -9.499 -24.744 -18.513 747 HB2 ARG 100 2HB ARG 100 -8.402 -24.940 -16.258 748 HB3 ARG 100 1HB ARG 100 -9.463 -26.332 -15.869 749 HG2 ARG 100 2HG ARG 100 -8.313 -27.733 -17.528 750 HG3 ARG 100 1HG ARG 100 -7.508 -26.302 -18.244 751 HD2 ARG 100 2HD ARG 100 -5.900 -27.634 -16.864 752 HD3 ARG 100 1HD ARG 100 -6.119 -25.948 -16.231 753 HE ARG 100 HE ARG 100 -7.945 -27.807 -14.917 754 HH11 ARG 100 1HH2 ARG 100 -4.401 -26.887 -14.986 755 HH12 ARG 100 2HH2 ARG 100 -4.120 -27.429 -13.411 756 HH21 ARG 100 1HH1 ARG 100 -7.439 -28.373 -12.555 757 HH22 ARG 100 2HH1 ARG 100 -5.871 -28.258 -12.025 758 H ARG 101 H ARG 101 -12.035 -26.450 -16.572 759 HA ARG 101 HA ARG 101 -12.384 -28.314 -18.855 760 HB2 ARG 101 2HB ARG 101 -13.195 -28.584 -15.900 761 HB3 ARG 101 1HB ARG 101 -13.826 -29.636 -17.216 762 HG2 ARG 101 2HG ARG 101 -11.389 -30.043 -17.892 763 HG3 ARG 101 1HG ARG 101 -10.934 -29.481 -16.245 764 HD2 ARG 101 2HD ARG 101 -12.193 -31.310 -15.194 765 HD3 ARG 101 1HD ARG 101 -13.078 -31.677 -16.742 766 HE ARG 101 HE ARG 101 -10.515 -32.024 -17.557 767 HH11 ARG 101 1HH2 ARG 101 -12.564 -33.495 -14.995 768 HH12 ARG 101 2HH2 ARG 101 -11.599 -34.862 -14.749 769 HH21 ARG 101 1HH1 ARG 101 -9.377 -34.121 -17.468 770 HH22 ARG 101 2HH1 ARG 101 -9.471 -35.087 -16.059 771 H GLY 102 H GLY 102 -13.550 -25.401 -17.886 772 HA2 GLY 102 2HA GLY 102 -15.367 -24.267 -18.281 773 HA3 GLY 102 1HA GLY 102 -15.927 -25.610 -19.346 774 H HIS 103 H HIS 103 -15.248 -26.219 -15.924 775 HA HIS 103 HA HIS 103 -18.057 -26.162 -15.210 776 HB2 HIS 103 2HB HIS 103 -16.472 -28.839 -15.347 777 HB3 HIS 103 1HB HIS 103 -18.034 -28.619 -14.504 778 HD1 HIS 103 1HD HIS 103 -16.686 -28.517 -18.144 779 HD2 HIS 103 2HD HIS 103 -20.247 -29.151 -15.969 780 HE1 HIS 103 1HE HIS 103 -18.441 -29.276 -19.786 781 HE2 HIS 103 2HE HIS 103 -20.595 -29.656 -18.420 782 H1 SER 1 H SER 1 0.830 -13.088 -20.600 783 HA SER 1 HA SER 1 1.614 -14.984 -22.592 784 HB2 SER 1 2HB SER 1 3.044 -13.618 -20.710 785 HB3 SER 1 1HB SER 1 2.690 -15.055 -19.716 786 HG SER 1 1HG SER 1 4.651 -15.015 -20.943 787 H ALA 2 H ALA 2 0.552 -15.182 -19.109 788 HA ALA 2 HA ALA 2 -0.478 -17.865 -19.682 789 HB1 ALA 2 1HB ALA 2 -1.114 -17.965 -17.288 790 HB2 ALA 2 2HB ALA 2 -0.645 -16.227 -17.092 791 HB3 ALA 2 3HB ALA 2 0.607 -17.460 -17.466 792 H ASP 3 H ASP 3 -2.885 -18.364 -19.021 793 HA ASP 3 HA ASP 3 -4.443 -16.532 -20.514 794 HB2 ASP 3 2HB ASP 3 -6.441 -17.987 -19.815 795 HB3 ASP 3 1HB ASP 3 -5.169 -18.671 -20.866 796 H HIS 4 H HIS 4 -4.369 -17.433 -17.106 797 HA HIS 4 HA HIS 4 -6.155 -15.541 -16.176 798 HB2 HIS 4 2HB HIS 4 -5.122 -15.657 -13.962 799 HB3 HIS 4 1HB HIS 4 -5.148 -17.291 -14.682 800 HD1 HIS 4 1HD HIS 4 -2.717 -18.392 -14.964 801 HD2 HIS 4 2HD HIS 4 -2.542 -14.249 -14.270 802 HE1 HIS 4 1HE HIS 4 -0.270 -17.764 -14.575 803 HE2 HIS 4 2HE HIS 4 -0.195 -15.299 -14.456 804 H GLU 5 H GLU 5 -3.057 -14.836 -17.566 805 HA GLU 5 HA GLU 5 -2.449 -12.504 -16.009 806 HB2 GLU 5 2HB GLU 5 -0.810 -14.066 -17.256 807 HB3 GLU 5 1HB GLU 5 -1.416 -13.358 -18.785 808 HG2 GLU 5 2HG GLU 5 -0.579 -11.084 -18.050 809 HG3 GLU 5 1HG GLU 5 0.082 -11.848 -16.545 810 H ARG 6 H ARG 6 -4.106 -13.386 -19.048 811 HA ARG 6 HA ARG 6 -4.198 -10.754 -20.075 812 HB2 ARG 6 2HB ARG 6 -5.954 -13.206 -20.655 813 HB3 ARG 6 1HB ARG 6 -6.077 -11.638 -21.525 814 HG2 ARG 6 2HG ARG 6 -3.716 -11.831 -22.292 815 HG3 ARG 6 1HG ARG 6 -3.523 -13.376 -21.407 816 HD2 ARG 6 2HD ARG 6 -3.955 -13.662 -23.918 817 HD3 ARG 6 1HD ARG 6 -5.124 -14.523 -22.829 818 HE ARG 6 HE ARG 6 -5.856 -11.768 -23.782 819 HH11 ARG 6 1HH2 ARG 6 -6.119 -15.261 -24.617 820 HH12 ARG 6 2HH2 ARG 6 -7.821 -15.232 -24.887 821 HH21 ARG 6 1HH1 ARG 6 -8.201 -11.663 -24.525 822 HH22 ARG 6 2HH1 ARG 6 -8.859 -13.051 -25.221 823 H GLU 7 H GLU 7 -6.145 -12.474 -17.688 824 HA GLU 7 HA GLU 7 -8.376 -10.739 -17.858 825 HB2 GLU 7 2HB GLU 7 -8.065 -13.122 -16.645 826 HB3 GLU 7 1HB GLU 7 -7.614 -12.118 -15.246 827 HG2 GLU 7 2HG GLU 7 -9.958 -12.615 -15.034 828 HG3 GLU 7 1HG GLU 7 -9.891 -10.888 -15.536 829 H ALA 8 H ALA 8 -5.405 -10.883 -15.932 830 HA ALA 8 HA ALA 8 -5.881 -8.688 -14.255 831 HB1 ALA 8 1HB ALA 8 -4.133 -10.397 -13.720 832 HB2 ALA 8 2HB ALA 8 -3.368 -8.772 -13.884 833 HB3 ALA 8 3HB ALA 8 -3.227 -9.958 -15.218 834 H GLN 9 H GLN 9 -4.285 -9.015 -17.412 835 HA GLN 9 HA GLN 9 -3.133 -6.553 -17.694 836 HB2 GLN 9 2HB GLN 9 -2.923 -8.568 -19.217 837 HB3 GLN 9 1HB GLN 9 -4.574 -8.245 -19.840 838 HG2 GLN 9 2HG GLN 9 -3.787 -6.105 -20.870 839 HG3 GLN 9 1HG GLN 9 -2.154 -6.349 -20.143 840 HE21 GLN 9 1HE2 GLN 9 -0.935 -6.702 -22.066 841 HE22 GLN 9 2HE2 GLN 9 -1.212 -8.023 -23.144 842 H LYS 10 H LYS 10 -6.545 -7.483 -18.202 843 HA LYS 10 HA LYS 10 -7.253 -4.947 -19.350 844 HB2 LYS 10 2HB LYS 10 -9.038 -7.129 -18.158 845 HB3 LYS 10 1HB LYS 10 -9.596 -5.746 -19.162 846 HG2 LYS 10 2HG LYS 10 -8.451 -6.558 -21.142 847 HG3 LYS 10 1HG LYS 10 -7.708 -7.925 -20.246 848 HD2 LYS 10 2HD LYS 10 -10.735 -7.461 -20.518 849 HD3 LYS 10 1HD LYS 10 -9.794 -8.511 -21.633 850 HE2 LYS 10 2HE LYS 10 -9.339 -10.167 -19.955 851 HE3 LYS 10 1HE LYS 10 -9.684 -9.037 -18.596 852 HZ1 LYS 10 3HZ LYS 10 -11.675 -10.293 -20.393 853 HZ2 LYS 10 1HZ LYS 10 -12.009 -9.034 -19.247 854 HZ3 LYS 10 2HZ LYS 10 -11.395 -10.546 -18.748 855 H ALA 11 H ALA 11 -6.710 -6.046 -16.096 856 HA ALA 11 HA ALA 11 -8.720 -4.408 -14.865 857 HB1 ALA 11 1HB ALA 11 -6.177 -5.603 -13.595 858 HB2 ALA 11 2HB ALA 11 -7.763 -6.453 -13.700 859 HB3 ALA 11 3HB ALA 11 -7.608 -4.948 -12.735 860 H GLU 12 H GLU 12 -5.268 -4.165 -15.784 861 HA GLU 12 HA GLU 12 -4.748 -1.676 -14.602 862 HB2 GLU 12 2HB GLU 12 -3.609 -2.726 -17.280 863 HB3 GLU 12 1HB GLU 12 -2.936 -1.407 -16.266 864 HG2 GLU 12 2HG GLU 12 -2.504 -3.137 -14.431 865 HG3 GLU 12 1HG GLU 12 -3.016 -4.428 -15.583 866 H GLU 13 H GLU 13 -6.031 -2.599 -17.788 867 HA GLU 13 HA GLU 13 -6.169 -0.079 -18.962 868 HB2 GLU 13 2HB GLU 13 -6.435 -2.351 -20.138 869 HB3 GLU 13 1HB GLU 13 -8.062 -2.481 -19.399 870 HG2 GLU 13 2HG GLU 13 -8.665 -0.279 -20.624 871 HG3 GLU 13 1HG GLU 13 -7.104 -0.424 -21.502 872 H GLU 14 H GLU 14 -8.506 -1.957 -17.045 873 HA GLU 14 HA GLU 14 -10.743 -0.390 -17.248 874 HB2 GLU 14 2HB GLU 14 -10.455 -2.735 -16.125 875 HB3 GLU 14 1HB GLU 14 -9.801 -1.873 -14.712 876 HG2 GLU 14 2HG GLU 14 -11.975 -2.142 -14.019 877 HG3 GLU 14 1HG GLU 14 -12.143 -0.531 -14.799 878 H LEU 15 H LEU 15 -7.942 -0.132 -15.036 879 HA LEU 15 HA LEU 15 -9.065 1.710 -13.300 880 HB2 LEU 15 2HB LEU 15 -6.921 0.348 -12.953 881 HB3 LEU 15 1HB LEU 15 -6.077 1.482 -14.033 882 HG LEU 15 HG LEU 15 -6.497 3.368 -12.487 883 HD11 LEU 15 1HD1 LEU 15 -8.025 1.344 -10.714 884 HD12 LEU 15 2HD1 LEU 15 -8.678 2.830 -11.501 885 HD13 LEU 15 3HD1 LEU 15 -7.484 2.969 -10.183 886 HD21 LEU 15 3HD2 LEU 15 -5.329 0.924 -11.002 887 HD22 LEU 15 1HD2 LEU 15 -5.005 2.652 -10.639 888 HD23 LEU 15 2HD2 LEU 15 -4.460 1.954 -12.198 889 H GLN 16 H GLN 16 -7.221 2.149 -16.307 890 HA GLN 16 HA GLN 16 -6.772 4.897 -16.152 891 HB2 GLN 16 2HB GLN 16 -7.344 3.230 -18.681 892 HB3 GLN 16 1HB GLN 16 -6.540 4.833 -18.644 893 HG2 GLN 16 2HG GLN 16 -4.572 3.879 -17.479 894 HG3 GLN 16 1HG GLN 16 -5.404 2.288 -17.297 895 HE21 GLN 16 1HE2 GLN 16 -3.727 1.221 -18.573 896 HE22 GLN 16 2HE2 GLN 16 -3.701 1.368 -20.294 897 H LYS 17 H LYS 17 -9.570 3.015 -17.181 898 HA LYS 17 HA LYS 17 -10.980 5.053 -18.498 899 HB2 LYS 17 2HB LYS 17 -11.362 2.502 -18.604 900 HB3 LYS 17 1HB LYS 17 -12.092 2.623 -16.976 901 HG2 LYS 17 2HG LYS 17 -13.860 4.221 -18.011 902 HG3 LYS 17 1HG LYS 17 -13.123 3.839 -19.606 903 HD2 LYS 17 2HD LYS 17 -14.962 2.333 -19.417 904 HD3 LYS 17 1HD LYS 17 -13.505 1.346 -19.050 905 HE2 LYS 17 2HE LYS 17 -14.047 1.779 -16.506 906 HE3 LYS 17 1HE LYS 17 -15.613 2.480 -17.078 907 HZ1 LYS 17 3HZ LYS 17 -15.774 0.174 -18.307 908 HZ2 LYS 17 1HZ LYS 17 -16.098 0.298 -16.626 909 HZ3 LYS 17 2HZ LYS 17 -14.619 -0.302 -17.139 910 H VAL 18 H VAL 18 -10.726 4.085 -15.078 911 HA VAL 18 HA VAL 18 -12.955 5.590 -14.173 912 HB VAL 18 HB VAL 18 -10.484 4.690 -12.586 913 HG11 VAL 18 1HG1 VAL 18 -12.070 4.785 -10.630 914 HG12 VAL 18 2HG1 VAL 18 -13.358 5.452 -11.701 915 HG13 VAL 18 3HG1 VAL 18 -11.859 6.401 -11.378 916 HG21 VAL 18 3HG2 VAL 18 -11.915 2.698 -11.971 917 HG22 VAL 18 1HG2 VAL 18 -11.495 2.722 -13.709 918 HG23 VAL 18 2HG2 VAL 18 -13.146 3.220 -13.182 919 H LEU 19 H LEU 19 -9.453 6.177 -14.612 920 HA LEU 19 HA LEU 19 -9.358 8.601 -13.247 921 HB2 LEU 19 2HB LEU 19 -7.603 7.837 -15.648 922 HB3 LEU 19 1HB LEU 19 -7.239 9.056 -14.387 923 HG LEU 19 HG LEU 19 -7.351 6.001 -14.098 924 HD11 LEU 19 1HD1 LEU 19 -5.270 6.937 -15.100 925 HD12 LEU 19 2HD1 LEU 19 -4.965 6.224 -13.471 926 HD13 LEU 19 3HD1 LEU 19 -5.057 8.010 -13.662 927 HD21 LEU 19 3HD2 LEU 19 -6.658 6.304 -11.702 928 HD22 LEU 19 1HD2 LEU 19 -8.343 6.838 -12.006 929 HD23 LEU 19 2HD2 LEU 19 -7.023 8.056 -11.820 930 H GLU 20 H GLU 20 -10.220 7.829 -16.605 931 HA GLU 20 HA GLU 20 -10.257 10.500 -17.513 932 HB2 GLU 20 2HB GLU 20 -11.656 7.980 -18.552 933 HB3 GLU 20 1HB GLU 20 -11.657 9.538 -19.436 934 HG2 GLU 20 2HG GLU 20 -9.044 8.054 -18.695 935 HG3 GLU 20 1HG GLU 20 -9.969 7.771 -20.209 936 H GLU 21 H GLU 21 -12.727 8.481 -15.839 937 HA GLU 21 HA GLU 21 -14.737 10.530 -16.367 938 HB2 GLU 21 2HB GLU 21 -14.917 8.150 -14.437 939 HB3 GLU 21 1HB GLU 21 -16.171 9.403 -14.740 940 HG2 GLU 21 2HG GLU 21 -15.965 8.696 -17.282 941 HG3 GLU 21 1HG GLU 21 -15.180 7.204 -16.638 942 H ALA 22 H ALA 22 -12.526 9.488 -13.798 943 HA ALA 22 HA ALA 22 -13.410 11.108 -11.748 944 HB1 ALA 22 1HB ALA 22 -11.671 9.301 -11.444 945 HB2 ALA 22 2HB ALA 22 -11.112 10.886 -10.790 946 HB3 ALA 22 3HB ALA 22 -10.496 10.296 -12.371 947 H SER 23 H SER 23 -11.103 11.821 -14.449 948 HA SER 23 HA SER 23 -10.170 14.206 -13.406 949 HB2 SER 23 2HB SER 23 -9.537 14.719 -15.828 950 HB3 SER 23 1HB SER 23 -8.987 13.114 -15.205 951 HG SER 23 1HG SER 23 -9.854 12.837 -17.215 952 H LYS 24 H LYS 24 -13.048 13.530 -15.379 953 HA LYS 24 HA LYS 24 -13.579 16.301 -15.812 954 HB2 LYS 24 2HB LYS 24 -14.396 14.412 -17.330 955 HB3 LYS 24 1HB LYS 24 -15.605 14.001 -16.069 956 HG2 LYS 24 2HG LYS 24 -16.507 16.388 -16.249 957 HG3 LYS 24 1HG LYS 24 -15.277 16.711 -17.518 958 HD2 LYS 24 2HD LYS 24 -16.322 14.754 -18.853 959 HD3 LYS 24 1HD LYS 24 -17.683 14.782 -17.681 960 HE2 LYS 24 2HE LYS 24 -16.721 17.136 -19.469 961 HE3 LYS 24 1HE LYS 24 -18.167 16.101 -19.788 962 HZ1 LYS 24 3HZ LYS 24 -18.102 17.515 -17.173 963 HZ2 LYS 24 1HZ LYS 24 -19.372 17.221 -18.255 964 HZ3 LYS 24 2HZ LYS 24 -18.268 18.434 -18.555 965 H LYS 25 H LYS 25 -15.049 13.772 -13.720 966 HA LYS 25 HA LYS 25 -16.944 15.467 -12.541 967 HB2 LYS 25 2HB LYS 25 -15.611 12.873 -11.554 968 HB3 LYS 25 1HB LYS 25 -17.039 13.623 -10.755 969 HG2 LYS 25 2HG LYS 25 -18.459 13.249 -12.674 970 HG3 LYS 25 1HG LYS 25 -17.076 12.806 -13.729 971 HD2 LYS 25 2HD LYS 25 -16.685 10.730 -12.541 972 HD3 LYS 25 1HD LYS 25 -17.913 11.145 -11.283 973 HE2 LYS 25 2HE LYS 25 -19.749 11.023 -12.917 974 HE3 LYS 25 1HE LYS 25 -18.597 10.791 -14.292 975 HZ1 LYS 25 3HZ LYS 25 -18.279 8.629 -13.781 976 HZ2 LYS 25 1HZ LYS 25 -19.845 8.807 -13.228 977 HZ3 LYS 25 2HZ LYS 25 -18.576 8.809 -12.102 978 H ALA 26 H ALA 26 -13.510 14.936 -11.856 979 HA ALA 26 HA ALA 26 -13.500 15.900 -9.241 980 HB1 ALA 26 1HB ALA 26 -11.223 15.874 -11.314 981 HB2 ALA 26 2HB ALA 26 -11.599 14.570 -10.123 982 HB3 ALA 26 3HB ALA 26 -11.043 16.163 -9.542 983 H VAL 27 H VAL 27 -12.982 17.641 -12.395 984 HA VAL 27 HA VAL 27 -12.410 20.059 -10.880 985 HB VAL 27 HB VAL 27 -11.154 19.558 -12.911 986 HG11 VAL 27 1HG1 VAL 27 -13.855 19.835 -14.395 987 HG12 VAL 27 2HG1 VAL 27 -12.870 18.336 -14.231 988 HG13 VAL 27 3HG1 VAL 27 -12.242 19.727 -15.172 989 HG21 VAL 27 3HG2 VAL 27 -12.896 22.079 -13.270 990 HG22 VAL 27 1HG2 VAL 27 -11.236 21.805 -13.872 991 HG23 VAL 27 2HG2 VAL 27 -11.543 21.915 -12.097 992 H GLU 28 H GLU 28 -15.183 18.357 -11.926 993 HA GLU 28 HA GLU 28 -16.798 20.823 -11.733 994 HB2 GLU 28 2HB GLU 28 -17.609 18.080 -12.831 995 HB3 GLU 28 1HB GLU 28 -18.617 19.571 -12.767 996 HG2 GLU 28 2HG GLU 28 -16.770 20.723 -14.175 997 HG3 GLU 28 1HG GLU 28 -16.035 19.100 -14.419 998 H ALA 29 H ALA 29 -15.307 19.183 -9.656 999 HA ALA 29 HA ALA 29 -17.545 18.104 -8.132 1000 HB1 ALA 29 1HB ALA 29 -14.588 18.213 -7.286 1001 HB2 ALA 29 2HB ALA 29 -15.265 16.869 -8.257 1002 HB3 ALA 29 3HB ALA 29 -15.923 17.167 -6.645 1003 H GLU 30 H GLU 30 -14.861 20.638 -8.033 1004 HA GLU 30 HA GLU 30 -15.927 21.518 -5.566 1005 HB2 GLU 30 2HB GLU 30 -14.045 22.721 -5.199 1006 HB3 GLU 30 1HB GLU 30 -13.490 21.327 -6.144 1007 HG2 GLU 30 2HG GLU 30 -13.640 24.262 -7.020 1008 HG3 GLU 30 1HG GLU 30 -12.213 23.202 -6.835 1009 H ARG 31 H ARG 31 -15.238 23.595 -8.414 1010 HA ARG 31 HA ARG 31 -16.131 25.281 -9.250 1011 HB2 ARG 31 2HB ARG 31 -18.869 24.007 -8.812 1012 HB3 ARG 31 1HB ARG 31 -18.468 25.291 -10.005 1013 HG2 ARG 31 2HG ARG 31 -17.550 22.364 -9.997 1014 HG3 ARG 31 1HG ARG 31 -18.611 23.189 -11.183 1015 HD2 ARG 31 2HD ARG 31 -15.565 23.441 -10.796 1016 HD3 ARG 31 1HD ARG 31 -16.453 22.914 -12.262 1017 HE ARG 31 HE ARG 31 -17.410 25.334 -12.304 1018 HH11 ARG 31 1HH2 ARG 31 -14.170 24.750 -10.634 1019 HH12 ARG 31 2HH2 ARG 31 -13.746 26.366 -10.775 1020 HH21 ARG 31 1HH1 ARG 31 -16.577 27.419 -12.724 1021 HH22 ARG 31 2HH1 ARG 31 -15.058 27.943 -12.115 1022 H GLY 32 H GLY 32 -17.470 24.801 -6.088 1023 HA2 GLY 32 2HA GLY 32 -17.200 27.619 -5.564 1024 HA3 GLY 32 1HA GLY 32 -18.899 26.964 -5.605 1025 H ALA 33 H ALA 33 -15.932 25.208 -4.691 1026 HA ALA 33 HA ALA 33 -17.207 24.265 -2.332 1027 HB1 ALA 33 1HB ALA 33 -15.663 22.767 -3.588 1028 HB2 ALA 33 2HB ALA 33 -14.977 23.058 -1.970 1029 HB3 ALA 33 3HB ALA 33 -14.314 23.944 -3.377 1030 HA PRO 34 HA PRO 34 -15.220 27.278 0.366 1031 HB2 PRO 34 2HB PRO 34 -14.922 25.849 2.755 1032 HB3 PRO 34 1HB PRO 34 -16.512 26.457 2.158 1033 HG2 PRO 34 2HG PRO 34 -15.323 23.651 1.851 1034 HG3 PRO 34 1HG PRO 34 -17.009 24.097 2.351 1035 HD2 PRO 34 2HD PRO 34 -16.315 23.360 -0.245 1036 HD3 PRO 34 1HD PRO 34 -17.617 24.594 0.064 1037 H GLY 35 H GLY 35 -13.075 27.912 0.118 1038 HA2 GLY 35 2HA GLY 35 -10.850 27.763 0.581 1039 HA3 GLY 35 1HA GLY 35 -10.995 25.989 0.903 1040 H ALA 36 H ALA 36 -12.092 24.923 -1.162 1041 HA ALA 36 HA ALA 36 -11.763 24.018 -3.098 1042 HB1 ALA 36 1HB ALA 36 -12.445 26.169 -4.194 1043 HB2 ALA 36 2HB ALA 36 -11.253 25.244 -5.174 1044 HB3 ALA 36 3HB ALA 36 -10.715 26.676 -4.217 1045 H ALA 37 H ALA 37 -9.796 23.540 -4.880 1046 HA ALA 37 HA ALA 37 -7.216 24.105 -3.996 1047 HB1 ALA 37 1HB ALA 37 -7.443 22.684 -2.029 1048 HB2 ALA 37 2HB ALA 37 -6.590 21.674 -3.235 1049 HB3 ALA 37 3HB ALA 37 -8.367 21.466 -2.951 1050 H LEU 38 H LEU 38 -9.234 21.415 -5.337 1051 HA LEU 38 HA LEU 38 -7.313 21.080 -7.490 1052 HB2 LEU 38 2HB LEU 38 -8.365 19.093 -6.364 1053 HB3 LEU 38 1HB LEU 38 -9.978 19.679 -6.882 1054 HG LEU 38 HG LEU 38 -9.500 19.244 -9.209 1055 HD11 LEU 38 1HD1 LEU 38 -7.351 18.233 -10.017 1056 HD12 LEU 38 2HD1 LEU 38 -6.598 18.535 -8.412 1057 HD13 LEU 38 3HD1 LEU 38 -7.121 19.918 -9.462 1058 HD21 LEU 38 3HD2 LEU 38 -10.191 17.313 -7.817 1059 HD22 LEU 38 1HD2 LEU 38 -8.472 16.933 -7.422 1060 HD23 LEU 38 2HD2 LEU 38 -9.059 16.768 -9.114 1061 H ILE 39 H ILE 39 -7.877 21.821 -9.734 1062 HA ILE 39 HA ILE 39 -10.325 23.007 -10.287 1063 HB ILE 39 HB ILE 39 -9.138 25.286 -10.880 1064 HG12 ILE 39 2HG1 ILE 39 -7.265 24.424 -8.577 1065 HG13 ILE 39 1HG1 ILE 39 -6.798 24.409 -10.312 1066 HG21 ILE 39 1HG2 ILE 39 -9.667 24.870 -7.889 1067 HG22 ILE 39 2HG2 ILE 39 -10.960 24.982 -9.137 1068 HG23 ILE 39 3HG2 ILE 39 -9.847 26.374 -8.861 1069 HD11 ILE 39 3HD ILE 39 -7.629 26.903 -8.691 1070 HD12 ILE 39 1HD ILE 39 -5.971 26.471 -9.239 1071 HD13 ILE 39 2HD ILE 39 -7.234 26.888 -10.451 1072 H SER 40 H SER 40 -9.755 24.093 -12.579 1073 HA SER 40 HA SER 40 -8.816 24.221 -14.489 1074 HB2 SER 40 2HB SER 40 -6.739 24.844 -13.281 1075 HB3 SER 40 1HB SER 40 -6.265 23.120 -13.216 1076 HG SER 40 1HG SER 40 -5.241 23.722 -14.897 1077 H TYR 41 H TYR 41 -9.990 22.883 -15.784 1078 HA TYR 41 HA TYR 41 -10.135 20.180 -15.699 1079 HB2 TYR 41 2HB TYR 41 -11.754 21.407 -16.995 1080 HB3 TYR 41 1HB TYR 41 -10.478 22.119 -18.034 1081 HD1 TYR 41 1HD TYR 41 -11.159 18.455 -17.102 1082 HD2 TYR 41 2HD TYR 41 -10.965 21.470 -20.168 1083 HE1 TYR 41 1HE TYR 41 -11.510 16.731 -18.817 1084 HE2 TYR 41 2HE TYR 41 -11.328 19.749 -21.885 1085 HH TYR 41 HH TYR 41 -11.480 16.264 -21.149 1086 HA PRO 42 HA PRO 42 -6.772 19.246 -18.722 1087 HB2 PRO 42 2HB PRO 42 -4.659 21.029 -19.304 1088 HB3 PRO 42 1HB PRO 42 -6.199 20.960 -20.245 1089 HG2 PRO 42 2HG PRO 42 -5.493 22.853 -17.933 1090 HG3 PRO 42 1HG PRO 42 -6.203 23.281 -19.545 1091 HD2 PRO 42 2HD PRO 42 -7.768 22.971 -17.312 1092 HD3 PRO 42 1HD PRO 42 -8.356 22.350 -18.923 1093 H ASP 43 H ASP 43 -6.211 20.881 -15.703 1094 HA ASP 43 HA ASP 43 -3.659 19.476 -15.301 1095 HB2 ASP 43 2HB ASP 43 -5.184 21.383 -13.422 1096 HB3 ASP 43 1HB ASP 43 -3.655 20.530 -13.018 1097 H ALA 44 H ALA 44 -7.099 19.470 -14.497 1098 HA ALA 44 HA ALA 44 -7.084 17.992 -12.211 1099 HB1 ALA 44 1HB ALA 44 -9.099 19.163 -13.084 1100 HB2 ALA 44 2HB ALA 44 -9.475 17.441 -12.717 1101 HB3 ALA 44 3HB ALA 44 -9.231 17.965 -14.425 1102 H ILE 45 H ILE 45 -6.822 16.883 -15.548 1103 HA ILE 45 HA ILE 45 -7.253 14.155 -14.919 1104 HB ILE 45 HB ILE 45 -7.609 14.999 -17.160 1105 HG12 ILE 45 2HG1 ILE 45 -5.328 12.929 -17.167 1106 HG13 ILE 45 1HG1 ILE 45 -7.032 12.576 -16.749 1107 HG21 ILE 45 1HG2 ILE 45 -4.561 15.501 -17.288 1108 HG22 ILE 45 2HG2 ILE 45 -5.847 16.756 -17.217 1109 HG23 ILE 45 3HG2 ILE 45 -5.731 15.682 -18.638 1110 HD11 ILE 45 3HD ILE 45 -6.023 13.613 -19.485 1111 HD12 ILE 45 1HD ILE 45 -6.622 11.961 -19.101 1112 HD13 ILE 45 2HD ILE 45 -7.755 13.352 -19.051 1113 H TRP 46 H TRP 46 -4.434 16.240 -14.547 1114 HA TRP 46 HA TRP 46 -2.659 13.948 -14.361 1115 HB2 TRP 46 2HB TRP 46 -2.344 16.887 -14.592 1116 HB3 TRP 46 1HB TRP 46 -1.308 16.222 -13.314 1117 HD1 TRP 46 HD TRP 46 0.915 16.712 -14.506 1118 HE1 TRP 46 1HE TRP 46 2.011 16.065 -16.739 1119 HE3 TRP 46 3HE TRP 46 -2.919 14.001 -16.560 1120 HZ2 TRP 46 2HZ TRP 46 1.499 14.240 -18.879 1121 HZ3 TRP 46 3HZ TRP 46 -2.556 12.833 -18.675 1122 HH2 TRP 46 HH TRP 46 -0.381 12.963 -19.844 1123 H TRP 47 H TRP 47 -4.745 15.797 -12.264 1124 HA TRP 47 HA TRP 47 -3.498 15.023 -9.812 1125 HB2 TRP 47 2HB TRP 47 -5.188 16.818 -9.734 1126 HB3 TRP 47 1HB TRP 47 -6.419 15.746 -10.479 1127 HD1 TRP 47 HD TRP 47 -4.443 15.934 -7.056 1128 HE1 TRP 47 1HE TRP 47 -5.694 14.545 -5.391 1129 HE3 TRP 47 3HE TRP 47 -8.169 14.247 -10.109 1130 HZ2 TRP 47 2HZ TRP 47 -8.243 13.159 -5.226 1131 HZ3 TRP 47 3HZ TRP 47 -9.953 12.833 -9.160 1132 HH2 TRP 47 HH TRP 47 -9.997 12.292 -6.751 1133 H SER 48 H SER 48 -6.126 13.651 -11.913 1134 HA SER 48 HA SER 48 -6.693 11.486 -10.396 1135 HB2 SER 48 2HB SER 48 -6.637 11.482 -13.471 1136 HB3 SER 48 1HB SER 48 -7.619 10.416 -12.398 1137 HG SER 48 1HG SER 48 -8.863 12.081 -13.134 1138 H VAL 49 H VAL 49 -3.878 11.893 -12.498 1139 HA VAL 49 HA VAL 49 -3.317 9.100 -12.710 1140 HB VAL 49 HB VAL 49 -1.711 11.627 -13.330 1141 HG11 VAL 49 1HG1 VAL 49 -0.053 9.812 -12.954 1142 HG12 VAL 49 2HG1 VAL 49 -0.204 10.120 -14.716 1143 HG13 VAL 49 3HG1 VAL 49 -1.005 8.680 -13.972 1144 HG21 VAL 49 3HG2 VAL 49 -2.315 11.071 -15.693 1145 HG22 VAL 49 1HG2 VAL 49 -3.817 11.172 -14.717 1146 HG23 VAL 49 2HG2 VAL 49 -3.152 9.567 -15.149 1147 H GLU 50 H GLU 50 -2.552 11.567 -10.208 1148 HA GLU 50 HA GLU 50 -0.310 9.885 -9.338 1149 HB2 GLU 50 2HB GLU 50 0.214 11.433 -7.637 1150 HB3 GLU 50 1HB GLU 50 0.068 12.341 -9.179 1151 HG2 GLU 50 2HG GLU 50 -1.882 13.523 -8.450 1152 HG3 GLU 50 1HG GLU 50 -2.296 12.281 -7.231 1153 H THR 51 H THR 51 -3.588 9.649 -9.069 1154 HA THR 51 HA THR 51 -3.394 8.624 -6.331 1155 HB THR 51 HB THR 51 -4.746 10.659 -6.293 1156 HG1 THR 51 1HG THR 51 -6.366 9.812 -5.266 1157 HG21 THR 51 3HG2 THR 51 -5.448 10.814 -8.623 1158 HG22 THR 51 1HG2 THR 51 -6.917 10.758 -7.606 1159 HG23 THR 51 2HG2 THR 51 -6.392 9.290 -8.526 1160 H ALA 52 H ALA 52 -5.578 7.042 -6.473 1161 HA ALA 52 HA ALA 52 -6.290 5.077 -7.172 1162 HB1 ALA 52 1HB ALA 52 -6.500 5.737 -9.547 1163 HB2 ALA 52 2HB ALA 52 -5.953 4.033 -9.333 1164 HB3 ALA 52 3HB ALA 52 -4.769 5.297 -9.816 1165 H THR 53 H THR 53 -2.775 5.615 -7.996 1166 HA THR 53 HA THR 53 -2.138 2.987 -7.079 1167 HB THR 53 HB THR 53 0.230 4.011 -7.762 1168 HG1 THR 53 1HG THR 53 -0.243 5.624 -9.419 1169 HG21 THR 53 3HG2 THR 53 -2.120 3.537 -9.738 1170 HG22 THR 53 1HG2 THR 53 -1.054 2.270 -9.014 1171 HG23 THR 53 2HG2 THR 53 -0.368 3.482 -10.156 1172 H THR 54 H THR 54 -3.279 4.670 -5.093 1173 HA THR 54 HA THR 54 -2.983 5.464 -3.012 1174 HB THR 54 HB THR 54 -2.159 3.603 -1.536 1175 HG1 THR 54 1HG THR 54 -0.561 2.942 -3.089 1176 HG21 THR 54 3HG2 THR 54 -4.521 3.685 -2.512 1177 HG22 THR 54 1HG2 THR 54 -3.915 2.007 -2.292 1178 HG23 THR 54 2HG2 THR 54 -3.949 2.737 -3.934 1179 H VAL 55 H VAL 55 -1.416 7.260 -3.893 1180 HA VAL 55 HA VAL 55 0.820 7.220 -2.036 1181 HB VAL 55 HB VAL 55 1.964 6.666 -4.003 1182 HG11 VAL 55 1HG1 VAL 55 -0.159 8.249 -5.426 1183 HG12 VAL 55 2HG1 VAL 55 0.673 6.739 -5.855 1184 HG13 VAL 55 3HG1 VAL 55 1.484 8.326 -6.128 1185 HG21 VAL 55 3HG2 VAL 55 3.429 8.553 -4.365 1186 HG22 VAL 55 1HG2 VAL 55 2.903 8.541 -2.647 1187 HG23 VAL 55 2HG2 VAL 55 2.197 9.736 -3.791 1188 H GLY 56 H GLY 56 -0.068 9.717 -4.438 1189 HA2 GLY 56 2HA GLY 56 -1.280 11.625 -4.108 1190 HA3 GLY 56 1HA GLY 56 -1.622 11.133 -2.395 1191 H TYR 57 H TYR 57 0.780 12.615 -4.635 1192 HA TYR 57 HA TYR 57 2.828 12.634 -2.580 1193 HB2 TYR 57 2HB TYR 57 2.629 14.064 -5.320 1194 HB3 TYR 57 1HB TYR 57 4.014 14.277 -4.191 1195 HD1 TYR 57 2HD TYR 57 2.151 11.645 -6.148 1196 HD2 TYR 57 1HD TYR 57 5.790 12.758 -4.140 1197 HE1 TYR 57 2HE TYR 57 3.256 9.675 -7.082 1198 HE2 TYR 57 1HE TYR 57 6.911 10.766 -5.073 1199 HH TYR 57 HH TYR 57 5.103 8.280 -6.835 1200 H GLY 58 H GLY 58 0.098 14.497 -3.500 1201 HA2 GLY 58 2HA GLY 58 -0.839 16.023 -2.075 1202 HA3 GLY 58 1HA GLY 58 0.786 16.465 -1.427 1203 H ASP 59 H ASP 59 -0.468 16.140 -4.839 1204 HA ASP 59 HA ASP 59 0.725 18.711 -5.398 1205 HB2 ASP 59 2HB ASP 59 0.403 16.613 -7.069 1206 HB3 ASP 59 1HB ASP 59 -1.172 17.371 -7.406 1207 H ARG 60 H ARG 60 -2.635 17.259 -5.458 1208 HA ARG 60 HA ARG 60 -3.648 19.746 -4.431 1209 HB2 ARG 60 2HB ARG 60 -4.762 18.534 -7.048 1210 HB3 ARG 60 1HB ARG 60 -5.542 19.842 -6.086 1211 HG2 ARG 60 2HG ARG 60 -3.466 21.251 -6.417 1212 HG3 ARG 60 1HG ARG 60 -2.814 19.991 -7.517 1213 HD2 ARG 60 2HD ARG 60 -4.684 20.371 -9.130 1214 HD3 ARG 60 1HD ARG 60 -5.425 21.597 -8.029 1215 HE ARG 60 HE ARG 60 -2.941 21.862 -9.635 1216 HH11 ARG 60 1HH2 ARG 60 -5.050 23.369 -7.067 1217 HH12 ARG 60 2HH2 ARG 60 -4.066 24.733 -6.896 1218 HH21 ARG 60 1HH1 ARG 60 -1.706 23.882 -9.493 1219 HH22 ARG 60 2HH1 ARG 60 -2.194 25.110 -8.441 1220 H TYR 61 H TYR 61 -6.042 19.247 -3.685 1221 HA TYR 61 HA TYR 61 -6.487 16.449 -3.371 1222 HB2 TYR 61 2HB TYR 61 -6.809 16.703 -0.863 1223 HB3 TYR 61 1HB TYR 61 -5.099 16.834 -1.368 1224 HD1 TYR 61 1HD TYR 61 -3.932 19.028 -1.344 1225 HD2 TYR 61 2HD TYR 61 -7.961 18.636 0.101 1226 HE1 TYR 61 1HE TYR 61 -3.745 21.212 -0.223 1227 HE2 TYR 61 2HE TYR 61 -7.786 20.810 1.213 1228 HH TYR 61 HH TYR 61 -4.810 22.816 0.986 1229 HA PRO 62 HA PRO 62 -10.353 18.792 -3.790 1230 HB2 PRO 62 2HB PRO 62 -12.229 16.738 -3.161 1231 HB3 PRO 62 1HB PRO 62 -11.361 16.872 -4.743 1232 HG2 PRO 62 2HG PRO 62 -10.750 15.115 -2.320 1233 HG3 PRO 62 1HG PRO 62 -10.699 14.675 -4.079 1234 HD2 PRO 62 2HD PRO 62 -8.440 15.350 -2.560 1235 HD3 PRO 62 1HD PRO 62 -8.560 15.693 -4.349 1236 H VAL 63 H VAL 63 -12.199 19.733 -2.266 1237 HA VAL 63 HA VAL 63 -11.264 19.470 0.468 1238 HB VAL 63 HB VAL 63 -13.343 21.442 -0.481 1239 HG11 VAL 63 1HG1 VAL 63 -11.355 21.264 1.909 1240 HG12 VAL 63 2HG1 VAL 63 -13.135 21.020 2.014 1241 HG13 VAL 63 3HG1 VAL 63 -12.476 22.631 1.576 1242 HG21 VAL 63 3HG2 VAL 63 -11.382 21.793 -1.902 1243 HG22 VAL 63 1HG2 VAL 63 -10.250 21.544 -0.513 1244 HG23 VAL 63 2HG2 VAL 63 -11.313 22.995 -0.565 1245 H THR 64 H THR 64 -14.749 19.963 -0.331 1246 HA THR 64 HA THR 64 -15.319 17.481 1.115 1247 HB THR 64 HB THR 64 -16.448 20.138 2.142 1248 HG1 THR 64 1HG THR 64 -14.963 20.060 3.710 1249 HG21 THR 64 3HG2 THR 64 -17.792 18.059 2.664 1250 HG22 THR 64 1HG2 THR 64 -17.010 18.674 4.149 1251 HG23 THR 64 2HG2 THR 64 -16.313 17.253 3.288 1252 H GLU 65 H GLU 65 -16.628 20.405 -0.592 1253 HA GLU 65 HA GLU 65 -19.324 19.413 -0.628 1254 HB2 GLU 65 2HB GLU 65 -18.825 21.913 -0.613 1255 HB3 GLU 65 1HB GLU 65 -18.062 21.731 -2.234 1256 HG2 GLU 65 2HG GLU 65 -20.255 20.933 -3.168 1257 HG3 GLU 65 1HG GLU 65 -20.998 21.056 -1.530 1258 H GLU 66 H GLU 66 -16.432 19.445 -2.540 1259 HA GLU 66 HA GLU 66 -17.268 18.602 -4.957 1260 HB2 GLU 66 2HB GLU 66 -14.870 17.287 -4.745 1261 HB3 GLU 66 1HB GLU 66 -15.041 19.030 -5.096 1262 HG2 GLU 66 2HG GLU 66 -14.739 18.028 -2.201 1263 HG3 GLU 66 1HG GLU 66 -13.384 18.305 -3.337 1264 H GLY 67 H GLY 67 -17.367 16.807 -2.027 1265 HA2 GLY 67 2HA GLY 67 -18.560 14.900 -1.694 1266 HA3 GLY 67 1HA GLY 67 -18.533 14.550 -3.490 1267 H ARG 68 H ARG 68 -16.689 14.405 -0.436 1268 HA ARG 68 HA ARG 68 -14.200 13.992 -1.607 1269 HB2 ARG 68 2HB ARG 68 -15.399 13.827 1.079 1270 HB3 ARG 68 1HB ARG 68 -14.176 12.536 0.873 1271 HG2 ARG 68 2HG ARG 68 -13.611 15.441 0.114 1272 HG3 ARG 68 1HG ARG 68 -13.389 14.833 1.792 1273 HD2 ARG 68 2HD ARG 68 -11.718 13.164 1.075 1274 HD3 ARG 68 1HD ARG 68 -11.980 13.574 -0.673 1275 HE ARG 68 HE ARG 68 -11.362 16.018 0.610 1276 HH11 ARG 68 1HH2 ARG 68 -9.628 12.790 0.405 1277 HH12 ARG 68 2HH2 ARG 68 -8.213 13.410 0.138 1278 HH21 ARG 68 1HH1 ARG 68 -9.147 16.775 0.082 1279 HH22 ARG 68 2HH1 ARG 68 -8.562 16.177 1.421 1280 H LYS 69 H LYS 69 -16.904 11.949 -1.635 1281 HA LYS 69 HA LYS 69 -15.640 9.470 -1.878 1282 HB2 LYS 69 2HB LYS 69 -18.283 10.425 -3.088 1283 HB3 LYS 69 1HB LYS 69 -17.661 8.736 -3.115 1284 HG2 LYS 69 2HG LYS 69 -17.459 8.796 -0.603 1285 HG3 LYS 69 1HG LYS 69 -18.344 10.359 -0.575 1286 HD2 LYS 69 2HD LYS 69 -20.372 9.292 -1.435 1287 HD3 LYS 69 1HD LYS 69 -19.444 7.823 -1.919 1288 HE2 LYS 69 2HE LYS 69 -18.980 7.259 0.472 1289 HE3 LYS 69 1HE LYS 69 -19.930 8.698 1.017 1290 HZ1 LYS 69 3HZ LYS 69 -21.084 6.559 -0.708 1291 HZ2 LYS 69 1HZ LYS 69 -21.892 7.767 0.242 1292 HZ3 LYS 69 2HZ LYS 69 -21.108 6.473 0.978 1293 H VAL 70 H VAL 70 -15.585 12.275 -4.027 1294 HA VAL 70 HA VAL 70 -14.993 10.804 -6.374 1295 HB VAL 70 HB VAL 70 -14.338 13.681 -5.569 1296 HG11 VAL 70 1HG1 VAL 70 -12.782 12.982 -7.391 1297 HG12 VAL 70 2HG1 VAL 70 -14.060 14.048 -8.062 1298 HG13 VAL 70 3HG1 VAL 70 -14.148 12.268 -8.325 1299 HG21 VAL 70 3HG2 VAL 70 -16.308 14.212 -7.030 1300 HG22 VAL 70 1HG2 VAL 70 -16.810 13.152 -5.680 1301 HG23 VAL 70 2HG2 VAL 70 -16.585 12.455 -7.324 1302 H ALA 71 H ALA 71 -13.089 11.801 -3.521 1303 HA ALA 71 HA ALA 71 -10.572 11.103 -4.796 1304 HB1 ALA 71 1HB ALA 71 -11.228 11.539 -1.797 1305 HB2 ALA 71 2HB ALA 71 -10.515 12.767 -2.900 1306 HB3 ALA 71 3HB ALA 71 -9.591 11.287 -2.491 1307 H GLU 72 H GLU 72 -12.716 9.843 -2.201 1308 HA GLU 72 HA GLU 72 -11.477 7.533 -1.545 1309 HB2 GLU 72 2HB GLU 72 -13.684 8.307 -0.451 1310 HB3 GLU 72 1HB GLU 72 -14.528 7.756 -1.931 1311 HG2 GLU 72 2HG GLU 72 -13.467 5.375 -1.389 1312 HG3 GLU 72 1HG GLU 72 -13.194 6.050 0.245 1313 H GLN 73 H GLN 73 -13.942 7.918 -4.200 1314 HA GLN 73 HA GLN 73 -13.866 5.182 -4.721 1315 HB2 GLN 73 2HB GLN 73 -15.787 6.757 -5.310 1316 HB3 GLN 73 1HB GLN 73 -14.832 7.263 -6.741 1317 HG2 GLN 73 2HG GLN 73 -14.792 4.821 -7.498 1318 HG3 GLN 73 1HG GLN 73 -15.757 4.379 -6.045 1319 HE21 GLN 73 1HE2 GLN 73 -16.298 4.408 -9.149 1320 HE22 GLN 73 2HE2 GLN 73 -17.855 5.144 -9.256 1321 H VAL 74 H VAL 74 -11.790 7.817 -5.952 1322 HA VAL 74 HA VAL 74 -10.901 6.201 -8.168 1323 HB VAL 74 HB VAL 74 -9.738 8.749 -6.955 1324 HG11 VAL 74 1HG1 VAL 74 -7.952 7.505 -8.182 1325 HG12 VAL 74 2HG1 VAL 74 -8.516 8.874 -9.195 1326 HG13 VAL 74 3HG1 VAL 74 -9.065 7.198 -9.564 1327 HG21 VAL 74 3HG2 VAL 74 -12.096 8.904 -7.978 1328 HG22 VAL 74 1HG2 VAL 74 -11.432 8.230 -9.501 1329 HG23 VAL 74 2HG2 VAL 74 -10.857 9.829 -8.882 1330 H MET 75 H MET 75 -9.741 7.043 -4.876 1331 HA MET 75 HA MET 75 -7.325 5.617 -5.071 1332 HB2 MET 75 2HB MET 75 -9.035 6.375 -2.629 1333 HB3 MET 75 1HB MET 75 -7.351 5.742 -2.537 1334 HG2 MET 75 2HG MET 75 -6.536 7.603 -3.922 1335 HG3 MET 75 1HG MET 75 -8.172 8.289 -4.081 1336 HE1 MET 75 3HE MET 75 -8.825 7.583 -0.587 1337 HE2 MET 75 1HE MET 75 -9.604 8.864 -1.584 1338 HE3 MET 75 2HE MET 75 -8.702 9.306 -0.103 1339 H LYS 76 H LYS 76 -10.565 4.697 -3.833 1340 HA LYS 76 HA LYS 76 -9.681 2.118 -3.070 1341 HB2 LYS 76 2HB LYS 76 -11.533 3.436 -2.012 1342 HB3 LYS 76 1HB LYS 76 -12.562 3.108 -3.439 1343 HG2 LYS 76 2HG LYS 76 -12.789 0.808 -2.863 1344 HG3 LYS 76 1HG LYS 76 -11.247 0.775 -1.944 1345 HD2 LYS 76 2HD LYS 76 -12.148 2.104 -0.121 1346 HD3 LYS 76 1HD LYS 76 -13.699 2.372 -0.964 1347 HE2 LYS 76 2HE LYS 76 -12.661 -0.431 -0.125 1348 HE3 LYS 76 1HE LYS 76 -13.723 0.606 0.912 1349 HZ1 LYS 76 3HZ LYS 76 -14.444 -0.303 -1.825 1350 HZ2 LYS 76 1HZ LYS 76 -15.408 0.552 -0.705 1351 HZ3 LYS 76 2HZ LYS 76 -14.897 -1.073 -0.383 1352 H ALA 77 H ALA 77 -10.800 3.467 -6.140 1353 HA ALA 77 HA ALA 77 -11.618 1.008 -7.280 1354 HB1 ALA 77 1HB ALA 77 -12.206 3.133 -8.441 1355 HB2 ALA 77 2HB ALA 77 -11.206 2.101 -9.518 1356 HB3 ALA 77 3HB ALA 77 -10.456 3.506 -8.669 1357 H GLY 78 H GLY 78 -8.475 2.565 -6.753 1358 HA2 GLY 78 2HA GLY 78 -6.960 0.978 -8.520 1359 HA3 GLY 78 1HA GLY 78 -6.400 1.868 -7.054 1360 H ILE 79 H ILE 79 -7.986 0.618 -5.131 1361 HA ILE 79 HA ILE 79 -6.477 -1.643 -4.543 1362 HB ILE 79 HB ILE 79 -9.189 -0.872 -3.363 1363 HG12 ILE 79 2HG1 ILE 79 -6.320 0.002 -2.611 1364 HG13 ILE 79 1HG1 ILE 79 -7.601 1.057 -3.278 1365 HG21 ILE 79 1HG2 ILE 79 -8.414 -3.219 -2.801 1366 HG22 ILE 79 2HG2 ILE 79 -8.381 -2.161 -1.360 1367 HG23 ILE 79 3HG2 ILE 79 -6.849 -2.553 -2.218 1368 HD11 ILE 79 3HD ILE 79 -7.601 -0.284 -0.497 1369 HD12 ILE 79 1HD ILE 79 -7.440 1.462 -0.881 1370 HD13 ILE 79 2HD ILE 79 -9.004 0.615 -1.190 1371 H GLU 80 H GLU 80 -9.686 -1.272 -6.147 1372 HA GLU 80 HA GLU 80 -10.362 -3.993 -6.019 1373 HB2 GLU 80 2HB GLU 80 -11.204 -1.987 -8.216 1374 HB3 GLU 80 1HB GLU 80 -11.887 -3.627 -7.963 1375 HG2 GLU 80 2HG GLU 80 -12.710 -2.862 -5.668 1376 HG3 GLU 80 1HG GLU 80 -12.204 -1.188 -6.110 1377 H VAL 81 H VAL 81 -8.860 -2.112 -8.703 1378 HA VAL 81 HA VAL 81 -8.926 -4.302 -10.445 1379 HB VAL 81 HB VAL 81 -7.452 -2.910 -11.921 1380 HG11 VAL 81 1HG1 VAL 81 -9.971 -2.775 -11.908 1381 HG12 VAL 81 2HG1 VAL 81 -9.204 -1.193 -12.296 1382 HG13 VAL 81 3HG1 VAL 81 -9.894 -1.475 -10.656 1383 HG21 VAL 81 3HG2 VAL 81 -7.569 -0.925 -9.539 1384 HG22 VAL 81 1HG2 VAL 81 -7.015 -0.544 -11.189 1385 HG23 VAL 81 2HG2 VAL 81 -6.085 -1.696 -10.207 1386 H PHE 82 H PHE 82 -6.261 -2.974 -8.406 1387 HA PHE 82 HA PHE 82 -4.388 -4.842 -9.461 1388 HB2 PHE 82 2HB PHE 82 -4.272 -3.175 -6.866 1389 HB3 PHE 82 1HB PHE 82 -2.885 -4.084 -7.581 1390 HD1 PHE 82 1HD PHE 82 -3.135 -3.424 -10.520 1391 HD2 PHE 82 2HD PHE 82 -3.600 -0.953 -7.015 1392 HE1 PHE 82 1HE PHE 82 -2.514 -1.436 -11.827 1393 HE2 PHE 82 2HE PHE 82 -2.965 1.016 -8.321 1394 HZ PHE 82 HZ PHE 82 -2.413 0.796 -10.738 1395 H ALA 83 H ALA 83 -6.650 -4.831 -6.651 1396 HA ALA 83 HA ALA 83 -5.450 -7.070 -5.448 1397 HB1 ALA 83 1HB ALA 83 -7.594 -7.415 -4.211 1398 HB2 ALA 83 2HB ALA 83 -8.387 -6.182 -5.268 1399 HB3 ALA 83 3HB ALA 83 -7.060 -5.706 -4.147 1400 H LEU 84 H LEU 84 -7.760 -6.740 -8.128 1401 HA LEU 84 HA LEU 84 -8.606 -9.424 -8.179 1402 HB2 LEU 84 2HB LEU 84 -9.679 -7.499 -9.378 1403 HB3 LEU 84 1HB LEU 84 -8.320 -7.450 -10.535 1404 HG LEU 84 HG LEU 84 -9.876 -10.055 -10.169 1405 HD11 LEU 84 1HD1 LEU 84 -11.656 -8.321 -10.305 1406 HD12 LEU 84 2HD1 LEU 84 -11.617 -9.329 -11.796 1407 HD13 LEU 84 3HD1 LEU 84 -10.926 -7.662 -11.815 1408 HD21 LEU 84 3HD2 LEU 84 -7.944 -10.089 -11.758 1409 HD22 LEU 84 1HD2 LEU 84 -8.644 -8.699 -12.668 1410 HD23 LEU 84 2HD2 LEU 84 -9.490 -10.291 -12.641 1411 H VAL 85 H VAL 85 -5.746 -7.757 -9.471 1412 HA VAL 85 HA VAL 85 -4.817 -9.803 -11.133 1413 HB VAL 85 HB VAL 85 -3.241 -7.589 -9.714 1414 HG11 VAL 85 1HG1 VAL 85 -1.611 -9.181 -10.520 1415 HG12 VAL 85 2HG1 VAL 85 -1.662 -7.853 -11.717 1416 HG13 VAL 85 3HG1 VAL 85 -2.475 -9.428 -12.072 1417 HG21 VAL 85 3HG2 VAL 85 -5.050 -6.628 -11.062 1418 HG22 VAL 85 1HG2 VAL 85 -4.692 -7.699 -12.448 1419 HG23 VAL 85 2HG2 VAL 85 -3.526 -6.415 -11.964 1420 H THR 86 H THR 86 -4.860 -9.564 -7.644 1421 HA THR 86 HA THR 86 -2.674 -11.027 -6.939 1422 HB THR 86 HB THR 86 -5.397 -11.309 -5.599 1423 HG1 THR 86 1HG THR 86 -5.192 -9.267 -5.573 1424 HG21 THR 86 3HG2 THR 86 -3.944 -11.458 -3.518 1425 HG22 THR 86 1HG2 THR 86 -2.469 -11.408 -4.546 1426 HG23 THR 86 2HG2 THR 86 -3.598 -12.810 -4.651 1427 H ALA 87 H ALA 87 -5.551 -12.192 -8.621 1428 HA ALA 87 HA ALA 87 -5.342 -14.917 -8.060 1429 HB1 ALA 87 1HB ALA 87 -6.124 -13.567 -10.733 1430 HB2 ALA 87 2HB ALA 87 -7.245 -13.849 -9.371 1431 HB3 ALA 87 3HB ALA 87 -6.538 -15.253 -10.238 1432 H ALA 88 H ALA 88 -3.551 -12.849 -10.339 1433 HA ALA 88 HA ALA 88 -2.336 -14.998 -11.788 1434 HB1 ALA 88 1HB ALA 88 -2.593 -12.687 -12.832 1435 HB2 ALA 88 2HB ALA 88 -0.859 -13.188 -12.751 1436 HB3 ALA 88 3HB ALA 88 -1.519 -12.018 -11.557 1437 H LEU 89 H LEU 89 -1.409 -12.742 -9.149 1438 HA LEU 89 HA LEU 89 1.192 -13.777 -8.869 1439 HB2 LEU 89 2HB LEU 89 -0.582 -12.330 -6.795 1440 HB3 LEU 89 1HB LEU 89 1.113 -12.820 -6.505 1441 HG LEU 89 HG LEU 89 1.183 -10.542 -6.950 1442 HD11 LEU 89 1HD1 LEU 89 2.979 -11.935 -8.031 1443 HD12 LEU 89 2HD1 LEU 89 2.716 -10.345 -8.834 1444 HD13 LEU 89 3HD1 LEU 89 2.090 -11.848 -9.599 1445 HD21 LEU 89 3HD2 LEU 89 -0.357 -10.873 -9.597 1446 HD22 LEU 89 1HD2 LEU 89 0.356 -9.361 -8.934 1447 HD23 LEU 89 2HD2 LEU 89 -0.994 -10.160 -8.064 1448 H ALA 90 H ALA 90 -1.924 -14.680 -7.394 1449 HA ALA 90 HA ALA 90 -0.816 -16.384 -5.486 1450 HB1 ALA 90 1HB ALA 90 -3.611 -16.500 -6.764 1451 HB2 ALA 90 2HB ALA 90 -3.154 -15.525 -5.322 1452 HB3 ALA 90 3HB ALA 90 -3.110 -17.322 -5.232 1453 H THR 91 H THR 91 -1.936 -17.065 -8.870 1454 HA THR 91 HA THR 91 -1.404 -19.860 -8.417 1455 HB THR 91 HB THR 91 -3.164 -19.177 -9.945 1456 HG1 THR 91 1HG THR 91 -1.017 -20.685 -10.892 1457 HG21 THR 91 3HG2 THR 91 -2.031 -17.188 -10.998 1458 HG22 THR 91 1HG2 THR 91 -2.662 -18.351 -12.208 1459 HG23 THR 91 2HG2 THR 91 -0.892 -18.279 -11.847 1460 H ASP 92 H ASP 92 0.721 -17.245 -8.644 1461 HA ASP 92 HA ASP 92 2.388 -18.358 -10.609 1462 HB2 ASP 92 2HB ASP 92 2.316 -15.822 -9.624 1463 HB3 ASP 92 1HB ASP 92 3.691 -16.458 -8.649 1464 H PHE 93 H PHE 93 2.179 -18.728 -7.073 1465 HA PHE 93 HA PHE 93 4.648 -20.157 -6.979 1466 HB2 PHE 93 2HB PHE 93 4.327 -20.676 -4.765 1467 HB3 PHE 93 1HB PHE 93 3.465 -19.117 -4.900 1468 HD1 PHE 93 1HD PHE 93 3.132 -22.779 -4.416 1469 HD2 PHE 93 2HD PHE 93 0.991 -19.077 -4.721 1470 HE1 PHE 93 1HE PHE 93 1.109 -23.875 -3.498 1471 HE2 PHE 93 2HE PHE 93 -1.029 -20.164 -3.803 1472 HZ PHE 93 HZ PHE 93 -0.966 -22.567 -3.167 1473 H VAL 94 H VAL 94 1.353 -20.984 -7.794 1474 HA VAL 94 HA VAL 94 1.510 -23.747 -7.321 1475 HB VAL 94 HB VAL 94 -0.371 -22.224 -9.200 1476 HG11 VAL 94 1HG1 VAL 94 -1.959 -24.124 -8.660 1477 HG12 VAL 94 2HG1 VAL 94 -0.640 -24.959 -7.763 1478 HG13 VAL 94 3HG1 VAL 94 -0.503 -24.701 -9.540 1479 HG21 VAL 94 3HG2 VAL 94 -1.866 -22.140 -7.165 1480 HG22 VAL 94 1HG2 VAL 94 -0.368 -21.213 -6.884 1481 HG23 VAL 94 2HG2 VAL 94 -0.554 -22.854 -6.172 1482 H ARG 95 H ARG 95 2.576 -21.688 -9.938 1483 HA ARG 95 HA ARG 95 2.749 -23.526 -12.031 1484 HB2 ARG 95 2HB ARG 95 4.585 -21.173 -11.264 1485 HB3 ARG 95 1HB ARG 95 4.792 -22.119 -12.771 1486 HG2 ARG 95 2HG ARG 95 2.670 -21.431 -13.660 1487 HG3 ARG 95 1HG ARG 95 2.183 -20.641 -12.122 1488 HD2 ARG 95 2HD ARG 95 3.037 -19.032 -13.990 1489 HD3 ARG 95 1HD ARG 95 3.754 -18.864 -12.345 1490 HE ARG 95 HE ARG 95 5.769 -19.283 -13.152 1491 HH11 ARG 95 1HH2 ARG 95 3.504 -20.690 -15.559 1492 HH12 ARG 95 2HH2 ARG 95 4.600 -20.737 -16.866 1493 HH21 ARG 95 1HH1 ARG 95 7.347 -19.355 -14.942 1494 HH22 ARG 95 2HH1 ARG 95 6.884 -19.948 -16.493 1495 H ARG 96 H ARG 96 4.628 -23.376 -9.006 1496 HA ARG 96 HA ARG 96 6.955 -24.475 -10.103 1497 HB2 ARG 96 2HB ARG 96 7.781 -24.952 -7.946 1498 HB3 ARG 96 1HB ARG 96 6.853 -23.424 -7.791 1499 HG2 ARG 96 2HG ARG 96 4.914 -24.760 -6.845 1500 HG3 ARG 96 1HG ARG 96 5.883 -26.256 -7.047 1501 HD2 ARG 96 2HD ARG 96 7.608 -25.375 -5.399 1502 HD3 ARG 96 1HD ARG 96 6.551 -23.939 -5.120 1503 HE ARG 96 HE ARG 96 4.916 -25.322 -4.112 1504 HH11 ARG 96 1HH2 ARG 96 7.695 -27.462 -5.116 1505 HH12 ARG 96 2HH2 ARG 96 6.888 -28.863 -4.620 1506 HH21 ARG 96 1HH1 ARG 96 3.699 -27.401 -3.979 1507 HH22 ARG 96 2HH1 ARG 96 4.374 -28.723 -4.753 1508 H GLU 97 H GLU 97 3.842 -25.963 -9.429 1509 HA GLU 97 HA GLU 97 4.898 -28.601 -9.122 1510 HB2 GLU 97 2HB GLU 97 2.090 -27.584 -9.683 1511 HB3 GLU 97 1HB GLU 97 2.482 -29.337 -9.688 1512 HG2 GLU 97 2HG GLU 97 3.051 -27.531 -7.247 1513 HG3 GLU 97 1HG GLU 97 1.508 -28.419 -7.511 1514 H GLU 98 H GLU 98 4.409 -26.486 -11.883 1515 HA GLU 98 HA GLU 98 4.075 -28.558 -13.784 1516 HB2 GLU 98 2HB GLU 98 5.278 -25.786 -14.260 1517 HB3 GLU 98 1HB GLU 98 4.553 -26.861 -15.487 1518 HG2 GLU 98 2HG GLU 98 3.002 -25.560 -13.132 1519 HG3 GLU 98 1HG GLU 98 3.156 -24.853 -14.769 1520 H GLU 99 H GLU 99 6.911 -26.651 -12.560 1521 HA GLU 99 HA GLU 99 8.691 -28.260 -14.105 1522 HB2 GLU 99 2HB GLU 99 8.934 -25.838 -12.369 1523 HB3 GLU 99 1HB GLU 99 10.405 -26.845 -12.573 1524 HG2 GLU 99 2HG GLU 99 10.253 -24.970 -14.221 1525 HG3 GLU 99 1HG GLU 99 10.441 -26.597 -14.955 1526 H ARG 100 H ARG 100 7.356 -28.627 -10.935 1527 HA ARG 100 HA ARG 100 9.305 -30.367 -9.888 1528 HB2 ARG 100 2HB ARG 100 7.360 -29.367 -8.593 1529 HB3 ARG 100 1HB ARG 100 6.243 -30.427 -9.513 1530 HG2 ARG 100 2HG ARG 100 7.439 -32.447 -8.531 1531 HG3 ARG 100 1HG ARG 100 8.449 -31.316 -7.551 1532 HD2 ARG 100 2HD ARG 100 6.362 -30.422 -6.436 1533 HD3 ARG 100 1HD ARG 100 5.351 -31.503 -7.487 1534 HE ARG 100 HE ARG 100 7.405 -32.964 -5.970 1535 HH11 ARG 100 1HH2 ARG 100 4.210 -31.292 -5.618 1536 HH12 ARG 100 2HH2 ARG 100 3.675 -32.307 -4.362 1537 HH21 ARG 100 1HH1 ARG 100 6.675 -34.337 -4.185 1538 HH22 ARG 100 2HH1 ARG 100 5.108 -34.138 -3.523 1539 H ARG 101 H ARG 101 6.421 -30.886 -11.975 1540 HA ARG 101 HA ARG 101 6.984 -33.731 -12.161 1541 HB2 ARG 101 2HB ARG 101 4.926 -32.008 -13.676 1542 HB3 ARG 101 1HB ARG 101 4.966 -33.797 -13.591 1543 HG2 ARG 101 2HG ARG 101 4.283 -31.838 -11.312 1544 HG3 ARG 101 1HG ARG 101 3.197 -32.917 -12.227 1545 HD2 ARG 101 2HD ARG 101 4.653 -34.891 -11.182 1546 HD3 ARG 101 1HD ARG 101 5.311 -33.626 -10.081 1547 HE ARG 101 HE ARG 101 3.185 -33.455 -9.021 1548 HH11 ARG 101 1HH2 ARG 101 2.845 -35.477 -12.036 1549 HH12 ARG 101 2HH2 ARG 101 1.170 -35.731 -11.767 1550 HH21 ARG 101 1HH1 ARG 101 1.048 -34.158 -8.560 1551 HH22 ARG 101 2HH1 ARG 101 0.230 -35.282 -9.646 1552 H GLY 102 H GLY 102 7.727 -30.789 -13.910 1553 HA2 GLY 102 2HA GLY 102 9.029 -30.461 -15.702 1554 HA3 GLY 102 1HA GLY 102 9.199 -32.253 -15.919 1555 H HIS 103 H HIS 103 6.314 -30.245 -15.566 1556 HA HIS 103 HA HIS 103 4.955 -31.598 -17.690 1557 HB2 HIS 103 2HB HIS 103 3.870 -30.593 -15.539 1558 HB3 HIS 103 1HB HIS 103 4.106 -28.980 -16.274 1559 HD1 HIS 103 1HD HIS 103 2.475 -32.329 -17.040 1560 HD2 HIS 103 2HD HIS 103 1.897 -28.247 -17.874 1561 HE1 HIS 103 1HE HIS 103 0.287 -32.131 -18.304 1562 HE2 HIS 103 2HE HIS 103 -0.057 -29.624 -18.774 1563 H1 SER 1 H SER 1 16.650 -26.304 -1.181 1564 HA SER 1 HA SER 1 14.758 -25.476 0.326 1565 HB2 SER 1 2HB SER 1 17.221 -23.695 -0.218 1566 HB3 SER 1 1HB SER 1 16.305 -23.806 1.327 1567 HG SER 1 1HG SER 1 18.368 -24.978 0.977 1568 H ALA 2 H ALA 2 13.034 -25.007 -1.238 1569 HA ALA 2 HA ALA 2 11.560 -23.692 -2.113 1570 HB1 ALA 2 1HB ALA 2 11.513 -22.704 0.136 1571 HB2 ALA 2 2HB ALA 2 11.234 -21.418 -1.098 1572 HB3 ALA 2 3HB ALA 2 12.834 -21.571 -0.317 1573 H ASP 3 H ASP 3 12.315 -23.823 -4.217 1574 HA ASP 3 HA ASP 3 13.558 -22.419 -6.000 1575 HB2 ASP 3 2HB ASP 3 11.147 -22.386 -7.245 1576 HB3 ASP 3 1HB ASP 3 11.990 -23.912 -6.853 1577 H HIS 4 H HIS 4 10.440 -21.235 -4.984 1578 HA HIS 4 HA HIS 4 10.434 -18.819 -6.164 1579 HB2 HIS 4 2HB HIS 4 8.598 -18.175 -4.536 1580 HB3 HIS 4 1HB HIS 4 8.390 -19.783 -5.288 1581 HD1 HIS 4 1HD HIS 4 8.897 -21.894 -3.794 1582 HD2 HIS 4 2HD HIS 4 9.119 -18.246 -1.706 1583 HE1 HIS 4 1HE HIS 4 8.674 -22.414 -1.268 1584 HE2 HIS 4 2HE HIS 4 8.865 -20.218 -0.077 1585 H GLU 5 H GLU 5 12.237 -19.436 -3.141 1586 HA GLU 5 HA GLU 5 12.002 -16.671 -2.320 1587 HB2 GLU 5 2HB GLU 5 13.804 -18.923 -1.277 1588 HB3 GLU 5 1HB GLU 5 13.762 -17.246 -0.622 1589 HG2 GLU 5 2HG GLU 5 11.294 -17.506 -0.147 1590 HG3 GLU 5 1HG GLU 5 11.407 -19.235 -0.656 1591 H ARG 6 H ARG 6 14.105 -18.579 -4.414 1592 HA ARG 6 HA ARG 6 16.262 -16.691 -4.388 1593 HB2 ARG 6 2HB ARG 6 15.484 -18.805 -6.499 1594 HB3 ARG 6 1HB ARG 6 17.004 -17.848 -6.497 1595 HG2 ARG 6 2HG ARG 6 17.594 -18.841 -4.254 1596 HG3 ARG 6 1HG ARG 6 16.148 -19.910 -4.368 1597 HD2 ARG 6 2HD ARG 6 17.050 -21.006 -6.407 1598 HD3 ARG 6 1HD ARG 6 18.441 -19.860 -6.473 1599 HE ARG 6 HE ARG 6 18.188 -22.253 -4.805 1600 HH11 ARG 6 1HH2 ARG 6 20.044 -19.165 -5.296 1601 HH12 ARG 6 2HH2 ARG 6 21.231 -19.615 -4.137 1602 HH21 ARG 6 1HH1 ARG 6 19.873 -22.704 -3.124 1603 HH22 ARG 6 2HH1 ARG 6 21.113 -21.554 -2.906 1604 H GLU 7 H GLU 7 13.286 -17.200 -6.233 1605 HA GLU 7 HA GLU 7 13.939 -15.393 -8.288 1606 HB2 GLU 7 2HB GLU 7 12.318 -17.453 -8.109 1607 HB3 GLU 7 1HB GLU 7 11.073 -16.259 -7.634 1608 HG2 GLU 7 2HG GLU 7 11.208 -15.165 -9.823 1609 HG3 GLU 7 1HG GLU 7 12.815 -15.912 -10.166 1610 H ALA 8 H ALA 8 12.074 -15.194 -5.263 1611 HA ALA 8 HA ALA 8 11.124 -12.600 -5.482 1612 HB1 ALA 8 1HB ALA 8 10.418 -14.134 -3.637 1613 HB2 ALA 8 2HB ALA 8 11.107 -12.618 -2.946 1614 HB3 ALA 8 3HB ALA 8 12.093 -14.124 -2.970 1615 H GLN 9 H GLN 9 14.313 -13.791 -4.345 1616 HA GLN 9 HA GLN 9 15.065 -11.194 -3.446 1617 HB2 GLN 9 2HB GLN 9 15.947 -13.670 -2.765 1618 HB3 GLN 9 1HB GLN 9 17.142 -13.320 -4.042 1619 HG2 GLN 9 2HG GLN 9 18.160 -12.659 -1.974 1620 HG3 GLN 9 1HG GLN 9 17.690 -11.124 -2.775 1621 HE21 GLN 9 1HE2 GLN 9 14.717 -12.298 -1.656 1622 HE22 GLN 9 2HE2 GLN 9 14.691 -11.486 -0.132 1623 H LYS 10 H LYS 10 15.276 -12.894 -6.519 1624 HA LYS 10 HA LYS 10 17.196 -11.112 -7.622 1625 HB2 LYS 10 2HB LYS 10 16.670 -13.473 -8.515 1626 HB3 LYS 10 1HB LYS 10 15.107 -12.831 -9.109 1627 HG2 LYS 10 2HG LYS 10 16.717 -12.951 -10.959 1628 HG3 LYS 10 1HG LYS 10 16.349 -11.230 -10.605 1629 HD2 LYS 10 2HD LYS 10 18.489 -11.117 -9.220 1630 HD3 LYS 10 1HD LYS 10 18.869 -12.795 -9.751 1631 HE2 LYS 10 2HE LYS 10 18.999 -11.971 -12.142 1632 HE3 LYS 10 1HE LYS 10 18.513 -10.312 -11.588 1633 HZ1 LYS 10 3HZ LYS 10 20.914 -10.478 -11.795 1634 HZ2 LYS 10 1HZ LYS 10 20.953 -11.810 -10.767 1635 HZ3 LYS 10 2HZ LYS 10 20.463 -10.288 -10.150 1636 H ALA 11 H ALA 11 13.670 -11.191 -7.296 1637 HA ALA 11 HA ALA 11 13.016 -9.246 -9.146 1638 HB1 ALA 11 1HB ALA 11 11.324 -10.710 -7.959 1639 HB2 ALA 11 2HB ALA 11 10.885 -8.966 -7.922 1640 HB3 ALA 11 3HB ALA 11 11.586 -9.746 -6.461 1641 H GLU 12 H GLU 12 14.107 -8.907 -5.752 1642 HA GLU 12 HA GLU 12 13.635 -6.193 -5.462 1643 HB2 GLU 12 2HB GLU 12 16.032 -7.726 -4.270 1644 HB3 GLU 12 1HB GLU 12 15.356 -6.161 -3.705 1645 HG2 GLU 12 2HG GLU 12 13.143 -7.427 -3.236 1646 HG3 GLU 12 1HG GLU 12 14.045 -8.952 -3.547 1647 H GLU 13 H GLU 13 16.319 -7.869 -7.142 1648 HA GLU 13 HA GLU 13 17.969 -5.554 -7.265 1649 HB2 GLU 13 2HB GLU 13 18.076 -8.028 -9.089 1650 HB3 GLU 13 1HB GLU 13 19.321 -6.743 -8.926 1651 HG2 GLU 13 2HG GLU 13 19.505 -7.434 -6.420 1652 HG3 GLU 13 1HG GLU 13 18.539 -8.894 -6.859 1653 H GLU 14 H GLU 14 15.215 -6.709 -9.144 1654 HA GLU 14 HA GLU 14 15.963 -5.301 -11.517 1655 HB2 GLU 14 2HB GLU 14 14.431 -7.290 -11.576 1656 HB3 GLU 14 1HB GLU 14 13.199 -6.324 -10.697 1657 HG2 GLU 14 2HG GLU 14 12.563 -6.356 -12.996 1658 HG3 GLU 14 1HG GLU 14 13.175 -4.695 -12.700 1659 H LEU 15 H LEU 15 14.055 -4.616 -8.582 1660 HA LEU 15 HA LEU 15 12.924 -2.240 -9.484 1661 HB2 LEU 15 2HB LEU 15 12.215 -3.421 -7.402 1662 HB3 LEU 15 1HB LEU 15 13.754 -2.964 -6.604 1663 HG LEU 15 HG LEU 15 13.119 -0.580 -6.660 1664 HD11 LEU 15 1HD1 LEU 15 11.961 -0.354 -8.805 1665 HD12 LEU 15 2HD1 LEU 15 10.803 0.109 -7.527 1666 HD13 LEU 15 3HD1 LEU 15 10.676 -1.510 -8.296 1667 HD21 LEU 15 3HD2 LEU 15 12.279 -1.982 -4.770 1668 HD22 LEU 15 1HD2 LEU 15 10.771 -2.343 -5.687 1669 HD23 LEU 15 2HD2 LEU 15 11.122 -0.660 -5.157 1670 H GLN 16 H GLN 16 16.042 -2.877 -7.900 1671 HA GLN 16 HA GLN 16 16.922 -0.265 -7.534 1672 HB2 GLN 16 2HB GLN 16 18.611 -2.696 -8.382 1673 HB3 GLN 16 1HB GLN 16 19.245 -1.187 -7.633 1674 HG2 GLN 16 2HG GLN 16 18.078 -1.722 -5.495 1675 HG3 GLN 16 1HG GLN 16 17.351 -3.204 -6.236 1676 HE21 GLN 16 1HE2 GLN 16 18.769 -4.111 -4.223 1677 HE22 GLN 16 2HE2 GLN 16 20.404 -4.546 -4.634 1678 H LYS 17 H LYS 17 16.983 -2.339 -10.421 1679 HA LYS 17 HA LYS 17 18.748 -0.719 -11.936 1680 HB2 LYS 17 2HB LYS 17 18.768 -2.878 -12.718 1681 HB3 LYS 17 1HB LYS 17 17.042 -3.171 -12.385 1682 HG2 LYS 17 2HG LYS 17 17.832 -1.341 -14.698 1683 HG3 LYS 17 1HG LYS 17 17.956 -3.126 -14.862 1684 HD2 LYS 17 2HD LYS 17 15.686 -3.494 -14.889 1685 HD3 LYS 17 1HD LYS 17 15.360 -2.242 -13.675 1686 HE2 LYS 17 2HE LYS 17 14.281 -1.513 -15.729 1687 HE3 LYS 17 1HE LYS 17 15.688 -0.421 -15.412 1688 HZ1 LYS 17 3HZ LYS 17 16.909 -2.054 -16.951 1689 HZ2 LYS 17 1HZ LYS 17 15.886 -0.875 -17.586 1690 HZ3 LYS 17 2HZ LYS 17 15.347 -2.539 -17.432 1691 H VAL 18 H VAL 18 15.197 -0.791 -11.484 1692 HA VAL 18 HA VAL 18 14.659 0.968 -13.641 1693 HB VAL 18 HB VAL 18 13.015 0.435 -11.107 1694 HG11 VAL 18 1HG1 VAL 18 12.264 1.760 -13.813 1695 HG12 VAL 18 2HG1 VAL 18 12.277 2.559 -12.196 1696 HG13 VAL 18 3HG1 VAL 18 11.086 1.268 -12.544 1697 HG21 VAL 18 3HG2 VAL 18 11.737 -1.133 -12.598 1698 HG22 VAL 18 1HG2 VAL 18 13.443 -1.651 -12.459 1699 HG23 VAL 18 2HG2 VAL 18 12.878 -0.805 -13.946 1700 H LEU 19 H LEU 19 15.454 1.413 -10.182 1701 HA LEU 19 HA LEU 19 14.834 4.085 -9.947 1702 HB2 LEU 19 2HB LEU 19 17.306 2.761 -8.663 1703 HB3 LEU 19 1HB LEU 19 16.514 4.282 -8.135 1704 HG LEU 19 HG LEU 19 15.373 1.441 -7.961 1705 HD11 LEU 19 1HD1 LEU 19 15.525 1.795 -5.509 1706 HD12 LEU 19 2HD1 LEU 19 16.213 3.441 -5.768 1707 HD13 LEU 19 3HD1 LEU 19 17.142 1.982 -6.285 1708 HD21 LEU 19 3HD2 LEU 19 13.464 2.918 -8.424 1709 HD22 LEU 19 1HD2 LEU 19 14.039 4.117 -7.208 1710 HD23 LEU 19 2HD2 LEU 19 13.476 2.490 -6.679 1711 H GLU 20 H GLU 20 17.737 2.565 -11.310 1712 HA GLU 20 HA GLU 20 19.360 4.851 -11.487 1713 HB2 GLU 20 2HB GLU 20 19.249 2.281 -13.170 1714 HB3 GLU 20 1HB GLU 20 20.517 3.521 -13.387 1715 HG2 GLU 20 2HG GLU 20 20.027 2.169 -10.649 1716 HG3 GLU 20 1HG GLU 20 21.058 1.433 -11.926 1717 H GLU 21 H GLU 21 17.160 3.263 -13.889 1718 HA GLU 21 HA GLU 21 17.585 5.179 -15.895 1719 HB2 GLU 21 2HB GLU 21 15.090 3.414 -15.470 1720 HB3 GLU 21 1HB GLU 21 15.537 4.287 -16.973 1721 HG2 GLU 21 2HG GLU 21 17.665 2.881 -17.097 1722 HG3 GLU 21 1HG GLU 21 17.069 1.927 -15.685 1723 H ALA 22 H ALA 22 15.183 4.874 -13.297 1724 HA ALA 22 HA ALA 22 13.528 6.986 -13.966 1725 HB1 ALA 22 1HB ALA 22 14.267 5.851 -11.207 1726 HB2 ALA 22 2HB ALA 22 12.939 5.275 -12.253 1727 HB3 ALA 22 3HB ALA 22 12.859 6.923 -11.518 1728 H SER 23 H SER 23 16.653 6.998 -12.227 1729 HA SER 23 HA SER 23 16.334 9.625 -11.253 1730 HB2 SER 23 2HB SER 23 18.665 9.604 -10.635 1731 HB3 SER 23 1HB SER 23 17.941 8.002 -10.247 1732 HG SER 23 1HG SER 23 18.916 7.267 -12.287 1733 H LYS 24 H LYS 24 17.519 8.299 -14.320 1734 HA LYS 24 HA LYS 24 18.621 10.739 -15.254 1735 HB2 LYS 24 2HB LYS 24 19.240 8.443 -16.116 1736 HB3 LYS 24 1HB LYS 24 17.665 8.356 -16.964 1737 HG2 LYS 24 2HG LYS 24 19.606 10.708 -17.390 1738 HG3 LYS 24 1HG LYS 24 19.923 9.139 -18.192 1739 HD2 LYS 24 2HD LYS 24 17.943 9.245 -19.527 1740 HD3 LYS 24 1HD LYS 24 17.234 10.587 -18.562 1741 HE2 LYS 24 2HE LYS 24 19.003 12.158 -19.305 1742 HE3 LYS 24 1HE LYS 24 19.773 10.859 -20.305 1743 HZ1 LYS 24 3HZ LYS 24 18.404 12.278 -21.644 1744 HZ2 LYS 24 1HZ LYS 24 17.060 12.093 -20.670 1745 HZ3 LYS 24 2HZ LYS 24 17.652 10.771 -21.574 1746 H LYS 25 H LYS 25 15.460 9.111 -15.422 1747 HA LYS 25 HA LYS 25 14.228 10.976 -17.154 1748 HB2 LYS 25 2HB LYS 25 12.933 9.362 -14.867 1749 HB3 LYS 25 1HB LYS 25 12.040 10.219 -16.160 1750 HG2 LYS 25 2HG LYS 25 14.002 7.900 -16.706 1751 HG3 LYS 25 1HG LYS 25 12.261 7.687 -16.343 1752 HD2 LYS 25 2HD LYS 25 11.660 9.099 -18.323 1753 HD3 LYS 25 1HD LYS 25 13.408 9.226 -18.756 1754 HE2 LYS 25 2HE LYS 25 13.551 6.729 -18.983 1755 HE3 LYS 25 1HE LYS 25 11.836 6.566 -18.442 1756 HZ1 LYS 25 3HZ LYS 25 11.115 7.701 -20.433 1757 HZ2 LYS 25 1HZ LYS 25 12.045 6.329 -20.727 1758 HZ3 LYS 25 2HZ LYS 25 12.743 7.886 -20.970 1759 H ALA 26 H ALA 26 14.346 10.730 -13.551 1760 HA ALA 26 HA ALA 26 12.717 12.952 -13.137 1761 HB1 ALA 26 1HB ALA 26 13.375 12.717 -10.755 1762 HB2 ALA 26 2HB ALA 26 14.778 11.683 -11.224 1763 HB3 ALA 26 3HB ALA 26 13.092 11.092 -11.470 1764 H VAL 27 H VAL 27 16.187 12.929 -13.840 1765 HA VAL 27 HA VAL 27 16.468 15.584 -12.674 1766 HB VAL 27 HB VAL 27 18.445 14.241 -12.612 1767 HG11 VAL 27 1HG1 VAL 27 19.663 13.494 -14.651 1768 HG12 VAL 27 2HG1 VAL 27 18.335 14.092 -15.706 1769 HG13 VAL 27 3HG1 VAL 27 18.043 12.739 -14.565 1770 HG21 VAL 27 3HG2 VAL 27 20.020 15.883 -13.542 1771 HG22 VAL 27 1HG2 VAL 27 18.534 16.767 -13.027 1772 HG23 VAL 27 2HG2 VAL 27 18.831 16.435 -14.763 1773 H GLU 28 H GLU 28 15.732 14.067 -15.783 1774 HA GLU 28 HA GLU 28 16.132 16.495 -17.270 1775 HB2 GLU 28 2HB GLU 28 16.609 14.233 -18.198 1776 HB3 GLU 28 1HB GLU 28 14.891 13.768 -18.026 1777 HG2 GLU 28 2HG GLU 28 14.193 15.224 -19.816 1778 HG3 GLU 28 1HG GLU 28 15.724 16.175 -19.752 1779 H ALA 29 H ALA 29 13.478 14.547 -15.948 1780 HA ALA 29 HA ALA 29 11.447 16.478 -16.704 1781 HB1 ALA 29 1HB ALA 29 11.383 13.770 -15.210 1782 HB2 ALA 29 2HB ALA 29 10.908 14.036 -16.926 1783 HB3 ALA 29 3HB ALA 29 9.931 14.735 -15.593 1784 H GLU 30 H GLU 30 11.871 18.219 -15.471 1785 HA GLU 30 HA GLU 30 11.127 19.180 -13.470 1786 HB2 GLU 30 2HB GLU 30 13.008 17.260 -12.119 1787 HB3 GLU 30 1HB GLU 30 12.767 18.871 -11.384 1788 HG2 GLU 30 2HG GLU 30 10.318 17.195 -12.176 1789 HG3 GLU 30 1HG GLU 30 11.163 16.901 -10.622 1790 H ARG 31 H ARG 31 13.544 19.067 -15.610 1791 HA ARG 31 HA ARG 31 15.279 21.001 -14.358 1792 HB2 ARG 31 2HB ARG 31 15.821 18.948 -15.984 1793 HB3 ARG 31 1HB ARG 31 15.415 20.090 -17.280 1794 HG2 ARG 31 2HG ARG 31 17.777 20.135 -17.059 1795 HG3 ARG 31 1HG ARG 31 17.212 21.657 -16.285 1796 HD2 ARG 31 2HD ARG 31 17.428 20.446 -14.003 1797 HD3 ARG 31 1HD ARG 31 18.194 19.055 -14.884 1798 HE ARG 31 HE ARG 31 19.591 21.319 -15.781 1799 HH11 ARG 31 1HH2 ARG 31 19.181 19.661 -12.564 1800 HH12 ARG 31 2HH2 ARG 31 20.232 20.691 -11.746 1801 HH21 ARG 31 1HH1 ARG 31 21.364 22.520 -14.599 1802 HH22 ARG 31 2HH1 ARG 31 21.427 22.412 -12.899 1803 H GLY 32 H GLY 32 12.611 22.112 -14.751 1804 HA2 GLY 32 2HA GLY 32 12.916 24.602 -15.403 1805 HA3 GLY 32 1HA GLY 32 12.934 23.894 -17.070 1806 H ALA 33 H ALA 33 11.012 23.070 -14.099 1807 HA ALA 33 HA ALA 33 8.680 22.985 -15.850 1808 HB1 ALA 33 1HB ALA 33 9.478 20.980 -14.296 1809 HB2 ALA 33 2HB ALA 33 7.731 21.399 -14.361 1810 HB3 ALA 33 3HB ALA 33 8.734 21.895 -12.964 1811 HA PRO 34 HA PRO 34 7.173 26.362 -13.298 1812 HB2 PRO 34 2HB PRO 34 4.395 26.010 -13.372 1813 HB3 PRO 34 1HB PRO 34 5.380 26.637 -14.735 1814 HG2 PRO 34 2HG PRO 34 4.445 23.747 -14.300 1815 HG3 PRO 34 1HG PRO 34 4.334 24.747 -15.810 1816 HD2 PRO 34 2HD PRO 34 6.376 22.932 -15.401 1817 HD3 PRO 34 1HD PRO 34 6.705 24.530 -16.214 1818 H GLY 35 H GLY 35 8.002 25.874 -11.209 1819 HA2 GLY 35 2HA GLY 35 7.273 25.882 -9.002 1820 HA3 GLY 35 1HA GLY 35 5.987 24.682 -9.402 1821 H ALA 36 H ALA 36 8.894 24.018 -11.017 1822 HA ALA 36 HA ALA 36 9.279 21.548 -10.023 1823 HB1 ALA 36 1HB ALA 36 11.578 21.607 -10.983 1824 HB2 ALA 36 2HB ALA 36 11.528 23.416 -11.050 1825 HB3 ALA 36 3HB ALA 36 10.454 22.426 -12.093 1826 H ALA 37 H ALA 37 10.668 20.545 -8.615 1827 HA ALA 37 HA ALA 37 11.881 22.252 -6.494 1828 HB1 ALA 37 1HB ALA 37 11.171 20.507 -4.830 1829 HB2 ALA 37 2HB ALA 37 10.332 19.602 -6.154 1830 HB3 ALA 37 3HB ALA 37 9.737 21.219 -5.651 1831 H LEU 38 H LEU 38 11.950 19.333 -8.571 1832 HA LEU 38 HA LEU 38 14.313 18.308 -7.205 1833 HB2 LEU 38 2HB LEU 38 12.181 17.021 -8.226 1834 HB3 LEU 38 1HB LEU 38 13.104 17.114 -9.735 1835 HG LEU 38 HG LEU 38 14.068 15.792 -7.152 1836 HD11 LEU 38 1HD1 LEU 38 13.608 13.637 -8.363 1837 HD12 LEU 38 2HD1 LEU 38 12.905 14.590 -9.723 1838 HD13 LEU 38 3HD1 LEU 38 12.117 14.615 -8.107 1839 HD21 LEU 38 3HD2 LEU 38 16.036 16.485 -8.527 1840 HD22 LEU 38 1HD2 LEU 38 15.294 15.712 -9.972 1841 HD23 LEU 38 2HD2 LEU 38 15.819 14.691 -8.592 1842 H ILE 39 H ILE 39 14.944 20.753 -8.133 1843 HA ILE 39 HA ILE 39 15.899 20.622 -10.854 1844 HB ILE 39 HB ILE 39 16.740 22.950 -10.310 1845 HG12 ILE 39 2HG1 ILE 39 15.088 22.549 -7.713 1846 HG13 ILE 39 1HG1 ILE 39 16.882 22.611 -7.783 1847 HG21 ILE 39 1HG2 ILE 39 14.576 22.399 -11.479 1848 HG22 ILE 39 2HG2 ILE 39 14.372 23.854 -10.438 1849 HG23 ILE 39 3HG2 ILE 39 13.740 22.266 -9.897 1850 HD11 ILE 39 3HD ILE 39 14.947 24.894 -8.572 1851 HD12 ILE 39 1HD ILE 39 15.990 24.806 -7.112 1852 HD13 ILE 39 2HD ILE 39 16.742 24.949 -8.739 1853 H SER 40 H SER 40 17.110 18.579 -9.797 1854 HA SER 40 HA SER 40 19.766 19.451 -8.803 1855 HB2 SER 40 2HB SER 40 18.330 16.810 -8.114 1856 HB3 SER 40 1HB SER 40 19.804 17.508 -7.338 1857 HG SER 40 1HG SER 40 18.177 17.781 -6.045 1858 H TYR 41 H TYR 41 20.555 16.598 -8.751 1859 HA TYR 41 HA TYR 41 20.291 15.348 -11.155 1860 HB2 TYR 41 2HB TYR 41 21.691 17.250 -12.067 1861 HB3 TYR 41 1HB TYR 41 23.001 16.846 -10.933 1862 HD1 TYR 41 1HD TYR 41 21.209 13.962 -12.612 1863 HD2 TYR 41 2HD TYR 41 24.413 16.843 -12.858 1864 HE1 TYR 41 1HE TYR 41 22.121 12.788 -14.549 1865 HE2 TYR 41 2HE TYR 41 25.331 15.647 -14.795 1866 HH TYR 41 HH TYR 41 23.652 12.848 -16.284 1867 HA PRO 42 HA PRO 42 23.433 13.106 -8.577 1868 HB2 PRO 42 2HB PRO 42 24.429 14.062 -6.094 1869 HB3 PRO 42 1HB PRO 42 25.231 14.327 -7.684 1870 HG2 PRO 42 2HG PRO 42 23.314 16.229 -6.222 1871 HG3 PRO 42 1HG PRO 42 24.922 16.603 -6.972 1872 HD2 PRO 42 2HD PRO 42 22.629 17.114 -8.370 1873 HD3 PRO 42 1HD PRO 42 24.053 16.331 -9.202 1874 H ASP 43 H ASP 43 21.095 15.007 -6.529 1875 HA ASP 43 HA ASP 43 20.667 12.564 -5.015 1876 HB2 ASP 43 2HB ASP 43 19.527 13.673 -3.362 1877 HB3 ASP 43 1HB ASP 43 20.956 14.689 -3.718 1878 H ALA 44 H ALA 44 19.817 13.178 -7.980 1879 HA ALA 44 HA ALA 44 16.981 13.117 -7.891 1880 HB1 ALA 44 1HB ALA 44 18.181 13.778 -9.997 1881 HB2 ALA 44 2HB ALA 44 17.093 12.381 -10.288 1882 HB3 ALA 44 3HB ALA 44 18.868 12.120 -10.124 1883 H ILE 45 H ILE 45 19.528 10.667 -7.712 1884 HA ILE 45 HA ILE 45 17.738 8.485 -8.038 1885 HB ILE 45 HB ILE 45 20.110 8.373 -8.637 1886 HG12 ILE 45 2HG1 ILE 45 19.312 6.306 -6.499 1887 HG13 ILE 45 1HG1 ILE 45 18.726 6.339 -8.194 1888 HG21 ILE 45 1HG2 ILE 45 21.870 8.185 -6.914 1889 HG22 ILE 45 2HG2 ILE 45 20.674 8.412 -5.595 1890 HG23 ILE 45 3HG2 ILE 45 21.036 9.757 -6.741 1891 HD11 ILE 45 3HD ILE 45 21.668 5.969 -7.311 1892 HD12 ILE 45 1HD ILE 45 20.573 4.718 -8.000 1893 HD13 ILE 45 2HD ILE 45 21.103 6.098 -9.019 1894 H TRP 46 H TRP 46 18.471 10.640 -5.426 1895 HA TRP 46 HA TRP 46 18.038 8.777 -3.320 1896 HB2 TRP 46 2HB TRP 46 19.376 11.078 -3.383 1897 HB3 TRP 46 1HB TRP 46 17.783 11.832 -3.047 1898 HD1 TRP 46 HD TRP 46 17.199 11.817 -0.396 1899 HE1 TRP 46 1HE TRP 46 18.312 10.786 1.654 1900 HE3 TRP 46 3HE TRP 46 20.581 8.851 -2.804 1901 HZ2 TRP 46 2HZ TRP 46 20.427 8.870 2.191 1902 HZ3 TRP 46 3HZ TRP 46 22.113 7.432 -1.479 1903 HH2 TRP 46 HH TRP 46 22.027 7.446 0.984 1904 H TRP 47 H TRP 47 16.187 11.335 -4.953 1905 HA TRP 47 HA TRP 47 13.757 11.050 -3.578 1906 HB2 TRP 47 2HB TRP 47 14.326 12.985 -5.060 1907 HB3 TRP 47 1HB TRP 47 14.409 11.890 -6.485 1908 HD1 TRP 47 HD TRP 47 11.716 13.259 -3.954 1909 HE1 TRP 47 1HE TRP 47 9.442 13.195 -5.128 1910 HE3 TRP 47 3HE TRP 47 13.169 10.941 -8.266 1911 HZ2 TRP 47 2HZ TRP 47 8.352 12.067 -7.524 1912 HZ3 TRP 47 3HZ TRP 47 11.456 10.353 -9.951 1913 HH2 TRP 47 HH TRP 47 9.083 10.917 -9.591 1914 H SER 48 H SER 48 15.207 9.373 -6.346 1915 HA SER 48 HA SER 48 13.014 8.021 -7.289 1916 HB2 SER 48 2HB SER 48 15.441 8.279 -8.258 1917 HB3 SER 48 1HB SER 48 15.845 6.814 -7.286 1918 HG SER 48 1HG SER 48 15.282 6.349 -9.423 1919 H VAL 49 H VAL 49 15.145 7.225 -4.514 1920 HA VAL 49 HA VAL 49 14.400 4.581 -4.169 1921 HB VAL 49 HB VAL 49 15.101 6.605 -1.964 1922 HG11 VAL 49 1HG1 VAL 49 15.918 4.543 -0.750 1923 HG12 VAL 49 2HG1 VAL 49 15.279 3.514 -2.079 1924 HG13 VAL 49 3HG1 VAL 49 14.153 4.467 -1.049 1925 HG21 VAL 49 3HG2 VAL 49 16.884 4.877 -3.811 1926 HG22 VAL 49 1HG2 VAL 49 17.454 5.646 -2.282 1927 HG23 VAL 49 2HG2 VAL 49 16.878 6.673 -3.623 1928 H GLU 50 H GLU 50 12.936 7.583 -2.708 1929 HA GLU 50 HA GLU 50 11.077 6.016 -1.235 1930 HB2 GLU 50 2HB GLU 50 9.964 8.157 -0.632 1931 HB3 GLU 50 1HB GLU 50 11.720 8.158 -0.287 1932 HG2 GLU 50 2HG GLU 50 12.155 9.521 -2.333 1933 HG3 GLU 50 1HG GLU 50 10.397 9.523 -2.740 1934 H THR 51 H THR 51 11.151 7.385 -4.425 1935 HA THR 51 HA THR 51 8.410 7.588 -4.947 1936 HB THR 51 HB THR 51 10.750 6.998 -6.851 1937 HG1 THR 51 1HG THR 51 11.025 8.945 -5.683 1938 HG21 THR 51 3HG2 THR 51 8.481 6.593 -7.929 1939 HG22 THR 51 1HG2 THR 51 9.323 8.032 -8.603 1940 HG23 THR 51 2HG2 THR 51 7.983 8.249 -7.430 1941 H ALA 52 H ALA 52 10.741 4.870 -5.290 1942 HA ALA 52 HA ALA 52 8.973 3.155 -6.644 1943 HB1 ALA 52 1HB ALA 52 11.391 2.719 -6.627 1944 HB2 ALA 52 2HB ALA 52 10.550 1.325 -5.861 1945 HB3 ALA 52 3HB ALA 52 11.390 2.542 -4.827 1946 H THR 53 H THR 53 9.456 3.784 -3.128 1947 HA THR 53 HA THR 53 7.809 1.554 -2.417 1948 HB THR 53 HB THR 53 7.945 2.940 -0.114 1949 HG1 THR 53 1HG THR 53 8.943 4.755 -1.225 1950 HG21 THR 53 3HG2 THR 53 10.322 1.506 -1.501 1951 HG22 THR 53 1HG2 THR 53 8.970 0.703 -0.614 1952 HG23 THR 53 2HG2 THR 53 10.123 1.761 0.274 1953 H THR 54 H THR 54 7.022 4.394 -3.917 1954 HA THR 54 HA THR 54 5.325 5.606 -4.214 1955 HB THR 54 HB THR 54 3.236 4.686 -4.593 1956 HG1 THR 54 1HG THR 54 2.679 3.873 -2.677 1957 HG21 THR 54 3HG2 THR 54 3.803 2.612 -5.756 1958 HG22 THR 54 1HG2 THR 54 5.147 2.234 -4.625 1959 HG23 THR 54 2HG2 THR 54 5.301 3.613 -5.765 1960 H VAL 55 H VAL 55 6.544 5.747 -1.524 1961 HA VAL 55 HA VAL 55 4.303 6.225 0.220 1962 HB VAL 55 HB VAL 55 6.282 5.146 1.102 1963 HG11 VAL 55 1HG1 VAL 55 8.405 6.339 1.478 1964 HG12 VAL 55 2HG1 VAL 55 7.807 7.796 0.631 1965 HG13 VAL 55 3HG1 VAL 55 8.066 6.258 -0.280 1966 HG21 VAL 55 3HG2 VAL 55 4.774 6.441 2.574 1967 HG22 VAL 55 1HG2 VAL 55 5.753 7.930 2.332 1968 HG23 VAL 55 2HG2 VAL 55 6.477 6.506 3.172 1969 H GLY 56 H GLY 56 6.867 8.124 -1.423 1970 HA2 GLY 56 2HA GLY 56 6.916 10.228 -2.134 1971 HA3 GLY 56 1HA GLY 56 5.106 10.130 -2.179 1972 H TYR 57 H TYR 57 7.942 10.830 0.040 1973 HA TYR 57 HA TYR 57 6.164 11.472 2.162 1974 HB2 TYR 57 2HB TYR 57 9.168 12.055 1.738 1975 HB3 TYR 57 1HB TYR 57 8.281 12.571 3.223 1976 HD1 TYR 57 1HD TYR 57 7.091 10.822 4.631 1977 HD2 TYR 57 2HD TYR 57 9.981 9.817 1.615 1978 HE1 TYR 57 1HE TYR 57 7.440 8.631 5.706 1979 HE2 TYR 57 2HE TYR 57 10.336 7.621 2.684 1980 HH TYR 57 HH TYR 57 8.649 6.622 5.683 1981 H GLY 58 H GLY 58 7.381 13.269 -0.540 1982 HA2 GLY 58 2HA GLY 58 6.080 15.139 -1.173 1983 HA3 GLY 58 1HA GLY 58 6.045 15.700 0.537 1984 H ASP 59 H ASP 59 9.010 14.365 -0.305 1985 HA ASP 59 HA ASP 59 10.534 16.579 0.134 1986 HB2 ASP 59 2HB ASP 59 11.206 14.073 0.126 1987 HB3 ASP 59 1HB ASP 59 11.343 14.166 -1.646 1988 H ARG 60 H ARG 60 9.839 15.036 -3.117 1989 HA ARG 60 HA ARG 60 9.505 17.609 -4.244 1990 HB2 ARG 60 2HB ARG 60 11.569 15.749 -5.588 1991 HB3 ARG 60 1HB ARG 60 10.889 17.265 -6.261 1992 HG2 ARG 60 2HG ARG 60 12.886 18.123 -5.486 1993 HG3 ARG 60 1HG ARG 60 11.831 18.420 -4.082 1994 HD2 ARG 60 2HD ARG 60 13.962 17.530 -3.276 1995 HD3 ARG 60 1HD ARG 60 12.732 16.220 -3.054 1996 HE ARG 60 HE ARG 60 13.636 15.778 -5.606 1997 HH11 ARG 60 1HH2 ARG 60 15.097 15.317 -2.439 1998 HH12 ARG 60 2HH2 ARG 60 16.781 15.545 -2.986 1999 HH21 ARG 60 1HH1 ARG 60 15.930 15.759 -6.444 2000 HH22 ARG 60 2HH1 ARG 60 17.224 15.632 -5.342 2001 H TYR 61 H TYR 61 8.729 17.051 -6.760 2002 HA TYR 61 HA TYR 61 7.856 14.461 -7.168 2003 HB2 TYR 61 2HB TYR 61 5.296 15.244 -7.287 2004 HB3 TYR 61 1HB TYR 61 5.969 14.672 -5.723 2005 HD1 TYR 61 2HD TYR 61 5.248 17.818 -7.678 2006 HD2 TYR 61 1HD TYR 61 6.044 16.063 -3.829 2007 HE1 TYR 61 2HE TYR 61 4.847 19.991 -6.604 2008 HE2 TYR 61 1HE TYR 61 5.629 18.234 -2.747 2009 HH TYR 61 HH TYR 61 4.384 21.020 -4.512 2010 HA PRO 62 HA PRO 62 8.031 16.844 -10.912 2011 HB2 PRO 62 2HB PRO 62 6.909 15.140 -12.821 2012 HB3 PRO 62 1HB PRO 62 8.428 14.722 -11.945 2013 HG2 PRO 62 2HG PRO 62 5.564 13.848 -11.243 2014 HG3 PRO 62 1HG PRO 62 7.031 12.795 -11.438 2015 HD2 PRO 62 2HD PRO 62 6.168 13.729 -8.956 2016 HD3 PRO 62 1HD PRO 62 7.946 13.565 -9.349 2017 H VAL 63 H VAL 63 6.669 17.803 -12.786 2018 HA VAL 63 HA VAL 63 3.949 18.317 -11.801 2019 HB VAL 63 HB VAL 63 5.457 20.381 -13.435 2020 HG11 VAL 63 1HG1 VAL 63 2.977 20.732 -12.814 2021 HG12 VAL 63 2HG1 VAL 63 4.062 21.910 -11.997 2022 HG13 VAL 63 3HG1 VAL 63 3.417 20.500 -11.085 2023 HG21 VAL 63 3HG2 VAL 63 7.120 19.829 -11.722 2024 HG22 VAL 63 1HG2 VAL 63 5.871 19.840 -10.426 2025 HG23 VAL 63 2HG2 VAL 63 6.318 21.360 -11.279 2026 H THR 64 H THR 64 3.672 20.011 -14.419 2027 HA THR 64 HA THR 64 2.228 18.001 -15.716 2028 HB THR 64 HB THR 64 1.655 20.014 -17.240 2029 HG1 THR 64 1HG THR 64 2.594 21.814 -16.823 2030 HG21 THR 64 3HG2 THR 64 0.244 21.018 -15.390 2031 HG22 THR 64 1HG2 THR 64 1.217 20.146 -14.159 2032 HG23 THR 64 2HG2 THR 64 0.222 19.227 -15.343 2033 H GLU 65 H GLU 65 4.822 20.253 -16.861 2034 HA GLU 65 HA GLU 65 4.915 18.837 -19.286 2035 HB2 GLU 65 2HB GLU 65 5.379 21.269 -19.157 2036 HB3 GLU 65 1HB GLU 65 6.991 20.905 -18.442 2037 HG2 GLU 65 2HG GLU 65 7.754 19.829 -20.459 2038 HG3 GLU 65 1HG GLU 65 6.083 19.565 -21.069 2039 H GLU 66 H GLU 66 6.427 18.336 -16.275 2040 HA GLU 66 HA GLU 66 8.651 16.931 -17.253 2041 HB2 GLU 66 2HB GLU 66 7.398 16.746 -14.476 2042 HB3 GLU 66 1HB GLU 66 9.101 16.440 -14.944 2043 HG2 GLU 66 2HG GLU 66 7.629 19.117 -14.787 2044 HG3 GLU 66 1HG GLU 66 9.172 18.634 -14.031 2045 H GLY 67 H GLY 67 5.347 16.190 -17.059 2046 HA2 GLY 67 2HA GLY 67 4.273 14.440 -17.965 2047 HA3 GLY 67 1HA GLY 67 5.869 13.568 -18.181 2048 H ARG 68 H ARG 68 3.264 14.430 -15.803 2049 HA ARG 68 HA ARG 68 4.686 13.504 -13.617 2050 HB2 ARG 68 2HB ARG 68 2.756 14.987 -13.435 2051 HB3 ARG 68 1HB ARG 68 1.647 13.687 -13.992 2052 HG2 ARG 68 2HG ARG 68 1.861 12.478 -11.963 2053 HG3 ARG 68 1HG ARG 68 3.393 13.275 -11.502 2054 HD2 ARG 68 2HD ARG 68 1.111 15.225 -11.785 2055 HD3 ARG 68 1HD ARG 68 0.771 13.952 -10.574 2056 HE ARG 68 HE ARG 68 2.977 16.021 -10.458 2057 HH11 ARG 68 1HH2 ARG 68 2.033 12.935 -8.987 2058 HH12 ARG 68 2HH2 ARG 68 1.662 13.585 -7.474 2059 HH21 ARG 68 1HH1 ARG 68 2.530 16.908 -8.211 2060 HH22 ARG 68 2HH1 ARG 68 2.660 15.785 -6.954 2061 H LYS 69 H LYS 69 3.381 11.724 -16.199 2062 HA LYS 69 HA LYS 69 2.976 9.244 -14.967 2063 HB2 LYS 69 2HB LYS 69 3.958 9.756 -17.833 2064 HB3 LYS 69 1HB LYS 69 3.400 8.198 -17.156 2065 HG2 LYS 69 2HG LYS 69 1.152 9.484 -16.613 2066 HG3 LYS 69 1HG LYS 69 1.714 10.648 -17.866 2067 HD2 LYS 69 2HD LYS 69 1.960 8.620 -19.471 2068 HD3 LYS 69 1HD LYS 69 1.384 7.590 -18.133 2069 HE2 LYS 69 2HE LYS 69 -0.611 7.760 -19.257 2070 HE3 LYS 69 1HE LYS 69 -0.786 9.196 -18.180 2071 HZ1 LYS 69 3HZ LYS 69 0.239 10.433 -20.214 2072 HZ2 LYS 69 1HZ LYS 69 -1.384 9.942 -20.245 2073 HZ3 LYS 69 2HZ LYS 69 -0.227 9.043 -21.089 2074 H VAL 70 H VAL 70 5.956 11.070 -15.353 2075 HA VAL 70 HA VAL 70 7.731 8.912 -15.494 2076 HB VAL 70 HB VAL 70 7.984 11.762 -14.439 2077 HG11 VAL 70 1HG1 VAL 70 10.493 11.383 -14.487 2078 HG12 VAL 70 2HG1 VAL 70 10.199 9.610 -14.675 2079 HG13 VAL 70 3HG1 VAL 70 9.681 10.467 -13.176 2080 HG21 VAL 70 3HG2 VAL 70 9.063 10.309 -16.962 2081 HG22 VAL 70 1HG2 VAL 70 9.256 12.059 -16.566 2082 HG23 VAL 70 2HG2 VAL 70 7.633 11.397 -16.932 2083 H ALA 71 H ALA 71 5.949 10.368 -12.757 2084 HA ALA 71 HA ALA 71 7.428 8.882 -10.786 2085 HB1 ALA 71 1HB ALA 71 6.175 10.938 -10.089 2086 HB2 ALA 71 2HB ALA 71 5.545 9.492 -9.233 2087 HB3 ALA 71 3HB ALA 71 4.626 10.184 -10.623 2088 H GLU 72 H GLU 72 4.287 8.568 -12.468 2089 HA GLU 72 HA GLU 72 3.233 6.377 -11.263 2090 HB2 GLU 72 2HB GLU 72 1.892 7.637 -12.802 2091 HB3 GLU 72 1HB GLU 72 3.074 7.353 -14.137 2092 HG2 GLU 72 2HG GLU 72 1.052 6.126 -14.567 2093 HG3 GLU 72 1HG GLU 72 2.402 4.976 -14.297 2094 H GLN 73 H GLN 73 5.502 6.295 -14.091 2095 HA GLN 73 HA GLN 73 5.282 3.491 -14.228 2096 HB2 GLN 73 2HB GLN 73 6.064 4.967 -16.124 2097 HB3 GLN 73 1HB GLN 73 7.665 5.081 -15.315 2098 HG2 GLN 73 2HG GLN 73 7.975 2.618 -15.515 2099 HG3 GLN 73 1HG GLN 73 6.270 2.421 -16.063 2100 HE21 GLN 73 1HE2 GLN 73 7.509 1.210 -17.837 2101 HE22 GLN 73 2HE2 GLN 73 7.881 2.112 -19.249 2102 H VAL 74 H VAL 74 7.371 5.548 -12.228 2103 HA VAL 74 HA VAL 74 9.202 3.413 -11.633 2104 HB VAL 74 HB VAL 74 8.793 6.150 -10.333 2105 HG11 VAL 74 1HG1 VAL 74 11.159 5.788 -9.483 2106 HG12 VAL 74 2HG1 VAL 74 11.119 4.101 -10.118 2107 HG13 VAL 74 3HG1 VAL 74 10.012 4.595 -8.786 2108 HG21 VAL 74 3HG2 VAL 74 10.792 5.152 -12.482 2109 HG22 VAL 74 1HG2 VAL 74 10.707 6.819 -11.782 2110 HG23 VAL 74 2HG2 VAL 74 9.387 6.207 -12.815 2111 H MET 75 H MET 75 6.316 4.924 -10.166 2112 HA MET 75 HA MET 75 6.422 3.572 -7.715 2113 HB2 MET 75 2HB MET 75 4.035 4.616 -9.365 2114 HB3 MET 75 1HB MET 75 3.879 3.953 -7.706 2115 HG2 MET 75 2HG MET 75 5.636 5.655 -6.953 2116 HG3 MET 75 1HG MET 75 5.458 6.465 -8.527 2117 HE1 MET 75 3HE MET 75 2.257 5.989 -9.131 2118 HE2 MET 75 1HE MET 75 3.082 7.568 -9.387 2119 HE3 MET 75 2HE MET 75 1.566 7.474 -8.429 2120 H LYS 76 H LYS 76 4.806 2.756 -10.820 2121 HA LYS 76 HA LYS 76 3.614 0.451 -9.842 2122 HB2 LYS 76 2HB LYS 76 2.941 1.551 -11.948 2123 HB3 LYS 76 1HB LYS 76 4.446 0.983 -12.750 2124 HG2 LYS 76 2HG LYS 76 3.707 -1.287 -12.782 2125 HG3 LYS 76 1HG LYS 76 2.660 -1.058 -11.342 2126 HD2 LYS 76 2HD LYS 76 1.056 0.306 -12.626 2127 HD3 LYS 76 1HD LYS 76 2.005 0.079 -14.131 2128 HE2 LYS 76 2HE LYS 76 0.804 -2.274 -12.479 2129 HE3 LYS 76 1HE LYS 76 -0.052 -1.437 -13.835 2130 HZ1 LYS 76 3HZ LYS 76 1.955 -2.011 -15.214 2131 HZ2 LYS 76 1HZ LYS 76 0.892 -3.232 -14.790 2132 HZ3 LYS 76 2HZ LYS 76 2.393 -3.147 -13.990 2133 H ALA 77 H ALA 77 6.898 0.956 -11.136 2134 HA ALA 77 HA ALA 77 7.585 -1.738 -11.390 2135 HB1 ALA 77 1HB ALA 77 9.413 0.609 -10.575 2136 HB2 ALA 77 2HB ALA 77 9.032 0.119 -12.268 2137 HB3 ALA 77 3HB ALA 77 9.961 -0.994 -11.192 2138 H GLY 78 H GLY 78 7.471 0.383 -8.516 2139 HA2 GLY 78 2HA GLY 78 8.924 -1.375 -6.819 2140 HA3 GLY 78 1HA GLY 78 7.818 -0.021 -6.372 2141 H ILE 79 H ILE 79 5.422 -0.679 -7.217 2142 HA ILE 79 HA ILE 79 4.557 -2.572 -5.374 2143 HB ILE 79 HB ILE 79 3.078 -1.543 -7.851 2144 HG12 ILE 79 2HG1 ILE 79 3.183 -0.424 -4.971 2145 HG13 ILE 79 1HG1 ILE 79 3.953 0.325 -6.402 2146 HG21 ILE 79 1HG2 ILE 79 1.006 -2.104 -6.536 2147 HG22 ILE 79 2HG2 ILE 79 2.016 -2.733 -5.190 2148 HG23 ILE 79 3HG2 ILE 79 1.991 -3.573 -6.784 2149 HD11 ILE 79 3HD ILE 79 0.915 -0.029 -5.961 2150 HD12 ILE 79 1HD ILE 79 1.852 1.492 -5.912 2151 HD13 ILE 79 2HD ILE 79 1.670 0.610 -7.470 2152 H GLU 80 H GLU 80 5.112 -2.820 -8.930 2153 HA GLU 80 HA GLU 80 4.015 -5.364 -9.185 2154 HB2 GLU 80 2HB GLU 80 4.552 -3.531 -10.948 2155 HB3 GLU 80 1HB GLU 80 6.192 -4.244 -11.042 2156 HG2 GLU 80 2HG GLU 80 5.156 -6.368 -11.917 2157 HG3 GLU 80 1HG GLU 80 3.513 -5.732 -11.536 2158 H VAL 81 H VAL 81 7.385 -4.299 -8.472 2159 HA VAL 81 HA VAL 81 8.489 -6.901 -8.576 2160 HB VAL 81 HB VAL 81 9.353 -4.240 -7.387 2161 HG11 VAL 81 1HG1 VAL 81 11.605 -5.365 -6.865 2162 HG12 VAL 81 2HG1 VAL 81 10.784 -6.953 -7.028 2163 HG13 VAL 81 3HG1 VAL 81 10.278 -5.797 -5.740 2164 HG21 VAL 81 3HG2 VAL 81 9.467 -4.684 -9.888 2165 HG22 VAL 81 1HG2 VAL 81 10.525 -6.108 -9.574 2166 HG23 VAL 81 2HG2 VAL 81 11.094 -4.448 -9.165 2167 H PHE 82 H PHE 82 7.246 -4.897 -5.810 2168 HA PHE 82 HA PHE 82 7.897 -6.885 -3.914 2169 HB2 PHE 82 2HB PHE 82 5.732 -4.688 -3.744 2170 HB3 PHE 82 1HB PHE 82 6.321 -5.665 -2.346 2171 HD1 PHE 82 2HD PHE 82 9.319 -5.647 -2.813 2172 HD2 PHE 82 1HD PHE 82 6.367 -2.531 -3.168 2173 HE1 PHE 82 2HE PHE 82 11.045 -3.952 -2.362 2174 HE2 PHE 82 1HE PHE 82 8.097 -0.842 -2.712 2175 HZ PHE 82 HZ PHE 82 10.446 -1.541 -2.304 2176 H ALA 83 H ALA 83 4.935 -6.265 -5.828 2177 HA ALA 83 HA ALA 83 3.308 -8.085 -4.479 2178 HB1 ALA 83 1HB ALA 83 2.376 -6.392 -6.078 2179 HB2 ALA 83 2HB ALA 83 1.862 -8.054 -6.529 2180 HB3 ALA 83 3HB ALA 83 3.190 -7.237 -7.443 2181 H LEU 84 H LEU 84 5.699 -8.517 -7.072 2182 HA LEU 84 HA LEU 84 4.956 -11.046 -7.941 2183 HB2 LEU 84 2HB LEU 84 6.565 -9.442 -9.020 2184 HB3 LEU 84 1HB LEU 84 7.805 -9.885 -7.816 2185 HG LEU 84 HG LEU 84 6.477 -12.036 -9.555 2186 HD11 LEU 84 1HD1 LEU 84 8.779 -10.202 -10.487 2187 HD12 LEU 84 2HD1 LEU 84 7.095 -10.221 -11.133 2188 HD13 LEU 84 3HD1 LEU 84 8.155 -11.659 -11.354 2189 HD21 LEU 84 3HD2 LEU 84 8.744 -13.122 -9.456 2190 HD22 LEU 84 1HD2 LEU 84 8.068 -12.876 -7.817 2191 HD23 LEU 84 2HD2 LEU 84 9.351 -11.771 -8.428 2192 H VAL 85 H VAL 85 6.856 -10.009 -5.146 2193 HA VAL 85 HA VAL 85 8.022 -12.454 -4.487 2194 HB VAL 85 HB VAL 85 7.285 -10.054 -2.733 2195 HG11 VAL 85 1HG1 VAL 85 7.753 -11.871 -1.196 2196 HG12 VAL 85 2HG1 VAL 85 9.234 -10.865 -1.281 2197 HG13 VAL 85 3HG1 VAL 85 9.155 -12.441 -2.162 2198 HG21 VAL 85 3HG2 VAL 85 8.740 -9.430 -4.660 2199 HG22 VAL 85 1HG2 VAL 85 9.859 -10.792 -4.301 2200 HG23 VAL 85 2HG2 VAL 85 9.700 -9.416 -3.151 2201 H THR 86 H THR 86 4.670 -11.543 -4.330 2202 HA THR 86 HA THR 86 3.882 -13.006 -2.105 2203 HB THR 86 HB THR 86 2.220 -12.533 -4.612 2204 HG1 THR 86 1HG THR 86 2.807 -10.592 -4.114 2205 HG21 THR 86 3HG2 THR 86 1.119 -14.025 -2.891 2206 HG22 THR 86 1HG2 THR 86 0.353 -12.401 -2.902 2207 HG23 THR 86 2HG2 THR 86 1.514 -12.832 -1.596 2208 H ALA 87 H ALA 87 5.059 -14.146 -5.181 2209 HA ALA 87 HA ALA 87 3.921 -16.721 -5.155 2210 HB1 ALA 87 1HB ALA 87 5.189 -15.792 -7.127 2211 HB2 ALA 87 2HB ALA 87 5.862 -17.373 -6.597 2212 HB3 ALA 87 3HB ALA 87 6.702 -15.835 -6.162 2213 H ALA 88 H ALA 88 6.232 -15.206 -3.030 2214 HA ALA 88 HA ALA 88 7.208 -17.741 -2.023 2215 HB1 ALA 88 1HB ALA 88 7.609 -14.891 -0.908 2216 HB2 ALA 88 2HB ALA 88 8.795 -15.774 -1.927 2217 HB3 ALA 88 3HB ALA 88 8.387 -16.379 -0.276 2218 H LEU 89 H LEU 89 5.139 -14.981 -0.916 2219 HA LEU 89 HA LEU 89 4.739 -16.179 1.553 2220 HB2 LEU 89 2HB LEU 89 3.041 -13.978 0.231 2221 HB3 LEU 89 1HB LEU 89 2.914 -14.509 1.935 2222 HG LEU 89 HG LEU 89 4.100 -12.560 2.069 2223 HD11 LEU 89 1HD1 LEU 89 6.259 -13.107 3.050 2224 HD12 LEU 89 2HD1 LEU 89 6.371 -14.649 2.128 2225 HD13 LEU 89 3HD1 LEU 89 5.111 -14.451 3.394 2226 HD21 LEU 89 3HD2 LEU 89 4.711 -12.168 -0.296 2227 HD22 LEU 89 1HD2 LEU 89 6.071 -13.351 -0.158 2228 HD23 LEU 89 2HD2 LEU 89 6.081 -11.844 0.816 2229 H ALA 90 H ALA 90 2.822 -16.609 -1.396 2230 HA ALA 90 HA ALA 90 0.606 -17.694 0.074 2231 HB1 ALA 90 1HB ALA 90 1.415 -17.981 -2.865 2232 HB2 ALA 90 2HB ALA 90 0.270 -16.772 -2.191 2233 HB3 ALA 90 3HB ALA 90 -0.167 -18.520 -2.167 2234 H THR 91 H THR 91 3.791 -18.958 -0.607 2235 HA THR 91 HA THR 91 2.901 -21.695 -0.714 2236 HB THR 91 HB THR 91 5.161 -22.415 -0.508 2237 HG1 THR 91 1HG THR 91 5.756 -19.677 0.062 2238 HG21 THR 91 3HG2 THR 91 4.340 -21.632 -2.720 2239 HG22 THR 91 1HG2 THR 91 6.104 -21.336 -2.557 2240 HG23 THR 91 2HG2 THR 91 4.943 -19.971 -2.395 2241 H ASP 92 H ASP 92 3.320 -19.279 1.754 2242 HA ASP 92 HA ASP 92 4.205 -20.890 3.795 2243 HB2 ASP 92 2HB ASP 92 2.634 -18.254 3.840 2244 HB3 ASP 92 1HB ASP 92 3.141 -19.106 5.341 2245 H PHE 93 H PHE 93 0.914 -20.527 2.483 2246 HA PHE 93 HA PHE 93 -0.218 -21.729 4.836 2247 HB2 PHE 93 2HB PHE 93 -2.343 -21.752 3.907 2248 HB3 PHE 93 1HB PHE 93 -1.626 -20.209 3.358 2249 HD1 PHE 93 1HD PHE 93 -2.802 -23.601 2.402 2250 HD2 PHE 93 2HD PHE 93 -1.223 -19.886 0.932 2251 HE1 PHE 93 1HE PHE 93 -3.410 -24.255 0.100 2252 HE2 PHE 93 2HE PHE 93 -1.827 -20.537 -1.366 2253 HZ PHE 93 HZ PHE 93 -2.915 -22.734 -1.794 2254 H VAL 94 H VAL 94 1.391 -22.923 1.992 2255 HA VAL 94 HA VAL 94 0.040 -25.396 1.835 2256 HB VAL 94 HB VAL 94 2.827 -24.685 0.796 2257 HG11 VAL 94 1HG1 VAL 94 2.270 -26.441 -0.939 2258 HG12 VAL 94 2HG1 VAL 94 0.730 -26.799 -0.074 2259 HG13 VAL 94 3HG1 VAL 94 2.313 -27.134 0.716 2260 HG21 VAL 94 3HG2 VAL 94 0.020 -24.272 -0.464 2261 HG22 VAL 94 1HG2 VAL 94 1.592 -24.053 -1.315 2262 HG23 VAL 94 2HG2 VAL 94 1.148 -22.963 0.030 2263 H ARG 95 H ARG 95 2.674 -24.110 3.800 2264 HA ARG 95 HA ARG 95 3.742 -26.597 4.634 2265 HB2 ARG 95 2HB ARG 95 3.644 -24.030 6.333 2266 HB3 ARG 95 1HB ARG 95 4.740 -25.441 6.526 2267 HG2 ARG 95 2HG ARG 95 5.693 -24.828 4.183 2268 HG3 ARG 95 1HG ARG 95 4.779 -23.280 4.357 2269 HD2 ARG 95 2HD ARG 95 6.004 -23.086 6.720 2270 HD3 ARG 95 1HD ARG 95 7.070 -24.403 6.123 2271 HE ARG 95 HE ARG 95 7.979 -22.920 4.435 2272 HH11 ARG 95 1HH2 ARG 95 5.534 -21.167 6.474 2273 HH12 ARG 95 2HH2 ARG 95 5.934 -19.642 5.783 2274 HH21 ARG 95 1HH1 ARG 95 8.646 -20.864 3.807 2275 HH22 ARG 95 2HH1 ARG 95 7.871 -19.421 4.395 2276 H ARG 96 H ARG 96 0.648 -25.226 5.255 2277 HA ARG 96 HA ARG 96 0.333 -26.079 7.956 2278 HB2 ARG 96 2HB ARG 96 -1.220 -24.418 6.929 2279 HB3 ARG 96 1HB ARG 96 -1.692 -25.622 5.685 2280 HG2 ARG 96 2HG ARG 96 -2.747 -27.049 7.415 2281 HG3 ARG 96 1HG ARG 96 -2.313 -25.871 8.697 2282 HD2 ARG 96 2HD ARG 96 -3.980 -24.338 8.042 2283 HD3 ARG 96 1HD ARG 96 -3.803 -24.723 6.299 2284 HE ARG 96 HE ARG 96 -5.558 -26.084 8.267 2285 HH11 ARG 96 1HH2 ARG 96 -4.020 -26.301 5.027 2286 HH12 ARG 96 2HH2 ARG 96 -5.095 -27.413 4.365 2287 HH21 ARG 96 1HH1 ARG 96 -7.279 -27.463 7.271 2288 HH22 ARG 96 2HH1 ARG 96 -7.160 -27.923 5.636 2289 H GLU 97 H GLU 97 0.152 -27.664 4.765 2290 HA GLU 97 HA GLU 97 -1.130 -29.992 6.017 2291 HB2 GLU 97 2HB GLU 97 -0.705 -29.421 3.033 2292 HB3 GLU 97 1HB GLU 97 -1.663 -30.743 3.783 2293 HG2 GLU 97 2HG GLU 97 -2.992 -28.816 4.990 2294 HG3 GLU 97 1HG GLU 97 -2.226 -27.695 3.796 2295 H GLU 98 H GLU 98 -0.072 -32.132 5.162 2296 HA GLU 98 HA GLU 98 1.585 -33.507 5.191 2297 HB2 GLU 98 2HB GLU 98 3.552 -31.306 4.426 2298 HB3 GLU 98 1HB GLU 98 3.812 -33.076 4.308 2299 HG2 GLU 98 2HG GLU 98 1.645 -31.533 2.713 2300 HG3 GLU 98 1HG GLU 98 3.317 -31.823 2.128 2301 H GLU 99 H GLU 99 2.876 -30.427 6.578 2302 HA GLU 99 HA GLU 99 4.404 -31.728 8.551 2303 HB2 GLU 99 2HB GLU 99 3.271 -28.860 8.584 2304 HB3 GLU 99 1HB GLU 99 4.442 -29.545 9.751 2305 HG2 GLU 99 2HG GLU 99 5.907 -30.065 7.552 2306 HG3 GLU 99 1HG GLU 99 4.853 -28.804 6.797 2307 H ARG 100 H ARG 100 1.053 -30.424 8.561 2308 HA ARG 100 HA ARG 100 0.721 -30.956 11.339 2309 HB2 ARG 100 2HB ARG 100 -0.591 -29.200 10.108 2310 HB3 ARG 100 1HB ARG 100 -1.400 -30.479 9.153 2311 HG2 ARG 100 2HG ARG 100 -2.847 -29.555 10.905 2312 HG3 ARG 100 1HG ARG 100 -2.550 -31.306 11.209 2313 HD2 ARG 100 2HD ARG 100 -0.931 -30.795 12.993 2314 HD3 ARG 100 1HD ARG 100 -1.013 -29.019 12.606 2315 HE ARG 100 HE ARG 100 -3.629 -29.473 13.188 2316 HH11 ARG 100 1HH2 ARG 100 -0.567 -30.267 15.001 2317 HH12 ARG 100 2HH2 ARG 100 -1.328 -30.111 16.529 2318 HH21 ARG 100 1HH1 ARG 100 -4.596 -29.365 15.266 2319 HH22 ARG 100 2HH1 ARG 100 -3.731 -29.703 16.699 2320 H ARG 101 H ARG 101 0.333 -32.904 8.396 2321 HA ARG 101 HA ARG 101 -0.902 -35.038 10.026 2322 HB2 ARG 101 2HB ARG 101 -1.589 -34.170 7.144 2323 HB3 ARG 101 1HB ARG 101 -2.064 -35.757 7.828 2324 HG2 ARG 101 2HG ARG 101 -3.001 -33.099 9.058 2325 HG3 ARG 101 1HG ARG 101 -3.825 -33.946 7.695 2326 HD2 ARG 101 2HD ARG 101 -3.941 -36.053 9.173 2327 HD3 ARG 101 1HD ARG 101 -3.467 -35.009 10.584 2328 HE ARG 101 HE ARG 101 -5.551 -33.582 9.450 2329 HH11 ARG 101 1HH2 ARG 101 -5.352 -37.040 10.547 2330 HH12 ARG 101 2HH2 ARG 101 -7.023 -37.320 10.208 2331 HH21 ARG 101 1HH1 ARG 101 -7.884 -33.954 9.372 2332 HH22 ARG 101 2HH1 ARG 101 -8.523 -35.428 9.952 2333 H GLY 102 H GLY 102 1.145 -36.033 10.285 2334 HA2 GLY 102 2HA GLY 102 1.997 -37.978 8.986 2335 HA3 GLY 102 1HA GLY 102 2.546 -36.744 7.774 2336 H HIS 103 H HIS 103 2.963 -34.763 10.008 2337 HA HIS 103 HA HIS 103 5.351 -35.884 11.277 2338 HB2 HIS 103 2HB HIS 103 6.001 -35.050 8.932 2339 HB3 HIS 103 1HB HIS 103 5.462 -33.423 9.406 2340 HD1 HIS 103 1HD HIS 103 7.199 -32.036 10.862 2341 HD2 HIS 103 2HD HIS 103 8.475 -35.972 9.966 2342 HE1 HIS 103 1HE HIS 103 9.631 -32.145 11.318 2343 HE2 HIS 103 2HE HIS 103 10.418 -34.495 10.744 2344 H1 SER 1 H SER 1 -4.196 -19.252 16.316 2345 HA SER 1 HA SER 1 -3.544 -20.394 18.910 2346 HB2 SER 1 2HB SER 1 -5.646 -21.633 18.855 2347 HB3 SER 1 1HB SER 1 -5.969 -19.875 18.656 2348 HG SER 1 1HG SER 1 -6.031 -20.371 16.295 2349 H ALA 2 H ALA 2 -4.151 -21.058 15.462 2350 HA ALA 2 HA ALA 2 -2.968 -23.677 15.710 2351 HB1 ALA 2 1HB ALA 2 -3.988 -22.121 13.271 2352 HB2 ALA 2 2HB ALA 2 -4.923 -23.335 14.205 2353 HB3 ALA 2 3HB ALA 2 -3.495 -23.871 13.248 2354 H ASP 3 H ASP 3 -1.379 -24.315 13.980 2355 HA ASP 3 HA ASP 3 1.097 -23.423 14.255 2356 HB2 ASP 3 2HB ASP 3 1.347 -24.316 11.665 2357 HB3 ASP 3 1HB ASP 3 1.062 -25.396 13.042 2358 H HIS 4 H HIS 4 -0.700 -22.698 11.345 2359 HA HIS 4 HA HIS 4 0.971 -20.734 10.356 2360 HB2 HIS 4 2HB HIS 4 -0.966 -20.042 8.869 2361 HB3 HIS 4 1HB HIS 4 -0.640 -21.801 8.869 2362 HD1 HIS 4 1HD HIS 4 -2.308 -23.324 10.371 2363 HD2 HIS 4 2HD HIS 4 -3.417 -19.268 10.198 2364 HE1 HIS 4 1HE HIS 4 -4.689 -23.150 11.203 2365 HE2 HIS 4 2HE HIS 4 -5.143 -20.668 11.408 2366 H GLU 5 H GLU 5 -1.421 -20.332 12.931 2367 HA GLU 5 HA GLU 5 -1.686 -17.474 12.460 2368 HB2 GLU 5 2HB GLU 5 -2.749 -19.394 14.585 2369 HB3 GLU 5 1HB GLU 5 -2.924 -17.623 14.749 2370 HG2 GLU 5 2HG GLU 5 -4.546 -17.415 13.154 2371 HG3 GLU 5 1HG GLU 5 -3.859 -18.680 12.094 2372 H ARG 6 H ARG 6 -0.010 -19.788 14.657 2373 HA ARG 6 HA ARG 6 1.177 -17.797 16.250 2374 HB2 ARG 6 2HB ARG 6 2.127 -20.645 15.548 2375 HB3 ARG 6 1HB ARG 6 2.930 -19.615 16.782 2376 HG2 ARG 6 2HG ARG 6 -0.030 -20.451 16.916 2377 HG3 ARG 6 1HG ARG 6 1.312 -21.352 17.706 2378 HD2 ARG 6 2HD ARG 6 1.860 -19.424 19.170 2379 HD3 ARG 6 1HD ARG 6 0.729 -18.369 18.231 2380 HE ARG 6 HE ARG 6 -0.445 -20.804 19.501 2381 HH11 ARG 6 1HH2 ARG 6 0.150 -17.223 19.803 2382 HH12 ARG 6 2HH2 ARG 6 -1.429 -16.927 20.430 2383 HH21 ARG 6 1HH1 ARG 6 -2.412 -20.300 20.813 2384 HH22 ARG 6 2HH1 ARG 6 -2.892 -18.641 20.893 2385 H GLU 7 H GLU 7 2.317 -19.442 13.294 2386 HA GLU 7 HA GLU 7 4.805 -18.171 13.165 2387 HB2 GLU 7 2HB GLU 7 3.993 -20.262 11.873 2388 HB3 GLU 7 1HB GLU 7 3.053 -19.152 10.828 2389 HG2 GLU 7 2HG GLU 7 4.982 -19.642 9.565 2390 HG3 GLU 7 1HG GLU 7 5.365 -18.026 10.246 2391 H ALA 8 H ALA 8 1.558 -17.218 11.944 2392 HA ALA 8 HA ALA 8 2.487 -15.037 10.409 2393 HB1 ALA 8 1HB ALA 8 0.099 -14.241 10.441 2394 HB2 ALA 8 2HB ALA 8 -0.287 -15.489 11.684 2395 HB3 ALA 8 3HB ALA 8 0.211 -15.988 10.023 2396 H GLN 9 H GLN 9 1.241 -15.343 13.770 2397 HA GLN 9 HA GLN 9 1.245 -12.586 14.266 2398 HB2 GLN 9 2HB GLN 9 -0.023 -14.402 15.566 2399 HB3 GLN 9 1HB GLN 9 1.521 -14.786 16.398 2400 HG2 GLN 9 2HG GLN 9 1.597 -12.384 17.257 2401 HG3 GLN 9 1HG GLN 9 0.039 -12.052 16.425 2402 HE21 GLN 9 1HE2 GLN 9 -1.656 -14.105 17.010 2403 HE22 GLN 9 2HE2 GLN 9 -1.891 -14.201 18.706 2404 H LYS 10 H LYS 10 3.762 -15.029 14.447 2405 HA LYS 10 HA LYS 10 5.650 -13.849 16.058 2406 HB2 LYS 10 2HB LYS 10 5.780 -16.163 15.028 2407 HB3 LYS 10 1HB LYS 10 6.017 -15.394 13.433 2408 HG2 LYS 10 2HG LYS 10 8.229 -14.388 14.360 2409 HG3 LYS 10 1HG LYS 10 7.966 -15.427 15.800 2410 HD2 LYS 10 2HD LYS 10 9.448 -16.628 14.326 2411 HD3 LYS 10 1HD LYS 10 7.842 -17.436 14.216 2412 HE2 LYS 10 2HE LYS 10 7.425 -16.118 12.023 2413 HE3 LYS 10 1HE LYS 10 9.123 -15.502 12.147 2414 HZ1 LYS 10 3HZ LYS 10 9.841 -17.852 12.137 2415 HZ2 LYS 10 1HZ LYS 10 9.029 -17.420 10.723 2416 HZ3 LYS 10 2HZ LYS 10 8.198 -18.324 11.914 2417 H ALA 11 H ALA 11 4.906 -13.245 12.607 2418 HA ALA 11 HA ALA 11 7.180 -11.682 12.067 2419 HB1 ALA 11 1HB ALA 11 4.411 -11.636 10.703 2420 HB2 ALA 11 2HB ALA 11 5.812 -12.672 10.233 2421 HB3 ALA 11 3HB ALA 11 5.914 -10.888 10.044 2422 H GLU 12 H GLU 12 3.923 -10.829 13.376 2423 HA GLU 12 HA GLU 12 4.359 -8.045 13.018 2424 HB2 GLU 12 2HB GLU 12 2.367 -9.402 14.909 2425 HB3 GLU 12 1HB GLU 12 2.566 -7.630 14.697 2426 HG2 GLU 12 2HG GLU 12 2.137 -8.030 12.150 2427 HG3 GLU 12 1HG GLU 12 1.491 -9.637 12.639 2428 H GLU 13 H GLU 13 5.462 -10.333 15.465 2429 HA GLU 13 HA GLU 13 5.952 -8.304 17.400 2430 HB2 GLU 13 2HB GLU 13 5.712 -10.786 17.938 2431 HB3 GLU 13 1HB GLU 13 7.360 -11.026 17.275 2432 HG2 GLU 13 2HG GLU 13 8.288 -9.458 19.003 2433 HG3 GLU 13 1HG GLU 13 6.622 -9.068 19.557 2434 H GLU 14 H GLU 14 7.717 -9.661 14.649 2435 HA GLU 14 HA GLU 14 10.241 -8.628 15.303 2436 HB2 GLU 14 2HB GLU 14 9.858 -10.456 13.620 2437 HB3 GLU 14 1HB GLU 14 9.102 -9.254 12.521 2438 HG2 GLU 14 2HG GLU 14 11.400 -9.759 11.818 2439 HG3 GLU 14 1HG GLU 14 11.316 -8.042 12.352 2440 H LEU 15 H LEU 15 7.453 -7.318 13.503 2441 HA LEU 15 HA LEU 15 8.714 -5.095 12.486 2442 HB2 LEU 15 2HB LEU 15 6.407 -5.896 11.861 2443 HB3 LEU 15 1HB LEU 15 5.774 -5.242 13.402 2444 HG LEU 15 HG LEU 15 6.284 -2.943 12.693 2445 HD11 LEU 15 1HD1 LEU 15 7.203 -2.470 10.351 2446 HD12 LEU 15 2HD1 LEU 15 7.651 -4.210 10.232 2447 HD13 LEU 15 3HD1 LEU 15 8.400 -3.154 11.490 2448 HD21 LEU 15 3HD2 LEU 15 4.939 -4.518 10.393 2449 HD22 LEU 15 1HD2 LEU 15 4.747 -2.762 10.730 2450 HD23 LEU 15 2HD2 LEU 15 4.140 -3.973 11.912 2451 H GLN 16 H GLN 16 7.160 -5.526 15.666 2452 HA GLN 16 HA GLN 16 7.346 -2.875 16.529 2453 HB2 GLN 16 2HB GLN 16 7.532 -5.433 18.223 2454 HB3 GLN 16 1HB GLN 16 7.235 -3.774 18.852 2455 HG2 GLN 16 2HG GLN 16 5.104 -3.653 17.484 2456 HG3 GLN 16 1HG GLN 16 5.341 -5.363 16.976 2457 HE21 GLN 16 1HE2 GLN 16 5.679 -6.976 18.853 2458 HE22 GLN 16 2HE2 GLN 16 4.778 -6.737 20.306 2459 H LYS 17 H LYS 17 9.795 -5.492 16.526 2460 HA LYS 17 HA LYS 17 11.573 -4.101 18.275 2461 HB2 LYS 17 2HB LYS 17 12.251 -6.264 16.184 2462 HB3 LYS 17 1HB LYS 17 13.341 -5.649 17.477 2463 HG2 LYS 17 2HG LYS 17 11.576 -6.410 19.184 2464 HG3 LYS 17 1HG LYS 17 10.753 -7.277 17.843 2465 HD2 LYS 17 2HD LYS 17 13.652 -7.774 18.848 2466 HD3 LYS 17 1HD LYS 17 12.187 -8.724 19.247 2467 HE2 LYS 17 2HE LYS 17 13.088 -10.084 17.612 2468 HE3 LYS 17 1HE LYS 17 11.953 -9.099 16.624 2469 HZ1 LYS 17 3HZ LYS 17 14.469 -7.777 16.591 2470 HZ2 LYS 17 1HZ LYS 17 13.659 -8.647 15.358 2471 HZ3 LYS 17 2HZ LYS 17 14.712 -9.457 16.399 2472 H VAL 18 H VAL 18 11.116 -4.316 14.732 2473 HA VAL 18 HA VAL 18 13.418 -2.855 14.069 2474 HB VAL 18 HB VAL 18 10.811 -3.177 12.502 2475 HG11 VAL 18 1HG1 VAL 18 12.101 -1.219 11.637 2476 HG12 VAL 18 2HG1 VAL 18 12.280 -2.597 10.505 2477 HG13 VAL 18 3HG1 VAL 18 13.622 -2.188 11.636 2478 HG21 VAL 18 3HG2 VAL 18 12.116 -4.976 11.312 2479 HG22 VAL 18 1HG2 VAL 18 11.978 -5.363 13.054 2480 HG23 VAL 18 2HG2 VAL 18 13.515 -4.702 12.411 2481 H LEU 19 H LEU 19 10.032 -1.842 14.813 2482 HA LEU 19 HA LEU 19 10.298 0.849 14.265 2483 HB2 LEU 19 2HB LEU 19 8.855 -0.210 16.784 2484 HB3 LEU 19 1HB LEU 19 8.626 1.382 15.989 2485 HG LEU 19 HG LEU 19 7.814 -1.370 14.923 2486 HD11 LEU 19 1HD1 LEU 19 6.389 -0.461 16.759 2487 HD12 LEU 19 2HD1 LEU 19 5.505 -0.513 15.190 2488 HD13 LEU 19 3HD1 LEU 19 6.140 1.054 15.813 2489 HD21 LEU 19 3HD2 LEU 19 7.505 1.377 13.560 2490 HD22 LEU 19 1HD2 LEU 19 6.708 -0.162 13.058 2491 HD23 LEU 19 2HD2 LEU 19 8.499 -0.013 12.970 2492 H GLU 20 H GLU 20 10.992 -0.856 17.384 2493 HA GLU 20 HA GLU 20 11.788 1.402 18.785 2494 HB2 GLU 20 2HB GLU 20 12.758 -1.499 19.205 2495 HB3 GLU 20 1HB GLU 20 13.075 -0.122 20.313 2496 HG2 GLU 20 2HG GLU 20 10.504 0.155 20.506 2497 HG3 GLU 20 1HG GLU 20 10.368 -1.476 19.749 2498 H GLU 21 H GLU 21 13.843 -0.983 16.966 2499 HA GLU 21 HA GLU 21 16.190 0.445 17.716 2500 HB2 GLU 21 2HB GLU 21 15.896 -1.626 15.481 2501 HB3 GLU 21 1HB GLU 21 17.427 -0.993 16.190 2502 HG2 GLU 21 2HG GLU 21 16.691 -1.905 18.462 2503 HG3 GLU 21 1HG GLU 21 15.279 -2.668 17.647 2504 H ALA 22 H ALA 22 13.971 0.667 14.928 2505 HA ALA 22 HA ALA 22 15.701 2.281 13.366 2506 HB1 ALA 22 1HB ALA 22 12.628 2.092 13.296 2507 HB2 ALA 22 2HB ALA 22 13.765 1.108 12.310 2508 HB3 ALA 22 3HB ALA 22 13.667 2.888 12.057 2509 H SER 23 H SER 23 13.374 2.901 15.961 2510 HA SER 23 HA SER 23 13.023 5.635 15.661 2511 HB2 SER 23 2HB SER 23 13.325 4.110 18.348 2512 HB3 SER 23 1HB SER 23 12.566 5.720 18.118 2513 HG SER 23 1HG SER 23 11.684 3.235 17.014 2514 H LYS 24 H LYS 24 15.611 3.809 17.397 2515 HA LYS 24 HA LYS 24 16.884 6.074 18.444 2516 HB2 LYS 24 2HB LYS 24 18.416 3.574 17.475 2517 HB3 LYS 24 1HB LYS 24 18.935 4.809 18.673 2518 HG2 LYS 24 2HG LYS 24 16.868 3.943 20.090 2519 HG3 LYS 24 1HG LYS 24 16.931 2.517 19.000 2520 HD2 LYS 24 2HD LYS 24 19.150 3.648 20.823 2521 HD3 LYS 24 1HD LYS 24 18.246 2.111 21.066 2522 HE2 LYS 24 2HE LYS 24 19.389 1.041 19.165 2523 HE3 LYS 24 1HE LYS 24 20.130 2.602 18.636 2524 HZ1 LYS 24 3HZ LYS 24 20.782 1.618 21.348 2525 HZ2 LYS 24 1HZ LYS 24 21.648 2.580 20.267 2526 HZ3 LYS 24 2HZ LYS 24 21.519 0.926 19.953 2527 H LYS 25 H LYS 25 17.388 4.236 15.423 2528 HA LYS 25 HA LYS 25 19.557 5.777 14.524 2529 HB2 LYS 25 2HB LYS 25 17.771 3.642 13.375 2530 HB3 LYS 25 1HB LYS 25 18.520 4.731 12.172 2531 HG2 LYS 25 2HG LYS 25 19.859 2.703 12.525 2532 HG3 LYS 25 1HG LYS 25 20.746 4.241 12.858 2533 HD2 LYS 25 2HD LYS 25 20.573 3.846 15.318 2534 HD3 LYS 25 1HD LYS 25 19.527 2.413 15.033 2535 HE2 LYS 25 2HE LYS 25 21.919 1.786 15.580 2536 HE3 LYS 25 1HE LYS 25 21.371 1.184 13.964 2537 HZ1 LYS 25 3HZ LYS 25 22.510 3.055 12.953 2538 HZ2 LYS 25 1HZ LYS 25 23.596 2.138 13.868 2539 HZ3 LYS 25 2HZ LYS 25 23.007 3.633 14.470 2540 H ALA 26 H ALA 26 16.033 6.220 14.123 2541 HA ALA 26 HA ALA 26 16.083 8.074 12.097 2542 HB1 ALA 26 1HB ALA 26 14.286 8.160 14.608 2543 HB2 ALA 26 2HB ALA 26 13.949 7.202 13.120 2544 HB3 ALA 26 3HB ALA 26 13.969 9.001 13.049 2545 H VAL 27 H VAL 27 16.509 8.701 15.647 2546 HA VAL 27 HA VAL 27 17.066 11.482 14.968 2547 HB VAL 27 HB VAL 27 17.276 11.820 17.429 2548 HG11 VAL 27 1HG1 VAL 27 15.240 12.301 16.060 2549 HG12 VAL 27 2HG1 VAL 27 14.792 11.726 17.708 2550 HG13 VAL 27 3HG1 VAL 27 14.658 10.615 16.293 2551 HG21 VAL 27 3HG2 VAL 27 17.841 9.425 18.080 2552 HG22 VAL 27 1HG2 VAL 27 16.200 8.899 17.549 2553 HG23 VAL 27 2HG2 VAL 27 16.377 10.039 18.924 2554 H GLU 28 H GLU 28 18.929 8.574 15.927 2555 HA GLU 28 HA GLU 28 21.264 10.081 16.578 2556 HB2 GLU 28 2HB GLU 28 20.886 7.119 15.846 2557 HB3 GLU 28 1HB GLU 28 22.468 7.821 16.333 2558 HG2 GLU 28 2HG GLU 28 21.633 8.381 18.565 2559 HG3 GLU 28 1HG GLU 28 19.993 7.750 18.165 2560 H ALA 29 H ALA 29 19.883 8.906 13.514 2561 HA ALA 29 HA ALA 29 22.457 8.987 12.242 2562 HB1 ALA 29 1HB ALA 29 21.361 8.470 10.197 2563 HB2 ALA 29 2HB ALA 29 19.723 8.788 10.905 2564 HB3 ALA 29 3HB ALA 29 20.708 7.388 11.462 2565 H GLU 30 H GLU 30 19.717 11.238 12.780 2566 HA GLU 30 HA GLU 30 20.593 13.145 10.911 2567 HB2 GLU 30 2HB GLU 30 19.028 13.376 13.514 2568 HB3 GLU 30 1HB GLU 30 19.423 14.834 12.500 2569 HG2 GLU 30 2HG GLU 30 18.109 13.945 10.605 2570 HG3 GLU 30 1HG GLU 30 17.638 12.507 11.599 2571 H ARG 31 H ARG 31 20.593 13.723 14.373 2572 HA ARG 31 HA ARG 31 21.157 16.042 14.546 2573 HB2 ARG 31 2HB ARG 31 22.989 14.415 16.343 2574 HB3 ARG 31 1HB ARG 31 22.267 16.037 16.644 2575 HG2 ARG 31 2HG ARG 31 19.937 14.759 16.310 2576 HG3 ARG 31 1HG ARG 31 20.924 13.282 16.570 2577 HD2 ARG 31 2HD ARG 31 20.464 15.633 18.517 2578 HD3 ARG 31 1HD ARG 31 19.924 13.932 18.732 2579 HE ARG 31 HE ARG 31 22.680 15.088 18.986 2580 HH11 ARG 31 1HH2 ARG 31 20.567 12.167 19.351 2581 HH12 ARG 31 2HH2 ARG 31 21.741 11.259 20.192 2582 HH21 ARG 31 1HH1 ARG 31 24.415 13.579 19.782 2583 HH22 ARG 31 2HH1 ARG 31 23.919 12.078 20.455 2584 H GLY 32 H GLY 32 22.081 17.248 12.974 2585 HA2 GLY 32 2HA GLY 32 24.354 18.352 12.805 2586 HA3 GLY 32 1HA GLY 32 24.840 16.701 12.222 2587 H ALA 33 H ALA 33 22.193 16.144 11.150 2588 HA ALA 33 HA ALA 33 22.659 16.530 8.606 2589 HB1 ALA 33 1HB ALA 33 19.861 16.291 9.863 2590 HB2 ALA 33 2HB ALA 33 20.959 14.932 9.431 2591 HB3 ALA 33 3HB ALA 33 20.239 15.945 8.141 2592 HA PRO 34 HA PRO 34 21.825 20.721 7.743 2593 HB2 PRO 34 2HB PRO 34 21.821 20.799 4.977 2594 HB3 PRO 34 1HB PRO 34 23.262 20.336 5.958 2595 HG2 PRO 34 2HG PRO 34 21.243 18.439 4.636 2596 HG3 PRO 34 1HG PRO 34 23.058 18.411 4.518 2597 HD2 PRO 34 2HD PRO 34 21.680 16.847 6.355 2598 HD3 PRO 34 1HD PRO 34 23.281 17.613 6.757 2599 H GLY 35 H GLY 35 19.660 21.027 8.693 2600 HA2 GLY 35 2HA GLY 35 17.804 22.401 7.881 2601 HA3 GLY 35 1HA GLY 35 17.459 21.052 6.710 2602 H ALA 36 H ALA 36 18.230 18.927 8.171 2603 HA ALA 36 HA ALA 36 17.611 17.392 9.547 2604 HB1 ALA 36 1HB ALA 36 17.025 17.812 11.895 2605 HB2 ALA 36 2HB ALA 36 16.742 19.555 11.539 2606 HB3 ALA 36 3HB ALA 36 18.403 18.850 11.414 2607 H ALA 37 H ALA 37 15.520 16.634 10.956 2608 HA ALA 37 HA ALA 37 13.067 17.654 9.718 2609 HB1 ALA 37 1HB ALA 37 14.149 14.777 9.257 2610 HB2 ALA 37 2HB ALA 37 13.957 16.038 7.994 2611 HB3 ALA 37 3HB ALA 37 12.500 15.361 8.797 2612 H LEU 38 H LEU 38 14.833 15.252 11.752 2613 HA LEU 38 HA LEU 38 12.327 14.583 13.108 2614 HB2 LEU 38 2HB LEU 38 14.892 13.032 12.552 2615 HB3 LEU 38 1HB LEU 38 13.760 12.505 13.816 2616 HG LEU 38 HG LEU 38 12.574 13.077 11.099 2617 HD11 LEU 38 1HD1 LEU 38 14.646 11.949 10.417 2618 HD12 LEU 38 2HD1 LEU 38 13.249 10.836 10.195 2619 HD13 LEU 38 3HD1 LEU 38 14.379 10.628 11.590 2620 HD21 LEU 38 3HD2 LEU 38 11.266 12.243 13.144 2621 HD22 LEU 38 1HD2 LEU 38 12.214 10.717 13.069 2622 HD23 LEU 38 2HD2 LEU 38 11.138 11.175 11.696 2623 H ILE 39 H ILE 39 15.432 16.058 13.583 2624 HA ILE 39 HA ILE 39 16.392 15.321 15.748 2625 HB ILE 39 HB ILE 39 17.006 17.772 16.450 2626 HG12 ILE 39 2HG1 ILE 39 15.754 18.276 13.669 2627 HG13 ILE 39 1HG1 ILE 39 14.971 18.733 15.209 2628 HG21 ILE 39 1HG2 ILE 39 18.411 16.088 15.195 2629 HG22 ILE 39 2HG2 ILE 39 18.707 17.791 14.679 2630 HG23 ILE 39 3HG2 ILE 39 17.717 16.687 13.658 2631 HD11 ILE 39 3HD ILE 39 17.733 19.753 14.240 2632 HD12 ILE 39 1HD ILE 39 16.203 20.679 14.186 2633 HD13 ILE 39 2HD ILE 39 16.923 20.225 15.778 2634 H SER 40 H SER 40 15.602 14.514 17.638 2635 HA SER 40 HA SER 40 14.667 16.221 19.624 2636 HB2 SER 40 2HB SER 40 12.489 16.130 18.199 2637 HB3 SER 40 1HB SER 40 12.507 14.359 18.361 2638 HG SER 40 1HG SER 40 11.125 15.283 19.841 2639 H TYR 41 H TYR 41 13.070 13.784 20.529 2640 HA TYR 41 HA TYR 41 14.678 11.502 20.301 2641 HB2 TYR 41 2HB TYR 41 15.225 13.158 22.727 2642 HB3 TYR 41 1HB TYR 41 14.608 11.524 23.174 2643 HD1 TYR 41 2HD TYR 41 15.630 9.523 21.694 2644 HD2 TYR 41 1HD TYR 41 17.563 13.289 22.455 2645 HE1 TYR 41 2HE TYR 41 17.805 8.500 21.193 2646 HE2 TYR 41 1HE TYR 41 19.747 12.274 21.974 2647 HH TYR 41 HH TYR 41 20.081 8.814 21.061 2648 HA PRO 42 HA PRO 42 11.038 10.265 22.793 2649 HB2 PRO 42 2HB PRO 42 8.899 12.025 23.469 2650 HB3 PRO 42 1HB PRO 42 10.298 11.634 24.535 2651 HG2 PRO 42 2HG PRO 42 9.988 14.030 22.643 2652 HG3 PRO 42 1HG PRO 42 10.537 14.034 24.369 2653 HD2 PRO 42 2HD PRO 42 12.348 14.107 22.325 2654 HD3 PRO 42 1HD PRO 42 12.671 13.031 23.757 2655 H ASP 43 H ASP 43 10.411 12.667 20.242 2656 HA ASP 43 HA ASP 43 8.173 11.130 19.310 2657 HB2 ASP 43 2HB ASP 43 8.334 12.830 17.289 2658 HB3 ASP 43 1HB ASP 43 7.529 13.201 18.839 2659 H ALA 44 H ALA 44 11.334 10.386 19.292 2660 HA ALA 44 HA ALA 44 11.745 9.586 16.625 2661 HB1 ALA 44 1HB ALA 44 12.759 8.302 19.252 2662 HB2 ALA 44 2HB ALA 44 13.593 9.599 18.323 2663 HB3 ALA 44 3HB ALA 44 13.384 7.974 17.598 2664 H ILE 45 H ILE 45 10.407 7.863 19.499 2665 HA ILE 45 HA ILE 45 9.736 5.579 17.907 2666 HB ILE 45 HB ILE 45 10.658 5.446 20.184 2667 HG12 ILE 45 2HG1 ILE 45 7.880 4.144 20.016 2668 HG13 ILE 45 1HG1 ILE 45 9.335 3.593 19.122 2669 HG21 ILE 45 1HG2 ILE 45 7.923 6.541 21.128 2670 HG22 ILE 45 2HG2 ILE 45 9.479 7.455 21.164 2671 HG23 ILE 45 3HG2 ILE 45 9.284 5.984 22.163 2672 HD11 ILE 45 3HD ILE 45 9.080 3.741 22.206 2673 HD12 ILE 45 1HD ILE 45 9.044 2.254 21.190 2674 HD13 ILE 45 2HD ILE 45 10.549 3.233 21.296 2675 H TRP 46 H TRP 46 8.330 8.553 18.233 2676 HA TRP 46 HA TRP 46 5.601 7.495 18.077 2677 HB2 TRP 46 2HB TRP 46 6.512 9.708 19.425 2678 HB3 TRP 46 1HB TRP 46 6.049 10.480 17.876 2679 HD1 TRP 46 HD TRP 46 3.406 11.181 18.008 2680 HE1 TRP 46 1HE TRP 46 1.477 10.571 19.581 2681 HE3 TRP 46 3HE TRP 46 5.658 7.361 20.552 2682 HZ2 TRP 46 2HZ TRP 46 0.961 8.682 21.659 2683 HZ3 TRP 46 3HZ TRP 46 4.435 6.255 22.384 2684 HH2 TRP 46 HH TRP 46 2.135 6.938 22.954 2685 H TRP 47 H TRP 47 8.205 8.999 16.089 2686 HA TRP 47 HA TRP 47 6.382 9.190 13.848 2687 HB2 TRP 47 2HB TRP 47 8.312 10.790 14.014 2688 HB3 TRP 47 1HB TRP 47 9.456 9.407 13.907 2689 HD1 TRP 47 HD TRP 47 6.433 10.740 11.721 2690 HE1 TRP 47 1HE TRP 47 6.960 10.261 9.263 2691 HE3 TRP 47 3HE TRP 47 10.910 8.406 12.351 2692 HZ2 TRP 47 2HZ TRP 47 9.146 9.196 7.737 2693 HZ3 TRP 47 3HZ TRP 47 12.142 7.592 10.368 2694 HH2 TRP 47 HH TRP 47 11.263 7.978 8.091 2695 H SER 48 H SER 48 8.654 6.845 15.256 2696 HA SER 48 HA SER 48 8.724 5.238 12.894 2697 HB2 SER 48 2HB SER 48 10.481 5.390 14.845 2698 HB3 SER 48 1HB SER 48 9.404 4.260 15.724 2699 HG SER 48 1HG SER 48 10.897 3.096 14.651 2700 H VAL 49 H VAL 49 6.200 5.592 12.909 2701 HA VAL 49 HA VAL 49 4.908 3.228 14.081 2702 HB VAL 49 HB VAL 49 3.895 6.144 14.071 2703 HG11 VAL 49 1HG1 VAL 49 1.998 4.570 13.557 2704 HG12 VAL 49 2HG1 VAL 49 1.853 5.224 15.218 2705 HG13 VAL 49 3HG1 VAL 49 2.453 3.549 14.970 2706 HG21 VAL 49 3HG2 VAL 49 3.836 5.806 16.578 2707 HG22 VAL 49 1HG2 VAL 49 5.495 5.713 15.904 2708 HG23 VAL 49 2HG2 VAL 49 4.644 4.203 16.359 2709 H GLU 50 H GLU 50 3.906 6.114 11.997 2710 HA GLU 50 HA GLU 50 2.464 4.255 10.446 2711 HB2 GLU 50 2HB GLU 50 1.699 6.155 9.093 2712 HB3 GLU 50 1HB GLU 50 1.423 6.399 10.833 2713 HG2 GLU 50 2HG GLU 50 3.940 7.628 9.513 2714 HG3 GLU 50 1HG GLU 50 2.317 8.378 9.317 2715 H THR 51 H THR 51 5.695 5.123 10.312 2716 HA THR 51 HA THR 51 5.873 4.999 7.434 2717 HB THR 51 HB THR 51 7.354 6.448 8.763 2718 HG1 THR 51 1HG THR 51 8.530 4.459 7.132 2719 HG21 THR 51 3HG2 THR 51 9.317 5.494 9.925 2720 HG22 THR 51 1HG2 THR 51 8.714 3.817 9.660 2721 HG23 THR 51 2HG2 THR 51 7.797 4.961 10.709 2722 H ALA 52 H ALA 52 5.567 2.702 10.042 2723 HA ALA 52 HA ALA 52 6.879 0.555 8.613 2724 HB1 ALA 52 1HB ALA 52 6.694 0.448 11.075 2725 HB2 ALA 52 2HB ALA 52 5.764 -0.901 10.332 2726 HB3 ALA 52 3HB ALA 52 4.893 0.540 10.979 2727 H THR 53 H THR 53 3.588 2.008 8.939 2728 HA THR 53 HA THR 53 2.457 -0.089 7.310 2729 HB THR 53 HB THR 53 0.365 1.413 7.717 2730 HG1 THR 53 1HG THR 53 1.209 3.251 8.447 2731 HG21 THR 53 3HG2 THR 53 0.152 0.491 10.041 2732 HG22 THR 53 1HG2 THR 53 1.917 0.123 10.082 2733 HG23 THR 53 2HG2 THR 53 0.838 -0.736 8.918 2734 H THR 54 H THR 54 4.539 2.027 6.401 2735 HA THR 54 HA THR 54 5.028 3.158 4.614 2736 HB THR 54 HB THR 54 4.330 2.170 2.431 2737 HG1 THR 54 1HG THR 54 2.234 1.551 3.230 2738 HG21 THR 54 3HG2 THR 54 6.230 1.296 3.857 2739 HG22 THR 54 1HG2 THR 54 5.428 0.004 2.899 2740 HG23 THR 54 2HG2 THR 54 5.098 0.147 4.664 2741 H VAL 55 H VAL 55 3.429 4.908 5.877 2742 HA VAL 55 HA VAL 55 1.883 6.035 3.612 2743 HB VAL 55 HB VAL 55 1.203 6.356 6.596 2744 HG11 VAL 55 1HG1 VAL 55 -0.233 7.148 3.965 2745 HG12 VAL 55 2HG1 VAL 55 0.527 8.299 5.116 2746 HG13 VAL 55 3HG1 VAL 55 -0.910 7.345 5.623 2747 HG21 VAL 55 3HG2 VAL 55 -0.843 4.944 5.900 2748 HG22 VAL 55 1HG2 VAL 55 0.707 4.043 6.005 2749 HG23 VAL 55 2HG2 VAL 55 0.050 4.522 4.396 2750 H GLY 56 H GLY 56 3.316 6.949 6.832 2751 HA2 GLY 56 2HA GLY 56 4.945 8.486 7.179 2752 HA3 GLY 56 1HA GLY 56 4.907 8.969 5.440 2753 H TYR 57 H TYR 57 2.351 9.614 4.982 2754 HA TYR 57 HA TYR 57 0.670 10.920 5.199 2755 HB2 TYR 57 2HB TYR 57 0.647 9.997 7.735 2756 HB3 TYR 57 1HB TYR 57 1.089 11.690 8.133 2757 HD1 TYR 57 2HD TYR 57 -0.499 13.556 7.336 2758 HD2 TYR 57 1HD TYR 57 -1.554 9.395 7.058 2759 HE1 TYR 57 2HE TYR 57 -2.830 14.172 6.896 2760 HE2 TYR 57 1HE TYR 57 -3.901 10.015 6.652 2761 HH TYR 57 HH TYR 57 -5.447 11.827 6.584 2762 H GLY 58 H GLY 58 3.752 11.934 6.266 2763 HA2 GLY 58 2HA GLY 58 4.799 13.699 5.090 2764 HA3 GLY 58 1HA GLY 58 3.272 14.655 5.222 2765 H ASP 59 H ASP 59 4.304 12.646 7.977 2766 HA ASP 59 HA ASP 59 4.353 14.960 9.567 2767 HB2 ASP 59 2HB ASP 59 3.835 12.541 10.400 2768 HB3 ASP 59 1HB ASP 59 5.605 12.313 10.494 2769 H ARG 60 H ARG 60 7.128 12.689 8.821 2770 HA ARG 60 HA ARG 60 8.880 15.030 9.103 2771 HB2 ARG 60 2HB ARG 60 9.548 12.184 10.055 2772 HB3 ARG 60 1HB ARG 60 10.575 13.647 10.234 2773 HG2 ARG 60 2HG ARG 60 7.829 13.193 11.566 2774 HG3 ARG 60 1HG ARG 60 9.391 12.859 12.352 2775 HD2 ARG 60 2HD ARG 60 9.997 15.281 12.333 2776 HD3 ARG 60 1HD ARG 60 8.523 15.662 11.361 2777 HE ARG 60 HE ARG 60 7.100 15.031 13.116 2778 HH11 ARG 60 1HH2 ARG 60 10.578 14.737 14.233 2779 HH12 ARG 60 2HH2 ARG 60 10.150 14.873 15.908 2780 HH21 ARG 60 1HH1 ARG 60 6.782 15.720 15.504 2781 HH22 ARG 60 2HH1 ARG 60 8.111 15.408 16.579 2782 H TYR 61 H TYR 61 10.988 14.625 7.939 2783 HA TYR 61 HA TYR 61 10.655 12.866 5.637 2784 HB2 TYR 61 2HB TYR 61 11.452 15.030 4.268 2785 HB3 TYR 61 1HB TYR 61 9.724 14.692 4.583 2786 HD1 TYR 61 2HD TYR 61 8.407 15.993 6.140 2787 HD2 TYR 61 1HD TYR 61 12.548 16.952 5.488 2788 HE1 TYR 61 2HE TYR 61 8.077 18.147 7.263 2789 HE2 TYR 61 1HE TYR 61 12.229 19.112 6.616 2790 HH TYR 61 HH TYR 61 9.303 19.884 8.391 2791 HA PRO 62 HA PRO 62 14.900 13.050 7.433 2792 HB2 PRO 62 2HB PRO 62 15.740 10.445 6.629 2793 HB3 PRO 62 1HB PRO 62 14.860 10.833 8.141 2794 HG2 PRO 62 2HG PRO 62 13.665 9.817 5.514 2795 HG3 PRO 62 1HG PRO 62 13.326 9.281 7.221 2796 HD2 PRO 62 2HD PRO 62 11.667 11.040 5.901 2797 HD3 PRO 62 1HD PRO 62 12.031 11.264 7.676 2798 H VAL 63 H VAL 63 17.113 13.167 6.452 2799 HA VAL 63 HA VAL 63 16.915 13.540 3.536 2800 HB VAL 63 HB VAL 63 17.116 15.482 5.130 2801 HG11 VAL 63 1HG1 VAL 63 20.119 14.766 5.187 2802 HG12 VAL 63 2HG1 VAL 63 18.962 14.589 6.558 2803 HG13 VAL 63 3HG1 VAL 63 19.301 16.210 5.874 2804 HG21 VAL 63 3HG2 VAL 63 19.054 15.380 2.727 2805 HG22 VAL 63 1HG2 VAL 63 18.328 16.824 3.504 2806 HG23 VAL 63 2HG2 VAL 63 17.271 15.635 2.662 2807 H THR 64 H THR 64 19.785 13.880 3.116 2808 HA THR 64 HA THR 64 20.392 11.272 2.347 2809 HB THR 64 HB THR 64 22.589 12.683 1.727 2810 HG1 THR 64 1HG THR 64 22.231 14.861 1.797 2811 HG21 THR 64 3HG2 THR 64 19.775 13.375 0.603 2812 HG22 THR 64 1HG2 THR 64 20.846 12.028 0.070 2813 HG23 THR 64 2HG2 THR 64 21.347 13.728 -0.206 2814 H GLU 65 H GLU 65 21.788 13.569 4.687 2815 HA GLU 65 HA GLU 65 23.999 11.988 5.208 2816 HB2 GLU 65 2HB GLU 65 23.775 14.528 5.594 2817 HB3 GLU 65 1HB GLU 65 22.980 14.129 7.156 2818 HG2 GLU 65 2HG GLU 65 25.081 12.872 7.846 2819 HG3 GLU 65 1HG GLU 65 25.818 13.270 6.252 2820 H GLU 66 H GLU 66 20.793 12.029 6.746 2821 HA GLU 66 HA GLU 66 21.662 10.360 8.912 2822 HB2 GLU 66 2HB GLU 66 19.157 10.227 9.377 2823 HB3 GLU 66 1HB GLU 66 19.868 11.866 9.369 2824 HG2 GLU 66 2HG GLU 66 19.074 12.080 6.895 2825 HG3 GLU 66 1HG GLU 66 18.131 10.571 7.188 2826 H GLY 67 H GLY 67 21.418 9.853 5.681 2827 HA2 GLY 67 2HA GLY 67 21.350 8.057 4.415 2828 HA3 GLY 67 1HA GLY 67 21.308 7.040 5.924 2829 H ARG 68 H ARG 68 19.203 9.176 3.833 2830 HA ARG 68 HA ARG 68 16.843 8.808 5.007 2831 HB2 ARG 68 2HB ARG 68 17.058 10.210 2.977 2832 HB3 ARG 68 1HB ARG 68 17.264 8.733 1.962 2833 HG2 ARG 68 2HG ARG 68 14.935 8.104 2.304 2834 HG3 ARG 68 1HG ARG 68 14.686 9.399 3.515 2835 HD2 ARG 68 2HD ARG 68 15.371 9.924 0.516 2836 HD3 ARG 68 1HD ARG 68 13.692 9.879 1.197 2837 HE ARG 68 HE ARG 68 14.977 11.655 2.888 2838 HH11 ARG 68 1HH2 ARG 68 13.420 11.805 -0.369 2839 HH12 ARG 68 2HH2 ARG 68 14.011 13.308 -0.699 2840 HH21 ARG 68 1HH1 ARG 68 14.589 13.854 2.742 2841 HH22 ARG 68 2HH1 ARG 68 14.082 14.610 1.283 2842 H LYS 69 H LYS 69 18.604 6.362 3.375 2843 HA LYS 69 HA LYS 69 16.903 4.245 3.071 2844 HB2 LYS 69 2HB LYS 69 19.749 4.514 4.185 2845 HB3 LYS 69 1HB LYS 69 18.976 2.903 4.059 2846 HG2 LYS 69 2HG LYS 69 19.372 4.740 1.616 2847 HG3 LYS 69 1HG LYS 69 20.504 3.454 2.156 2848 HD2 LYS 69 2HD LYS 69 18.518 1.821 2.121 2849 HD3 LYS 69 1HD LYS 69 17.584 3.082 1.256 2850 HE2 LYS 69 2HE LYS 69 19.186 3.005 -0.658 2851 HE3 LYS 69 1HE LYS 69 20.237 1.839 0.246 2852 HZ1 LYS 69 3HZ LYS 69 18.362 0.283 0.262 2853 HZ2 LYS 69 1HZ LYS 69 18.790 0.702 -1.323 2854 HZ3 LYS 69 2HZ LYS 69 17.392 1.359 -0.543 2855 H VAL 70 H VAL 70 17.689 5.823 6.191 2856 HA VAL 70 HA VAL 70 17.060 3.669 7.843 2857 HB VAL 70 HB VAL 70 16.882 6.685 8.268 2858 HG11 VAL 70 1HG1 VAL 70 16.707 6.153 10.734 2859 HG12 VAL 70 2HG1 VAL 70 16.415 4.419 10.337 2860 HG13 VAL 70 3HG1 VAL 70 15.228 5.683 9.841 2861 HG21 VAL 70 3HG2 VAL 70 19.183 5.646 7.968 2862 HG22 VAL 70 1HG2 VAL 70 18.825 4.498 9.309 2863 HG23 VAL 70 2HG2 VAL 70 18.928 6.272 9.621 2864 H ALA 71 H ALA 71 14.977 6.122 6.259 2865 HA ALA 71 HA ALA 71 12.572 5.223 7.487 2866 HB1 ALA 71 1HB ALA 71 12.722 7.469 6.373 2867 HB2 ALA 71 2HB ALA 71 11.434 6.470 5.631 2868 HB3 ALA 71 3HB ALA 71 13.011 6.672 4.785 2869 H GLU 72 H GLU 72 14.320 4.482 4.483 2870 HA GLU 72 HA GLU 72 12.428 2.899 3.221 2871 HB2 GLU 72 2HB GLU 72 14.686 3.704 2.200 2872 HB3 GLU 72 1HB GLU 72 15.451 2.364 3.116 2873 HG2 GLU 72 2HG GLU 72 13.663 0.835 1.799 2874 HG3 GLU 72 1HG GLU 72 13.562 2.256 0.700 2875 H GLN 73 H GLN 73 14.934 2.061 5.594 2876 HA GLN 73 HA GLN 73 14.679 -0.682 5.471 2877 HB2 GLN 73 2HB GLN 73 16.537 0.658 6.570 2878 HB3 GLN 73 1HB GLN 73 15.436 0.982 7.948 2879 HG2 GLN 73 2HG GLN 73 15.345 -1.506 8.435 2880 HG3 GLN 73 1HG GLN 73 16.354 -1.820 6.979 2881 HE21 GLN 73 1HE2 GLN 73 16.376 -0.034 10.159 2882 HE22 GLN 73 2HE2 GLN 73 18.074 -0.159 10.411 2883 H VAL 74 H VAL 74 12.818 1.697 7.451 2884 HA VAL 74 HA VAL 74 11.593 -0.315 9.024 2885 HB VAL 74 HB VAL 74 10.228 2.362 8.503 2886 HG11 VAL 74 1HG1 VAL 74 9.088 0.628 9.941 2887 HG12 VAL 74 2HG1 VAL 74 9.608 2.044 10.924 2888 HG13 VAL 74 3HG1 VAL 74 10.555 0.517 10.982 2889 HG21 VAL 74 3HG2 VAL 74 11.692 3.250 10.421 2890 HG22 VAL 74 1HG2 VAL 74 12.485 3.094 8.827 2891 HG23 VAL 74 2HG2 VAL 74 12.808 1.866 10.112 2892 H MET 75 H MET 75 10.718 1.436 6.038 2893 HA MET 75 HA MET 75 8.125 0.439 5.773 2894 HB2 MET 75 2HB MET 75 10.142 1.302 3.606 2895 HB3 MET 75 1HB MET 75 8.420 0.901 3.285 2896 HG2 MET 75 2HG MET 75 7.758 2.667 4.977 2897 HG3 MET 75 1HG MET 75 9.454 3.224 5.026 2898 HE1 MET 75 3HE MET 75 10.633 4.525 3.258 2899 HE2 MET 75 1HE MET 75 10.103 4.745 1.557 2900 HE3 MET 75 2HE MET 75 10.560 3.114 2.134 2901 H LYS 76 H LYS 76 11.272 -0.842 4.510 2902 HA LYS 76 HA LYS 76 9.965 -2.877 3.087 2903 HB2 LYS 76 2HB LYS 76 12.280 -2.149 2.562 2904 HB3 LYS 76 1HB LYS 76 12.875 -2.982 4.038 2905 HG2 LYS 76 2HG LYS 76 12.267 -5.171 3.146 2906 HG3 LYS 76 1HG LYS 76 11.167 -4.439 1.936 2907 HD2 LYS 76 2HD LYS 76 13.113 -3.430 0.738 2908 HD3 LYS 76 1HD LYS 76 14.246 -4.290 1.829 2909 HE2 LYS 76 2HE LYS 76 12.089 -5.686 0.057 2910 HE3 LYS 76 1HE LYS 76 13.805 -5.413 -0.433 2911 HZ1 LYS 76 3HZ LYS 76 14.423 -6.701 1.599 2912 HZ2 LYS 76 1HZ LYS 76 13.717 -7.522 0.311 2913 HZ3 LYS 76 2HZ LYS 76 12.792 -7.254 1.707 2914 H ALA 77 H ALA 77 11.165 -2.783 6.442 2915 HA ALA 77 HA ALA 77 10.772 -5.535 6.964 2916 HB1 ALA 77 1HB ALA 77 12.037 -4.046 8.554 2917 HB2 ALA 77 2HB ALA 77 10.659 -4.857 9.383 2918 HB3 ALA 77 3HB ALA 77 10.524 -3.129 8.888 2919 H GLY 78 H GLY 78 8.653 -2.648 7.237 2920 HA2 GLY 78 2HA GLY 78 6.447 -3.890 8.373 2921 HA3 GLY 78 1HA GLY 78 6.474 -2.402 7.354 2922 H ILE 79 H ILE 79 7.189 -3.310 4.902 2923 HA ILE 79 HA ILE 79 4.839 -4.350 3.873 2924 HB ILE 79 HB ILE 79 7.665 -4.266 2.715 2925 HG12 ILE 79 2HG1 ILE 79 5.180 -2.538 2.092 2926 HG13 ILE 79 1HG1 ILE 79 6.414 -2.074 3.289 2927 HG21 ILE 79 1HG2 ILE 79 6.409 -6.050 1.478 2928 HG22 ILE 79 2HG2 ILE 79 6.577 -4.604 0.445 2929 HG23 ILE 79 3HG2 ILE 79 5.008 -4.934 1.264 2930 HD11 ILE 79 3HD ILE 79 6.912 -2.483 0.264 2931 HD12 ILE 79 1HD ILE 79 6.868 -0.928 1.162 2932 HD13 ILE 79 2HD ILE 79 8.189 -2.109 1.485 2933 H GLU 80 H GLU 80 7.968 -6.063 4.574 2934 HA GLU 80 HA GLU 80 6.946 -8.486 3.547 2935 HB2 GLU 80 2HB GLU 80 9.342 -8.095 5.417 2936 HB3 GLU 80 1HB GLU 80 8.857 -9.632 4.626 2937 HG2 GLU 80 2HG GLU 80 9.052 -8.368 2.349 2938 HG3 GLU 80 1HG GLU 80 9.868 -7.056 3.268 2939 H VAL 81 H VAL 81 6.778 -7.025 6.795 2940 HA VAL 81 HA VAL 81 5.931 -9.398 8.082 2941 HB VAL 81 HB VAL 81 5.745 -6.439 8.754 2942 HG11 VAL 81 1HG1 VAL 81 3.711 -7.373 9.792 2943 HG12 VAL 81 2HG1 VAL 81 4.952 -7.185 11.065 2944 HG13 VAL 81 3HG1 VAL 81 4.614 -8.817 10.386 2945 HG21 VAL 81 3HG2 VAL 81 7.447 -7.110 10.451 2946 HG22 VAL 81 1HG2 VAL 81 7.975 -7.699 8.842 2947 HG23 VAL 81 2HG2 VAL 81 7.248 -8.844 10.020 2948 H PHE 82 H PHE 82 4.031 -6.591 6.724 2949 HA PHE 82 HA PHE 82 1.603 -7.839 7.461 2950 HB2 PHE 82 2HB PHE 82 2.097 -5.648 5.344 2951 HB3 PHE 82 1HB PHE 82 0.465 -6.168 5.924 2952 HD1 PHE 82 2HD PHE 82 0.449 -6.392 8.709 2953 HD2 PHE 82 1HD PHE 82 2.797 -3.653 6.356 2954 HE1 PHE 82 2HE PHE 82 0.672 -4.909 10.654 2955 HE2 PHE 82 1HE PHE 82 3.000 -2.163 8.306 2956 HZ PHE 82 HZ PHE 82 1.935 -2.774 10.464 2957 H ALA 83 H ALA 83 3.590 -8.050 4.537 2958 HA ALA 83 HA ALA 83 1.732 -9.516 3.018 2959 HB1 ALA 83 1HB ALA 83 4.812 -9.679 2.976 2960 HB2 ALA 83 2HB ALA 83 3.819 -8.518 2.026 2961 HB3 ALA 83 3HB ALA 83 3.701 -10.280 1.685 2962 H LEU 84 H LEU 84 4.188 -10.510 5.476 2963 HA LEU 84 HA LEU 84 4.018 -13.249 4.977 2964 HB2 LEU 84 2HB LEU 84 5.861 -12.062 6.243 2965 HB3 LEU 84 1HB LEU 84 4.760 -11.882 7.636 2966 HG LEU 84 HG LEU 84 6.510 -13.632 7.829 2967 HD11 LEU 84 1HD1 LEU 84 4.314 -13.847 9.131 2968 HD12 LEU 84 2HD1 LEU 84 5.279 -15.354 8.926 2969 HD13 LEU 84 3HD1 LEU 84 3.815 -15.094 7.931 2970 HD21 LEU 84 3HD2 LEU 84 6.615 -14.414 5.459 2971 HD22 LEU 84 1HD2 LEU 84 5.024 -15.244 5.656 2972 HD23 LEU 84 2HD2 LEU 84 6.436 -15.779 6.618 2973 H VAL 85 H VAL 85 2.203 -11.131 7.213 2974 HA VAL 85 HA VAL 85 0.863 -13.072 8.642 2975 HB VAL 85 HB VAL 85 0.003 -10.262 7.816 2976 HG11 VAL 85 1HG1 VAL 85 -1.574 -10.369 9.799 2977 HG12 VAL 85 2HG1 VAL 85 -1.261 -12.138 9.937 2978 HG13 VAL 85 3HG1 VAL 85 -2.074 -11.467 8.471 2979 HG21 VAL 85 3HG2 VAL 85 0.783 -9.700 10.132 2980 HG22 VAL 85 1HG2 VAL 85 2.123 -10.480 9.231 2981 HG23 VAL 85 2HG2 VAL 85 1.197 -11.425 10.439 2982 H THR 86 H THR 86 0.451 -12.187 5.292 2983 HA THR 86 HA THR 86 -2.119 -13.114 4.898 2984 HB THR 86 HB THR 86 0.055 -13.319 2.786 2985 HG1 THR 86 1HG THR 86 0.331 -11.358 3.441 2986 HG21 THR 86 3HG2 THR 86 -2.979 -12.625 2.724 2987 HG22 THR 86 1HG2 THR 86 -2.230 -14.150 2.122 2988 HG23 THR 86 2HG2 THR 86 -1.872 -12.598 1.302 2989 H ALA 87 H ALA 87 0.663 -15.015 5.794 2990 HA ALA 87 HA ALA 87 0.005 -17.455 4.607 2991 HB1 ALA 87 1HB ALA 87 1.069 -16.912 7.466 2992 HB2 ALA 87 2HB ALA 87 2.082 -17.031 5.993 2993 HB3 ALA 87 3HB ALA 87 1.186 -18.480 6.577 2994 H ALA 88 H ALA 88 -1.273 -15.850 7.538 2995 HA ALA 88 HA ALA 88 -2.867 -18.086 8.358 2996 HB1 ALA 88 1HB ALA 88 -3.034 -15.103 9.148 2997 HB2 ALA 88 2HB ALA 88 -2.166 -16.386 10.067 2998 HB3 ALA 88 3HB ALA 88 -3.961 -16.428 9.934 2999 H LEU 89 H LEU 89 -3.245 -15.167 6.382 3000 HA LEU 89 HA LEU 89 -6.084 -15.457 6.211 3001 HB2 LEU 89 2HB LEU 89 -4.227 -13.735 4.485 3002 HB3 LEU 89 1HB LEU 89 -5.994 -13.521 4.717 3003 HG LEU 89 HG LEU 89 -3.868 -13.270 6.956 3004 HD11 LEU 89 1HD1 LEU 89 -5.355 -11.031 5.483 3005 HD12 LEU 89 2HD1 LEU 89 -3.623 -11.461 5.247 3006 HD13 LEU 89 3HD1 LEU 89 -4.190 -10.843 6.838 3007 HD21 LEU 89 3HD2 LEU 89 -6.881 -12.577 6.971 3008 HD22 LEU 89 1HD2 LEU 89 -5.704 -12.219 8.288 3009 HD23 LEU 89 2HD2 LEU 89 -6.094 -13.922 7.877 3010 H ALA 90 H ALA 90 -3.308 -16.506 4.257 3011 HA ALA 90 HA ALA 90 -4.814 -17.055 1.952 3012 HB1 ALA 90 1HB ALA 90 -2.093 -18.199 2.807 3013 HB2 ALA 90 2HB ALA 90 -2.360 -16.724 1.815 3014 HB3 ALA 90 3HB ALA 90 -2.829 -18.329 1.157 3015 H THR 91 H THR 91 -4.276 -18.883 4.941 3016 HA THR 91 HA THR 91 -5.189 -21.305 3.661 3017 HB THR 91 HB THR 91 -3.621 -21.530 5.484 3018 HG1 THR 91 1HG THR 91 -6.203 -22.565 5.801 3019 HG21 THR 91 3HG2 THR 91 -4.405 -21.202 7.862 3020 HG22 THR 91 1HG2 THR 91 -5.818 -20.269 7.246 3021 HG23 THR 91 2HG2 THR 91 -4.137 -19.687 6.942 3022 H ASP 92 H ASP 92 -6.855 -18.393 4.411 3023 HA ASP 92 HA ASP 92 -9.077 -19.765 5.600 3024 HB2 ASP 92 2HB ASP 92 -8.690 -16.846 4.891 3025 HB3 ASP 92 1HB ASP 92 -10.332 -17.516 5.209 3026 H PHE 93 H PHE 93 -8.091 -19.389 2.288 3027 HA PHE 93 HA PHE 93 -10.830 -19.958 1.475 3028 HB2 PHE 93 2HB PHE 93 -10.294 -19.983 -0.738 3029 HB3 PHE 93 1HB PHE 93 -9.232 -18.693 -0.093 3030 HD1 PHE 93 1HD PHE 93 -6.772 -19.148 0.117 3031 HD2 PHE 93 2HD PHE 93 -9.412 -22.033 -1.663 3032 HE1 PHE 93 1HE PHE 93 -4.834 -20.315 -0.864 3033 HE2 PHE 93 2HE PHE 93 -7.471 -23.196 -2.655 3034 HZ PHE 93 HZ PHE 93 -5.184 -22.336 -2.274 3035 H VAL 94 H VAL 94 -8.288 -21.703 2.957 3036 HA VAL 94 HA VAL 94 -9.044 -24.219 1.699 3037 HB VAL 94 HB VAL 94 -6.934 -23.809 3.860 3038 HG11 VAL 94 1HG1 VAL 94 -6.051 -25.939 2.778 3039 HG12 VAL 94 2HG1 VAL 94 -7.483 -25.968 1.694 3040 HG13 VAL 94 3HG1 VAL 94 -7.698 -26.169 3.469 3041 HG21 VAL 94 3HG2 VAL 94 -5.312 -23.727 1.908 3042 HG22 VAL 94 1HG2 VAL 94 -6.359 -22.276 1.955 3043 HG23 VAL 94 2HG2 VAL 94 -6.700 -23.589 0.775 3044 H ARG 95 H ARG 95 -9.300 -22.367 4.712 3045 HA ARG 95 HA ARG 95 -10.296 -24.313 6.397 3046 HB2 ARG 95 2HB ARG 95 -9.474 -21.934 6.956 3047 HB3 ARG 95 1HB ARG 95 -11.036 -21.315 6.339 3048 HG2 ARG 95 2HG ARG 95 -12.211 -22.663 8.152 3049 HG3 ARG 95 1HG ARG 95 -10.609 -23.159 8.786 3050 HD2 ARG 95 2HD ARG 95 -11.631 -20.235 8.526 3051 HD3 ARG 95 1HD ARG 95 -11.678 -21.186 10.048 3052 HE ARG 95 HE ARG 95 -9.410 -19.855 8.724 3053 HH11 ARG 95 1HH2 ARG 95 -10.421 -22.185 11.276 3054 HH12 ARG 95 2HH2 ARG 95 -9.049 -22.047 12.263 3055 HH21 ARG 95 1HH1 ARG 95 -7.516 -19.494 10.149 3056 HH22 ARG 95 2HH1 ARG 95 -7.414 -20.215 11.694 3057 H ARG 96 H ARG 96 -11.842 -22.824 3.673 3058 HA ARG 96 HA ARG 96 -14.532 -22.970 4.468 3059 HB2 ARG 96 2HB ARG 96 -15.119 -22.688 2.129 3060 HB3 ARG 96 1HB ARG 96 -13.610 -21.741 2.381 3061 HG2 ARG 96 2HG ARG 96 -12.327 -23.816 1.522 3062 HG3 ARG 96 1HG ARG 96 -13.911 -24.533 1.079 3063 HD2 ARG 96 2HD ARG 96 -14.356 -22.703 -0.528 3064 HD3 ARG 96 1HD ARG 96 -12.745 -21.956 -0.152 3065 HE ARG 96 HE ARG 96 -11.691 -24.149 -0.784 3066 HH11 ARG 96 1HH2 ARG 96 -14.841 -23.260 -2.334 3067 HH12 ARG 96 2HH2 ARG 96 -14.860 -24.530 -3.432 3068 HH21 ARG 96 1HH1 ARG 96 -11.712 -26.001 -2.244 3069 HH22 ARG 96 2HH1 ARG 96 -12.892 -26.099 -3.473 3070 H GLU 97 H GLU 97 -12.248 -25.428 3.679 3071 HA GLU 97 HA GLU 97 -13.952 -27.240 2.320 3072 HB2 GLU 97 2HB GLU 97 -11.418 -26.821 2.090 3073 HB3 GLU 97 1HB GLU 97 -11.190 -27.635 3.662 3074 HG2 GLU 97 2HG GLU 97 -11.859 -29.803 2.676 3075 HG3 GLU 97 1HG GLU 97 -12.444 -28.981 1.176 3076 H GLU 98 H GLU 98 -15.099 -28.915 3.276 3077 HA GLU 98 HA GLU 98 -16.212 -30.017 4.712 3078 HB2 GLU 98 2HB GLU 98 -14.151 -29.590 6.907 3079 HB3 GLU 98 1HB GLU 98 -15.543 -30.715 6.898 3080 HG2 GLU 98 2HG GLU 98 -14.245 -31.431 4.509 3081 HG3 GLU 98 1HG GLU 98 -12.849 -30.939 5.527 3082 H GLU 99 H GLU 99 -15.207 -26.835 5.736 3083 HA GLU 99 HA GLU 99 -17.188 -26.586 7.703 3084 HB2 GLU 99 2HB GLU 99 -14.872 -25.350 7.440 3085 HB3 GLU 99 1HB GLU 99 -15.765 -24.208 6.398 3086 HG2 GLU 99 2HG GLU 99 -15.671 -23.333 8.701 3087 HG3 GLU 99 1HG GLU 99 -17.378 -23.817 8.375 3088 H ARG 100 H ARG 100 -16.991 -25.280 4.279 3089 HA ARG 100 HA ARG 100 -19.370 -23.817 4.776 3090 HB2 ARG 100 2HB ARG 100 -19.461 -22.990 2.646 3091 HB3 ARG 100 1HB ARG 100 -17.744 -22.985 3.110 3092 HG2 ARG 100 2HG ARG 100 -17.268 -24.829 1.545 3093 HG3 ARG 100 1HG ARG 100 -19.027 -25.158 1.318 3094 HD2 ARG 100 2HD ARG 100 -19.346 -22.824 0.362 3095 HD3 ARG 100 1HD ARG 100 -17.571 -22.582 0.431 3096 HE ARG 100 HE ARG 100 -17.289 -24.028 -1.401 3097 HH11 ARG 100 1HH2 ARG 100 -20.815 -23.732 -0.630 3098 HH12 ARG 100 2HH2 ARG 100 -21.329 -24.850 -1.774 3099 HH21 ARG 100 1HH1 ARG 100 -18.072 -25.093 -3.354 3100 HH22 ARG 100 2HH1 ARG 100 -19.736 -25.388 -3.566 3101 H ARG 101 H ARG 101 -19.139 -27.048 4.534 3102 HA ARG 101 HA ARG 101 -21.562 -27.631 3.087 3103 HB2 ARG 101 2HB ARG 101 -20.163 -29.188 5.369 3104 HB3 ARG 101 1HB ARG 101 -21.542 -29.796 4.386 3105 HG2 ARG 101 2HG ARG 101 -20.097 -29.761 2.343 3106 HG3 ARG 101 1HG ARG 101 -18.709 -29.187 3.342 3107 HD2 ARG 101 2HD ARG 101 -18.871 -31.266 4.760 3108 HD3 ARG 101 1HD ARG 101 -20.233 -31.870 3.728 3109 HE ARG 101 HE ARG 101 -18.670 -31.847 1.761 3110 HH11 ARG 101 1HH2 ARG 101 -17.458 -32.684 5.098 3111 HH12 ARG 101 2HH2 ARG 101 -15.926 -33.106 4.582 3112 HH21 ARG 101 1HH1 ARG 101 -16.571 -32.787 1.064 3113 HH22 ARG 101 2HH1 ARG 101 -15.457 -33.300 2.275 3114 H GLY 102 H GLY 102 -20.566 -26.626 6.373 3115 HA2 GLY 102 2HA GLY 102 -21.726 -25.942 8.104 3116 HA3 GLY 102 1HA GLY 102 -23.234 -26.021 7.106 3117 H HIS 103 H HIS 103 -20.896 -28.610 7.892 3118 HA HIS 103 HA HIS 103 -23.104 -30.269 8.891 3119 HB2 HIS 103 2HB HIS 103 -21.637 -31.600 7.542 3120 HB3 HIS 103 1HB HIS 103 -20.178 -30.767 8.165 3121 HD1 HIS 103 1HD HIS 103 -19.062 -31.605 10.244 3122 HD2 HIS 103 2HD HIS 103 -22.528 -33.827 9.275 3123 HE1 HIS 103 1HE HIS 103 -19.099 -33.655 11.727 3124 HE2 HIS 103 2HE HIS 103 -21.067 -35.020 11.076 Start of MODEL 13 1 H1 SER 1 H SER 1 -22.345 -19.525 -0.255 2 HA SER 1 HA SER 1 -22.559 -21.128 -2.135 3 HB2 SER 1 2HB SER 1 -24.300 -19.874 -3.421 4 HB3 SER 1 1HB SER 1 -23.173 -18.496 -3.646 5 HG SER 1 1HG SER 1 -23.360 -20.073 -5.415 6 H ALA 2 H ALA 2 -21.411 -17.728 -2.607 7 HA ALA 2 HA ALA 2 -18.767 -18.711 -3.122 8 HB1 ALA 2 1HB ALA 2 -18.136 -16.288 -3.293 9 HB2 ALA 2 2HB ALA 2 -19.791 -15.833 -2.726 10 HB3 ALA 2 3HB ALA 2 -19.575 -16.666 -4.292 11 H ASP 3 H ASP 3 -20.454 -17.036 -0.499 12 HA ASP 3 HA ASP 3 -20.208 -16.891 1.621 13 HB2 ASP 3 2HB ASP 3 -18.226 -19.210 1.509 14 HB3 ASP 3 1HB ASP 3 -19.115 -18.608 2.958 15 H HIS 4 H HIS 4 -16.918 -17.397 0.418 16 HA HIS 4 HA HIS 4 -15.619 -15.606 2.180 17 HB2 HIS 4 2HB HIS 4 -13.713 -15.622 0.567 18 HB3 HIS 4 1HB HIS 4 -14.312 -17.261 0.910 19 HD1 HIS 4 1HD HIS 4 -14.225 -14.696 -1.931 20 HD2 HIS 4 2HD HIS 4 -15.351 -18.696 -1.297 21 HE1 HIS 4 1HE HIS 4 -14.594 -15.724 -4.199 22 HE2 HIS 4 2HE HIS 4 -15.299 -18.162 -3.771 23 H GLU 5 H GLU 5 -17.400 -15.126 -0.818 24 HA GLU 5 HA GLU 5 -16.518 -12.499 -1.425 25 HB2 GLU 5 2HB GLU 5 -17.768 -14.055 -3.048 26 HB3 GLU 5 1HB GLU 5 -19.216 -13.897 -1.996 27 HG2 GLU 5 2HG GLU 5 -19.189 -11.365 -2.532 28 HG3 GLU 5 1HG GLU 5 -17.879 -11.718 -3.716 29 H ARG 6 H ARG 6 -19.204 -13.936 0.484 30 HA ARG 6 HA ARG 6 -20.590 -11.548 0.981 31 HB2 ARG 6 2HB ARG 6 -20.463 -14.100 2.728 32 HB3 ARG 6 1HB ARG 6 -21.618 -12.752 2.954 33 HG2 ARG 6 2HG ARG 6 -22.749 -13.223 0.858 34 HG3 ARG 6 1HG ARG 6 -21.494 -14.405 0.367 35 HD2 ARG 6 2HD ARG 6 -23.555 -15.532 1.125 36 HD3 ARG 6 1HD ARG 6 -22.161 -15.975 2.190 37 HE ARG 6 HE ARG 6 -23.104 -14.114 3.793 38 HH11 ARG 6 1HH2 ARG 6 -24.832 -16.821 2.152 39 HH12 ARG 6 2HH2 ARG 6 -26.307 -16.601 2.971 40 HH21 ARG 6 1HH1 ARG 6 -24.987 -14.080 5.219 41 HH22 ARG 6 2HH1 ARG 6 -26.284 -15.131 4.925 42 H GLU 7 H GLU 7 -18.086 -13.363 2.821 43 HA GLU 7 HA GLU 7 -18.178 -11.681 5.033 44 HB2 GLU 7 2HB GLU 7 -17.141 -14.015 4.983 45 HB3 GLU 7 1HB GLU 7 -15.734 -13.296 4.135 46 HG2 GLU 7 2HG GLU 7 -15.170 -13.543 6.489 47 HG3 GLU 7 1HG GLU 7 -15.342 -11.790 6.148 48 H ALA 8 H ALA 8 -16.372 -11.414 1.973 49 HA ALA 8 HA ALA 8 -14.631 -9.375 2.778 50 HB1 ALA 8 1HB ALA 8 -14.420 -8.805 0.354 51 HB2 ALA 8 2HB ALA 8 -15.840 -9.843 -0.024 52 HB3 ALA 8 3HB ALA 8 -14.324 -10.585 0.605 53 H GLN 9 H GLN 9 -17.953 -9.256 1.384 54 HA GLN 9 HA GLN 9 -17.993 -6.406 1.294 55 HB2 GLN 9 2HB GLN 9 -20.438 -8.246 1.438 56 HB3 GLN 9 1HB GLN 9 -20.373 -6.569 0.795 57 HG2 GLN 9 2HG GLN 9 -19.004 -9.045 -0.484 58 HG3 GLN 9 1HG GLN 9 -20.577 -8.353 -0.961 59 HE21 GLN 9 1HE2 GLN 9 -17.055 -7.371 -0.615 60 HE22 GLN 9 2HE2 GLN 9 -17.067 -6.340 -1.998 61 H LYS 10 H LYS 10 -18.841 -8.809 3.743 62 HA LYS 10 HA LYS 10 -20.247 -7.097 5.477 63 HB2 LYS 10 2HB LYS 10 -20.162 -9.661 5.558 64 HB3 LYS 10 1HB LYS 10 -18.490 -9.531 6.186 65 HG2 LYS 10 2HG LYS 10 -19.477 -8.172 8.170 66 HG3 LYS 10 1HG LYS 10 -21.094 -8.563 7.523 67 HD2 LYS 10 2HD LYS 10 -21.071 -10.590 8.519 68 HD3 LYS 10 1HD LYS 10 -19.585 -11.062 7.648 69 HE2 LYS 10 2HE LYS 10 -19.683 -9.487 10.314 70 HE3 LYS 10 1HE LYS 10 -19.319 -11.248 10.148 71 HZ1 LYS 10 3HZ LYS 10 -17.437 -9.636 10.393 72 HZ2 LYS 10 1HZ LYS 10 -17.684 -9.183 8.780 73 HZ3 LYS 10 2HZ LYS 10 -17.295 -10.807 9.118 74 H ALA 11 H ALA 11 -16.775 -7.869 5.064 75 HA ALA 11 HA ALA 11 -15.868 -6.585 7.384 76 HB1 ALA 11 1HB ALA 11 -14.474 -8.228 6.078 77 HB2 ALA 11 2HB ALA 11 -13.612 -6.671 6.340 78 HB3 ALA 11 3HB ALA 11 -14.352 -7.033 4.736 79 H GLU 12 H GLU 12 -16.570 -5.383 4.095 80 HA GLU 12 HA GLU 12 -15.357 -2.888 4.332 81 HB2 GLU 12 2HB GLU 12 -17.927 -3.571 2.771 82 HB3 GLU 12 1HB GLU 12 -16.909 -2.111 2.540 83 HG2 GLU 12 2HG GLU 12 -14.985 -3.599 1.820 84 HG3 GLU 12 1HG GLU 12 -16.064 -5.027 1.975 85 H GLU 13 H GLU 13 -18.560 -4.048 5.422 86 HA GLU 13 HA GLU 13 -19.635 -1.495 5.984 87 HB2 GLU 13 2HB GLU 13 -21.034 -3.663 5.867 88 HB3 GLU 13 1HB GLU 13 -20.296 -4.139 7.426 89 HG2 GLU 13 2HG GLU 13 -21.274 -1.851 8.355 90 HG3 GLU 13 1HG GLU 13 -22.251 -1.817 6.847 91 H GLU 14 H GLU 14 -17.820 -3.900 7.845 92 HA GLU 14 HA GLU 14 -18.037 -2.716 10.338 93 HB2 GLU 14 2HB GLU 14 -17.394 -5.091 9.829 94 HB3 GLU 14 1HB GLU 14 -15.775 -4.536 9.297 95 HG2 GLU 14 2HG GLU 14 -15.156 -3.909 11.567 96 HG3 GLU 14 1HG GLU 14 -16.870 -3.975 12.122 97 H LEU 15 H LEU 15 -15.807 -2.087 7.653 98 HA LEU 15 HA LEU 15 -13.980 -0.561 9.113 99 HB2 LEU 15 2HB LEU 15 -13.588 -1.494 6.786 100 HB3 LEU 15 1HB LEU 15 -14.692 -0.254 6.131 101 HG LEU 15 HG LEU 15 -13.170 1.550 6.790 102 HD11 LEU 15 1HD1 LEU 15 -10.911 1.073 7.847 103 HD12 LEU 15 2HD1 LEU 15 -11.458 -0.608 8.183 104 HD13 LEU 15 3HD1 LEU 15 -12.287 0.799 8.952 105 HD21 LEU 15 3HD2 LEU 15 -12.703 0.386 4.631 106 HD22 LEU 15 1HD2 LEU 15 -11.580 -0.748 5.469 107 HD23 LEU 15 2HD2 LEU 15 -11.186 1.005 5.376 108 H GLN 16 H GLN 16 -17.055 0.321 7.493 109 HA GLN 16 HA GLN 16 -16.637 3.102 7.668 110 HB2 GLN 16 2HB GLN 16 -19.320 1.622 7.536 111 HB3 GLN 16 1HB GLN 16 -19.074 3.397 7.365 112 HG2 GLN 16 2HG GLN 16 -17.457 2.837 5.387 113 HG3 GLN 16 1HG GLN 16 -18.169 1.182 5.412 114 HE21 GLN 16 1HE2 GLN 16 -20.861 1.494 5.810 115 HE22 GLN 16 2HE2 GLN 16 -21.581 2.596 4.699 116 H LYS 17 H LYS 17 -17.918 0.732 9.957 117 HA LYS 17 HA LYS 17 -19.031 2.569 11.784 118 HB2 LYS 17 2HB LYS 17 -19.609 0.205 11.826 119 HB3 LYS 17 1HB LYS 17 -17.919 -0.279 12.131 120 HG2 LYS 17 2HG LYS 17 -19.486 1.482 14.110 121 HG3 LYS 17 1HG LYS 17 -19.748 -0.287 14.065 122 HD2 LYS 17 2HD LYS 17 -17.013 1.057 14.594 123 HD3 LYS 17 1HD LYS 17 -18.115 0.517 15.866 124 HE2 LYS 17 2HE LYS 17 -17.101 -1.476 13.711 125 HE3 LYS 17 1HE LYS 17 -16.096 -1.026 15.139 126 HZ1 LYS 17 3HZ LYS 17 -17.556 -1.887 16.590 127 HZ2 LYS 17 1HZ LYS 17 -17.575 -3.043 15.310 128 HZ3 LYS 17 2HZ LYS 17 -18.878 -1.969 15.505 129 H VAL 18 H VAL 18 -15.708 1.287 11.350 130 HA VAL 18 HA VAL 18 -14.707 2.303 13.783 131 HB VAL 18 HB VAL 18 -13.238 1.633 11.180 132 HG11 VAL 18 1HG1 VAL 18 -12.168 2.071 14.058 133 HG12 VAL 18 2HG1 VAL 18 -11.790 3.079 12.609 134 HG13 VAL 18 3HG1 VAL 18 -11.217 1.383 12.691 135 HG21 VAL 18 3HG2 VAL 18 -12.760 -0.537 12.354 136 HG22 VAL 18 1HG2 VAL 18 -14.524 -0.306 12.160 137 HG23 VAL 18 2HG2 VAL 18 -13.756 -0.010 13.761 138 H LEU 19 H LEU 19 -15.198 3.731 10.559 139 HA LEU 19 HA LEU 19 -13.588 5.986 10.847 140 HB2 LEU 19 2HB LEU 19 -16.332 5.919 9.443 141 HB3 LEU 19 1HB LEU 19 -15.033 7.126 9.182 142 HG LEU 19 HG LEU 19 -14.887 4.133 8.480 143 HD11 LEU 19 1HD1 LEU 19 -15.047 4.906 6.116 144 HD12 LEU 19 2HD1 LEU 19 -15.230 6.611 6.673 145 HD13 LEU 19 3HD1 LEU 19 -16.505 5.397 7.056 146 HD21 LEU 19 3HD2 LEU 19 -12.832 4.771 7.197 147 HD22 LEU 19 1HD2 LEU 19 -12.615 4.973 8.969 148 HD23 LEU 19 2HD2 LEU 19 -12.898 6.415 7.921 149 H GLU 20 H GLU 20 -16.894 5.295 11.963 150 HA GLU 20 HA GLU 20 -17.547 7.942 12.663 151 HB2 GLU 20 2HB GLU 20 -18.695 5.295 13.734 152 HB3 GLU 20 1HB GLU 20 -19.417 6.926 13.961 153 HG2 GLU 20 2HG GLU 20 -19.670 7.150 11.456 154 HG3 GLU 20 1HG GLU 20 -19.027 5.476 11.247 155 H GLU 21 H GLU 21 -16.248 5.122 14.519 156 HA GLU 21 HA GLU 21 -16.074 6.487 16.976 157 HB2 GLU 21 2HB GLU 21 -14.127 4.296 15.987 158 HB3 GLU 21 1HB GLU 21 -14.319 4.922 17.663 159 HG2 GLU 21 2HG GLU 21 -16.726 3.979 17.626 160 HG3 GLU 21 1HG GLU 21 -16.292 3.170 16.073 161 H ALA 22 H ALA 22 -13.803 6.078 14.259 162 HA ALA 22 HA ALA 22 -11.557 7.202 15.334 163 HB1 ALA 22 1HB ALA 22 -11.596 5.992 13.132 164 HB2 ALA 22 2HB ALA 22 -10.821 7.611 12.968 165 HB3 ALA 22 3HB ALA 22 -12.514 7.351 12.409 166 H SER 23 H SER 23 -14.318 8.837 13.757 167 HA SER 23 HA SER 23 -13.057 11.340 13.648 168 HB2 SER 23 2HB SER 23 -15.255 12.322 13.223 169 HB3 SER 23 1HB SER 23 -15.035 10.814 12.270 170 HG SER 23 1HG SER 23 -16.284 9.735 13.957 171 H LYS 24 H LYS 24 -14.867 9.726 16.257 172 HA LYS 24 HA LYS 24 -15.053 12.060 17.888 173 HB2 LYS 24 2HB LYS 24 -16.628 10.049 18.038 174 HB3 LYS 24 1HB LYS 24 -15.282 9.117 18.769 175 HG2 LYS 24 2HG LYS 24 -15.237 10.781 20.697 176 HG3 LYS 24 1HG LYS 24 -16.563 11.694 19.896 177 HD2 LYS 24 2HD LYS 24 -17.974 9.567 19.968 178 HD3 LYS 24 1HD LYS 24 -16.732 8.809 21.009 179 HE2 LYS 24 2HE LYS 24 -18.321 11.404 21.682 180 HE3 LYS 24 1HE LYS 24 -18.780 9.739 22.202 181 HZ1 LYS 24 3HZ LYS 24 -16.593 9.656 23.420 182 HZ2 LYS 24 1HZ LYS 24 -17.729 10.715 23.977 183 HZ3 LYS 24 2HZ LYS 24 -16.427 11.343 23.136 184 H LYS 25 H LYS 25 -12.943 9.152 17.701 185 HA LYS 25 HA LYS 25 -11.375 9.819 19.922 186 HB2 LYS 25 2HB LYS 25 -10.445 8.261 17.442 187 HB3 LYS 25 1HB LYS 25 -9.607 8.347 19.027 188 HG2 LYS 25 2HG LYS 25 -11.619 7.196 20.101 189 HG3 LYS 25 1HG LYS 25 -12.290 6.975 18.447 190 HD2 LYS 25 2HD LYS 25 -9.824 5.969 17.981 191 HD3 LYS 25 1HD LYS 25 -9.845 5.646 19.735 192 HE2 LYS 25 2HE LYS 25 -11.915 4.669 17.626 193 HE3 LYS 25 1HE LYS 25 -10.552 3.684 18.268 194 HZ1 LYS 25 3HZ LYS 25 -12.935 3.438 19.131 195 HZ2 LYS 25 1HZ LYS 25 -12.565 4.730 20.175 196 HZ3 LYS 25 2HZ LYS 25 -11.648 3.296 20.201 197 H ALA 26 H ALA 26 -10.960 10.607 16.410 198 HA ALA 26 HA ALA 26 -8.520 11.915 16.691 199 HB1 ALA 26 1HB ALA 26 -9.436 11.151 14.492 200 HB2 ALA 26 2HB ALA 26 -8.986 12.889 14.450 201 HB3 ALA 26 3HB ALA 26 -10.725 12.402 14.576 202 H VAL 27 H VAL 27 -11.919 13.316 16.536 203 HA VAL 27 HA VAL 27 -10.829 15.896 16.684 204 HB VAL 27 HB VAL 27 -13.050 15.314 15.721 205 HG11 VAL 27 1HG1 VAL 27 -15.014 15.131 17.122 206 HG12 VAL 27 2HG1 VAL 27 -14.086 15.490 18.623 207 HG13 VAL 27 3HG1 VAL 27 -13.834 13.934 17.759 208 HG21 VAL 27 3HG2 VAL 27 -14.035 17.510 16.340 209 HG22 VAL 27 1HG2 VAL 27 -12.256 17.649 16.095 210 HG23 VAL 27 2HG2 VAL 27 -12.942 17.627 17.766 211 H GLU 28 H GLU 28 -11.936 13.624 19.283 212 HA GLU 28 HA GLU 28 -11.640 15.718 21.228 213 HB2 GLU 28 2HB GLU 28 -12.039 12.716 21.571 214 HB3 GLU 28 1HB GLU 28 -12.170 13.933 22.885 215 HG2 GLU 28 2HG GLU 28 -13.954 14.077 20.347 216 HG3 GLU 28 1HG GLU 28 -14.355 13.035 21.738 217 H ALA 29 H ALA 29 -9.449 13.545 19.662 218 HA ALA 29 HA ALA 29 -7.493 13.537 21.793 219 HB1 ALA 29 1HB ALA 29 -7.346 12.723 18.811 220 HB2 ALA 29 2HB ALA 29 -7.518 11.605 20.204 221 HB3 ALA 29 3HB ALA 29 -6.028 12.520 19.984 222 H GLU 30 H GLU 30 -7.910 14.948 18.491 223 HA GLU 30 HA GLU 30 -5.650 16.567 18.633 224 HB2 GLU 30 2HB GLU 30 -8.148 16.554 16.892 225 HB3 GLU 30 1HB GLU 30 -6.867 17.776 16.653 226 HG2 GLU 30 2HG GLU 30 -6.047 14.807 16.769 227 HG3 GLU 30 1HG GLU 30 -6.804 15.463 15.277 228 H ARG 31 H ARG 31 -9.042 17.186 19.678 229 HA ARG 31 HA ARG 31 -8.551 19.978 20.010 230 HB2 ARG 31 2HB ARG 31 -10.680 18.172 21.228 231 HB3 ARG 31 1HB ARG 31 -10.606 19.924 21.571 232 HG2 ARG 31 2HG ARG 31 -10.777 18.829 18.695 233 HG3 ARG 31 1HG ARG 31 -12.239 19.002 19.708 234 HD2 ARG 31 2HD ARG 31 -10.335 21.306 18.862 235 HD3 ARG 31 1HD ARG 31 -11.961 20.910 18.147 236 HE ARG 31 HE ARG 31 -12.145 21.189 21.030 237 HH11 ARG 31 1HH2 ARG 31 -12.093 23.080 17.977 238 HH12 ARG 31 2HH2 ARG 31 -12.681 24.522 18.660 239 HH21 ARG 31 1HH1 ARG 31 -12.861 23.173 22.031 240 HH22 ARG 31 2HH1 ARG 31 -12.889 24.654 21.162 241 H GLY 32 H GLY 32 -6.949 20.657 21.293 242 HA2 GLY 32 2HA GLY 32 -6.693 21.256 23.660 243 HA3 GLY 32 1HA GLY 32 -6.667 19.469 23.974 244 H ALA 33 H ALA 33 -5.410 19.309 21.072 245 HA ALA 33 HA ALA 33 -2.818 19.084 22.180 246 HB1 ALA 33 1HB ALA 33 -3.839 18.480 19.346 247 HB2 ALA 33 2HB ALA 33 -3.711 17.305 20.694 248 HB3 ALA 33 3HB ALA 33 -2.222 18.034 19.985 249 HA PRO 34 HA PRO 34 -1.464 22.884 20.208 250 HB2 PRO 34 2HB PRO 34 1.278 22.751 20.627 251 HB3 PRO 34 1HB PRO 34 0.082 23.050 21.946 252 HG2 PRO 34 2HG PRO 34 1.407 20.402 21.166 253 HG3 PRO 34 1HG PRO 34 1.211 21.106 22.822 254 HD2 PRO 34 2HD PRO 34 -0.522 19.198 21.744 255 HD3 PRO 34 1HD PRO 34 -1.108 20.489 22.893 256 H GLY 35 H GLY 35 -1.637 23.057 17.940 257 HA2 GLY 35 2HA GLY 35 -0.635 23.211 15.947 258 HA3 GLY 35 1HA GLY 35 0.672 22.078 16.468 259 H ALA 36 H ALA 36 -2.571 21.271 17.200 260 HA ALA 36 HA ALA 36 -2.780 18.827 16.071 261 HB1 ALA 36 1HB ALA 36 -4.413 19.721 17.728 262 HB2 ALA 36 2HB ALA 36 -5.302 19.243 16.255 263 HB3 ALA 36 3HB ALA 36 -4.973 20.978 16.575 264 H ALA 37 H ALA 37 -4.449 21.666 14.813 265 HA ALA 37 HA ALA 37 -4.646 22.531 12.787 266 HB1 ALA 37 1HB ALA 37 -3.548 20.035 11.400 267 HB2 ALA 37 2HB ALA 37 -2.587 21.507 11.760 268 HB3 ALA 37 3HB ALA 37 -3.990 21.600 10.628 269 H LEU 38 H LEU 38 -5.642 19.205 13.661 270 HA LEU 38 HA LEU 38 -8.057 19.526 12.064 271 HB2 LEU 38 2HB LEU 38 -6.844 17.311 12.328 272 HB3 LEU 38 1HB LEU 38 -7.297 17.313 14.044 273 HG LEU 38 HG LEU 38 -9.422 17.478 11.825 274 HD11 LEU 38 1HD1 LEU 38 -7.949 15.517 11.313 275 HD12 LEU 38 2HD1 LEU 38 -9.571 14.969 11.881 276 HD13 LEU 38 3HD1 LEU 38 -8.153 14.916 12.990 277 HD21 LEU 38 3HD2 LEU 38 -10.289 17.861 14.162 278 HD22 LEU 38 1HD2 LEU 38 -9.493 16.344 14.704 279 HD23 LEU 38 2HD2 LEU 38 -10.860 16.283 13.533 280 H ILE 39 H ILE 39 -9.853 20.572 12.938 281 HA ILE 39 HA ILE 39 -10.006 20.749 15.869 282 HB ILE 39 HB ILE 39 -10.718 23.145 15.571 283 HG12 ILE 39 2HG1 ILE 39 -9.575 22.813 12.711 284 HG13 ILE 39 1HG1 ILE 39 -11.319 22.982 13.108 285 HG21 ILE 39 1HG2 ILE 39 -8.396 22.401 16.295 286 HG22 ILE 39 2HG2 ILE 39 -8.422 24.004 15.474 287 HG23 ILE 39 3HG2 ILE 39 -7.853 22.544 14.587 288 HD11 ILE 39 3HD ILE 39 -9.117 25.093 13.606 289 HD12 ILE 39 1HD ILE 39 -10.442 25.156 12.395 290 HD13 ILE 39 2HD ILE 39 -10.834 25.244 14.151 291 H SER 40 H SER 40 -11.706 19.687 13.109 292 HA SER 40 HA SER 40 -14.206 20.927 14.051 293 HB2 SER 40 2HB SER 40 -13.709 19.743 11.287 294 HB3 SER 40 1HB SER 40 -14.992 20.901 11.767 295 HG SER 40 1HG SER 40 -13.158 21.631 10.504 296 H TYR 41 H TYR 41 -16.117 19.643 13.983 297 HA TYR 41 HA TYR 41 -15.677 16.835 14.399 298 HB2 TYR 41 2HB TYR 41 -18.210 18.559 14.712 299 HB3 TYR 41 1HB TYR 41 -18.164 16.773 14.943 300 HD1 TYR 41 1HD TYR 41 -16.436 19.958 16.132 301 HD2 TYR 41 2HD TYR 41 -17.595 15.913 17.059 302 HE1 TYR 41 1HE TYR 41 -15.451 20.183 18.360 303 HE2 TYR 41 2HE TYR 41 -16.667 16.173 19.325 304 HH TYR 41 HH TYR 41 -15.258 17.465 20.681 305 HA PRO 42 HA PRO 42 -18.339 16.151 10.660 306 HB2 PRO 42 2HB PRO 42 -18.864 18.166 8.738 307 HB3 PRO 42 1HB PRO 42 -19.943 17.799 10.135 308 HG2 PRO 42 2HG PRO 42 -17.751 19.940 9.958 309 HG3 PRO 42 1HG PRO 42 -19.461 20.139 10.525 310 HD2 PRO 42 2HD PRO 42 -17.435 19.792 12.328 311 HD3 PRO 42 1HD PRO 42 -19.009 18.899 12.570 312 H ASP 43 H ASP 43 -15.584 18.332 10.402 313 HA ASP 43 HA ASP 43 -14.784 17.276 7.857 314 HB2 ASP 43 2HB ASP 43 -12.866 18.748 9.739 315 HB3 ASP 43 1HB ASP 43 -12.768 18.559 7.967 316 H ALA 44 H ALA 44 -14.463 16.375 11.237 317 HA ALA 44 HA ALA 44 -11.941 15.127 11.134 318 HB1 ALA 44 1HB ALA 44 -12.663 13.873 13.208 319 HB2 ALA 44 2HB ALA 44 -14.335 14.517 12.991 320 HB3 ALA 44 3HB ALA 44 -12.967 15.623 13.356 321 H ILE 45 H ILE 45 -15.209 14.088 10.222 322 HA ILE 45 HA ILE 45 -14.410 11.342 10.069 323 HB ILE 45 HB ILE 45 -16.656 11.753 10.646 324 HG12 ILE 45 2HG1 ILE 45 -16.568 10.525 7.826 325 HG13 ILE 45 1HG1 ILE 45 -16.012 9.711 9.321 326 HG21 ILE 45 1HG2 ILE 45 -16.932 13.238 7.951 327 HG22 ILE 45 2HG2 ILE 45 -17.059 13.926 9.612 328 HG23 ILE 45 3HG2 ILE 45 -18.294 12.780 9.031 329 HD11 ILE 45 3HD ILE 45 -18.900 10.673 8.750 330 HD12 ILE 45 1HD ILE 45 -18.305 8.976 8.784 331 HD13 ILE 45 2HD ILE 45 -18.341 9.946 10.301 332 H TRP 46 H TRP 46 -14.278 14.152 7.907 333 HA TRP 46 HA TRP 46 -13.935 12.542 5.551 334 HB2 TRP 46 2HB TRP 46 -13.769 15.485 6.211 335 HB3 TRP 46 1HB TRP 46 -12.769 14.930 4.860 336 HD1 TRP 46 HD TRP 46 -14.167 16.576 3.368 337 HE1 TRP 46 1HE TRP 46 -16.349 16.304 2.057 338 HE3 TRP 46 3HE TRP 46 -16.084 12.493 5.839 339 HZ2 TRP 46 2HZ TRP 46 -18.515 14.443 1.936 340 HZ3 TRP 46 3HZ TRP 46 -18.214 11.551 5.093 341 HH2 TRP 46 HH TRP 46 -19.419 12.498 3.160 342 H TRP 47 H TRP 47 -11.820 13.868 8.033 343 HA TRP 47 HA TRP 47 -9.351 13.118 6.861 344 HB2 TRP 47 2HB TRP 47 -9.512 14.559 8.963 345 HB3 TRP 47 1HB TRP 47 -10.235 13.192 9.830 346 HD1 TRP 47 HD TRP 47 -6.757 13.849 8.049 347 HE1 TRP 47 1HE TRP 47 -5.013 12.572 9.330 348 HE3 TRP 47 3HE TRP 47 -9.850 11.467 11.310 349 HZ2 TRP 47 2HZ TRP 47 -4.899 10.836 11.628 350 HZ3 TRP 47 3HZ TRP 47 -8.874 9.831 12.895 351 HH2 TRP 47 HH TRP 47 -6.435 9.573 13.097 352 H SER 48 H SER 48 -11.708 11.321 9.038 353 HA SER 48 HA SER 48 -9.885 9.206 9.249 354 HB2 SER 48 2HB SER 48 -11.685 7.836 10.255 355 HB3 SER 48 1HB SER 48 -11.369 9.411 11.066 356 HG SER 48 1HG SER 48 -13.618 8.831 10.743 357 H VAL 49 H VAL 49 -12.400 9.876 6.852 358 HA VAL 49 HA VAL 49 -12.574 7.364 5.690 359 HB VAL 49 HB VAL 49 -12.741 10.159 4.479 360 HG11 VAL 49 1HG1 VAL 49 -13.866 9.057 2.480 361 HG12 VAL 49 2HG1 VAL 49 -13.362 7.447 3.102 362 HG13 VAL 49 3HG1 VAL 49 -12.124 8.649 2.585 363 HG21 VAL 49 3HG2 VAL 49 -15.161 9.774 4.600 364 HG22 VAL 49 1HG2 VAL 49 -14.505 9.292 6.205 365 HG23 VAL 49 2HG2 VAL 49 -14.927 8.033 5.004 366 H GLU 50 H GLU 50 -10.214 10.006 4.900 367 HA GLU 50 HA GLU 50 -8.910 8.387 2.973 368 HB2 GLU 50 2HB GLU 50 -7.186 10.256 2.936 369 HB3 GLU 50 1HB GLU 50 -8.874 10.771 2.630 370 HG2 GLU 50 2HG GLU 50 -9.082 11.476 5.049 371 HG3 GLU 50 1HG GLU 50 -7.355 11.063 5.298 372 H THR 51 H THR 51 -8.675 8.660 6.412 373 HA THR 51 HA THR 51 -5.987 7.744 6.667 374 HB THR 51 HB THR 51 -8.274 7.754 8.709 375 HG1 THR 51 1HG THR 51 -7.744 9.848 7.951 376 HG21 THR 51 3HG2 THR 51 -6.389 6.252 9.425 377 HG22 THR 51 1HG2 THR 51 -6.392 7.766 10.393 378 HG23 THR 51 2HG2 THR 51 -5.200 7.558 9.060 379 H ALA 52 H ALA 52 -9.245 6.197 6.651 380 HA ALA 52 HA ALA 52 -8.250 3.649 7.422 381 HB1 ALA 52 1HB ALA 52 -10.643 4.224 7.712 382 HB2 ALA 52 2HB ALA 52 -10.485 2.803 6.620 383 HB3 ALA 52 3HB ALA 52 -10.829 4.434 5.926 384 H THR 53 H THR 53 -8.516 5.344 4.272 385 HA THR 53 HA THR 53 -7.951 2.911 2.842 386 HB THR 53 HB THR 53 -7.718 4.523 0.884 387 HG1 THR 53 1HG THR 53 -7.277 6.399 2.073 388 HG21 THR 53 3HG2 THR 53 -9.840 3.278 1.471 389 HG22 THR 53 1HG2 THR 53 -10.186 4.913 0.797 390 HG23 THR 53 2HG2 THR 53 -10.328 4.624 2.568 391 H THR 54 H THR 54 -6.124 4.716 4.922 392 HA THR 54 HA THR 54 -4.044 5.167 5.246 393 HB THR 54 HB THR 54 -2.374 3.313 4.544 394 HG1 THR 54 1HG THR 54 -3.946 2.596 2.862 395 HG21 THR 54 3HG2 THR 54 -3.510 3.566 6.763 396 HG22 THR 54 1HG2 THR 54 -3.350 1.832 6.300 397 HG23 THR 54 2HG2 THR 54 -4.945 2.659 6.152 398 H VAL 55 H VAL 55 -4.972 6.782 3.245 399 HA VAL 55 HA VAL 55 -2.679 6.852 1.369 400 HB VAL 55 HB VAL 55 -5.386 8.253 1.036 401 HG11 VAL 55 1HG1 VAL 55 -2.841 8.025 -0.728 402 HG12 VAL 55 2HG1 VAL 55 -3.443 9.528 0.055 403 HG13 VAL 55 3HG1 VAL 55 -4.401 8.754 -1.258 404 HG21 VAL 55 3HG2 VAL 55 -5.595 6.585 -0.890 405 HG22 VAL 55 1HG2 VAL 55 -5.622 5.797 0.724 406 HG23 VAL 55 2HG2 VAL 55 -4.128 5.745 -0.268 407 H GLY 56 H GLY 56 -4.973 9.243 2.839 408 HA2 GLY 56 2HA GLY 56 -4.510 11.037 4.078 409 HA3 GLY 56 1HA GLY 56 -2.852 10.379 4.387 410 H TYR 57 H TYR 57 -4.854 12.487 2.331 411 HA TYR 57 HA TYR 57 -2.841 12.676 0.301 412 HB2 TYR 57 2HB TYR 57 -5.589 13.313 0.442 413 HB3 TYR 57 1HB TYR 57 -4.851 14.949 0.450 414 HD1 TYR 57 1HD TYR 57 -2.776 15.140 -1.400 415 HD2 TYR 57 2HD TYR 57 -6.141 12.464 -1.630 416 HE1 TYR 57 1HE TYR 57 -2.394 14.875 -3.796 417 HE2 TYR 57 2HE TYR 57 -5.758 12.213 -4.064 418 HH TYR 57 HH TYR 57 -2.925 13.658 -5.730 419 H GLY 58 H GLY 58 -3.495 14.326 3.318 420 HA2 GLY 58 2HA GLY 58 -1.498 15.377 4.185 421 HA3 GLY 58 1HA GLY 58 -1.373 16.308 2.652 422 H ASP 59 H ASP 59 -4.568 15.969 3.322 423 HA ASP 59 HA ASP 59 -5.145 18.570 3.747 424 HB2 ASP 59 2HB ASP 59 -6.530 15.922 3.987 425 HB3 ASP 59 1HB ASP 59 -7.207 17.120 5.100 426 H ARG 60 H ARG 60 -4.810 16.023 6.342 427 HA ARG 60 HA ARG 60 -4.547 18.060 8.358 428 HB2 ARG 60 2HB ARG 60 -6.700 15.856 8.312 429 HB3 ARG 60 1HB ARG 60 -6.184 16.639 9.843 430 HG2 ARG 60 2HG ARG 60 -7.207 18.696 9.279 431 HG3 ARG 60 1HG ARG 60 -7.173 18.355 7.527 432 HD2 ARG 60 2HD ARG 60 -9.054 16.882 9.477 433 HD3 ARG 60 1HD ARG 60 -9.520 18.331 8.505 434 HE ARG 60 HE ARG 60 -9.104 15.564 7.512 435 HH11 ARG 60 1HH2 ARG 60 -9.085 19.040 6.417 436 HH12 ARG 60 2HH2 ARG 60 -9.307 18.565 4.823 437 HH21 ARG 60 1HH1 ARG 60 -9.282 15.161 5.082 438 HH22 ARG 60 2HH1 ARG 60 -9.619 16.507 4.158 439 H TYR 61 H TYR 61 -3.472 16.798 10.351 440 HA TYR 61 HA TYR 61 -2.628 14.180 9.712 441 HB2 TYR 61 2HB TYR 61 -0.144 14.808 10.154 442 HB3 TYR 61 1HB TYR 61 -0.774 15.228 8.522 443 HD1 TYR 61 2HD TYR 61 0.143 16.657 11.873 444 HD2 TYR 61 1HD TYR 61 -0.979 17.521 7.811 445 HE1 TYR 61 2HE TYR 61 0.749 19.002 12.217 446 HE2 TYR 61 1HE TYR 61 -0.380 19.879 8.146 447 HH TYR 61 HH TYR 61 0.814 21.116 11.319 448 HA PRO 62 HA PRO 62 -2.946 14.987 14.137 449 HB2 PRO 62 2HB PRO 62 -2.252 12.482 15.187 450 HB3 PRO 62 1HB PRO 62 -3.765 12.748 14.251 451 HG2 PRO 62 2HG PRO 62 -1.086 11.634 13.278 452 HG3 PRO 62 1HG PRO 62 -2.735 10.972 12.984 453 HD2 PRO 62 2HD PRO 62 -1.420 12.604 11.128 454 HD3 PRO 62 1HD PRO 62 -3.232 12.629 11.343 455 H VAL 63 H VAL 63 -1.632 14.888 16.221 456 HA VAL 63 HA VAL 63 1.266 15.063 15.685 457 HB VAL 63 HB VAL 63 1.377 16.837 17.409 458 HG11 VAL 63 1HG1 VAL 63 0.488 18.588 15.943 459 HG12 VAL 63 2HG1 VAL 63 -0.571 17.421 15.084 460 HG13 VAL 63 3HG1 VAL 63 1.223 17.289 14.933 461 HG21 VAL 63 3HG2 VAL 63 -0.784 16.217 18.674 462 HG22 VAL 63 1HG2 VAL 63 -1.727 16.764 17.240 463 HG23 VAL 63 2HG2 VAL 63 -0.728 17.940 18.147 464 H THR 64 H THR 64 1.808 15.504 18.571 465 HA THR 64 HA THR 64 2.151 12.763 19.219 466 HB THR 64 HB THR 64 3.338 13.958 21.270 467 HG1 THR 64 1HG THR 64 3.473 16.125 19.462 468 HG21 THR 64 3HG2 THR 64 5.333 14.437 19.802 469 HG22 THR 64 1HG2 THR 64 4.296 14.249 18.336 470 HG23 THR 64 2HG2 THR 64 4.571 12.851 19.437 471 H GLU 65 H GLU 65 0.704 15.566 20.787 472 HA GLU 65 HA GLU 65 -0.068 14.432 23.142 473 HB2 GLU 65 2HB GLU 65 0.180 16.905 22.486 474 HB3 GLU 65 1HB GLU 65 -1.397 16.774 21.652 475 HG2 GLU 65 2HG GLU 65 -1.759 17.876 23.765 476 HG3 GLU 65 1HG GLU 65 -2.466 16.228 23.930 477 H GLU 66 H GLU 66 -1.797 14.556 20.034 478 HA GLU 66 HA GLU 66 -4.323 13.859 20.963 479 HB2 GLU 66 2HB GLU 66 -4.986 13.803 18.730 480 HB3 GLU 66 1HB GLU 66 -3.591 14.872 18.670 481 HG2 GLU 66 2HG GLU 66 -3.316 13.608 16.812 482 HG3 GLU 66 1HG GLU 66 -2.242 12.670 17.909 483 H GLY 67 H GLY 67 -1.405 12.179 20.345 484 HA2 GLY 67 2HA GLY 67 -0.727 10.256 21.275 485 HA3 GLY 67 1HA GLY 67 -2.455 9.793 21.611 486 H ARG 68 H ARG 68 -0.437 10.739 18.782 487 HA ARG 68 HA ARG 68 -1.402 10.101 16.641 488 HB2 ARG 68 2HB ARG 68 0.977 10.647 16.848 489 HB3 ARG 68 1HB ARG 68 1.343 8.948 17.322 490 HG2 ARG 68 2HG ARG 68 0.564 8.193 15.045 491 HG3 ARG 68 1HG ARG 68 0.202 9.882 14.613 492 HD2 ARG 68 2HD ARG 68 3.014 8.717 15.306 493 HD3 ARG 68 1HD ARG 68 2.329 8.872 13.665 494 HE ARG 68 HE ARG 68 3.754 10.575 14.016 495 HH11 ARG 68 1HH2 ARG 68 1.773 10.758 12.275 496 HH12 ARG 68 2HH2 ARG 68 0.965 12.254 12.435 497 HH21 ARG 68 1HH1 ARG 68 3.280 13.341 14.522 498 HH22 ARG 68 2HH1 ARG 68 1.675 13.696 14.139 499 H LYS 69 H LYS 69 -1.007 7.614 18.859 500 HA LYS 69 HA LYS 69 -1.281 5.247 17.382 501 HB2 LYS 69 2HB LYS 69 -2.195 5.889 20.240 502 HB3 LYS 69 1HB LYS 69 -1.732 4.282 19.582 503 HG2 LYS 69 2HG LYS 69 0.179 6.703 20.011 504 HG3 LYS 69 1HG LYS 69 -0.023 5.328 21.124 505 HD2 LYS 69 2HD LYS 69 0.905 3.751 19.664 506 HD3 LYS 69 1HD LYS 69 0.791 4.775 18.212 507 HE2 LYS 69 2HE LYS 69 2.664 5.443 20.595 508 HE3 LYS 69 1HE LYS 69 3.147 4.422 19.184 509 HZ1 LYS 69 3HZ LYS 69 3.834 6.652 18.850 510 HZ2 LYS 69 1HZ LYS 69 2.276 7.271 19.063 511 HZ3 LYS 69 2HZ LYS 69 2.623 6.275 17.729 512 H VAL 70 H VAL 70 -3.544 7.914 18.024 513 HA VAL 70 HA VAL 70 -5.898 6.340 17.885 514 HB VAL 70 HB VAL 70 -5.422 9.285 17.237 515 HG11 VAL 70 1HG1 VAL 70 -8.050 7.677 17.406 516 HG12 VAL 70 2HG1 VAL 70 -7.397 8.563 15.972 517 HG13 VAL 70 3HG1 VAL 70 -7.916 9.488 17.411 518 HG21 VAL 70 3HG2 VAL 70 -6.654 7.875 19.713 519 HG22 VAL 70 1HG2 VAL 70 -6.488 9.662 19.433 520 HG23 VAL 70 2HG2 VAL 70 -5.030 8.659 19.636 521 H ALA 71 H ALA 71 -3.996 8.241 15.481 522 HA ALA 71 HA ALA 71 -5.521 7.428 13.271 523 HB1 ALA 71 1HB ALA 71 -3.564 8.137 11.869 524 HB2 ALA 71 2HB ALA 71 -2.539 8.218 13.357 525 HB3 ALA 71 3HB ALA 71 -3.936 9.337 13.162 526 H GLU 72 H GLU 72 -2.602 6.033 14.755 527 HA GLU 72 HA GLU 72 -1.927 4.085 12.963 528 HB2 GLU 72 2HB GLU 72 -0.734 4.621 15.188 529 HB3 GLU 72 1HB GLU 72 -2.013 3.670 16.009 530 HG2 GLU 72 2HG GLU 72 -1.239 1.653 14.504 531 HG3 GLU 72 1HG GLU 72 0.169 2.683 14.064 532 H GLN 73 H GLN 73 -4.353 3.883 15.557 533 HA GLN 73 HA GLN 73 -5.024 1.198 15.236 534 HB2 GLN 73 2HB GLN 73 -5.411 2.736 17.240 535 HB3 GLN 73 1HB GLN 73 -6.741 3.521 16.331 536 HG2 GLN 73 2HG GLN 73 -8.015 1.337 16.363 537 HG3 GLN 73 1HG GLN 73 -6.623 0.554 17.214 538 HE21 GLN 73 1HE2 GLN 73 -8.661 0.234 18.819 539 HE22 GLN 73 2HE2 GLN 73 -8.722 1.405 20.082 540 H VAL 74 H VAL 74 -6.333 4.194 13.787 541 HA VAL 74 HA VAL 74 -8.603 2.932 12.620 542 HB VAL 74 HB VAL 74 -7.242 5.618 12.050 543 HG11 VAL 74 1HG1 VAL 74 -8.674 4.964 10.102 544 HG12 VAL 74 2HG1 VAL 74 -9.469 6.268 11.040 545 HG13 VAL 74 3HG1 VAL 74 -10.039 4.564 11.208 546 HG21 VAL 74 3HG2 VAL 74 -8.981 6.536 13.557 547 HG22 VAL 74 1HG2 VAL 74 -8.102 5.259 14.441 548 HG23 VAL 74 2HG2 VAL 74 -9.720 4.897 13.768 549 H MET 75 H MET 75 -5.356 3.916 11.454 550 HA MET 75 HA MET 75 -5.687 3.204 8.774 551 HB2 MET 75 2HB MET 75 -3.192 3.203 10.586 552 HB3 MET 75 1HB MET 75 -3.126 2.886 8.821 553 HG2 MET 75 2HG MET 75 -4.261 5.118 8.429 554 HG3 MET 75 1HG MET 75 -4.075 5.492 10.158 555 HE1 MET 75 3HE MET 75 -1.070 4.171 10.762 556 HE2 MET 75 1HE MET 75 -1.703 5.738 11.392 557 HE3 MET 75 2HE MET 75 -0.113 5.673 10.564 558 H LYS 76 H LYS 76 -4.439 1.277 11.581 559 HA LYS 76 HA LYS 76 -3.856 -0.945 10.004 560 HB2 LYS 76 2HB LYS 76 -3.057 -0.503 12.448 561 HB3 LYS 76 1HB LYS 76 -4.625 -1.218 12.951 562 HG2 LYS 76 2HG LYS 76 -3.974 -3.266 11.452 563 HG3 LYS 76 1HG LYS 76 -2.345 -2.524 11.318 564 HD2 LYS 76 2HD LYS 76 -2.146 -2.693 13.860 565 HD3 LYS 76 1HD LYS 76 -3.790 -3.440 13.880 566 HE2 LYS 76 2HE LYS 76 -2.869 -5.278 12.303 567 HE3 LYS 76 1HE LYS 76 -1.211 -4.618 12.613 568 HZ1 LYS 76 3HZ LYS 76 -1.710 -6.479 14.029 569 HZ2 LYS 76 1HZ LYS 76 -3.144 -5.747 14.577 570 HZ3 LYS 76 2HZ LYS 76 -1.624 -5.099 15.012 571 H ALA 77 H ALA 77 -6.882 0.033 11.614 572 HA ALA 77 HA ALA 77 -8.233 -2.394 11.359 573 HB1 ALA 77 1HB ALA 77 -9.111 -0.470 12.729 574 HB2 ALA 77 2HB ALA 77 -10.338 -1.052 11.541 575 HB3 ALA 77 3HB ALA 77 -9.405 0.457 11.212 576 H GLY 78 H GLY 78 -7.685 0.249 9.028 577 HA2 GLY 78 2HA GLY 78 -9.506 -0.704 7.064 578 HA3 GLY 78 1HA GLY 78 -8.123 0.443 6.862 579 H ILE 79 H ILE 79 -6.006 -1.138 7.650 580 HA ILE 79 HA ILE 79 -5.478 -2.597 5.337 581 HB ILE 79 HB ILE 79 -4.088 -2.697 8.058 582 HG12 ILE 79 2HG1 ILE 79 -3.420 -1.103 5.491 583 HG13 ILE 79 1HG1 ILE 79 -4.206 -0.408 6.929 584 HG21 ILE 79 1HG2 ILE 79 -3.494 -4.718 6.673 585 HG22 ILE 79 2HG2 ILE 79 -2.106 -3.599 6.775 586 HG23 ILE 79 3HG2 ILE 79 -3.103 -3.649 5.277 587 HD11 ILE 79 3HD ILE 79 -1.349 -1.574 6.822 588 HD12 ILE 79 1HD ILE 79 -1.826 0.148 6.980 589 HD13 ILE 79 2HD ILE 79 -2.170 -1.000 8.326 590 H GLU 80 H GLU 80 -6.509 -3.692 8.628 591 HA GLU 80 HA GLU 80 -6.362 -6.427 8.083 592 HB2 GLU 80 2HB GLU 80 -8.269 -4.928 9.979 593 HB3 GLU 80 1HB GLU 80 -8.133 -6.718 9.895 594 HG2 GLU 80 2HG GLU 80 -5.707 -6.582 10.521 595 HG3 GLU 80 1HG GLU 80 -5.857 -4.797 10.703 596 H VAL 81 H VAL 81 -8.989 -4.083 7.437 597 HA VAL 81 HA VAL 81 -10.878 -6.006 6.602 598 HB VAL 81 HB VAL 81 -10.563 -3.008 6.126 599 HG11 VAL 81 1HG1 VAL 81 -12.969 -3.066 5.281 600 HG12 VAL 81 2HG1 VAL 81 -12.851 -4.858 5.157 601 HG13 VAL 81 3HG1 VAL 81 -11.800 -3.806 4.141 602 HG21 VAL 81 3HG2 VAL 81 -12.384 -2.881 7.790 603 HG22 VAL 81 1HG2 VAL 81 -11.120 -3.958 8.465 604 HG23 VAL 81 2HG2 VAL 81 -12.610 -4.665 7.738 605 H PHE 82 H PHE 82 -8.632 -3.873 4.701 606 HA PHE 82 HA PHE 82 -9.392 -4.918 2.219 607 HB2 PHE 82 2HB PHE 82 -6.740 -3.610 3.133 608 HB3 PHE 82 1HB PHE 82 -7.031 -4.111 1.428 609 HD1 PHE 82 1HD PHE 82 -9.330 -3.324 0.380 610 HD2 PHE 82 2HD PHE 82 -7.252 -1.347 3.586 611 HE1 PHE 82 1HE PHE 82 -10.475 -1.209 -0.177 612 HE2 PHE 82 2HE PHE 82 -8.418 0.750 3.058 613 HZ PHE 82 HZ PHE 82 -10.034 0.840 1.165 614 H ALA 83 H ALA 83 -6.838 -5.964 4.492 615 HA ALA 83 HA ALA 83 -5.662 -7.837 2.779 616 HB1 ALA 83 1HB ALA 83 -5.829 -7.837 5.863 617 HB2 ALA 83 2HB ALA 83 -4.554 -7.028 4.882 618 HB3 ALA 83 3HB ALA 83 -4.680 -8.822 4.878 619 H LEU 84 H LEU 84 -8.465 -8.044 4.984 620 HA LEU 84 HA LEU 84 -8.665 -10.824 5.076 621 HB2 LEU 84 2HB LEU 84 -9.782 -9.202 6.616 622 HB3 LEU 84 1HB LEU 84 -10.918 -8.731 5.322 623 HG LEU 84 HG LEU 84 -10.698 -11.661 6.183 624 HD11 LEU 84 1HD1 LEU 84 -12.270 -9.511 7.744 625 HD12 LEU 84 2HD1 LEU 84 -10.810 -10.400 8.322 626 HD13 LEU 84 3HD1 LEU 84 -12.344 -11.293 8.018 627 HD21 LEU 84 3HD2 LEU 84 -13.148 -11.712 5.717 628 HD22 LEU 84 1HD2 LEU 84 -12.253 -11.152 4.273 629 HD23 LEU 84 2HD2 LEU 84 -13.130 -9.958 5.297 630 H VAL 85 H VAL 85 -9.840 -8.442 2.714 631 HA VAL 85 HA VAL 85 -11.637 -10.024 1.332 632 HB VAL 85 HB VAL 85 -9.862 -7.781 0.239 633 HG11 VAL 85 1HG1 VAL 85 -10.896 -8.959 -1.663 634 HG12 VAL 85 2HG1 VAL 85 -11.771 -7.425 -1.389 635 HG13 VAL 85 3HG1 VAL 85 -12.503 -8.981 -0.846 636 HG21 VAL 85 3HG2 VAL 85 -11.131 -7.011 2.216 637 HG22 VAL 85 1HG2 VAL 85 -12.649 -7.755 1.600 638 HG23 VAL 85 2HG2 VAL 85 -11.900 -6.355 0.747 639 H THR 86 H THR 86 -8.177 -10.363 1.492 640 HA THR 86 HA THR 86 -7.627 -11.486 -0.950 641 HB THR 86 HB THR 86 -6.371 -12.304 1.699 642 HG1 THR 86 1HG THR 86 -6.107 -10.221 1.650 643 HG21 THR 86 3HG2 THR 86 -5.639 -13.743 -0.248 644 HG22 THR 86 1HG2 THR 86 -4.321 -12.627 0.242 645 HG23 THR 86 2HG2 THR 86 -5.303 -12.260 -1.221 646 H ALA 87 H ALA 87 -9.505 -12.850 1.685 647 HA ALA 87 HA ALA 87 -9.398 -15.562 1.023 648 HB1 ALA 87 1HB ALA 87 -11.640 -15.688 2.135 649 HB2 ALA 87 2HB ALA 87 -11.806 -13.893 2.017 650 HB3 ALA 87 3HB ALA 87 -10.549 -14.617 3.071 651 H ALA 88 H ALA 88 -10.849 -12.835 -0.670 652 HA ALA 88 HA ALA 88 -12.349 -14.646 -2.417 653 HB1 ALA 88 1HB ALA 88 -13.692 -12.719 -1.324 654 HB2 ALA 88 2HB ALA 88 -13.606 -12.575 -3.127 655 HB3 ALA 88 3HB ALA 88 -12.537 -11.576 -2.085 656 H LEU 89 H LEU 89 -9.361 -13.165 -2.238 657 HA LEU 89 HA LEU 89 -9.336 -12.541 -5.114 658 HB2 LEU 89 2HB LEU 89 -7.120 -12.197 -3.010 659 HB3 LEU 89 1HB LEU 89 -7.021 -11.713 -4.734 660 HG LEU 89 HG LEU 89 -9.022 -10.552 -2.700 661 HD11 LEU 89 1HD1 LEU 89 -6.411 -9.316 -3.789 662 HD12 LEU 89 2HD1 LEU 89 -6.656 -9.937 -2.119 663 HD13 LEU 89 3HD1 LEU 89 -7.601 -8.522 -2.693 664 HD21 LEU 89 3HD2 LEU 89 -9.889 -10.378 -5.031 665 HD22 LEU 89 1HD2 LEU 89 -8.332 -9.637 -5.567 666 HD23 LEU 89 2HD2 LEU 89 -9.397 -8.768 -4.407 667 H ALA 90 H ALA 90 -7.853 -14.649 -2.617 668 HA ALA 90 HA ALA 90 -6.119 -15.938 -4.415 669 HB1 ALA 90 1HB ALA 90 -5.726 -15.963 -1.955 670 HB2 ALA 90 2HB ALA 90 -5.845 -17.644 -2.592 671 HB3 ALA 90 3HB ALA 90 -7.246 -16.901 -1.721 672 H THR 91 H THR 91 -9.589 -16.316 -3.901 673 HA THR 91 HA THR 91 -9.721 -18.996 -4.829 674 HB THR 91 HB THR 91 -12.184 -18.294 -5.285 675 HG1 THR 91 1HG THR 91 -11.818 -16.029 -5.414 676 HG21 THR 91 3HG2 THR 91 -10.939 -17.850 -2.488 677 HG22 THR 91 1HG2 THR 91 -11.315 -19.462 -3.211 678 HG23 THR 91 2HG2 THR 91 -12.641 -18.310 -2.821 679 H ASP 92 H ASP 92 -9.113 -15.904 -6.402 680 HA ASP 92 HA ASP 92 -10.710 -16.726 -8.651 681 HB2 ASP 92 2HB ASP 92 -9.355 -14.098 -7.998 682 HB3 ASP 92 1HB ASP 92 -10.101 -14.464 -9.599 683 H PHE 93 H PHE 93 -7.549 -17.339 -7.741 684 HA PHE 93 HA PHE 93 -6.766 -17.854 -10.490 685 HB2 PHE 93 2HB PHE 93 -4.705 -18.530 -9.808 686 HB3 PHE 93 1HB PHE 93 -5.065 -17.284 -8.591 687 HD1 PHE 93 2HD PHE 93 -4.751 -20.958 -9.225 688 HD2 PHE 93 1HD PHE 93 -5.095 -17.879 -6.248 689 HE1 PHE 93 2HE PHE 93 -4.098 -22.575 -7.475 690 HE2 PHE 93 1HE PHE 93 -4.449 -19.493 -4.502 691 HZ PHE 93 HZ PHE 93 -3.936 -21.848 -5.107 692 H VAL 94 H VAL 94 -8.346 -19.454 -7.756 693 HA VAL 94 HA VAL 94 -7.798 -22.089 -8.542 694 HB VAL 94 HB VAL 94 -10.031 -21.032 -6.728 695 HG11 VAL 94 1HG1 VAL 94 -9.865 -23.330 -5.682 696 HG12 VAL 94 2HG1 VAL 94 -8.717 -23.820 -6.983 697 HG13 VAL 94 3HG1 VAL 94 -10.426 -23.412 -7.387 698 HG21 VAL 94 3HG2 VAL 94 -7.726 -20.244 -6.025 699 HG22 VAL 94 1HG2 VAL 94 -7.128 -21.933 -6.110 700 HG23 VAL 94 2HG2 VAL 94 -8.374 -21.467 -4.896 701 H ARG 95 H ARG 95 -10.359 -19.796 -9.220 702 HA ARG 95 HA ARG 95 -12.257 -21.314 -10.504 703 HB2 ARG 95 2HB ARG 95 -11.133 -18.576 -11.408 704 HB3 ARG 95 1HB ARG 95 -12.705 -19.267 -11.931 705 HG2 ARG 95 2HG ARG 95 -13.599 -19.046 -9.621 706 HG3 ARG 95 1HG ARG 95 -12.018 -18.403 -9.056 707 HD2 ARG 95 2HD ARG 95 -12.236 -16.464 -10.696 708 HD3 ARG 95 1HD ARG 95 -13.835 -17.127 -11.210 709 HE ARG 95 HE ARG 95 -13.148 -16.076 -8.416 710 HH11 ARG 95 1HH2 ARG 95 -14.909 -15.419 -11.418 711 HH12 ARG 95 2HH2 ARG 95 -16.280 -14.755 -10.702 712 HH21 ARG 95 1HH1 ARG 95 -14.776 -14.666 -7.437 713 HH22 ARG 95 2HH1 ARG 95 -15.949 -13.961 -8.446 714 H ARG 96 H ARG 96 -8.951 -20.660 -11.567 715 HA ARG 96 HA ARG 96 -9.206 -20.613 -14.298 716 HB2 ARG 96 2HB ARG 96 -7.020 -20.211 -12.988 717 HB3 ARG 96 1HB ARG 96 -6.900 -21.984 -12.780 718 HG2 ARG 96 2HG ARG 96 -6.969 -22.061 -15.449 719 HG3 ARG 96 1HG ARG 96 -6.712 -20.296 -15.345 720 HD2 ARG 96 2HD ARG 96 -4.555 -21.371 -15.710 721 HD3 ARG 96 1HD ARG 96 -4.546 -20.809 -13.977 722 HE ARG 96 HE ARG 96 -5.541 -23.447 -13.833 723 HH11 ARG 96 1HH2 ARG 96 -2.494 -22.141 -15.346 724 HH12 ARG 96 2HH2 ARG 96 -1.695 -23.650 -15.220 725 HH21 ARG 96 1HH1 ARG 96 -4.500 -25.283 -13.651 726 HH22 ARG 96 2HH1 ARG 96 -2.844 -25.573 -14.109 727 H GLU 97 H GLU 97 -9.096 -23.446 -12.072 728 HA GLU 97 HA GLU 97 -8.679 -25.267 -14.194 729 HB2 GLU 97 2HB GLU 97 -9.863 -25.826 -11.413 730 HB3 GLU 97 1HB GLU 97 -9.259 -27.057 -12.577 731 HG2 GLU 97 2HG GLU 97 -7.565 -24.873 -11.196 732 HG3 GLU 97 1HG GLU 97 -7.555 -26.631 -10.824 733 H GLU 98 H GLU 98 -11.604 -23.723 -12.943 734 HA GLU 98 HA GLU 98 -13.229 -25.684 -14.380 735 HB2 GLU 98 2HB GLU 98 -14.157 -23.348 -12.668 736 HB3 GLU 98 1HB GLU 98 -15.202 -24.487 -13.593 737 HG2 GLU 98 2HG GLU 98 -14.018 -26.427 -12.360 738 HG3 GLU 98 1HG GLU 98 -13.284 -25.202 -11.272 739 H GLU 99 H GLU 99 -12.028 -22.301 -14.716 740 HA GLU 99 HA GLU 99 -13.534 -21.870 -17.083 741 HB2 GLU 99 2HB GLU 99 -11.005 -20.524 -16.014 742 HB3 GLU 99 1HB GLU 99 -11.697 -20.095 -17.614 743 HG2 GLU 99 2HG GLU 99 -13.250 -19.863 -14.962 744 HG3 GLU 99 1HG GLU 99 -12.464 -18.509 -15.860 745 H ARG 100 H ARG 100 -10.520 -23.578 -16.503 746 HA ARG 100 HA ARG 100 -9.622 -23.611 -19.138 747 HB2 ARG 100 2HB ARG 100 -8.270 -24.232 -17.127 748 HB3 ARG 100 1HB ARG 100 -9.257 -25.717 -16.917 749 HG2 ARG 100 2HG ARG 100 -8.450 -26.617 -19.034 750 HG3 ARG 100 1HG ARG 100 -7.604 -25.079 -19.446 751 HD2 ARG 100 2HD ARG 100 -5.922 -25.422 -17.703 752 HD3 ARG 100 1HD ARG 100 -6.843 -26.787 -16.967 753 HE ARG 100 HE ARG 100 -5.402 -26.747 -19.614 754 HH11 ARG 100 1HH2 ARG 100 -7.147 -28.772 -17.106 755 HH12 ARG 100 2HH2 ARG 100 -7.394 -30.073 -18.205 756 HH21 ARG 100 1HH1 ARG 100 -5.706 -28.643 -20.969 757 HH22 ARG 100 2HH1 ARG 100 -5.904 -30.183 -20.184 758 H ARG 101 H ARG 101 -12.217 -25.388 -17.586 759 HA ARG 101 HA ARG 101 -12.417 -27.360 -19.714 760 HB2 ARG 101 2HB ARG 101 -14.180 -26.624 -17.293 761 HB3 ARG 101 1HB ARG 101 -14.594 -27.942 -18.437 762 HG2 ARG 101 2HG ARG 101 -11.890 -27.919 -16.957 763 HG3 ARG 101 1HG ARG 101 -13.388 -28.508 -16.185 764 HD2 ARG 101 2HD ARG 101 -13.752 -30.178 -18.033 765 HD3 ARG 101 1HD ARG 101 -12.244 -29.606 -18.841 766 HE ARG 101 HE ARG 101 -11.000 -30.847 -17.400 767 HH11 ARG 101 1HH2 ARG 101 -13.983 -30.377 -15.363 768 HH12 ARG 101 2HH2 ARG 101 -14.018 -31.989 -14.878 769 HH21 ARG 101 1HH1 ARG 101 -11.241 -33.119 -16.772 770 HH22 ARG 101 2HH1 ARG 101 -12.389 -33.562 -15.615 771 H GLY 102 H GLY 102 -13.754 -24.221 -18.759 772 HA2 GLY 102 2HA GLY 102 -14.925 -22.740 -19.884 773 HA3 GLY 102 1HA GLY 102 -14.704 -23.748 -21.363 774 H HIS 103 H HIS 103 -16.298 -24.864 -18.337 775 HA HIS 103 HA HIS 103 -18.894 -24.799 -19.557 776 HB2 HIS 103 2HB HIS 103 -17.363 -27.482 -19.174 777 HB3 HIS 103 1HB HIS 103 -19.142 -27.363 -19.325 778 HD1 HIS 103 1HD HIS 103 -16.032 -26.630 -21.562 779 HD2 HIS 103 2HD HIS 103 -20.162 -27.487 -21.838 780 HE1 HIS 103 1HE HIS 103 -16.596 -26.862 -24.000 781 HE2 HIS 103 2HE HIS 103 -19.084 -27.400 -24.144 782 H1 SER 1 H SER 1 0.933 -13.528 -21.544 783 HA SER 1 HA SER 1 -1.194 -14.476 -22.664 784 HB2 SER 1 2HB SER 1 1.590 -15.750 -23.031 785 HB3 SER 1 1HB SER 1 0.292 -15.603 -24.282 786 HG SER 1 1HG SER 1 1.982 -14.004 -24.381 787 H ALA 2 H ALA 2 -1.188 -15.619 -19.920 788 HA ALA 2 HA ALA 2 -1.493 -18.475 -20.691 789 HB1 ALA 2 1HB ALA 2 -0.655 -17.419 -17.944 790 HB2 ALA 2 2HB ALA 2 0.454 -18.134 -19.158 791 HB3 ALA 2 3HB ALA 2 -0.836 -19.152 -18.430 792 H ASP 3 H ASP 3 -3.603 -16.757 -21.090 793 HA ASP 3 HA ASP 3 -5.673 -16.611 -20.927 794 HB2 ASP 3 2HB ASP 3 -5.315 -19.268 -20.478 795 HB3 ASP 3 1HB ASP 3 -6.254 -18.870 -18.997 796 H HIS 4 H HIS 4 -4.859 -17.525 -17.623 797 HA HIS 4 HA HIS 4 -6.641 -15.720 -16.371 798 HB2 HIS 4 2HB HIS 4 -5.575 -16.295 -14.293 799 HB3 HIS 4 1HB HIS 4 -5.579 -17.799 -15.262 800 HD1 HIS 4 1HD HIS 4 -2.932 -18.186 -16.504 801 HD2 HIS 4 2HD HIS 4 -3.315 -14.947 -13.971 802 HE1 HIS 4 1HE HIS 4 -0.606 -17.463 -15.898 803 HE2 HIS 4 2HE HIS 4 -0.896 -15.371 -14.659 804 H GLU 5 H GLU 5 -3.521 -15.269 -17.833 805 HA GLU 5 HA GLU 5 -2.628 -13.043 -16.334 806 HB2 GLU 5 2HB GLU 5 -1.627 -14.680 -18.493 807 HB3 GLU 5 1HB GLU 5 -1.680 -13.018 -19.143 808 HG2 GLU 5 2HG GLU 5 0.503 -13.260 -18.251 809 HG3 GLU 5 1HG GLU 5 -0.373 -12.284 -17.014 810 H ARG 6 H ARG 6 -4.833 -13.519 -19.113 811 HA ARG 6 HA ARG 6 -4.628 -10.857 -20.055 812 HB2 ARG 6 2HB ARG 6 -6.791 -12.997 -20.484 813 HB3 ARG 6 1HB ARG 6 -6.746 -11.407 -21.320 814 HG2 ARG 6 2HG ARG 6 -4.554 -11.980 -22.359 815 HG3 ARG 6 1HG ARG 6 -4.530 -13.557 -21.501 816 HD2 ARG 6 2HD ARG 6 -5.288 -13.752 -23.916 817 HD3 ARG 6 1HD ARG 6 -6.498 -14.356 -22.720 818 HE ARG 6 HE ARG 6 -6.592 -11.532 -23.867 819 HH11 ARG 6 1HH2 ARG 6 -8.435 -14.545 -22.933 820 HH12 ARG 6 2HH2 ARG 6 -9.624 -14.326 -24.147 821 HH21 ARG 6 1HH1 ARG 6 -8.601 -10.993 -25.077 822 HH22 ARG 6 2HH1 ARG 6 -9.898 -12.105 -25.081 823 H GLU 7 H GLU 7 -6.668 -12.489 -17.618 824 HA GLU 7 HA GLU 7 -8.541 -10.388 -17.555 825 HB2 GLU 7 2HB GLU 7 -8.746 -12.878 -16.647 826 HB3 GLU 7 1HB GLU 7 -8.122 -12.158 -15.127 827 HG2 GLU 7 2HG GLU 7 -10.569 -12.155 -15.031 828 HG3 GLU 7 1HG GLU 7 -10.053 -10.448 -15.276 829 H ALA 8 H ALA 8 -5.388 -10.857 -16.072 830 HA ALA 8 HA ALA 8 -5.644 -8.810 -14.111 831 HB1 ALA 8 1HB ALA 8 -3.801 -10.503 -13.954 832 HB2 ALA 8 2HB ALA 8 -3.131 -8.837 -14.060 833 HB3 ALA 8 3HB ALA 8 -3.108 -9.897 -15.505 834 H GLN 9 H GLN 9 -4.768 -8.899 -17.571 835 HA GLN 9 HA GLN 9 -3.833 -6.187 -17.582 836 HB2 GLN 9 2HB GLN 9 -4.805 -7.787 -20.001 837 HB3 GLN 9 1HB GLN 9 -3.717 -6.359 -20.012 838 HG2 GLN 9 2HG GLN 9 -2.988 -9.136 -18.821 839 HG3 GLN 9 1HG GLN 9 -2.630 -8.603 -20.486 840 HE21 GLN 9 1HE2 GLN 9 -2.133 -7.245 -17.096 841 HE22 GLN 9 2HE2 GLN 9 -0.482 -6.820 -17.363 842 H LYS 10 H LYS 10 -6.971 -7.778 -17.971 843 HA LYS 10 HA LYS 10 -8.324 -5.607 -19.146 844 HB2 LYS 10 2HB LYS 10 -9.298 -7.944 -19.002 845 HB3 LYS 10 1HB LYS 10 -9.455 -7.739 -17.227 846 HG2 LYS 10 2HG LYS 10 -10.977 -5.752 -17.616 847 HG3 LYS 10 1HG LYS 10 -10.893 -6.044 -19.380 848 HD2 LYS 10 2HD LYS 10 -11.948 -8.094 -17.299 849 HD3 LYS 10 1HD LYS 10 -12.939 -6.817 -18.080 850 HE2 LYS 10 2HE LYS 10 -12.043 -7.883 -20.375 851 HE3 LYS 10 1HE LYS 10 -11.728 -9.340 -19.344 852 HZ1 LYS 10 3HZ LYS 10 -13.912 -9.443 -20.280 853 HZ2 LYS 10 1HZ LYS 10 -14.278 -7.865 -19.755 854 HZ3 LYS 10 2HZ LYS 10 -14.088 -9.149 -18.617 855 H ALA 11 H ALA 11 -7.555 -6.471 -15.780 856 HA ALA 11 HA ALA 11 -9.145 -4.585 -14.502 857 HB1 ALA 11 1HB ALA 11 -7.681 -4.949 -12.535 858 HB2 ALA 11 2HB ALA 11 -6.402 -5.661 -13.578 859 HB3 ALA 11 3HB ALA 11 -7.971 -6.517 -13.351 860 H GLU 12 H GLU 12 -5.819 -4.319 -15.862 861 HA GLU 12 HA GLU 12 -5.326 -1.739 -14.873 862 HB2 GLU 12 2HB GLU 12 -4.199 -2.960 -17.472 863 HB3 GLU 12 1HB GLU 12 -3.607 -1.488 -16.634 864 HG2 GLU 12 2HG GLU 12 -3.088 -2.965 -14.590 865 HG3 GLU 12 1HG GLU 12 -3.433 -4.398 -15.623 866 H GLU 13 H GLU 13 -6.995 -2.874 -17.845 867 HA GLU 13 HA GLU 13 -7.083 -0.339 -19.080 868 HB2 GLU 13 2HB GLU 13 -7.632 -2.545 -20.306 869 HB3 GLU 13 1HB GLU 13 -9.205 -2.545 -19.446 870 HG2 GLU 13 2HG GLU 13 -9.589 -0.165 -20.462 871 HG3 GLU 13 1HG GLU 13 -8.130 -0.465 -21.463 872 H GLU 14 H GLU 14 -9.256 -2.051 -16.844 873 HA GLU 14 HA GLU 14 -11.421 -0.319 -16.873 874 HB2 GLU 14 2HB GLU 14 -11.375 -2.596 -15.738 875 HB3 GLU 14 1HB GLU 14 -10.294 -1.915 -14.490 876 HG2 GLU 14 2HG GLU 14 -12.486 -2.035 -13.518 877 HG3 GLU 14 1HG GLU 14 -12.150 -0.295 -13.799 878 H LEU 15 H LEU 15 -8.338 -0.179 -15.091 879 HA LEU 15 HA LEU 15 -9.098 1.814 -13.320 880 HB2 LEU 15 2HB LEU 15 -6.991 0.352 -13.189 881 HB3 LEU 15 1HB LEU 15 -6.246 1.417 -14.409 882 HG LEU 15 HG LEU 15 -6.488 3.381 -12.874 883 HD11 LEU 15 1HD1 LEU 15 -7.113 2.958 -10.421 884 HD12 LEU 15 2HD1 LEU 15 -7.755 1.358 -10.914 885 HD13 LEU 15 3HD1 LEU 15 -8.482 2.871 -11.570 886 HD21 LEU 15 3HD2 LEU 15 -4.393 2.038 -12.820 887 HD22 LEU 15 1HD2 LEU 15 -5.077 0.987 -11.525 888 HD23 LEU 15 2HD2 LEU 15 -4.771 2.727 -11.198 889 H GLN 16 H GLN 16 -7.670 1.992 -16.591 890 HA GLN 16 HA GLN 16 -7.209 4.778 -16.499 891 HB2 GLN 16 2HB GLN 16 -7.589 2.956 -18.940 892 HB3 GLN 16 1HB GLN 16 -6.945 4.635 -18.972 893 HG2 GLN 16 2HG GLN 16 -5.024 3.905 -17.483 894 HG3 GLN 16 1HG GLN 16 -5.632 2.204 -17.561 895 HE21 GLN 16 1HE2 GLN 16 -3.022 2.732 -18.542 896 HE22 GLN 16 2HE2 GLN 16 -3.041 2.605 -20.262 897 H LYS 17 H LYS 17 -10.014 2.841 -17.226 898 HA LYS 17 HA LYS 17 -11.512 4.759 -18.629 899 HB2 LYS 17 2HB LYS 17 -11.803 2.194 -18.426 900 HB3 LYS 17 1HB LYS 17 -12.555 2.483 -16.829 901 HG2 LYS 17 2HG LYS 17 -14.429 3.734 -17.947 902 HG3 LYS 17 1HG LYS 17 -13.568 3.597 -19.520 903 HD2 LYS 17 2HD LYS 17 -15.225 1.877 -19.578 904 HD3 LYS 17 1HD LYS 17 -13.651 1.062 -19.285 905 HE2 LYS 17 2HE LYS 17 -14.340 1.149 -16.711 906 HE3 LYS 17 1HE LYS 17 -15.988 1.560 -17.318 907 HZ1 LYS 17 3HZ LYS 17 -16.133 -0.668 -17.217 908 HZ2 LYS 17 1HZ LYS 17 -14.506 -0.932 -17.329 909 HZ3 LYS 17 2HZ LYS 17 -15.401 -0.652 -18.779 910 H VAL 18 H VAL 18 -11.341 3.853 -15.124 911 HA VAL 18 HA VAL 18 -13.307 5.821 -14.462 912 HB VAL 18 HB VAL 18 -12.846 5.301 -12.109 913 HG11 VAL 18 1HG1 VAL 18 -13.281 2.854 -13.966 914 HG12 VAL 18 2HG1 VAL 18 -14.538 4.073 -13.518 915 HG13 VAL 18 3HG1 VAL 18 -13.808 3.016 -12.249 916 HG21 VAL 18 3HG2 VAL 18 -10.854 3.214 -13.241 917 HG22 VAL 18 1HG2 VAL 18 -11.332 3.421 -11.526 918 HG23 VAL 18 2HG2 VAL 18 -10.376 4.702 -12.346 919 H LEU 19 H LEU 19 -9.822 5.939 -14.916 920 HA LEU 19 HA LEU 19 -9.312 8.246 -13.383 921 HB2 LEU 19 2HB LEU 19 -8.107 7.463 -16.124 922 HB3 LEU 19 1HB LEU 19 -7.529 8.832 -15.130 923 HG LEU 19 HG LEU 19 -7.377 5.880 -14.322 924 HD11 LEU 19 1HD1 LEU 19 -4.940 6.138 -14.683 925 HD12 LEU 19 2HD1 LEU 19 -5.168 7.850 -15.196 926 HD13 LEU 19 3HD1 LEU 19 -5.832 6.514 -16.203 927 HD21 LEU 19 3HD2 LEU 19 -5.876 6.762 -12.492 928 HD22 LEU 19 1HD2 LEU 19 -7.595 7.250 -12.288 929 HD23 LEU 19 2HD2 LEU 19 -6.384 8.429 -12.919 930 H GLU 20 H GLU 20 -10.544 7.806 -16.752 931 HA GLU 20 HA GLU 20 -10.547 10.593 -17.254 932 HB2 GLU 20 2HB GLU 20 -12.070 8.388 -18.748 933 HB3 GLU 20 1HB GLU 20 -12.024 10.124 -19.204 934 HG2 GLU 20 2HG GLU 20 -9.454 9.937 -19.314 935 HG3 GLU 20 1HG GLU 20 -9.651 8.149 -19.212 936 H GLU 21 H GLU 21 -13.037 8.306 -16.009 937 HA GLU 21 HA GLU 21 -15.063 10.280 -15.952 938 HB2 GLU 21 2HB GLU 21 -14.872 7.756 -14.205 939 HB3 GLU 21 1HB GLU 21 -16.320 8.793 -14.438 940 HG2 GLU 21 2HG GLU 21 -16.180 8.294 -16.953 941 HG3 GLU 21 1HG GLU 21 -14.905 7.078 -16.580 942 H ALA 22 H ALA 22 -12.501 9.378 -13.667 943 HA ALA 22 HA ALA 22 -13.389 10.813 -11.463 944 HB1 ALA 22 1HB ALA 22 -10.479 10.285 -12.342 945 HB2 ALA 22 2HB ALA 22 -11.477 9.186 -11.334 946 HB3 ALA 22 3HB ALA 22 -10.999 10.810 -10.706 947 H SER 23 H SER 23 -11.708 11.843 -14.401 948 HA SER 23 HA SER 23 -10.867 14.361 -13.516 949 HB2 SER 23 2HB SER 23 -10.179 13.129 -15.686 950 HB3 SER 23 1HB SER 23 -11.765 13.612 -16.381 951 HG SER 23 1HG SER 23 -10.228 15.079 -16.977 952 H LYS 24 H LYS 24 -13.893 13.250 -15.125 953 HA LYS 24 HA LYS 24 -15.124 15.758 -15.345 954 HB2 LYS 24 2HB LYS 24 -15.992 13.705 -16.554 955 HB3 LYS 24 1HB LYS 24 -16.467 12.994 -14.981 956 HG2 LYS 24 2HG LYS 24 -18.081 14.996 -14.660 957 HG3 LYS 24 1HG LYS 24 -17.643 15.508 -16.323 958 HD2 LYS 24 2HD LYS 24 -18.428 13.212 -17.134 959 HD3 LYS 24 1HD LYS 24 -19.028 12.865 -15.479 960 HE2 LYS 24 2HE LYS 24 -19.946 15.234 -17.269 961 HE3 LYS 24 1HE LYS 24 -20.806 13.653 -17.152 962 HZ1 LYS 24 3HZ LYS 24 -21.670 15.551 -15.843 963 HZ2 LYS 24 1HZ LYS 24 -20.398 15.489 -14.796 964 HZ3 LYS 24 2HZ LYS 24 -21.456 14.148 -14.924 965 H LYS 25 H LYS 25 -15.437 13.154 -12.889 966 HA LYS 25 HA LYS 25 -17.258 14.607 -11.315 967 HB2 LYS 25 2HB LYS 25 -15.416 12.263 -10.597 968 HB3 LYS 25 1HB LYS 25 -16.675 12.937 -9.499 969 HG2 LYS 25 2HG LYS 25 -18.452 12.452 -11.131 970 HG3 LYS 25 1HG LYS 25 -17.265 11.785 -12.305 971 HD2 LYS 25 2HD LYS 25 -16.680 9.947 -10.805 972 HD3 LYS 25 1HD LYS 25 -17.688 10.619 -9.479 973 HE2 LYS 25 2HE LYS 25 -18.781 9.577 -12.200 974 HE3 LYS 25 1HE LYS 25 -18.788 8.675 -10.632 975 HZ1 LYS 25 3HZ LYS 25 -20.855 9.576 -10.720 976 HZ2 LYS 25 1HZ LYS 25 -20.376 11.075 -11.392 977 HZ3 LYS 25 2HZ LYS 25 -20.069 10.685 -9.754 978 H ALA 26 H ALA 26 -13.634 14.423 -11.214 979 HA ALA 26 HA ALA 26 -13.375 15.781 -8.798 980 HB1 ALA 26 1HB ALA 26 -11.048 16.326 -9.539 981 HB2 ALA 26 2HB ALA 26 -11.460 15.809 -11.220 982 HB3 ALA 26 3HB ALA 26 -11.445 14.608 -9.885 983 H VAL 27 H VAL 27 -13.271 17.087 -12.214 984 HA VAL 27 HA VAL 27 -12.866 19.689 -11.201 985 HB VAL 27 HB VAL 27 -12.121 18.983 -13.442 986 HG11 VAL 27 1HG1 VAL 27 -13.643 18.922 -15.347 987 HG12 VAL 27 2HG1 VAL 27 -15.068 19.317 -14.324 988 HG13 VAL 27 3HG1 VAL 27 -14.234 17.736 -14.136 989 HG21 VAL 27 3HG2 VAL 27 -12.265 21.381 -12.754 990 HG22 VAL 27 1HG2 VAL 27 -13.950 21.478 -13.387 991 HG23 VAL 27 2HG2 VAL 27 -12.581 21.168 -14.517 992 H GLU 28 H GLU 28 -15.804 17.853 -12.046 993 HA GLU 28 HA GLU 28 -17.463 20.161 -11.949 994 HB2 GLU 28 2HB GLU 28 -17.871 18.116 -13.318 995 HB3 GLU 28 1HB GLU 28 -18.217 17.179 -11.838 996 HG2 GLU 28 2HG GLU 28 -20.302 18.277 -11.471 997 HG3 GLU 28 1HG GLU 28 -19.832 19.722 -12.440 998 H ALA 29 H ALA 29 -16.376 17.729 -9.584 999 HA ALA 29 HA ALA 29 -18.317 18.536 -7.651 1000 HB1 ALA 29 1HB ALA 29 -17.126 17.016 -6.161 1001 HB2 ALA 29 2HB ALA 29 -15.768 16.866 -7.331 1002 HB3 ALA 29 3HB ALA 29 -17.410 16.222 -7.724 1003 H GLU 30 H GLU 30 -14.793 19.275 -8.250 1004 HA GLU 30 HA GLU 30 -14.551 20.893 -5.964 1005 HB2 GLU 30 2HB GLU 30 -13.069 20.709 -8.606 1006 HB3 GLU 30 1HB GLU 30 -12.676 22.033 -7.475 1007 HG2 GLU 30 2HG GLU 30 -12.685 19.137 -6.451 1008 HG3 GLU 30 1HG GLU 30 -11.291 19.807 -7.372 1009 H ARG 31 H ARG 31 -16.010 21.573 -9.127 1010 HA ARG 31 HA ARG 31 -15.986 24.413 -8.707 1011 HB2 ARG 31 2HB ARG 31 -17.623 22.615 -10.547 1012 HB3 ARG 31 1HB ARG 31 -17.894 24.384 -10.492 1013 HG2 ARG 31 2HG ARG 31 -15.094 23.266 -11.108 1014 HG3 ARG 31 1HG ARG 31 -16.384 23.314 -12.343 1015 HD2 ARG 31 2HD ARG 31 -15.057 25.324 -12.643 1016 HD3 ARG 31 1HD ARG 31 -16.689 25.787 -12.004 1017 HE ARG 31 HE ARG 31 -14.604 25.376 -9.941 1018 HH11 ARG 31 1HH2 ARG 31 -16.053 27.797 -12.261 1019 HH12 ARG 31 2HH2 ARG 31 -15.162 29.096 -11.639 1020 HH21 ARG 31 1HH1 ARG 31 -13.666 27.360 -8.880 1021 HH22 ARG 31 2HH1 ARG 31 -13.982 28.902 -9.558 1022 H GLY 32 H GLY 32 -16.928 25.184 -6.883 1023 HA2 GLY 32 2HA GLY 32 -19.253 25.967 -6.406 1024 HA3 GLY 32 1HA GLY 32 -19.601 24.199 -6.185 1025 H ALA 33 H ALA 33 -16.652 23.865 -5.319 1026 HA ALA 33 HA ALA 33 -17.383 23.862 -2.630 1027 HB1 ALA 33 1HB ALA 33 -15.927 22.077 -3.611 1028 HB2 ALA 33 2HB ALA 33 -15.080 22.881 -2.242 1029 HB3 ALA 33 3HB ALA 33 -14.649 23.296 -3.937 1030 HA PRO 34 HA PRO 34 -15.497 27.738 -1.542 1031 HB2 PRO 34 2HB PRO 34 -15.190 27.492 1.234 1032 HB3 PRO 34 1HB PRO 34 -16.809 27.660 0.434 1033 HG2 PRO 34 2HG PRO 34 -15.412 25.078 1.326 1034 HG3 PRO 34 1HG PRO 34 -17.129 25.578 1.636 1035 HD2 PRO 34 2HD PRO 34 -16.400 23.887 -0.445 1036 HD3 PRO 34 1HD PRO 34 -17.764 25.082 -0.631 1037 H GLY 35 H GLY 35 -13.375 28.644 -1.281 1038 HA2 GLY 35 2HA GLY 35 -11.154 28.646 -0.899 1039 HA3 GLY 35 1HA GLY 35 -11.221 26.915 -0.369 1040 H ALA 36 H ALA 36 -12.076 25.459 -2.105 1041 HA ALA 36 HA ALA 36 -11.758 24.277 -3.853 1042 HB1 ALA 36 1HB ALA 36 -12.849 26.017 -5.243 1043 HB2 ALA 36 2HB ALA 36 -11.568 25.127 -6.143 1044 HB3 ALA 36 3HB ALA 36 -11.238 26.793 -5.522 1045 H ALA 37 H ALA 37 -10.077 23.256 -5.187 1046 HA ALA 37 HA ALA 37 -7.367 24.311 -4.609 1047 HB1 ALA 37 1HB ALA 37 -8.477 21.490 -4.143 1048 HB2 ALA 37 2HB ALA 37 -7.898 22.602 -2.864 1049 HB3 ALA 37 3HB ALA 37 -6.722 21.919 -4.042 1050 H LEU 38 H LEU 38 -9.506 22.053 -6.496 1051 HA LEU 38 HA LEU 38 -7.462 22.166 -8.652 1052 HB2 LEU 38 2HB LEU 38 -7.432 19.867 -7.806 1053 HB3 LEU 38 1HB LEU 38 -9.203 19.870 -7.639 1054 HG LEU 38 HG LEU 38 -9.552 19.799 -10.045 1055 HD11 LEU 38 1HD1 LEU 38 -7.884 19.629 -11.750 1056 HD12 LEU 38 2HD1 LEU 38 -6.535 19.502 -10.576 1057 HD13 LEU 38 3HD1 LEU 38 -7.412 21.068 -10.793 1058 HD21 LEU 38 3HD2 LEU 38 -7.555 17.644 -9.128 1059 HD22 LEU 38 1HD2 LEU 38 -8.770 17.489 -10.452 1060 HD23 LEU 38 2HD2 LEU 38 -9.309 17.703 -8.751 1061 H ILE 39 H ILE 39 -8.267 23.493 -10.262 1062 HA ILE 39 HA ILE 39 -11.004 22.893 -11.077 1063 HB ILE 39 HB ILE 39 -11.367 25.422 -11.438 1064 HG12 ILE 39 2HG1 ILE 39 -9.344 25.558 -9.088 1065 HG13 ILE 39 1HG1 ILE 39 -9.016 26.121 -10.759 1066 HG21 ILE 39 1HG2 ILE 39 -11.483 24.233 -8.584 1067 HG22 ILE 39 2HG2 ILE 39 -12.653 23.880 -9.897 1068 HG23 ILE 39 3HG2 ILE 39 -12.512 25.554 -9.233 1069 HD11 ILE 39 3HD ILE 39 -11.117 27.263 -8.801 1070 HD12 ILE 39 1HD ILE 39 -9.620 28.056 -9.388 1071 HD13 ILE 39 2HD ILE 39 -10.973 27.753 -10.538 1072 H SER 40 H SER 40 -9.821 21.702 -12.803 1073 HA SER 40 HA SER 40 -9.459 23.473 -15.005 1074 HB2 SER 40 2HB SER 40 -7.204 21.488 -14.281 1075 HB3 SER 40 1HB SER 40 -7.217 22.618 -15.686 1076 HG SER 40 1HG SER 40 -5.827 23.203 -13.962 1077 H TYR 41 H TYR 41 -9.507 22.074 -16.980 1078 HA TYR 41 HA TYR 41 -10.536 19.378 -16.477 1079 HB2 TYR 41 2HB TYR 41 -10.494 21.178 -18.953 1080 HB3 TYR 41 1HB TYR 41 -10.584 19.392 -19.155 1081 HD1 TYR 41 2HD TYR 41 -12.402 22.373 -17.806 1082 HD2 TYR 41 1HD TYR 41 -12.483 18.123 -18.490 1083 HE1 TYR 41 2HE TYR 41 -14.834 22.354 -17.410 1084 HE2 TYR 41 1HE TYR 41 -14.910 18.103 -18.097 1085 HH TYR 41 HH TYR 41 -16.783 21.075 -17.415 1086 HA PRO 42 HA PRO 42 -6.861 18.026 -18.909 1087 HB2 PRO 42 2HB PRO 42 -4.689 19.694 -19.607 1088 HB3 PRO 42 1HB PRO 42 -6.163 19.503 -20.628 1089 HG2 PRO 42 2HG PRO 42 -5.581 21.694 -18.557 1090 HG3 PRO 42 1HG PRO 42 -6.147 21.890 -20.270 1091 HD2 PRO 42 2HD PRO 42 -7.921 21.918 -18.186 1092 HD3 PRO 42 1HD PRO 42 -8.343 21.046 -19.734 1093 H ASP 43 H ASP 43 -6.496 20.109 -16.184 1094 HA ASP 43 HA ASP 43 -4.030 18.760 -15.361 1095 HB2 ASP 43 2HB ASP 43 -5.519 20.697 -13.533 1096 HB3 ASP 43 1HB ASP 43 -3.829 20.147 -13.460 1097 H ALA 44 H ALA 44 -7.543 18.538 -15.033 1098 HA ALA 44 HA ALA 44 -7.559 17.489 -12.388 1099 HB1 ALA 44 1HB ALA 44 -9.699 18.378 -13.201 1100 HB2 ALA 44 2HB ALA 44 -9.885 16.620 -12.971 1101 HB3 ALA 44 3HB ALA 44 -9.665 17.277 -14.632 1102 H ILE 45 H ILE 45 -7.475 16.119 -15.669 1103 HA ILE 45 HA ILE 45 -7.654 13.471 -14.818 1104 HB ILE 45 HB ILE 45 -8.171 14.199 -17.074 1105 HG12 ILE 45 2HG1 ILE 45 -5.934 12.088 -17.070 1106 HG13 ILE 45 1HG1 ILE 45 -7.629 11.810 -16.558 1107 HG21 ILE 45 1HG2 ILE 45 -5.133 14.608 -17.471 1108 HG22 ILE 45 2HG2 ILE 45 -6.366 15.916 -17.349 1109 HG23 ILE 45 3HG2 ILE 45 -6.412 14.771 -18.723 1110 HD11 ILE 45 3HD ILE 45 -6.710 12.655 -19.394 1111 HD12 ILE 45 1HD ILE 45 -7.315 11.040 -18.888 1112 HD13 ILE 45 2HD ILE 45 -8.427 12.455 -18.877 1113 H TRP 46 H TRP 46 -4.951 15.698 -14.753 1114 HA TRP 46 HA TRP 46 -2.941 13.674 -14.743 1115 HB2 TRP 46 2HB TRP 46 -2.773 16.288 -15.311 1116 HB3 TRP 46 1HB TRP 46 -2.495 16.461 -13.549 1117 HD1 TRP 46 HD TRP 46 -0.023 15.345 -12.693 1118 HE1 TRP 46 1HE TRP 46 2.028 14.576 -13.993 1119 HE3 TRP 46 3HE TRP 46 -2.088 15.286 -17.356 1120 HZ2 TRP 46 2HZ TRP 46 2.734 14.123 -16.768 1121 HZ3 TRP 46 3HZ TRP 46 -0.689 14.664 -19.297 1122 HH2 TRP 46 HH TRP 46 1.697 14.092 -19.003 1123 H TRP 47 H TRP 47 -4.678 15.637 -12.338 1124 HA TRP 47 HA TRP 47 -3.466 14.621 -10.013 1125 HB2 TRP 47 2HB TRP 47 -4.763 16.716 -10.001 1126 HB3 TRP 47 1HB TRP 47 -6.229 15.852 -10.577 1127 HD1 TRP 47 HD TRP 47 -4.043 16.073 -7.294 1128 HE1 TRP 47 1HE TRP 47 -5.384 15.034 -5.453 1129 HE3 TRP 47 3HE TRP 47 -8.082 14.516 -9.985 1130 HZ2 TRP 47 2HZ TRP 47 -8.061 14.060 -5.008 1131 HZ3 TRP 47 3HZ TRP 47 -9.946 13.404 -8.811 1132 HH2 TRP 47 HH TRP 47 -9.953 13.204 -6.352 1133 H SER 48 H SER 48 -6.198 13.434 -12.082 1134 HA SER 48 HA SER 48 -7.093 11.519 -10.311 1135 HB2 SER 48 2HB SER 48 -6.956 11.191 -13.374 1136 HB3 SER 48 1HB SER 48 -8.000 10.257 -12.243 1137 HG SER 48 1HG SER 48 -9.115 11.929 -13.236 1138 H VAL 49 H VAL 49 -4.235 11.379 -12.502 1139 HA VAL 49 HA VAL 49 -4.033 8.584 -12.500 1140 HB VAL 49 HB VAL 49 -1.647 10.475 -12.818 1141 HG11 VAL 49 1HG1 VAL 49 -0.860 8.639 -14.352 1142 HG12 VAL 49 2HG1 VAL 49 -2.330 7.671 -13.967 1143 HG13 VAL 49 3HG1 VAL 49 -1.107 8.021 -12.690 1144 HG21 VAL 49 3HG2 VAL 49 -3.900 9.783 -14.815 1145 HG22 VAL 49 1HG2 VAL 49 -2.272 10.387 -15.307 1146 HG23 VAL 49 2HG2 VAL 49 -3.314 11.406 -14.277 1147 H GLU 50 H GLU 50 -2.507 11.094 -10.430 1148 HA GLU 50 HA GLU 50 -0.859 9.319 -8.977 1149 HB2 GLU 50 2HB GLU 50 -0.840 11.218 -7.217 1150 HB3 GLU 50 1HB GLU 50 -0.210 11.604 -8.837 1151 HG2 GLU 50 2HG GLU 50 -2.383 12.696 -9.453 1152 HG3 GLU 50 1HG GLU 50 -3.037 12.309 -7.819 1153 H THR 51 H THR 51 -4.216 10.395 -8.627 1154 HA THR 51 HA THR 51 -4.559 9.535 -5.995 1155 HB THR 51 HB THR 51 -6.664 9.848 -8.209 1156 HG1 THR 51 1HG THR 51 -5.565 11.815 -7.835 1157 HG21 THR 51 3HG2 THR 51 -7.547 8.590 -6.197 1158 HG22 THR 51 1HG2 THR 51 -8.221 10.256 -6.258 1159 HG23 THR 51 2HG2 THR 51 -6.886 9.866 -5.112 1160 H ALA 52 H ALA 52 -5.023 7.869 -9.139 1161 HA ALA 52 HA ALA 52 -6.271 5.583 -7.992 1162 HB1 ALA 52 1HB ALA 52 -4.792 5.954 -10.671 1163 HB2 ALA 52 2HB ALA 52 -6.570 6.139 -10.393 1164 HB3 ALA 52 3HB ALA 52 -5.796 4.523 -10.238 1165 H THR 53 H THR 53 -2.936 6.612 -8.094 1166 HA THR 53 HA THR 53 -2.006 3.851 -7.739 1167 HB THR 53 HB THR 53 0.290 5.130 -7.802 1168 HG1 THR 53 1HG THR 53 -1.376 6.887 -9.336 1169 HG21 THR 53 3HG2 THR 53 0.312 4.852 -10.287 1170 HG22 THR 53 1HG2 THR 53 -1.493 4.740 -10.310 1171 HG23 THR 53 2HG2 THR 53 -0.517 3.469 -9.486 1172 H THR 54 H THR 54 -3.370 6.247 -5.932 1173 HA THR 54 HA THR 54 -3.494 6.708 -3.859 1174 HB THR 54 HB THR 54 -2.983 4.879 -2.136 1175 HG1 THR 54 1HG THR 54 -1.590 3.884 -4.037 1176 HG21 THR 54 3HG2 THR 54 -4.965 3.583 -2.934 1177 HG22 THR 54 1HG2 THR 54 -4.796 4.290 -4.584 1178 HG23 THR 54 2HG2 THR 54 -5.215 5.349 -3.186 1179 H VAL 55 H VAL 55 -1.087 7.818 -5.086 1180 HA VAL 55 HA VAL 55 0.220 8.428 -2.550 1181 HB VAL 55 HB VAL 55 2.439 8.594 -3.943 1182 HG11 VAL 55 1HG1 VAL 55 2.060 7.236 -1.872 1183 HG12 VAL 55 2HG1 VAL 55 3.099 6.373 -3.054 1184 HG13 VAL 55 3HG1 VAL 55 1.367 5.901 -2.859 1185 HG21 VAL 55 3HG2 VAL 55 1.350 7.813 -6.139 1186 HG22 VAL 55 1HG2 VAL 55 1.031 6.215 -5.368 1187 HG23 VAL 55 2HG2 VAL 55 2.717 6.774 -5.591 1188 H GLY 56 H GLY 56 -1.233 10.142 -2.702 1189 HA2 GLY 56 2HA GLY 56 -0.800 12.076 -4.867 1190 HA3 GLY 56 1HA GLY 56 -2.043 12.057 -3.541 1191 H TYR 57 H TYR 57 0.819 13.529 -4.451 1192 HA TYR 57 HA TYR 57 2.201 13.238 -1.927 1193 HB2 TYR 57 2HB TYR 57 2.904 14.666 -4.579 1194 HB3 TYR 57 1HB TYR 57 3.889 14.872 -3.087 1195 HD1 TYR 57 1HD TYR 57 2.563 12.111 -5.359 1196 HD2 TYR 57 2HD TYR 57 5.608 13.419 -2.618 1197 HE1 TYR 57 1HE TYR 57 3.906 10.127 -5.897 1198 HE2 TYR 57 2HE TYR 57 6.970 11.471 -3.193 1199 HH TYR 57 HH TYR 57 7.102 9.459 -4.311 1200 H GLY 58 H GLY 58 1.876 16.360 -3.778 1201 HA2 GLY 58 2HA GLY 58 0.199 17.432 -1.702 1202 HA3 GLY 58 1HA GLY 58 1.946 17.922 -1.581 1203 H ASP 59 H ASP 59 0.159 17.045 -4.462 1204 HA ASP 59 HA ASP 59 1.014 19.474 -5.745 1205 HB2 ASP 59 2HB ASP 59 -0.342 16.881 -6.725 1206 HB3 ASP 59 1HB ASP 59 -0.032 18.309 -7.790 1207 H ARG 60 H ARG 60 -2.160 17.653 -5.388 1208 HA ARG 60 HA ARG 60 -3.404 20.142 -4.733 1209 HB2 ARG 60 2HB ARG 60 -4.565 18.409 -7.017 1210 HB3 ARG 60 1HB ARG 60 -5.353 19.820 -6.233 1211 HG2 ARG 60 2HG ARG 60 -3.271 21.180 -6.989 1212 HG3 ARG 60 1HG ARG 60 -2.895 19.802 -8.078 1213 HD2 ARG 60 2HD ARG 60 -5.116 20.061 -9.201 1214 HD3 ARG 60 1HD ARG 60 -5.578 21.378 -8.050 1215 HE ARG 60 HE ARG 60 -3.877 21.615 -10.412 1216 HH11 ARG 60 1HH2 ARG 60 -4.755 23.185 -7.294 1217 HH12 ARG 60 2HH2 ARG 60 -3.543 24.367 -7.350 1218 HH21 ARG 60 1HH1 ARG 60 -2.703 23.656 -10.841 1219 HH22 ARG 60 2HH1 ARG 60 -2.388 24.718 -9.550 1220 H TYR 61 H TYR 61 -5.867 19.406 -4.022 1221 HA TYR 61 HA TYR 61 -6.012 16.729 -3.204 1222 HB2 TYR 61 2HB TYR 61 -6.398 17.588 -0.689 1223 HB3 TYR 61 1HB TYR 61 -4.720 17.249 -1.239 1224 HD1 TYR 61 1HD TYR 61 -7.159 19.954 -0.468 1225 HD2 TYR 61 2HD TYR 61 -3.116 19.014 -1.575 1226 HE1 TYR 61 1HE TYR 61 -6.510 22.284 -0.035 1227 HE2 TYR 61 2HE TYR 61 -2.447 21.352 -1.152 1228 HH TYR 61 HH TYR 61 -4.693 23.732 0.217 1229 HA PRO 62 HA PRO 62 -10.055 18.741 -3.646 1230 HB2 PRO 62 2HB PRO 62 -11.760 16.795 -2.581 1231 HB3 PRO 62 1HB PRO 62 -10.857 16.538 -4.124 1232 HG2 PRO 62 2HG PRO 62 -10.165 15.554 -1.310 1233 HG3 PRO 62 1HG PRO 62 -10.105 14.624 -2.860 1234 HD2 PRO 62 2HD PRO 62 -7.891 15.889 -1.631 1235 HD3 PRO 62 1HD PRO 62 -7.999 15.595 -3.428 1236 H VAL 63 H VAL 63 -12.102 19.421 -2.157 1237 HA VAL 63 HA VAL 63 -10.937 20.151 0.414 1238 HB VAL 63 HB VAL 63 -13.362 21.390 -0.931 1239 HG11 VAL 63 1HG1 VAL 63 -11.453 22.313 1.346 1240 HG12 VAL 63 2HG1 VAL 63 -13.170 21.815 1.577 1241 HG13 VAL 63 3HG1 VAL 63 -12.785 23.293 0.631 1242 HG21 VAL 63 3HG2 VAL 63 -10.358 22.094 -1.075 1243 HG22 VAL 63 1HG2 VAL 63 -11.700 23.199 -1.565 1244 HG23 VAL 63 2HG2 VAL 63 -11.447 21.658 -2.440 1245 H THR 64 H THR 64 -14.398 19.769 -0.264 1246 HA THR 64 HA THR 64 -14.836 17.890 1.722 1247 HB THR 64 HB THR 64 -15.453 20.794 2.519 1248 HG1 THR 64 1HG THR 64 -13.347 19.472 2.849 1249 HG21 THR 64 3HG2 THR 64 -16.396 19.853 4.649 1250 HG22 THR 64 1HG2 THR 64 -16.227 18.182 4.008 1251 HG23 THR 64 2HG2 THR 64 -17.376 19.341 3.237 1252 H GLU 65 H GLU 65 -16.085 20.569 -0.304 1253 HA GLU 65 HA GLU 65 -18.785 19.560 -0.009 1254 HB2 GLU 65 2HB GLU 65 -18.108 22.075 0.063 1255 HB3 GLU 65 1HB GLU 65 -18.052 21.958 -1.731 1256 HG2 GLU 65 2HG GLU 65 -20.459 21.234 -1.739 1257 HG3 GLU 65 1HG GLU 65 -20.468 21.206 0.063 1258 H GLU 66 H GLU 66 -16.074 19.315 -2.229 1259 HA GLU 66 HA GLU 66 -17.447 18.624 -4.538 1260 HB2 GLU 66 2HB GLU 66 -15.299 17.734 -5.317 1261 HB3 GLU 66 1HB GLU 66 -15.017 19.253 -4.435 1262 HG2 GLU 66 2HG GLU 66 -14.394 16.379 -3.502 1263 HG3 GLU 66 1HG GLU 66 -13.262 17.734 -3.914 1264 H GLY 67 H GLY 67 -16.445 16.908 -1.645 1265 HA2 GLY 67 2HA GLY 67 -17.813 15.236 -0.690 1266 HA3 GLY 67 1HA GLY 67 -18.299 14.699 -2.370 1267 H ARG 68 H ARG 68 -15.630 15.055 -0.087 1268 HA ARG 68 HA ARG 68 -13.514 14.406 -1.536 1269 HB2 ARG 68 2HB ARG 68 -13.745 15.147 0.878 1270 HB3 ARG 68 1HB ARG 68 -14.113 13.450 1.344 1271 HG2 ARG 68 2HG ARG 68 -11.797 12.786 0.629 1272 HG3 ARG 68 1HG ARG 68 -11.535 14.448 -0.010 1273 HD2 ARG 68 2HD ARG 68 -11.894 15.367 2.375 1274 HD3 ARG 68 1HD ARG 68 -11.962 13.655 2.958 1275 HE ARG 68 HE ARG 68 -9.652 13.664 2.916 1276 HH11 ARG 68 1HH2 ARG 68 -10.692 16.654 1.174 1277 HH12 ARG 68 2HH2 ARG 68 -9.112 17.128 0.906 1278 HH21 ARG 68 1HH1 ARG 68 -7.511 14.255 2.289 1279 HH22 ARG 68 2HH1 ARG 68 -7.331 15.831 1.595 1280 H LYS 69 H LYS 69 -16.090 12.342 -0.701 1281 HA LYS 69 HA LYS 69 -15.095 9.780 -0.986 1282 HB2 LYS 69 2HB LYS 69 -17.819 10.869 -1.923 1283 HB3 LYS 69 1HB LYS 69 -17.406 9.150 -1.618 1284 HG2 LYS 69 2HG LYS 69 -17.657 11.404 0.489 1285 HG3 LYS 69 1HG LYS 69 -18.734 10.007 0.193 1286 HD2 LYS 69 2HD LYS 69 -16.457 8.604 0.639 1287 HD3 LYS 69 1HD LYS 69 -15.956 10.092 1.486 1288 HE2 LYS 69 2HE LYS 69 -16.893 8.445 3.074 1289 HE3 LYS 69 1HE LYS 69 -18.000 9.877 3.005 1290 HZ1 LYS 69 3HZ LYS 69 -19.005 7.563 2.940 1291 HZ2 LYS 69 1HZ LYS 69 -18.418 7.438 1.349 1292 HZ3 LYS 69 2HZ LYS 69 -19.546 8.668 1.750 1293 H VAL 70 H VAL 70 -15.528 12.315 -3.441 1294 HA VAL 70 HA VAL 70 -15.651 10.635 -5.680 1295 HB VAL 70 HB VAL 70 -14.650 13.495 -5.290 1296 HG11 VAL 70 1HG1 VAL 70 -14.793 13.703 -7.810 1297 HG12 VAL 70 2HG1 VAL 70 -14.981 11.910 -7.933 1298 HG13 VAL 70 3HG1 VAL 70 -13.456 12.627 -7.291 1299 HG21 VAL 70 3HG2 VAL 70 -16.819 14.048 -6.395 1300 HG22 VAL 70 1HG2 VAL 70 -17.123 13.048 -4.937 1301 HG23 VAL 70 2HG2 VAL 70 -17.206 12.290 -6.569 1302 H ALA 71 H ALA 71 -12.901 11.924 -3.763 1303 HA ALA 71 HA ALA 71 -10.942 10.841 -5.553 1304 HB1 ALA 71 1HB ALA 71 -9.298 11.395 -3.771 1305 HB2 ALA 71 2HB ALA 71 -10.640 11.728 -2.609 1306 HB3 ALA 71 3HB ALA 71 -10.398 12.786 -4.048 1307 H GLU 72 H GLU 72 -12.499 9.883 -2.496 1308 HA GLU 72 HA GLU 72 -11.066 7.652 -1.813 1309 HB2 GLU 72 2HB GLU 72 -13.015 8.667 -0.469 1310 HB3 GLU 72 1HB GLU 72 -14.125 7.937 -1.669 1311 HG2 GLU 72 2HG GLU 72 -12.652 5.691 -0.814 1312 HG3 GLU 72 1HG GLU 72 -12.702 6.692 0.673 1313 H GLN 73 H GLN 73 -13.848 7.893 -4.056 1314 HA GLN 73 HA GLN 73 -14.130 5.217 -4.631 1315 HB2 GLN 73 2HB GLN 73 -15.715 7.100 -5.292 1316 HB3 GLN 73 1HB GLN 73 -14.535 7.589 -6.547 1317 HG2 GLN 73 2HG GLN 73 -14.854 5.208 -7.590 1318 HG3 GLN 73 1HG GLN 73 -16.139 4.934 -6.361 1319 HE21 GLN 73 1HE2 GLN 73 -15.119 7.580 -8.663 1320 HE22 GLN 73 2HE2 GLN 73 -16.713 7.884 -9.282 1321 H VAL 74 H VAL 74 -11.875 7.611 -6.049 1322 HA VAL 74 HA VAL 74 -11.083 5.904 -8.202 1323 HB VAL 74 HB VAL 74 -9.742 8.406 -7.051 1324 HG11 VAL 74 1HG1 VAL 74 -8.685 8.559 -9.345 1325 HG12 VAL 74 2HG1 VAL 74 -9.402 6.961 -9.778 1326 HG13 VAL 74 3HG1 VAL 74 -8.165 7.080 -8.475 1327 HG21 VAL 74 3HG2 VAL 74 -11.740 8.071 -9.393 1328 HG22 VAL 74 1HG2 VAL 74 -10.938 9.605 -8.868 1329 HG23 VAL 74 2HG2 VAL 74 -12.126 8.808 -7.800 1330 H MET 75 H MET 75 -9.829 6.771 -4.955 1331 HA MET 75 HA MET 75 -7.397 5.407 -5.116 1332 HB2 MET 75 2HB MET 75 -9.239 5.870 -2.687 1333 HB3 MET 75 1HB MET 75 -7.549 5.279 -2.571 1334 HG2 MET 75 2HG MET 75 -6.641 7.350 -3.410 1335 HG3 MET 75 1HG MET 75 -8.245 7.950 -3.907 1336 HE1 MET 75 3HE MET 75 -7.757 10.200 -2.830 1337 HE2 MET 75 1HE MET 75 -6.152 9.597 -2.307 1338 HE3 MET 75 2HE MET 75 -7.215 10.443 -1.133 1339 H LYS 76 H LYS 76 -10.632 4.331 -3.963 1340 HA LYS 76 HA LYS 76 -9.762 1.766 -3.247 1341 HB2 LYS 76 2HB LYS 76 -11.922 2.941 -2.494 1342 HB3 LYS 76 1HB LYS 76 -12.617 2.512 -4.092 1343 HG2 LYS 76 2HG LYS 76 -12.129 0.052 -3.553 1344 HG3 LYS 76 1HG LYS 76 -11.535 0.563 -1.938 1345 HD2 LYS 76 2HD LYS 76 -13.814 1.466 -1.395 1346 HD3 LYS 76 1HD LYS 76 -14.372 1.029 -3.053 1347 HE2 LYS 76 2HE LYS 76 -13.837 -1.421 -2.545 1348 HE3 LYS 76 1HE LYS 76 -13.450 -0.947 -0.841 1349 HZ1 LYS 76 3HZ LYS 76 -16.060 -0.577 -2.243 1350 HZ2 LYS 76 1HZ LYS 76 -15.724 -0.127 -0.620 1351 HZ3 LYS 76 2HZ LYS 76 -15.666 -1.771 -1.068 1352 H ALA 77 H ALA 77 -10.852 3.110 -6.353 1353 HA ALA 77 HA ALA 77 -11.278 0.640 -7.645 1354 HB1 ALA 77 1HB ALA 77 -11.049 1.901 -9.779 1355 HB2 ALA 77 2HB ALA 77 -10.365 3.310 -8.886 1356 HB3 ALA 77 3HB ALA 77 -12.079 2.823 -8.618 1357 H GLY 78 H GLY 78 -8.376 2.652 -7.121 1358 HA2 GLY 78 2HA GLY 78 -6.643 1.223 -8.821 1359 HA3 GLY 78 1HA GLY 78 -6.224 2.270 -7.413 1360 H ILE 79 H ILE 79 -7.336 0.991 -5.315 1361 HA ILE 79 HA ILE 79 -5.587 -1.072 -4.714 1362 HB ILE 79 HB ILE 79 -8.313 -0.371 -3.514 1363 HG12 ILE 79 2HG1 ILE 79 -5.443 0.310 -2.591 1364 HG13 ILE 79 1HG1 ILE 79 -6.508 1.439 -3.464 1365 HG21 ILE 79 1HG2 ILE 79 -7.735 -2.724 -2.897 1366 HG22 ILE 79 2HG2 ILE 79 -7.520 -1.669 -1.477 1367 HG23 ILE 79 3HG2 ILE 79 -6.082 -2.213 -2.414 1368 HD11 ILE 79 3HD ILE 79 -7.056 0.268 -0.657 1369 HD12 ILE 79 1HD ILE 79 -6.571 1.948 -1.062 1370 HD13 ILE 79 2HD ILE 79 -8.184 1.332 -1.576 1371 H GLU 80 H GLU 80 -9.023 -1.232 -5.909 1372 HA GLU 80 HA GLU 80 -9.192 -4.006 -5.700 1373 HB2 GLU 80 2HB GLU 80 -10.725 -2.124 -7.595 1374 HB3 GLU 80 1HB GLU 80 -10.919 -3.906 -7.637 1375 HG2 GLU 80 2HG GLU 80 -11.507 -3.796 -5.109 1376 HG3 GLU 80 1HG GLU 80 -11.787 -2.036 -5.390 1377 H VAL 81 H VAL 81 -8.260 -2.037 -8.606 1378 HA VAL 81 HA VAL 81 -8.282 -4.316 -10.230 1379 HB VAL 81 HB VAL 81 -7.083 -2.953 -11.924 1380 HG11 VAL 81 1HG1 VAL 81 -9.468 -1.584 -10.493 1381 HG12 VAL 81 2HG1 VAL 81 -9.576 -2.946 -11.666 1382 HG13 VAL 81 3HG1 VAL 81 -8.962 -1.342 -12.203 1383 HG21 VAL 81 3HG2 VAL 81 -5.599 -1.584 -10.446 1384 HG22 VAL 81 1HG2 VAL 81 -7.038 -0.808 -9.696 1385 HG23 VAL 81 2HG2 VAL 81 -6.664 -0.540 -11.422 1386 H PHE 82 H PHE 82 -5.606 -2.776 -8.400 1387 HA PHE 82 HA PHE 82 -3.655 -4.512 -9.558 1388 HB2 PHE 82 2HB PHE 82 -3.519 -2.830 -6.969 1389 HB3 PHE 82 1HB PHE 82 -2.119 -3.667 -7.732 1390 HD1 PHE 82 1HD PHE 82 -2.386 -3.070 -10.622 1391 HD2 PHE 82 2HD PHE 82 -3.127 -0.559 -7.206 1392 HE1 PHE 82 1HE PHE 82 -1.964 -1.073 -11.996 1393 HE2 PHE 82 2HE PHE 82 -2.710 1.440 -8.585 1394 HZ PHE 82 HZ PHE 82 -2.123 1.195 -10.987 1395 H ALA 83 H ALA 83 -5.648 -4.526 -6.550 1396 HA ALA 83 HA ALA 83 -4.348 -6.708 -5.409 1397 HB1 ALA 83 1HB ALA 83 -7.296 -5.865 -5.092 1398 HB2 ALA 83 2HB ALA 83 -5.919 -5.263 -4.104 1399 HB3 ALA 83 3HB ALA 83 -6.401 -6.988 -3.999 1400 H LEU 84 H LEU 84 -6.958 -6.509 -7.814 1401 HA LEU 84 HA LEU 84 -7.757 -9.175 -7.765 1402 HB2 LEU 84 2HB LEU 84 -8.948 -7.252 -8.836 1403 HB3 LEU 84 1HB LEU 84 -7.752 -7.233 -10.161 1404 HG LEU 84 HG LEU 84 -9.247 -9.828 -9.567 1405 HD11 LEU 84 1HD1 LEU 84 -11.035 -8.118 -9.382 1406 HD12 LEU 84 2HD1 LEU 84 -11.242 -9.112 -10.867 1407 HD13 LEU 84 3HD1 LEU 84 -10.582 -7.436 -10.989 1408 HD21 LEU 84 3HD2 LEU 84 -7.590 -9.804 -11.459 1409 HD22 LEU 84 1HD2 LEU 84 -8.482 -8.445 -12.231 1410 HD23 LEU 84 2HD2 LEU 84 -9.262 -10.058 -12.061 1411 H VAL 85 H VAL 85 -4.940 -7.634 -9.261 1412 HA VAL 85 HA VAL 85 -4.322 -9.666 -11.092 1413 HB VAL 85 HB VAL 85 -2.533 -7.563 -9.780 1414 HG11 VAL 85 1HG1 VAL 85 -1.015 -9.198 -10.648 1415 HG12 VAL 85 2HG1 VAL 85 -1.108 -7.910 -11.890 1416 HG13 VAL 85 3HG1 VAL 85 -1.987 -9.462 -12.151 1417 HG21 VAL 85 3HG2 VAL 85 -4.412 -6.590 -11.058 1418 HG22 VAL 85 1HG2 VAL 85 -4.094 -7.651 -12.461 1419 HG23 VAL 85 2HG2 VAL 85 -2.908 -6.378 -11.993 1420 H THR 86 H THR 86 -4.140 -9.616 -7.624 1421 HA THR 86 HA THR 86 -2.135 -11.451 -7.163 1422 HB THR 86 HB THR 86 -4.796 -11.311 -5.672 1423 HG1 THR 86 1HG THR 86 -4.069 -9.352 -5.522 1424 HG21 THR 86 3HG2 THR 86 -1.931 -12.182 -4.827 1425 HG22 THR 86 1HG2 THR 86 -3.353 -13.276 -4.999 1426 HG23 THR 86 2HG2 THR 86 -3.346 -12.017 -3.721 1427 H ALA 87 H ALA 87 -5.251 -11.936 -8.794 1428 HA ALA 87 HA ALA 87 -5.396 -14.727 -8.379 1429 HB1 ALA 87 1HB ALA 87 -6.930 -14.726 -10.365 1430 HB2 ALA 87 2HB ALA 87 -6.431 -13.032 -10.739 1431 HB3 ALA 87 3HB ALA 87 -7.332 -13.392 -9.227 1432 H ALA 88 H ALA 88 -3.540 -12.739 -10.645 1433 HA ALA 88 HA ALA 88 -2.850 -15.037 -12.264 1434 HB1 ALA 88 1HB ALA 88 -1.852 -12.091 -12.254 1435 HB2 ALA 88 2HB ALA 88 -3.041 -12.774 -13.419 1436 HB3 ALA 88 3HB ALA 88 -1.324 -13.315 -13.451 1437 H LEU 89 H LEU 89 -1.455 -12.803 -9.927 1438 HA LEU 89 HA LEU 89 1.108 -13.935 -10.022 1439 HB2 LEU 89 2HB LEU 89 -0.341 -11.941 -8.266 1440 HB3 LEU 89 1HB LEU 89 1.214 -12.599 -7.681 1441 HG LEU 89 HG LEU 89 1.309 -10.397 -8.936 1442 HD11 LEU 89 1HD1 LEU 89 3.238 -11.876 -8.404 1443 HD12 LEU 89 2HD1 LEU 89 3.502 -10.919 -9.910 1444 HD13 LEU 89 3HD1 LEU 89 3.097 -12.674 -10.013 1445 HD21 LEU 89 3HD2 LEU 89 1.151 -12.091 -11.518 1446 HD22 LEU 89 1HD2 LEU 89 1.404 -10.317 -11.366 1447 HD23 LEU 89 2HD2 LEU 89 -0.182 -11.046 -10.919 1448 H ALA 90 H ALA 90 -1.752 -14.775 -8.058 1449 HA ALA 90 HA ALA 90 -0.316 -16.318 -6.211 1450 HB1 ALA 90 1HB ALA 90 -3.231 -16.618 -7.131 1451 HB2 ALA 90 2HB ALA 90 -2.649 -15.636 -5.736 1452 HB3 ALA 90 3HB ALA 90 -2.502 -17.429 -5.687 1453 H THR 91 H THR 91 -0.997 -16.924 -9.585 1454 HA THR 91 HA THR 91 -0.908 -19.783 -9.244 1455 HB THR 91 HB THR 91 -0.753 -20.031 -11.627 1456 HG1 THR 91 1HG THR 91 -0.553 -17.177 -11.702 1457 HG21 THR 91 3HG2 THR 91 -2.976 -19.709 -10.520 1458 HG22 THR 91 1HG2 THR 91 -2.970 -19.083 -12.210 1459 HG23 THR 91 2HG2 THR 91 -2.878 -17.934 -10.825 1460 H ASP 92 H ASP 92 1.559 -17.280 -9.099 1461 HA ASP 92 HA ASP 92 3.318 -18.789 -10.726 1462 HB2 ASP 92 2HB ASP 92 3.530 -16.245 -10.416 1463 HB3 ASP 92 1HB ASP 92 4.445 -16.633 -8.915 1464 H PHE 93 H PHE 93 2.479 -19.111 -7.377 1465 HA PHE 93 HA PHE 93 4.897 -20.594 -6.804 1466 HB2 PHE 93 2HB PHE 93 4.131 -21.207 -4.776 1467 HB3 PHE 93 1HB PHE 93 3.508 -19.540 -4.934 1468 HD1 PHE 93 2HD PHE 93 2.672 -23.124 -4.586 1469 HD2 PHE 93 1HD PHE 93 1.035 -19.199 -5.187 1470 HE1 PHE 93 2HE PHE 93 0.460 -23.934 -3.839 1471 HE2 PHE 93 1HE PHE 93 -1.182 -20.014 -4.481 1472 HZ PHE 93 HZ PHE 93 -1.474 -22.376 -3.770 1473 H VAL 94 H VAL 94 1.689 -21.210 -8.123 1474 HA VAL 94 HA VAL 94 1.627 -23.975 -7.687 1475 HB VAL 94 HB VAL 94 0.047 -22.372 -9.772 1476 HG11 VAL 94 1HG1 VAL 94 -0.197 -24.858 -9.989 1477 HG12 VAL 94 2HG1 VAL 94 -1.704 -24.139 -9.328 1478 HG13 VAL 94 3HG1 VAL 94 -0.561 -24.994 -8.229 1479 HG21 VAL 94 3HG2 VAL 94 -1.660 -22.071 -7.943 1480 HG22 VAL 94 1HG2 VAL 94 -0.140 -21.226 -7.539 1481 HG23 VAL 94 2HG2 VAL 94 -0.521 -22.801 -6.760 1482 H ARG 95 H ARG 95 2.834 -21.906 -10.236 1483 HA ARG 95 HA ARG 95 3.294 -23.476 -12.374 1484 HB2 ARG 95 2HB ARG 95 3.997 -21.086 -12.164 1485 HB3 ARG 95 1HB ARG 95 5.250 -21.546 -10.968 1486 HG2 ARG 95 2HG ARG 95 6.496 -22.824 -12.710 1487 HG3 ARG 95 1HG ARG 95 5.223 -22.453 -13.910 1488 HD2 ARG 95 2HD ARG 95 7.036 -20.388 -12.448 1489 HD3 ARG 95 1HD ARG 95 7.283 -20.982 -14.134 1490 HE ARG 95 HE ARG 95 5.390 -18.950 -13.168 1491 HH11 ARG 95 1HH2 ARG 95 5.730 -21.542 -15.764 1492 HH12 ARG 95 2HH2 ARG 95 4.874 -20.666 -16.931 1493 HH21 ARG 95 1HH1 ARG 95 4.484 -17.661 -14.978 1494 HH22 ARG 95 2HH1 ARG 95 4.200 -18.389 -16.499 1495 H ARG 96 H ARG 96 4.989 -23.681 -9.222 1496 HA ARG 96 HA ARG 96 7.175 -25.153 -10.045 1497 HB2 ARG 96 2HB ARG 96 7.651 -25.657 -7.778 1498 HB3 ARG 96 1HB ARG 96 6.811 -24.069 -7.713 1499 HG2 ARG 96 2HG ARG 96 4.657 -25.339 -7.140 1500 HG3 ARG 96 1HG ARG 96 5.625 -26.857 -7.134 1501 HD2 ARG 96 2HD ARG 96 7.016 -25.944 -5.226 1502 HD3 ARG 96 1HD ARG 96 5.830 -24.554 -5.103 1503 HE ARG 96 HE ARG 96 4.273 -26.931 -5.324 1504 HH11 ARG 96 1HH2 ARG 96 6.806 -26.007 -2.933 1505 HH12 ARG 96 2HH2 ARG 96 6.473 -27.333 -1.908 1506 HH21 ARG 96 1HH1 ARG 96 3.819 -28.549 -4.054 1507 HH22 ARG 96 2HH1 ARG 96 4.596 -28.849 -2.525 1508 H GLU 97 H GLU 97 3.851 -26.176 -9.442 1509 HA GLU 97 HA GLU 97 4.402 -28.901 -8.911 1510 HB2 GLU 97 2HB GLU 97 1.845 -27.524 -9.941 1511 HB3 GLU 97 1HB GLU 97 1.896 -29.177 -9.270 1512 HG2 GLU 97 2HG GLU 97 2.647 -26.639 -7.646 1513 HG3 GLU 97 1HG GLU 97 0.989 -27.304 -7.752 1514 H GLU 98 H GLU 98 3.755 -26.908 -11.759 1515 HA GLU 98 HA GLU 98 3.303 -29.062 -13.578 1516 HB2 GLU 98 2HB GLU 98 3.987 -26.082 -14.005 1517 HB3 GLU 98 1HB GLU 98 3.404 -27.178 -15.292 1518 HG2 GLU 98 2HG GLU 98 1.717 -26.622 -12.740 1519 HG3 GLU 98 1HG GLU 98 1.715 -25.541 -14.169 1520 H GLU 99 H GLU 99 6.062 -27.215 -12.385 1521 HA GLU 99 HA GLU 99 7.753 -27.988 -14.568 1522 HB2 GLU 99 2HB GLU 99 8.524 -26.806 -11.837 1523 HB3 GLU 99 1HB GLU 99 9.627 -27.129 -13.213 1524 HG2 GLU 99 2HG GLU 99 8.055 -25.600 -14.639 1525 HG3 GLU 99 1HG GLU 99 7.339 -25.074 -13.076 1526 H ARG 100 H ARG 100 7.014 -29.157 -11.292 1527 HA ARG 100 HA ARG 100 9.110 -31.114 -11.327 1528 HB2 ARG 100 2HB ARG 100 8.033 -30.088 -9.218 1529 HB3 ARG 100 1HB ARG 100 6.591 -31.097 -9.546 1530 HG2 ARG 100 2HG ARG 100 8.083 -33.167 -9.379 1531 HG3 ARG 100 1HG ARG 100 9.476 -32.080 -9.055 1532 HD2 ARG 100 2HD ARG 100 8.275 -31.232 -6.960 1533 HD3 ARG 100 1HD ARG 100 6.992 -32.474 -7.214 1534 HE ARG 100 HE ARG 100 9.848 -32.870 -6.392 1535 HH11 ARG 100 1HH2 ARG 100 6.887 -34.572 -7.562 1536 HH12 ARG 100 2HH2 ARG 100 7.381 -36.112 -7.059 1537 HH21 ARG 100 1HH1 ARG 100 10.374 -34.923 -5.370 1538 HH22 ARG 100 2HH1 ARG 100 9.484 -36.312 -5.703 1539 H ARG 101 H ARG 101 5.505 -31.121 -11.860 1540 HA ARG 101 HA ARG 101 5.631 -33.933 -12.643 1541 HB2 ARG 101 2HB ARG 101 3.266 -31.964 -12.536 1542 HB3 ARG 101 1HB ARG 101 3.162 -33.691 -13.021 1543 HG2 ARG 101 2HG ARG 101 3.816 -34.407 -10.751 1544 HG3 ARG 101 1HG ARG 101 3.979 -32.683 -10.238 1545 HD2 ARG 101 2HD ARG 101 1.531 -32.285 -10.818 1546 HD3 ARG 101 1HD ARG 101 1.397 -33.995 -11.364 1547 HE ARG 101 HE ARG 101 1.132 -34.667 -9.227 1548 HH11 ARG 101 1HH2 ARG 101 2.360 -31.294 -9.181 1549 HH12 ARG 101 2HH2 ARG 101 2.009 -30.993 -7.537 1550 HH21 ARG 101 1HH1 ARG 101 0.908 -34.363 -6.860 1551 HH22 ARG 101 2HH1 ARG 101 1.226 -32.822 -6.163 1552 H GLY 102 H GLY 102 6.292 -34.267 -14.736 1553 HA2 GLY 102 2HA GLY 102 5.580 -34.421 -16.894 1554 HA3 GLY 102 1HA GLY 102 4.734 -32.834 -16.781 1555 H HIS 103 H HIS 103 7.726 -32.504 -15.281 1556 HA HIS 103 HA HIS 103 9.290 -31.960 -17.611 1557 HB2 HIS 103 2HB HIS 103 7.978 -29.892 -17.742 1558 HB3 HIS 103 1HB HIS 103 7.955 -29.720 -15.970 1559 HD1 HIS 103 1HD HIS 103 10.250 -28.852 -14.834 1560 HD2 HIS 103 2HD HIS 103 10.066 -28.524 -19.042 1561 HE1 HIS 103 1HE HIS 103 12.027 -27.219 -15.540 1562 HE2 HIS 103 2HE HIS 103 11.907 -27.026 -18.065 1563 H1 SER 1 H SER 1 16.305 -24.941 0.412 1564 HA SER 1 HA SER 1 17.106 -24.397 -1.600 1565 HB2 SER 1 2HB SER 1 15.138 -26.500 -2.695 1566 HB3 SER 1 1HB SER 1 16.686 -25.985 -3.450 1567 HG SER 1 1HG SER 1 17.750 -27.258 -2.091 1568 H ALA 2 H ALA 2 13.822 -24.299 -1.019 1569 HA ALA 2 HA ALA 2 12.347 -24.051 -3.023 1570 HB1 ALA 2 1HB ALA 2 10.780 -22.457 -1.949 1571 HB2 ALA 2 2HB ALA 2 12.069 -22.038 -0.756 1572 HB3 ALA 2 3HB ALA 2 11.411 -23.707 -0.819 1573 H ASP 3 H ASP 3 12.301 -23.330 -4.967 1574 HA ASP 3 HA ASP 3 14.062 -21.519 -5.861 1575 HB2 ASP 3 2HB ASP 3 11.547 -22.416 -7.391 1576 HB3 ASP 3 1HB ASP 3 13.118 -21.865 -8.075 1577 H HIS 4 H HIS 4 10.644 -21.057 -5.036 1578 HA HIS 4 HA HIS 4 10.355 -18.515 -6.138 1579 HB2 HIS 4 2HB HIS 4 8.569 -18.108 -4.399 1580 HB3 HIS 4 1HB HIS 4 8.358 -19.563 -5.402 1581 HD1 HIS 4 1HD HIS 4 9.982 -18.909 -1.812 1582 HD2 HIS 4 2HD HIS 4 7.360 -21.486 -3.894 1583 HE1 HIS 4 1HE HIS 4 9.290 -20.564 -0.242 1584 HE2 HIS 4 2HE HIS 4 7.426 -21.823 -1.365 1585 H GLU 5 H GLU 5 12.181 -19.420 -3.144 1586 HA GLU 5 HA GLU 5 11.985 -16.744 -2.122 1587 HB2 GLU 5 2HB GLU 5 14.428 -18.397 -1.373 1588 HB3 GLU 5 1HB GLU 5 13.475 -17.223 -0.421 1589 HG2 GLU 5 2HG GLU 5 12.833 -20.168 -1.026 1590 HG3 GLU 5 1HG GLU 5 13.420 -19.466 0.510 1591 H ARG 6 H ARG 6 14.074 -18.636 -4.248 1592 HA ARG 6 HA ARG 6 16.226 -16.723 -4.174 1593 HB2 ARG 6 2HB ARG 6 15.756 -19.163 -5.981 1594 HB3 ARG 6 1HB ARG 6 17.138 -18.036 -6.156 1595 HG2 ARG 6 2HG ARG 6 17.961 -19.903 -4.962 1596 HG3 ARG 6 1HG ARG 6 17.892 -18.515 -3.826 1597 HD2 ARG 6 2HD ARG 6 15.748 -19.545 -2.804 1598 HD3 ARG 6 1HD ARG 6 15.894 -20.880 -3.990 1599 HE ARG 6 HE ARG 6 17.514 -21.844 -2.727 1600 HH11 ARG 6 1HH2 ARG 6 17.091 -18.507 -1.470 1601 HH12 ARG 6 2HH2 ARG 6 17.595 -18.839 0.117 1602 HH21 ARG 6 1HH1 ARG 6 18.583 -22.281 -0.613 1603 HH22 ARG 6 2HH1 ARG 6 18.576 -21.104 0.592 1604 H GLU 7 H GLU 7 13.475 -17.511 -6.340 1605 HA GLU 7 HA GLU 7 14.184 -15.609 -8.268 1606 HB2 GLU 7 2HB GLU 7 12.519 -17.568 -8.507 1607 HB3 GLU 7 1HB GLU 7 11.330 -16.546 -7.637 1608 HG2 GLU 7 2HG GLU 7 10.926 -16.380 -10.056 1609 HG3 GLU 7 1HG GLU 7 11.576 -14.803 -9.488 1610 H ALA 8 H ALA 8 12.280 -15.389 -5.243 1611 HA ALA 8 HA ALA 8 11.312 -12.792 -5.622 1612 HB1 ALA 8 1HB ALA 8 12.026 -14.257 -2.996 1613 HB2 ALA 8 2HB ALA 8 10.419 -14.269 -3.810 1614 HB3 ALA 8 3HB ALA 8 11.067 -12.739 -3.112 1615 H GLN 9 H GLN 9 14.339 -14.023 -4.103 1616 HA GLN 9 HA GLN 9 15.189 -11.477 -3.278 1617 HB2 GLN 9 2HB GLN 9 16.044 -13.725 -2.411 1618 HB3 GLN 9 1HB GLN 9 17.027 -13.857 -3.909 1619 HG2 GLN 9 2HG GLN 9 18.232 -11.724 -3.287 1620 HG3 GLN 9 1HG GLN 9 17.160 -11.543 -1.848 1621 HE21 GLN 9 1HE2 GLN 9 19.370 -11.524 -0.768 1622 HE22 GLN 9 2HE2 GLN 9 20.122 -13.039 -0.352 1623 H LYS 10 H LYS 10 15.741 -13.337 -6.287 1624 HA LYS 10 HA LYS 10 17.553 -11.584 -7.499 1625 HB2 LYS 10 2HB LYS 10 17.039 -13.828 -8.467 1626 HB3 LYS 10 1HB LYS 10 15.331 -13.345 -8.709 1627 HG2 LYS 10 2HG LYS 10 16.096 -11.574 -10.364 1628 HG3 LYS 10 1HG LYS 10 17.774 -12.191 -10.204 1629 HD2 LYS 10 2HD LYS 10 17.134 -14.338 -11.171 1630 HD3 LYS 10 1HD LYS 10 15.388 -13.987 -11.008 1631 HE2 LYS 10 2HE LYS 10 17.332 -12.498 -12.914 1632 HE3 LYS 10 1HE LYS 10 16.157 -13.792 -13.368 1633 HZ1 LYS 10 3HZ LYS 10 15.576 -10.967 -12.596 1634 HZ2 LYS 10 1HZ LYS 10 14.415 -12.196 -12.373 1635 HZ3 LYS 10 2HZ LYS 10 15.109 -11.861 -13.894 1636 H ALA 11 H ALA 11 13.981 -11.558 -7.306 1637 HA ALA 11 HA ALA 11 13.548 -9.603 -9.236 1638 HB1 ALA 11 1HB ALA 11 11.808 -10.152 -6.754 1639 HB2 ALA 11 2HB ALA 11 11.733 -11.094 -8.288 1640 HB3 ALA 11 3HB ALA 11 11.285 -9.353 -8.282 1641 H GLU 12 H GLU 12 14.373 -9.291 -5.760 1642 HA GLU 12 HA GLU 12 13.767 -6.578 -5.500 1643 HB2 GLU 12 2HB GLU 12 16.028 -8.157 -4.119 1644 HB3 GLU 12 1HB GLU 12 15.529 -6.484 -3.700 1645 HG2 GLU 12 2HG GLU 12 13.198 -7.372 -3.157 1646 HG3 GLU 12 1HG GLU 12 13.853 -9.046 -3.313 1647 H GLU 13 H GLU 13 16.639 -8.217 -6.807 1648 HA GLU 13 HA GLU 13 18.279 -5.922 -6.852 1649 HB2 GLU 13 2HB GLU 13 19.148 -8.253 -6.833 1650 HB3 GLU 13 1HB GLU 13 18.475 -8.540 -8.471 1651 HG2 GLU 13 2HG GLU 13 20.030 -6.973 -9.494 1652 HG3 GLU 13 1HG GLU 13 20.455 -6.269 -7.896 1653 H GLU 14 H GLU 14 15.857 -7.264 -8.991 1654 HA GLU 14 HA GLU 14 16.638 -5.834 -11.293 1655 HB2 GLU 14 2HB GLU 14 15.257 -8.017 -11.018 1656 HB3 GLU 14 1HB GLU 14 13.825 -6.963 -10.821 1657 HG2 GLU 14 2HG GLU 14 13.971 -6.209 -13.116 1658 HG3 GLU 14 1HG GLU 14 15.727 -6.597 -13.217 1659 H LEU 15 H LEU 15 14.535 -5.141 -8.516 1660 HA LEU 15 HA LEU 15 13.290 -2.894 -9.609 1661 HB2 LEU 15 2HB LEU 15 12.482 -4.068 -7.555 1662 HB3 LEU 15 1HB LEU 15 13.887 -3.443 -6.642 1663 HG LEU 15 HG LEU 15 13.077 -1.138 -6.855 1664 HD11 LEU 15 1HD1 LEU 15 10.845 -0.613 -7.965 1665 HD12 LEU 15 2HD1 LEU 15 10.862 -2.261 -8.692 1666 HD13 LEU 15 3HD1 LEU 15 12.138 -1.059 -9.119 1667 HD21 LEU 15 3HD2 LEU 15 12.123 -2.539 -5.018 1668 HD22 LEU 15 1HD2 LEU 15 10.751 -3.023 -6.079 1669 HD23 LEU 15 2HD2 LEU 15 10.935 -1.306 -5.579 1670 H GLN 16 H GLN 16 16.320 -3.249 -7.736 1671 HA GLN 16 HA GLN 16 17.005 -0.614 -7.346 1672 HB2 GLN 16 2HB GLN 16 18.994 -2.804 -8.235 1673 HB3 GLN 16 1HB GLN 16 19.386 -1.281 -7.371 1674 HG2 GLN 16 2HG GLN 16 18.076 -2.184 -5.353 1675 HG3 GLN 16 1HG GLN 16 17.831 -3.720 -6.259 1676 HE21 GLN 16 1HE2 GLN 16 20.420 -1.427 -5.151 1677 HE22 GLN 16 2HE2 GLN 16 21.685 -2.593 -5.061 1678 H LYS 17 H LYS 17 17.400 -2.627 -10.231 1679 HA LYS 17 HA LYS 17 19.134 -0.854 -11.567 1680 HB2 LYS 17 2HB LYS 17 18.767 -3.423 -11.852 1681 HB3 LYS 17 1HB LYS 17 17.383 -3.014 -12.897 1682 HG2 LYS 17 2HG LYS 17 19.824 -1.500 -13.711 1683 HG3 LYS 17 1HG LYS 17 20.220 -3.208 -13.446 1684 HD2 LYS 17 2HD LYS 17 19.737 -3.083 -15.746 1685 HD3 LYS 17 1HD LYS 17 18.353 -3.927 -14.992 1686 HE2 LYS 17 2HE LYS 17 17.691 -2.270 -16.804 1687 HE3 LYS 17 1HE LYS 17 16.938 -1.873 -15.208 1688 HZ1 LYS 17 3HZ LYS 17 18.001 -0.042 -16.587 1689 HZ2 LYS 17 1HZ LYS 17 19.499 -0.616 -16.027 1690 HZ3 LYS 17 2HZ LYS 17 18.308 -0.108 -14.906 1691 H VAL 18 H VAL 18 15.639 -1.015 -11.256 1692 HA VAL 18 HA VAL 18 15.079 0.521 -13.632 1693 HB VAL 18 HB VAL 18 13.336 -0.238 -11.224 1694 HG11 VAL 18 1HG1 VAL 18 11.414 0.385 -12.742 1695 HG12 VAL 18 2HG1 VAL 18 12.579 1.038 -13.947 1696 HG13 VAL 18 3HG1 VAL 18 12.415 1.807 -12.315 1697 HG21 VAL 18 3HG2 VAL 18 13.523 -1.406 -14.093 1698 HG22 VAL 18 1HG2 VAL 18 12.376 -1.925 -12.804 1699 HG23 VAL 18 2HG2 VAL 18 14.132 -2.203 -12.602 1700 H LEU 19 H LEU 19 15.571 1.004 -10.129 1701 HA LEU 19 HA LEU 19 14.689 3.609 -9.891 1702 HB2 LEU 19 2HB LEU 19 17.157 2.501 -8.415 1703 HB3 LEU 19 1HB LEU 19 16.092 3.852 -7.910 1704 HG LEU 19 HG LEU 19 15.397 0.870 -8.030 1705 HD11 LEU 19 1HD1 LEU 19 15.258 1.018 -5.562 1706 HD12 LEU 19 2HD1 LEU 19 15.707 2.762 -5.624 1707 HD13 LEU 19 3HD1 LEU 19 16.892 1.508 -6.147 1708 HD21 LEU 19 3HD2 LEU 19 13.239 1.449 -6.953 1709 HD22 LEU 19 1HD2 LEU 19 13.343 2.150 -8.601 1710 HD23 LEU 19 2HD2 LEU 19 13.590 3.210 -7.157 1711 H GLU 20 H GLU 20 17.939 2.350 -10.830 1712 HA GLU 20 HA GLU 20 19.043 4.952 -10.869 1713 HB2 GLU 20 2HB GLU 20 20.205 2.447 -12.188 1714 HB3 GLU 20 1HB GLU 20 21.012 4.039 -11.978 1715 HG2 GLU 20 2HG GLU 20 20.590 3.783 -9.427 1716 HG3 GLU 20 1HG GLU 20 20.172 2.062 -9.762 1717 H GLU 21 H GLU 21 17.007 3.386 -13.174 1718 HA GLU 21 HA GLU 21 17.926 5.166 -15.321 1719 HB2 GLU 21 2HB GLU 21 15.504 3.276 -15.208 1720 HB3 GLU 21 1HB GLU 21 16.023 4.262 -16.622 1721 HG2 GLU 21 2HG GLU 21 18.228 3.060 -16.638 1722 HG3 GLU 21 1HG GLU 21 17.657 2.022 -15.273 1723 H ALA 22 H ALA 22 15.414 4.729 -12.851 1724 HA ALA 22 HA ALA 22 13.694 6.730 -13.797 1725 HB1 ALA 22 1HB ALA 22 12.654 6.624 -11.503 1726 HB2 ALA 22 2HB ALA 22 13.964 5.501 -11.003 1727 HB3 ALA 22 3HB ALA 22 12.810 5.010 -12.284 1728 H SER 23 H SER 23 16.586 6.870 -11.650 1729 HA SER 23 HA SER 23 16.039 9.492 -10.774 1730 HB2 SER 23 2HB SER 23 18.623 9.478 -10.338 1731 HB3 SER 23 1HB SER 23 17.593 8.290 -9.461 1732 HG SER 23 1HG SER 23 19.522 7.420 -10.477 1733 H LYS 24 H LYS 24 17.678 8.145 -13.660 1734 HA LYS 24 HA LYS 24 18.664 10.692 -14.446 1735 HB2 LYS 24 2HB LYS 24 19.615 8.479 -15.364 1736 HB3 LYS 24 1HB LYS 24 18.173 8.434 -16.438 1737 HG2 LYS 24 2HG LYS 24 18.833 10.885 -17.123 1738 HG3 LYS 24 1HG LYS 24 20.362 10.614 -16.231 1739 HD2 LYS 24 2HD LYS 24 20.931 8.761 -17.825 1740 HD3 LYS 24 1HD LYS 24 19.348 9.011 -18.665 1741 HE2 LYS 24 2HE LYS 24 20.042 11.429 -19.160 1742 HE3 LYS 24 1HE LYS 24 21.644 11.085 -18.400 1743 HZ1 LYS 24 3HZ LYS 24 21.956 10.836 -20.634 1744 HZ2 LYS 24 1HZ LYS 24 20.500 9.976 -20.904 1745 HZ3 LYS 24 2HZ LYS 24 21.839 9.242 -20.078 1746 H LYS 25 H LYS 25 15.772 8.724 -15.245 1747 HA LYS 25 HA LYS 25 14.672 10.495 -17.110 1748 HB2 LYS 25 2HB LYS 25 13.276 8.602 -15.141 1749 HB3 LYS 25 1HB LYS 25 12.440 9.457 -16.483 1750 HG2 LYS 25 2HG LYS 25 13.615 8.228 -18.182 1751 HG3 LYS 25 1HG LYS 25 14.818 7.591 -17.017 1752 HD2 LYS 25 2HD LYS 25 13.024 6.300 -15.845 1753 HD3 LYS 25 1HD LYS 25 11.823 6.844 -17.069 1754 HE2 LYS 25 2HE LYS 25 13.038 5.645 -18.872 1755 HE3 LYS 25 1HE LYS 25 14.417 5.290 -17.762 1756 HZ1 LYS 25 3HZ LYS 25 11.639 4.216 -17.481 1757 HZ2 LYS 25 1HZ LYS 25 12.944 3.895 -16.441 1758 HZ3 LYS 25 2HZ LYS 25 13.035 3.406 -18.081 1759 H ALA 26 H ALA 26 14.157 10.295 -13.508 1760 HA ALA 26 HA ALA 26 12.382 12.408 -13.385 1761 HB1 ALA 26 1HB ALA 26 14.373 11.502 -11.209 1762 HB2 ALA 26 2HB ALA 26 12.750 10.774 -11.515 1763 HB3 ALA 26 3HB ALA 26 12.868 12.478 -10.968 1764 H VAL 27 H VAL 27 16.031 12.486 -12.984 1765 HA VAL 27 HA VAL 27 15.887 15.263 -12.436 1766 HB VAL 27 HB VAL 27 17.776 13.828 -11.700 1767 HG11 VAL 27 1HG1 VAL 27 18.830 14.176 -14.588 1768 HG12 VAL 27 2HG1 VAL 27 18.185 12.647 -13.900 1769 HG13 VAL 27 3HG1 VAL 27 19.668 13.389 -13.201 1770 HG21 VAL 27 3HG2 VAL 27 17.834 16.281 -11.536 1771 HG22 VAL 27 1HG2 VAL 27 18.395 16.438 -13.244 1772 HG23 VAL 27 2HG2 VAL 27 19.463 15.673 -12.023 1773 H GLU 28 H GLU 28 16.236 13.394 -15.489 1774 HA GLU 28 HA GLU 28 16.962 15.675 -17.015 1775 HB2 GLU 28 2HB GLU 28 17.431 13.219 -17.610 1776 HB3 GLU 28 1HB GLU 28 15.688 13.053 -17.979 1777 HG2 GLU 28 2HG GLU 28 16.740 13.322 -20.085 1778 HG3 GLU 28 1HG GLU 28 16.060 14.952 -19.748 1779 H ALA 29 H ALA 29 13.941 14.110 -16.053 1780 HA ALA 29 HA ALA 29 12.212 15.468 -17.798 1781 HB1 ALA 29 1HB ALA 29 11.604 13.310 -16.721 1782 HB2 ALA 29 2HB ALA 29 10.453 14.566 -16.223 1783 HB3 ALA 29 3HB ALA 29 11.737 14.069 -15.096 1784 H GLU 30 H GLU 30 12.985 15.912 -14.246 1785 HA GLU 30 HA GLU 30 11.505 18.298 -14.118 1786 HB2 GLU 30 2HB GLU 30 13.589 17.106 -12.260 1787 HB3 GLU 30 1HB GLU 30 12.823 18.681 -11.918 1788 HG2 GLU 30 2HG GLU 30 10.930 16.374 -12.494 1789 HG3 GLU 30 1HG GLU 30 11.864 16.300 -10.978 1790 H ARG 31 H ARG 31 14.854 17.709 -15.165 1791 HA ARG 31 HA ARG 31 15.708 20.372 -14.843 1792 HB2 ARG 31 2HB ARG 31 17.248 18.414 -15.226 1793 HB3 ARG 31 1HB ARG 31 16.693 18.340 -16.929 1794 HG2 ARG 31 2HG ARG 31 17.661 20.716 -17.212 1795 HG3 ARG 31 1HG ARG 31 18.197 20.613 -15.491 1796 HD2 ARG 31 2HD ARG 31 19.490 18.431 -16.212 1797 HD3 ARG 31 1HD ARG 31 19.155 18.943 -17.922 1798 HE ARG 31 HE ARG 31 20.357 20.939 -16.016 1799 HH11 ARG 31 1HH2 ARG 31 21.179 18.322 -18.441 1800 HH12 ARG 31 2HH2 ARG 31 22.821 18.782 -18.496 1801 HH21 ARG 31 1HH1 ARG 31 22.558 21.658 -16.350 1802 HH22 ARG 31 2HH1 ARG 31 23.656 20.701 -17.217 1803 H GLY 32 H GLY 32 14.464 22.006 -15.717 1804 HA2 GLY 32 2HA GLY 32 14.446 23.354 -17.706 1805 HA3 GLY 32 1HA GLY 32 13.936 21.891 -18.633 1806 H ALA 33 H ALA 33 12.488 21.492 -15.662 1807 HA ALA 33 HA ALA 33 9.989 22.445 -16.736 1808 HB1 ALA 33 1HB ALA 33 10.074 20.116 -15.832 1809 HB2 ALA 33 2HB ALA 33 8.960 21.144 -14.855 1810 HB3 ALA 33 3HB ALA 33 10.601 20.757 -14.237 1811 HA PRO 34 HA PRO 34 10.246 25.761 -13.711 1812 HB2 PRO 34 2HB PRO 34 7.658 26.792 -13.794 1813 HB3 PRO 34 1HB PRO 34 8.813 26.970 -15.170 1814 HG2 PRO 34 2HG PRO 34 6.600 24.878 -14.836 1815 HG3 PRO 34 1HG PRO 34 6.967 25.890 -16.296 1816 HD2 PRO 34 2HD PRO 34 7.879 23.260 -15.950 1817 HD3 PRO 34 1HD PRO 34 8.851 24.509 -16.859 1818 H GLY 35 H GLY 35 10.025 25.899 -11.453 1819 HA2 GLY 35 2HA GLY 35 9.178 25.553 -9.415 1820 HA3 GLY 35 1HA GLY 35 7.706 24.820 -10.163 1821 H ALA 36 H ALA 36 10.673 23.537 -11.256 1822 HA ALA 36 HA ALA 36 10.224 20.951 -10.365 1823 HB1 ALA 36 1HB ALA 36 11.693 21.408 -12.338 1824 HB2 ALA 36 2HB ALA 36 12.616 20.538 -11.066 1825 HB3 ALA 36 3HB ALA 36 12.850 22.310 -11.285 1826 H ALA 37 H ALA 37 10.478 20.160 -8.396 1827 HA ALA 37 HA ALA 37 11.846 21.800 -6.359 1828 HB1 ALA 37 1HB ALA 37 10.781 20.183 -4.717 1829 HB2 ALA 37 2HB ALA 37 10.049 19.288 -6.108 1830 HB3 ALA 37 3HB ALA 37 9.546 20.977 -5.760 1831 H LEU 38 H LEU 38 11.919 18.771 -8.242 1832 HA LEU 38 HA LEU 38 14.163 17.799 -6.634 1833 HB2 LEU 38 2HB LEU 38 12.491 16.060 -7.217 1834 HB3 LEU 38 1HB LEU 38 12.539 16.575 -8.923 1835 HG LEU 38 HG LEU 38 14.819 15.776 -9.214 1836 HD11 LEU 38 1HD1 LEU 38 14.866 14.662 -6.337 1837 HD12 LEU 38 2HD1 LEU 38 15.709 16.187 -6.836 1838 HD13 LEU 38 3HD1 LEU 38 16.168 14.644 -7.581 1839 HD21 LEU 38 3HD2 LEU 38 13.063 13.632 -7.856 1840 HD22 LEU 38 1HD2 LEU 38 14.419 13.332 -9.011 1841 HD23 LEU 38 2HD2 LEU 38 12.938 14.202 -9.557 1842 H ILE 39 H ILE 39 16.281 18.122 -7.443 1843 HA ILE 39 HA ILE 39 16.622 18.655 -10.210 1844 HB ILE 39 HB ILE 39 18.185 20.606 -9.679 1845 HG12 ILE 39 2HG1 ILE 39 16.590 20.720 -7.032 1846 HG13 ILE 39 1HG1 ILE 39 18.303 20.198 -7.173 1847 HG21 ILE 39 1HG2 ILE 39 15.908 20.868 -10.757 1848 HG22 ILE 39 2HG2 ILE 39 16.405 22.315 -9.807 1849 HG23 ILE 39 3HG2 ILE 39 15.195 21.164 -9.138 1850 HD11 ILE 39 3HD ILE 39 17.192 23.013 -7.802 1851 HD12 ILE 39 1HD ILE 39 18.253 22.533 -6.430 1852 HD13 ILE 39 2HD ILE 39 18.892 22.488 -8.114 1853 H SER 40 H SER 40 19.105 18.605 -10.435 1854 HA SER 40 HA SER 40 21.067 17.836 -10.095 1855 HB2 SER 40 2HB SER 40 20.396 17.405 -7.156 1856 HB3 SER 40 1HB SER 40 22.051 17.419 -7.848 1857 HG SER 40 1HG SER 40 20.677 19.370 -6.870 1858 H TYR 41 H TYR 41 21.983 15.985 -10.718 1859 HA TYR 41 HA TYR 41 20.715 13.536 -10.625 1860 HB2 TYR 41 2HB TYR 41 22.431 14.032 -12.304 1861 HB3 TYR 41 1HB TYR 41 23.681 14.257 -11.033 1862 HD1 TYR 41 2HD TYR 41 21.449 11.709 -12.677 1863 HD2 TYR 41 1HD TYR 41 24.827 12.397 -10.093 1864 HE1 TYR 41 2HE TYR 41 22.015 9.309 -12.768 1865 HE2 TYR 41 1HE TYR 41 25.391 10.016 -10.183 1866 HH TYR 41 HH TYR 41 24.636 7.913 -10.788 1867 HA PRO 42 HA PRO 42 23.438 12.061 -7.156 1868 HB2 PRO 42 2HB PRO 42 24.270 13.827 -5.060 1869 HB3 PRO 42 1HB PRO 42 25.279 13.306 -6.459 1870 HG2 PRO 42 2HG PRO 42 23.537 15.824 -6.227 1871 HG3 PRO 42 1HG PRO 42 25.261 15.708 -6.769 1872 HD2 PRO 42 2HD PRO 42 23.295 15.829 -8.628 1873 HD3 PRO 42 1HD PRO 42 24.582 14.561 -8.842 1874 H ASP 43 H ASP 43 21.055 14.683 -6.220 1875 HA ASP 43 HA ASP 43 20.164 12.789 -4.185 1876 HB2 ASP 43 2HB ASP 43 18.599 14.503 -3.347 1877 HB3 ASP 43 1HB ASP 43 20.351 14.731 -3.062 1878 H ALA 44 H ALA 44 19.613 13.212 -7.447 1879 HA ALA 44 HA ALA 44 16.822 12.721 -7.441 1880 HB1 ALA 44 1HB ALA 44 17.981 13.464 -9.520 1881 HB2 ALA 44 2HB ALA 44 17.115 11.917 -9.786 1882 HB3 ALA 44 3HB ALA 44 18.909 11.921 -9.565 1883 H ILE 45 H ILE 45 19.672 10.639 -7.107 1884 HA ILE 45 HA ILE 45 18.116 8.248 -7.413 1885 HB ILE 45 HB ILE 45 20.348 8.285 -8.202 1886 HG12 ILE 45 2HG1 ILE 45 20.205 6.401 -5.775 1887 HG13 ILE 45 1HG1 ILE 45 19.346 6.149 -7.329 1888 HG21 ILE 45 1HG2 ILE 45 21.362 9.980 -6.737 1889 HG22 ILE 45 2HG2 ILE 45 22.324 8.481 -6.676 1890 HG23 ILE 45 3HG2 ILE 45 21.237 8.890 -5.310 1891 HD11 ILE 45 3HD ILE 45 22.416 6.285 -6.944 1892 HD12 ILE 45 1HD ILE 45 21.431 4.834 -7.323 1893 HD13 ILE 45 2HD ILE 45 21.588 6.149 -8.541 1894 H TRP 46 H TRP 46 18.539 10.487 -4.849 1895 HA TRP 46 HA TRP 46 18.054 8.523 -2.771 1896 HB2 TRP 46 2HB TRP 46 18.811 11.380 -2.898 1897 HB3 TRP 46 1HB TRP 46 17.432 11.168 -1.797 1898 HD1 TRP 46 HD TRP 46 18.412 11.259 0.557 1899 HE1 TRP 46 1HE TRP 46 20.502 10.332 1.778 1900 HE3 TRP 46 3HE TRP 46 20.525 8.683 -3.316 1901 HZ2 TRP 46 2HZ TRP 46 22.598 8.523 1.224 1902 HZ3 TRP 46 3HZ TRP 46 22.570 7.370 -2.919 1903 HH2 TRP 46 HH TRP 46 23.602 7.287 -0.678 1904 H TRP 47 H TRP 47 16.259 11.017 -4.638 1905 HA TRP 47 HA TRP 47 13.804 10.538 -3.359 1906 HB2 TRP 47 2HB TRP 47 14.358 12.544 -4.845 1907 HB3 TRP 47 1HB TRP 47 14.261 11.463 -6.275 1908 HD1 TRP 47 HD TRP 47 11.928 12.367 -3.201 1909 HE1 TRP 47 1HE TRP 47 9.613 11.755 -3.858 1910 HE3 TRP 47 3HE TRP 47 12.763 10.904 -8.016 1911 HZ2 TRP 47 2HZ TRP 47 8.090 11.335 -6.275 1912 HZ3 TRP 47 3HZ TRP 47 10.823 10.313 -9.437 1913 HH2 TRP 47 HH TRP 47 8.523 10.504 -8.563 1914 H SER 48 H SER 48 15.515 8.958 -6.034 1915 HA SER 48 HA SER 48 13.262 7.514 -6.958 1916 HB2 SER 48 2HB SER 48 15.416 8.215 -8.252 1917 HB3 SER 48 1HB SER 48 16.204 6.786 -7.492 1918 HG SER 48 1HG SER 48 15.414 6.139 -9.420 1919 H VAL 49 H VAL 49 13.086 6.953 -4.366 1920 HA VAL 49 HA VAL 49 13.636 4.092 -4.291 1921 HB VAL 49 HB VAL 49 14.284 5.872 -1.871 1922 HG11 VAL 49 1HG1 VAL 49 15.091 3.639 -0.936 1923 HG12 VAL 49 2HG1 VAL 49 14.431 2.812 -2.389 1924 HG13 VAL 49 3HG1 VAL 49 13.318 3.641 -1.240 1925 HG21 VAL 49 3HG2 VAL 49 16.650 4.936 -2.296 1926 HG22 VAL 49 1HG2 VAL 49 16.089 6.131 -3.513 1927 HG23 VAL 49 2HG2 VAL 49 16.078 4.370 -3.894 1928 H GLU 50 H GLU 50 12.150 6.953 -2.596 1929 HA GLU 50 HA GLU 50 10.312 5.491 -1.181 1930 HB2 GLU 50 2HB GLU 50 9.074 7.735 -0.930 1931 HB3 GLU 50 1HB GLU 50 10.770 7.656 -0.408 1932 HG2 GLU 50 2HG GLU 50 11.038 9.588 -1.499 1933 HG3 GLU 50 1HG GLU 50 11.162 8.607 -2.989 1934 H THR 51 H THR 51 10.069 6.825 -4.414 1935 HA THR 51 HA THR 51 7.373 6.385 -4.754 1936 HB THR 51 HB THR 51 8.676 8.062 -5.908 1937 HG1 THR 51 1HG THR 51 6.946 7.551 -6.999 1938 HG21 THR 51 3HG2 THR 51 10.851 6.872 -6.178 1939 HG22 THR 51 1HG2 THR 51 10.252 7.476 -7.752 1940 HG23 THR 51 2HG2 THR 51 10.101 5.726 -7.358 1941 H ALA 52 H ALA 52 10.143 4.187 -5.113 1942 HA ALA 52 HA ALA 52 8.702 2.295 -6.743 1943 HB1 ALA 52 1HB ALA 52 11.181 2.435 -6.889 1944 HB2 ALA 52 2HB ALA 52 10.674 0.803 -6.326 1945 HB3 ALA 52 3HB ALA 52 11.325 1.999 -5.142 1946 H THR 53 H THR 53 9.363 2.849 -3.264 1947 HA THR 53 HA THR 53 8.107 0.359 -2.520 1948 HB THR 53 HB THR 53 8.363 1.492 -0.176 1949 HG1 THR 53 1HG THR 53 8.664 3.617 -1.125 1950 HG21 THR 53 3HG2 THR 53 10.806 0.939 -0.168 1951 HG22 THR 53 1HG2 THR 53 10.840 0.962 -1.971 1952 HG23 THR 53 2HG2 THR 53 9.878 -0.292 -1.099 1953 H THR 54 H THR 54 6.910 3.152 -3.796 1954 HA THR 54 HA THR 54 5.187 4.406 -3.696 1955 HB THR 54 HB THR 54 2.964 3.396 -3.585 1956 HG1 THR 54 1HG THR 54 3.715 1.943 -1.901 1957 HG21 THR 54 3HG2 THR 54 5.074 1.644 -5.061 1958 HG22 THR 54 1HG2 THR 54 4.438 3.222 -5.648 1959 HG23 THR 54 2HG2 THR 54 3.330 1.811 -5.480 1960 H VAL 55 H VAL 55 6.269 5.535 -1.832 1961 HA VAL 55 HA VAL 55 4.412 5.535 0.463 1962 HB VAL 55 HB VAL 55 7.459 5.974 0.551 1963 HG11 VAL 55 1HG1 VAL 55 5.259 6.025 2.737 1964 HG12 VAL 55 2HG1 VAL 55 6.235 7.429 2.191 1965 HG13 VAL 55 3HG1 VAL 55 7.033 6.071 3.056 1966 HG21 VAL 55 3HG2 VAL 55 5.626 3.672 1.483 1967 HG22 VAL 55 1HG2 VAL 55 7.354 3.842 1.966 1968 HG23 VAL 55 2HG2 VAL 55 6.919 3.574 0.244 1969 H GLY 56 H GLY 56 7.190 7.573 -0.741 1970 HA2 GLY 56 2HA GLY 56 6.974 9.650 -1.661 1971 HA3 GLY 56 1HA GLY 56 5.269 9.762 -1.110 1972 H TYR 57 H TYR 57 4.862 9.881 1.185 1973 HA TYR 57 HA TYR 57 5.198 10.256 3.296 1974 HB2 TYR 57 2HB TYR 57 7.773 9.395 2.906 1975 HB3 TYR 57 1HB TYR 57 8.130 11.128 3.198 1976 HD1 TYR 57 2HD TYR 57 6.131 11.824 5.394 1977 HD2 TYR 57 1HD TYR 57 8.504 8.283 4.732 1978 HE1 TYR 57 2HE TYR 57 6.023 11.299 7.779 1979 HE2 TYR 57 1HE TYR 57 8.426 7.797 7.140 1980 HH TYR 57 HH TYR 57 7.626 8.414 9.171 1981 H GLY 58 H GLY 58 7.091 12.163 1.038 1982 HA2 GLY 58 2HA GLY 58 5.962 14.195 0.274 1983 HA3 GLY 58 1HA GLY 58 5.822 14.655 2.021 1984 H ASP 59 H ASP 59 8.586 13.052 0.263 1985 HA ASP 59 HA ASP 59 10.435 14.943 1.379 1986 HB2 ASP 59 2HB ASP 59 11.311 12.690 0.878 1987 HB3 ASP 59 1HB ASP 59 10.821 12.839 -0.841 1988 H ARG 60 H ARG 60 9.034 14.328 -1.941 1989 HA ARG 60 HA ARG 60 9.510 17.142 -2.544 1990 HB2 ARG 60 2HB ARG 60 10.262 14.943 -4.564 1991 HB3 ARG 60 1HB ARG 60 10.559 16.718 -4.709 1992 HG2 ARG 60 2HG ARG 60 12.146 16.530 -2.712 1993 HG3 ARG 60 1HG ARG 60 11.756 14.774 -2.689 1994 HD2 ARG 60 2HD ARG 60 12.749 14.598 -5.063 1995 HD3 ARG 60 1HD ARG 60 13.429 16.264 -4.795 1996 HE ARG 60 HE ARG 60 13.696 14.094 -2.708 1997 HH11 ARG 60 1HH2 ARG 60 15.805 15.976 -4.853 1998 HH12 ARG 60 2HH2 ARG 60 16.885 16.472 -3.691 1999 HH21 ARG 60 1HH1 ARG 60 14.753 14.952 -1.052 2000 HH22 ARG 60 2HH1 ARG 60 15.917 16.190 -1.217 2001 H TYR 61 H TYR 61 8.608 17.104 -5.224 2002 HA TYR 61 HA TYR 61 6.339 15.457 -5.459 2003 HB2 TYR 61 2HB TYR 61 4.743 17.279 -5.989 2004 HB3 TYR 61 1HB TYR 61 5.222 17.388 -4.267 2005 HD1 TYR 61 1HD TYR 61 6.641 19.320 -3.504 2006 HD2 TYR 61 2HD TYR 61 5.442 18.935 -7.610 2007 HE1 TYR 61 1HE TYR 61 7.431 21.620 -3.948 2008 HE2 TYR 61 2HE TYR 61 6.314 21.183 -8.089 2009 HH TYR 61 HH TYR 61 7.867 22.771 -7.254 2010 HA PRO 62 HA PRO 62 8.205 17.075 -9.346 2011 HB2 PRO 62 2HB PRO 62 7.324 14.807 -10.959 2012 HB3 PRO 62 1HB PRO 62 8.942 15.046 -10.235 2013 HG2 PRO 62 2HG PRO 62 7.073 13.009 -9.458 2014 HG3 PRO 62 1HG PRO 62 8.546 13.542 -8.555 2015 HD2 PRO 62 2HD PRO 62 5.640 14.403 -8.081 2016 HD3 PRO 62 1HD PRO 62 6.992 14.090 -6.907 2017 H VAL 63 H VAL 63 7.334 17.782 -11.536 2018 HA VAL 63 HA VAL 63 4.494 18.432 -11.124 2019 HB VAL 63 HB VAL 63 6.322 20.111 -10.970 2020 HG11 VAL 63 1HG1 VAL 63 6.500 19.869 -14.043 2021 HG12 VAL 63 2HG1 VAL 63 7.739 19.342 -12.851 2022 HG13 VAL 63 3HG1 VAL 63 7.319 21.077 -12.986 2023 HG21 VAL 63 3HG2 VAL 63 3.906 20.721 -11.260 2024 HG22 VAL 63 1HG2 VAL 63 4.176 20.892 -13.042 2025 HG23 VAL 63 2HG2 VAL 63 5.078 21.933 -11.895 2026 H THR 64 H THR 64 3.485 19.266 -13.446 2027 HA THR 64 HA THR 64 2.903 16.969 -14.851 2028 HB THR 64 HB THR 64 2.512 19.867 -15.787 2029 HG1 THR 64 1HG THR 64 1.068 18.480 -13.778 2030 HG21 THR 64 3HG2 THR 64 1.618 18.045 -17.292 2031 HG22 THR 64 1HG2 THR 64 0.299 19.031 -16.567 2032 HG23 THR 64 2HG2 THR 64 0.658 17.387 -15.923 2033 H GLU 65 H GLU 65 5.246 19.570 -15.433 2034 HA GLU 65 HA GLU 65 5.479 19.030 -18.222 2035 HB2 GLU 65 2HB GLU 65 5.787 21.327 -17.085 2036 HB3 GLU 65 1HB GLU 65 7.367 20.713 -16.492 2037 HG2 GLU 65 2HG GLU 65 7.800 22.061 -18.442 2038 HG3 GLU 65 1HG GLU 65 8.029 20.361 -18.982 2039 H GLU 66 H GLU 66 7.054 17.797 -15.286 2040 HA GLU 66 HA GLU 66 9.361 16.861 -16.618 2041 HB2 GLU 66 2HB GLU 66 10.029 15.901 -14.616 2042 HB3 GLU 66 1HB GLU 66 9.043 17.264 -14.085 2043 HG2 GLU 66 2HG GLU 66 8.378 15.658 -12.636 2044 HG3 GLU 66 1HG GLU 66 7.110 15.379 -13.881 2045 H GLY 67 H GLY 67 6.137 15.788 -15.968 2046 HA2 GLY 67 2HA GLY 67 4.852 14.770 -17.608 2047 HA3 GLY 67 1HA GLY 67 6.331 13.888 -18.206 2048 H ARG 68 H ARG 68 4.505 14.514 -15.172 2049 HA ARG 68 HA ARG 68 5.740 12.829 -13.611 2050 HB2 ARG 68 2HB ARG 68 3.783 14.596 -13.083 2051 HB3 ARG 68 1HB ARG 68 2.910 13.047 -12.779 2052 HG2 ARG 68 2HG ARG 68 5.252 12.469 -11.513 2053 HG3 ARG 68 1HG ARG 68 5.392 14.250 -11.468 2054 HD2 ARG 68 2HD ARG 68 3.091 12.519 -10.308 2055 HD3 ARG 68 1HD ARG 68 4.400 13.300 -9.360 2056 HE ARG 68 HE ARG 68 3.586 15.503 -9.930 2057 HH11 ARG 68 1HH2 ARG 68 1.236 12.750 -10.292 2058 HH12 ARG 68 2HH2 ARG 68 -0.063 13.769 -9.788 2059 HH21 ARG 68 1HH1 ARG 68 1.643 16.628 -9.145 2060 HH22 ARG 68 2HH1 ARG 68 0.155 15.795 -9.213 2061 H LYS 69 H LYS 69 4.291 11.592 -16.071 2062 HA LYS 69 HA LYS 69 3.494 9.005 -15.311 2063 HB2 LYS 69 2HB LYS 69 5.117 9.945 -17.761 2064 HB3 LYS 69 1HB LYS 69 4.220 8.412 -17.640 2065 HG2 LYS 69 2HG LYS 69 3.073 11.288 -17.723 2066 HG3 LYS 69 1HG LYS 69 3.139 10.161 -19.106 2067 HD2 LYS 69 2HD LYS 69 1.458 9.649 -16.552 2068 HD3 LYS 69 1HD LYS 69 0.885 10.529 -17.994 2069 HE2 LYS 69 2HE LYS 69 0.027 8.304 -18.200 2070 HE3 LYS 69 1HE LYS 69 1.344 8.457 -19.433 2071 HZ1 LYS 69 3HZ LYS 69 1.557 7.243 -16.726 2072 HZ2 LYS 69 1HZ LYS 69 2.797 7.246 -17.883 2073 HZ3 LYS 69 2HZ LYS 69 1.374 6.341 -18.131 2074 H VAL 70 H VAL 70 6.675 10.788 -15.329 2075 HA VAL 70 HA VAL 70 8.230 8.450 -15.500 2076 HB VAL 70 HB VAL 70 8.998 11.067 -14.133 2077 HG11 VAL 70 1HG1 VAL 70 11.317 10.279 -14.536 2078 HG12 VAL 70 2HG1 VAL 70 10.689 8.668 -15.086 2079 HG13 VAL 70 3HG1 VAL 70 10.454 9.223 -13.382 2080 HG21 VAL 70 3HG2 VAL 70 8.398 11.482 -16.489 2081 HG22 VAL 70 1HG2 VAL 70 9.375 10.060 -17.046 2082 HG23 VAL 70 2HG2 VAL 70 10.168 11.515 -16.316 2083 H ALA 71 H ALA 71 7.070 10.370 -12.700 2084 HA ALA 71 HA ALA 71 8.020 8.710 -10.687 2085 HB1 ALA 71 1HB ALA 71 6.250 9.702 -9.235 2086 HB2 ALA 71 2HB ALA 71 5.357 10.284 -10.688 2087 HB3 ALA 71 3HB ALA 71 6.971 10.973 -10.282 2088 H GLU 72 H GLU 72 4.842 8.667 -12.332 2089 HA GLU 72 HA GLU 72 3.588 6.585 -11.094 2090 HB2 GLU 72 2HB GLU 72 2.609 8.085 -12.933 2091 HB3 GLU 72 1HB GLU 72 3.628 7.199 -14.103 2092 HG2 GLU 72 2HG GLU 72 2.237 5.041 -13.237 2093 HG3 GLU 72 1HG GLU 72 1.078 6.303 -12.673 2094 H GLN 73 H GLN 73 5.889 6.444 -13.811 2095 HA GLN 73 HA GLN 73 5.565 3.770 -14.466 2096 HB2 GLN 73 2HB GLN 73 6.652 5.580 -15.862 2097 HB3 GLN 73 1HB GLN 73 8.068 5.551 -14.768 2098 HG2 GLN 73 2HG GLN 73 8.558 3.179 -15.484 2099 HG3 GLN 73 1HG GLN 73 7.126 3.213 -16.574 2100 HE21 GLN 73 1HE2 GLN 73 7.126 5.435 -17.993 2101 HE22 GLN 73 2HE2 GLN 73 8.605 5.790 -18.797 2102 H VAL 74 H VAL 74 7.609 5.336 -11.967 2103 HA VAL 74 HA VAL 74 9.242 3.034 -11.601 2104 HB VAL 74 HB VAL 74 8.834 5.094 -9.392 2105 HG11 VAL 74 1HG1 VAL 74 10.291 3.082 -8.981 2106 HG12 VAL 74 2HG1 VAL 74 11.272 4.589 -9.038 2107 HG13 VAL 74 3HG1 VAL 74 11.266 3.469 -10.449 2108 HG21 VAL 74 3HG2 VAL 74 10.649 6.463 -10.522 2109 HG22 VAL 74 1HG2 VAL 74 9.046 6.534 -11.292 2110 HG23 VAL 74 2HG2 VAL 74 10.349 5.533 -12.046 2111 H MET 75 H MET 75 6.321 4.379 -10.090 2112 HA MET 75 HA MET 75 6.129 2.716 -7.892 2113 HB2 MET 75 2HB MET 75 3.856 3.902 -9.602 2114 HB3 MET 75 1HB MET 75 3.670 3.278 -7.932 2115 HG2 MET 75 2HG MET 75 4.973 5.064 -6.990 2116 HG3 MET 75 1HG MET 75 5.646 5.537 -8.566 2117 HE1 MET 75 3HE MET 75 3.890 8.750 -7.889 2118 HE2 MET 75 1HE MET 75 5.367 7.841 -8.322 2119 HE3 MET 75 2HE MET 75 4.670 7.695 -6.668 2120 H LYS 76 H LYS 76 4.796 2.330 -11.206 2121 HA LYS 76 HA LYS 76 3.429 -0.046 -10.668 2122 HB2 LYS 76 2HB LYS 76 3.127 1.405 -12.752 2123 HB3 LYS 76 1HB LYS 76 4.640 0.688 -13.400 2124 HG2 LYS 76 2HG LYS 76 3.560 -1.615 -13.264 2125 HG3 LYS 76 1HG LYS 76 2.091 -0.849 -12.569 2126 HD2 LYS 76 2HD LYS 76 1.963 0.565 -14.731 2127 HD3 LYS 76 1HD LYS 76 3.193 -0.535 -15.439 2128 HE2 LYS 76 2HE LYS 76 0.452 -1.401 -14.251 2129 HE3 LYS 76 1HE LYS 76 0.748 -1.102 -16.001 2130 HZ1 LYS 76 3HZ LYS 76 2.005 -3.009 -16.186 2131 HZ2 LYS 76 1HZ LYS 76 0.746 -3.418 -15.174 2132 HZ3 LYS 76 2HZ LYS 76 2.353 -3.185 -14.549 2133 H ALA 77 H ALA 77 6.787 0.526 -11.733 2134 HA ALA 77 HA ALA 77 7.401 -2.174 -12.255 2135 HB1 ALA 77 1HB ALA 77 9.798 -1.464 -12.090 2136 HB2 ALA 77 2HB ALA 77 9.284 0.099 -11.349 2137 HB3 ALA 77 3HB ALA 77 8.850 -0.272 -13.058 2138 H GLY 78 H GLY 78 7.522 -0.179 -9.297 2139 HA2 GLY 78 2HA GLY 78 8.899 -2.042 -7.692 2140 HA3 GLY 78 1HA GLY 78 7.829 -0.684 -7.169 2141 H ILE 79 H ILE 79 5.398 -1.420 -8.195 2142 HA ILE 79 HA ILE 79 4.506 -3.239 -6.296 2143 HB ILE 79 HB ILE 79 3.191 -2.183 -8.833 2144 HG12 ILE 79 2HG1 ILE 79 2.803 -1.480 -5.843 2145 HG13 ILE 79 1HG1 ILE 79 3.826 -0.540 -6.965 2146 HG21 ILE 79 1HG2 ILE 79 1.002 -2.967 -7.819 2147 HG22 ILE 79 2HG2 ILE 79 1.916 -3.797 -6.512 2148 HG23 ILE 79 3HG2 ILE 79 2.065 -4.343 -8.221 2149 HD11 ILE 79 3HD ILE 79 0.765 -0.916 -7.182 2150 HD12 ILE 79 1HD ILE 79 1.659 0.578 -6.744 2151 HD13 ILE 79 2HD ILE 79 1.788 -0.083 -8.415 2152 H GLU 80 H GLU 80 5.247 -3.741 -9.802 2153 HA GLU 80 HA GLU 80 4.304 -6.380 -9.792 2154 HB2 GLU 80 2HB GLU 80 6.320 -5.048 -11.675 2155 HB3 GLU 80 1HB GLU 80 5.599 -6.679 -11.921 2156 HG2 GLU 80 2HG GLU 80 3.295 -5.671 -11.905 2157 HG3 GLU 80 1HG GLU 80 4.003 -4.028 -11.769 2158 H VAL 81 H VAL 81 7.481 -5.071 -8.842 2159 HA VAL 81 HA VAL 81 8.763 -7.603 -8.703 2160 HB VAL 81 HB VAL 81 9.332 -4.874 -7.451 2161 HG11 VAL 81 1HG1 VAL 81 10.277 -6.485 -5.843 2162 HG12 VAL 81 2HG1 VAL 81 11.621 -5.859 -6.848 2163 HG13 VAL 81 3HG1 VAL 81 10.953 -7.493 -7.174 2164 HG21 VAL 81 3HG2 VAL 81 10.720 -6.541 -9.671 2165 HG22 VAL 81 1HG2 VAL 81 11.176 -4.880 -9.144 2166 HG23 VAL 81 2HG2 VAL 81 9.603 -5.159 -9.960 2167 H PHE 82 H PHE 82 7.203 -5.499 -6.185 2168 HA PHE 82 HA PHE 82 7.711 -7.382 -4.145 2169 HB2 PHE 82 2HB PHE 82 5.630 -5.102 -4.262 2170 HB3 PHE 82 1HB PHE 82 5.978 -6.080 -2.782 2171 HD1 PHE 82 1HD PHE 82 8.669 -6.339 -2.323 2172 HD2 PHE 82 2HD PHE 82 6.737 -3.028 -4.278 2173 HE1 PHE 82 1HE PHE 82 10.570 -4.881 -1.739 2174 HE2 PHE 82 2HE PHE 82 8.641 -1.578 -3.704 2175 HZ PHE 82 HZ PHE 82 10.568 -2.491 -2.428 2176 H ALA 83 H ALA 83 4.906 -6.925 -6.321 2177 HA ALA 83 HA ALA 83 3.219 -8.721 -4.994 2178 HB1 ALA 83 1HB ALA 83 2.383 -7.160 -6.773 2179 HB2 ALA 83 2HB ALA 83 1.964 -8.866 -7.160 2180 HB3 ALA 83 3HB ALA 83 3.341 -8.057 -8.007 2181 H LEU 84 H LEU 84 5.780 -9.209 -7.451 2182 HA LEU 84 HA LEU 84 5.231 -11.844 -8.136 2183 HB2 LEU 84 2HB LEU 84 6.759 -10.306 -9.344 2184 HB3 LEU 84 1HB LEU 84 7.971 -10.462 -8.043 2185 HG LEU 84 HG LEU 84 6.940 -12.975 -9.448 2186 HD11 LEU 84 1HD1 LEU 84 9.008 -11.054 -10.699 2187 HD12 LEU 84 2HD1 LEU 84 7.344 -11.382 -11.310 2188 HD13 LEU 84 3HD1 LEU 84 8.571 -12.702 -11.303 2189 HD21 LEU 84 3HD2 LEU 84 9.751 -12.176 -8.421 2190 HD22 LEU 84 1HD2 LEU 84 9.317 -13.748 -9.188 2191 HD23 LEU 84 2HD2 LEU 84 8.609 -13.300 -7.606 2192 H VAL 85 H VAL 85 6.961 -10.515 -5.361 2193 HA VAL 85 HA VAL 85 8.224 -12.833 -4.487 2194 HB VAL 85 HB VAL 85 7.191 -10.421 -2.907 2195 HG11 VAL 85 1HG1 VAL 85 9.183 -12.630 -2.062 2196 HG12 VAL 85 2HG1 VAL 85 7.641 -12.167 -1.257 2197 HG13 VAL 85 3HG1 VAL 85 9.025 -11.029 -1.245 2198 HG21 VAL 85 3HG2 VAL 85 9.938 -11.057 -4.207 2199 HG22 VAL 85 1HG2 VAL 85 9.589 -9.645 -3.145 2200 HG23 VAL 85 2HG2 VAL 85 8.773 -9.794 -4.727 2201 H THR 86 H THR 86 4.793 -12.107 -4.547 2202 HA THR 86 HA THR 86 4.076 -13.571 -2.300 2203 HB THR 86 HB THR 86 2.565 -12.001 -3.623 2204 HG1 THR 86 1HG THR 86 1.753 -14.558 -2.744 2205 HG21 THR 86 3HG2 THR 86 1.881 -14.574 -5.233 2206 HG22 THR 86 1HG2 THR 86 2.864 -13.222 -5.884 2207 HG23 THR 86 2HG2 THR 86 1.163 -12.933 -5.383 2208 H ALA 87 H ALA 87 5.474 -14.711 -5.226 2209 HA ALA 87 HA ALA 87 4.358 -17.279 -5.346 2210 HB1 ALA 87 1HB ALA 87 6.458 -17.928 -6.548 2211 HB2 ALA 87 2HB ALA 87 7.243 -16.395 -6.004 2212 HB3 ALA 87 3HB ALA 87 5.856 -16.343 -7.143 2213 H ALA 88 H ALA 88 6.583 -15.783 -3.087 2214 HA ALA 88 HA ALA 88 7.414 -18.297 -1.905 2215 HB1 ALA 88 1HB ALA 88 9.001 -16.332 -1.820 2216 HB2 ALA 88 2HB ALA 88 8.499 -16.833 -0.175 2217 HB3 ALA 88 3HB ALA 88 7.763 -15.375 -0.934 2218 H LEU 89 H LEU 89 5.486 -15.438 -1.040 2219 HA LEU 89 HA LEU 89 4.729 -16.262 1.435 2220 HB2 LEU 89 2HB LEU 89 3.050 -14.484 -0.435 2221 HB3 LEU 89 1HB LEU 89 3.007 -14.489 1.357 2222 HG LEU 89 HG LEU 89 5.468 -13.688 -0.334 2223 HD11 LEU 89 1HD1 LEU 89 4.883 -11.351 0.188 2224 HD12 LEU 89 2HD1 LEU 89 3.394 -11.887 1.054 2225 HD13 LEU 89 3HD1 LEU 89 3.544 -12.134 -0.717 2226 HD21 LEU 89 3HD2 LEU 89 6.317 -12.698 1.795 2227 HD22 LEU 89 1HD2 LEU 89 6.085 -14.474 1.967 2228 HD23 LEU 89 2HD2 LEU 89 4.881 -13.335 2.675 2229 H ALA 90 H ALA 90 3.007 -16.860 -1.657 2230 HA ALA 90 HA ALA 90 0.667 -17.814 -0.347 2231 HB1 ALA 90 1HB ALA 90 0.552 -16.927 -2.656 2232 HB2 ALA 90 2HB ALA 90 0.004 -18.639 -2.614 2233 HB3 ALA 90 3HB ALA 90 1.661 -18.232 -3.219 2234 H THR 91 H THR 91 3.808 -19.254 -0.812 2235 HA THR 91 HA THR 91 2.674 -21.946 -0.590 2236 HB THR 91 HB THR 91 4.873 -22.873 -0.535 2237 HG1 THR 91 1HG THR 91 5.688 -20.173 -0.324 2238 HG21 THR 91 3HG2 THR 91 3.763 -22.342 -2.722 2239 HG22 THR 91 1HG2 THR 91 5.556 -22.328 -2.846 2240 HG23 THR 91 2HG2 THR 91 4.646 -20.771 -2.774 2241 H ASP 92 H ASP 92 3.479 -19.290 1.509 2242 HA ASP 92 HA ASP 92 4.934 -20.809 3.353 2243 HB2 ASP 92 2HB ASP 92 3.717 -18.019 3.448 2244 HB3 ASP 92 1HB ASP 92 4.098 -18.812 5.019 2245 H PHE 93 H PHE 93 1.505 -20.420 2.906 2246 HA PHE 93 HA PHE 93 0.945 -21.643 5.443 2247 HB2 PHE 93 2HB PHE 93 -1.292 -21.467 5.049 2248 HB3 PHE 93 1HB PHE 93 -0.669 -20.108 4.062 2249 HD1 PHE 93 2HD PHE 93 -0.442 -20.485 1.512 2250 HD2 PHE 93 1HD PHE 93 -2.668 -23.091 4.100 2251 HE1 PHE 93 2HE PHE 93 -1.716 -21.316 -0.428 2252 HE2 PHE 93 1HE PHE 93 -3.939 -23.936 2.160 2253 HZ PHE 93 HZ PHE 93 -3.494 -23.027 -0.111 2254 H VAL 94 H VAL 94 1.609 -22.766 2.167 2255 HA VAL 94 HA VAL 94 0.305 -25.213 2.295 2256 HB VAL 94 HB VAL 94 2.733 -24.450 0.597 2257 HG11 VAL 94 1HG1 VAL 94 1.840 -26.222 -0.968 2258 HG12 VAL 94 2HG1 VAL 94 0.606 -26.678 0.259 2259 HG13 VAL 94 3HG1 VAL 94 2.357 -26.925 0.599 2260 HG21 VAL 94 3HG2 VAL 94 -0.317 -24.209 0.089 2261 HG22 VAL 94 1HG2 VAL 94 0.968 -23.881 -1.129 2262 HG23 VAL 94 2HG2 VAL 94 0.815 -22.834 0.316 2263 H ARG 95 H ARG 95 3.445 -24.087 3.324 2264 HA ARG 95 HA ARG 95 4.835 -26.375 3.884 2265 HB2 ARG 95 2HB ARG 95 4.676 -23.730 5.458 2266 HB3 ARG 95 1HB ARG 95 5.900 -24.999 5.777 2267 HG2 ARG 95 2HG ARG 95 6.834 -24.783 3.543 2268 HG3 ARG 95 1HG ARG 95 5.638 -23.526 3.078 2269 HD2 ARG 95 2HD ARG 95 6.618 -21.836 4.435 2270 HD3 ARG 95 1HD ARG 95 7.342 -23.025 5.572 2271 HE ARG 95 HE ARG 95 9.025 -23.622 3.949 2272 HH11 ARG 95 1HH2 ARG 95 7.521 -20.301 3.497 2273 HH12 ARG 95 2HH2 ARG 95 8.676 -19.792 2.469 2274 HH21 ARG 95 1HH1 ARG 95 10.787 -22.671 2.637 2275 HH22 ARG 95 2HH1 ARG 95 10.530 -21.146 1.871 2276 H ARG 96 H ARG 96 1.928 -25.240 5.595 2277 HA ARG 96 HA ARG 96 2.523 -26.200 8.107 2278 HB2 ARG 96 2HB ARG 96 0.162 -26.117 8.640 2279 HB3 ARG 96 1HB ARG 96 0.582 -24.734 7.576 2280 HG2 ARG 96 2HG ARG 96 -0.264 -26.261 5.602 2281 HG3 ARG 96 1HG ARG 96 -1.004 -27.272 6.894 2282 HD2 ARG 96 2HD ARG 96 -2.252 -25.193 7.711 2283 HD3 ARG 96 1HD ARG 96 -1.553 -24.272 6.322 2284 HE ARG 96 HE ARG 96 -2.640 -25.892 4.772 2285 HH11 ARG 96 1HH2 ARG 96 -3.958 -25.997 8.166 2286 HH12 ARG 96 2HH2 ARG 96 -5.557 -26.240 7.693 2287 HH21 ARG 96 1HH1 ARG 96 -4.751 -26.533 4.154 2288 HH22 ARG 96 2HH1 ARG 96 -6.030 -26.671 5.313 2289 H GLU 97 H GLU 97 1.472 -28.030 5.236 2290 HA GLU 97 HA GLU 97 0.931 -30.340 6.921 2291 HB2 GLU 97 2HB GLU 97 0.246 -31.535 4.972 2292 HB3 GLU 97 1HB GLU 97 -0.607 -29.969 5.103 2293 HG2 GLU 97 2HG GLU 97 0.936 -29.016 3.320 2294 HG3 GLU 97 1HG GLU 97 1.718 -30.622 3.158 2295 H GLU 98 H GLU 98 3.707 -28.909 5.463 2296 HA GLU 98 HA GLU 98 5.019 -31.504 5.193 2297 HB2 GLU 98 2HB GLU 98 6.076 -28.741 4.439 2298 HB3 GLU 98 1HB GLU 98 6.980 -30.290 4.347 2299 HG2 GLU 98 2HG GLU 98 5.066 -31.207 2.873 2300 HG3 GLU 98 1HG GLU 98 4.447 -29.523 2.744 2301 H GLU 99 H GLU 99 4.612 -28.869 7.483 2302 HA GLU 99 HA GLU 99 6.937 -29.503 8.980 2303 HB2 GLU 99 2HB GLU 99 4.408 -27.992 9.889 2304 HB3 GLU 99 1HB GLU 99 5.873 -28.284 10.877 2305 HG2 GLU 99 2HG GLU 99 7.171 -27.140 8.849 2306 HG3 GLU 99 1HG GLU 99 5.566 -26.403 8.485 2307 H ARG 100 H ARG 100 3.442 -30.251 9.564 2308 HA ARG 100 HA ARG 100 3.842 -31.353 12.010 2309 HB2 ARG 100 2HB ARG 100 1.624 -32.474 11.822 2310 HB3 ARG 100 1HB ARG 100 1.601 -30.754 11.325 2311 HG2 ARG 100 2HG ARG 100 1.555 -31.381 8.936 2312 HG3 ARG 100 1HG ARG 100 1.719 -33.128 9.357 2313 HD2 ARG 100 2HD ARG 100 -0.505 -33.094 10.521 2314 HD3 ARG 100 1HD ARG 100 -0.676 -31.327 10.129 2315 HE ARG 100 HE ARG 100 -0.157 -33.067 7.766 2316 HH11 ARG 100 1HH2 ARG 100 -2.838 -32.101 10.018 2317 HH12 ARG 100 2HH2 ARG 100 -3.994 -31.892 8.818 2318 HH21 ARG 100 1HH1 ARG 100 -1.832 -33.073 6.104 2319 HH22 ARG 100 2HH1 ARG 100 -3.430 -32.725 6.482 2320 H ARG 101 H ARG 101 4.438 -32.948 8.970 2321 HA ARG 101 HA ARG 101 4.407 -35.600 10.168 2322 HB2 ARG 101 2HB ARG 101 5.391 -34.699 7.382 2323 HB3 ARG 101 1HB ARG 101 5.157 -36.394 7.931 2324 HG2 ARG 101 2HG ARG 101 2.971 -34.265 7.499 2325 HG3 ARG 101 1HG ARG 101 3.319 -35.727 6.511 2326 HD2 ARG 101 2HD ARG 101 2.849 -37.124 8.650 2327 HD3 ARG 101 1HD ARG 101 2.148 -35.623 9.394 2328 HE ARG 101 HE ARG 101 0.843 -35.628 7.022 2329 HH11 ARG 101 1HH2 ARG 101 1.194 -38.197 9.536 2330 HH12 ARG 101 2HH2 ARG 101 0.182 -39.319 8.736 2331 HH21 ARG 101 1HH1 ARG 101 -0.369 -37.302 5.821 2332 HH22 ARG 101 2HH1 ARG 101 -0.577 -38.838 6.448 2333 H GLY 102 H GLY 102 6.663 -32.976 9.899 2334 HA2 GLY 102 2HA GLY 102 8.769 -32.860 10.489 2335 HA3 GLY 102 1HA GLY 102 8.665 -34.566 11.073 2336 H HIS 103 H HIS 103 8.077 -33.407 7.750 2337 HA HIS 103 HA HIS 103 10.015 -35.335 6.773 2338 HB2 HIS 103 2HB HIS 103 8.050 -35.001 5.335 2339 HB3 HIS 103 1HB HIS 103 8.333 -33.228 5.282 2340 HD1 HIS 103 1HD HIS 103 9.755 -32.396 3.261 2341 HD2 HIS 103 2HD HIS 103 10.394 -36.522 4.054 2342 HE1 HIS 103 1HE HIS 103 11.348 -33.254 1.572 2343 HE2 HIS 103 2HE HIS 103 11.692 -35.689 1.961 2344 H1 SER 1 H SER 1 -3.914 -18.025 16.588 2345 HA SER 1 HA SER 1 -4.353 -19.325 18.472 2346 HB2 SER 1 2HB SER 1 -7.151 -19.766 17.254 2347 HB3 SER 1 1HB SER 1 -6.532 -20.525 18.773 2348 HG SER 1 1HG SER 1 -6.853 -17.758 18.196 2349 H ALA 2 H ALA 2 -5.072 -19.844 15.055 2350 HA ALA 2 HA ALA 2 -4.319 -22.661 15.267 2351 HB1 ALA 2 1HB ALA 2 -6.068 -22.058 13.575 2352 HB2 ALA 2 2HB ALA 2 -4.626 -22.830 12.839 2353 HB3 ALA 2 3HB ALA 2 -4.865 -21.045 12.705 2354 H ASP 3 H ASP 3 -2.464 -23.438 13.843 2355 HA ASP 3 HA ASP 3 -0.200 -22.167 14.769 2356 HB2 ASP 3 2HB ASP 3 -0.337 -24.245 12.506 2357 HB3 ASP 3 1HB ASP 3 1.194 -23.582 13.168 2358 H HIS 4 H HIS 4 -1.775 -21.774 11.633 2359 HA HIS 4 HA HIS 4 0.462 -20.280 10.583 2360 HB2 HIS 4 2HB HIS 4 -1.138 -19.547 8.722 2361 HB3 HIS 4 1HB HIS 4 -0.694 -21.271 8.843 2362 HD1 HIS 4 1HD HIS 4 -3.773 -19.061 9.941 2363 HD2 HIS 4 2HD HIS 4 -2.770 -23.070 8.953 2364 HE1 HIS 4 1HE HIS 4 -5.835 -20.311 9.888 2365 HE2 HIS 4 2HE HIS 4 -5.286 -22.736 9.349 2366 H GLU 5 H GLU 5 -2.272 -19.425 12.700 2367 HA GLU 5 HA GLU 5 -1.973 -16.643 11.969 2368 HB2 GLU 5 2HB GLU 5 -3.408 -17.062 14.511 2369 HB3 GLU 5 1HB GLU 5 -3.824 -16.100 13.068 2370 HG2 GLU 5 2HG GLU 5 -4.275 -19.119 13.444 2371 HG3 GLU 5 1HG GLU 5 -5.501 -17.824 13.669 2372 H ARG 6 H ARG 6 -0.794 -18.994 14.299 2373 HA ARG 6 HA ARG 6 0.178 -17.262 16.253 2374 HB2 ARG 6 2HB ARG 6 -0.040 -19.852 16.296 2375 HB3 ARG 6 1HB ARG 6 1.475 -19.910 15.338 2376 HG2 ARG 6 2HG ARG 6 2.581 -18.562 17.270 2377 HG3 ARG 6 1HG ARG 6 1.042 -18.815 18.169 2378 HD2 ARG 6 2HD ARG 6 1.398 -21.386 17.694 2379 HD3 ARG 6 1HD ARG 6 3.065 -20.911 17.144 2380 HE ARG 6 HE ARG 6 2.355 -19.850 19.802 2381 HH11 ARG 6 1HH2 ARG 6 3.368 -22.856 18.028 2382 HH12 ARG 6 2HH2 ARG 6 4.137 -23.566 19.361 2383 HH21 ARG 6 1HH1 ARG 6 3.340 -20.894 21.682 2384 HH22 ARG 6 2HH1 ARG 6 4.002 -22.475 21.555 2385 H GLU 7 H GLU 7 1.662 -18.559 13.261 2386 HA GLU 7 HA GLU 7 4.182 -17.427 13.691 2387 HB2 GLU 7 2HB GLU 7 3.270 -19.317 12.000 2388 HB3 GLU 7 1HB GLU 7 3.101 -17.930 10.880 2389 HG2 GLU 7 2HG GLU 7 5.252 -18.965 10.452 2390 HG3 GLU 7 1HG GLU 7 5.617 -17.443 11.345 2391 H ALA 8 H ALA 8 1.230 -16.276 12.086 2392 HA ALA 8 HA ALA 8 2.279 -13.907 11.001 2393 HB1 ALA 8 1HB ALA 8 -0.156 -13.200 10.855 2394 HB2 ALA 8 2HB ALA 8 -0.607 -14.595 11.885 2395 HB3 ALA 8 3HB ALA 8 0.083 -14.879 10.246 2396 H GLN 9 H GLN 9 0.759 -14.695 14.118 2397 HA GLN 9 HA GLN 9 0.485 -12.147 15.145 2398 HB2 GLN 9 2HB GLN 9 -0.503 -14.312 16.085 2399 HB3 GLN 9 1HB GLN 9 1.133 -14.755 16.665 2400 HG2 GLN 9 2HG GLN 9 1.113 -12.675 18.143 2401 HG3 GLN 9 1HG GLN 9 -0.577 -12.356 17.598 2402 HE21 GLN 9 1HE2 GLN 9 -0.433 -12.610 20.192 2403 HE22 GLN 9 2HE2 GLN 9 -0.826 -14.182 20.822 2404 H LYS 10 H LYS 10 3.275 -14.429 15.281 2405 HA LYS 10 HA LYS 10 4.690 -12.767 17.060 2406 HB2 LYS 10 2HB LYS 10 5.182 -15.221 16.848 2407 HB3 LYS 10 1HB LYS 10 5.842 -14.924 15.209 2408 HG2 LYS 10 2HG LYS 10 7.681 -15.165 16.847 2409 HG3 LYS 10 1HG LYS 10 7.657 -13.516 16.162 2410 HD2 LYS 10 2HD LYS 10 6.284 -12.856 18.331 2411 HD3 LYS 10 1HD LYS 10 6.874 -14.418 18.990 2412 HE2 LYS 10 2HE LYS 10 9.266 -13.588 18.644 2413 HE3 LYS 10 1HE LYS 10 8.606 -12.086 17.878 2414 HZ1 LYS 10 3HZ LYS 10 7.361 -11.811 20.118 2415 HZ2 LYS 10 1HZ LYS 10 8.996 -11.438 20.009 2416 HZ3 LYS 10 2HZ LYS 10 8.510 -12.889 20.736 2417 H ALA 11 H ALA 11 4.377 -12.774 13.562 2418 HA ALA 11 HA ALA 11 6.663 -11.296 12.941 2419 HB1 ALA 11 1HB ALA 11 3.949 -11.213 11.487 2420 HB2 ALA 11 2HB ALA 11 5.230 -12.452 11.214 2421 HB3 ALA 11 3HB ALA 11 5.546 -10.727 10.810 2422 H GLU 12 H GLU 12 3.556 -10.289 14.353 2423 HA GLU 12 HA GLU 12 3.824 -7.560 13.700 2424 HB2 GLU 12 2HB GLU 12 2.274 -8.810 16.042 2425 HB3 GLU 12 1HB GLU 12 2.195 -7.093 15.522 2426 HG2 GLU 12 2HG GLU 12 1.461 -7.933 13.196 2427 HG3 GLU 12 1HG GLU 12 1.246 -9.563 13.924 2428 H GLU 13 H GLU 13 5.157 -9.524 16.399 2429 HA GLU 13 HA GLU 13 5.928 -7.173 17.857 2430 HB2 GLU 13 2HB GLU 13 6.885 -10.059 18.225 2431 HB3 GLU 13 1HB GLU 13 7.292 -8.662 19.282 2432 HG2 GLU 13 2HG GLU 13 4.754 -8.325 19.648 2433 HG3 GLU 13 1HG GLU 13 4.509 -9.935 18.876 2434 H GLU 14 H GLU 14 7.345 -9.115 15.280 2435 HA GLU 14 HA GLU 14 9.999 -8.178 15.642 2436 HB2 GLU 14 2HB GLU 14 8.528 -9.373 13.241 2437 HB3 GLU 14 1HB GLU 14 10.263 -8.944 13.185 2438 HG2 GLU 14 2HG GLU 14 9.177 -10.826 15.384 2439 HG3 GLU 14 1HG GLU 14 9.605 -11.434 13.748 2440 H LEU 15 H LEU 15 7.103 -6.818 14.104 2441 HA LEU 15 HA LEU 15 8.555 -4.887 12.625 2442 HB2 LEU 15 2HB LEU 15 6.188 -5.577 12.104 2443 HB3 LEU 15 1HB LEU 15 5.631 -4.755 13.591 2444 HG LEU 15 HG LEU 15 6.247 -2.566 12.695 2445 HD11 LEU 15 1HD1 LEU 15 7.228 -2.295 10.364 2446 HD12 LEU 15 2HD1 LEU 15 7.552 -4.065 10.332 2447 HD13 LEU 15 3HD1 LEU 15 8.368 -3.002 11.539 2448 HD21 LEU 15 3HD2 LEU 15 4.843 -4.230 10.495 2449 HD22 LEU 15 1HD2 LEU 15 4.745 -2.447 10.698 2450 HD23 LEU 15 2HD2 LEU 15 4.057 -3.531 11.957 2451 H GLN 16 H GLN 16 7.114 -4.993 15.885 2452 HA GLN 16 HA GLN 16 7.447 -2.285 16.503 2453 HB2 GLN 16 2HB GLN 16 7.510 -4.688 18.422 2454 HB3 GLN 16 1HB GLN 16 7.362 -2.964 18.909 2455 HG2 GLN 16 2HG GLN 16 5.202 -2.808 17.574 2456 HG3 GLN 16 1HG GLN 16 5.295 -4.590 17.277 2457 HE21 GLN 16 1HE2 GLN 16 3.231 -3.084 18.886 2458 HE22 GLN 16 2HE2 GLN 16 3.343 -3.663 20.511 2459 H LYS 17 H LYS 17 9.684 -4.998 16.583 2460 HA LYS 17 HA LYS 17 11.725 -3.888 18.108 2461 HB2 LYS 17 2HB LYS 17 11.548 -6.300 17.299 2462 HB3 LYS 17 1HB LYS 17 11.987 -5.732 15.655 2463 HG2 LYS 17 2HG LYS 17 14.191 -4.853 16.629 2464 HG3 LYS 17 1HG LYS 17 13.741 -5.633 18.189 2465 HD2 LYS 17 2HD LYS 17 13.605 -7.855 17.008 2466 HD3 LYS 17 1HD LYS 17 13.977 -7.035 15.448 2467 HE2 LYS 17 2HE LYS 17 16.234 -6.337 16.331 2468 HE3 LYS 17 1HE LYS 17 15.871 -7.188 17.888 2469 HZ1 LYS 17 3HZ LYS 17 15.512 -9.234 16.430 2470 HZ2 LYS 17 1HZ LYS 17 17.125 -8.622 16.595 2471 HZ3 LYS 17 2HZ LYS 17 16.218 -8.359 15.172 2472 H VAL 18 H VAL 18 11.021 -3.677 14.591 2473 HA VAL 18 HA VAL 18 13.357 -2.240 13.964 2474 HB VAL 18 HB VAL 18 10.716 -2.361 12.413 2475 HG11 VAL 18 1HG1 VAL 18 12.240 -0.545 11.588 2476 HG12 VAL 18 2HG1 VAL 18 12.222 -1.913 10.426 2477 HG13 VAL 18 3HG1 VAL 18 13.621 -1.704 11.543 2478 HG21 VAL 18 3HG2 VAL 18 13.212 -4.198 12.378 2479 HG22 VAL 18 1HG2 VAL 18 11.870 -4.255 11.177 2480 HG23 VAL 18 2HG2 VAL 18 11.549 -4.662 12.888 2481 H LEU 19 H LEU 19 10.055 -1.282 14.977 2482 HA LEU 19 HA LEU 19 10.291 1.443 14.385 2483 HB2 LEU 19 2HB LEU 19 8.810 0.195 16.785 2484 HB3 LEU 19 1HB LEU 19 8.590 1.868 16.183 2485 HG LEU 19 HG LEU 19 7.934 -0.691 14.601 2486 HD11 LEU 19 1HD1 LEU 19 5.563 -0.190 15.046 2487 HD12 LEU 19 2HD1 LEU 19 6.005 1.271 15.998 2488 HD13 LEU 19 3HD1 LEU 19 6.442 -0.361 16.610 2489 HD21 LEU 19 3HD2 LEU 19 8.449 1.171 13.051 2490 HD22 LEU 19 1HD2 LEU 19 7.369 2.274 13.988 2491 HD23 LEU 19 2HD2 LEU 19 6.672 0.882 13.091 2492 H GLU 20 H GLU 20 11.011 -0.322 17.477 2493 HA GLU 20 HA GLU 20 11.895 2.059 18.716 2494 HB2 GLU 20 2HB GLU 20 12.682 0.685 20.596 2495 HB3 GLU 20 1HB GLU 20 10.988 0.369 20.110 2496 HG2 GLU 20 2HG GLU 20 11.752 -1.749 18.922 2497 HG3 GLU 20 1HG GLU 20 13.410 -1.468 19.561 2498 H GLU 21 H GLU 21 13.637 -0.600 17.053 2499 HA GLU 21 HA GLU 21 16.216 0.268 17.630 2500 HB2 GLU 21 2HB GLU 21 15.564 -1.987 16.584 2501 HB3 GLU 21 1HB GLU 21 15.234 -1.123 15.056 2502 HG2 GLU 21 2HG GLU 21 17.732 -0.354 15.135 2503 HG3 GLU 21 1HG GLU 21 17.945 -1.517 16.494 2504 H ALA 22 H ALA 22 14.018 1.017 14.855 2505 HA ALA 22 HA ALA 22 15.942 2.565 13.520 2506 HB1 ALA 22 1HB ALA 22 14.108 3.318 12.035 2507 HB2 ALA 22 2HB ALA 22 12.891 2.616 13.168 2508 HB3 ALA 22 3HB ALA 22 14.028 1.535 12.289 2509 H SER 23 H SER 23 13.657 3.353 16.086 2510 HA SER 23 HA SER 23 13.549 6.138 15.589 2511 HB2 SER 23 2HB SER 23 13.401 4.669 18.308 2512 HB3 SER 23 1HB SER 23 12.864 6.361 17.976 2513 HG SER 23 1HG SER 23 11.837 3.936 16.844 2514 H LYS 24 H LYS 24 15.760 4.038 17.383 2515 HA LYS 24 HA LYS 24 17.360 6.093 18.495 2516 HB2 LYS 24 2HB LYS 24 17.170 3.959 19.599 2517 HB3 LYS 24 1HB LYS 24 17.597 3.048 18.123 2518 HG2 LYS 24 2HG LYS 24 19.640 4.946 19.341 2519 HG3 LYS 24 1HG LYS 24 19.317 3.390 20.152 2520 HD2 LYS 24 2HD LYS 24 20.079 2.039 18.413 2521 HD3 LYS 24 1HD LYS 24 19.872 3.283 17.149 2522 HE2 LYS 24 2HE LYS 24 22.013 3.378 19.375 2523 HE3 LYS 24 1HE LYS 24 22.306 2.865 17.665 2524 HZ1 LYS 24 3HZ LYS 24 22.315 4.947 16.966 2525 HZ2 LYS 24 1HZ LYS 24 22.578 5.347 18.599 2526 HZ3 LYS 24 2HZ LYS 24 21.000 5.446 17.906 2527 H LYS 25 H LYS 25 17.235 4.447 15.405 2528 HA LYS 25 HA LYS 25 19.876 5.283 14.578 2529 HB2 LYS 25 2HB LYS 25 17.512 4.111 13.000 2530 HB3 LYS 25 1HB LYS 25 19.086 4.563 12.269 2531 HG2 LYS 25 2HG LYS 25 20.295 2.908 13.558 2532 HG3 LYS 25 1HG LYS 25 18.846 2.485 14.537 2533 HD2 LYS 25 2HD LYS 25 17.732 1.454 12.679 2534 HD3 LYS 25 1HD LYS 25 18.878 2.169 11.483 2535 HE2 LYS 25 2HE LYS 25 20.697 0.701 12.173 2536 HE3 LYS 25 1HE LYS 25 19.765 0.098 13.601 2537 HZ1 LYS 25 3HZ LYS 25 18.641 -0.358 10.877 2538 HZ2 LYS 25 1HZ LYS 25 18.467 -1.203 12.355 2539 HZ3 LYS 25 2HZ LYS 25 19.888 -1.318 11.467 2540 H ALA 26 H ALA 26 16.452 6.161 13.736 2541 HA ALA 26 HA ALA 26 17.001 8.137 11.951 2542 HB1 ALA 26 1HB ALA 26 14.684 8.957 12.377 2543 HB2 ALA 26 2HB ALA 26 14.619 8.006 13.912 2544 HB3 ALA 26 3HB ALA 26 14.729 7.162 12.323 2545 H VAL 27 H VAL 27 16.577 8.498 15.534 2546 HA VAL 27 HA VAL 27 16.733 11.296 15.401 2547 HB VAL 27 HB VAL 27 15.750 9.941 17.262 2548 HG11 VAL 27 1HG1 VAL 27 17.146 9.069 19.063 2549 HG12 VAL 27 2HG1 VAL 27 18.659 9.605 18.251 2550 HG13 VAL 27 3HG1 VAL 27 17.658 8.298 17.523 2551 HG21 VAL 27 3HG2 VAL 27 16.392 11.571 19.031 2552 HG22 VAL 27 1HG2 VAL 27 16.091 12.372 17.450 2553 HG23 VAL 27 2HG2 VAL 27 17.784 12.135 18.032 2554 H GLU 28 H GLU 28 19.213 8.804 15.400 2555 HA GLU 28 HA GLU 28 21.306 10.605 16.264 2556 HB2 GLU 28 2HB GLU 28 20.958 8.051 16.791 2557 HB3 GLU 28 1HB GLU 28 21.690 7.746 15.192 2558 HG2 GLU 28 2HG GLU 28 23.095 9.529 17.302 2559 HG3 GLU 28 1HG GLU 28 23.092 7.740 17.490 2560 H ALA 29 H ALA 29 19.996 9.058 13.398 2561 HA ALA 29 HA ALA 29 21.959 9.731 11.544 2562 HB1 ALA 29 1HB ALA 29 20.104 9.109 9.927 2563 HB2 ALA 29 2HB ALA 29 18.926 9.184 11.251 2564 HB3 ALA 29 3HB ALA 29 20.214 7.929 11.260 2565 H GLU 30 H GLU 30 18.774 11.236 12.330 2566 HA GLU 30 HA GLU 30 19.012 13.481 10.691 2567 HB2 GLU 30 2HB GLU 30 16.860 12.778 11.740 2568 HB3 GLU 30 1HB GLU 30 17.568 13.016 13.371 2569 HG2 GLU 30 2HG GLU 30 16.166 14.891 13.047 2570 HG3 GLU 30 1HG GLU 30 17.791 15.551 12.766 2571 H ARG 31 H ARG 31 20.077 12.889 14.100 2572 HA ARG 31 HA ARG 31 20.790 15.567 14.591 2573 HB2 ARG 31 2HB ARG 31 21.601 12.924 15.832 2574 HB3 ARG 31 1HB ARG 31 22.606 14.339 16.227 2575 HG2 ARG 31 2HG ARG 31 19.564 14.409 16.592 2576 HG3 ARG 31 1HG ARG 31 20.652 13.714 17.834 2577 HD2 ARG 31 2HD ARG 31 20.858 16.621 16.768 2578 HD3 ARG 31 1HD ARG 31 20.078 16.161 18.320 2579 HE ARG 31 HE ARG 31 22.980 16.212 17.663 2580 HH11 ARG 31 1HH2 ARG 31 20.507 15.077 20.027 2581 HH12 ARG 31 2HH2 ARG 31 21.547 15.027 21.369 2582 HH21 ARG 31 1HH1 ARG 31 24.316 16.497 19.607 2583 HH22 ARG 31 2HH1 ARG 31 23.885 15.810 21.084 2584 H GLY 32 H GLY 32 22.314 16.792 13.683 2585 HA2 GLY 32 2HA GLY 32 24.575 17.216 13.400 2586 HA3 GLY 32 1HA GLY 32 24.849 15.505 12.901 2587 H ALA 33 H ALA 33 21.979 16.058 11.452 2588 HA ALA 33 HA ALA 33 23.304 16.487 8.975 2589 HB1 ALA 33 1HB ALA 33 21.466 14.778 9.169 2590 HB2 ALA 33 2HB ALA 33 21.014 16.063 7.978 2591 HB3 ALA 33 3HB ALA 33 20.315 16.079 9.631 2592 HA PRO 34 HA PRO 34 21.899 20.741 8.767 2593 HB2 PRO 34 2HB PRO 34 22.096 21.293 6.040 2594 HB3 PRO 34 1HB PRO 34 23.554 21.075 7.089 2595 HG2 PRO 34 2HG PRO 34 22.203 18.983 5.295 2596 HG3 PRO 34 1HG PRO 34 23.962 19.402 5.390 2597 HD2 PRO 34 2HD PRO 34 22.817 17.267 6.781 2598 HD3 PRO 34 1HD PRO 34 24.195 18.227 7.495 2599 H GLY 35 H GLY 35 19.850 21.748 8.556 2600 HA2 GLY 35 2HA GLY 35 17.807 22.131 7.732 2601 HA3 GLY 35 1HA GLY 35 18.029 20.802 6.535 2602 H ALA 36 H ALA 36 18.771 19.939 9.759 2603 HA ALA 36 HA ALA 36 16.964 17.901 9.842 2604 HB1 ALA 36 1HB ALA 36 17.603 17.701 12.279 2605 HB2 ALA 36 2HB ALA 36 18.430 19.301 12.164 2606 HB3 ALA 36 3HB ALA 36 19.028 17.886 11.203 2607 H ALA 37 H ALA 37 15.057 17.491 10.873 2608 HA ALA 37 HA ALA 37 13.502 19.875 11.730 2609 HB1 ALA 37 1HB ALA 37 12.626 17.557 9.881 2610 HB2 ALA 37 2HB ALA 37 12.929 19.251 9.360 2611 HB3 ALA 37 3HB ALA 37 11.556 18.891 10.469 2612 H LEU 38 H LEU 38 14.216 16.386 11.985 2613 HA LEU 38 HA LEU 38 12.068 16.013 13.888 2614 HB2 LEU 38 2HB LEU 38 12.698 14.244 12.234 2615 HB3 LEU 38 1HB LEU 38 14.291 14.089 12.991 2616 HG LEU 38 HG LEU 38 13.179 13.293 15.124 2617 HD11 LEU 38 1HD1 LEU 38 10.554 13.443 13.503 2618 HD12 LEU 38 2HD1 LEU 38 10.972 14.431 14.955 2619 HD13 LEU 38 3HD1 LEU 38 10.756 12.660 15.105 2620 HD21 LEU 38 3HD2 LEU 38 13.976 11.688 13.365 2621 HD22 LEU 38 1HD2 LEU 38 12.363 11.753 12.569 2622 HD23 LEU 38 2HD2 LEU 38 12.520 11.051 14.214 2623 H ILE 39 H ILE 39 15.080 14.560 14.755 2624 HA ILE 39 HA ILE 39 16.408 14.774 16.462 2625 HB ILE 39 HB ILE 39 15.639 17.704 16.766 2626 HG12 ILE 39 2HG1 ILE 39 17.949 16.336 15.228 2627 HG13 ILE 39 1HG1 ILE 39 16.544 17.186 14.514 2628 HG21 ILE 39 1HG2 ILE 39 17.938 17.836 17.942 2629 HG22 ILE 39 2HG2 ILE 39 17.925 16.032 17.999 2630 HG23 ILE 39 3HG2 ILE 39 16.666 17.020 18.853 2631 HD11 ILE 39 3HD ILE 39 18.783 18.522 16.167 2632 HD12 ILE 39 1HD ILE 39 18.457 18.675 14.408 2633 HD13 ILE 39 2HD ILE 39 17.275 19.338 15.592 2634 H SER 40 H SER 40 16.102 15.261 19.073 2635 HA SER 40 HA SER 40 15.008 14.803 20.883 2636 HB2 SER 40 2HB SER 40 13.389 16.568 20.324 2637 HB3 SER 40 1HB SER 40 12.435 15.414 19.354 2638 HG SER 40 1HG SER 40 11.406 15.383 21.124 2639 H TYR 41 H TYR 41 14.868 12.843 21.846 2640 HA TYR 41 HA TYR 41 14.387 10.523 20.280 2641 HB2 TYR 41 2HB TYR 41 15.979 10.473 22.224 2642 HB3 TYR 41 1HB TYR 41 14.603 10.707 23.352 2643 HD1 TYR 41 2HD TYR 41 12.926 8.884 23.663 2644 HD2 TYR 41 1HD TYR 41 16.352 8.341 21.115 2645 HE1 TYR 41 2HE TYR 41 12.562 6.452 23.695 2646 HE2 TYR 41 1HE TYR 41 16.012 5.908 21.175 2647 HH TYR 41 HH TYR 41 14.943 4.236 22.799 2648 HA PRO 42 HA PRO 42 10.325 10.087 22.481 2649 HB2 PRO 42 2HB PRO 42 8.931 12.304 23.589 2650 HB3 PRO 42 1HB PRO 42 9.978 11.166 24.516 2651 HG2 PRO 42 2HG PRO 42 10.742 13.877 23.305 2652 HG3 PRO 42 1HG PRO 42 11.101 13.255 24.971 2653 HD2 PRO 42 2HD PRO 42 12.967 13.149 22.979 2654 HD3 PRO 42 1HD PRO 42 12.778 11.722 24.105 2655 H ASP 43 H ASP 43 11.051 12.795 20.432 2656 HA ASP 43 HA ASP 43 8.437 12.856 19.182 2657 HB2 ASP 43 2HB ASP 43 11.179 14.040 18.360 2658 HB3 ASP 43 1HB ASP 43 9.734 14.127 17.314 2659 H ALA 44 H ALA 44 11.765 11.637 18.539 2660 HA ALA 44 HA ALA 44 11.312 10.747 15.986 2661 HB1 ALA 44 1HB ALA 44 13.598 10.982 16.963 2662 HB2 ALA 44 2HB ALA 44 13.368 9.337 16.270 2663 HB3 ALA 44 3HB ALA 44 13.276 9.586 18.058 2664 H ILE 45 H ILE 45 10.628 9.135 19.044 2665 HA ILE 45 HA ILE 45 10.115 6.627 17.746 2666 HB ILE 45 HB ILE 45 11.176 6.852 19.945 2667 HG12 ILE 45 2HG1 ILE 45 8.602 5.179 20.088 2668 HG13 ILE 45 1HG1 ILE 45 10.046 4.741 19.125 2669 HG21 ILE 45 1HG2 ILE 45 8.376 7.574 21.019 2670 HG22 ILE 45 2HG2 ILE 45 9.710 8.755 20.774 2671 HG23 ILE 45 3HG2 ILE 45 9.907 7.417 21.951 2672 HD11 ILE 45 3HD ILE 45 10.025 5.154 22.194 2673 HD12 ILE 45 1HD ILE 45 10.087 3.579 21.323 2674 HD13 ILE 45 2HD ILE 45 11.462 4.736 21.193 2675 H TRP 46 H TRP 46 8.399 9.449 17.620 2676 HA TRP 46 HA TRP 46 5.816 8.031 17.604 2677 HB2 TRP 46 2HB TRP 46 6.542 10.772 18.319 2678 HB3 TRP 46 1HB TRP 46 5.461 10.802 16.894 2679 HD1 TRP 46 HD TRP 46 3.034 11.161 17.703 2680 HE1 TRP 46 1HE TRP 46 1.674 10.588 19.803 2681 HE3 TRP 46 3HE TRP 46 6.525 8.420 20.207 2682 HZ2 TRP 46 2HZ TRP 46 1.897 8.830 22.056 2683 HZ3 TRP 46 3HZ TRP 46 5.902 7.301 22.321 2684 HH2 TRP 46 HH TRP 46 3.619 7.511 23.236 2685 H TRP 47 H TRP 47 8.108 9.988 15.700 2686 HA TRP 47 HA TRP 47 6.908 9.885 13.243 2687 HB2 TRP 47 2HB TRP 47 8.862 11.291 13.848 2688 HB3 TRP 47 1HB TRP 47 9.887 9.824 14.055 2689 HD1 TRP 47 HD TRP 47 8.100 11.840 11.212 2690 HE1 TRP 47 1HE TRP 47 9.194 11.291 9.023 2691 HE3 TRP 47 3HE TRP 47 11.230 8.210 12.903 2692 HZ2 TRP 47 2HZ TRP 47 11.363 9.566 8.092 2693 HZ3 TRP 47 3HZ TRP 47 12.722 7.051 11.296 2694 HH2 TRP 47 HH TRP 47 12.809 7.745 8.930 2695 H SER 48 H SER 48 8.816 7.317 14.908 2696 HA SER 48 HA SER 48 9.144 5.769 12.564 2697 HB2 SER 48 2HB SER 48 9.580 3.882 14.292 2698 HB3 SER 48 1HB SER 48 10.657 5.325 14.342 2699 HG SER 48 1HG SER 48 10.102 5.125 16.362 2700 H VAL 49 H VAL 49 6.502 6.181 14.888 2701 HA VAL 49 HA VAL 49 5.234 3.708 14.067 2702 HB VAL 49 HB VAL 49 4.227 5.752 16.080 2703 HG11 VAL 49 1HG1 VAL 49 2.543 4.028 15.260 2704 HG12 VAL 49 2HG1 VAL 49 3.000 3.715 16.962 2705 HG13 VAL 49 3HG1 VAL 49 3.701 2.712 15.649 2706 HG21 VAL 49 3HG2 VAL 49 6.142 3.345 16.451 2707 HG22 VAL 49 1HG2 VAL 49 5.337 4.212 17.804 2708 HG23 VAL 49 2HG2 VAL 49 6.524 5.064 16.765 2709 H GLU 50 H GLU 50 5.324 4.865 11.878 2710 HA GLU 50 HA GLU 50 2.701 5.124 11.082 2711 HB2 GLU 50 2HB GLU 50 2.654 7.453 10.076 2712 HB3 GLU 50 1HB GLU 50 2.547 7.369 11.849 2713 HG2 GLU 50 2HG GLU 50 5.175 7.823 11.813 2714 HG3 GLU 50 1HG GLU 50 4.869 8.401 10.127 2715 H THR 51 H THR 51 6.118 5.787 10.557 2716 HA THR 51 HA THR 51 6.261 5.595 7.844 2717 HB THR 51 HB THR 51 8.301 4.618 9.932 2718 HG1 THR 51 1HG THR 51 7.923 6.744 10.439 2719 HG21 THR 51 3HG2 THR 51 8.589 5.615 7.002 2720 HG22 THR 51 1HG2 THR 51 8.944 3.961 7.603 2721 HG23 THR 51 2HG2 THR 51 9.965 5.342 8.135 2722 H ALA 52 H ALA 52 6.169 2.947 10.258 2723 HA ALA 52 HA ALA 52 6.849 0.887 8.463 2724 HB1 ALA 52 1HB ALA 52 7.027 0.548 10.912 2725 HB2 ALA 52 2HB ALA 52 5.899 -0.656 10.204 2726 HB3 ALA 52 3HB ALA 52 5.238 0.766 11.090 2727 H THR 53 H THR 53 3.788 2.605 9.003 2728 HA THR 53 HA THR 53 2.297 0.503 7.697 2729 HB THR 53 HB THR 53 0.493 2.517 7.971 2730 HG1 THR 53 1HG THR 53 2.037 3.930 8.938 2731 HG21 THR 53 3HG2 THR 53 -0.087 1.403 10.138 2732 HG22 THR 53 1HG2 THR 53 1.538 0.620 10.189 2733 HG23 THR 53 2HG2 THR 53 0.366 0.189 8.887 2734 H THR 54 H THR 54 4.513 2.607 6.524 2735 HA THR 54 HA THR 54 4.971 3.447 4.622 2736 HB THR 54 HB THR 54 3.700 2.468 2.495 2737 HG1 THR 54 1HG THR 54 2.175 1.417 4.085 2738 HG21 THR 54 3HG2 THR 54 5.562 0.866 4.383 2739 HG22 THR 54 1HG2 THR 54 6.058 2.073 3.129 2740 HG23 THR 54 2HG2 THR 54 5.276 0.539 2.631 2741 H VAL 55 H VAL 55 2.520 4.596 6.158 2742 HA VAL 55 HA VAL 55 1.306 6.082 3.965 2743 HB VAL 55 HB VAL 55 0.719 6.319 6.974 2744 HG11 VAL 55 1HG1 VAL 55 0.006 8.282 5.515 2745 HG12 VAL 55 2HG1 VAL 55 -1.406 7.347 6.121 2746 HG13 VAL 55 3HG1 VAL 55 -0.837 7.131 4.426 2747 HG21 VAL 55 3HG2 VAL 55 -0.454 4.525 4.748 2748 HG22 VAL 55 1HG2 VAL 55 -1.323 4.885 6.281 2749 HG23 VAL 55 2HG2 VAL 55 0.235 4.004 6.330 2750 H GLY 56 H GLY 56 2.804 6.907 7.193 2751 HA2 GLY 56 2HA GLY 56 4.367 8.480 7.619 2752 HA3 GLY 56 1HA GLY 56 4.374 8.987 5.884 2753 H TYR 57 H TYR 57 2.100 9.766 5.171 2754 HA TYR 57 HA TYR 57 0.403 11.070 5.224 2755 HB2 TYR 57 2HB TYR 57 -0.177 9.782 7.461 2756 HB3 TYR 57 1HB TYR 57 0.238 11.323 8.279 2757 HD1 TYR 57 1HD TYR 57 -1.072 13.026 5.709 2758 HD2 TYR 57 2HD TYR 57 -2.392 9.857 8.325 2759 HE1 TYR 57 1HE TYR 57 -3.358 13.671 5.322 2760 HE2 TYR 57 2HE TYR 57 -4.730 10.517 7.905 2761 HH TYR 57 HH TYR 57 -5.591 12.880 5.405 2762 H GLY 58 H GLY 58 2.606 12.099 7.920 2763 HA2 GLY 58 2HA GLY 58 3.385 14.351 6.433 2764 HA3 GLY 58 1HA GLY 58 2.180 14.821 7.709 2765 H ASP 59 H ASP 59 2.779 14.637 9.882 2766 HA ASP 59 HA ASP 59 4.122 15.157 11.465 2767 HB2 ASP 59 2HB ASP 59 3.883 12.662 11.778 2768 HB3 ASP 59 1HB ASP 59 5.505 12.461 11.091 2769 H ARG 60 H ARG 60 6.926 13.399 10.156 2770 HA ARG 60 HA ARG 60 8.269 15.906 9.585 2771 HB2 ARG 60 2HB ARG 60 9.067 13.971 11.784 2772 HB3 ARG 60 1HB ARG 60 10.375 14.472 10.694 2773 HG2 ARG 60 2HG ARG 60 10.514 15.907 12.527 2774 HG3 ARG 60 1HG ARG 60 9.946 16.882 11.143 2775 HD2 ARG 60 2HD ARG 60 8.870 17.489 13.347 2776 HD3 ARG 60 1HD ARG 60 7.648 16.973 12.124 2777 HE ARG 60 HE ARG 60 7.570 14.724 13.183 2778 HH11 ARG 60 1HH2 ARG 60 8.788 17.385 15.345 2779 HH12 ARG 60 2HH2 ARG 60 8.624 16.419 16.769 2780 HH21 ARG 60 1HH1 ARG 60 7.038 13.727 14.948 2781 HH22 ARG 60 2HH1 ARG 60 7.349 14.326 16.563 2782 H TYR 61 H TYR 61 10.538 15.161 8.518 2783 HA TYR 61 HA TYR 61 9.892 12.984 6.702 2784 HB2 TYR 61 2HB TYR 61 11.065 14.442 4.889 2785 HB3 TYR 61 1HB TYR 61 9.407 14.950 5.352 2786 HD1 TYR 61 2HD TYR 61 13.054 15.716 5.993 2787 HD2 TYR 61 1HD TYR 61 9.011 17.169 6.107 2788 HE1 TYR 61 2HE TYR 61 13.892 17.945 6.517 2789 HE2 TYR 61 1HE TYR 61 9.845 19.440 6.586 2790 HH TYR 61 HH TYR 61 13.376 20.052 7.054 2791 HA PRO 62 HA PRO 62 14.275 12.461 7.824 2792 HB2 PRO 62 2HB PRO 62 15.083 10.520 6.006 2793 HB3 PRO 62 1HB PRO 62 13.884 10.131 7.294 2794 HG2 PRO 62 2HG PRO 62 13.329 10.865 4.364 2795 HG3 PRO 62 1HG PRO 62 12.627 9.493 5.322 2796 HD2 PRO 62 2HD PRO 62 11.406 12.024 4.942 2797 HD3 PRO 62 1HD PRO 62 11.061 10.963 6.383 2798 H VAL 63 H VAL 63 16.484 12.846 6.719 2799 HA VAL 63 HA VAL 63 16.142 14.527 4.326 2800 HB VAL 63 HB VAL 63 18.122 15.820 5.105 2801 HG11 VAL 63 1HG1 VAL 63 15.816 15.686 7.156 2802 HG12 VAL 63 2HG1 VAL 63 15.737 16.531 5.565 2803 HG13 VAL 63 3HG1 VAL 63 16.899 17.076 6.838 2804 HG21 VAL 63 3HG2 VAL 63 18.852 15.560 7.486 2805 HG22 VAL 63 1HG2 VAL 63 19.180 14.025 6.600 2806 HG23 VAL 63 2HG2 VAL 63 17.770 14.172 7.721 2807 H THR 64 H THR 64 18.892 14.723 3.775 2808 HA THR 64 HA THR 64 19.185 12.307 2.330 2809 HB THR 64 HB THR 64 21.081 14.734 2.475 2810 HG1 THR 64 1HG THR 64 18.638 14.553 1.053 2811 HG21 THR 64 3HG2 THR 64 21.465 14.329 0.089 2812 HG22 THR 64 1HG2 THR 64 20.235 13.023 0.038 2813 HG23 THR 64 2HG2 THR 64 21.756 12.795 0.976 2814 H GLU 65 H GLU 65 21.051 14.185 4.671 2815 HA GLU 65 HA GLU 65 23.394 12.707 4.712 2816 HB2 GLU 65 2HB GLU 65 23.115 15.168 5.286 2817 HB3 GLU 65 1HB GLU 65 22.109 14.688 6.685 2818 HG2 GLU 65 2HG GLU 65 24.164 15.303 7.617 2819 HG3 GLU 65 1HG GLU 65 24.201 13.518 7.673 2820 H GLU 66 H GLU 66 20.330 12.375 6.397 2821 HA GLU 66 HA GLU 66 21.169 11.059 8.671 2822 HB2 GLU 66 2HB GLU 66 18.903 10.671 9.134 2823 HB3 GLU 66 1HB GLU 66 18.860 12.102 8.123 2824 HG2 GLU 66 2HG GLU 66 17.155 11.008 7.089 2825 HG3 GLU 66 1HG GLU 66 18.446 10.215 6.137 2826 H GLY 67 H GLY 67 20.922 10.162 5.395 2827 HA2 GLY 67 2HA GLY 67 21.874 8.406 4.338 2828 HA3 GLY 67 1HA GLY 67 22.049 7.527 5.931 2829 H ARG 68 H ARG 68 19.604 9.105 3.909 2830 HA ARG 68 HA ARG 68 17.242 8.520 4.634 2831 HB2 ARG 68 2HB ARG 68 17.880 9.752 2.617 2832 HB3 ARG 68 1HB ARG 68 18.475 8.241 1.877 2833 HG2 ARG 68 2HG ARG 68 15.746 7.649 2.255 2834 HG3 ARG 68 1HG ARG 68 15.686 9.406 2.077 2835 HD2 ARG 68 2HD ARG 68 15.397 7.995 -0.100 2836 HD3 ARG 68 1HD ARG 68 16.616 9.311 -0.160 2837 HE ARG 68 HE ARG 68 18.226 7.727 -0.625 2838 HH11 ARG 68 1HH2 ARG 68 15.662 5.997 1.250 2839 HH12 ARG 68 2HH2 ARG 68 16.355 4.433 0.869 2840 HH21 ARG 68 1HH1 ARG 68 19.027 5.369 -1.093 2841 HH22 ARG 68 2HH1 ARG 68 18.154 4.153 -0.235 2842 H LYS 69 H LYS 69 19.379 6.059 3.587 2843 HA LYS 69 HA LYS 69 17.734 3.858 3.121 2844 HB2 LYS 69 2HB LYS 69 20.550 4.129 4.299 2845 HB3 LYS 69 1HB LYS 69 19.818 2.565 3.783 2846 HG2 LYS 69 2HG LYS 69 19.759 3.199 1.472 2847 HG3 LYS 69 1HG LYS 69 20.095 4.925 1.829 2848 HD2 LYS 69 2HD LYS 69 22.353 4.358 2.672 2849 HD3 LYS 69 1HD LYS 69 22.103 2.625 2.251 2850 HE2 LYS 69 2HE LYS 69 22.070 3.105 -0.144 2851 HE3 LYS 69 1HE LYS 69 21.810 4.870 0.145 2852 HZ1 LYS 69 3HZ LYS 69 24.002 5.051 1.041 2853 HZ2 LYS 69 1HZ LYS 69 24.048 4.405 -0.533 2854 HZ3 LYS 69 2HZ LYS 69 24.347 3.405 0.802 2855 H VAL 70 H VAL 70 18.327 5.682 6.116 2856 HA VAL 70 HA VAL 70 17.854 3.484 7.821 2857 HB VAL 70 HB VAL 70 17.697 6.455 8.340 2858 HG11 VAL 70 1HG1 VAL 70 17.570 5.877 10.764 2859 HG12 VAL 70 2HG1 VAL 70 17.318 4.133 10.356 2860 HG13 VAL 70 3HG1 VAL 70 16.092 5.382 9.897 2861 HG21 VAL 70 3HG2 VAL 70 19.978 5.501 7.919 2862 HG22 VAL 70 1HG2 VAL 70 19.711 4.262 9.205 2863 HG23 VAL 70 2HG2 VAL 70 19.764 6.023 9.625 2864 H ALA 71 H ALA 71 15.825 6.270 6.721 2865 HA ALA 71 HA ALA 71 13.424 5.344 7.708 2866 HB1 ALA 71 1HB ALA 71 13.761 7.629 6.725 2867 HB2 ALA 71 2HB ALA 71 12.330 6.810 5.998 2868 HB3 ALA 71 3HB ALA 71 13.889 6.905 5.088 2869 H GLU 72 H GLU 72 14.974 4.648 4.619 2870 HA GLU 72 HA GLU 72 13.110 3.285 3.199 2871 HB2 GLU 72 2HB GLU 72 15.536 3.849 2.591 2872 HB3 GLU 72 1HB GLU 72 16.045 2.426 3.543 2873 HG2 GLU 72 2HG GLU 72 14.734 0.933 1.948 2874 HG3 GLU 72 1HG GLU 72 14.370 2.387 0.947 2875 H GLN 73 H GLN 73 15.184 1.957 5.802 2876 HA GLN 73 HA GLN 73 14.342 -0.700 5.316 2877 HB2 GLN 73 2HB GLN 73 15.806 -1.399 6.956 2878 HB3 GLN 73 1HB GLN 73 16.531 0.169 6.488 2879 HG2 GLN 73 2HG GLN 73 15.074 1.094 8.577 2880 HG3 GLN 73 1HG GLN 73 15.010 -0.636 9.042 2881 HE21 GLN 73 1HE2 GLN 73 16.926 2.242 8.906 2882 HE22 GLN 73 2HE2 GLN 73 18.474 1.591 9.389 2883 H VAL 74 H VAL 74 13.000 1.955 7.251 2884 HA VAL 74 HA VAL 74 11.708 0.238 9.122 2885 HB VAL 74 HB VAL 74 10.877 3.115 8.480 2886 HG11 VAL 74 1HG1 VAL 74 9.371 1.786 10.015 2887 HG12 VAL 74 2HG1 VAL 74 10.225 3.093 10.907 2888 HG13 VAL 74 3HG1 VAL 74 10.786 1.386 11.059 2889 HG21 VAL 74 3HG2 VAL 74 13.271 3.247 8.746 2890 HG22 VAL 74 1HG2 VAL 74 13.264 2.099 10.135 2891 HG23 VAL 74 2HG2 VAL 74 12.549 3.752 10.301 2892 H MET 75 H MET 75 10.756 2.081 6.217 2893 HA MET 75 HA MET 75 8.067 1.179 6.312 2894 HB2 MET 75 2HB MET 75 7.871 2.179 4.035 2895 HB3 MET 75 1HB MET 75 8.433 3.275 5.322 2896 HG2 MET 75 2HG MET 75 10.867 2.744 4.398 2897 HG3 MET 75 1HG MET 75 10.001 2.121 2.965 2898 HE1 MET 75 3HE MET 75 11.913 4.489 2.063 2899 HE2 MET 75 1HE MET 75 10.670 5.367 1.126 2900 HE3 MET 75 2HE MET 75 10.649 3.575 1.166 2901 H LYS 76 H LYS 76 11.021 0.045 4.532 2902 HA LYS 76 HA LYS 76 9.621 -1.823 3.001 2903 HB2 LYS 76 2HB LYS 76 12.094 -1.132 2.633 2904 HB3 LYS 76 1HB LYS 76 12.500 -2.244 3.979 2905 HG2 LYS 76 2HG LYS 76 11.147 -4.049 2.545 2906 HG3 LYS 76 1HG LYS 76 11.339 -2.885 1.198 2907 HD2 LYS 76 2HD LYS 76 13.855 -3.083 1.459 2908 HD3 LYS 76 1HD LYS 76 13.595 -4.163 2.880 2909 HE2 LYS 76 2HE LYS 76 12.317 -5.779 1.345 2910 HE3 LYS 76 1HE LYS 76 12.826 -4.767 -0.062 2911 HZ1 LYS 76 3HZ LYS 76 15.163 -5.231 0.578 2912 HZ2 LYS 76 1HZ LYS 76 14.248 -6.642 0.233 2913 HZ3 LYS 76 2HZ LYS 76 14.585 -6.233 1.851 2914 H ALA 77 H ALA 77 11.113 -2.100 6.279 2915 HA ALA 77 HA ALA 77 10.735 -4.857 6.534 2916 HB1 ALA 77 1HB ALA 77 12.183 -3.555 8.126 2917 HB2 ALA 77 2HB ALA 77 10.914 -4.474 9.013 2918 HB3 ALA 77 3HB ALA 77 10.722 -2.700 8.742 2919 H GLY 78 H GLY 78 8.568 -2.094 7.093 2920 HA2 GLY 78 2HA GLY 78 6.535 -3.451 8.464 2921 HA3 GLY 78 1HA GLY 78 6.397 -1.955 7.462 2922 H ILE 79 H ILE 79 7.058 -2.875 4.965 2923 HA ILE 79 HA ILE 79 4.695 -4.021 4.078 2924 HB ILE 79 HB ILE 79 7.427 -3.959 2.696 2925 HG12 ILE 79 2HG1 ILE 79 5.010 -2.052 2.417 2926 HG13 ILE 79 1HG1 ILE 79 6.461 -1.696 3.384 2927 HG21 ILE 79 1HG2 ILE 79 6.111 -4.228 0.554 2928 HG22 ILE 79 2HG2 ILE 79 4.599 -4.424 1.514 2929 HG23 ILE 79 3HG2 ILE 79 5.912 -5.652 1.610 2930 HD11 ILE 79 3HD ILE 79 6.394 -2.104 0.323 2931 HD12 ILE 79 1HD ILE 79 6.675 -0.575 1.218 2932 HD13 ILE 79 2HD ILE 79 7.897 -1.896 1.299 2933 H GLU 80 H GLU 80 7.924 -5.544 4.687 2934 HA GLU 80 HA GLU 80 7.147 -8.042 3.704 2935 HB2 GLU 80 2HB GLU 80 9.290 -7.518 5.847 2936 HB3 GLU 80 1HB GLU 80 9.032 -9.040 4.917 2937 HG2 GLU 80 2HG GLU 80 9.477 -7.720 2.767 2938 HG3 GLU 80 1HG GLU 80 9.991 -6.333 3.796 2939 H VAL 81 H VAL 81 6.721 -6.621 6.959 2940 HA VAL 81 HA VAL 81 5.997 -9.071 8.197 2941 HB VAL 81 HB VAL 81 5.540 -6.140 8.919 2942 HG11 VAL 81 1HG1 VAL 81 3.659 -7.355 9.968 2943 HG12 VAL 81 2HG1 VAL 81 4.890 -7.028 11.228 2944 HG13 VAL 81 3HG1 VAL 81 4.758 -8.672 10.520 2945 HG21 VAL 81 3HG2 VAL 81 7.912 -7.072 8.961 2946 HG22 VAL 81 1HG2 VAL 81 7.361 -8.369 10.081 2947 HG23 VAL 81 2HG2 VAL 81 7.324 -6.649 10.602 2948 H PHE 82 H PHE 82 4.049 -6.355 6.782 2949 HA PHE 82 HA PHE 82 1.593 -7.661 7.329 2950 HB2 PHE 82 2HB PHE 82 2.256 -5.463 5.260 2951 HB3 PHE 82 1HB PHE 82 0.585 -6.006 5.670 2952 HD1 PHE 82 2HD PHE 82 0.243 -6.155 8.426 2953 HD2 PHE 82 1HD PHE 82 2.799 -3.434 6.287 2954 HE1 PHE 82 2HE PHE 82 0.128 -4.561 10.306 2955 HE2 PHE 82 1HE PHE 82 2.685 -1.849 8.165 2956 HZ PHE 82 HZ PHE 82 1.350 -2.398 10.185 2957 H ALA 83 H ALA 83 3.938 -8.018 4.768 2958 HA ALA 83 HA ALA 83 2.142 -9.344 2.983 2959 HB1 ALA 83 1HB ALA 83 4.208 -8.149 2.182 2960 HB2 ALA 83 2HB ALA 83 4.179 -9.862 1.672 2961 HB3 ALA 83 3HB ALA 83 5.226 -9.357 3.051 2962 H LEU 84 H LEU 84 4.515 -10.343 5.482 2963 HA LEU 84 HA LEU 84 4.665 -13.027 4.836 2964 HB2 LEU 84 2HB LEU 84 6.186 -11.751 6.353 2965 HB3 LEU 84 1HB LEU 84 4.933 -11.736 7.625 2966 HG LEU 84 HG LEU 84 5.917 -14.390 6.443 2967 HD11 LEU 84 1HD1 LEU 84 7.993 -13.097 6.883 2968 HD12 LEU 84 2HD1 LEU 84 7.818 -14.458 8.050 2969 HD13 LEU 84 3HD1 LEU 84 7.455 -12.771 8.574 2970 HD21 LEU 84 3HD2 LEU 84 5.040 -13.596 9.306 2971 HD22 LEU 84 1HD2 LEU 84 5.599 -15.232 8.798 2972 HD23 LEU 84 2HD2 LEU 84 4.079 -14.561 8.128 2973 H VAL 85 H VAL 85 2.312 -11.267 6.856 2974 HA VAL 85 HA VAL 85 1.152 -13.588 7.927 2975 HB VAL 85 HB VAL 85 -0.649 -12.215 8.749 2976 HG11 VAL 85 1HG1 VAL 85 2.042 -10.675 8.931 2977 HG12 VAL 85 2HG1 VAL 85 1.720 -12.205 9.799 2978 HG13 VAL 85 3HG1 VAL 85 0.736 -10.742 10.156 2979 HG21 VAL 85 3HG2 VAL 85 0.589 -9.926 7.086 2980 HG22 VAL 85 1HG2 VAL 85 -0.801 -9.790 8.207 2981 HG23 VAL 85 2HG2 VAL 85 -0.972 -10.732 6.687 2982 H THR 86 H THR 86 1.112 -12.647 4.698 2983 HA THR 86 HA THR 86 -1.507 -13.262 3.987 2984 HB THR 86 HB THR 86 0.985 -13.628 2.267 2985 HG1 THR 86 1HG THR 86 1.010 -11.595 2.829 2986 HG21 THR 86 3HG2 THR 86 -0.636 -13.116 0.389 2987 HG22 THR 86 1HG2 THR 86 -2.003 -13.128 1.560 2988 HG23 THR 86 2HG2 THR 86 -1.078 -14.640 1.218 2989 H ALA 87 H ALA 87 1.026 -15.330 5.166 2990 HA ALA 87 HA ALA 87 0.193 -17.762 4.059 2991 HB1 ALA 87 1HB ALA 87 1.210 -17.223 6.930 2992 HB2 ALA 87 2HB ALA 87 2.256 -17.500 5.496 2993 HB3 ALA 87 3HB ALA 87 1.196 -18.826 6.097 2994 H ALA 88 H ALA 88 -1.154 -15.820 6.745 2995 HA ALA 88 HA ALA 88 -2.956 -17.862 7.652 2996 HB1 ALA 88 1HB ALA 88 -2.284 -16.008 9.199 2997 HB2 ALA 88 2HB ALA 88 -4.053 -15.973 8.914 2998 HB3 ALA 88 3HB ALA 88 -2.988 -14.794 8.066 2999 H LEU 89 H LEU 89 -3.088 -14.948 5.595 3000 HA LEU 89 HA LEU 89 -5.810 -14.985 5.066 3001 HB2 LEU 89 2HB LEU 89 -3.586 -13.953 3.210 3002 HB3 LEU 89 1HB LEU 89 -5.315 -13.491 3.150 3003 HG LEU 89 HG LEU 89 -3.390 -12.900 5.488 3004 HD11 LEU 89 1HD1 LEU 89 -4.475 -10.981 3.332 3005 HD12 LEU 89 2HD1 LEU 89 -2.806 -11.638 3.386 3006 HD13 LEU 89 3HD1 LEU 89 -3.383 -10.572 4.706 3007 HD21 LEU 89 3HD2 LEU 89 -5.745 -13.052 6.300 3008 HD22 LEU 89 1HD2 LEU 89 -6.284 -11.929 4.995 3009 HD23 LEU 89 2HD2 LEU 89 -5.185 -11.345 6.293 3010 H ALA 90 H ALA 90 -3.098 -16.554 3.348 3011 HA ALA 90 HA ALA 90 -4.612 -17.398 1.153 3012 HB1 ALA 90 1HB ALA 90 -2.055 -18.624 2.348 3013 HB2 ALA 90 2HB ALA 90 -2.117 -17.308 1.120 3014 HB3 ALA 90 3HB ALA 90 -2.708 -18.955 0.695 3015 H THR 91 H THR 91 -4.513 -18.611 4.429 3016 HA THR 91 HA THR 91 -5.495 -21.231 3.621 3017 HB THR 91 HB THR 91 -5.374 -20.118 6.471 3018 HG1 THR 91 1HG THR 91 -3.300 -19.986 5.479 3019 HG21 THR 91 3HG2 THR 91 -6.637 -22.249 6.221 3020 HG22 THR 91 1HG2 THR 91 -5.027 -22.665 6.901 3021 HG23 THR 91 2HG2 THR 91 -5.359 -22.944 5.160 3022 H ASP 92 H ASP 92 -6.722 -17.987 4.180 3023 HA ASP 92 HA ASP 92 -8.990 -18.739 5.620 3024 HB2 ASP 92 2HB ASP 92 -8.141 -16.315 5.501 3025 HB3 ASP 92 1HB ASP 92 -8.927 -16.211 3.881 3026 H PHE 93 H PHE 93 -8.400 -18.436 2.102 3027 HA PHE 93 HA PHE 93 -11.148 -18.858 1.511 3028 HB2 PHE 93 2HB PHE 93 -10.691 -18.990 -0.742 3029 HB3 PHE 93 1HB PHE 93 -9.495 -17.806 -0.138 3030 HD1 PHE 93 1HD PHE 93 -7.052 -18.540 0.050 3031 HD2 PHE 93 2HD PHE 93 -10.051 -21.042 -1.748 3032 HE1 PHE 93 1HE PHE 93 -5.291 -19.856 -1.067 3033 HE2 PHE 93 2HE PHE 93 -8.282 -22.381 -2.834 3034 HZ PHE 93 HZ PHE 93 -5.897 -21.769 -2.529 3035 H VAL 94 H VAL 94 -8.484 -21.001 2.298 3036 HA VAL 94 HA VAL 94 -9.557 -23.325 1.090 3037 HB VAL 94 HB VAL 94 -7.424 -23.108 3.275 3038 HG11 VAL 94 1HG1 VAL 94 -8.237 -25.459 2.940 3039 HG12 VAL 94 2HG1 VAL 94 -6.606 -25.270 2.208 3040 HG13 VAL 94 3HG1 VAL 94 -8.068 -25.288 1.158 3041 HG21 VAL 94 3HG2 VAL 94 -5.831 -23.111 1.293 3042 HG22 VAL 94 1HG2 VAL 94 -6.840 -21.639 1.326 3043 HG23 VAL 94 2HG2 VAL 94 -7.236 -22.969 0.184 3044 H ARG 95 H ARG 95 -10.104 -21.629 4.081 3045 HA ARG 95 HA ARG 95 -11.086 -23.529 5.801 3046 HB2 ARG 95 2HB ARG 95 -10.935 -21.021 6.302 3047 HB3 ARG 95 1HB ARG 95 -12.275 -20.762 5.155 3048 HG2 ARG 95 2HG ARG 95 -13.468 -20.593 7.053 3049 HG3 ARG 95 1HG ARG 95 -13.697 -22.326 6.767 3050 HD2 ARG 95 2HD ARG 95 -13.311 -21.964 9.119 3051 HD3 ARG 95 1HD ARG 95 -11.805 -22.769 8.493 3052 HE ARG 95 HE ARG 95 -11.324 -20.001 8.245 3053 HH11 ARG 95 1HH2 ARG 95 -12.690 -21.767 11.110 3054 HH12 ARG 95 2HH2 ARG 95 -11.672 -20.980 12.217 3055 HH21 ARG 95 1HH1 ARG 95 -10.095 -18.767 9.905 3056 HH22 ARG 95 2HH1 ARG 95 -10.376 -19.097 11.543 3057 H ARG 96 H ARG 96 -12.578 -22.138 2.885 3058 HA ARG 96 HA ARG 96 -15.190 -22.923 3.255 3059 HB2 ARG 96 2HB ARG 96 -15.592 -22.503 0.935 3060 HB3 ARG 96 1HB ARG 96 -14.239 -21.400 1.362 3061 HG2 ARG 96 2HG ARG 96 -12.669 -23.268 0.473 3062 HG3 ARG 96 1HG ARG 96 -14.141 -24.064 -0.191 3063 HD2 ARG 96 2HD ARG 96 -14.527 -22.151 -1.730 3064 HD3 ARG 96 1HD ARG 96 -13.087 -21.288 -1.034 3065 HE ARG 96 HE ARG 96 -11.710 -23.314 -1.666 3066 HH11 ARG 96 1HH2 ARG 96 -14.766 -22.793 -3.613 3067 HH12 ARG 96 2HH2 ARG 96 -14.257 -23.867 -4.843 3068 HH21 ARG 96 1HH1 ARG 96 -11.223 -24.917 -3.204 3069 HH22 ARG 96 2HH1 ARG 96 -12.095 -25.046 -4.680 3070 H GLU 97 H GLU 97 -12.375 -24.842 2.187 3071 HA GLU 97 HA GLU 97 -14.011 -26.877 0.978 3072 HB2 GLU 97 2HB GLU 97 -11.003 -26.591 1.488 3073 HB3 GLU 97 1HB GLU 97 -11.707 -28.120 0.866 3074 HG2 GLU 97 2HG GLU 97 -12.524 -27.125 -1.153 3075 HG3 GLU 97 1HG GLU 97 -12.287 -25.452 -0.538 3076 H GLU 98 H GLU 98 -12.309 -26.293 4.065 3077 HA GLU 98 HA GLU 98 -12.736 -28.959 4.966 3078 HB2 GLU 98 2HB GLU 98 -12.295 -26.433 6.665 3079 HB3 GLU 98 1HB GLU 98 -12.382 -28.134 7.237 3080 HG2 GLU 98 2HG GLU 98 -10.438 -28.624 5.552 3081 HG3 GLU 98 1HG GLU 98 -10.173 -26.835 5.534 3082 H GLU 99 H GLU 99 -14.533 -25.892 5.245 3083 HA GLU 99 HA GLU 99 -16.526 -26.823 6.955 3084 HB2 GLU 99 2HB GLU 99 -15.904 -24.387 6.308 3085 HB3 GLU 99 1HB GLU 99 -16.794 -24.661 4.780 3086 HG2 GLU 99 2HG GLU 99 -18.271 -23.482 6.244 3087 HG3 GLU 99 1HG GLU 99 -18.888 -25.175 6.251 3088 H ARG 100 H ARG 100 -16.288 -26.680 3.378 3089 HA ARG 100 HA ARG 100 -18.851 -27.583 2.837 3090 HB2 ARG 100 2HB ARG 100 -17.337 -26.461 1.185 3091 HB3 ARG 100 1HB ARG 100 -16.309 -27.935 1.132 3092 HG2 ARG 100 2HG ARG 100 -18.219 -29.220 0.163 3093 HG3 ARG 100 1HG ARG 100 -19.288 -27.780 0.323 3094 HD2 ARG 100 2HD ARG 100 -17.943 -26.524 -1.355 3095 HD3 ARG 100 1HD ARG 100 -16.741 -27.894 -1.445 3096 HE ARG 100 HE ARG 100 -19.512 -28.760 -1.939 3097 HH11 ARG 100 1HH2 ARG 100 -16.934 -26.859 -3.596 3098 HH12 ARG 100 2HH2 ARG 100 -17.286 -27.425 -5.161 3099 HH21 ARG 100 1HH1 ARG 100 -19.826 -29.765 -4.073 3100 HH22 ARG 100 2HH1 ARG 100 -18.991 -29.173 -5.448 3101 H ARG 101 H ARG 101 -15.801 -29.441 3.329 3102 HA ARG 101 HA ARG 101 -17.125 -31.932 2.768 3103 HB2 ARG 101 2HB ARG 101 -14.433 -31.228 4.038 3104 HB3 ARG 101 1HB ARG 101 -15.021 -32.926 3.979 3105 HG2 ARG 101 2HG ARG 101 -14.701 -31.183 1.458 3106 HG3 ARG 101 1HG ARG 101 -13.416 -32.234 2.141 3107 HD2 ARG 101 2HD ARG 101 -15.003 -34.251 1.935 3108 HD3 ARG 101 1HD ARG 101 -16.178 -33.182 1.087 3109 HE ARG 101 HE ARG 101 -14.935 -33.357 -0.835 3110 HH11 ARG 101 1HH2 ARG 101 -12.923 -34.674 1.904 3111 HH12 ARG 101 2HH2 ARG 101 -11.538 -34.935 0.980 3112 HH21 ARG 101 1HH1 ARG 101 -13.140 -34.256 -2.203 3113 HH22 ARG 101 2HH1 ARG 101 -11.756 -34.876 -1.464 3114 H GLY 102 H GLY 102 -16.402 -30.022 5.729 3115 HA2 GLY 102 2HA GLY 102 -17.653 -29.983 7.561 3116 HA3 GLY 102 1HA GLY 102 -18.514 -31.483 7.068 3117 H HIS 103 H HIS 103 -15.055 -31.239 6.997 3118 HA HIS 103 HA HIS 103 -13.418 -32.351 7.938 3119 HB2 HIS 103 2HB HIS 103 -14.915 -32.059 10.599 3120 HB3 HIS 103 1HB HIS 103 -13.183 -32.488 10.394 3121 HD1 HIS 103 1HD HIS 103 -15.458 -29.533 10.519 3122 HD2 HIS 103 2HD HIS 103 -11.492 -30.375 9.359 3123 HE1 HIS 103 1HE HIS 103 -14.277 -27.307 10.184 3124 HE2 HIS 103 2HE HIS 103 -11.852 -27.911 9.412 Start of MODEL 14 1 H1 SER 1 H SER 1 -23.543 -15.967 -4.595 2 HA SER 1 HA SER 1 -22.428 -17.557 -6.562 3 HB2 SER 1 2HB SER 1 -22.458 -14.532 -7.097 4 HB3 SER 1 1HB SER 1 -21.176 -15.608 -7.758 5 HG SER 1 1HG SER 1 -23.131 -15.210 -9.100 6 H ALA 2 H ALA 2 -21.181 -18.401 -5.126 7 HA ALA 2 HA ALA 2 -19.555 -18.756 -3.778 8 HB1 ALA 2 1HB ALA 2 -18.826 -15.782 -3.864 9 HB2 ALA 2 2HB ALA 2 -18.107 -17.052 -4.901 10 HB3 ALA 2 3HB ALA 2 -17.834 -17.076 -3.114 11 H ASP 3 H ASP 3 -18.807 -18.422 -1.578 12 HA ASP 3 HA ASP 3 -20.925 -17.599 0.241 13 HB2 ASP 3 2HB ASP 3 -18.931 -18.897 1.747 14 HB3 ASP 3 1HB ASP 3 -20.311 -19.740 0.994 15 H HIS 4 H HIS 4 -17.469 -17.749 -0.190 16 HA HIS 4 HA HIS 4 -16.570 -16.021 1.649 17 HB2 HIS 4 2HB HIS 4 -14.428 -15.887 0.330 18 HB3 HIS 4 1HB HIS 4 -15.086 -17.532 0.512 19 HD1 HIS 4 1HD HIS 4 -14.805 -14.834 -2.228 20 HD2 HIS 4 2HD HIS 4 -15.727 -18.926 -1.827 21 HE1 HIS 4 1HE HIS 4 -14.996 -15.781 -4.556 22 HE2 HIS 4 2HE HIS 4 -15.598 -18.230 -4.297 23 H GLU 5 H GLU 5 -18.068 -14.931 -1.352 24 HA GLU 5 HA GLU 5 -16.651 -12.435 -1.389 25 HB2 GLU 5 2HB GLU 5 -19.129 -13.390 -2.912 26 HB3 GLU 5 1HB GLU 5 -18.365 -11.777 -3.134 27 HG2 GLU 5 2HG GLU 5 -16.249 -12.767 -3.886 28 HG3 GLU 5 1HG GLU 5 -16.848 -14.427 -3.509 29 H ARG 6 H ARG 6 -19.549 -13.684 0.221 30 HA ARG 6 HA ARG 6 -20.655 -11.102 0.749 31 HB2 ARG 6 2HB ARG 6 -21.063 -13.850 2.071 32 HB3 ARG 6 1HB ARG 6 -22.052 -12.395 2.445 33 HG2 ARG 6 2HG ARG 6 -22.971 -12.304 0.220 34 HG3 ARG 6 1HG ARG 6 -21.827 -13.540 -0.415 35 HD2 ARG 6 2HD ARG 6 -22.830 -15.335 0.864 36 HD3 ARG 6 1HD ARG 6 -23.877 -14.185 1.807 37 HE ARG 6 HE ARG 6 -24.506 -13.741 -0.911 38 HH11 ARG 6 1HH2 ARG 6 -24.585 -16.568 1.356 39 HH12 ARG 6 2HH2 ARG 6 -26.093 -17.145 0.810 40 HH21 ARG 6 1HH1 ARG 6 -26.543 -14.595 -1.736 41 HH22 ARG 6 2HH1 ARG 6 -27.126 -16.101 -1.198 42 H GLU 7 H GLU 7 -18.307 -13.246 2.278 43 HA GLU 7 HA GLU 7 -18.309 -11.975 4.808 44 HB2 GLU 7 2HB GLU 7 -17.660 -14.338 4.339 45 HB3 GLU 7 1HB GLU 7 -16.182 -13.786 3.491 46 HG2 GLU 7 2HG GLU 7 -15.080 -13.214 5.486 47 HG3 GLU 7 1HG GLU 7 -16.606 -12.757 6.331 48 H ALA 8 H ALA 8 -16.432 -11.680 1.794 49 HA ALA 8 HA ALA 8 -14.543 -9.844 2.671 50 HB1 ALA 8 1HB ALA 8 -15.835 -10.062 -0.132 51 HB2 ALA 8 2HB ALA 8 -14.388 -10.983 0.430 52 HB3 ALA 8 3HB ALA 8 -14.310 -9.194 0.247 53 H GLN 9 H GLN 9 -17.817 -9.268 1.204 54 HA GLN 9 HA GLN 9 -17.434 -6.459 1.391 55 HB2 GLN 9 2HB GLN 9 -20.150 -7.834 1.126 56 HB3 GLN 9 1HB GLN 9 -19.733 -6.127 0.759 57 HG2 GLN 9 2HG GLN 9 -18.945 -8.659 -0.802 58 HG3 GLN 9 1HG GLN 9 -19.936 -7.280 -1.361 59 HE21 GLN 9 1HE2 GLN 9 -18.415 -4.994 -0.850 60 HE22 GLN 9 2HE2 GLN 9 -16.858 -5.106 -1.548 61 H LYS 10 H LYS 10 -18.495 -8.830 3.751 62 HA LYS 10 HA LYS 10 -19.849 -6.939 5.392 63 HB2 LYS 10 2HB LYS 10 -20.234 -9.452 5.500 64 HB3 LYS 10 1HB LYS 10 -18.585 -9.638 6.173 65 HG2 LYS 10 2HG LYS 10 -20.298 -9.787 7.946 66 HG3 LYS 10 1HG LYS 10 -19.237 -8.368 8.202 67 HD2 LYS 10 2HD LYS 10 -21.039 -6.907 7.127 68 HD3 LYS 10 1HD LYS 10 -22.121 -8.342 7.093 69 HE2 LYS 10 2HE LYS 10 -22.048 -8.443 9.615 70 HE3 LYS 10 1HE LYS 10 -20.802 -7.131 9.625 71 HZ1 LYS 10 3HZ LYS 10 -22.669 -5.964 10.023 72 HZ2 LYS 10 1HZ LYS 10 -23.701 -6.898 9.072 73 HZ3 LYS 10 2HZ LYS 10 -22.616 -5.820 8.328 74 H ALA 11 H ALA 11 -16.495 -7.794 4.820 75 HA ALA 11 HA ALA 11 -15.450 -6.739 7.236 76 HB1 ALA 11 1HB ALA 11 -14.041 -6.978 4.509 77 HB2 ALA 11 2HB ALA 11 -14.131 -8.289 5.741 78 HB3 ALA 11 3HB ALA 11 -13.255 -6.761 6.114 79 H GLU 12 H GLU 12 -16.235 -5.338 4.012 80 HA GLU 12 HA GLU 12 -15.000 -2.869 4.474 81 HB2 GLU 12 2HB GLU 12 -17.431 -3.400 2.656 82 HB3 GLU 12 1HB GLU 12 -16.489 -1.878 2.732 83 HG2 GLU 12 2HG GLU 12 -14.401 -3.267 2.068 84 HG3 GLU 12 1HG GLU 12 -15.546 -4.589 1.638 85 H GLU 13 H GLU 13 -18.155 -4.119 5.528 86 HA GLU 13 HA GLU 13 -19.253 -1.604 6.219 87 HB2 GLU 13 2HB GLU 13 -19.873 -4.380 7.395 88 HB3 GLU 13 1HB GLU 13 -20.822 -2.881 7.684 89 HG2 GLU 13 2HG GLU 13 -21.210 -2.686 5.189 90 HG3 GLU 13 1HG GLU 13 -20.451 -4.307 4.964 91 H GLU 14 H GLU 14 -17.123 -3.898 7.914 92 HA GLU 14 HA GLU 14 -17.492 -2.775 10.475 93 HB2 GLU 14 2HB GLU 14 -16.651 -5.136 9.959 94 HB3 GLU 14 1HB GLU 14 -15.097 -4.400 9.455 95 HG2 GLU 14 2HG GLU 14 -14.769 -5.280 11.644 96 HG3 GLU 14 1HG GLU 14 -14.871 -3.499 11.875 97 H LEU 15 H LEU 15 -15.371 -2.062 7.732 98 HA LEU 15 HA LEU 15 -13.552 -0.474 9.119 99 HB2 LEU 15 2HB LEU 15 -13.231 -1.366 6.772 100 HB3 LEU 15 1HB LEU 15 -14.399 -0.152 6.174 101 HG LEU 15 HG LEU 15 -12.891 1.687 6.813 102 HD11 LEU 15 1HD1 LEU 15 -11.105 -0.480 8.099 103 HD12 LEU 15 2HD1 LEU 15 -11.897 0.923 8.911 104 HD13 LEU 15 3HD1 LEU 15 -10.566 1.202 7.755 105 HD21 LEU 15 3HD2 LEU 15 -10.968 1.207 5.297 106 HD22 LEU 15 1HD2 LEU 15 -12.503 0.561 4.612 107 HD23 LEU 15 2HD2 LEU 15 -11.316 -0.555 5.379 108 H GLN 16 H GLN 16 -16.689 0.270 7.619 109 HA GLN 16 HA GLN 16 -16.411 3.080 7.874 110 HB2 GLN 16 2HB GLN 16 -18.900 1.333 7.493 111 HB3 GLN 16 1HB GLN 16 -18.864 3.125 7.318 112 HG2 GLN 16 2HG GLN 16 -17.275 2.988 5.438 113 HG3 GLN 16 1HG GLN 16 -17.084 1.215 5.633 114 HE21 GLN 16 1HE2 GLN 16 -18.570 -0.154 4.638 115 HE22 GLN 16 2HE2 GLN 16 -19.971 0.355 3.762 116 H LYS 17 H LYS 17 -17.387 0.554 10.089 117 HA LYS 17 HA LYS 17 -18.822 2.234 11.879 118 HB2 LYS 17 2HB LYS 17 -19.058 -0.268 11.810 119 HB3 LYS 17 1HB LYS 17 -17.367 -0.428 12.377 120 HG2 LYS 17 2HG LYS 17 -18.026 0.723 14.556 121 HG3 LYS 17 1HG LYS 17 -19.697 0.896 13.916 122 HD2 LYS 17 2HD LYS 17 -19.723 -1.018 15.383 123 HD3 LYS 17 1HD LYS 17 -19.828 -1.610 13.690 124 HE2 LYS 17 2HE LYS 17 -17.228 -1.989 13.838 125 HE3 LYS 17 1HE LYS 17 -17.394 -1.739 15.618 126 HZ1 LYS 17 3HZ LYS 17 -19.038 -3.700 14.099 127 HZ2 LYS 17 1HZ LYS 17 -18.701 -3.736 15.760 128 HZ3 LYS 17 2HZ LYS 17 -17.490 -4.049 14.573 129 H VAL 18 H VAL 18 -15.400 1.017 11.727 130 HA VAL 18 HA VAL 18 -14.755 2.330 14.152 131 HB VAL 18 HB VAL 18 -12.413 1.807 13.694 132 HG11 VAL 18 1HG1 VAL 18 -14.429 -0.517 13.271 133 HG12 VAL 18 2HG1 VAL 18 -13.981 0.228 14.857 134 HG13 VAL 18 3HG1 VAL 18 -12.747 -0.657 13.892 135 HG21 VAL 18 3HG2 VAL 18 -12.482 1.989 11.148 136 HG22 VAL 18 1HG2 VAL 18 -13.491 0.493 11.103 137 HG23 VAL 18 2HG2 VAL 18 -11.811 0.426 11.725 138 H LEU 19 H LEU 19 -14.831 3.379 10.774 139 HA LEU 19 HA LEU 19 -13.351 5.723 11.053 140 HB2 LEU 19 2HB LEU 19 -15.957 5.289 9.448 141 HB3 LEU 19 1HB LEU 19 -14.965 6.777 9.356 142 HG LEU 19 HG LEU 19 -14.016 3.982 8.514 143 HD11 LEU 19 1HD1 LEU 19 -14.791 6.450 6.834 144 HD12 LEU 19 2HD1 LEU 19 -15.770 4.948 6.993 145 HD13 LEU 19 3HD1 LEU 19 -14.149 4.887 6.205 146 HD21 LEU 19 3HD2 LEU 19 -12.658 6.735 8.429 147 HD22 LEU 19 1HD2 LEU 19 -12.100 5.314 7.484 148 HD23 LEU 19 2HD2 LEU 19 -12.074 5.263 9.280 149 H GLU 20 H GLU 20 -16.935 5.234 11.610 150 HA GLU 20 HA GLU 20 -17.152 7.936 12.439 151 HB2 GLU 20 2HB GLU 20 -19.263 5.761 12.799 152 HB3 GLU 20 1HB GLU 20 -19.446 7.518 13.124 153 HG2 GLU 20 2HG GLU 20 -18.669 7.858 10.619 154 HG3 GLU 20 1HG GLU 20 -19.076 6.117 10.414 155 H GLU 21 H GLU 21 -16.569 4.902 14.227 156 HA GLU 21 HA GLU 21 -16.931 6.058 16.784 157 HB2 GLU 21 2HB GLU 21 -16.743 3.552 16.360 158 HB3 GLU 21 1HB GLU 21 -14.993 3.783 16.054 159 HG2 GLU 21 2HG GLU 21 -14.742 4.698 18.417 160 HG3 GLU 21 1HG GLU 21 -16.487 4.379 18.710 161 H ALA 22 H ALA 22 -14.014 5.650 14.673 162 HA ALA 22 HA ALA 22 -12.261 6.824 16.491 163 HB1 ALA 22 1HB ALA 22 -11.946 6.549 13.451 164 HB2 ALA 22 2HB ALA 22 -11.444 5.332 14.674 165 HB3 ALA 22 3HB ALA 22 -10.631 6.937 14.621 166 H SER 23 H SER 23 -14.453 8.243 14.179 167 HA SER 23 HA SER 23 -13.169 10.738 13.914 168 HB2 SER 23 2HB SER 23 -16.200 10.117 13.910 169 HB3 SER 23 1HB SER 23 -15.423 11.620 13.280 170 HG SER 23 1HG SER 23 -14.999 8.944 12.339 171 H LYS 24 H LYS 24 -15.403 9.389 16.359 172 HA LYS 24 HA LYS 24 -15.716 11.842 17.788 173 HB2 LYS 24 2HB LYS 24 -17.363 9.936 17.901 174 HB3 LYS 24 1HB LYS 24 -16.154 8.940 18.766 175 HG2 LYS 24 2HG LYS 24 -17.123 11.663 19.855 176 HG3 LYS 24 1HG LYS 24 -18.083 10.161 20.066 177 HD2 LYS 24 2HD LYS 24 -16.127 9.078 21.258 178 HD3 LYS 24 1HD LYS 24 -15.210 10.607 21.112 179 HE2 LYS 24 2HE LYS 24 -16.084 10.471 23.348 180 HE3 LYS 24 1HE LYS 24 -16.931 11.818 22.497 181 HZ1 LYS 24 3HZ LYS 24 -18.033 9.793 23.895 182 HZ2 LYS 24 1HZ LYS 24 -18.293 9.257 22.310 183 HZ3 LYS 24 2HZ LYS 24 -18.886 10.777 22.788 184 H LYS 25 H LYS 25 -13.637 8.933 18.006 185 HA LYS 25 HA LYS 25 -12.280 9.630 20.336 186 HB2 LYS 25 2HB LYS 25 -11.221 8.070 17.898 187 HB3 LYS 25 1HB LYS 25 -10.350 8.212 19.453 188 HG2 LYS 25 2HG LYS 25 -12.020 6.968 20.660 189 HG3 LYS 25 1HG LYS 25 -13.147 6.935 19.259 190 HD2 LYS 25 2HD LYS 25 -11.749 5.441 18.002 191 HD3 LYS 25 1HD LYS 25 -10.333 5.693 19.080 192 HE2 LYS 25 2HE LYS 25 -11.308 4.379 20.870 193 HE3 LYS 25 1HE LYS 25 -12.933 4.353 20.078 194 HZ1 LYS 25 3HZ LYS 25 -12.349 2.733 18.695 195 HZ2 LYS 25 1HZ LYS 25 -11.267 2.338 19.916 196 HZ3 LYS 25 2HZ LYS 25 -10.690 3.147 18.568 197 H ALA 26 H ALA 26 -11.343 10.288 16.896 198 HA ALA 26 HA ALA 26 -8.924 11.455 17.494 199 HB1 ALA 26 1HB ALA 26 -10.730 12.022 15.060 200 HB2 ALA 26 2HB ALA 26 -9.590 10.634 15.206 201 HB3 ALA 26 3HB ALA 26 -8.951 12.311 15.169 202 H VAL 27 H VAL 27 -12.153 13.055 17.126 203 HA VAL 27 HA VAL 27 -10.955 15.631 17.306 204 HB VAL 27 HB VAL 27 -13.104 15.276 16.186 205 HG11 VAL 27 1HG1 VAL 27 -15.204 14.983 17.448 206 HG12 VAL 27 2HG1 VAL 27 -14.316 14.855 19.005 207 HG13 VAL 27 3HG1 VAL 27 -14.120 13.585 17.751 208 HG21 VAL 27 3HG2 VAL 27 -12.442 17.527 16.970 209 HG22 VAL 27 1HG2 VAL 27 -13.173 17.226 18.590 210 HG23 VAL 27 2HG2 VAL 27 -14.228 17.280 17.148 211 H GLU 28 H GLU 28 -12.223 13.282 19.684 212 HA GLU 28 HA GLU 28 -12.203 15.168 21.823 213 HB2 GLU 28 2HB GLU 28 -13.627 12.972 21.627 214 HB3 GLU 28 1HB GLU 28 -12.135 12.118 22.115 215 HG2 GLU 28 2HG GLU 28 -12.125 13.641 24.231 216 HG3 GLU 28 1HG GLU 28 -13.732 14.257 23.696 217 H ALA 29 H ALA 29 -9.953 12.996 20.310 218 HA ALA 29 HA ALA 29 -8.122 12.594 22.315 219 HB1 ALA 29 1HB ALA 29 -6.639 11.899 20.479 220 HB2 ALA 29 2HB ALA 29 -7.578 12.838 19.282 221 HB3 ALA 29 3HB ALA 29 -8.270 11.372 20.078 222 H GLU 30 H GLU 30 -8.348 15.154 19.843 223 HA GLU 30 HA GLU 30 -6.028 16.542 20.533 224 HB2 GLU 30 2HB GLU 30 -8.674 17.370 19.211 225 HB3 GLU 30 1HB GLU 30 -7.229 18.428 19.243 226 HG2 GLU 30 2HG GLU 30 -7.128 15.586 18.010 227 HG3 GLU 30 1HG GLU 30 -7.663 17.049 17.123 228 H ARG 31 H ARG 31 -9.032 16.341 22.253 229 HA ARG 31 HA ARG 31 -9.010 19.052 23.248 230 HB2 ARG 31 2HB ARG 31 -10.605 16.580 24.106 231 HB3 ARG 31 1HB ARG 31 -10.864 18.211 24.764 232 HG2 ARG 31 2HG ARG 31 -11.053 17.694 21.734 233 HG3 ARG 31 1HG ARG 31 -12.398 17.249 22.821 234 HD2 ARG 31 2HD ARG 31 -11.201 20.098 22.582 235 HD3 ARG 31 1HD ARG 31 -12.734 19.548 21.799 236 HE ARG 31 HE ARG 31 -12.243 20.079 24.704 237 HH11 ARG 31 1HH2 ARG 31 -14.520 18.502 22.379 238 HH12 ARG 31 2HH2 ARG 31 -15.789 18.381 23.533 239 HH21 ARG 31 1HH1 ARG 31 -13.858 19.725 26.239 240 HH22 ARG 31 2HH1 ARG 31 -15.328 18.914 25.871 241 H GLY 32 H GLY 32 -6.777 19.020 24.081 242 HA2 GLY 32 2HA GLY 32 -6.285 19.146 26.596 243 HA3 GLY 32 1HA GLY 32 -6.304 17.342 26.423 244 H ALA 33 H ALA 33 -5.400 18.106 23.423 245 HA ALA 33 HA ALA 33 -2.685 17.523 24.082 246 HB1 ALA 33 1HB ALA 33 -4.075 17.813 21.350 247 HB2 ALA 33 2HB ALA 33 -3.837 16.270 22.243 248 HB3 ALA 33 3HB ALA 33 -2.416 17.182 21.617 249 HA PRO 34 HA PRO 34 -1.517 21.777 23.303 250 HB2 PRO 34 2HB PRO 34 1.254 21.585 23.152 251 HB3 PRO 34 1HB PRO 34 0.344 21.289 24.685 252 HG2 PRO 34 2HG PRO 34 1.376 19.215 22.679 253 HG3 PRO 34 1HG PRO 34 1.553 19.210 24.482 254 HD2 PRO 34 2HD PRO 34 -0.462 17.814 23.117 255 HD3 PRO 34 1HD PRO 34 -0.722 18.516 24.783 256 H GLY 35 H GLY 35 -1.631 23.048 21.397 257 HA2 GLY 35 2HA GLY 35 -1.181 23.678 19.313 258 HA3 GLY 35 1HA GLY 35 0.082 22.395 19.194 259 H ALA 36 H ALA 36 -3.285 21.903 20.107 260 HA ALA 36 HA ALA 36 -3.707 19.788 18.369 261 HB1 ALA 36 1HB ALA 36 -5.101 20.091 20.410 262 HB2 ALA 36 2HB ALA 36 -6.147 20.078 18.947 263 HB3 ALA 36 3HB ALA 36 -5.756 21.642 19.748 264 H ALA 37 H ALA 37 -5.013 19.562 16.500 265 HA ALA 37 HA ALA 37 -5.294 22.074 14.936 266 HB1 ALA 37 1HB ALA 37 -3.161 20.900 14.287 267 HB2 ALA 37 2HB ALA 37 -4.374 20.836 12.954 268 HB3 ALA 37 3HB ALA 37 -4.090 19.391 14.004 269 H LEU 38 H LEU 38 -6.182 18.615 15.408 270 HA LEU 38 HA LEU 38 -8.177 18.767 13.296 271 HB2 LEU 38 2HB LEU 38 -6.563 16.823 13.582 272 HB3 LEU 38 1HB LEU 38 -7.297 16.493 15.165 273 HG LEU 38 HG LEU 38 -9.502 15.980 13.995 274 HD11 LEU 38 1HD1 LEU 38 -9.489 15.487 11.566 275 HD12 LEU 38 2HD1 LEU 38 -7.787 16.034 11.448 276 HD13 LEU 38 3HD1 LEU 38 -9.099 17.228 11.826 277 HD21 LEU 38 3HD2 LEU 38 -7.889 14.245 14.759 278 HD22 LEU 38 1HD2 LEU 38 -7.071 14.286 13.155 279 HD23 LEU 38 2HD2 LEU 38 -8.785 13.738 13.277 280 H ILE 39 H ILE 39 -8.864 20.591 15.237 281 HA ILE 39 HA ILE 39 -10.670 19.187 17.091 282 HB ILE 39 HB ILE 39 -8.938 20.282 18.195 283 HG12 ILE 39 2HG1 ILE 39 -11.512 21.921 18.577 284 HG13 ILE 39 1HG1 ILE 39 -11.252 20.241 19.161 285 HG21 ILE 39 1HG2 ILE 39 -8.224 21.938 16.505 286 HG22 ILE 39 2HG2 ILE 39 -8.508 22.731 18.075 287 HG23 ILE 39 3HG2 ILE 39 -9.724 22.900 16.763 288 HD11 ILE 39 3HD ILE 39 -9.594 22.719 20.000 289 HD12 ILE 39 1HD ILE 39 -10.810 21.841 21.004 290 HD13 ILE 39 2HD ILE 39 -9.275 21.026 20.527 291 H SER 40 H SER 40 -12.225 18.844 15.355 292 HA SER 40 HA SER 40 -13.941 21.199 15.024 293 HB2 SER 40 2HB SER 40 -13.121 19.377 12.671 294 HB3 SER 40 1HB SER 40 -14.300 20.752 12.613 295 HG SER 40 1HG SER 40 -12.405 21.398 11.826 296 H TYR 41 H TYR 41 -14.977 18.823 12.912 297 HA TYR 41 HA TYR 41 -15.921 16.798 14.472 298 HB2 TYR 41 2HB TYR 41 -17.712 19.166 14.669 299 HB3 TYR 41 1HB TYR 41 -18.552 17.790 13.867 300 HD1 TYR 41 1HD TYR 41 -18.610 15.545 14.972 301 HD2 TYR 41 2HD TYR 41 -17.421 19.095 17.086 302 HE1 TYR 41 1HE TYR 41 -19.159 14.458 17.110 303 HE2 TYR 41 2HE TYR 41 -17.944 18.001 19.227 304 HH TYR 41 HH TYR 41 -18.440 15.907 20.273 305 HA PRO 42 HA PRO 42 -17.802 16.257 10.294 306 HB2 PRO 42 2HB PRO 42 -18.039 18.231 8.316 307 HB3 PRO 42 1HB PRO 42 -19.255 18.025 9.631 308 HG2 PRO 42 2HG PRO 42 -16.882 19.980 9.561 309 HG3 PRO 42 1HG PRO 42 -18.613 20.344 9.954 310 HD2 PRO 42 2HD PRO 42 -16.708 19.884 11.915 311 HD3 PRO 42 1HD PRO 42 -18.421 19.283 12.110 312 H ASP 43 H ASP 43 -15.041 18.495 10.312 313 HA ASP 43 HA ASP 43 -13.701 17.516 8.097 314 HB2 ASP 43 2HB ASP 43 -12.389 18.470 10.751 315 HB3 ASP 43 1HB ASP 43 -11.678 18.504 9.108 316 H ALA 44 H ALA 44 -14.079 16.340 11.405 317 HA ALA 44 HA ALA 44 -11.570 15.049 11.598 318 HB1 ALA 44 1HB ALA 44 -12.821 15.757 13.660 319 HB2 ALA 44 2HB ALA 44 -12.471 13.995 13.680 320 HB3 ALA 44 3HB ALA 44 -14.126 14.572 13.266 321 H ILE 45 H ILE 45 -14.815 14.072 10.571 322 HA ILE 45 HA ILE 45 -14.156 11.313 10.448 323 HB ILE 45 HB ILE 45 -16.412 11.802 10.807 324 HG12 ILE 45 2HG1 ILE 45 -16.191 10.814 7.897 325 HG13 ILE 45 1HG1 ILE 45 -15.896 9.833 9.373 326 HG21 ILE 45 1HG2 ILE 45 -16.371 13.544 8.260 327 HG22 ILE 45 2HG2 ILE 45 -16.556 14.096 9.966 328 HG23 ILE 45 3HG2 ILE 45 -17.837 13.119 9.206 329 HD11 ILE 45 3HD ILE 45 -18.581 11.155 8.574 330 HD12 ILE 45 1HD ILE 45 -18.184 9.403 8.558 331 HD13 ILE 45 2HD ILE 45 -18.279 10.284 10.123 332 H TRP 46 H TRP 46 -13.815 14.043 8.163 333 HA TRP 46 HA TRP 46 -13.381 12.349 5.911 334 HB2 TRP 46 2HB TRP 46 -13.050 15.295 6.477 335 HB3 TRP 46 1HB TRP 46 -11.963 14.628 5.241 336 HD1 TRP 46 HD TRP 46 -12.900 15.989 3.297 337 HE1 TRP 46 1HE TRP 46 -15.133 16.138 2.059 338 HE3 TRP 46 3HE TRP 46 -15.679 12.832 6.240 339 HZ2 TRP 46 2HZ TRP 46 -17.630 14.749 2.060 340 HZ3 TRP 46 3HZ TRP 46 -17.964 12.262 5.551 341 HH2 TRP 46 HH TRP 46 -18.936 13.201 3.481 342 H TRP 47 H TRP 47 -11.240 13.819 8.372 343 HA TRP 47 HA TRP 47 -8.837 12.946 7.224 344 HB2 TRP 47 2HB TRP 47 -9.002 14.639 9.050 345 HB3 TRP 47 1HB TRP 47 -9.534 13.358 10.194 346 HD1 TRP 47 HD TRP 47 -6.324 14.323 8.085 347 HE1 TRP 47 1HE TRP 47 -4.277 13.458 9.391 348 HE3 TRP 47 3HE TRP 47 -8.779 11.669 11.674 349 HZ2 TRP 47 2HZ TRP 47 -3.783 11.871 11.717 350 HZ3 TRP 47 3HZ TRP 47 -7.475 10.439 13.380 351 HH2 TRP 47 HH TRP 47 -5.008 10.556 13.407 352 H SER 48 H SER 48 -11.211 11.339 9.316 353 HA SER 48 HA SER 48 -9.688 9.076 9.945 354 HB2 SER 48 2HB SER 48 -11.909 9.979 11.011 355 HB3 SER 48 1HB SER 48 -12.760 9.121 9.680 356 HG SER 48 1HG SER 48 -12.593 7.916 11.594 357 H VAL 49 H VAL 49 -11.912 9.833 7.221 358 HA VAL 49 HA VAL 49 -12.053 7.321 6.057 359 HB VAL 49 HB VAL 49 -12.221 10.133 4.879 360 HG11 VAL 49 1HG1 VAL 49 -13.277 9.084 2.843 361 HG12 VAL 49 2HG1 VAL 49 -12.803 7.454 3.445 362 HG13 VAL 49 3HG1 VAL 49 -11.552 8.662 2.990 363 HG21 VAL 49 3HG2 VAL 49 -14.000 9.275 6.571 364 HG22 VAL 49 1HG2 VAL 49 -14.401 8.001 5.378 365 HG23 VAL 49 2HG2 VAL 49 -14.643 9.739 4.960 366 H GLU 50 H GLU 50 -9.749 10.017 5.300 367 HA GLU 50 HA GLU 50 -8.436 8.486 3.351 368 HB2 GLU 50 2HB GLU 50 -6.739 10.320 3.322 369 HB3 GLU 50 1HB GLU 50 -8.434 10.882 3.221 370 HG2 GLU 50 2HG GLU 50 -8.322 11.307 5.780 371 HG3 GLU 50 1HG GLU 50 -6.541 11.066 5.655 372 H THR 51 H THR 51 -8.048 8.720 6.826 373 HA THR 51 HA THR 51 -5.446 7.619 6.974 374 HB THR 51 HB THR 51 -7.719 7.764 9.022 375 HG1 THR 51 1HG THR 51 -7.005 9.769 8.541 376 HG21 THR 51 3HG2 THR 51 -4.728 7.058 9.397 377 HG22 THR 51 1HG2 THR 51 -6.109 5.949 9.673 378 HG23 THR 51 2HG2 THR 51 -5.892 7.388 10.726 379 H ALA 52 H ALA 52 -8.752 6.183 6.914 380 HA ALA 52 HA ALA 52 -7.877 3.572 7.541 381 HB1 ALA 52 1HB ALA 52 -10.328 4.523 5.931 382 HB2 ALA 52 2HB ALA 52 -10.269 4.173 7.704 383 HB3 ALA 52 3HB ALA 52 -10.071 2.837 6.515 384 H THR 53 H THR 53 -8.001 5.395 4.453 385 HA THR 53 HA THR 53 -7.248 3.028 2.974 386 HB THR 53 HB THR 53 -7.058 4.884 1.103 387 HG1 THR 53 1HG THR 53 -7.213 6.631 2.599 388 HG21 THR 53 3HG2 THR 53 -9.727 4.125 2.494 389 HG22 THR 53 1HG2 THR 53 -8.838 3.113 1.291 390 HG23 THR 53 2HG2 THR 53 -9.538 4.699 0.794 391 H THR 54 H THR 54 -5.557 4.813 5.135 392 HA THR 54 HA THR 54 -3.503 5.187 5.552 393 HB THR 54 HB THR 54 -1.865 3.484 5.005 394 HG1 THR 54 1HG THR 54 -3.511 3.127 2.839 395 HG21 THR 54 3HG2 THR 54 -4.687 2.223 5.322 396 HG22 THR 54 1HG2 THR 54 -3.846 3.105 6.637 397 HG23 THR 54 2HG2 THR 54 -3.118 1.610 5.947 398 H VAL 55 H VAL 55 -4.466 7.023 3.677 399 HA VAL 55 HA VAL 55 -2.564 7.154 1.516 400 HB VAL 55 HB VAL 55 -4.620 9.270 2.378 401 HG11 VAL 55 1HG1 VAL 55 -4.421 9.930 -0.062 402 HG12 VAL 55 2HG1 VAL 55 -3.111 8.707 -0.276 403 HG13 VAL 55 3HG1 VAL 55 -2.861 10.124 0.805 404 HG21 VAL 55 3HG2 VAL 55 -5.662 6.986 2.001 405 HG22 VAL 55 1HG2 VAL 55 -4.923 6.945 0.366 406 HG23 VAL 55 2HG2 VAL 55 -6.145 8.210 0.794 407 H GLY 56 H GLY 56 -3.469 9.394 4.227 408 HA2 GLY 56 2HA GLY 56 -1.900 10.360 5.630 409 HA3 GLY 56 1HA GLY 56 -0.622 10.187 4.364 410 H TYR 57 H TYR 57 -0.731 11.508 2.483 411 HA TYR 57 HA TYR 57 -1.086 13.234 1.232 412 HB2 TYR 57 2HB TYR 57 -3.788 13.559 2.693 413 HB3 TYR 57 1HB TYR 57 -3.160 14.884 1.671 414 HD1 TYR 57 2HD TYR 57 -2.092 13.698 -0.735 415 HD2 TYR 57 1HD TYR 57 -5.612 12.736 1.552 416 HE1 TYR 57 2HE TYR 57 -3.246 13.043 -2.797 417 HE2 TYR 57 1HE TYR 57 -6.771 12.082 -0.512 418 HH TYR 57 HH TYR 57 -5.218 12.307 -3.744 419 H GLY 58 H GLY 58 -2.287 14.121 4.425 420 HA2 GLY 58 2HA GLY 58 -1.107 15.418 5.958 421 HA3 GLY 58 1HA GLY 58 -0.234 16.243 4.615 422 H ASP 59 H ASP 59 -3.679 15.517 5.387 423 HA ASP 59 HA ASP 59 -4.397 18.213 4.639 424 HB2 ASP 59 2HB ASP 59 -5.882 16.224 4.117 425 HB3 ASP 59 1HB ASP 59 -6.137 15.988 5.874 426 H ARG 60 H ARG 60 -4.040 16.160 7.634 427 HA ARG 60 HA ARG 60 -4.015 18.606 9.190 428 HB2 ARG 60 2HB ARG 60 -5.582 16.145 10.149 429 HB3 ARG 60 1HB ARG 60 -5.532 17.759 10.920 430 HG2 ARG 60 2HG ARG 60 -6.786 17.081 8.184 431 HG3 ARG 60 1HG ARG 60 -7.710 17.096 9.689 432 HD2 ARG 60 2HD ARG 60 -7.647 19.480 9.944 433 HD3 ARG 60 1HD ARG 60 -6.283 19.663 8.758 434 HE ARG 60 HE ARG 60 -7.912 18.537 7.069 435 HH11 ARG 60 1HH2 ARG 60 -9.294 20.784 9.581 436 HH12 ARG 60 2HH2 ARG 60 -10.835 20.807 8.795 437 HH21 ARG 60 1HH1 ARG 60 -9.758 18.793 6.029 438 HH22 ARG 60 2HH1 ARG 60 -11.074 19.766 6.616 439 H TYR 61 H TYR 61 -3.141 17.860 11.548 440 HA TYR 61 HA TYR 61 -1.352 15.607 11.245 441 HB2 TYR 61 2HB TYR 61 -0.545 18.330 12.477 442 HB3 TYR 61 1HB TYR 61 0.471 16.851 12.388 443 HD1 TYR 61 2HD TYR 61 0.082 16.050 9.459 444 HD2 TYR 61 1HD TYR 61 0.702 19.855 11.355 445 HE1 TYR 61 2HE TYR 61 1.212 16.865 7.447 446 HE2 TYR 61 1HE TYR 61 1.883 20.671 9.366 447 HH TYR 61 HH TYR 61 2.783 18.471 6.769 448 HA PRO 62 HA PRO 62 -3.306 15.786 15.434 449 HB2 PRO 62 2HB PRO 62 -2.490 13.225 16.288 450 HB3 PRO 62 1HB PRO 62 -3.834 13.452 15.096 451 HG2 PRO 62 2HG PRO 62 -0.867 12.846 14.643 452 HG3 PRO 62 1HG PRO 62 -2.292 11.988 13.909 453 HD2 PRO 62 2HD PRO 62 -0.827 14.017 12.657 454 HD3 PRO 62 1HD PRO 62 -2.614 13.788 12.339 455 H VAL 63 H VAL 63 -2.291 15.513 17.778 456 HA VAL 63 HA VAL 63 0.552 16.222 17.629 457 HB VAL 63 HB VAL 63 -1.086 16.453 20.162 458 HG11 VAL 63 1HG1 VAL 63 1.552 16.759 20.042 459 HG12 VAL 63 2HG1 VAL 63 0.623 18.145 20.691 460 HG13 VAL 63 3HG1 VAL 63 1.218 18.173 18.993 461 HG21 VAL 63 3HG2 VAL 63 -1.032 18.447 17.806 462 HG22 VAL 63 1HG2 VAL 63 -1.584 18.832 19.475 463 HG23 VAL 63 2HG2 VAL 63 -2.472 17.622 18.504 464 H THR 64 H THR 64 0.498 15.283 20.676 465 HA THR 64 HA THR 64 1.176 12.497 20.089 466 HB THR 64 HB THR 64 2.838 13.025 22.058 467 HG1 THR 64 1HG THR 64 3.285 15.296 22.175 468 HG21 THR 64 3HG2 THR 64 3.574 12.863 19.669 469 HG22 THR 64 1HG2 THR 64 4.442 14.199 20.486 470 HG23 THR 64 2HG2 THR 64 3.082 14.563 19.364 471 H GLU 65 H GLU 65 -0.610 14.673 22.183 472 HA GLU 65 HA GLU 65 -0.996 12.598 24.219 473 HB2 GLU 65 2HB GLU 65 -0.800 15.474 24.279 474 HB3 GLU 65 1HB GLU 65 -2.485 15.114 24.731 475 HG2 GLU 65 2HG GLU 65 -0.053 13.776 26.100 476 HG3 GLU 65 1HG GLU 65 -0.717 15.371 26.605 477 H GLU 66 H GLU 66 -2.167 13.076 21.217 478 HA GLU 66 HA GLU 66 -4.977 13.072 21.842 479 HB2 GLU 66 2HB GLU 66 -5.018 12.325 19.263 480 HB3 GLU 66 1HB GLU 66 -4.884 14.035 19.784 481 HG2 GLU 66 2HG GLU 66 -3.387 13.587 17.975 482 HG3 GLU 66 1HG GLU 66 -2.443 13.999 19.439 483 H GLY 67 H GLY 67 -2.311 10.880 21.046 484 HA2 GLY 67 2HA GLY 67 -2.869 9.042 22.861 485 HA3 GLY 67 1HA GLY 67 -4.012 8.588 21.529 486 H ARG 68 H ARG 68 -1.675 10.015 19.780 487 HA ARG 68 HA ARG 68 -0.190 9.475 18.490 488 HB2 ARG 68 2HB ARG 68 1.317 9.064 20.399 489 HB3 ARG 68 1HB ARG 68 0.784 7.355 20.489 490 HG2 ARG 68 2HG ARG 68 1.761 6.884 18.255 491 HG3 ARG 68 1HG ARG 68 2.207 8.596 18.038 492 HD2 ARG 68 2HD ARG 68 3.310 6.698 20.230 493 HD3 ARG 68 1HD ARG 68 4.178 7.152 18.702 494 HE ARG 68 HE ARG 68 3.772 9.601 19.615 495 HH11 ARG 68 1HH2 ARG 68 4.684 6.723 21.683 496 HH12 ARG 68 2HH2 ARG 68 5.519 7.696 22.806 497 HH21 ARG 68 1HH1 ARG 68 5.399 10.761 21.090 498 HH22 ARG 68 2HH1 ARG 68 5.902 9.938 22.476 499 H LYS 69 H LYS 69 -1.465 6.526 19.890 500 HA LYS 69 HA LYS 69 -1.490 5.202 17.332 501 HB2 LYS 69 2HB LYS 69 -2.434 4.180 20.064 502 HB3 LYS 69 1HB LYS 69 -2.291 3.215 18.552 503 HG2 LYS 69 2HG LYS 69 0.176 3.827 18.464 504 HG3 LYS 69 1HG LYS 69 0.024 4.547 20.101 505 HD2 LYS 69 2HD LYS 69 -0.671 2.358 21.033 506 HD3 LYS 69 1HD LYS 69 -0.639 1.601 19.405 507 HE2 LYS 69 2HE LYS 69 1.863 2.888 20.698 508 HE3 LYS 69 1HE LYS 69 1.409 1.159 20.959 509 HZ1 LYS 69 3HZ LYS 69 1.697 2.180 18.168 510 HZ2 LYS 69 1HZ LYS 69 1.810 0.633 18.780 511 HZ3 LYS 69 2HZ LYS 69 3.060 1.717 19.140 512 H VAL 70 H VAL 70 -3.319 7.642 18.006 513 HA VAL 70 HA VAL 70 -5.947 6.507 17.752 514 HB VAL 70 HB VAL 70 -5.031 9.341 16.983 515 HG11 VAL 70 1HG1 VAL 70 -7.799 8.132 17.716 516 HG12 VAL 70 2HG1 VAL 70 -7.281 8.659 16.070 517 HG13 VAL 70 3HG1 VAL 70 -7.449 9.870 17.385 518 HG21 VAL 70 3HG2 VAL 70 -5.877 9.942 19.291 519 HG22 VAL 70 1HG2 VAL 70 -4.370 8.986 19.284 520 HG23 VAL 70 2HG2 VAL 70 -5.941 8.185 19.703 521 H ALA 71 H ALA 71 -3.478 8.047 15.647 522 HA ALA 71 HA ALA 71 -4.846 7.596 13.228 523 HB1 ALA 71 1HB ALA 71 -2.633 8.008 12.127 524 HB2 ALA 71 2HB ALA 71 -1.806 7.891 13.729 525 HB3 ALA 71 3HB ALA 71 -2.955 9.238 13.391 526 H GLU 72 H GLU 72 -2.262 5.813 14.937 527 HA GLU 72 HA GLU 72 -1.791 3.809 13.149 528 HB2 GLU 72 2HB GLU 72 -0.514 4.248 15.359 529 HB3 GLU 72 1HB GLU 72 -1.843 3.371 16.191 530 HG2 GLU 72 2HG GLU 72 -1.267 1.326 14.724 531 HG3 GLU 72 1HG GLU 72 0.176 2.244 14.149 532 H GLN 73 H GLN 73 -4.398 3.928 15.675 533 HA GLN 73 HA GLN 73 -5.148 1.264 15.380 534 HB2 GLN 73 2HB GLN 73 -5.961 2.566 17.314 535 HB3 GLN 73 1HB GLN 73 -6.928 3.628 16.238 536 HG2 GLN 73 2HG GLN 73 -8.417 1.763 15.604 537 HG3 GLN 73 1HG GLN 73 -7.323 0.570 16.382 538 HE21 GLN 73 1HE2 GLN 73 -8.568 -0.271 18.013 539 HE22 GLN 73 2HE2 GLN 73 -9.364 0.651 19.249 540 H VAL 74 H VAL 74 -6.404 4.210 13.718 541 HA VAL 74 HA VAL 74 -8.394 2.765 12.314 542 HB VAL 74 HB VAL 74 -7.118 5.468 11.632 543 HG11 VAL 74 1HG1 VAL 74 -9.861 4.216 10.882 544 HG12 VAL 74 2HG1 VAL 74 -8.500 4.546 9.748 545 HG13 VAL 74 3HG1 VAL 74 -9.359 5.912 10.534 546 HG21 VAL 74 3HG2 VAL 74 -9.067 6.406 12.938 547 HG22 VAL 74 1HG2 VAL 74 -7.932 5.495 13.981 548 HG23 VAL 74 2HG2 VAL 74 -9.486 4.735 13.475 549 H MET 75 H MET 75 -5.058 3.776 11.630 550 HA MET 75 HA MET 75 -4.861 3.205 8.966 551 HB2 MET 75 2HB MET 75 -3.115 4.068 10.926 552 HB3 MET 75 1HB MET 75 -2.510 2.413 10.771 553 HG2 MET 75 2HG MET 75 -1.180 3.713 9.310 554 HG3 MET 75 1HG MET 75 -2.329 2.878 8.224 555 HE1 MET 75 3HE MET 75 -2.005 7.359 9.382 556 HE2 MET 75 1HE MET 75 -0.821 6.038 9.642 557 HE3 MET 75 2HE MET 75 -2.322 6.121 10.635 558 H LYS 76 H LYS 76 -4.177 1.087 11.768 559 HA LYS 76 HA LYS 76 -3.493 -1.162 10.242 560 HB2 LYS 76 2HB LYS 76 -2.835 -0.702 12.650 561 HB3 LYS 76 1HB LYS 76 -4.523 -1.041 13.142 562 HG2 LYS 76 2HG LYS 76 -4.307 -3.387 12.384 563 HG3 LYS 76 1HG LYS 76 -2.666 -3.061 11.714 564 HD2 LYS 76 2HD LYS 76 -1.790 -2.588 13.992 565 HD3 LYS 76 1HD LYS 76 -3.441 -2.674 14.672 566 HE2 LYS 76 2HE LYS 76 -2.105 -4.708 15.217 567 HE3 LYS 76 1HE LYS 76 -3.587 -5.112 14.269 568 HZ1 LYS 76 3HZ LYS 76 -2.362 -5.616 12.439 569 HZ2 LYS 76 1HZ LYS 76 -1.326 -6.154 13.683 570 HZ3 LYS 76 2HZ LYS 76 -0.996 -4.693 12.884 571 H ALA 77 H ALA 77 -6.577 -0.073 11.721 572 HA ALA 77 HA ALA 77 -8.018 -2.400 11.324 573 HB1 ALA 77 1HB ALA 77 -10.067 -0.994 11.487 574 HB2 ALA 77 2HB ALA 77 -9.079 0.492 11.209 575 HB3 ALA 77 3HB ALA 77 -8.853 -0.476 12.711 576 H GLY 78 H GLY 78 -7.414 0.325 9.069 577 HA2 GLY 78 2HA GLY 78 -9.145 -0.561 7.023 578 HA3 GLY 78 1HA GLY 78 -7.690 0.499 6.876 579 H ILE 79 H ILE 79 -5.656 -1.170 7.643 580 HA ILE 79 HA ILE 79 -5.321 -2.684 5.289 581 HB ILE 79 HB ILE 79 -3.622 -2.787 7.824 582 HG12 ILE 79 2HG1 ILE 79 -3.212 -1.008 5.332 583 HG13 ILE 79 1HG1 ILE 79 -3.964 -0.413 6.829 584 HG21 ILE 79 1HG2 ILE 79 -2.936 -3.386 4.851 585 HG22 ILE 79 2HG2 ILE 79 -3.141 -4.636 6.121 586 HG23 ILE 79 3HG2 ILE 79 -1.785 -3.480 6.226 587 HD11 ILE 79 3HD ILE 79 -1.086 -1.507 6.603 588 HD12 ILE 79 1HD ILE 79 -1.584 0.205 6.800 589 HD13 ILE 79 2HD ILE 79 -1.884 -0.971 8.133 590 H GLU 80 H GLU 80 -6.375 -3.539 8.600 591 HA GLU 80 HA GLU 80 -6.187 -6.341 8.304 592 HB2 GLU 80 2HB GLU 80 -8.054 -4.588 9.999 593 HB3 GLU 80 1HB GLU 80 -8.070 -6.380 10.095 594 HG2 GLU 80 2HG GLU 80 -5.808 -6.474 10.964 595 HG3 GLU 80 1HG GLU 80 -5.537 -4.724 10.653 596 H VAL 81 H VAL 81 -8.838 -4.017 7.608 597 HA VAL 81 HA VAL 81 -10.708 -5.947 6.800 598 HB VAL 81 HB VAL 81 -10.389 -2.952 6.333 599 HG11 VAL 81 1HG1 VAL 81 -11.602 -3.681 4.326 600 HG12 VAL 81 2HG1 VAL 81 -12.794 -2.991 5.468 601 HG13 VAL 81 3HG1 VAL 81 -12.660 -4.774 5.291 602 HG21 VAL 81 3HG2 VAL 81 -12.393 -4.666 7.969 603 HG22 VAL 81 1HG2 VAL 81 -12.281 -2.872 7.961 604 HG23 VAL 81 2HG2 VAL 81 -10.942 -3.841 8.651 605 H PHE 82 H PHE 82 -8.486 -3.851 4.836 606 HA PHE 82 HA PHE 82 -9.368 -5.106 2.442 607 HB2 PHE 82 2HB PHE 82 -6.858 -3.386 2.930 608 HB3 PHE 82 1HB PHE 82 -7.505 -3.849 1.311 609 HD1 PHE 82 2HD PHE 82 -10.394 -3.432 1.451 610 HD2 PHE 82 1HD PHE 82 -7.227 -1.105 3.220 611 HE1 PHE 82 2HE PHE 82 -11.852 -1.451 1.464 612 HE2 PHE 82 1HE PHE 82 -8.683 0.881 3.207 613 HZ PHE 82 HZ PHE 82 -11.000 0.723 2.324 614 H ALA 83 H ALA 83 -7.229 -6.280 4.845 615 HA ALA 83 HA ALA 83 -5.738 -7.910 2.928 616 HB1 ALA 83 1HB ALA 83 -4.702 -8.968 4.945 617 HB2 ALA 83 2HB ALA 83 -5.753 -7.951 6.005 618 HB3 ALA 83 3HB ALA 83 -4.511 -7.182 4.940 619 H LEU 84 H LEU 84 -8.495 -8.126 5.161 620 HA LEU 84 HA LEU 84 -8.589 -10.918 5.337 621 HB2 LEU 84 2HB LEU 84 -9.705 -9.205 6.836 622 HB3 LEU 84 1HB LEU 84 -10.918 -8.896 5.566 623 HG LEU 84 HG LEU 84 -10.485 -11.731 6.667 624 HD11 LEU 84 1HD1 LEU 84 -10.656 -10.282 8.683 625 HD12 LEU 84 2HD1 LEU 84 -12.122 -11.306 8.491 626 HD13 LEU 84 3HD1 LEU 84 -12.185 -9.559 8.052 627 HD21 LEU 84 3HD2 LEU 84 -12.096 -11.552 4.765 628 HD22 LEU 84 1HD2 LEU 84 -13.024 -10.280 5.640 629 HD23 LEU 84 2HD2 LEU 84 -12.959 -11.962 6.278 630 H VAL 85 H VAL 85 -9.955 -8.602 3.006 631 HA VAL 85 HA VAL 85 -11.696 -10.369 1.749 632 HB VAL 85 HB VAL 85 -11.825 -8.776 -0.087 633 HG11 VAL 85 1HG1 VAL 85 -11.610 -7.325 2.651 634 HG12 VAL 85 2HG1 VAL 85 -12.992 -8.359 2.154 635 HG13 VAL 85 3HG1 VAL 85 -12.619 -6.857 1.243 636 HG21 VAL 85 3HG2 VAL 85 -10.381 -6.715 -0.077 637 HG22 VAL 85 1HG2 VAL 85 -9.385 -8.188 -0.319 638 HG23 VAL 85 2HG2 VAL 85 -9.429 -7.385 1.290 639 H THR 86 H THR 86 -8.219 -10.385 1.665 640 HA THR 86 HA THR 86 -7.857 -11.354 -0.889 641 HB THR 86 HB THR 86 -6.139 -11.791 1.585 642 HG1 THR 86 1HG THR 86 -5.165 -9.870 0.849 643 HG21 THR 86 3HG2 THR 86 -5.466 -11.779 -1.454 644 HG22 THR 86 1HG2 THR 86 -5.416 -13.224 -0.373 645 HG23 THR 86 2HG2 THR 86 -4.263 -11.871 -0.116 646 H ALA 87 H ALA 87 -9.350 -12.886 1.833 647 HA ALA 87 HA ALA 87 -8.986 -15.584 1.153 648 HB1 ALA 87 1HB ALA 87 -11.547 -14.199 2.212 649 HB2 ALA 87 2HB ALA 87 -10.193 -14.747 3.246 650 HB3 ALA 87 3HB ALA 87 -11.163 -15.959 2.332 651 H ALA 88 H ALA 88 -10.968 -12.988 -0.308 652 HA ALA 88 HA ALA 88 -12.482 -14.862 -1.914 653 HB1 ALA 88 1HB ALA 88 -13.430 -12.802 -3.015 654 HB2 ALA 88 2HB ALA 88 -12.288 -11.787 -2.079 655 HB3 ALA 88 3HB ALA 88 -13.580 -12.693 -1.216 656 H LEU 89 H LEU 89 -9.587 -12.838 -2.127 657 HA LEU 89 HA LEU 89 -9.492 -12.917 -4.969 658 HB2 LEU 89 2HB LEU 89 -7.252 -12.232 -2.983 659 HB3 LEU 89 1HB LEU 89 -7.248 -11.880 -4.742 660 HG LEU 89 HG LEU 89 -9.250 -10.709 -2.702 661 HD11 LEU 89 1HD1 LEU 89 -6.789 -9.424 -4.041 662 HD12 LEU 89 2HD1 LEU 89 -6.939 -9.869 -2.303 663 HD13 LEU 89 3HD1 LEU 89 -7.989 -8.583 -2.988 664 HD21 LEU 89 3HD2 LEU 89 -8.810 -10.034 -5.684 665 HD22 LEU 89 1HD2 LEU 89 -9.856 -9.119 -4.540 666 HD23 LEU 89 2HD2 LEU 89 -10.271 -10.809 -4.967 667 H ALA 90 H ALA 90 -7.870 -14.750 -2.360 668 HA ALA 90 HA ALA 90 -6.044 -16.056 -4.038 669 HB1 ALA 90 1HB ALA 90 -5.776 -17.673 -2.116 670 HB2 ALA 90 2HB ALA 90 -7.243 -16.950 -1.346 671 HB3 ALA 90 3HB ALA 90 -5.758 -15.959 -1.558 672 H THR 91 H THR 91 -9.484 -16.534 -3.718 673 HA THR 91 HA THR 91 -9.215 -19.263 -4.736 674 HB THR 91 HB THR 91 -10.644 -19.112 -2.859 675 HG1 THR 91 1HG THR 91 -11.794 -19.622 -5.357 676 HG21 THR 91 3HG2 THR 91 -12.776 -17.852 -2.899 677 HG22 THR 91 1HG2 THR 91 -12.314 -17.071 -4.467 678 HG23 THR 91 2HG2 THR 91 -11.359 -16.771 -2.968 679 H ASP 92 H ASP 92 -9.137 -16.133 -6.101 680 HA ASP 92 HA ASP 92 -11.124 -16.727 -8.062 681 HB2 ASP 92 2HB ASP 92 -10.110 -14.324 -7.238 682 HB3 ASP 92 1HB ASP 92 -9.210 -14.534 -8.778 683 H PHE 93 H PHE 93 -7.722 -17.476 -7.717 684 HA PHE 93 HA PHE 93 -7.400 -18.097 -10.497 685 HB2 PHE 93 2HB PHE 93 -5.281 -18.912 -10.117 686 HB3 PHE 93 1HB PHE 93 -5.432 -17.693 -8.825 687 HD1 PHE 93 1HD PHE 93 -5.631 -18.432 -6.458 688 HD2 PHE 93 2HD PHE 93 -5.107 -21.285 -9.619 689 HE1 PHE 93 1HE PHE 93 -4.904 -20.118 -4.810 690 HE2 PHE 93 2HE PHE 93 -4.348 -22.970 -7.980 691 HZ PHE 93 HZ PHE 93 -4.228 -22.388 -5.566 692 H VAL 94 H VAL 94 -8.669 -19.761 -7.669 693 HA VAL 94 HA VAL 94 -8.300 -22.386 -8.572 694 HB VAL 94 HB VAL 94 -10.319 -21.312 -6.525 695 HG11 VAL 94 1HG1 VAL 94 -10.797 -23.686 -7.153 696 HG12 VAL 94 2HG1 VAL 94 -10.080 -23.614 -5.510 697 HG13 VAL 94 3HG1 VAL 94 -9.066 -24.123 -6.912 698 HG21 VAL 94 3HG2 VAL 94 -8.495 -21.812 -4.857 699 HG22 VAL 94 1HG2 VAL 94 -7.968 -20.542 -6.001 700 HG23 VAL 94 2HG2 VAL 94 -7.374 -22.225 -6.204 701 H ARG 95 H ARG 95 -10.629 -19.939 -9.201 702 HA ARG 95 HA ARG 95 -12.806 -21.421 -10.100 703 HB2 ARG 95 2HB ARG 95 -12.691 -19.002 -9.383 704 HB3 ARG 95 1HB ARG 95 -11.784 -18.618 -10.875 705 HG2 ARG 95 2HG ARG 95 -13.718 -19.032 -12.250 706 HG3 ARG 95 1HG ARG 95 -14.656 -19.760 -10.905 707 HD2 ARG 95 2HD ARG 95 -13.576 -16.856 -10.758 708 HD3 ARG 95 1HD ARG 95 -15.140 -17.232 -11.576 709 HE ARG 95 HE ARG 95 -15.833 -18.370 -9.372 710 HH11 ARG 95 1HH2 ARG 95 -13.495 -15.518 -9.282 711 HH12 ARG 95 2HH2 ARG 95 -14.426 -14.643 -8.191 712 HH21 ARG 95 1HH1 ARG 95 -17.062 -17.069 -7.729 713 HH22 ARG 95 2HH1 ARG 95 -16.476 -15.584 -7.201 714 H ARG 96 H ARG 96 -9.600 -20.949 -11.518 715 HA ARG 96 HA ARG 96 -10.368 -21.257 -14.197 716 HB2 ARG 96 2HB ARG 96 -8.195 -21.604 -14.865 717 HB3 ARG 96 1HB ARG 96 -8.006 -20.501 -13.473 718 HG2 ARG 96 2HG ARG 96 -7.046 -22.284 -12.106 719 HG3 ARG 96 1HG ARG 96 -7.672 -23.555 -13.196 720 HD2 ARG 96 2HD ARG 96 -6.149 -22.637 -15.061 721 HD3 ARG 96 1HD ARG 96 -5.277 -21.739 -13.737 722 HE ARG 96 HE ARG 96 -5.806 -24.535 -13.009 723 HH11 ARG 96 1HH2 ARG 96 -3.673 -22.767 -15.389 724 HH12 ARG 96 2HH2 ARG 96 -2.468 -23.977 -15.376 725 HH21 ARG 96 1HH1 ARG 96 -4.314 -26.124 -13.097 726 HH22 ARG 96 2HH1 ARG 96 -2.879 -26.049 -14.060 727 H GLU 97 H GLU 97 -10.004 -23.604 -11.538 728 HA GLU 97 HA GLU 97 -9.519 -25.780 -13.295 729 HB2 GLU 97 2HB GLU 97 -10.448 -25.744 -10.379 730 HB3 GLU 97 1HB GLU 97 -9.982 -27.225 -11.287 731 HG2 GLU 97 2HG GLU 97 -8.093 -24.829 -10.729 732 HG3 GLU 97 1HG GLU 97 -8.128 -26.388 -9.830 733 H GLU 98 H GLU 98 -12.405 -24.154 -12.145 734 HA GLU 98 HA GLU 98 -14.273 -26.184 -12.864 735 HB2 GLU 98 2HB GLU 98 -14.539 -23.127 -12.669 736 HB3 GLU 98 1HB GLU 98 -15.922 -24.195 -13.028 737 HG2 GLU 98 2HG GLU 98 -14.249 -24.589 -10.464 738 HG3 GLU 98 1HG GLU 98 -15.514 -23.318 -10.571 739 H GLU 99 H GLU 99 -12.972 -23.248 -14.496 740 HA GLU 99 HA GLU 99 -14.320 -23.528 -16.924 741 HB2 GLU 99 2HB GLU 99 -11.655 -22.209 -16.138 742 HB3 GLU 99 1HB GLU 99 -12.298 -22.084 -17.793 743 HG2 GLU 99 2HG GLU 99 -14.093 -21.239 -15.443 744 HG3 GLU 99 1HG GLU 99 -12.752 -20.164 -15.973 745 H ARG 100 H ARG 100 -11.102 -24.605 -15.863 746 HA ARG 100 HA ARG 100 -10.042 -25.557 -18.182 747 HB2 ARG 100 2HB ARG 100 -8.898 -25.240 -15.934 748 HB3 ARG 100 1HB ARG 100 -9.759 -26.688 -15.323 749 HG2 ARG 100 2HG ARG 100 -8.430 -28.074 -17.016 750 HG3 ARG 100 1HG ARG 100 -7.542 -26.565 -17.452 751 HD2 ARG 100 2HD ARG 100 -6.878 -26.311 -14.977 752 HD3 ARG 100 1HD ARG 100 -7.740 -27.867 -14.641 753 HE ARG 100 HE ARG 100 -5.664 -28.106 -16.727 754 HH11 ARG 100 1HH2 ARG 100 -6.321 -28.148 -13.109 755 HH12 ARG 100 2HH2 ARG 100 -4.903 -29.059 -12.803 756 HH21 ARG 100 1HH1 ARG 100 -3.449 -29.075 -16.003 757 HH22 ARG 100 2HH1 ARG 100 -3.384 -29.598 -14.382 758 H ARG 101 H ARG 101 -12.106 -27.307 -15.793 759 HA ARG 101 HA ARG 101 -12.023 -29.696 -17.457 760 HB2 ARG 101 2HB ARG 101 -13.694 -29.068 -14.958 761 HB3 ARG 101 1HB ARG 101 -13.570 -30.675 -15.755 762 HG2 ARG 101 2HG ARG 101 -11.237 -29.133 -14.444 763 HG3 ARG 101 1HG ARG 101 -12.209 -30.422 -13.658 764 HD2 ARG 101 2HD ARG 101 -11.407 -32.103 -15.329 765 HD3 ARG 101 1HD ARG 101 -10.401 -30.832 -16.158 766 HE ARG 101 HE ARG 101 -9.562 -30.558 -13.571 767 HH11 ARG 101 1HH2 ARG 101 -9.884 -33.604 -15.557 768 HH12 ARG 101 2HH2 ARG 101 -8.784 -34.470 -14.604 769 HH21 ARG 101 1HH1 ARG 101 -8.107 -31.714 -12.323 770 HH22 ARG 101 2HH1 ARG 101 -7.820 -33.388 -12.537 771 H GLY 102 H GLY 102 -14.086 -26.859 -16.948 772 HA2 GLY 102 2HA GLY 102 -15.826 -26.148 -18.118 773 HA3 GLY 102 1HA GLY 102 -15.698 -27.602 -19.194 774 H HIS 103 H HIS 103 -15.922 -27.412 -15.703 775 HA HIS 103 HA HIS 103 -17.094 -28.568 -14.243 776 HB2 HIS 103 2HB HIS 103 -18.488 -26.460 -14.863 777 HB3 HIS 103 1HB HIS 103 -19.603 -27.592 -15.683 778 HD1 HIS 103 1HD HIS 103 -18.324 -26.553 -12.191 779 HD2 HIS 103 2HD HIS 103 -20.910 -29.474 -13.847 780 HE1 HIS 103 1HE HIS 103 -19.592 -27.556 -10.330 781 HE2 HIS 103 2HE HIS 103 -20.978 -29.445 -11.272 782 H1 SER 1 H SER 1 -4.309 -12.402 -20.841 783 HA SER 1 HA SER 1 -4.417 -13.225 -23.115 784 HB2 SER 1 2HB SER 1 -2.228 -12.251 -22.116 785 HB3 SER 1 1HB SER 1 -1.685 -13.930 -21.812 786 HG SER 1 1HG SER 1 -0.921 -12.963 -23.723 787 H ALA 2 H ALA 2 -2.882 -15.557 -20.804 788 HA ALA 2 HA ALA 2 -3.505 -17.774 -22.554 789 HB1 ALA 2 1HB ALA 2 -1.398 -17.893 -21.213 790 HB2 ALA 2 2HB ALA 2 -2.538 -19.192 -20.718 791 HB3 ALA 2 3HB ALA 2 -2.342 -17.729 -19.691 792 H ASP 3 H ASP 3 -4.354 -16.702 -19.197 793 HA ASP 3 HA ASP 3 -7.036 -17.818 -19.556 794 HB2 ASP 3 2HB ASP 3 -5.423 -19.686 -18.903 795 HB3 ASP 3 1HB ASP 3 -4.934 -18.747 -17.470 796 H HIS 4 H HIS 4 -5.376 -17.269 -16.503 797 HA HIS 4 HA HIS 4 -7.368 -15.323 -15.797 798 HB2 HIS 4 2HB HIS 4 -5.717 -15.149 -13.612 799 HB3 HIS 4 1HB HIS 4 -6.975 -16.384 -13.835 800 HD1 HIS 4 1HD HIS 4 -3.162 -16.193 -14.789 801 HD2 HIS 4 2HD HIS 4 -6.267 -18.945 -14.065 802 HE1 HIS 4 1HE HIS 4 -2.186 -18.383 -14.971 803 HE2 HIS 4 2HE HIS 4 -4.072 -20.039 -14.799 804 H GLU 5 H GLU 5 -4.234 -15.173 -17.253 805 HA GLU 5 HA GLU 5 -3.441 -12.654 -16.355 806 HB2 GLU 5 2HB GLU 5 -2.907 -14.132 -19.007 807 HB3 GLU 5 1HB GLU 5 -2.024 -12.675 -18.431 808 HG2 GLU 5 2HG GLU 5 -0.608 -14.559 -17.989 809 HG3 GLU 5 1HG GLU 5 -1.237 -13.982 -16.413 810 H ARG 6 H ARG 6 -6.021 -13.619 -18.459 811 HA ARG 6 HA ARG 6 -6.099 -11.289 -20.100 812 HB2 ARG 6 2HB ARG 6 -6.992 -13.623 -20.674 813 HB3 ARG 6 1HB ARG 6 -8.282 -13.388 -19.461 814 HG2 ARG 6 2HG ARG 6 -9.257 -11.570 -20.765 815 HG3 ARG 6 1HG ARG 6 -7.867 -11.562 -21.919 816 HD2 ARG 6 2HD ARG 6 -8.459 -13.833 -22.759 817 HD3 ARG 6 1HD ARG 6 -9.709 -14.010 -21.470 818 HE ARG 6 HE ARG 6 -11.142 -12.516 -22.515 819 HH11 ARG 6 1HH2 ARG 6 -8.168 -13.048 -24.655 820 HH12 ARG 6 2HH2 ARG 6 -8.948 -12.362 -25.993 821 HH21 ARG 6 1HH1 ARG 6 -12.049 -11.573 -24.461 822 HH22 ARG 6 2HH1 ARG 6 -11.128 -11.496 -25.904 823 H GLU 7 H GLU 7 -7.896 -12.530 -17.257 824 HA GLU 7 HA GLU 7 -9.551 -10.311 -16.935 825 HB2 GLU 7 2HB GLU 7 -8.894 -12.804 -15.462 826 HB3 GLU 7 1HB GLU 7 -9.188 -11.440 -14.339 827 HG2 GLU 7 2HG GLU 7 -11.254 -12.737 -14.773 828 HG3 GLU 7 1HG GLU 7 -11.398 -11.014 -15.263 829 H ALA 8 H ALA 8 -6.326 -11.097 -15.674 830 HA ALA 8 HA ALA 8 -6.011 -8.939 -13.964 831 HB1 ALA 8 1HB ALA 8 -3.527 -9.249 -14.334 832 HB2 ALA 8 2HB ALA 8 -3.874 -10.278 -15.762 833 HB3 ALA 8 3HB ALA 8 -4.351 -10.835 -14.114 834 H GLN 9 H GLN 9 -5.422 -9.163 -17.499 835 HA GLN 9 HA GLN 9 -4.251 -6.628 -17.657 836 HB2 GLN 9 2HB GLN 9 -4.144 -8.627 -19.357 837 HB3 GLN 9 1HB GLN 9 -5.714 -8.037 -19.978 838 HG2 GLN 9 2HG GLN 9 -3.808 -7.203 -21.370 839 HG3 GLN 9 1HG GLN 9 -4.588 -5.804 -20.537 840 HE21 GLN 9 1HE2 GLN 9 -2.976 -4.407 -19.677 841 HE22 GLN 9 2HE2 GLN 9 -1.809 -4.987 -18.537 842 H LYS 10 H LYS 10 -7.619 -7.725 -17.842 843 HA LYS 10 HA LYS 10 -8.559 -5.224 -18.863 844 HB2 LYS 10 2HB LYS 10 -9.773 -7.829 -18.235 845 HB3 LYS 10 1HB LYS 10 -10.767 -6.502 -17.575 846 HG2 LYS 10 2HG LYS 10 -11.583 -6.903 -19.780 847 HG3 LYS 10 1HG LYS 10 -10.720 -5.335 -19.789 848 HD2 LYS 10 2HD LYS 10 -8.663 -6.677 -20.761 849 HD3 LYS 10 1HD LYS 10 -9.801 -8.053 -20.904 850 HE2 LYS 10 2HE LYS 10 -9.762 -7.000 -23.082 851 HE3 LYS 10 1HE LYS 10 -11.331 -6.511 -22.336 852 HZ1 LYS 10 3HZ LYS 10 -10.283 -4.689 -23.407 853 HZ2 LYS 10 1HZ LYS 10 -8.851 -4.858 -22.538 854 HZ3 LYS 10 2HZ LYS 10 -10.246 -4.346 -21.735 855 H ALA 11 H ALA 11 -7.685 -6.371 -15.702 856 HA ALA 11 HA ALA 11 -9.253 -4.565 -14.207 857 HB1 ALA 11 1HB ALA 11 -7.844 -5.192 -12.322 858 HB2 ALA 11 2HB ALA 11 -6.522 -5.753 -13.408 859 HB3 ALA 11 3HB ALA 11 -8.074 -6.660 -13.312 860 H GLU 12 H GLU 12 -5.891 -4.438 -15.510 861 HA GLU 12 HA GLU 12 -5.247 -1.917 -14.535 862 HB2 GLU 12 2HB GLU 12 -4.296 -3.171 -17.190 863 HB3 GLU 12 1HB GLU 12 -3.469 -1.884 -16.244 864 HG2 GLU 12 2HG GLU 12 -3.187 -3.560 -14.332 865 HG3 GLU 12 1HG GLU 12 -3.881 -4.842 -15.395 866 H GLU 13 H GLU 13 -6.882 -2.921 -17.492 867 HA GLU 13 HA GLU 13 -6.950 -0.380 -18.735 868 HB2 GLU 13 2HB GLU 13 -7.001 -2.652 -19.812 869 HB3 GLU 13 1HB GLU 13 -8.619 -2.939 -19.133 870 HG2 GLU 13 2HG GLU 13 -8.359 -0.429 -20.836 871 HG3 GLU 13 1HG GLU 13 -7.943 -1.952 -21.692 872 H GLU 14 H GLU 14 -8.919 -1.941 -16.254 873 HA GLU 14 HA GLU 14 -11.230 -0.317 -16.652 874 HB2 GLU 14 2HB GLU 14 -11.182 -2.646 -15.541 875 HB3 GLU 14 1HB GLU 14 -10.592 -1.817 -14.066 876 HG2 GLU 14 2HG GLU 14 -12.695 -0.451 -14.001 877 HG3 GLU 14 1HG GLU 14 -13.204 -1.122 -15.593 878 H LEU 15 H LEU 15 -8.340 -0.305 -14.577 879 HA LEU 15 HA LEU 15 -8.974 1.771 -12.929 880 HB2 LEU 15 2HB LEU 15 -6.984 0.325 -12.673 881 HB3 LEU 15 1HB LEU 15 -6.201 1.089 -14.086 882 HG LEU 15 HG LEU 15 -6.016 3.239 -12.895 883 HD11 LEU 15 1HD1 LEU 15 -7.556 1.846 -10.620 884 HD12 LEU 15 2HD1 LEU 15 -8.046 3.321 -11.529 885 HD13 LEU 15 3HD1 LEU 15 -6.645 3.385 -10.415 886 HD21 LEU 15 3HD2 LEU 15 -5.051 0.907 -11.112 887 HD22 LEU 15 1HD2 LEU 15 -4.382 2.574 -11.150 888 HD23 LEU 15 2HD2 LEU 15 -4.222 1.514 -12.593 889 H GLN 16 H GLN 16 -7.381 1.947 -16.133 890 HA GLN 16 HA GLN 16 -6.892 4.653 -16.220 891 HB2 GLN 16 2HB GLN 16 -7.728 2.843 -18.571 892 HB3 GLN 16 1HB GLN 16 -7.059 4.502 -18.727 893 HG2 GLN 16 2HG GLN 16 -4.954 3.752 -17.543 894 HG3 GLN 16 1HG GLN 16 -5.576 2.054 -17.572 895 HE21 GLN 16 1HE2 GLN 16 -3.214 2.355 -18.850 896 HE22 GLN 16 2HE2 GLN 16 -3.452 2.251 -20.575 897 H LYS 17 H LYS 17 -9.986 2.965 -16.792 898 HA LYS 17 HA LYS 17 -11.198 5.271 -17.989 899 HB2 LYS 17 2HB LYS 17 -12.446 2.679 -16.928 900 HB3 LYS 17 1HB LYS 17 -13.340 3.987 -17.783 901 HG2 LYS 17 2HG LYS 17 -11.839 3.766 -19.756 902 HG3 LYS 17 1HG LYS 17 -10.989 2.385 -19.006 903 HD2 LYS 17 2HD LYS 17 -14.022 2.501 -19.642 904 HD3 LYS 17 1HD LYS 17 -12.797 1.848 -20.767 905 HE2 LYS 17 2HE LYS 17 -13.431 0.693 -17.958 906 HE3 LYS 17 1HE LYS 17 -13.981 0.017 -19.543 907 HZ1 LYS 17 3HZ LYS 17 -11.659 -0.365 -20.150 908 HZ2 LYS 17 1HZ LYS 17 -12.013 -1.127 -18.709 909 HZ3 LYS 17 2HZ LYS 17 -11.116 0.311 -18.714 910 H VAL 18 H VAL 18 -10.899 3.952 -14.686 911 HA VAL 18 HA VAL 18 -12.896 5.661 -13.612 912 HB VAL 18 HB VAL 18 -10.530 4.388 -12.150 913 HG11 VAL 18 1HG1 VAL 18 -11.596 6.232 -10.838 914 HG12 VAL 18 2HG1 VAL 18 -12.099 4.656 -10.152 915 HG13 VAL 18 3HG1 VAL 18 -13.237 5.578 -11.194 916 HG21 VAL 18 3HG2 VAL 18 -11.865 2.636 -13.312 917 HG22 VAL 18 1HG2 VAL 18 -13.404 3.376 -12.737 918 HG23 VAL 18 2HG2 VAL 18 -12.268 2.613 -11.569 919 H LEU 19 H LEU 19 -9.371 5.977 -14.258 920 HA LEU 19 HA LEU 19 -9.037 8.378 -12.869 921 HB2 LEU 19 2HB LEU 19 -7.585 7.793 -15.514 922 HB3 LEU 19 1HB LEU 19 -7.041 8.824 -14.156 923 HG LEU 19 HG LEU 19 -7.226 5.772 -14.288 924 HD11 LEU 19 1HD1 LEU 19 -4.821 7.655 -13.927 925 HD12 LEU 19 2HD1 LEU 19 -5.280 6.784 -15.438 926 HD13 LEU 19 3HD1 LEU 19 -4.764 5.854 -13.981 927 HD21 LEU 19 3HD2 LEU 19 -7.908 6.419 -11.974 928 HD22 LEU 19 1HD2 LEU 19 -6.418 7.428 -11.815 929 HD23 LEU 19 2HD2 LEU 19 -6.303 5.637 -12.016 930 H GLU 20 H GLU 20 -10.222 7.717 -16.173 931 HA GLU 20 HA GLU 20 -10.215 10.426 -17.014 932 HB2 GLU 20 2HB GLU 20 -11.887 8.079 -18.097 933 HB3 GLU 20 1HB GLU 20 -11.693 9.699 -18.859 934 HG2 GLU 20 2HG GLU 20 -9.240 9.286 -19.154 935 HG3 GLU 20 1HG GLU 20 -9.442 7.636 -18.472 936 H GLU 21 H GLU 21 -12.707 8.262 -15.545 937 HA GLU 21 HA GLU 21 -14.763 10.233 -15.761 938 HB2 GLU 21 2HB GLU 21 -14.488 7.768 -13.959 939 HB3 GLU 21 1HB GLU 21 -15.966 8.788 -14.025 940 HG2 GLU 21 2HG GLU 21 -14.808 7.421 -16.540 941 HG3 GLU 21 1HG GLU 21 -15.946 6.602 -15.417 942 H ALA 22 H ALA 22 -12.481 9.212 -13.167 943 HA ALA 22 HA ALA 22 -13.604 10.880 -11.216 944 HB1 ALA 22 1HB ALA 22 -11.565 10.415 -9.877 945 HB2 ALA 22 2HB ALA 22 -10.764 9.707 -11.334 946 HB3 ALA 22 3HB ALA 22 -12.204 8.903 -10.614 947 H SER 23 H SER 23 -11.232 11.564 -13.793 948 HA SER 23 HA SER 23 -10.164 13.837 -12.435 949 HB2 SER 23 2HB SER 23 -9.401 14.510 -14.832 950 HB3 SER 23 1HB SER 23 -8.726 13.030 -14.063 951 HG SER 23 1HG SER 23 -9.847 11.764 -15.305 952 H LYS 24 H LYS 24 -12.803 13.280 -14.725 953 HA LYS 24 HA LYS 24 -13.588 15.935 -15.123 954 HB2 LYS 24 2HB LYS 24 -14.319 13.866 -16.411 955 HB3 LYS 24 1HB LYS 24 -15.311 13.359 -15.017 956 HG2 LYS 24 2HG LYS 24 -15.762 15.945 -16.652 957 HG3 LYS 24 1HG LYS 24 -16.505 14.349 -16.989 958 HD2 LYS 24 2HD LYS 24 -17.419 14.485 -14.495 959 HD3 LYS 24 1HD LYS 24 -17.010 16.224 -14.618 960 HE2 LYS 24 2HE LYS 24 -19.356 16.026 -15.196 961 HE3 LYS 24 1HE LYS 24 -18.467 16.364 -16.731 962 HZ1 LYS 24 3HZ LYS 24 -19.617 14.601 -17.459 963 HZ2 LYS 24 1HZ LYS 24 -20.003 14.057 -15.910 964 HZ3 LYS 24 2HZ LYS 24 -18.527 13.615 -16.598 965 H LYS 25 H LYS 25 -14.413 13.488 -12.645 966 HA LYS 25 HA LYS 25 -16.272 15.107 -11.279 967 HB2 LYS 25 2HB LYS 25 -14.587 12.786 -10.182 968 HB3 LYS 25 1HB LYS 25 -15.966 13.556 -9.330 969 HG2 LYS 25 2HG LYS 25 -17.537 12.836 -11.113 970 HG3 LYS 25 1HG LYS 25 -16.185 12.129 -12.051 971 HD2 LYS 25 2HD LYS 25 -15.695 10.640 -9.965 972 HD3 LYS 25 1HD LYS 25 -17.291 11.165 -9.345 973 HE2 LYS 25 2HE LYS 25 -16.687 9.606 -11.963 974 HE3 LYS 25 1HE LYS 25 -17.482 8.965 -10.471 975 HZ1 LYS 25 3HZ LYS 25 -19.281 10.649 -10.895 976 HZ2 LYS 25 1HZ LYS 25 -19.151 9.453 -12.096 977 HZ3 LYS 25 2HZ LYS 25 -18.547 10.985 -12.391 978 H ALA 26 H ALA 26 -12.738 14.550 -10.743 979 HA ALA 26 HA ALA 26 -12.484 15.918 -8.396 980 HB1 ALA 26 1HB ALA 26 -10.649 14.543 -9.412 981 HB2 ALA 26 2HB ALA 26 -10.068 16.186 -8.967 982 HB3 ALA 26 3HB ALA 26 -10.426 15.794 -10.690 983 H VAL 27 H VAL 27 -12.177 17.318 -11.736 984 HA VAL 27 HA VAL 27 -11.554 19.888 -10.745 985 HB VAL 27 HB VAL 27 -10.944 19.436 -13.000 986 HG11 VAL 27 1HG1 VAL 27 -12.710 17.749 -13.599 987 HG12 VAL 27 2HG1 VAL 27 -12.539 19.035 -14.833 988 HG13 VAL 27 3HG1 VAL 27 -13.934 19.062 -13.704 989 HG21 VAL 27 3HG2 VAL 27 -13.240 21.525 -12.946 990 HG22 VAL 27 1HG2 VAL 27 -11.966 21.388 -14.186 991 HG23 VAL 27 2HG2 VAL 27 -11.516 21.799 -12.490 992 H GLU 28 H GLU 28 -14.700 18.333 -11.608 993 HA GLU 28 HA GLU 28 -16.084 20.778 -11.202 994 HB2 GLU 28 2HB GLU 28 -17.168 17.919 -11.357 995 HB3 GLU 28 1HB GLU 28 -18.173 19.382 -11.123 996 HG2 GLU 28 2HG GLU 28 -16.716 20.204 -13.331 997 HG3 GLU 28 1HG GLU 28 -16.700 18.429 -13.608 998 H ALA 29 H ALA 29 -15.119 18.147 -9.111 999 HA ALA 29 HA ALA 29 -16.887 18.566 -7.016 1000 HB1 ALA 29 1HB ALA 29 -15.228 17.230 -5.694 1001 HB2 ALA 29 2HB ALA 29 -13.984 17.494 -6.961 1002 HB3 ALA 29 3HB ALA 29 -15.456 16.506 -7.299 1003 H GLU 30 H GLU 30 -13.598 19.852 -7.673 1004 HA GLU 30 HA GLU 30 -13.581 21.309 -5.238 1005 HB2 GLU 30 2HB GLU 30 -11.610 20.306 -6.589 1006 HB3 GLU 30 1HB GLU 30 -11.797 21.723 -7.660 1007 HG2 GLU 30 2HG GLU 30 -10.378 22.774 -6.251 1008 HG3 GLU 30 1HG GLU 30 -11.745 22.897 -5.082 1009 H ARG 31 H ARG 31 -14.862 21.917 -8.415 1010 HA ARG 31 HA ARG 31 -14.694 24.741 -8.404 1011 HB2 ARG 31 2HB ARG 31 -15.801 22.618 -10.131 1012 HB3 ARG 31 1HB ARG 31 -16.811 24.082 -10.196 1013 HG2 ARG 31 2HG ARG 31 -13.776 24.195 -10.606 1014 HG3 ARG 31 1HG ARG 31 -14.950 23.866 -11.925 1015 HD2 ARG 31 2HD ARG 31 -16.168 26.041 -11.407 1016 HD3 ARG 31 1HD ARG 31 -14.961 26.390 -10.123 1017 HE ARG 31 HE ARG 31 -13.585 27.210 -11.706 1018 HH11 ARG 31 1HH2 ARG 31 -16.139 25.331 -13.424 1019 HH12 ARG 31 2HH2 ARG 31 -15.602 25.762 -14.976 1020 HH21 ARG 31 1HH1 ARG 31 -12.698 27.571 -13.906 1021 HH22 ARG 31 2HH1 ARG 31 -13.399 26.741 -15.258 1022 H GLY 32 H GLY 32 -15.448 25.001 -6.142 1023 HA2 GLY 32 2HA GLY 32 -17.644 26.447 -5.808 1024 HA3 GLY 32 1HA GLY 32 -18.283 24.751 -5.673 1025 H ALA 33 H ALA 33 -15.335 24.059 -4.732 1026 HA ALA 33 HA ALA 33 -16.125 24.088 -2.017 1027 HB1 ALA 33 1HB ALA 33 -15.028 22.076 -3.033 1028 HB2 ALA 33 2HB ALA 33 -14.055 22.718 -1.657 1029 HB3 ALA 33 3HB ALA 33 -13.549 23.051 -3.349 1030 HA PRO 34 HA PRO 34 -13.595 27.630 -1.097 1031 HB2 PRO 34 2HB PRO 34 -13.417 27.529 1.677 1032 HB3 PRO 34 1HB PRO 34 -14.975 27.844 0.817 1033 HG2 PRO 34 2HG PRO 34 -13.949 25.191 1.952 1034 HG3 PRO 34 1HG PRO 34 -15.599 25.920 2.136 1035 HD2 PRO 34 2HD PRO 34 -14.937 23.981 0.211 1036 HD3 PRO 34 1HD PRO 34 -16.220 25.242 -0.074 1037 H GLY 35 H GLY 35 -11.328 27.998 -1.316 1038 HA2 GLY 35 2HA GLY 35 -9.165 27.783 -0.795 1039 HA3 GLY 35 1HA GLY 35 -9.556 26.488 0.396 1040 H ALA 36 H ALA 36 -10.745 26.432 -2.850 1041 HA ALA 36 HA ALA 36 -9.989 23.947 -3.589 1042 HB1 ALA 36 1HB ALA 36 -10.426 26.510 -5.284 1043 HB2 ALA 36 2HB ALA 36 -11.704 25.320 -4.813 1044 HB3 ALA 36 3HB ALA 36 -10.416 24.858 -5.980 1045 H ALA 37 H ALA 37 -8.249 22.982 -4.651 1046 HA ALA 37 HA ALA 37 -5.977 24.764 -5.354 1047 HB1 ALA 37 1HB ALA 37 -5.930 21.923 -4.150 1048 HB2 ALA 37 2HB ALA 37 -5.449 23.428 -3.295 1049 HB3 ALA 37 3HB ALA 37 -4.474 22.851 -4.693 1050 H LEU 38 H LEU 38 -8.020 21.900 -6.083 1051 HA LEU 38 HA LEU 38 -6.456 21.404 -8.518 1052 HB2 LEU 38 2HB LEU 38 -7.061 19.580 -6.854 1053 HB3 LEU 38 1HB LEU 38 -8.777 19.835 -7.252 1054 HG LEU 38 HG LEU 38 -6.643 19.076 -9.359 1055 HD11 LEU 38 1HD1 LEU 38 -8.385 17.194 -7.647 1056 HD12 LEU 38 2HD1 LEU 38 -6.601 17.393 -7.539 1057 HD13 LEU 38 3HD1 LEU 38 -7.334 16.701 -9.031 1058 HD21 LEU 38 3HD2 LEU 38 -8.708 18.006 -10.499 1059 HD22 LEU 38 1HD2 LEU 38 -8.700 19.801 -10.481 1060 HD23 LEU 38 2HD2 LEU 38 -9.724 18.895 -9.308 1061 H ILE 39 H ILE 39 -7.195 22.308 -10.469 1062 HA ILE 39 HA ILE 39 -9.992 22.561 -10.913 1063 HB ILE 39 HB ILE 39 -9.727 25.028 -11.656 1064 HG12 ILE 39 2HG1 ILE 39 -7.320 24.943 -9.704 1065 HG13 ILE 39 1HG1 ILE 39 -7.164 25.039 -11.488 1066 HG21 ILE 39 1HG2 ILE 39 -9.589 24.576 -8.623 1067 HG22 ILE 39 2HG2 ILE 39 -11.035 24.255 -9.639 1068 HG23 ILE 39 3HG2 ILE 39 -10.384 25.929 -9.503 1069 HD11 ILE 39 3HD ILE 39 -8.482 27.149 -9.652 1070 HD12 ILE 39 1HD ILE 39 -6.917 27.287 -10.525 1071 HD13 ILE 39 2HD ILE 39 -8.458 27.228 -11.456 1072 H SER 40 H SER 40 -9.391 24.260 -13.284 1073 HA SER 40 HA SER 40 -8.391 24.343 -15.220 1074 HB2 SER 40 2HB SER 40 -6.174 24.230 -13.935 1075 HB3 SER 40 1HB SER 40 -6.209 22.452 -14.115 1076 HG SER 40 1HG SER 40 -4.900 23.218 -15.575 1077 H TYR 41 H TYR 41 -7.067 21.913 -16.409 1078 HA TYR 41 HA TYR 41 -9.073 19.843 -16.170 1079 HB2 TYR 41 2HB TYR 41 -8.540 21.071 -18.961 1080 HB3 TYR 41 1HB TYR 41 -9.363 19.505 -18.650 1081 HD1 TYR 41 2HD TYR 41 -11.474 19.596 -17.077 1082 HD2 TYR 41 1HD TYR 41 -9.810 23.021 -19.074 1083 HE1 TYR 41 2HE TYR 41 -13.628 20.767 -16.853 1084 HE2 TYR 41 1HE TYR 41 -11.954 24.194 -18.866 1085 HH TYR 41 HH TYR 41 -14.859 22.642 -17.443 1086 HA PRO 42 HA PRO 42 -5.345 18.064 -18.305 1087 HB2 PRO 42 2HB PRO 42 -2.906 19.541 -18.519 1088 HB3 PRO 42 1HB PRO 42 -4.118 19.330 -19.838 1089 HG2 PRO 42 2HG PRO 42 -3.879 21.661 -17.856 1090 HG3 PRO 42 1HG PRO 42 -4.107 21.736 -19.653 1091 HD2 PRO 42 2HD PRO 42 -6.247 22.028 -18.004 1092 HD3 PRO 42 1HD PRO 42 -6.405 20.951 -19.462 1093 H ASP 43 H ASP 43 -4.668 20.456 -15.732 1094 HA ASP 43 HA ASP 43 -2.772 19.005 -14.328 1095 HB2 ASP 43 2HB ASP 43 -5.003 20.839 -13.184 1096 HB3 ASP 43 1HB ASP 43 -3.563 20.260 -12.283 1097 H ALA 44 H ALA 44 -6.322 18.949 -14.274 1098 HA ALA 44 HA ALA 44 -6.645 17.507 -11.911 1099 HB1 ALA 44 1HB ALA 44 -8.493 18.857 -12.970 1100 HB2 ALA 44 2HB ALA 44 -9.009 17.155 -12.701 1101 HB3 ALA 44 3HB ALA 44 -8.540 17.702 -14.351 1102 H ILE 45 H ILE 45 -6.392 16.473 -15.335 1103 HA ILE 45 HA ILE 45 -6.983 13.759 -14.644 1104 HB ILE 45 HB ILE 45 -7.720 14.628 -16.763 1105 HG12 ILE 45 2HG1 ILE 45 -5.649 12.386 -17.168 1106 HG13 ILE 45 1HG1 ILE 45 -7.256 12.179 -16.400 1107 HG21 ILE 45 1HG2 ILE 45 -5.893 16.229 -17.221 1108 HG22 ILE 45 2HG2 ILE 45 -6.104 15.118 -18.607 1109 HG23 ILE 45 3HG2 ILE 45 -4.721 14.884 -17.477 1110 HD11 ILE 45 3HD ILE 45 -6.761 13.110 -19.312 1111 HD12 ILE 45 1HD ILE 45 -7.365 11.502 -18.775 1112 HD13 ILE 45 2HD ILE 45 -8.376 12.972 -18.515 1113 H TRP 46 H TRP 46 -4.029 15.661 -14.823 1114 HA TRP 46 HA TRP 46 -2.412 13.283 -14.802 1115 HB2 TRP 46 2HB TRP 46 -1.902 16.215 -14.829 1116 HB3 TRP 46 1HB TRP 46 -0.798 15.342 -13.727 1117 HD1 TRP 46 HD TRP 46 0.378 12.984 -14.978 1118 HE1 TRP 46 1HE TRP 46 1.794 13.229 -17.131 1119 HE3 TRP 46 3HE TRP 46 -1.545 17.261 -16.965 1120 HZ2 TRP 46 2HZ TRP 46 1.534 14.419 -19.680 1121 HZ3 TRP 46 3HZ TRP 46 -0.936 17.914 -19.268 1122 HH2 TRP 46 HH TRP 46 0.588 16.509 -20.615 1123 H TRP 47 H TRP 47 -3.907 15.393 -12.359 1124 HA TRP 47 HA TRP 47 -2.506 14.359 -10.166 1125 HB2 TRP 47 2HB TRP 47 -3.833 16.508 -10.176 1126 HB3 TRP 47 1HB TRP 47 -5.347 15.541 -10.218 1127 HD1 TRP 47 HD TRP 47 -2.410 16.477 -7.788 1128 HE1 TRP 47 1HE TRP 47 -3.231 16.035 -5.359 1129 HE3 TRP 47 3HE TRP 47 -6.819 14.145 -8.859 1130 HZ2 TRP 47 2HZ TRP 47 -5.464 14.868 -4.100 1131 HZ3 TRP 47 3HZ TRP 47 -8.276 13.399 -6.999 1132 HH2 TRP 47 HH TRP 47 -7.605 13.762 -4.650 1133 H SER 48 H SER 48 -5.457 13.142 -11.885 1134 HA SER 48 HA SER 48 -6.143 11.444 -9.734 1135 HB2 SER 48 2HB SER 48 -7.590 10.197 -11.406 1136 HB3 SER 48 1HB SER 48 -7.946 11.945 -11.167 1137 HG SER 48 1HG SER 48 -7.842 11.130 -13.390 1138 H VAL 49 H VAL 49 -3.666 11.204 -12.167 1139 HA VAL 49 HA VAL 49 -3.427 8.405 -12.239 1140 HB VAL 49 HB VAL 49 -1.202 10.487 -12.582 1141 HG11 VAL 49 1HG1 VAL 49 -0.342 8.141 -12.320 1142 HG12 VAL 49 2HG1 VAL 49 -0.142 8.692 -14.009 1143 HG13 VAL 49 3HG1 VAL 49 -1.480 7.562 -13.588 1144 HG21 VAL 49 3HG2 VAL 49 -3.214 9.315 -14.631 1145 HG22 VAL 49 1HG2 VAL 49 -1.780 10.348 -15.031 1146 HG23 VAL 49 2HG2 VAL 49 -3.124 11.020 -14.070 1147 H GLU 50 H GLU 50 -1.899 10.927 -10.162 1148 HA GLU 50 HA GLU 50 -0.236 9.145 -8.755 1149 HB2 GLU 50 2HB GLU 50 -1.383 11.931 -8.076 1150 HB3 GLU 50 1HB GLU 50 -0.047 11.161 -7.162 1151 HG2 GLU 50 2HG GLU 50 1.479 11.298 -9.030 1152 HG3 GLU 50 1HG GLU 50 0.157 11.648 -10.208 1153 H THR 51 H THR 51 -3.587 10.085 -8.437 1154 HA THR 51 HA THR 51 -3.837 9.369 -5.693 1155 HB THR 51 HB THR 51 -6.011 9.714 -7.821 1156 HG1 THR 51 1HG THR 51 -4.686 11.596 -7.632 1157 HG21 THR 51 3HG2 THR 51 -6.026 9.985 -4.725 1158 HG22 THR 51 1HG2 THR 51 -6.797 8.650 -5.647 1159 HG23 THR 51 2HG2 THR 51 -7.416 10.328 -5.816 1160 H ALA 52 H ALA 52 -4.116 7.650 -8.786 1161 HA ALA 52 HA ALA 52 -5.542 5.412 -7.828 1162 HB1 ALA 52 1HB ALA 52 -3.513 5.611 -10.157 1163 HB2 ALA 52 2HB ALA 52 -5.263 6.001 -10.265 1164 HB3 ALA 52 3HB ALA 52 -4.741 4.309 -9.919 1165 H THR 53 H THR 53 -2.083 6.328 -7.814 1166 HA THR 53 HA THR 53 -1.338 3.652 -6.991 1167 HB THR 53 HB THR 53 0.986 4.733 -7.092 1168 HG1 THR 53 1HG THR 53 0.352 6.894 -6.997 1169 HG21 THR 53 3HG2 THR 53 0.942 4.654 -9.614 1170 HG22 THR 53 1HG2 THR 53 -0.853 4.763 -9.604 1171 HG23 THR 53 2HG2 THR 53 -0.035 3.312 -8.913 1172 H THR 54 H THR 54 -2.916 5.883 -5.357 1173 HA THR 54 HA THR 54 -3.060 6.629 -3.325 1174 HB THR 54 HB THR 54 -2.557 4.875 -1.488 1175 HG1 THR 54 1HG THR 54 -1.012 3.727 -2.758 1176 HG21 THR 54 3HG2 THR 54 -4.475 3.479 -2.319 1177 HG22 THR 54 1HG2 THR 54 -4.328 4.226 -3.953 1178 HG23 THR 54 2HG2 THR 54 -4.778 5.237 -2.522 1179 H VAL 55 H VAL 55 -0.586 7.504 -4.602 1180 HA VAL 55 HA VAL 55 1.375 7.265 -2.477 1181 HB VAL 55 HB VAL 55 1.991 6.797 -4.811 1182 HG11 VAL 55 1HG1 VAL 55 0.657 8.546 -6.013 1183 HG12 VAL 55 2HG1 VAL 55 2.398 8.653 -6.414 1184 HG13 VAL 55 3HG1 VAL 55 1.672 9.842 -5.285 1185 HG21 VAL 55 3HG2 VAL 55 3.663 7.394 -3.094 1186 HG22 VAL 55 1HG2 VAL 55 3.490 9.142 -3.497 1187 HG23 VAL 55 2HG2 VAL 55 4.165 8.001 -4.717 1188 H GLY 56 H GLY 56 -0.618 9.774 -4.098 1189 HA2 GLY 56 2HA GLY 56 -1.389 11.683 -3.193 1190 HA3 GLY 56 1HA GLY 56 -0.456 11.355 -1.678 1191 H TYR 57 H TYR 57 2.003 11.276 -2.206 1192 HA TYR 57 HA TYR 57 3.859 12.359 -2.481 1193 HB2 TYR 57 2HB TYR 57 2.601 13.353 -5.122 1194 HB3 TYR 57 1HB TYR 57 4.157 14.044 -4.536 1195 HD1 TYR 57 2HD TYR 57 5.902 12.157 -3.666 1196 HD2 TYR 57 1HD TYR 57 2.941 11.745 -6.759 1197 HE1 TYR 57 2HE TYR 57 7.300 10.446 -4.763 1198 HE2 TYR 57 1HE TYR 57 4.343 10.052 -7.872 1199 HH TYR 57 HH TYR 57 7.538 9.036 -6.583 1200 H GLY 58 H GLY 58 1.858 14.883 -3.904 1201 HA2 GLY 58 2HA GLY 58 0.972 16.339 -1.994 1202 HA3 GLY 58 1HA GLY 58 2.736 16.699 -1.783 1203 H ASP 59 H ASP 59 0.890 16.137 -4.859 1204 HA ASP 59 HA ASP 59 1.949 18.588 -5.940 1205 HB2 ASP 59 2HB ASP 59 1.408 16.761 -7.546 1206 HB3 ASP 59 1HB ASP 59 -0.293 16.742 -6.992 1207 H ARG 60 H ARG 60 -1.399 17.375 -5.087 1208 HA ARG 60 HA ARG 60 -2.047 20.053 -4.183 1209 HB2 ARG 60 2HB ARG 60 -3.708 18.523 -6.282 1210 HB3 ARG 60 1HB ARG 60 -4.272 19.993 -5.420 1211 HG2 ARG 60 2HG ARG 60 -2.589 21.387 -6.522 1212 HG3 ARG 60 1HG ARG 60 -1.750 19.944 -7.160 1213 HD2 ARG 60 2HD ARG 60 -3.857 19.362 -8.500 1214 HD3 ARG 60 1HD ARG 60 -4.502 20.996 -8.067 1215 HE ARG 60 HE ARG 60 -2.126 20.303 -9.752 1216 HH11 ARG 60 1HH2 ARG 60 -3.868 23.032 -8.087 1217 HH12 ARG 60 2HH2 ARG 60 -2.814 24.206 -8.716 1218 HH21 ARG 60 1HH1 ARG 60 -1.671 22.191 -11.428 1219 HH22 ARG 60 2HH1 ARG 60 -1.456 23.675 -10.642 1220 H TYR 61 H TYR 61 -4.447 19.829 -3.232 1221 HA TYR 61 HA TYR 61 -4.729 17.285 -1.920 1222 HB2 TYR 61 2HB TYR 61 -5.251 18.467 0.237 1223 HB3 TYR 61 1HB TYR 61 -3.544 18.777 -0.238 1224 HD1 TYR 61 1HD TYR 61 -6.907 20.236 0.179 1225 HD2 TYR 61 2HD TYR 61 -2.868 21.076 -1.021 1226 HE1 TYR 61 1HE TYR 61 -7.441 22.626 0.113 1227 HE2 TYR 61 2HE TYR 61 -3.380 23.492 -1.031 1228 HH TYR 61 HH TYR 61 -6.694 24.658 -0.900 1229 HA PRO 62 HA PRO 62 -8.744 19.113 -3.163 1230 HB2 PRO 62 2HB PRO 62 -10.394 16.962 -2.785 1231 HB3 PRO 62 1HB PRO 62 -9.035 16.860 -3.953 1232 HG2 PRO 62 2HG PRO 62 -9.127 15.839 -1.064 1233 HG3 PRO 62 1HG PRO 62 -8.599 14.931 -2.542 1234 HD2 PRO 62 2HD PRO 62 -6.878 16.378 -0.777 1235 HD3 PRO 62 1HD PRO 62 -6.478 16.004 -2.519 1236 H VAL 63 H VAL 63 -10.711 19.977 -2.013 1237 HA VAL 63 HA VAL 63 -9.982 20.590 0.679 1238 HB VAL 63 HB VAL 63 -12.502 21.485 -0.746 1239 HG11 VAL 63 1HG1 VAL 63 -12.296 21.826 1.906 1240 HG12 VAL 63 2HG1 VAL 63 -12.539 23.280 0.905 1241 HG13 VAL 63 3HG1 VAL 63 -10.896 22.875 1.510 1242 HG21 VAL 63 3HG2 VAL 63 -11.146 23.516 -1.304 1243 HG22 VAL 63 1HG2 VAL 63 -10.470 22.056 -2.084 1244 HG23 VAL 63 2HG2 VAL 63 -9.676 22.729 -0.628 1245 H THR 64 H THR 64 -13.480 20.109 0.192 1246 HA THR 64 HA THR 64 -13.597 17.924 1.999 1247 HB THR 64 HB THR 64 -14.506 20.670 3.061 1248 HG1 THR 64 1HG THR 64 -12.145 19.390 3.173 1249 HG21 THR 64 3HG2 THR 64 -15.944 18.767 3.885 1250 HG22 THR 64 1HG2 THR 64 -14.926 19.423 5.213 1251 HG23 THR 64 2HG2 THR 64 -14.473 17.880 4.417 1252 H GLU 65 H GLU 65 -15.129 20.711 0.318 1253 HA GLU 65 HA GLU 65 -17.642 19.246 0.275 1254 HB2 GLU 65 2HB GLU 65 -17.380 21.737 0.888 1255 HB3 GLU 65 1HB GLU 65 -17.172 22.039 -0.872 1256 HG2 GLU 65 2HG GLU 65 -19.434 21.192 -1.328 1257 HG3 GLU 65 1HG GLU 65 -19.584 20.508 0.330 1258 H GLU 66 H GLU 66 -14.917 18.686 -1.267 1259 HA GLU 66 HA GLU 66 -15.838 18.691 -3.999 1260 HB2 GLU 66 2HB GLU 66 -13.671 16.902 -3.848 1261 HB3 GLU 66 1HB GLU 66 -13.587 18.626 -4.299 1262 HG2 GLU 66 2HG GLU 66 -11.875 18.292 -2.793 1263 HG3 GLU 66 1HG GLU 66 -13.070 19.258 -1.920 1264 H GLY 67 H GLY 67 -15.458 16.784 -1.131 1265 HA2 GLY 67 2HA GLY 67 -16.848 15.093 -0.388 1266 HA3 GLY 67 1HA GLY 67 -17.278 14.696 -2.127 1267 H ARG 68 H ARG 68 -14.553 14.828 0.278 1268 HA ARG 68 HA ARG 68 -12.589 14.126 -1.423 1269 HB2 ARG 68 2HB ARG 68 -12.332 14.948 0.927 1270 HB3 ARG 68 1HB ARG 68 -12.677 13.293 1.533 1271 HG2 ARG 68 2HG ARG 68 -10.652 12.433 0.396 1272 HG3 ARG 68 1HG ARG 68 -10.420 13.990 -0.465 1273 HD2 ARG 68 2HD ARG 68 -10.235 13.646 2.614 1274 HD3 ARG 68 1HD ARG 68 -8.830 13.618 1.471 1275 HE ARG 68 HE ARG 68 -10.201 16.027 0.881 1276 HH11 ARG 68 1HH2 ARG 68 -8.364 14.517 3.696 1277 HH12 ARG 68 2HH2 ARG 68 -8.291 15.962 4.540 1278 HH21 ARG 68 1HH1 ARG 68 -8.983 17.966 1.629 1279 HH22 ARG 68 2HH1 ARG 68 -8.179 17.969 3.156 1280 H LYS 69 H LYS 69 -15.135 12.241 -0.436 1281 HA LYS 69 HA LYS 69 -14.517 9.600 -0.894 1282 HB2 LYS 69 2HB LYS 69 -16.872 11.408 -1.669 1283 HB3 LYS 69 1HB LYS 69 -16.915 9.657 -2.020 1284 HG2 LYS 69 2HG LYS 69 -16.295 10.552 0.831 1285 HG3 LYS 69 1HG LYS 69 -17.989 10.609 0.222 1286 HD2 LYS 69 2HD LYS 69 -18.044 8.282 -0.312 1287 HD3 LYS 69 1HD LYS 69 -16.288 8.064 -0.091 1288 HE2 LYS 69 2HE LYS 69 -18.246 8.768 2.212 1289 HE3 LYS 69 1HE LYS 69 -17.703 7.100 1.774 1290 HZ1 LYS 69 3HZ LYS 69 -15.415 7.805 2.099 1291 HZ2 LYS 69 1HZ LYS 69 -16.380 7.956 3.532 1292 HZ3 LYS 69 2HZ LYS 69 -15.930 9.326 2.640 1293 H VAL 70 H VAL 70 -14.482 12.325 -3.231 1294 HA VAL 70 HA VAL 70 -14.580 10.712 -5.545 1295 HB VAL 70 HB VAL 70 -13.550 13.547 -5.064 1296 HG11 VAL 70 1HG1 VAL 70 -12.393 12.662 -7.091 1297 HG12 VAL 70 2HG1 VAL 70 -13.695 13.792 -7.585 1298 HG13 VAL 70 3HG1 VAL 70 -13.947 12.011 -7.731 1299 HG21 VAL 70 3HG2 VAL 70 -16.144 12.435 -6.359 1300 HG22 VAL 70 1HG2 VAL 70 -15.713 14.174 -6.147 1301 HG23 VAL 70 2HG2 VAL 70 -16.039 13.152 -4.714 1302 H ALA 71 H ALA 71 -11.919 11.846 -3.413 1303 HA ALA 71 HA ALA 71 -9.861 10.855 -5.130 1304 HB1 ALA 71 1HB ALA 71 -8.355 11.201 -3.179 1305 HB2 ALA 71 2HB ALA 71 -9.773 11.440 -2.094 1306 HB3 ALA 71 3HB ALA 71 -9.408 12.637 -3.388 1307 H GLU 72 H GLU 72 -11.568 9.735 -2.210 1308 HA GLU 72 HA GLU 72 -10.395 7.331 -1.706 1309 HB2 GLU 72 2HB GLU 72 -12.278 8.467 -0.365 1310 HB3 GLU 72 1HB GLU 72 -13.420 7.874 -1.613 1311 HG2 GLU 72 2HG GLU 72 -12.638 5.462 -0.969 1312 HG3 GLU 72 1HG GLU 72 -11.824 6.235 0.444 1313 H GLN 73 H GLN 73 -12.956 8.046 -4.080 1314 HA GLN 73 HA GLN 73 -13.601 5.467 -4.827 1315 HB2 GLN 73 2HB GLN 73 -14.899 7.535 -5.433 1316 HB3 GLN 73 1HB GLN 73 -13.602 8.016 -6.569 1317 HG2 GLN 73 2HG GLN 73 -14.086 6.083 -8.035 1318 HG3 GLN 73 1HG GLN 73 -15.249 5.409 -6.835 1319 HE21 GLN 73 1HE2 GLN 73 -17.280 6.552 -6.458 1320 HE22 GLN 73 2HE2 GLN 73 -17.876 7.748 -7.561 1321 H VAL 74 H VAL 74 -10.993 7.629 -6.049 1322 HA VAL 74 HA VAL 74 -10.335 5.901 -8.206 1323 HB VAL 74 HB VAL 74 -8.350 7.867 -6.978 1324 HG11 VAL 74 1HG1 VAL 74 -8.993 6.987 -9.884 1325 HG12 VAL 74 2HG1 VAL 74 -7.617 6.384 -8.889 1326 HG13 VAL 74 3HG1 VAL 74 -7.674 8.111 -9.378 1327 HG21 VAL 74 3HG2 VAL 74 -10.331 9.207 -7.014 1328 HG22 VAL 74 1HG2 VAL 74 -10.889 8.524 -8.590 1329 HG23 VAL 74 2HG2 VAL 74 -9.451 9.617 -8.513 1330 H MET 75 H MET 75 -9.232 6.358 -4.860 1331 HA MET 75 HA MET 75 -6.920 4.794 -4.992 1332 HB2 MET 75 2HB MET 75 -8.823 5.290 -2.626 1333 HB3 MET 75 1HB MET 75 -7.162 4.623 -2.483 1334 HG2 MET 75 2HG MET 75 -6.140 6.683 -3.198 1335 HG3 MET 75 1HG MET 75 -7.661 7.339 -3.827 1336 HE1 MET 75 3HE MET 75 -7.086 9.510 -2.781 1337 HE2 MET 75 1HE MET 75 -5.604 8.837 -2.023 1338 HE3 MET 75 2HE MET 75 -6.759 9.793 -1.041 1339 H LYS 76 H LYS 76 -10.303 3.934 -4.027 1340 HA LYS 76 HA LYS 76 -9.752 1.219 -3.544 1341 HB2 LYS 76 2HB LYS 76 -12.323 2.629 -4.450 1342 HB3 LYS 76 1HB LYS 76 -12.280 0.855 -4.249 1343 HG2 LYS 76 2HG LYS 76 -11.770 2.906 -2.015 1344 HG3 LYS 76 1HG LYS 76 -13.298 2.031 -2.317 1345 HD2 LYS 76 2HD LYS 76 -10.620 0.885 -1.336 1346 HD3 LYS 76 1HD LYS 76 -12.162 0.985 -0.440 1347 HE2 LYS 76 2HE LYS 76 -11.505 -0.874 -2.826 1348 HE3 LYS 76 1HE LYS 76 -11.668 -1.362 -1.103 1349 HZ1 LYS 76 3HZ LYS 76 -13.526 -1.560 -2.956 1350 HZ2 LYS 76 1HZ LYS 76 -14.019 -0.092 -2.291 1351 HZ3 LYS 76 2HZ LYS 76 -13.915 -1.460 -1.286 1352 H ALA 77 H ALA 77 -10.613 2.942 -6.567 1353 HA ALA 77 HA ALA 77 -10.990 0.639 -8.115 1354 HB1 ALA 77 1HB ALA 77 -9.948 3.399 -9.022 1355 HB2 ALA 77 2HB ALA 77 -11.681 2.916 -8.904 1356 HB3 ALA 77 3HB ALA 77 -10.598 2.109 -10.099 1357 H GLY 78 H GLY 78 -8.060 2.444 -7.201 1358 HA2 GLY 78 2HA GLY 78 -6.308 1.023 -8.938 1359 HA3 GLY 78 1HA GLY 78 -5.901 2.047 -7.508 1360 H ILE 79 H ILE 79 -7.008 0.830 -5.403 1361 HA ILE 79 HA ILE 79 -5.217 -1.207 -4.867 1362 HB ILE 79 HB ILE 79 -7.816 -0.414 -3.483 1363 HG12 ILE 79 2HG1 ILE 79 -4.879 0.126 -2.691 1364 HG13 ILE 79 1HG1 ILE 79 -5.845 1.274 -3.653 1365 HG21 ILE 79 1HG2 ILE 79 -6.915 -1.667 -1.459 1366 HG22 ILE 79 2HG2 ILE 79 -5.578 -2.310 -2.476 1367 HG23 ILE 79 3HG2 ILE 79 -7.285 -2.773 -2.814 1368 HD11 ILE 79 3HD ILE 79 -6.513 0.345 -0.781 1369 HD12 ILE 79 1HD ILE 79 -5.874 1.944 -1.283 1370 HD13 ILE 79 2HD ILE 79 -7.532 1.448 -1.786 1371 H GLU 80 H GLU 80 -8.730 -1.461 -5.780 1372 HA GLU 80 HA GLU 80 -8.760 -4.240 -5.392 1373 HB2 GLU 80 2HB GLU 80 -10.628 -2.482 -7.064 1374 HB3 GLU 80 1HB GLU 80 -10.861 -4.252 -6.809 1375 HG2 GLU 80 2HG GLU 80 -10.938 -3.911 -4.333 1376 HG3 GLU 80 1HG GLU 80 -10.770 -2.135 -4.567 1377 H VAL 81 H VAL 81 -7.861 -2.319 -8.345 1378 HA VAL 81 HA VAL 81 -7.857 -4.724 -9.892 1379 HB VAL 81 HB VAL 81 -6.825 -3.488 -11.688 1380 HG11 VAL 81 1HG1 VAL 81 -9.191 -2.062 -10.268 1381 HG12 VAL 81 2HG1 VAL 81 -9.300 -3.479 -11.368 1382 HG13 VAL 81 3HG1 VAL 81 -8.757 -1.879 -11.995 1383 HG21 VAL 81 3HG2 VAL 81 -5.311 -1.962 -10.349 1384 HG22 VAL 81 1HG2 VAL 81 -6.763 -1.036 -9.831 1385 HG23 VAL 81 2HG2 VAL 81 -6.302 -1.125 -11.562 1386 H PHE 82 H PHE 82 -5.364 -2.865 -8.087 1387 HA PHE 82 HA PHE 82 -3.224 -4.463 -9.064 1388 HB2 PHE 82 2HB PHE 82 -3.419 -2.794 -6.470 1389 HB3 PHE 82 1HB PHE 82 -1.898 -3.527 -7.106 1390 HD1 PHE 82 2HD PHE 82 -2.101 -2.891 -10.065 1391 HD2 PHE 82 1HD PHE 82 -2.955 -0.516 -6.576 1392 HE1 PHE 82 2HE PHE 82 -1.631 -0.840 -11.339 1393 HE2 PHE 82 1HE PHE 82 -2.478 1.533 -7.857 1394 HZ PHE 82 HZ PHE 82 -1.818 1.384 -10.245 1395 H ALA 83 H ALA 83 -5.655 -4.931 -6.621 1396 HA ALA 83 HA ALA 83 -4.180 -7.036 -5.313 1397 HB1 ALA 83 1HB ALA 83 -5.737 -5.542 -4.026 1398 HB2 ALA 83 2HB ALA 83 -6.182 -7.273 -3.888 1399 HB3 ALA 83 3HB ALA 83 -7.123 -6.183 -4.983 1400 H LEU 84 H LEU 84 -6.912 -6.722 -7.621 1401 HA LEU 84 HA LEU 84 -7.880 -9.272 -7.576 1402 HB2 LEU 84 2HB LEU 84 -8.924 -7.325 -8.697 1403 HB3 LEU 84 1HB LEU 84 -7.683 -7.346 -9.984 1404 HG LEU 84 HG LEU 84 -9.423 -9.820 -9.487 1405 HD11 LEU 84 1HD1 LEU 84 -10.397 -7.309 -10.997 1406 HD12 LEU 84 2HD1 LEU 84 -11.029 -7.929 -9.423 1407 HD13 LEU 84 3HD1 LEU 84 -11.238 -8.906 -10.917 1408 HD21 LEU 84 3HD2 LEU 84 -7.684 -10.017 -11.285 1409 HD22 LEU 84 1HD2 LEU 84 -8.338 -8.548 -12.098 1410 HD23 LEU 84 2HD2 LEU 84 -9.334 -10.045 -11.986 1411 H VAL 85 H VAL 85 -5.063 -8.017 -9.336 1412 HA VAL 85 HA VAL 85 -4.725 -10.208 -11.020 1413 HB VAL 85 HB VAL 85 -2.431 -9.414 -11.399 1414 HG11 VAL 85 1HG1 VAL 85 -4.500 -7.109 -11.248 1415 HG12 VAL 85 2HG1 VAL 85 -4.496 -8.379 -12.507 1416 HG13 VAL 85 3HG1 VAL 85 -3.106 -7.240 -12.368 1417 HG21 VAL 85 3HG2 VAL 85 -3.091 -7.363 -9.176 1418 HG22 VAL 85 1HG2 VAL 85 -1.617 -7.370 -10.195 1419 HG23 VAL 85 2HG2 VAL 85 -1.891 -8.694 -9.015 1420 H THR 86 H THR 86 -4.406 -10.188 -7.625 1421 HA THR 86 HA THR 86 -2.390 -12.016 -7.193 1422 HB THR 86 HB THR 86 -5.044 -11.795 -5.706 1423 HG1 THR 86 1HG THR 86 -4.071 -9.900 -5.542 1424 HG21 THR 86 3HG2 THR 86 -2.292 -12.983 -4.884 1425 HG22 THR 86 1HG2 THR 86 -3.825 -13.912 -5.095 1426 HG23 THR 86 2HG2 THR 86 -3.681 -12.709 -3.770 1427 H ALA 87 H ALA 87 -5.510 -12.424 -8.762 1428 HA ALA 87 HA ALA 87 -5.760 -15.192 -8.607 1429 HB1 ALA 87 1HB ALA 87 -7.158 -14.987 -10.655 1430 HB2 ALA 87 2HB ALA 87 -6.455 -13.356 -10.994 1431 HB3 ALA 87 3HB ALA 87 -7.498 -13.600 -9.557 1432 H ALA 88 H ALA 88 -3.602 -13.190 -10.649 1433 HA ALA 88 HA ALA 88 -2.935 -15.483 -12.334 1434 HB1 ALA 88 1HB ALA 88 -1.342 -13.898 -13.459 1435 HB2 ALA 88 2HB ALA 88 -1.757 -12.628 -12.252 1436 HB3 ALA 88 3HB ALA 88 -3.006 -13.202 -13.418 1437 H LEU 89 H LEU 89 -1.784 -13.574 -9.620 1438 HA LEU 89 HA LEU 89 0.870 -14.538 -9.712 1439 HB2 LEU 89 2HB LEU 89 -0.725 -13.074 -7.547 1440 HB3 LEU 89 1HB LEU 89 1.033 -13.299 -7.496 1441 HG LEU 89 HG LEU 89 -0.363 -11.809 -9.791 1442 HD11 LEU 89 1HD1 LEU 89 -0.790 -10.601 -7.671 1443 HD12 LEU 89 2HD1 LEU 89 0.446 -9.725 -8.641 1444 HD13 LEU 89 3HD1 LEU 89 0.949 -10.729 -7.228 1445 HD21 LEU 89 3HD2 LEU 89 1.888 -12.697 -10.408 1446 HD22 LEU 89 1HD2 LEU 89 2.592 -11.973 -8.913 1447 HD23 LEU 89 2HD2 LEU 89 1.943 -10.912 -10.212 1448 H ALA 90 H ALA 90 -2.061 -15.585 -7.988 1449 HA ALA 90 HA ALA 90 -0.700 -17.280 -6.180 1450 HB1 ALA 90 1HB ALA 90 -3.050 -16.538 -5.780 1451 HB2 ALA 90 2HB ALA 90 -2.940 -18.337 -5.825 1452 HB3 ALA 90 3HB ALA 90 -3.574 -17.425 -7.255 1453 H THR 91 H THR 91 -1.659 -17.636 -9.615 1454 HA THR 91 HA THR 91 -1.100 -20.440 -9.558 1455 HB THR 91 HB THR 91 -0.819 -19.807 -12.217 1456 HG1 THR 91 1HG THR 91 -1.310 -17.561 -11.722 1457 HG21 THR 91 3HG2 THR 91 -3.422 -20.162 -10.592 1458 HG22 THR 91 1HG2 THR 91 -2.335 -21.498 -11.125 1459 HG23 THR 91 2HG2 THR 91 -3.212 -20.512 -12.346 1460 H ASP 92 H ASP 92 1.005 -17.707 -9.251 1461 HA ASP 92 HA ASP 92 2.822 -18.611 -11.182 1462 HB2 ASP 92 2HB ASP 92 2.647 -16.182 -10.047 1463 HB3 ASP 92 1HB ASP 92 3.911 -16.861 -8.953 1464 H PHE 93 H PHE 93 2.517 -19.281 -7.698 1465 HA PHE 93 HA PHE 93 4.991 -20.726 -7.651 1466 HB2 PHE 93 2HB PHE 93 4.354 -21.559 -5.448 1467 HB3 PHE 93 1HB PHE 93 4.084 -19.798 -5.538 1468 HD1 PHE 93 2HD PHE 93 2.386 -23.134 -5.489 1469 HD2 PHE 93 1HD PHE 93 1.901 -18.877 -5.215 1470 HE1 PHE 93 2HE PHE 93 0.053 -23.453 -4.743 1471 HE2 PHE 93 1HE PHE 93 -0.415 -19.208 -4.389 1472 HZ PHE 93 HZ PHE 93 -1.348 -21.486 -4.178 1473 H VAL 94 H VAL 94 1.795 -21.470 -8.810 1474 HA VAL 94 HA VAL 94 1.826 -24.255 -8.257 1475 HB VAL 94 HB VAL 94 0.201 -22.733 -10.334 1476 HG11 VAL 94 1HG1 VAL 94 -1.355 -24.712 -10.135 1477 HG12 VAL 94 2HG1 VAL 94 -0.164 -25.547 -9.076 1478 HG13 VAL 94 3HG1 VAL 94 0.243 -25.197 -10.794 1479 HG21 VAL 94 3HG2 VAL 94 -1.572 -22.750 -8.551 1480 HG22 VAL 94 1HG2 VAL 94 -0.126 -21.868 -7.968 1481 HG23 VAL 94 2HG2 VAL 94 -0.434 -23.545 -7.407 1482 H ARG 95 H ARG 95 2.991 -22.115 -10.790 1483 HA ARG 95 HA ARG 95 3.487 -23.933 -12.819 1484 HB2 ARG 95 2HB ARG 95 4.929 -21.319 -12.083 1485 HB3 ARG 95 1HB ARG 95 5.180 -22.198 -13.618 1486 HG2 ARG 95 2HG ARG 95 2.883 -21.890 -14.307 1487 HG3 ARG 95 1HG ARG 95 2.416 -21.146 -12.738 1488 HD2 ARG 95 2HD ARG 95 3.719 -19.120 -13.168 1489 HD3 ARG 95 1HD ARG 95 4.546 -19.885 -14.577 1490 HE ARG 95 HE ARG 95 2.466 -19.975 -15.813 1491 HH11 ARG 95 1HH2 ARG 95 2.752 -17.395 -13.270 1492 HH12 ARG 95 2HH2 ARG 95 1.497 -16.491 -13.835 1493 HH21 ARG 95 1HH1 ARG 95 0.590 -18.747 -16.560 1494 HH22 ARG 95 2HH1 ARG 95 0.058 -17.349 -15.765 1495 H ARG 96 H ARG 96 5.195 -23.509 -9.799 1496 HA ARG 96 HA ARG 96 7.746 -24.213 -10.473 1497 HB2 ARG 96 2HB ARG 96 8.179 -24.749 -8.203 1498 HB3 ARG 96 1HB ARG 96 6.862 -23.526 -8.136 1499 HG2 ARG 96 2HG ARG 96 5.270 -25.604 -8.111 1500 HG3 ARG 96 1HG ARG 96 6.718 -26.573 -7.681 1501 HD2 ARG 96 2HD ARG 96 6.974 -25.238 -5.551 1502 HD3 ARG 96 1HD ARG 96 5.510 -24.265 -5.966 1503 HE ARG 96 HE ARG 96 5.605 -27.016 -4.937 1504 HH11 ARG 96 1HH2 ARG 96 3.590 -24.826 -6.976 1505 HH12 ARG 96 2HH2 ARG 96 2.316 -25.981 -7.116 1506 HH21 ARG 96 1HH1 ARG 96 3.839 -28.562 -5.234 1507 HH22 ARG 96 2HH1 ARG 96 2.578 -28.160 -6.307 1508 H GLU 97 H GLU 97 4.890 -26.268 -10.474 1509 HA GLU 97 HA GLU 97 6.356 -28.711 -10.174 1510 HB2 GLU 97 2HB GLU 97 3.462 -28.250 -11.083 1511 HB3 GLU 97 1HB GLU 97 4.218 -29.837 -10.694 1512 HG2 GLU 97 2HG GLU 97 4.750 -28.972 -8.363 1513 HG3 GLU 97 1HG GLU 97 3.853 -27.456 -8.752 1514 H GLU 98 H GLU 98 5.505 -26.608 -12.889 1515 HA GLU 98 HA GLU 98 5.942 -28.686 -14.866 1516 HB2 GLU 98 2HB GLU 98 5.860 -25.619 -15.158 1517 HB3 GLU 98 1HB GLU 98 5.926 -26.786 -16.519 1518 HG2 GLU 98 2HG GLU 98 3.615 -26.667 -14.469 1519 HG3 GLU 98 1HG GLU 98 3.645 -25.750 -16.015 1520 H GLU 99 H GLU 99 7.569 -25.966 -13.324 1521 HA GLU 99 HA GLU 99 9.933 -25.804 -14.694 1522 HB2 GLU 99 2HB GLU 99 8.829 -24.320 -12.823 1523 HB3 GLU 99 1HB GLU 99 9.623 -25.411 -11.646 1524 HG2 GLU 99 2HG GLU 99 11.051 -23.668 -13.759 1525 HG3 GLU 99 1HG GLU 99 10.793 -23.260 -12.029 1526 H ARG 100 H ARG 100 9.083 -27.740 -11.792 1527 HA ARG 100 HA ARG 100 11.587 -28.737 -11.356 1528 HB2 ARG 100 2HB ARG 100 9.360 -28.880 -9.888 1529 HB3 ARG 100 1HB ARG 100 9.156 -30.467 -10.684 1530 HG2 ARG 100 2HG ARG 100 11.810 -30.656 -9.836 1531 HG3 ARG 100 1HG ARG 100 11.193 -29.463 -8.662 1532 HD2 ARG 100 2HD ARG 100 10.944 -31.676 -7.638 1533 HD3 ARG 100 1HD ARG 100 9.282 -31.118 -8.111 1534 HE ARG 100 HE ARG 100 10.951 -32.826 -9.980 1535 HH11 ARG 100 1HH2 ARG 100 8.139 -32.742 -7.654 1536 HH12 ARG 100 2HH2 ARG 100 7.431 -34.137 -8.309 1537 HH21 ARG 100 1HH1 ARG 100 10.050 -34.924 -10.593 1538 HH22 ARG 100 2HH1 ARG 100 8.645 -35.495 -9.865 1539 H ARG 101 H ARG 101 9.188 -29.897 -13.682 1540 HA ARG 101 HA ARG 101 10.674 -32.389 -14.102 1541 HB2 ARG 101 2HB ARG 101 8.315 -31.282 -15.733 1542 HB3 ARG 101 1HB ARG 101 9.009 -32.943 -15.794 1543 HG2 ARG 101 2HG ARG 101 8.285 -33.210 -13.325 1544 HG3 ARG 101 1HG ARG 101 7.451 -31.624 -13.492 1545 HD2 ARG 101 2HD ARG 101 6.146 -32.691 -15.500 1546 HD3 ARG 101 1HD ARG 101 6.825 -34.288 -14.951 1547 HE ARG 101 HE ARG 101 5.559 -32.820 -12.755 1548 HH11 ARG 101 1HH2 ARG 101 4.790 -34.970 -15.611 1549 HH12 ARG 101 2HH2 ARG 101 3.111 -34.934 -15.280 1550 HH21 ARG 101 1HH1 ARG 101 3.325 -33.330 -12.072 1551 HH22 ARG 101 2HH1 ARG 101 2.410 -34.443 -13.008 1552 H GLY 102 H GLY 102 10.585 -29.084 -15.177 1553 HA2 GLY 102 2HA GLY 102 11.676 -27.949 -16.715 1554 HA3 GLY 102 1HA GLY 102 12.702 -29.410 -16.996 1555 H HIS 103 H HIS 103 9.179 -28.954 -17.274 1556 HA HIS 103 HA HIS 103 9.295 -30.169 -19.947 1557 HB2 HIS 103 2HB HIS 103 7.549 -30.901 -18.194 1558 HB3 HIS 103 1HB HIS 103 6.763 -29.306 -18.392 1559 HD1 HIS 103 1HD HIS 103 5.701 -28.916 -20.982 1560 HD2 HIS 103 2HD HIS 103 7.061 -32.830 -20.114 1561 HE1 HIS 103 1HE HIS 103 4.794 -30.433 -22.740 1562 HE2 HIS 103 2HE HIS 103 5.596 -32.787 -22.216 1563 H1 SER 1 H SER 1 18.012 -24.160 -1.706 1564 HA SER 1 HA SER 1 16.636 -21.839 -2.012 1565 HB2 SER 1 2HB SER 1 19.264 -21.811 -3.652 1566 HB3 SER 1 1HB SER 1 17.862 -20.717 -3.958 1567 HG SER 1 1HG SER 1 19.674 -19.907 -2.628 1568 H ALA 2 H ALA 2 14.944 -23.070 -2.996 1569 HA ALA 2 HA ALA 2 15.760 -25.231 -4.705 1570 HB1 ALA 2 1HB ALA 2 12.895 -24.421 -3.975 1571 HB2 ALA 2 2HB ALA 2 13.891 -25.667 -3.171 1572 HB3 ALA 2 3HB ALA 2 13.421 -25.874 -4.888 1573 H ASP 3 H ASP 3 13.142 -22.824 -5.309 1574 HA ASP 3 HA ASP 3 14.232 -22.440 -8.055 1575 HB2 ASP 3 2HB ASP 3 12.669 -24.261 -8.476 1576 HB3 ASP 3 1HB ASP 3 11.519 -23.655 -7.252 1577 H HIS 4 H HIS 4 11.270 -21.805 -6.180 1578 HA HIS 4 HA HIS 4 11.211 -19.170 -7.295 1579 HB2 HIS 4 2HB HIS 4 9.109 -19.123 -5.550 1580 HB3 HIS 4 1HB HIS 4 9.034 -19.748 -7.219 1581 HD1 HIS 4 1HD HIS 4 9.421 -22.336 -7.569 1582 HD2 HIS 4 2HD HIS 4 9.057 -21.221 -3.527 1583 HE1 HIS 4 1HE HIS 4 9.127 -24.458 -6.218 1584 HE2 HIS 4 2HE HIS 4 9.136 -23.751 -3.783 1585 H GLU 5 H GLU 5 12.436 -20.594 -4.390 1586 HA GLU 5 HA GLU 5 12.344 -18.427 -2.672 1587 HB2 GLU 5 2HB GLU 5 14.415 -20.707 -2.960 1588 HB3 GLU 5 1HB GLU 5 14.260 -19.611 -1.545 1589 HG2 GLU 5 2HG GLU 5 13.208 -21.595 -0.856 1590 HG3 GLU 5 1HG GLU 5 11.861 -20.470 -1.225 1591 H ARG 6 H ARG 6 14.613 -19.211 -5.359 1592 HA ARG 6 HA ARG 6 16.391 -17.047 -4.526 1593 HB2 ARG 6 2HB ARG 6 17.536 -17.464 -6.791 1594 HB3 ARG 6 1HB ARG 6 17.727 -18.704 -5.524 1595 HG2 ARG 6 2HG ARG 6 16.262 -20.249 -6.582 1596 HG3 ARG 6 1HG ARG 6 15.504 -18.972 -7.593 1597 HD2 ARG 6 2HD ARG 6 18.453 -19.687 -8.044 1598 HD3 ARG 6 1HD ARG 6 17.092 -20.652 -8.768 1599 HE ARG 6 HE ARG 6 16.361 -18.015 -9.336 1600 HH11 ARG 6 1HH2 ARG 6 19.009 -20.312 -10.314 1601 HH12 ARG 6 2HH2 ARG 6 19.149 -19.599 -11.871 1602 HH21 ARG 6 1HH1 ARG 6 16.311 -17.412 -11.346 1603 HH22 ARG 6 2HH1 ARG 6 17.270 -18.080 -12.602 1604 H GLU 7 H GLU 7 13.748 -17.715 -6.837 1605 HA GLU 7 HA GLU 7 14.261 -15.445 -8.367 1606 HB2 GLU 7 2HB GLU 7 12.557 -17.684 -8.599 1607 HB3 GLU 7 1HB GLU 7 11.445 -16.280 -8.514 1608 HG2 GLU 7 2HG GLU 7 11.893 -16.595 -10.829 1609 HG3 GLU 7 1HG GLU 7 12.916 -15.190 -10.368 1610 H ALA 8 H ALA 8 12.203 -15.950 -5.496 1611 HA ALA 8 HA ALA 8 10.978 -13.450 -5.446 1612 HB1 ALA 8 1HB ALA 8 11.955 -15.189 -3.080 1613 HB2 ALA 8 2HB ALA 8 10.338 -15.288 -3.870 1614 HB3 ALA 8 3HB ALA 8 10.803 -13.813 -2.947 1615 H GLN 9 H GLN 9 14.164 -14.485 -4.138 1616 HA GLN 9 HA GLN 9 14.686 -11.955 -2.977 1617 HB2 GLN 9 2HB GLN 9 15.785 -13.985 -2.103 1618 HB3 GLN 9 1HB GLN 9 16.568 -14.272 -3.689 1619 HG2 GLN 9 2HG GLN 9 18.216 -13.426 -2.125 1620 HG3 GLN 9 1HG GLN 9 17.961 -12.172 -3.377 1621 HE21 GLN 9 1HE2 GLN 9 16.386 -10.336 -2.736 1622 HE22 GLN 9 2HE2 GLN 9 16.281 -9.848 -1.084 1623 H LYS 10 H LYS 10 15.342 -13.430 -6.136 1624 HA LYS 10 HA LYS 10 17.167 -11.499 -7.065 1625 HB2 LYS 10 2HB LYS 10 16.852 -13.783 -8.117 1626 HB3 LYS 10 1HB LYS 10 15.206 -13.299 -8.616 1627 HG2 LYS 10 2HG LYS 10 16.666 -13.234 -10.524 1628 HG3 LYS 10 1HG LYS 10 16.153 -11.559 -10.140 1629 HD2 LYS 10 2HD LYS 10 18.381 -11.121 -9.068 1630 HD3 LYS 10 1HD LYS 10 18.880 -12.820 -9.424 1631 HE2 LYS 10 2HE LYS 10 18.594 -12.364 -11.906 1632 HE3 LYS 10 1HE LYS 10 18.134 -10.659 -11.527 1633 HZ1 LYS 10 3HZ LYS 10 20.390 -10.825 -12.193 1634 HZ2 LYS 10 1HZ LYS 10 20.787 -11.967 -11.018 1635 HZ3 LYS 10 2HZ LYS 10 20.368 -10.383 -10.544 1636 H ALA 11 H ALA 11 13.601 -11.741 -7.075 1637 HA ALA 11 HA ALA 11 13.030 -9.670 -8.792 1638 HB1 ALA 11 1HB ALA 11 10.797 -9.553 -7.706 1639 HB2 ALA 11 2HB ALA 11 11.418 -10.466 -6.285 1640 HB3 ALA 11 3HB ALA 11 11.298 -11.272 -7.890 1641 H GLU 12 H GLU 12 13.646 -9.538 -5.237 1642 HA GLU 12 HA GLU 12 13.096 -6.833 -4.896 1643 HB2 GLU 12 2HB GLU 12 15.308 -8.436 -3.447 1644 HB3 GLU 12 1HB GLU 12 14.651 -6.846 -2.945 1645 HG2 GLU 12 2HG GLU 12 12.373 -7.953 -2.629 1646 HG3 GLU 12 1HG GLU 12 13.160 -9.549 -2.901 1647 H GLU 13 H GLU 13 16.018 -8.462 -6.084 1648 HA GLU 13 HA GLU 13 17.671 -6.156 -5.852 1649 HB2 GLU 13 2HB GLU 13 18.409 -8.586 -5.719 1650 HB3 GLU 13 1HB GLU 13 18.232 -8.688 -7.498 1651 HG2 GLU 13 2HG GLU 13 20.058 -7.091 -7.849 1652 HG3 GLU 13 1HG GLU 13 19.996 -6.542 -6.139 1653 H GLU 14 H GLU 14 15.524 -7.485 -8.314 1654 HA GLU 14 HA GLU 14 16.568 -6.042 -10.500 1655 HB2 GLU 14 2HB GLU 14 15.075 -8.010 -10.796 1656 HB3 GLU 14 1HB GLU 14 13.741 -7.124 -9.985 1657 HG2 GLU 14 2HG GLU 14 13.299 -7.173 -12.346 1658 HG3 GLU 14 1HG GLU 14 13.685 -5.477 -11.902 1659 H LEU 15 H LEU 15 14.175 -5.278 -7.950 1660 HA LEU 15 HA LEU 15 13.244 -2.945 -9.139 1661 HB2 LEU 15 2HB LEU 15 12.160 -4.113 -7.171 1662 HB3 LEU 15 1HB LEU 15 13.459 -3.482 -6.115 1663 HG LEU 15 HG LEU 15 12.724 -1.147 -6.577 1664 HD11 LEU 15 1HD1 LEU 15 10.643 -2.442 -8.452 1665 HD12 LEU 15 2HD1 LEU 15 11.922 -1.246 -8.884 1666 HD13 LEU 15 3HD1 LEU 15 10.542 -0.748 -7.859 1667 HD21 LEU 15 3HD2 LEU 15 11.683 -2.369 -4.682 1668 HD22 LEU 15 1HD2 LEU 15 10.386 -2.994 -5.763 1669 HD23 LEU 15 2HD2 LEU 15 10.503 -1.228 -5.425 1670 H GLN 16 H GLN 16 16.058 -3.521 -7.064 1671 HA GLN 16 HA GLN 16 16.834 -0.936 -6.437 1672 HB2 GLN 16 2HB GLN 16 18.690 -3.277 -7.244 1673 HB3 GLN 16 1HB GLN 16 19.206 -1.808 -6.366 1674 HG2 GLN 16 2HG GLN 16 17.914 -2.462 -4.374 1675 HG3 GLN 16 1HG GLN 16 17.245 -3.903 -5.243 1676 HE21 GLN 16 1HE2 GLN 16 18.366 -4.976 -3.277 1677 HE22 GLN 16 2HE2 GLN 16 19.988 -5.513 -3.528 1678 H LYS 17 H LYS 17 17.301 -2.832 -9.386 1679 HA LYS 17 HA LYS 17 19.303 -1.209 -10.541 1680 HB2 LYS 17 2HB LYS 17 18.795 -3.678 -11.028 1681 HB3 LYS 17 1HB LYS 17 17.309 -3.152 -11.872 1682 HG2 LYS 17 2HG LYS 17 18.804 -1.863 -13.532 1683 HG3 LYS 17 1HG LYS 17 20.225 -2.513 -12.643 1684 HD2 LYS 17 2HD LYS 17 19.969 -4.008 -14.485 1685 HD3 LYS 17 1HD LYS 17 19.263 -4.866 -13.066 1686 HE2 LYS 17 2HE LYS 17 16.939 -3.831 -13.957 1687 HE3 LYS 17 1HE LYS 17 17.844 -3.595 -15.502 1688 HZ1 LYS 17 3HZ LYS 17 17.189 -6.082 -14.016 1689 HZ2 LYS 17 1HZ LYS 17 18.334 -6.129 -15.283 1690 HZ3 LYS 17 2HZ LYS 17 16.728 -5.683 -15.536 1691 H VAL 18 H VAL 18 15.744 -1.383 -10.733 1692 HA VAL 18 HA VAL 18 15.480 0.411 -12.897 1693 HB VAL 18 HB VAL 18 13.443 -0.332 -10.732 1694 HG11 VAL 18 1HG1 VAL 18 11.759 0.291 -12.527 1695 HG12 VAL 18 2HG1 VAL 18 13.108 0.892 -13.566 1696 HG13 VAL 18 3HG1 VAL 18 12.732 1.705 -12.003 1697 HG21 VAL 18 3HG2 VAL 18 12.661 -2.010 -12.465 1698 HG22 VAL 18 1HG2 VAL 18 14.320 -2.366 -11.905 1699 HG23 VAL 18 2HG2 VAL 18 14.073 -1.581 -13.501 1700 H LEU 19 H LEU 19 15.907 0.819 -9.394 1701 HA LEU 19 HA LEU 19 15.031 3.474 -9.249 1702 HB2 LEU 19 2HB LEU 19 17.349 2.283 -7.618 1703 HB3 LEU 19 1HB LEU 19 16.405 3.755 -7.228 1704 HG LEU 19 HG LEU 19 15.393 0.855 -7.251 1705 HD11 LEU 19 1HD1 LEU 19 16.860 1.423 -5.325 1706 HD12 LEU 19 2HD1 LEU 19 15.157 1.157 -4.800 1707 HD13 LEU 19 3HD1 LEU 19 15.814 2.836 -4.932 1708 HD21 LEU 19 3HD2 LEU 19 13.514 2.297 -7.968 1709 HD22 LEU 19 1HD2 LEU 19 13.822 3.432 -6.596 1710 HD23 LEU 19 2HD2 LEU 19 13.274 1.745 -6.279 1711 H GLU 20 H GLU 20 18.249 2.109 -10.217 1712 HA GLU 20 HA GLU 20 19.536 4.629 -10.246 1713 HB2 GLU 20 2HB GLU 20 20.176 2.105 -11.897 1714 HB3 GLU 20 1HB GLU 20 21.068 3.657 -12.024 1715 HG2 GLU 20 2HG GLU 20 21.516 3.492 -9.480 1716 HG3 GLU 20 1HG GLU 20 21.024 1.759 -9.609 1717 H GLU 21 H GLU 21 17.813 2.746 -12.790 1718 HA GLU 21 HA GLU 21 18.157 4.574 -14.875 1719 HB2 GLU 21 2HB GLU 21 15.639 2.866 -14.268 1720 HB3 GLU 21 1HB GLU 21 15.926 3.805 -15.772 1721 HG2 GLU 21 2HG GLU 21 17.892 2.289 -16.292 1722 HG3 GLU 21 1HG GLU 21 17.396 1.252 -14.893 1723 H ALA 22 H ALA 22 15.520 4.215 -12.485 1724 HA ALA 22 HA ALA 22 13.868 6.202 -13.407 1725 HB1 ALA 22 1HB ALA 22 13.147 4.452 -11.749 1726 HB2 ALA 22 2HB ALA 22 12.753 6.113 -11.176 1727 HB3 ALA 22 3HB ALA 22 14.175 5.239 -10.497 1728 H SER 23 H SER 23 16.598 6.403 -11.139 1729 HA SER 23 HA SER 23 16.103 9.000 -10.206 1730 HB2 SER 23 2HB SER 23 18.855 7.644 -10.680 1731 HB3 SER 23 1HB SER 23 18.526 9.051 -9.598 1732 HG SER 23 1HG SER 23 17.618 6.350 -9.362 1733 H LYS 24 H LYS 24 17.980 7.799 -13.007 1734 HA LYS 24 HA LYS 24 18.900 10.382 -13.735 1735 HB2 LYS 24 2HB LYS 24 19.910 8.045 -14.275 1736 HB3 LYS 24 1HB LYS 24 18.726 7.946 -15.609 1737 HG2 LYS 24 2HG LYS 24 20.758 10.261 -15.237 1738 HG3 LYS 24 1HG LYS 24 21.156 8.731 -16.082 1739 HD2 LYS 24 2HD LYS 24 19.338 9.156 -17.751 1740 HD3 LYS 24 1HD LYS 24 19.008 10.754 -16.998 1741 HE2 LYS 24 2HE LYS 24 21.292 11.560 -17.536 1742 HE3 LYS 24 1HE LYS 24 21.766 9.915 -18.115 1743 HZ1 LYS 24 3HZ LYS 24 19.948 10.185 -19.820 1744 HZ2 LYS 24 1HZ LYS 24 21.330 11.192 -19.974 1745 HZ3 LYS 24 2HZ LYS 24 19.841 11.810 -19.410 1746 H LYS 25 H LYS 25 16.218 8.234 -14.707 1747 HA LYS 25 HA LYS 25 15.206 9.853 -16.758 1748 HB2 LYS 25 2HB LYS 25 13.780 7.878 -14.883 1749 HB3 LYS 25 1HB LYS 25 12.985 8.648 -16.297 1750 HG2 LYS 25 2HG LYS 25 14.371 7.520 -17.885 1751 HG3 LYS 25 1HG LYS 25 15.513 6.939 -16.631 1752 HD2 LYS 25 2HD LYS 25 13.820 5.452 -15.658 1753 HD3 LYS 25 1HD LYS 25 12.549 6.087 -16.763 1754 HE2 LYS 25 2HE LYS 25 13.680 5.119 -18.735 1755 HE3 LYS 25 1HE LYS 25 15.089 4.594 -17.736 1756 HZ1 LYS 25 3HZ LYS 25 13.448 2.864 -18.320 1757 HZ2 LYS 25 1HZ LYS 25 12.318 3.570 -17.234 1758 HZ3 LYS 25 2HZ LYS 25 13.830 2.913 -16.726 1759 H ALA 26 H ALA 26 14.554 9.866 -13.206 1760 HA ALA 26 HA ALA 26 12.374 11.558 -13.254 1761 HB1 ALA 26 1HB ALA 26 12.888 11.987 -10.828 1762 HB2 ALA 26 2HB ALA 26 14.532 11.282 -11.055 1763 HB3 ALA 26 3HB ALA 26 13.078 10.244 -11.224 1764 H VAL 27 H VAL 27 15.868 12.327 -12.844 1765 HA VAL 27 HA VAL 27 15.363 15.106 -12.572 1766 HB VAL 27 HB VAL 27 17.254 13.977 -11.512 1767 HG11 VAL 27 1HG1 VAL 27 18.410 13.659 -14.370 1768 HG12 VAL 27 2HG1 VAL 27 17.819 12.334 -13.310 1769 HG13 VAL 27 3HG1 VAL 27 19.251 13.287 -12.818 1770 HG21 VAL 27 3HG2 VAL 27 17.281 16.425 -11.969 1771 HG22 VAL 27 1HG2 VAL 27 18.169 16.142 -13.509 1772 HG23 VAL 27 2HG2 VAL 27 18.937 15.719 -11.941 1773 H GLU 28 H GLU 28 15.453 12.991 -15.286 1774 HA GLU 28 HA GLU 28 16.010 15.206 -17.119 1775 HB2 GLU 28 2HB GLU 28 17.178 12.926 -17.170 1776 HB3 GLU 28 1HB GLU 28 15.646 12.227 -17.771 1777 HG2 GLU 28 2HG GLU 28 15.835 13.473 -19.859 1778 HG3 GLU 28 1HG GLU 28 17.077 14.590 -19.168 1779 H ALA 29 H ALA 29 13.416 13.807 -15.459 1780 HA ALA 29 HA ALA 29 11.490 14.012 -17.639 1781 HB1 ALA 29 1HB ALA 29 11.337 12.039 -16.063 1782 HB2 ALA 29 2HB ALA 29 9.860 13.059 -16.016 1783 HB3 ALA 29 3HB ALA 29 11.084 13.173 -14.692 1784 H GLU 30 H GLU 30 12.679 15.810 -14.890 1785 HA GLU 30 HA GLU 30 10.437 17.566 -14.621 1786 HB2 GLU 30 2HB GLU 30 12.110 19.164 -13.569 1787 HB3 GLU 30 1HB GLU 30 12.171 17.522 -12.855 1788 HG2 GLU 30 2HG GLU 30 14.406 17.786 -13.031 1789 HG3 GLU 30 1HG GLU 30 14.149 17.176 -14.679 1790 H ARG 31 H ARG 31 13.100 17.123 -16.736 1791 HA ARG 31 HA ARG 31 13.524 19.689 -17.618 1792 HB2 ARG 31 2HB ARG 31 14.727 17.164 -17.962 1793 HB3 ARG 31 1HB ARG 31 14.061 17.417 -19.592 1794 HG2 ARG 31 2HG ARG 31 16.322 18.206 -19.611 1795 HG3 ARG 31 1HG ARG 31 15.292 19.684 -19.594 1796 HD2 ARG 31 2HD ARG 31 15.560 19.728 -17.044 1797 HD3 ARG 31 1HD ARG 31 16.773 18.394 -17.162 1798 HE ARG 31 HE ARG 31 17.883 20.075 -18.912 1799 HH11 ARG 31 1HH2 ARG 31 16.459 20.736 -15.657 1800 HH12 ARG 31 2HH2 ARG 31 17.102 22.304 -15.509 1801 HH21 ARG 31 1HH1 ARG 31 18.760 22.278 -18.770 1802 HH22 ARG 31 2HH1 ARG 31 18.491 23.267 -17.441 1803 H GLY 32 H GLY 32 12.066 20.942 -18.704 1804 HA2 GLY 32 2HA GLY 32 11.001 21.489 -20.653 1805 HA3 GLY 32 1HA GLY 32 10.816 19.751 -21.078 1806 H ALA 33 H ALA 33 9.950 19.922 -17.850 1807 HA ALA 33 HA ALA 33 7.144 20.015 -18.647 1808 HB1 ALA 33 1HB ALA 33 6.696 18.902 -16.463 1809 HB2 ALA 33 2HB ALA 33 8.454 19.006 -16.061 1810 HB3 ALA 33 3HB ALA 33 7.910 17.976 -17.429 1811 HA PRO 34 HA PRO 34 7.032 23.930 -16.542 1812 HB2 PRO 34 2HB PRO 34 4.297 24.209 -15.937 1813 HB3 PRO 34 1HB PRO 34 4.992 24.390 -17.590 1814 HG2 PRO 34 2HG PRO 34 3.677 21.914 -16.363 1815 HG3 PRO 34 1HG PRO 34 3.392 22.640 -18.000 1816 HD2 PRO 34 2HD PRO 34 5.089 20.481 -17.635 1817 HD3 PRO 34 1HD PRO 34 5.497 21.790 -18.832 1818 H GLY 35 H GLY 35 7.743 24.412 -14.481 1819 HA2 GLY 35 2HA GLY 35 7.468 24.680 -12.234 1820 HA3 GLY 35 1HA GLY 35 6.261 23.340 -12.199 1821 H ALA 36 H ALA 36 9.618 23.524 -13.518 1822 HA ALA 36 HA ALA 36 10.193 20.926 -12.719 1823 HB1 ALA 36 1HB ALA 36 12.558 21.483 -13.401 1824 HB2 ALA 36 2HB ALA 36 12.073 23.203 -13.575 1825 HB3 ALA 36 3HB ALA 36 11.355 21.938 -14.647 1826 H ALA 37 H ALA 37 10.865 20.126 -10.815 1827 HA ALA 37 HA ALA 37 12.121 21.936 -8.836 1828 HB1 ALA 37 1HB ALA 37 10.841 20.727 -7.062 1829 HB2 ALA 37 2HB ALA 37 10.029 19.711 -8.314 1830 HB3 ALA 37 3HB ALA 37 9.711 21.479 -8.240 1831 H LEU 38 H LEU 38 11.758 18.629 -10.148 1832 HA LEU 38 HA LEU 38 13.661 17.508 -8.322 1833 HB2 LEU 38 2HB LEU 38 11.427 16.589 -9.587 1834 HB3 LEU 38 1HB LEU 38 12.626 16.045 -10.793 1835 HG LEU 38 HG LEU 38 12.625 15.377 -7.773 1836 HD11 LEU 38 1HD1 LEU 38 10.600 14.501 -8.863 1837 HD12 LEU 38 2HD1 LEU 38 11.727 13.157 -8.498 1838 HD13 LEU 38 3HD1 LEU 38 11.583 13.759 -10.186 1839 HD21 LEU 38 3HD2 LEU 38 14.172 13.486 -8.393 1840 HD22 LEU 38 1HD2 LEU 38 14.916 15.094 -8.720 1841 HD23 LEU 38 2HD2 LEU 38 14.258 14.119 -10.078 1842 H ILE 39 H ILE 39 14.694 19.659 -9.853 1843 HA ILE 39 HA ILE 39 16.007 18.831 -12.225 1844 HB ILE 39 HB ILE 39 15.169 21.082 -11.955 1845 HG12 ILE 39 2HG1 ILE 39 18.245 21.234 -11.898 1846 HG13 ILE 39 1HG1 ILE 39 17.240 20.780 -13.311 1847 HG21 ILE 39 1HG2 ILE 39 17.060 21.377 -9.515 1848 HG22 ILE 39 2HG2 ILE 39 15.263 21.283 -9.452 1849 HG23 ILE 39 3HG2 ILE 39 16.043 22.672 -10.231 1850 HD11 ILE 39 3HD ILE 39 17.172 23.512 -11.867 1851 HD12 ILE 39 1HD ILE 39 17.890 23.161 -13.471 1852 HD13 ILE 39 2HD ILE 39 16.103 23.029 -13.235 1853 H SER 40 H SER 40 16.688 18.584 -8.852 1854 HA SER 40 HA SER 40 19.523 18.809 -9.153 1855 HB2 SER 40 2HB SER 40 18.474 19.634 -7.092 1856 HB3 SER 40 1HB SER 40 17.812 18.006 -6.748 1857 HG SER 40 1HG SER 40 19.629 18.175 -5.554 1858 H TYR 41 H TYR 41 20.793 17.291 -9.845 1859 HA TYR 41 HA TYR 41 20.064 14.629 -10.343 1860 HB2 TYR 41 2HB TYR 41 21.688 15.784 -11.790 1861 HB3 TYR 41 1HB TYR 41 22.807 16.033 -10.418 1862 HD1 TYR 41 1HD TYR 41 21.465 13.553 -12.842 1863 HD2 TYR 41 2HD TYR 41 24.214 14.217 -9.602 1864 HE1 TYR 41 1HE TYR 41 22.624 11.450 -13.399 1865 HE2 TYR 41 2HE TYR 41 25.374 12.120 -10.150 1866 HH TYR 41 HH TYR 41 24.402 10.058 -12.937 1867 HA PRO 42 HA PRO 42 22.729 13.133 -6.891 1868 HB2 PRO 42 2HB PRO 42 23.621 14.701 -4.736 1869 HB3 PRO 42 1HB PRO 42 24.528 14.558 -6.285 1870 HG2 PRO 42 2HG PRO 42 22.560 16.772 -5.469 1871 HG3 PRO 42 1HG PRO 42 24.222 16.957 -6.167 1872 HD2 PRO 42 2HD PRO 42 21.955 17.088 -7.725 1873 HD3 PRO 42 1HD PRO 42 23.464 16.275 -8.350 1874 H ASP 43 H ASP 43 20.174 15.346 -6.316 1875 HA ASP 43 HA ASP 43 19.244 14.186 -3.822 1876 HB2 ASP 43 2HB ASP 43 18.294 16.227 -5.882 1877 HB3 ASP 43 1HB ASP 43 17.037 15.487 -4.888 1878 H ALA 44 H ALA 44 18.982 13.661 -7.305 1879 HA ALA 44 HA ALA 44 16.350 12.835 -7.422 1880 HB1 ALA 44 1HB ALA 44 16.896 11.869 -9.648 1881 HB2 ALA 44 2HB ALA 44 18.659 11.979 -9.279 1882 HB3 ALA 44 3HB ALA 44 17.676 13.478 -9.448 1883 H ILE 45 H ILE 45 19.331 11.022 -6.821 1884 HA ILE 45 HA ILE 45 18.210 8.474 -6.995 1885 HB ILE 45 HB ILE 45 20.557 8.806 -7.237 1886 HG12 ILE 45 2HG1 ILE 45 20.009 7.131 -4.710 1887 HG13 ILE 45 1HG1 ILE 45 19.733 6.616 -6.406 1888 HG21 ILE 45 1HG2 ILE 45 22.036 9.501 -5.349 1889 HG22 ILE 45 2HG2 ILE 45 20.608 9.762 -4.295 1890 HG23 ILE 45 3HG2 ILE 45 20.865 10.784 -5.754 1891 HD11 ILE 45 3HD ILE 45 22.468 7.334 -5.140 1892 HD12 ILE 45 1HD ILE 45 21.880 5.703 -5.608 1893 HD13 ILE 45 2HD ILE 45 22.209 6.931 -6.881 1894 H TRP 46 H TRP 46 18.161 10.842 -4.371 1895 HA TRP 46 HA TRP 46 17.335 8.859 -2.429 1896 HB2 TRP 46 2HB TRP 46 17.843 11.848 -2.391 1897 HB3 TRP 46 1HB TRP 46 16.697 11.201 -1.205 1898 HD1 TRP 46 HD TRP 46 18.266 12.113 0.644 1899 HE1 TRP 46 1HE TRP 46 20.318 11.115 1.876 1900 HE3 TRP 46 3HE TRP 46 19.496 8.409 -2.693 1901 HZ2 TRP 46 2HZ TRP 46 22.173 9.018 1.478 1902 HZ3 TRP 46 3HZ TRP 46 21.414 6.969 -2.216 1903 HH2 TRP 46 HH TRP 46 22.744 7.259 -0.160 1904 H TRP 47 H TRP 47 15.779 11.165 -4.655 1905 HA TRP 47 HA TRP 47 13.191 10.934 -3.488 1906 HB2 TRP 47 2HB TRP 47 13.710 12.743 -5.188 1907 HB3 TRP 47 1HB TRP 47 13.941 11.484 -6.428 1908 HD1 TRP 47 HD TRP 47 10.907 12.654 -4.088 1909 HE1 TRP 47 1HE TRP 47 8.793 12.423 -5.459 1910 HE3 TRP 47 3HE TRP 47 12.919 10.256 -8.109 1911 HZ2 TRP 47 2HZ TRP 47 8.041 11.370 -8.042 1912 HZ3 TRP 47 3HZ TRP 47 11.418 9.497 -9.919 1913 HH2 TRP 47 HH TRP 47 9.023 10.076 -9.901 1914 H SER 48 H SER 48 14.983 9.080 -6.017 1915 HA SER 48 HA SER 48 12.886 7.582 -6.913 1916 HB2 SER 48 2HB SER 48 15.814 6.699 -6.552 1917 HB3 SER 48 1HB SER 48 14.611 5.925 -7.661 1918 HG SER 48 1HG SER 48 16.136 7.687 -8.413 1919 H VAL 49 H VAL 49 14.570 7.294 -3.851 1920 HA VAL 49 HA VAL 49 13.909 4.619 -3.286 1921 HB VAL 49 HB VAL 49 14.333 6.970 -1.353 1922 HG11 VAL 49 1HG1 VAL 49 14.513 3.902 -0.945 1923 HG12 VAL 49 2HG1 VAL 49 13.285 5.002 -0.216 1924 HG13 VAL 49 3HG1 VAL 49 15.014 5.151 0.249 1925 HG21 VAL 49 3HG2 VAL 49 16.711 6.089 -1.267 1926 HG22 VAL 49 1HG2 VAL 49 16.280 6.754 -2.874 1927 HG23 VAL 49 2HG2 VAL 49 16.332 4.971 -2.626 1928 H GLU 50 H GLU 50 12.276 7.757 -2.588 1929 HA GLU 50 HA GLU 50 10.202 6.416 -1.102 1930 HB2 GLU 50 2HB GLU 50 9.470 8.861 -0.700 1931 HB3 GLU 50 1HB GLU 50 11.079 8.381 -0.099 1932 HG2 GLU 50 2HG GLU 50 12.134 9.391 -2.207 1933 HG3 GLU 50 1HG GLU 50 10.511 10.047 -2.640 1934 H THR 51 H THR 51 10.184 5.601 -3.765 1935 HA THR 51 HA THR 51 7.635 6.692 -4.730 1936 HB THR 51 HB THR 51 10.263 6.571 -6.319 1937 HG1 THR 51 1HG THR 51 9.979 8.516 -5.390 1938 HG21 THR 51 3HG2 THR 51 8.559 5.555 -7.780 1939 HG22 THR 51 1HG2 THR 51 8.781 7.257 -8.306 1940 HG23 THR 51 2HG2 THR 51 7.339 6.787 -7.330 1941 H ALA 52 H ALA 52 10.300 4.278 -5.381 1942 HA ALA 52 HA ALA 52 8.625 2.625 -6.833 1943 HB1 ALA 52 1HB ALA 52 10.393 0.877 -6.543 1944 HB2 ALA 52 2HB ALA 52 11.157 1.869 -5.245 1945 HB3 ALA 52 3HB ALA 52 11.107 2.475 -6.947 1946 H THR 53 H THR 53 9.191 2.700 -3.286 1947 HA THR 53 HA THR 53 7.673 0.252 -2.948 1948 HB THR 53 HB THR 53 8.336 0.767 -0.501 1949 HG1 THR 53 1HG THR 53 8.780 2.880 -0.559 1950 HG21 THR 53 3HG2 THR 53 9.635 -0.823 -1.907 1951 HG22 THR 53 1HG2 THR 53 10.741 0.154 -0.886 1952 HG23 THR 53 2HG2 THR 53 10.576 0.531 -2.639 1953 H THR 54 H THR 54 6.452 2.908 -3.997 1954 HA THR 54 HA THR 54 4.792 4.250 -3.696 1955 HB THR 54 HB THR 54 2.664 3.316 -2.639 1956 HG1 THR 54 1HG THR 54 3.907 1.825 -1.329 1957 HG21 THR 54 3HG2 THR 54 2.377 1.671 -4.526 1958 HG22 THR 54 1HG2 THR 54 4.154 1.700 -4.837 1959 HG23 THR 54 2HG2 THR 54 3.159 3.188 -5.078 1960 H VAL 55 H VAL 55 5.984 5.866 -2.447 1961 HA VAL 55 HA VAL 55 5.110 5.910 0.367 1962 HB VAL 55 HB VAL 55 7.803 6.985 -0.614 1963 HG11 VAL 55 1HG1 VAL 55 8.218 7.215 1.813 1964 HG12 VAL 55 2HG1 VAL 55 6.633 6.434 2.196 1965 HG13 VAL 55 3HG1 VAL 55 6.676 8.052 1.442 1966 HG21 VAL 55 3HG2 VAL 55 7.133 4.294 0.719 1967 HG22 VAL 55 1HG2 VAL 55 8.792 4.987 0.526 1968 HG23 VAL 55 2HG2 VAL 55 7.834 4.549 -0.926 1969 H GLY 56 H GLY 56 6.994 8.387 -1.441 1970 HA2 GLY 56 2HA GLY 56 6.392 10.411 -2.097 1971 HA3 GLY 56 1HA GLY 56 4.653 9.947 -1.934 1972 H TYR 57 H TYR 57 7.320 10.046 0.452 1973 HA TYR 57 HA TYR 57 5.639 10.903 2.485 1974 HB2 TYR 57 2HB TYR 57 8.222 9.848 2.325 1975 HB3 TYR 57 1HB TYR 57 8.638 11.541 2.726 1976 HD1 TYR 57 1HD TYR 57 6.944 12.526 4.738 1977 HD2 TYR 57 2HD TYR 57 8.012 8.401 4.073 1978 HE1 TYR 57 1HE TYR 57 6.339 11.991 7.057 1979 HE2 TYR 57 2HE TYR 57 7.436 7.886 6.411 1980 HH TYR 57 HH TYR 57 6.002 10.320 8.608 1981 H GLY 58 H GLY 58 7.965 12.718 0.374 1982 HA2 GLY 58 2HA GLY 58 6.768 14.943 -0.011 1983 HA3 GLY 58 1HA GLY 58 7.338 15.192 1.711 1984 H ASP 59 H ASP 59 9.120 16.495 1.384 1985 HA ASP 59 HA ASP 59 11.052 17.197 0.896 1986 HB2 ASP 59 2HB ASP 59 11.904 15.062 1.742 1987 HB3 ASP 59 1HB ASP 59 12.008 14.449 0.047 1988 H ARG 60 H ARG 60 10.469 14.895 -1.863 1989 HA ARG 60 HA ARG 60 10.728 17.231 -3.651 1990 HB2 ARG 60 2HB ARG 60 11.983 14.456 -3.958 1991 HB3 ARG 60 1HB ARG 60 11.851 15.610 -5.329 1992 HG2 ARG 60 2HG ARG 60 13.413 17.138 -4.339 1993 HG3 ARG 60 1HG ARG 60 13.245 16.427 -2.709 1994 HD2 ARG 60 2HD ARG 60 14.599 14.951 -5.070 1995 HD3 ARG 60 1HD ARG 60 15.430 15.898 -3.769 1996 HE ARG 60 HE ARG 60 13.778 13.389 -3.337 1997 HH11 ARG 60 1HH2 ARG 60 16.442 15.569 -2.038 1998 HH12 ARG 60 2HH2 ARG 60 15.825 15.315 -0.450 1999 HH21 ARG 60 1HH1 ARG 60 13.518 12.711 -1.107 2000 HH22 ARG 60 2HH1 ARG 60 14.370 13.615 0.062 2001 H TYR 61 H TYR 61 9.510 16.747 -5.814 2002 HA TYR 61 HA TYR 61 7.519 14.727 -5.487 2003 HB2 TYR 61 2HB TYR 61 5.607 16.283 -5.747 2004 HB3 TYR 61 1HB TYR 61 6.499 16.681 -4.248 2005 HD1 TYR 61 1HD TYR 61 8.265 18.686 -4.438 2006 HD2 TYR 61 2HD TYR 61 5.080 17.964 -7.235 2007 HE1 TYR 61 1HE TYR 61 8.425 21.017 -5.226 2008 HE2 TYR 61 2HE TYR 61 5.227 20.270 -8.021 2009 HH TYR 61 HH TYR 61 6.421 22.178 -7.974 2010 HA PRO 62 HA PRO 62 8.413 15.085 -9.837 2011 HB2 PRO 62 2HB PRO 62 6.149 13.948 -11.038 2012 HB3 PRO 62 1HB PRO 62 7.301 12.953 -10.058 2013 HG2 PRO 62 2HG PRO 62 4.648 14.226 -9.168 2014 HG3 PRO 62 1HG PRO 62 5.205 12.525 -8.915 2015 HD2 PRO 62 2HD PRO 62 5.473 14.535 -7.014 2016 HD3 PRO 62 1HD PRO 62 6.705 13.199 -7.163 2017 H VAL 63 H VAL 63 7.504 16.036 -11.925 2018 HA VAL 63 HA VAL 63 6.035 18.491 -11.345 2019 HB VAL 63 HB VAL 63 7.648 17.639 -13.841 2020 HG11 VAL 63 1HG1 VAL 63 6.181 19.593 -14.267 2021 HG12 VAL 63 2HG1 VAL 63 7.861 20.186 -14.090 2022 HG13 VAL 63 3HG1 VAL 63 6.701 20.368 -12.731 2023 HG21 VAL 63 3HG2 VAL 63 9.547 18.963 -12.873 2024 HG22 VAL 63 1HG2 VAL 63 9.211 17.506 -11.896 2025 HG23 VAL 63 2HG2 VAL 63 8.641 19.123 -11.318 2026 H THR 64 H THR 64 4.350 18.961 -13.220 2027 HA THR 64 HA THR 64 2.594 16.930 -13.190 2028 HB THR 64 HB THR 64 2.482 19.262 -15.148 2029 HG1 THR 64 1HG THR 64 1.839 19.340 -12.399 2030 HG21 THR 64 3HG2 THR 64 0.060 19.238 -14.497 2031 HG22 THR 64 1HG2 THR 64 0.345 17.832 -13.401 2032 HG23 THR 64 2HG2 THR 64 0.548 17.648 -15.178 2033 H GLU 65 H GLU 65 3.989 18.206 -16.291 2034 HA GLU 65 HA GLU 65 2.653 16.441 -17.846 2035 HB2 GLU 65 2HB GLU 65 3.655 18.519 -18.683 2036 HB3 GLU 65 1HB GLU 65 5.312 17.863 -18.479 2037 HG2 GLU 65 2HG GLU 65 4.942 16.214 -20.278 2038 HG3 GLU 65 1HG GLU 65 3.195 16.636 -20.363 2039 H GLU 66 H GLU 66 6.270 16.150 -17.477 2040 HA GLU 66 HA GLU 66 5.861 13.360 -18.159 2041 HB2 GLU 66 2HB GLU 66 8.474 14.893 -18.057 2042 HB3 GLU 66 1HB GLU 66 8.216 13.187 -18.540 2043 HG2 GLU 66 2HG GLU 66 6.399 14.223 -20.218 2044 HG3 GLU 66 1HG GLU 66 7.308 15.759 -19.970 2045 H GLY 67 H GLY 67 7.180 15.171 -15.344 2046 HA2 GLY 67 2HA GLY 67 8.474 13.173 -14.064 2047 HA3 GLY 67 1HA GLY 67 7.535 14.485 -13.257 2048 H ARG 68 H ARG 68 4.917 13.693 -14.003 2049 HA ARG 68 HA ARG 68 4.483 11.624 -12.118 2050 HB2 ARG 68 2HB ARG 68 2.617 13.059 -14.080 2051 HB3 ARG 68 1HB ARG 68 2.054 11.846 -12.852 2052 HG2 ARG 68 2HG ARG 68 3.000 13.131 -11.022 2053 HG3 ARG 68 1HG ARG 68 3.750 14.309 -12.143 2054 HD2 ARG 68 2HD ARG 68 1.476 15.108 -12.870 2055 HD3 ARG 68 1HD ARG 68 0.712 13.951 -11.680 2056 HE ARG 68 HE ARG 68 1.990 14.879 -9.955 2057 HH11 ARG 68 1HH2 ARG 68 -0.414 15.487 -9.978 2058 HH12 ARG 68 2HH2 ARG 68 -0.630 17.170 -9.897 2059 HH21 ARG 68 1HH1 ARG 68 2.785 17.754 -10.586 2060 HH22 ARG 68 2HH1 ARG 68 1.391 18.488 -10.008 2061 H LYS 69 H LYS 69 4.607 11.670 -15.715 2062 HA LYS 69 HA LYS 69 3.507 8.999 -15.777 2063 HB2 LYS 69 2HB LYS 69 4.723 10.761 -17.952 2064 HB3 LYS 69 1HB LYS 69 4.263 9.050 -18.247 2065 HG2 LYS 69 2HG LYS 69 2.298 11.121 -17.113 2066 HG3 LYS 69 1HG LYS 69 2.485 10.829 -18.876 2067 HD2 LYS 69 2HD LYS 69 1.601 8.623 -18.758 2068 HD3 LYS 69 1HD LYS 69 1.936 8.463 -17.005 2069 HE2 LYS 69 2HE LYS 69 0.154 10.164 -16.484 2070 HE3 LYS 69 1HE LYS 69 -0.313 10.197 -18.234 2071 HZ1 LYS 69 3HZ LYS 69 -0.186 7.662 -16.657 2072 HZ2 LYS 69 1HZ LYS 69 -1.054 7.991 -18.113 2073 HZ3 LYS 69 2HZ LYS 69 -1.557 8.650 -16.652 2074 H VAL 70 H VAL 70 6.718 10.476 -15.611 2075 HA VAL 70 HA VAL 70 8.039 7.967 -15.997 2076 HB VAL 70 HB VAL 70 8.969 10.634 -14.852 2077 HG11 VAL 70 1HG1 VAL 70 10.409 8.832 -13.888 2078 HG12 VAL 70 2HG1 VAL 70 11.295 9.720 -15.171 2079 HG13 VAL 70 3HG1 VAL 70 10.606 8.088 -15.519 2080 HG21 VAL 70 3HG2 VAL 70 10.120 10.694 -17.153 2081 HG22 VAL 70 1HG2 VAL 70 8.332 10.674 -17.274 2082 HG23 VAL 70 2HG2 VAL 70 9.273 9.170 -17.576 2083 H ALA 71 H ALA 71 6.945 9.832 -13.088 2084 HA ALA 71 HA ALA 71 7.917 8.084 -11.169 2085 HB1 ALA 71 1HB ALA 71 5.254 9.651 -11.079 2086 HB2 ALA 71 2HB ALA 71 6.854 10.312 -10.591 2087 HB3 ALA 71 3HB ALA 71 6.124 8.956 -9.663 2088 H GLU 72 H GLU 72 4.840 8.052 -13.003 2089 HA GLU 72 HA GLU 72 3.575 5.955 -11.798 2090 HB2 GLU 72 2HB GLU 72 2.678 7.540 -13.687 2091 HB3 GLU 72 1HB GLU 72 3.527 6.470 -14.837 2092 HG2 GLU 72 2HG GLU 72 2.029 4.562 -13.624 2093 HG3 GLU 72 1HG GLU 72 1.040 5.964 -13.106 2094 H GLN 73 H GLN 73 6.137 5.896 -14.254 2095 HA GLN 73 HA GLN 73 5.831 3.222 -15.065 2096 HB2 GLN 73 2HB GLN 73 7.103 4.967 -16.365 2097 HB3 GLN 73 1HB GLN 73 8.343 5.012 -15.073 2098 HG2 GLN 73 2HG GLN 73 8.920 2.583 -15.565 2099 HG3 GLN 73 1HG GLN 73 7.746 2.612 -16.931 2100 HE21 GLN 73 1HE2 GLN 73 8.134 4.385 -18.627 2101 HE22 GLN 73 2HE2 GLN 73 9.733 4.968 -18.911 2102 H VAL 74 H VAL 74 8.063 4.772 -12.672 2103 HA VAL 74 HA VAL 74 9.276 2.260 -12.077 2104 HB VAL 74 HB VAL 74 10.663 4.169 -11.999 2105 HG11 VAL 74 1HG1 VAL 74 10.292 6.029 -10.305 2106 HG12 VAL 74 2HG1 VAL 74 8.659 5.347 -9.972 2107 HG13 VAL 74 3HG1 VAL 74 9.063 5.973 -11.608 2108 HG21 VAL 74 3HG2 VAL 74 10.192 3.234 -9.090 2109 HG22 VAL 74 1HG2 VAL 74 11.690 3.963 -9.762 2110 HG23 VAL 74 2HG2 VAL 74 11.140 2.345 -10.335 2111 H MET 75 H MET 75 6.561 4.080 -10.809 2112 HA MET 75 HA MET 75 6.236 2.886 -8.350 2113 HB2 MET 75 2HB MET 75 4.888 4.803 -9.653 2114 HB3 MET 75 1HB MET 75 3.849 3.473 -10.198 2115 HG2 MET 75 2HG MET 75 2.738 4.249 -8.321 2116 HG3 MET 75 1HG MET 75 3.639 2.867 -7.637 2117 HE1 MET 75 3HE MET 75 3.170 6.724 -8.018 2118 HE2 MET 75 1HE MET 75 4.872 6.671 -8.608 2119 HE3 MET 75 2HE MET 75 4.493 7.450 -7.045 2120 H LYS 76 H LYS 76 5.060 1.842 -11.594 2121 HA LYS 76 HA LYS 76 3.616 -0.347 -10.597 2122 HB2 LYS 76 2HB LYS 76 3.185 0.678 -12.857 2123 HB3 LYS 76 1HB LYS 76 4.732 -0.028 -13.442 2124 HG2 LYS 76 2HG LYS 76 3.884 -2.323 -12.959 2125 HG3 LYS 76 1HG LYS 76 2.371 -1.648 -12.263 2126 HD2 LYS 76 2HD LYS 76 1.718 -0.801 -14.517 2127 HD3 LYS 76 1HD LYS 76 3.302 -1.358 -15.186 2128 HE2 LYS 76 2HE LYS 76 2.743 -3.736 -14.566 2129 HE3 LYS 76 1HE LYS 76 1.136 -3.207 -13.941 2130 HZ1 LYS 76 3HZ LYS 76 1.443 -4.107 -16.350 2131 HZ2 LYS 76 1HZ LYS 76 1.854 -2.512 -16.723 2132 HZ3 LYS 76 2HZ LYS 76 0.336 -2.906 -16.018 2133 H ALA 77 H ALA 77 6.986 0.006 -11.672 2134 HA ALA 77 HA ALA 77 7.616 -2.696 -11.895 2135 HB1 ALA 77 1HB ALA 77 9.460 -0.412 -10.932 2136 HB2 ALA 77 2HB ALA 77 9.172 -0.865 -12.655 2137 HB3 ALA 77 3HB ALA 77 10.000 -2.019 -11.547 2138 H GLY 78 H GLY 78 7.482 -0.575 -9.012 2139 HA2 GLY 78 2HA GLY 78 8.682 -2.471 -7.263 2140 HA3 GLY 78 1HA GLY 78 7.690 -1.022 -6.847 2141 H ILE 79 H ILE 79 5.310 -1.698 -8.176 2142 HA ILE 79 HA ILE 79 4.111 -3.380 -6.274 2143 HB ILE 79 HB ILE 79 3.066 -2.443 -8.985 2144 HG12 ILE 79 2HG1 ILE 79 2.611 -1.327 -6.134 2145 HG13 ILE 79 1HG1 ILE 79 3.717 -0.604 -7.335 2146 HG21 ILE 79 1HG2 ILE 79 0.786 -2.969 -8.018 2147 HG22 ILE 79 2HG2 ILE 79 1.572 -3.641 -6.544 2148 HG23 ILE 79 3HG2 ILE 79 1.786 -4.446 -8.140 2149 HD11 ILE 79 3HD ILE 79 0.650 -0.837 -7.623 2150 HD12 ILE 79 1HD ILE 79 1.617 0.648 -7.337 2151 HD13 ILE 79 2HD ILE 79 1.764 -0.227 -8.906 2152 H GLU 80 H GLU 80 5.110 -3.923 -9.698 2153 HA GLU 80 HA GLU 80 4.236 -6.549 -9.921 2154 HB2 GLU 80 2HB GLU 80 6.723 -5.224 -11.181 2155 HB3 GLU 80 1HB GLU 80 6.107 -6.844 -11.644 2156 HG2 GLU 80 2HG GLU 80 3.993 -5.855 -12.497 2157 HG3 GLU 80 1HG GLU 80 4.538 -4.216 -11.997 2158 H VAL 81 H VAL 81 7.408 -5.300 -8.743 2159 HA VAL 81 HA VAL 81 8.597 -7.790 -8.403 2160 HB VAL 81 HB VAL 81 9.082 -5.015 -7.269 2161 HG11 VAL 81 1HG1 VAL 81 9.860 -6.399 -5.406 2162 HG12 VAL 81 2HG1 VAL 81 11.302 -5.918 -6.354 2163 HG13 VAL 81 3HG1 VAL 81 10.636 -7.579 -6.526 2164 HG21 VAL 81 3HG2 VAL 81 10.705 -6.898 -9.126 2165 HG22 VAL 81 1HG2 VAL 81 11.073 -5.175 -8.765 2166 HG23 VAL 81 2HG2 VAL 81 9.599 -5.598 -9.699 2167 H PHE 82 H PHE 82 6.925 -5.744 -5.893 2168 HA PHE 82 HA PHE 82 7.454 -7.736 -3.933 2169 HB2 PHE 82 2HB PHE 82 5.463 -5.385 -3.844 2170 HB3 PHE 82 1HB PHE 82 5.849 -6.453 -2.440 2171 HD1 PHE 82 2HD PHE 82 8.535 -6.829 -2.108 2172 HD2 PHE 82 1HD PHE 82 6.673 -3.381 -3.876 2173 HE1 PHE 82 2HE PHE 82 10.555 -5.494 -1.636 2174 HE2 PHE 82 1HE PHE 82 8.692 -2.056 -3.436 2175 HZ PHE 82 HZ PHE 82 10.650 -3.098 -2.299 2176 H ALA 83 H ALA 83 4.699 -7.112 -6.111 2177 HA ALA 83 HA ALA 83 2.989 -8.919 -4.766 2178 HB1 ALA 83 1HB ALA 83 1.548 -8.750 -6.746 2179 HB2 ALA 83 2HB ALA 83 2.902 -8.044 -7.715 2180 HB3 ALA 83 3HB ALA 83 2.176 -7.123 -6.349 2181 H LEU 84 H LEU 84 5.535 -9.313 -7.240 2182 HA LEU 84 HA LEU 84 4.702 -11.889 -8.054 2183 HB2 LEU 84 2HB LEU 84 6.054 -10.350 -9.446 2184 HB3 LEU 84 1HB LEU 84 7.444 -10.524 -8.336 2185 HG LEU 84 HG LEU 84 6.345 -13.107 -9.442 2186 HD11 LEU 84 1HD1 LEU 84 7.650 -11.094 -11.378 2187 HD12 LEU 84 2HD1 LEU 84 5.926 -11.651 -11.404 2188 HD13 LEU 84 3HD1 LEU 84 7.253 -12.823 -11.726 2189 HD21 LEU 84 3HD2 LEU 84 8.744 -13.617 -9.847 2190 HD22 LEU 84 1HD2 LEU 84 8.512 -13.007 -8.174 2191 HD23 LEU 84 2HD2 LEU 84 9.206 -11.921 -9.431 2192 H VAL 85 H VAL 85 6.220 -10.839 -5.164 2193 HA VAL 85 HA VAL 85 7.865 -13.052 -4.656 2194 HB VAL 85 HB VAL 85 6.439 -11.203 -2.681 2195 HG11 VAL 85 1HG1 VAL 85 8.374 -11.796 -1.145 2196 HG12 VAL 85 2HG1 VAL 85 8.880 -13.077 -2.304 2197 HG13 VAL 85 3HG1 VAL 85 7.295 -13.190 -1.452 2198 HG21 VAL 85 3HG2 VAL 85 7.847 -9.947 -4.294 2199 HG22 VAL 85 1HG2 VAL 85 9.224 -11.077 -4.046 2200 HG23 VAL 85 2HG2 VAL 85 8.674 -9.999 -2.711 2201 H THR 86 H THR 86 4.444 -12.946 -5.019 2202 HA THR 86 HA THR 86 3.454 -14.813 -3.286 2203 HB THR 86 HB THR 86 1.930 -15.405 -5.303 2204 HG1 THR 86 1HG THR 86 2.677 -14.725 -7.112 2205 HG21 THR 86 3HG2 THR 86 1.298 -13.759 -3.551 2206 HG22 THR 86 1HG2 THR 86 0.848 -13.114 -5.170 2207 HG23 THR 86 2HG2 THR 86 2.297 -12.486 -4.318 2208 H ALA 87 H ALA 87 5.661 -15.242 -6.001 2209 HA ALA 87 HA ALA 87 5.318 -17.912 -6.537 2210 HB1 ALA 87 1HB ALA 87 7.979 -16.358 -6.477 2211 HB2 ALA 87 2HB ALA 87 6.808 -16.381 -7.846 2212 HB3 ALA 87 3HB ALA 87 7.654 -17.891 -7.383 2213 H ALA 88 H ALA 88 6.761 -16.460 -3.686 2214 HA ALA 88 HA ALA 88 7.454 -19.157 -2.658 2215 HB1 ALA 88 1HB ALA 88 9.478 -17.660 -2.702 2216 HB2 ALA 88 2HB ALA 88 8.943 -17.980 -1.012 2217 HB3 ALA 88 3HB ALA 88 8.567 -16.400 -1.798 2218 H LEU 89 H LEU 89 6.225 -15.860 -1.887 2219 HA LEU 89 HA LEU 89 5.430 -16.358 0.689 2220 HB2 LEU 89 2HB LEU 89 5.751 -14.097 -0.228 2221 HB3 LEU 89 1HB LEU 89 4.438 -14.350 -1.414 2222 HG LEU 89 HG LEU 89 2.753 -14.395 0.415 2223 HD11 LEU 89 1HD1 LEU 89 5.110 -13.737 2.303 2224 HD12 LEU 89 2HD1 LEU 89 4.139 -15.258 2.312 2225 HD13 LEU 89 3HD1 LEU 89 3.362 -13.700 2.727 2226 HD21 LEU 89 3HD2 LEU 89 4.570 -11.903 0.474 2227 HD22 LEU 89 1HD2 LEU 89 2.817 -11.975 0.876 2228 HD23 LEU 89 2HD2 LEU 89 3.359 -12.288 -0.803 2229 H ALA 90 H ALA 90 3.489 -16.705 -2.366 2230 HA ALA 90 HA ALA 90 1.146 -17.250 -0.732 2231 HB1 ALA 90 1HB ALA 90 -0.090 -17.503 -2.841 2232 HB2 ALA 90 2HB ALA 90 1.434 -17.304 -3.780 2233 HB3 ALA 90 3HB ALA 90 0.789 -15.935 -2.800 2234 H THR 91 H THR 91 3.892 -18.983 -1.562 2235 HA THR 91 HA THR 91 2.511 -21.504 -1.995 2236 HB THR 91 HB THR 91 5.486 -21.357 -1.339 2237 HG1 THR 91 1HG THR 91 5.296 -19.791 -2.822 2238 HG21 THR 91 3HG2 THR 91 4.375 -23.592 -1.734 2239 HG22 THR 91 1HG2 THR 91 5.528 -23.205 -3.056 2240 HG23 THR 91 2HG2 THR 91 3.753 -23.009 -3.323 2241 H ASP 92 H ASP 92 3.412 -19.400 0.630 2242 HA ASP 92 HA ASP 92 4.650 -21.294 2.222 2243 HB2 ASP 92 2HB ASP 92 4.304 -18.550 2.479 2244 HB3 ASP 92 1HB ASP 92 3.224 -19.152 3.780 2245 H PHE 93 H PHE 93 1.222 -20.521 1.816 2246 HA PHE 93 HA PHE 93 0.446 -22.146 4.027 2247 HB2 PHE 93 2HB PHE 93 -1.766 -21.752 3.620 2248 HB3 PHE 93 1HB PHE 93 -1.011 -20.227 3.058 2249 HD1 PHE 93 2HD PHE 93 -0.281 -20.541 0.338 2250 HD2 PHE 93 1HD PHE 93 -3.550 -22.473 2.347 2251 HE1 PHE 93 2HE PHE 93 -1.432 -20.838 -1.820 2252 HE2 PHE 93 1HE PHE 93 -4.720 -22.732 0.193 2253 HZ PHE 93 HZ PHE 93 -3.663 -21.928 -1.903 2254 H VAL 94 H VAL 94 1.660 -23.015 0.950 2255 HA VAL 94 HA VAL 94 -0.045 -25.316 0.608 2256 HB VAL 94 HB VAL 94 2.523 -24.571 -0.872 2257 HG11 VAL 94 1HG1 VAL 94 0.171 -26.467 -1.568 2258 HG12 VAL 94 2HG1 VAL 94 1.850 -26.971 -1.155 2259 HG13 VAL 94 3HG1 VAL 94 1.539 -26.047 -2.667 2260 HG21 VAL 94 3HG2 VAL 94 0.962 -23.610 -2.585 2261 HG22 VAL 94 1HG2 VAL 94 0.836 -22.709 -1.049 2262 HG23 VAL 94 2HG2 VAL 94 -0.441 -23.895 -1.489 2263 H ARG 95 H ARG 95 3.147 -24.452 2.018 2264 HA ARG 95 HA ARG 95 4.035 -27.155 2.298 2265 HB2 ARG 95 2HB ARG 95 4.763 -24.728 4.071 2266 HB3 ARG 95 1HB ARG 95 5.525 -26.351 4.151 2267 HG2 ARG 95 2HG ARG 95 6.238 -25.988 1.675 2268 HG3 ARG 95 1HG ARG 95 5.852 -24.255 2.005 2269 HD2 ARG 95 2HD ARG 95 7.334 -24.763 4.269 2270 HD3 ARG 95 1HD ARG 95 7.983 -26.112 3.283 2271 HE ARG 95 HE ARG 95 9.105 -24.524 1.908 2272 HH11 ARG 95 1HH2 ARG 95 6.954 -22.761 4.269 2273 HH12 ARG 95 2HH2 ARG 95 7.108 -21.256 3.502 2274 HH21 ARG 95 1HH1 ARG 95 9.657 -22.433 1.158 2275 HH22 ARG 95 2HH1 ARG 95 8.861 -20.997 1.774 2276 H ARG 96 H ARG 96 1.479 -25.515 3.726 2277 HA ARG 96 HA ARG 96 1.618 -26.334 6.399 2278 HB2 ARG 96 2HB ARG 96 0.116 -24.562 5.236 2279 HB3 ARG 96 1HB ARG 96 -0.876 -25.930 4.648 2280 HG2 ARG 96 2HG ARG 96 -1.224 -26.498 7.200 2281 HG3 ARG 96 1HG ARG 96 -0.428 -24.923 7.519 2282 HD2 ARG 96 2HD ARG 96 -2.849 -24.490 7.502 2283 HD3 ARG 96 1HD ARG 96 -2.205 -23.822 5.958 2284 HE ARG 96 HE ARG 96 -3.040 -25.758 4.751 2285 HH11 ARG 96 1HH2 ARG 96 -4.369 -25.464 8.096 2286 HH12 ARG 96 2HH2 ARG 96 -5.427 -26.772 7.962 2287 HH21 ARG 96 1HH1 ARG 96 -4.570 -27.594 4.531 2288 HH22 ARG 96 2HH1 ARG 96 -5.388 -28.142 5.948 2289 H GLU 97 H GLU 97 0.748 -28.032 3.404 2290 HA GLU 97 HA GLU 97 -0.605 -30.109 4.968 2291 HB2 GLU 97 2HB GLU 97 -0.693 -29.845 1.936 2292 HB3 GLU 97 1HB GLU 97 -1.731 -30.835 3.026 2293 HG2 GLU 97 2HG GLU 97 -2.189 -28.443 4.195 2294 HG3 GLU 97 1HG GLU 97 -1.663 -27.781 2.608 2295 H GLU 98 H GLU 98 0.006 -32.378 4.409 2296 HA GLU 98 HA GLU 98 1.437 -33.951 4.594 2297 HB2 GLU 98 2HB GLU 98 3.427 -32.425 2.873 2298 HB3 GLU 98 1HB GLU 98 3.630 -34.098 3.493 2299 HG2 GLU 98 2HG GLU 98 1.414 -34.723 2.336 2300 HG3 GLU 98 1HG GLU 98 1.456 -33.105 1.540 2301 H GLU 99 H GLU 99 3.438 -30.937 5.069 2302 HA GLU 99 HA GLU 99 4.931 -32.090 7.166 2303 HB2 GLU 99 2HB GLU 99 4.380 -29.092 6.772 2304 HB3 GLU 99 1HB GLU 99 5.593 -29.833 7.860 2305 HG2 GLU 99 2HG GLU 99 6.647 -30.894 5.699 2306 HG3 GLU 99 1HG GLU 99 5.621 -29.716 4.788 2307 H ARG 100 H ARG 100 1.714 -30.852 7.034 2308 HA ARG 100 HA ARG 100 1.102 -30.143 9.565 2309 HB2 ARG 100 2HB ARG 100 -0.419 -30.735 7.290 2310 HB3 ARG 100 1HB ARG 100 -0.928 -32.063 8.357 2311 HG2 ARG 100 2HG ARG 100 -1.313 -30.073 10.137 2312 HG3 ARG 100 1HG ARG 100 -1.218 -29.042 8.684 2313 HD2 ARG 100 2HD ARG 100 -3.583 -29.459 9.078 2314 HD3 ARG 100 1HD ARG 100 -3.124 -30.474 7.644 2315 HE ARG 100 HE ARG 100 -2.899 -31.802 10.304 2316 HH11 ARG 100 1HH2 ARG 100 -5.376 -30.864 7.811 2317 HH12 ARG 100 2HH2 ARG 100 -6.370 -32.187 8.091 2318 HH21 ARG 100 1HH1 ARG 100 -4.513 -33.451 10.894 2319 HH22 ARG 100 2HH1 ARG 100 -5.885 -33.719 9.910 2320 H ARG 101 H ARG 101 1.616 -33.449 8.361 2321 HA ARG 101 HA ARG 101 0.610 -34.679 10.813 2322 HB2 ARG 101 2HB ARG 101 2.157 -35.917 8.428 2323 HB3 ARG 101 1HB ARG 101 1.396 -36.820 9.788 2324 HG2 ARG 101 2HG ARG 101 -0.849 -36.046 9.031 2325 HG3 ARG 101 1HG ARG 101 -0.091 -35.160 7.654 2326 HD2 ARG 101 2HD ARG 101 0.857 -37.348 6.776 2327 HD3 ARG 101 1HD ARG 101 0.101 -38.213 8.160 2328 HE ARG 101 HE ARG 101 -1.998 -38.015 7.245 2329 HH11 ARG 101 1HH2 ARG 101 0.480 -37.258 4.840 2330 HH12 ARG 101 2HH2 ARG 101 -0.575 -36.896 3.604 2331 HH21 ARG 101 1HH1 ARG 101 -3.546 -37.504 5.486 2332 HH22 ARG 101 2HH1 ARG 101 -2.975 -37.072 3.951 2333 H GLY 102 H GLY 102 3.647 -34.091 9.014 2334 HA2 GLY 102 2HA GLY 102 5.657 -33.627 9.927 2335 HA3 GLY 102 1HA GLY 102 5.150 -34.326 11.504 2336 H HIS 103 H HIS 103 4.165 -36.391 9.081 2337 HA HIS 103 HA HIS 103 4.819 -38.318 8.265 2338 HB2 HIS 103 2HB HIS 103 7.748 -37.492 8.698 2339 HB3 HIS 103 1HB HIS 103 7.205 -38.968 7.843 2340 HD1 HIS 103 1HD HIS 103 5.510 -38.444 5.738 2341 HD2 HIS 103 2HD HIS 103 8.151 -35.377 6.932 2342 HE1 HIS 103 1HE HIS 103 5.755 -36.842 3.772 2343 HE2 HIS 103 2HE HIS 103 7.350 -35.019 4.523 2344 H1 SER 1 H SER 1 -2.678 -18.480 18.586 2345 HA SER 1 HA SER 1 -4.534 -20.599 19.039 2346 HB2 SER 1 2HB SER 1 -5.218 -18.245 18.588 2347 HB3 SER 1 1HB SER 1 -4.314 -18.253 17.046 2348 HG SER 1 1HG SER 1 -6.018 -18.822 16.185 2349 H ALA 2 H ALA 2 -4.262 -19.961 15.669 2350 HA ALA 2 HA ALA 2 -3.359 -22.668 15.230 2351 HB1 ALA 2 1HB ALA 2 -4.108 -20.456 13.215 2352 HB2 ALA 2 2HB ALA 2 -5.211 -21.741 13.811 2353 HB3 ALA 2 3HB ALA 2 -3.792 -22.193 12.803 2354 H ASP 3 H ASP 3 -1.471 -23.166 13.874 2355 HA ASP 3 HA ASP 3 0.676 -21.717 14.830 2356 HB2 ASP 3 2HB ASP 3 0.363 -24.268 13.808 2357 HB3 ASP 3 1HB ASP 3 1.223 -23.505 12.421 2358 H HIS 4 H HIS 4 -0.915 -21.630 11.700 2359 HA HIS 4 HA HIS 4 0.997 -19.945 10.434 2360 HB2 HIS 4 2HB HIS 4 -0.627 -19.539 8.653 2361 HB3 HIS 4 1HB HIS 4 -0.656 -21.268 9.086 2362 HD1 HIS 4 1HD HIS 4 -2.755 -18.075 9.591 2363 HD2 HIS 4 2HD HIS 4 -3.189 -22.254 9.910 2364 HE1 HIS 4 1HE HIS 4 -5.211 -18.556 10.017 2365 HE2 HIS 4 2HE HIS 4 -5.403 -21.093 10.306 2366 H GLU 5 H GLU 5 -1.311 -19.288 12.890 2367 HA GLU 5 HA GLU 5 -1.872 -16.557 12.060 2368 HB2 GLU 5 2HB GLU 5 -3.571 -18.257 13.028 2369 HB3 GLU 5 1HB GLU 5 -2.684 -18.148 14.582 2370 HG2 GLU 5 2HG GLU 5 -3.299 -15.750 14.785 2371 HG3 GLU 5 1HG GLU 5 -4.160 -15.812 13.200 2372 H ARG 6 H ARG 6 -0.145 -18.598 14.437 2373 HA ARG 6 HA ARG 6 0.810 -16.521 15.999 2374 HB2 ARG 6 2HB ARG 6 0.659 -19.119 16.416 2375 HB3 ARG 6 1HB ARG 6 2.301 -19.177 15.702 2376 HG2 ARG 6 2HG ARG 6 3.054 -17.509 17.470 2377 HG3 ARG 6 1HG ARG 6 1.386 -17.478 18.126 2378 HD2 ARG 6 2HD ARG 6 3.308 -19.909 18.086 2379 HD3 ARG 6 1HD ARG 6 2.839 -18.955 19.540 2380 HE ARG 6 HE ARG 6 1.294 -21.076 18.162 2381 HH11 ARG 6 1HH2 ARG 6 0.840 -18.224 20.335 2382 HH12 ARG 6 2HH2 ARG 6 -0.535 -18.860 21.115 2383 HH21 ARG 6 1HH1 ARG 6 -0.536 -21.871 19.120 2384 HH22 ARG 6 2HH1 ARG 6 -1.438 -21.025 20.297 2385 H GLU 7 H GLU 7 2.195 -18.101 13.080 2386 HA GLU 7 HA GLU 7 4.656 -16.766 13.240 2387 HB2 GLU 7 2HB GLU 7 4.151 -18.858 11.905 2388 HB3 GLU 7 1HB GLU 7 3.357 -17.836 10.660 2389 HG2 GLU 7 2HG GLU 7 5.474 -16.794 10.056 2390 HG3 GLU 7 1HG GLU 7 6.240 -17.325 11.597 2391 H ALA 8 H ALA 8 1.533 -15.859 11.804 2392 HA ALA 8 HA ALA 8 2.437 -13.558 10.442 2393 HB1 ALA 8 1HB ALA 8 0.217 -14.609 9.923 2394 HB2 ALA 8 2HB ALA 8 -0.012 -12.899 10.443 2395 HB3 ALA 8 3HB ALA 8 -0.357 -14.236 11.590 2396 H GLN 9 H GLN 9 0.986 -14.117 13.659 2397 HA GLN 9 HA GLN 9 0.887 -11.468 14.471 2398 HB2 GLN 9 2HB GLN 9 -0.345 -13.478 15.408 2399 HB3 GLN 9 1HB GLN 9 1.176 -14.004 16.202 2400 HG2 GLN 9 2HG GLN 9 1.138 -11.974 17.656 2401 HG3 GLN 9 1HG GLN 9 -0.251 -11.309 16.709 2402 HE21 GLN 9 1HE2 GLN 9 -1.795 -11.351 18.426 2403 HE22 GLN 9 2HE2 GLN 9 -2.425 -12.822 19.080 2404 H LYS 10 H LYS 10 3.493 -13.907 14.730 2405 HA LYS 10 HA LYS 10 5.060 -12.388 16.499 2406 HB2 LYS 10 2HB LYS 10 5.365 -14.847 16.183 2407 HB3 LYS 10 1HB LYS 10 5.899 -14.559 14.497 2408 HG2 LYS 10 2HG LYS 10 7.822 -15.035 15.929 2409 HG3 LYS 10 1HG LYS 10 7.912 -13.362 15.290 2410 HD2 LYS 10 2HD LYS 10 6.879 -12.621 17.612 2411 HD3 LYS 10 1HD LYS 10 7.308 -14.267 18.171 2412 HE2 LYS 10 2HE LYS 10 9.181 -12.073 17.018 2413 HE3 LYS 10 1HE LYS 10 9.103 -12.620 18.740 2414 HZ1 LYS 10 3HZ LYS 10 9.862 -14.440 16.483 2415 HZ2 LYS 10 1HZ LYS 10 10.090 -14.678 18.158 2416 HZ3 LYS 10 2HZ LYS 10 10.968 -13.511 17.344 2417 H ALA 11 H ALA 11 4.677 -12.294 12.973 2418 HA ALA 11 HA ALA 11 7.049 -10.845 12.450 2419 HB1 ALA 11 1HB ALA 11 5.759 -12.019 10.639 2420 HB2 ALA 11 2HB ALA 11 6.009 -10.276 10.263 2421 HB3 ALA 11 3HB ALA 11 4.407 -10.847 10.860 2422 H GLU 12 H GLU 12 3.773 -9.919 13.504 2423 HA GLU 12 HA GLU 12 3.983 -7.172 13.027 2424 HB2 GLU 12 2HB GLU 12 2.425 -8.537 15.312 2425 HB3 GLU 12 1HB GLU 12 2.156 -6.881 14.677 2426 HG2 GLU 12 2HG GLU 12 1.434 -7.873 12.458 2427 HG3 GLU 12 1HG GLU 12 1.688 -9.523 13.133 2428 H GLU 13 H GLU 13 5.013 -9.226 15.738 2429 HA GLU 13 HA GLU 13 5.605 -7.186 17.566 2430 HB2 GLU 13 2HB GLU 13 5.346 -9.640 18.150 2431 HB3 GLU 13 1HB GLU 13 6.902 -9.973 17.322 2432 HG2 GLU 13 2HG GLU 13 8.097 -8.517 18.993 2433 HG3 GLU 13 1HG GLU 13 6.533 -8.184 19.819 2434 H GLU 14 H GLU 14 7.540 -8.775 15.020 2435 HA GLU 14 HA GLU 14 10.010 -7.638 15.700 2436 HB2 GLU 14 2HB GLU 14 9.677 -9.619 14.125 2437 HB3 GLU 14 1HB GLU 14 9.019 -8.479 12.914 2438 HG2 GLU 14 2HG GLU 14 11.255 -8.898 12.227 2439 HG3 GLU 14 1HG GLU 14 11.315 -7.264 12.961 2440 H LEU 15 H LEU 15 7.337 -6.548 13.568 2441 HA LEU 15 HA LEU 15 8.685 -4.390 12.457 2442 HB2 LEU 15 2HB LEU 15 6.508 -5.361 11.604 2443 HB3 LEU 15 1HB LEU 15 5.660 -4.620 12.994 2444 HG LEU 15 HG LEU 15 6.249 -2.344 12.173 2445 HD11 LEU 15 1HD1 LEU 15 8.435 -2.713 11.100 2446 HD12 LEU 15 2HD1 LEU 15 7.304 -2.051 9.884 2447 HD13 LEU 15 3HD1 LEU 15 7.696 -3.806 9.871 2448 HD21 LEU 15 3HD2 LEU 15 5.003 -4.101 9.960 2449 HD22 LEU 15 1HD2 LEU 15 4.835 -2.316 10.122 2450 HD23 LEU 15 2HD2 LEU 15 4.139 -3.404 11.379 2451 H GLN 16 H GLN 16 6.836 -4.657 15.484 2452 HA GLN 16 HA GLN 16 6.693 -1.913 16.042 2453 HB2 GLN 16 2HB GLN 16 6.777 -4.327 17.941 2454 HB3 GLN 16 1HB GLN 16 6.436 -2.650 18.472 2455 HG2 GLN 16 2HG GLN 16 4.418 -2.572 16.946 2456 HG3 GLN 16 1HG GLN 16 4.707 -4.297 16.514 2457 HE21 GLN 16 1HE2 GLN 16 3.006 -2.305 18.720 2458 HE22 GLN 16 2HE2 GLN 16 2.909 -3.385 20.069 2459 H LYS 17 H LYS 17 9.305 -4.254 16.497 2460 HA LYS 17 HA LYS 17 10.812 -2.687 18.335 2461 HB2 LYS 17 2HB LYS 17 11.054 -5.174 18.061 2462 HB3 LYS 17 1HB LYS 17 11.615 -4.913 16.382 2463 HG2 LYS 17 2HG LYS 17 13.669 -3.696 17.306 2464 HG3 LYS 17 1HG LYS 17 13.057 -4.031 18.962 2465 HD2 LYS 17 2HD LYS 17 14.729 -5.727 18.450 2466 HD3 LYS 17 1HD LYS 17 13.103 -6.494 18.439 2467 HE2 LYS 17 2HE LYS 17 13.172 -6.137 15.809 2468 HE3 LYS 17 1HE LYS 17 14.930 -5.811 16.024 2469 HZ1 LYS 17 3HZ LYS 17 15.284 -8.036 16.619 2470 HZ2 LYS 17 1HZ LYS 17 13.998 -8.109 15.489 2471 HZ3 LYS 17 2HZ LYS 17 13.685 -8.255 17.161 2472 H VAL 18 H VAL 18 10.588 -2.967 14.784 2473 HA VAL 18 HA VAL 18 12.909 -1.525 14.170 2474 HB VAL 18 HB VAL 18 10.343 -1.796 12.518 2475 HG11 VAL 18 1HG1 VAL 18 11.887 -1.389 10.563 2476 HG12 VAL 18 2HG1 VAL 18 13.237 -1.040 11.706 2477 HG13 VAL 18 3HG1 VAL 18 11.795 0.041 11.646 2478 HG21 VAL 18 3HG2 VAL 18 11.284 -4.032 13.138 2479 HG22 VAL 18 1HG2 VAL 18 12.925 -3.513 12.620 2480 HG23 VAL 18 2HG2 VAL 18 11.602 -3.691 11.413 2481 H LEU 19 H LEU 19 9.534 -0.508 14.839 2482 HA LEU 19 HA LEU 19 9.743 2.179 14.173 2483 HB2 LEU 19 2HB LEU 19 8.262 1.012 16.624 2484 HB3 LEU 19 1HB LEU 19 7.971 2.623 15.903 2485 HG LEU 19 HG LEU 19 7.460 -0.055 14.468 2486 HD11 LEU 19 1HD1 LEU 19 5.470 1.869 15.840 2487 HD12 LEU 19 2HD1 LEU 19 5.961 0.250 16.460 2488 HD13 LEU 19 3HD1 LEU 19 5.052 0.387 14.908 2489 HD21 LEU 19 3HD2 LEU 19 6.099 1.415 12.916 2490 HD22 LEU 19 1HD2 LEU 19 7.862 1.782 12.847 2491 HD23 LEU 19 2HD2 LEU 19 6.744 2.864 13.756 2492 H GLU 20 H GLU 20 10.668 0.461 17.154 2493 HA GLU 20 HA GLU 20 11.101 2.821 18.653 2494 HB2 GLU 20 2HB GLU 20 11.816 -0.120 19.149 2495 HB3 GLU 20 1HB GLU 20 12.023 1.188 20.368 2496 HG2 GLU 20 2HG GLU 20 9.639 1.725 20.336 2497 HG3 GLU 20 1HG GLU 20 9.329 0.637 18.947 2498 H GLU 21 H GLU 21 13.276 0.531 16.920 2499 HA GLU 21 HA GLU 21 15.641 1.975 17.514 2500 HB2 GLU 21 2HB GLU 21 15.779 -0.345 16.764 2501 HB3 GLU 21 1HB GLU 21 14.937 0.059 15.229 2502 HG2 GLU 21 2HG GLU 21 17.321 -0.325 14.831 2503 HG3 GLU 21 1HG GLU 21 16.916 1.391 14.478 2504 H ALA 22 H ALA 22 13.230 2.183 14.863 2505 HA ALA 22 HA ALA 22 14.558 3.933 13.213 2506 HB1 ALA 22 1HB ALA 22 12.320 4.553 12.285 2507 HB2 ALA 22 2HB ALA 22 11.518 3.802 13.711 2508 HB3 ALA 22 3HB ALA 22 12.427 2.775 12.554 2509 H SER 23 H SER 23 12.729 4.586 16.158 2510 HA SER 23 HA SER 23 12.396 7.362 15.705 2511 HB2 SER 23 2HB SER 23 12.483 5.818 18.382 2512 HB3 SER 23 1HB SER 23 11.748 7.443 18.093 2513 HG SER 23 1HG SER 23 10.950 4.899 17.027 2514 H LYS 24 H LYS 24 14.827 5.380 17.394 2515 HA LYS 24 HA LYS 24 16.389 7.559 18.338 2516 HB2 LYS 24 2HB LYS 24 16.590 5.550 19.576 2517 HB3 LYS 24 1HB LYS 24 16.712 4.528 18.116 2518 HG2 LYS 24 2HG LYS 24 18.972 6.498 18.517 2519 HG3 LYS 24 1HG LYS 24 18.836 5.187 19.735 2520 HD2 LYS 24 2HD LYS 24 19.317 3.471 18.240 2521 HD3 LYS 24 1HD LYS 24 18.529 4.278 16.872 2522 HE2 LYS 24 2HE LYS 24 20.998 4.049 16.549 2523 HE3 LYS 24 1HE LYS 24 20.419 5.762 16.449 2524 HZ1 LYS 24 3HZ LYS 24 21.332 4.845 19.072 2525 HZ2 LYS 24 1HZ LYS 24 21.510 6.347 18.270 2526 HZ3 LYS 24 2HZ LYS 24 22.502 5.036 17.848 2527 H LYS 25 H LYS 25 16.511 5.367 15.493 2528 HA LYS 25 HA LYS 25 18.859 6.446 14.415 2529 HB2 LYS 25 2HB LYS 25 16.508 4.932 13.199 2530 HB3 LYS 25 1HB LYS 25 17.822 5.548 12.147 2531 HG2 LYS 25 2HG LYS 25 18.587 3.880 14.571 2532 HG3 LYS 25 1HG LYS 25 17.891 3.064 13.134 2533 HD2 LYS 25 2HD LYS 25 19.624 3.845 11.659 2534 HD3 LYS 25 1HD LYS 25 20.249 5.023 12.855 2535 HE2 LYS 25 2HE LYS 25 21.702 2.943 12.511 2536 HE3 LYS 25 1HE LYS 25 21.258 3.302 14.224 2537 HZ1 LYS 25 3HZ LYS 25 19.754 1.599 14.295 2538 HZ2 LYS 25 1HZ LYS 25 21.122 0.950 13.513 2539 HZ3 LYS 25 2HZ LYS 25 19.728 1.327 12.587 2540 H ALA 26 H ALA 26 15.386 7.323 13.739 2541 HA ALA 26 HA ALA 26 15.946 9.115 11.726 2542 HB1 ALA 26 1HB ALA 26 13.720 10.143 12.234 2543 HB2 ALA 26 2HB ALA 26 13.677 9.285 13.824 2544 HB3 ALA 26 3HB ALA 26 13.626 8.350 12.291 2545 H VAL 27 H VAL 27 15.559 9.761 15.277 2546 HA VAL 27 HA VAL 27 16.050 12.505 14.873 2547 HB VAL 27 HB VAL 27 14.751 11.592 16.764 2548 HG11 VAL 27 1HG1 VAL 27 15.844 10.742 18.772 2549 HG12 VAL 27 2HG1 VAL 27 17.485 10.936 18.051 2550 HG13 VAL 27 3HG1 VAL 27 16.348 9.712 17.391 2551 HG21 VAL 27 3HG2 VAL 27 17.106 13.469 17.462 2552 HG22 VAL 27 1HG2 VAL 27 15.551 13.318 18.360 2553 HG23 VAL 27 2HG2 VAL 27 15.562 13.940 16.662 2554 H GLU 28 H GLU 28 18.257 9.741 15.646 2555 HA GLU 28 HA GLU 28 20.378 11.561 16.195 2556 HB2 GLU 28 2HB GLU 28 20.094 9.280 17.172 2557 HB3 GLU 28 1HB GLU 28 20.573 8.561 15.603 2558 HG2 GLU 28 2HG GLU 28 22.837 9.457 15.799 2559 HG3 GLU 28 1HG GLU 28 22.354 10.583 17.119 2560 H ALA 29 H ALA 29 19.159 9.953 13.293 2561 HA ALA 29 HA ALA 29 21.497 10.400 11.759 2562 HB1 ALA 29 1HB ALA 29 18.618 9.788 10.856 2563 HB2 ALA 29 2HB ALA 29 19.861 8.551 11.285 2564 HB3 ALA 29 3HB ALA 29 20.123 9.609 9.881 2565 H GLU 30 H GLU 30 18.274 12.098 12.071 2566 HA GLU 30 HA GLU 30 19.044 13.986 10.104 2567 HB2 GLU 30 2HB GLU 30 17.003 15.132 10.552 2568 HB3 GLU 30 1HB GLU 30 16.684 13.376 10.630 2569 HG2 GLU 30 2HG GLU 30 15.597 13.907 12.576 2570 HG3 GLU 30 1HG GLU 30 17.224 13.812 13.299 2571 H ARG 31 H ARG 31 19.676 13.711 13.553 2572 HA ARG 31 HA ARG 31 20.045 16.432 14.021 2573 HB2 ARG 31 2HB ARG 31 20.992 13.945 15.471 2574 HB3 ARG 31 1HB ARG 31 21.676 15.526 15.961 2575 HG2 ARG 31 2HG ARG 31 18.654 14.993 15.904 2576 HG3 ARG 31 1HG ARG 31 19.747 14.763 17.327 2577 HD2 ARG 31 2HD ARG 31 20.428 17.292 16.814 2578 HD3 ARG 31 1HD ARG 31 18.867 17.346 15.876 2579 HE ARG 31 HE ARG 31 17.942 16.265 18.139 2580 HH11 ARG 31 1HH2 ARG 31 20.214 19.033 17.706 2581 HH12 ARG 31 2HH2 ARG 31 20.002 19.709 19.232 2582 HH21 ARG 31 1HH1 ARG 31 17.610 17.194 20.352 2583 HH22 ARG 31 2HH1 ARG 31 18.501 18.564 20.847 2584 H GLY 32 H GLY 32 21.253 17.504 12.592 2585 HA2 GLY 32 2HA GLY 32 23.459 18.501 12.688 2586 HA3 GLY 32 1HA GLY 32 24.127 16.834 12.450 2587 H ALA 33 H ALA 33 21.243 16.823 10.779 2588 HA ALA 33 HA ALA 33 22.689 17.072 8.323 2589 HB1 ALA 33 1HB ALA 33 19.748 16.359 8.839 2590 HB2 ALA 33 2HB ALA 33 21.091 15.181 8.631 2591 HB3 ALA 33 3HB ALA 33 20.594 16.232 7.251 2592 HA PRO 34 HA PRO 34 21.270 21.187 7.828 2593 HB2 PRO 34 2HB PRO 34 21.603 21.666 5.093 2594 HB3 PRO 34 1HB PRO 34 22.976 21.425 6.237 2595 HG2 PRO 34 2HG PRO 34 21.677 19.316 4.423 2596 HG3 PRO 34 1HG PRO 34 23.443 19.678 4.630 2597 HD2 PRO 34 2HD PRO 34 22.175 17.626 5.996 2598 HD3 PRO 34 1HD PRO 34 23.473 18.622 6.800 2599 H GLY 35 H GLY 35 19.255 22.207 7.795 2600 HA2 GLY 35 2HA GLY 35 17.285 22.831 6.880 2601 HA3 GLY 35 1HA GLY 35 17.372 21.479 5.688 2602 H ALA 36 H ALA 36 18.197 20.314 8.697 2603 HA ALA 36 HA ALA 36 16.161 18.527 8.838 2604 HB1 ALA 36 1HB ALA 36 18.356 18.168 9.940 2605 HB2 ALA 36 2HB ALA 36 17.079 18.064 11.178 2606 HB3 ALA 36 3HB ALA 36 18.052 19.559 11.045 2607 H ALA 37 H ALA 37 14.227 18.317 9.965 2608 HA ALA 37 HA ALA 37 13.342 20.588 11.601 2609 HB1 ALA 37 1HB ALA 37 11.776 19.390 9.216 2610 HB2 ALA 37 2HB ALA 37 12.513 21.033 9.251 2611 HB3 ALA 37 3HB ALA 37 11.159 20.636 10.364 2612 H LEU 38 H LEU 38 14.005 17.341 11.603 2613 HA LEU 38 HA LEU 38 11.387 16.506 12.554 2614 HB2 LEU 38 2HB LEU 38 12.594 15.056 10.987 2615 HB3 LEU 38 1HB LEU 38 13.944 14.910 12.125 2616 HG LEU 38 HG LEU 38 11.088 14.079 12.904 2617 HD11 LEU 38 1HD1 LEU 38 11.587 11.766 12.078 2618 HD12 LEU 38 2HD1 LEU 38 13.132 12.355 11.363 2619 HD13 LEU 38 3HD1 LEU 38 11.558 12.963 10.739 2620 HD21 LEU 38 3HD2 LEU 38 13.865 13.060 13.817 2621 HD22 LEU 38 1HD2 LEU 38 12.283 12.388 14.346 2622 HD23 LEU 38 2HD2 LEU 38 12.734 14.069 14.794 2623 H ILE 39 H ILE 39 14.740 17.115 13.442 2624 HA ILE 39 HA ILE 39 15.569 16.856 15.592 2625 HB ILE 39 HB ILE 39 16.412 18.605 14.358 2626 HG12 ILE 39 2HG1 ILE 39 15.738 19.876 17.082 2627 HG13 ILE 39 1HG1 ILE 39 16.911 18.539 16.845 2628 HG21 ILE 39 1HG2 ILE 39 15.378 20.896 14.251 2629 HG22 ILE 39 2HG2 ILE 39 13.925 20.277 15.113 2630 HG23 ILE 39 3HG2 ILE 39 14.375 19.627 13.495 2631 HD11 ILE 39 3HD ILE 39 17.096 21.336 15.542 2632 HD12 ILE 39 1HD ILE 39 18.098 20.722 16.904 2633 HD13 ILE 39 2HD ILE 39 18.246 19.977 15.267 2634 H SER 40 H SER 40 14.427 15.760 17.177 2635 HA SER 40 HA SER 40 13.259 17.433 19.156 2636 HB2 SER 40 2HB SER 40 10.951 16.353 19.109 2637 HB3 SER 40 1HB SER 40 11.288 17.372 17.690 2638 HG SER 40 1HG SER 40 11.593 15.695 16.421 2639 H TYR 41 H TYR 41 11.668 14.682 19.443 2640 HA TYR 41 HA TYR 41 13.201 12.620 19.835 2641 HB2 TYR 41 2HB TYR 41 14.080 14.338 21.961 2642 HB3 TYR 41 1HB TYR 41 12.969 13.174 22.760 2643 HD1 TYR 41 2HD TYR 41 13.357 10.690 22.465 2644 HD2 TYR 41 1HD TYR 41 16.199 13.612 21.102 2645 HE1 TYR 41 2HE TYR 41 15.069 8.940 22.316 2646 HE2 TYR 41 1HE TYR 41 17.926 11.870 20.939 2647 HH TYR 41 HH TYR 41 18.302 9.584 20.934 2648 HA PRO 42 HA PRO 42 9.341 11.716 22.202 2649 HB2 PRO 42 2HB PRO 42 7.417 13.641 22.956 2650 HB3 PRO 42 1HB PRO 42 8.847 13.220 23.977 2651 HG2 PRO 42 2HG PRO 42 8.577 15.533 21.971 2652 HG3 PRO 42 1HG PRO 42 9.158 15.617 23.683 2653 HD2 PRO 42 2HD PRO 42 10.930 15.468 21.594 2654 HD3 PRO 42 1HD PRO 42 11.240 14.525 23.120 2655 H ASP 43 H ASP 43 9.268 14.077 19.698 2656 HA ASP 43 HA ASP 43 6.704 13.185 18.651 2657 HB2 ASP 43 2HB ASP 43 8.652 15.353 17.648 2658 HB3 ASP 43 1HB ASP 43 7.021 15.008 16.974 2659 H ALA 44 H ALA 44 10.030 12.338 18.511 2660 HA ALA 44 HA ALA 44 10.298 11.960 15.707 2661 HB1 ALA 44 1HB ALA 44 11.912 10.684 18.014 2662 HB2 ALA 44 2HB ALA 44 12.315 12.237 17.187 2663 HB3 ALA 44 3HB ALA 44 12.379 10.687 16.275 2664 H ILE 45 H ILE 45 9.117 10.090 18.393 2665 HA ILE 45 HA ILE 45 9.032 7.613 16.986 2666 HB ILE 45 HB ILE 45 9.616 7.575 19.266 2667 HG12 ILE 45 2HG1 ILE 45 6.725 6.545 19.189 2668 HG13 ILE 45 1HG1 ILE 45 8.134 5.727 18.439 2669 HG21 ILE 45 1HG2 ILE 45 7.092 9.264 19.749 2670 HG22 ILE 45 2HG2 ILE 45 8.811 9.712 20.068 2671 HG23 ILE 45 3HG2 ILE 45 8.024 8.468 21.068 2672 HD11 ILE 45 3HD ILE 45 7.796 6.340 21.457 2673 HD12 ILE 45 1HD ILE 45 7.694 4.732 20.657 2674 HD13 ILE 45 2HD ILE 45 9.263 5.614 20.704 2675 H TRP 46 H TRP 46 7.176 10.447 16.776 2676 HA TRP 46 HA TRP 46 4.639 9.051 16.433 2677 HB2 TRP 46 2HB TRP 46 5.040 11.625 17.217 2678 HB3 TRP 46 1HB TRP 46 5.041 11.923 15.454 2679 HD1 TRP 46 HD TRP 46 2.692 11.487 18.364 2680 HE1 TRP 46 1HE TRP 46 0.310 11.349 17.509 2681 HE3 TRP 46 3HE TRP 46 3.537 11.008 13.346 2682 HZ2 TRP 46 2HZ TRP 46 -1.018 10.202 15.242 2683 HZ3 TRP 46 3HZ TRP 46 1.645 10.481 11.872 2684 HH2 TRP 46 HH TRP 46 -0.602 10.049 12.800 2685 H TRP 47 H TRP 47 7.105 10.846 14.601 2686 HA TRP 47 HA TRP 47 6.242 10.485 12.031 2687 HB2 TRP 47 2HB TRP 47 8.119 11.980 12.680 2688 HB3 TRP 47 1HB TRP 47 9.107 10.558 13.169 2689 HD1 TRP 47 HD TRP 47 7.678 12.182 9.873 2690 HE1 TRP 47 1HE TRP 47 8.802 11.050 7.943 2691 HE3 TRP 47 3HE TRP 47 10.538 8.823 12.420 2692 HZ2 TRP 47 2HZ TRP 47 11.011 9.259 7.463 2693 HZ3 TRP 47 3HZ TRP 47 12.039 7.318 11.150 2694 HH2 TRP 47 HH TRP 47 12.295 7.558 8.708 2695 H SER 48 H SER 48 8.174 8.162 14.084 2696 HA SER 48 HA SER 48 8.690 6.492 11.873 2697 HB2 SER 48 2HB SER 48 9.335 4.783 13.670 2698 HB3 SER 48 1HB SER 48 10.203 6.364 13.727 2699 HG SER 48 1HG SER 48 9.530 5.926 15.785 2700 H VAL 49 H VAL 49 5.910 6.776 14.058 2701 HA VAL 49 HA VAL 49 4.884 4.182 13.534 2702 HB VAL 49 HB VAL 49 3.613 6.706 14.666 2703 HG11 VAL 49 1HG1 VAL 49 1.708 5.195 15.379 2704 HG12 VAL 49 2HG1 VAL 49 2.378 3.878 14.354 2705 HG13 VAL 49 3HG1 VAL 49 1.774 5.401 13.597 2706 HG21 VAL 49 3HG2 VAL 49 5.436 5.443 15.991 2707 HG22 VAL 49 1HG2 VAL 49 4.395 3.981 15.925 2708 HG23 VAL 49 2HG2 VAL 49 3.825 5.452 16.797 2709 H GLU 50 H GLU 50 4.290 7.455 12.053 2710 HA GLU 50 HA GLU 50 2.358 6.364 10.269 2711 HB2 GLU 50 2HB GLU 50 2.707 8.544 8.946 2712 HB3 GLU 50 1HB GLU 50 2.057 8.686 10.597 2713 HG2 GLU 50 2HG GLU 50 4.118 9.538 11.503 2714 HG3 GLU 50 1HG GLU 50 5.046 8.954 10.077 2715 H THR 51 H THR 51 5.712 5.953 10.324 2716 HA THR 51 HA THR 51 6.124 6.011 7.478 2717 HB THR 51 HB THR 51 7.924 5.126 9.802 2718 HG1 THR 51 1HG THR 51 7.421 7.431 9.652 2719 HG21 THR 51 3HG2 THR 51 8.604 5.637 6.829 2720 HG22 THR 51 1HG2 THR 51 8.692 4.040 7.669 2721 HG23 THR 51 2HG2 THR 51 9.802 5.369 8.144 2722 H ALA 52 H ALA 52 5.931 3.432 10.037 2723 HA ALA 52 HA ALA 52 6.852 1.438 8.241 2724 HB1 ALA 52 1HB ALA 52 6.185 -0.206 10.008 2725 HB2 ALA 52 2HB ALA 52 5.311 1.104 10.884 2726 HB3 ALA 52 3HB ALA 52 7.109 1.168 10.705 2727 H THR 53 H THR 53 3.672 2.825 8.752 2728 HA THR 53 HA THR 53 2.307 0.580 7.574 2729 HB THR 53 HB THR 53 0.375 2.335 7.766 2730 HG1 THR 53 1HG THR 53 1.580 4.199 8.048 2731 HG21 THR 53 3HG2 THR 53 0.756 0.414 9.346 2732 HG22 THR 53 1HG2 THR 53 0.209 1.887 10.228 2733 HG23 THR 53 2HG2 THR 53 1.942 1.404 10.282 2734 H THR 54 H THR 54 4.376 2.838 6.292 2735 HA THR 54 HA THR 54 4.658 3.942 4.487 2736 HB THR 54 HB THR 54 3.792 3.017 2.265 2737 HG1 THR 54 1HG THR 54 2.093 1.850 3.477 2738 HG21 THR 54 3HG2 THR 54 5.438 1.146 2.403 2739 HG22 THR 54 1HG2 THR 54 5.412 1.211 4.207 2740 HG23 THR 54 2HG2 THR 54 6.066 2.602 3.255 2741 H VAL 55 H VAL 55 3.476 5.688 5.629 2742 HA VAL 55 HA VAL 55 1.201 6.550 4.014 2743 HB VAL 55 HB VAL 55 1.375 6.651 7.105 2744 HG11 VAL 55 1HG1 VAL 55 -0.983 7.518 6.924 2745 HG12 VAL 55 2HG1 VAL 55 -0.853 7.476 5.126 2746 HG13 VAL 55 3HG1 VAL 55 0.152 8.628 6.080 2747 HG21 VAL 55 3HG2 VAL 55 -0.344 4.953 5.201 2748 HG22 VAL 55 1HG2 VAL 55 -0.561 5.052 6.990 2749 HG23 VAL 55 2HG2 VAL 55 0.921 4.338 6.303 2750 H GLY 56 H GLY 56 2.477 8.084 6.932 2751 HA2 GLY 56 2HA GLY 56 3.832 9.860 7.181 2752 HA3 GLY 56 1HA GLY 56 4.242 9.811 5.420 2753 H TYR 57 H TYR 57 2.180 11.271 7.885 2754 HA TYR 57 HA TYR 57 0.264 12.289 5.938 2755 HB2 TYR 57 2HB TYR 57 0.937 13.155 8.839 2756 HB3 TYR 57 1HB TYR 57 -0.324 13.952 7.826 2757 HD1 TYR 57 2HD TYR 57 -2.390 12.717 7.171 2758 HD2 TYR 57 1HD TYR 57 0.489 11.045 9.889 2759 HE1 TYR 57 2HE TYR 57 -4.096 11.147 8.012 2760 HE2 TYR 57 1HE TYR 57 -1.193 9.463 10.710 2761 HH TYR 57 HH TYR 57 -4.571 9.443 9.544 2762 H GLY 58 H GLY 58 3.345 13.118 7.427 2763 HA2 GLY 58 2HA GLY 58 4.896 14.364 6.266 2764 HA3 GLY 58 1HA GLY 58 3.595 15.270 5.412 2765 H ASP 59 H ASP 59 3.903 14.551 8.943 2766 HA ASP 59 HA ASP 59 3.833 17.380 9.516 2767 HB2 ASP 59 2HB ASP 59 2.928 15.859 11.292 2768 HB3 ASP 59 1HB ASP 59 4.580 15.179 11.536 2769 H ARG 60 H ARG 60 6.281 14.689 9.459 2770 HA ARG 60 HA ARG 60 8.319 16.768 9.234 2771 HB2 ARG 60 2HB ARG 60 8.738 14.311 11.024 2772 HB3 ARG 60 1HB ARG 60 9.794 15.761 10.819 2773 HG2 ARG 60 2HG ARG 60 7.670 17.122 11.578 2774 HG3 ARG 60 1HG ARG 60 7.016 15.539 12.139 2775 HD2 ARG 60 2HD ARG 60 8.949 15.404 13.794 2776 HD3 ARG 60 1HD ARG 60 9.520 17.027 13.160 2777 HE ARG 60 HE ARG 60 6.671 17.062 13.812 2778 HH11 ARG 60 1HH2 ARG 60 10.010 17.334 15.217 2779 HH12 ARG 60 2HH2 ARG 60 9.521 18.326 16.510 2780 HH21 ARG 60 1HH1 ARG 60 6.068 18.373 15.709 2781 HH22 ARG 60 2HH1 ARG 60 7.002 18.042 17.114 2782 H TYR 61 H TYR 61 10.402 15.728 8.208 2783 HA TYR 61 HA TYR 61 9.734 13.375 6.813 2784 HB2 TYR 61 2HB TYR 61 10.398 14.406 4.519 2785 HB3 TYR 61 1HB TYR 61 8.734 14.702 5.118 2786 HD1 TYR 61 1HD TYR 61 8.098 16.880 6.076 2787 HD2 TYR 61 2HD TYR 61 11.926 16.299 4.198 2788 HE1 TYR 61 1HE TYR 61 8.299 19.299 5.747 2789 HE2 TYR 61 2HE TYR 61 12.094 18.727 3.792 2790 HH TYR 61 HH TYR 61 9.287 20.845 4.355 2791 HA PRO 62 HA PRO 62 13.997 13.152 7.586 2792 HB2 PRO 62 2HB PRO 62 14.779 11.346 5.477 2793 HB3 PRO 62 1HB PRO 62 14.035 10.907 7.047 2794 HG2 PRO 62 2HG PRO 62 12.689 11.163 4.339 2795 HG3 PRO 62 1HG PRO 62 12.380 9.981 5.663 2796 HD2 PRO 62 2HD PRO 62 10.791 12.199 5.235 2797 HD3 PRO 62 1HD PRO 62 11.113 11.554 6.910 2798 H VAL 63 H VAL 63 16.212 13.379 6.634 2799 HA VAL 63 HA VAL 63 16.174 15.574 4.653 2800 HB VAL 63 HB VAL 63 18.583 14.999 6.421 2801 HG11 VAL 63 1HG1 VAL 63 18.604 16.897 4.666 2802 HG12 VAL 63 2HG1 VAL 63 18.705 17.513 6.349 2803 HG13 VAL 63 3HG1 VAL 63 17.150 17.591 5.460 2804 HG21 VAL 63 3HG2 VAL 63 16.789 14.810 8.072 2805 HG22 VAL 63 1HG2 VAL 63 15.942 16.255 7.397 2806 HG23 VAL 63 2HG2 VAL 63 17.530 16.428 8.224 2807 H THR 64 H THR 64 19.171 15.205 4.315 2808 HA THR 64 HA THR 64 19.122 13.027 2.399 2809 HB THR 64 HB THR 64 21.236 14.443 1.638 2810 HG1 THR 64 1HG THR 64 20.993 16.629 2.303 2811 HG21 THR 64 3HG2 THR 64 19.036 14.317 0.411 2812 HG22 THR 64 1HG2 THR 64 19.698 15.981 0.367 2813 HG23 THR 64 2HG2 THR 64 18.342 15.583 1.487 2814 H GLU 65 H GLU 65 21.332 14.693 4.648 2815 HA GLU 65 HA GLU 65 23.179 12.572 4.588 2816 HB2 GLU 65 2HB GLU 65 23.630 15.065 4.668 2817 HB3 GLU 65 1HB GLU 65 23.280 15.025 6.428 2818 HG2 GLU 65 2HG GLU 65 25.225 13.620 6.862 2819 HG3 GLU 65 1HG GLU 65 25.401 13.193 5.122 2820 H GLU 66 H GLU 66 20.311 12.728 6.264 2821 HA GLU 66 HA GLU 66 21.108 11.446 8.657 2822 HB2 GLU 66 2HB GLU 66 18.752 10.537 8.612 2823 HB3 GLU 66 1HB GLU 66 18.831 12.317 8.536 2824 HG2 GLU 66 2HG GLU 66 18.273 12.348 6.164 2825 HG3 GLU 66 1HG GLU 66 18.524 10.566 5.996 2826 H GLY 67 H GLY 67 20.730 10.561 5.311 2827 HA2 GLY 67 2HA GLY 67 21.495 8.665 4.278 2828 HA3 GLY 67 1HA GLY 67 21.548 7.796 5.884 2829 H ARG 68 H ARG 68 19.393 9.271 3.412 2830 HA ARG 68 HA ARG 68 17.016 8.965 4.750 2831 HB2 ARG 68 2HB ARG 68 17.565 10.294 2.617 2832 HB3 ARG 68 1HB ARG 68 17.403 8.759 1.696 2833 HG2 ARG 68 2HG ARG 68 14.981 8.631 2.521 2834 HG3 ARG 68 1HG ARG 68 15.269 10.157 3.423 2835 HD2 ARG 68 2HD ARG 68 15.879 11.231 1.092 2836 HD3 ARG 68 1HD ARG 68 15.229 9.720 0.346 2837 HE ARG 68 HE ARG 68 13.060 10.481 0.816 2838 HH11 ARG 68 1HH2 ARG 68 15.347 12.490 2.856 2839 HH12 ARG 68 2HH2 ARG 68 14.150 13.598 3.247 2840 HH21 ARG 68 1HH1 ARG 68 11.536 11.927 1.380 2841 HH22 ARG 68 2HH1 ARG 68 11.858 13.303 2.398 2842 H LYS 69 H LYS 69 19.034 6.545 3.548 2843 HA LYS 69 HA LYS 69 17.199 4.489 3.062 2844 HB2 LYS 69 2HB LYS 69 20.111 4.354 3.988 2845 HB3 LYS 69 1HB LYS 69 19.081 2.917 3.659 2846 HG2 LYS 69 2HG LYS 69 18.594 3.833 1.363 2847 HG3 LYS 69 1HG LYS 69 19.891 5.048 1.583 2848 HD2 LYS 69 2HD LYS 69 21.606 3.358 1.684 2849 HD3 LYS 69 1HD LYS 69 20.439 2.048 2.049 2850 HE2 LYS 69 2HE LYS 69 20.601 3.511 -0.678 2851 HE3 LYS 69 1HE LYS 69 21.360 1.916 -0.295 2852 HZ1 LYS 69 3HZ LYS 69 18.418 2.521 -0.261 2853 HZ2 LYS 69 1HZ LYS 69 19.060 1.110 0.244 2854 HZ3 LYS 69 2HZ LYS 69 19.276 1.563 -1.380 2855 H VAL 70 H VAL 70 17.955 6.166 6.039 2856 HA VAL 70 HA VAL 70 17.349 4.099 7.845 2857 HB VAL 70 HB VAL 70 17.083 7.146 7.963 2858 HG11 VAL 70 1HG1 VAL 70 16.728 6.865 10.450 2859 HG12 VAL 70 2HG1 VAL 70 16.473 5.092 10.205 2860 HG13 VAL 70 3HG1 VAL 70 15.330 6.296 9.493 2861 HG21 VAL 70 3HG2 VAL 70 19.412 6.120 7.928 2862 HG22 VAL 70 1HG2 VAL 70 18.981 5.129 9.370 2863 HG23 VAL 70 2HG2 VAL 70 19.040 6.930 9.481 2864 H ALA 71 H ALA 71 15.288 6.600 6.240 2865 HA ALA 71 HA ALA 71 12.880 5.616 7.276 2866 HB1 ALA 71 1HB ALA 71 11.769 6.936 5.461 2867 HB2 ALA 71 2HB ALA 71 13.360 7.137 4.629 2868 HB3 ALA 71 3HB ALA 71 13.080 7.894 6.238 2869 H GLU 72 H GLU 72 14.633 4.944 4.253 2870 HA GLU 72 HA GLU 72 12.897 3.367 2.862 2871 HB2 GLU 72 2HB GLU 72 15.216 4.022 2.076 2872 HB3 GLU 72 1HB GLU 72 15.904 2.859 3.253 2873 HG2 GLU 72 2HG GLU 72 14.823 0.950 1.993 2874 HG3 GLU 72 1HG GLU 72 14.284 2.131 0.742 2875 H GLN 73 H GLN 73 15.187 2.279 5.408 2876 HA GLN 73 HA GLN 73 14.623 -0.432 5.128 2877 HB2 GLN 73 2HB GLN 73 16.667 0.569 6.277 2878 HB3 GLN 73 1HB GLN 73 15.623 0.993 7.671 2879 HG2 GLN 73 2HG GLN 73 15.128 -1.465 8.027 2880 HG3 GLN 73 1HG GLN 73 16.133 -1.868 6.587 2881 HE21 GLN 73 1HE2 GLN 73 17.208 -3.249 8.393 2882 HE22 GLN 73 2HE2 GLN 73 18.481 -2.509 9.289 2883 H VAL 74 H VAL 74 13.121 2.080 7.183 2884 HA VAL 74 HA VAL 74 11.703 0.256 8.814 2885 HB VAL 74 HB VAL 74 11.181 3.216 8.213 2886 HG11 VAL 74 1HG1 VAL 74 10.186 1.402 10.532 2887 HG12 VAL 74 2HG1 VAL 74 9.162 2.154 9.255 2888 HG13 VAL 74 3HG1 VAL 74 9.998 3.194 10.452 2889 HG21 VAL 74 3HG2 VAL 74 13.512 2.682 9.130 2890 HG22 VAL 74 1HG2 VAL 74 12.743 1.861 10.522 2891 HG23 VAL 74 2HG2 VAL 74 12.507 3.632 10.256 2892 H MET 75 H MET 75 10.894 2.113 5.858 2893 HA MET 75 HA MET 75 8.180 1.347 5.816 2894 HB2 MET 75 2HB MET 75 10.055 2.221 3.544 2895 HB3 MET 75 1HB MET 75 8.265 2.081 3.402 2896 HG2 MET 75 2HG MET 75 7.974 3.697 5.273 2897 HG3 MET 75 1HG MET 75 9.736 3.904 5.415 2898 HE1 MET 75 3HE MET 75 11.291 5.034 3.485 2899 HE2 MET 75 1HE MET 75 10.632 5.713 1.966 2900 HE3 MET 75 2HE MET 75 10.626 3.938 2.220 2901 H LYS 76 H LYS 76 11.127 -0.047 4.301 2902 HA LYS 76 HA LYS 76 9.723 -1.954 2.809 2903 HB2 LYS 76 2HB LYS 76 12.146 -1.140 2.523 2904 HB3 LYS 76 1HB LYS 76 12.617 -2.307 3.793 2905 HG2 LYS 76 2HG LYS 76 10.958 -3.336 1.440 2906 HG3 LYS 76 1HG LYS 76 12.613 -2.756 1.066 2907 HD2 LYS 76 2HD LYS 76 13.608 -4.355 2.665 2908 HD3 LYS 76 1HD LYS 76 11.974 -4.944 3.131 2909 HE2 LYS 76 2HE LYS 76 11.574 -5.820 0.837 2910 HE3 LYS 76 1HE LYS 76 13.157 -5.155 0.263 2911 HZ1 LYS 76 3HZ LYS 76 12.912 -7.144 2.466 2912 HZ2 LYS 76 1HZ LYS 76 14.322 -6.701 1.584 2913 HZ3 LYS 76 2HZ LYS 76 13.109 -7.590 0.823 2914 H ALA 77 H ALA 77 10.957 -1.982 6.154 2915 HA ALA 77 HA ALA 77 10.579 -4.705 6.658 2916 HB1 ALA 77 1HB ALA 77 11.835 -3.197 8.234 2917 HB2 ALA 77 2HB ALA 77 10.510 -4.075 9.080 2918 HB3 ALA 77 3HB ALA 77 10.299 -2.341 8.627 2919 H GLY 78 H GLY 78 8.360 -1.907 6.852 2920 HA2 GLY 78 2HA GLY 78 6.200 -3.261 8.028 2921 HA3 GLY 78 1HA GLY 78 6.169 -1.759 7.026 2922 H ILE 79 H ILE 79 7.000 -2.578 4.593 2923 HA ILE 79 HA ILE 79 4.735 -3.719 3.486 2924 HB ILE 79 HB ILE 79 7.565 -3.473 2.363 2925 HG12 ILE 79 2HG1 ILE 79 5.025 -1.764 1.916 2926 HG13 ILE 79 1HG1 ILE 79 6.338 -1.324 3.036 2927 HG21 ILE 79 1HG2 ILE 79 6.494 -3.752 0.084 2928 HG22 ILE 79 2HG2 ILE 79 4.920 -4.112 0.879 2929 HG23 ILE 79 3HG2 ILE 79 6.318 -5.232 1.065 2930 HD11 ILE 79 3HD ILE 79 6.598 -1.607 -0.029 2931 HD12 ILE 79 1HD ILE 79 6.623 -0.097 0.934 2932 HD13 ILE 79 2HD ILE 79 7.973 -1.281 1.099 2933 H GLU 80 H GLU 80 7.926 -5.275 4.269 2934 HA GLU 80 HA GLU 80 7.136 -7.765 3.218 2935 HB2 GLU 80 2HB GLU 80 9.199 -7.208 5.429 2936 HB3 GLU 80 1HB GLU 80 8.904 -8.807 4.656 2937 HG2 GLU 80 2HG GLU 80 9.445 -7.724 2.387 2938 HG3 GLU 80 1HG GLU 80 10.011 -6.276 3.303 2939 H VAL 81 H VAL 81 6.812 -6.402 6.550 2940 HA VAL 81 HA VAL 81 5.916 -8.834 7.661 2941 HB VAL 81 HB VAL 81 5.729 -5.922 8.518 2942 HG11 VAL 81 1HG1 VAL 81 4.997 -6.819 10.799 2943 HG12 VAL 81 2HG1 VAL 81 4.652 -8.405 10.023 2944 HG13 VAL 81 3HG1 VAL 81 3.726 -6.938 9.536 2945 HG21 VAL 81 3HG2 VAL 81 7.440 -6.697 10.177 2946 HG22 VAL 81 1HG2 VAL 81 7.978 -7.111 8.515 2947 HG23 VAL 81 2HG2 VAL 81 7.290 -8.388 9.581 2948 H PHE 82 H PHE 82 4.100 -5.998 6.317 2949 HA PHE 82 HA PHE 82 1.575 -7.175 6.907 2950 HB2 PHE 82 2HB PHE 82 2.429 -4.882 5.027 2951 HB3 PHE 82 1HB PHE 82 0.720 -5.420 5.142 2952 HD1 PHE 82 2HD PHE 82 -0.244 -5.658 7.599 2953 HD2 PHE 82 1HD PHE 82 2.965 -3.051 6.427 2954 HE1 PHE 82 2HE PHE 82 -0.793 -4.137 9.466 2955 HE2 PHE 82 1HE PHE 82 2.470 -1.572 8.329 2956 HZ PHE 82 HZ PHE 82 0.560 -2.081 9.838 2957 H ALA 83 H ALA 83 3.894 -7.971 4.545 2958 HA ALA 83 HA ALA 83 1.900 -9.091 2.713 2959 HB1 ALA 83 1HB ALA 83 4.976 -9.034 2.524 2960 HB2 ALA 83 2HB ALA 83 3.858 -7.892 1.700 2961 HB3 ALA 83 3HB ALA 83 3.836 -9.634 1.257 2962 H LEU 84 H LEU 84 4.560 -10.029 4.927 2963 HA LEU 84 HA LEU 84 4.817 -12.668 4.434 2964 HB2 LEU 84 2HB LEU 84 6.176 -11.255 5.995 2965 HB3 LEU 84 1HB LEU 84 4.868 -11.308 7.209 2966 HG LEU 84 HG LEU 84 6.165 -13.885 6.153 2967 HD11 LEU 84 1HD1 LEU 84 7.346 -12.090 8.370 2968 HD12 LEU 84 2HD1 LEU 84 8.051 -12.368 6.734 2969 HD13 LEU 84 3HD1 LEU 84 7.930 -13.733 7.903 2970 HD21 LEU 84 3HD2 LEU 84 4.245 -14.265 7.689 2971 HD22 LEU 84 1HD2 LEU 84 4.957 -13.155 8.911 2972 HD23 LEU 84 2HD2 LEU 84 5.766 -14.713 8.512 2973 H VAL 85 H VAL 85 2.282 -11.050 6.263 2974 HA VAL 85 HA VAL 85 1.183 -13.290 7.481 2975 HB VAL 85 HB VAL 85 -0.819 -11.925 7.876 2976 HG11 VAL 85 1HG1 VAL 85 1.333 -11.678 9.251 2977 HG12 VAL 85 2HG1 VAL 85 0.317 -10.194 9.215 2978 HG13 VAL 85 3HG1 VAL 85 1.797 -10.299 8.212 2979 HG21 VAL 85 3HG2 VAL 85 0.563 -9.905 5.969 2980 HG22 VAL 85 1HG2 VAL 85 -0.887 -9.563 6.973 2981 HG23 VAL 85 2HG2 VAL 85 -0.978 -10.766 5.644 2982 H THR 86 H THR 86 1.139 -12.617 4.073 2983 HA THR 86 HA THR 86 -1.405 -13.599 3.548 2984 HB THR 86 HB THR 86 1.048 -13.332 1.789 2985 HG1 THR 86 1HG THR 86 0.065 -11.352 1.393 2986 HG21 THR 86 3HG2 THR 86 -0.645 -13.277 -0.097 2987 HG22 THR 86 1HG2 THR 86 -1.951 -13.736 1.056 2988 HG23 THR 86 2HG2 THR 86 -0.613 -14.892 0.690 2989 H ALA 87 H ALA 87 1.372 -15.301 4.622 2990 HA ALA 87 HA ALA 87 0.749 -17.897 3.757 2991 HB1 ALA 87 1HB ALA 87 1.921 -18.637 5.858 2992 HB2 ALA 87 2HB ALA 87 1.811 -16.958 6.510 2993 HB3 ALA 87 3HB ALA 87 2.833 -17.303 5.076 2994 H ALA 88 H ALA 88 -0.831 -15.718 6.044 2995 HA ALA 88 HA ALA 88 -2.489 -17.836 7.154 2996 HB1 ALA 88 1HB ALA 88 -2.514 -14.805 7.712 2997 HB2 ALA 88 2HB ALA 88 -1.686 -16.033 8.732 2998 HB3 ALA 88 3HB ALA 88 -3.489 -16.038 8.573 2999 H LEU 89 H LEU 89 -2.625 -15.035 4.917 3000 HA LEU 89 HA LEU 89 -5.439 -15.006 4.836 3001 HB2 LEU 89 2HB LEU 89 -3.492 -13.868 2.758 3002 HB3 LEU 89 1HB LEU 89 -5.232 -13.465 2.910 3003 HG LEU 89 HG LEU 89 -3.094 -12.900 5.060 3004 HD11 LEU 89 1HD1 LEU 89 -3.216 -10.547 4.368 3005 HD12 LEU 89 2HD1 LEU 89 -4.435 -10.933 3.101 3006 HD13 LEU 89 3HD1 LEU 89 -2.755 -11.559 2.963 3007 HD21 LEU 89 3HD2 LEU 89 -6.059 -12.048 4.884 3008 HD22 LEU 89 1HD2 LEU 89 -4.869 -11.414 6.070 3009 HD23 LEU 89 2HD2 LEU 89 -5.332 -13.151 6.110 3010 H ALA 90 H ALA 90 -3.013 -16.599 2.718 3011 HA ALA 90 HA ALA 90 -4.933 -17.304 0.759 3012 HB1 ALA 90 1HB ALA 90 -2.239 -18.622 1.436 3013 HB2 ALA 90 2HB ALA 90 -2.488 -17.276 0.268 3014 HB3 ALA 90 3HB ALA 90 -3.199 -18.896 -0.069 3015 H THR 91 H THR 91 -4.273 -18.607 3.953 3016 HA THR 91 HA THR 91 -5.706 -21.067 3.243 3017 HB THR 91 HB THR 91 -3.641 -21.470 4.410 3018 HG1 THR 91 1HG THR 91 -6.041 -21.980 5.737 3019 HG21 THR 91 3HG2 THR 91 -3.322 -20.803 6.794 3020 HG22 THR 91 1HG2 THR 91 -4.808 -19.776 6.714 3021 HG23 THR 91 2HG2 THR 91 -3.374 -19.395 5.690 3022 H ASP 92 H ASP 92 -6.672 -17.969 3.764 3023 HA ASP 92 HA ASP 92 -8.501 -18.601 5.904 3024 HB2 ASP 92 2HB ASP 92 -7.427 -16.180 5.069 3025 HB3 ASP 92 1HB ASP 92 -9.080 -16.108 4.366 3026 H PHE 93 H PHE 93 -8.476 -18.533 2.346 3027 HA PHE 93 HA PHE 93 -11.286 -18.717 2.143 3028 HB2 PHE 93 2HB PHE 93 -11.126 -18.875 -0.164 3029 HB3 PHE 93 1HB PHE 93 -9.674 -17.933 0.289 3030 HD1 PHE 93 1HD PHE 93 -10.925 -21.161 -1.043 3031 HD2 PHE 93 2HD PHE 93 -7.450 -18.819 -0.099 3032 HE1 PHE 93 1HE PHE 93 -9.543 -22.645 -2.453 3033 HE2 PHE 93 2HE PHE 93 -6.063 -20.307 -1.494 3034 HZ PHE 93 HZ PHE 93 -7.104 -22.221 -2.689 3035 H VAL 94 H VAL 94 -8.775 -21.195 2.531 3036 HA VAL 94 HA VAL 94 -10.322 -23.268 1.459 3037 HB VAL 94 HB VAL 94 -8.725 -24.849 2.355 3038 HG11 VAL 94 1HG1 VAL 94 -6.734 -23.944 1.147 3039 HG12 VAL 94 2HG1 VAL 94 -7.399 -22.276 1.215 3040 HG13 VAL 94 3HG1 VAL 94 -8.246 -23.543 0.257 3041 HG21 VAL 94 3HG2 VAL 94 -8.318 -23.844 4.616 3042 HG22 VAL 94 1HG2 VAL 94 -7.530 -22.421 3.848 3043 HG23 VAL 94 2HG2 VAL 94 -6.769 -24.042 3.728 3044 H ARG 95 H ARG 95 -10.707 -21.592 4.359 3045 HA ARG 95 HA ARG 95 -11.799 -23.545 6.053 3046 HB2 ARG 95 2HB ARG 95 -12.427 -20.548 5.662 3047 HB3 ARG 95 1HB ARG 95 -13.151 -21.539 6.973 3048 HG2 ARG 95 2HG ARG 95 -10.986 -21.976 7.965 3049 HG3 ARG 95 1HG ARG 95 -10.121 -21.074 6.665 3050 HD2 ARG 95 2HD ARG 95 -10.852 -18.961 7.373 3051 HD3 ARG 95 1HD ARG 95 -12.338 -19.596 8.181 3052 HE ARG 95 HE ARG 95 -10.762 -20.684 9.891 3053 HH11 ARG 95 1HH2 ARG 95 -10.002 -17.424 8.331 3054 HH12 ARG 95 2HH2 ARG 95 -9.098 -16.942 9.660 3055 HH21 ARG 95 1HH1 ARG 95 -9.682 -19.873 11.684 3056 HH22 ARG 95 2HH1 ARG 95 -8.994 -18.275 11.692 3057 H ARG 96 H ARG 96 -13.024 -22.164 3.016 3058 HA ARG 96 HA ARG 96 -15.740 -22.640 3.838 3059 HB2 ARG 96 2HB ARG 96 -16.499 -21.843 1.764 3060 HB3 ARG 96 1HB ARG 96 -15.169 -20.792 2.324 3061 HG2 ARG 96 2HG ARG 96 -14.425 -20.965 0.204 3062 HG3 ARG 96 1HG ARG 96 -13.739 -22.536 0.730 3063 HD2 ARG 96 2HD ARG 96 -16.038 -23.600 -0.072 3064 HD3 ARG 96 1HD ARG 96 -16.428 -21.969 -0.722 3065 HE ARG 96 HE ARG 96 -14.946 -22.265 -2.440 3066 HH11 ARG 96 1HH2 ARG 96 -14.250 -24.793 0.040 3067 HH12 ARG 96 2HH2 ARG 96 -13.489 -25.895 -1.014 3068 HH21 ARG 96 1HH1 ARG 96 -13.960 -23.856 -3.951 3069 HH22 ARG 96 2HH1 ARG 96 -13.273 -25.307 -3.357 3070 H GLU 97 H GLU 97 -13.273 -24.781 3.080 3071 HA GLU 97 HA GLU 97 -15.066 -26.741 1.856 3072 HB2 GLU 97 2HB GLU 97 -12.370 -26.456 1.441 3073 HB3 GLU 97 1HB GLU 97 -12.294 -27.453 2.912 3074 HG2 GLU 97 2HG GLU 97 -12.190 -28.962 1.002 3075 HG3 GLU 97 1HG GLU 97 -13.846 -29.166 1.673 3076 H GLU 98 H GLU 98 -15.456 -28.735 3.196 3077 HA GLU 98 HA GLU 98 -16.144 -29.767 4.944 3078 HB2 GLU 98 2HB GLU 98 -14.413 -28.149 6.840 3079 HB3 GLU 98 1HB GLU 98 -15.067 -29.809 7.062 3080 HG2 GLU 98 2HG GLU 98 -12.878 -28.956 5.041 3081 HG3 GLU 98 1HG GLU 98 -12.608 -29.750 6.625 3082 H GLU 99 H GLU 99 -15.883 -26.297 5.733 3083 HA GLU 99 HA GLU 99 -17.926 -26.142 7.578 3084 HB2 GLU 99 2HB GLU 99 -16.134 -24.413 7.143 3085 HB3 GLU 99 1HB GLU 99 -16.986 -23.960 5.636 3086 HG2 GLU 99 2HG GLU 99 -17.518 -22.317 7.290 3087 HG3 GLU 99 1HG GLU 99 -19.012 -23.296 7.089 3088 H ARG 100 H ARG 100 -18.026 -26.003 4.051 3089 HA ARG 100 HA ARG 100 -20.624 -25.201 3.626 3090 HB2 ARG 100 2HB ARG 100 -20.424 -26.411 1.436 3091 HB3 ARG 100 1HB ARG 100 -18.965 -25.449 1.830 3092 HG2 ARG 100 2HG ARG 100 -17.917 -27.629 2.791 3093 HG3 ARG 100 1HG ARG 100 -19.269 -28.511 2.014 3094 HD2 ARG 100 2HD ARG 100 -17.158 -26.714 0.614 3095 HD3 ARG 100 1HD ARG 100 -17.204 -28.528 0.614 3096 HE ARG 100 HE ARG 100 -19.728 -27.515 -0.378 3097 HH11 ARG 100 1HH2 ARG 100 -16.209 -27.727 -1.322 3098 HH12 ARG 100 2HH2 ARG 100 -16.537 -27.333 -2.964 3099 HH21 ARG 100 1HH1 ARG 100 -20.140 -27.440 -2.618 3100 HH22 ARG 100 2HH1 ARG 100 -18.888 -27.346 -3.800 3101 H ARG 101 H ARG 101 -19.539 -28.248 5.024 3102 HA ARG 101 HA ARG 101 -22.092 -29.554 4.407 3103 HB2 ARG 101 2HB ARG 101 -19.644 -30.603 5.956 3104 HB3 ARG 101 1HB ARG 101 -21.084 -31.562 5.472 3105 HG2 ARG 101 2HG ARG 101 -18.997 -30.304 3.576 3106 HG3 ARG 101 1HG ARG 101 -19.096 -32.024 4.084 3107 HD2 ARG 101 2HD ARG 101 -21.395 -32.193 2.990 3108 HD3 ARG 101 1HD ARG 101 -21.185 -30.500 2.366 3109 HE ARG 101 HE ARG 101 -18.870 -32.144 1.655 3110 HH11 ARG 101 1HH2 ARG 101 -22.380 -31.792 0.829 3111 HH12 ARG 101 2HH2 ARG 101 -22.258 -32.634 -0.635 3112 HH21 ARG 101 1HH1 ARG 101 -18.635 -33.008 -0.388 3113 HH22 ARG 101 2HH1 ARG 101 -19.933 -33.229 -1.503 3114 H GLY 102 H GLY 102 -20.750 -27.437 6.732 3115 HA2 GLY 102 2HA GLY 102 -21.451 -26.706 8.650 3116 HA3 GLY 102 1HA GLY 102 -23.013 -27.513 8.262 3117 H HIS 103 H HIS 103 -19.968 -29.282 8.777 3118 HA HIS 103 HA HIS 103 -21.084 -30.187 11.387 3119 HB2 HIS 103 2HB HIS 103 -19.712 -31.949 9.280 3120 HB3 HIS 103 1HB HIS 103 -19.951 -32.409 10.997 3121 HD1 HIS 103 1HD HIS 103 -22.452 -31.110 8.245 3122 HD2 HIS 103 2HD HIS 103 -22.162 -33.890 11.419 3123 HE1 HIS 103 1HE HIS 103 -24.579 -32.362 8.320 3124 HE2 HIS 103 2HE HIS 103 -24.434 -34.038 10.184 Start of MODEL 15 1 H1 SER 1 H SER 1 -21.846 -12.799 -3.426 2 HA SER 1 HA SER 1 -24.219 -13.628 -2.302 3 HB2 SER 1 2HB SER 1 -24.358 -14.532 -4.879 4 HB3 SER 1 1HB SER 1 -24.523 -12.795 -4.445 5 HG SER 1 1HG SER 1 -23.052 -13.059 -6.089 6 H ALA 2 H ALA 2 -21.242 -15.302 -3.397 7 HA ALA 2 HA ALA 2 -22.509 -17.867 -3.110 8 HB1 ALA 2 1HB ALA 2 -19.553 -17.255 -3.577 9 HB2 ALA 2 2HB ALA 2 -20.771 -17.782 -4.778 10 HB3 ALA 2 3HB ALA 2 -20.276 -18.902 -3.461 11 H ASP 3 H ASP 3 -19.377 -17.198 -1.452 12 HA ASP 3 HA ASP 3 -20.785 -17.855 1.099 13 HB2 ASP 3 2HB ASP 3 -18.278 -19.321 0.042 14 HB3 ASP 3 1HB ASP 3 -18.883 -19.387 1.745 15 H HIS 4 H HIS 4 -17.424 -17.550 0.046 16 HA HIS 4 HA HIS 4 -16.848 -15.938 2.315 17 HB2 HIS 4 2HB HIS 4 -14.504 -15.665 1.146 18 HB3 HIS 4 1HB HIS 4 -15.019 -17.245 1.798 19 HD1 HIS 4 1HD HIS 4 -15.737 -15.675 -1.693 20 HD2 HIS 4 2HD HIS 4 -14.698 -19.315 0.112 21 HE1 HIS 4 1HE HIS 4 -15.598 -17.306 -3.488 22 HE2 HIS 4 2HE HIS 4 -15.131 -19.541 -2.445 23 H GLU 5 H GLU 5 -17.969 -15.139 -0.874 24 HA GLU 5 HA GLU 5 -17.014 -12.547 -1.114 25 HB2 GLU 5 2HB GLU 5 -19.621 -13.916 -2.043 26 HB3 GLU 5 1HB GLU 5 -19.086 -12.287 -2.574 27 HG2 GLU 5 2HG GLU 5 -18.528 -13.756 -4.352 28 HG3 GLU 5 1HG GLU 5 -16.990 -13.301 -3.556 29 H ARG 6 H ARG 6 -19.714 -13.934 0.787 30 HA ARG 6 HA ARG 6 -20.871 -11.360 1.319 31 HB2 ARG 6 2HB ARG 6 -21.371 -14.152 2.502 32 HB3 ARG 6 1HB ARG 6 -22.330 -12.684 2.909 33 HG2 ARG 6 2HG ARG 6 -22.991 -12.388 0.555 34 HG3 ARG 6 1HG ARG 6 -22.035 -13.810 0.037 35 HD2 ARG 6 2HD ARG 6 -24.297 -13.959 2.125 36 HD3 ARG 6 1HD ARG 6 -24.613 -14.155 0.346 37 HE ARG 6 HE ARG 6 -22.823 -16.047 0.477 38 HH11 ARG 6 1HH2 ARG 6 -25.408 -15.438 2.951 39 HH12 ARG 6 2HH2 ARG 6 -25.283 -17.023 3.616 40 HH21 ARG 6 1HH1 ARG 6 -22.831 -18.198 1.261 41 HH22 ARG 6 2HH1 ARG 6 -23.691 -18.657 2.640 42 H GLU 7 H GLU 7 -18.386 -13.370 2.699 43 HA GLU 7 HA GLU 7 -18.404 -12.211 5.297 44 HB2 GLU 7 2HB GLU 7 -17.538 -14.523 4.546 45 HB3 GLU 7 1HB GLU 7 -16.081 -13.692 3.912 46 HG2 GLU 7 2HG GLU 7 -15.475 -12.955 6.214 47 HG3 GLU 7 1HG GLU 7 -17.054 -13.563 6.852 48 H ALA 8 H ALA 8 -16.607 -11.751 2.234 49 HA ALA 8 HA ALA 8 -14.880 -9.729 3.077 50 HB1 ALA 8 1HB ALA 8 -16.146 -10.181 0.290 51 HB2 ALA 8 2HB ALA 8 -14.599 -10.899 0.878 52 HB3 ALA 8 3HB ALA 8 -14.736 -9.117 0.631 53 H GLN 9 H GLN 9 -18.142 -9.572 1.637 54 HA GLN 9 HA GLN 9 -18.379 -6.808 1.497 55 HB2 GLN 9 2HB GLN 9 -19.899 -8.703 0.483 56 HB3 GLN 9 1HB GLN 9 -20.645 -8.810 2.106 57 HG2 GLN 9 2HG GLN 9 -21.002 -6.126 1.679 58 HG3 GLN 9 1HG GLN 9 -20.823 -6.623 -0.035 59 HE21 GLN 9 1HE2 GLN 9 -23.041 -6.274 2.526 60 HE22 GLN 9 2HE2 GLN 9 -24.341 -7.230 1.873 61 H LYS 10 H LYS 10 -18.929 -9.081 4.194 62 HA LYS 10 HA LYS 10 -20.339 -7.234 5.829 63 HB2 LYS 10 2HB LYS 10 -20.348 -9.804 6.162 64 HB3 LYS 10 1HB LYS 10 -18.684 -9.644 6.805 65 HG2 LYS 10 2HG LYS 10 -19.646 -7.931 8.506 66 HG3 LYS 10 1HG LYS 10 -21.274 -8.363 7.899 67 HD2 LYS 10 2HD LYS 10 -20.895 -10.726 8.690 68 HD3 LYS 10 1HD LYS 10 -19.233 -10.268 9.228 69 HE2 LYS 10 2HE LYS 10 -20.225 -8.512 10.769 70 HE3 LYS 10 1HE LYS 10 -21.880 -9.032 10.258 71 HZ1 LYS 10 3HZ LYS 10 -19.854 -10.609 11.765 72 HZ2 LYS 10 1HZ LYS 10 -21.319 -11.262 11.141 73 HZ3 LYS 10 2HZ LYS 10 -21.363 -10.002 12.289 74 H ALA 11 H ALA 11 -16.932 -8.209 5.399 75 HA ALA 11 HA ALA 11 -15.891 -6.964 7.641 76 HB1 ALA 11 1HB ALA 11 -13.681 -7.073 6.505 77 HB2 ALA 11 2HB ALA 11 -14.494 -7.354 4.920 78 HB3 ALA 11 3HB ALA 11 -14.596 -8.597 6.221 79 H GLU 12 H GLU 12 -16.598 -5.583 4.378 80 HA GLU 12 HA GLU 12 -15.283 -3.151 4.879 81 HB2 GLU 12 2HB GLU 12 -17.681 -3.635 3.024 82 HB3 GLU 12 1HB GLU 12 -16.736 -2.113 3.138 83 HG2 GLU 12 2HG GLU 12 -14.627 -3.484 2.516 84 HG3 GLU 12 1HG GLU 12 -15.745 -4.839 2.098 85 H GLU 13 H GLU 13 -18.380 -4.351 5.976 86 HA GLU 13 HA GLU 13 -19.503 -1.788 6.508 87 HB2 GLU 13 2HB GLU 13 -20.659 -3.981 5.957 88 HB3 GLU 13 1HB GLU 13 -20.319 -4.534 7.627 89 HG2 GLU 13 2HG GLU 13 -21.746 -2.788 8.576 90 HG3 GLU 13 1HG GLU 13 -21.890 -1.953 6.978 91 H GLU 14 H GLU 14 -17.519 -4.166 8.262 92 HA GLU 14 HA GLU 14 -17.732 -3.022 10.837 93 HB2 GLU 14 2HB GLU 14 -15.532 -4.679 9.479 94 HB3 GLU 14 1HB GLU 14 -15.281 -4.016 11.116 95 HG2 GLU 14 2HG GLU 14 -17.689 -5.815 10.459 96 HG3 GLU 14 1HG GLU 14 -16.091 -6.457 10.994 97 H LEU 15 H LEU 15 -15.722 -2.276 7.987 98 HA LEU 15 HA LEU 15 -13.915 -0.661 9.370 99 HB2 LEU 15 2HB LEU 15 -13.561 -1.630 7.072 100 HB3 LEU 15 1HB LEU 15 -14.736 -0.455 6.409 101 HG LEU 15 HG LEU 15 -13.255 1.421 6.931 102 HD11 LEU 15 1HD1 LEU 15 -11.464 -0.624 8.395 103 HD12 LEU 15 2HD1 LEU 15 -12.286 0.820 9.095 104 HD13 LEU 15 3HD1 LEU 15 -10.938 1.035 7.940 105 HD21 LEU 15 3HD2 LEU 15 -11.312 0.836 5.460 106 HD22 LEU 15 1HD2 LEU 15 -12.839 0.132 4.826 107 HD23 LEU 15 2HD2 LEU 15 -11.650 -0.913 5.682 108 H GLN 16 H GLN 16 -17.043 0.070 7.814 109 HA GLN 16 HA GLN 16 -16.968 2.849 8.011 110 HB2 GLN 16 2HB GLN 16 -19.434 1.024 8.370 111 HB3 GLN 16 1HB GLN 16 -19.461 2.802 8.165 112 HG2 GLN 16 2HG GLN 16 -18.261 2.385 5.858 113 HG3 GLN 16 1HG GLN 16 -18.698 0.651 6.082 114 HE21 GLN 16 1HE2 GLN 16 -20.260 3.923 6.604 115 HE22 GLN 16 2HE2 GLN 16 -21.733 3.537 5.767 116 H LYS 17 H LYS 17 -17.921 0.395 10.399 117 HA LYS 17 HA LYS 17 -19.011 2.110 12.323 118 HB2 LYS 17 2HB LYS 17 -19.349 -0.367 12.309 119 HB3 LYS 17 1HB LYS 17 -17.592 -0.606 12.532 120 HG2 LYS 17 2HG LYS 17 -17.775 0.430 14.849 121 HG3 LYS 17 1HG LYS 17 -19.549 0.568 14.595 122 HD2 LYS 17 2HD LYS 17 -19.021 -1.410 15.959 123 HD3 LYS 17 1HD LYS 17 -19.725 -1.912 14.381 124 HE2 LYS 17 2HE LYS 17 -17.444 -2.503 13.523 125 HE3 LYS 17 1HE LYS 17 -16.690 -1.945 15.064 126 HZ1 LYS 17 3HZ LYS 17 -17.186 -4.389 14.568 127 HZ2 LYS 17 1HZ LYS 17 -18.743 -4.105 15.086 128 HZ3 LYS 17 2HZ LYS 17 -17.477 -3.811 16.175 129 H VAL 18 H VAL 18 -15.687 0.857 11.815 130 HA VAL 18 HA VAL 18 -14.591 2.024 14.132 131 HB VAL 18 HB VAL 18 -13.244 1.139 11.527 132 HG11 VAL 18 1HG1 VAL 18 -11.157 0.980 12.955 133 HG12 VAL 18 2HG1 VAL 18 -12.040 1.764 14.319 134 HG13 VAL 18 3HG1 VAL 18 -11.724 2.672 12.794 135 HG21 VAL 18 3HG2 VAL 18 -13.675 -0.300 14.244 136 HG22 VAL 18 1HG2 VAL 18 -12.756 -0.952 12.840 137 HG23 VAL 18 2HG2 VAL 18 -14.522 -0.698 12.715 138 H LEU 19 H LEU 19 -14.898 3.154 10.724 139 HA LEU 19 HA LEU 19 -13.403 5.486 10.950 140 HB2 LEU 19 2HB LEU 19 -15.965 4.916 9.327 141 HB3 LEU 19 1HB LEU 19 -15.051 6.440 9.159 142 HG LEU 19 HG LEU 19 -13.848 3.674 8.568 143 HD11 LEU 19 1HD1 LEU 19 -14.108 4.285 6.173 144 HD12 LEU 19 2HD1 LEU 19 -14.944 5.814 6.624 145 HD13 LEU 19 3HD1 LEU 19 -15.717 4.225 6.977 146 HD21 LEU 19 3HD2 LEU 19 -12.086 5.292 9.126 147 HD22 LEU 19 1HD2 LEU 19 -12.906 6.573 8.151 148 HD23 LEU 19 2HD2 LEU 19 -12.156 5.177 7.328 149 H GLU 20 H GLU 20 -16.812 4.868 11.765 150 HA GLU 20 HA GLU 20 -17.553 7.533 12.230 151 HB2 GLU 20 2HB GLU 20 -18.883 5.155 11.935 152 HB3 GLU 20 1HB GLU 20 -18.886 5.205 13.702 153 HG2 GLU 20 2HG GLU 20 -20.945 6.198 13.117 154 HG3 GLU 20 1HG GLU 20 -19.920 7.649 13.430 155 H GLU 21 H GLU 21 -16.430 4.878 14.304 156 HA GLU 21 HA GLU 21 -16.696 6.140 16.809 157 HB2 GLU 21 2HB GLU 21 -16.539 3.681 16.556 158 HB3 GLU 21 1HB GLU 21 -14.979 3.839 15.701 159 HG2 GLU 21 2HG GLU 21 -14.503 2.951 17.861 160 HG3 GLU 21 1HG GLU 21 -13.890 4.635 17.849 161 H ALA 22 H ALA 22 -13.921 5.605 14.609 162 HA ALA 22 HA ALA 22 -12.064 6.881 16.278 163 HB1 ALA 22 1HB ALA 22 -11.403 5.131 14.610 164 HB2 ALA 22 2HB ALA 22 -10.490 6.666 14.370 165 HB3 ALA 22 3HB ALA 22 -11.862 6.244 13.271 166 H SER 23 H SER 23 -14.145 8.125 13.626 167 HA SER 23 HA SER 23 -12.607 10.447 13.170 168 HB2 SER 23 2HB SER 23 -14.902 11.512 12.470 169 HB3 SER 23 1HB SER 23 -14.242 10.169 11.507 170 HG SER 23 1HG SER 23 -15.646 8.783 12.364 171 H LYS 24 H LYS 24 -15.222 9.714 15.513 172 HA LYS 24 HA LYS 24 -15.306 12.391 16.434 173 HB2 LYS 24 2HB LYS 24 -17.185 10.792 16.819 174 HB3 LYS 24 1HB LYS 24 -16.158 9.871 17.971 175 HG2 LYS 24 2HG LYS 24 -16.012 11.876 19.463 176 HG3 LYS 24 1HG LYS 24 -16.878 12.867 18.253 177 HD2 LYS 24 2HD LYS 24 -18.929 11.490 18.534 178 HD3 LYS 24 1HD LYS 24 -18.107 10.456 19.748 179 HE2 LYS 24 2HE LYS 24 -18.601 13.515 20.014 180 HE3 LYS 24 1HE LYS 24 -19.600 12.219 20.780 181 HZ1 LYS 24 3HZ LYS 24 -17.630 11.509 21.997 182 HZ2 LYS 24 1HZ LYS 24 -18.069 13.095 22.336 183 HZ3 LYS 24 2HZ LYS 24 -16.717 12.843 21.365 184 H LYS 25 H LYS 25 -13.499 9.488 17.589 185 HA LYS 25 HA LYS 25 -12.443 10.885 19.839 186 HB2 LYS 25 2HB LYS 25 -11.706 8.259 18.471 187 HB3 LYS 25 1HB LYS 25 -10.560 9.016 19.617 188 HG2 LYS 25 2HG LYS 25 -11.717 7.518 20.953 189 HG3 LYS 25 1HG LYS 25 -12.338 9.147 21.375 190 HD2 LYS 25 2HD LYS 25 -14.407 8.619 19.914 191 HD3 LYS 25 1HD LYS 25 -13.725 6.969 19.694 192 HE2 LYS 25 2HE LYS 25 -13.637 6.840 22.316 193 HE3 LYS 25 1HE LYS 25 -14.689 8.312 22.323 194 HZ1 LYS 25 3HZ LYS 25 -16.384 6.986 21.104 195 HZ2 LYS 25 1HZ LYS 25 -15.859 6.145 22.487 196 HZ3 LYS 25 2HZ LYS 25 -15.292 5.720 20.977 197 H ALA 26 H ALA 26 -11.653 10.982 16.434 198 HA ALA 26 HA ALA 26 -8.986 11.760 16.682 199 HB1 ALA 26 1HB ALA 26 -10.090 11.102 14.491 200 HB2 ALA 26 2HB ALA 26 -9.142 12.625 14.412 201 HB3 ALA 26 3HB ALA 26 -10.939 12.693 14.492 202 H VAL 27 H VAL 27 -12.036 13.768 16.556 203 HA VAL 27 HA VAL 27 -10.517 16.150 16.732 204 HB VAL 27 HB VAL 27 -12.688 17.299 17.207 205 HG11 VAL 27 1HG1 VAL 27 -13.586 16.747 14.918 206 HG12 VAL 27 2HG1 VAL 27 -12.474 15.331 14.825 207 HG13 VAL 27 3HG1 VAL 27 -11.816 16.999 14.911 208 HG21 VAL 27 3HG2 VAL 27 -13.883 15.364 18.390 209 HG22 VAL 27 1HG2 VAL 27 -13.889 14.460 16.825 210 HG23 VAL 27 2HG2 VAL 27 -14.787 16.000 16.975 211 H GLU 28 H GLU 28 -11.949 14.037 19.155 212 HA GLU 28 HA GLU 28 -11.521 15.880 21.296 213 HB2 GLU 28 2HB GLU 28 -12.638 13.130 21.007 214 HB3 GLU 28 1HB GLU 28 -11.608 13.310 22.455 215 HG2 GLU 28 2HG GLU 28 -13.584 13.870 23.403 216 HG3 GLU 28 1HG GLU 28 -13.023 15.505 22.931 217 H ALA 29 H ALA 29 -9.503 13.442 19.638 218 HA ALA 29 HA ALA 29 -7.614 13.075 21.658 219 HB1 ALA 29 1HB ALA 29 -6.070 12.276 19.847 220 HB2 ALA 29 2HB ALA 29 -7.189 12.944 18.604 221 HB3 ALA 29 3HB ALA 29 -7.708 11.569 19.648 222 H GLU 30 H GLU 30 -8.086 15.636 19.332 223 HA GLU 30 HA GLU 30 -5.497 16.780 19.536 224 HB2 GLU 30 2HB GLU 30 -8.204 17.989 18.698 225 HB3 GLU 30 1HB GLU 30 -6.591 18.673 18.291 226 HG2 GLU 30 2HG GLU 30 -7.410 15.811 17.409 227 HG3 GLU 30 1HG GLU 30 -7.909 17.259 16.513 228 H ARG 31 H ARG 31 -8.004 16.586 21.836 229 HA ARG 31 HA ARG 31 -7.448 19.270 22.937 230 HB2 ARG 31 2HB ARG 31 -9.728 17.343 23.600 231 HB3 ARG 31 1HB ARG 31 -9.553 19.030 24.188 232 HG2 ARG 31 2HG ARG 31 -10.011 18.195 21.228 233 HG3 ARG 31 1HG ARG 31 -11.299 18.592 22.388 234 HD2 ARG 31 2HD ARG 31 -10.887 20.537 20.923 235 HD3 ARG 31 1HD ARG 31 -10.464 20.920 22.646 236 HE ARG 31 HE ARG 31 -8.233 19.903 20.976 237 HH11 ARG 31 1HH2 ARG 31 -9.950 22.947 21.958 238 HH12 ARG 31 2HH2 ARG 31 -8.533 23.875 22.027 239 HH21 ARG 31 1HH1 ARG 31 -6.298 21.148 21.193 240 HH22 ARG 31 2HH1 ARG 31 -6.320 22.782 21.739 241 H GLY 32 H GLY 32 -5.269 18.215 23.536 242 HA2 GLY 32 2HA GLY 32 -5.137 17.906 26.206 243 HA3 GLY 32 1HA GLY 32 -5.387 16.223 25.565 244 H ALA 33 H ALA 33 -4.147 16.484 23.072 245 HA ALA 33 HA ALA 33 -1.410 16.290 23.962 246 HB1 ALA 33 1HB ALA 33 -1.084 15.256 21.645 247 HB2 ALA 33 2HB ALA 33 -2.840 15.554 21.359 248 HB3 ALA 33 3HB ALA 33 -2.320 14.417 22.654 249 HA PRO 34 HA PRO 34 -0.392 20.063 21.926 250 HB2 PRO 34 2HB PRO 34 2.324 19.756 21.266 251 HB3 PRO 34 1HB PRO 34 1.730 19.910 22.963 252 HG2 PRO 34 2HG PRO 34 2.354 17.335 21.420 253 HG3 PRO 34 1HG PRO 34 2.903 17.801 23.084 254 HD2 PRO 34 2HD PRO 34 0.706 16.166 22.675 255 HD3 PRO 34 1HD PRO 34 0.699 17.409 24.001 256 H GLY 35 H GLY 35 -0.040 21.142 19.871 257 HA2 GLY 35 2HA GLY 35 0.527 21.248 17.700 258 HA3 GLY 35 1HA GLY 35 0.474 19.455 17.560 259 H ALA 36 H ALA 36 -2.208 20.968 19.146 260 HA ALA 36 HA ALA 36 -3.967 19.556 17.675 261 HB1 ALA 36 1HB ALA 36 -4.456 20.482 19.932 262 HB2 ALA 36 2HB ALA 36 -5.783 20.832 18.763 263 HB3 ALA 36 3HB ALA 36 -4.615 22.135 19.216 264 H ALA 37 H ALA 37 -5.147 19.674 15.883 265 HA ALA 37 HA ALA 37 -5.325 22.251 14.459 266 HB1 ALA 37 1HB ALA 37 -4.585 21.077 12.349 267 HB2 ALA 37 2HB ALA 37 -4.290 19.580 13.317 268 HB3 ALA 37 3HB ALA 37 -3.283 21.029 13.603 269 H LEU 38 H LEU 38 -6.309 18.766 14.698 270 HA LEU 38 HA LEU 38 -8.488 19.234 12.832 271 HB2 LEU 38 2HB LEU 38 -7.116 17.147 12.722 272 HB3 LEU 38 1HB LEU 38 -7.591 16.753 14.390 273 HG LEU 38 HG LEU 38 -9.955 16.432 13.695 274 HD11 LEU 38 1HD1 LEU 38 -8.987 16.801 10.800 275 HD12 LEU 38 2HD1 LEU 38 -10.052 17.970 11.688 276 HD13 LEU 38 3HD1 LEU 38 -10.632 16.307 11.332 277 HD21 LEU 38 3HD2 LEU 38 -8.336 14.559 13.779 278 HD22 LEU 38 1HD2 LEU 38 -7.920 14.806 12.050 279 HD23 LEU 38 2HD2 LEU 38 -9.586 14.290 12.508 280 H ILE 39 H ILE 39 -9.095 20.988 14.603 281 HA ILE 39 HA ILE 39 -10.572 19.813 16.831 282 HB ILE 39 HB ILE 39 -10.991 22.160 17.488 283 HG12 ILE 39 2HG1 ILE 39 -9.179 22.879 15.075 284 HG13 ILE 39 1HG1 ILE 39 -10.948 23.171 15.157 285 HG21 ILE 39 1HG2 ILE 39 -9.014 20.777 18.244 286 HG22 ILE 39 2HG2 ILE 39 -8.640 22.535 18.213 287 HG23 ILE 39 3HG2 ILE 39 -8.026 21.459 16.904 288 HD11 ILE 39 3HD ILE 39 -8.830 24.430 17.031 289 HD12 ILE 39 1HD ILE 39 -9.703 25.242 15.687 290 HD13 ILE 39 2HD ILE 39 -10.612 24.688 17.136 291 H SER 40 H SER 40 -11.213 20.178 13.608 292 HA SER 40 HA SER 40 -13.816 21.368 13.891 293 HB2 SER 40 2HB SER 40 -12.482 20.224 11.368 294 HB3 SER 40 1HB SER 40 -13.949 21.273 11.425 295 HG SER 40 1HG SER 40 -12.450 22.735 11.130 296 H TYR 41 H TYR 41 -15.718 20.290 13.966 297 HA TYR 41 HA TYR 41 -15.532 17.454 14.361 298 HB2 TYR 41 2HB TYR 41 -17.821 19.416 14.821 299 HB3 TYR 41 1HB TYR 41 -18.072 17.633 14.877 300 HD1 TYR 41 1HD TYR 41 -15.600 20.200 16.292 301 HD2 TYR 41 2HD TYR 41 -17.842 16.569 16.916 302 HE1 TYR 41 1HE TYR 41 -14.761 20.077 18.575 303 HE2 TYR 41 2HE TYR 41 -16.990 16.448 19.218 304 HH TYR 41 HH TYR 41 -15.297 17.316 20.717 305 HA PRO 42 HA PRO 42 -18.421 16.738 10.860 306 HB2 PRO 42 2HB PRO 42 -18.907 18.621 8.804 307 HB3 PRO 42 1HB PRO 42 -19.901 18.466 10.299 308 HG2 PRO 42 2HG PRO 42 -17.587 20.414 9.779 309 HG3 PRO 42 1HG PRO 42 -19.226 20.786 10.454 310 HD2 PRO 42 2HD PRO 42 -17.043 20.410 12.090 311 HD3 PRO 42 1HD PRO 42 -18.674 19.755 12.576 312 H ASP 43 H ASP 43 -15.438 18.445 10.471 313 HA ASP 43 HA ASP 43 -14.848 17.280 7.868 314 HB2 ASP 43 2HB ASP 43 -13.105 18.831 9.872 315 HB3 ASP 43 1HB ASP 43 -12.460 18.113 8.362 316 H ALA 44 H ALA 44 -14.857 16.307 11.178 317 HA ALA 44 HA ALA 44 -12.483 14.912 11.386 318 HB1 ALA 44 1HB ALA 44 -14.133 15.475 13.265 319 HB2 ALA 44 2HB ALA 44 -13.514 13.790 13.297 320 HB3 ALA 44 3HB ALA 44 -15.180 14.141 12.693 321 H ILE 45 H ILE 45 -15.668 13.945 10.120 322 HA ILE 45 HA ILE 45 -14.946 11.206 9.808 323 HB ILE 45 HB ILE 45 -17.210 11.707 10.225 324 HG12 ILE 45 2HG1 ILE 45 -17.007 10.807 7.287 325 HG13 ILE 45 1HG1 ILE 45 -16.625 9.783 8.711 326 HG21 ILE 45 1HG2 ILE 45 -17.354 14.036 9.409 327 HG22 ILE 45 2HG2 ILE 45 -18.634 13.052 8.659 328 HG23 ILE 45 3HG2 ILE 45 -17.185 13.493 7.699 329 HD11 ILE 45 3HD ILE 45 -19.386 11.059 8.113 330 HD12 ILE 45 1HD ILE 45 -18.937 9.324 7.944 331 HD13 ILE 45 2HD ILE 45 -18.977 10.083 9.571 332 H TRP 46 H TRP 46 -14.645 14.117 7.807 333 HA TRP 46 HA TRP 46 -14.171 12.573 5.417 334 HB2 TRP 46 2HB TRP 46 -14.580 15.391 6.097 335 HB3 TRP 46 1HB TRP 46 -13.097 15.254 5.132 336 HD1 TRP 46 HD TRP 46 -13.782 16.076 2.788 337 HE1 TRP 46 1HE TRP 46 -15.906 15.981 1.349 338 HE3 TRP 46 3HE TRP 46 -16.576 12.873 5.637 339 HZ2 TRP 46 2HZ TRP 46 -18.219 14.290 1.133 340 HZ3 TRP 46 3HZ TRP 46 -18.719 12.039 4.754 341 HH2 TRP 46 HH TRP 46 -19.531 12.732 2.534 342 H TRP 47 H TRP 47 -12.269 13.780 8.103 343 HA TRP 47 HA TRP 47 -9.707 13.341 6.937 344 HB2 TRP 47 2HB TRP 47 -10.021 14.768 8.958 345 HB3 TRP 47 1HB TRP 47 -10.689 13.376 9.862 346 HD1 TRP 47 HD TRP 47 -7.230 14.612 8.463 347 HE1 TRP 47 1HE TRP 47 -5.415 13.298 9.640 348 HE3 TRP 47 3HE TRP 47 -10.195 11.471 11.173 349 HZ2 TRP 47 2HZ TRP 47 -5.230 11.332 11.743 350 HZ3 TRP 47 3HZ TRP 47 -9.140 9.844 12.715 351 HH2 TRP 47 HH TRP 47 -6.689 9.791 13.007 352 H SER 48 H SER 48 -12.015 11.310 8.937 353 HA SER 48 HA SER 48 -10.121 9.264 9.122 354 HB2 SER 48 2HB SER 48 -11.831 7.772 10.005 355 HB3 SER 48 1HB SER 48 -11.816 9.372 10.829 356 HG SER 48 1HG SER 48 -13.911 8.479 10.240 357 H VAL 49 H VAL 49 -12.564 9.944 6.647 358 HA VAL 49 HA VAL 49 -12.589 7.562 5.298 359 HB VAL 49 HB VAL 49 -12.684 10.420 4.249 360 HG11 VAL 49 1HG1 VAL 49 -13.635 9.426 2.104 361 HG12 VAL 49 2HG1 VAL 49 -13.131 7.794 2.662 362 HG13 VAL 49 3HG1 VAL 49 -11.895 9.059 2.315 363 HG21 VAL 49 3HG2 VAL 49 -15.114 9.937 4.110 364 HG22 VAL 49 1HG2 VAL 49 -14.568 9.473 5.761 365 HG23 VAL 49 2HG2 VAL 49 -14.838 8.206 4.524 366 H GLU 50 H GLU 50 -10.034 10.156 4.975 367 HA GLU 50 HA GLU 50 -8.673 8.446 3.092 368 HB2 GLU 50 2HB GLU 50 -6.941 10.192 2.958 369 HB3 GLU 50 1HB GLU 50 -8.590 10.767 2.582 370 HG2 GLU 50 2HG GLU 50 -8.744 11.816 4.885 371 HG3 GLU 50 1HG GLU 50 -7.058 11.279 5.224 372 H THR 51 H THR 51 -8.984 8.198 6.359 373 HA THR 51 HA THR 51 -6.165 7.674 6.896 374 HB THR 51 HB THR 51 -8.547 7.525 8.797 375 HG1 THR 51 1HG THR 51 -8.094 9.675 7.928 376 HG21 THR 51 3HG2 THR 51 -5.486 7.700 9.264 377 HG22 THR 51 1HG2 THR 51 -6.480 6.227 9.528 378 HG23 THR 51 2HG2 THR 51 -6.750 7.687 10.545 379 H ALA 52 H ALA 52 -9.328 5.938 6.577 380 HA ALA 52 HA ALA 52 -8.204 3.452 7.427 381 HB1 ALA 52 1HB ALA 52 -10.726 4.022 5.751 382 HB2 ALA 52 2HB ALA 52 -10.645 3.722 7.537 383 HB3 ALA 52 3HB ALA 52 -10.250 2.405 6.391 384 H THR 53 H THR 53 -8.228 5.203 4.334 385 HA THR 53 HA THR 53 -7.421 2.854 2.867 386 HB THR 53 HB THR 53 -7.295 4.606 1.002 387 HG1 THR 53 1HG THR 53 -7.039 6.447 2.124 388 HG21 THR 53 3HG2 THR 53 -9.774 4.814 0.857 389 HG22 THR 53 1HG2 THR 53 -9.955 4.423 2.603 390 HG23 THR 53 2HG2 THR 53 -9.336 3.172 1.458 391 H THR 54 H THR 54 -5.875 4.493 5.163 392 HA THR 54 HA THR 54 -3.857 5.043 5.672 393 HB THR 54 HB THR 54 -2.123 3.380 5.187 394 HG1 THR 54 1HG THR 54 -2.737 3.073 2.991 395 HG21 THR 54 3HG2 THR 54 -4.925 2.059 5.497 396 HG22 THR 54 1HG2 THR 54 -4.092 2.974 6.799 397 HG23 THR 54 2HG2 THR 54 -3.354 1.469 6.144 398 H VAL 55 H VAL 55 -4.505 7.056 3.962 399 HA VAL 55 HA VAL 55 -1.942 7.336 2.554 400 HB VAL 55 HB VAL 55 -3.487 6.921 0.806 401 HG11 VAL 55 1HG1 VAL 55 -5.639 7.673 1.885 402 HG12 VAL 55 2HG1 VAL 55 -5.360 8.361 0.240 403 HG13 VAL 55 3HG1 VAL 55 -5.130 9.395 1.665 404 HG21 VAL 55 3HG2 VAL 55 -2.892 8.907 -0.541 405 HG22 VAL 55 1HG2 VAL 55 -1.546 8.475 0.558 406 HG23 VAL 55 2HG2 VAL 55 -2.593 9.879 0.947 407 H GLY 56 H GLY 56 -4.712 9.536 3.388 408 HA2 GLY 56 2HA GLY 56 -4.652 11.345 4.726 409 HA3 GLY 56 1HA GLY 56 -3.065 10.790 5.382 410 H TYR 57 H TYR 57 -4.663 12.921 3.091 411 HA TYR 57 HA TYR 57 -2.267 13.134 1.418 412 HB2 TYR 57 2HB TYR 57 -5.145 14.146 1.297 413 HB3 TYR 57 1HB TYR 57 -3.911 15.219 0.544 414 HD1 TYR 57 1HD TYR 57 -4.661 11.501 0.587 415 HD2 TYR 57 2HD TYR 57 -3.575 14.978 -1.700 416 HE1 TYR 57 1HE TYR 57 -4.578 10.135 -1.458 417 HE2 TYR 57 2HE TYR 57 -3.495 13.608 -3.750 418 HH TYR 57 HH TYR 57 -4.238 11.411 -4.675 419 H GLY 58 H GLY 58 -4.303 15.613 3.034 420 HA2 GLY 58 2HA GLY 58 -2.480 16.758 4.660 421 HA3 GLY 58 1HA GLY 58 -2.103 17.458 3.023 422 H ASP 59 H ASP 59 -5.234 16.347 4.406 423 HA ASP 59 HA ASP 59 -6.375 18.919 3.677 424 HB2 ASP 59 2HB ASP 59 -7.647 16.667 3.381 425 HB3 ASP 59 1HB ASP 59 -7.837 16.645 5.154 426 H ARG 60 H ARG 60 -5.695 16.855 6.619 427 HA ARG 60 HA ARG 60 -5.385 19.299 8.132 428 HB2 ARG 60 2HB ARG 60 -6.976 16.913 9.260 429 HB3 ARG 60 1HB ARG 60 -6.611 18.448 10.112 430 HG2 ARG 60 2HG ARG 60 -8.386 18.112 7.630 431 HG3 ARG 60 1HG ARG 60 -9.020 18.235 9.285 432 HD2 ARG 60 2HD ARG 60 -8.653 20.576 9.463 433 HD3 ARG 60 1HD ARG 60 -7.279 20.551 8.290 434 HE ARG 60 HE ARG 60 -8.832 20.046 6.474 435 HH11 ARG 60 1HH2 ARG 60 -10.539 21.633 9.247 436 HH12 ARG 60 2HH2 ARG 60 -12.106 21.272 8.588 437 HH21 ARG 60 1HH1 ARG 60 -10.780 19.816 5.593 438 HH22 ARG 60 2HH1 ARG 60 -12.273 20.206 6.415 439 H TYR 61 H TYR 61 -4.504 18.093 10.548 440 HA TYR 61 HA TYR 61 -2.751 15.967 9.748 441 HB2 TYR 61 2HB TYR 61 -1.763 18.674 10.908 442 HB3 TYR 61 1HB TYR 61 -0.814 17.141 10.997 443 HD1 TYR 61 2HD TYR 61 -0.184 15.940 8.872 444 HD2 TYR 61 1HD TYR 61 -1.779 19.933 8.832 445 HE1 TYR 61 2HE TYR 61 0.664 16.244 6.597 446 HE2 TYR 61 1HE TYR 61 -0.935 20.250 6.541 447 HH TYR 61 HH TYR 61 0.658 17.564 4.768 448 HA PRO 62 HA PRO 62 -4.315 15.562 13.982 449 HB2 PRO 62 2HB PRO 62 -3.417 13.020 14.595 450 HB3 PRO 62 1HB PRO 62 -4.662 13.268 13.312 451 HG2 PRO 62 2HG PRO 62 -1.626 12.923 12.958 452 HG3 PRO 62 1HG PRO 62 -2.947 12.038 12.086 453 HD2 PRO 62 2HD PRO 62 -1.658 14.338 11.097 454 HD3 PRO 62 1HD PRO 62 -3.393 13.942 10.696 455 H VAL 63 H VAL 63 -3.444 15.427 16.189 456 HA VAL 63 HA VAL 63 -0.852 16.444 16.532 457 HB VAL 63 HB VAL 63 -1.176 15.934 18.997 458 HG11 VAL 63 1HG1 VAL 63 -1.907 18.016 17.973 459 HG12 VAL 63 2HG1 VAL 63 -3.077 17.516 19.245 460 HG13 VAL 63 3HG1 VAL 63 -3.479 17.315 17.497 461 HG21 VAL 63 3HG2 VAL 63 -3.722 14.546 17.902 462 HG22 VAL 63 1HG2 VAL 63 -3.590 15.135 19.570 463 HG23 VAL 63 2HG2 VAL 63 -2.422 13.890 18.988 464 H THR 64 H THR 64 0.831 15.453 17.981 465 HA THR 64 HA THR 64 1.640 13.054 16.693 466 HB THR 64 HB THR 64 2.953 14.802 18.825 467 HG1 THR 64 1HG THR 64 2.573 15.250 16.325 468 HG21 THR 64 3HG2 THR 64 3.888 12.492 19.048 469 HG22 THR 64 1HG2 THR 64 5.075 13.561 18.250 470 HG23 THR 64 2HG2 THR 64 4.121 12.383 17.265 471 H GLU 65 H GLU 65 1.382 13.803 20.224 472 HA GLU 65 HA GLU 65 1.904 11.342 21.130 473 HB2 GLU 65 2HB GLU 65 1.768 13.469 22.444 474 HB3 GLU 65 1HB GLU 65 -0.022 13.376 22.411 475 HG2 GLU 65 2HG GLU 65 0.056 11.265 23.767 476 HG3 GLU 65 1HG GLU 65 1.862 11.283 23.685 477 H GLU 66 H GLU 66 -1.512 12.608 20.933 478 HA GLU 66 HA GLU 66 -2.371 9.840 21.141 479 HB2 GLU 66 2HB GLU 66 -4.130 12.328 21.180 480 HB3 GLU 66 1HB GLU 66 -4.622 10.616 21.415 481 HG2 GLU 66 2HG GLU 66 -2.508 10.841 23.246 482 HG3 GLU 66 1HG GLU 66 -3.201 12.496 23.313 483 H GLY 67 H GLY 67 -3.356 12.517 18.935 484 HA2 GLY 67 2HA GLY 67 -4.832 11.478 17.142 485 HA3 GLY 67 1HA GLY 67 -3.486 12.597 16.731 486 H ARG 68 H ARG 68 -1.254 10.986 16.854 487 HA ARG 68 HA ARG 68 -1.543 9.537 14.476 488 HB2 ARG 68 2HB ARG 68 0.613 10.539 15.428 489 HB3 ARG 68 1HB ARG 68 0.768 9.047 16.408 490 HG2 ARG 68 2HG ARG 68 0.285 7.863 13.982 491 HG3 ARG 68 1HG ARG 68 0.862 9.430 13.362 492 HD2 ARG 68 2HD ARG 68 2.331 7.373 15.149 493 HD3 ARG 68 1HD ARG 68 2.698 7.799 13.452 494 HE ARG 68 HE ARG 68 4.165 8.790 15.013 495 HH11 ARG 68 1HH2 ARG 68 4.287 9.587 12.576 496 HH12 ARG 68 2HH2 ARG 68 3.685 11.180 12.328 497 HH21 ARG 68 1HH1 ARG 68 2.157 11.466 15.489 498 HH22 ARG 68 2HH1 ARG 68 2.668 12.390 14.134 499 H LYS 69 H LYS 69 -1.242 8.350 17.894 500 HA LYS 69 HA LYS 69 -1.180 5.608 17.092 501 HB2 LYS 69 2HB LYS 69 -1.873 6.904 19.787 502 HB3 LYS 69 1HB LYS 69 -1.666 5.135 19.535 503 HG2 LYS 69 2HG LYS 69 0.528 7.241 19.030 504 HG3 LYS 69 1HG LYS 69 0.327 6.307 20.553 505 HD2 LYS 69 2HD LYS 69 0.568 4.160 19.245 506 HD3 LYS 69 1HD LYS 69 0.951 5.096 17.770 507 HE2 LYS 69 2HE LYS 69 2.571 5.152 20.426 508 HE3 LYS 69 1HE LYS 69 2.992 4.188 18.958 509 HZ1 LYS 69 3HZ LYS 69 2.862 7.167 19.124 510 HZ2 LYS 69 1HZ LYS 69 3.210 6.254 17.726 511 HZ3 LYS 69 2HZ LYS 69 4.245 6.188 19.061 512 H VAL 70 H VAL 70 -3.686 7.983 17.679 513 HA VAL 70 HA VAL 70 -5.848 6.127 17.756 514 HB VAL 70 HB VAL 70 -5.784 9.097 17.013 515 HG11 VAL 70 1HG1 VAL 70 -7.813 8.030 16.022 516 HG12 VAL 70 2HG1 VAL 70 -8.273 9.011 17.453 517 HG13 VAL 70 3HG1 VAL 70 -8.179 7.214 17.588 518 HG21 VAL 70 3HG2 VAL 70 -6.659 9.391 19.348 519 HG22 VAL 70 1HG2 VAL 70 -5.065 8.568 19.390 520 HG23 VAL 70 2HG2 VAL 70 -6.566 7.613 19.624 521 H ALA 71 H ALA 71 -4.332 8.148 15.154 522 HA ALA 71 HA ALA 71 -5.883 7.250 13.064 523 HB1 ALA 71 1HB ALA 71 -4.108 8.050 11.553 524 HB2 ALA 71 2HB ALA 71 -2.919 8.064 12.905 525 HB3 ALA 71 3HB ALA 71 -4.304 9.216 12.911 526 H GLU 72 H GLU 72 -2.770 5.891 14.293 527 HA GLU 72 HA GLU 72 -2.264 3.930 12.488 528 HB2 GLU 72 2HB GLU 72 -2.134 3.427 15.531 529 HB3 GLU 72 1HB GLU 72 -1.288 2.480 14.257 530 HG2 GLU 72 2HG GLU 72 -0.673 5.401 14.985 531 HG3 GLU 72 1HG GLU 72 0.196 3.956 15.578 532 H GLN 73 H GLN 73 -4.679 3.914 15.082 533 HA GLN 73 HA GLN 73 -5.129 1.118 14.944 534 HB2 GLN 73 2HB GLN 73 -5.462 2.719 16.942 535 HB3 GLN 73 1HB GLN 73 -7.014 3.200 16.191 536 HG2 GLN 73 2HG GLN 73 -7.856 0.861 16.397 537 HG3 GLN 73 1HG GLN 73 -6.217 0.287 16.887 538 HE21 GLN 73 1HE2 GLN 73 -7.349 -0.556 18.849 539 HE22 GLN 73 2HE2 GLN 73 -7.809 0.509 20.139 540 H VAL 74 H VAL 74 -6.435 3.931 13.256 541 HA VAL 74 HA VAL 74 -8.758 2.557 12.261 542 HB VAL 74 HB VAL 74 -7.479 5.054 11.033 543 HG11 VAL 74 1HG1 VAL 74 -9.372 3.951 9.780 544 HG12 VAL 74 2HG1 VAL 74 -9.857 5.556 10.425 545 HG13 VAL 74 3HG1 VAL 74 -10.408 4.048 11.251 546 HG21 VAL 74 3HG2 VAL 74 -8.979 6.364 12.626 547 HG22 VAL 74 1HG2 VAL 74 -7.566 5.585 13.392 548 HG23 VAL 74 2HG2 VAL 74 -9.194 4.841 13.579 549 H MET 75 H MET 75 -5.493 3.480 11.186 550 HA MET 75 HA MET 75 -5.607 2.636 8.555 551 HB2 MET 75 2HB MET 75 -3.261 2.715 10.553 552 HB3 MET 75 1HB MET 75 -3.051 2.455 8.795 553 HG2 MET 75 2HG MET 75 -3.782 4.652 8.230 554 HG3 MET 75 1HG MET 75 -4.528 4.936 9.819 555 HE1 MET 75 3HE MET 75 -1.571 7.560 9.375 556 HE2 MET 75 1HE MET 75 -3.343 7.356 9.599 557 HE3 MET 75 2HE MET 75 -2.556 6.801 8.083 558 H LYS 76 H LYS 76 -4.405 0.829 11.487 559 HA LYS 76 HA LYS 76 -3.906 -1.460 9.960 560 HB2 LYS 76 2HB LYS 76 -2.993 -1.022 12.358 561 HB3 LYS 76 1HB LYS 76 -4.553 -1.710 12.928 562 HG2 LYS 76 2HG LYS 76 -4.014 -3.708 11.288 563 HG3 LYS 76 1HG LYS 76 -2.359 -3.033 11.189 564 HD2 LYS 76 2HD LYS 76 -2.031 -3.510 13.620 565 HD3 LYS 76 1HD LYS 76 -3.777 -3.954 13.773 566 HE2 LYS 76 2HE LYS 76 -3.435 -5.789 12.049 567 HE3 LYS 76 1HE LYS 76 -1.659 -5.459 12.074 568 HZ1 LYS 76 3HZ LYS 76 -3.129 -6.178 14.577 569 HZ2 LYS 76 1HZ LYS 76 -1.452 -6.405 14.154 570 HZ3 LYS 76 2HZ LYS 76 -2.642 -7.315 13.435 571 H ALA 77 H ALA 77 -6.878 -0.389 11.647 572 HA ALA 77 HA ALA 77 -8.248 -2.824 11.439 573 HB1 ALA 77 1HB ALA 77 -9.418 0.028 11.354 574 HB2 ALA 77 2HB ALA 77 -9.099 -0.927 12.848 575 HB3 ALA 77 3HB ALA 77 -10.349 -1.485 11.675 576 H GLY 78 H GLY 78 -7.833 -0.115 9.150 577 HA2 GLY 78 2HA GLY 78 -9.648 -1.006 7.193 578 HA3 GLY 78 1HA GLY 78 -8.237 0.108 6.992 579 H ILE 79 H ILE 79 -6.096 -1.450 7.564 580 HA ILE 79 HA ILE 79 -5.746 -2.951 5.247 581 HB ILE 79 HB ILE 79 -4.183 -2.997 7.874 582 HG12 ILE 79 2HG1 ILE 79 -3.591 -1.566 5.199 583 HG13 ILE 79 1HG1 ILE 79 -4.351 -0.762 6.597 584 HG21 ILE 79 1HG2 ILE 79 -2.301 -3.982 6.473 585 HG22 ILE 79 2HG2 ILE 79 -3.434 -4.109 5.079 586 HG23 ILE 79 3HG2 ILE 79 -3.699 -5.088 6.565 587 HD11 ILE 79 3HD ILE 79 -1.514 -1.990 6.565 588 HD12 ILE 79 1HD ILE 79 -1.942 -0.251 6.564 589 HD13 ILE 79 2HD ILE 79 -2.314 -1.259 8.009 590 H GLU 80 H GLU 80 -6.554 -4.017 8.615 591 HA GLU 80 HA GLU 80 -6.455 -6.749 8.052 592 HB2 GLU 80 2HB GLU 80 -8.209 -5.203 10.032 593 HB3 GLU 80 1HB GLU 80 -8.142 -7.003 9.986 594 HG2 GLU 80 2HG GLU 80 -5.731 -6.996 10.543 595 HG3 GLU 80 1HG GLU 80 -5.697 -5.200 10.516 596 H VAL 81 H VAL 81 -9.114 -4.401 7.577 597 HA VAL 81 HA VAL 81 -11.081 -6.335 6.928 598 HB VAL 81 HB VAL 81 -10.786 -3.328 6.545 599 HG11 VAL 81 1HG1 VAL 81 -13.211 -3.329 5.745 600 HG12 VAL 81 2HG1 VAL 81 -13.075 -5.102 5.470 601 HG13 VAL 81 3HG1 VAL 81 -12.043 -3.954 4.540 602 HG21 VAL 81 3HG2 VAL 81 -12.761 -5.102 8.149 603 HG22 VAL 81 1HG2 VAL 81 -12.647 -3.307 8.206 604 HG23 VAL 81 2HG2 VAL 81 -11.294 -4.310 8.833 605 H PHE 82 H PHE 82 -8.991 -4.176 4.877 606 HA PHE 82 HA PHE 82 -10.001 -5.242 2.483 607 HB2 PHE 82 2HB PHE 82 -7.258 -3.913 2.981 608 HB3 PHE 82 1HB PHE 82 -8.010 -4.165 1.364 609 HD1 PHE 82 2HD PHE 82 -10.888 -3.327 1.895 610 HD2 PHE 82 1HD PHE 82 -7.142 -1.610 3.153 611 HE1 PHE 82 2HE PHE 82 -11.955 -1.122 2.072 612 HE2 PHE 82 1HE PHE 82 -8.215 0.599 3.313 613 HZ PHE 82 HZ PHE 82 -10.626 0.861 2.776 614 H ALA 83 H ALA 83 -7.103 -6.108 4.435 615 HA ALA 83 HA ALA 83 -6.116 -7.948 2.582 616 HB1 ALA 83 1HB ALA 83 -4.720 -8.849 4.447 617 HB2 ALA 83 2HB ALA 83 -5.717 -7.912 5.635 618 HB3 ALA 83 3HB ALA 83 -4.705 -7.049 4.423 619 H LEU 84 H LEU 84 -8.698 -8.240 4.995 620 HA LEU 84 HA LEU 84 -8.692 -11.052 5.240 621 HB2 LEU 84 2HB LEU 84 -9.869 -9.513 6.799 622 HB3 LEU 84 1HB LEU 84 -11.044 -9.073 5.529 623 HG LEU 84 HG LEU 84 -10.704 -11.982 6.438 624 HD11 LEU 84 1HD1 LEU 84 -12.364 -11.619 8.260 625 HD12 LEU 84 2HD1 LEU 84 -12.393 -9.850 7.904 626 HD13 LEU 84 3HD1 LEU 84 -10.889 -10.625 8.520 627 HD21 LEU 84 3HD2 LEU 84 -13.193 -12.111 5.998 628 HD22 LEU 84 1HD2 LEU 84 -12.293 -11.648 4.522 629 HD23 LEU 84 2HD2 LEU 84 -13.181 -10.392 5.457 630 H VAL 85 H VAL 85 -10.086 -8.794 2.887 631 HA VAL 85 HA VAL 85 -11.892 -10.489 1.650 632 HB VAL 85 HB VAL 85 -10.321 -8.143 0.461 633 HG11 VAL 85 1HG1 VAL 85 -11.363 -9.328 -1.405 634 HG12 VAL 85 2HG1 VAL 85 -12.372 -7.895 -1.039 635 HG13 VAL 85 3HG1 VAL 85 -12.909 -9.532 -0.505 636 HG21 VAL 85 3HG2 VAL 85 -11.503 -7.451 2.506 637 HG22 VAL 85 1HG2 VAL 85 -13.009 -8.291 2.001 638 HG23 VAL 85 2HG2 VAL 85 -12.421 -6.846 1.103 639 H THR 86 H THR 86 -8.430 -10.662 1.614 640 HA THR 86 HA THR 86 -7.941 -11.771 -0.848 641 HB THR 86 HB THR 86 -6.577 -12.555 1.762 642 HG1 THR 86 1HG THR 86 -6.303 -10.489 1.751 643 HG21 THR 86 3HG2 THR 86 -5.618 -12.456 -1.197 644 HG22 THR 86 1HG2 THR 86 -5.867 -13.954 -0.223 645 HG23 THR 86 2HG2 THR 86 -4.570 -12.798 0.228 646 H ALA 87 H ALA 87 -9.693 -13.155 1.864 647 HA ALA 87 HA ALA 87 -9.544 -15.862 1.209 648 HB1 ALA 87 1HB ALA 87 -11.715 -16.081 2.430 649 HB2 ALA 87 2HB ALA 87 -11.966 -14.295 2.318 650 HB3 ALA 87 3HB ALA 87 -10.624 -14.953 3.308 651 H ALA 88 H ALA 88 -11.337 -13.208 -0.323 652 HA ALA 88 HA ALA 88 -12.958 -15.028 -1.923 653 HB1 ALA 88 1HB ALA 88 -12.619 -11.963 -2.087 654 HB2 ALA 88 2HB ALA 88 -13.967 -12.819 -1.257 655 HB3 ALA 88 3HB ALA 88 -13.785 -12.947 -3.045 656 H LEU 89 H LEU 89 -10.185 -12.773 -2.196 657 HA LEU 89 HA LEU 89 -9.956 -12.886 -4.944 658 HB2 LEU 89 2HB LEU 89 -7.677 -12.394 -2.946 659 HB3 LEU 89 1HB LEU 89 -7.657 -11.965 -4.685 660 HG LEU 89 HG LEU 89 -9.595 -10.784 -2.597 661 HD11 LEU 89 1HD1 LEU 89 -8.245 -8.714 -2.760 662 HD12 LEU 89 2HD1 LEU 89 -7.090 -9.522 -3.877 663 HD13 LEU 89 3HD1 LEU 89 -7.238 -10.080 -2.172 664 HD21 LEU 89 3HD2 LEU 89 -10.611 -10.740 -4.865 665 HD22 LEU 89 1HD2 LEU 89 -9.108 -10.009 -5.548 666 HD23 LEU 89 2HD2 LEU 89 -10.112 -9.086 -4.371 667 H ALA 90 H ALA 90 -8.335 -14.972 -2.503 668 HA ALA 90 HA ALA 90 -6.643 -16.168 -4.441 669 HB1 ALA 90 1HB ALA 90 -6.055 -16.183 -2.035 670 HB2 ALA 90 2HB ALA 90 -6.175 -17.867 -2.661 671 HB3 ALA 90 3HB ALA 90 -7.519 -17.167 -1.677 672 H THR 91 H THR 91 -10.018 -16.500 -3.966 673 HA THR 91 HA THR 91 -10.122 -19.264 -4.827 674 HB THR 91 HB THR 91 -12.413 -17.243 -4.591 675 HG1 THR 91 1HG THR 91 -11.514 -17.450 -2.574 676 HG21 THR 91 3HG2 THR 91 -12.954 -19.313 -5.918 677 HG22 THR 91 1HG2 THR 91 -13.782 -19.350 -4.335 678 HG23 THR 91 2HG2 THR 91 -12.304 -20.350 -4.593 679 H ASP 92 H ASP 92 -9.872 -16.015 -6.233 680 HA ASP 92 HA ASP 92 -11.590 -16.631 -8.377 681 HB2 ASP 92 2HB ASP 92 -9.866 -14.235 -7.704 682 HB3 ASP 92 1HB ASP 92 -10.325 -14.462 -9.427 683 H PHE 93 H PHE 93 -8.208 -17.333 -8.014 684 HA PHE 93 HA PHE 93 -8.009 -17.778 -10.872 685 HB2 PHE 93 2HB PHE 93 -5.838 -18.528 -10.622 686 HB3 PHE 93 1HB PHE 93 -5.990 -17.221 -9.419 687 HD1 PHE 93 1HD PHE 93 -6.233 -17.927 -6.909 688 HD2 PHE 93 2HD PHE 93 -5.211 -20.688 -10.034 689 HE1 PHE 93 1HE PHE 93 -5.403 -19.534 -5.229 690 HE2 PHE 93 2HE PHE 93 -4.339 -22.282 -8.348 691 HZ PHE 93 HZ PHE 93 -4.428 -21.695 -5.936 692 H VAL 94 H VAL 94 -9.143 -19.575 -8.070 693 HA VAL 94 HA VAL 94 -8.416 -22.136 -8.998 694 HB VAL 94 HB VAL 94 -10.694 -21.424 -7.073 695 HG11 VAL 94 1HG1 VAL 94 -8.903 -23.947 -7.342 696 HG12 VAL 94 2HG1 VAL 94 -10.628 -23.849 -7.834 697 HG13 VAL 94 3HG1 VAL 94 -10.179 -23.685 -6.101 698 HG21 VAL 94 3HG2 VAL 94 -8.969 -21.641 -5.275 699 HG22 VAL 94 1HG2 VAL 94 -8.581 -20.269 -6.349 700 HG23 VAL 94 2HG2 VAL 94 -7.669 -21.808 -6.513 701 H ARG 95 H ARG 95 -11.035 -19.906 -9.578 702 HA ARG 95 HA ARG 95 -12.864 -21.723 -10.740 703 HB2 ARG 95 2HB ARG 95 -12.646 -18.737 -11.418 704 HB3 ARG 95 1HB ARG 95 -14.100 -19.790 -11.492 705 HG2 ARG 95 2HG ARG 95 -13.993 -19.937 -8.914 706 HG3 ARG 95 1HG ARG 95 -12.608 -18.789 -8.989 707 HD2 ARG 95 2HD ARG 95 -14.268 -17.215 -10.325 708 HD3 ARG 95 1HD ARG 95 -15.580 -18.239 -9.644 709 HE ARG 95 HE ARG 95 -13.689 -16.367 -8.213 710 HH11 ARG 95 1HH2 ARG 95 -16.481 -18.695 -7.728 711 HH12 ARG 95 2HH2 ARG 95 -16.994 -17.829 -6.341 712 HH21 ARG 95 1HH1 ARG 95 -14.406 -15.367 -6.434 713 HH22 ARG 95 2HH1 ARG 95 -15.786 -15.903 -5.499 714 H ARG 96 H ARG 96 -9.780 -20.769 -11.880 715 HA ARG 96 HA ARG 96 -10.349 -20.450 -14.626 716 HB2 ARG 96 2HB ARG 96 -7.993 -20.752 -15.065 717 HB3 ARG 96 1HB ARG 96 -8.070 -19.902 -13.484 718 HG2 ARG 96 2HG ARG 96 -7.863 -22.232 -12.374 719 HG3 ARG 96 1HG ARG 96 -7.575 -22.896 -14.015 720 HD2 ARG 96 2HD ARG 96 -5.413 -21.602 -14.175 721 HD3 ARG 96 1HD ARG 96 -5.718 -20.954 -12.505 722 HE ARG 96 HE ARG 96 -5.261 -23.067 -11.592 723 HH11 ARG 96 1HH2 ARG 96 -5.448 -23.540 -15.159 724 HH12 ARG 96 2HH2 ARG 96 -5.496 -25.247 -15.044 725 HH21 ARG 96 1HH1 ARG 96 -5.377 -25.463 -11.489 726 HH22 ARG 96 2HH1 ARG 96 -5.689 -26.307 -12.950 727 H GLU 97 H GLU 97 -10.233 -23.201 -12.461 728 HA GLU 97 HA GLU 97 -9.693 -25.042 -14.667 729 HB2 GLU 97 2HB GLU 97 -8.332 -25.079 -12.418 730 HB3 GLU 97 1HB GLU 97 -9.831 -25.695 -11.662 731 HG2 GLU 97 2HG GLU 97 -8.291 -27.528 -12.092 732 HG3 GLU 97 1HG GLU 97 -9.669 -27.756 -13.203 733 H GLU 98 H GLU 98 -11.100 -27.141 -14.212 734 HA GLU 98 HA GLU 98 -13.016 -28.127 -14.267 735 HB2 GLU 98 2HB GLU 98 -14.385 -25.927 -12.667 736 HB3 GLU 98 1HB GLU 98 -14.947 -27.607 -12.962 737 HG2 GLU 98 2HG GLU 98 -12.781 -28.417 -11.770 738 HG3 GLU 98 1HG GLU 98 -12.457 -26.692 -11.357 739 H GLU 99 H GLU 99 -13.832 -24.646 -14.648 740 HA GLU 99 HA GLU 99 -15.498 -25.125 -16.904 741 HB2 GLU 99 2HB GLU 99 -14.214 -22.532 -15.863 742 HB3 GLU 99 1HB GLU 99 -15.511 -22.643 -17.101 743 HG2 GLU 99 2HG GLU 99 -16.981 -23.834 -15.378 744 HG3 GLU 99 1HG GLU 99 -15.698 -23.549 -14.133 745 H ARG 100 H ARG 100 -12.108 -25.107 -16.534 746 HA ARG 100 HA ARG 100 -11.400 -24.173 -19.117 747 HB2 ARG 100 2HB ARG 100 -9.768 -24.368 -17.220 748 HB3 ARG 100 1HB ARG 100 -9.831 -26.153 -17.346 749 HG2 ARG 100 2HG ARG 100 -8.737 -26.070 -19.542 750 HG3 ARG 100 1HG ARG 100 -9.122 -24.329 -19.722 751 HD2 ARG 100 2HD ARG 100 -6.725 -24.622 -19.274 752 HD3 ARG 100 1HD ARG 100 -7.523 -23.699 -17.940 753 HE ARG 100 HE ARG 100 -7.652 -25.994 -16.684 754 HH11 ARG 100 1HH2 ARG 100 -4.936 -25.443 -19.137 755 HH12 ARG 100 2HH2 ARG 100 -3.820 -26.306 -18.219 756 HH21 ARG 100 1HH1 ARG 100 -6.109 -27.258 -15.578 757 HH22 ARG 100 2HH1 ARG 100 -4.748 -27.784 -16.439 758 H ARG 101 H ARG 101 -12.479 -27.284 -17.793 759 HA ARG 101 HA ARG 101 -11.866 -28.615 -20.339 760 HB2 ARG 101 2HB ARG 101 -12.855 -29.674 -17.619 761 HB3 ARG 101 1HB ARG 101 -12.530 -30.704 -19.055 762 HG2 ARG 101 2HG ARG 101 -10.412 -28.931 -17.656 763 HG3 ARG 101 1HG ARG 101 -10.679 -30.675 -17.301 764 HD2 ARG 101 2HD ARG 101 -10.076 -31.338 -19.578 765 HD3 ARG 101 1HD ARG 101 -9.963 -29.617 -20.126 766 HE ARG 101 HE ARG 101 -8.116 -29.684 -18.075 767 HH11 ARG 101 1HH2 ARG 101 -8.501 -32.001 -20.801 768 HH12 ARG 101 2HH2 ARG 101 -7.089 -31.545 -21.613 769 HH21 ARG 101 1HH1 ARG 101 -5.769 -29.732 -18.795 770 HH22 ARG 101 2HH1 ARG 101 -5.420 -30.371 -20.345 771 H GLY 102 H GLY 102 -14.482 -27.306 -18.362 772 HA2 GLY 102 2HA GLY 102 -16.418 -26.550 -19.298 773 HA3 GLY 102 1HA GLY 102 -16.230 -27.686 -20.689 774 H HIS 103 H HIS 103 -15.437 -29.529 -18.055 775 HA HIS 103 HA HIS 103 -17.987 -29.933 -16.934 776 HB2 HIS 103 2HB HIS 103 -18.455 -31.373 -18.889 777 HB3 HIS 103 1HB HIS 103 -16.804 -32.082 -18.810 778 HD1 HIS 103 1HD HIS 103 -16.675 -34.252 -17.579 779 HD2 HIS 103 2HD HIS 103 -19.931 -31.936 -16.222 780 HE1 HIS 103 1HE HIS 103 -17.789 -35.519 -15.651 781 HE2 HIS 103 2HE HIS 103 -19.734 -34.026 -14.847 782 H1 SER 1 H SER 1 1.635 -17.391 -22.752 783 HA SER 1 HA SER 1 2.857 -15.822 -21.046 784 HB2 SER 1 2HB SER 1 1.850 -13.797 -22.262 785 HB3 SER 1 1HB SER 1 0.213 -14.452 -21.918 786 HG SER 1 1HG SER 1 2.199 -13.441 -20.136 787 H ALA 2 H ALA 2 0.065 -15.420 -19.594 788 HA ALA 2 HA ALA 2 -0.924 -18.153 -19.770 789 HB1 ALA 2 1HB ALA 2 -0.816 -18.593 -17.326 790 HB2 ALA 2 2HB ALA 2 0.069 -17.037 -17.079 791 HB3 ALA 2 3HB ALA 2 0.832 -18.376 -17.997 792 H ASP 3 H ASP 3 -2.933 -18.450 -18.631 793 HA ASP 3 HA ASP 3 -4.705 -16.530 -19.358 794 HB2 ASP 3 2HB ASP 3 -5.270 -18.760 -17.289 795 HB3 ASP 3 1HB ASP 3 -6.430 -17.991 -18.432 796 H HIS 4 H HIS 4 -3.136 -17.085 -16.304 797 HA HIS 4 HA HIS 4 -5.031 -15.596 -14.719 798 HB2 HIS 4 2HB HIS 4 -3.198 -15.606 -12.925 799 HB3 HIS 4 1HB HIS 4 -3.863 -17.182 -13.415 800 HD1 HIS 4 1HD HIS 4 -0.527 -15.134 -13.948 801 HD2 HIS 4 2HD HIS 4 -2.096 -19.070 -14.346 802 HE1 HIS 4 1HE HIS 4 1.342 -16.649 -14.252 803 HE2 HIS 4 2HE HIS 4 0.446 -18.983 -14.698 804 H GLU 5 H GLU 5 -2.096 -14.865 -16.602 805 HA GLU 5 HA GLU 5 -1.670 -12.323 -15.445 806 HB2 GLU 5 2HB GLU 5 -0.827 -13.218 -18.270 807 HB3 GLU 5 1HB GLU 5 -0.078 -11.953 -17.245 808 HG2 GLU 5 2HG GLU 5 -0.014 -15.004 -16.699 809 HG3 GLU 5 1HG GLU 5 1.287 -14.027 -17.461 810 H ARG 6 H ARG 6 -3.521 -13.662 -18.160 811 HA ARG 6 HA ARG 6 -4.122 -11.341 -19.552 812 HB2 ARG 6 2HB ARG 6 -5.952 -13.774 -19.008 813 HB3 ARG 6 1HB ARG 6 -6.314 -12.526 -20.223 814 HG2 ARG 6 2HG ARG 6 -3.697 -14.132 -20.373 815 HG3 ARG 6 1HG ARG 6 -5.246 -14.846 -20.910 816 HD2 ARG 6 2HD ARG 6 -4.037 -12.225 -22.028 817 HD3 ARG 6 1HD ARG 6 -3.977 -13.833 -22.838 818 HE ARG 6 HE ARG 6 -6.226 -11.946 -22.700 819 HH11 ARG 6 1HH2 ARG 6 -5.715 -15.560 -22.920 820 HH12 ARG 6 2HH2 ARG 6 -6.383 -15.634 -24.490 821 HH21 ARG 6 1HH1 ARG 6 -7.854 -12.335 -24.429 822 HH22 ARG 6 2HH1 ARG 6 -8.114 -13.905 -24.963 823 H GLU 7 H GLU 7 -5.774 -12.846 -16.781 824 HA GLU 7 HA GLU 7 -7.959 -11.115 -16.700 825 HB2 GLU 7 2HB GLU 7 -7.260 -13.507 -15.480 826 HB3 GLU 7 1HB GLU 7 -6.937 -12.397 -14.127 827 HG2 GLU 7 2HG GLU 7 -9.200 -13.191 -13.850 828 HG3 GLU 7 1HG GLU 7 -9.350 -11.497 -14.449 829 H ALA 8 H ALA 8 -4.839 -11.224 -15.011 830 HA ALA 8 HA ALA 8 -5.214 -9.043 -13.310 831 HB1 ALA 8 1HB ALA 8 -3.415 -10.778 -12.960 832 HB2 ALA 8 2HB ALA 8 -2.682 -9.140 -13.079 833 HB3 ALA 8 3HB ALA 8 -2.613 -10.252 -14.484 834 H GLN 9 H GLN 9 -3.678 -9.313 -16.566 835 HA GLN 9 HA GLN 9 -2.827 -6.641 -16.639 836 HB2 GLN 9 2HB GLN 9 -1.967 -8.521 -18.184 837 HB3 GLN 9 1HB GLN 9 -3.504 -8.358 -19.096 838 HG2 GLN 9 2HG GLN 9 -2.813 -5.781 -19.297 839 HG3 GLN 9 1HG GLN 9 -1.201 -6.323 -18.754 840 HE21 GLN 9 1HE2 GLN 9 -2.784 -5.484 -21.477 841 HE22 GLN 9 2HE2 GLN 9 -2.079 -6.544 -22.649 842 H LYS 10 H LYS 10 -5.870 -8.267 -17.658 843 HA LYS 10 HA LYS 10 -6.856 -6.101 -19.133 844 HB2 LYS 10 2HB LYS 10 -7.823 -8.483 -19.144 845 HB3 LYS 10 1HB LYS 10 -8.558 -8.114 -17.551 846 HG2 LYS 10 2HG LYS 10 -9.719 -6.112 -18.692 847 HG3 LYS 10 1HG LYS 10 -9.127 -6.728 -20.265 848 HD2 LYS 10 2HD LYS 10 -10.428 -8.848 -19.929 849 HD3 LYS 10 1HD LYS 10 -10.911 -8.305 -18.291 850 HE2 LYS 10 2HE LYS 10 -11.757 -7.012 -20.979 851 HE3 LYS 10 1HE LYS 10 -12.796 -7.948 -19.829 852 HZ1 LYS 10 3HZ LYS 10 -13.219 -5.692 -19.406 853 HZ2 LYS 10 1HZ LYS 10 -11.587 -5.253 -19.500 854 HZ3 LYS 10 2HZ LYS 10 -12.179 -6.161 -18.154 855 H ALA 11 H ALA 11 -6.873 -6.807 -15.652 856 HA ALA 11 HA ALA 11 -8.781 -4.910 -14.892 857 HB1 ALA 11 1HB ALA 11 -7.904 -6.706 -13.349 858 HB2 ALA 11 2HB ALA 11 -7.793 -5.064 -12.615 859 HB3 ALA 11 3HB ALA 11 -6.320 -5.852 -13.290 860 H GLU 12 H GLU 12 -5.325 -4.586 -15.692 861 HA GLU 12 HA GLU 12 -4.935 -2.038 -14.585 862 HB2 GLU 12 2HB GLU 12 -3.549 -3.272 -17.045 863 HB3 GLU 12 1HB GLU 12 -2.973 -1.860 -16.109 864 HG2 GLU 12 2HG GLU 12 -2.639 -3.341 -14.087 865 HG3 GLU 12 1HG GLU 12 -3.213 -4.756 -15.043 866 H GLU 13 H GLU 13 -6.360 -3.124 -17.666 867 HA GLU 13 HA GLU 13 -6.242 -0.592 -18.961 868 HB2 GLU 13 2HB GLU 13 -8.031 -3.035 -19.416 869 HB3 GLU 13 1HB GLU 13 -8.193 -1.539 -20.384 870 HG2 GLU 13 2HG GLU 13 -5.517 -3.054 -20.198 871 HG3 GLU 13 1HG GLU 13 -6.784 -3.436 -21.422 872 H GLU 14 H GLU 14 -8.635 -2.245 -16.874 873 HA GLU 14 HA GLU 14 -10.624 -0.287 -17.277 874 HB2 GLU 14 2HB GLU 14 -10.206 -2.430 -15.156 875 HB3 GLU 14 1HB GLU 14 -11.510 -1.226 -14.947 876 HG2 GLU 14 2HG GLU 14 -11.262 -3.034 -17.438 877 HG3 GLU 14 1HG GLU 14 -12.315 -3.352 -16.009 878 H LEU 15 H LEU 15 -7.835 -0.389 -15.119 879 HA LEU 15 HA LEU 15 -8.725 1.617 -13.377 880 HB2 LEU 15 2HB LEU 15 -6.760 0.123 -12.920 881 HB3 LEU 15 1HB LEU 15 -5.830 0.957 -14.199 882 HG LEU 15 HG LEU 15 -5.784 3.034 -12.911 883 HD11 LEU 15 1HD1 LEU 15 -6.791 3.188 -10.583 884 HD12 LEU 15 2HD1 LEU 15 -7.692 1.663 -10.911 885 HD13 LEU 15 3HD1 LEU 15 -8.008 3.141 -11.892 886 HD21 LEU 15 3HD2 LEU 15 -4.500 2.293 -10.900 887 HD22 LEU 15 1HD2 LEU 15 -4.084 1.293 -12.337 888 HD23 LEU 15 2HD2 LEU 15 -5.170 0.634 -11.060 889 H GLN 16 H GLN 16 -7.056 1.756 -16.534 890 HA GLN 16 HA GLN 16 -6.410 4.488 -16.458 891 HB2 GLN 16 2HB GLN 16 -7.005 2.673 -18.869 892 HB3 GLN 16 1HB GLN 16 -6.277 4.309 -18.984 893 HG2 GLN 16 2HG GLN 16 -4.261 3.597 -17.777 894 HG3 GLN 16 1HG GLN 16 -4.978 1.986 -17.408 895 HE21 GLN 16 1HE2 GLN 16 -4.495 0.366 -18.852 896 HE22 GLN 16 2HE2 GLN 16 -4.211 0.527 -20.532 897 H LYS 17 H LYS 17 -9.326 2.731 -17.407 898 HA LYS 17 HA LYS 17 -10.666 4.891 -18.602 899 HB2 LYS 17 2HB LYS 17 -11.181 2.339 -18.704 900 HB3 LYS 17 1HB LYS 17 -11.967 2.538 -17.108 901 HG2 LYS 17 2HG LYS 17 -13.508 4.314 -18.259 902 HG3 LYS 17 1HG LYS 17 -12.699 3.861 -19.798 903 HD2 LYS 17 2HD LYS 17 -14.662 2.533 -19.811 904 HD3 LYS 17 1HD LYS 17 -13.365 1.414 -19.257 905 HE2 LYS 17 2HE LYS 17 -14.165 2.135 -16.794 906 HE3 LYS 17 1HE LYS 17 -15.635 2.749 -17.635 907 HZ1 LYS 17 3HZ LYS 17 -15.753 0.376 -18.591 908 HZ2 LYS 17 1HZ LYS 17 -16.093 0.646 -16.935 909 HZ3 LYS 17 2HZ LYS 17 -14.597 -0.020 -17.386 910 H VAL 18 H VAL 18 -10.426 3.746 -15.194 911 HA VAL 18 HA VAL 18 -12.463 5.401 -14.170 912 HB VAL 18 HB VAL 18 -9.958 4.429 -12.676 913 HG11 VAL 18 1HG1 VAL 18 -12.704 5.460 -11.663 914 HG12 VAL 18 2HG1 VAL 18 -11.111 6.274 -11.437 915 HG13 VAL 18 3HG1 VAL 18 -11.433 4.708 -10.633 916 HG21 VAL 18 3HG2 VAL 18 -11.531 2.612 -11.837 917 HG22 VAL 18 1HG2 VAL 18 -11.166 2.494 -13.579 918 HG23 VAL 18 2HG2 VAL 18 -12.755 3.153 -13.045 919 H LEU 19 H LEU 19 -8.960 5.881 -14.749 920 HA LEU 19 HA LEU 19 -8.654 8.260 -13.386 921 HB2 LEU 19 2HB LEU 19 -7.332 7.539 -16.082 922 HB3 LEU 19 1HB LEU 19 -6.767 8.809 -14.951 923 HG LEU 19 HG LEU 19 -6.844 5.795 -14.337 924 HD11 LEU 19 1HD1 LEU 19 -4.369 5.887 -14.593 925 HD12 LEU 19 2HD1 LEU 19 -4.480 7.620 -15.081 926 HD13 LEU 19 3HD1 LEU 19 -5.202 6.349 -16.126 927 HD21 LEU 19 3HD2 LEU 19 -5.346 6.455 -12.409 928 HD22 LEU 19 1HD2 LEU 19 -7.029 7.068 -12.238 929 HD23 LEU 19 2HD2 LEU 19 -5.712 8.183 -12.747 930 H GLU 20 H GLU 20 -9.752 7.656 -16.723 931 HA GLU 20 HA GLU 20 -9.859 10.324 -17.567 932 HB2 GLU 20 2HB GLU 20 -11.424 7.854 -18.538 933 HB3 GLU 20 1HB GLU 20 -11.396 9.438 -19.388 934 HG2 GLU 20 2HG GLU 20 -8.948 9.238 -19.781 935 HG3 GLU 20 1HG GLU 20 -8.896 7.693 -18.860 936 H GLU 21 H GLU 21 -12.356 8.113 -16.174 937 HA GLU 21 HA GLU 21 -14.398 10.054 -16.318 938 HB2 GLU 21 2HB GLU 21 -14.260 7.616 -14.448 939 HB3 GLU 21 1HB GLU 21 -15.688 8.663 -14.749 940 HG2 GLU 21 2HG GLU 21 -15.422 8.018 -17.280 941 HG3 GLU 21 1HG GLU 21 -14.305 6.726 -16.716 942 H ALA 22 H ALA 22 -12.118 9.120 -13.714 943 HA ALA 22 HA ALA 22 -13.248 10.719 -11.724 944 HB1 ALA 22 1HB ALA 22 -10.372 9.702 -12.062 945 HB2 ALA 22 2HB ALA 22 -11.689 8.895 -11.153 946 HB3 ALA 22 3HB ALA 22 -11.020 10.459 -10.559 947 H SER 23 H SER 23 -10.943 11.482 -14.305 948 HA SER 23 HA SER 23 -10.071 13.961 -13.364 949 HB2 SER 23 2HB SER 23 -9.131 12.681 -15.373 950 HB3 SER 23 1HB SER 23 -10.608 13.123 -16.295 951 HG SER 23 1HG SER 23 -9.047 14.601 -16.779 952 H LYS 24 H LYS 24 -12.975 12.972 -15.179 953 HA LYS 24 HA LYS 24 -13.910 15.592 -15.711 954 HB2 LYS 24 2HB LYS 24 -14.454 13.215 -16.807 955 HB3 LYS 24 1HB LYS 24 -15.742 13.124 -15.581 956 HG2 LYS 24 2HG LYS 24 -15.338 15.424 -17.618 957 HG3 LYS 24 1HG LYS 24 -16.323 13.972 -17.965 958 HD2 LYS 24 2HD LYS 24 -16.965 15.957 -15.689 959 HD3 LYS 24 1HD LYS 24 -17.588 16.066 -17.358 960 HE2 LYS 24 2HE LYS 24 -18.629 13.747 -17.105 961 HE3 LYS 24 1HE LYS 24 -18.160 13.781 -15.355 962 HZ1 LYS 24 3HZ LYS 24 -19.922 15.761 -16.720 963 HZ2 LYS 24 1HZ LYS 24 -19.510 15.801 -15.106 964 HZ3 LYS 24 2HZ LYS 24 -20.440 14.499 -15.714 965 H LYS 25 H LYS 25 -14.419 13.156 -13.158 966 HA LYS 25 HA LYS 25 -16.465 14.545 -11.813 967 HB2 LYS 25 2HB LYS 25 -14.396 12.587 -10.647 968 HB3 LYS 25 1HB LYS 25 -15.848 13.209 -9.791 969 HG2 LYS 25 2HG LYS 25 -17.312 12.232 -11.594 970 HG3 LYS 25 1HG LYS 25 -15.868 11.470 -12.342 971 HD2 LYS 25 2HD LYS 25 -15.461 10.186 -10.205 972 HD3 LYS 25 1HD LYS 25 -16.888 11.013 -9.478 973 HE2 LYS 25 2HE LYS 25 -18.327 10.008 -11.382 974 HE3 LYS 25 1HE LYS 25 -16.890 9.011 -11.848 975 HZ1 LYS 25 3HZ LYS 25 -18.348 7.794 -10.443 976 HZ2 LYS 25 1HZ LYS 25 -18.318 9.001 -9.223 977 HZ3 LYS 25 2HZ LYS 25 -16.915 8.096 -9.570 978 H ALA 26 H ALA 26 -12.898 14.426 -11.208 979 HA ALA 26 HA ALA 26 -12.843 16.060 -9.028 980 HB1 ALA 26 1HB ALA 26 -10.723 15.882 -11.265 981 HB2 ALA 26 2HB ALA 26 -10.877 14.750 -9.871 982 HB3 ALA 26 3HB ALA 26 -10.447 16.469 -9.577 983 H VAL 27 H VAL 27 -12.618 17.129 -12.512 984 HA VAL 27 HA VAL 27 -12.164 19.810 -11.745 985 HB VAL 27 HB VAL 27 -12.759 20.500 -14.048 986 HG11 VAL 27 1HG1 VAL 27 -10.856 19.388 -15.114 987 HG12 VAL 27 2HG1 VAL 27 -10.942 18.032 -13.936 988 HG13 VAL 27 3HG1 VAL 27 -10.459 19.685 -13.381 989 HG21 VAL 27 3HG2 VAL 27 -13.392 17.501 -14.483 990 HG22 VAL 27 1HG2 VAL 27 -13.240 18.741 -15.775 991 HG23 VAL 27 2HG2 VAL 27 -14.576 18.850 -14.579 992 H GLU 28 H GLU 28 -15.165 17.971 -12.033 993 HA GLU 28 HA GLU 28 -16.738 20.427 -12.137 994 HB2 GLU 28 2HB GLU 28 -17.545 17.468 -12.068 995 HB3 GLU 28 1HB GLU 28 -18.703 18.846 -12.015 996 HG2 GLU 28 2HG GLU 28 -17.844 19.678 -14.217 997 HG3 GLU 28 1HG GLU 28 -16.720 18.271 -14.315 998 H ALA 29 H ALA 29 -15.716 17.865 -9.915 999 HA ALA 29 HA ALA 29 -17.407 18.492 -7.798 1000 HB1 ALA 29 1HB ALA 29 -14.605 17.193 -7.806 1001 HB2 ALA 29 2HB ALA 29 -16.149 16.319 -8.101 1002 HB3 ALA 29 3HB ALA 29 -15.821 17.045 -6.508 1003 H GLU 30 H GLU 30 -13.947 19.460 -8.452 1004 HA GLU 30 HA GLU 30 -13.813 21.080 -6.162 1005 HB2 GLU 30 2HB GLU 30 -12.161 20.897 -8.694 1006 HB3 GLU 30 1HB GLU 30 -11.854 22.242 -7.559 1007 HG2 GLU 30 2HG GLU 30 -11.981 19.426 -6.385 1008 HG3 GLU 30 1HG GLU 30 -10.549 19.890 -7.357 1009 H ARG 31 H ARG 31 -15.310 21.736 -9.269 1010 HA ARG 31 HA ARG 31 -15.129 24.618 -8.924 1011 HB2 ARG 31 2HB ARG 31 -16.233 22.754 -11.008 1012 HB3 ARG 31 1HB ARG 31 -17.100 24.307 -10.842 1013 HG2 ARG 31 2HG ARG 31 -15.348 24.350 -12.581 1014 HG3 ARG 31 1HG ARG 31 -15.215 25.638 -11.335 1015 HD2 ARG 31 2HD ARG 31 -13.300 24.520 -10.243 1016 HD3 ARG 31 1HD ARG 31 -13.433 23.085 -11.316 1017 HE ARG 31 HE ARG 31 -12.460 25.822 -11.965 1018 HH11 ARG 31 1HH2 ARG 31 -13.412 22.587 -13.271 1019 HH12 ARG 31 2HH2 ARG 31 -12.791 22.886 -14.860 1020 HH21 ARG 31 1HH1 ARG 31 -12.034 26.312 -14.238 1021 HH22 ARG 31 2HH1 ARG 31 -12.006 25.112 -15.421 1022 H GLY 32 H GLY 32 -16.128 25.320 -7.114 1023 HA2 GLY 32 2HA GLY 32 -18.387 26.230 -6.694 1024 HA3 GLY 32 1HA GLY 32 -18.927 24.496 -6.694 1025 H ALA 33 H ALA 33 -15.931 24.018 -5.648 1026 HA ALA 33 HA ALA 33 -16.862 23.897 -2.956 1027 HB1 ALA 33 1HB ALA 33 -14.722 22.642 -2.526 1028 HB2 ALA 33 2HB ALA 33 -14.178 23.025 -4.195 1029 HB3 ALA 33 3HB ALA 33 -15.607 21.966 -3.945 1030 HA PRO 34 HA PRO 34 -14.503 27.551 -1.859 1031 HB2 PRO 34 2HB PRO 34 -14.442 27.369 0.917 1032 HB3 PRO 34 1HB PRO 34 -15.954 27.729 -0.006 1033 HG2 PRO 34 2HG PRO 34 -15.031 25.026 1.099 1034 HG3 PRO 34 1HG PRO 34 -16.674 25.790 1.215 1035 HD2 PRO 34 2HD PRO 34 -15.998 23.896 -0.727 1036 HD3 PRO 34 1HD PRO 34 -17.183 25.238 -1.057 1037 H GLY 35 H GLY 35 -12.250 28.026 -1.769 1038 HA2 GLY 35 2HA GLY 35 -10.113 27.752 -1.190 1039 HA3 GLY 35 1HA GLY 35 -10.549 26.313 -0.200 1040 H ALA 36 H ALA 36 -11.762 26.254 -3.412 1041 HA ALA 36 HA ALA 36 -10.463 23.890 -3.999 1042 HB1 ALA 36 1HB ALA 36 -11.396 24.091 -6.289 1043 HB2 ALA 36 2HB ALA 36 -11.797 25.829 -5.994 1044 HB3 ALA 36 3HB ALA 36 -12.628 24.522 -5.066 1045 H ALA 37 H ALA 37 -8.915 23.327 -5.535 1046 HA ALA 37 HA ALA 37 -6.936 25.465 -6.151 1047 HB1 ALA 37 1HB ALA 37 -5.124 23.899 -5.349 1048 HB2 ALA 37 2HB ALA 37 -6.399 22.732 -4.804 1049 HB3 ALA 37 3HB ALA 37 -6.242 24.333 -4.005 1050 H LEU 38 H LEU 38 -8.354 22.194 -6.797 1051 HA LEU 38 HA LEU 38 -6.503 21.917 -9.056 1052 HB2 LEU 38 2HB LEU 38 -6.795 19.859 -7.731 1053 HB3 LEU 38 1HB LEU 38 -8.566 20.024 -7.843 1054 HG LEU 38 HG LEU 38 -8.518 19.629 -10.276 1055 HD11 LEU 38 1HD1 LEU 38 -6.112 20.535 -10.713 1056 HD12 LEU 38 2HD1 LEU 38 -6.601 19.063 -11.575 1057 HD13 LEU 38 3HD1 LEU 38 -5.521 18.925 -10.150 1058 HD21 LEU 38 3HD2 LEU 38 -7.973 17.211 -10.209 1059 HD22 LEU 38 1HD2 LEU 38 -8.795 17.738 -8.696 1060 HD23 LEU 38 2HD2 LEU 38 -7.023 17.448 -8.692 1061 H ILE 39 H ILE 39 -7.211 22.268 -11.189 1062 HA ILE 39 HA ILE 39 -9.954 22.507 -11.779 1063 HB ILE 39 HB ILE 39 -9.682 24.773 -12.843 1064 HG12 ILE 39 2HG1 ILE 39 -7.064 24.971 -11.207 1065 HG13 ILE 39 1HG1 ILE 39 -7.150 24.795 -12.990 1066 HG21 ILE 39 1HG2 ILE 39 -10.723 24.434 -10.520 1067 HG22 ILE 39 2HG2 ILE 39 -10.101 26.093 -10.834 1068 HG23 ILE 39 3HG2 ILE 39 -9.162 24.949 -9.807 1069 HD11 ILE 39 3HD ILE 39 -8.186 27.193 -11.345 1070 HD12 ILE 39 1HD ILE 39 -6.782 27.152 -12.464 1071 HD13 ILE 39 2HD ILE 39 -8.450 26.981 -13.118 1072 H SER 40 H SER 40 -9.676 23.162 -14.370 1073 HA SER 40 HA SER 40 -8.741 22.921 -16.310 1074 HB2 SER 40 2HB SER 40 -6.740 24.077 -15.623 1075 HB3 SER 40 1HB SER 40 -6.129 22.647 -14.747 1076 HG SER 40 1HG SER 40 -5.073 22.286 -16.362 1077 H TYR 41 H TYR 41 -9.048 21.263 -17.720 1078 HA TYR 41 HA TYR 41 -9.372 18.671 -16.641 1079 HB2 TYR 41 2HB TYR 41 -10.726 19.562 -18.611 1080 HB3 TYR 41 1HB TYR 41 -9.276 19.316 -19.646 1081 HD1 TYR 41 1HD TYR 41 -11.444 17.477 -17.118 1082 HD2 TYR 41 2HD TYR 41 -9.082 17.207 -20.707 1083 HE1 TYR 41 1HE TYR 41 -12.147 15.149 -17.400 1084 HE2 TYR 41 2HE TYR 41 -9.774 14.863 -20.985 1085 HH TYR 41 HH TYR 41 -11.823 13.163 -18.592 1086 HA PRO 42 HA PRO 42 -5.413 17.350 -18.667 1087 HB2 PRO 42 2HB PRO 42 -3.333 19.205 -19.228 1088 HB3 PRO 42 1HB PRO 42 -4.531 18.594 -20.427 1089 HG2 PRO 42 2HG PRO 42 -4.656 21.181 -18.790 1090 HG3 PRO 42 1HG PRO 42 -4.963 20.965 -20.565 1091 HD2 PRO 42 2HD PRO 42 -7.024 21.101 -18.774 1092 HD3 PRO 42 1HD PRO 42 -7.099 19.880 -20.126 1093 H ASP 43 H ASP 43 -5.641 19.721 -16.135 1094 HA ASP 43 HA ASP 43 -3.180 18.817 -14.842 1095 HB2 ASP 43 2HB ASP 43 -5.479 20.625 -13.888 1096 HB3 ASP 43 1HB ASP 43 -4.162 20.078 -12.803 1097 H ALA 44 H ALA 44 -6.751 18.438 -14.703 1098 HA ALA 44 HA ALA 44 -6.834 17.119 -12.278 1099 HB1 ALA 44 1HB ALA 44 -8.788 16.919 -14.632 1100 HB2 ALA 44 2HB ALA 44 -8.823 18.108 -13.274 1101 HB3 ALA 44 3HB ALA 44 -9.129 16.366 -12.949 1102 H ILE 45 H ILE 45 -6.407 15.770 -15.547 1103 HA ILE 45 HA ILE 45 -6.707 13.131 -14.619 1104 HB ILE 45 HB ILE 45 -7.076 13.766 -16.923 1105 HG12 ILE 45 2HG1 ILE 45 -4.977 11.538 -16.586 1106 HG13 ILE 45 1HG1 ILE 45 -6.718 11.403 -16.174 1107 HG21 ILE 45 1HG2 ILE 45 -4.017 13.874 -17.224 1108 HG22 ILE 45 2HG2 ILE 45 -5.086 15.330 -17.161 1109 HG23 ILE 45 3HG2 ILE 45 -5.249 14.147 -18.499 1110 HD11 ILE 45 3HD ILE 45 -5.564 11.933 -18.996 1111 HD12 ILE 45 1HD ILE 45 -6.308 10.411 -18.397 1112 HD13 ILE 45 2HD ILE 45 -7.321 11.887 -18.587 1113 H TRP 46 H TRP 46 -3.973 15.367 -14.485 1114 HA TRP 46 HA TRP 46 -2.048 13.291 -14.080 1115 HB2 TRP 46 2HB TRP 46 -2.019 16.238 -14.288 1116 HB3 TRP 46 1HB TRP 46 -1.020 15.701 -12.903 1117 HD1 TRP 46 HD TRP 46 1.364 14.773 -13.487 1118 HE1 TRP 46 1HE TRP 46 2.609 14.717 -15.736 1119 HE3 TRP 46 3HE TRP 46 -2.491 15.334 -16.741 1120 HZ2 TRP 46 2HZ TRP 46 2.046 14.137 -18.455 1121 HZ3 TRP 46 3HZ TRP 46 -2.093 15.043 -19.171 1122 HH2 TRP 46 HH TRP 46 0.155 14.457 -20.014 1123 H TRP 47 H TRP 47 -4.070 15.328 -11.969 1124 HA TRP 47 HA TRP 47 -2.881 14.387 -9.561 1125 HB2 TRP 47 2HB TRP 47 -4.198 16.479 -9.593 1126 HB3 TRP 47 1HB TRP 47 -5.659 15.579 -10.125 1127 HD1 TRP 47 HD TRP 47 -3.321 15.715 -6.908 1128 HE1 TRP 47 1HE TRP 47 -4.756 14.939 -4.917 1129 HE3 TRP 47 3HE TRP 47 -7.592 14.554 -9.448 1130 HZ2 TRP 47 2HZ TRP 47 -7.391 13.929 -4.492 1131 HZ3 TRP 47 3HZ TRP 47 -9.546 13.693 -8.198 1132 HH2 TRP 47 HH TRP 47 -9.458 13.420 -5.762 1133 H SER 48 H SER 48 -5.581 13.302 -11.607 1134 HA SER 48 HA SER 48 -6.583 11.281 -10.008 1135 HB2 SER 48 2HB SER 48 -7.506 12.320 -12.213 1136 HB3 SER 48 1HB SER 48 -6.396 11.212 -13.093 1137 HG SER 48 1HG SER 48 -8.481 10.404 -12.896 1138 H VAL 49 H VAL 49 -3.976 11.167 -12.522 1139 HA VAL 49 HA VAL 49 -3.396 8.489 -12.435 1140 HB VAL 49 HB VAL 49 -1.689 10.939 -13.028 1141 HG11 VAL 49 1HG1 VAL 49 -0.005 9.355 -14.092 1142 HG12 VAL 49 2HG1 VAL 49 -0.839 7.971 -13.297 1143 HG13 VAL 49 3HG1 VAL 49 -0.026 9.237 -12.304 1144 HG21 VAL 49 3HG2 VAL 49 -2.669 8.675 -14.884 1145 HG22 VAL 49 1HG2 VAL 49 -2.050 10.296 -15.352 1146 HG23 VAL 49 2HG2 VAL 49 -3.665 10.134 -14.571 1147 H GLU 50 H GLU 50 -1.869 11.093 -10.367 1148 HA GLU 50 HA GLU 50 -0.159 9.169 -9.201 1149 HB2 GLU 50 2HB GLU 50 0.631 10.807 -7.664 1150 HB3 GLU 50 1HB GLU 50 0.382 11.634 -9.237 1151 HG2 GLU 50 2HG GLU 50 -1.783 12.612 -8.326 1152 HG3 GLU 50 1HG GLU 50 -1.459 11.814 -6.743 1153 H THR 51 H THR 51 -3.437 10.084 -8.533 1154 HA THR 51 HA THR 51 -3.448 9.230 -5.811 1155 HB THR 51 HB THR 51 -5.723 9.837 -7.774 1156 HG1 THR 51 1HG THR 51 -4.634 11.671 -7.411 1157 HG21 THR 51 3HG2 THR 51 -6.567 8.430 -5.887 1158 HG22 THR 51 1HG2 THR 51 -7.109 10.128 -5.671 1159 HG23 THR 51 2HG2 THR 51 -5.749 9.475 -4.687 1160 H ALA 52 H ALA 52 -4.072 7.713 -8.983 1161 HA ALA 52 HA ALA 52 -5.406 5.456 -7.938 1162 HB1 ALA 52 1HB ALA 52 -3.757 5.741 -10.523 1163 HB2 ALA 52 2HB ALA 52 -5.534 6.020 -10.336 1164 HB3 ALA 52 3HB ALA 52 -4.861 4.364 -10.131 1165 H THR 53 H THR 53 -1.978 6.315 -8.124 1166 HA THR 53 HA THR 53 -1.166 3.612 -7.458 1167 HB THR 53 HB THR 53 1.142 4.870 -7.462 1168 HG1 THR 53 1HG THR 53 0.048 6.982 -7.413 1169 HG21 THR 53 3HG2 THR 53 -0.644 4.688 -9.996 1170 HG22 THR 53 1HG2 THR 53 0.283 3.328 -9.256 1171 HG23 THR 53 2HG2 THR 53 1.156 4.733 -9.966 1172 H THR 54 H THR 54 -2.729 5.744 -5.600 1173 HA THR 54 HA THR 54 -2.725 6.399 -3.531 1174 HB THR 54 HB THR 54 -2.086 4.593 -1.793 1175 HG1 THR 54 1HG THR 54 -0.687 3.487 -3.256 1176 HG21 THR 54 3HG2 THR 54 -4.372 5.064 -2.640 1177 HG22 THR 54 1HG2 THR 54 -4.111 3.293 -2.470 1178 HG23 THR 54 2HG2 THR 54 -4.079 4.045 -4.107 1179 H VAL 55 H VAL 55 -0.887 7.915 -4.478 1180 HA VAL 55 HA VAL 55 1.317 7.765 -2.525 1181 HB VAL 55 HB VAL 55 1.410 9.205 -5.223 1182 HG11 VAL 55 1HG1 VAL 55 2.835 10.204 -3.392 1183 HG12 VAL 55 2HG1 VAL 55 3.876 9.312 -4.561 1184 HG13 VAL 55 3HG1 VAL 55 3.455 8.566 -2.980 1185 HG21 VAL 55 3HG2 VAL 55 1.339 6.765 -5.631 1186 HG22 VAL 55 1HG2 VAL 55 2.534 6.472 -4.324 1187 HG23 VAL 55 2HG2 VAL 55 3.030 7.342 -5.826 1188 H GLY 56 H GLY 56 0.175 10.468 -4.559 1189 HA2 GLY 56 2HA GLY 56 -0.947 12.329 -3.951 1190 HA3 GLY 56 1HA GLY 56 -1.144 11.678 -2.270 1191 H TYR 57 H TYR 57 1.241 13.045 -4.604 1192 HA TYR 57 HA TYR 57 3.333 13.110 -2.605 1193 HB2 TYR 57 2HB TYR 57 3.095 14.611 -5.318 1194 HB3 TYR 57 1HB TYR 57 4.577 14.579 -4.291 1195 HD1 TYR 57 2HD TYR 57 5.882 12.494 -4.023 1196 HD2 TYR 57 1HD TYR 57 2.540 12.734 -6.714 1197 HE1 TYR 57 2HE TYR 57 6.707 10.502 -5.225 1198 HE2 TYR 57 1HE TYR 57 3.338 10.740 -7.907 1199 HH TYR 57 HH TYR 57 4.847 9.009 -7.890 1200 H GLY 58 H GLY 58 0.694 15.063 -3.520 1201 HA2 GLY 58 2HA GLY 58 -0.130 16.728 -2.144 1202 HA3 GLY 58 1HA GLY 58 1.542 17.173 -1.648 1203 H ASP 59 H ASP 59 0.225 16.657 -4.989 1204 HA ASP 59 HA ASP 59 1.272 19.298 -5.624 1205 HB2 ASP 59 2HB ASP 59 0.785 16.945 -7.209 1206 HB3 ASP 59 1HB ASP 59 -0.325 18.165 -7.857 1207 H ARG 60 H ARG 60 -1.897 17.877 -4.846 1208 HA ARG 60 HA ARG 60 -2.965 20.529 -5.048 1209 HB2 ARG 60 2HB ARG 60 -4.398 18.122 -6.364 1210 HB3 ARG 60 1HB ARG 60 -5.080 19.768 -6.183 1211 HG2 ARG 60 2HG ARG 60 -2.656 19.027 -7.945 1212 HG3 ARG 60 1HG ARG 60 -4.352 19.100 -8.495 1213 HD2 ARG 60 2HD ARG 60 -4.466 21.555 -7.999 1214 HD3 ARG 60 1HD ARG 60 -2.764 21.549 -7.412 1215 HE ARG 60 HE ARG 60 -3.698 21.450 -10.213 1216 HH11 ARG 60 1HH2 ARG 60 -0.909 20.827 -8.001 1217 HH12 ARG 60 2HH2 ARG 60 0.206 20.521 -9.218 1218 HH21 ARG 60 1HH1 ARG 60 -2.036 21.431 -11.982 1219 HH22 ARG 60 2HH1 ARG 60 -0.413 21.267 -11.533 1220 H TYR 61 H TYR 61 -5.214 20.349 -3.806 1221 HA TYR 61 HA TYR 61 -5.342 17.984 -2.165 1222 HB2 TYR 61 2HB TYR 61 -5.166 20.861 -1.051 1223 HB3 TYR 61 1HB TYR 61 -5.790 19.447 -0.118 1224 HD1 TYR 61 2HD TYR 61 -4.202 17.294 -0.216 1225 HD2 TYR 61 1HD TYR 61 -2.870 21.346 -0.755 1226 HE1 TYR 61 2HE TYR 61 -1.925 16.623 0.423 1227 HE2 TYR 61 1HE TYR 61 -0.610 20.696 -0.041 1228 HH TYR 61 HH TYR 61 0.137 17.324 1.014 1229 HA PRO 62 HA PRO 62 -9.367 19.600 -3.546 1230 HB2 PRO 62 2HB PRO 62 -10.844 17.221 -3.309 1231 HB3 PRO 62 1HB PRO 62 -9.731 17.546 -4.681 1232 HG2 PRO 62 2HG PRO 62 -9.212 15.999 -2.091 1233 HG3 PRO 62 1HG PRO 62 -8.890 15.463 -3.786 1234 HD2 PRO 62 2HD PRO 62 -6.934 16.581 -2.149 1235 HD3 PRO 62 1HD PRO 62 -6.972 16.960 -3.938 1236 H VAL 63 H VAL 63 -11.502 19.970 -2.481 1237 HA VAL 63 HA VAL 63 -11.100 19.901 0.434 1238 HB VAL 63 HB VAL 63 -13.149 21.756 -0.725 1239 HG11 VAL 63 1HG1 VAL 63 -12.567 21.582 1.820 1240 HG12 VAL 63 2HG1 VAL 63 -12.231 23.187 1.098 1241 HG13 VAL 63 3HG1 VAL 63 -10.886 22.029 1.394 1242 HG21 VAL 63 3HG2 VAL 63 -11.347 22.075 -2.367 1243 HG22 VAL 63 1HG2 VAL 63 -10.092 22.075 -1.072 1244 HG23 VAL 63 2HG2 VAL 63 -11.282 23.414 -1.194 1245 H THR 64 H THR 64 -13.802 20.559 1.170 1246 HA THR 64 HA THR 64 -14.585 17.905 1.550 1247 HB THR 64 HB THR 64 -16.115 20.396 2.479 1248 HG1 THR 64 1HG THR 64 -14.342 19.879 4.277 1249 HG21 THR 64 3HG2 THR 64 -16.936 18.058 3.144 1250 HG22 THR 64 1HG2 THR 64 -16.471 19.090 4.536 1251 HG23 THR 64 2HG2 THR 64 -15.366 17.788 3.979 1252 H GLU 65 H GLU 65 -15.842 20.633 -0.312 1253 HA GLU 65 HA GLU 65 -18.489 19.548 -0.493 1254 HB2 GLU 65 2HB GLU 65 -17.736 22.027 -0.177 1255 HB3 GLU 65 1HB GLU 65 -17.472 22.034 -1.954 1256 HG2 GLU 65 2HG GLU 65 -19.875 21.536 -2.328 1257 HG3 GLU 65 1HG GLU 65 -20.129 21.249 -0.566 1258 H GLU 66 H GLU 66 -15.524 19.311 -2.267 1259 HA GLU 66 HA GLU 66 -16.582 18.761 -4.799 1260 HB2 GLU 66 2HB GLU 66 -14.394 18.180 -5.426 1261 HB3 GLU 66 1HB GLU 66 -14.136 19.333 -4.133 1262 HG2 GLU 66 2HG GLU 66 -12.687 17.871 -3.321 1263 HG3 GLU 66 1HG GLU 66 -14.050 16.938 -2.663 1264 H GLY 67 H GLY 67 -16.243 17.112 -1.816 1265 HA2 GLY 67 2HA GLY 67 -17.511 15.413 -1.006 1266 HA3 GLY 67 1HA GLY 67 -17.972 14.948 -2.717 1267 H ARG 68 H ARG 68 -15.255 14.995 -0.298 1268 HA ARG 68 HA ARG 68 -13.405 14.270 -2.176 1269 HB2 ARG 68 2HB ARG 68 -13.107 15.281 0.315 1270 HB3 ARG 68 1HB ARG 68 -12.701 13.564 0.651 1271 HG2 ARG 68 2HG ARG 68 -11.170 13.839 -1.536 1272 HG3 ARG 68 1HG ARG 68 -11.404 15.587 -1.276 1273 HD2 ARG 68 2HD ARG 68 -10.055 13.517 0.602 1274 HD3 ARG 68 1HD ARG 68 -9.249 14.866 -0.262 1275 HE ARG 68 HE ARG 68 -10.428 16.491 1.156 1276 HH11 ARG 68 2HH2 ARG 68 -9.566 13.395 2.711 1277 HH12 ARG 68 1HH2 ARG 68 -10.770 13.406 3.887 1278 HH21 ARG 68 1HH1 ARG 68 -10.686 16.974 3.412 1279 HH22 ARG 68 2HH1 ARG 68 -10.975 15.772 4.561 1280 H LYS 69 H LYS 69 -15.815 12.369 -1.357 1281 HA LYS 69 HA LYS 69 -14.567 9.816 -1.414 1282 HB2 LYS 69 2HB LYS 69 -17.381 10.626 -2.334 1283 HB3 LYS 69 1HB LYS 69 -16.735 8.954 -2.183 1284 HG2 LYS 69 2HG LYS 69 -16.319 9.370 0.275 1285 HG3 LYS 69 1HG LYS 69 -17.213 10.926 0.137 1286 HD2 LYS 69 2HD LYS 69 -19.233 9.672 -0.687 1287 HD3 LYS 69 1HD LYS 69 -18.289 8.138 -0.634 1288 HE2 LYS 69 2HE LYS 69 -18.038 8.387 1.879 1289 HE3 LYS 69 1HE LYS 69 -19.071 9.874 1.813 1290 HZ1 LYS 69 3HZ LYS 69 -20.834 8.470 0.820 1291 HZ2 LYS 69 1HZ LYS 69 -20.389 7.969 2.380 1292 HZ3 LYS 69 2HZ LYS 69 -19.837 7.097 1.034 1293 H VAL 70 H VAL 70 -14.852 12.430 -3.773 1294 HA VAL 70 HA VAL 70 -14.837 10.802 -6.082 1295 HB VAL 70 HB VAL 70 -13.729 13.608 -5.594 1296 HG11 VAL 70 1HG1 VAL 70 -13.953 12.016 -8.244 1297 HG12 VAL 70 2HG1 VAL 70 -12.441 12.640 -7.473 1298 HG13 VAL 70 3HG1 VAL 70 -13.655 13.795 -8.101 1299 HG21 VAL 70 3HG2 VAL 70 -16.274 12.568 -7.042 1300 HG22 VAL 70 1HG2 VAL 70 -15.733 14.288 -6.911 1301 HG23 VAL 70 2HG2 VAL 70 -16.229 13.409 -5.445 1302 H ALA 71 H ALA 71 -12.217 12.249 -4.079 1303 HA ALA 71 HA ALA 71 -10.089 11.034 -5.370 1304 HB1 ALA 71 1HB ALA 71 -9.844 12.854 -3.618 1305 HB2 ALA 71 2HB ALA 71 -8.788 11.432 -3.280 1306 HB3 ALA 71 3HB ALA 71 -10.317 11.670 -2.353 1307 H GLU 72 H GLU 72 -12.028 9.896 -2.593 1308 HA GLU 72 HA GLU 72 -10.681 7.584 -1.981 1309 HB2 GLU 72 2HB GLU 72 -12.684 8.563 -0.678 1310 HB3 GLU 72 1HB GLU 72 -13.734 7.847 -1.946 1311 HG2 GLU 72 2HG GLU 72 -12.689 5.546 -1.318 1312 HG3 GLU 72 1HG GLU 72 -11.947 6.371 0.103 1313 H GLN 73 H GLN 73 -13.209 8.099 -4.514 1314 HA GLN 73 HA GLN 73 -13.387 5.390 -5.152 1315 HB2 GLN 73 2HB GLN 73 -15.015 7.224 -6.018 1316 HB3 GLN 73 1HB GLN 73 -13.773 7.570 -7.262 1317 HG2 GLN 73 2HG GLN 73 -13.911 4.912 -7.721 1318 HG3 GLN 73 1HG GLN 73 -15.452 5.015 -6.805 1319 HE21 GLN 73 1HE2 GLN 73 -15.412 4.141 -9.481 1320 HE22 GLN 73 2HE2 GLN 73 -16.109 5.326 -10.519 1321 H VAL 74 H VAL 74 -11.108 7.925 -6.341 1322 HA VAL 74 HA VAL 74 -10.187 6.362 -8.491 1323 HB VAL 74 HB VAL 74 -8.425 8.419 -7.082 1324 HG11 VAL 74 1HG1 VAL 74 -8.782 7.534 -10.038 1325 HG12 VAL 74 2HG1 VAL 74 -7.413 7.073 -8.958 1326 HG13 VAL 74 3HG1 VAL 74 -7.635 8.787 -9.444 1327 HG21 VAL 74 3HG2 VAL 74 -10.487 9.602 -7.230 1328 HG22 VAL 74 1HG2 VAL 74 -10.901 8.899 -8.840 1329 HG23 VAL 74 2HG2 VAL 74 -9.557 10.097 -8.673 1330 H MET 75 H MET 75 -8.926 6.852 -5.143 1331 HA MET 75 HA MET 75 -6.726 5.110 -5.613 1332 HB2 MET 75 2HB MET 75 -6.438 5.046 -3.121 1333 HB3 MET 75 1HB MET 75 -6.303 6.649 -3.906 1334 HG2 MET 75 2HG MET 75 -8.528 7.299 -3.115 1335 HG3 MET 75 1HG MET 75 -8.826 5.669 -2.428 1336 HE1 MET 75 3HE MET 75 -8.865 8.747 -1.075 1337 HE2 MET 75 1HE MET 75 -8.205 8.417 0.562 1338 HE3 MET 75 2HE MET 75 -9.437 7.319 -0.129 1339 H LYS 76 H LYS 76 -10.019 4.600 -4.191 1340 HA LYS 76 HA LYS 76 -9.411 2.013 -3.324 1341 HB2 LYS 76 2HB LYS 76 -11.419 3.357 -2.572 1342 HB3 LYS 76 1HB LYS 76 -12.200 2.999 -4.147 1343 HG2 LYS 76 2HG LYS 76 -12.160 0.551 -3.618 1344 HG3 LYS 76 1HG LYS 76 -11.178 0.874 -2.147 1345 HD2 LYS 76 2HD LYS 76 -13.081 2.245 -1.212 1346 HD3 LYS 76 1HD LYS 76 -14.093 1.761 -2.621 1347 HE2 LYS 76 2HE LYS 76 -13.927 -0.653 -1.935 1348 HE3 LYS 76 1HE LYS 76 -12.820 -0.203 -0.574 1349 HZ1 LYS 76 3HZ LYS 76 -15.664 0.625 -0.913 1350 HZ2 LYS 76 1HZ LYS 76 -14.634 1.141 0.352 1351 HZ3 LYS 76 2HZ LYS 76 -15.089 -0.518 0.187 1352 H ALA 77 H ALA 77 -10.691 3.251 -6.454 1353 HA ALA 77 HA ALA 77 -11.128 0.723 -7.575 1354 HB1 ALA 77 1HB ALA 77 -11.010 1.893 -9.802 1355 HB2 ALA 77 2HB ALA 77 -10.332 3.352 -8.981 1356 HB3 ALA 77 3HB ALA 77 -12.018 2.825 -8.630 1357 H GLY 78 H GLY 78 -8.201 2.759 -7.351 1358 HA2 GLY 78 2HA GLY 78 -6.588 1.218 -9.075 1359 HA3 GLY 78 1HA GLY 78 -6.067 2.344 -7.762 1360 H ILE 79 H ILE 79 -7.019 1.183 -5.506 1361 HA ILE 79 HA ILE 79 -5.213 -0.858 -4.980 1362 HB ILE 79 HB ILE 79 -7.747 -0.008 -3.506 1363 HG12 ILE 79 2HG1 ILE 79 -4.764 0.515 -2.894 1364 HG13 ILE 79 1HG1 ILE 79 -5.811 1.674 -3.743 1365 HG21 ILE 79 1HG2 ILE 79 -6.787 -1.259 -1.509 1366 HG22 ILE 79 2HG2 ILE 79 -5.490 -1.916 -2.569 1367 HG23 ILE 79 3HG2 ILE 79 -7.213 -2.369 -2.839 1368 HD11 ILE 79 3HD ILE 79 -6.211 0.685 -0.839 1369 HD12 ILE 79 1HD ILE 79 -5.691 2.316 -1.369 1370 HD13 ILE 79 2HD ILE 79 -7.361 1.753 -1.731 1371 H GLU 80 H GLU 80 -8.753 -1.024 -5.746 1372 HA GLU 80 HA GLU 80 -9.030 -3.765 -5.465 1373 HB2 GLU 80 2HB GLU 80 -10.365 -1.943 -7.569 1374 HB3 GLU 80 1HB GLU 80 -10.815 -3.659 -7.282 1375 HG2 GLU 80 2HG GLU 80 -11.463 -3.085 -4.910 1376 HG3 GLU 80 1HG GLU 80 -11.180 -1.348 -5.274 1377 H VAL 81 H VAL 81 -7.875 -1.907 -8.321 1378 HA VAL 81 HA VAL 81 -7.773 -4.141 -10.035 1379 HB VAL 81 HB VAL 81 -6.535 -1.361 -10.042 1380 HG11 VAL 81 1HG1 VAL 81 -4.835 -2.668 -11.226 1381 HG12 VAL 81 2HG1 VAL 81 -5.839 -1.829 -12.452 1382 HG13 VAL 81 3HG1 VAL 81 -6.086 -3.583 -12.142 1383 HG21 VAL 81 3HG2 VAL 81 -9.026 -1.694 -10.436 1384 HG22 VAL 81 1HG2 VAL 81 -8.644 -2.783 -11.818 1385 HG23 VAL 81 2HG2 VAL 81 -8.193 -1.045 -11.884 1386 H PHE 82 H PHE 82 -5.198 -2.489 -8.100 1387 HA PHE 82 HA PHE 82 -3.234 -4.364 -8.939 1388 HB2 PHE 82 2HB PHE 82 -3.250 -2.420 -6.535 1389 HB3 PHE 82 1HB PHE 82 -1.800 -3.332 -7.105 1390 HD1 PHE 82 2HD PHE 82 -1.624 -3.119 -9.920 1391 HD2 PHE 82 1HD PHE 82 -3.091 -0.177 -7.143 1392 HE1 PHE 82 2HE PHE 82 -1.030 -1.330 -11.501 1393 HE2 PHE 82 1HE PHE 82 -2.504 1.611 -8.728 1394 HZ PHE 82 HZ PHE 82 -1.469 1.056 -10.912 1395 H ALA 83 H ALA 83 -5.654 -4.454 -6.416 1396 HA ALA 83 HA ALA 83 -4.314 -6.582 -4.992 1397 HB1 ALA 83 1HB ALA 83 -6.366 -6.670 -3.585 1398 HB2 ALA 83 2HB ALA 83 -7.177 -5.494 -4.693 1399 HB3 ALA 83 3HB ALA 83 -5.752 -4.984 -3.720 1400 H LEU 84 H LEU 84 -6.884 -6.218 -7.471 1401 HA LEU 84 HA LEU 84 -8.047 -8.709 -7.170 1402 HB2 LEU 84 2HB LEU 84 -9.068 -6.875 -8.459 1403 HB3 LEU 84 1HB LEU 84 -7.808 -6.992 -9.721 1404 HG LEU 84 HG LEU 84 -9.476 -9.468 -9.086 1405 HD11 LEU 84 1HD1 LEU 84 -11.380 -8.696 -10.488 1406 HD12 LEU 84 2HD1 LEU 84 -10.620 -7.063 -10.644 1407 HD13 LEU 84 3HD1 LEU 84 -11.176 -7.653 -9.035 1408 HD21 LEU 84 3HD2 LEU 84 -8.540 -8.229 -11.767 1409 HD22 LEU 84 1HD2 LEU 84 -9.417 -9.790 -11.571 1410 HD23 LEU 84 2HD2 LEU 84 -7.758 -9.607 -10.916 1411 H VAL 85 H VAL 85 -5.127 -7.710 -8.887 1412 HA VAL 85 HA VAL 85 -4.773 -10.009 -10.395 1413 HB VAL 85 HB VAL 85 -2.501 -9.398 -10.731 1414 HG11 VAL 85 1HG1 VAL 85 -4.400 -7.856 -11.636 1415 HG12 VAL 85 2HG1 VAL 85 -2.762 -7.114 -11.516 1416 HG13 VAL 85 3HG1 VAL 85 -4.002 -6.737 -10.284 1417 HG21 VAL 85 3HG2 VAL 85 -2.802 -7.760 -8.142 1418 HG22 VAL 85 1HG2 VAL 85 -1.462 -7.489 -9.314 1419 HG23 VAL 85 2HG2 VAL 85 -1.625 -9.068 -8.480 1420 H THR 86 H THR 86 -4.726 -9.754 -6.957 1421 HA THR 86 HA THR 86 -2.759 -11.580 -6.344 1422 HB THR 86 HB THR 86 -5.297 -11.074 -4.737 1423 HG1 THR 86 1HG THR 86 -4.386 -9.182 -4.954 1424 HG21 THR 86 3HG2 THR 86 -3.976 -13.033 -3.854 1425 HG22 THR 86 1HG2 THR 86 -3.788 -11.607 -2.778 1426 HG23 THR 86 2HG2 THR 86 -2.462 -12.049 -3.919 1427 H ALA 87 H ALA 87 -5.766 -12.118 -7.943 1428 HA ALA 87 HA ALA 87 -6.139 -14.841 -7.420 1429 HB1 ALA 87 1HB ALA 87 -7.102 -14.963 -9.746 1430 HB2 ALA 87 2HB ALA 87 -6.426 -13.328 -10.100 1431 HB3 ALA 87 3HB ALA 87 -7.711 -13.523 -8.859 1432 H ALA 88 H ALA 88 -3.927 -13.156 -9.710 1433 HA ALA 88 HA ALA 88 -2.784 -15.525 -10.784 1434 HB1 ALA 88 1HB ALA 88 -1.666 -12.651 -10.741 1435 HB2 ALA 88 2HB ALA 88 -2.671 -13.349 -12.063 1436 HB3 ALA 88 3HB ALA 88 -1.029 -14.009 -11.724 1437 H LEU 89 H LEU 89 -1.943 -13.266 -8.115 1438 HA LEU 89 HA LEU 89 0.605 -14.303 -7.673 1439 HB2 LEU 89 2HB LEU 89 -1.379 -12.939 -5.796 1440 HB3 LEU 89 1HB LEU 89 0.216 -13.463 -5.221 1441 HG LEU 89 HG LEU 89 1.430 -11.978 -6.484 1442 HD11 LEU 89 1HD1 LEU 89 0.701 -10.490 -8.303 1443 HD12 LEU 89 2HD1 LEU 89 -0.938 -11.210 -8.276 1444 HD13 LEU 89 3HD1 LEU 89 0.493 -12.199 -8.756 1445 HD21 LEU 89 3HD2 LEU 89 0.111 -10.916 -4.590 1446 HD22 LEU 89 1HD2 LEU 89 -1.114 -10.357 -5.779 1447 HD23 LEU 89 2HD2 LEU 89 0.564 -9.748 -5.870 1448 H ALA 90 H ALA 90 -2.552 -15.319 -6.314 1449 HA ALA 90 HA ALA 90 -1.380 -17.362 -4.700 1450 HB1 ALA 90 1HB ALA 90 -4.270 -17.017 -5.697 1451 HB2 ALA 90 2HB ALA 90 -3.609 -16.380 -4.145 1452 HB3 ALA 90 3HB ALA 90 -3.728 -18.159 -4.402 1453 H THR 91 H THR 91 -1.958 -17.071 -8.095 1454 HA THR 91 HA THR 91 -2.206 -19.926 -8.579 1455 HB THR 91 HB THR 91 -1.433 -17.804 -10.688 1456 HG1 THR 91 1HG THR 91 -3.485 -17.361 -9.522 1457 HG21 THR 91 3HG2 THR 91 -2.631 -19.460 -12.212 1458 HG22 THR 91 1HG2 THR 91 -2.837 -20.568 -10.805 1459 HG23 THR 91 2HG2 THR 91 -1.190 -20.174 -11.416 1460 H ASP 92 H ASP 92 0.189 -17.291 -8.476 1461 HA ASP 92 HA ASP 92 1.843 -18.616 -10.267 1462 HB2 ASP 92 2HB ASP 92 2.121 -16.028 -8.690 1463 HB3 ASP 92 1HB ASP 92 3.520 -16.676 -9.629 1464 H PHE 93 H PHE 93 1.563 -19.142 -6.985 1465 HA PHE 93 HA PHE 93 4.218 -20.207 -6.746 1466 HB2 PHE 93 2HB PHE 93 3.723 -21.044 -4.672 1467 HB3 PHE 93 1HB PHE 93 2.701 -19.582 -4.742 1468 HD1 PHE 93 2HD PHE 93 2.706 -23.300 -4.701 1469 HD2 PHE 93 1HD PHE 93 0.272 -19.758 -4.691 1470 HE1 PHE 93 2HE PHE 93 0.785 -24.623 -3.888 1471 HE2 PHE 93 1HE PHE 93 -1.640 -21.072 -3.870 1472 HZ PHE 93 HZ PHE 93 -1.394 -23.509 -3.451 1473 H VAL 94 H VAL 94 1.139 -21.293 -8.105 1474 HA VAL 94 HA VAL 94 1.655 -24.058 -7.822 1475 HB VAL 94 HB VAL 94 -0.405 -22.707 -9.637 1476 HG11 VAL 94 1HG1 VAL 94 -0.294 -25.488 -8.266 1477 HG12 VAL 94 2HG1 VAL 94 -0.127 -25.168 -10.032 1478 HG13 VAL 94 3HG1 VAL 94 -1.688 -24.841 -9.206 1479 HG21 VAL 94 3HG2 VAL 94 -0.651 -21.758 -7.331 1480 HG22 VAL 94 1HG2 VAL 94 -0.565 -23.409 -6.624 1481 HG23 VAL 94 2HG2 VAL 94 -1.963 -22.928 -7.648 1482 H ARG 95 H ARG 95 2.422 -21.572 -10.160 1483 HA ARG 95 HA ARG 95 2.966 -22.993 -12.460 1484 HB2 ARG 95 2HB ARG 95 4.815 -20.831 -11.239 1485 HB3 ARG 95 1HB ARG 95 4.866 -21.428 -12.928 1486 HG2 ARG 95 2HG ARG 95 2.531 -20.465 -13.273 1487 HG3 ARG 95 1HG ARG 95 2.682 -19.736 -11.637 1488 HD2 ARG 95 2HD ARG 95 4.968 -18.714 -12.519 1489 HD3 ARG 95 1HD ARG 95 4.387 -19.220 -14.159 1490 HE ARG 95 HE ARG 95 2.517 -17.522 -12.507 1491 HH11 ARG 95 1HH2 ARG 95 5.113 -17.422 -15.061 1492 HH12 ARG 95 2HH2 ARG 95 4.945 -15.721 -15.253 1493 HH21 ARG 95 1HH1 ARG 95 2.498 -15.211 -12.729 1494 HH22 ARG 95 2HH1 ARG 95 2.960 -14.536 -14.226 1495 H ARG 96 H ARG 96 4.671 -22.973 -9.348 1496 HA ARG 96 HA ARG 96 7.147 -23.777 -10.131 1497 HB2 ARG 96 2HB ARG 96 7.640 -24.378 -7.890 1498 HB3 ARG 96 1HB ARG 96 6.429 -23.057 -7.779 1499 HG2 ARG 96 2HG ARG 96 4.643 -24.961 -7.523 1500 HG3 ARG 96 1HG ARG 96 6.043 -26.068 -7.373 1501 HD2 ARG 96 2HD ARG 96 6.782 -24.552 -5.337 1502 HD3 ARG 96 1HD ARG 96 5.096 -23.866 -5.412 1503 HE ARG 96 HE ARG 96 4.974 -26.738 -5.601 1504 HH11 ARG 96 1HH2 ARG 96 5.331 -24.501 -2.743 1505 HH12 ARG 96 2HH2 ARG 96 6.065 -25.676 -1.800 1506 HH21 ARG 96 1HH1 ARG 96 5.473 -28.331 -4.123 1507 HH22 ARG 96 2HH1 ARG 96 6.050 -27.985 -2.532 1508 H GLU 97 H GLU 97 4.201 -25.824 -9.973 1509 HA GLU 97 HA GLU 97 5.872 -28.177 -9.853 1510 HB2 GLU 97 2HB GLU 97 2.872 -28.076 -10.287 1511 HB3 GLU 97 1HB GLU 97 3.879 -29.541 -10.005 1512 HG2 GLU 97 2HG GLU 97 3.451 -27.221 -8.007 1513 HG3 GLU 97 1HG GLU 97 2.737 -28.866 -7.914 1514 H GLU 98 H GLU 98 4.754 -26.110 -12.440 1515 HA GLU 98 HA GLU 98 5.642 -28.170 -14.340 1516 HB2 GLU 98 2HB GLU 98 5.222 -26.498 -16.149 1517 HB3 GLU 98 1HB GLU 98 3.786 -27.188 -15.346 1518 HG2 GLU 98 2HG GLU 98 3.406 -25.097 -14.065 1519 HG3 GLU 98 1HG GLU 98 4.897 -24.363 -14.776 1520 H GLU 99 H GLU 99 6.337 -24.823 -13.225 1521 HA GLU 99 HA GLU 99 8.475 -24.474 -14.892 1522 HB2 GLU 99 2HB GLU 99 7.019 -22.700 -14.038 1523 HB3 GLU 99 1HB GLU 99 7.693 -22.879 -12.388 1524 HG2 GLU 99 2HG GLU 99 9.860 -22.001 -13.079 1525 HG3 GLU 99 1HG GLU 99 9.462 -22.231 -14.816 1526 H ARG 100 H ARG 100 8.576 -25.691 -11.491 1527 HA ARG 100 HA ARG 100 11.209 -25.044 -10.909 1528 HB2 ARG 100 2HB ARG 100 9.604 -26.077 -9.232 1529 HB3 ARG 100 1HB ARG 100 9.643 -27.602 -10.159 1530 HG2 ARG 100 2HG ARG 100 12.253 -27.598 -9.583 1531 HG3 ARG 100 1HG ARG 100 11.808 -26.388 -8.355 1532 HD2 ARG 100 2HD ARG 100 10.694 -29.290 -8.650 1533 HD3 ARG 100 1HD ARG 100 11.913 -28.729 -7.443 1534 HE ARG 100 HE ARG 100 10.220 -27.351 -6.358 1535 HH11 ARG 100 1HH2 ARG 100 8.753 -30.026 -8.371 1536 HH12 ARG 100 2HH2 ARG 100 7.155 -29.518 -8.028 1537 HH21 ARG 100 1HH1 ARG 100 8.124 -27.123 -5.586 1538 HH22 ARG 100 2HH1 ARG 100 6.770 -27.989 -6.300 1539 H ARG 101 H ARG 101 9.879 -27.670 -12.823 1540 HA ARG 101 HA ARG 101 12.538 -28.925 -13.154 1541 HB2 ARG 101 2HB ARG 101 9.694 -29.956 -13.754 1542 HB3 ARG 101 1HB ARG 101 11.209 -30.891 -13.992 1543 HG2 ARG 101 2HG ARG 101 11.682 -30.911 -11.600 1544 HG3 ARG 101 1HG ARG 101 10.301 -29.837 -11.227 1545 HD2 ARG 101 2HD ARG 101 10.028 -32.659 -12.484 1546 HD3 ARG 101 1HD ARG 101 9.829 -32.279 -10.715 1547 HE ARG 101 HE ARG 101 8.106 -30.493 -12.082 1548 HH11 ARG 101 1HH2 ARG 101 8.423 -34.083 -11.840 1549 HH12 ARG 101 2HH2 ARG 101 6.770 -34.380 -11.796 1550 HH21 ARG 101 1HH1 ARG 101 5.813 -30.892 -12.214 1551 HH22 ARG 101 2HH1 ARG 101 5.223 -32.490 -12.360 1552 H GLY 102 H GLY 102 10.816 -26.508 -14.514 1553 HA2 GLY 102 2HA GLY 102 10.604 -25.608 -16.482 1554 HA3 GLY 102 1HA GLY 102 11.861 -26.754 -17.068 1555 H HIS 103 H HIS 103 8.944 -28.118 -15.740 1556 HA HIS 103 HA HIS 103 7.724 -28.649 -18.275 1557 HB2 HIS 103 2HB HIS 103 9.273 -30.964 -16.896 1558 HB3 HIS 103 1HB HIS 103 8.137 -31.133 -18.274 1559 HD1 HIS 103 1HD HIS 103 11.632 -29.932 -17.467 1560 HD2 HIS 103 2HD HIS 103 8.970 -29.669 -20.672 1561 HE1 HIS 103 1HE HIS 103 12.969 -29.188 -19.459 1562 HE2 HIS 103 2HE HIS 103 11.274 -28.717 -21.224 1563 H1 SER 1 H SER 1 16.445 -25.643 -1.273 1564 HA SER 1 HA SER 1 16.040 -24.515 0.927 1565 HB2 SER 1 2HB SER 1 18.037 -22.954 0.679 1566 HB3 SER 1 1HB SER 1 17.300 -22.274 -0.816 1567 HG SER 1 1HG SER 1 16.905 -21.049 1.129 1568 H ALA 2 H ALA 2 15.003 -21.966 -0.865 1569 HA ALA 2 HA ALA 2 13.124 -23.632 -2.432 1570 HB1 ALA 2 1HB ALA 2 12.553 -21.068 -0.864 1571 HB2 ALA 2 2HB ALA 2 11.995 -22.716 -0.443 1572 HB3 ALA 2 3HB ALA 2 11.374 -21.920 -1.933 1573 H ASP 3 H ASP 3 13.039 -23.217 -4.527 1574 HA ASP 3 HA ASP 3 14.608 -21.145 -5.649 1575 HB2 ASP 3 2HB ASP 3 12.487 -22.939 -6.997 1576 HB3 ASP 3 1HB ASP 3 13.670 -21.884 -7.855 1577 H HIS 4 H HIS 4 11.306 -21.513 -4.697 1578 HA HIS 4 HA HIS 4 10.227 -19.421 -6.279 1579 HB2 HIS 4 2HB HIS 4 8.245 -19.474 -4.935 1580 HB3 HIS 4 1HB HIS 4 8.771 -21.169 -5.143 1581 HD1 HIS 4 1HD HIS 4 8.804 -22.463 -2.772 1582 HD2 HIS 4 2HD HIS 4 9.040 -18.283 -2.383 1583 HE1 HIS 4 1HE HIS 4 8.638 -21.911 -0.308 1584 HE2 HIS 4 2HE HIS 4 8.631 -19.369 -0.135 1585 H GLU 5 H GLU 5 12.077 -19.439 -3.237 1586 HA GLU 5 HA GLU 5 11.325 -16.745 -2.523 1587 HB2 GLU 5 2HB GLU 5 13.532 -18.635 -1.475 1588 HB3 GLU 5 1HB GLU 5 13.213 -16.990 -0.832 1589 HG2 GLU 5 2HG GLU 5 10.959 -17.609 -0.090 1590 HG3 GLU 5 1HG GLU 5 11.125 -19.247 -0.842 1591 H ARG 6 H ARG 6 13.967 -18.526 -4.160 1592 HA ARG 6 HA ARG 6 15.788 -16.480 -4.411 1593 HB2 ARG 6 2HB ARG 6 15.128 -18.663 -6.502 1594 HB3 ARG 6 1HB ARG 6 16.557 -17.592 -6.575 1595 HG2 ARG 6 2HG ARG 6 17.467 -18.505 -4.523 1596 HG3 ARG 6 1HG ARG 6 16.069 -19.612 -4.307 1597 HD2 ARG 6 2HD ARG 6 16.654 -20.918 -6.320 1598 HD3 ARG 6 1HD ARG 6 17.791 -19.637 -6.877 1599 HE ARG 6 HE ARG 6 19.311 -20.139 -5.102 1600 HH11 ARG 6 1HH2 ARG 6 16.904 -22.860 -5.719 1601 HH12 ARG 6 2HH2 ARG 6 17.750 -23.902 -4.695 1602 HH21 ARG 6 1HH1 ARG 6 20.498 -21.727 -4.031 1603 HH22 ARG 6 2HH1 ARG 6 19.879 -23.325 -3.755 1604 H GLU 7 H GLU 7 12.978 -17.252 -6.594 1605 HA GLU 7 HA GLU 7 13.847 -15.203 -8.364 1606 HB2 GLU 7 2HB GLU 7 12.645 -17.194 -9.209 1607 HB3 GLU 7 1HB GLU 7 11.113 -16.520 -8.550 1608 HG2 GLU 7 2HG GLU 7 11.249 -14.581 -10.020 1609 HG3 GLU 7 1HG GLU 7 12.988 -14.872 -10.364 1610 H ALA 8 H ALA 8 11.821 -15.221 -5.513 1611 HA ALA 8 HA ALA 8 10.504 -12.772 -5.995 1612 HB1 ALA 8 1HB ALA 8 9.799 -14.291 -4.121 1613 HB2 ALA 8 2HB ALA 8 10.241 -12.665 -3.488 1614 HB3 ALA 8 3HB ALA 8 11.385 -14.029 -3.308 1615 H GLN 9 H GLN 9 13.639 -13.624 -4.452 1616 HA GLN 9 HA GLN 9 14.378 -10.992 -3.796 1617 HB2 GLN 9 2HB GLN 9 16.200 -13.368 -4.542 1618 HB3 GLN 9 1HB GLN 9 16.753 -11.843 -3.762 1619 HG2 GLN 9 2HG GLN 9 15.390 -12.347 -1.729 1620 HG3 GLN 9 1HG GLN 9 14.784 -13.862 -2.491 1621 HE21 GLN 9 1HE2 GLN 9 17.706 -12.225 -1.153 1622 HE22 GLN 9 2HE2 GLN 9 18.659 -13.666 -1.024 1623 H LYS 10 H LYS 10 14.761 -12.904 -6.757 1624 HA LYS 10 HA LYS 10 16.627 -11.283 -8.060 1625 HB2 LYS 10 2HB LYS 10 16.030 -13.623 -8.682 1626 HB3 LYS 10 1HB LYS 10 14.411 -13.092 -9.219 1627 HG2 LYS 10 2HG LYS 10 16.922 -11.913 -10.538 1628 HG3 LYS 10 1HG LYS 10 16.396 -13.596 -10.895 1629 HD2 LYS 10 2HD LYS 10 14.060 -12.649 -11.424 1630 HD3 LYS 10 1HD LYS 10 14.830 -11.022 -11.472 1631 HE2 LYS 10 2HE LYS 10 16.391 -11.830 -13.299 1632 HE3 LYS 10 1HE LYS 10 15.666 -13.483 -13.169 1633 HZ1 LYS 10 3HZ LYS 10 14.635 -12.567 -14.934 1634 HZ2 LYS 10 1HZ LYS 10 14.463 -11.003 -14.267 1635 HZ3 LYS 10 2HZ LYS 10 13.478 -12.314 -13.718 1636 H ALA 11 H ALA 11 13.080 -11.114 -7.796 1637 HA ALA 11 HA ALA 11 12.649 -9.228 -9.807 1638 HB1 ALA 11 1HB ALA 11 11.016 -9.644 -7.225 1639 HB2 ALA 11 2HB ALA 11 10.812 -10.592 -8.744 1640 HB3 ALA 11 3HB ALA 11 10.450 -8.830 -8.732 1641 H GLU 12 H GLU 12 13.587 -8.830 -6.351 1642 HA GLU 12 HA GLU 12 13.137 -6.076 -6.199 1643 HB2 GLU 12 2HB GLU 12 15.405 -7.640 -4.809 1644 HB3 GLU 12 1HB GLU 12 14.958 -5.932 -4.484 1645 HG2 GLU 12 2HG GLU 12 12.648 -6.751 -3.711 1646 HG3 GLU 12 1HG GLU 12 13.310 -8.433 -3.783 1647 H GLU 13 H GLU 13 15.868 -7.934 -7.536 1648 HA GLU 13 HA GLU 13 17.716 -5.833 -7.617 1649 HB2 GLU 13 2HB GLU 13 18.292 -8.276 -7.806 1650 HB3 GLU 13 1HB GLU 13 17.584 -8.300 -9.450 1651 HG2 GLU 13 2HG GLU 13 19.338 -6.686 -10.233 1652 HG3 GLU 13 1HG GLU 13 20.012 -6.587 -8.565 1653 H GLU 14 H GLU 14 15.214 -6.953 -9.888 1654 HA GLU 14 HA GLU 14 16.046 -5.376 -12.076 1655 HB2 GLU 14 2HB GLU 14 14.544 -7.426 -12.258 1656 HB3 GLU 14 1HB GLU 14 13.247 -6.477 -11.475 1657 HG2 GLU 14 2HG GLU 14 12.699 -6.436 -13.769 1658 HG3 GLU 14 1HG GLU 14 13.416 -4.820 -13.479 1659 H LEU 15 H LEU 15 13.866 -4.815 -9.293 1660 HA LEU 15 HA LEU 15 12.699 -2.499 -10.319 1661 HB2 LEU 15 2HB LEU 15 11.803 -3.811 -8.364 1662 HB3 LEU 15 1HB LEU 15 13.163 -3.222 -7.360 1663 HG LEU 15 HG LEU 15 12.347 -0.896 -7.537 1664 HD11 LEU 15 1HD1 LEU 15 11.448 -0.795 -9.816 1665 HD12 LEU 15 2HD1 LEU 15 10.124 -0.393 -8.688 1666 HD13 LEU 15 3HD1 LEU 15 10.189 -2.029 -9.431 1667 HD21 LEU 15 3HD2 LEU 15 10.191 -1.128 -6.298 1668 HD22 LEU 15 1HD2 LEU 15 11.396 -2.345 -5.740 1669 HD23 LEU 15 2HD2 LEU 15 10.051 -2.841 -6.830 1670 H GLN 16 H GLN 16 15.679 -3.049 -8.485 1671 HA GLN 16 HA GLN 16 16.137 -0.294 -7.978 1672 HB2 GLN 16 2HB GLN 16 18.073 -2.651 -7.945 1673 HB3 GLN 16 1HB GLN 16 18.402 -1.023 -7.247 1674 HG2 GLN 16 2HG GLN 16 16.500 -1.247 -5.662 1675 HG3 GLN 16 1HG GLN 16 16.056 -2.851 -6.322 1676 HE21 GLN 16 1HE2 GLN 16 18.503 -4.156 -6.597 1677 HE22 GLN 16 2HE2 GLN 16 19.413 -4.156 -5.111 1678 H LYS 17 H LYS 17 16.632 -2.278 -10.784 1679 HA LYS 17 HA LYS 17 18.727 -0.745 -11.943 1680 HB2 LYS 17 2HB LYS 17 18.094 -3.133 -12.561 1681 HB3 LYS 17 1HB LYS 17 16.590 -2.491 -13.297 1682 HG2 LYS 17 2HG LYS 17 17.973 -1.206 -14.974 1683 HG3 LYS 17 1HG LYS 17 19.469 -1.789 -14.170 1684 HD2 LYS 17 2HD LYS 17 19.096 -3.141 -16.147 1685 HD3 LYS 17 1HD LYS 17 18.826 -4.159 -14.690 1686 HE2 LYS 17 2HE LYS 17 16.283 -3.767 -15.001 1687 HE3 LYS 17 1HE LYS 17 16.665 -2.921 -16.550 1688 HZ1 LYS 17 3HZ LYS 17 17.391 -5.744 -15.912 1689 HZ2 LYS 17 1HZ LYS 17 17.557 -4.961 -17.413 1690 HZ3 LYS 17 2HZ LYS 17 16.004 -5.253 -16.697 1691 H VAL 18 H VAL 18 15.102 -0.739 -12.258 1692 HA VAL 18 HA VAL 18 15.218 1.392 -14.143 1693 HB VAL 18 HB VAL 18 12.763 1.541 -13.896 1694 HG11 VAL 18 1HG1 VAL 18 12.385 -0.677 -14.983 1695 HG12 VAL 18 2HG1 VAL 18 13.958 -1.289 -14.361 1696 HG13 VAL 18 3HG1 VAL 18 13.924 0.056 -15.564 1697 HG21 VAL 18 3HG2 VAL 18 11.569 -0.177 -12.561 1698 HG22 VAL 18 1HG2 VAL 18 12.603 0.794 -11.461 1699 HG23 VAL 18 2HG2 VAL 18 13.114 -0.863 -11.962 1700 H LEU 19 H LEU 19 15.127 1.226 -10.627 1701 HA LEU 19 HA LEU 19 14.446 3.907 -10.165 1702 HB2 LEU 19 2HB LEU 19 16.242 1.969 -8.592 1703 HB3 LEU 19 1HB LEU 19 15.939 3.643 -8.036 1704 HG LEU 19 HG LEU 19 13.713 1.571 -8.480 1705 HD11 LEU 19 1HD1 LEU 19 15.195 0.941 -6.550 1706 HD12 LEU 19 2HD1 LEU 19 13.568 1.478 -6.003 1707 HD13 LEU 19 3HD1 LEU 19 14.981 2.588 -5.852 1708 HD21 LEU 19 3HD2 LEU 19 12.438 3.354 -7.059 1709 HD22 LEU 19 1HD2 LEU 19 12.784 3.803 -8.767 1710 HD23 LEU 19 2HD2 LEU 19 13.786 4.464 -7.428 1711 H GLU 20 H GLU 20 17.647 2.393 -10.956 1712 HA GLU 20 HA GLU 20 19.143 4.723 -10.525 1713 HB2 GLU 20 2HB GLU 20 19.642 2.498 -12.607 1714 HB3 GLU 20 1HB GLU 20 20.784 3.822 -12.201 1715 HG2 GLU 20 2HG GLU 20 20.915 2.952 -9.823 1716 HG3 GLU 20 1HG GLU 20 19.917 1.532 -10.319 1717 H GLU 21 H GLU 21 17.545 3.434 -13.457 1718 HA GLU 21 HA GLU 21 18.297 5.410 -15.261 1719 HB2 GLU 21 2HB GLU 21 15.600 3.903 -15.160 1720 HB3 GLU 21 1HB GLU 21 16.278 4.724 -16.598 1721 HG2 GLU 21 2HG GLU 21 17.716 2.353 -15.211 1722 HG3 GLU 21 1HG GLU 21 16.380 2.126 -16.380 1723 H ALA 22 H ALA 22 15.293 5.050 -13.332 1724 HA ALA 22 HA ALA 22 14.023 7.359 -14.082 1725 HB1 ALA 22 1HB ALA 22 13.874 5.908 -11.358 1726 HB2 ALA 22 2HB ALA 22 12.905 5.500 -12.817 1727 HB3 ALA 22 3HB ALA 22 12.665 7.083 -11.988 1728 H SER 23 H SER 23 16.327 6.818 -11.394 1729 HA SER 23 HA SER 23 16.038 9.205 -10.042 1730 HB2 SER 23 2HB SER 23 18.739 7.773 -10.617 1731 HB3 SER 23 1HB SER 23 18.446 9.007 -9.338 1732 HG SER 23 1HG SER 23 17.375 6.384 -9.567 1733 H LYS 24 H LYS 24 18.160 8.434 -12.835 1734 HA LYS 24 HA LYS 24 19.204 11.118 -12.780 1735 HB2 LYS 24 2HB LYS 24 20.144 8.589 -13.639 1736 HB3 LYS 24 1HB LYS 24 20.000 9.526 -15.149 1737 HG2 LYS 24 2HG LYS 24 21.395 10.608 -12.609 1738 HG3 LYS 24 1HG LYS 24 22.244 9.580 -13.809 1739 HD2 LYS 24 2HD LYS 24 21.918 11.159 -15.587 1740 HD3 LYS 24 1HD LYS 24 20.864 12.227 -14.589 1741 HE2 LYS 24 2HE LYS 24 22.679 13.060 -13.276 1742 HE3 LYS 24 1HE LYS 24 23.737 11.640 -13.649 1743 HZ1 LYS 24 3HZ LYS 24 24.236 13.843 -14.794 1744 HZ2 LYS 24 1HZ LYS 24 22.915 13.516 -15.789 1745 HZ3 LYS 24 2HZ LYS 24 24.201 12.396 -15.723 1746 H LYS 25 H LYS 25 16.893 9.228 -14.788 1747 HA LYS 25 HA LYS 25 16.624 11.181 -16.811 1748 HB2 LYS 25 2HB LYS 25 14.596 9.152 -15.692 1749 HB3 LYS 25 1HB LYS 25 14.266 10.169 -17.131 1750 HG2 LYS 25 2HG LYS 25 16.595 8.152 -16.979 1751 HG3 LYS 25 1HG LYS 25 14.950 7.787 -17.594 1752 HD2 LYS 25 2HD LYS 25 15.217 9.614 -19.317 1753 HD3 LYS 25 1HD LYS 25 16.924 9.841 -18.777 1754 HE2 LYS 25 2HE LYS 25 17.420 7.423 -19.367 1755 HE3 LYS 25 1HE LYS 25 15.693 7.201 -19.848 1756 HZ1 LYS 25 3HZ LYS 25 16.123 9.044 -21.533 1757 HZ2 LYS 25 1HZ LYS 25 16.834 7.524 -21.774 1758 HZ3 LYS 25 2HZ LYS 25 17.777 8.811 -21.261 1759 H ALA 26 H ALA 26 15.151 10.811 -13.564 1760 HA ALA 26 HA ALA 26 13.106 12.612 -13.826 1761 HB1 ALA 26 1HB ALA 26 13.166 12.852 -11.334 1762 HB2 ALA 26 2HB ALA 26 14.782 12.052 -11.306 1763 HB3 ALA 26 3HB ALA 26 13.327 11.132 -11.831 1764 H VAL 27 H VAL 27 16.565 13.233 -13.218 1765 HA VAL 27 HA VAL 27 16.179 15.852 -12.329 1766 HB VAL 27 HB VAL 27 18.417 16.104 -12.186 1767 HG11 VAL 27 1HG1 VAL 27 18.123 13.019 -12.345 1768 HG12 VAL 27 2HG1 VAL 27 17.585 14.043 -10.959 1769 HG13 VAL 27 3HG1 VAL 27 19.323 13.920 -11.391 1770 HG21 VAL 27 3HG2 VAL 27 20.179 14.939 -13.533 1771 HG22 VAL 27 1HG2 VAL 27 19.168 16.070 -14.485 1772 HG23 VAL 27 2HG2 VAL 27 18.901 14.297 -14.630 1773 H GLU 28 H GLU 28 16.478 14.456 -15.592 1774 HA GLU 28 HA GLU 28 16.692 17.145 -16.699 1775 HB2 GLU 28 2HB GLU 28 17.901 14.975 -17.700 1776 HB3 GLU 28 1HB GLU 28 16.326 14.770 -18.539 1777 HG2 GLU 28 2HG GLU 28 16.555 17.254 -19.265 1778 HG3 GLU 28 1HG GLU 28 18.207 17.234 -18.575 1779 H ALA 29 H ALA 29 14.319 14.770 -15.833 1780 HA ALA 29 HA ALA 29 12.370 15.485 -17.749 1781 HB1 ALA 29 1HB ALA 29 11.922 14.181 -14.992 1782 HB2 ALA 29 2HB ALA 29 12.335 13.284 -16.504 1783 HB3 ALA 29 3HB ALA 29 10.783 14.181 -16.397 1784 H GLU 30 H GLU 30 13.266 16.781 -14.557 1785 HA GLU 30 HA GLU 30 10.887 18.360 -14.366 1786 HB2 GLU 30 2HB GLU 30 11.752 19.325 -12.400 1787 HB3 GLU 30 1HB GLU 30 12.301 17.629 -12.370 1788 HG2 GLU 30 2HG GLU 30 14.311 18.507 -11.812 1789 HG3 GLU 30 1HG GLU 30 14.539 18.822 -13.538 1790 H ARG 31 H ARG 31 14.068 18.639 -15.746 1791 HA ARG 31 HA ARG 31 14.285 21.417 -15.761 1792 HB2 ARG 31 2HB ARG 31 15.728 19.106 -17.089 1793 HB3 ARG 31 1HB ARG 31 16.128 20.746 -17.617 1794 HG2 ARG 31 2HG ARG 31 16.162 20.008 -14.637 1795 HG3 ARG 31 1HG ARG 31 17.539 19.637 -15.711 1796 HD2 ARG 31 2HD ARG 31 16.348 22.449 -15.154 1797 HD3 ARG 31 1HD ARG 31 17.924 21.835 -14.536 1798 HE ARG 31 HE ARG 31 17.262 22.771 -17.285 1799 HH11 ARG 31 1HH2 ARG 31 19.481 20.579 -15.512 1800 HH12 ARG 31 2HH2 ARG 31 20.567 20.421 -16.838 1801 HH21 ARG 31 1HH1 ARG 31 19.020 22.852 -18.917 1802 HH22 ARG 31 2HH1 ARG 31 20.347 21.787 -18.728 1803 H GLY 32 H GLY 32 12.417 22.319 -16.687 1804 HA2 GLY 32 2HA GLY 32 12.295 23.364 -19.025 1805 HA3 GLY 32 1HA GLY 32 11.877 21.664 -19.499 1806 H ALA 33 H ALA 33 10.659 21.133 -16.821 1807 HA ALA 33 HA ALA 33 8.056 21.919 -17.764 1808 HB1 ALA 33 1HB ALA 33 8.946 20.144 -15.424 1809 HB2 ALA 33 2HB ALA 33 8.514 19.532 -17.066 1810 HB3 ALA 33 3HB ALA 33 7.247 20.280 -16.014 1811 HA PRO 34 HA PRO 34 7.686 24.887 -14.476 1812 HB2 PRO 34 2HB PRO 34 4.910 24.970 -14.023 1813 HB3 PRO 34 1HB PRO 34 5.693 25.660 -15.496 1814 HG2 PRO 34 2HG PRO 34 4.393 22.901 -15.186 1815 HG3 PRO 34 1HG PRO 34 4.139 24.113 -16.514 1816 HD2 PRO 34 2HD PRO 34 5.896 22.000 -16.794 1817 HD3 PRO 34 1HD PRO 34 6.313 23.641 -17.465 1818 H GLY 35 H GLY 35 7.325 25.073 -12.180 1819 HA2 GLY 35 2HA GLY 35 7.022 24.372 -10.094 1820 HA3 GLY 35 1HA GLY 35 6.078 22.973 -10.730 1821 H ALA 36 H ALA 36 9.326 23.668 -11.716 1822 HA ALA 36 HA ALA 36 10.642 21.421 -11.559 1823 HB1 ALA 36 1HB ALA 36 11.589 24.206 -10.655 1824 HB2 ALA 36 2HB ALA 36 11.546 23.605 -12.352 1825 HB3 ALA 36 3HB ALA 36 12.695 22.899 -11.179 1826 H ALA 37 H ALA 37 12.086 20.253 -10.013 1827 HA ALA 37 HA ALA 37 11.258 20.654 -7.231 1828 HB1 ALA 37 1HB ALA 37 9.445 19.234 -8.165 1829 HB2 ALA 37 2HB ALA 37 10.447 18.350 -6.977 1830 HB3 ALA 37 3HB ALA 37 10.654 18.050 -8.757 1831 H LEU 38 H LEU 38 12.286 17.468 -7.871 1832 HA LEU 38 HA LEU 38 14.820 18.039 -6.667 1833 HB2 LEU 38 2HB LEU 38 15.278 15.673 -6.593 1834 HB3 LEU 38 1HB LEU 38 13.665 16.023 -5.937 1835 HG LEU 38 HG LEU 38 13.608 13.963 -7.056 1836 HD11 LEU 38 1HD1 LEU 38 11.551 15.351 -7.309 1837 HD12 LEU 38 2HD1 LEU 38 11.752 14.130 -8.610 1838 HD13 LEU 38 3HD1 LEU 38 12.108 15.859 -8.956 1839 HD21 LEU 38 3HD2 LEU 38 14.423 15.080 -9.790 1840 HD22 LEU 38 1HD2 LEU 38 14.183 13.375 -9.276 1841 HD23 LEU 38 2HD2 LEU 38 15.574 14.320 -8.636 1842 H ILE 39 H ILE 39 16.912 17.276 -7.661 1843 HA ILE 39 HA ILE 39 16.867 17.573 -10.558 1844 HB ILE 39 HB ILE 39 18.750 19.275 -10.335 1845 HG12 ILE 39 2HG1 ILE 39 17.747 19.471 -7.406 1846 HG13 ILE 39 1HG1 ILE 39 19.323 18.768 -7.904 1847 HG21 ILE 39 1HG2 ILE 39 16.022 20.159 -9.215 1848 HG22 ILE 39 2HG2 ILE 39 16.375 19.823 -10.940 1849 HG23 ILE 39 3HG2 ILE 39 17.219 21.167 -10.100 1850 HD11 ILE 39 3HD ILE 39 18.411 21.700 -8.275 1851 HD12 ILE 39 1HD ILE 39 19.660 21.082 -7.145 1852 HD13 ILE 39 2HD ILE 39 19.948 21.021 -8.927 1853 H SER 40 H SER 40 19.741 17.791 -10.619 1854 HA SER 40 HA SER 40 20.592 15.206 -10.501 1855 HB2 SER 40 2HB SER 40 22.348 17.731 -10.329 1856 HB3 SER 40 1HB SER 40 22.685 16.223 -11.257 1857 HG SER 40 1HG SER 40 21.997 18.059 -12.495 1858 H TYR 41 H TYR 41 23.030 15.043 -9.406 1859 HA TYR 41 HA TYR 41 24.364 15.122 -7.708 1860 HB2 TYR 41 2HB TYR 41 22.536 16.798 -5.926 1861 HB3 TYR 41 1HB TYR 41 24.335 16.665 -5.860 1862 HD1 TYR 41 1HD TYR 41 25.290 17.160 -8.547 1863 HD2 TYR 41 2HD TYR 41 21.958 18.967 -6.503 1864 HE1 TYR 41 1HE TYR 41 25.384 19.070 -10.085 1865 HE2 TYR 41 2HE TYR 41 22.086 20.905 -8.006 1866 HH TYR 41 HH TYR 41 23.089 21.842 -9.847 1867 HA PRO 42 HA PRO 42 22.648 11.709 -5.627 1868 HB2 PRO 42 2HB PRO 42 23.183 11.730 -2.821 1869 HB3 PRO 42 1HB PRO 42 24.335 11.253 -4.120 1870 HG2 PRO 42 2HG PRO 42 24.061 13.970 -2.749 1871 HG3 PRO 42 1HG PRO 42 25.574 13.060 -3.157 1872 HD2 PRO 42 2HD PRO 42 24.686 15.111 -4.705 1873 HD3 PRO 42 1HD PRO 42 25.365 13.623 -5.508 1874 H ASP 43 H ASP 43 21.096 14.529 -5.172 1875 HA ASP 43 HA ASP 43 19.201 13.814 -3.150 1876 HB2 ASP 43 2HB ASP 43 19.815 16.244 -3.895 1877 HB3 ASP 43 1HB ASP 43 18.833 15.941 -5.371 1878 H ALA 44 H ALA 44 19.532 13.669 -6.665 1879 HA ALA 44 HA ALA 44 17.014 13.208 -7.519 1880 HB1 ALA 44 1HB ALA 44 18.078 12.047 -9.465 1881 HB2 ALA 44 2HB ALA 44 19.595 11.794 -8.519 1882 HB3 ALA 44 3HB ALA 44 19.086 13.446 -8.981 1883 H ILE 45 H ILE 45 19.361 10.808 -6.354 1884 HA ILE 45 HA ILE 45 17.664 8.594 -6.956 1885 HB ILE 45 HB ILE 45 19.923 8.212 -7.300 1886 HG12 ILE 45 2HG1 ILE 45 19.297 6.809 -4.632 1887 HG13 ILE 45 1HG1 ILE 45 18.651 6.344 -6.240 1888 HG21 ILE 45 1HG2 ILE 45 20.954 10.044 -6.066 1889 HG22 ILE 45 2HG2 ILE 45 21.693 8.526 -5.493 1890 HG23 ILE 45 3HG2 ILE 45 20.461 9.349 -4.483 1891 HD11 ILE 45 3HD ILE 45 21.633 6.338 -5.406 1892 HD12 ILE 45 1HD ILE 45 20.572 4.915 -5.703 1893 HD13 ILE 45 2HD ILE 45 21.022 5.992 -7.072 1894 H TRP 46 H TRP 46 18.108 10.752 -4.239 1895 HA TRP 46 HA TRP 46 17.152 8.939 -2.277 1896 HB2 TRP 46 2HB TRP 46 17.866 11.853 -2.449 1897 HB3 TRP 46 1HB TRP 46 16.628 11.468 -1.252 1898 HD1 TRP 46 HD TRP 46 18.104 12.129 0.718 1899 HE1 TRP 46 1HE TRP 46 20.147 11.108 1.939 1900 HE3 TRP 46 3HE TRP 46 19.438 8.597 -2.745 1901 HZ2 TRP 46 2HZ TRP 46 21.956 8.985 1.546 1902 HZ3 TRP 46 3HZ TRP 46 21.400 7.197 -2.327 1903 HH2 TRP 46 HH TRP 46 22.652 7.371 -0.198 1904 H TRP 47 H TRP 47 15.556 11.373 -4.401 1905 HA TRP 47 HA TRP 47 12.970 10.857 -3.282 1906 HB2 TRP 47 2HB TRP 47 13.324 12.952 -4.518 1907 HB3 TRP 47 1HB TRP 47 13.823 12.040 -5.983 1908 HD1 TRP 47 HD TRP 47 10.493 12.323 -3.799 1909 HE1 TRP 47 1HE TRP 47 8.550 11.772 -5.310 1910 HE3 TRP 47 3HE TRP 47 13.138 11.279 -8.026 1911 HZ2 TRP 47 2HZ TRP 47 8.143 10.995 -8.067 1912 HZ3 TRP 47 3HZ TRP 47 11.934 10.481 -10.027 1913 HH2 TRP 47 HH TRP 47 9.480 10.342 -10.050 1914 H SER 48 H SER 48 14.910 9.418 -5.916 1915 HA SER 48 HA SER 48 12.847 8.029 -7.131 1916 HB2 SER 48 2HB SER 48 15.354 8.380 -7.852 1917 HB3 SER 48 1HB SER 48 15.685 6.876 -6.926 1918 HG SER 48 1HG SER 48 15.289 6.487 -9.105 1919 H VAL 49 H VAL 49 14.858 7.167 -4.261 1920 HA VAL 49 HA VAL 49 13.458 4.646 -3.989 1921 HB VAL 49 HB VAL 49 15.389 5.938 -2.027 1922 HG11 VAL 49 1HG1 VAL 49 15.658 3.554 -1.248 1923 HG12 VAL 49 2HG1 VAL 49 14.393 3.016 -2.416 1924 HG13 VAL 49 3HG1 VAL 49 13.965 4.102 -1.043 1925 HG21 VAL 49 3HG2 VAL 49 15.876 3.952 -4.361 1926 HG22 VAL 49 1HG2 VAL 49 17.085 4.386 -3.101 1927 HG23 VAL 49 2HG2 VAL 49 16.514 5.627 -4.256 1928 H GLU 50 H GLU 50 11.384 6.007 -4.115 1929 HA GLU 50 HA GLU 50 10.262 5.472 -1.639 1930 HB2 GLU 50 2HB GLU 50 9.041 7.413 -0.971 1931 HB3 GLU 50 1HB GLU 50 10.774 7.726 -0.831 1932 HG2 GLU 50 2HG GLU 50 10.671 9.225 -2.848 1933 HG3 GLU 50 1HG GLU 50 8.910 8.871 -3.022 1934 H THR 51 H THR 51 10.005 7.048 -4.800 1935 HA THR 51 HA THR 51 7.275 6.770 -5.060 1936 HB THR 51 HB THR 51 8.494 8.417 -6.284 1937 HG1 THR 51 1HG THR 51 6.810 7.970 -7.454 1938 HG21 THR 51 3HG2 THR 51 10.038 7.830 -8.177 1939 HG22 THR 51 1HG2 THR 51 9.979 6.100 -7.699 1940 HG23 THR 51 2HG2 THR 51 10.674 7.345 -6.585 1941 H ALA 52 H ALA 52 9.876 4.464 -6.008 1942 HA ALA 52 HA ALA 52 8.131 2.748 -7.413 1943 HB1 ALA 52 1HB ALA 52 10.805 2.084 -6.024 1944 HB2 ALA 52 2HB ALA 52 10.580 2.564 -7.755 1945 HB3 ALA 52 3HB ALA 52 9.926 1.005 -7.166 1946 H THR 53 H THR 53 8.740 3.117 -3.933 1947 HA THR 53 HA THR 53 7.531 0.536 -3.382 1948 HB THR 53 HB THR 53 8.005 1.500 -0.954 1949 HG1 THR 53 1HG THR 53 8.586 3.590 -1.653 1950 HG21 THR 53 3HG2 THR 53 10.353 0.623 -1.166 1951 HG22 THR 53 1HG2 THR 53 10.213 0.670 -2.967 1952 HG23 THR 53 2HG2 THR 53 9.160 -0.435 -2.003 1953 H THR 54 H THR 54 6.389 3.490 -4.343 1954 HA THR 54 HA THR 54 4.647 4.720 -4.035 1955 HB THR 54 HB THR 54 2.406 3.436 -3.787 1956 HG1 THR 54 1HG THR 54 3.736 1.567 -2.920 1957 HG21 THR 54 3HG2 THR 54 4.452 2.802 -6.033 1958 HG22 THR 54 1HG2 THR 54 3.419 4.280 -5.915 1959 HG23 THR 54 2HG2 THR 54 2.656 2.667 -6.146 1960 H VAL 55 H VAL 55 6.091 5.158 -1.894 1961 HA VAL 55 HA VAL 55 4.072 5.637 0.143 1962 HB VAL 55 HB VAL 55 6.020 5.261 1.841 1963 HG11 VAL 55 1HG1 VAL 55 4.484 2.892 0.576 1964 HG12 VAL 55 2HG1 VAL 55 3.848 4.032 1.815 1965 HG13 VAL 55 3HG1 VAL 55 5.220 2.934 2.221 1966 HG21 VAL 55 3HG2 VAL 55 6.811 3.233 -0.364 1967 HG22 VAL 55 1HG2 VAL 55 7.535 3.362 1.267 1968 HG23 VAL 55 2HG2 VAL 55 7.795 4.687 0.081 1969 H GLY 56 H GLY 56 4.051 7.722 -0.843 1970 HA2 GLY 56 2HA GLY 56 6.644 9.068 -1.238 1971 HA3 GLY 56 1HA GLY 56 4.972 9.680 -1.601 1972 H TYR 57 H TYR 57 7.512 9.451 0.803 1973 HA TYR 57 HA TYR 57 5.703 9.855 2.999 1974 HB2 TYR 57 2HB TYR 57 7.957 8.527 3.027 1975 HB3 TYR 57 1HB TYR 57 8.784 10.127 3.077 1976 HD1 TYR 57 1HD TYR 57 8.518 11.564 5.072 1977 HD2 TYR 57 2HD TYR 57 6.609 7.712 4.911 1978 HE1 TYR 57 1HE TYR 57 7.913 11.761 7.436 1979 HE2 TYR 57 2HE TYR 57 6.008 7.912 7.301 1980 HH TYR 57 HH TYR 57 6.153 9.252 9.257 1981 H GLY 58 H GLY 58 7.403 11.815 0.745 1982 HA2 GLY 58 2HA GLY 58 6.472 13.910 0.346 1983 HA3 GLY 58 1HA GLY 58 6.260 14.183 2.113 1984 H ASP 59 H ASP 59 9.152 12.987 0.299 1985 HA ASP 59 HA ASP 59 10.641 15.114 1.630 1986 HB2 ASP 59 2HB ASP 59 11.564 12.793 1.529 1987 HB3 ASP 59 1HB ASP 59 11.776 12.995 -0.260 1988 H ARG 60 H ARG 60 9.827 14.018 -1.769 1989 HA ARG 60 HA ARG 60 10.130 16.856 -2.524 1990 HB2 ARG 60 2HB ARG 60 11.128 14.573 -4.307 1991 HB3 ARG 60 1HB ARG 60 11.199 16.330 -4.683 1992 HG2 ARG 60 2HG ARG 60 12.709 15.100 -2.324 1993 HG3 ARG 60 1HG ARG 60 13.360 15.090 -3.987 1994 HD2 ARG 60 2HD ARG 60 13.417 17.542 -4.133 1995 HD3 ARG 60 1HD ARG 60 12.587 17.721 -2.543 1996 HE ARG 60 HE ARG 60 15.400 16.702 -3.051 1997 HH11 ARG 60 1HH2 ARG 60 12.776 17.342 -0.637 1998 HH12 ARG 60 2HH2 ARG 60 13.518 16.461 0.576 1999 HH21 ARG 60 1HH1 ARG 60 16.498 15.702 -1.250 2000 HH22 ARG 60 2HH1 ARG 60 15.528 15.303 0.148 2001 H TYR 61 H TYR 61 9.490 16.197 -5.361 2002 HA TYR 61 HA TYR 61 7.141 14.728 -5.413 2003 HB2 TYR 61 2HB TYR 61 5.594 16.565 -6.111 2004 HB3 TYR 61 1HB TYR 61 6.106 16.811 -4.410 2005 HD1 TYR 61 2HD TYR 61 8.332 18.450 -4.160 2006 HD2 TYR 61 1HD TYR 61 5.554 18.415 -7.445 2007 HE1 TYR 61 2HE TYR 61 9.036 20.715 -4.782 2008 HE2 TYR 61 1HE TYR 61 6.248 20.674 -8.065 2009 HH TYR 61 HH TYR 61 8.245 22.096 -7.821 2010 HA PRO 62 HA PRO 62 9.096 15.524 -9.473 2011 HB2 PRO 62 2HB PRO 62 7.440 14.097 -11.181 2012 HB3 PRO 62 1HB PRO 62 8.480 13.261 -9.964 2013 HG2 PRO 62 2HG PRO 62 5.508 13.968 -9.753 2014 HG3 PRO 62 1HG PRO 62 6.307 12.387 -9.366 2015 HD2 PRO 62 2HD PRO 62 5.691 14.377 -7.464 2016 HD3 PRO 62 1HD PRO 62 7.094 13.225 -7.278 2017 H VAL 63 H VAL 63 8.131 16.349 -11.888 2018 HA VAL 63 HA VAL 63 6.422 18.602 -11.217 2019 HB VAL 63 HB VAL 63 7.126 19.491 -13.411 2020 HG11 VAL 63 1HG1 VAL 63 9.430 19.947 -12.736 2021 HG12 VAL 63 2HG1 VAL 63 9.475 18.513 -11.646 2022 HG13 VAL 63 3HG1 VAL 63 8.393 19.896 -11.270 2023 HG21 VAL 63 3HG2 VAL 63 7.440 17.255 -14.584 2024 HG22 VAL 63 1HG2 VAL 63 8.890 16.927 -13.549 2025 HG23 VAL 63 2HG2 VAL 63 8.890 18.270 -14.708 2026 H THR 64 H THR 64 5.173 19.088 -13.661 2027 HA THR 64 HA THR 64 3.229 16.920 -13.704 2028 HB THR 64 HB THR 64 2.788 19.684 -14.878 2029 HG1 THR 64 1HG THR 64 2.715 18.941 -12.130 2030 HG21 THR 64 3HG2 THR 64 0.958 17.672 -13.373 2031 HG22 THR 64 1HG2 THR 64 1.054 17.860 -15.159 2032 HG23 THR 64 2HG2 THR 64 0.453 19.219 -14.153 2033 H GLU 65 H GLU 65 4.847 19.200 -16.083 2034 HA GLU 65 HA GLU 65 3.676 18.077 -18.262 2035 HB2 GLU 65 2HB GLU 65 4.974 20.274 -18.224 2036 HB3 GLU 65 1HB GLU 65 6.490 19.308 -18.348 2037 HG2 GLU 65 2HG GLU 65 5.646 18.319 -20.508 2038 HG3 GLU 65 1HG GLU 65 4.122 19.265 -20.334 2039 H GLU 66 H GLU 66 6.719 17.069 -16.707 2040 HA GLU 66 HA GLU 66 6.203 14.455 -17.776 2041 HB2 GLU 66 2HB GLU 66 9.058 15.640 -17.875 2042 HB3 GLU 66 1HB GLU 66 8.661 13.882 -17.873 2043 HG2 GLU 66 2HG GLU 66 7.155 14.384 -19.950 2044 HG3 GLU 66 1HG GLU 66 8.090 15.918 -20.092 2045 H GLY 67 H GLY 67 8.895 14.026 -16.026 2046 HA2 GLY 67 2HA GLY 67 9.356 13.773 -13.857 2047 HA3 GLY 67 1HA GLY 67 8.077 14.990 -13.469 2048 H ARG 68 H ARG 68 5.813 14.224 -13.746 2049 HA ARG 68 HA ARG 68 5.453 11.882 -12.187 2050 HB2 ARG 68 2HB ARG 68 3.925 14.197 -12.783 2051 HB3 ARG 68 1HB ARG 68 2.955 12.883 -13.472 2052 HG2 ARG 68 2HG ARG 68 2.624 11.794 -11.414 2053 HG3 ARG 68 1HG ARG 68 4.105 12.468 -10.675 2054 HD2 ARG 68 2HD ARG 68 1.487 14.044 -11.149 2055 HD3 ARG 68 1HD ARG 68 2.176 13.421 -9.599 2056 HE ARG 68 HE ARG 68 3.833 15.337 -11.295 2057 HH11 ARG 68 1HH2 ARG 68 1.731 14.888 -8.319 2058 HH12 ARG 68 2HH2 ARG 68 2.413 16.256 -7.581 2059 HH21 ARG 68 1HH1 ARG 68 4.797 17.148 -9.736 2060 HH22 ARG 68 2HH1 ARG 68 3.589 17.808 -8.774 2061 H LYS 69 H LYS 69 5.215 12.674 -15.648 2062 HA LYS 69 HA LYS 69 3.925 10.237 -16.299 2063 HB2 LYS 69 2HB LYS 69 3.923 12.206 -17.852 2064 HB3 LYS 69 1HB LYS 69 5.700 12.035 -18.066 2065 HG2 LYS 69 2HG LYS 69 4.468 11.143 -20.006 2066 HG3 LYS 69 1HG LYS 69 5.409 9.858 -19.178 2067 HD2 LYS 69 2HD LYS 69 3.279 9.104 -17.996 2068 HD3 LYS 69 1HD LYS 69 2.346 10.274 -18.983 2069 HE2 LYS 69 2HE LYS 69 4.135 7.967 -20.056 2070 HE3 LYS 69 1HE LYS 69 2.351 7.846 -19.809 2071 HZ1 LYS 69 3HZ LYS 69 3.206 10.089 -21.519 2072 HZ2 LYS 69 1HZ LYS 69 1.947 8.976 -21.668 2073 HZ3 LYS 69 2HZ LYS 69 3.522 8.538 -22.097 2074 H VAL 70 H VAL 70 7.307 11.177 -15.752 2075 HA VAL 70 HA VAL 70 8.370 8.726 -16.789 2076 HB VAL 70 HB VAL 70 9.656 10.770 -14.891 2077 HG11 VAL 70 1HG1 VAL 70 10.858 8.565 -16.711 2078 HG12 VAL 70 2HG1 VAL 70 10.830 8.547 -14.912 2079 HG13 VAL 70 3HG1 VAL 70 11.802 9.784 -15.780 2080 HG21 VAL 70 3HG2 VAL 70 8.909 11.874 -17.023 2081 HG22 VAL 70 1HG2 VAL 70 9.638 10.545 -17.984 2082 HG23 VAL 70 2HG2 VAL 70 10.691 11.654 -17.047 2083 H ALA 71 H ALA 71 7.643 10.142 -13.568 2084 HA ALA 71 HA ALA 71 8.380 8.037 -11.979 2085 HB1 ALA 71 1HB ALA 71 6.931 8.986 -10.237 2086 HB2 ALA 71 2HB ALA 71 5.944 9.860 -11.465 2087 HB3 ALA 71 3HB ALA 71 7.645 10.362 -11.157 2088 H GLU 72 H GLU 72 5.261 8.574 -13.671 2089 HA GLU 72 HA GLU 72 3.624 6.765 -12.568 2090 HB2 GLU 72 2HB GLU 72 3.082 8.347 -14.505 2091 HB3 GLU 72 1HB GLU 72 3.953 7.247 -15.601 2092 HG2 GLU 72 2HG GLU 72 1.925 5.685 -14.160 2093 HG3 GLU 72 1HG GLU 72 1.160 7.218 -14.703 2094 H GLN 73 H GLN 73 6.052 6.158 -15.069 2095 HA GLN 73 HA GLN 73 5.475 3.453 -15.508 2096 HB2 GLN 73 2HB GLN 73 6.743 5.095 -16.997 2097 HB3 GLN 73 1HB GLN 73 8.128 4.988 -15.868 2098 HG2 GLN 73 2HG GLN 73 8.424 2.560 -16.459 2099 HG3 GLN 73 1HG GLN 73 6.964 2.641 -17.523 2100 HE21 GLN 73 1HE2 GLN 73 8.277 2.222 -19.525 2101 HE22 GLN 73 2HE2 GLN 73 9.266 3.493 -20.168 2102 H VAL 74 H VAL 74 7.453 5.143 -13.094 2103 HA VAL 74 HA VAL 74 8.996 2.852 -12.367 2104 HB VAL 74 HB VAL 74 8.602 5.443 -10.779 2105 HG11 VAL 74 1HG1 VAL 74 10.875 4.856 -9.875 2106 HG12 VAL 74 2HG1 VAL 74 10.861 3.318 -10.819 2107 HG13 VAL 74 3HG1 VAL 74 9.667 3.583 -9.494 2108 HG21 VAL 74 3HG2 VAL 74 9.321 5.994 -13.115 2109 HG22 VAL 74 1HG2 VAL 74 10.643 4.778 -13.013 2110 HG23 VAL 74 2HG2 VAL 74 10.654 6.245 -11.957 2111 H MET 75 H MET 75 6.114 4.606 -11.075 2112 HA MET 75 HA MET 75 5.835 3.081 -8.747 2113 HB2 MET 75 2HB MET 75 3.673 4.472 -10.448 2114 HB3 MET 75 1HB MET 75 3.318 3.595 -8.926 2115 HG2 MET 75 2HG MET 75 3.547 5.512 -7.871 2116 HG3 MET 75 1HG MET 75 5.293 5.183 -7.973 2117 HE1 MET 75 3HE MET 75 2.449 6.516 -10.460 2118 HE2 MET 75 1HE MET 75 2.865 8.254 -10.588 2119 HE3 MET 75 2HE MET 75 2.288 7.584 -9.027 2120 H LYS 76 H LYS 76 4.538 2.561 -12.024 2121 HA LYS 76 HA LYS 76 3.034 0.275 -11.610 2122 HB2 LYS 76 2HB LYS 76 3.141 1.606 -13.777 2123 HB3 LYS 76 1HB LYS 76 4.834 1.102 -13.980 2124 HG2 LYS 76 2HG LYS 76 3.686 -0.232 -15.508 2125 HG3 LYS 76 1HG LYS 76 4.060 -1.338 -14.166 2126 HD2 LYS 76 2HD LYS 76 1.868 -1.858 -14.847 2127 HD3 LYS 76 1HD LYS 76 1.641 -0.946 -13.314 2128 HE2 LYS 76 2HE LYS 76 1.016 1.119 -14.638 2129 HE3 LYS 76 1HE LYS 76 1.463 0.275 -16.170 2130 HZ1 LYS 76 3HZ LYS 76 -0.837 -0.326 -14.392 2131 HZ2 LYS 76 1HZ LYS 76 -0.296 -1.400 -15.585 2132 HZ3 LYS 76 2HZ LYS 76 -0.808 0.142 -16.031 2133 H ALA 77 H ALA 77 6.498 0.597 -12.466 2134 HA ALA 77 HA ALA 77 7.042 -2.110 -12.729 2135 HB1 ALA 77 1HB ALA 77 9.452 -1.459 -12.532 2136 HB2 ALA 77 2HB ALA 77 8.964 0.159 -11.894 2137 HB3 ALA 77 3HB ALA 77 8.566 -0.302 -13.592 2138 H GLY 78 H GLY 78 6.944 -0.005 -9.883 2139 HA2 GLY 78 2HA GLY 78 8.277 -1.827 -8.146 2140 HA3 GLY 78 1HA GLY 78 7.276 -0.383 -7.738 2141 H ILE 79 H ILE 79 4.818 -0.997 -8.717 2142 HA ILE 79 HA ILE 79 3.864 -2.620 -6.674 2143 HB ILE 79 HB ILE 79 2.488 -1.670 -9.221 2144 HG12 ILE 79 2HG1 ILE 79 2.362 -0.626 -6.310 2145 HG13 ILE 79 1HG1 ILE 79 3.387 0.096 -7.571 2146 HG21 ILE 79 1HG2 ILE 79 1.240 -3.644 -8.304 2147 HG22 ILE 79 2HG2 ILE 79 0.334 -2.146 -7.948 2148 HG23 ILE 79 3HG2 ILE 79 1.293 -2.933 -6.649 2149 HD11 ILE 79 3HD ILE 79 0.300 -0.039 -7.626 2150 HD12 ILE 79 1HD ILE 79 1.324 1.409 -7.358 2151 HD13 ILE 79 2HD ILE 79 1.333 0.593 -8.964 2152 H GLU 80 H GLU 80 4.528 -3.446 -10.149 2153 HA GLU 80 HA GLU 80 3.341 -6.004 -9.849 2154 HB2 GLU 80 2HB GLU 80 4.401 -6.717 -11.922 2155 HB3 GLU 80 1HB GLU 80 3.547 -5.158 -12.110 2156 HG2 GLU 80 2HG GLU 80 5.650 -3.902 -12.174 2157 HG3 GLU 80 1HG GLU 80 6.615 -5.361 -11.750 2158 H VAL 81 H VAL 81 6.565 -4.788 -9.048 2159 HA VAL 81 HA VAL 81 7.794 -7.350 -8.920 2160 HB VAL 81 HB VAL 81 8.517 -4.567 -7.943 2161 HG11 VAL 81 1HG1 VAL 81 9.428 -5.966 -6.142 2162 HG12 VAL 81 2HG1 VAL 81 10.774 -5.526 -7.244 2163 HG13 VAL 81 3HG1 VAL 81 10.057 -7.176 -7.321 2164 HG21 VAL 81 3HG2 VAL 81 8.717 -5.237 -10.394 2165 HG22 VAL 81 1HG2 VAL 81 9.835 -6.565 -9.916 2166 HG23 VAL 81 2HG2 VAL 81 10.304 -4.847 -9.648 2167 H PHE 82 H PHE 82 6.325 -5.150 -6.446 2168 HA PHE 82 HA PHE 82 6.812 -7.054 -4.381 2169 HB2 PHE 82 2HB PHE 82 4.902 -4.631 -4.414 2170 HB3 PHE 82 1HB PHE 82 5.323 -5.601 -2.946 2171 HD1 PHE 82 1HD PHE 82 7.992 -5.996 -2.657 2172 HD2 PHE 82 2HD PHE 82 6.179 -2.679 -4.712 2173 HE1 PHE 82 1HE PHE 82 10.068 -4.691 -2.384 2174 HE2 PHE 82 2HE PHE 82 8.256 -1.385 -4.455 2175 HZ PHE 82 HZ PHE 82 10.215 -2.382 -3.290 2176 H ALA 83 H ALA 83 4.432 -6.892 -6.833 2177 HA ALA 83 HA ALA 83 2.453 -8.405 -5.431 2178 HB1 ALA 83 1HB ALA 83 1.909 -6.991 -7.450 2179 HB2 ALA 83 2HB ALA 83 1.390 -8.692 -7.649 2180 HB3 ALA 83 3HB ALA 83 2.878 -8.106 -8.479 2181 H LEU 84 H LEU 84 4.931 -9.132 -7.916 2182 HA LEU 84 HA LEU 84 4.514 -11.763 -8.344 2183 HB2 LEU 84 2HB LEU 84 6.005 -10.186 -9.587 2184 HB3 LEU 84 1HB LEU 84 7.229 -10.292 -8.294 2185 HG LEU 84 HG LEU 84 6.269 -12.810 -9.766 2186 HD11 LEU 84 1HD1 LEU 84 8.397 -10.843 -10.835 2187 HD12 LEU 84 2HD1 LEU 84 6.776 -11.162 -11.555 2188 HD13 LEU 84 3HD1 LEU 84 8.013 -12.469 -11.515 2189 HD21 LEU 84 3HD2 LEU 84 9.009 -12.042 -8.537 2190 HD22 LEU 84 1HD2 LEU 84 8.658 -13.566 -9.428 2191 HD23 LEU 84 2HD2 LEU 84 7.837 -13.237 -7.872 2192 H VAL 85 H VAL 85 6.538 -10.351 -5.733 2193 HA VAL 85 HA VAL 85 7.720 -12.720 -4.936 2194 HB VAL 85 HB VAL 85 8.304 -11.631 -2.840 2195 HG11 VAL 85 1HG1 VAL 85 9.564 -9.756 -3.819 2196 HG12 VAL 85 2HG1 VAL 85 8.422 -9.608 -5.191 2197 HG13 VAL 85 3HG1 VAL 85 9.476 -11.050 -5.062 2198 HG21 VAL 85 3HG2 VAL 85 6.353 -9.405 -3.729 2199 HG22 VAL 85 1HG2 VAL 85 7.471 -9.315 -2.328 2200 HG23 VAL 85 2HG2 VAL 85 6.116 -10.489 -2.312 2201 H THR 86 H THR 86 4.427 -11.739 -4.525 2202 HA THR 86 HA THR 86 3.916 -13.126 -2.139 2203 HB THR 86 HB THR 86 1.868 -12.449 -4.272 2204 HG1 THR 86 1HG THR 86 2.899 -10.593 -3.944 2205 HG21 THR 86 3HG2 THR 86 1.009 -13.797 -2.303 2206 HG22 THR 86 1HG2 THR 86 0.387 -12.113 -2.249 2207 HG23 THR 86 2HG2 THR 86 1.739 -12.599 -1.169 2208 H ALA 87 H ALA 87 4.575 -14.303 -5.338 2209 HA ALA 87 HA ALA 87 3.082 -16.702 -5.238 2210 HB1 ALA 87 1HB ALA 87 4.796 -17.558 -6.879 2211 HB2 ALA 87 2HB ALA 87 5.839 -16.129 -6.518 2212 HB3 ALA 87 3HB ALA 87 4.247 -15.902 -7.317 2213 H ALA 88 H ALA 88 5.976 -15.598 -3.562 2214 HA ALA 88 HA ALA 88 6.822 -18.216 -2.729 2215 HB1 ALA 88 1HB ALA 88 8.285 -16.882 -1.104 2216 HB2 ALA 88 2HB ALA 88 7.437 -15.387 -1.581 2217 HB3 ALA 88 3HB ALA 88 8.458 -16.242 -2.783 2218 H LEU 89 H LEU 89 5.053 -15.440 -1.425 2219 HA LEU 89 HA LEU 89 4.772 -16.501 1.141 2220 HB2 LEU 89 2HB LEU 89 3.118 -14.301 -0.215 2221 HB3 LEU 89 1HB LEU 89 3.333 -14.537 1.553 2222 HG LEU 89 HG LEU 89 5.624 -13.887 -0.436 2223 HD11 LEU 89 1HD1 LEU 89 5.607 -11.604 0.462 2224 HD12 LEU 89 2HD1 LEU 89 4.183 -11.996 1.486 2225 HD13 LEU 89 3HD1 LEU 89 4.023 -11.987 -0.303 2226 HD21 LEU 89 3HD2 LEU 89 6.953 -13.348 1.610 2227 HD22 LEU 89 1HD2 LEU 89 6.478 -15.076 1.580 2228 HD23 LEU 89 2HD2 LEU 89 5.603 -13.924 2.651 2229 H ALA 90 H ALA 90 2.722 -16.647 -1.755 2230 HA ALA 90 HA ALA 90 0.431 -17.640 -0.498 2231 HB1 ALA 90 1HB ALA 90 1.433 -18.106 -3.376 2232 HB2 ALA 90 2HB ALA 90 0.412 -16.730 -2.827 2233 HB3 ALA 90 3HB ALA 90 -0.251 -18.404 -2.784 2234 H THR 91 H THR 91 3.494 -19.263 -1.290 2235 HA THR 91 HA THR 91 2.155 -21.846 -0.892 2236 HB THR 91 HB THR 91 3.528 -21.857 -2.801 2237 HG1 THR 91 1HG THR 91 4.331 -23.304 -0.589 2238 HG21 THR 91 3HG2 THR 91 5.871 -20.998 -0.982 2239 HG22 THR 91 1HG2 THR 91 5.146 -20.083 -2.351 2240 HG23 THR 91 2HG2 THR 91 6.029 -21.600 -2.681 2241 H ASP 92 H ASP 92 3.288 -19.359 1.109 2242 HA ASP 92 HA ASP 92 4.921 -21.050 2.723 2243 HB2 ASP 92 2HB ASP 92 4.259 -18.170 2.832 2244 HB3 ASP 92 1HB ASP 92 4.130 -18.919 4.456 2245 H PHE 93 H PHE 93 1.482 -20.408 2.575 2246 HA PHE 93 HA PHE 93 1.038 -21.593 5.134 2247 HB2 PHE 93 2HB PHE 93 -1.234 -21.592 4.793 2248 HB3 PHE 93 1HB PHE 93 -0.701 -20.161 3.864 2249 HD1 PHE 93 2HD PHE 93 -2.156 -23.559 3.682 2250 HD2 PHE 93 1HD PHE 93 -0.874 -20.152 1.404 2251 HE1 PHE 93 2HE PHE 93 -3.441 -24.378 1.733 2252 HE2 PHE 93 1HE PHE 93 -2.161 -20.959 -0.536 2253 HZ PHE 93 HZ PHE 93 -3.461 -23.071 -0.380 2254 H VAL 94 H VAL 94 1.399 -22.807 1.830 2255 HA VAL 94 HA VAL 94 0.331 -25.326 2.208 2256 HB VAL 94 HB VAL 94 2.494 -24.495 0.207 2257 HG11 VAL 94 1HG1 VAL 94 1.407 -26.255 -1.251 2258 HG12 VAL 94 2HG1 VAL 94 0.348 -26.733 0.129 2259 HG13 VAL 94 3HG1 VAL 94 2.132 -26.967 0.230 2260 HG21 VAL 94 3HG2 VAL 94 -0.592 -24.262 0.068 2261 HG22 VAL 94 1HG2 VAL 94 0.541 -23.928 -1.287 2262 HG23 VAL 94 2HG2 VAL 94 0.548 -22.879 0.158 2263 H ARG 95 H ARG 95 3.428 -24.013 3.090 2264 HA ARG 95 HA ARG 95 4.981 -26.306 3.329 2265 HB2 ARG 95 2HB ARG 95 4.878 -23.739 5.025 2266 HB3 ARG 95 1HB ARG 95 6.179 -24.955 5.166 2267 HG2 ARG 95 2HG ARG 95 5.513 -23.507 2.517 2268 HG3 ARG 95 1HG ARG 95 6.642 -22.849 3.726 2269 HD2 ARG 95 2HD ARG 95 6.964 -25.607 2.338 2270 HD3 ARG 95 1HD ARG 95 7.860 -24.086 1.902 2271 HE ARG 95 HE ARG 95 8.468 -24.130 4.473 2272 HH11 ARG 95 1HH2 ARG 95 8.324 -27.211 2.473 2273 HH12 ARG 95 2HH2 ARG 95 9.864 -27.687 3.028 2274 HH21 ARG 95 1HH1 ARG 95 10.288 -25.080 5.411 2275 HH22 ARG 95 2HH1 ARG 95 10.991 -26.550 4.754 2276 H ARG 96 H ARG 96 2.209 -25.245 5.310 2277 HA ARG 96 HA ARG 96 2.886 -26.510 7.681 2278 HB2 ARG 96 2HB ARG 96 0.542 -26.681 8.305 2279 HB3 ARG 96 1HB ARG 96 0.850 -25.067 7.622 2280 HG2 ARG 96 2HG ARG 96 -0.438 -25.513 5.671 2281 HG3 ARG 96 1HG ARG 96 -0.352 -27.273 5.821 2282 HD2 ARG 96 2HD ARG 96 -1.743 -25.717 8.050 2283 HD3 ARG 96 1HD ARG 96 -2.546 -25.832 6.440 2284 HE ARG 96 HE ARG 96 -2.421 -28.301 6.522 2285 HH11 ARG 96 1HH2 ARG 96 -1.840 -26.713 9.799 2286 HH12 ARG 96 2HH2 ARG 96 -2.997 -27.680 10.579 2287 HH21 ARG 96 1HH1 ARG 96 -3.833 -29.774 7.745 2288 HH22 ARG 96 2HH1 ARG 96 -3.896 -29.634 9.459 2289 H GLU 97 H GLU 97 1.753 -27.883 4.628 2290 HA GLU 97 HA GLU 97 0.787 -30.279 5.864 2291 HB2 GLU 97 2HB GLU 97 1.292 -29.576 2.931 2292 HB3 GLU 97 1HB GLU 97 0.599 -31.133 3.485 2293 HG2 GLU 97 2HG GLU 97 -0.675 -28.358 3.971 2294 HG3 GLU 97 1HG GLU 97 -1.159 -29.531 2.699 2295 H GLU 98 H GLU 98 3.894 -29.090 5.028 2296 HA GLU 98 HA GLU 98 5.022 -31.753 4.713 2297 HB2 GLU 98 2HB GLU 98 6.515 -29.073 4.900 2298 HB3 GLU 98 1HB GLU 98 7.116 -30.650 4.288 2299 HG2 GLU 98 2HG GLU 98 5.135 -30.456 2.520 2300 HG3 GLU 98 1HG GLU 98 5.024 -28.739 3.034 2301 H GLU 99 H GLU 99 4.858 -28.989 7.007 2302 HA GLU 99 HA GLU 99 6.552 -30.071 8.892 2303 HB2 GLU 99 2HB GLU 99 4.271 -28.058 9.214 2304 HB3 GLU 99 1HB GLU 99 5.465 -28.416 10.506 2305 HG2 GLU 99 2HG GLU 99 6.330 -27.401 7.706 2306 HG3 GLU 99 1HG GLU 99 5.928 -26.324 9.089 2307 H ARG 100 H ARG 100 3.012 -30.546 8.616 2308 HA ARG 100 HA ARG 100 2.940 -31.927 11.122 2309 HB2 ARG 100 2HB ARG 100 0.652 -32.671 10.475 2310 HB3 ARG 100 1HB ARG 100 0.923 -30.903 10.385 2311 HG2 ARG 100 2HG ARG 100 1.352 -31.189 7.858 2312 HG3 ARG 100 1HG ARG 100 0.740 -32.858 8.005 2313 HD2 ARG 100 2HD ARG 100 -0.813 -30.329 8.928 2314 HD3 ARG 100 1HD ARG 100 -0.979 -31.026 7.287 2315 HE ARG 100 HE ARG 100 -1.842 -32.255 9.905 2316 HH11 ARG 100 1HH2 ARG 100 -1.795 -32.449 6.245 2317 HH12 ARG 100 2HH2 ARG 100 -2.877 -33.733 6.183 2318 HH21 ARG 100 1HH1 ARG 100 -3.515 -33.924 9.703 2319 HH22 ARG 100 2HH1 ARG 100 -3.800 -34.695 8.212 2320 H ARG 101 H ARG 101 4.133 -32.918 8.026 2321 HA ARG 101 HA ARG 101 3.700 -35.757 8.659 2322 HB2 ARG 101 2HB ARG 101 5.216 -34.469 6.320 2323 HB3 ARG 101 1HB ARG 101 4.932 -36.232 6.560 2324 HG2 ARG 101 2HG ARG 101 2.440 -35.836 6.399 2325 HG3 ARG 101 1HG ARG 101 2.772 -34.091 6.132 2326 HD2 ARG 101 2HD ARG 101 4.256 -34.820 4.111 2327 HD3 ARG 101 1HD ARG 101 3.533 -36.476 4.311 2328 HE ARG 101 HE ARG 101 1.469 -34.409 4.176 2329 HH11 ARG 101 1HH2 ARG 101 3.793 -36.220 2.062 2330 HH12 ARG 101 2HH2 ARG 101 3.485 -35.211 0.713 2331 HH21 ARG 101 1HH1 ARG 101 0.524 -33.722 2.237 2332 HH22 ARG 101 2HH1 ARG 101 1.253 -34.039 0.679 2333 H GLY 102 H GLY 102 6.052 -33.137 8.896 2334 HA2 GLY 102 2HA GLY 102 7.869 -32.994 10.117 2335 HA3 GLY 102 1HA GLY 102 7.640 -34.695 10.671 2336 H HIS 103 H HIS 103 7.907 -33.509 7.295 2337 HA HIS 103 HA HIS 103 10.581 -34.502 7.028 2338 HB2 HIS 103 2HB HIS 103 8.236 -35.892 5.534 2339 HB3 HIS 103 1HB HIS 103 9.966 -36.011 5.057 2340 HD1 HIS 103 1HD HIS 103 7.752 -37.036 8.076 2341 HD2 HIS 103 2HD HIS 103 11.627 -37.590 6.549 2342 HE1 HIS 103 1HE HIS 103 8.894 -38.734 9.535 2343 HE2 HIS 103 2HE HIS 103 11.291 -38.869 8.681 2344 H1 SER 1 H SER 1 -4.390 -18.847 17.898 2345 HA SER 1 HA SER 1 -1.956 -19.561 17.266 2346 HB2 SER 1 2HB SER 1 -3.578 -21.012 19.466 2347 HB3 SER 1 1HB SER 1 -1.833 -20.559 19.527 2348 HG SER 1 1HG SER 1 -3.573 -19.258 20.641 2349 H ALA 2 H ALA 2 -4.037 -20.849 15.514 2350 HA ALA 2 HA ALA 2 -4.178 -23.587 16.101 2351 HB1 ALA 2 1HB ALA 2 -5.119 -23.877 13.808 2352 HB2 ALA 2 2HB ALA 2 -4.579 -22.220 13.363 2353 HB3 ALA 2 3HB ALA 2 -5.849 -22.452 14.622 2354 H ASP 3 H ASP 3 -1.845 -21.748 14.125 2355 HA ASP 3 HA ASP 3 -0.195 -23.948 13.440 2356 HB2 ASP 3 2HB ASP 3 -2.322 -24.605 12.202 2357 HB3 ASP 3 1HB ASP 3 -2.459 -22.980 11.503 2358 H HIS 4 H HIS 4 -0.524 -22.149 10.781 2359 HA HIS 4 HA HIS 4 1.465 -20.394 10.972 2360 HB2 HIS 4 2HB HIS 4 0.394 -19.130 9.033 2361 HB3 HIS 4 1HB HIS 4 0.508 -20.901 8.808 2362 HD1 HIS 4 1HD HIS 4 -1.641 -22.272 8.965 2363 HD2 HIS 4 2HD HIS 4 -2.343 -18.254 9.872 2364 HE1 HIS 4 1HE HIS 4 -4.195 -21.898 8.921 2365 HE2 HIS 4 2HE HIS 4 -4.463 -19.505 9.834 2366 H GLU 5 H GLU 5 -1.688 -19.807 12.425 2367 HA GLU 5 HA GLU 5 -1.683 -17.053 12.418 2368 HB2 GLU 5 2HB GLU 5 -2.714 -18.577 14.844 2369 HB3 GLU 5 1HB GLU 5 -3.374 -17.115 14.050 2370 HG2 GLU 5 2HG GLU 5 -3.583 -20.032 13.007 2371 HG3 GLU 5 1HG GLU 5 -4.850 -19.073 13.841 2372 H ARG 6 H ARG 6 0.177 -19.355 14.396 2373 HA ARG 6 HA ARG 6 0.858 -17.490 16.442 2374 HB2 ARG 6 2HB ARG 6 1.074 -19.910 16.929 2375 HB3 ARG 6 1HB ARG 6 2.170 -20.122 15.527 2376 HG2 ARG 6 2HG ARG 6 3.470 -20.222 17.576 2377 HG3 ARG 6 1HG ARG 6 3.934 -18.793 16.621 2378 HD2 ARG 6 2HD ARG 6 2.097 -17.585 18.297 2379 HD3 ARG 6 1HD ARG 6 2.587 -18.940 19.373 2380 HE ARG 6 HE ARG 6 4.066 -16.548 18.686 2381 HH11 ARG 6 1HH2 ARG 6 4.820 -20.030 19.295 2382 HH12 ARG 6 2HH2 ARG 6 6.146 -19.703 20.310 2383 HH21 ARG 6 1HH1 ARG 6 6.026 -16.115 19.782 2384 HH22 ARG 6 2HH1 ARG 6 7.003 -17.390 20.413 2385 H GLU 7 H GLU 7 2.367 -18.515 13.339 2386 HA GLU 7 HA GLU 7 4.787 -17.161 13.898 2387 HB2 GLU 7 2HB GLU 7 4.379 -19.147 12.237 2388 HB3 GLU 7 1HB GLU 7 3.840 -17.882 11.086 2389 HG2 GLU 7 2HG GLU 7 6.153 -18.350 10.594 2390 HG3 GLU 7 1HG GLU 7 6.162 -16.760 11.436 2391 H ALA 8 H ALA 8 1.720 -16.310 12.339 2392 HA ALA 8 HA ALA 8 2.466 -13.858 11.242 2393 HB1 ALA 8 1HB ALA 8 -0.246 -14.662 12.491 2394 HB2 ALA 8 2HB ALA 8 0.235 -14.912 10.774 2395 HB3 ALA 8 3HB ALA 8 0.033 -13.243 11.422 2396 H GLN 9 H GLN 9 1.241 -14.647 14.547 2397 HA GLN 9 HA GLN 9 1.227 -11.971 15.435 2398 HB2 GLN 9 2HB GLN 9 1.561 -14.571 17.057 2399 HB3 GLN 9 1HB GLN 9 1.298 -12.943 17.778 2400 HG2 GLN 9 2HG GLN 9 -0.928 -12.760 16.716 2401 HG3 GLN 9 1HG GLN 9 -0.712 -14.363 15.917 2402 HE21 GLN 9 1HE2 GLN 9 -2.827 -14.648 17.306 2403 HE22 GLN 9 2HE2 GLN 9 -2.619 -15.276 18.903 2404 H LYS 10 H LYS 10 3.793 -14.418 15.291 2405 HA LYS 10 HA LYS 10 5.568 -13.080 17.064 2406 HB2 LYS 10 2HB LYS 10 5.808 -15.485 16.572 2407 HB3 LYS 10 1HB LYS 10 6.068 -15.130 14.831 2408 HG2 LYS 10 2HG LYS 10 8.192 -14.018 15.300 2409 HG3 LYS 10 1HG LYS 10 7.957 -14.171 17.079 2410 HD2 LYS 10 2HD LYS 10 8.372 -16.524 17.044 2411 HD3 LYS 10 1HD LYS 10 7.834 -16.675 15.343 2412 HE2 LYS 10 2HE LYS 10 10.278 -17.056 15.530 2413 HE3 LYS 10 1HE LYS 10 9.888 -15.653 14.461 2414 HZ1 LYS 10 3HZ LYS 10 10.698 -14.150 16.079 2415 HZ2 LYS 10 1HZ LYS 10 11.749 -15.457 16.109 2416 HZ3 LYS 10 2HZ LYS 10 10.640 -15.289 17.342 2417 H ALA 11 H ALA 11 4.923 -12.932 13.551 2418 HA ALA 11 HA ALA 11 7.161 -11.400 12.874 2419 HB1 ALA 11 1HB ALA 11 5.955 -10.855 10.782 2420 HB2 ALA 11 2HB ALA 11 4.392 -11.374 11.518 2421 HB3 ALA 11 3HB ALA 11 5.687 -12.585 11.192 2422 H GLU 12 H GLU 12 3.928 -10.426 14.128 2423 HA GLU 12 HA GLU 12 4.343 -7.677 13.631 2424 HB2 GLU 12 2HB GLU 12 2.465 -8.942 15.709 2425 HB3 GLU 12 1HB GLU 12 2.447 -7.237 15.137 2426 HG2 GLU 12 2HG GLU 12 2.037 -8.131 12.758 2427 HG3 GLU 12 1HG GLU 12 1.769 -9.758 13.486 2428 H GLU 13 H GLU 13 5.581 -9.771 16.083 2429 HA GLU 13 HA GLU 13 6.009 -7.810 18.117 2430 HB2 GLU 13 2HB GLU 13 5.708 -10.368 18.236 2431 HB3 GLU 13 1HB GLU 13 7.406 -10.534 17.707 2432 HG2 GLU 13 2HG GLU 13 8.230 -9.525 19.771 2433 HG3 GLU 13 1HG GLU 13 6.574 -8.991 20.249 2434 H GLU 14 H GLU 14 7.776 -9.273 15.434 2435 HA GLU 14 HA GLU 14 10.305 -8.202 15.862 2436 HB2 GLU 14 2HB GLU 14 9.572 -10.156 14.320 2437 HB3 GLU 14 1HB GLU 14 8.954 -8.918 13.186 2438 HG2 GLU 14 2HG GLU 14 11.002 -9.579 12.280 2439 HG3 GLU 14 1HG GLU 14 11.390 -8.001 13.050 2440 H LEU 15 H LEU 15 7.404 -6.957 14.212 2441 HA LEU 15 HA LEU 15 8.697 -4.911 12.852 2442 HB2 LEU 15 2HB LEU 15 6.371 -5.750 12.347 2443 HB3 LEU 15 1HB LEU 15 5.768 -4.885 13.796 2444 HG LEU 15 HG LEU 15 6.392 -2.707 12.798 2445 HD11 LEU 15 1HD1 LEU 15 7.578 -4.346 10.465 2446 HD12 LEU 15 2HD1 LEU 15 8.445 -3.204 11.563 2447 HD13 LEU 15 3HD1 LEU 15 7.243 -2.584 10.399 2448 HD21 LEU 15 3HD2 LEU 15 4.878 -4.460 10.750 2449 HD22 LEU 15 1HD2 LEU 15 4.815 -2.666 10.873 2450 HD23 LEU 15 2HD2 LEU 15 4.164 -3.681 12.210 2451 H GLN 16 H GLN 16 7.253 -5.023 16.096 2452 HA GLN 16 HA GLN 16 7.500 -2.260 16.622 2453 HB2 GLN 16 2HB GLN 16 7.280 -4.685 18.469 2454 HB3 GLN 16 1HB GLN 16 7.181 -2.983 19.041 2455 HG2 GLN 16 2HG GLN 16 5.170 -2.529 17.761 2456 HG3 GLN 16 1HG GLN 16 5.309 -4.044 16.812 2457 HE21 GLN 16 1HE2 GLN 16 4.561 -5.986 17.670 2458 HE22 GLN 16 2HE2 GLN 16 3.795 -6.142 19.223 2459 H LYS 17 H LYS 17 9.700 -4.987 16.904 2460 HA LYS 17 HA LYS 17 11.614 -3.829 18.576 2461 HB2 LYS 17 2HB LYS 17 11.206 -6.294 17.832 2462 HB3 LYS 17 1HB LYS 17 12.102 -5.891 16.334 2463 HG2 LYS 17 2HG LYS 17 14.155 -5.406 17.749 2464 HG3 LYS 17 1HG LYS 17 13.174 -5.725 19.221 2465 HD2 LYS 17 2HD LYS 17 14.362 -7.754 18.868 2466 HD3 LYS 17 1HD LYS 17 12.682 -8.063 18.305 2467 HE2 LYS 17 2HE LYS 17 13.585 -7.554 15.876 2468 HE3 LYS 17 1HE LYS 17 15.237 -7.624 16.603 2469 HZ1 LYS 17 3HZ LYS 17 14.363 -9.982 17.408 2470 HZ2 LYS 17 1HZ LYS 17 14.874 -9.721 15.812 2471 HZ3 LYS 17 2HZ LYS 17 13.242 -9.735 16.143 2472 H VAL 18 H VAL 18 11.237 -3.833 14.967 2473 HA VAL 18 HA VAL 18 13.740 -2.486 14.663 2474 HB VAL 18 HB VAL 18 13.220 -2.233 12.294 2475 HG11 VAL 18 1HG1 VAL 18 12.796 -5.071 13.475 2476 HG12 VAL 18 2HG1 VAL 18 14.388 -4.245 13.271 2477 HG13 VAL 18 3HG1 VAL 18 13.398 -4.681 11.826 2478 HG21 VAL 18 3HG2 VAL 18 10.671 -2.077 12.499 2479 HG22 VAL 18 1HG2 VAL 18 10.648 -3.827 12.934 2480 HG23 VAL 18 2HG2 VAL 18 11.224 -3.312 11.315 2481 H LEU 19 H LEU 19 10.405 -1.420 15.189 2482 HA LEU 19 HA LEU 19 10.708 1.239 14.369 2483 HB2 LEU 19 2HB LEU 19 9.191 0.340 16.913 2484 HB3 LEU 19 1HB LEU 19 9.002 1.882 16.036 2485 HG LEU 19 HG LEU 19 8.177 -0.917 15.137 2486 HD11 LEU 19 1HD1 LEU 19 6.687 0.148 16.815 2487 HD12 LEU 19 2HD1 LEU 19 5.870 -0.007 15.213 2488 HD13 LEU 19 3HD1 LEU 19 6.509 1.592 15.748 2489 HD21 LEU 19 3HD2 LEU 19 7.171 0.091 13.130 2490 HD22 LEU 19 1HD2 LEU 19 8.960 0.235 13.098 2491 HD23 LEU 19 2HD2 LEU 19 7.945 1.676 13.494 2492 H GLU 20 H GLU 20 11.380 -0.385 17.507 2493 HA GLU 20 HA GLU 20 12.089 1.912 18.884 2494 HB2 GLU 20 2HB GLU 20 13.074 -0.960 19.386 2495 HB3 GLU 20 1HB GLU 20 13.226 0.419 20.532 2496 HG2 GLU 20 2HG GLU 20 10.695 0.628 20.562 2497 HG3 GLU 20 1HG GLU 20 10.588 -0.844 19.536 2498 H GLU 21 H GLU 21 14.216 -0.419 17.090 2499 HA GLU 21 HA GLU 21 16.511 1.154 17.787 2500 HB2 GLU 21 2HB GLU 21 16.705 -1.301 17.253 2501 HB3 GLU 21 1HB GLU 21 16.394 -0.891 15.535 2502 HG2 GLU 21 2HG GLU 21 18.779 -1.100 15.753 2503 HG3 GLU 21 1HG GLU 21 18.492 0.673 15.686 2504 H ALA 22 H ALA 22 14.222 1.124 14.983 2505 HA ALA 22 HA ALA 22 15.749 2.762 13.318 2506 HB1 ALA 22 1HB ALA 22 13.605 3.366 12.178 2507 HB2 ALA 22 2HB ALA 22 12.680 2.619 13.530 2508 HB3 ALA 22 3HB ALA 22 13.706 1.594 12.462 2509 H SER 23 H SER 23 13.596 3.535 16.011 2510 HA SER 23 HA SER 23 13.356 6.275 15.622 2511 HB2 SER 23 2HB SER 23 13.613 4.767 18.318 2512 HB3 SER 23 1HB SER 23 12.879 6.392 18.078 2513 HG SER 23 1HG SER 23 11.969 3.923 16.925 2514 H LYS 24 H LYS 24 15.867 4.342 17.231 2515 HA LYS 24 HA LYS 24 17.299 6.533 18.281 2516 HB2 LYS 24 2HB LYS 24 17.340 4.173 19.161 2517 HB3 LYS 24 1HB LYS 24 18.281 3.662 17.732 2518 HG2 LYS 24 2HG LYS 24 19.235 5.867 19.692 2519 HG3 LYS 24 1HG LYS 24 19.476 4.109 19.985 2520 HD2 LYS 24 2HD LYS 24 20.632 3.922 17.757 2521 HD3 LYS 24 1HD LYS 24 20.649 5.716 17.628 2522 HE2 LYS 24 2HE LYS 24 22.064 5.932 19.637 2523 HE3 LYS 24 1HE LYS 24 21.897 4.163 19.992 2524 HZ1 LYS 24 3HZ LYS 24 23.989 4.663 18.917 2525 HZ2 LYS 24 1HZ LYS 24 23.199 5.377 17.594 2526 HZ3 LYS 24 2HZ LYS 24 22.986 3.684 17.929 2527 H LYS 25 H LYS 25 17.389 4.599 15.286 2528 HA LYS 25 HA LYS 25 19.711 5.798 14.238 2529 HB2 LYS 25 2HB LYS 25 17.365 4.598 12.672 2530 HB3 LYS 25 1HB LYS 25 18.962 5.043 11.987 2531 HG2 LYS 25 2HG LYS 25 20.092 3.385 13.502 2532 HG3 LYS 25 1HG LYS 25 18.509 2.967 14.214 2533 HD2 LYS 25 2HD LYS 25 17.798 2.359 11.732 2534 HD3 LYS 25 1HD LYS 25 19.574 2.325 11.430 2535 HE2 LYS 25 2HE LYS 25 19.725 0.696 13.489 2536 HE3 LYS 25 1HE LYS 25 17.917 0.644 13.448 2537 HZ1 LYS 25 3HZ LYS 25 19.866 -0.310 11.425 2538 HZ2 LYS 25 1HZ LYS 25 18.215 -0.108 11.040 2539 HZ3 LYS 25 2HZ LYS 25 18.695 -1.192 12.274 2540 H ALA 26 H ALA 26 16.211 6.580 13.661 2541 HA ALA 26 HA ALA 26 16.586 8.674 11.944 2542 HB1 ALA 26 1HB ALA 26 14.323 9.465 12.637 2543 HB2 ALA 26 2HB ALA 26 14.403 8.424 14.115 2544 HB3 ALA 26 3HB ALA 26 14.351 7.674 12.480 2545 H VAL 27 H VAL 27 16.426 8.867 15.565 2546 HA VAL 27 HA VAL 27 16.606 11.691 15.494 2547 HB VAL 27 HB VAL 27 15.550 10.374 17.299 2548 HG11 VAL 27 1HG1 VAL 27 17.315 8.581 17.474 2549 HG12 VAL 27 2HG1 VAL 27 16.858 9.292 19.053 2550 HG13 VAL 27 3HG1 VAL 27 18.418 9.750 18.274 2551 HG21 VAL 27 3HG2 VAL 27 17.787 12.229 18.296 2552 HG22 VAL 27 1HG2 VAL 27 16.248 11.835 19.150 2553 HG23 VAL 27 2HG2 VAL 27 16.197 12.784 17.607 2554 H GLU 28 H GLU 28 19.045 9.170 15.373 2555 HA GLU 28 HA GLU 28 21.168 10.969 16.193 2556 HB2 GLU 28 2HB GLU 28 20.952 8.541 16.914 2557 HB3 GLU 28 1HB GLU 28 21.344 8.053 15.244 2558 HG2 GLU 28 2HG GLU 28 23.607 9.007 15.439 2559 HG3 GLU 28 1HG GLU 28 23.163 9.856 16.974 2560 H ALA 29 H ALA 29 19.692 9.562 13.352 2561 HA ALA 29 HA ALA 29 21.605 10.197 11.411 2562 HB1 ALA 29 1HB ALA 29 19.643 9.759 9.866 2563 HB2 ALA 29 2HB ALA 29 18.556 9.728 11.265 2564 HB3 ALA 29 3HB ALA 29 19.831 8.472 11.080 2565 H GLU 30 H GLU 30 18.433 11.719 12.299 2566 HA GLU 30 HA GLU 30 18.692 13.959 10.700 2567 HB2 GLU 30 2HB GLU 30 17.099 13.332 13.214 2568 HB3 GLU 30 1HB GLU 30 17.047 14.986 12.554 2569 HG2 GLU 30 2HG GLU 30 16.455 12.672 10.638 2570 HG3 GLU 30 1HG GLU 30 15.231 13.165 11.851 2571 H ARG 31 H ARG 31 20.185 13.263 13.768 2572 HA ARG 31 HA ARG 31 20.626 15.957 14.549 2573 HB2 ARG 31 2HB ARG 31 20.777 13.733 15.966 2574 HB3 ARG 31 1HB ARG 31 22.400 13.557 15.312 2575 HG2 ARG 31 2HG ARG 31 22.651 14.550 17.471 2576 HG3 ARG 31 1HG ARG 31 22.953 15.881 16.318 2577 HD2 ARG 31 2HD ARG 31 21.569 16.569 18.296 2578 HD3 ARG 31 1HD ARG 31 20.649 16.803 16.753 2579 HE ARG 31 HE ARG 31 19.785 14.336 17.366 2580 HH11 ARG 31 1HH2 ARG 31 20.186 17.212 19.619 2581 HH12 ARG 31 2HH2 ARG 31 18.788 16.758 20.523 2582 HH21 ARG 31 1HH1 ARG 31 17.926 13.827 18.837 2583 HH22 ARG 31 2HH1 ARG 31 17.569 14.954 20.113 2584 H GLY 32 H GLY 32 21.694 17.271 13.027 2585 HA2 GLY 32 2HA GLY 32 23.883 18.056 12.557 2586 HA3 GLY 32 1HA GLY 32 24.381 16.368 12.165 2587 H ALA 33 H ALA 33 21.252 16.499 11.057 2588 HA ALA 33 HA ALA 33 22.223 16.935 8.377 2589 HB1 ALA 33 1HB ALA 33 19.466 16.014 9.393 2590 HB2 ALA 33 2HB ALA 33 20.779 14.943 8.799 2591 HB3 ALA 33 3HB ALA 33 19.966 16.091 7.669 2592 HA PRO 34 HA PRO 34 20.253 20.960 8.680 2593 HB2 PRO 34 2HB PRO 34 20.487 21.890 6.056 2594 HB3 PRO 34 1HB PRO 34 21.896 21.713 7.176 2595 HG2 PRO 34 2HG PRO 34 20.962 19.750 5.017 2596 HG3 PRO 34 1HG PRO 34 22.645 20.343 5.339 2597 HD2 PRO 34 2HD PRO 34 21.680 17.917 6.312 2598 HD3 PRO 34 1HD PRO 34 22.865 18.924 7.260 2599 H GLY 35 H GLY 35 18.037 21.601 8.697 2600 HA2 GLY 35 2HA GLY 35 16.019 21.934 7.711 2601 HA3 GLY 35 1HA GLY 35 16.371 20.681 6.460 2602 H ALA 36 H ALA 36 17.481 19.486 9.312 2603 HA ALA 36 HA ALA 36 15.568 17.502 9.590 2604 HB1 ALA 36 1HB ALA 36 16.797 16.982 11.741 2605 HB2 ALA 36 2HB ALA 36 17.744 18.508 11.557 2606 HB3 ALA 36 3HB ALA 36 17.905 17.168 10.353 2607 H ALA 37 H ALA 37 13.638 17.670 10.484 2608 HA ALA 37 HA ALA 37 13.029 19.935 12.307 2609 HB1 ALA 37 1HB ALA 37 10.620 19.408 11.816 2610 HB2 ALA 37 2HB ALA 37 11.131 18.019 10.780 2611 HB3 ALA 37 3HB ALA 37 11.506 19.701 10.273 2612 H LEU 38 H LEU 38 13.482 16.417 11.984 2613 HA LEU 38 HA LEU 38 11.838 15.881 14.328 2614 HB2 LEU 38 2HB LEU 38 11.835 14.398 12.236 2615 HB3 LEU 38 1HB LEU 38 13.539 14.040 12.548 2616 HG LEU 38 HG LEU 38 11.160 13.297 14.371 2617 HD11 LEU 38 1HD1 LEU 38 12.909 11.606 12.465 2618 HD12 LEU 38 2HD1 LEU 38 11.202 12.089 12.185 2619 HD13 LEU 38 3HD1 LEU 38 11.612 10.970 13.538 2620 HD21 LEU 38 3HD2 LEU 38 12.842 11.683 15.452 2621 HD22 LEU 38 1HD2 LEU 38 13.118 13.412 15.853 2622 HD23 LEU 38 2HD2 LEU 38 14.156 12.586 14.622 2623 H ILE 39 H ILE 39 13.012 16.651 16.172 2624 HA ILE 39 HA ILE 39 15.645 15.428 16.459 2625 HB ILE 39 HB ILE 39 16.125 17.421 15.239 2626 HG12 ILE 39 2HG1 ILE 39 17.005 17.731 18.170 2627 HG13 ILE 39 1HG1 ILE 39 17.709 16.620 16.941 2628 HG21 ILE 39 1HG2 ILE 39 14.700 19.061 17.430 2629 HG22 ILE 39 2HG2 ILE 39 14.104 18.765 15.757 2630 HG23 ILE 39 3HG2 ILE 39 15.601 19.701 16.015 2631 HD11 ILE 39 3HD ILE 39 17.689 19.709 16.783 2632 HD12 ILE 39 1HD ILE 39 19.101 18.665 17.157 2633 HD13 ILE 39 2HD ILE 39 18.345 18.603 15.520 2634 H SER 40 H SER 40 14.044 14.151 17.961 2635 HA SER 40 HA SER 40 14.872 14.923 20.520 2636 HB2 SER 40 2HB SER 40 11.886 15.282 19.860 2637 HB3 SER 40 1HB SER 40 12.355 14.651 21.475 2638 HG SER 40 1HG SER 40 12.380 17.151 20.519 2639 H TYR 41 H TYR 41 14.371 13.091 22.010 2640 HA TYR 41 HA TYR 41 14.241 10.632 20.542 2641 HB2 TYR 41 2HB TYR 41 14.561 11.113 23.553 2642 HB3 TYR 41 1HB TYR 41 14.487 9.494 22.783 2643 HD1 TYR 41 2HD TYR 41 16.512 12.658 22.975 2644 HD2 TYR 41 1HD TYR 41 16.363 8.579 21.621 2645 HE1 TYR 41 2HE TYR 41 18.918 12.726 22.533 2646 HE2 TYR 41 1HE TYR 41 18.782 8.638 21.180 2647 HH TYR 41 HH TYR 41 20.721 9.940 21.176 2648 HA PRO 42 HA PRO 42 10.184 9.862 22.684 2649 HB2 PRO 42 2HB PRO 42 8.567 11.998 23.637 2650 HB3 PRO 42 1HB PRO 42 9.654 10.979 24.655 2651 HG2 PRO 42 2HG PRO 42 10.260 13.704 23.388 2652 HG3 PRO 42 1HG PRO 42 10.591 13.160 25.086 2653 HD2 PRO 42 2HD PRO 42 12.557 13.130 23.190 2654 HD3 PRO 42 1HD PRO 42 12.420 11.726 24.348 2655 H ASP 43 H ASP 43 10.766 12.639 20.670 2656 HA ASP 43 HA ASP 43 8.203 12.503 19.350 2657 HB2 ASP 43 2HB ASP 43 10.789 13.969 18.531 2658 HB3 ASP 43 1HB ASP 43 9.256 14.011 17.597 2659 H ALA 44 H ALA 44 11.526 11.238 18.927 2660 HA ALA 44 HA ALA 44 11.235 10.401 16.276 2661 HB1 ALA 44 1HB ALA 44 13.078 9.246 18.472 2662 HB2 ALA 44 2HB ALA 44 13.470 10.633 17.390 2663 HB3 ALA 44 3HB ALA 44 13.257 8.991 16.695 2664 H ILE 45 H ILE 45 10.624 8.730 19.392 2665 HA ILE 45 HA ILE 45 10.126 6.238 18.131 2666 HB ILE 45 HB ILE 45 10.960 6.347 20.400 2667 HG12 ILE 45 2HG1 ILE 45 9.429 4.830 21.613 2668 HG13 ILE 45 1HG1 ILE 45 8.139 5.102 20.400 2669 HG21 ILE 45 1HG2 ILE 45 9.867 8.473 21.096 2670 HG22 ILE 45 2HG2 ILE 45 9.565 7.163 22.282 2671 HG23 ILE 45 3HG2 ILE 45 8.261 7.657 21.146 2672 HD11 ILE 45 3HD ILE 45 10.918 3.880 19.792 2673 HD12 ILE 45 1HD ILE 45 9.401 2.942 20.047 2674 HD13 ILE 45 2HD ILE 45 9.550 4.040 18.629 2675 H TRP 46 H TRP 46 8.245 9.101 18.538 2676 HA TRP 46 HA TRP 46 5.771 7.656 18.187 2677 HB2 TRP 46 2HB TRP 46 6.455 10.283 19.120 2678 HB3 TRP 46 1HB TRP 46 5.550 10.545 17.594 2679 HD1 TRP 46 HD TRP 46 2.895 9.834 17.685 2680 HE1 TRP 46 1HE TRP 46 1.391 9.272 19.704 2681 HE3 TRP 46 3HE TRP 46 6.449 8.980 21.234 2682 HZ2 TRP 46 2HZ TRP 46 1.649 7.972 22.223 2683 HZ3 TRP 46 3HZ TRP 46 5.781 8.025 23.409 2684 HH2 TRP 46 HH TRP 46 3.412 7.533 23.905 2685 H TRP 47 H TRP 47 8.063 9.561 16.264 2686 HA TRP 47 HA TRP 47 6.601 9.557 13.864 2687 HB2 TRP 47 2HB TRP 47 8.601 11.039 14.429 2688 HB3 TRP 47 1HB TRP 47 9.655 9.592 14.334 2689 HD1 TRP 47 HD TRP 47 7.278 11.616 11.900 2690 HE1 TRP 47 1HE TRP 47 8.089 11.113 9.567 2691 HE3 TRP 47 3HE TRP 47 11.026 8.310 12.899 2692 HZ2 TRP 47 2HZ TRP 47 10.443 10.114 8.273 2693 HZ3 TRP 47 3HZ TRP 47 12.472 7.542 11.051 2694 HH2 TRP 47 HH TRP 47 12.201 8.445 8.773 2695 H SER 48 H SER 48 8.833 7.166 15.348 2696 HA SER 48 HA SER 48 8.908 5.694 12.859 2697 HB2 SER 48 2HB SER 48 9.992 4.889 15.600 2698 HB3 SER 48 1HB SER 48 10.439 4.193 13.995 2699 HG SER 48 1HG SER 48 10.912 6.789 15.054 2700 H VAL 49 H VAL 49 6.324 5.754 13.139 2701 HA VAL 49 HA VAL 49 5.717 3.035 13.969 2702 HB VAL 49 HB VAL 49 3.759 5.263 14.696 2703 HG11 VAL 49 1HG1 VAL 49 3.910 2.223 15.324 2704 HG12 VAL 49 2HG1 VAL 49 2.805 2.996 14.137 2705 HG13 VAL 49 3HG1 VAL 49 2.616 3.356 15.880 2706 HG21 VAL 49 3HG2 VAL 49 5.712 5.483 16.226 2707 HG22 VAL 49 1HG2 VAL 49 5.792 3.705 16.444 2708 HG23 VAL 49 2HG2 VAL 49 4.399 4.607 17.110 2709 H GLU 50 H GLU 50 4.245 6.082 12.434 2710 HA GLU 50 HA GLU 50 2.516 4.449 11.023 2711 HB2 GLU 50 2HB GLU 50 1.614 6.335 9.978 2712 HB3 GLU 50 1HB GLU 50 2.027 6.801 11.648 2713 HG2 GLU 50 2HG GLU 50 3.411 7.596 9.032 2714 HG3 GLU 50 1HG GLU 50 2.571 8.673 10.206 2715 H THR 51 H THR 51 5.666 5.783 10.232 2716 HA THR 51 HA THR 51 5.822 5.190 7.605 2717 HB THR 51 HB THR 51 7.426 6.534 8.827 2718 HG1 THR 51 1HG THR 51 8.254 5.707 6.994 2719 HG21 THR 51 3HG2 THR 51 7.497 5.293 10.967 2720 HG22 THR 51 1HG2 THR 51 9.149 5.517 10.311 2721 HG23 THR 51 2HG2 THR 51 8.345 3.907 10.174 2722 H ALA 52 H ALA 52 5.903 2.826 10.292 2723 HA ALA 52 HA ALA 52 6.902 0.700 8.595 2724 HB1 ALA 52 1HB ALA 52 6.243 -0.786 10.526 2725 HB2 ALA 52 2HB ALA 52 5.543 0.645 11.363 2726 HB3 ALA 52 3HB ALA 52 7.317 0.565 11.031 2727 H THR 53 H THR 53 3.816 2.154 9.492 2728 HA THR 53 HA THR 53 2.228 0.000 8.528 2729 HB THR 53 HB THR 53 1.355 2.881 9.087 2730 HG1 THR 53 1HG THR 53 1.334 2.498 11.189 2731 HG21 THR 53 3HG2 THR 53 -0.388 1.308 8.152 2732 HG22 THR 53 1HG2 THR 53 -0.752 1.722 9.864 2733 HG23 THR 53 2HG2 THR 53 -0.024 0.119 9.456 2734 H THR 54 H THR 54 4.263 2.134 7.024 2735 HA THR 54 HA THR 54 4.589 2.923 5.072 2736 HB THR 54 HB THR 54 3.506 1.702 3.039 2737 HG1 THR 54 1HG THR 54 2.010 0.695 4.796 2738 HG21 THR 54 3HG2 THR 54 5.192 -0.091 3.360 2739 HG22 THR 54 1HG2 THR 54 5.272 0.239 5.131 2740 HG23 THR 54 2HG2 THR 54 5.859 1.468 3.951 2741 H VAL 55 H VAL 55 3.103 4.636 6.463 2742 HA VAL 55 HA VAL 55 1.760 5.974 4.329 2743 HB VAL 55 HB VAL 55 -0.172 4.870 5.194 2744 HG11 VAL 55 1HG1 VAL 55 -0.716 4.746 7.631 2745 HG12 VAL 55 2HG1 VAL 55 0.895 5.455 8.038 2746 HG13 VAL 55 3HG1 VAL 55 0.772 3.852 7.222 2747 HG21 VAL 55 3HG2 VAL 55 -0.034 7.592 6.657 2748 HG22 VAL 55 1HG2 VAL 55 -1.504 6.716 6.091 2749 HG23 VAL 55 2HG2 VAL 55 -0.324 7.349 4.893 2750 H GLY 56 H GLY 56 1.976 8.341 4.949 2751 HA2 GLY 56 2HA GLY 56 3.403 8.849 7.412 2752 HA3 GLY 56 1HA GLY 56 4.178 9.263 5.807 2753 H TYR 57 H TYR 57 1.772 10.272 8.138 2754 HA TYR 57 HA TYR 57 0.088 11.470 6.162 2755 HB2 TYR 57 2HB TYR 57 -0.438 10.867 8.751 2756 HB3 TYR 57 1HB TYR 57 0.077 12.569 9.029 2757 HD1 TYR 57 2HD TYR 57 -1.111 14.173 6.896 2758 HD2 TYR 57 1HD TYR 57 -2.734 10.633 8.737 2759 HE1 TYR 57 2HE TYR 57 -3.321 14.814 6.149 2760 HE2 TYR 57 1HE TYR 57 -4.995 11.335 8.048 2761 HH TYR 57 HH TYR 57 -5.679 13.435 5.632 2762 H GLY 58 H GLY 58 2.845 12.494 8.167 2763 HA2 GLY 58 2HA GLY 58 4.385 13.761 6.833 2764 HA3 GLY 58 1HA GLY 58 3.049 14.892 6.419 2765 H ASP 59 H ASP 59 3.953 13.374 9.584 2766 HA ASP 59 HA ASP 59 3.686 15.829 10.916 2767 HB2 ASP 59 2HB ASP 59 5.317 13.360 11.817 2768 HB3 ASP 59 1HB ASP 59 4.803 14.769 12.840 2769 H ARG 60 H ARG 60 6.578 13.969 9.692 2770 HA ARG 60 HA ARG 60 8.130 16.377 9.897 2771 HB2 ARG 60 2HB ARG 60 9.215 13.747 11.120 2772 HB3 ARG 60 1HB ARG 60 10.138 15.249 10.820 2773 HG2 ARG 60 2HG ARG 60 9.785 15.623 13.012 2774 HG3 ARG 60 1HG ARG 60 8.263 16.351 12.391 2775 HD2 ARG 60 2HD ARG 60 7.144 14.053 12.836 2776 HD3 ARG 60 1HD ARG 60 8.667 13.544 13.678 2777 HE ARG 60 HE ARG 60 8.053 16.003 14.860 2778 HH11 ARG 60 1HH2 ARG 60 5.928 13.104 14.331 2779 HH12 ARG 60 2HH2 ARG 60 4.795 13.657 15.482 2780 HH21 ARG 60 1HH1 ARG 60 6.575 16.546 16.474 2781 HH22 ARG 60 2HH1 ARG 60 5.168 15.567 16.775 2782 H TYR 61 H TYR 61 10.488 15.511 8.745 2783 HA TYR 61 HA TYR 61 9.789 13.716 6.650 2784 HB2 TYR 61 2HB TYR 61 10.859 16.520 5.898 2785 HB3 TYR 61 1HB TYR 61 10.170 15.267 4.806 2786 HD1 TYR 61 2HD TYR 61 7.595 14.842 4.958 2787 HD2 TYR 61 1HD TYR 61 9.522 18.110 6.983 2788 HE1 TYR 61 2HE TYR 61 5.405 15.867 5.384 2789 HE2 TYR 61 1HE TYR 61 7.325 19.149 7.399 2790 HH TYR 61 HH TYR 61 4.456 17.453 7.239 2791 HA PRO 62 HA PRO 62 14.233 13.596 7.751 2792 HB2 PRO 62 2HB PRO 62 15.131 11.663 5.939 2793 HB3 PRO 62 1HB PRO 62 13.978 11.239 7.252 2794 HG2 PRO 62 2HG PRO 62 13.333 11.940 4.327 2795 HG3 PRO 62 1HG PRO 62 12.784 10.489 5.273 2796 HD2 PRO 62 2HD PRO 62 11.257 12.823 5.001 2797 HD3 PRO 62 1HD PRO 62 11.205 11.807 6.518 2798 H VAL 63 H VAL 63 16.483 13.570 6.254 2799 HA VAL 63 HA VAL 63 16.026 15.214 3.888 2800 HB VAL 63 HB VAL 63 18.408 15.999 5.581 2801 HG11 VAL 63 1HG1 VAL 63 16.383 17.635 3.886 2802 HG12 VAL 63 2HG1 VAL 63 17.865 16.926 3.174 2803 HG13 VAL 63 3HG1 VAL 63 17.996 18.166 4.462 2804 HG21 VAL 63 3HG2 VAL 63 17.050 17.695 6.806 2805 HG22 VAL 63 1HG2 VAL 63 16.631 16.032 7.293 2806 HG23 VAL 63 2HG2 VAL 63 15.537 16.944 6.193 2807 H THR 64 H THR 64 18.938 15.551 3.514 2808 HA THR 64 HA THR 64 19.341 13.228 2.028 2809 HB THR 64 HB THR 64 21.548 14.646 1.564 2810 HG1 THR 64 1HG THR 64 21.646 16.475 2.644 2811 HG21 THR 64 3HG2 THR 64 18.694 15.759 1.004 2812 HG22 THR 64 1HG2 THR 64 19.547 14.510 0.035 2813 HG23 THR 64 2HG2 THR 64 20.183 16.189 0.096 2814 H GLU 65 H GLU 65 20.884 14.804 4.763 2815 HA GLU 65 HA GLU 65 23.081 13.022 4.745 2816 HB2 GLU 65 2HB GLU 65 23.043 15.539 5.107 2817 HB3 GLU 65 1HB GLU 65 22.425 15.248 6.765 2818 HG2 GLU 65 2HG GLU 65 24.499 14.085 7.385 2819 HG3 GLU 65 1HG GLU 65 25.065 14.067 5.668 2820 H GLU 66 H GLU 66 20.001 12.966 6.333 2821 HA GLU 66 HA GLU 66 20.846 11.567 8.639 2822 HB2 GLU 66 2HB GLU 66 18.604 11.474 9.265 2823 HB3 GLU 66 1HB GLU 66 18.683 12.946 8.305 2824 HG2 GLU 66 2HG GLU 66 16.706 12.012 7.621 2825 HG3 GLU 66 1HG GLU 66 17.767 11.376 6.304 2826 H GLY 67 H GLY 67 20.374 10.902 5.339 2827 HA2 GLY 67 2HA GLY 67 21.222 9.170 4.185 2828 HA3 GLY 67 1HA GLY 67 21.380 8.208 5.720 2829 H ARG 68 H ARG 68 18.811 10.029 4.160 2830 HA ARG 68 HA ARG 68 16.564 9.459 4.704 2831 HB2 ARG 68 2HB ARG 68 17.367 10.632 2.626 2832 HB3 ARG 68 1HB ARG 68 17.284 9.057 1.763 2833 HG2 ARG 68 2HG ARG 68 14.778 9.002 2.393 2834 HG3 ARG 68 1HG ARG 68 15.004 10.637 3.111 2835 HD2 ARG 68 2HD ARG 68 15.754 11.492 0.844 2836 HD3 ARG 68 1HD ARG 68 15.459 9.848 0.134 2837 HE ARG 68 HE ARG 68 13.576 11.927 0.898 2838 HH11 ARG 68 1HH2 ARG 68 13.791 8.851 -0.761 2839 HH12 ARG 68 2HH2 ARG 68 12.338 8.160 -0.288 2840 HH21 ARG 68 1HH1 ARG 68 11.287 11.083 1.566 2841 HH22 ARG 68 2HH1 ARG 68 10.646 9.851 0.630 2842 H LYS 69 H LYS 69 18.407 6.894 3.431 2843 HA LYS 69 HA LYS 69 16.412 4.952 2.979 2844 HB2 LYS 69 2HB LYS 69 19.380 4.649 3.696 2845 HB3 LYS 69 1HB LYS 69 18.316 3.369 3.004 2846 HG2 LYS 69 2HG LYS 69 18.076 4.681 0.907 2847 HG3 LYS 69 1HG LYS 69 19.149 5.975 1.554 2848 HD2 LYS 69 2HD LYS 69 21.037 4.370 1.743 2849 HD3 LYS 69 1HD LYS 69 19.954 3.026 1.226 2850 HE2 LYS 69 2HE LYS 69 19.622 4.200 -1.012 2851 HE3 LYS 69 1HE LYS 69 20.838 5.437 -0.518 2852 HZ1 LYS 69 3HZ LYS 69 21.382 2.510 -0.624 2853 HZ2 LYS 69 1HZ LYS 69 22.543 3.781 -0.524 2854 HZ3 LYS 69 2HZ LYS 69 21.631 3.557 -1.930 2855 H VAL 70 H VAL 70 17.233 6.551 5.932 2856 HA VAL 70 HA VAL 70 17.052 4.256 7.601 2857 HB VAL 70 HB VAL 70 16.358 7.151 8.300 2858 HG11 VAL 70 1HG1 VAL 70 16.752 6.365 10.641 2859 HG12 VAL 70 2HG1 VAL 70 16.968 4.667 10.056 2860 HG13 VAL 70 3HG1 VAL 70 15.370 5.496 9.897 2861 HG21 VAL 70 3HG2 VAL 70 18.686 7.031 7.522 2862 HG22 VAL 70 1HG2 VAL 70 19.016 5.569 8.537 2863 HG23 VAL 70 2HG2 VAL 70 18.661 7.177 9.293 2864 H ALA 71 H ALA 71 14.784 6.726 6.306 2865 HA ALA 71 HA ALA 71 12.446 5.626 7.384 2866 HB1 ALA 71 1HB ALA 71 12.495 7.907 6.339 2867 HB2 ALA 71 2HB ALA 71 11.224 6.876 5.589 2868 HB3 ALA 71 3HB ALA 71 12.785 7.163 4.725 2869 H GLU 72 H GLU 72 14.167 4.987 4.325 2870 HA GLU 72 HA GLU 72 12.372 3.307 3.072 2871 HB2 GLU 72 2HB GLU 72 14.611 4.040 2.033 2872 HB3 GLU 72 1HB GLU 72 15.411 2.867 3.127 2873 HG2 GLU 72 2HG GLU 72 13.793 1.085 1.896 2874 HG3 GLU 72 1HG GLU 72 13.660 2.371 0.652 2875 H GLN 73 H GLN 73 14.813 2.499 5.570 2876 HA GLN 73 HA GLN 73 14.532 -0.276 5.378 2877 HB2 GLN 73 2HB GLN 73 16.496 0.610 6.495 2878 HB3 GLN 73 1HB GLN 73 15.501 1.494 7.702 2879 HG2 GLN 73 2HG GLN 73 14.863 -0.516 8.856 2880 HG3 GLN 73 1HG GLN 73 15.342 -1.561 7.481 2881 HE21 GLN 73 1HE2 GLN 73 17.230 -2.604 7.721 2882 HE22 GLN 73 2HE2 GLN 73 18.600 -2.115 8.667 2883 H VAL 74 H VAL 74 12.790 2.147 7.425 2884 HA VAL 74 HA VAL 74 11.534 0.126 8.941 2885 HB VAL 74 HB VAL 74 10.246 2.864 8.617 2886 HG11 VAL 74 1HG1 VAL 74 9.189 1.088 10.053 2887 HG12 VAL 74 2HG1 VAL 74 9.796 2.452 11.056 2888 HG13 VAL 74 3HG1 VAL 74 10.720 0.907 10.987 2889 HG21 VAL 74 3HG2 VAL 74 12.575 3.496 8.790 2890 HG22 VAL 74 1HG2 VAL 74 12.913 2.249 10.058 2891 HG23 VAL 74 2HG2 VAL 74 11.862 3.673 10.415 2892 H MET 75 H MET 75 10.539 2.081 6.112 2893 HA MET 75 HA MET 75 7.932 1.130 5.941 2894 HB2 MET 75 2HB MET 75 9.806 2.136 3.715 2895 HB3 MET 75 1HB MET 75 8.031 1.891 3.526 2896 HG2 MET 75 2HG MET 75 7.624 3.491 5.402 2897 HG3 MET 75 1HG MET 75 9.357 3.829 5.531 2898 HE1 MET 75 3HE MET 75 9.994 5.667 1.992 2899 HE2 MET 75 1HE MET 75 10.098 3.894 2.245 2900 HE3 MET 75 2HE MET 75 10.772 5.024 3.478 2901 H LYS 76 H LYS 76 10.945 -0.087 4.377 2902 HA LYS 76 HA LYS 76 9.553 -2.072 2.918 2903 HB2 LYS 76 2HB LYS 76 11.848 -1.014 2.438 2904 HB3 LYS 76 1HB LYS 76 12.527 -2.121 3.673 2905 HG2 LYS 76 2HG LYS 76 11.641 -4.091 2.313 2906 HG3 LYS 76 1HG LYS 76 11.044 -2.940 1.073 2907 HD2 LYS 76 2HD LYS 76 13.973 -3.346 1.954 2908 HD3 LYS 76 1HD LYS 76 13.226 -4.019 0.460 2909 HE2 LYS 76 2HE LYS 76 12.846 -1.693 -0.431 2910 HE3 LYS 76 1HE LYS 76 13.522 -0.993 1.089 2911 HZ1 LYS 76 3HZ LYS 76 14.990 -2.478 -1.014 2912 HZ2 LYS 76 1HZ LYS 76 15.610 -2.234 0.555 2913 HZ3 LYS 76 2HZ LYS 76 15.197 -0.892 -0.363 2914 H ALA 77 H ALA 77 11.038 -2.012 6.161 2915 HA ALA 77 HA ALA 77 11.012 -4.812 6.565 2916 HB1 ALA 77 1HB ALA 77 12.344 -3.283 8.041 2917 HB2 ALA 77 2HB ALA 77 11.181 -4.263 9.005 2918 HB3 ALA 77 3HB ALA 77 10.817 -2.533 8.636 2919 H GLY 78 H GLY 78 8.619 -2.200 7.065 2920 HA2 GLY 78 2HA GLY 78 6.735 -3.724 8.475 2921 HA3 GLY 78 1HA GLY 78 6.455 -2.238 7.490 2922 H ILE 79 H ILE 79 7.134 -3.102 4.970 2923 HA ILE 79 HA ILE 79 4.854 -4.400 4.105 2924 HB ILE 79 HB ILE 79 7.578 -4.146 2.733 2925 HG12 ILE 79 2HG1 ILE 79 4.962 -2.531 2.393 2926 HG13 ILE 79 1HG1 ILE 79 6.348 -2.000 3.376 2927 HG21 ILE 79 1HG2 ILE 79 4.835 -4.946 1.526 2928 HG22 ILE 79 2HG2 ILE 79 6.285 -6.010 1.649 2929 HG23 ILE 79 3HG2 ILE 79 6.323 -4.585 0.577 2930 HD11 ILE 79 3HD ILE 79 6.361 -2.434 0.318 2931 HD12 ILE 79 1HD ILE 79 6.457 -0.878 1.210 2932 HD13 ILE 79 2HD ILE 79 7.824 -2.049 1.304 2933 H GLU 80 H GLU 80 8.149 -5.740 4.606 2934 HA GLU 80 HA GLU 80 7.737 -8.333 3.782 2935 HB2 GLU 80 2HB GLU 80 9.446 -7.111 6.019 2936 HB3 GLU 80 1HB GLU 80 9.529 -8.859 5.684 2937 HG2 GLU 80 2HG GLU 80 10.014 -6.868 3.387 2938 HG3 GLU 80 1HG GLU 80 11.294 -7.223 4.612 2939 H VAL 81 H VAL 81 7.121 -6.894 7.009 2940 HA VAL 81 HA VAL 81 6.519 -9.307 8.308 2941 HB VAL 81 HB VAL 81 5.899 -6.375 8.905 2942 HG11 VAL 81 1HG1 VAL 81 5.264 -7.157 11.247 2943 HG12 VAL 81 2HG1 VAL 81 5.203 -8.844 10.634 2944 HG13 VAL 81 3HG1 VAL 81 4.061 -7.602 10.002 2945 HG21 VAL 81 3HG2 VAL 81 7.675 -6.711 10.629 2946 HG22 VAL 81 1HG2 VAL 81 8.306 -7.187 9.015 2947 HG23 VAL 81 2HG2 VAL 81 7.809 -8.452 10.194 2948 H PHE 82 H PHE 82 4.316 -6.726 7.007 2949 HA PHE 82 HA PHE 82 2.030 -8.229 7.715 2950 HB2 PHE 82 2HB PHE 82 2.315 -5.950 5.648 2951 HB3 PHE 82 1HB PHE 82 0.740 -6.606 6.245 2952 HD1 PHE 82 1HD PHE 82 0.824 -6.845 9.051 2953 HD2 PHE 82 2HD PHE 82 2.815 -3.894 6.626 2954 HE1 PHE 82 1HE PHE 82 0.863 -5.289 10.966 2955 HE2 PHE 82 2HE PHE 82 2.835 -2.343 8.536 2956 HZ PHE 82 HZ PHE 82 1.855 -3.024 10.711 2957 H ALA 83 H ALA 83 3.981 -8.061 4.735 2958 HA ALA 83 HA ALA 83 2.155 -9.459 3.131 2959 HB1 ALA 83 1HB ALA 83 4.047 -9.806 1.573 2960 HB2 ALA 83 2HB ALA 83 5.224 -9.366 2.873 2961 HB3 ALA 83 3HB ALA 83 4.095 -8.134 2.210 2962 H LEU 84 H LEU 84 4.705 -10.557 5.409 2963 HA LEU 84 HA LEU 84 4.757 -13.233 4.607 2964 HB2 LEU 84 2HB LEU 84 6.439 -12.122 6.066 2965 HB3 LEU 84 1HB LEU 84 5.265 -12.047 7.407 2966 HG LEU 84 HG LEU 84 5.909 -14.759 6.159 2967 HD11 LEU 84 1HD1 LEU 84 8.141 -13.704 6.344 2968 HD12 LEU 84 2HD1 LEU 84 7.952 -15.016 7.559 2969 HD13 LEU 84 3HD1 LEU 84 7.833 -13.290 8.073 2970 HD21 LEU 84 3HD2 LEU 84 5.744 -15.554 8.539 2971 HD22 LEU 84 1HD2 LEU 84 4.248 -14.701 8.035 2972 HD23 LEU 84 2HD2 LEU 84 5.446 -13.866 9.091 2973 H VAL 85 H VAL 85 2.596 -11.447 6.762 2974 HA VAL 85 HA VAL 85 1.298 -13.658 7.899 2975 HB VAL 85 HB VAL 85 0.389 -10.760 7.540 2976 HG11 VAL 85 1HG1 VAL 85 -1.621 -12.051 8.077 2977 HG12 VAL 85 2HG1 VAL 85 -1.072 -11.249 9.583 2978 HG13 VAL 85 3HG1 VAL 85 -0.754 -13.008 9.330 2979 HG21 VAL 85 3HG2 VAL 85 1.223 -10.529 9.907 2980 HG22 VAL 85 1HG2 VAL 85 2.550 -11.023 8.816 2981 HG23 VAL 85 2HG2 VAL 85 1.783 -12.238 9.883 2982 H THR 86 H THR 86 1.174 -12.517 4.628 2983 HA THR 86 HA THR 86 -1.457 -13.099 3.979 2984 HB THR 86 HB THR 86 0.951 -13.585 2.167 2985 HG1 THR 86 1HG THR 86 1.168 -11.581 2.755 2986 HG21 THR 86 3HG2 THR 86 -0.704 -12.908 0.376 2987 HG22 THR 86 1HG2 THR 86 -2.016 -12.837 1.612 2988 HG23 THR 86 2HG2 THR 86 -1.231 -14.415 1.208 2989 H ALA 87 H ALA 87 1.129 -15.256 4.927 2990 HA ALA 87 HA ALA 87 0.127 -17.632 3.806 2991 HB1 ALA 87 1HB ALA 87 1.674 -17.214 6.442 2992 HB2 ALA 87 2HB ALA 87 2.412 -17.445 4.820 2993 HB3 ALA 87 3HB ALA 87 1.475 -18.787 5.572 2994 H ALA 88 H ALA 88 -1.000 -15.679 6.541 2995 HA ALA 88 HA ALA 88 -2.565 -17.840 7.654 2996 HB1 ALA 88 1HB ALA 88 -3.604 -16.069 9.096 2997 HB2 ALA 88 2HB ALA 88 -2.720 -14.797 8.177 2998 HB3 ALA 88 3HB ALA 88 -1.814 -15.974 9.192 2999 H LEU 89 H LEU 89 -3.030 -14.892 5.684 3000 HA LEU 89 HA LEU 89 -5.787 -15.181 5.466 3001 HB2 LEU 89 2HB LEU 89 -3.803 -13.687 3.647 3002 HB3 LEU 89 1HB LEU 89 -5.576 -13.656 3.412 3003 HG LEU 89 HG LEU 89 -4.971 -11.642 4.462 3004 HD11 LEU 89 1HD1 LEU 89 -7.130 -12.717 5.153 3005 HD12 LEU 89 2HD1 LEU 89 -6.466 -11.611 6.407 3006 HD13 LEU 89 3HD1 LEU 89 -6.331 -13.391 6.616 3007 HD21 LEU 89 3HD2 LEU 89 -2.815 -12.243 5.557 3008 HD22 LEU 89 1HD2 LEU 89 -3.711 -13.133 6.849 3009 HD23 LEU 89 2HD2 LEU 89 -3.922 -11.360 6.659 3010 H ALA 90 H ALA 90 -3.190 -16.532 3.464 3011 HA ALA 90 HA ALA 90 -4.917 -17.339 1.378 3012 HB1 ALA 90 1HB ALA 90 -2.198 -18.477 2.240 3013 HB2 ALA 90 2HB ALA 90 -2.453 -17.136 1.068 3014 HB3 ALA 90 3HB ALA 90 -3.019 -18.794 0.658 3015 H THR 91 H THR 91 -4.659 -18.574 4.633 3016 HA THR 91 HA THR 91 -5.552 -21.211 3.767 3017 HB THR 91 HB THR 91 -5.835 -21.836 6.061 3018 HG1 THR 91 1HG THR 91 -5.072 -19.138 6.618 3019 HG21 THR 91 3HG2 THR 91 -3.104 -20.480 5.539 3020 HG22 THR 91 1HG2 THR 91 -3.643 -22.040 4.821 3021 HG23 THR 91 2HG2 THR 91 -3.427 -21.904 6.596 3022 H ASP 92 H ASP 92 -6.944 -18.051 4.366 3023 HA ASP 92 HA ASP 92 -9.274 -18.988 5.586 3024 HB2 ASP 92 2HB ASP 92 -8.711 -16.325 4.181 3025 HB3 ASP 92 1HB ASP 92 -10.309 -16.739 4.914 3026 H PHE 93 H PHE 93 -8.447 -18.656 2.153 3027 HA PHE 93 HA PHE 93 -11.167 -19.245 1.416 3028 HB2 PHE 93 2HB PHE 93 -10.633 -19.135 -0.819 3029 HB3 PHE 93 1HB PHE 93 -9.509 -17.946 -0.099 3030 HD1 PHE 93 1HD PHE 93 -7.068 -18.887 0.435 3031 HD2 PHE 93 2HD PHE 93 -9.821 -20.661 -2.343 3032 HE1 PHE 93 1HE PHE 93 -5.191 -20.029 -0.694 3033 HE2 PHE 93 2HE PHE 93 -7.934 -21.836 -3.447 3034 HZ PHE 93 HZ PHE 93 -5.621 -21.507 -2.638 3035 H VAL 94 H VAL 94 -8.523 -21.158 2.562 3036 HA VAL 94 HA VAL 94 -9.217 -23.519 1.055 3037 HB VAL 94 HB VAL 94 -7.273 -23.177 3.388 3038 HG11 VAL 94 1HG1 VAL 94 -7.623 -25.437 1.292 3039 HG12 VAL 94 2HG1 VAL 94 -7.966 -25.567 3.060 3040 HG13 VAL 94 3HG1 VAL 94 -6.282 -25.314 2.488 3041 HG21 VAL 94 3HG2 VAL 94 -6.696 -21.724 1.404 3042 HG22 VAL 94 1HG2 VAL 94 -6.836 -23.143 0.314 3043 HG23 VAL 94 2HG2 VAL 94 -5.546 -23.078 1.568 3044 H ARG 95 H ARG 95 -9.843 -21.995 4.184 3045 HA ARG 95 HA ARG 95 -10.886 -24.118 5.588 3046 HB2 ARG 95 2HB ARG 95 -12.001 -21.248 5.693 3047 HB3 ARG 95 1HB ARG 95 -12.205 -22.523 6.938 3048 HG2 ARG 95 2HG ARG 95 -9.645 -22.441 7.303 3049 HG3 ARG 95 1HG ARG 95 -9.633 -21.055 6.164 3050 HD2 ARG 95 2HD ARG 95 -11.400 -19.958 7.811 3051 HD3 ARG 95 1HD ARG 95 -10.819 -21.170 9.014 3052 HE ARG 95 HE ARG 95 -9.314 -18.858 7.753 3053 HH11 ARG 95 1HH2 ARG 95 -9.570 -20.843 10.717 3054 HH12 ARG 95 2HH2 ARG 95 -7.977 -20.525 11.192 3055 HH21 ARG 95 1HH1 ARG 95 -7.337 -18.179 8.639 3056 HH22 ARG 95 2HH1 ARG 95 -6.717 -18.834 10.117 3057 H ARG 96 H ARG 96 -12.256 -22.473 2.811 3058 HA ARG 96 HA ARG 96 -14.935 -22.871 3.266 3059 HB2 ARG 96 2HB ARG 96 -15.394 -22.361 1.038 3060 HB3 ARG 96 1HB ARG 96 -13.882 -21.470 1.412 3061 HG2 ARG 96 2HG ARG 96 -12.637 -23.526 0.350 3062 HG3 ARG 96 1HG ARG 96 -14.256 -24.047 -0.234 3063 HD2 ARG 96 2HD ARG 96 -14.503 -21.812 -1.409 3064 HD3 ARG 96 1HD ARG 96 -12.788 -21.410 -1.006 3065 HE ARG 96 HE ARG 96 -13.752 -23.173 -3.101 3066 HH11 ARG 96 1HH2 ARG 96 -10.926 -22.635 -0.904 3067 HH12 ARG 96 2HH2 ARG 96 -9.881 -23.652 -1.806 3068 HH21 ARG 96 1HH1 ARG 96 -12.424 -24.992 -3.879 3069 HH22 ARG 96 2HH1 ARG 96 -10.743 -24.961 -3.660 3070 H GLU 97 H GLU 97 -12.494 -25.265 2.393 3071 HA GLU 97 HA GLU 97 -14.475 -27.041 1.338 3072 HB2 GLU 97 2HB GLU 97 -11.852 -27.059 0.840 3073 HB3 GLU 97 1HB GLU 97 -11.852 -28.217 2.221 3074 HG2 GLU 97 2HG GLU 97 -13.791 -29.427 1.040 3075 HG3 GLU 97 1HG GLU 97 -13.548 -28.305 -0.371 3076 H GLU 98 H GLU 98 -13.390 -26.161 4.554 3077 HA GLU 98 HA GLU 98 -14.528 -28.600 5.676 3078 HB2 GLU 98 2HB GLU 98 -13.366 -26.199 7.184 3079 HB3 GLU 98 1HB GLU 98 -13.916 -27.772 7.852 3080 HG2 GLU 98 2HG GLU 98 -12.107 -28.763 6.084 3081 HG3 GLU 98 1HG GLU 98 -11.394 -27.116 6.243 3082 H GLU 99 H GLU 99 -15.314 -25.201 5.000 3083 HA GLU 99 HA GLU 99 -17.507 -24.961 6.701 3084 HB2 GLU 99 2HB GLU 99 -17.026 -23.682 3.949 3085 HB3 GLU 99 1HB GLU 99 -18.332 -23.194 5.071 3086 HG2 GLU 99 2HG GLU 99 -16.726 -22.466 6.779 3087 HG3 GLU 99 1HG GLU 99 -15.328 -23.018 5.794 3088 H ARG 100 H ARG 100 -17.273 -26.161 3.333 3089 HA ARG 100 HA ARG 100 -20.031 -26.636 3.097 3090 HB2 ARG 100 2HB ARG 100 -19.564 -27.851 1.051 3091 HB3 ARG 100 1HB ARG 100 -18.543 -26.388 1.116 3092 HG2 ARG 100 2HG ARG 100 -16.576 -27.762 1.728 3093 HG3 ARG 100 1HG ARG 100 -17.588 -29.246 1.819 3094 HD2 ARG 100 2HD ARG 100 -18.163 -28.961 -0.668 3095 HD3 ARG 100 1HD ARG 100 -17.000 -27.589 -0.721 3096 HE ARG 100 HE ARG 100 -15.188 -29.065 -0.441 3097 HH11 ARG 100 1HH2 ARG 100 -18.266 -30.995 -0.328 3098 HH12 ARG 100 2HH2 ARG 100 -17.513 -32.447 -0.784 3099 HH21 ARG 100 1HH1 ARG 100 -14.138 -31.128 -0.978 3100 HH22 ARG 100 2HH1 ARG 100 -15.120 -32.481 -1.331 3101 H ARG 101 H ARG 101 -17.603 -28.429 4.797 3102 HA ARG 101 HA ARG 101 -18.937 -30.982 4.655 3103 HB2 ARG 101 2HB ARG 101 -16.829 -29.883 6.638 3104 HB3 ARG 101 1HB ARG 101 -17.487 -31.542 6.724 3105 HG2 ARG 101 2HG ARG 101 -16.085 -30.487 4.215 3106 HG3 ARG 101 1HG ARG 101 -15.182 -31.212 5.597 3107 HD2 ARG 101 2HD ARG 101 -16.323 -33.368 5.355 3108 HD3 ARG 101 1HD ARG 101 -17.508 -32.650 4.181 3109 HE ARG 101 HE ARG 101 -14.664 -32.445 3.354 3110 HH11 ARG 101 1HH2 ARG 101 -17.595 -34.516 3.371 3111 HH12 ARG 101 2HH2 ARG 101 -17.365 -35.215 1.854 3112 HH21 ARG 101 1HH1 ARG 101 -14.116 -33.587 1.335 3113 HH22 ARG 101 2HH1 ARG 101 -15.165 -34.828 0.748 3114 H GLY 102 H GLY 102 -18.706 -28.202 6.905 3115 HA2 GLY 102 2HA GLY 102 -20.320 -27.504 8.355 3116 HA3 GLY 102 1HA GLY 102 -21.235 -29.046 8.130 3117 H HIS 103 H HIS 103 -17.772 -28.442 8.865 3118 HA HIS 103 HA HIS 103 -17.939 -30.426 10.985 3119 HB2 HIS 103 2HB HIS 103 -15.935 -30.322 9.383 3120 HB3 HIS 103 1HB HIS 103 -15.507 -28.743 10.113 3121 HD1 HIS 103 1HD HIS 103 -15.735 -32.453 10.879 3122 HD2 HIS 103 2HD HIS 103 -14.349 -28.935 12.749 3123 HE1 HIS 103 1HE HIS 103 -14.369 -33.156 12.909 3124 HE2 HIS 103 2HE HIS 103 -13.656 -30.991 14.085 Start of MODEL 16 1 H1 SER 1 H SER 1 -22.330 -13.908 -2.729 2 HA SER 1 HA SER 1 -24.563 -15.697 -3.153 3 HB2 SER 1 2HB SER 1 -24.090 -14.379 -5.284 4 HB3 SER 1 1HB SER 1 -22.429 -15.057 -5.313 5 HG SER 1 1HG SER 1 -24.287 -16.070 -6.554 6 H ALA 2 H ALA 2 -20.905 -15.470 -3.736 7 HA ALA 2 HA ALA 2 -20.702 -18.121 -2.596 8 HB1 ALA 2 1HB ALA 2 -18.330 -18.053 -3.035 9 HB2 ALA 2 2HB ALA 2 -18.382 -16.281 -3.352 10 HB3 ALA 2 3HB ALA 2 -19.181 -17.424 -4.486 11 H ASP 3 H ASP 3 -19.129 -18.547 -0.824 12 HA ASP 3 HA ASP 3 -19.946 -17.148 1.462 13 HB2 ASP 3 2HB ASP 3 -18.276 -18.678 2.647 14 HB3 ASP 3 1HB ASP 3 -19.515 -19.535 1.682 15 H HIS 4 H HIS 4 -16.946 -17.281 -0.448 16 HA HIS 4 HA HIS 4 -15.499 -15.627 1.350 17 HB2 HIS 4 2HB HIS 4 -14.949 -16.037 -1.652 18 HB3 HIS 4 1HB HIS 4 -13.838 -15.248 -0.465 19 HD1 HIS 4 1HD HIS 4 -12.539 -17.695 -1.726 20 HD2 HIS 4 2HD HIS 4 -15.227 -18.041 1.529 21 HE1 HIS 4 1HE HIS 4 -12.158 -19.922 -0.628 22 HE2 HIS 4 2HE HIS 4 -13.934 -20.084 1.250 23 H GLU 5 H GLU 5 -17.698 -14.860 -1.302 24 HA GLU 5 HA GLU 5 -16.837 -12.153 -1.605 25 HB2 GLU 5 2HB GLU 5 -19.413 -13.659 -2.389 26 HB3 GLU 5 1HB GLU 5 -19.010 -12.004 -2.949 27 HG2 GLU 5 2HG GLU 5 -17.181 -12.756 -4.310 28 HG3 GLU 5 1HG GLU 5 -17.082 -14.351 -3.492 29 H ARG 6 H ARG 6 -19.456 -13.949 0.072 30 HA ARG 6 HA ARG 6 -20.723 -11.688 1.103 31 HB2 ARG 6 2HB ARG 6 -21.767 -13.937 0.821 32 HB3 ARG 6 1HB ARG 6 -20.682 -14.610 2.074 33 HG2 ARG 6 2HG ARG 6 -23.026 -14.253 2.806 34 HG3 ARG 6 1HG ARG 6 -21.815 -13.459 3.835 35 HD2 ARG 6 2HD ARG 6 -22.890 -11.609 1.692 36 HD3 ARG 6 1HD ARG 6 -24.191 -12.297 2.750 37 HE ARG 6 HE ARG 6 -22.363 -11.606 4.638 38 HH11 ARG 6 1HH2 ARG 6 -23.903 -9.627 2.020 39 HH12 ARG 6 2HH2 ARG 6 -23.502 -8.138 2.766 40 HH21 ARG 6 1HH1 ARG 6 -22.061 -9.635 5.685 41 HH22 ARG 6 2HH1 ARG 6 -22.520 -8.125 5.007 42 H GLU 7 H GLU 7 -18.222 -13.873 2.539 43 HA GLU 7 HA GLU 7 -18.132 -12.556 4.990 44 HB2 GLU 7 2HB GLU 7 -17.005 -14.857 4.009 45 HB3 GLU 7 1HB GLU 7 -15.577 -13.796 3.899 46 HG2 GLU 7 2HG GLU 7 -15.489 -14.959 6.026 47 HG3 GLU 7 1HG GLU 7 -15.941 -13.259 6.420 48 H ALA 8 H ALA 8 -16.428 -11.953 1.906 49 HA ALA 8 HA ALA 8 -14.629 -10.050 2.930 50 HB1 ALA 8 1HB ALA 8 -15.800 -10.380 0.079 51 HB2 ALA 8 2HB ALA 8 -14.259 -11.095 0.675 52 HB3 ALA 8 3HB ALA 8 -14.414 -9.312 0.488 53 H GLN 9 H GLN 9 -17.871 -9.820 1.429 54 HA GLN 9 HA GLN 9 -17.860 -7.030 1.379 55 HB2 GLN 9 2HB GLN 9 -19.325 -8.666 0.000 56 HB3 GLN 9 1HB GLN 9 -20.370 -8.815 1.448 57 HG2 GLN 9 2HG GLN 9 -21.262 -7.182 -0.251 58 HG3 GLN 9 1HG GLN 9 -20.885 -6.352 1.301 59 HE21 GLN 9 1HE2 GLN 9 -19.733 -4.461 1.024 60 HE22 GLN 9 2HE2 GLN 9 -18.517 -4.148 -0.152 61 H LYS 10 H LYS 10 -18.826 -9.369 3.817 62 HA LYS 10 HA LYS 10 -20.153 -7.742 5.632 63 HB2 LYS 10 2HB LYS 10 -19.859 -10.302 5.741 64 HB3 LYS 10 1HB LYS 10 -18.149 -10.025 6.173 65 HG2 LYS 10 2HG LYS 10 -19.000 -8.711 8.234 66 HG3 LYS 10 1HG LYS 10 -20.622 -9.380 7.843 67 HD2 LYS 10 2HD LYS 10 -19.764 -11.691 8.156 68 HD3 LYS 10 1HD LYS 10 -18.077 -11.102 8.215 69 HE2 LYS 10 2HE LYS 10 -18.902 -11.664 10.503 70 HE3 LYS 10 1HE LYS 10 -18.474 -9.911 10.361 71 HZ1 LYS 10 3HZ LYS 10 -20.822 -9.394 10.111 72 HZ2 LYS 10 1HZ LYS 10 -20.559 -10.323 11.515 73 HZ3 LYS 10 2HZ LYS 10 -21.211 -11.070 10.153 74 H ALA 11 H ALA 11 -16.661 -8.273 5.062 75 HA ALA 11 HA ALA 11 -15.810 -6.940 7.391 76 HB1 ALA 11 1HB ALA 11 -14.253 -7.375 4.767 77 HB2 ALA 11 2HB ALA 11 -14.356 -8.560 6.121 78 HB3 ALA 11 3HB ALA 11 -13.550 -6.972 6.378 79 H GLU 12 H GLU 12 -16.561 -5.818 4.071 80 HA GLU 12 HA GLU 12 -15.433 -3.258 4.356 81 HB2 GLU 12 2HB GLU 12 -17.864 -4.087 2.650 82 HB3 GLU 12 1HB GLU 12 -17.150 -2.446 2.685 83 HG2 GLU 12 2HG GLU 12 -14.867 -3.816 2.109 84 HG3 GLU 12 1HG GLU 12 -16.056 -4.959 1.377 85 H GLU 13 H GLU 13 -18.555 -4.594 5.435 86 HA GLU 13 HA GLU 13 -19.878 -2.181 5.973 87 HB2 GLU 13 2HB GLU 13 -20.045 -4.831 7.525 88 HB3 GLU 13 1HB GLU 13 -21.265 -3.526 7.580 89 HG2 GLU 13 2HG GLU 13 -21.985 -3.954 5.302 90 HG3 GLU 13 1HG GLU 13 -20.567 -5.011 4.966 91 H GLU 14 H GLU 14 -17.720 -4.262 7.950 92 HA GLU 14 HA GLU 14 -17.998 -2.709 10.287 93 HB2 GLU 14 2HB GLU 14 -17.277 -4.983 10.597 94 HB3 GLU 14 1HB GLU 14 -15.850 -4.761 9.530 95 HG2 GLU 14 2HG GLU 14 -14.576 -3.697 11.149 96 HG3 GLU 14 1HG GLU 14 -15.980 -2.878 11.891 97 H LEU 15 H LEU 15 -15.764 -2.522 7.518 98 HA LEU 15 HA LEU 15 -13.949 -0.816 8.717 99 HB2 LEU 15 2HB LEU 15 -13.596 -1.991 6.532 100 HB3 LEU 15 1HB LEU 15 -14.753 -0.871 5.748 101 HG LEU 15 HG LEU 15 -13.255 1.036 6.114 102 HD11 LEU 15 1HD1 LEU 15 -12.287 0.643 8.305 103 HD12 LEU 15 2HD1 LEU 15 -10.929 0.674 7.139 104 HD13 LEU 15 3HD1 LEU 15 -11.528 -0.903 7.773 105 HD21 LEU 15 3HD2 LEU 15 -11.300 0.359 4.731 106 HD22 LEU 15 1HD2 LEU 15 -12.811 -0.407 4.112 107 HD23 LEU 15 2HD2 LEU 15 -11.628 -1.377 5.066 108 H GLN 16 H GLN 16 -17.086 -0.142 7.250 109 HA GLN 16 HA GLN 16 -16.728 2.689 7.193 110 HB2 GLN 16 2HB GLN 16 -19.209 0.915 6.993 111 HB3 GLN 16 1HB GLN 16 -19.221 2.693 6.710 112 HG2 GLN 16 2HG GLN 16 -17.826 2.543 4.759 113 HG3 GLN 16 1HG GLN 16 -17.274 0.878 5.130 114 HE21 GLN 16 1HE2 GLN 16 -18.511 -0.881 4.458 115 HE22 GLN 16 2HE2 GLN 16 -20.013 -0.758 3.591 116 H LYS 17 H LYS 17 -18.054 0.354 9.527 117 HA LYS 17 HA LYS 17 -19.309 2.156 11.253 118 HB2 LYS 17 2HB LYS 17 -19.637 -0.296 11.418 119 HB3 LYS 17 1HB LYS 17 -17.894 -0.511 11.767 120 HG2 LYS 17 2HG LYS 17 -18.247 0.761 13.985 121 HG3 LYS 17 1HG LYS 17 -19.997 0.794 13.595 122 HD2 LYS 17 2HD LYS 17 -19.540 -1.034 15.153 123 HD3 LYS 17 1HD LYS 17 -19.995 -1.721 13.550 124 HE2 LYS 17 2HE LYS 17 -17.510 -2.087 13.067 125 HE3 LYS 17 1HE LYS 17 -17.119 -1.528 14.738 126 HZ1 LYS 17 3HZ LYS 17 -17.929 -3.476 15.611 127 HZ2 LYS 17 1HZ LYS 17 -17.502 -4.054 14.062 128 HZ3 LYS 17 2HZ LYS 17 -19.112 -3.665 14.412 129 H VAL 18 H VAL 18 -15.888 0.957 11.184 130 HA VAL 18 HA VAL 18 -15.292 2.314 13.600 131 HB VAL 18 HB VAL 18 -12.934 1.792 13.180 132 HG11 VAL 18 1HG1 VAL 18 -14.529 0.213 14.332 133 HG12 VAL 18 2HG1 VAL 18 -13.261 -0.672 13.407 134 HG13 VAL 18 3HG1 VAL 18 -14.926 -0.549 12.742 135 HG21 VAL 18 3HG2 VAL 18 -12.978 1.951 10.630 136 HG22 VAL 18 1HG2 VAL 18 -13.972 0.449 10.588 137 HG23 VAL 18 2HG2 VAL 18 -12.296 0.400 11.225 138 H LEU 19 H LEU 19 -15.502 3.451 10.286 139 HA LEU 19 HA LEU 19 -13.772 5.668 10.521 140 HB2 LEU 19 2HB LEU 19 -16.457 5.587 8.983 141 HB3 LEU 19 1HB LEU 19 -15.163 6.806 8.777 142 HG LEU 19 HG LEU 19 -14.978 3.828 8.086 143 HD11 LEU 19 1HD1 LEU 19 -15.031 4.571 5.719 144 HD12 LEU 19 2HD1 LEU 19 -15.215 6.287 6.240 145 HD13 LEU 19 3HD1 LEU 19 -16.520 5.084 6.594 146 HD21 LEU 19 3HD2 LEU 19 -12.860 4.406 6.917 147 HD22 LEU 19 1HD2 LEU 19 -12.723 4.681 8.686 148 HD23 LEU 19 2HD2 LEU 19 -12.940 6.082 7.566 149 H GLU 20 H GLU 20 -17.188 5.088 11.325 150 HA GLU 20 HA GLU 20 -17.804 7.779 11.916 151 HB2 GLU 20 2HB GLU 20 -19.236 5.234 12.892 152 HB3 GLU 20 1HB GLU 20 -19.933 6.882 12.766 153 HG2 GLU 20 2HG GLU 20 -19.029 5.088 10.398 154 HG3 GLU 20 1HG GLU 20 -20.709 5.299 10.977 155 H GLU 21 H GLU 21 -16.504 5.057 13.773 156 HA GLU 21 HA GLU 21 -16.883 6.427 16.304 157 HB2 GLU 21 2HB GLU 21 -14.972 4.087 15.650 158 HB3 GLU 21 1HB GLU 21 -15.339 4.789 17.263 159 HG2 GLU 21 2HG GLU 21 -17.845 4.201 16.712 160 HG3 GLU 21 1HG GLU 21 -17.176 3.104 15.450 161 H ALA 22 H ALA 22 -14.313 5.880 13.880 162 HA ALA 22 HA ALA 22 -12.218 6.994 15.270 163 HB1 ALA 22 1HB ALA 22 -12.665 6.924 12.222 164 HB2 ALA 22 2HB ALA 22 -11.852 5.651 13.199 165 HB3 ALA 22 3HB ALA 22 -11.097 7.275 13.029 166 H SER 23 H SER 23 -14.836 8.633 13.458 167 HA SER 23 HA SER 23 -13.430 11.049 13.080 168 HB2 SER 23 2HB SER 23 -15.823 12.001 12.842 169 HB3 SER 23 1HB SER 23 -15.426 10.594 11.776 170 HG SER 23 1HG SER 23 -17.467 10.410 12.839 171 H LYS 24 H LYS 24 -15.750 9.936 15.493 172 HA LYS 24 HA LYS 24 -15.704 12.154 17.188 173 HB2 LYS 24 2HB LYS 24 -17.522 10.558 17.224 174 HB3 LYS 24 1HB LYS 24 -16.433 9.196 17.606 175 HG2 LYS 24 2HG LYS 24 -16.675 11.507 19.614 176 HG3 LYS 24 1HG LYS 24 -18.031 10.347 19.406 177 HD2 LYS 24 2HD LYS 24 -16.414 8.424 19.731 178 HD3 LYS 24 1HD LYS 24 -15.162 9.598 20.259 179 HE2 LYS 24 2HE LYS 24 -17.958 9.241 21.574 180 HE3 LYS 24 1HE LYS 24 -16.438 8.444 22.139 181 HZ1 LYS 24 3HZ LYS 24 -16.933 11.403 22.077 182 HZ2 LYS 24 1HZ LYS 24 -15.479 10.616 22.546 183 HZ3 LYS 24 2HZ LYS 24 -16.893 10.347 23.413 184 H LYS 25 H LYS 25 -13.870 9.068 17.251 185 HA LYS 25 HA LYS 25 -12.497 9.729 19.626 186 HB2 LYS 25 2HB LYS 25 -11.865 7.681 17.440 187 HB3 LYS 25 1HB LYS 25 -10.953 7.812 18.988 188 HG2 LYS 25 2HG LYS 25 -12.948 7.346 20.314 189 HG3 LYS 25 1HG LYS 25 -14.003 7.368 18.867 190 HD2 LYS 25 2HD LYS 25 -12.922 5.329 17.976 191 HD3 LYS 25 1HD LYS 25 -11.775 5.301 19.375 192 HE2 LYS 25 2HE LYS 25 -13.658 5.026 20.973 193 HE3 LYS 25 1HE LYS 25 -14.863 5.136 19.633 194 HZ1 LYS 25 3HZ LYS 25 -14.281 3.042 18.837 195 HZ2 LYS 25 1HZ LYS 25 -14.325 2.900 20.498 196 HZ3 LYS 25 2HZ LYS 25 -12.812 2.953 19.748 197 H ALA 26 H ALA 26 -11.728 10.403 16.162 198 HA ALA 26 HA ALA 26 -9.060 11.124 16.719 199 HB1 ALA 26 1HB ALA 26 -10.840 12.057 14.383 200 HB2 ALA 26 2HB ALA 26 -9.819 10.575 14.398 201 HB3 ALA 26 3HB ALA 26 -9.039 12.188 14.492 202 H VAL 27 H VAL 27 -12.104 13.072 16.341 203 HA VAL 27 HA VAL 27 -10.739 15.496 16.756 204 HB VAL 27 HB VAL 27 -12.905 15.344 15.609 205 HG11 VAL 27 1HG1 VAL 27 -15.033 15.251 16.896 206 HG12 VAL 27 2HG1 VAL 27 -14.147 14.932 18.420 207 HG13 VAL 27 3HG1 VAL 27 -14.108 13.724 17.089 208 HG21 VAL 27 3HG2 VAL 27 -12.883 17.231 18.055 209 HG22 VAL 27 1HG2 VAL 27 -13.776 17.469 16.503 210 HG23 VAL 27 2HG2 VAL 27 -11.975 17.451 16.515 211 H GLU 28 H GLU 28 -12.347 13.200 18.986 212 HA GLU 28 HA GLU 28 -12.082 14.846 21.263 213 HB2 GLU 28 2HB GLU 28 -13.719 12.968 21.085 214 HB3 GLU 28 1HB GLU 28 -12.370 11.790 21.045 215 HG2 GLU 28 2HG GLU 28 -11.759 12.327 23.385 216 HG3 GLU 28 1HG GLU 28 -12.953 13.679 23.429 217 H ALA 29 H ALA 29 -9.968 12.447 19.671 218 HA ALA 29 HA ALA 29 -8.212 11.968 21.728 219 HB1 ALA 29 1HB ALA 29 -7.619 12.107 18.699 220 HB2 ALA 29 2HB ALA 29 -8.089 10.642 19.633 221 HB3 ALA 29 3HB ALA 29 -6.511 11.409 19.930 222 H GLU 30 H GLU 30 -8.149 14.568 19.233 223 HA GLU 30 HA GLU 30 -5.657 15.515 20.333 224 HB2 GLU 30 2HB GLU 30 -5.893 17.335 18.667 225 HB3 GLU 30 1HB GLU 30 -5.872 15.700 17.951 226 HG2 GLU 30 2HG GLU 30 -8.237 15.708 17.452 227 HG3 GLU 30 1HG GLU 30 -8.523 17.172 18.473 228 H ARG 31 H ARG 31 -8.957 15.964 21.130 229 HA ARG 31 HA ARG 31 -8.712 18.660 22.051 230 HB2 ARG 31 2HB ARG 31 -10.788 16.464 22.310 231 HB3 ARG 31 1HB ARG 31 -10.928 17.876 23.370 232 HG2 ARG 31 2HG ARG 31 -10.677 18.123 20.304 233 HG3 ARG 31 1HG ARG 31 -12.247 17.915 21.135 234 HD2 ARG 31 2HD ARG 31 -10.270 20.271 21.553 235 HD3 ARG 31 1HD ARG 31 -11.843 20.343 20.677 236 HE ARG 31 HE ARG 31 -11.404 20.026 23.638 237 HH11 ARG 31 1HH2 ARG 31 -13.832 20.214 20.944 238 HH12 ARG 31 2HH2 ARG 31 -15.166 20.033 22.005 239 HH21 ARG 31 1HH1 ARG 31 -13.262 19.655 25.010 240 HH22 ARG 31 2HH1 ARG 31 -14.823 20.060 24.434 241 H GLY 32 H GLY 32 -6.659 18.192 23.113 242 HA2 GLY 32 2HA GLY 32 -6.375 18.862 25.538 243 HA3 GLY 32 1HA GLY 32 -6.955 17.174 25.853 244 H ALA 33 H ALA 33 -5.018 17.896 22.907 245 HA ALA 33 HA ALA 33 -2.685 16.741 24.220 246 HB1 ALA 33 1HB ALA 33 -3.762 16.191 21.390 247 HB2 ALA 33 2HB ALA 33 -3.679 14.981 22.724 248 HB3 ALA 33 3HB ALA 33 -2.158 15.643 22.009 249 HA PRO 34 HA PRO 34 -1.369 20.594 22.355 250 HB2 PRO 34 2HB PRO 34 1.418 20.382 22.511 251 HB3 PRO 34 1HB PRO 34 0.359 20.666 23.945 252 HG2 PRO 34 2HG PRO 34 1.498 18.001 22.949 253 HG3 PRO 34 1HG PRO 34 1.495 18.655 24.639 254 HD2 PRO 34 2HD PRO 34 -0.412 16.846 23.759 255 HD3 PRO 34 1HD PRO 34 -0.847 18.201 24.900 256 H GLY 35 H GLY 35 -1.465 21.090 20.182 257 HA2 GLY 35 2HA GLY 35 -0.393 21.191 18.144 258 HA3 GLY 35 1HA GLY 35 0.199 19.501 18.337 259 H ALA 36 H ALA 36 -3.067 20.277 19.229 260 HA ALA 36 HA ALA 36 -4.323 18.465 17.607 261 HB1 ALA 36 1HB ALA 36 -5.309 19.526 19.686 262 HB2 ALA 36 2HB ALA 36 -6.417 19.728 18.289 263 HB3 ALA 36 3HB ALA 36 -5.394 21.109 18.814 264 H ALA 37 H ALA 37 -5.826 18.724 15.746 265 HA ALA 37 HA ALA 37 -5.175 21.036 14.069 266 HB1 ALA 37 1HB ALA 37 -3.514 19.286 13.450 267 HB2 ALA 37 2HB ALA 37 -4.726 19.484 12.131 268 HB3 ALA 37 3HB ALA 37 -4.845 18.098 13.288 269 H LEU 38 H LEU 38 -7.015 17.883 14.080 270 HA LEU 38 HA LEU 38 -8.946 19.183 12.283 271 HB2 LEU 38 2HB LEU 38 -9.909 16.900 11.949 272 HB3 LEU 38 1HB LEU 38 -8.266 17.132 11.288 273 HG LEU 38 HG LEU 38 -8.493 15.950 14.080 274 HD11 LEU 38 1HD1 LEU 38 -10.244 14.697 12.940 275 HD12 LEU 38 2HD1 LEU 38 -8.783 13.649 13.072 276 HD13 LEU 38 3HD1 LEU 38 -9.185 14.415 11.500 277 HD21 LEU 38 3HD2 LEU 38 -6.224 16.317 13.111 278 HD22 LEU 38 1HD2 LEU 38 -6.647 15.310 11.675 279 HD23 LEU 38 2HD2 LEU 38 -6.563 14.572 13.316 280 H ILE 39 H ILE 39 -9.060 20.285 14.587 281 HA ILE 39 HA ILE 39 -10.441 19.043 16.604 282 HB ILE 39 HB ILE 39 -8.905 20.926 16.798 283 HG12 ILE 39 2HG1 ILE 39 -11.646 21.616 18.007 284 HG13 ILE 39 1HG1 ILE 39 -10.518 20.341 18.601 285 HG21 ILE 39 1HG2 ILE 39 -9.577 23.249 16.247 286 HG22 ILE 39 2HG2 ILE 39 -11.161 22.682 15.609 287 HG23 ILE 39 3HG2 ILE 39 -9.619 22.226 14.783 288 HD11 ILE 39 3HD ILE 39 -9.923 23.374 18.439 289 HD12 ILE 39 1HD ILE 39 -10.232 22.423 19.931 290 HD13 ILE 39 2HD ILE 39 -8.745 22.109 18.950 291 H SER 40 H SER 40 -11.652 20.106 13.642 292 HA SER 40 HA SER 40 -14.296 20.832 14.648 293 HB2 SER 40 2HB SER 40 -13.225 20.713 11.765 294 HB3 SER 40 1HB SER 40 -14.859 21.289 12.245 295 HG SER 40 1HG SER 40 -13.335 22.905 11.862 296 H TYR 41 H TYR 41 -15.904 19.332 14.805 297 HA TYR 41 HA TYR 41 -15.450 16.686 14.222 298 HB2 TYR 41 2HB TYR 41 -16.996 17.285 16.003 299 HB3 TYR 41 1HB TYR 41 -18.103 18.087 14.833 300 HD1 TYR 41 2HD TYR 41 -16.384 14.701 15.280 301 HD2 TYR 41 1HD TYR 41 -19.921 16.865 14.111 302 HE1 TYR 41 2HE TYR 41 -17.480 12.585 14.676 303 HE2 TYR 41 1HE TYR 41 -20.995 14.774 13.479 304 HH TYR 41 HH TYR 41 -20.691 12.529 13.058 305 HA PRO 42 HA PRO 42 -18.160 16.590 10.467 306 HB2 PRO 42 2HB PRO 42 -18.599 18.888 8.845 307 HB3 PRO 42 1HB PRO 42 -19.701 18.328 10.158 308 HG2 PRO 42 2HG PRO 42 -17.475 20.434 10.340 309 HG3 PRO 42 1HG PRO 42 -19.186 20.563 10.922 310 HD2 PRO 42 2HD PRO 42 -17.182 19.909 12.658 311 HD3 PRO 42 1HD PRO 42 -18.762 19.000 12.746 312 H ASP 43 H ASP 43 -15.246 18.301 10.707 313 HA ASP 43 HA ASP 43 -14.370 17.712 7.992 314 HB2 ASP 43 2HB ASP 43 -13.166 19.221 10.385 315 HB3 ASP 43 1HB ASP 43 -12.071 18.603 9.111 316 H ALA 44 H ALA 44 -14.023 16.699 11.388 317 HA ALA 44 HA ALA 44 -11.815 15.098 11.170 318 HB1 ALA 44 1HB ALA 44 -14.251 14.706 13.024 319 HB2 ALA 44 2HB ALA 44 -12.816 15.746 13.363 320 HB3 ALA 44 3HB ALA 44 -12.625 13.962 13.251 321 H ILE 45 H ILE 45 -15.256 14.329 10.574 322 HA ILE 45 HA ILE 45 -14.778 11.587 10.175 323 HB ILE 45 HB ILE 45 -16.948 12.513 10.805 324 HG12 ILE 45 2HG1 ILE 45 -17.158 10.980 8.146 325 HG13 ILE 45 1HG1 ILE 45 -16.672 10.243 9.708 326 HG21 ILE 45 1HG2 ILE 45 -16.909 14.595 9.439 327 HG22 ILE 45 2HG2 ILE 45 -18.410 13.657 9.177 328 HG23 ILE 45 3HG2 ILE 45 -17.119 13.627 7.932 329 HD11 ILE 45 3HD ILE 45 -19.374 11.629 9.129 330 HD12 ILE 45 1HD ILE 45 -19.073 9.870 9.357 331 HD13 ILE 45 2HD ILE 45 -18.865 11.002 10.738 332 H TRP 46 H TRP 46 -14.348 14.312 8.030 333 HA TRP 46 HA TRP 46 -14.250 12.676 5.659 334 HB2 TRP 46 2HB TRP 46 -14.326 15.504 6.271 335 HB3 TRP 46 1HB TRP 46 -12.799 15.236 5.383 336 HD1 TRP 46 HD TRP 46 -13.279 16.091 3.001 337 HE1 TRP 46 1HE TRP 46 -15.357 16.263 1.511 338 HE3 TRP 46 3HE TRP 46 -16.517 13.267 5.783 339 HZ2 TRP 46 2HZ TRP 46 -17.920 15.012 1.316 340 HZ3 TRP 46 3HZ TRP 46 -18.742 12.762 4.864 341 HH2 TRP 46 HH TRP 46 -19.445 13.624 2.670 342 H TRP 47 H TRP 47 -12.049 13.638 8.218 343 HA TRP 47 HA TRP 47 -9.653 12.993 6.738 344 HB2 TRP 47 2HB TRP 47 -9.430 14.553 8.671 345 HB3 TRP 47 1HB TRP 47 -10.185 13.344 9.748 346 HD1 TRP 47 HD TRP 47 -6.808 13.623 7.656 347 HE1 TRP 47 1HE TRP 47 -5.185 11.999 8.651 348 HE3 TRP 47 3HE TRP 47 -9.904 11.563 11.144 349 HZ2 TRP 47 2HZ TRP 47 -5.142 10.069 10.813 350 HZ3 TRP 47 3HZ TRP 47 -9.075 9.686 12.506 351 HH2 TRP 47 HH TRP 47 -6.738 8.951 12.351 352 H SER 48 H SER 48 -11.920 11.342 9.061 353 HA SER 48 HA SER 48 -10.530 9.051 9.422 354 HB2 SER 48 2HB SER 48 -13.579 9.156 8.955 355 HB3 SER 48 1HB SER 48 -12.665 7.874 9.830 356 HG SER 48 1HG SER 48 -13.509 9.229 11.299 357 H VAL 49 H VAL 49 -12.447 9.995 6.594 358 HA VAL 49 HA VAL 49 -12.523 7.528 5.285 359 HB VAL 49 HB VAL 49 -12.533 10.412 4.239 360 HG11 VAL 49 1HG1 VAL 49 -13.133 7.761 2.781 361 HG12 VAL 49 2HG1 VAL 49 -11.890 8.982 2.345 362 HG13 VAL 49 3HG1 VAL 49 -13.630 9.381 2.165 363 HG21 VAL 49 3HG2 VAL 49 -14.803 8.376 4.798 364 HG22 VAL 49 1HG2 VAL 49 -15.015 10.035 4.125 365 HG23 VAL 49 2HG2 VAL 49 -14.431 9.815 5.806 366 H GLU 50 H GLU 50 -9.962 10.056 5.483 367 HA GLU 50 HA GLU 50 -8.689 9.004 3.151 368 HB2 GLU 50 2HB GLU 50 -8.760 11.464 3.829 369 HB3 GLU 50 1HB GLU 50 -7.527 11.075 5.077 370 HG2 GLU 50 2HG GLU 50 -5.953 10.308 3.278 371 HG3 GLU 50 1HG GLU 50 -7.222 10.574 2.022 372 H THR 51 H THR 51 -8.573 8.175 6.498 373 HA THR 51 HA THR 51 -5.799 7.289 6.268 374 HB THR 51 HB THR 51 -6.357 8.681 8.149 375 HG1 THR 51 1HG THR 51 -4.811 7.056 8.421 376 HG21 THR 51 3HG2 THR 51 -8.371 6.464 8.922 377 HG22 THR 51 1HG2 THR 51 -8.717 8.185 8.493 378 HG23 THR 51 2HG2 THR 51 -7.833 7.800 9.998 379 H ALA 52 H ALA 52 -9.079 5.921 6.351 380 HA ALA 52 HA ALA 52 -8.268 3.343 7.186 381 HB1 ALA 52 1HB ALA 52 -10.622 4.099 7.408 382 HB2 ALA 52 2HB ALA 52 -10.551 2.630 6.372 383 HB3 ALA 52 3HB ALA 52 -10.761 4.252 5.612 384 H THR 53 H THR 53 -8.233 4.972 4.045 385 HA THR 53 HA THR 53 -7.972 2.542 2.553 386 HB THR 53 HB THR 53 -7.439 4.349 0.728 387 HG1 THR 53 1HG THR 53 -6.961 6.100 2.018 388 HG21 THR 53 3HG2 THR 53 -9.866 4.934 0.573 389 HG22 THR 53 1HG2 THR 53 -10.128 4.436 2.283 390 HG23 THR 53 2HG2 THR 53 -9.669 3.206 1.042 391 H THR 54 H THR 54 -5.913 4.070 4.697 392 HA THR 54 HA THR 54 -3.789 4.372 4.953 393 HB THR 54 HB THR 54 -2.254 2.429 4.014 394 HG1 THR 54 1HG THR 54 -4.106 1.777 2.640 395 HG21 THR 54 3HG2 THR 54 -2.927 2.815 6.378 396 HG22 THR 54 1HG2 THR 54 -3.002 1.073 5.952 397 HG23 THR 54 2HG2 THR 54 -4.530 2.028 6.072 398 H VAL 55 H VAL 55 -4.066 6.367 3.546 399 HA VAL 55 HA VAL 55 -1.951 6.208 1.530 400 HB VAL 55 HB VAL 55 -4.522 7.867 1.176 401 HG11 VAL 55 1HG1 VAL 55 -3.477 8.326 -1.082 402 HG12 VAL 55 2HG1 VAL 55 -2.014 7.391 -0.592 403 HG13 VAL 55 3HG1 VAL 55 -2.420 8.924 0.242 404 HG21 VAL 55 3HG2 VAL 55 -4.818 6.223 -0.812 405 HG22 VAL 55 1HG2 VAL 55 -5.095 5.512 0.815 406 HG23 VAL 55 2HG2 VAL 55 -3.553 5.205 -0.044 407 H GLY 56 H GLY 56 -3.999 8.915 2.731 408 HA2 GLY 56 2HA GLY 56 -3.450 10.480 4.290 409 HA3 GLY 56 1HA GLY 56 -1.792 9.756 4.473 410 H TYR 57 H TYR 57 -3.955 11.700 2.326 411 HA TYR 57 HA TYR 57 -1.766 12.086 0.432 412 HB2 TYR 57 2HB TYR 57 -4.257 11.977 -0.344 413 HB3 TYR 57 1HB TYR 57 -4.506 13.559 0.474 414 HD1 TYR 57 2HD TYR 57 -2.603 15.425 -0.267 415 HD2 TYR 57 1HD TYR 57 -3.855 12.079 -2.669 416 HE1 TYR 57 2HE TYR 57 -1.506 16.402 -2.195 417 HE2 TYR 57 1HE TYR 57 -2.820 13.124 -4.645 418 HH TYR 57 HH TYR 57 -1.153 14.752 -5.360 419 H GLY 58 H GLY 58 -3.807 13.802 2.892 420 HA2 GLY 58 2HA GLY 58 -1.951 15.024 4.264 421 HA3 GLY 58 1HA GLY 58 -2.042 16.095 2.795 422 H ASP 59 H ASP 59 -3.369 17.706 3.078 423 HA ASP 59 HA ASP 59 -4.929 18.989 3.666 424 HB2 ASP 59 2HB ASP 59 -6.582 17.457 2.622 425 HB3 ASP 59 1HB ASP 59 -6.876 16.756 4.265 426 H ARG 60 H ARG 60 -5.379 16.313 6.062 427 HA ARG 60 HA ARG 60 -5.183 18.423 8.146 428 HB2 ARG 60 2HB ARG 60 -6.397 15.628 8.535 429 HB3 ARG 60 1HB ARG 60 -6.346 16.972 9.714 430 HG2 ARG 60 2HG ARG 60 -8.548 16.892 9.044 431 HG3 ARG 60 1HG ARG 60 -7.896 18.301 8.137 432 HD2 ARG 60 2HD ARG 60 -7.995 17.079 6.020 433 HD3 ARG 60 1HD ARG 60 -8.124 15.497 6.851 434 HE ARG 60 HE ARG 60 -10.393 15.803 7.152 435 HH11 ARG 60 1HH2 ARG 60 -9.076 18.918 5.735 436 HH12 ARG 60 2HH2 ARG 60 -10.632 19.559 5.530 437 HH21 ARG 60 1HH1 ARG 60 -12.430 16.898 7.048 438 HH22 ARG 60 2HH1 ARG 60 -12.544 18.512 6.529 439 H TYR 61 H TYR 61 -4.297 16.994 10.371 440 HA TYR 61 HA TYR 61 -2.557 14.932 9.634 441 HB2 TYR 61 2HB TYR 61 -0.515 16.022 10.808 442 HB3 TYR 61 1HB TYR 61 -0.853 16.595 9.138 443 HD1 TYR 61 2HD TYR 61 -1.932 18.830 8.766 444 HD2 TYR 61 1HD TYR 61 -0.646 17.565 12.670 445 HE1 TYR 61 2HE TYR 61 -2.015 21.157 9.537 446 HE2 TYR 61 1HE TYR 61 -0.704 19.892 13.450 447 HH TYR 61 HH TYR 61 -1.790 22.602 11.331 448 HA PRO 62 HA PRO 62 -4.107 14.760 13.881 449 HB2 PRO 62 2HB PRO 62 -3.004 12.394 14.774 450 HB3 PRO 62 1HB PRO 62 -4.180 12.388 13.401 451 HG2 PRO 62 2HG PRO 62 -1.107 12.340 13.257 452 HG3 PRO 62 1HG PRO 62 -2.279 11.242 12.408 453 HD2 PRO 62 2HD PRO 62 -1.173 13.564 11.260 454 HD3 PRO 62 1HD PRO 62 -2.834 12.946 10.821 455 H VAL 63 H VAL 63 -3.135 14.397 16.235 456 HA VAL 63 HA VAL 63 -0.708 15.974 16.457 457 HB VAL 63 HB VAL 63 -2.791 16.736 17.511 458 HG11 VAL 63 1HG1 VAL 63 -3.975 14.604 17.858 459 HG12 VAL 63 2HG1 VAL 63 -3.787 15.444 19.423 460 HG13 VAL 63 3HG1 VAL 63 -2.730 14.044 19.047 461 HG21 VAL 63 3HG2 VAL 63 -2.002 17.266 19.707 462 HG22 VAL 63 1HG2 VAL 63 -0.560 17.197 18.635 463 HG23 VAL 63 2HG2 VAL 63 -0.907 15.849 19.783 464 H THR 64 H THR 64 0.769 15.248 18.365 465 HA THR 64 HA THR 64 1.651 12.695 17.903 466 HB THR 64 HB THR 64 2.605 14.427 20.237 467 HG1 THR 64 1HG THR 64 3.638 15.729 18.720 468 HG21 THR 64 3HG2 THR 64 4.040 12.891 17.952 469 HG22 THR 64 1HG2 THR 64 3.811 12.286 19.639 470 HG23 THR 64 2HG2 THR 64 4.837 13.727 19.335 471 H GLU 65 H GLU 65 0.499 14.169 21.027 472 HA GLU 65 HA GLU 65 1.135 11.995 22.520 473 HB2 GLU 65 2HB GLU 65 0.671 14.302 23.411 474 HB3 GLU 65 1HB GLU 65 -1.090 14.019 23.187 475 HG2 GLU 65 2HG GLU 65 -1.040 12.166 24.824 476 HG3 GLU 65 1HG GLU 65 0.760 12.257 24.906 477 H GLU 66 H GLU 66 -1.947 12.632 20.891 478 HA GLU 66 HA GLU 66 -2.678 9.832 21.405 479 HB2 GLU 66 2HB GLU 66 -4.543 12.259 21.508 480 HB3 GLU 66 1HB GLU 66 -5.140 10.586 21.198 481 HG2 GLU 66 2HG GLU 66 -3.429 11.051 23.684 482 HG3 GLU 66 1HG GLU 66 -5.127 11.653 23.661 483 H GLY 67 H GLY 67 -4.738 11.739 19.440 484 HA2 GLY 67 2HA GLY 67 -5.128 11.763 17.254 485 HA3 GLY 67 1HA GLY 67 -3.495 12.523 17.266 486 H ARG 68 H ARG 68 -1.670 11.262 16.814 487 HA ARG 68 HA ARG 68 -1.777 9.553 14.672 488 HB2 ARG 68 2HB ARG 68 0.201 10.913 15.374 489 HB3 ARG 68 1HB ARG 68 0.392 9.894 16.837 490 HG2 ARG 68 2HG ARG 68 0.867 7.891 15.410 491 HG3 ARG 68 1HG ARG 68 0.573 8.849 13.935 492 HD2 ARG 68 2HD ARG 68 2.870 9.138 15.989 493 HD3 ARG 68 1HD ARG 68 3.006 8.600 14.284 494 HE ARG 68 HE ARG 68 3.267 11.222 15.192 495 HH11 ARG 68 1HH2 ARG 68 1.120 9.996 12.610 496 HH12 ARG 68 2HH2 ARG 68 2.093 10.590 11.328 497 HH21 ARG 68 1HH1 ARG 68 4.513 12.244 13.384 498 HH22 ARG 68 2HH1 ARG 68 4.060 11.774 11.800 499 H LYS 69 H LYS 69 -1.569 8.779 18.207 500 HA LYS 69 HA LYS 69 -1.114 6.021 17.599 501 HB2 LYS 69 2HB LYS 69 -0.786 7.508 19.928 502 HB3 LYS 69 1HB LYS 69 -2.250 6.563 20.327 503 HG2 LYS 69 2HG LYS 69 0.548 5.552 19.513 504 HG3 LYS 69 1HG LYS 69 -0.258 5.369 21.111 505 HD2 LYS 69 2HD LYS 69 -1.963 3.810 19.983 506 HD3 LYS 69 1HD LYS 69 -1.079 4.038 18.448 507 HE2 LYS 69 2HE LYS 69 -0.322 1.989 19.128 508 HE3 LYS 69 1HE LYS 69 1.041 3.079 19.579 509 HZ1 LYS 69 3HZ LYS 69 -1.082 2.312 21.524 510 HZ2 LYS 69 1HZ LYS 69 0.541 2.752 21.864 511 HZ3 LYS 69 2HZ LYS 69 0.184 1.268 21.152 512 H VAL 70 H VAL 70 -3.943 8.057 18.029 513 HA VAL 70 HA VAL 70 -5.768 5.857 18.324 514 HB VAL 70 HB VAL 70 -6.300 8.784 17.585 515 HG11 VAL 70 1HG1 VAL 70 -8.203 7.266 16.970 516 HG12 VAL 70 2HG1 VAL 70 -8.620 8.272 18.401 517 HG13 VAL 70 3HG1 VAL 70 -8.170 6.538 18.621 518 HG21 VAL 70 3HG2 VAL 70 -6.878 8.903 20.097 519 HG22 VAL 70 1HG2 VAL 70 -5.136 8.634 19.781 520 HG23 VAL 70 2HG2 VAL 70 -6.182 7.264 20.289 521 H ALA 71 H ALA 71 -4.657 8.069 15.741 522 HA ALA 71 HA ALA 71 -6.109 7.123 13.620 523 HB1 ALA 71 1HB ALA 71 -4.335 8.096 12.161 524 HB2 ALA 71 2HB ALA 71 -3.194 8.148 13.552 525 HB3 ALA 71 3HB ALA 71 -4.652 9.205 13.546 526 H GLU 72 H GLU 72 -2.977 5.940 14.908 527 HA GLU 72 HA GLU 72 -2.232 4.140 13.025 528 HB2 GLU 72 2HB GLU 72 -0.969 4.611 15.231 529 HB3 GLU 72 1HB GLU 72 -2.173 3.585 16.064 530 HG2 GLU 72 2HG GLU 72 -1.383 1.694 14.336 531 HG3 GLU 72 1HG GLU 72 0.014 2.787 14.054 532 H GLN 73 H GLN 73 -4.647 3.753 15.616 533 HA GLN 73 HA GLN 73 -5.043 0.991 15.106 534 HB2 GLN 73 2HB GLN 73 -5.397 2.206 17.313 535 HB3 GLN 73 1HB GLN 73 -6.896 2.915 16.626 536 HG2 GLN 73 2HG GLN 73 -7.906 0.621 16.442 537 HG3 GLN 73 1HG GLN 73 -6.329 -0.126 16.875 538 HE21 GLN 73 1HE2 GLN 73 -8.501 2.487 18.260 539 HE22 GLN 73 2HE2 GLN 73 -8.381 1.919 19.900 540 H VAL 74 H VAL 74 -6.451 3.972 13.794 541 HA VAL 74 HA VAL 74 -8.820 2.739 12.796 542 HB VAL 74 HB VAL 74 -7.475 5.317 11.816 543 HG11 VAL 74 1HG1 VAL 74 -10.382 4.254 11.580 544 HG12 VAL 74 2HG1 VAL 74 -9.202 4.431 10.230 545 HG13 VAL 74 3HG1 VAL 74 -9.817 5.891 11.071 546 HG21 VAL 74 3HG2 VAL 74 -7.900 5.436 14.277 547 HG22 VAL 74 1HG2 VAL 74 -9.591 4.868 14.036 548 HG23 VAL 74 2HG2 VAL 74 -9.057 6.468 13.393 549 H MET 75 H MET 75 -5.622 3.657 11.388 550 HA MET 75 HA MET 75 -6.308 2.691 8.830 551 HB2 MET 75 2HB MET 75 -3.900 2.818 8.277 552 HB3 MET 75 1HB MET 75 -4.590 4.320 8.957 553 HG2 MET 75 2HG MET 75 -3.591 3.686 11.206 554 HG3 MET 75 1HG MET 75 -2.830 2.265 10.442 555 HE1 MET 75 3HE MET 75 -1.807 6.767 9.887 556 HE2 MET 75 1HE MET 75 -3.211 6.038 10.742 557 HE3 MET 75 2HE MET 75 -3.167 6.082 8.944 558 H LYS 76 H LYS 76 -4.763 1.114 11.665 559 HA LYS 76 HA LYS 76 -4.018 -1.215 10.348 560 HB2 LYS 76 2HB LYS 76 -3.311 -0.598 12.695 561 HB3 LYS 76 1HB LYS 76 -4.965 -1.000 13.268 562 HG2 LYS 76 2HG LYS 76 -4.644 -3.382 12.486 563 HG3 LYS 76 1HG LYS 76 -3.029 -2.940 11.836 564 HD2 LYS 76 2HD LYS 76 -2.290 -2.356 14.167 565 HD3 LYS 76 1HD LYS 76 -3.891 -2.899 14.800 566 HE2 LYS 76 2HE LYS 76 -3.461 -5.230 13.939 567 HE3 LYS 76 1HE LYS 76 -1.905 -4.678 13.208 568 HZ1 LYS 76 3HZ LYS 76 -2.501 -5.412 15.915 569 HZ2 LYS 76 1HZ LYS 76 -1.558 -3.962 15.778 570 HZ3 LYS 76 2HZ LYS 76 -1.088 -5.438 15.042 571 H ALA 77 H ALA 77 -7.134 -0.248 11.770 572 HA ALA 77 HA ALA 77 -8.400 -2.728 11.588 573 HB1 ALA 77 1HB ALA 77 -9.649 0.085 11.372 574 HB2 ALA 77 2HB ALA 77 -9.326 -0.795 12.910 575 HB3 ALA 77 3HB ALA 77 -10.539 -1.438 11.744 576 H GLY 78 H GLY 78 -7.668 -0.273 9.170 577 HA2 GLY 78 2HA GLY 78 -9.516 -1.273 7.200 578 HA3 GLY 78 1HA GLY 78 -8.227 -0.017 7.026 579 H ILE 79 H ILE 79 -5.994 -1.449 7.857 580 HA ILE 79 HA ILE 79 -5.249 -2.796 5.574 581 HB ILE 79 HB ILE 79 -4.104 -3.001 8.403 582 HG12 ILE 79 2HG1 ILE 79 -3.159 -1.406 5.930 583 HG13 ILE 79 1HG1 ILE 79 -4.111 -0.707 7.259 584 HG21 ILE 79 1HG2 ILE 79 -2.002 -3.879 7.295 585 HG22 ILE 79 2HG2 ILE 79 -2.869 -3.942 5.719 586 HG23 ILE 79 3HG2 ILE 79 -3.364 -5.010 7.084 587 HD11 ILE 79 3HD ILE 79 -1.256 -1.865 7.486 588 HD12 ILE 79 1HD ILE 79 -1.759 -0.147 7.614 589 HD13 ILE 79 2HD ILE 79 -2.247 -1.319 8.892 590 H GLU 80 H GLU 80 -6.402 -4.172 8.724 591 HA GLU 80 HA GLU 80 -6.056 -6.806 7.779 592 HB2 GLU 80 2HB GLU 80 -7.328 -7.591 9.727 593 HB3 GLU 80 1HB GLU 80 -6.003 -6.459 10.140 594 HG2 GLU 80 2HG GLU 80 -7.663 -4.588 10.407 595 HG3 GLU 80 1HG GLU 80 -8.996 -5.731 9.993 596 H VAL 81 H VAL 81 -8.692 -4.512 7.261 597 HA VAL 81 HA VAL 81 -10.604 -6.521 6.539 598 HB VAL 81 HB VAL 81 -10.454 -3.505 6.143 599 HG11 VAL 81 1HG1 VAL 81 -12.849 -3.679 5.267 600 HG12 VAL 81 2HG1 VAL 81 -12.600 -5.448 5.053 601 HG13 VAL 81 3HG1 VAL 81 -11.609 -4.271 4.115 602 HG21 VAL 81 3HG2 VAL 81 -12.340 -3.552 7.758 603 HG22 VAL 81 1HG2 VAL 81 -10.981 -4.516 8.435 604 HG23 VAL 81 2HG2 VAL 81 -12.394 -5.351 7.706 605 H PHE 82 H PHE 82 -8.399 -4.303 4.690 606 HA PHE 82 HA PHE 82 -9.137 -5.430 2.205 607 HB2 PHE 82 2HB PHE 82 -6.598 -3.869 3.026 608 HB3 PHE 82 1HB PHE 82 -6.964 -4.351 1.327 609 HD1 PHE 82 2HD PHE 82 -9.456 -3.772 0.528 610 HD2 PHE 82 1HD PHE 82 -7.282 -1.684 3.599 611 HE1 PHE 82 2HE PHE 82 -10.867 -1.783 0.174 612 HE2 PHE 82 1HE PHE 82 -8.694 0.300 3.248 613 HZ PHE 82 HZ PHE 82 -10.493 0.272 1.539 614 H ALA 83 H ALA 83 -6.790 -6.396 4.628 615 HA ALA 83 HA ALA 83 -5.418 -8.253 2.982 616 HB1 ALA 83 1HB ALA 83 -5.752 -8.171 6.052 617 HB2 ALA 83 2HB ALA 83 -4.444 -7.356 5.121 618 HB3 ALA 83 3HB ALA 83 -4.537 -9.149 5.158 619 H LEU 84 H LEU 84 -8.213 -8.492 5.268 620 HA LEU 84 HA LEU 84 -8.303 -11.234 5.427 621 HB2 LEU 84 2HB LEU 84 -9.491 -9.719 6.962 622 HB3 LEU 84 1HB LEU 84 -10.632 -9.231 5.677 623 HG LEU 84 HG LEU 84 -10.402 -12.193 6.353 624 HD11 LEU 84 1HD1 LEU 84 -11.894 -11.989 8.341 625 HD12 LEU 84 2HD1 LEU 84 -11.833 -10.193 8.220 626 HD13 LEU 84 3HD1 LEU 84 -10.340 -11.118 8.610 627 HD21 LEU 84 3HD2 LEU 84 -12.843 -10.370 5.793 628 HD22 LEU 84 1HD2 LEU 84 -12.900 -12.149 6.061 629 HD23 LEU 84 2HD2 LEU 84 -12.065 -11.487 4.615 630 H VAL 85 H VAL 85 -9.812 -9.060 3.037 631 HA VAL 85 HA VAL 85 -11.417 -11.062 1.908 632 HB VAL 85 HB VAL 85 -11.870 -9.530 0.101 633 HG11 VAL 85 1HG1 VAL 85 -12.805 -9.232 2.513 634 HG12 VAL 85 2HG1 VAL 85 -12.847 -7.754 1.479 635 HG13 VAL 85 3HG1 VAL 85 -11.599 -7.936 2.747 636 HG21 VAL 85 3HG2 VAL 85 -9.516 -8.637 -0.292 637 HG22 VAL 85 1HG2 VAL 85 -9.617 -7.770 1.285 638 HG23 VAL 85 2HG2 VAL 85 -10.711 -7.319 -0.061 639 H THR 86 H THR 86 -8.024 -10.859 1.787 640 HA THR 86 HA THR 86 -7.498 -11.572 -0.841 641 HB THR 86 HB THR 86 -5.900 -12.377 1.632 642 HG1 THR 86 1HG THR 86 -5.974 -10.280 1.705 643 HG21 THR 86 3HG2 THR 86 -5.110 -13.577 -0.429 644 HG22 THR 86 1HG2 THR 86 -3.958 -12.266 -0.009 645 HG23 THR 86 2HG2 THR 86 -5.124 -12.035 -1.361 646 H ALA 87 H ALA 87 -8.986 -13.400 1.706 647 HA ALA 87 HA ALA 87 -8.559 -16.002 0.788 648 HB1 ALA 87 1HB ALA 87 -10.743 -16.530 1.930 649 HB2 ALA 87 2HB ALA 87 -11.121 -14.766 2.009 650 HB3 ALA 87 3HB ALA 87 -9.743 -15.429 2.942 651 H ALA 88 H ALA 88 -10.752 -13.433 -0.389 652 HA ALA 88 HA ALA 88 -12.292 -15.191 -2.067 653 HB1 ALA 88 1HB ALA 88 -13.249 -13.074 -3.019 654 HB2 ALA 88 2HB ALA 88 -12.043 -12.110 -2.097 655 HB3 ALA 88 3HB ALA 88 -13.315 -13.027 -1.219 656 H LEU 89 H LEU 89 -9.636 -12.808 -2.408 657 HA LEU 89 HA LEU 89 -9.427 -13.018 -5.173 658 HB2 LEU 89 2HB LEU 89 -7.323 -12.217 -3.070 659 HB3 LEU 89 1HB LEU 89 -7.005 -12.203 -4.824 660 HG LEU 89 HG LEU 89 -7.428 -9.988 -4.149 661 HD11 LEU 89 1HD1 LEU 89 -9.931 -10.925 -5.701 662 HD12 LEU 89 2HD1 LEU 89 -8.280 -10.695 -6.394 663 HD13 LEU 89 3HD1 LEU 89 -9.175 -9.293 -5.711 664 HD21 LEU 89 3HD2 LEU 89 -10.213 -10.736 -3.055 665 HD22 LEU 89 1HD2 LEU 89 -9.503 -9.090 -3.202 666 HD23 LEU 89 2HD2 LEU 89 -8.756 -10.275 -2.089 667 H ALA 90 H ALA 90 -7.877 -14.927 -2.588 668 HA ALA 90 HA ALA 90 -6.104 -16.310 -4.223 669 HB1 ALA 90 1HB ALA 90 -5.989 -16.370 -1.718 670 HB2 ALA 90 2HB ALA 90 -6.045 -18.038 -2.401 671 HB3 ALA 90 3HB ALA 90 -7.528 -17.305 -1.674 672 H THR 91 H THR 91 -9.557 -17.081 -3.416 673 HA THR 91 HA THR 91 -9.533 -19.579 -4.637 674 HB THR 91 HB THR 91 -12.181 -18.648 -5.020 675 HG1 THR 91 1HG THR 91 -11.553 -16.740 -3.889 676 HG21 THR 91 3HG2 THR 91 -11.404 -20.828 -4.062 677 HG22 THR 91 1HG2 THR 91 -12.614 -20.034 -3.001 678 HG23 THR 91 2HG2 THR 91 -10.851 -19.986 -2.569 679 H ASP 92 H ASP 92 -9.276 -16.472 -6.246 680 HA ASP 92 HA ASP 92 -10.856 -17.334 -8.452 681 HB2 ASP 92 2HB ASP 92 -9.251 -14.819 -7.950 682 HB3 ASP 92 1HB ASP 92 -9.593 -15.295 -9.652 683 H PHE 93 H PHE 93 -7.587 -18.106 -7.598 684 HA PHE 93 HA PHE 93 -7.014 -18.766 -10.368 685 HB2 PHE 93 2HB PHE 93 -5.038 -19.881 -9.752 686 HB3 PHE 93 1HB PHE 93 -5.067 -18.318 -8.861 687 HD1 PHE 93 1HD PHE 93 -5.405 -22.049 -8.580 688 HD2 PHE 93 2HD PHE 93 -4.968 -18.344 -6.453 689 HE1 PHE 93 1HE PHE 93 -4.909 -23.297 -6.512 690 HE2 PHE 93 2HE PHE 93 -4.452 -19.589 -4.386 691 HZ PHE 93 HZ PHE 93 -4.443 -22.073 -4.402 692 H VAL 94 H VAL 94 -8.748 -20.197 -7.703 693 HA VAL 94 HA VAL 94 -8.301 -22.906 -8.473 694 HB VAL 94 HB VAL 94 -10.493 -21.764 -6.655 695 HG11 VAL 94 1HG1 VAL 94 -10.882 -24.141 -7.380 696 HG12 VAL 94 2HG1 VAL 94 -10.426 -24.068 -5.643 697 HG13 VAL 94 3HG1 VAL 94 -9.210 -24.580 -6.871 698 HG21 VAL 94 3HG2 VAL 94 -7.616 -22.691 -5.977 699 HG22 VAL 94 1HG2 VAL 94 -8.884 -22.248 -4.781 700 HG23 VAL 94 2HG2 VAL 94 -8.210 -20.998 -5.876 701 H ARG 95 H ARG 95 -10.784 -20.412 -8.927 702 HA ARG 95 HA ARG 95 -12.711 -21.899 -10.299 703 HB2 ARG 95 2HB ARG 95 -11.867 -18.936 -10.537 704 HB3 ARG 95 1HB ARG 95 -13.309 -19.618 -11.352 705 HG2 ARG 95 2HG ARG 95 -14.366 -20.173 -9.239 706 HG3 ARG 95 1HG ARG 95 -12.959 -19.551 -8.294 707 HD2 ARG 95 2HD ARG 95 -13.338 -17.265 -8.994 708 HD3 ARG 95 1HD ARG 95 -14.446 -17.760 -10.327 709 HE ARG 95 HE ARG 95 -16.065 -18.568 -8.610 710 HH11 ARG 95 1HH2 ARG 95 -13.813 -15.765 -7.755 711 HH12 ARG 95 2HH2 ARG 95 -15.084 -14.855 -7.148 712 HH21 ARG 95 1HH1 ARG 95 -17.624 -17.423 -7.363 713 HH22 ARG 95 2HH1 ARG 95 -17.300 -15.908 -6.651 714 H ARG 96 H ARG 96 -9.553 -20.829 -11.338 715 HA ARG 96 HA ARG 96 -9.991 -20.309 -14.001 716 HB2 ARG 96 2HB ARG 96 -7.889 -19.800 -12.741 717 HB3 ARG 96 1HB ARG 96 -7.477 -21.554 -12.746 718 HG2 ARG 96 2HG ARG 96 -7.242 -21.532 -15.205 719 HG3 ARG 96 1HG ARG 96 -7.911 -19.869 -15.280 720 HD2 ARG 96 2HD ARG 96 -5.410 -19.867 -15.573 721 HD3 ARG 96 1HD ARG 96 -5.957 -18.936 -14.127 722 HE ARG 96 HE ARG 96 -4.990 -20.521 -12.684 723 HH11 ARG 96 1HH2 ARG 96 -5.021 -22.119 -15.905 724 HH12 ARG 96 2HH2 ARG 96 -3.617 -23.054 -15.579 725 HH21 ARG 96 1HH1 ARG 96 -2.898 -21.730 -12.383 726 HH22 ARG 96 2HH1 ARG 96 -2.487 -22.909 -13.587 727 H GLU 97 H GLU 97 -10.026 -23.435 -12.363 728 HA GLU 97 HA GLU 97 -9.384 -24.935 -14.684 729 HB2 GLU 97 2HB GLU 97 -10.290 -26.904 -13.649 730 HB3 GLU 97 1HB GLU 97 -9.197 -26.054 -12.516 731 HG2 GLU 97 2HG GLU 97 -11.126 -25.232 -11.185 732 HG3 GLU 97 1HG GLU 97 -12.289 -25.875 -12.397 733 H GLU 98 H GLU 98 -12.352 -23.323 -13.597 734 HA GLU 98 HA GLU 98 -14.093 -24.857 -15.269 735 HB2 GLU 98 2HB GLU 98 -14.478 -22.012 -14.135 736 HB3 GLU 98 1HB GLU 98 -15.736 -23.038 -14.895 737 HG2 GLU 98 2HG GLU 98 -15.371 -24.733 -12.962 738 HG3 GLU 98 1HG GLU 98 -14.306 -23.487 -12.192 739 H GLU 99 H GLU 99 -12.184 -21.878 -15.489 740 HA GLU 99 HA GLU 99 -13.338 -20.865 -17.832 741 HB2 GLU 99 2HB GLU 99 -10.526 -20.375 -16.671 742 HB3 GLU 99 1HB GLU 99 -11.388 -19.321 -17.839 743 HG2 GLU 99 2HG GLU 99 -13.160 -18.846 -16.125 744 HG3 GLU 99 1HG GLU 99 -12.339 -19.925 -14.941 745 H ARG 100 H ARG 100 -10.801 -23.181 -17.172 746 HA ARG 100 HA ARG 100 -9.696 -23.288 -19.779 747 HB2 ARG 100 2HB ARG 100 -8.527 -23.944 -17.684 748 HB3 ARG 100 1HB ARG 100 -9.666 -25.296 -17.432 749 HG2 ARG 100 2HG ARG 100 -8.159 -25.243 -20.071 750 HG3 ARG 100 1HG ARG 100 -7.156 -25.460 -18.605 751 HD2 ARG 100 2HD ARG 100 -9.542 -27.271 -19.380 752 HD3 ARG 100 1HD ARG 100 -7.807 -27.665 -19.635 753 HE ARG 100 HE ARG 100 -9.296 -27.535 -17.026 754 HH11 ARG 100 1HH2 ARG 100 -6.010 -27.908 -18.552 755 HH12 ARG 100 2HH2 ARG 100 -5.527 -29.128 -17.462 756 HH21 ARG 100 1HH1 ARG 100 -8.361 -28.950 -15.251 757 HH22 ARG 100 2HH1 ARG 100 -6.819 -29.586 -15.484 758 H ARG 101 H ARG 101 -12.402 -24.939 -18.156 759 HA ARG 101 HA ARG 101 -12.779 -26.836 -20.301 760 HB2 ARG 101 2HB ARG 101 -14.707 -25.921 -18.069 761 HB3 ARG 101 1HB ARG 101 -15.007 -27.272 -19.210 762 HG2 ARG 101 2HG ARG 101 -13.090 -28.538 -18.296 763 HG3 ARG 101 1HG ARG 101 -12.757 -27.215 -17.119 764 HD2 ARG 101 2HD ARG 101 -15.019 -27.542 -16.074 765 HD3 ARG 101 1HD ARG 101 -15.422 -28.793 -17.302 766 HE ARG 101 HE ARG 101 -13.254 -29.012 -15.176 767 HH11 ARG 101 1HH2 ARG 101 -15.605 -30.771 -17.352 768 HH12 ARG 101 2HH2 ARG 101 -15.812 -32.063 -16.281 769 HH21 ARG 101 1HH1 ARG 101 -13.298 -30.927 -13.911 770 HH22 ARG 101 2HH1 ARG 101 -14.240 -32.280 -14.381 771 H GLY 102 H GLY 102 -13.931 -23.605 -19.355 772 HA2 GLY 102 2HA GLY 102 -14.902 -22.020 -20.651 773 HA3 GLY 102 1HA GLY 102 -15.158 -23.227 -21.976 774 H HIS 103 H HIS 103 -15.906 -23.506 -18.509 775 HA HIS 103 HA HIS 103 -18.573 -24.448 -19.067 776 HB2 HIS 103 2HB HIS 103 -17.380 -25.349 -17.061 777 HB3 HIS 103 1HB HIS 103 -17.090 -23.678 -16.475 778 HD1 HIS 103 1HD HIS 103 -18.381 -23.799 -14.206 779 HD2 HIS 103 2HD HIS 103 -20.760 -24.887 -17.548 780 HE1 HIS 103 1HE HIS 103 -20.715 -24.058 -13.419 781 HE2 HIS 103 2HE HIS 103 -22.158 -24.615 -15.466 782 H1 SER 1 H SER 1 -1.168 -18.116 -23.837 783 HA SER 1 HA SER 1 0.869 -16.928 -22.576 784 HB2 SER 1 2HB SER 1 0.015 -14.765 -23.724 785 HB3 SER 1 1HB SER 1 -1.573 -15.044 -22.931 786 HG SER 1 1HG SER 1 0.922 -14.258 -21.877 787 H ALA 2 H ALA 2 -0.586 -16.140 -20.356 788 HA ALA 2 HA ALA 2 -2.041 -18.625 -19.733 789 HB1 ALA 2 1HB ALA 2 -0.957 -16.440 -17.846 790 HB2 ALA 2 2HB ALA 2 -0.220 -18.057 -18.112 791 HB3 ALA 2 3HB ALA 2 -1.837 -17.934 -17.333 792 H ASP 3 H ASP 3 -4.249 -18.480 -19.515 793 HA ASP 3 HA ASP 3 -5.552 -16.267 -20.345 794 HB2 ASP 3 2HB ASP 3 -6.304 -18.904 -19.721 795 HB3 ASP 3 1HB ASP 3 -7.257 -17.976 -18.513 796 H HIS 4 H HIS 4 -4.629 -17.051 -17.110 797 HA HIS 4 HA HIS 4 -6.178 -15.225 -15.643 798 HB2 HIS 4 2HB HIS 4 -4.544 -15.304 -13.845 799 HB3 HIS 4 1HB HIS 4 -4.709 -16.947 -14.497 800 HD1 HIS 4 1HD HIS 4 -2.129 -13.967 -15.177 801 HD2 HIS 4 2HD HIS 4 -2.207 -18.106 -14.332 802 HE1 HIS 4 1HE HIS 4 0.158 -14.655 -14.919 803 HE2 HIS 4 2HE HIS 4 0.188 -17.032 -14.254 804 H GLU 5 H GLU 5 -3.452 -14.690 -17.817 805 HA GLU 5 HA GLU 5 -2.478 -12.375 -16.418 806 HB2 GLU 5 2HB GLU 5 -1.122 -14.154 -17.854 807 HB3 GLU 5 1HB GLU 5 -1.786 -13.306 -19.275 808 HG2 GLU 5 2HG GLU 5 0.366 -12.405 -18.975 809 HG3 GLU 5 1HG GLU 5 -0.687 -11.130 -18.265 810 H ARG 6 H ARG 6 -4.512 -13.281 -19.125 811 HA ARG 6 HA ARG 6 -4.635 -10.722 -20.322 812 HB2 ARG 6 2HB ARG 6 -6.516 -13.151 -20.539 813 HB3 ARG 6 1HB ARG 6 -6.477 -11.749 -21.664 814 HG2 ARG 6 2HG ARG 6 -4.149 -12.302 -22.337 815 HG3 ARG 6 1HG ARG 6 -4.055 -13.628 -21.137 816 HD2 ARG 6 2HD ARG 6 -4.419 -14.497 -23.432 817 HD3 ARG 6 1HD ARG 6 -5.759 -14.955 -22.320 818 HE ARG 6 HE ARG 6 -5.796 -12.694 -24.362 819 HH11 ARG 6 1HH2 ARG 6 -7.662 -15.220 -22.395 820 HH12 ARG 6 2HH2 ARG 6 -9.130 -14.768 -23.067 821 HH21 ARG 6 1HH1 ARG 6 -7.903 -12.398 -25.483 822 HH22 ARG 6 2HH1 ARG 6 -9.178 -13.508 -25.140 823 H GLU 7 H GLU 7 -6.566 -12.514 -17.956 824 HA GLU 7 HA GLU 7 -8.692 -10.778 -17.614 825 HB2 GLU 7 2HB GLU 7 -8.323 -13.191 -16.736 826 HB3 GLU 7 1HB GLU 7 -7.256 -12.492 -15.482 827 HG2 GLU 7 2HG GLU 7 -9.391 -12.974 -14.484 828 HG3 GLU 7 1HG GLU 7 -9.261 -11.182 -14.587 829 H ALA 8 H ALA 8 -5.458 -10.897 -16.100 830 HA ALA 8 HA ALA 8 -5.854 -8.846 -14.245 831 HB1 ALA 8 1HB ALA 8 -3.231 -9.833 -15.562 832 HB2 ALA 8 2HB ALA 8 -3.960 -10.483 -14.050 833 HB3 ALA 8 3HB ALA 8 -3.325 -8.799 -14.098 834 H GLN 9 H GLN 9 -4.464 -8.850 -17.539 835 HA GLN 9 HA GLN 9 -3.670 -6.171 -17.569 836 HB2 GLN 9 2HB GLN 9 -2.913 -8.022 -19.102 837 HB3 GLN 9 1HB GLN 9 -4.510 -7.989 -19.918 838 HG2 GLN 9 2HG GLN 9 -4.085 -5.750 -20.835 839 HG3 GLN 9 1HG GLN 9 -2.619 -5.538 -19.810 840 HE21 GLN 9 1HE2 GLN 9 -0.734 -6.925 -20.229 841 HE22 GLN 9 2HE2 GLN 9 -0.531 -7.724 -21.764 842 H LYS 10 H LYS 10 -6.730 -7.737 -18.427 843 HA LYS 10 HA LYS 10 -8.037 -5.564 -19.591 844 HB2 LYS 10 2HB LYS 10 -8.676 -8.015 -19.701 845 HB3 LYS 10 1HB LYS 10 -9.042 -7.950 -17.953 846 HG2 LYS 10 2HG LYS 10 -10.896 -6.218 -18.555 847 HG3 LYS 10 1HG LYS 10 -10.563 -6.597 -20.273 848 HD2 LYS 10 2HD LYS 10 -12.494 -7.871 -19.449 849 HD3 LYS 10 1HD LYS 10 -11.150 -9.008 -19.829 850 HE2 LYS 10 2HE LYS 10 -10.603 -9.196 -17.376 851 HE3 LYS 10 1HE LYS 10 -11.869 -7.969 -16.985 852 HZ1 LYS 10 3HZ LYS 10 -13.542 -9.461 -17.483 853 HZ2 LYS 10 1HZ LYS 10 -12.327 -10.391 -16.691 854 HZ3 LYS 10 2HZ LYS 10 -12.511 -10.550 -18.351 855 H ALA 11 H ALA 11 -7.551 -6.504 -16.170 856 HA ALA 11 HA ALA 11 -9.542 -4.782 -15.113 857 HB1 ALA 11 1HB ALA 11 -7.011 -5.865 -13.724 858 HB2 ALA 11 2HB ALA 11 -8.600 -6.713 -13.799 859 HB3 ALA 11 3HB ALA 11 -8.454 -5.153 -12.916 860 H GLU 12 H GLU 12 -6.066 -4.432 -15.885 861 HA GLU 12 HA GLU 12 -5.729 -1.960 -14.618 862 HB2 GLU 12 2HB GLU 12 -4.130 -3.128 -16.964 863 HB3 GLU 12 1HB GLU 12 -3.645 -1.729 -15.949 864 HG2 GLU 12 2HG GLU 12 -3.698 -3.227 -13.901 865 HG3 GLU 12 1HG GLU 12 -4.050 -4.633 -14.962 866 H GLU 13 H GLU 13 -7.029 -2.794 -17.831 867 HA GLU 13 HA GLU 13 -6.951 -0.210 -18.924 868 HB2 GLU 13 2HB GLU 13 -9.111 -2.375 -19.389 869 HB3 GLU 13 1HB GLU 13 -8.935 -0.851 -20.317 870 HG2 GLU 13 2HG GLU 13 -6.616 -1.630 -21.048 871 HG3 GLU 13 1HG GLU 13 -6.995 -3.247 -20.344 872 H GLU 14 H GLU 14 -9.234 -1.771 -16.658 873 HA GLU 14 HA GLU 14 -11.251 0.183 -16.994 874 HB2 GLU 14 2HB GLU 14 -11.817 -2.033 -16.123 875 HB3 GLU 14 1HB GLU 14 -10.814 -1.761 -14.655 876 HG2 GLU 14 2HG GLU 14 -12.322 -0.022 -13.834 877 HG3 GLU 14 1HG GLU 14 -13.199 0.060 -15.409 878 H LEU 15 H LEU 15 -8.443 -0.133 -14.824 879 HA LEU 15 HA LEU 15 -9.172 1.931 -13.103 880 HB2 LEU 15 2HB LEU 15 -7.304 0.310 -12.661 881 HB3 LEU 15 1HB LEU 15 -6.319 1.107 -13.927 882 HG LEU 15 HG LEU 15 -6.218 3.187 -12.598 883 HD11 LEU 15 1HD1 LEU 15 -8.146 1.775 -10.646 884 HD12 LEU 15 2HD1 LEU 15 -8.418 3.314 -11.546 885 HD13 LEU 15 3HD1 LEU 15 -7.203 3.251 -10.234 886 HD21 LEU 15 3HD2 LEU 15 -4.535 1.421 -12.117 887 HD22 LEU 15 1HD2 LEU 15 -5.610 0.700 -10.867 888 HD23 LEU 15 2HD2 LEU 15 -4.927 2.345 -10.623 889 H GLN 16 H GLN 16 -7.451 1.991 -16.240 890 HA GLN 16 HA GLN 16 -6.811 4.737 -16.118 891 HB2 GLN 16 2HB GLN 16 -7.161 2.940 -18.578 892 HB3 GLN 16 1HB GLN 16 -6.462 4.601 -18.587 893 HG2 GLN 16 2HG GLN 16 -4.641 3.821 -17.003 894 HG3 GLN 16 1HG GLN 16 -5.273 2.133 -17.150 895 HE21 GLN 16 1HE2 GLN 16 -2.597 3.146 -18.048 896 HE22 GLN 16 2HE2 GLN 16 -2.540 2.796 -19.748 897 H LYS 17 H LYS 17 -9.762 3.036 -16.979 898 HA LYS 17 HA LYS 17 -10.960 5.181 -18.417 899 HB2 LYS 17 2HB LYS 17 -11.631 2.692 -18.482 900 HB3 LYS 17 1HB LYS 17 -12.346 2.916 -16.856 901 HG2 LYS 17 2HG LYS 17 -13.914 4.680 -17.862 902 HG3 LYS 17 1HG LYS 17 -13.160 4.354 -19.460 903 HD2 LYS 17 2HD LYS 17 -15.179 3.104 -19.451 904 HD3 LYS 17 1HD LYS 17 -13.867 1.897 -19.204 905 HE2 LYS 17 2HE LYS 17 -14.414 1.935 -16.681 906 HE3 LYS 17 1HE LYS 17 -15.761 3.085 -17.047 907 HZ1 LYS 17 3HZ LYS 17 -15.493 0.215 -17.763 908 HZ2 LYS 17 1HZ LYS 17 -16.553 1.246 -18.630 909 HZ3 LYS 17 2HZ LYS 17 -16.732 1.031 -16.944 910 H VAL 18 H VAL 18 -10.878 4.097 -15.012 911 HA VAL 18 HA VAL 18 -12.782 5.902 -14.027 912 HB VAL 18 HB VAL 18 -10.452 4.500 -12.621 913 HG11 VAL 18 1HG1 VAL 18 -11.761 4.948 -10.499 914 HG12 VAL 18 2HG1 VAL 18 -12.871 6.025 -11.423 915 HG13 VAL 18 3HG1 VAL 18 -11.129 6.454 -11.236 916 HG21 VAL 18 3HG2 VAL 18 -13.484 3.857 -12.802 917 HG22 VAL 18 1HG2 VAL 18 -12.257 2.929 -11.869 918 HG23 VAL 18 2HG2 VAL 18 -12.182 2.963 -13.658 919 H LEU 19 H LEU 19 -9.236 6.175 -14.523 920 HA LEU 19 HA LEU 19 -8.786 8.550 -13.207 921 HB2 LEU 19 2HB LEU 19 -7.587 7.744 -15.938 922 HB3 LEU 19 1HB LEU 19 -6.929 9.005 -14.846 923 HG LEU 19 HG LEU 19 -7.074 5.996 -14.235 924 HD11 LEU 19 1HD1 LEU 19 -4.601 6.059 -14.497 925 HD12 LEU 19 2HD1 LEU 19 -4.678 7.806 -14.932 926 HD13 LEU 19 3HD1 LEU 19 -5.419 6.578 -16.018 927 HD21 LEU 19 3HD2 LEU 19 -5.561 6.599 -12.300 928 HD22 LEU 19 1HD2 LEU 19 -7.237 7.226 -12.112 929 HD23 LEU 19 2HD2 LEU 19 -5.904 8.335 -12.614 930 H GLU 20 H GLU 20 -10.050 8.042 -16.522 931 HA GLU 20 HA GLU 20 -9.888 10.790 -17.173 932 HB2 GLU 20 2HB GLU 20 -11.515 8.604 -18.573 933 HB3 GLU 20 1HB GLU 20 -11.210 10.277 -19.159 934 HG2 GLU 20 2HG GLU 20 -8.641 9.703 -18.848 935 HG3 GLU 20 1HG GLU 20 -9.176 7.984 -18.785 936 H GLU 21 H GLU 21 -12.589 8.674 -16.012 937 HA GLU 21 HA GLU 21 -14.430 10.834 -16.056 938 HB2 GLU 21 2HB GLU 21 -14.551 8.313 -14.309 939 HB3 GLU 21 1HB GLU 21 -15.867 9.499 -14.592 940 HG2 GLU 21 2HG GLU 21 -15.134 8.834 -17.226 941 HG3 GLU 21 1HG GLU 21 -14.836 7.277 -16.372 942 H ALA 22 H ALA 22 -12.110 9.651 -13.636 943 HA ALA 22 HA ALA 22 -12.967 11.107 -11.455 944 HB1 ALA 22 1HB ALA 22 -10.626 10.903 -10.595 945 HB2 ALA 22 2HB ALA 22 -10.068 10.402 -12.232 946 HB3 ALA 22 3HB ALA 22 -11.187 9.345 -11.310 947 H SER 23 H SER 23 -11.030 12.103 -14.273 948 HA SER 23 HA SER 23 -10.196 14.542 -13.133 949 HB2 SER 23 2HB SER 23 -9.483 15.267 -15.313 950 HB3 SER 23 1HB SER 23 -9.050 13.534 -15.114 951 HG SER 23 1HG SER 23 -10.956 13.050 -16.397 952 H LYS 24 H LYS 24 -13.056 13.593 -15.035 953 HA LYS 24 HA LYS 24 -14.134 16.162 -15.347 954 HB2 LYS 24 2HB LYS 24 -14.803 14.124 -16.677 955 HB3 LYS 24 1HB LYS 24 -15.659 13.473 -15.245 956 HG2 LYS 24 2HG LYS 24 -16.315 16.211 -16.506 957 HG3 LYS 24 1HG LYS 24 -16.988 14.669 -17.138 958 HD2 LYS 24 2HD LYS 24 -18.130 14.235 -14.936 959 HD3 LYS 24 1HD LYS 24 -17.431 15.731 -14.259 960 HE2 LYS 24 2HE LYS 24 -19.717 16.230 -14.855 961 HE3 LYS 24 1HE LYS 24 -18.601 17.134 -15.954 962 HZ1 LYS 24 3HZ LYS 24 -20.443 14.938 -16.521 963 HZ2 LYS 24 1HZ LYS 24 -18.957 14.915 -17.342 964 HZ3 LYS 24 2HZ LYS 24 -19.943 16.267 -17.501 965 H LYS 25 H LYS 25 -14.604 13.580 -12.912 966 HA LYS 25 HA LYS 25 -16.490 14.942 -11.330 967 HB2 LYS 25 2HB LYS 25 -14.460 12.716 -10.756 968 HB3 LYS 25 1HB LYS 25 -15.249 13.538 -9.377 969 HG2 LYS 25 2HG LYS 25 -16.478 11.576 -9.743 970 HG3 LYS 25 1HG LYS 25 -17.471 13.004 -10.168 971 HD2 LYS 25 2HD LYS 25 -17.065 12.502 -12.638 972 HD3 LYS 25 1HD LYS 25 -16.057 11.101 -12.140 973 HE2 LYS 25 2HE LYS 25 -18.262 10.259 -12.760 974 HE3 LYS 25 1HE LYS 25 -18.060 10.073 -10.974 975 HZ1 LYS 25 3HZ LYS 25 -19.322 12.294 -10.844 976 HZ2 LYS 25 1HZ LYS 25 -20.163 10.898 -11.261 977 HZ3 LYS 25 2HZ LYS 25 -19.736 12.021 -12.473 978 H ALA 26 H ALA 26 -12.896 14.690 -10.910 979 HA ALA 26 HA ALA 26 -12.797 16.186 -8.613 980 HB1 ALA 26 1HB ALA 26 -10.613 15.919 -10.772 981 HB2 ALA 26 2HB ALA 26 -10.888 14.773 -9.410 982 HB3 ALA 26 3HB ALA 26 -10.349 16.455 -9.068 983 H VAL 27 H VAL 27 -12.587 17.380 -12.049 984 HA VAL 27 HA VAL 27 -11.892 19.990 -11.226 985 HB VAL 27 HB VAL 27 -11.511 19.526 -13.533 986 HG11 VAL 27 1HG1 VAL 27 -13.218 19.099 -15.210 987 HG12 VAL 27 2HG1 VAL 27 -14.555 19.272 -14.024 988 HG13 VAL 27 3HG1 VAL 27 -13.435 17.880 -13.920 989 HG21 VAL 27 3HG2 VAL 27 -13.841 21.575 -13.312 990 HG22 VAL 27 1HG2 VAL 27 -12.578 21.506 -14.575 991 HG23 VAL 27 2HG2 VAL 27 -12.121 21.897 -12.876 992 H GLU 28 H GLU 28 -15.081 18.440 -11.859 993 HA GLU 28 HA GLU 28 -16.396 20.932 -11.485 994 HB2 GLU 28 2HB GLU 28 -17.154 19.085 -13.018 995 HB3 GLU 28 1HB GLU 28 -17.672 18.142 -11.586 996 HG2 GLU 28 2HG GLU 28 -19.359 19.823 -11.000 997 HG3 GLU 28 1HG GLU 28 -18.681 21.013 -12.169 998 H ALA 29 H ALA 29 -15.454 18.273 -9.457 999 HA ALA 29 HA ALA 29 -17.120 18.661 -7.292 1000 HB1 ALA 29 1HB ALA 29 -15.480 17.320 -6.060 1001 HB2 ALA 29 2HB ALA 29 -14.190 17.698 -7.264 1002 HB3 ALA 29 3HB ALA 29 -15.609 16.669 -7.698 1003 H GLU 30 H GLU 30 -13.897 20.184 -8.058 1004 HA GLU 30 HA GLU 30 -14.046 21.697 -5.623 1005 HB2 GLU 30 2HB GLU 30 -12.128 21.788 -7.971 1006 HB3 GLU 30 1HB GLU 30 -12.227 23.144 -6.809 1007 HG2 GLU 30 2HG GLU 30 -11.893 21.447 -4.895 1008 HG3 GLU 30 1HG GLU 30 -11.369 20.267 -6.163 1009 H ARG 31 H ARG 31 -15.716 22.126 -8.607 1010 HA ARG 31 HA ARG 31 -15.609 25.002 -8.571 1011 HB2 ARG 31 2HB ARG 31 -17.514 23.076 -10.007 1012 HB3 ARG 31 1HB ARG 31 -17.602 24.849 -10.191 1013 HG2 ARG 31 2HG ARG 31 -15.153 23.158 -10.933 1014 HG3 ARG 31 1HG ARG 31 -16.441 23.646 -12.077 1015 HD2 ARG 31 2HD ARG 31 -14.592 25.600 -10.537 1016 HD3 ARG 31 1HD ARG 31 -14.393 25.079 -12.251 1017 HE ARG 31 HE ARG 31 -16.739 26.644 -11.108 1018 HH11 ARG 31 1HH2 ARG 31 -14.579 25.999 -14.005 1019 HH12 ARG 31 2HH2 ARG 31 -14.848 27.539 -14.664 1020 HH21 ARG 31 1HH1 ARG 31 -17.545 28.414 -12.439 1021 HH22 ARG 31 2HH1 ARG 31 -16.826 28.762 -13.946 1022 H GLY 32 H GLY 32 -16.095 25.244 -6.255 1023 HA2 GLY 32 2HA GLY 32 -18.322 26.428 -5.557 1024 HA3 GLY 32 1HA GLY 32 -18.812 24.686 -5.416 1025 H ALA 33 H ALA 33 -15.727 24.188 -4.868 1026 HA ALA 33 HA ALA 33 -16.212 24.117 -2.057 1027 HB1 ALA 33 1HB ALA 33 -15.138 22.159 -3.201 1028 HB2 ALA 33 2HB ALA 33 -14.036 22.860 -1.954 1029 HB3 ALA 33 3HB ALA 33 -13.764 23.217 -3.695 1030 HA PRO 34 HA PRO 34 -13.633 27.761 -1.508 1031 HB2 PRO 34 2HB PRO 34 -13.242 27.750 1.264 1032 HB3 PRO 34 1HB PRO 34 -14.846 28.121 0.517 1033 HG2 PRO 34 2HG PRO 34 -13.871 25.438 1.636 1034 HG3 PRO 34 1HG PRO 34 -15.447 26.273 1.963 1035 HD2 PRO 34 2HD PRO 34 -15.137 24.262 0.046 1036 HD3 PRO 34 1HD PRO 34 -16.311 25.637 -0.195 1037 H GLY 35 H GLY 35 -11.289 28.248 -1.220 1038 HA2 GLY 35 2HA GLY 35 -9.140 27.788 -0.901 1039 HA3 GLY 35 1HA GLY 35 -9.627 26.345 0.061 1040 H ALA 36 H ALA 36 -10.939 26.506 -3.075 1041 HA ALA 36 HA ALA 36 -9.899 24.116 -3.945 1042 HB1 ALA 36 1HB ALA 36 -11.132 26.482 -5.520 1043 HB2 ALA 36 2HB ALA 36 -12.036 25.085 -4.823 1044 HB3 ALA 36 3HB ALA 36 -10.906 24.836 -6.193 1045 H ALA 37 H ALA 37 -8.350 23.566 -5.492 1046 HA ALA 37 HA ALA 37 -6.542 25.662 -6.494 1047 HB1 ALA 37 1HB ALA 37 -4.502 24.523 -5.546 1048 HB2 ALA 37 2HB ALA 37 -5.573 23.356 -4.674 1049 HB3 ALA 37 3HB ALA 37 -5.578 25.096 -4.221 1050 H LEU 38 H LEU 38 -7.889 22.432 -6.521 1051 HA LEU 38 HA LEU 38 -5.984 21.270 -8.264 1052 HB2 LEU 38 2HB LEU 38 -7.638 20.273 -6.441 1053 HB3 LEU 38 1HB LEU 38 -8.858 20.317 -7.729 1054 HG LEU 38 HG LEU 38 -6.199 18.740 -7.764 1055 HD11 LEU 38 1HD1 LEU 38 -7.761 17.983 -6.005 1056 HD12 LEU 38 2HD1 LEU 38 -7.662 16.760 -7.314 1057 HD13 LEU 38 3HD1 LEU 38 -9.097 17.842 -7.204 1058 HD21 LEU 38 3HD2 LEU 38 -6.895 19.127 -10.117 1059 HD22 LEU 38 1HD2 LEU 38 -8.583 18.618 -9.730 1060 HD23 LEU 38 2HD2 LEU 38 -7.233 17.425 -9.657 1061 H ILE 39 H ILE 39 -9.126 22.826 -8.385 1062 HA ILE 39 HA ILE 39 -10.260 22.318 -10.641 1063 HB ILE 39 HB ILE 39 -11.144 23.716 -8.965 1064 HG12 ILE 39 2HG1 ILE 39 -12.103 23.814 -11.319 1065 HG13 ILE 39 1HG1 ILE 39 -12.531 25.090 -10.135 1066 HG21 ILE 39 1HG2 ILE 39 -9.183 25.008 -8.297 1067 HG22 ILE 39 2HG2 ILE 39 -10.553 26.103 -8.656 1068 HG23 ILE 39 3HG2 ILE 39 -9.199 25.944 -9.834 1069 HD11 ILE 39 3HD ILE 39 -10.526 25.476 -12.459 1070 HD12 ILE 39 1HD ILE 39 -12.205 26.100 -12.373 1071 HD13 ILE 39 2HD ILE 39 -10.966 26.710 -11.226 1072 H SER 40 H SER 40 -9.830 22.240 -12.823 1073 HA SER 40 HA SER 40 -8.360 24.084 -14.224 1074 HB2 SER 40 2HB SER 40 -6.364 23.221 -12.830 1075 HB3 SER 40 1HB SER 40 -6.791 21.550 -13.309 1076 HG SER 40 1HG SER 40 -5.112 22.336 -14.506 1077 H TYR 41 H TYR 41 -7.312 21.798 -15.819 1078 HA TYR 41 HA TYR 41 -9.367 19.903 -16.177 1079 HB2 TYR 41 2HB TYR 41 -9.847 22.353 -17.641 1080 HB3 TYR 41 1HB TYR 41 -9.239 21.181 -18.863 1081 HD1 TYR 41 2HD TYR 41 -10.279 18.671 -18.508 1082 HD2 TYR 41 1HD TYR 41 -12.146 22.362 -17.322 1083 HE1 TYR 41 2HE TYR 41 -12.484 17.591 -18.631 1084 HE2 TYR 41 1HE TYR 41 -14.346 21.296 -17.456 1085 HH TYR 41 HH TYR 41 -15.488 19.305 -17.677 1086 HA PRO 42 HA PRO 42 -6.023 19.083 -19.271 1087 HB2 PRO 42 2HB PRO 42 -3.627 20.623 -19.385 1088 HB3 PRO 42 1HB PRO 42 -5.060 20.834 -20.460 1089 HG2 PRO 42 2HG PRO 42 -4.398 22.371 -17.889 1090 HG3 PRO 42 1HG PRO 42 -4.955 23.030 -19.483 1091 HD2 PRO 42 2HD PRO 42 -6.723 22.664 -17.443 1092 HD3 PRO 42 1HD PRO 42 -7.200 22.186 -19.137 1093 H ASP 43 H ASP 43 -4.824 20.413 -16.102 1094 HA ASP 43 HA ASP 43 -3.225 17.961 -15.924 1095 HB2 ASP 43 2HB ASP 43 -1.898 18.937 -14.183 1096 HB3 ASP 43 1HB ASP 43 -1.791 19.860 -15.719 1097 H ALA 44 H ALA 44 -6.260 18.558 -15.449 1098 HA ALA 44 HA ALA 44 -6.597 17.965 -12.674 1099 HB1 ALA 44 1HB ALA 44 -8.973 17.413 -13.272 1100 HB2 ALA 44 2HB ALA 44 -8.557 17.523 -15.023 1101 HB3 ALA 44 3HB ALA 44 -8.479 18.989 -13.976 1102 H ILE 45 H ILE 45 -6.233 16.097 -15.669 1103 HA ILE 45 HA ILE 45 -6.853 13.604 -14.477 1104 HB ILE 45 HB ILE 45 -7.284 14.077 -16.792 1105 HG12 ILE 45 2HG1 ILE 45 -6.666 11.694 -15.891 1106 HG13 ILE 45 1HG1 ILE 45 -6.924 12.011 -17.636 1107 HG21 ILE 45 1HG2 ILE 45 -4.233 14.320 -17.195 1108 HG22 ILE 45 2HG2 ILE 45 -5.450 15.643 -17.333 1109 HG23 ILE 45 3HG2 ILE 45 -5.478 14.282 -18.489 1110 HD11 ILE 45 3HD ILE 45 -4.131 11.813 -16.324 1111 HD12 ILE 45 1HD ILE 45 -4.963 10.505 -17.227 1112 HD13 ILE 45 2HD ILE 45 -4.484 12.012 -18.078 1113 H TRP 46 H TRP 46 -3.974 15.603 -14.659 1114 HA TRP 46 HA TRP 46 -2.116 13.483 -14.355 1115 HB2 TRP 46 2HB TRP 46 -2.040 16.478 -14.350 1116 HB3 TRP 46 1HB TRP 46 -0.852 15.752 -13.237 1117 HD1 TRP 46 HD TRP 46 1.262 14.601 -14.222 1118 HE1 TRP 46 1HE TRP 46 2.353 14.701 -16.515 1119 HE3 TRP 46 3HE TRP 46 -2.769 16.165 -16.921 1120 HZ2 TRP 46 2HZ TRP 46 1.596 15.315 -19.195 1121 HZ3 TRP 46 3HZ TRP 46 -2.509 16.569 -19.343 1122 HH2 TRP 46 HH TRP 46 -0.333 16.166 -20.463 1123 H TRP 47 H TRP 47 -3.991 15.441 -12.093 1124 HA TRP 47 HA TRP 47 -2.678 14.544 -9.741 1125 HB2 TRP 47 2HB TRP 47 -4.092 16.602 -9.808 1126 HB3 TRP 47 1HB TRP 47 -5.528 15.617 -10.253 1127 HD1 TRP 47 HD TRP 47 -3.157 16.211 -7.159 1128 HE1 TRP 47 1HE TRP 47 -4.440 15.602 -5.072 1129 HE3 TRP 47 3HE TRP 47 -7.314 14.302 -9.423 1130 HZ2 TRP 47 2HZ TRP 47 -6.905 14.191 -4.439 1131 HZ3 TRP 47 3HZ TRP 47 -9.107 13.316 -8.025 1132 HH2 TRP 47 HH TRP 47 -8.904 13.270 -5.564 1133 H SER 48 H SER 48 -5.528 13.331 -11.709 1134 HA SER 48 HA SER 48 -6.233 11.533 -9.661 1135 HB2 SER 48 2HB SER 48 -7.703 10.385 -11.377 1136 HB3 SER 48 1HB SER 48 -8.057 12.107 -11.000 1137 HG SER 48 1HG SER 48 -8.009 11.416 -13.294 1138 H VAL 49 H VAL 49 -3.969 11.291 -12.363 1139 HA VAL 49 HA VAL 49 -3.563 8.566 -12.422 1140 HB VAL 49 HB VAL 49 -1.575 10.860 -12.741 1141 HG11 VAL 49 1HG1 VAL 49 -0.212 8.838 -12.175 1142 HG12 VAL 49 2HG1 VAL 49 -0.095 9.160 -13.937 1143 HG13 VAL 49 3HG1 VAL 49 -1.162 7.844 -13.338 1144 HG21 VAL 49 3HG2 VAL 49 -2.876 8.981 -14.826 1145 HG22 VAL 49 1HG2 VAL 49 -1.923 10.467 -15.148 1146 HG23 VAL 49 2HG2 VAL 49 -3.556 10.583 -14.404 1147 H GLU 50 H GLU 50 -1.943 10.940 -10.152 1148 HA GLU 50 HA GLU 50 -0.480 8.790 -8.978 1149 HB2 GLU 50 2HB GLU 50 0.262 10.340 -7.235 1150 HB3 GLU 50 1HB GLU 50 0.511 11.002 -8.874 1151 HG2 GLU 50 2HG GLU 50 -1.392 12.559 -8.615 1152 HG3 GLU 50 1HG GLU 50 -1.870 11.816 -7.046 1153 H THR 51 H THR 51 -3.624 10.096 -8.516 1154 HA THR 51 HA THR 51 -3.907 9.438 -5.765 1155 HB THR 51 HB THR 51 -6.036 9.919 -7.920 1156 HG1 THR 51 1HG THR 51 -4.662 11.728 -7.664 1157 HG21 THR 51 3HG2 THR 51 -6.989 8.843 -5.858 1158 HG22 THR 51 1HG2 THR 51 -7.463 10.575 -5.937 1159 HG23 THR 51 2HG2 THR 51 -6.148 10.053 -4.821 1160 H ALA 52 H ALA 52 -4.568 7.795 -8.891 1161 HA ALA 52 HA ALA 52 -5.956 5.611 -7.745 1162 HB1 ALA 52 1HB ALA 52 -5.462 4.462 -9.940 1163 HB2 ALA 52 2HB ALA 52 -4.367 5.826 -10.379 1164 HB3 ALA 52 3HB ALA 52 -6.140 6.112 -10.166 1165 H THR 53 H THR 53 -2.465 6.328 -8.173 1166 HA THR 53 HA THR 53 -1.771 3.604 -7.524 1167 HB THR 53 HB THR 53 0.594 4.615 -7.598 1168 HG1 THR 53 1HG THR 53 -0.062 6.783 -7.308 1169 HG21 THR 53 3HG2 THR 53 -1.261 4.890 -10.075 1170 HG22 THR 53 1HG2 THR 53 -0.498 3.360 -9.492 1171 HG23 THR 53 2HG2 THR 53 0.533 4.711 -10.093 1172 H THR 54 H THR 54 -3.070 5.958 -5.633 1173 HA THR 54 HA THR 54 -3.007 6.506 -3.535 1174 HB THR 54 HB THR 54 -2.553 4.639 -1.868 1175 HG1 THR 54 1HG THR 54 -1.257 3.633 -3.854 1176 HG21 THR 54 3HG2 THR 54 -4.430 4.077 -4.283 1177 HG22 THR 54 1HG2 THR 54 -4.802 5.176 -2.902 1178 HG23 THR 54 2HG2 THR 54 -4.593 3.409 -2.619 1179 H VAL 55 H VAL 55 -1.075 7.943 -4.444 1180 HA VAL 55 HA VAL 55 1.070 7.623 -2.438 1181 HB VAL 55 HB VAL 55 1.374 8.784 -5.275 1182 HG11 VAL 55 1HG1 VAL 55 3.405 8.305 -2.976 1183 HG12 VAL 55 2HG1 VAL 55 2.828 9.920 -3.509 1184 HG13 VAL 55 3HG1 VAL 55 3.812 8.909 -4.622 1185 HG21 VAL 55 3HG2 VAL 55 2.901 6.765 -5.579 1186 HG22 VAL 55 1HG2 VAL 55 1.177 6.312 -5.369 1187 HG23 VAL 55 2HG2 VAL 55 2.321 6.134 -3.996 1188 H GLY 56 H GLY 56 0.529 10.366 -4.645 1189 HA2 GLY 56 2HA GLY 56 -0.543 12.306 -4.242 1190 HA3 GLY 56 1HA GLY 56 -0.988 11.749 -2.571 1191 H TYR 57 H TYR 57 1.664 12.960 -4.674 1192 HA TYR 57 HA TYR 57 3.533 12.935 -2.501 1193 HB2 TYR 57 2HB TYR 57 3.610 14.504 -5.156 1194 HB3 TYR 57 1HB TYR 57 4.908 14.572 -3.910 1195 HD1 TYR 57 2HD TYR 57 6.402 12.711 -3.468 1196 HD2 TYR 57 1HD TYR 57 3.429 12.543 -6.551 1197 HE1 TYR 57 2HE TYR 57 7.716 10.977 -4.627 1198 HE2 TYR 57 1HE TYR 57 4.725 10.816 -7.723 1199 HH TYR 57 HH TYR 57 7.883 9.608 -6.584 1200 H GLY 58 H GLY 58 1.033 15.206 -3.451 1201 HA2 GLY 58 2HA GLY 58 0.483 16.898 -1.852 1202 HA3 GLY 58 1HA GLY 58 2.231 17.218 -1.610 1203 H ASP 59 H ASP 59 0.430 16.641 -4.646 1204 HA ASP 59 HA ASP 59 1.659 19.001 -5.821 1205 HB2 ASP 59 2HB ASP 59 1.467 16.761 -7.032 1206 HB3 ASP 59 1HB ASP 59 -0.316 16.945 -7.031 1207 H ARG 60 H ARG 60 -1.720 17.586 -5.352 1208 HA ARG 60 HA ARG 60 -2.533 20.158 -4.409 1209 HB2 ARG 60 2HB ARG 60 -3.942 18.960 -6.871 1210 HB3 ARG 60 1HB ARG 60 -4.738 20.087 -5.725 1211 HG2 ARG 60 2HG ARG 60 -4.025 21.782 -7.020 1212 HG3 ARG 60 1HG ARG 60 -2.462 21.527 -6.213 1213 HD2 ARG 60 2HD ARG 60 -1.959 21.647 -8.535 1214 HD3 ARG 60 1HD ARG 60 -1.851 19.871 -8.165 1215 HE ARG 60 HE ARG 60 -4.528 20.284 -8.892 1216 HH11 ARG 60 1HH2 ARG 60 -1.346 20.649 -10.493 1217 HH12 ARG 60 2HH2 ARG 60 -1.988 21.134 -12.024 1218 HH21 ARG 60 1HH1 ARG 60 -5.429 21.059 -11.044 1219 HH22 ARG 60 2HH1 ARG 60 -4.333 21.102 -12.381 1220 H TYR 61 H TYR 61 -4.649 19.989 -3.304 1221 HA TYR 61 HA TYR 61 -5.005 17.295 -2.262 1222 HB2 TYR 61 2HB TYR 61 -5.721 18.486 -0.103 1223 HB3 TYR 61 1HB TYR 61 -3.973 18.690 -0.471 1224 HD1 TYR 61 1HD TYR 61 -3.102 20.924 -1.224 1225 HD2 TYR 61 2HD TYR 61 -7.244 20.385 -0.221 1226 HE1 TYR 61 1HE TYR 61 -3.437 23.372 -1.252 1227 HE2 TYR 61 2HE TYR 61 -7.598 22.803 -0.298 1228 HH TYR 61 HH TYR 61 -6.667 24.794 -1.189 1229 HA PRO 62 HA PRO 62 -9.174 18.805 -3.452 1230 HB2 PRO 62 2HB PRO 62 -10.739 16.728 -2.467 1231 HB3 PRO 62 1HB PRO 62 -9.663 16.472 -3.891 1232 HG2 PRO 62 2HG PRO 62 -9.149 15.764 -0.952 1233 HG3 PRO 62 1HG PRO 62 -8.878 14.726 -2.413 1234 HD2 PRO 62 2HD PRO 62 -6.901 16.303 -1.132 1235 HD3 PRO 62 1HD PRO 62 -6.819 15.852 -2.898 1236 H VAL 63 H VAL 63 -11.141 19.621 -2.153 1237 HA VAL 63 HA VAL 63 -10.285 20.232 0.564 1238 HB VAL 63 HB VAL 63 -12.670 21.571 -0.726 1239 HG11 VAL 63 1HG1 VAL 63 -10.404 22.524 1.174 1240 HG12 VAL 63 2HG1 VAL 63 -11.940 21.839 1.796 1241 HG13 VAL 63 3HG1 VAL 63 -11.962 23.358 0.849 1242 HG21 VAL 63 3HG2 VAL 63 -11.037 23.291 -1.618 1243 HG22 VAL 63 1HG2 VAL 63 -10.951 21.738 -2.495 1244 HG23 VAL 63 2HG2 VAL 63 -9.689 22.154 -1.282 1245 H THR 64 H THR 64 -13.416 20.761 0.952 1246 HA THR 64 HA THR 64 -13.928 18.051 1.916 1247 HB THR 64 HB THR 64 -15.424 20.557 2.832 1248 HG1 THR 64 1HG THR 64 -13.828 20.963 4.299 1249 HG21 THR 64 3HG2 THR 64 -15.508 19.304 4.975 1250 HG22 THR 64 1HG2 THR 64 -14.395 18.044 4.332 1251 HG23 THR 64 2HG2 THR 64 -16.054 18.214 3.651 1252 H GLU 65 H GLU 65 -15.230 20.731 0.011 1253 HA GLU 65 HA GLU 65 -17.891 19.621 0.089 1254 HB2 GLU 65 2HB GLU 65 -16.969 22.148 0.298 1255 HB3 GLU 65 1HB GLU 65 -17.192 22.127 -1.484 1256 HG2 GLU 65 2HG GLU 65 -19.581 21.632 -1.212 1257 HG3 GLU 65 1HG GLU 65 -19.381 21.277 0.535 1258 H GLU 66 H GLU 66 -15.171 18.976 -1.662 1259 HA GLU 66 HA GLU 66 -16.317 18.844 -4.292 1260 HB2 GLU 66 2HB GLU 66 -14.039 17.430 -4.564 1261 HB3 GLU 66 1HB GLU 66 -14.056 19.223 -4.552 1262 HG2 GLU 66 2HG GLU 66 -12.224 18.394 -3.200 1263 HG3 GLU 66 1HG GLU 66 -13.395 19.224 -2.114 1264 H GLY 67 H GLY 67 -15.802 16.916 -1.439 1265 HA2 GLY 67 2HA GLY 67 -17.370 15.418 -0.689 1266 HA3 GLY 67 1HA GLY 67 -17.885 15.075 -2.404 1267 H ARG 68 H ARG 68 -15.042 15.023 -0.198 1268 HA ARG 68 HA ARG 68 -13.205 13.948 -1.697 1269 HB2 ARG 68 2HB ARG 68 -12.963 14.894 0.588 1270 HB3 ARG 68 1HB ARG 68 -13.445 13.310 1.286 1271 HG2 ARG 68 2HG ARG 68 -11.441 12.225 0.284 1272 HG3 ARG 68 1HG ARG 68 -11.046 13.721 -0.626 1273 HD2 ARG 68 2HD ARG 68 -10.946 13.393 2.465 1274 HD3 ARG 68 1HD ARG 68 -9.537 13.415 1.318 1275 HE ARG 68 HE ARG 68 -11.298 15.755 0.995 1276 HH11 ARG 68 1HH2 ARG 68 -8.259 14.461 2.613 1277 HH12 ARG 68 2HH2 ARG 68 -7.799 15.977 3.089 1278 HH21 ARG 68 1HH1 ARG 68 -10.509 17.777 1.611 1279 HH22 ARG 68 2HH1 ARG 68 -9.097 18.040 2.508 1280 H LYS 69 H LYS 69 -15.908 12.223 -0.946 1281 HA LYS 69 HA LYS 69 -15.054 9.593 -1.368 1282 HB2 LYS 69 2HB LYS 69 -17.593 11.042 -2.325 1283 HB3 LYS 69 1HB LYS 69 -17.350 9.264 -2.349 1284 HG2 LYS 69 2HG LYS 69 -17.353 10.989 0.215 1285 HG3 LYS 69 1HG LYS 69 -18.760 10.081 -0.426 1286 HD2 LYS 69 2HD LYS 69 -17.549 7.931 -0.205 1287 HD3 LYS 69 1HD LYS 69 -16.065 8.796 0.321 1288 HE2 LYS 69 2HE LYS 69 -17.240 9.605 2.387 1289 HE3 LYS 69 1HE LYS 69 -18.708 8.650 1.920 1290 HZ1 LYS 69 3HZ LYS 69 -17.092 7.564 3.497 1291 HZ2 LYS 69 1HZ LYS 69 -16.004 7.408 2.144 1292 HZ3 LYS 69 2HZ LYS 69 -17.479 6.650 2.114 1293 H VAL 70 H VAL 70 -14.949 12.406 -3.541 1294 HA VAL 70 HA VAL 70 -14.779 10.970 -5.968 1295 HB VAL 70 HB VAL 70 -13.414 13.621 -5.186 1296 HG11 VAL 70 1HG1 VAL 70 -13.225 13.946 -7.702 1297 HG12 VAL 70 2HG1 VAL 70 -13.737 12.233 -7.941 1298 HG13 VAL 70 3HG1 VAL 70 -12.185 12.615 -7.105 1299 HG21 VAL 70 3HG2 VAL 70 -15.250 14.596 -6.665 1300 HG22 VAL 70 1HG2 VAL 70 -15.847 13.896 -5.145 1301 HG23 VAL 70 2HG2 VAL 70 -16.044 12.980 -6.691 1302 H ALA 71 H ALA 71 -12.309 12.062 -3.579 1303 HA ALA 71 HA ALA 71 -10.149 10.887 -4.982 1304 HB1 ALA 71 1HB ALA 71 -10.362 11.614 -1.987 1305 HB2 ALA 71 2HB ALA 71 -9.781 12.716 -3.288 1306 HB3 ALA 71 3HB ALA 71 -8.841 11.237 -2.877 1307 H GLU 72 H GLU 72 -12.176 9.867 -2.188 1308 HA GLU 72 HA GLU 72 -10.886 7.518 -1.574 1309 HB2 GLU 72 2HB GLU 72 -12.912 8.519 -0.274 1310 HB3 GLU 72 1HB GLU 72 -13.948 7.729 -1.507 1311 HG2 GLU 72 2HG GLU 72 -12.635 5.503 -0.823 1312 HG3 GLU 72 1HG GLU 72 -12.126 6.450 0.618 1313 H GLN 73 H GLN 73 -13.513 8.043 -3.967 1314 HA GLN 73 HA GLN 73 -13.904 5.416 -4.700 1315 HB2 GLN 73 2HB GLN 73 -15.398 7.347 -5.290 1316 HB3 GLN 73 1HB GLN 73 -14.139 7.986 -6.392 1317 HG2 GLN 73 2HG GLN 73 -14.444 5.980 -7.885 1318 HG3 GLN 73 1HG GLN 73 -15.659 5.308 -6.732 1319 HE21 GLN 73 1HE2 GLN 73 -17.221 5.436 -8.600 1320 HE22 GLN 73 2HE2 GLN 73 -17.935 6.957 -9.019 1321 H VAL 74 H VAL 74 -11.579 7.833 -5.990 1322 HA VAL 74 HA VAL 74 -10.735 6.170 -8.129 1323 HB VAL 74 HB VAL 74 -9.448 8.616 -6.817 1324 HG11 VAL 74 1HG1 VAL 74 -8.765 7.179 -9.484 1325 HG12 VAL 74 2HG1 VAL 74 -7.687 7.348 -8.053 1326 HG13 VAL 74 3HG1 VAL 74 -8.146 8.802 -8.996 1327 HG21 VAL 74 3HG2 VAL 74 -10.467 9.826 -8.726 1328 HG22 VAL 74 1HG2 VAL 74 -11.767 8.931 -7.880 1329 HG23 VAL 74 2HG2 VAL 74 -11.109 8.277 -9.411 1330 H MET 75 H MET 75 -9.450 6.851 -4.833 1331 HA MET 75 HA MET 75 -7.095 5.345 -5.138 1332 HB2 MET 75 2HB MET 75 -8.735 5.981 -2.609 1333 HB3 MET 75 1HB MET 75 -7.093 5.244 -2.597 1334 HG2 MET 75 2HG MET 75 -6.190 7.226 -3.816 1335 HG3 MET 75 1HG MET 75 -7.780 8.015 -3.761 1336 HE1 MET 75 3HE MET 75 -8.170 8.557 0.252 1337 HE2 MET 75 1HE MET 75 -8.672 7.075 -0.613 1338 HE3 MET 75 2HE MET 75 -9.009 8.695 -1.328 1339 H LYS 76 H LYS 76 -10.338 4.498 -3.874 1340 HA LYS 76 HA LYS 76 -9.774 1.891 -3.119 1341 HB2 LYS 76 2HB LYS 76 -11.850 3.305 -2.566 1342 HB3 LYS 76 1HB LYS 76 -12.430 3.001 -4.232 1343 HG2 LYS 76 2HG LYS 76 -12.412 0.482 -3.670 1344 HG3 LYS 76 1HG LYS 76 -11.951 0.943 -1.992 1345 HD2 LYS 76 2HD LYS 76 -14.106 2.403 -1.945 1346 HD3 LYS 76 1HD LYS 76 -14.513 1.712 -3.549 1347 HE2 LYS 76 2HE LYS 76 -15.765 0.490 -1.811 1348 HE3 LYS 76 1HE LYS 76 -14.526 -0.621 -2.521 1349 HZ1 LYS 76 3HZ LYS 76 -14.269 0.896 0.038 1350 HZ2 LYS 76 1HZ LYS 76 -13.123 -0.176 -0.631 1351 HZ3 LYS 76 2HZ LYS 76 -14.625 -0.791 -0.167 1352 H ALA 77 H ALA 77 -10.880 3.242 -6.252 1353 HA ALA 77 HA ALA 77 -11.432 0.833 -7.509 1354 HB1 ALA 77 1HB ALA 77 -12.124 3.046 -8.468 1355 HB2 ALA 77 2HB ALA 77 -11.183 2.090 -9.670 1356 HB3 ALA 77 3HB ALA 77 -10.394 3.449 -8.779 1357 H GLY 78 H GLY 78 -8.369 2.641 -7.164 1358 HA2 GLY 78 2HA GLY 78 -6.853 1.063 -8.949 1359 HA3 GLY 78 1HA GLY 78 -6.258 2.098 -7.590 1360 H ILE 79 H ILE 79 -7.322 0.921 -5.395 1361 HA ILE 79 HA ILE 79 -5.591 -1.186 -4.927 1362 HB ILE 79 HB ILE 79 -8.101 -0.321 -3.418 1363 HG12 ILE 79 2HG1 ILE 79 -5.113 0.256 -2.874 1364 HG13 ILE 79 1HG1 ILE 79 -6.198 1.396 -3.713 1365 HG21 ILE 79 1HG2 ILE 79 -5.782 -2.156 -2.487 1366 HG22 ILE 79 2HG2 ILE 79 -7.487 -2.679 -2.762 1367 HG23 ILE 79 3HG2 ILE 79 -7.107 -1.543 -1.439 1368 HD11 ILE 79 3HD ILE 79 -6.511 0.427 -0.795 1369 HD12 ILE 79 1HD ILE 79 -5.999 2.051 -1.355 1370 HD13 ILE 79 2HD ILE 79 -7.684 1.492 -1.665 1371 H GLU 80 H GLU 80 -9.115 -1.246 -5.739 1372 HA GLU 80 HA GLU 80 -9.366 -4.034 -5.443 1373 HB2 GLU 80 2HB GLU 80 -10.957 -2.077 -7.198 1374 HB3 GLU 80 1HB GLU 80 -11.383 -3.815 -6.991 1375 HG2 GLU 80 2HG GLU 80 -11.623 -3.482 -4.522 1376 HG3 GLU 80 1HG GLU 80 -11.296 -1.722 -4.723 1377 H VAL 81 H VAL 81 -8.447 -2.031 -8.282 1378 HA VAL 81 HA VAL 81 -8.479 -4.173 -10.123 1379 HB VAL 81 HB VAL 81 -7.187 -1.415 -10.067 1380 HG11 VAL 81 1HG1 VAL 81 -6.653 -1.788 -12.538 1381 HG12 VAL 81 2HG1 VAL 81 -6.940 -3.547 -12.294 1382 HG13 VAL 81 3HG1 VAL 81 -5.601 -2.715 -11.420 1383 HG21 VAL 81 3HG2 VAL 81 -8.929 -0.982 -11.813 1384 HG22 VAL 81 1HG2 VAL 81 -9.702 -1.653 -10.339 1385 HG23 VAL 81 2HG2 VAL 81 -9.437 -2.708 -11.773 1386 H PHE 82 H PHE 82 -5.831 -2.696 -8.145 1387 HA PHE 82 HA PHE 82 -3.879 -4.504 -9.126 1388 HB2 PHE 82 2HB PHE 82 -3.892 -2.929 -6.471 1389 HB3 PHE 82 1HB PHE 82 -2.446 -3.698 -7.221 1390 HD1 PHE 82 2HD PHE 82 -3.005 -2.788 -10.183 1391 HD2 PHE 82 1HD PHE 82 -3.081 -0.742 -6.389 1392 HE1 PHE 82 2HE PHE 82 -2.489 -0.669 -11.309 1393 HE2 PHE 82 1HE PHE 82 -2.592 1.380 -7.529 1394 HZ PHE 82 HZ PHE 82 -2.287 1.433 -9.994 1395 H ALA 83 H ALA 83 -6.458 -4.978 -6.911 1396 HA ALA 83 HA ALA 83 -5.134 -7.090 -5.436 1397 HB1 ALA 83 1HB ALA 83 -6.967 -5.704 -4.348 1398 HB2 ALA 83 2HB ALA 83 -7.322 -7.465 -4.350 1399 HB3 ALA 83 3HB ALA 83 -8.138 -6.373 -5.531 1400 H LEU 84 H LEU 84 -7.565 -6.691 -8.012 1401 HA LEU 84 HA LEU 84 -8.475 -9.269 -8.218 1402 HB2 LEU 84 2HB LEU 84 -9.378 -7.125 -9.234 1403 HB3 LEU 84 1HB LEU 84 -8.152 -7.241 -10.525 1404 HG LEU 84 HG LEU 84 -10.165 -9.507 -9.973 1405 HD11 LEU 84 1HD1 LEU 84 -11.496 -7.419 -10.135 1406 HD12 LEU 84 2HD1 LEU 84 -11.760 -8.467 -11.576 1407 HD13 LEU 84 3HD1 LEU 84 -10.707 -7.008 -11.703 1408 HD21 LEU 84 3HD2 LEU 84 -8.750 -8.610 -12.579 1409 HD22 LEU 84 1HD2 LEU 84 -9.996 -9.905 -12.459 1410 HD23 LEU 84 2HD2 LEU 84 -8.419 -10.112 -11.640 1411 H VAL 85 H VAL 85 -5.602 -7.767 -9.674 1412 HA VAL 85 HA VAL 85 -5.021 -9.814 -11.464 1413 HB VAL 85 HB VAL 85 -2.802 -8.870 -11.692 1414 HG11 VAL 85 1HG1 VAL 85 -4.893 -7.710 -12.678 1415 HG12 VAL 85 2HG1 VAL 85 -3.489 -6.618 -12.409 1416 HG13 VAL 85 3HG1 VAL 85 -4.874 -6.601 -11.275 1417 HG21 VAL 85 3HG2 VAL 85 -2.076 -6.947 -10.232 1418 HG22 VAL 85 1HG2 VAL 85 -2.262 -8.445 -9.260 1419 HG23 VAL 85 2HG2 VAL 85 -3.536 -7.178 -9.214 1420 H THR 86 H THR 86 -4.964 -10.040 -8.063 1421 HA THR 86 HA THR 86 -2.779 -11.735 -7.703 1422 HB THR 86 HB THR 86 -5.391 -11.587 -6.135 1423 HG1 THR 86 1HG THR 86 -4.569 -9.675 -5.954 1424 HG21 THR 86 3HG2 THR 86 -4.097 -13.611 -5.476 1425 HG22 THR 86 1HG2 THR 86 -3.908 -12.350 -4.213 1426 HG23 THR 86 2HG2 THR 86 -2.569 -12.646 -5.381 1427 H ALA 87 H ALA 87 -5.820 -12.299 -9.369 1428 HA ALA 87 HA ALA 87 -5.845 -15.112 -9.174 1429 HB1 ALA 87 1HB ALA 87 -7.112 -15.064 -11.330 1430 HB2 ALA 87 2HB ALA 87 -6.634 -13.338 -11.573 1431 HB3 ALA 87 3HB ALA 87 -7.718 -13.792 -10.213 1432 H ALA 88 H ALA 88 -3.593 -12.933 -10.699 1433 HA ALA 88 HA ALA 88 -2.410 -14.983 -12.380 1434 HB1 ALA 88 1HB ALA 88 -0.741 -13.223 -13.000 1435 HB2 ALA 88 2HB ALA 88 -1.455 -12.096 -11.810 1436 HB3 ALA 88 3HB ALA 88 -2.411 -12.590 -13.243 1437 H LEU 89 H LEU 89 -1.511 -12.875 -9.570 1438 HA LEU 89 HA LEU 89 0.956 -14.163 -9.305 1439 HB2 LEU 89 2HB LEU 89 -0.535 -12.462 -7.208 1440 HB3 LEU 89 1HB LEU 89 1.155 -13.035 -7.068 1441 HG LEU 89 HG LEU 89 1.308 -10.809 -7.656 1442 HD11 LEU 89 1HD1 LEU 89 2.881 -12.342 -8.877 1443 HD12 LEU 89 2HD1 LEU 89 2.598 -10.784 -9.733 1444 HD13 LEU 89 3HD1 LEU 89 1.807 -12.293 -10.320 1445 HD21 LEU 89 3HD2 LEU 89 -0.994 -10.378 -8.511 1446 HD22 LEU 89 1HD2 LEU 89 -0.533 -11.102 -10.102 1447 HD23 LEU 89 2HD2 LEU 89 0.292 -9.622 -9.512 1448 H ALA 90 H ALA 90 -2.172 -14.829 -7.654 1449 HA ALA 90 HA ALA 90 -0.909 -16.466 -5.691 1450 HB1 ALA 90 1HB ALA 90 -3.218 -17.280 -5.153 1451 HB2 ALA 90 2HB ALA 90 -3.849 -16.365 -6.578 1452 HB3 ALA 90 3HB ALA 90 -3.115 -15.488 -5.186 1453 H THR 91 H THR 91 -1.640 -16.975 -9.082 1454 HA THR 91 HA THR 91 -1.705 -19.857 -8.597 1455 HB THR 91 HB THR 91 -3.272 -19.106 -10.247 1456 HG1 THR 91 1HG THR 91 -1.179 -20.820 -10.879 1457 HG21 THR 91 3HG2 THR 91 -2.491 -18.533 -12.547 1458 HG22 THR 91 1HG2 THR 91 -0.831 -18.217 -11.886 1459 HG23 THR 91 2HG2 THR 91 -2.252 -17.254 -11.328 1460 H ASP 92 H ASP 92 0.732 -17.465 -8.637 1461 HA ASP 92 HA ASP 92 2.459 -18.839 -10.401 1462 HB2 ASP 92 2HB ASP 92 2.878 -16.501 -8.515 1463 HB3 ASP 92 1HB ASP 92 4.316 -17.410 -9.101 1464 H PHE 93 H PHE 93 1.840 -19.260 -6.933 1465 HA PHE 93 HA PHE 93 4.117 -20.970 -6.673 1466 HB2 PHE 93 2HB PHE 93 3.443 -21.582 -4.521 1467 HB3 PHE 93 1HB PHE 93 2.983 -19.857 -4.653 1468 HD1 PHE 93 1HD PHE 93 0.510 -19.287 -4.856 1469 HD2 PHE 93 2HD PHE 93 1.846 -23.325 -4.241 1470 HE1 PHE 93 1HE PHE 93 -1.756 -19.928 -4.129 1471 HE2 PHE 93 2HE PHE 93 -0.436 -23.973 -3.543 1472 HZ PHE 93 HZ PHE 93 -2.238 -22.272 -3.466 1473 H VAL 94 H VAL 94 0.906 -21.367 -7.963 1474 HA VAL 94 HA VAL 94 0.690 -24.150 -7.472 1475 HB VAL 94 HB VAL 94 -0.840 -22.435 -9.494 1476 HG11 VAL 94 1HG1 VAL 94 -1.163 -24.902 -9.830 1477 HG12 VAL 94 2HG1 VAL 94 -2.644 -24.160 -9.129 1478 HG13 VAL 94 3HG1 VAL 94 -1.533 -25.104 -8.077 1479 HG21 VAL 94 3HG2 VAL 94 -1.424 -23.016 -6.507 1480 HG22 VAL 94 1HG2 VAL 94 -2.499 -22.133 -7.643 1481 HG23 VAL 94 2HG2 VAL 94 -0.938 -21.417 -7.163 1482 H ARG 95 H ARG 95 1.973 -22.090 -10.023 1483 HA ARG 95 HA ARG 95 2.207 -24.009 -12.063 1484 HB2 ARG 95 2HB ARG 95 3.942 -21.538 -11.460 1485 HB3 ARG 95 1HB ARG 95 4.005 -22.476 -12.985 1486 HG2 ARG 95 2HG ARG 95 1.689 -21.852 -13.553 1487 HG3 ARG 95 1HG ARG 95 1.460 -21.094 -11.951 1488 HD2 ARG 95 2HD ARG 95 1.807 -19.309 -13.524 1489 HD3 ARG 95 1HD ARG 95 3.296 -19.406 -12.492 1490 HE ARG 95 HE ARG 95 4.455 -20.580 -14.273 1491 HH11 ARG 95 1HH2 ARG 95 2.501 -17.788 -14.893 1492 HH12 ARG 95 2HH2 ARG 95 2.538 -17.852 -16.604 1493 HH21 ARG 95 1HH1 ARG 95 4.323 -20.933 -16.841 1494 HH22 ARG 95 2HH1 ARG 95 3.629 -19.670 -17.710 1495 H ARG 96 H ARG 96 4.131 -23.406 -9.144 1496 HA ARG 96 HA ARG 96 6.564 -24.337 -9.796 1497 HB2 ARG 96 2HB ARG 96 5.903 -23.490 -7.490 1498 HB3 ARG 96 1HB ARG 96 5.077 -25.052 -7.200 1499 HG2 ARG 96 2HG ARG 96 7.434 -26.170 -7.561 1500 HG3 ARG 96 1HG ARG 96 8.099 -24.512 -7.579 1501 HD2 ARG 96 2HD ARG 96 8.353 -25.640 -5.319 1502 HD3 ARG 96 1HD ARG 96 7.297 -24.179 -5.205 1503 HE ARG 96 HE ARG 96 5.382 -25.533 -4.980 1504 HH11 ARG 96 1HH2 ARG 96 8.324 -27.652 -4.767 1505 HH12 ARG 96 2HH2 ARG 96 7.456 -29.072 -4.759 1506 HH21 ARG 96 1HH1 ARG 96 4.209 -27.598 -4.899 1507 HH22 ARG 96 2HH1 ARG 96 5.040 -28.997 -5.347 1508 H GLU 97 H GLU 97 3.652 -26.326 -9.125 1509 HA GLU 97 HA GLU 97 5.120 -28.764 -9.031 1510 HB2 GLU 97 2HB GLU 97 2.152 -28.094 -9.326 1511 HB3 GLU 97 1HB GLU 97 2.694 -29.763 -9.679 1512 HG2 GLU 97 2HG GLU 97 3.131 -28.335 -6.994 1513 HG3 GLU 97 1HG GLU 97 1.913 -29.617 -7.341 1514 H GLU 98 H GLU 98 3.759 -26.867 -11.692 1515 HA GLU 98 HA GLU 98 3.907 -29.080 -13.524 1516 HB2 GLU 98 2HB GLU 98 3.525 -26.100 -14.169 1517 HB3 GLU 98 1HB GLU 98 3.266 -27.509 -15.250 1518 HG2 GLU 98 2HG GLU 98 1.463 -28.315 -13.541 1519 HG3 GLU 98 1HG GLU 98 1.628 -26.701 -12.749 1520 H GLU 99 H GLU 99 5.842 -26.239 -12.556 1521 HA GLU 99 HA GLU 99 7.786 -26.396 -14.560 1522 HB2 GLU 99 2HB GLU 99 8.021 -25.391 -11.664 1523 HB3 GLU 99 1HB GLU 99 9.242 -25.095 -12.949 1524 HG2 GLU 99 2HG GLU 99 7.630 -23.782 -14.278 1525 HG3 GLU 99 1HG GLU 99 6.302 -24.138 -13.124 1526 H ARG 100 H ARG 100 7.397 -28.111 -11.515 1527 HA ARG 100 HA ARG 100 9.935 -29.171 -11.265 1528 HB2 ARG 100 2HB ARG 100 7.592 -29.158 -9.831 1529 HB3 ARG 100 1HB ARG 100 7.557 -30.857 -10.358 1530 HG2 ARG 100 2HG ARG 100 9.581 -31.333 -9.096 1531 HG3 ARG 100 1HG ARG 100 10.055 -29.605 -9.064 1532 HD2 ARG 100 2HD ARG 100 9.216 -30.265 -6.799 1533 HD3 ARG 100 1HD ARG 100 8.193 -29.011 -7.562 1534 HE ARG 100 HE ARG 100 6.399 -30.440 -7.344 1535 HH11 ARG 100 1HH2 ARG 100 9.267 -32.472 -6.711 1536 HH12 ARG 100 2HH2 ARG 100 8.408 -33.943 -6.706 1537 HH21 ARG 100 1HH1 ARG 100 5.219 -32.336 -7.407 1538 HH22 ARG 100 2HH1 ARG 100 5.951 -33.847 -6.973 1539 H ARG 101 H ARG 101 7.215 -30.215 -13.267 1540 HA ARG 101 HA ARG 101 8.590 -32.695 -14.029 1541 HB2 ARG 101 2HB ARG 101 5.776 -31.588 -14.340 1542 HB3 ARG 101 1HB ARG 101 6.386 -32.694 -15.613 1543 HG2 ARG 101 2HG ARG 101 5.181 -34.008 -13.992 1544 HG3 ARG 101 1HG ARG 101 6.914 -34.437 -14.042 1545 HD2 ARG 101 2HD ARG 101 6.302 -34.548 -11.724 1546 HD3 ARG 101 1HD ARG 101 7.302 -33.075 -11.896 1547 HE ARG 101 HE ARG 101 5.399 -31.734 -11.367 1548 HH11 ARG 101 1HH2 ARG 101 4.198 -34.909 -12.436 1549 HH12 ARG 101 2HH2 ARG 101 2.650 -34.730 -11.813 1550 HH21 ARG 101 1HH1 ARG 101 3.581 -31.895 -9.726 1551 HH22 ARG 101 2HH1 ARG 101 2.366 -32.998 -9.995 1552 H GLY 102 H GLY 102 8.448 -29.392 -14.923 1553 HA2 GLY 102 2HA GLY 102 9.619 -28.378 -16.480 1554 HA3 GLY 102 1HA GLY 102 10.069 -29.963 -17.214 1555 H HIS 103 H HIS 103 6.719 -29.451 -16.664 1556 HA HIS 103 HA HIS 103 5.018 -29.463 -18.062 1557 HB2 HIS 103 2HB HIS 103 4.677 -27.497 -19.551 1558 HB3 HIS 103 1HB HIS 103 5.159 -27.080 -17.889 1559 HD1 HIS 103 1HD HIS 103 6.930 -25.229 -17.825 1560 HD2 HIS 103 2HD HIS 103 7.295 -27.557 -21.326 1561 HE1 HIS 103 1HE HIS 103 8.784 -24.267 -19.155 1562 HE2 HIS 103 2HE HIS 103 9.018 -25.739 -21.263 1563 H1 SER 1 H SER 1 15.277 -20.009 0.039 1564 HA SER 1 HA SER 1 16.244 -19.112 -2.014 1565 HB2 SER 1 2HB SER 1 18.760 -20.547 -0.970 1566 HB3 SER 1 1HB SER 1 18.592 -19.886 -2.638 1567 HG SER 1 1HG SER 1 19.628 -18.474 -1.168 1568 H ALA 2 H ALA 2 14.436 -21.140 -1.059 1569 HA ALA 2 HA ALA 2 15.122 -23.494 -2.631 1570 HB1 ALA 2 1HB ALA 2 13.720 -23.772 -0.555 1571 HB2 ALA 2 2HB ALA 2 12.825 -24.267 -2.034 1572 HB3 ALA 2 3HB ALA 2 12.484 -22.678 -1.246 1573 H ASP 3 H ASP 3 15.142 -23.014 -4.773 1574 HA ASP 3 HA ASP 3 14.861 -21.814 -6.629 1575 HB2 ASP 3 2HB ASP 3 12.351 -23.559 -6.433 1576 HB3 ASP 3 1HB ASP 3 12.949 -22.789 -7.953 1577 H HIS 4 H HIS 4 11.433 -21.813 -5.742 1578 HA HIS 4 HA HIS 4 10.781 -19.462 -6.983 1579 HB2 HIS 4 2HB HIS 4 8.702 -19.414 -5.786 1580 HB3 HIS 4 1HB HIS 4 9.086 -21.118 -6.161 1581 HD1 HIS 4 1HD HIS 4 7.505 -19.444 -3.557 1582 HD2 HIS 4 2HD HIS 4 10.865 -21.974 -3.465 1583 HE1 HIS 4 1HE HIS 4 7.904 -20.079 -1.162 1584 HE2 HIS 4 2HE HIS 4 10.114 -21.352 -1.136 1585 H GLU 5 H GLU 5 12.322 -19.790 -3.782 1586 HA GLU 5 HA GLU 5 11.766 -17.092 -2.978 1587 HB2 GLU 5 2HB GLU 5 13.722 -19.240 -2.038 1588 HB3 GLU 5 1HB GLU 5 13.628 -17.633 -1.248 1589 HG2 GLU 5 2HG GLU 5 11.634 -18.031 -0.193 1590 HG3 GLU 5 1HG GLU 5 10.971 -19.015 -1.540 1591 H ARG 6 H ARG 6 14.154 -18.653 -5.054 1592 HA ARG 6 HA ARG 6 16.158 -16.630 -4.675 1593 HB2 ARG 6 2HB ARG 6 15.833 -18.593 -7.027 1594 HB3 ARG 6 1HB ARG 6 17.295 -17.649 -6.588 1595 HG2 ARG 6 2HG ARG 6 17.425 -18.926 -4.406 1596 HG3 ARG 6 1HG ARG 6 15.968 -19.866 -4.871 1597 HD2 ARG 6 2HD ARG 6 18.015 -21.204 -5.296 1598 HD3 ARG 6 1HD ARG 6 17.172 -20.817 -6.860 1599 HE ARG 6 HE ARG 6 19.136 -18.746 -6.205 1600 HH11 ARG 6 1HH2 ARG 6 18.980 -22.204 -7.371 1601 HH12 ARG 6 2HH2 ARG 6 20.484 -22.075 -8.192 1602 HH21 ARG 6 1HH1 ARG 6 21.097 -18.647 -7.299 1603 HH22 ARG 6 2HH1 ARG 6 21.733 -19.991 -8.173 1604 H GLU 7 H GLU 7 13.459 -17.345 -6.913 1605 HA GLU 7 HA GLU 7 14.080 -15.283 -8.701 1606 HB2 GLU 7 2HB GLU 7 12.444 -17.420 -8.886 1607 HB3 GLU 7 1HB GLU 7 11.218 -16.211 -8.406 1608 HG2 GLU 7 2HG GLU 7 11.133 -16.229 -10.761 1609 HG3 GLU 7 1HG GLU 7 12.142 -14.778 -10.436 1610 H ALA 8 H ALA 8 12.363 -15.339 -5.624 1611 HA ALA 8 HA ALA 8 11.114 -12.811 -5.856 1612 HB1 ALA 8 1HB ALA 8 10.416 -14.444 -4.088 1613 HB2 ALA 8 2HB ALA 8 10.944 -12.886 -3.356 1614 HB3 ALA 8 3HB ALA 8 12.042 -14.310 -3.319 1615 H GLN 9 H GLN 9 14.344 -13.846 -4.539 1616 HA GLN 9 HA GLN 9 14.874 -11.132 -3.754 1617 HB2 GLN 9 2HB GLN 9 16.717 -13.554 -3.844 1618 HB3 GLN 9 1HB GLN 9 17.234 -11.924 -3.301 1619 HG2 GLN 9 2HG GLN 9 14.922 -13.519 -1.981 1620 HG3 GLN 9 1HG GLN 9 16.618 -13.477 -1.398 1621 HE21 GLN 9 1HE2 GLN 9 13.589 -11.576 -1.626 1622 HE22 GLN 9 2HE2 GLN 9 14.163 -10.156 -0.827 1623 H LYS 10 H LYS 10 15.501 -13.039 -6.629 1624 HA LYS 10 HA LYS 10 17.256 -11.294 -7.917 1625 HB2 LYS 10 2HB LYS 10 16.517 -13.706 -8.486 1626 HB3 LYS 10 1HB LYS 10 14.965 -13.010 -9.037 1627 HG2 LYS 10 2HG LYS 10 16.658 -11.577 -10.651 1628 HG3 LYS 10 1HG LYS 10 17.699 -13.005 -10.344 1629 HD2 LYS 10 2HD LYS 10 15.645 -14.471 -10.900 1630 HD3 LYS 10 1HD LYS 10 14.777 -12.960 -11.344 1631 HE2 LYS 10 2HE LYS 10 16.583 -12.567 -13.156 1632 HE3 LYS 10 1HE LYS 10 17.240 -14.206 -12.744 1633 HZ1 LYS 10 3HZ LYS 10 14.706 -14.833 -13.018 1634 HZ2 LYS 10 1HZ LYS 10 15.787 -14.748 -14.351 1635 HZ3 LYS 10 2HZ LYS 10 14.719 -13.443 -14.021 1636 H ALA 11 H ALA 11 13.741 -11.159 -7.380 1637 HA ALA 11 HA ALA 11 13.199 -9.212 -9.368 1638 HB1 ALA 11 1HB ALA 11 11.559 -9.858 -6.841 1639 HB2 ALA 11 2HB ALA 11 11.416 -10.729 -8.413 1640 HB3 ALA 11 3HB ALA 11 10.985 -8.985 -8.307 1641 H GLU 12 H GLU 12 14.247 -9.076 -5.940 1642 HA GLU 12 HA GLU 12 13.601 -6.354 -5.572 1643 HB2 GLU 12 2HB GLU 12 15.871 -7.938 -4.221 1644 HB3 GLU 12 1HB GLU 12 15.285 -6.289 -3.767 1645 HG2 GLU 12 2HG GLU 12 13.000 -7.346 -3.258 1646 HG3 GLU 12 1HG GLU 12 13.786 -8.958 -3.439 1647 H GLU 13 H GLU 13 16.388 -7.992 -7.046 1648 HA GLU 13 HA GLU 13 18.090 -5.736 -7.048 1649 HB2 GLU 13 2HB GLU 13 18.065 -8.196 -8.904 1650 HB3 GLU 13 1HB GLU 13 19.451 -7.069 -8.655 1651 HG2 GLU 13 2HG GLU 13 19.532 -7.733 -6.218 1652 HG3 GLU 13 1HG GLU 13 18.161 -8.869 -6.475 1653 H GLU 14 H GLU 14 15.475 -6.861 -9.091 1654 HA GLU 14 HA GLU 14 16.053 -5.345 -11.383 1655 HB2 GLU 14 2HB GLU 14 14.377 -7.423 -10.889 1656 HB3 GLU 14 1HB GLU 14 13.201 -6.122 -10.596 1657 HG2 GLU 14 2HG GLU 14 12.901 -6.796 -12.877 1658 HG3 GLU 14 1HG GLU 14 13.795 -5.238 -12.980 1659 H LEU 15 H LEU 15 14.202 -4.811 -8.410 1660 HA LEU 15 HA LEU 15 12.812 -2.521 -9.004 1661 HB2 LEU 15 2HB LEU 15 12.648 -3.958 -6.877 1662 HB3 LEU 15 1HB LEU 15 14.161 -3.197 -6.312 1663 HG LEU 15 HG LEU 15 12.963 -0.926 -6.431 1664 HD11 LEU 15 1HD1 LEU 15 11.065 -1.508 -7.930 1665 HD12 LEU 15 2HD1 LEU 15 10.443 -1.001 -6.319 1666 HD13 LEU 15 3HD1 LEU 15 10.481 -2.742 -6.750 1667 HD21 LEU 15 3HD2 LEU 15 13.378 -2.131 -4.290 1668 HD22 LEU 15 1HD2 LEU 15 11.835 -3.046 -4.497 1669 HD23 LEU 15 2HD2 LEU 15 11.803 -1.260 -4.263 1670 H GLN 16 H GLN 16 16.059 -2.902 -7.640 1671 HA GLN 16 HA GLN 16 16.752 -0.247 -7.250 1672 HB2 GLN 16 2HB GLN 16 18.565 -2.561 -8.164 1673 HB3 GLN 16 1HB GLN 16 19.129 -1.067 -7.337 1674 HG2 GLN 16 2HG GLN 16 18.085 -1.745 -5.222 1675 HG3 GLN 16 1HG GLN 16 17.218 -3.116 -6.010 1676 HE21 GLN 16 1HE2 GLN 16 18.660 -4.025 -3.960 1677 HE22 GLN 16 2HE2 GLN 16 20.162 -4.711 -4.433 1678 H LYS 17 H LYS 17 16.923 -2.296 -10.129 1679 HA LYS 17 HA LYS 17 18.668 -0.621 -11.601 1680 HB2 LYS 17 2HB LYS 17 18.446 -3.128 -11.800 1681 HB3 LYS 17 1HB LYS 17 16.804 -2.900 -12.475 1682 HG2 LYS 17 2HG LYS 17 17.833 -1.740 -14.490 1683 HG3 LYS 17 1HG LYS 17 19.452 -1.921 -13.729 1684 HD2 LYS 17 2HD LYS 17 19.241 -3.704 -15.349 1685 HD3 LYS 17 1HD LYS 17 19.160 -4.403 -13.695 1686 HE2 LYS 17 2HE LYS 17 16.504 -4.269 -14.030 1687 HE3 LYS 17 1HE LYS 17 16.890 -4.078 -15.780 1688 HZ1 LYS 17 3HZ LYS 17 16.433 -6.352 -14.910 1689 HZ2 LYS 17 1HZ LYS 17 17.872 -6.304 -14.040 1690 HZ3 LYS 17 2HZ LYS 17 17.915 -6.258 -15.749 1691 H VAL 18 H VAL 18 15.080 -1.247 -11.691 1692 HA VAL 18 HA VAL 18 14.762 0.360 -13.982 1693 HB VAL 18 HB VAL 18 12.331 0.240 -13.584 1694 HG11 VAL 18 1HG1 VAL 18 13.623 -1.521 -14.826 1695 HG12 VAL 18 2HG1 VAL 18 12.222 -2.222 -13.939 1696 HG13 VAL 18 3HG1 VAL 18 13.885 -2.427 -13.288 1697 HG21 VAL 18 3HG2 VAL 18 11.475 -1.199 -11.711 1698 HG22 VAL 18 1HG2 VAL 18 12.277 0.267 -11.064 1699 HG23 VAL 18 2HG2 VAL 18 13.123 -1.321 -11.022 1700 H LEU 19 H LEU 19 14.578 1.124 -10.497 1701 HA LEU 19 HA LEU 19 13.587 3.755 -11.013 1702 HB2 LEU 19 2HB LEU 19 13.805 4.206 -8.657 1703 HB3 LEU 19 1HB LEU 19 13.115 2.587 -8.911 1704 HG LEU 19 HG LEU 19 15.626 1.754 -8.580 1705 HD11 LEU 19 1HD1 LEU 19 16.714 4.037 -8.336 1706 HD12 LEU 19 2HD1 LEU 19 16.877 3.042 -6.858 1707 HD13 LEU 19 3HD1 LEU 19 15.658 4.364 -6.916 1708 HD21 LEU 19 3HD2 LEU 19 15.123 1.442 -6.144 1709 HD22 LEU 19 1HD2 LEU 19 13.700 1.103 -7.189 1710 HD23 LEU 19 2HD2 LEU 19 13.785 2.643 -6.277 1711 H GLU 20 H GLU 20 16.783 2.233 -10.867 1712 HA GLU 20 HA GLU 20 18.327 4.492 -10.395 1713 HB2 GLU 20 2HB GLU 20 18.763 1.729 -11.158 1714 HB3 GLU 20 1HB GLU 20 19.742 2.690 -12.252 1715 HG2 GLU 20 2HG GLU 20 19.818 3.138 -9.194 1716 HG3 GLU 20 1HG GLU 20 20.764 1.838 -10.002 1717 H GLU 21 H GLU 21 17.320 2.988 -13.509 1718 HA GLU 21 HA GLU 21 18.578 4.889 -15.143 1719 HB2 GLU 21 2HB GLU 21 17.698 2.675 -15.966 1720 HB3 GLU 21 1HB GLU 21 16.026 3.273 -15.718 1721 HG2 GLU 21 2HG GLU 21 16.514 3.424 -18.067 1722 HG3 GLU 21 1HG GLU 21 16.478 5.106 -17.436 1723 H ALA 22 H ALA 22 15.297 4.728 -13.748 1724 HA ALA 22 HA ALA 22 14.348 7.052 -15.015 1725 HB1 ALA 22 1HB ALA 22 13.376 5.725 -12.419 1726 HB2 ALA 22 2HB ALA 22 12.813 5.322 -14.087 1727 HB3 ALA 22 3HB ALA 22 12.471 6.944 -13.393 1728 H SER 23 H SER 23 16.494 6.670 -12.310 1729 HA SER 23 HA SER 23 15.831 9.065 -10.928 1730 HB2 SER 23 2HB SER 23 18.606 7.650 -11.107 1731 HB3 SER 23 1HB SER 23 18.112 8.864 -9.880 1732 HG SER 23 1HG SER 23 16.867 6.314 -10.282 1733 H LYS 24 H LYS 24 18.229 8.206 -13.450 1734 HA LYS 24 HA LYS 24 19.357 10.815 -13.517 1735 HB2 LYS 24 2HB LYS 24 20.702 9.000 -14.356 1736 HB3 LYS 24 1HB LYS 24 19.405 8.416 -15.438 1737 HG2 LYS 24 2HG LYS 24 20.447 11.238 -15.940 1738 HG3 LYS 24 1HG LYS 24 21.545 9.870 -16.283 1739 HD2 LYS 24 2HD LYS 24 19.892 8.792 -17.752 1740 HD3 LYS 24 1HD LYS 24 18.688 10.081 -17.407 1741 HE2 LYS 24 2HE LYS 24 20.225 11.797 -18.451 1742 HE3 LYS 24 1HE LYS 24 21.352 10.455 -18.913 1743 HZ1 LYS 24 3HZ LYS 24 18.569 10.995 -19.755 1744 HZ2 LYS 24 1HZ LYS 24 19.283 9.437 -19.987 1745 HZ3 LYS 24 2HZ LYS 24 19.943 10.837 -20.735 1746 H LYS 25 H LYS 25 16.836 9.069 -15.353 1747 HA LYS 25 HA LYS 25 16.302 11.196 -17.111 1748 HB2 LYS 25 2HB LYS 25 14.501 8.871 -16.240 1749 HB3 LYS 25 1HB LYS 25 14.120 10.015 -17.572 1750 HG2 LYS 25 2HG LYS 25 16.106 9.317 -18.846 1751 HG3 LYS 25 1HG LYS 25 16.614 8.202 -17.529 1752 HD2 LYS 25 2HD LYS 25 14.566 6.861 -17.804 1753 HD3 LYS 25 1HD LYS 25 13.967 7.953 -19.107 1754 HE2 LYS 25 2HE LYS 25 15.783 7.276 -20.629 1755 HE3 LYS 25 1HE LYS 25 16.645 6.430 -19.289 1756 HZ1 LYS 25 3HZ LYS 25 14.610 4.969 -19.147 1757 HZ2 LYS 25 1HZ LYS 25 15.597 4.756 -20.517 1758 HZ3 LYS 25 2HZ LYS 25 14.109 5.608 -20.618 1759 H ALA 26 H ALA 26 15.333 10.695 -13.740 1760 HA ALA 26 HA ALA 26 12.964 12.173 -13.820 1761 HB1 ALA 26 1HB ALA 26 13.602 10.739 -11.843 1762 HB2 ALA 26 2HB ALA 26 13.206 12.419 -11.347 1763 HB3 ALA 26 3HB ALA 26 14.924 11.887 -11.444 1764 H VAL 27 H VAL 27 16.355 13.099 -13.148 1765 HA VAL 27 HA VAL 27 15.789 15.798 -12.515 1766 HB VAL 27 HB VAL 27 18.379 14.642 -13.716 1767 HG11 VAL 27 1HG1 VAL 27 18.347 17.141 -13.726 1768 HG12 VAL 27 2HG1 VAL 27 19.453 16.552 -12.441 1769 HG13 VAL 27 3HG1 VAL 27 17.811 17.163 -12.005 1770 HG21 VAL 27 3HG2 VAL 27 17.475 14.828 -10.766 1771 HG22 VAL 27 1HG2 VAL 27 19.112 14.379 -11.342 1772 HG23 VAL 27 2HG2 VAL 27 17.721 13.313 -11.718 1773 H GLU 28 H GLU 28 16.713 14.059 -15.455 1774 HA GLU 28 HA GLU 28 17.019 16.218 -17.186 1775 HB2 GLU 28 2HB GLU 28 17.795 13.781 -17.480 1776 HB3 GLU 28 1HB GLU 28 16.085 13.323 -17.739 1777 HG2 GLU 28 2HG GLU 28 16.050 14.766 -19.829 1778 HG3 GLU 28 1HG GLU 28 17.796 15.132 -19.561 1779 H ALA 29 H ALA 29 14.211 14.104 -16.432 1780 HA ALA 29 HA ALA 29 12.538 15.068 -18.411 1781 HB1 ALA 29 1HB ALA 29 11.845 13.776 -15.692 1782 HB2 ALA 29 2HB ALA 29 12.090 12.913 -17.252 1783 HB3 ALA 29 3HB ALA 29 10.670 13.989 -17.043 1784 H GLU 30 H GLU 30 13.019 16.116 -15.035 1785 HA GLU 30 HA GLU 30 10.738 17.826 -15.167 1786 HB2 GLU 30 2HB GLU 30 11.059 18.207 -12.928 1787 HB3 GLU 30 1HB GLU 30 11.851 16.627 -13.119 1788 HG2 GLU 30 2HG GLU 30 13.492 17.687 -11.881 1789 HG3 GLU 30 1HG GLU 30 14.082 18.210 -13.480 1790 H ARG 31 H ARG 31 14.191 18.105 -15.854 1791 HA ARG 31 HA ARG 31 14.292 20.917 -15.704 1792 HB2 ARG 31 2HB ARG 31 16.206 18.761 -16.202 1793 HB3 ARG 31 1HB ARG 31 16.412 19.972 -17.475 1794 HG2 ARG 31 2HG ARG 31 17.922 20.616 -15.792 1795 HG3 ARG 31 1HG ARG 31 16.549 21.781 -15.735 1796 HD2 ARG 31 2HD ARG 31 15.619 20.346 -13.746 1797 HD3 ARG 31 1HD ARG 31 17.188 19.479 -13.755 1798 HE ARG 31 HE ARG 31 18.360 21.532 -13.252 1799 HH11 ARG 31 1HH2 ARG 31 14.731 21.796 -12.853 1800 HH12 ARG 31 2HH2 ARG 31 14.815 23.313 -12.155 1801 HH21 ARG 31 1HH1 ARG 31 18.366 23.813 -12.401 1802 HH22 ARG 31 2HH1 ARG 31 16.884 24.595 -12.073 1803 H GLY 32 H GLY 32 12.622 21.819 -16.959 1804 HA2 GLY 32 2HA GLY 32 12.850 22.889 -19.223 1805 HA3 GLY 32 1HA GLY 32 12.634 21.193 -19.826 1806 H ALA 33 H ALA 33 10.943 20.634 -17.338 1807 HA ALA 33 HA ALA 33 8.496 21.331 -18.761 1808 HB1 ALA 33 1HB ALA 33 7.510 19.585 -17.134 1809 HB2 ALA 33 2HB ALA 33 9.200 19.377 -16.516 1810 HB3 ALA 33 3HB ALA 33 8.809 18.948 -18.221 1811 HA PRO 34 HA PRO 34 7.562 24.205 -15.562 1812 HB2 PRO 34 2HB PRO 34 4.743 24.251 -15.484 1813 HB3 PRO 34 1HB PRO 34 5.706 24.913 -16.862 1814 HG2 PRO 34 2HG PRO 34 4.442 22.127 -16.634 1815 HG3 PRO 34 1HG PRO 34 4.320 23.300 -18.018 1816 HD2 PRO 34 2HD PRO 34 6.154 21.232 -18.018 1817 HD3 PRO 34 1HD PRO 34 6.613 22.862 -18.677 1818 H GLY 35 H GLY 35 6.915 24.466 -13.309 1819 HA2 GLY 35 2HA GLY 35 6.106 23.808 -11.318 1820 HA3 GLY 35 1HA GLY 35 5.601 22.228 -12.024 1821 H ALA 36 H ALA 36 8.795 23.348 -12.610 1822 HA ALA 36 HA ALA 36 10.152 21.191 -11.846 1823 HB1 ALA 36 1HB ALA 36 12.178 22.610 -11.936 1824 HB2 ALA 36 2HB ALA 36 11.187 24.090 -11.650 1825 HB3 ALA 36 3HB ALA 36 11.018 23.164 -13.182 1826 H ALA 37 H ALA 37 11.240 20.411 -10.108 1827 HA ALA 37 HA ALA 37 11.252 21.829 -7.566 1828 HB1 ALA 37 1HB ALA 37 10.061 20.000 -6.310 1829 HB2 ALA 37 2HB ALA 37 9.723 19.155 -7.872 1830 HB3 ALA 37 3HB ALA 37 8.974 20.754 -7.531 1831 H LEU 38 H LEU 38 12.249 19.141 -9.677 1832 HA LEU 38 HA LEU 38 13.811 17.960 -7.482 1833 HB2 LEU 38 2HB LEU 38 12.020 16.584 -8.554 1834 HB3 LEU 38 1HB LEU 38 12.819 16.742 -10.137 1835 HG LEU 38 HG LEU 38 14.334 15.544 -7.751 1836 HD11 LEU 38 1HD1 LEU 38 12.126 14.398 -7.730 1837 HD12 LEU 38 2HD1 LEU 38 13.412 13.288 -8.330 1838 HD13 LEU 38 3HD1 LEU 38 12.266 14.043 -9.487 1839 HD21 LEU 38 3HD2 LEU 38 15.624 15.828 -9.905 1840 HD22 LEU 38 1HD2 LEU 38 14.359 14.895 -10.777 1841 HD23 LEU 38 2HD2 LEU 38 15.372 14.093 -9.524 1842 H ILE 39 H ILE 39 16.205 17.442 -8.088 1843 HA ILE 39 HA ILE 39 17.198 18.675 -10.440 1844 HB ILE 39 HB ILE 39 18.816 20.135 -8.994 1845 HG12 ILE 39 2HG1 ILE 39 16.537 19.904 -6.914 1846 HG13 ILE 39 1HG1 ILE 39 18.141 19.099 -6.771 1847 HG21 ILE 39 1HG2 ILE 39 17.460 22.114 -9.135 1848 HG22 ILE 39 2HG2 ILE 39 15.938 21.176 -8.973 1849 HG23 ILE 39 3HG2 ILE 39 16.925 21.034 -10.473 1850 HD11 ILE 39 3HD ILE 39 17.652 22.153 -6.873 1851 HD12 ILE 39 1HD ILE 39 18.116 21.179 -5.436 1852 HD13 ILE 39 2HD ILE 39 19.269 21.353 -6.812 1853 H SER 40 H SER 40 19.774 18.506 -9.977 1854 HA SER 40 HA SER 40 21.533 17.514 -9.325 1855 HB2 SER 40 2HB SER 40 20.015 16.990 -6.733 1856 HB3 SER 40 1HB SER 40 21.804 16.890 -6.920 1857 HG SER 40 1HG SER 40 20.878 18.843 -6.083 1858 H TYR 41 H TYR 41 22.191 15.740 -10.433 1859 HA TYR 41 HA TYR 41 20.819 13.371 -10.480 1860 HB2 TYR 41 2HB TYR 41 23.837 13.580 -10.957 1861 HB3 TYR 41 1HB TYR 41 22.712 12.296 -11.541 1862 HD1 TYR 41 2HD TYR 41 20.939 12.880 -13.268 1863 HD2 TYR 41 1HD TYR 41 23.904 15.711 -11.992 1864 HE1 TYR 41 2HE TYR 41 20.325 14.363 -15.138 1865 HE2 TYR 41 1HE TYR 41 23.270 17.223 -13.824 1866 HH TYR 41 HH TYR 41 21.507 17.712 -15.284 1867 HA PRO 42 HA PRO 42 23.196 11.359 -7.060 1868 HB2 PRO 42 2HB PRO 42 24.217 12.894 -4.898 1869 HB3 PRO 42 1HB PRO 42 25.177 12.259 -6.286 1870 HG2 PRO 42 2HG PRO 42 23.947 15.041 -5.949 1871 HG3 PRO 42 1HG PRO 42 25.603 14.600 -6.546 1872 HD2 PRO 42 2HD PRO 42 23.590 15.234 -8.291 1873 HD3 PRO 42 1HD PRO 42 24.732 13.867 -8.683 1874 H ASP 43 H ASP 43 21.148 14.202 -6.457 1875 HA ASP 43 HA ASP 43 20.057 13.116 -4.006 1876 HB2 ASP 43 2HB ASP 43 19.009 15.372 -5.847 1877 HB3 ASP 43 1HB ASP 43 18.239 14.878 -4.306 1878 H ALA 44 H ALA 44 19.569 13.054 -7.447 1879 HA ALA 44 HA ALA 44 16.955 12.663 -7.790 1880 HB1 ALA 44 1HB ALA 44 19.119 11.118 -9.363 1881 HB2 ALA 44 2HB ALA 44 18.718 12.849 -9.604 1882 HB3 ALA 44 3HB ALA 44 17.469 11.594 -9.927 1883 H ILE 45 H ILE 45 19.341 10.098 -7.068 1884 HA ILE 45 HA ILE 45 17.490 8.004 -7.387 1885 HB ILE 45 HB ILE 45 19.845 7.679 -7.738 1886 HG12 ILE 45 2HG1 ILE 45 18.851 5.966 -5.384 1887 HG13 ILE 45 1HG1 ILE 45 18.363 5.776 -7.104 1888 HG21 ILE 45 1HG2 ILE 45 21.489 7.666 -5.867 1889 HG22 ILE 45 2HG2 ILE 45 20.219 8.179 -4.706 1890 HG23 ILE 45 3HG2 ILE 45 20.742 9.279 -6.029 1891 HD11 ILE 45 3HD ILE 45 21.226 5.446 -5.977 1892 HD12 ILE 45 1HD ILE 45 20.129 4.141 -6.549 1893 HD13 ILE 45 2HD ILE 45 20.779 5.342 -7.723 1894 H TRP 46 H TRP 46 18.070 10.224 -4.715 1895 HA TRP 46 HA TRP 46 16.894 8.425 -2.776 1896 HB2 TRP 46 2HB TRP 46 17.976 11.245 -2.692 1897 HB3 TRP 46 1HB TRP 46 16.711 10.810 -1.524 1898 HD1 TRP 46 HD TRP 46 18.460 11.392 0.259 1899 HE1 TRP 46 1HE TRP 46 20.400 10.085 1.342 1900 HE3 TRP 46 3HE TRP 46 18.750 7.431 -2.985 1901 HZ2 TRP 46 2HZ TRP 46 21.309 7.369 1.297 1902 HZ3 TRP 46 3HZ TRP 46 20.142 5.518 -2.396 1903 HH2 TRP 46 HH TRP 46 21.404 5.475 -0.266 1904 H TRP 47 H TRP 47 15.702 10.638 -5.192 1905 HA TRP 47 HA TRP 47 13.056 10.706 -3.945 1906 HB2 TRP 47 2HB TRP 47 13.656 12.612 -5.474 1907 HB3 TRP 47 1HB TRP 47 14.055 11.456 -6.764 1908 HD1 TRP 47 HD TRP 47 10.720 12.452 -4.785 1909 HE1 TRP 47 1HE TRP 47 8.802 12.127 -6.423 1910 HE3 TRP 47 3HE TRP 47 13.364 10.405 -8.632 1911 HZ2 TRP 47 2HZ TRP 47 8.439 11.122 -9.083 1912 HZ3 TRP 47 3HZ TRP 47 12.155 9.612 -10.626 1913 HH2 TRP 47 HH TRP 47 9.740 9.999 -10.876 1914 H SER 48 H SER 48 14.871 9.000 -6.572 1915 HA SER 48 HA SER 48 12.622 7.724 -7.529 1916 HB2 SER 48 2HB SER 48 15.483 6.634 -7.651 1917 HB3 SER 48 1HB SER 48 14.133 6.320 -8.814 1918 HG SER 48 1HG SER 48 15.792 7.964 -9.235 1919 H VAL 49 H VAL 49 14.839 6.789 -4.901 1920 HA VAL 49 HA VAL 49 14.103 4.112 -4.875 1921 HB VAL 49 HB VAL 49 16.157 5.047 -3.891 1922 HG11 VAL 49 1HG1 VAL 49 15.120 6.984 -2.626 1923 HG12 VAL 49 2HG1 VAL 49 16.187 5.948 -1.614 1924 HG13 VAL 49 3HG1 VAL 49 14.404 5.807 -1.463 1925 HG21 VAL 49 3HG2 VAL 49 16.140 3.359 -2.003 1926 HG22 VAL 49 1HG2 VAL 49 15.413 2.726 -3.531 1927 HG23 VAL 49 2HG2 VAL 49 14.355 3.230 -2.177 1928 H GLU 50 H GLU 50 12.809 6.877 -2.979 1929 HA GLU 50 HA GLU 50 10.867 5.364 -1.652 1930 HB2 GLU 50 2HB GLU 50 9.997 7.634 -0.952 1931 HB3 GLU 50 1HB GLU 50 11.744 7.386 -0.674 1932 HG2 GLU 50 2HG GLU 50 12.233 8.623 -2.851 1933 HG3 GLU 50 1HG GLU 50 10.481 9.036 -2.969 1934 H THR 51 H THR 51 10.971 6.589 -4.862 1935 HA THR 51 HA THR 51 8.097 6.852 -5.144 1936 HB THR 51 HB THR 51 10.423 6.962 -7.131 1937 HG1 THR 51 1HG THR 51 10.370 8.734 -5.870 1938 HG21 THR 51 3HG2 THR 51 8.679 7.926 -8.726 1939 HG22 THR 51 1HG2 THR 51 7.389 7.393 -7.582 1940 HG23 THR 51 2HG2 THR 51 8.437 6.179 -8.386 1941 H ALA 52 H ALA 52 10.668 4.431 -5.746 1942 HA ALA 52 HA ALA 52 8.945 2.731 -7.276 1943 HB1 ALA 52 1HB ALA 52 10.763 1.057 -7.042 1944 HB2 ALA 52 2HB ALA 52 11.547 2.062 -5.761 1945 HB3 ALA 52 3HB ALA 52 11.471 2.659 -7.461 1946 H THR 53 H THR 53 9.709 3.176 -3.778 1947 HA THR 53 HA THR 53 8.169 0.824 -3.122 1948 HB THR 53 HB THR 53 8.856 1.645 -0.746 1949 HG1 THR 53 1HG THR 53 10.938 2.859 -1.055 1950 HG21 THR 53 3HG2 THR 53 9.863 -0.283 -2.007 1951 HG22 THR 53 1HG2 THR 53 11.130 0.623 -1.102 1952 HG23 THR 53 2HG2 THR 53 10.970 0.845 -2.882 1953 H THR 54 H THR 54 7.271 3.675 -4.269 1954 HA THR 54 HA THR 54 5.572 4.989 -4.163 1955 HB THR 54 HB THR 54 3.299 3.803 -3.750 1956 HG1 THR 54 1HG THR 54 4.462 2.081 -2.561 1957 HG21 THR 54 3HG2 THR 54 5.369 2.804 -5.834 1958 HG22 THR 54 1HG2 THR 54 4.347 4.286 -5.976 1959 HG23 THR 54 2HG2 THR 54 3.577 2.658 -5.959 1960 H VAL 55 H VAL 55 6.924 5.879 -2.154 1961 HA VAL 55 HA VAL 55 4.880 6.313 -0.067 1962 HB VAL 55 HB VAL 55 7.901 6.628 0.301 1963 HG11 VAL 55 1HG1 VAL 55 6.360 8.028 1.782 1964 HG12 VAL 55 2HG1 VAL 55 7.192 6.746 2.711 1965 HG13 VAL 55 3HG1 VAL 55 5.469 6.532 2.236 1966 HG21 VAL 55 3HG2 VAL 55 6.000 4.264 0.898 1967 HG22 VAL 55 1HG2 VAL 55 7.647 4.440 1.599 1968 HG23 VAL 55 2HG2 VAL 55 7.455 4.253 -0.164 1969 H GLY 56 H GLY 56 7.871 8.073 -1.157 1970 HA2 GLY 56 2HA GLY 56 7.972 10.120 -2.127 1971 HA3 GLY 56 1HA GLY 56 6.185 10.329 -1.950 1972 H TYR 57 H TYR 57 5.479 10.326 0.449 1973 HA TYR 57 HA TYR 57 5.534 10.911 2.530 1974 HB2 TYR 57 2HB TYR 57 8.084 10.047 2.462 1975 HB3 TYR 57 1HB TYR 57 8.457 11.805 2.604 1976 HD1 TYR 57 1HD TYR 57 6.995 13.045 4.503 1977 HD2 TYR 57 2HD TYR 57 7.924 8.839 4.444 1978 HE1 TYR 57 1HE TYR 57 6.536 12.917 6.871 1979 HE2 TYR 57 2HE TYR 57 7.492 8.723 6.876 1980 HH TYR 57 HH TYR 57 6.128 11.499 8.685 1981 H GLY 58 H GLY 58 7.439 12.981 0.392 1982 HA2 GLY 58 2HA GLY 58 5.991 14.947 -0.207 1983 HA3 GLY 58 1HA GLY 58 6.142 15.386 1.537 1984 H ASP 59 H ASP 59 8.924 13.816 0.208 1985 HA ASP 59 HA ASP 59 10.452 16.060 0.900 1986 HB2 ASP 59 2HB ASP 59 10.893 13.259 0.244 1987 HB3 ASP 59 1HB ASP 59 11.961 14.196 -0.820 1988 H ARG 60 H ARG 60 9.821 14.505 -2.320 1989 HA ARG 60 HA ARG 60 10.340 17.029 -3.664 1990 HB2 ARG 60 2HB ARG 60 11.649 14.291 -4.243 1991 HB3 ARG 60 1HB ARG 60 11.620 15.610 -5.461 1992 HG2 ARG 60 2HG ARG 60 13.169 16.939 -4.244 1993 HG3 ARG 60 1HG ARG 60 12.856 16.102 -2.698 1994 HD2 ARG 60 2HD ARG 60 14.297 14.759 -5.088 1995 HD3 ARG 60 1HD ARG 60 15.139 15.544 -3.701 1996 HE ARG 60 HE ARG 60 13.619 12.968 -3.643 1997 HH11 ARG 60 1HH2 ARG 60 15.104 15.591 -1.596 1998 HH12 ARG 60 2HH2 ARG 60 14.618 14.738 -0.182 1999 HH21 ARG 60 1HH1 ARG 60 13.211 11.905 -1.539 2000 HH22 ARG 60 2HH1 ARG 60 13.846 12.649 -0.178 2001 H TYR 61 H TYR 61 9.135 16.859 -5.862 2002 HA TYR 61 HA TYR 61 7.367 14.584 -5.968 2003 HB2 TYR 61 2HB TYR 61 5.445 16.161 -6.645 2004 HB3 TYR 61 1HB TYR 61 5.866 16.136 -4.901 2005 HD1 TYR 61 1HD TYR 61 6.151 18.149 -8.031 2006 HD2 TYR 61 2HD TYR 61 6.646 18.058 -3.760 2007 HE1 TYR 61 1HE TYR 61 6.297 20.597 -8.007 2008 HE2 TYR 61 2HE TYR 61 6.783 20.512 -3.719 2009 HH TYR 61 HH TYR 61 6.127 22.440 -6.656 2010 HA PRO 62 HA PRO 62 8.791 15.322 -10.126 2011 HB2 PRO 62 2HB PRO 62 6.985 13.799 -11.624 2012 HB3 PRO 62 1HB PRO 62 8.175 13.017 -10.510 2013 HG2 PRO 62 2HG PRO 62 5.227 13.707 -9.984 2014 HG3 PRO 62 1HG PRO 62 6.081 12.136 -9.656 2015 HD2 PRO 62 2HD PRO 62 5.685 14.116 -7.724 2016 HD3 PRO 62 1HD PRO 62 7.161 13.043 -7.721 2017 H VAL 63 H VAL 63 8.015 16.270 -12.273 2018 HA VAL 63 HA VAL 63 6.036 18.297 -11.763 2019 HB VAL 63 HB VAL 63 6.793 19.225 -13.916 2020 HG11 VAL 63 1HG1 VAL 63 8.011 19.627 -11.732 2021 HG12 VAL 63 2HG1 VAL 63 9.075 19.765 -13.178 2022 HG13 VAL 63 3HG1 VAL 63 9.151 18.311 -12.116 2023 HG21 VAL 63 3HG2 VAL 63 8.676 18.113 -15.130 2024 HG22 VAL 63 1HG2 VAL 63 7.206 17.090 -15.165 2025 HG23 VAL 63 2HG2 VAL 63 8.596 16.695 -14.058 2026 H THR 64 H THR 64 4.661 18.742 -14.030 2027 HA THR 64 HA THR 64 2.958 16.460 -14.128 2028 HB THR 64 HB THR 64 1.609 18.122 -15.606 2029 HG1 THR 64 1HG THR 64 2.336 20.304 -15.162 2030 HG21 THR 64 3HG2 THR 64 2.399 18.849 -12.680 2031 HG22 THR 64 1HG2 THR 64 1.168 17.636 -13.170 2032 HG23 THR 64 2HG2 THR 64 0.899 19.372 -13.531 2033 H GLU 65 H GLU 65 4.015 18.565 -16.762 2034 HA GLU 65 HA GLU 65 3.454 17.210 -18.888 2035 HB2 GLU 65 2HB GLU 65 4.650 19.441 -18.884 2036 HB3 GLU 65 1HB GLU 65 6.206 18.584 -18.664 2037 HG2 GLU 65 2HG GLU 65 5.897 17.451 -20.889 2038 HG3 GLU 65 1HG GLU 65 4.296 18.256 -21.070 2039 H GLU 66 H GLU 66 6.733 16.727 -17.479 2040 HA GLU 66 HA GLU 66 6.795 14.151 -18.894 2041 HB2 GLU 66 2HB GLU 66 9.074 15.779 -17.710 2042 HB3 GLU 66 1HB GLU 66 9.228 14.260 -18.663 2043 HG2 GLU 66 2HG GLU 66 7.992 16.884 -19.779 2044 HG3 GLU 66 1HG GLU 66 9.714 16.409 -19.918 2045 H GLY 67 H GLY 67 7.900 15.482 -15.734 2046 HA2 GLY 67 2HA GLY 67 9.001 13.390 -14.615 2047 HA3 GLY 67 1HA GLY 67 8.018 14.592 -13.700 2048 H ARG 68 H ARG 68 5.438 13.872 -14.569 2049 HA ARG 68 HA ARG 68 5.130 11.660 -12.859 2050 HB2 ARG 68 2HB ARG 68 3.630 13.748 -13.110 2051 HB3 ARG 68 1HB ARG 68 2.828 12.836 -14.437 2052 HG2 ARG 68 2HG ARG 68 2.280 11.011 -12.852 2053 HG3 ARG 68 1HG ARG 68 3.286 11.752 -11.568 2054 HD2 ARG 68 2HD ARG 68 0.721 13.033 -12.744 2055 HD3 ARG 68 1HD ARG 68 0.768 12.058 -11.247 2056 HE ARG 68 HE ARG 68 1.516 14.854 -11.546 2057 HH11 ARG 68 1HH2 ARG 68 2.576 12.111 -9.523 2058 HH12 ARG 68 2HH2 ARG 68 1.885 12.765 -8.074 2059 HH21 ARG 68 1HH1 ARG 68 0.903 15.928 -9.414 2060 HH22 ARG 68 2HH1 ARG 68 0.766 14.845 -8.113 2061 H LYS 69 H LYS 69 5.271 11.864 -16.443 2062 HA LYS 69 HA LYS 69 4.062 9.236 -16.735 2063 HB2 LYS 69 2HB LYS 69 5.527 11.089 -18.688 2064 HB3 LYS 69 1HB LYS 69 5.420 9.336 -19.024 2065 HG2 LYS 69 2HG LYS 69 3.584 10.042 -20.177 2066 HG3 LYS 69 1HG LYS 69 2.923 9.412 -18.646 2067 HD2 LYS 69 2HD LYS 69 1.691 11.285 -18.611 2068 HD3 LYS 69 1HD LYS 69 3.151 12.135 -18.023 2069 HE2 LYS 69 2HE LYS 69 2.248 11.828 -20.995 2070 HE3 LYS 69 1HE LYS 69 2.009 13.295 -19.970 2071 HZ1 LYS 69 3HZ LYS 69 4.664 12.169 -20.833 2072 HZ2 LYS 69 1HZ LYS 69 4.398 13.520 -19.802 2073 HZ3 LYS 69 2HZ LYS 69 3.908 13.576 -21.368 2074 H VAL 70 H VAL 70 7.295 10.665 -16.303 2075 HA VAL 70 HA VAL 70 8.655 8.201 -16.689 2076 HB VAL 70 HB VAL 70 9.551 10.639 -15.061 2077 HG11 VAL 70 1HG1 VAL 70 11.860 9.746 -15.575 2078 HG12 VAL 70 2HG1 VAL 70 11.121 8.288 -16.340 2079 HG13 VAL 70 3HG1 VAL 70 10.916 8.590 -14.576 2080 HG21 VAL 70 3HG2 VAL 70 9.834 9.898 -18.058 2081 HG22 VAL 70 1HG2 VAL 70 10.751 11.212 -17.247 2082 HG23 VAL 70 2HG2 VAL 70 8.965 11.325 -17.384 2083 H ALA 71 H ALA 71 7.560 9.982 -13.741 2084 HA ALA 71 HA ALA 71 8.391 8.115 -11.880 2085 HB1 ALA 71 1HB ALA 71 5.919 9.957 -11.657 2086 HB2 ALA 71 2HB ALA 71 7.603 10.475 -11.305 2087 HB3 ALA 71 3HB ALA 71 6.824 9.208 -10.289 2088 H GLU 72 H GLU 72 5.206 8.414 -13.554 2089 HA GLU 72 HA GLU 72 3.678 6.596 -12.242 2090 HB2 GLU 72 2HB GLU 72 2.845 8.016 -14.187 2091 HB3 GLU 72 1HB GLU 72 3.895 7.085 -15.294 2092 HG2 GLU 72 2HG GLU 72 2.398 5.018 -14.700 2093 HG3 GLU 72 1HG GLU 72 1.321 6.185 -13.855 2094 H GLN 73 H GLN 73 6.025 6.057 -14.904 2095 HA GLN 73 HA GLN 73 5.410 3.342 -15.160 2096 HB2 GLN 73 2HB GLN 73 6.581 4.732 -16.931 2097 HB3 GLN 73 1HB GLN 73 8.073 4.663 -15.937 2098 HG2 GLN 73 2HG GLN 73 8.084 2.143 -16.137 2099 HG3 GLN 73 1HG GLN 73 6.525 2.213 -17.037 2100 HE21 GLN 73 1HE2 GLN 73 7.336 1.317 -18.994 2101 HE22 GLN 73 2HE2 GLN 73 8.448 2.160 -20.020 2102 H VAL 74 H VAL 74 7.733 5.057 -13.069 2103 HA VAL 74 HA VAL 74 9.181 2.744 -12.295 2104 HB VAL 74 HB VAL 74 8.787 5.348 -10.713 2105 HG11 VAL 74 1HG1 VAL 74 11.004 4.713 -9.677 2106 HG12 VAL 74 2HG1 VAL 74 10.964 3.141 -10.562 2107 HG13 VAL 74 3HG1 VAL 74 9.731 3.508 -9.303 2108 HG21 VAL 74 3HG2 VAL 74 10.949 6.033 -11.776 2109 HG22 VAL 74 1HG2 VAL 74 9.670 5.814 -13.005 2110 HG23 VAL 74 2HG2 VAL 74 10.923 4.542 -12.800 2111 H MET 75 H MET 75 6.365 4.511 -10.948 2112 HA MET 75 HA MET 75 6.137 3.083 -8.573 2113 HB2 MET 75 2HB MET 75 3.915 4.334 -10.306 2114 HB3 MET 75 1HB MET 75 3.682 3.731 -8.627 2115 HG2 MET 75 2HG MET 75 5.305 5.360 -7.755 2116 HG3 MET 75 1HG MET 75 5.629 5.987 -9.395 2117 HE1 MET 75 3HE MET 75 3.706 8.754 -7.348 2118 HE2 MET 75 1HE MET 75 5.183 8.373 -8.304 2119 HE3 MET 75 2HE MET 75 4.845 7.498 -6.774 2120 H LYS 76 H LYS 76 4.647 2.467 -11.791 2121 HA LYS 76 HA LYS 76 3.121 0.282 -10.961 2122 HB2 LYS 76 2HB LYS 76 2.981 1.529 -13.248 2123 HB3 LYS 76 1HB LYS 76 4.369 0.518 -13.761 2124 HG2 LYS 76 2HG LYS 76 2.833 -1.538 -13.037 2125 HG3 LYS 76 1HG LYS 76 1.506 -0.327 -13.013 2126 HD2 LYS 76 2HD LYS 76 2.276 0.250 -15.467 2127 HD3 LYS 76 1HD LYS 76 3.255 -1.259 -15.376 2128 HE2 LYS 76 2HE LYS 76 0.173 -0.969 -15.213 2129 HE3 LYS 76 1HE LYS 76 1.139 -1.739 -16.526 2130 HZ1 LYS 76 3HZ LYS 76 1.830 -3.438 -14.746 2131 HZ2 LYS 76 1HZ LYS 76 0.163 -3.368 -15.246 2132 HZ3 LYS 76 2HZ LYS 76 0.627 -2.745 -13.772 2133 H ALA 77 H ALA 77 6.466 0.474 -12.220 2134 HA ALA 77 HA ALA 77 6.875 -2.298 -12.415 2135 HB1 ALA 77 1HB ALA 77 8.382 -0.611 -13.536 2136 HB2 ALA 77 2HB ALA 77 9.317 -1.743 -12.487 2137 HB3 ALA 77 3HB ALA 77 8.953 -0.070 -11.914 2138 H GLY 78 H GLY 78 7.258 0.018 -9.731 2139 HA2 GLY 78 2HA GLY 78 8.666 -1.678 -8.014 2140 HA3 GLY 78 1HA GLY 78 7.647 -0.249 -7.580 2141 H ILE 79 H ILE 79 5.145 -1.028 -8.329 2142 HA ILE 79 HA ILE 79 4.367 -2.662 -6.213 2143 HB ILE 79 HB ILE 79 2.865 -1.841 -8.742 2144 HG12 ILE 79 2HG1 ILE 79 2.801 -0.707 -5.862 2145 HG13 ILE 79 1HG1 ILE 79 3.724 0.025 -7.200 2146 HG21 ILE 79 1HG2 ILE 79 1.759 -3.857 -7.696 2147 HG22 ILE 79 2HG2 ILE 79 0.769 -2.392 -7.437 2148 HG23 ILE 79 3HG2 ILE 79 1.775 -3.034 -6.093 2149 HD11 ILE 79 3HD ILE 79 0.651 -0.262 -7.067 2150 HD12 ILE 79 1HD ILE 79 1.622 1.240 -6.921 2151 HD13 ILE 79 2HD ILE 79 1.566 0.361 -8.496 2152 H GLU 80 H GLU 80 4.850 -3.409 -9.705 2153 HA GLU 80 HA GLU 80 3.871 -6.018 -9.569 2154 HB2 GLU 80 2HB GLU 80 5.940 -4.822 -11.497 2155 HB3 GLU 80 1HB GLU 80 5.229 -6.461 -11.674 2156 HG2 GLU 80 2HG GLU 80 2.929 -5.466 -11.856 2157 HG3 GLU 80 1HG GLU 80 3.628 -3.822 -11.732 2158 H VAL 81 H VAL 81 7.092 -4.751 -8.684 2159 HA VAL 81 HA VAL 81 8.355 -7.285 -8.572 2160 HB VAL 81 HB VAL 81 8.975 -4.583 -7.298 2161 HG11 VAL 81 1HG1 VAL 81 11.252 -5.582 -6.715 2162 HG12 VAL 81 2HG1 VAL 81 10.577 -7.216 -7.040 2163 HG13 VAL 81 3HG1 VAL 81 9.913 -6.207 -5.702 2164 HG21 VAL 81 3HG2 VAL 81 10.376 -6.255 -9.503 2165 HG22 VAL 81 1HG2 VAL 81 10.812 -4.587 -8.979 2166 HG23 VAL 81 2HG2 VAL 81 9.250 -4.889 -9.817 2167 H PHE 82 H PHE 82 6.837 -5.223 -5.997 2168 HA PHE 82 HA PHE 82 7.381 -7.136 -3.994 2169 HB2 PHE 82 2HB PHE 82 5.294 -4.856 -4.055 2170 HB3 PHE 82 1HB PHE 82 5.654 -5.857 -2.594 2171 HD1 PHE 82 2HD PHE 82 8.194 -6.094 -1.960 2172 HD2 PHE 82 1HD PHE 82 6.599 -2.888 -4.347 2173 HE1 PHE 82 2HE PHE 82 10.180 -4.717 -1.444 2174 HE2 PHE 82 1HE PHE 82 8.587 -1.524 -3.847 2175 HZ PHE 82 HZ PHE 82 10.390 -2.434 -2.391 2176 H ALA 83 H ALA 83 4.542 -6.601 -6.087 2177 HA ALA 83 HA ALA 83 2.886 -8.473 -4.841 2178 HB1 ALA 83 1HB ALA 83 2.047 -6.799 -6.507 2179 HB2 ALA 83 2HB ALA 83 1.587 -8.472 -6.983 2180 HB3 ALA 83 3HB ALA 83 2.963 -7.642 -7.809 2181 H LEU 84 H LEU 84 5.540 -8.902 -7.192 2182 HA LEU 84 HA LEU 84 4.791 -11.467 -8.059 2183 HB2 LEU 84 2HB LEU 84 6.365 -9.955 -9.254 2184 HB3 LEU 84 1HB LEU 84 7.598 -10.198 -7.986 2185 HG LEU 84 HG LEU 84 6.447 -12.630 -9.432 2186 HD11 LEU 84 1HD1 LEU 84 8.043 -12.350 -11.335 2187 HD12 LEU 84 2HD1 LEU 84 8.527 -10.733 -10.699 2188 HD13 LEU 84 3HD1 LEU 84 6.842 -11.009 -11.273 2189 HD21 LEU 84 3HD2 LEU 84 9.314 -11.937 -8.479 2190 HD22 LEU 84 1HD2 LEU 84 8.814 -13.480 -9.262 2191 HD23 LEU 84 2HD2 LEU 84 8.162 -13.043 -7.647 2192 H VAL 85 H VAL 85 6.694 -10.291 -5.314 2193 HA VAL 85 HA VAL 85 7.872 -12.713 -4.587 2194 HB VAL 85 HB VAL 85 7.176 -10.249 -2.911 2195 HG11 VAL 85 1HG1 VAL 85 7.660 -12.091 -1.354 2196 HG12 VAL 85 2HG1 VAL 85 9.102 -11.032 -1.436 2197 HG13 VAL 85 3HG1 VAL 85 9.089 -12.611 -2.312 2198 HG21 VAL 85 3HG2 VAL 85 9.740 -11.080 -4.454 2199 HG22 VAL 85 1HG2 VAL 85 9.583 -9.642 -3.383 2200 HG23 VAL 85 2HG2 VAL 85 8.631 -9.738 -4.891 2201 H THR 86 H THR 86 4.571 -11.591 -4.239 2202 HA THR 86 HA THR 86 3.745 -12.975 -2.058 2203 HB THR 86 HB THR 86 1.998 -12.716 -4.537 2204 HG1 THR 86 1HG THR 86 2.664 -10.762 -4.416 2205 HG21 THR 86 3HG2 THR 86 1.492 -12.477 -1.472 2206 HG22 THR 86 1HG2 THR 86 0.992 -13.868 -2.504 2207 HG23 THR 86 2HG2 THR 86 0.255 -12.248 -2.758 2208 H ALA 87 H ALA 87 4.743 -14.365 -5.142 2209 HA ALA 87 HA ALA 87 3.378 -16.825 -4.905 2210 HB1 ALA 87 1HB ALA 87 6.139 -16.245 -6.162 2211 HB2 ALA 87 2HB ALA 87 4.563 -16.056 -6.997 2212 HB3 ALA 87 3HB ALA 87 5.109 -17.695 -6.485 2213 H ALA 88 H ALA 88 6.253 -15.539 -3.280 2214 HA ALA 88 HA ALA 88 7.045 -18.166 -2.314 2215 HB1 ALA 88 1HB ALA 88 8.233 -15.377 -1.766 2216 HB2 ALA 88 2HB ALA 88 8.888 -16.549 -2.968 2217 HB3 ALA 88 3HB ALA 88 8.934 -16.937 -1.208 2218 H LEU 89 H LEU 89 5.007 -15.523 -1.417 2219 HA LEU 89 HA LEU 89 5.063 -16.330 1.392 2220 HB2 LEU 89 2HB LEU 89 3.365 -14.251 -0.130 2221 HB3 LEU 89 1HB LEU 89 3.008 -14.756 1.545 2222 HG LEU 89 HG LEU 89 4.124 -12.669 1.613 2223 HD11 LEU 89 1HD1 LEU 89 6.112 -14.817 2.607 2224 HD12 LEU 89 2HD1 LEU 89 4.596 -14.315 3.447 2225 HD13 LEU 89 3HD1 LEU 89 5.931 -13.132 3.204 2226 HD21 LEU 89 3HD2 LEU 89 5.390 -12.681 -0.512 2227 HD22 LEU 89 1HD2 LEU 89 6.562 -13.878 0.162 2228 HD23 LEU 89 2HD2 LEU 89 6.432 -12.233 0.879 2229 H ALA 90 H ALA 90 3.093 -16.635 -1.562 2230 HA ALA 90 HA ALA 90 0.888 -17.775 -0.283 2231 HB1 ALA 90 1HB ALA 90 1.765 -18.061 -3.217 2232 HB2 ALA 90 2HB ALA 90 0.756 -16.725 -2.552 2233 HB3 ALA 90 3HB ALA 90 0.117 -18.406 -2.556 2234 H THR 91 H THR 91 4.007 -19.195 -1.055 2235 HA THR 91 HA THR 91 3.056 -21.887 -1.132 2236 HB THR 91 HB THR 91 5.564 -22.321 -0.412 2237 HG1 THR 91 1HG THR 91 5.992 -20.150 0.307 2238 HG21 THR 91 3HG2 THR 91 4.939 -20.833 -3.049 2239 HG22 THR 91 1HG2 THR 91 4.600 -22.577 -2.731 2240 HG23 THR 91 2HG2 THR 91 6.297 -21.985 -2.743 2241 H ASP 92 H ASP 92 3.430 -19.479 1.418 2242 HA ASP 92 HA ASP 92 4.598 -21.430 3.137 2243 HB2 ASP 92 2HB ASP 92 4.085 -18.463 3.442 2244 HB3 ASP 92 1HB ASP 92 4.512 -19.493 4.860 2245 H PHE 93 H PHE 93 1.364 -20.770 2.419 2246 HA PHE 93 HA PHE 93 0.554 -21.991 4.944 2247 HB2 PHE 93 2HB PHE 93 -1.645 -21.855 4.383 2248 HB3 PHE 93 1HB PHE 93 -0.992 -20.306 3.767 2249 HD1 PHE 93 1HD PHE 93 -0.473 -20.265 1.174 2250 HD2 PHE 93 2HD PHE 93 -2.964 -23.219 3.051 2251 HE1 PHE 93 1HE PHE 93 -1.481 -20.807 -1.012 2252 HE2 PHE 93 2HE PHE 93 -3.977 -23.757 0.865 2253 HZ PHE 93 HZ PHE 93 -3.238 -22.555 -1.175 2254 H VAL 94 H VAL 94 1.724 -22.967 1.809 2255 HA VAL 94 HA VAL 94 0.293 -25.444 1.709 2256 HB VAL 94 HB VAL 94 2.722 -24.630 0.052 2257 HG11 VAL 94 1HG1 VAL 94 1.679 -26.235 -1.593 2258 HG12 VAL 94 2HG1 VAL 94 0.382 -26.620 -0.402 2259 HG13 VAL 94 3HG1 VAL 94 2.092 -27.063 -0.051 2260 HG21 VAL 94 3HG2 VAL 94 1.025 -23.805 -1.612 2261 HG22 VAL 94 1HG2 VAL 94 0.984 -22.821 -0.124 2262 HG23 VAL 94 2HG2 VAL 94 -0.292 -24.057 -0.411 2263 H ARG 95 H ARG 95 3.471 -24.213 2.707 2264 HA ARG 95 HA ARG 95 4.857 -26.534 3.152 2265 HB2 ARG 95 2HB ARG 95 4.826 -24.065 5.005 2266 HB3 ARG 95 1HB ARG 95 6.089 -25.343 4.999 2267 HG2 ARG 95 2HG ARG 95 6.764 -24.694 2.686 2268 HG3 ARG 95 1HG ARG 95 5.503 -23.408 2.693 2269 HD2 ARG 95 2HD ARG 95 6.646 -22.448 4.816 2270 HD3 ARG 95 1HD ARG 95 8.008 -23.587 4.535 2271 HE ARG 95 HE ARG 95 7.113 -21.242 2.861 2272 HH11 ARG 95 1HH2 ARG 95 9.753 -23.728 3.414 2273 HH12 ARG 95 2HH2 ARG 95 10.854 -22.812 2.487 2274 HH21 ARG 95 1HH1 ARG 95 8.627 -20.107 1.804 2275 HH22 ARG 95 2HH1 ARG 95 10.159 -20.801 1.298 2276 H ARG 96 H ARG 96 2.017 -25.477 4.895 2277 HA ARG 96 HA ARG 96 2.539 -26.507 7.410 2278 HB2 ARG 96 2HB ARG 96 0.199 -26.422 7.895 2279 HB3 ARG 96 1HB ARG 96 0.507 -25.071 6.751 2280 HG2 ARG 96 2HG ARG 96 -0.239 -26.712 4.878 2281 HG3 ARG 96 1HG ARG 96 -0.781 -27.816 6.190 2282 HD2 ARG 96 2HD ARG 96 -2.393 -26.058 7.013 2283 HD3 ARG 96 1HD ARG 96 -1.923 -24.983 5.631 2284 HE ARG 96 HE ARG 96 -3.540 -27.458 5.547 2285 HH11 ARG 96 1HH2 ARG 96 -1.414 -25.364 3.456 2286 HH12 ARG 96 2HH2 ARG 96 -2.009 -26.125 2.012 2287 HH21 ARG 96 1HH1 ARG 96 -4.040 -28.510 3.565 2288 HH22 ARG 96 2HH1 ARG 96 -3.488 -27.845 2.058 2289 H GLU 97 H GLU 97 1.773 -28.177 4.383 2290 HA GLU 97 HA GLU 97 0.865 -30.542 5.691 2291 HB2 GLU 97 2HB GLU 97 1.731 -30.173 2.770 2292 HB3 GLU 97 1HB GLU 97 0.833 -31.558 3.475 2293 HG2 GLU 97 2HG GLU 97 -0.969 -29.791 4.224 2294 HG3 GLU 97 1HG GLU 97 -0.138 -28.656 3.096 2295 H GLU 98 H GLU 98 4.009 -29.205 4.896 2296 HA GLU 98 HA GLU 98 5.320 -31.781 5.029 2297 HB2 GLU 98 2HB GLU 98 6.617 -29.012 5.037 2298 HB3 GLU 98 1HB GLU 98 7.397 -30.589 4.678 2299 HG2 GLU 98 2HG GLU 98 5.215 -29.227 2.940 2300 HG3 GLU 98 1HG GLU 98 6.983 -29.120 2.662 2301 H GLU 99 H GLU 99 4.567 -28.926 7.091 2302 HA GLU 99 HA GLU 99 6.219 -29.743 9.215 2303 HB2 GLU 99 2HB GLU 99 3.647 -28.088 9.297 2304 HB3 GLU 99 1HB GLU 99 4.748 -28.304 10.693 2305 HG2 GLU 99 2HG GLU 99 5.677 -27.079 8.009 2306 HG3 GLU 99 1HG GLU 99 4.999 -26.115 9.367 2307 H ARG 100 H ARG 100 2.829 -30.367 8.382 2308 HA ARG 100 HA ARG 100 2.157 -31.810 10.671 2309 HB2 ARG 100 2HB ARG 100 0.622 -30.667 8.981 2310 HB3 ARG 100 1HB ARG 100 0.881 -32.061 7.879 2311 HG2 ARG 100 2HG ARG 100 -0.230 -33.559 9.552 2312 HG3 ARG 100 1HG ARG 100 -0.302 -32.201 10.733 2313 HD2 ARG 100 2HD ARG 100 -1.835 -30.904 9.180 2314 HD3 ARG 100 1HD ARG 100 -1.760 -32.256 8.000 2315 HE ARG 100 HE ARG 100 -3.282 -33.455 9.269 2316 HH11 ARG 100 1HH2 ARG 100 -2.249 -30.592 11.318 2317 HH12 ARG 100 2HH2 ARG 100 -3.240 -31.132 12.629 2318 HH21 ARG 100 1HH1 ARG 100 -4.922 -33.728 10.862 2319 HH22 ARG 100 2HH1 ARG 100 -5.082 -32.567 12.143 2320 H ARG 101 H ARG 101 3.578 -32.907 7.509 2321 HA ARG 101 HA ARG 101 4.075 -35.493 8.822 2322 HB2 ARG 101 2HB ARG 101 3.471 -35.158 5.810 2323 HB3 ARG 101 1HB ARG 101 3.880 -36.681 6.672 2324 HG2 ARG 101 2HG ARG 101 1.638 -36.494 7.880 2325 HG3 ARG 101 1HG ARG 101 1.348 -34.973 6.960 2326 HD2 ARG 101 2HD ARG 101 1.868 -36.476 4.806 2327 HD3 ARG 101 1HD ARG 101 1.513 -37.874 5.876 2328 HE ARG 101 HE ARG 101 -0.270 -35.566 5.106 2329 HH11 ARG 101 1HH2 ARG 101 0.003 -39.004 6.266 2330 HH12 ARG 101 2HH2 ARG 101 -1.625 -39.365 5.954 2331 HH21 ARG 101 1HH1 ARG 101 -2.609 -36.096 4.856 2332 HH22 ARG 101 2HH1 ARG 101 -3.189 -37.629 5.317 2333 H GLY 102 H GLY 102 6.322 -35.253 9.135 2334 HA2 GLY 102 2HA GLY 102 8.381 -35.579 8.248 2335 HA3 GLY 102 1HA GLY 102 7.832 -34.957 6.654 2336 H HIS 103 H HIS 103 7.578 -33.417 9.916 2337 HA HIS 103 HA HIS 103 8.604 -30.985 8.827 2338 HB2 HIS 103 2HB HIS 103 8.806 -30.206 11.260 2339 HB3 HIS 103 1HB HIS 103 7.172 -30.615 10.729 2340 HD1 HIS 103 1HD HIS 103 5.929 -32.313 12.053 2341 HD2 HIS 103 2HD HIS 103 10.032 -32.262 12.988 2342 HE1 HIS 103 1HE HIS 103 6.264 -33.811 14.104 2343 HE2 HIS 103 2HE HIS 103 8.795 -33.708 14.647 2344 H1 SER 1 H SER 1 -4.617 -19.945 15.950 2345 HA SER 1 HA SER 1 -2.356 -20.031 16.575 2346 HB2 SER 1 2HB SER 1 -3.290 -21.839 18.899 2347 HB3 SER 1 1HB SER 1 -1.583 -21.389 18.520 2348 HG SER 1 1HG SER 1 -3.746 -19.670 19.202 2349 H ALA 2 H ALA 2 -3.946 -21.047 14.569 2350 HA ALA 2 HA ALA 2 -3.550 -23.923 14.499 2351 HB1 ALA 2 1HB ALA 2 -5.647 -22.988 13.499 2352 HB2 ALA 2 2HB ALA 2 -4.626 -23.815 12.268 2353 HB3 ALA 2 3HB ALA 2 -4.653 -22.019 12.358 2354 H ASP 3 H ASP 3 -1.237 -23.082 14.966 2355 HA ASP 3 HA ASP 3 0.820 -23.306 14.421 2356 HB2 ASP 3 2HB ASP 3 -0.379 -25.031 12.639 2357 HB3 ASP 3 1HB ASP 3 0.507 -23.989 11.481 2358 H HIS 4 H HIS 4 -0.612 -21.967 11.494 2359 HA HIS 4 HA HIS 4 1.598 -20.250 10.904 2360 HB2 HIS 4 2HB HIS 4 -0.023 -19.247 9.120 2361 HB3 HIS 4 1HB HIS 4 0.467 -20.953 8.963 2362 HD1 HIS 4 1HD HIS 4 -2.729 -19.110 10.394 2363 HD2 HIS 4 2HD HIS 4 -1.456 -22.817 8.827 2364 HE1 HIS 4 1HE HIS 4 -4.709 -20.516 10.188 2365 HE2 HIS 4 2HE HIS 4 -3.912 -22.811 9.309 2366 H GLU 5 H GLU 5 -1.476 -19.764 12.718 2367 HA GLU 5 HA GLU 5 -1.343 -16.941 12.464 2368 HB2 GLU 5 2HB GLU 5 -2.711 -18.550 14.688 2369 HB3 GLU 5 1HB GLU 5 -2.787 -16.784 14.485 2370 HG2 GLU 5 2HG GLU 5 -4.656 -17.047 13.359 2371 HG3 GLU 5 1HG GLU 5 -3.649 -17.510 11.952 2372 H ARG 6 H ARG 6 0.464 -19.197 14.435 2373 HA ARG 6 HA ARG 6 1.127 -17.422 16.548 2374 HB2 ARG 6 2HB ARG 6 2.847 -19.692 15.347 2375 HB3 ARG 6 1HB ARG 6 3.025 -18.959 16.973 2376 HG2 ARG 6 2HG ARG 6 0.813 -19.882 17.651 2377 HG3 ARG 6 1HG ARG 6 0.595 -20.629 16.031 2378 HD2 ARG 6 2HD ARG 6 2.857 -21.242 18.049 2379 HD3 ARG 6 1HD ARG 6 1.446 -22.312 17.687 2380 HE ARG 6 HE ARG 6 2.513 -22.011 15.165 2381 HH11 ARG 6 1HH2 ARG 6 4.622 -22.357 18.034 2382 HH12 ARG 6 2HH2 ARG 6 5.273 -23.870 17.549 2383 HH21 ARG 6 1HH1 ARG 6 3.558 -24.091 14.419 2384 HH22 ARG 6 2HH1 ARG 6 4.522 -24.934 15.518 2385 H GLU 7 H GLU 7 2.539 -18.234 13.360 2386 HA GLU 7 HA GLU 7 4.919 -16.761 13.720 2387 HB2 GLU 7 2HB GLU 7 4.628 -18.675 12.051 2388 HB3 GLU 7 1HB GLU 7 3.536 -17.608 11.105 2389 HG2 GLU 7 2HG GLU 7 5.581 -17.458 9.952 2390 HG3 GLU 7 1HG GLU 7 5.594 -15.964 10.947 2391 H ALA 8 H ALA 8 1.725 -16.098 12.290 2392 HA ALA 8 HA ALA 8 2.296 -13.601 11.195 2393 HB1 ALA 8 1HB ALA 8 -0.190 -13.181 11.331 2394 HB2 ALA 8 2HB ALA 8 -0.364 -14.599 12.419 2395 HB3 ALA 8 3HB ALA 8 0.155 -14.835 10.706 2396 H GLN 9 H GLN 9 1.095 -14.491 14.454 2397 HA GLN 9 HA GLN 9 0.842 -11.855 15.371 2398 HB2 GLN 9 2HB GLN 9 -0.251 -13.899 16.375 2399 HB3 GLN 9 1HB GLN 9 1.352 -14.440 16.977 2400 HG2 GLN 9 2HG GLN 9 1.496 -12.413 18.451 2401 HG3 GLN 9 1HG GLN 9 -0.058 -11.797 17.786 2402 HE21 GLN 9 1HE2 GLN 9 -2.041 -12.842 18.440 2403 HE22 GLN 9 2HE2 GLN 9 -2.099 -14.026 19.705 2404 H LYS 10 H LYS 10 3.529 -14.217 15.465 2405 HA LYS 10 HA LYS 10 5.174 -12.799 17.202 2406 HB2 LYS 10 2HB LYS 10 5.425 -15.266 16.389 2407 HB3 LYS 10 1HB LYS 10 6.122 -14.598 14.882 2408 HG2 LYS 10 2HG LYS 10 8.005 -15.173 16.215 2409 HG3 LYS 10 1HG LYS 10 7.868 -13.404 16.401 2410 HD2 LYS 10 2HD LYS 10 6.376 -14.146 18.581 2411 HD3 LYS 10 1HD LYS 10 7.263 -15.680 18.354 2412 HE2 LYS 10 2HE LYS 10 8.500 -14.352 19.980 2413 HE3 LYS 10 1HE LYS 10 9.472 -14.301 18.454 2414 HZ1 LYS 10 3HZ LYS 10 9.156 -12.168 19.646 2415 HZ2 LYS 10 1HZ LYS 10 7.487 -12.248 19.334 2416 HZ3 LYS 10 2HZ LYS 10 8.569 -12.101 18.029 2417 H ALA 11 H ALA 11 4.707 -12.608 13.690 2418 HA ALA 11 HA ALA 11 6.914 -11.019 13.073 2419 HB1 ALA 11 1HB ALA 11 4.169 -11.084 11.666 2420 HB2 ALA 11 2HB ALA 11 5.530 -12.216 11.340 2421 HB3 ALA 11 3HB ALA 11 5.707 -10.464 10.963 2422 H GLU 12 H GLU 12 3.642 -10.147 14.306 2423 HA GLU 12 HA GLU 12 3.917 -7.400 13.764 2424 HB2 GLU 12 2HB GLU 12 2.249 -8.710 15.991 2425 HB3 GLU 12 1HB GLU 12 2.196 -6.987 15.487 2426 HG2 GLU 12 2HG GLU 12 1.622 -7.916 13.080 2427 HG3 GLU 12 1HG GLU 12 1.222 -9.458 13.925 2428 H GLU 13 H GLU 13 5.028 -9.422 16.464 2429 HA GLU 13 HA GLU 13 5.645 -7.275 18.193 2430 HB2 GLU 13 2HB GLU 13 6.948 -10.056 18.132 2431 HB3 GLU 13 1HB GLU 13 6.910 -8.902 19.514 2432 HG2 GLU 13 2HG GLU 13 4.353 -9.118 19.523 2433 HG3 GLU 13 1HG GLU 13 4.494 -10.399 18.263 2434 H GLU 14 H GLU 14 7.379 -8.898 15.584 2435 HA GLU 14 HA GLU 14 9.976 -7.951 16.091 2436 HB2 GLU 14 2HB GLU 14 9.635 -9.826 14.567 2437 HB3 GLU 14 1HB GLU 14 8.508 -8.863 13.567 2438 HG2 GLU 14 2HG GLU 14 10.441 -9.132 12.291 2439 HG3 GLU 14 1HG GLU 14 10.429 -7.411 12.790 2440 H LEU 15 H LEU 15 7.202 -6.584 14.252 2441 HA LEU 15 HA LEU 15 8.638 -4.472 13.157 2442 HB2 LEU 15 2HB LEU 15 6.346 -5.205 12.413 2443 HB3 LEU 15 1HB LEU 15 5.650 -4.501 13.903 2444 HG LEU 15 HG LEU 15 6.281 -2.229 13.184 2445 HD11 LEU 15 1HD1 LEU 15 8.438 -2.541 12.077 2446 HD12 LEU 15 2HD1 LEU 15 7.311 -1.838 10.876 2447 HD13 LEU 15 3HD1 LEU 15 7.703 -3.594 10.809 2448 HD21 LEU 15 3HD2 LEU 15 4.856 -2.034 11.133 2449 HD22 LEU 15 1HD2 LEU 15 4.132 -3.159 12.339 2450 HD23 LEU 15 2HD2 LEU 15 4.959 -3.811 10.880 2451 H GLN 16 H GLN 16 6.997 -4.771 16.297 2452 HA GLN 16 HA GLN 16 7.189 -2.033 16.982 2453 HB2 GLN 16 2HB GLN 16 6.990 -4.494 18.814 2454 HB3 GLN 16 1HB GLN 16 6.713 -2.785 19.318 2455 HG2 GLN 16 2HG GLN 16 4.779 -2.627 17.715 2456 HG3 GLN 16 1HG GLN 16 5.018 -4.359 17.258 2457 HE21 GLN 16 1HE2 GLN 16 2.563 -3.846 18.262 2458 HE22 GLN 16 2HE2 GLN 16 2.393 -4.309 19.915 2459 H LYS 17 H LYS 17 9.504 -4.638 17.045 2460 HA LYS 17 HA LYS 17 11.241 -3.438 19.009 2461 HB2 LYS 17 2HB LYS 17 11.133 -5.924 18.589 2462 HB3 LYS 17 1HB LYS 17 11.625 -5.634 16.906 2463 HG2 LYS 17 2HG LYS 17 13.830 -4.545 18.046 2464 HG3 LYS 17 1HG LYS 17 13.278 -5.488 19.469 2465 HD2 LYS 17 2HD LYS 17 14.814 -6.905 18.247 2466 HD3 LYS 17 1HD LYS 17 13.160 -7.537 17.898 2467 HE2 LYS 17 2HE LYS 17 13.236 -6.119 15.688 2468 HE3 LYS 17 1HE LYS 17 14.966 -5.790 16.077 2469 HZ1 LYS 17 3HZ LYS 17 13.619 -8.372 15.458 2470 HZ2 LYS 17 1HZ LYS 17 15.252 -8.269 16.106 2471 HZ3 LYS 17 2HZ LYS 17 14.845 -7.570 14.620 2472 H VAL 18 H VAL 18 10.909 -3.629 15.437 2473 HA VAL 18 HA VAL 18 13.317 -2.370 14.800 2474 HB VAL 18 HB VAL 18 10.700 -2.554 13.231 2475 HG11 VAL 18 1HG1 VAL 18 12.020 -0.656 12.305 2476 HG12 VAL 18 2HG1 VAL 18 12.159 -2.067 11.210 2477 HG13 VAL 18 3HG1 VAL 18 13.523 -1.656 12.312 2478 HG21 VAL 18 3HG2 VAL 18 11.923 -4.409 12.052 2479 HG22 VAL 18 1HG2 VAL 18 11.817 -4.766 13.803 2480 HG23 VAL 18 2HG2 VAL 18 13.356 -4.160 13.109 2481 H LEU 19 H LEU 19 10.065 -1.043 15.509 2482 HA LEU 19 HA LEU 19 10.437 1.595 14.922 2483 HB2 LEU 19 2HB LEU 19 9.117 0.439 17.467 2484 HB3 LEU 19 1HB LEU 19 8.951 2.144 16.934 2485 HG LEU 19 HG LEU 19 7.947 -0.299 15.362 2486 HD11 LEU 19 1HD1 LEU 19 5.684 0.462 16.049 2487 HD12 LEU 19 2HD1 LEU 19 6.399 1.810 17.006 2488 HD13 LEU 19 3HD1 LEU 19 6.688 0.103 17.504 2489 HD21 LEU 19 3HD2 LEU 19 8.486 1.542 13.801 2490 HD22 LEU 19 1HD2 LEU 19 7.659 2.731 14.867 2491 HD23 LEU 19 2HD2 LEU 19 6.704 1.463 14.024 2492 H GLU 20 H GLU 20 11.499 -0.132 17.885 2493 HA GLU 20 HA GLU 20 12.344 2.250 19.165 2494 HB2 GLU 20 2HB GLU 20 13.071 -0.656 19.836 2495 HB3 GLU 20 1HB GLU 20 13.404 0.807 20.827 2496 HG2 GLU 20 2HG GLU 20 10.862 1.249 20.884 2497 HG3 GLU 20 1HG GLU 20 10.635 -0.370 20.124 2498 H GLU 21 H GLU 21 14.056 -0.328 17.283 2499 HA GLU 21 HA GLU 21 16.619 0.809 17.657 2500 HB2 GLU 21 2HB GLU 21 15.524 -0.812 15.264 2501 HB3 GLU 21 1HB GLU 21 17.176 -0.140 15.355 2502 HG2 GLU 21 2HG GLU 21 17.332 -1.478 17.668 2503 HG3 GLU 21 1HG GLU 21 15.968 -2.429 16.973 2504 H ALA 22 H ALA 22 14.062 1.334 15.231 2505 HA ALA 22 HA ALA 22 15.445 2.980 13.509 2506 HB1 ALA 22 1HB ALA 22 13.342 1.921 12.862 2507 HB2 ALA 22 2HB ALA 22 13.118 3.711 12.764 2508 HB3 ALA 22 3HB ALA 22 12.470 2.777 14.161 2509 H SER 23 H SER 23 13.957 3.719 16.584 2510 HA SER 23 HA SER 23 13.742 6.521 16.265 2511 HB2 SER 23 2HB SER 23 14.248 4.889 18.850 2512 HB3 SER 23 1HB SER 23 13.553 6.548 18.742 2513 HG SER 23 1HG SER 23 12.398 4.154 17.624 2514 H LYS 24 H LYS 24 16.351 4.302 17.282 2515 HA LYS 24 HA LYS 24 18.061 6.410 18.160 2516 HB2 LYS 24 2HB LYS 24 18.061 4.024 19.035 2517 HB3 LYS 24 1HB LYS 24 18.862 3.509 17.519 2518 HG2 LYS 24 2HG LYS 24 20.016 5.802 19.206 2519 HG3 LYS 24 1HG LYS 24 20.197 4.112 19.790 2520 HD2 LYS 24 2HD LYS 24 21.533 3.445 17.916 2521 HD3 LYS 24 1HD LYS 24 21.101 4.900 16.959 2522 HE2 LYS 24 2HE LYS 24 23.452 4.991 17.876 2523 HE3 LYS 24 1HE LYS 24 22.399 6.375 18.379 2524 HZ1 LYS 24 3HZ LYS 24 22.697 4.010 20.128 2525 HZ2 LYS 24 1HZ LYS 24 22.276 5.630 20.514 2526 HZ3 LYS 24 2HZ LYS 24 23.874 5.241 20.100 2527 H LYS 25 H LYS 25 17.471 4.559 15.194 2528 HA LYS 25 HA LYS 25 19.702 5.502 13.742 2529 HB2 LYS 25 2HB LYS 25 16.944 4.806 12.574 2530 HB3 LYS 25 1HB LYS 25 18.495 4.829 11.687 2531 HG2 LYS 25 2HG LYS 25 17.925 2.854 13.990 2532 HG3 LYS 25 1HG LYS 25 17.363 2.581 12.313 2533 HD2 LYS 25 2HD LYS 25 19.694 2.663 11.487 2534 HD3 LYS 25 1HD LYS 25 20.310 2.816 13.163 2535 HE2 LYS 25 2HE LYS 25 18.564 0.455 12.121 2536 HE3 LYS 25 1HE LYS 25 20.369 0.436 12.143 2537 HZ1 LYS 25 3HZ LYS 25 20.439 0.109 14.323 2538 HZ2 LYS 25 1HZ LYS 25 18.936 -0.573 14.126 2539 HZ3 LYS 25 2HZ LYS 25 19.051 1.025 14.691 2540 H ALA 26 H ALA 26 16.270 6.655 13.957 2541 HA ALA 26 HA ALA 26 16.609 8.740 12.134 2542 HB1 ALA 26 1HB ALA 26 14.380 9.514 12.919 2543 HB2 ALA 26 2HB ALA 26 14.505 8.447 14.371 2544 HB3 ALA 26 3HB ALA 26 14.383 7.727 12.725 2545 H VAL 27 H VAL 27 17.091 8.721 15.717 2546 HA VAL 27 HA VAL 27 17.157 11.598 15.713 2547 HB VAL 27 HB VAL 27 16.428 10.216 17.667 2548 HG11 VAL 27 1HG1 VAL 27 18.281 8.511 17.602 2549 HG12 VAL 27 2HG1 VAL 27 18.148 9.306 19.211 2550 HG13 VAL 27 3HG1 VAL 27 19.468 9.772 18.091 2551 HG21 VAL 27 3HG2 VAL 27 17.400 11.811 19.321 2552 HG22 VAL 27 1HG2 VAL 27 16.916 12.651 17.801 2553 HG23 VAL 27 2HG2 VAL 27 18.654 12.312 18.136 2554 H GLU 28 H GLU 28 19.491 8.992 15.201 2555 HA GLU 28 HA GLU 28 21.823 10.659 15.522 2556 HB2 GLU 28 2HB GLU 28 21.318 7.948 14.142 2557 HB3 GLU 28 1HB GLU 28 22.921 8.740 14.107 2558 HG2 GLU 28 2HG GLU 28 21.507 8.013 16.749 2559 HG3 GLU 28 1HG GLU 28 22.536 6.867 15.812 2560 H ALA 29 H ALA 29 19.854 9.287 12.867 2561 HA ALA 29 HA ALA 29 21.333 10.796 10.887 2562 HB1 ALA 29 1HB ALA 29 20.774 8.406 10.397 2563 HB2 ALA 29 2HB ALA 29 19.924 9.523 9.270 2564 HB3 ALA 29 3HB ALA 29 19.025 8.783 10.630 2565 H GLU 30 H GLU 30 20.688 12.833 11.767 2566 HA GLU 30 HA GLU 30 18.737 13.815 10.134 2567 HB2 GLU 30 2HB GLU 30 17.697 13.516 12.853 2568 HB3 GLU 30 1HB GLU 30 17.626 15.209 12.240 2569 HG2 GLU 30 2HG GLU 30 16.563 12.823 10.591 2570 HG3 GLU 30 1HG GLU 30 15.603 13.750 11.772 2571 H ARG 31 H ARG 31 20.530 14.578 13.200 2572 HA ARG 31 HA ARG 31 20.886 17.256 12.200 2573 HB2 ARG 31 2HB ARG 31 20.605 16.823 14.633 2574 HB3 ARG 31 1HB ARG 31 22.228 16.051 14.665 2575 HG2 ARG 31 2HG ARG 31 23.304 18.173 14.042 2576 HG3 ARG 31 1HG ARG 31 21.707 18.948 13.724 2577 HD2 ARG 31 2HD ARG 31 21.083 18.800 16.098 2578 HD3 ARG 31 1HD ARG 31 22.632 17.954 16.516 2579 HE ARG 31 HE ARG 31 23.536 20.279 15.314 2580 HH11 ARG 31 1HH2 ARG 31 21.272 19.609 18.061 2581 HH12 ARG 31 2HH2 ARG 31 21.441 21.145 18.759 2582 HH21 ARG 31 1HH1 ARG 31 23.906 22.300 16.380 2583 HH22 ARG 31 2HH1 ARG 31 23.067 22.745 17.817 2584 H GLY 32 H GLY 32 22.140 17.386 10.372 2585 HA2 GLY 32 2HA GLY 32 24.879 17.426 10.535 2586 HA3 GLY 32 1HA GLY 32 24.357 15.785 9.931 2587 H ALA 33 H ALA 33 22.147 16.207 8.544 2588 HA ALA 33 HA ALA 33 23.199 17.205 6.194 2589 HB1 ALA 33 1HB ALA 33 20.324 16.336 6.871 2590 HB2 ALA 33 2HB ALA 33 21.634 15.345 6.126 2591 HB3 ALA 33 3HB ALA 33 20.882 16.670 5.189 2592 HA PRO 34 HA PRO 34 21.197 21.195 5.989 2593 HB2 PRO 34 2HB PRO 34 20.865 21.548 3.236 2594 HB3 PRO 34 1HB PRO 34 22.454 21.675 4.090 2595 HG2 PRO 34 2HG PRO 34 21.292 19.252 2.610 2596 HG3 PRO 34 1HG PRO 34 22.961 19.935 2.450 2597 HD2 PRO 34 2HD PRO 34 22.428 17.777 4.060 2598 HD3 PRO 34 1HD PRO 34 23.608 19.048 4.607 2599 H GLY 35 H GLY 35 19.071 21.290 6.802 2600 HA2 GLY 35 2HA GLY 35 16.950 21.847 5.925 2601 HA3 GLY 35 1HA GLY 35 16.976 20.345 4.938 2602 H ALA 36 H ALA 36 18.406 19.640 7.871 2603 HA ALA 36 HA ALA 36 16.634 17.745 8.522 2604 HB1 ALA 36 1HB ALA 36 18.465 19.176 10.534 2605 HB2 ALA 36 2HB ALA 36 18.959 17.845 9.412 2606 HB3 ALA 36 3HB ALA 36 17.753 17.518 10.694 2607 H ALA 37 H ALA 37 15.105 17.324 10.138 2608 HA ALA 37 HA ALA 37 13.595 19.739 10.941 2609 HB1 ALA 37 1HB ALA 37 11.519 18.461 10.274 2610 HB2 ALA 37 2HB ALA 37 12.570 17.106 9.693 2611 HB3 ALA 37 3HB ALA 37 12.620 18.699 8.869 2612 H LEU 38 H LEU 38 14.201 16.206 11.497 2613 HA LEU 38 HA LEU 38 12.696 16.385 14.030 2614 HB2 LEU 38 2HB LEU 38 12.082 14.427 12.693 2615 HB3 LEU 38 1HB LEU 38 13.784 14.077 12.359 2616 HG LEU 38 HG LEU 38 14.155 13.474 14.765 2617 HD11 LEU 38 1HD1 LEU 38 11.077 13.628 15.064 2618 HD12 LEU 38 2HD1 LEU 38 12.233 14.787 15.821 2619 HD13 LEU 38 3HD1 LEU 38 12.261 13.057 16.289 2620 HD21 LEU 38 3HD2 LEU 38 13.094 11.261 14.581 2621 HD22 LEU 38 1HD2 LEU 38 13.703 11.806 12.985 2622 HD23 LEU 38 2HD2 LEU 38 11.938 11.877 13.336 2623 H ILE 39 H ILE 39 13.857 16.387 16.016 2624 HA ILE 39 HA ILE 39 16.766 16.134 15.832 2625 HB ILE 39 HB ILE 39 16.914 18.397 17.031 2626 HG12 ILE 39 2HG1 ILE 39 14.048 18.783 15.912 2627 HG13 ILE 39 1HG1 ILE 39 14.427 18.493 17.645 2628 HG21 ILE 39 1HG2 ILE 39 17.513 18.036 14.606 2629 HG22 ILE 39 2HG2 ILE 39 16.918 19.704 14.966 2630 HG23 ILE 39 3HG2 ILE 39 15.844 18.525 14.140 2631 HD11 ILE 39 3HD ILE 39 15.329 20.919 15.953 2632 HD12 ILE 39 1HD ILE 39 14.119 20.899 17.285 2633 HD13 ILE 39 2HD ILE 39 15.855 20.594 17.649 2634 H SER 40 H SER 40 14.254 14.753 17.266 2635 HA SER 40 HA SER 40 15.362 15.065 19.955 2636 HB2 SER 40 2HB SER 40 12.752 15.047 20.638 2637 HB3 SER 40 1HB SER 40 13.649 16.567 20.334 2638 HG SER 40 1HG SER 40 11.493 15.988 19.267 2639 H TYR 41 H TYR 41 15.318 13.215 21.156 2640 HA TYR 41 HA TYR 41 14.868 10.817 19.712 2641 HB2 TYR 41 2HB TYR 41 16.746 10.998 21.367 2642 HB3 TYR 41 1HB TYR 41 15.547 11.188 22.690 2643 HD1 TYR 41 2HD TYR 41 16.010 8.800 19.741 2644 HD2 TYR 41 1HD TYR 41 15.346 9.264 23.972 2645 HE1 TYR 41 2HE TYR 41 16.087 6.363 20.026 2646 HE2 TYR 41 1HE TYR 41 15.421 6.829 24.254 2647 HH TYR 41 HH TYR 41 15.890 4.815 23.232 2648 HA PRO 42 HA PRO 42 11.348 9.927 22.597 2649 HB2 PRO 42 2HB PRO 42 9.863 11.917 23.931 2650 HB3 PRO 42 1HB PRO 42 11.305 11.105 24.646 2651 HG2 PRO 42 2HG PRO 42 11.203 13.782 23.151 2652 HG3 PRO 42 1HG PRO 42 11.994 13.421 24.745 2653 HD2 PRO 42 2HD PRO 42 13.433 13.448 22.411 2654 HD3 PRO 42 1HD PRO 42 13.772 12.169 23.669 2655 H ASP 43 H ASP 43 11.418 12.528 20.352 2656 HA ASP 43 HA ASP 43 8.593 12.148 19.653 2657 HB2 ASP 43 2HB ASP 43 10.639 14.060 18.384 2658 HB3 ASP 43 1HB ASP 43 8.870 13.973 18.046 2659 H ALA 44 H ALA 44 11.902 11.289 18.758 2660 HA ALA 44 HA ALA 44 11.529 10.744 16.075 2661 HB1 ALA 44 1HB ALA 44 13.554 9.246 16.261 2662 HB2 ALA 44 2HB ALA 44 13.452 9.351 18.057 2663 HB3 ALA 44 3HB ALA 44 13.824 10.817 17.074 2664 H ILE 45 H ILE 45 10.912 8.769 18.958 2665 HA ILE 45 HA ILE 45 10.407 6.394 17.538 2666 HB ILE 45 HB ILE 45 10.928 6.206 19.832 2667 HG12 ILE 45 2HG1 ILE 45 7.943 5.489 19.567 2668 HG13 ILE 45 1HG1 ILE 45 9.285 4.588 18.787 2669 HG21 ILE 45 1HG2 ILE 45 10.237 8.409 20.674 2670 HG22 ILE 45 2HG2 ILE 45 9.478 7.132 21.667 2671 HG23 ILE 45 3HG2 ILE 45 8.496 8.010 20.450 2672 HD11 ILE 45 3HD ILE 45 8.924 4.979 21.831 2673 HD12 ILE 45 1HD ILE 45 8.589 3.482 20.894 2674 HD13 ILE 45 2HD ILE 45 10.280 4.087 21.024 2675 H TRP 46 H TRP 46 8.378 9.244 18.190 2676 HA TRP 46 HA TRP 46 6.020 7.711 17.571 2677 HB2 TRP 46 2HB TRP 46 6.484 10.051 19.048 2678 HB3 TRP 46 1HB TRP 46 5.666 10.668 17.581 2679 HD1 TRP 46 HD TRP 46 3.005 10.583 17.956 2680 HE1 TRP 46 1HE TRP 46 1.476 9.443 19.595 2681 HE3 TRP 46 3HE TRP 46 6.394 7.421 20.098 2682 HZ2 TRP 46 2HZ TRP 46 1.554 7.100 21.304 2683 HZ3 TRP 46 3HZ TRP 46 5.604 5.714 21.698 2684 HH2 TRP 46 HH TRP 46 3.216 5.549 22.291 2685 H TRP 47 H TRP 47 8.262 9.824 15.883 2686 HA TRP 47 HA TRP 47 6.817 10.061 13.459 2687 HB2 TRP 47 2HB TRP 47 8.811 11.454 13.925 2688 HB3 TRP 47 1HB TRP 47 9.836 9.991 14.111 2689 HD1 TRP 47 HD TRP 47 7.917 11.898 11.239 2690 HE1 TRP 47 1HE TRP 47 8.764 11.035 9.045 2691 HE3 TRP 47 3HE TRP 47 11.242 8.454 13.014 2692 HZ2 TRP 47 2HZ TRP 47 10.825 9.244 8.095 2693 HZ3 TRP 47 3HZ TRP 47 12.581 7.136 11.404 2694 HH2 TRP 47 HH TRP 47 12.386 7.536 8.975 2695 H SER 48 H SER 48 9.074 7.650 14.797 2696 HA SER 48 HA SER 48 9.335 6.001 12.636 2697 HB2 SER 48 2HB SER 48 10.605 6.025 14.909 2698 HB3 SER 48 1HB SER 48 9.261 5.017 15.557 2699 HG SER 48 1HG SER 48 10.994 3.810 14.878 2700 H VAL 49 H VAL 49 6.718 6.063 15.098 2701 HA VAL 49 HA VAL 49 5.481 3.672 14.494 2702 HB VAL 49 HB VAL 49 4.209 6.310 15.385 2703 HG11 VAL 49 1HG1 VAL 49 2.309 4.835 16.221 2704 HG12 VAL 49 2HG1 VAL 49 3.034 3.439 15.357 2705 HG13 VAL 49 3HG1 VAL 49 2.412 4.851 14.434 2706 HG21 VAL 49 3HG2 VAL 49 5.096 3.782 16.945 2707 HG22 VAL 49 1HG2 VAL 49 4.285 5.230 17.652 2708 HG23 VAL 49 2HG2 VAL 49 5.935 5.370 16.972 2709 H GLU 50 H GLU 50 4.982 6.908 12.893 2710 HA GLU 50 HA GLU 50 2.905 5.756 11.295 2711 HB2 GLU 50 2HB GLU 50 2.506 7.773 10.313 2712 HB3 GLU 50 1HB GLU 50 3.059 8.252 11.942 2713 HG2 GLU 50 2HG GLU 50 5.309 8.911 10.953 2714 HG3 GLU 50 1HG GLU 50 4.753 8.370 9.330 2715 H THR 51 H THR 51 6.342 6.040 11.103 2716 HA THR 51 HA THR 51 6.581 5.886 8.288 2717 HB THR 51 HB THR 51 8.591 5.128 10.479 2718 HG1 THR 51 1HG THR 51 7.888 7.315 10.632 2719 HG21 THR 51 3HG2 THR 51 9.243 4.278 8.199 2720 HG22 THR 51 1HG2 THR 51 10.284 5.660 8.689 2721 HG23 THR 51 2HG2 THR 51 8.956 5.915 7.498 2722 H ALA 52 H ALA 52 6.438 3.495 10.960 2723 HA ALA 52 HA ALA 52 7.033 1.261 9.332 2724 HB1 ALA 52 1HB ALA 52 5.454 1.447 11.974 2725 HB2 ALA 52 2HB ALA 52 7.229 1.147 11.803 2726 HB3 ALA 52 3HB ALA 52 6.049 -0.085 11.229 2727 H THR 53 H THR 53 3.972 3.049 9.964 2728 HA THR 53 HA THR 53 2.470 0.918 8.701 2729 HB THR 53 HB THR 53 0.535 2.490 9.087 2730 HG1 THR 53 1HG THR 53 1.637 4.417 9.243 2731 HG21 THR 53 3HG2 THR 53 2.304 1.763 11.535 2732 HG22 THR 53 1HG2 THR 53 1.200 0.629 10.667 2733 HG23 THR 53 2HG2 THR 53 0.527 2.051 11.545 2734 H THR 54 H THR 54 4.602 3.002 7.492 2735 HA THR 54 HA THR 54 4.984 4.070 5.667 2736 HB THR 54 HB THR 54 4.433 2.861 3.554 2737 HG1 THR 54 1HG THR 54 2.393 2.051 4.289 2738 HG21 THR 54 3HG2 THR 54 5.774 0.888 4.205 2739 HG22 THR 54 1HG2 THR 54 5.312 1.065 5.936 2740 HG23 THR 54 2HG2 THR 54 6.348 2.309 5.153 2741 H VAL 55 H VAL 55 2.767 5.225 7.064 2742 HA VAL 55 HA VAL 55 0.892 5.920 4.948 2743 HB VAL 55 HB VAL 55 -0.005 5.373 7.144 2744 HG11 VAL 55 1HG1 VAL 55 0.228 6.870 9.085 2745 HG12 VAL 55 2HG1 VAL 55 1.327 7.966 8.182 2746 HG13 VAL 55 3HG1 VAL 55 1.849 6.291 8.593 2747 HG21 VAL 55 3HG2 VAL 55 -0.457 8.279 6.202 2748 HG22 VAL 55 1HG2 VAL 55 -1.567 7.335 7.273 2749 HG23 VAL 55 2HG2 VAL 55 -1.257 6.797 5.583 2750 H GLY 56 H GLY 56 3.371 7.451 7.062 2751 HA2 GLY 56 2HA GLY 56 4.701 9.188 6.698 2752 HA3 GLY 56 1HA GLY 56 4.469 8.855 4.932 2753 H TYR 57 H TYR 57 2.408 10.142 7.651 2754 HA TYR 57 HA TYR 57 0.843 11.471 5.722 2755 HB2 TYR 57 2HB TYR 57 0.444 10.570 8.331 2756 HB3 TYR 57 1HB TYR 57 0.596 12.326 8.645 2757 HD1 TYR 57 1HD TYR 57 -0.862 13.816 6.828 2758 HD2 TYR 57 2HD TYR 57 -1.671 9.741 7.942 2759 HE1 TYR 57 1HE TYR 57 -3.154 14.054 6.032 2760 HE2 TYR 57 2HE TYR 57 -3.995 9.989 7.139 2761 HH TYR 57 HH TYR 57 -4.999 12.572 5.088 2762 H GLY 58 H GLY 58 3.535 12.445 7.880 2763 HA2 GLY 58 2HA GLY 58 4.570 14.314 6.419 2764 HA3 GLY 58 1HA GLY 58 3.200 15.239 7.196 2765 H ASP 59 H ASP 59 3.892 16.274 9.018 2766 HA ASP 59 HA ASP 59 4.582 16.558 11.026 2767 HB2 ASP 59 2HB ASP 59 3.829 14.231 11.623 2768 HB3 ASP 59 1HB ASP 59 5.487 13.639 11.283 2769 H ARG 60 H ARG 60 7.069 14.143 9.926 2770 HA ARG 60 HA ARG 60 8.977 16.264 9.500 2771 HB2 ARG 60 2HB ARG 60 9.038 14.345 11.862 2772 HB3 ARG 60 1HB ARG 60 10.598 14.671 11.047 2773 HG2 ARG 60 2HG ARG 60 10.771 16.802 11.769 2774 HG3 ARG 60 1HG ARG 60 9.017 17.151 11.695 2775 HD2 ARG 60 2HD ARG 60 10.118 15.253 13.857 2776 HD3 ARG 60 1HD ARG 60 10.238 17.039 14.072 2777 HE ARG 60 HE ARG 60 7.670 15.412 13.813 2778 HH11 ARG 60 1HH2 ARG 60 9.092 18.755 14.187 2779 HH12 ARG 60 2HH2 ARG 60 7.618 19.351 14.783 2780 HH21 ARG 60 1HH1 ARG 60 5.784 16.399 14.646 2781 HH22 ARG 60 2HH1 ARG 60 5.860 17.891 15.505 2782 H TYR 61 H TYR 61 11.169 15.009 8.683 2783 HA TYR 61 HA TYR 61 10.684 12.469 7.626 2784 HB2 TYR 61 2HB TYR 61 10.996 13.333 5.160 2785 HB3 TYR 61 1HB TYR 61 9.360 13.499 5.874 2786 HD1 TYR 61 2HD TYR 61 12.468 15.389 4.981 2787 HD2 TYR 61 1HD TYR 61 8.373 15.647 6.260 2788 HE1 TYR 61 2HE TYR 61 12.510 17.799 4.572 2789 HE2 TYR 61 1HE TYR 61 8.394 18.076 5.845 2790 HH TYR 61 HH TYR 61 11.346 19.759 4.621 2791 HA PRO 62 HA PRO 62 15.022 13.592 7.922 2792 HB2 PRO 62 2HB PRO 62 16.315 11.265 7.115 2793 HB3 PRO 62 1HB PRO 62 15.332 11.351 8.620 2794 HG2 PRO 62 2HG PRO 62 14.448 10.316 5.866 2795 HG3 PRO 62 1HG PRO 62 14.232 9.517 7.482 2796 HD2 PRO 62 2HD PRO 62 12.235 11.063 6.260 2797 HD3 PRO 62 1HD PRO 62 12.461 11.023 8.072 2798 H VAL 63 H VAL 63 16.924 14.239 6.662 2799 HA VAL 63 HA VAL 63 16.168 14.618 3.872 2800 HB VAL 63 HB VAL 63 18.682 15.925 4.828 2801 HG11 VAL 63 1HG1 VAL 63 17.588 16.331 2.532 2802 HG12 VAL 63 2HG1 VAL 63 17.605 17.809 3.554 2803 HG13 VAL 63 3HG1 VAL 63 16.092 16.854 3.380 2804 HG21 VAL 63 3HG2 VAL 63 15.908 16.610 5.990 2805 HG22 VAL 63 1HG2 VAL 63 17.368 17.664 6.016 2806 HG23 VAL 63 2HG2 VAL 63 17.386 16.112 6.902 2807 H THR 64 H THR 64 18.945 15.051 2.888 2808 HA THR 64 HA THR 64 19.085 12.593 1.754 2809 HB THR 64 HB THR 64 21.409 14.521 1.406 2810 HG1 THR 64 1HG THR 64 20.110 15.975 0.344 2811 HG21 THR 64 3HG2 THR 64 19.383 13.273 -0.580 2812 HG22 THR 64 1HG2 THR 64 20.964 12.528 -0.126 2813 HG23 THR 64 2HG2 THR 64 20.921 14.104 -0.989 2814 H GLU 65 H GLU 65 21.392 14.259 3.885 2815 HA GLU 65 HA GLU 65 23.408 12.308 3.477 2816 HB2 GLU 65 2HB GLU 65 23.426 14.970 3.969 2817 HB3 GLU 65 1HB GLU 65 23.490 14.420 5.673 2818 HG2 GLU 65 2HG GLU 65 25.566 13.042 5.033 2819 HG3 GLU 65 1HG GLU 65 25.501 13.809 3.395 2820 H GLU 66 H GLU 66 20.681 12.439 5.390 2821 HA GLU 66 HA GLU 66 21.760 11.017 7.681 2822 HB2 GLU 66 2HB GLU 66 18.964 12.134 7.068 2823 HB3 GLU 66 1HB GLU 66 19.594 11.590 8.643 2824 HG2 GLU 66 2HG GLU 66 20.484 13.992 6.958 2825 HG3 GLU 66 1HG GLU 66 19.734 14.082 8.537 2826 H GLY 67 H GLY 67 22.100 9.947 5.359 2827 HA2 GLY 67 2HA GLY 67 21.455 8.687 3.612 2828 HA3 GLY 67 1HA GLY 67 21.764 7.513 4.948 2829 H ARG 68 H ARG 68 19.271 9.324 3.161 2830 HA ARG 68 HA ARG 68 17.164 8.857 4.684 2831 HB2 ARG 68 2HB ARG 68 17.275 10.430 2.753 2832 HB3 ARG 68 1HB ARG 68 17.044 9.047 1.627 2833 HG2 ARG 68 2HG ARG 68 14.804 8.637 2.505 2834 HG3 ARG 68 1HG ARG 68 15.047 9.795 3.862 2835 HD2 ARG 68 2HD ARG 68 14.958 11.734 2.377 2836 HD3 ARG 68 1HD ARG 68 15.105 10.680 0.910 2837 HE ARG 68 HE ARG 68 12.857 10.013 1.067 2838 HH11 ARG 68 1HH2 ARG 68 13.507 12.354 3.821 2839 HH12 ARG 68 2HH2 ARG 68 12.200 13.191 3.279 2840 HH21 ARG 68 1HH1 ARG 68 10.870 10.706 1.136 2841 HH22 ARG 68 2HH1 ARG 68 10.304 11.894 2.288 2842 H LYS 69 H LYS 69 18.708 6.392 2.905 2843 HA LYS 69 HA LYS 69 16.652 4.499 2.843 2844 HB2 LYS 69 2HB LYS 69 19.672 4.178 3.192 2845 HB3 LYS 69 1HB LYS 69 18.548 2.777 3.178 2846 HG2 LYS 69 2HG LYS 69 17.664 3.398 0.967 2847 HG3 LYS 69 1HG LYS 69 18.832 4.762 0.856 2848 HD2 LYS 69 2HD LYS 69 20.731 3.204 0.948 2849 HD3 LYS 69 1HD LYS 69 19.645 1.804 1.280 2850 HE2 LYS 69 2HE LYS 69 18.635 1.916 -0.956 2851 HE3 LYS 69 1HE LYS 69 19.432 3.507 -1.282 2852 HZ1 LYS 69 3HZ LYS 69 20.871 0.901 -0.940 2853 HZ2 LYS 69 1HZ LYS 69 21.567 2.431 -1.209 2854 HZ3 LYS 69 2HZ LYS 69 20.541 1.727 -2.388 2855 H VAL 70 H VAL 70 17.922 6.088 5.644 2856 HA VAL 70 HA VAL 70 17.476 4.078 7.547 2857 HB VAL 70 HB VAL 70 17.119 7.120 7.713 2858 HG11 VAL 70 1HG1 VAL 70 17.065 6.769 10.230 2859 HG12 VAL 70 2HG1 VAL 70 16.836 4.999 9.951 2860 HG13 VAL 70 3HG1 VAL 70 15.583 6.180 9.415 2861 HG21 VAL 70 3HG2 VAL 70 19.461 6.405 7.469 2862 HG22 VAL 70 1HG2 VAL 70 19.269 5.121 8.719 2863 HG23 VAL 70 2HG2 VAL 70 19.194 6.865 9.167 2864 H ALA 71 H ALA 71 15.256 6.416 5.937 2865 HA ALA 71 HA ALA 71 12.968 5.594 7.380 2866 HB1 ALA 71 1HB ALA 71 12.997 7.780 6.143 2867 HB2 ALA 71 2HB ALA 71 11.655 6.734 5.563 2868 HB3 ALA 71 3HB ALA 71 13.157 6.897 4.582 2869 H GLU 72 H GLU 72 14.306 4.732 4.160 2870 HA GLU 72 HA GLU 72 12.438 2.978 3.254 2871 HB2 GLU 72 2HB GLU 72 15.473 2.892 3.015 2872 HB3 GLU 72 1HB GLU 72 14.511 1.587 2.330 2873 HG2 GLU 72 2HG GLU 72 13.454 4.277 1.505 2874 HG3 GLU 72 1HG GLU 72 15.145 3.957 0.961 2875 H GLN 73 H GLN 73 15.082 2.122 5.599 2876 HA GLN 73 HA GLN 73 14.398 -0.615 5.409 2877 HB2 GLN 73 2HB GLN 73 16.636 0.106 6.272 2878 HB3 GLN 73 1HB GLN 73 15.850 0.663 7.789 2879 HG2 GLN 73 2HG GLN 73 15.063 -1.681 8.251 2880 HG3 GLN 73 1HG GLN 73 15.714 -2.224 6.663 2881 HE21 GLN 73 1HE2 GLN 73 16.695 -3.770 8.453 2882 HE22 GLN 73 2HE2 GLN 73 18.265 -3.342 9.028 2883 H VAL 74 H VAL 74 13.205 2.003 7.535 2884 HA VAL 74 HA VAL 74 11.924 0.255 9.369 2885 HB VAL 74 HB VAL 74 11.249 3.172 8.696 2886 HG11 VAL 74 1HG1 VAL 74 10.356 3.198 11.069 2887 HG12 VAL 74 2HG1 VAL 74 10.667 1.429 11.203 2888 HG13 VAL 74 3HG1 VAL 74 9.444 2.050 10.035 2889 HG21 VAL 74 3HG2 VAL 74 12.767 3.699 10.627 2890 HG22 VAL 74 1HG2 VAL 74 13.663 2.923 9.291 2891 HG23 VAL 74 2HG2 VAL 74 13.229 1.951 10.731 2892 H MET 75 H MET 75 10.919 2.046 6.454 2893 HA MET 75 HA MET 75 8.217 1.328 6.518 2894 HB2 MET 75 2HB MET 75 10.056 2.086 4.167 2895 HB3 MET 75 1HB MET 75 8.266 1.972 4.059 2896 HG2 MET 75 2HG MET 75 8.083 3.645 5.939 2897 HG3 MET 75 1HG MET 75 9.837 3.878 5.915 2898 HE1 MET 75 3HE MET 75 10.186 5.427 2.130 2899 HE2 MET 75 1HE MET 75 10.194 3.680 2.511 2900 HE3 MET 75 2HE MET 75 11.137 4.831 3.528 2901 H LYS 76 H LYS 76 11.029 -0.182 4.773 2902 HA LYS 76 HA LYS 76 9.461 -2.140 3.560 2903 HB2 LYS 76 2HB LYS 76 11.771 -1.682 2.768 2904 HB3 LYS 76 1HB LYS 76 12.437 -2.395 4.278 2905 HG2 LYS 76 2HG LYS 76 11.492 -4.612 3.700 2906 HG3 LYS 76 1HG LYS 76 10.647 -3.928 2.270 2907 HD2 LYS 76 2HD LYS 76 12.802 -3.565 1.122 2908 HD3 LYS 76 1HD LYS 76 13.707 -4.028 2.603 2909 HE2 LYS 76 2HE LYS 76 12.679 -6.369 2.476 2910 HE3 LYS 76 1HE LYS 76 11.890 -5.897 0.920 2911 HZ1 LYS 76 3HZ LYS 76 14.795 -6.270 1.500 2912 HZ2 LYS 76 1HZ LYS 76 14.262 -5.466 0.115 2913 HZ3 LYS 76 2HZ LYS 76 13.833 -7.059 0.348 2914 H ALA 77 H ALA 77 10.989 -2.083 6.792 2915 HA ALA 77 HA ALA 77 10.595 -4.796 7.385 2916 HB1 ALA 77 1HB ALA 77 12.010 -3.287 8.836 2917 HB2 ALA 77 2HB ALA 77 10.746 -4.139 9.791 2918 HB3 ALA 77 3HB ALA 77 10.519 -2.409 9.335 2919 H GLY 78 H GLY 78 8.393 -2.002 7.614 2920 HA2 GLY 78 2HA GLY 78 6.349 -3.358 9.031 2921 HA3 GLY 78 1HA GLY 78 6.223 -1.850 8.040 2922 H ILE 79 H ILE 79 6.929 -2.702 5.557 2923 HA ILE 79 HA ILE 79 4.584 -3.839 4.611 2924 HB ILE 79 HB ILE 79 7.326 -3.581 3.289 2925 HG12 ILE 79 2HG1 ILE 79 4.786 -1.831 3.060 2926 HG13 ILE 79 1HG1 ILE 79 6.172 -1.437 4.106 2927 HG21 ILE 79 1HG2 ILE 79 6.072 -3.795 1.098 2928 HG22 ILE 79 2HG2 ILE 79 4.564 -4.167 2.009 2929 HG23 ILE 79 3HG2 ILE 79 5.966 -5.297 2.058 2930 HD11 ILE 79 3HD ILE 79 6.255 -1.636 1.025 2931 HD12 ILE 79 1HD ILE 79 6.338 -0.152 2.028 2932 HD13 ILE 79 2HD ILE 79 7.688 -1.342 2.085 2933 H GLU 80 H GLU 80 7.804 -5.339 5.193 2934 HA GLU 80 HA GLU 80 7.210 -7.883 4.229 2935 HB2 GLU 80 2HB GLU 80 8.997 -7.003 6.580 2936 HB3 GLU 80 1HB GLU 80 8.956 -8.691 5.961 2937 HG2 GLU 80 2HG GLU 80 9.823 -7.992 3.771 2938 HG3 GLU 80 1HG GLU 80 9.826 -6.260 4.264 2939 H VAL 81 H VAL 81 6.749 -6.512 7.533 2940 HA VAL 81 HA VAL 81 5.933 -8.933 8.704 2941 HB VAL 81 HB VAL 81 5.671 -5.988 9.433 2942 HG11 VAL 81 1HG1 VAL 81 3.657 -6.945 10.456 2943 HG12 VAL 81 2HG1 VAL 81 4.897 -6.770 11.737 2944 HG13 VAL 81 3HG1 VAL 81 4.564 -8.393 11.031 2945 HG21 VAL 81 3HG2 VAL 81 7.362 -6.655 11.152 2946 HG22 VAL 81 1HG2 VAL 81 7.926 -7.164 9.525 2947 HG23 VAL 81 2HG2 VAL 81 7.229 -8.378 10.657 2948 H PHE 82 H PHE 82 4.029 -6.155 7.376 2949 HA PHE 82 HA PHE 82 1.565 -7.436 7.967 2950 HB2 PHE 82 2HB PHE 82 2.167 -5.170 5.959 2951 HB3 PHE 82 1HB PHE 82 0.517 -5.668 6.493 2952 HD1 PHE 82 1HD PHE 82 0.642 -5.973 9.377 2953 HD2 PHE 82 2HD PHE 82 2.630 -3.085 6.877 2954 HE1 PHE 82 1HE PHE 82 0.755 -4.406 11.271 2955 HE2 PHE 82 2HE PHE 82 2.736 -1.519 8.772 2956 HZ PHE 82 HZ PHE 82 1.795 -2.165 10.978 2957 H ALA 83 H ALA 83 3.836 -7.878 5.363 2958 HA ALA 83 HA ALA 83 1.844 -9.038 3.607 2959 HB1 ALA 83 1HB ALA 83 3.826 -7.873 2.611 2960 HB2 ALA 83 2HB ALA 83 3.766 -9.603 2.126 2961 HB3 ALA 83 3HB ALA 83 4.920 -9.058 3.408 2962 H LEU 84 H LEU 84 4.362 -10.086 5.905 2963 HA LEU 84 HA LEU 84 4.562 -12.721 5.147 2964 HB2 LEU 84 2HB LEU 84 6.104 -11.427 6.645 2965 HB3 LEU 84 1HB LEU 84 4.938 -11.582 7.989 2966 HG LEU 84 HG LEU 84 5.985 -14.081 6.549 2967 HD11 LEU 84 1HD1 LEU 84 8.015 -14.141 7.990 2968 HD12 LEU 84 2HD1 LEU 84 7.613 -12.512 8.650 2969 HD13 LEU 84 3HD1 LEU 84 8.020 -12.704 6.904 2970 HD21 LEU 84 3HD2 LEU 84 5.913 -15.105 8.825 2971 HD22 LEU 84 1HD2 LEU 84 4.304 -14.445 8.385 2972 HD23 LEU 84 2HD2 LEU 84 5.359 -13.546 9.535 2973 H VAL 85 H VAL 85 2.163 -11.134 7.211 2974 HA VAL 85 HA VAL 85 1.126 -13.450 8.364 2975 HB VAL 85 HB VAL 85 -0.831 -12.187 8.995 2976 HG11 VAL 85 1HG1 VAL 85 1.691 -10.391 9.139 2977 HG12 VAL 85 2HG1 VAL 85 1.424 -11.833 10.171 2978 HG13 VAL 85 3HG1 VAL 85 0.312 -10.427 10.279 2979 HG21 VAL 85 3HG2 VAL 85 0.229 -10.067 7.014 2980 HG22 VAL 85 1HG2 VAL 85 -1.092 -9.787 8.199 2981 HG23 VAL 85 2HG2 VAL 85 -1.318 -10.971 6.867 2982 H THR 86 H THR 86 1.118 -12.726 5.069 2983 HA THR 86 HA THR 86 -1.332 -13.689 4.237 2984 HB THR 86 HB THR 86 1.390 -13.887 2.877 2985 HG1 THR 86 1HG THR 86 0.940 -11.821 3.070 2986 HG21 THR 86 3HG2 THR 86 -1.489 -14.153 1.733 2987 HG22 THR 86 1HG2 THR 86 -0.226 -15.446 1.745 2988 HG23 THR 86 2HG2 THR 86 0.008 -13.971 0.748 2989 H ALA 87 H ALA 87 1.346 -15.429 5.717 2990 HA ALA 87 HA ALA 87 0.621 -18.010 4.853 2991 HB1 ALA 87 1HB ALA 87 1.808 -18.834 6.891 2992 HB2 ALA 87 2HB ALA 87 1.815 -17.158 7.567 2993 HB3 ALA 87 3HB ALA 87 2.759 -17.540 6.084 2994 H ALA 88 H ALA 88 -0.977 -15.776 7.028 2995 HA ALA 88 HA ALA 88 -2.725 -17.865 8.095 2996 HB1 ALA 88 1HB ALA 88 -2.006 -16.069 9.715 2997 HB2 ALA 88 2HB ALA 88 -3.783 -16.059 9.422 2998 HB3 ALA 88 3HB ALA 88 -2.735 -14.828 8.634 2999 H LEU 89 H LEU 89 -2.764 -14.850 6.084 3000 HA LEU 89 HA LEU 89 -5.474 -14.888 5.572 3001 HB2 LEU 89 2HB LEU 89 -3.340 -13.894 3.598 3002 HB3 LEU 89 1HB LEU 89 -5.058 -13.400 3.639 3003 HG LEU 89 HG LEU 89 -3.055 -12.852 5.917 3004 HD11 LEU 89 1HD1 LEU 89 -2.870 -10.560 5.036 3005 HD12 LEU 89 2HD1 LEU 89 -3.963 -10.962 3.658 3006 HD13 LEU 89 3HD1 LEU 89 -2.345 -11.733 3.788 3007 HD21 LEU 89 3HD2 LEU 89 -5.468 -12.831 6.648 3008 HD22 LEU 89 1HD2 LEU 89 -5.846 -11.661 5.343 3009 HD23 LEU 89 2HD2 LEU 89 -4.742 -11.186 6.682 3010 H ALA 90 H ALA 90 -2.874 -16.512 3.695 3011 HA ALA 90 HA ALA 90 -4.594 -17.207 1.555 3012 HB1 ALA 90 1HB ALA 90 -2.765 -18.734 0.842 3013 HB2 ALA 90 2HB ALA 90 -1.945 -18.500 2.436 3014 HB3 ALA 90 3HB ALA 90 -2.105 -17.120 1.292 3015 H THR 91 H THR 91 -4.419 -18.428 4.810 3016 HA THR 91 HA THR 91 -5.446 -21.029 3.980 3017 HB THR 91 HB THR 91 -5.717 -21.639 6.293 3018 HG1 THR 91 1HG THR 91 -4.944 -18.972 6.828 3019 HG21 THR 91 3HG2 THR 91 -3.609 -22.043 5.028 3020 HG22 THR 91 1HG2 THR 91 -3.310 -21.852 6.786 3021 HG23 THR 91 2HG2 THR 91 -2.917 -20.495 5.668 3022 H ASP 92 H ASP 92 -6.717 -17.818 4.480 3023 HA ASP 92 HA ASP 92 -9.018 -18.764 5.848 3024 HB2 ASP 92 2HB ASP 92 -8.405 -16.046 4.599 3025 HB3 ASP 92 1HB ASP 92 -10.034 -16.459 5.259 3026 H PHE 93 H PHE 93 -8.165 -18.936 2.533 3027 HA PHE 93 HA PHE 93 -10.921 -18.984 1.697 3028 HB2 PHE 93 2HB PHE 93 -10.298 -19.238 -0.515 3029 HB3 PHE 93 1HB PHE 93 -9.021 -18.209 0.168 3030 HD1 PHE 93 1HD PHE 93 -9.848 -21.572 -1.193 3031 HD2 PHE 93 2HD PHE 93 -6.727 -18.989 0.248 3032 HE1 PHE 93 1HE PHE 93 -8.156 -23.024 -2.252 3033 HE2 PHE 93 2HE PHE 93 -5.037 -20.459 -0.773 3034 HZ PHE 93 HZ PHE 93 -5.744 -22.473 -2.052 3035 H VAL 94 H VAL 94 -8.553 -21.382 2.853 3036 HA VAL 94 HA VAL 94 -9.813 -23.520 1.489 3037 HB VAL 94 HB VAL 94 -8.315 -25.021 2.401 3038 HG11 VAL 94 1HG1 VAL 94 -7.393 -23.344 0.761 3039 HG12 VAL 94 2HG1 VAL 94 -6.135 -23.956 1.890 3040 HG13 VAL 94 3HG1 VAL 94 -6.816 -22.311 2.120 3041 HG21 VAL 94 3HG2 VAL 94 -8.466 -24.537 4.827 3042 HG22 VAL 94 1HG2 VAL 94 -7.575 -22.991 4.612 3043 HG23 VAL 94 2HG2 VAL 94 -6.758 -24.552 4.292 3044 H ARG 95 H ARG 95 -10.638 -21.770 4.252 3045 HA ARG 95 HA ARG 95 -11.967 -23.756 5.738 3046 HB2 ARG 95 2HB ARG 95 -12.301 -20.715 5.585 3047 HB3 ARG 95 1HB ARG 95 -13.529 -21.731 6.394 3048 HG2 ARG 95 2HG ARG 95 -12.348 -21.227 8.199 3049 HG3 ARG 95 1HG ARG 95 -11.601 -22.794 7.761 3050 HD2 ARG 95 2HD ARG 95 -9.594 -21.470 6.809 3051 HD3 ARG 95 1HD ARG 95 -10.424 -19.944 7.347 3052 HE ARG 95 HE ARG 95 -10.231 -21.941 9.500 3053 HH11 ARG 95 1HH2 ARG 95 -8.602 -18.967 8.106 3054 HH12 ARG 95 2HH2 ARG 95 -7.294 -19.044 9.083 3055 HH21 ARG 95 1HH1 ARG 95 -8.547 -21.689 11.202 3056 HH22 ARG 95 2HH1 ARG 95 -7.335 -20.494 11.030 3057 H ARG 96 H ARG 96 -12.669 -22.489 2.553 3058 HA ARG 96 HA ARG 96 -15.446 -22.796 2.588 3059 HB2 ARG 96 2HB ARG 96 -15.444 -22.838 0.199 3060 HB3 ARG 96 1HB ARG 96 -14.196 -21.697 0.723 3061 HG2 ARG 96 2HG ARG 96 -12.910 -22.737 -0.850 3062 HG3 ARG 96 1HG ARG 96 -12.629 -23.948 0.444 3063 HD2 ARG 96 2HD ARG 96 -14.763 -25.184 -0.542 3064 HD3 ARG 96 1HD ARG 96 -14.645 -24.039 -1.921 3065 HE ARG 96 HE ARG 96 -12.470 -25.976 -0.981 3066 HH11 ARG 96 1HH2 ARG 96 -14.113 -24.455 -3.855 3067 HH12 ARG 96 2HH2 ARG 96 -14.043 -25.922 -4.753 3068 HH21 ARG 96 1HH1 ARG 96 -12.168 -27.735 -2.263 3069 HH22 ARG 96 2HH1 ARG 96 -12.519 -27.740 -3.966 3070 H GLU 97 H GLU 97 -12.919 -25.211 2.716 3071 HA GLU 97 HA GLU 97 -14.395 -27.300 1.520 3072 HB2 GLU 97 2HB GLU 97 -11.737 -26.886 2.296 3073 HB3 GLU 97 1HB GLU 97 -12.282 -28.030 3.546 3074 HG2 GLU 97 2HG GLU 97 -11.237 -29.256 1.741 3075 HG3 GLU 97 1HG GLU 97 -12.998 -29.617 1.653 3076 H GLU 98 H GLU 98 -13.825 -26.251 4.939 3077 HA GLU 98 HA GLU 98 -15.466 -28.414 5.914 3078 HB2 GLU 98 2HB GLU 98 -15.053 -27.264 8.189 3079 HB3 GLU 98 1HB GLU 98 -13.726 -28.101 7.339 3080 HG2 GLU 98 2HG GLU 98 -12.858 -25.836 6.512 3081 HG3 GLU 98 1HG GLU 98 -14.126 -25.048 7.533 3082 H GLU 99 H GLU 99 -15.768 -24.870 5.342 3083 HA GLU 99 HA GLU 99 -18.324 -24.816 6.561 3084 HB2 GLU 99 2HB GLU 99 -17.159 -22.801 4.584 3085 HB3 GLU 99 1HB GLU 99 -18.625 -22.569 5.599 3086 HG2 GLU 99 2HG GLU 99 -15.759 -22.953 6.685 3087 HG3 GLU 99 1HG GLU 99 -16.629 -21.391 6.525 3088 H ARG 100 H ARG 100 -17.377 -26.257 3.662 3089 HA ARG 100 HA ARG 100 -19.721 -25.811 2.165 3090 HB2 ARG 100 2HB ARG 100 -17.563 -26.803 1.297 3091 HB3 ARG 100 1HB ARG 100 -17.915 -28.314 2.183 3092 HG2 ARG 100 2HG ARG 100 -19.815 -28.778 0.691 3093 HG3 ARG 100 1HG ARG 100 -19.836 -27.084 0.111 3094 HD2 ARG 100 2HD ARG 100 -18.845 -28.632 -1.620 3095 HD3 ARG 100 1HD ARG 100 -17.722 -27.319 -1.078 3096 HE ARG 100 HE ARG 100 -17.610 -30.003 0.285 3097 HH11 ARG 100 1HH2 ARG 100 -15.975 -27.737 -2.087 3098 HH12 ARG 100 2HH2 ARG 100 -14.408 -28.309 -1.611 3099 HH21 ARG 100 1HH1 ARG 100 -15.361 -30.945 0.465 3100 HH22 ARG 100 2HH1 ARG 100 -14.092 -30.119 -0.356 3101 H ARG 101 H ARG 101 -18.826 -28.132 4.746 3102 HA ARG 101 HA ARG 101 -21.504 -29.348 4.628 3103 HB2 ARG 101 2HB ARG 101 -18.974 -29.996 6.253 3104 HB3 ARG 101 1HB ARG 101 -20.576 -30.753 6.580 3105 HG2 ARG 101 2HG ARG 101 -20.703 -31.687 4.348 3106 HG3 ARG 101 1HG ARG 101 -19.113 -30.989 3.879 3107 HD2 ARG 101 2HD ARG 101 -17.882 -32.449 5.349 3108 HD3 ARG 101 1HD ARG 101 -19.351 -32.853 6.330 3109 HE ARG 101 HE ARG 101 -20.274 -33.968 4.246 3110 HH11 ARG 101 1HH2 ARG 101 -16.713 -34.056 5.110 3111 HH12 ARG 101 2HH2 ARG 101 -16.518 -35.632 4.512 3112 HH21 ARG 101 1HH1 ARG 101 -19.852 -36.052 3.242 3113 HH22 ARG 101 2HH1 ARG 101 -18.370 -36.849 3.427 3114 H GLY 102 H GLY 102 -19.775 -26.788 6.151 3115 HA2 GLY 102 2HA GLY 102 -20.451 -25.265 7.624 3116 HA3 GLY 102 1HA GLY 102 -22.018 -26.144 7.802 3117 H HIS 103 H HIS 103 -18.833 -27.713 8.203 3118 HA HIS 103 HA HIS 103 -19.137 -27.604 11.110 3119 HB2 HIS 103 2HB HIS 103 -18.766 -30.260 9.563 3120 HB3 HIS 103 1HB HIS 103 -18.611 -30.033 11.338 3121 HD1 HIS 103 1HD HIS 103 -20.494 -31.595 12.087 3122 HD2 HIS 103 2HD HIS 103 -21.821 -28.846 9.151 3123 HE1 HIS 103 1HE HIS 103 -22.950 -31.908 11.809 3124 HE2 HIS 103 2HE HIS 103 -23.730 -30.336 9.996 Start of MODEL 17 1 H1 SER 1 H SER 1 -22.174 -15.256 -2.335 2 HA SER 1 HA SER 1 -23.694 -17.427 -2.338 3 HB2 SER 1 2HB SER 1 -23.873 -16.991 -4.892 4 HB3 SER 1 1HB SER 1 -22.093 -17.125 -4.988 5 HG SER 1 1HG SER 1 -23.219 -19.024 -5.549 6 H ALA 2 H ALA 2 -21.696 -19.161 -3.070 7 HA ALA 2 HA ALA 2 -19.922 -20.164 -2.295 8 HB1 ALA 2 1HB ALA 2 -18.709 -18.559 -3.803 9 HB2 ALA 2 2HB ALA 2 -17.700 -19.090 -2.414 10 HB3 ALA 2 3HB ALA 2 -18.481 -17.457 -2.402 11 H ASP 3 H ASP 3 -17.779 -19.387 -0.436 12 HA ASP 3 HA ASP 3 -19.059 -17.709 1.442 13 HB2 ASP 3 2HB ASP 3 -19.045 -20.187 2.552 14 HB3 ASP 3 1HB ASP 3 -17.280 -19.877 2.715 15 H HIS 4 H HIS 4 -17.471 -16.297 1.880 16 HA HIS 4 HA HIS 4 -15.155 -15.820 1.942 17 HB2 HIS 4 2HB HIS 4 -13.754 -15.625 -0.083 18 HB3 HIS 4 1HB HIS 4 -14.044 -17.290 0.458 19 HD1 HIS 4 1HD HIS 4 -15.208 -15.008 -2.528 20 HD2 HIS 4 2HD HIS 4 -14.760 -19.052 -1.415 21 HE1 HIS 4 1HE HIS 4 -15.485 -16.336 -4.566 22 HE2 HIS 4 2HE HIS 4 -15.219 -18.757 -3.950 23 H GLU 5 H GLU 5 -17.211 -15.181 -1.020 24 HA GLU 5 HA GLU 5 -16.323 -12.467 -0.898 25 HB2 GLU 5 2HB GLU 5 -17.957 -12.118 -2.834 26 HB3 GLU 5 1HB GLU 5 -16.506 -13.120 -3.040 27 HG2 GLU 5 2HG GLU 5 -18.215 -15.191 -2.537 28 HG3 GLU 5 1HG GLU 5 -19.433 -13.974 -3.043 29 H ARG 6 H ARG 6 -19.158 -14.199 0.318 30 HA ARG 6 HA ARG 6 -20.640 -11.917 1.013 31 HB2 ARG 6 2HB ARG 6 -21.566 -13.452 2.910 32 HB3 ARG 6 1HB ARG 6 -21.864 -13.954 1.221 33 HG2 ARG 6 2HG ARG 6 -20.242 -15.698 1.275 34 HG3 ARG 6 1HG ARG 6 -19.457 -15.074 2.760 35 HD2 ARG 6 2HD ARG 6 -22.239 -16.399 2.593 36 HD3 ARG 6 1HD ARG 6 -20.748 -17.145 3.254 37 HE ARG 6 HE ARG 6 -22.589 -15.668 4.714 38 HH11 ARG 6 1HH2 ARG 6 -19.009 -16.234 4.679 39 HH12 ARG 6 2HH2 ARG 6 -18.701 -15.228 6.030 40 HH21 ARG 6 1HH1 ARG 6 -22.140 -14.675 6.838 41 HH22 ARG 6 2HH1 ARG 6 -20.535 -14.283 7.274 42 H GLU 7 H GLU 7 -17.888 -13.524 2.576 43 HA GLU 7 HA GLU 7 -18.196 -12.274 5.095 44 HB2 GLU 7 2HB GLU 7 -17.042 -14.536 4.580 45 HB3 GLU 7 1HB GLU 7 -15.718 -13.603 3.823 46 HG2 GLU 7 2HG GLU 7 -15.006 -14.314 6.004 47 HG3 GLU 7 1HG GLU 7 -15.239 -12.533 6.065 48 H ALA 8 H ALA 8 -16.455 -11.667 2.085 49 HA ALA 8 HA ALA 8 -14.768 -9.620 2.956 50 HB1 ALA 8 1HB ALA 8 -14.436 -10.795 0.748 51 HB2 ALA 8 2HB ALA 8 -14.599 -9.019 0.500 52 HB3 ALA 8 3HB ALA 8 -15.987 -10.094 0.148 53 H GLN 9 H GLN 9 -18.054 -9.588 1.529 54 HA GLN 9 HA GLN 9 -18.320 -6.827 1.356 55 HB2 GLN 9 2HB GLN 9 -19.815 -8.475 0.235 56 HB3 GLN 9 1HB GLN 9 -20.511 -8.954 1.812 57 HG2 GLN 9 2HG GLN 9 -20.653 -6.061 0.712 58 HG3 GLN 9 1HG GLN 9 -21.856 -7.322 0.268 59 HE21 GLN 9 1HE2 GLN 9 -21.644 -4.741 2.291 60 HE22 GLN 9 2HE2 GLN 9 -22.626 -5.297 3.597 61 H LYS 10 H LYS 10 -19.058 -9.085 4.046 62 HA LYS 10 HA LYS 10 -20.253 -7.182 5.702 63 HB2 LYS 10 2HB LYS 10 -20.284 -9.740 6.008 64 HB3 LYS 10 1HB LYS 10 -18.609 -9.597 6.644 65 HG2 LYS 10 2HG LYS 10 -19.598 -7.855 8.330 66 HG3 LYS 10 1HG LYS 10 -21.213 -8.409 7.785 67 HD2 LYS 10 2HD LYS 10 -20.750 -10.676 8.705 68 HD3 LYS 10 1HD LYS 10 -19.005 -10.282 8.850 69 HE2 LYS 10 2HE LYS 10 -19.990 -10.153 11.099 70 HE3 LYS 10 1HE LYS 10 -19.486 -8.509 10.548 71 HZ1 LYS 10 3HZ LYS 10 -22.075 -9.517 11.216 72 HZ2 LYS 10 1HZ LYS 10 -22.089 -8.675 9.724 73 HZ3 LYS 10 2HZ LYS 10 -21.533 -7.903 11.092 74 H ALA 11 H ALA 11 -16.841 -7.989 5.112 75 HA ALA 11 HA ALA 11 -15.810 -6.683 7.383 76 HB1 ALA 11 1HB ALA 11 -14.497 -8.372 6.046 77 HB2 ALA 11 2HB ALA 11 -13.609 -6.828 6.281 78 HB3 ALA 11 3HB ALA 11 -14.392 -7.181 4.694 79 H GLU 12 H GLU 12 -16.802 -5.520 4.155 80 HA GLU 12 HA GLU 12 -15.508 -3.029 4.302 81 HB2 GLU 12 2HB GLU 12 -18.158 -3.652 2.855 82 HB3 GLU 12 1HB GLU 12 -17.099 -2.218 2.632 83 HG2 GLU 12 2HG GLU 12 -15.248 -3.828 1.837 84 HG3 GLU 12 1HG GLU 12 -16.473 -5.146 1.831 85 H GLU 13 H GLU 13 -18.552 -4.240 5.685 86 HA GLU 13 HA GLU 13 -19.634 -1.704 6.333 87 HB2 GLU 13 2HB GLU 13 -20.157 -4.369 7.800 88 HB3 GLU 13 1HB GLU 13 -21.233 -2.932 7.707 89 HG2 GLU 13 2HG GLU 13 -21.410 -3.349 5.180 90 HG3 GLU 13 1HG GLU 13 -20.471 -4.870 5.398 91 H GLU 14 H GLU 14 -17.443 -3.985 7.894 92 HA GLU 14 HA GLU 14 -17.464 -2.827 10.467 93 HB2 GLU 14 2HB GLU 14 -16.712 -5.093 10.341 94 HB3 GLU 14 1HB GLU 14 -15.520 -4.732 9.061 95 HG2 GLU 14 2HG GLU 14 -13.902 -3.921 10.482 96 HG3 GLU 14 1HG GLU 14 -15.068 -3.286 11.686 97 H LEU 15 H LEU 15 -15.565 -2.266 7.524 98 HA LEU 15 HA LEU 15 -13.611 -0.615 8.517 99 HB2 LEU 15 2HB LEU 15 -13.936 -1.522 6.100 100 HB3 LEU 15 1HB LEU 15 -15.092 -0.187 5.845 101 HG LEU 15 HG LEU 15 -13.184 1.444 6.443 102 HD11 LEU 15 1HD1 LEU 15 -10.837 0.520 6.109 103 HD12 LEU 15 2HD1 LEU 15 -11.510 -1.141 6.152 104 HD13 LEU 15 3HD1 LEU 15 -11.619 -0.088 7.612 105 HD21 LEU 15 3HD2 LEU 15 -13.946 1.038 4.104 106 HD22 LEU 15 1HD2 LEU 15 -12.813 -0.361 3.965 107 HD23 LEU 15 2HD2 LEU 15 -12.166 1.309 4.178 108 H GLN 16 H GLN 16 -16.911 0.271 7.345 109 HA GLN 16 HA GLN 16 -16.470 3.018 7.812 110 HB2 GLN 16 2HB GLN 16 -19.194 1.634 7.556 111 HB3 GLN 16 1HB GLN 16 -18.822 3.383 7.365 112 HG2 GLN 16 2HG GLN 16 -17.129 2.580 5.478 113 HG3 GLN 16 1HG GLN 16 -18.074 1.048 5.483 114 HE21 GLN 16 1HE2 GLN 16 -20.745 2.156 5.989 115 HE22 GLN 16 2HE2 GLN 16 -21.155 3.251 4.724 116 H LYS 17 H LYS 17 -17.527 0.450 9.900 117 HA LYS 17 HA LYS 17 -18.889 1.986 11.863 118 HB2 LYS 17 2HB LYS 17 -19.242 -0.440 11.661 119 HB3 LYS 17 1HB LYS 17 -17.489 -0.729 11.781 120 HG2 LYS 17 2HG LYS 17 -17.574 -0.005 14.234 121 HG3 LYS 17 1HG LYS 17 -19.361 0.107 14.058 122 HD2 LYS 17 2HD LYS 17 -18.834 -2.062 15.040 123 HD3 LYS 17 1HD LYS 17 -19.380 -2.334 13.347 124 HE2 LYS 17 2HE LYS 17 -16.865 -2.472 12.685 125 HE3 LYS 17 1HE LYS 17 -16.466 -2.438 14.439 126 HZ1 LYS 17 3HZ LYS 17 -16.620 -4.666 13.306 127 HZ2 LYS 17 1HZ LYS 17 -18.285 -4.493 13.223 128 HZ3 LYS 17 2HZ LYS 17 -17.509 -4.549 14.719 129 H VAL 18 H VAL 18 -15.452 0.871 11.481 130 HA VAL 18 HA VAL 18 -14.744 1.949 14.021 131 HB VAL 18 HB VAL 18 -12.390 1.529 13.345 132 HG11 VAL 18 1HG1 VAL 18 -13.836 -0.156 14.540 133 HG12 VAL 18 2HG1 VAL 18 -12.677 -0.954 13.417 134 HG13 VAL 18 3HG1 VAL 18 -14.404 -0.800 12.949 135 HG21 VAL 18 3HG2 VAL 18 -13.690 0.355 10.788 136 HG22 VAL 18 1HG2 VAL 18 -11.975 0.268 11.223 137 HG23 VAL 18 2HG2 VAL 18 -12.694 1.858 10.828 138 H LEU 19 H LEU 19 -14.853 3.263 10.716 139 HA LEU 19 HA LEU 19 -13.298 5.538 11.146 140 HB2 LEU 19 2HB LEU 19 -15.865 5.277 9.442 141 HB3 LEU 19 1HB LEU 19 -14.742 6.671 9.384 142 HG LEU 19 HG LEU 19 -14.056 3.800 8.554 143 HD11 LEU 19 1HD1 LEU 19 -15.601 4.953 6.970 144 HD12 LEU 19 2HD1 LEU 19 -13.963 4.726 6.261 145 HD13 LEU 19 3HD1 LEU 19 -14.467 6.344 6.868 146 HD21 LEU 19 3HD2 LEU 19 -12.349 6.320 8.829 147 HD22 LEU 19 1HD2 LEU 19 -11.987 5.086 7.582 148 HD23 LEU 19 2HD2 LEU 19 -11.993 4.630 9.330 149 H GLU 20 H GLU 20 -16.719 4.855 11.884 150 HA GLU 20 HA GLU 20 -17.372 7.516 12.598 151 HB2 GLU 20 2HB GLU 20 -18.729 4.828 13.142 152 HB3 GLU 20 1HB GLU 20 -19.461 6.424 13.544 153 HG2 GLU 20 2HG GLU 20 -19.444 7.136 11.208 154 HG3 GLU 20 1HG GLU 20 -18.520 5.685 10.695 155 H GLU 21 H GLU 21 -16.103 4.688 14.389 156 HA GLU 21 HA GLU 21 -16.513 6.050 16.902 157 HB2 GLU 21 2HB GLU 21 -16.290 3.461 16.647 158 HB3 GLU 21 1HB GLU 21 -14.521 3.760 16.588 159 HG2 GLU 21 2HG GLU 21 -14.871 5.156 18.782 160 HG3 GLU 21 1HG GLU 21 -16.544 4.519 18.810 161 H ALA 22 H ALA 22 -13.840 5.565 14.564 162 HA ALA 22 HA ALA 22 -11.835 6.717 16.115 163 HB1 ALA 22 1HB ALA 22 -12.064 6.579 13.043 164 HB2 ALA 22 2HB ALA 22 -11.330 5.321 14.098 165 HB3 ALA 22 3HB ALA 22 -10.566 6.946 13.970 166 H SER 23 H SER 23 -14.215 8.189 13.879 167 HA SER 23 HA SER 23 -12.873 10.647 13.681 168 HB2 SER 23 2HB SER 23 -15.268 11.547 13.075 169 HB3 SER 23 1HB SER 23 -14.464 10.352 12.000 170 HG SER 23 1HG SER 23 -15.705 8.779 12.675 171 H LYS 24 H LYS 24 -15.102 9.350 16.101 172 HA LYS 24 HA LYS 24 -15.575 11.748 17.489 173 HB2 LYS 24 2HB LYS 24 -16.774 9.511 17.872 174 HB3 LYS 24 1HB LYS 24 -15.268 8.893 18.616 175 HG2 LYS 24 2HG LYS 24 -15.507 10.883 20.333 176 HG3 LYS 24 1HG LYS 24 -17.166 11.051 19.656 177 HD2 LYS 24 2HD LYS 24 -17.398 8.480 20.126 178 HD3 LYS 24 1HD LYS 24 -15.854 8.600 21.024 179 HE2 LYS 24 2HE LYS 24 -17.777 8.667 22.578 180 HE3 LYS 24 1HE LYS 24 -16.911 10.257 22.626 181 HZ1 LYS 24 3HZ LYS 24 -19.179 9.943 20.745 182 HZ2 LYS 24 1HZ LYS 24 -18.654 11.302 21.608 183 HZ3 LYS 24 2HZ LYS 24 -19.491 10.072 22.409 184 H LYS 25 H LYS 25 -13.031 9.236 17.748 185 HA LYS 25 HA LYS 25 -11.770 10.366 19.993 186 HB2 LYS 25 2HB LYS 25 -10.468 8.582 17.852 187 HB3 LYS 25 1HB LYS 25 -9.864 8.893 19.519 188 HG2 LYS 25 2HG LYS 25 -12.042 7.864 20.400 189 HG3 LYS 25 1HG LYS 25 -12.433 7.414 18.699 190 HD2 LYS 25 2HD LYS 25 -10.129 6.177 18.662 191 HD3 LYS 25 1HD LYS 25 -10.121 6.392 20.444 192 HE2 LYS 25 2HE LYS 25 -12.122 4.797 18.702 193 HE3 LYS 25 1HE LYS 25 -11.031 4.161 19.996 194 HZ1 LYS 25 3HZ LYS 25 -13.308 4.321 20.711 195 HZ2 LYS 25 1HZ LYS 25 -13.380 5.961 20.358 196 HZ3 LYS 25 2HZ LYS 25 -12.380 5.478 21.613 197 H ALA 26 H ALA 26 -11.312 10.763 16.479 198 HA ALA 26 HA ALA 26 -8.980 12.286 16.610 199 HB1 ALA 26 1HB ALA 26 -11.220 12.441 14.501 200 HB2 ALA 26 2HB ALA 26 -9.901 11.207 14.515 201 HB3 ALA 26 3HB ALA 26 -9.497 12.942 14.304 202 H VAL 27 H VAL 27 -12.415 13.290 17.007 203 HA VAL 27 HA VAL 27 -11.765 16.082 16.891 204 HB VAL 27 HB VAL 27 -14.178 14.661 18.163 205 HG11 VAL 27 1HG1 VAL 27 -15.273 16.973 17.948 206 HG12 VAL 27 2HG1 VAL 27 -13.653 17.661 17.557 207 HG13 VAL 27 3HG1 VAL 27 -13.963 16.929 19.171 208 HG21 VAL 27 3HG2 VAL 27 -15.354 15.303 16.098 209 HG22 VAL 27 1HG2 VAL 27 -13.897 14.370 15.641 210 HG23 VAL 27 2HG2 VAL 27 -13.886 16.152 15.471 211 H GLU 28 H GLU 28 -12.152 13.624 19.513 212 HA GLU 28 HA GLU 28 -11.878 15.546 21.577 213 HB2 GLU 28 2HB GLU 28 -11.262 12.529 21.666 214 HB3 GLU 28 1HB GLU 28 -11.350 13.626 23.089 215 HG2 GLU 28 2HG GLU 28 -13.779 14.131 22.472 216 HG3 GLU 28 1HG GLU 28 -13.682 12.838 21.219 217 H ALA 29 H ALA 29 -9.612 13.533 19.757 218 HA ALA 29 HA ALA 29 -7.312 14.284 21.291 219 HB1 ALA 29 1HB ALA 29 -7.653 12.013 20.189 220 HB2 ALA 29 2HB ALA 29 -6.168 12.822 19.635 221 HB3 ALA 29 3HB ALA 29 -7.618 12.833 18.584 222 H GLU 30 H GLU 30 -8.091 16.655 20.868 223 HA GLU 30 HA GLU 30 -6.400 17.835 18.891 224 HB2 GLU 30 2HB GLU 30 -8.288 17.457 17.349 225 HB3 GLU 30 1HB GLU 30 -9.484 18.002 18.549 226 HG2 GLU 30 2HG GLU 30 -7.316 19.969 17.641 227 HG3 GLU 30 1HG GLU 30 -8.650 19.572 16.520 228 H ARG 31 H ARG 31 -9.350 18.116 20.824 229 HA ARG 31 HA ARG 31 -9.246 20.717 21.492 230 HB2 ARG 31 2HB ARG 31 -10.235 18.617 23.539 231 HB3 ARG 31 1HB ARG 31 -10.860 20.276 23.235 232 HG2 ARG 31 2HG ARG 31 -11.124 17.740 21.506 233 HG3 ARG 31 1HG ARG 31 -12.389 18.491 22.504 234 HD2 ARG 31 2HD ARG 31 -11.395 20.549 20.659 235 HD3 ARG 31 1HD ARG 31 -11.586 19.012 19.722 236 HE ARG 31 HE ARG 31 -13.884 19.681 21.468 237 HH11 ARG 31 1HH2 ARG 31 -12.195 20.458 18.344 238 HH12 ARG 31 2HH2 ARG 31 -13.580 21.258 17.690 239 HH21 ARG 31 1HH1 ARG 31 -15.865 20.294 20.267 240 HH22 ARG 31 2HH1 ARG 31 -15.794 20.813 18.630 241 H GLY 32 H GLY 32 -7.098 21.418 22.092 242 HA2 GLY 32 2HA GLY 32 -6.148 22.326 24.035 243 HA3 GLY 32 1HA GLY 32 -6.466 20.800 24.924 244 H ALA 33 H ALA 33 -5.361 20.234 21.690 245 HA ALA 33 HA ALA 33 -2.717 19.600 22.743 246 HB1 ALA 33 1HB ALA 33 -3.769 17.800 21.471 247 HB2 ALA 33 2HB ALA 33 -2.381 18.449 20.519 248 HB3 ALA 33 3HB ALA 33 -4.079 18.913 20.097 249 HA PRO 34 HA PRO 34 -1.536 23.434 20.737 250 HB2 PRO 34 2HB PRO 34 1.247 23.368 21.037 251 HB3 PRO 34 1HB PRO 34 0.108 23.647 22.409 252 HG2 PRO 34 2HG PRO 34 1.427 21.010 21.582 253 HG3 PRO 34 1HG PRO 34 1.314 21.736 23.240 254 HD2 PRO 34 2HD PRO 34 -0.467 19.799 22.335 255 HD3 PRO 34 1HD PRO 34 -1.015 21.155 23.426 256 H GLY 35 H GLY 35 -1.380 23.930 18.521 257 HA2 GLY 35 2HA GLY 35 -0.731 23.825 16.426 258 HA3 GLY 35 1HA GLY 35 0.710 22.878 16.967 259 H ALA 36 H ALA 36 -2.656 21.902 17.507 260 HA ALA 36 HA ALA 36 -2.198 19.502 15.912 261 HB1 ALA 36 1HB ALA 36 -3.256 19.166 18.164 262 HB2 ALA 36 2HB ALA 36 -4.414 18.738 16.857 263 HB3 ALA 36 3HB ALA 36 -4.574 20.309 17.723 264 H ALA 37 H ALA 37 -4.104 18.890 14.432 265 HA ALA 37 HA ALA 37 -5.659 21.094 13.495 266 HB1 ALA 37 1HB ALA 37 -5.222 20.379 11.063 267 HB2 ALA 37 2HB ALA 37 -3.895 19.311 11.653 268 HB3 ALA 37 3HB ALA 37 -3.747 21.094 11.799 269 H LEU 38 H LEU 38 -7.311 19.753 12.001 270 HA LEU 38 HA LEU 38 -8.658 18.014 11.680 271 HB2 LEU 38 2HB LEU 38 -6.563 16.475 12.136 272 HB3 LEU 38 1HB LEU 38 -7.227 16.325 13.782 273 HG LEU 38 HG LEU 38 -8.486 15.344 11.154 274 HD11 LEU 38 1HD1 LEU 38 -8.143 13.118 12.371 275 HD12 LEU 38 2HD1 LEU 38 -7.275 14.005 13.663 276 HD13 LEU 38 3HD1 LEU 38 -6.615 13.982 11.984 277 HD21 LEU 38 3HD2 LEU 38 -10.359 16.110 12.597 278 HD22 LEU 38 1HD2 LEU 38 -9.649 15.258 14.015 279 HD23 LEU 38 2HD2 LEU 38 -10.265 14.312 12.605 280 H ILE 39 H ILE 39 -10.386 19.322 12.539 281 HA ILE 39 HA ILE 39 -10.708 19.279 15.430 282 HB ILE 39 HB ILE 39 -9.390 21.236 15.115 283 HG12 ILE 39 2HG1 ILE 39 -12.240 22.344 14.769 284 HG13 ILE 39 1HG1 ILE 39 -11.605 21.633 16.289 285 HG21 ILE 39 1HG2 ILE 39 -9.751 22.886 13.227 286 HG22 ILE 39 2HG2 ILE 39 -10.955 21.774 12.500 287 HG23 ILE 39 3HG2 ILE 39 -9.219 21.290 12.656 288 HD11 ILE 39 3HD ILE 39 -10.451 24.117 14.857 289 HD12 ILE 39 1HD ILE 39 -11.410 24.089 16.378 290 HD13 ILE 39 2HD ILE 39 -9.773 23.347 16.344 291 H SER 40 H SER 40 -12.896 19.333 15.900 292 HA SER 40 HA SER 40 -15.001 19.514 15.765 293 HB2 SER 40 2HB SER 40 -14.410 21.644 14.353 294 HB3 SER 40 1HB SER 40 -15.056 20.715 12.961 295 HG SER 40 1HG SER 40 -16.529 22.083 14.095 296 H TYR 41 H TYR 41 -16.762 18.242 15.305 297 HA TYR 41 HA TYR 41 -16.337 15.785 14.279 298 HB2 TYR 41 2HB TYR 41 -19.172 16.942 14.348 299 HB3 TYR 41 1HB TYR 41 -18.633 15.256 14.638 300 HD1 TYR 41 2HD TYR 41 -18.834 18.694 16.003 301 HD2 TYR 41 1HD TYR 41 -17.670 14.640 16.841 302 HE1 TYR 41 2HE TYR 41 -18.704 19.234 18.393 303 HE2 TYR 41 1HE TYR 41 -17.539 15.173 19.241 304 HH TYR 41 HH TYR 41 -18.785 18.242 20.493 305 HA PRO 42 HA PRO 42 -18.584 16.445 10.263 306 HB2 PRO 42 2HB PRO 42 -19.005 18.941 9.091 307 HB3 PRO 42 1HB PRO 42 -20.092 18.299 10.368 308 HG2 PRO 42 2HG PRO 42 -17.648 20.137 10.764 309 HG3 PRO 42 1HG PRO 42 -19.340 20.465 11.294 310 HD2 PRO 42 2HD PRO 42 -17.562 19.347 13.012 311 HD3 PRO 42 1HD PRO 42 -19.247 18.651 12.941 312 H ASP 43 H ASP 43 -15.674 18.018 11.109 313 HA ASP 43 HA ASP 43 -14.660 18.046 8.340 314 HB2 ASP 43 2HB ASP 43 -14.023 19.561 10.850 315 HB3 ASP 43 1HB ASP 43 -12.560 18.807 10.156 316 H ALA 44 H ALA 44 -14.094 16.883 11.691 317 HA ALA 44 HA ALA 44 -11.951 15.256 11.171 318 HB1 ALA 44 1HB ALA 44 -14.173 14.880 13.281 319 HB2 ALA 44 2HB ALA 44 -12.692 15.884 13.490 320 HB3 ALA 44 3HB ALA 44 -12.549 14.100 13.341 321 H ILE 45 H ILE 45 -15.441 14.525 10.904 322 HA ILE 45 HA ILE 45 -15.059 11.761 10.587 323 HB ILE 45 HB ILE 45 -17.184 12.843 11.251 324 HG12 ILE 45 2HG1 ILE 45 -17.362 10.942 8.831 325 HG13 ILE 45 1HG1 ILE 45 -17.043 10.469 10.530 326 HG21 ILE 45 1HG2 ILE 45 -17.094 14.708 9.510 327 HG22 ILE 45 2HG2 ILE 45 -18.672 13.862 9.604 328 HG23 ILE 45 3HG2 ILE 45 -17.541 13.501 8.252 329 HD11 ILE 45 3HD ILE 45 -19.633 11.799 9.477 330 HD12 ILE 45 1HD ILE 45 -19.422 10.089 9.979 331 HD13 ILE 45 2HD ILE 45 -19.297 11.402 11.207 332 H TRP 46 H TRP 46 -14.694 14.459 8.345 333 HA TRP 46 HA TRP 46 -14.895 12.709 6.066 334 HB2 TRP 46 2HB TRP 46 -15.172 15.528 6.505 335 HB3 TRP 46 1HB TRP 46 -13.714 15.365 5.487 336 HD1 TRP 46 HD TRP 46 -14.162 14.074 3.006 337 HE1 TRP 46 1HE TRP 46 -16.168 14.622 1.558 338 HE3 TRP 46 3HE TRP 46 -17.537 15.497 6.544 339 HZ2 TRP 46 2HZ TRP 46 -19.041 14.710 1.834 340 HZ3 TRP 46 3HZ TRP 46 -19.903 15.796 5.904 341 HH2 TRP 46 HH TRP 46 -20.640 15.399 3.575 342 H TRP 47 H TRP 47 -12.445 13.906 8.215 343 HA TRP 47 HA TRP 47 -10.206 13.278 6.544 344 HB2 TRP 47 2HB TRP 47 -9.944 14.841 8.427 345 HB3 TRP 47 1HB TRP 47 -10.542 13.610 9.592 346 HD1 TRP 47 HD TRP 47 -7.338 14.274 7.398 347 HE1 TRP 47 1HE TRP 47 -5.589 12.589 8.108 348 HE3 TRP 47 3HE TRP 47 -10.053 11.659 10.826 349 HZ2 TRP 47 2HZ TRP 47 -5.194 10.660 10.200 350 HZ3 TRP 47 3HZ TRP 47 -8.977 9.795 12.045 351 HH2 TRP 47 HH TRP 47 -6.589 9.290 11.702 352 H SER 48 H SER 48 -12.257 11.607 8.910 353 HA SER 48 HA SER 48 -10.637 9.285 9.127 354 HB2 SER 48 2HB SER 48 -12.320 10.311 10.857 355 HB3 SER 48 1HB SER 48 -13.612 9.523 9.891 356 HG SER 48 1HG SER 48 -13.128 8.007 11.292 357 H VAL 49 H VAL 49 -10.583 9.289 6.654 358 HA VAL 49 HA VAL 49 -12.477 7.333 5.588 359 HB VAL 49 HB VAL 49 -11.695 10.019 4.252 360 HG11 VAL 49 1HG1 VAL 49 -13.156 9.196 2.351 361 HG12 VAL 49 2HG1 VAL 49 -13.314 7.605 3.173 362 HG13 VAL 49 3HG1 VAL 49 -11.714 8.150 2.563 363 HG21 VAL 49 3HG2 VAL 49 -14.156 10.456 4.255 364 HG22 VAL 49 1HG2 VAL 49 -13.504 10.326 5.917 365 HG23 VAL 49 2HG2 VAL 49 -14.422 8.949 5.218 366 H GLU 50 H GLU 50 -9.772 9.519 4.528 367 HA GLU 50 HA GLU 50 -8.783 7.542 2.871 368 HB2 GLU 50 2HB GLU 50 -6.971 8.967 2.301 369 HB3 GLU 50 1HB GLU 50 -8.414 9.996 2.496 370 HG2 GLU 50 2HG GLU 50 -7.581 10.781 4.734 371 HG3 GLU 50 1HG GLU 50 -6.159 9.673 4.630 372 H THR 51 H THR 51 -8.143 8.269 6.176 373 HA THR 51 HA THR 51 -5.586 7.148 6.401 374 HB THR 51 HB THR 51 -6.275 8.775 7.992 375 HG1 THR 51 1HG THR 51 -5.166 6.888 8.866 376 HG21 THR 51 3HG2 THR 51 -8.720 8.657 7.810 377 HG22 THR 51 1HG2 THR 51 -8.279 8.385 9.516 378 HG23 THR 51 2HG2 THR 51 -8.750 6.986 8.503 379 H ALA 52 H ALA 52 -8.903 5.753 6.395 380 HA ALA 52 HA ALA 52 -7.938 3.252 7.467 381 HB1 ALA 52 1HB ALA 52 -10.185 2.353 6.881 382 HB2 ALA 52 2HB ALA 52 -10.603 3.918 6.080 383 HB3 ALA 52 3HB ALA 52 -10.298 3.841 7.863 384 H THR 53 H THR 53 -8.219 4.779 4.251 385 HA THR 53 HA THR 53 -7.767 2.205 2.980 386 HB THR 53 HB THR 53 -7.586 3.708 0.895 387 HG1 THR 53 1HG THR 53 -7.318 5.647 2.145 388 HG21 THR 53 3HG2 THR 53 -10.189 3.624 2.579 389 HG22 THR 53 1HG2 THR 53 -9.575 2.305 1.510 390 HG23 THR 53 2HG2 THR 53 -10.085 3.881 0.799 391 H THR 54 H THR 54 -5.871 3.910 4.932 392 HA THR 54 HA THR 54 -3.803 4.316 5.208 393 HB THR 54 HB THR 54 -4.079 1.944 5.592 394 HG1 THR 54 1HG THR 54 -1.520 2.830 4.766 395 HG21 THR 54 3HG2 THR 54 -4.482 1.062 3.318 396 HG22 THR 54 1HG2 THR 54 -3.066 0.250 4.062 397 HG23 THR 54 2HG2 THR 54 -2.818 1.511 2.807 398 H VAL 55 H VAL 55 -4.420 5.970 3.267 399 HA VAL 55 HA VAL 55 -1.973 5.937 1.609 400 HB VAL 55 HB VAL 55 -3.295 7.806 0.305 401 HG11 VAL 55 1HG1 VAL 55 -2.409 5.689 -0.613 402 HG12 VAL 55 2HG1 VAL 55 -4.048 6.028 -1.289 403 HG13 VAL 55 3HG1 VAL 55 -3.834 4.779 0.005 404 HG21 VAL 55 3HG2 VAL 55 -5.637 5.984 1.241 405 HG22 VAL 55 1HG2 VAL 55 -5.737 7.393 0.131 406 HG23 VAL 55 2HG2 VAL 55 -5.392 7.653 1.878 407 H GLY 56 H GLY 56 -3.920 8.767 2.154 408 HA2 GLY 56 2HA GLY 56 -3.684 10.191 4.082 409 HA3 GLY 56 1HA GLY 56 -1.961 9.629 4.201 410 H TYR 57 H TYR 57 -4.357 11.039 1.820 411 HA TYR 57 HA TYR 57 -2.297 11.632 -0.033 412 HB2 TYR 57 2HB TYR 57 -4.750 11.235 -0.671 413 HB3 TYR 57 1HB TYR 57 -5.178 12.776 0.156 414 HD1 TYR 57 1HD TYR 57 -4.381 14.942 -0.789 415 HD2 TYR 57 2HD TYR 57 -3.675 11.244 -2.858 416 HE1 TYR 57 1HE TYR 57 -3.564 16.188 -2.729 417 HE2 TYR 57 2HE TYR 57 -2.885 12.503 -4.834 418 HH TYR 57 HH TYR 57 -1.969 14.538 -5.463 419 H GLY 58 H GLY 58 -3.797 13.246 2.696 420 HA2 GLY 58 2HA GLY 58 -2.346 14.627 3.910 421 HA3 GLY 58 1HA GLY 58 -1.688 15.314 2.394 422 H ASP 59 H ASP 59 -5.135 14.865 3.633 423 HA ASP 59 HA ASP 59 -5.423 17.686 2.988 424 HB2 ASP 59 2HB ASP 59 -7.587 17.910 3.212 425 HB3 ASP 59 1HB ASP 59 -7.355 16.379 2.322 426 H ARG 60 H ARG 60 -4.705 15.732 5.862 427 HA ARG 60 HA ARG 60 -4.349 18.238 7.257 428 HB2 ARG 60 2HB ARG 60 -6.061 15.945 8.412 429 HB3 ARG 60 1HB ARG 60 -5.552 17.408 9.318 430 HG2 ARG 60 2HG ARG 60 -6.859 18.826 7.690 431 HG3 ARG 60 1HG ARG 60 -7.423 17.360 6.851 432 HD2 ARG 60 2HD ARG 60 -8.875 16.662 8.500 433 HD3 ARG 60 1HD ARG 60 -7.965 17.461 9.830 434 HE ARG 60 HE ARG 60 -10.151 18.607 8.265 435 HH11 ARG 60 1HH2 ARG 60 -7.023 19.602 9.574 436 HH12 ARG 60 2HH2 ARG 60 -7.422 21.210 9.918 437 HH21 ARG 60 1HH1 ARG 60 -10.897 20.778 8.849 438 HH22 ARG 60 2HH1 ARG 60 -9.806 21.880 9.580 439 H TYR 61 H TYR 61 -3.398 17.392 9.684 440 HA TYR 61 HA TYR 61 -1.895 15.015 9.331 441 HB2 TYR 61 2HB TYR 61 0.261 16.107 10.070 442 HB3 TYR 61 1HB TYR 61 -0.228 16.577 8.408 443 HD1 TYR 61 2HD TYR 61 -1.231 18.886 8.013 444 HD2 TYR 61 1HD TYR 61 0.420 17.733 11.806 445 HE1 TYR 61 2HE TYR 61 -1.132 21.262 8.689 446 HE2 TYR 61 1HE TYR 61 0.530 20.073 12.491 447 HH TYR 61 HH TYR 61 0.147 22.248 11.930 448 HA PRO 62 HA PRO 62 -3.180 15.717 13.684 449 HB2 PRO 62 2HB PRO 62 -2.392 13.287 14.782 450 HB3 PRO 62 1HB PRO 62 -3.714 13.346 13.563 451 HG2 PRO 62 2HG PRO 62 -0.743 12.713 13.104 452 HG3 PRO 62 1HG PRO 62 -2.184 11.763 12.548 453 HD2 PRO 62 2HD PRO 62 -0.846 13.683 10.976 454 HD3 PRO 62 1HD PRO 62 -2.626 13.319 10.787 455 H VAL 63 H VAL 63 -1.753 15.208 15.979 456 HA VAL 63 HA VAL 63 0.978 16.088 15.378 457 HB VAL 63 HB VAL 63 -0.237 17.973 16.104 458 HG11 VAL 63 1HG1 VAL 63 -0.868 16.527 18.760 459 HG12 VAL 63 2HG1 VAL 63 -2.017 17.048 17.478 460 HG13 VAL 63 3HG1 VAL 63 -1.089 18.274 18.398 461 HG21 VAL 63 3HG2 VAL 63 2.171 17.825 16.537 462 HG22 VAL 63 1HG2 VAL 63 1.893 17.157 18.184 463 HG23 VAL 63 2HG2 VAL 63 1.311 18.802 17.775 464 H THR 64 H THR 64 0.800 15.629 18.600 465 HA THR 64 HA THR 64 1.529 12.778 18.498 466 HB THR 64 HB THR 64 3.028 15.227 19.604 467 HG1 THR 64 1HG THR 64 3.512 14.508 17.509 468 HG21 THR 64 3HG2 THR 64 3.583 12.288 20.391 469 HG22 THR 64 1HG2 THR 64 3.078 13.615 21.491 470 HG23 THR 64 2HG2 THR 64 4.679 13.679 20.681 471 H GLU 65 H GLU 65 0.378 15.649 20.320 472 HA GLU 65 HA GLU 65 -0.144 14.106 22.655 473 HB2 GLU 65 2HB GLU 65 0.695 16.514 22.593 474 HB3 GLU 65 1HB GLU 65 -0.908 17.014 21.950 475 HG2 GLU 65 2HG GLU 65 -0.595 17.464 24.405 476 HG3 GLU 65 1HG GLU 65 -1.979 16.357 24.101 477 H GLU 66 H GLU 66 -1.681 14.207 19.709 478 HA GLU 66 HA GLU 66 -4.399 14.209 20.705 479 HB2 GLU 66 2HB GLU 66 -4.745 13.229 18.248 480 HB3 GLU 66 1HB GLU 66 -4.523 14.976 18.579 481 HG2 GLU 66 2HG GLU 66 -3.311 14.398 16.617 482 HG3 GLU 66 1HG GLU 66 -2.143 14.861 17.914 483 H GLY 67 H GLY 67 -1.754 12.113 19.721 484 HA2 GLY 67 2HA GLY 67 -1.047 10.470 21.217 485 HA3 GLY 67 1HA GLY 67 -2.789 10.062 21.570 486 H ARG 68 H ARG 68 -0.909 10.827 18.653 487 HA ARG 68 HA ARG 68 -1.494 10.006 16.611 488 HB2 ARG 68 2HB ARG 68 0.820 10.493 17.239 489 HB3 ARG 68 1HB ARG 68 1.094 8.763 17.630 490 HG2 ARG 68 2HG ARG 68 0.821 8.111 15.301 491 HG3 ARG 68 1HG ARG 68 0.166 9.715 14.843 492 HD2 ARG 68 2HD ARG 68 3.061 9.260 15.873 493 HD3 ARG 68 1HD ARG 68 2.580 9.333 14.123 494 HE ARG 68 HE ARG 68 1.565 11.659 15.594 495 HH11 ARG 68 1HH2 ARG 68 4.704 10.369 14.285 496 HH12 ARG 68 2HH2 ARG 68 5.150 11.892 13.584 497 HH21 ARG 68 1HH1 ARG 68 2.230 13.654 14.628 498 HH22 ARG 68 2HH1 ARG 68 3.685 13.761 13.684 499 H LYS 69 H LYS 69 -1.325 7.461 18.901 500 HA LYS 69 HA LYS 69 -1.885 5.232 17.323 501 HB2 LYS 69 2HB LYS 69 -2.919 5.847 20.148 502 HB3 LYS 69 1HB LYS 69 -2.749 4.232 19.381 503 HG2 LYS 69 2HG LYS 69 -0.458 6.134 20.230 504 HG3 LYS 69 1HG LYS 69 -1.007 4.640 21.067 505 HD2 LYS 69 2HD LYS 69 -0.344 3.283 19.025 506 HD3 LYS 69 1HD LYS 69 0.214 4.777 18.227 507 HE2 LYS 69 2HE LYS 69 2.146 3.552 19.092 508 HE3 LYS 69 1HE LYS 69 1.978 5.112 19.987 509 HZ1 LYS 69 3HZ LYS 69 1.054 2.429 20.962 510 HZ2 LYS 69 1HZ LYS 69 0.957 3.886 21.804 511 HZ3 LYS 69 2HZ LYS 69 2.463 3.203 21.440 512 H VAL 70 H VAL 70 -3.855 8.060 18.202 513 HA VAL 70 HA VAL 70 -6.388 6.915 17.690 514 HB VAL 70 HB VAL 70 -5.374 9.803 17.447 515 HG11 VAL 70 1HG1 VAL 70 -7.405 9.605 16.042 516 HG12 VAL 70 2HG1 VAL 70 -7.841 10.409 17.584 517 HG13 VAL 70 3HG1 VAL 70 -8.255 8.671 17.326 518 HG21 VAL 70 3HG2 VAL 70 -6.961 8.299 19.651 519 HG22 VAL 70 1HG2 VAL 70 -6.555 10.054 19.653 520 HG23 VAL 70 2HG2 VAL 70 -5.248 8.846 19.767 521 H ALA 71 H ALA 71 -4.055 8.714 15.599 522 HA ALA 71 HA ALA 71 -5.612 8.354 13.265 523 HB1 ALA 71 1HB ALA 71 -3.570 9.153 12.038 524 HB2 ALA 71 2HB ALA 71 -2.603 9.000 13.556 525 HB3 ALA 71 3HB ALA 71 -3.928 10.216 13.446 526 H GLU 72 H GLU 72 -2.737 6.699 14.643 527 HA GLU 72 HA GLU 72 -2.250 4.923 12.585 528 HB2 GLU 72 2HB GLU 72 -0.774 5.225 14.708 529 HB3 GLU 72 1HB GLU 72 -1.980 4.214 15.562 530 HG2 GLU 72 2HG GLU 72 -1.458 2.389 13.710 531 HG3 GLU 72 1HG GLU 72 -0.013 3.386 13.340 532 H GLN 73 H GLN 73 -4.605 4.717 15.281 533 HA GLN 73 HA GLN 73 -5.216 2.044 15.090 534 HB2 GLN 73 2HB GLN 73 -6.083 3.423 16.966 535 HB3 GLN 73 1HB GLN 73 -7.069 4.391 15.822 536 HG2 GLN 73 2HG GLN 73 -8.490 2.871 17.106 537 HG3 GLN 73 1HG GLN 73 -8.519 2.338 15.394 538 HE21 GLN 73 1HE2 GLN 73 -7.167 0.398 14.823 539 HE22 GLN 73 2HE2 GLN 73 -6.662 -0.724 16.053 540 H VAL 74 H VAL 74 -6.427 4.799 13.145 541 HA VAL 74 HA VAL 74 -8.531 3.268 12.028 542 HB VAL 74 HB VAL 74 -7.442 5.702 10.605 543 HG11 VAL 74 1HG1 VAL 74 -10.271 4.644 11.328 544 HG12 VAL 74 2HG1 VAL 74 -9.434 4.444 9.742 545 HG13 VAL 74 3HG1 VAL 74 -9.909 6.086 10.311 546 HG21 VAL 74 3HG2 VAL 74 -8.776 7.128 12.249 547 HG22 VAL 74 1HG2 VAL 74 -7.239 6.483 12.890 548 HG23 VAL 74 2HG2 VAL 74 -8.802 5.720 13.377 549 H MET 75 H MET 75 -5.161 4.005 11.128 550 HA MET 75 HA MET 75 -5.177 3.110 8.511 551 HB2 MET 75 2HB MET 75 -2.831 2.632 10.455 552 HB3 MET 75 1HB MET 75 -2.758 2.769 8.669 553 HG2 MET 75 2HG MET 75 -3.531 5.032 10.614 554 HG3 MET 75 1HG MET 75 -1.882 4.710 10.020 555 HE1 MET 75 3HE MET 75 -3.454 7.415 10.014 556 HE2 MET 75 1HE MET 75 -2.858 8.079 8.449 557 HE3 MET 75 2HE MET 75 -1.747 7.160 9.515 558 H LYS 76 H LYS 76 -4.277 1.305 11.486 559 HA LYS 76 HA LYS 76 -3.906 -1.122 10.110 560 HB2 LYS 76 2HB LYS 76 -2.825 -0.661 12.296 561 HB3 LYS 76 1HB LYS 76 -4.425 -0.740 13.112 562 HG2 LYS 76 2HG LYS 76 -4.689 -3.105 12.562 563 HG3 LYS 76 1HG LYS 76 -3.256 -3.097 11.484 564 HD2 LYS 76 2HD LYS 76 -3.148 -2.612 14.528 565 HD3 LYS 76 1HD LYS 76 -2.999 -4.227 13.749 566 HE2 LYS 76 2HE LYS 76 -0.971 -3.457 12.458 567 HE3 LYS 76 1HE LYS 76 -1.088 -1.845 13.267 568 HZ1 LYS 76 3HZ LYS 76 0.376 -2.834 14.558 569 HZ2 LYS 76 1HZ LYS 76 -0.220 -4.451 14.338 570 HZ3 LYS 76 2HZ LYS 76 -0.997 -3.370 15.398 571 H ALA 77 H ALA 77 -6.784 0.400 11.464 572 HA ALA 77 HA ALA 77 -8.315 -1.964 11.636 573 HB1 ALA 77 1HB ALA 77 -10.268 -0.545 11.823 574 HB2 ALA 77 2HB ALA 77 -9.364 0.888 11.176 575 HB3 ALA 77 3HB ALA 77 -8.953 0.195 12.793 576 H GLY 78 H GLY 78 -7.317 0.050 8.928 577 HA2 GLY 78 2HA GLY 78 -9.275 -1.105 7.135 578 HA3 GLY 78 1HA GLY 78 -7.893 0.000 6.781 579 H ILE 79 H ILE 79 -5.858 -1.504 8.023 580 HA ILE 79 HA ILE 79 -5.048 -3.112 5.941 581 HB ILE 79 HB ILE 79 -4.143 -3.038 8.855 582 HG12 ILE 79 2HG1 ILE 79 -3.923 -0.883 7.465 583 HG13 ILE 79 1HG1 ILE 79 -2.421 -1.517 8.188 584 HG21 ILE 79 1HG2 ILE 79 -1.967 -4.040 8.045 585 HG22 ILE 79 2HG2 ILE 79 -2.744 -4.356 6.451 586 HG23 ILE 79 3HG2 ILE 79 -3.345 -5.186 7.939 587 HD11 ILE 79 3HD ILE 79 -3.241 -1.873 5.228 588 HD12 ILE 79 1HD ILE 79 -2.085 -0.660 5.878 589 HD13 ILE 79 2HD ILE 79 -1.681 -2.401 5.974 590 H GLU 80 H GLU 80 -6.627 -4.085 9.045 591 HA GLU 80 HA GLU 80 -6.408 -6.855 8.506 592 HB2 GLU 80 2HB GLU 80 -8.485 -5.408 10.268 593 HB3 GLU 80 1HB GLU 80 -8.266 -7.185 10.170 594 HG2 GLU 80 2HG GLU 80 -5.834 -6.852 10.964 595 HG3 GLU 80 1HG GLU 80 -6.256 -5.130 11.290 596 H VAL 81 H VAL 81 -8.821 -4.405 7.560 597 HA VAL 81 HA VAL 81 -10.809 -6.267 6.783 598 HB VAL 81 HB VAL 81 -10.381 -3.287 6.257 599 HG11 VAL 81 1HG1 VAL 81 -12.762 -5.061 5.388 600 HG12 VAL 81 2HG1 VAL 81 -11.691 -4.078 4.322 601 HG13 VAL 81 3HG1 VAL 81 -12.799 -3.268 5.473 602 HG21 VAL 81 3HG2 VAL 81 -12.239 -3.074 7.910 603 HG22 VAL 81 1HG2 VAL 81 -10.900 -4.026 8.628 604 HG23 VAL 81 2HG2 VAL 81 -12.376 -4.864 8.033 605 H PHE 82 H PHE 82 -8.580 -4.148 4.850 606 HA PHE 82 HA PHE 82 -9.390 -5.346 2.411 607 HB2 PHE 82 2HB PHE 82 -6.883 -3.667 3.085 608 HB3 PHE 82 1HB PHE 82 -7.342 -4.176 1.416 609 HD1 PHE 82 1HD PHE 82 -9.785 -3.637 0.662 610 HD2 PHE 82 2HD PHE 82 -7.727 -1.566 3.821 611 HE1 PHE 82 1HE PHE 82 -11.320 -1.718 0.409 612 HE2 PHE 82 2HE PHE 82 -9.272 0.338 3.586 613 HZ PHE 82 HZ PHE 82 -11.075 0.276 1.877 614 H ALA 83 H ALA 83 -7.268 -6.455 4.895 615 HA ALA 83 HA ALA 83 -5.735 -8.188 3.179 616 HB1 ALA 83 1HB ALA 83 -5.028 -9.333 5.299 617 HB2 ALA 83 2HB ALA 83 -6.198 -8.324 6.234 618 HB3 ALA 83 3HB ALA 83 -4.799 -7.564 5.406 619 H LEU 84 H LEU 84 -8.559 -8.492 5.395 620 HA LEU 84 HA LEU 84 -8.761 -11.238 5.337 621 HB2 LEU 84 2HB LEU 84 -9.825 -9.645 6.952 622 HB3 LEU 84 1HB LEU 84 -11.027 -9.175 5.718 623 HG LEU 84 HG LEU 84 -10.701 -12.124 6.465 624 HD11 LEU 84 1HD1 LEU 84 -12.197 -10.093 8.238 625 HD12 LEU 84 2HD1 LEU 84 -10.671 -10.981 8.649 626 HD13 LEU 84 3HD1 LEU 84 -12.208 -11.890 8.421 627 HD21 LEU 84 3HD2 LEU 84 -13.157 -12.216 6.164 628 HD22 LEU 84 1HD2 LEU 84 -12.395 -11.540 4.690 629 HD23 LEU 84 2HD2 LEU 84 -13.230 -10.441 5.852 630 H VAL 85 H VAL 85 -10.156 -8.806 3.117 631 HA VAL 85 HA VAL 85 -11.915 -10.528 1.830 632 HB VAL 85 HB VAL 85 -12.075 -8.909 0.037 633 HG11 VAL 85 1HG1 VAL 85 -12.799 -6.995 1.388 634 HG12 VAL 85 2HG1 VAL 85 -11.715 -7.439 2.744 635 HG13 VAL 85 3HG1 VAL 85 -13.124 -8.475 2.354 636 HG21 VAL 85 3HG2 VAL 85 -9.633 -8.363 -0.281 637 HG22 VAL 85 1HG2 VAL 85 -9.605 -7.586 1.342 638 HG23 VAL 85 2HG2 VAL 85 -10.584 -6.876 0.017 639 H THR 86 H THR 86 -8.507 -10.686 1.771 640 HA THR 86 HA THR 86 -8.063 -11.576 -0.829 641 HB THR 86 HB THR 86 -6.497 -12.380 1.660 642 HG1 THR 86 1HG THR 86 -6.469 -10.266 1.671 643 HG21 THR 86 3HG2 THR 86 -4.569 -12.459 0.021 644 HG22 THR 86 1HG2 THR 86 -5.698 -12.114 -1.337 645 HG23 THR 86 2HG2 THR 86 -5.826 -13.662 -0.415 646 H ALA 87 H ALA 87 -9.709 -13.104 1.840 647 HA ALA 87 HA ALA 87 -9.420 -15.784 1.087 648 HB1 ALA 87 1HB ALA 87 -10.511 -15.067 3.239 649 HB2 ALA 87 2HB ALA 87 -11.579 -16.157 2.301 650 HB3 ALA 87 3HB ALA 87 -11.881 -14.375 2.309 651 H ALA 88 H ALA 88 -11.167 -13.126 -0.431 652 HA ALA 88 HA ALA 88 -12.726 -14.932 -2.114 653 HB1 ALA 88 1HB ALA 88 -13.788 -12.733 -1.444 654 HB2 ALA 88 2HB ALA 88 -13.546 -12.843 -3.229 655 HB3 ALA 88 3HB ALA 88 -12.424 -11.860 -2.223 656 H LEU 89 H LEU 89 -9.989 -12.620 -2.282 657 HA LEU 89 HA LEU 89 -9.655 -12.721 -5.008 658 HB2 LEU 89 2HB LEU 89 -7.436 -12.273 -2.931 659 HB3 LEU 89 1HB LEU 89 -7.394 -11.767 -4.651 660 HG LEU 89 HG LEU 89 -9.374 -10.696 -2.537 661 HD11 LEU 89 1HD1 LEU 89 -8.020 -8.627 -2.561 662 HD12 LEU 89 2HD1 LEU 89 -6.850 -9.368 -3.711 663 HD13 LEU 89 3HD1 LEU 89 -7.011 -10.019 -2.043 664 HD21 LEU 89 3HD2 LEU 89 -10.335 -10.540 -4.836 665 HD22 LEU 89 1HD2 LEU 89 -8.822 -9.750 -5.420 666 HD23 LEU 89 2HD2 LEU 89 -9.869 -8.917 -4.221 667 H ALA 90 H ALA 90 -8.101 -14.772 -2.506 668 HA ALA 90 HA ALA 90 -6.320 -15.965 -4.360 669 HB1 ALA 90 1HB ALA 90 -7.272 -16.902 -1.602 670 HB2 ALA 90 2HB ALA 90 -5.817 -15.901 -1.939 671 HB3 ALA 90 3HB ALA 90 -5.875 -17.606 -2.515 672 H THR 91 H THR 91 -9.733 -16.388 -4.019 673 HA THR 91 HA THR 91 -9.621 -19.142 -4.950 674 HB THR 91 HB THR 91 -12.013 -19.142 -5.178 675 HG1 THR 91 1HG THR 91 -11.840 -16.376 -4.536 676 HG21 THR 91 3HG2 THR 91 -12.565 -18.969 -2.766 677 HG22 THR 91 1HG2 THR 91 -11.106 -17.947 -2.480 678 HG23 THR 91 2HG2 THR 91 -10.928 -19.665 -3.000 679 H ASP 92 H ASP 92 -9.304 -15.957 -6.351 680 HA ASP 92 HA ASP 92 -11.061 -16.551 -8.453 681 HB2 ASP 92 2HB ASP 92 -10.228 -14.179 -7.483 682 HB3 ASP 92 1HB ASP 92 -9.089 -14.299 -8.874 683 H PHE 93 H PHE 93 -7.687 -17.203 -7.996 684 HA PHE 93 HA PHE 93 -7.221 -17.748 -10.774 685 HB2 PHE 93 2HB PHE 93 -5.069 -18.452 -10.271 686 HB3 PHE 93 1HB PHE 93 -5.377 -17.242 -8.995 687 HD1 PHE 93 2HD PHE 93 -5.699 -17.983 -6.632 688 HD2 PHE 93 1HD PHE 93 -4.802 -20.814 -9.737 689 HE1 PHE 93 2HE PHE 93 -5.002 -19.627 -4.932 690 HE2 PHE 93 1HE PHE 93 -4.106 -22.463 -8.033 691 HZ PHE 93 HZ PHE 93 -4.177 -21.866 -5.625 692 H VAL 94 H VAL 94 -8.566 -19.494 -8.040 693 HA VAL 94 HA VAL 94 -7.957 -22.101 -8.902 694 HB VAL 94 HB VAL 94 -10.164 -21.186 -6.971 695 HG11 VAL 94 1HG1 VAL 94 -9.798 -23.465 -5.946 696 HG12 VAL 94 2HG1 VAL 94 -8.651 -23.876 -7.270 697 HG13 VAL 94 3HG1 VAL 94 -10.393 -23.587 -7.634 698 HG21 VAL 94 3HG2 VAL 94 -7.179 -21.836 -6.461 699 HG22 VAL 94 1HG2 VAL 94 -8.413 -21.533 -5.188 700 HG23 VAL 94 2HG2 VAL 94 -7.940 -20.216 -6.300 701 H ARG 95 H ARG 95 -10.580 -19.836 -9.365 702 HA ARG 95 HA ARG 95 -12.514 -21.483 -10.510 703 HB2 ARG 95 2HB ARG 95 -11.815 -18.519 -10.967 704 HB3 ARG 95 1HB ARG 95 -13.288 -19.306 -11.630 705 HG2 ARG 95 2HG ARG 95 -14.157 -19.799 -9.450 706 HG3 ARG 95 1HG ARG 95 -12.680 -19.179 -8.612 707 HD2 ARG 95 2HD ARG 95 -13.109 -16.901 -9.222 708 HD3 ARG 95 1HD ARG 95 -14.325 -17.355 -10.475 709 HE ARG 95 HE ARG 95 -15.784 -18.230 -8.652 710 HH11 ARG 95 1HH2 ARG 95 -13.605 -15.320 -8.207 711 HH12 ARG 95 2HH2 ARG 95 -14.752 -14.518 -7.305 712 HH21 ARG 95 1HH1 ARG 95 -17.144 -17.171 -6.978 713 HH22 ARG 95 2HH1 ARG 95 -16.621 -15.710 -6.248 714 H ARG 96 H ARG 96 -9.347 -20.691 -11.819 715 HA ARG 96 HA ARG 96 -10.240 -20.554 -14.492 716 HB2 ARG 96 2HB ARG 96 -8.152 -20.485 -15.312 717 HB3 ARG 96 1HB ARG 96 -7.923 -19.753 -13.692 718 HG2 ARG 96 2HG ARG 96 -6.871 -21.905 -12.905 719 HG3 ARG 96 1HG ARG 96 -7.281 -22.673 -14.481 720 HD2 ARG 96 2HD ARG 96 -5.852 -20.781 -15.615 721 HD3 ARG 96 1HD ARG 96 -5.181 -20.491 -13.965 722 HE ARG 96 HE ARG 96 -4.136 -22.637 -14.023 723 HH11 ARG 96 1HH2 ARG 96 -5.938 -22.094 -17.174 724 HH12 ARG 96 2HH2 ARG 96 -5.575 -23.635 -17.737 725 HH21 ARG 96 1HH1 ARG 96 -3.362 -24.666 -15.133 726 HH22 ARG 96 2HH1 ARG 96 -4.277 -25.178 -16.485 727 H GLU 97 H GLU 97 -9.870 -23.245 -12.291 728 HA GLU 97 HA GLU 97 -9.580 -25.233 -14.317 729 HB2 GLU 97 2HB GLU 97 -9.235 -25.512 -11.702 730 HB3 GLU 97 1HB GLU 97 -11.014 -25.674 -11.639 731 HG2 GLU 97 2HG GLU 97 -10.473 -27.509 -13.629 732 HG3 GLU 97 1HG GLU 97 -8.874 -27.527 -12.800 733 H GLU 98 H GLU 98 -12.295 -23.682 -12.595 734 HA GLU 98 HA GLU 98 -14.413 -25.136 -13.675 735 HB2 GLU 98 2HB GLU 98 -14.413 -22.176 -12.784 736 HB3 GLU 98 1HB GLU 98 -15.834 -23.252 -12.887 737 HG2 GLU 98 2HG GLU 98 -15.024 -24.588 -10.969 738 HG3 GLU 98 1HG GLU 98 -13.469 -23.679 -10.925 739 H GLU 99 H GLU 99 -12.992 -21.910 -14.572 740 HA GLU 99 HA GLU 99 -14.726 -21.567 -16.738 741 HB2 GLU 99 2HB GLU 99 -13.440 -19.593 -15.811 742 HB3 GLU 99 1HB GLU 99 -11.961 -20.232 -16.609 743 HG2 GLU 99 2HG GLU 99 -13.168 -20.093 -18.856 744 HG3 GLU 99 1HG GLU 99 -14.614 -19.457 -18.008 745 H ARG 100 H ARG 100 -11.423 -23.028 -16.592 746 HA ARG 100 HA ARG 100 -11.153 -23.181 -19.366 747 HB2 ARG 100 2HB ARG 100 -9.303 -23.342 -17.700 748 HB3 ARG 100 1HB ARG 100 -9.838 -24.991 -17.247 749 HG2 ARG 100 2HG ARG 100 -9.184 -24.284 -20.164 750 HG3 ARG 100 1HG ARG 100 -7.836 -24.410 -19.006 751 HD2 ARG 100 2HD ARG 100 -9.839 -26.704 -19.589 752 HD3 ARG 100 1HD ARG 100 -8.178 -26.510 -20.295 753 HE ARG 100 HE ARG 100 -7.715 -26.348 -17.568 754 HH11 ARG 100 1HH2 ARG 100 -8.920 -28.793 -19.932 755 HH12 ARG 100 2HH2 ARG 100 -8.544 -30.121 -18.943 756 HH21 ARG 100 1HH1 ARG 100 -6.946 -28.316 -16.344 757 HH22 ARG 100 2HH1 ARG 100 -7.297 -29.833 -16.985 758 H ARG 101 H ARG 101 -12.743 -25.385 -17.032 759 HA ARG 101 HA ARG 101 -13.119 -27.425 -19.041 760 HB2 ARG 101 2HB ARG 101 -14.518 -26.975 -16.340 761 HB3 ARG 101 1HB ARG 101 -14.838 -28.377 -17.425 762 HG2 ARG 101 2HG ARG 101 -12.469 -29.137 -17.183 763 HG3 ARG 101 1HG ARG 101 -12.145 -27.754 -16.086 764 HD2 ARG 101 2HD ARG 101 -14.044 -28.608 -14.571 765 HD3 ARG 101 1HD ARG 101 -14.132 -30.096 -15.585 766 HE ARG 101 HE ARG 101 -12.031 -29.249 -13.631 767 HH11 ARG 101 1HH2 ARG 101 -12.802 -31.802 -16.069 768 HH12 ARG 101 2HH2 ARG 101 -12.071 -33.044 -15.152 769 HH21 ARG 101 1HH1 ARG 101 -11.142 -30.784 -12.477 770 HH22 ARG 101 2HH1 ARG 101 -11.231 -32.475 -12.851 771 H GLY 102 H GLY 102 -14.804 -24.503 -17.991 772 HA2 GLY 102 2HA GLY 102 -16.399 -23.355 -18.999 773 HA3 GLY 102 1HA GLY 102 -16.512 -24.628 -20.274 774 H HIS 103 H HIS 103 -16.833 -25.256 -16.748 775 HA HIS 103 HA HIS 103 -19.697 -25.450 -16.934 776 HB2 HIS 103 2HB HIS 103 -17.971 -28.003 -16.493 777 HB3 HIS 103 1HB HIS 103 -19.746 -27.886 -16.257 778 HD1 HIS 103 1HD HIS 103 -17.193 -27.709 -19.214 779 HD2 HIS 103 2HD HIS 103 -21.291 -28.419 -18.462 780 HE1 HIS 103 1HE HIS 103 -18.188 -28.583 -21.313 781 HE2 HIS 103 2HE HIS 103 -20.647 -28.908 -20.919 782 H1 SER 1 H SER 1 -1.383 -13.638 -21.223 783 HA SER 1 HA SER 1 -3.148 -13.736 -23.562 784 HB2 SER 1 2HB SER 1 -0.442 -15.146 -23.149 785 HB3 SER 1 1HB SER 1 -1.580 -15.520 -24.498 786 HG SER 1 1HG SER 1 0.151 -14.004 -24.926 787 H ALA 2 H ALA 2 -1.930 -15.347 -20.621 788 HA ALA 2 HA ALA 2 -3.547 -17.704 -21.176 789 HB1 ALA 2 1HB ALA 2 -1.445 -18.045 -19.953 790 HB2 ALA 2 2HB ALA 2 -2.798 -18.446 -18.856 791 HB3 ALA 2 3HB ALA 2 -1.948 -16.868 -18.699 792 H ASP 3 H ASP 3 -5.002 -18.446 -19.269 793 HA ASP 3 HA ASP 3 -7.283 -17.005 -19.399 794 HB2 ASP 3 2HB ASP 3 -6.779 -18.643 -16.829 795 HB3 ASP 3 1HB ASP 3 -8.317 -18.366 -17.703 796 H HIS 4 H HIS 4 -5.106 -17.178 -16.646 797 HA HIS 4 HA HIS 4 -6.412 -15.258 -15.049 798 HB2 HIS 4 2HB HIS 4 -4.383 -15.308 -13.603 799 HB3 HIS 4 1HB HIS 4 -4.930 -16.958 -14.025 800 HD1 HIS 4 1HD HIS 4 -2.069 -16.895 -13.138 801 HD2 HIS 4 2HD HIS 4 -3.032 -16.019 -17.155 802 HE1 HIS 4 1HE HIS 4 0.042 -17.094 -14.527 803 HE2 HIS 4 2HE HIS 4 -0.580 -16.466 -16.887 804 H GLU 5 H GLU 5 -4.325 -14.724 -17.799 805 HA GLU 5 HA GLU 5 -3.145 -12.290 -16.677 806 HB2 GLU 5 2HB GLU 5 -2.775 -13.856 -19.280 807 HB3 GLU 5 1HB GLU 5 -2.125 -12.206 -19.093 808 HG2 GLU 5 2HG GLU 5 -0.413 -12.780 -17.701 809 HG3 GLU 5 1HG GLU 5 -1.335 -14.067 -16.866 810 H ARG 6 H ARG 6 -5.471 -13.550 -19.131 811 HA ARG 6 HA ARG 6 -6.009 -10.965 -20.143 812 HB2 ARG 6 2HB ARG 6 -7.558 -13.592 -20.358 813 HB3 ARG 6 1HB ARG 6 -8.014 -12.081 -21.226 814 HG2 ARG 6 2HG ARG 6 -5.882 -12.003 -22.423 815 HG3 ARG 6 1HG ARG 6 -5.208 -13.342 -21.444 816 HD2 ARG 6 2HD ARG 6 -5.798 -14.166 -23.704 817 HD3 ARG 6 1HD ARG 6 -6.770 -14.973 -22.427 818 HE ARG 6 HE ARG 6 -8.677 -14.100 -23.240 819 HH11 ARG 6 1HH2 ARG 6 -6.163 -11.993 -24.806 820 HH12 ARG 6 2HH2 ARG 6 -6.766 -12.198 -26.374 821 HH21 ARG 6 1HH1 ARG 6 -9.847 -13.766 -25.282 822 HH22 ARG 6 2HH1 ARG 6 -9.067 -12.999 -26.607 823 H GLU 7 H GLU 7 -7.399 -12.856 -17.470 824 HA GLU 7 HA GLU 7 -9.564 -11.183 -16.913 825 HB2 GLU 7 2HB GLU 7 -8.970 -13.530 -15.933 826 HB3 GLU 7 1HB GLU 7 -7.818 -12.680 -14.864 827 HG2 GLU 7 2HG GLU 7 -9.719 -12.954 -13.498 828 HG3 GLU 7 1HG GLU 7 -9.904 -11.261 -14.073 829 H ALA 8 H ALA 8 -6.156 -11.181 -15.783 830 HA ALA 8 HA ALA 8 -6.395 -8.996 -14.058 831 HB1 ALA 8 1HB ALA 8 -3.897 -10.118 -15.501 832 HB2 ALA 8 2HB ALA 8 -4.517 -10.674 -13.900 833 HB3 ALA 8 3HB ALA 8 -3.859 -9.008 -14.087 834 H GLN 9 H GLN 9 -5.638 -9.226 -17.509 835 HA GLN 9 HA GLN 9 -4.615 -6.648 -17.839 836 HB2 GLN 9 2HB GLN 9 -4.328 -8.475 -19.478 837 HB3 GLN 9 1HB GLN 9 -6.086 -8.456 -19.857 838 HG2 GLN 9 2HG GLN 9 -5.936 -6.285 -20.939 839 HG3 GLN 9 1HG GLN 9 -4.319 -5.958 -20.227 840 HE21 GLN 9 1HE2 GLN 9 -2.542 -6.517 -21.406 841 HE22 GLN 9 2HE2 GLN 9 -2.550 -7.469 -22.866 842 H LYS 10 H LYS 10 -7.957 -7.900 -17.792 843 HA LYS 10 HA LYS 10 -9.124 -5.518 -18.803 844 HB2 LYS 10 2HB LYS 10 -10.278 -7.823 -17.147 845 HB3 LYS 10 1HB LYS 10 -11.271 -6.476 -17.819 846 HG2 LYS 10 2HG LYS 10 -10.693 -7.022 -20.090 847 HG3 LYS 10 1HG LYS 10 -9.460 -8.226 -19.589 848 HD2 LYS 10 2HD LYS 10 -11.215 -9.650 -18.546 849 HD3 LYS 10 1HD LYS 10 -12.490 -8.505 -19.080 850 HE2 LYS 10 2HE LYS 10 -10.544 -10.060 -20.949 851 HE3 LYS 10 1HE LYS 10 -12.266 -10.489 -20.600 852 HZ1 LYS 10 3HZ LYS 10 -12.294 -9.347 -22.590 853 HZ2 LYS 10 1HZ LYS 10 -11.262 -8.073 -22.076 854 HZ3 LYS 10 2HZ LYS 10 -12.826 -8.213 -21.469 855 H ALA 11 H ALA 11 -8.060 -6.562 -15.607 856 HA ALA 11 HA ALA 11 -9.519 -4.652 -14.128 857 HB1 ALA 11 1HB ALA 11 -8.363 -6.655 -13.082 858 HB2 ALA 11 2HB ALA 11 -7.947 -5.102 -12.285 859 HB3 ALA 11 3HB ALA 11 -6.778 -5.867 -13.421 860 H GLU 12 H GLU 12 -6.346 -4.588 -15.807 861 HA GLU 12 HA GLU 12 -5.604 -2.002 -14.945 862 HB2 GLU 12 2HB GLU 12 -4.954 -3.315 -17.672 863 HB3 GLU 12 1HB GLU 12 -4.170 -1.867 -16.965 864 HG2 GLU 12 2HG GLU 12 -3.230 -3.307 -15.108 865 HG3 GLU 12 1HG GLU 12 -3.979 -4.758 -15.893 866 H GLU 13 H GLU 13 -7.295 -3.229 -17.837 867 HA GLU 13 HA GLU 13 -7.524 -0.965 -19.331 868 HB2 GLU 13 2HB GLU 13 -8.212 -3.344 -20.012 869 HB3 GLU 13 1HB GLU 13 -9.666 -3.170 -18.990 870 HG2 GLU 13 2HG GLU 13 -10.377 -1.194 -20.495 871 HG3 GLU 13 1HG GLU 13 -8.975 -1.603 -21.549 872 H GLU 14 H GLU 14 -9.879 -2.211 -16.874 873 HA GLU 14 HA GLU 14 -11.558 0.042 -17.295 874 HB2 GLU 14 2HB GLU 14 -12.921 -0.710 -15.448 875 HB3 GLU 14 1HB GLU 14 -12.601 -2.049 -16.593 876 HG2 GLU 14 2HG GLU 14 -11.262 -3.259 -15.073 877 HG3 GLU 14 1HG GLU 14 -10.788 -1.809 -14.123 878 H LEU 15 H LEU 15 -8.661 -0.309 -15.431 879 HA LEU 15 HA LEU 15 -9.449 1.541 -13.410 880 HB2 LEU 15 2HB LEU 15 -7.566 -0.066 -13.083 881 HB3 LEU 15 1HB LEU 15 -6.613 0.801 -14.322 882 HG LEU 15 HG LEU 15 -6.562 2.842 -12.909 883 HD11 LEU 15 1HD1 LEU 15 -8.721 2.810 -11.771 884 HD12 LEU 15 2HD1 LEU 15 -7.450 2.750 -10.515 885 HD13 LEU 15 3HD1 LEU 15 -8.341 1.249 -10.956 886 HD21 LEU 15 3HD2 LEU 15 -4.792 1.097 -12.554 887 HD22 LEU 15 1HD2 LEU 15 -5.795 0.345 -11.259 888 HD23 LEU 15 2HD2 LEU 15 -5.152 2.008 -11.042 889 H GLN 16 H GLN 16 -7.985 1.722 -16.668 890 HA GLN 16 HA GLN 16 -7.471 4.542 -16.427 891 HB2 GLN 16 2HB GLN 16 -7.454 2.667 -18.852 892 HB3 GLN 16 1HB GLN 16 -7.259 4.442 -18.990 893 HG2 GLN 16 2HG GLN 16 -5.068 3.728 -19.038 894 HG3 GLN 16 1HG GLN 16 -5.263 4.302 -17.359 895 HE21 GLN 16 1HE2 GLN 16 -5.295 2.658 -15.634 896 HE22 GLN 16 2HE2 GLN 16 -4.895 1.001 -15.933 897 H LYS 17 H LYS 17 -10.317 2.714 -16.918 898 HA LYS 17 HA LYS 17 -11.744 4.615 -18.512 899 HB2 LYS 17 2HB LYS 17 -12.408 2.228 -18.417 900 HB3 LYS 17 1HB LYS 17 -12.734 2.375 -16.654 901 HG2 LYS 17 2HG LYS 17 -14.656 3.815 -17.031 902 HG3 LYS 17 1HG LYS 17 -14.242 4.016 -18.767 903 HD2 LYS 17 2HD LYS 17 -16.153 2.488 -18.454 904 HD3 LYS 17 1HD LYS 17 -14.757 1.680 -19.254 905 HE2 LYS 17 2HE LYS 17 -14.163 0.542 -17.087 906 HE3 LYS 17 1HE LYS 17 -15.552 1.353 -16.267 907 HZ1 LYS 17 3HZ LYS 17 -17.021 -0.038 -17.266 908 HZ2 LYS 17 1HZ LYS 17 -15.700 -1.051 -17.219 909 HZ3 LYS 17 2HZ LYS 17 -16.091 -0.267 -18.689 910 H VAL 18 H VAL 18 -11.616 3.799 -14.971 911 HA VAL 18 HA VAL 18 -13.398 5.871 -14.330 912 HB VAL 18 HB VAL 18 -12.815 5.467 -11.979 913 HG11 VAL 18 1HG1 VAL 18 -13.301 2.915 -13.679 914 HG12 VAL 18 2HG1 VAL 18 -14.536 4.162 -13.276 915 HG13 VAL 18 3HG1 VAL 18 -13.776 3.180 -11.966 916 HG21 VAL 18 3HG2 VAL 18 -10.857 3.335 -13.094 917 HG22 VAL 18 1HG2 VAL 18 -11.263 3.625 -11.375 918 HG23 VAL 18 2HG2 VAL 18 -10.347 4.868 -12.292 919 H LEU 19 H LEU 19 -9.915 5.869 -14.844 920 HA LEU 19 HA LEU 19 -9.252 8.201 -13.483 921 HB2 LEU 19 2HB LEU 19 -8.227 7.243 -16.236 922 HB3 LEU 19 1HB LEU 19 -7.517 8.619 -15.330 923 HG LEU 19 HG LEU 19 -7.503 5.697 -14.403 924 HD11 LEU 19 1HD1 LEU 19 -5.063 5.832 -14.839 925 HD12 LEU 19 2HD1 LEU 19 -5.224 7.543 -15.375 926 HD13 LEU 19 3HD1 LEU 19 -5.970 6.228 -16.350 927 HD21 LEU 19 3HD2 LEU 19 -6.356 8.245 -13.117 928 HD22 LEU 19 1HD2 LEU 19 -5.901 6.577 -12.639 929 HD23 LEU 19 2HD2 LEU 19 -7.591 7.136 -12.408 930 H GLU 20 H GLU 20 -10.837 7.787 -16.682 931 HA GLU 20 HA GLU 20 -10.499 10.584 -17.271 932 HB2 GLU 20 2HB GLU 20 -12.085 8.433 -18.773 933 HB3 GLU 20 1HB GLU 20 -11.826 10.128 -19.310 934 HG2 GLU 20 2HG GLU 20 -9.281 9.683 -19.193 935 HG3 GLU 20 1HG GLU 20 -9.667 7.940 -18.958 936 H GLU 21 H GLU 21 -12.923 8.553 -15.748 937 HA GLU 21 HA GLU 21 -14.986 10.552 -15.919 938 HB2 GLU 21 2HB GLU 21 -14.710 8.205 -13.934 939 HB3 GLU 21 1HB GLU 21 -16.195 9.161 -14.277 940 HG2 GLU 21 2HG GLU 21 -16.089 8.332 -16.695 941 HG3 GLU 21 1HG GLU 21 -14.692 7.292 -16.244 942 H ALA 22 H ALA 22 -12.522 9.439 -13.607 943 HA ALA 22 HA ALA 22 -13.118 10.963 -11.433 944 HB1 ALA 22 1HB ALA 22 -11.377 9.134 -11.460 945 HB2 ALA 22 2HB ALA 22 -10.724 10.654 -10.751 946 HB3 ALA 22 3HB ALA 22 -10.304 10.182 -12.440 947 H SER 23 H SER 23 -11.124 11.871 -14.321 948 HA SER 23 HA SER 23 -10.201 14.247 -13.150 949 HB2 SER 23 2HB SER 23 -9.744 14.884 -15.633 950 HB3 SER 23 1HB SER 23 -8.917 13.435 -14.948 951 HG SER 23 1HG SER 23 -9.853 13.043 -16.994 952 H LYS 24 H LYS 24 -13.057 13.537 -15.262 953 HA LYS 24 HA LYS 24 -13.824 16.247 -15.438 954 HB2 LYS 24 2HB LYS 24 -14.805 14.504 -16.957 955 HB3 LYS 24 1HB LYS 24 -15.676 13.790 -15.560 956 HG2 LYS 24 2HG LYS 24 -16.936 15.955 -15.239 957 HG3 LYS 24 1HG LYS 24 -16.020 16.679 -16.603 958 HD2 LYS 24 2HD LYS 24 -17.027 14.945 -18.141 959 HD3 LYS 24 1HD LYS 24 -18.012 14.317 -16.777 960 HE2 LYS 24 2HE LYS 24 -18.094 17.243 -17.826 961 HE3 LYS 24 1HE LYS 24 -19.231 15.931 -18.335 962 HZ1 LYS 24 3HZ LYS 24 -20.027 17.480 -16.539 963 HZ2 LYS 24 1HZ LYS 24 -18.967 16.743 -15.465 964 HZ3 LYS 24 2HZ LYS 24 -20.143 15.813 -16.224 965 H LYS 25 H LYS 25 -14.800 13.622 -13.207 966 HA LYS 25 HA LYS 25 -16.673 15.203 -11.828 967 HB2 LYS 25 2HB LYS 25 -15.214 12.610 -11.065 968 HB3 LYS 25 1HB LYS 25 -16.500 13.352 -10.064 969 HG2 LYS 25 2HG LYS 25 -18.020 13.292 -12.175 970 HG3 LYS 25 1HG LYS 25 -16.772 12.242 -12.906 971 HD2 LYS 25 2HD LYS 25 -17.923 10.528 -12.032 972 HD3 LYS 25 1HD LYS 25 -17.192 10.938 -10.451 973 HE2 LYS 25 2HE LYS 25 -19.877 12.044 -11.551 974 HE3 LYS 25 1HE LYS 25 -19.757 10.609 -10.469 975 HZ1 LYS 25 3HZ LYS 25 -20.303 12.869 -9.444 976 HZ2 LYS 25 1HZ LYS 25 -18.670 13.243 -9.540 977 HZ3 LYS 25 2HZ LYS 25 -19.218 11.846 -8.694 978 H ALA 26 H ALA 26 -13.165 14.866 -11.450 979 HA ALA 26 HA ALA 26 -13.065 16.036 -8.866 980 HB1 ALA 26 1HB ALA 26 -10.891 15.937 -11.057 981 HB2 ALA 26 2HB ALA 26 -11.137 14.702 -9.769 982 HB3 ALA 26 3HB ALA 26 -10.638 16.370 -9.322 983 H VAL 27 H VAL 27 -12.770 17.306 -12.249 984 HA VAL 27 HA VAL 27 -12.105 19.908 -11.485 985 HB VAL 27 HB VAL 27 -13.610 18.886 -13.950 986 HG11 VAL 27 1HG1 VAL 27 -12.942 21.089 -15.033 987 HG12 VAL 27 2HG1 VAL 27 -12.414 21.700 -13.420 988 HG13 VAL 27 3HG1 VAL 27 -14.149 21.320 -13.728 989 HG21 VAL 27 3HG2 VAL 27 -11.388 19.083 -15.022 990 HG22 VAL 27 1HG2 VAL 27 -11.197 18.115 -13.524 991 HG23 VAL 27 2HG2 VAL 27 -10.689 19.823 -13.527 992 H GLU 28 H GLU 28 -15.333 18.391 -12.023 993 HA GLU 28 HA GLU 28 -16.522 20.924 -11.129 994 HB2 GLU 28 2HB GLU 28 -17.940 18.477 -12.223 995 HB3 GLU 28 1HB GLU 28 -18.626 20.107 -11.896 996 HG2 GLU 28 2HG GLU 28 -16.748 21.006 -13.523 997 HG3 GLU 28 1HG GLU 28 -16.580 19.296 -14.072 998 H ALA 29 H ALA 29 -15.062 18.747 -9.380 999 HA ALA 29 HA ALA 29 -17.135 18.070 -7.479 1000 HB1 ALA 29 1HB ALA 29 -15.170 17.596 -5.942 1001 HB2 ALA 29 2HB ALA 29 -14.042 18.180 -7.196 1002 HB3 ALA 29 3HB ALA 29 -15.015 16.690 -7.483 1003 H GLU 30 H GLU 30 -14.367 20.268 -7.767 1004 HA GLU 30 HA GLU 30 -14.692 21.897 -5.700 1005 HB2 GLU 30 2HB GLU 30 -13.443 21.855 -8.394 1006 HB3 GLU 30 1HB GLU 30 -13.844 23.530 -7.906 1007 HG2 GLU 30 2HG GLU 30 -11.657 23.195 -7.128 1008 HG3 GLU 30 1HG GLU 30 -12.770 23.105 -5.701 1009 H ARG 31 H ARG 31 -16.726 21.904 -8.549 1010 HA ARG 31 HA ARG 31 -17.614 24.627 -8.258 1011 HB2 ARG 31 2HB ARG 31 -18.703 22.235 -9.865 1012 HB3 ARG 31 1HB ARG 31 -19.478 23.851 -9.884 1013 HG2 ARG 31 2HG ARG 31 -16.599 23.331 -10.846 1014 HG3 ARG 31 1HG ARG 31 -18.086 23.402 -11.861 1015 HD2 ARG 31 2HD ARG 31 -18.483 25.793 -10.834 1016 HD3 ARG 31 1HD ARG 31 -16.767 25.694 -10.256 1017 HE ARG 31 HE ARG 31 -17.086 25.031 -13.114 1018 HH11 ARG 31 1HH2 ARG 31 -17.193 27.847 -10.804 1019 HH12 ARG 31 2HH2 ARG 31 -16.738 29.004 -11.963 1020 HH21 ARG 31 1HH1 ARG 31 -16.389 26.703 -14.715 1021 HH22 ARG 31 2HH1 ARG 31 -16.220 28.317 -14.241 1022 H GLY 32 H GLY 32 -18.025 24.348 -5.889 1023 HA2 GLY 32 2HA GLY 32 -20.520 24.683 -5.143 1024 HA3 GLY 32 1HA GLY 32 -20.406 22.872 -5.171 1025 H ALA 33 H ALA 33 -17.648 22.633 -4.530 1026 HA ALA 33 HA ALA 33 -18.114 22.702 -1.719 1027 HB1 ALA 33 1HB ALA 33 -17.173 20.671 -2.827 1028 HB2 ALA 33 2HB ALA 33 -16.037 21.306 -1.578 1029 HB3 ALA 33 3HB ALA 33 -15.738 21.639 -3.326 1030 HA PRO 34 HA PRO 34 -15.332 26.134 -1.102 1031 HB2 PRO 34 2HB PRO 34 -14.787 25.980 1.633 1032 HB3 PRO 34 1HB PRO 34 -16.426 26.381 0.988 1033 HG2 PRO 34 2HG PRO 34 -15.398 23.638 1.909 1034 HG3 PRO 34 1HG PRO 34 -16.943 24.462 2.376 1035 HD2 PRO 34 2HD PRO 34 -16.822 22.572 0.348 1036 HD3 PRO 34 1HD PRO 34 -17.934 24.009 0.240 1037 H GLY 35 H GLY 35 -13.073 26.713 -0.828 1038 HA2 GLY 35 2HA GLY 35 -10.893 26.418 -0.533 1039 HA3 GLY 35 1HA GLY 35 -11.195 24.762 0.110 1040 H ALA 36 H ALA 36 -12.107 26.232 -3.019 1041 HA ALA 36 HA ALA 36 -11.608 23.907 -4.369 1042 HB1 ALA 36 1HB ALA 36 -11.775 26.817 -5.431 1043 HB2 ALA 36 2HB ALA 36 -13.174 25.690 -5.229 1044 HB3 ALA 36 3HB ALA 36 -11.922 25.360 -6.473 1045 H ALA 37 H ALA 37 -9.911 22.972 -5.448 1046 HA ALA 37 HA ALA 37 -7.538 24.639 -5.977 1047 HB1 ALA 37 1HB ALA 37 -7.213 23.625 -3.682 1048 HB2 ALA 37 2HB ALA 37 -6.076 22.913 -4.881 1049 HB3 ALA 37 3HB ALA 37 -7.548 21.999 -4.370 1050 H LEU 38 H LEU 38 -9.277 21.483 -6.330 1051 HA LEU 38 HA LEU 38 -7.402 20.452 -8.202 1052 HB2 LEU 38 2HB LEU 38 -9.334 19.404 -6.470 1053 HB3 LEU 38 1HB LEU 38 -10.197 19.276 -8.005 1054 HG LEU 38 HG LEU 38 -9.147 17.187 -7.546 1055 HD11 LEU 38 1HD1 LEU 38 -8.942 17.836 -9.955 1056 HD12 LEU 38 2HD1 LEU 38 -7.626 16.729 -9.424 1057 HD13 LEU 38 3HD1 LEU 38 -7.291 18.482 -9.650 1058 HD21 LEU 38 3HD2 LEU 38 -6.734 16.874 -7.052 1059 HD22 LEU 38 1HD2 LEU 38 -7.543 17.921 -5.847 1060 HD23 LEU 38 2HD2 LEU 38 -6.483 18.659 -7.102 1061 H ILE 39 H ILE 39 -9.797 22.786 -8.499 1062 HA ILE 39 HA ILE 39 -11.093 21.900 -10.829 1063 HB ILE 39 HB ILE 39 -12.224 23.347 -9.427 1064 HG12 ILE 39 2HG1 ILE 39 -11.714 24.864 -12.036 1065 HG13 ILE 39 1HG1 ILE 39 -12.756 23.408 -11.833 1066 HG21 ILE 39 1HG2 ILE 39 -11.624 25.683 -8.927 1067 HG22 ILE 39 2HG2 ILE 39 -10.139 25.563 -9.927 1068 HG23 ILE 39 3HG2 ILE 39 -10.296 24.601 -8.416 1069 HD11 ILE 39 3HD ILE 39 -13.188 26.149 -10.463 1070 HD12 ILE 39 1HD ILE 39 -14.151 25.445 -11.809 1071 HD13 ILE 39 2HD ILE 39 -14.187 24.669 -10.182 1072 H SER 40 H SER 40 -9.257 21.201 -12.156 1073 HA SER 40 HA SER 40 -8.856 23.225 -14.154 1074 HB2 SER 40 2HB SER 40 -6.193 22.438 -14.025 1075 HB3 SER 40 1HB SER 40 -6.858 23.953 -13.335 1076 HG SER 40 1HG SER 40 -5.980 21.635 -12.060 1077 H TYR 41 H TYR 41 -9.522 22.078 -15.878 1078 HA TYR 41 HA TYR 41 -9.551 19.348 -16.089 1079 HB2 TYR 41 2HB TYR 41 -10.762 21.163 -17.551 1080 HB3 TYR 41 1HB TYR 41 -9.277 21.163 -18.562 1081 HD1 TYR 41 1HD TYR 41 -12.125 19.130 -17.268 1082 HD2 TYR 41 2HD TYR 41 -8.829 19.245 -20.036 1083 HE1 TYR 41 1HE TYR 41 -13.049 17.179 -18.446 1084 HE2 TYR 41 2HE TYR 41 -9.758 17.300 -21.225 1085 HH TYR 41 HH TYR 41 -11.693 15.974 -21.510 1086 HA PRO 42 HA PRO 42 -5.677 19.197 -18.618 1087 HB2 PRO 42 2HB PRO 42 -3.515 21.004 -18.242 1088 HB3 PRO 42 1HB PRO 42 -4.806 21.191 -19.485 1089 HG2 PRO 42 2HG PRO 42 -4.713 22.437 -16.682 1090 HG3 PRO 42 1HG PRO 42 -5.063 23.253 -18.262 1091 HD2 PRO 42 2HD PRO 42 -7.096 22.473 -16.642 1092 HD3 PRO 42 1HD PRO 42 -7.228 22.170 -18.434 1093 H ASP 43 H ASP 43 -5.483 20.065 -15.167 1094 HA ASP 43 HA ASP 43 -3.358 18.036 -14.964 1095 HB2 ASP 43 2HB ASP 43 -2.748 18.925 -12.744 1096 HB3 ASP 43 1HB ASP 43 -2.337 19.958 -14.149 1097 H ALA 44 H ALA 44 -6.667 18.373 -14.737 1098 HA ALA 44 HA ALA 44 -7.124 16.918 -12.399 1099 HB1 ALA 44 1HB ALA 44 -8.948 18.104 -13.549 1100 HB2 ALA 44 2HB ALA 44 -9.360 16.379 -13.357 1101 HB3 ALA 44 3HB ALA 44 -8.820 17.003 -14.971 1102 H ILE 45 H ILE 45 -6.321 15.944 -15.687 1103 HA ILE 45 HA ILE 45 -6.726 13.149 -15.266 1104 HB ILE 45 HB ILE 45 -6.955 13.874 -17.472 1105 HG12 ILE 45 2HG1 ILE 45 -4.134 12.635 -17.381 1106 HG13 ILE 45 1HG1 ILE 45 -5.672 11.738 -17.178 1107 HG21 ILE 45 1HG2 ILE 45 -5.184 15.203 -18.713 1108 HG22 ILE 45 2HG2 ILE 45 -4.294 15.412 -17.171 1109 HG23 ILE 45 3HG2 ILE 45 -5.947 16.098 -17.382 1110 HD11 ILE 45 3HD ILE 45 -4.802 13.306 -19.706 1111 HD12 ILE 45 1HD ILE 45 -4.868 11.521 -19.499 1112 HD13 ILE 45 2HD ILE 45 -6.395 12.485 -19.490 1113 H TRP 46 H TRP 46 -4.033 15.419 -14.729 1114 HA TRP 46 HA TRP 46 -2.085 13.316 -14.484 1115 HB2 TRP 46 2HB TRP 46 -2.086 16.297 -14.346 1116 HB3 TRP 46 1HB TRP 46 -1.081 15.585 -13.066 1117 HD1 TRP 46 HD TRP 46 1.339 15.870 -13.791 1118 HE1 TRP 46 1HE TRP 46 2.706 15.547 -15.932 1119 HE3 TRP 46 3HE TRP 46 -2.426 14.317 -16.886 1120 HZ2 TRP 46 2HZ TRP 46 2.245 14.700 -18.619 1121 HZ3 TRP 46 3HZ TRP 46 -1.901 13.734 -19.221 1122 HH2 TRP 46 HH TRP 46 0.405 13.940 -20.088 1123 H TRP 47 H TRP 47 -4.128 15.278 -12.298 1124 HA TRP 47 HA TRP 47 -3.105 14.221 -9.921 1125 HB2 TRP 47 2HB TRP 47 -4.485 16.265 -9.925 1126 HB3 TRP 47 1HB TRP 47 -5.877 15.363 -10.610 1127 HD1 TRP 47 HD TRP 47 -3.791 15.421 -7.245 1128 HE1 TRP 47 1HE TRP 47 -5.242 14.418 -5.411 1129 HE3 TRP 47 3HE TRP 47 -7.796 14.162 -10.124 1130 HZ2 TRP 47 2HZ TRP 47 -7.889 13.248 -5.206 1131 HZ3 TRP 47 3HZ TRP 47 -9.734 13.031 -9.084 1132 HH2 TRP 47 HH TRP 47 -9.785 12.595 -6.667 1133 H SER 48 H SER 48 -5.864 13.069 -12.066 1134 HA SER 48 HA SER 48 -6.590 11.147 -10.158 1135 HB2 SER 48 2HB SER 48 -7.937 10.036 -11.953 1136 HB3 SER 48 1HB SER 48 -8.302 11.778 -11.680 1137 HG SER 48 1HG SER 48 -8.151 11.101 -13.897 1138 H VAL 49 H VAL 49 -4.163 11.132 -12.705 1139 HA VAL 49 HA VAL 49 -3.675 8.403 -12.782 1140 HB VAL 49 HB VAL 49 -2.025 10.861 -13.377 1141 HG11 VAL 49 1HG1 VAL 49 -1.063 7.938 -13.667 1142 HG12 VAL 49 2HG1 VAL 49 -0.338 9.202 -12.609 1143 HG13 VAL 49 3HG1 VAL 49 -0.268 9.385 -14.392 1144 HG21 VAL 49 3HG2 VAL 49 -3.062 8.521 -15.126 1145 HG22 VAL 49 1HG2 VAL 49 -2.387 10.092 -15.701 1146 HG23 VAL 49 2HG2 VAL 49 -3.981 10.039 -14.866 1147 H GLU 50 H GLU 50 -2.406 10.855 -10.375 1148 HA GLU 50 HA GLU 50 -0.801 8.756 -9.223 1149 HB2 GLU 50 2HB GLU 50 0.005 10.196 -7.587 1150 HB3 GLU 50 1HB GLU 50 0.038 11.066 -9.149 1151 HG2 GLU 50 2HG GLU 50 -1.745 12.575 -8.465 1152 HG3 GLU 50 1HG GLU 50 -2.180 11.550 -7.052 1153 H THR 51 H THR 51 -4.075 9.707 -8.923 1154 HA THR 51 HA THR 51 -4.243 9.052 -6.129 1155 HB THR 51 HB THR 51 -5.676 10.722 -7.771 1156 HG1 THR 51 1HG THR 51 -5.610 10.944 -5.632 1157 HG21 THR 51 3HG2 THR 51 -8.019 9.953 -7.877 1158 HG22 THR 51 1HG2 THR 51 -7.582 8.351 -7.188 1159 HG23 THR 51 2HG2 THR 51 -6.986 8.825 -8.823 1160 H ALA 52 H ALA 52 -4.800 7.448 -9.234 1161 HA ALA 52 HA ALA 52 -6.274 5.278 -8.148 1162 HB1 ALA 52 1HB ALA 52 -5.830 4.180 -10.379 1163 HB2 ALA 52 2HB ALA 52 -4.681 5.513 -10.777 1164 HB3 ALA 52 3HB ALA 52 -6.440 5.865 -10.559 1165 H THR 53 H THR 53 -2.770 5.961 -8.386 1166 HA THR 53 HA THR 53 -2.046 3.233 -8.050 1167 HB THR 53 HB THR 53 0.229 4.732 -7.549 1168 HG1 THR 53 1HG THR 53 0.076 6.521 -8.981 1169 HG21 THR 53 3HG2 THR 53 -0.110 2.929 -9.265 1170 HG22 THR 53 1HG2 THR 53 0.674 4.379 -9.995 1171 HG23 THR 53 2HG2 THR 53 -1.079 4.067 -10.281 1172 H THR 54 H THR 54 -3.434 5.475 -5.985 1173 HA THR 54 HA THR 54 -3.535 5.803 -3.858 1174 HB THR 54 HB THR 54 -3.381 3.762 -2.313 1175 HG1 THR 54 1HG THR 54 -2.115 2.730 -4.206 1176 HG21 THR 54 3HG2 THR 54 -5.479 4.742 -3.328 1177 HG22 THR 54 1HG2 THR 54 -5.564 2.950 -3.219 1178 HG23 THR 54 2HG2 THR 54 -5.235 3.740 -4.806 1179 H VAL 55 H VAL 55 -1.471 7.040 -4.589 1180 HA VAL 55 HA VAL 55 0.503 6.546 -2.464 1181 HB VAL 55 HB VAL 55 0.958 7.730 -5.287 1182 HG11 VAL 55 1HG1 VAL 55 2.344 8.855 -3.452 1183 HG12 VAL 55 2HG1 VAL 55 3.359 7.859 -4.561 1184 HG13 VAL 55 3HG1 VAL 55 2.904 7.229 -2.933 1185 HG21 VAL 55 3HG2 VAL 55 1.764 5.082 -3.923 1186 HG22 VAL 55 1HG2 VAL 55 2.499 5.672 -5.462 1187 HG23 VAL 55 2HG2 VAL 55 0.746 5.281 -5.389 1188 H GLY 56 H GLY 56 0.095 9.319 -4.664 1189 HA2 GLY 56 2HA GLY 56 -1.085 11.256 -4.285 1190 HA3 GLY 56 1HA GLY 56 -1.370 10.764 -2.557 1191 H TYR 57 H TYR 57 1.142 11.829 -4.949 1192 HA TYR 57 HA TYR 57 3.128 11.788 -2.849 1193 HB2 TYR 57 2HB TYR 57 3.553 11.151 -5.309 1194 HB3 TYR 57 1HB TYR 57 3.345 12.883 -5.731 1195 HD1 TYR 57 1HD TYR 57 5.030 14.517 -5.053 1196 HD2 TYR 57 2HD TYR 57 5.596 10.358 -4.184 1197 HE1 TYR 57 1HE TYR 57 7.415 14.917 -4.678 1198 HE2 TYR 57 2HE TYR 57 8.007 10.772 -3.736 1199 HH TYR 57 HH TYR 57 9.756 12.566 -3.485 1200 H GLY 58 H GLY 58 0.761 13.965 -4.073 1201 HA2 GLY 58 2HA GLY 58 0.114 15.658 -2.627 1202 HA3 GLY 58 1HA GLY 58 1.834 15.992 -2.200 1203 H ASP 59 H ASP 59 0.092 15.576 -5.332 1204 HA ASP 59 HA ASP 59 1.457 17.784 -6.479 1205 HB2 ASP 59 2HB ASP 59 0.080 15.609 -7.540 1206 HB3 ASP 59 1HB ASP 59 -1.175 16.853 -7.744 1207 H ARG 60 H ARG 60 -1.932 17.145 -5.395 1208 HA ARG 60 HA ARG 60 -2.323 20.028 -5.075 1209 HB2 ARG 60 2HB ARG 60 -4.360 18.209 -6.476 1210 HB3 ARG 60 1HB ARG 60 -4.603 19.934 -5.992 1211 HG2 ARG 60 2HG ARG 60 -2.461 20.365 -7.493 1212 HG3 ARG 60 1HG ARG 60 -2.931 18.834 -8.280 1213 HD2 ARG 60 2HD ARG 60 -5.183 19.752 -8.828 1214 HD3 ARG 60 1HD ARG 60 -4.881 21.234 -7.846 1215 HE ARG 60 HE ARG 60 -4.167 20.761 -10.590 1216 HH11 ARG 60 1HH2 ARG 60 -2.699 22.433 -7.697 1217 HH12 ARG 60 2HH2 ARG 60 -2.537 23.914 -8.483 1218 HH21 ARG 60 1HH1 ARG 60 -3.275 22.542 -11.756 1219 HH22 ARG 60 2HH1 ARG 60 -2.524 23.877 -10.952 1220 H TYR 61 H TYR 61 -5.320 18.923 -4.576 1221 HA TYR 61 HA TYR 61 -5.234 17.796 -1.999 1222 HB2 TYR 61 2HB TYR 61 -4.380 20.011 -1.258 1223 HB3 TYR 61 1HB TYR 61 -5.378 20.850 -2.483 1224 HD1 TYR 61 1HD TYR 61 -7.718 21.348 -2.114 1225 HD2 TYR 61 2HD TYR 61 -5.384 19.421 0.942 1226 HE1 TYR 61 1HE TYR 61 -9.337 22.080 -0.441 1227 HE2 TYR 61 2HE TYR 61 -7.003 20.171 2.642 1228 HH TYR 61 HH TYR 61 -10.001 21.947 1.780 1229 HA PRO 62 HA PRO 62 -9.267 18.122 -4.248 1230 HB2 PRO 62 2HB PRO 62 -10.597 15.947 -3.156 1231 HB3 PRO 62 1HB PRO 62 -9.275 15.719 -4.367 1232 HG2 PRO 62 2HG PRO 62 -9.099 15.536 -1.306 1233 HG3 PRO 62 1HG PRO 62 -8.448 14.365 -2.533 1234 HD2 PRO 62 2HD PRO 62 -6.940 16.418 -1.322 1235 HD3 PRO 62 1HD PRO 62 -6.582 15.797 -3.003 1236 H VAL 63 H VAL 63 -11.423 18.904 -3.523 1237 HA VAL 63 HA VAL 63 -11.376 20.124 -0.980 1238 HB VAL 63 HB VAL 63 -13.844 20.698 -1.614 1239 HG11 VAL 63 1HG1 VAL 63 -11.415 21.493 -3.317 1240 HG12 VAL 63 2HG1 VAL 63 -11.999 22.253 -1.809 1241 HG13 VAL 63 3HG1 VAL 63 -13.000 22.357 -3.302 1242 HG21 VAL 63 3HG2 VAL 63 -14.365 20.330 -4.056 1243 HG22 VAL 63 1HG2 VAL 63 -14.205 18.774 -3.178 1244 HG23 VAL 63 2HG2 VAL 63 -12.896 19.371 -4.270 1245 H THR 64 H THR 64 -13.338 20.025 0.495 1246 HA THR 64 HA THR 64 -13.322 17.422 1.527 1247 HB THR 64 HB THR 64 -14.929 19.738 2.687 1248 HG1 THR 64 1HG THR 64 -12.109 19.512 2.788 1249 HG21 THR 64 3HG2 THR 64 -14.821 17.544 3.903 1250 HG22 THR 64 1HG2 THR 64 -13.968 18.833 4.815 1251 HG23 THR 64 2HG2 THR 64 -13.022 17.605 3.894 1252 H GLU 65 H GLU 65 -16.056 19.668 0.684 1253 HA GLU 65 HA GLU 65 -17.980 17.831 1.419 1254 HB2 GLU 65 2HB GLU 65 -18.217 20.276 1.430 1255 HB3 GLU 65 1HB GLU 65 -18.219 20.332 -0.362 1256 HG2 GLU 65 2HG GLU 65 -20.408 19.441 -0.529 1257 HG3 GLU 65 1HG GLU 65 -20.291 18.599 1.054 1258 H GLU 66 H GLU 66 -16.122 17.885 -1.413 1259 HA GLU 66 HA GLU 66 -17.859 15.898 -2.677 1260 HB2 GLU 66 2HB GLU 66 -16.519 18.343 -4.014 1261 HB3 GLU 66 1HB GLU 66 -17.025 16.890 -4.949 1262 HG2 GLU 66 2HG GLU 66 -19.138 18.273 -3.218 1263 HG3 GLU 66 1HG GLU 66 -18.549 19.129 -4.680 1264 H GLY 67 H GLY 67 -15.185 16.981 -4.363 1265 HA2 GLY 67 2HA GLY 67 -13.294 15.976 -4.964 1266 HA3 GLY 67 1HA GLY 67 -12.889 16.793 -3.423 1267 H ARG 68 H ARG 68 -13.137 15.422 -1.458 1268 HA ARG 68 HA ARG 68 -11.524 13.180 -1.652 1269 HB2 ARG 68 2HB ARG 68 -11.631 14.674 0.300 1270 HB3 ARG 68 1HB ARG 68 -13.309 14.146 0.649 1271 HG2 ARG 68 2HG ARG 68 -12.578 11.928 1.268 1272 HG3 ARG 68 1HG ARG 68 -10.956 12.157 0.563 1273 HD2 ARG 68 2HD ARG 68 -12.018 13.748 3.015 1274 HD3 ARG 68 1HD ARG 68 -11.067 12.233 3.134 1275 HE ARG 68 HE ARG 68 -10.003 14.797 2.996 1276 HH11 ARG 68 1HH2 ARG 68 -8.976 12.351 0.639 1277 HH12 ARG 68 2HH2 ARG 68 -7.535 11.940 1.528 1278 HH21 ARG 68 1HH1 ARG 68 -8.117 14.187 4.241 1279 HH22 ARG 68 2HH1 ARG 68 -7.042 13.034 3.592 1280 H LYS 69 H LYS 69 -15.127 13.380 -1.413 1281 HA LYS 69 HA LYS 69 -15.500 10.551 -1.112 1282 HB2 LYS 69 2HB LYS 69 -17.300 12.841 -2.137 1283 HB3 LYS 69 1HB LYS 69 -17.891 11.156 -1.967 1284 HG2 LYS 69 2HG LYS 69 -16.671 12.623 0.434 1285 HG3 LYS 69 1HG LYS 69 -18.376 12.904 -0.076 1286 HD2 LYS 69 2HD LYS 69 -18.860 10.472 0.049 1287 HD3 LYS 69 1HD LYS 69 -17.205 10.137 0.637 1288 HE2 LYS 69 2HE LYS 69 -19.271 11.952 2.094 1289 HE3 LYS 69 1HE LYS 69 -19.017 10.194 2.437 1290 HZ1 LYS 69 3HZ LYS 69 -16.769 10.645 3.017 1291 HZ2 LYS 69 1HZ LYS 69 -17.848 11.567 3.966 1292 HZ3 LYS 69 2HZ LYS 69 -16.959 12.337 2.740 1293 H VAL 70 H VAL 70 -15.130 12.823 -3.791 1294 HA VAL 70 HA VAL 70 -15.939 11.014 -5.829 1295 HB VAL 70 HB VAL 70 -14.161 13.513 -6.020 1296 HG11 VAL 70 1HG1 VAL 70 -13.988 12.039 -8.037 1297 HG12 VAL 70 2HG1 VAL 70 -14.909 13.536 -8.400 1298 HG13 VAL 70 3HG1 VAL 70 -15.786 11.974 -8.156 1299 HG21 VAL 70 3HG2 VAL 70 -17.231 13.156 -6.248 1300 HG22 VAL 70 1HG2 VAL 70 -16.332 14.660 -6.655 1301 HG23 VAL 70 2HG2 VAL 70 -16.364 14.067 -4.963 1302 H ALA 71 H ALA 71 -12.810 12.128 -4.484 1303 HA ALA 71 HA ALA 71 -11.120 10.570 -6.018 1304 HB1 ALA 71 1HB ALA 71 -10.691 11.451 -3.082 1305 HB2 ALA 71 2HB ALA 71 -10.349 12.483 -4.511 1306 HB3 ALA 71 3HB ALA 71 -9.408 10.969 -4.252 1307 H GLU 72 H GLU 72 -12.596 9.918 -2.815 1308 HA GLU 72 HA GLU 72 -11.409 7.608 -2.086 1309 HB2 GLU 72 2HB GLU 72 -13.059 8.991 -0.765 1310 HB3 GLU 72 1HB GLU 72 -14.374 8.416 -1.838 1311 HG2 GLU 72 2HG GLU 72 -14.004 6.064 -0.909 1312 HG3 GLU 72 1HG GLU 72 -12.735 6.739 0.183 1313 H GLN 73 H GLN 73 -14.251 8.020 -4.211 1314 HA GLN 73 HA GLN 73 -14.737 5.285 -4.535 1315 HB2 GLN 73 2HB GLN 73 -16.300 7.266 -4.920 1316 HB3 GLN 73 1HB GLN 73 -15.467 7.557 -6.478 1317 HG2 GLN 73 2HG GLN 73 -16.219 5.302 -7.300 1318 HG3 GLN 73 1HG GLN 73 -16.937 4.945 -5.675 1319 HE21 GLN 73 1HE2 GLN 73 -18.853 4.721 -7.433 1320 HE22 GLN 73 2HE2 GLN 73 -19.821 6.149 -7.634 1321 H VAL 74 H VAL 74 -12.662 7.572 -6.316 1322 HA VAL 74 HA VAL 74 -12.136 5.775 -8.479 1323 HB VAL 74 HB VAL 74 -10.734 8.337 -7.566 1324 HG11 VAL 74 1HG1 VAL 74 -10.507 6.765 -10.234 1325 HG12 VAL 74 2HG1 VAL 74 -9.206 6.943 -9.001 1326 HG13 VAL 74 3HG1 VAL 74 -9.780 8.382 -9.896 1327 HG21 VAL 74 3HG2 VAL 74 -12.792 7.863 -9.836 1328 HG22 VAL 74 1HG2 VAL 74 -12.117 9.441 -9.275 1329 HG23 VAL 74 2HG2 VAL 74 -13.230 8.524 -8.229 1330 H MET 75 H MET 75 -10.399 6.836 -5.505 1331 HA MET 75 HA MET 75 -8.065 5.358 -5.920 1332 HB2 MET 75 2HB MET 75 -9.421 6.163 -3.272 1333 HB3 MET 75 1HB MET 75 -7.782 5.430 -3.395 1334 HG2 MET 75 2HG MET 75 -7.086 7.360 -4.878 1335 HG3 MET 75 1HG MET 75 -8.617 8.175 -4.509 1336 HE1 MET 75 3HE MET 75 -8.985 7.249 -1.303 1337 HE2 MET 75 1HE MET 75 -9.381 8.846 -2.035 1338 HE3 MET 75 2HE MET 75 -8.333 8.751 -0.577 1339 H LYS 76 H LYS 76 -11.144 4.503 -4.217 1340 HA LYS 76 HA LYS 76 -10.221 2.037 -3.317 1341 HB2 LYS 76 2HB LYS 76 -12.341 3.296 -2.542 1342 HB3 LYS 76 1HB LYS 76 -13.148 2.638 -4.001 1343 HG2 LYS 76 2HG LYS 76 -12.480 0.278 -3.110 1344 HG3 LYS 76 1HG LYS 76 -11.943 1.094 -1.602 1345 HD2 LYS 76 2HD LYS 76 -14.313 1.990 -1.310 1346 HD3 LYS 76 1HD LYS 76 -14.752 1.167 -2.851 1347 HE2 LYS 76 2HE LYS 76 -13.957 -1.061 -1.665 1348 HE3 LYS 76 1HE LYS 76 -14.074 -0.121 -0.120 1349 HZ1 LYS 76 3HZ LYS 76 -16.197 -0.599 -2.150 1350 HZ2 LYS 76 1HZ LYS 76 -16.425 0.355 -0.732 1351 HZ3 LYS 76 2HZ LYS 76 -16.151 -1.296 -0.604 1352 H ALA 77 H ALA 77 -11.583 3.006 -6.458 1353 HA ALA 77 HA ALA 77 -12.084 0.391 -7.407 1354 HB1 ALA 77 1HB ALA 77 -12.054 1.390 -9.694 1355 HB2 ALA 77 2HB ALA 77 -11.313 2.895 -9.040 1356 HB3 ALA 77 3HB ALA 77 -12.993 2.446 -8.574 1357 H GLY 78 H GLY 78 -9.190 2.457 -7.290 1358 HA2 GLY 78 2HA GLY 78 -7.548 0.875 -8.951 1359 HA3 GLY 78 1HA GLY 78 -7.049 2.080 -7.702 1360 H ILE 79 H ILE 79 -8.171 0.871 -5.427 1361 HA ILE 79 HA ILE 79 -6.204 -0.964 -4.731 1362 HB ILE 79 HB ILE 79 -8.952 -0.597 -3.423 1363 HG12 ILE 79 2HG1 ILE 79 -6.220 0.708 -2.810 1364 HG13 ILE 79 1HG1 ILE 79 -7.604 1.529 -3.586 1365 HG21 ILE 79 1HG2 ILE 79 -7.820 -2.752 -2.723 1366 HG22 ILE 79 2HG2 ILE 79 -7.839 -1.578 -1.381 1367 HG23 ILE 79 3HG2 ILE 79 -6.326 -1.832 -2.321 1368 HD11 ILE 79 3HD ILE 79 -7.508 0.463 -0.693 1369 HD12 ILE 79 1HD ILE 79 -7.552 2.173 -1.236 1370 HD13 ILE 79 2HD ILE 79 -8.992 1.115 -1.486 1371 H GLU 80 H GLU 80 -9.673 -1.513 -5.630 1372 HA GLU 80 HA GLU 80 -9.463 -4.288 -5.336 1373 HB2 GLU 80 2HB GLU 80 -11.482 -2.755 -7.062 1374 HB3 GLU 80 1HB GLU 80 -11.588 -4.480 -6.568 1375 HG2 GLU 80 2HG GLU 80 -11.574 -3.703 -4.115 1376 HG3 GLU 80 1HG GLU 80 -11.716 -2.011 -4.711 1377 H VAL 81 H VAL 81 -8.529 -2.213 -8.043 1378 HA VAL 81 HA VAL 81 -8.399 -4.302 -9.973 1379 HB VAL 81 HB VAL 81 -7.333 -1.466 -9.765 1380 HG11 VAL 81 1HG1 VAL 81 -6.528 -1.712 -12.177 1381 HG12 VAL 81 2HG1 VAL 81 -6.612 -3.493 -11.979 1382 HG13 VAL 81 3HG1 VAL 81 -5.492 -2.519 -10.960 1383 HG21 VAL 81 3HG2 VAL 81 -9.271 -2.890 -11.720 1384 HG22 VAL 81 1HG2 VAL 81 -8.921 -1.128 -11.651 1385 HG23 VAL 81 2HG2 VAL 81 -9.771 -1.923 -10.286 1386 H PHE 82 H PHE 82 -5.806 -2.610 -8.062 1387 HA PHE 82 HA PHE 82 -3.785 -4.361 -8.984 1388 HB2 PHE 82 2HB PHE 82 -3.917 -2.535 -6.490 1389 HB3 PHE 82 1HB PHE 82 -2.452 -3.485 -6.935 1390 HD1 PHE 82 2HD PHE 82 -1.597 -3.238 -9.393 1391 HD2 PHE 82 1HD PHE 82 -4.040 -0.332 -7.371 1392 HE1 PHE 82 2HE PHE 82 -0.788 -1.482 -10.932 1393 HE2 PHE 82 1HE PHE 82 -3.254 1.412 -8.917 1394 HZ PHE 82 HZ PHE 82 -1.622 0.857 -10.703 1395 H ALA 83 H ALA 83 -6.130 -4.558 -6.362 1396 HA ALA 83 HA ALA 83 -4.862 -6.738 -5.066 1397 HB1 ALA 83 1HB ALA 83 -6.507 -5.273 -3.876 1398 HB2 ALA 83 2HB ALA 83 -7.012 -6.992 -3.832 1399 HB3 ALA 83 3HB ALA 83 -7.812 -5.848 -4.975 1400 H LEU 84 H LEU 84 -7.505 -6.477 -7.550 1401 HA LEU 84 HA LEU 84 -8.290 -9.133 -7.397 1402 HB2 LEU 84 2HB LEU 84 -9.617 -7.381 -8.503 1403 HB3 LEU 84 1HB LEU 84 -8.430 -7.254 -9.835 1404 HG LEU 84 HG LEU 84 -9.666 -9.983 -9.244 1405 HD11 LEU 84 1HD1 LEU 84 -11.588 -8.435 -8.955 1406 HD12 LEU 84 2HD1 LEU 84 -11.760 -9.442 -10.440 1407 HD13 LEU 84 3HD1 LEU 84 -11.250 -7.710 -10.580 1408 HD21 LEU 84 3HD2 LEU 84 -9.757 -10.183 -11.727 1409 HD22 LEU 84 1HD2 LEU 84 -8.095 -9.765 -11.198 1410 HD23 LEU 84 2HD2 LEU 84 -9.155 -8.495 -11.914 1411 H VAL 85 H VAL 85 -5.705 -7.581 -9.295 1412 HA VAL 85 HA VAL 85 -5.227 -9.850 -10.877 1413 HB VAL 85 HB VAL 85 -3.143 -8.850 -11.575 1414 HG11 VAL 85 1HG1 VAL 85 -4.160 -6.866 -12.614 1415 HG12 VAL 85 2HG1 VAL 85 -5.372 -6.710 -11.302 1416 HG13 VAL 85 3HG1 VAL 85 -5.462 -8.098 -12.427 1417 HG21 VAL 85 3HG2 VAL 85 -3.722 -6.674 -9.460 1418 HG22 VAL 85 1HG2 VAL 85 -2.373 -6.674 -10.640 1419 HG23 VAL 85 2HG2 VAL 85 -2.400 -7.890 -9.323 1420 H THR 86 H THR 86 -4.770 -9.608 -7.533 1421 HA THR 86 HA THR 86 -2.480 -11.126 -7.127 1422 HB THR 86 HB THR 86 -5.082 -11.238 -5.521 1423 HG1 THR 86 1HG THR 86 -4.407 -9.218 -5.458 1424 HG21 THR 86 3HG2 THR 86 -3.535 -11.880 -3.617 1425 HG22 THR 86 1HG2 THR 86 -2.152 -11.962 -4.769 1426 HG23 THR 86 2HG2 THR 86 -3.524 -13.126 -4.904 1427 H ALA 87 H ALA 87 -5.572 -11.987 -8.549 1428 HA ALA 87 HA ALA 87 -5.528 -14.747 -8.322 1429 HB1 ALA 87 1HB ALA 87 -6.296 -13.075 -10.811 1430 HB2 ALA 87 2HB ALA 87 -7.364 -13.338 -9.403 1431 HB3 ALA 87 3HB ALA 87 -6.875 -14.740 -10.422 1432 H ALA 88 H ALA 88 -3.639 -12.585 -10.471 1433 HA ALA 88 HA ALA 88 -2.683 -14.749 -12.110 1434 HB1 ALA 88 1HB ALA 88 -2.876 -12.445 -13.094 1435 HB2 ALA 88 2HB ALA 88 -1.169 -13.018 -13.120 1436 HB3 ALA 88 3HB ALA 88 -1.701 -11.834 -11.873 1437 H LEU 89 H LEU 89 -1.628 -12.866 -9.273 1438 HA LEU 89 HA LEU 89 1.019 -13.895 -9.323 1439 HB2 LEU 89 2HB LEU 89 -0.550 -12.466 -7.098 1440 HB3 LEU 89 1HB LEU 89 1.127 -13.052 -6.902 1441 HG LEU 89 HG LEU 89 1.243 -10.748 -7.297 1442 HD11 LEU 89 1HD1 LEU 89 2.788 -10.587 -9.172 1443 HD12 LEU 89 2HD1 LEU 89 2.131 -12.078 -9.938 1444 HD13 LEU 89 3HD1 LEU 89 3.006 -12.178 -8.361 1445 HD21 LEU 89 3HD2 LEU 89 0.479 -9.519 -9.278 1446 HD22 LEU 89 1HD2 LEU 89 -0.905 -10.263 -8.421 1447 HD23 LEU 89 2HD2 LEU 89 -0.296 -10.993 -9.958 1448 H ALA 90 H ALA 90 -1.998 -14.927 -7.759 1449 HA ALA 90 HA ALA 90 -0.826 -16.712 -5.978 1450 HB1 ALA 90 1HB ALA 90 -3.575 -16.886 -7.342 1451 HB2 ALA 90 2HB ALA 90 -3.210 -15.983 -5.828 1452 HB3 ALA 90 3HB ALA 90 -3.076 -17.779 -5.847 1453 H THR 91 H THR 91 -1.663 -17.120 -9.430 1454 HA THR 91 HA THR 91 -1.109 -19.879 -9.483 1455 HB THR 91 HB THR 91 -0.530 -19.037 -12.079 1456 HG1 THR 91 1HG THR 91 -1.008 -16.828 -11.264 1457 HG21 THR 91 3HG2 THR 91 -2.927 -19.591 -12.511 1458 HG22 THR 91 1HG2 THR 91 -3.278 -19.466 -10.744 1459 HG23 THR 91 2HG2 THR 91 -2.187 -20.760 -11.357 1460 H ASP 92 H ASP 92 1.161 -17.303 -8.913 1461 HA ASP 92 HA ASP 92 3.110 -18.123 -10.724 1462 HB2 ASP 92 2HB ASP 92 3.086 -15.879 -9.428 1463 HB3 ASP 92 1HB ASP 92 3.861 -16.766 -8.073 1464 H PHE 93 H PHE 93 2.597 -19.013 -7.271 1465 HA PHE 93 HA PHE 93 4.889 -20.677 -7.286 1466 HB2 PHE 93 2HB PHE 93 4.470 -21.327 -5.102 1467 HB3 PHE 93 1HB PHE 93 3.818 -19.662 -5.165 1468 HD1 PHE 93 2HD PHE 93 1.231 -19.441 -5.543 1469 HD2 PHE 93 1HD PHE 93 3.163 -23.055 -4.278 1470 HE1 PHE 93 2HE PHE 93 -0.928 -20.295 -4.712 1471 HE2 PHE 93 1HE PHE 93 0.986 -23.923 -3.447 1472 HZ PHE 93 HZ PHE 93 -1.056 -22.537 -3.650 1473 H VAL 94 H VAL 94 1.587 -21.176 -8.306 1474 HA VAL 94 HA VAL 94 1.491 -23.971 -8.001 1475 HB VAL 94 HB VAL 94 -0.109 -22.216 -9.930 1476 HG11 VAL 94 1HG1 VAL 94 -0.702 -24.964 -8.616 1477 HG12 VAL 94 2HG1 VAL 94 -0.433 -24.658 -10.371 1478 HG13 VAL 94 3HG1 VAL 94 -1.888 -23.992 -9.557 1479 HG21 VAL 94 3HG2 VAL 94 -0.572 -22.907 -6.942 1480 HG22 VAL 94 1HG2 VAL 94 -1.761 -22.079 -8.010 1481 HG23 VAL 94 2HG2 VAL 94 -0.221 -21.274 -7.604 1482 H ARG 95 H ARG 95 3.136 -21.898 -10.297 1483 HA ARG 95 HA ARG 95 3.246 -23.789 -12.414 1484 HB2 ARG 95 2HB ARG 95 5.342 -21.638 -11.759 1485 HB3 ARG 95 1HB ARG 95 5.184 -22.573 -13.283 1486 HG2 ARG 95 2HG ARG 95 2.820 -21.477 -13.519 1487 HG3 ARG 95 1HG ARG 95 3.368 -20.375 -12.197 1488 HD2 ARG 95 2HD ARG 95 5.526 -19.993 -13.729 1489 HD3 ARG 95 1HD ARG 95 4.551 -20.755 -15.035 1490 HE ARG 95 HE ARG 95 3.107 -18.885 -15.109 1491 HH11 ARG 95 1HH2 ARG 95 5.532 -18.526 -12.396 1492 HH12 ARG 95 2HH2 ARG 95 5.093 -16.930 -12.048 1493 HH21 ARG 95 1HH1 ARG 95 2.733 -16.517 -14.751 1494 HH22 ARG 95 2HH1 ARG 95 3.596 -15.728 -13.497 1495 H ARG 96 H ARG 96 4.822 -23.689 -9.254 1496 HA ARG 96 HA ARG 96 7.193 -24.995 -10.047 1497 HB2 ARG 96 2HB ARG 96 7.724 -25.403 -7.791 1498 HB3 ARG 96 1HB ARG 96 6.813 -23.856 -7.761 1499 HG2 ARG 96 2HG ARG 96 4.737 -25.230 -7.106 1500 HG3 ARG 96 1HG ARG 96 5.797 -26.671 -6.970 1501 HD2 ARG 96 2HD ARG 96 7.115 -25.622 -5.146 1502 HD3 ARG 96 1HD ARG 96 6.155 -24.092 -5.299 1503 HE ARG 96 HE ARG 96 4.118 -25.383 -4.743 1504 HH11 ARG 96 1HH2 ARG 96 7.288 -26.759 -3.516 1505 HH12 ARG 96 2HH2 ARG 96 6.525 -27.638 -2.261 1506 HH21 ARG 96 1HH1 ARG 96 3.159 -26.763 -3.056 1507 HH22 ARG 96 2HH1 ARG 96 4.138 -27.720 -2.055 1508 H GLU 97 H GLU 97 3.973 -26.052 -9.993 1509 HA GLU 97 HA GLU 97 4.138 -28.736 -9.308 1510 HB2 GLU 97 2HB GLU 97 1.986 -27.455 -9.666 1511 HB3 GLU 97 1HB GLU 97 2.384 -27.302 -11.403 1512 HG2 GLU 97 2HG GLU 97 0.654 -29.000 -11.062 1513 HG3 GLU 97 1HG GLU 97 2.139 -29.788 -11.696 1514 H GLU 98 H GLU 98 4.636 -27.006 -12.394 1515 HA GLU 98 HA GLU 98 4.755 -29.215 -14.037 1516 HB2 GLU 98 2HB GLU 98 6.336 -26.606 -14.467 1517 HB3 GLU 98 1HB GLU 98 5.655 -27.711 -15.703 1518 HG2 GLU 98 2HG GLU 98 4.028 -25.879 -13.789 1519 HG3 GLU 98 1HG GLU 98 4.420 -25.561 -15.508 1520 H GLU 99 H GLU 99 7.343 -27.295 -12.468 1521 HA GLU 99 HA GLU 99 9.305 -29.103 -13.518 1522 HB2 GLU 99 2HB GLU 99 9.272 -26.327 -12.819 1523 HB3 GLU 99 1HB GLU 99 10.549 -27.118 -11.843 1524 HG2 GLU 99 2HG GLU 99 11.476 -26.275 -13.948 1525 HG3 GLU 99 1HG GLU 99 11.546 -28.072 -13.957 1526 H ARG 100 H ARG 100 7.386 -29.294 -10.790 1527 HA ARG 100 HA ARG 100 9.378 -30.590 -9.145 1528 HB2 ARG 100 2HB ARG 100 7.226 -29.551 -8.180 1529 HB3 ARG 100 1HB ARG 100 6.313 -30.881 -8.955 1530 HG2 ARG 100 2HG ARG 100 7.757 -32.528 -7.570 1531 HG3 ARG 100 1HG ARG 100 8.517 -31.107 -6.798 1532 HD2 ARG 100 2HD ARG 100 6.845 -31.990 -5.270 1533 HD3 ARG 100 1HD ARG 100 6.200 -30.425 -5.879 1534 HE ARG 100 HE ARG 100 5.217 -33.192 -6.396 1535 HH11 ARG 100 1HH2 ARG 100 4.649 -29.678 -6.930 1536 HH12 ARG 100 2HH2 ARG 100 3.113 -29.958 -7.714 1537 HH21 ARG 100 1HH1 ARG 100 3.259 -33.484 -7.746 1538 HH22 ARG 100 2HH1 ARG 100 2.501 -32.075 -8.423 1539 H ARG 101 H ARG 101 6.791 -31.431 -11.485 1540 HA ARG 101 HA ARG 101 7.315 -34.248 -11.299 1541 HB2 ARG 101 2HB ARG 101 5.888 -32.692 -13.543 1542 HB3 ARG 101 1HB ARG 101 5.860 -34.474 -13.278 1543 HG2 ARG 101 2HG ARG 101 4.725 -34.084 -11.043 1544 HG3 ARG 101 1HG ARG 101 4.692 -32.320 -11.404 1545 HD2 ARG 101 2HD ARG 101 3.388 -32.874 -13.564 1546 HD3 ARG 101 1HD ARG 101 3.302 -34.594 -12.978 1547 HE ARG 101 HE ARG 101 2.333 -32.496 -11.048 1548 HH11 ARG 101 1HH2 ARG 101 1.379 -34.855 -13.551 1549 HH12 ARG 101 2HH2 ARG 101 -0.264 -34.542 -13.492 1550 HH21 ARG 101 1HH1 ARG 101 0.180 -32.092 -10.815 1551 HH22 ARG 101 2HH1 ARG 101 -1.010 -32.645 -11.914 1552 H GLY 102 H GLY 102 8.362 -31.511 -13.283 1553 HA2 GLY 102 2HA GLY 102 10.375 -31.353 -14.348 1554 HA3 GLY 102 1HA GLY 102 10.517 -33.158 -14.403 1555 H HIS 103 H HIS 103 7.578 -31.422 -15.138 1556 HA HIS 103 HA HIS 103 6.146 -31.956 -16.724 1557 HB2 HIS 103 2HB HIS 103 6.328 -30.504 -18.669 1558 HB3 HIS 103 1HB HIS 103 6.836 -29.680 -17.169 1559 HD1 HIS 103 1HD HIS 103 8.415 -31.171 -20.348 1560 HD2 HIS 103 2HD HIS 103 9.324 -28.534 -17.195 1561 HE1 HIS 103 1HE HIS 103 10.596 -30.064 -20.904 1562 HE2 HIS 103 2HE HIS 103 11.095 -28.436 -19.036 1563 H1 SER 1 H SER 1 15.393 -21.261 1.484 1564 HA SER 1 HA SER 1 16.626 -20.330 -0.205 1565 HB2 SER 1 2HB SER 1 18.747 -21.649 0.962 1566 HB3 SER 1 1HB SER 1 18.420 -22.826 -0.341 1567 HG SER 1 1HG SER 1 19.961 -21.305 -0.847 1568 H ALA 2 H ALA 2 15.185 -20.756 -1.995 1569 HA ALA 2 HA ALA 2 14.869 -23.459 -2.880 1570 HB1 ALA 2 1HB ALA 2 13.106 -23.406 -1.054 1571 HB2 ALA 2 2HB ALA 2 12.339 -23.451 -2.681 1572 HB3 ALA 2 3HB ALA 2 12.444 -21.893 -1.751 1573 H ASP 3 H ASP 3 13.211 -23.266 -4.840 1574 HA ASP 3 HA ASP 3 14.356 -21.466 -6.580 1575 HB2 ASP 3 2HB ASP 3 11.695 -23.014 -6.829 1576 HB3 ASP 3 1HB ASP 3 12.366 -21.994 -8.151 1577 H HIS 4 H HIS 4 11.155 -21.335 -5.023 1578 HA HIS 4 HA HIS 4 10.417 -18.866 -6.160 1579 HB2 HIS 4 2HB HIS 4 8.678 -18.705 -4.381 1580 HB3 HIS 4 1HB HIS 4 8.657 -20.288 -5.198 1581 HD1 HIS 4 1HD HIS 4 9.400 -22.436 -3.694 1582 HD2 HIS 4 2HD HIS 4 9.760 -18.741 -1.667 1583 HE1 HIS 4 1HE HIS 4 9.878 -22.917 -1.292 1584 HE2 HIS 4 2HE HIS 4 10.392 -20.720 -0.209 1585 H GLU 5 H GLU 5 12.489 -19.603 -3.357 1586 HA GLU 5 HA GLU 5 12.222 -16.953 -2.227 1587 HB2 GLU 5 2HB GLU 5 13.970 -19.389 -1.634 1588 HB3 GLU 5 1HB GLU 5 14.311 -17.812 -0.859 1589 HG2 GLU 5 2HG GLU 5 12.498 -17.839 0.512 1590 HG3 GLU 5 1HG GLU 5 11.443 -18.699 -0.636 1591 H ARG 6 H ARG 6 14.551 -18.810 -4.247 1592 HA ARG 6 HA ARG 6 16.514 -16.813 -4.358 1593 HB2 ARG 6 2HB ARG 6 15.737 -18.955 -6.441 1594 HB3 ARG 6 1HB ARG 6 17.153 -17.867 -6.601 1595 HG2 ARG 6 2HG ARG 6 18.124 -18.779 -4.485 1596 HG3 ARG 6 1HG ARG 6 16.755 -19.913 -4.324 1597 HD2 ARG 6 2HD ARG 6 18.765 -21.061 -5.342 1598 HD3 ARG 6 1HD ARG 6 17.364 -21.035 -6.480 1599 HE ARG 6 HE ARG 6 18.505 -19.559 -7.900 1600 HH11 ARG 6 1HH2 ARG 6 20.424 -19.751 -4.845 1601 HH12 ARG 6 2HH2 ARG 6 21.542 -18.550 -5.298 1602 HH21 ARG 6 1HH1 ARG 6 20.042 -18.074 -8.569 1603 HH22 ARG 6 2HH1 ARG 6 21.327 -17.516 -7.535 1604 H GLU 7 H GLU 7 13.659 -17.479 -6.454 1605 HA GLU 7 HA GLU 7 14.293 -15.451 -8.254 1606 HB2 GLU 7 2HB GLU 7 12.428 -17.513 -8.209 1607 HB3 GLU 7 1HB GLU 7 11.379 -16.080 -8.009 1608 HG2 GLU 7 2HG GLU 7 11.488 -16.437 -10.347 1609 HG3 GLU 7 1HG GLU 7 12.651 -15.088 -10.097 1610 H ALA 8 H ALA 8 12.430 -15.411 -5.213 1611 HA ALA 8 HA ALA 8 11.355 -12.831 -5.521 1612 HB1 ALA 8 1HB ALA 8 12.146 -14.315 -2.928 1613 HB2 ALA 8 2HB ALA 8 10.536 -14.393 -3.737 1614 HB3 ALA 8 3HB ALA 8 11.113 -12.844 -3.021 1615 H GLN 9 H GLN 9 14.435 -14.019 -4.084 1616 HA GLN 9 HA GLN 9 15.206 -11.471 -3.191 1617 HB2 GLN 9 2HB GLN 9 16.150 -13.670 -2.331 1618 HB3 GLN 9 1HB GLN 9 17.017 -13.860 -3.889 1619 HG2 GLN 9 2HG GLN 9 18.578 -13.070 -2.188 1620 HG3 GLN 9 1HG GLN 9 18.341 -11.731 -3.360 1621 HE21 GLN 9 1HE2 GLN 9 16.898 -9.895 -2.669 1622 HE22 GLN 9 2HE2 GLN 9 16.554 -9.593 -1.022 1623 H LYS 10 H LYS 10 15.658 -13.187 -6.230 1624 HA LYS 10 HA LYS 10 17.521 -11.458 -7.437 1625 HB2 LYS 10 2HB LYS 10 17.009 -13.780 -8.177 1626 HB3 LYS 10 1HB LYS 10 15.325 -13.310 -8.562 1627 HG2 LYS 10 2HG LYS 10 16.051 -11.846 -10.386 1628 HG3 LYS 10 1HG LYS 10 17.777 -12.141 -10.012 1629 HD2 LYS 10 2HD LYS 10 15.715 -14.331 -10.787 1630 HD3 LYS 10 1HD LYS 10 16.762 -13.493 -11.974 1631 HE2 LYS 10 2HE LYS 10 17.753 -15.292 -9.640 1632 HE3 LYS 10 1HE LYS 10 17.707 -15.702 -11.391 1633 HZ1 LYS 10 3HZ LYS 10 19.515 -13.824 -9.990 1634 HZ2 LYS 10 1HZ LYS 10 19.117 -13.538 -11.602 1635 HZ3 LYS 10 2HZ LYS 10 19.837 -15.022 -11.125 1636 H ALA 11 H ALA 11 13.951 -11.431 -7.176 1637 HA ALA 11 HA ALA 11 13.488 -9.480 -9.113 1638 HB1 ALA 11 1HB ALA 11 11.819 -10.037 -6.581 1639 HB2 ALA 11 2HB ALA 11 11.680 -10.945 -8.130 1640 HB3 ALA 11 3HB ALA 11 11.256 -9.197 -8.071 1641 H GLU 12 H GLU 12 14.281 -9.207 -5.617 1642 HA GLU 12 HA GLU 12 13.707 -6.486 -5.402 1643 HB2 GLU 12 2HB GLU 12 15.780 -8.094 -3.800 1644 HB3 GLU 12 1HB GLU 12 15.171 -6.456 -3.391 1645 HG2 GLU 12 2HG GLU 12 12.808 -7.428 -3.265 1646 HG3 GLU 12 1HG GLU 12 13.516 -9.074 -3.417 1647 H GLU 13 H GLU 13 16.544 -8.153 -6.594 1648 HA GLU 13 HA GLU 13 18.316 -5.950 -6.623 1649 HB2 GLU 13 2HB GLU 13 19.202 -8.167 -6.558 1650 HB3 GLU 13 1HB GLU 13 18.149 -8.722 -7.896 1651 HG2 GLU 13 2HG GLU 13 20.463 -8.647 -8.646 1652 HG3 GLU 13 1HG GLU 13 19.453 -7.482 -9.552 1653 H GLU 14 H GLU 14 15.788 -7.107 -8.806 1654 HA GLU 14 HA GLU 14 16.652 -5.670 -11.082 1655 HB2 GLU 14 2HB GLU 14 15.140 -7.699 -11.145 1656 HB3 GLU 14 1HB GLU 14 13.857 -6.711 -10.380 1657 HG2 GLU 14 2HG GLU 14 13.330 -6.874 -12.703 1658 HG3 GLU 14 1HG GLU 14 13.873 -5.187 -12.413 1659 H LEU 15 H LEU 15 14.549 -4.972 -8.295 1660 HA LEU 15 HA LEU 15 13.373 -2.672 -9.282 1661 HB2 LEU 15 2HB LEU 15 12.611 -3.920 -7.239 1662 HB3 LEU 15 1HB LEU 15 14.027 -3.306 -6.338 1663 HG LEU 15 HG LEU 15 13.190 -1.012 -6.447 1664 HD11 LEU 15 1HD1 LEU 15 10.958 -0.448 -7.524 1665 HD12 LEU 15 2HD1 LEU 15 10.962 -2.068 -8.308 1666 HD13 LEU 15 3HD1 LEU 15 12.236 -0.854 -8.707 1667 HD21 LEU 15 3HD2 LEU 15 12.259 -2.505 -4.669 1668 HD22 LEU 15 1HD2 LEU 15 10.882 -2.950 -5.742 1669 HD23 LEU 15 2HD2 LEU 15 11.059 -1.259 -5.161 1670 H GLN 16 H GLN 16 16.390 -3.099 -7.412 1671 HA GLN 16 HA GLN 16 17.054 -0.460 -7.014 1672 HB2 GLN 16 2HB GLN 16 19.079 -2.685 -7.709 1673 HB3 GLN 16 1HB GLN 16 19.397 -1.142 -6.843 1674 HG2 GLN 16 2HG GLN 16 17.682 -2.010 -5.048 1675 HG3 GLN 16 1HG GLN 16 17.848 -3.625 -5.830 1676 HE21 GLN 16 1HE2 GLN 16 20.249 -4.511 -6.010 1677 HE22 GLN 16 2HE2 GLN 16 21.359 -3.965 -4.823 1678 H LYS 17 H LYS 17 17.536 -2.460 -9.906 1679 HA LYS 17 HA LYS 17 19.296 -0.642 -11.189 1680 HB2 LYS 17 2HB LYS 17 19.258 -3.048 -11.641 1681 HB3 LYS 17 1HB LYS 17 17.601 -2.954 -12.281 1682 HG2 LYS 17 2HG LYS 17 19.978 -1.402 -13.492 1683 HG3 LYS 17 1HG LYS 17 19.750 -3.132 -13.867 1684 HD2 LYS 17 2HD LYS 17 17.546 -1.061 -14.496 1685 HD3 LYS 17 1HD LYS 17 18.935 -1.370 -15.567 1686 HE2 LYS 17 2HE LYS 17 16.890 -2.633 -16.272 1687 HE3 LYS 17 1HE LYS 17 18.314 -3.698 -15.946 1688 HZ1 LYS 17 3HZ LYS 17 16.181 -3.194 -13.934 1689 HZ2 LYS 17 1HZ LYS 17 17.425 -4.350 -13.914 1690 HZ3 LYS 17 2HZ LYS 17 16.140 -4.516 -14.970 1691 H VAL 18 H VAL 18 15.747 -0.983 -11.048 1692 HA VAL 18 HA VAL 18 15.223 0.678 -13.287 1693 HB VAL 18 HB VAL 18 13.451 0.096 -10.853 1694 HG11 VAL 18 1HG1 VAL 18 12.663 2.129 -12.080 1695 HG12 VAL 18 2HG1 VAL 18 11.580 0.748 -12.432 1696 HG13 VAL 18 3HG1 VAL 18 12.796 1.259 -13.656 1697 HG21 VAL 18 3HG2 VAL 18 13.642 -1.252 -13.642 1698 HG22 VAL 18 1HG2 VAL 18 12.391 -1.595 -12.394 1699 HG23 VAL 18 2HG2 VAL 18 14.102 -1.997 -12.067 1700 H LEU 19 H LEU 19 15.687 1.229 -9.776 1701 HA LEU 19 HA LEU 19 14.991 3.896 -9.665 1702 HB2 LEU 19 2HB LEU 19 17.362 2.695 -8.112 1703 HB3 LEU 19 1HB LEU 19 16.362 4.106 -7.655 1704 HG LEU 19 HG LEU 19 15.519 1.155 -7.738 1705 HD11 LEU 19 1HD1 LEU 19 15.903 3.052 -5.345 1706 HD12 LEU 19 2HD1 LEU 19 17.025 1.736 -5.850 1707 HD13 LEU 19 3HD1 LEU 19 15.364 1.335 -5.274 1708 HD21 LEU 19 3HD2 LEU 19 13.532 2.532 -8.344 1709 HD22 LEU 19 1HD2 LEU 19 13.797 3.567 -6.883 1710 HD23 LEU 19 2HD2 LEU 19 13.381 1.822 -6.704 1711 H GLU 20 H GLU 20 18.128 2.380 -10.524 1712 HA GLU 20 HA GLU 20 19.591 4.749 -10.571 1713 HB2 GLU 20 2HB GLU 20 20.102 2.250 -12.292 1714 HB3 GLU 20 1HB GLU 20 21.231 3.614 -11.974 1715 HG2 GLU 20 2HG GLU 20 21.153 3.020 -9.488 1716 HG3 GLU 20 1HG GLU 20 20.240 1.532 -9.929 1717 H GLU 21 H GLU 21 17.715 3.147 -13.228 1718 HA GLU 21 HA GLU 21 18.663 5.260 -15.018 1719 HB2 GLU 21 2HB GLU 21 17.428 4.258 -16.790 1720 HB3 GLU 21 1HB GLU 21 18.569 3.102 -16.064 1721 HG2 GLU 21 2HG GLU 21 16.882 1.739 -15.091 1722 HG3 GLU 21 1HG GLU 21 15.620 3.018 -15.181 1723 H ALA 22 H ALA 22 16.096 4.778 -12.764 1724 HA ALA 22 HA ALA 22 14.213 6.514 -14.055 1725 HB1 ALA 22 1HB ALA 22 14.407 5.669 -11.095 1726 HB2 ALA 22 2HB ALA 22 13.420 4.840 -12.351 1727 HB3 ALA 22 3HB ALA 22 13.024 6.526 -11.865 1728 H SER 23 H SER 23 16.832 6.827 -11.589 1729 HA SER 23 HA SER 23 16.200 9.468 -10.887 1730 HB2 SER 23 2HB SER 23 18.842 9.428 -10.279 1731 HB3 SER 23 1HB SER 23 17.591 8.585 -9.319 1732 HG SER 23 1HG SER 23 18.124 6.699 -10.112 1733 H LYS 24 H LYS 24 18.290 8.075 -13.357 1734 HA LYS 24 HA LYS 24 19.402 10.351 -14.443 1735 HB2 LYS 24 2HB LYS 24 19.753 7.836 -15.049 1736 HB3 LYS 24 1HB LYS 24 18.325 7.970 -16.109 1737 HG2 LYS 24 2HG LYS 24 21.036 9.443 -16.381 1738 HG3 LYS 24 1HG LYS 24 20.483 8.026 -17.285 1739 HD2 LYS 24 2HD LYS 24 19.743 9.290 -18.912 1740 HD3 LYS 24 1HD LYS 24 18.474 9.967 -17.868 1741 HE2 LYS 24 2HE LYS 24 21.334 11.112 -18.341 1742 HE3 LYS 24 1HE LYS 24 19.781 11.759 -19.001 1743 HZ1 LYS 24 3HZ LYS 24 20.157 13.122 -17.233 1744 HZ2 LYS 24 1HZ LYS 24 20.846 11.885 -16.245 1745 HZ3 LYS 24 2HZ LYS 24 19.160 11.965 -16.521 1746 H LYS 25 H LYS 25 16.176 8.855 -14.978 1747 HA LYS 25 HA LYS 25 15.447 10.655 -17.055 1748 HB2 LYS 25 2HB LYS 25 13.666 8.875 -15.299 1749 HB3 LYS 25 1HB LYS 25 13.070 9.888 -16.656 1750 HG2 LYS 25 2HG LYS 25 14.473 8.652 -18.284 1751 HG3 LYS 25 1HG LYS 25 15.160 7.667 -16.965 1752 HD2 LYS 25 2HD LYS 25 12.585 7.033 -16.482 1753 HD3 LYS 25 1HD LYS 25 12.314 7.689 -18.124 1754 HE2 LYS 25 2HE LYS 25 12.596 5.253 -18.329 1755 HE3 LYS 25 1HE LYS 25 14.082 6.032 -19.011 1756 HZ1 LYS 25 3HZ LYS 25 14.779 4.270 -17.615 1757 HZ2 LYS 25 1HZ LYS 25 13.739 4.716 -16.369 1758 HZ3 LYS 25 2HZ LYS 25 15.084 5.684 -16.731 1759 H ALA 26 H ALA 26 14.681 10.478 -13.521 1760 HA ALA 26 HA ALA 26 12.895 12.553 -13.476 1761 HB1 ALA 26 1HB ALA 26 14.901 11.839 -11.251 1762 HB2 ALA 26 2HB ALA 26 13.342 10.993 -11.580 1763 HB3 ALA 26 3HB ALA 26 13.327 12.707 -11.057 1764 H VAL 27 H VAL 27 16.482 12.797 -13.049 1765 HA VAL 27 HA VAL 27 16.281 15.600 -12.620 1766 HB VAL 27 HB VAL 27 18.089 14.126 -11.747 1767 HG11 VAL 27 1HG1 VAL 27 18.538 12.787 -13.818 1768 HG12 VAL 27 2HG1 VAL 27 20.029 13.578 -13.203 1769 HG13 VAL 27 3HG1 VAL 27 19.196 14.253 -14.639 1770 HG21 VAL 27 3HG2 VAL 27 19.856 15.886 -12.011 1771 HG22 VAL 27 1HG2 VAL 27 18.227 16.581 -11.671 1772 HG23 VAL 27 2HG2 VAL 27 18.916 16.630 -13.334 1773 H GLU 28 H GLU 28 16.261 13.641 -15.546 1774 HA GLU 28 HA GLU 28 17.121 15.932 -17.175 1775 HB2 GLU 28 2HB GLU 28 17.691 13.243 -17.455 1776 HB3 GLU 28 1HB GLU 28 16.224 13.336 -18.456 1777 HG2 GLU 28 2HG GLU 28 18.140 13.658 -19.929 1778 HG3 GLU 28 1HG GLU 28 17.359 15.271 -19.743 1779 H ALA 29 H ALA 29 14.401 14.759 -15.687 1780 HA ALA 29 HA ALA 29 12.561 14.916 -17.857 1781 HB1 ALA 29 1HB ALA 29 12.033 14.778 -14.814 1782 HB2 ALA 29 2HB ALA 29 12.233 13.342 -15.881 1783 HB3 ALA 29 3HB ALA 29 10.864 14.433 -16.132 1784 H GLU 30 H GLU 30 13.430 16.800 -14.931 1785 HA GLU 30 HA GLU 30 12.044 19.104 -16.093 1786 HB2 GLU 30 2HB GLU 30 12.591 20.164 -13.850 1787 HB3 GLU 30 1HB GLU 30 11.334 18.914 -13.891 1788 HG2 GLU 30 2HG GLU 30 12.398 17.445 -12.532 1789 HG3 GLU 30 1HG GLU 30 14.017 17.686 -13.300 1790 H ARG 31 H ARG 31 14.748 19.798 -14.018 1791 HA ARG 31 HA ARG 31 16.198 21.338 -14.365 1792 HB2 ARG 31 2HB ARG 31 17.346 19.410 -16.386 1793 HB3 ARG 31 1HB ARG 31 18.123 20.977 -15.970 1794 HG2 ARG 31 2HG ARG 31 18.005 20.300 -13.495 1795 HG3 ARG 31 1HG ARG 31 17.576 18.669 -14.034 1796 HD2 ARG 31 2HD ARG 31 20.195 20.134 -14.028 1797 HD3 ARG 31 1HD ARG 31 19.928 18.365 -13.943 1798 HE ARG 31 HE ARG 31 20.600 20.025 -16.228 1799 HH11 ARG 31 1HH2 ARG 31 18.732 16.987 -15.515 1800 HH12 ARG 31 2HH2 ARG 31 19.547 16.067 -16.723 1801 HH21 ARG 31 1HH1 ARG 31 20.928 18.868 -18.406 1802 HH22 ARG 31 2HH1 ARG 31 20.434 17.226 -18.519 1803 H GLY 32 H GLY 32 14.571 22.787 -14.960 1804 HA2 GLY 32 2HA GLY 32 14.559 24.804 -16.159 1805 HA3 GLY 32 1HA GLY 32 15.018 23.912 -17.661 1806 H ALA 33 H ALA 33 12.619 22.999 -15.137 1807 HA ALA 33 HA ALA 33 10.527 23.169 -17.175 1808 HB1 ALA 33 1HB ALA 33 10.717 20.811 -16.369 1809 HB2 ALA 33 2HB ALA 33 9.235 21.560 -15.680 1810 HB3 ALA 33 3HB ALA 33 10.698 21.383 -14.654 1811 HA PRO 34 HA PRO 34 9.131 26.235 -14.229 1812 HB2 PRO 34 2HB PRO 34 6.354 26.208 -14.612 1813 HB3 PRO 34 1HB PRO 34 7.524 26.942 -15.772 1814 HG2 PRO 34 2HG PRO 34 6.266 24.153 -15.881 1815 HG3 PRO 34 1HG PRO 34 6.414 25.362 -17.226 1816 HD2 PRO 34 2HD PRO 34 8.203 23.274 -16.914 1817 HD3 PRO 34 1HD PRO 34 8.782 24.912 -17.463 1818 H GLY 35 H GLY 35 9.153 25.885 -12.004 1819 HA2 GLY 35 2HA GLY 35 8.272 25.252 -10.019 1820 HA3 GLY 35 1HA GLY 35 7.037 24.247 -10.873 1821 H ALA 36 H ALA 36 10.405 24.010 -11.676 1822 HA ALA 36 HA ALA 36 10.616 21.260 -11.065 1823 HB1 ALA 36 1HB ALA 36 11.989 22.310 -12.865 1824 HB2 ALA 36 2HB ALA 36 13.098 21.731 -11.577 1825 HB3 ALA 36 3HB ALA 36 12.696 23.473 -11.679 1826 H ALA 37 H ALA 37 12.121 20.310 -9.522 1827 HA ALA 37 HA ALA 37 12.712 21.967 -7.166 1828 HB1 ALA 37 1HB ALA 37 11.689 20.354 -5.571 1829 HB2 ALA 37 2HB ALA 37 11.112 19.342 -6.951 1830 HB3 ALA 37 3HB ALA 37 10.413 20.977 -6.684 1831 H LEU 38 H LEU 38 13.126 18.996 -9.138 1832 HA LEU 38 HA LEU 38 15.177 18.056 -7.274 1833 HB2 LEU 38 2HB LEU 38 13.360 16.412 -7.919 1834 HB3 LEU 38 1HB LEU 38 13.873 16.591 -9.625 1835 HG LEU 38 HG LEU 38 16.093 15.616 -9.099 1836 HD11 LEU 38 1HD1 LEU 38 16.628 14.600 -6.892 1837 HD12 LEU 38 2HD1 LEU 38 15.136 15.291 -6.184 1838 HD13 LEU 38 3HD1 LEU 38 16.460 16.374 -6.757 1839 HD21 LEU 38 3HD2 LEU 38 15.334 13.287 -8.640 1840 HD22 LEU 38 1HD2 LEU 38 14.225 14.158 -9.762 1841 HD23 LEU 38 2HD2 LEU 38 13.751 13.916 -8.045 1842 H ILE 39 H ILE 39 15.841 20.304 -8.349 1843 HA ILE 39 HA ILE 39 16.987 20.099 -10.944 1844 HB ILE 39 HB ILE 39 17.871 22.387 -10.419 1845 HG12 ILE 39 2HG1 ILE 39 16.461 22.021 -7.680 1846 HG13 ILE 39 1HG1 ILE 39 18.241 21.998 -7.917 1847 HG21 ILE 39 1HG2 ILE 39 14.886 21.938 -9.744 1848 HG22 ILE 39 2HG2 ILE 39 15.605 21.968 -11.384 1849 HG23 ILE 39 3HG2 ILE 39 15.635 23.452 -10.377 1850 HD11 ILE 39 3HD ILE 39 16.369 24.386 -8.489 1851 HD12 ILE 39 1HD ILE 39 17.554 24.229 -7.146 1852 HD13 ILE 39 2HD ILE 39 18.136 24.348 -8.845 1853 H SER 40 H SER 40 18.004 18.167 -8.761 1854 HA SER 40 HA SER 40 20.825 18.946 -8.867 1855 HB2 SER 40 2HB SER 40 19.947 19.539 -6.570 1856 HB3 SER 40 1HB SER 40 19.446 17.827 -6.366 1857 HG SER 40 1HG SER 40 21.351 17.751 -5.523 1858 H TYR 41 H TYR 41 21.922 17.409 -9.776 1859 HA TYR 41 HA TYR 41 20.827 14.906 -10.467 1860 HB2 TYR 41 2HB TYR 41 22.439 15.972 -11.992 1861 HB3 TYR 41 1HB TYR 41 23.690 15.995 -10.701 1862 HD1 TYR 41 2HD TYR 41 21.424 13.054 -11.620 1863 HD2 TYR 41 1HD TYR 41 25.382 14.752 -11.682 1864 HE1 TYR 41 2HE TYR 41 22.319 10.927 -12.411 1865 HE2 TYR 41 1HE TYR 41 26.283 12.615 -12.474 1866 HH TYR 41 HH TYR 41 24.166 9.813 -13.258 1867 HA PRO 42 HA PRO 42 23.637 12.778 -7.470 1868 HB2 PRO 42 2HB PRO 42 24.622 14.021 -5.128 1869 HB3 PRO 42 1HB PRO 42 25.522 13.996 -6.690 1870 HG2 PRO 42 2HG PRO 42 23.655 16.205 -5.644 1871 HG3 PRO 42 1HG PRO 42 25.337 16.388 -6.281 1872 HD2 PRO 42 2HD PRO 42 23.201 16.843 -7.898 1873 HD3 PRO 42 1HD PRO 42 24.610 15.887 -8.557 1874 H ASP 43 H ASP 43 21.260 15.102 -6.430 1875 HA ASP 43 HA ASP 43 20.376 13.616 -4.125 1876 HB2 ASP 43 2HB ASP 43 19.026 15.824 -5.821 1877 HB3 ASP 43 1HB ASP 43 18.208 15.015 -4.458 1878 H ALA 44 H ALA 44 20.018 13.379 -7.601 1879 HA ALA 44 HA ALA 44 17.313 12.763 -7.718 1880 HB1 ALA 44 1HB ALA 44 17.732 11.974 -10.029 1881 HB2 ALA 44 2HB ALA 44 19.508 11.909 -9.699 1882 HB3 ALA 44 3HB ALA 44 18.646 13.491 -9.705 1883 H ILE 45 H ILE 45 20.134 10.692 -7.164 1884 HA ILE 45 HA ILE 45 18.691 8.271 -7.583 1885 HB ILE 45 HB ILE 45 21.066 8.479 -8.034 1886 HG12 ILE 45 2HG1 ILE 45 20.451 6.385 -5.865 1887 HG13 ILE 45 1HG1 ILE 45 19.951 6.287 -7.587 1888 HG21 ILE 45 1HG2 ILE 45 22.738 8.590 -6.202 1889 HG22 ILE 45 2HG2 ILE 45 21.443 8.692 -4.967 1890 HG23 ILE 45 3HG2 ILE 45 21.684 10.031 -6.143 1891 HD11 ILE 45 3HD ILE 45 22.851 6.369 -6.521 1892 HD12 ILE 45 1HD ILE 45 21.998 4.955 -7.241 1893 HD13 ILE 45 2HD ILE 45 22.397 6.387 -8.267 1894 H TRP 46 H TRP 46 18.940 10.527 -4.990 1895 HA TRP 46 HA TRP 46 18.242 8.566 -2.963 1896 HB2 TRP 46 2HB TRP 46 19.770 10.948 -2.977 1897 HB3 TRP 46 1HB TRP 46 18.246 11.480 -2.222 1898 HD1 TRP 46 HD TRP 46 18.869 11.503 0.356 1899 HE1 TRP 46 1HE TRP 46 20.424 10.140 1.858 1900 HE3 TRP 46 3HE TRP 46 20.354 7.937 -2.997 1901 HZ2 TRP 46 2HZ TRP 46 21.525 7.456 1.830 1902 HZ3 TRP 46 3HZ TRP 46 21.622 5.993 -2.204 1903 HH2 TRP 46 HH TRP 46 22.197 5.748 0.171 1904 H TRP 47 H TRP 47 16.804 11.010 -5.041 1905 HA TRP 47 HA TRP 47 14.257 11.104 -3.756 1906 HB2 TRP 47 2HB TRP 47 14.693 12.822 -5.435 1907 HB3 TRP 47 1HB TRP 47 15.181 11.598 -6.656 1908 HD1 TRP 47 HD TRP 47 11.858 12.766 -4.885 1909 HE1 TRP 47 1HE TRP 47 9.903 12.147 -6.336 1910 HE3 TRP 47 3HE TRP 47 14.440 10.239 -8.463 1911 HZ2 TRP 47 2HZ TRP 47 9.459 10.602 -8.747 1912 HZ3 TRP 47 3HZ TRP 47 13.175 9.030 -10.223 1913 HH2 TRP 47 HH TRP 47 10.718 9.220 -10.368 1914 H SER 48 H SER 48 15.740 9.070 -6.365 1915 HA SER 48 HA SER 48 13.297 7.675 -6.772 1916 HB2 SER 48 2HB SER 48 14.703 6.145 -8.245 1917 HB3 SER 48 1HB SER 48 14.792 7.884 -8.684 1918 HG SER 48 1HG SER 48 16.629 6.530 -7.012 1919 H VAL 49 H VAL 49 13.291 7.314 -4.282 1920 HA VAL 49 HA VAL 49 14.227 4.565 -3.761 1921 HB VAL 49 HB VAL 49 14.364 7.023 -1.892 1922 HG11 VAL 49 1HG1 VAL 49 14.746 4.006 -1.312 1923 HG12 VAL 49 2HG1 VAL 49 13.534 5.096 -0.558 1924 HG13 VAL 49 3HG1 VAL 49 15.277 5.317 -0.200 1925 HG21 VAL 49 3HG2 VAL 49 16.531 5.135 -3.029 1926 HG22 VAL 49 1HG2 VAL 49 16.808 6.426 -1.794 1927 HG23 VAL 49 2HG2 VAL 49 16.285 6.866 -3.452 1928 H GLU 50 H GLU 50 12.304 7.245 -2.226 1929 HA GLU 50 HA GLU 50 10.625 5.380 -1.058 1930 HB2 GLU 50 2HB GLU 50 9.359 7.407 -0.231 1931 HB3 GLU 50 1HB GLU 50 11.111 7.402 0.107 1932 HG2 GLU 50 2HG GLU 50 11.495 9.022 -1.827 1933 HG3 GLU 50 1HG GLU 50 9.716 9.054 -2.099 1934 H THR 51 H THR 51 10.488 6.718 -4.174 1935 HA THR 51 HA THR 51 7.671 6.600 -4.538 1936 HB THR 51 HB THR 51 8.871 8.175 -5.841 1937 HG1 THR 51 1HG THR 51 7.300 7.155 -7.074 1938 HG21 THR 51 3HG2 THR 51 10.715 7.502 -7.431 1939 HG22 THR 51 1HG2 THR 51 10.710 5.848 -6.719 1940 HG23 THR 51 2HG2 THR 51 11.163 7.288 -5.716 1941 H ALA 52 H ALA 52 10.344 4.240 -4.691 1942 HA ALA 52 HA ALA 52 8.883 2.400 -6.339 1943 HB1 ALA 52 1HB ALA 52 11.360 1.987 -4.541 1944 HB2 ALA 52 2HB ALA 52 11.374 2.385 -6.304 1945 HB3 ALA 52 3HB ALA 52 10.718 0.805 -5.746 1946 H THR 53 H THR 53 9.106 3.148 -2.869 1947 HA THR 53 HA THR 53 7.763 0.674 -2.176 1948 HB THR 53 HB THR 53 7.946 1.799 0.171 1949 HG1 THR 53 1HG THR 53 8.427 3.878 -0.528 1950 HG21 THR 53 3HG2 THR 53 10.343 1.087 0.317 1951 HG22 THR 53 1HG2 THR 53 10.482 1.104 -1.482 1952 HG23 THR 53 2HG2 THR 53 9.390 -0.081 -0.671 1953 H THR 54 H THR 54 6.713 3.281 -3.741 1954 HA THR 54 HA THR 54 4.897 4.453 -3.905 1955 HB THR 54 HB THR 54 2.798 3.089 -3.939 1956 HG1 THR 54 1HG THR 54 3.374 1.709 -2.218 1957 HG21 THR 54 3HG2 THR 54 3.637 1.672 -5.775 1958 HG22 THR 54 1HG2 THR 54 5.320 1.722 -5.139 1959 HG23 THR 54 2HG2 THR 54 4.559 3.219 -5.787 1960 H VAL 55 H VAL 55 5.953 5.221 -1.467 1961 HA VAL 55 HA VAL 55 3.569 5.408 0.257 1962 HB VAL 55 HB VAL 55 5.164 6.573 1.856 1963 HG11 VAL 55 1HG1 VAL 55 5.520 3.584 1.124 1964 HG12 VAL 55 2HG1 VAL 55 4.219 4.306 2.138 1965 HG13 VAL 55 3HG1 VAL 55 5.921 4.339 2.718 1966 HG21 VAL 55 3HG2 VAL 55 7.303 5.188 0.069 1967 HG22 VAL 55 1HG2 VAL 55 7.575 6.020 1.633 1968 HG23 VAL 55 2HG2 VAL 55 7.102 6.977 0.226 1969 H GLY 56 H GLY 56 6.123 7.494 -1.204 1970 HA2 GLY 56 2HA GLY 56 5.897 9.523 -2.161 1971 HA3 GLY 56 1HA GLY 56 4.094 9.413 -1.969 1972 H TYR 57 H TYR 57 7.118 9.645 0.092 1973 HA TYR 57 HA TYR 57 5.517 10.527 2.263 1974 HB2 TYR 57 2HB TYR 57 7.901 9.234 2.207 1975 HB3 TYR 57 1HB TYR 57 8.585 10.891 2.166 1976 HD1 TYR 57 2HD TYR 57 7.385 12.539 4.005 1977 HD2 TYR 57 1HD TYR 57 7.601 8.250 4.285 1978 HE1 TYR 57 2HE TYR 57 6.836 12.665 6.383 1979 HE2 TYR 57 1HE TYR 57 7.098 8.388 6.692 1980 HH TYR 57 HH TYR 57 6.131 9.748 8.291 1981 H GLY 58 H GLY 58 7.905 11.973 0.018 1982 HA2 GLY 58 2HA GLY 58 6.990 13.863 -1.190 1983 HA3 GLY 58 1HA GLY 58 6.477 14.574 0.386 1984 H ASP 59 H ASP 59 9.515 12.950 -0.809 1985 HA ASP 59 HA ASP 59 11.043 14.789 0.663 1986 HB2 ASP 59 2HB ASP 59 12.994 13.704 -0.053 1987 HB3 ASP 59 1HB ASP 59 11.744 12.421 0.129 1988 H ARG 60 H ARG 60 9.962 14.732 -2.739 1989 HA ARG 60 HA ARG 60 11.097 17.432 -3.021 1990 HB2 ARG 60 2HB ARG 60 10.788 15.474 -5.373 1991 HB3 ARG 60 1HB ARG 60 11.634 17.070 -5.382 1992 HG2 ARG 60 2HG ARG 60 12.450 14.510 -3.929 1993 HG3 ARG 60 1HG ARG 60 13.158 15.067 -5.463 1994 HD2 ARG 60 2HD ARG 60 14.366 16.867 -4.396 1995 HD3 ARG 60 1HD ARG 60 13.348 16.788 -2.900 1996 HE ARG 60 HE ARG 60 14.282 14.293 -2.830 1997 HH11 ARG 60 1HH2 ARG 60 15.918 17.506 -2.969 1998 HH12 ARG 60 2HH2 ARG 60 17.521 16.845 -2.694 1999 HH21 ARG 60 1HH1 ARG 60 16.412 13.570 -1.949 2000 HH22 ARG 60 2HH1 ARG 60 17.734 14.688 -1.890 2001 H TYR 61 H TYR 61 9.807 17.971 -5.539 2002 HA TYR 61 HA TYR 61 7.160 16.960 -5.386 2003 HB2 TYR 61 2HB TYR 61 7.692 19.984 -5.143 2004 HB3 TYR 61 1HB TYR 61 6.202 19.331 -5.928 2005 HD1 TYR 61 2HD TYR 61 5.237 17.139 -4.393 2006 HD2 TYR 61 1HD TYR 61 7.123 20.745 -2.981 2007 HE1 TYR 61 2HE TYR 61 4.127 16.863 -2.255 2008 HE2 TYR 61 1HE TYR 61 5.936 20.514 -0.837 2009 HH TYR 61 HH TYR 61 4.026 17.592 -0.080 2010 HA PRO 62 HA PRO 62 8.831 17.539 -9.625 2011 HB2 PRO 62 2HB PRO 62 7.222 15.655 -10.921 2012 HB3 PRO 62 1HB PRO 62 8.562 15.128 -9.838 2013 HG2 PRO 62 2HG PRO 62 5.579 15.419 -9.168 2014 HG3 PRO 62 1HG PRO 62 6.652 13.992 -8.863 2015 HD2 PRO 62 2HD PRO 62 6.115 15.969 -6.961 2016 HD3 PRO 62 1HD PRO 62 7.717 15.091 -7.016 2017 H VAL 63 H VAL 63 7.114 17.665 -11.849 2018 HA VAL 63 HA VAL 63 4.870 19.267 -10.966 2019 HB VAL 63 HB VAL 63 6.633 20.857 -11.176 2020 HG11 VAL 63 1HG1 VAL 63 8.163 19.774 -12.725 2021 HG12 VAL 63 2HG1 VAL 63 7.744 21.411 -13.309 2022 HG13 VAL 63 3HG1 VAL 63 7.027 19.968 -14.108 2023 HG21 VAL 63 3HG2 VAL 63 5.442 22.512 -12.419 2024 HG22 VAL 63 1HG2 VAL 63 4.244 21.415 -11.670 2025 HG23 VAL 63 2HG2 VAL 63 4.582 21.311 -13.433 2026 H THR 64 H THR 64 5.053 19.720 -14.152 2027 HA THR 64 HA THR 64 3.435 17.323 -14.718 2028 HB THR 64 HB THR 64 3.314 20.103 -16.053 2029 HG1 THR 64 1HG THR 64 2.169 19.246 -13.634 2030 HG21 THR 64 3HG2 THR 64 1.012 19.530 -16.641 2031 HG22 THR 64 1HG2 THR 64 1.081 17.997 -15.708 2032 HG23 THR 64 2HG2 THR 64 2.079 18.195 -17.196 2033 H GLU 65 H GLU 65 5.893 19.628 -15.827 2034 HA GLU 65 HA GLU 65 5.989 18.644 -18.506 2035 HB2 GLU 65 2HB GLU 65 7.685 20.651 -16.917 2036 HB3 GLU 65 1HB GLU 65 7.982 20.287 -18.647 2037 HG2 GLU 65 2HG GLU 65 5.222 21.294 -17.686 2038 HG3 GLU 65 1HG GLU 65 6.571 22.413 -18.064 2039 H GLU 66 H GLU 66 7.297 17.529 -15.529 2040 HA GLU 66 HA GLU 66 9.757 16.571 -16.679 2041 HB2 GLU 66 2HB GLU 66 9.624 15.117 -14.425 2042 HB3 GLU 66 1HB GLU 66 10.238 16.796 -14.470 2043 HG2 GLU 66 2HG GLU 66 8.776 16.508 -12.546 2044 HG3 GLU 66 1HG GLU 66 7.991 17.651 -13.700 2045 H GLY 67 H GLY 67 6.498 15.593 -15.942 2046 HA2 GLY 67 2HA GLY 67 5.203 14.611 -17.595 2047 HA3 GLY 67 1HA GLY 67 6.656 13.661 -18.163 2048 H ARG 68 H ARG 68 5.120 14.484 -15.022 2049 HA ARG 68 HA ARG 68 5.384 13.053 -13.233 2050 HB2 ARG 68 2HB ARG 68 3.384 14.235 -13.092 2051 HB3 ARG 68 1HB ARG 68 2.595 13.270 -14.394 2052 HG2 ARG 68 2HG ARG 68 2.244 11.383 -12.993 2053 HG3 ARG 68 1HG ARG 68 3.399 11.940 -11.747 2054 HD2 ARG 68 2HD ARG 68 0.798 13.497 -12.335 2055 HD3 ARG 68 1HD ARG 68 0.848 12.079 -11.226 2056 HE ARG 68 HE ARG 68 1.856 14.769 -10.668 2057 HH11 ARG 68 1HH2 ARG 68 2.301 11.206 -9.701 2058 HH12 ARG 68 2HH2 ARG 68 2.071 11.691 -8.096 2059 HH21 ARG 68 1HH1 ARG 68 1.879 15.149 -8.560 2060 HH22 ARG 68 2HH1 ARG 68 1.827 13.839 -7.406 2061 H LYS 69 H LYS 69 4.159 11.274 -15.991 2062 HA LYS 69 HA LYS 69 4.009 8.718 -15.014 2063 HB2 LYS 69 2HB LYS 69 3.492 9.448 -17.396 2064 HB3 LYS 69 1HB LYS 69 5.253 9.611 -17.675 2065 HG2 LYS 69 2HG LYS 69 4.501 7.522 -18.671 2066 HG3 LYS 69 1HG LYS 69 5.562 7.158 -17.292 2067 HD2 LYS 69 2HD LYS 69 3.766 5.567 -17.226 2068 HD3 LYS 69 1HD LYS 69 3.543 6.685 -15.854 2069 HE2 LYS 69 2HE LYS 69 1.348 6.218 -16.847 2070 HE3 LYS 69 1HE LYS 69 1.758 7.935 -17.216 2071 HZ1 LYS 69 3HZ LYS 69 1.925 5.588 -19.060 2072 HZ2 LYS 69 1HZ LYS 69 2.506 7.168 -19.441 2073 HZ3 LYS 69 2HZ LYS 69 0.874 6.936 -19.114 2074 H VAL 70 H VAL 70 6.947 10.702 -15.383 2075 HA VAL 70 HA VAL 70 8.811 8.618 -15.223 2076 HB VAL 70 HB VAL 70 8.996 11.503 -14.221 2077 HG11 VAL 70 1HG1 VAL 70 10.759 10.178 -13.088 2078 HG12 VAL 70 2HG1 VAL 70 11.506 11.117 -14.422 2079 HG13 VAL 70 3HG1 VAL 70 11.195 9.352 -14.630 2080 HG21 VAL 70 3HG2 VAL 70 10.226 11.849 -16.383 2081 HG22 VAL 70 1HG2 VAL 70 8.559 11.291 -16.694 2082 HG23 VAL 70 2HG2 VAL 70 9.927 10.129 -16.846 2083 H ALA 71 H ALA 71 6.965 10.319 -12.643 2084 HA ALA 71 HA ALA 71 8.354 8.984 -10.514 2085 HB1 ALA 71 1HB ALA 71 7.210 11.219 -10.148 2086 HB2 ALA 71 2HB ALA 71 6.562 9.942 -9.060 2087 HB3 ALA 71 3HB ALA 71 5.627 10.449 -10.512 2088 H GLU 72 H GLU 72 5.139 8.752 -12.115 2089 HA GLU 72 HA GLU 72 4.175 6.644 -10.663 2090 HB2 GLU 72 2HB GLU 72 3.565 7.006 -13.637 2091 HB3 GLU 72 1HB GLU 72 2.520 6.261 -12.378 2092 HG2 GLU 72 2HG GLU 72 3.268 9.260 -12.563 2093 HG3 GLU 72 1HG GLU 72 1.735 8.497 -13.080 2094 H GLN 73 H GLN 73 6.400 6.509 -13.464 2095 HA GLN 73 HA GLN 73 5.954 3.775 -13.970 2096 HB2 GLN 73 2HB GLN 73 6.988 5.367 -15.639 2097 HB3 GLN 73 1HB GLN 73 8.507 5.316 -14.688 2098 HG2 GLN 73 2HG GLN 73 8.684 2.844 -15.118 2099 HG3 GLN 73 1HG GLN 73 7.080 2.856 -15.931 2100 HE21 GLN 73 1HE2 GLN 73 8.860 1.766 -17.467 2101 HE22 GLN 73 2HE2 GLN 73 9.570 2.809 -18.667 2102 H VAL 74 H VAL 74 8.051 5.451 -11.606 2103 HA VAL 74 HA VAL 74 9.613 3.101 -11.109 2104 HB VAL 74 HB VAL 74 9.256 5.342 -9.071 2105 HG11 VAL 74 1HG1 VAL 74 11.608 3.477 -9.876 2106 HG12 VAL 74 2HG1 VAL 74 10.558 3.291 -8.422 2107 HG13 VAL 74 3HG1 VAL 74 11.641 4.718 -8.567 2108 HG21 VAL 74 3HG2 VAL 74 9.630 6.576 -11.097 2109 HG22 VAL 74 1HG2 VAL 74 10.897 5.427 -11.685 2110 HG23 VAL 74 2HG2 VAL 74 11.199 6.492 -10.251 2111 H MET 75 H MET 75 6.731 4.684 -9.752 2112 HA MET 75 HA MET 75 6.322 3.114 -7.522 2113 HB2 MET 75 2HB MET 75 4.204 4.330 -9.416 2114 HB3 MET 75 1HB MET 75 3.869 3.713 -7.772 2115 HG2 MET 75 2HG MET 75 5.326 5.439 -6.773 2116 HG3 MET 75 1HG MET 75 5.803 6.019 -8.399 2117 HE1 MET 75 3HE MET 75 4.857 8.134 -6.372 2118 HE2 MET 75 1HE MET 75 3.738 9.082 -7.413 2119 HE3 MET 75 2HE MET 75 5.250 8.420 -8.109 2120 H LYS 76 H LYS 76 5.014 2.667 -10.856 2121 HA LYS 76 HA LYS 76 3.660 0.306 -10.237 2122 HB2 LYS 76 2HB LYS 76 3.205 1.574 -12.335 2123 HB3 LYS 76 1HB LYS 76 4.814 1.090 -12.975 2124 HG2 LYS 76 2HG LYS 76 4.165 -1.309 -12.918 2125 HG3 LYS 76 1HG LYS 76 2.584 -0.912 -12.179 2126 HD2 LYS 76 2HD LYS 76 3.506 0.098 -14.941 2127 HD3 LYS 76 1HD LYS 76 2.694 -1.483 -14.689 2128 HE2 LYS 76 2HE LYS 76 0.661 -0.378 -13.763 2129 HE3 LYS 76 1HE LYS 76 1.431 1.251 -13.957 2130 HZ1 LYS 76 3HZ LYS 76 1.566 0.860 -16.319 2131 HZ2 LYS 76 1HZ LYS 76 -0.048 0.689 -15.790 2132 HZ3 LYS 76 2HZ LYS 76 0.858 -0.694 -16.162 2133 H ALA 77 H ALA 77 7.021 0.795 -11.407 2134 HA ALA 77 HA ALA 77 7.562 -1.907 -11.873 2135 HB1 ALA 77 1HB ALA 77 9.507 0.318 -10.974 2136 HB2 ALA 77 2HB ALA 77 9.057 -0.048 -12.683 2137 HB3 ALA 77 3HB ALA 77 9.981 -1.259 -11.716 2138 H GLY 78 H GLY 78 7.639 0.035 -8.890 2139 HA2 GLY 78 2HA GLY 78 9.002 -1.842 -7.280 2140 HA3 GLY 78 1HA GLY 78 7.906 -0.500 -6.769 2141 H ILE 79 H ILE 79 5.524 -1.231 -7.908 2142 HA ILE 79 HA ILE 79 4.537 -3.069 -6.082 2143 HB ILE 79 HB ILE 79 3.328 -2.124 -8.724 2144 HG12 ILE 79 2HG1 ILE 79 2.844 -1.194 -5.813 2145 HG13 ILE 79 1HG1 ILE 79 3.874 -0.332 -6.984 2146 HG21 ILE 79 1HG2 ILE 79 2.014 -3.576 -6.324 2147 HG22 ILE 79 2HG2 ILE 79 2.206 -4.249 -7.981 2148 HG23 ILE 79 3HG2 ILE 79 1.114 -2.865 -7.710 2149 HD11 ILE 79 3HD ILE 79 0.829 -0.784 -7.247 2150 HD12 ILE 79 1HD ILE 79 1.683 0.756 -6.900 2151 HD13 ILE 79 2HD ILE 79 1.869 -0.026 -8.513 2152 H GLU 80 H GLU 80 5.434 -3.504 -9.549 2153 HA GLU 80 HA GLU 80 4.529 -6.126 -9.742 2154 HB2 GLU 80 2HB GLU 80 6.900 -4.833 -11.216 2155 HB3 GLU 80 1HB GLU 80 6.102 -6.377 -11.682 2156 HG2 GLU 80 2HG GLU 80 3.930 -5.127 -12.049 2157 HG3 GLU 80 1HG GLU 80 4.767 -3.588 -11.655 2158 H VAL 81 H VAL 81 7.656 -4.883 -8.549 2159 HA VAL 81 HA VAL 81 8.921 -7.416 -8.434 2160 HB VAL 81 HB VAL 81 9.455 -4.712 -7.118 2161 HG11 VAL 81 1HG1 VAL 81 10.365 -6.352 -5.520 2162 HG12 VAL 81 2HG1 VAL 81 11.729 -5.694 -6.475 2163 HG13 VAL 81 3HG1 VAL 81 11.083 -7.329 -6.852 2164 HG21 VAL 81 3HG2 VAL 81 11.323 -4.675 -8.782 2165 HG22 VAL 81 1HG2 VAL 81 9.771 -4.966 -9.628 2166 HG23 VAL 81 2HG2 VAL 81 10.900 -6.336 -9.333 2167 H PHE 82 H PHE 82 7.294 -5.366 -5.919 2168 HA PHE 82 HA PHE 82 7.729 -7.293 -3.905 2169 HB2 PHE 82 2HB PHE 82 5.643 -5.020 -4.048 2170 HB3 PHE 82 1HB PHE 82 5.966 -6.010 -2.572 2171 HD1 PHE 82 1HD PHE 82 8.729 -6.258 -2.168 2172 HD2 PHE 82 2HD PHE 82 6.647 -2.908 -3.895 2173 HE1 PHE 82 1HE PHE 82 10.584 -4.770 -1.527 2174 HE2 PHE 82 2HE PHE 82 8.497 -1.424 -3.242 2175 HZ PHE 82 HZ PHE 82 10.479 -2.340 -2.059 2176 H ALA 83 H ALA 83 4.961 -6.731 -6.121 2177 HA ALA 83 HA ALA 83 3.242 -8.545 -4.884 2178 HB1 ALA 83 1HB ALA 83 2.454 -6.887 -6.591 2179 HB2 ALA 83 2HB ALA 83 1.982 -8.555 -7.051 2180 HB3 ALA 83 3HB ALA 83 3.384 -7.757 -7.863 2181 H LEU 84 H LEU 84 5.904 -9.023 -7.209 2182 HA LEU 84 HA LEU 84 5.178 -11.618 -8.003 2183 HB2 LEU 84 2HB LEU 84 6.743 -10.122 -9.230 2184 HB3 LEU 84 1HB LEU 84 7.979 -10.344 -7.960 2185 HG LEU 84 HG LEU 84 6.825 -12.832 -9.291 2186 HD11 LEU 84 1HD1 LEU 84 7.082 -11.290 -11.223 2187 HD12 LEU 84 2HD1 LEU 84 8.301 -12.616 -11.282 2188 HD13 LEU 84 3HD1 LEU 84 8.792 -10.960 -10.757 2189 HD21 LEU 84 3HD2 LEU 84 9.724 -12.044 -8.542 2190 HD22 LEU 84 1HD2 LEU 84 9.189 -13.641 -9.184 2191 HD23 LEU 84 2HD2 LEU 84 8.636 -13.095 -7.567 2192 H VAL 85 H VAL 85 6.901 -10.391 -5.161 2193 HA VAL 85 HA VAL 85 8.181 -12.736 -4.381 2194 HB VAL 85 HB VAL 85 7.109 -10.442 -2.660 2195 HG11 VAL 85 1HG1 VAL 85 9.174 -12.652 -1.999 2196 HG12 VAL 85 2HG1 VAL 85 7.615 -12.322 -1.155 2197 HG13 VAL 85 3HG1 VAL 85 8.955 -11.136 -1.051 2198 HG21 VAL 85 3HG2 VAL 85 9.505 -9.622 -2.851 2199 HG22 VAL 85 1HG2 VAL 85 8.668 -9.652 -4.428 2200 HG23 VAL 85 2HG2 VAL 85 9.854 -10.942 -4.024 2201 H THR 86 H THR 86 4.788 -11.949 -4.386 2202 HA THR 86 HA THR 86 3.836 -13.570 -2.401 2203 HB THR 86 HB THR 86 2.490 -13.125 -5.099 2204 HG1 THR 86 1HG THR 86 2.835 -11.159 -4.497 2205 HG21 THR 86 3HG2 THR 86 1.265 -14.733 -3.576 2206 HG22 THR 86 1HG2 THR 86 0.404 -13.157 -3.652 2207 HG23 THR 86 2HG2 THR 86 1.407 -13.556 -2.212 2208 H ALA 87 H ALA 87 5.402 -14.560 -5.384 2209 HA ALA 87 HA ALA 87 4.396 -17.150 -5.632 2210 HB1 ALA 87 1HB ALA 87 7.311 -16.186 -6.040 2211 HB2 ALA 87 2HB ALA 87 6.009 -16.056 -7.263 2212 HB3 ALA 87 3HB ALA 87 6.571 -17.678 -6.750 2213 H ALA 88 H ALA 88 6.720 -15.754 -3.333 2214 HA ALA 88 HA ALA 88 7.517 -18.352 -2.306 2215 HB1 ALA 88 1HB ALA 88 9.206 -16.471 -2.257 2216 HB2 ALA 88 2HB ALA 88 8.790 -17.010 -0.586 2217 HB3 ALA 88 3HB ALA 88 8.079 -15.499 -1.253 2218 H LEU 89 H LEU 89 5.665 -15.474 -1.279 2219 HA LEU 89 HA LEU 89 4.999 -16.349 1.235 2220 HB2 LEU 89 2HB LEU 89 3.246 -14.577 -0.569 2221 HB3 LEU 89 1HB LEU 89 3.205 -14.639 1.220 2222 HG LEU 89 HG LEU 89 5.626 -13.699 -0.451 2223 HD11 LEU 89 1HD1 LEU 89 3.514 -12.012 1.023 2224 HD12 LEU 89 2HD1 LEU 89 3.680 -12.168 -0.757 2225 HD13 LEU 89 3HD1 LEU 89 4.994 -11.401 0.194 2226 HD21 LEU 89 3HD2 LEU 89 6.322 -14.540 1.792 2227 HD22 LEU 89 1HD2 LEU 89 5.067 -13.510 2.578 2228 HD23 LEU 89 2HD2 LEU 89 6.453 -12.749 1.716 2229 H ALA 90 H ALA 90 3.238 -16.888 -1.854 2230 HA ALA 90 HA ALA 90 0.982 -18.025 -0.571 2231 HB1 ALA 90 1HB ALA 90 1.931 -18.273 -3.482 2232 HB2 ALA 90 2HB ALA 90 0.829 -17.004 -2.840 2233 HB3 ALA 90 3HB ALA 90 0.293 -18.723 -2.862 2234 H THR 91 H THR 91 4.146 -19.277 -1.060 2235 HA THR 91 HA THR 91 3.237 -22.044 -1.190 2236 HB THR 91 HB THR 91 6.077 -20.948 -0.803 2237 HG1 THR 91 1HG THR 91 5.290 -20.262 -2.800 2238 HG21 THR 91 3HG2 THR 91 4.963 -23.699 -1.721 2239 HG22 THR 91 1HG2 THR 91 5.835 -23.365 -0.183 2240 HG23 THR 91 2HG2 THR 91 6.703 -23.227 -1.744 2241 H ASP 92 H ASP 92 3.778 -19.472 1.165 2242 HA ASP 92 HA ASP 92 5.115 -21.119 2.982 2243 HB2 ASP 92 2HB ASP 92 4.950 -18.405 2.826 2244 HB3 ASP 92 1HB ASP 92 3.761 -18.676 4.142 2245 H PHE 93 H PHE 93 1.698 -20.645 2.405 2246 HA PHE 93 HA PHE 93 0.945 -21.728 4.960 2247 HB2 PHE 93 2HB PHE 93 -1.290 -21.566 4.388 2248 HB3 PHE 93 1HB PHE 93 -0.572 -20.204 3.481 2249 HD1 PHE 93 1HD PHE 93 -0.150 -20.537 0.956 2250 HD2 PHE 93 2HD PHE 93 -2.509 -23.264 3.289 2251 HE1 PHE 93 1HE PHE 93 -1.197 -21.397 -1.108 2252 HE2 PHE 93 2HE PHE 93 -3.568 -24.116 1.228 2253 HZ PHE 93 HZ PHE 93 -2.922 -23.181 -0.980 2254 H VAL 94 H VAL 94 2.120 -23.078 1.979 2255 HA VAL 94 HA VAL 94 0.571 -25.461 2.089 2256 HB VAL 94 HB VAL 94 3.133 -25.006 0.499 2257 HG11 VAL 94 1HG1 VAL 94 2.307 -27.379 0.590 2258 HG12 VAL 94 2HG1 VAL 94 1.993 -26.686 -1.036 2259 HG13 VAL 94 3HG1 VAL 94 0.646 -26.841 0.147 2260 HG21 VAL 94 3HG2 VAL 94 1.543 -23.100 0.050 2261 HG22 VAL 94 1HG2 VAL 94 0.194 -24.264 -0.175 2262 HG23 VAL 94 2HG2 VAL 94 1.572 -24.228 -1.332 2263 H ARG 95 H ARG 95 3.531 -24.268 3.479 2264 HA ARG 95 HA ARG 95 4.855 -26.548 4.271 2265 HB2 ARG 95 2HB ARG 95 4.302 -24.036 5.988 2266 HB3 ARG 95 1HB ARG 95 5.586 -25.252 6.295 2267 HG2 ARG 95 2HG ARG 95 6.751 -24.560 4.199 2268 HG3 ARG 95 1HG ARG 95 5.468 -23.330 3.883 2269 HD2 ARG 95 2HD ARG 95 5.956 -22.233 6.097 2270 HD3 ARG 95 1HD ARG 95 7.176 -23.532 6.442 2271 HE ARG 95 HE ARG 95 7.343 -21.326 4.369 2272 HH11 ARG 95 1HH2 ARG 95 8.540 -22.501 7.385 2273 HH12 ARG 95 2HH2 ARG 95 9.946 -21.631 7.247 2274 HH21 ARG 95 1HH1 ARG 95 9.610 -20.728 3.848 2275 HH22 ARG 95 2HH1 ARG 95 10.808 -20.983 5.055 2276 H ARG 96 H ARG 96 1.888 -25.062 5.585 2277 HA ARG 96 HA ARG 96 1.801 -26.183 8.084 2278 HB2 ARG 96 2HB ARG 96 0.162 -24.438 7.217 2279 HB3 ARG 96 1HB ARG 96 -0.556 -25.696 6.171 2280 HG2 ARG 96 2HG ARG 96 -1.106 -26.995 8.416 2281 HG3 ARG 96 1HG ARG 96 -0.645 -25.469 9.216 2282 HD2 ARG 96 2HD ARG 96 -3.035 -25.491 9.019 2283 HD3 ARG 96 1HD ARG 96 -2.469 -24.289 7.796 2284 HE ARG 96 HE ARG 96 -2.690 -26.136 6.049 2285 HH11 ARG 96 1HH2 ARG 96 -4.875 -26.054 9.003 2286 HH12 ARG 96 2HH2 ARG 96 -6.180 -26.723 8.155 2287 HH21 ARG 96 1HH1 ARG 96 -4.403 -27.619 5.187 2288 HH22 ARG 96 2HH1 ARG 96 -5.893 -27.691 6.025 2289 H GLU 97 H GLU 97 0.837 -27.582 4.953 2290 HA GLU 97 HA GLU 97 -0.582 -29.769 6.034 2291 HB2 GLU 97 2HB GLU 97 -0.981 -28.930 3.738 2292 HB3 GLU 97 1HB GLU 97 0.735 -29.242 3.305 2293 HG2 GLU 97 2HG GLU 97 -0.701 -30.903 2.257 2294 HG3 GLU 97 1HG GLU 97 0.353 -31.701 3.472 2295 H GLU 98 H GLU 98 2.832 -29.135 5.322 2296 HA GLU 98 HA GLU 98 3.508 -31.925 5.445 2297 HB2 GLU 98 2HB GLU 98 5.456 -29.575 5.321 2298 HB3 GLU 98 1HB GLU 98 5.717 -31.297 4.871 2299 HG2 GLU 98 2HG GLU 98 3.726 -30.892 3.141 2300 HG3 GLU 98 1HG GLU 98 4.019 -29.142 3.435 2301 H GLU 99 H GLU 99 3.640 -29.026 7.566 2302 HA GLU 99 HA GLU 99 4.966 -30.408 9.653 2303 HB2 GLU 99 2HB GLU 99 3.331 -27.823 9.811 2304 HB3 GLU 99 1HB GLU 99 4.447 -28.473 11.066 2305 HG2 GLU 99 2HG GLU 99 6.323 -28.426 9.303 2306 HG3 GLU 99 1HG GLU 99 5.207 -27.525 8.216 2307 H ARG 100 H ARG 100 1.629 -30.257 8.683 2308 HA ARG 100 HA ARG 100 0.419 -31.096 11.062 2309 HB2 ARG 100 2HB ARG 100 -0.674 -30.154 8.933 2310 HB3 ARG 100 1HB ARG 100 -0.369 -31.732 8.145 2311 HG2 ARG 100 2HG ARG 100 -1.899 -32.809 9.860 2312 HG3 ARG 100 1HG ARG 100 -2.167 -31.197 10.599 2313 HD2 ARG 100 2HD ARG 100 -4.076 -31.767 9.054 2314 HD3 ARG 100 1HD ARG 100 -3.157 -30.338 8.449 2315 HE ARG 100 HE ARG 100 -2.606 -31.542 6.517 2316 HH11 ARG 100 1HH2 ARG 100 -3.716 -33.940 9.013 2317 HH12 ARG 100 2HH2 ARG 100 -3.767 -35.210 7.881 2318 HH21 ARG 100 1HH1 ARG 100 -2.592 -33.382 5.079 2319 HH22 ARG 100 2HH1 ARG 100 -3.059 -34.951 5.688 2320 H ARG 101 H ARG 101 2.013 -32.855 8.394 2321 HA ARG 101 HA ARG 101 1.235 -35.446 9.402 2322 HB2 ARG 101 2HB ARG 101 3.314 -34.695 7.256 2323 HB3 ARG 101 1HB ARG 101 2.704 -36.354 7.596 2324 HG2 ARG 101 2HG ARG 101 0.396 -35.654 6.950 2325 HG3 ARG 101 1HG ARG 101 0.981 -33.980 6.672 2326 HD2 ARG 101 2HD ARG 101 2.558 -34.908 4.848 2327 HD3 ARG 101 1HD ARG 101 1.732 -36.513 5.056 2328 HE ARG 101 HE ARG 101 0.078 -34.036 4.604 2329 HH11 ARG 101 1HH2 ARG 101 1.442 -37.070 3.074 2330 HH12 ARG 101 2HH2 ARG 101 0.373 -37.054 1.789 2331 HH21 ARG 101 1HH1 ARG 101 -1.406 -34.038 2.863 2332 HH22 ARG 101 2HH1 ARG 101 -1.385 -35.232 1.649 2333 H GLY 102 H GLY 102 3.906 -33.194 9.738 2334 HA2 GLY 102 2HA GLY 102 5.481 -33.111 11.300 2335 HA3 GLY 102 1HA GLY 102 4.890 -34.678 11.968 2336 H HIS 103 H HIS 103 5.742 -34.436 8.535 2337 HA HIS 103 HA HIS 103 8.368 -35.499 8.966 2338 HB2 HIS 103 2HB HIS 103 6.166 -37.290 7.724 2339 HB3 HIS 103 1HB HIS 103 7.927 -37.633 7.708 2340 HD1 HIS 103 1HD HIS 103 4.981 -37.532 10.220 2341 HD2 HIS 103 2HD HIS 103 9.020 -38.736 10.030 2342 HE1 HIS 103 1HE HIS 103 5.458 -38.905 12.277 2343 HE2 HIS 103 2HE HIS 103 7.906 -39.508 12.207 2344 H1 SER 1 H SER 1 -3.149 -18.659 16.646 2345 HA SER 1 HA SER 1 -5.165 -19.538 18.149 2346 HB2 SER 1 2HB SER 1 -6.296 -18.504 15.466 2347 HB3 SER 1 1HB SER 1 -7.124 -19.733 16.494 2348 HG SER 1 1HG SER 1 -6.758 -17.005 16.841 2349 H ALA 2 H ALA 2 -4.844 -19.807 14.532 2350 HA ALA 2 HA ALA 2 -4.244 -22.627 14.976 2351 HB1 ALA 2 1HB ALA 2 -4.405 -22.901 12.531 2352 HB2 ALA 2 2HB ALA 2 -4.527 -21.115 12.319 2353 HB3 ALA 2 3HB ALA 2 -5.848 -22.019 13.139 2354 H ASP 3 H ASP 3 -2.520 -23.435 13.379 2355 HA ASP 3 HA ASP 3 0.009 -22.972 14.093 2356 HB2 ASP 3 2HB ASP 3 0.413 -23.937 11.582 2357 HB3 ASP 3 1HB ASP 3 -0.402 -24.933 12.823 2358 H HIS 4 H HIS 4 -1.224 -21.944 10.964 2359 HA HIS 4 HA HIS 4 0.799 -20.188 10.329 2360 HB2 HIS 4 2HB HIS 4 -0.732 -19.307 8.547 2361 HB3 HIS 4 1HB HIS 4 -0.688 -21.091 8.599 2362 HD1 HIS 4 1HD HIS 4 -2.836 -22.285 9.710 2363 HD2 HIS 4 2HD HIS 4 -3.236 -18.118 9.370 2364 HE1 HIS 4 1HE HIS 4 -5.342 -21.712 9.865 2365 HE2 HIS 4 2HE HIS 4 -5.395 -19.081 9.870 2366 H GLU 5 H GLU 5 -2.023 -19.541 12.397 2367 HA GLU 5 HA GLU 5 -1.994 -16.706 11.909 2368 HB2 GLU 5 2HB GLU 5 -3.212 -18.166 14.311 2369 HB3 GLU 5 1HB GLU 5 -3.586 -16.504 13.749 2370 HG2 GLU 5 2HG GLU 5 -4.215 -19.072 12.150 2371 HG3 GLU 5 1HG GLU 5 -5.362 -18.248 13.262 2372 H ARG 6 H ARG 6 -0.513 -19.045 14.122 2373 HA ARG 6 HA ARG 6 0.336 -17.228 16.084 2374 HB2 ARG 6 2HB ARG 6 0.218 -19.850 16.190 2375 HB3 ARG 6 1HB ARG 6 1.753 -19.839 15.276 2376 HG2 ARG 6 2HG ARG 6 2.454 -20.146 17.456 2377 HG3 ARG 6 1HG ARG 6 2.702 -18.380 17.233 2378 HD2 ARG 6 2HD ARG 6 0.518 -17.964 18.507 2379 HD3 ARG 6 1HD ARG 6 0.333 -19.761 18.720 2380 HE ARG 6 HE ARG 6 2.955 -18.936 19.617 2381 HH11 ARG 6 1HH2 ARG 6 -0.496 -18.938 20.811 2382 HH12 ARG 6 2HH2 ARG 6 -0.096 -18.271 22.303 2383 HH21 ARG 6 1HH1 ARG 6 3.485 -18.311 21.776 2384 HH22 ARG 6 2HH1 ARG 6 2.253 -17.909 22.914 2385 H GLU 7 H GLU 7 1.817 -18.453 13.077 2386 HA GLU 7 HA GLU 7 4.322 -17.207 13.326 2387 HB2 GLU 7 2HB GLU 7 3.722 -19.084 11.681 2388 HB3 GLU 7 1HB GLU 7 2.748 -17.896 10.766 2389 HG2 GLU 7 2HG GLU 7 4.597 -17.633 9.489 2390 HG3 GLU 7 1HG GLU 7 5.213 -16.583 10.806 2391 H ALA 8 H ALA 8 1.198 -16.205 11.889 2392 HA ALA 8 HA ALA 8 2.067 -13.863 10.697 2393 HB1 ALA 8 1HB ALA 8 -0.728 -14.478 11.866 2394 HB2 ALA 8 2HB ALA 8 -0.173 -14.896 10.205 2395 HB3 ALA 8 3HB ALA 8 -0.352 -13.173 10.691 2396 H GLN 9 H GLN 9 0.756 -14.417 14.001 2397 HA GLN 9 HA GLN 9 0.895 -11.655 14.670 2398 HB2 GLN 9 2HB GLN 9 0.635 -14.199 16.347 2399 HB3 GLN 9 1HB GLN 9 0.743 -12.579 17.113 2400 HG2 GLN 9 2HG GLN 9 -1.418 -13.280 15.001 2401 HG3 GLN 9 1HG GLN 9 -1.643 -13.446 16.780 2402 HE21 GLN 9 1HE2 GLN 9 -1.492 -11.084 14.116 2403 HE22 GLN 9 2HE2 GLN 9 -1.476 -9.649 15.054 2404 H LYS 10 H LYS 10 3.293 -14.257 14.795 2405 HA LYS 10 HA LYS 10 5.088 -12.947 16.517 2406 HB2 LYS 10 2HB LYS 10 5.221 -15.415 15.680 2407 HB3 LYS 10 1HB LYS 10 5.837 -14.752 14.137 2408 HG2 LYS 10 2HG LYS 10 7.634 -13.549 15.785 2409 HG3 LYS 10 1HG LYS 10 7.180 -14.889 16.882 2410 HD2 LYS 10 2HD LYS 10 7.849 -16.539 15.082 2411 HD3 LYS 10 1HD LYS 10 8.155 -15.162 13.966 2412 HE2 LYS 10 2HE LYS 10 9.920 -14.294 15.640 2413 HE3 LYS 10 1HE LYS 10 9.743 -15.851 16.540 2414 HZ1 LYS 10 3HZ LYS 10 10.567 -15.559 13.679 2415 HZ2 LYS 10 1HZ LYS 10 10.446 -17.024 14.552 2416 HZ3 LYS 10 2HZ LYS 10 11.586 -15.853 14.988 2417 H ALA 11 H ALA 11 4.386 -12.651 13.052 2418 HA ALA 11 HA ALA 11 6.673 -11.211 12.320 2419 HB1 ALA 11 1HB ALA 11 3.877 -11.055 11.037 2420 HB2 ALA 11 2HB ALA 11 5.131 -12.284 10.638 2421 HB3 ALA 11 3HB ALA 11 5.429 -10.546 10.281 2422 H GLU 12 H GLU 12 3.481 -10.122 13.632 2423 HA GLU 12 HA GLU 12 3.959 -7.389 13.169 2424 HB2 GLU 12 2HB GLU 12 2.220 -8.636 15.385 2425 HB3 GLU 12 1HB GLU 12 2.370 -6.881 15.042 2426 HG2 GLU 12 2HG GLU 12 1.566 -7.455 12.602 2427 HG3 GLU 12 1HG GLU 12 1.010 -9.016 13.319 2428 H GLU 13 H GLU 13 4.924 -9.548 15.862 2429 HA GLU 13 HA GLU 13 5.666 -7.383 17.510 2430 HB2 GLU 13 2HB GLU 13 6.655 -10.267 17.777 2431 HB3 GLU 13 1HB GLU 13 6.662 -8.970 19.019 2432 HG2 GLU 13 2HG GLU 13 4.021 -8.874 18.488 2433 HG3 GLU 13 1HG GLU 13 4.284 -10.536 17.858 2434 H GLU 14 H GLU 14 7.275 -9.006 14.883 2435 HA GLU 14 HA GLU 14 9.916 -8.176 15.518 2436 HB2 GLU 14 2HB GLU 14 9.214 -10.055 13.883 2437 HB3 GLU 14 1HB GLU 14 8.743 -8.766 12.737 2438 HG2 GLU 14 2HG GLU 14 10.907 -9.526 12.059 2439 HG3 GLU 14 1HG GLU 14 11.194 -7.925 12.824 2440 H LEU 15 H LEU 15 7.125 -6.728 13.806 2441 HA LEU 15 HA LEU 15 8.561 -4.661 12.581 2442 HB2 LEU 15 2HB LEU 15 6.229 -5.337 11.932 2443 HB3 LEU 15 1HB LEU 15 5.608 -4.657 13.464 2444 HG LEU 15 HG LEU 15 6.171 -2.386 12.779 2445 HD11 LEU 15 1HD1 LEU 15 8.318 -2.612 11.636 2446 HD12 LEU 15 2HD1 LEU 15 7.157 -1.883 10.485 2447 HD13 LEU 15 3HD1 LEU 15 7.590 -3.628 10.336 2448 HD21 LEU 15 3HD2 LEU 15 4.035 -3.350 11.924 2449 HD22 LEU 15 1HD2 LEU 15 4.867 -3.921 10.432 2450 HD23 LEU 15 2HD2 LEU 15 4.713 -2.158 10.755 2451 H GLN 16 H GLN 16 6.970 -4.931 15.749 2452 HA GLN 16 HA GLN 16 7.257 -2.295 16.593 2453 HB2 GLN 16 2HB GLN 16 7.447 -4.818 18.331 2454 HB3 GLN 16 1HB GLN 16 7.143 -3.150 18.926 2455 HG2 GLN 16 2HG GLN 16 4.976 -3.073 17.638 2456 HG3 GLN 16 1HG GLN 16 5.218 -4.782 17.127 2457 HE21 GLN 16 1HE2 GLN 16 6.093 -6.142 19.284 2458 HE22 GLN 16 2HE2 GLN 16 5.017 -6.038 20.623 2459 H LYS 17 H LYS 17 9.657 -4.867 16.359 2460 HA LYS 17 HA LYS 17 11.527 -3.771 18.204 2461 HB2 LYS 17 2HB LYS 17 11.448 -6.184 17.420 2462 HB3 LYS 17 1HB LYS 17 11.993 -5.639 15.803 2463 HG2 LYS 17 2HG LYS 17 14.121 -4.724 16.881 2464 HG3 LYS 17 1HG LYS 17 13.610 -5.486 18.423 2465 HD2 LYS 17 2HD LYS 17 14.009 -6.933 15.721 2466 HD3 LYS 17 1HD LYS 17 15.243 -6.862 17.027 2467 HE2 LYS 17 2HE LYS 17 13.870 -8.205 18.537 2468 HE3 LYS 17 1HE LYS 17 12.425 -8.096 17.460 2469 HZ1 LYS 17 3HZ LYS 17 14.973 -9.467 16.722 2470 HZ2 LYS 17 1HZ LYS 17 13.511 -9.386 15.823 2471 HZ3 LYS 17 2HZ LYS 17 13.562 -10.201 17.329 2472 H VAL 18 H VAL 18 10.959 -3.569 14.671 2473 HA VAL 18 HA VAL 18 13.313 -2.168 14.093 2474 HB VAL 18 HB VAL 18 10.718 -2.144 12.477 2475 HG11 VAL 18 1HG1 VAL 18 12.308 -1.823 10.542 2476 HG12 VAL 18 2HG1 VAL 18 13.697 -1.751 11.687 2477 HG13 VAL 18 3HG1 VAL 18 12.435 -0.468 11.710 2478 HG21 VAL 18 3HG2 VAL 18 11.802 -4.122 11.277 2479 HG22 VAL 18 1HG2 VAL 18 11.316 -4.499 12.953 2480 HG23 VAL 18 2HG2 VAL 18 13.052 -4.184 12.571 2481 H LEU 19 H LEU 19 10.101 -1.132 15.238 2482 HA LEU 19 HA LEU 19 10.343 1.577 14.627 2483 HB2 LEU 19 2HB LEU 19 9.041 0.478 17.191 2484 HB3 LEU 19 1HB LEU 19 8.711 2.051 16.392 2485 HG LEU 19 HG LEU 19 8.042 -0.752 15.315 2486 HD11 LEU 19 1HD1 LEU 19 5.673 -0.108 15.711 2487 HD12 LEU 19 2HD1 LEU 19 6.193 1.490 16.358 2488 HD13 LEU 19 3HD1 LEU 19 6.619 -0.023 17.246 2489 HD21 LEU 19 3HD2 LEU 19 8.513 0.773 13.391 2490 HD22 LEU 19 1HD2 LEU 19 7.351 1.971 14.072 2491 HD23 LEU 19 2HD2 LEU 19 6.769 0.369 13.508 2492 H GLU 20 H GLU 20 11.448 -0.297 17.457 2493 HA GLU 20 HA GLU 20 12.337 1.976 18.938 2494 HB2 GLU 20 2HB GLU 20 12.823 -1.047 19.233 2495 HB3 GLU 20 1HB GLU 20 13.366 0.154 20.435 2496 HG2 GLU 20 2HG GLU 20 10.385 -0.193 19.659 2497 HG3 GLU 20 1HG GLU 20 11.210 -1.140 20.946 2498 H GLU 21 H GLU 21 13.813 -0.438 16.795 2499 HA GLU 21 HA GLU 21 16.527 0.274 17.115 2500 HB2 GLU 21 2HB GLU 21 14.795 -0.717 14.746 2501 HB3 GLU 21 1HB GLU 21 16.541 -0.461 14.535 2502 HG2 GLU 21 2HG GLU 21 15.445 -2.365 16.707 2503 HG3 GLU 21 1HG GLU 21 15.633 -2.880 14.991 2504 H ALA 22 H ALA 22 13.971 1.269 14.806 2505 HA ALA 22 HA ALA 22 15.678 2.915 13.325 2506 HB1 ALA 22 1HB ALA 22 12.606 2.806 13.304 2507 HB2 ALA 22 2HB ALA 22 13.696 1.822 12.266 2508 HB3 ALA 22 3HB ALA 22 13.641 3.608 12.065 2509 H SER 23 H SER 23 13.617 3.574 16.172 2510 HA SER 23 HA SER 23 13.267 6.309 15.684 2511 HB2 SER 23 2HB SER 23 12.988 6.411 18.252 2512 HB3 SER 23 1HB SER 23 11.920 5.236 17.401 2513 HG SER 23 1HG SER 23 13.043 4.442 19.336 2514 H LYS 24 H LYS 24 15.667 4.445 17.434 2515 HA LYS 24 HA LYS 24 17.348 6.491 18.280 2516 HB2 LYS 24 2HB LYS 24 17.238 4.110 19.100 2517 HB3 LYS 24 1HB LYS 24 17.990 3.541 17.583 2518 HG2 LYS 24 2HG LYS 24 19.367 5.510 19.525 2519 HG3 LYS 24 1HG LYS 24 19.398 3.723 19.720 2520 HD2 LYS 24 2HD LYS 24 20.469 3.475 17.449 2521 HD3 LYS 24 1HD LYS 24 20.517 5.260 17.291 2522 HE2 LYS 24 2HE LYS 24 22.713 4.484 17.997 2523 HE3 LYS 24 1HE LYS 24 21.947 5.437 19.333 2524 HZ1 LYS 24 3HZ LYS 24 21.977 2.464 19.133 2525 HZ2 LYS 24 1HZ LYS 24 21.458 3.397 20.480 2526 HZ3 LYS 24 2HZ LYS 24 23.097 3.387 20.022 2527 H LYS 25 H LYS 25 17.367 4.440 15.343 2528 HA LYS 25 HA LYS 25 19.722 5.517 14.273 2529 HB2 LYS 25 2HB LYS 25 17.379 4.158 12.848 2530 HB3 LYS 25 1HB LYS 25 18.926 4.581 12.046 2531 HG2 LYS 25 2HG LYS 25 20.217 3.084 13.444 2532 HG3 LYS 25 1HG LYS 25 18.843 2.816 14.561 2533 HD2 LYS 25 2HD LYS 25 17.562 1.670 12.748 2534 HD3 LYS 25 1HD LYS 25 18.972 1.847 11.636 2535 HE2 LYS 25 2HE LYS 25 20.385 0.438 13.141 2536 HE3 LYS 25 1HE LYS 25 19.078 0.408 14.383 2537 HZ1 LYS 25 3HZ LYS 25 18.371 -1.376 13.512 2538 HZ2 LYS 25 1HZ LYS 25 19.476 -1.331 12.235 2539 HZ3 LYS 25 2HZ LYS 25 17.962 -0.590 12.015 2540 H ALA 26 H ALA 26 16.259 6.434 13.640 2541 HA ALA 26 HA ALA 26 16.795 8.242 11.620 2542 HB1 ALA 26 1HB ALA 26 14.562 9.247 12.167 2543 HB2 ALA 26 2HB ALA 26 14.551 8.363 13.742 2544 HB3 ALA 26 3HB ALA 26 14.478 7.451 12.191 2545 H VAL 27 H VAL 27 16.570 8.762 15.147 2546 HA VAL 27 HA VAL 27 16.915 11.538 14.840 2547 HB VAL 27 HB VAL 27 15.745 9.953 16.619 2548 HG11 VAL 27 1HG1 VAL 27 18.379 10.587 18.100 2549 HG12 VAL 27 2HG1 VAL 27 17.841 8.957 17.535 2550 HG13 VAL 27 3HG1 VAL 27 16.879 9.843 18.762 2551 HG21 VAL 27 3HG2 VAL 27 16.890 12.738 17.192 2552 HG22 VAL 27 1HG2 VAL 27 15.500 11.924 18.022 2553 HG23 VAL 27 2HG2 VAL 27 15.396 12.338 16.284 2554 H GLU 28 H GLU 28 19.152 8.842 15.274 2555 HA GLU 28 HA GLU 28 21.333 10.542 16.031 2556 HB2 GLU 28 2HB GLU 28 21.085 8.144 16.787 2557 HB3 GLU 28 1HB GLU 28 21.457 7.609 15.117 2558 HG2 GLU 28 2HG GLU 28 23.744 8.562 15.281 2559 HG3 GLU 28 1HG GLU 28 23.303 9.424 16.799 2560 H ALA 29 H ALA 29 20.005 9.083 13.096 2561 HA ALA 29 HA ALA 29 22.150 9.522 11.393 2562 HB1 ALA 29 1HB ALA 29 20.461 9.127 9.611 2563 HB2 ALA 29 2HB ALA 29 19.124 9.391 10.780 2564 HB3 ALA 29 3HB ALA 29 20.225 7.970 10.927 2565 H GLU 30 H GLU 30 19.283 11.455 12.226 2566 HA GLU 30 HA GLU 30 19.755 13.524 10.448 2567 HB2 GLU 30 2HB GLU 30 17.599 12.857 11.681 2568 HB3 GLU 30 1HB GLU 30 18.287 13.631 13.142 2569 HG2 GLU 30 2HG GLU 30 16.945 15.334 12.244 2570 HG3 GLU 30 1HG GLU 30 18.560 15.734 11.567 2571 H ARG 31 H ARG 31 21.272 12.850 13.575 2572 HA ARG 31 HA ARG 31 22.147 15.599 13.931 2573 HB2 ARG 31 2HB ARG 31 22.694 13.045 15.458 2574 HB3 ARG 31 1HB ARG 31 23.917 14.352 15.514 2575 HG2 ARG 31 2HG ARG 31 22.593 14.705 17.404 2576 HG3 ARG 31 1HG ARG 31 22.197 16.002 16.227 2577 HD2 ARG 31 2HD ARG 31 20.036 14.702 15.644 2578 HD3 ARG 31 1HD ARG 31 20.516 13.504 16.924 2579 HE ARG 31 HE ARG 31 20.247 16.472 17.516 2580 HH11 ARG 31 1HH2 ARG 31 18.798 13.204 17.910 2581 HH12 ARG 31 2HH2 ARG 31 17.945 13.561 19.334 2582 HH21 ARG 31 1HH1 ARG 31 19.602 16.763 19.793 2583 HH22 ARG 31 2HH1 ARG 31 18.682 15.629 20.618 2584 H GLY 32 H GLY 32 23.528 16.468 12.524 2585 HA2 GLY 32 2HA GLY 32 25.834 16.448 11.867 2586 HA3 GLY 32 1HA GLY 32 25.617 14.729 11.347 2587 H ALA 33 H ALA 33 22.730 15.534 10.569 2588 HA ALA 33 HA ALA 33 23.436 15.992 7.870 2589 HB1 ALA 33 1HB ALA 33 20.648 15.816 9.188 2590 HB2 ALA 33 2HB ALA 33 21.553 14.434 8.484 2591 HB3 ALA 33 3HB ALA 33 20.966 15.767 7.424 2592 HA PRO 34 HA PRO 34 22.414 20.378 8.071 2593 HB2 PRO 34 2HB PRO 34 22.372 21.046 5.375 2594 HB3 PRO 34 1HB PRO 34 23.892 20.631 6.258 2595 HG2 PRO 34 2HG PRO 34 22.181 18.808 4.491 2596 HG3 PRO 34 1HG PRO 34 23.981 19.020 4.467 2597 HD2 PRO 34 2HD PRO 34 22.681 16.948 5.830 2598 HD3 PRO 34 1HD PRO 34 24.244 17.674 6.433 2599 H GLY 35 H GLY 35 20.347 21.346 8.517 2600 HA2 GLY 35 2HA GLY 35 18.303 22.033 8.006 2601 HA3 GLY 35 1HA GLY 35 18.283 21.030 6.510 2602 H ALA 36 H ALA 36 19.300 19.748 9.503 2603 HA ALA 36 HA ALA 36 17.713 17.542 9.636 2604 HB1 ALA 36 1HB ALA 36 19.804 17.783 10.929 2605 HB2 ALA 36 2HB ALA 36 18.494 17.643 12.154 2606 HB3 ALA 36 3HB ALA 36 19.171 19.254 11.774 2607 H ALA 37 H ALA 37 15.723 17.041 10.501 2608 HA ALA 37 HA ALA 37 14.304 19.142 12.059 2609 HB1 ALA 37 1HB ALA 37 12.211 18.515 10.795 2610 HB2 ALA 37 2HB ALA 37 13.189 17.391 9.767 2611 HB3 ALA 37 3HB ALA 37 13.471 19.163 9.675 2612 H LEU 38 H LEU 38 14.923 15.716 11.283 2613 HA LEU 38 HA LEU 38 12.928 14.765 13.141 2614 HB2 LEU 38 2HB LEU 38 13.876 13.895 10.746 2615 HB3 LEU 38 1HB LEU 38 15.029 13.023 11.769 2616 HG LEU 38 HG LEU 38 11.940 12.848 11.861 2617 HD11 LEU 38 1HD1 LEU 38 14.070 10.930 10.716 2618 HD12 LEU 38 2HD1 LEU 38 12.902 11.933 9.782 2619 HD13 LEU 38 3HD1 LEU 38 12.302 10.596 10.819 2620 HD21 LEU 38 3HD2 LEU 38 14.023 11.182 13.420 2621 HD22 LEU 38 1HD2 LEU 38 12.259 10.810 13.305 2622 HD23 LEU 38 2HD2 LEU 38 12.817 12.316 14.123 2623 H ILE 39 H ILE 39 14.529 16.357 14.578 2624 HA ILE 39 HA ILE 39 16.635 14.709 15.795 2625 HB ILE 39 HB ILE 39 17.392 16.824 16.868 2626 HG12 ILE 39 2HG1 ILE 39 15.263 18.185 15.067 2627 HG13 ILE 39 1HG1 ILE 39 15.141 18.028 16.849 2628 HG21 ILE 39 1HG2 ILE 39 18.271 15.921 14.664 2629 HG22 ILE 39 2HG2 ILE 39 18.436 17.704 14.830 2630 HG23 ILE 39 3HG2 ILE 39 17.129 17.012 13.801 2631 HD11 ILE 39 3HD ILE 39 17.302 19.608 15.298 2632 HD12 ILE 39 1HD ILE 39 15.967 20.271 16.308 2633 HD13 ILE 39 2HD ILE 39 17.305 19.347 17.082 2634 H SER 40 H SER 40 16.536 15.900 18.341 2635 HA SER 40 HA SER 40 15.550 16.017 20.213 2636 HB2 SER 40 2HB SER 40 13.530 17.062 18.918 2637 HB3 SER 40 1HB SER 40 12.710 15.506 19.242 2638 HG SER 40 1HG SER 40 12.521 17.301 20.789 2639 H TYR 41 H TYR 41 13.071 13.979 20.676 2640 HA TYR 41 HA TYR 41 14.370 11.487 20.207 2641 HB2 TYR 41 2HB TYR 41 14.487 12.600 23.077 2642 HB3 TYR 41 1HB TYR 41 14.330 10.827 22.776 2643 HD1 TYR 41 2HD TYR 41 16.047 9.610 21.454 2644 HD2 TYR 41 1HD TYR 41 16.598 13.696 22.675 2645 HE1 TYR 41 2HE TYR 41 18.415 9.479 20.803 2646 HE2 TYR 41 1HE TYR 41 18.953 13.588 21.936 2647 HH TYR 41 HH TYR 41 20.540 10.671 21.089 2648 HA PRO 42 HA PRO 42 10.455 10.357 22.244 2649 HB2 PRO 42 2HB PRO 42 8.538 12.146 23.286 2650 HB3 PRO 42 1HB PRO 42 9.921 11.487 24.245 2651 HG2 PRO 42 2HG PRO 42 9.767 14.152 22.744 2652 HG3 PRO 42 1HG PRO 42 10.321 13.872 24.446 2653 HD2 PRO 42 2HD PRO 42 12.101 14.110 22.361 2654 HD3 PRO 42 1HD PRO 42 12.391 12.885 23.683 2655 H ASP 43 H ASP 43 10.455 13.167 20.276 2656 HA ASP 43 HA ASP 43 8.035 12.805 18.916 2657 HB2 ASP 43 2HB ASP 43 10.537 14.297 17.879 2658 HB3 ASP 43 1HB ASP 43 8.804 14.692 17.611 2659 H ALA 44 H ALA 44 11.370 11.649 18.606 2660 HA ALA 44 HA ALA 44 11.267 11.049 15.840 2661 HB1 ALA 44 1HB ALA 44 13.201 9.991 18.000 2662 HB2 ALA 44 2HB ALA 44 13.416 11.491 17.020 2663 HB3 ALA 44 3HB ALA 44 13.436 9.881 16.215 2664 H ILE 45 H ILE 45 10.652 9.169 18.810 2665 HA ILE 45 HA ILE 45 10.408 6.693 17.397 2666 HB ILE 45 HB ILE 45 10.961 6.440 19.663 2667 HG12 ILE 45 2HG1 ILE 45 7.946 5.803 19.479 2668 HG13 ILE 45 1HG1 ILE 45 9.278 4.807 18.814 2669 HG21 ILE 45 1HG2 ILE 45 10.384 8.673 20.505 2670 HG22 ILE 45 2HG2 ILE 45 9.637 7.443 21.552 2671 HG23 ILE 45 3HG2 ILE 45 8.619 8.323 20.359 2672 HD11 ILE 45 3HD ILE 45 8.816 5.452 21.810 2673 HD12 ILE 45 1HD ILE 45 8.493 3.891 20.970 2674 HD13 ILE 45 2HD ILE 45 10.183 4.480 21.138 2675 H TRP 46 H TRP 46 8.244 9.407 18.055 2676 HA TRP 46 HA TRP 46 5.892 7.881 17.429 2677 HB2 TRP 46 2HB TRP 46 6.530 10.529 18.500 2678 HB3 TRP 46 1HB TRP 46 5.443 10.752 17.113 2679 HD1 TRP 46 HD TRP 46 3.093 11.102 18.056 2680 HE1 TRP 46 1HE TRP 46 1.749 10.306 20.079 2681 HE3 TRP 46 3HE TRP 46 6.478 7.793 19.953 2682 HZ2 TRP 46 2HZ TRP 46 2.012 8.316 22.140 2683 HZ3 TRP 46 3HZ TRP 46 5.894 6.477 21.961 2684 HH2 TRP 46 HH TRP 46 3.690 6.751 23.052 2685 H TRP 47 H TRP 47 8.378 9.524 15.644 2686 HA TRP 47 HA TRP 47 6.897 9.882 13.239 2687 HB2 TRP 47 2HB TRP 47 9.023 11.119 13.708 2688 HB3 TRP 47 1HB TRP 47 9.931 9.569 13.659 2689 HD1 TRP 47 HD TRP 47 7.875 11.888 11.228 2690 HE1 TRP 47 1HE TRP 47 8.458 11.169 8.839 2691 HE3 TRP 47 3HE TRP 47 11.009 8.006 12.260 2692 HZ2 TRP 47 2HZ TRP 47 10.412 9.551 7.538 2693 HZ3 TRP 47 3HZ TRP 47 12.201 6.885 10.401 2694 HH2 TRP 47 HH TRP 47 11.906 7.654 8.073 2695 H SER 48 H SER 48 9.212 7.300 14.487 2696 HA SER 48 HA SER 48 8.890 5.809 12.159 2697 HB2 SER 48 2HB SER 48 9.896 3.869 13.555 2698 HB3 SER 48 1HB SER 48 10.886 5.337 13.256 2699 HG SER 48 1HG SER 48 10.755 4.426 15.479 2700 H VAL 49 H VAL 49 6.750 6.058 14.867 2701 HA VAL 49 HA VAL 49 5.441 3.588 14.589 2702 HB VAL 49 HB VAL 49 4.518 6.308 15.605 2703 HG11 VAL 49 1HG1 VAL 49 2.930 3.644 15.624 2704 HG12 VAL 49 2HG1 VAL 49 2.437 5.174 14.824 2705 HG13 VAL 49 3HG1 VAL 49 2.517 5.091 16.611 2706 HG21 VAL 49 3HG2 VAL 49 6.287 4.918 16.888 2707 HG22 VAL 49 1HG2 VAL 49 5.069 3.615 17.042 2708 HG23 VAL 49 2HG2 VAL 49 4.778 5.217 17.819 2709 H GLU 50 H GLU 50 4.984 6.706 12.728 2710 HA GLU 50 HA GLU 50 2.684 5.450 11.460 2711 HB2 GLU 50 2HB GLU 50 2.251 7.391 10.204 2712 HB3 GLU 50 1HB GLU 50 2.534 7.850 11.906 2713 HG2 GLU 50 2HG GLU 50 3.641 9.563 10.789 2714 HG3 GLU 50 1HG GLU 50 5.016 8.440 11.067 2715 H THR 51 H THR 51 6.130 6.036 10.877 2716 HA THR 51 HA THR 51 6.010 5.185 8.196 2717 HB THR 51 HB THR 51 8.501 5.338 9.936 2718 HG1 THR 51 1HG THR 51 6.789 7.435 9.094 2719 HG21 THR 51 3HG2 THR 51 8.832 4.605 7.587 2720 HG22 THR 51 1HG2 THR 51 9.483 6.265 7.806 2721 HG23 THR 51 2HG2 THR 51 7.902 6.030 6.970 2722 H ALA 52 H ALA 52 4.750 3.124 9.022 2723 HA ALA 52 HA ALA 52 6.623 0.886 8.930 2724 HB1 ALA 52 1HB ALA 52 6.449 1.345 11.407 2725 HB2 ALA 52 2HB ALA 52 5.600 -0.189 10.999 2726 HB3 ALA 52 3HB ALA 52 4.660 1.328 11.304 2727 H THR 53 H THR 53 3.193 1.978 9.568 2728 HA THR 53 HA THR 53 2.224 -0.369 8.197 2729 HB THR 53 HB THR 53 0.020 0.580 9.110 2730 HG1 THR 53 1HG THR 53 0.623 2.705 9.289 2731 HG21 THR 53 3HG2 THR 53 1.343 -1.141 10.367 2732 HG22 THR 53 1HG2 THR 53 0.587 0.043 11.493 2733 HG23 THR 53 2HG2 THR 53 2.345 0.153 11.129 2734 H THR 54 H THR 54 3.526 1.220 6.352 2735 HA THR 54 HA THR 54 3.343 2.570 4.582 2736 HB THR 54 HB THR 54 1.510 1.737 2.965 2737 HG1 THR 54 1HG THR 54 0.173 0.960 4.671 2738 HG21 THR 54 3HG2 THR 54 3.485 -0.246 4.320 2739 HG22 THR 54 1HG2 THR 54 3.898 0.940 3.019 2740 HG23 THR 54 2HG2 THR 54 2.762 -0.408 2.677 2741 H VAL 55 H VAL 55 2.887 4.509 6.044 2742 HA VAL 55 HA VAL 55 0.413 5.741 5.071 2743 HB VAL 55 HB VAL 55 1.912 6.577 7.630 2744 HG11 VAL 55 1HG1 VAL 55 0.438 8.256 6.353 2745 HG12 VAL 55 2HG1 VAL 55 -0.188 7.865 7.992 2746 HG13 VAL 55 3HG1 VAL 55 -0.941 7.121 6.521 2747 HG21 VAL 55 3HG2 VAL 55 -0.461 4.634 7.331 2748 HG22 VAL 55 1HG2 VAL 55 0.031 5.446 8.873 2749 HG23 VAL 55 2HG2 VAL 55 1.156 4.304 8.065 2750 H GLY 56 H GLY 56 2.921 7.684 6.627 2751 HA2 GLY 56 2HA GLY 56 4.750 8.604 5.687 2752 HA3 GLY 56 1HA GLY 56 4.212 8.124 4.018 2753 H TYR 57 H TYR 57 2.680 9.672 6.873 2754 HA TYR 57 HA TYR 57 0.947 11.062 5.093 2755 HB2 TYR 57 2HB TYR 57 0.810 10.213 7.750 2756 HB3 TYR 57 1HB TYR 57 1.015 11.976 8.003 2757 HD1 TYR 57 1HD TYR 57 -0.689 12.685 5.287 2758 HD2 TYR 57 2HD TYR 57 -1.331 10.160 8.721 2759 HE1 TYR 57 1HE TYR 57 -3.089 12.860 4.964 2760 HE2 TYR 57 2HE TYR 57 -3.771 10.337 8.371 2761 HH TYR 57 HH TYR 57 -5.122 11.947 5.468 2762 H GLY 58 H GLY 58 4.064 11.837 6.158 2763 HA2 GLY 58 2HA GLY 58 5.207 13.689 5.436 2764 HA3 GLY 58 1HA GLY 58 3.669 14.560 5.177 2765 H ASP 59 H ASP 59 4.823 12.883 8.088 2766 HA ASP 59 HA ASP 59 4.118 15.019 9.810 2767 HB2 ASP 59 2HB ASP 59 4.064 12.609 10.479 2768 HB3 ASP 59 1HB ASP 59 5.832 12.475 10.238 2769 H ARG 60 H ARG 60 7.326 13.597 8.789 2770 HA ARG 60 HA ARG 60 8.507 16.203 8.928 2771 HB2 ARG 60 2HB ARG 60 9.727 13.849 10.519 2772 HB3 ARG 60 1HB ARG 60 10.512 15.442 10.228 2773 HG2 ARG 60 2HG ARG 60 8.455 16.511 11.345 2774 HG3 ARG 60 1HG ARG 60 7.980 14.853 11.860 2775 HD2 ARG 60 2HD ARG 60 10.031 14.674 13.278 2776 HD3 ARG 60 1HD ARG 60 10.592 16.308 12.685 2777 HE ARG 60 HE ARG 60 7.821 16.256 13.704 2778 HH11 ARG 60 1HH2 ARG 60 11.273 16.939 14.638 2779 HH12 ARG 60 2HH2 ARG 60 10.838 17.710 16.101 2780 HH21 ARG 60 1HH1 ARG 60 7.284 17.312 15.724 2781 HH22 ARG 60 2HH1 ARG 60 8.496 17.787 16.821 2782 H TYR 61 H TYR 61 10.932 15.859 8.000 2783 HA TYR 61 HA TYR 61 10.719 13.868 5.876 2784 HB2 TYR 61 2HB TYR 61 11.459 16.873 5.610 2785 HB3 TYR 61 1HB TYR 61 11.664 15.636 4.310 2786 HD1 TYR 61 1HD TYR 61 9.690 14.485 3.361 2787 HD2 TYR 61 2HD TYR 61 9.220 17.742 6.138 2788 HE1 TYR 61 1HE TYR 61 7.347 14.670 2.748 2789 HE2 TYR 61 2HE TYR 61 6.839 17.920 5.518 2790 HH TYR 61 HH TYR 61 5.381 15.597 3.147 2791 HA PRO 62 HA PRO 62 14.898 13.997 7.725 2792 HB2 PRO 62 2HB PRO 62 15.903 11.621 6.670 2793 HB3 PRO 62 1HB PRO 62 14.742 11.655 8.038 2794 HG2 PRO 62 2HG PRO 62 14.159 11.214 5.062 2795 HG3 PRO 62 1HG PRO 62 13.569 10.242 6.473 2796 HD2 PRO 62 2HD PRO 62 12.033 12.250 5.314 2797 HD3 PRO 62 1HD PRO 62 11.997 11.957 7.112 2798 H VAL 63 H VAL 63 17.223 14.024 6.708 2799 HA VAL 63 HA VAL 63 16.946 15.609 4.323 2800 HB VAL 63 HB VAL 63 19.460 15.196 5.968 2801 HG11 VAL 63 1HG1 VAL 63 18.558 17.488 4.070 2802 HG12 VAL 63 2HG1 VAL 63 19.720 16.223 3.560 2803 HG13 VAL 63 3HG1 VAL 63 20.152 17.329 4.893 2804 HG21 VAL 63 3HG2 VAL 63 17.613 16.039 7.419 2805 HG22 VAL 63 1HG2 VAL 63 17.188 17.282 6.196 2806 HG23 VAL 63 2HG2 VAL 63 18.766 17.355 7.059 2807 H THR 64 H THR 64 19.997 13.864 4.693 2808 HA THR 64 HA THR 64 19.604 12.177 2.461 2809 HB THR 64 HB THR 64 21.101 14.842 2.112 2810 HG1 THR 64 1HG THR 64 18.731 14.245 1.595 2811 HG21 THR 64 3HG2 THR 64 21.238 12.384 0.226 2812 HG22 THR 64 1HG2 THR 64 22.605 13.086 1.156 2813 HG23 THR 64 2HG2 THR 64 21.833 14.035 -0.155 2814 H GLU 65 H GLU 65 21.727 14.029 4.571 2815 HA GLU 65 HA GLU 65 23.950 12.288 4.507 2816 HB2 GLU 65 2HB GLU 65 23.869 14.815 4.903 2817 HB3 GLU 65 1HB GLU 65 22.934 14.505 6.400 2818 HG2 GLU 65 2HG GLU 65 25.252 15.117 6.940 2819 HG3 GLU 65 1HG GLU 65 24.956 13.412 7.427 2820 H GLU 66 H GLU 66 20.814 11.987 5.930 2821 HA GLU 66 HA GLU 66 21.696 10.779 8.388 2822 HB2 GLU 66 2HB GLU 66 19.055 10.176 8.302 2823 HB3 GLU 66 1HB GLU 66 19.691 11.738 8.903 2824 HG2 GLU 66 2HG GLU 66 17.803 12.176 7.536 2825 HG3 GLU 66 1HG GLU 66 19.241 12.827 6.694 2826 H GLY 67 H GLY 67 20.625 10.055 5.159 2827 HA2 GLY 67 2HA GLY 67 21.575 8.319 3.909 2828 HA3 GLY 67 1HA GLY 67 21.633 7.298 5.429 2829 H ARG 68 H ARG 68 19.429 8.953 3.064 2830 HA ARG 68 HA ARG 68 17.074 8.670 4.349 2831 HB2 ARG 68 2HB ARG 68 17.207 9.946 2.268 2832 HB3 ARG 68 1HB ARG 68 17.507 8.448 1.317 2833 HG2 ARG 68 2HG ARG 68 15.224 7.613 1.826 2834 HG3 ARG 68 1HG ARG 68 14.934 8.983 2.944 2835 HD2 ARG 68 2HD ARG 68 15.297 9.172 -0.129 2836 HD3 ARG 68 1HD ARG 68 13.721 9.235 0.747 2837 HE ARG 68 HE ARG 68 15.675 11.381 0.448 2838 HH11 ARG 68 1HH2 ARG 68 12.435 10.666 1.594 2839 HH12 ARG 68 2HH2 ARG 68 12.365 11.893 2.715 2840 HH21 ARG 68 1HH1 ARG 68 15.805 12.966 2.354 2841 HH22 ARG 68 2HH1 ARG 68 14.422 13.318 3.189 2842 H LYS 69 H LYS 69 18.994 6.220 3.099 2843 HA LYS 69 HA LYS 69 17.298 4.065 2.858 2844 HB2 LYS 69 2HB LYS 69 20.103 4.221 4.122 2845 HB3 LYS 69 1HB LYS 69 19.313 2.700 3.586 2846 HG2 LYS 69 2HG LYS 69 20.000 5.047 1.709 2847 HG3 LYS 69 1HG LYS 69 21.021 3.592 1.953 2848 HD2 LYS 69 2HD LYS 69 19.439 2.120 0.943 2849 HD3 LYS 69 1HD LYS 69 18.098 3.280 1.158 2850 HE2 LYS 69 2HE LYS 69 19.127 4.826 -0.552 2851 HE3 LYS 69 1HE LYS 69 20.358 3.546 -0.917 2852 HZ1 LYS 69 3HZ LYS 69 18.386 3.534 -2.376 2853 HZ2 LYS 69 1HZ LYS 69 17.397 3.103 -1.001 2854 HZ3 LYS 69 2HZ LYS 69 18.577 2.057 -1.511 2855 H VAL 70 H VAL 70 18.053 5.893 5.813 2856 HA VAL 70 HA VAL 70 17.376 3.842 7.624 2857 HB VAL 70 HB VAL 70 17.316 6.886 7.875 2858 HG11 VAL 70 1HG1 VAL 70 17.218 6.427 10.381 2859 HG12 VAL 70 2HG1 VAL 70 16.834 4.701 10.030 2860 HG13 VAL 70 3HG1 VAL 70 15.689 6.006 9.540 2861 HG21 VAL 70 3HG2 VAL 70 19.578 5.778 7.559 2862 HG22 VAL 70 1HG2 VAL 70 19.231 4.690 8.950 2863 HG23 VAL 70 2HG2 VAL 70 19.392 6.468 9.201 2864 H ALA 71 H ALA 71 15.447 6.382 5.945 2865 HA ALA 71 HA ALA 71 13.009 5.707 7.223 2866 HB1 ALA 71 1HB ALA 71 13.479 6.998 4.450 2867 HB2 ALA 71 2HB ALA 71 13.306 7.894 6.001 2868 HB3 ALA 71 3HB ALA 71 11.913 6.964 5.343 2869 H GLU 72 H GLU 72 14.599 4.749 4.202 2870 HA GLU 72 HA GLU 72 12.695 3.118 3.068 2871 HB2 GLU 72 2HB GLU 72 14.890 3.762 1.985 2872 HB3 GLU 72 1HB GLU 72 15.733 2.663 3.127 2873 HG2 GLU 72 2HG GLU 72 14.543 0.688 2.089 2874 HG3 GLU 72 1HG GLU 72 13.805 1.808 0.881 2875 H GLN 73 H GLN 73 15.122 2.280 5.589 2876 HA GLN 73 HA GLN 73 14.673 -0.461 5.630 2877 HB2 GLN 73 2HB GLN 73 16.619 0.355 6.814 2878 HB3 GLN 73 1HB GLN 73 15.635 1.421 7.865 2879 HG2 GLN 73 2HG GLN 73 14.813 -0.406 9.197 2880 HG3 GLN 73 1HG GLN 73 15.309 -1.637 7.988 2881 HE21 GLN 73 1HE2 GLN 73 17.531 -2.292 7.862 2882 HE22 GLN 73 2HE2 GLN 73 18.808 -1.582 8.795 2883 H VAL 74 H VAL 74 13.005 2.132 7.525 2884 HA VAL 74 HA VAL 74 11.674 0.250 9.130 2885 HB VAL 74 HB VAL 74 10.335 2.918 8.730 2886 HG11 VAL 74 1HG1 VAL 74 9.632 1.211 10.453 2887 HG12 VAL 74 2HG1 VAL 74 10.168 2.754 11.186 2888 HG13 VAL 74 3HG1 VAL 74 11.263 1.318 11.223 2889 HG21 VAL 74 3HG2 VAL 74 13.206 2.639 9.846 2890 HG22 VAL 74 1HG2 VAL 74 12.100 4.030 10.158 2891 HG23 VAL 74 2HG2 VAL 74 12.625 3.685 8.487 2892 H MET 75 H MET 75 10.746 2.051 6.190 2893 HA MET 75 HA MET 75 8.093 1.137 6.133 2894 HB2 MET 75 2HB MET 75 9.869 2.076 3.807 2895 HB3 MET 75 1HB MET 75 8.074 1.924 3.761 2896 HG2 MET 75 2HG MET 75 7.904 3.552 5.665 2897 HG3 MET 75 1HG MET 75 9.670 3.778 5.645 2898 HE1 MET 75 3HE MET 75 10.234 5.498 2.077 2899 HE2 MET 75 1HE MET 75 10.095 3.720 2.241 2900 HE3 MET 75 2HE MET 75 11.018 4.669 3.463 2901 H LYS 76 H LYS 76 11.100 -0.111 4.586 2902 HA LYS 76 HA LYS 76 9.756 -2.037 3.063 2903 HB2 LYS 76 2HB LYS 76 12.139 -1.069 2.809 2904 HB3 LYS 76 1HB LYS 76 12.679 -2.300 3.982 2905 HG2 LYS 76 2HG LYS 76 11.052 -3.170 1.525 2906 HG3 LYS 76 1HG LYS 76 12.697 -2.514 1.251 2907 HD2 LYS 76 2HD LYS 76 13.666 -4.238 2.793 2908 HD3 LYS 76 1HD LYS 76 12.029 -4.974 2.966 2909 HE2 LYS 76 2HE LYS 76 11.955 -5.438 0.504 2910 HE3 LYS 76 1HE LYS 76 13.565 -4.644 0.277 2911 HZ1 LYS 76 3HZ LYS 76 14.620 -6.402 1.466 2912 HZ2 LYS 76 1HZ LYS 76 13.525 -7.121 0.378 2913 HZ3 LYS 76 2HZ LYS 76 13.102 -7.007 2.022 2914 H ALA 77 H ALA 77 11.018 -2.073 6.392 2915 HA ALA 77 HA ALA 77 10.718 -4.851 6.792 2916 HB1 ALA 77 1HB ALA 77 10.568 -2.546 8.843 2917 HB2 ALA 77 2HB ALA 77 12.067 -3.422 8.365 2918 HB3 ALA 77 3HB ALA 77 10.756 -4.294 9.248 2919 H GLY 78 H GLY 78 8.533 -2.048 7.243 2920 HA2 GLY 78 2HA GLY 78 6.445 -3.415 8.499 2921 HA3 GLY 78 1HA GLY 78 6.360 -1.893 7.533 2922 H ILE 79 H ILE 79 7.039 -2.735 5.030 2923 HA ILE 79 HA ILE 79 4.683 -3.842 4.065 2924 HB ILE 79 HB ILE 79 7.451 -3.585 2.800 2925 HG12 ILE 79 2HG1 ILE 79 4.872 -1.927 2.403 2926 HG13 ILE 79 1HG1 ILE 79 6.170 -1.461 3.533 2927 HG21 ILE 79 1HG2 ILE 79 6.275 -3.877 0.572 2928 HG22 ILE 79 2HG2 ILE 79 4.753 -4.286 1.441 2929 HG23 ILE 79 3HG2 ILE 79 6.191 -5.364 1.556 2930 HD11 ILE 79 3HD ILE 79 6.468 -1.725 0.468 2931 HD12 ILE 79 1HD ILE 79 6.423 -0.212 1.431 2932 HD13 ILE 79 2HD ILE 79 7.812 -1.347 1.614 2933 H GLU 80 H GLU 80 7.888 -5.424 4.658 2934 HA GLU 80 HA GLU 80 7.102 -7.899 3.609 2935 HB2 GLU 80 2HB GLU 80 9.210 -7.214 5.728 2936 HB3 GLU 80 1HB GLU 80 8.991 -8.863 5.043 2937 HG2 GLU 80 2HG GLU 80 9.497 -8.043 2.753 2938 HG3 GLU 80 1HG GLU 80 9.732 -6.368 3.379 2939 H VAL 81 H VAL 81 6.738 -6.548 6.904 2940 HA VAL 81 HA VAL 81 6.015 -8.962 8.148 2941 HB VAL 81 HB VAL 81 5.578 -6.015 8.765 2942 HG11 VAL 81 1HG1 VAL 81 4.778 -6.746 11.072 2943 HG12 VAL 81 2HG1 VAL 81 4.554 -8.411 10.427 2944 HG13 VAL 81 3HG1 VAL 81 3.586 -7.040 9.768 2945 HG21 VAL 81 3HG2 VAL 81 7.270 -6.517 10.522 2946 HG22 VAL 81 1HG2 VAL 81 7.886 -7.104 8.943 2947 HG23 VAL 81 2HG2 VAL 81 7.207 -8.272 10.135 2948 H PHE 82 H PHE 82 3.961 -6.349 6.686 2949 HA PHE 82 HA PHE 82 1.614 -7.917 7.233 2950 HB2 PHE 82 2HB PHE 82 1.945 -5.380 5.516 2951 HB3 PHE 82 1HB PHE 82 0.365 -6.147 5.946 2952 HD1 PHE 82 1HD PHE 82 0.135 -6.722 8.591 2953 HD2 PHE 82 2HD PHE 82 2.634 -3.638 6.926 2954 HE1 PHE 82 1HE PHE 82 0.207 -5.596 10.786 2955 HE2 PHE 82 2HE PHE 82 2.714 -2.523 9.115 2956 HZ PHE 82 HZ PHE 82 1.504 -3.496 11.062 2957 H ALA 83 H ALA 83 3.985 -8.195 4.858 2958 HA ALA 83 HA ALA 83 2.182 -9.276 2.851 2959 HB1 ALA 83 1HB ALA 83 4.233 -9.767 1.559 2960 HB2 ALA 83 2HB ALA 83 5.265 -9.323 2.972 2961 HB3 ALA 83 3HB ALA 83 4.273 -8.070 2.138 2962 H LEU 84 H LEU 84 4.570 -10.366 5.279 2963 HA LEU 84 HA LEU 84 4.763 -13.023 4.665 2964 HB2 LEU 84 2HB LEU 84 6.115 -11.627 6.291 2965 HB3 LEU 84 1HB LEU 84 4.800 -11.761 7.488 2966 HG LEU 84 HG LEU 84 6.246 -14.211 6.292 2967 HD11 LEU 84 1HD1 LEU 84 7.975 -12.668 7.183 2968 HD12 LEU 84 2HD1 LEU 84 7.830 -14.136 8.213 2969 HD13 LEU 84 3HD1 LEU 84 7.110 -12.577 8.765 2970 HD21 LEU 84 3HD2 LEU 84 4.238 -14.863 7.601 2971 HD22 LEU 84 1HD2 LEU 84 4.755 -13.826 8.982 2972 HD23 LEU 84 2HD2 LEU 84 5.712 -15.281 8.524 2973 H VAL 85 H VAL 85 2.330 -11.352 6.664 2974 HA VAL 85 HA VAL 85 1.133 -13.619 7.719 2975 HB VAL 85 HB VAL 85 -0.755 -12.218 8.338 2976 HG11 VAL 85 1HG1 VAL 85 1.492 -12.096 9.573 2977 HG12 VAL 85 2HG1 VAL 85 0.506 -10.599 9.703 2978 HG13 VAL 85 3HG1 VAL 85 1.914 -10.655 8.596 2979 HG21 VAL 85 3HG2 VAL 85 -1.049 -10.902 6.215 2980 HG22 VAL 85 1HG2 VAL 85 0.543 -10.110 6.483 2981 HG23 VAL 85 2HG2 VAL 85 -0.821 -9.798 7.610 2982 H THR 86 H THR 86 1.133 -12.719 4.429 2983 HA THR 86 HA THR 86 -1.412 -13.546 3.670 2984 HB THR 86 HB THR 86 1.158 -13.767 2.040 2985 HG1 THR 86 1HG THR 86 1.018 -11.715 2.554 2986 HG21 THR 86 3HG2 THR 86 -0.439 -13.408 0.104 2987 HG22 THR 86 1HG2 THR 86 -1.833 -13.492 1.237 2988 HG23 THR 86 2HG2 THR 86 -0.800 -14.947 0.957 2989 H ALA 87 H ALA 87 1.273 -15.367 4.935 2990 HA ALA 87 HA ALA 87 0.676 -17.914 3.959 2991 HB1 ALA 87 1HB ALA 87 1.757 -18.757 6.057 2992 HB2 ALA 87 2HB ALA 87 1.577 -17.129 6.814 2993 HB3 ALA 87 3HB ALA 87 2.684 -17.349 5.422 2994 H ALA 88 H ALA 88 -0.972 -15.887 6.367 2995 HA ALA 88 HA ALA 88 -2.625 -18.068 7.317 2996 HB1 ALA 88 1HB ALA 88 -2.788 -15.016 7.832 2997 HB2 ALA 88 2HB ALA 88 -2.012 -16.204 8.933 2998 HB3 ALA 88 3HB ALA 88 -3.789 -16.254 8.657 2999 H LEU 89 H LEU 89 -2.848 -15.099 5.344 3000 HA LEU 89 HA LEU 89 -5.569 -15.224 4.874 3001 HB2 LEU 89 2HB LEU 89 -3.447 -14.098 2.957 3002 HB3 LEU 89 1HB LEU 89 -5.196 -13.709 2.941 3003 HG LEU 89 HG LEU 89 -3.244 -13.040 5.235 3004 HD11 LEU 89 1HD1 LEU 89 -3.387 -10.699 4.455 3005 HD12 LEU 89 2HD1 LEU 89 -4.467 -11.178 3.097 3006 HD13 LEU 89 3HD1 LEU 89 -2.758 -11.744 3.142 3007 HD21 LEU 89 3HD2 LEU 89 -5.088 -11.591 6.104 3008 HD22 LEU 89 1HD2 LEU 89 -5.567 -13.320 6.102 3009 HD23 LEU 89 2HD2 LEU 89 -6.195 -12.210 4.825 3010 H ALA 90 H ALA 90 -2.896 -16.803 3.139 3011 HA ALA 90 HA ALA 90 -4.398 -17.523 0.893 3012 HB1 ALA 90 1HB ALA 90 -2.561 -19.147 0.420 3013 HB2 ALA 90 2HB ALA 90 -1.927 -18.900 2.095 3014 HB3 ALA 90 3HB ALA 90 -1.903 -17.543 0.914 3015 H THR 91 H THR 91 -4.255 -19.023 4.134 3016 HA THR 91 HA THR 91 -5.544 -21.406 3.010 3017 HB THR 91 HB THR 91 -3.722 -21.869 4.480 3018 HG1 THR 91 1HG THR 91 -6.303 -22.476 5.407 3019 HG21 THR 91 3HG2 THR 91 -3.849 -21.362 6.923 3020 HG22 THR 91 1HG2 THR 91 -5.253 -20.266 6.627 3021 HG23 THR 91 2HG2 THR 91 -3.637 -19.905 5.912 3022 H ASP 92 H ASP 92 -6.474 -18.304 3.818 3023 HA ASP 92 HA ASP 92 -8.585 -18.936 5.577 3024 HB2 ASP 92 2HB ASP 92 -7.343 -16.645 5.245 3025 HB3 ASP 92 1HB ASP 92 -8.526 -16.362 3.920 3026 H PHE 93 H PHE 93 -8.257 -18.645 2.046 3027 HA PHE 93 HA PHE 93 -11.066 -18.947 1.617 3028 HB2 PHE 93 2HB PHE 93 -10.725 -19.061 -0.658 3029 HB3 PHE 93 1HB PHE 93 -9.450 -17.933 -0.121 3030 HD1 PHE 93 2HD PHE 93 -10.199 -21.242 -1.596 3031 HD2 PHE 93 1HD PHE 93 -7.052 -18.652 -0.238 3032 HE1 PHE 93 2HE PHE 93 -8.566 -22.524 -2.939 3033 HE2 PHE 93 1HE PHE 93 -5.424 -19.934 -1.573 3034 HZ PHE 93 HZ PHE 93 -6.177 -21.854 -2.957 3035 H VAL 94 H VAL 94 -8.325 -21.106 2.014 3036 HA VAL 94 HA VAL 94 -9.428 -23.384 0.834 3037 HB VAL 94 HB VAL 94 -7.208 -23.169 2.942 3038 HG11 VAL 94 1HG1 VAL 94 -7.881 -25.398 0.894 3039 HG12 VAL 94 2HG1 VAL 94 -7.947 -25.531 2.693 3040 HG13 VAL 94 3HG1 VAL 94 -6.367 -25.308 1.874 3041 HG21 VAL 94 3HG2 VAL 94 -7.098 -23.118 -0.156 3042 HG22 VAL 94 1HG2 VAL 94 -5.678 -23.106 0.947 3043 HG23 VAL 94 2HG2 VAL 94 -6.790 -21.709 0.912 3044 H ARG 95 H ARG 95 -9.693 -21.945 3.993 3045 HA ARG 95 HA ARG 95 -10.581 -23.926 5.595 3046 HB2 ARG 95 2HB ARG 95 -10.331 -21.486 6.274 3047 HB3 ARG 95 1HB ARG 95 -11.778 -21.097 5.285 3048 HG2 ARG 95 2HG ARG 95 -12.501 -21.169 7.579 3049 HG3 ARG 95 1HG ARG 95 -13.176 -22.593 6.770 3050 HD2 ARG 95 2HD ARG 95 -12.396 -23.466 8.844 3051 HD3 ARG 95 1HD ARG 95 -11.097 -23.939 7.692 3052 HE ARG 95 HE ARG 95 -10.711 -21.285 8.922 3053 HH11 ARG 95 1HH2 ARG 95 -10.359 -24.842 9.553 3054 HH12 ARG 95 2HH2 ARG 95 -9.335 -24.616 10.896 3055 HH21 ARG 95 1HH1 ARG 95 -9.406 -20.996 10.845 3056 HH22 ARG 95 2HH1 ARG 95 -9.073 -22.300 11.858 3057 H ARG 96 H ARG 96 -12.372 -22.340 2.914 3058 HA ARG 96 HA ARG 96 -14.883 -23.101 3.745 3059 HB2 ARG 96 2HB ARG 96 -15.802 -22.499 1.681 3060 HB3 ARG 96 1HB ARG 96 -14.413 -21.389 1.900 3061 HG2 ARG 96 2HG ARG 96 -13.078 -22.758 0.271 3062 HG3 ARG 96 1HG ARG 96 -14.412 -23.955 0.152 3063 HD2 ARG 96 2HD ARG 96 -15.958 -22.207 -0.744 3064 HD3 ARG 96 1HD ARG 96 -14.580 -21.023 -0.778 3065 HE ARG 96 HE ARG 96 -13.655 -23.345 -2.101 3066 HH11 ARG 96 1HH2 ARG 96 -16.599 -21.404 -2.749 3067 HH12 ARG 96 2HH2 ARG 96 -16.184 -20.959 -4.318 3068 HH21 ARG 96 1HH1 ARG 96 -13.745 -23.510 -4.538 3069 HH22 ARG 96 2HH1 ARG 96 -14.323 -22.167 -5.395 3070 H GLU 97 H GLU 97 -12.442 -25.191 2.563 3071 HA GLU 97 HA GLU 97 -14.024 -27.194 1.353 3072 HB2 GLU 97 2HB GLU 97 -11.459 -27.355 3.045 3073 HB3 GLU 97 1HB GLU 97 -12.193 -28.786 2.249 3074 HG2 GLU 97 2HG GLU 97 -11.142 -26.297 0.740 3075 HG3 GLU 97 1HG GLU 97 -10.247 -27.842 0.971 3076 H GLU 98 H GLU 98 -13.422 -26.217 4.743 3077 HA GLU 98 HA GLU 98 -14.459 -28.589 5.906 3078 HB2 GLU 98 2HB GLU 98 -14.020 -25.785 7.109 3079 HB3 GLU 98 1HB GLU 98 -14.472 -27.253 8.038 3080 HG2 GLU 98 2HG GLU 98 -12.330 -28.372 7.327 3081 HG3 GLU 98 1HG GLU 98 -11.847 -26.871 6.448 3082 H GLU 99 H GLU 99 -15.793 -25.189 5.537 3083 HA GLU 99 HA GLU 99 -18.291 -25.847 6.440 3084 HB2 GLU 99 2HB GLU 99 -17.357 -23.618 4.554 3085 HB3 GLU 99 1HB GLU 99 -19.056 -23.768 5.124 3086 HG2 GLU 99 2HG GLU 99 -18.059 -22.165 6.554 3087 HG3 GLU 99 1HG GLU 99 -18.273 -23.667 7.516 3088 H ARG 100 H ARG 100 -17.003 -26.219 3.124 3089 HA ARG 100 HA ARG 100 -19.532 -26.634 1.945 3090 HB2 ARG 100 2HB ARG 100 -17.251 -26.207 0.727 3091 HB3 ARG 100 1HB ARG 100 -16.958 -27.956 0.948 3092 HG2 ARG 100 2HG ARG 100 -19.419 -28.152 -0.186 3093 HG3 ARG 100 1HG ARG 100 -19.077 -26.482 -0.715 3094 HD2 ARG 100 2HD ARG 100 -17.511 -29.070 -1.415 3095 HD3 ARG 100 1HD ARG 100 -18.515 -28.058 -2.506 3096 HE ARG 100 HE ARG 100 -16.890 -26.301 -2.475 3097 HH11 ARG 100 1HH2 ARG 100 -15.751 -29.118 -0.498 3098 HH12 ARG 100 2HH2 ARG 100 -14.075 -28.767 -0.693 3099 HH21 ARG 100 1HH1 ARG 100 -14.490 -26.130 -3.021 3100 HH22 ARG 100 2HH1 ARG 100 -13.389 -26.941 -1.961 3101 H ARG 101 H ARG 101 -17.130 -28.865 3.454 3102 HA ARG 101 HA ARG 101 -18.631 -31.225 2.800 3103 HB2 ARG 101 2HB ARG 101 -16.414 -30.712 4.868 3104 HB3 ARG 101 1HB ARG 101 -17.113 -32.333 4.544 3105 HG2 ARG 101 2HG ARG 101 -15.689 -30.625 2.410 3106 HG3 ARG 101 1HG ARG 101 -14.880 -31.823 3.479 3107 HD2 ARG 101 2HD ARG 101 -16.376 -33.639 2.537 3108 HD3 ARG 101 1HD ARG 101 -17.067 -32.437 1.357 3109 HE ARG 101 HE ARG 101 -14.281 -32.169 1.070 3110 HH11 ARG 101 1HH2 ARG 101 -16.521 -35.012 0.741 3111 HH12 ARG 101 2HH2 ARG 101 -15.284 -36.023 0.116 3112 HH21 ARG 101 1HH1 ARG 101 -12.847 -33.370 -0.111 3113 HH22 ARG 101 2HH1 ARG 101 -13.174 -34.993 -0.654 3114 H GLY 102 H GLY 102 -18.355 -29.013 5.607 3115 HA2 GLY 102 2HA GLY 102 -20.093 -28.535 6.982 3116 HA3 GLY 102 1HA GLY 102 -20.886 -30.115 6.608 3117 H HIS 103 H HIS 103 -17.421 -30.285 7.161 3118 HA HIS 103 HA HIS 103 -17.477 -30.393 9.948 3119 HB2 HIS 103 2HB HIS 103 -18.614 -32.628 9.692 3120 HB3 HIS 103 1HB HIS 103 -17.414 -33.108 8.457 3121 HD1 HIS 103 1HD HIS 103 -16.519 -31.596 11.952 3122 HD2 HIS 103 2HD HIS 103 -16.198 -35.209 9.764 3123 HE1 HIS 103 1HE HIS 103 -15.275 -33.246 13.376 3124 HE2 HIS 103 2HE HIS 103 -15.040 -35.390 12.011 Start of MODEL 18 1 H1 SER 1 H SER 1 -21.051 -12.309 -3.784 2 HA SER 1 HA SER 1 -23.310 -13.479 -3.393 3 HB2 SER 1 2HB SER 1 -21.817 -13.892 -6.061 4 HB3 SER 1 1HB SER 1 -23.545 -13.443 -5.799 5 HG SER 1 1HG SER 1 -22.840 -11.433 -5.067 6 H ALA 2 H ALA 2 -20.251 -14.953 -4.192 7 HA ALA 2 HA ALA 2 -21.372 -17.593 -4.540 8 HB1 ALA 2 1HB ALA 2 -19.477 -16.906 -5.973 9 HB2 ALA 2 2HB ALA 2 -19.035 -18.317 -4.957 10 HB3 ALA 2 3HB ALA 2 -18.438 -16.667 -4.522 11 H ASP 3 H ASP 3 -19.222 -15.974 -2.060 12 HA ASP 3 HA ASP 3 -19.143 -18.365 -0.445 13 HB2 ASP 3 2HB ASP 3 -18.331 -19.061 -2.807 14 HB3 ASP 3 1HB ASP 3 -17.224 -17.673 -2.842 15 H HIS 4 H HIS 4 -16.159 -17.393 -1.109 16 HA HIS 4 HA HIS 4 -15.325 -15.931 0.886 17 HB2 HIS 4 2HB HIS 4 -13.423 -15.189 -0.558 18 HB3 HIS 4 1HB HIS 4 -13.839 -16.904 -0.782 19 HD1 HIS 4 1HD HIS 4 -14.440 -13.521 -2.848 20 HD2 HIS 4 2HD HIS 4 -13.869 -17.693 -3.365 21 HE1 HIS 4 1HE HIS 4 -13.968 -13.897 -5.182 22 HE2 HIS 4 2HE HIS 4 -13.481 -16.257 -5.539 23 H GLU 5 H GLU 5 -17.004 -14.506 -1.918 24 HA GLU 5 HA GLU 5 -16.099 -11.911 -1.573 25 HB2 GLU 5 2HB GLU 5 -18.849 -12.726 -2.665 26 HB3 GLU 5 1HB GLU 5 -17.968 -11.207 -3.018 27 HG2 GLU 5 2HG GLU 5 -17.007 -14.026 -3.906 28 HG3 GLU 5 1HG GLU 5 -17.980 -12.893 -4.902 29 H ARG 6 H ARG 6 -18.649 -13.671 0.108 30 HA ARG 6 HA ARG 6 -20.024 -11.331 0.982 31 HB2 ARG 6 2HB ARG 6 -19.921 -14.161 2.181 32 HB3 ARG 6 1HB ARG 6 -21.166 -12.923 2.554 33 HG2 ARG 6 2HG ARG 6 -22.139 -13.088 0.353 34 HG3 ARG 6 1HG ARG 6 -20.707 -13.948 -0.324 35 HD2 ARG 6 2HD ARG 6 -21.091 -15.879 1.209 36 HD3 ARG 6 1HD ARG 6 -22.627 -15.102 1.803 37 HE ARG 6 HE ARG 6 -22.774 -15.190 -1.038 38 HH11 ARG 6 1HH2 ARG 6 -22.516 -17.456 1.754 39 HH12 ARG 6 2HH2 ARG 6 -23.613 -18.596 1.095 40 HH21 ARG 6 1HH1 ARG 6 -23.909 -16.997 -2.111 41 HH22 ARG 6 2HH1 ARG 6 -24.446 -18.338 -1.173 42 H GLU 7 H GLU 7 -17.257 -13.248 2.110 43 HA GLU 7 HA GLU 7 -17.361 -12.137 4.750 44 HB2 GLU 7 2HB GLU 7 -16.456 -14.498 3.977 45 HB3 GLU 7 1HB GLU 7 -14.961 -13.610 3.541 46 HG2 GLU 7 2HG GLU 7 -14.767 -14.618 5.794 47 HG3 GLU 7 1HG GLU 7 -14.804 -12.827 5.964 48 H ALA 8 H ALA 8 -15.693 -11.596 1.675 49 HA ALA 8 HA ALA 8 -13.890 -9.632 2.562 50 HB1 ALA 8 1HB ALA 8 -15.208 -9.984 -0.220 51 HB2 ALA 8 2HB ALA 8 -13.659 -10.741 0.310 52 HB3 ALA 8 3HB ALA 8 -13.777 -8.955 0.128 53 H GLN 9 H GLN 9 -17.181 -9.424 1.117 54 HA GLN 9 HA GLN 9 -17.357 -6.649 1.199 55 HB2 GLN 9 2HB GLN 9 -18.815 -8.072 -0.187 56 HB3 GLN 9 1HB GLN 9 -19.581 -8.781 1.274 57 HG2 GLN 9 2HG GLN 9 -20.691 -6.685 1.837 58 HG3 GLN 9 1HG GLN 9 -19.661 -5.756 0.697 59 HE21 GLN 9 1HE2 GLN 9 -20.415 -5.497 -1.402 60 HE22 GLN 9 2HE2 GLN 9 -21.711 -6.403 -2.132 61 H LYS 10 H LYS 10 -18.133 -9.110 3.668 62 HA LYS 10 HA LYS 10 -19.459 -7.381 5.443 63 HB2 LYS 10 2HB LYS 10 -19.620 -9.772 5.884 64 HB3 LYS 10 1HB LYS 10 -17.834 -9.950 5.904 65 HG2 LYS 10 2HG LYS 10 -17.620 -8.724 7.980 66 HG3 LYS 10 1HG LYS 10 -19.360 -8.268 7.982 67 HD2 LYS 10 2HD LYS 10 -20.017 -10.507 8.598 68 HD3 LYS 10 1HD LYS 10 -18.470 -11.212 8.028 69 HE2 LYS 10 2HE LYS 10 -18.739 -11.043 10.601 70 HE3 LYS 10 1HE LYS 10 -17.209 -10.396 9.902 71 HZ1 LYS 10 3HZ LYS 10 -18.438 -9.032 11.635 72 HZ2 LYS 10 1HZ LYS 10 -19.484 -8.562 10.387 73 HZ3 LYS 10 2HZ LYS 10 -17.827 -8.238 10.272 74 H ALA 11 H ALA 11 -15.993 -8.145 4.945 75 HA ALA 11 HA ALA 11 -15.051 -6.961 7.264 76 HB1 ALA 11 1HB ALA 11 -13.654 -8.453 5.785 77 HB2 ALA 11 2HB ALA 11 -12.821 -6.902 6.159 78 HB3 ALA 11 3HB ALA 11 -13.594 -7.143 4.550 79 H GLU 12 H GLU 12 -15.945 -5.502 4.152 80 HA GLU 12 HA GLU 12 -14.743 -3.007 4.557 81 HB2 GLU 12 2HB GLU 12 -17.288 -3.723 2.984 82 HB3 GLU 12 1HB GLU 12 -16.413 -2.156 2.875 83 HG2 GLU 12 2HG GLU 12 -14.376 -3.317 2.019 84 HG3 GLU 12 1HG GLU 12 -15.205 -4.912 2.133 85 H GLU 13 H GLU 13 -17.688 -4.439 5.905 86 HA GLU 13 HA GLU 13 -18.870 -1.946 6.624 87 HB2 GLU 13 2HB GLU 13 -19.970 -4.388 6.343 88 HB3 GLU 13 1HB GLU 13 -19.500 -4.580 8.052 89 HG2 GLU 13 2HG GLU 13 -21.797 -3.765 8.053 90 HG3 GLU 13 1HG GLU 13 -20.790 -2.336 8.499 91 H GLU 14 H GLU 14 -16.646 -4.285 8.099 92 HA GLU 14 HA GLU 14 -16.720 -3.291 10.712 93 HB2 GLU 14 2HB GLU 14 -14.886 -5.096 9.196 94 HB3 GLU 14 1HB GLU 14 -14.108 -4.168 10.512 95 HG2 GLU 14 2HG GLU 14 -14.774 -6.221 11.491 96 HG3 GLU 14 1HG GLU 14 -15.875 -4.965 12.132 97 H LEU 15 H LEU 15 -14.806 -2.342 7.881 98 HA LEU 15 HA LEU 15 -13.199 -0.529 9.268 99 HB2 LEU 15 2HB LEU 15 -12.719 -1.459 6.977 100 HB3 LEU 15 1HB LEU 15 -14.043 -0.461 6.301 101 HG LEU 15 HG LEU 15 -12.818 1.602 6.776 102 HD11 LEU 15 1HD1 LEU 15 -10.456 1.496 7.818 103 HD12 LEU 15 2HD1 LEU 15 -10.860 -0.170 8.360 104 HD13 LEU 15 3HD1 LEU 15 -11.816 1.237 8.950 105 HD21 LEU 15 3HD2 LEU 15 -12.209 0.369 4.701 106 HD22 LEU 15 1HD2 LEU 15 -10.935 -0.544 5.582 107 HD23 LEU 15 2HD2 LEU 15 -10.775 1.232 5.356 108 H GLN 16 H GLN 16 -16.353 -0.115 7.591 109 HA GLN 16 HA GLN 16 -16.435 2.654 7.771 110 HB2 GLN 16 2HB GLN 16 -18.854 0.763 7.814 111 HB3 GLN 16 1HB GLN 16 -18.890 2.543 7.577 112 HG2 GLN 16 2HG GLN 16 -17.182 2.055 5.579 113 HG3 GLN 16 1HG GLN 16 -17.845 0.384 5.656 114 HE21 GLN 16 1HE2 GLN 16 -20.438 0.281 5.630 115 HE22 GLN 16 2HE2 GLN 16 -21.206 1.455 4.641 116 H LYS 17 H LYS 17 -17.370 0.214 10.204 117 HA LYS 17 HA LYS 17 -18.612 2.061 11.951 118 HB2 LYS 17 2HB LYS 17 -17.236 -0.626 12.514 119 HB3 LYS 17 1HB LYS 17 -18.169 0.294 13.747 120 HG2 LYS 17 2HG LYS 17 -20.233 0.129 12.464 121 HG3 LYS 17 1HG LYS 17 -19.410 -0.669 11.091 122 HD2 LYS 17 2HD LYS 17 -19.613 -1.872 13.933 123 HD3 LYS 17 1HD LYS 17 -20.775 -2.182 12.592 124 HE2 LYS 17 2HE LYS 17 -18.897 -3.046 11.148 125 HE3 LYS 17 1HE LYS 17 -17.755 -2.871 12.543 126 HZ1 LYS 17 3HZ LYS 17 -18.987 -4.553 13.714 127 HZ2 LYS 17 1HZ LYS 17 -18.639 -5.110 12.137 128 HZ3 LYS 17 2HZ LYS 17 -20.202 -4.575 12.514 129 H VAL 18 H VAL 18 -15.215 1.123 11.460 130 HA VAL 18 HA VAL 18 -14.316 2.288 13.897 131 HB VAL 18 HB VAL 18 -12.785 1.507 11.369 132 HG11 VAL 18 1HG1 VAL 18 -11.464 3.155 12.734 133 HG12 VAL 18 2HG1 VAL 18 -10.770 1.507 12.894 134 HG13 VAL 18 3HG1 VAL 18 -11.780 2.190 14.222 135 HG21 VAL 18 3HG2 VAL 18 -12.206 -0.531 12.706 136 HG22 VAL 18 1HG2 VAL 18 -13.990 -0.407 12.551 137 HG23 VAL 18 2HG2 VAL 18 -13.197 0.068 14.090 138 H LEU 19 H LEU 19 -14.940 3.497 10.591 139 HA LEU 19 HA LEU 19 -13.489 5.874 10.731 140 HB2 LEU 19 2HB LEU 19 -16.271 5.543 9.435 141 HB3 LEU 19 1HB LEU 19 -15.093 6.846 9.087 142 HG LEU 19 HG LEU 19 -14.723 3.861 8.456 143 HD11 LEU 19 1HD1 LEU 19 -15.036 4.545 6.082 144 HD12 LEU 19 2HD1 LEU 19 -15.325 6.249 6.594 145 HD13 LEU 19 3HD1 LEU 19 -16.489 4.957 7.067 146 HD21 LEU 19 3HD2 LEU 19 -12.770 4.612 7.085 147 HD22 LEU 19 1HD2 LEU 19 -12.511 4.909 8.839 148 HD23 LEU 19 2HD2 LEU 19 -12.950 6.275 7.745 149 H GLU 20 H GLU 20 -16.706 5.018 11.932 150 HA GLU 20 HA GLU 20 -17.566 7.608 12.592 151 HB2 GLU 20 2HB GLU 20 -18.342 4.853 13.738 152 HB3 GLU 20 1HB GLU 20 -19.265 6.361 14.013 153 HG2 GLU 20 2HG GLU 20 -18.744 5.218 11.167 154 HG3 GLU 20 1HG GLU 20 -20.133 4.736 12.200 155 H GLU 21 H GLU 21 -16.021 4.982 14.486 156 HA GLU 21 HA GLU 21 -15.903 6.410 16.939 157 HB2 GLU 21 2HB GLU 21 -14.343 4.062 15.734 158 HB3 GLU 21 1HB GLU 21 -13.790 4.775 17.276 159 HG2 GLU 21 2HG GLU 21 -16.693 3.797 16.970 160 HG3 GLU 21 1HG GLU 21 -15.339 2.684 17.386 161 H ALA 22 H ALA 22 -13.746 6.102 14.127 162 HA ALA 22 HA ALA 22 -11.525 7.322 15.172 163 HB1 ALA 22 1HB ALA 22 -12.494 7.412 12.250 164 HB2 ALA 22 2HB ALA 22 -11.525 6.091 12.979 165 HB3 ALA 22 3HB ALA 22 -10.811 7.737 12.809 166 H SER 23 H SER 23 -14.401 8.839 13.625 167 HA SER 23 HA SER 23 -13.178 11.397 13.505 168 HB2 SER 23 2HB SER 23 -15.555 12.291 13.264 169 HB3 SER 23 1HB SER 23 -15.029 11.090 12.035 170 HG SER 23 1HG SER 23 -16.327 9.605 12.856 171 H LYS 24 H LYS 24 -15.236 9.775 15.939 172 HA LYS 24 HA LYS 24 -15.494 11.943 17.666 173 HB2 LYS 24 2HB LYS 24 -16.888 9.898 17.833 174 HB3 LYS 24 1HB LYS 24 -15.449 8.914 18.241 175 HG2 LYS 24 2HG LYS 24 -15.203 10.067 20.404 176 HG3 LYS 24 1HG LYS 24 -16.523 11.217 19.987 177 HD2 LYS 24 2HD LYS 24 -18.198 9.434 20.020 178 HD3 LYS 24 1HD LYS 24 -16.942 8.159 20.096 179 HE2 LYS 24 2HE LYS 24 -18.114 8.545 22.309 180 HE3 LYS 24 1HE LYS 24 -16.321 8.743 22.390 181 HZ1 LYS 24 3HZ LYS 24 -17.670 10.438 23.564 182 HZ2 LYS 24 1HZ LYS 24 -18.177 11.065 22.053 183 HZ3 LYS 24 2HZ LYS 24 -16.525 11.055 22.471 184 H LYS 25 H LYS 25 -13.165 9.222 17.745 185 HA LYS 25 HA LYS 25 -11.808 10.287 19.992 186 HB2 LYS 25 2HB LYS 25 -11.006 8.137 17.942 187 HB3 LYS 25 1HB LYS 25 -10.112 8.468 19.470 188 HG2 LYS 25 2HG LYS 25 -13.054 7.508 19.297 189 HG3 LYS 25 1HG LYS 25 -11.615 6.502 19.660 190 HD2 LYS 25 2HD LYS 25 -11.104 8.055 21.599 191 HD3 LYS 25 1HD LYS 25 -12.698 8.846 21.370 192 HE2 LYS 25 2HE LYS 25 -13.911 6.795 21.920 193 HE3 LYS 25 1HE LYS 25 -12.402 5.800 21.826 194 HZ1 LYS 25 3HZ LYS 25 -11.528 6.950 23.716 195 HZ2 LYS 25 1HZ LYS 25 -13.105 6.301 24.068 196 HZ3 LYS 25 2HZ LYS 25 -12.880 7.960 23.852 197 H ALA 26 H ALA 26 -11.294 10.673 16.455 198 HA ALA 26 HA ALA 26 -8.699 11.754 16.758 199 HB1 ALA 26 1HB ALA 26 -9.464 10.995 14.504 200 HB2 ALA 26 2HB ALA 26 -8.984 12.729 14.475 201 HB3 ALA 26 3HB ALA 26 -10.733 12.274 14.502 202 H VAL 27 H VAL 27 -12.009 13.265 16.600 203 HA VAL 27 HA VAL 27 -11.006 15.896 16.659 204 HB VAL 27 HB VAL 27 -13.683 14.706 17.556 205 HG11 VAL 27 1HG1 VAL 27 -14.593 17.081 17.367 206 HG12 VAL 27 2HG1 VAL 27 -12.899 17.694 17.233 207 HG13 VAL 27 3HG1 VAL 27 -13.461 16.892 18.748 208 HG21 VAL 27 3HG2 VAL 27 -12.906 14.603 15.080 209 HG22 VAL 27 1HG2 VAL 27 -12.954 16.393 15.066 210 HG23 VAL 27 2HG2 VAL 27 -14.459 15.434 15.390 211 H GLU 28 H GLU 28 -11.859 13.586 19.236 212 HA GLU 28 HA GLU 28 -11.546 15.450 21.345 213 HB2 GLU 28 2HB GLU 28 -12.806 13.233 21.519 214 HB3 GLU 28 1HB GLU 28 -11.232 12.385 21.421 215 HG2 GLU 28 2HG GLU 28 -10.502 13.572 23.553 216 HG3 GLU 28 1HG GLU 28 -12.126 14.334 23.661 217 H ALA 29 H ALA 29 -9.310 13.324 19.551 218 HA ALA 29 HA ALA 29 -7.316 13.133 21.433 219 HB1 ALA 29 1HB ALA 29 -5.785 12.619 19.567 220 HB2 ALA 29 2HB ALA 29 -6.965 13.260 18.366 221 HB3 ALA 29 3HB ALA 29 -7.353 11.771 19.304 222 H GLU 30 H GLU 30 -7.887 15.517 18.970 223 HA GLU 30 HA GLU 30 -5.643 17.082 19.188 224 HB2 GLU 30 2HB GLU 30 -8.061 16.840 17.727 225 HB3 GLU 30 1HB GLU 30 -8.320 18.376 18.592 226 HG2 GLU 30 2HG GLU 30 -7.369 18.871 16.463 227 HG3 GLU 30 1HG GLU 30 -6.056 19.118 17.661 228 H ARG 31 H ARG 31 -8.608 16.913 21.137 229 HA ARG 31 HA ARG 31 -8.181 19.544 22.261 230 HB2 ARG 31 2HB ARG 31 -10.485 18.811 21.570 231 HB3 ARG 31 1HB ARG 31 -10.410 17.500 22.787 232 HG2 ARG 31 2HG ARG 31 -11.771 19.438 23.522 233 HG3 ARG 31 1HG ARG 31 -10.393 19.118 24.630 234 HD2 ARG 31 2HD ARG 31 -9.125 21.064 23.733 235 HD3 ARG 31 1HD ARG 31 -10.383 21.294 22.438 236 HE ARG 31 HE ARG 31 -11.436 21.326 25.219 237 HH11 ARG 31 1HH2 ARG 31 -9.570 23.444 22.985 238 HH12 ARG 31 2HH2 ARG 31 -10.659 24.723 22.938 239 HH21 ARG 31 1HH1 ARG 31 -12.742 23.377 25.605 240 HH22 ARG 31 2HH1 ARG 31 -12.474 24.738 24.575 241 H GLY 32 H GLY 32 -6.095 18.884 23.203 242 HA2 GLY 32 2HA GLY 32 -6.070 18.826 25.855 243 HA3 GLY 32 1HA GLY 32 -6.179 17.060 25.432 244 H ALA 33 H ALA 33 -4.862 17.346 22.861 245 HA ALA 33 HA ALA 33 -2.211 17.061 23.886 246 HB1 ALA 33 1HB ALA 33 -3.361 16.803 21.050 247 HB2 ALA 33 2HB ALA 33 -3.140 15.438 22.201 248 HB3 ALA 33 3HB ALA 33 -1.700 16.290 21.520 249 HA PRO 34 HA PRO 34 -0.936 21.001 22.189 250 HB2 PRO 34 2HB PRO 34 1.818 20.629 21.776 251 HB3 PRO 34 1HB PRO 34 1.081 20.782 23.416 252 HG2 PRO 34 2HG PRO 34 1.788 18.210 21.904 253 HG3 PRO 34 1HG PRO 34 2.188 18.638 23.619 254 HD2 PRO 34 2HD PRO 34 -0.002 17.071 22.952 255 HD3 PRO 34 1HD PRO 34 -0.099 18.270 24.321 256 H GLY 35 H GLY 35 -0.519 22.047 20.136 257 HA2 GLY 35 2HA GLY 35 0.112 22.174 17.991 258 HA3 GLY 35 1HA GLY 35 0.422 20.399 17.946 259 H ALA 36 H ALA 36 -2.559 21.464 19.294 260 HA ALA 36 HA ALA 36 -4.059 19.787 17.814 261 HB1 ALA 36 1HB ALA 36 -6.071 20.978 18.752 262 HB2 ALA 36 2HB ALA 36 -5.016 22.369 19.199 263 HB3 ALA 36 3HB ALA 36 -4.789 20.763 19.991 264 H ALA 37 H ALA 37 -4.975 19.686 15.786 265 HA ALA 37 HA ALA 37 -5.332 22.211 14.323 266 HB1 ALA 37 1HB ALA 37 -4.550 20.944 12.286 267 HB2 ALA 37 2HB ALA 37 -4.212 19.508 13.330 268 HB3 ALA 37 3HB ALA 37 -3.268 21.016 13.549 269 H LEU 38 H LEU 38 -6.171 18.657 14.321 270 HA LEU 38 HA LEU 38 -8.386 19.227 12.534 271 HB2 LEU 38 2HB LEU 38 -6.960 17.173 12.229 272 HB3 LEU 38 1HB LEU 38 -7.517 16.591 13.822 273 HG LEU 38 HG LEU 38 -9.891 16.525 12.956 274 HD11 LEU 38 1HD1 LEU 38 -10.372 16.637 10.526 275 HD12 LEU 38 2HD1 LEU 38 -8.678 17.096 10.176 276 HD13 LEU 38 3HD1 LEU 38 -9.750 18.221 11.095 277 HD21 LEU 38 3HD2 LEU 38 -8.457 14.519 13.005 278 HD22 LEU 38 1HD2 LEU 38 -7.847 14.883 11.353 279 HD23 LEU 38 2HD2 LEU 38 -9.586 14.469 11.602 280 H ILE 39 H ILE 39 -9.500 20.673 14.155 281 HA ILE 39 HA ILE 39 -11.052 19.010 16.040 282 HB ILE 39 HB ILE 39 -9.455 20.208 17.267 283 HG12 ILE 39 2HG1 ILE 39 -12.251 21.431 17.665 284 HG13 ILE 39 1HG1 ILE 39 -11.723 19.788 18.176 285 HG21 ILE 39 1HG2 ILE 39 -9.306 22.678 17.338 286 HG22 ILE 39 2HG2 ILE 39 -10.534 22.826 16.035 287 HG23 ILE 39 3HG2 ILE 39 -8.937 22.063 15.703 288 HD11 ILE 39 3HD ILE 39 -10.539 22.465 19.183 289 HD12 ILE 39 1HD ILE 39 -11.613 21.356 20.102 290 HD13 ILE 39 2HD ILE 39 -9.949 20.823 19.646 291 H SER 40 H SER 40 -12.404 18.641 14.093 292 HA SER 40 HA SER 40 -14.662 20.350 14.464 293 HB2 SER 40 2HB SER 40 -13.349 20.043 11.685 294 HB3 SER 40 1HB SER 40 -15.104 20.429 11.879 295 HG SER 40 1HG SER 40 -13.843 22.258 11.515 296 H TYR 41 H TYR 41 -16.217 18.736 14.822 297 HA TYR 41 HA TYR 41 -15.797 16.093 14.098 298 HB2 TYR 41 2HB TYR 41 -17.485 17.102 15.892 299 HB3 TYR 41 1HB TYR 41 -18.663 17.055 14.533 300 HD1 TYR 41 2HD TYR 41 -18.654 14.677 13.177 301 HD2 TYR 41 1HD TYR 41 -17.305 15.228 17.234 302 HE1 TYR 41 2HE TYR 41 -18.785 12.264 13.547 303 HE2 TYR 41 1HE TYR 41 -17.547 12.817 17.632 304 HH TYR 41 HH TYR 41 -17.826 10.560 14.992 305 HA PRO 42 HA PRO 42 -18.667 16.284 10.488 306 HB2 PRO 42 2HB PRO 42 -19.337 18.644 9.112 307 HB3 PRO 42 1HB PRO 42 -20.255 18.040 10.542 308 HG2 PRO 42 2HG PRO 42 -18.006 20.129 10.507 309 HG3 PRO 42 1HG PRO 42 -19.635 20.251 11.292 310 HD2 PRO 42 2HD PRO 42 -17.416 19.500 12.729 311 HD3 PRO 42 1HD PRO 42 -19.015 18.679 13.025 312 H ASP 43 H ASP 43 -15.740 17.839 10.731 313 HA ASP 43 HA ASP 43 -15.127 17.727 7.855 314 HB2 ASP 43 2HB ASP 43 -14.751 19.798 9.617 315 HB3 ASP 43 1HB ASP 43 -13.213 18.905 9.918 316 H ALA 44 H ALA 44 -14.369 16.537 11.182 317 HA ALA 44 HA ALA 44 -12.014 15.219 10.464 318 HB1 ALA 44 1HB ALA 44 -12.213 14.017 12.643 319 HB2 ALA 44 2HB ALA 44 -13.894 14.653 12.827 320 HB3 ALA 44 3HB ALA 44 -12.480 15.778 12.828 321 H ILE 45 H ILE 45 -15.390 14.276 10.184 322 HA ILE 45 HA ILE 45 -14.835 11.511 9.901 323 HB ILE 45 HB ILE 45 -17.007 12.366 10.575 324 HG12 ILE 45 2HG1 ILE 45 -17.149 10.761 7.950 325 HG13 ILE 45 1HG1 ILE 45 -16.725 10.100 9.562 326 HG21 ILE 45 1HG2 ILE 45 -17.308 13.403 7.680 327 HG22 ILE 45 2HG2 ILE 45 -17.055 14.436 9.137 328 HG23 ILE 45 3HG2 ILE 45 -18.546 13.457 8.979 329 HD11 ILE 45 3HD ILE 45 -19.429 11.380 8.771 330 HD12 ILE 45 1HD ILE 45 -19.093 9.644 9.113 331 HD13 ILE 45 2HD ILE 45 -18.987 10.848 10.443 332 H TRP 46 H TRP 46 -14.360 14.270 7.827 333 HA TRP 46 HA TRP 46 -14.402 12.765 5.373 334 HB2 TRP 46 2HB TRP 46 -14.495 15.515 6.098 335 HB3 TRP 46 1HB TRP 46 -12.865 15.358 5.397 336 HD1 TRP 46 HD TRP 46 -12.999 15.976 2.831 337 HE1 TRP 46 1HE TRP 46 -14.830 16.129 1.104 338 HE3 TRP 46 3HE TRP 46 -16.704 13.759 5.547 339 HZ2 TRP 46 2HZ TRP 46 -17.629 15.366 0.908 340 HZ3 TRP 46 3HZ TRP 46 -18.928 13.464 4.533 341 HH2 TRP 46 HH TRP 46 -19.376 14.232 2.220 342 H TRP 47 H TRP 47 -12.106 14.015 7.744 343 HA TRP 47 HA TRP 47 -9.769 13.238 6.411 344 HB2 TRP 47 2HB TRP 47 -9.947 14.905 8.327 345 HB3 TRP 47 1HB TRP 47 -10.210 13.524 9.447 346 HD1 TRP 47 HD TRP 47 -7.433 15.016 7.085 347 HE1 TRP 47 1HE TRP 47 -5.154 14.408 8.134 348 HE3 TRP 47 3HE TRP 47 -9.095 11.896 10.756 349 HZ2 TRP 47 2HZ TRP 47 -4.190 12.534 10.066 350 HZ3 TRP 47 3HZ TRP 47 -7.454 10.740 12.204 351 HH2 TRP 47 HH TRP 47 -5.025 11.064 11.858 352 H SER 48 H SER 48 -11.847 11.545 8.924 353 HA SER 48 HA SER 48 -10.069 9.423 9.095 354 HB2 SER 48 2HB SER 48 -11.888 8.089 10.168 355 HB3 SER 48 1HB SER 48 -11.530 9.677 10.937 356 HG SER 48 1HG SER 48 -13.813 9.012 10.547 357 H VAL 49 H VAL 49 -12.567 10.005 6.669 358 HA VAL 49 HA VAL 49 -12.715 7.406 5.628 359 HB VAL 49 HB VAL 49 -12.989 10.163 4.357 360 HG11 VAL 49 1HG1 VAL 49 -12.199 8.601 2.530 361 HG12 VAL 49 2HG1 VAL 49 -13.883 9.097 2.293 362 HG13 VAL 49 3HG1 VAL 49 -13.516 7.450 2.947 363 HG21 VAL 49 3HG2 VAL 49 -15.395 9.655 4.460 364 HG22 VAL 49 1HG2 VAL 49 -14.714 9.233 6.063 365 HG23 VAL 49 2HG2 VAL 49 -15.070 7.929 4.892 366 H GLU 50 H GLU 50 -10.437 10.137 4.807 367 HA GLU 50 HA GLU 50 -9.092 8.443 2.958 368 HB2 GLU 50 2HB GLU 50 -7.370 10.226 2.755 369 HB3 GLU 50 1HB GLU 50 -9.040 10.751 2.391 370 HG2 GLU 50 2HG GLU 50 -9.222 11.895 4.571 371 HG3 GLU 50 1HG GLU 50 -7.579 11.327 5.055 372 H THR 51 H THR 51 -8.679 9.174 6.416 373 HA THR 51 HA THR 51 -6.102 8.227 6.714 374 HB THR 51 HB THR 51 -8.406 7.866 8.703 375 HG1 THR 51 1HG THR 51 -6.749 10.073 8.074 376 HG21 THR 51 3HG2 THR 51 -6.373 6.641 9.436 377 HG22 THR 51 1HG2 THR 51 -6.581 8.117 10.438 378 HG23 THR 51 2HG2 THR 51 -5.342 8.086 9.126 379 H ALA 52 H ALA 52 -9.201 6.431 6.569 380 HA ALA 52 HA ALA 52 -8.145 3.977 7.460 381 HB1 ALA 52 1HB ALA 52 -10.577 4.417 7.436 382 HB2 ALA 52 2HB ALA 52 -10.227 3.003 6.381 383 HB3 ALA 52 3HB ALA 52 -10.556 4.612 5.641 384 H THR 53 H THR 53 -8.318 5.499 4.217 385 HA THR 53 HA THR 53 -7.339 3.117 2.944 386 HB THR 53 HB THR 53 -7.087 4.928 0.996 387 HG1 THR 53 1HG THR 53 -7.542 6.656 2.575 388 HG21 THR 53 3HG2 THR 53 -8.726 3.032 1.085 389 HG22 THR 53 1HG2 THR 53 -9.510 4.540 0.487 390 HG23 THR 53 2HG2 THR 53 -9.795 3.989 2.181 391 H THR 54 H THR 54 -5.818 5.140 5.054 392 HA THR 54 HA THR 54 -3.803 5.767 5.469 393 HB THR 54 HB THR 54 -1.921 4.148 4.883 394 HG1 THR 54 1HG THR 54 -3.345 3.356 2.995 395 HG21 THR 54 3HG2 THR 54 -3.292 4.081 6.972 396 HG22 THR 54 1HG2 THR 54 -2.855 2.426 6.416 397 HG23 THR 54 2HG2 THR 54 -4.528 3.049 6.154 398 H VAL 55 H VAL 55 -4.939 6.876 2.923 399 HA VAL 55 HA VAL 55 -2.574 7.185 1.289 400 HB VAL 55 HB VAL 55 -4.512 7.020 0.006 401 HG11 VAL 55 1HG1 VAL 55 -6.490 8.439 0.167 402 HG12 VAL 55 2HG1 VAL 55 -5.781 9.416 1.490 403 HG13 VAL 55 3HG1 VAL 55 -6.216 7.683 1.763 404 HG21 VAL 55 3HG2 VAL 55 -2.741 8.645 -0.700 405 HG22 VAL 55 1HG2 VAL 55 -3.630 9.993 0.090 406 HG23 VAL 55 2HG2 VAL 55 -4.357 9.133 -1.306 407 H GLY 56 H GLY 56 -4.738 9.358 3.194 408 HA2 GLY 56 2HA GLY 56 -4.269 11.161 4.399 409 HA3 GLY 56 1HA GLY 56 -2.593 10.491 4.578 410 H TYR 57 H TYR 57 -4.748 12.374 2.402 411 HA TYR 57 HA TYR 57 -2.669 12.747 0.498 412 HB2 TYR 57 2HB TYR 57 -5.153 12.576 -0.007 413 HB3 TYR 57 1HB TYR 57 -5.423 14.131 0.856 414 HD1 TYR 57 1HD TYR 57 -3.912 12.524 -2.180 415 HD2 TYR 57 2HD TYR 57 -4.743 16.199 -0.117 416 HE1 TYR 57 1HE TYR 57 -3.181 13.803 -4.170 417 HE2 TYR 57 2HE TYR 57 -3.972 17.469 -2.025 418 HH TYR 57 HH TYR 57 -3.071 17.411 -4.049 419 H GLY 58 H GLY 58 -3.575 14.336 3.388 420 HA2 GLY 58 2HA GLY 58 -1.959 15.632 4.442 421 HA3 GLY 58 1HA GLY 58 -1.503 16.388 2.874 422 H ASP 59 H ASP 59 -4.832 15.879 3.721 423 HA ASP 59 HA ASP 59 -5.550 18.573 3.516 424 HB2 ASP 59 2HB ASP 59 -7.139 16.729 3.050 425 HB3 ASP 59 1HB ASP 59 -6.949 16.088 4.710 426 H ARG 60 H ARG 60 -5.201 16.416 6.430 427 HA ARG 60 HA ARG 60 -4.523 18.762 7.944 428 HB2 ARG 60 2HB ARG 60 -7.146 17.521 8.316 429 HB3 ARG 60 1HB ARG 60 -6.146 17.028 9.694 430 HG2 ARG 60 2HG ARG 60 -7.375 19.050 10.264 431 HG3 ARG 60 1HG ARG 60 -5.623 19.404 10.248 432 HD2 ARG 60 2HD ARG 60 -7.105 21.246 9.181 433 HD3 ARG 60 1HD ARG 60 -5.823 20.611 8.098 434 HE ARG 60 HE ARG 60 -7.398 19.544 6.763 435 HH11 ARG 60 1HH2 ARG 60 -9.179 21.008 9.621 436 HH12 ARG 60 2HH2 ARG 60 -10.700 20.503 8.937 437 HH21 ARG 60 1HH1 ARG 60 -9.548 18.620 6.227 438 HH22 ARG 60 2HH1 ARG 60 -10.917 19.297 7.075 439 H TYR 61 H TYR 61 -3.613 17.895 10.144 440 HA TYR 61 HA TYR 61 -2.234 15.402 9.602 441 HB2 TYR 61 2HB TYR 61 -0.898 17.896 10.869 442 HB3 TYR 61 1HB TYR 61 -0.101 16.349 10.390 443 HD1 TYR 61 1HD TYR 61 -0.271 15.733 7.803 444 HD2 TYR 61 2HD TYR 61 -0.961 19.686 9.374 445 HE1 TYR 61 1HE TYR 61 -0.074 16.663 5.543 446 HE2 TYR 61 2HE TYR 61 -0.769 20.619 7.100 447 HH TYR 61 HH TYR 61 -1.228 18.895 4.413 448 HA PRO 62 HA PRO 62 -4.024 15.468 13.736 449 HB2 PRO 62 2HB PRO 62 -3.254 13.004 14.673 450 HB3 PRO 62 1HB PRO 62 -4.312 13.114 13.214 451 HG2 PRO 62 2HG PRO 62 -1.276 12.671 13.329 452 HG3 PRO 62 1HG PRO 62 -2.495 11.796 12.312 453 HD2 PRO 62 2HD PRO 62 -0.926 14.068 11.528 454 HD3 PRO 62 1HD PRO 62 -2.458 13.542 10.698 455 H VAL 63 H VAL 63 -3.323 15.442 16.088 456 HA VAL 63 HA VAL 63 -0.771 16.542 16.467 457 HB VAL 63 HB VAL 63 -1.304 16.252 18.964 458 HG11 VAL 63 1HG1 VAL 63 -3.101 17.961 18.841 459 HG12 VAL 63 2HG1 VAL 63 -3.296 17.627 17.078 460 HG13 VAL 63 3HG1 VAL 63 -1.747 18.284 17.695 461 HG21 VAL 63 3HG2 VAL 63 -2.726 14.205 18.786 462 HG22 VAL 63 1HG2 VAL 63 -3.931 15.084 17.772 463 HG23 VAL 63 2HG2 VAL 63 -3.689 15.557 19.462 464 H THR 64 H THR 64 0.595 15.675 18.394 465 HA THR 64 HA THR 64 1.663 13.176 17.451 466 HB THR 64 HB THR 64 2.804 15.128 19.517 467 HG1 THR 64 1HG THR 64 2.513 15.404 16.733 468 HG21 THR 64 3HG2 THR 64 4.013 12.944 19.304 469 HG22 THR 64 1HG2 THR 64 4.993 14.313 18.673 470 HG23 THR 64 2HG2 THR 64 4.175 13.185 17.531 471 H GLU 65 H GLU 65 0.699 14.664 20.613 472 HA GLU 65 HA GLU 65 1.547 12.612 22.205 473 HB2 GLU 65 2HB GLU 65 0.728 15.034 22.769 474 HB3 GLU 65 1HB GLU 65 -0.928 14.347 22.779 475 HG2 GLU 65 2HG GLU 65 -0.187 14.455 25.063 476 HG3 GLU 65 1HG GLU 65 -0.110 12.714 24.612 477 H GLU 66 H GLU 66 -1.604 13.078 20.622 478 HA GLU 66 HA GLU 66 -1.992 10.238 20.713 479 HB2 GLU 66 2HB GLU 66 -4.364 12.113 21.356 480 HB3 GLU 66 1HB GLU 66 -4.438 10.357 20.957 481 HG2 GLU 66 2HG GLU 66 -2.698 10.158 23.004 482 HG3 GLU 66 1HG GLU 66 -3.432 11.723 23.497 483 H GLY 67 H GLY 67 -4.612 11.345 19.096 484 HA2 GLY 67 2HA GLY 67 -5.023 12.144 17.055 485 HA3 GLY 67 1HA GLY 67 -3.377 12.889 17.035 486 H ARG 68 H ARG 68 -1.587 11.522 16.655 487 HA ARG 68 HA ARG 68 -1.800 9.806 14.465 488 HB2 ARG 68 2HB ARG 68 0.164 11.221 15.282 489 HB3 ARG 68 1HB ARG 68 0.449 9.976 16.553 490 HG2 ARG 68 2HG ARG 68 0.661 8.270 14.525 491 HG3 ARG 68 1HG ARG 68 0.711 9.734 13.487 492 HD2 ARG 68 2HD ARG 68 2.712 8.832 15.640 493 HD3 ARG 68 1HD ARG 68 3.022 9.199 13.910 494 HE ARG 68 HE ARG 68 2.073 11.277 15.937 495 HH11 ARG 68 1HH2 ARG 68 3.907 10.687 12.873 496 HH12 ARG 68 2HH2 ARG 68 4.835 12.039 13.037 497 HH21 ARG 68 1HH1 ARG 68 2.829 13.546 15.361 498 HH22 ARG 68 2HH1 ARG 68 4.108 13.676 14.351 499 H LYS 69 H LYS 69 -1.484 9.189 18.007 500 HA LYS 69 HA LYS 69 -1.249 6.385 17.582 501 HB2 LYS 69 2HB LYS 69 -0.428 7.755 19.650 502 HB3 LYS 69 1HB LYS 69 -2.120 7.651 20.230 503 HG2 LYS 69 2HG LYS 69 -0.840 5.910 21.298 504 HG3 LYS 69 1HG LYS 69 -1.914 5.107 20.113 505 HD2 LYS 69 2HD LYS 69 0.132 5.010 18.495 506 HD3 LYS 69 1HD LYS 69 1.094 5.732 19.811 507 HE2 LYS 69 2HE LYS 69 1.588 3.435 20.035 508 HE3 LYS 69 1HE LYS 69 0.289 3.663 21.272 509 HZ1 LYS 69 3HZ LYS 69 -0.272 1.730 20.077 510 HZ2 LYS 69 1HZ LYS 69 0.205 2.370 18.618 511 HZ3 LYS 69 2HZ LYS 69 -1.272 2.888 19.348 512 H VAL 70 H VAL 70 -3.954 8.544 17.599 513 HA VAL 70 HA VAL 70 -5.894 6.474 18.226 514 HB VAL 70 HB VAL 70 -6.206 9.336 17.174 515 HG11 VAL 70 1HG1 VAL 70 -8.635 9.007 17.625 516 HG12 VAL 70 2HG1 VAL 70 -8.353 7.261 17.989 517 HG13 VAL 70 3HG1 VAL 70 -8.081 7.908 16.328 518 HG21 VAL 70 3HG2 VAL 70 -7.115 9.694 19.519 519 HG22 VAL 70 1HG2 VAL 70 -5.393 9.167 19.544 520 HG23 VAL 70 2HG2 VAL 70 -6.697 7.998 19.931 521 H ALA 71 H ALA 71 -4.713 8.424 15.450 522 HA ALA 71 HA ALA 71 -6.124 7.251 13.437 523 HB1 ALA 71 1HB ALA 71 -4.355 8.079 11.890 524 HB2 ALA 71 2HB ALA 71 -3.218 8.276 13.271 525 HB3 ALA 71 3HB ALA 71 -4.688 9.310 13.164 526 H GLU 72 H GLU 72 -2.952 6.248 14.762 527 HA GLU 72 HA GLU 72 -2.139 4.209 13.274 528 HB2 GLU 72 2HB GLU 72 -0.960 4.912 15.269 529 HB3 GLU 72 1HB GLU 72 -2.375 4.520 16.301 530 HG2 GLU 72 2HG GLU 72 -0.689 2.940 16.764 531 HG3 GLU 72 1HG GLU 72 -1.966 2.040 15.887 532 H GLN 73 H GLN 73 -4.711 3.893 15.774 533 HA GLN 73 HA GLN 73 -4.971 1.096 15.337 534 HB2 GLN 73 2HB GLN 73 -5.591 2.311 17.498 535 HB3 GLN 73 1HB GLN 73 -7.008 3.003 16.638 536 HG2 GLN 73 2HG GLN 73 -7.853 0.612 16.252 537 HG3 GLN 73 1HG GLN 73 -6.430 -0.001 17.169 538 HE21 GLN 73 1HE2 GLN 73 -7.152 -0.591 19.244 539 HE22 GLN 73 2HE2 GLN 73 -8.254 0.330 20.218 540 H VAL 74 H VAL 74 -6.506 3.990 13.993 541 HA VAL 74 HA VAL 74 -8.738 2.662 12.826 542 HB VAL 74 HB VAL 74 -7.433 5.366 12.183 543 HG11 VAL 74 1HG1 VAL 74 -9.664 5.960 11.189 544 HG12 VAL 74 2HG1 VAL 74 -10.219 4.260 11.409 545 HG13 VAL 74 3HG1 VAL 74 -8.865 4.635 10.287 546 HG21 VAL 74 3HG2 VAL 74 -8.189 5.132 14.595 547 HG22 VAL 74 1HG2 VAL 74 -9.828 4.664 14.015 548 HG23 VAL 74 2HG2 VAL 74 -9.170 6.311 13.683 549 H MET 75 H MET 75 -5.540 3.797 11.684 550 HA MET 75 HA MET 75 -5.820 3.062 9.004 551 HB2 MET 75 2HB MET 75 -3.319 3.302 10.788 552 HB3 MET 75 1HB MET 75 -3.261 3.058 9.009 553 HG2 MET 75 2HG MET 75 -4.649 5.132 8.706 554 HG3 MET 75 1HG MET 75 -4.543 5.470 10.445 555 HE1 MET 75 3HE MET 75 -1.368 4.478 10.957 556 HE2 MET 75 1HE MET 75 -2.106 5.932 11.718 557 HE3 MET 75 2HE MET 75 -0.558 6.068 10.825 558 H LYS 76 H LYS 76 -4.475 1.285 11.827 559 HA LYS 76 HA LYS 76 -3.647 -0.945 10.447 560 HB2 LYS 76 2HB LYS 76 -3.194 -0.340 12.904 561 HB3 LYS 76 1HB LYS 76 -4.831 -0.964 13.289 562 HG2 LYS 76 2HG LYS 76 -4.093 -3.230 12.302 563 HG3 LYS 76 1HG LYS 76 -2.462 -2.509 12.052 564 HD2 LYS 76 2HD LYS 76 -2.333 -2.095 14.571 565 HD3 LYS 76 1HD LYS 76 -3.945 -2.863 14.746 566 HE2 LYS 76 2HE LYS 76 -2.194 -4.497 15.333 567 HE3 LYS 76 1HE LYS 76 -3.011 -5.037 13.815 568 HZ1 LYS 76 3HZ LYS 76 -0.568 -5.216 13.807 569 HZ2 LYS 76 1HZ LYS 76 -0.432 -3.520 13.924 570 HZ3 LYS 76 2HZ LYS 76 -1.149 -4.228 12.554 571 H ALA 77 H ALA 77 -6.905 -0.147 11.672 572 HA ALA 77 HA ALA 77 -8.029 -2.710 11.228 573 HB1 ALA 77 1HB ALA 77 -10.242 -1.554 11.361 574 HB2 ALA 77 2HB ALA 77 -9.418 0.046 11.238 575 HB3 ALA 77 3HB ALA 77 -9.154 -0.991 12.687 576 H GLY 78 H GLY 78 -7.598 0.192 9.196 577 HA2 GLY 78 2HA GLY 78 -9.178 -0.701 7.029 578 HA3 GLY 78 1HA GLY 78 -7.873 0.551 7.026 579 H ILE 79 H ILE 79 -5.665 -0.844 7.716 580 HA ILE 79 HA ILE 79 -4.896 -2.131 5.397 581 HB ILE 79 HB ILE 79 -3.727 -2.283 8.218 582 HG12 ILE 79 2HG1 ILE 79 -2.823 -0.634 5.769 583 HG13 ILE 79 1HG1 ILE 79 -3.889 0.025 7.029 584 HG21 ILE 79 1HG2 ILE 79 -2.465 -3.115 5.511 585 HG22 ILE 79 2HG2 ILE 79 -2.882 -4.233 6.864 586 HG23 ILE 79 3HG2 ILE 79 -1.585 -3.021 7.074 587 HD11 ILE 79 3HD ILE 79 -1.002 -0.982 7.463 588 HD12 ILE 79 1HD ILE 79 -1.566 0.714 7.436 589 HD13 ILE 79 2HD ILE 79 -2.098 -0.379 8.771 590 H GLU 80 H GLU 80 -5.945 -3.568 8.567 591 HA GLU 80 HA GLU 80 -5.605 -6.211 7.695 592 HB2 GLU 80 2HB GLU 80 -7.473 -5.070 9.849 593 HB3 GLU 80 1HB GLU 80 -7.374 -6.823 9.464 594 HG2 GLU 80 2HG GLU 80 -4.887 -6.780 9.964 595 HG3 GLU 80 1HG GLU 80 -5.078 -5.092 10.573 596 H VAL 81 H VAL 81 -8.491 -4.042 7.452 597 HA VAL 81 HA VAL 81 -10.185 -6.051 6.447 598 HB VAL 81 HB VAL 81 -10.186 -3.011 6.374 599 HG11 VAL 81 1HG1 VAL 81 -11.319 -3.562 4.268 600 HG12 VAL 81 2HG1 VAL 81 -12.573 -3.164 5.485 601 HG13 VAL 81 3HG1 VAL 81 -12.262 -4.884 5.052 602 HG21 VAL 81 3HG2 VAL 81 -12.092 -3.355 7.956 603 HG22 VAL 81 1HG2 VAL 81 -10.659 -4.273 8.535 604 HG23 VAL 81 2HG2 VAL 81 -12.011 -5.133 7.715 605 H PHE 82 H PHE 82 -8.200 -3.544 4.722 606 HA PHE 82 HA PHE 82 -9.023 -4.471 2.185 607 HB2 PHE 82 2HB PHE 82 -6.567 -2.790 3.015 608 HB3 PHE 82 1HB PHE 82 -6.991 -3.149 1.300 609 HD1 PHE 82 2HD PHE 82 -9.706 -2.763 0.849 610 HD2 PHE 82 1HD PHE 82 -7.196 -0.608 3.600 611 HE1 PHE 82 2HE PHE 82 -11.232 -0.830 0.733 612 HE2 PHE 82 1HE PHE 82 -8.728 1.315 3.492 613 HZ PHE 82 HZ PHE 82 -10.752 1.222 2.057 614 H ALA 83 H ALA 83 -6.368 -5.478 4.339 615 HA ALA 83 HA ALA 83 -5.144 -7.049 2.278 616 HB1 ALA 83 1HB ALA 83 -3.802 -6.246 4.231 617 HB2 ALA 83 2HB ALA 83 -3.774 -8.040 4.114 618 HB3 ALA 83 3HB ALA 83 -4.827 -7.225 5.339 619 H LEU 84 H LEU 84 -7.597 -7.625 4.838 620 HA LEU 84 HA LEU 84 -7.380 -10.376 4.923 621 HB2 LEU 84 2HB LEU 84 -8.545 -9.088 6.649 622 HB3 LEU 84 1HB LEU 84 -9.846 -8.631 5.512 623 HG LEU 84 HG LEU 84 -9.312 -11.595 5.997 624 HD11 LEU 84 1HD1 LEU 84 -10.596 -11.613 8.127 625 HD12 LEU 84 2HD1 LEU 84 -10.679 -9.810 8.113 626 HD13 LEU 84 3HD1 LEU 84 -9.088 -10.642 8.284 627 HD21 LEU 84 3HD2 LEU 84 -11.814 -11.754 5.957 628 HD22 LEU 84 1HD2 LEU 84 -11.206 -10.931 4.482 629 HD23 LEU 84 2HD2 LEU 84 -11.937 -9.961 5.810 630 H VAL 85 H VAL 85 -9.153 -8.301 2.659 631 HA VAL 85 HA VAL 85 -10.774 -10.359 1.681 632 HB VAL 85 HB VAL 85 -11.366 -8.997 -0.178 633 HG11 VAL 85 1HG1 VAL 85 -10.934 -7.155 2.272 634 HG12 VAL 85 2HG1 VAL 85 -12.165 -8.458 2.234 635 HG13 VAL 85 3HG1 VAL 85 -12.257 -7.086 1.070 636 HG21 VAL 85 3HG2 VAL 85 -9.112 -8.145 -0.886 637 HG22 VAL 85 1HG2 VAL 85 -8.996 -7.192 0.630 638 HG23 VAL 85 2HG2 VAL 85 -10.235 -6.775 -0.597 639 H THR 86 H THR 86 -7.384 -10.166 1.408 640 HA THR 86 HA THR 86 -6.903 -11.183 -1.097 641 HB THR 86 HB THR 86 -5.398 -11.879 1.462 642 HG1 THR 86 1HG THR 86 -5.336 -9.738 1.278 643 HG21 THR 86 3HG2 THR 86 -4.693 -13.335 -0.474 644 HG22 THR 86 1HG2 THR 86 -3.446 -12.082 -0.165 645 HG23 THR 86 2HG2 THR 86 -4.581 -11.884 -1.540 646 H ALA 87 H ALA 87 -8.537 -12.693 1.571 647 HA ALA 87 HA ALA 87 -8.297 -15.379 0.798 648 HB1 ALA 87 1HB ALA 87 -10.701 -13.928 2.080 649 HB2 ALA 87 2HB ALA 87 -9.310 -14.632 2.976 650 HB3 ALA 87 3HB ALA 87 -10.428 -15.712 2.068 651 H ALA 88 H ALA 88 -10.001 -12.717 -0.739 652 HA ALA 88 HA ALA 88 -11.728 -14.473 -2.290 653 HB1 ALA 88 1HB ALA 88 -12.471 -12.322 -3.392 654 HB2 ALA 88 2HB ALA 88 -11.254 -11.416 -2.435 655 HB3 ALA 88 3HB ALA 88 -12.637 -12.208 -1.601 656 H LEU 89 H LEU 89 -8.806 -12.456 -2.517 657 HA LEU 89 HA LEU 89 -8.546 -12.363 -5.257 658 HB2 LEU 89 2HB LEU 89 -6.473 -12.270 -2.996 659 HB3 LEU 89 1HB LEU 89 -5.998 -12.108 -4.707 660 HG LEU 89 HG LEU 89 -7.186 -10.120 -5.051 661 HD11 LEU 89 1HD1 LEU 89 -8.494 -8.819 -3.441 662 HD12 LEU 89 2HD1 LEU 89 -8.336 -10.100 -2.222 663 HD13 LEU 89 3HD1 LEU 89 -9.281 -10.394 -3.737 664 HD21 LEU 89 3HD2 LEU 89 -5.991 -8.570 -3.473 665 HD22 LEU 89 1HD2 LEU 89 -4.940 -9.930 -3.950 666 HD23 LEU 89 2HD2 LEU 89 -5.704 -9.914 -2.329 667 H ALA 90 H ALA 90 -7.253 -14.725 -2.920 668 HA ALA 90 HA ALA 90 -5.753 -16.067 -4.889 669 HB1 ALA 90 1HB ALA 90 -5.345 -17.779 -3.125 670 HB2 ALA 90 2HB ALA 90 -6.629 -17.004 -2.108 671 HB3 ALA 90 3HB ALA 90 -5.120 -16.105 -2.502 672 H THR 91 H THR 91 -9.205 -16.406 -4.164 673 HA THR 91 HA THR 91 -9.148 -19.171 -5.054 674 HB THR 91 HB THR 91 -10.911 -19.428 -3.874 675 HG1 THR 91 1HG THR 91 -12.098 -17.718 -5.802 676 HG21 THR 91 3HG2 THR 91 -11.329 -16.393 -3.606 677 HG22 THR 91 1HG2 THR 91 -10.199 -17.364 -2.598 678 HG23 THR 91 2HG2 THR 91 -11.942 -17.699 -2.525 679 H ASP 92 H ASP 92 -9.033 -16.030 -6.514 680 HA ASP 92 HA ASP 92 -10.831 -17.019 -8.603 681 HB2 ASP 92 2HB ASP 92 -10.173 -14.215 -7.796 682 HB3 ASP 92 1HB ASP 92 -11.124 -14.692 -9.252 683 H PHE 93 H PHE 93 -7.768 -17.615 -8.162 684 HA PHE 93 HA PHE 93 -7.407 -17.691 -11.074 685 HB2 PHE 93 2HB PHE 93 -5.284 -18.614 -10.889 686 HB3 PHE 93 1HB PHE 93 -5.320 -17.394 -9.574 687 HD1 PHE 93 2HD PHE 93 -5.272 -21.004 -10.405 688 HD2 PHE 93 1HD PHE 93 -5.331 -18.125 -7.228 689 HE1 PHE 93 2HE PHE 93 -4.688 -22.782 -8.781 690 HE2 PHE 93 1HE PHE 93 -4.698 -19.876 -5.613 691 HZ PHE 93 HZ PHE 93 -4.377 -22.215 -6.381 692 H VAL 94 H VAL 94 -8.628 -19.521 -8.291 693 HA VAL 94 HA VAL 94 -8.351 -22.071 -9.443 694 HB VAL 94 HB VAL 94 -10.254 -21.267 -7.188 695 HG11 VAL 94 1HG1 VAL 94 -10.542 -23.597 -8.038 696 HG12 VAL 94 2HG1 VAL 94 -9.743 -23.636 -6.425 697 HG13 VAL 94 3HG1 VAL 94 -8.774 -23.896 -7.919 698 HG21 VAL 94 3HG2 VAL 94 -8.338 -21.748 -5.643 699 HG22 VAL 94 1HG2 VAL 94 -7.950 -20.345 -6.680 700 HG23 VAL 94 2HG2 VAL 94 -7.246 -21.957 -7.052 701 H ARG 95 H ARG 95 -10.706 -19.521 -9.642 702 HA ARG 95 HA ARG 95 -12.923 -20.863 -10.637 703 HB2 ARG 95 2HB ARG 95 -12.926 -18.468 -10.036 704 HB3 ARG 95 1HB ARG 95 -11.806 -18.090 -11.392 705 HG2 ARG 95 2HG ARG 95 -13.495 -18.652 -13.058 706 HG3 ARG 95 1HG ARG 95 -14.560 -19.388 -11.829 707 HD2 ARG 95 2HD ARG 95 -13.874 -16.380 -12.092 708 HD3 ARG 95 1HD ARG 95 -15.425 -17.171 -12.569 709 HE ARG 95 HE ARG 95 -14.688 -16.241 -9.949 710 HH11 ARG 95 1HH2 ARG 95 -16.342 -19.339 -10.908 711 HH12 ARG 95 2HH2 ARG 95 -17.810 -18.901 -10.353 712 HH21 ARG 95 1HH1 ARG 95 -16.499 -15.843 -8.811 713 HH22 ARG 95 2HH1 ARG 95 -17.913 -16.852 -8.883 714 H ARG 96 H ARG 96 -9.736 -20.396 -12.176 715 HA ARG 96 HA ARG 96 -10.636 -20.489 -14.809 716 HB2 ARG 96 2HB ARG 96 -8.444 -20.792 -15.561 717 HB3 ARG 96 1HB ARG 96 -8.302 -19.785 -14.093 718 HG2 ARG 96 2HG ARG 96 -7.722 -21.922 -12.789 719 HG3 ARG 96 1HG ARG 96 -7.788 -22.814 -14.336 720 HD2 ARG 96 2HD ARG 96 -5.840 -21.494 -15.239 721 HD3 ARG 96 1HD ARG 96 -5.815 -20.511 -13.731 722 HE ARG 96 HE ARG 96 -4.698 -22.226 -12.678 723 HH11 ARG 96 1HH2 ARG 96 -6.015 -23.699 -15.690 724 HH12 ARG 96 2HH2 ARG 96 -5.881 -25.326 -15.149 725 HH21 ARG 96 1HH1 ARG 96 -4.650 -24.499 -11.869 726 HH22 ARG 96 2HH1 ARG 96 -5.254 -25.760 -12.804 727 H GLU 97 H GLU 97 -10.497 -23.015 -12.411 728 HA GLU 97 HA GLU 97 -10.206 -25.183 -14.230 729 HB2 GLU 97 2HB GLU 97 -11.430 -25.212 -11.405 730 HB3 GLU 97 1HB GLU 97 -10.887 -26.629 -12.373 731 HG2 GLU 97 2HG GLU 97 -8.530 -25.497 -12.394 732 HG3 GLU 97 1HG GLU 97 -9.141 -24.415 -11.094 733 H GLU 98 H GLU 98 -12.866 -23.090 -13.262 734 HA GLU 98 HA GLU 98 -14.940 -24.866 -14.186 735 HB2 GLU 98 2HB GLU 98 -15.043 -21.811 -13.745 736 HB3 GLU 98 1HB GLU 98 -16.436 -22.920 -13.955 737 HG2 GLU 98 2HG GLU 98 -15.781 -24.048 -11.743 738 HG3 GLU 98 1HG GLU 98 -14.456 -22.832 -11.575 739 H GLU 99 H GLU 99 -13.086 -22.000 -15.293 740 HA GLU 99 HA GLU 99 -14.418 -21.541 -17.665 741 HB2 GLU 99 2HB GLU 99 -11.417 -21.139 -17.138 742 HB3 GLU 99 1HB GLU 99 -12.359 -20.408 -18.478 743 HG2 GLU 99 2HG GLU 99 -13.712 -19.083 -16.815 744 HG3 GLU 99 1HG GLU 99 -12.710 -19.759 -15.471 745 H ARG 100 H ARG 100 -11.888 -23.897 -16.893 746 HA ARG 100 HA ARG 100 -11.154 -24.452 -19.525 747 HB2 ARG 100 2HB ARG 100 -9.941 -25.081 -17.321 748 HB3 ARG 100 1HB ARG 100 -11.013 -26.521 -17.263 749 HG2 ARG 100 2HG ARG 100 -10.099 -27.242 -19.503 750 HG3 ARG 100 1HG ARG 100 -9.162 -25.720 -19.609 751 HD2 ARG 100 2HD ARG 100 -7.620 -27.544 -18.964 752 HD3 ARG 100 1HD ARG 100 -7.793 -26.374 -17.607 753 HE ARG 100 HE ARG 100 -8.689 -28.062 -16.307 754 HH11 ARG 100 1HH2 ARG 100 -8.815 -29.199 -19.755 755 HH12 ARG 100 2HH2 ARG 100 -9.475 -30.733 -19.330 756 HH21 ARG 100 1HH1 ARG 100 -9.361 -30.213 -15.776 757 HH22 ARG 100 2HH1 ARG 100 -9.625 -31.405 -17.000 758 H ARG 101 H ARG 101 -13.961 -25.431 -17.692 759 HA ARG 101 HA ARG 101 -14.615 -27.634 -19.468 760 HB2 ARG 101 2HB ARG 101 -16.437 -26.269 -17.399 761 HB3 ARG 101 1HB ARG 101 -16.617 -27.902 -18.132 762 HG2 ARG 101 2HG ARG 101 -14.434 -28.560 -16.937 763 HG3 ARG 101 1HG ARG 101 -14.460 -26.946 -16.130 764 HD2 ARG 101 2HD ARG 101 -16.780 -27.528 -15.187 765 HD3 ARG 101 1HD ARG 101 -16.578 -29.185 -15.905 766 HE ARG 101 HE ARG 101 -14.335 -28.422 -14.162 767 HH11 ARG 101 1HH2 ARG 101 -17.754 -29.586 -14.187 768 HH12 ARG 101 2HH2 ARG 101 -17.708 -30.251 -12.610 769 HH21 ARG 101 1HH1 ARG 101 -14.233 -29.592 -11.959 770 HH22 ARG 101 2HH1 ARG 101 -15.678 -30.192 -11.334 771 H GLY 102 H GLY 102 -15.358 -24.192 -18.923 772 HA2 GLY 102 2HA GLY 102 -16.068 -22.706 -20.426 773 HA3 GLY 102 1HA GLY 102 -16.491 -24.033 -21.577 774 H HIS 103 H HIS 103 -17.577 -24.213 -18.294 775 HA HIS 103 HA HIS 103 -20.372 -23.862 -19.165 776 HB2 HIS 103 2HB HIS 103 -20.069 -25.896 -17.848 777 HB3 HIS 103 1HB HIS 103 -19.051 -25.036 -16.648 778 HD1 HIS 103 1HD HIS 103 -20.213 -23.985 -14.627 779 HD2 HIS 103 2HD HIS 103 -22.976 -25.179 -17.613 780 HE1 HIS 103 1HE HIS 103 -22.517 -23.719 -13.683 781 HE2 HIS 103 2HE HIS 103 -24.159 -24.373 -15.454 782 H1 SER 1 H SER 1 0.923 -15.157 -22.161 783 HA SER 1 HA SER 1 -0.880 -13.986 -21.876 784 HB2 SER 1 2HB SER 1 -0.689 -13.800 -24.513 785 HB3 SER 1 1HB SER 1 -2.086 -14.922 -24.557 786 HG SER 1 1HG SER 1 -2.473 -12.592 -24.599 787 H ALA 2 H ALA 2 -1.093 -15.636 -20.164 788 HA ALA 2 HA ALA 2 -2.673 -17.947 -20.692 789 HB1 ALA 2 1HB ALA 2 -1.975 -16.719 -17.965 790 HB2 ALA 2 2HB ALA 2 -0.933 -17.857 -18.881 791 HB3 ALA 2 3HB ALA 2 -2.527 -18.415 -18.274 792 H ASP 3 H ASP 3 -4.484 -18.319 -18.845 793 HA ASP 3 HA ASP 3 -6.757 -16.846 -19.511 794 HB2 ASP 3 2HB ASP 3 -7.663 -18.093 -17.321 795 HB3 ASP 3 1HB ASP 3 -7.234 -19.025 -18.781 796 H HIS 4 H HIS 4 -5.167 -17.123 -16.408 797 HA HIS 4 HA HIS 4 -6.190 -14.942 -15.157 798 HB2 HIS 4 2HB HIS 4 -4.218 -15.125 -13.564 799 HB3 HIS 4 1HB HIS 4 -5.071 -16.653 -13.912 800 HD1 HIS 4 1HD HIS 4 -1.651 -15.011 -14.753 801 HD2 HIS 4 2HD HIS 4 -3.617 -18.740 -15.017 802 HE1 HIS 4 1HE HIS 4 0.022 -16.666 -15.497 803 HE2 HIS 4 2HE HIS 4 -1.148 -18.912 -15.630 804 H GLU 5 H GLU 5 -3.477 -14.851 -17.463 805 HA GLU 5 HA GLU 5 -2.540 -12.297 -16.536 806 HB2 GLU 5 2HB GLU 5 -1.972 -14.035 -18.978 807 HB3 GLU 5 1HB GLU 5 -1.312 -12.378 -18.879 808 HG2 GLU 5 2HG GLU 5 0.266 -12.847 -17.342 809 HG3 GLU 5 1HG GLU 5 -0.816 -13.887 -16.365 810 H ARG 6 H ARG 6 -4.818 -13.458 -19.048 811 HA ARG 6 HA ARG 6 -4.970 -10.873 -20.255 812 HB2 ARG 6 2HB ARG 6 -6.668 -13.403 -20.506 813 HB3 ARG 6 1HB ARG 6 -7.024 -11.881 -21.405 814 HG2 ARG 6 2HG ARG 6 -4.814 -11.858 -22.441 815 HG3 ARG 6 1HG ARG 6 -4.279 -13.303 -21.539 816 HD2 ARG 6 2HD ARG 6 -6.635 -13.254 -23.542 817 HD3 ARG 6 1HD ARG 6 -4.939 -13.735 -23.960 818 HE ARG 6 HE ARG 6 -5.345 -15.358 -21.852 819 HH11 ARG 6 1HH2 ARG 6 -7.651 -14.703 -24.531 820 HH12 ARG 6 2HH2 ARG 6 -7.550 -16.253 -25.250 821 HH21 ARG 6 1HH1 ARG 6 -5.722 -17.717 -22.472 822 HH22 ARG 6 2HH1 ARG 6 -6.703 -18.058 -23.800 823 H GLU 7 H GLU 7 -6.844 -12.617 -17.735 824 HA GLU 7 HA GLU 7 -8.858 -10.666 -17.595 825 HB2 GLU 7 2HB GLU 7 -8.805 -13.112 -16.596 826 HB3 GLU 7 1HB GLU 7 -8.012 -12.340 -15.192 827 HG2 GLU 7 2HG GLU 7 -10.257 -12.368 -14.531 828 HG3 GLU 7 1HG GLU 7 -10.128 -10.709 -15.210 829 H ALA 8 H ALA 8 -5.677 -11.021 -15.968 830 HA ALA 8 HA ALA 8 -5.900 -8.877 -14.203 831 HB1 ALA 8 1HB ALA 8 -3.364 -9.952 -15.601 832 HB2 ALA 8 2HB ALA 8 -4.042 -10.548 -14.040 833 HB3 ALA 8 3HB ALA 8 -3.389 -8.876 -14.159 834 H GLN 9 H GLN 9 -4.650 -9.002 -17.567 835 HA GLN 9 HA GLN 9 -3.827 -6.353 -17.712 836 HB2 GLN 9 2HB GLN 9 -3.190 -8.101 -19.400 837 HB3 GLN 9 1HB GLN 9 -4.896 -8.208 -19.934 838 HG2 GLN 9 2HG GLN 9 -3.590 -6.989 -21.589 839 HG3 GLN 9 1HG GLN 9 -4.738 -5.833 -20.839 840 HE21 GLN 9 1HE2 GLN 9 -3.813 -4.399 -19.073 841 HE22 GLN 9 2HE2 GLN 9 -2.125 -4.042 -19.025 842 H LYS 10 H LYS 10 -6.993 -7.845 -18.192 843 HA LYS 10 HA LYS 10 -8.248 -5.723 -19.487 844 HB2 LYS 10 2HB LYS 10 -8.981 -8.234 -19.119 845 HB3 LYS 10 1HB LYS 10 -9.637 -7.665 -17.556 846 HG2 LYS 10 2HG LYS 10 -10.964 -5.893 -19.020 847 HG3 LYS 10 1HG LYS 10 -10.450 -6.897 -20.423 848 HD2 LYS 10 2HD LYS 10 -11.430 -8.927 -19.054 849 HD3 LYS 10 1HD LYS 10 -12.157 -7.672 -17.990 850 HE2 LYS 10 2HE LYS 10 -13.219 -6.705 -20.230 851 HE3 LYS 10 1HE LYS 10 -12.734 -8.285 -20.971 852 HZ1 LYS 10 3HZ LYS 10 -14.700 -7.680 -18.883 853 HZ2 LYS 10 1HZ LYS 10 -13.919 -9.240 -18.881 854 HZ3 LYS 10 2HZ LYS 10 -14.827 -8.732 -20.214 855 H ALA 11 H ALA 11 -7.748 -6.508 -16.050 856 HA ALA 11 HA ALA 11 -9.520 -4.623 -14.961 857 HB1 ALA 11 1HB ALA 11 -6.937 -5.772 -13.713 858 HB2 ALA 11 2HB ALA 11 -8.556 -6.555 -13.649 859 HB3 ALA 11 3HB ALA 11 -8.287 -4.979 -12.822 860 H GLU 12 H GLU 12 -6.113 -4.433 -16.005 861 HA GLU 12 HA GLU 12 -5.551 -1.950 -14.848 862 HB2 GLU 12 2HB GLU 12 -4.382 -3.127 -17.438 863 HB3 GLU 12 1HB GLU 12 -3.665 -1.808 -16.457 864 HG2 GLU 12 2HG GLU 12 -3.353 -3.394 -14.532 865 HG3 GLU 12 1HG GLU 12 -4.063 -4.731 -15.507 866 H GLU 13 H GLU 13 -7.135 -2.822 -17.945 867 HA GLU 13 HA GLU 13 -7.038 -0.127 -18.910 868 HB2 GLU 13 2HB GLU 13 -8.741 -2.484 -19.857 869 HB3 GLU 13 1HB GLU 13 -8.585 -0.891 -20.686 870 HG2 GLU 13 2HG GLU 13 -6.077 -1.276 -20.872 871 HG3 GLU 13 1HG GLU 13 -6.309 -2.938 -20.215 872 H GLU 14 H GLU 14 -9.207 -1.949 -16.842 873 HA GLU 14 HA GLU 14 -11.443 -0.223 -17.091 874 HB2 GLU 14 2HB GLU 14 -11.693 -2.503 -16.155 875 HB3 GLU 14 1HB GLU 14 -10.540 -2.111 -14.841 876 HG2 GLU 14 2HG GLU 14 -12.754 -2.170 -13.923 877 HG3 GLU 14 1HG GLU 14 -12.174 -0.472 -13.867 878 H LEU 15 H LEU 15 -8.510 -0.294 -15.055 879 HA LEU 15 HA LEU 15 -9.228 1.702 -13.301 880 HB2 LEU 15 2HB LEU 15 -7.162 0.209 -13.163 881 HB3 LEU 15 1HB LEU 15 -6.385 1.219 -14.406 882 HG LEU 15 HG LEU 15 -6.453 3.202 -12.929 883 HD11 LEU 15 1HD1 LEU 15 -7.895 1.378 -10.897 884 HD12 LEU 15 2HD1 LEU 15 -8.507 2.901 -11.640 885 HD13 LEU 15 3HD1 LEU 15 -7.146 2.956 -10.483 886 HD21 LEU 15 3HD2 LEU 15 -4.497 1.656 -12.822 887 HD22 LEU 15 1HD2 LEU 15 -5.269 0.747 -11.474 888 HD23 LEU 15 2HD2 LEU 15 -4.790 2.459 -11.242 889 H GLN 16 H GLN 16 -7.599 1.929 -16.447 890 HA GLN 16 HA GLN 16 -7.059 4.643 -16.503 891 HB2 GLN 16 2HB GLN 16 -7.794 2.776 -18.839 892 HB3 GLN 16 1HB GLN 16 -7.007 4.381 -19.016 893 HG2 GLN 16 2HG GLN 16 -4.998 3.601 -17.807 894 HG3 GLN 16 1HG GLN 16 -5.775 2.019 -17.439 895 HE21 GLN 16 1HE2 GLN 16 -3.644 1.345 -18.576 896 HE22 GLN 16 2HE2 GLN 16 -3.708 1.126 -20.283 897 H LYS 17 H LYS 17 -10.025 2.880 -17.392 898 HA LYS 17 HA LYS 17 -11.378 5.056 -18.565 899 HB2 LYS 17 2HB LYS 17 -11.967 2.620 -18.892 900 HB3 LYS 17 1HB LYS 17 -12.403 2.524 -17.170 901 HG2 LYS 17 2HG LYS 17 -14.155 4.522 -17.900 902 HG3 LYS 17 1HG LYS 17 -13.891 3.779 -19.509 903 HD2 LYS 17 2HD LYS 17 -15.820 2.705 -18.527 904 HD3 LYS 17 1HD LYS 17 -14.463 1.519 -18.420 905 HE2 LYS 17 2HE LYS 17 -14.115 2.263 -15.965 906 HE3 LYS 17 1HE LYS 17 -15.563 3.321 -16.142 907 HZ1 LYS 17 3HZ LYS 17 -16.654 1.577 -15.451 908 HZ2 LYS 17 1HZ LYS 17 -15.336 0.525 -15.651 909 HZ3 LYS 17 2HZ LYS 17 -16.360 0.799 -16.969 910 H VAL 18 H VAL 18 -11.138 3.840 -15.184 911 HA VAL 18 HA VAL 18 -13.208 5.492 -14.183 912 HB VAL 18 HB VAL 18 -10.840 4.192 -12.747 913 HG11 VAL 18 1HG1 VAL 18 -12.262 4.538 -10.665 914 HG12 VAL 18 2HG1 VAL 18 -13.388 5.562 -11.625 915 HG13 VAL 18 3HG1 VAL 18 -11.682 6.085 -11.360 916 HG21 VAL 18 3HG2 VAL 18 -12.580 2.506 -12.074 917 HG22 VAL 18 1HG2 VAL 18 -12.444 2.574 -13.859 918 HG23 VAL 18 2HG2 VAL 18 -13.823 3.381 -13.037 919 H LEU 19 H LEU 19 -9.677 5.916 -14.643 920 HA LEU 19 HA LEU 19 -9.408 8.357 -13.355 921 HB2 LEU 19 2HB LEU 19 -7.972 7.676 -15.989 922 HB3 LEU 19 1HB LEU 19 -7.457 8.833 -14.733 923 HG LEU 19 HG LEU 19 -7.511 5.772 -14.593 924 HD11 LEU 19 1HD1 LEU 19 -5.046 5.973 -14.369 925 HD12 LEU 19 2HD1 LEU 19 -5.170 7.767 -14.479 926 HD13 LEU 19 3HD1 LEU 19 -5.633 6.745 -15.890 927 HD21 LEU 19 3HD2 LEU 19 -6.475 5.900 -12.355 928 HD22 LEU 19 1HD2 LEU 19 -8.142 6.561 -12.329 929 HD23 LEU 19 2HD2 LEU 19 -6.724 7.684 -12.305 930 H GLU 20 H GLU 20 -10.405 7.621 -16.735 931 HA GLU 20 HA GLU 20 -10.538 10.188 -17.726 932 HB2 GLU 20 2HB GLU 20 -12.522 7.909 -18.385 933 HB3 GLU 20 1HB GLU 20 -12.265 9.383 -19.365 934 HG2 GLU 20 2HG GLU 20 -9.944 8.629 -19.927 935 HG3 GLU 20 1HG GLU 20 -10.164 7.177 -18.894 936 H GLU 21 H GLU 21 -13.097 8.302 -16.013 937 HA GLU 21 HA GLU 21 -14.942 10.476 -16.240 938 HB2 GLU 21 2HB GLU 21 -15.650 8.087 -16.178 939 HB3 GLU 21 1HB GLU 21 -15.217 8.007 -14.439 940 HG2 GLU 21 2HG GLU 21 -16.996 9.543 -13.830 941 HG3 GLU 21 1HG GLU 21 -17.174 10.135 -15.524 942 H ALA 22 H ALA 22 -12.727 9.265 -13.705 943 HA ALA 22 HA ALA 22 -13.574 10.940 -11.657 944 HB1 ALA 22 1HB ALA 22 -10.740 9.856 -12.196 945 HB2 ALA 22 2HB ALA 22 -12.031 9.006 -11.275 946 HB3 ALA 22 3HB ALA 22 -11.331 10.537 -10.633 947 H SER 23 H SER 23 -11.435 11.541 -14.410 948 HA SER 23 HA SER 23 -10.212 13.909 -13.564 949 HB2 SER 23 2HB SER 23 -11.174 13.208 -16.427 950 HB3 SER 23 1HB SER 23 -9.929 14.432 -15.987 951 HG SER 23 1HG SER 23 -9.763 11.608 -15.478 952 H LYS 24 H LYS 24 -13.327 13.269 -15.091 953 HA LYS 24 HA LYS 24 -14.060 15.964 -15.598 954 HB2 LYS 24 2HB LYS 24 -14.934 13.782 -16.700 955 HB3 LYS 24 1HB LYS 24 -15.855 13.467 -15.195 956 HG2 LYS 24 2HG LYS 24 -17.051 15.731 -15.585 957 HG3 LYS 24 1HG LYS 24 -16.220 15.784 -17.172 958 HD2 LYS 24 2HD LYS 24 -18.320 13.758 -16.182 959 HD3 LYS 24 1HD LYS 24 -18.445 14.942 -17.525 960 HE2 LYS 24 2HE LYS 24 -16.525 13.590 -18.695 961 HE3 LYS 24 1HE LYS 24 -16.766 12.333 -17.422 962 HZ1 LYS 24 3HZ LYS 24 -18.266 11.506 -18.744 963 HZ2 LYS 24 1HZ LYS 24 -18.281 12.880 -19.767 964 HZ3 LYS 24 2HZ LYS 24 -19.299 12.801 -18.399 965 H LYS 25 H LYS 25 -14.799 13.481 -13.133 966 HA LYS 25 HA LYS 25 -16.461 14.996 -11.518 967 HB2 LYS 25 2HB LYS 25 -14.518 12.696 -10.866 968 HB3 LYS 25 1HB LYS 25 -15.611 13.389 -9.633 969 HG2 LYS 25 2HG LYS 25 -16.720 12.286 -12.267 970 HG3 LYS 25 1HG LYS 25 -16.419 11.237 -10.838 971 HD2 LYS 25 2HD LYS 25 -17.925 12.474 -9.429 972 HD3 LYS 25 1HD LYS 25 -18.014 13.842 -10.586 973 HE2 LYS 25 2HE LYS 25 -19.242 12.407 -12.240 974 HE3 LYS 25 1HE LYS 25 -19.267 11.048 -11.038 975 HZ1 LYS 25 3HZ LYS 25 -20.706 12.182 -9.695 976 HZ2 LYS 25 1HZ LYS 25 -21.192 12.766 -11.225 977 HZ3 LYS 25 2HZ LYS 25 -20.208 13.724 -10.193 978 H ALA 26 H ALA 26 -12.879 14.591 -11.322 979 HA ALA 26 HA ALA 26 -12.556 15.963 -8.979 980 HB1 ALA 26 1HB ALA 26 -10.191 16.237 -9.636 981 HB2 ALA 26 2HB ALA 26 -10.604 15.906 -11.365 982 HB3 ALA 26 3HB ALA 26 -10.762 14.610 -10.125 983 H VAL 27 H VAL 27 -12.507 17.334 -12.342 984 HA VAL 27 HA VAL 27 -12.087 19.949 -11.274 985 HB VAL 27 HB VAL 27 -11.229 19.461 -13.455 986 HG11 VAL 27 1HG1 VAL 27 -12.997 17.862 -14.283 987 HG12 VAL 27 2HG1 VAL 27 -12.664 19.185 -15.450 988 HG13 VAL 27 3HG1 VAL 27 -14.152 19.229 -14.448 989 HG21 VAL 27 3HG2 VAL 27 -12.034 21.537 -14.582 990 HG22 VAL 27 1HG2 VAL 27 -11.786 21.796 -12.815 991 HG23 VAL 27 2HG2 VAL 27 -13.446 21.617 -13.488 992 H GLU 28 H GLU 28 -15.026 18.112 -12.387 993 HA GLU 28 HA GLU 28 -16.601 20.430 -12.289 994 HB2 GLU 28 2HB GLU 28 -17.000 18.012 -13.449 995 HB3 GLU 28 1HB GLU 28 -17.944 17.743 -11.965 996 HG2 GLU 28 2HG GLU 28 -19.662 18.676 -13.163 997 HG3 GLU 28 1HG GLU 28 -18.898 20.258 -12.773 998 H ALA 29 H ALA 29 -15.714 18.040 -9.859 999 HA ALA 29 HA ALA 29 -17.694 18.732 -7.958 1000 HB1 ALA 29 1HB ALA 29 -16.305 17.341 -6.441 1001 HB2 ALA 29 2HB ALA 29 -14.944 17.372 -7.613 1002 HB3 ALA 29 3HB ALA 29 -16.488 16.521 -8.001 1003 H GLU 30 H GLU 30 -14.255 19.684 -8.541 1004 HA GLU 30 HA GLU 30 -14.200 21.468 -6.317 1005 HB2 GLU 30 2HB GLU 30 -12.446 20.954 -8.755 1006 HB3 GLU 30 1HB GLU 30 -12.058 22.279 -7.627 1007 HG2 GLU 30 2HG GLU 30 -12.583 19.532 -6.387 1008 HG3 GLU 30 1HG GLU 30 -11.078 19.727 -7.338 1009 H ARG 31 H ARG 31 -15.403 21.674 -9.581 1010 HA ARG 31 HA ARG 31 -15.063 24.436 -9.942 1011 HB2 ARG 31 2HB ARG 31 -15.351 22.784 -11.834 1012 HB3 ARG 31 1HB ARG 31 -17.045 22.537 -11.308 1013 HG2 ARG 31 2HG ARG 31 -17.157 23.930 -13.188 1014 HG3 ARG 31 1HG ARG 31 -17.409 25.040 -11.803 1015 HD2 ARG 31 2HD ARG 31 -14.858 25.639 -12.021 1016 HD3 ARG 31 1HD ARG 31 -14.875 24.716 -13.585 1017 HE ARG 31 HE ARG 31 -17.036 26.216 -14.008 1018 HH11 ARG 31 1HH2 ARG 31 -13.927 27.740 -13.529 1019 HH12 ARG 31 2HH2 ARG 31 -14.520 29.117 -12.671 1020 HH21 ARG 31 1HH1 ARG 31 -17.932 28.124 -12.806 1021 HH22 ARG 31 2HH1 ARG 31 -16.819 29.434 -12.452 1022 H GLY 32 H GLY 32 -15.894 25.442 -8.042 1023 HA2 GLY 32 2HA GLY 32 -17.764 27.014 -7.894 1024 HA3 GLY 32 1HA GLY 32 -18.856 25.575 -7.953 1025 H ALA 33 H ALA 33 -16.140 24.478 -6.387 1026 HA ALA 33 HA ALA 33 -17.555 24.626 -3.903 1027 HB1 ALA 33 1HB ALA 33 -14.923 23.224 -4.657 1028 HB2 ALA 33 2HB ALA 33 -16.548 22.468 -4.605 1029 HB3 ALA 33 3HB ALA 33 -15.780 23.043 -3.086 1030 HA PRO 34 HA PRO 34 -14.978 27.946 -2.483 1031 HB2 PRO 34 2HB PRO 34 -15.283 27.837 0.271 1032 HB3 PRO 34 1HB PRO 34 -16.656 28.209 -0.838 1033 HG2 PRO 34 2HG PRO 34 -15.979 25.516 0.448 1034 HG3 PRO 34 1HG PRO 34 -17.592 26.339 0.331 1035 HD2 PRO 34 2HD PRO 34 -16.676 24.362 -1.459 1036 HD3 PRO 34 1HD PRO 34 -17.852 25.664 -1.942 1037 H GLY 35 H GLY 35 -12.721 28.234 -2.254 1038 HA2 GLY 35 2HA GLY 35 -10.703 27.938 -1.388 1039 HA3 GLY 35 1HA GLY 35 -11.297 26.563 -0.383 1040 H ALA 36 H ALA 36 -12.301 26.181 -3.575 1041 HA ALA 36 HA ALA 36 -10.892 23.816 -3.807 1042 HB1 ALA 36 1HB ALA 36 -13.079 24.154 -4.895 1043 HB2 ALA 36 2HB ALA 36 -11.850 23.707 -6.115 1044 HB3 ALA 36 3HB ALA 36 -12.385 25.424 -5.966 1045 H ALA 37 H ALA 37 -9.341 23.095 -5.293 1046 HA ALA 37 HA ALA 37 -7.322 25.176 -5.892 1047 HB1 ALA 37 1HB ALA 37 -6.575 23.417 -4.265 1048 HB2 ALA 37 2HB ALA 37 -5.675 23.271 -5.823 1049 HB3 ALA 37 3HB ALA 37 -7.040 22.140 -5.437 1050 H LEU 38 H LEU 38 -9.003 22.196 -7.062 1051 HA LEU 38 HA LEU 38 -7.601 22.434 -9.626 1052 HB2 LEU 38 2HB LEU 38 -7.857 20.157 -8.446 1053 HB3 LEU 38 1HB LEU 38 -9.602 20.303 -8.732 1054 HG LEU 38 HG LEU 38 -9.161 20.426 -11.233 1055 HD11 LEU 38 1HD1 LEU 38 -7.066 19.755 -12.223 1056 HD12 LEU 38 2HD1 LEU 38 -6.334 19.393 -10.620 1057 HD13 LEU 38 3HD1 LEU 38 -6.678 21.104 -11.108 1058 HD21 LEU 38 3HD2 LEU 38 -9.877 18.386 -10.031 1059 HD22 LEU 38 1HD2 LEU 38 -8.163 17.894 -9.798 1060 HD23 LEU 38 2HD2 LEU 38 -8.860 17.984 -11.462 1061 H ILE 39 H ILE 39 -8.901 24.588 -9.738 1062 HA ILE 39 HA ILE 39 -11.617 24.104 -10.776 1063 HB ILE 39 HB ILE 39 -11.796 26.597 -10.698 1064 HG12 ILE 39 2HG1 ILE 39 -9.074 26.427 -9.210 1065 HG13 ILE 39 1HG1 ILE 39 -9.315 27.116 -10.852 1066 HG21 ILE 39 1HG2 ILE 39 -12.123 26.601 -8.235 1067 HG22 ILE 39 2HG2 ILE 39 -11.008 25.202 -8.049 1068 HG23 ILE 39 3HG2 ILE 39 -12.579 24.993 -8.893 1069 HD11 ILE 39 3HD ILE 39 -10.524 28.185 -8.215 1070 HD12 ILE 39 1HD ILE 39 -9.208 28.923 -9.189 1071 HD13 ILE 39 2HD ILE 39 -10.881 28.848 -9.860 1072 H SER 40 H SER 40 -9.091 23.276 -12.200 1073 HA SER 40 HA SER 40 -8.903 25.185 -14.375 1074 HB2 SER 40 2HB SER 40 -7.025 23.568 -15.083 1075 HB3 SER 40 1HB SER 40 -6.779 24.421 -13.530 1076 HG SER 40 1HG SER 40 -6.323 22.192 -13.400 1077 H TYR 41 H TYR 41 -8.345 21.959 -15.204 1078 HA TYR 41 HA TYR 41 -10.485 20.718 -16.010 1079 HB2 TYR 41 2HB TYR 41 -11.726 22.451 -17.083 1080 HB3 TYR 41 1HB TYR 41 -10.277 23.132 -17.867 1081 HD1 TYR 41 2HD TYR 41 -11.689 19.585 -17.866 1082 HD2 TYR 41 1HD TYR 41 -10.730 23.127 -20.117 1083 HE1 TYR 41 2HE TYR 41 -12.298 18.427 -19.948 1084 HE2 TYR 41 1HE TYR 41 -11.352 21.986 -22.199 1085 HH TYR 41 HH TYR 41 -12.008 20.043 -23.155 1086 HA PRO 42 HA PRO 42 -7.612 19.525 -19.304 1087 HB2 PRO 42 2HB PRO 42 -5.340 20.909 -20.201 1088 HB3 PRO 42 1HB PRO 42 -7.012 21.338 -20.725 1089 HG2 PRO 42 2HG PRO 42 -5.401 22.614 -18.431 1090 HG3 PRO 42 1HG PRO 42 -6.247 23.450 -19.799 1091 HD2 PRO 42 2HD PRO 42 -7.456 23.142 -17.341 1092 HD3 PRO 42 1HD PRO 42 -8.408 22.949 -18.882 1093 H ASP 43 H ASP 43 -6.135 20.769 -16.423 1094 HA ASP 43 HA ASP 43 -4.089 18.675 -16.483 1095 HB2 ASP 43 2HB ASP 43 -3.203 19.881 -14.393 1096 HB3 ASP 43 1HB ASP 43 -2.977 20.670 -15.983 1097 H ALA 44 H ALA 44 -7.283 18.792 -15.773 1098 HA ALA 44 HA ALA 44 -7.284 17.690 -13.156 1099 HB1 ALA 44 1HB ALA 44 -9.399 17.373 -15.384 1100 HB2 ALA 44 2HB ALA 44 -9.349 18.701 -14.169 1101 HB3 ALA 44 3HB ALA 44 -9.622 17.007 -13.633 1102 H ILE 45 H ILE 45 -7.151 16.376 -16.455 1103 HA ILE 45 HA ILE 45 -7.428 13.702 -15.728 1104 HB ILE 45 HB ILE 45 -7.928 14.492 -17.953 1105 HG12 ILE 45 2HG1 ILE 45 -5.576 12.507 -18.064 1106 HG13 ILE 45 1HG1 ILE 45 -7.266 12.113 -17.621 1107 HG21 ILE 45 1HG2 ILE 45 -4.911 15.091 -18.277 1108 HG22 ILE 45 2HG2 ILE 45 -6.213 16.326 -18.104 1109 HG23 ILE 45 3HG2 ILE 45 -6.174 15.265 -19.540 1110 HD11 ILE 45 3HD ILE 45 -6.332 13.211 -20.367 1111 HD12 ILE 45 1HD ILE 45 -6.869 11.535 -19.994 1112 HD13 ILE 45 2HD ILE 45 -8.044 12.893 -19.898 1113 H TRP 46 H TRP 46 -4.659 15.814 -15.602 1114 HA TRP 46 HA TRP 46 -2.855 13.549 -15.559 1115 HB2 TRP 46 2HB TRP 46 -2.554 16.117 -16.475 1116 HB3 TRP 46 1HB TRP 46 -1.869 16.320 -14.829 1117 HD1 TRP 46 HD TRP 46 0.629 15.174 -14.550 1118 HE1 TRP 46 1HE TRP 46 2.273 14.348 -16.313 1119 HE3 TRP 46 3HE TRP 46 -2.631 14.480 -18.411 1120 HZ2 TRP 46 2HZ TRP 46 2.149 13.083 -18.887 1121 HZ3 TRP 46 3HZ TRP 46 -1.828 13.396 -20.487 1122 HH2 TRP 46 HH TRP 46 0.537 12.717 -20.721 1123 H TRP 47 H TRP 47 -4.769 15.371 -13.307 1124 HA TRP 47 HA TRP 47 -3.030 14.795 -11.060 1125 HB2 TRP 47 2HB TRP 47 -4.492 16.865 -11.089 1126 HB3 TRP 47 1HB TRP 47 -5.937 15.806 -11.066 1127 HD1 TRP 47 HD TRP 47 -2.661 15.865 -8.780 1128 HE1 TRP 47 1HE TRP 47 -3.461 15.653 -6.327 1129 HE3 TRP 47 3HE TRP 47 -7.685 15.587 -9.597 1130 HZ2 TRP 47 2HZ TRP 47 -5.912 15.597 -4.920 1131 HZ3 TRP 47 3HZ TRP 47 -9.213 15.405 -7.659 1132 HH2 TRP 47 HH TRP 47 -8.340 15.410 -5.359 1133 H SER 48 H SER 48 -6.102 13.626 -12.574 1134 HA SER 48 HA SER 48 -6.474 11.586 -10.666 1135 HB2 SER 48 2HB SER 48 -7.625 11.890 -13.497 1136 HB3 SER 48 1HB SER 48 -8.217 10.744 -12.233 1137 HG SER 48 1HG SER 48 -9.421 12.650 -12.240 1138 H VAL 49 H VAL 49 -4.001 11.099 -11.027 1139 HA VAL 49 HA VAL 49 -3.880 8.602 -12.567 1140 HB VAL 49 HB VAL 49 -1.603 10.678 -12.378 1141 HG11 VAL 49 1HG1 VAL 49 -0.774 8.295 -12.346 1142 HG12 VAL 49 2HG1 VAL 49 -0.410 9.074 -13.922 1143 HG13 VAL 49 3HG1 VAL 49 -1.783 7.919 -13.792 1144 HG21 VAL 49 3HG2 VAL 49 -3.339 11.443 -13.981 1145 HG22 VAL 49 1HG2 VAL 49 -3.373 9.826 -14.766 1146 HG23 VAL 49 2HG2 VAL 49 -1.896 10.858 -14.873 1147 H GLU 50 H GLU 50 -2.018 10.704 -10.225 1148 HA GLU 50 HA GLU 50 -0.793 8.503 -9.101 1149 HB2 GLU 50 2HB GLU 50 0.116 10.025 -7.380 1150 HB3 GLU 50 1HB GLU 50 0.288 10.663 -9.036 1151 HG2 GLU 50 2HG GLU 50 -1.673 12.230 -8.633 1152 HG3 GLU 50 1HG GLU 50 -1.815 11.588 -6.950 1153 H THR 51 H THR 51 -3.902 9.783 -8.422 1154 HA THR 51 HA THR 51 -4.066 8.910 -5.721 1155 HB THR 51 HB THR 51 -5.427 10.737 -6.249 1156 HG1 THR 51 1HG THR 51 -6.561 8.996 -5.146 1157 HG21 THR 51 3HG2 THR 51 -5.397 10.689 -8.707 1158 HG22 THR 51 1HG2 THR 51 -7.098 10.706 -8.165 1159 HG23 THR 51 2HG2 THR 51 -6.374 9.163 -8.739 1160 H ALA 52 H ALA 52 -4.456 7.350 -8.900 1161 HA ALA 52 HA ALA 52 -6.052 5.199 -7.870 1162 HB1 ALA 52 1HB ALA 52 -6.098 5.747 -10.294 1163 HB2 ALA 52 2HB ALA 52 -5.462 4.083 -10.045 1164 HB3 ALA 52 3HB ALA 52 -4.324 5.428 -10.420 1165 H THR 53 H THR 53 -2.583 5.990 -8.068 1166 HA THR 53 HA THR 53 -1.839 3.278 -7.356 1167 HB THR 53 HB THR 53 0.509 4.425 -7.479 1168 HG1 THR 53 1HG THR 53 -0.295 6.556 -7.419 1169 HG21 THR 53 3HG2 THR 53 -0.464 2.900 -9.223 1170 HG22 THR 53 1HG2 THR 53 0.460 4.251 -9.973 1171 HG23 THR 53 2HG2 THR 53 -1.343 4.288 -9.967 1172 H THR 54 H THR 54 -3.358 5.406 -5.584 1173 HA THR 54 HA THR 54 -3.438 6.013 -3.528 1174 HB THR 54 HB THR 54 -2.976 4.305 -1.805 1175 HG1 THR 54 1HG THR 54 -1.103 3.465 -2.936 1176 HG21 THR 54 3HG2 THR 54 -4.234 3.219 -4.434 1177 HG22 THR 54 1HG2 THR 54 -5.053 4.342 -3.294 1178 HG23 THR 54 2HG2 THR 54 -4.598 2.687 -2.754 1179 H VAL 55 H VAL 55 -1.659 7.669 -4.445 1180 HA VAL 55 HA VAL 55 0.093 7.997 -2.148 1181 HB VAL 55 HB VAL 55 1.004 8.924 -4.939 1182 HG11 VAL 55 1HG1 VAL 55 3.245 8.938 -3.791 1183 HG12 VAL 55 2HG1 VAL 55 2.511 8.218 -2.317 1184 HG13 VAL 55 3HG1 VAL 55 2.098 9.896 -2.789 1185 HG21 VAL 55 3HG2 VAL 55 1.566 6.191 -3.633 1186 HG22 VAL 55 1HG2 VAL 55 2.544 6.897 -4.969 1187 HG23 VAL 55 2HG2 VAL 55 0.813 6.502 -5.240 1188 H GLY 56 H GLY 56 0.691 10.642 -3.664 1189 HA2 GLY 56 2HA GLY 56 -1.209 12.257 -4.403 1190 HA3 GLY 56 1HA GLY 56 -1.669 11.922 -2.658 1191 H TYR 57 H TYR 57 0.787 13.241 -4.837 1192 HA TYR 57 HA TYR 57 2.752 13.446 -2.670 1193 HB2 TYR 57 2HB TYR 57 2.739 14.388 -5.607 1194 HB3 TYR 57 1HB TYR 57 4.037 14.882 -4.449 1195 HD1 TYR 57 2HD TYR 57 2.574 11.987 -6.275 1196 HD2 TYR 57 1HD TYR 57 5.692 13.324 -3.632 1197 HE1 TYR 57 2HE TYR 57 3.870 9.960 -6.785 1198 HE2 TYR 57 1HE TYR 57 6.990 11.286 -4.131 1199 HH TYR 57 HH TYR 57 7.208 9.456 -5.706 1200 H GLY 58 H GLY 58 0.096 15.213 -3.900 1201 HA2 GLY 58 2HA GLY 58 -0.816 16.932 -2.669 1202 HA3 GLY 58 1HA GLY 58 0.816 17.451 -2.121 1203 H ASP 59 H ASP 59 -0.455 16.733 -5.428 1204 HA ASP 59 HA ASP 59 0.704 19.170 -6.382 1205 HB2 ASP 59 2HB ASP 59 0.427 17.061 -7.848 1206 HB3 ASP 59 1HB ASP 59 -1.313 17.488 -7.972 1207 H ARG 60 H ARG 60 -2.765 18.001 -6.186 1208 HA ARG 60 HA ARG 60 -3.554 20.837 -5.951 1209 HB2 ARG 60 2HB ARG 60 -5.109 18.429 -7.012 1210 HB3 ARG 60 1HB ARG 60 -5.928 19.914 -6.448 1211 HG2 ARG 60 2HG ARG 60 -5.798 20.304 -8.681 1212 HG3 ARG 60 1HG ARG 60 -4.480 21.294 -7.993 1213 HD2 ARG 60 2HD ARG 60 -2.813 19.490 -8.799 1214 HD3 ARG 60 1HD ARG 60 -4.206 18.602 -9.517 1215 HE ARG 60 HE ARG 60 -4.410 20.255 -11.208 1216 HH11 ARG 60 1HH2 ARG 60 -1.710 21.191 -9.027 1217 HH12 ARG 60 2HH2 ARG 60 -1.620 22.800 -9.560 1218 HH21 ARG 60 1HH1 ARG 60 -3.926 22.258 -12.318 1219 HH22 ARG 60 2HH1 ARG 60 -2.765 23.361 -11.645 1220 H TYR 61 H TYR 61 -6.067 20.501 -4.642 1221 HA TYR 61 HA TYR 61 -5.594 19.085 -2.207 1222 HB2 TYR 61 2HB TYR 61 -4.356 21.200 -1.692 1223 HB3 TYR 61 1HB TYR 61 -5.711 22.171 -2.379 1224 HD1 TYR 61 2HD TYR 61 -5.808 19.215 0.016 1225 HD2 TYR 61 1HD TYR 61 -6.564 23.414 -0.588 1226 HE1 TYR 61 2HE TYR 61 -6.973 19.307 2.130 1227 HE2 TYR 61 1HE TYR 61 -7.673 23.525 1.612 1228 HH TYR 61 HH TYR 61 -8.140 20.536 3.609 1229 HA PRO 62 HA PRO 62 -9.925 19.735 -3.593 1230 HB2 PRO 62 2HB PRO 62 -10.967 17.245 -3.046 1231 HB3 PRO 62 1HB PRO 62 -9.823 17.482 -4.412 1232 HG2 PRO 62 2HG PRO 62 -9.182 16.506 -1.567 1233 HG3 PRO 62 1HG PRO 62 -8.718 15.711 -3.126 1234 HD2 PRO 62 2HD PRO 62 -7.059 17.482 -1.711 1235 HD3 PRO 62 1HD PRO 62 -7.007 17.362 -3.533 1236 H VAL 63 H VAL 63 -11.890 20.147 -2.355 1237 HA VAL 63 HA VAL 63 -11.268 20.452 0.478 1238 HB VAL 63 HB VAL 63 -13.121 22.097 0.539 1239 HG11 VAL 63 1HG1 VAL 63 -10.668 22.624 0.316 1240 HG12 VAL 63 2HG1 VAL 63 -11.678 23.795 -0.620 1241 HG13 VAL 63 3HG1 VAL 63 -10.796 22.488 -1.471 1242 HG21 VAL 63 3HG2 VAL 63 -14.374 21.276 -1.599 1243 HG22 VAL 63 1HG2 VAL 63 -12.966 21.832 -2.557 1244 HG23 VAL 63 2HG2 VAL 63 -13.925 23.021 -1.627 1245 H THR 64 H THR 64 -14.555 20.711 0.374 1246 HA THR 64 HA THR 64 -14.902 17.987 1.371 1247 HB THR 64 HB THR 64 -16.116 20.443 2.728 1248 HG1 THR 64 1HG THR 64 -13.498 19.422 2.967 1249 HG21 THR 64 3HG2 THR 64 -16.794 18.052 3.425 1250 HG22 THR 64 1HG2 THR 64 -16.084 19.042 4.747 1251 HG23 THR 64 2HG2 THR 64 -15.099 17.781 3.940 1252 H GLU 65 H GLU 65 -15.865 20.336 -0.748 1253 HA GLU 65 HA GLU 65 -18.724 19.649 -0.719 1254 HB2 GLU 65 2HB GLU 65 -17.174 22.236 -1.245 1255 HB3 GLU 65 1HB GLU 65 -18.708 21.990 -2.112 1256 HG2 GLU 65 2HG GLU 65 -18.493 21.820 0.960 1257 HG3 GLU 65 1HG GLU 65 -18.896 23.335 0.065 1258 H GLU 66 H GLU 66 -15.836 18.839 -2.096 1259 HA GLU 66 HA GLU 66 -16.781 18.863 -4.841 1260 HB2 GLU 66 2HB GLU 66 -14.603 17.101 -4.719 1261 HB3 GLU 66 1HB GLU 66 -14.537 18.825 -5.180 1262 HG2 GLU 66 2HG GLU 66 -12.771 18.434 -3.676 1263 HG3 GLU 66 1HG GLU 66 -13.940 19.483 -2.842 1264 H GLY 67 H GLY 67 -16.307 17.013 -1.937 1265 HA2 GLY 67 2HA GLY 67 -17.733 15.328 -1.158 1266 HA3 GLY 67 1HA GLY 67 -18.103 14.878 -2.891 1267 H ARG 68 H ARG 68 -15.482 14.979 -0.368 1268 HA ARG 68 HA ARG 68 -13.461 14.349 -2.136 1269 HB2 ARG 68 2HB ARG 68 -13.133 15.291 0.153 1270 HB3 ARG 68 1HB ARG 68 -13.430 13.654 0.849 1271 HG2 ARG 68 2HG ARG 68 -11.391 12.816 -0.338 1272 HG3 ARG 68 1HG ARG 68 -11.190 14.407 -1.151 1273 HD2 ARG 68 2HD ARG 68 -11.081 13.938 1.916 1274 HD3 ARG 68 1HD ARG 68 -9.628 14.047 0.839 1275 HE ARG 68 HE ARG 68 -11.146 16.390 0.297 1276 HH11 ARG 68 1HH2 ARG 68 -9.460 14.922 3.201 1277 HH12 ARG 68 2HH2 ARG 68 -9.604 16.329 4.110 1278 HH21 ARG 68 1HH1 ARG 68 -10.095 18.358 1.191 1279 HH22 ARG 68 2HH1 ARG 68 -9.547 18.369 2.827 1280 H LYS 69 H LYS 69 -15.992 12.510 -1.275 1281 HA LYS 69 HA LYS 69 -15.144 9.891 -1.547 1282 HB2 LYS 69 2HB LYS 69 -17.682 11.100 -2.758 1283 HB3 LYS 69 1HB LYS 69 -17.384 9.399 -2.258 1284 HG2 LYS 69 2HG LYS 69 -17.085 10.291 0.160 1285 HG3 LYS 69 1HG LYS 69 -17.584 11.904 -0.438 1286 HD2 LYS 69 2HD LYS 69 -19.564 11.038 0.507 1287 HD3 LYS 69 1HD LYS 69 -19.760 10.883 -1.265 1288 HE2 LYS 69 2HE LYS 69 -20.620 8.839 -0.232 1289 HE3 LYS 69 1HE LYS 69 -19.078 8.420 -1.072 1290 HZ1 LYS 69 3HZ LYS 69 -18.696 7.439 0.853 1291 HZ2 LYS 69 1HZ LYS 69 -19.725 8.446 1.784 1292 HZ3 LYS 69 2HZ LYS 69 -18.130 8.912 1.369 1293 H VAL 70 H VAL 70 -15.160 12.596 -3.880 1294 HA VAL 70 HA VAL 70 -14.929 11.039 -6.220 1295 HB VAL 70 HB VAL 70 -14.064 13.888 -5.523 1296 HG11 VAL 70 1HG1 VAL 70 -13.841 14.210 -8.036 1297 HG12 VAL 70 2HG1 VAL 70 -13.929 12.417 -8.246 1298 HG13 VAL 70 3HG1 VAL 70 -12.556 13.163 -7.347 1299 HG21 VAL 70 3HG2 VAL 70 -16.531 13.445 -5.562 1300 HG22 VAL 70 1HG2 VAL 70 -16.392 12.701 -7.198 1301 HG23 VAL 70 2HG2 VAL 70 -16.050 14.457 -6.956 1302 H ALA 71 H ALA 71 -12.481 12.365 -3.903 1303 HA ALA 71 HA ALA 71 -10.273 11.382 -5.419 1304 HB1 ALA 71 1HB ALA 71 -9.977 13.234 -3.727 1305 HB2 ALA 71 2HB ALA 71 -8.921 11.823 -3.359 1306 HB3 ALA 71 3HB ALA 71 -10.433 12.088 -2.414 1307 H GLU 72 H GLU 72 -12.147 10.260 -2.599 1308 HA GLU 72 HA GLU 72 -10.835 7.923 -1.982 1309 HB2 GLU 72 2HB GLU 72 -12.846 8.977 -0.715 1310 HB3 GLU 72 1HB GLU 72 -13.885 8.329 -2.024 1311 HG2 GLU 72 2HG GLU 72 -12.948 5.966 -1.356 1312 HG3 GLU 72 1HG GLU 72 -12.361 6.766 0.140 1313 H GLN 73 H GLN 73 -13.372 8.510 -4.470 1314 HA GLN 73 HA GLN 73 -13.870 5.852 -4.985 1315 HB2 GLN 73 2HB GLN 73 -15.380 7.691 -5.562 1316 HB3 GLN 73 1HB GLN 73 -14.277 8.249 -6.865 1317 HG2 GLN 73 2HG GLN 73 -14.744 6.203 -8.176 1318 HG3 GLN 73 1HG GLN 73 -15.563 5.438 -6.760 1319 HE21 GLN 73 1HE2 GLN 73 -17.068 5.430 -8.970 1320 HE22 GLN 73 2HE2 GLN 73 -18.365 6.573 -8.836 1321 H VAL 74 H VAL 74 -11.365 7.991 -6.376 1322 HA VAL 74 HA VAL 74 -10.668 6.075 -8.394 1323 HB VAL 74 HB VAL 74 -8.685 8.166 -7.426 1324 HG11 VAL 74 1HG1 VAL 74 -8.172 8.203 -9.881 1325 HG12 VAL 74 2HG1 VAL 74 -9.515 7.044 -10.200 1326 HG13 VAL 74 3HG1 VAL 74 -8.083 6.526 -9.236 1327 HG21 VAL 74 3HG2 VAL 74 -11.299 8.744 -8.957 1328 HG22 VAL 74 1HG2 VAL 74 -9.846 9.821 -8.975 1329 HG23 VAL 74 2HG2 VAL 74 -10.683 9.499 -7.433 1330 H MET 75 H MET 75 -9.538 7.050 -5.172 1331 HA MET 75 HA MET 75 -7.269 5.580 -4.882 1332 HB2 MET 75 2HB MET 75 -8.810 7.241 -3.281 1333 HB3 MET 75 1HB MET 75 -9.181 5.701 -2.495 1334 HG2 MET 75 2HG MET 75 -7.386 6.617 -1.274 1335 HG3 MET 75 1HG MET 75 -6.662 5.310 -2.248 1336 HE1 MET 75 3HE MET 75 -6.222 9.945 -2.919 1337 HE2 MET 75 1HE MET 75 -7.246 9.132 -1.693 1338 HE3 MET 75 2HE MET 75 -7.737 9.122 -3.417 1339 H LYS 76 H LYS 76 -10.605 4.652 -3.971 1340 HA LYS 76 HA LYS 76 -9.922 2.046 -3.169 1341 HB2 LYS 76 2HB LYS 76 -11.971 3.367 -2.440 1342 HB3 LYS 76 1HB LYS 76 -12.699 3.054 -4.048 1343 HG2 LYS 76 2HG LYS 76 -12.718 0.596 -3.580 1344 HG3 LYS 76 1HG LYS 76 -11.768 0.867 -2.080 1345 HD2 LYS 76 2HD LYS 76 -13.665 2.309 -1.197 1346 HD3 LYS 76 1HD LYS 76 -14.673 1.799 -2.586 1347 HE2 LYS 76 2HE LYS 76 -13.358 -0.160 -0.555 1348 HE3 LYS 76 1HE LYS 76 -15.013 0.528 -0.352 1349 HZ1 LYS 76 3HZ LYS 76 -15.001 -1.674 -1.265 1350 HZ2 LYS 76 1HZ LYS 76 -14.189 -1.189 -2.693 1351 HZ3 LYS 76 2HZ LYS 76 -15.722 -0.581 -2.338 1352 H ALA 77 H ALA 77 -10.969 3.415 -6.297 1353 HA ALA 77 HA ALA 77 -11.630 0.989 -7.550 1354 HB1 ALA 77 1HB ALA 77 -10.386 3.501 -8.862 1355 HB2 ALA 77 2HB ALA 77 -12.146 3.245 -8.623 1356 HB3 ALA 77 3HB ALA 77 -11.231 2.163 -9.724 1357 H GLY 78 H GLY 78 -8.553 2.725 -7.116 1358 HA2 GLY 78 2HA GLY 78 -6.959 1.185 -8.813 1359 HA3 GLY 78 1HA GLY 78 -6.451 2.145 -7.371 1360 H ILE 79 H ILE 79 -7.730 0.836 -5.323 1361 HA ILE 79 HA ILE 79 -6.001 -1.284 -4.837 1362 HB ILE 79 HB ILE 79 -8.672 -0.646 -3.488 1363 HG12 ILE 79 2HG1 ILE 79 -5.784 0.184 -2.752 1364 HG13 ILE 79 1HG1 ILE 79 -6.994 1.262 -3.499 1365 HG21 ILE 79 1HG2 ILE 79 -7.883 -2.987 -2.959 1366 HG22 ILE 79 2HG2 ILE 79 -7.728 -1.928 -1.528 1367 HG23 ILE 79 3HG2 ILE 79 -6.267 -2.336 -2.498 1368 HD11 ILE 79 3HD ILE 79 -7.176 0.003 -0.688 1369 HD12 ILE 79 1HD ILE 79 -6.919 1.727 -1.109 1370 HD13 ILE 79 2HD ILE 79 -8.503 0.944 -1.471 1371 H GLU 80 H GLU 80 -9.399 -1.244 -6.022 1372 HA GLU 80 HA GLU 80 -9.632 -4.039 -5.723 1373 HB2 GLU 80 2HB GLU 80 -11.404 -2.084 -7.254 1374 HB3 GLU 80 1HB GLU 80 -11.807 -3.804 -6.903 1375 HG2 GLU 80 2HG GLU 80 -11.550 -3.356 -4.430 1376 HG3 GLU 80 1HG GLU 80 -11.227 -1.627 -4.773 1377 H VAL 81 H VAL 81 -8.525 -2.080 -8.500 1378 HA VAL 81 HA VAL 81 -8.684 -4.374 -10.232 1379 HB VAL 81 HB VAL 81 -7.369 -3.068 -11.857 1380 HG11 VAL 81 1HG1 VAL 81 -9.217 -1.458 -12.305 1381 HG12 VAL 81 2HG1 VAL 81 -9.821 -1.628 -10.616 1382 HG13 VAL 81 3HG1 VAL 81 -9.888 -3.033 -11.747 1383 HG21 VAL 81 3HG2 VAL 81 -6.011 -1.645 -10.260 1384 HG22 VAL 81 1HG2 VAL 81 -7.526 -0.834 -9.716 1385 HG23 VAL 81 2HG2 VAL 81 -6.956 -0.653 -11.397 1386 H PHE 82 H PHE 82 -6.087 -2.783 -8.265 1387 HA PHE 82 HA PHE 82 -4.092 -4.503 -9.282 1388 HB2 PHE 82 2HB PHE 82 -4.144 -2.883 -6.657 1389 HB3 PHE 82 1HB PHE 82 -2.697 -3.762 -7.280 1390 HD1 PHE 82 1HD PHE 82 -2.669 -3.168 -10.186 1391 HD2 PHE 82 2HD PHE 82 -3.600 -0.623 -6.838 1392 HE1 PHE 82 1HE PHE 82 -2.009 -1.197 -11.497 1393 HE2 PHE 82 2HE PHE 82 -2.927 1.343 -8.153 1394 HZ PHE 82 HZ PHE 82 -2.135 1.075 -10.491 1395 H ALA 83 H ALA 83 -6.262 -4.704 -6.458 1396 HA ALA 83 HA ALA 83 -5.168 -6.958 -5.292 1397 HB1 ALA 83 1HB ALA 83 -8.143 -6.137 -5.564 1398 HB2 ALA 83 2HB ALA 83 -7.018 -5.619 -4.255 1399 HB3 ALA 83 3HB ALA 83 -7.501 -7.339 -4.384 1400 H LEU 84 H LEU 84 -7.492 -6.687 -8.021 1401 HA LEU 84 HA LEU 84 -8.051 -9.435 -8.172 1402 HB2 LEU 84 2HB LEU 84 -9.362 -7.502 -9.317 1403 HB3 LEU 84 1HB LEU 84 -8.046 -7.458 -10.527 1404 HG LEU 84 HG LEU 84 -8.570 -10.013 -10.914 1405 HD11 LEU 84 1HD1 LEU 84 -10.893 -10.735 -10.417 1406 HD12 LEU 84 2HD1 LEU 84 -11.194 -9.215 -9.502 1407 HD13 LEU 84 3HD1 LEU 84 -9.982 -10.407 -8.903 1408 HD21 LEU 84 3HD2 LEU 84 -10.557 -7.850 -11.805 1409 HD22 LEU 84 1HD2 LEU 84 -10.413 -9.497 -12.516 1410 HD23 LEU 84 2HD2 LEU 84 -9.029 -8.356 -12.617 1411 H VAL 85 H VAL 85 -5.370 -7.489 -9.450 1412 HA VAL 85 HA VAL 85 -4.521 -9.266 -11.444 1413 HB VAL 85 HB VAL 85 -2.994 -7.153 -9.862 1414 HG11 VAL 85 1HG1 VAL 85 -2.063 -8.781 -12.324 1415 HG12 VAL 85 2HG1 VAL 85 -1.296 -8.737 -10.692 1416 HG13 VAL 85 3HG1 VAL 85 -1.281 -7.270 -11.724 1417 HG21 VAL 85 3HG2 VAL 85 -4.895 -6.359 -11.361 1418 HG22 VAL 85 1HG2 VAL 85 -4.140 -7.199 -12.750 1419 HG23 VAL 85 2HG2 VAL 85 -3.294 -5.822 -11.959 1420 H THR 86 H THR 86 -4.155 -9.330 -7.897 1421 HA THR 86 HA THR 86 -2.047 -11.090 -7.878 1422 HB THR 86 HB THR 86 -4.137 -10.773 -5.712 1423 HG1 THR 86 1HG THR 86 -2.747 -8.991 -5.123 1424 HG21 THR 86 3HG2 THR 86 -1.062 -11.288 -5.688 1425 HG22 THR 86 1HG2 THR 86 -2.315 -12.516 -5.290 1426 HG23 THR 86 2HG2 THR 86 -2.102 -11.082 -4.236 1427 H ALA 87 H ALA 87 -5.132 -11.784 -9.145 1428 HA ALA 87 HA ALA 87 -5.237 -14.539 -8.428 1429 HB1 ALA 87 1HB ALA 87 -7.172 -13.407 -9.533 1430 HB2 ALA 87 2HB ALA 87 -6.630 -14.823 -10.498 1431 HB3 ALA 87 3HB ALA 87 -6.186 -13.146 -11.012 1432 H ALA 88 H ALA 88 -3.378 -12.662 -10.830 1433 HA ALA 88 HA ALA 88 -2.425 -14.999 -12.236 1434 HB1 ALA 88 1HB ALA 88 -0.840 -13.363 -13.351 1435 HB2 ALA 88 2HB ALA 88 -1.406 -12.084 -12.222 1436 HB3 ALA 88 3HB ALA 88 -2.547 -12.771 -13.431 1437 H LEU 89 H LEU 89 -1.648 -13.228 -9.350 1438 HA LEU 89 HA LEU 89 0.987 -14.534 -9.166 1439 HB2 LEU 89 2HB LEU 89 -0.094 -12.141 -7.591 1440 HB3 LEU 89 1HB LEU 89 1.573 -12.795 -7.563 1441 HG LEU 89 HG LEU 89 0.199 -11.550 -10.045 1442 HD11 LEU 89 1HD1 LEU 89 0.498 -9.859 -8.250 1443 HD12 LEU 89 2HD1 LEU 89 1.567 -9.537 -9.664 1444 HD13 LEU 89 3HD1 LEU 89 2.252 -10.259 -8.164 1445 HD21 LEU 89 3HD2 LEU 89 2.532 -11.444 -10.992 1446 HD22 LEU 89 1HD2 LEU 89 2.005 -13.138 -10.695 1447 HD23 LEU 89 2HD2 LEU 89 3.148 -12.342 -9.554 1448 H ALA 90 H ALA 90 -1.865 -15.609 -8.695 1449 HA ALA 90 HA ALA 90 -1.184 -16.615 -5.992 1450 HB1 ALA 90 1HB ALA 90 -3.621 -17.234 -5.768 1451 HB2 ALA 90 2HB ALA 90 -3.951 -16.383 -7.334 1452 HB3 ALA 90 3HB ALA 90 -3.383 -15.455 -5.901 1453 H THR 91 H THR 91 -1.214 -17.199 -9.327 1454 HA THR 91 HA THR 91 -1.709 -20.069 -8.927 1455 HB THR 91 HB THR 91 -3.069 -19.026 -10.645 1456 HG1 THR 91 1HG THR 91 -1.042 -20.772 -11.487 1457 HG21 THR 91 3HG2 THR 91 -1.637 -17.126 -11.278 1458 HG22 THR 91 1HG2 THR 91 -2.038 -18.105 -12.715 1459 HG23 THR 91 2HG2 THR 91 -0.394 -18.223 -11.986 1460 H ASP 92 H ASP 92 0.777 -17.985 -8.435 1461 HA ASP 92 HA ASP 92 2.755 -19.043 -10.179 1462 HB2 ASP 92 2HB ASP 92 4.338 -17.704 -8.678 1463 HB3 ASP 92 1HB ASP 92 3.126 -16.792 -9.635 1464 H PHE 93 H PHE 93 1.951 -19.325 -6.708 1465 HA PHE 93 HA PHE 93 3.881 -21.253 -6.235 1466 HB2 PHE 93 2HB PHE 93 3.047 -21.768 -4.151 1467 HB3 PHE 93 1HB PHE 93 2.553 -20.058 -4.407 1468 HD1 PHE 93 2HD PHE 93 0.063 -19.763 -5.363 1469 HD2 PHE 93 1HD PHE 93 1.507 -23.297 -3.376 1470 HE1 PHE 93 2HE PHE 93 -2.253 -20.393 -4.784 1471 HE2 PHE 93 1HE PHE 93 -0.807 -23.917 -2.792 1472 HZ PHE 93 HZ PHE 93 -2.700 -22.464 -3.490 1473 H VAL 94 H VAL 94 0.851 -21.702 -7.867 1474 HA VAL 94 HA VAL 94 0.685 -24.506 -7.493 1475 HB VAL 94 HB VAL 94 -0.604 -22.799 -9.684 1476 HG11 VAL 94 1HG1 VAL 94 -0.799 -25.276 -10.086 1477 HG12 VAL 94 2HG1 VAL 94 -2.380 -24.598 -9.564 1478 HG13 VAL 94 3HG1 VAL 94 -1.363 -25.519 -8.394 1479 HG21 VAL 94 3HG2 VAL 94 -2.510 -22.738 -7.971 1480 HG22 VAL 94 1HG2 VAL 94 -1.099 -21.759 -7.488 1481 HG23 VAL 94 2HG2 VAL 94 -1.374 -23.371 -6.736 1482 H ARG 95 H ARG 95 2.421 -22.407 -9.740 1483 HA ARG 95 HA ARG 95 3.006 -24.481 -11.661 1484 HB2 ARG 95 2HB ARG 95 4.034 -21.648 -11.140 1485 HB3 ARG 95 1HB ARG 95 5.044 -22.768 -12.097 1486 HG2 ARG 95 2HG ARG 95 3.751 -21.431 -13.622 1487 HG3 ARG 95 1HG ARG 95 3.317 -23.166 -13.716 1488 HD2 ARG 95 2HD ARG 95 1.315 -22.193 -11.961 1489 HD3 ARG 95 1HD ARG 95 1.657 -20.734 -12.948 1490 HE ARG 95 HE ARG 95 0.827 -21.846 -14.868 1491 HH11 ARG 95 1HH2 ARG 95 1.102 -24.278 -12.183 1492 HH12 ARG 95 2HH2 ARG 95 0.741 -25.600 -13.214 1493 HH21 ARG 95 1HH1 ARG 95 0.161 -23.720 -16.145 1494 HH22 ARG 95 2HH1 ARG 95 -0.161 -25.208 -15.403 1495 H ARG 96 H ARG 96 4.209 -23.528 -8.504 1496 HA ARG 96 HA ARG 96 6.780 -24.572 -8.907 1497 HB2 ARG 96 2HB ARG 96 6.112 -22.860 -7.141 1498 HB3 ARG 96 1HB ARG 96 5.470 -24.232 -6.168 1499 HG2 ARG 96 2HG ARG 96 7.760 -25.276 -6.188 1500 HG3 ARG 96 1HG ARG 96 8.352 -23.995 -7.281 1501 HD2 ARG 96 2HD ARG 96 9.198 -23.581 -5.053 1502 HD3 ARG 96 1HD ARG 96 7.998 -22.288 -5.439 1503 HE ARG 96 HE ARG 96 6.408 -23.322 -3.950 1504 HH11 ARG 96 1HH2 ARG 96 9.659 -25.148 -3.799 1505 HH12 ARG 96 2HH2 ARG 96 9.193 -25.935 -2.380 1506 HH21 ARG 96 1HH1 ARG 96 6.058 -24.306 -1.814 1507 HH22 ARG 96 2HH1 ARG 96 7.174 -25.506 -1.283 1508 H GLU 97 H GLU 97 3.732 -26.183 -8.311 1509 HA GLU 97 HA GLU 97 4.868 -28.435 -6.979 1510 HB2 GLU 97 2HB GLU 97 2.485 -27.778 -6.787 1511 HB3 GLU 97 1HB GLU 97 2.195 -28.268 -8.485 1512 HG2 GLU 97 2HG GLU 97 2.380 -30.584 -7.980 1513 HG3 GLU 97 1HG GLU 97 3.451 -30.304 -6.563 1514 H GLU 98 H GLU 98 4.085 -27.664 -10.408 1515 HA GLU 98 HA GLU 98 5.240 -30.207 -11.243 1516 HB2 GLU 98 2HB GLU 98 4.431 -29.362 -13.560 1517 HB3 GLU 98 1HB GLU 98 3.255 -29.912 -12.336 1518 HG2 GLU 98 2HG GLU 98 2.749 -27.509 -11.701 1519 HG3 GLU 98 1HG GLU 98 3.818 -26.964 -13.051 1520 H GLU 99 H GLU 99 6.479 -27.324 -10.337 1521 HA GLU 99 HA GLU 99 8.611 -27.187 -12.299 1522 HB2 GLU 99 2HB GLU 99 7.875 -25.150 -10.975 1523 HB3 GLU 99 1HB GLU 99 8.422 -25.939 -9.463 1524 HG2 GLU 99 2HG GLU 99 10.312 -25.331 -11.829 1525 HG3 GLU 99 1HG GLU 99 9.918 -24.141 -10.544 1526 H ARG 100 H ARG 100 8.122 -28.057 -8.837 1527 HA ARG 100 HA ARG 100 10.593 -29.160 -8.471 1528 HB2 ARG 100 2HB ARG 100 8.518 -28.562 -6.928 1529 HB3 ARG 100 1HB ARG 100 8.137 -30.294 -7.006 1530 HG2 ARG 100 2HG ARG 100 10.484 -30.814 -6.135 1531 HG3 ARG 100 1HG ARG 100 10.816 -29.050 -6.075 1532 HD2 ARG 100 2HD ARG 100 8.749 -30.641 -4.458 1533 HD3 ARG 100 1HD ARG 100 10.172 -29.727 -3.803 1534 HE ARG 100 HE ARG 100 8.948 -27.731 -5.095 1535 HH11 ARG 100 1HH2 ARG 100 7.432 -30.153 -2.863 1536 HH12 ARG 100 2HH2 ARG 100 5.841 -29.513 -3.037 1537 HH21 ARG 100 1HH1 ARG 100 6.685 -27.077 -5.489 1538 HH22 ARG 100 2HH1 ARG 100 5.403 -27.722 -4.520 1539 H ARG 101 H ARG 101 7.493 -30.828 -9.259 1540 HA ARG 101 HA ARG 101 8.968 -33.341 -9.670 1541 HB2 ARG 101 2HB ARG 101 5.965 -32.665 -9.607 1542 HB3 ARG 101 1HB ARG 101 6.601 -34.247 -10.167 1543 HG2 ARG 101 2HG ARG 101 7.674 -34.644 -7.981 1544 HG3 ARG 101 1HG ARG 101 7.002 -33.101 -7.338 1545 HD2 ARG 101 2HD ARG 101 4.700 -33.913 -7.499 1546 HD3 ARG 101 1HD ARG 101 5.198 -35.359 -8.475 1547 HE ARG 101 HE ARG 101 6.694 -35.752 -6.249 1548 HH11 ARG 101 1HH2 ARG 101 3.122 -35.159 -6.701 1549 HH12 ARG 101 2HH2 ARG 101 2.674 -35.958 -5.294 1550 HH21 ARG 101 1HH1 ARG 101 5.964 -37.013 -4.337 1551 HH22 ARG 101 2HH1 ARG 101 4.359 -36.754 -3.729 1552 H GLY 102 H GLY 102 9.819 -33.540 -11.729 1553 HA2 GLY 102 2HA GLY 102 9.003 -34.207 -13.864 1554 HA3 GLY 102 1HA GLY 102 8.049 -32.680 -13.949 1555 H HIS 103 H HIS 103 10.315 -31.198 -12.596 1556 HA HIS 103 HA HIS 103 11.769 -30.619 -15.042 1557 HB2 HIS 103 2HB HIS 103 10.981 -28.770 -13.527 1558 HB3 HIS 103 1HB HIS 103 11.990 -29.463 -12.210 1559 HD1 HIS 103 1HD HIS 103 13.501 -28.846 -15.705 1560 HD2 HIS 103 2HD HIS 103 13.160 -26.997 -11.949 1561 HE1 HIS 103 1HE HIS 103 15.164 -27.012 -15.652 1562 HE2 HIS 103 2HE HIS 103 14.864 -25.800 -13.465 1563 H1 SER 1 H SER 1 16.938 -20.520 -2.850 1564 HA SER 1 HA SER 1 17.257 -21.244 -0.113 1565 HB2 SER 1 2HB SER 1 18.312 -18.858 -0.476 1566 HB3 SER 1 1HB SER 1 16.631 -18.293 -0.749 1567 HG SER 1 1HG SER 1 16.279 -18.436 1.329 1568 H ALA 2 H ALA 2 15.503 -22.397 0.070 1569 HA ALA 2 HA ALA 2 13.505 -23.167 -0.012 1570 HB1 ALA 2 1HB ALA 2 13.298 -21.401 1.734 1571 HB2 ALA 2 2HB ALA 2 11.735 -21.737 0.921 1572 HB3 ALA 2 3HB ALA 2 12.682 -20.261 0.487 1573 H ASP 3 H ASP 3 14.434 -22.206 -2.717 1574 HA ASP 3 HA ASP 3 13.794 -22.083 -4.802 1575 HB2 ASP 3 2HB ASP 3 10.945 -22.861 -3.865 1576 HB3 ASP 3 1HB ASP 3 11.476 -22.711 -5.584 1577 H HIS 4 H HIS 4 10.931 -21.205 -3.110 1578 HA HIS 4 HA HIS 4 9.935 -19.237 -4.823 1579 HB2 HIS 4 2HB HIS 4 8.216 -18.836 -3.117 1580 HB3 HIS 4 1HB HIS 4 8.509 -20.589 -3.218 1581 HD1 HIS 4 1HD HIS 4 9.284 -17.615 -0.873 1582 HD2 HIS 4 2HD HIS 4 9.058 -21.819 -0.732 1583 HE1 HIS 4 1HE HIS 4 9.395 -18.288 1.554 1584 HE2 HIS 4 2HE HIS 4 9.166 -20.751 1.657 1585 H GLU 5 H GLU 5 12.022 -19.121 -1.958 1586 HA GLU 5 HA GLU 5 11.543 -16.330 -1.490 1587 HB2 GLU 5 2HB GLU 5 12.166 -17.925 0.382 1588 HB3 GLU 5 1HB GLU 5 13.772 -18.147 -0.383 1589 HG2 GLU 5 2HG GLU 5 14.282 -15.710 -0.042 1590 HG3 GLU 5 1HG GLU 5 12.653 -15.479 0.694 1591 H ARG 6 H ARG 6 13.905 -18.406 -3.142 1592 HA ARG 6 HA ARG 6 15.808 -16.442 -3.575 1593 HB2 ARG 6 2HB ARG 6 15.958 -18.999 -3.734 1594 HB3 ARG 6 1HB ARG 6 15.283 -18.882 -5.388 1595 HG2 ARG 6 2HG ARG 6 17.745 -17.267 -4.503 1596 HG3 ARG 6 1HG ARG 6 17.906 -19.011 -4.895 1597 HD2 ARG 6 2HD ARG 6 17.217 -18.711 -7.201 1598 HD3 ARG 6 1HD ARG 6 16.746 -16.993 -6.954 1599 HE ARG 6 HE ARG 6 19.497 -18.179 -6.906 1600 HH11 ARG 6 1HH2 ARG 6 17.458 -15.168 -6.651 1601 HH12 ARG 6 2HH2 ARG 6 18.790 -14.114 -6.969 1602 HH21 ARG 6 1HH1 ARG 6 21.301 -16.628 -6.574 1603 HH22 ARG 6 2HH1 ARG 6 20.969 -14.965 -6.467 1604 H GLU 7 H GLU 7 12.889 -17.317 -5.385 1605 HA GLU 7 HA GLU 7 13.462 -15.737 -7.661 1606 HB2 GLU 7 2HB GLU 7 11.717 -17.692 -7.340 1607 HB3 GLU 7 1HB GLU 7 10.630 -16.428 -6.705 1608 HG2 GLU 7 2HG GLU 7 10.029 -15.924 -8.855 1609 HG3 GLU 7 1HG GLU 7 11.703 -15.348 -9.165 1610 H ALA 8 H ALA 8 11.563 -15.227 -4.645 1611 HA ALA 8 HA ALA 8 10.669 -12.644 -5.199 1612 HB1 ALA 8 1HB ALA 8 10.334 -12.451 -2.704 1613 HB2 ALA 8 2HB ALA 8 11.313 -13.940 -2.466 1614 HB3 ALA 8 3HB ALA 8 9.729 -14.028 -3.327 1615 H GLN 9 H GLN 9 13.612 -13.812 -3.560 1616 HA GLN 9 HA GLN 9 14.552 -11.299 -2.772 1617 HB2 GLN 9 2HB GLN 9 15.085 -13.659 -1.890 1618 HB3 GLN 9 1HB GLN 9 16.188 -13.855 -3.287 1619 HG2 GLN 9 2HG GLN 9 17.630 -12.008 -2.358 1620 HG3 GLN 9 1HG GLN 9 16.420 -11.721 -1.042 1621 HE21 GLN 9 1HE2 GLN 9 17.798 -12.476 0.776 1622 HE22 GLN 9 2HE2 GLN 9 18.149 -14.153 0.953 1623 H LYS 10 H LYS 10 14.781 -13.072 -5.810 1624 HA LYS 10 HA LYS 10 16.904 -11.498 -6.943 1625 HB2 LYS 10 2HB LYS 10 16.215 -13.826 -7.835 1626 HB3 LYS 10 1HB LYS 10 14.676 -13.095 -8.375 1627 HG2 LYS 10 2HG LYS 10 16.096 -11.454 -9.802 1628 HG3 LYS 10 1HG LYS 10 17.516 -12.466 -9.393 1629 HD2 LYS 10 2HD LYS 10 16.395 -14.430 -10.505 1630 HD3 LYS 10 1HD LYS 10 14.932 -13.414 -10.800 1631 HE2 LYS 10 2HE LYS 10 16.320 -11.830 -12.213 1632 HE3 LYS 10 1HE LYS 10 17.758 -12.899 -11.969 1633 HZ1 LYS 10 3HZ LYS 10 16.833 -13.456 -14.026 1634 HZ2 LYS 10 1HZ LYS 10 15.250 -13.524 -13.473 1635 HZ3 LYS 10 2HZ LYS 10 16.389 -14.713 -13.024 1636 H ALA 11 H ALA 11 13.332 -11.462 -6.794 1637 HA ALA 11 HA ALA 11 12.906 -9.570 -8.773 1638 HB1 ALA 11 1HB ALA 11 11.143 -10.033 -6.293 1639 HB2 ALA 11 2HB ALA 11 11.084 -11.023 -7.797 1640 HB3 ALA 11 3HB ALA 11 10.644 -9.278 -7.848 1641 H GLU 12 H GLU 12 13.505 -9.122 -5.237 1642 HA GLU 12 HA GLU 12 12.946 -6.386 -5.295 1643 HB2 GLU 12 2HB GLU 12 13.346 -7.838 -3.139 1644 HB3 GLU 12 1HB GLU 12 15.074 -7.447 -3.388 1645 HG2 GLU 12 2HG GLU 12 13.860 -4.912 -3.649 1646 HG3 GLU 12 1HG GLU 12 12.734 -5.716 -2.506 1647 H GLU 13 H GLU 13 15.875 -8.159 -6.127 1648 HA GLU 13 HA GLU 13 17.699 -6.041 -6.097 1649 HB2 GLU 13 2HB GLU 13 18.161 -8.569 -6.173 1650 HB3 GLU 13 1HB GLU 13 17.660 -8.547 -7.892 1651 HG2 GLU 13 2HG GLU 13 19.572 -6.972 -8.401 1652 HG3 GLU 13 1HG GLU 13 20.090 -7.083 -6.671 1653 H GLU 14 H GLU 14 15.330 -7.165 -8.449 1654 HA GLU 14 HA GLU 14 16.299 -5.803 -10.708 1655 HB2 GLU 14 2HB GLU 14 14.557 -7.793 -10.463 1656 HB3 GLU 14 1HB GLU 14 13.350 -6.502 -10.211 1657 HG2 GLU 14 2HG GLU 14 13.223 -7.079 -12.540 1658 HG3 GLU 14 1HG GLU 14 14.136 -5.525 -12.507 1659 H LEU 15 H LEU 15 13.951 -5.013 -8.125 1660 HA LEU 15 HA LEU 15 12.945 -2.679 -9.254 1661 HB2 LEU 15 2HB LEU 15 11.872 -3.883 -7.341 1662 HB3 LEU 15 1HB LEU 15 13.227 -3.403 -6.271 1663 HG LEU 15 HG LEU 15 12.586 -1.026 -6.444 1664 HD11 LEU 15 1HD1 LEU 15 11.779 -0.820 -8.746 1665 HD12 LEU 15 2HD1 LEU 15 10.444 -0.353 -7.651 1666 HD13 LEU 15 3HD1 LEU 15 10.430 -1.974 -8.438 1667 HD21 LEU 15 3HD2 LEU 15 10.372 -1.138 -5.283 1668 HD22 LEU 15 1HD2 LEU 15 11.499 -2.414 -4.699 1669 HD23 LEU 15 2HD2 LEU 15 10.164 -2.842 -5.825 1670 H GLN 16 H GLN 16 15.787 -3.273 -7.237 1671 HA GLN 16 HA GLN 16 16.377 -0.594 -6.673 1672 HB2 GLN 16 2HB GLN 16 18.238 -3.014 -6.864 1673 HB3 GLN 16 1HB GLN 16 18.666 -1.435 -6.113 1674 HG2 GLN 16 2HG GLN 16 16.956 -1.732 -4.345 1675 HG3 GLN 16 1HG GLN 16 16.316 -3.215 -5.135 1676 HE21 GLN 16 1HE2 GLN 16 16.858 -4.292 -2.933 1677 HE22 GLN 16 2HE2 GLN 16 18.444 -4.957 -2.822 1678 H LYS 17 H LYS 17 16.950 -2.515 -9.626 1679 HA LYS 17 HA LYS 17 18.925 -0.687 -10.644 1680 HB2 LYS 17 2HB LYS 17 18.716 -3.069 -11.507 1681 HB3 LYS 17 1HB LYS 17 17.160 -2.626 -12.259 1682 HG2 LYS 17 2HG LYS 17 19.221 -0.678 -13.120 1683 HG3 LYS 17 1HG LYS 17 19.899 -2.322 -13.226 1684 HD2 LYS 17 2HD LYS 17 18.966 -2.426 -15.281 1685 HD3 LYS 17 1HD LYS 17 17.449 -2.766 -14.412 1686 HE2 LYS 17 2HE LYS 17 16.867 -1.098 -16.012 1687 HE3 LYS 17 1HE LYS 17 17.005 -0.163 -14.474 1688 HZ1 LYS 17 3HZ LYS 17 18.048 0.920 -16.440 1689 HZ2 LYS 17 1HZ LYS 17 19.148 -0.378 -16.556 1690 HZ3 LYS 17 2HZ LYS 17 19.177 0.636 -15.208 1691 H VAL 18 H VAL 18 15.383 -1.040 -10.726 1692 HA VAL 18 HA VAL 18 14.897 0.799 -12.787 1693 HB VAL 18 HB VAL 18 13.067 0.127 -10.427 1694 HG11 VAL 18 1HG1 VAL 18 11.245 0.770 -12.047 1695 HG12 VAL 18 2HG1 VAL 18 12.487 1.282 -13.246 1696 HG13 VAL 18 3HG1 VAL 18 12.315 2.158 -11.679 1697 HG21 VAL 18 3HG2 VAL 18 12.086 -1.571 -12.020 1698 HG22 VAL 18 1HG2 VAL 18 13.778 -1.963 -11.598 1699 HG23 VAL 18 2HG2 VAL 18 13.404 -1.226 -13.199 1700 H LEU 19 H LEU 19 15.407 1.159 -9.259 1701 HA LEU 19 HA LEU 19 14.715 3.806 -8.977 1702 HB2 LEU 19 2HB LEU 19 17.145 2.424 -7.668 1703 HB3 LEU 19 1HB LEU 19 16.396 3.953 -7.110 1704 HG LEU 19 HG LEU 19 15.022 1.202 -7.126 1705 HD11 LEU 19 1HD1 LEU 19 16.183 2.848 -4.783 1706 HD12 LEU 19 2HD1 LEU 19 16.908 1.354 -5.481 1707 HD13 LEU 19 3HD1 LEU 19 15.307 1.279 -4.658 1708 HD21 LEU 19 3HD2 LEU 19 13.329 2.989 -7.354 1709 HD22 LEU 19 1HD2 LEU 19 14.094 3.930 -6.024 1710 HD23 LEU 19 2HD2 LEU 19 13.310 2.351 -5.674 1711 H GLU 20 H GLU 20 17.795 2.426 -10.175 1712 HA GLU 20 HA GLU 20 19.183 4.906 -10.224 1713 HB2 GLU 20 2HB GLU 20 19.740 2.247 -11.677 1714 HB3 GLU 20 1HB GLU 20 20.781 3.690 -11.776 1715 HG2 GLU 20 2HG GLU 20 20.702 3.501 -9.046 1716 HG3 GLU 20 1HG GLU 20 20.360 1.773 -9.431 1717 H GLU 21 H GLU 21 17.247 3.076 -12.545 1718 HA GLU 21 HA GLU 21 17.906 4.634 -14.837 1719 HB2 GLU 21 2HB GLU 21 16.940 2.257 -14.829 1720 HB3 GLU 21 1HB GLU 21 15.424 2.908 -14.153 1721 HG2 GLU 21 2HG GLU 21 14.960 2.553 -16.439 1722 HG3 GLU 21 1HG GLU 21 15.183 4.332 -16.312 1723 H ALA 22 H ALA 22 15.234 4.488 -12.484 1724 HA ALA 22 HA ALA 22 13.630 6.445 -13.622 1725 HB1 ALA 22 1HB ALA 22 12.698 4.757 -12.080 1726 HB2 ALA 22 2HB ALA 22 12.440 6.394 -11.369 1727 HB3 ALA 22 3HB ALA 22 13.757 5.337 -10.755 1728 H SER 23 H SER 23 16.420 6.722 -11.440 1729 HA SER 23 HA SER 23 15.607 9.305 -10.497 1730 HB2 SER 23 2HB SER 23 18.165 9.412 -9.821 1731 HB3 SER 23 1HB SER 23 16.990 8.339 -8.983 1732 HG SER 23 1HG SER 23 17.744 6.604 -9.946 1733 H LYS 24 H LYS 24 17.620 8.048 -13.138 1734 HA LYS 24 HA LYS 24 18.565 10.546 -14.025 1735 HB2 LYS 24 2HB LYS 24 19.456 8.296 -14.724 1736 HB3 LYS 24 1HB LYS 24 17.979 7.994 -15.683 1737 HG2 LYS 24 2HG LYS 24 19.750 10.483 -16.143 1738 HG3 LYS 24 1HG LYS 24 20.187 8.867 -16.771 1739 HD2 LYS 24 2HD LYS 24 18.064 8.739 -18.069 1740 HD3 LYS 24 1HD LYS 24 17.694 10.446 -17.612 1741 HE2 LYS 24 2HE LYS 24 19.880 11.194 -18.599 1742 HE3 LYS 24 1HE LYS 24 20.285 9.483 -19.008 1743 HZ1 LYS 24 3HZ LYS 24 18.298 9.519 -20.521 1744 HZ2 LYS 24 1HZ LYS 24 19.572 10.612 -20.883 1745 HZ3 LYS 24 2HZ LYS 24 18.132 11.172 -20.213 1746 H LYS 25 H LYS 25 15.751 8.514 -14.887 1747 HA LYS 25 HA LYS 25 14.698 10.291 -16.792 1748 HB2 LYS 25 2HB LYS 25 13.671 7.881 -15.280 1749 HB3 LYS 25 1HB LYS 25 12.441 8.979 -15.966 1750 HG2 LYS 25 2HG LYS 25 12.832 7.183 -17.513 1751 HG3 LYS 25 1HG LYS 25 13.286 8.768 -18.217 1752 HD2 LYS 25 2HD LYS 25 15.689 8.262 -17.942 1753 HD3 LYS 25 1HD LYS 25 15.300 6.705 -17.115 1754 HE2 LYS 25 2HE LYS 25 14.180 5.848 -19.184 1755 HE3 LYS 25 1HE LYS 25 14.481 7.419 -20.023 1756 HZ1 LYS 25 3HZ LYS 25 16.807 7.017 -19.965 1757 HZ2 LYS 25 1HZ LYS 25 16.030 5.688 -20.633 1758 HZ3 LYS 25 2HZ LYS 25 16.602 5.556 -19.034 1759 H ALA 26 H ALA 26 14.215 10.110 -13.226 1760 HA ALA 26 HA ALA 26 12.116 11.919 -13.105 1761 HB1 ALA 26 1HB ALA 26 12.763 12.274 -10.715 1762 HB2 ALA 26 2HB ALA 26 14.349 11.471 -11.017 1763 HB3 ALA 26 3HB ALA 26 12.822 10.525 -11.133 1764 H VAL 27 H VAL 27 15.694 12.540 -12.756 1765 HA VAL 27 HA VAL 27 15.247 15.311 -12.437 1766 HB VAL 27 HB VAL 27 17.222 14.251 -11.523 1767 HG11 VAL 27 1HG1 VAL 27 18.236 13.895 -14.428 1768 HG12 VAL 27 2HG1 VAL 27 17.677 12.567 -13.354 1769 HG13 VAL 27 3HG1 VAL 27 19.127 13.522 -12.911 1770 HG21 VAL 27 3HG2 VAL 27 17.232 16.687 -12.044 1771 HG22 VAL 27 1HG2 VAL 27 17.984 16.363 -13.649 1772 HG23 VAL 27 2HG2 VAL 27 18.872 15.967 -12.132 1773 H GLU 28 H GLU 28 15.847 13.244 -15.257 1774 HA GLU 28 HA GLU 28 16.262 15.334 -17.096 1775 HB2 GLU 28 2HB GLU 28 16.953 12.986 -17.518 1776 HB3 GLU 28 1HB GLU 28 15.240 12.457 -17.511 1777 HG2 GLU 28 2HG GLU 28 14.781 13.670 -19.611 1778 HG3 GLU 28 1HG GLU 28 16.403 14.456 -19.559 1779 H ALA 29 H ALA 29 13.344 13.652 -15.901 1780 HA ALA 29 HA ALA 29 11.506 14.469 -17.769 1781 HB1 ALA 29 1HB ALA 29 10.958 12.788 -15.998 1782 HB2 ALA 29 2HB ALA 29 9.787 14.138 -15.928 1783 HB3 ALA 29 3HB ALA 29 11.117 14.061 -14.731 1784 H GLU 30 H GLU 30 12.921 16.265 -15.086 1785 HA GLU 30 HA GLU 30 10.906 18.256 -15.029 1786 HB2 GLU 30 2HB GLU 30 13.793 18.294 -14.024 1787 HB3 GLU 30 1HB GLU 30 12.491 19.423 -13.508 1788 HG2 GLU 30 2HG GLU 30 12.169 16.360 -13.144 1789 HG3 GLU 30 1HG GLU 30 13.137 17.350 -12.034 1790 H ARG 31 H ARG 31 13.526 17.632 -17.224 1791 HA ARG 31 HA ARG 31 13.942 20.439 -17.886 1792 HB2 ARG 31 2HB ARG 31 15.012 17.884 -19.202 1793 HB3 ARG 31 1HB ARG 31 15.520 19.549 -19.612 1794 HG2 ARG 31 2HG ARG 31 15.911 18.162 -16.865 1795 HG3 ARG 31 1HG ARG 31 17.111 18.172 -18.170 1796 HD2 ARG 31 2HD ARG 31 16.193 20.485 -16.387 1797 HD3 ARG 31 1HD ARG 31 17.861 19.863 -16.647 1798 HE ARG 31 HE ARG 31 16.875 22.106 -17.842 1799 HH11 ARG 31 1HH2 ARG 31 18.180 19.089 -19.306 1800 HH12 ARG 31 2HH2 ARG 31 18.757 19.856 -20.705 1801 HH21 ARG 31 1HH1 ARG 31 17.907 23.190 -19.694 1802 HH22 ARG 31 2HH1 ARG 31 18.373 22.168 -21.017 1803 H GLY 32 H GLY 32 11.536 20.670 -18.427 1804 HA2 GLY 32 2HA GLY 32 11.136 21.071 -21.046 1805 HA3 GLY 32 1HA GLY 32 10.610 19.344 -20.794 1806 H ALA 33 H ALA 33 9.812 19.553 -18.103 1807 HA ALA 33 HA ALA 33 7.201 20.528 -18.668 1808 HB1 ALA 33 1HB ALA 33 8.432 19.347 -16.135 1809 HB2 ALA 33 2HB ALA 33 7.614 18.381 -17.414 1810 HB3 ALA 33 3HB ALA 33 6.655 19.540 -16.407 1811 HA PRO 34 HA PRO 34 7.822 24.307 -16.421 1812 HB2 PRO 34 2HB PRO 34 5.202 25.044 -15.722 1813 HB3 PRO 34 1HB PRO 34 5.835 25.113 -17.412 1814 HG2 PRO 34 2HG PRO 34 4.202 22.869 -16.107 1815 HG3 PRO 34 1HG PRO 34 3.924 23.670 -17.715 1816 HD2 PRO 34 2HD PRO 34 5.285 21.255 -17.464 1817 HD3 PRO 34 1HD PRO 34 5.801 22.487 -18.702 1818 H GLY 35 H GLY 35 8.100 25.090 -14.256 1819 HA2 GLY 35 2HA GLY 35 7.881 25.163 -12.043 1820 HA3 GLY 35 1HA GLY 35 6.656 23.844 -12.118 1821 H ALA 36 H ALA 36 9.843 23.534 -13.561 1822 HA ALA 36 HA ALA 36 10.414 21.125 -12.440 1823 HB1 ALA 36 1HB ALA 36 12.390 23.246 -13.486 1824 HB2 ALA 36 2HB ALA 36 11.558 21.985 -14.479 1825 HB3 ALA 36 3HB ALA 36 12.772 21.502 -13.244 1826 H ALA 37 H ALA 37 11.379 20.351 -10.680 1827 HA ALA 37 HA ALA 37 12.566 22.251 -8.733 1828 HB1 ALA 37 1HB ALA 37 11.309 21.046 -6.901 1829 HB2 ALA 37 2HB ALA 37 10.457 20.060 -8.156 1830 HB3 ALA 37 3HB ALA 37 10.189 21.834 -8.065 1831 H LEU 38 H LEU 38 12.145 18.927 -10.009 1832 HA LEU 38 HA LEU 38 14.066 17.859 -8.116 1833 HB2 LEU 38 2HB LEU 38 11.755 16.907 -9.317 1834 HB3 LEU 38 1HB LEU 38 12.976 16.149 -10.359 1835 HG LEU 38 HG LEU 38 12.913 15.948 -7.305 1836 HD11 LEU 38 1HD1 LEU 38 11.831 13.997 -9.436 1837 HD12 LEU 38 2HD1 LEU 38 10.849 15.003 -8.313 1838 HD13 LEU 38 3HD1 LEU 38 11.899 13.699 -7.661 1839 HD21 LEU 38 3HD2 LEU 38 15.187 15.455 -8.221 1840 HD22 LEU 38 1HD2 LEU 38 14.475 14.286 -9.386 1841 HD23 LEU 38 2HD2 LEU 38 14.395 13.951 -7.614 1842 H ILE 39 H ILE 39 14.996 19.903 -9.912 1843 HA ILE 39 HA ILE 39 16.406 18.697 -12.084 1844 HB ILE 39 HB ILE 39 15.445 20.984 -12.093 1845 HG12 ILE 39 2HG1 ILE 39 18.476 20.908 -12.618 1846 HG13 ILE 39 1HG1 ILE 39 17.199 20.263 -13.698 1847 HG21 ILE 39 1HG2 ILE 39 16.020 21.586 -9.704 1848 HG22 ILE 39 2HG2 ILE 39 16.548 22.834 -10.879 1849 HG23 ILE 39 3HG2 ILE 39 17.756 21.712 -10.169 1850 HD11 ILE 39 3HD ILE 39 17.574 23.220 -12.862 1851 HD12 ILE 39 1HD ILE 39 17.905 22.503 -14.474 1852 HD13 ILE 39 2HD ILE 39 16.207 22.602 -13.868 1853 H SER 40 H SER 40 16.724 18.301 -8.929 1854 HA SER 40 HA SER 40 19.488 18.531 -8.372 1855 HB2 SER 40 2HB SER 40 17.341 16.689 -7.145 1856 HB3 SER 40 1HB SER 40 18.905 17.184 -6.397 1857 HG SER 40 1HG SER 40 17.083 18.354 -5.657 1858 H TYR 41 H TYR 41 21.077 17.105 -9.108 1859 HA TYR 41 HA TYR 41 20.217 14.636 -10.374 1860 HB2 TYR 41 2HB TYR 41 22.946 16.038 -10.281 1861 HB3 TYR 41 1HB TYR 41 22.741 14.350 -10.871 1862 HD1 TYR 41 2HD TYR 41 21.581 17.896 -11.469 1863 HD2 TYR 41 1HD TYR 41 21.885 13.891 -13.006 1864 HE1 TYR 41 2HE TYR 41 20.833 18.689 -13.662 1865 HE2 TYR 41 1HE TYR 41 21.148 14.687 -15.221 1866 HH TYR 41 HH TYR 41 20.517 18.133 -15.899 1867 HA PRO 42 HA PRO 42 22.726 12.496 -7.122 1868 HB2 PRO 42 2HB PRO 42 23.531 13.781 -4.716 1869 HB3 PRO 42 1HB PRO 42 24.551 13.643 -6.190 1870 HG2 PRO 42 2HG PRO 42 22.759 15.988 -5.339 1871 HG3 PRO 42 1HG PRO 42 24.470 16.056 -5.928 1872 HD2 PRO 42 2HD PRO 42 22.394 16.562 -7.623 1873 HD3 PRO 42 1HD PRO 42 23.802 15.558 -8.199 1874 H ASP 43 H ASP 43 20.475 14.995 -6.000 1875 HA ASP 43 HA ASP 43 19.544 13.323 -3.839 1876 HB2 ASP 43 2HB ASP 43 18.086 15.801 -4.881 1877 HB3 ASP 43 1HB ASP 43 17.926 15.011 -3.290 1878 H ALA 44 H ALA 44 19.112 13.327 -7.218 1879 HA ALA 44 HA ALA 44 16.344 13.005 -7.452 1880 HB1 ALA 44 1HB ALA 44 17.771 13.415 -9.485 1881 HB2 ALA 44 2HB ALA 44 16.798 11.936 -9.675 1882 HB3 ALA 44 3HB ALA 44 18.551 11.815 -9.262 1883 H ILE 45 H ILE 45 18.967 10.724 -6.694 1884 HA ILE 45 HA ILE 45 17.337 8.430 -7.105 1885 HB ILE 45 HB ILE 45 19.707 8.259 -7.398 1886 HG12 ILE 45 2HG1 ILE 45 18.682 6.490 -5.089 1887 HG13 ILE 45 1HG1 ILE 45 18.293 6.279 -6.828 1888 HG21 ILE 45 1HG2 ILE 45 21.276 8.312 -5.466 1889 HG22 ILE 45 2HG2 ILE 45 19.940 8.769 -4.354 1890 HG23 ILE 45 3HG2 ILE 45 20.455 9.882 -5.669 1891 HD11 ILE 45 3HD ILE 45 21.093 6.095 -5.545 1892 HD12 ILE 45 1HD ILE 45 20.096 4.731 -6.179 1893 HD13 ILE 45 2HD ILE 45 20.759 5.969 -7.321 1894 H TRP 46 H TRP 46 17.725 10.670 -4.434 1895 HA TRP 46 HA TRP 46 16.651 8.839 -2.511 1896 HB2 TRP 46 2HB TRP 46 17.327 11.794 -2.556 1897 HB3 TRP 46 1HB TRP 46 16.217 11.206 -1.319 1898 HD1 TRP 46 HD TRP 46 18.195 12.219 0.245 1899 HE1 TRP 46 1HE TRP 46 20.053 10.916 1.517 1900 HE3 TRP 46 3HE TRP 46 18.460 7.959 -2.674 1901 HZ2 TRP 46 2HZ TRP 46 21.453 8.528 1.270 1902 HZ3 TRP 46 3HZ TRP 46 19.995 6.200 -2.029 1903 HH2 TRP 46 HH TRP 46 21.468 6.448 -0.067 1904 H TRP 47 H TRP 47 15.180 11.265 -4.685 1905 HA TRP 47 HA TRP 47 12.617 10.862 -3.496 1906 HB2 TRP 47 2HB TRP 47 13.100 12.892 -4.804 1907 HB3 TRP 47 1HB TRP 47 13.376 11.905 -6.282 1908 HD1 TRP 47 HD TRP 47 10.369 12.923 -3.896 1909 HE1 TRP 47 1HE TRP 47 8.212 12.583 -5.219 1910 HE3 TRP 47 3HE TRP 47 12.382 10.790 -8.069 1911 HZ2 TRP 47 2HZ TRP 47 7.446 11.505 -7.777 1912 HZ3 TRP 47 3HZ TRP 47 10.888 10.081 -9.907 1913 HH2 TRP 47 HH TRP 47 8.465 10.451 -9.767 1914 H SER 48 H SER 48 14.482 9.257 -6.032 1915 HA SER 48 HA SER 48 12.478 7.747 -7.199 1916 HB2 SER 48 2HB SER 48 14.998 8.133 -7.868 1917 HB3 SER 48 1HB SER 48 15.355 6.716 -6.814 1918 HG SER 48 1HG SER 48 15.072 6.108 -8.956 1919 H VAL 49 H VAL 49 14.503 7.110 -4.304 1920 HA VAL 49 HA VAL 49 13.776 4.502 -3.796 1921 HB VAL 49 HB VAL 49 14.601 6.795 -1.959 1922 HG11 VAL 49 1HG1 VAL 49 15.084 4.976 -0.232 1923 HG12 VAL 49 2HG1 VAL 49 14.115 3.830 -1.240 1924 HG13 VAL 49 3HG1 VAL 49 13.335 5.270 -0.491 1925 HG21 VAL 49 3HG2 VAL 49 16.267 5.852 -3.684 1926 HG22 VAL 49 1HG2 VAL 49 16.067 4.239 -2.928 1927 HG23 VAL 49 2HG2 VAL 49 16.779 5.596 -1.980 1928 H GLU 50 H GLU 50 12.159 7.511 -2.495 1929 HA GLU 50 HA GLU 50 10.268 5.856 -1.158 1930 HB2 GLU 50 2HB GLU 50 9.133 8.003 -0.529 1931 HB3 GLU 50 1HB GLU 50 10.853 7.872 -0.065 1932 HG2 GLU 50 2HG GLU 50 11.498 9.309 -2.059 1933 HG3 GLU 50 1HG GLU 50 9.747 9.542 -2.421 1934 H THR 51 H THR 51 10.488 6.918 -4.383 1935 HA THR 51 HA THR 51 7.655 7.048 -4.873 1936 HB THR 51 HB THR 51 10.094 7.035 -6.715 1937 HG1 THR 51 1HG THR 51 9.986 8.887 -5.590 1938 HG21 THR 51 3HG2 THR 51 8.135 6.176 -8.000 1939 HG22 THR 51 1HG2 THR 51 8.465 7.880 -8.466 1940 HG23 THR 51 2HG2 THR 51 7.094 7.493 -7.363 1941 H ALA 52 H ALA 52 10.286 4.607 -5.219 1942 HA ALA 52 HA ALA 52 8.652 2.778 -6.639 1943 HB1 ALA 52 1HB ALA 52 11.104 2.269 -4.844 1944 HB2 ALA 52 2HB ALA 52 11.128 2.556 -6.628 1945 HB3 ALA 52 3HB ALA 52 10.370 1.063 -5.968 1946 H THR 53 H THR 53 8.910 3.583 -3.179 1947 HA THR 53 HA THR 53 7.463 1.170 -2.473 1948 HB THR 53 HB THR 53 7.716 2.153 -0.143 1949 HG1 THR 53 1HG THR 53 8.029 4.298 -0.665 1950 HG21 THR 53 3HG2 THR 53 10.150 1.601 -0.059 1951 HG22 THR 53 1HG2 THR 53 10.292 1.788 -1.844 1952 HG23 THR 53 2HG2 THR 53 9.292 0.453 -1.152 1953 H THR 54 H THR 54 6.516 3.923 -3.985 1954 HA THR 54 HA THR 54 4.809 5.279 -3.995 1955 HB THR 54 HB THR 54 2.510 4.063 -3.759 1956 HG1 THR 54 1HG THR 54 3.111 2.269 -2.579 1957 HG21 THR 54 3HG2 THR 54 2.960 2.934 -5.937 1958 HG22 THR 54 1HG2 THR 54 4.739 3.076 -5.671 1959 HG23 THR 54 2HG2 THR 54 3.726 4.559 -5.866 1960 H VAL 55 H VAL 55 6.176 5.647 -1.632 1961 HA VAL 55 HA VAL 55 4.067 5.917 0.418 1962 HB VAL 55 HB VAL 55 7.095 6.382 0.612 1963 HG11 VAL 55 1HG1 VAL 55 5.833 8.012 2.065 1964 HG12 VAL 55 2HG1 VAL 55 6.593 6.735 3.074 1965 HG13 VAL 55 3HG1 VAL 55 4.829 6.672 2.715 1966 HG21 VAL 55 3HG2 VAL 55 6.905 4.408 2.203 1967 HG22 VAL 55 1HG2 VAL 55 6.393 3.950 0.534 1968 HG23 VAL 55 2HG2 VAL 55 5.159 4.268 1.797 1969 H GLY 56 H GLY 56 6.697 7.787 -1.250 1970 HA2 GLY 56 2HA GLY 56 6.733 9.906 -1.940 1971 HA3 GLY 56 1HA GLY 56 4.928 9.799 -2.074 1972 H TYR 57 H TYR 57 7.560 10.117 0.413 1973 HA TYR 57 HA TYR 57 5.633 10.894 2.395 1974 HB2 TYR 57 2HB TYR 57 7.930 9.518 2.582 1975 HB3 TYR 57 1HB TYR 57 8.712 11.126 2.655 1976 HD1 TYR 57 2HD TYR 57 6.184 12.300 4.496 1977 HD2 TYR 57 1HD TYR 57 8.812 8.884 4.641 1978 HE1 TYR 57 2HE TYR 57 5.871 12.152 6.921 1979 HE2 TYR 57 1HE TYR 57 8.467 8.733 7.074 1980 HH TYR 57 HH TYR 57 6.092 10.605 8.873 1981 H GLY 58 H GLY 58 8.282 12.289 0.378 1982 HA2 GLY 58 2HA GLY 58 7.022 14.520 -0.304 1983 HA3 GLY 58 1HA GLY 58 7.733 14.973 1.308 1984 H ASP 59 H ASP 59 9.754 15.682 1.286 1985 HA ASP 59 HA ASP 59 11.671 16.350 0.701 1986 HB2 ASP 59 2HB ASP 59 12.515 14.039 0.772 1987 HB3 ASP 59 1HB ASP 59 12.198 13.861 -0.984 1988 H ARG 60 H ARG 60 10.480 14.943 -2.403 1989 HA ARG 60 HA ARG 60 10.840 17.644 -3.565 1990 HB2 ARG 60 2HB ARG 60 11.173 15.072 -5.204 1991 HB3 ARG 60 1HB ARG 60 11.494 16.760 -5.734 1992 HG2 ARG 60 2HG ARG 60 13.016 15.162 -3.612 1993 HG3 ARG 60 1HG ARG 60 13.579 15.411 -5.285 1994 HD2 ARG 60 2HD ARG 60 14.180 17.692 -4.950 1995 HD3 ARG 60 1HD ARG 60 13.043 17.907 -3.545 1996 HE ARG 60 HE ARG 60 14.536 15.974 -2.510 1997 HH11 ARG 60 1HH2 ARG 60 15.685 19.101 -4.025 1998 HH12 ARG 60 2HH2 ARG 60 17.194 19.010 -3.198 1999 HH21 ARG 60 1HH1 ARG 60 16.125 16.201 -1.174 2000 HH22 ARG 60 2HH1 ARG 60 17.471 17.282 -1.362 2001 H TYR 61 H TYR 61 9.564 17.041 -6.101 2002 HA TYR 61 HA TYR 61 7.250 15.585 -5.580 2003 HB2 TYR 61 2HB TYR 61 5.616 17.399 -6.264 2004 HB3 TYR 61 1HB TYR 61 6.306 17.667 -4.631 2005 HD1 TYR 61 1HD TYR 61 6.531 18.762 -8.220 2006 HD2 TYR 61 2HD TYR 61 7.477 19.703 -4.133 2007 HE1 TYR 61 1HE TYR 61 7.170 21.016 -8.908 2008 HE2 TYR 61 2HE TYR 61 8.085 21.997 -4.808 2009 HH TYR 61 HH TYR 61 8.116 22.957 -8.278 2010 HA PRO 62 HA PRO 62 8.442 15.870 -9.935 2011 HB2 PRO 62 2HB PRO 62 6.617 14.152 -11.100 2012 HB3 PRO 62 1HB PRO 62 7.909 13.536 -9.997 2013 HG2 PRO 62 2HG PRO 62 4.984 14.162 -9.372 2014 HG3 PRO 62 1HG PRO 62 5.901 12.670 -8.926 2015 HD2 PRO 62 2HD PRO 62 5.562 14.843 -7.170 2016 HD3 PRO 62 1HD PRO 62 7.062 13.812 -7.159 2017 H VAL 63 H VAL 63 7.708 16.862 -11.904 2018 HA VAL 63 HA VAL 63 5.637 18.764 -11.625 2019 HB VAL 63 HB VAL 63 6.427 19.393 -13.984 2020 HG11 VAL 63 1HG1 VAL 63 8.538 19.045 -11.762 2021 HG12 VAL 63 2HG1 VAL 63 7.359 20.394 -11.917 2022 HG13 VAL 63 3HG1 VAL 63 8.624 20.152 -13.172 2023 HG21 VAL 63 3HG2 VAL 63 7.085 17.193 -14.873 2024 HG22 VAL 63 1HG2 VAL 63 8.194 16.857 -13.500 2025 HG23 VAL 63 2HG2 VAL 63 8.610 18.130 -14.627 2026 H THR 64 H THR 64 4.396 19.140 -14.026 2027 HA THR 64 HA THR 64 2.517 16.987 -14.021 2028 HB THR 64 HB THR 64 1.421 18.623 -15.823 2029 HG1 THR 64 1HG THR 64 2.250 20.551 -15.880 2030 HG21 THR 64 3HG2 THR 64 0.529 18.080 -13.576 2031 HG22 THR 64 1HG2 THR 64 0.417 19.852 -13.847 2032 HG23 THR 64 2HG2 THR 64 1.720 19.171 -12.793 2033 H GLU 65 H GLU 65 3.850 18.800 -16.780 2034 HA GLU 65 HA GLU 65 2.995 17.294 -18.703 2035 HB2 GLU 65 2HB GLU 65 4.213 19.426 -19.006 2036 HB3 GLU 65 1HB GLU 65 5.777 18.583 -18.733 2037 HG2 GLU 65 2HG GLU 65 5.521 17.286 -20.808 2038 HG3 GLU 65 1HG GLU 65 3.860 17.939 -21.060 2039 H GLU 66 H GLU 66 5.982 16.538 -16.980 2040 HA GLU 66 HA GLU 66 6.079 13.913 -18.302 2041 HB2 GLU 66 2HB GLU 66 8.310 15.674 -17.138 2042 HB3 GLU 66 1HB GLU 66 8.548 13.967 -17.660 2043 HG2 GLU 66 2HG GLU 66 7.456 16.084 -19.628 2044 HG3 GLU 66 1HG GLU 66 9.211 15.977 -19.243 2045 H GLY 67 H GLY 67 7.876 14.968 -15.498 2046 HA2 GLY 67 2HA GLY 67 8.235 13.619 -13.674 2047 HA3 GLY 67 1HA GLY 67 7.018 14.868 -13.258 2048 H ARG 68 H ARG 68 4.701 14.134 -13.573 2049 HA ARG 68 HA ARG 68 4.289 12.054 -11.781 2050 HB2 ARG 68 2HB ARG 68 2.952 14.240 -12.406 2051 HB3 ARG 68 1HB ARG 68 2.062 13.192 -13.550 2052 HG2 ARG 68 2HG ARG 68 1.296 11.764 -11.672 2053 HG3 ARG 68 1HG ARG 68 2.418 12.565 -10.538 2054 HD2 ARG 68 2HD ARG 68 -0.081 13.804 -11.841 2055 HD3 ARG 68 1HD ARG 68 0.128 13.406 -10.104 2056 HE ARG 68 HE ARG 68 0.891 15.841 -11.437 2057 HH11 ARG 68 1HH2 ARG 68 1.961 13.825 -8.641 2058 HH12 ARG 68 2HH2 ARG 68 3.182 14.906 -8.182 2059 HH21 ARG 68 1HH1 ARG 68 2.083 17.530 -10.090 2060 HH22 ARG 68 2HH1 ARG 68 3.639 16.920 -9.611 2061 H LYS 69 H LYS 69 3.998 12.125 -15.374 2062 HA LYS 69 HA LYS 69 2.768 9.490 -15.370 2063 HB2 LYS 69 2HB LYS 69 2.162 11.260 -17.069 2064 HB3 LYS 69 1HB LYS 69 3.811 11.088 -17.769 2065 HG2 LYS 69 2HG LYS 69 3.345 8.666 -18.236 2066 HG3 LYS 69 1HG LYS 69 1.762 8.792 -17.408 2067 HD2 LYS 69 2HD LYS 69 0.931 10.344 -19.153 2068 HD3 LYS 69 1HD LYS 69 2.547 10.336 -19.959 2069 HE2 LYS 69 2HE LYS 69 2.348 7.853 -20.344 2070 HE3 LYS 69 1HE LYS 69 0.722 7.852 -19.552 2071 HZ1 LYS 69 3HZ LYS 69 0.784 7.923 -22.013 2072 HZ2 LYS 69 1HZ LYS 69 1.384 9.518 -21.935 2073 HZ3 LYS 69 2HZ LYS 69 -0.155 9.168 -21.266 2074 H VAL 70 H VAL 70 5.940 10.927 -15.361 2075 HA VAL 70 HA VAL 70 7.274 8.578 -16.369 2076 HB VAL 70 HB VAL 70 8.336 10.950 -14.745 2077 HG11 VAL 70 1HG1 VAL 70 10.577 10.184 -15.580 2078 HG12 VAL 70 2HG1 VAL 70 9.814 8.715 -16.302 2079 HG13 VAL 70 3HG1 VAL 70 9.825 8.948 -14.513 2080 HG21 VAL 70 3HG2 VAL 70 9.172 11.707 -17.015 2081 HG22 VAL 70 1HG2 VAL 70 7.380 11.611 -16.987 2082 HG23 VAL 70 2HG2 VAL 70 8.335 10.316 -17.784 2083 H ALA 71 H ALA 71 6.545 10.066 -13.185 2084 HA ALA 71 HA ALA 71 7.584 8.167 -11.519 2085 HB1 ALA 71 1HB ALA 71 6.038 9.008 -9.779 2086 HB2 ALA 71 2HB ALA 71 4.951 9.709 -11.029 2087 HB3 ALA 71 3HB ALA 71 6.583 10.408 -10.775 2088 H GLU 72 H GLU 72 4.356 8.257 -13.053 2089 HA GLU 72 HA GLU 72 2.951 6.245 -12.037 2090 HB2 GLU 72 2HB GLU 72 2.288 7.600 -14.112 2091 HB3 GLU 72 1HB GLU 72 3.456 6.633 -15.055 2092 HG2 GLU 72 2HG GLU 72 1.955 4.551 -14.220 2093 HG3 GLU 72 1HG GLU 72 0.717 5.829 -13.973 2094 H GLN 73 H GLN 73 5.478 5.846 -14.502 2095 HA GLN 73 HA GLN 73 5.214 3.081 -14.793 2096 HB2 GLN 73 2HB GLN 73 6.245 4.737 -16.461 2097 HB3 GLN 73 1HB GLN 73 7.668 4.869 -15.383 2098 HG2 GLN 73 2HG GLN 73 8.108 2.389 -15.726 2099 HG3 GLN 73 1HG GLN 73 6.679 2.318 -16.827 2100 HE21 GLN 73 1HE2 GLN 73 8.579 1.480 -18.256 2101 HE22 GLN 73 2HE2 GLN 73 9.412 2.672 -19.205 2102 H VAL 74 H VAL 74 7.272 5.114 -12.727 2103 HA VAL 74 HA VAL 74 9.085 3.062 -11.989 2104 HB VAL 74 HB VAL 74 8.444 5.707 -10.563 2105 HG11 VAL 74 1HG1 VAL 74 9.759 4.142 -9.118 2106 HG12 VAL 74 2HG1 VAL 74 10.804 5.484 -9.687 2107 HG13 VAL 74 3HG1 VAL 74 10.932 3.857 -10.454 2108 HG21 VAL 74 3HG2 VAL 74 10.491 5.070 -12.797 2109 HG22 VAL 74 1HG2 VAL 74 10.346 6.634 -11.904 2110 HG23 VAL 74 2HG2 VAL 74 9.027 6.090 -12.974 2111 H MET 75 H MET 75 6.220 4.579 -10.501 2112 HA MET 75 HA MET 75 6.247 3.245 -8.054 2113 HB2 MET 75 2HB MET 75 3.942 4.365 -9.777 2114 HB3 MET 75 1HB MET 75 3.712 3.754 -8.109 2115 HG2 MET 75 2HG MET 75 5.451 5.411 -7.310 2116 HG3 MET 75 1HG MET 75 5.497 6.136 -8.929 2117 HE1 MET 75 3HE MET 75 1.826 7.654 -9.268 2118 HE2 MET 75 1HE MET 75 2.342 6.028 -9.807 2119 HE3 MET 75 2HE MET 75 3.429 7.447 -10.050 2120 H LYS 76 H LYS 76 4.667 2.447 -11.163 2121 HA LYS 76 HA LYS 76 3.287 0.219 -10.312 2122 HB2 LYS 76 2HB LYS 76 3.139 1.546 -12.563 2123 HB3 LYS 76 1HB LYS 76 4.487 0.509 -13.128 2124 HG2 LYS 76 2HG LYS 76 2.984 -1.528 -12.583 2125 HG3 LYS 76 1HG LYS 76 1.672 -0.360 -12.196 2126 HD2 LYS 76 2HD LYS 76 1.963 0.557 -14.616 2127 HD3 LYS 76 1HD LYS 76 3.080 -0.837 -14.885 2128 HE2 LYS 76 2HE LYS 76 1.097 -2.360 -14.088 2129 HE3 LYS 76 1HE LYS 76 0.038 -0.906 -14.269 2130 HZ1 LYS 76 3HZ LYS 76 0.774 -0.865 -16.681 2131 HZ2 LYS 76 1HZ LYS 76 -0.050 -2.263 -16.188 2132 HZ3 LYS 76 2HZ LYS 76 1.650 -2.300 -16.341 2133 H ALA 77 H ALA 77 6.647 0.522 -11.465 2134 HA ALA 77 HA ALA 77 7.167 -2.201 -11.800 2135 HB1 ALA 77 1HB ALA 77 9.137 0.023 -10.964 2136 HB2 ALA 77 2HB ALA 77 8.698 -0.387 -12.663 2137 HB3 ALA 77 3HB ALA 77 9.590 -1.583 -11.647 2138 H GLY 78 H GLY 78 7.242 -0.126 -8.904 2139 HA2 GLY 78 2HA GLY 78 8.578 -2.022 -7.249 2140 HA3 GLY 78 1HA GLY 78 7.620 -0.571 -6.756 2141 H ILE 79 H ILE 79 5.160 -1.116 -7.784 2142 HA ILE 79 HA ILE 79 4.062 -2.808 -5.890 2143 HB ILE 79 HB ILE 79 2.884 -1.850 -8.544 2144 HG12 ILE 79 2HG1 ILE 79 2.601 -0.712 -5.680 2145 HG13 ILE 79 1HG1 ILE 79 3.677 -0.028 -6.925 2146 HG21 ILE 79 1HG2 ILE 79 0.643 -2.298 -7.463 2147 HG22 ILE 79 2HG2 ILE 79 1.477 -2.992 -6.027 2148 HG23 ILE 79 3HG2 ILE 79 1.581 -3.809 -7.628 2149 HD11 ILE 79 3HD ILE 79 0.596 -0.169 -7.085 2150 HD12 ILE 79 1HD ILE 79 1.616 1.285 -6.834 2151 HD13 ILE 79 2HD ILE 79 1.673 0.416 -8.413 2152 H GLU 80 H GLU 80 4.808 -3.423 -9.372 2153 HA GLU 80 HA GLU 80 3.756 -6.010 -9.413 2154 HB2 GLU 80 2HB GLU 80 6.045 -4.807 -11.076 2155 HB3 GLU 80 1HB GLU 80 5.332 -6.429 -11.372 2156 HG2 GLU 80 2HG GLU 80 3.084 -5.385 -11.792 2157 HG3 GLU 80 1HG GLU 80 3.790 -3.755 -11.532 2158 H VAL 81 H VAL 81 7.062 -4.887 -8.515 2159 HA VAL 81 HA VAL 81 8.154 -7.474 -8.300 2160 HB VAL 81 HB VAL 81 8.897 -4.720 -7.234 2161 HG11 VAL 81 1HG1 VAL 81 9.775 -6.184 -5.477 2162 HG12 VAL 81 2HG1 VAL 81 11.140 -5.751 -6.555 2163 HG13 VAL 81 3HG1 VAL 81 10.380 -7.377 -6.686 2164 HG21 VAL 81 3HG2 VAL 81 10.727 -4.978 -8.921 2165 HG22 VAL 81 1HG2 VAL 81 9.136 -5.267 -9.704 2166 HG23 VAL 81 2HG2 VAL 81 10.193 -6.661 -9.279 2167 H PHE 82 H PHE 82 6.727 -5.260 -5.815 2168 HA PHE 82 HA PHE 82 7.219 -7.083 -3.714 2169 HB2 PHE 82 2HB PHE 82 5.141 -4.800 -3.893 2170 HB3 PHE 82 1HB PHE 82 5.546 -5.699 -2.380 2171 HD1 PHE 82 2HD PHE 82 8.381 -5.904 -2.183 2172 HD2 PHE 82 1HD PHE 82 6.056 -2.663 -3.802 2173 HE1 PHE 82 2HE PHE 82 10.212 -4.335 -1.682 2174 HE2 PHE 82 1HE PHE 82 7.892 -1.098 -3.307 2175 HZ PHE 82 HZ PHE 82 9.980 -1.923 -2.241 2176 H ALA 83 H ALA 83 4.421 -6.650 -5.921 2177 HA ALA 83 HA ALA 83 2.787 -8.449 -4.447 2178 HB1 ALA 83 1HB ALA 83 1.311 -8.447 -6.448 2179 HB2 ALA 83 2HB ALA 83 2.607 -7.635 -7.412 2180 HB3 ALA 83 3HB ALA 83 1.818 -6.771 -6.041 2181 H LEU 84 H LEU 84 5.293 -8.854 -6.939 2182 HA LEU 84 HA LEU 84 4.454 -11.400 -7.791 2183 HB2 LEU 84 2HB LEU 84 5.877 -9.878 -9.124 2184 HB3 LEU 84 1HB LEU 84 7.236 -10.104 -7.985 2185 HG LEU 84 HG LEU 84 6.073 -12.631 -9.161 2186 HD11 LEU 84 1HD1 LEU 84 7.098 -12.332 -11.411 2187 HD12 LEU 84 2HD1 LEU 84 7.521 -10.625 -11.008 2188 HD13 LEU 84 3HD1 LEU 84 5.792 -11.129 -11.114 2189 HD21 LEU 84 3HD2 LEU 84 8.192 -12.653 -7.811 2190 HD22 LEU 84 1HD2 LEU 84 8.976 -11.566 -9.014 2191 HD23 LEU 84 2HD2 LEU 84 8.473 -13.232 -9.490 2192 H VAL 85 H VAL 85 6.121 -10.405 -4.872 2193 HA VAL 85 HA VAL 85 7.453 -12.884 -4.503 2194 HB VAL 85 HB VAL 85 8.067 -12.221 -2.358 2195 HG11 VAL 85 1HG1 VAL 85 8.987 -10.839 -4.313 2196 HG12 VAL 85 2HG1 VAL 85 9.005 -9.991 -2.724 2197 HG13 VAL 85 3HG1 VAL 85 7.753 -9.578 -3.940 2198 HG21 VAL 85 3HG2 VAL 85 6.966 -10.153 -1.229 2199 HG22 VAL 85 1HG2 VAL 85 6.050 -11.694 -1.202 2200 HG23 VAL 85 2HG2 VAL 85 5.585 -10.408 -2.360 2201 H THR 86 H THR 86 4.179 -12.397 -4.752 2202 HA THR 86 HA THR 86 3.199 -13.710 -2.509 2203 HB THR 86 HB THR 86 1.869 -13.501 -5.227 2204 HG1 THR 86 1HG THR 86 2.218 -11.499 -4.555 2205 HG21 THR 86 3HG2 THR 86 0.728 -15.154 -3.723 2206 HG22 THR 86 1HG2 THR 86 -0.238 -13.655 -3.850 2207 HG23 THR 86 2HG2 THR 86 0.735 -13.960 -2.361 2208 H ALA 87 H ALA 87 4.708 -15.004 -5.412 2209 HA ALA 87 HA ALA 87 4.102 -17.638 -5.208 2210 HB1 ALA 87 1HB ALA 87 5.646 -16.652 -6.934 2211 HB2 ALA 87 2HB ALA 87 6.380 -18.103 -6.166 2212 HB3 ALA 87 3HB ALA 87 6.917 -16.445 -5.681 2213 H ALA 88 H ALA 88 5.852 -15.709 -2.903 2214 HA ALA 88 HA ALA 88 6.871 -17.998 -1.427 2215 HB1 ALA 88 1HB ALA 88 8.284 -15.849 -1.554 2216 HB2 ALA 88 2HB ALA 88 7.816 -16.276 0.147 2217 HB3 ALA 88 3HB ALA 88 6.953 -14.981 -0.729 2218 H LEU 89 H LEU 89 4.350 -15.480 -1.299 2219 HA LEU 89 HA LEU 89 3.785 -15.949 1.430 2220 HB2 LEU 89 2HB LEU 89 2.013 -14.550 -0.646 2221 HB3 LEU 89 1HB LEU 89 1.869 -14.432 1.137 2222 HG LEU 89 HG LEU 89 4.244 -13.440 -0.570 2223 HD11 LEU 89 1HD1 LEU 89 2.075 -11.820 0.909 2224 HD12 LEU 89 2HD1 LEU 89 2.165 -12.090 -0.874 2225 HD13 LEU 89 3HD1 LEU 89 3.463 -11.170 -0.040 2226 HD21 LEU 89 3HD2 LEU 89 3.789 -13.216 2.472 2227 HD22 LEU 89 1HD2 LEU 89 5.034 -12.312 1.537 2228 HD23 LEU 89 2HD2 LEU 89 5.118 -14.100 1.633 2229 H ALA 90 H ALA 90 2.143 -16.938 -1.615 2230 HA ALA 90 HA ALA 90 -0.037 -18.123 -0.259 2231 HB1 ALA 90 1HB ALA 90 -0.569 -19.164 -2.474 2232 HB2 ALA 90 2HB ALA 90 1.048 -18.646 -3.096 2233 HB3 ALA 90 3HB ALA 90 -0.182 -17.416 -2.655 2234 H THR 91 H THR 91 3.214 -19.289 -1.056 2235 HA THR 91 HA THR 91 2.378 -22.023 -0.552 2236 HB THR 91 HB THR 91 4.051 -21.584 -2.311 2237 HG1 THR 91 1HG THR 91 4.526 -23.231 -0.122 2238 HG21 THR 91 3HG2 THR 91 5.324 -19.756 -1.212 2239 HG22 THR 91 1HG2 THR 91 6.399 -21.093 -1.714 2240 HG23 THR 91 2HG2 THR 91 5.965 -20.888 0.027 2241 H ASP 92 H ASP 92 3.340 -19.255 1.487 2242 HA ASP 92 HA ASP 92 4.981 -20.964 3.034 2243 HB2 ASP 92 2HB ASP 92 5.435 -18.491 3.117 2244 HB3 ASP 92 1HB ASP 92 4.062 -18.371 4.282 2245 H PHE 93 H PHE 93 1.507 -20.260 3.202 2246 HA PHE 93 HA PHE 93 1.345 -21.447 5.804 2247 HB2 PHE 93 2HB PHE 93 -1.020 -21.600 5.620 2248 HB3 PHE 93 1HB PHE 93 -0.501 -20.041 4.919 2249 HD1 PHE 93 1HD PHE 93 -0.726 -19.644 2.463 2250 HD2 PHE 93 2HD PHE 93 -1.991 -23.339 4.258 2251 HE1 PHE 93 1HE PHE 93 -2.005 -20.212 0.426 2252 HE2 PHE 93 2HE PHE 93 -3.261 -23.903 2.204 2253 HZ PHE 93 HZ PHE 93 -3.246 -22.326 0.277 2254 H VAL 94 H VAL 94 1.674 -22.760 2.579 2255 HA VAL 94 HA VAL 94 0.399 -25.222 3.044 2256 HB VAL 94 HB VAL 94 2.555 -24.571 0.974 2257 HG11 VAL 94 1HG1 VAL 94 1.379 -26.370 -0.359 2258 HG12 VAL 94 2HG1 VAL 94 0.310 -26.711 1.049 2259 HG13 VAL 94 3HG1 VAL 94 2.079 -27.026 1.158 2260 HG21 VAL 94 3HG2 VAL 94 -0.525 -24.214 0.872 2261 HG22 VAL 94 1HG2 VAL 94 0.597 -24.001 -0.517 2262 HG23 VAL 94 2HG2 VAL 94 0.678 -22.880 0.874 2263 H ARG 95 H ARG 95 3.470 -23.881 3.922 2264 HA ARG 95 HA ARG 95 4.958 -26.226 4.202 2265 HB2 ARG 95 2HB ARG 95 5.802 -23.831 4.132 2266 HB3 ARG 95 1HB ARG 95 5.175 -23.615 5.796 2267 HG2 ARG 95 2HG ARG 95 6.778 -25.245 6.671 2268 HG3 ARG 95 1HG ARG 95 7.259 -25.773 5.031 2269 HD2 ARG 95 2HD ARG 95 8.924 -24.180 6.227 2270 HD3 ARG 95 1HD ARG 95 8.408 -23.673 4.570 2271 HE ARG 95 HE ARG 95 7.182 -21.842 5.459 2272 HH11 ARG 95 1HH2 ARG 95 8.143 -24.055 8.284 2273 HH12 ARG 95 2HH2 ARG 95 7.920 -22.770 9.387 2274 HH21 ARG 95 1HH1 ARG 95 6.474 -20.415 7.072 2275 HH22 ARG 95 2HH1 ARG 95 6.498 -20.913 8.713 2276 H ARG 96 H ARG 96 2.222 -25.060 6.035 2277 HA ARG 96 HA ARG 96 2.959 -26.270 8.490 2278 HB2 ARG 96 2HB ARG 96 0.777 -25.799 9.296 2279 HB3 ARG 96 1HB ARG 96 1.152 -24.457 8.161 2280 HG2 ARG 96 2HG ARG 96 -0.165 -25.825 6.368 2281 HG3 ARG 96 1HG ARG 96 -0.658 -26.908 7.705 2282 HD2 ARG 96 2HD ARG 96 -1.775 -24.924 8.874 2283 HD3 ARG 96 1HD ARG 96 -1.308 -23.901 7.455 2284 HE ARG 96 HE ARG 96 -2.968 -24.901 6.188 2285 HH11 ARG 96 1HH2 ARG 96 -2.558 -26.916 9.184 2286 HH12 ARG 96 2HH2 ARG 96 -3.622 -28.137 8.653 2287 HH21 ARG 96 1HH1 ARG 96 -4.571 -26.565 5.572 2288 HH22 ARG 96 2HH1 ARG 96 -4.901 -27.862 6.601 2289 H GLU 97 H GLU 97 1.757 -27.641 5.457 2290 HA GLU 97 HA GLU 97 0.713 -29.966 6.916 2291 HB2 GLU 97 2HB GLU 97 0.508 -29.420 3.928 2292 HB3 GLU 97 1HB GLU 97 -0.155 -30.812 4.847 2293 HG2 GLU 97 2HG GLU 97 -1.252 -28.819 6.355 2294 HG3 GLU 97 1HG GLU 97 -1.076 -27.896 4.820 2295 H GLU 98 H GLU 98 3.605 -28.813 5.551 2296 HA GLU 98 HA GLU 98 4.694 -31.548 5.404 2297 HB2 GLU 98 2HB GLU 98 5.545 -28.868 4.176 2298 HB3 GLU 98 1HB GLU 98 6.738 -30.182 4.380 2299 HG2 GLU 98 2HG GLU 98 4.098 -30.543 2.801 2300 HG3 GLU 98 1HG GLU 98 5.687 -30.091 2.072 2301 H GLU 99 H GLU 99 7.252 -30.984 6.193 2302 HA GLU 99 HA GLU 99 8.624 -30.504 7.800 2303 HB2 GLU 99 2HB GLU 99 8.082 -28.206 7.071 2304 HB3 GLU 99 1HB GLU 99 6.860 -28.050 8.360 2305 HG2 GLU 99 2HG GLU 99 8.573 -28.032 10.093 2306 HG3 GLU 99 1HG GLU 99 9.826 -28.662 8.959 2307 H ARG 100 H ARG 100 5.501 -29.728 9.230 2308 HA ARG 100 HA ARG 100 5.914 -30.571 11.854 2309 HB2 ARG 100 2HB ARG 100 4.172 -28.980 11.054 2310 HB3 ARG 100 1HB ARG 100 3.381 -30.291 10.118 2311 HG2 ARG 100 2HG ARG 100 2.695 -31.412 12.234 2312 HG3 ARG 100 1HG ARG 100 3.690 -30.269 13.191 2313 HD2 ARG 100 2HD ARG 100 1.229 -29.659 13.259 2314 HD3 ARG 100 1HD ARG 100 2.253 -28.365 12.543 2315 HE ARG 100 HE ARG 100 1.574 -29.001 10.306 2316 HH11 ARG 100 1HH2 ARG 100 -0.369 -30.829 12.807 2317 HH12 ARG 100 2HH2 ARG 100 -1.729 -30.983 11.785 2318 HH21 ARG 100 1HH1 ARG 100 -0.166 -29.374 8.947 2319 HH22 ARG 100 2HH1 ARG 100 -1.621 -30.138 9.428 2320 H ARG 101 H ARG 101 4.825 -32.257 8.948 2321 HA ARG 101 HA ARG 101 3.964 -34.673 10.176 2322 HB2 ARG 101 2HB ARG 101 4.498 -33.640 7.419 2323 HB3 ARG 101 1HB ARG 101 5.015 -35.343 7.591 2324 HG2 ARG 101 2HG ARG 101 2.768 -35.297 6.770 2325 HG3 ARG 101 1HG ARG 101 2.832 -36.022 8.415 2326 HD2 ARG 101 2HD ARG 101 1.949 -33.751 9.353 2327 HD3 ARG 101 1HD ARG 101 1.784 -33.204 7.641 2328 HE ARG 101 HE ARG 101 0.239 -34.947 7.182 2329 HH11 ARG 101 1HH2 ARG 101 1.082 -34.885 10.764 2330 HH12 ARG 101 2HH2 ARG 101 0.209 -36.318 11.065 2331 HH21 ARG 101 1HH1 ARG 101 -0.930 -36.926 7.787 2332 HH22 ARG 101 2HH1 ARG 101 -1.309 -37.235 9.419 2333 H GLY 102 H GLY 102 7.127 -33.473 9.042 2334 HA2 GLY 102 2HA GLY 102 9.178 -34.300 9.231 2335 HA3 GLY 102 1HA GLY 102 8.546 -35.520 10.411 2336 H HIS 103 H HIS 103 8.206 -34.705 6.882 2337 HA HIS 103 HA HIS 103 8.328 -37.594 6.316 2338 HB2 HIS 103 2HB HIS 103 6.103 -36.566 5.613 2339 HB3 HIS 103 1HB HIS 103 7.013 -35.376 4.624 2340 HD1 HIS 103 1HD HIS 103 7.174 -36.125 2.236 2341 HD2 HIS 103 2HD HIS 103 6.821 -39.427 4.834 2342 HE1 HIS 103 1HE HIS 103 7.083 -38.233 0.800 2343 HE2 HIS 103 2HE HIS 103 6.854 -40.198 2.392 2344 H1 SER 1 H SER 1 -2.598 -25.347 19.017 2345 HA SER 1 HA SER 1 -4.479 -24.337 18.148 2346 HB2 SER 1 2HB SER 1 -3.884 -23.334 20.408 2347 HB3 SER 1 1HB SER 1 -2.991 -22.023 19.563 2348 HG SER 1 1HG SER 1 -4.842 -21.302 18.720 2349 H ALA 2 H ALA 2 -3.744 -24.592 15.898 2350 HA ALA 2 HA ALA 2 -3.627 -23.886 13.844 2351 HB1 ALA 2 1HB ALA 2 -5.681 -22.613 14.492 2352 HB2 ALA 2 2HB ALA 2 -4.765 -21.775 13.201 2353 HB3 ALA 2 3HB ALA 2 -4.656 -21.197 14.894 2354 H ASP 3 H ASP 3 -1.157 -24.081 14.322 2355 HA ASP 3 HA ASP 3 0.449 -22.046 14.868 2356 HB2 ASP 3 2HB ASP 3 0.939 -24.479 13.071 2357 HB3 ASP 3 1HB ASP 3 2.254 -23.287 13.375 2358 H HIS 4 H HIS 4 -0.966 -22.485 11.703 2359 HA HIS 4 HA HIS 4 0.668 -20.721 10.290 2360 HB2 HIS 4 2HB HIS 4 -0.975 -20.593 8.594 2361 HB3 HIS 4 1HB HIS 4 -1.132 -22.239 9.268 2362 HD1 HIS 4 1HD HIS 4 -3.277 -21.625 11.622 2363 HD2 HIS 4 2HD HIS 4 -3.372 -19.742 7.856 2364 HE1 HIS 4 1HE HIS 4 -5.577 -20.742 11.294 2365 HE2 HIS 4 2HE HIS 4 -5.505 -19.341 9.209 2366 H GLU 5 H GLU 5 -1.943 -19.952 12.630 2367 HA GLU 5 HA GLU 5 -2.152 -17.184 11.798 2368 HB2 GLU 5 2HB GLU 5 -3.286 -18.884 14.098 2369 HB3 GLU 5 1HB GLU 5 -3.418 -17.107 14.140 2370 HG2 GLU 5 2HG GLU 5 -4.973 -16.938 12.463 2371 HG3 GLU 5 1HG GLU 5 -4.428 -18.421 11.609 2372 H ARG 6 H ARG 6 -0.774 -19.248 14.362 2373 HA ARG 6 HA ARG 6 0.121 -17.238 16.008 2374 HB2 ARG 6 2HB ARG 6 0.002 -19.699 16.600 2375 HB3 ARG 6 1HB ARG 6 1.389 -19.979 15.498 2376 HG2 ARG 6 2HG ARG 6 2.694 -18.289 17.055 2377 HG3 ARG 6 1HG ARG 6 1.321 -18.440 18.180 2378 HD2 ARG 6 2HD ARG 6 3.362 -19.966 18.687 2379 HD3 ARG 6 1HD ARG 6 1.772 -20.813 18.555 2380 HE ARG 6 HE ARG 6 2.618 -22.053 16.811 2381 HH11 ARG 6 1HH2 ARG 6 4.594 -19.002 16.705 2382 HH12 ARG 6 2HH2 ARG 6 5.347 -19.441 15.209 2383 HH21 ARG 6 1HH1 ARG 6 3.684 -22.585 14.951 2384 HH22 ARG 6 2HH1 ARG 6 4.721 -21.449 14.112 2385 H GLU 7 H GLU 7 1.740 -18.769 13.173 2386 HA GLU 7 HA GLU 7 4.154 -17.405 13.582 2387 HB2 GLU 7 2HB GLU 7 3.359 -19.416 11.836 2388 HB3 GLU 7 1HB GLU 7 3.515 -18.029 10.721 2389 HG2 GLU 7 2HG GLU 7 5.732 -18.977 10.768 2390 HG3 GLU 7 1HG GLU 7 5.842 -17.591 11.899 2391 H ALA 8 H ALA 8 1.148 -16.427 12.018 2392 HA ALA 8 HA ALA 8 2.235 -14.197 10.625 2393 HB1 ALA 8 1HB ALA 8 -0.009 -15.151 9.998 2394 HB2 ALA 8 2HB ALA 8 -0.148 -13.415 10.462 2395 HB3 ALA 8 3HB ALA 8 -0.652 -14.690 11.618 2396 H GLN 9 H GLN 9 0.780 -14.731 13.856 2397 HA GLN 9 HA GLN 9 0.828 -12.013 14.580 2398 HB2 GLN 9 2HB GLN 9 -0.576 -13.665 15.786 2399 HB3 GLN 9 1HB GLN 9 0.890 -14.543 16.324 2400 HG2 GLN 9 2HG GLN 9 -0.103 -13.234 18.156 2401 HG3 GLN 9 1HG GLN 9 1.545 -12.629 17.791 2402 HE21 GLN 9 1HE2 GLN 9 1.664 -10.605 16.372 2403 HE22 GLN 9 2HE2 GLN 9 0.419 -9.416 16.477 2404 H LYS 10 H LYS 10 3.261 -14.629 14.848 2405 HA LYS 10 HA LYS 10 5.006 -13.110 16.461 2406 HB2 LYS 10 2HB LYS 10 5.076 -15.604 16.289 2407 HB3 LYS 10 1HB LYS 10 5.760 -15.453 14.631 2408 HG2 LYS 10 2HG LYS 10 7.764 -14.354 15.485 2409 HG3 LYS 10 1HG LYS 10 7.017 -14.109 17.103 2410 HD2 LYS 10 2HD LYS 10 7.167 -16.505 17.618 2411 HD3 LYS 10 1HD LYS 10 7.649 -16.890 15.928 2412 HE2 LYS 10 2HE LYS 10 9.642 -16.897 17.483 2413 HE3 LYS 10 1HE LYS 10 9.773 -15.679 16.157 2414 HZ1 LYS 10 3HZ LYS 10 8.843 -14.042 17.958 2415 HZ2 LYS 10 1HZ LYS 10 10.455 -14.556 17.962 2416 HZ3 LYS 10 2HZ LYS 10 9.315 -15.195 19.055 2417 H ALA 11 H ALA 11 4.392 -13.064 12.989 2418 HA ALA 11 HA ALA 11 6.813 -11.912 12.182 2419 HB1 ALA 11 1HB ALA 11 4.018 -11.374 10.997 2420 HB2 ALA 11 2HB ALA 11 5.082 -12.759 10.551 2421 HB3 ALA 11 3HB ALA 11 5.601 -11.074 10.191 2422 H GLU 12 H GLU 12 3.859 -10.423 13.646 2423 HA GLU 12 HA GLU 12 4.614 -7.766 13.137 2424 HB2 GLU 12 2HB GLU 12 3.048 -8.770 15.594 2425 HB3 GLU 12 1HB GLU 12 3.236 -7.063 15.061 2426 HG2 GLU 12 2HG GLU 12 2.044 -7.757 12.855 2427 HG3 GLU 12 1HG GLU 12 1.584 -9.281 13.712 2428 H GLU 13 H GLU 13 5.652 -10.058 15.578 2429 HA GLU 13 HA GLU 13 6.699 -8.269 17.489 2430 HB2 GLU 13 2HB GLU 13 6.211 -10.851 17.723 2431 HB3 GLU 13 1HB GLU 13 7.701 -11.097 16.773 2432 HG2 GLU 13 2HG GLU 13 8.812 -9.620 18.742 2433 HG3 GLU 13 1HG GLU 13 7.363 -10.156 19.662 2434 H GLU 14 H GLU 14 7.869 -9.712 14.479 2435 HA GLU 14 HA GLU 14 10.614 -9.241 14.865 2436 HB2 GLU 14 2HB GLU 14 9.563 -10.947 13.291 2437 HB3 GLU 14 1HB GLU 14 9.077 -9.600 12.218 2438 HG2 GLU 14 2HG GLU 14 11.480 -9.029 11.816 2439 HG3 GLU 14 1HG GLU 14 11.989 -10.337 12.956 2440 H LEU 15 H LEU 15 7.950 -7.468 13.301 2441 HA LEU 15 HA LEU 15 9.477 -5.427 12.194 2442 HB2 LEU 15 2HB LEU 15 7.118 -5.733 11.563 2443 HB3 LEU 15 1HB LEU 15 6.577 -5.308 13.218 2444 HG LEU 15 HG LEU 15 7.311 -2.979 12.914 2445 HD11 LEU 15 1HD1 LEU 15 9.353 -3.100 11.610 2446 HD12 LEU 15 2HD1 LEU 15 8.172 -2.221 10.590 2447 HD13 LEU 15 3HD1 LEU 15 8.534 -3.955 10.264 2448 HD21 LEU 15 3HD2 LEU 15 5.715 -4.015 10.486 2449 HD22 LEU 15 1HD2 LEU 15 5.773 -2.307 11.047 2450 HD23 LEU 15 2HD2 LEU 15 5.061 -3.580 12.102 2451 H GLN 16 H GLN 16 7.946 -5.679 15.455 2452 HA GLN 16 HA GLN 16 8.460 -3.136 16.336 2453 HB2 GLN 16 2HB GLN 16 8.641 -5.695 18.027 2454 HB3 GLN 16 1HB GLN 16 8.715 -4.017 18.661 2455 HG2 GLN 16 2HG GLN 16 6.400 -3.594 17.623 2456 HG3 GLN 16 1HG GLN 16 6.315 -5.349 17.238 2457 HE21 GLN 16 1HE2 GLN 16 7.783 -3.848 20.239 2458 HE22 GLN 16 2HE2 GLN 16 6.714 -4.657 21.336 2459 H LYS 17 H LYS 17 10.773 -5.879 16.278 2460 HA LYS 17 HA LYS 17 12.701 -4.387 17.765 2461 HB2 LYS 17 2HB LYS 17 12.840 -7.019 16.232 2462 HB3 LYS 17 1HB LYS 17 14.249 -6.322 17.109 2463 HG2 LYS 17 2HG LYS 17 13.056 -6.279 19.224 2464 HG3 LYS 17 1HG LYS 17 11.529 -6.848 18.482 2465 HD2 LYS 17 2HD LYS 17 14.080 -8.572 18.382 2466 HD3 LYS 17 1HD LYS 17 13.024 -8.490 19.837 2467 HE2 LYS 17 2HE LYS 17 11.025 -9.147 18.455 2468 HE3 LYS 17 1HE LYS 17 12.104 -9.434 17.035 2469 HZ1 LYS 17 3HZ LYS 17 11.399 -11.281 18.728 2470 HZ2 LYS 17 1HZ LYS 17 12.751 -10.755 19.604 2471 HZ3 LYS 17 2HZ LYS 17 12.958 -11.304 17.998 2472 H VAL 18 H VAL 18 11.812 -4.215 14.436 2473 HA VAL 18 HA VAL 18 14.426 -3.087 13.706 2474 HB VAL 18 HB VAL 18 11.968 -3.585 11.943 2475 HG11 VAL 18 1HG1 VAL 18 13.689 -3.267 10.097 2476 HG12 VAL 18 2HG1 VAL 18 14.915 -2.823 11.332 2477 HG13 VAL 18 3HG1 VAL 18 13.469 -1.779 11.074 2478 HG21 VAL 18 3HG2 VAL 18 12.848 -5.756 12.789 2479 HG22 VAL 18 1HG2 VAL 18 14.533 -5.265 12.375 2480 HG23 VAL 18 2HG2 VAL 18 13.319 -5.536 11.074 2481 H LEU 19 H LEU 19 10.924 -2.397 13.875 2482 HA LEU 19 HA LEU 19 10.800 0.258 13.180 2483 HB2 LEU 19 2HB LEU 19 8.732 -0.916 13.436 2484 HB3 LEU 19 1HB LEU 19 9.274 -1.663 14.964 2485 HG LEU 19 HG LEU 19 8.874 0.378 16.241 2486 HD11 LEU 19 1HD1 LEU 19 7.552 1.613 13.749 2487 HD12 LEU 19 2HD1 LEU 19 9.177 2.081 14.350 2488 HD13 LEU 19 3HD1 LEU 19 7.727 2.331 15.382 2489 HD21 LEU 19 3HD2 LEU 19 6.444 -0.545 14.583 2490 HD22 LEU 19 1HD2 LEU 19 6.386 0.301 16.172 2491 HD23 LEU 19 2HD2 LEU 19 7.103 -1.347 16.057 2492 H GLU 20 H GLU 20 11.340 -1.179 16.480 2493 HA GLU 20 HA GLU 20 11.442 1.437 17.597 2494 HB2 GLU 20 2HB GLU 20 12.196 -1.276 18.790 2495 HB3 GLU 20 1HB GLU 20 12.101 0.266 19.710 2496 HG2 GLU 20 2HG GLU 20 9.673 0.468 19.252 2497 HG3 GLU 20 1HG GLU 20 9.708 -0.995 18.203 2498 H GLU 21 H GLU 21 13.787 -0.511 15.974 2499 HA GLU 21 HA GLU 21 16.090 0.703 17.227 2500 HB2 GLU 21 2HB GLU 21 16.325 -1.569 16.314 2501 HB3 GLU 21 1HB GLU 21 15.700 -1.033 14.726 2502 HG2 GLU 21 2HG GLU 21 18.087 -1.381 14.544 2503 HG3 GLU 21 1HG GLU 21 17.720 0.374 14.370 2504 H ALA 22 H ALA 22 13.875 1.205 14.501 2505 HA ALA 22 HA ALA 22 15.281 3.046 13.028 2506 HB1 ALA 22 1HB ALA 22 12.992 2.037 12.417 2507 HB2 ALA 22 2HB ALA 22 13.162 3.806 12.089 2508 HB3 ALA 22 3HB ALA 22 12.242 3.242 13.516 2509 H SER 23 H SER 23 13.153 3.589 15.875 2510 HA SER 23 HA SER 23 13.173 6.329 15.897 2511 HB2 SER 23 2HB SER 23 13.311 4.527 18.409 2512 HB3 SER 23 1HB SER 23 12.464 6.114 18.238 2513 HG SER 23 1HG SER 23 11.161 4.153 18.106 2514 H LYS 24 H LYS 24 15.541 4.035 17.254 2515 HA LYS 24 HA LYS 24 16.981 5.987 18.727 2516 HB2 LYS 24 2HB LYS 24 16.977 3.582 19.329 2517 HB3 LYS 24 1HB LYS 24 17.765 3.161 17.779 2518 HG2 LYS 24 2HG LYS 24 19.274 5.225 19.338 2519 HG3 LYS 24 1HG LYS 24 19.014 3.732 20.280 2520 HD2 LYS 24 2HD LYS 24 20.113 3.644 17.412 2521 HD3 LYS 24 1HD LYS 24 21.177 3.909 18.840 2522 HE2 LYS 24 2HE LYS 24 20.542 1.776 19.853 2523 HE3 LYS 24 1HE LYS 24 19.259 1.498 18.618 2524 HZ1 LYS 24 3HZ LYS 24 21.596 0.409 18.471 2525 HZ2 LYS 24 1HZ LYS 24 22.008 1.845 17.635 2526 HZ3 LYS 24 2HZ LYS 24 20.697 0.858 17.089 2527 H LYS 25 H LYS 25 17.220 4.510 15.498 2528 HA LYS 25 HA LYS 25 19.667 5.781 14.810 2529 HB2 LYS 25 2HB LYS 25 17.428 4.589 13.065 2530 HB3 LYS 25 1HB LYS 25 18.981 5.221 12.412 2531 HG2 LYS 25 2HG LYS 25 20.268 3.547 13.672 2532 HG3 LYS 25 1HG LYS 25 18.783 2.905 14.445 2533 HD2 LYS 25 2HD LYS 25 17.929 2.067 12.314 2534 HD3 LYS 25 1HD LYS 25 19.266 2.864 11.395 2535 HE2 LYS 25 2HE LYS 25 20.961 1.414 12.457 2536 HE3 LYS 25 1HE LYS 25 19.735 0.687 13.540 2537 HZ1 LYS 25 3HZ LYS 25 18.732 -0.426 11.562 2538 HZ2 LYS 25 1HZ LYS 25 20.375 -0.725 11.799 2539 HZ3 LYS 25 2HZ LYS 25 19.927 0.285 10.582 2540 H ALA 26 H ALA 26 16.207 6.528 14.084 2541 HA ALA 26 HA ALA 26 16.641 8.600 12.357 2542 HB1 ALA 26 1HB ALA 26 14.249 8.232 14.271 2543 HB2 ALA 26 2HB ALA 26 14.425 7.467 12.652 2544 HB3 ALA 26 3HB ALA 26 14.268 9.251 12.781 2545 H VAL 27 H VAL 27 16.258 8.738 15.945 2546 HA VAL 27 HA VAL 27 16.180 11.554 15.945 2547 HB VAL 27 HB VAL 27 15.277 10.146 17.747 2548 HG11 VAL 27 1HG1 VAL 27 17.200 8.484 17.826 2549 HG12 VAL 27 2HG1 VAL 27 16.720 9.113 19.427 2550 HG13 VAL 27 3HG1 VAL 27 18.209 9.734 18.638 2551 HG21 VAL 27 3HG2 VAL 27 15.694 12.578 18.075 2552 HG22 VAL 27 1HG2 VAL 27 17.367 12.236 18.657 2553 HG23 VAL 27 2HG2 VAL 27 15.949 11.657 19.605 2554 H GLU 28 H GLU 28 18.851 9.219 15.964 2555 HA GLU 28 HA GLU 28 20.830 11.126 16.706 2556 HB2 GLU 28 2HB GLU 28 20.782 8.441 16.871 2557 HB3 GLU 28 1HB GLU 28 21.391 8.518 15.202 2558 HG2 GLU 28 2HG GLU 28 23.362 8.340 16.492 2559 HG3 GLU 28 1HG GLU 28 23.260 10.114 16.179 2560 H ALA 29 H ALA 29 19.473 9.755 13.774 2561 HA ALA 29 HA ALA 29 21.275 10.613 11.876 2562 HB1 ALA 29 1HB ALA 29 19.536 9.963 10.306 2563 HB2 ALA 29 2HB ALA 29 18.237 10.226 11.520 2564 HB3 ALA 29 3HB ALA 29 19.404 8.858 11.680 2565 H GLU 30 H GLU 30 18.313 12.189 13.190 2566 HA GLU 30 HA GLU 30 18.763 14.506 11.531 2567 HB2 GLU 30 2HB GLU 30 16.648 13.737 13.557 2568 HB3 GLU 30 1HB GLU 30 16.717 15.377 12.841 2569 HG2 GLU 30 2HG GLU 30 16.811 12.991 10.919 2570 HG3 GLU 30 1HG GLU 30 15.253 13.398 11.711 2571 H ARG 31 H ARG 31 19.659 13.586 14.835 2572 HA ARG 31 HA ARG 31 20.041 16.263 15.744 2573 HB2 ARG 31 2HB ARG 31 21.102 13.542 16.626 2574 HB3 ARG 31 1HB ARG 31 21.764 15.031 17.370 2575 HG2 ARG 31 2HG ARG 31 18.745 14.558 17.336 2576 HG3 ARG 31 1HG ARG 31 19.806 13.756 18.538 2577 HD2 ARG 31 2HD ARG 31 20.672 16.032 19.309 2578 HD3 ARG 31 1HD ARG 31 19.608 16.817 18.093 2579 HE ARG 31 HE ARG 31 17.909 16.676 19.534 2580 HH11 ARG 31 1HH2 ARG 31 20.328 14.199 20.657 2581 HH12 ARG 31 2HH2 ARG 31 19.366 13.644 21.959 2582 HH21 ARG 31 1HH1 ARG 31 17.042 16.393 21.713 2583 HH22 ARG 31 2HH1 ARG 31 17.603 15.199 22.738 2584 H GLY 32 H GLY 32 21.044 17.261 13.920 2585 HA2 GLY 32 2HA GLY 32 23.363 18.211 13.966 2586 HA3 GLY 32 1HA GLY 32 23.855 16.557 13.450 2587 H ALA 33 H ALA 33 20.805 17.013 12.152 2588 HA ALA 33 HA ALA 33 21.909 17.128 9.585 2589 HB1 ALA 33 1HB ALA 33 18.996 17.198 10.601 2590 HB2 ALA 33 2HB ALA 33 19.918 15.743 10.085 2591 HB3 ALA 33 3HB ALA 33 19.449 16.986 8.882 2592 HA PRO 34 HA PRO 34 21.117 21.496 8.741 2593 HB2 PRO 34 2HB PRO 34 20.708 21.480 5.963 2594 HB3 PRO 34 1HB PRO 34 22.326 21.182 6.696 2595 HG2 PRO 34 2HG PRO 34 20.289 19.091 5.771 2596 HG3 PRO 34 1HG PRO 34 22.057 19.172 5.383 2597 HD2 PRO 34 2HD PRO 34 21.065 17.587 7.416 2598 HD3 PRO 34 1HD PRO 34 22.653 18.456 7.619 2599 H GLY 35 H GLY 35 19.188 22.703 9.093 2600 HA2 GLY 35 2HA GLY 35 17.097 23.393 8.597 2601 HA3 GLY 35 1HA GLY 35 16.831 21.950 7.540 2602 H ALA 36 H ALA 36 17.275 19.875 8.895 2603 HA ALA 36 HA ALA 36 16.514 18.360 10.194 2604 HB1 ALA 36 1HB ALA 36 17.708 19.462 12.091 2605 HB2 ALA 36 2HB ALA 36 16.213 18.615 12.617 2606 HB3 ALA 36 3HB ALA 36 16.217 20.413 12.453 2607 H ALA 37 H ALA 37 14.533 17.478 11.272 2608 HA ALA 37 HA ALA 37 12.170 19.216 11.050 2609 HB1 ALA 37 1HB ALA 37 12.287 18.027 8.821 2610 HB2 ALA 37 2HB ALA 37 10.939 17.371 9.813 2611 HB3 ALA 37 3HB ALA 37 12.497 16.462 9.668 2612 H LEU 38 H LEU 38 13.576 15.957 11.763 2613 HA LEU 38 HA LEU 38 11.455 15.620 13.782 2614 HB2 LEU 38 2HB LEU 38 11.791 13.794 12.000 2615 HB3 LEU 38 1HB LEU 38 13.433 13.558 12.665 2616 HG LEU 38 HG LEU 38 12.371 12.992 14.924 2617 HD11 LEU 38 1HD1 LEU 38 9.751 13.007 13.282 2618 HD12 LEU 38 2HD1 LEU 38 10.150 14.122 14.641 2619 HD13 LEU 38 3HD1 LEU 38 9.929 12.375 14.954 2620 HD21 LEU 38 3HD2 LEU 38 13.210 11.258 13.412 2621 HD22 LEU 38 1HD2 LEU 38 11.680 11.269 12.472 2622 HD23 LEU 38 2HD2 LEU 38 11.685 10.675 14.172 2623 H ILE 39 H ILE 39 12.069 15.432 16.025 2624 HA ILE 39 HA ILE 39 14.846 15.228 16.654 2625 HB ILE 39 HB ILE 39 14.631 17.256 18.233 2626 HG12 ILE 39 2HG1 ILE 39 12.365 18.101 16.305 2627 HG13 ILE 39 1HG1 ILE 39 12.080 17.476 17.956 2628 HG21 ILE 39 1HG2 ILE 39 16.022 17.249 16.093 2629 HG22 ILE 39 2HG2 ILE 39 15.402 18.890 16.526 2630 HG23 ILE 39 3HG2 ILE 39 14.621 17.943 15.219 2631 HD11 ILE 39 3HD ILE 39 13.613 20.057 17.228 2632 HD12 ILE 39 1HD ILE 39 11.997 19.926 18.002 2633 HD13 ILE 39 2HD ILE 39 13.464 19.392 18.900 2634 H SER 40 H SER 40 14.867 15.043 19.118 2635 HA SER 40 HA SER 40 14.174 14.469 21.052 2636 HB2 SER 40 2HB SER 40 11.267 15.059 20.284 2637 HB3 SER 40 1HB SER 40 11.936 14.880 21.942 2638 HG SER 40 1HG SER 40 12.365 16.888 20.010 2639 H TYR 41 H TYR 41 14.000 12.520 22.055 2640 HA TYR 41 HA TYR 41 13.483 10.239 20.627 2641 HB2 TYR 41 2HB TYR 41 13.299 10.381 23.703 2642 HB3 TYR 41 1HB TYR 41 13.741 8.975 22.678 2643 HD1 TYR 41 2HD TYR 41 15.888 9.016 21.417 2644 HD2 TYR 41 1HD TYR 41 14.906 12.089 24.264 2645 HE1 TYR 41 2HE TYR 41 18.229 9.769 21.406 2646 HE2 TYR 41 1HE TYR 41 17.256 12.824 24.279 2647 HH TYR 41 HH TYR 41 19.762 10.924 22.908 2648 HA PRO 42 HA PRO 42 9.299 9.606 22.554 2649 HB2 PRO 42 2HB PRO 42 7.751 11.681 23.654 2650 HB3 PRO 42 1HB PRO 42 8.912 10.686 24.611 2651 HG2 PRO 42 2HG PRO 42 9.416 13.418 23.285 2652 HG3 PRO 42 1HG PRO 42 9.776 12.946 24.994 2653 HD2 PRO 42 2HD PRO 42 11.718 12.880 23.085 2654 HD3 PRO 42 1HD PRO 42 11.609 11.519 24.292 2655 H ASP 43 H ASP 43 10.022 12.392 20.608 2656 HA ASP 43 HA ASP 43 7.404 12.406 19.312 2657 HB2 ASP 43 2HB ASP 43 10.024 13.971 18.941 2658 HB3 ASP 43 1HB ASP 43 8.883 13.872 17.569 2659 H ALA 44 H ALA 44 10.846 11.601 18.705 2660 HA ALA 44 HA ALA 44 10.644 10.821 16.115 2661 HB1 ALA 44 1HB ALA 44 12.842 11.146 17.246 2662 HB2 ALA 44 2HB ALA 44 12.768 9.534 16.454 2663 HB3 ALA 44 3HB ALA 44 12.552 9.671 18.243 2664 H ILE 45 H ILE 45 10.000 8.870 19.033 2665 HA ILE 45 HA ILE 45 9.877 6.459 17.591 2666 HB ILE 45 HB ILE 45 10.319 6.408 19.919 2667 HG12 ILE 45 2HG1 ILE 45 7.577 5.084 19.446 2668 HG13 ILE 45 1HG1 ILE 45 9.129 4.464 18.808 2669 HG21 ILE 45 1HG2 ILE 45 7.505 7.603 20.377 2670 HG22 ILE 45 2HG2 ILE 45 9.069 8.422 20.633 2671 HG23 ILE 45 3HG2 ILE 45 8.630 7.022 21.650 2672 HD11 ILE 45 3HD ILE 45 8.393 4.807 21.796 2673 HD12 ILE 45 1HD ILE 45 8.547 3.263 20.889 2674 HD13 ILE 45 2HD ILE 45 10.007 4.275 21.192 2675 H TRP 46 H TRP 46 7.482 9.046 17.975 2676 HA TRP 46 HA TRP 46 5.341 7.272 17.163 2677 HB2 TRP 46 2HB TRP 46 5.602 10.021 18.215 2678 HB3 TRP 46 1HB TRP 46 4.451 9.937 16.867 2679 HD1 TRP 46 HD TRP 46 2.263 10.172 18.063 2680 HE1 TRP 46 1HE TRP 46 1.262 9.433 20.264 2681 HE3 TRP 46 3HE TRP 46 5.806 6.773 19.441 2682 HZ2 TRP 46 2HZ TRP 46 1.639 7.273 22.146 2683 HZ3 TRP 46 3HZ TRP 46 5.431 5.379 21.432 2684 HH2 TRP 46 HH TRP 46 3.376 5.627 22.780 2685 H TRP 47 H TRP 47 7.578 9.556 15.661 2686 HA TRP 47 HA TRP 47 6.473 9.533 13.057 2687 HB2 TRP 47 2HB TRP 47 8.212 11.152 13.737 2688 HB3 TRP 47 1HB TRP 47 9.359 9.821 14.104 2689 HD1 TRP 47 HD TRP 47 7.879 11.704 11.036 2690 HE1 TRP 47 1HE TRP 47 8.984 10.821 9.010 2691 HE3 TRP 47 3HE TRP 47 10.816 8.106 13.149 2692 HZ2 TRP 47 2HZ TRP 47 11.327 9.233 8.306 2693 HZ3 TRP 47 3HZ TRP 47 12.395 6.859 11.727 2694 HH2 TRP 47 HH TRP 47 12.667 7.430 9.332 2695 H SER 48 H SER 48 8.811 7.346 14.791 2696 HA SER 48 HA SER 48 9.326 5.747 12.612 2697 HB2 SER 48 2HB SER 48 9.157 4.782 15.528 2698 HB3 SER 48 1HB SER 48 10.070 4.005 14.182 2699 HG SER 48 1HG SER 48 11.240 5.349 15.658 2700 H VAL 49 H VAL 49 6.572 5.624 14.899 2701 HA VAL 49 HA VAL 49 5.665 3.068 14.241 2702 HB VAL 49 HB VAL 49 4.192 5.526 15.285 2703 HG11 VAL 49 1HG1 VAL 49 3.125 2.636 14.932 2704 HG12 VAL 49 2HG1 VAL 49 2.473 4.113 14.147 2705 HG13 VAL 49 3HG1 VAL 49 2.335 3.914 15.918 2706 HG21 VAL 49 3HG2 VAL 49 5.975 4.392 16.758 2707 HG22 VAL 49 1HG2 VAL 49 5.060 2.859 16.615 2708 HG23 VAL 49 2HG2 VAL 49 4.317 4.279 17.439 2709 H GLU 50 H GLU 50 4.692 6.272 12.853 2710 HA GLU 50 HA GLU 50 2.945 5.107 10.976 2711 HB2 GLU 50 2HB GLU 50 2.940 7.370 9.879 2712 HB3 GLU 50 1HB GLU 50 2.646 7.451 11.638 2713 HG2 GLU 50 2HG GLU 50 5.038 8.039 12.036 2714 HG3 GLU 50 1HG GLU 50 5.361 8.047 10.259 2715 H THR 51 H THR 51 6.419 5.643 10.982 2716 HA THR 51 HA THR 51 6.706 5.500 8.147 2717 HB THR 51 HB THR 51 8.759 5.141 10.393 2718 HG1 THR 51 1HG THR 51 7.932 7.212 10.370 2719 HG21 THR 51 3HG2 THR 51 9.115 5.607 7.346 2720 HG22 THR 51 1HG2 THR 51 9.609 4.129 8.255 2721 HG23 THR 51 2HG2 THR 51 10.432 5.697 8.572 2722 H ALA 52 H ALA 52 6.813 3.159 10.867 2723 HA ALA 52 HA ALA 52 7.756 1.010 9.271 2724 HB1 ALA 52 1HB ALA 52 7.957 0.948 11.748 2725 HB2 ALA 52 2HB ALA 52 6.979 -0.449 11.170 2726 HB3 ALA 52 3HB ALA 52 6.156 0.980 11.903 2727 H THR 53 H THR 53 4.485 2.389 9.882 2728 HA THR 53 HA THR 53 3.287 0.171 8.447 2729 HB THR 53 HB THR 53 1.161 1.519 8.977 2730 HG1 THR 53 1HG THR 53 1.485 2.947 10.741 2731 HG21 THR 53 3HG2 THR 53 1.925 -0.522 10.237 2732 HG22 THR 53 1HG2 THR 53 1.204 0.686 11.361 2733 HG23 THR 53 2HG2 THR 53 2.997 0.498 11.270 2734 H THR 54 H THR 54 5.135 2.597 7.417 2735 HA THR 54 HA THR 54 5.400 3.674 5.579 2736 HB THR 54 HB THR 54 4.504 2.603 3.418 2737 HG1 THR 54 1HG THR 54 2.823 1.509 4.929 2738 HG21 THR 54 3HG2 THR 54 6.070 0.926 5.504 2739 HG22 THR 54 1HG2 THR 54 6.746 2.196 4.411 2740 HG23 THR 54 2HG2 THR 54 6.069 0.680 3.717 2741 H VAL 55 H VAL 55 3.547 5.110 7.067 2742 HA VAL 55 HA VAL 55 1.669 6.007 4.957 2743 HB VAL 55 HB VAL 55 1.438 6.625 7.939 2744 HG11 VAL 55 1HG1 VAL 55 0.249 8.168 6.325 2745 HG12 VAL 55 2HG1 VAL 55 -0.932 7.127 7.194 2746 HG13 VAL 55 3HG1 VAL 55 -0.476 6.747 5.495 2747 HG21 VAL 55 3HG2 VAL 55 -0.324 4.774 7.887 2748 HG22 VAL 55 1HG2 VAL 55 1.355 4.178 7.737 2749 HG23 VAL 55 2HG2 VAL 55 0.308 4.278 6.276 2750 H GLY 56 H GLY 56 3.364 7.501 7.796 2751 HA2 GLY 56 2HA GLY 56 4.775 9.189 7.798 2752 HA3 GLY 56 1HA GLY 56 4.665 9.352 6.005 2753 H TYR 57 H TYR 57 2.104 9.914 5.501 2754 HA TYR 57 HA TYR 57 0.425 11.271 5.570 2755 HB2 TYR 57 2HB TYR 57 0.689 10.594 8.305 2756 HB3 TYR 57 1HB TYR 57 0.579 12.376 8.362 2757 HD1 TYR 57 1HD TYR 57 -1.423 13.436 6.945 2758 HD2 TYR 57 2HD TYR 57 -1.242 9.312 8.149 2759 HE1 TYR 57 1HE TYR 57 -3.859 13.264 6.706 2760 HE2 TYR 57 2HE TYR 57 -3.682 9.124 7.902 2761 HH TYR 57 HH TYR 57 -5.726 11.963 7.140 2762 H GLY 58 H GLY 58 3.372 12.568 6.852 2763 HA2 GLY 58 2HA GLY 58 4.414 14.380 5.742 2764 HA3 GLY 58 1HA GLY 58 2.803 15.175 5.565 2765 H ASP 59 H ASP 59 3.676 13.446 8.520 2766 HA ASP 59 HA ASP 59 3.262 15.737 10.125 2767 HB2 ASP 59 2HB ASP 59 2.768 13.444 10.956 2768 HB3 ASP 59 1HB ASP 59 4.476 12.968 10.721 2769 H ARG 60 H ARG 60 6.293 13.703 9.730 2770 HA ARG 60 HA ARG 60 7.829 16.179 9.608 2771 HB2 ARG 60 2HB ARG 60 8.103 14.041 11.767 2772 HB3 ARG 60 1HB ARG 60 9.608 14.560 10.958 2773 HG2 ARG 60 2HG ARG 60 9.534 15.879 12.867 2774 HG3 ARG 60 1HG ARG 60 9.115 16.963 11.511 2775 HD2 ARG 60 2HD ARG 60 7.766 17.486 13.521 2776 HD3 ARG 60 1HD ARG 60 6.675 16.866 12.234 2777 HE ARG 60 HE ARG 60 6.370 14.832 13.349 2778 HH11 ARG 60 1HH2 ARG 60 7.946 17.308 15.517 2779 HH12 ARG 60 2HH2 ARG 60 7.777 16.282 16.900 2780 HH21 ARG 60 1HH1 ARG 60 6.148 13.626 15.329 2781 HH22 ARG 60 2HH1 ARG 60 6.663 14.350 16.828 2782 H TYR 61 H TYR 61 9.951 15.658 8.457 2783 HA TYR 61 HA TYR 61 9.985 13.061 7.269 2784 HB2 TYR 61 2HB TYR 61 10.431 14.197 4.929 2785 HB3 TYR 61 1HB TYR 61 8.757 13.839 5.470 2786 HD1 TYR 61 1HD TYR 61 7.222 15.595 6.148 2787 HD2 TYR 61 2HD TYR 61 11.185 16.561 4.791 2788 HE1 TYR 61 1HE TYR 61 6.547 17.940 5.876 2789 HE2 TYR 61 2HE TYR 61 10.512 18.913 4.489 2790 HH TYR 61 HH TYR 61 7.344 20.126 5.591 2791 HA PRO 62 HA PRO 62 14.060 14.665 8.336 2792 HB2 PRO 62 2HB PRO 62 15.552 12.336 8.095 2793 HB3 PRO 62 1HB PRO 62 14.369 12.587 9.427 2794 HG2 PRO 62 2HG PRO 62 13.940 11.087 6.787 2795 HG3 PRO 62 1HG PRO 62 13.572 10.515 8.464 2796 HD2 PRO 62 2HD PRO 62 11.635 11.673 6.850 2797 HD3 PRO 62 1HD PRO 62 11.675 12.000 8.645 2798 H VAL 63 H VAL 63 16.439 14.464 7.310 2799 HA VAL 63 HA VAL 63 15.995 14.985 4.437 2800 HB VAL 63 HB VAL 63 16.369 16.860 6.035 2801 HG11 VAL 63 1HG1 VAL 63 18.623 17.376 6.823 2802 HG12 VAL 63 2HG1 VAL 63 19.291 15.859 6.117 2803 HG13 VAL 63 3HG1 VAL 63 18.092 15.784 7.463 2804 HG21 VAL 63 3HG2 VAL 63 18.438 16.840 3.750 2805 HG22 VAL 63 1HG2 VAL 63 17.606 18.225 4.520 2806 HG23 VAL 63 2HG2 VAL 63 16.656 17.062 3.534 2807 H THR 64 H THR 64 18.413 15.138 3.342 2808 HA THR 64 HA THR 64 19.082 12.654 2.620 2809 HB THR 64 HB THR 64 20.912 15.134 2.737 2810 HG1 THR 64 1HG THR 64 18.825 14.550 0.906 2811 HG21 THR 64 3HG2 THR 64 20.680 13.022 0.480 2812 HG22 THR 64 1HG2 THR 64 21.994 13.090 1.708 2813 HG23 THR 64 2HG2 THR 64 21.779 14.436 0.543 2814 H GLU 65 H GLU 65 20.544 14.594 5.212 2815 HA GLU 65 HA GLU 65 22.829 12.915 5.444 2816 HB2 GLU 65 2HB GLU 65 22.536 15.494 5.841 2817 HB3 GLU 65 1HB GLU 65 21.969 15.053 7.478 2818 HG2 GLU 65 2HG GLU 65 24.103 14.159 8.102 2819 HG3 GLU 65 1HG GLU 65 24.597 13.873 6.395 2820 H GLU 66 H GLU 66 19.570 12.708 6.585 2821 HA GLU 66 HA GLU 66 20.171 11.324 8.984 2822 HB2 GLU 66 2HB GLU 66 18.017 12.015 9.182 2823 HB3 GLU 66 1HB GLU 66 17.677 11.965 7.452 2824 HG2 GLU 66 2HG GLU 66 17.821 9.333 9.052 2825 HG3 GLU 66 1HG GLU 66 16.368 10.387 9.057 2826 H GLY 67 H GLY 67 19.871 10.661 5.548 2827 HA2 GLY 67 2HA GLY 67 21.569 9.016 4.959 2828 HA3 GLY 67 1HA GLY 67 20.667 7.873 6.047 2829 H ARG 68 H ARG 68 18.109 9.278 5.403 2830 HA ARG 68 HA ARG 68 16.380 8.958 4.464 2831 HB2 ARG 68 2HB ARG 68 17.267 10.367 2.615 2832 HB3 ARG 68 1HB ARG 68 17.479 8.867 1.641 2833 HG2 ARG 68 2HG ARG 68 15.064 8.425 1.694 2834 HG3 ARG 68 1HG ARG 68 14.864 9.480 3.120 2835 HD2 ARG 68 2HD ARG 68 15.575 11.475 1.476 2836 HD3 ARG 68 1HD ARG 68 15.142 10.284 0.179 2837 HE ARG 68 HE ARG 68 12.913 10.734 0.627 2838 HH11 ARG 68 1HH2 ARG 68 14.650 11.497 3.735 2839 HH12 ARG 68 2HH2 ARG 68 13.521 12.644 4.221 2840 HH21 ARG 68 1HH1 ARG 68 11.261 11.757 1.439 2841 HH22 ARG 68 2HH1 ARG 68 11.240 12.542 2.997 2842 H LYS 69 H LYS 69 18.766 6.753 3.444 2843 HA LYS 69 HA LYS 69 17.054 4.597 2.889 2844 HB2 LYS 69 2HB LYS 69 19.673 5.052 2.379 2845 HB3 LYS 69 1HB LYS 69 19.892 4.172 3.924 2846 HG2 LYS 69 2HG LYS 69 20.120 2.597 2.144 2847 HG3 LYS 69 1HG LYS 69 18.519 2.243 2.869 2848 HD2 LYS 69 2HD LYS 69 17.347 3.356 1.045 2849 HD3 LYS 69 1HD LYS 69 18.854 4.043 0.369 2850 HE2 LYS 69 2HE LYS 69 18.327 0.992 0.574 2851 HE3 LYS 69 1HE LYS 69 17.841 1.984 -0.857 2852 HZ1 LYS 69 3HZ LYS 69 20.657 1.811 0.167 2853 HZ2 LYS 69 1HZ LYS 69 20.108 2.571 -1.241 2854 HZ3 LYS 69 2HZ LYS 69 20.006 0.893 -1.104 2855 H VAL 70 H VAL 70 17.647 6.239 5.893 2856 HA VAL 70 HA VAL 70 17.535 3.866 7.463 2857 HB VAL 70 HB VAL 70 16.891 6.659 8.450 2858 HG11 VAL 70 1HG1 VAL 70 17.889 4.123 9.911 2859 HG12 VAL 70 2HG1 VAL 70 16.198 4.759 9.944 2860 HG13 VAL 70 3HG1 VAL 70 17.533 5.735 10.637 2861 HG21 VAL 70 3HG2 VAL 70 19.616 5.204 8.156 2862 HG22 VAL 70 1HG2 VAL 70 19.335 6.698 9.142 2863 HG23 VAL 70 2HG2 VAL 70 19.106 6.753 7.376 2864 H ALA 71 H ALA 71 15.298 6.279 6.095 2865 HA ALA 71 HA ALA 71 12.979 5.185 7.286 2866 HB1 ALA 71 1HB ALA 71 12.959 7.442 6.189 2867 HB2 ALA 71 2HB ALA 71 11.706 6.357 5.490 2868 HB3 ALA 71 3HB ALA 71 13.237 6.667 4.589 2869 H GLU 72 H GLU 72 14.467 4.709 4.056 2870 HA GLU 72 HA GLU 72 12.767 2.966 2.911 2871 HB2 GLU 72 2HB GLU 72 14.833 3.901 1.838 2872 HB3 GLU 72 1HB GLU 72 15.841 2.726 2.739 2873 HG2 GLU 72 2HG GLU 72 13.605 1.559 1.021 2874 HG3 GLU 72 1HG GLU 72 14.906 2.429 0.157 2875 H GLN 73 H GLN 73 15.607 1.923 4.862 2876 HA GLN 73 HA GLN 73 15.047 -0.781 4.522 2877 HB2 GLN 73 2HB GLN 73 16.833 -1.204 6.156 2878 HB3 GLN 73 1HB GLN 73 17.296 0.168 5.091 2879 HG2 GLN 73 2HG GLN 73 16.399 1.743 6.945 2880 HG3 GLN 73 1HG GLN 73 16.286 0.294 8.013 2881 HE21 GLN 73 1HE2 GLN 73 17.881 2.447 8.706 2882 HE22 GLN 73 2HE2 GLN 73 19.572 2.134 8.466 2883 H VAL 74 H VAL 74 13.735 1.538 6.821 2884 HA VAL 74 HA VAL 74 12.997 -0.492 8.760 2885 HB VAL 74 HB VAL 74 12.501 2.510 8.510 2886 HG11 VAL 74 1HG1 VAL 74 11.451 2.394 10.789 2887 HG12 VAL 74 2HG1 VAL 74 11.517 0.590 10.742 2888 HG13 VAL 74 3HG1 VAL 74 10.467 1.506 9.597 2889 HG21 VAL 74 3HG2 VAL 74 14.082 2.615 10.386 2890 HG22 VAL 74 1HG2 VAL 74 14.827 1.593 9.131 2891 HG23 VAL 74 2HG2 VAL 74 14.085 0.815 10.574 2892 H MET 75 H MET 75 11.500 1.640 6.303 2893 HA MET 75 HA MET 75 8.863 0.830 6.535 2894 HB2 MET 75 2HB MET 75 10.584 1.665 4.125 2895 HB3 MET 75 1HB MET 75 8.804 1.437 3.998 2896 HG2 MET 75 2HG MET 75 8.317 3.279 5.427 2897 HG3 MET 75 1HG MET 75 9.961 3.340 6.089 2898 HE1 MET 75 3HE MET 75 8.655 3.119 2.309 2899 HE2 MET 75 1HE MET 75 10.429 2.832 2.223 2900 HE3 MET 75 2HE MET 75 9.732 4.324 1.531 2901 H LYS 76 H LYS 76 11.532 -0.503 4.555 2902 HA LYS 76 HA LYS 76 10.093 -2.392 3.173 2903 HB2 LYS 76 2HB LYS 76 12.462 -1.608 2.763 2904 HB3 LYS 76 1HB LYS 76 13.014 -2.640 4.120 2905 HG2 LYS 76 2HG LYS 76 12.233 -4.685 2.907 2906 HG3 LYS 76 1HG LYS 76 11.588 -3.677 1.571 2907 HD2 LYS 76 2HD LYS 76 14.547 -3.815 2.429 2908 HD3 LYS 76 1HD LYS 76 13.826 -4.768 1.086 2909 HE2 LYS 76 2HE LYS 76 13.290 -2.706 -0.195 2910 HE3 LYS 76 1HE LYS 76 13.845 -1.671 1.178 2911 HZ1 LYS 76 3HZ LYS 76 15.545 -1.636 -0.210 2912 HZ2 LYS 76 1HZ LYS 76 15.475 -3.329 -0.657 2913 HZ3 LYS 76 2HZ LYS 76 16.059 -2.795 0.887 2914 H ALA 77 H ALA 77 11.530 -2.622 6.434 2915 HA ALA 77 HA ALA 77 11.195 -5.421 6.689 2916 HB1 ALA 77 1HB ALA 77 12.719 -4.134 8.208 2917 HB2 ALA 77 2HB ALA 77 11.478 -5.040 9.145 2918 HB3 ALA 77 3HB ALA 77 11.296 -3.261 8.893 2919 H GLY 78 H GLY 78 9.114 -2.592 7.292 2920 HA2 GLY 78 2HA GLY 78 7.080 -3.992 8.687 2921 HA3 GLY 78 1HA GLY 78 6.984 -2.385 7.868 2922 H ILE 79 H ILE 79 7.550 -3.076 5.264 2923 HA ILE 79 HA ILE 79 5.103 -3.984 4.329 2924 HB ILE 79 HB ILE 79 7.820 -3.828 2.938 2925 HG12 ILE 79 2HG1 ILE 79 5.369 -1.942 2.825 2926 HG13 ILE 79 1HG1 ILE 79 6.788 -1.663 3.866 2927 HG21 ILE 79 1HG2 ILE 79 6.542 -3.889 0.765 2928 HG22 ILE 79 2HG2 ILE 79 5.018 -4.202 1.666 2929 HG23 ILE 79 3HG2 ILE 79 6.348 -5.417 1.662 2930 HD11 ILE 79 3HD ILE 79 6.804 -1.746 0.776 2931 HD12 ILE 79 1HD ILE 79 7.006 -0.308 1.832 2932 HD13 ILE 79 2HD ILE 79 8.276 -1.589 1.810 2933 H GLU 80 H GLU 80 8.243 -5.727 4.606 2934 HA GLU 80 HA GLU 80 7.362 -8.125 3.489 2935 HB2 GLU 80 2HB GLU 80 9.780 -7.463 3.876 2936 HB3 GLU 80 1HB GLU 80 9.517 -7.654 5.633 2937 HG2 GLU 80 2HG GLU 80 10.652 -9.612 4.967 2938 HG3 GLU 80 1HG GLU 80 8.950 -10.169 5.136 2939 H VAL 81 H VAL 81 7.405 -6.982 6.913 2940 HA VAL 81 HA VAL 81 6.569 -9.395 8.053 2941 HB VAL 81 HB VAL 81 6.571 -6.488 8.908 2942 HG11 VAL 81 1HG1 VAL 81 4.515 -7.191 9.993 2943 HG12 VAL 81 2HG1 VAL 81 5.803 -7.314 11.232 2944 HG13 VAL 81 3HG1 VAL 81 5.205 -8.802 10.424 2945 HG21 VAL 81 3HG2 VAL 81 8.679 -7.899 8.871 2946 HG22 VAL 81 1HG2 VAL 81 7.900 -9.080 9.988 2947 HG23 VAL 81 2HG2 VAL 81 8.238 -7.401 10.538 2948 H PHE 82 H PHE 82 4.613 -6.523 7.000 2949 HA PHE 82 HA PHE 82 2.208 -7.918 7.746 2950 HB2 PHE 82 2HB PHE 82 2.609 -5.312 6.153 2951 HB3 PHE 82 1HB PHE 82 1.004 -5.957 6.670 2952 HD1 PHE 82 2HD PHE 82 1.214 -6.813 9.389 2953 HD2 PHE 82 1HD PHE 82 3.193 -3.494 7.487 2954 HE1 PHE 82 2HE PHE 82 1.412 -5.682 11.569 2955 HE2 PHE 82 1HE PHE 82 3.364 -2.354 9.663 2956 HZ PHE 82 HZ PHE 82 2.471 -3.437 11.716 2957 H ALA 83 H ALA 83 4.279 -8.396 5.185 2958 HA ALA 83 HA ALA 83 2.167 -9.208 3.342 2959 HB1 ALA 83 1HB ALA 83 4.247 -8.212 2.355 2960 HB2 ALA 83 2HB ALA 83 4.011 -9.918 1.836 2961 HB3 ALA 83 3HB ALA 83 5.226 -9.520 3.104 2962 H LEU 84 H LEU 84 4.705 -10.515 5.497 2963 HA LEU 84 HA LEU 84 4.621 -13.156 4.874 2964 HB2 LEU 84 2HB LEU 84 6.156 -11.784 6.430 2965 HB3 LEU 84 1HB LEU 84 4.977 -12.057 7.738 2966 HG LEU 84 HG LEU 84 6.413 -14.293 6.159 2967 HD11 LEU 84 1HD1 LEU 84 8.087 -12.794 7.218 2968 HD12 LEU 84 2HD1 LEU 84 8.062 -14.405 8.018 2969 HD13 LEU 84 3HD1 LEU 84 7.282 -12.988 8.819 2970 HD21 LEU 84 3HD2 LEU 84 4.492 -15.238 7.393 2971 HD22 LEU 84 1HD2 LEU 84 4.981 -14.378 8.904 2972 HD23 LEU 84 2HD2 LEU 84 6.007 -15.696 8.226 2973 H VAL 85 H VAL 85 2.504 -11.362 7.092 2974 HA VAL 85 HA VAL 85 1.171 -13.473 8.259 2975 HB VAL 85 HB VAL 85 -0.585 -11.871 8.855 2976 HG11 VAL 85 1HG1 VAL 85 2.189 -10.485 8.896 2977 HG12 VAL 85 2HG1 VAL 85 1.740 -11.855 9.962 2978 HG13 VAL 85 3HG1 VAL 85 0.849 -10.297 10.071 2979 HG21 VAL 85 3HG2 VAL 85 -0.906 -10.675 6.688 2980 HG22 VAL 85 1HG2 VAL 85 0.773 -10.042 6.760 2981 HG23 VAL 85 2HG2 VAL 85 -0.448 -9.492 7.956 2982 H THR 86 H THR 86 1.011 -12.486 4.963 2983 HA THR 86 HA THR 86 -1.662 -13.149 4.463 2984 HB THR 86 HB THR 86 0.574 -13.065 2.405 2985 HG1 THR 86 1HG THR 86 0.755 -11.208 3.339 2986 HG21 THR 86 3HG2 THR 86 -2.454 -12.374 2.254 2987 HG22 THR 86 1HG2 THR 86 -1.691 -13.845 1.538 2988 HG23 THR 86 2HG2 THR 86 -1.262 -12.218 0.921 2989 H ALA 87 H ALA 87 0.959 -15.163 5.312 2990 HA ALA 87 HA ALA 87 0.306 -17.502 3.936 2991 HB1 ALA 87 1HB ALA 87 1.102 -17.175 6.910 2992 HB2 ALA 87 2HB ALA 87 2.242 -17.358 5.534 2993 HB3 ALA 87 3HB ALA 87 1.159 -18.719 5.981 2994 H ALA 88 H ALA 88 -1.116 -16.066 6.914 2995 HA ALA 88 HA ALA 88 -2.980 -18.156 7.300 2996 HB1 ALA 88 1HB ALA 88 -2.252 -16.671 9.187 2997 HB2 ALA 88 2HB ALA 88 -4.035 -16.612 8.971 2998 HB3 ALA 88 3HB ALA 88 -3.009 -15.262 8.358 2999 H LEU 89 H LEU 89 -3.094 -14.973 5.706 3000 HA LEU 89 HA LEU 89 -5.867 -15.043 5.215 3001 HB2 LEU 89 2HB LEU 89 -3.742 -13.508 3.627 3002 HB3 LEU 89 1HB LEU 89 -5.498 -13.156 3.683 3003 HG LEU 89 HG LEU 89 -3.555 -12.970 6.082 3004 HD11 LEU 89 1HD1 LEU 89 -3.079 -11.221 4.381 3005 HD12 LEU 89 2HD1 LEU 89 -3.802 -10.509 5.865 3006 HD13 LEU 89 3HD1 LEU 89 -4.809 -10.726 4.390 3007 HD21 LEU 89 3HD2 LEU 89 -5.861 -13.497 6.864 3008 HD22 LEU 89 1HD2 LEU 89 -6.532 -12.173 5.852 3009 HD23 LEU 89 2HD2 LEU 89 -5.451 -11.785 7.238 3010 H ALA 90 H ALA 90 -3.030 -16.128 3.258 3011 HA ALA 90 HA ALA 90 -4.641 -16.799 1.025 3012 HB1 ALA 90 1HB ALA 90 -1.828 -17.775 1.783 3013 HB2 ALA 90 2HB ALA 90 -2.204 -16.342 0.765 3014 HB3 ALA 90 3HB ALA 90 -2.626 -17.989 0.175 3015 H THR 91 H THR 91 -4.100 -18.313 4.095 3016 HA THR 91 HA THR 91 -4.722 -20.989 3.239 3017 HB THR 91 HB THR 91 -5.278 -19.811 6.035 3018 HG1 THR 91 1HG THR 91 -3.005 -19.600 5.182 3019 HG21 THR 91 3HG2 THR 91 -6.214 -22.097 5.651 3020 HG22 THR 91 1HG2 THR 91 -4.817 -22.196 6.766 3021 HG23 THR 91 2HG2 THR 91 -4.624 -22.669 5.031 3022 H ASP 92 H ASP 92 -6.490 -17.965 3.923 3023 HA ASP 92 HA ASP 92 -8.601 -19.261 5.138 3024 HB2 ASP 92 2HB ASP 92 -7.865 -16.611 5.067 3025 HB3 ASP 92 1HB ASP 92 -9.376 -16.585 4.094 3026 H PHE 93 H PHE 93 -8.083 -18.524 1.729 3027 HA PHE 93 HA PHE 93 -10.775 -19.102 1.031 3028 HB2 PHE 93 2HB PHE 93 -10.267 -19.082 -1.209 3029 HB3 PHE 93 1HB PHE 93 -9.097 -17.903 -0.533 3030 HD1 PHE 93 1HD PHE 93 -6.663 -18.621 -0.310 3031 HD2 PHE 93 2HD PHE 93 -9.566 -21.014 -2.381 3032 HE1 PHE 93 1HE PHE 93 -4.844 -19.816 -1.473 3033 HE2 PHE 93 2HE PHE 93 -7.742 -22.206 -3.555 3034 HZ PHE 93 HZ PHE 93 -5.377 -21.590 -3.128 3035 H VAL 94 H VAL 94 -8.004 -21.135 1.813 3036 HA VAL 94 HA VAL 94 -8.954 -23.408 0.391 3037 HB VAL 94 HB VAL 94 -6.888 -23.341 2.651 3038 HG11 VAL 94 1HG1 VAL 94 -5.959 -25.330 1.383 3039 HG12 VAL 94 2HG1 VAL 94 -7.348 -25.244 0.239 3040 HG13 VAL 94 3HG1 VAL 94 -7.628 -25.645 1.972 3041 HG21 VAL 94 3HG2 VAL 94 -6.615 -22.713 -0.365 3042 HG22 VAL 94 1HG2 VAL 94 -5.232 -23.098 0.715 3043 HG23 VAL 94 2HG2 VAL 94 -6.206 -21.624 1.012 3044 H ARG 95 H ARG 95 -9.504 -21.961 3.535 3045 HA ARG 95 HA ARG 95 -10.334 -24.256 4.933 3046 HB2 ARG 95 2HB ARG 95 -11.479 -21.417 5.258 3047 HB3 ARG 95 1HB ARG 95 -11.538 -22.740 6.469 3048 HG2 ARG 95 2HG ARG 95 -9.020 -22.600 6.699 3049 HG3 ARG 95 1HG ARG 95 -9.012 -21.334 5.434 3050 HD2 ARG 95 2HD ARG 95 -9.110 -19.853 7.170 3051 HD3 ARG 95 1HD ARG 95 -10.874 -20.180 7.115 3052 HE ARG 95 HE ARG 95 -8.876 -20.959 9.123 3053 HH11 ARG 95 1HH2 ARG 95 -12.421 -21.338 8.160 3054 HH12 ARG 95 2HH2 ARG 95 -12.818 -21.756 9.764 3055 HH21 ARG 95 1HH1 ARG 95 -9.559 -21.314 11.149 3056 HH22 ARG 95 2HH1 ARG 95 -11.200 -21.556 11.567 3057 H ARG 96 H ARG 96 -11.896 -22.298 2.433 3058 HA ARG 96 HA ARG 96 -14.524 -22.778 3.144 3059 HB2 ARG 96 2HB ARG 96 -15.223 -21.972 1.058 3060 HB3 ARG 96 1HB ARG 96 -13.668 -21.135 1.341 3061 HG2 ARG 96 2HG ARG 96 -12.553 -22.962 -0.116 3062 HG3 ARG 96 1HG ARG 96 -14.184 -23.606 -0.452 3063 HD2 ARG 96 2HD ARG 96 -14.908 -21.494 -1.458 3064 HD3 ARG 96 1HD ARG 96 -13.263 -20.769 -1.158 3065 HE ARG 96 HE ARG 96 -13.008 -23.321 -2.521 3066 HH11 ARG 96 1HH2 ARG 96 -14.316 -19.979 -2.998 3067 HH12 ARG 96 2HH2 ARG 96 -13.397 -19.660 -4.429 3068 HH21 ARG 96 1HH1 ARG 96 -12.278 -23.083 -4.859 3069 HH22 ARG 96 2HH1 ARG 96 -12.451 -21.565 -5.649 3070 H GLU 97 H GLU 97 -12.147 -24.952 1.803 3071 HA GLU 97 HA GLU 97 -13.985 -26.631 0.445 3072 HB2 GLU 97 2HB GLU 97 -11.172 -27.290 1.426 3073 HB3 GLU 97 1HB GLU 97 -12.109 -28.172 0.169 3074 HG2 GLU 97 2HG GLU 97 -11.149 -25.220 -0.052 3075 HG3 GLU 97 1HG GLU 97 -10.311 -26.632 -0.759 3076 H GLU 98 H GLU 98 -13.307 -26.122 3.792 3077 HA GLU 98 HA GLU 98 -14.594 -28.698 4.434 3078 HB2 GLU 98 2HB GLU 98 -12.920 -26.950 6.312 3079 HB3 GLU 98 1HB GLU 98 -13.684 -28.541 6.660 3080 HG2 GLU 98 2HG GLU 98 -12.279 -29.462 4.642 3081 HG3 GLU 98 1HG GLU 98 -11.345 -27.927 4.737 3082 H GLU 99 H GLU 99 -14.719 -25.116 4.913 3083 HA GLU 99 HA GLU 99 -16.715 -25.176 6.817 3084 HB2 GLU 99 2HB GLU 99 -16.161 -22.980 4.754 3085 HB3 GLU 99 1HB GLU 99 -17.177 -22.798 6.222 3086 HG2 GLU 99 2HG GLU 99 -15.223 -23.211 7.705 3087 HG3 GLU 99 1HG GLU 99 -14.163 -23.505 6.287 3088 H ARG 100 H ARG 100 -17.040 -25.430 3.302 3089 HA ARG 100 HA ARG 100 -19.870 -24.948 3.373 3090 HB2 ARG 100 2HB ARG 100 -18.020 -26.053 1.178 3091 HB3 ARG 100 1HB ARG 100 -19.707 -25.495 0.920 3092 HG2 ARG 100 2HG ARG 100 -19.115 -23.200 1.641 3093 HG3 ARG 100 1HG ARG 100 -17.436 -23.670 1.987 3094 HD2 ARG 100 2HD ARG 100 -18.795 -23.777 -0.777 3095 HD3 ARG 100 1HD ARG 100 -17.628 -22.506 -0.199 3096 HE ARG 100 HE ARG 100 -16.128 -24.693 0.223 3097 HH11 ARG 100 1HH2 ARG 100 -18.012 -23.691 -2.702 3098 HH12 ARG 100 2HH2 ARG 100 -17.247 -24.851 -3.740 3099 HH21 ARG 100 1HH1 ARG 100 -14.548 -25.486 -1.622 3100 HH22 ARG 100 2HH1 ARG 100 -15.246 -25.903 -3.041 3101 H ARG 101 H ARG 101 -18.018 -27.615 4.256 3102 HA ARG 101 HA ARG 101 -20.112 -29.570 3.545 3103 HB2 ARG 101 2HB ARG 101 -17.204 -29.970 4.516 3104 HB3 ARG 101 1HB ARG 101 -18.397 -31.289 4.238 3105 HG2 ARG 101 2HG ARG 101 -18.555 -30.698 1.852 3106 HG3 ARG 101 1HG ARG 101 -17.407 -29.326 2.064 3107 HD2 ARG 101 2HD ARG 101 -15.522 -30.828 2.512 3108 HD3 ARG 101 1HD ARG 101 -16.618 -32.278 2.585 3109 HE ARG 101 HE ARG 101 -17.088 -31.057 0.076 3110 HH11 ARG 101 1HH2 ARG 101 -14.155 -32.461 1.686 3111 HH12 ARG 101 2HH2 ARG 101 -13.540 -33.116 0.247 3112 HH21 ARG 101 1HH1 ARG 101 -16.210 -31.926 -1.882 3113 HH22 ARG 101 2HH1 ARG 101 -14.759 -32.833 -1.901 3114 H GLY 102 H GLY 102 -18.090 -28.082 6.124 3115 HA2 GLY 102 2HA GLY 102 -19.107 -27.314 8.045 3116 HA3 GLY 102 1HA GLY 102 -20.232 -28.723 8.045 3117 H HIS 103 H HIS 103 -17.148 -29.844 7.068 3118 HA HIS 103 HA HIS 103 -15.927 -29.917 9.599 3119 HB2 HIS 103 2HB HIS 103 -17.742 -31.778 9.895 3120 HB3 HIS 103 1HB HIS 103 -16.959 -32.640 8.539 3121 HD1 HIS 103 1HD HIS 103 -15.955 -31.094 11.919 3122 HD2 HIS 103 2HD HIS 103 -15.121 -34.485 9.564 3123 HE1 HIS 103 1HE HIS 103 -14.273 -32.533 13.209 3124 HE2 HIS 103 2HE HIS 103 -13.853 -34.576 11.778 Start of MODEL 19 1 H1 SER 1 H SER 1 -21.179 -22.151 -1.382 2 HA SER 1 HA SER 1 -21.356 -22.036 -4.092 3 HB2 SER 1 2HB SER 1 -23.370 -20.535 -3.809 4 HB3 SER 1 1HB SER 1 -22.373 -19.378 -2.865 5 HG SER 1 1HG SER 1 -22.612 -18.796 -5.063 6 H ALA 2 H ALA 2 -20.623 -19.873 -1.292 7 HA ALA 2 HA ALA 2 -17.803 -19.950 -2.041 8 HB1 ALA 2 1HB ALA 2 -18.582 -18.045 -3.417 9 HB2 ALA 2 2HB ALA 2 -17.676 -17.416 -2.003 10 HB3 ALA 2 3HB ALA 2 -19.479 -17.350 -2.032 11 H ASP 3 H ASP 3 -19.989 -17.882 -0.149 12 HA ASP 3 HA ASP 3 -20.158 -17.331 1.896 13 HB2 ASP 3 2HB ASP 3 -18.770 -19.933 2.665 14 HB3 ASP 3 1HB ASP 3 -19.354 -18.717 3.858 15 H HIS 4 H HIS 4 -16.848 -18.243 1.109 16 HA HIS 4 HA HIS 4 -15.584 -16.402 2.743 17 HB2 HIS 4 2HB HIS 4 -13.730 -16.344 0.827 18 HB3 HIS 4 1HB HIS 4 -13.990 -17.727 1.907 19 HD1 HIS 4 1HD HIS 4 -15.063 -16.804 -1.782 20 HD2 HIS 4 2HD HIS 4 -14.749 -20.115 0.840 21 HE1 HIS 4 1HE HIS 4 -15.400 -18.786 -3.121 22 HE2 HIS 4 2HE HIS 4 -15.440 -20.782 -1.565 23 H GLU 5 H GLU 5 -16.869 -15.641 -0.654 24 HA GLU 5 HA GLU 5 -16.028 -12.979 -0.245 25 HB2 GLU 5 2HB GLU 5 -17.777 -12.422 -2.116 26 HB3 GLU 5 1HB GLU 5 -16.182 -13.104 -2.440 27 HG2 GLU 5 2HG GLU 5 -18.434 -15.129 -2.105 28 HG3 GLU 5 1HG GLU 5 -18.503 -14.039 -3.527 29 H ARG 6 H ARG 6 -18.673 -14.603 1.281 30 HA ARG 6 HA ARG 6 -20.291 -12.198 1.501 31 HB2 ARG 6 2HB ARG 6 -20.302 -14.752 3.248 32 HB3 ARG 6 1HB ARG 6 -21.452 -13.389 3.371 33 HG2 ARG 6 2HG ARG 6 -22.274 -13.822 1.090 34 HG3 ARG 6 1HG ARG 6 -21.181 -15.240 0.917 35 HD2 ARG 6 2HD ARG 6 -22.307 -16.479 2.676 36 HD3 ARG 6 1HD ARG 6 -23.137 -15.005 3.300 37 HE ARG 6 HE ARG 6 -24.397 -14.889 1.152 38 HH11 ARG 6 1HH2 ARG 6 -23.294 -18.171 2.358 39 HH12 ARG 6 2HH2 ARG 6 -24.840 -18.835 2.178 40 HH21 ARG 6 1HH1 ARG 6 -26.408 -15.880 0.846 41 HH22 ARG 6 2HH1 ARG 6 -26.678 -17.541 1.308 42 H GLU 7 H GLU 7 -17.936 -14.094 3.352 43 HA GLU 7 HA GLU 7 -17.880 -12.685 5.712 44 HB2 GLU 7 2HB GLU 7 -16.997 -14.988 5.198 45 HB3 GLU 7 1HB GLU 7 -15.655 -14.265 4.258 46 HG2 GLU 7 2HG GLU 7 -14.629 -13.370 6.303 47 HG3 GLU 7 1HG GLU 7 -16.072 -13.831 7.284 48 H ALA 8 H ALA 8 -16.104 -12.248 2.668 49 HA ALA 8 HA ALA 8 -14.400 -10.187 3.388 50 HB1 ALA 8 1HB ALA 8 -15.799 -10.666 0.675 51 HB2 ALA 8 2HB ALA 8 -14.232 -11.393 1.195 52 HB3 ALA 8 3HB ALA 8 -14.365 -9.615 0.930 53 H GLN 9 H GLN 9 -17.825 -10.031 2.307 54 HA GLN 9 HA GLN 9 -17.778 -7.186 2.089 55 HB2 GLN 9 2HB GLN 9 -20.118 -9.165 2.209 56 HB3 GLN 9 1HB GLN 9 -20.283 -7.401 1.880 57 HG2 GLN 9 2HG GLN 9 -18.870 -7.591 -0.153 58 HG3 GLN 9 1HG GLN 9 -18.605 -9.339 0.146 59 HE21 GLN 9 1HE2 GLN 9 -20.556 -7.159 -1.567 60 HE22 GLN 9 2HE2 GLN 9 -21.867 -8.230 -1.927 61 H LYS 10 H LYS 10 -18.367 -9.458 4.763 62 HA LYS 10 HA LYS 10 -19.669 -7.556 6.448 63 HB2 LYS 10 2HB LYS 10 -19.611 -10.011 7.099 64 HB3 LYS 10 1HB LYS 10 -17.835 -9.882 7.304 65 HG2 LYS 10 2HG LYS 10 -18.278 -8.052 9.098 66 HG3 LYS 10 1HG LYS 10 -20.017 -8.468 8.972 67 HD2 LYS 10 2HD LYS 10 -19.503 -10.766 9.763 68 HD3 LYS 10 1HD LYS 10 -17.740 -10.440 9.708 69 HE2 LYS 10 2HE LYS 10 -19.739 -8.931 11.550 70 HE3 LYS 10 1HE LYS 10 -18.747 -10.364 12.025 71 HZ1 LYS 10 3HZ LYS 10 -16.789 -8.825 11.243 72 HZ2 LYS 10 1HZ LYS 10 -17.508 -8.715 12.793 73 HZ3 LYS 10 2HZ LYS 10 -17.837 -7.567 11.624 74 H ALA 11 H ALA 11 -16.291 -8.397 5.724 75 HA ALA 11 HA ALA 11 -15.082 -7.041 7.787 76 HB1 ALA 11 1HB ALA 11 -13.871 -8.634 6.229 77 HB2 ALA 11 2HB ALA 11 -12.995 -7.069 6.425 78 HB3 ALA 11 3HB ALA 11 -13.948 -7.385 4.939 79 H GLU 12 H GLU 12 -16.140 -5.741 4.576 80 HA GLU 12 HA GLU 12 -14.915 -3.228 5.083 81 HB2 GLU 12 2HB GLU 12 -16.795 -4.177 2.945 82 HB3 GLU 12 1HB GLU 12 -16.882 -2.441 3.364 83 HG2 GLU 12 2HG GLU 12 -14.339 -2.274 3.108 84 HG3 GLU 12 1HG GLU 12 -14.384 -3.922 2.368 85 H GLU 13 H GLU 13 -18.152 -4.533 5.971 86 HA GLU 13 HA GLU 13 -19.140 -1.960 6.634 87 HB2 GLU 13 2HB GLU 13 -20.076 -4.612 7.861 88 HB3 GLU 13 1HB GLU 13 -20.935 -3.027 7.830 89 HG2 GLU 13 2HG GLU 13 -20.790 -3.224 5.200 90 HG3 GLU 13 1HG GLU 13 -20.347 -4.939 5.487 91 H GLU 14 H GLU 14 -17.129 -4.286 8.252 92 HA GLU 14 HA GLU 14 -17.321 -3.340 10.875 93 HB2 GLU 14 2HB GLU 14 -16.244 -5.543 9.892 94 HB3 GLU 14 1HB GLU 14 -14.803 -4.530 9.589 95 HG2 GLU 14 2HG GLU 14 -14.340 -5.641 11.628 96 HG3 GLU 14 1HG GLU 14 -14.813 -3.978 12.124 97 H LEU 15 H LEU 15 -15.455 -2.281 8.024 98 HA LEU 15 HA LEU 15 -13.631 -0.656 9.406 99 HB2 LEU 15 2HB LEU 15 -13.427 -1.495 6.985 100 HB3 LEU 15 1HB LEU 15 -14.634 -0.275 6.512 101 HG LEU 15 HG LEU 15 -13.123 1.560 7.304 102 HD11 LEU 15 1HD1 LEU 15 -10.688 1.018 7.826 103 HD12 LEU 15 2HD1 LEU 15 -11.130 -0.715 7.946 104 HD13 LEU 15 3HD1 LEU 15 -11.829 0.485 9.092 105 HD21 LEU 15 3HD2 LEU 15 -13.093 0.801 4.927 106 HD22 LEU 15 1HD2 LEU 15 -11.770 -0.359 5.298 107 HD23 LEU 15 2HD2 LEU 15 -11.483 1.404 5.448 108 H GLN 16 H GLN 16 -16.776 -0.043 7.844 109 HA GLN 16 HA GLN 16 -16.829 2.716 8.082 110 HB2 GLN 16 2HB GLN 16 -19.252 0.826 8.320 111 HB3 GLN 16 1HB GLN 16 -19.277 2.563 7.850 112 HG2 GLN 16 2HG GLN 16 -17.920 1.951 5.764 113 HG3 GLN 16 1HG GLN 16 -18.026 0.219 6.243 114 HE21 GLN 16 1HE2 GLN 16 -20.059 3.141 5.563 115 HE22 GLN 16 2HE2 GLN 16 -21.457 2.255 5.038 116 H LYS 17 H LYS 17 -17.602 0.208 10.435 117 HA LYS 17 HA LYS 17 -18.867 1.848 12.369 118 HB2 LYS 17 2HB LYS 17 -19.045 -0.659 12.260 119 HB3 LYS 17 1HB LYS 17 -17.290 -0.773 12.589 120 HG2 LYS 17 2HG LYS 17 -17.690 0.244 14.893 121 HG3 LYS 17 1HG LYS 17 -19.444 0.298 14.514 122 HD2 LYS 17 2HD LYS 17 -18.973 -1.668 15.888 123 HD3 LYS 17 1HD LYS 17 -19.457 -2.193 14.235 124 HE2 LYS 17 2HE LYS 17 -16.974 -2.540 13.680 125 HE3 LYS 17 1HE LYS 17 -16.568 -2.117 15.390 126 HZ1 LYS 17 3HZ LYS 17 -16.793 -4.537 14.728 127 HZ2 LYS 17 1HZ LYS 17 -18.430 -4.319 14.610 128 HZ3 LYS 17 2HZ LYS 17 -17.678 -4.094 16.129 129 H VAL 18 H VAL 18 -15.472 0.860 11.776 130 HA VAL 18 HA VAL 18 -14.447 2.002 14.144 131 HB VAL 18 HB VAL 18 -13.066 1.333 11.491 132 HG11 VAL 18 1HG1 VAL 18 -10.940 1.372 12.861 133 HG12 VAL 18 2HG1 VAL 18 -11.858 2.051 14.255 134 HG13 VAL 18 3HG1 VAL 18 -11.682 2.997 12.729 135 HG21 VAL 18 3HG2 VAL 18 -13.242 -0.186 14.191 136 HG22 VAL 18 1HG2 VAL 18 -12.326 -0.712 12.731 137 HG23 VAL 18 2HG2 VAL 18 -14.116 -0.640 12.688 138 H LEU 19 H LEU 19 -14.881 3.211 10.778 139 HA LEU 19 HA LEU 19 -13.608 5.625 11.008 140 HB2 LEU 19 2HB LEU 19 -16.310 5.180 9.575 141 HB3 LEU 19 1HB LEU 19 -15.209 6.568 9.314 142 HG LEU 19 HG LEU 19 -14.618 3.639 8.612 143 HD11 LEU 19 1HD1 LEU 19 -15.188 6.071 6.809 144 HD12 LEU 19 2HD1 LEU 19 -16.340 4.733 7.156 145 HD13 LEU 19 3HD1 LEU 19 -14.809 4.393 6.270 146 HD21 LEU 19 3HD2 LEU 19 -12.909 6.175 8.261 147 HD22 LEU 19 1HD2 LEU 19 -12.622 4.623 7.397 148 HD23 LEU 19 2HD2 LEU 19 -12.486 4.693 9.190 149 H GLU 20 H GLU 20 -16.945 4.803 11.953 150 HA GLU 20 HA GLU 20 -17.754 7.425 12.590 151 HB2 GLU 20 2HB GLU 20 -18.806 4.671 13.460 152 HB3 GLU 20 1HB GLU 20 -19.629 6.202 13.895 153 HG2 GLU 20 2HG GLU 20 -19.100 5.357 10.966 154 HG3 GLU 20 1HG GLU 20 -20.580 4.920 11.889 155 H GLU 21 H GLU 21 -16.320 4.747 14.586 156 HA GLU 21 HA GLU 21 -16.598 6.330 16.983 157 HB2 GLU 21 2HB GLU 21 -14.724 3.941 16.463 158 HB3 GLU 21 1HB GLU 21 -14.781 4.920 17.973 159 HG2 GLU 21 2HG GLU 21 -17.311 4.359 18.092 160 HG3 GLU 21 1HG GLU 21 -16.952 3.042 16.915 161 H ALA 22 H ALA 22 -14.060 5.744 14.542 162 HA ALA 22 HA ALA 22 -11.969 7.001 15.787 163 HB1 ALA 22 1HB ALA 22 -11.669 5.599 13.762 164 HB2 ALA 22 2HB ALA 22 -11.000 7.247 13.460 165 HB3 ALA 22 3HB ALA 22 -12.598 6.778 12.787 166 H SER 23 H SER 23 -14.625 8.494 13.820 167 HA SER 23 HA SER 23 -13.277 10.969 13.635 168 HB2 SER 23 2HB SER 23 -15.660 11.837 13.091 169 HB3 SER 23 1HB SER 23 -14.963 10.563 12.021 170 HG SER 23 1HG SER 23 -17.008 9.935 12.524 171 H LYS 24 H LYS 24 -15.386 9.480 16.034 172 HA LYS 24 HA LYS 24 -15.804 11.851 17.534 173 HB2 LYS 24 2HB LYS 24 -17.267 9.754 17.465 174 HB3 LYS 24 1HB LYS 24 -16.088 8.948 18.539 175 HG2 LYS 24 2HG LYS 24 -17.476 11.615 19.226 176 HG3 LYS 24 1HG LYS 24 -18.277 10.046 19.509 177 HD2 LYS 24 2HD LYS 24 -17.037 9.458 21.308 178 HD3 LYS 24 1HD LYS 24 -15.520 10.144 20.686 179 HE2 LYS 24 2HE LYS 24 -17.813 11.745 22.027 180 HE3 LYS 24 1HE LYS 24 -16.196 11.339 22.728 181 HZ1 LYS 24 3HZ LYS 24 -15.839 13.415 21.982 182 HZ2 LYS 24 1HZ LYS 24 -16.875 13.298 20.646 183 HZ3 LYS 24 2HZ LYS 24 -15.346 12.540 20.609 184 H LYS 25 H LYS 25 -13.449 9.196 17.535 185 HA LYS 25 HA LYS 25 -12.115 9.960 19.912 186 HB2 LYS 25 2HB LYS 25 -10.975 8.373 17.537 187 HB3 LYS 25 1HB LYS 25 -10.204 8.569 19.144 188 HG2 LYS 25 2HG LYS 25 -12.221 7.416 20.205 189 HG3 LYS 25 1HG LYS 25 -12.855 7.123 18.561 190 HD2 LYS 25 2HD LYS 25 -10.486 6.001 18.113 191 HD3 LYS 25 1HD LYS 25 -10.384 5.911 19.899 192 HE2 LYS 25 2HE LYS 25 -12.529 4.664 18.037 193 HE3 LYS 25 1HE LYS 25 -11.260 3.774 18.960 194 HZ1 LYS 25 3HZ LYS 25 -13.555 3.717 19.864 195 HZ2 LYS 25 1HZ LYS 25 -13.460 5.357 20.253 196 HZ3 LYS 25 2HZ LYS 25 -12.394 4.308 21.000 197 H ALA 26 H ALA 26 -11.330 10.479 16.405 198 HA ALA 26 HA ALA 26 -9.046 11.934 16.791 199 HB1 ALA 26 1HB ALA 26 -11.080 12.255 14.489 200 HB2 ALA 26 2HB ALA 26 -9.787 11.003 14.576 201 HB3 ALA 26 3HB ALA 26 -9.338 12.737 14.463 202 H VAL 27 H VAL 27 -12.447 13.216 16.437 203 HA VAL 27 HA VAL 27 -11.510 15.866 16.597 204 HB VAL 27 HB VAL 27 -13.706 15.140 15.621 205 HG11 VAL 27 1HG1 VAL 27 -15.662 14.881 17.059 206 HG12 VAL 27 2HG1 VAL 27 -14.714 15.229 18.545 207 HG13 VAL 27 3HG1 VAL 27 -14.421 13.713 17.616 208 HG21 VAL 27 3HG2 VAL 27 -13.058 17.509 15.949 209 HG22 VAL 27 1HG2 VAL 27 -13.674 17.482 17.640 210 HG23 VAL 27 2HG2 VAL 27 -14.819 17.295 16.267 211 H GLU 28 H GLU 28 -12.412 13.495 19.142 212 HA GLU 28 HA GLU 28 -12.591 15.504 21.181 213 HB2 GLU 28 2HB GLU 28 -13.654 13.132 21.235 214 HB3 GLU 28 1HB GLU 28 -12.028 12.491 21.570 215 HG2 GLU 28 2HG GLU 28 -13.263 12.694 23.690 216 HG3 GLU 28 1HG GLU 28 -11.994 13.974 23.693 217 H ALA 29 H ALA 29 -10.166 13.333 19.860 218 HA ALA 29 HA ALA 29 -8.212 13.583 21.833 219 HB1 ALA 29 1HB ALA 29 -8.302 11.712 20.151 220 HB2 ALA 29 2HB ALA 29 -6.750 12.577 20.047 221 HB3 ALA 29 3HB ALA 29 -8.003 12.892 18.827 222 H GLU 30 H GLU 30 -8.711 15.131 18.634 223 HA GLU 30 HA GLU 30 -6.548 16.865 18.808 224 HB2 GLU 30 2HB GLU 30 -7.759 16.128 16.708 225 HB3 GLU 30 1HB GLU 30 -9.167 17.115 17.219 226 HG2 GLU 30 2HG GLU 30 -8.061 18.460 15.648 227 HG3 GLU 30 1HG GLU 30 -7.508 19.145 17.204 228 H ARG 31 H ARG 31 -10.003 17.269 19.817 229 HA ARG 31 HA ARG 31 -9.709 20.066 20.199 230 HB2 ARG 31 2HB ARG 31 -11.748 18.091 21.292 231 HB3 ARG 31 1HB ARG 31 -11.834 19.846 21.660 232 HG2 ARG 31 2HG ARG 31 -11.672 18.901 18.748 233 HG3 ARG 31 1HG ARG 31 -13.197 18.757 19.673 234 HD2 ARG 31 2HD ARG 31 -13.086 21.296 20.132 235 HD3 ARG 31 1HD ARG 31 -11.631 21.371 19.064 236 HE ARG 31 HE ARG 31 -13.040 21.217 17.211 237 HH11 ARG 31 1HH2 ARG 31 -14.917 20.076 20.059 238 HH12 ARG 31 2HH2 ARG 31 -16.394 19.912 19.237 239 HH21 ARG 31 1HH1 ARG 31 -15.017 21.039 16.068 240 HH22 ARG 31 2HH1 ARG 31 -16.469 20.524 16.864 241 H GLY 32 H GLY 32 -8.298 20.928 21.572 242 HA2 GLY 32 2HA GLY 32 -8.034 21.555 23.856 243 HA3 GLY 32 1HA GLY 32 -8.075 19.801 24.292 244 H ALA 33 H ALA 33 -6.575 19.677 21.370 245 HA ALA 33 HA ALA 33 -4.031 19.472 22.672 246 HB1 ALA 33 1HB ALA 33 -3.281 18.433 20.520 247 HB2 ALA 33 2HB ALA 33 -4.845 18.868 19.760 248 HB3 ALA 33 3HB ALA 33 -4.808 17.669 21.097 249 HA PRO 34 HA PRO 34 -2.626 23.299 20.793 250 HB2 PRO 34 2HB PRO 34 0.156 22.919 20.693 251 HB3 PRO 34 1HB PRO 34 -0.727 23.197 22.240 252 HG2 PRO 34 2HG PRO 34 0.128 20.528 21.013 253 HG3 PRO 34 1HG PRO 34 0.348 21.095 22.720 254 HD2 PRO 34 2HD PRO 34 -1.753 19.445 21.938 255 HD3 PRO 34 1HD PRO 34 -1.986 20.721 23.223 256 H GLY 35 H GLY 35 -2.193 24.083 18.640 257 HA2 GLY 35 2HA GLY 35 -1.656 24.001 16.488 258 HA3 GLY 35 1HA GLY 35 -0.753 22.474 16.825 259 H ALA 36 H ALA 36 -4.007 22.552 17.789 260 HA ALA 36 HA ALA 36 -4.751 20.294 16.488 261 HB1 ALA 36 1HB ALA 36 -6.443 22.662 17.524 262 HB2 ALA 36 2HB ALA 36 -6.063 21.115 18.401 263 HB3 ALA 36 3HB ALA 36 -7.174 21.113 16.985 264 H ALA 37 H ALA 37 -5.131 19.846 14.397 265 HA ALA 37 HA ALA 37 -5.534 22.103 12.544 266 HB1 ALA 37 1HB ALA 37 -5.030 20.390 10.756 267 HB2 ALA 37 2HB ALA 37 -4.895 19.125 12.040 268 HB3 ALA 37 3HB ALA 37 -3.702 20.461 11.979 269 H LEU 38 H LEU 38 -6.832 18.956 13.712 270 HA LEU 38 HA LEU 38 -9.086 19.194 11.884 271 HB2 LEU 38 2HB LEU 38 -7.819 17.017 12.251 272 HB3 LEU 38 1HB LEU 38 -8.466 16.987 13.909 273 HG LEU 38 HG LEU 38 -10.815 16.894 12.972 274 HD11 LEU 38 1HD1 LEU 38 -9.424 16.558 10.239 275 HD12 LEU 38 2HD1 LEU 38 -10.452 17.963 10.724 276 HD13 LEU 38 3HD1 LEU 38 -11.179 16.330 10.561 277 HD21 LEU 38 3HD2 LEU 38 -9.593 14.847 13.646 278 HD22 LEU 38 1HD2 LEU 38 -8.911 14.672 11.990 279 HD23 LEU 38 2HD2 LEU 38 -10.688 14.506 12.255 280 H ILE 39 H ILE 39 -9.587 21.288 13.235 281 HA ILE 39 HA ILE 39 -10.759 20.840 15.791 282 HB ILE 39 HB ILE 39 -11.399 23.250 15.632 283 HG12 ILE 39 2HG1 ILE 39 -10.051 23.090 12.840 284 HG13 ILE 39 1HG1 ILE 39 -11.802 23.346 13.142 285 HG21 ILE 39 1HG2 ILE 39 -8.473 22.583 14.862 286 HG22 ILE 39 2HG2 ILE 39 -9.188 22.387 16.502 287 HG23 ILE 39 3HG2 ILE 39 -9.045 24.021 15.774 288 HD11 ILE 39 3HD ILE 39 -9.495 25.245 13.939 289 HD12 ILE 39 1HD ILE 39 -10.732 25.503 12.660 290 HD13 ILE 39 2HD ILE 39 -11.222 25.490 14.396 291 H SER 40 H SER 40 -12.002 19.913 12.877 292 HA SER 40 HA SER 40 -14.669 21.020 13.370 293 HB2 SER 40 2HB SER 40 -13.354 20.011 10.817 294 HB3 SER 40 1HB SER 40 -15.079 20.556 10.929 295 HG SER 40 1HG SER 40 -13.584 22.177 10.237 296 H TYR 41 H TYR 41 -16.213 19.755 14.067 297 HA TYR 41 HA TYR 41 -15.950 16.962 14.360 298 HB2 TYR 41 2HB TYR 41 -17.287 18.129 16.012 299 HB3 TYR 41 1HB TYR 41 -18.303 18.902 14.754 300 HD1 TYR 41 2HD TYR 41 -17.326 15.480 16.010 301 HD2 TYR 41 1HD TYR 41 -20.373 17.920 14.217 302 HE1 TYR 41 2HE TYR 41 -18.868 13.555 16.024 303 HE2 TYR 41 1HE TYR 41 -21.905 16.003 14.191 304 HH TYR 41 HH TYR 41 -22.038 13.715 14.398 305 HA PRO 42 HA PRO 42 -18.974 16.183 10.970 306 HB2 PRO 42 2HB PRO 42 -19.801 18.052 9.060 307 HB3 PRO 42 1HB PRO 42 -20.563 17.932 10.686 308 HG2 PRO 42 2HG PRO 42 -18.305 19.835 9.825 309 HG3 PRO 42 1HG PRO 42 -19.860 20.262 10.649 310 HD2 PRO 42 2HD PRO 42 -17.552 19.892 12.091 311 HD3 PRO 42 1HD PRO 42 -19.141 19.259 12.724 312 H ASP 43 H ASP 43 -16.048 17.886 10.499 313 HA ASP 43 HA ASP 43 -15.630 16.754 7.805 314 HB2 ASP 43 2HB ASP 43 -13.846 18.618 9.482 315 HB3 ASP 43 1HB ASP 43 -13.350 17.881 7.931 316 H ALA 44 H ALA 44 -15.398 15.889 11.115 317 HA ALA 44 HA ALA 44 -12.734 14.939 11.125 318 HB1 ALA 44 1HB ALA 44 -13.371 13.695 13.192 319 HB2 ALA 44 2HB ALA 44 -15.110 14.078 12.886 320 HB3 ALA 44 3HB ALA 44 -13.943 15.398 13.251 321 H ILE 45 H ILE 45 -15.858 13.606 10.164 322 HA ILE 45 HA ILE 45 -14.975 10.934 9.862 323 HB ILE 45 HB ILE 45 -17.316 11.455 10.190 324 HG12 ILE 45 2HG1 ILE 45 -16.826 10.193 7.417 325 HG13 ILE 45 1HG1 ILE 45 -16.628 9.366 8.995 326 HG21 ILE 45 1HG2 ILE 45 -17.272 12.825 7.419 327 HG22 ILE 45 2HG2 ILE 45 -17.390 13.678 9.005 328 HG23 ILE 45 3HG2 ILE 45 -18.693 12.580 8.483 329 HD11 ILE 45 3HD ILE 45 -19.263 10.504 7.842 330 HD12 ILE 45 1HD ILE 45 -18.807 8.776 8.029 331 HD13 ILE 45 2HD ILE 45 -19.078 9.785 9.491 332 H TRP 46 H TRP 46 -14.733 13.829 7.953 333 HA TRP 46 HA TRP 46 -14.478 12.745 5.405 334 HB2 TRP 46 2HB TRP 46 -14.723 15.256 6.479 335 HB3 TRP 46 1HB TRP 46 -12.957 15.300 6.224 336 HD1 TRP 46 HD TRP 46 -12.414 16.193 3.724 337 HE1 TRP 46 1HE TRP 46 -13.804 16.433 1.583 338 HE3 TRP 46 3HE TRP 46 -16.749 14.126 5.428 339 HZ2 TRP 46 2HZ TRP 46 -16.455 15.712 0.704 340 HZ3 TRP 46 3HZ TRP 46 -18.702 14.029 3.950 341 HH2 TRP 46 HH TRP 46 -18.562 14.786 1.596 342 H TRP 47 H TRP 47 -12.156 13.742 7.866 343 HA TRP 47 HA TRP 47 -9.778 12.994 6.543 344 HB2 TRP 47 2HB TRP 47 -9.939 14.629 8.467 345 HB3 TRP 47 1HB TRP 47 -10.495 13.311 9.544 346 HD1 TRP 47 HD TRP 47 -7.218 14.337 7.576 347 HE1 TRP 47 1HE TRP 47 -5.250 13.335 8.818 348 HE3 TRP 47 3HE TRP 47 -9.796 11.661 11.078 349 HZ2 TRP 47 2HZ TRP 47 -4.798 11.762 11.183 350 HZ3 TRP 47 3HZ TRP 47 -8.531 10.362 12.765 351 HH2 TRP 47 HH TRP 47 -6.067 10.437 12.831 352 H SER 48 H SER 48 -11.999 11.408 8.836 353 HA SER 48 HA SER 48 -10.523 9.221 9.484 354 HB2 SER 48 2HB SER 48 -12.789 10.066 10.455 355 HB3 SER 48 1HB SER 48 -13.581 9.105 9.152 356 HG SER 48 1HG SER 48 -13.414 7.985 11.116 357 H VAL 49 H VAL 49 -12.787 9.546 6.624 358 HA VAL 49 HA VAL 49 -12.558 6.838 6.032 359 HB VAL 49 HB VAL 49 -13.043 8.729 3.737 360 HG11 VAL 49 1HG1 VAL 49 -12.914 6.269 3.334 361 HG12 VAL 49 2HG1 VAL 49 -14.608 6.821 3.162 362 HG13 VAL 49 3HG1 VAL 49 -14.100 5.958 4.652 363 HG21 VAL 49 3HG2 VAL 49 -14.450 9.774 5.372 364 HG22 VAL 49 1HG2 VAL 49 -14.923 8.198 6.130 365 HG23 VAL 49 2HG2 VAL 49 -15.518 8.642 4.489 366 H GLU 50 H GLU 50 -10.543 9.624 4.752 367 HA GLU 50 HA GLU 50 -9.163 7.690 3.129 368 HB2 GLU 50 2HB GLU 50 -7.540 9.458 2.552 369 HB3 GLU 50 1HB GLU 50 -9.227 9.677 2.048 370 HG2 GLU 50 2HG GLU 50 -9.574 11.373 3.901 371 HG3 GLU 50 1HG GLU 50 -7.854 11.125 4.416 372 H THR 51 H THR 51 -8.917 8.624 6.427 373 HA THR 51 HA THR 51 -6.168 7.909 6.715 374 HB THR 51 HB THR 51 -8.440 7.870 8.773 375 HG1 THR 51 1HG THR 51 -8.104 9.915 7.950 376 HG21 THR 51 3HG2 THR 51 -5.354 7.861 9.117 377 HG22 THR 51 1HG2 THR 51 -6.475 6.524 9.557 378 HG23 THR 51 2HG2 THR 51 -6.554 8.086 10.440 379 H ALA 52 H ALA 52 -9.283 6.120 6.642 380 HA ALA 52 HA ALA 52 -8.126 3.684 7.533 381 HB1 ALA 52 1HB ALA 52 -10.665 4.194 5.871 382 HB2 ALA 52 2HB ALA 52 -10.560 4.030 7.671 383 HB3 ALA 52 3HB ALA 52 -10.197 2.620 6.615 384 H THR 53 H THR 53 -8.159 5.308 4.350 385 HA THR 53 HA THR 53 -7.231 2.817 3.132 386 HB THR 53 HB THR 53 -7.285 4.157 1.006 387 HG1 THR 53 1HG THR 53 -7.253 6.211 1.857 388 HG21 THR 53 3HG2 THR 53 -9.906 3.953 2.664 389 HG22 THR 53 1HG2 THR 53 -9.126 2.603 1.755 390 HG23 THR 53 2HG2 THR 53 -9.780 4.027 0.867 391 H THR 54 H THR 54 -5.830 4.721 5.196 392 HA THR 54 HA THR 54 -3.813 5.267 5.705 393 HB THR 54 HB THR 54 -2.125 3.537 5.306 394 HG1 THR 54 1HG THR 54 -2.604 3.139 3.119 395 HG21 THR 54 3HG2 THR 54 -4.955 2.278 5.557 396 HG22 THR 54 1HG2 THR 54 -4.166 3.223 6.862 397 HG23 THR 54 2HG2 THR 54 -3.421 1.688 6.280 398 H VAL 55 H VAL 55 -4.691 6.820 3.434 399 HA VAL 55 HA VAL 55 -2.234 7.031 1.834 400 HB VAL 55 HB VAL 55 -4.065 6.540 0.471 401 HG11 VAL 55 1HG1 VAL 55 -6.189 7.609 0.392 402 HG12 VAL 55 2HG1 VAL 55 -5.696 8.943 1.483 403 HG13 VAL 55 3HG1 VAL 55 -5.908 7.264 2.116 404 HG21 VAL 55 3HG2 VAL 55 -2.434 8.224 -0.345 405 HG22 VAL 55 1HG2 VAL 55 -3.451 9.568 0.265 406 HG23 VAL 55 2HG2 VAL 55 -4.066 8.507 -1.055 407 H GLY 56 H GLY 56 -4.752 9.384 2.940 408 HA2 GLY 56 2HA GLY 56 -4.499 11.116 4.363 409 HA3 GLY 56 1HA GLY 56 -2.776 10.642 4.644 410 H TYR 57 H TYR 57 -5.049 12.307 2.344 411 HA TYR 57 HA TYR 57 -2.910 12.821 0.541 412 HB2 TYR 57 2HB TYR 57 -5.789 12.915 0.484 413 HB3 TYR 57 1HB TYR 57 -5.301 14.616 0.213 414 HD1 TYR 57 2HD TYR 57 -3.681 15.126 -1.683 415 HD2 TYR 57 1HD TYR 57 -5.430 11.235 -1.152 416 HE1 TYR 57 2HE TYR 57 -3.068 14.545 -3.988 417 HE2 TYR 57 1HE TYR 57 -4.814 10.637 -3.463 418 HH TYR 57 HH TYR 57 -2.799 12.802 -5.475 419 H GLY 58 H GLY 58 -3.692 14.219 3.467 420 HA2 GLY 58 2HA GLY 58 -2.290 15.707 4.444 421 HA3 GLY 58 1HA GLY 58 -1.886 16.429 2.850 422 H ASP 59 H ASP 59 -5.292 15.979 3.545 423 HA ASP 59 HA ASP 59 -5.585 18.818 3.541 424 HB2 ASP 59 2HB ASP 59 -7.377 17.381 2.538 425 HB3 ASP 59 1HB ASP 59 -7.845 16.856 4.195 426 H ARG 60 H ARG 60 -5.743 16.291 6.190 427 HA ARG 60 HA ARG 60 -5.160 18.483 7.968 428 HB2 ARG 60 2HB ARG 60 -7.322 16.471 8.828 429 HB3 ARG 60 1HB ARG 60 -6.552 17.746 9.819 430 HG2 ARG 60 2HG ARG 60 -8.469 18.885 9.316 431 HG3 ARG 60 1HG ARG 60 -7.480 19.379 7.905 432 HD2 ARG 60 2HD ARG 60 -8.593 17.205 6.762 433 HD3 ARG 60 1HD ARG 60 -9.825 17.361 8.068 434 HE ARG 60 HE ARG 60 -9.522 18.888 5.640 435 HH11 ARG 60 1HH2 ARG 60 -10.479 20.262 8.805 436 HH12 ARG 60 2HH2 ARG 60 -12.143 20.332 8.346 437 HH21 ARG 60 1HH1 ARG 60 -11.660 19.388 5.026 438 HH22 ARG 60 2HH1 ARG 60 -12.791 19.997 6.219 439 H TYR 61 H TYR 61 -4.274 17.440 10.129 440 HA TYR 61 HA TYR 61 -3.058 14.923 9.628 441 HB2 TYR 61 2HB TYR 61 -0.775 16.116 10.400 442 HB3 TYR 61 1HB TYR 61 -1.213 16.081 8.662 443 HD1 TYR 61 2HD TYR 61 -1.256 18.268 11.720 444 HD2 TYR 61 1HD TYR 61 -1.706 18.077 7.452 445 HE1 TYR 61 2HE TYR 61 -1.262 20.724 11.622 446 HE2 TYR 61 1HE TYR 61 -1.738 20.531 7.335 447 HH TYR 61 HH TYR 61 -1.784 22.478 8.508 448 HA PRO 62 HA PRO 62 -3.940 15.566 14.004 449 HB2 PRO 62 2HB PRO 62 -2.898 13.214 15.072 450 HB3 PRO 62 1HB PRO 62 -4.269 13.191 13.919 451 HG2 PRO 62 2HG PRO 62 -1.321 12.660 13.365 452 HG3 PRO 62 1HG PRO 62 -2.759 11.745 12.774 453 HD2 PRO 62 2HD PRO 62 -1.381 13.820 11.350 454 HD3 PRO 62 1HD PRO 62 -3.090 13.275 11.012 455 H VAL 63 H VAL 63 -2.316 14.879 16.226 456 HA VAL 63 HA VAL 63 0.260 16.112 15.706 457 HB VAL 63 HB VAL 63 -1.384 17.914 16.115 458 HG11 VAL 63 1HG1 VAL 63 -2.363 18.344 18.286 459 HG12 VAL 63 2HG1 VAL 63 -1.715 16.815 18.982 460 HG13 VAL 63 3HG1 VAL 63 -2.929 16.783 17.645 461 HG21 VAL 63 3HG2 VAL 63 1.028 18.262 16.514 462 HG22 VAL 63 1HG2 VAL 63 0.829 17.866 18.267 463 HG23 VAL 63 2HG2 VAL 63 -0.030 19.268 17.556 464 H THR 64 H THR 64 0.403 16.292 18.758 465 HA THR 64 HA THR 64 1.324 13.523 19.032 466 HB THR 64 HB THR 64 2.135 16.089 20.514 467 HG1 THR 64 1HG THR 64 2.870 16.187 18.443 468 HG21 THR 64 3HG2 THR 64 3.486 13.296 20.489 469 HG22 THR 64 1HG2 THR 64 2.553 13.978 21.872 470 HG23 THR 64 2HG2 THR 64 4.072 14.768 21.332 471 H GLU 65 H GLU 65 -0.432 16.144 20.823 472 HA GLU 65 HA GLU 65 -0.781 14.461 23.072 473 HB2 GLU 65 2HB GLU 65 -0.465 17.022 23.099 474 HB3 GLU 65 1HB GLU 65 -2.170 17.139 22.550 475 HG2 GLU 65 2HG GLU 65 -2.087 17.493 24.962 476 HG3 GLU 65 1HG GLU 65 -2.868 15.899 24.667 477 H GLU 66 H GLU 66 -2.544 14.926 20.100 478 HA GLU 66 HA GLU 66 -5.071 14.182 21.009 479 HB2 GLU 66 2HB GLU 66 -5.705 14.001 18.750 480 HB3 GLU 66 1HB GLU 66 -4.473 15.259 18.782 481 HG2 GLU 66 2HG GLU 66 -3.904 14.101 16.883 482 HG3 GLU 66 1HG GLU 66 -2.792 13.271 18.041 483 H GLY 67 H GLY 67 -2.146 12.506 20.209 484 HA2 GLY 67 2HA GLY 67 -1.409 10.628 21.318 485 HA3 GLY 67 1HA GLY 67 -3.141 10.063 21.503 486 H ARG 68 H ARG 68 -0.594 10.914 19.119 487 HA ARG 68 HA ARG 68 -1.886 10.653 16.827 488 HB2 ARG 68 2HB ARG 68 0.626 11.260 17.287 489 HB3 ARG 68 1HB ARG 68 0.931 9.504 17.033 490 HG2 ARG 68 2HG ARG 68 -0.554 9.916 14.817 491 HG3 ARG 68 1HG ARG 68 -0.196 11.628 15.138 492 HD2 ARG 68 2HD ARG 68 2.324 11.040 14.936 493 HD3 ARG 68 1HD ARG 68 1.847 9.312 14.687 494 HE ARG 68 HE ARG 68 1.178 9.784 12.505 495 HH11 ARG 68 1HH2 ARG 68 1.099 12.929 14.274 496 HH12 ARG 68 2HH2 ARG 68 1.254 13.896 12.860 497 HH21 ARG 68 1HH1 ARG 68 1.368 11.069 10.603 498 HH22 ARG 68 2HH1 ARG 68 1.130 12.813 10.710 499 H LYS 69 H LYS 69 -1.142 8.105 18.900 500 HA LYS 69 HA LYS 69 -1.382 5.738 17.609 501 HB2 LYS 69 2HB LYS 69 -3.012 6.758 20.038 502 HB3 LYS 69 1HB LYS 69 -2.775 5.026 19.628 503 HG2 LYS 69 2HG LYS 69 -0.498 6.966 20.373 504 HG3 LYS 69 1HG LYS 69 -1.325 5.893 21.547 505 HD2 LYS 69 2HD LYS 69 -0.337 3.944 20.717 506 HD3 LYS 69 1HD LYS 69 -0.306 4.569 19.046 507 HE2 LYS 69 2HE LYS 69 1.550 6.256 19.913 508 HE3 LYS 69 1HE LYS 69 1.730 5.091 21.284 509 HZ1 LYS 69 3HZ LYS 69 3.207 4.486 19.491 510 HZ2 LYS 69 1HZ LYS 69 1.917 4.656 18.364 511 HZ3 LYS 69 2HZ LYS 69 1.928 3.345 19.425 512 H VAL 70 H VAL 70 -3.920 8.289 17.877 513 HA VAL 70 HA VAL 70 -6.061 6.575 17.305 514 HB VAL 70 HB VAL 70 -5.761 9.579 16.907 515 HG11 VAL 70 1HG1 VAL 70 -7.548 8.798 15.371 516 HG12 VAL 70 2HG1 VAL 70 -8.283 9.596 16.797 517 HG13 VAL 70 3HG1 VAL 70 -8.288 7.791 16.675 518 HG21 VAL 70 3HG2 VAL 70 -5.619 8.737 19.285 519 HG22 VAL 70 1HG2 VAL 70 -7.196 7.877 19.070 520 HG23 VAL 70 2HG2 VAL 70 -7.102 9.687 18.985 521 H ALA 71 H ALA 71 -3.864 8.480 15.186 522 HA ALA 71 HA ALA 71 -5.159 7.777 12.784 523 HB1 ALA 71 1HB ALA 71 -2.986 8.320 11.650 524 HB2 ALA 71 2HB ALA 71 -2.160 8.359 13.250 525 HB3 ALA 71 3HB ALA 71 -3.421 9.581 12.858 526 H GLU 72 H GLU 72 -2.355 6.312 14.499 527 HA GLU 72 HA GLU 72 -1.729 4.255 12.829 528 HB2 GLU 72 2HB GLU 72 -1.848 4.067 15.908 529 HB3 GLU 72 1HB GLU 72 -0.972 2.927 14.834 530 HG2 GLU 72 2HG GLU 72 0.619 4.697 14.163 531 HG3 GLU 72 1HG GLU 72 -0.263 5.918 15.158 532 H GLN 73 H GLN 73 -4.209 4.227 15.405 533 HA GLN 73 HA GLN 73 -4.757 1.488 15.140 534 HB2 GLN 73 2HB GLN 73 -5.220 2.874 17.200 535 HB3 GLN 73 1HB GLN 73 -6.589 3.651 16.345 536 HG2 GLN 73 2HG GLN 73 -7.799 1.495 16.208 537 HG3 GLN 73 1HG GLN 73 -6.345 0.599 16.779 538 HE21 GLN 73 1HE2 GLN 73 -7.371 -0.291 18.627 539 HE22 GLN 73 2HE2 GLN 73 -7.956 0.634 19.966 540 H VAL 74 H VAL 74 -6.179 4.370 13.576 541 HA VAL 74 HA VAL 74 -8.393 2.919 12.485 542 HB VAL 74 HB VAL 74 -7.167 5.641 11.801 543 HG11 VAL 74 1HG1 VAL 74 -8.456 4.820 9.820 544 HG12 VAL 74 2HG1 VAL 74 -9.399 6.089 10.667 545 HG13 VAL 74 3HG1 VAL 74 -9.841 4.354 10.875 546 HG21 VAL 74 3HG2 VAL 74 -8.135 5.333 14.162 547 HG22 VAL 74 1HG2 VAL 74 -9.686 4.842 13.414 548 HG23 VAL 74 2HG2 VAL 74 -9.033 6.514 13.161 549 H MET 75 H MET 75 -5.178 4.006 11.347 550 HA MET 75 HA MET 75 -5.465 3.161 8.712 551 HB2 MET 75 2HB MET 75 -2.974 3.530 10.476 552 HB3 MET 75 1HB MET 75 -2.894 3.193 8.710 553 HG2 MET 75 2HG MET 75 -4.299 5.180 8.244 554 HG3 MET 75 1HG MET 75 -4.370 5.594 9.964 555 HE1 MET 75 3HE MET 75 -1.941 5.930 11.349 556 HE2 MET 75 1HE MET 75 -0.466 6.544 10.572 557 HE3 MET 75 2HE MET 75 -0.894 4.805 10.419 558 H LYS 76 H LYS 76 -4.190 1.380 11.602 559 HA LYS 76 HA LYS 76 -3.502 -0.867 10.075 560 HB2 LYS 76 2HB LYS 76 -2.789 -0.378 12.547 561 HB3 LYS 76 1HB LYS 76 -4.347 -1.152 12.993 562 HG2 LYS 76 2HG LYS 76 -3.541 -3.126 11.411 563 HG3 LYS 76 1HG LYS 76 -1.928 -2.354 11.493 564 HD2 LYS 76 2HD LYS 76 -1.954 -2.702 14.008 565 HD3 LYS 76 1HD LYS 76 -3.619 -3.389 13.858 566 HE2 LYS 76 2HE LYS 76 -2.672 -5.177 12.274 567 HE3 LYS 76 1HE LYS 76 -1.012 -4.589 12.673 568 HZ1 LYS 76 3HZ LYS 76 -3.028 -5.738 14.560 569 HZ2 LYS 76 1HZ LYS 76 -1.470 -5.202 15.010 570 HZ3 LYS 76 2HZ LYS 76 -1.615 -6.492 13.949 571 H ALA 77 H ALA 77 -6.610 0.120 11.497 572 HA ALA 77 HA ALA 77 -7.868 -2.395 11.302 573 HB1 ALA 77 1HB ALA 77 -10.022 -1.135 11.431 574 HB2 ALA 77 2HB ALA 77 -9.149 0.406 11.096 575 HB3 ALA 77 3HB ALA 77 -8.848 -0.480 12.634 576 H GLY 78 H GLY 78 -7.250 0.198 8.966 577 HA2 GLY 78 2HA GLY 78 -8.979 -0.669 6.915 578 HA3 GLY 78 1HA GLY 78 -7.484 0.336 6.785 579 H ILE 79 H ILE 79 -5.514 -1.288 7.642 580 HA ILE 79 HA ILE 79 -4.995 -2.910 5.460 581 HB ILE 79 HB ILE 79 -3.735 -3.050 8.245 582 HG12 ILE 79 2HG1 ILE 79 -2.940 -1.428 5.735 583 HG13 ILE 79 1HG1 ILE 79 -3.678 -0.739 7.207 584 HG21 ILE 79 1HG2 ILE 79 -1.759 -4.041 7.011 585 HG22 ILE 79 2HG2 ILE 79 -2.706 -3.992 5.478 586 HG23 ILE 79 3HG2 ILE 79 -3.209 -5.074 6.826 587 HD11 ILE 79 3HD ILE 79 -0.889 -2.045 7.020 588 HD12 ILE 79 1HD ILE 79 -1.280 -0.313 7.271 589 HD13 ILE 79 2HD ILE 79 -1.668 -1.513 8.562 590 H GLU 80 H GLU 80 -6.325 -3.704 8.693 591 HA GLU 80 HA GLU 80 -6.235 -6.476 8.353 592 HB2 GLU 80 2HB GLU 80 -8.095 -4.757 10.091 593 HB3 GLU 80 1HB GLU 80 -8.052 -6.550 10.154 594 HG2 GLU 80 2HG GLU 80 -5.650 -6.510 10.826 595 HG3 GLU 80 1HG GLU 80 -5.659 -4.710 10.816 596 H VAL 81 H VAL 81 -8.907 -4.171 7.550 597 HA VAL 81 HA VAL 81 -10.693 -6.339 7.064 598 HB VAL 81 HB VAL 81 -12.273 -4.672 6.186 599 HG11 VAL 81 1HG1 VAL 81 -10.895 -3.895 8.858 600 HG12 VAL 81 2HG1 VAL 81 -12.083 -5.227 8.639 601 HG13 VAL 81 3HG1 VAL 81 -12.586 -3.520 8.371 602 HG21 VAL 81 3HG2 VAL 81 -11.701 -2.243 6.361 603 HG22 VAL 81 1HG2 VAL 81 -10.695 -3.025 5.125 604 HG23 VAL 81 2HG2 VAL 81 -10.005 -2.641 6.745 605 H PHE 82 H PHE 82 -8.730 -4.169 4.949 606 HA PHE 82 HA PHE 82 -9.810 -5.289 2.581 607 HB2 PHE 82 2HB PHE 82 -7.173 -3.739 3.016 608 HB3 PHE 82 1HB PHE 82 -7.883 -4.130 1.405 609 HD1 PHE 82 2HD PHE 82 -10.741 -3.512 1.630 610 HD2 PHE 82 1HD PHE 82 -7.361 -1.456 3.333 611 HE1 PHE 82 2HE PHE 82 -12.049 -1.430 1.716 612 HE2 PHE 82 1HE PHE 82 -8.676 0.627 3.419 613 HZ PHE 82 HZ PHE 82 -11.026 0.652 2.609 614 H ALA 83 H ALA 83 -6.859 -5.964 4.562 615 HA ALA 83 HA ALA 83 -5.775 -7.784 2.775 616 HB1 ALA 83 1HB ALA 83 -4.465 -6.983 4.730 617 HB2 ALA 83 2HB ALA 83 -4.531 -8.778 4.709 618 HB3 ALA 83 3HB ALA 83 -5.581 -7.849 5.847 619 H LEU 84 H LEU 84 -8.334 -8.205 5.240 620 HA LEU 84 HA LEU 84 -8.289 -11.000 5.250 621 HB2 LEU 84 2HB LEU 84 -9.402 -9.539 6.989 622 HB3 LEU 84 1HB LEU 84 -10.680 -9.144 5.797 623 HG LEU 84 HG LEU 84 -11.363 -11.561 5.750 624 HD11 LEU 84 1HD1 LEU 84 -9.226 -12.700 6.293 625 HD12 LEU 84 2HD1 LEU 84 -10.481 -13.153 7.490 626 HD13 LEU 84 3HD1 LEU 84 -9.212 -11.956 7.937 627 HD21 LEU 84 3HD2 LEU 84 -12.382 -11.652 8.015 628 HD22 LEU 84 1HD2 LEU 84 -12.477 -9.990 7.329 629 HD23 LEU 84 2HD2 LEU 84 -11.250 -10.377 8.599 630 H VAL 85 H VAL 85 -9.847 -8.686 3.055 631 HA VAL 85 HA VAL 85 -11.674 -10.425 1.838 632 HB VAL 85 HB VAL 85 -10.244 -7.934 0.770 633 HG11 VAL 85 1HG1 VAL 85 -12.230 -7.752 -0.811 634 HG12 VAL 85 2HG1 VAL 85 -12.689 -9.442 -0.378 635 HG13 VAL 85 3HG1 VAL 85 -11.120 -9.104 -1.192 636 HG21 VAL 85 3HG2 VAL 85 -12.390 -6.789 1.412 637 HG22 VAL 85 1HG2 VAL 85 -11.604 -7.529 2.836 638 HG23 VAL 85 2HG2 VAL 85 -13.023 -8.327 2.095 639 H THR 86 H THR 86 -8.204 -10.278 1.686 640 HA THR 86 HA THR 86 -7.818 -11.120 -0.900 641 HB THR 86 HB THR 86 -5.928 -11.709 1.401 642 HG1 THR 86 1HG THR 86 -6.254 -9.648 1.571 643 HG21 THR 86 3HG2 THR 86 -5.245 -12.726 -0.809 644 HG22 THR 86 1HG2 THR 86 -4.199 -11.323 -0.413 645 HG23 THR 86 2HG2 THR 86 -5.517 -11.142 -1.628 646 H ALA 87 H ALA 87 -9.065 -12.992 1.758 647 HA ALA 87 HA ALA 87 -8.351 -15.561 0.868 648 HB1 ALA 87 1HB ALA 87 -9.513 -15.212 3.041 649 HB2 ALA 87 2HB ALA 87 -10.494 -16.307 2.009 650 HB3 ALA 87 3HB ALA 87 -10.961 -14.576 2.184 651 H ALA 88 H ALA 88 -11.214 -13.512 0.041 652 HA ALA 88 HA ALA 88 -12.279 -15.341 -1.842 653 HB1 ALA 88 1HB ALA 88 -13.694 -13.571 -0.761 654 HB2 ALA 88 2HB ALA 88 -13.742 -13.452 -2.556 655 HB3 ALA 88 3HB ALA 88 -12.729 -12.300 -1.602 656 H LEU 89 H LEU 89 -10.046 -12.545 -2.073 657 HA LEU 89 HA LEU 89 -10.034 -12.432 -4.888 658 HB2 LEU 89 2HB LEU 89 -7.734 -11.655 -3.005 659 HB3 LEU 89 1HB LEU 89 -7.895 -11.176 -4.723 660 HG LEU 89 HG LEU 89 -9.832 -10.370 -2.470 661 HD11 LEU 89 1HD1 LEU 89 -7.654 -8.708 -3.887 662 HD12 LEU 89 2HD1 LEU 89 -7.583 -9.311 -2.193 663 HD13 LEU 89 3HD1 LEU 89 -8.825 -8.104 -2.662 664 HD21 LEU 89 3HD2 LEU 89 -9.698 -9.438 -5.415 665 HD22 LEU 89 1HD2 LEU 89 -10.739 -8.722 -4.131 666 HD23 LEU 89 2HD2 LEU 89 -11.017 -10.416 -4.659 667 H ALA 90 H ALA 90 -7.939 -14.227 -2.563 668 HA ALA 90 HA ALA 90 -6.315 -15.296 -4.639 669 HB1 ALA 90 1HB ALA 90 -5.425 -16.782 -2.820 670 HB2 ALA 90 2HB ALA 90 -6.731 -16.180 -1.724 671 HB3 ALA 90 3HB ALA 90 -5.459 -15.052 -2.315 672 H THR 91 H THR 91 -9.503 -16.033 -3.536 673 HA THR 91 HA THR 91 -9.453 -18.814 -4.287 674 HB THR 91 HB THR 91 -11.936 -16.996 -4.148 675 HG1 THR 91 1HG THR 91 -10.600 -17.061 -2.168 676 HG21 THR 91 3HG2 THR 91 -11.493 -20.049 -3.788 677 HG22 THR 91 1HG2 THR 91 -12.372 -19.255 -5.147 678 HG23 THR 91 2HG2 THR 91 -13.052 -19.191 -3.492 679 H ASP 92 H ASP 92 -9.636 -15.704 -5.922 680 HA ASP 92 HA ASP 92 -11.594 -16.191 -7.747 681 HB2 ASP 92 2HB ASP 92 -10.457 -13.937 -7.319 682 HB3 ASP 92 1HB ASP 92 -9.112 -14.502 -8.357 683 H PHE 93 H PHE 93 -8.112 -16.969 -8.049 684 HA PHE 93 HA PHE 93 -8.370 -17.772 -10.740 685 HB2 PHE 93 2HB PHE 93 -6.118 -18.435 -10.723 686 HB3 PHE 93 1HB PHE 93 -6.179 -17.080 -9.559 687 HD1 PHE 93 1HD PHE 93 -6.203 -17.696 -7.019 688 HD2 PHE 93 2HD PHE 93 -5.321 -20.521 -10.116 689 HE1 PHE 93 1HE PHE 93 -5.248 -19.247 -5.344 690 HE2 PHE 93 2HE PHE 93 -4.369 -22.077 -8.448 691 HZ PHE 93 HZ PHE 93 -4.324 -21.429 -6.044 692 H VAL 94 H VAL 94 -9.307 -19.415 -7.831 693 HA VAL 94 HA VAL 94 -8.752 -22.063 -8.781 694 HB VAL 94 HB VAL 94 -10.624 -21.194 -6.523 695 HG11 VAL 94 1HG1 VAL 94 -9.100 -23.835 -7.119 696 HG12 VAL 94 2HG1 VAL 94 -10.882 -23.598 -7.211 697 HG13 VAL 94 3HG1 VAL 94 -10.044 -23.493 -5.626 698 HG21 VAL 94 3HG2 VAL 94 -7.567 -21.714 -6.542 699 HG22 VAL 94 1HG2 VAL 94 -8.586 -21.582 -5.066 700 HG23 VAL 94 2HG2 VAL 94 -8.384 -20.163 -6.134 701 H ARG 95 H ARG 95 -11.138 -19.604 -9.244 702 HA ARG 95 HA ARG 95 -13.313 -21.315 -9.917 703 HB2 ARG 95 2HB ARG 95 -13.303 -18.834 -9.033 704 HB3 ARG 95 1HB ARG 95 -12.948 -18.377 -10.722 705 HG2 ARG 95 2HG ARG 95 -15.092 -19.570 -11.412 706 HG3 ARG 95 1HG ARG 95 -15.470 -19.859 -9.684 707 HD2 ARG 95 2HD ARG 95 -15.007 -17.104 -11.022 708 HD3 ARG 95 1HD ARG 95 -16.644 -17.810 -10.696 709 HE ARG 95 HE ARG 95 -15.573 -17.832 -8.178 710 HH11 ARG 95 1HH2 ARG 95 -15.808 -15.236 -10.698 711 HH12 ARG 95 2HH2 ARG 95 -15.537 -13.959 -9.609 712 HH21 ARG 95 1HH1 ARG 95 -15.827 -15.893 -6.587 713 HH22 ARG 95 2HH1 ARG 95 -15.599 -14.370 -7.252 714 H ARG 96 H ARG 96 -10.358 -20.502 -11.543 715 HA ARG 96 HA ARG 96 -11.509 -20.306 -14.154 716 HB2 ARG 96 2HB ARG 96 -9.371 -19.946 -15.012 717 HB3 ARG 96 1HB ARG 96 -9.254 -19.285 -13.348 718 HG2 ARG 96 2HG ARG 96 -8.428 -21.755 -12.758 719 HG3 ARG 96 1HG ARG 96 -8.151 -21.885 -14.530 720 HD2 ARG 96 2HD ARG 96 -6.624 -19.809 -14.327 721 HD3 ARG 96 1HD ARG 96 -6.748 -19.954 -12.525 722 HE ARG 96 HE ARG 96 -5.461 -21.764 -14.481 723 HH11 ARG 96 1HH2 ARG 96 -6.940 -21.773 -11.162 724 HH12 ARG 96 2HH2 ARG 96 -6.450 -23.415 -10.913 725 HH21 ARG 96 1HH1 ARG 96 -4.557 -23.893 -13.793 726 HH22 ARG 96 2HH1 ARG 96 -5.147 -24.551 -12.329 727 H GLU 97 H GLU 97 -10.853 -22.960 -12.071 728 HA GLU 97 HA GLU 97 -10.590 -24.829 -14.327 729 HB2 GLU 97 2HB GLU 97 -10.269 -25.472 -11.343 730 HB3 GLU 97 1HB GLU 97 -9.893 -26.520 -12.758 731 HG2 GLU 97 2HG GLU 97 -8.287 -24.601 -13.533 732 HG3 GLU 97 1HG GLU 97 -8.522 -23.890 -11.894 733 H GLU 98 H GLU 98 -12.120 -26.819 -13.998 734 HA GLU 98 HA GLU 98 -14.135 -27.489 -14.248 735 HB2 GLU 98 2HB GLU 98 -15.196 -25.408 -12.284 736 HB3 GLU 98 1HB GLU 98 -16.096 -26.807 -12.944 737 HG2 GLU 98 2HG GLU 98 -13.548 -27.019 -11.203 738 HG3 GLU 98 1HG GLU 98 -15.233 -27.187 -10.601 739 H GLU 99 H GLU 99 -13.822 -23.975 -14.375 740 HA GLU 99 HA GLU 99 -15.974 -23.319 -15.879 741 HB2 GLU 99 2HB GLU 99 -14.401 -21.789 -14.659 742 HB3 GLU 99 1HB GLU 99 -13.207 -21.956 -15.977 743 HG2 GLU 99 2HG GLU 99 -16.066 -20.992 -16.609 744 HG3 GLU 99 1HG GLU 99 -14.939 -19.895 -15.746 745 H ARG 100 H ARG 100 -12.734 -24.291 -17.092 746 HA ARG 100 HA ARG 100 -13.244 -23.675 -19.734 747 HB2 ARG 100 2HB ARG 100 -10.995 -24.143 -18.691 748 HB3 ARG 100 1HB ARG 100 -11.367 -25.903 -18.735 749 HG2 ARG 100 2HG ARG 100 -11.435 -25.839 -21.221 750 HG3 ARG 100 1HG ARG 100 -11.383 -24.047 -21.201 751 HD2 ARG 100 2HD ARG 100 -9.187 -24.905 -21.835 752 HD3 ARG 100 1HD ARG 100 -9.067 -24.077 -20.242 753 HE ARG 100 HE ARG 100 -8.859 -26.176 -19.098 754 HH11 ARG 100 1HH2 ARG 100 -8.190 -26.391 -22.646 755 HH12 ARG 100 2HH2 ARG 100 -7.768 -28.037 -22.602 756 HH21 ARG 100 1HH1 ARG 100 -7.938 -28.288 -19.041 757 HH22 ARG 100 2HH1 ARG 100 -7.370 -29.053 -20.450 758 H ARG 101 H ARG 101 -14.184 -26.522 -17.907 759 HA ARG 101 HA ARG 101 -14.919 -28.051 -20.277 760 HB2 ARG 101 2HB ARG 101 -15.305 -28.588 -17.257 761 HB3 ARG 101 1HB ARG 101 -15.576 -29.780 -18.573 762 HG2 ARG 101 2HG ARG 101 -13.163 -29.761 -19.126 763 HG3 ARG 101 1HG ARG 101 -12.841 -28.480 -17.905 764 HD2 ARG 101 2HD ARG 101 -13.460 -29.998 -16.038 765 HD3 ARG 101 1HD ARG 101 -13.957 -31.271 -17.222 766 HE ARG 101 HE ARG 101 -11.122 -30.167 -16.884 767 HH11 ARG 101 1HH2 ARG 101 -13.301 -33.015 -16.939 768 HH12 ARG 101 2HH2 ARG 101 -12.108 -34.165 -17.258 769 HH21 ARG 101 1HH1 ARG 101 -9.366 -31.815 -17.267 770 HH22 ARG 101 2HH1 ARG 101 -9.820 -33.471 -17.394 771 H GLY 102 H GLY 102 -16.200 -25.719 -18.064 772 HA2 GLY 102 2HA GLY 102 -18.133 -24.716 -17.944 773 HA3 GLY 102 1HA GLY 102 -18.756 -25.756 -19.285 774 H HIS 103 H HIS 103 -17.306 -27.275 -16.462 775 HA HIS 103 HA HIS 103 -19.632 -27.580 -14.932 776 HB2 HIS 103 2HB HIS 103 -20.320 -29.129 -16.887 777 HB3 HIS 103 1HB HIS 103 -18.799 -30.033 -16.639 778 HD1 HIS 103 1HD HIS 103 -21.833 -28.946 -14.542 779 HD2 HIS 103 2HD HIS 103 -19.339 -32.304 -15.084 780 HE1 HIS 103 1HE HIS 103 -22.753 -30.819 -13.092 781 HE2 HIS 103 2HE HIS 103 -21.286 -32.825 -13.474 782 H1 SER 1 H SER 1 2.041 -17.318 -20.741 783 HA SER 1 HA SER 1 0.868 -15.252 -19.606 784 HB2 SER 1 2HB SER 1 1.204 -14.030 -21.832 785 HB3 SER 1 1HB SER 1 0.182 -15.282 -22.620 786 HG SER 1 1HG SER 1 -0.777 -13.222 -21.906 787 H ALA 2 H ALA 2 -1.713 -15.839 -20.035 788 HA ALA 2 HA ALA 2 -2.294 -18.405 -20.914 789 HB1 ALA 2 1HB ALA 2 -2.796 -19.585 -18.764 790 HB2 ALA 2 2HB ALA 2 -2.101 -18.191 -17.820 791 HB3 ALA 2 3HB ALA 2 -1.051 -19.215 -18.855 792 H ASP 3 H ASP 3 -4.228 -18.287 -18.334 793 HA ASP 3 HA ASP 3 -6.139 -16.494 -19.646 794 HB2 ASP 3 2HB ASP 3 -6.827 -18.875 -19.174 795 HB3 ASP 3 1HB ASP 3 -6.495 -18.635 -17.424 796 H HIS 4 H HIS 4 -5.172 -17.434 -16.350 797 HA HIS 4 HA HIS 4 -6.396 -15.386 -15.023 798 HB2 HIS 4 2HB HIS 4 -5.077 -15.914 -13.049 799 HB3 HIS 4 1HB HIS 4 -5.483 -17.441 -13.873 800 HD1 HIS 4 1HD HIS 4 -3.251 -18.574 -15.245 801 HD2 HIS 4 2HD HIS 4 -2.461 -15.463 -12.503 802 HE1 HIS 4 1HE HIS 4 -0.780 -18.684 -14.589 803 HE2 HIS 4 2HE HIS 4 -0.387 -16.889 -12.864 804 H GLU 5 H GLU 5 -3.254 -15.299 -16.612 805 HA GLU 5 HA GLU 5 -2.261 -13.070 -15.167 806 HB2 GLU 5 2HB GLU 5 -1.204 -13.843 -17.939 807 HB3 GLU 5 1HB GLU 5 -0.352 -13.243 -16.484 808 HG2 GLU 5 2HG GLU 5 -1.199 -15.593 -15.448 809 HG3 GLU 5 1HG GLU 5 -1.307 -16.080 -17.191 810 H ARG 6 H ARG 6 -4.293 -13.561 -18.025 811 HA ARG 6 HA ARG 6 -3.757 -10.984 -19.163 812 HB2 ARG 6 2HB ARG 6 -6.019 -13.029 -19.618 813 HB3 ARG 6 1HB ARG 6 -5.966 -11.455 -20.448 814 HG2 ARG 6 2HG ARG 6 -3.847 -13.684 -20.677 815 HG3 ARG 6 1HG ARG 6 -5.121 -13.303 -21.877 816 HD2 ARG 6 2HD ARG 6 -2.652 -11.609 -21.114 817 HD3 ARG 6 1HD ARG 6 -3.058 -12.343 -22.720 818 HE ARG 6 HE ARG 6 -5.207 -10.584 -22.035 819 HH11 ARG 6 1HH2 ARG 6 -1.683 -10.379 -22.844 820 HH12 ARG 6 2HH2 ARG 6 -1.763 -8.691 -23.160 821 HH21 ARG 6 1HH1 ARG 6 -5.262 -8.232 -22.668 822 HH22 ARG 6 2HH1 ARG 6 -3.782 -7.534 -23.200 823 H GLU 7 H GLU 7 -6.208 -12.446 -16.978 824 HA GLU 7 HA GLU 7 -7.878 -10.233 -17.069 825 HB2 GLU 7 2HB GLU 7 -8.174 -12.739 -16.058 826 HB3 GLU 7 1HB GLU 7 -7.853 -11.869 -14.526 827 HG2 GLU 7 2HG GLU 7 -10.270 -11.946 -14.857 828 HG3 GLU 7 1HG GLU 7 -9.760 -10.249 -15.179 829 H ALA 8 H ALA 8 -5.045 -10.937 -15.110 830 HA ALA 8 HA ALA 8 -5.279 -8.809 -13.283 831 HB1 ALA 8 1HB ALA 8 -2.757 -10.204 -14.419 832 HB2 ALA 8 2HB ALA 8 -3.650 -10.688 -12.930 833 HB3 ALA 8 3HB ALA 8 -2.774 -9.115 -12.990 834 H GLN 9 H GLN 9 -3.667 -9.081 -16.499 835 HA GLN 9 HA GLN 9 -2.613 -6.446 -16.351 836 HB2 GLN 9 2HB GLN 9 -1.618 -8.325 -17.695 837 HB3 GLN 9 1HB GLN 9 -2.998 -8.214 -18.839 838 HG2 GLN 9 2HG GLN 9 -2.301 -5.948 -19.548 839 HG3 GLN 9 1HG GLN 9 -1.095 -5.853 -18.207 840 HE21 GLN 9 1HE2 GLN 9 0.885 -5.834 -19.385 841 HE22 GLN 9 2HE2 GLN 9 1.414 -7.200 -20.317 842 H LYS 10 H LYS 10 -5.530 -7.889 -17.711 843 HA LYS 10 HA LYS 10 -6.522 -5.755 -19.192 844 HB2 LYS 10 2HB LYS 10 -7.270 -8.141 -19.252 845 HB3 LYS 10 1HB LYS 10 -7.849 -7.999 -17.560 846 HG2 LYS 10 2HG LYS 10 -9.634 -6.396 -18.338 847 HG3 LYS 10 1HG LYS 10 -9.074 -6.636 -20.037 848 HD2 LYS 10 2HD LYS 10 -9.446 -9.103 -19.819 849 HD3 LYS 10 1HD LYS 10 -9.869 -8.888 -18.084 850 HE2 LYS 10 2HE LYS 10 -11.918 -7.560 -18.747 851 HE3 LYS 10 1HE LYS 10 -11.541 -7.891 -20.490 852 HZ1 LYS 10 3HZ LYS 10 -11.684 -10.282 -19.973 853 HZ2 LYS 10 1HZ LYS 10 -13.117 -9.446 -19.572 854 HZ3 LYS 10 2HZ LYS 10 -11.983 -9.953 -18.362 855 H ALA 11 H ALA 11 -6.678 -6.523 -15.697 856 HA ALA 11 HA ALA 11 -8.665 -4.709 -15.006 857 HB1 ALA 11 1HB ALA 11 -7.820 -4.900 -12.675 858 HB2 ALA 11 2HB ALA 11 -6.287 -5.630 -13.277 859 HB3 ALA 11 3HB ALA 11 -7.843 -6.517 -13.464 860 H GLU 12 H GLU 12 -5.186 -4.233 -15.539 861 HA GLU 12 HA GLU 12 -4.980 -1.667 -14.400 862 HB2 GLU 12 2HB GLU 12 -3.317 -3.495 -15.967 863 HB3 GLU 12 1HB GLU 12 -3.123 -1.857 -16.630 864 HG2 GLU 12 2HG GLU 12 -2.924 -2.255 -13.593 865 HG3 GLU 12 1HG GLU 12 -1.575 -2.809 -14.647 866 H GLU 13 H GLU 13 -6.228 -2.790 -17.539 867 HA GLU 13 HA GLU 13 -6.062 -0.222 -18.772 868 HB2 GLU 13 2HB GLU 13 -6.220 -2.462 -20.048 869 HB3 GLU 13 1HB GLU 13 -7.949 -2.508 -19.580 870 HG2 GLU 13 2HG GLU 13 -8.259 -0.264 -20.782 871 HG3 GLU 13 1HG GLU 13 -6.534 -0.350 -21.302 872 H GLU 14 H GLU 14 -8.440 -2.008 -16.840 873 HA GLU 14 HA GLU 14 -10.621 -0.292 -17.303 874 HB2 GLU 14 2HB GLU 14 -10.867 -2.626 -16.458 875 HB3 GLU 14 1HB GLU 14 -10.033 -2.152 -14.938 876 HG2 GLU 14 2HG GLU 14 -12.367 -2.331 -14.460 877 HG3 GLU 14 1HG GLU 14 -11.964 -0.583 -14.413 878 H LEU 15 H LEU 15 -7.939 -0.276 -14.950 879 HA LEU 15 HA LEU 15 -8.942 1.690 -13.288 880 HB2 LEU 15 2HB LEU 15 -6.913 0.286 -12.807 881 HB3 LEU 15 1HB LEU 15 -5.985 1.217 -14.015 882 HG LEU 15 HG LEU 15 -6.135 3.252 -12.656 883 HD11 LEU 15 1HD1 LEU 15 -8.402 3.140 -11.710 884 HD12 LEU 15 2HD1 LEU 15 -7.234 3.234 -10.360 885 HD13 LEU 15 3HD1 LEU 15 -7.991 1.654 -10.772 886 HD21 LEU 15 3HD2 LEU 15 -4.838 2.507 -10.657 887 HD22 LEU 15 1HD2 LEU 15 -4.346 1.576 -12.118 888 HD23 LEU 15 2HD2 LEU 15 -5.414 0.821 -10.885 889 H GLN 16 H GLN 16 -7.088 2.002 -16.326 890 HA GLN 16 HA GLN 16 -6.668 4.760 -16.251 891 HB2 GLN 16 2HB GLN 16 -7.201 3.068 -18.773 892 HB3 GLN 16 1HB GLN 16 -6.463 4.705 -18.717 893 HG2 GLN 16 2HG GLN 16 -4.521 3.701 -17.367 894 HG3 GLN 16 1HG GLN 16 -5.255 2.074 -17.624 895 HE21 GLN 16 1HE2 GLN 16 -3.645 1.193 -19.099 896 HE22 GLN 16 2HE2 GLN 16 -3.241 1.932 -20.600 897 H LYS 17 H LYS 17 -9.492 2.862 -17.183 898 HA LYS 17 HA LYS 17 -10.818 4.919 -18.599 899 HB2 LYS 17 2HB LYS 17 -11.132 2.341 -18.733 900 HB3 LYS 17 1HB LYS 17 -12.039 2.470 -17.200 901 HG2 LYS 17 2HG LYS 17 -13.655 4.090 -18.448 902 HG3 LYS 17 1HG LYS 17 -12.729 3.709 -19.943 903 HD2 LYS 17 2HD LYS 17 -14.586 2.207 -20.006 904 HD3 LYS 17 1HD LYS 17 -13.208 1.210 -19.405 905 HE2 LYS 17 2HE LYS 17 -14.119 1.858 -16.974 906 HE3 LYS 17 1HE LYS 17 -15.613 2.375 -17.847 907 HZ1 LYS 17 3HZ LYS 17 -14.324 -0.311 -17.802 908 HZ2 LYS 17 1HZ LYS 17 -15.742 0.072 -18.739 909 HZ3 LYS 17 2HZ LYS 17 -15.722 0.145 -17.028 910 H VAL 18 H VAL 18 -10.744 3.818 -15.215 911 HA VAL 18 HA VAL 18 -12.948 5.329 -14.315 912 HB VAL 18 HB VAL 18 -10.533 4.241 -12.771 913 HG11 VAL 18 1HG1 VAL 18 -11.639 6.054 -11.453 914 HG12 VAL 18 2HG1 VAL 18 -12.054 4.454 -10.758 915 HG13 VAL 18 3HG1 VAL 18 -13.259 5.330 -11.771 916 HG21 VAL 18 3HG2 VAL 18 -11.888 2.460 -13.938 917 HG22 VAL 18 1HG2 VAL 18 -13.395 3.126 -13.227 918 HG23 VAL 18 2HG2 VAL 18 -12.136 2.394 -12.166 919 H LEU 19 H LEU 19 -9.421 5.959 -14.565 920 HA LEU 19 HA LEU 19 -9.313 8.392 -13.263 921 HB2 LEU 19 2HB LEU 19 -7.790 7.762 -15.872 922 HB3 LEU 19 1HB LEU 19 -7.338 8.947 -14.621 923 HG LEU 19 HG LEU 19 -7.312 5.889 -14.434 924 HD11 LEU 19 1HD1 LEU 19 -5.455 6.879 -15.744 925 HD12 LEU 19 2HD1 LEU 19 -4.854 6.145 -14.208 926 HD13 LEU 19 3HD1 LEU 19 -5.019 7.936 -14.352 927 HD21 LEU 19 3HD2 LEU 19 -7.976 6.702 -12.196 928 HD22 LEU 19 1HD2 LEU 19 -6.591 7.865 -12.182 929 HD23 LEU 19 2HD2 LEU 19 -6.291 6.086 -12.196 930 H GLU 20 H GLU 20 -10.081 7.679 -16.683 931 HA GLU 20 HA GLU 20 -10.238 10.339 -17.538 932 HB2 GLU 20 2HB GLU 20 -11.534 7.780 -18.632 933 HB3 GLU 20 1HB GLU 20 -11.548 9.350 -19.510 934 HG2 GLU 20 2HG GLU 20 -8.858 8.129 -18.652 935 HG3 GLU 20 1HG GLU 20 -9.734 7.474 -20.076 936 H GLU 21 H GLU 21 -12.680 8.211 -15.980 937 HA GLU 21 HA GLU 21 -14.719 10.200 -16.626 938 HB2 GLU 21 2HB GLU 21 -15.029 7.500 -16.234 939 HB3 GLU 21 1HB GLU 21 -15.487 8.142 -14.623 940 HG2 GLU 21 2HG GLU 21 -16.948 9.879 -15.946 941 HG3 GLU 21 1HG GLU 21 -16.640 8.880 -17.411 942 H ALA 22 H ALA 22 -12.628 9.190 -13.953 943 HA ALA 22 HA ALA 22 -13.818 10.708 -11.943 944 HB1 ALA 22 1HB ALA 22 -12.160 8.889 -11.455 945 HB2 ALA 22 2HB ALA 22 -11.664 10.453 -10.715 946 HB3 ALA 22 3HB ALA 22 -10.865 9.877 -12.227 947 H SER 23 H SER 23 -11.430 11.599 -14.491 948 HA SER 23 HA SER 23 -10.602 13.979 -13.298 949 HB2 SER 23 2HB SER 23 -9.846 14.618 -15.624 950 HB3 SER 23 1HB SER 23 -9.354 12.950 -15.158 951 HG SER 23 1HG SER 23 -10.180 12.720 -17.137 952 H LYS 24 H LYS 24 -13.244 13.165 -15.457 953 HA LYS 24 HA LYS 24 -14.239 15.716 -15.948 954 HB2 LYS 24 2HB LYS 24 -14.761 13.517 -17.170 955 HB3 LYS 24 1HB LYS 24 -15.861 13.079 -15.836 956 HG2 LYS 24 2HG LYS 24 -16.167 15.541 -17.685 957 HG3 LYS 24 1HG LYS 24 -16.904 13.954 -17.976 958 HD2 LYS 24 2HD LYS 24 -18.676 14.319 -16.680 959 HD3 LYS 24 1HD LYS 24 -17.675 14.748 -15.276 960 HE2 LYS 24 2HE LYS 24 -18.823 16.631 -17.432 961 HE3 LYS 24 1HE LYS 24 -19.092 16.652 -15.644 962 HZ1 LYS 24 3HZ LYS 24 -16.619 17.110 -15.498 963 HZ2 LYS 24 1HZ LYS 24 -17.577 18.382 -16.093 964 HZ3 LYS 24 2HZ LYS 24 -16.699 17.442 -17.185 965 H LYS 25 H LYS 25 -14.822 13.348 -13.378 966 HA LYS 25 HA LYS 25 -16.880 14.809 -12.065 967 HB2 LYS 25 2HB LYS 25 -15.145 12.419 -11.323 968 HB3 LYS 25 1HB LYS 25 -15.979 13.331 -10.029 969 HG2 LYS 25 2HG LYS 25 -17.356 11.487 -10.553 970 HG3 LYS 25 1HG LYS 25 -18.166 13.010 -11.019 971 HD2 LYS 25 2HD LYS 25 -17.671 12.505 -13.449 972 HD3 LYS 25 1HD LYS 25 -16.902 10.951 -12.947 973 HE2 LYS 25 2HE LYS 25 -19.039 10.200 -11.872 974 HE3 LYS 25 1HE LYS 25 -19.793 11.789 -12.263 975 HZ1 LYS 25 3HZ LYS 25 -19.052 9.668 -14.261 976 HZ2 LYS 25 1HZ LYS 25 -19.753 11.193 -14.613 977 HZ3 LYS 25 2HZ LYS 25 -20.554 10.110 -13.629 978 H ALA 26 H ALA 26 -13.353 14.358 -11.310 979 HA ALA 26 HA ALA 26 -13.200 15.953 -9.142 980 HB1 ALA 26 1HB ALA 26 -11.305 14.549 -9.971 981 HB2 ALA 26 2HB ALA 26 -10.773 16.237 -9.652 982 HB3 ALA 26 3HB ALA 26 -11.060 15.686 -11.350 983 H VAL 27 H VAL 27 -12.788 17.120 -12.575 984 HA VAL 27 HA VAL 27 -12.224 19.731 -11.677 985 HB VAL 27 HB VAL 27 -11.574 18.875 -13.895 986 HG11 VAL 27 1HG1 VAL 27 -13.718 17.726 -14.530 987 HG12 VAL 27 2HG1 VAL 27 -13.159 18.889 -15.786 988 HG13 VAL 27 3HG1 VAL 27 -14.522 19.333 -14.711 989 HG21 VAL 27 3HG2 VAL 27 -11.497 21.290 -13.332 990 HG22 VAL 27 1HG2 VAL 27 -13.202 21.504 -13.889 991 HG23 VAL 27 2HG2 VAL 27 -11.924 21.048 -15.067 992 H GLU 28 H GLU 28 -15.326 18.111 -12.401 993 HA GLU 28 HA GLU 28 -16.691 20.664 -12.410 994 HB2 GLU 28 2HB GLU 28 -17.201 18.285 -13.698 995 HB3 GLU 28 1HB GLU 28 -18.302 18.116 -12.309 996 HG2 GLU 28 2HG GLU 28 -19.583 19.160 -14.108 997 HG3 GLU 28 1HG GLU 28 -19.223 20.472 -12.928 998 H ALA 29 H ALA 29 -15.924 18.077 -10.222 999 HA ALA 29 HA ALA 29 -17.802 18.676 -8.185 1000 HB1 ALA 29 1HB ALA 29 -15.107 17.158 -8.145 1001 HB2 ALA 29 2HB ALA 29 -16.709 16.410 -8.469 1002 HB3 ALA 29 3HB ALA 29 -16.343 17.097 -6.866 1003 H GLU 30 H GLU 30 -14.235 19.299 -8.650 1004 HA GLU 30 HA GLU 30 -13.945 20.897 -6.402 1005 HB2 GLU 30 2HB GLU 30 -12.391 20.588 -8.991 1006 HB3 GLU 30 1HB GLU 30 -11.950 21.923 -7.895 1007 HG2 GLU 30 2HG GLU 30 -12.188 19.117 -6.689 1008 HG3 GLU 30 1HG GLU 30 -10.753 19.552 -7.667 1009 H ARG 31 H ARG 31 -15.085 21.787 -9.691 1010 HA ARG 31 HA ARG 31 -14.842 24.564 -9.154 1011 HB2 ARG 31 2HB ARG 31 -16.514 22.999 -11.183 1012 HB3 ARG 31 1HB ARG 31 -16.742 24.763 -10.996 1013 HG2 ARG 31 2HG ARG 31 -14.120 23.408 -11.853 1014 HG3 ARG 31 1HG ARG 31 -15.302 24.298 -12.867 1015 HD2 ARG 31 2HD ARG 31 -14.840 26.279 -11.056 1016 HD3 ARG 31 1HD ARG 31 -13.299 25.352 -10.801 1017 HE ARG 31 HE ARG 31 -13.991 25.967 -13.635 1018 HH11 ARG 31 1HH2 ARG 31 -12.569 27.373 -10.605 1019 HH12 ARG 31 2HH2 ARG 31 -12.159 28.832 -11.389 1020 HH21 ARG 31 1HH1 ARG 31 -12.962 27.786 -14.712 1021 HH22 ARG 31 2HH1 ARG 31 -11.896 28.812 -13.857 1022 H GLY 32 H GLY 32 -15.771 25.504 -7.449 1023 HA2 GLY 32 2HA GLY 32 -17.831 26.612 -6.878 1024 HA3 GLY 32 1HA GLY 32 -18.645 25.000 -6.981 1025 H ALA 33 H ALA 33 -15.691 24.113 -5.909 1026 HA ALA 33 HA ALA 33 -16.683 23.958 -3.229 1027 HB1 ALA 33 1HB ALA 33 -15.653 21.927 -4.310 1028 HB2 ALA 33 2HB ALA 33 -14.719 22.429 -2.849 1029 HB3 ALA 33 3HB ALA 33 -14.106 22.818 -4.488 1030 HA PRO 34 HA PRO 34 -13.769 27.162 -2.008 1031 HB2 PRO 34 2HB PRO 34 -13.737 26.862 0.755 1032 HB3 PRO 34 1HB PRO 34 -15.175 27.503 -0.127 1033 HG2 PRO 34 2HG PRO 34 -14.687 24.645 0.859 1034 HG3 PRO 34 1HG PRO 34 -16.196 25.637 1.026 1035 HD2 PRO 34 2HD PRO 34 -15.750 23.727 -0.991 1036 HD3 PRO 34 1HD PRO 34 -16.812 25.187 -1.251 1037 H GLY 35 H GLY 35 -11.499 27.273 -1.796 1038 HA2 GLY 35 2HA GLY 35 -9.424 26.595 -1.343 1039 HA3 GLY 35 1HA GLY 35 -10.086 25.183 -0.439 1040 H ALA 36 H ALA 36 -11.361 25.482 -3.594 1041 HA ALA 36 HA ALA 36 -10.417 23.085 -4.491 1042 HB1 ALA 36 1HB ALA 36 -11.378 25.479 -6.185 1043 HB2 ALA 36 2HB ALA 36 -12.418 24.167 -5.495 1044 HB3 ALA 36 3HB ALA 36 -11.210 23.769 -6.758 1045 H ALA 37 H ALA 37 -8.401 22.574 -4.799 1046 HA ALA 37 HA ALA 37 -6.403 24.613 -5.460 1047 HB1 ALA 37 1HB ALA 37 -6.127 21.625 -4.706 1048 HB2 ALA 37 2HB ALA 37 -5.858 23.010 -3.595 1049 HB3 ALA 37 3HB ALA 37 -4.742 22.757 -4.985 1050 H LEU 38 H LEU 38 -8.283 21.889 -6.742 1051 HA LEU 38 HA LEU 38 -6.592 21.761 -9.132 1052 HB2 LEU 38 2HB LEU 38 -7.162 19.592 -8.128 1053 HB3 LEU 38 1HB LEU 38 -8.884 20.009 -8.112 1054 HG LEU 38 HG LEU 38 -7.393 19.959 -10.787 1055 HD11 LEU 38 1HD1 LEU 38 -6.705 17.864 -9.609 1056 HD12 LEU 38 2HD1 LEU 38 -7.801 17.502 -10.994 1057 HD13 LEU 38 3HD1 LEU 38 -8.430 17.464 -9.306 1058 HD21 LEU 38 3HD2 LEU 38 -9.591 19.090 -11.651 1059 HD22 LEU 38 1HD2 LEU 38 -9.831 20.654 -10.805 1060 HD23 LEU 38 2HD2 LEU 38 -10.268 19.122 -9.982 1061 H ILE 39 H ILE 39 -7.314 22.626 -11.058 1062 HA ILE 39 HA ILE 39 -10.029 23.317 -11.370 1063 HB ILE 39 HB ILE 39 -9.358 25.640 -12.264 1064 HG12 ILE 39 2HG1 ILE 39 -6.869 25.200 -10.471 1065 HG13 ILE 39 1HG1 ILE 39 -6.849 25.239 -12.266 1066 HG21 ILE 39 1HG2 ILE 39 -10.635 25.202 -10.106 1067 HG22 ILE 39 2HG2 ILE 39 -9.698 26.740 -10.122 1068 HG23 ILE 39 3HG2 ILE 39 -9.081 25.314 -9.210 1069 HD11 ILE 39 3HD ILE 39 -7.578 27.572 -10.378 1070 HD12 ILE 39 1HD ILE 39 -6.126 27.413 -11.421 1071 HD13 ILE 39 2HD ILE 39 -7.747 27.628 -12.178 1072 H SER 40 H SER 40 -10.097 23.989 -13.777 1073 HA SER 40 HA SER 40 -9.457 24.028 -15.850 1074 HB2 SER 40 2HB SER 40 -7.140 24.763 -15.038 1075 HB3 SER 40 1HB SER 40 -6.652 23.045 -15.105 1076 HG SER 40 1HG SER 40 -6.039 23.674 -16.951 1077 H TYR 41 H TYR 41 -10.197 22.546 -17.315 1078 HA TYR 41 HA TYR 41 -10.493 19.834 -16.553 1079 HB2 TYR 41 2HB TYR 41 -12.239 20.889 -17.914 1080 HB3 TYR 41 1HB TYR 41 -11.056 21.291 -19.202 1081 HD1 TYR 41 1HD TYR 41 -11.819 18.045 -17.303 1082 HD2 TYR 41 2HD TYR 41 -11.551 20.078 -21.090 1083 HE1 TYR 41 1HE TYR 41 -12.404 15.961 -18.467 1084 HE2 TYR 41 2HE TYR 41 -12.127 17.993 -22.252 1085 HH TYR 41 HH TYR 41 -12.405 15.699 -22.036 1086 HA PRO 42 HA PRO 42 -7.305 18.706 -19.713 1087 HB2 PRO 42 2HB PRO 42 -5.366 20.492 -20.722 1088 HB3 PRO 42 1HB PRO 42 -6.980 20.233 -21.481 1089 HG2 PRO 42 2HG PRO 42 -6.171 22.425 -19.487 1090 HG3 PRO 42 1HG PRO 42 -7.036 22.622 -21.068 1091 HD2 PRO 42 2HD PRO 42 -8.395 22.525 -18.700 1092 HD3 PRO 42 1HD PRO 42 -9.072 21.662 -20.157 1093 H ASP 43 H ASP 43 -6.684 20.533 -16.912 1094 HA ASP 43 HA ASP 43 -4.041 19.252 -16.595 1095 HB2 ASP 43 2HB ASP 43 -5.238 21.543 -14.946 1096 HB3 ASP 43 1HB ASP 43 -3.577 20.857 -14.820 1097 H ALA 44 H ALA 44 -7.393 19.035 -15.817 1098 HA ALA 44 HA ALA 44 -7.181 18.119 -13.161 1099 HB1 ALA 44 1HB ALA 44 -9.378 18.879 -14.073 1100 HB2 ALA 44 2HB ALA 44 -9.494 17.179 -13.508 1101 HB3 ALA 44 3HB ALA 44 -9.364 17.534 -15.272 1102 H ILE 45 H ILE 45 -7.208 16.617 -16.350 1103 HA ILE 45 HA ILE 45 -7.233 13.956 -15.623 1104 HB ILE 45 HB ILE 45 -7.770 14.734 -17.834 1105 HG12 ILE 45 2HG1 ILE 45 -5.323 12.857 -17.872 1106 HG13 ILE 45 1HG1 ILE 45 -7.031 12.399 -17.570 1107 HG21 ILE 45 1HG2 ILE 45 -4.794 15.509 -18.159 1108 HG22 ILE 45 2HG2 ILE 45 -6.160 16.664 -17.950 1109 HG23 ILE 45 3HG2 ILE 45 -6.084 15.634 -19.401 1110 HD11 ILE 45 3HD ILE 45 -5.868 13.547 -20.199 1111 HD12 ILE 45 1HD ILE 45 -6.505 11.889 -19.895 1112 HD13 ILE 45 2HD ILE 45 -7.627 13.290 -19.878 1113 H TRP 46 H TRP 46 -4.664 16.315 -15.418 1114 HA TRP 46 HA TRP 46 -2.533 14.433 -15.535 1115 HB2 TRP 46 2HB TRP 46 -2.126 16.857 -16.076 1116 HB3 TRP 46 1HB TRP 46 -2.588 17.299 -14.401 1117 HD1 TRP 46 HD TRP 46 0.460 15.825 -16.340 1118 HE1 TRP 46 1HE TRP 46 2.462 15.782 -14.695 1119 HE3 TRP 46 3HE TRP 46 -1.952 17.221 -12.058 1120 HZ2 TRP 46 2HZ TRP 46 2.925 16.110 -11.931 1121 HZ3 TRP 46 3HZ TRP 46 -0.688 17.284 -9.934 1122 HH2 TRP 46 HH TRP 46 1.719 16.742 -9.879 1123 H TRP 47 H TRP 47 -4.616 15.802 -12.998 1124 HA TRP 47 HA TRP 47 -2.860 14.866 -10.907 1125 HB2 TRP 47 2HB TRP 47 -4.227 16.938 -10.567 1126 HB3 TRP 47 1HB TRP 47 -5.729 15.967 -10.761 1127 HD1 TRP 47 HD TRP 47 -2.510 15.677 -8.434 1128 HE1 TRP 47 1HE TRP 47 -3.234 14.698 -6.256 1129 HE3 TRP 47 3HE TRP 47 -7.491 15.224 -9.447 1130 HZ2 TRP 47 2HZ TRP 47 -5.795 14.269 -4.849 1131 HZ3 TRP 47 3HZ TRP 47 -9.029 14.497 -7.655 1132 HH2 TRP 47 HH TRP 47 -8.185 14.020 -5.388 1133 H SER 48 H SER 48 -5.859 13.795 -12.615 1134 HA SER 48 HA SER 48 -6.397 11.808 -10.663 1135 HB2 SER 48 2HB SER 48 -8.111 11.025 -12.409 1136 HB3 SER 48 1HB SER 48 -8.277 12.724 -11.836 1137 HG SER 48 1HG SER 48 -7.001 11.819 -14.191 1138 H VAL 49 H VAL 49 -3.894 11.267 -11.039 1139 HA VAL 49 HA VAL 49 -4.012 8.664 -12.308 1140 HB VAL 49 HB VAL 49 -1.505 10.353 -12.681 1141 HG11 VAL 49 1HG1 VAL 49 -1.087 8.485 -14.382 1142 HG12 VAL 49 2HG1 VAL 49 -2.592 7.681 -13.830 1143 HG13 VAL 49 3HG1 VAL 49 -1.206 7.876 -12.695 1144 HG21 VAL 49 3HG2 VAL 49 -2.206 10.537 -15.115 1145 HG22 VAL 49 1HG2 VAL 49 -3.239 11.505 -14.012 1146 HG23 VAL 49 2HG2 VAL 49 -3.839 9.936 -14.664 1147 H GLU 50 H GLU 50 -2.037 11.017 -10.257 1148 HA GLU 50 HA GLU 50 -0.697 8.941 -8.965 1149 HB2 GLU 50 2HB GLU 50 -0.062 10.558 -7.204 1150 HB3 GLU 50 1HB GLU 50 0.312 11.165 -8.833 1151 HG2 GLU 50 2HG GLU 50 -1.192 12.948 -8.712 1152 HG3 GLU 50 1HG GLU 50 -2.357 12.049 -7.691 1153 H THR 51 H THR 51 -3.841 10.336 -8.398 1154 HA THR 51 HA THR 51 -4.145 9.551 -5.751 1155 HB THR 51 HB THR 51 -5.434 11.343 -6.779 1156 HG1 THR 51 1HG THR 51 -6.438 10.434 -5.086 1157 HG21 THR 51 3HG2 THR 51 -5.673 10.381 -9.091 1158 HG22 THR 51 1HG2 THR 51 -7.254 10.888 -8.402 1159 HG23 THR 51 2HG2 THR 51 -6.821 9.143 -8.454 1160 H ALA 52 H ALA 52 -4.497 7.737 -8.809 1161 HA ALA 52 HA ALA 52 -6.107 5.675 -7.657 1162 HB1 ALA 52 1HB ALA 52 -6.111 6.039 -10.107 1163 HB2 ALA 52 2HB ALA 52 -5.516 4.386 -9.730 1164 HB3 ALA 52 3HB ALA 52 -4.341 5.677 -10.188 1165 H THR 53 H THR 53 -2.647 6.408 -7.768 1166 HA THR 53 HA THR 53 -1.972 3.724 -6.885 1167 HB THR 53 HB THR 53 0.399 4.884 -6.922 1168 HG1 THR 53 1HG THR 53 -0.568 7.006 -7.212 1169 HG21 THR 53 3HG2 THR 53 -0.415 3.135 -8.515 1170 HG22 THR 53 1HG2 THR 53 0.521 4.409 -9.377 1171 HG23 THR 53 2HG2 THR 53 -1.283 4.389 -9.479 1172 H THR 54 H THR 54 -3.496 6.057 -5.291 1173 HA THR 54 HA THR 54 -3.559 6.795 -3.230 1174 HB THR 54 HB THR 54 -3.254 4.957 -1.472 1175 HG1 THR 54 1HG THR 54 -1.687 3.808 -2.812 1176 HG21 THR 54 3HG2 THR 54 -5.230 3.729 -2.374 1177 HG22 THR 54 1HG2 THR 54 -4.926 4.377 -4.026 1178 HG23 THR 54 2HG2 THR 54 -5.387 5.496 -2.685 1179 H VAL 55 H VAL 55 -1.495 8.162 -4.011 1180 HA VAL 55 HA VAL 55 0.391 7.914 -1.768 1181 HB VAL 55 HB VAL 55 2.027 9.128 -3.402 1182 HG11 VAL 55 1HG1 VAL 55 3.003 6.874 -3.895 1183 HG12 VAL 55 2HG1 VAL 55 1.406 6.099 -3.586 1184 HG13 VAL 55 3HG1 VAL 55 2.292 6.905 -2.248 1185 HG21 VAL 55 3HG2 VAL 55 1.851 8.312 -5.780 1186 HG22 VAL 55 1HG2 VAL 55 0.369 9.252 -5.397 1187 HG23 VAL 55 2HG2 VAL 55 0.330 7.450 -5.407 1188 H GLY 56 H GLY 56 0.024 10.528 -4.241 1189 HA2 GLY 56 2HA GLY 56 -1.103 12.463 -3.955 1190 HA3 GLY 56 1HA GLY 56 -1.572 11.989 -2.277 1191 H TYR 57 H TYR 57 1.177 12.920 -4.372 1192 HA TYR 57 HA TYR 57 2.973 13.128 -2.133 1193 HB2 TYR 57 2HB TYR 57 3.111 14.128 -5.057 1194 HB3 TYR 57 1HB TYR 57 4.383 14.594 -3.868 1195 HD1 TYR 57 1HD TYR 57 2.619 11.518 -5.181 1196 HD2 TYR 57 2HD TYR 57 6.225 13.246 -3.588 1197 HE1 TYR 57 1HE TYR 57 3.796 9.421 -5.578 1198 HE2 TYR 57 2HE TYR 57 7.429 11.146 -4.011 1199 HH TYR 57 HH TYR 57 5.704 8.221 -5.045 1200 H GLY 58 H GLY 58 0.561 15.151 -3.396 1201 HA2 GLY 58 2HA GLY 58 -0.265 16.834 -2.061 1202 HA3 GLY 58 1HA GLY 58 1.399 17.293 -1.551 1203 H ASP 59 H ASP 59 0.204 16.646 -4.904 1204 HA ASP 59 HA ASP 59 0.985 19.399 -5.484 1205 HB2 ASP 59 2HB ASP 59 1.870 17.453 -6.944 1206 HB3 ASP 59 1HB ASP 59 0.247 17.483 -7.720 1207 H ARG 60 H ARG 60 -2.020 17.375 -5.218 1208 HA ARG 60 HA ARG 60 -3.377 19.899 -5.180 1209 HB2 ARG 60 2HB ARG 60 -4.699 17.528 -6.640 1210 HB3 ARG 60 1HB ARG 60 -5.422 19.131 -6.350 1211 HG2 ARG 60 2HG ARG 60 -3.053 18.568 -8.214 1212 HG3 ARG 60 1HG ARG 60 -4.774 18.621 -8.712 1213 HD2 ARG 60 2HD ARG 60 -4.969 21.013 -8.050 1214 HD3 ARG 60 1HD ARG 60 -3.269 21.054 -7.501 1215 HE ARG 60 HE ARG 60 -4.229 21.171 -10.267 1216 HH11 ARG 60 1HH2 ARG 60 -1.479 20.380 -8.107 1217 HH12 ARG 60 2HH2 ARG 60 -0.336 20.087 -9.320 1218 HH21 ARG 60 1HH1 ARG 60 -2.542 20.984 -12.059 1219 HH22 ARG 60 2HH1 ARG 60 -0.936 20.550 -11.614 1220 H TYR 61 H TYR 61 -5.808 19.169 -4.230 1221 HA TYR 61 HA TYR 61 -5.792 16.710 -2.933 1222 HB2 TYR 61 2HB TYR 61 -6.451 17.869 -0.642 1223 HB3 TYR 61 1HB TYR 61 -4.708 17.664 -1.012 1224 HD1 TYR 61 1HD TYR 61 -7.505 20.197 -1.015 1225 HD2 TYR 61 2HD TYR 61 -3.269 19.516 -1.245 1226 HE1 TYR 61 1HE TYR 61 -7.112 22.609 -0.732 1227 HE2 TYR 61 2HE TYR 61 -2.858 21.924 -0.945 1228 HH TYR 61 HH TYR 61 -3.758 23.955 -0.707 1229 HA PRO 62 HA PRO 62 -9.985 18.237 -3.874 1230 HB2 PRO 62 2HB PRO 62 -11.527 16.179 -2.804 1231 HB3 PRO 62 1HB PRO 62 -10.399 15.854 -4.163 1232 HG2 PRO 62 2HG PRO 62 -9.846 15.473 -1.153 1233 HG3 PRO 62 1HG PRO 62 -9.652 14.243 -2.465 1234 HD2 PRO 62 2HD PRO 62 -7.577 15.840 -1.523 1235 HD3 PRO 62 1HD PRO 62 -7.670 15.340 -3.276 1236 H VAL 63 H VAL 63 -12.248 18.463 -2.453 1237 HA VAL 63 HA VAL 63 -11.546 19.106 0.307 1238 HB VAL 63 HB VAL 63 -13.391 21.039 -1.123 1239 HG11 VAL 63 1HG1 VAL 63 -11.194 21.370 1.038 1240 HG12 VAL 63 2HG1 VAL 63 -12.894 21.022 1.481 1241 HG13 VAL 63 3HG1 VAL 63 -12.493 22.550 0.630 1242 HG21 VAL 63 3HG2 VAL 63 -11.439 22.480 -1.720 1243 HG22 VAL 63 1HG2 VAL 63 -11.451 20.973 -2.662 1244 HG23 VAL 63 2HG2 VAL 63 -10.308 21.150 -1.287 1245 H THR 64 H THR 64 -14.265 20.219 0.768 1246 HA THR 64 HA THR 64 -15.486 17.745 1.332 1247 HB THR 64 HB THR 64 -16.738 20.420 2.042 1248 HG1 THR 64 1HG THR 64 -15.240 20.538 3.756 1249 HG21 THR 64 3HG2 THR 64 -16.174 17.813 3.633 1250 HG22 THR 64 1HG2 THR 64 -17.725 18.187 2.801 1251 HG23 THR 64 2HG2 THR 64 -17.177 19.204 4.177 1252 H GLU 65 H GLU 65 -16.341 20.671 -0.472 1253 HA GLU 65 HA GLU 65 -19.005 19.981 -0.929 1254 HB2 GLU 65 2HB GLU 65 -17.398 22.277 -1.222 1255 HB3 GLU 65 1HB GLU 65 -17.711 21.833 -2.920 1256 HG2 GLU 65 2HG GLU 65 -19.438 23.307 -2.488 1257 HG3 GLU 65 1HG GLU 65 -20.272 21.744 -2.173 1258 H GLU 66 H GLU 66 -15.980 19.363 -2.645 1259 HA GLU 66 HA GLU 66 -17.058 18.749 -5.124 1260 HB2 GLU 66 2HB GLU 66 -14.894 18.215 -5.797 1261 HB3 GLU 66 1HB GLU 66 -14.640 19.381 -4.507 1262 HG2 GLU 66 2HG GLU 66 -13.002 17.894 -4.030 1263 HG3 GLU 66 1HG GLU 66 -14.269 17.119 -3.001 1264 H GLY 67 H GLY 67 -16.823 17.084 -2.151 1265 HA2 GLY 67 2HA GLY 67 -18.141 15.384 -1.456 1266 HA3 GLY 67 1HA GLY 67 -18.550 14.996 -3.189 1267 H ARG 68 H ARG 68 -15.722 15.288 -1.042 1268 HA ARG 68 HA ARG 68 -13.728 14.258 -2.210 1269 HB2 ARG 68 2HB ARG 68 -13.981 15.069 0.165 1270 HB3 ARG 68 1HB ARG 68 -14.266 13.363 0.625 1271 HG2 ARG 68 2HG ARG 68 -11.906 13.018 -0.690 1272 HG3 ARG 68 1HG ARG 68 -11.789 14.788 -0.527 1273 HD2 ARG 68 2HD ARG 68 -10.544 13.480 1.280 1274 HD3 ARG 68 1HD ARG 68 -11.769 14.601 1.948 1275 HE ARG 68 HE ARG 68 -12.962 12.792 2.771 1276 HH11 ARG 68 1HH2 ARG 68 -10.301 11.359 0.981 1277 HH12 ARG 68 2HH2 ARG 68 -11.082 9.891 0.581 1278 HH21 ARG 68 1HH1 ARG 68 -14.166 10.749 2.264 1279 HH22 ARG 68 2HH1 ARG 68 -13.491 9.505 1.390 1280 H LYS 69 H LYS 69 -16.409 12.289 -1.631 1281 HA LYS 69 HA LYS 69 -15.249 9.745 -1.813 1282 HB2 LYS 69 2HB LYS 69 -17.961 10.675 -2.872 1283 HB3 LYS 69 1HB LYS 69 -17.371 8.980 -2.772 1284 HG2 LYS 69 2HG LYS 69 -17.023 9.439 -0.209 1285 HG3 LYS 69 1HG LYS 69 -18.120 10.846 -0.469 1286 HD2 LYS 69 2HD LYS 69 -19.753 9.149 -1.599 1287 HD3 LYS 69 1HD LYS 69 -18.631 7.853 -1.072 1288 HE2 LYS 69 2HE LYS 69 -20.463 7.940 0.518 1289 HE3 LYS 69 1HE LYS 69 -19.001 8.578 1.362 1290 HZ1 LYS 69 3HZ LYS 69 -19.837 10.734 1.277 1291 HZ2 LYS 69 1HZ LYS 69 -21.188 9.789 1.576 1292 HZ3 LYS 69 2HZ LYS 69 -20.930 10.423 0.013 1293 H VAL 70 H VAL 70 -15.458 12.420 -4.184 1294 HA VAL 70 HA VAL 70 -15.322 10.790 -6.465 1295 HB VAL 70 HB VAL 70 -14.157 13.583 -6.061 1296 HG11 VAL 70 1HG1 VAL 70 -14.181 13.691 -8.556 1297 HG12 VAL 70 2HG1 VAL 70 -14.599 11.931 -8.641 1298 HG13 VAL 70 3HG1 VAL 70 -13.015 12.474 -7.962 1299 HG21 VAL 70 3HG2 VAL 70 -16.630 13.510 -5.744 1300 HG22 VAL 70 1HG2 VAL 70 -16.832 12.601 -7.290 1301 HG23 VAL 70 2HG2 VAL 70 -16.211 14.301 -7.283 1302 H ALA 71 H ALA 71 -12.727 12.323 -4.486 1303 HA ALA 71 HA ALA 71 -10.611 11.004 -5.761 1304 HB1 ALA 71 1HB ALA 71 -9.257 11.545 -3.723 1305 HB2 ALA 71 2HB ALA 71 -10.772 11.966 -2.834 1306 HB3 ALA 71 3HB ALA 71 -10.248 12.955 -4.245 1307 H GLU 72 H GLU 72 -12.504 10.129 -2.854 1308 HA GLU 72 HA GLU 72 -11.088 7.899 -2.060 1309 HB2 GLU 72 2HB GLU 72 -13.105 9.077 -0.895 1310 HB3 GLU 72 1HB GLU 72 -14.145 8.078 -1.965 1311 HG2 GLU 72 2HG GLU 72 -13.107 5.983 -0.943 1312 HG3 GLU 72 1HG GLU 72 -12.221 7.040 0.219 1313 H GLN 73 H GLN 73 -13.630 8.176 -4.531 1314 HA GLN 73 HA GLN 73 -13.957 5.433 -4.958 1315 HB2 GLN 73 2HB GLN 73 -15.585 7.180 -5.562 1316 HB3 GLN 73 1HB GLN 73 -14.474 7.837 -6.810 1317 HG2 GLN 73 2HG GLN 73 -14.827 5.914 -8.262 1318 HG3 GLN 73 1HG GLN 73 -15.444 4.914 -6.896 1319 HE21 GLN 73 1HE2 GLN 73 -16.263 8.216 -8.293 1320 HE22 GLN 73 2HE2 GLN 73 -17.976 7.964 -8.255 1321 H VAL 74 H VAL 74 -11.636 7.828 -6.359 1322 HA VAL 74 HA VAL 74 -10.801 5.992 -8.379 1323 HB VAL 74 HB VAL 74 -8.956 8.203 -7.388 1324 HG11 VAL 74 1HG1 VAL 74 -8.391 8.227 -9.844 1325 HG12 VAL 74 2HG1 VAL 74 -9.636 6.964 -10.158 1326 HG13 VAL 74 3HG1 VAL 74 -8.190 6.575 -9.157 1327 HG21 VAL 74 3HG2 VAL 74 -11.557 8.563 -9.013 1328 HG22 VAL 74 1HG2 VAL 74 -10.177 9.731 -9.032 1329 HG23 VAL 74 2HG2 VAL 74 -11.028 9.401 -7.499 1330 H MET 75 H MET 75 -9.674 6.954 -5.136 1331 HA MET 75 HA MET 75 -7.346 5.431 -5.089 1332 HB2 MET 75 2HB MET 75 -9.189 6.336 -2.795 1333 HB3 MET 75 1HB MET 75 -7.558 5.614 -2.564 1334 HG2 MET 75 2HG MET 75 -6.615 7.401 -4.072 1335 HG3 MET 75 1HG MET 75 -8.175 8.231 -4.102 1336 HE1 MET 75 3HE MET 75 -9.279 9.373 -1.908 1337 HE2 MET 75 1HE MET 75 -8.457 9.491 -0.317 1338 HE3 MET 75 2HE MET 75 -9.079 7.900 -0.881 1339 H LYS 76 H LYS 76 -10.688 4.561 -3.957 1340 HA LYS 76 HA LYS 76 -9.881 1.985 -3.171 1341 HB2 LYS 76 2HB LYS 76 -12.068 3.109 -2.442 1342 HB3 LYS 76 1HB LYS 76 -12.733 2.676 -4.053 1343 HG2 LYS 76 2HG LYS 76 -12.142 0.229 -3.545 1344 HG3 LYS 76 1HG LYS 76 -11.633 0.724 -1.904 1345 HD2 LYS 76 2HD LYS 76 -14.484 0.981 -3.086 1346 HD3 LYS 76 1HD LYS 76 -13.872 -0.378 -2.082 1347 HE2 LYS 76 2HE LYS 76 -13.423 1.281 -0.176 1348 HE3 LYS 76 1HE LYS 76 -14.266 2.544 -1.162 1349 HZ1 LYS 76 3HZ LYS 76 -15.915 1.739 0.130 1350 HZ2 LYS 76 1HZ LYS 76 -15.325 0.119 0.164 1351 HZ3 LYS 76 2HZ LYS 76 -16.135 0.702 -1.211 1352 H ALA 77 H ALA 77 -11.072 3.248 -6.327 1353 HA ALA 77 HA ALA 77 -11.439 0.732 -7.517 1354 HB1 ALA 77 1HB ALA 77 -10.613 3.387 -8.859 1355 HB2 ALA 77 2HB ALA 77 -12.307 2.846 -8.567 1356 HB3 ALA 77 3HB ALA 77 -11.259 1.931 -9.710 1357 H GLY 78 H GLY 78 -8.561 2.841 -7.202 1358 HA2 GLY 78 2HA GLY 78 -6.858 1.336 -8.860 1359 HA3 GLY 78 1HA GLY 78 -6.409 2.459 -7.518 1360 H ILE 79 H ILE 79 -7.446 1.250 -5.322 1361 HA ILE 79 HA ILE 79 -5.652 -0.766 -4.702 1362 HB ILE 79 HB ILE 79 -8.325 -0.002 -3.432 1363 HG12 ILE 79 2HG1 ILE 79 -5.431 0.541 -2.513 1364 HG13 ILE 79 1HG1 ILE 79 -6.378 1.704 -3.471 1365 HG21 ILE 79 1HG2 ILE 79 -7.548 -1.273 -1.388 1366 HG22 ILE 79 2HG2 ILE 79 -6.131 -1.886 -2.325 1367 HG23 ILE 79 3HG2 ILE 79 -7.809 -2.368 -2.772 1368 HD11 ILE 79 3HD ILE 79 -7.107 0.693 -0.637 1369 HD12 ILE 79 1HD ILE 79 -6.475 2.311 -1.086 1370 HD13 ILE 79 2HD ILE 79 -8.117 1.811 -1.636 1371 H GLU 80 H GLU 80 -9.136 -1.016 -5.725 1372 HA GLU 80 HA GLU 80 -9.309 -3.777 -5.473 1373 HB2 GLU 80 2HB GLU 80 -10.675 -2.063 -7.654 1374 HB3 GLU 80 1HB GLU 80 -11.010 -3.793 -7.327 1375 HG2 GLU 80 2HG GLU 80 -11.683 -3.044 -4.909 1376 HG3 GLU 80 1HG GLU 80 -11.748 -1.375 -5.597 1377 H VAL 81 H VAL 81 -8.194 -1.830 -8.286 1378 HA VAL 81 HA VAL 81 -7.914 -4.020 -10.020 1379 HB VAL 81 HB VAL 81 -6.767 -1.197 -9.921 1380 HG11 VAL 81 1HG1 VAL 81 -5.009 -2.422 -11.104 1381 HG12 VAL 81 2HG1 VAL 81 -6.009 -1.587 -12.332 1382 HG13 VAL 81 3HG1 VAL 81 -6.217 -3.355 -12.065 1383 HG21 VAL 81 3HG2 VAL 81 -8.391 -0.877 -11.799 1384 HG22 VAL 81 1HG2 VAL 81 -9.238 -1.561 -10.376 1385 HG23 VAL 81 2HG2 VAL 81 -8.814 -2.624 -11.766 1386 H PHE 82 H PHE 82 -5.477 -2.306 -7.953 1387 HA PHE 82 HA PHE 82 -3.421 -4.078 -8.793 1388 HB2 PHE 82 2HB PHE 82 -3.522 -2.238 -6.317 1389 HB3 PHE 82 1HB PHE 82 -2.039 -3.046 -6.944 1390 HD1 PHE 82 2HD PHE 82 -2.226 -2.632 -9.907 1391 HD2 PHE 82 1HD PHE 82 -3.151 0.024 -6.642 1392 HE1 PHE 82 2HE PHE 82 -1.829 -0.694 -11.366 1393 HE2 PHE 82 1HE PHE 82 -2.752 1.957 -8.111 1394 HZ PHE 82 HZ PHE 82 -2.082 1.609 -10.480 1395 H ALA 83 H ALA 83 -5.890 -4.325 -6.319 1396 HA ALA 83 HA ALA 83 -4.491 -6.454 -4.953 1397 HB1 ALA 83 1HB ALA 83 -7.394 -5.487 -4.632 1398 HB2 ALA 83 2HB ALA 83 -5.990 -4.928 -3.656 1399 HB3 ALA 83 3HB ALA 83 -6.519 -6.639 -3.544 1400 H LEU 84 H LEU 84 -6.950 -6.085 -7.497 1401 HA LEU 84 HA LEU 84 -8.170 -8.539 -7.419 1402 HB2 LEU 84 2HB LEU 84 -8.931 -6.661 -8.835 1403 HB3 LEU 84 1HB LEU 84 -7.484 -6.783 -9.873 1404 HG LEU 84 HG LEU 84 -9.463 -9.119 -9.608 1405 HD11 LEU 84 1HD1 LEU 84 -10.785 -8.158 -11.501 1406 HD12 LEU 84 2HD1 LEU 84 -9.788 -6.656 -11.443 1407 HD13 LEU 84 3HD1 LEU 84 -10.837 -7.099 -10.046 1408 HD21 LEU 84 3HD2 LEU 84 -7.443 -9.669 -10.964 1409 HD22 LEU 84 1HD2 LEU 84 -7.652 -8.171 -11.940 1410 HD23 LEU 84 2HD2 LEU 84 -8.858 -9.503 -12.045 1411 H VAL 85 H VAL 85 -5.133 -7.529 -8.931 1412 HA VAL 85 HA VAL 85 -4.672 -9.821 -10.393 1413 HB VAL 85 HB VAL 85 -2.409 -9.127 -10.672 1414 HG11 VAL 85 1HG1 VAL 85 -4.062 -6.539 -10.282 1415 HG12 VAL 85 2HG1 VAL 85 -4.349 -7.679 -11.640 1416 HG13 VAL 85 3HG1 VAL 85 -2.763 -6.846 -11.471 1417 HG21 VAL 85 3HG2 VAL 85 -2.864 -7.469 -8.116 1418 HG22 VAL 85 1HG2 VAL 85 -1.488 -7.173 -9.239 1419 HG23 VAL 85 2HG2 VAL 85 -1.632 -8.740 -8.378 1420 H THR 86 H THR 86 -4.688 -9.529 -6.949 1421 HA THR 86 HA THR 86 -2.678 -11.311 -6.327 1422 HB THR 86 HB THR 86 -5.169 -10.923 -4.629 1423 HG1 THR 86 1HG THR 86 -4.483 -8.954 -4.956 1424 HG21 THR 86 3HG2 THR 86 -2.192 -11.596 -4.012 1425 HG22 THR 86 1HG2 THR 86 -3.594 -12.715 -3.812 1426 HG23 THR 86 2HG2 THR 86 -3.446 -11.255 -2.776 1427 H ALA 87 H ALA 87 -5.725 -11.859 -7.844 1428 HA ALA 87 HA ALA 87 -6.174 -14.554 -7.388 1429 HB1 ALA 87 1HB ALA 87 -7.114 -14.568 -9.730 1430 HB2 ALA 87 2HB ALA 87 -6.283 -13.004 -10.075 1431 HB3 ALA 87 3HB ALA 87 -7.602 -13.068 -8.869 1432 H ALA 88 H ALA 88 -3.917 -12.917 -9.620 1433 HA ALA 88 HA ALA 88 -2.883 -15.303 -10.762 1434 HB1 ALA 88 1HB ALA 88 -2.876 -13.126 -12.059 1435 HB2 ALA 88 2HB ALA 88 -1.205 -13.764 -11.840 1436 HB3 ALA 88 3HB ALA 88 -1.787 -12.413 -10.816 1437 H LEU 89 H LEU 89 -1.923 -13.046 -8.168 1438 HA LEU 89 HA LEU 89 0.657 -14.059 -7.794 1439 HB2 LEU 89 2HB LEU 89 -1.316 -12.699 -5.898 1440 HB3 LEU 89 1HB LEU 89 0.261 -13.246 -5.316 1441 HG LEU 89 HG LEU 89 1.509 -11.792 -6.643 1442 HD11 LEU 89 1HD1 LEU 89 0.378 -11.866 -8.851 1443 HD12 LEU 89 2HD1 LEU 89 0.711 -10.192 -8.330 1444 HD13 LEU 89 3HD1 LEU 89 -0.951 -10.832 -8.195 1445 HD21 LEU 89 3HD2 LEU 89 0.726 -9.547 -5.894 1446 HD22 LEU 89 1HD2 LEU 89 0.422 -10.768 -4.618 1447 HD23 LEU 89 2HD2 LEU 89 -0.934 -10.169 -5.639 1448 H ALA 90 H ALA 90 -2.477 -15.007 -6.320 1449 HA ALA 90 HA ALA 90 -1.323 -17.078 -4.748 1450 HB1 ALA 90 1HB ALA 90 -3.546 -16.036 -4.203 1451 HB2 ALA 90 2HB ALA 90 -3.684 -17.821 -4.409 1452 HB3 ALA 90 3HB ALA 90 -4.224 -16.712 -5.727 1453 H THR 91 H THR 91 -2.084 -16.798 -8.132 1454 HA THR 91 HA THR 91 -2.418 -19.637 -8.573 1455 HB THR 91 HB THR 91 -1.624 -17.581 -10.724 1456 HG1 THR 91 1HG THR 91 -3.681 -17.126 -9.490 1457 HG21 THR 91 3HG2 THR 91 -2.933 -19.238 -12.194 1458 HG22 THR 91 1HG2 THR 91 -3.076 -20.324 -10.768 1459 HG23 THR 91 2HG2 THR 91 -1.460 -19.946 -11.460 1460 H ASP 92 H ASP 92 0.154 -17.122 -8.727 1461 HA ASP 92 HA ASP 92 1.603 -18.694 -10.533 1462 HB2 ASP 92 2HB ASP 92 2.226 -16.052 -9.181 1463 HB3 ASP 92 1HB ASP 92 3.490 -16.915 -10.136 1464 H PHE 93 H PHE 93 1.459 -19.081 -7.192 1465 HA PHE 93 HA PHE 93 4.050 -20.363 -7.110 1466 HB2 PHE 93 2HB PHE 93 3.729 -21.031 -4.963 1467 HB3 PHE 93 1HB PHE 93 2.800 -19.510 -4.990 1468 HD1 PHE 93 1HD PHE 93 0.299 -19.606 -4.876 1469 HD2 PHE 93 2HD PHE 93 2.677 -23.172 -4.631 1470 HE1 PHE 93 1HE PHE 93 -1.594 -20.793 -3.832 1471 HE2 PHE 93 2HE PHE 93 0.769 -24.375 -3.608 1472 HZ PHE 93 HZ PHE 93 -1.361 -23.178 -3.174 1473 H VAL 94 H VAL 94 0.716 -21.204 -7.982 1474 HA VAL 94 HA VAL 94 0.974 -23.980 -7.647 1475 HB VAL 94 HB VAL 94 -1.129 -22.496 -9.311 1476 HG11 VAL 94 1HG1 VAL 94 -1.158 -25.191 -7.772 1477 HG12 VAL 94 2HG1 VAL 94 -1.197 -24.991 -9.562 1478 HG13 VAL 94 3HG1 VAL 94 -2.584 -24.430 -8.570 1479 HG21 VAL 94 3HG2 VAL 94 -1.004 -21.397 -7.082 1480 HG22 VAL 94 1HG2 VAL 94 -0.971 -23.003 -6.267 1481 HG23 VAL 94 2HG2 VAL 94 -2.444 -22.454 -7.134 1482 H ARG 95 H ARG 95 1.726 -21.757 -10.168 1483 HA ARG 95 HA ARG 95 1.803 -23.193 -12.481 1484 HB2 ARG 95 2HB ARG 95 2.432 -20.746 -12.034 1485 HB3 ARG 95 1HB ARG 95 3.974 -21.331 -11.330 1486 HG2 ARG 95 2HG ARG 95 4.463 -22.392 -13.618 1487 HG3 ARG 95 1HG ARG 95 3.033 -21.515 -14.261 1488 HD2 ARG 95 2HD ARG 95 4.030 -19.321 -13.743 1489 HD3 ARG 95 1HD ARG 95 5.383 -20.072 -12.813 1490 HE ARG 95 HE ARG 95 5.303 -19.634 -15.653 1491 HH11 ARG 95 1HH2 ARG 95 6.747 -21.774 -13.127 1492 HH12 ARG 95 2HH2 ARG 95 7.670 -22.718 -14.210 1493 HH21 ARG 95 1HH1 ARG 95 6.506 -20.997 -17.201 1494 HH22 ARG 95 2HH1 ARG 95 7.571 -22.212 -16.601 1495 H ARG 96 H ARG 96 3.881 -23.561 -9.612 1496 HA ARG 96 HA ARG 96 5.962 -25.010 -10.760 1497 HB2 ARG 96 2HB ARG 96 6.677 -25.553 -8.541 1498 HB3 ARG 96 1HB ARG 96 5.915 -23.932 -8.423 1499 HG2 ARG 96 2HG ARG 96 3.740 -25.222 -7.707 1500 HG3 ARG 96 1HG ARG 96 4.811 -26.661 -7.558 1501 HD2 ARG 96 2HD ARG 96 6.220 -25.267 -5.861 1502 HD3 ARG 96 1HD ARG 96 4.897 -24.046 -5.909 1503 HE ARG 96 HE ARG 96 3.349 -25.703 -5.023 1504 HH11 ARG 96 1HH2 ARG 96 6.761 -27.033 -5.223 1505 HH12 ARG 96 2HH2 ARG 96 6.316 -28.426 -4.320 1506 HH21 ARG 96 1HH1 ARG 96 2.856 -27.778 -3.996 1507 HH22 ARG 96 2HH1 ARG 96 4.169 -28.855 -3.640 1508 H GLU 97 H GLU 97 2.688 -26.018 -9.827 1509 HA GLU 97 HA GLU 97 3.318 -28.779 -9.478 1510 HB2 GLU 97 2HB GLU 97 0.726 -27.201 -9.853 1511 HB3 GLU 97 1HB GLU 97 0.691 -28.977 -9.809 1512 HG2 GLU 97 2HG GLU 97 2.013 -27.406 -7.509 1513 HG3 GLU 97 1HG GLU 97 0.234 -27.645 -7.612 1514 H GLU 98 H GLU 98 2.590 -26.680 -12.257 1515 HA GLU 98 HA GLU 98 1.856 -28.833 -13.975 1516 HB2 GLU 98 2HB GLU 98 2.994 -26.063 -14.686 1517 HB3 GLU 98 1HB GLU 98 2.502 -27.326 -15.861 1518 HG2 GLU 98 2HG GLU 98 0.175 -27.258 -14.472 1519 HG3 GLU 98 1HG GLU 98 0.744 -25.599 -14.050 1520 H GLU 99 H GLU 99 4.926 -27.283 -13.013 1521 HA GLU 99 HA GLU 99 6.448 -28.551 -15.024 1522 HB2 GLU 99 2HB GLU 99 7.421 -27.429 -12.336 1523 HB3 GLU 99 1HB GLU 99 8.420 -27.866 -13.769 1524 HG2 GLU 99 2HG GLU 99 7.069 -26.136 -15.124 1525 HG3 GLU 99 1HG GLU 99 6.340 -25.575 -13.570 1526 H ARG 100 H ARG 100 5.265 -29.609 -11.887 1527 HA ARG 100 HA ARG 100 7.132 -31.687 -11.514 1528 HB2 ARG 100 2HB ARG 100 5.518 -30.826 -9.738 1529 HB3 ARG 100 1HB ARG 100 4.200 -31.710 -10.578 1530 HG2 ARG 100 2HG ARG 100 5.449 -33.874 -10.206 1531 HG3 ARG 100 1HG ARG 100 6.793 -32.962 -9.452 1532 HD2 ARG 100 2HD ARG 100 5.415 -34.034 -7.696 1533 HD3 ARG 100 1HD ARG 100 5.296 -32.243 -7.574 1534 HE ARG 100 HE ARG 100 3.044 -32.345 -8.046 1535 HH11 ARG 100 1HH2 ARG 100 4.437 -35.595 -9.105 1536 HH12 ARG 100 2HH2 ARG 100 2.906 -36.342 -8.967 1537 HH21 ARG 100 1HH1 ARG 100 1.035 -33.617 -7.760 1538 HH22 ARG 100 2HH1 ARG 100 1.003 -35.258 -8.316 1539 H ARG 101 H ARG 101 4.188 -31.393 -13.444 1540 HA ARG 101 HA ARG 101 4.135 -34.249 -14.053 1541 HB2 ARG 101 2HB ARG 101 2.385 -31.860 -14.879 1542 HB3 ARG 101 1HB ARG 101 2.044 -33.566 -15.338 1543 HG2 ARG 101 2HG ARG 101 1.453 -34.203 -13.152 1544 HG3 ARG 101 1HG ARG 101 2.373 -32.881 -12.370 1545 HD2 ARG 101 2HD ARG 101 0.692 -31.178 -13.085 1546 HD3 ARG 101 1HD ARG 101 -0.225 -32.452 -13.984 1547 HE ARG 101 HE ARG 101 -1.215 -33.111 -11.995 1548 HH11 ARG 101 1HH2 ARG 101 1.676 -31.111 -11.029 1549 HH12 ARG 101 2HH2 ARG 101 1.295 -31.146 -9.377 1550 HH21 ARG 101 1HH1 ARG 101 -1.698 -33.125 -9.791 1551 HH22 ARG 101 2HH1 ARG 101 -0.652 -32.402 -8.613 1552 H GLY 102 H GLY 102 5.793 -31.487 -15.160 1553 HA2 GLY 102 2HA GLY 102 7.231 -31.318 -16.836 1554 HA3 GLY 102 1HA GLY 102 6.715 -32.939 -17.432 1555 H HIS 103 H HIS 103 4.043 -30.984 -17.007 1556 HA HIS 103 HA HIS 103 2.608 -30.046 -18.354 1557 HB2 HIS 103 2HB HIS 103 4.645 -28.383 -18.431 1558 HB3 HIS 103 1HB HIS 103 4.799 -28.885 -20.135 1559 HD1 HIS 103 1HD HIS 103 1.988 -28.636 -21.250 1560 HD2 HIS 103 2HD HIS 103 3.296 -26.099 -18.155 1561 HE1 HIS 103 1HE HIS 103 0.556 -26.530 -21.316 1562 HE2 HIS 103 2HE HIS 103 1.398 -25.051 -19.383 1563 H1 SER 1 H SER 1 17.712 -23.904 -1.378 1564 HA SER 1 HA SER 1 16.831 -23.241 0.760 1565 HB2 SER 1 2HB SER 1 17.566 -20.782 0.456 1566 HB3 SER 1 1HB SER 1 16.172 -20.565 -0.653 1567 HG SER 1 1HG SER 1 15.034 -20.270 1.024 1568 H ALA 2 H ALA 2 15.436 -21.832 -2.349 1569 HA ALA 2 HA ALA 2 13.888 -24.162 -2.712 1570 HB1 ALA 2 1HB ALA 2 12.331 -23.045 -1.054 1571 HB2 ALA 2 2HB ALA 2 11.621 -23.039 -2.704 1572 HB3 ALA 2 3HB ALA 2 12.373 -21.541 -2.030 1573 H ASP 3 H ASP 3 12.509 -23.751 -4.683 1574 HA ASP 3 HA ASP 3 14.006 -22.675 -6.806 1575 HB2 ASP 3 2HB ASP 3 11.865 -23.342 -8.098 1576 HB3 ASP 3 1HB ASP 3 12.668 -24.679 -7.230 1577 H HIS 4 H HIS 4 10.874 -22.040 -5.366 1578 HA HIS 4 HA HIS 4 10.244 -19.773 -6.837 1579 HB2 HIS 4 2HB HIS 4 8.409 -19.323 -5.211 1580 HB3 HIS 4 1HB HIS 4 8.494 -21.039 -5.675 1581 HD1 HIS 4 1HD HIS 4 9.509 -18.806 -2.677 1582 HD2 HIS 4 2HD HIS 4 8.509 -22.803 -3.555 1583 HE1 HIS 4 1HE HIS 4 9.302 -20.015 -0.487 1584 HE2 HIS 4 2HE HIS 4 8.598 -22.354 -1.025 1585 H GLU 5 H GLU 5 12.354 -20.019 -4.111 1586 HA GLU 5 HA GLU 5 11.937 -17.331 -3.186 1587 HB2 GLU 5 2HB GLU 5 12.718 -19.426 -1.842 1588 HB3 GLU 5 1HB GLU 5 14.335 -19.149 -2.567 1589 HG2 GLU 5 2HG GLU 5 14.326 -16.820 -1.526 1590 HG3 GLU 5 1HG GLU 5 12.697 -17.164 -0.823 1591 H ARG 6 H ARG 6 14.047 -19.082 -5.454 1592 HA ARG 6 HA ARG 6 15.952 -16.981 -5.732 1593 HB2 ARG 6 2HB ARG 6 15.252 -19.365 -7.549 1594 HB3 ARG 6 1HB ARG 6 16.679 -18.297 -7.754 1595 HG2 ARG 6 2HG ARG 6 17.604 -19.000 -5.580 1596 HG3 ARG 6 1HG ARG 6 16.121 -19.885 -5.158 1597 HD2 ARG 6 2HD ARG 6 17.938 -21.429 -5.878 1598 HD3 ARG 6 1HD ARG 6 16.466 -21.542 -6.940 1599 HE ARG 6 HE ARG 6 18.441 -19.589 -7.912 1600 HH11 ARG 6 1HH2 ARG 6 18.168 -23.149 -7.575 1601 HH12 ARG 6 2HH2 ARG 6 18.484 -23.519 -9.201 1602 HH21 ARG 6 1HH1 ARG 6 19.522 -20.206 -10.027 1603 HH22 ARG 6 2HH1 ARG 6 19.484 -21.846 -10.514 1604 H GLU 7 H GLU 7 12.939 -17.943 -7.267 1605 HA GLU 7 HA GLU 7 13.016 -16.234 -9.465 1606 HB2 GLU 7 2HB GLU 7 11.372 -18.253 -8.610 1607 HB3 GLU 7 1HB GLU 7 10.381 -16.882 -8.043 1608 HG2 GLU 7 2HG GLU 7 9.570 -17.541 -10.225 1609 HG3 GLU 7 1HG GLU 7 10.450 -15.989 -10.482 1610 H ALA 8 H ALA 8 11.846 -15.846 -6.122 1611 HA ALA 8 HA ALA 8 10.730 -13.289 -6.438 1612 HB1 ALA 8 1HB ALA 8 10.143 -14.769 -4.490 1613 HB2 ALA 8 2HB ALA 8 10.803 -13.198 -3.909 1614 HB3 ALA 8 3HB ALA 8 11.843 -14.662 -3.895 1615 H GLN 9 H GLN 9 13.902 -14.430 -5.299 1616 HA GLN 9 HA GLN 9 15.087 -12.066 -4.561 1617 HB2 GLN 9 2HB GLN 9 15.969 -14.417 -4.213 1618 HB3 GLN 9 1HB GLN 9 16.275 -14.537 -5.973 1619 HG2 GLN 9 2HG GLN 9 18.018 -12.693 -5.762 1620 HG3 GLN 9 1HG GLN 9 17.731 -12.678 -3.982 1621 HE21 GLN 9 1HE2 GLN 9 19.300 -13.953 -2.929 1622 HE22 GLN 9 2HE2 GLN 9 19.962 -15.434 -3.520 1623 H LYS 10 H LYS 10 14.760 -13.524 -7.792 1624 HA LYS 10 HA LYS 10 16.516 -11.846 -9.164 1625 HB2 LYS 10 2HB LYS 10 15.658 -14.031 -9.998 1626 HB3 LYS 10 1HB LYS 10 14.002 -13.340 -10.089 1627 HG2 LYS 10 2HG LYS 10 14.692 -11.822 -11.931 1628 HG3 LYS 10 1HG LYS 10 16.403 -12.331 -11.747 1629 HD2 LYS 10 2HD LYS 10 15.370 -13.446 -13.694 1630 HD3 LYS 10 1HD LYS 10 15.852 -14.630 -12.429 1631 HE2 LYS 10 2HE LYS 10 13.386 -14.669 -11.641 1632 HE3 LYS 10 1HE LYS 10 12.970 -13.653 -13.072 1633 HZ1 LYS 10 3HZ LYS 10 12.817 -16.213 -13.033 1634 HZ2 LYS 10 1HZ LYS 10 14.458 -16.203 -13.420 1635 HZ3 LYS 10 2HZ LYS 10 13.303 -15.438 -14.467 1636 H ALA 11 H ALA 11 13.117 -11.416 -8.175 1637 HA ALA 11 HA ALA 11 12.635 -9.245 -9.962 1638 HB1 ALA 11 1HB ALA 11 10.575 -8.858 -8.640 1639 HB2 ALA 11 2HB ALA 11 11.170 -9.958 -7.343 1640 HB3 ALA 11 3HB ALA 11 10.757 -10.614 -8.970 1641 H GLU 12 H GLU 12 14.025 -9.591 -6.699 1642 HA GLU 12 HA GLU 12 13.655 -6.895 -5.990 1643 HB2 GLU 12 2HB GLU 12 15.647 -8.921 -4.829 1644 HB3 GLU 12 1HB GLU 12 15.289 -7.290 -4.162 1645 HG2 GLU 12 2HG GLU 12 12.813 -7.990 -4.013 1646 HG3 GLU 12 1HG GLU 12 13.338 -9.677 -4.357 1647 H GLU 13 H GLU 13 16.419 -8.573 -7.613 1648 HA GLU 13 HA GLU 13 18.029 -6.223 -7.444 1649 HB2 GLU 13 2HB GLU 13 19.640 -7.234 -8.894 1650 HB3 GLU 13 1HB GLU 13 19.098 -8.413 -7.673 1651 HG2 GLU 13 2HG GLU 13 18.783 -9.917 -9.311 1652 HG3 GLU 13 1HG GLU 13 17.387 -8.961 -9.902 1653 H GLU 14 H GLU 14 15.542 -7.352 -9.657 1654 HA GLU 14 HA GLU 14 16.219 -5.686 -11.811 1655 HB2 GLU 14 2HB GLU 14 14.775 -7.734 -12.006 1656 HB3 GLU 14 1HB GLU 14 13.490 -6.893 -11.096 1657 HG2 GLU 14 2HG GLU 14 12.642 -6.064 -13.002 1658 HG3 GLU 14 1HG GLU 14 14.153 -5.160 -13.326 1659 H LEU 15 H LEU 15 14.289 -5.193 -8.841 1660 HA LEU 15 HA LEU 15 13.136 -2.779 -9.653 1661 HB2 LEU 15 2HB LEU 15 12.395 -4.146 -7.668 1662 HB3 LEU 15 1HB LEU 15 13.862 -3.635 -6.783 1663 HG LEU 15 HG LEU 15 13.100 -1.294 -6.764 1664 HD11 LEU 15 1HD1 LEU 15 10.801 -0.659 -7.673 1665 HD12 LEU 15 2HD1 LEU 15 10.762 -2.237 -8.543 1666 HD13 LEU 15 3HD1 LEU 15 12.021 -1.007 -8.935 1667 HD21 LEU 15 3HD2 LEU 15 11.040 -1.512 -5.376 1668 HD22 LEU 15 1HD2 LEU 15 12.224 -2.811 -4.978 1669 HD23 LEU 15 2HD2 LEU 15 10.779 -3.182 -5.988 1670 H GLN 16 H GLN 16 16.256 -3.549 -8.193 1671 HA GLN 16 HA GLN 16 17.002 -0.916 -7.515 1672 HB2 GLN 16 2HB GLN 16 18.729 -3.355 -8.217 1673 HB3 GLN 16 1HB GLN 16 19.335 -1.895 -7.375 1674 HG2 GLN 16 2HG GLN 16 18.007 -2.364 -5.380 1675 HG3 GLN 16 1HG GLN 16 17.062 -3.653 -6.214 1676 HE21 GLN 16 1HE2 GLN 16 18.132 -4.569 -3.954 1677 HE22 GLN 16 2HE2 GLN 16 19.580 -5.481 -4.214 1678 H LYS 17 H LYS 17 17.015 -2.716 -10.505 1679 HA LYS 17 HA LYS 17 19.032 -1.258 -11.846 1680 HB2 LYS 17 2HB LYS 17 18.135 -3.606 -12.354 1681 HB3 LYS 17 1HB LYS 17 16.657 -2.840 -13.008 1682 HG2 LYS 17 2HG LYS 17 17.969 -1.807 -14.846 1683 HG3 LYS 17 1HG LYS 17 19.507 -2.326 -14.069 1684 HD2 LYS 17 2HD LYS 17 19.016 -3.871 -15.895 1685 HD3 LYS 17 1HD LYS 17 18.873 -4.713 -14.316 1686 HE2 LYS 17 2HE LYS 17 16.323 -4.439 -14.471 1687 HE3 LYS 17 1HE LYS 17 16.537 -3.737 -16.124 1688 HZ1 LYS 17 3HZ LYS 17 16.009 -6.162 -15.831 1689 HZ2 LYS 17 1HZ LYS 17 17.612 -6.399 -15.324 1690 HZ3 LYS 17 2HZ LYS 17 17.312 -5.805 -16.912 1691 H VAL 18 H VAL 18 15.411 -1.066 -11.755 1692 HA VAL 18 HA VAL 18 15.387 1.011 -13.691 1693 HB VAL 18 HB VAL 18 12.993 1.274 -13.173 1694 HG11 VAL 18 1HG1 VAL 18 12.390 -0.961 -14.106 1695 HG12 VAL 18 2HG1 VAL 18 13.987 -1.633 -13.624 1696 HG13 VAL 18 3HG1 VAL 18 13.891 -0.344 -14.885 1697 HG21 VAL 18 3HG2 VAL 18 11.882 -0.310 -11.626 1698 HG22 VAL 18 1HG2 VAL 18 13.095 0.632 -10.696 1699 HG23 VAL 18 2HG2 VAL 18 13.447 -1.066 -11.191 1700 H LEU 19 H LEU 19 15.796 0.974 -10.193 1701 HA LEU 19 HA LEU 19 15.121 3.628 -9.644 1702 HB2 LEU 19 2HB LEU 19 17.431 1.952 -8.465 1703 HB3 LEU 19 1HB LEU 19 16.936 3.552 -7.831 1704 HG LEU 19 HG LEU 19 15.152 1.056 -7.841 1705 HD11 LEU 19 1HD1 LEU 19 15.554 1.013 -5.398 1706 HD12 LEU 19 2HD1 LEU 19 16.632 2.455 -5.517 1707 HD13 LEU 19 3HD1 LEU 19 17.126 0.894 -6.278 1708 HD21 LEU 19 3HD2 LEU 19 13.742 2.456 -6.260 1709 HD22 LEU 19 1HD2 LEU 19 13.744 3.076 -7.947 1710 HD23 LEU 19 2HD2 LEU 19 14.743 3.886 -6.679 1711 H GLU 20 H GLU 20 18.069 2.208 -11.066 1712 HA GLU 20 HA GLU 20 19.615 4.577 -10.826 1713 HB2 GLU 20 2HB GLU 20 19.940 2.145 -12.687 1714 HB3 GLU 20 1HB GLU 20 21.198 3.396 -12.414 1715 HG2 GLU 20 2HG GLU 20 20.079 1.575 -10.174 1716 HG3 GLU 20 1HG GLU 20 21.506 1.172 -11.187 1717 H GLU 21 H GLU 21 17.252 3.421 -13.186 1718 HA GLU 21 HA GLU 21 18.223 5.395 -15.125 1719 HB2 GLU 21 2HB GLU 21 17.472 3.243 -16.045 1720 HB3 GLU 21 1HB GLU 21 15.808 3.545 -15.437 1721 HG2 GLU 21 2HG GLU 21 15.476 5.395 -16.934 1722 HG3 GLU 21 1HG GLU 21 17.240 5.643 -17.172 1723 H ALA 22 H ALA 22 15.726 4.850 -12.689 1724 HA ALA 22 HA ALA 22 14.019 6.918 -13.283 1725 HB1 ALA 22 1HB ALA 22 14.804 5.913 -10.476 1726 HB2 ALA 22 2HB ALA 22 13.562 5.162 -11.534 1727 HB3 ALA 22 3HB ALA 22 13.311 6.830 -10.900 1728 H SER 23 H SER 23 17.126 6.996 -11.391 1729 HA SER 23 HA SER 23 16.796 9.636 -10.510 1730 HB2 SER 23 2HB SER 23 19.457 9.380 -10.357 1731 HB3 SER 23 1HB SER 23 18.386 8.385 -9.305 1732 HG SER 23 1HG SER 23 20.057 7.197 -10.476 1733 H LYS 24 H LYS 24 18.197 8.219 -13.490 1734 HA LYS 24 HA LYS 24 19.386 10.664 -14.300 1735 HB2 LYS 24 2HB LYS 24 20.092 8.353 -15.168 1736 HB3 LYS 24 1HB LYS 24 18.616 8.367 -16.186 1737 HG2 LYS 24 2HG LYS 24 19.482 10.597 -17.186 1738 HG3 LYS 24 1HG LYS 24 21.009 10.331 -16.279 1739 HD2 LYS 24 2HD LYS 24 21.366 8.182 -17.591 1740 HD3 LYS 24 1HD LYS 24 19.775 8.433 -18.374 1741 HE2 LYS 24 2HE LYS 24 21.319 9.173 -20.026 1742 HE3 LYS 24 1HE LYS 24 20.675 10.691 -19.293 1743 HZ1 LYS 24 3HZ LYS 24 22.873 11.156 -19.267 1744 HZ2 LYS 24 1HZ LYS 24 23.356 9.535 -19.238 1745 HZ3 LYS 24 2HZ LYS 24 22.889 10.314 -17.800 1746 H LYS 25 H LYS 25 16.319 9.000 -15.237 1747 HA LYS 25 HA LYS 25 15.613 11.116 -17.026 1748 HB2 LYS 25 2HB LYS 25 13.956 8.832 -15.828 1749 HB3 LYS 25 1HB LYS 25 13.349 9.996 -17.064 1750 HG2 LYS 25 2HG LYS 25 15.206 9.385 -18.597 1751 HG3 LYS 25 1HG LYS 25 15.828 8.179 -17.421 1752 HD2 LYS 25 2HD LYS 25 13.894 6.754 -17.707 1753 HD3 LYS 25 1HD LYS 25 13.002 8.022 -18.635 1754 HE2 LYS 25 2HE LYS 25 14.554 7.924 -20.498 1755 HE3 LYS 25 1HE LYS 25 15.710 6.868 -19.598 1756 HZ1 LYS 25 3HZ LYS 25 14.441 5.062 -19.836 1757 HZ2 LYS 25 1HZ LYS 25 14.199 5.870 -21.331 1758 HZ3 LYS 25 2HZ LYS 25 12.969 5.898 -20.156 1759 H ALA 26 H ALA 26 15.219 10.617 -13.537 1760 HA ALA 26 HA ALA 26 13.130 12.425 -13.150 1761 HB1 ALA 26 1HB ALA 26 13.996 12.706 -10.811 1762 HB2 ALA 26 2HB ALA 26 15.502 11.825 -11.269 1763 HB3 ALA 26 3HB ALA 26 13.914 10.975 -11.274 1764 H VAL 27 H VAL 27 16.714 12.963 -13.180 1765 HA VAL 27 HA VAL 27 16.256 15.743 -12.655 1766 HB VAL 27 HB VAL 27 18.147 14.480 -11.747 1767 HG11 VAL 27 1HG1 VAL 27 19.231 14.470 -14.649 1768 HG12 VAL 27 2HG1 VAL 27 18.652 13.035 -13.724 1769 HG13 VAL 27 3HG1 VAL 27 20.092 13.926 -13.163 1770 HG21 VAL 27 3HG2 VAL 27 19.825 16.281 -12.086 1771 HG22 VAL 27 1HG2 VAL 27 18.163 16.943 -11.846 1772 HG23 VAL 27 2HG2 VAL 27 18.894 16.892 -13.501 1773 H GLU 28 H GLU 28 16.340 13.767 -15.546 1774 HA GLU 28 HA GLU 28 16.873 15.999 -17.293 1775 HB2 GLU 28 2HB GLU 28 17.297 13.471 -17.896 1776 HB3 GLU 28 1HB GLU 28 15.534 13.417 -18.230 1777 HG2 GLU 28 2HG GLU 28 15.936 15.462 -19.820 1778 HG3 GLU 28 1HG GLU 28 17.691 15.195 -19.556 1779 H ALA 29 H ALA 29 14.104 14.523 -15.699 1780 HA ALA 29 HA ALA 29 12.082 15.338 -17.396 1781 HB1 ALA 29 1HB ALA 29 11.787 13.696 -15.468 1782 HB2 ALA 29 2HB ALA 29 10.560 14.995 -15.465 1783 HB3 ALA 29 3HB ALA 29 11.936 15.072 -14.317 1784 H GLU 30 H GLU 30 13.473 16.918 -14.471 1785 HA GLU 30 HA GLU 30 11.962 19.303 -15.035 1786 HB2 GLU 30 2HB GLU 30 14.169 19.045 -12.910 1787 HB3 GLU 30 1HB GLU 30 12.810 20.244 -13.076 1788 HG2 GLU 30 2HG GLU 30 11.284 18.095 -12.814 1789 HG3 GLU 30 1HG GLU 30 12.750 17.324 -12.129 1790 H ARG 31 H ARG 31 14.342 20.790 -13.865 1791 HA ARG 31 HA ARG 31 15.820 22.252 -14.506 1792 HB2 ARG 31 2HB ARG 31 16.810 20.262 -16.590 1793 HB3 ARG 31 1HB ARG 31 17.720 21.675 -15.956 1794 HG2 ARG 31 2HG ARG 31 16.844 19.194 -14.328 1795 HG3 ARG 31 1HG ARG 31 18.428 19.461 -15.134 1796 HD2 ARG 31 2HD ARG 31 18.682 21.583 -13.607 1797 HD3 ARG 31 1HD ARG 31 17.332 20.868 -12.612 1798 HE ARG 31 HE ARG 31 19.007 18.727 -13.113 1799 HH11 ARG 31 1HH2 ARG 31 19.697 21.476 -10.980 1800 HH12 ARG 31 2HH2 ARG 31 21.340 21.424 -11.119 1801 HH21 ARG 31 1HH1 ARG 31 21.303 18.520 -13.290 1802 HH22 ARG 31 2HH1 ARG 31 22.356 19.551 -12.418 1803 H GLY 32 H GLY 32 13.463 22.875 -15.411 1804 HA2 GLY 32 2HA GLY 32 13.601 24.986 -16.725 1805 HA3 GLY 32 1HA GLY 32 13.879 23.891 -18.134 1806 H ALA 33 H ALA 33 11.638 23.298 -15.301 1807 HA ALA 33 HA ALA 33 9.448 23.615 -17.159 1808 HB1 ALA 33 1HB ALA 33 8.407 21.570 -15.980 1809 HB2 ALA 33 2HB ALA 33 10.055 21.244 -15.341 1810 HB3 ALA 33 3HB ALA 33 9.761 21.178 -17.113 1811 HA PRO 34 HA PRO 34 8.439 25.935 -13.634 1812 HB2 PRO 34 2HB PRO 34 5.676 26.285 -13.842 1813 HB3 PRO 34 1HB PRO 34 6.819 26.927 -15.085 1814 HG2 PRO 34 2HG PRO 34 5.252 24.286 -15.164 1815 HG3 PRO 34 1HG PRO 34 5.357 25.546 -16.463 1816 HD2 PRO 34 2HD PRO 34 6.974 23.281 -16.412 1817 HD3 PRO 34 1HD PRO 34 7.605 24.882 -17.020 1818 H GLY 35 H GLY 35 7.620 25.874 -11.418 1819 HA2 GLY 35 2HA GLY 35 6.430 24.960 -9.698 1820 HA3 GLY 35 1HA GLY 35 6.011 23.524 -10.706 1821 H ALA 36 H ALA 36 8.502 22.815 -11.604 1822 HA ALA 36 HA ALA 36 9.814 21.111 -10.786 1823 HB1 ALA 36 1HB ALA 36 10.842 22.618 -12.359 1824 HB2 ALA 36 2HB ALA 36 12.079 22.229 -11.124 1825 HB3 ALA 36 3HB ALA 36 11.229 23.820 -11.062 1826 H ALA 37 H ALA 37 10.666 20.001 -9.136 1827 HA ALA 37 HA ALA 37 11.156 21.446 -6.575 1828 HB1 ALA 37 1HB ALA 37 10.046 18.604 -7.037 1829 HB2 ALA 37 2HB ALA 37 9.099 20.005 -6.430 1830 HB3 ALA 37 3HB ALA 37 10.429 19.328 -5.419 1831 H LEU 38 H LEU 38 12.106 18.907 -8.893 1832 HA LEU 38 HA LEU 38 14.255 17.941 -7.173 1833 HB2 LEU 38 2HB LEU 38 12.310 16.521 -8.135 1834 HB3 LEU 38 1HB LEU 38 13.057 16.715 -9.729 1835 HG LEU 38 HG LEU 38 14.503 15.450 -7.306 1836 HD11 LEU 38 1HD1 LEU 38 13.787 13.243 -8.275 1837 HD12 LEU 38 2HD1 LEU 38 12.778 14.116 -9.488 1838 HD13 LEU 38 3HD1 LEU 38 12.378 14.238 -7.740 1839 HD21 LEU 38 3HD2 LEU 38 15.035 15.300 -10.340 1840 HD22 LEU 38 1HD2 LEU 38 15.794 14.201 -9.137 1841 HD23 LEU 38 2HD2 LEU 38 16.129 15.965 -9.077 1842 H ILE 39 H ILE 39 15.223 20.197 -7.928 1843 HA ILE 39 HA ILE 39 16.302 20.042 -10.627 1844 HB ILE 39 HB ILE 39 17.161 22.342 -10.116 1845 HG12 ILE 39 2HG1 ILE 39 15.441 22.106 -7.549 1846 HG13 ILE 39 1HG1 ILE 39 17.233 21.999 -7.555 1847 HG21 ILE 39 1HG2 ILE 39 14.920 23.333 -10.392 1848 HG22 ILE 39 2HG2 ILE 39 14.133 21.856 -9.707 1849 HG23 ILE 39 3HG2 ILE 39 14.980 21.771 -11.275 1850 HD11 ILE 39 3HD ILE 39 15.604 24.440 -8.538 1851 HD12 ILE 39 1HD ILE 39 16.487 24.298 -6.977 1852 HD13 ILE 39 2HD ILE 39 17.396 24.294 -8.533 1853 H SER 40 H SER 40 17.383 18.010 -8.755 1854 HA SER 40 HA SER 40 20.182 18.954 -8.656 1855 HB2 SER 40 2HB SER 40 18.681 17.315 -6.524 1856 HB3 SER 40 1HB SER 40 20.468 17.550 -6.534 1857 HG SER 40 1HG SER 40 19.283 18.832 -5.098 1858 H TYR 41 H TYR 41 21.646 17.336 -9.319 1859 HA TYR 41 HA TYR 41 20.552 14.847 -10.253 1860 HB2 TYR 41 2HB TYR 41 22.397 16.139 -11.453 1861 HB3 TYR 41 1HB TYR 41 23.522 15.649 -10.139 1862 HD1 TYR 41 2HD TYR 41 23.638 12.977 -9.705 1863 HD2 TYR 41 1HD TYR 41 22.275 14.843 -13.341 1864 HE1 TYR 41 2HE TYR 41 24.058 10.900 -10.921 1865 HE2 TYR 41 1HE TYR 41 22.711 12.762 -14.569 1866 HH TYR 41 HH TYR 41 23.908 9.805 -12.914 1867 HA PRO 42 HA PRO 42 23.177 12.893 -6.961 1868 HB2 PRO 42 2HB PRO 42 24.039 14.193 -4.623 1869 HB3 PRO 42 1HB PRO 42 24.983 14.207 -6.159 1870 HG2 PRO 42 2HG PRO 42 23.030 16.346 -5.147 1871 HG3 PRO 42 1HG PRO 42 24.719 16.576 -5.762 1872 HD2 PRO 42 2HD PRO 42 22.550 16.940 -7.401 1873 HD3 PRO 42 1HD PRO 42 24.038 16.104 -8.038 1874 H ASP 43 H ASP 43 20.816 15.291 -5.956 1875 HA ASP 43 HA ASP 43 19.854 13.727 -3.762 1876 HB2 ASP 43 2HB ASP 43 18.200 15.917 -5.126 1877 HB3 ASP 43 1HB ASP 43 18.066 15.300 -3.458 1878 H ALA 44 H ALA 44 19.573 13.551 -7.194 1879 HA ALA 44 HA ALA 44 16.823 13.145 -7.487 1880 HB1 ALA 44 1HB ALA 44 18.299 13.704 -9.450 1881 HB2 ALA 44 2HB ALA 44 17.352 12.211 -9.746 1882 HB3 ALA 44 3HB ALA 44 19.094 12.096 -9.303 1883 H ILE 45 H ILE 45 19.514 10.938 -6.773 1884 HA ILE 45 HA ILE 45 17.953 8.603 -7.198 1885 HB ILE 45 HB ILE 45 20.336 8.492 -7.466 1886 HG12 ILE 45 2HG1 ILE 45 19.410 6.758 -5.091 1887 HG13 ILE 45 1HG1 ILE 45 18.977 6.484 -6.809 1888 HG21 ILE 45 1HG2 ILE 45 21.906 8.660 -5.534 1889 HG22 ILE 45 2HG2 ILE 45 20.552 9.079 -4.433 1890 HG23 ILE 45 3HG2 ILE 45 21.024 10.198 -5.762 1891 HD11 ILE 45 3HD ILE 45 21.847 6.420 -5.644 1892 HD12 ILE 45 1HD ILE 45 20.832 5.009 -6.114 1893 HD13 ILE 45 2HD ILE 45 21.404 6.160 -7.378 1894 H TRP 46 H TRP 46 18.299 10.849 -4.485 1895 HA TRP 46 HA TRP 46 17.301 8.920 -2.580 1896 HB2 TRP 46 2HB TRP 46 18.198 11.779 -2.502 1897 HB3 TRP 46 1HB TRP 46 16.831 11.422 -1.432 1898 HD1 TRP 46 HD TRP 46 18.367 12.124 0.512 1899 HE1 TRP 46 1HE TRP 46 20.007 10.838 2.017 1900 HE3 TRP 46 3HE TRP 46 19.230 8.118 -2.571 1901 HZ2 TRP 46 2HZ TRP 46 21.334 8.287 1.958 1902 HZ3 TRP 46 3HZ TRP 46 20.663 6.299 -1.788 1903 HH2 TRP 46 HH TRP 46 21.699 6.368 0.453 1904 H TRP 47 H TRP 47 15.906 11.243 -4.813 1905 HA TRP 47 HA TRP 47 13.284 11.054 -3.676 1906 HB2 TRP 47 2HB TRP 47 13.934 12.886 -5.329 1907 HB3 TRP 47 1HB TRP 47 14.166 11.641 -6.571 1908 HD1 TRP 47 HD TRP 47 11.061 12.605 -4.223 1909 HE1 TRP 47 1HE TRP 47 8.987 12.416 -5.654 1910 HE3 TRP 47 3HE TRP 47 13.294 10.844 -8.464 1911 HZ2 TRP 47 2HZ TRP 47 8.324 11.348 -8.259 1912 HZ3 TRP 47 3HZ TRP 47 11.885 10.252 -10.408 1913 HH2 TRP 47 HH TRP 47 9.459 10.561 -10.333 1914 H SER 48 H SER 48 15.151 9.153 -6.216 1915 HA SER 48 HA SER 48 12.783 7.787 -6.912 1916 HB2 SER 48 2HB SER 48 14.260 6.125 -8.108 1917 HB3 SER 48 1HB SER 48 14.323 7.838 -8.654 1918 HG SER 48 1HG SER 48 16.366 6.714 -8.409 1919 H VAL 49 H VAL 49 14.823 7.442 -4.165 1920 HA VAL 49 HA VAL 49 14.250 4.726 -3.612 1921 HB VAL 49 HB VAL 49 15.031 7.083 -1.836 1922 HG11 VAL 49 1HG1 VAL 49 13.782 5.518 -0.351 1923 HG12 VAL 49 2HG1 VAL 49 15.545 5.335 -0.057 1924 HG13 VAL 49 3HG1 VAL 49 14.677 4.112 -1.042 1925 HG21 VAL 49 3HG2 VAL 49 16.558 4.542 -2.737 1926 HG22 VAL 49 1HG2 VAL 49 17.236 5.939 -1.823 1927 HG23 VAL 49 2HG2 VAL 49 16.721 6.139 -3.536 1928 H GLU 50 H GLU 50 12.537 7.808 -2.682 1929 HA GLU 50 HA GLU 50 10.816 6.351 -0.939 1930 HB2 GLU 50 2HB GLU 50 9.789 8.460 -0.396 1931 HB3 GLU 50 1HB GLU 50 11.548 8.758 -0.589 1932 HG2 GLU 50 2HG GLU 50 10.934 9.525 -3.050 1933 HG3 GLU 50 1HG GLU 50 9.236 9.532 -2.480 1934 H THR 51 H THR 51 10.831 6.336 -4.234 1935 HA THR 51 HA THR 51 7.924 6.593 -4.484 1936 HB THR 51 HB THR 51 9.658 8.002 -5.845 1937 HG1 THR 51 1HG THR 51 7.563 8.188 -6.228 1938 HG21 THR 51 3HG2 THR 51 9.465 5.515 -7.685 1939 HG22 THR 51 1HG2 THR 51 10.946 6.012 -6.790 1940 HG23 THR 51 2HG2 THR 51 10.251 7.090 -8.048 1941 H ALA 52 H ALA 52 10.646 4.297 -4.973 1942 HA ALA 52 HA ALA 52 9.087 2.510 -6.520 1943 HB1 ALA 52 1HB ALA 52 10.995 0.905 -6.166 1944 HB2 ALA 52 2HB ALA 52 11.699 2.037 -4.952 1945 HB3 ALA 52 3HB ALA 52 11.564 2.530 -6.685 1946 H THR 53 H THR 53 9.367 3.041 -3.052 1947 HA THR 53 HA THR 53 8.366 0.423 -2.387 1948 HB THR 53 HB THR 53 8.463 1.573 -0.043 1949 HG1 THR 53 1HG THR 53 9.539 3.463 0.012 1950 HG21 THR 53 3HG2 THR 53 11.033 1.336 -1.781 1951 HG22 THR 53 1HG2 THR 53 10.188 -0.031 -0.965 1952 HG23 THR 53 2HG2 THR 53 10.956 1.267 0.018 1953 H THR 54 H THR 54 6.988 3.058 -3.757 1954 HA THR 54 HA THR 54 5.102 3.965 -3.932 1955 HB THR 54 HB THR 54 3.073 2.774 -3.904 1956 HG1 THR 54 1HG THR 54 3.017 1.799 -1.986 1957 HG21 THR 54 3HG2 THR 54 4.920 2.086 -5.564 1958 HG22 THR 54 1HG2 THR 54 3.760 0.774 -5.169 1959 HG23 THR 54 2HG2 THR 54 5.399 0.770 -4.439 1960 H VAL 55 H VAL 55 6.555 4.711 -1.527 1961 HA VAL 55 HA VAL 55 4.375 5.161 0.349 1962 HB VAL 55 HB VAL 55 5.956 6.134 1.872 1963 HG11 VAL 55 1HG1 VAL 55 5.305 3.701 1.761 1964 HG12 VAL 55 2HG1 VAL 55 6.955 3.933 2.450 1965 HG13 VAL 55 3HG1 VAL 55 6.747 3.348 0.753 1966 HG21 VAL 55 3HG2 VAL 55 8.427 5.835 1.482 1967 HG22 VAL 55 1HG2 VAL 55 7.736 7.022 0.344 1968 HG23 VAL 55 2HG2 VAL 55 8.110 5.351 -0.224 1969 H GLY 56 H GLY 56 6.741 7.286 -1.453 1970 HA2 GLY 56 2HA GLY 56 6.371 9.287 -2.319 1971 HA3 GLY 56 1HA GLY 56 4.597 8.943 -2.252 1972 H TYR 57 H TYR 57 7.339 9.788 -0.050 1973 HA TYR 57 HA TYR 57 5.633 10.655 1.991 1974 HB2 TYR 57 2HB TYR 57 8.606 10.604 1.450 1975 HB3 TYR 57 1HB TYR 57 8.131 12.027 2.431 1976 HD1 TYR 57 1HD TYR 57 8.077 8.303 2.342 1977 HD2 TYR 57 2HD TYR 57 7.190 11.842 4.611 1978 HE1 TYR 57 1HE TYR 57 7.780 6.926 4.367 1979 HE2 TYR 57 2HE TYR 57 6.930 10.477 6.648 1980 HH TYR 57 HH TYR 57 7.841 7.101 6.777 1981 H GLY 58 H GLY 58 6.756 12.327 -0.827 1982 HA2 GLY 58 2HA GLY 58 5.625 14.174 -1.577 1983 HA3 GLY 58 1HA GLY 58 5.160 14.609 0.103 1984 H ASP 59 H ASP 59 8.454 13.670 -0.645 1985 HA ASP 59 HA ASP 59 9.407 16.134 0.367 1986 HB2 ASP 59 2HB ASP 59 10.314 13.562 0.229 1987 HB3 ASP 59 1HB ASP 59 11.203 14.200 -1.171 1988 H ARG 60 H ARG 60 9.366 14.546 -2.907 1989 HA ARG 60 HA ARG 60 9.447 17.163 -4.153 1990 HB2 ARG 60 2HB ARG 60 11.352 14.853 -4.899 1991 HB3 ARG 60 1HB ARG 60 11.127 16.316 -5.899 1992 HG2 ARG 60 2HG ARG 60 12.406 17.668 -4.511 1993 HG3 ARG 60 1HG ARG 60 12.051 16.745 -3.025 1994 HD2 ARG 60 2HD ARG 60 13.862 15.677 -5.289 1995 HD3 ARG 60 1HD ARG 60 14.473 16.500 -3.809 1996 HE ARG 60 HE ARG 60 13.165 13.800 -3.983 1997 HH11 ARG 60 1HH2 ARG 60 14.554 16.359 -1.817 1998 HH12 ARG 60 2HH2 ARG 60 13.843 15.617 -0.522 1999 HH21 ARG 60 1HH1 ARG 60 12.920 12.535 -1.818 2000 HH22 ARG 60 2HH1 ARG 60 13.777 13.173 -0.550 2001 H TYR 61 H TYR 61 8.660 16.790 -6.598 2002 HA TYR 61 HA TYR 61 7.896 14.189 -7.251 2003 HB2 TYR 61 2HB TYR 61 5.903 14.944 -5.728 2004 HB3 TYR 61 1HB TYR 61 5.611 16.273 -6.904 2005 HD1 TYR 61 1HD TYR 61 6.121 12.524 -6.792 2006 HD2 TYR 61 2HD TYR 61 4.032 15.804 -8.616 2007 HE1 TYR 61 1HE TYR 61 4.711 10.933 -8.010 2008 HE2 TYR 61 2HE TYR 61 2.630 14.213 -9.873 2009 HH TYR 61 HH TYR 61 2.775 10.715 -9.241 2010 HA PRO 62 HA PRO 62 8.561 16.919 -10.782 2011 HB2 PRO 62 2HB PRO 62 8.074 15.211 -12.944 2012 HB3 PRO 62 1HB PRO 62 9.530 15.078 -11.895 2013 HG2 PRO 62 2HG PRO 62 6.893 13.510 -11.651 2014 HG3 PRO 62 1HG PRO 62 8.582 12.839 -11.677 2015 HD2 PRO 62 2HD PRO 62 7.232 13.326 -9.313 2016 HD3 PRO 62 1HD PRO 62 9.019 13.685 -9.447 2017 H VAL 63 H VAL 63 7.432 17.931 -12.564 2018 HA VAL 63 HA VAL 63 4.542 17.963 -12.066 2019 HB VAL 63 HB VAL 63 5.979 20.256 -13.414 2020 HG11 VAL 63 1HG1 VAL 63 3.403 20.345 -13.108 2021 HG12 VAL 63 2HG1 VAL 63 4.259 21.557 -12.110 2022 HG13 VAL 63 3HG1 VAL 63 3.650 20.043 -11.352 2023 HG21 VAL 63 3HG2 VAL 63 7.433 19.794 -11.479 2024 HG22 VAL 63 1HG2 VAL 63 6.011 19.561 -10.399 2025 HG23 VAL 63 2HG2 VAL 63 6.391 21.182 -11.097 2026 H THR 64 H THR 64 3.835 19.466 -14.411 2027 HA THR 64 HA THR 64 2.944 17.383 -15.895 2028 HB THR 64 HB THR 64 3.023 20.294 -16.830 2029 HG1 THR 64 1HG THR 64 1.523 20.807 -15.401 2030 HG21 THR 64 3HG2 THR 64 0.785 18.145 -16.861 2031 HG22 THR 64 1HG2 THR 64 1.835 18.556 -18.268 2032 HG23 THR 64 2HG2 THR 64 0.710 19.786 -17.592 2033 H GLU 65 H GLU 65 5.303 19.948 -16.847 2034 HA GLU 65 HA GLU 65 5.594 18.788 -19.420 2035 HB2 GLU 65 2HB GLU 65 5.756 21.223 -19.067 2036 HB3 GLU 65 1HB GLU 65 7.270 21.008 -18.118 2037 HG2 GLU 65 2HG GLU 65 8.490 20.219 -20.041 2038 HG3 GLU 65 1HG GLU 65 6.983 19.908 -20.977 2039 H GLU 66 H GLU 66 6.899 18.164 -16.355 2040 HA GLU 66 HA GLU 66 9.381 17.115 -17.168 2041 HB2 GLU 66 2HB GLU 66 7.811 16.903 -14.542 2042 HB3 GLU 66 1HB GLU 66 9.578 16.704 -14.741 2043 HG2 GLU 66 2HG GLU 66 9.799 19.033 -15.572 2044 HG3 GLU 66 1HG GLU 66 8.032 19.344 -15.386 2045 H GLY 67 H GLY 67 6.094 16.076 -16.966 2046 HA2 GLY 67 2HA GLY 67 5.159 14.300 -17.985 2047 HA3 GLY 67 1HA GLY 67 6.807 13.551 -18.214 2048 H ARG 68 H ARG 68 4.265 14.319 -15.818 2049 HA ARG 68 HA ARG 68 5.149 13.384 -13.492 2050 HB2 ARG 68 2HB ARG 68 2.896 13.981 -13.275 2051 HB3 ARG 68 1HB ARG 68 2.481 13.283 -14.880 2052 HG2 ARG 68 2HG ARG 68 2.447 10.969 -13.863 2053 HG3 ARG 68 1HG ARG 68 2.839 11.684 -12.268 2054 HD2 ARG 68 2HD ARG 68 0.417 10.966 -12.793 2055 HD3 ARG 68 1HD ARG 68 0.625 12.630 -12.109 2056 HE ARG 68 HE ARG 68 -0.518 13.338 -13.885 2057 HH11 ARG 68 1HH2 ARG 68 0.856 10.167 -15.137 2058 HH12 ARG 68 2HH2 ARG 68 0.216 10.449 -16.665 2059 HH21 ARG 68 1HH1 ARG 68 -0.837 13.811 -16.186 2060 HH22 ARG 68 2HH1 ARG 68 -0.448 12.674 -17.399 2061 H LYS 69 H LYS 69 4.239 11.440 -16.241 2062 HA LYS 69 HA LYS 69 4.156 8.911 -15.415 2063 HB2 LYS 69 2HB LYS 69 5.462 10.085 -17.905 2064 HB3 LYS 69 1HB LYS 69 5.331 8.311 -17.637 2065 HG2 LYS 69 2HG LYS 69 2.914 8.377 -17.515 2066 HG3 LYS 69 1HG LYS 69 2.876 10.167 -17.663 2067 HD2 LYS 69 2HD LYS 69 3.798 10.101 -19.901 2068 HD3 LYS 69 1HD LYS 69 4.177 8.346 -19.787 2069 HE2 LYS 69 2HE LYS 69 1.873 7.674 -19.962 2070 HE3 LYS 69 1HE LYS 69 1.265 9.339 -19.582 2071 HZ1 LYS 69 3HZ LYS 69 2.079 10.143 -21.595 2072 HZ2 LYS 69 1HZ LYS 69 1.146 8.785 -21.982 2073 HZ3 LYS 69 2HZ LYS 69 2.865 8.723 -22.026 2074 H VAL 70 H VAL 70 7.119 10.939 -15.388 2075 HA VAL 70 HA VAL 70 8.934 8.802 -15.284 2076 HB VAL 70 HB VAL 70 9.112 11.655 -14.213 2077 HG11 VAL 70 1HG1 VAL 70 10.797 10.287 -12.990 2078 HG12 VAL 70 2HG1 VAL 70 11.618 11.253 -14.263 2079 HG13 VAL 70 3HG1 VAL 70 11.318 9.495 -14.524 2080 HG21 VAL 70 3HG2 VAL 70 8.812 11.431 -16.720 2081 HG22 VAL 70 1HG2 VAL 70 10.196 10.280 -16.777 2082 HG23 VAL 70 2HG2 VAL 70 10.454 11.999 -16.304 2083 H ALA 71 H ALA 71 6.889 10.280 -12.733 2084 HA ALA 71 HA ALA 71 8.262 8.801 -10.632 2085 HB1 ALA 71 1HB ALA 71 7.085 10.993 -10.108 2086 HB2 ALA 71 2HB ALA 71 6.401 9.619 -9.170 2087 HB3 ALA 71 3HB ALA 71 5.527 10.269 -10.612 2088 H GLU 72 H GLU 72 5.176 8.798 -12.298 2089 HA GLU 72 HA GLU 72 3.852 6.740 -11.126 2090 HB2 GLU 72 2HB GLU 72 3.173 8.557 -12.865 2091 HB3 GLU 72 1HB GLU 72 3.898 7.488 -14.109 2092 HG2 GLU 72 2HG GLU 72 2.142 5.727 -13.532 2093 HG3 GLU 72 1HG GLU 72 1.381 6.943 -12.426 2094 H GLN 73 H GLN 73 6.039 6.599 -14.025 2095 HA GLN 73 HA GLN 73 5.431 3.911 -14.531 2096 HB2 GLN 73 2HB GLN 73 6.268 5.569 -16.266 2097 HB3 GLN 73 1HB GLN 73 7.903 5.428 -15.540 2098 HG2 GLN 73 2HG GLN 73 7.861 2.939 -16.044 2099 HG3 GLN 73 1HG GLN 73 6.211 3.132 -16.753 2100 HE21 GLN 73 1HE2 GLN 73 7.872 2.010 -18.413 2101 HE22 GLN 73 2HE2 GLN 73 8.595 3.069 -19.587 2102 H VAL 74 H VAL 74 8.018 5.501 -12.645 2103 HA VAL 74 HA VAL 74 9.550 3.105 -12.357 2104 HB VAL 74 HB VAL 74 9.532 5.751 -10.814 2105 HG11 VAL 74 1HG1 VAL 74 10.526 3.924 -9.392 2106 HG12 VAL 74 2HG1 VAL 74 11.792 5.046 -9.971 2107 HG13 VAL 74 3HG1 VAL 74 11.597 3.433 -10.756 2108 HG21 VAL 74 3HG2 VAL 74 11.426 4.667 -13.023 2109 HG22 VAL 74 1HG2 VAL 74 11.474 6.298 -12.248 2110 HG23 VAL 74 2HG2 VAL 74 10.111 5.862 -13.310 2111 H MET 75 H MET 75 7.101 4.881 -10.428 2112 HA MET 75 HA MET 75 7.146 3.311 -8.159 2113 HB2 MET 75 2HB MET 75 5.962 5.491 -8.384 2114 HB3 MET 75 1HB MET 75 4.765 4.746 -9.493 2115 HG2 MET 75 2HG MET 75 3.999 3.217 -7.657 2116 HG3 MET 75 1HG MET 75 5.228 3.921 -6.566 2117 HE1 MET 75 3HE MET 75 5.191 7.020 -7.040 2118 HE2 MET 75 1HE MET 75 5.292 6.005 -5.555 2119 HE3 MET 75 2HE MET 75 4.094 7.341 -5.652 2120 H LYS 76 H LYS 76 5.224 2.942 -11.177 2121 HA LYS 76 HA LYS 76 3.701 0.829 -10.228 2122 HB2 LYS 76 2HB LYS 76 3.228 2.296 -12.248 2123 HB3 LYS 76 1HB LYS 76 4.386 1.286 -13.181 2124 HG2 LYS 76 2HG LYS 76 2.996 -0.733 -12.775 2125 HG3 LYS 76 1HG LYS 76 1.927 0.173 -11.658 2126 HD2 LYS 76 2HD LYS 76 2.180 0.690 -14.692 2127 HD3 LYS 76 1HD LYS 76 0.903 -0.265 -13.863 2128 HE2 LYS 76 2HE LYS 76 0.302 1.859 -12.512 2129 HE3 LYS 76 1HE LYS 76 1.382 2.785 -13.639 2130 HZ1 LYS 76 3HZ LYS 76 -0.828 2.886 -14.479 2131 HZ2 LYS 76 1HZ LYS 76 -1.081 1.222 -14.235 2132 HZ3 LYS 76 2HZ LYS 76 -0.069 1.706 -15.455 2133 H ALA 77 H ALA 77 6.946 0.838 -11.641 2134 HA ALA 77 HA ALA 77 7.055 -1.938 -12.189 2135 HB1 ALA 77 1HB ALA 77 9.541 -1.635 -12.230 2136 HB2 ALA 77 2HB ALA 77 9.355 0.000 -11.492 2137 HB3 ALA 77 3HB ALA 77 8.727 -0.316 -13.151 2138 H GLY 78 H GLY 78 7.420 -0.015 -9.239 2139 HA2 GLY 78 2HA GLY 78 8.764 -1.999 -7.704 2140 HA3 GLY 78 1HA GLY 78 7.847 -0.551 -7.129 2141 H ILE 79 H ILE 79 5.350 -1.150 -8.293 2142 HA ILE 79 HA ILE 79 4.224 -2.799 -6.352 2143 HB ILE 79 HB ILE 79 3.032 -2.093 -9.092 2144 HG12 ILE 79 2HG1 ILE 79 2.849 -0.578 -6.418 2145 HG13 ILE 79 1HG1 ILE 79 3.802 -0.042 -7.840 2146 HG21 ILE 79 1HG2 ILE 79 1.685 -2.861 -6.406 2147 HG22 ILE 79 2HG2 ILE 79 1.802 -3.933 -7.850 2148 HG23 ILE 79 3HG2 ILE 79 0.828 -2.435 -7.931 2149 HD11 ILE 79 3HD ILE 79 0.730 -0.270 -7.657 2150 HD12 ILE 79 1HD ILE 79 1.718 1.217 -7.802 2151 HD13 ILE 79 2HD ILE 79 1.625 0.063 -9.187 2152 H GLU 80 H GLU 80 5.068 -3.409 -9.797 2153 HA GLU 80 HA GLU 80 4.017 -5.976 -9.943 2154 HB2 GLU 80 2HB GLU 80 6.417 -4.760 -11.448 2155 HB3 GLU 80 1HB GLU 80 5.606 -6.303 -11.893 2156 HG2 GLU 80 2HG GLU 80 3.454 -5.068 -12.284 2157 HG3 GLU 80 1HG GLU 80 4.269 -3.511 -11.897 2158 H VAL 81 H VAL 81 7.238 -4.867 -8.866 2159 HA VAL 81 HA VAL 81 8.424 -7.416 -8.729 2160 HB VAL 81 HB VAL 81 9.005 -4.720 -7.425 2161 HG11 VAL 81 1HG1 VAL 81 11.256 -5.699 -6.737 2162 HG12 VAL 81 2HG1 VAL 81 10.613 -7.340 -7.080 2163 HG13 VAL 81 3HG1 VAL 81 9.879 -6.328 -5.783 2164 HG21 VAL 81 3HG2 VAL 81 9.338 -5.044 -9.934 2165 HG22 VAL 81 1HG2 VAL 81 10.470 -6.398 -9.583 2166 HG23 VAL 81 2HG2 VAL 81 10.875 -4.723 -9.071 2167 H PHE 82 H PHE 82 6.850 -5.368 -6.179 2168 HA PHE 82 HA PHE 82 7.242 -7.397 -4.230 2169 HB2 PHE 82 2HB PHE 82 5.338 -4.972 -4.181 2170 HB3 PHE 82 1HB PHE 82 5.721 -6.018 -2.758 2171 HD1 PHE 82 1HD PHE 82 8.542 -6.450 -2.704 2172 HD2 PHE 82 2HD PHE 82 6.432 -2.921 -3.988 2173 HE1 PHE 82 1HE PHE 82 10.542 -5.086 -2.252 2174 HE2 PHE 82 2HE PHE 82 8.428 -1.565 -3.526 2175 HZ PHE 82 HZ PHE 82 10.495 -2.630 -2.653 2176 H ALA 83 H ALA 83 4.804 -6.908 -6.658 2177 HA ALA 83 HA ALA 83 2.807 -8.471 -5.409 2178 HB1 ALA 83 1HB ALA 83 1.773 -8.590 -7.680 2179 HB2 ALA 83 2HB ALA 83 3.286 -7.935 -8.413 2180 HB3 ALA 83 3HB ALA 83 2.296 -6.921 -7.304 2181 H LEU 84 H LEU 84 5.238 -9.179 -7.944 2182 HA LEU 84 HA LEU 84 4.636 -11.765 -8.519 2183 HB2 LEU 84 2HB LEU 84 6.207 -10.224 -9.707 2184 HB3 LEU 84 1HB LEU 84 7.427 -10.439 -8.426 2185 HG LEU 84 HG LEU 84 6.350 -12.853 -9.989 2186 HD11 LEU 84 1HD1 LEU 84 6.905 -11.154 -11.712 2187 HD12 LEU 84 2HD1 LEU 84 8.086 -12.513 -11.744 2188 HD13 LEU 84 3HD1 LEU 84 8.547 -10.934 -10.999 2189 HD21 LEU 84 3HD2 LEU 84 7.919 -13.415 -8.127 2190 HD22 LEU 84 1HD2 LEU 84 9.131 -12.244 -8.760 2191 HD23 LEU 84 2HD2 LEU 84 8.712 -13.719 -9.703 2192 H VAL 85 H VAL 85 6.765 -10.596 -5.868 2193 HA VAL 85 HA VAL 85 7.814 -13.107 -5.272 2194 HB VAL 85 HB VAL 85 8.631 -12.175 -3.174 2195 HG11 VAL 85 1HG1 VAL 85 8.857 -10.141 -5.508 2196 HG12 VAL 85 2HG1 VAL 85 9.748 -11.690 -5.434 2197 HG13 VAL 85 3HG1 VAL 85 10.044 -10.424 -4.193 2198 HG21 VAL 85 3HG2 VAL 85 8.102 -9.818 -2.538 2199 HG22 VAL 85 1HG2 VAL 85 6.588 -10.787 -2.546 2200 HG23 VAL 85 2HG2 VAL 85 6.962 -9.681 -3.915 2201 H THR 86 H THR 86 4.618 -12.012 -4.736 2202 HA THR 86 HA THR 86 4.076 -13.383 -2.354 2203 HB THR 86 HB THR 86 2.142 -12.670 -4.586 2204 HG1 THR 86 1HG THR 86 3.070 -10.821 -4.088 2205 HG21 THR 86 3HG2 THR 86 0.515 -12.441 -2.657 2206 HG22 THR 86 1HG2 THR 86 1.780 -13.006 -1.514 2207 HG23 THR 86 2HG2 THR 86 1.128 -14.126 -2.771 2208 H ALA 87 H ALA 87 4.727 -14.542 -5.562 2209 HA ALA 87 HA ALA 87 3.342 -16.999 -5.411 2210 HB1 ALA 87 1HB ALA 87 5.004 -17.801 -7.112 2211 HB2 ALA 87 2HB ALA 87 6.012 -16.333 -6.807 2212 HB3 ALA 87 3HB ALA 87 4.377 -16.169 -7.538 2213 H ALA 88 H ALA 88 6.114 -15.769 -3.657 2214 HA ALA 88 HA ALA 88 7.007 -18.424 -2.869 2215 HB1 ALA 88 1HB ALA 88 7.771 -15.635 -1.767 2216 HB2 ALA 88 2HB ALA 88 8.728 -16.561 -2.973 2217 HB3 ALA 88 3HB ALA 88 8.532 -17.186 -1.283 2218 H LEU 89 H LEU 89 5.244 -15.587 -1.575 2219 HA LEU 89 HA LEU 89 5.048 -16.532 1.018 2220 HB2 LEU 89 2HB LEU 89 3.157 -14.591 -0.434 2221 HB3 LEU 89 1HB LEU 89 3.302 -14.777 1.345 2222 HG LEU 89 HG LEU 89 5.591 -13.841 -0.504 2223 HD11 LEU 89 1HD1 LEU 89 3.739 -12.176 -0.502 2224 HD12 LEU 89 2HD1 LEU 89 5.168 -11.562 0.395 2225 HD13 LEU 89 3HD1 LEU 89 3.730 -12.168 1.295 2226 HD21 LEU 89 3HD2 LEU 89 6.690 -13.107 1.623 2227 HD22 LEU 89 1HD2 LEU 89 6.448 -14.888 1.596 2228 HD23 LEU 89 2HD2 LEU 89 5.353 -13.844 2.578 2229 H ALA 90 H ALA 90 2.907 -17.067 -1.764 2230 HA ALA 90 HA ALA 90 0.821 -18.179 -0.192 2231 HB1 ALA 90 1HB ALA 90 1.472 -18.549 -3.166 2232 HB2 ALA 90 2HB ALA 90 0.416 -17.268 -2.470 2233 HB3 ALA 90 3HB ALA 90 -0.088 -18.995 -2.363 2234 H THR 91 H THR 91 3.964 -19.488 -0.944 2235 HA THR 91 HA THR 91 2.970 -22.223 -0.833 2236 HB THR 91 HB THR 91 5.234 -22.997 -0.856 2237 HG1 THR 91 1HG THR 91 5.933 -20.243 -0.596 2238 HG21 THR 91 3HG2 THR 91 4.105 -22.385 -3.012 2239 HG22 THR 91 1HG2 THR 91 5.888 -22.173 -3.113 2240 HG23 THR 91 2HG2 THR 91 4.820 -20.734 -2.934 2241 H ASP 92 H ASP 92 3.757 -19.627 1.378 2242 HA ASP 92 HA ASP 92 4.982 -21.362 3.243 2243 HB2 ASP 92 2HB ASP 92 4.383 -18.388 3.218 2244 HB3 ASP 92 1HB ASP 92 4.697 -19.187 4.805 2245 H PHE 93 H PHE 93 1.678 -20.740 2.644 2246 HA PHE 93 HA PHE 93 1.023 -21.809 5.292 2247 HB2 PHE 93 2HB PHE 93 -1.212 -21.476 4.891 2248 HB3 PHE 93 1HB PHE 93 -0.429 -20.016 4.206 2249 HD1 PHE 93 2HD PHE 93 -0.224 -19.832 1.643 2250 HD2 PHE 93 1HD PHE 93 -2.613 -22.816 3.598 2251 HE1 PHE 93 2HE PHE 93 -1.444 -20.247 -0.467 2252 HE2 PHE 93 1HE PHE 93 -3.801 -23.256 1.474 2253 HZ PHE 93 HZ PHE 93 -3.238 -21.951 -0.557 2254 H VAL 94 H VAL 94 1.683 -22.905 2.031 2255 HA VAL 94 HA VAL 94 0.003 -25.211 2.146 2256 HB VAL 94 HB VAL 94 2.277 -24.510 0.233 2257 HG11 VAL 94 1HG1 VAL 94 1.778 -26.964 0.169 2258 HG12 VAL 94 2HG1 VAL 94 1.102 -26.168 -1.292 2259 HG13 VAL 94 3HG1 VAL 94 0.009 -26.621 0.068 2260 HG21 VAL 94 3HG2 VAL 94 -0.801 -24.150 0.048 2261 HG22 VAL 94 1HG2 VAL 94 0.393 -23.744 -1.235 2262 HG23 VAL 94 2HG2 VAL 94 0.376 -22.822 0.294 2263 H ARG 95 H ARG 95 3.314 -24.371 2.987 2264 HA ARG 95 HA ARG 95 4.372 -26.935 3.302 2265 HB2 ARG 95 2HB ARG 95 4.934 -24.287 4.779 2266 HB3 ARG 95 1HB ARG 95 5.941 -25.757 4.990 2267 HG2 ARG 95 2HG ARG 95 6.682 -25.743 2.710 2268 HG3 ARG 95 1HG ARG 95 5.558 -24.417 2.245 2269 HD2 ARG 95 2HD ARG 95 6.778 -22.751 3.521 2270 HD3 ARG 95 1HD ARG 95 7.750 -24.004 4.384 2271 HE ARG 95 HE ARG 95 8.701 -24.608 2.044 2272 HH11 ARG 95 1HH2 ARG 95 7.867 -21.105 2.965 2273 HH12 ARG 95 2HH2 ARG 95 9.006 -20.490 1.927 2274 HH21 ARG 95 1HH1 ARG 95 10.550 -23.636 1.054 2275 HH22 ARG 95 2HH1 ARG 95 10.675 -21.927 0.924 2276 H ARG 96 H ARG 96 1.707 -25.645 5.076 2277 HA ARG 96 HA ARG 96 2.434 -26.757 7.607 2278 HB2 ARG 96 2HB ARG 96 0.331 -26.088 8.435 2279 HB3 ARG 96 1HB ARG 96 0.761 -24.832 7.231 2280 HG2 ARG 96 2HG ARG 96 -0.611 -26.350 5.560 2281 HG3 ARG 96 1HG ARG 96 -1.301 -27.104 7.036 2282 HD2 ARG 96 2HD ARG 96 -2.182 -24.826 7.748 2283 HD3 ARG 96 1HD ARG 96 -1.548 -24.100 6.222 2284 HE ARG 96 HE ARG 96 -3.928 -25.786 6.547 2285 HH11 ARG 96 1HH2 ARG 96 -1.403 -24.951 4.076 2286 HH12 ARG 96 2HH2 ARG 96 -2.168 -25.966 2.882 2287 HH21 ARG 96 1HH1 ARG 96 -4.841 -27.078 4.845 2288 HH22 ARG 96 2HH1 ARG 96 -4.057 -27.138 3.325 2289 H GLU 97 H GLU 97 1.122 -28.051 4.625 2290 HA GLU 97 HA GLU 97 0.095 -30.427 6.018 2291 HB2 GLU 97 2HB GLU 97 -1.152 -30.855 3.791 2292 HB3 GLU 97 1HB GLU 97 -1.776 -29.604 4.909 2293 HG2 GLU 97 2HG GLU 97 -0.537 -27.837 3.507 2294 HG3 GLU 97 1HG GLU 97 -0.256 -29.117 2.277 2295 H GLU 98 H GLU 98 0.562 -32.396 4.724 2296 HA GLU 98 HA GLU 98 1.998 -33.835 4.446 2297 HB2 GLU 98 2HB GLU 98 3.503 -34.101 2.717 2298 HB3 GLU 98 1HB GLU 98 1.974 -33.380 2.133 2299 HG2 GLU 98 2HG GLU 98 3.037 -31.223 1.726 2300 HG3 GLU 98 1HG GLU 98 4.535 -31.710 2.603 2301 H GLU 99 H GLU 99 3.712 -30.835 5.319 2302 HA GLU 99 HA GLU 99 6.059 -32.110 6.052 2303 HB2 GLU 99 2HB GLU 99 5.698 -29.564 5.945 2304 HB3 GLU 99 1HB GLU 99 4.993 -29.684 7.589 2305 HG2 GLU 99 2HG GLU 99 7.220 -30.816 8.324 2306 HG3 GLU 99 1HG GLU 99 7.856 -30.463 6.678 2307 H ARG 100 H ARG 100 3.176 -31.394 8.089 2308 HA ARG 100 HA ARG 100 4.377 -32.617 10.335 2309 HB2 ARG 100 2HB ARG 100 2.534 -30.719 10.076 2310 HB3 ARG 100 1HB ARG 100 1.381 -32.088 10.202 2311 HG2 ARG 100 2HG ARG 100 2.280 -32.643 12.436 2312 HG3 ARG 100 1HG ARG 100 3.692 -31.565 12.197 2313 HD2 ARG 100 2HD ARG 100 1.973 -30.513 13.748 2314 HD3 ARG 100 1HD ARG 100 2.330 -29.536 12.283 2315 HE ARG 100 HE ARG 100 0.107 -29.645 11.807 2316 HH11 ARG 100 1HH2 ARG 100 0.702 -32.342 14.138 2317 HH12 ARG 100 2HH2 ARG 100 -0.953 -32.803 14.141 2318 HH21 ARG 100 1HH1 ARG 100 -2.021 -30.631 11.520 2319 HH22 ARG 100 2HH1 ARG 100 -2.518 -31.848 12.610 2320 H ARG 101 H ARG 101 2.882 -33.960 7.618 2321 HA ARG 101 HA ARG 101 2.080 -36.419 9.020 2322 HB2 ARG 101 2HB ARG 101 1.856 -35.568 6.065 2323 HB3 ARG 101 1HB ARG 101 1.349 -37.171 6.695 2324 HG2 ARG 101 2HG ARG 101 0.185 -34.493 7.696 2325 HG3 ARG 101 1HG ARG 101 -0.523 -35.495 6.377 2326 HD2 ARG 101 2HD ARG 101 -0.761 -37.423 7.908 2327 HD3 ARG 101 1HD ARG 101 -0.142 -36.442 9.309 2328 HE ARG 101 HE ARG 101 -2.192 -34.865 8.338 2329 HH11 ARG 101 1HH2 ARG 101 -2.006 -38.432 9.181 2330 HH12 ARG 101 2HH2 ARG 101 -3.593 -38.455 9.840 2331 HH21 ARG 101 1HH1 ARG 101 -4.454 -35.055 9.279 2332 HH22 ARG 101 2HH1 ARG 101 -5.090 -36.633 9.464 2333 H GLY 102 H GLY 102 4.615 -35.001 6.972 2334 HA2 GLY 102 2HA GLY 102 6.729 -35.745 6.983 2335 HA3 GLY 102 1HA GLY 102 6.194 -37.415 7.394 2336 H HIS 103 H HIS 103 4.344 -35.886 4.955 2337 HA HIS 103 HA HIS 103 3.874 -36.551 2.898 2338 HB2 HIS 103 2HB HIS 103 5.824 -35.070 2.343 2339 HB3 HIS 103 1HB HIS 103 6.902 -36.497 2.428 2340 HD1 HIS 103 1HD HIS 103 4.510 -34.717 0.056 2341 HD2 HIS 103 2HD HIS 103 6.370 -38.525 0.342 2342 HE1 HIS 103 1HE HIS 103 4.308 -35.825 -2.144 2343 HE2 HIS 103 2HE HIS 103 5.288 -38.150 -1.944 2344 H1 SER 1 H SER 1 -4.439 -19.113 17.608 2345 HA SER 1 HA SER 1 -5.168 -21.470 19.127 2346 HB2 SER 1 2HB SER 1 -6.870 -19.992 17.013 2347 HB3 SER 1 1HB SER 1 -7.408 -21.257 18.179 2348 HG SER 1 1HG SER 1 -6.633 -18.565 18.544 2349 H ALA 2 H ALA 2 -4.991 -20.083 15.786 2350 HA ALA 2 HA ALA 2 -4.641 -22.820 14.755 2351 HB1 ALA 2 1HB ALA 2 -4.844 -21.800 12.479 2352 HB2 ALA 2 2HB ALA 2 -4.958 -20.159 13.230 2353 HB3 ALA 2 3HB ALA 2 -6.259 -21.369 13.508 2354 H ASP 3 H ASP 3 -2.698 -23.378 13.559 2355 HA ASP 3 HA ASP 3 -0.416 -22.281 14.662 2356 HB2 ASP 3 2HB ASP 3 -0.768 -24.095 12.198 2357 HB3 ASP 3 1HB ASP 3 0.851 -23.496 12.701 2358 H HIS 4 H HIS 4 -1.854 -21.611 11.441 2359 HA HIS 4 HA HIS 4 0.243 -19.889 10.685 2360 HB2 HIS 4 2HB HIS 4 -0.972 -19.083 8.840 2361 HB3 HIS 4 1HB HIS 4 -1.380 -20.804 8.980 2362 HD1 HIS 4 1HD HIS 4 -3.151 -17.662 10.496 2363 HD2 HIS 4 2HD HIS 4 -3.816 -20.786 7.792 2364 HE1 HIS 4 1HE HIS 4 -5.560 -17.489 9.751 2365 HE2 HIS 4 2HE HIS 4 -5.922 -19.213 8.029 2366 H GLU 5 H GLU 5 -2.248 -19.395 13.008 2367 HA GLU 5 HA GLU 5 -2.629 -16.555 12.536 2368 HB2 GLU 5 2HB GLU 5 -4.461 -18.018 13.608 2369 HB3 GLU 5 1HB GLU 5 -3.302 -18.388 14.920 2370 HG2 GLU 5 2HG GLU 5 -3.295 -15.800 15.401 2371 HG3 GLU 5 1HG GLU 5 -4.768 -15.750 14.367 2372 H ARG 6 H ARG 6 -0.932 -18.836 14.737 2373 HA ARG 6 HA ARG 6 0.042 -16.829 16.419 2374 HB2 ARG 6 2HB ARG 6 -0.216 -19.340 16.936 2375 HB3 ARG 6 1HB ARG 6 1.322 -19.593 16.048 2376 HG2 ARG 6 2HG ARG 6 2.451 -17.994 17.670 2377 HG3 ARG 6 1HG ARG 6 0.900 -17.796 18.541 2378 HD2 ARG 6 2HD ARG 6 2.486 -20.440 18.237 2379 HD3 ARG 6 1HD ARG 6 2.469 -19.405 19.707 2380 HE ARG 6 HE ARG 6 0.392 -21.266 18.754 2381 HH11 ARG 6 1HH2 ARG 6 1.003 -18.449 20.984 2382 HH12 ARG 6 2HH2 ARG 6 -0.207 -18.914 22.096 2383 HH21 ARG 6 1HH1 ARG 6 -1.104 -21.996 20.480 2384 HH22 ARG 6 2HH1 ARG 6 -1.460 -20.960 21.782 2385 H GLU 7 H GLU 7 1.310 -18.415 13.571 2386 HA GLU 7 HA GLU 7 3.868 -17.476 13.339 2387 HB2 GLU 7 2HB GLU 7 2.425 -19.223 12.096 2388 HB3 GLU 7 1HB GLU 7 1.710 -17.884 11.150 2389 HG2 GLU 7 2HG GLU 7 3.860 -17.516 9.992 2390 HG3 GLU 7 1HG GLU 7 4.689 -18.688 11.093 2391 H ALA 8 H ALA 8 0.802 -16.037 12.144 2392 HA ALA 8 HA ALA 8 1.942 -13.715 11.060 2393 HB1 ALA 8 1HB ALA 8 -0.430 -12.871 10.982 2394 HB2 ALA 8 2HB ALA 8 -0.947 -14.253 12.017 2395 HB3 ALA 8 3HB ALA 8 -0.310 -14.559 10.359 2396 H GLN 9 H GLN 9 0.477 -14.416 14.269 2397 HA GLN 9 HA GLN 9 0.469 -11.718 15.065 2398 HB2 GLN 9 2HB GLN 9 -0.958 -13.304 16.274 2399 HB3 GLN 9 1HB GLN 9 0.475 -14.269 16.752 2400 HG2 GLN 9 2HG GLN 9 -0.355 -13.044 18.672 2401 HG3 GLN 9 1HG GLN 9 1.264 -12.420 18.256 2402 HE21 GLN 9 1HE2 GLN 9 1.130 -10.329 16.691 2403 HE22 GLN 9 2HE2 GLN 9 -0.110 -9.179 17.026 2404 H LYS 10 H LYS 10 2.980 -14.326 15.432 2405 HA LYS 10 HA LYS 10 4.571 -12.629 17.057 2406 HB2 LYS 10 2HB LYS 10 4.994 -15.010 17.196 2407 HB3 LYS 10 1HB LYS 10 5.517 -15.063 15.473 2408 HG2 LYS 10 2HG LYS 10 7.507 -13.824 15.901 2409 HG3 LYS 10 1HG LYS 10 6.830 -13.080 17.391 2410 HD2 LYS 10 2HD LYS 10 7.169 -15.066 18.700 2411 HD3 LYS 10 1HD LYS 10 7.634 -16.035 17.256 2412 HE2 LYS 10 2HE LYS 10 9.580 -15.226 18.716 2413 HE3 LYS 10 1HE LYS 10 9.716 -14.820 16.963 2414 HZ1 LYS 10 3HZ LYS 10 9.586 -12.605 17.376 2415 HZ2 LYS 10 1HZ LYS 10 10.186 -13.108 18.865 2416 HZ3 LYS 10 2HZ LYS 10 8.555 -12.760 18.757 2417 H ALA 11 H ALA 11 4.154 -12.854 13.548 2418 HA ALA 11 HA ALA 11 6.492 -11.609 12.768 2419 HB1 ALA 11 1HB ALA 11 4.761 -12.568 11.177 2420 HB2 ALA 11 2HB ALA 11 5.329 -10.926 10.711 2421 HB3 ALA 11 3HB ALA 11 3.726 -11.131 11.502 2422 H GLU 12 H GLU 12 3.518 -10.160 14.125 2423 HA GLU 12 HA GLU 12 4.217 -7.492 13.572 2424 HB2 GLU 12 2HB GLU 12 2.394 -8.554 15.808 2425 HB3 GLU 12 1HB GLU 12 2.474 -6.862 15.214 2426 HG2 GLU 12 2HG GLU 12 1.777 -7.680 12.907 2427 HG3 GLU 12 1HG GLU 12 1.530 -9.329 13.587 2428 H GLU 13 H GLU 13 5.332 -9.713 16.016 2429 HA GLU 13 HA GLU 13 6.084 -7.747 17.958 2430 HB2 GLU 13 2HB GLU 13 5.534 -10.283 18.285 2431 HB3 GLU 13 1HB GLU 13 7.162 -10.621 17.624 2432 HG2 GLU 13 2HG GLU 13 8.222 -9.421 19.540 2433 HG3 GLU 13 1HG GLU 13 6.598 -8.918 20.147 2434 H GLU 14 H GLU 14 7.546 -9.459 15.193 2435 HA GLU 14 HA GLU 14 10.171 -8.572 15.845 2436 HB2 GLU 14 2HB GLU 14 9.116 -10.648 14.292 2437 HB3 GLU 14 1HB GLU 14 9.794 -9.532 13.070 2438 HG2 GLU 14 2HG GLU 14 11.511 -11.140 13.647 2439 HG3 GLU 14 1HG GLU 14 12.001 -9.577 14.392 2440 H LEU 15 H LEU 15 7.452 -7.181 14.215 2441 HA LEU 15 HA LEU 15 8.891 -5.289 12.674 2442 HB2 LEU 15 2HB LEU 15 6.485 -5.734 12.258 2443 HB3 LEU 15 1HB LEU 15 6.056 -5.077 13.865 2444 HG LEU 15 HG LEU 15 6.673 -2.822 13.209 2445 HD11 LEU 15 1HD1 LEU 15 7.469 -2.340 10.793 2446 HD12 LEU 15 2HD1 LEU 15 7.888 -4.093 10.684 2447 HD13 LEU 15 3HD1 LEU 15 8.691 -3.040 11.901 2448 HD21 LEU 15 3HD2 LEU 15 5.117 -4.156 10.896 2449 HD22 LEU 15 1HD2 LEU 15 5.101 -2.408 11.322 2450 HD23 LEU 15 2HD2 LEU 15 4.426 -3.620 12.472 2451 H GLN 16 H GLN 16 7.559 -5.307 16.023 2452 HA GLN 16 HA GLN 16 8.095 -2.694 16.709 2453 HB2 GLN 16 2HB GLN 16 8.321 -5.157 18.530 2454 HB3 GLN 16 1HB GLN 16 8.326 -3.446 19.073 2455 HG2 GLN 16 2HG GLN 16 5.997 -3.138 18.140 2456 HG3 GLN 16 1HG GLN 16 5.980 -4.867 17.628 2457 HE21 GLN 16 1HE2 GLN 16 7.279 -3.314 20.690 2458 HE22 GLN 16 2HE2 GLN 16 6.293 -4.278 21.749 2459 H LYS 17 H LYS 17 10.229 -5.491 16.737 2460 HA LYS 17 HA LYS 17 12.425 -4.540 18.039 2461 HB2 LYS 17 2HB LYS 17 11.716 -6.845 17.075 2462 HB3 LYS 17 1HB LYS 17 12.458 -6.342 15.530 2463 HG2 LYS 17 2HG LYS 17 14.682 -6.426 16.511 2464 HG3 LYS 17 1HG LYS 17 14.020 -6.437 18.189 2465 HD2 LYS 17 2HD LYS 17 12.932 -8.592 17.858 2466 HD3 LYS 17 1HD LYS 17 13.400 -8.639 16.124 2467 HE2 LYS 17 2HE LYS 17 15.765 -8.994 16.680 2468 HE3 LYS 17 1HE LYS 17 15.449 -8.719 18.444 2469 HZ1 LYS 17 3HZ LYS 17 13.870 -10.804 17.067 2470 HZ2 LYS 17 1HZ LYS 17 14.453 -10.693 18.673 2471 HZ3 LYS 17 2HZ LYS 17 15.526 -11.128 17.450 2472 H VAL 18 H VAL 18 11.650 -4.195 14.519 2473 HA VAL 18 HA VAL 18 14.104 -2.691 14.124 2474 HB VAL 18 HB VAL 18 13.378 -2.638 11.717 2475 HG11 VAL 18 1HG1 VAL 18 14.981 -4.291 12.710 2476 HG12 VAL 18 2HG1 VAL 18 13.995 -5.025 11.389 2477 HG13 VAL 18 3HG1 VAL 18 13.604 -5.396 13.111 2478 HG21 VAL 18 3HG2 VAL 18 10.890 -2.939 12.053 2479 HG22 VAL 18 1HG2 VAL 18 11.175 -4.579 12.753 2480 HG23 VAL 18 2HG2 VAL 18 11.575 -4.256 11.053 2481 H LEU 19 H LEU 19 10.625 -2.140 14.359 2482 HA LEU 19 HA LEU 19 10.433 0.468 13.388 2483 HB2 LEU 19 2HB LEU 19 8.380 -0.736 13.710 2484 HB3 LEU 19 1HB LEU 19 8.923 -1.342 15.298 2485 HG LEU 19 HG LEU 19 8.478 0.769 16.411 2486 HD11 LEU 19 1HD1 LEU 19 8.804 2.350 14.405 2487 HD12 LEU 19 2HD1 LEU 19 7.332 2.644 15.394 2488 HD13 LEU 19 3HD1 LEU 19 7.201 1.812 13.812 2489 HD21 LEU 19 3HD2 LEU 19 6.721 -0.975 16.313 2490 HD22 LEU 19 1HD2 LEU 19 6.074 -0.269 14.786 2491 HD23 LEU 19 2HD2 LEU 19 5.999 0.670 16.321 2492 H GLU 20 H GLU 20 10.940 -0.798 16.746 2493 HA GLU 20 HA GLU 20 10.990 1.791 17.850 2494 HB2 GLU 20 2HB GLU 20 11.924 -0.897 18.993 2495 HB3 GLU 20 1HB GLU 20 11.918 0.646 19.914 2496 HG2 GLU 20 2HG GLU 20 9.454 0.864 19.631 2497 HG3 GLU 20 1HG GLU 20 9.397 -0.657 18.675 2498 H GLU 21 H GLU 21 13.573 -0.514 16.826 2499 HA GLU 21 HA GLU 21 15.677 1.158 17.585 2500 HB2 GLU 21 2HB GLU 21 15.369 -1.109 15.591 2501 HB3 GLU 21 1HB GLU 21 16.886 -0.174 15.581 2502 HG2 GLU 21 2HG GLU 21 15.762 -1.503 18.135 2503 HG3 GLU 21 1HG GLU 21 16.915 -2.293 17.004 2504 H ALA 22 H ALA 22 13.619 1.234 14.706 2505 HA ALA 22 HA ALA 22 15.268 2.854 13.150 2506 HB1 ALA 22 1HB ALA 22 12.188 2.829 13.156 2507 HB2 ALA 22 2HB ALA 22 13.228 1.661 12.274 2508 HB3 ALA 22 3HB ALA 22 13.264 3.410 11.835 2509 H SER 23 H SER 23 13.059 3.620 15.830 2510 HA SER 23 HA SER 23 12.878 6.371 15.216 2511 HB2 SER 23 2HB SER 23 11.982 6.750 17.444 2512 HB3 SER 23 1HB SER 23 11.239 5.263 16.763 2513 HG SER 23 1HG SER 23 12.720 4.039 18.072 2514 H LYS 24 H LYS 24 15.073 4.408 17.147 2515 HA LYS 24 HA LYS 24 16.489 6.554 18.288 2516 HB2 LYS 24 2HB LYS 24 16.249 4.261 19.271 2517 HB3 LYS 24 1HB LYS 24 17.293 3.583 17.986 2518 HG2 LYS 24 2HG LYS 24 18.328 5.914 19.667 2519 HG3 LYS 24 1HG LYS 24 18.161 4.327 20.476 2520 HD2 LYS 24 2HD LYS 24 19.833 3.297 19.291 2521 HD3 LYS 24 1HD LYS 24 19.640 4.303 17.822 2522 HE2 LYS 24 2HE LYS 24 20.739 5.457 20.469 2523 HE3 LYS 24 1HE LYS 24 21.805 4.706 19.210 2524 HZ1 LYS 24 3HZ LYS 24 19.919 6.773 18.322 2525 HZ2 LYS 24 1HZ LYS 24 21.487 6.376 17.795 2526 HZ3 LYS 24 2HZ LYS 24 21.279 7.254 19.251 2527 H LYS 25 H LYS 25 16.717 4.751 15.275 2528 HA LYS 25 HA LYS 25 19.336 5.806 14.663 2529 HB2 LYS 25 2HB LYS 25 17.377 4.467 12.718 2530 HB3 LYS 25 1HB LYS 25 19.099 4.872 12.430 2531 HG2 LYS 25 2HG LYS 25 17.890 2.608 14.062 2532 HG3 LYS 25 1HG LYS 25 19.134 2.569 12.785 2533 HD2 LYS 25 2HD LYS 25 20.744 3.715 14.424 2534 HD3 LYS 25 1HD LYS 25 19.499 3.521 15.705 2535 HE2 LYS 25 2HE LYS 25 20.925 1.252 14.162 2536 HE3 LYS 25 1HE LYS 25 21.224 1.749 15.872 2537 HZ1 LYS 25 3HZ LYS 25 18.892 1.029 16.385 2538 HZ2 LYS 25 1HZ LYS 25 19.912 -0.159 15.872 2539 HZ3 LYS 25 2HZ LYS 25 18.753 0.470 14.791 2540 H ALA 26 H ALA 26 15.919 6.431 13.565 2541 HA ALA 26 HA ALA 26 16.603 8.399 11.757 2542 HB1 ALA 26 1HB ALA 26 14.269 8.976 11.692 2543 HB2 ALA 26 2HB ALA 26 13.962 8.222 13.312 2544 HB3 ALA 26 3HB ALA 26 14.378 7.200 11.884 2545 H VAL 27 H VAL 27 15.720 8.774 15.267 2546 HA VAL 27 HA VAL 27 15.767 11.559 15.156 2547 HB VAL 27 HB VAL 27 14.822 10.141 16.987 2548 HG11 VAL 27 1HG1 VAL 27 17.706 9.927 18.069 2549 HG12 VAL 27 2HG1 VAL 27 16.841 8.598 17.220 2550 HG13 VAL 27 3HG1 VAL 27 16.190 9.247 18.763 2551 HG21 VAL 27 3HG2 VAL 27 16.771 12.380 17.857 2552 HG22 VAL 27 1HG2 VAL 27 15.409 11.722 18.822 2553 HG23 VAL 27 2HG2 VAL 27 15.074 12.571 17.263 2554 H GLU 28 H GLU 28 18.406 9.265 15.205 2555 HA GLU 28 HA GLU 28 20.319 11.245 16.128 2556 HB2 GLU 28 2HB GLU 28 20.163 8.727 16.806 2557 HB3 GLU 28 1HB GLU 28 20.991 8.384 15.261 2558 HG2 GLU 28 2HG GLU 28 22.128 10.494 17.218 2559 HG3 GLU 28 1HG GLU 28 22.274 8.753 17.632 2560 H ALA 29 H ALA 29 19.060 9.704 13.267 2561 HA ALA 29 HA ALA 29 21.202 10.157 11.547 2562 HB1 ALA 29 1HB ALA 29 19.568 9.446 9.827 2563 HB2 ALA 29 2HB ALA 29 18.209 9.753 10.953 2564 HB3 ALA 29 3HB ALA 29 19.383 8.422 11.264 2565 H GLU 30 H GLU 30 17.964 11.857 11.749 2566 HA GLU 30 HA GLU 30 18.877 14.079 10.354 2567 HB2 GLU 30 2HB GLU 30 16.492 13.588 12.206 2568 HB3 GLU 30 1HB GLU 30 16.828 15.207 11.530 2569 HG2 GLU 30 2HG GLU 30 15.358 14.496 9.963 2570 HG3 GLU 30 1HG GLU 30 16.881 13.984 9.166 2571 H ARG 31 H ARG 31 19.878 13.177 13.450 2572 HA ARG 31 HA ARG 31 19.945 15.757 14.653 2573 HB2 ARG 31 2HB ARG 31 20.172 13.436 15.870 2574 HB3 ARG 31 1HB ARG 31 21.868 13.451 15.341 2575 HG2 ARG 31 2HG ARG 31 21.890 14.261 17.558 2576 HG3 ARG 31 1HG ARG 31 22.051 15.747 16.557 2577 HD2 ARG 31 2HD ARG 31 19.482 16.041 16.797 2578 HD3 ARG 31 1HD ARG 31 19.492 14.657 17.965 2579 HE ARG 31 HE ARG 31 21.323 16.071 19.211 2580 HH11 ARG 31 1HH2 ARG 31 18.556 17.602 17.450 2581 HH12 ARG 31 2HH2 ARG 31 18.682 19.094 18.233 2582 HH21 ARG 31 1HH1 ARG 31 21.396 18.009 20.396 2583 HH22 ARG 31 2HH1 ARG 31 20.300 19.304 20.125 2584 H GLY 32 H GLY 32 20.942 17.265 13.297 2585 HA2 GLY 32 2HA GLY 32 23.017 18.390 13.144 2586 HA3 GLY 32 1HA GLY 32 23.832 16.814 12.818 2587 H ALA 33 H ALA 33 20.752 16.860 11.291 2588 HA ALA 33 HA ALA 33 22.110 17.235 8.768 2589 HB1 ALA 33 1HB ALA 33 19.971 16.431 7.753 2590 HB2 ALA 33 2HB ALA 33 19.229 16.372 9.392 2591 HB3 ALA 33 3HB ALA 33 20.600 15.279 8.985 2592 HA PRO 34 HA PRO 34 20.298 21.333 8.691 2593 HB2 PRO 34 2HB PRO 34 20.782 22.107 6.049 2594 HB3 PRO 34 1HB PRO 34 22.095 21.945 7.282 2595 HG2 PRO 34 2HG PRO 34 21.234 19.883 5.181 2596 HG3 PRO 34 1HG PRO 34 22.916 20.440 5.568 2597 HD2 PRO 34 2HD PRO 34 21.810 18.118 6.625 2598 HD3 PRO 34 1HD PRO 34 22.955 19.144 7.597 2599 H GLY 35 H GLY 35 18.185 22.152 8.371 2600 HA2 GLY 35 2HA GLY 35 16.193 22.419 7.424 2601 HA3 GLY 35 1HA GLY 35 16.732 21.421 6.020 2602 H ALA 36 H ALA 36 17.174 19.983 9.127 2603 HA ALA 36 HA ALA 36 15.610 17.807 8.432 2604 HB1 ALA 36 1HB ALA 36 15.992 16.981 10.777 2605 HB2 ALA 36 2HB ALA 36 16.612 18.605 11.238 2606 HB3 ALA 36 3HB ALA 36 17.513 17.603 10.048 2607 H ALA 37 H ALA 37 13.631 16.984 9.229 2608 HA ALA 37 HA ALA 37 11.867 18.986 10.502 2609 HB1 ALA 37 1HB ALA 37 11.115 18.315 8.201 2610 HB2 ALA 37 2HB ALA 37 9.969 17.754 9.467 2611 HB3 ALA 37 3HB ALA 37 11.124 16.594 8.713 2612 H LEU 38 H LEU 38 13.070 15.574 10.488 2613 HA LEU 38 HA LEU 38 11.420 14.979 12.786 2614 HB2 LEU 38 2HB LEU 38 11.818 13.259 10.929 2615 HB3 LEU 38 1HB LEU 38 13.536 13.279 11.401 2616 HG LEU 38 HG LEU 38 12.930 12.475 13.704 2617 HD11 LEU 38 1HD1 LEU 38 10.604 13.254 13.990 2618 HD12 LEU 38 2HD1 LEU 38 10.617 11.458 14.011 2619 HD13 LEU 38 3HD1 LEU 38 10.076 12.321 12.529 2620 HD21 LEU 38 3HD2 LEU 38 12.417 10.144 12.947 2621 HD22 LEU 38 1HD2 LEU 38 13.647 10.974 11.909 2622 HD23 LEU 38 2HD2 LEU 38 11.970 10.795 11.317 2623 H ILE 39 H ILE 39 12.300 14.779 14.940 2624 HA ILE 39 HA ILE 39 15.020 14.989 15.461 2625 HB ILE 39 HB ILE 39 14.528 17.225 16.866 2626 HG12 ILE 39 2HG1 ILE 39 12.523 17.558 14.538 2627 HG13 ILE 39 1HG1 ILE 39 12.108 17.339 16.278 2628 HG21 ILE 39 1HG2 ILE 39 16.255 16.938 14.997 2629 HG22 ILE 39 2HG2 ILE 39 15.612 18.607 15.229 2630 HG23 ILE 39 3HG2 ILE 39 15.028 17.602 13.862 2631 HD11 ILE 39 3HD ILE 39 13.610 19.735 15.013 2632 HD12 ILE 39 1HD ILE 39 11.928 19.726 15.642 2633 HD13 ILE 39 2HD ILE 39 13.304 19.524 16.776 2634 H SER 40 H SER 40 15.020 15.303 17.945 2635 HA SER 40 HA SER 40 14.469 14.913 19.939 2636 HB2 SER 40 2HB SER 40 11.648 15.672 19.092 2637 HB3 SER 40 1HB SER 40 12.210 15.561 20.797 2638 HG SER 40 1HG SER 40 12.323 17.674 19.828 2639 H TYR 41 H TYR 41 14.310 13.202 21.308 2640 HA TYR 41 HA TYR 41 13.837 10.725 20.140 2641 HB2 TYR 41 2HB TYR 41 14.600 11.678 22.918 2642 HB3 TYR 41 1HB TYR 41 13.846 10.054 22.828 2643 HD1 TYR 41 1HD TYR 41 14.856 8.210 21.709 2644 HD2 TYR 41 2HD TYR 41 16.855 12.021 21.839 2645 HE1 TYR 41 1HE TYR 41 16.951 7.126 21.047 2646 HE2 TYR 41 2HE TYR 41 18.959 10.943 21.161 2647 HH TYR 41 HH TYR 41 20.032 8.924 20.709 2648 HA PRO 42 HA PRO 42 9.950 9.923 22.458 2649 HB2 PRO 42 2HB PRO 42 8.425 11.874 23.772 2650 HB3 PRO 42 1HB PRO 42 9.793 11.005 24.563 2651 HG2 PRO 42 2HG PRO 42 9.864 13.749 23.179 2652 HG3 PRO 42 1HG PRO 42 10.496 13.315 24.825 2653 HD2 PRO 42 2HD PRO 42 12.144 13.397 22.614 2654 HD3 PRO 42 1HD PRO 42 12.353 12.090 23.870 2655 H ASP 43 H ASP 43 10.315 12.788 20.525 2656 HA ASP 43 HA ASP 43 7.632 12.772 19.494 2657 HB2 ASP 43 2HB ASP 43 10.199 14.118 18.398 2658 HB3 ASP 43 1HB ASP 43 8.550 14.337 17.734 2659 H ALA 44 H ALA 44 10.897 11.596 18.622 2660 HA ALA 44 HA ALA 44 10.413 10.930 16.029 2661 HB1 ALA 44 1HB ALA 44 12.347 9.539 17.979 2662 HB2 ALA 44 2HB ALA 44 12.705 10.992 16.974 2663 HB3 ALA 44 3HB ALA 44 12.409 9.408 16.178 2664 H ILE 45 H ILE 45 9.790 8.980 18.946 2665 HA ILE 45 HA ILE 45 9.253 6.607 17.541 2666 HB ILE 45 HB ILE 45 9.827 6.433 19.797 2667 HG12 ILE 45 2HG1 ILE 45 6.852 5.663 19.558 2668 HG13 ILE 45 1HG1 ILE 45 8.231 4.746 18.869 2669 HG21 ILE 45 1HG2 ILE 45 8.413 7.360 21.663 2670 HG22 ILE 45 2HG2 ILE 45 7.391 8.217 20.457 2671 HG23 ILE 45 3HG2 ILE 45 9.135 8.623 20.638 2672 HD11 ILE 45 3HD ILE 45 7.727 5.285 21.876 2673 HD12 ILE 45 1HD ILE 45 7.554 3.720 21.004 2674 HD13 ILE 45 2HD ILE 45 9.184 4.460 21.201 2675 H TRP 46 H TRP 46 7.284 9.514 18.042 2676 HA TRP 46 HA TRP 46 4.816 8.169 17.381 2677 HB2 TRP 46 2HB TRP 46 5.640 10.992 18.074 2678 HB3 TRP 46 1HB TRP 46 4.255 10.837 16.976 2679 HD1 TRP 46 HD TRP 46 2.635 11.923 18.558 2680 HE1 TRP 46 1HE TRP 46 1.456 11.268 20.746 2681 HE3 TRP 46 3HE TRP 46 5.333 7.715 19.652 2682 HZ2 TRP 46 2HZ TRP 46 1.554 9.100 22.610 2683 HZ3 TRP 46 3HZ TRP 46 4.767 6.415 21.659 2684 HH2 TRP 46 HH TRP 46 2.900 7.089 23.118 2685 H TRP 47 H TRP 47 7.480 9.534 15.573 2686 HA TRP 47 HA TRP 47 5.826 9.641 13.146 2687 HB2 TRP 47 2HB TRP 47 7.600 11.388 13.515 2688 HB3 TRP 47 1HB TRP 47 8.840 10.088 13.569 2689 HD1 TRP 47 HD TRP 47 6.336 11.721 10.985 2690 HE1 TRP 47 1HE TRP 47 7.386 11.456 8.660 2691 HE3 TRP 47 3HE TRP 47 10.209 8.656 12.260 2692 HZ2 TRP 47 2HZ TRP 47 9.460 9.883 7.472 2693 HZ3 TRP 47 3HZ TRP 47 11.698 7.791 10.484 2694 HH2 TRP 47 HH TRP 47 11.326 8.400 8.120 2695 H SER 48 H SER 48 8.210 7.657 14.896 2696 HA SER 48 HA SER 48 9.005 6.110 12.779 2697 HB2 SER 48 2HB SER 48 9.914 6.236 15.262 2698 HB3 SER 48 1HB SER 48 8.820 4.839 15.562 2699 HG SER 48 1HG SER 48 10.452 3.731 14.725 2700 H VAL 49 H VAL 49 6.188 5.744 14.945 2701 HA VAL 49 HA VAL 49 5.391 3.221 14.076 2702 HB VAL 49 HB VAL 49 3.107 3.962 14.876 2703 HG11 VAL 49 1HG1 VAL 49 3.853 3.960 17.237 2704 HG12 VAL 49 2HG1 VAL 49 5.548 4.354 16.753 2705 HG13 VAL 49 3HG1 VAL 49 4.806 2.775 16.281 2706 HG21 VAL 49 3HG2 VAL 49 3.384 6.430 14.351 2707 HG22 VAL 49 1HG2 VAL 49 4.682 6.543 15.595 2708 HG23 VAL 49 2HG2 VAL 49 3.009 6.162 16.075 2709 H GLU 50 H GLU 50 5.193 6.340 12.425 2710 HA GLU 50 HA GLU 50 3.075 5.561 10.673 2711 HB2 GLU 50 2HB GLU 50 5.213 7.777 10.323 2712 HB3 GLU 50 1HB GLU 50 3.749 7.588 9.338 2713 HG2 GLU 50 2HG GLU 50 3.133 7.794 12.270 2714 HG3 GLU 50 1HG GLU 50 4.100 9.183 11.655 2715 H THR 51 H THR 51 6.665 5.832 10.517 2716 HA THR 51 HA THR 51 6.597 5.281 7.733 2717 HB THR 51 HB THR 51 8.267 6.757 8.883 2718 HG1 THR 51 1HG THR 51 9.202 4.663 7.221 2719 HG21 THR 51 3HG2 THR 51 10.334 5.712 9.805 2720 HG22 THR 51 1HG2 THR 51 9.570 4.082 9.724 2721 HG23 THR 51 2HG2 THR 51 8.884 5.346 10.796 2722 H ALA 52 H ALA 52 6.808 3.302 10.610 2723 HA ALA 52 HA ALA 52 7.785 0.961 9.286 2724 HB1 ALA 52 1HB ALA 52 6.137 1.259 11.879 2725 HB2 ALA 52 2HB ALA 52 7.938 1.198 11.783 2726 HB3 ALA 52 3HB ALA 52 6.963 -0.248 11.331 2727 H THR 53 H THR 53 4.526 2.503 9.751 2728 HA THR 53 HA THR 53 3.299 0.124 8.636 2729 HB THR 53 HB THR 53 1.170 1.431 8.924 2730 HG1 THR 53 1HG THR 53 2.005 3.521 8.965 2731 HG21 THR 53 3HG2 THR 53 2.048 -0.220 10.616 2732 HG22 THR 53 1HG2 THR 53 1.187 1.154 11.406 2733 HG23 THR 53 2HG2 THR 53 2.987 1.096 11.418 2734 H THR 54 H THR 54 4.981 2.667 7.424 2735 HA THR 54 HA THR 54 5.171 3.727 5.569 2736 HB THR 54 HB THR 54 4.962 2.543 3.461 2737 HG1 THR 54 1HG THR 54 3.020 1.484 3.933 2738 HG21 THR 54 3HG2 THR 54 5.910 0.691 5.775 2739 HG22 THR 54 1HG2 THR 54 6.842 2.093 5.143 2740 HG23 THR 54 2HG2 THR 54 6.491 0.687 4.074 2741 H VAL 55 H VAL 55 3.354 5.124 6.673 2742 HA VAL 55 HA VAL 55 1.177 5.365 4.702 2743 HB VAL 55 HB VAL 55 -0.050 6.638 6.362 2744 HG11 VAL 55 1HG1 VAL 55 0.940 3.811 7.209 2745 HG12 VAL 55 2HG1 VAL 55 -0.234 4.164 5.906 2746 HG13 VAL 55 3HG1 VAL 55 -0.646 4.539 7.615 2747 HG21 VAL 55 3HG2 VAL 55 2.305 5.881 8.254 2748 HG22 VAL 55 1HG2 VAL 55 0.684 6.374 8.809 2749 HG23 VAL 55 2HG2 VAL 55 1.667 7.540 7.913 2750 H GLY 56 H GLY 56 2.913 7.799 6.738 2751 HA2 GLY 56 2HA GLY 56 4.401 9.358 5.944 2752 HA3 GLY 56 1HA GLY 56 3.968 8.938 4.242 2753 H TYR 57 H TYR 57 2.128 9.991 7.230 2754 HA TYR 57 HA TYR 57 0.159 11.115 5.620 2755 HB2 TYR 57 2HB TYR 57 0.378 10.385 8.321 2756 HB3 TYR 57 1HB TYR 57 0.343 12.173 8.466 2757 HD1 TYR 57 1HD TYR 57 -1.616 13.371 7.091 2758 HD2 TYR 57 2HD TYR 57 -1.599 9.200 8.145 2759 HE1 TYR 57 1HE TYR 57 -4.031 13.263 6.698 2760 HE2 TYR 57 2HE TYR 57 -4.036 9.106 7.807 2761 HH TYR 57 HH TYR 57 -6.015 10.513 7.566 2762 H GLY 58 H GLY 58 3.186 12.410 6.589 2763 HA2 GLY 58 2HA GLY 58 4.013 14.189 5.413 2764 HA3 GLY 58 1HA GLY 58 2.386 14.938 5.316 2765 H ASP 59 H ASP 59 3.033 13.807 8.448 2766 HA ASP 59 HA ASP 59 3.224 16.392 9.511 2767 HB2 ASP 59 2HB ASP 59 3.727 13.618 10.730 2768 HB3 ASP 59 1HB ASP 59 4.106 15.110 11.674 2769 H ARG 60 H ARG 60 5.796 13.860 9.053 2770 HA ARG 60 HA ARG 60 7.699 16.013 9.021 2771 HB2 ARG 60 2HB ARG 60 8.094 13.629 10.929 2772 HB3 ARG 60 1HB ARG 60 9.325 14.868 10.530 2773 HG2 ARG 60 2HG ARG 60 7.903 16.639 11.602 2774 HG3 ARG 60 1HG ARG 60 6.651 15.407 11.979 2775 HD2 ARG 60 2HD ARG 60 8.360 14.152 13.397 2776 HD3 ARG 60 1HD ARG 60 9.531 15.488 13.103 2777 HE ARG 60 HE ARG 60 6.990 15.595 14.712 2778 HH11 ARG 60 1HH2 ARG 60 9.971 17.416 13.719 2779 HH12 ARG 60 2HH2 ARG 60 10.095 18.206 15.226 2780 HH21 ARG 60 1HH1 ARG 60 7.300 16.577 16.783 2781 HH22 ARG 60 2HH1 ARG 60 8.529 17.709 17.064 2782 H TYR 61 H TYR 61 9.855 14.992 8.092 2783 HA TYR 61 HA TYR 61 9.389 12.686 6.517 2784 HB2 TYR 61 2HB TYR 61 10.199 14.334 4.445 2785 HB3 TYR 61 1HB TYR 61 8.469 13.973 4.769 2786 HD1 TYR 61 2HD TYR 61 11.152 16.527 5.341 2787 HD2 TYR 61 1HD TYR 61 6.952 15.635 5.531 2788 HE1 TYR 61 2HE TYR 61 10.667 18.905 5.800 2789 HE2 TYR 61 1HE TYR 61 6.456 17.992 6.005 2790 HH TYR 61 HH TYR 61 7.320 20.147 5.998 2791 HA PRO 62 HA PRO 62 13.788 13.110 7.376 2792 HB2 PRO 62 2HB PRO 62 14.900 11.293 5.570 2793 HB3 PRO 62 1HB PRO 62 13.873 10.771 6.958 2794 HG2 PRO 62 2HG PRO 62 13.031 11.200 4.035 2795 HG3 PRO 62 1HG PRO 62 12.672 9.774 5.094 2796 HD2 PRO 62 2HD PRO 62 10.907 11.915 4.694 2797 HD3 PRO 62 1HD PRO 62 10.973 10.987 6.263 2798 H VAL 63 H VAL 63 16.088 13.478 5.832 2799 HA VAL 63 HA VAL 63 15.214 15.282 3.715 2800 HB VAL 63 HB VAL 63 15.501 16.706 5.472 2801 HG11 VAL 63 1HG1 VAL 63 16.885 15.360 7.028 2802 HG12 VAL 63 2HG1 VAL 63 17.543 17.020 6.796 2803 HG13 VAL 63 3HG1 VAL 63 18.336 15.618 6.001 2804 HG21 VAL 63 3HG2 VAL 63 17.961 16.927 3.616 2805 HG22 VAL 63 1HG2 VAL 63 17.183 18.247 4.559 2806 HG23 VAL 63 2HG2 VAL 63 16.270 17.437 3.231 2807 H THR 64 H THR 64 18.461 14.142 4.754 2808 HA THR 64 HA THR 64 18.849 12.749 2.422 2809 HB THR 64 HB THR 64 20.224 15.507 2.454 2810 HG1 THR 64 1HG THR 64 18.005 14.869 1.488 2811 HG21 THR 64 3HG2 THR 64 20.715 13.139 0.509 2812 HG22 THR 64 1HG2 THR 64 21.896 13.769 1.713 2813 HG23 THR 64 2HG2 THR 64 21.377 14.802 0.341 2814 H GLU 65 H GLU 65 20.428 14.769 4.892 2815 HA GLU 65 HA GLU 65 22.734 13.088 4.917 2816 HB2 GLU 65 2HB GLU 65 22.677 15.620 5.047 2817 HB3 GLU 65 1HB GLU 65 22.070 15.490 6.730 2818 HG2 GLU 65 2HG GLU 65 24.164 14.512 7.497 2819 HG3 GLU 65 1HG GLU 65 24.631 14.078 5.811 2820 H GLU 66 H GLU 66 19.641 12.863 6.430 2821 HA GLU 66 HA GLU 66 20.497 11.571 8.763 2822 HB2 GLU 66 2HB GLU 66 18.239 10.725 8.964 2823 HB3 GLU 66 1HB GLU 66 18.164 12.410 8.455 2824 HG2 GLU 66 2HG GLU 66 17.647 9.895 6.719 2825 HG3 GLU 66 1HG GLU 66 16.448 11.048 7.407 2826 H GLY 67 H GLY 67 20.108 10.825 5.398 2827 HA2 GLY 67 2HA GLY 67 21.069 9.129 4.226 2828 HA3 GLY 67 1HA GLY 67 21.285 8.163 5.767 2829 H ARG 68 H ARG 68 18.874 9.497 3.458 2830 HA ARG 68 HA ARG 68 16.593 8.899 4.671 2831 HB2 ARG 68 2HB ARG 68 16.838 10.150 2.555 2832 HB3 ARG 68 1HB ARG 68 17.187 8.637 1.654 2833 HG2 ARG 68 2HG ARG 68 14.891 7.808 2.051 2834 HG3 ARG 68 1HG ARG 68 14.536 9.184 3.145 2835 HD2 ARG 68 2HD ARG 68 15.126 9.435 0.104 2836 HD3 ARG 68 1HD ARG 68 13.484 9.461 0.862 2837 HE ARG 68 HE ARG 68 15.671 11.408 1.642 2838 HH11 ARG 68 1HH2 ARG 68 12.206 11.317 0.301 2839 HH12 ARG 68 2HH2 ARG 68 11.782 12.521 1.389 2840 HH21 ARG 68 1HH1 ARG 68 14.961 13.520 2.333 2841 HH22 ARG 68 2HH1 ARG 68 13.263 13.905 2.260 2842 H LYS 69 H LYS 69 18.840 6.651 3.424 2843 HA LYS 69 HA LYS 69 17.258 4.390 3.175 2844 HB2 LYS 69 2HB LYS 69 20.225 4.720 3.713 2845 HB3 LYS 69 1HB LYS 69 19.432 3.115 3.729 2846 HG2 LYS 69 2HG LYS 69 18.383 3.663 1.474 2847 HG3 LYS 69 1HG LYS 69 19.514 5.044 1.334 2848 HD2 LYS 69 2HD LYS 69 21.442 3.529 1.373 2849 HD3 LYS 69 1HD LYS 69 20.433 2.137 1.885 2850 HE2 LYS 69 2HE LYS 69 20.123 3.559 -0.849 2851 HE3 LYS 69 1HE LYS 69 21.131 2.087 -0.562 2852 HZ1 LYS 69 3HZ LYS 69 19.098 0.897 0.100 2853 HZ2 LYS 69 1HZ LYS 69 19.016 1.541 -1.459 2854 HZ3 LYS 69 2HZ LYS 69 18.141 2.249 -0.183 2855 H VAL 70 H VAL 70 18.058 6.127 6.121 2856 HA VAL 70 HA VAL 70 17.725 3.934 7.883 2857 HB VAL 70 HB VAL 70 17.349 6.953 8.251 2858 HG11 VAL 70 1HG1 VAL 70 17.486 6.421 10.726 2859 HG12 VAL 70 2HG1 VAL 70 17.312 4.664 10.340 2860 HG13 VAL 70 3HG1 VAL 70 15.972 5.819 9.980 2861 HG21 VAL 70 3HG2 VAL 70 19.613 4.993 9.067 2862 HG22 VAL 70 1HG2 VAL 70 19.557 6.769 9.401 2863 HG23 VAL 70 2HG2 VAL 70 19.698 6.179 7.715 2864 H ALA 71 H ALA 71 15.501 6.391 6.481 2865 HA ALA 71 HA ALA 71 13.202 5.391 7.802 2866 HB1 ALA 71 1HB ALA 71 11.907 6.782 6.192 2867 HB2 ALA 71 2HB ALA 71 13.390 7.027 5.187 2868 HB3 ALA 71 3HB ALA 71 13.293 7.722 6.847 2869 H GLU 72 H GLU 72 14.644 4.928 4.568 2870 HA GLU 72 HA GLU 72 12.811 3.286 3.366 2871 HB2 GLU 72 2HB GLU 72 15.004 4.234 2.372 2872 HB3 GLU 72 1HB GLU 72 15.857 2.979 3.327 2873 HG2 GLU 72 2HG GLU 72 14.400 1.249 1.891 2874 HG3 GLU 72 1HG GLU 72 14.168 2.661 0.796 2875 H GLN 73 H GLN 73 15.475 2.340 5.601 2876 HA GLN 73 HA GLN 73 15.323 -0.397 5.219 2877 HB2 GLN 73 2HB GLN 73 17.226 0.712 6.434 2878 HB3 GLN 73 1HB GLN 73 16.124 1.139 7.777 2879 HG2 GLN 73 2HG GLN 73 15.793 -1.340 8.263 2880 HG3 GLN 73 1HG GLN 73 16.932 -1.729 6.919 2881 HE21 GLN 73 1HE2 GLN 73 17.514 -2.603 9.577 2882 HE22 GLN 73 2HE2 GLN 73 18.839 -1.674 10.184 2883 H VAL 74 H VAL 74 13.651 1.702 7.633 2884 HA VAL 74 HA VAL 74 12.509 -0.580 8.910 2885 HB VAL 74 HB VAL 74 13.029 1.267 10.260 2886 HG11 VAL 74 1HG1 VAL 74 12.904 3.145 8.705 2887 HG12 VAL 74 2HG1 VAL 74 11.807 3.466 10.082 2888 HG13 VAL 74 3HG1 VAL 74 11.122 2.941 8.505 2889 HG21 VAL 74 3HG2 VAL 74 10.866 1.568 11.463 2890 HG22 VAL 74 1HG2 VAL 74 11.066 -0.140 10.916 2891 HG23 VAL 74 2HG2 VAL 74 9.955 0.975 10.037 2892 H MET 75 H MET 75 11.448 1.685 6.353 2893 HA MET 75 HA MET 75 8.761 0.981 6.263 2894 HB2 MET 75 2HB MET 75 10.668 1.498 3.884 2895 HB3 MET 75 1HB MET 75 8.884 1.383 3.736 2896 HG2 MET 75 2HG MET 75 8.552 3.420 5.025 2897 HG3 MET 75 1HG MET 75 10.280 3.517 5.425 2898 HE1 MET 75 3HE MET 75 9.729 5.943 4.715 2899 HE2 MET 75 1HE MET 75 10.306 6.518 3.111 2900 HE3 MET 75 2HE MET 75 11.421 5.640 4.206 2901 H LYS 76 H LYS 76 11.571 -0.515 4.608 2902 HA LYS 76 HA LYS 76 9.978 -2.329 3.193 2903 HB2 LYS 76 2HB LYS 76 12.410 -1.403 2.800 2904 HB3 LYS 76 1HB LYS 76 12.955 -2.820 3.735 2905 HG2 LYS 76 2HG LYS 76 11.070 -3.092 1.296 2906 HG3 LYS 76 1HG LYS 76 12.824 -2.778 1.080 2907 HD2 LYS 76 2HD LYS 76 13.384 -4.826 2.381 2908 HD3 LYS 76 1HD LYS 76 11.639 -5.246 2.490 2909 HE2 LYS 76 2HE LYS 76 11.479 -5.505 0.029 2910 HE3 LYS 76 1HE LYS 76 13.146 -4.836 -0.197 2911 HZ1 LYS 76 3HZ LYS 76 13.153 -7.251 -0.373 2912 HZ2 LYS 76 1HZ LYS 76 12.469 -7.395 1.199 2913 HZ3 LYS 76 2HZ LYS 76 14.012 -6.753 1.002 2914 H ALA 77 H ALA 77 11.404 -2.454 6.401 2915 HA ALA 77 HA ALA 77 11.149 -5.286 6.707 2916 HB1 ALA 77 1HB ALA 77 12.727 -3.933 8.138 2917 HB2 ALA 77 2HB ALA 77 11.547 -4.891 9.096 2918 HB3 ALA 77 3HB ALA 77 11.303 -3.110 8.883 2919 H GLY 78 H GLY 78 9.103 -2.414 7.422 2920 HA2 GLY 78 2HA GLY 78 7.077 -3.763 8.814 2921 HA3 GLY 78 1HA GLY 78 6.961 -2.209 7.898 2922 H ILE 79 H ILE 79 7.430 -2.969 5.344 2923 HA ILE 79 HA ILE 79 5.003 -4.023 4.538 2924 HB ILE 79 HB ILE 79 7.652 -3.803 3.034 2925 HG12 ILE 79 2HG1 ILE 79 5.119 -2.024 3.012 2926 HG13 ILE 79 1HG1 ILE 79 6.579 -1.658 3.961 2927 HG21 ILE 79 1HG2 ILE 79 6.246 -3.960 0.927 2928 HG22 ILE 79 2HG2 ILE 79 4.801 -4.325 1.935 2929 HG23 ILE 79 3HG2 ILE 79 6.183 -5.478 1.867 2930 HD11 ILE 79 3HD ILE 79 6.430 -1.813 0.877 2931 HD12 ILE 79 1HD ILE 79 6.597 -0.342 1.889 2932 HD13 ILE 79 2HD ILE 79 7.943 -1.543 1.828 2933 H GLU 80 H GLU 80 8.210 -5.684 4.891 2934 HA GLU 80 HA GLU 80 7.232 -8.107 3.834 2935 HB2 GLU 80 2HB GLU 80 9.655 -7.590 5.640 2936 HB3 GLU 80 1HB GLU 80 9.211 -9.202 4.988 2937 HG2 GLU 80 2HG GLU 80 9.294 -8.238 2.631 2938 HG3 GLU 80 1HG GLU 80 9.962 -6.720 3.324 2939 H VAL 81 H VAL 81 7.059 -6.769 7.131 2940 HA VAL 81 HA VAL 81 6.394 -9.223 8.378 2941 HB VAL 81 HB VAL 81 6.001 -6.289 9.102 2942 HG11 VAL 81 1HG1 VAL 81 5.251 -7.139 11.406 2943 HG12 VAL 81 2HG1 VAL 81 4.998 -8.754 10.668 2944 HG13 VAL 81 3HG1 VAL 81 4.028 -7.339 10.114 2945 HG21 VAL 81 3HG2 VAL 81 7.717 -6.866 10.816 2946 HG22 VAL 81 1HG2 VAL 81 8.308 -7.373 9.199 2947 HG23 VAL 81 2HG2 VAL 81 7.656 -8.599 10.345 2948 H PHE 82 H PHE 82 4.345 -6.501 7.127 2949 HA PHE 82 HA PHE 82 1.965 -7.884 7.766 2950 HB2 PHE 82 2HB PHE 82 2.405 -5.588 5.747 2951 HB3 PHE 82 1HB PHE 82 0.792 -6.171 6.313 2952 HD1 PHE 82 1HD PHE 82 0.727 -6.438 9.068 2953 HD2 PHE 82 2HD PHE 82 3.126 -3.648 6.832 2954 HE1 PHE 82 1HE PHE 82 0.881 -4.975 11.047 2955 HE2 PHE 82 2HE PHE 82 3.276 -2.193 8.801 2956 HZ PHE 82 HZ PHE 82 2.150 -2.838 10.925 2957 H ALA 83 H ALA 83 3.969 -7.758 4.812 2958 HA ALA 83 HA ALA 83 2.147 -9.151 3.190 2959 HB1 ALA 83 1HB ALA 83 5.228 -9.133 3.034 2960 HB2 ALA 83 2HB ALA 83 4.137 -7.930 2.255 2961 HB3 ALA 83 3HB ALA 83 4.102 -9.646 1.717 2962 H LEU 84 H LEU 84 4.567 -10.281 5.587 2963 HA LEU 84 HA LEU 84 4.639 -12.948 4.741 2964 HB2 LEU 84 2HB LEU 84 6.323 -11.914 6.230 2965 HB3 LEU 84 1HB LEU 84 5.130 -11.794 7.554 2966 HG LEU 84 HG LEU 84 5.605 -14.543 6.352 2967 HD11 LEU 84 1HD1 LEU 84 7.712 -14.900 7.637 2968 HD12 LEU 84 2HD1 LEU 84 7.731 -13.159 8.109 2969 HD13 LEU 84 3HD1 LEU 84 7.909 -13.628 6.375 2970 HD21 LEU 84 3HD2 LEU 84 5.492 -15.287 8.733 2971 HD22 LEU 84 1HD2 LEU 84 4.066 -14.275 8.330 2972 HD23 LEU 84 2HD2 LEU 84 5.421 -13.574 9.285 2973 H VAL 85 H VAL 85 2.320 -11.158 6.689 2974 HA VAL 85 HA VAL 85 1.008 -13.309 7.895 2975 HB VAL 85 HB VAL 85 -0.042 -10.555 7.071 2976 HG11 VAL 85 1HG1 VAL 85 -2.014 -11.892 7.541 2977 HG12 VAL 85 2HG1 VAL 85 -1.688 -10.900 8.996 2978 HG13 VAL 85 3HG1 VAL 85 -1.252 -12.653 8.983 2979 HG21 VAL 85 3HG2 VAL 85 1.948 -10.419 8.566 2980 HG22 VAL 85 1HG2 VAL 85 1.228 -11.616 9.696 2981 HG23 VAL 85 2HG2 VAL 85 0.478 -9.991 9.485 2982 H THR 86 H THR 86 1.276 -12.636 4.537 2983 HA THR 86 HA THR 86 -1.196 -13.468 3.612 2984 HB THR 86 HB THR 86 1.526 -13.860 2.307 2985 HG1 THR 86 1HG THR 86 1.262 -11.770 2.568 2986 HG21 THR 86 3HG2 THR 86 -1.347 -13.826 1.122 2987 HG22 THR 86 1HG2 THR 86 -0.213 -15.233 1.120 2988 HG23 THR 86 2HG2 THR 86 0.172 -13.770 0.158 2989 H ALA 87 H ALA 87 1.296 -15.370 5.207 2990 HA ALA 87 HA ALA 87 0.516 -17.917 4.333 2991 HB1 ALA 87 1HB ALA 87 2.533 -17.557 5.789 2992 HB2 ALA 87 2HB ALA 87 1.411 -18.751 6.527 2993 HB3 ALA 87 3HB ALA 87 1.461 -17.064 7.147 2994 H ALA 88 H ALA 88 -1.064 -15.578 6.482 2995 HA ALA 88 HA ALA 88 -3.006 -17.519 7.416 2996 HB1 ALA 88 1HB ALA 88 -2.982 -14.441 7.677 2997 HB2 ALA 88 2HB ALA 88 -2.374 -15.587 8.921 2998 HB3 ALA 88 3HB ALA 88 -4.123 -15.561 8.490 2999 H LEU 89 H LEU 89 -2.772 -14.749 5.156 3000 HA LEU 89 HA LEU 89 -5.484 -14.638 4.640 3001 HB2 LEU 89 2HB LEU 89 -3.272 -13.696 2.734 3002 HB3 LEU 89 1HB LEU 89 -4.976 -13.140 2.767 3003 HG LEU 89 HG LEU 89 -2.886 -12.709 4.996 3004 HD11 LEU 89 1HD1 LEU 89 -4.075 -10.696 2.988 3005 HD12 LEU 89 2HD1 LEU 89 -2.414 -11.395 2.929 3006 HD13 LEU 89 3HD1 LEU 89 -2.895 -10.346 4.304 3007 HD21 LEU 89 3HD2 LEU 89 -5.121 -12.843 6.036 3008 HD22 LEU 89 1HD2 LEU 89 -5.797 -11.706 4.812 3009 HD23 LEU 89 2HD2 LEU 89 -4.571 -11.135 5.998 3010 H ALA 90 H ALA 90 -2.921 -16.239 2.669 3011 HA ALA 90 HA ALA 90 -4.845 -17.020 0.677 3012 HB1 ALA 90 1HB ALA 90 -1.965 -17.981 1.177 3013 HB2 ALA 90 2HB ALA 90 -2.455 -16.664 0.051 3014 HB3 ALA 90 3HB ALA 90 -2.961 -18.361 -0.282 3015 H THR 91 H THR 91 -4.170 -18.146 3.871 3016 HA THR 91 HA THR 91 -4.845 -20.902 3.290 3017 HB THR 91 HB THR 91 -4.984 -19.472 6.000 3018 HG1 THR 91 1HG THR 91 -2.823 -19.676 5.406 3019 HG21 THR 91 3HG2 THR 91 -4.932 -21.928 6.853 3020 HG22 THR 91 1HG2 THR 91 -5.165 -22.455 5.151 3021 HG23 THR 91 2HG2 THR 91 -6.435 -21.494 5.999 3022 H ASP 92 H ASP 92 -6.485 -17.814 4.263 3023 HA ASP 92 HA ASP 92 -8.554 -19.442 5.353 3024 HB2 ASP 92 2HB ASP 92 -8.116 -16.454 5.407 3025 HB3 ASP 92 1HB ASP 92 -9.659 -17.199 5.953 3026 H PHE 93 H PHE 93 -8.122 -19.006 2.255 3027 HA PHE 93 HA PHE 93 -11.020 -19.168 1.816 3028 HB2 PHE 93 2HB PHE 93 -10.769 -19.159 -0.498 3029 HB3 PHE 93 1HB PHE 93 -9.857 -17.768 0.162 3030 HD1 PHE 93 1HD PHE 93 -7.311 -17.840 0.137 3031 HD2 PHE 93 2HD PHE 93 -9.731 -20.815 -1.803 3032 HE1 PHE 93 1HE PHE 93 -5.378 -18.530 -1.243 3033 HE2 PHE 93 2HE PHE 93 -7.776 -21.514 -3.157 3034 HZ PHE 93 HZ PHE 93 -5.610 -20.344 -2.906 3035 H VAL 94 H VAL 94 -7.970 -21.154 1.789 3036 HA VAL 94 HA VAL 94 -9.179 -23.213 0.330 3037 HB VAL 94 HB VAL 94 -7.374 -24.674 0.826 3038 HG11 VAL 94 1HG1 VAL 94 -7.113 -22.878 -0.904 3039 HG12 VAL 94 2HG1 VAL 94 -5.541 -23.292 -0.138 3040 HG13 VAL 94 3HG1 VAL 94 -6.386 -21.776 0.324 3041 HG21 VAL 94 3HG2 VAL 94 -5.561 -24.218 2.357 3042 HG22 VAL 94 1HG2 VAL 94 -7.060 -24.047 3.316 3043 HG23 VAL 94 2HG2 VAL 94 -6.175 -22.584 2.744 3044 H ARG 95 H ARG 95 -9.389 -22.319 3.643 3045 HA ARG 95 HA ARG 95 -10.312 -24.655 4.826 3046 HB2 ARG 95 2HB ARG 95 -11.220 -21.742 5.268 3047 HB3 ARG 95 1HB ARG 95 -11.956 -23.118 6.142 3048 HG2 ARG 95 2HG ARG 95 -9.631 -23.784 6.953 3049 HG3 ARG 95 1HG ARG 95 -9.098 -22.131 6.456 3050 HD2 ARG 95 2HD ARG 95 -10.892 -21.136 7.949 3051 HD3 ARG 95 1HD ARG 95 -11.472 -22.784 8.385 3052 HE ARG 95 HE ARG 95 -9.031 -21.369 9.318 3053 HH11 ARG 95 1HH2 ARG 95 -11.131 -24.359 9.728 3054 HH12 ARG 95 2HH2 ARG 95 -10.010 -25.120 10.694 3055 HH21 ARG 95 1HH1 ARG 95 -7.832 -22.366 11.066 3056 HH22 ARG 95 2HH1 ARG 95 -8.155 -24.009 11.539 3057 H ARG 96 H ARG 96 -11.863 -22.753 2.268 3058 HA ARG 96 HA ARG 96 -14.519 -23.308 2.660 3059 HB2 ARG 96 2HB ARG 96 -14.835 -23.135 0.203 3060 HB3 ARG 96 1HB ARG 96 -13.686 -21.873 0.759 3061 HG2 ARG 96 2HG ARG 96 -11.759 -23.111 -0.146 3062 HG3 ARG 96 1HG ARG 96 -12.725 -24.547 -0.458 3063 HD2 ARG 96 2HD ARG 96 -13.228 -21.872 -1.910 3064 HD3 ARG 96 1HD ARG 96 -12.147 -23.173 -2.532 3065 HE ARG 96 HE ARG 96 -15.088 -23.168 -2.505 3066 HH11 ARG 96 1HH2 ARG 96 -12.188 -25.336 -2.448 3067 HH12 ARG 96 2HH2 ARG 96 -13.011 -26.755 -2.753 3068 HH21 ARG 96 1HH1 ARG 96 -16.208 -25.105 -3.344 3069 HH22 ARG 96 2HH1 ARG 96 -15.306 -26.475 -3.792 3070 H GLU 97 H GLU 97 -11.999 -25.536 1.944 3071 HA GLU 97 HA GLU 97 -13.648 -27.371 0.531 3072 HB2 GLU 97 2HB GLU 97 -11.159 -27.059 0.108 3073 HB3 GLU 97 1HB GLU 97 -10.871 -27.936 1.646 3074 HG2 GLU 97 2HG GLU 97 -10.686 -29.428 -0.374 3075 HG3 GLU 97 1HG GLU 97 -12.028 -29.936 0.714 3076 H GLU 98 H GLU 98 -12.331 -27.044 3.886 3077 HA GLU 98 HA GLU 98 -14.110 -29.267 4.617 3078 HB2 GLU 98 2HB GLU 98 -11.562 -28.420 6.014 3079 HB3 GLU 98 1HB GLU 98 -12.834 -29.383 6.830 3080 HG2 GLU 98 2HG GLU 98 -11.483 -30.291 4.223 3081 HG3 GLU 98 1HG GLU 98 -10.970 -30.796 5.875 3082 H GLU 99 H GLU 99 -14.101 -28.224 7.446 3083 HA GLU 99 HA GLU 99 -15.561 -27.262 8.655 3084 HB2 GLU 99 2HB GLU 99 -15.869 -24.865 6.803 3085 HB3 GLU 99 1HB GLU 99 -15.972 -24.941 8.591 3086 HG2 GLU 99 2HG GLU 99 -13.413 -25.221 6.855 3087 HG3 GLU 99 1HG GLU 99 -13.969 -23.752 7.712 3088 H ARG 100 H ARG 100 -16.460 -26.486 5.398 3089 HA ARG 100 HA ARG 100 -19.215 -26.354 5.482 3090 HB2 ARG 100 2HB ARG 100 -17.775 -25.298 3.810 3091 HB3 ARG 100 1HB ARG 100 -17.068 -26.861 3.330 3092 HG2 ARG 100 2HG ARG 100 -20.065 -26.539 2.933 3093 HG3 ARG 100 1HG ARG 100 -19.021 -25.471 1.953 3094 HD2 ARG 100 2HD ARG 100 -18.828 -28.563 1.992 3095 HD3 ARG 100 1HD ARG 100 -19.563 -27.535 0.687 3096 HE ARG 100 HE ARG 100 -16.873 -26.615 1.205 3097 HH11 ARG 100 1HH2 ARG 100 -18.505 -29.579 -0.137 3098 HH12 ARG 100 2HH2 ARG 100 -17.386 -29.743 -1.411 3099 HH21 ARG 100 1HH1 ARG 100 -15.232 -27.098 -0.307 3100 HH22 ARG 100 2HH1 ARG 100 -15.120 -28.616 -1.057 3101 H ARG 101 H ARG 101 -17.014 -29.101 4.918 3102 HA ARG 101 HA ARG 101 -19.148 -30.860 4.087 3103 HB2 ARG 101 2HB ARG 101 -16.285 -31.415 5.049 3104 HB3 ARG 101 1HB ARG 101 -17.385 -32.652 4.341 3105 HG2 ARG 101 2HG ARG 101 -17.239 -31.732 2.157 3106 HG3 ARG 101 1HG ARG 101 -16.589 -30.152 2.736 3107 HD2 ARG 101 2HD ARG 101 -14.484 -31.105 3.411 3108 HD3 ARG 101 1HD ARG 101 -15.057 -32.800 3.143 3109 HE ARG 101 HE ARG 101 -14.924 -30.898 0.827 3110 HH11 ARG 101 1HH2 ARG 101 -12.835 -32.921 2.894 3111 HH12 ARG 101 2HH2 ARG 101 -11.939 -33.611 1.630 3112 HH21 ARG 101 1HH1 ARG 101 -13.402 -31.411 -0.829 3113 HH22 ARG 101 2HH1 ARG 101 -12.254 -32.678 -0.636 3114 H GLY 102 H GLY 102 -17.883 -29.723 7.158 3115 HA2 GLY 102 2HA GLY 102 -18.668 -30.102 9.169 3116 HA3 GLY 102 1HA GLY 102 -19.723 -31.414 8.540 3117 H HIS 103 H HIS 103 -16.308 -31.673 7.780 3118 HA HIS 103 HA HIS 103 -16.200 -33.976 9.581 3119 HB2 HIS 103 2HB HIS 103 -13.973 -32.979 7.728 3120 HB3 HIS 103 1HB HIS 103 -14.013 -34.527 8.627 3121 HD1 HIS 103 1HD HIS 103 -16.226 -36.152 7.829 3122 HD2 HIS 103 2HD HIS 103 -14.774 -33.227 5.162 3123 HE1 HIS 103 1HE HIS 103 -17.153 -36.697 5.544 3124 HE2 HIS 103 2HE HIS 103 -16.224 -34.954 3.934 Start of MODEL 20 1 H1 SER 1 H SER 1 -21.063 -13.854 -3.281 2 HA SER 1 HA SER 1 -23.799 -14.485 -2.452 3 HB2 SER 1 2HB SER 1 -23.484 -14.595 -4.942 4 HB3 SER 1 1HB SER 1 -22.024 -15.616 -4.721 5 HG SER 1 1HG SER 1 -23.180 -17.264 -4.551 6 H ALA 2 H ALA 2 -20.410 -15.679 -2.893 7 HA ALA 2 HA ALA 2 -21.032 -17.969 -1.244 8 HB1 ALA 2 1HB ALA 2 -19.481 -18.218 -3.197 9 HB2 ALA 2 2HB ALA 2 -18.714 -18.723 -1.649 10 HB3 ALA 2 3HB ALA 2 -18.309 -17.124 -2.386 11 H ASP 3 H ASP 3 -19.578 -18.575 0.545 12 HA ASP 3 HA ASP 3 -19.636 -17.076 2.741 13 HB2 ASP 3 2HB ASP 3 -17.380 -18.453 3.398 14 HB3 ASP 3 1HB ASP 3 -18.981 -19.222 3.259 15 H HIS 4 H HIS 4 -16.655 -17.440 0.923 16 HA HIS 4 HA HIS 4 -15.243 -15.429 2.221 17 HB2 HIS 4 2HB HIS 4 -13.608 -15.563 0.352 18 HB3 HIS 4 1HB HIS 4 -14.125 -17.173 0.918 19 HD1 HIS 4 1HD HIS 4 -14.337 -14.921 -2.155 20 HD2 HIS 4 2HD HIS 4 -15.686 -18.721 -0.939 21 HE1 HIS 4 1HE HIS 4 -14.995 -16.129 -4.211 22 HE2 HIS 4 2HE HIS 4 -15.878 -18.382 -3.492 23 H GLU 5 H GLU 5 -17.665 -14.987 -0.267 24 HA GLU 5 HA GLU 5 -16.581 -12.463 -1.202 25 HB2 GLU 5 2HB GLU 5 -19.259 -13.867 -1.801 26 HB3 GLU 5 1HB GLU 5 -18.597 -12.455 -2.683 27 HG2 GLU 5 2HG GLU 5 -16.752 -13.784 -3.600 28 HG3 GLU 5 1HG GLU 5 -17.155 -15.180 -2.530 29 H ARG 6 H ARG 6 -19.305 -13.824 0.715 30 HA ARG 6 HA ARG 6 -20.510 -11.394 1.425 31 HB2 ARG 6 2HB ARG 6 -20.300 -13.980 3.102 32 HB3 ARG 6 1HB ARG 6 -21.429 -12.622 3.443 33 HG2 ARG 6 2HG ARG 6 -22.693 -13.083 1.379 34 HG3 ARG 6 1HG ARG 6 -21.494 -14.323 0.894 35 HD2 ARG 6 2HD ARG 6 -22.063 -15.523 3.181 36 HD3 ARG 6 1HD ARG 6 -23.511 -14.426 3.238 37 HE ARG 6 HE ARG 6 -23.166 -15.793 0.647 38 HH11 ARG 6 1HH2 ARG 6 -24.311 -16.435 4.031 39 HH12 ARG 6 2HH2 ARG 6 -25.340 -17.713 3.583 40 HH21 ARG 6 1HH1 ARG 6 -24.447 -17.562 0.063 41 HH22 ARG 6 2HH1 ARG 6 -25.317 -18.500 1.214 42 H GLU 7 H GLU 7 -17.877 -13.305 2.946 43 HA GLU 7 HA GLU 7 -17.798 -11.744 5.265 44 HB2 GLU 7 2HB GLU 7 -16.963 -14.107 4.963 45 HB3 GLU 7 1HB GLU 7 -15.503 -13.454 4.155 46 HG2 GLU 7 2HG GLU 7 -14.728 -12.410 6.200 47 HG3 GLU 7 1HG GLU 7 -16.364 -12.470 6.948 48 H ALA 8 H ALA 8 -16.281 -11.355 2.087 49 HA ALA 8 HA ALA 8 -14.439 -9.353 2.862 50 HB1 ALA 8 1HB ALA 8 -14.386 -8.738 0.437 51 HB2 ALA 8 2HB ALA 8 -15.819 -9.783 0.132 52 HB3 ALA 8 3HB ALA 8 -14.259 -10.525 0.646 53 H GLN 9 H GLN 9 -17.876 -9.301 1.813 54 HA GLN 9 HA GLN 9 -18.099 -6.506 1.636 55 HB2 GLN 9 2HB GLN 9 -20.325 -8.456 2.524 56 HB3 GLN 9 1HB GLN 9 -20.545 -6.757 1.991 57 HG2 GLN 9 2HG GLN 9 -19.667 -7.431 -0.320 58 HG3 GLN 9 1HG GLN 9 -19.638 -9.142 0.248 59 HE21 GLN 9 1HE2 GLN 9 -21.685 -6.476 -0.798 60 HE22 GLN 9 2HE2 GLN 9 -23.221 -7.254 -0.576 61 H LYS 10 H LYS 10 -18.605 -8.791 4.298 62 HA LYS 10 HA LYS 10 -19.660 -7.146 6.230 63 HB2 LYS 10 2HB LYS 10 -19.375 -9.696 6.329 64 HB3 LYS 10 1HB LYS 10 -17.626 -9.441 6.615 65 HG2 LYS 10 2HG LYS 10 -18.265 -8.161 8.765 66 HG3 LYS 10 1HG LYS 10 -19.949 -8.723 8.491 67 HD2 LYS 10 2HD LYS 10 -19.063 -11.125 8.497 68 HD3 LYS 10 1HD LYS 10 -17.425 -10.476 8.863 69 HE2 LYS 10 2HE LYS 10 -18.354 -9.462 11.024 70 HE3 LYS 10 1HE LYS 10 -19.956 -10.197 10.629 71 HZ1 LYS 10 3HZ LYS 10 -19.141 -11.744 11.964 72 HZ2 LYS 10 1HZ LYS 10 -17.499 -11.461 11.612 73 HZ3 LYS 10 2HZ LYS 10 -18.438 -12.378 10.540 74 H ALA 11 H ALA 11 -16.263 -7.758 5.362 75 HA ALA 11 HA ALA 11 -15.068 -6.369 7.458 76 HB1 ALA 11 1HB ALA 11 -13.912 -8.024 5.909 77 HB2 ALA 11 2HB ALA 11 -13.011 -6.488 6.092 78 HB3 ALA 11 3HB ALA 11 -13.974 -6.792 4.601 79 H GLU 12 H GLU 12 -16.029 -5.300 4.146 80 HA GLU 12 HA GLU 12 -14.973 -2.714 4.419 81 HB2 GLU 12 2HB GLU 12 -17.239 -3.655 2.573 82 HB3 GLU 12 1HB GLU 12 -16.432 -2.056 2.493 83 HG2 GLU 12 2HG GLU 12 -14.214 -3.231 2.055 84 HG3 GLU 12 1HG GLU 12 -15.104 -4.790 1.930 85 H GLU 13 H GLU 13 -18.170 -4.073 5.341 86 HA GLU 13 HA GLU 13 -19.258 -1.504 5.904 87 HB2 GLU 13 2HB GLU 13 -20.259 -4.257 6.809 88 HB3 GLU 13 1HB GLU 13 -21.150 -2.703 6.972 89 HG2 GLU 13 2HG GLU 13 -21.037 -2.428 4.434 90 HG3 GLU 13 1HG GLU 13 -20.321 -4.071 4.331 91 H GLU 14 H GLU 14 -17.283 -3.759 7.777 92 HA GLU 14 HA GLU 14 -17.913 -2.576 10.293 93 HB2 GLU 14 2HB GLU 14 -17.015 -4.954 9.987 94 HB3 GLU 14 1HB GLU 14 -15.437 -4.225 9.557 95 HG2 GLU 14 2HG GLU 14 -15.218 -4.893 11.824 96 HG3 GLU 14 1HG GLU 14 -15.453 -3.115 11.913 97 H LEU 15 H LEU 15 -15.469 -2.054 7.749 98 HA LEU 15 HA LEU 15 -13.758 -0.373 9.074 99 HB2 LEU 15 2HB LEU 15 -13.494 -1.269 6.710 100 HB3 LEU 15 1HB LEU 15 -14.686 -0.076 6.144 101 HG LEU 15 HG LEU 15 -13.195 1.804 6.846 102 HD11 LEU 15 1HD1 LEU 15 -10.787 1.315 7.485 103 HD12 LEU 15 2HD1 LEU 15 -11.228 -0.414 7.707 104 HD13 LEU 15 3HD1 LEU 15 -11.971 0.858 8.745 105 HD21 LEU 15 3HD2 LEU 15 -11.764 -0.225 5.015 106 HD22 LEU 15 1HD2 LEU 15 -11.486 1.542 5.076 107 HD23 LEU 15 2HD2 LEU 15 -13.074 0.905 4.523 108 H GLN 16 H GLN 16 -16.798 0.395 7.449 109 HA GLN 16 HA GLN 16 -16.748 3.174 7.557 110 HB2 GLN 16 2HB GLN 16 -19.137 1.251 7.862 111 HB3 GLN 16 1HB GLN 16 -19.287 2.986 7.458 112 HG2 GLN 16 2HG GLN 16 -17.795 0.932 5.659 113 HG3 GLN 16 1HG GLN 16 -19.533 1.345 5.514 114 HE21 GLN 16 1HE2 GLN 16 -16.224 2.558 4.939 115 HE22 GLN 16 2HE2 GLN 16 -16.719 4.043 4.176 116 H LYS 17 H LYS 17 -17.520 0.783 10.087 117 HA LYS 17 HA LYS 17 -18.919 2.682 11.706 118 HB2 LYS 17 2HB LYS 17 -19.316 0.163 11.735 119 HB3 LYS 17 1HB LYS 17 -17.720 -0.021 12.531 120 HG2 LYS 17 2HG LYS 17 -18.598 1.447 14.457 121 HG3 LYS 17 1HG LYS 17 -20.157 1.578 13.576 122 HD2 LYS 17 2HD LYS 17 -20.512 -0.131 15.208 123 HD3 LYS 17 1HD LYS 17 -20.316 -0.955 13.624 124 HE2 LYS 17 2HE LYS 17 -17.664 -1.000 14.557 125 HE3 LYS 17 1HE LYS 17 -18.557 -0.998 16.126 126 HZ1 LYS 17 3HZ LYS 17 -18.582 -2.948 13.899 127 HZ2 LYS 17 1HZ LYS 17 -19.916 -2.889 14.936 128 HZ3 LYS 17 2HZ LYS 17 -18.371 -3.251 15.538 129 H VAL 18 H VAL 18 -15.602 1.422 11.415 130 HA VAL 18 HA VAL 18 -14.604 2.485 13.808 131 HB VAL 18 HB VAL 18 -13.105 1.978 11.178 132 HG11 VAL 18 1HG1 VAL 18 -11.118 1.680 12.711 133 HG12 VAL 18 2HG1 VAL 18 -12.126 2.185 14.115 134 HG13 VAL 18 3HG1 VAL 18 -11.762 3.354 12.788 135 HG21 VAL 18 3HG2 VAL 18 -12.573 -0.259 12.254 136 HG22 VAL 18 1HG2 VAL 18 -14.320 -0.082 11.905 137 HG23 VAL 18 2HG2 VAL 18 -13.716 0.125 13.590 138 H LEU 19 H LEU 19 -15.194 3.865 10.571 139 HA LEU 19 HA LEU 19 -13.729 6.184 10.859 140 HB2 LEU 19 2HB LEU 19 -16.449 6.036 9.433 141 HB3 LEU 19 1HB LEU 19 -15.168 7.264 9.184 142 HG LEU 19 HG LEU 19 -15.038 4.281 8.463 143 HD11 LEU 19 1HD1 LEU 19 -16.488 5.648 6.961 144 HD12 LEU 19 2HD1 LEU 19 -14.993 5.105 6.110 145 HD13 LEU 19 3HD1 LEU 19 -15.131 6.804 6.689 146 HD21 LEU 19 3HD2 LEU 19 -12.875 6.444 8.095 147 HD22 LEU 19 1HD2 LEU 19 -12.870 4.817 7.327 148 HD23 LEU 19 2HD2 LEU 19 -12.760 4.962 9.112 149 H GLU 20 H GLU 20 -17.095 5.469 11.956 150 HA GLU 20 HA GLU 20 -17.583 8.153 12.760 151 HB2 GLU 20 2HB GLU 20 -19.035 5.601 13.692 152 HB3 GLU 20 1HB GLU 20 -19.453 7.275 14.171 153 HG2 GLU 20 2HG GLU 20 -19.706 7.738 11.569 154 HG3 GLU 20 1HG GLU 20 -19.821 5.944 11.444 155 H GLU 21 H GLU 21 -16.425 5.196 14.510 156 HA GLU 21 HA GLU 21 -16.418 6.480 17.032 157 HB2 GLU 21 2HB GLU 21 -14.625 4.135 16.123 158 HB3 GLU 21 1HB GLU 21 -14.863 4.701 17.810 159 HG2 GLU 21 2HG GLU 21 -17.376 4.132 17.532 160 HG3 GLU 21 1HG GLU 21 -16.928 3.323 15.984 161 H ALA 22 H ALA 22 -13.978 6.098 14.456 162 HA ALA 22 HA ALA 22 -11.820 7.206 15.817 163 HB1 ALA 22 1HB ALA 22 -12.449 7.086 12.810 164 HB2 ALA 22 2HB ALA 22 -11.511 5.884 13.748 165 HB3 ALA 22 3HB ALA 22 -10.844 7.542 13.495 166 H SER 23 H SER 23 -14.375 8.687 13.842 167 HA SER 23 HA SER 23 -13.442 11.238 13.503 168 HB2 SER 23 2HB SER 23 -15.628 10.252 12.608 169 HB3 SER 23 1HB SER 23 -16.313 10.344 14.265 170 HG SER 23 1HG SER 23 -16.993 12.075 13.088 171 H LYS 24 H LYS 24 -15.095 9.799 16.327 172 HA LYS 24 HA LYS 24 -15.377 12.172 17.795 173 HB2 LYS 24 2HB LYS 24 -16.656 9.962 18.099 174 HB3 LYS 24 1HB LYS 24 -15.162 9.258 18.782 175 HG2 LYS 24 2HG LYS 24 -15.295 11.117 20.607 176 HG3 LYS 24 1HG LYS 24 -16.948 11.457 19.980 177 HD2 LYS 24 2HD LYS 24 -17.532 8.988 20.384 178 HD3 LYS 24 1HD LYS 24 -15.860 8.739 20.972 179 HE2 LYS 24 2HE LYS 24 -17.174 8.905 22.942 180 HE3 LYS 24 1HE LYS 24 -16.325 10.493 22.823 181 HZ1 LYS 24 3HZ LYS 24 -18.679 10.575 23.430 182 HZ2 LYS 24 1HZ LYS 24 -19.140 9.979 21.921 183 HZ3 LYS 24 2HZ LYS 24 -18.390 11.473 21.988 184 H LYS 25 H LYS 25 -12.945 9.557 17.809 185 HA LYS 25 HA LYS 25 -11.440 10.585 19.968 186 HB2 LYS 25 2HB LYS 25 -10.690 8.671 17.666 187 HB3 LYS 25 1HB LYS 25 -9.595 9.035 19.037 188 HG2 LYS 25 2HG LYS 25 -12.383 7.735 19.318 189 HG3 LYS 25 1HG LYS 25 -10.805 6.872 19.311 190 HD2 LYS 25 2HD LYS 25 -10.060 8.234 21.294 191 HD3 LYS 25 1HD LYS 25 -11.684 9.009 21.363 192 HE2 LYS 25 2HE LYS 25 -12.751 6.775 21.793 193 HE3 LYS 25 1HE LYS 25 -11.117 5.990 21.755 194 HZ1 LYS 25 3HZ LYS 25 -10.453 7.344 23.609 195 HZ2 LYS 25 1HZ LYS 25 -11.899 6.503 23.977 196 HZ3 LYS 25 2HZ LYS 25 -11.934 8.182 23.621 197 H ALA 26 H ALA 26 -11.144 10.908 16.409 198 HA ALA 26 HA ALA 26 -8.761 12.266 16.336 199 HB1 ALA 26 1HB ALA 26 -10.023 11.410 14.314 200 HB2 ALA 26 2HB ALA 26 -9.517 13.124 14.134 201 HB3 ALA 26 3HB ALA 26 -11.231 12.728 14.538 202 H VAL 27 H VAL 27 -12.064 13.568 17.006 203 HA VAL 27 HA VAL 27 -11.070 16.266 17.019 204 HB VAL 27 HB VAL 27 -13.666 15.162 18.224 205 HG11 VAL 27 1HG1 VAL 27 -14.408 17.598 18.038 206 HG12 VAL 27 2HG1 VAL 27 -12.717 18.062 17.629 207 HG13 VAL 27 3HG1 VAL 27 -13.107 17.372 19.251 208 HG21 VAL 27 3HG2 VAL 27 -13.482 14.813 15.745 209 HG22 VAL 27 1HG2 VAL 27 -13.075 16.550 15.520 210 HG23 VAL 27 2HG2 VAL 27 -14.696 16.066 16.147 211 H GLU 28 H GLU 28 -11.983 13.866 19.573 212 HA GLU 28 HA GLU 28 -11.626 15.820 21.573 213 HB2 GLU 28 2HB GLU 28 -13.155 13.697 21.664 214 HB3 GLU 28 1HB GLU 28 -11.676 12.817 22.161 215 HG2 GLU 28 2HG GLU 28 -11.413 14.507 24.072 216 HG3 GLU 28 1HG GLU 28 -12.955 15.274 23.562 217 H ALA 29 H ALA 29 -9.461 13.467 20.101 218 HA ALA 29 HA ALA 29 -7.544 13.428 22.156 219 HB1 ALA 29 1HB ALA 29 -7.182 12.980 19.131 220 HB2 ALA 29 2HB ALA 29 -7.662 11.706 20.292 221 HB3 ALA 29 3HB ALA 29 -6.049 12.465 20.429 222 H GLU 30 H GLU 30 -8.153 15.614 19.389 223 HA GLU 30 HA GLU 30 -5.636 16.867 19.637 224 HB2 GLU 30 2HB GLU 30 -8.150 17.722 18.129 225 HB3 GLU 30 1HB GLU 30 -6.540 18.526 17.982 226 HG2 GLU 30 2HG GLU 30 -6.869 15.503 17.433 227 HG3 GLU 30 1HG GLU 30 -7.307 16.733 16.212 228 H ARG 31 H ARG 31 -8.619 18.750 19.760 229 HA ARG 31 HA ARG 31 -8.777 20.842 20.769 230 HB2 ARG 31 2HB ARG 31 -9.413 18.650 22.783 231 HB3 ARG 31 1HB ARG 31 -9.950 20.345 23.019 232 HG2 ARG 31 2HG ARG 31 -10.687 18.778 20.476 233 HG3 ARG 31 1HG ARG 31 -11.591 18.540 21.993 234 HD2 ARG 31 2HD ARG 31 -11.246 21.267 20.558 235 HD3 ARG 31 1HD ARG 31 -12.726 20.209 20.501 236 HE ARG 31 HE ARG 31 -12.261 20.495 23.216 237 HH11 ARG 31 1HH2 ARG 31 -12.675 22.915 20.551 238 HH12 ARG 31 2HH2 ARG 31 -13.580 24.003 21.490 239 HH21 ARG 31 1HH1 ARG 31 -13.220 22.186 24.593 240 HH22 ARG 31 2HH1 ARG 31 -13.618 23.698 23.909 241 H GLY 32 H GLY 32 -6.309 21.411 20.851 242 HA2 GLY 32 2HA GLY 32 -5.410 22.914 22.632 243 HA3 GLY 32 1HA GLY 32 -5.328 21.398 23.618 244 H ALA 33 H ALA 33 -4.913 19.811 21.095 245 HA ALA 33 HA ALA 33 -2.228 19.618 21.343 246 HB1 ALA 33 1HB ALA 33 -4.021 18.619 19.087 247 HB2 ALA 33 2HB ALA 33 -3.650 17.747 20.613 248 HB3 ALA 33 3HB ALA 33 -2.363 18.023 19.390 249 HA PRO 34 HA PRO 34 -0.991 22.729 18.413 250 HB2 PRO 34 2HB PRO 34 1.784 22.398 18.418 251 HB3 PRO 34 1HB PRO 34 0.852 23.114 19.789 252 HG2 PRO 34 2HG PRO 34 1.802 20.218 19.476 253 HG3 PRO 34 1HG PRO 34 1.968 21.299 20.923 254 HD2 PRO 34 2HD PRO 34 -0.084 19.444 20.681 255 HD3 PRO 34 1HD PRO 34 -0.374 21.072 21.458 256 H GLY 35 H GLY 35 -1.207 22.699 16.193 257 HA2 GLY 35 2HA GLY 35 -0.252 22.283 14.143 258 HA3 GLY 35 1HA GLY 35 0.430 20.720 14.726 259 H ALA 36 H ALA 36 -2.336 20.456 16.082 260 HA ALA 36 HA ALA 36 -3.424 18.453 15.006 261 HB1 ALA 36 1HB ALA 36 -4.420 19.575 16.964 262 HB2 ALA 36 2HB ALA 36 -5.708 19.226 15.776 263 HB3 ALA 36 3HB ALA 36 -5.071 20.910 15.937 264 H ALA 37 H ALA 37 -4.750 21.612 13.979 265 HA ALA 37 HA ALA 37 -5.702 22.340 12.188 266 HB1 ALA 37 1HB ALA 37 -3.870 21.440 10.761 267 HB2 ALA 37 2HB ALA 37 -5.469 21.428 9.919 268 HB3 ALA 37 3HB ALA 37 -4.781 19.902 10.589 269 H LEU 38 H LEU 38 -6.523 19.344 13.583 270 HA LEU 38 HA LEU 38 -9.111 19.213 12.232 271 HB2 LEU 38 2HB LEU 38 -7.423 17.233 12.347 272 HB3 LEU 38 1HB LEU 38 -7.801 17.126 14.076 273 HG LEU 38 HG LEU 38 -9.912 16.948 11.813 274 HD11 LEU 38 1HD1 LEU 38 -9.742 14.457 12.088 275 HD12 LEU 38 2HD1 LEU 38 -8.354 14.693 13.219 276 HD13 LEU 38 3HD1 LEU 38 -8.202 15.178 11.501 277 HD21 LEU 38 3HD2 LEU 38 -11.226 15.649 13.593 278 HD22 LEU 38 1HD2 LEU 38 -11.017 17.389 13.989 279 HD23 LEU 38 2HD2 LEU 38 -9.990 16.151 14.797 280 H ILE 39 H ILE 39 -10.755 20.199 13.362 281 HA ILE 39 HA ILE 39 -10.687 20.044 16.282 282 HB ILE 39 HB ILE 39 -11.417 22.500 16.304 283 HG12 ILE 39 2HG1 ILE 39 -10.150 22.510 13.475 284 HG13 ILE 39 1HG1 ILE 39 -11.912 22.633 13.810 285 HG21 ILE 39 1HG2 ILE 39 -9.108 23.319 16.402 286 HG22 ILE 39 2HG2 ILE 39 -8.522 21.967 15.368 287 HG23 ILE 39 3HG2 ILE 39 -9.145 21.630 17.018 288 HD11 ILE 39 3HD ILE 39 -9.765 24.662 14.735 289 HD12 ILE 39 1HD ILE 39 -10.967 24.882 13.411 290 HD13 ILE 39 2HD ILE 39 -11.524 24.742 15.116 291 H SER 40 H SER 40 -12.510 19.259 13.550 292 HA SER 40 HA SER 40 -14.977 20.323 14.786 293 HB2 SER 40 2HB SER 40 -14.307 20.100 11.806 294 HB3 SER 40 1HB SER 40 -15.850 20.711 12.496 295 HG SER 40 1HG SER 40 -14.368 22.304 11.808 296 H TYR 41 H TYR 41 -16.489 18.796 15.163 297 HA TYR 41 HA TYR 41 -16.174 16.114 14.629 298 HB2 TYR 41 2HB TYR 41 -18.751 17.687 15.251 299 HB3 TYR 41 1HB TYR 41 -18.678 15.894 15.117 300 HD1 TYR 41 1HD TYR 41 -17.530 18.833 17.136 301 HD2 TYR 41 2HD TYR 41 -17.675 14.540 16.797 302 HE1 TYR 41 1HE TYR 41 -16.903 18.626 19.502 303 HE2 TYR 41 2HE TYR 41 -17.098 14.336 19.182 304 HH TYR 41 HH TYR 41 -15.952 16.898 21.132 305 HA PRO 42 HA PRO 42 -19.031 16.055 11.007 306 HB2 PRO 42 2HB PRO 42 -19.519 18.328 9.383 307 HB3 PRO 42 1HB PRO 42 -20.559 17.827 10.768 308 HG2 PRO 42 2HG PRO 42 -18.266 19.869 10.771 309 HG3 PRO 42 1HG PRO 42 -19.936 20.074 11.447 310 HD2 PRO 42 2HD PRO 42 -17.832 19.402 13.055 311 HD3 PRO 42 1HD PRO 42 -19.439 18.571 13.293 312 H ASP 43 H ASP 43 -16.088 17.857 11.024 313 HA ASP 43 HA ASP 43 -15.435 17.191 8.267 314 HB2 ASP 43 2HB ASP 43 -13.726 18.584 10.425 315 HB3 ASP 43 1HB ASP 43 -13.294 18.372 8.696 316 H ALA 44 H ALA 44 -14.996 16.095 11.596 317 HA ALA 44 HA ALA 44 -12.524 14.882 11.298 318 HB1 ALA 44 1HB ALA 44 -13.075 13.664 13.419 319 HB2 ALA 44 2HB ALA 44 -14.781 14.237 13.279 320 HB3 ALA 44 3HB ALA 44 -13.449 15.418 13.504 321 H ILE 45 H ILE 45 -15.796 13.642 10.740 322 HA ILE 45 HA ILE 45 -14.961 10.976 10.306 323 HB ILE 45 HB ILE 45 -17.218 11.450 10.934 324 HG12 ILE 45 2HG1 ILE 45 -17.163 10.283 8.085 325 HG13 ILE 45 1HG1 ILE 45 -16.710 9.414 9.586 326 HG21 ILE 45 1HG2 ILE 45 -17.490 13.710 9.893 327 HG22 ILE 45 2HG2 ILE 45 -18.839 12.622 9.463 328 HG23 ILE 45 3HG2 ILE 45 -17.554 12.957 8.258 329 HD11 ILE 45 3HD ILE 45 -19.510 10.555 8.917 330 HD12 ILE 45 1HD ILE 45 -19.020 8.829 8.955 331 HD13 ILE 45 2HD ILE 45 -19.059 9.780 10.483 332 H TRP 46 H TRP 46 -15.025 13.871 8.275 333 HA TRP 46 HA TRP 46 -14.899 12.405 5.828 334 HB2 TRP 46 2HB TRP 46 -15.630 15.003 6.535 335 HB3 TRP 46 1HB TRP 46 -14.026 15.293 5.810 336 HD1 TRP 46 HD TRP 46 -14.435 15.929 3.265 337 HE1 TRP 46 1HE TRP 46 -16.310 15.518 1.550 338 HE3 TRP 46 3HE TRP 46 -17.294 12.683 5.978 339 HZ2 TRP 46 2HZ TRP 46 -18.599 13.831 1.288 340 HZ3 TRP 46 3HZ TRP 46 -19.317 11.707 4.954 341 HH2 TRP 46 HH TRP 46 -19.965 12.278 2.643 342 H TRP 47 H TRP 47 -12.622 13.897 8.079 343 HA TRP 47 HA TRP 47 -10.263 13.489 6.579 344 HB2 TRP 47 2HB TRP 47 -10.292 14.930 8.597 345 HB3 TRP 47 1HB TRP 47 -10.818 13.552 9.618 346 HD1 TRP 47 HD TRP 47 -7.634 14.496 7.469 347 HE1 TRP 47 1HE TRP 47 -5.659 13.310 8.465 348 HE3 TRP 47 3HE TRP 47 -10.087 11.908 11.118 349 HZ2 TRP 47 2HZ TRP 47 -5.102 11.669 10.794 350 HZ3 TRP 47 3HZ TRP 47 -8.781 10.470 12.653 351 HH2 TRP 47 HH TRP 47 -6.323 10.380 12.513 352 H SER 48 H SER 48 -12.066 11.518 8.941 353 HA SER 48 HA SER 48 -10.374 9.399 9.151 354 HB2 SER 48 2HB SER 48 -12.604 10.066 10.419 355 HB3 SER 48 1HB SER 48 -13.421 9.020 9.205 356 HG SER 48 1HG SER 48 -12.830 8.019 11.178 357 H VAL 49 H VAL 49 -12.789 10.054 6.583 358 HA VAL 49 HA VAL 49 -12.829 7.592 5.339 359 HB VAL 49 HB VAL 49 -12.965 10.369 4.051 360 HG11 VAL 49 1HG1 VAL 49 -14.155 9.159 2.152 361 HG12 VAL 49 2HG1 VAL 49 -13.702 7.590 2.895 362 HG13 VAL 49 3HG1 VAL 49 -12.427 8.695 2.273 363 HG21 VAL 49 3HG2 VAL 49 -15.445 9.931 4.094 364 HG22 VAL 49 1HG2 VAL 49 -14.768 9.931 5.750 365 HG23 VAL 49 2HG2 VAL 49 -15.160 8.371 4.947 366 H GLU 50 H GLU 50 -10.439 10.311 4.792 367 HA GLU 50 HA GLU 50 -9.164 8.754 2.764 368 HB2 GLU 50 2HB GLU 50 -7.477 10.363 2.489 369 HB3 GLU 50 1HB GLU 50 -9.023 11.248 2.643 370 HG2 GLU 50 2HG GLU 50 -8.373 12.092 4.883 371 HG3 GLU 50 1HG GLU 50 -6.965 10.979 4.943 372 H THR 51 H THR 51 -8.986 8.941 6.185 373 HA THR 51 HA THR 51 -6.263 8.203 6.471 374 HB THR 51 HB THR 51 -8.567 8.018 8.486 375 HG1 THR 51 1HG THR 51 -8.281 10.153 7.676 376 HG21 THR 51 3HG2 THR 51 -5.491 8.217 8.842 377 HG22 THR 51 1HG2 THR 51 -6.493 6.763 9.191 378 HG23 THR 51 2HG2 THR 51 -6.708 8.257 10.168 379 H ALA 52 H ALA 52 -9.394 6.462 6.382 380 HA ALA 52 HA ALA 52 -8.295 3.950 7.096 381 HB1 ALA 52 1HB ALA 52 -10.462 3.028 6.222 382 HB2 ALA 52 2HB ALA 52 -10.861 4.651 5.534 383 HB3 ALA 52 3HB ALA 52 -10.720 4.427 7.322 384 H THR 53 H THR 53 -8.575 5.707 3.984 385 HA THR 53 HA THR 53 -7.819 3.339 2.509 386 HB THR 53 HB THR 53 -7.822 5.048 0.584 387 HG1 THR 53 1HG THR 53 -7.617 6.869 1.998 388 HG21 THR 53 3HG2 THR 53 -9.732 3.488 1.124 389 HG22 THR 53 1HG2 THR 53 -10.318 5.089 0.537 390 HG23 THR 53 2HG2 THR 53 -10.390 4.696 2.294 391 H THR 54 H THR 54 -6.096 4.988 4.642 392 HA THR 54 HA THR 54 -3.994 5.478 4.952 393 HB THR 54 HB THR 54 -2.400 3.670 4.150 394 HG1 THR 54 1HG THR 54 -3.684 3.293 2.217 395 HG21 THR 54 3HG2 THR 54 -3.800 3.553 6.259 396 HG22 THR 54 1HG2 THR 54 -3.519 1.932 5.530 397 HG23 THR 54 2HG2 THR 54 -5.117 2.738 5.339 398 H VAL 55 H VAL 55 -4.453 7.546 3.505 399 HA VAL 55 HA VAL 55 -2.138 7.580 1.712 400 HB VAL 55 HB VAL 55 -3.852 7.386 0.145 401 HG11 VAL 55 1HG1 VAL 55 -5.391 9.768 1.374 402 HG12 VAL 55 2HG1 VAL 55 -5.832 8.025 1.568 403 HG13 VAL 55 3HG1 VAL 55 -5.826 8.778 -0.057 404 HG21 VAL 55 3HG2 VAL 55 -1.948 8.970 -0.221 405 HG22 VAL 55 1HG2 VAL 55 -2.969 10.346 0.321 406 HG23 VAL 55 2HG2 VAL 55 -3.403 9.407 -1.161 407 H GLY 56 H GLY 56 -4.531 10.031 2.884 408 HA2 GLY 56 2HA GLY 56 -4.160 11.605 4.489 409 HA3 GLY 56 1HA GLY 56 -2.485 10.977 4.739 410 H TYR 57 H TYR 57 -4.590 12.794 2.397 411 HA TYR 57 HA TYR 57 -2.368 13.380 0.693 412 HB2 TYR 57 2HB TYR 57 -5.268 14.386 0.905 413 HB3 TYR 57 1HB TYR 57 -4.098 15.377 -0.046 414 HD1 TYR 57 2HD TYR 57 -5.590 11.953 0.194 415 HD2 TYR 57 1HD TYR 57 -3.275 14.718 -2.147 416 HE1 TYR 57 2HE TYR 57 -5.628 10.385 -1.695 417 HE2 TYR 57 1HE TYR 57 -3.326 13.154 -4.050 418 HH TYR 57 HH TYR 57 -4.497 9.853 -3.662 419 H GLY 58 H GLY 58 -3.817 14.957 3.457 420 HA2 GLY 58 2HA GLY 58 -2.111 16.306 4.663 421 HA3 GLY 58 1HA GLY 58 -1.927 17.236 3.130 422 H ASP 59 H ASP 59 -4.946 15.901 4.574 423 HA ASP 59 HA ASP 59 -6.207 18.459 4.253 424 HB2 ASP 59 2HB ASP 59 -7.270 16.011 4.119 425 HB3 ASP 59 1HB ASP 59 -7.380 16.118 5.886 426 H ARG 60 H ARG 60 -4.979 16.338 6.947 427 HA ARG 60 HA ARG 60 -4.973 18.638 8.711 428 HB2 ARG 60 2HB ARG 60 -5.975 15.863 9.607 429 HB3 ARG 60 1HB ARG 60 -5.903 17.346 10.610 430 HG2 ARG 60 2HG ARG 60 -7.690 16.890 8.144 431 HG3 ARG 60 1HG ARG 60 -8.234 16.705 9.832 432 HD2 ARG 60 2HD ARG 60 -8.290 18.990 10.270 433 HD3 ARG 60 1HD ARG 60 -7.022 19.420 9.047 434 HE ARG 60 HE ARG 60 -8.819 18.612 7.318 435 HH11 ARG 60 1HH2 ARG 60 -9.208 20.965 10.046 436 HH12 ARG 60 2HH2 ARG 60 -10.638 21.641 9.327 437 HH21 ARG 60 1HH1 ARG 60 -10.591 19.538 6.464 438 HH22 ARG 60 2HH1 ARG 60 -11.472 20.832 7.269 439 H TYR 61 H TYR 61 -3.727 17.618 10.914 440 HA TYR 61 HA TYR 61 -1.625 15.854 9.976 441 HB2 TYR 61 2HB TYR 61 -1.172 18.765 10.883 442 HB3 TYR 61 1HB TYR 61 0.122 17.503 10.909 443 HD1 TYR 61 1HD TYR 61 0.635 16.236 8.756 444 HD2 TYR 61 2HD TYR 61 -1.615 19.906 8.794 445 HE1 TYR 61 1HE TYR 61 1.083 16.524 6.375 446 HE2 TYR 61 2HE TYR 61 -1.140 20.211 6.391 447 HH TYR 61 HH TYR 61 0.755 17.793 4.512 448 HA PRO 62 HA PRO 62 -2.856 15.482 14.383 449 HB2 PRO 62 2HB PRO 62 -2.440 12.702 14.680 450 HB3 PRO 62 1HB PRO 62 -3.927 13.426 13.969 451 HG2 PRO 62 2HG PRO 62 -1.465 12.359 12.473 452 HG3 PRO 62 1HG PRO 62 -3.212 11.992 12.154 453 HD2 PRO 62 2HD PRO 62 -1.863 13.907 10.712 454 HD3 PRO 62 1HD PRO 62 -3.595 14.187 11.213 455 H VAL 63 H VAL 63 -1.586 14.666 16.390 456 HA VAL 63 HA VAL 63 1.291 14.669 15.885 457 HB VAL 63 HB VAL 63 0.465 16.996 15.913 458 HG11 VAL 63 1HG1 VAL 63 -0.432 18.007 17.994 459 HG12 VAL 63 2HG1 VAL 63 -0.510 16.393 18.780 460 HG13 VAL 63 3HG1 VAL 63 -1.522 16.752 17.337 461 HG21 VAL 63 3HG2 VAL 63 2.801 16.469 16.672 462 HG22 VAL 63 1HG2 VAL 63 2.230 16.506 18.390 463 HG23 VAL 63 2HG2 VAL 63 2.097 17.968 17.368 464 H THR 64 H THR 64 2.399 14.519 18.203 465 HA THR 64 HA THR 64 1.744 12.142 19.329 466 HB THR 64 HB THR 64 3.420 14.476 20.421 467 HG1 THR 64 1HG THR 64 4.842 14.006 18.906 468 HG21 THR 64 3HG2 THR 64 4.943 12.625 21.236 469 HG22 THR 64 1HG2 THR 64 3.734 11.400 20.718 470 HG23 THR 64 2HG2 THR 64 3.331 12.567 22.025 471 H GLU 65 H GLU 65 0.574 15.321 20.104 472 HA GLU 65 HA GLU 65 -0.070 14.797 22.825 473 HB2 GLU 65 2HB GLU 65 0.454 17.102 21.833 474 HB3 GLU 65 1HB GLU 65 -1.121 17.023 20.980 475 HG2 GLU 65 2HG GLU 65 -1.277 18.401 23.039 476 HG3 GLU 65 1HG GLU 65 -2.304 16.931 23.210 477 H GLU 66 H GLU 66 -1.799 14.656 19.626 478 HA GLU 66 HA GLU 66 -4.263 14.007 20.776 479 HB2 GLU 66 2HB GLU 66 -5.156 13.621 18.713 480 HB3 GLU 66 1HB GLU 66 -3.823 14.699 18.298 481 HG2 GLU 66 2HG GLU 66 -4.051 13.083 16.591 482 HG3 GLU 66 1HG GLU 66 -2.542 12.641 17.431 483 H GLY 67 H GLY 67 -1.662 12.148 19.376 484 HA2 GLY 67 2HA GLY 67 -0.555 10.548 20.861 485 HA3 GLY 67 1HA GLY 67 -2.225 9.948 21.274 486 H ARG 68 H ARG 68 -0.316 10.969 18.430 487 HA ARG 68 HA ARG 68 -1.306 10.412 16.309 488 HB2 ARG 68 2HB ARG 68 1.136 10.852 16.422 489 HB3 ARG 68 1HB ARG 68 1.427 9.122 16.855 490 HG2 ARG 68 2HG ARG 68 0.657 8.381 14.622 491 HG3 ARG 68 1HG ARG 68 0.260 10.063 14.170 492 HD2 ARG 68 2HD ARG 68 3.089 8.904 14.754 493 HD3 ARG 68 1HD ARG 68 2.392 9.218 13.123 494 HE ARG 68 HE ARG 68 3.559 11.198 14.951 495 HH11 ARG 68 1HH2 ARG 68 2.080 10.936 11.782 496 HH12 ARG 68 2HH2 ARG 68 1.303 12.400 11.772 497 HH21 ARG 68 1HH1 ARG 68 3.386 13.544 14.244 498 HH22 ARG 68 2HH1 ARG 68 1.853 13.986 13.569 499 H LYS 69 H LYS 69 -0.787 7.712 18.367 500 HA LYS 69 HA LYS 69 -1.324 5.635 16.579 501 HB2 LYS 69 2HB LYS 69 -1.892 5.866 19.570 502 HB3 LYS 69 1HB LYS 69 -1.955 4.337 18.612 503 HG2 LYS 69 2HG LYS 69 0.470 4.679 17.989 504 HG3 LYS 69 1HG LYS 69 0.564 6.070 19.111 505 HD2 LYS 69 2HD LYS 69 -0.091 3.143 19.925 506 HD3 LYS 69 1HD LYS 69 1.512 3.926 19.963 507 HE2 LYS 69 2HE LYS 69 0.876 4.103 22.201 508 HE3 LYS 69 1HE LYS 69 0.469 5.734 21.542 509 HZ1 LYS 69 3HZ LYS 69 -1.334 5.208 22.752 510 HZ2 LYS 69 1HZ LYS 69 -1.311 3.525 22.384 511 HZ3 LYS 69 2HZ LYS 69 -1.898 4.689 21.280 512 H VAL 70 H VAL 70 -3.603 8.275 17.405 513 HA VAL 70 HA VAL 70 -5.794 6.394 17.060 514 HB VAL 70 HB VAL 70 -5.884 9.385 17.158 515 HG11 VAL 70 1HG1 VAL 70 -7.526 8.687 15.436 516 HG12 VAL 70 2HG1 VAL 70 -8.359 9.133 16.953 517 HG13 VAL 70 3HG1 VAL 70 -8.155 7.388 16.522 518 HG21 VAL 70 3HG2 VAL 70 -5.588 8.003 19.275 519 HG22 VAL 70 1HG2 VAL 70 -7.066 7.065 18.860 520 HG23 VAL 70 2HG2 VAL 70 -7.187 8.834 19.215 521 H ALA 71 H ALA 71 -3.948 8.752 15.061 522 HA ALA 71 HA ALA 71 -5.321 8.209 12.687 523 HB1 ALA 71 1HB ALA 71 -3.618 10.035 12.876 524 HB2 ALA 71 2HB ALA 71 -3.267 8.956 11.472 525 HB3 ALA 71 3HB ALA 71 -2.308 8.807 12.992 526 H GLU 72 H GLU 72 -2.346 6.651 13.947 527 HA GLU 72 HA GLU 72 -1.967 4.804 11.940 528 HB2 GLU 72 2HB GLU 72 -1.430 4.351 14.931 529 HB3 GLU 72 1HB GLU 72 -0.662 3.450 13.583 530 HG2 GLU 72 2HG GLU 72 -0.348 6.512 13.857 531 HG3 GLU 72 1HG GLU 72 0.700 5.352 14.738 532 H GLN 73 H GLN 73 -4.168 4.639 14.734 533 HA GLN 73 HA GLN 73 -4.627 1.838 14.574 534 HB2 GLN 73 2HB GLN 73 -5.069 3.148 16.632 535 HB3 GLN 73 1HB GLN 73 -6.342 4.087 15.773 536 HG2 GLN 73 2HG GLN 73 -7.695 1.930 15.552 537 HG3 GLN 73 1HG GLN 73 -6.388 1.056 16.423 538 HE21 GLN 73 1HE2 GLN 73 -9.147 3.183 16.769 539 HE22 GLN 73 2HE2 GLN 73 -9.077 3.330 18.495 540 H VAL 74 H VAL 74 -6.203 4.730 13.131 541 HA VAL 74 HA VAL 74 -8.414 3.273 12.101 542 HB VAL 74 HB VAL 74 -7.203 5.953 11.238 543 HG11 VAL 74 1HG1 VAL 74 -8.662 5.056 9.413 544 HG12 VAL 74 2HG1 VAL 74 -9.518 6.380 10.270 545 HG13 VAL 74 3HG1 VAL 74 -9.959 4.666 10.603 546 HG21 VAL 74 3HG2 VAL 74 -9.561 5.253 13.110 547 HG22 VAL 74 1HG2 VAL 74 -9.001 6.914 12.657 548 HG23 VAL 74 2HG2 VAL 74 -7.966 5.854 13.659 549 H MET 75 H MET 75 -5.254 4.318 10.810 550 HA MET 75 HA MET 75 -5.552 3.436 8.197 551 HB2 MET 75 2HB MET 75 -3.097 3.633 10.044 552 HB3 MET 75 1HB MET 75 -2.963 3.310 8.287 553 HG2 MET 75 2HG MET 75 -3.782 5.448 7.668 554 HG3 MET 75 1HG MET 75 -4.514 5.760 9.263 555 HE1 MET 75 3HE MET 75 -1.528 8.411 8.442 556 HE2 MET 75 1HE MET 75 -3.313 8.248 8.563 557 HE3 MET 75 2HE MET 75 -2.417 7.453 7.218 558 H LYS 76 H LYS 76 -4.306 1.731 11.098 559 HA LYS 76 HA LYS 76 -3.627 -0.628 9.836 560 HB2 LYS 76 2HB LYS 76 -3.043 0.094 12.223 561 HB3 LYS 76 1HB LYS 76 -4.704 -0.380 12.709 562 HG2 LYS 76 2HG LYS 76 -4.204 -2.748 11.909 563 HG3 LYS 76 1HG LYS 76 -2.553 -2.196 11.451 564 HD2 LYS 76 2HD LYS 76 -2.163 -1.582 13.914 565 HD3 LYS 76 1HD LYS 76 -3.797 -2.221 14.288 566 HE2 LYS 76 2HE LYS 76 -2.063 -3.909 14.843 567 HE3 LYS 76 1HE LYS 76 -3.103 -4.517 13.493 568 HZ1 LYS 76 3HZ LYS 76 -0.738 -4.908 13.158 569 HZ2 LYS 76 1HZ LYS 76 -0.405 -3.256 13.227 570 HZ3 LYS 76 2HZ LYS 76 -1.352 -3.882 11.946 571 H ALA 77 H ALA 77 -6.774 0.404 11.191 572 HA ALA 77 HA ALA 77 -8.056 -2.078 10.997 573 HB1 ALA 77 1HB ALA 77 -9.291 0.742 10.785 574 HB2 ALA 77 2HB ALA 77 -9.005 -0.162 12.318 575 HB3 ALA 77 3HB ALA 77 -10.195 -0.783 11.120 576 H GLY 78 H GLY 78 -7.525 0.534 8.644 577 HA2 GLY 78 2HA GLY 78 -9.243 -0.400 6.609 578 HA3 GLY 78 1HA GLY 78 -7.804 0.680 6.459 579 H ILE 79 H ILE 79 -5.756 -0.881 7.288 580 HA ILE 79 HA ILE 79 -5.234 -2.482 5.074 581 HB ILE 79 HB ILE 79 -3.880 -2.439 7.813 582 HG12 ILE 79 2HG1 ILE 79 -3.130 -1.057 5.148 583 HG13 ILE 79 1HG1 ILE 79 -3.944 -0.237 6.504 584 HG21 ILE 79 1HG2 ILE 79 -1.900 -3.465 6.613 585 HG22 ILE 79 2HG2 ILE 79 -2.893 -3.611 5.118 586 HG23 ILE 79 3HG2 ILE 79 -3.310 -4.565 6.588 587 HD11 ILE 79 3HD ILE 79 -1.104 -1.447 6.583 588 HD12 ILE 79 1HD ILE 79 -1.558 0.288 6.572 589 HD13 ILE 79 2HD ILE 79 -1.964 -0.728 8.002 590 H GLU 80 H GLU 80 -6.427 -3.359 8.364 591 HA GLU 80 HA GLU 80 -6.250 -6.119 8.055 592 HB2 GLU 80 2HB GLU 80 -8.451 -4.591 9.593 593 HB3 GLU 80 1HB GLU 80 -8.149 -6.360 9.678 594 HG2 GLU 80 2HG GLU 80 -5.840 -5.874 10.631 595 HG3 GLU 80 1HG GLU 80 -6.292 -4.133 10.719 596 H VAL 81 H VAL 81 -9.046 -3.945 7.299 597 HA VAL 81 HA VAL 81 -10.662 -6.160 6.618 598 HB VAL 81 HB VAL 81 -12.298 -4.506 5.775 599 HG11 VAL 81 1HG1 VAL 81 -11.019 -3.868 8.531 600 HG12 VAL 81 2HG1 VAL 81 -12.155 -5.230 8.189 601 HG13 VAL 81 3HG1 VAL 81 -12.712 -3.526 8.029 602 HG21 VAL 81 3HG2 VAL 81 -11.829 -2.086 6.089 603 HG22 VAL 81 1HG2 VAL 81 -10.726 -2.762 4.867 604 HG23 VAL 81 2HG2 VAL 81 -10.137 -2.430 6.534 605 H PHE 82 H PHE 82 -8.695 -3.870 4.645 606 HA PHE 82 HA PHE 82 -9.678 -4.906 2.197 607 HB2 PHE 82 2HB PHE 82 -7.040 -3.409 2.757 608 HB3 PHE 82 1HB PHE 82 -7.725 -3.722 1.120 609 HD1 PHE 82 1HD PHE 82 -10.738 -3.070 1.834 610 HD2 PHE 82 2HD PHE 82 -6.994 -1.077 2.609 611 HE1 PHE 82 1HE PHE 82 -11.904 -0.917 1.966 612 HE2 PHE 82 2HE PHE 82 -8.175 1.073 2.751 613 HZ PHE 82 HZ PHE 82 -10.635 1.173 2.428 614 H ALA 83 H ALA 83 -6.826 -5.696 4.264 615 HA ALA 83 HA ALA 83 -5.696 -7.454 2.385 616 HB1 ALA 83 1HB ALA 83 -5.459 -7.520 5.458 617 HB2 ALA 83 2HB ALA 83 -4.384 -6.604 4.342 618 HB3 ALA 83 3HB ALA 83 -4.389 -8.402 4.299 619 H LEU 84 H LEU 84 -8.263 -7.858 4.812 620 HA LEU 84 HA LEU 84 -8.224 -10.666 4.817 621 HB2 LEU 84 2HB LEU 84 -9.244 -9.236 6.588 622 HB3 LEU 84 1HB LEU 84 -10.575 -8.802 5.475 623 HG LEU 84 HG LEU 84 -10.111 -11.758 5.768 624 HD11 LEU 84 1HD1 LEU 84 -11.048 -10.204 8.254 625 HD12 LEU 84 2HD1 LEU 84 -9.482 -11.080 8.078 626 HD13 LEU 84 3HD1 LEU 84 -11.037 -11.990 8.046 627 HD21 LEU 84 3HD2 LEU 84 -12.571 -11.838 6.034 628 HD22 LEU 84 1HD2 LEU 84 -12.137 -10.813 4.624 629 HD23 LEU 84 2HD2 LEU 84 -12.654 -10.043 6.169 630 H VAL 85 H VAL 85 -9.587 -8.346 2.528 631 HA VAL 85 HA VAL 85 -11.534 -9.963 1.370 632 HB VAL 85 HB VAL 85 -9.830 -7.810 0.010 633 HG11 VAL 85 1HG1 VAL 85 -11.019 -9.063 -1.741 634 HG12 VAL 85 2HG1 VAL 85 -11.934 -7.549 -1.446 635 HG13 VAL 85 3HG1 VAL 85 -12.535 -9.104 -0.771 636 HG21 VAL 85 3HG2 VAL 85 -12.475 -7.684 1.626 637 HG22 VAL 85 1HG2 VAL 85 -11.858 -6.350 0.583 638 HG23 VAL 85 2HG2 VAL 85 -10.906 -6.881 1.995 639 H THR 86 H THR 86 -8.095 -10.348 1.349 640 HA THR 86 HA THR 86 -7.628 -11.660 -1.002 641 HB THR 86 HB THR 86 -6.428 -12.328 1.725 642 HG1 THR 86 1HG THR 86 -5.989 -10.277 1.470 643 HG21 THR 86 3HG2 THR 86 -5.770 -14.004 -0.034 644 HG22 THR 86 1HG2 THR 86 -4.393 -12.907 0.316 645 HG23 THR 86 2HG2 THR 86 -5.369 -12.666 -1.178 646 H ALA 87 H ALA 87 -9.561 -12.827 1.727 647 HA ALA 87 HA ALA 87 -9.467 -15.570 1.125 648 HB1 ALA 87 1HB ALA 87 -11.834 -13.925 2.230 649 HB2 ALA 87 2HB ALA 87 -10.527 -14.663 3.221 650 HB3 ALA 87 3HB ALA 87 -11.659 -15.722 2.315 651 H ALA 88 H ALA 88 -10.997 -12.863 -0.513 652 HA ALA 88 HA ALA 88 -12.597 -14.596 -2.199 653 HB1 ALA 88 1HB ALA 88 -12.211 -11.539 -2.317 654 HB2 ALA 88 2HB ALA 88 -13.600 -12.364 -1.530 655 HB3 ALA 88 3HB ALA 88 -13.359 -12.494 -3.311 656 H LEU 89 H LEU 89 -9.875 -12.285 -2.454 657 HA LEU 89 HA LEU 89 -9.503 -12.550 -5.147 658 HB2 LEU 89 2HB LEU 89 -7.205 -12.125 -3.149 659 HB3 LEU 89 1HB LEU 89 -7.286 -11.552 -4.845 660 HG LEU 89 HG LEU 89 -9.117 -10.597 -2.551 661 HD11 LEU 89 1HD1 LEU 89 -7.768 -8.518 -2.558 662 HD12 LEU 89 2HD1 LEU 89 -6.635 -9.252 -3.756 663 HD13 LEU 89 3HD1 LEU 89 -6.780 -9.949 -2.111 664 HD21 LEU 89 3HD2 LEU 89 -9.742 -8.739 -4.083 665 HD22 LEU 89 1HD2 LEU 89 -10.254 -10.335 -4.731 666 HD23 LEU 89 2HD2 LEU 89 -8.801 -9.519 -5.414 667 H ALA 90 H ALA 90 -8.062 -14.547 -2.548 668 HA ALA 90 HA ALA 90 -6.272 -15.885 -4.287 669 HB1 ALA 90 1HB ALA 90 -5.878 -15.761 -1.820 670 HB2 ALA 90 2HB ALA 90 -5.922 -17.465 -2.399 671 HB3 ALA 90 3HB ALA 90 -7.350 -16.760 -1.542 672 H THR 91 H THR 91 -9.748 -16.266 -3.779 673 HA THR 91 HA THR 91 -9.706 -19.048 -4.523 674 HB THR 91 HB THR 91 -12.113 -18.929 -4.939 675 HG1 THR 91 1HG THR 91 -11.776 -16.160 -4.452 676 HG21 THR 91 3HG2 THR 91 -11.355 -19.549 -2.726 677 HG22 THR 91 1HG2 THR 91 -12.789 -18.486 -2.540 678 HG23 THR 91 2HG2 THR 91 -11.144 -17.822 -2.227 679 H ASP 92 H ASP 92 -9.414 -15.991 -6.258 680 HA ASP 92 HA ASP 92 -10.784 -17.017 -8.534 681 HB2 ASP 92 2HB ASP 92 -9.267 -14.412 -8.094 682 HB3 ASP 92 1HB ASP 92 -9.968 -14.886 -9.691 683 H PHE 93 H PHE 93 -7.650 -17.723 -7.458 684 HA PHE 93 HA PHE 93 -6.850 -18.312 -10.233 685 HB2 PHE 93 2HB PHE 93 -4.682 -18.733 -9.620 686 HB3 PHE 93 1HB PHE 93 -5.116 -17.392 -8.523 687 HD1 PHE 93 1HD PHE 93 -5.358 -17.819 -6.102 688 HD2 PHE 93 2HD PHE 93 -4.291 -20.995 -8.794 689 HE1 PHE 93 1HE PHE 93 -4.772 -19.252 -4.181 690 HE2 PHE 93 2HE PHE 93 -3.674 -22.418 -6.873 691 HZ PHE 93 HZ PHE 93 -3.941 -21.559 -4.560 692 H VAL 94 H VAL 94 -8.452 -19.699 -7.471 693 HA VAL 94 HA VAL 94 -7.596 -22.379 -7.903 694 HB VAL 94 HB VAL 94 -9.921 -21.298 -6.223 695 HG11 VAL 94 1HG1 VAL 94 -8.381 -23.990 -6.150 696 HG12 VAL 94 2HG1 VAL 94 -10.104 -23.768 -6.626 697 HG13 VAL 94 3HG1 VAL 94 -9.594 -23.449 -4.933 698 HG21 VAL 94 3HG2 VAL 94 -7.647 -20.275 -5.648 699 HG22 VAL 94 1HG2 VAL 94 -6.989 -21.927 -5.435 700 HG23 VAL 94 2HG2 VAL 94 -8.300 -21.316 -4.359 701 H ARG 95 H ARG 95 -10.397 -20.355 -8.660 702 HA ARG 95 HA ARG 95 -12.122 -22.220 -9.743 703 HB2 ARG 95 2HB ARG 95 -11.610 -19.276 -10.497 704 HB3 ARG 95 1HB ARG 95 -13.022 -20.231 -11.069 705 HG2 ARG 95 2HG ARG 95 -13.818 -20.593 -8.823 706 HG3 ARG 95 1HG ARG 95 -12.408 -19.777 -8.073 707 HD2 ARG 95 2HD ARG 95 -13.068 -17.587 -8.821 708 HD3 ARG 95 1HD ARG 95 -14.270 -18.249 -10.000 709 HE ARG 95 HE ARG 95 -15.463 -19.241 -7.964 710 HH11 ARG 95 1HH2 ARG 95 -13.644 -16.029 -7.722 711 HH12 ARG 95 2HH2 ARG 95 -14.605 -15.466 -6.462 712 HH21 ARG 95 1HH1 ARG 95 -17.063 -18.095 -6.637 713 HH22 ARG 95 2HH1 ARG 95 -16.789 -16.581 -5.968 714 H ARG 96 H ARG 96 -9.063 -21.192 -10.999 715 HA ARG 96 HA ARG 96 -9.527 -21.497 -13.756 716 HB2 ARG 96 2HB ARG 96 -7.524 -20.366 -12.602 717 HB3 ARG 96 1HB ARG 96 -6.985 -21.999 -12.131 718 HG2 ARG 96 2HG ARG 96 -7.171 -22.280 -14.915 719 HG3 ARG 96 1HG ARG 96 -6.804 -20.543 -14.751 720 HD2 ARG 96 2HD ARG 96 -4.649 -21.571 -14.907 721 HD3 ARG 96 1HD ARG 96 -4.818 -21.307 -13.128 722 HE ARG 96 HE ARG 96 -5.009 -23.889 -14.667 723 HH11 ARG 96 1HH2 ARG 96 -5.361 -22.496 -11.309 724 HH12 ARG 96 2HH2 ARG 96 -5.016 -24.006 -10.581 725 HH21 ARG 96 1HH1 ARG 96 -4.677 -25.807 -13.658 726 HH22 ARG 96 2HH1 ARG 96 -4.883 -26.028 -11.976 727 H GLU 97 H GLU 97 -8.864 -23.840 -11.115 728 HA GLU 97 HA GLU 97 -8.144 -25.947 -12.913 729 HB2 GLU 97 2HB GLU 97 -7.578 -25.711 -10.337 730 HB3 GLU 97 1HB GLU 97 -9.219 -26.357 -10.075 731 HG2 GLU 97 2HG GLU 97 -7.735 -28.249 -9.950 732 HG3 GLU 97 1HG GLU 97 -8.498 -28.385 -11.577 733 H GLU 98 H GLU 98 -11.138 -24.632 -11.499 734 HA GLU 98 HA GLU 98 -12.844 -26.788 -12.230 735 HB2 GLU 98 2HB GLU 98 -13.598 -23.792 -11.949 736 HB3 GLU 98 1HB GLU 98 -14.737 -25.158 -12.129 737 HG2 GLU 98 2HG GLU 98 -13.995 -26.049 -9.884 738 HG3 GLU 98 1HG GLU 98 -12.971 -24.577 -9.665 739 H GLU 99 H GLU 99 -11.947 -23.622 -13.680 740 HA GLU 99 HA GLU 99 -13.623 -23.781 -15.856 741 HB2 GLU 99 2HB GLU 99 -12.595 -21.661 -15.109 742 HB3 GLU 99 1HB GLU 99 -10.983 -22.213 -15.670 743 HG2 GLU 99 2HG GLU 99 -11.654 -22.130 -18.004 744 HG3 GLU 99 1HG GLU 99 -13.400 -22.001 -17.574 745 H ARG 100 H ARG 100 -10.300 -24.962 -15.472 746 HA ARG 100 HA ARG 100 -9.786 -25.677 -18.093 747 HB2 ARG 100 2HB ARG 100 -8.134 -25.553 -16.252 748 HB3 ARG 100 1HB ARG 100 -8.870 -26.967 -15.444 749 HG2 ARG 100 2HG ARG 100 -7.807 -27.217 -18.314 750 HG3 ARG 100 1HG ARG 100 -6.631 -27.089 -16.976 751 HD2 ARG 100 2HD ARG 100 -8.796 -29.296 -17.203 752 HD3 ARG 100 1HD ARG 100 -7.027 -29.473 -17.556 753 HE ARG 100 HE ARG 100 -7.231 -28.404 -14.919 754 HH11 ARG 100 1HH2 ARG 100 -8.230 -31.472 -16.620 755 HH12 ARG 100 2HH2 ARG 100 -7.654 -32.471 -15.369 756 HH21 ARG 100 1HH1 ARG 100 -6.705 -29.728 -13.179 757 HH22 ARG 100 2HH1 ARG 100 -6.924 -31.453 -13.204 758 H ARG 101 H ARG 101 -11.734 -27.375 -15.639 759 HA ARG 101 HA ARG 101 -11.860 -29.794 -17.241 760 HB2 ARG 101 2HB ARG 101 -13.327 -28.942 -14.693 761 HB3 ARG 101 1HB ARG 101 -13.618 -30.500 -15.550 762 HG2 ARG 101 2HG ARG 101 -11.257 -31.174 -15.247 763 HG3 ARG 101 1HG ARG 101 -10.869 -29.602 -14.475 764 HD2 ARG 101 2HD ARG 101 -11.135 -31.459 -12.793 765 HD3 ARG 101 1HD ARG 101 -12.319 -30.101 -12.548 766 HE ARG 101 HE ARG 101 -13.345 -32.327 -14.248 767 HH11 ARG 101 1HH2 ARG 101 -12.585 -31.590 -10.803 768 HH12 ARG 101 2HH2 ARG 101 -13.994 -32.323 -10.162 769 HH21 ARG 101 1HH1 ARG 101 -15.377 -33.328 -13.330 770 HH22 ARG 101 2HH1 ARG 101 -15.472 -33.495 -11.635 771 H GLY 102 H GLY 102 -13.583 -26.742 -16.980 772 HA2 GLY 102 2HA GLY 102 -14.938 -25.970 -18.597 773 HA3 GLY 102 1HA GLY 102 -15.278 -27.638 -19.176 774 H HIS 103 H HIS 103 -15.614 -27.879 -15.939 775 HA HIS 103 HA HIS 103 -18.004 -26.394 -15.574 776 HB2 HIS 103 2HB HIS 103 -18.938 -28.468 -16.843 777 HB3 HIS 103 1HB HIS 103 -18.445 -29.441 -15.417 778 HD1 HIS 103 1HD HIS 103 -20.510 -26.271 -16.193 779 HD2 HIS 103 2HD HIS 103 -20.252 -29.282 -13.262 780 HE1 HIS 103 1HE HIS 103 -22.383 -25.871 -14.522 781 HE2 HIS 103 2HE HIS 103 -22.040 -27.571 -12.673 782 H1 SER 1 H SER 1 -2.731 -17.406 -24.529 783 HA SER 1 HA SER 1 -0.807 -17.281 -22.389 784 HB2 SER 1 2HB SER 1 -1.706 -14.841 -22.326 785 HB3 SER 1 1HB SER 1 -0.847 -15.306 -23.835 786 HG SER 1 1HG SER 1 -3.633 -15.220 -23.373 787 H ALA 2 H ALA 2 -2.237 -19.176 -21.692 788 HA ALA 2 HA ALA 2 -4.129 -20.091 -21.082 789 HB1 ALA 2 1HB ALA 2 -3.103 -18.810 -18.564 790 HB2 ALA 2 2HB ALA 2 -2.679 -20.392 -19.266 791 HB3 ALA 2 3HB ALA 2 -4.331 -20.136 -18.607 792 H ASP 3 H ASP 3 -5.332 -18.055 -18.583 793 HA ASP 3 HA ASP 3 -7.595 -17.372 -20.366 794 HB2 ASP 3 2HB ASP 3 -7.742 -19.453 -18.093 795 HB3 ASP 3 1HB ASP 3 -9.188 -18.533 -18.634 796 H HIS 4 H HIS 4 -6.395 -17.553 -16.955 797 HA HIS 4 HA HIS 4 -8.134 -15.311 -16.419 798 HB2 HIS 4 2HB HIS 4 -7.878 -15.545 -14.160 799 HB3 HIS 4 1HB HIS 4 -8.017 -17.198 -14.820 800 HD1 HIS 4 1HD HIS 4 -4.620 -17.178 -15.511 801 HD2 HIS 4 2HD HIS 4 -6.649 -16.329 -11.874 802 HE1 HIS 4 1HE HIS 4 -3.018 -17.534 -13.660 803 HE2 HIS 4 2HE HIS 4 -4.163 -16.940 -11.513 804 H GLU 5 H GLU 5 -5.032 -15.583 -17.626 805 HA GLU 5 HA GLU 5 -3.949 -13.242 -16.466 806 HB2 GLU 5 2HB GLU 5 -2.617 -13.722 -18.928 807 HB3 GLU 5 1HB GLU 5 -2.079 -14.138 -17.278 808 HG2 GLU 5 2HG GLU 5 -3.761 -15.991 -19.075 809 HG3 GLU 5 1HG GLU 5 -1.985 -16.054 -18.900 810 H ARG 6 H ARG 6 -6.150 -13.909 -19.203 811 HA ARG 6 HA ARG 6 -5.894 -11.277 -20.305 812 HB2 ARG 6 2HB ARG 6 -8.242 -13.258 -20.546 813 HB3 ARG 6 1HB ARG 6 -8.113 -11.679 -21.391 814 HG2 ARG 6 2HG ARG 6 -5.932 -12.502 -22.451 815 HG3 ARG 6 1HG ARG 6 -6.366 -14.149 -21.849 816 HD2 ARG 6 2HD ARG 6 -8.604 -13.927 -23.100 817 HD3 ARG 6 1HD ARG 6 -8.077 -12.314 -23.706 818 HE ARG 6 HE ARG 6 -6.855 -15.009 -24.358 819 HH11 ARG 6 1HH2 ARG 6 -7.148 -11.498 -25.344 820 HH12 ARG 6 2HH2 ARG 6 -7.149 -11.883 -27.009 821 HH21 ARG 6 1HH1 ARG 6 -6.623 -15.414 -26.566 822 HH22 ARG 6 2HH1 ARG 6 -6.739 -14.154 -27.726 823 H GLU 7 H GLU 7 -7.851 -12.788 -17.761 824 HA GLU 7 HA GLU 7 -9.735 -10.761 -17.442 825 HB2 GLU 7 2HB GLU 7 -9.651 -13.180 -16.414 826 HB3 GLU 7 1HB GLU 7 -8.579 -12.481 -15.163 827 HG2 GLU 7 2HG GLU 7 -10.802 -12.531 -14.231 828 HG3 GLU 7 1HG GLU 7 -10.483 -10.803 -14.629 829 H ALA 8 H ALA 8 -6.470 -11.261 -16.135 830 HA ALA 8 HA ALA 8 -6.475 -9.112 -14.347 831 HB1 ALA 8 1HB ALA 8 -3.961 -9.338 -14.384 832 HB2 ALA 8 2HB ALA 8 -4.090 -10.422 -15.815 833 HB3 ALA 8 3HB ALA 8 -4.761 -10.944 -14.224 834 H GLN 9 H GLN 9 -5.638 -9.334 -17.813 835 HA GLN 9 HA GLN 9 -4.512 -6.726 -17.977 836 HB2 GLN 9 2HB GLN 9 -5.874 -8.430 -20.161 837 HB3 GLN 9 1HB GLN 9 -4.925 -6.944 -20.473 838 HG2 GLN 9 2HG GLN 9 -3.735 -9.509 -19.196 839 HG3 GLN 9 1HG GLN 9 -3.699 -9.111 -20.945 840 HE21 GLN 9 1HE2 GLN 9 -2.515 -8.033 -17.693 841 HE22 GLN 9 2HE2 GLN 9 -1.323 -6.933 -18.296 842 H LYS 10 H LYS 10 -7.776 -8.055 -18.443 843 HA LYS 10 HA LYS 10 -8.959 -5.774 -19.490 844 HB2 LYS 10 2HB LYS 10 -9.854 -8.117 -19.522 845 HB3 LYS 10 1HB LYS 10 -10.191 -8.013 -17.761 846 HG2 LYS 10 2HG LYS 10 -11.920 -6.335 -18.125 847 HG3 LYS 10 1HG LYS 10 -11.422 -6.114 -19.848 848 HD2 LYS 10 2HD LYS 10 -12.152 -8.398 -20.420 849 HD3 LYS 10 1HD LYS 10 -12.451 -8.792 -18.695 850 HE2 LYS 10 2HE LYS 10 -14.568 -8.377 -20.014 851 HE3 LYS 10 1HE LYS 10 -14.383 -7.299 -18.575 852 HZ1 LYS 10 3HZ LYS 10 -13.539 -6.440 -21.302 853 HZ2 LYS 10 1HZ LYS 10 -13.845 -5.510 -19.922 854 HZ3 LYS 10 2HZ LYS 10 -15.141 -6.273 -20.727 855 H ALA 11 H ALA 11 -8.216 -6.678 -16.152 856 HA ALA 11 HA ALA 11 -9.862 -4.787 -14.886 857 HB1 ALA 11 1HB ALA 11 -8.479 -5.179 -12.873 858 HB2 ALA 11 2HB ALA 11 -7.185 -5.940 -13.877 859 HB3 ALA 11 3HB ALA 11 -8.790 -6.746 -13.696 860 H GLU 12 H GLU 12 -6.595 -4.540 -16.347 861 HA GLU 12 HA GLU 12 -5.984 -2.071 -15.100 862 HB2 GLU 12 2HB GLU 12 -4.762 -3.288 -17.645 863 HB3 GLU 12 1HB GLU 12 -4.166 -1.824 -16.796 864 HG2 GLU 12 2HG GLU 12 -3.856 -3.256 -14.691 865 HG3 GLU 12 1HG GLU 12 -4.194 -4.712 -15.690 866 H GLU 13 H GLU 13 -7.740 -2.994 -18.034 867 HA GLU 13 HA GLU 13 -7.823 -0.418 -19.171 868 HB2 GLU 13 2HB GLU 13 -9.792 -2.737 -19.605 869 HB3 GLU 13 1HB GLU 13 -9.470 -1.356 -20.714 870 HG2 GLU 13 2HG GLU 13 -7.051 -2.181 -20.930 871 HG3 GLU 13 1HG GLU 13 -7.484 -3.607 -19.922 872 H GLU 14 H GLU 14 -9.898 -2.169 -16.859 873 HA GLU 14 HA GLU 14 -12.044 -0.355 -16.882 874 HB2 GLU 14 2HB GLU 14 -12.265 -2.627 -15.884 875 HB3 GLU 14 1HB GLU 14 -11.064 -2.193 -14.623 876 HG2 GLU 14 2HG GLU 14 -13.285 -2.159 -13.638 877 HG3 GLU 14 1HG GLU 14 -12.672 -0.473 -13.700 878 H LEU 15 H LEU 15 -8.996 -0.494 -15.006 879 HA LEU 15 HA LEU 15 -9.632 1.604 -13.314 880 HB2 LEU 15 2HB LEU 15 -7.705 0.048 -12.978 881 HB3 LEU 15 1HB LEU 15 -6.827 0.844 -14.321 882 HG LEU 15 HG LEU 15 -6.704 2.956 -13.036 883 HD11 LEU 15 1HD1 LEU 15 -8.418 1.515 -10.910 884 HD12 LEU 15 2HD1 LEU 15 -8.835 3.012 -11.827 885 HD13 LEU 15 3HD1 LEU 15 -7.517 3.046 -10.618 886 HD21 LEU 15 3HD2 LEU 15 -5.241 2.201 -11.159 887 HD22 LEU 15 1HD2 LEU 15 -4.943 1.222 -12.640 888 HD23 LEU 15 2HD2 LEU 15 -5.910 0.536 -11.284 889 H GLN 16 H GLN 16 -8.093 1.658 -16.550 890 HA GLN 16 HA GLN 16 -7.481 4.381 -16.641 891 HB2 GLN 16 2HB GLN 16 -8.388 2.669 -19.028 892 HB3 GLN 16 1HB GLN 16 -7.495 4.224 -19.111 893 HG2 GLN 16 2HG GLN 16 -6.397 1.546 -18.029 894 HG3 GLN 16 1HG GLN 16 -6.036 2.309 -19.602 895 HE21 GLN 16 1HE2 GLN 16 -5.340 2.371 -16.133 896 HE22 GLN 16 2HE2 GLN 16 -4.106 3.595 -16.199 897 H LYS 17 H LYS 17 -10.501 2.652 -17.372 898 HA LYS 17 HA LYS 17 -11.858 4.771 -18.603 899 HB2 LYS 17 2HB LYS 17 -12.539 2.317 -18.643 900 HB3 LYS 17 1HB LYS 17 -12.959 2.455 -16.915 901 HG2 LYS 17 2HG LYS 17 -14.682 4.312 -17.656 902 HG3 LYS 17 1HG LYS 17 -14.330 3.784 -19.334 903 HD2 LYS 17 2HD LYS 17 -16.317 2.608 -18.623 904 HD3 LYS 17 1HD LYS 17 -14.974 1.397 -18.586 905 HE2 LYS 17 2HE LYS 17 -14.756 1.894 -16.041 906 HE3 LYS 17 1HE LYS 17 -16.237 2.908 -16.187 907 HZ1 LYS 17 3HZ LYS 17 -16.056 0.319 -15.602 908 HZ2 LYS 17 1HZ LYS 17 -16.469 0.180 -17.218 909 HZ3 LYS 17 2HZ LYS 17 -17.499 1.080 -16.151 910 H VAL 18 H VAL 18 -11.640 3.692 -15.180 911 HA VAL 18 HA VAL 18 -13.430 5.589 -14.158 912 HB VAL 18 HB VAL 18 -11.119 4.118 -12.793 913 HG11 VAL 18 1HG1 VAL 18 -12.428 4.582 -10.665 914 HG12 VAL 18 2HG1 VAL 18 -13.519 5.675 -11.596 915 HG13 VAL 18 3HG1 VAL 18 -11.771 6.080 -11.400 916 HG21 VAL 18 3HG2 VAL 18 -14.159 3.524 -12.974 917 HG22 VAL 18 1HG2 VAL 18 -12.952 2.571 -12.037 918 HG23 VAL 18 2HG2 VAL 18 -12.876 2.605 -13.825 919 H LEU 19 H LEU 19 -9.929 5.799 -14.944 920 HA LEU 19 HA LEU 19 -9.488 8.182 -13.511 921 HB2 LEU 19 2HB LEU 19 -8.022 7.515 -16.121 922 HB3 LEU 19 1HB LEU 19 -7.445 8.516 -14.745 923 HG LEU 19 HG LEU 19 -7.908 5.500 -14.847 924 HD11 LEU 19 1HD1 LEU 19 -5.539 5.166 -14.627 925 HD12 LEU 19 2HD1 LEU 19 -5.242 6.917 -14.403 926 HD13 LEU 19 3HD1 LEU 19 -5.823 6.299 -16.000 927 HD21 LEU 19 3HD2 LEU 19 -6.914 7.118 -12.420 928 HD22 LEU 19 1HD2 LEU 19 -6.978 5.319 -12.565 929 HD23 LEU 19 2HD2 LEU 19 -8.496 6.260 -12.544 930 H GLU 20 H GLU 20 -10.713 7.549 -16.817 931 HA GLU 20 HA GLU 20 -10.625 10.302 -17.570 932 HB2 GLU 20 2HB GLU 20 -12.361 8.060 -18.763 933 HB3 GLU 20 1HB GLU 20 -12.187 9.745 -19.360 934 HG2 GLU 20 2HG GLU 20 -9.652 9.282 -19.629 935 HG3 GLU 20 1HG GLU 20 -10.050 7.541 -19.381 936 H GLU 21 H GLU 21 -13.063 8.182 -16.021 937 HA GLU 21 HA GLU 21 -15.138 10.130 -16.075 938 HB2 GLU 21 2HB GLU 21 -14.655 7.834 -14.067 939 HB3 GLU 21 1HB GLU 21 -16.170 8.784 -14.209 940 HG2 GLU 21 2HG GLU 21 -16.577 7.886 -16.489 941 HG3 GLU 21 1HG GLU 21 -15.026 6.977 -16.431 942 H ALA 22 H ALA 22 -12.544 9.260 -13.815 943 HA ALA 22 HA ALA 22 -13.292 10.765 -11.649 944 HB1 ALA 22 1HB ALA 22 -10.467 9.973 -12.581 945 HB2 ALA 22 2HB ALA 22 -11.531 9.008 -11.500 946 HB3 ALA 22 3HB ALA 22 -10.865 10.583 -10.936 947 H SER 23 H SER 23 -11.497 11.765 -14.575 948 HA SER 23 HA SER 23 -10.611 14.191 -13.352 949 HB2 SER 23 2HB SER 23 -10.258 14.747 -15.968 950 HB3 SER 23 1HB SER 23 -9.173 13.682 -15.011 951 HG SER 23 1HG SER 23 -10.047 11.899 -15.854 952 H LYS 24 H LYS 24 -13.408 13.171 -15.304 953 HA LYS 24 HA LYS 24 -14.487 15.776 -15.602 954 HB2 LYS 24 2HB LYS 24 -15.252 14.022 -17.090 955 HB3 LYS 24 1HB LYS 24 -15.765 12.982 -15.731 956 HG2 LYS 24 2HG LYS 24 -17.078 15.725 -15.994 957 HG3 LYS 24 1HG LYS 24 -17.494 14.478 -17.217 958 HD2 LYS 24 2HD LYS 24 -18.794 13.267 -15.779 959 HD3 LYS 24 1HD LYS 24 -17.569 13.348 -14.485 960 HE2 LYS 24 2HE LYS 24 -19.578 14.361 -13.636 961 HE3 LYS 24 1HE LYS 24 -18.346 15.658 -13.827 962 HZ1 LYS 24 3HZ LYS 24 -20.833 15.788 -14.583 963 HZ2 LYS 24 1HZ LYS 24 -20.218 15.303 -16.076 964 HZ3 LYS 24 2HZ LYS 24 -19.647 16.728 -15.275 965 H LYS 25 H LYS 25 -14.882 13.177 -13.153 966 HA LYS 25 HA LYS 25 -16.822 14.622 -11.689 967 HB2 LYS 25 2HB LYS 25 -14.972 12.380 -10.745 968 HB3 LYS 25 1HB LYS 25 -16.320 13.084 -9.781 969 HG2 LYS 25 2HG LYS 25 -17.984 12.366 -11.471 970 HG3 LYS 25 1HG LYS 25 -16.679 11.696 -12.506 971 HD2 LYS 25 2HD LYS 25 -16.020 10.180 -10.546 972 HD3 LYS 25 1HD LYS 25 -17.527 10.682 -9.712 973 HE2 LYS 25 2HE LYS 25 -17.351 9.323 -12.505 974 HE3 LYS 25 1HE LYS 25 -17.689 8.458 -10.959 975 HZ1 LYS 25 3HZ LYS 25 -19.596 8.981 -12.378 976 HZ2 LYS 25 1HZ LYS 25 -19.447 10.628 -12.062 977 HZ3 LYS 25 2HZ LYS 25 -19.771 9.538 -10.778 978 H ALA 26 H ALA 26 -13.226 14.271 -11.165 979 HA ALA 26 HA ALA 26 -13.191 15.837 -8.879 980 HB1 ALA 26 1HB ALA 26 -10.741 16.047 -9.255 981 HB2 ALA 26 2HB ALA 26 -10.938 15.451 -10.951 982 HB3 ALA 26 3HB ALA 26 -11.286 14.361 -9.554 983 H VAL 27 H VAL 27 -12.855 16.821 -12.375 984 HA VAL 27 HA VAL 27 -12.179 19.451 -11.609 985 HB VAL 27 HB VAL 27 -11.657 18.449 -13.841 986 HG11 VAL 27 1HG1 VAL 27 -13.981 17.582 -14.397 987 HG12 VAL 27 2HG1 VAL 27 -13.272 18.627 -15.677 988 HG13 VAL 27 3HG1 VAL 27 -14.544 19.279 -14.589 989 HG21 VAL 27 3HG2 VAL 27 -13.034 21.215 -13.716 990 HG22 VAL 27 1HG2 VAL 27 -11.874 20.674 -14.970 991 HG23 VAL 27 2HG2 VAL 27 -11.334 20.842 -13.258 992 H GLU 28 H GLU 28 -15.348 17.861 -12.345 993 HA GLU 28 HA GLU 28 -16.661 20.374 -12.270 994 HB2 GLU 28 2HB GLU 28 -17.316 18.287 -13.593 995 HB3 GLU 28 1HB GLU 28 -17.996 17.626 -12.065 996 HG2 GLU 28 2HG GLU 28 -19.615 19.501 -11.952 997 HG3 GLU 28 1HG GLU 28 -18.814 20.339 -13.335 998 H ALA 29 H ALA 29 -15.885 17.881 -9.930 999 HA ALA 29 HA ALA 29 -17.561 18.736 -7.846 1000 HB1 ALA 29 1HB ALA 29 -15.997 17.253 -6.496 1001 HB2 ALA 29 2HB ALA 29 -14.899 17.158 -7.886 1002 HB3 ALA 29 3HB ALA 29 -16.551 16.450 -7.985 1003 H GLU 30 H GLU 30 -14.009 19.279 -8.552 1004 HA GLU 30 HA GLU 30 -13.700 21.060 -6.393 1005 HB2 GLU 30 2HB GLU 30 -12.058 20.456 -8.873 1006 HB3 GLU 30 1HB GLU 30 -11.597 21.827 -7.830 1007 HG2 GLU 30 2HG GLU 30 -12.113 19.196 -6.395 1008 HG3 GLU 30 1HG GLU 30 -10.664 19.268 -7.438 1009 H ARG 31 H ARG 31 -14.857 21.552 -9.713 1010 HA ARG 31 HA ARG 31 -14.564 24.365 -9.722 1011 HB2 ARG 31 2HB ARG 31 -16.394 22.473 -11.234 1012 HB3 ARG 31 1HB ARG 31 -16.566 24.235 -11.436 1013 HG2 ARG 31 2HG ARG 31 -13.851 22.881 -11.912 1014 HG3 ARG 31 1HG ARG 31 -15.143 22.788 -13.145 1015 HD2 ARG 31 2HD ARG 31 -13.799 25.356 -12.077 1016 HD3 ARG 31 1HD ARG 31 -13.630 24.627 -13.731 1017 HE ARG 31 HE ARG 31 -16.412 25.001 -13.343 1018 HH11 ARG 31 1HH2 ARG 31 -13.507 27.160 -13.524 1019 HH12 ARG 31 2HH2 ARG 31 -14.446 28.581 -13.724 1020 HH21 ARG 31 1HH1 ARG 31 -17.614 26.890 -13.425 1021 HH22 ARG 31 2HH1 ARG 31 -16.893 28.455 -13.416 1022 H GLY 32 H GLY 32 -15.289 25.397 -7.905 1023 HA2 GLY 32 2HA GLY 32 -17.409 26.728 -7.656 1024 HA3 GLY 32 1HA GLY 32 -18.149 25.118 -7.268 1025 H ALA 33 H ALA 33 -15.500 24.149 -6.184 1026 HA ALA 33 HA ALA 33 -16.299 24.741 -3.544 1027 HB1 ALA 33 1HB ALA 33 -14.575 23.041 -2.891 1028 HB2 ALA 33 2HB ALA 33 -13.982 23.007 -4.592 1029 HB3 ALA 33 3HB ALA 33 -15.643 22.433 -4.211 1030 HA PRO 34 HA PRO 34 -12.948 27.687 -2.961 1031 HB2 PRO 34 2HB PRO 34 -12.998 28.049 -0.199 1032 HB3 PRO 34 1HB PRO 34 -14.333 28.630 -1.265 1033 HG2 PRO 34 2HG PRO 34 -14.224 26.011 0.331 1034 HG3 PRO 34 1HG PRO 34 -15.578 27.220 0.264 1035 HD2 PRO 34 2HD PRO 34 -15.514 24.916 -1.310 1036 HD3 PRO 34 1HD PRO 34 -16.232 26.468 -1.925 1037 H GLY 35 H GLY 35 -10.653 27.650 -2.448 1038 HA2 GLY 35 2HA GLY 35 -8.792 26.888 -1.448 1039 HA3 GLY 35 1HA GLY 35 -9.717 25.532 -0.692 1040 H ALA 36 H ALA 36 -10.923 25.200 -3.474 1041 HA ALA 36 HA ALA 36 -9.591 23.022 -4.383 1042 HB1 ALA 36 1HB ALA 36 -10.960 23.392 -6.484 1043 HB2 ALA 36 2HB ALA 36 -11.383 25.047 -5.909 1044 HB3 ALA 36 3HB ALA 36 -11.944 23.584 -5.009 1045 H ALA 37 H ALA 37 -7.616 22.918 -5.243 1046 HA ALA 37 HA ALA 37 -6.478 25.286 -6.618 1047 HB1 ALA 37 1HB ALA 37 -5.084 24.434 -4.692 1048 HB2 ALA 37 2HB ALA 37 -4.257 24.145 -6.262 1049 HB3 ALA 37 3HB ALA 37 -5.097 22.789 -5.420 1050 H LEU 38 H LEU 38 -7.880 22.091 -6.961 1051 HA LEU 38 HA LEU 38 -6.331 21.398 -9.300 1052 HB2 LEU 38 2HB LEU 38 -7.030 19.683 -7.609 1053 HB3 LEU 38 1HB LEU 38 -8.735 20.074 -7.897 1054 HG LEU 38 HG LEU 38 -7.192 19.199 -10.330 1055 HD11 LEU 38 1HD1 LEU 38 -7.883 17.255 -8.033 1056 HD12 LEU 38 2HD1 LEU 38 -6.234 17.660 -8.628 1057 HD13 LEU 38 3HD1 LEU 38 -7.386 16.783 -9.698 1058 HD21 LEU 38 3HD2 LEU 38 -9.260 17.900 -10.808 1059 HD22 LEU 38 1HD2 LEU 38 -9.735 19.579 -10.375 1060 HD23 LEU 38 2HD2 LEU 38 -9.912 18.265 -9.173 1061 H ILE 39 H ILE 39 -8.891 23.386 -8.543 1062 HA ILE 39 HA ILE 39 -10.860 22.972 -10.345 1063 HB ILE 39 HB ILE 39 -10.985 24.333 -8.382 1064 HG12 ILE 39 2HG1 ILE 39 -11.722 26.026 -10.836 1065 HG13 ILE 39 1HG1 ILE 39 -12.626 24.604 -10.220 1066 HG21 ILE 39 1HG2 ILE 39 -9.348 26.519 -9.827 1067 HG22 ILE 39 2HG2 ILE 39 -8.689 25.417 -8.570 1068 HG23 ILE 39 3HG2 ILE 39 -10.004 26.556 -8.157 1069 HD11 ILE 39 3HD ILE 39 -12.090 27.250 -8.703 1070 HD12 ILE 39 1HD ILE 39 -13.662 26.711 -9.388 1071 HD13 ILE 39 2HD ILE 39 -12.930 25.809 -7.999 1072 H SER 40 H SER 40 -9.454 22.302 -12.225 1073 HA SER 40 HA SER 40 -8.884 24.563 -14.034 1074 HB2 SER 40 2HB SER 40 -7.234 22.001 -13.483 1075 HB3 SER 40 1HB SER 40 -6.801 23.316 -14.656 1076 HG SER 40 1HG SER 40 -5.806 23.169 -12.511 1077 H TYR 41 H TYR 41 -7.813 21.701 -15.303 1078 HA TYR 41 HA TYR 41 -9.928 20.280 -16.200 1079 HB2 TYR 41 2HB TYR 41 -9.455 22.735 -17.943 1080 HB3 TYR 41 1HB TYR 41 -9.541 21.159 -18.803 1081 HD1 TYR 41 1HD TYR 41 -11.551 19.602 -18.242 1082 HD2 TYR 41 2HD TYR 41 -11.507 23.846 -17.544 1083 HE1 TYR 41 1HE TYR 41 -14.006 19.658 -18.419 1084 HE2 TYR 41 2HE TYR 41 -13.951 23.908 -17.705 1085 HH TYR 41 HH TYR 41 -15.862 22.744 -18.159 1086 HA PRO 42 HA PRO 42 -6.301 19.099 -18.767 1087 HB2 PRO 42 2HB PRO 42 -3.859 20.503 -18.926 1088 HB3 PRO 42 1HB PRO 42 -5.273 20.828 -19.999 1089 HG2 PRO 42 2HG PRO 42 -4.509 22.297 -17.415 1090 HG3 PRO 42 1HG PRO 42 -4.938 23.016 -19.019 1091 HD2 PRO 42 2HD PRO 42 -6.800 22.778 -17.005 1092 HD3 PRO 42 1HD PRO 42 -7.270 22.444 -18.735 1093 H ASP 43 H ASP 43 -5.240 20.696 -15.717 1094 HA ASP 43 HA ASP 43 -3.487 18.515 -15.120 1095 HB2 ASP 43 2HB ASP 43 -3.172 19.839 -12.920 1096 HB3 ASP 43 1HB ASP 43 -2.547 20.525 -14.450 1097 H ALA 44 H ALA 44 -6.787 18.688 -15.104 1098 HA ALA 44 HA ALA 44 -7.316 17.687 -12.479 1099 HB1 ALA 44 1HB ALA 44 -9.555 17.022 -13.370 1100 HB2 ALA 44 2HB ALA 44 -9.011 17.389 -15.048 1101 HB3 ALA 44 3HB ALA 44 -9.164 18.713 -13.835 1102 H ILE 45 H ILE 45 -6.832 16.254 -15.731 1103 HA ILE 45 HA ILE 45 -7.183 13.605 -14.771 1104 HB ILE 45 HB ILE 45 -7.773 14.296 -17.046 1105 HG12 ILE 45 2HG1 ILE 45 -5.633 12.087 -17.050 1106 HG13 ILE 45 1HG1 ILE 45 -7.301 11.909 -16.420 1107 HG21 ILE 45 1HG2 ILE 45 -6.024 14.713 -18.762 1108 HG22 ILE 45 2HG2 ILE 45 -4.729 14.553 -17.527 1109 HG23 ILE 45 3HG2 ILE 45 -5.900 15.916 -17.443 1110 HD11 ILE 45 3HD ILE 45 -6.553 12.597 -19.343 1111 HD12 ILE 45 1HD ILE 45 -7.178 11.027 -18.725 1112 HD13 ILE 45 2HD ILE 45 -8.234 12.485 -18.689 1113 H TRP 46 H TRP 46 -4.553 15.800 -14.679 1114 HA TRP 46 HA TRP 46 -2.500 13.855 -14.758 1115 HB2 TRP 46 2HB TRP 46 -2.217 16.405 -15.097 1116 HB3 TRP 46 1HB TRP 46 -2.374 16.575 -13.313 1117 HD1 TRP 46 HD TRP 46 0.105 15.348 -16.049 1118 HE1 TRP 46 1HE TRP 46 2.372 14.954 -14.890 1119 HE3 TRP 46 3HE TRP 46 -1.306 15.938 -11.171 1120 HZ2 TRP 46 2HZ TRP 46 3.358 14.515 -12.262 1121 HZ3 TRP 46 3HZ TRP 46 0.327 15.469 -9.395 1122 HH2 TRP 46 HH TRP 46 2.631 14.764 -9.931 1123 H TRP 47 H TRP 47 -4.352 15.458 -12.137 1124 HA TRP 47 HA TRP 47 -3.070 14.042 -10.066 1125 HB2 TRP 47 2HB TRP 47 -4.291 16.193 -9.726 1126 HB3 TRP 47 1HB TRP 47 -5.832 15.380 -10.158 1127 HD1 TRP 47 HD TRP 47 -3.047 15.109 -7.343 1128 HE1 TRP 47 1HE TRP 47 -4.288 14.710 -5.136 1129 HE3 TRP 47 3HE TRP 47 -7.746 14.454 -9.212 1130 HZ2 TRP 47 2HZ TRP 47 -6.893 13.832 -4.323 1131 HZ3 TRP 47 3HZ TRP 47 -9.600 13.913 -7.659 1132 HH2 TRP 47 HH TRP 47 -9.179 13.634 -5.255 1133 H SER 48 H SER 48 -6.154 13.446 -11.937 1134 HA SER 48 HA SER 48 -7.066 11.434 -10.371 1135 HB2 SER 48 2HB SER 48 -7.312 11.387 -13.438 1136 HB3 SER 48 1HB SER 48 -8.438 10.663 -12.230 1137 HG SER 48 1HG SER 48 -8.857 12.795 -11.504 1138 H VAL 49 H VAL 49 -4.475 11.129 -12.815 1139 HA VAL 49 HA VAL 49 -4.623 8.267 -12.741 1140 HB VAL 49 HB VAL 49 -2.443 10.078 -13.795 1141 HG11 VAL 49 1HG1 VAL 49 -1.560 7.780 -13.318 1142 HG12 VAL 49 2HG1 VAL 49 -1.789 7.942 -15.088 1143 HG13 VAL 49 3HG1 VAL 49 -2.991 7.030 -14.107 1144 HG21 VAL 49 3HG2 VAL 49 -4.652 10.420 -14.945 1145 HG22 VAL 49 1HG2 VAL 49 -4.761 8.673 -15.281 1146 HG23 VAL 49 2HG2 VAL 49 -3.446 9.650 -16.018 1147 H GLU 50 H GLU 50 -2.623 10.794 -11.043 1148 HA GLU 50 HA GLU 50 -0.973 8.991 -9.696 1149 HB2 GLU 50 2HB GLU 50 -2.058 11.671 -8.618 1150 HB3 GLU 50 1HB GLU 50 -0.635 10.768 -7.987 1151 HG2 GLU 50 2HG GLU 50 -0.779 12.027 -10.801 1152 HG3 GLU 50 1HG GLU 50 -0.072 12.799 -9.347 1153 H THR 51 H THR 51 -4.237 10.323 -8.932 1154 HA THR 51 HA THR 51 -4.458 9.449 -6.358 1155 HB THR 51 HB THR 51 -6.804 9.359 -8.321 1156 HG1 THR 51 1HG THR 51 -5.540 11.630 -7.189 1157 HG21 THR 51 3HG2 THR 51 -6.623 10.234 -5.346 1158 HG22 THR 51 1HG2 THR 51 -7.304 8.673 -5.935 1159 HG23 THR 51 2HG2 THR 51 -8.105 10.223 -6.366 1160 H ALA 52 H ALA 52 -4.929 7.593 -9.357 1161 HA ALA 52 HA ALA 52 -6.308 5.436 -8.153 1162 HB1 ALA 52 1HB ALA 52 -6.418 5.855 -10.569 1163 HB2 ALA 52 2HB ALA 52 -5.743 4.210 -10.281 1164 HB3 ALA 52 3HB ALA 52 -4.644 5.567 -10.746 1165 H THR 53 H THR 53 -2.898 6.304 -8.270 1166 HA THR 53 HA THR 53 -2.095 3.559 -7.784 1167 HB THR 53 HB THR 53 0.170 4.378 -7.701 1168 HG1 THR 53 1HG THR 53 -0.982 6.988 -8.018 1169 HG21 THR 53 3HG2 THR 53 0.318 5.215 -10.040 1170 HG22 THR 53 1HG2 THR 53 -1.426 5.643 -10.057 1171 HG23 THR 53 2HG2 THR 53 -0.921 3.915 -9.932 1172 H THR 54 H THR 54 -3.339 6.156 -6.020 1173 HA THR 54 HA THR 54 -3.759 6.566 -3.998 1174 HB THR 54 HB THR 54 -3.712 5.090 -2.157 1175 HG1 THR 54 1HG THR 54 -1.762 3.807 -3.665 1176 HG21 THR 54 3HG2 THR 54 -4.247 3.392 -4.706 1177 HG22 THR 54 1HG2 THR 54 -5.315 4.724 -4.172 1178 HG23 THR 54 2HG2 THR 54 -5.063 3.292 -3.105 1179 H VAL 55 H VAL 55 -0.777 6.702 -5.297 1180 HA VAL 55 HA VAL 55 0.868 6.884 -3.093 1181 HB VAL 55 HB VAL 55 1.579 6.500 -5.466 1182 HG11 VAL 55 1HG1 VAL 55 1.562 9.568 -5.796 1183 HG12 VAL 55 2HG1 VAL 55 0.294 8.489 -6.498 1184 HG13 VAL 55 3HG1 VAL 55 2.004 8.316 -6.993 1185 HG21 VAL 55 3HG2 VAL 55 3.185 6.904 -3.626 1186 HG22 VAL 55 1HG2 VAL 55 3.063 8.681 -3.855 1187 HG23 VAL 55 2HG2 VAL 55 3.775 7.656 -5.156 1188 H GLY 56 H GLY 56 -0.769 9.476 -4.932 1189 HA2 GLY 56 2HA GLY 56 -1.462 11.502 -4.297 1190 HA3 GLY 56 1HA GLY 56 -1.513 10.803 -2.637 1191 H TYR 57 H TYR 57 1.315 11.546 -4.733 1192 HA TYR 57 HA TYR 57 3.047 12.195 -2.897 1193 HB2 TYR 57 2HB TYR 57 2.696 13.625 -5.624 1194 HB3 TYR 57 1HB TYR 57 4.136 13.896 -4.582 1195 HD1 TYR 57 2HD TYR 57 5.398 11.763 -3.734 1196 HD2 TYR 57 1HD TYR 57 2.959 11.976 -7.283 1197 HE1 TYR 57 2HE TYR 57 6.778 10.018 -4.792 1198 HE2 TYR 57 1HE TYR 57 4.314 10.248 -8.330 1199 HH TYR 57 HH TYR 57 7.280 8.936 -6.779 1200 H GLY 58 H GLY 58 0.496 14.460 -3.741 1201 HA2 GLY 58 2HA GLY 58 -0.041 15.999 -2.068 1202 HA3 GLY 58 1HA GLY 58 1.699 16.380 -1.834 1203 H ASP 59 H ASP 59 0.841 15.994 -5.126 1204 HA ASP 59 HA ASP 59 1.462 18.666 -5.688 1205 HB2 ASP 59 2HB ASP 59 1.891 16.883 -7.351 1206 HB3 ASP 59 1HB ASP 59 0.117 16.604 -7.522 1207 H ARG 60 H ARG 60 -1.785 16.985 -5.798 1208 HA ARG 60 HA ARG 60 -2.986 19.636 -5.415 1209 HB2 ARG 60 2HB ARG 60 -3.949 17.469 -7.356 1210 HB3 ARG 60 1HB ARG 60 -5.121 18.522 -6.508 1211 HG2 ARG 60 2HG ARG 60 -4.842 19.420 -8.650 1212 HG3 ARG 60 1HG ARG 60 -4.073 20.555 -7.484 1213 HD2 ARG 60 2HD ARG 60 -1.817 19.795 -8.182 1214 HD3 ARG 60 1HD ARG 60 -2.524 18.527 -9.268 1215 HE ARG 60 HE ARG 60 -3.740 20.772 -10.264 1216 HH11 ARG 60 1HH2 ARG 60 -0.263 19.913 -9.698 1217 HH12 ARG 60 2HH2 ARG 60 0.363 21.278 -10.484 1218 HH21 ARG 60 1HH1 ARG 60 -2.905 22.284 -11.778 1219 HH22 ARG 60 2HH1 ARG 60 -1.216 22.710 -11.782 1220 H TYR 61 H TYR 61 -5.031 19.437 -4.148 1221 HA TYR 61 HA TYR 61 -5.184 17.033 -2.581 1222 HB2 TYR 61 2HB TYR 61 -5.561 18.476 -0.508 1223 HB3 TYR 61 1HB TYR 61 -3.862 18.510 -1.097 1224 HD1 TYR 61 1HD TYR 61 -7.006 20.431 -0.767 1225 HD2 TYR 61 2HD TYR 61 -2.927 20.583 -2.120 1226 HE1 TYR 61 1HE TYR 61 -7.209 22.847 -1.066 1227 HE2 TYR 61 2HE TYR 61 -3.111 23.028 -2.401 1228 HH TYR 61 HH TYR 61 -6.281 24.605 -2.236 1229 HA PRO 62 HA PRO 62 -9.354 18.605 -3.694 1230 HB2 PRO 62 2HB PRO 62 -10.897 16.469 -2.842 1231 HB3 PRO 62 1HB PRO 62 -9.702 16.239 -4.166 1232 HG2 PRO 62 2HG PRO 62 -9.351 15.593 -1.182 1233 HG3 PRO 62 1HG PRO 62 -8.999 14.524 -2.604 1234 HD2 PRO 62 2HD PRO 62 -7.095 16.178 -1.288 1235 HD3 PRO 62 1HD PRO 62 -6.945 15.663 -3.031 1236 H VAL 63 H VAL 63 -11.633 18.575 -2.229 1237 HA VAL 63 HA VAL 63 -10.929 19.102 0.555 1238 HB VAL 63 HB VAL 63 -10.718 21.162 -0.814 1239 HG11 VAL 63 1HG1 VAL 63 -12.431 20.760 -2.515 1240 HG12 VAL 63 2HG1 VAL 63 -12.676 22.333 -1.707 1241 HG13 VAL 63 3HG1 VAL 63 -13.759 20.949 -1.309 1242 HG21 VAL 63 3HG2 VAL 63 -11.725 22.687 0.709 1243 HG22 VAL 63 1HG2 VAL 63 -11.148 21.260 1.637 1244 HG23 VAL 63 2HG2 VAL 63 -12.913 21.501 1.323 1245 H THR 64 H THR 64 -13.623 20.067 1.079 1246 HA THR 64 HA THR 64 -14.866 17.452 1.337 1247 HB THR 64 HB THR 64 -15.343 20.196 2.630 1248 HG1 THR 64 1HG THR 64 -13.456 19.126 3.281 1249 HG21 THR 64 3HG2 THR 64 -17.515 18.955 2.651 1250 HG22 THR 64 1HG2 THR 64 -16.781 18.975 4.285 1251 HG23 THR 64 2HG2 THR 64 -16.698 17.487 3.289 1252 H GLU 65 H GLU 65 -15.539 20.698 -0.130 1253 HA GLU 65 HA GLU 65 -18.259 20.041 -0.518 1254 HB2 GLU 65 2HB GLU 65 -17.280 22.432 -0.270 1255 HB3 GLU 65 1HB GLU 65 -16.896 22.314 -2.020 1256 HG2 GLU 65 2HG GLU 65 -19.331 21.835 -2.489 1257 HG3 GLU 65 1HG GLU 65 -19.685 21.893 -0.728 1258 H GLU 66 H GLU 66 -15.312 19.491 -2.377 1259 HA GLU 66 HA GLU 66 -16.503 19.006 -4.839 1260 HB2 GLU 66 2HB GLU 66 -14.415 18.226 -5.558 1261 HB3 GLU 66 1HB GLU 66 -13.999 19.342 -4.263 1262 HG2 GLU 66 2HG GLU 66 -12.550 17.630 -3.852 1263 HG3 GLU 66 1HG GLU 66 -13.872 17.080 -2.758 1264 H GLY 67 H GLY 67 -16.266 17.283 -1.886 1265 HA2 GLY 67 2HA GLY 67 -17.742 15.756 -1.101 1266 HA3 GLY 67 1HA GLY 67 -18.275 15.390 -2.799 1267 H ARG 68 H ARG 68 -15.317 15.488 -0.820 1268 HA ARG 68 HA ARG 68 -13.409 14.278 -1.816 1269 HB2 ARG 68 2HB ARG 68 -13.405 15.043 0.481 1270 HB3 ARG 68 1HB ARG 68 -14.438 13.655 0.989 1271 HG2 ARG 68 2HG ARG 68 -12.656 12.076 0.644 1272 HG3 ARG 68 1HG ARG 68 -11.610 13.289 -0.163 1273 HD2 ARG 68 2HD ARG 68 -12.569 13.712 2.753 1274 HD3 ARG 68 1HD ARG 68 -11.197 12.609 2.415 1275 HE ARG 68 HE ARG 68 -11.152 15.532 2.317 1276 HH11 ARG 68 1HH2 ARG 68 -9.563 12.624 0.915 1277 HH12 ARG 68 2HH2 ARG 68 -8.017 13.132 1.451 1278 HH21 ARG 68 1HH1 ARG 68 -8.965 16.334 2.602 1279 HH22 ARG 68 2HH1 ARG 68 -7.668 15.422 1.961 1280 H LYS 69 H LYS 69 -16.258 12.493 -1.252 1281 HA LYS 69 HA LYS 69 -15.301 9.885 -1.636 1282 HB2 LYS 69 2HB LYS 69 -18.083 11.059 -2.089 1283 HB3 LYS 69 1HB LYS 69 -17.645 9.311 -2.027 1284 HG2 LYS 69 2HG LYS 69 -16.702 9.641 0.269 1285 HG3 LYS 69 1HG LYS 69 -17.305 11.325 0.311 1286 HD2 LYS 69 2HD LYS 69 -19.435 10.696 0.795 1287 HD3 LYS 69 1HD LYS 69 -19.453 9.364 -0.406 1288 HE2 LYS 69 2HE LYS 69 -17.947 9.153 2.300 1289 HE3 LYS 69 1HE LYS 69 -19.667 8.639 2.065 1290 HZ1 LYS 69 3HZ LYS 69 -17.427 7.556 0.371 1291 HZ2 LYS 69 1HZ LYS 69 -19.052 7.052 0.517 1292 HZ3 LYS 69 2HZ LYS 69 -17.962 6.858 1.807 1293 H VAL 70 H VAL 70 -15.157 12.533 -3.852 1294 HA VAL 70 HA VAL 70 -15.602 10.910 -6.188 1295 HB VAL 70 HB VAL 70 -13.958 13.484 -5.901 1296 HG11 VAL 70 1HG1 VAL 70 -14.851 11.849 -8.368 1297 HG12 VAL 70 2HG1 VAL 70 -13.157 12.165 -7.828 1298 HG13 VAL 70 3HG1 VAL 70 -14.165 13.526 -8.403 1299 HG21 VAL 70 3HG2 VAL 70 -16.864 12.961 -6.829 1300 HG22 VAL 70 1HG2 VAL 70 -15.941 14.499 -7.078 1301 HG23 VAL 70 2HG2 VAL 70 -16.297 13.956 -5.420 1302 H ALA 71 H ALA 71 -12.819 12.211 -4.370 1303 HA ALA 71 HA ALA 71 -10.806 10.837 -5.626 1304 HB1 ALA 71 1HB ALA 71 -10.891 11.528 -2.614 1305 HB2 ALA 71 2HB ALA 71 -10.536 12.719 -3.903 1306 HB3 ALA 71 3HB ALA 71 -9.421 11.328 -3.639 1307 H GLU 72 H GLU 72 -12.744 9.886 -2.810 1308 HA GLU 72 HA GLU 72 -11.566 7.565 -2.000 1309 HB2 GLU 72 2HB GLU 72 -13.562 8.715 -0.918 1310 HB3 GLU 72 1HB GLU 72 -14.583 8.063 -2.251 1311 HG2 GLU 72 2HG GLU 72 -14.064 5.716 -1.441 1312 HG3 GLU 72 1HG GLU 72 -13.162 6.427 -0.047 1313 H GLN 73 H GLN 73 -13.982 7.979 -4.656 1314 HA GLN 73 HA GLN 73 -14.150 5.211 -5.178 1315 HB2 GLN 73 2HB GLN 73 -15.986 6.669 -5.899 1316 HB3 GLN 73 1HB GLN 73 -14.863 7.636 -6.905 1317 HG2 GLN 73 2HG GLN 73 -16.270 6.247 -8.322 1318 HG3 GLN 73 1HG GLN 73 -14.568 5.714 -8.492 1319 HE21 GLN 73 1HE2 GLN 73 -13.966 3.708 -7.059 1320 HE22 GLN 73 2HE2 GLN 73 -15.187 2.472 -6.912 1321 H VAL 74 H VAL 74 -12.030 7.829 -6.489 1322 HA VAL 74 HA VAL 74 -11.089 6.246 -8.627 1323 HB VAL 74 HB VAL 74 -9.415 8.439 -7.319 1324 HG11 VAL 74 1HG1 VAL 74 -8.661 8.758 -9.701 1325 HG12 VAL 74 2HG1 VAL 74 -9.748 7.424 -10.236 1326 HG13 VAL 74 3HG1 VAL 74 -8.351 7.078 -9.155 1327 HG21 VAL 74 3HG2 VAL 74 -11.873 8.761 -9.159 1328 HG22 VAL 74 1HG2 VAL 74 -10.623 10.036 -8.867 1329 HG23 VAL 74 2HG2 VAL 74 -11.608 9.448 -7.511 1330 H MET 75 H MET 75 -9.772 6.925 -5.331 1331 HA MET 75 HA MET 75 -7.463 5.349 -5.784 1332 HB2 MET 75 2HB MET 75 -7.027 5.482 -3.354 1333 HB3 MET 75 1HB MET 75 -7.331 7.064 -4.127 1334 HG2 MET 75 2HG MET 75 -9.752 6.874 -3.215 1335 HG3 MET 75 1HG MET 75 -9.223 5.424 -2.327 1336 HE1 MET 75 3HE MET 75 -8.855 9.219 -2.949 1337 HE2 MET 75 1HE MET 75 -7.092 8.891 -2.938 1338 HE3 MET 75 2HE MET 75 -7.841 9.829 -1.603 1339 H LYS 76 H LYS 76 -10.678 4.594 -4.298 1340 HA LYS 76 HA LYS 76 -9.817 2.061 -3.442 1341 HB2 LYS 76 2HB LYS 76 -11.832 3.404 -2.613 1342 HB3 LYS 76 1HB LYS 76 -12.753 2.769 -4.006 1343 HG2 LYS 76 2HG LYS 76 -11.249 0.881 -2.080 1344 HG3 LYS 76 1HG LYS 76 -12.758 1.680 -1.538 1345 HD2 LYS 76 2HD LYS 76 -14.043 0.652 -3.382 1346 HD3 LYS 76 1HD LYS 76 -12.570 -0.191 -3.981 1347 HE2 LYS 76 2HE LYS 76 -12.385 -1.514 -1.903 1348 HE3 LYS 76 1HE LYS 76 -13.720 -0.581 -1.127 1349 HZ1 LYS 76 3HZ LYS 76 -14.044 -2.311 -3.550 1350 HZ2 LYS 76 1HZ LYS 76 -15.266 -1.536 -2.658 1351 HZ3 LYS 76 2HZ LYS 76 -14.388 -2.744 -1.900 1352 H ALA 77 H ALA 77 -11.135 3.246 -6.524 1353 HA ALA 77 HA ALA 77 -11.700 0.731 -7.653 1354 HB1 ALA 77 1HB ALA 77 -12.485 2.853 -8.751 1355 HB2 ALA 77 2HB ALA 77 -11.483 1.875 -9.881 1356 HB3 ALA 77 3HB ALA 77 -10.772 3.317 -9.062 1357 H GLY 78 H GLY 78 -8.703 2.663 -7.383 1358 HA2 GLY 78 2HA GLY 78 -7.132 1.064 -9.090 1359 HA3 GLY 78 1HA GLY 78 -6.581 2.158 -7.762 1360 H ILE 79 H ILE 79 -7.571 1.060 -5.520 1361 HA ILE 79 HA ILE 79 -5.784 -0.949 -4.952 1362 HB ILE 79 HB ILE 79 -8.380 -0.232 -3.504 1363 HG12 ILE 79 2HG1 ILE 79 -5.444 0.565 -2.954 1364 HG13 ILE 79 1HG1 ILE 79 -6.625 1.615 -3.783 1365 HG21 ILE 79 1HG2 ILE 79 -7.621 -2.532 -2.802 1366 HG22 ILE 79 2HG2 ILE 79 -7.307 -1.357 -1.494 1367 HG23 ILE 79 3HG2 ILE 79 -5.952 -1.901 -2.535 1368 HD11 ILE 79 3HD ILE 79 -6.800 0.628 -0.860 1369 HD12 ILE 79 1HD ILE 79 -6.465 2.293 -1.433 1370 HD13 ILE 79 2HD ILE 79 -8.094 1.570 -1.701 1371 H GLU 80 H GLU 80 -9.350 -1.299 -5.661 1372 HA GLU 80 HA GLU 80 -9.040 -4.123 -5.290 1373 HB2 GLU 80 2HB GLU 80 -11.356 -4.415 -5.897 1374 HB3 GLU 80 1HB GLU 80 -11.138 -3.185 -4.622 1375 HG2 GLU 80 2HG GLU 80 -11.603 -1.346 -6.190 1376 HG3 GLU 80 1HG GLU 80 -11.562 -2.459 -7.595 1377 H VAL 81 H VAL 81 -8.182 -2.179 -7.947 1378 HA VAL 81 HA VAL 81 -8.692 -4.248 -9.926 1379 HB VAL 81 HB VAL 81 -7.507 -1.458 -9.999 1380 HG11 VAL 81 1HG1 VAL 81 -7.159 -3.634 -12.173 1381 HG12 VAL 81 2HG1 VAL 81 -5.862 -2.687 -11.353 1382 HG13 VAL 81 3HG1 VAL 81 -6.996 -1.874 -12.475 1383 HG21 VAL 81 3HG2 VAL 81 -10.009 -1.902 -10.214 1384 HG22 VAL 81 1HG2 VAL 81 -9.681 -2.926 -11.658 1385 HG23 VAL 81 2HG2 VAL 81 -9.301 -1.165 -11.695 1386 H PHE 82 H PHE 82 -5.840 -2.654 -8.327 1387 HA PHE 82 HA PHE 82 -3.947 -4.410 -9.393 1388 HB2 PHE 82 2HB PHE 82 -3.840 -3.060 -6.612 1389 HB3 PHE 82 1HB PHE 82 -2.426 -3.657 -7.553 1390 HD1 PHE 82 2HD PHE 82 -3.095 -2.522 -10.326 1391 HD2 PHE 82 1HD PHE 82 -3.383 -0.816 -6.380 1392 HE1 PHE 82 2HE PHE 82 -2.865 -0.262 -11.277 1393 HE2 PHE 82 1HE PHE 82 -3.151 1.433 -7.336 1394 HZ PHE 82 HZ PHE 82 -2.899 1.731 -9.788 1395 H ALA 83 H ALA 83 -6.102 -4.666 -6.610 1396 HA ALA 83 HA ALA 83 -4.842 -7.004 -5.568 1397 HB1 ALA 83 1HB ALA 83 -6.131 -5.378 -4.141 1398 HB2 ALA 83 2HB ALA 83 -6.746 -7.056 -3.991 1399 HB3 ALA 83 3HB ALA 83 -7.644 -5.855 -4.996 1400 H LEU 84 H LEU 84 -7.177 -6.527 -8.156 1401 HA LEU 84 HA LEU 84 -8.488 -9.080 -7.746 1402 HB2 LEU 84 2HB LEU 84 -9.598 -7.124 -8.875 1403 HB3 LEU 84 1HB LEU 84 -8.456 -7.249 -10.238 1404 HG LEU 84 HG LEU 84 -10.093 -9.700 -9.439 1405 HD11 LEU 84 1HD1 LEU 84 -11.325 -7.328 -10.986 1406 HD12 LEU 84 2HD1 LEU 84 -11.738 -7.828 -9.308 1407 HD13 LEU 84 3HD1 LEU 84 -12.092 -8.935 -10.674 1408 HD21 LEU 84 3HD2 LEU 84 -10.211 -10.085 -11.913 1409 HD22 LEU 84 1HD2 LEU 84 -8.510 -9.917 -11.373 1410 HD23 LEU 84 2HD2 LEU 84 -9.322 -8.544 -12.209 1411 H VAL 85 H VAL 85 -5.802 -7.675 -9.607 1412 HA VAL 85 HA VAL 85 -5.478 -9.981 -11.206 1413 HB VAL 85 HB VAL 85 -3.545 -8.997 -12.156 1414 HG11 VAL 85 1HG1 VAL 85 -5.965 -8.139 -12.640 1415 HG12 VAL 85 2HG1 VAL 85 -4.635 -7.001 -13.079 1416 HG13 VAL 85 3HG1 VAL 85 -5.597 -6.739 -11.588 1417 HG21 VAL 85 3HG2 VAL 85 -2.489 -8.047 -10.007 1418 HG22 VAL 85 1HG2 VAL 85 -3.744 -6.754 -10.049 1419 HG23 VAL 85 2HG2 VAL 85 -2.549 -6.878 -11.373 1420 H THR 86 H THR 86 -4.751 -9.499 -7.908 1421 HA THR 86 HA THR 86 -2.473 -10.951 -7.552 1422 HB THR 86 HB THR 86 -5.018 -10.863 -5.868 1423 HG1 THR 86 1HG THR 86 -2.650 -9.276 -5.687 1424 HG21 THR 86 3HG2 THR 86 -2.098 -11.538 -5.072 1425 HG22 THR 86 1HG2 THR 86 -3.511 -12.655 -5.013 1426 HG23 THR 86 2HG2 THR 86 -3.452 -11.229 -3.920 1427 H ALA 87 H ALA 87 -5.581 -12.048 -8.766 1428 HA ALA 87 HA ALA 87 -5.292 -14.779 -8.208 1429 HB1 ALA 87 1HB ALA 87 -6.870 -15.137 -10.112 1430 HB2 ALA 87 2HB ALA 87 -6.577 -13.443 -10.678 1431 HB3 ALA 87 3HB ALA 87 -7.394 -13.741 -9.109 1432 H ALA 88 H ALA 88 -3.884 -12.756 -10.805 1433 HA ALA 88 HA ALA 88 -2.977 -14.970 -12.402 1434 HB1 ALA 88 1HB ALA 88 -2.156 -11.997 -12.438 1435 HB2 ALA 88 2HB ALA 88 -3.408 -12.756 -13.491 1436 HB3 ALA 88 3HB ALA 88 -1.681 -13.235 -13.660 1437 H LEU 89 H LEU 89 -1.652 -12.680 -9.977 1438 HA LEU 89 HA LEU 89 0.958 -13.793 -10.114 1439 HB2 LEU 89 2HB LEU 89 -0.344 -12.009 -7.968 1440 HB3 LEU 89 1HB LEU 89 1.353 -12.571 -7.915 1441 HG LEU 89 HG LEU 89 1.383 -10.367 -8.658 1442 HD11 LEU 89 1HD1 LEU 89 2.657 -10.489 -10.745 1443 HD12 LEU 89 2HD1 LEU 89 1.939 -12.094 -11.151 1444 HD13 LEU 89 3HD1 LEU 89 3.013 -11.925 -9.719 1445 HD21 LEU 89 3HD2 LEU 89 -0.921 -10.067 -9.524 1446 HD22 LEU 89 1HD2 LEU 89 -0.488 -10.968 -11.029 1447 HD23 LEU 89 2HD2 LEU 89 0.321 -9.408 -10.644 1448 H ALA 90 H ALA 90 -1.922 -14.590 -8.175 1449 HA ALA 90 HA ALA 90 -0.551 -16.089 -6.270 1450 HB1 ALA 90 1HB ALA 90 -3.419 -16.499 -7.308 1451 HB2 ALA 90 2HB ALA 90 -2.930 -15.446 -5.930 1452 HB3 ALA 90 3HB ALA 90 -2.731 -17.230 -5.802 1453 H THR 91 H THR 91 -1.713 -16.969 -9.547 1454 HA THR 91 HA THR 91 -1.227 -19.711 -9.295 1455 HB THR 91 HB THR 91 -0.628 -19.011 -12.025 1456 HG1 THR 91 1HG THR 91 -1.323 -16.922 -11.578 1457 HG21 THR 91 3HG2 THR 91 -1.973 -20.950 -11.211 1458 HG22 THR 91 1HG2 THR 91 -2.894 -19.969 -12.406 1459 HG23 THR 91 2HG2 THR 91 -3.270 -19.842 -10.643 1460 H ASP 92 H ASP 92 1.129 -17.129 -9.208 1461 HA ASP 92 HA ASP 92 3.025 -18.520 -10.790 1462 HB2 ASP 92 2HB ASP 92 3.252 -16.046 -9.043 1463 HB3 ASP 92 1HB ASP 92 4.733 -16.894 -9.614 1464 H PHE 93 H PHE 93 1.947 -19.090 -7.543 1465 HA PHE 93 HA PHE 93 4.430 -20.407 -6.882 1466 HB2 PHE 93 2HB PHE 93 3.576 -21.179 -4.917 1467 HB3 PHE 93 1HB PHE 93 2.874 -19.545 -5.063 1468 HD1 PHE 93 2HD PHE 93 2.223 -23.229 -5.197 1469 HD2 PHE 93 1HD PHE 93 0.469 -19.312 -5.014 1470 HE1 PHE 93 2HE PHE 93 0.055 -24.231 -4.576 1471 HE2 PHE 93 1HE PHE 93 -1.688 -20.305 -4.377 1472 HZ PHE 93 HZ PHE 93 -1.910 -22.779 -4.159 1473 H VAL 94 H VAL 94 1.577 -21.192 -8.738 1474 HA VAL 94 HA VAL 94 1.685 -23.997 -8.284 1475 HB VAL 94 HB VAL 94 0.221 -22.456 -10.489 1476 HG11 VAL 94 1HG1 VAL 94 -1.328 -24.453 -10.409 1477 HG12 VAL 94 2HG1 VAL 94 -0.240 -25.244 -9.211 1478 HG13 VAL 94 3HG1 VAL 94 0.337 -24.933 -10.886 1479 HG21 VAL 94 3HG2 VAL 94 -0.379 -21.515 -8.229 1480 HG22 VAL 94 1HG2 VAL 94 -0.634 -23.176 -7.594 1481 HG23 VAL 94 2HG2 VAL 94 -1.727 -22.515 -8.861 1482 H ARG 95 H ARG 95 2.960 -21.710 -10.652 1483 HA ARG 95 HA ARG 95 3.812 -23.510 -12.615 1484 HB2 ARG 95 2HB ARG 95 4.990 -20.813 -11.677 1485 HB3 ARG 95 1HB ARG 95 5.518 -21.660 -13.171 1486 HG2 ARG 95 2HG ARG 95 2.638 -20.660 -12.662 1487 HG3 ARG 95 1HG ARG 95 3.918 -19.807 -13.585 1488 HD2 ARG 95 2HD ARG 95 4.099 -21.859 -15.129 1489 HD3 ARG 95 1HD ARG 95 2.639 -22.541 -14.302 1490 HE ARG 95 HE ARG 95 2.204 -19.787 -15.243 1491 HH11 ARG 95 1HH2 ARG 95 2.674 -23.215 -16.461 1492 HH12 ARG 95 2HH2 ARG 95 1.918 -22.888 -17.960 1493 HH21 ARG 95 1HH1 ARG 95 0.901 -19.507 -17.245 1494 HH22 ARG 95 2HH1 ARG 95 1.053 -20.692 -18.476 1495 H ARG 96 H ARG 96 5.013 -22.984 -9.420 1496 HA ARG 96 HA ARG 96 7.707 -23.603 -9.842 1497 HB2 ARG 96 2HB ARG 96 6.576 -22.507 -7.786 1498 HB3 ARG 96 1HB ARG 96 6.037 -24.146 -7.328 1499 HG2 ARG 96 2HG ARG 96 8.825 -24.415 -7.861 1500 HG3 ARG 96 1HG ARG 96 8.724 -22.805 -7.120 1501 HD2 ARG 96 2HD ARG 96 9.163 -24.642 -5.418 1502 HD3 ARG 96 1HD ARG 96 7.594 -23.801 -5.092 1503 HE ARG 96 HE ARG 96 6.446 -25.745 -5.631 1504 HH11 ARG 96 1HH2 ARG 96 9.850 -26.129 -6.943 1505 HH12 ARG 96 2HH2 ARG 96 9.708 -27.791 -7.103 1506 HH21 ARG 96 1HH1 ARG 96 6.272 -28.054 -5.974 1507 HH22 ARG 96 2HH1 ARG 96 7.564 -28.978 -6.526 1508 H GLU 97 H GLU 97 4.780 -25.672 -9.504 1509 HA GLU 97 HA GLU 97 6.345 -28.024 -9.000 1510 HB2 GLU 97 2HB GLU 97 3.953 -27.880 -8.268 1511 HB3 GLU 97 1HB GLU 97 3.439 -27.896 -9.984 1512 HG2 GLU 97 2HG GLU 97 4.393 -30.172 -10.293 1513 HG3 GLU 97 1HG GLU 97 5.121 -30.128 -8.646 1514 H GLU 98 H GLU 98 5.199 -26.274 -11.877 1515 HA GLU 98 HA GLU 98 5.627 -28.407 -13.673 1516 HB2 GLU 98 2HB GLU 98 5.747 -25.404 -14.341 1517 HB3 GLU 98 1HB GLU 98 5.523 -26.777 -15.477 1518 HG2 GLU 98 2HG GLU 98 3.364 -27.338 -14.101 1519 HG3 GLU 98 1HG GLU 98 3.538 -25.704 -13.363 1520 H GLU 99 H GLU 99 7.703 -25.687 -12.503 1521 HA GLU 99 HA GLU 99 9.799 -26.498 -14.251 1522 HB2 GLU 99 2HB GLU 99 9.966 -24.579 -11.891 1523 HB3 GLU 99 1HB GLU 99 11.238 -24.846 -13.135 1524 HG2 GLU 99 2HG GLU 99 8.402 -23.761 -13.715 1525 HG3 GLU 99 1HG GLU 99 9.895 -22.774 -13.565 1526 H ARG 100 H ARG 100 8.747 -27.852 -11.324 1527 HA ARG 100 HA ARG 100 11.277 -28.819 -10.462 1528 HB2 ARG 100 2HB ARG 100 9.176 -28.718 -9.065 1529 HB3 ARG 100 1HB ARG 100 8.492 -30.070 -10.009 1530 HG2 ARG 100 2HG ARG 100 11.223 -30.443 -8.682 1531 HG3 ARG 100 1HG ARG 100 9.794 -30.359 -7.610 1532 HD2 ARG 100 2HD ARG 100 10.142 -32.388 -9.920 1533 HD3 ARG 100 1HD ARG 100 10.401 -32.728 -8.160 1534 HE ARG 100 HE ARG 100 7.890 -31.780 -8.005 1535 HH11 ARG 100 1HH2 ARG 100 9.254 -34.295 -10.235 1536 HH12 ARG 100 2HH2 ARG 100 7.736 -34.812 -10.815 1537 HH21 ARG 100 1HH1 ARG 100 5.819 -32.924 -8.442 1538 HH22 ARG 100 2HH1 ARG 100 5.759 -34.075 -9.695 1539 H ARG 101 H ARG 101 9.027 -29.718 -13.022 1540 HA ARG 101 HA ARG 101 10.149 -32.353 -13.397 1541 HB2 ARG 101 2HB ARG 101 8.459 -30.692 -15.371 1542 HB3 ARG 101 1HB ARG 101 8.755 -32.466 -15.425 1543 HG2 ARG 101 2HG ARG 101 7.441 -32.678 -13.241 1544 HG3 ARG 101 1HG ARG 101 7.193 -30.904 -13.257 1545 HD2 ARG 101 2HD ARG 101 5.174 -31.890 -14.064 1546 HD3 ARG 101 1HD ARG 101 5.959 -31.108 -15.494 1547 HE ARG 101 HE ARG 101 6.945 -33.643 -15.745 1548 HH11 ARG 101 1HH2 ARG 101 3.550 -32.470 -15.319 1549 HH12 ARG 101 2HH2 ARG 101 2.846 -33.999 -15.538 1550 HH21 ARG 101 1HH1 ARG 101 5.831 -35.704 -16.511 1551 HH22 ARG 101 2HH1 ARG 101 4.233 -35.939 -15.974 1552 H GLY 102 H GLY 102 10.659 -29.055 -14.554 1553 HA2 GLY 102 2HA GLY 102 12.584 -28.270 -15.376 1554 HA3 GLY 102 1HA GLY 102 13.098 -29.919 -15.884 1555 H HIS 103 H HIS 103 10.125 -29.943 -16.956 1556 HA HIS 103 HA HIS 103 9.066 -29.690 -18.867 1557 HB2 HIS 103 2HB HIS 103 10.912 -27.321 -19.556 1558 HB3 HIS 103 1HB HIS 103 9.574 -27.908 -20.572 1559 HD1 HIS 103 1HD HIS 103 9.988 -25.955 -17.156 1560 HD2 HIS 103 2HD HIS 103 7.082 -27.018 -20.065 1561 HE1 HIS 103 1HE HIS 103 7.996 -24.664 -16.697 1562 HE2 HIS 103 2HE HIS 103 6.202 -25.320 -18.400 1563 H1 SER 1 H SER 1 18.200 -23.580 -0.085 1564 HA SER 1 HA SER 1 16.038 -22.378 1.097 1565 HB2 SER 1 2HB SER 1 16.689 -20.346 -0.441 1566 HB3 SER 1 1HB SER 1 17.871 -20.942 0.770 1567 HG SER 1 1HG SER 1 17.780 -21.637 -1.964 1568 H ALA 2 H ALA 2 14.810 -24.318 0.159 1569 HA ALA 2 HA ALA 2 13.258 -25.203 -1.058 1570 HB1 ALA 2 1HB ALA 2 11.893 -23.534 0.068 1571 HB2 ALA 2 2HB ALA 2 11.259 -23.775 -1.594 1572 HB3 ALA 2 3HB ALA 2 12.250 -22.308 -1.182 1573 H ASP 3 H ASP 3 12.905 -22.342 -3.006 1574 HA ASP 3 HA ASP 3 14.076 -23.335 -5.376 1575 HB2 ASP 3 2HB ASP 3 12.289 -25.114 -5.026 1576 HB3 ASP 3 1HB ASP 3 11.033 -23.841 -4.954 1577 H HIS 4 H HIS 4 10.984 -22.005 -4.273 1578 HA HIS 4 HA HIS 4 10.691 -19.929 -6.010 1579 HB2 HIS 4 2HB HIS 4 8.957 -18.981 -4.557 1580 HB3 HIS 4 1HB HIS 4 8.818 -20.757 -4.555 1581 HD1 HIS 4 1HD HIS 4 7.652 -21.041 -2.185 1582 HD2 HIS 4 2HD HIS 4 10.678 -18.155 -1.975 1583 HE1 HIS 4 1HE HIS 4 7.869 -20.420 0.141 1584 HE2 HIS 4 2HE HIS 4 9.534 -18.606 0.270 1585 H GLU 5 H GLU 5 12.664 -19.969 -3.113 1586 HA GLU 5 HA GLU 5 12.434 -17.266 -2.428 1587 HB2 GLU 5 2HB GLU 5 14.634 -19.320 -1.728 1588 HB3 GLU 5 1HB GLU 5 14.294 -17.785 -0.861 1589 HG2 GLU 5 2HG GLU 5 12.030 -18.587 -0.254 1590 HG3 GLU 5 1HG GLU 5 12.310 -20.159 -1.105 1591 H ARG 6 H ARG 6 14.502 -19.084 -4.601 1592 HA ARG 6 HA ARG 6 16.600 -17.232 -4.833 1593 HB2 ARG 6 2HB ARG 6 15.533 -19.237 -6.922 1594 HB3 ARG 6 1HB ARG 6 17.195 -18.568 -6.853 1595 HG2 ARG 6 2HG ARG 6 17.644 -19.778 -4.740 1596 HG3 ARG 6 1HG ARG 6 15.955 -20.358 -4.625 1597 HD2 ARG 6 2HD ARG 6 17.977 -21.126 -6.808 1598 HD3 ARG 6 1HD ARG 6 17.393 -22.179 -5.456 1599 HE ARG 6 HE ARG 6 14.996 -21.664 -6.517 1600 HH11 ARG 6 1HH2 ARG 6 17.915 -21.697 -8.569 1601 HH12 ARG 6 2HH2 ARG 6 17.063 -22.162 -9.945 1602 HH21 ARG 6 1HH1 ARG 6 13.969 -22.991 -8.305 1603 HH22 ARG 6 2HH1 ARG 6 14.890 -23.196 -9.730 1604 H GLU 7 H GLU 7 13.554 -17.771 -6.626 1605 HA GLU 7 HA GLU 7 14.111 -15.881 -8.641 1606 HB2 GLU 7 2HB GLU 7 12.513 -17.945 -8.705 1607 HB3 GLU 7 1HB GLU 7 11.340 -16.924 -7.814 1608 HG2 GLU 7 2HG GLU 7 10.798 -16.878 -10.184 1609 HG3 GLU 7 1HG GLU 7 11.465 -15.251 -9.776 1610 H ALA 8 H ALA 8 12.380 -15.855 -5.526 1611 HA ALA 8 HA ALA 8 11.226 -13.326 -5.791 1612 HB1 ALA 8 1HB ALA 8 10.510 -14.942 -4.003 1613 HB2 ALA 8 2HB ALA 8 10.997 -13.366 -3.284 1614 HB3 ALA 8 3HB ALA 8 12.117 -14.769 -3.209 1615 H GLN 9 H GLN 9 14.418 -14.347 -4.470 1616 HA GLN 9 HA GLN 9 15.119 -11.718 -3.623 1617 HB2 GLN 9 2HB GLN 9 16.920 -14.103 -4.299 1618 HB3 GLN 9 1HB GLN 9 17.480 -12.602 -3.487 1619 HG2 GLN 9 2HG GLN 9 15.263 -14.358 -2.234 1620 HG3 GLN 9 1HG GLN 9 17.003 -14.752 -2.059 1621 HE21 GLN 9 1HE2 GLN 9 14.543 -12.134 -1.387 1622 HE22 GLN 9 2HE2 GLN 9 15.461 -11.371 -0.164 1623 H LYS 10 H LYS 10 15.528 -13.545 -6.665 1624 HA LYS 10 HA LYS 10 17.323 -11.798 -7.893 1625 HB2 LYS 10 2HB LYS 10 16.667 -14.150 -8.666 1626 HB3 LYS 10 1HB LYS 10 15.109 -13.472 -9.236 1627 HG2 LYS 10 2HG LYS 10 16.395 -11.973 -10.830 1628 HG3 LYS 10 1HG LYS 10 17.926 -12.733 -10.269 1629 HD2 LYS 10 2HD LYS 10 17.089 -14.978 -11.077 1630 HD3 LYS 10 1HD LYS 10 15.525 -14.233 -11.513 1631 HE2 LYS 10 2HE LYS 10 16.799 -14.540 -13.553 1632 HE3 LYS 10 1HE LYS 10 16.677 -12.766 -13.227 1633 HZ1 LYS 10 3HZ LYS 10 18.836 -13.451 -13.974 1634 HZ2 LYS 10 1HZ LYS 10 19.038 -14.514 -12.658 1635 HZ3 LYS 10 2HZ LYS 10 18.967 -12.808 -12.411 1636 H ALA 11 H ALA 11 13.773 -11.788 -7.646 1637 HA ALA 11 HA ALA 11 13.246 -9.760 -9.466 1638 HB1 ALA 11 1HB ALA 11 11.682 -10.400 -6.888 1639 HB2 ALA 11 2HB ALA 11 11.490 -11.270 -8.456 1640 HB3 ALA 11 3HB ALA 11 11.051 -9.529 -8.338 1641 H GLU 12 H GLU 12 14.194 -9.554 -6.000 1642 HA GLU 12 HA GLU 12 13.591 -6.812 -5.733 1643 HB2 GLU 12 2HB GLU 12 15.513 -8.633 -4.194 1644 HB3 GLU 12 1HB GLU 12 15.340 -6.891 -3.809 1645 HG2 GLU 12 2HG GLU 12 12.942 -7.142 -3.288 1646 HG3 GLU 12 1HG GLU 12 13.010 -8.902 -3.680 1647 H GLU 13 H GLU 13 16.460 -8.516 -6.981 1648 HA GLU 13 HA GLU 13 18.149 -6.249 -6.844 1649 HB2 GLU 13 2HB GLU 13 18.932 -8.660 -6.998 1650 HB3 GLU 13 1HB GLU 13 18.455 -8.654 -8.730 1651 HG2 GLU 13 2HG GLU 13 20.105 -6.807 -9.170 1652 HG3 GLU 13 1HG GLU 13 20.496 -6.721 -7.414 1653 H GLU 14 H GLU 14 15.879 -7.542 -9.226 1654 HA GLU 14 HA GLU 14 16.736 -5.937 -11.363 1655 HB2 GLU 14 2HB GLU 14 15.467 -8.135 -11.481 1656 HB3 GLU 14 1HB GLU 14 14.007 -7.255 -10.916 1657 HG2 GLU 14 2HG GLU 14 13.841 -7.550 -13.297 1658 HG3 GLU 14 1HG GLU 14 14.170 -5.799 -13.005 1659 H LEU 15 H LEU 15 14.492 -5.400 -8.678 1660 HA LEU 15 HA LEU 15 13.283 -3.085 -9.705 1661 HB2 LEU 15 2HB LEU 15 12.381 -4.290 -7.734 1662 HB3 LEU 15 1HB LEU 15 13.818 -3.833 -6.769 1663 HG LEU 15 HG LEU 15 13.176 -1.466 -6.811 1664 HD11 LEU 15 1HD1 LEU 15 10.970 -0.731 -7.862 1665 HD12 LEU 15 2HD1 LEU 15 10.924 -2.304 -8.744 1666 HD13 LEU 15 3HD1 LEU 15 12.254 -1.128 -9.044 1667 HD21 LEU 15 3HD2 LEU 15 10.711 -3.219 -6.174 1668 HD22 LEU 15 1HD2 LEU 15 11.023 -1.555 -5.569 1669 HD23 LEU 15 2HD2 LEU 15 12.106 -2.907 -5.074 1670 H GLN 16 H GLN 16 16.340 -3.607 -7.903 1671 HA GLN 16 HA GLN 16 16.841 -0.923 -7.307 1672 HB2 GLN 16 2HB GLN 16 19.047 -2.967 -7.932 1673 HB3 GLN 16 1HB GLN 16 19.151 -1.497 -6.903 1674 HG2 GLN 16 2HG GLN 16 17.684 -4.140 -6.307 1675 HG3 GLN 16 1HG GLN 16 19.122 -3.465 -5.474 1676 HE21 GLN 16 1HE2 GLN 16 15.811 -3.860 -5.144 1677 HE22 GLN 16 2HE2 GLN 16 15.459 -2.521 -4.083 1678 H LYS 17 H LYS 17 17.388 -2.856 -10.182 1679 HA LYS 17 HA LYS 17 19.218 -1.189 -11.463 1680 HB2 LYS 17 2HB LYS 17 18.516 -3.671 -11.876 1681 HB3 LYS 17 1HB LYS 17 17.187 -3.016 -12.877 1682 HG2 LYS 17 2HG LYS 17 18.884 -2.004 -14.435 1683 HG3 LYS 17 1HG LYS 17 20.194 -2.413 -13.276 1684 HD2 LYS 17 2HD LYS 17 20.364 -4.092 -14.943 1685 HD3 LYS 17 1HD LYS 17 19.577 -4.874 -13.526 1686 HE2 LYS 17 2HE LYS 17 17.293 -4.380 -14.784 1687 HE3 LYS 17 1HE LYS 17 18.323 -4.028 -16.227 1688 HZ1 LYS 17 3HZ LYS 17 17.905 -6.548 -14.735 1689 HZ2 LYS 17 1HZ LYS 17 19.265 -6.385 -15.801 1690 HZ3 LYS 17 2HZ LYS 17 17.678 -6.227 -16.359 1691 H VAL 18 H VAL 18 15.616 -1.244 -11.495 1692 HA VAL 18 HA VAL 18 15.597 0.918 -13.445 1693 HB VAL 18 HB VAL 18 13.140 0.708 -13.384 1694 HG11 VAL 18 1HG1 VAL 18 14.732 -1.900 -13.932 1695 HG12 VAL 18 2HG1 VAL 18 14.609 -0.485 -15.046 1696 HG13 VAL 18 3HG1 VAL 18 13.144 -1.447 -14.645 1697 HG21 VAL 18 3HG2 VAL 18 12.114 -1.281 -12.281 1698 HG22 VAL 18 1HG2 VAL 18 12.869 -0.225 -11.044 1699 HG23 VAL 18 2HG2 VAL 18 13.689 -1.748 -11.562 1700 H LEU 19 H LEU 19 15.081 0.398 -9.967 1701 HA LEU 19 HA LEU 19 13.956 2.836 -9.255 1702 HB2 LEU 19 2HB LEU 19 14.066 1.173 -7.537 1703 HB3 LEU 19 1HB LEU 19 15.747 0.757 -7.964 1704 HG LEU 19 HG LEU 19 16.667 2.693 -6.841 1705 HD11 LEU 19 1HD1 LEU 19 15.408 4.232 -5.453 1706 HD12 LEU 19 2HD1 LEU 19 13.850 3.420 -5.822 1707 HD13 LEU 19 3HD1 LEU 19 14.723 4.327 -7.100 1708 HD21 LEU 19 3HD2 LEU 19 16.205 2.008 -4.513 1709 HD22 LEU 19 1HD2 LEU 19 16.352 0.575 -5.589 1710 HD23 LEU 19 2HD2 LEU 19 14.723 1.122 -5.037 1711 H GLU 20 H GLU 20 17.443 1.879 -9.509 1712 HA GLU 20 HA GLU 20 18.318 4.404 -8.688 1713 HB2 GLU 20 2HB GLU 20 19.541 2.044 -8.751 1714 HB3 GLU 20 1HB GLU 20 19.998 2.510 -10.405 1715 HG2 GLU 20 2HG GLU 20 21.866 3.215 -9.189 1716 HG3 GLU 20 1HG GLU 20 20.909 4.752 -9.171 1717 H GLU 21 H GLU 21 17.335 3.141 -11.799 1718 HA GLU 21 HA GLU 21 18.586 5.125 -13.463 1719 HB2 GLU 21 2HB GLU 21 17.981 3.021 -14.532 1720 HB3 GLU 21 1HB GLU 21 16.332 3.095 -13.842 1721 HG2 GLU 21 2HG GLU 21 16.091 3.463 -16.155 1722 HG3 GLU 21 1HG GLU 21 15.776 5.041 -15.370 1723 H ALA 22 H ALA 22 15.511 4.655 -11.720 1724 HA ALA 22 HA ALA 22 14.115 6.786 -12.785 1725 HB1 ALA 22 1HB ALA 22 13.085 4.988 -11.343 1726 HB2 ALA 22 2HB ALA 22 12.643 6.661 -10.824 1727 HB3 ALA 22 3HB ALA 22 13.864 5.729 -9.905 1728 H SER 23 H SER 23 16.537 6.719 -10.145 1729 HA SER 23 HA SER 23 16.130 9.199 -9.043 1730 HB2 SER 23 2HB SER 23 18.912 7.984 -9.661 1731 HB3 SER 23 1HB SER 23 18.431 8.985 -8.237 1732 HG SER 23 1HG SER 23 18.604 6.631 -7.942 1733 H LYS 24 H LYS 24 17.956 8.253 -11.911 1734 HA LYS 24 HA LYS 24 19.171 10.787 -12.433 1735 HB2 LYS 24 2HB LYS 24 20.408 8.890 -13.163 1736 HB3 LYS 24 1HB LYS 24 18.926 8.007 -13.609 1737 HG2 LYS 24 2HG LYS 24 18.695 9.379 -15.685 1738 HG3 LYS 24 1HG LYS 24 20.305 10.120 -15.355 1739 HD2 LYS 24 2HD LYS 24 21.400 7.918 -15.523 1740 HD3 LYS 24 1HD LYS 24 19.823 7.087 -15.306 1741 HE2 LYS 24 2HE LYS 24 19.081 8.027 -17.577 1742 HE3 LYS 24 1HE LYS 24 20.812 8.474 -17.877 1743 HZ1 LYS 24 3HZ LYS 24 20.029 6.259 -18.703 1744 HZ2 LYS 24 1HZ LYS 24 19.836 5.761 -17.103 1745 HZ3 LYS 24 2HZ LYS 24 21.409 6.143 -17.703 1746 H LYS 25 H LYS 25 16.459 8.862 -13.735 1747 HA LYS 25 HA LYS 25 15.638 10.729 -15.647 1748 HB2 LYS 25 2HB LYS 25 14.268 8.403 -14.190 1749 HB3 LYS 25 1HB LYS 25 13.360 9.391 -15.379 1750 HG2 LYS 25 2HG LYS 25 15.999 8.027 -16.142 1751 HG3 LYS 25 1HG LYS 25 14.403 7.214 -16.284 1752 HD2 LYS 25 2HD LYS 25 13.521 8.938 -17.754 1753 HD3 LYS 25 1HD LYS 25 14.952 9.989 -17.487 1754 HE2 LYS 25 2HE LYS 25 16.415 8.303 -18.678 1755 HE3 LYS 25 1HE LYS 25 14.930 7.329 -19.063 1756 HZ1 LYS 25 3HZ LYS 25 14.009 9.242 -20.161 1757 HZ2 LYS 25 1HZ LYS 25 15.531 8.926 -20.833 1758 HZ3 LYS 25 2HZ LYS 25 15.381 10.205 -19.718 1759 H ALA 26 H ALA 26 14.835 10.452 -12.184 1760 HA ALA 26 HA ALA 26 12.575 12.001 -12.131 1761 HB1 ALA 26 1HB ALA 26 13.124 12.481 -9.738 1762 HB2 ALA 26 2HB ALA 26 14.822 11.929 -9.999 1763 HB3 ALA 26 3HB ALA 26 13.464 10.758 -10.120 1764 H VAL 27 H VAL 27 15.985 13.054 -11.729 1765 HA VAL 27 HA VAL 27 15.339 15.819 -11.595 1766 HB VAL 27 HB VAL 27 17.892 14.227 -12.178 1767 HG11 VAL 27 1HG1 VAL 27 18.185 16.414 -13.359 1768 HG12 VAL 27 2HG1 VAL 27 19.177 16.366 -11.882 1769 HG13 VAL 27 3HG1 VAL 27 17.630 17.293 -11.887 1770 HG21 VAL 27 3HG2 VAL 27 18.437 15.009 -9.850 1771 HG22 VAL 27 1HG2 VAL 27 16.870 14.119 -9.883 1772 HG23 VAL 27 2HG2 VAL 27 16.873 15.908 -9.770 1773 H GLU 28 H GLU 28 16.165 13.570 -14.245 1774 HA GLU 28 HA GLU 28 16.620 15.493 -16.215 1775 HB2 GLU 28 2HB GLU 28 16.979 12.863 -16.372 1776 HB3 GLU 28 1HB GLU 28 15.244 12.796 -16.782 1777 HG2 GLU 28 2HG GLU 28 16.113 14.713 -18.601 1778 HG3 GLU 28 1HG GLU 28 17.627 13.768 -18.394 1779 H ALA 29 H ALA 29 13.676 13.927 -15.002 1780 HA ALA 29 HA ALA 29 11.883 14.610 -16.950 1781 HB1 ALA 29 1HB ALA 29 11.279 14.420 -13.922 1782 HB2 ALA 29 2HB ALA 29 11.450 12.995 -14.996 1783 HB3 ALA 29 3HB ALA 29 10.109 14.169 -15.268 1784 H GLU 30 H GLU 30 13.095 16.478 -14.246 1785 HA GLU 30 HA GLU 30 11.128 18.433 -14.115 1786 HB2 GLU 30 2HB GLU 30 14.130 18.567 -13.468 1787 HB3 GLU 30 1HB GLU 30 12.892 19.712 -12.849 1788 HG2 GLU 30 2HG GLU 30 12.679 16.660 -12.315 1789 HG3 GLU 30 1HG GLU 30 13.666 17.734 -11.287 1790 H ARG 31 H ARG 31 13.713 17.975 -16.454 1791 HA ARG 31 HA ARG 31 13.530 20.817 -17.259 1792 HB2 ARG 31 2HB ARG 31 15.511 18.611 -17.996 1793 HB3 ARG 31 1HB ARG 31 15.173 19.948 -19.136 1794 HG2 ARG 31 2HG ARG 31 17.064 20.692 -18.071 1795 HG3 ARG 31 1HG ARG 31 15.726 21.635 -17.341 1796 HD2 ARG 31 2HD ARG 31 15.817 20.140 -15.289 1797 HD3 ARG 31 1HD ARG 31 17.197 19.230 -16.008 1798 HE ARG 31 HE ARG 31 17.182 21.973 -14.862 1799 HH11 ARG 31 1HH2 ARG 31 18.955 19.944 -17.275 1800 HH12 ARG 31 2HH2 ARG 31 20.450 20.709 -17.040 1801 HH21 ARG 31 1HH1 ARG 31 19.486 22.657 -14.202 1802 HH22 ARG 31 2HH1 ARG 31 20.707 22.415 -15.363 1803 H GLY 32 H GLY 32 11.792 21.184 -18.522 1804 HA2 GLY 32 2HA GLY 32 11.306 20.812 -20.923 1805 HA3 GLY 32 1HA GLY 32 10.978 19.093 -20.425 1806 H ALA 33 H ALA 33 9.939 19.480 -17.883 1807 HA ALA 33 HA ALA 33 7.297 20.367 -18.699 1808 HB1 ALA 33 1HB ALA 33 7.497 18.100 -17.704 1809 HB2 ALA 33 2HB ALA 33 6.543 19.170 -16.601 1810 HB3 ALA 33 3HB ALA 33 8.277 18.815 -16.251 1811 HA PRO 34 HA PRO 34 7.852 23.799 -15.912 1812 HB2 PRO 34 2HB PRO 34 5.219 24.685 -15.517 1813 HB3 PRO 34 1HB PRO 34 6.089 24.866 -17.091 1814 HG2 PRO 34 2HG PRO 34 4.151 22.627 -16.280 1815 HG3 PRO 34 1HG PRO 34 4.130 23.629 -17.795 1816 HD2 PRO 34 2HD PRO 34 5.297 21.131 -17.706 1817 HD3 PRO 34 1HD PRO 34 6.054 22.469 -18.679 1818 H GLY 35 H GLY 35 7.381 24.548 -13.679 1819 HA2 GLY 35 2HA GLY 35 6.619 24.339 -11.568 1820 HA3 GLY 35 1HA GLY 35 5.903 22.733 -11.970 1821 H ALA 36 H ALA 36 9.288 23.634 -12.688 1822 HA ALA 36 HA ALA 36 10.140 21.227 -11.588 1823 HB1 ALA 36 1HB ALA 36 11.882 23.644 -12.328 1824 HB2 ALA 36 2HB ALA 36 11.365 22.324 -13.458 1825 HB3 ALA 36 3HB ALA 36 12.438 21.943 -12.070 1826 H ALA 37 H ALA 37 11.182 20.627 -9.796 1827 HA ALA 37 HA ALA 37 11.598 22.555 -7.628 1828 HB1 ALA 37 1HB ALA 37 9.135 21.984 -7.457 1829 HB2 ALA 37 2HB ALA 37 10.058 21.280 -6.075 1830 HB3 ALA 37 3HB ALA 37 9.548 20.235 -7.458 1831 H LEU 38 H LEU 38 11.582 19.177 -8.856 1832 HA LEU 38 HA LEU 38 12.977 18.156 -6.580 1833 HB2 LEU 38 2HB LEU 38 11.226 16.999 -8.077 1834 HB3 LEU 38 1HB LEU 38 12.488 16.821 -9.314 1835 HG LEU 38 HG LEU 38 12.802 15.666 -6.487 1836 HD11 LEU 38 1HD1 LEU 38 10.644 14.861 -7.379 1837 HD12 LEU 38 2HD1 LEU 38 11.857 13.536 -7.447 1838 HD13 LEU 38 3HD1 LEU 38 11.410 14.423 -8.947 1839 HD21 LEU 38 3HD2 LEU 38 14.919 15.562 -7.795 1840 HD22 LEU 38 1HD2 LEU 38 14.038 14.888 -9.216 1841 HD23 LEU 38 2HD2 LEU 38 14.200 13.923 -7.703 1842 H ILE 39 H ILE 39 13.675 19.499 -9.689 1843 HA ILE 39 HA ILE 39 15.936 18.566 -10.587 1844 HB ILE 39 HB ILE 39 14.931 20.240 -11.810 1845 HG12 ILE 39 2HG1 ILE 39 16.613 21.927 -12.352 1846 HG13 ILE 39 1HG1 ILE 39 17.517 21.615 -10.847 1847 HG21 ILE 39 1HG2 ILE 39 15.287 22.125 -9.397 1848 HG22 ILE 39 2HG2 ILE 39 13.750 21.450 -10.049 1849 HG23 ILE 39 3HG2 ILE 39 14.689 22.623 -11.019 1850 HD11 ILE 39 3HD ILE 39 17.074 19.490 -13.060 1851 HD12 ILE 39 1HD ILE 39 18.535 20.545 -12.919 1852 HD13 ILE 39 2HD ILE 39 18.174 19.361 -11.635 1853 H SER 40 H SER 40 17.769 17.829 -9.667 1854 HA SER 40 HA SER 40 19.544 19.492 -8.399 1855 HB2 SER 40 2HB SER 40 17.772 19.299 -6.502 1856 HB3 SER 40 1HB SER 40 18.086 17.550 -6.491 1857 HG SER 40 1HG SER 40 19.479 18.097 -5.133 1858 H TYR 41 H TYR 41 19.993 16.558 -6.836 1859 HA TYR 41 HA TYR 41 20.553 14.772 -8.910 1860 HB2 TYR 41 2HB TYR 41 22.802 16.722 -8.280 1861 HB3 TYR 41 1HB TYR 41 23.260 14.988 -8.250 1862 HD1 TYR 41 1HD TYR 41 20.878 15.202 -10.965 1863 HD2 TYR 41 2HD TYR 41 24.882 16.194 -9.734 1864 HE1 TYR 41 1HE TYR 41 21.582 15.271 -13.305 1865 HE2 TYR 41 2HE TYR 41 25.596 16.247 -12.072 1866 HH TYR 41 HH TYR 41 25.005 15.556 -14.212 1867 HA PRO 42 HA PRO 42 22.659 12.930 -5.346 1868 HB2 PRO 42 2HB PRO 42 23.381 14.143 -2.936 1869 HB3 PRO 42 1HB PRO 42 24.341 14.371 -4.447 1870 HG2 PRO 42 2HG PRO 42 22.144 16.228 -3.346 1871 HG3 PRO 42 1HG PRO 42 23.830 16.673 -3.849 1872 HD2 PRO 42 2HD PRO 42 21.688 16.932 -5.576 1873 HD3 PRO 42 1HD PRO 42 23.320 16.362 -6.161 1874 H ASP 43 H ASP 43 19.997 14.980 -4.627 1875 HA ASP 43 HA ASP 43 18.944 13.303 -2.516 1876 HB2 ASP 43 2HB ASP 43 17.327 15.382 -2.403 1877 HB3 ASP 43 1HB ASP 43 18.970 15.490 -1.710 1878 H ALA 44 H ALA 44 19.030 13.380 -5.811 1879 HA ALA 44 HA ALA 44 16.271 13.194 -6.459 1880 HB1 ALA 44 1HB ALA 44 18.672 11.918 -7.941 1881 HB2 ALA 44 2HB ALA 44 18.172 13.631 -8.119 1882 HB3 ALA 44 3HB ALA 44 17.043 12.314 -8.612 1883 H ILE 45 H ILE 45 18.789 11.000 -5.408 1884 HA ILE 45 HA ILE 45 17.410 8.611 -5.965 1885 HB ILE 45 HB ILE 45 19.652 8.386 -6.148 1886 HG12 ILE 45 2HG1 ILE 45 19.208 7.388 -3.277 1887 HG13 ILE 45 1HG1 ILE 45 18.664 6.552 -4.766 1888 HG21 ILE 45 1HG2 ILE 45 20.440 10.502 -5.307 1889 HG22 ILE 45 2HG2 ILE 45 21.302 9.255 -4.381 1890 HG23 ILE 45 3HG2 ILE 45 19.917 10.110 -3.623 1891 HD11 ILE 45 3HD ILE 45 21.605 7.151 -4.005 1892 HD12 ILE 45 1HD ILE 45 20.774 5.555 -3.997 1893 HD13 ILE 45 2HD ILE 45 21.063 6.396 -5.551 1894 H TRP 46 H TRP 46 17.108 10.967 -3.410 1895 HA TRP 46 HA TRP 46 16.230 9.045 -1.456 1896 HB2 TRP 46 2HB TRP 46 16.988 11.697 -1.177 1897 HB3 TRP 46 1HB TRP 46 15.207 11.885 -1.182 1898 HD1 TRP 46 HD TRP 46 17.982 11.237 1.222 1899 HE1 TRP 46 1HE TRP 46 17.178 10.109 3.376 1900 HE3 TRP 46 3HE TRP 46 13.154 10.320 -0.159 1901 HZ2 TRP 46 2HZ TRP 46 14.905 8.566 4.180 1902 HZ3 TRP 46 3HZ TRP 46 11.683 9.106 1.369 1903 HH2 TRP 46 HH TRP 46 12.527 8.220 3.505 1904 H TRP 47 H TRP 47 14.700 11.382 -3.718 1905 HA TRP 47 HA TRP 47 12.068 10.692 -3.109 1906 HB2 TRP 47 2HB TRP 47 12.653 12.777 -4.296 1907 HB3 TRP 47 1HB TRP 47 13.221 11.828 -5.718 1908 HD1 TRP 47 HD TRP 47 9.839 12.677 -3.838 1909 HE1 TRP 47 1HE TRP 47 7.940 12.383 -5.505 1910 HE3 TRP 47 3HE TRP 47 12.520 10.614 -7.650 1911 HZ2 TRP 47 2HZ TRP 47 7.619 11.427 -8.208 1912 HZ3 TRP 47 3HZ TRP 47 11.345 9.931 -9.725 1913 HH2 TRP 47 HH TRP 47 8.933 10.352 -9.998 1914 H SER 48 H SER 48 14.436 9.172 -5.420 1915 HA SER 48 HA SER 48 12.342 7.779 -6.737 1916 HB2 SER 48 2HB SER 48 14.158 6.374 -7.750 1917 HB3 SER 48 1HB SER 48 14.335 8.148 -8.006 1918 HG SER 48 1HG SER 48 16.269 7.058 -7.321 1919 H VAL 49 H VAL 49 14.343 7.103 -3.868 1920 HA VAL 49 HA VAL 49 13.806 4.366 -3.708 1921 HB VAL 49 HB VAL 49 14.576 6.468 -1.664 1922 HG11 VAL 49 1HG1 VAL 49 14.039 3.464 -1.145 1923 HG12 VAL 49 2HG1 VAL 49 13.223 4.860 -0.351 1924 HG13 VAL 49 3HG1 VAL 49 14.961 4.563 -0.036 1925 HG21 VAL 49 3HG2 VAL 49 16.188 5.585 -3.483 1926 HG22 VAL 49 1HG2 VAL 49 16.001 3.948 -2.791 1927 HG23 VAL 49 2HG2 VAL 49 16.740 5.271 -1.803 1928 H GLU 50 H GLU 50 12.057 7.156 -2.217 1929 HA GLU 50 HA GLU 50 10.093 5.525 -1.095 1930 HB2 GLU 50 2HB GLU 50 8.790 7.666 -0.813 1931 HB3 GLU 50 1HB GLU 50 10.445 7.684 -0.159 1932 HG2 GLU 50 2HG GLU 50 11.271 8.957 -2.125 1933 HG3 GLU 50 1HG GLU 50 9.610 8.978 -2.836 1934 H THR 51 H THR 51 10.383 6.894 -4.342 1935 HA THR 51 HA THR 51 7.696 6.394 -5.098 1936 HB THR 51 HB THR 51 10.248 6.785 -6.743 1937 HG1 THR 51 1HG THR 51 9.757 8.613 -5.642 1938 HG21 THR 51 3HG2 THR 51 7.270 6.708 -7.601 1939 HG22 THR 51 1HG2 THR 51 8.584 5.636 -8.182 1940 HG23 THR 51 2HG2 THR 51 8.601 7.381 -8.612 1941 H ALA 52 H ALA 52 10.762 4.494 -5.539 1942 HA ALA 52 HA ALA 52 9.449 2.478 -7.047 1943 HB1 ALA 52 1HB ALA 52 11.944 2.838 -7.155 1944 HB2 ALA 52 2HB ALA 52 11.531 1.141 -6.710 1945 HB3 ALA 52 3HB ALA 52 12.069 2.301 -5.437 1946 H THR 53 H THR 53 9.935 3.001 -3.519 1947 HA THR 53 HA THR 53 9.030 0.325 -2.950 1948 HB THR 53 HB THR 53 9.040 1.110 -0.565 1949 HG1 THR 53 1HG THR 53 8.715 3.338 -1.066 1950 HG21 THR 53 3HG2 THR 53 11.623 1.636 -2.206 1951 HG22 THR 53 1HG2 THR 53 11.037 0.022 -1.652 1952 HG23 THR 53 2HG2 THR 53 11.531 1.267 -0.446 1953 H THR 54 H THR 54 7.418 3.027 -4.092 1954 HA THR 54 HA THR 54 5.478 3.917 -3.925 1955 HB THR 54 HB THR 54 3.453 2.291 -3.470 1956 HG1 THR 54 1HG THR 54 5.095 0.688 -2.723 1957 HG21 THR 54 3HG2 THR 54 3.645 1.618 -5.858 1958 HG22 THR 54 1HG2 THR 54 5.400 2.047 -5.868 1959 HG23 THR 54 2HG2 THR 54 4.147 3.329 -5.640 1960 H VAL 55 H VAL 55 6.525 5.041 -2.050 1961 HA VAL 55 HA VAL 55 4.512 4.964 0.088 1962 HB VAL 55 HB VAL 55 7.470 5.740 0.449 1963 HG11 VAL 55 1HG1 VAL 55 5.043 5.666 2.384 1964 HG12 VAL 55 2HG1 VAL 55 5.876 7.151 1.811 1965 HG13 VAL 55 3HG1 VAL 55 6.753 5.989 2.868 1966 HG21 VAL 55 3HG2 VAL 55 7.362 3.716 2.058 1967 HG22 VAL 55 1HG2 VAL 55 7.271 3.290 0.307 1968 HG23 VAL 55 2HG2 VAL 55 5.783 3.298 1.298 1969 H GLY 56 H GLY 56 7.115 7.321 -0.652 1970 HA2 GLY 56 2HA GLY 56 6.948 9.309 -1.774 1971 HA3 GLY 56 1HA GLY 56 5.160 9.049 -1.987 1972 H TYR 57 H TYR 57 7.786 9.858 0.408 1973 HA TYR 57 HA TYR 57 5.870 10.158 2.532 1974 HB2 TYR 57 2HB TYR 57 8.379 9.415 2.753 1975 HB3 TYR 57 1HB TYR 57 8.819 11.121 2.419 1976 HD1 TYR 57 1HD TYR 57 7.858 12.921 4.027 1977 HD2 TYR 57 2HD TYR 57 7.844 8.726 4.969 1978 HE1 TYR 57 1HE TYR 57 7.332 13.450 6.349 1979 HE2 TYR 57 2HE TYR 57 7.313 9.263 7.325 1980 HH TYR 57 HH TYR 57 6.020 11.176 8.535 1981 H GLY 58 H GLY 58 7.434 12.064 0.034 1982 HA2 GLY 58 2HA GLY 58 6.349 13.897 -0.855 1983 HA3 GLY 58 1HA GLY 58 5.568 14.245 0.730 1984 H ASP 59 H ASP 59 9.056 13.513 0.189 1985 HA ASP 59 HA ASP 59 9.684 16.069 1.371 1986 HB2 ASP 59 2HB ASP 59 11.236 14.139 1.799 1987 HB3 ASP 59 1HB ASP 59 11.723 14.177 0.072 1988 H ARG 60 H ARG 60 9.439 14.617 -1.913 1989 HA ARG 60 HA ARG 60 9.923 17.267 -3.022 1990 HB2 ARG 60 2HB ARG 60 11.211 14.750 -4.241 1991 HB3 ARG 60 1HB ARG 60 11.483 16.477 -4.694 1992 HG2 ARG 60 2HG ARG 60 12.233 16.839 -2.266 1993 HG3 ARG 60 1HG ARG 60 12.203 15.041 -2.052 1994 HD2 ARG 60 2HD ARG 60 14.141 14.759 -3.530 1995 HD3 ARG 60 1HD ARG 60 14.116 16.541 -3.935 1996 HE ARG 60 HE ARG 60 14.103 15.634 -1.034 1997 HH11 ARG 60 1HH2 ARG 60 15.738 17.557 -3.552 1998 HH12 ARG 60 2HH2 ARG 60 16.889 18.100 -2.512 1999 HH21 ARG 60 1HH1 ARG 60 14.944 16.986 0.393 2000 HH22 ARG 60 2HH1 ARG 60 15.994 18.313 -0.018 2001 H TYR 61 H TYR 61 8.967 17.323 -5.339 2002 HA TYR 61 HA TYR 61 6.763 15.437 -5.503 2003 HB2 TYR 61 2HB TYR 61 6.509 18.474 -6.059 2004 HB3 TYR 61 1HB TYR 61 5.181 17.255 -6.031 2005 HD1 TYR 61 2HD TYR 61 5.093 15.875 -3.664 2006 HD2 TYR 61 1HD TYR 61 6.787 19.802 -4.157 2007 HE1 TYR 61 2HE TYR 61 5.009 16.207 -1.244 2008 HE2 TYR 61 1HE TYR 61 6.690 20.145 -1.714 2009 HH TYR 61 HH TYR 61 6.204 17.484 0.455 2010 HA PRO 62 HA PRO 62 8.884 15.878 -9.467 2011 HB2 PRO 62 2HB PRO 62 7.268 14.344 -11.127 2012 HB3 PRO 62 1HB PRO 62 8.219 13.571 -9.797 2013 HG2 PRO 62 2HG PRO 62 5.269 14.441 -9.749 2014 HG3 PRO 62 1HG PRO 62 5.947 12.834 -9.266 2015 HD2 PRO 62 2HD PRO 62 5.427 14.901 -7.454 2016 HD3 PRO 62 1HD PRO 62 6.817 13.740 -7.210 2017 H VAL 63 H VAL 63 8.503 16.925 -11.617 2018 HA VAL 63 HA VAL 63 6.678 18.981 -11.666 2019 HB VAL 63 HB VAL 63 7.104 18.856 -14.283 2020 HG11 VAL 63 1HG1 VAL 63 8.131 20.471 -12.805 2021 HG12 VAL 63 2HG1 VAL 63 9.367 19.829 -13.939 2022 HG13 VAL 63 3HG1 VAL 63 9.331 19.270 -12.220 2023 HG21 VAL 63 3HG2 VAL 63 9.027 17.443 -14.909 2024 HG22 VAL 63 1HG2 VAL 63 7.744 16.401 -14.209 2025 HG23 VAL 63 2HG2 VAL 63 9.217 16.822 -13.250 2026 H THR 64 H THR 64 5.075 19.301 -13.626 2027 HA THR 64 HA THR 64 3.073 17.275 -13.259 2028 HB THR 64 HB THR 64 2.877 19.804 -14.950 2029 HG1 THR 64 1HG THR 64 2.755 19.341 -12.180 2030 HG21 THR 64 3HG2 THR 64 0.448 19.605 -14.317 2031 HG22 THR 64 1HG2 THR 64 0.800 18.094 -13.399 2032 HG23 THR 64 2HG2 THR 64 0.994 18.127 -15.188 2033 H GLU 65 H GLU 65 3.755 18.844 -16.416 2034 HA GLU 65 HA GLU 65 2.756 17.156 -18.029 2035 HB2 GLU 65 2HB GLU 65 4.635 19.274 -18.278 2036 HB3 GLU 65 1HB GLU 65 5.370 17.956 -19.206 2037 HG2 GLU 65 2HG GLU 65 4.164 18.769 -20.922 2038 HG3 GLU 65 1HG GLU 65 2.814 17.813 -20.225 2039 H GLU 66 H GLU 66 6.227 16.676 -17.206 2040 HA GLU 66 HA GLU 66 6.250 14.070 -18.489 2041 HB2 GLU 66 2HB GLU 66 8.464 15.618 -16.993 2042 HB3 GLU 66 1HB GLU 66 8.676 14.015 -17.788 2043 HG2 GLU 66 2HG GLU 66 7.831 16.602 -19.268 2044 HG3 GLU 66 1HG GLU 66 9.533 16.068 -19.065 2045 H GLY 67 H GLY 67 7.973 14.585 -15.467 2046 HA2 GLY 67 2HA GLY 67 7.680 13.956 -13.370 2047 HA3 GLY 67 1HA GLY 67 6.068 14.703 -13.654 2048 H ARG 68 H ARG 68 4.293 13.446 -14.070 2049 HA ARG 68 HA ARG 68 4.100 10.978 -12.815 2050 HB2 ARG 68 2HB ARG 68 2.173 12.421 -13.119 2051 HB3 ARG 68 1HB ARG 68 2.274 12.244 -14.914 2052 HG2 ARG 68 2HG ARG 68 1.740 9.828 -14.698 2053 HG3 ARG 68 1HG ARG 68 1.957 9.906 -12.921 2054 HD2 ARG 68 2HD ARG 68 -0.443 9.840 -13.609 2055 HD3 ARG 68 1HD ARG 68 -0.012 11.275 -12.609 2056 HE ARG 68 HE ARG 68 -0.406 12.693 -14.324 2057 HH11 ARG 68 1HH2 ARG 68 -0.087 9.360 -15.758 2058 HH12 ARG 68 2HH2 ARG 68 -0.563 9.784 -17.290 2059 HH21 ARG 68 1HH1 ARG 68 -1.144 13.284 -16.549 2060 HH22 ARG 68 2HH1 ARG 68 -1.253 12.119 -17.798 2061 H LYS 69 H LYS 69 4.669 11.792 -16.305 2062 HA LYS 69 HA LYS 69 4.314 9.150 -17.257 2063 HB2 LYS 69 2HB LYS 69 5.877 11.591 -18.244 2064 HB3 LYS 69 1HB LYS 69 6.181 10.014 -19.028 2065 HG2 LYS 69 2HG LYS 69 4.580 11.276 -20.320 2066 HG3 LYS 69 1HG LYS 69 3.922 9.719 -19.710 2067 HD2 LYS 69 2HD LYS 69 2.654 10.968 -17.913 2068 HD3 LYS 69 1HD LYS 69 3.349 12.510 -18.514 2069 HE2 LYS 69 2HE LYS 69 1.025 12.152 -19.323 2070 HE3 LYS 69 1HE LYS 69 2.178 12.204 -20.713 2071 HZ1 LYS 69 3HZ LYS 69 0.438 10.398 -20.725 2072 HZ2 LYS 69 1HZ LYS 69 1.280 9.626 -19.483 2073 HZ3 LYS 69 2HZ LYS 69 2.026 9.893 -20.987 2074 H VAL 70 H VAL 70 6.924 10.608 -15.449 2075 HA VAL 70 HA VAL 70 8.733 8.392 -16.036 2076 HB VAL 70 HB VAL 70 9.092 10.895 -14.300 2077 HG11 VAL 70 1HG1 VAL 70 11.086 8.691 -15.177 2078 HG12 VAL 70 2HG1 VAL 70 10.503 8.987 -13.496 2079 HG13 VAL 70 3HG1 VAL 70 11.511 10.224 -14.318 2080 HG21 VAL 70 3HG2 VAL 70 9.985 10.143 -17.171 2081 HG22 VAL 70 1HG2 VAL 70 10.624 11.549 -16.258 2082 HG23 VAL 70 2HG2 VAL 70 8.885 11.492 -16.702 2083 H ALA 71 H ALA 71 7.079 10.026 -13.252 2084 HA ALA 71 HA ALA 71 7.853 8.247 -11.317 2085 HB1 ALA 71 1HB ALA 71 5.220 9.857 -11.354 2086 HB2 ALA 71 2HB ALA 71 6.814 10.521 -10.859 2087 HB3 ALA 71 3HB ALA 71 6.056 9.197 -9.910 2088 H GLU 72 H GLU 72 4.807 8.271 -13.213 2089 HA GLU 72 HA GLU 72 3.414 6.230 -12.012 2090 HB2 GLU 72 2HB GLU 72 2.568 7.883 -13.758 2091 HB3 GLU 72 1HB GLU 72 3.519 7.015 -14.999 2092 HG2 GLU 72 2HG GLU 72 1.980 4.970 -14.505 2093 HG3 GLU 72 1HG GLU 72 0.974 6.107 -13.523 2094 H GLN 73 H GLN 73 5.882 6.250 -14.569 2095 HA GLN 73 HA GLN 73 5.594 3.533 -15.291 2096 HB2 GLN 73 2HB GLN 73 6.584 5.423 -16.715 2097 HB3 GLN 73 1HB GLN 73 8.045 5.365 -15.682 2098 HG2 GLN 73 2HG GLN 73 8.467 2.996 -16.430 2099 HG3 GLN 73 1HG GLN 73 6.949 3.046 -17.412 2100 HE21 GLN 73 1HE2 GLN 73 8.410 2.617 -19.307 2101 HE22 GLN 73 2HE2 GLN 73 9.248 3.948 -20.041 2102 H VAL 74 H VAL 74 7.784 5.313 -13.087 2103 HA VAL 74 HA VAL 74 9.440 3.103 -12.502 2104 HB VAL 74 HB VAL 74 8.915 5.757 -11.080 2105 HG11 VAL 74 1HG1 VAL 74 9.804 4.114 -9.384 2106 HG12 VAL 74 2HG1 VAL 74 11.032 5.339 -9.802 2107 HG13 VAL 74 3HG1 VAL 74 11.147 3.677 -10.503 2108 HG21 VAL 74 3HG2 VAL 74 10.985 6.462 -12.213 2109 HG22 VAL 74 1HG2 VAL 74 9.941 5.734 -13.468 2110 HG23 VAL 74 2HG2 VAL 74 11.302 4.784 -12.805 2111 H MET 75 H MET 75 6.642 4.596 -10.732 2112 HA MET 75 HA MET 75 6.964 2.859 -8.549 2113 HB2 MET 75 2HB MET 75 4.829 3.590 -7.719 2114 HB3 MET 75 1HB MET 75 5.780 4.981 -8.304 2115 HG2 MET 75 2HG MET 75 4.388 4.955 -10.438 2116 HG3 MET 75 1HG MET 75 3.423 3.617 -9.752 2117 HE1 MET 75 3HE MET 75 4.976 7.077 -8.485 2118 HE2 MET 75 1HE MET 75 3.491 8.072 -8.414 2119 HE3 MET 75 2HE MET 75 4.034 7.427 -9.979 2120 H LYS 76 H LYS 76 5.146 2.531 -11.603 2121 HA LYS 76 HA LYS 76 3.654 0.327 -10.719 2122 HB2 LYS 76 2HB LYS 76 3.356 1.935 -12.776 2123 HB3 LYS 76 1HB LYS 76 4.302 0.720 -13.679 2124 HG2 LYS 76 2HG LYS 76 1.824 -0.003 -11.965 2125 HG3 LYS 76 1HG LYS 76 1.630 0.782 -13.565 2126 HD2 LYS 76 2HD LYS 76 2.787 -1.059 -14.701 2127 HD3 LYS 76 1HD LYS 76 3.045 -1.924 -13.145 2128 HE2 LYS 76 2HE LYS 76 0.648 -2.287 -12.821 2129 HE3 LYS 76 1HE LYS 76 0.226 -1.112 -14.131 2130 HZ1 LYS 76 3HZ LYS 76 1.628 -3.724 -14.580 2131 HZ2 LYS 76 1HZ LYS 76 1.081 -2.579 -15.757 2132 HZ3 LYS 76 2HZ LYS 76 -0.039 -3.385 -14.826 2133 H ALA 77 H ALA 77 6.922 0.623 -12.026 2134 HA ALA 77 HA ALA 77 7.292 -2.135 -12.573 2135 HB1 ALA 77 1HB ALA 77 9.399 -0.017 -11.792 2136 HB2 ALA 77 2HB ALA 77 8.852 -0.371 -13.472 2137 HB3 ALA 77 3HB ALA 77 9.734 -1.630 -12.529 2138 H GLY 78 H GLY 78 7.689 -0.082 -9.675 2139 HA2 GLY 78 2HA GLY 78 8.949 -2.008 -8.045 2140 HA3 GLY 78 1HA GLY 78 8.007 -0.557 -7.525 2141 H ILE 79 H ILE 79 5.529 -1.084 -8.451 2142 HA ILE 79 HA ILE 79 4.408 -2.739 -6.586 2143 HB ILE 79 HB ILE 79 3.373 -1.758 -9.280 2144 HG12 ILE 79 2HG1 ILE 79 2.774 -0.871 -6.375 2145 HG13 ILE 79 1HG1 ILE 79 3.957 -0.074 -7.438 2146 HG21 ILE 79 1HG2 ILE 79 1.702 -3.074 -7.031 2147 HG22 ILE 79 2HG2 ILE 79 2.019 -3.804 -8.653 2148 HG23 ILE 79 3HG2 ILE 79 1.056 -2.310 -8.517 2149 HD11 ILE 79 3HD ILE 79 0.905 -0.227 -7.905 2150 HD12 ILE 79 1HD ILE 79 1.882 1.213 -7.469 2151 HD13 ILE 79 2HD ILE 79 2.088 0.457 -9.088 2152 H GLU 80 H GLU 80 5.204 -3.547 -10.034 2153 HA GLU 80 HA GLU 80 4.029 -6.107 -9.780 2154 HB2 GLU 80 2HB GLU 80 5.895 -5.056 -11.963 2155 HB3 GLU 80 1HB GLU 80 5.101 -6.670 -11.970 2156 HG2 GLU 80 2HG GLU 80 2.846 -5.511 -11.714 2157 HG3 GLU 80 1HG GLU 80 3.671 -3.934 -11.980 2158 H VAL 81 H VAL 81 7.295 -4.946 -9.010 2159 HA VAL 81 HA VAL 81 8.454 -7.543 -8.911 2160 HB VAL 81 HB VAL 81 9.208 -4.880 -7.614 2161 HG11 VAL 81 1HG1 VAL 81 10.679 -7.599 -7.485 2162 HG12 VAL 81 2HG1 VAL 81 10.097 -6.613 -6.093 2163 HG13 VAL 81 3HG1 VAL 81 11.447 -6.024 -7.109 2164 HG21 VAL 81 3HG2 VAL 81 10.448 -6.550 -9.917 2165 HG22 VAL 81 1HG2 VAL 81 10.993 -4.926 -9.360 2166 HG23 VAL 81 2HG2 VAL 81 9.391 -5.113 -10.145 2167 H PHE 82 H PHE 82 6.955 -5.400 -6.409 2168 HA PHE 82 HA PHE 82 7.330 -7.260 -4.325 2169 HB2 PHE 82 2HB PHE 82 5.137 -5.096 -4.548 2170 HB3 PHE 82 1HB PHE 82 5.649 -5.924 -3.027 2171 HD1 PHE 82 1HD PHE 82 8.577 -5.894 -3.079 2172 HD2 PHE 82 2HD PHE 82 5.796 -2.875 -4.397 2173 HE1 PHE 82 1HE PHE 82 10.292 -4.154 -2.750 2174 HE2 PHE 82 2HE PHE 82 7.507 -1.153 -4.061 2175 HZ PHE 82 HZ PHE 82 9.772 -1.780 -3.250 2176 H ALA 83 H ALA 83 4.900 -7.002 -6.832 2177 HA ALA 83 HA ALA 83 2.984 -8.650 -5.517 2178 HB1 ALA 83 1HB ALA 83 1.784 -8.660 -7.648 2179 HB2 ALA 83 2HB ALA 83 3.251 -8.085 -8.538 2180 HB3 ALA 83 3HB ALA 83 2.401 -7.007 -7.370 2181 H LEU 84 H LEU 84 5.670 -9.199 -7.799 2182 HA LEU 84 HA LEU 84 5.014 -11.794 -8.560 2183 HB2 LEU 84 2HB LEU 84 6.640 -10.196 -9.644 2184 HB3 LEU 84 1HB LEU 84 7.817 -10.505 -8.339 2185 HG LEU 84 HG LEU 84 6.697 -12.778 -10.084 2186 HD11 LEU 84 1HD1 LEU 84 7.477 -10.995 -11.643 2187 HD12 LEU 84 2HD1 LEU 84 8.559 -12.435 -11.702 2188 HD13 LEU 84 3HD1 LEU 84 9.078 -10.952 -10.816 2189 HD21 LEU 84 3HD2 LEU 84 8.090 -13.559 -8.172 2190 HD22 LEU 84 1HD2 LEU 84 9.414 -12.428 -8.635 2191 HD23 LEU 84 2HD2 LEU 84 8.978 -13.809 -9.706 2192 H VAL 85 H VAL 85 6.976 -10.556 -5.821 2193 HA VAL 85 HA VAL 85 7.925 -13.113 -5.128 2194 HB VAL 85 HB VAL 85 8.812 -12.142 -3.100 2195 HG11 VAL 85 1HG1 VAL 85 9.123 -10.187 -5.492 2196 HG12 VAL 85 2HG1 VAL 85 9.886 -11.808 -5.422 2197 HG13 VAL 85 3HG1 VAL 85 10.327 -10.551 -4.209 2198 HG21 VAL 85 3HG2 VAL 85 7.315 -9.558 -3.908 2199 HG22 VAL 85 1HG2 VAL 85 8.439 -9.753 -2.524 2200 HG23 VAL 85 2HG2 VAL 85 6.856 -10.603 -2.515 2201 H THR 86 H THR 86 4.788 -11.852 -4.796 2202 HA THR 86 HA THR 86 4.119 -12.897 -2.311 2203 HB THR 86 HB THR 86 2.878 -11.233 -3.973 2204 HG1 THR 86 1HG THR 86 1.571 -12.947 -2.149 2205 HG21 THR 86 3HG2 THR 86 2.309 -13.023 -5.691 2206 HG22 THR 86 1HG2 THR 86 0.883 -12.159 -5.032 2207 HG23 THR 86 2HG2 THR 86 1.256 -13.831 -4.474 2208 H ALA 87 H ALA 87 4.819 -14.466 -5.332 2209 HA ALA 87 HA ALA 87 3.342 -16.824 -5.019 2210 HB1 ALA 87 1HB ALA 87 5.036 -17.822 -6.591 2211 HB2 ALA 87 2HB ALA 87 6.110 -16.394 -6.326 2212 HB3 ALA 87 3HB ALA 87 4.524 -16.186 -7.140 2213 H ALA 88 H ALA 88 6.345 -15.692 -3.573 2214 HA ALA 88 HA ALA 88 7.211 -18.249 -2.610 2215 HB1 ALA 88 1HB ALA 88 8.815 -16.775 -1.249 2216 HB2 ALA 88 2HB ALA 88 7.973 -15.335 -1.864 2217 HB3 ALA 88 3HB ALA 88 8.878 -16.386 -3.009 2218 H LEU 89 H LEU 89 5.185 -15.557 -1.497 2219 HA LEU 89 HA LEU 89 5.123 -16.578 1.216 2220 HB2 LEU 89 2HB LEU 89 3.549 -14.314 -0.168 2221 HB3 LEU 89 1HB LEU 89 3.280 -14.828 1.524 2222 HG LEU 89 HG LEU 89 4.566 -12.844 1.542 2223 HD11 LEU 89 1HD1 LEU 89 6.477 -13.494 2.956 2224 HD12 LEU 89 2HD1 LEU 89 6.391 -15.198 2.366 2225 HD13 LEU 89 3HD1 LEU 89 5.028 -14.496 3.305 2226 HD21 LEU 89 3HD2 LEU 89 5.642 -12.832 -0.662 2227 HD22 LEU 89 1HD2 LEU 89 6.766 -14.150 -0.182 2228 HD23 LEU 89 2HD2 LEU 89 6.841 -12.548 0.639 2229 H ALA 90 H ALA 90 3.180 -16.669 -1.746 2230 HA ALA 90 HA ALA 90 0.878 -17.725 -0.581 2231 HB1 ALA 90 1HB ALA 90 0.900 -16.693 -2.872 2232 HB2 ALA 90 2HB ALA 90 0.204 -18.353 -2.894 2233 HB3 ALA 90 3HB ALA 90 1.894 -18.074 -3.467 2234 H THR 91 H THR 91 3.973 -19.332 -1.396 2235 HA THR 91 HA THR 91 2.742 -21.926 -1.412 2236 HB THR 91 HB THR 91 5.139 -22.747 -0.910 2237 HG1 THR 91 1HG THR 91 5.864 -20.692 -0.035 2238 HG21 THR 91 3HG2 THR 91 4.096 -22.579 -3.232 2239 HG22 THR 91 1HG2 THR 91 5.887 -22.394 -3.202 2240 HG23 THR 91 2HG2 THR 91 4.840 -20.935 -3.374 2241 H ASP 92 H ASP 92 3.273 -19.605 1.152 2242 HA ASP 92 HA ASP 92 4.453 -21.694 2.777 2243 HB2 ASP 92 2HB ASP 92 4.269 -18.728 3.239 2244 HB3 ASP 92 1HB ASP 92 4.921 -19.931 4.414 2245 H PHE 93 H PHE 93 1.307 -20.997 2.049 2246 HA PHE 93 HA PHE 93 0.433 -22.194 4.580 2247 HB2 PHE 93 2HB PHE 93 -1.820 -22.060 3.922 2248 HB3 PHE 93 1HB PHE 93 -1.112 -20.479 3.459 2249 HD1 PHE 93 1HD PHE 93 -0.733 -20.004 1.003 2250 HD2 PHE 93 2HD PHE 93 -2.679 -23.604 2.312 2251 HE1 PHE 93 1HE PHE 93 -1.519 -20.425 -1.298 2252 HE2 PHE 93 2HE PHE 93 -3.415 -24.050 -0.001 2253 HZ PHE 93 HZ PHE 93 -2.804 -22.471 -1.819 2254 H VAL 94 H VAL 94 1.905 -23.145 1.660 2255 HA VAL 94 HA VAL 94 0.491 -25.689 1.473 2256 HB VAL 94 HB VAL 94 2.670 -24.606 -0.383 2257 HG11 VAL 94 1HG1 VAL 94 2.324 -27.086 -0.440 2258 HG12 VAL 94 2HG1 VAL 94 1.686 -26.325 -1.939 2259 HG13 VAL 94 3HG1 VAL 94 0.552 -26.851 -0.644 2260 HG21 VAL 94 3HG2 VAL 94 -0.409 -24.370 -0.591 2261 HG22 VAL 94 1HG2 VAL 94 0.757 -23.969 -1.898 2262 HG23 VAL 94 2HG2 VAL 94 0.739 -22.999 -0.393 2263 H ARG 95 H ARG 95 3.776 -24.260 1.760 2264 HA ARG 95 HA ARG 95 5.234 -26.567 2.123 2265 HB2 ARG 95 2HB ARG 95 6.272 -24.379 1.586 2266 HB3 ARG 95 1HB ARG 95 5.748 -23.697 3.161 2267 HG2 ARG 95 2HG ARG 95 7.343 -25.013 4.396 2268 HG3 ARG 95 1HG ARG 95 7.621 -26.117 3.016 2269 HD2 ARG 95 2HD ARG 95 9.579 -24.653 3.434 2270 HD3 ARG 95 1HD ARG 95 8.885 -24.382 1.783 2271 HE ARG 95 HE ARG 95 7.786 -22.476 3.737 2272 HH11 ARG 95 1HH2 ARG 95 11.100 -23.206 2.453 2273 HH12 ARG 95 2HH2 ARG 95 11.453 -21.582 2.051 2274 HH21 ARG 95 1HH1 ARG 95 8.273 -20.200 3.054 2275 HH22 ARG 95 2HH1 ARG 95 9.851 -19.823 2.599 2276 H ARG 96 H ARG 96 3.036 -25.118 4.361 2277 HA ARG 96 HA ARG 96 4.288 -25.997 6.736 2278 HB2 ARG 96 2HB ARG 96 2.208 -25.577 7.899 2279 HB3 ARG 96 1HB ARG 96 2.463 -24.262 6.702 2280 HG2 ARG 96 2HG ARG 96 0.950 -25.524 5.100 2281 HG3 ARG 96 1HG ARG 96 0.587 -26.709 6.390 2282 HD2 ARG 96 2HD ARG 96 -0.464 -24.933 7.807 2283 HD3 ARG 96 1HD ARG 96 -0.068 -23.691 6.540 2284 HE ARG 96 HE ARG 96 -1.385 -25.020 4.916 2285 HH11 ARG 96 1HH2 ARG 96 -2.261 -25.609 8.408 2286 HH12 ARG 96 2HH2 ARG 96 -3.775 -26.325 8.014 2287 HH21 ARG 96 1HH1 ARG 96 -3.353 -26.157 4.479 2288 HH22 ARG 96 2HH1 ARG 96 -4.443 -26.574 5.755 2289 H GLU 97 H GLU 97 2.850 -27.900 4.209 2290 HA GLU 97 HA GLU 97 1.708 -29.941 5.822 2291 HB2 GLU 97 2HB GLU 97 1.854 -31.397 3.824 2292 HB3 GLU 97 1HB GLU 97 1.192 -29.793 3.373 2293 HG2 GLU 97 2HG GLU 97 3.485 -29.120 2.502 2294 HG3 GLU 97 1HG GLU 97 4.096 -30.756 2.905 2295 H GLU 98 H GLU 98 2.719 -31.972 6.470 2296 HA GLU 98 HA GLU 98 4.271 -33.190 7.374 2297 HB2 GLU 98 2HB GLU 98 6.250 -31.970 5.387 2298 HB3 GLU 98 1HB GLU 98 6.637 -33.307 6.506 2299 HG2 GLU 98 2HG GLU 98 4.371 -33.458 4.401 2300 HG3 GLU 98 1HG GLU 98 6.062 -34.000 4.108 2301 H GLU 99 H GLU 99 5.945 -30.073 6.801 2302 HA GLU 99 HA GLU 99 7.511 -30.223 9.098 2303 HB2 GLU 99 2HB GLU 99 6.674 -27.726 7.525 2304 HB3 GLU 99 1HB GLU 99 8.072 -27.840 8.653 2305 HG2 GLU 99 2HG GLU 99 7.766 -29.489 6.040 2306 HG3 GLU 99 1HG GLU 99 8.685 -27.961 6.197 2307 H ARG 100 H ARG 100 4.157 -29.242 8.724 2308 HA ARG 100 HA ARG 100 3.909 -27.746 11.072 2309 HB2 ARG 100 2HB ARG 100 2.031 -27.994 9.395 2310 HB3 ARG 100 1HB ARG 100 1.793 -29.684 9.960 2311 HG2 ARG 100 2HG ARG 100 1.238 -28.682 12.279 2312 HG3 ARG 100 1HG ARG 100 1.475 -27.058 11.567 2313 HD2 ARG 100 2HD ARG 100 -0.932 -27.608 11.671 2314 HD3 ARG 100 1HD ARG 100 -0.435 -27.558 9.928 2315 HE ARG 100 HE ARG 100 -0.744 -30.050 11.658 2316 HH11 ARG 100 1HH2 ARG 100 -0.651 -28.903 8.247 2317 HH12 ARG 100 2HH2 ARG 100 -1.959 -29.914 7.747 2318 HH21 ARG 100 1HH1 ARG 100 -2.478 -31.474 10.885 2319 HH22 ARG 100 2HH1 ARG 100 -2.905 -31.451 9.223 2320 H ARG 101 H ARG 101 4.225 -31.283 10.605 2321 HA ARG 101 HA ARG 101 3.273 -31.992 13.209 2322 HB2 ARG 101 2HB ARG 101 5.374 -33.404 11.408 2323 HB3 ARG 101 1HB ARG 101 4.702 -34.084 12.929 2324 HG2 ARG 101 2HG ARG 101 2.441 -34.177 11.885 2325 HG3 ARG 101 1HG ARG 101 3.155 -33.591 10.330 2326 HD2 ARG 101 2HD ARG 101 4.700 -35.559 10.251 2327 HD3 ARG 101 1HD ARG 101 4.126 -36.109 11.869 2328 HE ARG 101 HE ARG 101 2.505 -35.923 9.328 2329 HH11 ARG 101 1HH2 ARG 101 3.264 -37.735 12.396 2330 HH12 ARG 101 2HH2 ARG 101 2.024 -38.890 12.194 2331 HH21 ARG 101 1HH1 ARG 101 0.927 -37.650 8.974 2332 HH22 ARG 101 2HH1 ARG 101 0.686 -38.888 10.115 2333 H GLY 102 H GLY 102 6.355 -31.039 11.734 2334 HA2 GLY 102 2HA GLY 102 8.344 -30.518 12.596 2335 HA3 GLY 102 1HA GLY 102 7.632 -30.619 14.260 2336 H HIS 103 H HIS 103 7.838 -33.022 11.565 2337 HA HIS 103 HA HIS 103 9.896 -34.533 12.633 2338 HB2 HIS 103 2HB HIS 103 8.262 -35.352 14.408 2339 HB3 HIS 103 1HB HIS 103 7.054 -35.679 13.135 2340 HD1 HIS 103 1HD HIS 103 9.724 -37.404 15.020 2341 HD2 HIS 103 2HD HIS 103 7.732 -37.921 11.348 2342 HE1 HIS 103 1HE HIS 103 10.170 -39.734 14.269 2343 HE2 HIS 103 2HE HIS 103 8.916 -40.099 12.150 2344 H1 SER 1 H SER 1 -5.563 -22.757 17.372 2345 HA SER 1 HA SER 1 -3.197 -22.948 18.861 2346 HB2 SER 1 2HB SER 1 -3.518 -25.327 16.927 2347 HB3 SER 1 1HB SER 1 -2.123 -24.956 18.002 2348 HG SER 1 1HG SER 1 -3.186 -26.242 19.281 2349 H ALA 2 H ALA 2 -3.826 -24.053 15.491 2350 HA ALA 2 HA ALA 2 -3.259 -23.331 13.564 2351 HB1 ALA 2 1HB ALA 2 -5.312 -21.994 13.923 2352 HB2 ALA 2 2HB ALA 2 -4.159 -21.100 12.872 2353 HB3 ALA 2 3HB ALA 2 -4.330 -20.657 14.607 2354 H ASP 3 H ASP 3 -0.870 -23.627 13.796 2355 HA ASP 3 HA ASP 3 0.605 -21.641 14.903 2356 HB2 ASP 3 2HB ASP 3 1.374 -24.135 14.078 2357 HB3 ASP 3 1HB ASP 3 2.176 -23.147 12.804 2358 H HIS 4 H HIS 4 -0.531 -21.736 11.612 2359 HA HIS 4 HA HIS 4 1.236 -19.784 10.571 2360 HB2 HIS 4 2HB HIS 4 -0.500 -19.304 8.817 2361 HB3 HIS 4 1HB HIS 4 -0.007 -21.008 8.939 2362 HD1 HIS 4 1HD HIS 4 -3.024 -18.798 9.958 2363 HD2 HIS 4 2HD HIS 4 -2.065 -22.832 9.252 2364 HE1 HIS 4 1HE HIS 4 -5.153 -20.106 10.149 2365 HE2 HIS 4 2HE HIS 4 -4.588 -22.529 9.690 2366 H GLU 5 H GLU 5 -1.655 -19.446 12.656 2367 HA GLU 5 HA GLU 5 -1.815 -16.590 12.129 2368 HB2 GLU 5 2HB GLU 5 -3.350 -18.558 13.894 2369 HB3 GLU 5 1HB GLU 5 -3.526 -16.789 14.113 2370 HG2 GLU 5 2HG GLU 5 -4.570 -16.416 12.072 2371 HG3 GLU 5 1HG GLU 5 -3.834 -17.841 11.283 2372 H ARG 6 H ARG 6 -0.440 -18.910 14.463 2373 HA ARG 6 HA ARG 6 0.227 -16.867 16.332 2374 HB2 ARG 6 2HB ARG 6 1.595 -19.599 15.966 2375 HB3 ARG 6 1HB ARG 6 1.726 -18.515 17.387 2376 HG2 ARG 6 2HG ARG 6 -0.756 -20.080 16.446 2377 HG3 ARG 6 1HG ARG 6 0.233 -20.310 17.926 2378 HD2 ARG 6 2HD ARG 6 -0.488 -17.862 18.548 2379 HD3 ARG 6 1HD ARG 6 -1.771 -18.027 17.274 2380 HE ARG 6 HE ARG 6 -2.425 -20.196 18.581 2381 HH11 ARG 6 1HH2 ARG 6 -2.184 -16.834 19.633 2382 HH12 ARG 6 2HH2 ARG 6 -2.272 -17.035 21.274 2383 HH21 ARG 6 1HH1 ARG 6 -3.012 -20.611 21.079 2384 HH22 ARG 6 2HH1 ARG 6 -2.879 -19.293 22.118 2385 H GLU 7 H GLU 7 1.901 -18.300 13.540 2386 HA GLU 7 HA GLU 7 4.348 -17.051 13.859 2387 HB2 GLU 7 2HB GLU 7 3.528 -18.988 12.332 2388 HB3 GLU 7 1HB GLU 7 3.072 -17.725 11.148 2389 HG2 GLU 7 2HG GLU 7 5.440 -17.119 10.848 2390 HG3 GLU 7 1HG GLU 7 5.915 -18.022 12.338 2391 H ALA 8 H ALA 8 1.337 -15.950 12.331 2392 HA ALA 8 HA ALA 8 2.295 -13.591 11.225 2393 HB1 ALA 8 1HB ALA 8 -0.118 -12.829 11.276 2394 HB2 ALA 8 2HB ALA 8 -0.515 -14.192 12.371 2395 HB3 ALA 8 3HB ALA 8 0.022 -14.525 10.683 2396 H GLN 9 H GLN 9 1.093 -14.312 14.486 2397 HA GLN 9 HA GLN 9 0.930 -11.684 15.419 2398 HB2 GLN 9 2HB GLN 9 -0.037 -13.885 16.446 2399 HB3 GLN 9 1HB GLN 9 1.604 -14.198 17.082 2400 HG2 GLN 9 2HG GLN 9 0.264 -13.226 18.880 2401 HG3 GLN 9 1HG GLN 9 1.458 -11.978 18.378 2402 HE21 GLN 9 1HE2 GLN 9 -1.941 -13.120 17.674 2403 HE22 GLN 9 2HE2 GLN 9 -2.581 -11.546 17.333 2404 H LYS 10 H LYS 10 3.648 -13.951 15.149 2405 HA LYS 10 HA LYS 10 5.396 -12.586 16.926 2406 HB2 LYS 10 2HB LYS 10 6.122 -14.350 14.511 2407 HB3 LYS 10 1HB LYS 10 7.240 -13.878 15.826 2408 HG2 LYS 10 2HG LYS 10 5.983 -15.268 17.460 2409 HG3 LYS 10 1HG LYS 10 4.700 -15.562 16.241 2410 HD2 LYS 10 2HD LYS 10 6.620 -16.504 14.727 2411 HD3 LYS 10 1HD LYS 10 7.567 -16.667 16.229 2412 HE2 LYS 10 2HE LYS 10 4.732 -17.882 15.780 2413 HE3 LYS 10 1HE LYS 10 6.258 -18.749 15.380 2414 HZ1 LYS 10 3HZ LYS 10 6.882 -18.684 17.675 2415 HZ2 LYS 10 1HZ LYS 10 5.336 -19.389 17.425 2416 HZ3 LYS 10 2HZ LYS 10 5.458 -17.825 18.115 2417 H ALA 11 H ALA 11 4.625 -12.356 13.459 2418 HA ALA 11 HA ALA 11 6.823 -10.796 12.715 2419 HB1 ALA 11 1HB ALA 11 4.024 -10.824 11.419 2420 HB2 ALA 11 2HB ALA 11 5.343 -12.005 11.068 2421 HB3 ALA 11 3HB ALA 11 5.563 -10.273 10.654 2422 H GLU 12 H GLU 12 3.568 -9.911 13.914 2423 HA GLU 12 HA GLU 12 3.721 -7.135 13.690 2424 HB2 GLU 12 2HB GLU 12 2.431 -8.941 15.837 2425 HB3 GLU 12 1HB GLU 12 2.276 -7.174 15.899 2426 HG2 GLU 12 2HG GLU 12 1.454 -8.252 13.229 2427 HG3 GLU 12 1HG GLU 12 0.557 -9.018 14.590 2428 H GLU 13 H GLU 13 4.888 -9.332 16.247 2429 HA GLU 13 HA GLU 13 5.601 -7.289 18.084 2430 HB2 GLU 13 2HB GLU 13 5.123 -9.648 18.801 2431 HB3 GLU 13 1HB GLU 13 6.518 -10.213 17.833 2432 HG2 GLU 13 2HG GLU 13 7.169 -10.231 20.149 2433 HG3 GLU 13 1HG GLU 13 8.080 -8.914 19.337 2434 H GLU 14 H GLU 14 7.397 -9.225 15.629 2435 HA GLU 14 HA GLU 14 9.869 -8.186 16.415 2436 HB2 GLU 14 2HB GLU 14 9.447 -10.335 15.035 2437 HB3 GLU 14 1HB GLU 14 9.415 -9.267 13.596 2438 HG2 GLU 14 2HG GLU 14 11.743 -8.456 14.186 2439 HG3 GLU 14 1HG GLU 14 11.707 -9.467 15.680 2440 H LEU 15 H LEU 15 7.438 -7.001 14.112 2441 HA LEU 15 HA LEU 15 8.991 -5.112 12.827 2442 HB2 LEU 15 2HB LEU 15 6.650 -5.727 12.170 2443 HB3 LEU 15 1HB LEU 15 6.024 -4.888 13.620 2444 HG LEU 15 HG LEU 15 6.798 -2.706 12.751 2445 HD11 LEU 15 1HD1 LEU 15 7.736 -2.471 10.425 2446 HD12 LEU 15 2HD1 LEU 15 7.911 -4.260 10.323 2447 HD13 LEU 15 3HD1 LEU 15 8.862 -3.314 11.533 2448 HD21 LEU 15 3HD2 LEU 15 5.252 -4.281 10.589 2449 HD22 LEU 15 1HD2 LEU 15 5.261 -2.497 10.809 2450 HD23 LEU 15 2HD2 LEU 15 4.539 -3.554 12.077 2451 H GLN 16 H GLN 16 7.259 -4.919 15.939 2452 HA GLN 16 HA GLN 16 7.649 -2.193 16.418 2453 HB2 GLN 16 2HB GLN 16 7.287 -4.509 18.381 2454 HB3 GLN 16 1HB GLN 16 7.191 -2.772 18.834 2455 HG2 GLN 16 2HG GLN 16 5.216 -2.400 17.468 2456 HG3 GLN 16 1HG GLN 16 5.372 -3.993 16.657 2457 HE21 GLN 16 1HE2 GLN 16 4.080 -5.571 17.477 2458 HE22 GLN 16 2HE2 GLN 16 3.495 -5.698 19.105 2459 H LYS 17 H LYS 17 9.788 -4.968 16.889 2460 HA LYS 17 HA LYS 17 11.587 -3.698 18.673 2461 HB2 LYS 17 2HB LYS 17 11.526 -6.216 18.240 2462 HB3 LYS 17 1HB LYS 17 12.130 -5.888 16.594 2463 HG2 LYS 17 2HG LYS 17 14.157 -4.666 17.946 2464 HG3 LYS 17 1HG LYS 17 13.562 -5.663 19.301 2465 HD2 LYS 17 2HD LYS 17 15.446 -6.698 18.134 2466 HD3 LYS 17 1HD LYS 17 13.989 -7.733 17.948 2467 HE2 LYS 17 2HE LYS 17 13.702 -7.133 15.619 2468 HE3 LYS 17 1HE LYS 17 14.785 -5.690 15.767 2469 HZ1 LYS 17 3HZ LYS 17 15.951 -8.344 16.313 2470 HZ2 LYS 17 1HZ LYS 17 16.622 -6.929 15.667 2471 HZ3 LYS 17 2HZ LYS 17 15.573 -7.914 14.698 2472 H VAL 18 H VAL 18 11.312 -3.864 15.099 2473 HA VAL 18 HA VAL 18 13.825 -2.709 14.553 2474 HB VAL 18 HB VAL 18 11.286 -2.712 12.828 2475 HG11 VAL 18 1HG1 VAL 18 14.275 -2.355 12.085 2476 HG12 VAL 18 2HG1 VAL 18 12.990 -1.094 11.975 2477 HG13 VAL 18 3HG1 VAL 18 12.917 -2.538 10.912 2478 HG21 VAL 18 3HG2 VAL 18 11.880 -5.035 13.510 2479 HG22 VAL 18 1HG2 VAL 18 13.602 -4.761 13.052 2480 HG23 VAL 18 2HG2 VAL 18 12.312 -4.778 11.795 2481 H LEU 19 H LEU 19 10.554 -1.412 15.110 2482 HA LEU 19 HA LEU 19 11.040 1.228 14.406 2483 HB2 LEU 19 2HB LEU 19 9.228 0.360 16.740 2484 HB3 LEU 19 1HB LEU 19 9.120 1.860 15.774 2485 HG LEU 19 HG LEU 19 8.530 -1.014 14.886 2486 HD11 LEU 19 1HD1 LEU 19 6.657 1.413 15.150 2487 HD12 LEU 19 2HD1 LEU 19 6.771 0.037 16.305 2488 HD13 LEU 19 3HD1 LEU 19 6.192 -0.245 14.620 2489 HD21 LEU 19 3HD2 LEU 19 8.356 1.490 13.106 2490 HD22 LEU 19 1HD2 LEU 19 7.796 -0.177 12.705 2491 HD23 LEU 19 2HD2 LEU 19 9.544 0.141 12.934 2492 H GLU 20 H GLU 20 11.390 -0.422 17.618 2493 HA GLU 20 HA GLU 20 12.173 1.953 18.897 2494 HB2 GLU 20 2HB GLU 20 12.651 -0.931 19.801 2495 HB3 GLU 20 1HB GLU 20 12.931 0.547 20.784 2496 HG2 GLU 20 2HG GLU 20 10.465 1.175 20.411 2497 HG3 GLU 20 1HG GLU 20 10.209 -0.457 19.695 2498 H GLU 21 H GLU 21 14.111 -0.593 17.277 2499 HA GLU 21 HA GLU 21 16.637 0.432 18.021 2500 HB2 GLU 21 2HB GLU 21 15.756 -1.022 15.456 2501 HB3 GLU 21 1HB GLU 21 17.470 -0.710 15.873 2502 HG2 GLU 21 2HG GLU 21 15.735 -2.304 17.846 2503 HG3 GLU 21 1HG GLU 21 16.271 -3.067 16.312 2504 H ALA 22 H ALA 22 14.489 1.030 15.199 2505 HA ALA 22 HA ALA 22 16.171 2.735 13.797 2506 HB1 ALA 22 1HB ALA 22 13.084 2.690 13.813 2507 HB2 ALA 22 2HB ALA 22 14.135 1.662 12.774 2508 HB3 ALA 22 3HB ALA 22 14.120 3.452 12.554 2509 H SER 23 H SER 23 13.629 3.399 16.187 2510 HA SER 23 HA SER 23 13.465 6.104 16.127 2511 HB2 SER 23 2HB SER 23 13.561 4.336 18.678 2512 HB3 SER 23 1HB SER 23 12.884 6.003 18.588 2513 HG SER 23 1HG SER 23 11.966 3.744 17.096 2514 H LYS 24 H LYS 24 15.867 4.175 18.024 2515 HA LYS 24 HA LYS 24 17.060 6.418 19.259 2516 HB2 LYS 24 2HB LYS 24 17.641 4.260 20.235 2517 HB3 LYS 24 1HB LYS 24 18.101 3.587 18.637 2518 HG2 LYS 24 2HG LYS 24 20.125 4.968 18.531 2519 HG3 LYS 24 1HG LYS 24 19.700 5.831 20.044 2520 HD2 LYS 24 2HD LYS 24 20.425 4.036 21.377 2521 HD3 LYS 24 1HD LYS 24 19.934 2.805 20.171 2522 HE2 LYS 24 2HE LYS 24 22.436 2.929 20.469 2523 HE3 LYS 24 1HE LYS 24 21.884 3.181 18.771 2524 HZ1 LYS 24 3HZ LYS 24 22.664 5.438 20.582 2525 HZ2 LYS 24 1HZ LYS 24 22.342 5.524 18.945 2526 HZ3 LYS 24 2HZ LYS 24 23.664 4.679 19.458 2527 H LYS 25 H LYS 25 17.822 4.541 16.351 2528 HA LYS 25 HA LYS 25 20.232 5.829 15.800 2529 HB2 LYS 25 2HB LYS 25 18.295 4.298 13.961 2530 HB3 LYS 25 1HB LYS 25 19.955 4.799 13.476 2531 HG2 LYS 25 2HG LYS 25 20.960 3.445 15.248 2532 HG3 LYS 25 1HG LYS 25 19.367 3.009 15.925 2533 HD2 LYS 25 2HD LYS 25 18.743 1.770 13.912 2534 HD3 LYS 25 1HD LYS 25 20.288 2.184 13.094 2535 HE2 LYS 25 2HE LYS 25 20.117 0.631 15.783 2536 HE3 LYS 25 1HE LYS 25 20.150 -0.177 14.169 2537 HZ1 LYS 25 3HZ LYS 25 22.283 0.534 13.761 2538 HZ2 LYS 25 1HZ LYS 25 22.296 0.050 15.393 2539 HZ3 LYS 25 2HZ LYS 25 22.324 1.711 15.002 2540 H ALA 26 H ALA 26 16.888 6.402 14.634 2541 HA ALA 26 HA ALA 26 17.290 8.274 12.712 2542 HB1 ALA 26 1HB ALA 26 15.024 8.267 14.802 2543 HB2 ALA 26 2HB ALA 26 15.034 7.338 13.255 2544 HB3 ALA 26 3HB ALA 26 15.020 9.138 13.218 2545 H VAL 27 H VAL 27 17.019 8.878 16.263 2546 HA VAL 27 HA VAL 27 17.084 11.646 16.108 2547 HB VAL 27 HB VAL 27 18.368 9.904 18.296 2548 HG11 VAL 27 1HG1 VAL 27 17.345 12.836 18.344 2549 HG12 VAL 27 2HG1 VAL 27 19.051 12.299 18.557 2550 HG13 VAL 27 3HG1 VAL 27 17.823 11.888 19.801 2551 HG21 VAL 27 3HG2 VAL 27 15.958 9.310 17.845 2552 HG22 VAL 27 1HG2 VAL 27 15.498 11.029 18.083 2553 HG23 VAL 27 2HG2 VAL 27 16.189 10.063 19.447 2554 H GLU 28 H GLU 28 19.757 9.313 16.095 2555 HA GLU 28 HA GLU 28 21.769 11.384 16.361 2556 HB2 GLU 28 2HB GLU 28 22.013 8.363 15.830 2557 HB3 GLU 28 1HB GLU 28 23.341 9.443 16.383 2558 HG2 GLU 28 2HG GLU 28 22.163 9.779 18.571 2559 HG3 GLU 28 1HG GLU 28 20.762 8.804 17.998 2560 H ALA 29 H ALA 29 19.962 9.851 13.899 2561 HA ALA 29 HA ALA 29 21.987 9.741 11.887 2562 HB1 ALA 29 1HB ALA 29 18.917 9.418 11.658 2563 HB2 ALA 29 2HB ALA 29 20.050 8.073 12.063 2564 HB3 ALA 29 3HB ALA 29 20.150 8.866 10.490 2565 H GLU 30 H GLU 30 18.842 11.523 12.359 2566 HA GLU 30 HA GLU 30 19.426 13.371 10.354 2567 HB2 GLU 30 2HB GLU 30 17.479 13.484 12.707 2568 HB3 GLU 30 1HB GLU 30 17.677 14.854 11.566 2569 HG2 GLU 30 2HG GLU 30 15.828 13.719 10.666 2570 HG3 GLU 30 1HG GLU 30 17.196 13.143 9.644 2571 H ARG 31 H ARG 31 20.316 13.327 13.780 2572 HA ARG 31 HA ARG 31 21.062 16.062 13.863 2573 HB2 ARG 31 2HB ARG 31 20.489 14.633 15.842 2574 HB3 ARG 31 1HB ARG 31 22.021 13.729 15.615 2575 HG2 ARG 31 2HG ARG 31 23.300 15.841 16.117 2576 HG3 ARG 31 1HG ARG 31 21.738 16.738 16.246 2577 HD2 ARG 31 2HD ARG 31 21.034 15.179 18.129 2578 HD3 ARG 31 1HD ARG 31 22.647 14.379 18.072 2579 HE ARG 31 HE ARG 31 21.932 17.123 19.018 2580 HH11 ARG 31 1HH2 ARG 31 24.650 14.796 18.262 2581 HH12 ARG 31 2HH2 ARG 31 25.728 15.509 19.348 2582 HH21 ARG 31 1HH1 ARG 31 23.548 18.173 20.394 2583 HH22 ARG 31 2HH1 ARG 31 25.208 17.799 20.189 2584 H GLY 32 H GLY 32 22.662 16.902 12.572 2585 HA2 GLY 32 2HA GLY 32 25.085 17.101 12.562 2586 HA3 GLY 32 1HA GLY 32 25.136 15.323 12.196 2587 H ALA 33 H ALA 33 22.564 15.503 10.713 2588 HA ALA 33 HA ALA 33 23.869 15.781 8.232 2589 HB1 ALA 33 1HB ALA 33 20.930 15.122 8.857 2590 HB2 ALA 33 2HB ALA 33 22.257 13.920 8.707 2591 HB3 ALA 33 3HB ALA 33 21.754 14.883 7.266 2592 HA PRO 34 HA PRO 34 22.475 19.872 7.561 2593 HB2 PRO 34 2HB PRO 34 22.852 20.223 4.842 2594 HB3 PRO 34 1HB PRO 34 24.193 19.955 6.013 2595 HG2 PRO 34 2HG PRO 34 22.812 17.865 4.242 2596 HG3 PRO 34 1HG PRO 34 24.592 18.157 4.440 2597 HD2 PRO 34 2HD PRO 34 23.247 16.201 5.879 2598 HD3 PRO 34 1HD PRO 34 24.588 17.170 6.637 2599 H GLY 35 H GLY 35 20.308 20.371 7.958 2600 HA2 GLY 35 2HA GLY 35 18.319 21.212 7.095 2601 HA3 GLY 35 1HA GLY 35 18.451 20.096 5.675 2602 H ALA 36 H ALA 36 18.952 19.563 9.174 2603 HA ALA 36 HA ALA 36 17.478 17.123 9.098 2604 HB1 ALA 36 1HB ALA 36 19.574 17.387 10.499 2605 HB2 ALA 36 2HB ALA 36 18.158 16.976 11.522 2606 HB3 ALA 36 3HB ALA 36 18.755 18.672 11.455 2607 H ALA 37 H ALA 37 15.846 16.704 10.850 2608 HA ALA 37 HA ALA 37 14.145 19.044 11.363 2609 HB1 ALA 37 1HB ALA 37 13.220 16.342 10.164 2610 HB2 ALA 37 2HB ALA 37 13.226 17.915 9.302 2611 HB3 ALA 37 3HB ALA 37 12.131 17.674 10.714 2612 H LEU 38 H LEU 38 14.455 15.406 11.885 2613 HA LEU 38 HA LEU 38 13.129 15.782 14.411 2614 HB2 LEU 38 2HB LEU 38 12.640 13.779 12.963 2615 HB3 LEU 38 1HB LEU 38 14.301 13.193 13.230 2616 HG LEU 38 HG LEU 38 12.591 13.857 15.669 2617 HD11 LEU 38 1HD1 LEU 38 11.308 11.838 15.634 2618 HD12 LEU 38 2HD1 LEU 38 12.269 11.160 14.270 2619 HD13 LEU 38 3HD1 LEU 38 11.135 12.512 13.970 2620 HD21 LEU 38 3HD2 LEU 38 13.730 11.831 16.642 2621 HD22 LEU 38 1HD2 LEU 38 14.975 12.955 15.982 2622 HD23 LEU 38 2HD2 LEU 38 14.514 11.505 15.050 2623 H ILE 39 H ILE 39 14.181 15.958 16.388 2624 HA ILE 39 HA ILE 39 16.834 14.845 16.651 2625 HB ILE 39 HB ILE 39 17.637 17.009 17.790 2626 HG12 ILE 39 2HG1 ILE 39 15.340 18.244 16.112 2627 HG13 ILE 39 1HG1 ILE 39 15.367 18.129 17.904 2628 HG21 ILE 39 1HG2 ILE 39 18.593 17.901 15.763 2629 HG22 ILE 39 2HG2 ILE 39 17.269 17.222 14.750 2630 HG23 ILE 39 3HG2 ILE 39 18.440 16.120 15.556 2631 HD11 ILE 39 3HD ILE 39 17.316 19.743 16.127 2632 HD12 ILE 39 1HD ILE 39 16.029 20.394 17.194 2633 HD13 ILE 39 2HD ILE 39 17.469 19.571 17.919 2634 H SER 40 H SER 40 14.269 13.930 17.797 2635 HA SER 40 HA SER 40 14.929 14.503 20.604 2636 HB2 SER 40 2HB SER 40 12.128 14.762 19.365 2637 HB3 SER 40 1HB SER 40 12.420 14.637 21.135 2638 HG SER 40 1HG SER 40 12.148 16.738 20.102 2639 H TYR 41 H TYR 41 15.182 12.601 21.619 2640 HA TYR 41 HA TYR 41 14.414 10.169 20.582 2641 HB2 TYR 41 2HB TYR 41 16.119 10.765 22.535 2642 HB3 TYR 41 1HB TYR 41 14.721 10.496 23.617 2643 HD1 TYR 41 1HD TYR 41 13.461 8.138 23.266 2644 HD2 TYR 41 2HD TYR 41 17.436 9.004 21.855 2645 HE1 TYR 41 1HE TYR 41 13.969 5.735 23.229 2646 HE2 TYR 41 2HE TYR 41 17.954 6.601 21.844 2647 HH TYR 41 HH TYR 41 15.540 4.077 22.567 2648 HA PRO 42 HA PRO 42 10.613 9.888 23.224 2649 HB2 PRO 42 2HB PRO 42 9.217 12.210 24.114 2650 HB3 PRO 42 1HB PRO 42 10.411 11.287 25.097 2651 HG2 PRO 42 2HG PRO 42 10.906 13.782 23.385 2652 HG3 PRO 42 1HG PRO 42 11.435 13.471 25.090 2653 HD2 PRO 42 2HD PRO 42 13.162 13.080 23.011 2654 HD3 PRO 42 1HD PRO 42 13.100 11.850 24.356 2655 H ASP 43 H ASP 43 11.086 12.107 20.651 2656 HA ASP 43 HA ASP 43 8.293 11.845 19.768 2657 HB2 ASP 43 2HB ASP 43 10.578 13.524 18.568 2658 HB3 ASP 43 1HB ASP 43 8.896 13.410 17.947 2659 H ALA 44 H ALA 44 11.534 10.560 19.417 2660 HA ALA 44 HA ALA 44 11.444 9.946 16.694 2661 HB1 ALA 44 1HB ALA 44 13.562 10.038 18.020 2662 HB2 ALA 44 2HB ALA 44 13.385 8.498 17.120 2663 HB3 ALA 44 3HB ALA 44 13.076 8.544 18.902 2664 H ILE 45 H ILE 45 10.446 8.189 19.581 2665 HA ILE 45 HA ILE 45 9.919 5.719 18.324 2666 HB ILE 45 HB ILE 45 10.304 5.676 20.621 2667 HG12 ILE 45 2HG1 ILE 45 7.254 5.343 20.332 2668 HG13 ILE 45 1HG1 ILE 45 8.497 4.158 19.827 2669 HG21 ILE 45 1HG2 ILE 45 8.889 7.047 22.275 2670 HG22 ILE 45 2HG2 ILE 45 8.253 7.967 20.874 2671 HG23 ILE 45 3HG2 ILE 45 10.011 7.986 21.262 2672 HD11 ILE 45 3HD ILE 45 7.925 5.108 22.711 2673 HD12 ILE 45 1HD ILE 45 7.624 3.482 22.005 2674 HD13 ILE 45 2HD ILE 45 9.317 4.044 22.240 2675 H TRP 46 H TRP 46 8.191 8.754 18.409 2676 HA TRP 46 HA TRP 46 5.694 7.469 17.670 2677 HB2 TRP 46 2HB TRP 46 6.482 9.993 18.909 2678 HB3 TRP 46 1HB TRP 46 5.590 10.377 17.413 2679 HD1 TRP 46 HD TRP 46 3.053 10.581 17.810 2680 HE1 TRP 46 1HE TRP 46 1.324 9.613 19.459 2681 HE3 TRP 46 3HE TRP 46 6.181 7.675 20.566 2682 HZ2 TRP 46 2HZ TRP 46 1.372 8.061 21.870 2683 HZ3 TRP 46 3HZ TRP 46 5.319 6.506 22.567 2684 HH2 TRP 46 HH TRP 46 2.946 6.703 23.216 2685 H TRP 47 H TRP 47 8.465 9.083 16.176 2686 HA TRP 47 HA TRP 47 7.062 9.484 13.704 2687 HB2 TRP 47 2HB TRP 47 9.083 10.867 14.456 2688 HB3 TRP 47 1HB TRP 47 10.113 9.433 14.130 2689 HD1 TRP 47 HD TRP 47 7.211 10.920 11.854 2690 HE1 TRP 47 1HE TRP 47 8.214 11.414 9.549 2691 HE3 TRP 47 3HE TRP 47 12.067 9.615 12.811 2692 HZ2 TRP 47 2HZ TRP 47 10.780 11.487 8.359 2693 HZ3 TRP 47 3HZ TRP 47 13.769 9.985 11.063 2694 HH2 TRP 47 HH TRP 47 13.143 10.897 8.872 2695 H SER 48 H SER 48 9.113 6.999 15.196 2696 HA SER 48 HA SER 48 9.367 5.484 12.791 2697 HB2 SER 48 2HB SER 48 9.857 4.612 15.694 2698 HB3 SER 48 1HB SER 48 10.463 3.800 14.197 2699 HG SER 48 1HG SER 48 11.143 6.308 15.330 2700 H VAL 49 H VAL 49 6.671 5.948 12.945 2701 HA VAL 49 HA VAL 49 5.682 3.254 13.490 2702 HB VAL 49 HB VAL 49 3.887 5.669 14.001 2703 HG11 VAL 49 1HG1 VAL 49 2.481 3.887 15.052 2704 HG12 VAL 49 2HG1 VAL 49 3.744 2.640 14.687 2705 HG13 VAL 49 3HG1 VAL 49 2.852 3.463 13.348 2706 HG21 VAL 49 3HG2 VAL 49 4.194 5.172 16.455 2707 HG22 VAL 49 1HG2 VAL 49 5.709 5.763 15.703 2708 HG23 VAL 49 2HG2 VAL 49 5.521 4.013 16.051 2709 H GLU 50 H GLU 50 4.565 6.431 12.098 2710 HA GLU 50 HA GLU 50 3.184 5.421 10.107 2711 HB2 GLU 50 2HB GLU 50 3.272 7.611 8.985 2712 HB3 GLU 50 1HB GLU 50 2.863 7.661 10.714 2713 HG2 GLU 50 2HG GLU 50 5.163 8.492 11.271 2714 HG3 GLU 50 1HG GLU 50 5.614 8.419 9.524 2715 H THR 51 H THR 51 6.620 5.575 10.131 2716 HA THR 51 HA THR 51 6.991 5.382 7.318 2717 HB THR 51 HB THR 51 8.697 6.408 8.637 2718 HG1 THR 51 1HG THR 51 9.533 5.203 6.965 2719 HG21 THR 51 3HG2 THR 51 8.269 5.408 10.840 2720 HG22 THR 51 1HG2 THR 51 9.980 5.134 10.394 2721 HG23 THR 51 2HG2 THR 51 8.797 3.782 10.264 2722 H ALA 52 H ALA 52 6.350 3.020 9.922 2723 HA ALA 52 HA ALA 52 7.250 0.787 8.298 2724 HB1 ALA 52 1HB ALA 52 5.739 0.868 10.988 2725 HB2 ALA 52 2HB ALA 52 7.518 0.656 10.768 2726 HB3 ALA 52 3HB ALA 52 6.387 -0.618 10.185 2727 H THR 53 H THR 53 4.189 2.490 9.237 2728 HA THR 53 HA THR 53 2.600 0.562 7.858 2729 HB THR 53 HB THR 53 0.918 2.647 8.413 2730 HG1 THR 53 1HG THR 53 1.684 3.589 10.398 2731 HG21 THR 53 3HG2 THR 53 2.083 0.584 10.418 2732 HG22 THR 53 1HG2 THR 53 0.758 0.274 9.228 2733 HG23 THR 53 2HG2 THR 53 0.501 1.442 10.580 2734 H THR 54 H THR 54 4.729 2.865 6.819 2735 HA THR 54 HA THR 54 5.161 3.874 4.981 2736 HB THR 54 HB THR 54 4.361 2.853 2.787 2737 HG1 THR 54 1HG THR 54 2.575 1.787 4.310 2738 HG21 THR 54 3HG2 THR 54 5.654 1.036 4.951 2739 HG22 THR 54 1HG2 THR 54 6.515 2.296 3.997 2740 HG23 THR 54 2HG2 THR 54 5.820 0.858 3.166 2741 H VAL 55 H VAL 55 3.339 5.314 6.447 2742 HA VAL 55 HA VAL 55 1.787 6.648 4.337 2743 HB VAL 55 HB VAL 55 0.024 7.020 6.198 2744 HG11 VAL 55 1HG1 VAL 55 0.363 4.219 4.931 2745 HG12 VAL 55 2HG1 VAL 55 -0.351 5.668 4.133 2746 HG13 VAL 55 3HG1 VAL 55 -1.168 4.930 5.565 2747 HG21 VAL 55 3HG2 VAL 55 1.331 6.100 8.143 2748 HG22 VAL 55 1HG2 VAL 55 1.449 4.498 7.339 2749 HG23 VAL 55 2HG2 VAL 55 -0.139 5.111 7.862 2750 H GLY 56 H GLY 56 3.967 7.771 4.520 2751 HA2 GLY 56 2HA GLY 56 4.547 9.190 6.941 2752 HA3 GLY 56 1HA GLY 56 5.227 9.417 5.271 2753 H TYR 57 H TYR 57 2.895 10.534 7.592 2754 HA TYR 57 HA TYR 57 1.251 11.794 5.622 2755 HB2 TYR 57 2HB TYR 57 0.667 10.884 8.065 2756 HB3 TYR 57 1HB TYR 57 1.165 12.520 8.619 2757 HD1 TYR 57 2HD TYR 57 -0.258 13.579 5.652 2758 HD2 TYR 57 1HD TYR 57 -1.457 11.392 9.169 2759 HE1 TYR 57 2HE TYR 57 -2.544 14.241 5.285 2760 HE2 TYR 57 1HE TYR 57 -3.795 12.055 8.761 2761 HH TYR 57 HH TYR 57 -4.935 13.422 5.798 2762 H GLY 58 H GLY 58 3.910 12.644 7.766 2763 HA2 GLY 58 2HA GLY 58 5.366 14.168 6.527 2764 HA3 GLY 58 1HA GLY 58 4.004 15.337 6.498 2765 H ASP 59 H ASP 59 5.150 13.230 9.243 2766 HA ASP 59 HA ASP 59 4.925 15.577 10.874 2767 HB2 ASP 59 2HB ASP 59 4.393 13.213 11.715 2768 HB3 ASP 59 1HB ASP 59 6.162 12.961 11.855 2769 H ARG 60 H ARG 60 7.776 13.583 9.634 2770 HA ARG 60 HA ARG 60 9.305 16.014 9.899 2771 HB2 ARG 60 2HB ARG 60 10.273 13.453 11.324 2772 HB3 ARG 60 1HB ARG 60 11.307 14.856 10.917 2773 HG2 ARG 60 2HG ARG 60 10.873 15.462 13.076 2774 HG3 ARG 60 1HG ARG 60 9.488 16.254 12.254 2775 HD2 ARG 60 2HD ARG 60 8.306 13.841 12.823 2776 HD3 ARG 60 1HD ARG 60 9.548 13.813 14.125 2777 HE ARG 60 HE ARG 60 7.236 15.593 13.704 2778 HH11 ARG 60 1HH2 ARG 60 9.546 16.459 15.989 2779 HH12 ARG 60 2HH2 ARG 60 8.839 15.771 17.370 2780 HH21 ARG 60 1HH1 ARG 60 6.098 14.422 15.397 2781 HH22 ARG 60 2HH1 ARG 60 6.544 14.823 17.021 2782 H TYR 61 H TYR 61 11.697 15.354 8.892 2783 HA TYR 61 HA TYR 61 11.055 13.782 6.541 2784 HB2 TYR 61 2HB TYR 61 12.292 16.621 6.444 2785 HB3 TYR 61 1HB TYR 61 11.889 15.565 5.037 2786 HD1 TYR 61 1HD TYR 61 10.547 17.736 7.726 2787 HD2 TYR 61 2HD TYR 61 9.486 15.207 4.413 2788 HE1 TYR 61 1HE TYR 61 8.203 18.461 7.931 2789 HE2 TYR 61 2HE TYR 61 7.154 15.984 4.564 2790 HH TYR 61 HH TYR 61 5.841 17.321 7.249 2791 HA PRO 62 HA PRO 62 15.334 12.957 7.987 2792 HB2 PRO 62 2HB PRO 62 16.000 10.943 6.162 2793 HB3 PRO 62 1HB PRO 62 14.825 10.654 7.488 2794 HG2 PRO 62 2HG PRO 62 14.284 11.353 4.551 2795 HG3 PRO 62 1HG PRO 62 13.484 10.077 5.565 2796 HD2 PRO 62 2HD PRO 62 12.458 12.664 5.087 2797 HD3 PRO 62 1HD PRO 62 12.050 11.675 6.565 2798 H VAL 63 H VAL 63 17.530 12.609 6.482 2799 HA VAL 63 HA VAL 63 17.498 14.907 4.648 2800 HB VAL 63 HB VAL 63 19.863 14.078 6.402 2801 HG11 VAL 63 1HG1 VAL 63 20.379 15.419 4.276 2802 HG12 VAL 63 2HG1 VAL 63 20.629 16.396 5.764 2803 HG13 VAL 63 3HG1 VAL 63 19.150 16.631 4.779 2804 HG21 VAL 63 3HG2 VAL 63 18.093 14.709 7.944 2805 HG22 VAL 63 1HG2 VAL 63 17.596 16.090 6.898 2806 HG23 VAL 63 2HG2 VAL 63 19.179 16.127 7.756 2807 H THR 64 H THR 64 20.284 12.787 5.198 2808 HA THR 64 HA THR 64 19.901 11.004 3.141 2809 HB THR 64 HB THR 64 21.499 13.523 2.416 2810 HG1 THR 64 1HG THR 64 19.290 13.026 1.748 2811 HG21 THR 64 3HG2 THR 64 22.507 12.205 0.478 2812 HG22 THR 64 1HG2 THR 64 21.927 10.681 1.256 2813 HG23 THR 64 2HG2 THR 64 23.152 11.711 2.071 2814 H GLU 65 H GLU 65 22.252 13.083 4.928 2815 HA GLU 65 HA GLU 65 24.136 11.023 5.170 2816 HB2 GLU 65 2HB GLU 65 24.527 13.525 5.241 2817 HB3 GLU 65 1HB GLU 65 23.885 13.539 6.920 2818 HG2 GLU 65 2HG GLU 65 25.739 12.141 7.706 2819 HG3 GLU 65 1HG GLU 65 26.252 11.784 6.016 2820 H GLU 66 H GLU 66 21.107 11.394 6.637 2821 HA GLU 66 HA GLU 66 21.589 10.299 9.165 2822 HB2 GLU 66 2HB GLU 66 19.036 9.558 8.867 2823 HB3 GLU 66 1HB GLU 66 19.507 11.232 9.203 2824 HG2 GLU 66 2HG GLU 66 17.783 11.284 7.688 2825 HG3 GLU 66 1HG GLU 66 19.247 11.826 6.782 2826 H GLY 67 H GLY 67 21.215 8.944 5.912 2827 HA2 GLY 67 2HA GLY 67 22.710 6.855 6.154 2828 HA3 GLY 67 1HA GLY 67 21.226 6.271 7.029 2829 H ARG 68 H ARG 68 19.396 8.030 5.535 2830 HA ARG 68 HA ARG 68 18.132 8.128 3.852 2831 HB2 ARG 68 2HB ARG 68 19.894 8.394 2.197 2832 HB3 ARG 68 1HB ARG 68 20.226 6.636 2.166 2833 HG2 ARG 68 2HG ARG 68 18.067 6.119 1.162 2834 HG3 ARG 68 1HG ARG 68 17.473 7.788 1.401 2835 HD2 ARG 68 2HD ARG 68 19.804 6.936 -0.453 2836 HD3 ARG 68 1HD ARG 68 18.131 7.389 -0.991 2837 HE ARG 68 HE ARG 68 18.577 9.601 0.271 2838 HH11 ARG 68 1HH2 ARG 68 21.345 7.820 -1.206 2839 HH12 ARG 68 2HH2 ARG 68 22.036 9.126 -1.973 2840 HH21 ARG 68 1HH1 ARG 68 19.981 11.553 -0.336 2841 HH22 ARG 68 2HH1 ARG 68 20.929 11.372 -1.737 2842 H LYS 69 H LYS 69 19.841 5.142 4.080 2843 HA LYS 69 HA LYS 69 17.688 3.342 3.779 2844 HB2 LYS 69 2HB LYS 69 20.378 2.905 5.233 2845 HB3 LYS 69 1HB LYS 69 19.353 1.646 4.469 2846 HG2 LYS 69 2HG LYS 69 20.943 3.871 2.995 2847 HG3 LYS 69 1HG LYS 69 21.447 2.169 3.213 2848 HD2 LYS 69 2HD LYS 69 19.501 1.374 1.925 2849 HD3 LYS 69 1HD LYS 69 18.913 3.057 1.705 2850 HE2 LYS 69 2HE LYS 69 20.883 3.643 0.328 2851 HE3 LYS 69 1HE LYS 69 21.641 2.030 0.650 2852 HZ1 LYS 69 3HZ LYS 69 20.505 2.228 -1.516 2853 HZ2 LYS 69 1HZ LYS 69 19.010 2.402 -0.703 2854 HZ3 LYS 69 2HZ LYS 69 19.901 0.965 -0.529 2855 H VAL 70 H VAL 70 17.833 5.598 6.157 2856 HA VAL 70 HA VAL 70 17.425 3.869 8.448 2857 HB VAL 70 HB VAL 70 16.797 6.857 8.072 2858 HG11 VAL 70 1HG1 VAL 70 15.415 5.790 9.888 2859 HG12 VAL 70 2HG1 VAL 70 16.677 6.865 10.568 2860 HG13 VAL 70 3HG1 VAL 70 16.905 5.077 10.617 2861 HG21 VAL 70 3HG2 VAL 70 18.866 7.189 9.416 2862 HG22 VAL 70 1HG2 VAL 70 19.212 6.438 7.839 2863 HG23 VAL 70 2HG2 VAL 70 19.234 5.427 9.344 2864 H ALA 71 H ALA 71 15.489 6.143 6.433 2865 HA ALA 71 HA ALA 71 13.038 5.206 7.378 2866 HB1 ALA 71 1HB ALA 71 13.304 7.446 6.282 2867 HB2 ALA 71 2HB ALA 71 12.028 6.474 5.473 2868 HB3 ALA 71 3HB ALA 71 13.659 6.626 4.715 2869 H GLU 72 H GLU 72 14.782 4.495 4.305 2870 HA GLU 72 HA GLU 72 12.884 2.925 3.116 2871 HB2 GLU 72 2HB GLU 72 15.043 3.638 2.008 2872 HB3 GLU 72 1HB GLU 72 15.917 2.469 3.035 2873 HG2 GLU 72 2HG GLU 72 13.795 0.989 1.626 2874 HG3 GLU 72 1HG GLU 72 14.591 2.057 0.440 2875 H GLN 73 H GLN 73 15.252 1.979 5.609 2876 HA GLN 73 HA GLN 73 14.810 -0.790 5.229 2877 HB2 GLN 73 2HB GLN 73 16.897 0.206 6.120 2878 HB3 GLN 73 1HB GLN 73 16.044 0.667 7.633 2879 HG2 GLN 73 2HG GLN 73 15.760 -1.730 8.236 2880 HG3 GLN 73 1HG GLN 73 16.246 -2.243 6.579 2881 HE21 GLN 73 1HE2 GLN 73 17.551 -0.191 9.312 2882 HE22 GLN 73 2HE2 GLN 73 19.199 -0.683 9.102 2883 H VAL 74 H VAL 74 13.326 1.693 7.383 2884 HA VAL 74 HA VAL 74 11.979 -0.298 8.941 2885 HB VAL 74 HB VAL 74 11.370 2.691 8.698 2886 HG11 VAL 74 1HG1 VAL 74 10.562 0.509 10.758 2887 HG12 VAL 74 2HG1 VAL 74 9.461 1.432 9.667 2888 HG13 VAL 74 3HG1 VAL 74 10.324 2.282 10.992 2889 HG21 VAL 74 3HG2 VAL 74 13.743 2.247 9.463 2890 HG22 VAL 74 1HG2 VAL 74 13.122 1.112 10.714 2891 HG23 VAL 74 2HG2 VAL 74 12.720 2.872 10.791 2892 H MET 75 H MET 75 11.175 1.845 6.180 2893 HA MET 75 HA MET 75 8.502 1.213 5.873 2894 HB2 MET 75 2HB MET 75 10.703 1.817 3.812 2895 HB3 MET 75 1HB MET 75 8.968 1.688 3.350 2896 HG2 MET 75 2HG MET 75 8.330 3.630 4.473 2897 HG3 MET 75 1HG MET 75 9.706 3.569 5.597 2898 HE1 MET 75 3HE MET 75 11.069 2.986 1.915 2899 HE2 MET 75 1HE MET 75 10.843 4.590 1.157 2900 HE3 MET 75 2HE MET 75 9.422 3.583 1.558 2901 H LYS 76 H LYS 76 11.362 -0.388 4.384 2902 HA LYS 76 HA LYS 76 9.879 -2.305 3.003 2903 HB2 LYS 76 2HB LYS 76 12.221 -1.811 2.422 2904 HB3 LYS 76 1HB LYS 76 12.778 -2.382 4.027 2905 HG2 LYS 76 2HG LYS 76 12.220 -4.689 3.514 2906 HG3 LYS 76 1HG LYS 76 11.333 -4.225 2.022 2907 HD2 LYS 76 2HD LYS 76 13.376 -3.686 0.846 2908 HD3 LYS 76 1HD LYS 76 14.313 -3.563 2.363 2909 HE2 LYS 76 2HE LYS 76 14.872 -5.650 1.051 2910 HE3 LYS 76 1HE LYS 76 14.296 -5.970 2.734 2911 HZ1 LYS 76 3HZ LYS 76 13.378 -7.105 0.443 2912 HZ2 LYS 76 1HZ LYS 76 12.160 -5.990 0.829 2913 HZ3 LYS 76 2HZ LYS 76 12.607 -7.115 2.017 2914 H ALA 77 H ALA 77 11.252 -2.336 6.310 2915 HA ALA 77 HA ALA 77 10.815 -5.038 6.841 2916 HB1 ALA 77 1HB ALA 77 12.221 -3.570 8.332 2917 HB2 ALA 77 2HB ALA 77 10.926 -4.411 9.264 2918 HB3 ALA 77 3HB ALA 77 10.738 -2.672 8.824 2919 H GLY 78 H GLY 78 8.672 -2.189 7.137 2920 HA2 GLY 78 2HA GLY 78 6.569 -3.495 8.476 2921 HA3 GLY 78 1HA GLY 78 6.497 -2.007 7.454 2922 H ILE 79 H ILE 79 7.133 -2.841 4.981 2923 HA ILE 79 HA ILE 79 4.765 -3.911 4.068 2924 HB ILE 79 HB ILE 79 7.483 -3.785 2.686 2925 HG12 ILE 79 2HG1 ILE 79 5.021 -1.924 2.474 2926 HG13 ILE 79 1HG1 ILE 79 6.429 -1.581 3.510 2927 HG21 ILE 79 1HG2 ILE 79 4.657 -4.247 1.489 2928 HG22 ILE 79 2HG2 ILE 79 6.004 -5.442 1.497 2929 HG23 ILE 79 3HG2 ILE 79 6.150 -3.949 0.528 2930 HD11 ILE 79 3HD ILE 79 6.485 -1.825 0.429 2931 HD12 ILE 79 1HD ILE 79 6.641 -0.332 1.405 2932 HD13 ILE 79 2HD ILE 79 7.936 -1.581 1.478 2933 H GLU 80 H GLU 80 7.952 -5.642 4.524 2934 HA GLU 80 HA GLU 80 6.659 -8.017 3.528 2935 HB2 GLU 80 2HB GLU 80 8.699 -9.288 3.971 2936 HB3 GLU 80 1HB GLU 80 8.852 -7.920 2.835 2937 HG2 GLU 80 2HG GLU 80 10.023 -6.547 4.528 2938 HG3 GLU 80 1HG GLU 80 9.844 -7.847 5.756 2939 H VAL 81 H VAL 81 6.552 -6.557 6.614 2940 HA VAL 81 HA VAL 81 6.152 -9.040 8.037 2941 HB VAL 81 HB VAL 81 5.922 -6.094 8.692 2942 HG11 VAL 81 1HG1 VAL 81 4.648 -8.366 10.361 2943 HG12 VAL 81 2HG1 VAL 81 3.839 -6.896 9.701 2944 HG13 VAL 81 3HG1 VAL 81 5.063 -6.738 11.003 2945 HG21 VAL 81 3HG2 VAL 81 7.549 -6.756 10.441 2946 HG22 VAL 81 1HG2 VAL 81 8.095 -7.405 8.857 2947 HG23 VAL 81 2HG2 VAL 81 7.319 -8.502 10.058 2948 H PHE 82 H PHE 82 4.118 -6.422 6.590 2949 HA PHE 82 HA PHE 82 1.690 -7.654 7.305 2950 HB2 PHE 82 2HB PHE 82 2.194 -5.788 4.901 2951 HB3 PHE 82 1HB PHE 82 0.604 -6.097 5.698 2952 HD1 PHE 82 1HD PHE 82 1.459 -5.886 8.656 2953 HD2 PHE 82 2HD PHE 82 2.453 -3.504 5.204 2954 HE1 PHE 82 1HE PHE 82 1.945 -3.965 10.113 2955 HE2 PHE 82 2HE PHE 82 2.921 -1.582 6.673 2956 HZ PHE 82 HZ PHE 82 2.685 -1.801 9.127 2957 H ALA 83 H ALA 83 3.941 -8.294 4.725 2958 HA ALA 83 HA ALA 83 2.016 -9.837 3.191 2959 HB1 ALA 83 1HB ALA 83 3.925 -10.304 1.675 2960 HB2 ALA 83 2HB ALA 83 5.069 -9.567 2.862 2961 HB3 ALA 83 3HB ALA 83 3.837 -8.542 2.034 2962 H LEU 84 H LEU 84 4.102 -10.435 5.899 2963 HA LEU 84 HA LEU 84 4.779 -13.140 5.224 2964 HB2 LEU 84 2HB LEU 84 6.099 -11.613 6.758 2965 HB3 LEU 84 1HB LEU 84 4.803 -11.719 7.977 2966 HG LEU 84 HG LEU 84 6.275 -14.205 6.909 2967 HD11 LEU 84 1HD1 LEU 84 7.192 -12.394 9.236 2968 HD12 LEU 84 2HD1 LEU 84 8.011 -12.579 7.642 2969 HD13 LEU 84 3HD1 LEU 84 7.918 -13.977 8.775 2970 HD21 LEU 84 3HD2 LEU 84 5.816 -15.130 9.221 2971 HD22 LEU 84 1HD2 LEU 84 4.314 -14.783 8.321 2972 HD23 LEU 84 2HD2 LEU 84 4.864 -13.655 9.612 2973 H VAL 85 H VAL 85 2.303 -11.397 7.082 2974 HA VAL 85 HA VAL 85 1.247 -13.646 8.350 2975 HB VAL 85 HB VAL 85 -0.570 -12.293 9.094 2976 HG11 VAL 85 1HG1 VAL 85 0.709 -10.502 10.187 2977 HG12 VAL 85 2HG1 VAL 85 1.940 -10.476 8.885 2978 HG13 VAL 85 3HG1 VAL 85 1.834 -11.890 9.985 2979 HG21 VAL 85 3HG2 VAL 85 -1.250 -11.177 6.963 2980 HG22 VAL 85 1HG2 VAL 85 0.294 -10.253 6.949 2981 HG23 VAL 85 2HG2 VAL 85 -0.925 -9.948 8.229 2982 H THR 86 H THR 86 1.137 -12.895 5.049 2983 HA THR 86 HA THR 86 -1.403 -13.732 4.393 2984 HB THR 86 HB THR 86 1.142 -13.951 2.735 2985 HG1 THR 86 1HG THR 86 -0.611 -11.750 3.218 2986 HG21 THR 86 3HG2 THR 86 -0.426 -13.491 0.815 2987 HG22 THR 86 1HG2 THR 86 -1.839 -13.561 1.931 2988 HG23 THR 86 2HG2 THR 86 -0.837 -15.032 1.637 2989 H ALA 87 H ALA 87 1.296 -15.611 5.609 2990 HA ALA 87 HA ALA 87 0.496 -18.122 4.606 2991 HB1 ALA 87 1HB ALA 87 1.701 -19.086 6.571 2992 HB2 ALA 87 2HB ALA 87 1.763 -17.452 7.339 2993 HB3 ALA 87 3HB ALA 87 2.667 -17.774 5.818 2994 H ALA 88 H ALA 88 -1.081 -15.942 6.832 2995 HA ALA 88 HA ALA 88 -2.896 -18.066 7.736 2996 HB1 ALA 88 1HB ALA 88 -3.491 -16.445 9.584 2997 HB2 ALA 88 2HB ALA 88 -2.332 -15.258 8.905 2998 HB3 ALA 88 3HB ALA 88 -1.715 -16.787 9.610 2999 H LEU 89 H LEU 89 -2.669 -15.924 5.257 3000 HA LEU 89 HA LEU 89 -5.536 -15.171 5.486 3001 HB2 LEU 89 2HB LEU 89 -3.411 -13.849 3.697 3002 HB3 LEU 89 1HB LEU 89 -5.149 -13.430 3.769 3003 HG LEU 89 HG LEU 89 -3.162 -13.112 6.101 3004 HD11 LEU 89 1HD1 LEU 89 -2.659 -11.540 4.219 3005 HD12 LEU 89 2HD1 LEU 89 -3.322 -10.665 5.644 3006 HD13 LEU 89 3HD1 LEU 89 -4.373 -10.981 4.215 3007 HD21 LEU 89 3HD2 LEU 89 -5.471 -13.460 6.951 3008 HD22 LEU 89 1HD2 LEU 89 -6.100 -12.187 5.834 3009 HD23 LEU 89 2HD2 LEU 89 -4.975 -11.749 7.169 3010 H ALA 90 H ALA 90 -2.880 -16.476 3.433 3011 HA ALA 90 HA ALA 90 -4.605 -17.026 1.252 3012 HB1 ALA 90 1HB ALA 90 -2.143 -16.767 0.918 3013 HB2 ALA 90 2HB ALA 90 -2.693 -18.396 0.385 3014 HB3 ALA 90 3HB ALA 90 -1.850 -18.198 1.972 3015 H THR 91 H THR 91 -4.214 -18.493 4.366 3016 HA THR 91 HA THR 91 -4.975 -21.128 3.645 3017 HB THR 91 HB THR 91 -5.749 -21.030 6.196 3018 HG1 THR 91 1HG THR 91 -5.765 -18.761 6.436 3019 HG21 THR 91 3HG2 THR 91 -3.358 -21.259 6.910 3020 HG22 THR 91 1HG2 THR 91 -2.813 -20.547 5.352 3021 HG23 THR 91 2HG2 THR 91 -3.662 -22.141 5.365 3022 H ASP 92 H ASP 92 -6.683 -18.021 3.775 3023 HA ASP 92 HA ASP 92 -9.007 -19.398 4.843 3024 HB2 ASP 92 2HB ASP 92 -8.256 -16.466 4.632 3025 HB3 ASP 92 1HB ASP 92 -9.936 -17.016 5.011 3026 H PHE 93 H PHE 93 -7.886 -19.270 1.828 3027 HA PHE 93 HA PHE 93 -10.643 -19.395 0.817 3028 HB2 PHE 93 2HB PHE 93 -9.885 -19.665 -1.358 3029 HB3 PHE 93 1HB PHE 93 -8.833 -18.374 -0.707 3030 HD1 PHE 93 2HD PHE 93 -9.101 -21.900 -1.840 3031 HD2 PHE 93 1HD PHE 93 -6.397 -18.834 -0.510 3032 HE1 PHE 93 2HE PHE 93 -7.196 -23.217 -2.690 3033 HE2 PHE 93 1HE PHE 93 -4.495 -20.140 -1.380 3034 HZ PHE 93 HZ PHE 93 -4.896 -22.336 -2.491 3035 H VAL 94 H VAL 94 -8.134 -21.250 2.337 3036 HA VAL 94 HA VAL 94 -8.917 -23.753 1.129 3037 HB VAL 94 HB VAL 94 -6.868 -23.301 3.363 3038 HG11 VAL 94 1HG1 VAL 94 -7.238 -25.516 1.227 3039 HG12 VAL 94 2HG1 VAL 94 -7.597 -25.679 2.985 3040 HG13 VAL 94 3HG1 VAL 94 -5.901 -25.427 2.434 3041 HG21 VAL 94 3HG2 VAL 94 -5.157 -23.199 1.541 3042 HG22 VAL 94 1HG2 VAL 94 -6.260 -21.799 1.437 3043 HG23 VAL 94 2HG2 VAL 94 -6.458 -23.179 0.300 3044 H ARG 95 H ARG 95 -8.984 -21.998 4.216 3045 HA ARG 95 HA ARG 95 -9.754 -23.962 5.922 3046 HB2 ARG 95 2HB ARG 95 -9.038 -21.473 6.361 3047 HB3 ARG 95 1HB ARG 95 -10.761 -21.057 6.125 3048 HG2 ARG 95 2HG ARG 95 -11.282 -22.716 8.043 3049 HG3 ARG 95 1HG ARG 95 -9.516 -22.831 8.322 3050 HD2 ARG 95 2HD ARG 95 -11.304 -20.305 8.540 3051 HD3 ARG 95 1HD ARG 95 -10.531 -21.186 9.908 3052 HE ARG 95 HE ARG 95 -9.317 -19.278 7.945 3053 HH11 ARG 95 1HH2 ARG 95 -8.904 -20.937 11.126 3054 HH12 ARG 95 2HH2 ARG 95 -7.444 -20.038 11.425 3055 HH21 ARG 95 1HH1 ARG 95 -7.297 -18.364 8.342 3056 HH22 ARG 95 2HH1 ARG 95 -6.646 -18.510 9.969 3057 H ARG 96 H ARG 96 -11.842 -21.927 3.867 3058 HA ARG 96 HA ARG 96 -14.263 -22.916 4.887 3059 HB2 ARG 96 2HB ARG 96 -15.240 -21.953 2.716 3060 HB3 ARG 96 1HB ARG 96 -14.340 -20.817 3.755 3061 HG2 ARG 96 2HG ARG 96 -12.806 -20.352 2.197 3062 HG3 ARG 96 1HG ARG 96 -12.461 -22.077 1.866 3063 HD2 ARG 96 2HD ARG 96 -14.792 -20.492 0.641 3064 HD3 ARG 96 1HD ARG 96 -13.235 -20.902 -0.186 3065 HE ARG 96 HE ARG 96 -13.843 -23.360 0.349 3066 HH11 ARG 96 1HH2 ARG 96 -16.580 -21.019 0.034 3067 HH12 ARG 96 2HH2 ARG 96 -17.487 -22.038 -0.929 3068 HH21 ARG 96 1HH1 ARG 96 -15.269 -24.846 -0.958 3069 HH22 ARG 96 2HH1 ARG 96 -16.602 -24.143 -1.751 3070 H GLU 97 H GLU 97 -11.940 -24.702 3.075 3071 HA GLU 97 HA GLU 97 -14.117 -26.277 1.923 3072 HB2 GLU 97 2HB GLU 97 -12.396 -25.346 0.255 3073 HB3 GLU 97 1HB GLU 97 -11.183 -26.400 1.049 3074 HG2 GLU 97 2HG GLU 97 -12.232 -27.359 -1.095 3075 HG3 GLU 97 1HG GLU 97 -12.447 -28.419 0.343 3076 H GLU 98 H GLU 98 -13.990 -28.515 2.230 3077 HA GLU 98 HA GLU 98 -13.913 -30.292 3.451 3078 HB2 GLU 98 2HB GLU 98 -11.218 -29.443 4.574 3079 HB3 GLU 98 1HB GLU 98 -11.990 -31.045 4.798 3080 HG2 GLU 98 2HG GLU 98 -11.999 -31.436 2.332 3081 HG3 GLU 98 1HG GLU 98 -11.234 -29.830 2.051 3082 H GLU 99 H GLU 99 -12.864 -27.594 5.619 3083 HA GLU 99 HA GLU 99 -14.116 -28.653 7.885 3084 HB2 GLU 99 2HB GLU 99 -12.351 -26.709 7.701 3085 HB3 GLU 99 1HB GLU 99 -13.762 -25.661 7.415 3086 HG2 GLU 99 2HG GLU 99 -13.429 -25.400 9.705 3087 HG3 GLU 99 1HG GLU 99 -14.689 -26.679 9.709 3088 H ARG 100 H ARG 100 -15.439 -26.979 5.088 3089 HA ARG 100 HA ARG 100 -17.885 -26.194 6.264 3090 HB2 ARG 100 2HB ARG 100 -18.830 -26.118 3.943 3091 HB3 ARG 100 1HB ARG 100 -17.329 -25.174 4.161 3092 HG2 ARG 100 2HG ARG 100 -15.976 -26.869 3.071 3093 HG3 ARG 100 1HG ARG 100 -17.345 -28.008 2.912 3094 HD2 ARG 100 2HD ARG 100 -17.595 -25.171 1.741 3095 HD3 ARG 100 1HD ARG 100 -16.560 -26.350 0.886 3096 HE ARG 100 HE ARG 100 -19.534 -26.588 1.394 3097 HH11 ARG 100 1HH2 ARG 100 -16.511 -28.072 -0.065 3098 HH12 ARG 100 2HH2 ARG 100 -17.347 -28.774 -1.355 3099 HH21 ARG 100 1HH1 ARG 100 -20.700 -27.921 -0.364 3100 HH22 ARG 100 2HH1 ARG 100 -19.733 -28.791 -1.446 3101 H ARG 101 H ARG 101 -16.711 -29.379 5.471 3102 HA ARG 101 HA ARG 101 -19.444 -30.430 5.270 3103 HB2 ARG 101 2HB ARG 101 -16.769 -31.948 5.227 3104 HB3 ARG 101 1HB ARG 101 -18.395 -32.575 4.792 3105 HG2 ARG 101 2HG ARG 101 -18.413 -30.826 2.865 3106 HG3 ARG 101 1HG ARG 101 -16.727 -30.422 3.320 3107 HD2 ARG 101 2HD ARG 101 -16.649 -31.979 1.423 3108 HD3 ARG 101 1HD ARG 101 -16.032 -32.822 2.908 3109 HE ARG 101 HE ARG 101 -18.916 -33.197 2.573 3110 HH11 ARG 101 1HH2 ARG 101 -15.703 -34.330 1.325 3111 HH12 ARG 101 2HH2 ARG 101 -16.279 -35.829 0.797 3112 HH21 ARG 101 1HH1 ARG 101 -19.734 -35.296 1.736 3113 HH22 ARG 101 2HH1 ARG 101 -18.637 -36.535 1.472 3114 H GLY 102 H GLY 102 -17.115 -29.503 7.587 3115 HA2 GLY 102 2HA GLY 102 -17.411 -29.530 9.776 3116 HA3 GLY 102 1HA GLY 102 -18.642 -30.834 9.632 3117 H HIS 103 H HIS 103 -16.212 -32.145 7.837 3118 HA HIS 103 HA HIS 103 -14.500 -32.985 9.970 3119 HB2 HIS 103 2HB HIS 103 -16.753 -34.367 10.182 3120 HB3 HIS 103 1HB HIS 103 -16.317 -35.104 8.617 3121 HD1 HIS 103 1HD HIS 103 -13.401 -36.062 9.048 3122 HD2 HIS 103 2HD HIS 103 -16.258 -36.115 12.176 3123 HE1 HIS 103 1HE HIS 103 -12.690 -37.792 10.670 3124 HE2 HIS 103 2HE HIS 103 -14.382 -37.816 12.574
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