NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25444 | 2k8v | 15964 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1HT MET 1 -9.652 6.805 22.580 2 H2 MET 1 2HT MET 1 -10.416 7.732 21.354 3 H3 MET 1 3HT MET 1 -10.087 6.068 21.095 4 HA MET 1 HA MET 1 -12.413 6.603 21.598 5 HB2 MET 1 2HB MET 1 -10.754 4.757 23.310 6 HB3 MET 1 1HB MET 1 -12.510 4.761 23.375 7 HG2 MET 1 2HG MET 1 -11.305 4.532 20.695 8 HG3 MET 1 1HG MET 1 -11.086 3.158 21.776 9 HE1 MET 1 2HE MET 1 -14.583 5.034 19.876 10 HE2 MET 1 3HE MET 1 -13.926 3.731 18.884 11 HE3 MET 1 1HE MET 1 -12.868 5.020 19.461 12 H HIS 2 H HIS 2 -13.831 7.656 22.863 13 HA HIS 2 HA HIS 2 -12.801 8.865 25.343 14 HB2 HIS 2 2HB HIS 2 -14.721 9.843 23.262 15 HB3 HIS 2 1HB HIS 2 -14.846 10.447 24.911 16 HD1 HIS 2 1HD HIS 2 -13.438 12.419 25.424 17 HD2 HIS 2 2HD HIS 2 -11.999 10.296 22.155 18 HE1 HIS 2 1HE HIS 2 -11.504 13.766 24.546 19 HE2 HIS 2 2HE HIS 2 -10.704 12.504 22.517 20 H HIS 3 H HIS 3 -15.860 7.742 23.891 21 HA HIS 3 HA HIS 3 -16.499 6.263 26.288 22 HB2 HIS 3 2HB HIS 3 -17.480 8.916 25.973 23 HB3 HIS 3 1HB HIS 3 -18.838 7.818 25.758 24 HD1 HIS 3 1HD HIS 3 -16.515 9.160 28.315 25 HD2 HIS 3 2HD HIS 3 -19.478 6.258 28.048 26 HE1 HIS 3 1HE HIS 3 -17.065 8.540 30.689 27 HE2 HIS 3 2HE HIS 3 -18.920 6.846 30.503 28 H HIS 4 H HIS 4 -17.910 7.590 23.297 29 HA HIS 4 HA HIS 4 -19.617 5.327 22.905 30 HB2 HIS 4 2HB HIS 4 -18.873 7.698 21.205 31 HB3 HIS 4 1HB HIS 4 -19.882 6.398 20.579 32 HD1 HIS 4 1HD HIS 4 -22.064 5.905 22.264 33 HD2 HIS 4 2HD HIS 4 -20.327 9.679 22.320 34 HE1 HIS 4 1HE HIS 4 -23.800 7.430 23.257 35 HE2 HIS 4 2HE HIS 4 -22.694 9.691 23.361 36 H HIS 5 H HIS 5 -19.544 4.051 20.843 37 HA HIS 5 HA HIS 5 -16.759 3.370 20.158 38 HB2 HIS 5 2HB HIS 5 -18.466 1.735 21.497 39 HB3 HIS 5 1HB HIS 5 -18.806 1.265 19.835 40 HD1 HIS 5 1HD HIS 5 -16.327 0.910 18.448 41 HD2 HIS 5 2HD HIS 5 -16.528 0.183 22.534 42 HE1 HIS 5 1HE HIS 5 -14.373 -0.586 18.962 43 HE2 HIS 5 2HE HIS 5 -14.565 -1.082 21.424 44 H HIS 6 H HIS 6 -16.272 2.946 18.028 45 HA HIS 6 HA HIS 6 -18.438 3.389 16.081 46 HB2 HIS 6 2HB HIS 6 -15.841 4.747 16.386 47 HB3 HIS 6 1HB HIS 6 -16.213 4.237 14.743 48 HD1 HIS 6 1HD HIS 6 -17.047 6.771 17.278 49 HD2 HIS 6 2HD HIS 6 -18.588 5.440 13.656 50 HE1 HIS 6 1HE HIS 6 -18.660 8.553 16.537 51 HE2 HIS 6 2HE HIS 6 -19.515 7.766 14.302 52 H HIS 7 H HIS 7 -18.406 2.165 14.211 53 HA HIS 7 HA HIS 7 -16.365 0.043 14.095 54 HB2 HIS 7 2HB HIS 7 -19.226 -0.185 14.364 55 HB3 HIS 7 1HB HIS 7 -18.704 -0.931 12.857 56 HD1 HIS 7 1HD HIS 7 -18.521 -1.315 16.556 57 HD2 HIS 7 2HD HIS 7 -17.071 -3.208 13.153 58 HE1 HIS 7 1HE HIS 7 -17.628 -3.528 17.347 59 HE2 HIS 7 2HE HIS 7 -16.678 -4.619 15.285 60 H MET 8 H MET 8 -19.038 1.144 12.005 61 HA MET 8 HA MET 8 -17.124 1.886 9.937 62 HB2 MET 8 2HB MET 8 -18.401 0.556 8.230 63 HB3 MET 8 1HB MET 8 -17.468 -0.412 9.379 64 HG2 MET 8 2HG MET 8 -19.569 -0.733 10.685 65 HG3 MET 8 1HG MET 8 -20.440 0.063 9.377 66 HE1 MET 8 3HE MET 8 -19.804 -2.237 6.373 67 HE2 MET 8 1HE MET 8 -19.765 -0.566 6.934 68 HE3 MET 8 2HE MET 8 -21.254 -1.502 7.057 69 H SER 9 H SER 9 -18.105 3.088 8.173 70 HA SER 9 HA SER 9 -20.606 4.407 8.999 71 HB2 SER 9 2HB SER 9 -18.044 5.465 7.950 72 HB3 SER 9 1HB SER 9 -19.510 6.223 7.329 73 HG SER 9 HG SER 9 -20.130 6.618 9.493 74 H ASP 10 H ASP 10 -18.769 3.088 6.313 75 HA ASP 10 HA ASP 10 -19.297 2.674 4.128 76 HB2 ASP 10 2HB ASP 10 -21.353 1.344 3.851 77 HB3 ASP 10 1HB ASP 10 -20.428 0.834 5.259 78 H GLY 11 H GLY 11 -19.305 4.664 3.128 79 HA2 GLY 11 2HA GLY 11 -21.709 5.504 1.936 80 HA3 GLY 11 1HA GLY 11 -21.354 6.575 3.282 81 H HIS 12 H HIS 12 -19.014 7.398 3.288 82 HA HIS 12 HA HIS 12 -18.340 8.207 0.538 83 HB2 HIS 12 2HB HIS 12 -18.886 9.772 2.791 84 HB3 HIS 12 1HB HIS 12 -17.126 9.842 2.612 85 HD1 HIS 12 1HD HIS 12 -16.409 11.737 1.218 86 HD2 HIS 12 2HD HIS 12 -20.139 10.317 0.058 87 HE1 HIS 12 1HE HIS 12 -17.133 13.220 -0.680 88 HE2 HIS 12 2HE HIS 12 -19.437 12.406 -1.296 89 H ASN 13 H ASN 13 -16.432 7.612 -0.275 90 HA ASN 13 HA ASN 13 -14.051 7.408 1.238 91 HB2 ASN 13 2HB ASN 13 -15.684 4.961 0.919 92 HB3 ASN 13 1HB ASN 13 -13.969 4.788 0.562 93 HD21 ASN 13 1HD2 ASN 13 -15.774 3.861 2.794 94 HD22 ASN 13 2HD2 ASN 13 -14.936 4.320 4.234 95 H GLY 14 H GLY 14 -12.792 8.299 -0.273 96 HA2 GLY 14 2HA GLY 14 -13.104 7.507 -3.075 97 HA3 GLY 14 1HA GLY 14 -12.147 8.867 -2.474 98 H LEU 15 H LEU 15 -11.081 7.164 -4.363 99 HA LEU 15 HA LEU 15 -8.665 6.394 -3.147 100 HB2 LEU 15 2HB LEU 15 -8.859 3.921 -3.575 101 HB3 LEU 15 1HB LEU 15 -9.767 4.530 -2.207 102 HG LEU 15 HG LEU 15 -11.703 4.657 -4.038 103 HD11 LEU 15 1HD1 LEU 15 -9.834 3.629 -5.630 104 HD12 LEU 15 2HD1 LEU 15 -11.544 3.229 -5.792 105 HD13 LEU 15 3HD1 LEU 15 -10.459 2.127 -4.944 106 HD21 LEU 15 3HD2 LEU 15 -12.521 2.559 -3.185 107 HD22 LEU 15 1HD2 LEU 15 -11.719 3.439 -1.883 108 HD23 LEU 15 2HD2 LEU 15 -10.899 2.092 -2.673 109 H GLY 16 H GLY 16 -7.489 4.722 -4.726 110 HA2 GLY 16 2HA GLY 16 -6.800 5.973 -7.042 111 HA3 GLY 16 1HA GLY 16 -6.694 4.250 -6.815 112 H LYS 17 H LYS 17 -8.530 6.865 -8.146 113 HA LYS 17 HA LYS 17 -9.861 4.988 -9.947 114 HB2 LYS 17 2HB LYS 17 -11.198 6.915 -8.095 115 HB3 LYS 17 1HB LYS 17 -11.916 6.621 -9.672 116 HG2 LYS 17 2HG LYS 17 -11.847 4.162 -9.108 117 HG3 LYS 17 1HG LYS 17 -11.435 4.645 -7.462 118 HD2 LYS 17 2HD LYS 17 -13.756 6.026 -8.625 119 HD3 LYS 17 1HD LYS 17 -13.967 4.292 -8.369 120 HE2 LYS 17 2HE LYS 17 -13.952 4.491 -6.123 121 HE3 LYS 17 1HE LYS 17 -12.720 5.753 -6.142 122 HZ1 LYS 17 3HZ LYS 17 -14.566 7.243 -7.013 123 HZ2 LYS 17 1HZ LYS 17 -14.638 6.803 -5.382 124 HZ3 LYS 17 2HZ LYS 17 -15.638 6.036 -6.509 125 H GLY 18 H GLY 18 -7.718 7.232 -9.876 126 HA2 GLY 18 2HA GLY 18 -8.653 8.517 -12.352 127 HA3 GLY 18 1HA GLY 18 -7.998 9.512 -11.049 128 H PHE 19 H PHE 19 -6.491 6.483 -11.217 129 HA PHE 19 HA PHE 19 -4.277 7.635 -12.777 130 HB2 PHE 19 2HB PHE 19 -3.834 5.547 -10.666 131 HB3 PHE 19 1HB PHE 19 -2.693 6.726 -11.327 132 HD1 PHE 19 1HD PHE 19 -4.462 9.162 -11.062 133 HD2 PHE 19 2HD PHE 19 -3.571 5.988 -8.376 134 HE1 PHE 19 1HE PHE 19 -4.904 10.658 -9.156 135 HE2 PHE 19 2HE PHE 19 -4.011 7.473 -6.463 136 HZ PHE 19 HZ PHE 19 -4.678 9.812 -6.853 137 H GLY 20 H GLY 20 -5.143 4.412 -11.530 138 HA2 GLY 20 2HA GLY 20 -4.631 3.362 -14.245 139 HA3 GLY 20 1HA GLY 20 -4.363 2.453 -12.757 140 H ASP 21 H ASP 21 -6.372 2.180 -11.371 141 HA ASP 21 HA ASP 21 -8.969 2.392 -12.163 142 HB2 ASP 21 2HB ASP 21 -7.572 0.325 -13.704 143 HB3 ASP 21 1HB ASP 21 -9.020 -0.278 -12.885 144 H HIS 22 H HIS 22 -7.688 -0.826 -11.502 145 HA HIS 22 HA HIS 22 -8.500 -0.545 -8.684 146 HB2 HIS 22 2HB HIS 22 -8.977 -2.901 -10.525 147 HB3 HIS 22 1HB HIS 22 -9.242 -2.933 -8.785 148 HD1 HIS 22 1HD HIS 22 -11.031 -0.969 -7.967 149 HD2 HIS 22 2HD HIS 22 -11.191 -2.241 -11.921 150 HE1 HIS 22 1HE HIS 22 -13.303 -0.289 -8.800 151 HE2 HIS 22 2HE HIS 22 -13.359 -1.020 -11.211 152 H ILE 23 H ILE 23 -6.466 -0.364 -7.817 153 HA ILE 23 HA ILE 23 -4.776 -2.728 -7.993 154 HB ILE 23 HB ILE 23 -3.787 0.045 -8.647 155 HG12 ILE 23 2HG1 ILE 23 -3.033 -1.415 -10.739 156 HG13 ILE 23 1HG1 ILE 23 -4.433 -2.371 -10.264 157 HG21 ILE 23 1HG2 ILE 23 -1.635 -0.722 -8.641 158 HG22 ILE 23 2HG2 ILE 23 -2.111 -2.409 -8.780 159 HG23 ILE 23 3HG2 ILE 23 -2.316 -1.556 -7.251 160 HD11 ILE 23 3HD1 ILE 23 -4.333 0.071 -11.722 161 HD12 ILE 23 1HD1 ILE 23 -5.235 0.325 -10.228 162 HD13 ILE 23 2HD1 ILE 23 -5.725 -0.945 -11.348 163 H HIS 24 H HIS 24 -3.566 0.380 -6.839 164 HA HIS 24 HA HIS 24 -3.231 -0.770 -4.225 165 HB2 HIS 24 2HB HIS 24 -2.555 2.076 -4.576 166 HB3 HIS 24 1HB HIS 24 -1.633 0.792 -3.797 167 HD1 HIS 24 1HD HIS 24 -0.915 -1.057 -6.015 168 HD2 HIS 24 2HD HIS 24 -0.998 3.063 -6.515 169 HE1 HIS 24 1HE HIS 24 0.627 -0.580 -7.938 170 HE2 HIS 24 2HE HIS 24 0.580 1.920 -8.210 171 H TRP 25 H TRP 25 -5.888 -0.411 -4.924 172 HA TRP 25 HA TRP 25 -6.787 1.154 -2.686 173 HB2 TRP 25 2HB TRP 25 -8.441 2.227 -4.572 174 HB3 TRP 25 1HB TRP 25 -6.997 3.016 -3.928 175 HD1 TRP 25 HD TRP 25 -8.294 1.235 -7.022 176 HE1 TRP 25 1HE TRP 25 -6.637 1.615 -8.939 177 HE3 TRP 25 3HE TRP 25 -4.512 3.506 -4.476 178 HZ2 TRP 25 2HZ TRP 25 -4.099 2.730 -9.361 179 HZ3 TRP 25 3HZ TRP 25 -2.516 4.208 -5.694 180 HH2 TRP 25 HH TRP 25 -2.301 3.825 -8.096 181 H ARG 26 H ARG 26 -6.908 -1.569 -4.239 182 HA ARG 26 HA ARG 26 -9.463 -2.161 -5.013 183 HB2 ARG 26 2HB ARG 26 -7.215 -3.635 -4.654 184 HB3 ARG 26 1HB ARG 26 -8.183 -4.211 -3.293 185 HG2 ARG 26 2HG ARG 26 -8.493 -5.646 -5.208 186 HG3 ARG 26 1HG ARG 26 -9.993 -4.791 -4.844 187 HD2 ARG 26 2HD ARG 26 -8.742 -3.096 -6.607 188 HD3 ARG 26 1HD ARG 26 -8.302 -4.695 -7.223 189 HE ARG 26 HE ARG 26 -10.912 -3.479 -7.241 190 HH11 ARG 26 1HH1 ARG 26 -9.148 -6.488 -7.347 191 HH12 ARG 26 2HH1 ARG 26 -10.423 -7.352 -8.136 192 HH21 ARG 26 1HH2 ARG 26 -12.591 -4.614 -8.278 193 HH22 ARG 26 2HH2 ARG 26 -12.379 -6.288 -8.667 194 H THR 27 H THR 27 -8.194 -1.587 -1.830 195 HA THR 27 HA THR 27 -9.438 -0.831 -0.009 196 HB THR 27 HB THR 27 -11.784 -2.498 -0.902 197 HG1 THR 27 1HG THR 27 -12.553 -0.705 -1.959 198 HG21 THR 27 3HG2 THR 27 -13.067 -1.318 0.574 199 HG22 THR 27 1HG2 THR 27 -11.975 0.068 0.588 200 HG23 THR 27 2HG2 THR 27 -11.542 -1.406 1.455 201 H LEU 28 H LEU 28 -9.534 -1.698 2.017 202 HA LEU 28 HA LEU 28 -8.282 -4.195 2.399 203 HB2 LEU 28 2HB LEU 28 -8.459 -2.062 3.926 204 HB3 LEU 28 1HB LEU 28 -9.872 -2.897 4.572 205 HG LEU 28 HG LEU 28 -7.485 -4.592 4.425 206 HD11 LEU 28 1HD1 LEU 28 -6.806 -2.083 5.057 207 HD12 LEU 28 2HD1 LEU 28 -6.051 -3.500 5.787 208 HD13 LEU 28 3HD1 LEU 28 -7.335 -2.646 6.643 209 HD21 LEU 28 3HD2 LEU 28 -8.189 -5.168 6.685 210 HD22 LEU 28 1HD2 LEU 28 -9.555 -5.222 5.571 211 HD23 LEU 28 2HD2 LEU 28 -9.365 -3.853 6.668 212 H GLU 29 H GLU 29 -11.572 -3.346 1.932 213 HA GLU 29 HA GLU 29 -12.840 -5.406 3.365 214 HB2 GLU 29 2HB GLU 29 -13.654 -3.296 1.764 215 HB3 GLU 29 1HB GLU 29 -14.162 -4.714 0.856 216 HG2 GLU 29 2HG GLU 29 -14.799 -4.390 3.765 217 HG3 GLU 29 1HG GLU 29 -15.819 -3.703 2.501 218 H ASP 30 H ASP 30 -12.029 -5.218 -0.102 219 HA ASP 30 HA ASP 30 -12.510 -8.053 -0.431 220 HB2 ASP 30 2HB ASP 30 -12.376 -5.753 -2.150 221 HB3 ASP 30 1HB ASP 30 -11.269 -6.998 -2.748 222 H GLY 31 H GLY 31 -9.818 -5.897 0.004 223 HA2 GLY 31 2HA GLY 31 -7.788 -7.670 -0.934 224 HA3 GLY 31 1HA GLY 31 -7.545 -6.238 0.071 225 H LYS 32 H LYS 32 -9.087 -6.940 2.285 226 HA LYS 32 HA LYS 32 -7.265 -8.653 3.653 227 HB2 LYS 32 2HB LYS 32 -8.562 -6.680 4.621 228 HB3 LYS 32 1HB LYS 32 -9.950 -7.756 4.686 229 HG2 LYS 32 2HG LYS 32 -7.677 -9.033 5.876 230 HG3 LYS 32 1HG LYS 32 -7.921 -7.440 6.595 231 HD2 LYS 32 2HD LYS 32 -9.524 -8.333 7.855 232 HD3 LYS 32 1HD LYS 32 -10.476 -8.563 6.389 233 HE2 LYS 32 2HE LYS 32 -8.708 -10.684 6.352 234 HE3 LYS 32 1HE LYS 32 -9.117 -10.518 8.059 235 HZ1 LYS 32 3HZ LYS 32 -11.503 -10.494 7.315 236 HZ2 LYS 32 1HZ LYS 32 -10.697 -11.971 7.129 237 HZ3 LYS 32 2HZ LYS 32 -10.961 -10.977 5.787 238 H LYS 33 H LYS 33 -10.722 -8.963 2.831 239 HA LYS 33 HA LYS 33 -11.172 -11.488 3.873 240 HB2 LYS 33 2HB LYS 33 -13.015 -11.665 2.249 241 HB3 LYS 33 1HB LYS 33 -12.975 -10.091 3.034 242 HG2 LYS 33 2HG LYS 33 -13.235 -9.332 0.939 243 HG3 LYS 33 1HG LYS 33 -11.481 -9.574 0.850 244 HD2 LYS 33 2HD LYS 33 -11.917 -10.861 -0.927 245 HD3 LYS 33 1HD LYS 33 -12.478 -12.063 0.238 246 HE2 LYS 33 2HE LYS 33 -14.678 -10.475 -0.027 247 HE3 LYS 33 1HE LYS 33 -13.993 -10.408 -1.650 248 HZ1 LYS 33 3HZ LYS 33 -14.756 -12.848 -0.142 249 HZ2 LYS 33 1HZ LYS 33 -13.945 -12.865 -1.626 250 HZ3 LYS 33 2HZ LYS 33 -15.510 -12.232 -1.524 251 H GLU 34 H GLU 34 -9.537 -10.559 0.935 252 HA GLU 34 HA GLU 34 -9.371 -13.338 0.044 253 HB2 GLU 34 2HB GLU 34 -9.879 -11.387 -1.524 254 HB3 GLU 34 1HB GLU 34 -8.186 -10.933 -1.334 255 HG2 GLU 34 2HG GLU 34 -7.525 -12.454 -2.800 256 HG3 GLU 34 1HG GLU 34 -8.447 -13.731 -1.991 257 H ALA 35 H ALA 35 -7.442 -10.816 1.472 258 HA ALA 35 HA ALA 35 -4.892 -11.925 0.945 259 HB1 ALA 35 1HB ALA 35 -4.943 -9.649 1.533 260 HB2 ALA 35 2HB ALA 35 -4.187 -10.469 2.900 261 HB3 ALA 35 3HB ALA 35 -5.875 -9.965 2.996 262 H ALA 36 H ALA 36 -7.381 -12.897 3.044 263 HA ALA 36 HA ALA 36 -5.689 -14.099 5.042 264 HB1 ALA 36 1HB ALA 36 -7.756 -13.413 5.879 265 HB2 ALA 36 2HB ALA 36 -7.919 -15.163 5.736 266 HB3 ALA 36 3HB ALA 36 -8.643 -14.107 4.522 267 H ALA 37 H ALA 37 -7.748 -15.282 2.394 268 HA ALA 37 HA ALA 37 -7.090 -18.020 2.784 269 HB1 ALA 37 1HB ALA 37 -8.285 -16.566 0.432 270 HB2 ALA 37 2HB ALA 37 -9.138 -17.472 1.682 271 HB3 ALA 37 3HB ALA 37 -8.110 -18.320 0.525 272 H SER 38 H SER 38 -6.370 -16.082 -0.112 273 HA SER 38 HA SER 38 -4.319 -17.726 -1.041 274 HB2 SER 38 2HB SER 38 -5.628 -15.488 -1.979 275 HB3 SER 38 1HB SER 38 -3.974 -14.900 -1.740 276 HG SER 38 HG SER 38 -4.799 -17.137 -3.284 277 H GLY 39 H GLY 39 -4.245 -15.046 1.223 278 HA2 GLY 39 2HA GLY 39 -2.612 -14.502 2.770 279 HA3 GLY 39 1HA GLY 39 -1.654 -15.859 2.173 280 H LEU 40 H LEU 40 -2.668 -12.554 1.349 281 HA LEU 40 HA LEU 40 0.011 -12.120 0.230 282 HB2 LEU 40 2HB LEU 40 -0.933 -10.821 -1.621 283 HB3 LEU 40 1HB LEU 40 -1.462 -12.493 -1.664 284 HG LEU 40 HG LEU 40 -3.574 -11.603 -0.450 285 HD11 LEU 40 1HD1 LEU 40 -2.121 -9.195 -0.807 286 HD12 LEU 40 2HD1 LEU 40 -3.697 -9.436 -0.055 287 HD13 LEU 40 3HD1 LEU 40 -3.585 -9.123 -1.787 288 HD21 LEU 40 3HD2 LEU 40 -3.993 -10.553 -3.033 289 HD22 LEU 40 1HD2 LEU 40 -4.434 -12.146 -2.416 290 HD23 LEU 40 2HD2 LEU 40 -2.868 -11.904 -3.190 291 HA PRO 41 HA PRO 41 -0.211 -8.564 2.903 292 HB2 PRO 41 2HB PRO 41 1.997 -7.264 2.037 293 HB3 PRO 41 1HB PRO 41 2.089 -8.731 3.018 294 HG2 PRO 41 2HG PRO 41 2.374 -8.414 0.054 295 HG3 PRO 41 1HG PRO 41 3.345 -9.389 1.172 296 HD2 PRO 41 2HD PRO 41 1.381 -10.446 -0.376 297 HD3 PRO 41 1HD PRO 41 1.803 -11.097 1.219 298 H LEU 42 H LEU 42 -0.112 -6.081 2.659 299 HA LEU 42 HA LEU 42 -1.346 -5.386 0.093 300 HB2 LEU 42 2HB LEU 42 -2.181 -3.467 1.916 301 HB3 LEU 42 1HB LEU 42 -3.124 -4.780 1.250 302 HG LEU 42 HG LEU 42 -1.504 -5.090 3.765 303 HD11 LEU 42 1HD1 LEU 42 -3.467 -4.632 5.045 304 HD12 LEU 42 2HD1 LEU 42 -4.442 -4.453 3.585 305 HD13 LEU 42 3HD1 LEU 42 -3.197 -3.263 3.965 306 HD21 LEU 42 3HD2 LEU 42 -3.517 -6.712 2.279 307 HD22 LEU 42 1HD2 LEU 42 -3.433 -6.844 4.035 308 HD23 LEU 42 2HD2 LEU 42 -2.016 -7.214 3.054 309 H MET 43 H MET 43 -1.218 -3.148 -0.539 310 HA MET 43 HA MET 43 1.297 -1.857 0.319 311 HB2 MET 43 2HB MET 43 1.745 -2.813 -1.815 312 HB3 MET 43 1HB MET 43 0.194 -2.272 -2.463 313 HG2 MET 43 2HG MET 43 1.315 0.096 -1.811 314 HG3 MET 43 1HG MET 43 2.751 -0.844 -2.198 315 HE1 MET 43 3HE MET 43 2.879 -2.190 -4.861 316 HE2 MET 43 1HE MET 43 1.337 -2.265 -5.714 317 HE3 MET 43 2HE MET 43 1.466 -2.890 -4.072 318 H VAL 44 H VAL 44 -0.091 -0.609 1.767 319 HA VAL 44 HA VAL 44 -2.209 1.003 0.841 320 HB VAL 44 HB VAL 44 -0.494 1.331 3.298 321 HG11 VAL 44 1HG1 VAL 44 -2.637 2.976 2.202 322 HG12 VAL 44 2HG1 VAL 44 -1.478 3.333 3.481 323 HG13 VAL 44 3HG1 VAL 44 -2.951 2.437 3.851 324 HG21 VAL 44 3HG2 VAL 44 -1.886 -0.789 2.918 325 HG22 VAL 44 1HG2 VAL 44 -3.285 0.256 3.187 326 HG23 VAL 44 2HG2 VAL 44 -2.063 0.067 4.450 327 H ILE 45 H ILE 45 -1.784 2.375 -0.840 328 HA ILE 45 HA ILE 45 0.506 4.174 -0.645 329 HB ILE 45 HB ILE 45 0.017 3.079 -2.825 330 HG12 ILE 45 2HG1 ILE 45 -0.384 6.048 -3.081 331 HG13 ILE 45 1HG1 ILE 45 1.146 5.371 -2.505 332 HG21 ILE 45 1HG2 ILE 45 -1.858 3.643 -4.126 333 HG22 ILE 45 2HG2 ILE 45 -2.354 4.905 -3.001 334 HG23 ILE 45 3HG2 ILE 45 -2.476 3.206 -2.535 335 HD11 ILE 45 3HD1 ILE 45 1.645 5.502 -4.701 336 HD12 ILE 45 1HD1 ILE 45 -0.039 5.375 -5.209 337 HD13 ILE 45 2HD1 ILE 45 0.849 3.929 -4.730 338 H ILE 46 H ILE 46 0.267 6.087 0.319 339 HA ILE 46 HA ILE 46 -2.392 7.354 0.201 340 HB ILE 46 HB ILE 46 -0.442 7.599 2.486 341 HG12 ILE 46 2HG1 ILE 46 -3.034 6.099 2.618 342 HG13 ILE 46 1HG1 ILE 46 -1.595 5.302 2.005 343 HG21 ILE 46 1HG2 ILE 46 -2.047 8.859 3.585 344 HG22 ILE 46 2HG2 ILE 46 -3.354 8.274 2.557 345 HG23 ILE 46 3HG2 ILE 46 -2.186 9.427 1.922 346 HD11 ILE 46 3HD1 ILE 46 -1.678 6.670 4.672 347 HD12 ILE 46 1HD1 ILE 46 -0.479 5.530 4.065 348 HD13 ILE 46 2HD1 ILE 46 -2.109 4.976 4.447 349 H HIS 47 H HIS 47 -2.482 9.536 -0.199 350 HA HIS 47 HA HIS 47 0.070 10.945 -0.488 351 HB2 HIS 47 2HB HIS 47 -0.623 11.804 -2.716 352 HB3 HIS 47 1HB HIS 47 -0.268 10.072 -2.687 353 HD1 HIS 47 1HD HIS 47 -2.820 12.465 -3.667 354 HD2 HIS 47 2HD HIS 47 -2.724 8.444 -2.605 355 HE1 HIS 47 1HE HIS 47 -4.983 11.500 -4.505 356 HE2 HIS 47 2HE HIS 47 -4.842 9.042 -3.973 357 H LYS 48 H LYS 48 0.013 12.887 0.353 358 HA LYS 48 HA LYS 48 -2.590 14.295 0.417 359 HB2 LYS 48 2HB LYS 48 -1.010 13.415 2.645 360 HB3 LYS 48 1HB LYS 48 -1.122 15.168 2.658 361 HG2 LYS 48 2HG LYS 48 -2.954 14.544 3.903 362 HG3 LYS 48 1HG LYS 48 -3.652 14.764 2.298 363 HD2 LYS 48 2HD LYS 48 -4.408 12.676 2.365 364 HD3 LYS 48 1HD LYS 48 -2.746 12.093 2.442 365 HE2 LYS 48 2HE LYS 48 -2.827 12.415 4.916 366 HE3 LYS 48 1HE LYS 48 -4.541 12.798 4.759 367 HZ1 LYS 48 3HZ LYS 48 -5.062 10.655 4.562 368 HZ2 LYS 48 1HZ LYS 48 -3.503 10.320 5.129 369 HZ3 LYS 48 2HZ LYS 48 -3.813 10.342 3.466 370 H SER 49 H SER 49 -2.561 16.549 0.368 371 HA SER 49 HA SER 49 -1.921 18.567 -0.444 372 HB2 SER 49 2HB SER 49 -0.474 18.211 1.707 373 HB3 SER 49 1HB SER 49 0.860 18.096 0.560 374 HG SER 49 HG SER 49 0.374 20.255 1.389 375 H TRP 50 H TRP 50 -1.755 18.927 -2.533 376 HA TRP 50 HA TRP 50 -0.989 19.005 -4.668 377 HB2 TRP 50 2HB TRP 50 1.785 18.275 -3.814 378 HB3 TRP 50 1HB TRP 50 1.250 19.480 -4.993 379 HD1 TRP 50 HD TRP 50 2.253 19.093 -1.392 380 HE1 TRP 50 1HE TRP 50 2.135 21.376 -0.211 381 HE3 TRP 50 3HE TRP 50 -0.193 21.755 -5.009 382 HZ2 TRP 50 2HZ TRP 50 1.137 23.962 -0.739 383 HZ3 TRP 50 3HZ TRP 50 -0.692 24.127 -4.591 384 HH2 TRP 50 HH TRP 50 -0.041 25.208 -2.500 385 H CYS 51 H CYS 51 1.207 16.548 -3.332 386 HA CYS 51 HA CYS 51 1.573 14.380 -3.859 387 HB2 CYS 51 2HB CYS 51 -0.610 13.826 -3.192 388 HB3 CYS 51 1HB CYS 51 -1.340 14.647 -4.565 389 H GLY 52 H GLY 52 2.850 13.693 -5.452 390 HA2 GLY 52 2HA GLY 52 2.212 14.514 -8.220 391 HA3 GLY 52 1HA GLY 52 3.842 14.181 -7.631 392 H ALA 53 H ALA 53 2.672 11.852 -6.091 393 HA ALA 53 HA ALA 53 3.234 9.849 -8.004 394 HB1 ALA 53 1HB ALA 53 3.032 8.330 -6.276 395 HB2 ALA 53 2HB ALA 53 1.770 9.263 -5.471 396 HB3 ALA 53 3HB ALA 53 3.445 9.811 -5.410 397 H CYS 54 H CYS 54 0.436 11.625 -7.366 398 HA CYS 54 HA CYS 54 -1.291 9.524 -8.385 399 HB2 CYS 54 2HB CYS 54 -3.103 11.332 -7.982 400 HB3 CYS 54 1HB CYS 54 -2.348 10.566 -6.577 401 H LYS 55 H LYS 55 -0.042 12.693 -9.277 402 HA LYS 55 HA LYS 55 -1.638 12.875 -11.648 403 HB2 LYS 55 2HB LYS 55 0.036 14.729 -12.229 404 HB3 LYS 55 1HB LYS 55 -0.993 14.959 -10.824 405 HG2 LYS 55 2HG LYS 55 0.734 15.027 -9.423 406 HG3 LYS 55 1HG LYS 55 1.536 13.657 -10.208 407 HD2 LYS 55 2HD LYS 55 2.778 14.990 -11.552 408 HD3 LYS 55 1HD LYS 55 1.489 16.179 -11.740 409 HE2 LYS 55 2HE LYS 55 1.952 17.045 -9.505 410 HE3 LYS 55 1HE LYS 55 3.223 15.841 -9.296 411 HZ1 LYS 55 3HZ LYS 55 3.445 17.522 -11.655 412 HZ2 LYS 55 1HZ LYS 55 4.645 16.990 -10.585 413 HZ3 LYS 55 2HZ LYS 55 3.668 18.309 -10.174 414 H ALA 56 H ALA 56 1.687 11.816 -10.940 415 HA ALA 56 HA ALA 56 2.415 11.513 -13.684 416 HB1 ALA 56 1HB ALA 56 3.615 10.040 -11.348 417 HB2 ALA 56 2HB ALA 56 4.005 11.713 -11.743 418 HB3 ALA 56 3HB ALA 56 4.374 10.428 -12.891 419 H LEU 57 H LEU 57 0.991 9.377 -11.283 420 HA LEU 57 HA LEU 57 1.207 6.981 -12.738 421 HB2 LEU 57 2HB LEU 57 -0.673 7.891 -10.572 422 HB3 LEU 57 1HB LEU 57 -0.772 6.288 -11.266 423 HG LEU 57 HG LEU 57 0.630 6.872 -9.046 424 HD11 LEU 57 1HD1 LEU 57 0.080 4.658 -10.150 425 HD12 LEU 57 2HD1 LEU 57 1.550 4.744 -9.184 426 HD13 LEU 57 3HD1 LEU 57 1.649 4.798 -10.941 427 HD21 LEU 57 3HD2 LEU 57 2.629 7.036 -11.296 428 HD22 LEU 57 1HD2 LEU 57 3.026 6.856 -9.587 429 HD23 LEU 57 2HD2 LEU 57 2.225 8.320 -10.156 430 H LYS 58 H LYS 58 -1.232 9.542 -12.802 431 HA LYS 58 HA LYS 58 -3.285 8.257 -14.088 432 HB2 LYS 58 2HB LYS 58 -2.574 11.011 -15.007 433 HB3 LYS 58 1HB LYS 58 -4.150 10.315 -14.691 434 HG2 LYS 58 2HG LYS 58 -3.377 10.231 -12.239 435 HG3 LYS 58 1HG LYS 58 -2.144 11.380 -12.756 436 HD2 LYS 58 2HD LYS 58 -5.118 11.741 -13.108 437 HD3 LYS 58 1HD LYS 58 -4.144 12.486 -11.838 438 HE2 LYS 58 2HE LYS 58 -2.725 13.395 -13.808 439 HE3 LYS 58 1HE LYS 58 -4.142 13.018 -14.785 440 HZ1 LYS 58 3HZ LYS 58 -5.084 14.884 -14.102 441 HZ2 LYS 58 1HZ LYS 58 -3.700 15.270 -13.207 442 HZ3 LYS 58 2HZ LYS 58 -4.963 14.407 -12.484 443 HA PRO 59 HA PRO 59 -1.509 9.073 -18.478 444 HB2 PRO 59 2HB PRO 59 1.033 9.955 -18.736 445 HB3 PRO 59 1HB PRO 59 -0.352 11.050 -18.545 446 HG2 PRO 59 2HG PRO 59 1.586 10.070 -16.471 447 HG3 PRO 59 1HG PRO 59 0.996 11.714 -16.763 448 HD2 PRO 59 2HD PRO 59 -0.028 10.171 -14.813 449 HD3 PRO 59 1HD PRO 59 -1.027 11.321 -15.735 450 H LYS 60 H LYS 60 0.990 7.964 -16.184 451 HA LYS 60 HA LYS 60 1.824 5.946 -18.140 452 HB2 LYS 60 2HB LYS 60 3.718 5.533 -16.688 453 HB3 LYS 60 1HB LYS 60 3.570 7.258 -17.010 454 HG2 LYS 60 2HG LYS 60 2.097 7.030 -14.777 455 HG3 LYS 60 1HG LYS 60 3.297 5.776 -14.493 456 HD2 LYS 60 2HD LYS 60 3.830 8.684 -15.119 457 HD3 LYS 60 1HD LYS 60 4.081 7.881 -13.569 458 HE2 LYS 60 2HE LYS 60 6.156 7.419 -14.217 459 HE3 LYS 60 1HE LYS 60 5.491 6.363 -15.459 460 HZ1 LYS 60 3HZ LYS 60 6.584 7.746 -16.825 461 HZ2 LYS 60 1HZ LYS 60 6.642 9.010 -15.702 462 HZ3 LYS 60 2HZ LYS 60 5.243 8.755 -16.618 463 H PHE 61 H PHE 61 0.774 6.095 -14.720 464 HA PHE 61 HA PHE 61 0.665 3.305 -14.413 465 HB2 PHE 61 2HB PHE 61 0.692 4.946 -12.523 466 HB3 PHE 61 1HB PHE 61 -0.991 5.322 -12.901 467 HD1 PHE 61 2HD PHE 61 1.302 2.785 -11.600 468 HD2 PHE 61 1HD PHE 61 -2.754 3.782 -12.394 469 HE1 PHE 61 2HE PHE 61 0.570 0.890 -10.213 470 HE2 PHE 61 1HE PHE 61 -3.495 1.889 -11.010 471 HZ PHE 61 HZ PHE 61 -1.829 0.445 -9.919 472 H ALA 62 H ALA 62 -1.297 5.505 -16.137 473 HA ALA 62 HA ALA 62 -3.773 4.188 -16.064 474 HB1 ALA 62 1HB ALA 62 -4.029 6.119 -17.236 475 HB2 ALA 62 2HB ALA 62 -3.675 5.078 -18.617 476 HB3 ALA 62 3HB ALA 62 -2.395 6.056 -17.896 477 H GLU 63 H GLU 63 -0.711 3.406 -17.269 478 HA GLU 63 HA GLU 63 -1.332 1.445 -19.231 479 HB2 GLU 63 2HB GLU 63 0.835 2.773 -18.944 480 HB3 GLU 63 1HB GLU 63 1.193 1.703 -17.585 481 HG2 GLU 63 2HG GLU 63 2.317 0.625 -19.246 482 HG3 GLU 63 1HG GLU 63 0.752 -0.176 -19.379 483 H SER 64 H SER 64 -1.505 1.542 -15.875 484 HA SER 64 HA SER 64 -0.792 -1.011 -15.073 485 HB2 SER 64 2HB SER 64 -2.794 0.964 -14.045 486 HB3 SER 64 1HB SER 64 -2.534 -0.574 -13.243 487 HG SER 64 HG SER 64 -0.531 1.367 -13.766 488 H THR 65 H THR 65 -2.964 -0.428 -17.451 489 HA THR 65 HA THR 65 -5.268 -1.808 -16.902 490 HB THR 65 HB THR 65 -4.005 -2.506 -19.487 491 HG1 THR 65 1HG THR 65 -4.418 0.175 -18.685 492 HG21 THR 65 3HG2 THR 65 -6.404 -2.807 -19.091 493 HG22 THR 65 1HG2 THR 65 -6.070 -1.703 -20.424 494 HG23 THR 65 2HG2 THR 65 -6.565 -1.066 -18.855 495 H GLU 66 H GLU 66 -2.047 -3.013 -17.566 496 HA GLU 66 HA GLU 66 -2.855 -5.779 -17.446 497 HB2 GLU 66 2HB GLU 66 -0.610 -4.445 -18.434 498 HB3 GLU 66 1HB GLU 66 -0.013 -5.301 -17.010 499 HG2 GLU 66 2HG GLU 66 -1.500 -7.226 -18.220 500 HG3 GLU 66 1HG GLU 66 -0.883 -6.330 -19.609 501 H ILE 67 H ILE 67 -1.571 -3.297 -15.334 502 HA ILE 67 HA ILE 67 -0.911 -5.057 -13.189 503 HB ILE 67 HB ILE 67 -1.604 -2.120 -13.107 504 HG12 ILE 67 2HG1 ILE 67 1.052 -3.565 -13.246 505 HG13 ILE 67 1HG1 ILE 67 0.344 -2.531 -14.496 506 HG21 ILE 67 1HG2 ILE 67 -0.370 -2.153 -10.941 507 HG22 ILE 67 2HG2 ILE 67 -0.368 -3.914 -11.030 508 HG23 ILE 67 3HG2 ILE 67 -1.896 -3.040 -10.918 509 HD11 ILE 67 3HD1 ILE 67 0.416 -0.846 -12.363 510 HD12 ILE 67 1HD1 ILE 67 1.656 -0.954 -13.611 511 HD13 ILE 67 2HD1 ILE 67 1.856 -1.827 -12.092 512 H SER 68 H SER 68 -3.854 -4.005 -14.523 513 HA SER 68 HA SER 68 -5.467 -4.031 -12.179 514 HB2 SER 68 2HB SER 68 -5.942 -3.168 -14.653 515 HB3 SER 68 1HB SER 68 -6.615 -4.788 -14.831 516 HG SER 68 HG SER 68 -8.299 -3.699 -14.064 517 H GLU 69 H GLU 69 -4.239 -6.450 -14.352 518 HA GLU 69 HA GLU 69 -5.880 -8.525 -13.119 519 HB2 GLU 69 2HB GLU 69 -3.877 -8.895 -15.342 520 HB3 GLU 69 1HB GLU 69 -5.200 -9.963 -14.893 521 HG2 GLU 69 2HG GLU 69 -5.448 -7.230 -16.130 522 HG3 GLU 69 1HG GLU 69 -5.723 -8.777 -16.930 523 H LEU 70 H LEU 70 -2.600 -7.363 -13.324 524 HA LEU 70 HA LEU 70 -1.226 -9.559 -12.283 525 HB2 LEU 70 2HB LEU 70 -0.703 -6.786 -12.808 526 HB3 LEU 70 1HB LEU 70 -0.014 -7.222 -11.246 527 HG LEU 70 HG LEU 70 1.127 -9.147 -12.420 528 HD11 LEU 70 1HD1 LEU 70 0.524 -7.624 -14.936 529 HD12 LEU 70 2HD1 LEU 70 -0.464 -8.983 -14.396 530 HD13 LEU 70 3HD1 LEU 70 1.246 -9.225 -14.754 531 HD21 LEU 70 3HD2 LEU 70 2.926 -7.768 -13.266 532 HD22 LEU 70 1HD2 LEU 70 2.264 -7.042 -11.799 533 HD23 LEU 70 2HD2 LEU 70 1.846 -6.378 -13.380 534 H SER 71 H SER 71 -3.319 -7.260 -10.766 535 HA SER 71 HA SER 71 -2.569 -7.145 -8.163 536 HB2 SER 71 2HB SER 71 -5.078 -6.956 -9.589 537 HB3 SER 71 1HB SER 71 -5.297 -7.647 -7.980 538 HG SER 71 HG SER 71 -4.383 -5.113 -8.726 539 H HIS 72 H HIS 72 -3.429 -10.048 -9.792 540 HA HIS 72 HA HIS 72 -4.443 -11.610 -7.728 541 HB2 HIS 72 2HB HIS 72 -3.554 -13.547 -8.999 542 HB3 HIS 72 1HB HIS 72 -4.416 -12.397 -10.031 543 HD1 HIS 72 1HD HIS 72 -3.255 -12.425 -12.212 544 HD2 HIS 72 2HD HIS 72 -0.573 -12.430 -9.039 545 HE1 HIS 72 1HE HIS 72 -0.974 -12.281 -13.261 546 HE2 HIS 72 2HE HIS 72 0.628 -12.196 -11.318 547 H ASN 73 H ASN 73 -1.413 -10.159 -8.029 548 HA ASN 73 HA ASN 73 0.113 -12.096 -6.567 549 HB2 ASN 73 2HB ASN 73 1.605 -9.859 -6.339 550 HB3 ASN 73 1HB ASN 73 1.641 -10.911 -7.755 551 HD21 ASN 73 1HD2 ASN 73 1.773 -9.713 -9.518 552 HD22 ASN 73 2HD2 ASN 73 0.890 -8.241 -9.813 553 H PHE 74 H PHE 74 -1.725 -9.236 -5.773 554 HA PHE 74 HA PHE 74 -2.133 -9.920 -3.146 555 HB2 PHE 74 2HB PHE 74 -0.760 -8.354 -1.900 556 HB3 PHE 74 1HB PHE 74 0.236 -9.481 -2.817 557 HD1 PHE 74 1HD PHE 74 -0.336 -7.798 -5.485 558 HD2 PHE 74 2HD PHE 74 1.141 -6.915 -1.595 559 HE1 PHE 74 1HE PHE 74 0.962 -5.929 -6.406 560 HE2 PHE 74 2HE PHE 74 2.437 -5.040 -2.509 561 HZ PHE 74 HZ PHE 74 2.355 -4.552 -4.914 562 H VAL 75 H VAL 75 -2.372 -7.304 -1.960 563 HA VAL 75 HA VAL 75 -4.017 -5.824 -3.862 564 HB VAL 75 HB VAL 75 -5.587 -7.439 -2.926 565 HG11 VAL 75 1HG1 VAL 75 -5.498 -6.334 -0.202 566 HG12 VAL 75 2HG1 VAL 75 -4.119 -7.333 -0.657 567 HG13 VAL 75 3HG1 VAL 75 -5.754 -7.991 -0.751 568 HG21 VAL 75 3HG2 VAL 75 -6.198 -4.823 -1.594 569 HG22 VAL 75 1HG2 VAL 75 -7.299 -5.945 -2.393 570 HG23 VAL 75 2HG2 VAL 75 -6.179 -4.977 -3.350 571 H MET 76 H MET 76 -4.146 -3.619 -3.390 572 HA MET 76 HA MET 76 -2.893 -2.850 -0.861 573 HB2 MET 76 2HB MET 76 -2.469 -0.784 -2.719 574 HB3 MET 76 1HB MET 76 -1.302 -1.837 -1.965 575 HG2 MET 76 2HG MET 76 -2.761 -2.551 -4.485 576 HG3 MET 76 1HG MET 76 -1.189 -1.761 -4.449 577 HE1 MET 76 3HE MET 76 -1.883 -5.949 -4.948 578 HE2 MET 76 1HE MET 76 -1.163 -4.778 -6.054 579 HE3 MET 76 2HE MET 76 -2.766 -4.485 -5.379 580 H VAL 77 H VAL 77 -3.227 -0.325 -0.581 581 HA VAL 77 HA VAL 77 -6.028 0.350 -1.109 582 HB VAL 77 HB VAL 77 -4.801 -0.210 1.529 583 HG11 VAL 77 1HG1 VAL 77 -6.504 2.169 1.011 584 HG12 VAL 77 2HG1 VAL 77 -5.181 1.941 2.160 585 HG13 VAL 77 3HG1 VAL 77 -6.765 1.240 2.489 586 HG21 VAL 77 3HG2 VAL 77 -7.698 -0.310 0.817 587 HG22 VAL 77 1HG2 VAL 77 -6.790 -1.311 1.948 588 HG23 VAL 77 2HG2 VAL 77 -6.582 -1.538 0.210 589 H ASN 78 H ASN 78 -6.413 2.489 -1.373 590 HA ASN 78 HA ASN 78 -4.174 4.311 -0.859 591 HB2 ASN 78 2HB ASN 78 -4.219 4.356 -3.146 592 HB3 ASN 78 1HB ASN 78 -5.935 4.018 -3.232 593 HD21 ASN 78 1HD2 ASN 78 -3.865 6.483 -1.827 594 HD22 ASN 78 2HD2 ASN 78 -4.754 7.844 -2.437 595 H LEU 79 H LEU 79 -4.573 5.789 0.599 596 HA LEU 79 HA LEU 79 -7.340 6.760 0.879 597 HB2 LEU 79 2HB LEU 79 -7.305 6.666 3.173 598 HB3 LEU 79 1HB LEU 79 -6.396 5.230 2.752 599 HG LEU 79 HG LEU 79 -4.353 6.910 3.009 600 HD11 LEU 79 1HD1 LEU 79 -6.559 8.105 4.646 601 HD12 LEU 79 2HD1 LEU 79 -5.463 8.906 3.522 602 HD13 LEU 79 3HD1 LEU 79 -4.858 8.312 5.068 603 HD21 LEU 79 3HD2 LEU 79 -4.053 6.062 5.258 604 HD22 LEU 79 1HD2 LEU 79 -4.693 4.796 4.212 605 HD23 LEU 79 2HD2 LEU 79 -5.761 5.629 5.343 606 H GLU 80 H GLU 80 -7.531 8.910 1.847 607 HA GLU 80 HA GLU 80 -5.191 10.631 1.466 608 HB2 GLU 80 2HB GLU 80 -7.104 10.435 -0.478 609 HB3 GLU 80 1HB GLU 80 -7.720 11.781 0.488 610 HG2 GLU 80 2HG GLU 80 -5.251 12.642 0.286 611 HG3 GLU 80 1HG GLU 80 -5.224 11.574 -1.126 612 H ASP 81 H ASP 81 -6.319 13.065 1.905 613 HA ASP 81 HA ASP 81 -6.477 13.285 4.642 614 HB2 ASP 81 2HB ASP 81 -6.195 15.123 2.867 615 HB3 ASP 81 1HB ASP 81 -7.954 15.165 2.810 616 H GLU 82 H GLU 82 -8.990 12.415 2.407 617 HA GLU 82 HA GLU 82 -11.267 13.036 3.875 618 HB2 GLU 82 2HB GLU 82 -10.594 11.096 1.739 619 HB3 GLU 82 1HB GLU 82 -12.058 10.769 2.656 620 HG2 GLU 82 2HG GLU 82 -11.489 13.408 1.334 621 HG3 GLU 82 1HG GLU 82 -12.369 12.093 0.554 622 H GLU 83 H GLU 83 -9.167 10.198 4.059 623 HA GLU 83 HA GLU 83 -10.395 9.552 6.645 624 HB2 GLU 83 2HB GLU 83 -10.332 7.158 6.118 625 HB3 GLU 83 1HB GLU 83 -11.371 8.030 5.000 626 HG2 GLU 83 2HG GLU 83 -8.917 8.063 3.747 627 HG3 GLU 83 1HG GLU 83 -8.983 6.463 4.493 628 H GLU 84 H GLU 84 -8.112 10.989 6.479 629 HA GLU 84 HA GLU 84 -5.733 9.460 6.397 630 HB2 GLU 84 2HB GLU 84 -5.727 11.886 6.099 631 HB3 GLU 84 1HB GLU 84 -6.294 12.104 7.750 632 HG2 GLU 84 2HG GLU 84 -3.937 10.510 7.801 633 HG3 GLU 84 1HG GLU 84 -3.638 11.935 6.808 634 HA PRO 85 HA PRO 85 -6.471 7.340 10.318 635 HB2 PRO 85 2HB PRO 85 -3.708 6.394 9.814 636 HB3 PRO 85 1HB PRO 85 -5.185 5.461 10.123 637 HG2 PRO 85 2HG PRO 85 -4.093 5.569 7.681 638 HG3 PRO 85 1HG PRO 85 -5.858 5.542 7.911 639 HD2 PRO 85 2HD PRO 85 -4.058 7.845 7.256 640 HD3 PRO 85 1HD PRO 85 -5.688 7.470 6.645 641 H LYS 86 H LYS 86 -4.845 6.942 12.262 642 HA LYS 86 HA LYS 86 -3.365 9.448 12.719 643 HB2 LYS 86 2HB LYS 86 -5.337 8.020 14.470 644 HB3 LYS 86 1HB LYS 86 -4.044 8.976 15.205 645 HG2 LYS 86 2HG LYS 86 -4.923 10.954 14.510 646 HG3 LYS 86 1HG LYS 86 -5.657 10.253 13.067 647 HD2 LYS 86 2HD LYS 86 -7.589 10.398 14.191 648 HD3 LYS 86 1HD LYS 86 -7.013 8.994 15.091 649 HE2 LYS 86 2HE LYS 86 -6.619 10.193 16.959 650 HE3 LYS 86 1HE LYS 86 -6.027 11.589 16.059 651 HZ1 LYS 86 3HZ LYS 86 -8.496 11.878 15.437 652 HZ2 LYS 86 1HZ LYS 86 -7.984 12.353 16.977 653 HZ3 LYS 86 2HZ LYS 86 -8.798 10.884 16.772 654 H ASP 87 H ASP 87 -1.796 7.672 11.751 655 HA ASP 87 HA ASP 87 -0.011 6.995 13.848 656 HB2 ASP 87 2HB ASP 87 -1.987 5.042 13.265 657 HB3 ASP 87 1HB ASP 87 -0.452 4.439 12.624 658 H GLU 88 H GLU 88 1.543 5.080 12.689 659 HA GLU 88 HA GLU 88 2.942 6.528 10.717 660 HB2 GLU 88 2HB GLU 88 3.172 3.622 11.511 661 HB3 GLU 88 1HB GLU 88 4.331 4.486 10.510 662 HG2 GLU 88 2HG GLU 88 3.657 5.069 13.384 663 HG3 GLU 88 1HG GLU 88 5.140 4.336 12.772 664 H ASP 89 H ASP 89 0.220 4.516 10.460 665 HA ASP 89 HA ASP 89 0.492 3.148 8.117 666 HB2 ASP 89 2HB ASP 89 -1.866 4.511 9.368 667 HB3 ASP 89 1HB ASP 89 -2.028 3.697 7.805 668 H PHE 90 H PHE 90 0.527 6.582 8.430 669 HA PHE 90 HA PHE 90 0.110 6.858 5.532 670 HB2 PHE 90 2HB PHE 90 -0.175 9.320 6.049 671 HB3 PHE 90 1HB PHE 90 -1.444 8.251 6.662 672 HD1 PHE 90 2HD PHE 90 1.823 9.681 7.790 673 HD2 PHE 90 1HD PHE 90 -2.175 8.621 8.794 674 HE1 PHE 90 2HE PHE 90 2.151 10.598 10.050 675 HE2 PHE 90 1HE PHE 90 -1.856 9.540 11.052 676 HZ PHE 90 HZ PHE 90 0.309 10.530 11.684 677 H SER 91 H SER 91 2.382 7.284 8.107 678 HA SER 91 HA SER 91 4.535 7.639 6.249 679 HB2 SER 91 2HB SER 91 4.061 9.887 8.221 680 HB3 SER 91 1HB SER 91 5.319 9.793 6.979 681 HG SER 91 HG SER 91 3.711 9.948 5.406 682 HA PRO 92 HA PRO 92 5.956 5.627 10.047 683 HB2 PRO 92 2HB PRO 92 7.334 3.635 8.805 684 HB3 PRO 92 1HB PRO 92 5.588 3.582 9.098 685 HG2 PRO 92 2HG PRO 92 7.037 3.913 6.579 686 HG3 PRO 92 1HG PRO 92 5.343 3.484 6.849 687 HD2 PRO 92 2HD PRO 92 6.471 6.053 6.141 688 HD3 PRO 92 1HD PRO 92 4.765 5.588 6.267 689 H ASP 93 H ASP 93 8.371 5.083 7.505 690 HA ASP 93 HA ASP 93 10.381 6.312 9.218 691 HB2 ASP 93 2HB ASP 93 10.445 4.046 7.701 692 HB3 ASP 93 1HB ASP 93 11.232 5.204 6.618 693 H GLY 94 H GLY 94 8.916 8.326 8.501 694 HA2 GLY 94 2HA GLY 94 10.631 10.015 7.032 695 HA3 GLY 94 1HA GLY 94 9.298 9.507 5.992 696 H GLY 95 H GLY 95 9.357 12.084 6.287 697 HA2 GLY 95 2HA GLY 95 7.333 12.664 8.364 698 HA3 GLY 95 1HA GLY 95 8.624 13.799 7.961 699 H TYR 96 H TYR 96 7.772 12.394 5.110 700 HA TYR 96 HA TYR 96 6.651 14.680 4.000 701 HB2 TYR 96 2HB TYR 96 5.825 13.035 2.189 702 HB3 TYR 96 1HB TYR 96 7.563 13.174 2.468 703 HD1 TYR 96 2HD TYR 96 5.687 11.353 4.987 704 HD2 TYR 96 1HD TYR 96 7.737 10.999 1.275 705 HE1 TYR 96 2HE TYR 96 5.819 8.918 5.297 706 HE2 TYR 96 1HE TYR 96 7.862 8.568 1.568 707 HH TYR 96 HH TYR 96 7.171 7.037 4.533 708 H ILE 97 H ILE 97 4.351 14.105 2.639 709 HA ILE 97 HA ILE 97 2.358 13.198 4.539 710 HB ILE 97 HB ILE 97 1.077 15.357 4.307 711 HG12 ILE 97 2HG1 ILE 97 3.522 16.880 3.866 712 HG13 ILE 97 1HG1 ILE 97 3.063 15.913 2.462 713 HG21 ILE 97 1HG2 ILE 97 3.733 15.488 5.721 714 HG22 ILE 97 2HG2 ILE 97 2.273 14.723 6.349 715 HG23 ILE 97 3HG2 ILE 97 2.309 16.467 6.078 716 HD11 ILE 97 3HD1 ILE 97 1.008 16.994 2.251 717 HD12 ILE 97 1HD1 ILE 97 2.174 18.277 2.570 718 HD13 ILE 97 2HD1 ILE 97 1.119 17.705 3.865 719 HA PRO 98 HA PRO 98 2.129 10.933 3.655 720 HB2 PRO 98 2HB PRO 98 -0.558 10.281 2.374 721 HB3 PRO 98 1HB PRO 98 0.220 9.464 3.759 722 HG2 PRO 98 2HG PRO 98 -1.300 11.883 3.752 723 HG3 PRO 98 1HG PRO 98 -0.501 11.074 5.131 724 HD2 PRO 98 2HD PRO 98 0.463 13.357 4.404 725 HD3 PRO 98 1HD PRO 98 1.604 12.010 4.605 726 H ARG 99 H ARG 99 2.843 8.920 2.714 727 HA ARG 99 HA ARG 99 2.958 8.990 -0.229 728 HB2 ARG 99 2HB ARG 99 5.068 8.870 1.803 729 HB3 ARG 99 1HB ARG 99 5.260 7.710 0.487 730 HG2 ARG 99 2HG ARG 99 6.449 9.741 0.001 731 HG3 ARG 99 1HG ARG 99 5.114 9.549 -1.130 732 HD2 ARG 99 2HD ARG 99 3.787 11.112 0.291 733 HD3 ARG 99 1HD ARG 99 5.217 11.368 1.274 734 HE ARG 99 HE ARG 99 6.259 12.133 -0.918 735 HH11 ARG 99 1HH1 ARG 99 2.868 12.547 -0.155 736 HH12 ARG 99 2HH1 ARG 99 2.689 13.935 -1.170 737 HH21 ARG 99 1HH2 ARG 99 6.009 13.957 -2.246 738 HH22 ARG 99 2HH2 ARG 99 4.467 14.735 -2.354 739 H ILE 100 H ILE 100 4.274 6.649 -0.737 740 HA ILE 100 HA ILE 100 2.186 4.736 -0.340 741 HB ILE 100 HB ILE 100 3.814 5.102 -2.373 742 HG12 ILE 100 2HG1 ILE 100 1.847 3.550 -2.121 743 HG13 ILE 100 1HG1 ILE 100 3.090 3.023 -3.239 744 HG21 ILE 100 1HG2 ILE 100 5.783 4.027 -2.441 745 HG22 ILE 100 2HG2 ILE 100 5.218 2.686 -1.452 746 HG23 ILE 100 3HG2 ILE 100 5.707 4.197 -0.690 747 HD11 ILE 100 3HD1 ILE 100 3.266 1.117 -2.159 748 HD12 ILE 100 1HD1 ILE 100 1.999 1.641 -1.051 749 HD13 ILE 100 2HD1 ILE 100 3.688 1.973 -0.675 750 H LEU 101 H LEU 101 2.124 2.926 0.922 751 HA LEU 101 HA LEU 101 4.448 2.350 2.628 752 HB2 LEU 101 2HB LEU 101 1.643 2.946 3.493 753 HB3 LEU 101 1HB LEU 101 2.696 1.953 4.479 754 HG LEU 101 HG LEU 101 4.289 3.837 4.644 755 HD11 LEU 101 1HD1 LEU 101 2.468 4.945 2.657 756 HD12 LEU 101 2HD1 LEU 101 4.142 5.363 3.024 757 HD13 LEU 101 3HD1 LEU 101 2.832 6.053 3.979 758 HD21 LEU 101 3HD2 LEU 101 3.203 4.398 6.502 759 HD22 LEU 101 1HD2 LEU 101 1.798 3.523 5.895 760 HD23 LEU 101 2HD2 LEU 101 1.965 5.247 5.574 761 H PHE 102 H PHE 102 4.984 0.237 2.490 762 HA PHE 102 HA PHE 102 2.916 -1.666 1.678 763 HB2 PHE 102 2HB PHE 102 5.901 -1.763 1.913 764 HB3 PHE 102 1HB PHE 102 4.989 -3.267 1.918 765 HD1 PHE 102 2HD PHE 102 5.565 -0.171 -0.046 766 HD2 PHE 102 1HD PHE 102 4.294 -4.232 -0.081 767 HE1 PHE 102 2HE PHE 102 5.488 -0.122 -2.505 768 HE2 PHE 102 1HE PHE 102 4.219 -4.191 -2.539 769 HZ PHE 102 HZ PHE 102 4.814 -2.135 -3.755 770 H LEU 103 H LEU 103 2.185 -3.352 3.046 771 HA LEU 103 HA LEU 103 3.244 -3.388 5.763 772 HB2 LEU 103 2HB LEU 103 1.217 -2.907 6.828 773 HB3 LEU 103 1HB LEU 103 1.411 -1.685 5.591 774 HG LEU 103 HG LEU 103 -0.453 -4.044 5.526 775 HD11 LEU 103 1HD1 LEU 103 -0.910 -1.074 5.587 776 HD12 LEU 103 2HD1 LEU 103 -1.250 -2.222 6.881 777 HD13 LEU 103 3HD1 LEU 103 -2.165 -2.293 5.375 778 HD21 LEU 103 3HD2 LEU 103 0.034 -3.940 3.310 779 HD22 LEU 103 1HD2 LEU 103 0.544 -2.251 3.384 780 HD23 LEU 103 2HD2 LEU 103 -1.173 -2.658 3.385 781 H ASP 104 H ASP 104 2.036 -5.041 7.143 782 HA ASP 104 HA ASP 104 2.214 -7.556 5.791 783 HB2 ASP 104 2HB ASP 104 1.821 -6.647 8.601 784 HB3 ASP 104 1HB ASP 104 1.318 -8.294 8.191 785 HA PRO 105 HA PRO 105 -1.929 -8.396 4.579 786 HB2 PRO 105 2HB PRO 105 -1.616 -11.077 5.808 787 HB3 PRO 105 1HB PRO 105 -2.005 -10.636 4.135 788 HG2 PRO 105 2HG PRO 105 0.409 -11.584 4.823 789 HG3 PRO 105 1HG PRO 105 0.208 -10.354 3.555 790 HD2 PRO 105 2HD PRO 105 1.167 -10.054 6.364 791 HD3 PRO 105 1HD PRO 105 1.677 -9.196 4.898 792 H SER 106 H SER 106 -3.074 -7.075 5.973 793 HA SER 106 HA SER 106 -5.066 -7.976 7.496 794 HB2 SER 106 2HB SER 106 -2.544 -8.108 9.071 795 HB3 SER 106 1HB SER 106 -3.961 -7.442 9.899 796 HG SER 106 HG SER 106 -5.022 -9.342 9.616 797 H GLY 107 H GLY 107 -2.561 -5.616 7.141 798 HA2 GLY 107 2HA GLY 107 -3.223 -3.335 6.654 799 HA3 GLY 107 1HA GLY 107 -4.504 -3.515 7.859 800 H LYS 108 H LYS 108 -1.093 -4.474 8.107 801 HA LYS 108 HA LYS 108 -0.861 -2.579 10.364 802 HB2 LYS 108 2HB LYS 108 -0.512 -5.348 10.347 803 HB3 LYS 108 1HB LYS 108 1.120 -4.698 10.388 804 HG2 LYS 108 2HG LYS 108 -0.421 -3.220 12.243 805 HG3 LYS 108 1HG LYS 108 -0.768 -4.938 12.502 806 HD2 LYS 108 2HD LYS 108 1.633 -5.391 12.668 807 HD3 LYS 108 1HD LYS 108 1.978 -3.680 12.406 808 HE2 LYS 108 2HE LYS 108 2.003 -3.605 14.657 809 HE3 LYS 108 1HE LYS 108 0.252 -3.513 14.471 810 HZ1 LYS 108 3HZ LYS 108 0.319 -5.254 15.873 811 HZ2 LYS 108 1HZ LYS 108 1.901 -5.691 15.456 812 HZ3 LYS 108 2HZ LYS 108 0.607 -6.145 14.464 813 H VAL 109 H VAL 109 -0.172 -0.920 8.852 814 HA VAL 109 HA VAL 109 1.930 -1.021 7.091 815 HB VAL 109 HB VAL 109 0.748 1.142 8.757 816 HG11 VAL 109 1HG1 VAL 109 3.308 1.375 7.209 817 HG12 VAL 109 2HG1 VAL 109 3.012 1.777 8.899 818 HG13 VAL 109 3HG1 VAL 109 2.299 2.761 7.623 819 HG21 VAL 109 3HG2 VAL 109 -0.456 0.675 6.799 820 HG22 VAL 109 1HG2 VAL 109 1.009 0.543 5.826 821 HG23 VAL 109 2HG2 VAL 109 0.481 2.119 6.417 822 H HIS 110 H HIS 110 4.055 -0.973 7.146 823 HA HIS 110 HA HIS 110 5.482 -0.349 9.583 824 HB2 HIS 110 2HB HIS 110 4.969 -3.091 8.779 825 HB3 HIS 110 1HB HIS 110 6.696 -2.752 8.814 826 HD1 HIS 110 1HD HIS 110 7.667 -1.921 11.147 827 HD2 HIS 110 2HD HIS 110 3.785 -3.399 11.237 828 HE1 HIS 110 1HE HIS 110 7.175 -2.371 13.571 829 HE2 HIS 110 2HE HIS 110 4.850 -3.340 13.593 830 HA PRO 111 HA PRO 111 8.161 1.195 6.398 831 HB2 PRO 111 2HB PRO 111 10.345 1.741 7.919 832 HB3 PRO 111 1HB PRO 111 8.889 2.742 7.940 833 HG2 PRO 111 2HG PRO 111 9.756 0.620 9.862 834 HG3 PRO 111 1HG PRO 111 9.042 2.208 10.197 835 HD2 PRO 111 2HD PRO 111 7.604 -0.092 10.252 836 HD3 PRO 111 1HD PRO 111 6.901 1.471 9.775 837 H GLU 112 H GLU 112 7.965 -1.652 6.647 838 HA GLU 112 HA GLU 112 10.718 -2.617 6.637 839 HB2 GLU 112 2HB GLU 112 8.052 -3.819 6.953 840 HB3 GLU 112 1HB GLU 112 9.176 -4.785 6.006 841 HG2 GLU 112 2HG GLU 112 9.986 -3.663 8.656 842 HG3 GLU 112 1HG GLU 112 9.039 -5.147 8.551 843 H ILE 113 H ILE 113 8.104 -1.921 4.428 844 HA ILE 113 HA ILE 113 9.889 -2.670 2.216 845 HB ILE 113 HB ILE 113 6.938 -3.229 2.431 846 HG12 ILE 113 2HG1 ILE 113 8.381 -4.913 3.423 847 HG13 ILE 113 1HG1 ILE 113 7.663 -5.541 1.932 848 HG21 ILE 113 1HG2 ILE 113 7.406 -2.291 0.212 849 HG22 ILE 113 2HG2 ILE 113 7.004 -4.004 0.118 850 HG23 ILE 113 3HG2 ILE 113 8.683 -3.484 -0.017 851 HD11 ILE 113 3HD1 ILE 113 10.429 -5.229 2.652 852 HD12 ILE 113 1HD1 ILE 113 10.070 -4.380 1.149 853 HD13 ILE 113 2HD1 ILE 113 9.708 -6.100 1.299 854 H ILE 114 H ILE 114 10.426 -1.012 1.075 855 HA ILE 114 HA ILE 114 8.542 1.222 0.682 856 HB ILE 114 HB ILE 114 10.293 2.796 0.789 857 HG12 ILE 114 2HG1 ILE 114 11.969 1.459 -0.495 858 HG13 ILE 114 1HG1 ILE 114 12.655 2.265 0.903 859 HG21 ILE 114 1HG2 ILE 114 9.584 1.392 2.954 860 HG22 ILE 114 2HG2 ILE 114 10.697 2.760 3.004 861 HG23 ILE 114 3HG2 ILE 114 11.325 1.114 2.979 862 HD11 ILE 114 3HD1 ILE 114 12.424 -0.580 0.297 863 HD12 ILE 114 1HD1 ILE 114 11.996 -0.148 1.952 864 HD13 ILE 114 2HD1 ILE 114 13.583 0.280 1.311 865 H ASN 115 H ASN 115 10.030 2.644 -1.158 866 HA ASN 115 HA ASN 115 9.920 0.867 -3.489 867 HB2 ASN 115 2HB ASN 115 8.470 2.748 -3.749 868 HB3 ASN 115 1HB ASN 115 9.723 3.865 -3.194 869 HD21 ASN 115 1HD2 ASN 115 9.216 5.023 -5.156 870 HD22 ASN 115 2HD2 ASN 115 9.962 4.532 -6.654 871 H GLU 116 H GLU 116 11.983 -0.058 -3.181 872 HA GLU 116 HA GLU 116 14.368 1.266 -2.723 873 HB2 GLU 116 2HB GLU 116 13.636 -1.307 -4.041 874 HB3 GLU 116 1HB GLU 116 15.294 -0.721 -4.222 875 HG2 GLU 116 2HG GLU 116 13.937 -1.029 -1.559 876 HG3 GLU 116 1HG GLU 116 14.873 -2.312 -2.319 877 H ASN 117 H ASN 117 12.452 1.160 -5.602 878 HA ASN 117 HA ASN 117 14.596 2.111 -7.304 879 HB2 ASN 117 2HB ASN 117 12.214 0.737 -7.758 880 HB3 ASN 117 1HB ASN 117 11.918 2.350 -8.423 881 HD21 ASN 117 1HD2 ASN 117 12.597 2.730 -10.402 882 HD22 ASN 117 2HD2 ASN 117 13.766 1.782 -11.279 883 H GLY 118 H GLY 118 12.729 3.545 -4.997 884 HA2 GLY 118 2HA GLY 118 12.012 5.962 -6.385 885 HA3 GLY 118 1HA GLY 118 11.936 5.687 -4.642 886 H ASN 119 H ASN 119 12.739 7.934 -4.599 887 HA ASN 119 HA ASN 119 15.405 8.491 -5.473 888 HB2 ASN 119 2HB ASN 119 13.308 9.943 -3.920 889 HB3 ASN 119 1HB ASN 119 14.982 10.502 -3.791 890 HD21 ASN 119 1HD2 ASN 119 12.803 11.944 -4.899 891 HD22 ASN 119 2HD2 ASN 119 13.166 12.226 -6.580 892 HA PRO 120 HA PRO 120 17.609 7.214 -1.854 893 HB2 PRO 120 2HB PRO 120 19.768 8.777 -1.915 894 HB3 PRO 120 1HB PRO 120 19.434 7.632 -3.231 895 HG2 PRO 120 2HG PRO 120 18.997 10.591 -3.129 896 HG3 PRO 120 1HG PRO 120 19.592 9.585 -4.470 897 HD2 PRO 120 2HD PRO 120 16.976 10.492 -4.170 898 HD3 PRO 120 1HD PRO 120 17.480 9.125 -5.190 899 H SER 121 H SER 121 15.523 9.324 -1.370 900 HA SER 121 HA SER 121 16.203 9.939 1.308 901 HB2 SER 121 2HB SER 121 16.936 11.903 -0.719 902 HB3 SER 121 1HB SER 121 15.787 12.568 0.454 903 HG SER 121 HG SER 121 18.318 12.378 0.804 904 H TYR 122 H TYR 122 14.129 8.688 -0.154 905 HA TYR 122 HA TYR 122 11.864 10.031 0.983 906 HB2 TYR 122 2HB TYR 122 12.553 10.412 -1.803 907 HB3 TYR 122 1HB TYR 122 10.972 9.640 -1.641 908 HD1 TYR 122 2HD TYR 122 9.416 10.798 0.211 909 HD2 TYR 122 1HD TYR 122 12.630 12.703 -1.824 910 HE1 TYR 122 2HE TYR 122 8.414 12.991 0.693 911 HE2 TYR 122 1HE TYR 122 11.639 14.901 -1.346 912 HH TYR 122 HH TYR 122 8.909 15.609 -0.792 913 H LYS 123 H LYS 123 12.978 7.522 -1.249 914 HA LYS 123 HA LYS 123 12.341 5.359 -1.578 915 HB2 LYS 123 2HB LYS 123 12.126 5.781 1.366 916 HB3 LYS 123 1HB LYS 123 11.526 4.271 0.696 917 HG2 LYS 123 2HG LYS 123 14.326 5.360 0.488 918 HG3 LYS 123 1HG LYS 123 13.783 3.960 1.432 919 HD2 LYS 123 2HD LYS 123 14.298 2.703 -0.336 920 HD3 LYS 123 1HD LYS 123 12.914 3.434 -1.158 921 HE2 LYS 123 2HE LYS 123 14.470 4.021 -2.675 922 HE3 LYS 123 1HE LYS 123 14.767 5.348 -1.553 923 HZ1 LYS 123 3HZ LYS 123 16.732 3.916 -2.394 924 HZ2 LYS 123 1HZ LYS 123 16.216 2.808 -1.223 925 HZ3 LYS 123 2HZ LYS 123 16.677 4.369 -0.766 926 H TYR 124 H TYR 124 9.951 5.656 0.957 927 HA TYR 124 HA TYR 124 7.864 4.473 -0.270 928 HB2 TYR 124 2HB TYR 124 7.613 6.873 1.542 929 HB3 TYR 124 1HB TYR 124 6.379 5.646 1.258 930 HD1 TYR 124 2HD TYR 124 6.675 3.368 2.181 931 HD2 TYR 124 1HD TYR 124 9.433 6.491 3.031 932 HE1 TYR 124 2HE TYR 124 7.566 2.061 4.063 933 HE2 TYR 124 1HE TYR 124 10.332 5.194 4.912 934 HH TYR 124 HH TYR 124 10.447 2.675 5.520 935 H PHE 125 H PHE 125 8.973 7.730 -0.906 936 HA PHE 125 HA PHE 125 6.670 8.746 -2.132 937 HB2 PHE 125 2HB PHE 125 8.693 10.091 -1.524 938 HB3 PHE 125 1HB PHE 125 9.520 9.382 -2.918 939 HD1 PHE 125 2HD PHE 125 6.083 10.746 -2.429 940 HD2 PHE 125 1HD PHE 125 9.759 10.969 -4.562 941 HE1 PHE 125 2HE PHE 125 5.129 12.488 -3.881 942 HE2 PHE 125 1HE PHE 125 8.812 12.712 -6.019 943 HZ PHE 125 HZ PHE 125 6.492 13.471 -5.680 944 H TYR 126 H TYR 126 5.722 8.387 -4.029 945 HA TYR 126 HA TYR 126 7.169 6.744 -5.995 946 HB2 TYR 126 2HB TYR 126 4.476 6.479 -4.830 947 HB3 TYR 126 1HB TYR 126 4.540 6.290 -6.586 948 HD1 TYR 126 1HD TYR 126 7.243 4.996 -6.821 949 HD2 TYR 126 2HD TYR 126 4.027 4.304 -4.137 950 HE1 TYR 126 1HE TYR 126 7.981 2.667 -6.550 951 HE2 TYR 126 2HE TYR 126 4.755 1.972 -3.848 952 HH TYR 126 HH TYR 126 6.109 0.281 -5.262 953 H VAL 127 H VAL 127 6.920 7.215 -8.159 954 HA VAL 127 HA VAL 127 5.205 9.314 -9.092 955 HB VAL 127 HB VAL 127 7.192 10.654 -10.013 956 HG11 VAL 127 1HG1 VAL 127 6.924 12.181 -8.345 957 HG12 VAL 127 2HG1 VAL 127 7.108 10.981 -7.065 958 HG13 VAL 127 3HG1 VAL 127 5.587 11.102 -7.949 959 HG21 VAL 127 3HG2 VAL 127 9.270 10.089 -9.463 960 HG22 VAL 127 1HG2 VAL 127 8.629 8.652 -8.665 961 HG23 VAL 127 2HG2 VAL 127 8.874 10.136 -7.746 962 H SER 128 H SER 128 5.088 6.866 -9.936 963 HA SER 128 HA SER 128 5.221 6.761 -12.604 964 HB2 SER 128 2HB SER 128 7.518 7.169 -12.871 965 HB3 SER 128 1HB SER 128 7.951 6.142 -11.495 966 HG SER 128 HG SER 128 8.357 4.793 -13.087 967 H ALA 129 H ALA 129 4.474 4.849 -13.387 968 HA ALA 129 HA ALA 129 3.704 2.850 -11.476 969 HB1 ALA 129 1HB ALA 129 2.309 2.013 -13.110 970 HB2 ALA 129 2HB ALA 129 3.389 2.484 -14.423 971 HB3 ALA 129 3HB ALA 129 2.430 3.706 -13.587 972 H GLU 130 H GLU 130 6.292 3.299 -13.714 973 HA GLU 130 HA GLU 130 7.019 0.668 -14.272 974 HB2 GLU 130 2HB GLU 130 8.004 3.107 -14.947 975 HB3 GLU 130 1HB GLU 130 9.243 2.557 -13.812 976 HG2 GLU 130 2HG GLU 130 8.750 0.369 -15.472 977 HG3 GLU 130 1HG GLU 130 8.765 1.779 -16.545 978 H GLN 131 H GLN 131 7.894 2.736 -11.514 979 HA GLN 131 HA GLN 131 9.538 0.688 -10.378 980 HB2 GLN 131 2HB GLN 131 9.444 2.133 -8.323 981 HB3 GLN 131 1HB GLN 131 10.249 2.794 -9.737 982 HG2 GLN 131 2HG GLN 131 7.555 3.583 -9.906 983 HG3 GLN 131 1HG GLN 131 8.054 3.850 -8.238 984 HE21 GLN 131 1HE2 GLN 131 8.456 5.940 -8.051 985 HE22 GLN 131 2HE2 GLN 131 9.451 6.876 -9.109 986 H VAL 132 H VAL 132 6.379 2.105 -9.463 987 HA VAL 132 HA VAL 132 5.899 0.476 -7.282 988 HB VAL 132 HB VAL 132 3.627 1.045 -7.410 989 HG11 VAL 132 1HG1 VAL 132 4.026 3.522 -8.599 990 HG12 VAL 132 2HG1 VAL 132 5.610 3.045 -7.989 991 HG13 VAL 132 3HG1 VAL 132 4.228 3.110 -6.897 992 HG21 VAL 132 3HG2 VAL 132 2.819 0.421 -9.462 993 HG22 VAL 132 1HG2 VAL 132 4.095 1.267 -10.338 994 HG23 VAL 132 2HG2 VAL 132 2.784 2.181 -9.593 995 H VAL 133 H VAL 133 5.909 -0.320 -10.639 996 HA VAL 133 HA VAL 133 4.348 -2.722 -10.290 997 HB VAL 133 HB VAL 133 4.320 -1.464 -12.446 998 HG11 VAL 133 1HG1 VAL 133 7.185 -2.115 -12.337 999 HG12 VAL 133 2HG1 VAL 133 6.351 -0.784 -13.132 1000 HG13 VAL 133 3HG1 VAL 133 6.407 -2.370 -13.897 1001 HG21 VAL 133 3HG2 VAL 133 4.249 -3.424 -13.829 1002 HG22 VAL 133 1HG2 VAL 133 3.651 -3.845 -12.225 1003 HG23 VAL 133 2HG2 VAL 133 5.283 -4.307 -12.707 1004 H GLN 134 H GLN 134 7.769 -1.806 -10.315 1005 HA GLN 134 HA GLN 134 8.609 -4.585 -10.507 1006 HB2 GLN 134 2HB GLN 134 10.858 -3.558 -9.695 1007 HB3 GLN 134 1HB GLN 134 10.286 -3.190 -11.316 1008 HG2 GLN 134 2HG GLN 134 9.429 -1.061 -10.540 1009 HG3 GLN 134 1HG GLN 134 9.974 -1.426 -8.904 1010 HE21 GLN 134 1HE2 GLN 134 12.426 -2.416 -9.217 1011 HE22 GLN 134 2HE2 GLN 134 13.484 -1.248 -9.966 1012 H GLY 135 H GLY 135 7.956 -2.225 -8.031 1013 HA2 GLY 135 2HA GLY 135 8.919 -3.844 -5.855 1014 HA3 GLY 135 1HA GLY 135 7.910 -2.394 -5.724 1015 H MET 136 H MET 136 6.124 -3.682 -7.820 1016 HA MET 136 HA MET 136 4.312 -4.968 -5.981 1017 HB2 MET 136 2HB MET 136 4.223 -3.829 -8.682 1018 HB3 MET 136 1HB MET 136 3.272 -5.297 -8.523 1019 HG2 MET 136 2HG MET 136 2.002 -4.322 -6.724 1020 HG3 MET 136 1HG MET 136 3.004 -2.874 -6.764 1021 HE1 MET 136 3HE MET 136 -0.586 -2.992 -7.416 1022 HE2 MET 136 1HE MET 136 0.086 -4.610 -7.618 1023 HE3 MET 136 2HE MET 136 -0.703 -3.808 -8.975 1024 H LYS 137 H LYS 137 6.031 -5.799 -8.940 1025 HA LYS 137 HA LYS 137 5.315 -8.541 -8.947 1026 HB2 LYS 137 2HB LYS 137 6.682 -8.719 -10.866 1027 HB3 LYS 137 1HB LYS 137 5.958 -7.124 -10.933 1028 HG2 LYS 137 2HG LYS 137 8.181 -6.393 -9.779 1029 HG3 LYS 137 1HG LYS 137 8.786 -7.908 -10.452 1030 HD2 LYS 137 2HD LYS 137 7.638 -5.542 -11.920 1031 HD3 LYS 137 1HD LYS 137 9.254 -6.231 -12.062 1032 HE2 LYS 137 2HE LYS 137 6.728 -7.689 -12.829 1033 HE3 LYS 137 1HE LYS 137 7.706 -6.761 -13.960 1034 HZ1 LYS 137 3HZ LYS 137 8.904 -8.913 -12.333 1035 HZ2 LYS 137 1HZ LYS 137 9.462 -8.247 -13.786 1036 HZ3 LYS 137 2HZ LYS 137 8.109 -9.264 -13.784 1037 H GLU 138 H GLU 138 7.594 -6.827 -7.121 1038 HA GLU 138 HA GLU 138 9.349 -9.140 -6.793 1039 HB2 GLU 138 2HB GLU 138 9.566 -6.232 -6.212 1040 HB3 GLU 138 1HB GLU 138 10.464 -7.337 -5.173 1041 HG2 GLU 138 2HG GLU 138 10.811 -7.995 -7.965 1042 HG3 GLU 138 1HG GLU 138 11.263 -6.318 -7.625 1043 H ALA 139 H ALA 139 8.134 -6.744 -4.488 1044 HA ALA 139 HA ALA 139 8.280 -8.264 -2.211 1045 HB1 ALA 139 1HB ALA 139 7.457 -5.753 -2.751 1046 HB2 ALA 139 2HB ALA 139 7.248 -6.544 -1.188 1047 HB3 ALA 139 3HB ALA 139 5.918 -6.513 -2.345 1048 H GLN 140 H GLN 140 5.940 -8.497 -4.766 1049 HA GLN 140 HA GLN 140 3.878 -9.760 -3.361 1050 HB2 GLN 140 2HB GLN 140 3.110 -10.512 -5.563 1051 HB3 GLN 140 1HB GLN 140 3.523 -8.800 -5.552 1052 HG2 GLN 140 2HG GLN 140 4.405 -9.600 -7.549 1053 HG3 GLN 140 1HG GLN 140 5.789 -9.529 -6.460 1054 HE21 GLN 140 1HE2 GLN 140 3.186 -11.882 -7.011 1055 HE22 GLN 140 2HE2 GLN 140 4.229 -13.237 -7.250 1056 H GLU 141 H GLU 141 6.969 -10.904 -4.220 1057 HA GLU 141 HA GLU 141 6.099 -13.703 -4.031 1058 HB2 GLU 141 2HB GLU 141 7.373 -13.745 -5.906 1059 HB3 GLU 141 1HB GLU 141 8.283 -12.304 -5.444 1060 HG2 GLU 141 2HG GLU 141 9.624 -13.659 -3.908 1061 HG3 GLU 141 1HG GLU 141 8.724 -15.096 -4.396 1062 H ARG 142 H ARG 142 8.137 -11.293 -2.524 1063 HA ARG 142 HA ARG 142 9.125 -13.273 -0.608 1064 HB2 ARG 142 2HB ARG 142 10.494 -11.225 0.194 1065 HB3 ARG 142 1HB ARG 142 10.927 -12.002 -1.333 1066 HG2 ARG 142 2HG ARG 142 9.771 -10.270 -2.573 1067 HG3 ARG 142 1HG ARG 142 9.238 -9.517 -1.060 1068 HD2 ARG 142 2HD ARG 142 11.148 -8.329 -1.966 1069 HD3 ARG 142 1HD ARG 142 11.582 -9.132 -0.447 1070 HE ARG 142 HE ARG 142 12.189 -10.744 -2.721 1071 HH11 ARG 142 1HH1 ARG 142 13.324 -8.043 -0.828 1072 HH12 ARG 142 2HH1 ARG 142 14.986 -8.284 -1.249 1073 HH21 ARG 142 1HH2 ARG 142 14.375 -11.065 -3.278 1074 HH22 ARG 142 2HH2 ARG 142 15.584 -9.999 -2.640 1075 H LEU 143 H LEU 143 7.432 -10.155 -0.668 1076 HA LEU 143 HA LEU 143 7.065 -9.936 2.103 1077 HB2 LEU 143 2HB LEU 143 6.782 -8.181 0.247 1078 HB3 LEU 143 1HB LEU 143 5.157 -8.841 0.057 1079 HG LEU 143 HG LEU 143 4.571 -8.210 2.296 1080 HD11 LEU 143 1HD1 LEU 143 7.492 -7.816 2.577 1081 HD12 LEU 143 2HD1 LEU 143 6.315 -8.448 3.728 1082 HD13 LEU 143 3HD1 LEU 143 6.438 -6.709 3.455 1083 HD21 LEU 143 3HD2 LEU 143 5.846 -6.137 0.568 1084 HD22 LEU 143 1HD2 LEU 143 5.174 -5.680 2.134 1085 HD23 LEU 143 2HD2 LEU 143 4.139 -6.418 0.911 1086 H THR 144 H THR 144 5.509 -11.927 -0.231 1087 HA THR 144 HA THR 144 3.177 -12.360 1.470 1088 HB THR 144 HB THR 144 2.898 -12.123 -0.989 1089 HG1 THR 144 1HG THR 144 1.490 -13.446 0.395 1090 HG21 THR 144 3HG2 THR 144 4.277 -14.792 -1.140 1091 HG22 THR 144 1HG2 THR 144 4.913 -13.264 -1.752 1092 HG23 THR 144 2HG2 THR 144 3.457 -13.960 -2.463 1093 H GLY 145 H GLY 145 2.973 -14.030 2.817 1094 HA2 GLY 145 2HA GLY 145 3.265 -16.143 3.716 1095 HA3 GLY 145 1HA GLY 145 4.282 -16.548 2.343 1096 H ASP 146 H ASP 146 4.975 -13.712 4.225 1097 HA ASP 146 HA ASP 146 6.784 -13.127 5.480 1098 HB2 ASP 146 2HB ASP 146 5.975 -15.796 6.506 1099 HB3 ASP 146 1HB ASP 146 7.549 -15.192 7.016 1100 H ALA 147 H ALA 147 7.276 -14.180 2.831 1101 HA ALA 147 HA ALA 147 9.769 -15.671 3.105 1102 HB1 ALA 147 1HB ALA 147 9.702 -15.862 0.674 1103 HB2 ALA 147 2HB ALA 147 8.291 -14.804 0.623 1104 HB3 ALA 147 3HB ALA 147 8.180 -16.385 1.394 1105 H PHE 148 H PHE 148 9.280 -12.702 3.774 1106 HA PHE 148 HA PHE 148 11.397 -11.570 2.075 1107 HB2 PHE 148 2HB PHE 148 10.538 -9.369 2.674 1108 HB3 PHE 148 1HB PHE 148 9.232 -10.368 2.022 1109 HD1 PHE 148 2HD PHE 148 7.611 -11.426 3.620 1110 HD2 PHE 148 1HD PHE 148 10.400 -8.442 4.817 1111 HE1 PHE 148 2HE PHE 148 6.268 -10.985 5.635 1112 HE2 PHE 148 1HE PHE 148 9.061 -7.994 6.834 1113 HZ PHE 148 HZ PHE 148 6.993 -9.266 7.243 1114 H ARG 149 H ARG 149 10.454 -12.336 5.330 1115 HA ARG 149 HA ARG 149 12.429 -10.793 6.661 1116 HB2 ARG 149 2HB ARG 149 10.792 -13.182 7.507 1117 HB3 ARG 149 1HB ARG 149 11.869 -12.316 8.586 1118 HG2 ARG 149 2HG ARG 149 10.506 -10.233 7.888 1119 HG3 ARG 149 1HG ARG 149 9.306 -11.413 7.358 1120 HD2 ARG 149 2HD ARG 149 9.827 -12.394 9.788 1121 HD3 ARG 149 1HD ARG 149 10.200 -10.697 10.089 1122 HE ARG 149 HE ARG 149 7.794 -10.590 8.863 1123 HH11 ARG 149 1HH1 ARG 149 8.992 -12.382 11.606 1124 HH12 ARG 149 2HH1 ARG 149 7.457 -12.428 12.405 1125 HH21 ARG 149 1HH2 ARG 149 5.773 -10.648 9.913 1126 HH22 ARG 149 2HH2 ARG 149 5.629 -11.444 11.444 1127 H LYS 150 H LYS 150 14.075 -11.604 4.944 1128 HA LYS 150 HA LYS 150 15.993 -12.729 4.487 1129 HB2 LYS 150 2HB LYS 150 15.715 -13.086 7.444 1130 HB3 LYS 150 1HB LYS 150 17.003 -13.925 6.590 1131 HG2 LYS 150 2HG LYS 150 16.949 -11.184 5.775 1132 HG3 LYS 150 1HG LYS 150 16.985 -11.280 7.536 1133 HD2 LYS 150 2HD LYS 150 19.219 -11.414 7.165 1134 HD3 LYS 150 1HD LYS 150 18.838 -13.125 6.972 1135 HE2 LYS 150 2HE LYS 150 18.631 -11.381 4.578 1136 HE3 LYS 150 1HE LYS 150 20.245 -11.771 5.170 1137 HZ1 LYS 150 3HZ LYS 150 19.897 -14.039 4.828 1138 HZ2 LYS 150 1HZ LYS 150 19.233 -13.313 3.451 1139 HZ3 LYS 150 2HZ LYS 150 18.220 -13.870 4.686 1140 H LYS 151 H LYS 151 15.003 -15.060 6.939 1141 HA LYS 151 HA LYS 151 13.927 -16.924 5.046 1142 HB2 LYS 151 2HB LYS 151 16.768 -17.013 5.732 1143 HB3 LYS 151 1HB LYS 151 15.939 -18.528 6.057 1144 HG2 LYS 151 2HG LYS 151 15.261 -18.742 3.793 1145 HG3 LYS 151 1HG LYS 151 15.773 -17.095 3.419 1146 HD2 LYS 151 2HD LYS 151 18.087 -17.693 3.754 1147 HD3 LYS 151 1HD LYS 151 17.627 -19.308 4.298 1148 HE2 LYS 151 2HE LYS 151 16.648 -18.478 1.635 1149 HE3 LYS 151 1HE LYS 151 18.383 -18.754 1.783 1150 HZ1 LYS 151 3HZ LYS 151 17.511 -20.920 2.984 1151 HZ2 LYS 151 1HZ LYS 151 17.712 -20.849 1.305 1152 HZ3 LYS 151 2HZ LYS 151 16.174 -20.654 1.983 1153 H HIS 152 H HIS 152 15.813 -17.501 8.000 1154 HA HIS 152 HA HIS 152 13.322 -18.370 9.316 1155 HB2 HIS 152 2HB HIS 152 16.106 -19.520 9.583 1156 HB3 HIS 152 1HB HIS 152 14.741 -19.980 10.595 1157 HD1 HIS 152 1HD HIS 152 16.459 -20.953 7.603 1158 HD2 HIS 152 2HD HIS 152 12.518 -21.071 8.914 1159 HE1 HIS 152 1HE HIS 152 15.311 -22.641 6.133 1160 HE2 HIS 152 2HE HIS 152 12.908 -22.632 6.890 1161 H LEU 153 H LEU 153 13.877 -18.589 11.837 1162 HA LEU 153 HA LEU 153 15.023 -15.990 12.626 1163 HB2 LEU 153 2HB LEU 153 13.506 -16.166 14.615 1164 HB3 LEU 153 1HB LEU 153 12.696 -15.947 13.075 1165 HG LEU 153 HG LEU 153 13.040 -18.735 14.044 1166 HD11 LEU 153 1HD1 LEU 153 10.682 -18.181 15.181 1167 HD12 LEU 153 2HD1 LEU 153 11.506 -16.647 15.461 1168 HD13 LEU 153 3HD1 LEU 153 12.209 -18.147 16.063 1169 HD21 LEU 153 3HD2 LEU 153 11.185 -19.158 12.756 1170 HD22 LEU 153 1HD2 LEU 153 11.905 -17.813 11.871 1171 HD23 LEU 153 2HD2 LEU 153 10.542 -17.528 12.954 1172 H GLU 154 H GLU 154 14.791 -19.413 13.391 1173 HA GLU 154 HA GLU 154 17.345 -19.378 14.675 1174 HB2 GLU 154 2HB GLU 154 14.894 -19.271 16.301 1175 HB3 GLU 154 1HB GLU 154 16.013 -20.550 16.754 1176 HG2 GLU 154 2HG GLU 154 17.463 -19.118 17.656 1177 HG3 GLU 154 1HG GLU 154 17.313 -17.980 16.320 1178 H ASP 155 H ASP 155 17.738 -21.643 15.726 1179 HA ASP 155 HA ASP 155 16.232 -23.867 14.924 1180 HB2 ASP 155 2HB ASP 155 17.445 -22.772 12.737 1181 HB3 ASP 155 1HB ASP 155 18.657 -23.943 13.250 1182 H GLU 156 H GLU 156 19.713 -23.071 14.923 1183 HA GLU 156 HA GLU 156 21.460 -23.889 16.127 1184 HB2 GLU 156 2HB GLU 156 19.202 -23.819 18.002 1185 HB3 GLU 156 1HB GLU 156 20.470 -24.966 18.455 1186 HG2 GLU 156 2HG GLU 156 20.991 -22.079 17.792 1187 HG3 GLU 156 1HG GLU 156 20.694 -22.674 19.425 1188 H LEU 157 H LEU 157 22.401 -25.623 15.272 1189 HA LEU 157 HA LEU 157 21.690 -28.251 16.143 1190 HB2 LEU 157 2HB LEU 157 20.276 -27.388 13.959 1191 HB3 LEU 157 1HB LEU 157 21.632 -28.210 13.210 1192 HG LEU 157 HG LEU 157 19.790 -29.747 13.432 1193 HD11 LEU 157 1HD1 LEU 157 21.698 -30.990 13.630 1194 HD12 LEU 157 2HD1 LEU 157 20.920 -31.366 15.167 1195 HD13 LEU 157 3HD1 LEU 157 22.214 -30.169 15.102 1196 HD21 LEU 157 3HD2 LEU 157 19.897 -29.457 16.415 1197 HD22 LEU 157 1HD2 LEU 157 18.657 -30.217 15.419 1198 HD23 LEU 157 2HD2 LEU 157 18.826 -28.462 15.430 Start of MODEL 2 1 H1 MET 1 1HT MET 1 -7.105 -6.796 -27.760 2 H2 MET 1 2HT MET 1 -8.700 -6.740 -27.126 3 H3 MET 1 3HT MET 1 -7.402 -6.039 -26.249 4 HA MET 1 HA MET 1 -8.898 -4.493 -27.469 5 HB2 MET 1 2HB MET 1 -6.954 -3.121 -28.174 6 HB3 MET 1 1HB MET 1 -6.739 -3.840 -26.583 7 HG2 MET 1 2HG MET 1 -5.342 -5.590 -27.574 8 HG3 MET 1 1HG MET 1 -5.541 -4.841 -29.157 9 HE1 MET 1 2HE MET 1 -3.359 -3.367 -25.503 10 HE2 MET 1 3HE MET 1 -2.655 -4.784 -26.282 11 HE3 MET 1 1HE MET 1 -4.335 -4.816 -25.742 12 H HIS 2 H HIS 2 -9.890 -4.056 -29.335 13 HA HIS 2 HA HIS 2 -8.985 -5.480 -31.743 14 HB2 HIS 2 2HB HIS 2 -11.655 -4.666 -30.710 15 HB3 HIS 2 1HB HIS 2 -11.429 -4.659 -32.455 16 HD1 HIS 2 1HD HIS 2 -10.140 -7.108 -33.220 17 HD2 HIS 2 2HD HIS 2 -12.657 -7.032 -29.914 18 HE1 HIS 2 1HE HIS 2 -10.844 -9.495 -32.857 19 HE2 HIS 2 2HE HIS 2 -12.298 -9.436 -30.798 20 H HIS 3 H HIS 3 -10.425 -2.368 -30.766 21 HA HIS 3 HA HIS 3 -9.256 -1.144 -33.164 22 HB2 HIS 3 2HB HIS 3 -11.761 -0.835 -31.841 23 HB3 HIS 3 1HB HIS 3 -10.903 0.698 -31.736 24 HD1 HIS 3 1HD HIS 3 -12.754 -1.465 -34.070 25 HD2 HIS 3 2HD HIS 3 -10.270 1.859 -34.286 26 HE1 HIS 3 1HE HIS 3 -13.083 -0.531 -36.382 27 HE2 HIS 3 2HE HIS 3 -11.513 1.436 -36.516 28 H HIS 4 H HIS 4 -9.711 -0.448 -29.697 29 HA HIS 4 HA HIS 4 -7.031 0.693 -29.609 30 HB2 HIS 4 2HB HIS 4 -7.823 2.727 -28.447 31 HB3 HIS 4 1HB HIS 4 -8.429 2.626 -30.097 32 HD1 HIS 4 1HD HIS 4 -10.970 2.240 -30.406 33 HD2 HIS 4 2HD HIS 4 -9.766 2.571 -26.444 34 HE1 HIS 4 1HE HIS 4 -13.088 2.546 -29.085 35 HE2 HIS 4 2HE HIS 4 -12.327 2.836 -26.699 36 H HIS 5 H HIS 5 -9.988 -0.003 -27.766 37 HA HIS 5 HA HIS 5 -8.559 -1.577 -25.863 38 HB2 HIS 5 2HB HIS 5 -8.393 1.077 -25.307 39 HB3 HIS 5 1HB HIS 5 -9.873 0.660 -24.450 40 HD1 HIS 5 1HD HIS 5 -6.188 -0.054 -24.486 41 HD2 HIS 5 2HD HIS 5 -9.530 -0.869 -22.157 42 HE1 HIS 5 1HE HIS 5 -5.295 -1.037 -22.350 43 HE2 HIS 5 2HE HIS 5 -7.340 -1.600 -20.991 44 H HIS 6 H HIS 6 -11.501 0.408 -26.195 45 HA HIS 6 HA HIS 6 -13.167 -1.935 -26.095 46 HB2 HIS 6 2HB HIS 6 -12.671 -0.380 -23.687 47 HB3 HIS 6 1HB HIS 6 -14.382 -0.415 -24.100 48 HD1 HIS 6 1HD HIS 6 -11.826 -2.334 -22.418 49 HD2 HIS 6 2HD HIS 6 -15.360 -3.190 -24.432 50 HE1 HIS 6 1HE HIS 6 -12.461 -4.660 -21.703 51 HE2 HIS 6 2HE HIS 6 -14.558 -5.188 -22.998 52 H HIS 7 H HIS 7 -15.324 -1.525 -26.711 53 HA HIS 7 HA HIS 7 -15.691 1.102 -27.978 54 HB2 HIS 7 2HB HIS 7 -17.411 -0.093 -29.375 55 HB3 HIS 7 1HB HIS 7 -15.757 -0.656 -29.601 56 HD1 HIS 7 1HD HIS 7 -19.117 -1.795 -28.680 57 HD2 HIS 7 2HD HIS 7 -15.223 -3.202 -28.329 58 HE1 HIS 7 1HE HIS 7 -19.333 -4.244 -28.154 59 HE2 HIS 7 2HE HIS 7 -16.965 -5.057 -27.864 60 H MET 8 H MET 8 -17.107 -1.203 -25.770 61 HA MET 8 HA MET 8 -19.592 0.250 -25.530 62 HB2 MET 8 2HB MET 8 -18.425 -2.174 -24.187 63 HB3 MET 8 1HB MET 8 -19.882 -1.402 -23.550 64 HG2 MET 8 2HG MET 8 -20.952 -1.710 -25.758 65 HG3 MET 8 1HG MET 8 -19.518 -2.584 -26.296 66 HE1 MET 8 3HE MET 8 -19.113 -5.387 -25.445 67 HE2 MET 8 1HE MET 8 -19.438 -5.509 -23.714 68 HE3 MET 8 2HE MET 8 -18.481 -4.165 -24.340 69 H SER 9 H SER 9 -19.883 1.973 -24.292 70 HA SER 9 HA SER 9 -19.616 3.554 -22.682 71 HB2 SER 9 2HB SER 9 -18.901 1.018 -21.313 72 HB3 SER 9 1HB SER 9 -18.419 2.511 -20.507 73 HG SER 9 HG SER 9 -20.543 3.151 -20.445 74 H ASP 10 H ASP 10 -17.826 4.490 -21.095 75 HA ASP 10 HA ASP 10 -15.239 4.361 -22.500 76 HB2 ASP 10 2HB ASP 10 -16.885 6.506 -22.647 77 HB3 ASP 10 1HB ASP 10 -15.961 6.924 -21.208 78 H GLY 11 H GLY 11 -16.885 5.225 -19.473 79 HA2 GLY 11 2HA GLY 11 -15.839 3.951 -17.531 80 HA3 GLY 11 1HA GLY 11 -14.351 4.731 -18.045 81 H HIS 12 H HIS 12 -15.626 4.928 -15.471 82 HA HIS 12 HA HIS 12 -16.043 7.837 -15.416 83 HB2 HIS 12 2HB HIS 12 -17.809 5.695 -14.373 84 HB3 HIS 12 1HB HIS 12 -17.563 7.092 -13.315 85 HD1 HIS 12 1HD HIS 12 -19.166 6.055 -16.519 86 HD2 HIS 12 2HD HIS 12 -18.667 9.505 -14.257 87 HE1 HIS 12 1HE HIS 12 -20.765 7.734 -17.493 88 HE2 HIS 12 2HE HIS 12 -20.382 9.840 -16.164 89 H ASN 13 H ASN 13 -15.591 5.039 -13.247 90 HA ASN 13 HA ASN 13 -13.137 6.011 -12.211 91 HB2 ASN 13 2HB ASN 13 -15.642 6.723 -10.788 92 HB3 ASN 13 1HB ASN 13 -14.311 6.139 -9.794 93 HD21 ASN 13 1HD2 ASN 13 -15.690 8.838 -10.490 94 HD22 ASN 13 2HD2 ASN 13 -14.347 9.909 -10.666 95 H GLY 14 H GLY 14 -12.026 4.375 -11.294 96 HA2 GLY 14 2HA GLY 14 -13.366 1.795 -11.118 97 HA3 GLY 14 1HA GLY 14 -11.626 2.083 -11.030 98 H LEU 15 H LEU 15 -11.192 0.956 -9.189 99 HA LEU 15 HA LEU 15 -12.705 1.607 -6.769 100 HB2 LEU 15 2HB LEU 15 -11.323 -0.739 -7.759 101 HB3 LEU 15 1HB LEU 15 -10.801 -0.333 -6.133 102 HG LEU 15 HG LEU 15 -13.281 -0.265 -5.521 103 HD11 LEU 15 1HD1 LEU 15 -13.865 -0.265 -8.054 104 HD12 LEU 15 2HD1 LEU 15 -14.873 -1.167 -6.923 105 HD13 LEU 15 3HD1 LEU 15 -13.679 -2.012 -7.908 106 HD21 LEU 15 3HD2 LEU 15 -11.642 -2.661 -6.151 107 HD22 LEU 15 1HD2 LEU 15 -13.330 -2.903 -5.701 108 HD23 LEU 15 2HD2 LEU 15 -12.236 -2.068 -4.599 109 H GLY 16 H GLY 16 -9.682 2.219 -8.295 110 HA2 GLY 16 2HA GLY 16 -8.393 2.968 -5.782 111 HA3 GLY 16 1HA GLY 16 -7.639 2.956 -7.377 112 H LYS 17 H LYS 17 -10.715 4.458 -7.193 113 HA LYS 17 HA LYS 17 -11.402 6.599 -7.493 114 HB2 LYS 17 2HB LYS 17 -9.254 6.845 -5.427 115 HB3 LYS 17 1HB LYS 17 -10.029 8.295 -6.051 116 HG2 LYS 17 2HG LYS 17 -12.165 7.576 -5.281 117 HG3 LYS 17 1HG LYS 17 -11.539 5.980 -4.863 118 HD2 LYS 17 2HD LYS 17 -10.303 6.825 -3.048 119 HD3 LYS 17 1HD LYS 17 -10.462 8.490 -3.609 120 HE2 LYS 17 2HE LYS 17 -12.477 8.749 -2.650 121 HE3 LYS 17 1HE LYS 17 -13.010 7.132 -3.108 122 HZ1 LYS 17 3HZ LYS 17 -12.864 7.330 -0.721 123 HZ2 LYS 17 1HZ LYS 17 -11.244 7.808 -0.817 124 HZ3 LYS 17 2HZ LYS 17 -11.692 6.241 -1.268 125 H GLY 18 H GLY 18 -9.608 5.666 -9.519 126 HA2 GLY 18 2HA GLY 18 -9.072 7.048 -11.437 127 HA3 GLY 18 1HA GLY 18 -8.476 8.277 -10.317 128 H PHE 19 H PHE 19 -7.119 6.084 -8.742 129 HA PHE 19 HA PHE 19 -4.552 6.368 -9.632 130 HB2 PHE 19 2HB PHE 19 -5.701 5.099 -7.536 131 HB3 PHE 19 1HB PHE 19 -5.159 3.711 -8.486 132 HD1 PHE 19 2HD PHE 19 -2.675 4.753 -9.653 133 HD2 PHE 19 1HD PHE 19 -4.261 5.163 -5.734 134 HE1 PHE 19 2HE PHE 19 -0.395 5.041 -8.765 135 HE2 PHE 19 1HE PHE 19 -1.991 5.456 -4.834 136 HZ PHE 19 HZ PHE 19 -0.052 5.392 -6.353 137 H GLY 20 H GLY 20 -6.353 3.342 -10.056 138 HA2 GLY 20 2HA GLY 20 -5.355 3.101 -12.797 139 HA3 GLY 20 1HA GLY 20 -4.861 1.852 -11.650 140 H ASP 21 H ASP 21 -7.309 1.847 -10.172 141 HA ASP 21 HA ASP 21 -9.529 1.235 -10.229 142 HB2 ASP 21 2HB ASP 21 -9.201 0.585 -13.169 143 HB3 ASP 21 1HB ASP 21 -10.713 0.670 -12.258 144 H HIS 22 H HIS 22 -8.790 -1.097 -12.734 145 HA HIS 22 HA HIS 22 -9.381 -3.258 -11.050 146 HB2 HIS 22 2HB HIS 22 -8.197 -4.592 -12.953 147 HB3 HIS 22 1HB HIS 22 -9.699 -3.746 -13.292 148 HD1 HIS 22 1HD HIS 22 -9.380 -3.167 -15.705 149 HD2 HIS 22 2HD HIS 22 -6.123 -2.071 -13.368 150 HE1 HIS 22 1HE HIS 22 -7.890 -1.823 -17.217 151 HE2 HIS 22 2HE HIS 22 -5.968 -1.098 -15.759 152 H ILE 23 H ILE 23 -8.128 -3.190 -9.186 153 HA ILE 23 HA ILE 23 -5.508 -4.380 -9.483 154 HB ILE 23 HB ILE 23 -5.871 -1.622 -8.369 155 HG12 ILE 23 2HG1 ILE 23 -3.414 -1.800 -9.578 156 HG13 ILE 23 1HG1 ILE 23 -4.370 -2.944 -10.516 157 HG21 ILE 23 1HG2 ILE 23 -3.974 -3.703 -7.410 158 HG22 ILE 23 2HG2 ILE 23 -4.787 -2.418 -6.518 159 HG23 ILE 23 3HG2 ILE 23 -3.406 -2.038 -7.546 160 HD11 ILE 23 3HD1 ILE 23 -4.225 -0.452 -11.229 161 HD12 ILE 23 1HD1 ILE 23 -5.449 -0.221 -9.982 162 HD13 ILE 23 2HD1 ILE 23 -5.762 -1.311 -11.331 163 H HIS 24 H HIS 24 -6.699 -6.107 -8.579 164 HA HIS 24 HA HIS 24 -7.984 -7.113 -6.829 165 HB2 HIS 24 2HB HIS 24 -5.069 -7.176 -6.729 166 HB3 HIS 24 1HB HIS 24 -5.815 -7.566 -5.177 167 HD1 HIS 24 1HD HIS 24 -6.222 -9.978 -4.904 168 HD2 HIS 24 2HD HIS 24 -6.449 -8.829 -8.891 169 HE1 HIS 24 1HE HIS 24 -6.685 -12.089 -6.188 170 HE2 HIS 24 2HE HIS 24 -6.738 -11.382 -8.605 171 H TRP 25 H TRP 25 -5.815 -4.605 -5.581 172 HA TRP 25 HA TRP 25 -5.992 -4.186 -3.127 173 HB2 TRP 25 2HB TRP 25 -6.779 -1.780 -3.308 174 HB3 TRP 25 1HB TRP 25 -5.406 -2.246 -4.284 175 HD1 TRP 25 HD TRP 25 -9.089 -2.618 -5.528 176 HE1 TRP 25 1HE TRP 25 -9.375 -1.077 -7.528 177 HE3 TRP 25 3HE TRP 25 -4.554 -0.256 -5.406 178 HZ2 TRP 25 2HZ TRP 25 -7.923 0.881 -8.873 179 HZ3 TRP 25 3HZ TRP 25 -4.093 1.453 -7.103 180 HH2 TRP 25 HH TRP 25 -5.747 2.009 -8.807 181 H ARG 26 H ARG 26 -8.922 -3.694 -4.901 182 HA ARG 26 HA ARG 26 -11.113 -3.706 -4.203 183 HB2 ARG 26 2HB ARG 26 -9.829 -5.678 -2.334 184 HB3 ARG 26 1HB ARG 26 -11.540 -5.274 -2.174 185 HG2 ARG 26 2HG ARG 26 -11.138 -5.826 -4.891 186 HG3 ARG 26 1HG ARG 26 -10.244 -7.063 -4.007 187 HD2 ARG 26 2HD ARG 26 -12.118 -8.098 -3.400 188 HD3 ARG 26 1HD ARG 26 -12.831 -6.588 -2.811 189 HE ARG 26 HE ARG 26 -13.024 -6.465 -5.546 190 HH11 ARG 26 1HH1 ARG 26 -14.127 -8.652 -3.060 191 HH12 ARG 26 2HH1 ARG 26 -15.535 -9.141 -3.941 192 HH21 ARG 26 1HH2 ARG 26 -14.876 -7.108 -6.706 193 HH22 ARG 26 2HH2 ARG 26 -15.960 -8.267 -6.011 194 H THR 27 H THR 27 -8.636 -2.420 -2.191 195 HA THR 27 HA THR 27 -8.834 -0.506 -0.901 196 HB THR 27 HB THR 27 -11.708 -1.116 -0.259 197 HG1 THR 27 1HG THR 27 -12.106 -0.863 -2.299 198 HG21 THR 27 3HG2 THR 27 -9.907 1.129 0.130 199 HG22 THR 27 1HG2 THR 27 -11.433 0.742 0.925 200 HG23 THR 27 2HG2 THR 27 -11.434 1.580 -0.627 201 H LEU 28 H LEU 28 -9.048 -0.099 1.455 202 HA LEU 28 HA LEU 28 -7.934 -2.140 2.945 203 HB2 LEU 28 2HB LEU 28 -8.087 0.394 3.409 204 HB3 LEU 28 1HB LEU 28 -9.608 0.007 4.214 205 HG LEU 28 HG LEU 28 -6.949 -1.219 4.959 206 HD11 LEU 28 1HD1 LEU 28 -6.529 0.875 5.700 207 HD12 LEU 28 2HD1 LEU 28 -7.547 0.350 7.041 208 HD13 LEU 28 3HD1 LEU 28 -8.235 1.323 5.740 209 HD21 LEU 28 3HD2 LEU 28 -9.739 -1.535 5.867 210 HD22 LEU 28 1HD2 LEU 28 -8.513 -1.430 7.130 211 HD23 LEU 28 2HD2 LEU 28 -8.398 -2.681 5.892 212 H GLU 29 H GLU 29 -11.340 -1.347 2.523 213 HA GLU 29 HA GLU 29 -12.287 -3.000 4.624 214 HB2 GLU 29 2HB GLU 29 -13.529 -1.095 3.510 215 HB3 GLU 29 1HB GLU 29 -13.852 -2.189 2.175 216 HG2 GLU 29 2HG GLU 29 -14.637 -2.755 5.021 217 HG3 GLU 29 1HG GLU 29 -15.692 -1.970 3.848 218 H ASP 30 H ASP 30 -13.249 -3.581 1.260 219 HA ASP 30 HA ASP 30 -13.557 -6.342 1.651 220 HB2 ASP 30 2HB ASP 30 -14.584 -4.830 -0.162 221 HB3 ASP 30 1HB ASP 30 -13.077 -5.101 -1.049 222 H GLY 31 H GLY 31 -10.758 -4.465 0.965 223 HA2 GLY 31 2HA GLY 31 -9.197 -6.383 -0.393 224 HA3 GLY 31 1HA GLY 31 -8.567 -5.039 0.562 225 H LYS 32 H LYS 32 -9.288 -5.568 3.083 226 HA LYS 32 HA LYS 32 -7.481 -7.575 3.870 227 HB2 LYS 32 2HB LYS 32 -8.246 -7.161 6.132 228 HB3 LYS 32 1HB LYS 32 -8.086 -5.633 5.279 229 HG2 LYS 32 2HG LYS 32 -10.394 -5.341 5.125 230 HG3 LYS 32 1HG LYS 32 -10.724 -7.040 5.466 231 HD2 LYS 32 2HD LYS 32 -9.360 -6.245 7.706 232 HD3 LYS 32 1HD LYS 32 -10.289 -4.802 7.298 233 HE2 LYS 32 2HE LYS 32 -11.927 -7.152 7.042 234 HE3 LYS 32 1HE LYS 32 -11.184 -7.096 8.639 235 HZ1 LYS 32 3HZ LYS 32 -12.169 -5.048 9.104 236 HZ2 LYS 32 1HZ LYS 32 -13.399 -5.927 8.342 237 HZ3 LYS 32 2HZ LYS 32 -12.550 -4.743 7.484 238 H LYS 33 H LYS 33 -10.954 -7.576 3.383 239 HA LYS 33 HA LYS 33 -11.489 -10.064 4.620 240 HB2 LYS 33 2HB LYS 33 -13.174 -8.280 3.996 241 HB3 LYS 33 1HB LYS 33 -13.039 -8.844 2.336 242 HG2 LYS 33 2HG LYS 33 -13.504 -11.132 3.893 243 HG3 LYS 33 1HG LYS 33 -14.613 -9.885 4.492 244 HD2 LYS 33 2HD LYS 33 -15.915 -10.126 2.702 245 HD3 LYS 33 1HD LYS 33 -14.552 -9.844 1.618 246 HE2 LYS 33 2HE LYS 33 -14.061 -12.386 2.442 247 HE3 LYS 33 1HE LYS 33 -15.824 -12.358 2.451 248 HZ1 LYS 33 3HZ LYS 33 -14.121 -11.586 0.144 249 HZ2 LYS 33 1HZ LYS 33 -15.813 -11.646 0.160 250 HZ3 LYS 33 2HZ LYS 33 -14.913 -13.072 0.312 251 H GLU 34 H GLU 34 -10.153 -9.206 1.546 252 HA GLU 34 HA GLU 34 -10.579 -11.887 0.470 253 HB2 GLU 34 2HB GLU 34 -10.800 -9.632 -0.835 254 HB3 GLU 34 1HB GLU 34 -9.042 -9.736 -0.945 255 HG2 GLU 34 2HG GLU 34 -9.219 -11.110 -2.664 256 HG3 GLU 34 1HG GLU 34 -10.118 -12.263 -1.663 257 H ALA 35 H ALA 35 -8.013 -9.796 1.642 258 HA ALA 35 HA ALA 35 -5.787 -11.242 0.790 259 HB1 ALA 35 1HB ALA 35 -4.677 -10.228 2.847 260 HB2 ALA 35 2HB ALA 35 -6.241 -9.488 3.187 261 HB3 ALA 35 3HB ALA 35 -5.392 -9.107 1.689 262 H ALA 36 H ALA 36 -7.979 -11.788 3.461 263 HA ALA 36 HA ALA 36 -6.421 -13.640 4.906 264 HB1 ALA 36 1HB ALA 36 -9.386 -13.174 4.744 265 HB2 ALA 36 2HB ALA 36 -8.268 -12.685 6.017 266 HB3 ALA 36 3HB ALA 36 -8.670 -14.389 5.805 267 H ALA 37 H ALA 37 -8.880 -14.097 2.382 268 HA ALA 37 HA ALA 37 -8.927 -16.886 2.373 269 HB1 ALA 37 1HB ALA 37 -9.230 -15.764 -0.286 270 HB2 ALA 37 2HB ALA 37 -10.147 -14.870 0.926 271 HB3 ALA 37 3HB ALA 37 -10.403 -16.605 0.728 272 H SER 38 H SER 38 -7.397 -14.980 -0.217 273 HA SER 38 HA SER 38 -5.760 -17.086 -1.098 274 HB2 SER 38 2HB SER 38 -6.081 -14.225 -1.692 275 HB3 SER 38 1HB SER 38 -4.435 -14.830 -1.946 276 HG SER 38 HG SER 38 -5.252 -16.373 -3.348 277 H GLY 39 H GLY 39 -5.321 -14.663 1.370 278 HA2 GLY 39 2HA GLY 39 -3.756 -14.570 3.064 279 HA3 GLY 39 1HA GLY 39 -3.063 -16.070 2.442 280 H LEU 40 H LEU 40 -3.491 -12.966 0.777 281 HA LEU 40 HA LEU 40 -0.568 -12.882 0.426 282 HB2 LEU 40 2HB LEU 40 -1.091 -11.468 -1.594 283 HB3 LEU 40 1HB LEU 40 -1.530 -13.162 -1.705 284 HG LEU 40 HG LEU 40 -3.884 -12.524 -1.164 285 HD11 LEU 40 1HD1 LEU 40 -4.043 -10.519 -0.153 286 HD12 LEU 40 2HD1 LEU 40 -4.146 -9.927 -1.811 287 HD13 LEU 40 3HD1 LEU 40 -2.606 -9.884 -0.954 288 HD21 LEU 40 3HD2 LEU 40 -2.480 -12.311 -3.574 289 HD22 LEU 40 1HD2 LEU 40 -3.544 -10.905 -3.512 290 HD23 LEU 40 2HD2 LEU 40 -4.216 -12.527 -3.357 291 HA PRO 41 HA PRO 41 -0.426 -9.041 2.581 292 HB2 PRO 41 2HB PRO 41 1.670 -7.830 1.356 293 HB3 PRO 41 1HB PRO 41 1.865 -9.195 2.463 294 HG2 PRO 41 2HG PRO 41 1.839 -9.171 -0.532 295 HG3 PRO 41 1HG PRO 41 2.916 -10.049 0.571 296 HD2 PRO 41 2HD PRO 41 0.812 -11.229 -0.657 297 HD3 PRO 41 1HD PRO 41 1.373 -11.716 0.955 298 H LEU 42 H LEU 42 -0.319 -6.609 2.172 299 HA LEU 42 HA LEU 42 -1.769 -5.977 -0.299 300 HB2 LEU 42 2HB LEU 42 -2.498 -4.018 1.517 301 HB3 LEU 42 1HB LEU 42 -3.471 -5.366 0.973 302 HG LEU 42 HG LEU 42 -1.653 -5.742 3.312 303 HD11 LEU 42 1HD1 LEU 42 -4.439 -4.906 3.841 304 HD12 LEU 42 2HD1 LEU 42 -3.297 -3.641 3.392 305 HD13 LEU 42 3HD1 LEU 42 -2.978 -4.659 4.795 306 HD21 LEU 42 3HD2 LEU 42 -4.195 -6.960 2.281 307 HD22 LEU 42 1HD2 LEU 42 -3.652 -7.210 3.939 308 HD23 LEU 42 2HD2 LEU 42 -2.642 -7.738 2.594 309 H MET 43 H MET 43 -1.700 -3.639 -0.847 310 HA MET 43 HA MET 43 0.904 -2.433 -0.194 311 HB2 MET 43 2HB MET 43 1.187 -3.357 -2.363 312 HB3 MET 43 1HB MET 43 -0.414 -2.823 -2.879 313 HG2 MET 43 2HG MET 43 0.772 -1.227 -3.922 314 HG3 MET 43 1HG MET 43 0.717 -0.443 -2.345 315 HE1 MET 43 3HE MET 43 3.996 -0.341 -0.962 316 HE2 MET 43 1HE MET 43 3.294 -1.906 -0.552 317 HE3 MET 43 2HE MET 43 2.260 -0.484 -0.679 318 H VAL 44 H VAL 44 -0.057 -1.025 1.284 319 HA VAL 44 HA VAL 44 -2.372 0.486 0.807 320 HB VAL 44 HB VAL 44 -0.075 1.059 2.680 321 HG11 VAL 44 1HG1 VAL 44 -1.290 3.111 2.256 322 HG12 VAL 44 2HG1 VAL 44 -1.674 2.518 3.871 323 HG13 VAL 44 3HG1 VAL 44 -2.826 2.297 2.553 324 HG21 VAL 44 3HG2 VAL 44 -1.208 -1.046 3.131 325 HG22 VAL 44 1HG2 VAL 44 -2.771 -0.224 3.127 326 HG23 VAL 44 2HG2 VAL 44 -1.585 0.140 4.382 327 H ILE 45 H ILE 45 -2.405 1.564 -1.098 328 HA ILE 45 HA ILE 45 -0.295 3.530 -1.636 329 HB ILE 45 HB ILE 45 -2.524 3.374 -3.550 330 HG12 ILE 45 2HG1 ILE 45 -0.710 0.980 -3.145 331 HG13 ILE 45 1HG1 ILE 45 -2.469 1.011 -2.964 332 HG21 ILE 45 1HG2 ILE 45 0.455 3.120 -3.890 333 HG22 ILE 45 2HG2 ILE 45 -0.445 4.634 -3.916 334 HG23 ILE 45 3HG2 ILE 45 -0.723 3.417 -5.162 335 HD11 ILE 45 3HD1 ILE 45 -0.946 0.450 -5.272 336 HD12 ILE 45 1HD1 ILE 45 -1.819 1.955 -5.562 337 HD13 ILE 45 2HD1 ILE 45 -2.699 0.500 -5.096 338 H ILE 46 H ILE 46 -0.644 5.493 -0.713 339 HA ILE 46 HA ILE 46 -3.440 6.428 -0.625 340 HB ILE 46 HB ILE 46 -1.378 7.409 1.315 341 HG12 ILE 46 2HG1 ILE 46 -3.217 5.273 2.225 342 HG13 ILE 46 1HG1 ILE 46 -1.899 4.748 1.182 343 HG21 ILE 46 1HG2 ILE 46 -4.382 7.202 1.344 344 HG22 ILE 46 2HG2 ILE 46 -3.425 8.668 1.165 345 HG23 ILE 46 3HG2 ILE 46 -3.406 7.783 2.691 346 HD11 ILE 46 3HD1 ILE 46 -1.826 5.184 3.929 347 HD12 ILE 46 1HD1 ILE 46 -0.933 6.528 3.219 348 HD13 ILE 46 2HD1 ILE 46 -0.461 4.867 2.857 349 H HIS 47 H HIS 47 -3.878 8.568 -1.093 350 HA HIS 47 HA HIS 47 -1.608 10.175 -2.059 351 HB2 HIS 47 2HB HIS 47 -2.955 10.881 -4.027 352 HB3 HIS 47 1HB HIS 47 -2.536 9.165 -4.046 353 HD1 HIS 47 1HD HIS 47 -5.185 11.088 -5.052 354 HD2 HIS 47 2HD HIS 47 -4.964 7.811 -2.506 355 HE1 HIS 47 1HE HIS 47 -7.497 10.101 -5.024 356 HE2 HIS 47 2HE HIS 47 -7.355 8.157 -3.428 357 H LYS 48 H LYS 48 -1.689 11.582 -0.353 358 HA LYS 48 HA LYS 48 -4.205 13.104 -0.055 359 HB2 LYS 48 2HB LYS 48 -2.501 11.885 1.882 360 HB3 LYS 48 1HB LYS 48 -2.479 13.622 2.138 361 HG2 LYS 48 2HG LYS 48 -4.281 13.154 3.405 362 HG3 LYS 48 1HG LYS 48 -5.113 13.266 1.853 363 HD2 LYS 48 2HD LYS 48 -5.844 11.187 2.164 364 HD3 LYS 48 1HD LYS 48 -4.176 10.631 2.016 365 HE2 LYS 48 2HE LYS 48 -4.106 10.081 4.171 366 HE3 LYS 48 1HE LYS 48 -4.654 11.684 4.652 367 HZ1 LYS 48 3HZ LYS 48 -6.576 10.785 5.228 368 HZ2 LYS 48 1HZ LYS 48 -6.076 9.262 4.689 369 HZ3 LYS 48 2HZ LYS 48 -6.855 10.320 3.628 370 H SER 49 H SER 49 -4.081 15.371 0.287 371 HA SER 49 HA SER 49 -3.415 17.468 -0.285 372 HB2 SER 49 2HB SER 49 -1.846 17.032 1.587 373 HB3 SER 49 1HB SER 49 -0.662 16.430 0.426 374 HG SER 49 HG SER 49 -1.225 18.973 1.122 375 H TRP 50 H TRP 50 -1.322 18.600 -1.524 376 HA TRP 50 HA TRP 50 -1.700 17.859 -4.232 377 HB2 TRP 50 2HB TRP 50 0.137 19.548 -4.659 378 HB3 TRP 50 1HB TRP 50 -1.260 20.158 -3.760 379 HD1 TRP 50 HD TRP 50 2.456 19.368 -3.355 380 HE1 TRP 50 1HE TRP 50 3.291 20.419 -1.159 381 HE3 TRP 50 3HE TRP 50 -2.030 20.869 -1.415 382 HZ2 TRP 50 2HZ TRP 50 2.193 21.714 1.096 383 HZ3 TRP 50 3HZ TRP 50 -2.050 22.007 0.765 384 HH2 TRP 50 HH TRP 50 0.019 22.419 1.995 385 H CYS 51 H CYS 51 -1.080 15.568 -3.882 386 HA CYS 51 HA CYS 51 1.718 14.967 -3.558 387 HB2 CYS 51 2HB CYS 51 0.891 12.606 -4.196 388 HB3 CYS 51 1HB CYS 51 0.346 13.296 -2.674 389 H GLY 52 H GLY 52 2.739 13.406 -5.183 390 HA2 GLY 52 2HA GLY 52 2.326 14.506 -7.895 391 HA3 GLY 52 1HA GLY 52 3.856 13.854 -7.298 392 H ALA 53 H ALA 53 2.706 11.580 -5.998 393 HA ALA 53 HA ALA 53 2.733 9.720 -8.101 394 HB1 ALA 53 1HB ALA 53 2.503 8.088 -6.496 395 HB2 ALA 53 2HB ALA 53 1.394 9.056 -5.525 396 HB3 ALA 53 3HB ALA 53 3.119 9.420 -5.520 397 H CYS 54 H CYS 54 0.288 11.751 -6.931 398 HA CYS 54 HA CYS 54 -1.831 10.101 -7.930 399 HB2 CYS 54 2HB CYS 54 -3.210 12.262 -7.432 400 HB3 CYS 54 1HB CYS 54 -2.595 11.297 -6.084 401 H LYS 55 H LYS 55 -0.197 13.089 -8.787 402 HA LYS 55 HA LYS 55 -1.710 13.572 -11.143 403 HB2 LYS 55 2HB LYS 55 0.944 14.570 -10.132 404 HB3 LYS 55 1HB LYS 55 0.343 15.018 -11.724 405 HG2 LYS 55 2HG LYS 55 -1.527 16.140 -10.809 406 HG3 LYS 55 1HG LYS 55 -1.233 15.455 -9.201 407 HD2 LYS 55 2HD LYS 55 -0.436 17.659 -9.064 408 HD3 LYS 55 1HD LYS 55 1.010 16.675 -9.287 409 HE2 LYS 55 2HE LYS 55 1.512 18.083 -10.948 410 HE3 LYS 55 1HE LYS 55 0.268 17.237 -11.867 411 HZ1 LYS 55 3HZ LYS 55 0.040 19.796 -10.400 412 HZ2 LYS 55 1HZ LYS 55 -1.327 18.907 -10.856 413 HZ3 LYS 55 2HZ LYS 55 -0.265 19.491 -12.036 414 H ALA 56 H ALA 56 1.194 11.736 -10.387 415 HA ALA 56 HA ALA 56 1.856 11.247 -13.143 416 HB1 ALA 56 1HB ALA 56 2.963 9.418 -11.143 417 HB2 ALA 56 2HB ALA 56 3.244 11.125 -10.800 418 HB3 ALA 56 3HB ALA 56 3.782 10.434 -12.330 419 H LEU 57 H LEU 57 0.485 9.250 -10.515 420 HA LEU 57 HA LEU 57 0.265 6.865 -11.817 421 HB2 LEU 57 2HB LEU 57 -1.635 6.323 -10.374 422 HB3 LEU 57 1HB LEU 57 -0.311 7.058 -9.496 423 HG LEU 57 HG LEU 57 -1.599 9.236 -9.613 424 HD11 LEU 57 1HD1 LEU 57 -3.395 7.532 -11.118 425 HD12 LEU 57 2HD1 LEU 57 -3.362 9.288 -10.964 426 HD13 LEU 57 3HD1 LEU 57 -4.200 8.314 -9.759 427 HD21 LEU 57 3HD2 LEU 57 -1.513 7.478 -7.697 428 HD22 LEU 57 1HD2 LEU 57 -3.187 7.179 -8.152 429 HD23 LEU 57 2HD2 LEU 57 -2.696 8.782 -7.630 430 H LYS 58 H LYS 58 -1.887 9.644 -12.239 431 HA LYS 58 HA LYS 58 -4.033 8.489 -13.448 432 HB2 LYS 58 2HB LYS 58 -2.880 11.110 -13.428 433 HB3 LYS 58 1HB LYS 58 -3.487 10.756 -15.039 434 HG2 LYS 58 2HG LYS 58 -5.157 11.868 -13.649 435 HG3 LYS 58 1HG LYS 58 -5.676 10.262 -14.157 436 HD2 LYS 58 2HD LYS 58 -5.061 9.359 -11.980 437 HD3 LYS 58 1HD LYS 58 -4.487 10.949 -11.469 438 HE2 LYS 58 2HE LYS 58 -7.229 10.946 -12.491 439 HE3 LYS 58 1HE LYS 58 -7.004 9.955 -11.051 440 HZ1 LYS 58 3HZ LYS 58 -6.644 11.746 -9.772 441 HZ2 LYS 58 1HZ LYS 58 -7.458 12.583 -10.996 442 HZ3 LYS 58 2HZ LYS 58 -5.768 12.574 -10.958 443 HA PRO 59 HA PRO 59 -2.330 8.317 -17.885 444 HB2 PRO 59 2HB PRO 59 0.064 9.353 -18.531 445 HB3 PRO 59 1HB PRO 59 -1.401 10.351 -18.410 446 HG2 PRO 59 2HG PRO 59 0.779 9.936 -16.385 447 HG3 PRO 59 1HG PRO 59 0.029 11.449 -16.924 448 HD2 PRO 59 2HD PRO 59 -0.704 10.221 -14.634 449 HD3 PRO 59 1HD PRO 59 -1.855 11.128 -15.643 450 H LYS 60 H LYS 60 0.098 7.701 -15.402 451 HA LYS 60 HA LYS 60 1.252 5.598 -17.095 452 HB2 LYS 60 2HB LYS 60 3.056 5.475 -15.459 453 HB3 LYS 60 1HB LYS 60 2.844 7.117 -16.050 454 HG2 LYS 60 2HG LYS 60 1.258 7.231 -13.938 455 HG3 LYS 60 1HG LYS 60 2.361 5.987 -13.361 456 HD2 LYS 60 2HD LYS 60 3.122 8.225 -12.701 457 HD3 LYS 60 1HD LYS 60 4.260 7.457 -13.807 458 HE2 LYS 60 2HE LYS 60 2.284 8.976 -15.256 459 HE3 LYS 60 1HE LYS 60 3.102 9.984 -14.067 460 HZ1 LYS 60 3HZ LYS 60 4.832 8.261 -15.624 461 HZ2 LYS 60 1HZ LYS 60 5.029 9.882 -15.183 462 HZ3 LYS 60 2HZ LYS 60 4.057 9.478 -16.505 463 H PHE 61 H PHE 61 -0.057 5.978 -13.766 464 HA PHE 61 HA PHE 61 0.074 3.219 -13.229 465 HB2 PHE 61 2HB PHE 61 -0.236 5.094 -11.528 466 HB3 PHE 61 1HB PHE 61 -1.940 5.086 -11.993 467 HD1 PHE 61 1HD PHE 61 -3.254 2.967 -11.700 468 HD2 PHE 61 2HD PHE 61 0.620 3.508 -10.035 469 HE1 PHE 61 1HE PHE 61 -3.673 1.111 -10.139 470 HE2 PHE 61 2HE PHE 61 0.212 1.653 -8.471 471 HZ PHE 61 HZ PHE 61 -1.937 0.451 -8.521 472 H ALA 62 H ALA 62 -2.015 5.178 -15.129 473 HA ALA 62 HA ALA 62 -4.292 3.510 -15.208 474 HB1 ALA 62 1HB ALA 62 -3.134 5.626 -16.960 475 HB2 ALA 62 2HB ALA 62 -4.716 5.548 -16.182 476 HB3 ALA 62 3HB ALA 62 -4.395 4.584 -17.623 477 H GLU 63 H GLU 63 -1.111 3.240 -16.305 478 HA GLU 63 HA GLU 63 -1.499 1.271 -18.374 479 HB2 GLU 63 2HB GLU 63 0.388 3.032 -18.212 480 HB3 GLU 63 1HB GLU 63 1.089 1.968 -16.987 481 HG2 GLU 63 2HG GLU 63 2.184 1.206 -18.826 482 HG3 GLU 63 1HG GLU 63 0.769 0.156 -18.882 483 H SER 64 H SER 64 -1.406 1.336 -15.034 484 HA SER 64 HA SER 64 -0.135 -1.028 -14.368 485 HB2 SER 64 2HB SER 64 -2.499 0.324 -13.093 486 HB3 SER 64 1HB SER 64 -1.563 -0.947 -12.339 487 HG SER 64 HG SER 64 0.290 0.484 -12.635 488 H THR 65 H THR 65 -2.669 -0.775 -16.471 489 HA THR 65 HA THR 65 -4.563 -2.625 -15.819 490 HB THR 65 HB THR 65 -3.374 -2.790 -18.556 491 HG1 THR 65 1HG THR 65 -4.260 -0.773 -19.069 492 HG21 THR 65 3HG2 THR 65 -6.180 -2.054 -18.199 493 HG22 THR 65 1HG2 THR 65 -5.738 -3.631 -17.545 494 HG23 THR 65 2HG2 THR 65 -5.440 -3.266 -19.245 495 H GLU 66 H GLU 66 -1.239 -3.135 -16.792 496 HA GLU 66 HA GLU 66 -1.505 -5.999 -16.915 497 HB2 GLU 66 2HB GLU 66 0.488 -4.099 -17.672 498 HB3 GLU 66 1HB GLU 66 1.224 -5.260 -16.568 499 HG2 GLU 66 2HG GLU 66 0.267 -7.074 -18.013 500 HG3 GLU 66 1HG GLU 66 -0.155 -5.819 -19.178 501 H ILE 67 H ILE 67 -0.499 -3.553 -14.564 502 HA ILE 67 HA ILE 67 0.508 -5.558 -12.771 503 HB ILE 67 HB ILE 67 1.086 -3.959 -11.316 504 HG12 ILE 67 2HG1 ILE 67 -1.562 -2.593 -11.810 505 HG13 ILE 67 1HG1 ILE 67 -1.110 -3.582 -10.416 506 HG21 ILE 67 1HG2 ILE 67 0.533 -1.608 -12.844 507 HG22 ILE 67 2HG2 ILE 67 1.076 -2.908 -13.902 508 HG23 ILE 67 3HG2 ILE 67 2.067 -2.415 -12.536 509 HD11 ILE 67 3HD1 ILE 67 -1.065 -1.244 -9.822 510 HD12 ILE 67 1HD1 ILE 67 0.042 -0.895 -11.151 511 HD13 ILE 67 2HD1 ILE 67 0.574 -1.896 -9.799 512 H SER 68 H SER 68 -2.574 -4.688 -13.791 513 HA SER 68 HA SER 68 -4.081 -5.243 -11.452 514 HB2 SER 68 2HB SER 68 -5.052 -4.110 -13.435 515 HB3 SER 68 1HB SER 68 -4.868 -5.600 -14.361 516 HG SER 68 HG SER 68 -6.674 -6.246 -13.538 517 H GLU 69 H GLU 69 -2.805 -7.157 -14.105 518 HA GLU 69 HA GLU 69 -3.941 -9.628 -13.235 519 HB2 GLU 69 2HB GLU 69 -1.529 -9.233 -15.015 520 HB3 GLU 69 1HB GLU 69 -2.550 -10.662 -14.916 521 HG2 GLU 69 2HG GLU 69 -3.646 -8.008 -15.769 522 HG3 GLU 69 1HG GLU 69 -2.858 -9.100 -16.907 523 H LEU 70 H LEU 70 -0.927 -7.902 -12.827 524 HA LEU 70 HA LEU 70 0.474 -9.936 -11.423 525 HB2 LEU 70 2HB LEU 70 0.782 -6.970 -11.719 526 HB3 LEU 70 1HB LEU 70 1.743 -7.827 -10.520 527 HG LEU 70 HG LEU 70 2.781 -9.171 -12.247 528 HD11 LEU 70 1HD1 LEU 70 0.697 -9.163 -13.703 529 HD12 LEU 70 2HD1 LEU 70 2.253 -9.075 -14.525 530 HD13 LEU 70 3HD1 LEU 70 1.276 -7.617 -14.334 531 HD21 LEU 70 3HD2 LEU 70 4.142 -7.524 -13.211 532 HD22 LEU 70 1HD2 LEU 70 3.564 -6.805 -11.706 533 HD23 LEU 70 2HD2 LEU 70 2.836 -6.339 -13.244 534 H SER 71 H SER 71 -2.097 -7.859 -10.603 535 HA SER 71 HA SER 71 -1.639 -7.566 -7.824 536 HB2 SER 71 2HB SER 71 -3.539 -6.669 -9.674 537 HB3 SER 71 1HB SER 71 -4.435 -7.643 -8.511 538 HG SER 71 HG SER 71 -2.972 -5.286 -8.113 539 H HIS 72 H HIS 72 -2.610 -10.239 -9.720 540 HA HIS 72 HA HIS 72 -4.309 -11.603 -7.961 541 HB2 HIS 72 2HB HIS 72 -2.944 -12.169 -10.397 542 HB3 HIS 72 1HB HIS 72 -2.582 -13.482 -9.266 543 HD1 HIS 72 1HD HIS 72 -4.729 -14.732 -8.252 544 HD2 HIS 72 2HD HIS 72 -5.423 -12.283 -11.537 545 HE1 HIS 72 1HE HIS 72 -6.980 -15.418 -9.138 546 HE2 HIS 72 2HE HIS 72 -7.415 -13.865 -11.074 547 H ASN 73 H ASN 73 -1.071 -10.730 -7.696 548 HA ASN 73 HA ASN 73 -0.276 -12.856 -5.913 549 HB2 ASN 73 2HB ASN 73 1.087 -10.310 -6.820 550 HB3 ASN 73 1HB ASN 73 1.835 -11.549 -5.811 551 HD21 ASN 73 1HD2 ASN 73 0.714 -10.727 -8.996 552 HD22 ASN 73 2HD2 ASN 73 1.433 -12.082 -9.815 553 H PHE 74 H PHE 74 -1.343 -9.516 -5.729 554 HA PHE 74 HA PHE 74 -2.012 -9.779 -2.968 555 HB2 PHE 74 2HB PHE 74 -0.622 -7.749 -2.298 556 HB3 PHE 74 1HB PHE 74 0.245 -9.272 -2.530 557 HD1 PHE 74 1HD PHE 74 -0.745 -6.238 -4.457 558 HD2 PHE 74 2HD PHE 74 2.176 -9.245 -3.737 559 HE1 PHE 74 1HE PHE 74 0.774 -5.139 -6.054 560 HE2 PHE 74 2HE PHE 74 3.700 -8.154 -5.329 561 HZ PHE 74 HZ PHE 74 3.001 -6.100 -6.490 562 H VAL 75 H VAL 75 -3.053 -7.756 -2.124 563 HA VAL 75 HA VAL 75 -4.339 -6.307 -4.354 564 HB VAL 75 HB VAL 75 -6.359 -6.228 -3.185 565 HG11 VAL 75 1HG1 VAL 75 -5.195 -8.676 -3.636 566 HG12 VAL 75 2HG1 VAL 75 -6.899 -8.390 -3.284 567 HG13 VAL 75 3HG1 VAL 75 -5.791 -8.816 -1.981 568 HG21 VAL 75 3HG2 VAL 75 -5.598 -5.406 -1.057 569 HG22 VAL 75 1HG2 VAL 75 -4.844 -6.956 -0.683 570 HG23 VAL 75 2HG2 VAL 75 -6.600 -6.832 -0.791 571 H MET 76 H MET 76 -4.551 -4.026 -4.256 572 HA MET 76 HA MET 76 -2.751 -2.828 -2.278 573 HB2 MET 76 2HB MET 76 -4.030 -1.854 -4.803 574 HB3 MET 76 1HB MET 76 -3.374 -0.699 -3.654 575 HG2 MET 76 2HG MET 76 -1.849 -1.315 -5.510 576 HG3 MET 76 1HG MET 76 -1.186 -1.589 -3.904 577 HE1 MET 76 3HE MET 76 -1.592 -2.826 -7.297 578 HE2 MET 76 1HE MET 76 -0.818 -4.405 -7.172 579 HE3 MET 76 2HE MET 76 0.043 -2.958 -6.649 580 H VAL 77 H VAL 77 -3.485 -0.572 -1.477 581 HA VAL 77 HA VAL 77 -6.294 -0.594 -0.642 582 HB VAL 77 HB VAL 77 -3.953 -0.288 1.247 583 HG11 VAL 77 1HG1 VAL 77 -6.354 0.987 1.477 584 HG12 VAL 77 2HG1 VAL 77 -5.299 0.553 2.823 585 HG13 VAL 77 3HG1 VAL 77 -6.640 -0.502 2.378 586 HG21 VAL 77 3HG2 VAL 77 -6.072 -2.330 1.596 587 HG22 VAL 77 1HG2 VAL 77 -4.367 -2.381 2.039 588 HG23 VAL 77 2HG2 VAL 77 -4.849 -2.608 0.357 589 H ASN 78 H ASN 78 -6.409 1.088 -2.244 590 HA ASN 78 HA ASN 78 -4.903 3.494 -1.762 591 HB2 ASN 78 2HB ASN 78 -5.395 2.674 -4.063 592 HB3 ASN 78 1HB ASN 78 -7.091 3.057 -3.783 593 HD21 ASN 78 1HD2 ASN 78 -4.193 4.836 -2.802 594 HD22 ASN 78 2HD2 ASN 78 -4.567 6.275 -3.698 595 H LEU 79 H LEU 79 -5.493 4.645 -0.056 596 HA LEU 79 HA LEU 79 -8.358 5.247 0.266 597 HB2 LEU 79 2HB LEU 79 -7.925 5.720 2.592 598 HB3 LEU 79 1HB LEU 79 -7.345 4.116 2.191 599 HG LEU 79 HG LEU 79 -5.077 5.535 1.837 600 HD11 LEU 79 1HD1 LEU 79 -4.917 7.056 3.822 601 HD12 LEU 79 2HD1 LEU 79 -6.672 6.953 3.959 602 HD13 LEU 79 3HD1 LEU 79 -5.940 7.647 2.513 603 HD21 LEU 79 3HD2 LEU 79 -5.673 3.486 3.292 604 HD22 LEU 79 1HD2 LEU 79 -5.848 4.663 4.594 605 HD23 LEU 79 2HD2 LEU 79 -4.304 4.492 3.761 606 H GLU 80 H GLU 80 -8.974 7.389 0.837 607 HA GLU 80 HA GLU 80 -7.079 9.438 -0.109 608 HB2 GLU 80 2HB GLU 80 -9.499 8.775 -1.222 609 HB3 GLU 80 1HB GLU 80 -9.935 10.128 -0.171 610 HG2 GLU 80 2HG GLU 80 -8.037 11.402 -1.264 611 HG3 GLU 80 1HG GLU 80 -7.980 10.091 -2.451 612 H ASP 81 H ASP 81 -8.384 11.706 0.609 613 HA ASP 81 HA ASP 81 -7.665 12.093 3.260 614 HB2 ASP 81 2HB ASP 81 -9.101 14.179 3.095 615 HB3 ASP 81 1HB ASP 81 -7.863 14.000 1.857 616 H GLU 82 H GLU 82 -10.580 10.772 1.945 617 HA GLU 82 HA GLU 82 -12.433 11.301 3.936 618 HB2 GLU 82 2HB GLU 82 -12.060 8.872 2.187 619 HB3 GLU 82 1HB GLU 82 -13.434 9.059 3.270 620 HG2 GLU 82 2HG GLU 82 -12.907 11.315 1.450 621 HG3 GLU 82 1HG GLU 82 -13.441 9.815 0.696 622 H GLU 83 H GLU 83 -9.758 9.061 3.914 623 HA GLU 83 HA GLU 83 -10.433 8.295 6.678 624 HB2 GLU 83 2HB GLU 83 -9.700 6.649 4.358 625 HB3 GLU 83 1HB GLU 83 -8.769 6.291 5.805 626 HG2 GLU 83 2HG GLU 83 -10.484 4.889 6.195 627 HG3 GLU 83 1HG GLU 83 -11.216 6.347 6.879 628 H GLU 84 H GLU 84 -9.176 9.781 7.725 629 HA GLU 84 HA GLU 84 -6.336 9.933 7.014 630 HB2 GLU 84 2HB GLU 84 -7.939 11.692 8.878 631 HB3 GLU 84 1HB GLU 84 -6.274 11.958 8.375 632 HG2 GLU 84 2HG GLU 84 -6.888 12.921 6.468 633 HG3 GLU 84 1HG GLU 84 -8.096 11.682 6.130 634 HA PRO 85 HA PRO 85 -6.090 7.137 10.643 635 HB2 PRO 85 2HB PRO 85 -3.641 6.141 9.971 636 HB3 PRO 85 1HB PRO 85 -5.166 5.500 9.329 637 HG2 PRO 85 2HG PRO 85 -3.232 7.418 8.076 638 HG3 PRO 85 1HG PRO 85 -4.081 6.037 7.343 639 HD2 PRO 85 2HD PRO 85 -4.909 8.583 6.996 640 HD3 PRO 85 1HD PRO 85 -6.051 7.219 7.092 641 H LYS 86 H LYS 86 -3.739 6.714 11.876 642 HA LYS 86 HA LYS 86 -2.307 9.218 12.183 643 HB2 LYS 86 2HB LYS 86 -4.174 8.106 14.248 644 HB3 LYS 86 1HB LYS 86 -2.718 8.966 14.763 645 HG2 LYS 86 2HG LYS 86 -3.776 10.888 14.494 646 HG3 LYS 86 1HG LYS 86 -3.957 10.544 12.774 647 HD2 LYS 86 2HD LYS 86 -6.154 10.348 13.046 648 HD3 LYS 86 1HD LYS 86 -5.897 9.013 14.171 649 HE2 LYS 86 2HE LYS 86 -6.885 10.352 15.673 650 HE3 LYS 86 1HE LYS 86 -5.328 11.176 15.732 651 HZ1 LYS 86 3HZ LYS 86 -6.081 12.845 14.306 652 HZ2 LYS 86 1HZ LYS 86 -7.382 12.592 15.360 653 HZ3 LYS 86 2HZ LYS 86 -7.424 11.952 13.795 654 H ASP 87 H ASP 87 -1.089 7.157 11.175 655 HA ASP 87 HA ASP 87 0.858 6.448 13.149 656 HB2 ASP 87 2HB ASP 87 -1.261 4.740 13.105 657 HB3 ASP 87 1HB ASP 87 -0.196 3.983 11.909 658 H GLU 88 H GLU 88 2.113 4.356 11.929 659 HA GLU 88 HA GLU 88 3.505 5.612 9.828 660 HB2 GLU 88 2HB GLU 88 3.508 2.665 10.469 661 HB3 GLU 88 1HB GLU 88 4.778 3.585 9.678 662 HG2 GLU 88 2HG GLU 88 3.918 3.758 12.552 663 HG3 GLU 88 1HG GLU 88 5.448 3.151 11.921 664 H ASP 89 H ASP 89 0.585 3.881 9.821 665 HA ASP 89 HA ASP 89 0.586 2.476 7.459 666 HB2 ASP 89 2HB ASP 89 -1.584 3.953 8.919 667 HB3 ASP 89 1HB ASP 89 -1.919 3.104 7.402 668 H PHE 90 H PHE 90 0.911 5.881 7.755 669 HA PHE 90 HA PHE 90 0.212 6.162 4.908 670 HB2 PHE 90 2HB PHE 90 -0.286 8.521 5.325 671 HB3 PHE 90 1HB PHE 90 -1.278 7.470 6.346 672 HD1 PHE 90 2HD PHE 90 1.769 9.589 6.360 673 HD2 PHE 90 1HD PHE 90 -1.300 7.743 8.658 674 HE1 PHE 90 2HE PHE 90 2.512 10.837 8.347 675 HE2 PHE 90 1HE PHE 90 -0.565 8.991 10.647 676 HZ PHE 90 HZ PHE 90 1.343 10.538 10.494 677 H SER 91 H SER 91 2.528 7.106 7.413 678 HA SER 91 HA SER 91 4.671 7.128 5.533 679 HB2 SER 91 2HB SER 91 4.009 9.820 6.746 680 HB3 SER 91 1HB SER 91 5.279 9.446 5.571 681 HG SER 91 HG SER 91 3.858 9.760 4.072 682 HA PRO 92 HA PRO 92 6.098 6.289 9.779 683 HB2 PRO 92 2HB PRO 92 8.009 4.475 8.581 684 HB3 PRO 92 1HB PRO 92 6.619 4.095 9.611 685 HG2 PRO 92 2HG PRO 92 6.775 3.437 6.958 686 HG3 PRO 92 1HG PRO 92 5.251 3.693 7.822 687 HD2 PRO 92 2HD PRO 92 6.737 5.558 6.008 688 HD3 PRO 92 1HD PRO 92 4.990 5.260 6.133 689 H ASP 93 H ASP 93 8.645 5.852 7.338 690 HA ASP 93 HA ASP 93 10.314 7.748 8.815 691 HB2 ASP 93 2HB ASP 93 11.021 5.335 8.091 692 HB3 ASP 93 1HB ASP 93 11.299 6.091 6.514 693 H GLY 94 H GLY 94 8.162 8.704 7.149 694 HA2 GLY 94 2HA GLY 94 9.765 10.404 5.376 695 HA3 GLY 94 1HA GLY 94 8.403 9.524 4.675 696 H GLY 95 H GLY 95 8.899 12.430 4.961 697 HA2 GLY 95 2HA GLY 95 6.907 13.286 6.905 698 HA3 GLY 95 1HA GLY 95 7.892 14.332 5.878 699 H TYR 96 H TYR 96 7.130 12.721 3.476 700 HA TYR 96 HA TYR 96 5.162 14.288 2.421 701 HB2 TYR 96 2HB TYR 96 4.643 12.199 0.936 702 HB3 TYR 96 1HB TYR 96 6.221 12.987 0.830 703 HD1 TYR 96 2HD TYR 96 8.193 11.918 1.932 704 HD2 TYR 96 1HD TYR 96 4.435 9.951 1.663 705 HE1 TYR 96 2HE TYR 96 9.291 9.767 2.385 706 HE2 TYR 96 1HE TYR 96 5.513 7.790 2.091 707 HH TYR 96 HH TYR 96 8.208 7.342 3.475 708 H ILE 97 H ILE 97 2.906 13.801 1.830 709 HA ILE 97 HA ILE 97 1.527 12.028 3.685 710 HB ILE 97 HB ILE 97 -0.162 14.022 3.988 711 HG12 ILE 97 2HG1 ILE 97 2.166 15.785 4.136 712 HG13 ILE 97 1HG1 ILE 97 1.763 15.303 2.483 713 HG21 ILE 97 1HG2 ILE 97 0.841 12.999 5.860 714 HG22 ILE 97 2HG2 ILE 97 1.162 14.727 6.017 715 HG23 ILE 97 3HG2 ILE 97 2.432 13.639 5.449 716 HD11 ILE 97 3HD1 ILE 97 -0.420 16.200 2.671 717 HD12 ILE 97 1HD1 ILE 97 0.705 17.422 3.265 718 HD13 ILE 97 2HD1 ILE 97 -0.233 16.459 4.407 719 HA PRO 98 HA PRO 98 0.880 9.980 2.992 720 HB2 PRO 98 2HB PRO 98 -1.881 9.466 1.824 721 HB3 PRO 98 1HB PRO 98 -1.028 8.491 3.056 722 HG2 PRO 98 2HG PRO 98 -2.484 10.902 3.439 723 HG3 PRO 98 1HG PRO 98 -1.526 9.992 4.640 724 HD2 PRO 98 2HD PRO 98 -0.680 12.349 3.951 725 HD3 PRO 98 1HD PRO 98 0.490 11.020 3.987 726 H ARG 99 H ARG 99 1.775 8.197 1.999 727 HA ARG 99 HA ARG 99 1.671 8.185 -0.945 728 HB2 ARG 99 2HB ARG 99 3.950 8.210 0.946 729 HB3 ARG 99 1HB ARG 99 4.120 7.171 -0.471 730 HG2 ARG 99 2HG ARG 99 5.070 9.408 -0.816 731 HG3 ARG 99 1HG ARG 99 3.761 9.046 -1.942 732 HD2 ARG 99 2HD ARG 99 2.230 10.403 -0.680 733 HD3 ARG 99 1HD ARG 99 3.415 10.642 0.593 734 HE ARG 99 HE ARG 99 4.685 11.661 -1.528 735 HH11 ARG 99 1HH1 ARG 99 1.443 12.145 -0.322 736 HH12 ARG 99 2HH1 ARG 99 1.328 13.762 -0.929 737 HH21 ARG 99 1HH2 ARG 99 4.531 13.788 -2.325 738 HH22 ARG 99 2HH2 ARG 99 3.078 14.694 -2.065 739 H ILE 100 H ILE 100 3.170 5.965 -1.468 740 HA ILE 100 HA ILE 100 1.361 3.845 -0.619 741 HB ILE 100 HB ILE 100 1.755 4.115 -3.009 742 HG12 ILE 100 2HG1 ILE 100 2.969 1.572 -1.912 743 HG13 ILE 100 1HG1 ILE 100 1.250 1.886 -2.124 744 HG21 ILE 100 1HG2 ILE 100 3.890 4.986 -3.236 745 HG22 ILE 100 2HG2 ILE 100 4.051 3.344 -3.854 746 HG23 ILE 100 3HG2 ILE 100 4.615 3.733 -2.230 747 HD11 ILE 100 3HD1 ILE 100 2.236 2.370 -4.623 748 HD12 ILE 100 1HD1 ILE 100 1.501 0.860 -4.084 749 HD13 ILE 100 2HD1 ILE 100 3.256 1.045 -4.060 750 H LEU 101 H LEU 101 1.931 2.136 0.619 751 HA LEU 101 HA LEU 101 4.745 1.615 1.188 752 HB2 LEU 101 2HB LEU 101 3.408 1.490 3.685 753 HB3 LEU 101 1HB LEU 101 4.723 2.545 3.212 754 HG LEU 101 HG LEU 101 1.903 3.285 2.525 755 HD11 LEU 101 1HD1 LEU 101 1.653 4.440 4.593 756 HD12 LEU 101 2HD1 LEU 101 3.264 3.944 5.118 757 HD13 LEU 101 3HD1 LEU 101 1.984 2.742 4.936 758 HD21 LEU 101 3HD2 LEU 101 3.865 5.278 3.398 759 HD22 LEU 101 1HD2 LEU 101 2.765 5.287 2.020 760 HD23 LEU 101 2HD2 LEU 101 4.292 4.416 1.924 761 H PHE 102 H PHE 102 5.204 -0.495 1.845 762 HA PHE 102 HA PHE 102 3.115 -2.417 1.269 763 HB2 PHE 102 2HB PHE 102 6.023 -2.707 2.010 764 HB3 PHE 102 1HB PHE 102 4.964 -4.080 1.715 765 HD1 PHE 102 2HD PHE 102 6.170 -0.947 0.109 766 HD2 PHE 102 1HD PHE 102 4.775 -4.931 -0.422 767 HE1 PHE 102 2HE PHE 102 6.654 -0.792 -2.298 768 HE2 PHE 102 1HE PHE 102 5.257 -4.784 -2.829 769 HZ PHE 102 HZ PHE 102 6.198 -2.711 -3.771 770 H LEU 103 H LEU 103 2.455 -4.117 2.695 771 HA LEU 103 HA LEU 103 3.158 -3.960 5.483 772 HB2 LEU 103 2HB LEU 103 1.159 -3.234 6.379 773 HB3 LEU 103 1HB LEU 103 1.385 -2.171 5.010 774 HG LEU 103 HG LEU 103 -0.513 -4.497 5.224 775 HD11 LEU 103 1HD1 LEU 103 -0.805 -1.525 5.057 776 HD12 LEU 103 2HD1 LEU 103 -1.454 -2.633 6.261 777 HD13 LEU 103 3HD1 LEU 103 -2.123 -2.616 4.628 778 HD21 LEU 103 3HD2 LEU 103 0.556 -3.055 2.859 779 HD22 LEU 103 1HD2 LEU 103 -1.168 -3.431 2.882 780 HD23 LEU 103 2HD2 LEU 103 0.018 -4.728 3.019 781 H ASP 104 H ASP 104 2.127 -5.619 6.795 782 HA ASP 104 HA ASP 104 2.038 -8.111 5.426 783 HB2 ASP 104 2HB ASP 104 1.823 -7.201 8.252 784 HB3 ASP 104 1HB ASP 104 1.175 -8.801 7.861 785 HA PRO 105 HA PRO 105 -2.188 -8.661 4.347 786 HB2 PRO 105 2HB PRO 105 -2.049 -11.352 5.580 787 HB3 PRO 105 1HB PRO 105 -2.448 -10.888 3.915 788 HG2 PRO 105 2HG PRO 105 -0.092 -12.022 4.572 789 HG3 PRO 105 1HG PRO 105 -0.244 -10.825 3.267 790 HD2 PRO 105 2HD PRO 105 0.876 -10.519 6.006 791 HD3 PRO 105 1HD PRO 105 1.337 -9.706 4.498 792 H SER 106 H SER 106 -3.144 -7.232 5.822 793 HA SER 106 HA SER 106 -5.159 -8.023 7.402 794 HB2 SER 106 2HB SER 106 -4.050 -7.647 9.770 795 HB3 SER 106 1HB SER 106 -4.008 -9.245 9.007 796 HG SER 106 HG SER 106 -1.938 -7.325 8.737 797 H GLY 107 H GLY 107 -2.519 -5.824 6.980 798 HA2 GLY 107 2HA GLY 107 -3.101 -3.500 6.511 799 HA3 GLY 107 1HA GLY 107 -4.287 -3.612 7.814 800 H LYS 108 H LYS 108 -0.991 -4.883 7.893 801 HA LYS 108 HA LYS 108 -0.452 -3.014 10.111 802 HB2 LYS 108 2HB LYS 108 -0.043 -5.860 9.789 803 HB3 LYS 108 1HB LYS 108 1.460 -5.052 10.208 804 HG2 LYS 108 2HG LYS 108 -0.804 -4.158 11.812 805 HG3 LYS 108 1HG LYS 108 -0.464 -5.891 11.971 806 HD2 LYS 108 2HD LYS 108 1.912 -4.164 12.033 807 HD3 LYS 108 1HD LYS 108 0.790 -3.911 13.371 808 HE2 LYS 108 2HE LYS 108 1.854 -5.633 14.331 809 HE3 LYS 108 1HE LYS 108 0.898 -6.633 13.240 810 HZ1 LYS 108 3HZ LYS 108 3.677 -5.685 12.823 811 HZ2 LYS 108 1HZ LYS 108 2.760 -6.456 11.629 812 HZ3 LYS 108 2HZ LYS 108 3.163 -7.280 13.050 813 H VAL 109 H VAL 109 0.190 -1.400 8.490 814 HA VAL 109 HA VAL 109 2.283 -1.671 6.682 815 HB VAL 109 HB VAL 109 1.064 0.619 8.144 816 HG11 VAL 109 1HG1 VAL 109 3.671 0.747 6.659 817 HG12 VAL 109 2HG1 VAL 109 3.321 1.282 8.301 818 HG13 VAL 109 3HG1 VAL 109 2.642 2.154 6.928 819 HG21 VAL 109 3HG2 VAL 109 1.454 -0.130 5.257 820 HG22 VAL 109 1HG2 VAL 109 0.789 1.418 5.776 821 HG23 VAL 109 2HG2 VAL 109 -0.052 -0.079 6.171 822 H HIS 110 H HIS 110 4.397 -1.732 6.802 823 HA HIS 110 HA HIS 110 5.709 -1.067 9.335 824 HB2 HIS 110 2HB HIS 110 7.220 -3.102 8.884 825 HB3 HIS 110 1HB HIS 110 5.614 -3.412 9.536 826 HD1 HIS 110 1HD HIS 110 4.491 -5.296 8.419 827 HD2 HIS 110 2HD HIS 110 7.068 -3.305 5.840 828 HE1 HIS 110 1HE HIS 110 4.352 -6.539 6.238 829 HE2 HIS 110 2HE HIS 110 5.847 -5.257 4.665 830 HA PRO 111 HA PRO 111 8.370 1.108 6.530 831 HB2 PRO 111 2HB PRO 111 10.477 1.537 8.190 832 HB3 PRO 111 1HB PRO 111 8.960 2.437 8.310 833 HG2 PRO 111 2HG PRO 111 9.906 0.101 9.917 834 HG3 PRO 111 1HG PRO 111 9.079 1.571 10.463 835 HD2 PRO 111 2HD PRO 111 7.800 -0.796 10.114 836 HD3 PRO 111 1HD PRO 111 7.007 0.774 9.850 837 H GLU 112 H GLU 112 8.360 -1.730 6.279 838 HA GLU 112 HA GLU 112 11.184 -2.481 6.200 839 HB2 GLU 112 2HB GLU 112 8.802 -3.894 6.712 840 HB3 GLU 112 1HB GLU 112 9.422 -4.521 5.192 841 HG2 GLU 112 2HG GLU 112 11.460 -4.213 7.258 842 HG3 GLU 112 1HG GLU 112 10.178 -5.347 7.677 843 H ILE 113 H ILE 113 8.546 -3.265 3.938 844 HA ILE 113 HA ILE 113 10.403 -2.984 1.734 845 HB ILE 113 HB ILE 113 7.486 -3.738 1.626 846 HG12 ILE 113 2HG1 ILE 113 9.511 -5.830 1.243 847 HG13 ILE 113 1HG1 ILE 113 9.473 -5.156 2.879 848 HG21 ILE 113 1HG2 ILE 113 9.572 -3.377 -0.382 849 HG22 ILE 113 2HG2 ILE 113 7.820 -3.446 -0.568 850 HG23 ILE 113 3HG2 ILE 113 8.757 -4.936 -0.482 851 HD11 ILE 113 3HD1 ILE 113 7.923 -6.741 3.193 852 HD12 ILE 113 1HD1 ILE 113 7.527 -6.850 1.477 853 HD13 ILE 113 2HD1 ILE 113 6.846 -5.552 2.457 854 H ILE 114 H ILE 114 10.780 -1.117 0.875 855 HA ILE 114 HA ILE 114 8.574 0.783 0.427 856 HB ILE 114 HB ILE 114 10.046 2.632 0.872 857 HG12 ILE 114 2HG1 ILE 114 12.110 1.409 -0.009 858 HG13 ILE 114 1HG1 ILE 114 12.362 2.457 1.376 859 HG21 ILE 114 1HG2 ILE 114 9.273 0.760 2.828 860 HG22 ILE 114 2HG2 ILE 114 9.542 2.492 3.017 861 HG23 ILE 114 3HG2 ILE 114 10.865 1.360 3.286 862 HD11 ILE 114 3HD1 ILE 114 13.243 0.769 2.496 863 HD12 ILE 114 1HD1 ILE 114 13.006 -0.273 1.092 864 HD13 ILE 114 2HD1 ILE 114 11.750 -0.151 2.324 865 H ASN 115 H ASN 115 10.250 2.661 -0.953 866 HA ASN 115 HA ASN 115 10.515 1.275 -3.500 867 HB2 ASN 115 2HB ASN 115 9.310 3.510 -3.227 868 HB3 ASN 115 1HB ASN 115 10.908 4.226 -2.984 869 HD21 ASN 115 1HD2 ASN 115 9.384 5.133 -5.009 870 HD22 ASN 115 2HD2 ASN 115 10.027 4.600 -6.540 871 H GLU 116 H GLU 116 12.415 0.093 -2.629 872 HA GLU 116 HA GLU 116 14.791 1.245 -1.820 873 HB2 GLU 116 2HB GLU 116 14.081 -1.306 -3.190 874 HB3 GLU 116 1HB GLU 116 15.790 -0.860 -3.091 875 HG2 GLU 116 2HG GLU 116 13.995 -0.929 -0.689 876 HG3 GLU 116 1HG GLU 116 14.866 -2.349 -1.259 877 H ASN 117 H ASN 117 13.371 1.189 -4.971 878 HA ASN 117 HA ASN 117 15.858 2.103 -6.212 879 HB2 ASN 117 2HB ASN 117 13.952 0.380 -7.135 880 HB3 ASN 117 1HB ASN 117 13.439 1.898 -7.888 881 HD21 ASN 117 1HD2 ASN 117 14.255 2.251 -9.803 882 HD22 ASN 117 2HD2 ASN 117 15.788 1.670 -10.395 883 H GLY 118 H GLY 118 13.657 3.575 -4.431 884 HA2 GLY 118 2HA GLY 118 13.059 5.791 -6.242 885 HA3 GLY 118 1HA GLY 118 12.448 5.586 -4.597 886 H ASN 119 H ASN 119 13.058 7.953 -4.635 887 HA ASN 119 HA ASN 119 15.813 8.668 -4.584 888 HB2 ASN 119 2HB ASN 119 13.464 10.064 -4.794 889 HB3 ASN 119 1HB ASN 119 13.963 10.443 -3.139 890 HD21 ASN 119 1HD2 ASN 119 15.316 12.057 -2.882 891 HD22 ASN 119 2HD2 ASN 119 16.328 12.751 -4.121 892 HA PRO 120 HA PRO 120 16.751 7.705 -0.366 893 HB2 PRO 120 2HB PRO 120 18.785 9.731 -0.196 894 HB3 PRO 120 1HB PRO 120 18.985 7.998 -0.505 895 HG2 PRO 120 2HG PRO 120 19.499 9.988 -2.344 896 HG3 PRO 120 1HG PRO 120 19.133 8.298 -2.757 897 HD2 PRO 120 2HD PRO 120 17.340 10.698 -2.785 898 HD3 PRO 120 1HD PRO 120 17.427 9.332 -3.926 899 H SER 121 H SER 121 14.550 9.495 -0.561 900 HA SER 121 HA SER 121 14.456 10.554 2.017 901 HB2 SER 121 2HB SER 121 15.702 12.308 0.065 902 HB3 SER 121 1HB SER 121 14.221 13.032 0.714 903 HG SER 121 HG SER 121 16.213 11.892 2.372 904 H TYR 122 H TYR 122 12.916 8.987 0.308 905 HA TYR 122 HA TYR 122 10.376 10.283 0.530 906 HB2 TYR 122 2HB TYR 122 11.833 10.297 -1.996 907 HB3 TYR 122 1HB TYR 122 10.247 9.536 -2.138 908 HD1 TYR 122 1HD TYR 122 8.424 11.016 -0.611 909 HD2 TYR 122 2HD TYR 122 11.844 12.479 -2.674 910 HE1 TYR 122 1HE TYR 122 7.389 13.243 -0.737 911 HE2 TYR 122 2HE TYR 122 10.820 14.711 -2.803 912 HH TYR 122 HH TYR 122 8.661 15.755 -2.700 913 H LYS 123 H LYS 123 12.090 7.670 -1.141 914 HA LYS 123 HA LYS 123 11.626 5.459 -1.423 915 HB2 LYS 123 2HB LYS 123 10.940 6.016 1.438 916 HB3 LYS 123 1HB LYS 123 10.683 4.408 0.781 917 HG2 LYS 123 2HG LYS 123 13.286 5.905 0.967 918 HG3 LYS 123 1HG LYS 123 12.807 4.455 1.864 919 HD2 LYS 123 2HD LYS 123 13.887 3.327 0.260 920 HD3 LYS 123 1HD LYS 123 12.470 3.673 -0.742 921 HE2 LYS 123 2HE LYS 123 13.627 5.047 -2.064 922 HE3 LYS 123 1HE LYS 123 14.363 5.877 -0.696 923 HZ1 LYS 123 3HZ LYS 123 15.290 3.214 -1.594 924 HZ2 LYS 123 1HZ LYS 123 16.096 4.327 -0.607 925 HZ3 LYS 123 2HZ LYS 123 15.905 4.644 -2.256 926 H TYR 124 H TYR 124 8.930 5.672 0.802 927 HA TYR 124 HA TYR 124 7.121 4.264 -0.650 928 HB2 TYR 124 2HB TYR 124 6.710 6.449 1.359 929 HB3 TYR 124 1HB TYR 124 5.364 5.519 0.691 930 HD1 TYR 124 1HD TYR 124 6.523 2.837 0.488 931 HD2 TYR 124 2HD TYR 124 6.904 5.731 3.582 932 HE1 TYR 124 1HE TYR 124 6.966 1.041 2.098 933 HE2 TYR 124 2HE TYR 124 7.347 3.937 5.203 934 HH TYR 124 HH TYR 124 6.599 1.090 5.050 935 H PHE 125 H PHE 125 8.113 7.496 -1.357 936 HA PHE 125 HA PHE 125 5.762 8.226 -2.827 937 HB2 PHE 125 2HB PHE 125 7.398 9.870 -1.829 938 HB3 PHE 125 1HB PHE 125 8.534 9.407 -3.105 939 HD1 PHE 125 1HD PHE 125 4.906 10.277 -2.952 940 HD2 PHE 125 2HD PHE 125 8.683 10.965 -4.783 941 HE1 PHE 125 1HE PHE 125 3.873 11.928 -4.450 942 HE2 PHE 125 2HE PHE 125 7.658 12.620 -6.283 943 HZ PHE 125 HZ PHE 125 5.249 13.101 -6.118 944 H TYR 126 H TYR 126 5.195 7.255 -4.671 945 HA TYR 126 HA TYR 126 7.336 6.334 -6.472 946 HB2 TYR 126 2HB TYR 126 4.735 5.143 -5.678 947 HB3 TYR 126 1HB TYR 126 5.212 4.952 -7.370 948 HD1 TYR 126 2HD TYR 126 6.022 4.090 -3.900 949 HD2 TYR 126 1HD TYR 126 7.121 3.583 -7.973 950 HE1 TYR 126 2HE TYR 126 7.460 2.201 -3.267 951 HE2 TYR 126 1HE TYR 126 8.569 1.696 -7.353 952 HH TYR 126 HH TYR 126 8.367 -0.002 -4.765 953 H VAL 127 H VAL 127 7.436 8.452 -7.375 954 HA VAL 127 HA VAL 127 5.143 9.517 -8.768 955 HB VAL 127 HB VAL 127 6.818 10.990 -7.691 956 HG11 VAL 127 1HG1 VAL 127 9.014 10.990 -8.159 957 HG12 VAL 127 2HG1 VAL 127 8.752 10.730 -9.884 958 HG13 VAL 127 3HG1 VAL 127 8.699 9.365 -8.768 959 HG21 VAL 127 3HG2 VAL 127 5.431 11.450 -9.926 960 HG22 VAL 127 1HG2 VAL 127 7.064 11.695 -10.547 961 HG23 VAL 127 2HG2 VAL 127 6.484 12.651 -9.182 962 H SER 128 H SER 128 5.229 7.203 -9.840 963 HA SER 128 HA SER 128 5.418 7.410 -12.529 964 HB2 SER 128 2HB SER 128 7.677 5.967 -12.776 965 HB3 SER 128 1HB SER 128 7.653 7.736 -12.868 966 HG SER 128 HG SER 128 9.240 6.807 -11.400 967 H ALA 129 H ALA 129 4.756 5.553 -13.566 968 HA ALA 129 HA ALA 129 3.861 3.410 -11.884 969 HB1 ALA 129 1HB ALA 129 2.454 4.145 -13.702 970 HB2 ALA 129 2HB ALA 129 2.921 2.464 -13.953 971 HB3 ALA 129 3HB ALA 129 3.709 3.744 -14.872 972 H GLU 130 H GLU 130 6.497 3.925 -14.108 973 HA GLU 130 HA GLU 130 7.230 1.293 -14.646 974 HB2 GLU 130 2HB GLU 130 9.541 2.239 -14.986 975 HB3 GLU 130 1HB GLU 130 8.253 3.048 -15.888 976 HG2 GLU 130 2HG GLU 130 8.239 4.879 -14.347 977 HG3 GLU 130 1HG GLU 130 9.366 4.039 -13.268 978 H GLN 131 H GLN 131 8.090 3.360 -11.891 979 HA GLN 131 HA GLN 131 9.834 1.378 -10.800 980 HB2 GLN 131 2HB GLN 131 9.431 2.859 -8.668 981 HB3 GLN 131 1HB GLN 131 10.548 3.324 -9.939 982 HG2 GLN 131 2HG GLN 131 8.886 4.801 -10.900 983 HG3 GLN 131 1HG GLN 131 7.707 4.298 -9.690 984 HE21 GLN 131 1HE2 GLN 131 7.460 6.390 -8.917 985 HE22 GLN 131 2HE2 GLN 131 8.675 7.174 -7.971 986 H VAL 132 H VAL 132 6.674 2.651 -9.705 987 HA VAL 132 HA VAL 132 6.265 0.946 -7.588 988 HB VAL 132 HB VAL 132 4.705 2.669 -7.862 989 HG11 VAL 132 1HG1 VAL 132 3.841 3.366 -9.787 990 HG12 VAL 132 2HG1 VAL 132 3.265 1.752 -10.209 991 HG13 VAL 132 3HG1 VAL 132 4.930 2.215 -10.560 992 HG21 VAL 132 3HG2 VAL 132 3.257 0.101 -8.484 993 HG22 VAL 132 1HG2 VAL 132 2.540 1.551 -7.783 994 HG23 VAL 132 2HG2 VAL 132 3.758 0.649 -6.883 995 H VAL 133 H VAL 133 6.215 0.160 -10.958 996 HA VAL 133 HA VAL 133 4.813 -2.327 -10.547 997 HB VAL 133 HB VAL 133 4.676 -1.111 -12.716 998 HG11 VAL 133 1HG1 VAL 133 6.847 -1.878 -14.148 999 HG12 VAL 133 2HG1 VAL 133 7.575 -1.508 -12.586 1000 HG13 VAL 133 3HG1 VAL 133 6.633 -0.281 -13.431 1001 HG21 VAL 133 3HG2 VAL 133 4.613 -3.055 -14.042 1002 HG22 VAL 133 1HG2 VAL 133 4.299 -3.606 -12.395 1003 HG23 VAL 133 2HG2 VAL 133 5.895 -3.830 -13.112 1004 H GLN 134 H GLN 134 8.177 -1.208 -10.708 1005 HA GLN 134 HA GLN 134 9.173 -3.937 -10.831 1006 HB2 GLN 134 2HB GLN 134 11.394 -2.774 -10.201 1007 HB3 GLN 134 1HB GLN 134 10.703 -2.460 -11.784 1008 HG2 GLN 134 2HG GLN 134 9.794 -0.365 -10.987 1009 HG3 GLN 134 1HG GLN 134 10.451 -0.674 -9.381 1010 HE21 GLN 134 1HE2 GLN 134 11.455 -0.455 -12.774 1011 HE22 GLN 134 2HE2 GLN 134 12.983 0.321 -12.450 1012 H GLY 135 H GLY 135 8.411 -1.567 -8.413 1013 HA2 GLY 135 2HA GLY 135 9.653 -2.972 -6.238 1014 HA3 GLY 135 1HA GLY 135 8.495 -1.638 -6.108 1015 H MET 136 H MET 136 6.612 -3.084 -7.938 1016 HA MET 136 HA MET 136 5.279 -4.602 -5.859 1017 HB2 MET 136 2HB MET 136 4.508 -3.267 -8.296 1018 HB3 MET 136 1HB MET 136 3.887 -4.910 -8.292 1019 HG2 MET 136 2HG MET 136 2.175 -4.019 -7.173 1020 HG3 MET 136 1HG MET 136 3.255 -4.127 -5.783 1021 HE1 MET 136 3HE MET 136 4.438 -0.584 -5.151 1022 HE2 MET 136 1HE MET 136 5.359 -1.689 -6.171 1023 HE3 MET 136 2HE MET 136 4.517 -2.299 -4.747 1024 H LYS 137 H LYS 137 6.815 -5.217 -8.975 1025 HA LYS 137 HA LYS 137 6.183 -8.005 -8.989 1026 HB2 LYS 137 2HB LYS 137 7.440 -8.135 -10.990 1027 HB3 LYS 137 1HB LYS 137 6.636 -6.576 -11.024 1028 HG2 LYS 137 2HG LYS 137 8.872 -5.707 -10.022 1029 HG3 LYS 137 1HG LYS 137 9.526 -7.212 -10.668 1030 HD2 LYS 137 2HD LYS 137 8.161 -4.992 -12.181 1031 HD3 LYS 137 1HD LYS 137 9.832 -5.533 -12.334 1032 HE2 LYS 137 2HE LYS 137 7.408 -7.193 -13.017 1033 HE3 LYS 137 1HE LYS 137 8.375 -6.298 -14.186 1034 HZ1 LYS 137 3HZ LYS 137 9.432 -8.444 -12.425 1035 HZ2 LYS 137 1HZ LYS 137 10.269 -7.650 -13.663 1036 HZ3 LYS 137 2HZ LYS 137 8.971 -8.667 -14.037 1037 H GLU 138 H GLU 138 8.518 -6.148 -7.361 1038 HA GLU 138 HA GLU 138 10.522 -8.217 -7.191 1039 HB2 GLU 138 2HB GLU 138 10.941 -5.692 -7.061 1040 HB3 GLU 138 1HB GLU 138 10.321 -5.791 -5.413 1041 HG2 GLU 138 2HG GLU 138 12.095 -7.626 -5.085 1042 HG3 GLU 138 1HG GLU 138 12.817 -6.976 -6.567 1043 H ALA 139 H ALA 139 8.398 -6.617 -4.843 1044 HA ALA 139 HA ALA 139 8.844 -8.493 -2.771 1045 HB1 ALA 139 1HB ALA 139 7.530 -7.158 -1.511 1046 HB2 ALA 139 2HB ALA 139 6.291 -7.022 -2.758 1047 HB3 ALA 139 3HB ALA 139 7.749 -6.035 -2.852 1048 H GLN 140 H GLN 140 7.007 -8.658 -5.611 1049 HA GLN 140 HA GLN 140 4.783 -10.142 -4.884 1050 HB2 GLN 140 2HB GLN 140 6.226 -9.514 -7.318 1051 HB3 GLN 140 1HB GLN 140 5.578 -11.158 -7.364 1052 HG2 GLN 140 2HG GLN 140 3.406 -9.916 -6.492 1053 HG3 GLN 140 1HG GLN 140 4.168 -8.553 -7.313 1054 HE21 GLN 140 1HE2 GLN 140 2.419 -8.566 -8.790 1055 HE22 GLN 140 2HE2 GLN 140 2.362 -9.713 -10.081 1056 H GLU 141 H GLU 141 8.089 -11.109 -4.854 1057 HA GLU 141 HA GLU 141 7.249 -13.913 -4.580 1058 HB2 GLU 141 2HB GLU 141 8.893 -14.596 -5.932 1059 HB3 GLU 141 1HB GLU 141 8.975 -12.907 -6.441 1060 HG2 GLU 141 2HG GLU 141 10.611 -12.632 -4.504 1061 HG3 GLU 141 1HG GLU 141 10.737 -14.386 -4.542 1062 H ARG 142 H ARG 142 9.239 -11.362 -3.225 1063 HA ARG 142 HA ARG 142 10.250 -13.129 -1.155 1064 HB2 ARG 142 2HB ARG 142 11.556 -11.227 -0.406 1065 HB3 ARG 142 1HB ARG 142 11.724 -11.428 -2.154 1066 HG2 ARG 142 2HG ARG 142 10.561 -9.509 -2.624 1067 HG3 ARG 142 1HG ARG 142 9.655 -9.555 -1.101 1068 HD2 ARG 142 2HD ARG 142 11.284 -7.736 -1.104 1069 HD3 ARG 142 1HD ARG 142 11.680 -8.950 0.123 1070 HE ARG 142 HE ARG 142 13.022 -9.333 -2.397 1071 HH11 ARG 142 1HH1 ARG 142 13.149 -7.760 0.716 1072 HH12 ARG 142 2HH1 ARG 142 14.872 -7.594 0.701 1073 HH21 ARG 142 1HH2 ARG 142 15.290 -9.115 -2.418 1074 HH22 ARG 142 2HH2 ARG 142 16.087 -8.363 -1.078 1075 H LEU 143 H LEU 143 7.781 -10.702 -1.541 1076 HA LEU 143 HA LEU 143 7.320 -10.564 1.332 1077 HB2 LEU 143 2HB LEU 143 7.226 -8.516 -0.069 1078 HB3 LEU 143 1HB LEU 143 5.832 -9.194 -0.908 1079 HG LEU 143 HG LEU 143 4.494 -9.083 1.082 1080 HD11 LEU 143 1HD1 LEU 143 7.102 -8.796 2.394 1081 HD12 LEU 143 2HD1 LEU 143 5.602 -9.513 2.983 1082 HD13 LEU 143 3HD1 LEU 143 5.824 -7.764 3.036 1083 HD21 LEU 143 3HD2 LEU 143 4.201 -7.028 0.210 1084 HD22 LEU 143 1HD2 LEU 143 5.932 -6.702 0.124 1085 HD23 LEU 143 2HD2 LEU 143 5.074 -6.516 1.655 1086 H THR 144 H THR 144 5.865 -11.910 -1.563 1087 HA THR 144 HA THR 144 3.353 -12.569 -0.497 1088 HB THR 144 HB THR 144 3.347 -14.296 -2.340 1089 HG1 THR 144 1HG THR 144 5.701 -14.497 -2.310 1090 HG21 THR 144 3HG2 THR 144 2.505 -12.056 -2.769 1091 HG22 THR 144 1HG2 THR 144 3.337 -12.715 -4.178 1092 HG23 THR 144 2HG2 THR 144 4.139 -11.517 -3.161 1093 H GLY 145 H GLY 145 3.863 -13.336 1.638 1094 HA2 GLY 145 2HA GLY 145 3.472 -15.747 2.431 1095 HA3 GLY 145 1HA GLY 145 5.053 -16.031 1.718 1096 H ASP 146 H ASP 146 6.766 -15.842 3.005 1097 HA ASP 146 HA ASP 146 6.813 -13.939 5.179 1098 HB2 ASP 146 2HB ASP 146 6.355 -16.828 5.624 1099 HB3 ASP 146 1HB ASP 146 7.589 -16.089 6.640 1100 H ALA 147 H ALA 147 8.305 -14.611 2.702 1101 HA ALA 147 HA ALA 147 10.887 -15.532 3.645 1102 HB1 ALA 147 1HB ALA 147 11.393 -14.730 1.135 1103 HB2 ALA 147 2HB ALA 147 9.652 -14.983 1.020 1104 HB3 ALA 147 3HB ALA 147 10.704 -16.304 1.529 1105 H PHE 148 H PHE 148 9.257 -12.542 2.984 1106 HA PHE 148 HA PHE 148 11.382 -10.811 2.563 1107 HB2 PHE 148 2HB PHE 148 9.886 -9.044 3.515 1108 HB3 PHE 148 1HB PHE 148 9.121 -10.043 2.272 1109 HD1 PHE 148 2HD PHE 148 7.450 -11.743 2.922 1110 HD2 PHE 148 1HD PHE 148 9.081 -9.003 5.738 1111 HE1 PHE 148 2HE PHE 148 5.599 -12.234 4.466 1112 HE2 PHE 148 1HE PHE 148 7.232 -9.488 7.286 1113 HZ PHE 148 HZ PHE 148 5.487 -11.107 6.652 1114 H ARG 149 H ARG 149 10.069 -12.057 5.601 1115 HA ARG 149 HA ARG 149 11.288 -10.517 7.476 1116 HB2 ARG 149 2HB ARG 149 10.851 -13.482 7.443 1117 HB3 ARG 149 1HB ARG 149 11.355 -12.588 8.869 1118 HG2 ARG 149 2HG ARG 149 8.867 -11.955 7.319 1119 HG3 ARG 149 1HG ARG 149 8.918 -13.035 8.701 1120 HD2 ARG 149 2HD ARG 149 8.315 -11.054 9.687 1121 HD3 ARG 149 1HD ARG 149 10.062 -11.045 9.903 1122 HE ARG 149 HE ARG 149 9.580 -9.744 7.524 1123 HH11 ARG 149 1HH1 ARG 149 8.694 -9.306 10.868 1124 HH12 ARG 149 2HH1 ARG 149 8.584 -7.582 10.744 1125 HH21 ARG 149 1HH2 ARG 149 9.434 -7.477 7.356 1126 HH22 ARG 149 2HH2 ARG 149 9.002 -6.544 8.749 1127 H LYS 150 H LYS 150 13.333 -9.835 7.568 1128 HA LYS 150 HA LYS 150 15.503 -11.297 6.412 1129 HB2 LYS 150 2HB LYS 150 15.187 -8.711 7.854 1130 HB3 LYS 150 1HB LYS 150 16.793 -9.427 7.803 1131 HG2 LYS 150 2HG LYS 150 17.028 -9.086 5.569 1132 HG3 LYS 150 1HG LYS 150 15.297 -9.232 5.252 1133 HD2 LYS 150 2HD LYS 150 15.974 -6.948 4.886 1134 HD3 LYS 150 1HD LYS 150 14.964 -7.024 6.332 1135 HE2 LYS 150 2HE LYS 150 16.648 -6.405 7.694 1136 HE3 LYS 150 1HE LYS 150 17.847 -7.343 6.805 1137 HZ1 LYS 150 3HZ LYS 150 16.747 -4.924 5.563 1138 HZ2 LYS 150 1HZ LYS 150 18.279 -5.624 5.387 1139 HZ3 LYS 150 2HZ LYS 150 17.902 -4.750 6.786 1140 H LYS 151 H LYS 151 17.237 -12.294 7.444 1141 HA LYS 151 HA LYS 151 18.265 -13.594 9.000 1142 HB2 LYS 151 2HB LYS 151 17.709 -11.163 10.259 1143 HB3 LYS 151 1HB LYS 151 17.182 -12.387 11.406 1144 HG2 LYS 151 2HG LYS 151 19.356 -12.154 12.038 1145 HG3 LYS 151 1HG LYS 151 19.522 -13.448 10.851 1146 HD2 LYS 151 2HD LYS 151 20.041 -11.709 9.137 1147 HD3 LYS 151 1HD LYS 151 20.044 -10.507 10.428 1148 HE2 LYS 151 2HE LYS 151 22.100 -11.078 11.078 1149 HE3 LYS 151 1HE LYS 151 21.703 -12.796 11.073 1150 HZ1 LYS 151 3HZ LYS 151 22.261 -12.985 8.825 1151 HZ2 LYS 151 1HZ LYS 151 23.492 -12.027 9.481 1152 HZ3 LYS 151 2HZ LYS 151 22.256 -11.313 8.575 1153 H HIS 152 H HIS 152 17.744 -14.826 11.213 1154 HA HIS 152 HA HIS 152 16.559 -16.508 12.182 1155 HB2 HIS 152 2HB HIS 152 14.151 -14.908 11.289 1156 HB3 HIS 152 1HB HIS 152 14.158 -16.174 12.513 1157 HD1 HIS 152 1HD HIS 152 16.155 -15.517 14.478 1158 HD2 HIS 152 2HD HIS 152 14.137 -12.491 12.471 1159 HE1 HIS 152 1HE HIS 152 16.388 -13.477 15.930 1160 HE2 HIS 152 2HE HIS 152 15.234 -11.638 14.652 1161 H LEU 153 H LEU 153 17.382 -16.830 9.474 1162 HA LEU 153 HA LEU 153 15.669 -19.031 8.746 1163 HB2 LEU 153 2HB LEU 153 15.018 -16.631 7.628 1164 HB3 LEU 153 1HB LEU 153 16.133 -17.270 6.435 1165 HG LEU 153 HG LEU 153 14.083 -19.184 7.315 1166 HD11 LEU 153 1HD1 LEU 153 12.201 -18.152 6.611 1167 HD12 LEU 153 2HD1 LEU 153 13.049 -17.188 5.402 1168 HD13 LEU 153 3HD1 LEU 153 13.087 -16.707 7.097 1169 HD21 LEU 153 3HD2 LEU 153 14.419 -18.416 4.492 1170 HD22 LEU 153 1HD2 LEU 153 14.371 -20.013 5.240 1171 HD23 LEU 153 2HD2 LEU 153 15.854 -19.060 5.290 1172 H GLU 154 H GLU 154 18.356 -16.942 7.737 1173 HA GLU 154 HA GLU 154 19.639 -18.844 6.103 1174 HB2 GLU 154 2HB GLU 154 20.054 -16.177 6.808 1175 HB3 GLU 154 1HB GLU 154 21.488 -17.011 7.389 1176 HG2 GLU 154 2HG GLU 154 22.254 -17.409 5.320 1177 HG3 GLU 154 1HG GLU 154 20.647 -17.739 4.674 1178 H ASP 155 H ASP 155 22.134 -19.286 6.779 1179 HA ASP 155 HA ASP 155 23.514 -20.634 7.981 1180 HB2 ASP 155 2HB ASP 155 22.086 -19.042 10.030 1181 HB3 ASP 155 1HB ASP 155 22.890 -20.499 10.610 1182 H GLU 156 H GLU 156 23.333 -22.351 9.982 1183 HA GLU 156 HA GLU 156 20.891 -23.924 9.563 1184 HB2 GLU 156 2HB GLU 156 22.167 -25.973 9.313 1185 HB3 GLU 156 1HB GLU 156 22.654 -24.806 8.078 1186 HG2 GLU 156 2HG GLU 156 24.161 -25.277 10.642 1187 HG3 GLU 156 1HG GLU 156 24.524 -26.080 9.117 1188 H LEU 157 H LEU 157 23.780 -23.382 11.531 1189 HA LEU 157 HA LEU 157 22.600 -24.853 13.753 1190 HB2 LEU 157 2HB LEU 157 25.190 -24.542 12.891 1191 HB3 LEU 157 1HB LEU 157 25.111 -23.423 14.241 1192 HG LEU 157 HG LEU 157 24.224 -26.284 14.514 1193 HD11 LEU 157 1HD1 LEU 157 26.891 -25.531 15.511 1194 HD12 LEU 157 2HD1 LEU 157 26.742 -25.705 13.762 1195 HD13 LEU 157 3HD1 LEU 157 26.320 -27.050 14.821 1196 HD21 LEU 157 3HD2 LEU 157 25.437 -24.754 16.725 1197 HD22 LEU 157 1HD2 LEU 157 24.063 -25.860 16.725 1198 HD23 LEU 157 2HD2 LEU 157 23.856 -24.199 16.171 Start of MODEL 3 1 H1 MET 1 1HT MET 1 -26.785 -2.401 11.063 2 H2 MET 1 2HT MET 1 -28.218 -3.277 11.415 3 H3 MET 1 3HT MET 1 -28.186 -2.170 10.103 4 HA MET 1 HA MET 1 -26.483 -3.529 9.053 5 HB2 MET 1 2HB MET 1 -26.043 -5.736 9.925 6 HB3 MET 1 1HB MET 1 -25.729 -4.559 11.191 7 HG2 MET 1 2HG MET 1 -27.933 -5.063 12.167 8 HG3 MET 1 1HG MET 1 -28.176 -6.292 10.927 9 HE1 MET 1 2HE MET 1 -25.638 -8.427 10.913 10 HE2 MET 1 3HE MET 1 -27.394 -8.339 10.778 11 HE3 MET 1 1HE MET 1 -26.655 -9.306 12.054 12 H HIS 2 H HIS 2 -29.473 -4.587 10.655 13 HA HIS 2 HA HIS 2 -30.379 -5.739 8.109 14 HB2 HIS 2 2HB HIS 2 -32.059 -6.933 9.437 15 HB3 HIS 2 1HB HIS 2 -30.437 -7.253 10.042 16 HD1 HIS 2 1HD HIS 2 -29.787 -6.082 12.319 17 HD2 HIS 2 2HD HIS 2 -33.787 -5.766 11.239 18 HE1 HIS 2 1HE HIS 2 -30.989 -5.349 14.402 19 HE2 HIS 2 2HE HIS 2 -33.420 -5.240 13.745 20 H HIS 3 H HIS 3 -31.472 -4.328 6.911 21 HA HIS 3 HA HIS 3 -33.717 -2.912 8.118 22 HB2 HIS 3 2HB HIS 3 -31.269 -1.630 7.146 23 HB3 HIS 3 1HB HIS 3 -32.729 -0.985 6.407 24 HD1 HIS 3 1HD HIS 3 -30.865 -1.123 9.618 25 HD2 HIS 3 2HD HIS 3 -34.481 0.340 8.189 26 HE1 HIS 3 1HE HIS 3 -31.723 0.415 11.412 27 HE2 HIS 3 2HE HIS 3 -33.867 1.360 10.485 28 H HIS 4 H HIS 4 -31.935 -3.129 5.030 29 HA HIS 4 HA HIS 4 -34.459 -3.907 3.736 30 HB2 HIS 4 2HB HIS 4 -33.756 -2.574 1.745 31 HB3 HIS 4 1HB HIS 4 -34.107 -1.592 3.162 32 HD1 HIS 4 1HD HIS 4 -32.154 -0.306 4.227 33 HD2 HIS 4 2HD HIS 4 -31.055 -2.615 0.951 34 HE1 HIS 4 1HE HIS 4 -29.826 0.435 3.631 35 HE2 HIS 4 2HE HIS 4 -29.150 -1.037 1.703 36 H HIS 5 H HIS 5 -34.313 -5.750 2.644 37 HA HIS 5 HA HIS 5 -31.811 -7.113 2.398 38 HB2 HIS 5 2HB HIS 5 -34.659 -7.729 1.879 39 HB3 HIS 5 1HB HIS 5 -33.494 -8.619 0.905 40 HD1 HIS 5 1HD HIS 5 -31.816 -10.173 2.210 41 HD2 HIS 5 2HD HIS 5 -34.849 -8.519 4.519 42 HE1 HIS 5 1HE HIS 5 -31.832 -11.496 4.349 43 HE2 HIS 5 2HE HIS 5 -33.729 -10.529 5.696 44 H HIS 6 H HIS 6 -30.374 -6.433 0.940 45 HA HIS 6 HA HIS 6 -30.953 -6.624 -1.843 46 HB2 HIS 6 2HB HIS 6 -31.629 -4.186 -0.798 47 HB3 HIS 6 1HB HIS 6 -29.975 -3.900 -1.325 48 HD1 HIS 6 1HD HIS 6 -29.581 -3.612 -3.797 49 HD2 HIS 6 2HD HIS 6 -33.419 -4.941 -2.919 50 HE1 HIS 6 1HE HIS 6 -30.849 -3.486 -5.965 51 HE2 HIS 6 2HE HIS 6 -33.143 -4.381 -5.428 52 H HIS 7 H HIS 7 -29.054 -6.347 -3.176 53 HA HIS 7 HA HIS 7 -26.577 -6.684 -1.623 54 HB2 HIS 7 2HB HIS 7 -27.712 -8.301 -3.604 55 HB3 HIS 7 1HB HIS 7 -26.371 -7.487 -4.403 56 HD1 HIS 7 1HD HIS 7 -24.158 -7.507 -2.472 57 HD2 HIS 7 2HD HIS 7 -26.820 -10.687 -2.736 58 HE1 HIS 7 1HE HIS 7 -22.947 -9.482 -1.493 59 HE2 HIS 7 2HE HIS 7 -24.606 -11.375 -1.588 60 H MET 8 H MET 8 -25.381 -4.902 -1.581 61 HA MET 8 HA MET 8 -24.486 -3.663 -3.989 62 HB2 MET 8 2HB MET 8 -26.864 -2.684 -3.373 63 HB3 MET 8 1HB MET 8 -25.923 -1.729 -2.219 64 HG2 MET 8 2HG MET 8 -24.952 -0.486 -3.837 65 HG3 MET 8 1HG MET 8 -24.931 -1.808 -5.001 66 HE1 MET 8 3HE MET 8 -27.064 -2.230 -6.806 67 HE2 MET 8 1HE MET 8 -28.666 -1.887 -6.154 68 HE3 MET 8 2HE MET 8 -27.545 -2.906 -5.250 69 H SER 9 H SER 9 -22.525 -2.785 -3.673 70 HA SER 9 HA SER 9 -21.492 -2.738 -0.949 71 HB2 SER 9 2HB SER 9 -20.361 -3.744 -3.136 72 HB3 SER 9 1HB SER 9 -19.773 -2.089 -3.302 73 HG SER 9 HG SER 9 -19.501 -3.600 -0.922 74 H ASP 10 H ASP 10 -19.746 -0.925 -0.625 75 HA ASP 10 HA ASP 10 -21.179 1.583 -0.860 76 HB2 ASP 10 2HB ASP 10 -18.873 0.580 0.735 77 HB3 ASP 10 1HB ASP 10 -18.957 2.312 0.428 78 H GLY 11 H GLY 11 -17.787 0.630 -1.458 79 HA2 GLY 11 2HA GLY 11 -16.591 1.026 -3.454 80 HA3 GLY 11 1HA GLY 11 -17.842 2.155 -3.953 81 H HIS 12 H HIS 12 -17.995 3.886 -1.865 82 HA HIS 12 HA HIS 12 -17.044 5.769 -1.015 83 HB2 HIS 12 2HB HIS 12 -15.387 3.636 -0.249 84 HB3 HIS 12 1HB HIS 12 -14.288 4.898 -0.825 85 HD1 HIS 12 1HD HIS 12 -17.340 4.773 1.467 86 HD2 HIS 12 2HD HIS 12 -13.600 6.559 1.180 87 HE1 HIS 12 1HE HIS 12 -17.096 6.159 3.550 88 HE2 HIS 12 2HE HIS 12 -14.794 7.170 3.392 89 H ASN 13 H ASN 13 -16.919 7.406 -2.398 90 HA ASN 13 HA ASN 13 -15.353 7.260 -4.803 91 HB2 ASN 13 2HB ASN 13 -16.148 9.646 -5.098 92 HB3 ASN 13 1HB ASN 13 -17.420 8.435 -4.967 93 HD21 ASN 13 1HD2 ASN 13 -15.814 11.090 -3.412 94 HD22 ASN 13 2HD2 ASN 13 -16.991 11.341 -2.173 95 H GLY 14 H GLY 14 -13.625 8.641 -5.388 96 HA2 GLY 14 2HA GLY 14 -11.759 9.964 -5.047 97 HA3 GLY 14 1HA GLY 14 -12.395 10.375 -3.452 98 H LEU 15 H LEU 15 -10.885 7.682 -5.232 99 HA LEU 15 HA LEU 15 -9.080 7.246 -3.003 100 HB2 LEU 15 2HB LEU 15 -11.288 5.406 -3.724 101 HB3 LEU 15 1HB LEU 15 -9.732 4.668 -3.394 102 HG LEU 15 HG LEU 15 -9.992 6.339 -1.251 103 HD11 LEU 15 1HD1 LEU 15 -12.742 5.337 -1.970 104 HD12 LEU 15 2HD1 LEU 15 -12.232 7.019 -1.809 105 HD13 LEU 15 3HD1 LEU 15 -12.283 5.974 -0.389 106 HD21 LEU 15 3HD2 LEU 15 -11.265 3.703 -0.933 107 HD22 LEU 15 1HD2 LEU 15 -9.901 4.419 -0.074 108 HD23 LEU 15 2HD2 LEU 15 -9.660 3.693 -1.664 109 H GLY 16 H GLY 16 -10.186 5.488 -5.906 110 HA2 GLY 16 2HA GLY 16 -7.569 5.858 -7.152 111 HA3 GLY 16 1HA GLY 16 -8.029 4.213 -6.745 112 H LYS 17 H LYS 17 -9.679 7.019 -8.204 113 HA LYS 17 HA LYS 17 -10.417 5.275 -10.461 114 HB2 LYS 17 2HB LYS 17 -12.566 6.578 -10.578 115 HB3 LYS 17 1HB LYS 17 -12.409 5.529 -9.175 116 HG2 LYS 17 2HG LYS 17 -11.484 8.296 -8.799 117 HG3 LYS 17 1HG LYS 17 -13.217 8.091 -9.061 118 HD2 LYS 17 2HD LYS 17 -11.794 6.347 -7.095 119 HD3 LYS 17 1HD LYS 17 -12.242 7.994 -6.644 120 HE2 LYS 17 2HE LYS 17 -14.098 5.824 -7.614 121 HE3 LYS 17 1HE LYS 17 -13.973 6.439 -5.966 122 HZ1 LYS 17 3HZ LYS 17 -14.485 8.693 -7.178 123 HZ2 LYS 17 1HZ LYS 17 -15.732 7.645 -6.718 124 HZ3 LYS 17 2HZ LYS 17 -15.196 7.671 -8.322 125 H GLY 18 H GLY 18 -9.666 6.007 -12.330 126 HA2 GLY 18 2HA GLY 18 -9.788 7.892 -13.935 127 HA3 GLY 18 1HA GLY 18 -9.229 8.920 -12.610 128 H PHE 19 H PHE 19 -7.332 6.824 -11.693 129 HA PHE 19 HA PHE 19 -5.348 7.068 -13.858 130 HB2 PHE 19 2HB PHE 19 -3.610 7.295 -12.090 131 HB3 PHE 19 1HB PHE 19 -4.769 8.633 -12.104 132 HD1 PHE 19 2HD PHE 19 -6.608 8.646 -10.399 133 HD2 PHE 19 1HD PHE 19 -3.296 5.990 -10.178 134 HE1 PHE 19 2HE PHE 19 -7.070 8.278 -8.008 135 HE2 PHE 19 1HE PHE 19 -3.747 5.614 -7.788 136 HZ PHE 19 HZ PHE 19 -5.637 6.760 -6.700 137 H GLY 20 H GLY 20 -6.368 4.889 -14.317 138 HA2 GLY 20 2HA GLY 20 -4.972 2.780 -14.396 139 HA3 GLY 20 1HA GLY 20 -5.115 2.809 -12.638 140 H ASP 21 H ASP 21 -6.914 2.028 -11.667 141 HA ASP 21 HA ASP 21 -9.450 1.720 -12.781 142 HB2 ASP 21 2HB ASP 21 -8.127 0.083 -14.231 143 HB3 ASP 21 1HB ASP 21 -7.957 -0.914 -12.779 144 H HIS 22 H HIS 22 -9.043 -1.234 -11.312 145 HA HIS 22 HA HIS 22 -9.962 -0.192 -8.755 146 HB2 HIS 22 2HB HIS 22 -9.504 -3.102 -9.034 147 HB3 HIS 22 1HB HIS 22 -10.902 -2.239 -8.407 148 HD1 HIS 22 1HD HIS 22 -12.779 -1.637 -10.085 149 HD2 HIS 22 2HD HIS 22 -9.598 -3.718 -11.764 150 HE1 HIS 22 1HE HIS 22 -13.580 -2.377 -12.351 151 HE2 HIS 22 2HE HIS 22 -11.650 -3.661 -13.337 152 H ILE 23 H ILE 23 -7.509 -2.441 -9.909 153 HA ILE 23 HA ILE 23 -5.646 -3.292 -8.837 154 HB ILE 23 HB ILE 23 -5.032 -0.348 -9.005 155 HG12 ILE 23 2HG1 ILE 23 -4.212 -1.702 -11.346 156 HG13 ILE 23 1HG1 ILE 23 -5.876 -2.193 -11.043 157 HG21 ILE 23 1HG2 ILE 23 -2.935 -0.891 -8.605 158 HG22 ILE 23 2HG2 ILE 23 -2.947 -2.056 -9.927 159 HG23 ILE 23 3HG2 ILE 23 -3.436 -2.554 -8.307 160 HD11 ILE 23 3HD1 ILE 23 -5.276 0.690 -10.829 161 HD12 ILE 23 1HD1 ILE 23 -6.699 -0.135 -11.464 162 HD13 ILE 23 2HD1 ILE 23 -5.235 -0.027 -12.441 163 H HIS 24 H HIS 24 -4.335 -0.676 -7.276 164 HA HIS 24 HA HIS 24 -4.614 -1.939 -4.718 165 HB2 HIS 24 2HB HIS 24 -3.158 0.639 -5.056 166 HB3 HIS 24 1HB HIS 24 -2.766 -0.761 -4.054 167 HD1 HIS 24 1HD HIS 24 -1.357 0.918 -6.723 168 HD2 HIS 24 2HD HIS 24 -2.288 -3.087 -6.126 169 HE1 HIS 24 1HE HIS 24 0.096 -0.357 -8.328 170 HE2 HIS 24 2HE HIS 24 -0.413 -2.783 -7.879 171 H TRP 25 H TRP 25 -6.978 -0.524 -5.858 172 HA TRP 25 HA TRP 25 -7.559 1.065 -3.487 173 HB2 TRP 25 2HB TRP 25 -8.817 2.582 -5.371 174 HB3 TRP 25 1HB TRP 25 -7.260 2.969 -4.635 175 HD1 TRP 25 HD TRP 25 -8.853 2.045 -7.893 176 HE1 TRP 25 1HE TRP 25 -7.072 2.031 -9.724 177 HE3 TRP 25 3HE TRP 25 -4.680 2.381 -4.989 178 HZ2 TRP 25 2HZ TRP 25 -4.264 2.161 -9.943 179 HZ3 TRP 25 3HZ TRP 25 -2.484 2.435 -6.074 180 HH2 TRP 25 HH TRP 25 -2.273 2.325 -8.508 181 H ARG 26 H ARG 26 -8.515 -1.224 -5.764 182 HA ARG 26 HA ARG 26 -11.125 -1.002 -6.286 183 HB2 ARG 26 2HB ARG 26 -10.080 -3.067 -6.829 184 HB3 ARG 26 1HB ARG 26 -9.630 -3.325 -5.172 185 HG2 ARG 26 2HG ARG 26 -11.333 -4.881 -5.742 186 HG3 ARG 26 1HG ARG 26 -11.986 -3.721 -4.590 187 HD2 ARG 26 2HD ARG 26 -12.278 -3.114 -7.464 188 HD3 ARG 26 1HD ARG 26 -13.258 -4.436 -6.823 189 HE ARG 26 HE ARG 26 -14.135 -2.799 -5.191 190 HH11 ARG 26 1HH1 ARG 26 -12.715 -1.602 -8.155 191 HH12 ARG 26 2HH1 ARG 26 -13.611 -0.124 -8.127 192 HH21 ARG 26 1HH2 ARG 26 -15.308 -0.855 -5.166 193 HH22 ARG 26 2HH2 ARG 26 -15.079 0.302 -6.435 194 H THR 27 H THR 27 -9.854 -1.793 -3.037 195 HA THR 27 HA THR 27 -11.675 -0.399 -1.550 196 HB THR 27 HB THR 27 -12.944 -2.701 -0.786 197 HG1 THR 27 1HG THR 27 -13.306 -3.959 -2.438 198 HG21 THR 27 3HG2 THR 27 -14.771 -1.520 -1.185 199 HG22 THR 27 1HG2 THR 27 -14.433 -1.444 -2.915 200 HG23 THR 27 2HG2 THR 27 -13.713 -0.261 -1.822 201 H LEU 28 H LEU 28 -10.929 -0.338 0.481 202 HA LEU 28 HA LEU 28 -8.695 -1.938 1.217 203 HB2 LEU 28 2HB LEU 28 -8.810 0.327 1.992 204 HB3 LEU 28 1HB LEU 28 -10.371 0.039 2.763 205 HG LEU 28 HG LEU 28 -7.981 -1.522 3.667 206 HD11 LEU 28 1HD1 LEU 28 -7.423 0.957 3.546 207 HD12 LEU 28 2HD1 LEU 28 -7.232 0.168 5.110 208 HD13 LEU 28 3HD1 LEU 28 -8.643 1.178 4.801 209 HD21 LEU 28 3HD2 LEU 28 -9.760 -2.302 4.837 210 HD22 LEU 28 1HD2 LEU 28 -10.670 -0.799 4.671 211 HD23 LEU 28 2HD2 LEU 28 -9.375 -0.919 5.863 212 H GLU 29 H GLU 29 -11.973 -1.675 2.605 213 HA GLU 29 HA GLU 29 -11.835 -3.587 4.552 214 HB2 GLU 29 2HB GLU 29 -13.868 -2.140 3.305 215 HB3 GLU 29 1HB GLU 29 -14.345 -3.823 3.112 216 HG2 GLU 29 2HG GLU 29 -14.255 -4.180 5.482 217 HG3 GLU 29 1HG GLU 29 -13.589 -2.568 5.741 218 H ASP 30 H ASP 30 -12.775 -4.180 1.163 219 HA ASP 30 HA ASP 30 -12.983 -6.984 1.445 220 HB2 ASP 30 2HB ASP 30 -12.977 -5.043 -0.785 221 HB3 ASP 30 1HB ASP 30 -12.471 -6.686 -1.203 222 H GLY 31 H GLY 31 -10.282 -4.869 1.029 223 HA2 GLY 31 2HA GLY 31 -8.452 -6.627 -0.184 224 HA3 GLY 31 1HA GLY 31 -8.029 -5.252 0.841 225 H LYS 32 H LYS 32 -8.779 -5.837 3.288 226 HA LYS 32 HA LYS 32 -6.953 -7.853 4.097 227 HB2 LYS 32 2HB LYS 32 -7.974 -7.417 6.393 228 HB3 LYS 32 1HB LYS 32 -7.211 -6.051 5.590 229 HG2 LYS 32 2HG LYS 32 -9.147 -4.921 5.369 230 HG3 LYS 32 1HG LYS 32 -10.099 -6.383 5.104 231 HD2 LYS 32 2HD LYS 32 -8.972 -6.171 7.796 232 HD3 LYS 32 1HD LYS 32 -10.109 -4.882 7.392 233 HE2 LYS 32 2HE LYS 32 -10.968 -7.580 6.608 234 HE3 LYS 32 1HE LYS 32 -10.809 -7.332 8.346 235 HZ1 LYS 32 3HZ LYS 32 -12.971 -6.692 7.925 236 HZ2 LYS 32 1HZ LYS 32 -12.596 -5.972 6.440 237 HZ3 LYS 32 2HZ LYS 32 -12.162 -5.207 7.883 238 H LYS 33 H LYS 33 -10.443 -7.753 3.718 239 HA LYS 33 HA LYS 33 -11.004 -10.180 5.063 240 HB2 LYS 33 2HB LYS 33 -12.557 -8.205 4.169 241 HB3 LYS 33 1HB LYS 33 -12.733 -9.300 2.805 242 HG2 LYS 33 2HG LYS 33 -13.050 -10.747 5.261 243 HG3 LYS 33 1HG LYS 33 -14.126 -9.339 5.236 244 HD2 LYS 33 2HD LYS 33 -15.488 -10.743 4.107 245 HD3 LYS 33 1HD LYS 33 -14.491 -10.269 2.730 246 HE2 LYS 33 2HE LYS 33 -13.093 -12.229 3.035 247 HE3 LYS 33 1HE LYS 33 -14.012 -12.686 4.468 248 HZ1 LYS 33 3HZ LYS 33 -15.108 -13.945 2.977 249 HZ2 LYS 33 1HZ LYS 33 -14.696 -12.970 1.657 250 HZ3 LYS 33 2HZ LYS 33 -15.964 -12.518 2.680 251 H GLU 34 H GLU 34 -10.277 -9.396 1.700 252 HA GLU 34 HA GLU 34 -10.616 -12.142 0.851 253 HB2 GLU 34 2HB GLU 34 -11.139 -10.076 -0.558 254 HB3 GLU 34 1HB GLU 34 -9.395 -9.905 -0.761 255 HG2 GLU 34 2HG GLU 34 -9.339 -11.463 -2.335 256 HG3 GLU 34 1HG GLU 34 -10.268 -12.599 -1.342 257 H ALA 35 H ALA 35 -8.037 -10.025 1.829 258 HA ALA 35 HA ALA 35 -5.856 -11.390 0.707 259 HB1 ALA 35 1HB ALA 35 -5.285 -9.311 1.510 260 HB2 ALA 35 2HB ALA 35 -4.654 -10.354 2.785 261 HB3 ALA 35 3HB ALA 35 -6.191 -9.520 3.009 262 H ALA 36 H ALA 36 -7.755 -11.976 3.584 263 HA ALA 36 HA ALA 36 -6.012 -13.760 4.889 264 HB1 ALA 36 1HB ALA 36 -8.193 -14.607 5.939 265 HB2 ALA 36 2HB ALA 36 -8.980 -13.340 4.997 266 HB3 ALA 36 3HB ALA 36 -7.757 -12.917 6.195 267 H ALA 37 H ALA 37 -8.754 -14.383 2.703 268 HA ALA 37 HA ALA 37 -8.557 -17.174 2.676 269 HB1 ALA 37 1HB ALA 37 -9.834 -15.126 0.973 270 HB2 ALA 37 2HB ALA 37 -10.518 -16.566 1.726 271 HB3 ALA 37 3HB ALA 37 -9.576 -16.709 0.241 272 H SER 38 H SER 38 -7.642 -15.082 -0.060 273 HA SER 38 HA SER 38 -6.063 -16.992 -1.349 274 HB2 SER 38 2HB SER 38 -6.295 -14.009 -1.511 275 HB3 SER 38 1HB SER 38 -4.969 -14.815 -2.364 276 HG SER 38 HG SER 38 -7.728 -15.436 -2.646 277 H GLY 39 H GLY 39 -5.306 -14.710 1.188 278 HA2 GLY 39 2HA GLY 39 -3.527 -14.762 2.673 279 HA3 GLY 39 1HA GLY 39 -2.853 -16.118 1.764 280 H LEU 40 H LEU 40 -3.739 -13.043 0.312 281 HA LEU 40 HA LEU 40 -0.891 -12.614 -0.280 282 HB2 LEU 40 2HB LEU 40 -1.736 -11.138 -2.123 283 HB3 LEU 40 1HB LEU 40 -2.096 -12.843 -2.304 284 HG LEU 40 HG LEU 40 -4.401 -12.340 -1.402 285 HD11 LEU 40 1HD1 LEU 40 -4.797 -9.731 -2.045 286 HD12 LEU 40 2HD1 LEU 40 -3.206 -9.671 -1.286 287 HD13 LEU 40 3HD1 LEU 40 -4.580 -10.342 -0.406 288 HD21 LEU 40 3HD2 LEU 40 -3.926 -10.763 -3.888 289 HD22 LEU 40 1HD2 LEU 40 -5.221 -11.897 -3.507 290 HD23 LEU 40 2HD2 LEU 40 -3.604 -12.496 -3.875 291 HA PRO 41 HA PRO 41 -0.749 -9.046 2.301 292 HB2 PRO 41 2HB PRO 41 1.004 -7.504 0.845 293 HB3 PRO 41 1HB PRO 41 1.488 -8.825 1.911 294 HG2 PRO 41 2HG PRO 41 1.129 -8.820 -1.059 295 HG3 PRO 41 1HG PRO 41 2.407 -9.574 -0.087 296 HD2 PRO 41 2HD PRO 41 0.381 -11.014 -1.092 297 HD3 PRO 41 1HD PRO 41 1.063 -11.370 0.508 298 H LEU 42 H LEU 42 -1.051 -6.650 2.229 299 HA LEU 42 HA LEU 42 -3.005 -6.003 0.141 300 HB2 LEU 42 2HB LEU 42 -3.160 -4.065 2.171 301 HB3 LEU 42 1HB LEU 42 -4.318 -5.313 1.775 302 HG LEU 42 HG LEU 42 -2.031 -5.911 3.615 303 HD11 LEU 42 1HD1 LEU 42 -3.625 -3.838 4.180 304 HD12 LEU 42 2HD1 LEU 42 -2.989 -4.932 5.409 305 HD13 LEU 42 3HD1 LEU 42 -4.627 -5.153 4.794 306 HD21 LEU 42 3HD2 LEU 42 -3.863 -7.441 4.533 307 HD22 LEU 42 1HD2 LEU 42 -3.174 -7.852 2.962 308 HD23 LEU 42 2HD2 LEU 42 -4.748 -7.062 3.057 309 H MET 43 H MET 43 -3.073 -3.870 -0.681 310 HA MET 43 HA MET 43 -0.418 -2.626 -0.773 311 HB2 MET 43 2HB MET 43 -1.366 -3.613 -2.896 312 HB3 MET 43 1HB MET 43 -2.632 -2.378 -2.835 313 HG2 MET 43 2HG MET 43 -0.722 -1.860 -4.347 314 HG3 MET 43 1HG MET 43 -1.023 -0.637 -3.120 315 HE1 MET 43 3HE MET 43 1.288 -4.133 -2.830 316 HE2 MET 43 1HE MET 43 2.580 -3.315 -3.707 317 HE3 MET 43 2HE MET 43 0.979 -3.460 -4.430 318 H VAL 44 H VAL 44 -0.897 -1.479 1.168 319 HA VAL 44 HA VAL 44 -3.093 0.355 1.278 320 HB VAL 44 HB VAL 44 -0.684 0.067 3.073 321 HG11 VAL 44 1HG1 VAL 44 -1.534 2.334 3.218 322 HG12 VAL 44 2HG1 VAL 44 -1.954 1.441 4.679 323 HG13 VAL 44 3HG1 VAL 44 -3.176 1.730 3.442 324 HG21 VAL 44 3HG2 VAL 44 -1.863 -1.827 3.510 325 HG22 VAL 44 1HG2 VAL 44 -3.401 -1.123 3.021 326 HG23 VAL 44 2HG2 VAL 44 -2.706 -0.721 4.590 327 H ILE 45 H ILE 45 -2.822 1.700 -0.523 328 HA ILE 45 HA ILE 45 -0.451 3.426 -0.520 329 HB ILE 45 HB ILE 45 -2.620 3.221 -2.613 330 HG12 ILE 45 2HG1 ILE 45 0.063 1.860 -2.361 331 HG13 ILE 45 1HG1 ILE 45 -1.527 1.114 -2.574 332 HG21 ILE 45 1HG2 ILE 45 -0.037 4.198 -3.476 333 HG22 ILE 45 2HG2 ILE 45 -0.720 5.201 -2.197 334 HG23 ILE 45 3HG2 ILE 45 -1.635 4.912 -3.677 335 HD11 ILE 45 3HD1 ILE 45 -1.061 2.837 -4.780 336 HD12 ILE 45 1HD1 ILE 45 -1.206 1.079 -4.756 337 HD13 ILE 45 2HD1 ILE 45 0.370 1.837 -4.544 338 H ILE 46 H ILE 46 -0.616 5.338 0.471 339 HA ILE 46 HA ILE 46 -3.258 6.639 0.496 340 HB ILE 46 HB ILE 46 -1.258 6.931 2.727 341 HG12 ILE 46 2HG1 ILE 46 -3.622 5.336 3.336 342 HG13 ILE 46 1HG1 ILE 46 -2.590 4.568 2.132 343 HG21 ILE 46 1HG2 ILE 46 -2.991 7.939 3.929 344 HG22 ILE 46 2HG2 ILE 46 -4.227 7.342 2.823 345 HG23 ILE 46 3HG2 ILE 46 -3.127 8.618 2.306 346 HD11 ILE 46 3HD1 ILE 46 -1.556 5.636 4.738 347 HD12 ILE 46 1HD1 ILE 46 -0.753 4.537 3.614 348 HD13 ILE 46 2HD1 ILE 46 -2.149 3.985 4.542 349 H HIS 47 H HIS 47 -3.297 8.637 -0.282 350 HA HIS 47 HA HIS 47 -0.764 10.116 -0.470 351 HB2 HIS 47 2HB HIS 47 -1.432 10.837 -2.767 352 HB3 HIS 47 1HB HIS 47 -1.058 9.112 -2.634 353 HD1 HIS 47 1HD HIS 47 -3.273 11.083 -4.387 354 HD2 HIS 47 2HD HIS 47 -3.846 7.798 -1.906 355 HE1 HIS 47 1HE HIS 47 -5.509 10.133 -5.035 356 HE2 HIS 47 2HE HIS 47 -5.878 8.211 -3.450 357 H LYS 48 H LYS 48 -0.974 11.987 0.532 358 HA LYS 48 HA LYS 48 -3.576 13.380 0.298 359 HB2 LYS 48 2HB LYS 48 -2.201 12.552 2.673 360 HB3 LYS 48 1HB LYS 48 -2.299 14.304 2.643 361 HG2 LYS 48 2HG LYS 48 -4.574 14.317 2.807 362 HG3 LYS 48 1HG LYS 48 -4.750 12.743 2.023 363 HD2 LYS 48 2HD LYS 48 -4.522 11.607 3.963 364 HD3 LYS 48 1HD LYS 48 -3.323 12.734 4.604 365 HE2 LYS 48 2HE LYS 48 -6.133 13.663 4.314 366 HE3 LYS 48 1HE LYS 48 -5.749 12.559 5.632 367 HZ1 LYS 48 3HZ LYS 48 -3.825 14.248 6.028 368 HZ2 LYS 48 1HZ LYS 48 -5.378 14.573 6.614 369 HZ3 LYS 48 2HZ LYS 48 -4.838 15.312 5.191 370 H SER 49 H SER 49 -3.343 15.788 0.835 371 HA SER 49 HA SER 49 -2.446 17.840 0.398 372 HB2 SER 49 2HB SER 49 -0.404 16.833 1.574 373 HB3 SER 49 1HB SER 49 0.239 16.529 -0.040 374 HG SER 49 HG SER 49 0.754 18.618 1.106 375 H TRP 50 H TRP 50 -0.451 18.581 -1.472 376 HA TRP 50 HA TRP 50 -1.806 18.726 -3.841 377 HB2 TRP 50 2HB TRP 50 0.477 19.032 -4.924 378 HB3 TRP 50 1HB TRP 50 0.118 20.096 -3.557 379 HD1 TRP 50 HD TRP 50 1.454 19.628 -1.262 380 HE1 TRP 50 1HE TRP 50 3.688 18.435 -0.809 381 HE3 TRP 50 3HE TRP 50 1.950 17.123 -5.693 382 HZ2 TRP 50 2HZ TRP 50 5.432 16.666 -2.152 383 HZ3 TRP 50 3HZ TRP 50 3.930 15.702 -6.027 384 HH2 TRP 50 HH TRP 50 5.634 15.480 -4.292 385 H CYS 51 H CYS 51 0.637 16.306 -2.975 386 HA CYS 51 HA CYS 51 1.054 14.210 -3.722 387 HB2 CYS 51 2HB CYS 51 -1.256 13.766 -3.125 388 HB3 CYS 51 1HB CYS 51 -1.812 14.407 -4.667 389 H GLY 52 H GLY 52 2.165 13.435 -5.391 390 HA2 GLY 52 2HA GLY 52 1.577 14.501 -8.089 391 HA3 GLY 52 1HA GLY 52 3.230 14.289 -7.503 392 H ALA 53 H ALA 53 2.803 11.838 -6.148 393 HA ALA 53 HA ALA 53 3.349 9.973 -8.118 394 HB1 ALA 53 1HB ALA 53 3.997 9.320 -5.990 395 HB2 ALA 53 2HB ALA 53 2.589 8.300 -6.288 396 HB3 ALA 53 3HB ALA 53 2.437 9.742 -5.284 397 H CYS 54 H CYS 54 0.333 11.177 -6.982 398 HA CYS 54 HA CYS 54 -1.152 9.042 -8.180 399 HB2 CYS 54 2HB CYS 54 -3.148 10.537 -7.641 400 HB3 CYS 54 1HB CYS 54 -2.186 9.995 -6.259 401 H LYS 55 H LYS 55 -0.294 12.363 -8.938 402 HA LYS 55 HA LYS 55 -1.885 12.647 -11.249 403 HB2 LYS 55 2HB LYS 55 0.504 14.023 -10.122 404 HB3 LYS 55 1HB LYS 55 0.160 14.274 -11.828 405 HG2 LYS 55 2HG LYS 55 -1.722 15.473 -11.423 406 HG3 LYS 55 1HG LYS 55 -2.093 14.591 -9.930 407 HD2 LYS 55 2HD LYS 55 -0.529 15.838 -8.687 408 HD3 LYS 55 1HD LYS 55 0.249 16.467 -10.141 409 HE2 LYS 55 2HE LYS 55 -2.574 17.098 -9.286 410 HE3 LYS 55 1HE LYS 55 -1.178 18.132 -8.980 411 HZ1 LYS 55 3HZ LYS 55 -2.271 18.927 -10.916 412 HZ2 LYS 55 1HZ LYS 55 -2.316 17.388 -11.617 413 HZ3 LYS 55 2HZ LYS 55 -0.839 18.189 -11.430 414 H ALA 56 H ALA 56 1.451 11.562 -10.744 415 HA ALA 56 HA ALA 56 2.059 11.091 -13.471 416 HB1 ALA 56 1HB ALA 56 3.510 11.111 -11.196 417 HB2 ALA 56 2HB ALA 56 4.073 10.419 -12.717 418 HB3 ALA 56 3HB ALA 56 3.379 9.375 -11.476 419 H LEU 57 H LEU 57 -0.007 9.411 -11.340 420 HA LEU 57 HA LEU 57 0.355 6.835 -12.593 421 HB2 LEU 57 2HB LEU 57 -1.615 7.858 -10.560 422 HB3 LEU 57 1HB LEU 57 -1.683 6.236 -11.210 423 HG LEU 57 HG LEU 57 -0.116 7.255 -9.036 424 HD11 LEU 57 1HD1 LEU 57 -1.205 4.776 -10.005 425 HD12 LEU 57 2HD1 LEU 57 -0.821 5.274 -8.359 426 HD13 LEU 57 3HD1 LEU 57 0.425 4.549 -9.373 427 HD21 LEU 57 3HD2 LEU 57 1.675 7.578 -10.652 428 HD22 LEU 57 1HD2 LEU 57 1.479 5.920 -11.221 429 HD23 LEU 57 2HD2 LEU 57 2.041 6.228 -9.579 430 H LYS 58 H LYS 58 -1.904 9.518 -12.833 431 HA LYS 58 HA LYS 58 -4.048 8.404 -14.058 432 HB2 LYS 58 2HB LYS 58 -2.757 11.051 -14.244 433 HB3 LYS 58 1HB LYS 58 -3.922 10.662 -15.503 434 HG2 LYS 58 2HG LYS 58 -5.539 10.071 -13.658 435 HG3 LYS 58 1HG LYS 58 -4.382 10.794 -12.538 436 HD2 LYS 58 2HD LYS 58 -5.333 12.315 -14.936 437 HD3 LYS 58 1HD LYS 58 -6.315 12.247 -13.471 438 HE2 LYS 58 2HE LYS 58 -4.360 13.087 -12.189 439 HE3 LYS 58 1HE LYS 58 -3.487 13.268 -13.710 440 HZ1 LYS 58 3HZ LYS 58 -5.497 14.695 -14.384 441 HZ2 LYS 58 1HZ LYS 58 -4.349 15.363 -13.336 442 HZ3 LYS 58 2HZ LYS 58 -5.816 14.784 -12.726 443 HA PRO 59 HA PRO 59 -2.499 8.430 -18.521 444 HB2 PRO 59 2HB PRO 59 -0.268 9.723 -19.266 445 HB3 PRO 59 1HB PRO 59 -1.811 10.571 -19.025 446 HG2 PRO 59 2HG PRO 59 0.533 10.335 -17.166 447 HG3 PRO 59 1HG PRO 59 -0.426 11.766 -17.584 448 HD2 PRO 59 2HD PRO 59 -0.819 10.330 -15.304 449 HD3 PRO 59 1HD PRO 59 -2.120 11.215 -16.140 450 H LYS 60 H LYS 60 -0.016 8.024 -16.104 451 HA LYS 60 HA LYS 60 1.423 6.152 -17.821 452 HB2 LYS 60 2HB LYS 60 3.061 7.317 -16.772 453 HB3 LYS 60 1HB LYS 60 2.063 7.670 -15.376 454 HG2 LYS 60 2HG LYS 60 3.753 6.300 -14.560 455 HG3 LYS 60 1HG LYS 60 2.372 5.213 -14.739 456 HD2 LYS 60 2HD LYS 60 4.411 4.174 -15.585 457 HD3 LYS 60 1HD LYS 60 3.284 4.481 -16.911 458 HE2 LYS 60 2HE LYS 60 4.953 6.773 -16.549 459 HE3 LYS 60 1HE LYS 60 5.968 5.332 -16.660 460 HZ1 LYS 60 3HZ LYS 60 5.136 4.822 -18.764 461 HZ2 LYS 60 1HZ LYS 60 5.356 6.500 -18.813 462 HZ3 LYS 60 2HZ LYS 60 3.806 5.855 -18.607 463 H PHE 61 H PHE 61 0.120 6.132 -14.475 464 HA PHE 61 HA PHE 61 0.357 3.376 -14.150 465 HB2 PHE 61 2HB PHE 61 -0.148 5.102 -12.341 466 HB3 PHE 61 1HB PHE 61 -1.831 4.982 -12.861 467 HD1 PHE 61 1HD PHE 61 -3.046 2.847 -12.633 468 HD2 PHE 61 2HD PHE 61 0.874 3.379 -11.068 469 HE1 PHE 61 1HE PHE 61 -3.331 0.835 -11.245 470 HE2 PHE 61 2HE PHE 61 0.596 1.370 -9.674 471 HZ PHE 61 HZ PHE 61 -1.509 0.095 -9.764 472 H ALA 62 H ALA 62 -1.824 5.220 -16.060 473 HA ALA 62 HA ALA 62 -4.012 3.485 -16.188 474 HB1 ALA 62 1HB ALA 62 -3.590 4.460 -18.788 475 HB2 ALA 62 2HB ALA 62 -2.975 5.708 -17.698 476 HB3 ALA 62 3HB ALA 62 -4.639 5.142 -17.544 477 H GLU 63 H GLU 63 -0.763 3.166 -17.154 478 HA GLU 63 HA GLU 63 -1.031 1.089 -19.110 479 HB2 GLU 63 2HB GLU 63 0.928 2.820 -18.635 480 HB3 GLU 63 1HB GLU 63 1.479 1.547 -17.540 481 HG2 GLU 63 2HG GLU 63 2.249 0.309 -19.217 482 HG3 GLU 63 1HG GLU 63 0.768 0.506 -20.154 483 H SER 64 H SER 64 -1.245 1.255 -15.763 484 HA SER 64 HA SER 64 -0.125 -1.118 -14.884 485 HB2 SER 64 2HB SER 64 -2.460 0.495 -13.913 486 HB3 SER 64 1HB SER 64 -1.891 -0.926 -13.057 487 HG SER 64 HG SER 64 -0.391 1.408 -13.649 488 H THR 65 H THR 65 -2.305 -1.013 -17.304 489 HA THR 65 HA THR 65 -4.366 -2.730 -16.729 490 HB THR 65 HB THR 65 -2.931 -3.308 -19.258 491 HG1 THR 65 1HG THR 65 -3.904 -0.717 -18.647 492 HG21 THR 65 3HG2 THR 65 -5.082 -2.911 -20.268 493 HG22 THR 65 1HG2 THR 65 -5.723 -2.321 -18.733 494 HG23 THR 65 2HG2 THR 65 -5.248 -4.014 -18.900 495 H GLU 66 H GLU 66 -0.973 -3.410 -17.289 496 HA GLU 66 HA GLU 66 -1.317 -6.271 -17.028 497 HB2 GLU 66 2HB GLU 66 0.727 -4.586 -18.012 498 HB3 GLU 66 1HB GLU 66 1.406 -5.413 -16.608 499 HG2 GLU 66 2HG GLU 66 0.300 -7.509 -17.789 500 HG3 GLU 66 1HG GLU 66 0.521 -6.502 -19.220 501 H ILE 67 H ILE 67 -0.479 -3.498 -15.058 502 HA ILE 67 HA ILE 67 0.429 -5.014 -12.822 503 HB ILE 67 HB ILE 67 -0.803 -2.259 -12.806 504 HG12 ILE 67 2HG1 ILE 67 2.122 -3.017 -12.926 505 HG13 ILE 67 1HG1 ILE 67 1.172 -2.499 -14.328 506 HG21 ILE 67 1HG2 ILE 67 -0.751 -2.687 -10.591 507 HG22 ILE 67 2HG2 ILE 67 0.948 -2.251 -10.775 508 HG23 ILE 67 3HG2 ILE 67 0.470 -3.949 -10.755 509 HD11 ILE 67 3HD1 ILE 67 0.965 -0.635 -12.123 510 HD12 ILE 67 1HD1 ILE 67 1.427 -0.360 -13.801 511 HD13 ILE 67 2HD1 ILE 67 2.635 -0.888 -12.630 512 H SER 68 H SER 68 -2.627 -4.530 -14.237 513 HA SER 68 HA SER 68 -4.278 -4.720 -11.939 514 HB2 SER 68 2HB SER 68 -4.802 -4.200 -14.524 515 HB3 SER 68 1HB SER 68 -5.199 -5.919 -14.509 516 HG SER 68 HG SER 68 -6.500 -3.788 -13.336 517 H GLU 69 H GLU 69 -2.622 -7.001 -13.994 518 HA GLU 69 HA GLU 69 -3.822 -9.316 -12.762 519 HB2 GLU 69 2HB GLU 69 -1.360 -9.281 -14.502 520 HB3 GLU 69 1HB GLU 69 -2.474 -10.615 -14.235 521 HG2 GLU 69 2HG GLU 69 -3.071 -8.073 -15.729 522 HG3 GLU 69 1HG GLU 69 -2.780 -9.660 -16.437 523 H LEU 70 H LEU 70 -0.742 -7.596 -12.707 524 HA LEU 70 HA LEU 70 0.634 -9.316 -10.956 525 HB2 LEU 70 2HB LEU 70 0.889 -6.428 -11.692 526 HB3 LEU 70 1HB LEU 70 1.825 -7.053 -10.336 527 HG LEU 70 HG LEU 70 2.907 -8.673 -11.802 528 HD11 LEU 70 1HD1 LEU 70 1.421 -7.392 -14.089 529 HD12 LEU 70 2HD1 LEU 70 0.945 -8.917 -13.333 530 HD13 LEU 70 3HD1 LEU 70 2.507 -8.783 -14.142 531 HD21 LEU 70 3HD2 LEU 70 4.290 -7.156 -13.019 532 HD22 LEU 70 1HD2 LEU 70 3.801 -6.351 -11.527 533 HD23 LEU 70 2HD2 LEU 70 3.019 -5.934 -13.052 534 H SER 71 H SER 71 -1.889 -7.031 -10.436 535 HA SER 71 HA SER 71 -1.466 -6.428 -7.721 536 HB2 SER 71 2HB SER 71 -3.380 -5.802 -9.677 537 HB3 SER 71 1HB SER 71 -4.261 -6.590 -8.368 538 HG SER 71 HG SER 71 -3.101 -5.078 -6.952 539 H HIS 72 H HIS 72 -2.552 -9.297 -9.271 540 HA HIS 72 HA HIS 72 -4.210 -10.390 -7.296 541 HB2 HIS 72 2HB HIS 72 -2.513 -11.526 -9.485 542 HB3 HIS 72 1HB HIS 72 -3.177 -12.625 -8.268 543 HD1 HIS 72 1HD HIS 72 -5.657 -13.157 -8.403 544 HD2 HIS 72 2HD HIS 72 -4.461 -10.248 -11.120 545 HE1 HIS 72 1HE HIS 72 -7.616 -12.833 -9.945 546 HE2 HIS 72 2HE HIS 72 -6.906 -10.995 -11.516 547 H ASN 73 H ASN 73 -0.927 -9.650 -7.267 548 HA ASN 73 HA ASN 73 -0.033 -11.658 -5.440 549 HB2 ASN 73 2HB ASN 73 1.117 -9.063 -6.452 550 HB3 ASN 73 1HB ASN 73 1.954 -10.081 -5.275 551 HD21 ASN 73 1HD2 ASN 73 0.612 -9.994 -8.527 552 HD22 ASN 73 2HD2 ASN 73 1.617 -11.260 -9.166 553 H PHE 74 H PHE 74 -1.550 -8.575 -5.172 554 HA PHE 74 HA PHE 74 -1.722 -8.829 -2.293 555 HB2 PHE 74 2HB PHE 74 -1.304 -6.172 -2.378 556 HB3 PHE 74 1HB PHE 74 -0.005 -7.341 -2.133 557 HD1 PHE 74 1HD PHE 74 -1.736 -5.411 -4.793 558 HD2 PHE 74 2HD PHE 74 1.812 -7.389 -3.535 559 HE1 PHE 74 1HE PHE 74 -0.558 -4.558 -6.784 560 HE2 PHE 74 2HE PHE 74 2.998 -6.540 -5.514 561 HZ PHE 74 HZ PHE 74 1.815 -5.128 -7.144 562 H VAL 75 H VAL 75 -3.034 -6.209 -1.957 563 HA VAL 75 HA VAL 75 -5.123 -6.281 -3.966 564 HB VAL 75 HB VAL 75 -5.787 -8.023 -2.335 565 HG11 VAL 75 1HG1 VAL 75 -6.425 -7.535 -0.146 566 HG12 VAL 75 2HG1 VAL 75 -6.475 -5.797 -0.447 567 HG13 VAL 75 3HG1 VAL 75 -4.924 -6.633 -0.354 568 HG21 VAL 75 3HG2 VAL 75 -7.304 -6.111 -3.645 569 HG22 VAL 75 1HG2 VAL 75 -7.970 -6.120 -2.014 570 HG23 VAL 75 2HG2 VAL 75 -7.903 -7.612 -2.947 571 H MET 76 H MET 76 -6.421 -4.675 -4.153 572 HA MET 76 HA MET 76 -5.907 -2.139 -4.008 573 HB2 MET 76 2HB MET 76 -8.446 -1.896 -3.845 574 HB3 MET 76 1HB MET 76 -7.782 -2.852 -5.156 575 HG2 MET 76 2HG MET 76 -8.284 -4.421 -2.761 576 HG3 MET 76 1HG MET 76 -9.738 -3.660 -3.388 577 HE1 MET 76 3HE MET 76 -10.312 -6.027 -3.157 578 HE2 MET 76 1HE MET 76 -9.558 -7.385 -3.995 579 HE3 MET 76 2HE MET 76 -10.905 -6.526 -4.742 580 H VAL 77 H VAL 77 -5.119 -0.980 -2.248 581 HA VAL 77 HA VAL 77 -7.079 -0.406 -0.185 582 HB VAL 77 HB VAL 77 -4.264 -1.183 0.586 583 HG11 VAL 77 1HG1 VAL 77 -5.520 -1.097 2.906 584 HG12 VAL 77 2HG1 VAL 77 -6.543 0.052 2.044 585 HG13 VAL 77 3HG1 VAL 77 -4.813 0.353 2.193 586 HG21 VAL 77 3HG2 VAL 77 -5.757 -3.081 -0.060 587 HG22 VAL 77 1HG2 VAL 77 -6.832 -2.599 1.251 588 HG23 VAL 77 2HG2 VAL 77 -5.188 -3.127 1.607 589 H ASN 78 H ASN 78 -6.797 1.428 -1.947 590 HA ASN 78 HA ASN 78 -4.613 3.222 -1.224 591 HB2 ASN 78 2HB ASN 78 -5.604 2.681 -3.659 592 HB3 ASN 78 1HB ASN 78 -6.609 4.060 -3.245 593 HD21 ASN 78 1HD2 ASN 78 -4.832 5.563 -1.775 594 HD22 ASN 78 2HD2 ASN 78 -3.561 6.118 -2.818 595 H LEU 79 H LEU 79 -5.088 4.267 0.637 596 HA LEU 79 HA LEU 79 -7.768 5.288 1.103 597 HB2 LEU 79 2HB LEU 79 -5.333 5.721 2.816 598 HB3 LEU 79 1HB LEU 79 -7.012 5.890 3.286 599 HG LEU 79 HG LEU 79 -5.893 3.238 2.425 600 HD11 LEU 79 1HD1 LEU 79 -5.677 4.600 5.081 601 HD12 LEU 79 2HD1 LEU 79 -4.454 3.697 4.185 602 HD13 LEU 79 3HD1 LEU 79 -5.782 2.843 4.971 603 HD21 LEU 79 3HD2 LEU 79 -7.835 2.966 4.406 604 HD22 LEU 79 1HD2 LEU 79 -8.027 2.666 2.680 605 HD23 LEU 79 2HD2 LEU 79 -8.436 4.244 3.350 606 H GLU 80 H GLU 80 -8.318 7.462 1.301 607 HA GLU 80 HA GLU 80 -6.386 9.343 0.113 608 HB2 GLU 80 2HB GLU 80 -8.793 8.643 -0.941 609 HB3 GLU 80 1HB GLU 80 -9.251 10.052 0.022 610 HG2 GLU 80 2HG GLU 80 -7.079 11.037 -1.205 611 HG3 GLU 80 1HG GLU 80 -7.608 9.865 -2.423 612 H ASP 81 H ASP 81 -7.617 11.708 0.584 613 HA ASP 81 HA ASP 81 -6.758 12.505 3.032 614 HB2 ASP 81 2HB ASP 81 -7.679 13.892 1.051 615 HB3 ASP 81 1HB ASP 81 -9.236 13.737 1.862 616 H GLU 82 H GLU 82 -9.845 11.021 2.287 617 HA GLU 82 HA GLU 82 -11.202 11.602 4.665 618 HB2 GLU 82 2HB GLU 82 -11.865 10.308 2.391 619 HB3 GLU 82 1HB GLU 82 -11.655 8.932 3.466 620 HG2 GLU 82 2HG GLU 82 -13.578 9.323 4.500 621 HG3 GLU 82 1HG GLU 82 -13.213 11.036 4.699 622 H GLU 83 H GLU 83 -8.884 9.087 3.874 623 HA GLU 83 HA GLU 83 -7.867 7.471 5.078 624 HB2 GLU 83 2HB GLU 83 -6.812 8.192 7.070 625 HB3 GLU 83 1HB GLU 83 -6.948 9.613 6.046 626 HG2 GLU 83 2HG GLU 83 -9.172 9.210 7.929 627 HG3 GLU 83 1HG GLU 83 -7.599 9.540 8.661 628 H GLU 84 H GLU 84 -7.897 6.366 7.376 629 HA GLU 84 HA GLU 84 -10.463 6.120 8.607 630 HB2 GLU 84 2HB GLU 84 -9.820 4.395 6.366 631 HB3 GLU 84 1HB GLU 84 -10.106 3.461 7.828 632 HG2 GLU 84 2HG GLU 84 -12.272 4.539 8.106 633 HG3 GLU 84 1HG GLU 84 -11.984 5.499 6.654 634 HA PRO 85 HA PRO 85 -7.350 2.912 10.565 635 HB2 PRO 85 2HB PRO 85 -4.845 3.639 9.164 636 HB3 PRO 85 1HB PRO 85 -5.475 2.037 9.594 637 HG2 PRO 85 2HG PRO 85 -5.491 2.895 7.061 638 HG3 PRO 85 1HG PRO 85 -6.827 1.920 7.716 639 HD2 PRO 85 2HD PRO 85 -6.686 4.875 7.231 640 HD3 PRO 85 1HD PRO 85 -8.032 3.744 6.948 641 H LYS 86 H LYS 86 -5.616 5.773 9.373 642 HA LYS 86 HA LYS 86 -4.582 7.500 10.435 643 HB2 LYS 86 2HB LYS 86 -7.055 7.023 11.832 644 HB3 LYS 86 1HB LYS 86 -5.823 7.587 12.968 645 HG2 LYS 86 2HG LYS 86 -5.398 9.518 11.496 646 HG3 LYS 86 1HG LYS 86 -6.695 8.969 10.435 647 HD2 LYS 86 2HD LYS 86 -7.627 9.076 13.149 648 HD3 LYS 86 1HD LYS 86 -6.905 10.623 12.698 649 HE2 LYS 86 2HE LYS 86 -8.370 10.070 10.485 650 HE3 LYS 86 1HE LYS 86 -9.362 9.321 11.735 651 HZ1 LYS 86 3HZ LYS 86 -9.592 11.360 12.852 652 HZ2 LYS 86 1HZ LYS 86 -9.841 11.722 11.217 653 HZ3 LYS 86 2HZ LYS 86 -8.366 12.101 11.954 654 H ASP 87 H ASP 87 -2.529 7.043 10.922 655 HA ASP 87 HA ASP 87 -1.739 6.447 13.554 656 HB2 ASP 87 2HB ASP 87 -2.549 4.160 12.331 657 HB3 ASP 87 1HB ASP 87 -0.836 4.175 11.891 658 H GLU 88 H GLU 88 0.744 5.346 13.198 659 HA GLU 88 HA GLU 88 2.134 7.524 11.913 660 HB2 GLU 88 2HB GLU 88 2.754 5.466 13.888 661 HB3 GLU 88 1HB GLU 88 4.059 5.712 12.737 662 HG2 GLU 88 2HG GLU 88 2.756 7.925 14.300 663 HG3 GLU 88 1HG GLU 88 4.222 7.085 14.800 664 H ASP 89 H ASP 89 1.175 4.344 11.067 665 HA ASP 89 HA ASP 89 3.169 3.473 9.371 666 HB2 ASP 89 2HB ASP 89 0.234 3.053 9.547 667 HB3 ASP 89 1HB ASP 89 1.001 2.617 8.013 668 H PHE 90 H PHE 90 0.589 5.798 8.729 669 HA PHE 90 HA PHE 90 0.682 6.143 6.035 670 HB2 PHE 90 2HB PHE 90 0.438 8.208 8.219 671 HB3 PHE 90 1HB PHE 90 0.239 8.610 6.508 672 HD1 PHE 90 2HD PHE 90 -1.130 6.587 9.284 673 HD2 PHE 90 1HD PHE 90 -1.760 8.135 5.373 674 HE1 PHE 90 2HE PHE 90 -3.491 5.907 9.401 675 HE2 PHE 90 1HE PHE 90 -4.125 7.460 5.483 676 HZ PHE 90 HZ PHE 90 -4.993 6.344 7.498 677 H SER 91 H SER 91 3.131 7.079 8.327 678 HA SER 91 HA SER 91 4.995 7.583 6.173 679 HB2 SER 91 2HB SER 91 3.884 9.807 6.645 680 HB3 SER 91 1HB SER 91 4.588 9.728 8.268 681 HG SER 91 HG SER 91 5.748 10.797 6.320 682 HA PRO 92 HA PRO 92 6.854 5.443 9.806 683 HB2 PRO 92 2HB PRO 92 8.279 3.887 7.784 684 HB3 PRO 92 1HB PRO 92 7.160 3.329 9.039 685 HG2 PRO 92 2HG PRO 92 6.546 3.286 6.399 686 HG3 PRO 92 1HG PRO 92 5.329 3.510 7.668 687 HD2 PRO 92 2HD PRO 92 6.629 5.555 5.905 688 HD3 PRO 92 1HD PRO 92 4.930 5.418 6.404 689 H ASP 93 H ASP 93 8.824 5.546 6.851 690 HA ASP 93 HA ASP 93 10.825 7.126 8.326 691 HB2 ASP 93 2HB ASP 93 11.058 4.706 6.706 692 HB3 ASP 93 1HB ASP 93 12.154 5.986 6.167 693 H GLY 94 H GLY 94 8.536 8.116 6.824 694 HA2 GLY 94 2HA GLY 94 9.862 9.372 4.512 695 HA3 GLY 94 1HA GLY 94 8.116 9.201 4.725 696 H GLY 95 H GLY 95 7.213 11.127 4.979 697 HA2 GLY 95 2HA GLY 95 7.717 12.789 7.168 698 HA3 GLY 95 1HA GLY 95 8.610 13.437 5.792 699 H TYR 96 H TYR 96 6.850 12.975 3.707 700 HA TYR 96 HA TYR 96 4.953 15.064 4.195 701 HB2 TYR 96 2HB TYR 96 4.400 14.945 1.864 702 HB3 TYR 96 1HB TYR 96 6.155 14.809 2.024 703 HD1 TYR 96 2HD TYR 96 3.055 13.006 1.194 704 HD2 TYR 96 1HD TYR 96 7.304 12.794 1.365 705 HE1 TYR 96 2HE TYR 96 3.006 10.958 -0.167 706 HE2 TYR 96 1HE TYR 96 7.259 10.746 0.014 707 HH TYR 96 HH TYR 96 5.846 9.021 -0.676 708 H ILE 97 H ILE 97 2.655 14.806 3.431 709 HA ILE 97 HA ILE 97 1.580 12.307 4.528 710 HB ILE 97 HB ILE 97 -0.227 13.502 5.513 711 HG12 ILE 97 2HG1 ILE 97 -0.912 15.060 3.829 712 HG13 ILE 97 1HG1 ILE 97 -0.457 15.998 5.250 713 HG21 ILE 97 1HG2 ILE 97 1.841 15.526 6.058 714 HG22 ILE 97 2HG2 ILE 97 2.290 13.838 6.308 715 HG23 ILE 97 3HG2 ILE 97 0.906 14.518 7.163 716 HD11 ILE 97 3HD1 ILE 97 1.772 16.371 4.161 717 HD12 ILE 97 1HD1 ILE 97 0.394 17.136 3.374 718 HD13 ILE 97 2HD1 ILE 97 1.088 15.665 2.696 719 HA PRO 98 HA PRO 98 0.940 10.288 3.874 720 HB2 PRO 98 2HB PRO 98 -1.515 9.568 2.231 721 HB3 PRO 98 1HB PRO 98 -0.821 8.663 3.608 722 HG2 PRO 98 2HG PRO 98 -2.508 10.951 3.691 723 HG3 PRO 98 1HG PRO 98 -1.726 10.104 5.058 724 HD2 PRO 98 2HD PRO 98 -0.945 12.521 4.531 725 HD3 PRO 98 1HD PRO 98 0.302 11.289 4.783 726 H ARG 99 H ARG 99 1.744 8.272 2.983 727 HA ARG 99 HA ARG 99 2.505 8.533 0.141 728 HB2 ARG 99 2HB ARG 99 4.304 7.027 1.944 729 HB3 ARG 99 1HB ARG 99 4.693 8.163 0.649 730 HG2 ARG 99 2HG ARG 99 4.328 10.035 2.084 731 HG3 ARG 99 1HG ARG 99 3.637 9.015 3.341 732 HD2 ARG 99 2HD ARG 99 5.639 8.701 4.224 733 HD3 ARG 99 1HD ARG 99 6.235 8.047 2.701 734 HE ARG 99 HE ARG 99 6.203 10.947 3.227 735 HH11 ARG 99 1HH1 ARG 99 7.897 8.051 2.278 736 HH12 ARG 99 2HH1 ARG 99 9.367 8.880 1.902 737 HH21 ARG 99 1HH2 ARG 99 8.158 12.034 2.754 738 HH22 ARG 99 2HH2 ARG 99 9.512 11.134 2.164 739 H ILE 100 H ILE 100 3.458 6.318 -0.666 740 HA ILE 100 HA ILE 100 1.335 4.386 -0.448 741 HB ILE 100 HB ILE 100 3.985 4.090 -1.870 742 HG12 ILE 100 2HG1 ILE 100 1.374 5.336 -2.704 743 HG13 ILE 100 1HG1 ILE 100 2.996 6.001 -2.833 744 HG21 ILE 100 1HG2 ILE 100 2.021 2.206 -1.346 745 HG22 ILE 100 2HG2 ILE 100 3.285 2.093 -2.568 746 HG23 ILE 100 3HG2 ILE 100 1.696 2.719 -3.001 747 HD11 ILE 100 3HD1 ILE 100 1.574 4.104 -4.608 748 HD12 ILE 100 1HD1 ILE 100 3.322 3.937 -4.450 749 HD13 ILE 100 2HD1 ILE 100 2.629 5.460 -5.003 750 H LEU 101 H LEU 101 1.337 2.446 0.633 751 HA LEU 101 HA LEU 101 3.763 1.749 2.159 752 HB2 LEU 101 2HB LEU 101 0.974 2.204 3.095 753 HB3 LEU 101 1HB LEU 101 1.934 0.985 3.904 754 HG LEU 101 HG LEU 101 3.575 2.653 4.546 755 HD11 LEU 101 1HD1 LEU 101 2.045 4.311 2.650 756 HD12 LEU 101 2HD1 LEU 101 3.766 4.319 3.037 757 HD13 LEU 101 3HD1 LEU 101 2.614 5.109 4.114 758 HD21 LEU 101 3HD2 LEU 101 1.558 4.252 5.585 759 HD22 LEU 101 1HD2 LEU 101 2.230 2.794 6.316 760 HD23 LEU 101 2HD2 LEU 101 0.782 2.693 5.312 761 H PHE 102 H PHE 102 4.414 -0.320 1.727 762 HA PHE 102 HA PHE 102 2.345 -2.237 0.874 763 HB2 PHE 102 2HB PHE 102 4.618 -1.920 -0.346 764 HB3 PHE 102 1HB PHE 102 5.283 -2.822 1.004 765 HD1 PHE 102 2HD PHE 102 3.784 -5.012 1.576 766 HD2 PHE 102 1HD PHE 102 4.185 -3.145 -2.227 767 HE1 PHE 102 2HE PHE 102 3.169 -7.126 0.478 768 HE2 PHE 102 1HE PHE 102 3.569 -5.256 -3.331 769 HZ PHE 102 HZ PHE 102 3.061 -7.250 -1.979 770 H LEU 103 H LEU 103 1.623 -3.803 2.259 771 HA LEU 103 HA LEU 103 3.229 -4.318 4.661 772 HB2 LEU 103 2HB LEU 103 1.494 -3.890 6.155 773 HB3 LEU 103 1HB LEU 103 1.485 -2.537 5.047 774 HG LEU 103 HG LEU 103 -0.485 -4.790 5.254 775 HD11 LEU 103 1HD1 LEU 103 -0.773 -1.794 5.292 776 HD12 LEU 103 2HD1 LEU 103 -0.833 -2.860 6.696 777 HD13 LEU 103 3HD1 LEU 103 -2.082 -2.963 5.455 778 HD21 LEU 103 3HD2 LEU 103 -0.094 -2.848 2.985 779 HD22 LEU 103 1HD2 LEU 103 -1.581 -3.759 3.254 780 HD23 LEU 103 2HD2 LEU 103 -0.077 -4.611 2.912 781 H ASP 104 H ASP 104 2.433 -6.119 5.981 782 HA ASP 104 HA ASP 104 1.988 -8.417 4.330 783 HB2 ASP 104 2HB ASP 104 1.895 -8.428 7.341 784 HB3 ASP 104 1HB ASP 104 2.434 -9.709 6.244 785 HA PRO 105 HA PRO 105 -2.369 -8.932 4.412 786 HB2 PRO 105 2HB PRO 105 -2.512 -11.631 5.085 787 HB3 PRO 105 1HB PRO 105 -2.303 -10.983 3.447 788 HG2 PRO 105 2HG PRO 105 -0.261 -12.053 5.348 789 HG3 PRO 105 1HG PRO 105 -0.358 -12.217 3.578 790 HD2 PRO 105 2HD PRO 105 1.356 -10.510 4.740 791 HD3 PRO 105 1HD PRO 105 0.545 -10.114 3.211 792 H SER 106 H SER 106 -2.869 -7.673 6.191 793 HA SER 106 HA SER 106 -4.388 -8.617 8.189 794 HB2 SER 106 2HB SER 106 -1.515 -8.983 8.880 795 HB3 SER 106 1HB SER 106 -2.560 -8.323 10.150 796 HG SER 106 HG SER 106 -2.290 -10.793 9.686 797 H GLY 107 H GLY 107 -1.964 -6.349 7.204 798 HA2 GLY 107 2HA GLY 107 -2.566 -4.010 7.083 799 HA3 GLY 107 1HA GLY 107 -3.459 -4.221 8.593 800 H LYS 108 H LYS 108 -0.189 -5.368 7.796 801 HA LYS 108 HA LYS 108 0.800 -3.599 9.956 802 HB2 LYS 108 2HB LYS 108 1.392 -6.462 9.327 803 HB3 LYS 108 1HB LYS 108 2.628 -5.478 10.099 804 HG2 LYS 108 2HG LYS 108 0.603 -4.880 11.711 805 HG3 LYS 108 1HG LYS 108 0.049 -6.472 11.160 806 HD2 LYS 108 2HD LYS 108 2.179 -7.452 11.861 807 HD3 LYS 108 1HD LYS 108 2.739 -5.866 12.394 808 HE2 LYS 108 2HE LYS 108 1.951 -6.515 14.396 809 HE3 LYS 108 1HE LYS 108 0.387 -6.053 13.727 810 HZ1 LYS 108 3HZ LYS 108 0.570 -8.553 12.851 811 HZ2 LYS 108 1HZ LYS 108 -0.136 -8.143 14.333 812 HZ3 LYS 108 2HZ LYS 108 1.460 -8.696 14.282 813 H VAL 109 H VAL 109 1.303 -1.967 8.348 814 HA VAL 109 HA VAL 109 3.021 -2.388 6.163 815 HB VAL 109 HB VAL 109 2.486 0.083 7.807 816 HG11 VAL 109 1HG1 VAL 109 3.284 0.873 5.290 817 HG12 VAL 109 2HG1 VAL 109 4.400 -0.420 5.710 818 HG13 VAL 109 3HG1 VAL 109 4.227 0.973 6.774 819 HG21 VAL 109 3HG2 VAL 109 0.893 0.685 6.183 820 HG22 VAL 109 1HG2 VAL 109 0.583 -1.017 6.528 821 HG23 VAL 109 2HG2 VAL 109 1.447 -0.557 5.062 822 H HIS 110 H HIS 110 5.092 -2.614 5.978 823 HA HIS 110 HA HIS 110 6.732 -2.230 8.398 824 HB2 HIS 110 2HB HIS 110 6.742 -4.285 6.251 825 HB3 HIS 110 1HB HIS 110 8.314 -3.763 6.848 826 HD1 HIS 110 1HD HIS 110 5.046 -4.646 8.605 827 HD2 HIS 110 2HD HIS 110 9.107 -5.517 8.734 828 HE1 HIS 110 1HE HIS 110 5.330 -6.243 10.528 829 HE2 HIS 110 2HE HIS 110 7.808 -6.682 10.644 830 HA PRO 111 HA PRO 111 8.565 1.091 6.069 831 HB2 PRO 111 2HB PRO 111 10.716 1.539 7.674 832 HB3 PRO 111 1HB PRO 111 9.082 2.079 8.081 833 HG2 PRO 111 2HG PRO 111 10.570 -0.337 9.031 834 HG3 PRO 111 1HG PRO 111 9.563 0.791 9.956 835 HD2 PRO 111 2HD PRO 111 8.663 -1.626 9.136 836 HD3 PRO 111 1HD PRO 111 7.598 -0.206 9.268 837 H GLU 112 H GLU 112 9.053 -1.615 5.217 838 HA GLU 112 HA GLU 112 11.888 -1.396 4.425 839 HB2 GLU 112 2HB GLU 112 10.318 -3.960 4.719 840 HB3 GLU 112 1HB GLU 112 12.034 -3.805 4.370 841 HG2 GLU 112 2HG GLU 112 12.506 -3.027 6.548 842 HG3 GLU 112 1HG GLU 112 10.796 -2.787 6.908 843 H ILE 113 H ILE 113 8.627 -2.337 3.455 844 HA ILE 113 HA ILE 113 9.493 -2.643 0.692 845 HB ILE 113 HB ILE 113 6.683 -2.907 1.714 846 HG12 ILE 113 2HG1 ILE 113 8.676 -5.155 1.396 847 HG13 ILE 113 1HG1 ILE 113 8.331 -4.378 2.950 848 HG21 ILE 113 1HG2 ILE 113 6.554 -4.468 -0.271 849 HG22 ILE 113 2HG2 ILE 113 8.132 -3.846 -0.753 850 HG23 ILE 113 3HG2 ILE 113 6.747 -2.757 -0.652 851 HD11 ILE 113 3HD1 ILE 113 6.528 -6.056 1.247 852 HD12 ILE 113 1HD1 ILE 113 5.895 -4.988 2.499 853 HD13 ILE 113 2HD1 ILE 113 7.003 -6.290 2.930 854 H ILE 114 H ILE 114 10.040 -0.601 0.153 855 HA ILE 114 HA ILE 114 7.836 1.311 -0.250 856 HB ILE 114 HB ILE 114 9.401 3.146 0.157 857 HG12 ILE 114 2HG1 ILE 114 11.416 1.691 -0.561 858 HG13 ILE 114 1HG1 ILE 114 11.671 2.861 0.722 859 HG21 ILE 114 1HG2 ILE 114 8.112 2.281 2.039 860 HG22 ILE 114 2HG2 ILE 114 9.679 2.910 2.554 861 HG23 ILE 114 3HG2 ILE 114 9.425 1.169 2.426 862 HD11 ILE 114 3HD1 ILE 114 10.849 0.293 1.763 863 HD12 ILE 114 1HD1 ILE 114 12.258 1.277 2.157 864 HD13 ILE 114 2HD1 ILE 114 12.307 0.179 0.778 865 H ASN 115 H ASN 115 9.875 3.119 -1.539 866 HA ASN 115 HA ASN 115 9.985 1.759 -4.130 867 HB2 ASN 115 2HB ASN 115 8.861 3.951 -4.085 868 HB3 ASN 115 1HB ASN 115 10.330 4.686 -3.428 869 HD21 ASN 115 1HD2 ASN 115 9.847 6.032 -5.403 870 HD22 ASN 115 2HD2 ASN 115 10.614 5.534 -6.887 871 H GLU 116 H GLU 116 11.813 0.485 -3.209 872 HA GLU 116 HA GLU 116 14.225 1.522 -2.368 873 HB2 GLU 116 2HB GLU 116 13.494 -0.991 -3.830 874 HB3 GLU 116 1HB GLU 116 15.187 -0.624 -3.479 875 HG2 GLU 116 2HG GLU 116 13.053 -0.665 -1.367 876 HG3 GLU 116 1HG GLU 116 13.975 -2.094 -1.822 877 H ASN 117 H ASN 117 12.866 1.559 -5.540 878 HA ASN 117 HA ASN 117 15.394 2.110 -6.844 879 HB2 ASN 117 2HB ASN 117 13.588 0.808 -7.969 880 HB3 ASN 117 1HB ASN 117 12.593 2.271 -7.979 881 HD21 ASN 117 1HD2 ASN 117 15.688 0.955 -9.057 882 HD22 ASN 117 2HD2 ASN 117 15.803 1.933 -10.496 883 H GLY 118 H GLY 118 13.278 3.905 -5.000 884 HA2 GLY 118 2HA GLY 118 13.491 6.358 -6.559 885 HA3 GLY 118 1HA GLY 118 12.646 6.160 -5.019 886 H ASN 119 H ASN 119 13.752 8.275 -4.642 887 HA ASN 119 HA ASN 119 16.599 8.135 -4.100 888 HB2 ASN 119 2HB ASN 119 16.444 10.506 -3.611 889 HB3 ASN 119 1HB ASN 119 15.579 10.163 -5.117 890 HD21 ASN 119 1HD2 ASN 119 15.339 11.205 -1.840 891 HD22 ASN 119 2HD2 ASN 119 13.656 11.659 -1.885 892 HA PRO 120 HA PRO 120 16.213 7.347 0.227 893 HB2 PRO 120 2HB PRO 120 18.448 8.458 1.208 894 HB3 PRO 120 1HB PRO 120 18.507 7.058 0.119 895 HG2 PRO 120 2HG PRO 120 18.954 9.958 -0.490 896 HG3 PRO 120 1HG PRO 120 19.863 8.537 -1.056 897 HD2 PRO 120 2HD PRO 120 17.935 9.824 -2.535 898 HD3 PRO 120 1HD PRO 120 18.376 8.112 -2.745 899 H SER 121 H SER 121 14.448 9.340 -0.323 900 HA SER 121 HA SER 121 14.212 10.704 2.111 901 HB2 SER 121 2HB SER 121 15.639 12.159 -0.055 902 HB3 SER 121 1HB SER 121 14.387 13.063 0.814 903 HG SER 121 HG SER 121 15.515 12.282 2.771 904 H TYR 122 H TYR 122 12.671 9.112 0.447 905 HA TYR 122 HA TYR 122 10.241 10.524 0.351 906 HB2 TYR 122 2HB TYR 122 11.936 10.662 -2.006 907 HB3 TYR 122 1HB TYR 122 10.372 9.939 -2.372 908 HD1 TYR 122 1HD TYR 122 8.302 11.298 -1.431 909 HD2 TYR 122 2HD TYR 122 12.164 12.948 -2.075 910 HE1 TYR 122 1HE TYR 122 7.315 13.547 -1.527 911 HE2 TYR 122 2HE TYR 122 11.191 15.203 -2.173 912 HH TYR 122 HH TYR 122 8.588 16.136 -1.025 913 H LYS 123 H LYS 123 12.141 7.900 -1.028 914 HA LYS 123 HA LYS 123 11.511 5.769 -1.712 915 HB2 LYS 123 2HB LYS 123 11.155 6.113 1.229 916 HB3 LYS 123 1HB LYS 123 10.737 4.567 0.508 917 HG2 LYS 123 2HG LYS 123 13.418 5.935 0.404 918 HG3 LYS 123 1HG LYS 123 12.988 4.497 1.349 919 HD2 LYS 123 2HD LYS 123 13.688 3.288 -0.386 920 HD3 LYS 123 1HD LYS 123 12.254 3.853 -1.250 921 HE2 LYS 123 2HE LYS 123 13.437 5.235 -2.563 922 HE3 LYS 123 1HE LYS 123 14.496 5.741 -1.248 923 HZ1 LYS 123 3HZ LYS 123 16.048 4.506 -2.213 924 HZ2 LYS 123 1HZ LYS 123 14.945 3.789 -3.276 925 HZ3 LYS 123 2HZ LYS 123 15.183 3.135 -1.733 926 H TYR 124 H TYR 124 9.059 5.849 0.765 927 HA TYR 124 HA TYR 124 7.102 4.429 -0.365 928 HB2 TYR 124 2HB TYR 124 6.627 6.939 1.252 929 HB3 TYR 124 1HB TYR 124 5.482 5.609 1.041 930 HD1 TYR 124 1HD TYR 124 8.742 6.542 2.554 931 HD2 TYR 124 2HD TYR 124 5.628 3.651 2.388 932 HE1 TYR 124 1HE TYR 124 9.677 5.430 4.532 933 HE2 TYR 124 2HE TYR 124 6.556 2.530 4.365 934 HH TYR 124 HH TYR 124 9.655 3.280 5.618 935 H PHE 125 H PHE 125 7.906 7.698 -1.278 936 HA PHE 125 HA PHE 125 5.523 8.252 -2.738 937 HB2 PHE 125 2HB PHE 125 7.166 9.946 -1.841 938 HB3 PHE 125 1HB PHE 125 8.258 9.476 -3.151 939 HD1 PHE 125 2HD PHE 125 4.622 10.325 -2.862 940 HD2 PHE 125 1HD PHE 125 8.322 10.987 -4.852 941 HE1 PHE 125 2HE PHE 125 3.532 11.964 -4.332 942 HE2 PHE 125 1HE PHE 125 7.238 12.630 -6.329 943 HZ PHE 125 HZ PHE 125 4.839 13.119 -6.071 944 H TYR 126 H TYR 126 4.940 7.548 -4.697 945 HA TYR 126 HA TYR 126 7.023 6.443 -6.470 946 HB2 TYR 126 2HB TYR 126 4.598 5.206 -5.401 947 HB3 TYR 126 1HB TYR 126 4.702 5.101 -7.164 948 HD1 TYR 126 1HD TYR 126 7.476 4.673 -7.725 949 HD2 TYR 126 2HD TYR 126 5.172 3.174 -4.483 950 HE1 TYR 126 1HE TYR 126 9.010 2.763 -7.529 951 HE2 TYR 126 2HE TYR 126 6.700 1.258 -4.274 952 HH TYR 126 HH TYR 126 8.731 0.436 -4.904 953 H VAL 127 H VAL 127 7.201 8.123 -7.900 954 HA VAL 127 HA VAL 127 4.727 9.079 -9.178 955 HB VAL 127 HB VAL 127 6.362 10.887 -10.099 956 HG11 VAL 127 1HG1 VAL 127 6.034 12.215 -7.974 957 HG12 VAL 127 2HG1 VAL 127 5.327 10.755 -7.281 958 HG13 VAL 127 3HG1 VAL 127 4.580 11.515 -8.685 959 HG21 VAL 127 3HG2 VAL 127 8.274 9.469 -8.910 960 HG22 VAL 127 1HG2 VAL 127 7.843 10.517 -7.558 961 HG23 VAL 127 2HG2 VAL 127 8.371 11.221 -9.085 962 H SER 128 H SER 128 5.093 6.795 -10.204 963 HA SER 128 HA SER 128 5.374 6.989 -12.885 964 HB2 SER 128 2HB SER 128 7.765 5.784 -13.036 965 HB3 SER 128 1HB SER 128 7.590 7.546 -13.104 966 HG SER 128 HG SER 128 9.185 6.858 -11.592 967 H ALA 129 H ALA 129 3.877 5.395 -12.962 968 HA ALA 129 HA ALA 129 3.624 3.107 -11.521 969 HB1 ALA 129 1HB ALA 129 3.079 3.279 -14.478 970 HB2 ALA 129 2HB ALA 129 2.021 3.924 -13.224 971 HB3 ALA 129 3HB ALA 129 2.322 2.189 -13.317 972 H GLU 130 H GLU 130 5.996 3.732 -13.989 973 HA GLU 130 HA GLU 130 6.708 1.123 -14.678 974 HB2 GLU 130 2HB GLU 130 7.531 3.493 -15.536 975 HB3 GLU 130 1HB GLU 130 8.841 3.194 -14.385 976 HG2 GLU 130 2HG GLU 130 8.066 1.212 -16.509 977 HG3 GLU 130 1HG GLU 130 9.244 2.505 -16.786 978 H GLN 131 H GLN 131 8.308 3.229 -12.263 979 HA GLN 131 HA GLN 131 9.926 1.186 -11.245 980 HB2 GLN 131 2HB GLN 131 10.081 2.632 -9.196 981 HB3 GLN 131 1HB GLN 131 10.615 3.352 -10.709 982 HG2 GLN 131 2HG GLN 131 8.533 4.580 -10.891 983 HG3 GLN 131 1HG GLN 131 7.929 3.808 -9.425 984 HE21 GLN 131 1HE2 GLN 131 7.761 6.336 -9.200 985 HE22 GLN 131 2HE2 GLN 131 9.054 7.052 -8.304 986 H VAL 132 H VAL 132 6.673 2.218 -10.371 987 HA VAL 132 HA VAL 132 6.440 0.852 -7.959 988 HB VAL 132 HB VAL 132 4.185 1.232 -8.014 989 HG11 VAL 132 1HG1 VAL 132 3.766 3.371 -8.920 990 HG12 VAL 132 2HG1 VAL 132 4.979 3.150 -10.178 991 HG13 VAL 132 3HG1 VAL 132 5.477 3.323 -8.497 992 HG21 VAL 132 3HG2 VAL 132 3.141 1.568 -10.507 993 HG22 VAL 132 1HG2 VAL 132 3.077 0.073 -9.578 994 HG23 VAL 132 2HG2 VAL 132 4.337 0.306 -10.784 995 H VAL 133 H VAL 133 6.465 -0.327 -11.220 996 HA VAL 133 HA VAL 133 5.320 -2.880 -10.549 997 HB VAL 133 HB VAL 133 5.217 -1.809 -12.863 998 HG11 VAL 133 1HG1 VAL 133 8.020 -1.966 -12.612 999 HG12 VAL 133 2HG1 VAL 133 7.085 -1.426 -14.004 1000 HG13 VAL 133 3HG1 VAL 133 7.556 -3.119 -13.860 1001 HG21 VAL 133 3HG2 VAL 133 4.948 -3.887 -13.868 1002 HG22 VAL 133 1HG2 VAL 133 4.746 -4.243 -12.152 1003 HG23 VAL 133 2HG2 VAL 133 6.275 -4.608 -12.955 1004 H GLN 134 H GLN 134 8.565 -1.500 -10.775 1005 HA GLN 134 HA GLN 134 9.787 -4.133 -10.639 1006 HB2 GLN 134 2HB GLN 134 11.881 -2.685 -10.053 1007 HB3 GLN 134 1HB GLN 134 11.242 -2.670 -11.690 1008 HG2 GLN 134 2HG GLN 134 10.115 -0.583 -11.267 1009 HG3 GLN 134 1HG GLN 134 10.648 -0.611 -9.588 1010 HE21 GLN 134 1HE2 GLN 134 11.496 0.063 -12.849 1011 HE22 GLN 134 2HE2 GLN 134 13.082 0.713 -12.535 1012 H GLY 135 H GLY 135 8.894 -1.567 -8.451 1013 HA2 GLY 135 2HA GLY 135 10.137 -2.770 -6.149 1014 HA3 GLY 135 1HA GLY 135 8.982 -1.427 -6.145 1015 H MET 136 H MET 136 7.088 -2.980 -7.831 1016 HA MET 136 HA MET 136 5.712 -4.307 -5.667 1017 HB2 MET 136 2HB MET 136 5.069 -3.644 -8.512 1018 HB3 MET 136 1HB MET 136 4.126 -4.882 -7.695 1019 HG2 MET 136 2HG MET 136 3.270 -3.379 -6.138 1020 HG3 MET 136 1HG MET 136 4.519 -2.182 -6.468 1021 HE1 MET 136 3HE MET 136 1.745 -0.781 -6.419 1022 HE2 MET 136 1HE MET 136 1.974 0.117 -7.920 1023 HE3 MET 136 2HE MET 136 3.343 -0.169 -6.845 1024 H LYS 137 H LYS 137 6.836 -5.295 -8.886 1025 HA LYS 137 HA LYS 137 6.391 -8.014 -8.655 1026 HB2 LYS 137 2HB LYS 137 7.898 -8.298 -10.492 1027 HB3 LYS 137 1HB LYS 137 7.034 -6.792 -10.739 1028 HG2 LYS 137 2HG LYS 137 9.094 -5.697 -9.647 1029 HG3 LYS 137 1HG LYS 137 9.894 -7.231 -9.994 1030 HD2 LYS 137 2HD LYS 137 8.632 -5.323 -11.956 1031 HD3 LYS 137 1HD LYS 137 10.332 -5.771 -11.829 1032 HE2 LYS 137 2HE LYS 137 8.140 -7.727 -12.499 1033 HE3 LYS 137 1HE LYS 137 9.062 -6.846 -13.715 1034 HZ1 LYS 137 3HZ LYS 137 10.585 -8.296 -11.692 1035 HZ2 LYS 137 1HZ LYS 137 10.908 -8.074 -13.339 1036 HZ3 LYS 137 2HZ LYS 137 9.773 -9.228 -12.847 1037 H GLU 138 H GLU 138 8.770 -6.057 -7.116 1038 HA GLU 138 HA GLU 138 10.684 -8.091 -6.567 1039 HB2 GLU 138 2HB GLU 138 11.060 -5.573 -6.462 1040 HB3 GLU 138 1HB GLU 138 10.201 -5.608 -4.924 1041 HG2 GLU 138 2HG GLU 138 12.590 -7.350 -5.423 1042 HG3 GLU 138 1HG GLU 138 12.754 -5.670 -4.883 1043 H ALA 139 H ALA 139 8.478 -6.400 -4.363 1044 HA ALA 139 HA ALA 139 8.657 -8.399 -2.343 1045 HB1 ALA 139 1HB ALA 139 6.312 -6.615 -2.327 1046 HB2 ALA 139 2HB ALA 139 7.887 -5.821 -2.337 1047 HB3 ALA 139 3HB ALA 139 7.485 -6.965 -1.057 1048 H GLN 140 H GLN 140 6.897 -8.198 -5.229 1049 HA GLN 140 HA GLN 140 4.493 -9.448 -4.592 1050 HB2 GLN 140 2HB GLN 140 6.079 -8.999 -7.045 1051 HB3 GLN 140 1HB GLN 140 4.895 -10.309 -7.117 1052 HG2 GLN 140 2HG GLN 140 3.185 -8.660 -6.305 1053 HG3 GLN 140 1HG GLN 140 4.390 -7.402 -6.542 1054 HE21 GLN 140 1HE2 GLN 140 3.711 -10.256 -8.514 1055 HE22 GLN 140 2HE2 GLN 140 3.282 -9.386 -9.939 1056 H GLU 141 H GLU 141 7.644 -10.774 -4.561 1057 HA GLU 141 HA GLU 141 6.537 -13.482 -4.689 1058 HB2 GLU 141 2HB GLU 141 8.896 -14.199 -5.171 1059 HB3 GLU 141 1HB GLU 141 8.092 -13.260 -6.440 1060 HG2 GLU 141 2HG GLU 141 9.206 -11.270 -5.708 1061 HG3 GLU 141 1HG GLU 141 9.947 -12.150 -4.380 1062 H ARG 142 H ARG 142 8.846 -11.448 -2.960 1063 HA ARG 142 HA ARG 142 9.389 -13.459 -0.990 1064 HB2 ARG 142 2HB ARG 142 10.550 -11.547 0.211 1065 HB3 ARG 142 1HB ARG 142 11.169 -11.967 -1.389 1066 HG2 ARG 142 2HG ARG 142 11.129 -9.696 -1.551 1067 HG3 ARG 142 1HG ARG 142 9.507 -10.070 -2.156 1068 HD2 ARG 142 2HD ARG 142 9.483 -8.224 -0.540 1069 HD3 ARG 142 1HD ARG 142 8.560 -9.621 0.035 1070 HE ARG 142 HE ARG 142 10.062 -9.861 1.754 1071 HH11 ARG 142 1HH1 ARG 142 11.392 -7.677 -0.620 1072 HH12 ARG 142 2HH1 ARG 142 12.727 -7.205 0.379 1073 HH21 ARG 142 1HH2 ARG 142 11.817 -9.242 3.069 1074 HH22 ARG 142 2HH2 ARG 142 12.967 -8.094 2.472 1075 H LEU 143 H LEU 143 7.027 -10.951 -1.334 1076 HA LEU 143 HA LEU 143 6.336 -11.066 1.499 1077 HB2 LEU 143 2HB LEU 143 6.153 -9.087 -0.505 1078 HB3 LEU 143 1HB LEU 143 4.498 -9.499 -0.056 1079 HG LEU 143 HG LEU 143 5.407 -7.592 1.216 1080 HD11 LEU 143 1HD1 LEU 143 3.793 -8.370 2.549 1081 HD12 LEU 143 2HD1 LEU 143 5.117 -8.974 3.544 1082 HD13 LEU 143 3HD1 LEU 143 4.327 -10.044 2.386 1083 HD21 LEU 143 3HD2 LEU 143 7.657 -7.881 1.534 1084 HD22 LEU 143 1HD2 LEU 143 7.497 -9.599 1.898 1085 HD23 LEU 143 2HD2 LEU 143 7.047 -8.399 3.106 1086 H THR 144 H THR 144 5.119 -12.068 -1.634 1087 HA THR 144 HA THR 144 2.525 -12.806 -0.773 1088 HB THR 144 HB THR 144 2.544 -14.175 -2.891 1089 HG1 THR 144 1HG THR 144 4.781 -14.556 -2.993 1090 HG21 THR 144 3HG2 THR 144 3.351 -11.292 -3.116 1091 HG22 THR 144 1HG2 THR 144 1.711 -11.930 -3.006 1092 HG23 THR 144 2HG2 THR 144 2.693 -12.265 -4.431 1093 H GLY 145 H GLY 145 5.629 -14.414 -0.776 1094 HA2 GLY 145 2HA GLY 145 4.510 -17.014 -0.187 1095 HA3 GLY 145 1HA GLY 145 6.216 -16.594 -0.225 1096 H ASP 146 H ASP 146 7.232 -15.882 1.641 1097 HA ASP 146 HA ASP 146 5.838 -15.285 4.044 1098 HB2 ASP 146 2HB ASP 146 6.684 -18.087 3.553 1099 HB3 ASP 146 1HB ASP 146 7.046 -17.427 5.145 1100 H ALA 147 H ALA 147 8.000 -14.251 2.399 1101 HA ALA 147 HA ALA 147 10.423 -14.634 3.938 1102 HB1 ALA 147 1HB ALA 147 11.511 -13.711 2.194 1103 HB2 ALA 147 2HB ALA 147 10.315 -12.432 1.987 1104 HB3 ALA 147 3HB ALA 147 10.008 -14.042 1.335 1105 H PHE 148 H PHE 148 7.768 -12.417 3.789 1106 HA PHE 148 HA PHE 148 8.905 -10.134 4.924 1107 HB2 PHE 148 2HB PHE 148 6.619 -9.523 5.561 1108 HB3 PHE 148 1HB PHE 148 6.662 -10.179 3.918 1109 HD1 PHE 148 2HD PHE 148 5.765 -12.405 3.452 1110 HD2 PHE 148 1HD PHE 148 5.465 -10.650 7.317 1111 HE1 PHE 148 2HE PHE 148 4.042 -14.052 4.061 1112 HE2 PHE 148 1HE PHE 148 3.741 -12.294 7.934 1113 HZ PHE 148 HZ PHE 148 3.027 -13.997 6.305 1114 H ARG 149 H ARG 149 7.761 -13.108 6.383 1115 HA ARG 149 HA ARG 149 7.744 -12.198 9.061 1116 HB2 ARG 149 2HB ARG 149 7.899 -14.947 7.833 1117 HB3 ARG 149 1HB ARG 149 7.811 -14.678 9.566 1118 HG2 ARG 149 2HG ARG 149 5.695 -13.284 8.963 1119 HG3 ARG 149 1HG ARG 149 5.738 -14.231 7.476 1120 HD2 ARG 149 2HD ARG 149 5.396 -16.237 8.595 1121 HD3 ARG 149 1HD ARG 149 5.941 -15.582 10.139 1122 HE ARG 149 HE ARG 149 3.287 -15.462 9.041 1123 HH11 ARG 149 1HH1 ARG 149 5.539 -13.965 11.247 1124 HH12 ARG 149 2HH1 ARG 149 4.301 -13.253 12.225 1125 HH21 ARG 149 1HH2 ARG 149 1.657 -14.526 10.327 1126 HH22 ARG 149 2HH2 ARG 149 2.097 -13.570 11.704 1127 H LYS 150 H LYS 150 9.186 -13.724 10.620 1128 HA LYS 150 HA LYS 150 11.979 -13.470 9.732 1129 HB2 LYS 150 2HB LYS 150 11.101 -11.658 11.358 1130 HB3 LYS 150 1HB LYS 150 11.159 -12.930 12.569 1131 HG2 LYS 150 2HG LYS 150 13.622 -12.793 11.063 1132 HG3 LYS 150 1HG LYS 150 13.228 -11.244 11.812 1133 HD2 LYS 150 2HD LYS 150 12.687 -13.080 13.804 1134 HD3 LYS 150 1HD LYS 150 14.130 -13.733 13.026 1135 HE2 LYS 150 2HE LYS 150 14.944 -11.237 13.194 1136 HE3 LYS 150 1HE LYS 150 13.749 -11.163 14.487 1137 HZ1 LYS 150 3HZ LYS 150 16.234 -11.891 14.915 1138 HZ2 LYS 150 1HZ LYS 150 15.613 -13.411 14.507 1139 HZ3 LYS 150 2HZ LYS 150 14.950 -12.546 15.800 1140 H LYS 151 H LYS 151 9.758 -14.963 12.040 1141 HA LYS 151 HA LYS 151 11.456 -17.363 12.002 1142 HB2 LYS 151 2HB LYS 151 10.096 -16.178 14.430 1143 HB3 LYS 151 1HB LYS 151 10.927 -17.726 14.393 1144 HG2 LYS 151 2HG LYS 151 12.925 -16.241 13.524 1145 HG3 LYS 151 1HG LYS 151 12.036 -14.973 14.371 1146 HD2 LYS 151 2HD LYS 151 13.293 -15.708 16.114 1147 HD3 LYS 151 1HD LYS 151 11.964 -16.861 16.257 1148 HE2 LYS 151 2HE LYS 151 14.039 -17.710 14.390 1149 HE3 LYS 151 1HE LYS 151 14.629 -17.495 16.038 1150 HZ1 LYS 151 3HZ LYS 151 13.484 -19.728 15.166 1151 HZ2 LYS 151 1HZ LYS 151 12.120 -18.931 15.769 1152 HZ3 LYS 151 2HZ LYS 151 13.439 -19.235 16.783 1153 H HIS 152 H HIS 152 10.149 -18.479 10.602 1154 HA HIS 152 HA HIS 152 7.307 -18.724 11.183 1155 HB2 HIS 152 2HB HIS 152 7.163 -19.907 9.058 1156 HB3 HIS 152 1HB HIS 152 8.047 -18.397 8.852 1157 HD1 HIS 152 1HD HIS 152 10.447 -20.413 10.378 1158 HD2 HIS 152 2HD HIS 152 8.781 -20.380 6.573 1159 HE1 HIS 152 1HE HIS 152 12.083 -21.634 8.920 1160 HE2 HIS 152 2HE HIS 152 11.100 -21.524 6.603 1161 H LEU 153 H LEU 153 9.720 -20.029 12.690 1162 HA LEU 153 HA LEU 153 8.382 -22.604 13.017 1163 HB2 LEU 153 2HB LEU 153 10.855 -22.284 11.676 1164 HB3 LEU 153 1HB LEU 153 11.211 -23.009 13.232 1165 HG LEU 153 HG LEU 153 9.158 -24.578 12.473 1166 HD11 LEU 153 1HD1 LEU 153 9.349 -23.135 10.241 1167 HD12 LEU 153 2HD1 LEU 153 8.899 -24.841 10.238 1168 HD13 LEU 153 3HD1 LEU 153 10.559 -24.367 9.875 1169 HD21 LEU 153 3HD2 LEU 153 10.979 -25.770 13.094 1170 HD22 LEU 153 1HD2 LEU 153 12.098 -24.733 12.210 1171 HD23 LEU 153 2HD2 LEU 153 11.159 -25.954 11.350 1172 H GLU 154 H GLU 154 7.651 -22.141 15.042 1173 HA GLU 154 HA GLU 154 9.654 -22.071 17.146 1174 HB2 GLU 154 2HB GLU 154 8.741 -19.677 16.377 1175 HB3 GLU 154 1HB GLU 154 7.442 -20.114 17.477 1176 HG2 GLU 154 2HG GLU 154 8.936 -18.915 18.795 1177 HG3 GLU 154 1HG GLU 154 9.275 -20.602 19.179 1178 H ASP 155 H ASP 155 6.165 -21.913 16.461 1179 HA ASP 155 HA ASP 155 5.667 -24.288 17.978 1180 HB2 ASP 155 2HB ASP 155 5.706 -21.929 19.457 1181 HB3 ASP 155 1HB ASP 155 3.995 -22.215 19.155 1182 H GLU 156 H GLU 156 4.153 -25.305 16.857 1183 HA GLU 156 HA GLU 156 2.472 -23.873 15.004 1184 HB2 GLU 156 2HB GLU 156 3.208 -26.684 15.514 1185 HB3 GLU 156 1HB GLU 156 1.562 -26.441 14.918 1186 HG2 GLU 156 2HG GLU 156 4.009 -25.315 13.578 1187 HG3 GLU 156 1HG GLU 156 3.285 -26.867 13.160 1188 H LEU 157 H LEU 157 0.267 -23.631 15.082 1189 HA LEU 157 HA LEU 157 -0.963 -24.139 17.705 1190 HB2 LEU 157 2HB LEU 157 -0.777 -21.776 16.707 1191 HB3 LEU 157 1HB LEU 157 -2.038 -22.283 15.600 1192 HG LEU 157 HG LEU 157 -2.540 -22.664 18.506 1193 HD11 LEU 157 1HD1 LEU 157 -3.533 -20.198 18.222 1194 HD12 LEU 157 2HD1 LEU 157 -2.104 -20.050 17.199 1195 HD13 LEU 157 3HD1 LEU 157 -1.935 -20.520 18.891 1196 HD21 LEU 157 3HD2 LEU 157 -4.749 -22.551 17.899 1197 HD22 LEU 157 1HD2 LEU 157 -4.040 -23.213 16.425 1198 HD23 LEU 157 2HD2 LEU 157 -4.431 -21.497 16.522 Start of MODEL 4 1 H1 MET 1 1HT MET 1 -3.083 4.303 19.907 2 H2 MET 1 2HT MET 1 -4.342 4.182 18.749 3 H3 MET 1 3HT MET 1 -2.949 5.123 18.408 4 HA MET 1 HA MET 1 -2.760 3.139 17.229 5 HB2 MET 1 2HB MET 1 -1.077 3.381 19.712 6 HB3 MET 1 1HB MET 1 -0.755 2.137 18.513 7 HG2 MET 1 2HG MET 1 0.593 3.676 17.620 8 HG3 MET 1 1HG MET 1 -0.896 4.324 16.935 9 HE1 MET 1 2HE MET 1 1.869 5.982 17.413 10 HE2 MET 1 3HE MET 1 1.183 7.519 17.940 11 HE3 MET 1 1HE MET 1 0.437 6.628 16.614 12 H HIS 2 H HIS 2 -3.013 2.359 20.701 13 HA HIS 2 HA HIS 2 -3.535 -0.402 20.237 14 HB2 HIS 2 2HB HIS 2 -3.553 1.407 22.610 15 HB3 HIS 2 1HB HIS 2 -4.389 -0.137 22.740 16 HD1 HIS 2 1HD HIS 2 -1.022 0.753 21.191 17 HD2 HIS 2 2HD HIS 2 -2.687 -1.787 24.028 18 HE1 HIS 2 1HE HIS 2 0.879 -0.672 22.016 19 HE2 HIS 2 2HE HIS 2 -0.166 -2.251 23.678 20 H HIS 3 H HIS 3 -5.672 1.965 21.831 21 HA HIS 3 HA HIS 3 -8.008 0.442 21.276 22 HB2 HIS 3 2HB HIS 3 -9.228 2.374 22.192 23 HB3 HIS 3 1HB HIS 3 -7.877 1.918 23.222 24 HD1 HIS 3 1HD HIS 3 -9.329 4.755 21.469 25 HD2 HIS 3 2HD HIS 3 -5.576 3.703 22.908 26 HE1 HIS 3 1HE HIS 3 -8.018 6.899 21.556 27 HE2 HIS 3 2HE HIS 3 -5.721 6.221 22.342 28 H HIS 4 H HIS 4 -9.779 1.003 19.923 29 HA HIS 4 HA HIS 4 -9.560 3.097 17.985 30 HB2 HIS 4 2HB HIS 4 -9.522 1.594 15.999 31 HB3 HIS 4 1HB HIS 4 -8.027 1.557 16.926 32 HD1 HIS 4 1HD HIS 4 -7.148 -0.725 17.212 33 HD2 HIS 4 2HD HIS 4 -11.294 -0.701 16.946 34 HE1 HIS 4 1HE HIS 4 -7.844 -3.138 17.352 35 HE2 HIS 4 2HE HIS 4 -10.361 -3.092 17.272 36 H HIS 5 H HIS 5 -11.488 3.482 16.907 37 HA HIS 5 HA HIS 5 -13.827 2.398 18.145 38 HB2 HIS 5 2HB HIS 5 -13.236 4.501 16.131 39 HB3 HIS 5 1HB HIS 5 -14.849 3.798 16.092 40 HD1 HIS 5 1HD HIS 5 -16.362 5.371 17.248 41 HD2 HIS 5 2HD HIS 5 -12.720 5.007 19.216 42 HE1 HIS 5 1HE HIS 5 -16.575 6.776 19.322 43 HE2 HIS 5 2HE HIS 5 -14.393 6.465 20.542 44 H HIS 6 H HIS 6 -15.726 2.015 16.361 45 HA HIS 6 HA HIS 6 -14.899 -0.435 15.029 46 HB2 HIS 6 2HB HIS 6 -17.313 0.530 16.252 47 HB3 HIS 6 1HB HIS 6 -17.656 0.042 14.596 48 HD1 HIS 6 1HD HIS 6 -15.470 -1.529 17.297 49 HD2 HIS 6 2HD HIS 6 -18.577 -2.489 14.710 50 HE1 HIS 6 1HE HIS 6 -15.922 -3.974 17.668 51 HE2 HIS 6 2HE HIS 6 -17.749 -4.552 16.032 52 H HIS 7 H HIS 7 -17.235 2.047 14.011 53 HA HIS 7 HA HIS 7 -17.616 3.049 12.007 54 HB2 HIS 7 2HB HIS 7 -14.760 3.066 12.374 55 HB3 HIS 7 1HB HIS 7 -15.136 2.887 10.663 56 HD1 HIS 7 1HD HIS 7 -16.993 4.768 9.802 57 HD2 HIS 7 2HD HIS 7 -14.752 5.640 13.191 58 HE1 HIS 7 1HE HIS 7 -17.138 7.263 10.080 59 HE2 HIS 7 2HE HIS 7 -15.705 7.776 12.086 60 H MET 8 H MET 8 -18.958 1.694 10.940 61 HA MET 8 HA MET 8 -17.784 -0.540 9.442 62 HB2 MET 8 2HB MET 8 -20.110 -0.327 11.003 63 HB3 MET 8 1HB MET 8 -20.673 -0.423 9.330 64 HG2 MET 8 2HG MET 8 -20.576 -2.632 9.783 65 HG3 MET 8 1HG MET 8 -18.906 -2.403 9.263 66 HE1 MET 8 3HE MET 8 -21.377 -2.342 11.966 67 HE2 MET 8 1HE MET 8 -20.487 -2.406 13.487 68 HE3 MET 8 2HE MET 8 -20.880 -3.897 12.631 69 H SER 9 H SER 9 -20.230 2.021 9.015 70 HA SER 9 HA SER 9 -19.482 2.118 6.165 71 HB2 SER 9 2HB SER 9 -22.187 2.129 7.457 72 HB3 SER 9 1HB SER 9 -21.952 2.987 5.935 73 HG SER 9 HG SER 9 -21.042 0.944 5.152 74 H ASP 10 H ASP 10 -19.184 4.105 5.257 75 HA ASP 10 HA ASP 10 -19.945 6.514 6.663 76 HB2 ASP 10 2HB ASP 10 -17.553 7.381 6.592 77 HB3 ASP 10 1HB ASP 10 -17.905 6.171 7.823 78 H GLY 11 H GLY 11 -17.900 5.216 4.050 79 HA2 GLY 11 2HA GLY 11 -18.810 7.450 2.351 80 HA3 GLY 11 1HA GLY 11 -17.322 6.545 2.108 81 H HIS 12 H HIS 12 -17.980 6.217 -0.083 82 HA HIS 12 HA HIS 12 -19.938 4.035 -0.345 83 HB2 HIS 12 2HB HIS 12 -20.574 4.971 -2.563 84 HB3 HIS 12 1HB HIS 12 -20.991 6.033 -1.212 85 HD1 HIS 12 1HD HIS 12 -19.695 6.248 -4.470 86 HD2 HIS 12 2HD HIS 12 -18.636 7.987 -0.848 87 HE1 HIS 12 1HE HIS 12 -18.349 8.286 -5.071 88 HE2 HIS 12 2HE HIS 12 -17.798 9.372 -2.865 89 H ASN 13 H ASN 13 -17.852 2.837 -0.078 90 HA ASN 13 HA ASN 13 -16.012 1.734 -0.870 91 HB2 ASN 13 2HB ASN 13 -16.417 0.571 -3.004 92 HB3 ASN 13 1HB ASN 13 -17.823 0.511 -1.948 93 HD21 ASN 13 1HD2 ASN 13 -16.590 1.473 -4.969 94 HD22 ASN 13 2HD2 ASN 13 -18.034 2.189 -5.593 95 H GLY 14 H GLY 14 -14.366 3.233 -0.904 96 HA2 GLY 14 2HA GLY 14 -13.998 5.274 -2.776 97 HA3 GLY 14 1HA GLY 14 -12.706 4.512 -1.840 98 H LEU 15 H LEU 15 -11.538 5.036 -3.905 99 HA LEU 15 HA LEU 15 -11.117 2.669 -5.379 100 HB2 LEU 15 2HB LEU 15 -13.020 4.618 -6.476 101 HB3 LEU 15 1HB LEU 15 -11.753 4.140 -7.591 102 HG LEU 15 HG LEU 15 -12.895 1.826 -6.284 103 HD11 LEU 15 1HD1 LEU 15 -14.868 3.369 -6.192 104 HD12 LEU 15 2HD1 LEU 15 -15.114 1.897 -7.131 105 HD13 LEU 15 3HD1 LEU 15 -14.817 3.428 -7.954 106 HD21 LEU 15 3HD2 LEU 15 -11.625 2.360 -8.605 107 HD22 LEU 15 1HD2 LEU 15 -13.298 2.284 -9.162 108 HD23 LEU 15 2HD2 LEU 15 -12.586 0.909 -8.316 109 H GLY 16 H GLY 16 -9.809 3.359 -7.543 110 HA2 GLY 16 2HA GLY 16 -7.761 5.235 -6.565 111 HA3 GLY 16 1HA GLY 16 -7.462 3.931 -7.698 112 H LYS 17 H LYS 17 -10.168 6.168 -7.832 113 HA LYS 17 HA LYS 17 -9.949 6.730 -10.536 114 HB2 LYS 17 2HB LYS 17 -11.323 8.022 -8.233 115 HB3 LYS 17 1HB LYS 17 -11.197 8.945 -9.725 116 HG2 LYS 17 2HG LYS 17 -12.075 6.586 -10.691 117 HG3 LYS 17 1HG LYS 17 -12.821 6.578 -9.093 118 HD2 LYS 17 2HD LYS 17 -13.063 9.157 -10.408 119 HD3 LYS 17 1HD LYS 17 -13.784 7.853 -11.355 120 HE2 LYS 17 2HE LYS 17 -15.578 8.256 -10.051 121 HE3 LYS 17 1HE LYS 17 -14.714 7.235 -8.903 122 HZ1 LYS 17 3HZ LYS 17 -13.720 9.320 -7.999 123 HZ2 LYS 17 1HZ LYS 17 -15.392 9.183 -7.766 124 HZ3 LYS 17 2HZ LYS 17 -14.787 10.198 -8.975 125 H GLY 18 H GLY 18 -8.796 8.104 -11.746 126 HA2 GLY 18 2HA GLY 18 -7.743 10.307 -11.972 127 HA3 GLY 18 1HA GLY 18 -7.103 10.079 -10.339 128 H PHE 19 H PHE 19 -6.634 7.154 -11.168 129 HA PHE 19 HA PHE 19 -4.679 7.175 -13.216 130 HB2 PHE 19 2HB PHE 19 -2.783 6.589 -11.497 131 HB3 PHE 19 1HB PHE 19 -3.134 8.275 -11.894 132 HD1 PHE 19 2HD PHE 19 -4.285 9.708 -10.309 133 HD2 PHE 19 1HD PHE 19 -3.254 5.700 -9.329 134 HE1 PHE 19 2HE PHE 19 -4.653 10.203 -7.925 135 HE2 PHE 19 1HE PHE 19 -3.621 6.184 -6.942 136 HZ PHE 19 HZ PHE 19 -4.320 8.439 -6.237 137 H GLY 20 H GLY 20 -5.890 5.339 -13.794 138 HA2 GLY 20 2HA GLY 20 -5.289 2.932 -13.829 139 HA3 GLY 20 1HA GLY 20 -5.390 2.988 -12.070 140 H ASP 21 H ASP 21 -7.149 2.032 -11.322 141 HA ASP 21 HA ASP 21 -9.753 2.789 -11.918 142 HB2 ASP 21 2HB ASP 21 -8.660 0.753 -13.735 143 HB3 ASP 21 1HB ASP 21 -10.193 0.294 -12.980 144 H HIS 22 H HIS 22 -9.000 -0.644 -11.738 145 HA HIS 22 HA HIS 22 -9.735 -0.606 -8.882 146 HB2 HIS 22 2HB HIS 22 -10.726 -2.882 -9.293 147 HB3 HIS 22 1HB HIS 22 -11.578 -1.563 -10.085 148 HD1 HIS 22 1HD HIS 22 -11.283 -1.375 -12.697 149 HD2 HIS 22 2HD HIS 22 -9.679 -4.802 -10.981 150 HE1 HIS 22 1HE HIS 22 -10.862 -2.952 -14.611 151 HE2 HIS 22 2HE HIS 22 -9.827 -4.992 -13.556 152 H ILE 23 H ILE 23 -7.724 -0.761 -7.996 153 HA ILE 23 HA ILE 23 -6.308 -3.279 -8.386 154 HB ILE 23 HB ILE 23 -5.049 -0.571 -8.836 155 HG12 ILE 23 2HG1 ILE 23 -4.323 -2.093 -10.949 156 HG13 ILE 23 1HG1 ILE 23 -5.894 -2.796 -10.584 157 HG21 ILE 23 1HG2 ILE 23 -3.835 -2.804 -7.674 158 HG22 ILE 23 2HG2 ILE 23 -3.066 -1.344 -8.292 159 HG23 ILE 23 3HG2 ILE 23 -3.261 -2.746 -9.340 160 HD11 ILE 23 3HD1 ILE 23 -5.436 -0.579 -12.124 161 HD12 ILE 23 1HD1 ILE 23 -5.925 0.110 -10.575 162 HD13 ILE 23 2HD1 ILE 23 -6.980 -1.036 -11.406 163 H HIS 24 H HIS 24 -4.712 -0.510 -6.992 164 HA HIS 24 HA HIS 24 -4.661 -1.800 -4.404 165 HB2 HIS 24 2HB HIS 24 -3.461 0.893 -4.927 166 HB3 HIS 24 1HB HIS 24 -2.902 -0.390 -3.852 167 HD1 HIS 24 1HD HIS 24 -1.847 1.220 -6.752 168 HD2 HIS 24 2HD HIS 24 -2.182 -2.788 -5.714 169 HE1 HIS 24 1HE HIS 24 -0.278 -0.002 -8.284 170 HE2 HIS 24 2HE HIS 24 -0.610 -2.434 -7.738 171 H TRP 25 H TRP 25 -7.193 -0.764 -5.371 172 HA TRP 25 HA TRP 25 -7.897 0.888 -3.093 173 HB2 TRP 25 2HB TRP 25 -9.279 2.195 -5.077 174 HB3 TRP 25 1HB TRP 25 -7.809 2.784 -4.306 175 HD1 TRP 25 HD TRP 25 -9.108 1.346 -7.551 176 HE1 TRP 25 1HE TRP 25 -7.272 1.531 -9.324 177 HE3 TRP 25 3HE TRP 25 -5.220 2.760 -4.569 178 HZ2 TRP 25 2HZ TRP 25 -4.532 2.191 -9.464 179 HZ3 TRP 25 3HZ TRP 25 -3.032 3.141 -5.586 180 HH2 TRP 25 HH TRP 25 -2.682 2.863 -7.990 181 H ARG 26 H ARG 26 -8.670 -1.524 -5.363 182 HA ARG 26 HA ARG 26 -11.316 -1.394 -5.828 183 HB2 ARG 26 2HB ARG 26 -10.172 -3.939 -4.712 184 HB3 ARG 26 1HB ARG 26 -11.457 -3.754 -5.901 185 HG2 ARG 26 2HG ARG 26 -9.468 -2.567 -7.236 186 HG3 ARG 26 1HG ARG 26 -8.520 -3.672 -6.240 187 HD2 ARG 26 2HD ARG 26 -9.271 -4.515 -8.526 188 HD3 ARG 26 1HD ARG 26 -9.565 -5.566 -7.132 189 HE ARG 26 HE ARG 26 -11.769 -3.835 -7.853 190 HH11 ARG 26 1HH1 ARG 26 -10.278 -6.963 -8.286 191 HH12 ARG 26 2HH1 ARG 26 -11.746 -7.731 -8.786 192 HH21 ARG 26 1HH2 ARG 26 -13.698 -4.847 -8.512 193 HH22 ARG 26 2HH2 ARG 26 -13.687 -6.531 -8.916 194 H THR 27 H THR 27 -9.884 -2.031 -2.647 195 HA THR 27 HA THR 27 -11.917 -1.013 -1.137 196 HB THR 27 HB THR 27 -12.718 -3.514 -0.360 197 HG1 THR 27 1HG THR 27 -12.140 -4.748 -1.981 198 HG21 THR 27 3HG2 THR 27 -14.737 -2.693 -0.727 199 HG22 THR 27 1HG2 THR 27 -14.450 -2.568 -2.462 200 HG23 THR 27 2HG2 THR 27 -13.946 -1.263 -1.388 201 H LEU 28 H LEU 28 -11.037 -0.702 0.791 202 HA LEU 28 HA LEU 28 -8.592 -1.914 1.535 203 HB2 LEU 28 2HB LEU 28 -9.315 0.371 2.200 204 HB3 LEU 28 1HB LEU 28 -10.512 -0.357 3.272 205 HG LEU 28 HG LEU 28 -7.612 -1.044 3.589 206 HD11 LEU 28 1HD1 LEU 28 -7.932 1.470 3.493 207 HD12 LEU 28 2HD1 LEU 28 -7.194 0.822 4.958 208 HD13 LEU 28 3HD1 LEU 28 -8.892 1.299 4.962 209 HD21 LEU 28 3HD2 LEU 28 -8.957 -2.381 4.934 210 HD22 LEU 28 1HD2 LEU 28 -10.077 -1.066 5.292 211 HD23 LEU 28 2HD2 LEU 28 -8.468 -1.079 6.019 212 H GLU 29 H GLU 29 -11.893 -2.253 2.820 213 HA GLU 29 HA GLU 29 -11.294 -4.144 4.799 214 HB2 GLU 29 2HB GLU 29 -13.488 -2.773 4.249 215 HB3 GLU 29 1HB GLU 29 -13.923 -4.242 3.387 216 HG2 GLU 29 2HG GLU 29 -13.374 -5.465 5.559 217 HG3 GLU 29 1HG GLU 29 -13.413 -3.872 6.315 218 H ASP 30 H ASP 30 -12.832 -4.738 1.629 219 HA ASP 30 HA ASP 30 -12.690 -7.515 1.705 220 HB2 ASP 30 2HB ASP 30 -13.092 -5.465 -0.381 221 HB3 ASP 30 1HB ASP 30 -12.484 -7.019 -0.967 222 H GLY 31 H GLY 31 -10.238 -5.158 0.997 223 HA2 GLY 31 2HA GLY 31 -8.428 -6.768 -0.430 224 HA3 GLY 31 1HA GLY 31 -7.999 -5.353 0.535 225 H LYS 32 H LYS 32 -8.877 -6.302 3.050 226 HA LYS 32 HA LYS 32 -6.599 -7.803 3.828 227 HB2 LYS 32 2HB LYS 32 -7.688 -6.188 5.323 228 HB3 LYS 32 1HB LYS 32 -9.131 -7.192 5.367 229 HG2 LYS 32 2HG LYS 32 -7.823 -8.989 6.420 230 HG3 LYS 32 1HG LYS 32 -6.408 -7.935 6.419 231 HD2 LYS 32 2HD LYS 32 -7.126 -7.402 8.492 232 HD3 LYS 32 1HD LYS 32 -8.221 -6.327 7.619 233 HE2 LYS 32 2HE LYS 32 -9.826 -8.325 7.560 234 HE3 LYS 32 1HE LYS 32 -8.785 -9.029 8.799 235 HZ1 LYS 32 3HZ LYS 32 -9.156 -6.729 9.931 236 HZ2 LYS 32 1HZ LYS 32 -10.324 -7.944 10.069 237 HZ3 LYS 32 2HZ LYS 32 -10.540 -6.684 8.963 238 H LYS 33 H LYS 33 -10.070 -8.628 3.831 239 HA LYS 33 HA LYS 33 -9.750 -11.312 4.576 240 HB2 LYS 33 2HB LYS 33 -11.903 -10.143 4.683 241 HB3 LYS 33 1HB LYS 33 -11.947 -10.047 2.928 242 HG2 LYS 33 2HG LYS 33 -11.571 -12.770 3.699 243 HG3 LYS 33 1HG LYS 33 -12.942 -12.090 4.593 244 HD2 LYS 33 2HD LYS 33 -14.212 -11.905 2.741 245 HD3 LYS 33 1HD LYS 33 -12.854 -11.398 1.736 246 HE2 LYS 33 2HE LYS 33 -12.087 -13.859 1.945 247 HE3 LYS 33 1HE LYS 33 -13.750 -14.167 2.446 248 HZ1 LYS 33 3HZ LYS 33 -13.023 -12.800 -0.085 249 HZ2 LYS 33 1HZ LYS 33 -14.554 -13.352 0.380 250 HZ3 LYS 33 2HZ LYS 33 -13.326 -14.460 0.030 251 H GLU 34 H GLU 34 -9.520 -9.716 1.477 252 HA GLU 34 HA GLU 34 -9.599 -12.113 -0.084 253 HB2 GLU 34 2HB GLU 34 -10.229 -9.942 -1.036 254 HB3 GLU 34 1HB GLU 34 -8.586 -9.352 -0.789 255 HG2 GLU 34 2HG GLU 34 -7.773 -10.448 -2.582 256 HG3 GLU 34 1HG GLU 34 -8.857 -11.831 -2.367 257 H ALA 35 H ALA 35 -7.027 -9.999 1.124 258 HA ALA 35 HA ALA 35 -4.852 -11.216 -0.118 259 HB1 ALA 35 1HB ALA 35 -3.552 -10.333 1.882 260 HB2 ALA 35 2HB ALA 35 -5.099 -9.738 2.487 261 HB3 ALA 35 3HB ALA 35 -4.471 -9.154 0.946 262 H ALA 36 H ALA 36 -6.781 -12.271 2.565 263 HA ALA 36 HA ALA 36 -4.964 -14.073 3.749 264 HB1 ALA 36 1HB ALA 36 -6.809 -13.525 5.063 265 HB2 ALA 36 2HB ALA 36 -7.136 -15.185 4.562 266 HB3 ALA 36 3HB ALA 36 -7.953 -13.844 3.760 267 H ALA 37 H ALA 37 -7.458 -14.523 1.259 268 HA ALA 37 HA ALA 37 -7.235 -17.278 0.937 269 HB1 ALA 37 1HB ALA 37 -8.103 -15.057 -0.859 270 HB2 ALA 37 2HB ALA 37 -9.048 -16.372 -0.159 271 HB3 ALA 37 3HB ALA 37 -7.949 -16.693 -1.501 272 H SER 38 H SER 38 -5.886 -14.922 -1.372 273 HA SER 38 HA SER 38 -4.083 -16.776 -2.509 274 HB2 SER 38 2HB SER 38 -2.975 -14.481 -3.283 275 HB3 SER 38 1HB SER 38 -4.504 -15.051 -3.973 276 HG SER 38 HG SER 38 -4.131 -13.130 -1.919 277 H GLY 39 H GLY 39 -3.882 -14.672 0.243 278 HA2 GLY 39 2HA GLY 39 -2.316 -14.669 1.948 279 HA3 GLY 39 1HA GLY 39 -1.402 -15.892 1.055 280 H LEU 40 H LEU 40 -2.340 -12.893 -0.449 281 HA LEU 40 HA LEU 40 0.480 -12.196 -0.712 282 HB2 LEU 40 2HB LEU 40 -0.190 -10.733 -2.486 283 HB3 LEU 40 1HB LEU 40 -0.976 -12.280 -2.714 284 HG LEU 40 HG LEU 40 -3.018 -11.211 -1.589 285 HD11 LEU 40 1HD1 LEU 40 -2.514 -9.225 -0.671 286 HD12 LEU 40 2HD1 LEU 40 -2.818 -8.625 -2.302 287 HD13 LEU 40 3HD1 LEU 40 -1.166 -8.942 -1.770 288 HD21 LEU 40 3HD2 LEU 40 -3.854 -10.499 -3.660 289 HD22 LEU 40 1HD2 LEU 40 -2.627 -11.700 -4.064 290 HD23 LEU 40 2HD2 LEU 40 -2.263 -9.980 -4.220 291 HA PRO 41 HA PRO 41 0.295 -8.802 2.098 292 HB2 PRO 41 2HB PRO 41 1.962 -6.998 1.057 293 HB3 PRO 41 1HB PRO 41 2.540 -8.586 1.577 294 HG2 PRO 41 2HG PRO 41 1.841 -7.643 -1.180 295 HG3 PRO 41 1HG PRO 41 3.277 -8.537 -0.645 296 HD2 PRO 41 2HD PRO 41 1.132 -9.739 -1.801 297 HD3 PRO 41 1HD PRO 41 2.160 -10.549 -0.605 298 H LEU 42 H LEU 42 -0.547 -6.770 2.573 299 HA LEU 42 HA LEU 42 -2.574 -5.853 0.765 300 HB2 LEU 42 2HB LEU 42 -1.691 -5.129 3.522 301 HB3 LEU 42 1HB LEU 42 -2.713 -4.012 2.639 302 HG LEU 42 HG LEU 42 -3.522 -6.881 2.971 303 HD11 LEU 42 1HD1 LEU 42 -2.927 -5.812 5.187 304 HD12 LEU 42 2HD1 LEU 42 -4.573 -6.425 5.027 305 HD13 LEU 42 3HD1 LEU 42 -4.258 -4.695 4.889 306 HD21 LEU 42 3HD2 LEU 42 -5.510 -6.214 2.168 307 HD22 LEU 42 1HD2 LEU 42 -4.601 -4.839 1.540 308 HD23 LEU 42 2HD2 LEU 42 -5.476 -4.696 3.065 309 H MET 43 H MET 43 -2.781 -3.629 0.070 310 HA MET 43 HA MET 43 -0.176 -2.307 -0.342 311 HB2 MET 43 2HB MET 43 -0.848 -3.361 -2.419 312 HB3 MET 43 1HB MET 43 -2.449 -2.609 -2.329 313 HG2 MET 43 2HG MET 43 -1.048 -1.454 -3.924 314 HG3 MET 43 1HG MET 43 -1.399 -0.405 -2.553 315 HE1 MET 43 3HE MET 43 1.162 -0.601 -0.302 316 HE2 MET 43 1HE MET 43 -0.095 0.414 -1.012 317 HE3 MET 43 2HE MET 43 1.603 0.804 -1.275 318 H VAL 44 H VAL 44 -0.392 -0.750 1.211 319 HA VAL 44 HA VAL 44 -2.841 0.827 1.280 320 HB VAL 44 HB VAL 44 -0.475 1.281 3.056 321 HG11 VAL 44 1HG1 VAL 44 -2.005 2.270 4.531 322 HG12 VAL 44 2HG1 VAL 44 -3.390 1.552 3.709 323 HG13 VAL 44 3HG1 VAL 44 -2.480 2.850 2.933 324 HG21 VAL 44 3HG2 VAL 44 -2.184 -0.291 4.524 325 HG22 VAL 44 1HG2 VAL 44 -0.661 -0.811 3.802 326 HG23 VAL 44 2HG2 VAL 44 -2.181 -1.073 2.944 327 H ILE 45 H ILE 45 -2.471 1.805 -0.807 328 HA ILE 45 HA ILE 45 -0.283 3.712 -1.008 329 HB ILE 45 HB ILE 45 -2.509 2.942 -2.902 330 HG12 ILE 45 2HG1 ILE 45 0.497 2.669 -3.119 331 HG13 ILE 45 1HG1 ILE 45 -0.608 1.371 -2.650 332 HG21 ILE 45 1HG2 ILE 45 -0.588 4.511 -4.257 333 HG22 ILE 45 2HG2 ILE 45 -1.081 5.415 -2.827 334 HG23 ILE 45 3HG2 ILE 45 -2.293 4.869 -3.984 335 HD11 ILE 45 3HD1 ILE 45 -0.289 2.704 -5.311 336 HD12 ILE 45 1HD1 ILE 45 -1.740 1.791 -4.898 337 HD13 ILE 45 2HD1 ILE 45 -0.168 0.993 -4.900 338 H ILE 46 H ILE 46 -0.520 5.592 0.067 339 HA ILE 46 HA ILE 46 -3.210 6.781 0.109 340 HB ILE 46 HB ILE 46 -1.013 7.172 2.135 341 HG12 ILE 46 2HG1 ILE 46 -3.483 5.888 2.995 342 HG13 ILE 46 1HG1 ILE 46 -2.610 4.941 1.785 343 HG21 ILE 46 1HG2 ILE 46 -3.873 7.873 2.577 344 HG22 ILE 46 2HG2 ILE 46 -2.843 8.981 1.677 345 HG23 ILE 46 3HG2 ILE 46 -2.425 8.529 3.331 346 HD11 ILE 46 3HD1 ILE 46 -1.341 6.051 4.277 347 HD12 ILE 46 1HD1 ILE 46 -0.682 4.845 3.171 348 HD13 ILE 46 2HD1 ILE 46 -2.066 4.443 4.188 349 H HIS 47 H HIS 47 -3.453 8.917 -0.390 350 HA HIS 47 HA HIS 47 -1.022 10.397 -1.126 351 HB2 HIS 47 2HB HIS 47 -2.289 11.142 -3.232 352 HB3 HIS 47 1HB HIS 47 -1.553 9.534 -3.229 353 HD1 HIS 47 1HD HIS 47 -4.372 10.953 -4.540 354 HD2 HIS 47 2HD HIS 47 -3.864 7.719 -1.980 355 HE1 HIS 47 1HE HIS 47 -6.456 9.566 -4.786 356 HE2 HIS 47 2HE HIS 47 -6.106 7.591 -3.262 357 H LYS 48 H LYS 48 -1.030 12.349 -0.297 358 HA LYS 48 HA LYS 48 -3.602 13.786 -0.124 359 HB2 LYS 48 2HB LYS 48 -1.739 13.170 2.102 360 HB3 LYS 48 1HB LYS 48 -2.471 14.765 2.086 361 HG2 LYS 48 2HG LYS 48 -4.700 13.679 1.940 362 HG3 LYS 48 1HG LYS 48 -3.900 12.117 2.130 363 HD2 LYS 48 2HD LYS 48 -2.857 13.516 4.220 364 HD3 LYS 48 1HD LYS 48 -4.481 14.199 4.117 365 HE2 LYS 48 2HE LYS 48 -5.107 11.619 3.893 366 HE3 LYS 48 1HE LYS 48 -3.609 11.451 4.807 367 HZ1 LYS 48 3HZ LYS 48 -6.055 12.928 5.590 368 HZ2 LYS 48 1HZ LYS 48 -4.578 13.116 6.394 369 HZ3 LYS 48 2HZ LYS 48 -5.345 11.608 6.372 370 H SER 49 H SER 49 -3.472 16.062 -0.179 371 HA SER 49 HA SER 49 -2.700 18.042 -0.989 372 HB2 SER 49 2HB SER 49 -1.129 17.498 1.059 373 HB3 SER 49 1HB SER 49 0.097 17.336 -0.199 374 HG SER 49 HG SER 49 -0.296 19.505 0.810 375 H TRP 50 H TRP 50 -0.144 18.700 -2.089 376 HA TRP 50 HA TRP 50 -0.516 17.883 -4.754 377 HB2 TRP 50 2HB TRP 50 1.734 18.931 -5.142 378 HB3 TRP 50 1HB TRP 50 0.573 19.977 -4.316 379 HD1 TRP 50 HD TRP 50 3.880 18.157 -3.787 380 HE1 TRP 50 1HE TRP 50 4.949 18.986 -1.598 381 HE3 TRP 50 3HE TRP 50 -0.014 20.939 -1.981 382 HZ2 TRP 50 2HZ TRP 50 4.238 20.604 0.600 383 HZ3 TRP 50 3HZ TRP 50 0.265 22.096 0.171 384 HH2 TRP 50 HH TRP 50 2.347 21.931 1.435 385 H CYS 51 H CYS 51 -0.642 15.555 -4.409 386 HA CYS 51 HA CYS 51 1.817 14.156 -3.790 387 HB2 CYS 51 2HB CYS 51 0.431 12.117 -4.134 388 HB3 CYS 51 1HB CYS 51 -0.256 13.226 -2.950 389 H GLY 52 H GLY 52 3.337 14.128 -5.388 390 HA2 GLY 52 2HA GLY 52 2.737 14.313 -8.155 391 HA3 GLY 52 1HA GLY 52 4.284 13.798 -7.477 392 H ALA 53 H ALA 53 2.991 11.639 -5.939 393 HA ALA 53 HA ALA 53 3.313 9.536 -7.755 394 HB1 ALA 53 1HB ALA 53 1.634 9.279 -5.288 395 HB2 ALA 53 2HB ALA 53 3.381 9.502 -5.180 396 HB3 ALA 53 3HB ALA 53 2.721 8.098 -6.018 397 H CYS 54 H CYS 54 0.723 11.673 -7.313 398 HA CYS 54 HA CYS 54 -1.154 9.818 -8.546 399 HB2 CYS 54 2HB CYS 54 -1.847 12.614 -7.676 400 HB3 CYS 54 1HB CYS 54 -2.901 11.199 -7.802 401 H LYS 55 H LYS 55 0.603 12.795 -9.082 402 HA LYS 55 HA LYS 55 -0.742 13.563 -11.454 403 HB2 LYS 55 2HB LYS 55 0.745 15.307 -11.585 404 HB3 LYS 55 1HB LYS 55 0.867 14.917 -9.880 405 HG2 LYS 55 2HG LYS 55 2.998 14.113 -10.072 406 HG3 LYS 55 1HG LYS 55 2.782 13.621 -11.758 407 HD2 LYS 55 2HD LYS 55 3.877 15.472 -12.331 408 HD3 LYS 55 1HD LYS 55 2.458 16.378 -11.802 409 HE2 LYS 55 2HE LYS 55 3.388 16.657 -9.604 410 HE3 LYS 55 1HE LYS 55 4.742 15.597 -9.996 411 HZ1 LYS 55 3HZ LYS 55 4.181 18.219 -11.276 412 HZ2 LYS 55 1HZ LYS 55 5.488 17.205 -11.633 413 HZ3 LYS 55 2HZ LYS 55 5.372 17.928 -10.108 414 H ALA 56 H ALA 56 2.080 11.521 -10.826 415 HA ALA 56 HA ALA 56 2.573 11.186 -13.670 416 HB1 ALA 56 1HB ALA 56 4.178 11.040 -11.464 417 HB2 ALA 56 2HB ALA 56 4.591 10.428 -13.066 418 HB3 ALA 56 3HB ALA 56 3.923 9.337 -11.852 419 H LEU 57 H LEU 57 1.103 9.384 -11.039 420 HA LEU 57 HA LEU 57 0.925 6.895 -12.322 421 HB2 LEU 57 2HB LEU 57 -0.483 8.189 -10.037 422 HB3 LEU 57 1HB LEU 57 -1.124 6.691 -10.683 423 HG LEU 57 HG LEU 57 0.524 6.625 -8.672 424 HD11 LEU 57 1HD1 LEU 57 1.214 4.778 -10.922 425 HD12 LEU 57 2HD1 LEU 57 -0.374 4.730 -10.153 426 HD13 LEU 57 3HD1 LEU 57 1.079 4.435 -9.196 427 HD21 LEU 57 3HD2 LEU 57 2.192 8.055 -10.011 428 HD22 LEU 57 1HD2 LEU 57 2.578 6.554 -10.854 429 HD23 LEU 57 2HD2 LEU 57 2.811 6.671 -9.110 430 H LYS 58 H LYS 58 -0.951 9.782 -12.767 431 HA LYS 58 HA LYS 58 -3.335 8.642 -13.700 432 HB2 LYS 58 2HB LYS 58 -2.953 10.956 -15.270 433 HB3 LYS 58 1HB LYS 58 -3.948 10.772 -13.841 434 HG2 LYS 58 2HG LYS 58 -1.456 11.187 -12.776 435 HG3 LYS 58 1HG LYS 58 -1.441 12.198 -14.213 436 HD2 LYS 58 2HD LYS 58 -3.944 12.442 -12.798 437 HD3 LYS 58 1HD LYS 58 -2.578 12.802 -11.743 438 HE2 LYS 58 2HE LYS 58 -1.762 14.220 -13.783 439 HE3 LYS 58 1HE LYS 58 -3.464 14.176 -14.239 440 HZ1 LYS 58 3HZ LYS 58 -4.003 15.084 -12.039 441 HZ2 LYS 58 1HZ LYS 58 -3.017 16.128 -12.937 442 HZ3 LYS 58 2HZ LYS 58 -2.353 15.204 -11.685 443 HA PRO 59 HA PRO 59 -1.738 8.711 -18.201 444 HB2 PRO 59 2HB PRO 59 0.737 9.585 -18.770 445 HB3 PRO 59 1HB PRO 59 -0.624 10.702 -18.540 446 HG2 PRO 59 2HG PRO 59 1.516 9.902 -16.590 447 HG3 PRO 59 1HG PRO 59 0.901 11.520 -16.969 448 HD2 PRO 59 2HD PRO 59 0.072 10.114 -14.800 449 HD3 PRO 59 1HD PRO 59 -0.983 11.251 -15.677 450 H LYS 60 H LYS 60 0.514 7.689 -15.726 451 HA LYS 60 HA LYS 60 1.613 5.642 -17.512 452 HB2 LYS 60 2HB LYS 60 3.333 5.305 -15.923 453 HB3 LYS 60 1HB LYS 60 3.095 7.045 -16.018 454 HG2 LYS 60 2HG LYS 60 1.481 6.664 -14.040 455 HG3 LYS 60 1HG LYS 60 2.337 5.142 -13.839 456 HD2 LYS 60 2HD LYS 60 3.071 7.418 -12.611 457 HD3 LYS 60 1HD LYS 60 4.198 6.145 -13.040 458 HE2 LYS 60 2HE LYS 60 3.619 8.452 -14.877 459 HE3 LYS 60 1HE LYS 60 4.856 8.533 -13.627 460 HZ1 LYS 60 3HZ LYS 60 5.185 7.567 -16.154 461 HZ2 LYS 60 1HZ LYS 60 5.076 6.165 -15.213 462 HZ3 LYS 60 2HZ LYS 60 6.244 7.335 -14.855 463 H PHE 61 H PHE 61 -0.012 5.880 -14.330 464 HA PHE 61 HA PHE 61 -0.229 3.056 -14.104 465 HB2 PHE 61 2HB PHE 61 -0.321 4.858 -12.220 466 HB3 PHE 61 1HB PHE 61 -2.047 4.899 -12.606 467 HD1 PHE 61 2HD PHE 61 0.698 2.870 -11.290 468 HD2 PHE 61 1HD PHE 61 -3.462 3.003 -12.158 469 HE1 PHE 61 2HE PHE 61 0.363 0.830 -9.958 470 HE2 PHE 61 1HE PHE 61 -3.808 0.957 -10.832 471 HZ PHE 61 HZ PHE 61 -1.894 -0.132 -9.733 472 H ALA 62 H ALA 62 -1.884 5.421 -15.871 473 HA ALA 62 HA ALA 62 -4.435 4.207 -16.041 474 HB1 ALA 62 1HB ALA 62 -2.885 6.101 -17.773 475 HB2 ALA 62 2HB ALA 62 -4.390 6.372 -16.895 476 HB3 ALA 62 3HB ALA 62 -4.390 5.394 -18.363 477 H GLU 63 H GLU 63 -1.335 3.399 -17.005 478 HA GLU 63 HA GLU 63 -1.887 1.657 -19.218 479 HB2 GLU 63 2HB GLU 63 0.274 2.980 -18.730 480 HB3 GLU 63 1HB GLU 63 0.605 1.741 -17.515 481 HG2 GLU 63 2HG GLU 63 1.463 0.425 -19.073 482 HG3 GLU 63 1HG GLU 63 -0.069 0.430 -19.944 483 H SER 64 H SER 64 -2.164 1.536 -15.890 484 HA SER 64 HA SER 64 -1.385 -0.862 -14.966 485 HB2 SER 64 2HB SER 64 -2.393 0.678 -13.496 486 HB3 SER 64 1HB SER 64 -3.903 0.680 -14.400 487 HG SER 64 HG SER 64 -3.124 -0.948 -12.404 488 H THR 65 H THR 65 -3.441 -0.635 -17.636 489 HA THR 65 HA THR 65 -5.341 -2.580 -17.339 490 HB THR 65 HB THR 65 -4.681 -3.215 -19.794 491 HG1 THR 65 1HG THR 65 -3.415 -1.581 -20.764 492 HG21 THR 65 3HG2 THR 65 -6.504 -1.589 -19.011 493 HG22 THR 65 1HG2 THR 65 -5.916 -1.464 -20.669 494 HG23 THR 65 2HG2 THR 65 -5.352 -0.326 -19.446 495 H GLU 66 H GLU 66 -1.881 -2.990 -17.858 496 HA GLU 66 HA GLU 66 -2.052 -5.871 -17.809 497 HB2 GLU 66 2HB GLU 66 0.389 -5.834 -17.911 498 HB3 GLU 66 1HB GLU 66 -0.295 -4.763 -19.138 499 HG2 GLU 66 2HG GLU 66 0.196 -3.367 -16.666 500 HG3 GLU 66 1HG GLU 66 1.657 -4.143 -17.270 501 H ILE 67 H ILE 67 -1.438 -3.234 -15.615 502 HA ILE 67 HA ILE 67 -0.466 -4.852 -13.477 503 HB ILE 67 HB ILE 67 -1.823 -2.159 -13.321 504 HG12 ILE 67 2HG1 ILE 67 1.119 -2.856 -13.483 505 HG13 ILE 67 1HG1 ILE 67 0.163 -2.114 -14.773 506 HG21 ILE 67 1HG2 ILE 67 -1.852 -2.901 -11.145 507 HG22 ILE 67 2HG2 ILE 67 -0.283 -2.099 -11.210 508 HG23 ILE 67 3HG2 ILE 67 -0.380 -3.855 -11.339 509 HD11 ILE 67 3HD1 ILE 67 -0.232 -0.449 -12.604 510 HD12 ILE 67 1HD1 ILE 67 0.845 -0.164 -13.970 511 HD13 ILE 67 2HD1 ILE 67 1.468 -0.903 -12.495 512 H SER 68 H SER 68 -3.515 -4.442 -14.923 513 HA SER 68 HA SER 68 -5.228 -4.783 -12.710 514 HB2 SER 68 2HB SER 68 -6.941 -5.175 -14.278 515 HB3 SER 68 1HB SER 68 -5.810 -4.141 -15.152 516 HG SER 68 HG SER 68 -6.181 -6.934 -15.386 517 H GLU 69 H GLU 69 -3.354 -6.995 -14.653 518 HA GLU 69 HA GLU 69 -4.532 -9.301 -13.316 519 HB2 GLU 69 2HB GLU 69 -2.632 -10.441 -14.819 520 HB3 GLU 69 1HB GLU 69 -4.224 -10.044 -15.442 521 HG2 GLU 69 2HG GLU 69 -3.290 -7.904 -16.293 522 HG3 GLU 69 1HG GLU 69 -1.694 -8.457 -15.786 523 H LEU 70 H LEU 70 -1.490 -7.551 -13.599 524 HA LEU 70 HA LEU 70 0.109 -9.233 -12.008 525 HB2 LEU 70 2HB LEU 70 0.191 -6.451 -12.950 526 HB3 LEU 70 1HB LEU 70 1.057 -6.728 -11.441 527 HG LEU 70 HG LEU 70 1.683 -8.718 -13.483 528 HD11 LEU 70 1HD1 LEU 70 1.205 -6.371 -14.638 529 HD12 LEU 70 2HD1 LEU 70 2.517 -7.435 -15.156 530 HD13 LEU 70 3HD1 LEU 70 2.856 -6.070 -14.090 531 HD21 LEU 70 3HD2 LEU 70 3.319 -8.796 -11.951 532 HD22 LEU 70 1HD2 LEU 70 2.972 -7.171 -11.359 533 HD23 LEU 70 2HD2 LEU 70 3.984 -7.392 -12.786 534 H SER 71 H SER 71 -2.324 -6.896 -11.234 535 HA SER 71 HA SER 71 -1.831 -6.112 -8.691 536 HB2 SER 71 2HB SER 71 -4.245 -6.586 -10.258 537 HB3 SER 71 1HB SER 71 -4.489 -6.749 -8.520 538 HG SER 71 HG SER 71 -3.319 -4.651 -8.416 539 H HIS 72 H HIS 72 -2.376 -9.381 -9.650 540 HA HIS 72 HA HIS 72 -3.423 -10.474 -7.308 541 HB2 HIS 72 2HB HIS 72 -1.830 -11.502 -9.602 542 HB3 HIS 72 1HB HIS 72 -1.876 -12.500 -8.141 543 HD1 HIS 72 1HD HIS 72 -4.534 -12.809 -7.250 544 HD2 HIS 72 2HD HIS 72 -3.839 -12.112 -11.284 545 HE1 HIS 72 1HE HIS 72 -6.604 -13.609 -8.435 546 HE2 HIS 72 2HE HIS 72 -6.205 -13.072 -10.864 547 H ASN 73 H ASN 73 -0.445 -8.980 -7.895 548 HA ASN 73 HA ASN 73 1.147 -10.401 -6.008 549 HB2 ASN 73 2HB ASN 73 1.506 -7.660 -7.228 550 HB3 ASN 73 1HB ASN 73 2.742 -8.597 -6.391 551 HD21 ASN 73 1HD2 ASN 73 1.818 -7.682 -9.318 552 HD22 ASN 73 2HD2 ASN 73 2.298 -9.061 -10.260 553 H PHE 74 H PHE 74 -0.871 -7.511 -5.852 554 HA PHE 74 HA PHE 74 -0.575 -7.529 -2.945 555 HB2 PHE 74 2HB PHE 74 0.179 -5.380 -4.818 556 HB3 PHE 74 1HB PHE 74 -0.768 -4.871 -3.419 557 HD1 PHE 74 2HD PHE 74 2.325 -6.577 -4.479 558 HD2 PHE 74 1HD PHE 74 0.209 -4.758 -1.273 559 HE1 PHE 74 2HE PHE 74 4.363 -6.645 -3.106 560 HE2 PHE 74 1HE PHE 74 2.242 -4.825 0.114 561 HZ PHE 74 HZ PHE 74 4.322 -5.769 -0.806 562 H VAL 75 H VAL 75 -2.329 -5.775 -2.040 563 HA VAL 75 HA VAL 75 -4.731 -6.156 -3.701 564 HB VAL 75 HB VAL 75 -4.579 -7.858 -1.887 565 HG11 VAL 75 1HG1 VAL 75 -4.175 -5.549 -0.277 566 HG12 VAL 75 2HG1 VAL 75 -4.155 -7.248 0.197 567 HG13 VAL 75 3HG1 VAL 75 -5.666 -6.340 0.232 568 HG21 VAL 75 3HG2 VAL 75 -6.959 -6.008 -1.821 569 HG22 VAL 75 1HG2 VAL 75 -6.941 -7.703 -1.327 570 HG23 VAL 75 2HG2 VAL 75 -6.668 -7.273 -3.016 571 H MET 76 H MET 76 -6.217 -4.748 -3.792 572 HA MET 76 HA MET 76 -6.082 -2.141 -3.746 573 HB2 MET 76 2HB MET 76 -8.562 -2.187 -3.473 574 HB3 MET 76 1HB MET 76 -7.912 -3.260 -4.694 575 HG2 MET 76 2HG MET 76 -8.189 -4.444 -2.027 576 HG3 MET 76 1HG MET 76 -9.703 -3.985 -2.800 577 HE1 MET 76 3HE MET 76 -10.374 -7.338 -4.213 578 HE2 MET 76 1HE MET 76 -10.986 -5.685 -4.175 579 HE3 MET 76 2HE MET 76 -10.481 -6.473 -2.680 580 H VAL 77 H VAL 77 -5.116 -1.019 -1.946 581 HA VAL 77 HA VAL 77 -7.060 -0.510 0.166 582 HB VAL 77 HB VAL 77 -4.175 -1.037 0.874 583 HG11 VAL 77 1HG1 VAL 77 -5.643 -1.137 3.173 584 HG12 VAL 77 2HG1 VAL 77 -6.448 0.151 2.275 585 HG13 VAL 77 3HG1 VAL 77 -4.720 0.259 2.616 586 HG21 VAL 77 3HG2 VAL 77 -4.921 -3.167 0.522 587 HG22 VAL 77 1HG2 VAL 77 -6.591 -2.760 0.908 588 HG23 VAL 77 2HG2 VAL 77 -5.405 -2.930 2.200 589 H ASN 78 H ASN 78 -7.125 1.316 -1.463 590 HA ASN 78 HA ASN 78 -4.982 3.258 -1.241 591 HB2 ASN 78 2HB ASN 78 -6.211 2.793 -3.380 592 HB3 ASN 78 1HB ASN 78 -7.627 3.534 -2.656 593 HD21 ASN 78 1HD2 ASN 78 -4.211 4.443 -2.537 594 HD22 ASN 78 2HD2 ASN 78 -4.434 6.023 -3.222 595 H LEU 79 H LEU 79 -4.975 4.264 0.704 596 HA LEU 79 HA LEU 79 -7.504 5.274 1.770 597 HB2 LEU 79 2HB LEU 79 -6.377 4.351 3.536 598 HB3 LEU 79 1HB LEU 79 -4.803 4.764 2.896 599 HG LEU 79 HG LEU 79 -5.179 7.121 3.566 600 HD11 LEU 79 1HD1 LEU 79 -7.045 7.828 4.764 601 HD12 LEU 79 2HD1 LEU 79 -7.557 6.179 5.124 602 HD13 LEU 79 3HD1 LEU 79 -7.727 6.819 3.488 603 HD21 LEU 79 3HD2 LEU 79 -5.263 6.563 6.109 604 HD22 LEU 79 1HD2 LEU 79 -3.910 6.003 5.129 605 HD23 LEU 79 2HD2 LEU 79 -5.214 4.892 5.549 606 H GLU 80 H GLU 80 -8.106 7.343 1.606 607 HA GLU 80 HA GLU 80 -6.133 9.267 0.565 608 HB2 GLU 80 2HB GLU 80 -8.434 8.435 -0.669 609 HB3 GLU 80 1HB GLU 80 -8.969 9.911 0.143 610 HG2 GLU 80 2HG GLU 80 -6.792 10.909 -0.925 611 HG3 GLU 80 1HG GLU 80 -6.977 9.548 -2.042 612 H ASP 81 H ASP 81 -7.355 11.609 0.848 613 HA ASP 81 HA ASP 81 -7.012 12.235 3.563 614 HB2 ASP 81 2HB ASP 81 -6.851 13.754 1.466 615 HB3 ASP 81 1HB ASP 81 -8.585 13.975 1.683 616 H GLU 82 H GLU 82 -9.791 11.187 1.781 617 HA GLU 82 HA GLU 82 -11.926 12.188 3.171 618 HB2 GLU 82 2HB GLU 82 -13.062 9.994 2.689 619 HB3 GLU 82 1HB GLU 82 -12.323 10.770 1.296 620 HG2 GLU 82 2HG GLU 82 -10.294 9.260 1.837 621 HG3 GLU 82 1HG GLU 82 -11.459 8.323 2.772 622 H GLU 83 H GLU 83 -9.602 9.821 4.227 623 HA GLU 83 HA GLU 83 -10.988 9.658 6.822 624 HB2 GLU 83 2HB GLU 83 -9.712 7.573 5.145 625 HB3 GLU 83 1HB GLU 83 -9.411 7.468 6.875 626 HG2 GLU 83 2HG GLU 83 -11.432 6.649 7.259 627 HG3 GLU 83 1HG GLU 83 -12.205 7.944 6.336 628 H GLU 84 H GLU 84 -9.597 9.494 8.700 629 HA GLU 84 HA GLU 84 -6.842 10.406 8.255 630 HB2 GLU 84 2HB GLU 84 -7.154 11.952 10.242 631 HB3 GLU 84 1HB GLU 84 -7.948 12.437 8.750 632 HG2 GLU 84 2HG GLU 84 -9.963 11.099 9.835 633 HG3 GLU 84 1HG GLU 84 -9.113 11.531 11.317 634 HA PRO 85 HA PRO 85 -7.287 6.830 11.306 635 HB2 PRO 85 2HB PRO 85 -5.006 5.842 9.693 636 HB3 PRO 85 1HB PRO 85 -6.459 4.984 10.239 637 HG2 PRO 85 2HG PRO 85 -6.146 5.688 7.677 638 HG3 PRO 85 1HG PRO 85 -7.738 5.753 8.468 639 HD2 PRO 85 2HD PRO 85 -5.835 7.981 7.842 640 HD3 PRO 85 1HD PRO 85 -7.611 7.938 7.712 641 H LYS 86 H LYS 86 -6.450 7.753 13.104 642 HA LYS 86 HA LYS 86 -4.089 9.207 13.310 643 HB2 LYS 86 2HB LYS 86 -6.090 8.770 14.997 644 HB3 LYS 86 1HB LYS 86 -4.973 7.559 15.637 645 HG2 LYS 86 2HG LYS 86 -3.911 9.135 16.767 646 HG3 LYS 86 1HG LYS 86 -3.524 9.969 15.261 647 HD2 LYS 86 2HD LYS 86 -4.674 11.570 16.520 648 HD3 LYS 86 1HD LYS 86 -5.896 10.938 15.416 649 HE2 LYS 86 2HE LYS 86 -6.418 9.285 17.347 650 HE3 LYS 86 1HE LYS 86 -5.563 10.456 18.351 651 HZ1 LYS 86 3HZ LYS 86 -8.163 10.586 17.863 652 HZ2 LYS 86 1HZ LYS 86 -7.600 11.532 16.578 653 HZ3 LYS 86 2HZ LYS 86 -7.217 11.955 18.169 654 H ASP 87 H ASP 87 -2.403 8.176 12.228 655 HA ASP 87 HA ASP 87 -0.876 6.357 13.804 656 HB2 ASP 87 2HB ASP 87 -0.792 4.515 12.142 657 HB3 ASP 87 1HB ASP 87 -2.396 4.715 12.862 658 H GLU 88 H GLU 88 0.964 5.417 12.178 659 HA GLU 88 HA GLU 88 1.994 7.788 10.767 660 HB2 GLU 88 2HB GLU 88 3.200 5.939 12.677 661 HB3 GLU 88 1HB GLU 88 4.174 6.161 11.231 662 HG2 GLU 88 2HG GLU 88 4.925 7.771 12.742 663 HG3 GLU 88 1HG GLU 88 3.909 8.648 11.601 664 H ASP 89 H ASP 89 0.942 4.594 10.369 665 HA ASP 89 HA ASP 89 2.480 3.419 8.474 666 HB2 ASP 89 2HB ASP 89 -0.518 3.536 8.738 667 HB3 ASP 89 1HB ASP 89 0.270 2.546 7.501 668 H PHE 90 H PHE 90 0.506 6.270 8.012 669 HA PHE 90 HA PHE 90 0.401 6.183 5.186 670 HB2 PHE 90 2HB PHE 90 -0.375 8.449 5.279 671 HB3 PHE 90 1HB PHE 90 -1.085 7.579 6.646 672 HD1 PHE 90 2HD PHE 90 1.706 9.854 5.727 673 HD2 PHE 90 1HD PHE 90 -0.847 8.398 8.804 674 HE1 PHE 90 2HE PHE 90 2.577 11.572 7.256 675 HE2 PHE 90 1HE PHE 90 0.017 10.116 10.339 676 HZ PHE 90 HZ PHE 90 1.733 11.705 9.566 677 H SER 91 H SER 91 2.862 7.182 7.414 678 HA SER 91 HA SER 91 4.666 7.661 5.178 679 HB2 SER 91 2HB SER 91 3.838 9.904 5.652 680 HB3 SER 91 1HB SER 91 4.214 9.701 7.372 681 HG SER 91 HG SER 91 5.938 10.097 5.198 682 HA PRO 92 HA PRO 92 6.554 5.442 8.818 683 HB2 PRO 92 2HB PRO 92 6.992 3.157 7.101 684 HB3 PRO 92 1HB PRO 92 5.974 3.274 8.546 685 HG2 PRO 92 2HG PRO 92 5.001 2.935 6.004 686 HG3 PRO 92 1HG PRO 92 4.085 3.676 7.329 687 HD2 PRO 92 2HD PRO 92 5.563 4.986 5.080 688 HD3 PRO 92 1HD PRO 92 3.995 5.411 5.798 689 H ASP 93 H ASP 93 7.884 7.359 7.403 690 HA ASP 93 HA ASP 93 10.516 6.209 7.201 691 HB2 ASP 93 2HB ASP 93 8.961 6.751 4.812 692 HB3 ASP 93 1HB ASP 93 10.443 7.716 4.845 693 H GLY 94 H GLY 94 8.601 9.118 6.427 694 HA2 GLY 94 2HA GLY 94 10.501 10.666 8.063 695 HA3 GLY 94 1HA GLY 94 10.119 11.209 6.424 696 H GLY 95 H GLY 95 8.429 12.525 6.154 697 HA2 GLY 95 2HA GLY 95 6.223 12.485 8.053 698 HA3 GLY 95 1HA GLY 95 7.188 13.966 8.027 699 H TYR 96 H TYR 96 6.812 12.241 5.049 700 HA TYR 96 HA TYR 96 5.658 14.452 3.753 701 HB2 TYR 96 2HB TYR 96 5.110 12.675 1.933 702 HB3 TYR 96 1HB TYR 96 6.797 13.048 2.300 703 HD1 TYR 96 2HD TYR 96 4.132 10.536 2.609 704 HD2 TYR 96 1HD TYR 96 8.235 11.404 3.334 705 HE1 TYR 96 2HE TYR 96 4.559 8.144 3.007 706 HE2 TYR 96 1HE TYR 96 8.669 9.020 3.749 707 HH TYR 96 HH TYR 96 6.314 6.799 4.346 708 H ILE 97 H ILE 97 3.525 14.181 2.433 709 HA ILE 97 HA ILE 97 1.476 12.884 4.061 710 HB ILE 97 HB ILE 97 0.096 15.056 3.743 711 HG12 ILE 97 2HG1 ILE 97 2.606 16.547 3.994 712 HG13 ILE 97 1HG1 ILE 97 2.361 15.825 2.402 713 HG21 ILE 97 1HG2 ILE 97 0.733 14.242 5.918 714 HG22 ILE 97 2HG2 ILE 97 1.008 15.983 5.844 715 HG23 ILE 97 3HG2 ILE 97 2.369 14.869 5.712 716 HD11 ILE 97 3HD1 ILE 97 0.645 17.188 1.896 717 HD12 ILE 97 1HD1 ILE 97 1.462 18.242 3.051 718 HD13 ILE 97 2HD1 ILE 97 0.076 17.282 3.566 719 HA PRO 98 HA PRO 98 1.334 10.639 3.034 720 HB2 PRO 98 2HB PRO 98 -1.320 10.058 1.665 721 HB3 PRO 98 1HB PRO 98 -0.583 9.192 3.042 722 HG2 PRO 98 2HG PRO 98 -2.094 11.614 3.068 723 HG3 PRO 98 1HG PRO 98 -1.345 10.753 4.443 724 HD2 PRO 98 2HD PRO 98 -0.356 13.051 3.832 725 HD3 PRO 98 1HD PRO 98 0.776 11.694 4.025 726 H ARG 99 H ARG 99 2.088 8.708 2.103 727 HA ARG 99 HA ARG 99 2.208 8.644 -0.829 728 HB2 ARG 99 2HB ARG 99 4.345 8.538 1.206 729 HB3 ARG 99 1HB ARG 99 4.511 7.420 -0.143 730 HG2 ARG 99 2HG ARG 99 5.708 9.370 -0.680 731 HG3 ARG 99 1HG ARG 99 4.252 9.383 -1.670 732 HD2 ARG 99 2HD ARG 99 3.418 10.759 0.510 733 HD3 ARG 99 1HD ARG 99 5.121 11.203 0.476 734 HE ARG 99 HE ARG 99 4.230 11.538 -2.099 735 HH11 ARG 99 1HH1 ARG 99 3.350 12.808 1.028 736 HH12 ARG 99 2HH1 ARG 99 2.823 14.332 0.400 737 HH21 ARG 99 1HH2 ARG 99 3.539 13.543 -2.927 738 HH22 ARG 99 2HH2 ARG 99 2.929 14.749 -1.845 739 H ILE 100 H ILE 100 3.537 6.246 -1.130 740 HA ILE 100 HA ILE 100 1.507 4.369 -0.131 741 HB ILE 100 HB ILE 100 1.919 2.975 -1.975 742 HG12 ILE 100 2HG1 ILE 100 3.872 3.960 -3.597 743 HG13 ILE 100 1HG1 ILE 100 4.546 4.309 -2.010 744 HG21 ILE 100 1HG2 ILE 100 2.301 5.677 -3.216 745 HG22 ILE 100 2HG2 ILE 100 0.797 5.224 -2.414 746 HG23 ILE 100 3HG2 ILE 100 1.363 4.309 -3.813 747 HD11 ILE 100 3HD1 ILE 100 4.429 1.832 -3.427 748 HD12 ILE 100 1HD1 ILE 100 3.589 1.680 -1.885 749 HD13 ILE 100 2HD1 ILE 100 5.268 2.223 -1.926 750 H LEU 101 H LEU 101 2.079 2.316 0.652 751 HA LEU 101 HA LEU 101 4.812 1.580 1.059 752 HB2 LEU 101 2HB LEU 101 4.457 1.398 3.610 753 HB3 LEU 101 1HB LEU 101 4.919 2.939 2.925 754 HG LEU 101 HG LEU 101 3.174 3.041 4.714 755 HD11 LEU 101 1HD1 LEU 101 3.571 4.676 2.710 756 HD12 LEU 101 2HD1 LEU 101 2.187 4.879 3.785 757 HD13 LEU 101 3HD1 LEU 101 1.976 4.110 2.210 758 HD21 LEU 101 3HD2 LEU 101 1.293 2.020 2.616 759 HD22 LEU 101 1HD2 LEU 101 0.978 2.323 4.324 760 HD23 LEU 101 2HD2 LEU 101 2.000 0.968 3.843 761 H PHE 102 H PHE 102 5.058 -0.590 1.644 762 HA PHE 102 HA PHE 102 2.605 -2.128 1.282 763 HB2 PHE 102 2HB PHE 102 5.445 -3.144 1.409 764 HB3 PHE 102 1HB PHE 102 4.033 -4.013 0.819 765 HD1 PHE 102 1HD PHE 102 2.771 -2.863 -1.174 766 HD2 PHE 102 2HD PHE 102 6.811 -2.072 -0.110 767 HE1 PHE 102 1HE PHE 102 3.206 -2.033 -3.449 768 HE2 PHE 102 2HE PHE 102 7.253 -1.239 -2.378 769 HZ PHE 102 HZ PHE 102 5.449 -1.217 -4.052 770 H LEU 103 H LEU 103 1.968 -3.835 2.652 771 HA LEU 103 HA LEU 103 3.235 -3.934 5.288 772 HB2 LEU 103 2HB LEU 103 1.213 -3.569 6.481 773 HB3 LEU 103 1HB LEU 103 1.427 -2.238 5.365 774 HG LEU 103 HG LEU 103 -0.473 -4.544 5.058 775 HD11 LEU 103 1HD1 LEU 103 -1.222 -2.941 6.685 776 HD12 LEU 103 2HD1 LEU 103 -2.181 -2.788 5.215 777 HD13 LEU 103 3HD1 LEU 103 -0.913 -1.616 5.570 778 HD21 LEU 103 3HD2 LEU 103 -1.233 -2.893 3.144 779 HD22 LEU 103 1HD2 LEU 103 0.004 -4.120 2.880 780 HD23 LEU 103 2HD2 LEU 103 0.472 -2.449 3.184 781 H ASP 104 H ASP 104 2.406 -5.711 6.648 782 HA ASP 104 HA ASP 104 2.345 -8.120 5.140 783 HB2 ASP 104 2HB ASP 104 2.219 -9.252 7.301 784 HB3 ASP 104 1HB ASP 104 3.437 -7.968 7.335 785 HA PRO 105 HA PRO 105 -1.910 -8.865 4.286 786 HB2 PRO 105 2HB PRO 105 -1.365 -11.622 5.280 787 HB3 PRO 105 1HB PRO 105 -2.067 -11.091 3.740 788 HG2 PRO 105 2HG PRO 105 0.447 -11.972 3.872 789 HG3 PRO 105 1HG PRO 105 0.001 -10.617 2.810 790 HD2 PRO 105 2HD PRO 105 1.438 -10.592 5.424 791 HD3 PRO 105 1HD PRO 105 1.654 -9.551 4.003 792 H SER 106 H SER 106 -2.549 -7.539 6.102 793 HA SER 106 HA SER 106 -4.459 -8.663 7.733 794 HB2 SER 106 2HB SER 106 -3.526 -8.892 9.893 795 HB3 SER 106 1HB SER 106 -2.336 -9.669 8.834 796 HG SER 106 HG SER 106 -1.334 -8.251 10.303 797 H GLY 107 H GLY 107 -2.028 -6.208 7.290 798 HA2 GLY 107 2HA GLY 107 -2.878 -3.937 6.895 799 HA3 GLY 107 1HA GLY 107 -3.946 -4.194 8.279 800 H LYS 108 H LYS 108 -0.514 -5.075 7.988 801 HA LYS 108 HA LYS 108 0.022 -3.115 10.142 802 HB2 LYS 108 2HB LYS 108 0.522 -5.985 10.032 803 HB3 LYS 108 1HB LYS 108 1.958 -5.060 10.452 804 HG2 LYS 108 2HG LYS 108 0.257 -3.873 12.100 805 HG3 LYS 108 1HG LYS 108 -0.578 -5.429 11.945 806 HD2 LYS 108 2HD LYS 108 2.006 -6.219 12.326 807 HD3 LYS 108 1HD LYS 108 1.935 -4.753 13.305 808 HE2 LYS 108 2HE LYS 108 1.126 -6.132 14.886 809 HE3 LYS 108 1HE LYS 108 -0.392 -5.941 14.009 810 HZ1 LYS 108 3HZ LYS 108 0.950 -7.969 12.720 811 HZ2 LYS 108 1HZ LYS 108 -0.379 -8.130 13.756 812 HZ3 LYS 108 2HZ LYS 108 1.192 -8.273 14.366 813 H VAL 109 H VAL 109 0.625 -1.633 8.414 814 HA VAL 109 HA VAL 109 2.642 -2.008 6.553 815 HB VAL 109 HB VAL 109 2.048 0.543 8.044 816 HG11 VAL 109 1HG1 VAL 109 2.909 1.649 6.102 817 HG12 VAL 109 2HG1 VAL 109 3.134 0.104 5.283 818 HG13 VAL 109 3HG1 VAL 109 4.106 0.500 6.700 819 HG21 VAL 109 3HG2 VAL 109 -0.006 -0.454 7.103 820 HG22 VAL 109 1HG2 VAL 109 0.762 -0.485 5.517 821 HG23 VAL 109 2HG2 VAL 109 0.437 1.054 6.306 822 H HIS 110 H HIS 110 4.699 -2.213 6.605 823 HA HIS 110 HA HIS 110 6.100 -1.616 9.129 824 HB2 HIS 110 2HB HIS 110 6.045 -3.994 7.517 825 HB3 HIS 110 1HB HIS 110 7.678 -3.336 7.513 826 HD1 HIS 110 1HD HIS 110 9.089 -4.021 9.424 827 HD2 HIS 110 2HD HIS 110 5.040 -4.315 10.306 828 HE1 HIS 110 1HE HIS 110 8.974 -5.039 11.719 829 HE2 HIS 110 2HE HIS 110 6.513 -5.309 12.184 830 HA PRO 111 HA PRO 111 8.084 1.468 6.581 831 HB2 PRO 111 2HB PRO 111 10.029 2.189 8.351 832 HB3 PRO 111 1HB PRO 111 8.354 2.740 8.476 833 HG2 PRO 111 2HG PRO 111 9.731 0.524 9.936 834 HG3 PRO 111 1HG PRO 111 8.601 1.740 10.559 835 HD2 PRO 111 2HD PRO 111 7.841 -0.793 9.991 836 HD3 PRO 111 1HD PRO 111 6.753 0.599 9.775 837 H GLU 112 H GLU 112 8.722 -1.297 6.143 838 HA GLU 112 HA GLU 112 11.646 -1.154 5.777 839 HB2 GLU 112 2HB GLU 112 10.282 -3.069 7.145 840 HB3 GLU 112 1HB GLU 112 10.346 -3.789 5.542 841 HG2 GLU 112 2HG GLU 112 12.919 -2.867 5.966 842 HG3 GLU 112 1HG GLU 112 12.423 -3.505 7.534 843 H ILE 113 H ILE 113 8.819 -2.780 4.322 844 HA ILE 113 HA ILE 113 10.056 -3.014 1.773 845 HB ILE 113 HB ILE 113 7.087 -3.113 2.248 846 HG12 ILE 113 2HG1 ILE 113 8.495 -5.680 2.325 847 HG13 ILE 113 1HG1 ILE 113 8.906 -4.626 3.684 848 HG21 ILE 113 1HG2 ILE 113 8.429 -3.282 -0.061 849 HG22 ILE 113 2HG2 ILE 113 6.936 -4.168 0.250 850 HG23 ILE 113 3HG2 ILE 113 8.493 -4.974 0.432 851 HD11 ILE 113 3HD1 ILE 113 6.408 -6.033 3.062 852 HD12 ILE 113 1HD1 ILE 113 6.220 -4.385 3.662 853 HD13 ILE 113 2HD1 ILE 113 7.105 -5.574 4.616 854 H ILE 114 H ILE 114 10.766 -0.952 1.257 855 HA ILE 114 HA ILE 114 8.712 1.061 0.647 856 HB ILE 114 HB ILE 114 10.336 2.744 0.825 857 HG12 ILE 114 2HG1 ILE 114 12.118 1.483 -0.464 858 HG13 ILE 114 1HG1 ILE 114 12.711 2.444 0.878 859 HG21 ILE 114 1HG2 ILE 114 9.967 0.903 2.941 860 HG22 ILE 114 2HG2 ILE 114 10.277 2.637 3.028 861 HG23 ILE 114 3HG2 ILE 114 11.625 1.500 3.023 862 HD11 ILE 114 3HD1 ILE 114 12.540 0.216 2.202 863 HD12 ILE 114 1HD1 ILE 114 13.897 0.497 1.113 864 HD13 ILE 114 2HD1 ILE 114 12.549 -0.515 0.598 865 H ASN 115 H ASN 115 10.118 2.613 -1.130 866 HA ASN 115 HA ASN 115 10.078 0.925 -3.516 867 HB2 ASN 115 2HB ASN 115 8.701 3.042 -3.370 868 HB3 ASN 115 1HB ASN 115 10.223 3.942 -3.378 869 HD21 ASN 115 1HD2 ASN 115 9.388 4.938 -5.304 870 HD22 ASN 115 2HD2 ASN 115 9.557 4.119 -6.833 871 H GLU 116 H GLU 116 12.155 -0.031 -3.064 872 HA GLU 116 HA GLU 116 14.535 1.302 -2.636 873 HB2 GLU 116 2HB GLU 116 13.858 -1.294 -3.971 874 HB3 GLU 116 1HB GLU 116 15.529 -0.718 -3.957 875 HG2 GLU 116 2HG GLU 116 13.876 -1.008 -1.466 876 HG3 GLU 116 1HG GLU 116 14.861 -2.313 -2.119 877 H ASN 117 H ASN 117 12.650 1.113 -5.529 878 HA ASN 117 HA ASN 117 14.821 1.987 -7.240 879 HB2 ASN 117 2HB ASN 117 13.006 0.406 -7.998 880 HB3 ASN 117 1HB ASN 117 11.887 1.775 -7.936 881 HD21 ASN 117 1HD2 ASN 117 14.919 0.671 -9.375 882 HD22 ASN 117 2HD2 ASN 117 14.744 1.567 -10.860 883 H GLY 118 H GLY 118 12.849 3.513 -5.053 884 HA2 GLY 118 2HA GLY 118 12.450 5.934 -6.640 885 HA3 GLY 118 1HA GLY 118 11.867 5.649 -4.996 886 H ASN 119 H ASN 119 12.823 8.013 -5.169 887 HA ASN 119 HA ASN 119 15.561 8.475 -5.116 888 HB2 ASN 119 2HB ASN 119 14.901 10.471 -3.611 889 HB3 ASN 119 1HB ASN 119 14.226 10.396 -5.246 890 HD21 ASN 119 1HD2 ASN 119 12.562 11.783 -4.511 891 HD22 ASN 119 2HD2 ASN 119 11.220 11.152 -3.592 892 HA PRO 120 HA PRO 120 16.797 6.609 -1.288 893 HB2 PRO 120 2HB PRO 120 19.203 8.233 -1.265 894 HB3 PRO 120 1HB PRO 120 19.027 6.512 -1.645 895 HG2 PRO 120 2HG PRO 120 19.693 8.413 -3.492 896 HG3 PRO 120 1HG PRO 120 18.852 6.898 -3.893 897 HD2 PRO 120 2HD PRO 120 17.736 9.657 -3.533 898 HD3 PRO 120 1HD PRO 120 17.324 8.415 -4.742 899 H SER 121 H SER 121 14.932 8.500 -0.697 900 HA SER 121 HA SER 121 15.820 9.443 1.848 901 HB2 SER 121 2HB SER 121 15.348 11.467 -0.356 902 HB3 SER 121 1HB SER 121 15.283 11.878 1.365 903 HG SER 121 HG SER 121 17.359 12.236 0.365 904 H TYR 122 H TYR 122 13.514 9.597 -0.753 905 HA TYR 122 HA TYR 122 11.294 10.018 1.083 906 HB2 TYR 122 2HB TYR 122 11.936 10.813 -1.543 907 HB3 TYR 122 1HB TYR 122 10.544 9.741 -1.667 908 HD1 TYR 122 2HD TYR 122 8.571 10.305 -0.008 909 HD2 TYR 122 1HD TYR 122 11.641 13.035 -1.100 910 HE1 TYR 122 2HE TYR 122 7.127 12.181 0.639 911 HE2 TYR 122 1HE TYR 122 10.214 14.920 -0.445 912 HH TYR 122 HH TYR 122 7.390 15.118 -0.280 913 H LYS 123 H LYS 123 12.580 7.684 -1.213 914 HA LYS 123 HA LYS 123 12.016 5.538 -1.744 915 HB2 LYS 123 2HB LYS 123 11.580 5.662 1.223 916 HB3 LYS 123 1HB LYS 123 11.368 4.166 0.328 917 HG2 LYS 123 2HG LYS 123 13.898 5.798 0.385 918 HG3 LYS 123 1HG LYS 123 13.586 4.352 1.360 919 HD2 LYS 123 2HD LYS 123 14.540 3.239 -0.337 920 HD3 LYS 123 1HD LYS 123 12.994 3.481 -1.166 921 HE2 LYS 123 2HE LYS 123 13.813 5.180 -2.477 922 HE3 LYS 123 1HE LYS 123 15.065 5.619 -1.317 923 HZ1 LYS 123 3HZ LYS 123 16.108 4.599 -3.173 924 HZ2 LYS 123 1HZ LYS 123 15.051 3.279 -3.140 925 HZ3 LYS 123 2HZ LYS 123 16.180 3.490 -1.898 926 H TYR 124 H TYR 124 9.576 5.613 0.775 927 HA TYR 124 HA TYR 124 7.601 4.340 -0.551 928 HB2 TYR 124 2HB TYR 124 7.493 6.414 1.608 929 HB3 TYR 124 1HB TYR 124 6.013 5.658 0.993 930 HD1 TYR 124 2HD TYR 124 6.445 2.946 0.668 931 HD2 TYR 124 1HD TYR 124 8.249 5.467 3.574 932 HE1 TYR 124 2HE TYR 124 6.828 1.000 2.109 933 HE2 TYR 124 1HE TYR 124 8.647 3.524 5.019 934 HH TYR 124 HH TYR 124 8.922 0.935 4.591 935 H PHE 125 H PHE 125 8.592 7.581 -1.241 936 HA PHE 125 HA PHE 125 6.139 8.438 -2.435 937 HB2 PHE 125 2HB PHE 125 7.777 10.091 -1.754 938 HB3 PHE 125 1HB PHE 125 8.990 9.391 -2.832 939 HD1 PHE 125 2HD PHE 125 5.422 10.418 -3.260 940 HD2 PHE 125 1HD PHE 125 9.454 10.822 -4.560 941 HE1 PHE 125 2HE PHE 125 4.691 11.945 -5.044 942 HE2 PHE 125 1HE PHE 125 8.730 12.351 -6.345 943 HZ PHE 125 HZ PHE 125 6.344 12.914 -6.590 944 H TYR 126 H TYR 126 5.648 8.538 -4.709 945 HA TYR 126 HA TYR 126 7.321 6.807 -6.390 946 HB2 TYR 126 2HB TYR 126 4.510 6.385 -5.588 947 HB3 TYR 126 1HB TYR 126 4.869 6.121 -7.300 948 HD1 TYR 126 1HD TYR 126 5.714 5.052 -3.863 949 HD2 TYR 126 2HD TYR 126 6.082 4.211 -8.012 950 HE1 TYR 126 1HE TYR 126 6.592 2.819 -3.326 951 HE2 TYR 126 2HE TYR 126 6.958 1.975 -7.488 952 HH TYR 126 HH TYR 126 8.046 0.805 -5.673 953 H VAL 127 H VAL 127 7.192 7.108 -8.591 954 HA VAL 127 HA VAL 127 5.521 9.078 -9.817 955 HB VAL 127 HB VAL 127 7.443 10.481 -10.647 956 HG11 VAL 127 1HG1 VAL 127 7.114 10.649 -7.662 957 HG12 VAL 127 2HG1 VAL 127 5.855 11.131 -8.800 958 HG13 VAL 127 3HG1 VAL 127 7.409 11.963 -8.801 959 HG21 VAL 127 3HG2 VAL 127 9.334 10.387 -8.730 960 HG22 VAL 127 1HG2 VAL 127 9.449 9.525 -10.265 961 HG23 VAL 127 2HG2 VAL 127 8.894 8.682 -8.818 962 H SER 128 H SER 128 5.556 6.561 -10.451 963 HA SER 128 HA SER 128 6.142 6.354 -13.132 964 HB2 SER 128 2HB SER 128 8.474 6.444 -12.848 965 HB3 SER 128 1HB SER 128 8.422 5.452 -11.381 966 HG SER 128 HG SER 128 9.058 4.532 -13.617 967 H ALA 129 H ALA 129 5.122 4.602 -13.935 968 HA ALA 129 HA ALA 129 3.807 2.824 -12.097 969 HB1 ALA 129 1HB ALA 129 2.319 3.136 -13.740 970 HB2 ALA 129 2HB ALA 129 3.199 1.849 -14.563 971 HB3 ALA 129 3HB ALA 129 3.562 3.537 -14.926 972 H GLU 130 H GLU 130 6.600 2.681 -14.157 973 HA GLU 130 HA GLU 130 6.781 -0.118 -14.429 974 HB2 GLU 130 2HB GLU 130 8.218 2.077 -15.334 975 HB3 GLU 130 1HB GLU 130 9.367 1.222 -14.298 976 HG2 GLU 130 2HG GLU 130 8.386 -0.849 -15.698 977 HG3 GLU 130 1HG GLU 130 8.190 0.446 -16.891 978 H GLN 131 H GLN 131 7.812 2.080 -11.884 979 HA GLN 131 HA GLN 131 9.285 -0.003 -10.544 980 HB2 GLN 131 2HB GLN 131 9.559 1.668 -8.726 981 HB3 GLN 131 1HB GLN 131 10.188 2.174 -10.286 982 HG2 GLN 131 2HG GLN 131 7.997 3.412 -10.599 983 HG3 GLN 131 1HG GLN 131 7.705 3.110 -8.889 984 HE21 GLN 131 1HE2 GLN 131 7.770 5.266 -8.338 985 HE22 GLN 131 2HE2 GLN 131 9.230 6.189 -8.341 986 H VAL 132 H VAL 132 6.184 1.678 -10.033 987 HA VAL 132 HA VAL 132 5.498 0.642 -7.570 988 HB VAL 132 HB VAL 132 3.286 1.134 -8.004 989 HG11 VAL 132 1HG1 VAL 132 5.192 2.892 -9.013 990 HG12 VAL 132 2HG1 VAL 132 3.552 3.270 -8.498 991 HG13 VAL 132 3HG1 VAL 132 3.882 2.894 -10.188 992 HG21 VAL 132 3HG2 VAL 132 3.837 0.208 -10.784 993 HG22 VAL 132 1HG2 VAL 132 2.454 1.257 -10.470 994 HG23 VAL 132 2HG2 VAL 132 2.581 -0.304 -9.657 995 H VAL 133 H VAL 133 5.509 -0.888 -10.713 996 HA VAL 133 HA VAL 133 4.202 -3.288 -9.817 997 HB VAL 133 HB VAL 133 3.973 -2.646 -12.150 998 HG11 VAL 133 1HG1 VAL 133 5.962 -1.478 -12.610 999 HG12 VAL 133 2HG1 VAL 133 6.025 -2.919 -13.628 1000 HG13 VAL 133 3HG1 VAL 133 6.966 -2.847 -12.136 1001 HG21 VAL 133 3HG2 VAL 133 5.635 -5.148 -11.828 1002 HG22 VAL 133 1HG2 VAL 133 4.592 -4.774 -13.202 1003 HG23 VAL 133 2HG2 VAL 133 3.888 -5.029 -11.605 1004 H GLN 134 H GLN 134 7.547 -2.177 -10.246 1005 HA GLN 134 HA GLN 134 8.692 -4.776 -9.992 1006 HB2 GLN 134 2HB GLN 134 10.777 -3.717 -9.902 1007 HB3 GLN 134 1HB GLN 134 9.805 -2.603 -10.849 1008 HG2 GLN 134 2HG GLN 134 9.693 -1.045 -9.137 1009 HG3 GLN 134 1HG GLN 134 10.082 -2.232 -7.898 1010 HE21 GLN 134 1HE2 GLN 134 11.439 -0.641 -10.749 1011 HE22 GLN 134 2HE2 GLN 134 13.073 -0.567 -10.146 1012 H GLY 135 H GLY 135 7.680 -2.305 -7.756 1013 HA2 GLY 135 2HA GLY 135 8.758 -3.623 -5.430 1014 HA3 GLY 135 1HA GLY 135 7.677 -2.222 -5.445 1015 H MET 136 H MET 136 5.857 -3.745 -7.318 1016 HA MET 136 HA MET 136 4.252 -4.957 -5.256 1017 HB2 MET 136 2HB MET 136 3.493 -3.597 -7.364 1018 HB3 MET 136 1HB MET 136 3.610 -5.154 -8.172 1019 HG2 MET 136 2HG MET 136 2.109 -6.040 -6.320 1020 HG3 MET 136 1HG MET 136 1.803 -4.352 -5.921 1021 HE1 MET 136 3HE MET 136 -1.445 -4.316 -7.627 1022 HE2 MET 136 1HE MET 136 -0.453 -4.074 -6.191 1023 HE3 MET 136 2HE MET 136 -0.988 -5.696 -6.630 1024 H LYS 137 H LYS 137 6.103 -5.963 -8.037 1025 HA LYS 137 HA LYS 137 5.439 -8.734 -7.846 1026 HB2 LYS 137 2HB LYS 137 7.028 -9.028 -9.654 1027 HB3 LYS 137 1HB LYS 137 5.995 -7.649 -9.984 1028 HG2 LYS 137 2HG LYS 137 7.899 -6.250 -8.994 1029 HG3 LYS 137 1HG LYS 137 8.883 -7.698 -9.215 1030 HD2 LYS 137 2HD LYS 137 7.434 -6.102 -11.321 1031 HD3 LYS 137 1HD LYS 137 9.172 -6.354 -11.160 1032 HE2 LYS 137 2HE LYS 137 7.173 -8.540 -11.727 1033 HE3 LYS 137 1HE LYS 137 8.110 -7.702 -12.962 1034 HZ1 LYS 137 3HZ LYS 137 9.981 -8.806 -12.416 1035 HZ2 LYS 137 1HZ LYS 137 8.900 -9.956 -11.805 1036 HZ3 LYS 137 2HZ LYS 137 9.629 -8.842 -10.762 1037 H GLU 138 H GLU 138 7.597 -6.729 -6.185 1038 HA GLU 138 HA GLU 138 9.438 -8.915 -5.568 1039 HB2 GLU 138 2HB GLU 138 10.225 -6.548 -6.171 1040 HB3 GLU 138 1HB GLU 138 9.654 -6.081 -4.571 1041 HG2 GLU 138 2HG GLU 138 11.153 -8.070 -3.778 1042 HG3 GLU 138 1HG GLU 138 11.952 -7.819 -5.339 1043 H ALA 139 H ALA 139 7.885 -6.326 -3.708 1044 HA ALA 139 HA ALA 139 8.089 -7.481 -1.204 1045 HB1 ALA 139 1HB ALA 139 6.369 -5.955 -0.491 1046 HB2 ALA 139 2HB ALA 139 5.834 -5.722 -2.155 1047 HB3 ALA 139 3HB ALA 139 7.420 -5.143 -1.649 1048 H GLN 140 H GLN 140 5.921 -8.245 -3.808 1049 HA GLN 140 HA GLN 140 3.925 -9.523 -2.281 1050 HB2 GLN 140 2HB GLN 140 3.180 -10.454 -4.407 1051 HB3 GLN 140 1HB GLN 140 3.503 -8.726 -4.536 1052 HG2 GLN 140 2HG GLN 140 4.429 -9.582 -6.468 1053 HG3 GLN 140 1HG GLN 140 5.816 -9.462 -5.391 1054 HE21 GLN 140 1HE2 GLN 140 6.565 -11.021 -7.116 1055 HE22 GLN 140 2HE2 GLN 140 6.309 -12.702 -6.809 1056 H GLU 141 H GLU 141 7.098 -10.491 -3.072 1057 HA GLU 141 HA GLU 141 6.410 -13.286 -2.458 1058 HB2 GLU 141 2HB GLU 141 7.631 -14.048 -4.176 1059 HB3 GLU 141 1HB GLU 141 7.467 -12.401 -4.797 1060 HG2 GLU 141 2HG GLU 141 9.585 -11.925 -3.446 1061 HG3 GLU 141 1HG GLU 141 9.787 -13.677 -3.428 1062 H ARG 142 H ARG 142 8.236 -10.585 -1.471 1063 HA ARG 142 HA ARG 142 10.008 -12.294 0.129 1064 HB2 ARG 142 2HB ARG 142 11.351 -10.229 0.485 1065 HB3 ARG 142 1HB ARG 142 11.232 -10.727 -1.206 1066 HG2 ARG 142 2HG ARG 142 10.862 -8.500 -1.440 1067 HG3 ARG 142 1HG ARG 142 9.195 -9.039 -1.179 1068 HD2 ARG 142 2HD ARG 142 9.740 -7.071 0.167 1069 HD3 ARG 142 1HD ARG 142 9.361 -8.472 1.180 1070 HE ARG 142 HE ARG 142 12.174 -8.092 0.645 1071 HH11 ARG 142 1HH1 ARG 142 9.515 -7.329 2.779 1072 HH12 ARG 142 2HH1 ARG 142 10.539 -6.991 4.133 1073 HH21 ARG 142 1HH2 ARG 142 13.517 -7.648 2.428 1074 HH22 ARG 142 2HH2 ARG 142 12.809 -7.171 3.935 1075 H LEU 143 H LEU 143 7.251 -10.317 0.410 1076 HA LEU 143 HA LEU 143 7.720 -10.005 3.295 1077 HB2 LEU 143 2HB LEU 143 6.721 -8.004 3.242 1078 HB3 LEU 143 1HB LEU 143 7.034 -8.083 1.509 1079 HG LEU 143 HG LEU 143 4.654 -9.244 1.481 1080 HD11 LEU 143 1HD1 LEU 143 3.919 -9.358 3.626 1081 HD12 LEU 143 2HD1 LEU 143 3.336 -7.740 3.232 1082 HD13 LEU 143 3HD1 LEU 143 4.838 -7.942 4.135 1083 HD21 LEU 143 3HD2 LEU 143 5.568 -6.462 1.329 1084 HD22 LEU 143 1HD2 LEU 143 3.835 -6.656 1.589 1085 HD23 LEU 143 2HD2 LEU 143 4.607 -7.407 0.194 1086 H THR 144 H THR 144 5.732 -11.573 0.946 1087 HA THR 144 HA THR 144 3.370 -12.044 2.272 1088 HB THR 144 HB THR 144 3.466 -14.310 1.078 1089 HG1 THR 144 1HG THR 144 5.675 -13.135 -0.220 1090 HG21 THR 144 3HG2 THR 144 3.213 -13.306 -1.157 1091 HG22 THR 144 1HG2 THR 144 3.751 -11.768 -0.485 1092 HG23 THR 144 2HG2 THR 144 2.256 -12.507 0.089 1093 H GLY 145 H GLY 145 3.347 -12.475 4.430 1094 HA2 GLY 145 2HA GLY 145 3.203 -14.474 5.879 1095 HA3 GLY 145 1HA GLY 145 4.808 -14.894 5.305 1096 H ASP 146 H ASP 146 6.300 -14.590 6.807 1097 HA ASP 146 HA ASP 146 6.405 -12.079 8.262 1098 HB2 ASP 146 2HB ASP 146 5.751 -14.695 9.525 1099 HB3 ASP 146 1HB ASP 146 6.845 -13.623 10.393 1100 H ALA 147 H ALA 147 8.021 -13.468 6.245 1101 HA ALA 147 HA ALA 147 10.452 -14.150 7.724 1102 HB1 ALA 147 1HB ALA 147 9.359 -15.301 5.532 1103 HB2 ALA 147 2HB ALA 147 11.064 -15.410 5.964 1104 HB3 ALA 147 3HB ALA 147 10.528 -14.211 4.786 1105 H PHE 148 H PHE 148 9.271 -11.374 7.326 1106 HA PHE 148 HA PHE 148 11.616 -10.114 6.063 1107 HB2 PHE 148 2HB PHE 148 10.143 -8.126 5.751 1108 HB3 PHE 148 1HB PHE 148 9.575 -9.558 4.881 1109 HD1 PHE 148 2HD PHE 148 8.956 -7.311 7.714 1110 HD2 PHE 148 1HD PHE 148 7.534 -10.655 5.498 1111 HE1 PHE 148 2HE PHE 148 6.769 -7.111 8.823 1112 HE2 PHE 148 1HE PHE 148 5.344 -10.460 6.602 1113 HZ PHE 148 HZ PHE 148 4.960 -8.689 8.269 1114 H ARG 149 H ARG 149 9.751 -10.435 8.950 1115 HA ARG 149 HA ARG 149 10.226 -8.160 10.369 1116 HB2 ARG 149 2HB ARG 149 10.502 -10.911 11.564 1117 HB3 ARG 149 1HB ARG 149 9.941 -9.445 12.352 1118 HG2 ARG 149 2HG ARG 149 8.062 -9.519 10.556 1119 HG3 ARG 149 1HG ARG 149 8.516 -11.219 10.432 1120 HD2 ARG 149 2HD ARG 149 7.226 -11.625 12.196 1121 HD3 ARG 149 1HD ARG 149 8.351 -10.681 13.173 1122 HE ARG 149 HE ARG 149 6.399 -9.087 11.792 1123 HH11 ARG 149 1HH1 ARG 149 7.060 -10.937 14.676 1124 HH12 ARG 149 2HH1 ARG 149 5.892 -10.093 15.636 1125 HH21 ARG 149 1HH2 ARG 149 4.861 -7.977 13.052 1126 HH22 ARG 149 2HH2 ARG 149 4.643 -8.413 14.713 1127 H LYS 150 H LYS 150 12.300 -11.032 10.650 1128 HA LYS 150 HA LYS 150 14.620 -9.252 10.894 1129 HB2 LYS 150 2HB LYS 150 13.799 -11.441 12.783 1130 HB3 LYS 150 1HB LYS 150 15.476 -10.926 12.655 1131 HG2 LYS 150 2HG LYS 150 15.110 -9.007 13.765 1132 HG3 LYS 150 1HG LYS 150 13.527 -8.758 13.025 1133 HD2 LYS 150 2HD LYS 150 12.910 -9.183 15.193 1134 HD3 LYS 150 1HD LYS 150 12.867 -10.815 14.527 1135 HE2 LYS 150 2HE LYS 150 15.512 -10.379 15.367 1136 HE3 LYS 150 1HE LYS 150 14.479 -9.759 16.654 1137 HZ1 LYS 150 3HZ LYS 150 13.466 -11.835 16.927 1138 HZ2 LYS 150 1HZ LYS 150 15.113 -12.189 16.764 1139 HZ3 LYS 150 2HZ LYS 150 14.061 -12.434 15.462 1140 H LYS 151 H LYS 151 13.523 -12.591 10.479 1141 HA LYS 151 HA LYS 151 15.965 -13.600 9.490 1142 HB2 LYS 151 2HB LYS 151 13.156 -14.524 9.609 1143 HB3 LYS 151 1HB LYS 151 14.150 -15.258 8.359 1144 HG2 LYS 151 2HG LYS 151 14.903 -15.167 11.271 1145 HG3 LYS 151 1HG LYS 151 14.083 -16.524 10.496 1146 HD2 LYS 151 2HD LYS 151 15.938 -17.099 9.240 1147 HD3 LYS 151 1HD LYS 151 16.631 -15.478 9.335 1148 HE2 LYS 151 2HE LYS 151 16.427 -16.489 11.978 1149 HE3 LYS 151 1HE LYS 151 17.157 -17.744 10.977 1150 HZ1 LYS 151 3HZ LYS 151 19.022 -16.597 11.420 1151 HZ2 LYS 151 1HZ LYS 151 18.206 -15.155 11.758 1152 HZ3 LYS 151 2HZ LYS 151 18.505 -15.602 10.155 1153 H HIS 152 H HIS 152 16.791 -13.777 7.461 1154 HA HIS 152 HA HIS 152 15.690 -12.006 5.452 1155 HB2 HIS 152 2HB HIS 152 18.203 -13.686 5.491 1156 HB3 HIS 152 1HB HIS 152 17.761 -12.592 4.185 1157 HD1 HIS 152 1HD HIS 152 18.679 -10.304 4.379 1158 HD2 HIS 152 2HD HIS 152 18.474 -12.208 8.067 1159 HE1 HIS 152 1HE HIS 152 19.736 -8.715 6.016 1160 HE2 HIS 152 2HE HIS 152 19.678 -9.925 8.224 1161 H LEU 153 H LEU 153 16.250 -15.461 5.888 1162 HA LEU 153 HA LEU 153 15.594 -16.329 3.314 1163 HB2 LEU 153 2HB LEU 153 16.341 -17.526 5.668 1164 HB3 LEU 153 1HB LEU 153 14.692 -18.089 5.479 1165 HG LEU 153 HG LEU 153 16.390 -18.308 3.072 1166 HD11 LEU 153 1HD1 LEU 153 16.855 -20.039 5.497 1167 HD12 LEU 153 2HD1 LEU 153 18.010 -18.921 4.772 1168 HD13 LEU 153 3HD1 LEU 153 17.485 -20.348 3.879 1169 HD21 LEU 153 3HD2 LEU 153 14.474 -20.159 4.487 1170 HD22 LEU 153 1HD2 LEU 153 15.242 -20.477 2.931 1171 HD23 LEU 153 2HD2 LEU 153 14.110 -19.135 3.099 1172 H GLU 154 H GLU 154 13.781 -15.945 2.234 1173 HA GLU 154 HA GLU 154 11.239 -15.904 3.723 1174 HB2 GLU 154 2HB GLU 154 10.375 -14.511 1.847 1175 HB3 GLU 154 1HB GLU 154 11.678 -13.749 2.750 1176 HG2 GLU 154 2HG GLU 154 12.856 -15.197 0.628 1177 HG3 GLU 154 1HG GLU 154 11.501 -14.285 -0.037 1178 H ASP 155 H ASP 155 10.177 -17.748 3.483 1179 HA ASP 155 HA ASP 155 9.434 -19.723 2.611 1180 HB2 ASP 155 2HB ASP 155 8.113 -19.480 0.609 1181 HB3 ASP 155 1HB ASP 155 7.950 -18.013 1.567 1182 H GLU 156 H GLU 156 9.415 -20.867 0.129 1183 HA GLU 156 HA GLU 156 12.284 -21.301 -0.354 1184 HB2 GLU 156 2HB GLU 156 9.891 -23.105 -0.462 1185 HB3 GLU 156 1HB GLU 156 11.314 -23.483 -1.441 1186 HG2 GLU 156 2HG GLU 156 11.465 -24.693 0.602 1187 HG3 GLU 156 1HG GLU 156 12.680 -23.415 0.632 1188 H LEU 157 H LEU 157 9.161 -20.843 -1.930 1189 HA LEU 157 HA LEU 157 10.570 -19.951 -4.334 1190 HB2 LEU 157 2HB LEU 157 9.870 -22.357 -4.587 1191 HB3 LEU 157 1HB LEU 157 8.206 -21.818 -4.457 1192 HG LEU 157 HG LEU 157 8.668 -20.335 -6.470 1193 HD11 LEU 157 1HD1 LEU 157 10.605 -20.438 -7.619 1194 HD12 LEU 157 2HD1 LEU 157 10.856 -22.145 -7.257 1195 HD13 LEU 157 3HD1 LEU 157 11.257 -20.920 -6.054 1196 HD21 LEU 157 3HD2 LEU 157 8.413 -23.278 -6.404 1197 HD22 LEU 157 1HD2 LEU 157 8.799 -22.551 -7.964 1198 HD23 LEU 157 2HD2 LEU 157 7.344 -22.059 -7.098 Start of MODEL 5 1 H1 MET 1 1HT MET 1 -22.826 -22.878 -22.275 2 H2 MET 1 2HT MET 1 -21.729 -24.071 -22.837 3 H3 MET 1 3HT MET 1 -22.492 -23.013 -23.951 4 HA MET 1 HA MET 1 -20.132 -22.536 -23.380 5 HB2 MET 1 2HB MET 1 -22.474 -20.696 -23.327 6 HB3 MET 1 1HB MET 1 -20.900 -20.019 -22.932 7 HG2 MET 1 2HG MET 1 -20.432 -21.508 -25.215 8 HG3 MET 1 1HG MET 1 -22.009 -20.774 -25.496 9 HE1 MET 1 2HE MET 1 -18.365 -19.355 -26.740 10 HE2 MET 1 3HE MET 1 -18.608 -20.780 -25.728 11 HE3 MET 1 1HE MET 1 -17.937 -19.306 -25.030 12 H HIS 2 H HIS 2 -18.665 -22.031 -21.838 13 HA HIS 2 HA HIS 2 -19.542 -22.194 -19.071 14 HB2 HIS 2 2HB HIS 2 -16.880 -22.341 -20.451 15 HB3 HIS 2 1HB HIS 2 -16.963 -22.070 -18.713 16 HD1 HIS 2 1HD HIS 2 -17.684 -24.658 -21.332 17 HD2 HIS 2 2HD HIS 2 -17.663 -24.292 -17.194 18 HE1 HIS 2 1HE HIS 2 -17.913 -27.002 -20.449 19 HE2 HIS 2 2HE HIS 2 -17.978 -26.747 -17.943 20 H HIS 3 H HIS 3 -19.833 -20.486 -17.806 21 HA HIS 3 HA HIS 3 -18.691 -17.907 -18.656 22 HB2 HIS 3 2HB HIS 3 -21.356 -18.657 -17.922 23 HB3 HIS 3 1HB HIS 3 -20.753 -17.492 -16.749 24 HD1 HIS 3 1HD HIS 3 -19.407 -15.391 -18.196 25 HD2 HIS 3 2HD HIS 3 -22.641 -17.366 -19.901 26 HE1 HIS 3 1HE HIS 3 -20.284 -13.838 -19.968 27 HE2 HIS 3 2HE HIS 3 -22.291 -15.019 -20.930 28 H HIS 4 H HIS 4 -18.771 -16.363 -16.551 29 HA HIS 4 HA HIS 4 -16.760 -17.449 -14.819 30 HB2 HIS 4 2HB HIS 4 -17.822 -14.828 -15.466 31 HB3 HIS 4 1HB HIS 4 -17.601 -15.016 -13.730 32 HD1 HIS 4 1HD HIS 4 -15.043 -16.280 -13.294 33 HD2 HIS 4 2HD HIS 4 -15.605 -13.757 -16.548 34 HE1 HIS 4 1HE HIS 4 -12.740 -15.527 -13.966 35 HE2 HIS 4 2HE HIS 4 -13.100 -14.067 -15.990 36 H HIS 5 H HIS 5 -17.070 -16.751 -12.357 37 HA HIS 5 HA HIS 5 -19.207 -18.415 -11.389 38 HB2 HIS 5 2HB HIS 5 -17.118 -16.792 -9.923 39 HB3 HIS 5 1HB HIS 5 -18.250 -17.893 -9.147 40 HD1 HIS 5 1HD HIS 5 -14.934 -17.781 -10.530 41 HD2 HIS 5 2HD HIS 5 -17.901 -20.669 -10.178 42 HE1 HIS 5 1HE HIS 5 -13.766 -19.986 -10.848 43 HE2 HIS 5 2HE HIS 5 -15.596 -21.713 -10.715 44 H HIS 6 H HIS 6 -18.391 -14.972 -11.260 45 HA HIS 6 HA HIS 6 -20.965 -14.411 -9.981 46 HB2 HIS 6 2HB HIS 6 -18.343 -13.130 -9.997 47 HB3 HIS 6 1HB HIS 6 -19.649 -11.986 -10.294 48 HD1 HIS 6 1HD HIS 6 -21.740 -12.397 -8.424 49 HD2 HIS 6 2HD HIS 6 -17.847 -13.393 -7.363 50 HE1 HIS 6 1HE HIS 6 -21.722 -12.452 -5.911 51 HE2 HIS 6 2HE HIS 6 -19.379 -13.141 -5.294 52 H HIS 7 H HIS 7 -20.748 -15.246 -12.777 53 HA HIS 7 HA HIS 7 -21.642 -14.732 -14.805 54 HB2 HIS 7 2HB HIS 7 -23.046 -12.763 -13.020 55 HB3 HIS 7 1HB HIS 7 -23.332 -12.768 -14.758 56 HD1 HIS 7 1HD HIS 7 -24.774 -14.639 -15.709 57 HD2 HIS 7 2HD HIS 7 -23.996 -15.060 -11.649 58 HE1 HIS 7 1HE HIS 7 -26.305 -16.470 -14.918 59 HE2 HIS 7 2HE HIS 7 -25.752 -16.770 -12.478 60 H MET 8 H MET 8 -22.077 -12.636 -16.304 61 HA MET 8 HA MET 8 -19.468 -11.451 -16.601 62 HB2 MET 8 2HB MET 8 -20.544 -10.354 -18.616 63 HB3 MET 8 1HB MET 8 -20.516 -12.121 -18.623 64 HG2 MET 8 2HG MET 8 -22.812 -12.258 -18.123 65 HG3 MET 8 1HG MET 8 -22.899 -10.553 -17.683 66 HE1 MET 8 3HE MET 8 -23.771 -8.637 -20.121 67 HE2 MET 8 1HE MET 8 -22.151 -8.738 -20.812 68 HE3 MET 8 2HE MET 8 -22.366 -8.760 -19.061 69 H SER 9 H SER 9 -18.855 -9.644 -15.639 70 HA SER 9 HA SER 9 -20.835 -7.851 -14.496 71 HB2 SER 9 2HB SER 9 -18.817 -6.700 -13.534 72 HB3 SER 9 1HB SER 9 -18.967 -8.397 -13.077 73 HG SER 9 HG SER 9 -17.326 -8.916 -14.417 74 H ASP 10 H ASP 10 -20.148 -5.412 -14.637 75 HA ASP 10 HA ASP 10 -18.939 -4.481 -17.019 76 HB2 ASP 10 2HB ASP 10 -21.471 -5.454 -17.480 77 HB3 ASP 10 1HB ASP 10 -21.770 -3.737 -17.227 78 H GLY 11 H GLY 11 -18.286 -2.456 -16.661 79 HA2 GLY 11 2HA GLY 11 -19.120 -0.167 -16.023 80 HA3 GLY 11 1HA GLY 11 -19.665 -0.932 -14.538 81 H HIS 12 H HIS 12 -17.722 1.270 -15.057 82 HA HIS 12 HA HIS 12 -15.406 0.073 -13.680 83 HB2 HIS 12 2HB HIS 12 -15.390 2.466 -15.536 84 HB3 HIS 12 1HB HIS 12 -13.984 1.764 -14.722 85 HD1 HIS 12 1HD HIS 12 -13.316 -0.702 -15.530 86 HD2 HIS 12 2HD HIS 12 -16.018 1.336 -17.943 87 HE1 HIS 12 1HE HIS 12 -13.314 -1.927 -17.726 88 HE2 HIS 12 2HE HIS 12 -15.012 -0.720 -19.145 89 H ASN 13 H ASN 13 -16.858 3.286 -14.237 90 HA ASN 13 HA ASN 13 -17.412 4.972 -12.812 91 HB2 ASN 13 2HB ASN 13 -18.107 2.703 -11.426 92 HB3 ASN 13 1HB ASN 13 -17.022 3.507 -10.297 93 HD21 ASN 13 1HD2 ASN 13 -17.924 4.908 -8.984 94 HD22 ASN 13 2HD2 ASN 13 -19.409 5.750 -9.251 95 H GLY 14 H GLY 14 -15.142 3.094 -10.803 96 HA2 GLY 14 2HA GLY 14 -12.741 3.960 -11.016 97 HA3 GLY 14 1HA GLY 14 -13.472 5.519 -10.620 98 H LEU 15 H LEU 15 -11.427 3.940 -9.184 99 HA LEU 15 HA LEU 15 -12.768 3.946 -6.581 100 HB2 LEU 15 2HB LEU 15 -11.410 1.652 -7.877 101 HB3 LEU 15 1HB LEU 15 -11.094 1.892 -6.169 102 HG LEU 15 HG LEU 15 -13.936 2.036 -6.787 103 HD11 LEU 15 1HD1 LEU 15 -14.363 -0.059 -7.611 104 HD12 LEU 15 2HD1 LEU 15 -12.817 -0.711 -7.070 105 HD13 LEU 15 3HD1 LEU 15 -12.885 0.341 -8.485 106 HD21 LEU 15 3HD2 LEU 15 -12.141 0.618 -4.860 107 HD22 LEU 15 1HD2 LEU 15 -13.837 0.156 -5.006 108 HD23 LEU 15 2HD2 LEU 15 -13.409 1.803 -4.546 109 H GLY 16 H GLY 16 -9.665 3.775 -8.314 110 HA2 GLY 16 2HA GLY 16 -8.211 4.716 -6.002 111 HA3 GLY 16 1HA GLY 16 -7.534 4.414 -7.598 112 H LYS 17 H LYS 17 -9.809 6.647 -5.997 113 HA LYS 17 HA LYS 17 -9.748 8.717 -7.807 114 HB2 LYS 17 2HB LYS 17 -10.167 8.573 -4.856 115 HB3 LYS 17 1HB LYS 17 -9.992 10.157 -5.598 116 HG2 LYS 17 2HG LYS 17 -11.966 10.001 -6.735 117 HG3 LYS 17 1HG LYS 17 -11.912 8.238 -6.807 118 HD2 LYS 17 2HD LYS 17 -12.183 9.543 -4.144 119 HD3 LYS 17 1HD LYS 17 -13.591 9.507 -5.207 120 HE2 LYS 17 2HE LYS 17 -13.645 7.164 -5.240 121 HE3 LYS 17 1HE LYS 17 -11.998 7.030 -4.627 122 HZ1 LYS 17 3HZ LYS 17 -13.889 6.562 -3.020 123 HZ2 LYS 17 1HZ LYS 17 -14.159 8.232 -3.006 124 HZ3 LYS 17 2HZ LYS 17 -12.674 7.611 -2.487 125 H GLY 18 H GLY 18 -7.676 8.938 -8.699 126 HA2 GLY 18 2HA GLY 18 -6.095 10.982 -7.758 127 HA3 GLY 18 1HA GLY 18 -5.386 9.510 -7.087 128 H PHE 19 H PHE 19 -5.783 7.742 -9.223 129 HA PHE 19 HA PHE 19 -4.750 8.936 -11.630 130 HB2 PHE 19 2HB PHE 19 -2.658 7.480 -11.573 131 HB3 PHE 19 1HB PHE 19 -2.663 8.909 -10.531 132 HD1 PHE 19 2HD PHE 19 -3.478 8.477 -8.073 133 HD2 PHE 19 1HD PHE 19 -2.024 5.460 -10.694 134 HE1 PHE 19 2HE PHE 19 -2.960 7.053 -6.137 135 HE2 PHE 19 1HE PHE 19 -1.497 4.032 -8.763 136 HZ PHE 19 HZ PHE 19 -1.966 4.826 -6.481 137 H GLY 20 H GLY 20 -4.753 5.758 -9.974 138 HA2 GLY 20 2HA GLY 20 -5.227 4.357 -12.422 139 HA3 GLY 20 1HA GLY 20 -5.252 3.666 -10.802 140 H ASP 21 H ASP 21 -7.071 2.402 -11.535 141 HA ASP 21 HA ASP 21 -9.592 3.918 -11.408 142 HB2 ASP 21 2HB ASP 21 -8.676 1.938 -13.411 143 HB3 ASP 21 1HB ASP 21 -10.342 1.742 -12.841 144 H HIS 22 H HIS 22 -9.001 0.425 -11.606 145 HA HIS 22 HA HIS 22 -9.972 0.142 -8.840 146 HB2 HIS 22 2HB HIS 22 -11.214 -1.908 -9.586 147 HB3 HIS 22 1HB HIS 22 -11.862 -0.400 -10.227 148 HD1 HIS 22 1HD HIS 22 -11.433 0.070 -12.780 149 HD2 HIS 22 2HD HIS 22 -10.313 -3.712 -11.475 150 HE1 HIS 22 1HE HIS 22 -11.113 -1.294 -14.868 151 HE2 HIS 22 2HE HIS 22 -10.491 -3.596 -14.052 152 H ILE 23 H ILE 23 -8.009 -0.356 -7.960 153 HA ILE 23 HA ILE 23 -6.939 -2.987 -8.474 154 HB ILE 23 HB ILE 23 -5.365 -0.488 -9.089 155 HG12 ILE 23 2HG1 ILE 23 -4.834 -2.290 -11.063 156 HG13 ILE 23 1HG1 ILE 23 -6.496 -2.702 -10.656 157 HG21 ILE 23 1HG2 ILE 23 -4.379 -2.863 -7.867 158 HG22 ILE 23 2HG2 ILE 23 -3.513 -1.407 -8.354 159 HG23 ILE 23 3HG2 ILE 23 -3.724 -2.730 -9.497 160 HD11 ILE 23 3HD1 ILE 23 -7.268 -0.908 -11.704 161 HD12 ILE 23 1HD1 ILE 23 -5.637 -0.674 -12.334 162 HD13 ILE 23 2HD1 ILE 23 -6.139 0.152 -10.857 163 H HIS 24 H HIS 24 -5.039 -0.322 -7.195 164 HA HIS 24 HA HIS 24 -4.901 -1.622 -4.612 165 HB2 HIS 24 2HB HIS 24 -3.529 0.954 -5.331 166 HB3 HIS 24 1HB HIS 24 -3.042 -0.265 -4.151 167 HD1 HIS 24 1HD HIS 24 -1.905 0.960 -7.189 168 HD2 HIS 24 2HD HIS 24 -2.656 -2.889 -5.814 169 HE1 HIS 24 1HE HIS 24 -0.530 -0.558 -8.651 170 HE2 HIS 24 2HE HIS 24 -0.901 -2.866 -7.715 171 H TRP 25 H TRP 25 -7.415 -0.479 -5.360 172 HA TRP 25 HA TRP 25 -7.855 1.286 -3.092 173 HB2 TRP 25 2HB TRP 25 -9.388 2.515 -5.045 174 HB3 TRP 25 1HB TRP 25 -7.868 3.131 -4.392 175 HD1 TRP 25 HD TRP 25 -9.377 1.606 -7.484 176 HE1 TRP 25 1HE TRP 25 -7.622 1.604 -9.346 177 HE3 TRP 25 3HE TRP 25 -5.295 2.955 -4.753 178 HZ2 TRP 25 2HZ TRP 25 -4.862 2.125 -9.647 179 HZ3 TRP 25 3HZ TRP 25 -3.142 3.186 -5.895 180 HH2 TRP 25 HH TRP 25 -2.921 2.777 -8.294 181 H ARG 26 H ARG 26 -8.903 -1.111 -5.299 182 HA ARG 26 HA ARG 26 -11.532 -1.120 -5.552 183 HB2 ARG 26 2HB ARG 26 -10.345 -3.107 -6.121 184 HB3 ARG 26 1HB ARG 26 -9.820 -3.308 -4.475 185 HG2 ARG 26 2HG ARG 26 -11.440 -4.971 -4.976 186 HG3 ARG 26 1HG ARG 26 -12.101 -3.849 -3.792 187 HD2 ARG 26 2HD ARG 26 -12.563 -3.423 -6.711 188 HD3 ARG 26 1HD ARG 26 -13.531 -4.617 -5.834 189 HE ARG 26 HE ARG 26 -13.643 -1.725 -5.570 190 HH11 ARG 26 1HH1 ARG 26 -14.566 -4.822 -4.247 191 HH12 ARG 26 2HH1 ARG 26 -15.894 -4.178 -3.343 192 HH21 ARG 26 1HH2 ARG 26 -15.391 -0.881 -4.383 193 HH22 ARG 26 2HH2 ARG 26 -16.363 -1.943 -3.421 194 H THR 27 H THR 27 -9.959 -1.759 -2.412 195 HA THR 27 HA THR 27 -11.554 -0.426 -0.723 196 HB THR 27 HB THR 27 -13.578 -1.461 -1.448 197 HG1 THR 27 1HG THR 27 -14.191 -1.758 0.516 198 HG21 THR 27 3HG2 THR 27 -13.487 -3.438 -2.448 199 HG22 THR 27 1HG2 THR 27 -13.489 -4.134 -0.824 200 HG23 THR 27 2HG2 THR 27 -11.959 -3.854 -1.664 201 H LEU 28 H LEU 28 -10.967 -0.746 1.395 202 HA LEU 28 HA LEU 28 -8.710 -2.456 1.840 203 HB2 LEU 28 2HB LEU 28 -8.939 -0.200 2.844 204 HB3 LEU 28 1HB LEU 28 -10.283 -0.798 3.817 205 HG LEU 28 HG LEU 28 -7.658 -2.201 4.020 206 HD11 LEU 28 1HD1 LEU 28 -6.656 -0.216 4.419 207 HD12 LEU 28 2HD1 LEU 28 -7.392 -0.426 6.008 208 HD13 LEU 28 3HD1 LEU 28 -8.171 0.598 4.802 209 HD21 LEU 28 3HD2 LEU 28 -10.136 -1.870 5.581 210 HD22 LEU 28 1HD2 LEU 28 -8.640 -1.933 6.512 211 HD23 LEU 28 2HD2 LEU 28 -9.061 -3.260 5.432 212 H GLU 29 H GLU 29 -12.123 -2.658 2.408 213 HA GLU 29 HA GLU 29 -12.079 -4.595 4.470 214 HB2 GLU 29 2HB GLU 29 -14.038 -3.131 3.715 215 HB3 GLU 29 1HB GLU 29 -14.275 -4.308 2.427 216 HG2 GLU 29 2HG GLU 29 -14.093 -5.856 4.707 217 HG3 GLU 29 1HG GLU 29 -15.004 -4.437 5.228 218 H ASP 30 H ASP 30 -13.038 -5.087 1.060 219 HA ASP 30 HA ASP 30 -12.909 -7.868 1.117 220 HB2 ASP 30 2HB ASP 30 -13.664 -6.045 -0.748 221 HB3 ASP 30 1HB ASP 30 -12.138 -6.607 -1.442 222 H GLY 31 H GLY 31 -10.379 -5.496 0.723 223 HA2 GLY 31 2HA GLY 31 -8.385 -7.129 -0.395 224 HA3 GLY 31 1HA GLY 31 -8.097 -5.698 0.600 225 H LYS 32 H LYS 32 -9.345 -6.628 2.974 226 HA LYS 32 HA LYS 32 -7.193 -8.135 4.074 227 HB2 LYS 32 2HB LYS 32 -9.025 -6.422 5.111 228 HB3 LYS 32 1HB LYS 32 -9.706 -7.962 5.618 229 HG2 LYS 32 2HG LYS 32 -7.130 -8.327 6.317 230 HG3 LYS 32 1HG LYS 32 -7.272 -6.580 6.517 231 HD2 LYS 32 2HD LYS 32 -9.564 -7.423 7.694 232 HD3 LYS 32 1HD LYS 32 -8.486 -8.771 8.060 233 HE2 LYS 32 2HE LYS 32 -6.895 -7.274 9.083 234 HE3 LYS 32 1HE LYS 32 -7.858 -5.875 8.614 235 HZ1 LYS 32 3HZ LYS 32 -9.676 -7.161 9.982 236 HZ2 LYS 32 1HZ LYS 32 -8.560 -6.144 10.744 237 HZ3 LYS 32 2HZ LYS 32 -8.321 -7.817 10.752 238 H LYS 33 H LYS 33 -10.674 -8.880 3.778 239 HA LYS 33 HA LYS 33 -10.537 -11.532 4.616 240 HB2 LYS 33 2HB LYS 33 -12.645 -10.294 4.363 241 HB3 LYS 33 1HB LYS 33 -12.446 -10.307 2.615 242 HG2 LYS 33 2HG LYS 33 -12.267 -12.960 3.208 243 HG3 LYS 33 1HG LYS 33 -13.430 -12.388 4.418 244 HD2 LYS 33 2HD LYS 33 -15.025 -12.341 2.870 245 HD3 LYS 33 1HD LYS 33 -14.080 -11.195 1.913 246 HE2 LYS 33 2HE LYS 33 -13.195 -13.994 1.746 247 HE3 LYS 33 1HE LYS 33 -14.798 -13.678 1.083 248 HZ1 LYS 33 3HZ LYS 33 -13.439 -11.664 0.022 249 HZ2 LYS 33 1HZ LYS 33 -13.592 -13.169 -0.735 250 HZ3 LYS 33 2HZ LYS 33 -12.192 -12.800 0.137 251 H GLU 34 H GLU 34 -10.076 -10.134 1.413 252 HA GLU 34 HA GLU 34 -9.866 -12.659 0.083 253 HB2 GLU 34 2HB GLU 34 -10.574 -10.644 -1.117 254 HB3 GLU 34 1HB GLU 34 -9.003 -9.900 -0.812 255 HG2 GLU 34 2HG GLU 34 -7.967 -11.100 -2.419 256 HG3 GLU 34 1HG GLU 34 -8.982 -12.528 -2.162 257 H ALA 35 H ALA 35 -7.538 -10.232 1.195 258 HA ALA 35 HA ALA 35 -5.198 -11.376 0.243 259 HB1 ALA 35 1HB ALA 35 -4.166 -10.267 2.340 260 HB2 ALA 35 2HB ALA 35 -5.795 -9.654 2.619 261 HB3 ALA 35 3HB ALA 35 -4.943 -9.247 1.129 262 H ALA 36 H ALA 36 -7.217 -12.338 2.901 263 HA ALA 36 HA ALA 36 -5.349 -13.910 4.319 264 HB1 ALA 36 1HB ALA 36 -7.297 -13.344 5.483 265 HB2 ALA 36 2HB ALA 36 -7.465 -15.071 5.165 266 HB3 ALA 36 3HB ALA 36 -8.346 -13.902 4.180 267 H ALA 37 H ALA 37 -7.820 -14.826 1.918 268 HA ALA 37 HA ALA 37 -7.324 -17.551 1.832 269 HB1 ALA 37 1HB ALA 37 -9.178 -17.102 0.621 270 HB2 ALA 37 2HB ALA 37 -8.031 -17.108 -0.720 271 HB3 ALA 37 3HB ALA 37 -8.536 -15.579 0.002 272 H SER 38 H SER 38 -6.348 -15.507 -0.896 273 HA SER 38 HA SER 38 -4.348 -17.240 -1.794 274 HB2 SER 38 2HB SER 38 -5.538 -15.091 -2.867 275 HB3 SER 38 1HB SER 38 -4.024 -14.331 -2.342 276 HG SER 38 HG SER 38 -3.477 -15.091 -4.273 277 H GLY 39 H GLY 39 -4.313 -14.862 0.717 278 HA2 GLY 39 2HA GLY 39 -2.703 -14.507 2.342 279 HA3 GLY 39 1HA GLY 39 -1.668 -15.677 1.518 280 H LEU 40 H LEU 40 -3.052 -12.972 -0.190 281 HA LEU 40 HA LEU 40 -0.358 -11.952 -0.651 282 HB2 LEU 40 2HB LEU 40 -1.294 -10.720 -2.495 283 HB3 LEU 40 1HB LEU 40 -1.825 -12.387 -2.583 284 HG LEU 40 HG LEU 40 -3.943 -11.436 -1.332 285 HD11 LEU 40 1HD1 LEU 40 -4.100 -9.240 -1.156 286 HD12 LEU 40 2HD1 LEU 40 -3.892 -9.067 -2.897 287 HD13 LEU 40 3HD1 LEU 40 -2.483 -9.078 -1.836 288 HD21 LEU 40 3HD2 LEU 40 -5.022 -11.730 -3.289 289 HD22 LEU 40 1HD2 LEU 40 -3.444 -12.307 -3.825 290 HD23 LEU 40 2HD2 LEU 40 -3.941 -10.650 -4.169 291 HA PRO 41 HA PRO 41 -0.905 -8.738 2.389 292 HB2 PRO 41 2HB PRO 41 1.050 -7.060 1.407 293 HB3 PRO 41 1HB PRO 41 1.355 -8.435 2.472 294 HG2 PRO 41 2HG PRO 41 1.581 -8.264 -0.505 295 HG3 PRO 41 1HG PRO 41 2.679 -9.032 0.655 296 HD2 PRO 41 2HD PRO 41 0.967 -10.484 -0.785 297 HD3 PRO 41 1HD PRO 41 1.294 -10.886 0.913 298 H LEU 42 H LEU 42 -1.271 -6.351 2.425 299 HA LEU 42 HA LEU 42 -2.959 -5.643 0.168 300 HB2 LEU 42 2HB LEU 42 -2.925 -3.676 2.277 301 HB3 LEU 42 1HB LEU 42 -4.259 -4.581 1.610 302 HG LEU 42 HG LEU 42 -2.419 -5.600 3.768 303 HD11 LEU 42 1HD1 LEU 42 -4.818 -3.933 3.827 304 HD12 LEU 42 2HD1 LEU 42 -3.595 -4.209 5.067 305 HD13 LEU 42 3HD1 LEU 42 -4.912 -5.364 4.854 306 HD21 LEU 42 3HD2 LEU 42 -3.235 -7.504 2.737 307 HD22 LEU 42 1HD2 LEU 42 -4.769 -6.742 2.313 308 HD23 LEU 42 2HD2 LEU 42 -4.450 -7.210 3.982 309 H MET 43 H MET 43 -2.927 -3.518 -0.695 310 HA MET 43 HA MET 43 -0.213 -2.416 -0.865 311 HB2 MET 43 2HB MET 43 -1.033 -3.358 -2.962 312 HB3 MET 43 1HB MET 43 -2.488 -2.349 -2.876 313 HG2 MET 43 2HG MET 43 -1.203 -1.133 -4.319 314 HG3 MET 43 1HG MET 43 -0.722 -0.404 -2.791 315 HE1 MET 43 3HE MET 43 1.855 -2.288 -1.572 316 HE2 MET 43 1HE MET 43 1.151 -0.672 -1.597 317 HE3 MET 43 2HE MET 43 2.750 -0.948 -2.290 318 H VAL 44 H VAL 44 -0.344 -0.955 0.817 319 HA VAL 44 HA VAL 44 -2.538 0.901 1.004 320 HB VAL 44 HB VAL 44 0.061 0.975 2.528 321 HG11 VAL 44 1HG1 VAL 44 -2.633 2.018 3.365 322 HG12 VAL 44 2HG1 VAL 44 -1.455 3.007 2.500 323 HG13 VAL 44 3HG1 VAL 44 -1.059 2.348 4.088 324 HG21 VAL 44 3HG2 VAL 44 -2.071 -0.058 4.090 325 HG22 VAL 44 1HG2 VAL 44 -0.560 -0.840 3.630 326 HG23 VAL 44 2HG2 VAL 44 -1.981 -0.992 2.597 327 H ILE 45 H ILE 45 -2.506 2.136 -0.852 328 HA ILE 45 HA ILE 45 -0.149 3.857 -1.225 329 HB ILE 45 HB ILE 45 -2.341 3.715 -3.255 330 HG12 ILE 45 2HG1 ILE 45 -0.210 1.629 -2.780 331 HG13 ILE 45 1HG1 ILE 45 -1.948 1.391 -2.994 332 HG21 ILE 45 1HG2 ILE 45 0.579 3.846 -3.836 333 HG22 ILE 45 2HG2 ILE 45 -0.230 5.269 -3.180 334 HG23 ILE 45 3HG2 ILE 45 -0.775 4.569 -4.703 335 HD11 ILE 45 3HD1 ILE 45 -1.768 1.940 -5.333 336 HD12 ILE 45 1HD1 ILE 45 -0.620 0.665 -4.930 337 HD13 ILE 45 2HD1 ILE 45 -0.057 2.323 -5.145 338 H ILE 46 H ILE 46 -0.434 5.666 -0.043 339 HA ILE 46 HA ILE 46 -3.120 6.868 -0.020 340 HB ILE 46 HB ILE 46 -0.888 7.444 1.916 341 HG12 ILE 46 2HG1 ILE 46 -3.112 5.797 2.864 342 HG13 ILE 46 1HG1 ILE 46 -2.128 4.998 1.638 343 HG21 ILE 46 1HG2 ILE 46 -2.450 8.546 3.212 344 HG22 ILE 46 2HG2 ILE 46 -3.812 7.735 2.445 345 HG23 ILE 46 3HG2 ILE 46 -2.937 8.995 1.577 346 HD11 ILE 46 3HD1 ILE 46 -0.953 6.318 4.064 347 HD12 ILE 46 1HD1 ILE 46 -0.193 5.160 2.972 348 HD13 ILE 46 2HD1 ILE 46 -1.482 4.634 4.057 349 H HIS 47 H HIS 47 -3.401 9.048 -0.433 350 HA HIS 47 HA HIS 47 -1.031 10.545 -1.307 351 HB2 HIS 47 2HB HIS 47 -3.509 10.430 -3.016 352 HB3 HIS 47 1HB HIS 47 -1.922 11.088 -3.433 353 HD1 HIS 47 1HD HIS 47 -0.537 9.589 -4.823 354 HD2 HIS 47 2HD HIS 47 -3.303 7.471 -2.562 355 HE1 HIS 47 1HE HIS 47 -0.275 7.188 -5.519 356 HE2 HIS 47 2HE HIS 47 -2.106 5.970 -4.292 357 H LYS 48 H LYS 48 -1.033 12.340 -0.140 358 HA LYS 48 HA LYS 48 -3.621 13.724 0.274 359 HB2 LYS 48 2HB LYS 48 -1.593 12.991 2.140 360 HB3 LYS 48 1HB LYS 48 -1.678 14.741 2.077 361 HG2 LYS 48 2HG LYS 48 -4.155 14.522 2.430 362 HG3 LYS 48 1HG LYS 48 -3.875 12.811 2.757 363 HD2 LYS 48 2HD LYS 48 -2.035 14.432 4.263 364 HD3 LYS 48 1HD LYS 48 -3.694 14.950 4.562 365 HE2 LYS 48 2HE LYS 48 -3.933 12.238 4.668 366 HE3 LYS 48 1HE LYS 48 -2.318 12.476 5.329 367 HZ1 LYS 48 3HZ LYS 48 -4.834 13.707 6.312 368 HZ2 LYS 48 1HZ LYS 48 -3.292 14.094 6.895 369 HZ3 LYS 48 2HZ LYS 48 -3.907 12.531 7.098 370 H SER 49 H SER 49 -3.263 16.171 0.672 371 HA SER 49 HA SER 49 -2.824 18.170 -0.339 372 HB2 SER 49 2HB SER 49 -0.521 18.825 -0.356 373 HB3 SER 49 1HB SER 49 -0.725 17.715 0.998 374 HG SER 49 HG SER 49 1.134 17.401 -0.522 375 H TRP 50 H TRP 50 -0.933 18.928 -2.289 376 HA TRP 50 HA TRP 50 -2.253 18.440 -4.653 377 HB2 TRP 50 2HB TRP 50 -0.159 19.158 -5.804 378 HB3 TRP 50 1HB TRP 50 -0.639 20.232 -4.484 379 HD1 TRP 50 HD TRP 50 2.049 17.677 -5.442 380 HE1 TRP 50 1HE TRP 50 4.054 17.961 -3.855 381 HE3 TRP 50 3HE TRP 50 0.014 21.026 -2.157 382 HZ2 TRP 50 2HZ TRP 50 4.690 19.411 -1.517 383 HZ3 TRP 50 3HZ TRP 50 1.388 21.811 -0.272 384 HH2 TRP 50 HH TRP 50 3.676 21.019 0.040 385 H CYS 51 H CYS 51 0.607 16.757 -3.403 386 HA CYS 51 HA CYS 51 1.501 14.722 -3.836 387 HB2 CYS 51 2HB CYS 51 -0.431 13.680 -3.081 388 HB3 CYS 51 1HB CYS 51 -1.414 14.310 -4.395 389 H GLY 52 H GLY 52 2.845 14.091 -5.408 390 HA2 GLY 52 2HA GLY 52 2.095 14.692 -8.203 391 HA3 GLY 52 1HA GLY 52 3.755 14.574 -7.613 392 H ALA 53 H ALA 53 3.074 12.194 -5.988 393 HA ALA 53 HA ALA 53 3.804 10.187 -7.803 394 HB1 ALA 53 1HB ALA 53 3.879 8.803 -6.007 395 HB2 ALA 53 2HB ALA 53 2.338 9.374 -5.365 396 HB3 ALA 53 3HB ALA 53 3.800 10.333 -5.134 397 H CYS 54 H CYS 54 0.814 11.664 -7.266 398 HA CYS 54 HA CYS 54 -0.612 9.418 -8.487 399 HB2 CYS 54 2HB CYS 54 -2.680 10.624 -7.696 400 HB3 CYS 54 1HB CYS 54 -1.625 10.040 -6.401 401 H LYS 55 H LYS 55 0.375 12.714 -8.879 402 HA LYS 55 HA LYS 55 -1.415 13.506 -10.900 403 HB2 LYS 55 2HB LYS 55 0.597 14.716 -9.480 404 HB3 LYS 55 1HB LYS 55 1.285 14.635 -11.096 405 HG2 LYS 55 2HG LYS 55 -0.797 15.721 -11.951 406 HG3 LYS 55 1HG LYS 55 -1.293 15.950 -10.264 407 HD2 LYS 55 2HD LYS 55 0.045 17.722 -10.032 408 HD3 LYS 55 1HD LYS 55 1.424 16.857 -10.712 409 HE2 LYS 55 2HE LYS 55 1.201 18.467 -12.303 410 HE3 LYS 55 1HE LYS 55 0.086 17.273 -12.965 411 HZ1 LYS 55 3HZ LYS 55 -0.460 19.873 -11.812 412 HZ2 LYS 55 1HZ LYS 55 -1.527 18.648 -11.341 413 HZ3 LYS 55 2HZ LYS 55 -1.320 19.005 -12.982 414 H ALA 56 H ALA 56 1.936 12.255 -11.152 415 HA ALA 56 HA ALA 56 1.717 12.042 -14.033 416 HB1 ALA 56 1HB ALA 56 3.951 11.742 -14.026 417 HB2 ALA 56 2HB ALA 56 3.901 10.611 -12.673 418 HB3 ALA 56 3HB ALA 56 3.826 12.348 -12.374 419 H LEU 57 H LEU 57 1.092 9.991 -11.332 420 HA LEU 57 HA LEU 57 1.355 7.533 -12.712 421 HB2 LEU 57 2HB LEU 57 0.168 8.394 -10.128 422 HB3 LEU 57 1HB LEU 57 -0.281 6.824 -10.765 423 HG LEU 57 HG LEU 57 1.633 6.818 -9.130 424 HD11 LEU 57 1HD1 LEU 57 1.375 4.891 -10.441 425 HD12 LEU 57 2HD1 LEU 57 3.074 5.338 -10.604 426 HD13 LEU 57 3HD1 LEU 57 1.938 5.705 -11.901 427 HD21 LEU 57 3HD2 LEU 57 3.612 7.842 -9.540 428 HD22 LEU 57 1HD2 LEU 57 2.578 8.940 -10.453 429 HD23 LEU 57 2HD2 LEU 57 3.468 7.667 -11.289 430 H LYS 58 H LYS 58 -1.150 9.941 -12.683 431 HA LYS 58 HA LYS 58 -3.347 8.299 -13.262 432 HB2 LYS 58 2HB LYS 58 -3.060 11.009 -14.522 433 HB3 LYS 58 1HB LYS 58 -4.508 10.212 -13.939 434 HG2 LYS 58 2HG LYS 58 -3.457 10.416 -11.616 435 HG3 LYS 58 1HG LYS 58 -2.358 11.572 -12.367 436 HD2 LYS 58 2HD LYS 58 -5.036 12.181 -13.161 437 HD3 LYS 58 1HD LYS 58 -4.979 12.023 -11.406 438 HE2 LYS 58 2HE LYS 58 -2.736 13.528 -12.514 439 HE3 LYS 58 1HE LYS 58 -4.305 14.266 -12.837 440 HZ1 LYS 58 3HZ LYS 58 -4.788 14.194 -10.474 441 HZ2 LYS 58 1HZ LYS 58 -3.358 15.054 -10.760 442 HZ3 LYS 58 2HZ LYS 58 -3.290 13.473 -10.161 443 HA PRO 59 HA PRO 59 -2.406 8.814 -17.966 444 HB2 PRO 59 2HB PRO 59 -0.025 9.846 -18.718 445 HB3 PRO 59 1HB PRO 59 -1.443 10.859 -18.380 446 HG2 PRO 59 2HG PRO 59 0.883 10.203 -16.599 447 HG3 PRO 59 1HG PRO 59 0.124 11.775 -16.911 448 HD2 PRO 59 2HD PRO 59 -0.439 10.334 -14.704 449 HD3 PRO 59 1HD PRO 59 -1.660 11.340 -15.517 450 H LYS 60 H LYS 60 0.379 8.028 -15.907 451 HA LYS 60 HA LYS 60 1.235 6.007 -17.839 452 HB2 LYS 60 2HB LYS 60 3.199 5.709 -16.487 453 HB3 LYS 60 1HB LYS 60 2.931 7.431 -16.728 454 HG2 LYS 60 2HG LYS 60 1.613 7.148 -14.468 455 HG3 LYS 60 1HG LYS 60 2.731 5.803 -14.262 456 HD2 LYS 60 2HD LYS 60 3.393 8.720 -14.668 457 HD3 LYS 60 1HD LYS 60 3.761 7.714 -13.269 458 HE2 LYS 60 2HE LYS 60 5.792 7.647 -14.281 459 HE3 LYS 60 1HE LYS 60 5.036 6.301 -15.132 460 HZ1 LYS 60 3HZ LYS 60 6.137 8.572 -16.247 461 HZ2 LYS 60 1HZ LYS 60 4.465 8.757 -16.435 462 HZ3 LYS 60 2HZ LYS 60 5.240 7.381 -17.043 463 H PHE 61 H PHE 61 0.248 6.100 -14.387 464 HA PHE 61 HA PHE 61 0.274 3.311 -14.063 465 HB2 PHE 61 2HB PHE 61 0.144 4.925 -12.161 466 HB3 PHE 61 1HB PHE 61 -1.527 5.260 -12.616 467 HD1 PHE 61 1HD PHE 61 -3.175 3.326 -12.611 468 HD2 PHE 61 2HD PHE 61 0.658 3.130 -10.772 469 HE1 PHE 61 1HE PHE 61 -3.927 1.419 -11.250 470 HE2 PHE 61 2HE PHE 61 -0.089 1.229 -9.404 471 HZ PHE 61 HZ PHE 61 -2.385 0.369 -9.644 472 H ALA 62 H ALA 62 -1.780 5.390 -15.830 473 HA ALA 62 HA ALA 62 -4.168 3.934 -15.828 474 HB1 ALA 62 1HB ALA 62 -4.712 5.609 -17.205 475 HB2 ALA 62 2HB ALA 62 -3.714 4.874 -18.460 476 HB3 ALA 62 3HB ALA 62 -3.014 6.060 -17.358 477 H GLU 63 H GLU 63 -1.043 3.352 -16.990 478 HA GLU 63 HA GLU 63 -1.497 1.368 -18.968 479 HB2 GLU 63 2HB GLU 63 0.571 2.825 -18.633 480 HB3 GLU 63 1HB GLU 63 0.970 1.781 -17.267 481 HG2 GLU 63 2HG GLU 63 0.697 -0.122 -19.066 482 HG3 GLU 63 1HG GLU 63 1.028 1.200 -20.187 483 H SER 64 H SER 64 -1.749 1.410 -15.614 484 HA SER 64 HA SER 64 -0.877 -1.091 -14.814 485 HB2 SER 64 2HB SER 64 -3.029 0.738 -13.836 486 HB3 SER 64 1HB SER 64 -2.738 -0.804 -13.052 487 HG SER 64 HG SER 64 -0.706 1.118 -13.495 488 H THR 65 H THR 65 -3.028 -0.654 -17.243 489 HA THR 65 HA THR 65 -5.227 -2.231 -16.773 490 HB THR 65 HB THR 65 -4.744 -3.036 -19.256 491 HG1 THR 65 1HG THR 65 -3.144 -0.713 -19.171 492 HG21 THR 65 3HG2 THR 65 -5.101 -0.194 -19.484 493 HG22 THR 65 1HG2 THR 65 -6.089 -0.853 -18.181 494 HG23 THR 65 2HG2 THR 65 -6.236 -1.504 -19.813 495 H GLU 66 H GLU 66 -1.906 -3.158 -17.391 496 HA GLU 66 HA GLU 66 -2.479 -5.981 -17.320 497 HB2 GLU 66 2HB GLU 66 -0.032 -6.268 -17.392 498 HB3 GLU 66 1HB GLU 66 -0.599 -5.197 -18.675 499 HG2 GLU 66 2HG GLU 66 0.085 -3.753 -16.267 500 HG3 GLU 66 1HG GLU 66 1.439 -4.700 -16.881 501 H ILE 67 H ILE 67 -1.506 -3.430 -15.154 502 HA ILE 67 HA ILE 67 -0.704 -5.150 -13.015 503 HB ILE 67 HB ILE 67 -1.668 -2.291 -12.871 504 HG12 ILE 67 2HG1 ILE 67 1.163 -3.347 -13.025 505 HG13 ILE 67 1HG1 ILE 67 0.285 -2.628 -14.382 506 HG21 ILE 67 1HG2 ILE 67 -0.391 -4.135 -10.902 507 HG22 ILE 67 2HG2 ILE 67 -1.739 -3.018 -10.684 508 HG23 ILE 67 3HG2 ILE 67 -0.092 -2.398 -10.804 509 HD11 ILE 67 3HD1 ILE 67 0.271 -0.912 -12.052 510 HD12 ILE 67 1HD1 ILE 67 0.775 -0.574 -13.707 511 HD13 ILE 67 2HD1 ILE 67 1.906 -1.315 -12.575 512 H SER 68 H SER 68 -3.703 -4.361 -14.393 513 HA SER 68 HA SER 68 -5.384 -4.403 -12.131 514 HB2 SER 68 2HB SER 68 -5.756 -4.071 -14.839 515 HB3 SER 68 1HB SER 68 -6.511 -5.638 -14.547 516 HG SER 68 HG SER 68 -7.226 -3.109 -13.624 517 H GLU 69 H GLU 69 -4.006 -6.933 -14.136 518 HA GLU 69 HA GLU 69 -5.344 -9.005 -12.579 519 HB2 GLU 69 2HB GLU 69 -3.373 -9.528 -14.785 520 HB3 GLU 69 1HB GLU 69 -4.713 -10.530 -14.247 521 HG2 GLU 69 2HG GLU 69 -4.863 -7.979 -15.833 522 HG3 GLU 69 1HG GLU 69 -5.264 -9.609 -16.375 523 H LEU 70 H LEU 70 -2.144 -7.767 -13.320 524 HA LEU 70 HA LEU 70 -0.530 -9.587 -11.972 525 HB2 LEU 70 2HB LEU 70 -0.312 -6.991 -13.126 526 HB3 LEU 70 1HB LEU 70 0.460 -6.946 -11.543 527 HG LEU 70 HG LEU 70 1.134 -9.072 -13.554 528 HD11 LEU 70 1HD1 LEU 70 2.500 -6.411 -13.244 529 HD12 LEU 70 2HD1 LEU 70 1.359 -6.790 -14.539 530 HD13 LEU 70 3HD1 LEU 70 2.880 -7.685 -14.407 531 HD21 LEU 70 3HD2 LEU 70 1.843 -9.411 -11.231 532 HD22 LEU 70 1HD2 LEU 70 2.645 -7.840 -11.247 533 HD23 LEU 70 2HD2 LEU 70 3.224 -9.139 -12.290 534 H SER 71 H SER 71 -2.360 -6.851 -10.851 535 HA SER 71 HA SER 71 -1.473 -6.351 -8.343 536 HB2 SER 71 2HB SER 71 -3.974 -6.025 -9.752 537 HB3 SER 71 1HB SER 71 -4.240 -6.333 -8.035 538 HG SER 71 HG SER 71 -3.097 -4.549 -7.521 539 H HIS 72 H HIS 72 -2.732 -9.387 -9.300 540 HA HIS 72 HA HIS 72 -4.004 -10.305 -7.015 541 HB2 HIS 72 2HB HIS 72 -3.394 -12.558 -7.743 542 HB3 HIS 72 1HB HIS 72 -3.888 -11.578 -9.130 543 HD1 HIS 72 1HD HIS 72 -0.628 -12.553 -7.414 544 HD2 HIS 72 2HD HIS 72 -2.156 -11.765 -11.196 545 HE1 HIS 72 1HE HIS 72 1.266 -12.991 -9.008 546 HE2 HIS 72 2HE HIS 72 0.288 -12.603 -11.299 547 H ASN 73 H ASN 73 -0.815 -9.327 -7.441 548 HA ASN 73 HA ASN 73 0.499 -10.955 -5.521 549 HB2 ASN 73 2HB ASN 73 2.225 -9.091 -5.673 550 HB3 ASN 73 1HB ASN 73 1.848 -9.927 -7.179 551 HD21 ASN 73 1HD2 ASN 73 1.920 -8.527 -8.785 552 HD22 ASN 73 2HD2 ASN 73 1.247 -6.918 -8.768 553 H PHE 74 H PHE 74 -1.181 -7.876 -5.403 554 HA PHE 74 HA PHE 74 -1.127 -7.935 -2.493 555 HB2 PHE 74 2HB PHE 74 -0.306 -5.701 -4.330 556 HB3 PHE 74 1HB PHE 74 -0.930 -5.369 -2.716 557 HD1 PHE 74 2HD PHE 74 1.652 -7.360 -4.486 558 HD2 PHE 74 1HD PHE 74 0.533 -5.357 -0.903 559 HE1 PHE 74 2HE PHE 74 3.895 -7.766 -3.567 560 HE2 PHE 74 1HE PHE 74 2.777 -5.760 0.026 561 HZ PHE 74 HZ PHE 74 4.462 -6.969 -1.312 562 H VAL 75 H VAL 75 -2.745 -5.734 -1.960 563 HA VAL 75 HA VAL 75 -4.955 -5.948 -3.855 564 HB VAL 75 HB VAL 75 -5.314 -7.735 -2.179 565 HG11 VAL 75 1HG1 VAL 75 -5.594 -5.389 -0.311 566 HG12 VAL 75 2HG1 VAL 75 -4.498 -6.763 -0.171 567 HG13 VAL 75 3HG1 VAL 75 -6.232 -6.996 0.037 568 HG21 VAL 75 3HG2 VAL 75 -7.562 -7.521 -2.426 569 HG22 VAL 75 1HG2 VAL 75 -7.090 -6.174 -3.457 570 HG23 VAL 75 2HG2 VAL 75 -7.591 -5.878 -1.794 571 H MET 76 H MET 76 -6.465 -4.473 -3.868 572 HA MET 76 HA MET 76 -6.140 -1.900 -3.804 573 HB2 MET 76 2HB MET 76 -8.632 -1.821 -3.317 574 HB3 MET 76 1HB MET 76 -8.092 -2.786 -4.679 575 HG2 MET 76 2HG MET 76 -8.164 -4.288 -2.191 576 HG3 MET 76 1HG MET 76 -9.736 -3.635 -2.633 577 HE1 MET 76 3HE MET 76 -9.504 -7.288 -3.048 578 HE2 MET 76 1HE MET 76 -10.920 -6.615 -3.857 579 HE3 MET 76 2HE MET 76 -10.342 -5.901 -2.351 580 H VAL 77 H VAL 77 -5.066 -0.815 -2.085 581 HA VAL 77 HA VAL 77 -6.819 -0.308 0.185 582 HB VAL 77 HB VAL 77 -3.895 -0.965 0.536 583 HG11 VAL 77 1HG1 VAL 77 -5.858 0.403 2.274 584 HG12 VAL 77 2HG1 VAL 77 -4.105 0.576 2.186 585 HG13 VAL 77 3HG1 VAL 77 -4.814 -0.795 3.037 586 HG21 VAL 77 3HG2 VAL 77 -5.046 -2.658 2.154 587 HG22 VAL 77 1HG2 VAL 77 -4.912 -3.018 0.434 588 HG23 VAL 77 2HG2 VAL 77 -6.432 -2.412 1.093 589 H ASN 78 H ASN 78 -6.999 1.489 -1.510 590 HA ASN 78 HA ASN 78 -4.908 3.491 -1.379 591 HB2 ASN 78 2HB ASN 78 -6.135 3.122 -3.479 592 HB3 ASN 78 1HB ASN 78 -7.633 3.562 -2.677 593 HD21 ASN 78 1HD2 ASN 78 -4.461 5.065 -2.364 594 HD22 ASN 78 2HD2 ASN 78 -4.944 6.615 -2.983 595 H LEU 79 H LEU 79 -4.809 4.534 0.538 596 HA LEU 79 HA LEU 79 -7.352 5.494 1.672 597 HB2 LEU 79 2HB LEU 79 -4.749 5.339 3.160 598 HB3 LEU 79 1HB LEU 79 -6.364 5.515 3.814 599 HG LEU 79 HG LEU 79 -5.203 3.045 2.525 600 HD11 LEU 79 1HD1 LEU 79 -4.523 3.609 4.878 601 HD12 LEU 79 2HD1 LEU 79 -5.335 2.055 4.677 602 HD13 LEU 79 3HD1 LEU 79 -6.219 3.436 5.329 603 HD21 LEU 79 3HD2 LEU 79 -7.952 3.387 3.711 604 HD22 LEU 79 1HD2 LEU 79 -7.297 1.965 2.897 605 HD23 LEU 79 2HD2 LEU 79 -7.613 3.439 1.980 606 H GLU 80 H GLU 80 -7.062 7.559 2.997 607 HA GLU 80 HA GLU 80 -5.139 9.453 1.984 608 HB2 GLU 80 2HB GLU 80 -7.429 9.178 0.508 609 HB3 GLU 80 1HB GLU 80 -7.874 10.477 1.621 610 HG2 GLU 80 2HG GLU 80 -5.586 11.495 0.906 611 HG3 GLU 80 1HG GLU 80 -5.762 10.415 -0.488 612 H ASP 81 H ASP 81 -6.274 11.801 2.732 613 HA ASP 81 HA ASP 81 -5.911 11.829 5.503 614 HB2 ASP 81 2HB ASP 81 -6.974 14.167 5.309 615 HB3 ASP 81 1HB ASP 81 -5.485 13.858 4.425 616 H GLU 82 H GLU 82 -8.950 12.364 3.700 617 HA GLU 82 HA GLU 82 -10.587 12.401 5.994 618 HB2 GLU 82 2HB GLU 82 -10.911 12.866 3.263 619 HB3 GLU 82 1HB GLU 82 -11.990 11.523 3.614 620 HG2 GLU 82 2HG GLU 82 -13.466 12.898 4.508 621 HG3 GLU 82 1HG GLU 82 -12.268 13.483 5.662 622 H GLU 83 H GLU 83 -9.113 9.784 4.392 623 HA GLU 83 HA GLU 83 -11.071 7.792 4.804 624 HB2 GLU 83 2HB GLU 83 -8.754 7.881 3.456 625 HB3 GLU 83 1HB GLU 83 -8.222 7.001 4.881 626 HG2 GLU 83 2HG GLU 83 -8.906 5.194 3.757 627 HG3 GLU 83 1HG GLU 83 -10.525 5.690 4.265 628 H GLU 84 H GLU 84 -10.064 5.739 6.132 629 HA GLU 84 HA GLU 84 -10.614 6.335 8.818 630 HB2 GLU 84 2HB GLU 84 -10.572 4.068 7.312 631 HB3 GLU 84 1HB GLU 84 -9.150 3.836 8.322 632 HG2 GLU 84 2HG GLU 84 -10.362 3.475 10.166 633 HG3 GLU 84 1HG GLU 84 -11.523 4.742 9.773 634 HA PRO 85 HA PRO 85 -5.769 5.364 9.457 635 HB2 PRO 85 2HB PRO 85 -4.430 6.811 7.452 636 HB3 PRO 85 1HB PRO 85 -4.528 5.047 7.599 637 HG2 PRO 85 2HG PRO 85 -6.184 6.915 5.950 638 HG3 PRO 85 1HG PRO 85 -5.584 5.289 5.555 639 HD2 PRO 85 2HD PRO 85 -8.125 5.638 6.219 640 HD3 PRO 85 1HD PRO 85 -7.229 4.240 6.860 641 H LYS 86 H LYS 86 -4.428 6.774 10.537 642 HA LYS 86 HA LYS 86 -4.439 9.582 10.242 643 HB2 LYS 86 2HB LYS 86 -6.452 8.389 12.039 644 HB3 LYS 86 1HB LYS 86 -5.482 9.675 12.764 645 HG2 LYS 86 2HG LYS 86 -6.553 11.257 11.623 646 HG3 LYS 86 1HG LYS 86 -6.440 10.363 10.106 647 HD2 LYS 86 2HD LYS 86 -8.727 10.447 10.462 648 HD3 LYS 86 1HD LYS 86 -8.300 8.876 11.144 649 HE2 LYS 86 2HE LYS 86 -8.246 9.851 13.377 650 HE3 LYS 86 1HE LYS 86 -8.629 11.435 12.708 651 HZ1 LYS 86 3HZ LYS 86 -10.684 10.201 11.769 652 HZ2 LYS 86 1HZ LYS 86 -10.674 10.684 13.390 653 HZ3 LYS 86 2HZ LYS 86 -10.358 9.072 12.986 654 H ASP 87 H ASP 87 -2.604 7.396 10.540 655 HA ASP 87 HA ASP 87 -1.141 8.329 12.910 656 HB2 ASP 87 2HB ASP 87 -2.351 5.971 13.024 657 HB3 ASP 87 1HB ASP 87 -0.915 5.457 12.128 658 H GLU 88 H GLU 88 1.201 7.329 12.783 659 HA GLU 88 HA GLU 88 2.516 8.516 10.657 660 HB2 GLU 88 2HB GLU 88 3.234 6.803 12.895 661 HB3 GLU 88 1HB GLU 88 4.258 6.535 11.492 662 HG2 GLU 88 2HG GLU 88 5.339 8.176 12.751 663 HG3 GLU 88 1HG GLU 88 4.580 9.041 11.418 664 H ASP 89 H ASP 89 0.926 5.461 10.738 665 HA ASP 89 HA ASP 89 2.344 3.931 8.947 666 HB2 ASP 89 2HB ASP 89 0.281 3.222 10.185 667 HB3 ASP 89 1HB ASP 89 -0.676 4.125 9.002 668 H PHE 90 H PHE 90 0.578 6.851 8.280 669 HA PHE 90 HA PHE 90 0.441 6.310 5.440 670 HB2 PHE 90 2HB PHE 90 -0.344 8.760 5.358 671 HB3 PHE 90 1HB PHE 90 -1.391 7.575 6.148 672 HD1 PHE 90 1HD PHE 90 1.575 9.541 7.322 673 HD2 PHE 90 2HD PHE 90 -2.535 8.574 7.851 674 HE1 PHE 90 1HE PHE 90 1.508 10.950 9.333 675 HE2 PHE 90 2HE PHE 90 -2.608 9.985 9.865 676 HZ PHE 90 HZ PHE 90 -0.586 11.176 10.608 677 H SER 91 H SER 91 2.764 7.583 7.575 678 HA SER 91 HA SER 91 4.588 8.067 5.443 679 HB2 SER 91 2HB SER 91 4.176 10.543 7.068 680 HB3 SER 91 1HB SER 91 4.800 10.363 5.421 681 HG SER 91 HG SER 91 2.796 10.301 4.647 682 HA PRO 92 HA PRO 92 6.422 7.243 9.645 683 HB2 PRO 92 2HB PRO 92 6.972 4.641 9.463 684 HB3 PRO 92 1HB PRO 92 5.337 5.204 9.863 685 HG2 PRO 92 2HG PRO 92 6.417 4.196 7.261 686 HG3 PRO 92 1HG PRO 92 4.838 3.899 8.011 687 HD2 PRO 92 2HD PRO 92 5.343 5.768 6.015 688 HD3 PRO 92 1HD PRO 92 3.940 5.783 7.100 689 H ASP 93 H ASP 93 8.018 8.650 8.479 690 HA ASP 93 HA ASP 93 10.550 7.461 8.414 691 HB2 ASP 93 2HB ASP 93 9.180 6.966 6.048 692 HB3 ASP 93 1HB ASP 93 10.211 8.348 5.653 693 H GLY 94 H GLY 94 9.206 9.930 6.226 694 HA2 GLY 94 2HA GLY 94 10.965 11.889 7.562 695 HA3 GLY 94 1HA GLY 94 10.444 11.989 5.876 696 H GLY 95 H GLY 95 9.011 13.539 5.538 697 HA2 GLY 95 2HA GLY 95 6.920 13.965 7.573 698 HA3 GLY 95 1HA GLY 95 7.817 15.337 6.920 699 H TYR 96 H TYR 96 7.402 13.015 4.532 700 HA TYR 96 HA TYR 96 5.807 14.620 2.917 701 HB2 TYR 96 2HB TYR 96 5.522 12.628 1.485 702 HB3 TYR 96 1HB TYR 96 7.201 12.847 1.995 703 HD1 TYR 96 1HD TYR 96 8.126 11.375 3.799 704 HD2 TYR 96 2HD TYR 96 4.331 10.665 2.019 705 HE1 TYR 96 1HE TYR 96 8.166 9.071 4.654 706 HE2 TYR 96 2HE TYR 96 4.360 8.350 2.849 707 HH TYR 96 HH TYR 96 5.564 6.785 3.894 708 H ILE 97 H ILE 97 3.610 14.184 2.111 709 HA ILE 97 HA ILE 97 1.871 12.752 3.958 710 HB ILE 97 HB ILE 97 0.339 14.814 3.990 711 HG12 ILE 97 2HG1 ILE 97 2.703 16.531 3.809 712 HG13 ILE 97 1HG1 ILE 97 2.241 15.795 2.271 713 HG21 ILE 97 1HG2 ILE 97 2.941 14.704 5.497 714 HG22 ILE 97 2HG2 ILE 97 1.362 14.110 6.013 715 HG23 ILE 97 3HG2 ILE 97 1.652 15.845 5.878 716 HD11 ILE 97 3HD1 ILE 97 0.519 17.513 4.040 717 HD12 ILE 97 1HD1 ILE 97 -0.037 16.688 2.581 718 HD13 ILE 97 2HD1 ILE 97 1.200 17.940 2.469 719 HA PRO 98 HA PRO 98 1.425 10.589 3.075 720 HB2 PRO 98 2HB PRO 98 -1.321 10.087 1.853 721 HB3 PRO 98 1HB PRO 98 -0.525 9.170 3.163 722 HG2 PRO 98 2HG PRO 98 -1.954 11.629 3.350 723 HG3 PRO 98 1HG PRO 98 -1.108 10.734 4.645 724 HD2 PRO 98 2HD PRO 98 -0.128 13.022 3.959 725 HD3 PRO 98 1HD PRO 98 0.986 11.649 4.072 726 H ARG 99 H ARG 99 2.193 8.700 2.098 727 HA ARG 99 HA ARG 99 2.143 8.692 -0.838 728 HB2 ARG 99 2HB ARG 99 4.385 8.608 1.062 729 HB3 ARG 99 1HB ARG 99 4.497 7.460 -0.266 730 HG2 ARG 99 2HG ARG 99 5.644 9.514 -0.789 731 HG3 ARG 99 1HG ARG 99 4.261 9.295 -1.861 732 HD2 ARG 99 2HD ARG 99 3.182 10.737 0.188 733 HD3 ARG 99 1HD ARG 99 4.820 11.379 0.122 734 HE ARG 99 HE ARG 99 3.547 11.219 -2.447 735 HH11 ARG 99 1HH1 ARG 99 3.938 13.165 0.422 736 HH12 ARG 99 2HH1 ARG 99 3.583 14.654 -0.387 737 HH21 ARG 99 1HH2 ARG 99 3.071 13.175 -3.514 738 HH22 ARG 99 2HH2 ARG 99 3.086 14.659 -2.622 739 H ILE 100 H ILE 100 3.497 6.372 -1.293 740 HA ILE 100 HA ILE 100 1.479 4.413 -0.570 741 HB ILE 100 HB ILE 100 2.135 4.627 -2.918 742 HG12 ILE 100 2HG1 ILE 100 3.071 1.969 -1.825 743 HG13 ILE 100 1HG1 ILE 100 1.377 2.435 -1.931 744 HG21 ILE 100 1HG2 ILE 100 4.395 3.711 -3.574 745 HG22 ILE 100 2HG2 ILE 100 4.849 3.864 -1.877 746 HG23 ILE 100 3HG2 ILE 100 4.395 5.295 -2.801 747 HD11 ILE 100 3HD1 ILE 100 3.222 1.535 -4.015 748 HD12 ILE 100 1HD1 ILE 100 2.209 2.908 -4.464 749 HD13 ILE 100 2HD1 ILE 100 1.466 1.406 -3.913 750 H LEU 101 H LEU 101 2.082 2.218 0.029 751 HA LEU 101 HA LEU 101 4.653 1.597 1.055 752 HB2 LEU 101 2HB LEU 101 3.344 1.325 3.447 753 HB3 LEU 101 1HB LEU 101 4.502 2.573 3.057 754 HG LEU 101 HG LEU 101 1.754 3.217 2.257 755 HD11 LEU 101 1HD1 LEU 101 1.256 1.977 4.282 756 HD12 LEU 101 2HD1 LEU 101 1.005 3.704 4.531 757 HD13 LEU 101 3HD1 LEU 101 2.451 2.923 5.169 758 HD21 LEU 101 3HD2 LEU 101 2.928 5.123 2.170 759 HD22 LEU 101 1HD2 LEU 101 4.174 4.519 3.265 760 HD23 LEU 101 2HD2 LEU 101 2.671 5.183 3.912 761 H PHE 102 H PHE 102 4.818 -0.559 1.790 762 HA PHE 102 HA PHE 102 2.498 -2.203 1.049 763 HB2 PHE 102 2HB PHE 102 5.391 -3.017 1.353 764 HB3 PHE 102 1HB PHE 102 4.090 -4.029 0.739 765 HD1 PHE 102 2HD PHE 102 5.587 -0.671 0.041 766 HD2 PHE 102 1HD PHE 102 3.980 -4.280 -1.533 767 HE1 PHE 102 2HE PHE 102 6.056 0.120 -2.237 768 HE2 PHE 102 1HE PHE 102 4.449 -3.498 -3.816 769 HZ PHE 102 HZ PHE 102 5.489 -1.294 -4.171 770 H LEU 103 H LEU 103 1.595 -3.664 2.481 771 HA LEU 103 HA LEU 103 2.861 -3.899 5.117 772 HB2 LEU 103 2HB LEU 103 0.988 -3.228 6.318 773 HB3 LEU 103 1HB LEU 103 1.150 -2.031 5.053 774 HG LEU 103 HG LEU 103 -0.854 -4.268 5.201 775 HD11 LEU 103 1HD1 LEU 103 -2.405 -2.243 5.043 776 HD12 LEU 103 2HD1 LEU 103 -0.987 -1.290 5.480 777 HD13 LEU 103 3HD1 LEU 103 -1.582 -2.534 6.574 778 HD21 LEU 103 3HD2 LEU 103 0.066 -2.605 2.936 779 HD22 LEU 103 1HD2 LEU 103 -1.673 -2.815 3.115 780 HD23 LEU 103 2HD2 LEU 103 -0.630 -4.227 2.946 781 H ASP 104 H ASP 104 2.083 -5.610 6.442 782 HA ASP 104 HA ASP 104 1.693 -8.021 5.023 783 HB2 ASP 104 2HB ASP 104 2.430 -7.271 7.634 784 HB3 ASP 104 1HB ASP 104 0.979 -8.267 7.813 785 HA PRO 105 HA PRO 105 -2.653 -8.358 4.431 786 HB2 PRO 105 2HB PRO 105 -2.951 -11.044 5.117 787 HB3 PRO 105 1HB PRO 105 -2.493 -10.431 3.517 788 HG2 PRO 105 2HG PRO 105 -0.766 -11.484 5.719 789 HG3 PRO 105 1HG PRO 105 -0.619 -11.711 3.960 790 HD2 PRO 105 2HD PRO 105 0.961 -9.998 5.269 791 HD3 PRO 105 1HD PRO 105 0.341 -9.618 3.648 792 H SER 106 H SER 106 -3.379 -7.062 6.096 793 HA SER 106 HA SER 106 -5.170 -7.970 7.889 794 HB2 SER 106 2HB SER 106 -3.800 -7.721 10.100 795 HB3 SER 106 1HB SER 106 -3.722 -9.254 9.214 796 HG SER 106 HG SER 106 -1.720 -7.676 9.886 797 H GLY 107 H GLY 107 -2.595 -5.730 7.247 798 HA2 GLY 107 2HA GLY 107 -3.231 -3.398 6.913 799 HA3 GLY 107 1HA GLY 107 -4.280 -3.560 8.326 800 H LYS 108 H LYS 108 -0.918 -4.673 7.926 801 HA LYS 108 HA LYS 108 -0.172 -2.733 10.034 802 HB2 LYS 108 2HB LYS 108 0.119 -5.656 9.971 803 HB3 LYS 108 1HB LYS 108 1.575 -4.791 10.448 804 HG2 LYS 108 2HG LYS 108 -0.364 -3.539 11.926 805 HG3 LYS 108 1HG LYS 108 -0.916 -5.225 11.899 806 HD2 LYS 108 2HD LYS 108 1.697 -5.599 12.413 807 HD3 LYS 108 1HD LYS 108 1.471 -4.016 13.162 808 HE2 LYS 108 2HE LYS 108 -0.709 -5.308 14.086 809 HE3 LYS 108 1HE LYS 108 0.415 -6.658 13.940 810 HZ1 LYS 108 3HZ LYS 108 1.065 -4.141 15.368 811 HZ2 LYS 108 1HZ LYS 108 1.943 -5.588 15.382 812 HZ3 LYS 108 2HZ LYS 108 0.430 -5.509 16.134 813 H VAL 109 H VAL 109 0.628 -1.324 8.361 814 HA VAL 109 HA VAL 109 2.530 -2.042 6.430 815 HB VAL 109 HB VAL 109 1.225 0.227 6.870 816 HG11 VAL 109 1HG1 VAL 109 2.646 1.997 7.676 817 HG12 VAL 109 2HG1 VAL 109 3.973 0.865 7.934 818 HG13 VAL 109 3HG1 VAL 109 2.515 0.753 8.919 819 HG21 VAL 109 3HG2 VAL 109 3.376 1.220 5.517 820 HG22 VAL 109 1HG2 VAL 109 2.078 0.264 4.804 821 HG23 VAL 109 2HG2 VAL 109 3.576 -0.519 5.303 822 H HIS 110 H HIS 110 4.547 -2.504 6.424 823 HA HIS 110 HA HIS 110 6.067 -2.109 8.918 824 HB2 HIS 110 2HB HIS 110 6.348 -4.243 6.789 825 HB3 HIS 110 1HB HIS 110 7.477 -4.023 8.121 826 HD1 HIS 110 1HD HIS 110 5.746 -3.791 10.525 827 HD2 HIS 110 2HD HIS 110 4.860 -6.401 7.415 828 HE1 HIS 110 1HE HIS 110 4.262 -5.555 11.530 829 HE2 HIS 110 2HE HIS 110 3.824 -7.178 9.653 830 HA PRO 111 HA PRO 111 8.461 0.673 6.395 831 HB2 PRO 111 2HB PRO 111 10.546 1.036 8.109 832 HB3 PRO 111 1HB PRO 111 8.975 1.816 8.329 833 HG2 PRO 111 2HG PRO 111 10.075 -0.636 9.646 834 HG3 PRO 111 1HG PRO 111 9.160 0.704 10.360 835 HD2 PRO 111 2HD PRO 111 8.018 -1.670 9.730 836 HD3 PRO 111 1HD PRO 111 7.133 -0.128 9.637 837 H GLU 112 H GLU 112 8.656 -2.165 5.891 838 HA GLU 112 HA GLU 112 11.557 -2.476 5.462 839 HB2 GLU 112 2HB GLU 112 9.427 -4.340 6.219 840 HB3 GLU 112 1HB GLU 112 10.442 -4.935 4.914 841 HG2 GLU 112 2HG GLU 112 11.569 -3.860 7.479 842 HG3 GLU 112 1HG GLU 112 11.129 -5.554 7.263 843 H ILE 113 H ILE 113 8.415 -3.133 3.927 844 HA ILE 113 HA ILE 113 9.703 -3.297 1.324 845 HB ILE 113 HB ILE 113 6.814 -3.674 2.113 846 HG12 ILE 113 2HG1 ILE 113 8.190 -5.436 3.011 847 HG13 ILE 113 1HG1 ILE 113 7.308 -6.072 1.617 848 HG21 ILE 113 1HG2 ILE 113 7.176 -2.883 -0.241 849 HG22 ILE 113 2HG2 ILE 113 6.397 -4.459 -0.102 850 HG23 ILE 113 3HG2 ILE 113 8.106 -4.355 -0.522 851 HD11 ILE 113 3HD1 ILE 113 9.256 -6.815 0.877 852 HD12 ILE 113 1HD1 ILE 113 10.150 -5.887 2.080 853 HD13 ILE 113 2HD1 ILE 113 9.686 -5.136 0.552 854 H ILE 114 H ILE 114 10.375 -1.172 1.060 855 HA ILE 114 HA ILE 114 8.228 0.762 0.472 856 HB ILE 114 HB ILE 114 9.695 2.565 1.177 857 HG12 ILE 114 2HG1 ILE 114 11.803 1.201 0.550 858 HG13 ILE 114 1HG1 ILE 114 11.903 2.302 1.910 859 HG21 ILE 114 1HG2 ILE 114 9.285 0.363 3.161 860 HG22 ILE 114 2HG2 ILE 114 8.348 1.839 2.934 861 HG23 ILE 114 3HG2 ILE 114 9.968 1.920 3.624 862 HD11 ILE 114 3HD1 ILE 114 12.375 0.650 3.326 863 HD12 ILE 114 1HD1 ILE 114 12.645 -0.343 1.895 864 HD13 ILE 114 2HD1 ILE 114 11.077 -0.369 2.698 865 H ASN 115 H ASN 115 10.279 2.673 -0.512 866 HA ASN 115 HA ASN 115 10.680 1.473 -3.143 867 HB2 ASN 115 2HB ASN 115 9.572 3.681 -3.024 868 HB3 ASN 115 1HB ASN 115 11.010 4.346 -2.236 869 HD21 ASN 115 1HD2 ASN 115 10.308 5.657 -4.367 870 HD22 ASN 115 2HD2 ASN 115 11.306 5.276 -5.743 871 H GLU 116 H GLU 116 12.406 0.120 -2.047 872 HA GLU 116 HA GLU 116 14.760 1.125 -1.006 873 HB2 GLU 116 2HB GLU 116 14.059 -1.370 -2.492 874 HB3 GLU 116 1HB GLU 116 15.763 -1.017 -2.184 875 HG2 GLU 116 2HG GLU 116 13.670 -1.077 -0.027 876 HG3 GLU 116 1HG GLU 116 14.616 -2.486 -0.500 877 H ASN 117 H ASN 117 13.634 1.143 -4.278 878 HA ASN 117 HA ASN 117 16.248 1.796 -5.362 879 HB2 ASN 117 2HB ASN 117 13.702 0.877 -6.423 880 HB3 ASN 117 1HB ASN 117 14.347 2.234 -7.360 881 HD21 ASN 117 1HD2 ASN 117 15.926 1.865 -8.766 882 HD22 ASN 117 2HD2 ASN 117 16.779 0.355 -8.944 883 H GLY 118 H GLY 118 14.034 3.499 -3.650 884 HA2 GLY 118 2HA GLY 118 14.117 5.918 -5.290 885 HA3 GLY 118 1HA GLY 118 13.235 5.706 -3.773 886 H ASN 119 H ASN 119 14.265 7.923 -3.504 887 HA ASN 119 HA ASN 119 17.070 7.995 -2.927 888 HB2 ASN 119 2HB ASN 119 16.537 10.303 -2.061 889 HB3 ASN 119 1HB ASN 119 16.095 10.010 -3.749 890 HD21 ASN 119 1HD2 ASN 119 15.108 11.833 -1.557 891 HD22 ASN 119 2HD2 ASN 119 13.380 11.614 -1.571 892 HA PRO 120 HA PRO 120 16.867 6.715 1.302 893 HB2 PRO 120 2HB PRO 120 19.297 8.198 1.897 894 HB3 PRO 120 1HB PRO 120 19.074 6.449 1.717 895 HG2 PRO 120 2HG PRO 120 20.477 7.974 -0.054 896 HG3 PRO 120 1HG PRO 120 19.628 6.478 -0.504 897 HD2 PRO 120 2HD PRO 120 18.779 9.333 -0.868 898 HD3 PRO 120 1HD PRO 120 18.628 7.955 -1.986 899 H SER 121 H SER 121 15.098 8.703 1.067 900 HA SER 121 HA SER 121 15.015 9.893 3.582 901 HB2 SER 121 2HB SER 121 16.334 11.516 1.460 902 HB3 SER 121 1HB SER 121 15.158 12.349 2.493 903 HG SER 121 HG SER 121 16.555 12.305 4.053 904 H TYR 122 H TYR 122 13.361 8.462 1.867 905 HA TYR 122 HA TYR 122 10.964 9.931 2.020 906 HB2 TYR 122 2HB TYR 122 12.526 10.276 -0.375 907 HB3 TYR 122 1HB TYR 122 10.994 9.492 -0.761 908 HD1 TYR 122 1HD TYR 122 8.854 10.640 0.077 909 HD2 TYR 122 2HD TYR 122 12.635 12.581 -0.045 910 HE1 TYR 122 1HE TYR 122 7.727 12.825 0.143 911 HE2 TYR 122 2HE TYR 122 11.521 14.771 0.028 912 HH TYR 122 HH TYR 122 9.334 15.742 -0.513 913 H LYS 123 H LYS 123 12.563 7.448 0.057 914 HA LYS 123 HA LYS 123 11.930 5.341 -0.567 915 HB2 LYS 123 2HB LYS 123 11.373 5.526 2.367 916 HB3 LYS 123 1HB LYS 123 10.978 4.047 1.512 917 HG2 LYS 123 2HG LYS 123 13.701 5.331 1.607 918 HG3 LYS 123 1HG LYS 123 13.175 3.948 2.583 919 HD2 LYS 123 2HD LYS 123 13.510 2.513 0.903 920 HD3 LYS 123 1HD LYS 123 12.691 3.561 -0.263 921 HE2 LYS 123 2HE LYS 123 15.138 3.056 -0.681 922 HE3 LYS 123 1HE LYS 123 14.665 4.754 -0.723 923 HZ1 LYS 123 3HZ LYS 123 16.760 4.173 0.549 924 HZ2 LYS 123 1HZ LYS 123 15.753 3.487 1.723 925 HZ3 LYS 123 2HZ LYS 123 15.631 5.134 1.362 926 H TYR 124 H TYR 124 9.333 5.629 1.777 927 HA TYR 124 HA TYR 124 7.322 4.391 0.516 928 HB2 TYR 124 2HB TYR 124 7.081 6.919 2.152 929 HB3 TYR 124 1HB TYR 124 5.757 5.790 1.814 930 HD1 TYR 124 2HD TYR 124 5.801 3.530 2.779 931 HD2 TYR 124 1HD TYR 124 8.735 6.416 3.819 932 HE1 TYR 124 2HE TYR 124 6.412 2.182 4.744 933 HE2 TYR 124 1HE TYR 124 9.362 5.077 5.784 934 HH TYR 124 HH TYR 124 7.481 2.499 6.925 935 H PHE 125 H PHE 125 8.530 7.545 -0.381 936 HA PHE 125 HA PHE 125 6.248 8.197 -2.018 937 HB2 PHE 125 2HB PHE 125 7.448 10.050 -1.080 938 HB3 PHE 125 1HB PHE 125 8.985 9.452 -1.721 939 HD1 PHE 125 2HD PHE 125 5.631 10.625 -2.851 940 HD2 PHE 125 1HD PHE 125 9.787 10.307 -3.701 941 HE1 PHE 125 2HE PHE 125 5.320 12.000 -4.870 942 HE2 PHE 125 1HE PHE 125 9.484 11.679 -5.719 943 HZ PHE 125 HZ PHE 125 7.249 12.528 -6.306 944 H TYR 126 H TYR 126 5.852 7.226 -3.870 945 HA TYR 126 HA TYR 126 8.077 6.095 -5.401 946 HB2 TYR 126 2HB TYR 126 5.163 5.507 -5.194 947 HB3 TYR 126 1HB TYR 126 5.960 5.182 -6.740 948 HD1 TYR 126 2HD TYR 126 6.753 4.658 -3.111 949 HD2 TYR 126 1HD TYR 126 6.610 3.001 -7.024 950 HE1 TYR 126 2HE TYR 126 7.582 2.518 -2.229 951 HE2 TYR 126 1HE TYR 126 7.434 0.855 -6.155 952 HH TYR 126 HH TYR 126 8.616 -0.042 -4.288 953 H VAL 127 H VAL 127 7.539 6.135 -7.895 954 HA VAL 127 HA VAL 127 6.252 8.454 -8.915 955 HB VAL 127 HB VAL 127 8.428 9.375 -9.931 956 HG11 VAL 127 1HG1 VAL 127 8.318 9.879 -6.996 957 HG12 VAL 127 2HG1 VAL 127 6.927 10.291 -7.999 958 HG13 VAL 127 3HG1 VAL 127 8.500 11.019 -8.329 959 HG21 VAL 127 3HG2 VAL 127 10.018 8.775 -7.629 960 HG22 VAL 127 1HG2 VAL 127 10.376 8.496 -9.333 961 HG23 VAL 127 2HG2 VAL 127 9.514 7.273 -8.403 962 H SER 128 H SER 128 5.312 7.264 -10.453 963 HA SER 128 HA SER 128 5.248 6.594 -12.685 964 HB2 SER 128 2HB SER 128 7.712 7.250 -12.888 965 HB3 SER 128 1HB SER 128 8.076 5.565 -12.481 966 HG SER 128 HG SER 128 7.972 5.640 -14.671 967 H ALA 129 H ALA 129 4.261 4.796 -13.272 968 HA ALA 129 HA ALA 129 3.850 2.665 -11.530 969 HB1 ALA 129 1HB ALA 129 2.199 2.378 -12.984 970 HB2 ALA 129 2HB ALA 129 3.362 1.697 -14.124 971 HB3 ALA 129 3HB ALA 129 2.999 3.423 -14.158 972 H GLU 130 H GLU 130 6.458 3.261 -13.693 973 HA GLU 130 HA GLU 130 7.311 0.712 -14.358 974 HB2 GLU 130 2HB GLU 130 8.323 3.318 -14.563 975 HB3 GLU 130 1HB GLU 130 9.560 2.409 -13.687 976 HG2 GLU 130 2HG GLU 130 8.378 1.230 -16.155 977 HG3 GLU 130 1HG GLU 130 9.563 2.539 -16.303 978 H GLN 131 H GLN 131 8.612 2.653 -11.642 979 HA GLN 131 HA GLN 131 9.973 0.499 -10.504 980 HB2 GLN 131 2HB GLN 131 10.055 1.829 -8.439 981 HB3 GLN 131 1HB GLN 131 10.621 2.690 -9.865 982 HG2 GLN 131 2HG GLN 131 8.216 3.621 -9.969 983 HG3 GLN 131 1HG GLN 131 8.108 3.083 -8.295 984 HE21 GLN 131 1HE2 GLN 131 8.938 4.332 -6.744 985 HE22 GLN 131 2HE2 GLN 131 9.868 5.762 -7.013 986 H VAL 132 H VAL 132 6.692 1.687 -9.972 987 HA VAL 132 HA VAL 132 6.089 0.234 -7.678 988 HB VAL 132 HB VAL 132 3.896 0.747 -7.977 989 HG11 VAL 132 1HG1 VAL 132 5.222 2.801 -8.342 990 HG12 VAL 132 2HG1 VAL 132 3.613 2.851 -9.064 991 HG13 VAL 132 3HG1 VAL 132 5.026 2.567 -10.077 992 HG21 VAL 132 3HG2 VAL 132 4.300 -0.183 -10.741 993 HG22 VAL 132 1HG2 VAL 132 3.031 1.015 -10.499 994 HG23 VAL 132 2HG2 VAL 132 2.989 -0.508 -9.612 995 H VAL 133 H VAL 133 6.558 -0.838 -10.925 996 HA VAL 133 HA VAL 133 5.221 -3.357 -10.550 997 HB VAL 133 HB VAL 133 5.632 -2.084 -12.792 998 HG11 VAL 133 1HG1 VAL 133 8.247 -2.483 -12.209 999 HG12 VAL 133 2HG1 VAL 133 7.620 -2.252 -13.839 1000 HG13 VAL 133 3HG1 VAL 133 7.918 -3.881 -13.228 1001 HG21 VAL 133 3HG2 VAL 133 5.081 -4.750 -12.085 1002 HG22 VAL 133 1HG2 VAL 133 6.163 -4.805 -13.477 1003 HG23 VAL 133 2HG2 VAL 133 4.647 -3.907 -13.573 1004 H GLN 134 H GLN 134 8.540 -2.140 -10.365 1005 HA GLN 134 HA GLN 134 9.648 -4.801 -10.093 1006 HB2 GLN 134 2HB GLN 134 11.679 -3.412 -9.216 1007 HB3 GLN 134 1HB GLN 134 11.249 -3.354 -10.921 1008 HG2 GLN 134 2HG GLN 134 10.136 -1.253 -10.623 1009 HG3 GLN 134 1HG GLN 134 10.388 -1.330 -8.882 1010 HE21 GLN 134 1HE2 GLN 134 12.904 -1.943 -8.505 1011 HE22 GLN 134 2HE2 GLN 134 13.981 -0.798 -9.259 1012 H GLY 135 H GLY 135 8.425 -2.324 -8.016 1013 HA2 GLY 135 2HA GLY 135 9.412 -3.456 -5.563 1014 HA3 GLY 135 1HA GLY 135 8.211 -2.167 -5.720 1015 H MET 136 H MET 136 6.721 -3.945 -7.667 1016 HA MET 136 HA MET 136 5.192 -5.393 -5.642 1017 HB2 MET 136 2HB MET 136 4.654 -4.276 -8.321 1018 HB3 MET 136 1HB MET 136 3.888 -5.827 -8.004 1019 HG2 MET 136 2HG MET 136 2.569 -4.988 -6.317 1020 HG3 MET 136 1HG MET 136 3.647 -3.630 -6.002 1021 HE1 MET 136 3HE MET 136 0.628 -4.680 -8.835 1022 HE2 MET 136 1HE MET 136 2.291 -5.223 -9.050 1023 HE3 MET 136 2HE MET 136 1.660 -3.901 -10.034 1024 H LYS 137 H LYS 137 7.257 -5.781 -8.358 1025 HA LYS 137 HA LYS 137 6.874 -8.559 -8.831 1026 HB2 LYS 137 2HB LYS 137 8.725 -6.406 -9.698 1027 HB3 LYS 137 1HB LYS 137 9.264 -8.052 -9.918 1028 HG2 LYS 137 2HG LYS 137 7.847 -6.644 -11.726 1029 HG3 LYS 137 1HG LYS 137 7.884 -8.399 -11.641 1030 HD2 LYS 137 2HD LYS 137 5.821 -8.440 -10.410 1031 HD3 LYS 137 1HD LYS 137 5.821 -6.681 -10.273 1032 HE2 LYS 137 2HE LYS 137 4.316 -7.164 -12.014 1033 HE3 LYS 137 1HE LYS 137 5.797 -6.643 -12.814 1034 HZ1 LYS 137 3HZ LYS 137 5.205 -9.501 -12.337 1035 HZ2 LYS 137 1HZ LYS 137 6.324 -8.826 -13.412 1036 HZ3 LYS 137 2HZ LYS 137 4.666 -8.697 -13.723 1037 H GLU 138 H GLU 138 8.519 -6.819 -6.416 1038 HA GLU 138 HA GLU 138 10.391 -9.011 -5.900 1039 HB2 GLU 138 2HB GLU 138 10.388 -6.115 -5.366 1040 HB3 GLU 138 1HB GLU 138 11.036 -7.113 -4.064 1041 HG2 GLU 138 2HG GLU 138 12.861 -6.475 -5.425 1042 HG3 GLU 138 1HG GLU 138 12.539 -8.184 -5.763 1043 H ALA 139 H ALA 139 8.457 -6.796 -3.902 1044 HA ALA 139 HA ALA 139 8.409 -8.321 -1.600 1045 HB1 ALA 139 1HB ALA 139 6.163 -6.579 -2.608 1046 HB2 ALA 139 2HB ALA 139 7.592 -6.000 -1.752 1047 HB3 ALA 139 3HB ALA 139 6.447 -7.066 -0.938 1048 H GLN 140 H GLN 140 6.655 -8.758 -4.561 1049 HA GLN 140 HA GLN 140 4.643 -10.464 -3.545 1050 HB2 GLN 140 2HB GLN 140 4.133 -10.933 -5.843 1051 HB3 GLN 140 1HB GLN 140 4.461 -9.214 -5.668 1052 HG2 GLN 140 2HG GLN 140 5.574 -9.761 -7.614 1053 HG3 GLN 140 1HG GLN 140 6.853 -9.829 -6.404 1054 HE21 GLN 140 1HE2 GLN 140 4.353 -11.991 -7.711 1055 HE22 GLN 140 2HE2 GLN 140 5.394 -13.354 -7.915 1056 H GLU 141 H GLU 141 7.952 -10.938 -4.125 1057 HA GLU 141 HA GLU 141 7.679 -13.794 -4.614 1058 HB2 GLU 141 2HB GLU 141 9.314 -12.637 -5.951 1059 HB3 GLU 141 1HB GLU 141 10.095 -11.988 -4.504 1060 HG2 GLU 141 2HG GLU 141 11.145 -13.943 -4.029 1061 HG3 GLU 141 1HG GLU 141 9.883 -14.934 -4.756 1062 H ARG 142 H ARG 142 8.521 -11.621 -2.002 1063 HA ARG 142 HA ARG 142 9.019 -13.992 -0.327 1064 HB2 ARG 142 2HB ARG 142 10.366 -12.082 1.041 1065 HB3 ARG 142 1HB ARG 142 11.108 -13.178 -0.128 1066 HG2 ARG 142 2HG ARG 142 11.933 -11.163 -0.824 1067 HG3 ARG 142 1HG ARG 142 10.486 -11.287 -1.839 1068 HD2 ARG 142 2HD ARG 142 10.281 -9.142 -1.044 1069 HD3 ARG 142 1HD ARG 142 9.354 -10.038 0.170 1070 HE ARG 142 HE ARG 142 10.944 -9.506 1.733 1071 HH11 ARG 142 1HH1 ARG 142 12.203 -8.808 -1.445 1072 HH12 ARG 142 2HH1 ARG 142 13.609 -7.996 -0.846 1073 HH21 ARG 142 1HH2 ARG 142 12.793 -8.438 2.525 1074 HH22 ARG 142 2HH2 ARG 142 13.944 -7.785 1.407 1075 H LEU 143 H LEU 143 7.634 -10.755 -0.471 1076 HA LEU 143 HA LEU 143 6.786 -10.708 2.238 1077 HB2 LEU 143 2HB LEU 143 6.964 -8.852 0.278 1078 HB3 LEU 143 1HB LEU 143 5.227 -9.146 0.289 1079 HG LEU 143 HG LEU 143 5.749 -7.275 1.720 1080 HD11 LEU 143 1HD1 LEU 143 5.083 -9.679 3.409 1081 HD12 LEU 143 2HD1 LEU 143 3.936 -8.823 2.378 1082 HD13 LEU 143 3HD1 LEU 143 4.674 -7.997 3.750 1083 HD21 LEU 143 3HD2 LEU 143 8.076 -7.864 2.219 1084 HD22 LEU 143 1HD2 LEU 143 7.514 -9.178 3.250 1085 HD23 LEU 143 2HD2 LEU 143 7.164 -7.507 3.687 1086 H THR 144 H THR 144 5.595 -12.406 -0.465 1087 HA THR 144 HA THR 144 2.861 -12.425 -0.124 1088 HB THR 144 HB THR 144 3.043 -14.841 -0.937 1089 HG1 THR 144 1HG THR 144 5.741 -14.141 -1.371 1090 HG21 THR 144 3HG2 THR 144 4.188 -12.543 -2.468 1091 HG22 THR 144 1HG2 THR 144 2.584 -13.264 -2.593 1092 HG23 THR 144 2HG2 THR 144 3.997 -14.144 -3.178 1093 H GLY 145 H GLY 145 5.308 -13.817 1.901 1094 HA2 GLY 145 2HA GLY 145 3.171 -14.889 3.635 1095 HA3 GLY 145 1HA GLY 145 4.650 -15.791 3.346 1096 H ASP 146 H ASP 146 5.167 -15.824 5.550 1097 HA ASP 146 HA ASP 146 5.852 -13.217 6.727 1098 HB2 ASP 146 2HB ASP 146 4.798 -15.738 7.850 1099 HB3 ASP 146 1HB ASP 146 6.038 -14.943 8.816 1100 H ALA 147 H ALA 147 7.456 -14.818 4.803 1101 HA ALA 147 HA ALA 147 9.712 -15.739 6.383 1102 HB1 ALA 147 1HB ALA 147 8.989 -15.816 3.489 1103 HB2 ALA 147 2HB ALA 147 9.453 -17.131 4.568 1104 HB3 ALA 147 3HB ALA 147 10.676 -16.013 3.964 1105 H PHE 148 H PHE 148 8.674 -12.901 4.734 1106 HA PHE 148 HA PHE 148 11.069 -11.685 4.037 1107 HB2 PHE 148 2HB PHE 148 9.859 -9.586 4.107 1108 HB3 PHE 148 1HB PHE 148 8.796 -10.844 3.464 1109 HD1 PHE 148 2HD PHE 148 9.502 -8.678 6.344 1110 HD2 PHE 148 1HD PHE 148 6.844 -11.543 4.658 1111 HE1 PHE 148 2HE PHE 148 7.817 -8.110 8.045 1112 HE2 PHE 148 1HE PHE 148 5.154 -10.979 6.355 1113 HZ PHE 148 HZ PHE 148 5.640 -9.260 8.051 1114 H ARG 149 H ARG 149 9.333 -11.603 7.123 1115 HA ARG 149 HA ARG 149 11.043 -9.863 8.470 1116 HB2 ARG 149 2HB ARG 149 10.187 -11.478 10.493 1117 HB3 ARG 149 1HB ARG 149 9.295 -10.109 9.850 1118 HG2 ARG 149 2HG ARG 149 7.864 -11.438 8.641 1119 HG3 ARG 149 1HG ARG 149 8.983 -12.799 8.625 1120 HD2 ARG 149 2HD ARG 149 7.858 -11.834 11.217 1121 HD3 ARG 149 1HD ARG 149 6.875 -12.852 10.167 1122 HE ARG 149 HE ARG 149 9.471 -13.949 10.607 1123 HH11 ARG 149 1HH1 ARG 149 6.300 -13.597 12.019 1124 HH12 ARG 149 2HH1 ARG 149 6.438 -15.023 12.992 1125 HH21 ARG 149 1HH2 ARG 149 9.655 -15.824 11.884 1126 HH22 ARG 149 2HH2 ARG 149 8.344 -16.287 12.917 1127 H LYS 150 H LYS 150 13.085 -10.046 9.074 1128 HA LYS 150 HA LYS 150 14.470 -12.550 8.814 1129 HB2 LYS 150 2HB LYS 150 15.167 -9.773 8.901 1130 HB3 LYS 150 1HB LYS 150 16.126 -10.636 10.094 1131 HG2 LYS 150 2HG LYS 150 17.494 -10.937 8.333 1132 HG3 LYS 150 1HG LYS 150 16.421 -12.301 8.024 1133 HD2 LYS 150 2HD LYS 150 16.043 -11.423 6.010 1134 HD3 LYS 150 1HD LYS 150 15.160 -10.129 6.822 1135 HE2 LYS 150 2HE LYS 150 16.649 -8.753 5.881 1136 HE3 LYS 150 1HE LYS 150 17.771 -9.341 7.107 1137 HZ1 LYS 150 3HZ LYS 150 18.058 -11.225 5.272 1138 HZ2 LYS 150 1HZ LYS 150 18.992 -9.814 5.288 1139 HZ3 LYS 150 2HZ LYS 150 17.653 -9.933 4.259 1140 H LYS 151 H LYS 151 15.874 -13.410 10.531 1141 HA LYS 151 HA LYS 151 14.457 -14.088 12.818 1142 HB2 LYS 151 2HB LYS 151 16.820 -14.701 13.719 1143 HB3 LYS 151 1HB LYS 151 16.173 -15.563 12.330 1144 HG2 LYS 151 2HG LYS 151 17.600 -13.277 11.400 1145 HG3 LYS 151 1HG LYS 151 18.609 -14.155 12.548 1146 HD2 LYS 151 2HD LYS 151 17.171 -15.810 10.576 1147 HD3 LYS 151 1HD LYS 151 18.435 -14.762 9.924 1148 HE2 LYS 151 2HE LYS 151 20.050 -15.714 11.469 1149 HE3 LYS 151 1HE LYS 151 18.794 -16.714 12.197 1150 HZ1 LYS 151 3HZ LYS 151 19.129 -16.975 9.322 1151 HZ2 LYS 151 1HZ LYS 151 18.833 -18.162 10.491 1152 HZ3 LYS 151 2HZ LYS 151 20.400 -17.565 10.268 1153 H HIS 152 H HIS 152 17.269 -11.884 12.665 1154 HA HIS 152 HA HIS 152 16.143 -9.917 14.291 1155 HB2 HIS 152 2HB HIS 152 17.308 -10.248 16.404 1156 HB3 HIS 152 1HB HIS 152 16.275 -11.630 16.054 1157 HD1 HIS 152 1HD HIS 152 18.075 -13.257 14.236 1158 HD2 HIS 152 2HD HIS 152 19.413 -11.382 17.690 1159 HE1 HIS 152 1HE HIS 152 20.156 -14.473 14.890 1160 HE2 HIS 152 2HE HIS 152 20.894 -13.405 17.050 1161 H LEU 153 H LEU 153 19.099 -11.552 13.307 1162 HA LEU 153 HA LEU 153 20.343 -8.907 12.934 1163 HB2 LEU 153 2HB LEU 153 21.440 -11.404 14.139 1164 HB3 LEU 153 1HB LEU 153 22.524 -10.382 13.215 1165 HG LEU 153 HG LEU 153 20.872 -9.133 15.364 1166 HD11 LEU 153 1HD1 LEU 153 22.277 -9.791 17.098 1167 HD12 LEU 153 2HD1 LEU 153 23.512 -10.400 15.997 1168 HD13 LEU 153 3HD1 LEU 153 22.000 -11.284 16.201 1169 HD21 LEU 153 3HD2 LEU 153 22.642 -8.121 13.612 1170 HD22 LEU 153 1HD2 LEU 153 23.726 -8.518 14.944 1171 HD23 LEU 153 2HD2 LEU 153 22.357 -7.439 15.213 1172 H GLU 154 H GLU 154 20.928 -8.475 10.912 1173 HA GLU 154 HA GLU 154 21.919 -10.508 9.139 1174 HB2 GLU 154 2HB GLU 154 19.182 -10.195 9.154 1175 HB3 GLU 154 1HB GLU 154 19.678 -9.146 7.833 1176 HG2 GLU 154 2HG GLU 154 19.198 -11.276 6.917 1177 HG3 GLU 154 1HG GLU 154 20.949 -11.069 6.883 1178 H ASP 155 H ASP 155 20.311 -7.335 8.840 1179 HA ASP 155 HA ASP 155 22.481 -6.407 7.137 1180 HB2 ASP 155 2HB ASP 155 19.897 -5.067 7.964 1181 HB3 ASP 155 1HB ASP 155 21.058 -4.404 6.816 1182 H GLU 156 H GLU 156 20.715 -4.902 9.847 1183 HA GLU 156 HA GLU 156 23.168 -4.324 11.243 1184 HB2 GLU 156 2HB GLU 156 22.501 -2.496 9.343 1185 HB3 GLU 156 1HB GLU 156 21.643 -1.846 10.745 1186 HG2 GLU 156 2HG GLU 156 23.760 -0.806 10.692 1187 HG3 GLU 156 1HG GLU 156 23.808 -1.983 12.004 1188 H LEU 157 H LEU 157 19.848 -3.028 11.032 1189 HA LEU 157 HA LEU 157 19.543 -3.629 13.901 1190 HB2 LEU 157 2HB LEU 157 18.772 -1.289 12.259 1191 HB3 LEU 157 1HB LEU 157 17.612 -1.799 13.472 1192 HG LEU 157 HG LEU 157 20.302 -1.638 14.562 1193 HD11 LEU 157 1HD1 LEU 157 19.962 1.007 14.528 1194 HD12 LEU 157 2HD1 LEU 157 19.280 0.621 12.949 1195 HD13 LEU 157 3HD1 LEU 157 20.937 0.154 13.332 1196 HD21 LEU 157 3HD2 LEU 157 18.858 0.096 15.983 1197 HD22 LEU 157 1HD2 LEU 157 18.735 -1.651 16.202 1198 HD23 LEU 157 2HD2 LEU 157 17.541 -0.798 15.223 Start of MODEL 6 1 H1 MET 1 1HT MET 1 -18.945 35.306 1.046 2 H2 MET 1 2HT MET 1 -20.059 34.974 -0.216 3 H3 MET 1 3HT MET 1 -18.693 35.970 -0.514 4 HA MET 1 HA MET 1 -18.128 33.974 -1.429 5 HB2 MET 1 2HB MET 1 -16.758 35.039 0.696 6 HB3 MET 1 1HB MET 1 -16.914 33.354 1.177 7 HG2 MET 1 2HG MET 1 -16.074 33.734 -1.598 8 HG3 MET 1 1HG MET 1 -14.945 34.371 -0.402 9 HE1 MET 1 2HE MET 1 -13.390 31.435 1.254 10 HE2 MET 1 3HE MET 1 -13.995 33.069 1.529 11 HE3 MET 1 1HE MET 1 -12.913 32.747 0.174 12 H HIS 2 H HIS 2 -18.714 31.927 -1.801 13 HA HIS 2 HA HIS 2 -20.562 30.652 0.036 14 HB2 HIS 2 2HB HIS 2 -20.797 28.965 -1.789 15 HB3 HIS 2 1HB HIS 2 -21.158 30.610 -2.301 16 HD1 HIS 2 1HD HIS 2 -18.457 27.985 -2.584 17 HD2 HIS 2 2HD HIS 2 -19.620 31.552 -4.373 18 HE1 HIS 2 1HE HIS 2 -16.996 28.227 -4.619 19 HE2 HIS 2 2HE HIS 2 -17.777 30.348 -5.731 20 H HIS 3 H HIS 3 -20.321 28.257 0.410 21 HA HIS 3 HA HIS 3 -17.520 27.674 1.098 22 HB2 HIS 3 2HB HIS 3 -18.501 26.099 2.785 23 HB3 HIS 3 1HB HIS 3 -18.888 27.792 3.070 24 HD1 HIS 3 1HD HIS 3 -20.422 24.508 2.567 25 HD2 HIS 3 2HD HIS 3 -21.610 28.483 2.338 26 HE1 HIS 3 1HE HIS 3 -22.936 24.460 2.586 27 HE2 HIS 3 2HE HIS 3 -23.632 26.881 2.534 28 H HIS 4 H HIS 4 -17.159 25.193 1.303 29 HA HIS 4 HA HIS 4 -17.994 24.027 -1.251 30 HB2 HIS 4 2HB HIS 4 -15.660 23.590 0.578 31 HB3 HIS 4 1HB HIS 4 -16.127 22.328 -0.556 32 HD1 HIS 4 1HD HIS 4 -14.901 25.896 -0.489 33 HD2 HIS 4 2HD HIS 4 -15.345 22.744 -3.160 34 HE1 HIS 4 1HE HIS 4 -13.715 26.619 -2.585 35 HE2 HIS 4 2HE HIS 4 -14.073 24.733 -4.216 36 H HIS 5 H HIS 5 -17.943 21.462 -1.064 37 HA HIS 5 HA HIS 5 -19.318 19.711 -0.545 38 HB2 HIS 5 2HB HIS 5 -19.068 18.928 1.793 39 HB3 HIS 5 1HB HIS 5 -17.531 19.366 1.054 40 HD1 HIS 5 1HD HIS 5 -19.853 20.295 3.801 41 HD2 HIS 5 2HD HIS 5 -16.309 21.678 2.131 42 HE1 HIS 5 1HE HIS 5 -18.935 21.956 5.452 43 HE2 HIS 5 2HE HIS 5 -16.746 22.713 4.460 44 H HIS 6 H HIS 6 -21.363 20.414 -1.091 45 HA HIS 6 HA HIS 6 -22.958 21.680 1.023 46 HB2 HIS 6 2HB HIS 6 -22.746 22.461 -1.528 47 HB3 HIS 6 1HB HIS 6 -24.066 21.311 -1.712 48 HD1 HIS 6 1HD HIS 6 -23.209 24.370 0.373 49 HD2 HIS 6 2HD HIS 6 -26.509 22.336 -1.121 50 HE1 HIS 6 1HE HIS 6 -25.195 25.795 0.956 51 HE2 HIS 6 2HE HIS 6 -27.190 24.502 0.117 52 H HIS 7 H HIS 7 -24.312 20.474 2.160 53 HA HIS 7 HA HIS 7 -25.765 18.833 2.775 54 HB2 HIS 7 2HB HIS 7 -26.515 19.361 0.238 55 HB3 HIS 7 1HB HIS 7 -26.035 17.676 0.059 56 HD1 HIS 7 1HD HIS 7 -27.191 16.098 2.091 57 HD2 HIS 7 2HD HIS 7 -29.109 19.596 0.926 58 HE1 HIS 7 1HE HIS 7 -29.576 15.840 2.844 59 HE2 HIS 7 2HE HIS 7 -30.736 17.932 2.053 60 H MET 8 H MET 8 -24.084 17.327 0.012 61 HA MET 8 HA MET 8 -22.369 15.752 1.634 62 HB2 MET 8 2HB MET 8 -25.000 14.768 1.395 63 HB3 MET 8 1HB MET 8 -24.008 13.771 0.326 64 HG2 MET 8 2HG MET 8 -23.552 12.580 2.145 65 HG3 MET 8 1HG MET 8 -22.476 13.904 2.585 66 HE1 MET 8 3HE MET 8 -26.765 13.290 4.026 67 HE2 MET 8 1HE MET 8 -25.693 11.890 4.003 68 HE3 MET 8 2HE MET 8 -26.040 12.760 2.508 69 H SER 9 H SER 9 -22.219 17.429 -0.693 70 HA SER 9 HA SER 9 -21.799 15.701 -2.969 71 HB2 SER 9 2HB SER 9 -20.969 17.817 -4.051 72 HB3 SER 9 1HB SER 9 -22.614 17.917 -3.428 73 HG SER 9 HG SER 9 -20.258 18.912 -2.200 74 H ASP 10 H ASP 10 -20.112 14.351 -2.829 75 HA ASP 10 HA ASP 10 -17.973 13.592 -2.687 76 HB2 ASP 10 2HB ASP 10 -17.742 16.360 -3.615 77 HB3 ASP 10 1HB ASP 10 -16.297 15.783 -2.791 78 H GLY 11 H GLY 11 -18.114 12.883 -0.554 79 HA2 GLY 11 2HA GLY 11 -16.579 14.517 1.342 80 HA3 GLY 11 1HA GLY 11 -18.160 13.928 1.833 81 H HIS 12 H HIS 12 -18.466 11.522 1.650 82 HA HIS 12 HA HIS 12 -16.172 10.227 2.870 83 HB2 HIS 12 2HB HIS 12 -19.082 9.788 2.797 84 HB3 HIS 12 1HB HIS 12 -18.121 8.303 2.751 85 HD1 HIS 12 1HD HIS 12 -19.064 11.143 4.972 86 HD2 HIS 12 2HD HIS 12 -16.653 7.762 5.092 87 HE1 HIS 12 1HE HIS 12 -18.449 10.843 7.391 88 HE2 HIS 12 2HE HIS 12 -16.929 8.834 7.430 89 H ASN 13 H ASN 13 -14.889 10.237 0.893 90 HA ASN 13 HA ASN 13 -15.320 7.792 -0.619 91 HB2 ASN 13 2HB ASN 13 -15.432 10.534 -1.801 92 HB3 ASN 13 1HB ASN 13 -14.678 9.246 -2.737 93 HD21 ASN 13 1HD2 ASN 13 -17.546 10.755 -1.951 94 HD22 ASN 13 2HD2 ASN 13 -18.644 9.577 -2.574 95 H GLY 14 H GLY 14 -13.380 7.779 -2.391 96 HA2 GLY 14 2HA GLY 14 -10.987 8.804 -2.362 97 HA3 GLY 14 1HA GLY 14 -10.964 8.090 -0.744 98 H LEU 15 H LEU 15 -10.147 7.595 -3.920 99 HA LEU 15 HA LEU 15 -9.323 4.915 -3.446 100 HB2 LEU 15 2HB LEU 15 -10.699 3.784 -5.096 101 HB3 LEU 15 1HB LEU 15 -11.697 4.493 -3.843 102 HG LEU 15 HG LEU 15 -11.452 6.383 -5.973 103 HD11 LEU 15 1HD1 LEU 15 -12.158 3.583 -6.807 104 HD12 LEU 15 2HD1 LEU 15 -10.974 4.675 -7.527 105 HD13 LEU 15 3HD1 LEU 15 -12.697 5.010 -7.692 106 HD21 LEU 15 3HD2 LEU 15 -13.871 6.228 -5.977 107 HD22 LEU 15 1HD2 LEU 15 -13.267 6.239 -4.319 108 HD23 LEU 15 2HD2 LEU 15 -13.800 4.726 -5.054 109 H GLY 16 H GLY 16 -9.148 4.025 -6.108 110 HA2 GLY 16 2HA GLY 16 -7.104 5.866 -7.102 111 HA3 GLY 16 1HA GLY 16 -7.274 4.178 -7.541 112 H LYS 17 H LYS 17 -9.669 6.793 -7.547 113 HA LYS 17 HA LYS 17 -10.706 6.046 -10.078 114 HB2 LYS 17 2HB LYS 17 -12.065 8.076 -9.900 115 HB3 LYS 17 1HB LYS 17 -12.075 7.175 -8.388 116 HG2 LYS 17 2HG LYS 17 -10.274 8.733 -7.575 117 HG3 LYS 17 1HG LYS 17 -10.584 9.707 -9.014 118 HD2 LYS 17 2HD LYS 17 -12.070 10.759 -7.690 119 HD3 LYS 17 1HD LYS 17 -13.101 9.377 -8.067 120 HE2 LYS 17 2HE LYS 17 -12.234 8.244 -6.035 121 HE3 LYS 17 1HE LYS 17 -11.338 9.711 -5.644 122 HZ1 LYS 17 3HZ LYS 17 -13.213 10.809 -5.046 123 HZ2 LYS 17 1HZ LYS 17 -13.731 9.240 -4.683 124 HZ3 LYS 17 2HZ LYS 17 -14.206 9.974 -6.131 125 H GLY 18 H GLY 18 -9.985 6.516 -12.046 126 HA2 GLY 18 2HA GLY 18 -9.103 7.801 -13.774 127 HA3 GLY 18 1HA GLY 18 -8.703 9.056 -12.597 128 H PHE 19 H PHE 19 -7.493 6.369 -11.227 129 HA PHE 19 HA PHE 19 -4.807 6.983 -12.116 130 HB2 PHE 19 2HB PHE 19 -5.765 4.950 -10.083 131 HB3 PHE 19 1HB PHE 19 -4.089 5.444 -10.345 132 HD1 PHE 19 2HD PHE 19 -6.065 8.318 -10.703 133 HD2 PHE 19 1HD PHE 19 -4.543 5.656 -7.746 134 HE1 PHE 19 2HE PHE 19 -6.325 10.066 -8.995 135 HE2 PHE 19 1HE PHE 19 -4.800 7.403 -6.038 136 HZ PHE 19 HZ PHE 19 -5.691 9.609 -6.658 137 H GLY 20 H GLY 20 -6.401 3.861 -11.541 138 HA2 GLY 20 2HA GLY 20 -5.445 2.944 -14.172 139 HA3 GLY 20 1HA GLY 20 -5.088 1.995 -12.726 140 H ASP 21 H ASP 21 -7.254 1.889 -11.296 141 HA ASP 21 HA ASP 21 -9.766 1.723 -12.376 142 HB2 ASP 21 2HB ASP 21 -9.925 -0.845 -12.656 143 HB3 ASP 21 1HB ASP 21 -9.223 0.100 -13.977 144 H HIS 22 H HIS 22 -9.217 -1.322 -10.925 145 HA HIS 22 HA HIS 22 -10.204 -0.282 -8.375 146 HB2 HIS 22 2HB HIS 22 -9.768 -3.202 -8.852 147 HB3 HIS 22 1HB HIS 22 -11.031 -2.395 -7.932 148 HD1 HIS 22 1HD HIS 22 -13.199 -1.876 -9.134 149 HD2 HIS 22 2HD HIS 22 -10.228 -3.284 -11.675 150 HE1 HIS 22 1HE HIS 22 -14.344 -2.315 -11.329 151 HE2 HIS 22 2HE HIS 22 -12.547 -3.266 -12.817 152 H ILE 23 H ILE 23 -7.706 -2.403 -9.637 153 HA ILE 23 HA ILE 23 -5.891 -3.354 -8.511 154 HB ILE 23 HB ILE 23 -5.202 -0.431 -8.757 155 HG12 ILE 23 2HG1 ILE 23 -4.948 -2.530 -10.906 156 HG13 ILE 23 1HG1 ILE 23 -6.366 -1.497 -10.756 157 HG21 ILE 23 1HG2 ILE 23 -3.137 -1.029 -8.259 158 HG22 ILE 23 2HG2 ILE 23 -3.129 -2.166 -9.608 159 HG23 ILE 23 3HG2 ILE 23 -3.667 -2.693 -8.013 160 HD11 ILE 23 3HD1 ILE 23 -4.924 -0.552 -12.392 161 HD12 ILE 23 1HD1 ILE 23 -3.540 -0.641 -11.304 162 HD13 ILE 23 2HD1 ILE 23 -4.862 0.475 -10.959 163 H HIS 24 H HIS 24 -4.642 -0.602 -7.043 164 HA HIS 24 HA HIS 24 -4.799 -1.836 -4.451 165 HB2 HIS 24 2HB HIS 24 -3.385 0.735 -5.063 166 HB3 HIS 24 1HB HIS 24 -2.994 -0.486 -3.845 167 HD1 HIS 24 1HD HIS 24 -1.454 0.722 -6.636 168 HD2 HIS 24 2HD HIS 24 -2.691 -3.117 -5.649 169 HE1 HIS 24 1HE HIS 24 -0.064 -0.819 -8.056 170 HE2 HIS 24 2HE HIS 24 -0.942 -3.122 -7.549 171 H TRP 25 H TRP 25 -7.261 -0.633 -5.450 172 HA TRP 25 HA TRP 25 -7.817 1.051 -3.143 173 HB2 TRP 25 2HB TRP 25 -9.236 2.380 -5.104 174 HB3 TRP 25 1HB TRP 25 -7.761 2.953 -4.330 175 HD1 TRP 25 HD TRP 25 -9.107 1.695 -7.595 176 HE1 TRP 25 1HE TRP 25 -7.258 1.813 -9.352 177 HE3 TRP 25 3HE TRP 25 -5.168 2.733 -4.547 178 HZ2 TRP 25 2HZ TRP 25 -4.459 2.306 -9.453 179 HZ3 TRP 25 3HZ TRP 25 -2.953 3.017 -5.518 180 HH2 TRP 25 HH TRP 25 -2.590 2.810 -7.931 181 H ARG 26 H ARG 26 -8.762 -1.327 -5.370 182 HA ARG 26 HA ARG 26 -11.350 -1.258 -5.867 183 HB2 ARG 26 2HB ARG 26 -9.728 -3.287 -5.701 184 HB3 ARG 26 1HB ARG 26 -10.493 -3.536 -4.133 185 HG2 ARG 26 2HG ARG 26 -11.928 -3.506 -6.778 186 HG3 ARG 26 1HG ARG 26 -11.411 -4.948 -5.894 187 HD2 ARG 26 2HD ARG 26 -13.025 -4.719 -4.297 188 HD3 ARG 26 1HD ARG 26 -13.099 -2.962 -4.462 189 HE ARG 26 HE ARG 26 -14.650 -3.197 -6.151 190 HH11 ARG 26 1HH1 ARG 26 -13.342 -6.324 -5.303 191 HH12 ARG 26 2HH1 ARG 26 -14.542 -7.202 -6.190 192 HH21 ARG 26 1HH2 ARG 26 -16.226 -4.355 -7.316 193 HH22 ARG 26 2HH2 ARG 26 -16.177 -6.085 -7.333 194 H THR 27 H THR 27 -10.210 -2.091 -2.596 195 HA THR 27 HA THR 27 -11.959 -0.468 -1.165 196 HB THR 27 HB THR 27 -13.285 -2.694 -0.314 197 HG1 THR 27 1HG THR 27 -12.394 -3.878 -2.105 198 HG21 THR 27 3HG2 THR 27 -14.899 -1.227 -0.684 199 HG22 THR 27 1HG2 THR 27 -14.923 -1.792 -2.354 200 HG23 THR 27 2HG2 THR 27 -13.950 -0.388 -1.912 201 H LEU 28 H LEU 28 -11.093 -0.301 0.808 202 HA LEU 28 HA LEU 28 -8.867 -1.774 1.608 203 HB2 LEU 28 2HB LEU 28 -9.546 0.507 2.414 204 HB3 LEU 28 1HB LEU 28 -10.741 -0.282 3.445 205 HG LEU 28 HG LEU 28 -7.926 -1.198 3.704 206 HD11 LEU 28 1HD1 LEU 28 -8.767 1.303 5.115 207 HD12 LEU 28 2HD1 LEU 28 -7.986 1.376 3.536 208 HD13 LEU 28 3HD1 LEU 28 -7.151 0.632 4.899 209 HD21 LEU 28 3HD2 LEU 28 -9.408 -2.285 5.131 210 HD22 LEU 28 1HD2 LEU 28 -10.314 -0.812 5.471 211 HD23 LEU 28 2HD2 LEU 28 -8.702 -1.033 6.154 212 H GLU 29 H GLU 29 -12.176 -1.928 2.941 213 HA GLU 29 HA GLU 29 -11.749 -4.024 4.715 214 HB2 GLU 29 2HB GLU 29 -13.797 -2.511 4.469 215 HB3 GLU 29 1HB GLU 29 -14.335 -3.629 3.224 216 HG2 GLU 29 2HG GLU 29 -13.581 -5.103 5.550 217 HG3 GLU 29 1HG GLU 29 -14.696 -3.815 6.005 218 H ASP 30 H ASP 30 -13.233 -4.264 1.475 219 HA ASP 30 HA ASP 30 -13.409 -7.019 1.337 220 HB2 ASP 30 2HB ASP 30 -13.474 -4.796 -0.561 221 HB3 ASP 30 1HB ASP 30 -12.857 -6.293 -1.275 222 H GLY 31 H GLY 31 -10.610 -4.987 0.983 223 HA2 GLY 31 2HA GLY 31 -8.961 -6.866 -0.378 224 HA3 GLY 31 1HA GLY 31 -8.404 -5.450 0.519 225 H LYS 32 H LYS 32 -9.370 -6.068 3.058 226 HA LYS 32 HA LYS 32 -7.332 -7.736 4.032 227 HB2 LYS 32 2HB LYS 32 -9.205 -5.982 5.125 228 HB3 LYS 32 1HB LYS 32 -9.587 -7.537 5.851 229 HG2 LYS 32 2HG LYS 32 -7.427 -7.742 6.782 230 HG3 LYS 32 1HG LYS 32 -6.805 -6.405 5.812 231 HD2 LYS 32 2HD LYS 32 -7.159 -5.209 7.688 232 HD3 LYS 32 1HD LYS 32 -8.829 -5.174 7.119 233 HE2 LYS 32 2HE LYS 32 -8.757 -7.546 8.450 234 HE3 LYS 32 1HE LYS 32 -7.636 -6.576 9.405 235 HZ1 LYS 32 3HZ LYS 32 -10.476 -5.975 8.798 236 HZ2 LYS 32 1HZ LYS 32 -9.417 -4.848 9.487 237 HZ3 LYS 32 2HZ LYS 32 -9.787 -6.277 10.313 238 H LYS 33 H LYS 33 -10.835 -8.330 3.762 239 HA LYS 33 HA LYS 33 -10.861 -10.924 4.761 240 HB2 LYS 33 2HB LYS 33 -12.861 -9.493 4.259 241 HB3 LYS 33 1HB LYS 33 -12.640 -9.875 2.557 242 HG2 LYS 33 2HG LYS 33 -12.656 -12.317 4.003 243 HG3 LYS 33 1HG LYS 33 -14.036 -11.342 4.540 244 HD2 LYS 33 2HD LYS 33 -15.039 -11.392 2.488 245 HD3 LYS 33 1HD LYS 33 -13.506 -11.509 1.620 246 HE2 LYS 33 2HE LYS 33 -13.299 -13.849 2.474 247 HE3 LYS 33 1HE LYS 33 -14.933 -13.699 3.120 248 HZ1 LYS 33 3HZ LYS 33 -15.485 -13.024 0.691 249 HZ2 LYS 33 1HZ LYS 33 -15.315 -14.660 1.091 250 HZ3 LYS 33 2HZ LYS 33 -14.050 -13.840 0.320 251 H GLU 34 H GLU 34 -10.639 -9.882 1.360 252 HA GLU 34 HA GLU 34 -10.370 -12.462 0.278 253 HB2 GLU 34 2HB GLU 34 -10.935 -10.355 -0.983 254 HB3 GLU 34 1HB GLU 34 -9.230 -9.918 -0.884 255 HG2 GLU 34 2HG GLU 34 -8.662 -11.291 -2.542 256 HG3 GLU 34 1HG GLU 34 -9.672 -12.608 -1.920 257 H ALA 35 H ALA 35 -8.014 -10.190 1.553 258 HA ALA 35 HA ALA 35 -5.672 -11.376 0.601 259 HB1 ALA 35 1HB ALA 35 -4.815 -10.384 2.934 260 HB2 ALA 35 2HB ALA 35 -6.364 -9.547 2.818 261 HB3 ALA 35 3HB ALA 35 -5.169 -9.376 1.531 262 H ALA 36 H ALA 36 -7.803 -12.305 3.193 263 HA ALA 36 HA ALA 36 -6.023 -13.991 4.601 264 HB1 ALA 36 1HB ALA 36 -8.195 -15.054 5.421 265 HB2 ALA 36 2HB ALA 36 -9.017 -13.835 4.446 266 HB3 ALA 36 3HB ALA 36 -7.951 -13.341 5.762 267 H ALA 37 H ALA 37 -8.539 -14.743 2.191 268 HA ALA 37 HA ALA 37 -8.111 -17.491 2.048 269 HB1 ALA 37 1HB ALA 37 -9.368 -15.463 0.309 270 HB2 ALA 37 2HB ALA 37 -10.014 -16.976 0.939 271 HB3 ALA 37 3HB ALA 37 -8.930 -16.993 -0.452 272 H SER 38 H SER 38 -7.165 -15.299 -0.588 273 HA SER 38 HA SER 38 -5.311 -17.031 -1.737 274 HB2 SER 38 2HB SER 38 -5.133 -14.016 -1.866 275 HB3 SER 38 1HB SER 38 -4.607 -15.189 -3.083 276 HG SER 38 HG SER 38 -6.847 -15.769 -3.301 277 H GLY 39 H GLY 39 -4.993 -14.884 0.975 278 HA2 GLY 39 2HA GLY 39 -3.298 -14.659 2.515 279 HA3 GLY 39 1HA GLY 39 -2.516 -16.048 1.752 280 H LEU 40 H LEU 40 -3.347 -12.813 0.522 281 HA LEU 40 HA LEU 40 -0.502 -12.459 -0.151 282 HB2 LEU 40 2HB LEU 40 -1.368 -10.911 -1.953 283 HB3 LEU 40 1HB LEU 40 -1.648 -12.623 -2.198 284 HG LEU 40 HG LEU 40 -3.980 -12.133 -1.152 285 HD11 LEU 40 1HD1 LEU 40 -4.498 -10.035 -0.683 286 HD12 LEU 40 2HD1 LEU 40 -4.102 -9.539 -2.328 287 HD13 LEU 40 3HD1 LEU 40 -2.850 -9.556 -1.088 288 HD21 LEU 40 3HD2 LEU 40 -3.687 -10.915 -3.846 289 HD22 LEU 40 1HD2 LEU 40 -4.846 -12.109 -3.264 290 HD23 LEU 40 2HD2 LEU 40 -3.189 -12.592 -3.627 291 HA PRO 41 HA PRO 41 -0.262 -8.941 2.476 292 HB2 PRO 41 2HB PRO 41 1.247 -7.264 0.873 293 HB3 PRO 41 1HB PRO 41 1.897 -8.538 1.909 294 HG2 PRO 41 2HG PRO 41 1.308 -8.592 -1.020 295 HG3 PRO 41 1HG PRO 41 2.700 -9.263 -0.146 296 HD2 PRO 41 2HD PRO 41 0.719 -10.846 -0.975 297 HD3 PRO 41 1HD PRO 41 1.489 -11.110 0.604 298 H LEU 42 H LEU 42 -0.657 -6.588 2.539 299 HA LEU 42 HA LEU 42 -2.923 -5.925 0.815 300 HB2 LEU 42 2HB LEU 42 -2.100 -5.163 3.579 301 HB3 LEU 42 1HB LEU 42 -3.109 -4.061 2.667 302 HG LEU 42 HG LEU 42 -3.864 -6.940 3.111 303 HD11 LEU 42 1HD1 LEU 42 -5.063 -4.740 4.712 304 HD12 LEU 42 2HD1 LEU 42 -3.500 -5.389 5.206 305 HD13 LEU 42 3HD1 LEU 42 -4.899 -6.455 5.089 306 HD21 LEU 42 3HD2 LEU 42 -5.818 -6.440 2.114 307 HD22 LEU 42 1HD2 LEU 42 -4.885 -5.137 1.376 308 HD23 LEU 42 2HD2 LEU 42 -5.876 -4.818 2.801 309 H MET 43 H MET 43 -3.150 -3.740 0.065 310 HA MET 43 HA MET 43 -0.565 -2.396 -0.348 311 HB2 MET 43 2HB MET 43 -1.588 -3.558 -2.361 312 HB3 MET 43 1HB MET 43 -2.884 -2.359 -2.291 313 HG2 MET 43 2HG MET 43 -1.142 -1.798 -3.925 314 HG3 MET 43 1HG MET 43 -1.300 -0.579 -2.665 315 HE1 MET 43 3HE MET 43 1.383 0.362 -1.591 316 HE2 MET 43 1HE MET 43 1.612 -0.952 -0.439 317 HE3 MET 43 2HE MET 43 -0.009 -0.338 -0.767 318 H VAL 44 H VAL 44 -0.897 -1.059 1.447 319 HA VAL 44 HA VAL 44 -3.247 0.612 1.593 320 HB VAL 44 HB VAL 44 -0.738 0.781 3.258 321 HG11 VAL 44 1HG1 VAL 44 -2.581 1.705 4.884 322 HG12 VAL 44 2HG1 VAL 44 -3.418 2.077 3.375 323 HG13 VAL 44 3HG1 VAL 44 -1.820 2.755 3.689 324 HG21 VAL 44 3HG2 VAL 44 -2.259 -0.425 4.943 325 HG22 VAL 44 1HG2 VAL 44 -1.512 -1.371 3.660 326 HG23 VAL 44 2HG2 VAL 44 -3.203 -0.898 3.530 327 H ILE 45 H ILE 45 -2.476 1.308 -0.742 328 HA ILE 45 HA ILE 45 -0.433 3.306 -0.815 329 HB ILE 45 HB ILE 45 -2.563 2.470 -2.772 330 HG12 ILE 45 2HG1 ILE 45 0.443 2.501 -3.060 331 HG13 ILE 45 1HG1 ILE 45 -0.437 1.134 -2.365 332 HG21 ILE 45 1HG2 ILE 45 -2.526 4.568 -3.586 333 HG22 ILE 45 2HG2 ILE 45 -0.957 4.103 -4.242 334 HG23 ILE 45 3HG2 ILE 45 -1.049 4.986 -2.719 335 HD11 ILE 45 3HD1 ILE 45 -1.702 1.729 -4.791 336 HD12 ILE 45 1HD1 ILE 45 -0.687 0.341 -4.409 337 HD13 ILE 45 2HD1 ILE 45 0.033 1.793 -5.104 338 H ILE 46 H ILE 46 -0.601 5.335 -0.103 339 HA ILE 46 HA ILE 46 -3.296 6.487 0.113 340 HB ILE 46 HB ILE 46 -1.007 7.251 1.903 341 HG12 ILE 46 2HG1 ILE 46 -3.050 5.543 3.097 342 HG13 ILE 46 1HG1 ILE 46 -2.119 4.715 1.845 343 HG21 ILE 46 1HG2 ILE 46 -3.062 8.706 1.630 344 HG22 ILE 46 2HG2 ILE 46 -2.652 8.222 3.278 345 HG23 ILE 46 3HG2 ILE 46 -3.956 7.411 2.418 346 HD11 ILE 46 3HD1 ILE 46 -1.301 4.594 4.266 347 HD12 ILE 46 1HD1 ILE 46 -0.789 6.267 4.034 348 HD13 ILE 46 2HD1 ILE 46 -0.120 4.990 3.015 349 H HIS 47 H HIS 47 -3.592 8.600 -0.496 350 HA HIS 47 HA HIS 47 -1.246 10.006 -1.570 351 HB2 HIS 47 2HB HIS 47 -2.638 10.640 -3.572 352 HB3 HIS 47 1HB HIS 47 -2.140 8.945 -3.504 353 HD1 HIS 47 1HD HIS 47 -4.883 10.703 -4.580 354 HD2 HIS 47 2HD HIS 47 -4.498 7.567 -1.881 355 HE1 HIS 47 1HE HIS 47 -7.155 9.631 -4.467 356 HE2 HIS 47 2HE HIS 47 -6.869 7.672 -2.907 357 H LYS 48 H LYS 48 -1.163 11.795 -0.365 358 HA LYS 48 HA LYS 48 -3.681 13.338 -0.108 359 HB2 LYS 48 2HB LYS 48 -1.846 12.471 1.936 360 HB3 LYS 48 1HB LYS 48 -1.946 14.222 1.917 361 HG2 LYS 48 2HG LYS 48 -4.582 13.352 1.711 362 HG3 LYS 48 1HG LYS 48 -3.834 12.280 2.896 363 HD2 LYS 48 2HD LYS 48 -2.911 14.852 3.519 364 HD3 LYS 48 1HD LYS 48 -4.629 15.038 3.163 365 HE2 LYS 48 2HE LYS 48 -4.448 12.733 4.729 366 HE3 LYS 48 1HE LYS 48 -3.341 13.885 5.472 367 HZ1 LYS 48 3HZ LYS 48 -5.226 14.559 6.476 368 HZ2 LYS 48 1HZ LYS 48 -6.239 13.969 5.255 369 HZ3 LYS 48 2HZ LYS 48 -5.441 15.446 5.053 370 H SER 49 H SER 49 -3.537 15.617 -0.212 371 HA SER 49 HA SER 49 -2.772 17.631 -0.949 372 HB2 SER 49 2HB SER 49 -0.391 16.337 0.081 373 HB3 SER 49 1HB SER 49 -0.003 17.374 -1.290 374 HG SER 49 HG SER 49 -1.629 18.250 0.850 375 H TRP 50 H TRP 50 -0.968 18.454 -2.761 376 HA TRP 50 HA TRP 50 -2.028 17.855 -5.214 377 HB2 TRP 50 2HB TRP 50 0.077 18.746 -6.199 378 HB3 TRP 50 1HB TRP 50 -0.559 19.762 -4.897 379 HD1 TRP 50 HD TRP 50 2.278 17.244 -5.593 380 HE1 TRP 50 1HE TRP 50 4.174 17.681 -3.907 381 HE3 TRP 50 3HE TRP 50 -0.021 20.762 -2.683 382 HZ2 TRP 50 2HZ TRP 50 4.634 19.303 -1.643 383 HZ3 TRP 50 3HZ TRP 50 1.216 21.706 -0.775 384 HH2 TRP 50 HH TRP 50 3.494 20.991 -0.268 385 H CYS 51 H CYS 51 0.622 16.262 -3.557 386 HA CYS 51 HA CYS 51 1.912 14.445 -4.083 387 HB2 CYS 51 2HB CYS 51 0.525 12.410 -4.373 388 HB3 CYS 51 1HB CYS 51 -0.041 13.449 -3.072 389 H GLY 52 H GLY 52 3.239 14.699 -5.848 390 HA2 GLY 52 2HA GLY 52 2.358 14.884 -8.528 391 HA3 GLY 52 1HA GLY 52 3.992 14.441 -8.024 392 H ALA 53 H ALA 53 3.138 12.157 -6.468 393 HA ALA 53 HA ALA 53 3.334 10.127 -8.351 394 HB1 ALA 53 1HB ALA 53 3.047 8.624 -6.614 395 HB2 ALA 53 2HB ALA 53 1.902 9.668 -5.772 396 HB3 ALA 53 3HB ALA 53 3.621 10.063 -5.772 397 H CYS 54 H CYS 54 0.633 11.994 -7.404 398 HA CYS 54 HA CYS 54 -1.259 10.107 -8.427 399 HB2 CYS 54 2HB CYS 54 -1.747 12.990 -7.673 400 HB3 CYS 54 1HB CYS 54 -2.957 11.706 -7.821 401 H LYS 55 H LYS 55 0.297 13.076 -9.425 402 HA LYS 55 HA LYS 55 -1.215 13.503 -11.777 403 HB2 LYS 55 2HB LYS 55 1.092 14.673 -10.485 404 HB3 LYS 55 1HB LYS 55 1.349 14.553 -12.220 405 HG2 LYS 55 2HG LYS 55 -0.646 15.814 -12.662 406 HG3 LYS 55 1HG LYS 55 -1.065 15.821 -10.940 407 HD2 LYS 55 2HD LYS 55 1.587 16.837 -11.255 408 HD3 LYS 55 1HD LYS 55 0.518 17.683 -12.374 409 HE2 LYS 55 2HE LYS 55 -1.032 18.107 -10.471 410 HE3 LYS 55 1HE LYS 55 0.174 17.404 -9.392 411 HZ1 LYS 55 3HZ LYS 55 1.590 19.170 -9.677 412 HZ2 LYS 55 1HZ LYS 55 0.092 19.953 -9.757 413 HZ3 LYS 55 2HZ LYS 55 0.943 19.609 -11.177 414 H ALA 56 H ALA 56 1.849 11.802 -11.143 415 HA ALA 56 HA ALA 56 2.294 11.145 -13.887 416 HB1 ALA 56 1HB ALA 56 3.954 9.512 -12.911 417 HB2 ALA 56 2HB ALA 56 3.463 10.100 -11.323 418 HB3 ALA 56 3HB ALA 56 4.192 11.207 -12.485 419 H LEU 57 H LEU 57 0.974 9.285 -11.144 420 HA LEU 57 HA LEU 57 0.702 6.862 -12.468 421 HB2 LEU 57 2HB LEU 57 -0.994 6.282 -10.798 422 HB3 LEU 57 1HB LEU 57 0.433 7.002 -10.086 423 HG LEU 57 HG LEU 57 -0.850 9.173 -9.981 424 HD11 LEU 57 1HD1 LEU 57 -3.436 8.418 -9.847 425 HD12 LEU 57 2HD1 LEU 57 -2.876 7.432 -11.196 426 HD13 LEU 57 3HD1 LEU 57 -2.701 9.185 -11.250 427 HD21 LEU 57 3HD2 LEU 57 -1.785 6.755 -8.446 428 HD22 LEU 57 1HD2 LEU 57 -2.198 8.413 -8.013 429 HD23 LEU 57 2HD2 LEU 57 -0.514 7.889 -7.992 430 H LYS 58 H LYS 58 -1.249 9.731 -12.779 431 HA LYS 58 HA LYS 58 -3.638 8.692 -13.659 432 HB2 LYS 58 2HB LYS 58 -2.165 11.203 -14.159 433 HB3 LYS 58 1HB LYS 58 -3.438 10.818 -15.308 434 HG2 LYS 58 2HG LYS 58 -4.802 10.384 -13.077 435 HG3 LYS 58 1HG LYS 58 -3.617 11.523 -12.436 436 HD2 LYS 58 2HD LYS 58 -5.404 11.990 -14.824 437 HD3 LYS 58 1HD LYS 58 -5.639 12.667 -13.211 438 HE2 LYS 58 2HE LYS 58 -3.753 14.039 -13.385 439 HE3 LYS 58 1HE LYS 58 -3.094 13.112 -14.733 440 HZ1 LYS 58 3HZ LYS 58 -4.571 15.414 -14.901 441 HZ2 LYS 58 1HZ LYS 58 -5.654 14.196 -15.358 442 HZ3 LYS 58 2HZ LYS 58 -4.185 14.373 -16.178 443 HA PRO 59 HA PRO 59 -2.316 8.292 -18.218 444 HB2 PRO 59 2HB PRO 59 0.036 9.222 -19.101 445 HB3 PRO 59 1HB PRO 59 -1.355 10.294 -18.836 446 HG2 PRO 59 2HG PRO 59 1.000 9.773 -17.047 447 HG3 PRO 59 1HG PRO 59 0.272 11.323 -17.509 448 HD2 PRO 59 2HD PRO 59 -0.276 10.089 -15.150 449 HD3 PRO 59 1HD PRO 59 -1.457 11.107 -16.010 450 H LYS 60 H LYS 60 0.209 7.604 -15.883 451 HA LYS 60 HA LYS 60 1.272 5.475 -17.596 452 HB2 LYS 60 2HB LYS 60 3.114 5.322 -16.097 453 HB3 LYS 60 1HB LYS 60 2.803 7.037 -16.346 454 HG2 LYS 60 2HG LYS 60 1.384 6.882 -14.238 455 HG3 LYS 60 1HG LYS 60 2.185 5.347 -13.946 456 HD2 LYS 60 2HD LYS 60 3.092 7.721 -13.015 457 HD3 LYS 60 1HD LYS 60 4.123 6.334 -13.329 458 HE2 LYS 60 2HE LYS 60 5.117 8.322 -14.278 459 HE3 LYS 60 1HE LYS 60 4.612 7.241 -15.574 460 HZ1 LYS 60 3HZ LYS 60 3.597 9.869 -14.843 461 HZ2 LYS 60 1HZ LYS 60 2.446 8.741 -15.356 462 HZ3 LYS 60 2HZ LYS 60 3.739 9.149 -16.368 463 H PHE 61 H PHE 61 -0.125 5.899 -14.350 464 HA PHE 61 HA PHE 61 -0.162 3.142 -13.761 465 HB2 PHE 61 2HB PHE 61 -0.466 5.282 -12.239 466 HB3 PHE 61 1HB PHE 61 -2.175 4.973 -12.550 467 HD1 PHE 61 2HD PHE 61 -3.123 2.731 -11.908 468 HD2 PHE 61 1HD PHE 61 0.753 4.016 -10.716 469 HE1 PHE 61 2HE PHE 61 -3.100 1.020 -10.141 470 HE2 PHE 61 1HE PHE 61 0.783 2.307 -8.949 471 HZ PHE 61 HZ PHE 61 -1.148 0.810 -8.663 472 H ALA 62 H ALA 62 -2.080 5.207 -15.728 473 HA ALA 62 HA ALA 62 -4.468 3.699 -15.793 474 HB1 ALA 62 1HB ALA 62 -4.733 5.758 -16.804 475 HB2 ALA 62 2HB ALA 62 -4.519 4.726 -18.218 476 HB3 ALA 62 3HB ALA 62 -3.165 5.681 -17.608 477 H GLU 63 H GLU 63 -1.304 3.191 -16.830 478 HA GLU 63 HA GLU 63 -1.785 1.229 -18.883 479 HB2 GLU 63 2HB GLU 63 0.221 2.860 -18.646 480 HB3 GLU 63 1HB GLU 63 0.812 1.724 -17.429 481 HG2 GLU 63 2HG GLU 63 1.673 0.445 -19.014 482 HG3 GLU 63 1HG GLU 63 0.084 0.246 -19.751 483 H SER 64 H SER 64 -1.749 1.340 -15.525 484 HA SER 64 HA SER 64 -0.642 -1.041 -14.709 485 HB2 SER 64 2HB SER 64 -3.011 0.455 -13.624 486 HB3 SER 64 1HB SER 64 -2.190 -0.837 -12.768 487 HG SER 64 HG SER 64 -0.869 0.643 -12.104 488 H THR 65 H THR 65 -2.965 -0.924 -17.014 489 HA THR 65 HA THR 65 -4.983 -2.639 -16.332 490 HB THR 65 HB THR 65 -3.745 -3.245 -18.940 491 HG1 THR 65 1HG THR 65 -4.515 -0.600 -18.273 492 HG21 THR 65 3HG2 THR 65 -6.395 -1.962 -18.447 493 HG22 THR 65 1HG2 THR 65 -6.138 -3.690 -18.209 494 HG23 THR 65 2HG2 THR 65 -5.882 -2.971 -19.799 495 H GLU 66 H GLU 66 -1.659 -3.382 -17.219 496 HA GLU 66 HA GLU 66 -2.051 -6.229 -16.850 497 HB2 GLU 66 2HB GLU 66 0.321 -6.446 -17.316 498 HB3 GLU 66 1HB GLU 66 -0.410 -5.369 -18.510 499 HG2 GLU 66 2HG GLU 66 0.556 -3.923 -16.213 500 HG3 GLU 66 1HG GLU 66 1.834 -4.876 -16.964 501 H ILE 67 H ILE 67 -1.002 -3.445 -15.050 502 HA ILE 67 HA ILE 67 0.210 -4.870 -12.911 503 HB ILE 67 HB ILE 67 -1.082 -2.145 -12.943 504 HG12 ILE 67 2HG1 ILE 67 1.825 -2.958 -13.127 505 HG13 ILE 67 1HG1 ILE 67 0.833 -2.373 -14.471 506 HG21 ILE 67 1HG2 ILE 67 0.903 -2.305 -10.947 507 HG22 ILE 67 2HG2 ILE 67 -0.163 -3.695 -10.740 508 HG23 ILE 67 3HG2 ILE 67 -0.833 -2.064 -10.744 509 HD11 ILE 67 3HD1 ILE 67 1.282 -0.273 -13.945 510 HD12 ILE 67 1HD1 ILE 67 2.413 -0.867 -12.730 511 HD13 ILE 67 2HD1 ILE 67 0.744 -0.517 -12.284 512 H SER 68 H SER 68 -3.023 -4.420 -13.963 513 HA SER 68 HA SER 68 -4.396 -4.682 -11.502 514 HB2 SER 68 2HB SER 68 -5.244 -4.156 -13.976 515 HB3 SER 68 1HB SER 68 -5.523 -5.897 -13.992 516 HG SER 68 HG SER 68 -7.366 -4.897 -13.232 517 H GLU 69 H GLU 69 -2.928 -6.913 -13.749 518 HA GLU 69 HA GLU 69 -3.898 -9.274 -12.426 519 HB2 GLU 69 2HB GLU 69 -1.582 -9.103 -14.354 520 HB3 GLU 69 1HB GLU 69 -2.580 -10.505 -13.995 521 HG2 GLU 69 2HG GLU 69 -3.501 -8.010 -15.405 522 HG3 GLU 69 1HG GLU 69 -3.103 -9.545 -16.174 523 H LEU 70 H LEU 70 -0.938 -7.363 -12.550 524 HA LEU 70 HA LEU 70 0.628 -9.040 -10.889 525 HB2 LEU 70 2HB LEU 70 0.763 -6.138 -11.642 526 HB3 LEU 70 1HB LEU 70 1.832 -6.779 -10.393 527 HG LEU 70 HG LEU 70 2.739 -8.395 -12.018 528 HD11 LEU 70 1HD1 LEU 70 1.132 -6.909 -14.086 529 HD12 LEU 70 2HD1 LEU 70 0.676 -8.478 -13.413 530 HD13 LEU 70 3HD1 LEU 70 2.174 -8.314 -14.327 531 HD21 LEU 70 3HD2 LEU 70 4.259 -6.916 -12.792 532 HD22 LEU 70 1HD2 LEU 70 3.392 -5.798 -11.739 533 HD23 LEU 70 2HD2 LEU 70 3.032 -5.843 -13.466 534 H SER 71 H SER 71 -2.001 -6.957 -10.235 535 HA SER 71 HA SER 71 -1.384 -6.243 -7.564 536 HB2 SER 71 2HB SER 71 -3.386 -5.619 -9.367 537 HB3 SER 71 1HB SER 71 -4.214 -6.561 -8.126 538 HG SER 71 HG SER 71 -4.248 -4.499 -7.389 539 H HIS 72 H HIS 72 -2.476 -9.168 -9.006 540 HA HIS 72 HA HIS 72 -3.965 -10.293 -6.927 541 HB2 HIS 72 2HB HIS 72 -2.548 -11.275 -9.311 542 HB3 HIS 72 1HB HIS 72 -2.656 -12.458 -8.000 543 HD1 HIS 72 1HD HIS 72 -5.270 -12.654 -7.025 544 HD2 HIS 72 2HD HIS 72 -4.709 -11.325 -10.922 545 HE1 HIS 72 1HE HIS 72 -7.477 -13.002 -8.179 546 HE2 HIS 72 2HE HIS 72 -7.141 -12.101 -10.507 547 H ASN 73 H ASN 73 -0.701 -9.458 -7.106 548 HA ASN 73 HA ASN 73 0.351 -11.404 -5.312 549 HB2 ASN 73 2HB ASN 73 1.355 -8.751 -6.342 550 HB3 ASN 73 1HB ASN 73 2.295 -9.793 -5.269 551 HD21 ASN 73 1HD2 ASN 73 1.226 -9.247 -8.479 552 HD22 ASN 73 2HD2 ASN 73 1.972 -10.639 -9.200 553 H PHE 74 H PHE 74 -1.228 -8.340 -4.950 554 HA PHE 74 HA PHE 74 -1.341 -8.702 -2.078 555 HB2 PHE 74 2HB PHE 74 -1.085 -6.008 -2.113 556 HB3 PHE 74 1HB PHE 74 0.249 -7.123 -1.827 557 HD1 PHE 74 1HD PHE 74 1.727 -7.766 -3.767 558 HD2 PHE 74 2HD PHE 74 -1.031 -4.530 -3.898 559 HE1 PHE 74 1HE PHE 74 2.962 -6.799 -5.660 560 HE2 PHE 74 2HE PHE 74 0.201 -3.556 -5.794 561 HZ PHE 74 HZ PHE 74 2.199 -4.691 -6.676 562 H VAL 75 H VAL 75 -2.831 -6.140 -1.674 563 HA VAL 75 HA VAL 75 -4.948 -6.420 -3.647 564 HB VAL 75 HB VAL 75 -5.378 -8.161 -1.917 565 HG11 VAL 75 1HG1 VAL 75 -6.366 -5.960 -0.149 566 HG12 VAL 75 2HG1 VAL 75 -4.702 -6.534 -0.031 567 HG13 VAL 75 3HG1 VAL 75 -6.040 -7.649 0.242 568 HG21 VAL 75 3HG2 VAL 75 -7.628 -8.010 -2.269 569 HG22 VAL 75 1HG2 VAL 75 -7.094 -6.794 -3.427 570 HG23 VAL 75 2HG2 VAL 75 -7.696 -6.303 -1.843 571 H MET 76 H MET 76 -6.291 -4.923 -3.925 572 HA MET 76 HA MET 76 -5.992 -2.342 -3.826 573 HB2 MET 76 2HB MET 76 -8.733 -2.638 -3.518 574 HB3 MET 76 1HB MET 76 -7.844 -2.717 -5.021 575 HG2 MET 76 2HG MET 76 -8.105 -5.167 -3.343 576 HG3 MET 76 1HG MET 76 -9.450 -4.668 -4.331 577 HE1 MET 76 3HE MET 76 -9.697 -5.015 -6.762 578 HE2 MET 76 1HE MET 76 -8.411 -5.393 -7.908 579 HE3 MET 76 2HE MET 76 -8.483 -3.799 -7.157 580 H VAL 77 H VAL 77 -5.312 -1.193 -2.016 581 HA VAL 77 HA VAL 77 -7.390 -0.643 -0.064 582 HB VAL 77 HB VAL 77 -4.635 -1.542 0.789 583 HG11 VAL 77 1HG1 VAL 77 -6.776 -0.046 2.229 584 HG12 VAL 77 2HG1 VAL 77 -5.024 0.142 2.307 585 HG13 VAL 77 3HG1 VAL 77 -5.801 -1.218 3.114 586 HG21 VAL 77 3HG2 VAL 77 -6.326 -3.016 2.229 587 HG22 VAL 77 1HG2 VAL 77 -5.741 -3.510 0.641 588 HG23 VAL 77 2HG2 VAL 77 -7.326 -2.757 0.802 589 H ASN 78 H ASN 78 -7.265 1.267 -1.538 590 HA ASN 78 HA ASN 78 -4.994 3.023 -1.175 591 HB2 ASN 78 2HB ASN 78 -6.168 2.772 -3.363 592 HB3 ASN 78 1HB ASN 78 -7.571 3.542 -2.642 593 HD21 ASN 78 1HD2 ASN 78 -4.126 4.300 -2.313 594 HD22 ASN 78 2HD2 ASN 78 -4.253 5.913 -2.937 595 H LEU 79 H LEU 79 -4.949 3.970 0.797 596 HA LEU 79 HA LEU 79 -7.394 4.973 2.001 597 HB2 LEU 79 2HB LEU 79 -6.025 4.090 3.636 598 HB3 LEU 79 1HB LEU 79 -4.560 4.658 2.869 599 HG LEU 79 HG LEU 79 -5.101 6.962 3.607 600 HD11 LEU 79 1HD1 LEU 79 -7.130 5.932 5.502 601 HD12 LEU 79 2HD1 LEU 79 -7.633 6.188 3.832 602 HD13 LEU 79 3HD1 LEU 79 -6.969 7.527 4.767 603 HD21 LEU 79 3HD2 LEU 79 -3.585 5.925 5.015 604 HD22 LEU 79 1HD2 LEU 79 -4.763 4.736 5.573 605 HD23 LEU 79 2HD2 LEU 79 -4.867 6.407 6.126 606 H GLU 80 H GLU 80 -7.986 7.109 2.142 607 HA GLU 80 HA GLU 80 -6.383 8.975 0.531 608 HB2 GLU 80 2HB GLU 80 -9.050 8.314 0.336 609 HB3 GLU 80 1HB GLU 80 -9.093 9.837 1.230 610 HG2 GLU 80 2HG GLU 80 -7.619 10.800 -0.571 611 HG3 GLU 80 1HG GLU 80 -7.917 9.316 -1.491 612 H ASP 81 H ASP 81 -7.364 11.374 1.285 613 HA ASP 81 HA ASP 81 -5.856 12.061 3.507 614 HB2 ASP 81 2HB ASP 81 -7.018 14.222 3.432 615 HB3 ASP 81 1HB ASP 81 -6.569 13.684 1.817 616 H GLU 82 H GLU 82 -9.067 10.783 3.334 617 HA GLU 82 HA GLU 82 -10.281 11.662 5.625 618 HB2 GLU 82 2HB GLU 82 -10.339 9.091 4.125 619 HB3 GLU 82 1HB GLU 82 -11.084 9.120 5.717 620 HG2 GLU 82 2HG GLU 82 -12.227 11.294 4.749 621 HG3 GLU 82 1HG GLU 82 -11.891 10.491 3.216 622 H GLU 83 H GLU 83 -7.577 9.489 5.329 623 HA GLU 83 HA GLU 83 -6.207 8.495 6.839 624 HB2 GLU 83 2HB GLU 83 -7.090 11.008 8.127 625 HB3 GLU 83 1HB GLU 83 -6.359 9.815 9.191 626 HG2 GLU 83 2HG GLU 83 -4.466 9.727 7.460 627 HG3 GLU 83 1HG GLU 83 -5.152 11.239 6.852 628 H GLU 84 H GLU 84 -6.119 7.544 9.132 629 HA GLU 84 HA GLU 84 -8.467 6.946 10.544 630 HB2 GLU 84 2HB GLU 84 -7.995 5.324 8.183 631 HB3 GLU 84 1HB GLU 84 -8.024 4.340 9.641 632 HG2 GLU 84 2HG GLU 84 -10.199 5.597 10.188 633 HG3 GLU 84 1HG GLU 84 -10.183 6.059 8.486 634 HA PRO 85 HA PRO 85 -4.839 4.021 11.960 635 HB2 PRO 85 2HB PRO 85 -2.601 4.948 10.271 636 HB3 PRO 85 1HB PRO 85 -3.101 3.294 10.675 637 HG2 PRO 85 2HG PRO 85 -3.469 4.311 8.219 638 HG3 PRO 85 1HG PRO 85 -4.648 3.201 8.959 639 HD2 PRO 85 2HD PRO 85 -4.756 6.188 8.690 640 HD3 PRO 85 1HD PRO 85 -6.049 4.983 8.461 641 H LYS 86 H LYS 86 -4.210 7.273 10.806 642 HA LYS 86 HA LYS 86 -3.089 9.054 11.697 643 HB2 LYS 86 2HB LYS 86 -3.784 9.608 13.994 644 HB3 LYS 86 1HB LYS 86 -5.142 9.098 12.986 645 HG2 LYS 86 2HG LYS 86 -5.189 6.947 14.033 646 HG3 LYS 86 1HG LYS 86 -3.702 7.293 14.920 647 HD2 LYS 86 2HD LYS 86 -4.864 8.236 16.564 648 HD3 LYS 86 1HD LYS 86 -5.604 9.367 15.429 649 HE2 LYS 86 2HE LYS 86 -6.685 6.630 15.377 650 HE3 LYS 86 1HE LYS 86 -6.975 7.528 16.867 651 HZ1 LYS 86 3HZ LYS 86 -7.660 8.478 14.136 652 HZ2 LYS 86 1HZ LYS 86 -7.982 9.293 15.584 653 HZ3 LYS 86 2HZ LYS 86 -8.758 7.829 15.246 654 H ASP 87 H ASP 87 -1.211 7.253 11.305 655 HA ASP 87 HA ASP 87 0.688 7.803 13.362 656 HB2 ASP 87 2HB ASP 87 -0.813 5.600 13.913 657 HB3 ASP 87 1HB ASP 87 0.517 4.877 12.997 658 H GLU 88 H GLU 88 2.561 5.825 12.802 659 HA GLU 88 HA GLU 88 3.781 6.795 10.491 660 HB2 GLU 88 2HB GLU 88 4.310 4.754 12.483 661 HB3 GLU 88 1HB GLU 88 4.858 4.258 10.888 662 HG2 GLU 88 2HG GLU 88 6.687 5.322 11.849 663 HG3 GLU 88 1HG GLU 88 6.006 6.516 10.749 664 H ASP 89 H ASP 89 1.230 4.559 10.770 665 HA ASP 89 HA ASP 89 1.696 2.805 8.670 666 HB2 ASP 89 2HB ASP 89 -0.670 3.723 10.177 667 HB3 ASP 89 1HB ASP 89 -1.006 3.049 8.575 668 H PHE 90 H PHE 90 1.163 6.184 8.441 669 HA PHE 90 HA PHE 90 0.251 5.896 5.663 670 HB2 PHE 90 2HB PHE 90 -0.166 8.414 5.849 671 HB3 PHE 90 1HB PHE 90 -1.232 7.341 6.762 672 HD1 PHE 90 1HD PHE 90 2.089 8.973 7.339 673 HD2 PHE 90 2HD PHE 90 -1.821 8.156 8.805 674 HE1 PHE 90 1HE PHE 90 2.600 10.230 9.389 675 HE2 PHE 90 2HE PHE 90 -1.317 9.411 10.859 676 HZ PHE 90 HZ PHE 90 0.896 10.451 11.153 677 H SER 91 H SER 91 3.005 6.750 7.521 678 HA SER 91 HA SER 91 4.610 7.054 5.185 679 HB2 SER 91 2HB SER 91 4.611 9.532 6.887 680 HB3 SER 91 1HB SER 91 5.171 9.316 5.222 681 HG SER 91 HG SER 91 3.138 10.460 5.457 682 HA PRO 92 HA PRO 92 6.849 5.851 9.075 683 HB2 PRO 92 2HB PRO 92 7.242 3.262 8.605 684 HB3 PRO 92 1HB PRO 92 5.665 3.849 9.171 685 HG2 PRO 92 2HG PRO 92 6.531 3.101 6.404 686 HG3 PRO 92 1HG PRO 92 5.010 2.738 7.237 687 HD2 PRO 92 2HD PRO 92 5.366 4.808 5.433 688 HD3 PRO 92 1HD PRO 92 4.093 4.744 6.662 689 H ASP 93 H ASP 93 8.005 7.233 6.930 690 HA ASP 93 HA ASP 93 10.621 5.978 6.879 691 HB2 ASP 93 2HB ASP 93 8.854 6.037 4.553 692 HB3 ASP 93 1HB ASP 93 10.418 6.807 4.240 693 H GLY 94 H GLY 94 9.342 8.512 4.758 694 HA2 GLY 94 2HA GLY 94 11.336 10.342 5.882 695 HA3 GLY 94 1HA GLY 94 10.473 10.554 4.355 696 H GLY 95 H GLY 95 9.394 12.414 4.518 697 HA2 GLY 95 2HA GLY 95 7.483 12.676 6.732 698 HA3 GLY 95 1HA GLY 95 8.620 13.996 6.444 699 H TYR 96 H TYR 96 6.636 11.932 4.320 700 HA TYR 96 HA TYR 96 5.724 14.370 2.962 701 HB2 TYR 96 2HB TYR 96 4.801 12.329 1.393 702 HB3 TYR 96 1HB TYR 96 6.346 13.158 1.159 703 HD1 TYR 96 2HD TYR 96 8.391 12.127 2.385 704 HD2 TYR 96 1HD TYR 96 4.760 10.029 1.673 705 HE1 TYR 96 2HE TYR 96 9.577 9.991 2.663 706 HE2 TYR 96 1HE TYR 96 5.934 7.885 1.949 707 HH TYR 96 HH TYR 96 8.834 7.325 1.633 708 H ILE 97 H ILE 97 3.399 13.657 1.830 709 HA ILE 97 HA ILE 97 1.666 12.460 3.805 710 HB ILE 97 HB ILE 97 0.154 14.576 3.649 711 HG12 ILE 97 2HG1 ILE 97 2.637 16.153 3.635 712 HG13 ILE 97 1HG1 ILE 97 2.197 15.463 2.070 713 HG21 ILE 97 1HG2 ILE 97 2.640 14.603 5.353 714 HG22 ILE 97 2HG2 ILE 97 1.174 13.687 5.703 715 HG23 ILE 97 3HG2 ILE 97 1.129 15.450 5.686 716 HD11 ILE 97 3HD1 ILE 97 0.413 16.811 1.828 717 HD12 ILE 97 1HD1 ILE 97 1.328 17.837 2.932 718 HD13 ILE 97 2HD1 ILE 97 0.036 16.810 3.554 719 HA PRO 98 HA PRO 98 1.302 10.250 3.026 720 HB2 PRO 98 2HB PRO 98 -1.407 9.625 1.788 721 HB3 PRO 98 1HB PRO 98 -0.596 8.762 3.127 722 HG2 PRO 98 2HG PRO 98 -2.105 11.177 3.248 723 HG3 PRO 98 1HG PRO 98 -1.225 10.355 4.569 724 HD2 PRO 98 2HD PRO 98 -0.327 12.663 3.804 725 HD3 PRO 98 1HD PRO 98 0.835 11.331 3.964 726 H ARG 99 H ARG 99 2.032 8.247 2.134 727 HA ARG 99 HA ARG 99 2.205 8.283 -0.816 728 HB2 ARG 99 2HB ARG 99 4.232 8.169 1.258 729 HB3 ARG 99 1HB ARG 99 4.387 6.839 0.110 730 HG2 ARG 99 2HG ARG 99 5.718 8.880 -0.424 731 HG3 ARG 99 1HG ARG 99 4.648 8.325 -1.712 732 HD2 ARG 99 2HD ARG 99 3.307 10.206 0.021 733 HD3 ARG 99 1HD ARG 99 4.802 10.888 -0.621 734 HE ARG 99 HE ARG 99 3.033 9.604 -2.535 735 HH11 ARG 99 1HH1 ARG 99 4.107 12.590 -1.073 736 HH12 ARG 99 2HH1 ARG 99 3.560 13.572 -2.388 737 HH21 ARG 99 1HH2 ARG 99 2.318 10.894 -4.259 738 HH22 ARG 99 2HH2 ARG 99 2.548 12.608 -4.198 739 H ILE 100 H ILE 100 3.427 5.905 -1.297 740 HA ILE 100 HA ILE 100 1.276 4.009 -0.749 741 HB ILE 100 HB ILE 100 2.265 2.615 -2.458 742 HG12 ILE 100 2HG1 ILE 100 4.330 4.146 -3.565 743 HG13 ILE 100 1HG1 ILE 100 4.632 4.165 -1.835 744 HG21 ILE 100 1HG2 ILE 100 1.847 3.962 -4.330 745 HG22 ILE 100 2HG2 ILE 100 2.432 5.417 -3.523 746 HG23 ILE 100 3HG2 ILE 100 0.900 4.695 -3.034 747 HD11 ILE 100 3HD1 ILE 100 5.800 2.337 -2.924 748 HD12 ILE 100 1HD1 ILE 100 4.267 1.704 -3.521 749 HD13 ILE 100 2HD1 ILE 100 4.593 1.735 -1.787 750 H LEU 101 H LEU 101 1.412 2.503 0.816 751 HA LEU 101 HA LEU 101 4.102 1.728 1.757 752 HB2 LEU 101 2HB LEU 101 1.594 2.314 3.287 753 HB3 LEU 101 1HB LEU 101 2.840 1.289 3.967 754 HG LEU 101 HG LEU 101 4.366 3.050 4.155 755 HD11 LEU 101 1HD1 LEU 101 3.799 5.325 3.142 756 HD12 LEU 101 2HD1 LEU 101 2.648 4.445 2.137 757 HD13 LEU 101 3HD1 LEU 101 4.367 4.061 2.054 758 HD21 LEU 101 3HD2 LEU 101 3.010 4.934 5.160 759 HD22 LEU 101 1HD2 LEU 101 2.747 3.327 5.836 760 HD23 LEU 101 2HD2 LEU 101 1.580 4.012 4.703 761 H PHE 102 H PHE 102 4.585 -0.394 1.721 762 HA PHE 102 HA PHE 102 2.427 -2.276 1.109 763 HB2 PHE 102 2HB PHE 102 5.412 -2.346 0.951 764 HB3 PHE 102 1HB PHE 102 4.531 -3.866 1.058 765 HD1 PHE 102 2HD PHE 102 4.854 -0.759 -0.932 766 HD2 PHE 102 1HD PHE 102 3.519 -4.798 -0.832 767 HE1 PHE 102 2HE PHE 102 4.442 -0.679 -3.358 768 HE2 PHE 102 1HE PHE 102 3.107 -4.726 -3.256 769 HZ PHE 102 HZ PHE 102 3.567 -2.664 -4.522 770 H LEU 103 H LEU 103 1.828 -3.966 2.501 771 HA LEU 103 HA LEU 103 3.271 -4.203 5.024 772 HB2 LEU 103 2HB LEU 103 1.452 -3.692 6.421 773 HB3 LEU 103 1HB LEU 103 1.580 -2.384 5.265 774 HG LEU 103 HG LEU 103 -0.482 -4.564 5.347 775 HD11 LEU 103 1HD1 LEU 103 -2.021 -2.656 5.451 776 HD12 LEU 103 2HD1 LEU 103 -0.635 -1.566 5.513 777 HD13 LEU 103 3HD1 LEU 103 -0.916 -2.714 6.822 778 HD21 LEU 103 3HD2 LEU 103 0.293 -2.691 3.145 779 HD22 LEU 103 1HD2 LEU 103 -1.377 -3.233 3.321 780 HD23 LEU 103 2HD2 LEU 103 -0.092 -4.412 3.066 781 H ASP 104 H ASP 104 1.926 -5.781 6.524 782 HA ASP 104 HA ASP 104 1.761 -8.244 5.021 783 HB2 ASP 104 2HB ASP 104 2.041 -7.472 7.862 784 HB3 ASP 104 1HB ASP 104 1.151 -8.973 7.564 785 HA PRO 105 HA PRO 105 -2.582 -8.664 4.454 786 HB2 PRO 105 2HB PRO 105 -2.283 -11.411 5.557 787 HB3 PRO 105 1HB PRO 105 -2.958 -10.881 4.006 788 HG2 PRO 105 2HG PRO 105 -0.546 -12.026 4.151 789 HG3 PRO 105 1HG PRO 105 -0.879 -10.701 3.014 790 HD2 PRO 105 2HD PRO 105 0.616 -10.659 5.595 791 HD3 PRO 105 1HD PRO 105 0.913 -9.749 4.100 792 H SER 106 H SER 106 -3.276 -7.269 6.099 793 HA SER 106 HA SER 106 -5.113 -8.051 7.880 794 HB2 SER 106 2HB SER 106 -2.409 -8.557 9.004 795 HB3 SER 106 1HB SER 106 -3.574 -7.773 10.085 796 HG SER 106 HG SER 106 -3.401 -10.310 9.609 797 H GLY 107 H GLY 107 -2.442 -5.948 7.227 798 HA2 GLY 107 2HA GLY 107 -2.917 -3.583 6.950 799 HA3 GLY 107 1HA GLY 107 -3.995 -3.702 8.346 800 H LYS 108 H LYS 108 -0.731 -5.036 7.975 801 HA LYS 108 HA LYS 108 0.080 -3.358 10.265 802 HB2 LYS 108 2HB LYS 108 0.447 -6.192 9.651 803 HB3 LYS 108 1HB LYS 108 1.939 -5.392 10.121 804 HG2 LYS 108 2HG LYS 108 0.243 -4.459 12.017 805 HG3 LYS 108 1HG LYS 108 -0.428 -6.071 11.716 806 HD2 LYS 108 2HD LYS 108 1.801 -7.044 12.088 807 HD3 LYS 108 1HD LYS 108 2.438 -5.434 12.427 808 HE2 LYS 108 2HE LYS 108 1.244 -5.250 14.421 809 HE3 LYS 108 1HE LYS 108 0.112 -6.523 13.969 810 HZ1 LYS 108 3HZ LYS 108 1.973 -7.005 15.681 811 HZ2 LYS 108 1HZ LYS 108 2.960 -7.169 14.315 812 HZ3 LYS 108 2HZ LYS 108 1.606 -8.165 14.507 813 H VAL 109 H VAL 109 0.619 -1.648 8.701 814 HA VAL 109 HA VAL 109 2.427 -1.806 6.636 815 HB VAL 109 HB VAL 109 1.714 0.363 8.564 816 HG11 VAL 109 1HG1 VAL 109 4.007 0.818 8.220 817 HG12 VAL 109 2HG1 VAL 109 3.104 1.913 7.175 818 HG13 VAL 109 3HG1 VAL 109 3.885 0.486 6.496 819 HG21 VAL 109 3HG2 VAL 109 1.331 -0.108 5.619 820 HG22 VAL 109 1HG2 VAL 109 0.993 1.441 6.394 821 HG23 VAL 109 2HG2 VAL 109 0.099 -0.001 6.877 822 H HIS 110 H HIS 110 4.490 -2.161 6.426 823 HA HIS 110 HA HIS 110 6.249 -1.778 8.737 824 HB2 HIS 110 2HB HIS 110 7.430 -3.938 8.023 825 HB3 HIS 110 1HB HIS 110 5.899 -4.109 8.874 826 HD1 HIS 110 1HD HIS 110 6.579 -3.552 5.171 827 HD2 HIS 110 2HD HIS 110 4.723 -6.254 7.723 828 HE1 HIS 110 1HE HIS 110 5.495 -5.255 3.672 829 HE2 HIS 110 2HE HIS 110 4.276 -6.808 5.238 830 HA PRO 111 HA PRO 111 8.611 0.265 5.593 831 HB2 PRO 111 2HB PRO 111 10.990 0.433 6.907 832 HB3 PRO 111 1HB PRO 111 9.609 1.474 7.269 833 HG2 PRO 111 2HG PRO 111 10.544 -0.989 8.684 834 HG3 PRO 111 1HG PRO 111 9.964 0.540 9.367 835 HD2 PRO 111 2HD PRO 111 8.407 -1.669 9.198 836 HD3 PRO 111 1HD PRO 111 7.750 -0.022 9.058 837 H GLU 112 H GLU 112 8.336 -2.618 5.380 838 HA GLU 112 HA GLU 112 11.000 -3.630 4.846 839 HB2 GLU 112 2HB GLU 112 8.284 -4.754 5.030 840 HB3 GLU 112 1HB GLU 112 9.302 -5.499 3.804 841 HG2 GLU 112 2HG GLU 112 10.138 -5.153 6.670 842 HG3 GLU 112 1HG GLU 112 9.342 -6.598 6.049 843 H ILE 113 H ILE 113 8.037 -3.040 2.961 844 HA ILE 113 HA ILE 113 9.729 -2.805 0.564 845 HB ILE 113 HB ILE 113 6.783 -3.413 0.533 846 HG12 ILE 113 2HG1 ILE 113 7.823 -5.769 -0.148 847 HG13 ILE 113 1HG1 ILE 113 9.131 -5.211 0.903 848 HG21 ILE 113 1HG2 ILE 113 8.244 -2.487 -1.468 849 HG22 ILE 113 2HG2 ILE 113 6.984 -3.696 -1.720 850 HG23 ILE 113 3HG2 ILE 113 8.674 -4.192 -1.616 851 HD11 ILE 113 3HD1 ILE 113 7.647 -5.028 2.759 852 HD12 ILE 113 1HD1 ILE 113 7.424 -6.619 2.031 853 HD13 ILE 113 2HD1 ILE 113 6.244 -5.341 1.737 854 H ILE 114 H ILE 114 10.121 -0.758 0.225 855 HA ILE 114 HA ILE 114 7.984 1.226 0.597 856 HB ILE 114 HB ILE 114 10.003 2.847 0.431 857 HG12 ILE 114 2HG1 ILE 114 11.546 0.853 -0.179 858 HG13 ILE 114 1HG1 ILE 114 12.143 2.056 0.950 859 HG21 ILE 114 1HG2 ILE 114 9.096 3.022 2.473 860 HG22 ILE 114 2HG2 ILE 114 10.515 2.104 2.973 861 HG23 ILE 114 3HG2 ILE 114 8.984 1.274 2.689 862 HD11 ILE 114 3HD1 ILE 114 10.763 -0.197 2.204 863 HD12 ILE 114 1HD1 ILE 114 12.292 0.579 2.618 864 HD13 ILE 114 2HD1 ILE 114 12.234 -0.623 1.329 865 H ASN 115 H ASN 115 10.819 0.684 -1.488 866 HA ASN 115 HA ASN 115 9.564 0.778 -3.943 867 HB2 ASN 115 2HB ASN 115 8.897 3.079 -3.368 868 HB3 ASN 115 1HB ASN 115 10.589 3.501 -3.072 869 HD21 ASN 115 1HD2 ASN 115 8.948 4.872 -4.856 870 HD22 ASN 115 2HD2 ASN 115 9.556 4.620 -6.469 871 H GLU 116 H GLU 116 12.345 1.766 -2.048 872 HA GLU 116 HA GLU 116 14.562 1.347 -2.238 873 HB2 GLU 116 2HB GLU 116 13.532 -0.621 -4.267 874 HB3 GLU 116 1HB GLU 116 15.263 -0.412 -3.975 875 HG2 GLU 116 2HG GLU 116 13.302 -1.025 -1.786 876 HG3 GLU 116 1HG GLU 116 14.108 -2.280 -2.723 877 H ASN 117 H ASN 117 13.283 1.355 -5.582 878 HA ASN 117 HA ASN 117 15.482 3.092 -6.375 879 HB2 ASN 117 2HB ASN 117 14.395 1.022 -7.677 880 HB3 ASN 117 1HB ASN 117 13.364 2.312 -8.317 881 HD21 ASN 117 1HD2 ASN 117 16.569 0.991 -8.170 882 HD22 ASN 117 2HD2 ASN 117 17.249 1.962 -9.448 883 H GLY 118 H GLY 118 13.124 3.965 -4.668 884 HA2 GLY 118 2HA GLY 118 11.961 5.999 -6.448 885 HA3 GLY 118 1HA GLY 118 11.335 5.532 -4.867 886 H ASN 119 H ASN 119 14.460 6.681 -6.106 887 HA ASN 119 HA ASN 119 15.840 8.363 -5.448 888 HB2 ASN 119 2HB ASN 119 13.948 9.806 -5.963 889 HB3 ASN 119 1HB ASN 119 13.259 9.509 -4.361 890 HD21 ASN 119 1HD2 ASN 119 13.908 10.714 -2.682 891 HD22 ASN 119 2HD2 ASN 119 15.118 11.966 -2.777 892 HA PRO 120 HA PRO 120 16.872 7.165 -1.293 893 HB2 PRO 120 2HB PRO 120 19.179 8.497 -1.017 894 HB3 PRO 120 1HB PRO 120 19.026 7.136 -2.146 895 HG2 PRO 120 2HG PRO 120 18.953 10.081 -2.699 896 HG3 PRO 120 1HG PRO 120 19.778 8.788 -3.600 897 HD2 PRO 120 2HD PRO 120 17.354 9.866 -4.324 898 HD3 PRO 120 1HD PRO 120 17.885 8.224 -4.758 899 H SER 121 H SER 121 14.849 9.057 -1.266 900 HA SER 121 HA SER 121 15.159 10.274 1.223 901 HB2 SER 121 2HB SER 121 16.074 11.893 -1.067 902 HB3 SER 121 1HB SER 121 14.899 12.709 -0.021 903 HG SER 121 HG SER 121 16.340 11.964 1.749 904 H TYR 122 H TYR 122 13.307 8.710 -0.123 905 HA TYR 122 HA TYR 122 10.897 10.098 0.420 906 HB2 TYR 122 2HB TYR 122 11.961 10.232 -2.270 907 HB3 TYR 122 1HB TYR 122 10.391 9.424 -2.250 908 HD1 TYR 122 2HD TYR 122 8.654 10.725 -0.572 909 HD2 TYR 122 1HD TYR 122 11.905 12.480 -2.681 910 HE1 TYR 122 2HE TYR 122 7.550 12.919 -0.438 911 HE2 TYR 122 1HE TYR 122 10.814 14.678 -2.551 912 HH TYR 122 HH TYR 122 8.427 15.536 -2.292 913 H LYS 123 H LYS 123 12.366 7.456 -1.405 914 HA LYS 123 HA LYS 123 11.853 5.252 -1.621 915 HB2 LYS 123 2HB LYS 123 11.288 5.902 1.235 916 HB3 LYS 123 1HB LYS 123 10.881 4.302 0.640 917 HG2 LYS 123 2HG LYS 123 13.599 5.595 0.618 918 HG3 LYS 123 1HG LYS 123 13.062 4.252 1.643 919 HD2 LYS 123 2HD LYS 123 13.760 2.835 0.078 920 HD3 LYS 123 1HD LYS 123 12.534 3.486 -1.018 921 HE2 LYS 123 2HE LYS 123 14.298 4.012 -2.307 922 HE3 LYS 123 1HE LYS 123 14.468 5.381 -1.208 923 HZ1 LYS 123 3HZ LYS 123 16.529 4.586 -0.947 924 HZ2 LYS 123 1HZ LYS 123 16.135 3.041 -1.512 925 HZ3 LYS 123 2HZ LYS 123 15.813 3.464 0.095 926 H TYR 124 H TYR 124 9.169 5.661 0.623 927 HA TYR 124 HA TYR 124 7.308 4.249 -0.780 928 HB2 TYR 124 2HB TYR 124 6.982 6.547 1.131 929 HB3 TYR 124 1HB TYR 124 5.597 5.665 0.478 930 HD1 TYR 124 1HD TYR 124 6.361 2.911 0.529 931 HD2 TYR 124 2HD TYR 124 7.279 5.971 3.333 932 HE1 TYR 124 1HE TYR 124 6.586 1.218 2.289 933 HE2 TYR 124 2HE TYR 124 7.518 4.287 5.100 934 HH TYR 124 HH TYR 124 6.493 1.048 4.703 935 H PHE 125 H PHE 125 8.458 7.381 -1.626 936 HA PHE 125 HA PHE 125 6.156 8.314 -3.008 937 HB2 PHE 125 2HB PHE 125 8.178 9.674 -2.220 938 HB3 PHE 125 1HB PHE 125 9.006 9.064 -3.659 939 HD1 PHE 125 2HD PHE 125 6.005 10.952 -2.554 940 HD2 PHE 125 1HD PHE 125 8.733 10.120 -5.712 941 HE1 PHE 125 2HE PHE 125 5.013 12.768 -3.885 942 HE2 PHE 125 1HE PHE 125 7.748 11.937 -7.046 943 HZ PHE 125 HZ PHE 125 5.884 13.262 -6.134 944 H TYR 126 H TYR 126 5.307 7.494 -4.817 945 HA TYR 126 HA TYR 126 7.112 6.102 -6.682 946 HB2 TYR 126 2HB TYR 126 4.530 5.331 -5.545 947 HB3 TYR 126 1HB TYR 126 4.568 5.204 -7.309 948 HD1 TYR 126 1HD TYR 126 7.553 4.479 -7.506 949 HD2 TYR 126 2HD TYR 126 4.397 3.009 -5.065 950 HE1 TYR 126 1HE TYR 126 8.715 2.324 -7.313 951 HE2 TYR 126 2HE TYR 126 5.553 0.850 -4.858 952 HH TYR 126 HH TYR 126 8.786 0.401 -5.782 953 H VAL 127 H VAL 127 7.576 7.855 -7.973 954 HA VAL 127 HA VAL 127 5.305 9.063 -9.410 955 HB VAL 127 HB VAL 127 6.689 10.701 -8.226 956 HG11 VAL 127 1HG1 VAL 127 8.809 9.080 -8.917 957 HG12 VAL 127 2HG1 VAL 127 8.919 10.681 -8.187 958 HG13 VAL 127 3HG1 VAL 127 9.031 10.501 -9.936 959 HG21 VAL 127 3HG2 VAL 127 7.443 11.186 -11.051 960 HG22 VAL 127 1HG2 VAL 127 6.631 12.242 -9.897 961 HG23 VAL 127 2HG2 VAL 127 5.732 10.952 -10.697 962 H SER 128 H SER 128 5.410 6.918 -10.565 963 HA SER 128 HA SER 128 5.974 7.016 -13.157 964 HB2 SER 128 2HB SER 128 8.263 5.733 -13.282 965 HB3 SER 128 1HB SER 128 8.254 7.496 -13.113 966 HG SER 128 HG SER 128 9.685 6.467 -11.637 967 H ALA 129 H ALA 129 5.413 5.136 -14.181 968 HA ALA 129 HA ALA 129 4.480 2.982 -12.516 969 HB1 ALA 129 1HB ALA 129 3.742 2.007 -14.711 970 HB2 ALA 129 2HB ALA 129 4.409 3.443 -15.488 971 HB3 ALA 129 3HB ALA 129 3.087 3.599 -14.331 972 H GLU 130 H GLU 130 7.381 3.636 -14.211 973 HA GLU 130 HA GLU 130 8.137 0.990 -14.876 974 HB2 GLU 130 2HB GLU 130 9.445 3.635 -14.743 975 HB3 GLU 130 1HB GLU 130 10.523 2.250 -14.531 976 HG2 GLU 130 2HG GLU 130 8.587 2.245 -16.798 977 HG3 GLU 130 1HG GLU 130 10.045 3.247 -16.904 978 H GLN 131 H GLN 131 8.677 2.997 -12.005 979 HA GLN 131 HA GLN 131 10.245 0.930 -10.767 980 HB2 GLN 131 2HB GLN 131 10.098 2.410 -8.736 981 HB3 GLN 131 1HB GLN 131 10.909 3.090 -10.140 982 HG2 GLN 131 2HG GLN 131 8.848 4.318 -10.698 983 HG3 GLN 131 1HG GLN 131 8.101 3.684 -9.232 984 HE21 GLN 131 1HE2 GLN 131 8.091 6.288 -9.378 985 HE22 GLN 131 2HE2 GLN 131 9.299 7.012 -8.378 986 H VAL 132 H VAL 132 6.948 2.213 -10.386 987 HA VAL 132 HA VAL 132 6.179 0.824 -8.134 988 HB VAL 132 HB VAL 132 3.951 1.112 -8.749 989 HG11 VAL 132 1HG1 VAL 132 4.107 3.310 -8.694 990 HG12 VAL 132 2HG1 VAL 132 4.453 3.336 -10.422 991 HG13 VAL 132 3HG1 VAL 132 5.774 3.212 -9.259 992 HG21 VAL 132 3HG2 VAL 132 3.519 1.725 -11.305 993 HG22 VAL 132 1HG2 VAL 132 3.481 0.067 -10.702 994 HG23 VAL 132 2HG2 VAL 132 4.926 0.681 -11.503 995 H VAL 133 H VAL 133 6.694 -0.321 -11.386 996 HA VAL 133 HA VAL 133 5.494 -2.894 -10.896 997 HB VAL 133 HB VAL 133 5.453 -2.006 -13.166 998 HG11 VAL 133 1HG1 VAL 133 7.344 -0.718 -13.456 999 HG12 VAL 133 2HG1 VAL 133 7.744 -2.159 -14.393 1000 HG13 VAL 133 3HG1 VAL 133 8.409 -1.945 -12.773 1001 HG21 VAL 133 3HG2 VAL 133 6.395 -3.990 -14.337 1002 HG22 VAL 133 1HG2 VAL 133 5.399 -4.402 -12.940 1003 HG23 VAL 133 2HG2 VAL 133 7.158 -4.471 -12.819 1004 H GLN 134 H GLN 134 8.742 -1.480 -10.784 1005 HA GLN 134 HA GLN 134 10.061 -4.021 -10.665 1006 HB2 GLN 134 2HB GLN 134 12.050 -2.832 -10.215 1007 HB3 GLN 134 1HB GLN 134 11.120 -1.767 -11.257 1008 HG2 GLN 134 2HG GLN 134 10.639 -0.294 -9.532 1009 HG3 GLN 134 1HG GLN 134 10.986 -1.486 -8.289 1010 HE21 GLN 134 1HE2 GLN 134 12.411 0.600 -10.719 1011 HE22 GLN 134 2HE2 GLN 134 13.987 0.696 -9.983 1012 H GLY 135 H GLY 135 8.818 -1.757 -8.279 1013 HA2 GLY 135 2HA GLY 135 9.708 -3.345 -6.038 1014 HA3 GLY 135 1HA GLY 135 8.665 -1.917 -5.971 1015 H MET 136 H MET 136 7.065 -3.346 -8.199 1016 HA MET 136 HA MET 136 5.250 -4.689 -6.371 1017 HB2 MET 136 2HB MET 136 4.073 -3.288 -7.808 1018 HB3 MET 136 1HB MET 136 5.097 -3.674 -9.181 1019 HG2 MET 136 2HG MET 136 4.024 -5.736 -9.538 1020 HG3 MET 136 1HG MET 136 3.214 -5.671 -7.974 1021 HE1 MET 136 3HE MET 136 -0.018 -5.262 -9.380 1022 HE2 MET 136 1HE MET 136 0.452 -4.400 -7.915 1023 HE3 MET 136 2HE MET 136 1.138 -5.985 -8.260 1024 H LYS 137 H LYS 137 7.371 -5.364 -9.043 1025 HA LYS 137 HA LYS 137 6.580 -8.111 -9.324 1026 HB2 LYS 137 2HB LYS 137 8.264 -8.236 -11.044 1027 HB3 LYS 137 1HB LYS 137 7.343 -6.760 -11.253 1028 HG2 LYS 137 2HG LYS 137 9.279 -5.688 -9.893 1029 HG3 LYS 137 1HG LYS 137 10.167 -7.134 -10.378 1030 HD2 LYS 137 2HD LYS 137 8.899 -5.062 -12.164 1031 HD3 LYS 137 1HD LYS 137 10.614 -5.427 -11.992 1032 HE2 LYS 137 2HE LYS 137 8.981 -7.728 -12.777 1033 HE3 LYS 137 1HE LYS 137 8.966 -6.410 -13.943 1034 HZ1 LYS 137 3HZ LYS 137 11.116 -6.727 -14.461 1035 HZ2 LYS 137 1HZ LYS 137 10.842 -8.290 -13.874 1036 HZ3 LYS 137 2HZ LYS 137 11.571 -7.130 -12.883 1037 H GLU 138 H GLU 138 8.635 -6.404 -7.266 1038 HA GLU 138 HA GLU 138 10.308 -8.750 -6.727 1039 HB2 GLU 138 2HB GLU 138 11.536 -6.671 -7.091 1040 HB3 GLU 138 1HB GLU 138 10.597 -5.877 -5.828 1041 HG2 GLU 138 2HG GLU 138 11.719 -6.926 -4.136 1042 HG3 GLU 138 1HG GLU 138 12.132 -8.330 -5.134 1043 H ALA 139 H ALA 139 8.560 -6.218 -4.969 1044 HA ALA 139 HA ALA 139 8.548 -7.401 -2.455 1045 HB1 ALA 139 1HB ALA 139 6.914 -5.844 -1.856 1046 HB2 ALA 139 2HB ALA 139 6.226 -5.805 -3.478 1047 HB3 ALA 139 3HB ALA 139 7.791 -5.053 -3.166 1048 H GLN 140 H GLN 140 6.618 -8.039 -5.277 1049 HA GLN 140 HA GLN 140 4.505 -9.415 -4.067 1050 HB2 GLN 140 2HB GLN 140 4.149 -10.369 -6.321 1051 HB3 GLN 140 1HB GLN 140 4.301 -8.617 -6.315 1052 HG2 GLN 140 2HG GLN 140 5.612 -9.126 -8.092 1053 HG3 GLN 140 1HG GLN 140 6.817 -9.191 -6.810 1054 HE21 GLN 140 1HE2 GLN 140 4.328 -11.445 -7.962 1055 HE22 GLN 140 2HE2 GLN 140 5.402 -12.775 -8.205 1056 H GLU 141 H GLU 141 7.769 -10.340 -4.435 1057 HA GLU 141 HA GLU 141 7.063 -13.175 -4.168 1058 HB2 GLU 141 2HB GLU 141 8.815 -13.720 -5.453 1059 HB3 GLU 141 1HB GLU 141 8.793 -12.017 -5.925 1060 HG2 GLU 141 2HG GLU 141 10.328 -11.656 -3.930 1061 HG3 GLU 141 1HG GLU 141 10.571 -13.400 -3.967 1062 H ARG 142 H ARG 142 8.875 -10.578 -2.662 1063 HA ARG 142 HA ARG 142 9.906 -12.342 -0.600 1064 HB2 ARG 142 2HB ARG 142 10.963 -10.306 0.302 1065 HB3 ARG 142 1HB ARG 142 11.339 -10.553 -1.407 1066 HG2 ARG 142 2HG ARG 142 10.816 -8.377 -1.567 1067 HG3 ARG 142 1HG ARG 142 9.152 -8.985 -1.608 1068 HD2 ARG 142 2HD ARG 142 9.204 -7.232 -0.012 1069 HD3 ARG 142 1HD ARG 142 9.120 -8.751 0.897 1070 HE ARG 142 HE ARG 142 11.199 -8.316 1.757 1071 HH11 ARG 142 1HH1 ARG 142 10.612 -6.165 -0.928 1072 HH12 ARG 142 2HH1 ARG 142 12.013 -5.195 -0.621 1073 HH21 ARG 142 1HH2 ARG 142 13.043 -7.045 2.162 1074 HH22 ARG 142 2HH2 ARG 142 13.395 -5.697 1.135 1075 H LEU 143 H LEU 143 7.381 -9.938 -0.974 1076 HA LEU 143 HA LEU 143 6.770 -9.864 1.839 1077 HB2 LEU 143 2HB LEU 143 6.448 -7.927 0.313 1078 HB3 LEU 143 1HB LEU 143 5.157 -8.822 -0.488 1079 HG LEU 143 HG LEU 143 3.780 -8.740 1.458 1080 HD11 LEU 143 1HD1 LEU 143 4.929 -9.017 3.379 1081 HD12 LEU 143 2HD1 LEU 143 4.885 -7.254 3.404 1082 HD13 LEU 143 3HD1 LEU 143 6.318 -8.091 2.808 1083 HD21 LEU 143 3HD2 LEU 143 3.323 -6.755 0.484 1084 HD22 LEU 143 1HD2 LEU 143 5.013 -6.253 0.463 1085 HD23 LEU 143 2HD2 LEU 143 4.068 -6.114 1.947 1086 H THR 144 H THR 144 5.282 -11.285 -1.059 1087 HA THR 144 HA THR 144 2.968 -12.287 0.085 1088 HB THR 144 HB THR 144 3.106 -14.020 -1.741 1089 HG1 THR 144 1HG THR 144 5.393 -14.114 -1.842 1090 HG21 THR 144 3HG2 THR 144 2.964 -12.441 -3.611 1091 HG22 THR 144 1HG2 THR 144 3.558 -11.163 -2.551 1092 HG23 THR 144 2HG2 THR 144 2.007 -11.933 -2.218 1093 H GLY 145 H GLY 145 3.185 -13.203 2.087 1094 HA2 GLY 145 2HA GLY 145 3.207 -15.536 2.945 1095 HA3 GLY 145 1HA GLY 145 4.796 -15.681 2.207 1096 H ASP 146 H ASP 146 6.470 -15.432 3.518 1097 HA ASP 146 HA ASP 146 6.457 -13.465 5.628 1098 HB2 ASP 146 2HB ASP 146 6.035 -16.338 6.178 1099 HB3 ASP 146 1HB ASP 146 7.261 -15.552 7.169 1100 H ALA 147 H ALA 147 7.986 -14.200 3.192 1101 HA ALA 147 HA ALA 147 10.579 -15.019 4.207 1102 HB1 ALA 147 1HB ALA 147 9.402 -15.461 1.838 1103 HB2 ALA 147 2HB ALA 147 11.150 -15.449 2.060 1104 HB3 ALA 147 3HB ALA 147 10.332 -14.016 1.440 1105 H PHE 148 H PHE 148 8.871 -12.115 3.436 1106 HA PHE 148 HA PHE 148 10.952 -10.352 2.905 1107 HB2 PHE 148 2HB PHE 148 9.411 -8.581 3.748 1108 HB3 PHE 148 1HB PHE 148 8.650 -9.686 2.595 1109 HD1 PHE 148 2HD PHE 148 7.004 -11.326 3.357 1110 HD2 PHE 148 1HD PHE 148 8.701 -8.476 6.023 1111 HE1 PHE 148 2HE PHE 148 5.206 -11.774 4.976 1112 HE2 PHE 148 1HE PHE 148 6.906 -8.919 7.645 1113 HZ PHE 148 HZ PHE 148 5.156 -10.571 7.123 1114 H ARG 149 H ARG 149 9.696 -11.514 5.996 1115 HA ARG 149 HA ARG 149 11.080 -9.769 7.683 1116 HB2 ARG 149 2HB ARG 149 10.430 -12.648 8.297 1117 HB3 ARG 149 1HB ARG 149 10.582 -11.315 9.428 1118 HG2 ARG 149 2HG ARG 149 8.596 -10.270 8.298 1119 HG3 ARG 149 1HG ARG 149 8.387 -11.798 7.440 1120 HD2 ARG 149 2HD ARG 149 8.662 -11.812 10.402 1121 HD3 ARG 149 1HD ARG 149 7.122 -11.335 9.692 1122 HE ARG 149 HE ARG 149 7.575 -13.631 8.429 1123 HH11 ARG 149 1HH1 ARG 149 7.859 -12.827 11.816 1124 HH12 ARG 149 2HH1 ARG 149 7.503 -14.433 12.354 1125 HH21 ARG 149 1HH2 ARG 149 7.102 -15.740 9.139 1126 HH22 ARG 149 2HH2 ARG 149 7.071 -16.085 10.836 1127 H LYS 150 H LYS 150 13.179 -9.555 8.078 1128 HA LYS 150 HA LYS 150 15.018 -11.631 7.165 1129 HB2 LYS 150 2HB LYS 150 16.771 -9.909 7.570 1130 HB3 LYS 150 1HB LYS 150 15.544 -9.404 6.416 1131 HG2 LYS 150 2HG LYS 150 14.596 -7.886 7.895 1132 HG3 LYS 150 1HG LYS 150 15.322 -8.659 9.304 1133 HD2 LYS 150 2HD LYS 150 16.832 -7.001 9.175 1134 HD3 LYS 150 1HD LYS 150 17.528 -7.956 7.866 1135 HE2 LYS 150 2HE LYS 150 16.615 -6.613 6.224 1136 HE3 LYS 150 1HE LYS 150 15.331 -6.022 7.277 1137 HZ1 LYS 150 3HZ LYS 150 16.915 -4.284 6.916 1138 HZ2 LYS 150 1HZ LYS 150 18.203 -5.275 7.391 1139 HZ3 LYS 150 2HZ LYS 150 17.045 -4.788 8.525 1140 H LYS 151 H LYS 151 16.111 -12.933 8.500 1141 HA LYS 151 HA LYS 151 16.128 -12.282 11.373 1142 HB2 LYS 151 2HB LYS 151 14.603 -14.253 10.380 1143 HB3 LYS 151 1HB LYS 151 16.109 -15.140 10.567 1144 HG2 LYS 151 2HG LYS 151 15.127 -15.532 12.592 1145 HG3 LYS 151 1HG LYS 151 16.078 -14.093 12.966 1146 HD2 LYS 151 2HD LYS 151 13.535 -13.290 11.934 1147 HD3 LYS 151 1HD LYS 151 13.285 -14.467 13.225 1148 HE2 LYS 151 2HE LYS 151 14.942 -11.954 13.416 1149 HE3 LYS 151 1HE LYS 151 13.332 -12.184 14.097 1150 HZ1 LYS 151 3HZ LYS 151 14.129 -13.405 15.794 1151 HZ2 LYS 151 1HZ LYS 151 15.569 -12.580 15.467 1152 HZ3 LYS 151 2HZ LYS 151 15.334 -14.144 14.868 1153 H HIS 152 H HIS 152 17.559 -14.770 9.252 1154 HA HIS 152 HA HIS 152 20.211 -13.936 10.214 1155 HB2 HIS 152 2HB HIS 152 19.184 -16.767 9.925 1156 HB3 HIS 152 1HB HIS 152 20.872 -16.350 10.203 1157 HD1 HIS 152 1HD HIS 152 21.542 -16.391 12.579 1158 HD2 HIS 152 2HD HIS 152 17.477 -15.651 12.137 1159 HE1 HIS 152 1HE HIS 152 20.622 -16.276 14.916 1160 HE2 HIS 152 2HE HIS 152 18.178 -15.733 14.625 1161 H LEU 153 H LEU 153 19.144 -16.484 7.978 1162 HA LEU 153 HA LEU 153 19.703 -16.937 5.819 1163 HB2 LEU 153 2HB LEU 153 19.155 -14.049 5.921 1164 HB3 LEU 153 1HB LEU 153 20.100 -14.560 4.536 1165 HG LEU 153 HG LEU 153 17.690 -14.478 4.049 1166 HD11 LEU 153 1HD1 LEU 153 19.328 -16.146 3.011 1167 HD12 LEU 153 2HD1 LEU 153 17.603 -16.469 2.834 1168 HD13 LEU 153 3HD1 LEU 153 18.547 -17.351 4.035 1169 HD21 LEU 153 3HD2 LEU 153 16.487 -14.996 5.916 1170 HD22 LEU 153 1HD2 LEU 153 17.594 -16.276 6.413 1171 HD23 LEU 153 2HD2 LEU 153 16.450 -16.560 5.101 1172 H GLU 154 H GLU 154 21.381 -16.141 3.985 1173 HA GLU 154 HA GLU 154 23.843 -15.062 4.780 1174 HB2 GLU 154 2HB GLU 154 23.541 -17.519 5.914 1175 HB3 GLU 154 1HB GLU 154 24.330 -17.947 4.403 1176 HG2 GLU 154 2HG GLU 154 26.184 -17.601 5.630 1177 HG3 GLU 154 1HG GLU 154 25.912 -15.929 5.140 1178 H ASP 155 H ASP 155 24.395 -14.204 2.897 1179 HA ASP 155 HA ASP 155 24.881 -15.882 0.612 1180 HB2 ASP 155 2HB ASP 155 22.464 -14.196 0.779 1181 HB3 ASP 155 1HB ASP 155 23.393 -14.026 -0.707 1182 H GLU 156 H GLU 156 25.833 -14.634 -1.206 1183 HA GLU 156 HA GLU 156 27.624 -12.620 -0.144 1184 HB2 GLU 156 2HB GLU 156 27.966 -14.627 -1.958 1185 HB3 GLU 156 1HB GLU 156 27.750 -13.236 -3.025 1186 HG2 GLU 156 2HG GLU 156 30.069 -13.469 -2.655 1187 HG3 GLU 156 1HG GLU 156 29.542 -12.077 -1.710 1188 H LEU 157 H LEU 157 27.888 -10.528 -0.990 1189 HA LEU 157 HA LEU 157 27.184 -8.503 -1.749 1190 HB2 LEU 157 2HB LEU 157 26.327 -10.420 -3.814 1191 HB3 LEU 157 1HB LEU 157 25.475 -8.887 -3.836 1192 HG LEU 157 HG LEU 157 27.387 -8.878 -5.361 1193 HD11 LEU 157 1HD1 LEU 157 28.065 -6.746 -4.869 1194 HD12 LEU 157 2HD1 LEU 157 28.209 -7.071 -3.143 1195 HD13 LEU 157 3HD1 LEU 157 26.616 -6.866 -3.871 1196 HD21 LEU 157 3HD2 LEU 157 29.658 -8.682 -3.956 1197 HD22 LEU 157 1HD2 LEU 157 29.076 -10.201 -4.639 1198 HD23 LEU 157 2HD2 LEU 157 28.787 -9.831 -2.940 Start of MODEL 7 1 H1 MET 1 1HT MET 1 -24.698 13.827 6.893 2 H2 MET 1 2HT MET 1 -24.441 14.355 5.282 3 H3 MET 1 3HT MET 1 -24.883 12.726 5.593 4 HA MET 1 HA MET 1 -26.966 13.555 6.552 5 HB2 MET 1 2HB MET 1 -25.611 15.968 6.407 6 HB3 MET 1 1HB MET 1 -26.767 16.076 5.087 7 HG2 MET 1 2HG MET 1 -28.398 16.535 6.501 8 HG3 MET 1 1HG MET 1 -28.092 15.044 7.389 9 HE1 MET 1 2HE MET 1 -27.725 16.606 10.674 10 HE2 MET 1 3HE MET 1 -27.121 15.109 9.963 11 HE3 MET 1 1HE MET 1 -28.733 15.692 9.552 12 H HIS 2 H HIS 2 -25.387 14.518 3.515 13 HA HIS 2 HA HIS 2 -27.736 13.870 1.963 14 HB2 HIS 2 2HB HIS 2 -26.281 14.452 0.019 15 HB3 HIS 2 1HB HIS 2 -26.393 15.731 1.222 16 HD1 HIS 2 1HD HIS 2 -23.993 13.411 -0.392 17 HD2 HIS 2 2HD HIS 2 -24.012 16.188 2.698 18 HE1 HIS 2 1HE HIS 2 -21.573 13.832 0.148 19 HE2 HIS 2 2HE HIS 2 -21.609 15.571 1.969 20 H HIS 3 H HIS 3 -24.446 12.575 2.330 21 HA HIS 3 HA HIS 3 -25.400 10.060 1.123 22 HB2 HIS 3 2HB HIS 3 -23.169 11.695 0.421 23 HB3 HIS 3 1HB HIS 3 -22.553 10.175 1.058 24 HD1 HIS 3 1HD HIS 3 -24.551 11.594 -1.774 25 HD2 HIS 3 2HD HIS 3 -23.008 7.937 -0.543 26 HE1 HIS 3 1HE HIS 3 -24.804 10.058 -3.749 27 HE2 HIS 3 2HE HIS 3 -23.957 7.824 -2.946 28 H HIS 4 H HIS 4 -22.889 11.311 3.325 29 HA HIS 4 HA HIS 4 -22.121 10.564 5.332 30 HB2 HIS 4 2HB HIS 4 -24.828 10.041 5.423 31 HB3 HIS 4 1HB HIS 4 -24.120 8.473 5.795 32 HD1 HIS 4 1HD HIS 4 -22.129 8.709 7.761 33 HD2 HIS 4 2HD HIS 4 -25.143 11.567 7.624 34 HE1 HIS 4 1HE HIS 4 -22.140 9.784 10.034 35 HE2 HIS 4 2HE HIS 4 -23.920 11.564 9.902 36 H HIS 5 H HIS 5 -23.651 7.603 4.074 37 HA HIS 5 HA HIS 5 -21.239 6.101 4.578 38 HB2 HIS 5 2HB HIS 5 -24.035 5.473 3.792 39 HB3 HIS 5 1HB HIS 5 -22.794 4.323 3.307 40 HD1 HIS 5 1HD HIS 5 -21.101 3.769 5.532 41 HD2 HIS 5 2HD HIS 5 -25.071 4.807 6.185 42 HE1 HIS 5 1HE HIS 5 -21.648 2.920 7.836 43 HE2 HIS 5 2HE HIS 5 -24.080 3.483 8.174 44 H HIS 6 H HIS 6 -20.574 4.486 2.788 45 HA HIS 6 HA HIS 6 -19.800 6.072 0.497 46 HB2 HIS 6 2HB HIS 6 -18.942 3.523 1.729 47 HB3 HIS 6 1HB HIS 6 -18.764 3.623 -0.020 48 HD1 HIS 6 1HD HIS 6 -17.171 4.618 3.104 49 HD2 HIS 6 2HD HIS 6 -17.089 5.861 -0.859 50 HE1 HIS 6 1HE HIS 6 -15.099 6.026 2.884 51 HE2 HIS 6 2HE HIS 6 -15.024 6.695 0.456 52 H HIS 7 H HIS 7 -19.687 4.580 -1.634 53 HA HIS 7 HA HIS 7 -22.391 4.336 -2.484 54 HB2 HIS 7 2HB HIS 7 -19.717 4.086 -3.713 55 HB3 HIS 7 1HB HIS 7 -20.989 3.139 -4.480 56 HD1 HIS 7 1HD HIS 7 -23.059 4.522 -5.412 57 HD2 HIS 7 2HD HIS 7 -19.767 6.778 -4.254 58 HE1 HIS 7 1HE HIS 7 -23.403 6.789 -6.443 59 HE2 HIS 7 2HE HIS 7 -21.357 8.111 -5.801 60 H MET 8 H MET 8 -19.822 1.997 -1.786 61 HA MET 8 HA MET 8 -19.860 -0.238 -1.377 62 HB2 MET 8 2HB MET 8 -21.964 0.837 0.040 63 HB3 MET 8 1HB MET 8 -22.738 -0.467 -0.868 64 HG2 MET 8 2HG MET 8 -22.104 -1.724 0.867 65 HG3 MET 8 1HG MET 8 -20.539 -1.734 0.055 66 HE1 MET 8 3HE MET 8 -19.769 1.304 0.420 67 HE2 MET 8 1HE MET 8 -18.528 0.098 0.758 68 HE3 MET 8 2HE MET 8 -18.864 1.372 1.932 69 H SER 9 H SER 9 -21.368 -2.319 -1.893 70 HA SER 9 HA SER 9 -22.091 -3.724 -3.529 71 HB2 SER 9 2HB SER 9 -23.858 -1.670 -3.537 72 HB3 SER 9 1HB SER 9 -23.270 -1.580 -5.197 73 HG SER 9 HG SER 9 -25.076 -3.209 -4.273 74 H ASP 10 H ASP 10 -21.757 -4.366 -5.768 75 HA ASP 10 HA ASP 10 -19.230 -3.401 -6.752 76 HB2 ASP 10 2HB ASP 10 -20.430 -5.843 -6.786 77 HB3 ASP 10 1HB ASP 10 -20.759 -5.291 -8.425 78 H GLY 11 H GLY 11 -19.311 -3.538 -9.427 79 HA2 GLY 11 2HA GLY 11 -21.114 -2.650 -11.100 80 HA3 GLY 11 1HA GLY 11 -20.958 -1.210 -10.105 81 H HIS 12 H HIS 12 -18.784 -0.248 -9.943 82 HA HIS 12 HA HIS 12 -17.427 -0.442 -12.535 83 HB2 HIS 12 2HB HIS 12 -18.328 1.759 -11.201 84 HB3 HIS 12 1HB HIS 12 -16.636 1.716 -10.684 85 HD1 HIS 12 1HD HIS 12 -14.843 2.181 -12.474 86 HD2 HIS 12 2HD HIS 12 -18.738 2.338 -13.914 87 HE1 HIS 12 1HE HIS 12 -14.676 3.234 -14.752 88 HE2 HIS 12 2HE HIS 12 -17.035 3.242 -15.638 89 H ASN 13 H ASN 13 -16.795 -0.450 -9.056 90 HA ASN 13 HA ASN 13 -15.139 -1.446 -7.842 91 HB2 ASN 13 2HB ASN 13 -13.870 -2.406 -10.405 92 HB3 ASN 13 1HB ASN 13 -13.726 -3.096 -8.792 93 HD21 ASN 13 1HD2 ASN 13 -14.354 -4.725 -10.831 94 HD22 ASN 13 2HD2 ASN 13 -16.006 -5.223 -10.730 95 H GLY 14 H GLY 14 -13.677 -0.287 -10.895 96 HA2 GLY 14 2HA GLY 14 -11.276 0.600 -9.798 97 HA3 GLY 14 1HA GLY 14 -11.999 1.226 -11.282 98 H LEU 15 H LEU 15 -10.651 2.298 -8.648 99 HA LEU 15 HA LEU 15 -12.274 4.712 -8.584 100 HB2 LEU 15 2HB LEU 15 -11.848 2.877 -6.275 101 HB3 LEU 15 1HB LEU 15 -11.841 4.603 -5.968 102 HG LEU 15 HG LEU 15 -14.117 4.430 -7.389 103 HD11 LEU 15 1HD1 LEU 15 -15.276 2.371 -6.341 104 HD12 LEU 15 2HD1 LEU 15 -13.641 1.727 -6.200 105 HD13 LEU 15 3HD1 LEU 15 -14.285 2.156 -7.785 106 HD21 LEU 15 3HD2 LEU 15 -15.293 4.351 -5.207 107 HD22 LEU 15 1HD2 LEU 15 -13.942 5.485 -5.236 108 HD23 LEU 15 2HD2 LEU 15 -13.764 3.922 -4.439 109 H GLY 16 H GLY 16 -9.746 3.599 -6.361 110 HA2 GLY 16 2HA GLY 16 -7.649 4.407 -5.901 111 HA3 GLY 16 1HA GLY 16 -7.532 4.820 -7.604 112 H LYS 17 H LYS 17 -8.498 6.847 -8.290 113 HA LYS 17 HA LYS 17 -9.394 8.858 -6.580 114 HB2 LYS 17 2HB LYS 17 -7.064 8.662 -5.671 115 HB3 LYS 17 1HB LYS 17 -6.458 9.148 -7.248 116 HG2 LYS 17 2HG LYS 17 -6.539 10.987 -5.597 117 HG3 LYS 17 1HG LYS 17 -7.488 11.300 -7.052 118 HD2 LYS 17 2HD LYS 17 -9.454 11.282 -5.930 119 HD3 LYS 17 1HD LYS 17 -8.932 10.004 -4.831 120 HE2 LYS 17 2HE LYS 17 -7.381 11.840 -3.848 121 HE3 LYS 17 1HE LYS 17 -8.485 12.957 -4.654 122 HZ1 LYS 17 3HZ LYS 17 -8.870 12.090 -2.191 123 HZ2 LYS 17 1HZ LYS 17 -9.694 10.868 -3.022 124 HZ3 LYS 17 2HZ LYS 17 -10.150 12.484 -3.223 125 H GLY 18 H GLY 18 -7.576 8.009 -9.457 126 HA2 GLY 18 2HA GLY 18 -9.134 8.860 -11.419 127 HA3 GLY 18 1HA GLY 18 -8.480 10.403 -10.859 128 H PHE 19 H PHE 19 -6.819 7.270 -11.059 129 HA PHE 19 HA PHE 19 -5.203 8.311 -13.268 130 HB2 PHE 19 2HB PHE 19 -3.143 7.412 -12.106 131 HB3 PHE 19 1HB PHE 19 -3.854 8.861 -11.381 132 HD1 PHE 19 1HD PHE 19 -5.440 8.503 -9.392 133 HD2 PHE 19 2HD PHE 19 -2.731 5.543 -10.808 134 HE1 PHE 19 1HE PHE 19 -5.564 7.359 -7.219 135 HE2 PHE 19 2HE PHE 19 -2.848 4.396 -8.636 136 HZ PHE 19 HZ PHE 19 -4.267 5.301 -6.839 137 H GLY 20 H GLY 20 -5.598 5.450 -11.155 138 HA2 GLY 20 2HA GLY 20 -5.073 3.751 -13.496 139 HA3 GLY 20 1HA GLY 20 -5.015 3.233 -11.812 140 H ASP 21 H ASP 21 -6.528 1.729 -11.511 141 HA ASP 21 HA ASP 21 -9.267 2.346 -12.376 142 HB2 ASP 21 2HB ASP 21 -7.672 -0.121 -12.932 143 HB3 ASP 21 1HB ASP 21 -9.409 -0.289 -12.636 144 H HIS 22 H HIS 22 -8.589 -0.741 -10.924 145 HA HIS 22 HA HIS 22 -9.734 0.244 -8.393 146 HB2 HIS 22 2HB HIS 22 -10.550 -2.048 -8.036 147 HB3 HIS 22 1HB HIS 22 -11.164 -1.382 -9.542 148 HD1 HIS 22 1HD HIS 22 -9.363 -4.241 -8.173 149 HD2 HIS 22 2HD HIS 22 -9.777 -2.426 -11.889 150 HE1 HIS 22 1HE HIS 22 -8.564 -5.941 -9.844 151 HE2 HIS 22 2HE HIS 22 -8.760 -4.797 -12.080 152 H ILE 23 H ILE 23 -7.453 -2.031 -9.788 153 HA ILE 23 HA ILE 23 -5.890 -3.363 -8.580 154 HB ILE 23 HB ILE 23 -4.817 -0.570 -8.930 155 HG12 ILE 23 2HG1 ILE 23 -4.001 -1.826 -11.121 156 HG13 ILE 23 1HG1 ILE 23 -5.429 -2.806 -10.803 157 HG21 ILE 23 1HG2 ILE 23 -3.563 -2.857 -7.892 158 HG22 ILE 23 2HG2 ILE 23 -2.835 -1.316 -8.341 159 HG23 ILE 23 3HG2 ILE 23 -2.933 -2.621 -9.522 160 HD11 ILE 23 3HD1 ILE 23 -6.791 -1.220 -11.544 161 HD12 ILE 23 1HD1 ILE 23 -5.350 -0.445 -12.199 162 HD13 ILE 23 2HD1 ILE 23 -5.970 0.037 -10.619 163 H HIS 24 H HIS 24 -4.337 -0.703 -7.088 164 HA HIS 24 HA HIS 24 -4.622 -1.945 -4.503 165 HB2 HIS 24 2HB HIS 24 -3.096 0.592 -4.839 166 HB3 HIS 24 1HB HIS 24 -2.735 -0.822 -3.845 167 HD1 HIS 24 1HD HIS 24 -1.319 0.852 -6.525 168 HD2 HIS 24 2HD HIS 24 -2.260 -3.144 -5.892 169 HE1 HIS 24 1HE HIS 24 0.140 -0.439 -8.113 170 HE2 HIS 24 2HE HIS 24 -0.380 -2.860 -7.647 171 H TRP 25 H TRP 25 -6.979 -0.606 -5.570 172 HA TRP 25 HA TRP 25 -7.520 1.123 -3.291 173 HB2 TRP 25 2HB TRP 25 -8.807 2.504 -5.284 174 HB3 TRP 25 1HB TRP 25 -7.281 2.981 -4.537 175 HD1 TRP 25 HD TRP 25 -8.762 1.820 -7.771 176 HE1 TRP 25 1HE TRP 25 -6.925 1.664 -9.545 177 HE3 TRP 25 3HE TRP 25 -4.678 2.432 -4.795 178 HZ2 TRP 25 2HZ TRP 25 -4.114 1.821 -9.694 179 HZ3 TRP 25 3HZ TRP 25 -2.454 2.429 -5.810 180 HH2 TRP 25 HH TRP 25 -2.169 2.126 -8.222 181 H ARG 26 H ARG 26 -8.511 -1.226 -5.536 182 HA ARG 26 HA ARG 26 -11.112 -1.057 -6.019 183 HB2 ARG 26 2HB ARG 26 -10.116 -3.132 -6.519 184 HB3 ARG 26 1HB ARG 26 -9.560 -3.318 -4.886 185 HG2 ARG 26 2HG ARG 26 -11.255 -4.925 -5.264 186 HG3 ARG 26 1HG ARG 26 -11.888 -3.710 -4.157 187 HD2 ARG 26 2HD ARG 26 -13.624 -3.607 -5.533 188 HD3 ARG 26 1HD ARG 26 -12.540 -2.703 -6.600 189 HE ARG 26 HE ARG 26 -12.554 -4.476 -8.034 190 HH11 ARG 26 1HH1 ARG 26 -13.605 -5.589 -4.900 191 HH12 ARG 26 2HH1 ARG 26 -13.996 -7.181 -5.457 192 HH21 ARG 26 1HH2 ARG 26 -13.067 -6.569 -8.770 193 HH22 ARG 26 2HH2 ARG 26 -13.689 -7.738 -7.654 194 H THR 27 H THR 27 -9.841 -1.804 -2.759 195 HA THR 27 HA THR 27 -11.519 -0.332 -1.240 196 HB THR 27 HB THR 27 -13.504 -1.349 -2.094 197 HG1 THR 27 1HG THR 27 -13.000 -2.678 0.348 198 HG21 THR 27 3HG2 THR 27 -11.940 -3.773 -2.128 199 HG22 THR 27 1HG2 THR 27 -13.434 -3.375 -2.980 200 HG23 THR 27 2HG2 THR 27 -13.498 -4.004 -1.334 201 H LEU 28 H LEU 28 -10.897 -0.474 0.842 202 HA LEU 28 HA LEU 28 -8.805 -2.276 1.529 203 HB2 LEU 28 2HB LEU 28 -9.060 0.066 2.388 204 HB3 LEU 28 1HB LEU 28 -10.401 -0.506 3.383 205 HG LEU 28 HG LEU 28 -7.794 -1.915 3.656 206 HD11 LEU 28 1HD1 LEU 28 -6.783 -0.286 4.988 207 HD12 LEU 28 2HD1 LEU 28 -8.262 0.668 5.106 208 HD13 LEU 28 3HD1 LEU 28 -7.372 0.607 3.585 209 HD21 LEU 28 3HD2 LEU 28 -10.116 -1.185 5.407 210 HD22 LEU 28 1HD2 LEU 28 -8.585 -1.736 6.089 211 HD23 LEU 28 2HD2 LEU 28 -9.492 -2.785 4.999 212 H GLU 29 H GLU 29 -12.249 -2.196 2.094 213 HA GLU 29 HA GLU 29 -12.474 -3.989 4.205 214 HB2 GLU 29 2HB GLU 29 -14.241 -2.597 2.713 215 HB3 GLU 29 1HB GLU 29 -14.502 -4.210 2.061 216 HG2 GLU 29 2HG GLU 29 -15.108 -5.065 4.190 217 HG3 GLU 29 1HG GLU 29 -14.585 -3.588 5.000 218 H ASP 30 H ASP 30 -12.969 -4.802 0.761 219 HA ASP 30 HA ASP 30 -12.936 -7.577 1.133 220 HB2 ASP 30 2HB ASP 30 -13.371 -5.874 -0.999 221 HB3 ASP 30 1HB ASP 30 -11.889 -6.720 -1.465 222 H GLY 31 H GLY 31 -10.342 -5.280 0.852 223 HA2 GLY 31 2HA GLY 31 -8.268 -6.966 0.024 224 HA3 GLY 31 1HA GLY 31 -8.063 -5.514 1.007 225 H LYS 32 H LYS 32 -9.341 -6.195 3.331 226 HA LYS 32 HA LYS 32 -7.403 -7.909 4.541 227 HB2 LYS 32 2HB LYS 32 -8.553 -5.892 5.600 228 HB3 LYS 32 1HB LYS 32 -9.950 -6.936 5.828 229 HG2 LYS 32 2HG LYS 32 -7.314 -7.882 6.819 230 HG3 LYS 32 1HG LYS 32 -8.144 -6.606 7.714 231 HD2 LYS 32 2HD LYS 32 -9.821 -8.896 6.930 232 HD3 LYS 32 1HD LYS 32 -8.553 -9.254 8.103 233 HE2 LYS 32 2HE LYS 32 -9.374 -7.345 9.474 234 HE3 LYS 32 1HE LYS 32 -10.715 -7.167 8.342 235 HZ1 LYS 32 3HZ LYS 32 -11.272 -8.472 10.343 236 HZ2 LYS 32 1HZ LYS 32 -10.144 -9.643 9.876 237 HZ3 LYS 32 2HZ LYS 32 -11.497 -9.340 8.908 238 H LYS 33 H LYS 33 -10.864 -8.189 3.834 239 HA LYS 33 HA LYS 33 -11.221 -10.726 5.025 240 HB2 LYS 33 2HB LYS 33 -13.083 -9.203 4.493 241 HB3 LYS 33 1HB LYS 33 -12.782 -9.440 2.777 242 HG2 LYS 33 2HG LYS 33 -13.082 -11.998 3.539 243 HG3 LYS 33 1HG LYS 33 -14.114 -11.196 4.735 244 HD2 LYS 33 2HD LYS 33 -15.717 -10.968 3.210 245 HD3 LYS 33 1HD LYS 33 -14.626 -10.035 2.184 246 HE2 LYS 33 2HE LYS 33 -13.734 -12.533 1.695 247 HE3 LYS 33 1HE LYS 33 -15.432 -12.867 2.022 248 HZ1 LYS 33 3HZ LYS 33 -14.736 -10.687 0.182 249 HZ2 LYS 33 1HZ LYS 33 -16.113 -11.672 0.209 250 HZ3 LYS 33 2HZ LYS 33 -14.646 -12.283 -0.371 251 H GLU 34 H GLU 34 -9.991 -9.722 1.929 252 HA GLU 34 HA GLU 34 -10.154 -12.417 0.840 253 HB2 GLU 34 2HB GLU 34 -10.583 -10.286 -0.505 254 HB3 GLU 34 1HB GLU 34 -8.837 -10.038 -0.459 255 HG2 GLU 34 2HG GLU 34 -8.510 -11.479 -2.108 256 HG3 GLU 34 1HG GLU 34 -9.480 -12.722 -1.299 257 H ALA 35 H ALA 35 -7.753 -10.159 2.067 258 HA ALA 35 HA ALA 35 -5.423 -11.430 1.237 259 HB1 ALA 35 1HB ALA 35 -6.045 -9.761 3.653 260 HB2 ALA 35 2HB ALA 35 -5.163 -9.309 2.194 261 HB3 ALA 35 3HB ALA 35 -4.430 -10.410 3.363 262 H ALA 36 H ALA 36 -7.575 -12.164 3.906 263 HA ALA 36 HA ALA 36 -5.919 -13.951 5.304 264 HB1 ALA 36 1HB ALA 36 -8.904 -13.669 5.126 265 HB2 ALA 36 2HB ALA 36 -7.828 -13.162 6.428 266 HB3 ALA 36 3HB ALA 36 -8.130 -14.877 6.150 267 H ALA 37 H ALA 37 -8.544 -14.666 2.990 268 HA ALA 37 HA ALA 37 -8.000 -17.437 2.860 269 HB1 ALA 37 1HB ALA 37 -9.612 -17.541 1.153 270 HB2 ALA 37 2HB ALA 37 -9.340 -15.864 0.679 271 HB3 ALA 37 3HB ALA 37 -10.142 -16.229 2.206 272 H SER 38 H SER 38 -7.468 -14.949 0.353 273 HA SER 38 HA SER 38 -5.902 -16.545 -1.320 274 HB2 SER 38 2HB SER 38 -6.449 -13.645 -1.045 275 HB3 SER 38 1HB SER 38 -4.968 -14.077 -1.916 276 HG SER 38 HG SER 38 -7.597 -14.993 -2.492 277 H GLY 39 H GLY 39 -5.065 -14.692 1.520 278 HA2 GLY 39 2HA GLY 39 -3.147 -14.696 2.793 279 HA3 GLY 39 1HA GLY 39 -2.580 -16.051 1.811 280 H LEU 40 H LEU 40 -3.392 -12.701 0.925 281 HA LEU 40 HA LEU 40 -0.614 -12.392 -0.017 282 HB2 LEU 40 2HB LEU 40 -1.585 -10.836 -1.750 283 HB3 LEU 40 1HB LEU 40 -1.915 -12.541 -1.975 284 HG LEU 40 HG LEU 40 -4.171 -12.144 -0.926 285 HD11 LEU 40 1HD1 LEU 40 -4.711 -9.542 -1.350 286 HD12 LEU 40 2HD1 LEU 40 -3.043 -9.432 -0.787 287 HD13 LEU 40 3HD1 LEU 40 -4.264 -10.209 0.220 288 HD21 LEU 40 3HD2 LEU 40 -3.939 -12.368 -3.320 289 HD22 LEU 40 1HD2 LEU 40 -3.485 -10.669 -3.465 290 HD23 LEU 40 2HD2 LEU 40 -5.116 -11.106 -2.956 291 HA PRO 41 HA PRO 41 -0.236 -8.838 2.542 292 HB2 PRO 41 2HB PRO 41 1.265 -7.200 0.920 293 HB3 PRO 41 1HB PRO 41 1.920 -8.527 1.885 294 HG2 PRO 41 2HG PRO 41 1.220 -8.458 -1.015 295 HG3 PRO 41 1HG PRO 41 2.608 -9.218 -0.215 296 HD2 PRO 41 2HD PRO 41 0.484 -10.649 -1.040 297 HD3 PRO 41 1HD PRO 41 1.378 -11.068 0.435 298 H LEU 42 H LEU 42 -0.623 -6.491 2.621 299 HA LEU 42 HA LEU 42 -2.932 -5.810 0.957 300 HB2 LEU 42 2HB LEU 42 -2.028 -5.071 3.688 301 HB3 LEU 42 1HB LEU 42 -2.972 -3.891 2.800 302 HG LEU 42 HG LEU 42 -4.797 -5.506 2.561 303 HD11 LEU 42 1HD1 LEU 42 -3.816 -7.610 2.494 304 HD12 LEU 42 2HD1 LEU 42 -4.593 -7.580 4.076 305 HD13 LEU 42 3HD1 LEU 42 -2.855 -7.318 3.943 306 HD21 LEU 42 3HD2 LEU 42 -3.754 -4.882 5.299 307 HD22 LEU 42 1HD2 LEU 42 -5.264 -5.765 5.081 308 HD23 LEU 42 2HD2 LEU 42 -5.090 -4.141 4.419 309 H MET 43 H MET 43 -2.346 -4.775 -0.817 310 HA MET 43 HA MET 43 -0.062 -3.079 -0.995 311 HB2 MET 43 2HB MET 43 -1.402 -4.459 -2.824 312 HB3 MET 43 1HB MET 43 -2.278 -2.933 -3.004 313 HG2 MET 43 2HG MET 43 0.707 -3.311 -3.253 314 HG3 MET 43 1HG MET 43 -0.426 -3.132 -4.589 315 HE1 MET 43 3HE MET 43 1.650 0.088 -2.260 316 HE2 MET 43 1HE MET 43 2.063 -1.609 -2.509 317 HE3 MET 43 2HE MET 43 0.881 -1.161 -1.280 318 H VAL 44 H VAL 44 -0.182 -1.357 0.391 319 HA VAL 44 HA VAL 44 -2.573 0.328 0.264 320 HB VAL 44 HB VAL 44 -0.303 0.621 2.219 321 HG11 VAL 44 1HG1 VAL 44 -2.935 1.885 1.814 322 HG12 VAL 44 2HG1 VAL 44 -1.460 2.532 2.531 323 HG13 VAL 44 3HG1 VAL 44 -2.517 1.486 3.479 324 HG21 VAL 44 3HG2 VAL 44 -2.708 -1.163 2.292 325 HG22 VAL 44 1HG2 VAL 44 -1.986 -0.549 3.778 326 HG23 VAL 44 2HG2 VAL 44 -1.029 -1.538 2.675 327 H ILE 45 H ILE 45 -2.570 2.374 -0.350 328 HA ILE 45 HA ILE 45 -0.133 3.842 -0.772 329 HB ILE 45 HB ILE 45 -0.094 2.922 -2.922 330 HG12 ILE 45 2HG1 ILE 45 -1.685 5.478 -3.151 331 HG13 ILE 45 1HG1 ILE 45 0.069 5.361 -2.974 332 HG21 ILE 45 1HG2 ILE 45 -2.681 3.404 -4.010 333 HG22 ILE 45 2HG2 ILE 45 -2.837 2.470 -2.519 334 HG23 ILE 45 3HG2 ILE 45 -1.813 1.879 -3.827 335 HD11 ILE 45 3HD1 ILE 45 -0.593 3.788 -5.195 336 HD12 ILE 45 1HD1 ILE 45 0.224 5.351 -5.177 337 HD13 ILE 45 2HD1 ILE 45 -1.532 5.274 -5.346 338 H ILE 46 H ILE 46 -0.495 5.843 -0.062 339 HA ILE 46 HA ILE 46 -3.272 6.821 -0.133 340 HB ILE 46 HB ILE 46 -1.348 7.558 2.049 341 HG12 ILE 46 2HG1 ILE 46 -3.352 5.541 2.748 342 HG13 ILE 46 1HG1 ILE 46 -2.140 4.947 1.616 343 HG21 ILE 46 1HG2 ILE 46 -3.248 8.251 3.235 344 HG22 ILE 46 2HG2 ILE 46 -4.339 7.385 2.159 345 HG23 ILE 46 3HG2 ILE 46 -3.503 8.828 1.588 346 HD11 ILE 46 3HD1 ILE 46 -1.675 4.628 4.082 347 HD12 ILE 46 1HD1 ILE 46 -1.419 6.372 4.156 348 HD13 ILE 46 2HD1 ILE 46 -0.390 5.371 3.129 349 H HIS 47 H HIS 47 -3.627 8.942 -0.546 350 HA HIS 47 HA HIS 47 -1.307 10.636 -1.149 351 HB2 HIS 47 2HB HIS 47 -3.717 10.811 -2.910 352 HB3 HIS 47 1HB HIS 47 -2.032 11.205 -3.266 353 HD1 HIS 47 1HD HIS 47 -1.240 9.721 -5.050 354 HD2 HIS 47 2HD HIS 47 -3.718 7.700 -2.391 355 HE1 HIS 47 1HE HIS 47 -1.355 7.362 -5.902 356 HE2 HIS 47 2HE HIS 47 -3.000 6.212 -4.381 357 H LYS 48 H LYS 48 -1.992 11.386 1.055 358 HA LYS 48 HA LYS 48 -4.478 12.912 1.110 359 HB2 LYS 48 2HB LYS 48 -2.458 12.072 3.117 360 HB3 LYS 48 1HB LYS 48 -3.338 13.555 3.449 361 HG2 LYS 48 2HG LYS 48 -5.363 11.901 2.738 362 HG3 LYS 48 1HG LYS 48 -4.245 10.769 3.501 363 HD2 LYS 48 2HD LYS 48 -5.332 11.437 5.375 364 HD3 LYS 48 1HD LYS 48 -4.156 12.751 5.301 365 HE2 LYS 48 2HE LYS 48 -6.080 13.762 3.719 366 HE3 LYS 48 1HE LYS 48 -7.064 12.768 4.791 367 HZ1 LYS 48 3HZ LYS 48 -6.661 15.141 5.500 368 HZ2 LYS 48 1HZ LYS 48 -5.062 14.690 5.820 369 HZ3 LYS 48 2HZ LYS 48 -6.332 13.953 6.660 370 H SER 49 H SER 49 -4.640 15.128 1.084 371 HA SER 49 HA SER 49 -4.073 17.289 0.644 372 HB2 SER 49 2HB SER 49 -2.317 18.209 1.858 373 HB3 SER 49 1HB SER 49 -2.601 16.714 2.749 374 HG SER 49 HG SER 49 -0.357 17.178 2.189 375 H TRP 50 H TRP 50 -1.492 18.339 -0.148 376 HA TRP 50 HA TRP 50 -1.571 18.154 -2.869 377 HB2 TRP 50 2HB TRP 50 0.753 18.948 -2.898 378 HB3 TRP 50 1HB TRP 50 -0.193 19.792 -1.662 379 HD1 TRP 50 HD TRP 50 0.139 18.652 0.931 380 HE1 TRP 50 1HE TRP 50 2.348 17.908 2.024 381 HE3 TRP 50 3HE TRP 50 2.987 18.116 -3.280 382 HZ2 TRP 50 2HZ TRP 50 4.952 17.188 1.209 383 HZ3 TRP 50 3HZ TRP 50 5.328 17.396 -3.037 384 HH2 TRP 50 HH TRP 50 6.289 16.943 -0.837 385 H CYS 51 H CYS 51 -0.759 16.833 -4.456 386 HA CYS 51 HA CYS 51 1.014 14.647 -3.774 387 HB2 CYS 51 2HB CYS 51 -0.954 13.531 -3.146 388 HB3 CYS 51 1HB CYS 51 -1.892 14.252 -4.446 389 H GLY 52 H GLY 52 2.087 13.794 -5.541 390 HA2 GLY 52 2HA GLY 52 1.396 14.953 -8.177 391 HA3 GLY 52 1HA GLY 52 3.066 14.788 -7.630 392 H ALA 53 H ALA 53 2.835 12.226 -6.444 393 HA ALA 53 HA ALA 53 3.393 10.551 -8.579 394 HB1 ALA 53 1HB ALA 53 3.518 10.307 -5.868 395 HB2 ALA 53 2HB ALA 53 3.821 9.000 -7.014 396 HB3 ALA 53 3HB ALA 53 2.227 9.177 -6.276 397 H CYS 54 H CYS 54 0.377 11.526 -7.294 398 HA CYS 54 HA CYS 54 -1.068 9.410 -8.542 399 HB2 CYS 54 2HB CYS 54 -3.086 10.936 -7.993 400 HB3 CYS 54 1HB CYS 54 -2.176 10.252 -6.639 401 H LYS 55 H LYS 55 -0.083 12.654 -9.300 402 HA LYS 55 HA LYS 55 -1.732 12.982 -11.604 403 HB2 LYS 55 2HB LYS 55 0.241 14.516 -10.179 404 HB3 LYS 55 1HB LYS 55 0.624 14.531 -11.895 405 HG2 LYS 55 2HG LYS 55 -1.846 15.154 -12.235 406 HG3 LYS 55 1HG LYS 55 -1.831 15.536 -10.504 407 HD2 LYS 55 2HD LYS 55 0.426 16.797 -11.361 408 HD3 LYS 55 1HD LYS 55 -0.620 16.962 -12.773 409 HE2 LYS 55 2HE LYS 55 -2.384 17.889 -11.307 410 HE3 LYS 55 1HE LYS 55 -1.265 17.800 -9.948 411 HZ1 LYS 55 3HZ LYS 55 -1.473 20.013 -11.138 412 HZ2 LYS 55 1HZ LYS 55 -0.607 19.304 -12.407 413 HZ3 LYS 55 2HZ LYS 55 0.096 19.437 -10.875 414 H ALA 56 H ALA 56 1.661 12.050 -11.073 415 HA ALA 56 HA ALA 56 2.209 11.529 -13.832 416 HB1 ALA 56 1HB ALA 56 3.758 11.836 -11.641 417 HB2 ALA 56 2HB ALA 56 4.314 11.109 -13.150 418 HB3 ALA 56 3HB ALA 56 3.789 10.081 -11.816 419 H LEU 57 H LEU 57 0.448 9.831 -11.473 420 HA LEU 57 HA LEU 57 0.957 7.182 -12.465 421 HB2 LEU 57 2HB LEU 57 -0.784 8.416 -10.400 422 HB3 LEU 57 1HB LEU 57 -1.285 6.865 -11.035 423 HG LEU 57 HG LEU 57 0.435 7.297 -8.913 424 HD11 LEU 57 1HD1 LEU 57 -0.411 5.259 -8.703 425 HD12 LEU 57 2HD1 LEU 57 0.948 4.715 -9.685 426 HD13 LEU 57 3HD1 LEU 57 -0.607 5.063 -10.443 427 HD21 LEU 57 3HD2 LEU 57 2.167 7.848 -10.717 428 HD22 LEU 57 1HD2 LEU 57 2.124 6.127 -11.095 429 HD23 LEU 57 2HD2 LEU 57 2.607 6.665 -9.487 430 H LYS 58 H LYS 58 -1.524 9.640 -12.987 431 HA LYS 58 HA LYS 58 -3.497 8.100 -14.123 432 HB2 LYS 58 2HB LYS 58 -2.750 10.862 -15.079 433 HB3 LYS 58 1HB LYS 58 -4.314 10.085 -15.218 434 HG2 LYS 58 2HG LYS 58 -4.465 10.062 -12.750 435 HG3 LYS 58 1HG LYS 58 -2.949 10.960 -12.683 436 HD2 LYS 58 2HD LYS 58 -4.412 12.459 -14.433 437 HD3 LYS 58 1HD LYS 58 -5.658 11.874 -13.328 438 HE2 LYS 58 2HE LYS 58 -3.923 12.606 -11.498 439 HE3 LYS 58 1HE LYS 58 -3.309 13.632 -12.793 440 HZ1 LYS 58 3HZ LYS 58 -4.947 14.778 -11.424 441 HZ2 LYS 58 1HZ LYS 58 -6.109 13.610 -11.805 442 HZ3 LYS 58 2HZ LYS 58 -5.493 14.618 -13.016 443 HA PRO 59 HA PRO 59 -1.716 8.383 -18.546 444 HB2 PRO 59 2HB PRO 59 0.616 9.628 -19.027 445 HB3 PRO 59 1HB PRO 59 -0.916 10.519 -18.913 446 HG2 PRO 59 2HG PRO 59 1.215 10.142 -16.832 447 HG3 PRO 59 1HG PRO 59 0.363 11.623 -17.305 448 HD2 PRO 59 2HD PRO 59 -0.333 10.171 -15.121 449 HD3 PRO 59 1HD PRO 59 -1.510 11.096 -16.087 450 H LYS 60 H LYS 60 0.488 7.898 -15.908 451 HA LYS 60 HA LYS 60 2.147 6.047 -17.418 452 HB2 LYS 60 2HB LYS 60 3.429 7.300 -15.910 453 HB3 LYS 60 1HB LYS 60 2.222 7.164 -14.640 454 HG2 LYS 60 2HG LYS 60 4.083 5.796 -14.054 455 HG3 LYS 60 1HG LYS 60 2.723 4.747 -14.463 456 HD2 LYS 60 2HD LYS 60 4.814 3.926 -15.438 457 HD3 LYS 60 1HD LYS 60 3.689 4.429 -16.702 458 HE2 LYS 60 2HE LYS 60 5.181 6.717 -16.051 459 HE3 LYS 60 1HE LYS 60 6.343 5.388 -16.126 460 HZ1 LYS 60 3HZ LYS 60 5.509 6.754 -18.257 461 HZ2 LYS 60 1HZ LYS 60 4.408 5.469 -18.284 462 HZ3 LYS 60 2HZ LYS 60 6.071 5.160 -18.331 463 H PHE 61 H PHE 61 0.567 5.849 -14.249 464 HA PHE 61 HA PHE 61 0.554 3.124 -14.011 465 HB2 PHE 61 2HB PHE 61 -0.061 4.853 -12.277 466 HB3 PHE 61 1HB PHE 61 -1.671 4.865 -12.999 467 HD1 PHE 61 1HD PHE 61 -2.985 2.712 -13.058 468 HD2 PHE 61 2HD PHE 61 0.563 3.181 -10.761 469 HE1 PHE 61 1HE PHE 61 -3.600 0.748 -11.713 470 HE2 PHE 61 2HE PHE 61 -0.045 1.222 -9.409 471 HZ PHE 61 HZ PHE 61 -2.128 -0.001 -9.884 472 H ALA 62 H ALA 62 -1.336 5.068 -16.145 473 HA ALA 62 HA ALA 62 -3.564 3.445 -16.551 474 HB1 ALA 62 1HB ALA 62 -2.327 5.650 -17.846 475 HB2 ALA 62 2HB ALA 62 -3.966 5.033 -18.063 476 HB3 ALA 62 3HB ALA 62 -2.654 4.422 -19.071 477 H GLU 63 H GLU 63 -0.247 2.920 -17.135 478 HA GLU 63 HA GLU 63 -0.451 0.861 -19.129 479 HB2 GLU 63 2HB GLU 63 1.543 2.505 -18.470 480 HB3 GLU 63 1HB GLU 63 1.944 1.188 -17.363 481 HG2 GLU 63 2HG GLU 63 2.717 -0.111 -19.007 482 HG3 GLU 63 1HG GLU 63 1.388 0.296 -20.090 483 H SER 64 H SER 64 -0.894 1.073 -15.800 484 HA SER 64 HA SER 64 0.025 -1.350 -14.823 485 HB2 SER 64 2HB SER 64 -2.320 0.345 -14.013 486 HB3 SER 64 1HB SER 64 -1.730 -1.009 -13.066 487 HG SER 64 HG SER 64 -0.218 1.278 -13.796 488 H THR 65 H THR 65 -2.035 -1.127 -17.357 489 HA THR 65 HA THR 65 -4.219 -2.707 -16.853 490 HB THR 65 HB THR 65 -2.663 -3.304 -19.325 491 HG1 THR 65 1HG THR 65 -3.727 -0.752 -18.702 492 HG21 THR 65 3HG2 THR 65 -5.468 -2.291 -19.130 493 HG22 THR 65 1HG2 THR 65 -5.069 -3.991 -18.873 494 HG23 THR 65 2HG2 THR 65 -4.708 -3.225 -20.420 495 H GLU 66 H GLU 66 -0.871 -3.631 -17.376 496 HA GLU 66 HA GLU 66 -1.450 -6.451 -17.076 497 HB2 GLU 66 2HB GLU 66 0.934 -6.802 -17.295 498 HB3 GLU 66 1HB GLU 66 0.412 -5.651 -18.533 499 HG2 GLU 66 2HG GLU 66 1.227 -4.357 -16.076 500 HG3 GLU 66 1HG GLU 66 2.511 -5.338 -16.775 501 H ILE 67 H ILE 67 -0.476 -3.732 -15.131 502 HA ILE 67 HA ILE 67 0.392 -5.259 -12.890 503 HB ILE 67 HB ILE 67 -0.680 -2.439 -13.006 504 HG12 ILE 67 2HG1 ILE 67 2.148 -3.517 -12.939 505 HG13 ILE 67 1HG1 ILE 67 1.361 -2.732 -14.316 506 HG21 ILE 67 1HG2 ILE 67 0.639 -2.265 -10.808 507 HG22 ILE 67 2HG2 ILE 67 0.535 -4.025 -10.775 508 HG23 ILE 67 3HG2 ILE 67 -0.937 -3.054 -10.773 509 HD11 ILE 67 3HD1 ILE 67 2.555 -1.566 -11.887 510 HD12 ILE 67 1HD1 ILE 67 1.083 -0.802 -12.485 511 HD13 ILE 67 2HD1 ILE 67 2.490 -0.948 -13.536 512 H SER 68 H SER 68 -2.650 -4.612 -14.302 513 HA SER 68 HA SER 68 -4.314 -4.741 -12.018 514 HB2 SER 68 2HB SER 68 -6.110 -5.020 -13.525 515 HB3 SER 68 1HB SER 68 -4.931 -4.096 -14.455 516 HG SER 68 HG SER 68 -4.213 -6.251 -15.222 517 H GLU 69 H GLU 69 -2.749 -7.106 -14.053 518 HA GLU 69 HA GLU 69 -4.031 -9.367 -12.809 519 HB2 GLU 69 2HB GLU 69 -1.532 -9.475 -14.486 520 HB3 GLU 69 1HB GLU 69 -2.758 -10.717 -14.274 521 HG2 GLU 69 2HG GLU 69 -3.095 -8.125 -15.767 522 HG3 GLU 69 1HG GLU 69 -2.896 -9.725 -16.479 523 H LEU 70 H LEU 70 -0.933 -7.694 -12.695 524 HA LEU 70 HA LEU 70 0.362 -9.463 -10.905 525 HB2 LEU 70 2HB LEU 70 0.773 -6.604 -11.691 526 HB3 LEU 70 1HB LEU 70 1.676 -7.269 -10.333 527 HG LEU 70 HG LEU 70 2.602 -9.007 -11.824 528 HD11 LEU 70 1HD1 LEU 70 2.262 -8.964 -14.170 529 HD12 LEU 70 2HD1 LEU 70 1.344 -7.460 -14.080 530 HD13 LEU 70 3HD1 LEU 70 0.670 -8.951 -13.415 531 HD21 LEU 70 3HD2 LEU 70 4.213 -7.627 -12.836 532 HD22 LEU 70 1HD2 LEU 70 3.661 -6.727 -11.424 533 HD23 LEU 70 2HD2 LEU 70 3.074 -6.295 -13.029 534 H SER 71 H SER 71 -2.165 -7.221 -10.453 535 HA SER 71 HA SER 71 -1.712 -6.440 -7.783 536 HB2 SER 71 2HB SER 71 -3.557 -5.808 -9.694 537 HB3 SER 71 1HB SER 71 -4.505 -6.793 -8.579 538 HG SER 71 HG SER 71 -4.658 -4.863 -7.657 539 H HIS 72 H HIS 72 -2.854 -9.390 -9.177 540 HA HIS 72 HA HIS 72 -4.399 -10.403 -7.074 541 HB2 HIS 72 2HB HIS 72 -2.902 -11.569 -9.366 542 HB3 HIS 72 1HB HIS 72 -3.326 -12.669 -8.045 543 HD1 HIS 72 1HD HIS 72 -5.675 -13.528 -8.005 544 HD2 HIS 72 2HD HIS 72 -5.213 -10.307 -10.589 545 HE1 HIS 72 1HE HIS 72 -7.858 -13.338 -9.239 546 HE2 HIS 72 2HE HIS 72 -7.584 -11.330 -10.737 547 H ASN 73 H ASN 73 -1.111 -9.691 -7.251 548 HA ASN 73 HA ASN 73 -0.113 -11.648 -5.438 549 HB2 ASN 73 2HB ASN 73 0.939 -9.041 -6.520 550 HB3 ASN 73 1HB ASN 73 1.845 -10.016 -5.358 551 HD21 ASN 73 1HD2 ASN 73 0.435 -9.968 -8.570 552 HD22 ASN 73 2HD2 ASN 73 1.420 -11.242 -9.222 553 H PHE 74 H PHE 74 -1.674 -8.583 -5.090 554 HA PHE 74 HA PHE 74 -1.772 -8.900 -2.212 555 HB2 PHE 74 2HB PHE 74 -1.277 -6.328 -2.067 556 HB3 PHE 74 1HB PHE 74 0.055 -7.482 -2.149 557 HD1 PHE 74 1HD PHE 74 -2.139 -5.971 -4.757 558 HD2 PHE 74 2HD PHE 74 1.802 -6.570 -3.275 559 HE1 PHE 74 1HE PHE 74 -1.231 -4.800 -6.722 560 HE2 PHE 74 2HE PHE 74 2.722 -5.403 -5.235 561 HZ PHE 74 HZ PHE 74 1.203 -4.514 -6.961 562 H VAL 75 H VAL 75 -3.054 -6.316 -1.724 563 HA VAL 75 HA VAL 75 -5.198 -6.327 -3.695 564 HB VAL 75 HB VAL 75 -5.856 -8.031 -2.051 565 HG11 VAL 75 1HG1 VAL 75 -6.348 -5.834 -0.077 566 HG12 VAL 75 2HG1 VAL 75 -4.800 -6.678 -0.119 567 HG13 VAL 75 3HG1 VAL 75 -6.286 -7.577 0.185 568 HG21 VAL 75 3HG2 VAL 75 -7.383 -6.098 -3.260 569 HG22 VAL 75 1HG2 VAL 75 -7.901 -5.980 -1.583 570 HG23 VAL 75 2HG2 VAL 75 -8.017 -7.516 -2.432 571 H MET 76 H MET 76 -6.424 -4.698 -3.893 572 HA MET 76 HA MET 76 -5.874 -2.165 -3.774 573 HB2 MET 76 2HB MET 76 -8.427 -1.909 -3.557 574 HB3 MET 76 1HB MET 76 -7.764 -2.815 -4.904 575 HG2 MET 76 2HG MET 76 -8.270 -4.435 -2.526 576 HG3 MET 76 1HG MET 76 -9.719 -3.706 -3.201 577 HE1 MET 76 3HE MET 76 -10.196 -6.136 -2.982 578 HE2 MET 76 1HE MET 76 -9.374 -7.446 -3.830 579 HE3 MET 76 2HE MET 76 -10.744 -6.631 -4.582 580 H VAL 77 H VAL 77 -5.080 -0.990 -2.066 581 HA VAL 77 HA VAL 77 -6.974 -0.381 0.050 582 HB VAL 77 HB VAL 77 -4.166 -1.301 0.655 583 HG11 VAL 77 1HG1 VAL 77 -5.982 0.475 2.154 584 HG12 VAL 77 2HG1 VAL 77 -4.227 0.323 2.229 585 HG13 VAL 77 3HG1 VAL 77 -5.249 -0.832 3.084 586 HG21 VAL 77 3HG2 VAL 77 -5.675 -2.668 2.321 587 HG22 VAL 77 1HG2 VAL 77 -5.412 -3.207 0.663 588 HG23 VAL 77 2HG2 VAL 77 -6.896 -2.356 1.091 589 H ASN 78 H ASN 78 -6.823 1.403 -1.711 590 HA ASN 78 HA ASN 78 -4.702 3.279 -0.958 591 HB2 ASN 78 2HB ASN 78 -4.424 3.231 -3.201 592 HB3 ASN 78 1HB ASN 78 -6.066 2.706 -3.502 593 HD21 ASN 78 1HD2 ASN 78 -4.155 5.493 -2.521 594 HD22 ASN 78 2HD2 ASN 78 -5.173 6.686 -3.269 595 H LEU 79 H LEU 79 -5.347 4.611 0.531 596 HA LEU 79 HA LEU 79 -8.065 5.756 0.313 597 HB2 LEU 79 2HB LEU 79 -8.158 6.043 2.642 598 HB3 LEU 79 1HB LEU 79 -7.505 4.436 2.402 599 HG LEU 79 HG LEU 79 -5.202 5.762 2.627 600 HD11 LEU 79 1HD1 LEU 79 -6.738 7.869 2.982 601 HD12 LEU 79 2HD1 LEU 79 -5.249 7.661 3.902 602 HD13 LEU 79 3HD1 LEU 79 -6.801 7.262 4.637 603 HD21 LEU 79 3HD2 LEU 79 -6.490 5.284 5.231 604 HD22 LEU 79 1HD2 LEU 79 -4.986 4.640 4.569 605 HD23 LEU 79 2HD2 LEU 79 -6.531 3.937 4.093 606 H GLU 80 H GLU 80 -8.295 8.051 0.892 607 HA GLU 80 HA GLU 80 -6.146 9.799 1.272 608 HB2 GLU 80 2HB GLU 80 -5.854 10.773 -0.946 609 HB3 GLU 80 1HB GLU 80 -5.435 9.057 -0.964 610 HG2 GLU 80 2HG GLU 80 -8.044 8.950 -1.661 611 HG3 GLU 80 1HG GLU 80 -7.569 10.505 -2.363 612 H ASP 81 H ASP 81 -7.958 10.402 2.660 613 HA ASP 81 HA ASP 81 -9.646 12.384 1.320 614 HB2 ASP 81 2HB ASP 81 -11.422 11.614 3.155 615 HB3 ASP 81 1HB ASP 81 -11.339 10.866 1.564 616 H GLU 82 H GLU 82 -10.137 11.553 4.663 617 HA GLU 82 HA GLU 82 -8.573 13.900 5.486 618 HB2 GLU 82 2HB GLU 82 -11.389 13.175 6.288 619 HB3 GLU 82 1HB GLU 82 -10.408 14.330 7.180 620 HG2 GLU 82 2HG GLU 82 -10.228 15.188 4.556 621 HG3 GLU 82 1HG GLU 82 -11.904 14.667 4.727 622 H GLU 83 H GLU 83 -9.352 10.624 5.985 623 HA GLU 83 HA GLU 83 -9.130 10.101 8.631 624 HB2 GLU 83 2HB GLU 83 -8.253 8.674 6.185 625 HB3 GLU 83 1HB GLU 83 -7.596 8.095 7.711 626 HG2 GLU 83 2HG GLU 83 -9.726 7.569 8.551 627 HG3 GLU 83 1HG GLU 83 -10.540 8.498 7.287 628 H GLU 84 H GLU 84 -6.204 9.701 6.655 629 HA GLU 84 HA GLU 84 -4.006 10.079 7.105 630 HB2 GLU 84 2HB GLU 84 -5.120 12.458 7.284 631 HB3 GLU 84 1HB GLU 84 -4.734 12.285 8.991 632 HG2 GLU 84 2HG GLU 84 -2.367 11.853 8.332 633 HG3 GLU 84 1HG GLU 84 -2.815 12.255 6.675 634 HA PRO 85 HA PRO 85 -4.403 7.491 10.958 635 HB2 PRO 85 2HB PRO 85 -1.847 6.601 9.685 636 HB3 PRO 85 1HB PRO 85 -3.121 5.636 10.458 637 HG2 PRO 85 2HG PRO 85 -2.924 5.744 7.805 638 HG3 PRO 85 1HG PRO 85 -4.514 5.749 8.603 639 HD2 PRO 85 2HD PRO 85 -3.026 7.988 7.309 640 HD3 PRO 85 1HD PRO 85 -4.779 7.693 7.402 641 H LYS 86 H LYS 86 -3.190 7.552 12.862 642 HA LYS 86 HA LYS 86 -1.201 9.712 12.960 643 HB2 LYS 86 2HB LYS 86 -3.417 9.559 14.415 644 HB3 LYS 86 1HB LYS 86 -2.390 8.544 15.435 645 HG2 LYS 86 2HG LYS 86 -0.967 10.291 15.959 646 HG3 LYS 86 1HG LYS 86 -1.446 11.240 14.549 647 HD2 LYS 86 2HD LYS 86 -3.203 12.158 15.612 648 HD3 LYS 86 1HD LYS 86 -3.626 10.647 16.421 649 HE2 LYS 86 2HE LYS 86 -1.151 12.021 17.302 650 HE3 LYS 86 1HE LYS 86 -2.689 12.767 17.735 651 HZ1 LYS 86 3HZ LYS 86 -2.498 11.379 19.482 652 HZ2 LYS 86 1HZ LYS 86 -1.506 10.279 18.666 653 HZ3 LYS 86 2HZ LYS 86 -3.178 10.257 18.416 654 H ASP 87 H ASP 87 -0.245 7.359 11.967 655 HA ASP 87 HA ASP 87 1.729 6.668 13.970 656 HB2 ASP 87 2HB ASP 87 -0.501 4.967 13.516 657 HB3 ASP 87 1HB ASP 87 0.910 4.180 12.796 658 H GLU 88 H GLU 88 2.870 4.489 12.646 659 HA GLU 88 HA GLU 88 4.215 5.848 10.506 660 HB2 GLU 88 2HB GLU 88 4.504 3.112 11.723 661 HB3 GLU 88 1HB GLU 88 5.447 3.625 10.333 662 HG2 GLU 88 2HG GLU 88 6.850 4.073 12.078 663 HG3 GLU 88 1HG GLU 88 6.087 5.638 11.818 664 H ASP 89 H ASP 89 1.580 3.645 10.752 665 HA ASP 89 HA ASP 89 1.650 2.196 8.437 666 HB2 ASP 89 2HB ASP 89 -0.193 2.560 10.379 667 HB3 ASP 89 1HB ASP 89 -0.986 3.389 9.032 668 H PHE 90 H PHE 90 1.312 5.635 8.668 669 HA PHE 90 HA PHE 90 0.508 5.740 5.842 670 HB2 PHE 90 2HB PHE 90 -0.417 7.871 6.198 671 HB3 PHE 90 1HB PHE 90 -0.865 6.950 7.640 672 HD1 PHE 90 1HD PHE 90 1.439 9.514 6.321 673 HD2 PHE 90 2HD PHE 90 -0.143 7.617 9.784 674 HE1 PHE 90 1HE PHE 90 2.455 11.254 7.734 675 HE2 PHE 90 2HE PHE 90 0.867 9.353 11.204 676 HZ PHE 90 HZ PHE 90 2.168 11.177 10.178 677 H SER 91 H SER 91 3.029 6.618 8.088 678 HA SER 91 HA SER 91 4.870 7.053 5.946 679 HB2 SER 91 2HB SER 91 4.119 9.442 7.653 680 HB3 SER 91 1HB SER 91 5.452 9.386 6.489 681 HG SER 91 HG SER 91 3.998 10.007 5.111 682 HA PRO 92 HA PRO 92 6.715 5.533 9.927 683 HB2 PRO 92 2HB PRO 92 8.218 3.794 8.090 684 HB3 PRO 92 1HB PRO 92 7.236 3.358 9.501 685 HG2 PRO 92 2HG PRO 92 6.438 2.819 6.988 686 HG3 PRO 92 1HG PRO 92 5.291 3.240 8.270 687 HD2 PRO 92 2HD PRO 92 6.385 4.955 6.070 688 HD3 PRO 92 1HD PRO 92 4.728 4.857 6.695 689 H ASP 93 H ASP 93 8.555 5.589 6.867 690 HA ASP 93 HA ASP 93 10.716 7.007 8.259 691 HB2 ASP 93 2HB ASP 93 12.047 6.379 6.183 692 HB3 ASP 93 1HB ASP 93 11.540 5.035 7.216 693 H GLY 94 H GLY 94 9.500 9.023 8.163 694 HA2 GLY 94 2HA GLY 94 10.356 10.905 6.471 695 HA3 GLY 94 1HA GLY 94 9.059 10.173 5.526 696 H GLY 95 H GLY 95 8.635 12.692 5.904 697 HA2 GLY 95 2HA GLY 95 6.843 12.887 8.250 698 HA3 GLY 95 1HA GLY 95 7.715 14.261 7.566 699 H TYR 96 H TYR 96 6.990 12.915 4.838 700 HA TYR 96 HA TYR 96 5.018 14.631 4.034 701 HB2 TYR 96 2HB TYR 96 4.441 12.707 2.326 702 HB3 TYR 96 1HB TYR 96 5.977 13.579 2.230 703 HD1 TYR 96 1HD TYR 96 8.045 12.496 3.187 704 HD2 TYR 96 2HD TYR 96 4.395 10.367 2.687 705 HE1 TYR 96 1HE TYR 96 9.270 10.373 3.341 706 HE2 TYR 96 2HE TYR 96 5.614 8.232 2.832 707 HH TYR 96 HH TYR 96 8.313 7.755 4.116 708 H ILE 97 H ILE 97 2.778 13.886 3.163 709 HA ILE 97 HA ILE 97 1.441 12.001 4.877 710 HB ILE 97 HB ILE 97 -0.177 13.555 5.811 711 HG12 ILE 97 2HG1 ILE 97 -0.487 15.423 4.532 712 HG13 ILE 97 1HG1 ILE 97 0.681 16.055 5.685 713 HG21 ILE 97 1HG2 ILE 97 1.213 14.575 7.459 714 HG22 ILE 97 2HG2 ILE 97 2.608 14.526 6.381 715 HG23 ILE 97 3HG2 ILE 97 1.924 13.026 7.008 716 HD11 ILE 97 3HD1 ILE 97 1.242 16.778 3.466 717 HD12 ILE 97 1HD1 ILE 97 1.280 15.111 2.895 718 HD13 ILE 97 2HD1 ILE 97 2.478 15.673 4.061 719 HA PRO 98 HA PRO 98 0.883 10.100 4.048 720 HB2 PRO 98 2HB PRO 98 -1.809 9.488 2.774 721 HB3 PRO 98 1HB PRO 98 -0.914 8.476 3.944 722 HG2 PRO 98 2HG PRO 98 -2.549 10.741 4.480 723 HG3 PRO 98 1HG PRO 98 -1.561 9.795 5.631 724 HD2 PRO 98 2HD PRO 98 -0.862 12.253 5.168 725 HD3 PRO 98 1HD PRO 98 0.393 11.004 5.132 726 H ARG 99 H ARG 99 1.812 8.366 2.907 727 HA ARG 99 HA ARG 99 1.864 8.708 -0.015 728 HB2 ARG 99 2HB ARG 99 3.981 8.547 1.987 729 HB3 ARG 99 1HB ARG 99 4.227 7.442 0.632 730 HG2 ARG 99 2HG ARG 99 5.314 9.633 0.332 731 HG3 ARG 99 1HG ARG 99 4.142 9.263 -0.931 732 HD2 ARG 99 2HD ARG 99 2.873 10.646 1.249 733 HD3 ARG 99 1HD ARG 99 4.268 11.557 0.674 734 HE ARG 99 HE ARG 99 2.667 10.665 -1.493 735 HH11 ARG 99 1HH1 ARG 99 2.793 13.055 1.046 736 HH12 ARG 99 2HH1 ARG 99 1.841 14.211 0.177 737 HH21 ARG 99 1HH2 ARG 99 1.412 12.184 -2.638 738 HH22 ARG 99 2HH2 ARG 99 1.055 13.717 -1.914 739 H ILE 100 H ILE 100 3.293 6.517 -0.747 740 HA ILE 100 HA ILE 100 1.356 4.392 -0.308 741 HB ILE 100 HB ILE 100 1.929 4.896 -2.607 742 HG12 ILE 100 2HG1 ILE 100 3.207 2.254 -1.907 743 HG13 ILE 100 1HG1 ILE 100 1.471 2.522 -1.861 744 HG21 ILE 100 1HG2 ILE 100 4.250 4.324 -3.413 745 HG22 ILE 100 2HG2 ILE 100 4.738 4.327 -1.718 746 HG23 ILE 100 3HG2 ILE 100 4.098 5.796 -2.454 747 HD11 ILE 100 3HD1 ILE 100 2.422 3.421 -4.370 748 HD12 ILE 100 1HD1 ILE 100 1.348 2.068 -4.016 749 HD13 ILE 100 2HD1 ILE 100 3.092 1.819 -4.065 750 H LEU 101 H LEU 101 2.088 2.148 0.004 751 HA LEU 101 HA LEU 101 4.659 1.441 0.861 752 HB2 LEU 101 2HB LEU 101 3.829 1.178 3.359 753 HB3 LEU 101 1HB LEU 101 4.646 2.611 2.797 754 HG LEU 101 HG LEU 101 1.811 2.882 2.392 755 HD11 LEU 101 1HD1 LEU 101 2.501 2.748 5.270 756 HD12 LEU 101 2HD1 LEU 101 2.087 1.257 4.424 757 HD13 LEU 101 3HD1 LEU 101 0.935 2.595 4.471 758 HD21 LEU 101 3HD2 LEU 101 2.855 4.889 2.464 759 HD22 LEU 101 1HD2 LEU 101 4.075 4.337 3.615 760 HD23 LEU 101 2HD2 LEU 101 2.456 4.756 4.176 761 H PHE 102 H PHE 102 4.834 -0.756 1.459 762 HA PHE 102 HA PHE 102 2.361 -2.289 0.999 763 HB2 PHE 102 2HB PHE 102 5.257 -3.142 0.857 764 HB3 PHE 102 1HB PHE 102 3.886 -4.206 0.577 765 HD1 PHE 102 2HD PHE 102 5.098 -0.874 -0.601 766 HD2 PHE 102 1HD PHE 102 3.369 -4.630 -1.607 767 HE1 PHE 102 2HE PHE 102 5.095 -0.232 -2.976 768 HE2 PHE 102 1HE PHE 102 3.364 -3.997 -3.983 769 HZ PHE 102 HZ PHE 102 4.227 -1.794 -4.671 770 H LEU 103 H LEU 103 1.631 -3.840 2.443 771 HA LEU 103 HA LEU 103 3.083 -4.019 5.000 772 HB2 LEU 103 2HB LEU 103 0.268 -4.406 5.400 773 HB3 LEU 103 1HB LEU 103 1.348 -3.281 6.168 774 HG LEU 103 HG LEU 103 -0.155 -2.810 3.621 775 HD11 LEU 103 1HD1 LEU 103 -0.706 -2.283 6.443 776 HD12 LEU 103 2HD1 LEU 103 -1.809 -2.405 5.072 777 HD13 LEU 103 3HD1 LEU 103 -0.940 -0.900 5.375 778 HD21 LEU 103 3HD2 LEU 103 2.204 -1.580 4.604 779 HD22 LEU 103 1HD2 LEU 103 0.881 -0.421 4.718 780 HD23 LEU 103 2HD2 LEU 103 1.268 -1.172 3.169 781 H ASP 104 H ASP 104 2.181 -5.834 6.388 782 HA ASP 104 HA ASP 104 2.254 -8.264 4.807 783 HB2 ASP 104 2HB ASP 104 2.371 -9.405 7.002 784 HB3 ASP 104 1HB ASP 104 3.610 -8.154 6.840 785 HA PRO 105 HA PRO 105 -2.034 -9.166 4.408 786 HB2 PRO 105 2HB PRO 105 -1.345 -11.730 5.790 787 HB3 PRO 105 1HB PRO 105 -2.290 -11.461 4.312 788 HG2 PRO 105 2HG PRO 105 0.249 -12.296 4.200 789 HG3 PRO 105 1HG PRO 105 -0.405 -11.153 3.005 790 HD2 PRO 105 2HD PRO 105 1.495 -10.679 5.232 791 HD3 PRO 105 1HD PRO 105 1.309 -9.809 3.698 792 H SER 106 H SER 106 -2.718 -7.620 5.924 793 HA SER 106 HA SER 106 -4.476 -8.267 7.829 794 HB2 SER 106 2HB SER 106 -3.035 -9.450 9.264 795 HB3 SER 106 1HB SER 106 -1.706 -8.305 9.019 796 HG SER 106 HG SER 106 -3.917 -8.148 10.709 797 H GLY 107 H GLY 107 -1.859 -6.175 6.919 798 HA2 GLY 107 2HA GLY 107 -2.351 -3.877 6.367 799 HA3 GLY 107 1HA GLY 107 -3.507 -3.860 7.704 800 H LYS 108 H LYS 108 -0.195 -5.137 7.727 801 HA LYS 108 HA LYS 108 0.459 -3.035 9.705 802 HB2 LYS 108 2HB LYS 108 0.671 -5.931 9.856 803 HB3 LYS 108 1HB LYS 108 2.204 -5.141 10.199 804 HG2 LYS 108 2HG LYS 108 0.248 -3.698 11.606 805 HG3 LYS 108 1HG LYS 108 -0.108 -5.415 11.862 806 HD2 LYS 108 2HD LYS 108 2.094 -5.815 12.697 807 HD3 LYS 108 1HD LYS 108 2.628 -4.202 12.222 808 HE2 LYS 108 2HE LYS 108 2.239 -4.245 14.601 809 HE3 LYS 108 1HE LYS 108 1.019 -3.234 13.828 810 HZ1 LYS 108 3HZ LYS 108 -0.584 -4.528 14.607 811 HZ2 LYS 108 1HZ LYS 108 0.573 -5.340 15.537 812 HZ3 LYS 108 2HZ LYS 108 0.145 -5.933 14.011 813 H VAL 109 H VAL 109 1.243 -1.757 7.877 814 HA VAL 109 HA VAL 109 3.172 -2.434 6.049 815 HB VAL 109 HB VAL 109 2.021 -0.174 6.303 816 HG11 VAL 109 1HG1 VAL 109 4.379 0.323 8.120 817 HG12 VAL 109 2HG1 VAL 109 2.686 0.278 8.616 818 HG13 VAL 109 3HG1 VAL 109 3.254 1.544 7.524 819 HG21 VAL 109 3HG2 VAL 109 4.847 -0.648 5.506 820 HG22 VAL 109 1HG2 VAL 109 4.242 1.008 5.512 821 HG23 VAL 109 2HG2 VAL 109 3.455 -0.214 4.518 822 H HIS 110 H HIS 110 5.292 -2.587 5.926 823 HA HIS 110 HA HIS 110 6.797 -2.506 8.453 824 HB2 HIS 110 2HB HIS 110 6.700 -4.514 6.284 825 HB3 HIS 110 1HB HIS 110 8.318 -4.096 6.840 826 HD1 HIS 110 1HD HIS 110 5.163 -5.772 7.927 827 HD2 HIS 110 2HD HIS 110 8.941 -4.936 9.440 828 HE1 HIS 110 1HE HIS 110 5.374 -7.160 10.014 829 HE2 HIS 110 2HE HIS 110 7.626 -6.557 10.967 830 HA PRO 111 HA PRO 111 8.891 0.832 6.365 831 HB2 PRO 111 2HB PRO 111 11.069 0.952 8.037 832 HB3 PRO 111 1HB PRO 111 9.505 1.693 8.386 833 HG2 PRO 111 2HG PRO 111 10.631 -0.896 9.355 834 HG3 PRO 111 1HG PRO 111 9.687 0.315 10.239 835 HD2 PRO 111 2HD PRO 111 8.594 -1.972 9.324 836 HD3 PRO 111 1HD PRO 111 7.683 -0.446 9.379 837 H GLU 112 H GLU 112 9.206 -1.797 5.286 838 HA GLU 112 HA GLU 112 12.053 -1.717 4.522 839 HB2 GLU 112 2HB GLU 112 11.406 -3.705 5.927 840 HB3 GLU 112 1HB GLU 112 10.334 -4.198 4.623 841 HG2 GLU 112 2HG GLU 112 12.721 -3.811 3.329 842 HG3 GLU 112 1HG GLU 112 13.217 -4.475 4.885 843 H ILE 113 H ILE 113 9.006 -3.205 3.386 844 HA ILE 113 HA ILE 113 9.742 -3.099 0.656 845 HB ILE 113 HB ILE 113 6.930 -3.250 1.732 846 HG12 ILE 113 2HG1 ILE 113 8.262 -4.957 2.837 847 HG13 ILE 113 1HG1 ILE 113 7.227 -5.718 1.619 848 HG21 ILE 113 1HG2 ILE 113 6.513 -4.499 -0.356 849 HG22 ILE 113 2HG2 ILE 113 8.174 -4.183 -0.853 850 HG23 ILE 113 3HG2 ILE 113 7.045 -2.844 -0.650 851 HD11 ILE 113 3HD1 ILE 113 10.075 -5.788 1.889 852 HD12 ILE 113 1HD1 ILE 113 9.632 -5.119 0.320 853 HD13 ILE 113 2HD1 ILE 113 9.028 -6.703 0.805 854 H ILE 114 H ILE 114 10.481 -0.904 0.526 855 HA ILE 114 HA ILE 114 8.311 1.062 0.205 856 HB ILE 114 HB ILE 114 9.859 2.793 0.797 857 HG12 ILE 114 2HG1 ILE 114 11.863 0.636 0.379 858 HG13 ILE 114 1HG1 ILE 114 11.956 2.343 -0.021 859 HG21 ILE 114 1HG2 ILE 114 9.546 2.416 2.968 860 HG22 ILE 114 2HG2 ILE 114 10.697 1.081 2.972 861 HG23 ILE 114 3HG2 ILE 114 9.018 0.790 2.532 862 HD11 ILE 114 3HD1 ILE 114 12.683 0.934 2.484 863 HD12 ILE 114 1HD1 ILE 114 12.105 2.594 2.596 864 HD13 ILE 114 2HD1 ILE 114 13.526 2.217 1.620 865 H ASN 115 H ASN 115 9.771 3.031 -1.103 866 HA ASN 115 HA ASN 115 9.631 2.214 -3.785 867 HB2 ASN 115 2HB ASN 115 9.328 4.542 -3.168 868 HB3 ASN 115 1HB ASN 115 10.973 4.624 -2.527 869 HD21 ASN 115 1HD2 ASN 115 9.805 6.317 -4.509 870 HD22 ASN 115 2HD2 ASN 115 10.730 6.105 -5.972 871 H GLU 116 H GLU 116 12.480 3.074 -1.859 872 HA GLU 116 HA GLU 116 14.621 2.300 -1.867 873 HB2 GLU 116 2HB GLU 116 13.117 0.105 -2.915 874 HB3 GLU 116 1HB GLU 116 14.623 0.240 -3.830 875 HG2 GLU 116 2HG GLU 116 14.475 0.147 -0.825 876 HG3 GLU 116 1HG GLU 116 14.728 -1.265 -1.849 877 H ASN 117 H ASN 117 13.423 1.816 -5.197 878 HA ASN 117 HA ASN 117 15.762 2.649 -6.474 879 HB2 ASN 117 2HB ASN 117 13.218 1.738 -7.246 880 HB3 ASN 117 1HB ASN 117 13.427 3.301 -8.050 881 HD21 ASN 117 1HD2 ASN 117 15.073 0.225 -7.446 882 HD22 ASN 117 2HD2 ASN 117 15.894 0.166 -8.982 883 H GLY 118 H GLY 118 13.307 4.505 -4.925 884 HA2 GLY 118 2HA GLY 118 13.917 6.944 -6.379 885 HA3 GLY 118 1HA GLY 118 12.778 6.774 -5.041 886 H ASN 119 H ASN 119 13.915 8.903 -4.579 887 HA ASN 119 HA ASN 119 16.538 9.130 -3.753 888 HB2 ASN 119 2HB ASN 119 15.553 10.919 -2.129 889 HB3 ASN 119 1HB ASN 119 15.429 11.159 -3.879 890 HD21 ASN 119 1HD2 ASN 119 13.725 12.632 -3.142 891 HD22 ASN 119 2HD2 ASN 119 12.120 11.990 -2.925 892 HA PRO 120 HA PRO 120 16.629 6.529 -0.134 893 HB2 PRO 120 2HB PRO 120 19.196 7.752 0.531 894 HB3 PRO 120 1HB PRO 120 18.847 6.098 -0.000 895 HG2 PRO 120 2HG PRO 120 20.155 7.899 -1.551 896 HG3 PRO 120 1HG PRO 120 19.123 6.613 -2.220 897 HD2 PRO 120 2HD PRO 120 18.509 9.520 -1.799 898 HD3 PRO 120 1HD PRO 120 18.114 8.466 -3.180 899 H SER 121 H SER 121 14.896 8.343 0.513 900 HA SER 121 HA SER 121 15.471 9.004 3.216 901 HB2 SER 121 2HB SER 121 15.622 11.189 1.152 902 HB3 SER 121 1HB SER 121 15.005 11.545 2.772 903 HG SER 121 HG SER 121 17.038 10.486 3.501 904 H TYR 122 H TYR 122 13.589 9.583 0.351 905 HA TYR 122 HA TYR 122 11.151 10.117 1.790 906 HB2 TYR 122 2HB TYR 122 12.216 10.491 -0.845 907 HB3 TYR 122 1HB TYR 122 10.667 9.658 -0.949 908 HD1 TYR 122 2HD TYR 122 8.849 10.785 0.784 909 HD2 TYR 122 1HD TYR 122 12.147 12.755 -1.039 910 HE1 TYR 122 2HE TYR 122 7.716 12.948 1.083 911 HE2 TYR 122 1HE TYR 122 11.031 14.922 -0.737 912 HH TYR 122 HH TYR 122 7.812 15.253 -0.059 913 H LYS 123 H LYS 123 12.372 7.623 -0.415 914 HA LYS 123 HA LYS 123 11.753 5.470 -0.802 915 HB2 LYS 123 2HB LYS 123 11.145 5.731 2.137 916 HB3 LYS 123 1HB LYS 123 11.017 4.203 1.284 917 HG2 LYS 123 2HG LYS 123 13.483 5.855 1.759 918 HG3 LYS 123 1HG LYS 123 13.122 4.223 2.349 919 HD2 LYS 123 2HD LYS 123 14.334 3.532 0.595 920 HD3 LYS 123 1HD LYS 123 12.898 3.920 -0.357 921 HE2 LYS 123 2HE LYS 123 14.437 6.293 0.072 922 HE3 LYS 123 1HE LYS 123 15.478 5.025 -0.572 923 HZ1 LYS 123 3HZ LYS 123 13.488 6.554 -1.899 924 HZ2 LYS 123 1HZ LYS 123 13.167 4.901 -2.057 925 HZ3 LYS 123 2HZ LYS 123 14.657 5.523 -2.554 926 H TYR 124 H TYR 124 9.252 5.461 1.596 927 HA TYR 124 HA TYR 124 7.233 4.417 0.147 928 HB2 TYR 124 2HB TYR 124 7.173 6.332 2.448 929 HB3 TYR 124 1HB TYR 124 5.685 5.660 1.760 930 HD1 TYR 124 1HD TYR 124 6.383 2.951 1.105 931 HD2 TYR 124 2HD TYR 124 7.548 5.261 4.478 932 HE1 TYR 124 1HE TYR 124 6.708 0.888 2.393 933 HE2 TYR 124 2HE TYR 124 7.875 3.202 5.779 934 HH TYR 124 HH TYR 124 6.755 0.663 5.507 935 H PHE 125 H PHE 125 8.345 7.702 -0.143 936 HA PHE 125 HA PHE 125 5.948 8.623 -1.455 937 HB2 PHE 125 2HB PHE 125 7.222 10.264 -0.243 938 HB3 PHE 125 1HB PHE 125 8.695 9.850 -1.132 939 HD1 PHE 125 2HD PHE 125 5.227 11.093 -1.727 940 HD2 PHE 125 1HD PHE 125 9.312 11.157 -2.918 941 HE1 PHE 125 2HE PHE 125 4.711 12.834 -3.387 942 HE2 PHE 125 1HE PHE 125 8.804 12.899 -4.580 943 HZ PHE 125 HZ PHE 125 6.501 13.738 -4.818 944 H TYR 126 H TYR 126 5.439 7.986 -3.436 945 HA TYR 126 HA TYR 126 7.594 7.308 -5.316 946 HB2 TYR 126 2HB TYR 126 4.696 6.485 -5.158 947 HB3 TYR 126 1HB TYR 126 5.665 6.229 -6.615 948 HD1 TYR 126 1HD TYR 126 6.630 5.826 -3.026 949 HD2 TYR 126 2HD TYR 126 5.916 3.924 -6.762 950 HE1 TYR 126 1HE TYR 126 7.440 3.704 -2.092 951 HE2 TYR 126 2HE TYR 126 6.726 1.795 -5.836 952 HH TYR 126 HH TYR 126 7.046 1.190 -2.627 953 H VAL 127 H VAL 127 6.888 7.699 -7.689 954 HA VAL 127 HA VAL 127 5.205 9.975 -8.164 955 HB VAL 127 HB VAL 127 7.142 11.275 -9.259 956 HG11 VAL 127 1HG1 VAL 127 7.245 11.246 -6.262 957 HG12 VAL 127 2HG1 VAL 127 5.815 11.809 -7.128 958 HG13 VAL 127 3HG1 VAL 127 7.365 12.618 -7.364 959 HG21 VAL 127 3HG2 VAL 127 8.945 10.258 -7.176 960 HG22 VAL 127 1HG2 VAL 127 9.284 10.739 -8.839 961 HG23 VAL 127 2HG2 VAL 127 8.634 9.134 -8.500 962 H SER 128 H SER 128 5.069 7.434 -9.173 963 HA SER 128 HA SER 128 4.530 7.580 -11.769 964 HB2 SER 128 2HB SER 128 6.691 6.597 -12.861 965 HB3 SER 128 1HB SER 128 6.584 8.344 -12.582 966 HG SER 128 HG SER 128 8.580 7.272 -11.880 967 H ALA 129 H ALA 129 3.586 5.714 -12.314 968 HA ALA 129 HA ALA 129 3.580 3.490 -10.621 969 HB1 ALA 129 1HB ALA 129 1.961 4.286 -12.577 970 HB2 ALA 129 2HB ALA 129 1.997 2.623 -11.993 971 HB3 ALA 129 3HB ALA 129 2.870 3.059 -13.461 972 H GLU 130 H GLU 130 5.681 4.308 -13.274 973 HA GLU 130 HA GLU 130 6.629 1.860 -14.093 974 HB2 GLU 130 2HB GLU 130 8.824 3.018 -14.488 975 HB3 GLU 130 1HB GLU 130 7.419 3.842 -15.174 976 HG2 GLU 130 2HG GLU 130 8.054 5.687 -14.141 977 HG3 GLU 130 1HG GLU 130 7.747 4.887 -12.590 978 H GLN 131 H GLN 131 7.391 3.626 -11.140 979 HA GLN 131 HA GLN 131 9.269 1.561 -10.362 980 HB2 GLN 131 2HB GLN 131 9.588 2.891 -8.329 981 HB3 GLN 131 1HB GLN 131 9.937 3.788 -9.801 982 HG2 GLN 131 2HG GLN 131 8.152 5.187 -9.539 983 HG3 GLN 131 1HG GLN 131 7.212 3.995 -8.641 984 HE21 GLN 131 1HE2 GLN 131 8.601 6.871 -8.334 985 HE22 GLN 131 2HE2 GLN 131 9.033 6.847 -6.661 986 H VAL 132 H VAL 132 5.983 2.576 -9.656 987 HA VAL 132 HA VAL 132 5.689 1.066 -7.291 988 HB VAL 132 HB VAL 132 3.421 1.447 -7.377 989 HG11 VAL 132 1HG1 VAL 132 3.179 3.733 -8.726 990 HG12 VAL 132 2HG1 VAL 132 4.934 3.621 -8.653 991 HG13 VAL 132 3HG1 VAL 132 3.991 3.606 -7.168 992 HG21 VAL 132 3HG2 VAL 132 3.577 1.543 -10.373 993 HG22 VAL 132 1HG2 VAL 132 2.124 1.891 -9.443 994 HG23 VAL 132 2HG2 VAL 132 2.850 0.284 -9.381 995 H VAL 133 H VAL 133 5.815 0.280 -10.636 996 HA VAL 133 HA VAL 133 4.630 -2.327 -10.346 997 HB VAL 133 HB VAL 133 4.401 -1.209 -12.491 998 HG11 VAL 133 1HG1 VAL 133 7.363 -1.094 -12.292 999 HG12 VAL 133 2HG1 VAL 133 6.221 0.147 -12.803 1000 HG13 VAL 133 3HG1 VAL 133 6.614 -1.190 -13.884 1001 HG21 VAL 133 3HG2 VAL 133 5.241 -3.019 -13.954 1002 HG22 VAL 133 1HG2 VAL 133 4.423 -3.630 -12.514 1003 HG23 VAL 133 2HG2 VAL 133 6.186 -3.639 -12.598 1004 H GLN 134 H GLN 134 7.900 -0.912 -10.459 1005 HA GLN 134 HA GLN 134 9.167 -3.489 -10.611 1006 HB2 GLN 134 2HB GLN 134 11.226 -2.345 -10.317 1007 HB3 GLN 134 1HB GLN 134 10.217 -1.276 -11.277 1008 HG2 GLN 134 2HG GLN 134 9.801 0.138 -9.429 1009 HG3 GLN 134 1HG GLN 134 10.495 -1.021 -8.304 1010 HE21 GLN 134 1HE2 GLN 134 11.421 0.712 -11.261 1011 HE22 GLN 134 2HE2 GLN 134 13.018 1.141 -10.710 1012 H GLY 135 H GLY 135 8.297 -1.263 -8.043 1013 HA2 GLY 135 2HA GLY 135 9.455 -2.823 -5.941 1014 HA3 GLY 135 1HA GLY 135 8.350 -1.456 -5.751 1015 H MET 136 H MET 136 6.434 -2.878 -7.672 1016 HA MET 136 HA MET 136 5.191 -4.473 -5.559 1017 HB2 MET 136 2HB MET 136 3.148 -4.290 -6.721 1018 HB3 MET 136 1HB MET 136 3.904 -2.715 -6.857 1019 HG2 MET 136 2HG MET 136 3.600 -2.819 -9.032 1020 HG3 MET 136 1HG MET 136 4.758 -4.145 -9.099 1021 HE1 MET 136 3HE MET 136 3.810 -6.830 -8.659 1022 HE2 MET 136 1HE MET 136 2.088 -7.119 -8.411 1023 HE3 MET 136 2HE MET 136 2.997 -6.160 -7.245 1024 H LYS 137 H LYS 137 6.675 -4.823 -8.680 1025 HA LYS 137 HA LYS 137 5.810 -7.525 -9.092 1026 HB2 LYS 137 2HB LYS 137 7.119 -7.504 -11.060 1027 HB3 LYS 137 1HB LYS 137 6.447 -5.888 -10.919 1028 HG2 LYS 137 2HG LYS 137 8.633 -5.203 -9.871 1029 HG3 LYS 137 1HG LYS 137 9.261 -6.777 -10.360 1030 HD2 LYS 137 2HD LYS 137 8.130 -4.652 -12.182 1031 HD3 LYS 137 1HD LYS 137 9.831 -5.090 -12.014 1032 HE2 LYS 137 2HE LYS 137 7.698 -7.026 -12.890 1033 HE3 LYS 137 1HE LYS 137 8.645 -6.056 -14.016 1034 HZ1 LYS 137 3HZ LYS 137 10.163 -7.564 -12.051 1035 HZ2 LYS 137 1HZ LYS 137 10.470 -7.310 -13.696 1036 HZ3 LYS 137 2HZ LYS 137 9.355 -8.487 -13.215 1037 H GLU 138 H GLU 138 8.175 -6.072 -7.165 1038 HA GLU 138 HA GLU 138 9.899 -8.430 -7.144 1039 HB2 GLU 138 2HB GLU 138 10.435 -5.721 -6.914 1040 HB3 GLU 138 1HB GLU 138 10.590 -6.316 -5.262 1041 HG2 GLU 138 2HG GLU 138 11.945 -8.199 -6.763 1042 HG3 GLU 138 1HG GLU 138 12.350 -6.657 -7.540 1043 H ALA 139 H ALA 139 8.256 -6.368 -4.763 1044 HA ALA 139 HA ALA 139 8.594 -8.205 -2.625 1045 HB1 ALA 139 1HB ALA 139 7.710 -6.596 -1.319 1046 HB2 ALA 139 2HB ALA 139 6.388 -6.262 -2.440 1047 HB3 ALA 139 3HB ALA 139 7.992 -5.592 -2.740 1048 H GLN 140 H GLN 140 6.401 -8.135 -5.222 1049 HA GLN 140 HA GLN 140 4.101 -9.188 -4.028 1050 HB2 GLN 140 2HB GLN 140 3.592 -9.990 -6.362 1051 HB3 GLN 140 1HB GLN 140 3.876 -8.264 -6.183 1052 HG2 GLN 140 2HG GLN 140 4.975 -8.971 -8.150 1053 HG3 GLN 140 1HG GLN 140 6.216 -8.683 -6.937 1054 HE21 GLN 140 1HE2 GLN 140 4.074 -11.426 -7.616 1055 HE22 GLN 140 2HE2 GLN 140 5.337 -12.597 -7.759 1056 H GLU 141 H GLU 141 7.076 -10.746 -4.984 1057 HA GLU 141 HA GLU 141 5.867 -13.375 -4.760 1058 HB2 GLU 141 2HB GLU 141 7.978 -14.265 -5.536 1059 HB3 GLU 141 1HB GLU 141 7.403 -12.980 -6.610 1060 HG2 GLU 141 2HG GLU 141 8.864 -11.413 -5.492 1061 HG3 GLU 141 1HG GLU 141 9.441 -12.698 -4.445 1062 H ARG 142 H ARG 142 8.206 -11.366 -3.099 1063 HA ARG 142 HA ARG 142 8.828 -13.430 -1.183 1064 HB2 ARG 142 2HB ARG 142 10.149 -11.603 -0.062 1065 HB3 ARG 142 1HB ARG 142 10.620 -11.964 -1.726 1066 HG2 ARG 142 2HG ARG 142 9.207 -10.016 -2.440 1067 HG3 ARG 142 1HG ARG 142 9.034 -9.609 -0.724 1068 HD2 ARG 142 2HD ARG 142 10.859 -8.396 -1.986 1069 HD3 ARG 142 1HD ARG 142 11.347 -9.207 -0.490 1070 HE ARG 142 HE ARG 142 11.699 -10.791 -2.875 1071 HH11 ARG 142 1HH1 ARG 142 13.152 -8.441 -0.740 1072 HH12 ARG 142 2HH1 ARG 142 14.773 -8.855 -1.186 1073 HH21 ARG 142 1HH2 ARG 142 13.832 -11.333 -3.462 1074 HH22 ARG 142 2HH2 ARG 142 15.159 -10.495 -2.731 1075 H LEU 143 H LEU 143 7.228 -10.242 -1.008 1076 HA LEU 143 HA LEU 143 6.481 -10.360 1.663 1077 HB2 LEU 143 2HB LEU 143 6.274 -8.511 -0.257 1078 HB3 LEU 143 1HB LEU 143 4.608 -9.087 -0.251 1079 HG LEU 143 HG LEU 143 4.384 -8.518 2.093 1080 HD11 LEU 143 1HD1 LEU 143 7.308 -7.921 1.872 1081 HD12 LEU 143 2HD1 LEU 143 6.456 -8.889 3.075 1082 HD13 LEU 143 3HD1 LEU 143 6.310 -7.131 3.092 1083 HD21 LEU 143 3HD2 LEU 143 5.513 -6.338 0.353 1084 HD22 LEU 143 1HD2 LEU 143 4.737 -6.038 1.909 1085 HD23 LEU 143 2HD2 LEU 143 3.818 -6.766 0.590 1086 H THR 144 H THR 144 5.200 -12.068 -1.050 1087 HA THR 144 HA THR 144 2.681 -12.687 0.235 1088 HB THR 144 HB THR 144 2.458 -14.212 -1.787 1089 HG1 THR 144 1HG THR 144 4.649 -14.366 -2.314 1090 HG21 THR 144 3HG2 THR 144 2.236 -12.300 -3.418 1091 HG22 THR 144 1HG2 THR 144 2.779 -11.255 -2.106 1092 HG23 THR 144 2HG2 THR 144 1.293 -12.189 -1.933 1093 H GLY 145 H GLY 145 2.338 -14.368 1.544 1094 HA2 GLY 145 2HA GLY 145 2.525 -16.495 2.436 1095 HA3 GLY 145 1HA GLY 145 3.726 -16.864 1.209 1096 H ASP 146 H ASP 146 4.064 -14.099 3.314 1097 HA ASP 146 HA ASP 146 5.681 -13.538 4.819 1098 HB2 ASP 146 2HB ASP 146 4.524 -16.045 5.663 1099 HB3 ASP 146 1HB ASP 146 6.207 -15.947 6.171 1100 H ALA 147 H ALA 147 6.502 -14.741 2.189 1101 HA ALA 147 HA ALA 147 8.897 -16.224 2.685 1102 HB1 ALA 147 1HB ALA 147 8.237 -14.765 0.142 1103 HB2 ALA 147 2HB ALA 147 7.484 -16.299 0.578 1104 HB3 ALA 147 3HB ALA 147 9.231 -16.205 0.353 1105 H PHE 148 H PHE 148 8.072 -12.870 2.520 1106 HA PHE 148 HA PHE 148 10.526 -11.737 1.827 1107 HB2 PHE 148 2HB PHE 148 9.711 -9.701 2.882 1108 HB3 PHE 148 1HB PHE 148 8.396 -10.482 1.995 1109 HD1 PHE 148 1HD PHE 148 6.592 -11.618 3.206 1110 HD2 PHE 148 2HD PHE 148 9.644 -9.471 5.252 1111 HE1 PHE 148 1HE PHE 148 5.206 -11.591 5.237 1112 HE2 PHE 148 2HE PHE 148 8.263 -9.441 7.288 1113 HZ PHE 148 HZ PHE 148 6.040 -10.502 7.283 1114 H ARG 149 H ARG 149 9.426 -13.162 4.803 1115 HA ARG 149 HA ARG 149 11.368 -12.069 6.528 1116 HB2 ARG 149 2HB ARG 149 9.764 -14.623 6.660 1117 HB3 ARG 149 1HB ARG 149 10.777 -14.041 7.967 1118 HG2 ARG 149 2HG ARG 149 9.366 -11.873 7.753 1119 HG3 ARG 149 1HG ARG 149 8.218 -12.928 6.926 1120 HD2 ARG 149 2HD ARG 149 7.546 -13.838 8.843 1121 HD3 ARG 149 1HD ARG 149 9.204 -14.137 9.361 1122 HE ARG 149 HE ARG 149 7.514 -11.939 10.125 1123 HH11 ARG 149 1HH1 ARG 149 10.812 -13.031 9.788 1124 HH12 ARG 149 2HH1 ARG 149 11.432 -11.911 10.953 1125 HH21 ARG 149 1HH2 ARG 149 8.330 -10.466 11.658 1126 HH22 ARG 149 2HH2 ARG 149 10.024 -10.455 12.016 1127 H LYS 150 H LYS 150 12.725 -13.996 7.759 1128 HA LYS 150 HA LYS 150 14.462 -15.084 5.647 1129 HB2 LYS 150 2HB LYS 150 15.440 -13.347 7.172 1130 HB3 LYS 150 1HB LYS 150 15.221 -14.471 8.506 1131 HG2 LYS 150 2HG LYS 150 16.624 -15.724 6.321 1132 HG3 LYS 150 1HG LYS 150 17.434 -14.244 6.836 1133 HD2 LYS 150 2HD LYS 150 16.499 -16.039 8.987 1134 HD3 LYS 150 1HD LYS 150 17.830 -16.638 7.996 1135 HE2 LYS 150 2HE LYS 150 18.968 -15.517 9.651 1136 HE3 LYS 150 1HE LYS 150 18.832 -14.266 8.415 1137 HZ1 LYS 150 3HZ LYS 150 17.223 -13.147 9.602 1138 HZ2 LYS 150 1HZ LYS 150 18.233 -13.706 10.841 1139 HZ3 LYS 150 2HZ LYS 150 16.777 -14.501 10.512 1140 H LYS 151 H LYS 151 14.512 -17.214 5.422 1141 HA LYS 151 HA LYS 151 14.319 -19.442 5.832 1142 HB2 LYS 151 2HB LYS 151 15.157 -18.338 8.470 1143 HB3 LYS 151 1HB LYS 151 14.601 -20.003 8.421 1144 HG2 LYS 151 2HG LYS 151 16.779 -18.920 6.655 1145 HG3 LYS 151 1HG LYS 151 17.068 -19.705 8.210 1146 HD2 LYS 151 2HD LYS 151 16.215 -21.769 7.435 1147 HD3 LYS 151 1HD LYS 151 15.510 -21.024 6.001 1148 HE2 LYS 151 2HE LYS 151 18.167 -20.374 5.772 1149 HE3 LYS 151 1HE LYS 151 18.224 -21.990 6.475 1150 HZ1 LYS 151 3HZ LYS 151 16.399 -22.335 4.568 1151 HZ2 LYS 151 1HZ LYS 151 18.054 -22.604 4.334 1152 HZ3 LYS 151 2HZ LYS 151 17.356 -21.146 3.840 1153 H HIS 152 H HIS 152 13.164 -20.911 7.862 1154 HA HIS 152 HA HIS 152 11.195 -21.597 8.767 1155 HB2 HIS 152 2HB HIS 152 10.338 -18.720 8.377 1156 HB3 HIS 152 1HB HIS 152 9.401 -19.940 9.229 1157 HD1 HIS 152 1HD HIS 152 13.085 -19.006 9.526 1158 HD2 HIS 152 2HD HIS 152 9.654 -19.334 11.846 1159 HE1 HIS 152 1HE HIS 152 13.815 -18.506 11.879 1160 HE2 HIS 152 2HE HIS 152 11.703 -18.611 13.248 1161 H LEU 153 H LEU 153 10.249 -19.210 6.282 1162 HA LEU 153 HA LEU 153 9.008 -19.409 4.387 1163 HB2 LEU 153 2HB LEU 153 10.333 -22.033 4.642 1164 HB3 LEU 153 1HB LEU 153 8.915 -22.007 3.612 1165 HG LEU 153 HG LEU 153 10.794 -19.820 3.079 1166 HD11 LEU 153 1HD1 LEU 153 12.129 -21.702 1.710 1167 HD12 LEU 153 2HD1 LEU 153 11.724 -22.618 3.161 1168 HD13 LEU 153 3HD1 LEU 153 12.631 -21.112 3.295 1169 HD21 LEU 153 3HD2 LEU 153 10.009 -20.040 0.973 1170 HD22 LEU 153 1HD2 LEU 153 8.710 -20.915 1.786 1171 HD23 LEU 153 2HD2 LEU 153 10.034 -21.803 1.031 1172 H GLU 154 H GLU 154 6.861 -19.415 4.097 1173 HA GLU 154 HA GLU 154 5.259 -21.208 5.803 1174 HB2 GLU 154 2HB GLU 154 4.761 -18.362 4.946 1175 HB3 GLU 154 1HB GLU 154 3.486 -19.386 5.591 1176 HG2 GLU 154 2HG GLU 154 5.652 -19.576 7.375 1177 HG3 GLU 154 1HG GLU 154 5.463 -17.868 6.981 1178 H ASP 155 H ASP 155 5.507 -19.635 2.655 1179 HA ASP 155 HA ASP 155 4.648 -20.157 0.616 1180 HB2 ASP 155 2HB ASP 155 4.798 -22.728 2.030 1181 HB3 ASP 155 1HB ASP 155 3.623 -22.701 0.718 1182 H GLU 156 H GLU 156 2.534 -21.147 -0.445 1183 HA GLU 156 HA GLU 156 0.346 -19.737 0.804 1184 HB2 GLU 156 2HB GLU 156 0.671 -21.185 -1.819 1185 HB3 GLU 156 1HB GLU 156 -0.893 -20.561 -1.285 1186 HG2 GLU 156 2HG GLU 156 1.579 -18.870 -1.574 1187 HG3 GLU 156 1HG GLU 156 0.370 -19.073 -2.839 1188 H LEU 157 H LEU 157 -1.802 -20.726 1.035 1189 HA LEU 157 HA LEU 157 -1.554 -23.406 2.188 1190 HB2 LEU 157 2HB LEU 157 -3.640 -21.251 2.496 1191 HB3 LEU 157 1HB LEU 157 -3.814 -22.859 3.172 1192 HG LEU 157 HG LEU 157 -1.289 -21.845 4.006 1193 HD11 LEU 157 1HD1 LEU 157 -3.549 -19.967 4.666 1194 HD12 LEU 157 2HD1 LEU 157 -2.294 -19.626 3.474 1195 HD13 LEU 157 3HD1 LEU 157 -1.863 -19.843 5.171 1196 HD21 LEU 157 3HD2 LEU 157 -3.256 -23.378 5.031 1197 HD22 LEU 157 1HD2 LEU 157 -3.539 -21.873 5.907 1198 HD23 LEU 157 2HD2 LEU 157 -1.963 -22.662 5.995 Start of MODEL 8 1 H1 MET 1 1HT MET 1 -6.405 -14.161 -22.992 2 H2 MET 1 2HT MET 1 -7.517 -15.468 -23.040 3 H3 MET 1 3HT MET 1 -5.844 -15.768 -22.797 4 HA MET 1 HA MET 1 -6.774 -15.990 -20.732 5 HB2 MET 1 2HB MET 1 -5.383 -13.428 -21.331 6 HB3 MET 1 1HB MET 1 -6.069 -13.609 -19.722 7 HG2 MET 1 2HG MET 1 -4.692 -15.997 -20.296 8 HG3 MET 1 1HG MET 1 -3.641 -14.667 -20.779 9 HE1 MET 1 2HE MET 1 -5.024 -16.814 -18.091 10 HE2 MET 1 3HE MET 1 -6.133 -15.507 -17.679 11 HE3 MET 1 1HE MET 1 -4.827 -15.937 -16.573 12 H HIS 2 H HIS 2 -9.116 -15.826 -21.848 13 HA HIS 2 HA HIS 2 -10.569 -13.883 -20.206 14 HB2 HIS 2 2HB HIS 2 -10.723 -14.177 -23.179 15 HB3 HIS 2 1HB HIS 2 -12.175 -13.738 -22.286 16 HD1 HIS 2 1HD HIS 2 -8.989 -12.377 -23.551 17 HD2 HIS 2 2HD HIS 2 -12.015 -11.207 -20.954 18 HE1 HIS 2 1HE HIS 2 -8.657 -9.909 -23.198 19 HE2 HIS 2 2HE HIS 2 -10.446 -9.241 -21.555 20 H HIS 3 H HIS 3 -12.836 -14.450 -19.887 21 HA HIS 3 HA HIS 3 -13.773 -17.043 -20.676 22 HB2 HIS 3 2HB HIS 3 -12.242 -16.853 -18.282 23 HB3 HIS 3 1HB HIS 3 -13.916 -17.144 -17.824 24 HD1 HIS 3 1HD HIS 3 -14.727 -19.497 -17.997 25 HD2 HIS 3 2HD HIS 3 -11.200 -18.886 -20.108 26 HE1 HIS 3 1HE HIS 3 -14.007 -21.777 -18.776 27 HE2 HIS 3 2HE HIS 3 -11.920 -21.370 -20.130 28 H HIS 4 H HIS 4 -14.139 -14.398 -18.334 29 HA HIS 4 HA HIS 4 -16.943 -14.744 -18.013 30 HB2 HIS 4 2HB HIS 4 -15.095 -12.437 -17.393 31 HB3 HIS 4 1HB HIS 4 -16.815 -12.421 -17.011 32 HD1 HIS 4 1HD HIS 4 -14.171 -15.111 -16.464 33 HD2 HIS 4 2HD HIS 4 -16.971 -12.880 -14.355 34 HE1 HIS 4 1HE HIS 4 -14.068 -15.964 -14.101 35 HE2 HIS 4 2HE HIS 4 -15.832 -14.660 -12.863 36 H HIS 5 H HIS 5 -18.647 -13.496 -18.833 37 HA HIS 5 HA HIS 5 -18.009 -11.990 -21.285 38 HB2 HIS 5 2HB HIS 5 -20.328 -13.848 -20.736 39 HB3 HIS 5 1HB HIS 5 -20.267 -12.755 -22.115 40 HD1 HIS 5 1HD HIS 5 -19.105 -13.594 -24.156 41 HD2 HIS 5 2HD HIS 5 -18.199 -15.849 -20.786 42 HE1 HIS 5 1HE HIS 5 -17.764 -15.548 -24.995 43 HE2 HIS 5 2HE HIS 5 -17.296 -16.941 -22.949 44 H HIS 6 H HIS 6 -18.883 -10.008 -21.506 45 HA HIS 6 HA HIS 6 -19.947 -8.069 -20.975 46 HB2 HIS 6 2HB HIS 6 -21.913 -10.167 -20.213 47 HB3 HIS 6 1HB HIS 6 -22.215 -8.532 -19.635 48 HD1 HIS 6 1HD HIS 6 -21.119 -9.927 -23.013 49 HD2 HIS 6 2HD HIS 6 -23.915 -7.342 -21.351 50 HE1 HIS 6 1HE HIS 6 -22.431 -9.017 -24.956 51 HE2 HIS 6 2HE HIS 6 -24.060 -7.389 -23.933 52 H HIS 7 H HIS 7 -18.531 -7.121 -19.577 53 HA HIS 7 HA HIS 7 -19.336 -6.864 -16.858 54 HB2 HIS 7 2HB HIS 7 -17.566 -8.994 -17.411 55 HB3 HIS 7 1HB HIS 7 -16.604 -7.736 -16.642 56 HD1 HIS 7 1HD HIS 7 -18.730 -10.516 -15.853 57 HD2 HIS 7 2HD HIS 7 -17.885 -6.848 -14.092 58 HE1 HIS 7 1HE HIS 7 -19.470 -10.733 -13.460 59 HE2 HIS 7 2HE HIS 7 -19.031 -8.473 -12.437 60 H MET 8 H MET 8 -18.802 -5.188 -19.147 61 HA MET 8 HA MET 8 -16.846 -3.395 -17.903 62 HB2 MET 8 2HB MET 8 -16.655 -4.643 -20.562 63 HB3 MET 8 1HB MET 8 -16.421 -2.891 -20.560 64 HG2 MET 8 2HG MET 8 -14.332 -3.204 -19.926 65 HG3 MET 8 1HG MET 8 -14.914 -3.894 -18.413 66 HE1 MET 8 3HE MET 8 -13.747 -6.222 -22.194 67 HE2 MET 8 1HE MET 8 -12.903 -4.745 -21.726 68 HE3 MET 8 2HE MET 8 -14.617 -4.690 -22.138 69 H SER 9 H SER 9 -19.333 -3.749 -20.415 70 HA SER 9 HA SER 9 -19.859 -1.037 -20.819 71 HB2 SER 9 2HB SER 9 -21.706 -3.423 -21.059 72 HB3 SER 9 1HB SER 9 -22.085 -1.809 -21.660 73 HG SER 9 HG SER 9 -21.215 -2.886 -23.362 74 H ASP 10 H ASP 10 -21.287 0.409 -19.914 75 HA ASP 10 HA ASP 10 -22.497 1.427 -18.281 76 HB2 ASP 10 2HB ASP 10 -23.704 -1.126 -18.678 77 HB3 ASP 10 1HB ASP 10 -23.738 -0.772 -16.953 78 H GLY 11 H GLY 11 -21.056 2.225 -16.855 79 HA2 GLY 11 2HA GLY 11 -20.889 1.542 -14.261 80 HA3 GLY 11 1HA GLY 11 -19.688 0.482 -14.983 81 H HIS 12 H HIS 12 -19.286 2.613 -13.054 82 HA HIS 12 HA HIS 12 -17.947 4.714 -14.554 83 HB2 HIS 12 2HB HIS 12 -19.207 4.590 -12.050 84 HB3 HIS 12 1HB HIS 12 -17.489 4.808 -11.694 85 HD1 HIS 12 1HD HIS 12 -19.586 6.347 -14.475 86 HD2 HIS 12 2HD HIS 12 -17.271 7.464 -11.211 87 HE1 HIS 12 1HE HIS 12 -19.501 8.859 -14.540 88 HE2 HIS 12 2HE HIS 12 -18.134 9.516 -12.528 89 H ASN 13 H ASN 13 -15.735 5.153 -14.442 90 HA ASN 13 HA ASN 13 -14.087 2.861 -13.601 91 HB2 ASN 13 2HB ASN 13 -13.948 4.720 -15.919 92 HB3 ASN 13 1HB ASN 13 -12.423 4.167 -15.238 93 HD21 ASN 13 1HD2 ASN 13 -12.714 1.653 -14.621 94 HD22 ASN 13 2HD2 ASN 13 -13.201 0.692 -15.972 95 H GLY 14 H GLY 14 -11.723 3.587 -13.168 96 HA2 GLY 14 2HA GLY 14 -10.228 4.805 -11.907 97 HA3 GLY 14 1HA GLY 14 -11.296 6.199 -12.106 98 H LEU 15 H LEU 15 -10.353 3.571 -10.061 99 HA LEU 15 HA LEU 15 -12.290 4.456 -8.030 100 HB2 LEU 15 2HB LEU 15 -11.394 1.843 -8.868 101 HB3 LEU 15 1HB LEU 15 -11.093 2.075 -7.156 102 HG LEU 15 HG LEU 15 -13.593 2.897 -7.140 103 HD11 LEU 15 1HD1 LEU 15 -13.414 1.220 -9.630 104 HD12 LEU 15 2HD1 LEU 15 -14.057 2.853 -9.463 105 HD13 LEU 15 3HD1 LEU 15 -14.916 1.490 -8.748 106 HD21 LEU 15 3HD2 LEU 15 -12.467 0.138 -7.100 107 HD22 LEU 15 1HD2 LEU 15 -14.212 0.357 -6.975 108 HD23 LEU 15 2HD2 LEU 15 -13.143 1.099 -5.785 109 H GLY 16 H GLY 16 -8.940 4.303 -8.822 110 HA2 GLY 16 2HA GLY 16 -7.998 4.469 -6.107 111 HA3 GLY 16 1HA GLY 16 -7.019 4.699 -7.553 112 H LYS 17 H LYS 17 -9.657 6.647 -7.921 113 HA LYS 17 HA LYS 17 -10.066 8.869 -7.720 114 HB2 LYS 17 2HB LYS 17 -8.180 8.716 -5.360 115 HB3 LYS 17 1HB LYS 17 -9.226 10.076 -5.745 116 HG2 LYS 17 2HG LYS 17 -10.632 7.523 -5.540 117 HG3 LYS 17 1HG LYS 17 -9.846 8.037 -4.048 118 HD2 LYS 17 2HD LYS 17 -11.284 9.738 -3.737 119 HD3 LYS 17 1HD LYS 17 -11.296 10.166 -5.449 120 HE2 LYS 17 2HE LYS 17 -12.741 8.118 -5.810 121 HE3 LYS 17 1HE LYS 17 -12.896 8.032 -4.056 122 HZ1 LYS 17 3HZ LYS 17 -13.933 10.164 -4.022 123 HZ2 LYS 17 1HZ LYS 17 -14.735 9.225 -5.177 124 HZ3 LYS 17 2HZ LYS 17 -13.635 10.412 -5.667 125 H GLY 18 H GLY 18 -8.589 8.474 -9.754 126 HA2 GLY 18 2HA GLY 18 -7.297 9.858 -11.147 127 HA3 GLY 18 1HA GLY 18 -6.648 10.656 -9.710 128 H PHE 19 H PHE 19 -6.721 7.340 -11.020 129 HA PHE 19 HA PHE 19 -3.799 7.269 -10.897 130 HB2 PHE 19 2HB PHE 19 -5.309 6.179 -8.870 131 HB3 PHE 19 1HB PHE 19 -5.045 4.791 -9.934 132 HD1 PHE 19 1HD PHE 19 -2.409 5.061 -10.940 133 HD2 PHE 19 2HD PHE 19 -3.899 6.082 -7.083 134 HE1 PHE 19 1HE PHE 19 -0.155 4.762 -9.986 135 HE2 PHE 19 2HE PHE 19 -1.651 5.787 -6.129 136 HZ PHE 19 HZ PHE 19 0.221 5.125 -7.578 137 H GLY 20 H GLY 20 -6.394 4.884 -11.377 138 HA2 GLY 20 2HA GLY 20 -5.727 4.668 -14.206 139 HA3 GLY 20 1HA GLY 20 -5.392 3.244 -13.221 140 H ASP 21 H ASP 21 -7.205 2.319 -12.004 141 HA ASP 21 HA ASP 21 -9.889 3.030 -12.692 142 HB2 ASP 21 2HB ASP 21 -8.573 0.670 -14.018 143 HB3 ASP 21 1HB ASP 21 -10.315 0.671 -13.701 144 H HIS 22 H HIS 22 -9.335 -0.353 -12.279 145 HA HIS 22 HA HIS 22 -9.864 -0.108 -9.390 146 HB2 HIS 22 2HB HIS 22 -11.074 -2.344 -9.672 147 HB3 HIS 22 1HB HIS 22 -11.891 -0.921 -10.312 148 HD1 HIS 22 1HD HIS 22 -12.394 -0.881 -12.787 149 HD2 HIS 22 2HD HIS 22 -9.960 -4.062 -11.679 150 HE1 HIS 22 1HE HIS 22 -12.256 -2.360 -14.816 151 HE2 HIS 22 2HE HIS 22 -10.712 -4.236 -14.147 152 H ILE 23 H ILE 23 -7.856 -0.490 -8.581 153 HA ILE 23 HA ILE 23 -6.730 -3.139 -9.042 154 HB ILE 23 HB ILE 23 -5.341 -0.560 -9.713 155 HG12 ILE 23 2HG1 ILE 23 -5.547 -3.179 -11.210 156 HG13 ILE 23 1HG1 ILE 23 -6.576 -1.777 -11.487 157 HG21 ILE 23 1HG2 ILE 23 -3.413 -2.452 -10.075 158 HG22 ILE 23 2HG2 ILE 23 -4.152 -2.952 -8.555 159 HG23 ILE 23 3HG2 ILE 23 -3.507 -1.319 -8.727 160 HD11 ILE 23 3HD1 ILE 23 -5.023 -1.500 -13.131 161 HD12 ILE 23 1HD1 ILE 23 -3.718 -2.196 -12.172 162 HD13 ILE 23 2HD1 ILE 23 -4.284 -0.560 -11.835 163 H HIS 24 H HIS 24 -4.926 -0.419 -7.715 164 HA HIS 24 HA HIS 24 -4.734 -1.841 -5.205 165 HB2 HIS 24 2HB HIS 24 -3.350 0.720 -5.992 166 HB3 HIS 24 1HB HIS 24 -2.941 -0.336 -4.637 167 HD1 HIS 24 1HD HIS 24 -1.195 0.508 -7.283 168 HD2 HIS 24 2HD HIS 24 -2.914 -3.165 -6.382 169 HE1 HIS 24 1HE HIS 24 0.120 -1.189 -8.593 170 HE2 HIS 24 2HE HIS 24 -0.997 -3.393 -8.103 171 H TRP 25 H TRP 25 -7.251 -0.555 -5.926 172 HA TRP 25 HA TRP 25 -7.596 1.028 -3.500 173 HB2 TRP 25 2HB TRP 25 -9.172 2.406 -5.289 174 HB3 TRP 25 1HB TRP 25 -7.587 2.922 -4.701 175 HD1 TRP 25 HD TRP 25 -9.330 1.596 -7.780 176 HE1 TRP 25 1HE TRP 25 -7.679 1.616 -9.727 177 HE3 TRP 25 3HE TRP 25 -5.074 2.676 -5.216 178 HZ2 TRP 25 2HZ TRP 25 -4.919 2.075 -10.164 179 HZ3 TRP 25 3HZ TRP 25 -2.961 2.898 -6.464 180 HH2 TRP 25 HH TRP 25 -2.884 2.600 -8.886 181 H ARG 26 H ARG 26 -8.705 -1.428 -5.546 182 HA ARG 26 HA ARG 26 -11.394 -1.205 -5.729 183 HB2 ARG 26 2HB ARG 26 -10.384 -3.258 -6.453 184 HB3 ARG 26 1HB ARG 26 -9.866 -3.621 -4.821 185 HG2 ARG 26 2HG ARG 26 -11.645 -5.061 -5.275 186 HG3 ARG 26 1HG ARG 26 -12.256 -3.831 -4.171 187 HD2 ARG 26 2HD ARG 26 -13.920 -3.642 -5.622 188 HD3 ARG 26 1HD ARG 26 -12.764 -2.710 -6.586 189 HE ARG 26 HE ARG 26 -12.877 -4.370 -8.138 190 HH11 ARG 26 1HH1 ARG 26 -13.673 -5.752 -5.033 191 HH12 ARG 26 2HH1 ARG 26 -13.982 -7.331 -5.677 192 HH21 ARG 26 1HH2 ARG 26 -13.284 -6.444 -8.984 193 HH22 ARG 26 2HH2 ARG 26 -13.763 -7.724 -7.918 194 H THR 27 H THR 27 -9.622 -1.900 -2.704 195 HA THR 27 HA THR 27 -11.279 -0.564 -1.000 196 HB THR 27 HB THR 27 -12.374 -2.891 -0.048 197 HG1 THR 27 1HG THR 27 -13.171 -3.042 -2.690 198 HG21 THR 27 3HG2 THR 27 -14.272 -1.759 -0.175 199 HG22 THR 27 1HG2 THR 27 -14.170 -1.613 -1.931 200 HG23 THR 27 2HG2 THR 27 -13.325 -0.459 -0.899 201 H LEU 28 H LEU 28 -10.474 -0.567 1.026 202 HA LEU 28 HA LEU 28 -8.086 -2.094 1.507 203 HB2 LEU 28 2HB LEU 28 -8.202 0.231 2.206 204 HB3 LEU 28 1HB LEU 28 -9.591 -0.124 3.234 205 HG LEU 28 HG LEU 28 -6.973 -1.510 3.712 206 HD11 LEU 28 1HD1 LEU 28 -5.971 0.263 4.647 207 HD12 LEU 28 2HD1 LEU 28 -7.476 0.887 5.321 208 HD13 LEU 28 3HD1 LEU 28 -7.064 1.208 3.636 209 HD21 LEU 28 3HD2 LEU 28 -8.085 -2.355 5.436 210 HD22 LEU 28 1HD2 LEU 28 -9.534 -1.490 4.926 211 HD23 LEU 28 2HD2 LEU 28 -8.404 -0.733 6.048 212 H GLU 29 H GLU 29 -11.290 -1.846 3.028 213 HA GLU 29 HA GLU 29 -10.870 -3.826 4.981 214 HB2 GLU 29 2HB GLU 29 -12.836 -2.053 4.537 215 HB3 GLU 29 1HB GLU 29 -13.605 -3.488 3.874 216 HG2 GLU 29 2HG GLU 29 -12.901 -4.590 6.112 217 HG3 GLU 29 1HG GLU 29 -12.753 -2.927 6.677 218 H ASP 30 H ASP 30 -12.459 -4.014 1.799 219 HA ASP 30 HA ASP 30 -13.071 -6.739 1.863 220 HB2 ASP 30 2HB ASP 30 -13.294 -4.637 0.008 221 HB3 ASP 30 1HB ASP 30 -12.358 -5.894 -0.812 222 H GLY 31 H GLY 31 -10.105 -5.054 1.088 223 HA2 GLY 31 2HA GLY 31 -8.721 -7.152 -0.176 224 HA3 GLY 31 1HA GLY 31 -7.974 -5.801 0.683 225 H LYS 32 H LYS 32 -9.066 -6.328 3.247 226 HA LYS 32 HA LYS 32 -7.178 -8.209 4.200 227 HB2 LYS 32 2HB LYS 32 -8.269 -6.186 5.409 228 HB3 LYS 32 1HB LYS 32 -9.560 -7.316 5.796 229 HG2 LYS 32 2HG LYS 32 -7.521 -8.793 6.612 230 HG3 LYS 32 1HG LYS 32 -6.769 -7.206 6.786 231 HD2 LYS 32 2HD LYS 32 -8.544 -6.471 8.239 232 HD3 LYS 32 1HD LYS 32 -9.439 -7.967 7.966 233 HE2 LYS 32 2HE LYS 32 -7.149 -9.012 8.847 234 HE3 LYS 32 1HE LYS 32 -7.060 -7.449 9.659 235 HZ1 LYS 32 3HZ LYS 32 -9.605 -8.842 9.841 236 HZ2 LYS 32 1HZ LYS 32 -8.767 -7.956 11.014 237 HZ3 LYS 32 2HZ LYS 32 -8.317 -9.551 10.675 238 H LYS 33 H LYS 33 -10.663 -8.353 3.649 239 HA LYS 33 HA LYS 33 -11.139 -10.856 4.825 240 HB2 LYS 33 2HB LYS 33 -12.862 -9.162 4.073 241 HB3 LYS 33 1HB LYS 33 -12.598 -9.737 2.432 242 HG2 LYS 33 2HG LYS 33 -13.053 -12.042 3.923 243 HG3 LYS 33 1HG LYS 33 -14.216 -10.855 4.540 244 HD2 LYS 33 2HD LYS 33 -15.473 -11.516 2.796 245 HD3 LYS 33 1HD LYS 33 -14.416 -10.461 1.856 246 HE2 LYS 33 2HE LYS 33 -13.268 -13.097 2.246 247 HE3 LYS 33 1HE LYS 33 -14.839 -13.171 1.452 248 HZ1 LYS 33 3HZ LYS 33 -12.948 -11.177 0.472 249 HZ2 LYS 33 1HZ LYS 33 -14.069 -12.116 -0.379 250 HZ3 LYS 33 2HZ LYS 33 -12.603 -12.796 0.120 251 H GLU 34 H GLU 34 -10.553 -10.025 1.410 252 HA GLU 34 HA GLU 34 -10.482 -12.719 0.524 253 HB2 GLU 34 2HB GLU 34 -10.955 -10.816 -0.973 254 HB3 GLU 34 1HB GLU 34 -9.295 -10.253 -0.767 255 HG2 GLU 34 2HG GLU 34 -8.452 -11.794 -2.174 256 HG3 GLU 34 1HG GLU 34 -9.609 -13.040 -1.676 257 H ALA 35 H ALA 35 -8.022 -10.452 1.609 258 HA ALA 35 HA ALA 35 -5.737 -11.852 0.823 259 HB1 ALA 35 1HB ALA 35 -5.357 -9.678 1.553 260 HB2 ALA 35 2HB ALA 35 -4.701 -10.662 2.862 261 HB3 ALA 35 3HB ALA 35 -6.286 -9.908 3.034 262 H ALA 36 H ALA 36 -7.951 -12.398 3.451 263 HA ALA 36 HA ALA 36 -6.301 -14.016 5.071 264 HB1 ALA 36 1HB ALA 36 -9.270 -13.712 4.799 265 HB2 ALA 36 2HB ALA 36 -8.216 -13.193 6.115 266 HB3 ALA 36 3HB ALA 36 -8.565 -14.907 5.888 267 H ALA 37 H ALA 37 -8.793 -14.903 2.679 268 HA ALA 37 HA ALA 37 -8.353 -17.680 2.821 269 HB1 ALA 37 1HB ALA 37 -10.346 -17.306 1.817 270 HB2 ALA 37 2HB ALA 37 -9.367 -17.427 0.356 271 HB3 ALA 37 3HB ALA 37 -9.789 -15.844 1.006 272 H SER 38 H SER 38 -7.511 -15.527 0.102 273 HA SER 38 HA SER 38 -5.797 -17.336 -1.161 274 HB2 SER 38 2HB SER 38 -6.323 -14.419 -1.353 275 HB3 SER 38 1HB SER 38 -4.793 -14.996 -2.033 276 HG SER 38 HG SER 38 -7.285 -16.199 -2.638 277 H GLY 39 H GLY 39 -5.239 -15.092 1.454 278 HA2 GLY 39 2HA GLY 39 -3.466 -14.940 2.920 279 HA3 GLY 39 1HA GLY 39 -2.779 -16.371 2.145 280 H LEU 40 H LEU 40 -3.514 -13.064 1.019 281 HA LEU 40 HA LEU 40 -0.690 -12.839 0.210 282 HB2 LEU 40 2HB LEU 40 -1.510 -11.407 -1.679 283 HB3 LEU 40 1HB LEU 40 -1.894 -13.112 -1.807 284 HG LEU 40 HG LEU 40 -4.193 -12.584 -0.961 285 HD11 LEU 40 1HD1 LEU 40 -2.986 -9.910 -0.818 286 HD12 LEU 40 2HD1 LEU 40 -4.319 -10.607 0.100 287 HD13 LEU 40 3HD1 LEU 40 -4.600 -9.976 -1.524 288 HD21 LEU 40 3HD2 LEU 40 -3.200 -12.487 -3.480 289 HD22 LEU 40 1HD2 LEU 40 -3.942 -10.893 -3.348 290 HD23 LEU 40 2HD2 LEU 40 -4.910 -12.341 -3.076 291 HA PRO 41 HA PRO 41 -0.602 -9.028 2.430 292 HB2 PRO 41 2HB PRO 41 1.279 -7.646 1.091 293 HB3 PRO 41 1HB PRO 41 1.674 -9.079 2.048 294 HG2 PRO 41 2HG PRO 41 1.289 -8.823 -0.911 295 HG3 PRO 41 1HG PRO 41 2.539 -9.710 -0.021 296 HD2 PRO 41 2HD PRO 41 0.337 -10.905 -1.087 297 HD3 PRO 41 1HD PRO 41 1.165 -11.512 0.360 298 H LEU 42 H LEU 42 -0.864 -6.651 2.209 299 HA LEU 42 HA LEU 42 -2.622 -6.044 -0.061 300 HB2 LEU 42 2HB LEU 42 -3.007 -4.079 1.891 301 HB3 LEU 42 1HB LEU 42 -4.091 -5.376 1.442 302 HG LEU 42 HG LEU 42 -1.955 -5.817 3.502 303 HD11 LEU 42 1HD1 LEU 42 -3.771 -3.836 3.815 304 HD12 LEU 42 2HD1 LEU 42 -3.091 -4.784 5.138 305 HD13 LEU 42 3HD1 LEU 42 -4.661 -5.214 4.461 306 HD21 LEU 42 3HD2 LEU 42 -2.888 -7.852 2.899 307 HD22 LEU 42 1HD2 LEU 42 -4.491 -7.160 2.653 308 HD23 LEU 42 2HD2 LEU 42 -3.867 -7.383 4.288 309 H MET 43 H MET 43 -2.610 -3.914 -0.924 310 HA MET 43 HA MET 43 0.058 -2.682 -0.843 311 HB2 MET 43 2HB MET 43 -0.575 -3.493 -3.043 312 HB3 MET 43 1HB MET 43 -2.107 -2.615 -2.963 313 HG2 MET 43 2HG MET 43 -0.747 -1.327 -4.350 314 HG3 MET 43 1HG MET 43 -0.695 -0.504 -2.791 315 HE1 MET 43 3HE MET 43 2.693 -3.115 -4.516 316 HE2 MET 43 1HE MET 43 1.126 -2.851 -5.280 317 HE3 MET 43 2HE MET 43 1.240 -3.831 -3.818 318 H VAL 44 H VAL 44 -0.128 -1.239 0.820 319 HA VAL 44 HA VAL 44 -2.438 0.497 1.001 320 HB VAL 44 HB VAL 44 0.054 0.631 2.684 321 HG11 VAL 44 1HG1 VAL 44 -1.792 2.470 2.612 322 HG12 VAL 44 2HG1 VAL 44 -1.155 1.920 4.162 323 HG13 VAL 44 3HG1 VAL 44 -2.708 1.317 3.584 324 HG21 VAL 44 3HG2 VAL 44 -1.781 -1.516 2.503 325 HG22 VAL 44 1HG2 VAL 44 -2.081 -0.687 4.030 326 HG23 VAL 44 2HG2 VAL 44 -0.467 -1.290 3.655 327 H ILE 45 H ILE 45 -2.142 1.628 -1.021 328 HA ILE 45 HA ILE 45 0.133 3.458 -1.104 329 HB ILE 45 HB ILE 45 -0.496 3.981 -3.364 330 HG12 ILE 45 2HG1 ILE 45 -2.567 2.112 -3.925 331 HG13 ILE 45 1HG1 ILE 45 -3.087 3.119 -2.568 332 HG21 ILE 45 1HG2 ILE 45 0.694 2.179 -3.870 333 HG22 ILE 45 2HG2 ILE 45 -0.822 1.291 -4.007 334 HG23 ILE 45 3HG2 ILE 45 0.058 1.300 -2.479 335 HD11 ILE 45 3HD1 ILE 45 -3.762 4.032 -4.747 336 HD12 ILE 45 1HD1 ILE 45 -2.066 4.147 -5.206 337 HD13 ILE 45 2HD1 ILE 45 -2.685 5.117 -3.873 338 H ILE 46 H ILE 46 -0.178 5.234 0.162 339 HA ILE 46 HA ILE 46 -2.861 6.428 0.130 340 HB ILE 46 HB ILE 46 -0.701 6.923 2.170 341 HG12 ILE 46 2HG1 ILE 46 -2.997 5.252 2.931 342 HG13 ILE 46 1HG1 ILE 46 -1.909 4.497 1.767 343 HG21 ILE 46 1HG2 ILE 46 -2.301 8.007 3.424 344 HG22 ILE 46 2HG2 ILE 46 -3.633 7.208 2.601 345 HG23 ILE 46 3HG2 ILE 46 -2.739 8.487 1.785 346 HD11 ILE 46 3HD1 ILE 46 -0.106 4.568 3.249 347 HD12 ILE 46 1HD1 ILE 46 -1.480 4.111 4.257 348 HD13 ILE 46 2HD1 ILE 46 -0.885 5.772 4.279 349 H HIS 47 H HIS 47 -3.169 8.315 -0.785 350 HA HIS 47 HA HIS 47 -0.875 10.114 -1.189 351 HB2 HIS 47 2HB HIS 47 -3.115 9.730 -3.184 352 HB3 HIS 47 1HB HIS 47 -1.619 10.650 -3.401 353 HD1 HIS 47 1HD HIS 47 0.005 9.456 -4.810 354 HD2 HIS 47 2HD HIS 47 -2.351 6.817 -2.630 355 HE1 HIS 47 1HE HIS 47 0.772 7.162 -5.485 356 HE2 HIS 47 2HE HIS 47 -0.759 5.587 -4.258 357 H LYS 48 H LYS 48 -1.458 11.410 0.540 358 HA LYS 48 HA LYS 48 -4.177 12.510 0.588 359 HB2 LYS 48 2HB LYS 48 -1.974 12.222 2.513 360 HB3 LYS 48 1HB LYS 48 -2.892 13.712 2.661 361 HG2 LYS 48 2HG LYS 48 -3.809 12.031 4.105 362 HG3 LYS 48 1HG LYS 48 -4.957 12.397 2.816 363 HD2 LYS 48 2HD LYS 48 -4.193 10.402 1.603 364 HD3 LYS 48 1HD LYS 48 -3.095 10.031 2.930 365 HE2 LYS 48 2HE LYS 48 -5.973 10.438 3.549 366 HE3 LYS 48 1HE LYS 48 -5.488 8.931 2.776 367 HZ1 LYS 48 3HZ LYS 48 -3.932 9.807 5.083 368 HZ2 LYS 48 1HZ LYS 48 -4.370 8.245 4.605 369 HZ3 LYS 48 2HZ LYS 48 -5.494 9.237 5.388 370 H SER 49 H SER 49 -4.455 14.848 0.992 371 HA SER 49 HA SER 49 -4.391 16.940 0.055 372 HB2 SER 49 2HB SER 49 -2.723 18.222 1.014 373 HB3 SER 49 1HB SER 49 -2.647 16.771 2.015 374 HG SER 49 HG SER 49 -0.848 17.740 0.135 375 H TRP 50 H TRP 50 -2.290 18.410 -1.075 376 HA TRP 50 HA TRP 50 -2.520 17.867 -3.772 377 HB2 TRP 50 2HB TRP 50 -0.013 19.132 -2.690 378 HB3 TRP 50 1HB TRP 50 -0.911 19.526 -4.162 379 HD1 TRP 50 HD TRP 50 -3.154 21.016 -3.853 380 HE1 TRP 50 1HE TRP 50 -3.834 22.672 -2.005 381 HE3 TRP 50 3HE TRP 50 0.160 19.593 -0.232 382 HZ2 TRP 50 2HZ TRP 50 -3.065 23.293 0.641 383 HZ3 TRP 50 3HZ TRP 50 0.124 20.769 1.929 384 HH2 TRP 50 HH TRP 50 -1.456 22.582 2.354 385 H CYS 51 H CYS 51 -1.979 16.051 -4.773 386 HA CYS 51 HA CYS 51 0.641 14.854 -4.152 387 HB2 CYS 51 2HB CYS 51 -0.882 13.288 -3.328 388 HB3 CYS 51 1HB CYS 51 -2.043 13.592 -4.611 389 H GLY 52 H GLY 52 1.953 14.312 -5.859 390 HA2 GLY 52 2HA GLY 52 0.915 14.962 -8.553 391 HA3 GLY 52 1HA GLY 52 2.589 15.217 -8.059 392 H ALA 53 H ALA 53 3.076 12.787 -6.762 393 HA ALA 53 HA ALA 53 3.923 11.141 -8.805 394 HB1 ALA 53 1HB ALA 53 4.466 11.080 -6.277 395 HB2 ALA 53 2HB ALA 53 4.494 9.573 -7.193 396 HB3 ALA 53 3HB ALA 53 3.104 9.964 -6.183 397 H CYS 54 H CYS 54 0.783 11.445 -7.451 398 HA CYS 54 HA CYS 54 -0.121 9.009 -8.711 399 HB2 CYS 54 2HB CYS 54 -2.341 9.623 -7.718 400 HB3 CYS 54 1HB CYS 54 -1.049 9.452 -6.525 401 H LYS 55 H LYS 55 -0.274 12.480 -9.081 402 HA LYS 55 HA LYS 55 -2.278 12.670 -11.021 403 HB2 LYS 55 2HB LYS 55 0.012 14.353 -10.167 404 HB3 LYS 55 1HB LYS 55 -0.653 14.685 -11.760 405 HG2 LYS 55 2HG LYS 55 -2.936 14.705 -10.511 406 HG3 LYS 55 1HG LYS 55 -1.927 14.970 -9.077 407 HD2 LYS 55 2HD LYS 55 -0.841 16.774 -10.756 408 HD3 LYS 55 1HD LYS 55 -2.498 16.757 -11.363 409 HE2 LYS 55 2HE LYS 55 -2.972 16.881 -8.718 410 HE3 LYS 55 1HE LYS 55 -1.426 17.724 -8.788 411 HZ1 LYS 55 3HZ LYS 55 -3.035 19.373 -9.060 412 HZ2 LYS 55 1HZ LYS 55 -3.963 18.442 -10.126 413 HZ3 LYS 55 2HZ LYS 55 -2.483 19.083 -10.630 414 H ALA 56 H ALA 56 1.260 12.395 -11.420 415 HA ALA 56 HA ALA 56 1.184 12.164 -14.250 416 HB1 ALA 56 1HB ALA 56 3.169 12.510 -12.455 417 HB2 ALA 56 2HB ALA 56 3.433 11.995 -14.120 418 HB3 ALA 56 3HB ALA 56 3.374 10.800 -12.825 419 H LEU 57 H LEU 57 0.517 9.969 -11.691 420 HA LEU 57 HA LEU 57 0.956 7.573 -13.181 421 HB2 LEU 57 2HB LEU 57 -0.024 8.297 -10.507 422 HB3 LEU 57 1HB LEU 57 -0.714 6.828 -11.168 423 HG LEU 57 HG LEU 57 1.289 5.688 -11.113 424 HD11 LEU 57 1HD1 LEU 57 3.508 6.907 -10.876 425 HD12 LEU 57 2HD1 LEU 57 2.622 8.372 -11.302 426 HD13 LEU 57 3HD1 LEU 57 2.694 7.022 -12.436 427 HD21 LEU 57 3HD2 LEU 57 1.521 5.668 -8.913 428 HD22 LEU 57 1HD2 LEU 57 0.645 7.195 -8.823 429 HD23 LEU 57 2HD2 LEU 57 2.403 7.192 -8.955 430 H LYS 58 H LYS 58 -1.601 9.871 -13.112 431 HA LYS 58 HA LYS 58 -3.806 8.230 -13.595 432 HB2 LYS 58 2HB LYS 58 -3.123 11.048 -14.109 433 HB3 LYS 58 1HB LYS 58 -4.341 10.385 -15.189 434 HG2 LYS 58 2HG LYS 58 -5.897 10.566 -13.627 435 HG3 LYS 58 1HG LYS 58 -4.931 9.618 -12.495 436 HD2 LYS 58 2HD LYS 58 -4.243 11.442 -11.380 437 HD3 LYS 58 1HD LYS 58 -3.974 12.360 -12.862 438 HE2 LYS 58 2HE LYS 58 -6.692 11.836 -11.670 439 HE3 LYS 58 1HE LYS 58 -5.746 13.292 -11.363 440 HZ1 LYS 58 3HZ LYS 58 -6.904 14.047 -13.120 441 HZ2 LYS 58 1HZ LYS 58 -7.215 12.505 -13.741 442 HZ3 LYS 58 2HZ LYS 58 -5.718 13.242 -14.019 443 HA PRO 59 HA PRO 59 -2.905 8.243 -18.295 444 HB2 PRO 59 2HB PRO 59 -0.894 9.707 -19.308 445 HB3 PRO 59 1HB PRO 59 -2.472 10.431 -18.934 446 HG2 PRO 59 2HG PRO 59 0.065 10.487 -17.338 447 HG3 PRO 59 1HG PRO 59 -1.072 11.803 -17.677 448 HD2 PRO 59 2HD PRO 59 -1.054 10.386 -15.335 449 HD3 PRO 59 1HD PRO 59 -2.509 11.159 -16.011 450 H LYS 60 H LYS 60 -0.264 8.234 -16.062 451 HA LYS 60 HA LYS 60 1.442 6.543 -17.676 452 HB2 LYS 60 2HB LYS 60 2.706 7.923 -16.296 453 HB3 LYS 60 1HB LYS 60 1.589 7.761 -14.952 454 HG2 LYS 60 2HG LYS 60 3.549 6.610 -14.344 455 HG3 LYS 60 1HG LYS 60 2.341 5.377 -14.719 456 HD2 LYS 60 2HD LYS 60 4.493 4.788 -15.693 457 HD3 LYS 60 1HD LYS 60 3.336 5.163 -16.974 458 HE2 LYS 60 2HE LYS 60 4.583 7.595 -16.304 459 HE3 LYS 60 1HE LYS 60 5.870 6.388 -16.393 460 HZ1 LYS 60 3HZ LYS 60 3.852 6.533 -18.532 461 HZ2 LYS 60 1HZ LYS 60 5.447 5.972 -18.601 462 HZ3 LYS 60 2HZ LYS 60 5.138 7.632 -18.518 463 H PHE 61 H PHE 61 0.140 6.175 -14.399 464 HA PHE 61 HA PHE 61 0.437 3.459 -14.154 465 HB2 PHE 61 2HB PHE 61 -0.290 5.159 -12.390 466 HB3 PHE 61 1HB PHE 61 -1.925 4.917 -13.009 467 HD1 PHE 61 2HD PHE 61 0.948 3.186 -11.451 468 HD2 PHE 61 1HD PHE 61 -3.202 3.048 -12.377 469 HE1 PHE 61 2HE PHE 61 0.698 1.201 -10.018 470 HE2 PHE 61 1HE PHE 61 -3.459 1.061 -10.948 471 HZ PHE 61 HZ PHE 61 -1.507 0.137 -9.764 472 H ALA 62 H ALA 62 -1.781 5.172 -16.175 473 HA ALA 62 HA ALA 62 -3.840 3.334 -16.447 474 HB1 ALA 62 1HB ALA 62 -4.316 4.345 -18.493 475 HB2 ALA 62 2HB ALA 62 -2.615 4.655 -18.843 476 HB3 ALA 62 3HB ALA 62 -3.453 5.610 -17.617 477 H GLU 63 H GLU 63 -0.512 3.156 -17.241 478 HA GLU 63 HA GLU 63 -0.500 1.012 -19.104 479 HB2 GLU 63 2HB GLU 63 1.353 2.769 -18.474 480 HB3 GLU 63 1HB GLU 63 1.768 1.596 -17.219 481 HG2 GLU 63 2HG GLU 63 2.061 -0.120 -18.964 482 HG3 GLU 63 1HG GLU 63 1.723 1.099 -20.194 483 H SER 64 H SER 64 -1.146 1.211 -15.826 484 HA SER 64 HA SER 64 -0.127 -1.116 -14.744 485 HB2 SER 64 2HB SER 64 -2.578 0.509 -14.185 486 HB3 SER 64 1HB SER 64 -2.226 -0.935 -13.252 487 HG SER 64 HG SER 64 -0.378 1.185 -13.593 488 H THR 65 H THR 65 -1.915 -1.076 -17.460 489 HA THR 65 HA THR 65 -4.002 -2.834 -17.210 490 HB THR 65 HB THR 65 -2.189 -3.433 -19.470 491 HG1 THR 65 1HG THR 65 -1.974 -1.465 -20.185 492 HG21 THR 65 3HG2 THR 65 -5.019 -2.421 -19.380 493 HG22 THR 65 1HG2 THR 65 -4.531 -4.113 -19.496 494 HG23 THR 65 2HG2 THR 65 -4.157 -2.995 -20.808 495 H GLU 66 H GLU 66 -0.551 -3.458 -17.205 496 HA GLU 66 HA GLU 66 -0.889 -6.319 -16.970 497 HB2 GLU 66 2HB GLU 66 1.310 -4.536 -17.478 498 HB3 GLU 66 1HB GLU 66 1.710 -5.571 -16.107 499 HG2 GLU 66 2HG GLU 66 0.898 -7.493 -17.616 500 HG3 GLU 66 1HG GLU 66 1.095 -6.335 -18.931 501 H ILE 67 H ILE 67 -0.437 -3.504 -14.935 502 HA ILE 67 HA ILE 67 0.113 -4.941 -12.537 503 HB ILE 67 HB ILE 67 -1.065 -2.194 -12.906 504 HG12 ILE 67 2HG1 ILE 67 1.763 -3.105 -12.341 505 HG13 ILE 67 1HG1 ILE 67 1.177 -2.398 -13.853 506 HG21 ILE 67 1HG2 ILE 67 -0.607 -3.794 -10.523 507 HG22 ILE 67 2HG2 ILE 67 -1.549 -2.320 -10.731 508 HG23 ILE 67 3HG2 ILE 67 0.191 -2.222 -10.462 509 HD11 ILE 67 3HD1 ILE 67 1.713 -0.399 -13.083 510 HD12 ILE 67 1HD1 ILE 67 2.205 -1.098 -11.538 511 HD13 ILE 67 2HD1 ILE 67 0.534 -0.591 -11.787 512 H SER 68 H SER 68 -2.678 -4.594 -14.446 513 HA SER 68 HA SER 68 -4.676 -4.726 -12.434 514 HB2 SER 68 2HB SER 68 -6.205 -5.111 -14.187 515 HB3 SER 68 1HB SER 68 -4.940 -4.142 -14.941 516 HG SER 68 HG SER 68 -5.424 -6.914 -15.172 517 H GLU 69 H GLU 69 -2.722 -7.076 -14.122 518 HA GLU 69 HA GLU 69 -4.079 -9.276 -12.763 519 HB2 GLU 69 2HB GLU 69 -2.259 -10.588 -14.192 520 HB3 GLU 69 1HB GLU 69 -3.786 -10.066 -14.885 521 HG2 GLU 69 2HG GLU 69 -2.672 -8.064 -15.769 522 HG3 GLU 69 1HG GLU 69 -1.140 -8.657 -15.131 523 H LEU 70 H LEU 70 -1.160 -7.432 -12.792 524 HA LEU 70 HA LEU 70 0.455 -9.201 -11.268 525 HB2 LEU 70 2HB LEU 70 0.689 -6.610 -12.439 526 HB3 LEU 70 1HB LEU 70 1.213 -6.508 -10.758 527 HG LEU 70 HG LEU 70 2.757 -8.426 -11.214 528 HD11 LEU 70 1HD1 LEU 70 1.513 -9.302 -13.143 529 HD12 LEU 70 2HD1 LEU 70 3.220 -9.033 -13.502 530 HD13 LEU 70 3HD1 LEU 70 2.004 -7.889 -14.085 531 HD21 LEU 70 3HD2 LEU 70 3.020 -5.828 -12.698 532 HD22 LEU 70 1HD2 LEU 70 4.309 -7.029 -12.680 533 HD23 LEU 70 2HD2 LEU 70 3.760 -6.304 -11.170 534 H SER 71 H SER 71 -2.227 -7.303 -10.495 535 HA SER 71 HA SER 71 -1.538 -6.753 -7.763 536 HB2 SER 71 2HB SER 71 -3.780 -6.185 -9.549 537 HB3 SER 71 1HB SER 71 -4.269 -6.579 -7.900 538 HG SER 71 HG SER 71 -3.756 -4.585 -7.493 539 H HIS 72 H HIS 72 -2.622 -9.489 -9.414 540 HA HIS 72 HA HIS 72 -4.374 -10.687 -7.615 541 HB2 HIS 72 2HB HIS 72 -2.419 -11.825 -9.608 542 HB3 HIS 72 1HB HIS 72 -3.467 -12.862 -8.630 543 HD1 HIS 72 1HD HIS 72 -3.365 -11.530 -11.859 544 HD2 HIS 72 2HD HIS 72 -6.341 -11.741 -8.967 545 HE1 HIS 72 1HE HIS 72 -5.533 -11.262 -13.105 546 HE2 HIS 72 2HE HIS 72 -7.315 -11.316 -11.325 547 H ASN 73 H ASN 73 -1.107 -9.938 -7.244 548 HA ASN 73 HA ASN 73 -0.571 -12.098 -5.381 549 HB2 ASN 73 2HB ASN 73 1.623 -10.680 -5.120 550 HB3 ASN 73 1HB ASN 73 1.369 -11.701 -6.534 551 HD21 ASN 73 1HD2 ASN 73 2.004 -10.754 -8.330 552 HD22 ASN 73 2HD2 ASN 73 1.893 -9.051 -8.677 553 H PHE 74 H PHE 74 -1.898 -8.999 -5.214 554 HA PHE 74 HA PHE 74 -2.000 -9.129 -2.339 555 HB2 PHE 74 2HB PHE 74 -1.276 -6.659 -2.195 556 HB3 PHE 74 1HB PHE 74 -0.015 -7.880 -2.402 557 HD1 PHE 74 1HD PHE 74 -2.264 -5.904 -4.642 558 HD2 PHE 74 2HD PHE 74 1.677 -7.264 -3.787 559 HE1 PHE 74 1HE PHE 74 -1.425 -4.708 -6.621 560 HE2 PHE 74 2HE PHE 74 2.523 -6.071 -5.765 561 HZ PHE 74 HZ PHE 74 0.971 -4.791 -7.185 562 H VAL 75 H VAL 75 -3.137 -6.587 -1.837 563 HA VAL 75 HA VAL 75 -5.221 -6.332 -3.858 564 HB VAL 75 HB VAL 75 -6.086 -8.017 -2.293 565 HG11 VAL 75 1HG1 VAL 75 -6.560 -7.560 -0.034 566 HG12 VAL 75 2HG1 VAL 75 -6.239 -5.838 -0.232 567 HG13 VAL 75 3HG1 VAL 75 -4.910 -6.994 -0.290 568 HG21 VAL 75 3HG2 VAL 75 -7.810 -5.627 -1.833 569 HG22 VAL 75 1HG2 VAL 75 -8.238 -7.227 -2.436 570 HG23 VAL 75 2HG2 VAL 75 -7.445 -6.070 -3.497 571 H MET 76 H MET 76 -6.041 -4.494 -4.155 572 HA MET 76 HA MET 76 -5.119 -2.082 -3.733 573 HB2 MET 76 2HB MET 76 -7.695 -1.518 -3.762 574 HB3 MET 76 1HB MET 76 -6.887 -2.227 -5.146 575 HG2 MET 76 2HG MET 76 -7.880 -4.156 -3.187 576 HG3 MET 76 1HG MET 76 -9.119 -3.211 -3.977 577 HE1 MET 76 3HE MET 76 -9.826 -5.583 -4.279 578 HE2 MET 76 1HE MET 76 -8.742 -6.842 -4.871 579 HE3 MET 76 2HE MET 76 -9.880 -6.068 -5.974 580 H VAL 77 H VAL 77 -4.678 -0.811 -2.099 581 HA VAL 77 HA VAL 77 -6.681 -0.316 -0.077 582 HB VAL 77 HB VAL 77 -3.835 -0.983 0.698 583 HG11 VAL 77 1HG1 VAL 77 -4.277 0.488 2.347 584 HG12 VAL 77 2HG1 VAL 77 -5.207 -0.849 3.026 585 HG13 VAL 77 3HG1 VAL 77 -6.021 0.409 2.094 586 HG21 VAL 77 3HG2 VAL 77 -4.679 -3.066 0.568 587 HG22 VAL 77 1HG2 VAL 77 -6.348 -2.511 0.682 588 HG23 VAL 77 2HG2 VAL 77 -5.365 -2.650 2.139 589 H ASN 78 H ASN 78 -6.544 1.431 -1.836 590 HA ASN 78 HA ASN 78 -4.430 3.352 -1.298 591 HB2 ASN 78 2HB ASN 78 -4.778 3.073 -3.594 592 HB3 ASN 78 1HB ASN 78 -6.514 3.103 -3.428 593 HD21 ASN 78 1HD2 ASN 78 -3.974 5.262 -2.275 594 HD22 ASN 78 2HD2 ASN 78 -4.608 6.696 -3.018 595 H LEU 79 H LEU 79 -4.763 4.515 0.444 596 HA LEU 79 HA LEU 79 -7.449 5.616 0.930 597 HB2 LEU 79 2HB LEU 79 -7.018 4.815 2.977 598 HB3 LEU 79 1HB LEU 79 -5.308 4.644 2.647 599 HG LEU 79 HG LEU 79 -5.097 7.128 3.115 600 HD11 LEU 79 1HD1 LEU 79 -7.819 6.745 4.347 601 HD12 LEU 79 2HD1 LEU 79 -7.511 7.636 2.856 602 HD13 LEU 79 3HD1 LEU 79 -6.831 8.208 4.380 603 HD21 LEU 79 3HD2 LEU 79 -4.211 5.955 4.833 604 HD22 LEU 79 1HD2 LEU 79 -5.658 4.967 5.048 605 HD23 LEU 79 2HD2 LEU 79 -5.611 6.612 5.684 606 H GLU 80 H GLU 80 -7.838 7.740 0.700 607 HA GLU 80 HA GLU 80 -5.840 9.752 1.018 608 HB2 GLU 80 2HB GLU 80 -6.073 10.596 -1.382 609 HB3 GLU 80 1HB GLU 80 -5.047 9.179 -1.126 610 HG2 GLU 80 2HG GLU 80 -6.788 7.718 -1.917 611 HG3 GLU 80 1HG GLU 80 -7.917 9.077 -2.047 612 H ASP 81 H ASP 81 -7.667 10.167 2.492 613 HA ASP 81 HA ASP 81 -9.613 11.918 1.179 614 HB2 ASP 81 2HB ASP 81 -11.271 10.996 3.018 615 HB3 ASP 81 1HB ASP 81 -11.072 10.172 1.475 616 H GLU 82 H GLU 82 -10.007 11.144 4.541 617 HA GLU 82 HA GLU 82 -9.841 13.807 5.378 618 HB2 GLU 82 2HB GLU 82 -9.835 12.861 7.679 619 HB3 GLU 82 1HB GLU 82 -11.102 12.204 6.653 620 HG2 GLU 82 2HG GLU 82 -9.687 10.218 6.248 621 HG3 GLU 82 1HG GLU 82 -8.505 10.871 7.378 622 H GLU 83 H GLU 83 -7.426 11.284 5.220 623 HA GLU 83 HA GLU 83 -5.144 11.491 5.155 624 HB2 GLU 83 2HB GLU 83 -5.308 14.261 6.307 625 HB3 GLU 83 1HB GLU 83 -4.015 13.552 5.354 626 HG2 GLU 83 2HG GLU 83 -4.919 14.255 3.459 627 HG3 GLU 83 1HG GLU 83 -6.491 13.568 3.878 628 H GLU 84 H GLU 84 -7.095 12.117 7.906 629 HA GLU 84 HA GLU 84 -4.839 11.438 9.666 630 HB2 GLU 84 2HB GLU 84 -6.990 13.364 9.901 631 HB3 GLU 84 1HB GLU 84 -6.970 12.268 11.277 632 HG2 GLU 84 2HG GLU 84 -4.826 12.914 11.917 633 HG3 GLU 84 1HG GLU 84 -4.470 13.623 10.342 634 HA PRO 85 HA PRO 85 -7.501 7.705 9.843 635 HB2 PRO 85 2HB PRO 85 -5.585 5.874 9.513 636 HB3 PRO 85 1HB PRO 85 -6.223 6.793 8.132 637 HG2 PRO 85 2HG PRO 85 -3.684 7.193 9.673 638 HG3 PRO 85 1HG PRO 85 -3.961 7.280 7.918 639 HD2 PRO 85 2HD PRO 85 -3.833 9.471 9.604 640 HD3 PRO 85 1HD PRO 85 -4.652 9.454 8.024 641 H LYS 86 H LYS 86 -5.407 9.209 11.862 642 HA LYS 86 HA LYS 86 -4.986 9.026 14.088 643 HB2 LYS 86 2HB LYS 86 -7.380 7.774 13.831 644 HB3 LYS 86 1HB LYS 86 -6.393 6.452 14.466 645 HG2 LYS 86 2HG LYS 86 -7.462 7.585 16.288 646 HG3 LYS 86 1HG LYS 86 -5.729 7.915 16.349 647 HD2 LYS 86 2HD LYS 86 -6.566 9.994 14.846 648 HD3 LYS 86 1HD LYS 86 -7.994 9.736 15.850 649 HE2 LYS 86 2HE LYS 86 -6.809 10.121 17.833 650 HE3 LYS 86 1HE LYS 86 -5.247 9.896 17.045 651 HZ1 LYS 86 3HZ LYS 86 -5.464 11.965 15.941 652 HZ2 LYS 86 1HZ LYS 86 -5.840 12.245 17.568 653 HZ3 LYS 86 2HZ LYS 86 -7.077 12.143 16.419 654 H ASP 87 H ASP 87 -3.013 8.221 12.497 655 HA ASP 87 HA ASP 87 -1.512 6.475 14.112 656 HB2 ASP 87 2HB ASP 87 -3.212 5.096 12.380 657 HB3 ASP 87 1HB ASP 87 -1.632 5.050 11.580 658 H GLU 88 H GLU 88 0.595 5.842 13.000 659 HA GLU 88 HA GLU 88 1.470 8.109 11.350 660 HB2 GLU 88 2HB GLU 88 2.694 6.550 13.513 661 HB3 GLU 88 1HB GLU 88 3.765 6.848 12.151 662 HG2 GLU 88 2HG GLU 88 4.135 8.618 13.612 663 HG3 GLU 88 1HG GLU 88 3.100 9.286 12.355 664 H ASP 89 H ASP 89 0.821 4.781 11.194 665 HA ASP 89 HA ASP 89 2.675 3.670 9.544 666 HB2 ASP 89 2HB ASP 89 0.556 2.613 10.478 667 HB3 ASP 89 1HB ASP 89 -0.282 3.293 9.072 668 H PHE 90 H PHE 90 0.401 6.170 8.688 669 HA PHE 90 HA PHE 90 0.524 5.840 5.876 670 HB2 PHE 90 2HB PHE 90 -0.582 7.941 5.719 671 HB3 PHE 90 1HB PHE 90 -1.214 7.153 7.171 672 HD1 PHE 90 1HD PHE 90 1.161 9.725 5.968 673 HD2 PHE 90 2HD PHE 90 -1.028 8.178 9.273 674 HE1 PHE 90 1HE PHE 90 1.764 11.708 7.290 675 HE2 PHE 90 2HE PHE 90 -0.431 10.160 10.601 676 HZ PHE 90 HZ PHE 90 0.967 11.929 9.611 677 H SER 91 H SER 91 2.694 7.219 8.166 678 HA SER 91 HA SER 91 4.649 7.712 6.109 679 HB2 SER 91 2HB SER 91 3.470 9.985 7.716 680 HB3 SER 91 1HB SER 91 5.064 10.084 6.952 681 HG SER 91 HG SER 91 2.890 10.717 5.809 682 HA PRO 92 HA PRO 92 6.392 6.590 10.242 683 HB2 PRO 92 2HB PRO 92 6.933 4.005 9.868 684 HB3 PRO 92 1HB PRO 92 5.284 4.554 10.231 685 HG2 PRO 92 2HG PRO 92 6.462 3.658 7.650 686 HG3 PRO 92 1HG PRO 92 4.809 3.474 8.258 687 HD2 PRO 92 2HD PRO 92 5.748 5.442 6.452 688 HD3 PRO 92 1HD PRO 92 4.160 5.389 7.237 689 H ASP 93 H ASP 93 7.992 8.103 9.029 690 HA ASP 93 HA ASP 93 10.556 7.069 9.228 691 HB2 ASP 93 2HB ASP 93 11.276 7.071 6.835 692 HB3 ASP 93 1HB ASP 93 10.155 5.763 7.237 693 H GLY 94 H GLY 94 8.678 9.334 7.222 694 HA2 GLY 94 2HA GLY 94 10.560 11.454 8.073 695 HA3 GLY 94 1HA GLY 94 9.855 11.395 6.453 696 H GLY 95 H GLY 95 8.421 12.979 6.239 697 HA2 GLY 95 2HA GLY 95 6.321 13.213 8.271 698 HA3 GLY 95 1HA GLY 95 7.260 14.658 7.890 699 H TYR 96 H TYR 96 6.821 12.601 5.207 700 HA TYR 96 HA TYR 96 5.430 14.500 3.717 701 HB2 TYR 96 2HB TYR 96 4.918 12.585 2.145 702 HB3 TYR 96 1HB TYR 96 6.627 12.818 2.537 703 HD1 TYR 96 2HD TYR 96 7.757 11.241 4.091 704 HD2 TYR 96 1HD TYR 96 3.792 10.566 2.704 705 HE1 TYR 96 2HE TYR 96 7.922 8.888 4.775 706 HE2 TYR 96 1HE TYR 96 3.953 8.197 3.361 707 HH TYR 96 HH TYR 96 5.168 6.684 4.499 708 H ILE 97 H ILE 97 3.216 13.927 2.614 709 HA ILE 97 HA ILE 97 1.360 12.806 4.562 710 HB ILE 97 HB ILE 97 -0.146 14.799 4.254 711 HG12 ILE 97 2HG1 ILE 97 2.218 16.457 3.639 712 HG13 ILE 97 1HG1 ILE 97 1.612 15.480 2.300 713 HG21 ILE 97 1HG2 ILE 97 2.490 15.041 5.688 714 HG22 ILE 97 2HG2 ILE 97 0.935 14.533 6.349 715 HG23 ILE 97 3HG2 ILE 97 1.185 16.214 5.874 716 HD11 ILE 97 3HD1 ILE 97 0.248 17.690 3.782 717 HD12 ILE 97 1HD1 ILE 97 -0.676 16.490 2.878 718 HD13 ILE 97 2HD1 ILE 97 0.510 17.495 2.047 719 HA PRO 98 HA PRO 98 1.475 10.399 3.628 720 HB2 PRO 98 2HB PRO 98 -1.243 9.507 2.596 721 HB3 PRO 98 1HB PRO 98 -0.276 8.772 3.904 722 HG2 PRO 98 2HG PRO 98 -1.998 11.035 4.047 723 HG3 PRO 98 1HG PRO 98 -0.988 10.326 5.337 724 HD2 PRO 98 2HD PRO 98 -0.357 12.680 4.488 725 HD3 PRO 98 1HD PRO 98 0.938 11.468 4.614 726 H ARG 99 H ARG 99 2.110 8.297 2.657 727 HA ARG 99 HA ARG 99 2.044 8.359 -0.277 728 HB2 ARG 99 2HB ARG 99 4.328 8.366 1.548 729 HB3 ARG 99 1HB ARG 99 4.441 7.159 0.272 730 HG2 ARG 99 2HG ARG 99 5.497 9.323 -0.258 731 HG3 ARG 99 1HG ARG 99 4.260 8.833 -1.411 732 HD2 ARG 99 2HD ARG 99 3.267 10.481 0.791 733 HD3 ARG 99 1HD ARG 99 4.457 11.289 -0.225 734 HE ARG 99 HE ARG 99 2.335 9.950 -1.659 735 HH11 ARG 99 1HH1 ARG 99 3.426 12.935 -0.213 736 HH12 ARG 99 2HH1 ARG 99 2.385 13.927 -1.176 737 HH21 ARG 99 1HH2 ARG 99 0.964 11.255 -2.923 738 HH22 ARG 99 2HH2 ARG 99 0.987 12.975 -2.713 739 H ILE 100 H ILE 100 3.434 6.102 -0.811 740 HA ILE 100 HA ILE 100 1.506 4.049 -0.102 741 HB ILE 100 HB ILE 100 3.803 3.912 -2.050 742 HG12 ILE 100 2HG1 ILE 100 1.473 3.960 -3.516 743 HG13 ILE 100 1HG1 ILE 100 1.137 5.112 -2.227 744 HG21 ILE 100 1HG2 ILE 100 1.486 2.085 -1.496 745 HG22 ILE 100 2HG2 ILE 100 3.209 1.710 -1.478 746 HG23 ILE 100 3HG2 ILE 100 2.395 2.036 -3.006 747 HD11 ILE 100 3HD1 ILE 100 2.057 6.248 -4.139 748 HD12 ILE 100 1HD1 ILE 100 3.463 5.184 -4.133 749 HD13 ILE 100 2HD1 ILE 100 3.205 6.311 -2.802 750 H LEU 101 H LEU 101 2.055 1.967 0.633 751 HA LEU 101 HA LEU 101 4.709 1.305 1.466 752 HB2 LEU 101 2HB LEU 101 3.522 0.999 3.917 753 HB3 LEU 101 1HB LEU 101 4.649 2.258 3.485 754 HG LEU 101 HG LEU 101 1.851 2.892 2.840 755 HD11 LEU 101 1HD1 LEU 101 2.726 2.608 5.703 756 HD12 LEU 101 2HD1 LEU 101 1.521 1.612 4.888 757 HD13 LEU 101 3HD1 LEU 101 1.217 3.330 5.147 758 HD21 LEU 101 3HD2 LEU 101 3.608 4.558 2.661 759 HD22 LEU 101 1HD2 LEU 101 4.034 4.321 4.353 760 HD23 LEU 101 2HD2 LEU 101 2.471 5.014 3.924 761 H PHE 102 H PHE 102 4.962 -0.857 1.722 762 HA PHE 102 HA PHE 102 2.652 -2.525 1.163 763 HB2 PHE 102 2HB PHE 102 5.518 -2.736 0.829 764 HB3 PHE 102 1HB PHE 102 4.884 -4.167 1.637 765 HD1 PHE 102 2HD PHE 102 2.817 -5.279 0.539 766 HD2 PHE 102 1HD PHE 102 5.431 -2.589 -1.470 767 HE1 PHE 102 2HE PHE 102 2.071 -6.176 -1.627 768 HE2 PHE 102 1HE PHE 102 4.690 -3.480 -3.639 769 HZ PHE 102 HZ PHE 102 3.008 -5.276 -3.719 770 H LEU 103 H LEU 103 1.774 -4.062 2.566 771 HA LEU 103 HA LEU 103 2.953 -4.206 5.243 772 HB2 LEU 103 2HB LEU 103 1.027 -3.587 6.376 773 HB3 LEU 103 1HB LEU 103 1.156 -2.427 5.077 774 HG LEU 103 HG LEU 103 -0.730 -4.759 5.241 775 HD11 LEU 103 1HD1 LEU 103 -1.546 -3.024 6.582 776 HD12 LEU 103 2HD1 LEU 103 -2.392 -2.843 5.045 777 HD13 LEU 103 3HD1 LEU 103 -1.039 -1.784 5.441 778 HD21 LEU 103 3HD2 LEU 103 0.122 -3.046 2.972 779 HD22 LEU 103 1HD2 LEU 103 -1.594 -3.433 3.107 780 HD23 LEU 103 2HD2 LEU 103 -0.404 -4.730 2.985 781 H ASP 104 H ASP 104 2.245 -5.945 6.549 782 HA ASP 104 HA ASP 104 2.024 -8.379 5.146 783 HB2 ASP 104 2HB ASP 104 1.893 -7.613 8.046 784 HB3 ASP 104 1HB ASP 104 1.532 -9.270 7.543 785 HA PRO 105 HA PRO 105 -2.272 -8.994 4.419 786 HB2 PRO 105 2HB PRO 105 -1.863 -11.741 5.485 787 HB3 PRO 105 1HB PRO 105 -2.514 -11.219 3.920 788 HG2 PRO 105 2HG PRO 105 -0.050 -12.239 4.129 789 HG3 PRO 105 1HG PRO 105 -0.414 -10.914 3.000 790 HD2 PRO 105 2HD PRO 105 0.990 -10.838 5.631 791 HD3 PRO 105 1HD PRO 105 1.287 -9.889 4.160 792 H SER 106 H SER 106 -3.070 -7.664 6.082 793 HA SER 106 HA SER 106 -4.899 -8.619 7.811 794 HB2 SER 106 2HB SER 106 -2.178 -8.889 8.978 795 HB3 SER 106 1HB SER 106 -3.426 -8.219 10.041 796 HG SER 106 HG SER 106 -4.704 -10.119 9.315 797 H GLY 107 H GLY 107 -2.349 -6.314 7.297 798 HA2 GLY 107 2HA GLY 107 -3.077 -3.995 6.968 799 HA3 GLY 107 1HA GLY 107 -4.111 -4.207 8.382 800 H LYS 108 H LYS 108 -0.738 -5.268 7.999 801 HA LYS 108 HA LYS 108 -0.006 -3.284 10.065 802 HB2 LYS 108 2HB LYS 108 -0.083 -6.086 10.367 803 HB3 LYS 108 1HB LYS 108 1.618 -5.647 10.289 804 HG2 LYS 108 2HG LYS 108 0.554 -3.756 11.988 805 HG3 LYS 108 1HG LYS 108 -0.321 -5.238 12.410 806 HD2 LYS 108 2HD LYS 108 2.005 -6.345 12.428 807 HD3 LYS 108 1HD LYS 108 2.631 -4.696 12.496 808 HE2 LYS 108 2HE LYS 108 2.459 -5.542 14.735 809 HE3 LYS 108 1HE LYS 108 1.226 -4.304 14.505 810 HZ1 LYS 108 3HZ LYS 108 0.735 -6.702 15.549 811 HZ2 LYS 108 1HZ LYS 108 0.400 -7.025 13.922 812 HZ3 LYS 108 2HZ LYS 108 -0.428 -5.790 14.727 813 H VAL 109 H VAL 109 0.897 -1.923 8.438 814 HA VAL 109 HA VAL 109 2.795 -2.711 6.537 815 HB VAL 109 HB VAL 109 2.524 -0.048 7.917 816 HG11 VAL 109 1HG1 VAL 109 4.620 -0.334 6.713 817 HG12 VAL 109 2HG1 VAL 109 3.579 0.858 5.934 818 HG13 VAL 109 3HG1 VAL 109 3.720 -0.764 5.259 819 HG21 VAL 109 3HG2 VAL 109 1.388 -0.474 5.224 820 HG22 VAL 109 1HG2 VAL 109 0.780 0.492 6.567 821 HG23 VAL 109 2HG2 VAL 109 0.539 -1.253 6.558 822 H HIS 110 H HIS 110 4.958 -2.610 6.458 823 HA HIS 110 HA HIS 110 6.412 -2.192 8.965 824 HB2 HIS 110 2HB HIS 110 6.068 -4.721 7.593 825 HB3 HIS 110 1HB HIS 110 7.769 -4.267 7.633 826 HD1 HIS 110 1HD HIS 110 8.963 -4.365 9.881 827 HD2 HIS 110 2HD HIS 110 4.896 -5.178 10.138 828 HE1 HIS 110 1HE HIS 110 8.600 -5.249 12.206 829 HE2 HIS 110 2HE HIS 110 6.114 -5.622 12.376 830 HA PRO 111 HA PRO 111 8.816 0.265 6.151 831 HB2 PRO 111 2HB PRO 111 11.000 0.660 7.729 832 HB3 PRO 111 1HB PRO 111 9.471 1.517 7.963 833 HG2 PRO 111 2HG PRO 111 10.535 -0.882 9.396 834 HG3 PRO 111 1HG PRO 111 9.717 0.542 10.060 835 HD2 PRO 111 2HD PRO 111 8.447 -1.812 9.664 836 HD3 PRO 111 1HD PRO 111 7.624 -0.245 9.481 837 H GLU 112 H GLU 112 8.881 -2.576 5.778 838 HA GLU 112 HA GLU 112 11.744 -3.068 5.288 839 HB2 GLU 112 2HB GLU 112 10.335 -4.698 6.681 840 HB3 GLU 112 1HB GLU 112 9.562 -5.140 5.165 841 HG2 GLU 112 2HG GLU 112 12.505 -5.176 5.164 842 HG3 GLU 112 1HG GLU 112 11.714 -6.385 6.173 843 H ILE 113 H ILE 113 8.555 -3.069 3.798 844 HA ILE 113 HA ILE 113 9.817 -3.445 1.169 845 HB ILE 113 HB ILE 113 6.898 -3.726 1.882 846 HG12 ILE 113 2HG1 ILE 113 8.511 -6.077 1.069 847 HG13 ILE 113 1HG1 ILE 113 8.837 -5.429 2.684 848 HG21 ILE 113 1HG2 ILE 113 8.388 -4.481 -0.629 849 HG22 ILE 113 2HG2 ILE 113 7.316 -3.092 -0.451 850 HG23 ILE 113 3HG2 ILE 113 6.670 -4.729 -0.324 851 HD11 ILE 113 3HD1 ILE 113 7.183 -6.807 3.291 852 HD12 ILE 113 1HD1 ILE 113 6.513 -6.893 1.663 853 HD13 ILE 113 2HD1 ILE 113 6.134 -5.518 2.700 854 H ILE 114 H ILE 114 10.504 -1.280 1.005 855 HA ILE 114 HA ILE 114 8.335 0.665 0.547 856 HB ILE 114 HB ILE 114 9.936 2.438 1.081 857 HG12 ILE 114 2HG1 ILE 114 11.912 0.785 0.460 858 HG13 ILE 114 1HG1 ILE 114 12.154 2.105 1.593 859 HG21 ILE 114 1HG2 ILE 114 9.318 0.329 3.092 860 HG22 ILE 114 2HG2 ILE 114 8.671 1.961 2.934 861 HG23 ILE 114 3HG2 ILE 114 10.300 1.717 3.562 862 HD11 ILE 114 3HD1 ILE 114 11.282 -0.453 2.762 863 HD12 ILE 114 1HD1 ILE 114 12.468 0.717 3.337 864 HD13 ILE 114 2HD1 ILE 114 12.900 -0.421 2.063 865 H ASN 115 H ASN 115 9.613 2.621 -0.763 866 HA ASN 115 HA ASN 115 10.043 1.477 -3.367 867 HB2 ASN 115 2HB ASN 115 8.786 3.570 -3.114 868 HB3 ASN 115 1HB ASN 115 10.210 4.343 -2.405 869 HD21 ASN 115 1HD2 ASN 115 9.835 5.893 -4.136 870 HD22 ASN 115 2HD2 ASN 115 10.522 5.572 -5.706 871 H GLU 116 H GLU 116 11.975 0.242 -2.742 872 HA GLU 116 HA GLU 116 14.353 1.320 -1.823 873 HB2 GLU 116 2HB GLU 116 13.640 -1.054 -3.480 874 HB3 GLU 116 1HB GLU 116 15.344 -0.594 -3.380 875 HG2 GLU 116 2HG GLU 116 13.610 -1.027 -0.964 876 HG3 GLU 116 1HG GLU 116 14.555 -2.309 -1.719 877 H ASN 117 H ASN 117 12.858 1.647 -4.921 878 HA ASN 117 HA ASN 117 15.277 2.551 -6.233 879 HB2 ASN 117 2HB ASN 117 13.083 1.334 -7.203 880 HB3 ASN 117 1HB ASN 117 12.625 3.021 -7.485 881 HD21 ASN 117 1HD2 ASN 117 13.857 4.281 -8.891 882 HD22 ASN 117 2HD2 ASN 117 14.932 3.559 -10.059 883 H GLY 118 H GLY 118 13.175 3.938 -4.070 884 HA2 GLY 118 2HA GLY 118 12.927 6.538 -5.292 885 HA3 GLY 118 1HA GLY 118 12.501 6.109 -3.631 886 H ASN 119 H ASN 119 13.464 8.171 -3.063 887 HA ASN 119 HA ASN 119 16.385 8.256 -3.230 888 HB2 ASN 119 2HB ASN 119 16.207 10.590 -2.569 889 HB3 ASN 119 1HB ASN 119 15.109 10.270 -3.919 890 HD21 ASN 119 1HD2 ASN 119 13.076 10.874 -3.716 891 HD22 ASN 119 2HD2 ASN 119 12.296 11.329 -2.225 892 HA PRO 120 HA PRO 120 16.913 7.208 1.026 893 HB2 PRO 120 2HB PRO 120 19.178 9.006 1.318 894 HB3 PRO 120 1HB PRO 120 19.169 7.241 1.168 895 HG2 PRO 120 2HG PRO 120 20.137 8.905 -0.762 896 HG3 PRO 120 1HG PRO 120 19.439 7.305 -1.106 897 HD2 PRO 120 2HD PRO 120 18.185 10.022 -1.355 898 HD3 PRO 120 1HD PRO 120 18.086 8.622 -2.455 899 H SER 121 H SER 121 14.899 9.029 0.926 900 HA SER 121 HA SER 121 14.905 10.195 3.452 901 HB2 SER 121 2HB SER 121 15.813 11.986 1.227 902 HB3 SER 121 1HB SER 121 14.766 12.658 2.487 903 HG SER 121 HG SER 121 17.362 12.292 2.602 904 H TYR 122 H TYR 122 13.220 8.639 1.843 905 HA TYR 122 HA TYR 122 10.749 9.930 2.219 906 HB2 TYR 122 2HB TYR 122 12.074 10.525 -0.237 907 HB3 TYR 122 1HB TYR 122 10.646 9.551 -0.594 908 HD1 TYR 122 2HD TYR 122 8.430 10.359 0.540 909 HD2 TYR 122 1HD TYR 122 11.870 12.804 0.024 910 HE1 TYR 122 2HE TYR 122 7.026 12.365 0.740 911 HE2 TYR 122 1HE TYR 122 10.479 14.819 0.232 912 HH TYR 122 HH TYR 122 8.184 15.507 -0.009 913 H LYS 123 H LYS 123 12.343 7.589 0.080 914 HA LYS 123 HA LYS 123 11.774 5.467 -0.558 915 HB2 LYS 123 2HB LYS 123 11.292 5.545 2.397 916 HB3 LYS 123 1HB LYS 123 10.924 4.079 1.502 917 HG2 LYS 123 2HG LYS 123 13.601 5.450 1.692 918 HG3 LYS 123 1HG LYS 123 13.125 3.927 2.464 919 HD2 LYS 123 2HD LYS 123 13.661 2.774 0.637 920 HD3 LYS 123 1HD LYS 123 12.638 3.801 -0.373 921 HE2 LYS 123 2HE LYS 123 15.236 4.914 0.511 922 HE3 LYS 123 1HE LYS 123 15.284 3.623 -0.688 923 HZ1 LYS 123 3HZ LYS 123 13.691 6.114 -0.959 924 HZ2 LYS 123 1HZ LYS 123 13.886 4.907 -2.129 925 HZ3 LYS 123 2HZ LYS 123 15.204 5.861 -1.670 926 H TYR 124 H TYR 124 9.235 5.573 1.859 927 HA TYR 124 HA TYR 124 7.192 4.376 0.646 928 HB2 TYR 124 2HB TYR 124 7.024 6.902 2.295 929 HB3 TYR 124 1HB TYR 124 5.655 5.832 1.944 930 HD1 TYR 124 2HD TYR 124 5.510 3.643 2.954 931 HD2 TYR 124 1HD TYR 124 8.765 6.215 3.844 932 HE1 TYR 124 2HE TYR 124 6.090 2.224 4.879 933 HE2 TYR 124 1HE TYR 124 9.363 4.808 5.770 934 HH TYR 124 HH TYR 124 8.370 3.196 7.252 935 H PHE 125 H PHE 125 8.287 7.627 -0.143 936 HA PHE 125 HA PHE 125 6.047 8.231 -1.832 937 HB2 PHE 125 2HB PHE 125 7.152 10.105 -0.872 938 HB3 PHE 125 1HB PHE 125 8.736 9.537 -1.411 939 HD1 PHE 125 2HD PHE 125 5.453 10.714 -2.714 940 HD2 PHE 125 1HD PHE 125 9.644 10.369 -3.366 941 HE1 PHE 125 2HE PHE 125 5.249 12.101 -4.736 942 HE2 PHE 125 1HE PHE 125 9.448 11.756 -5.389 943 HZ PHE 125 HZ PHE 125 7.248 12.623 -6.077 944 H TYR 126 H TYR 126 5.721 7.618 -3.851 945 HA TYR 126 HA TYR 126 7.966 6.418 -5.320 946 HB2 TYR 126 2HB TYR 126 4.984 5.970 -5.477 947 HB3 TYR 126 1HB TYR 126 6.100 5.379 -6.715 948 HD1 TYR 126 2HD TYR 126 5.283 5.161 -3.099 949 HD2 TYR 126 1HD TYR 126 7.297 3.372 -6.390 950 HE1 TYR 126 2HE TYR 126 5.706 3.153 -1.743 951 HE2 TYR 126 1HE TYR 126 7.722 1.359 -5.047 952 HH TYR 126 HH TYR 126 6.476 0.272 -2.914 953 H VAL 127 H VAL 127 7.341 6.512 -7.840 954 HA VAL 127 HA VAL 127 6.196 8.946 -8.766 955 HB VAL 127 HB VAL 127 8.413 9.716 -9.831 956 HG11 VAL 127 1HG1 VAL 127 8.394 10.154 -6.879 957 HG12 VAL 127 2HG1 VAL 127 7.049 10.728 -7.862 958 HG13 VAL 127 3HG1 VAL 127 8.684 11.306 -8.182 959 HG21 VAL 127 3HG2 VAL 127 9.436 7.494 -8.662 960 HG22 VAL 127 1HG2 VAL 127 9.843 8.723 -7.464 961 HG23 VAL 127 2HG2 VAL 127 10.391 8.901 -9.130 962 H SER 128 H SER 128 5.118 7.859 -10.304 963 HA SER 128 HA SER 128 4.856 7.130 -12.482 964 HB2 SER 128 2HB SER 128 7.365 7.866 -12.758 965 HB3 SER 128 1HB SER 128 7.673 6.123 -12.667 966 HG SER 128 HG SER 128 7.009 5.979 -14.643 967 H ALA 129 H ALA 129 4.195 5.179 -13.282 968 HA ALA 129 HA ALA 129 3.886 3.050 -11.470 969 HB1 ALA 129 1HB ALA 129 3.552 2.713 -14.422 970 HB2 ALA 129 2HB ALA 129 2.442 3.725 -13.498 971 HB3 ALA 129 3HB ALA 129 2.612 2.014 -13.105 972 H GLU 130 H GLU 130 6.203 3.667 -14.016 973 HA GLU 130 HA GLU 130 7.254 1.219 -14.576 974 HB2 GLU 130 2HB GLU 130 7.965 3.727 -15.195 975 HB3 GLU 130 1HB GLU 130 9.239 3.359 -14.026 976 HG2 GLU 130 2HG GLU 130 9.302 1.133 -15.563 977 HG3 GLU 130 1HG GLU 130 8.809 2.351 -16.751 978 H GLN 131 H GLN 131 8.380 3.289 -11.887 979 HA GLN 131 HA GLN 131 10.031 1.206 -10.862 980 HB2 GLN 131 2HB GLN 131 10.094 2.693 -8.801 981 HB3 GLN 131 1HB GLN 131 10.851 3.276 -10.276 982 HG2 GLN 131 2HG GLN 131 9.721 5.159 -9.855 983 HG3 GLN 131 1HG GLN 131 8.344 4.294 -10.528 984 HE21 GLN 131 1HE2 GLN 131 10.041 4.888 -7.487 985 HE22 GLN 131 2HE2 GLN 131 8.631 4.862 -6.491 986 H VAL 132 H VAL 132 7.088 2.740 -9.517 987 HA VAL 132 HA VAL 132 6.799 1.064 -7.345 988 HB VAL 132 HB VAL 132 5.337 2.834 -7.272 989 HG11 VAL 132 1HG1 VAL 132 4.863 3.911 -9.142 990 HG12 VAL 132 2HG1 VAL 132 3.586 2.733 -9.439 991 HG13 VAL 132 3HG1 VAL 132 5.194 2.480 -10.118 992 HG21 VAL 132 3HG2 VAL 132 3.327 0.871 -8.282 993 HG22 VAL 132 1HG2 VAL 132 3.246 1.944 -6.885 994 HG23 VAL 132 2HG2 VAL 132 4.266 0.506 -6.835 995 H VAL 133 H VAL 133 6.319 0.324 -10.682 996 HA VAL 133 HA VAL 133 4.706 -2.000 -10.152 997 HB VAL 133 HB VAL 133 4.599 -0.724 -12.327 998 HG11 VAL 133 1HG1 VAL 133 6.527 -0.347 -13.376 999 HG12 VAL 133 2HG1 VAL 133 6.522 -2.053 -13.823 1000 HG13 VAL 133 3HG1 VAL 133 7.378 -1.523 -12.376 1001 HG21 VAL 133 3HG2 VAL 133 5.235 -3.632 -12.731 1002 HG22 VAL 133 1HG2 VAL 133 4.040 -2.641 -13.570 1003 HG23 VAL 133 2HG2 VAL 133 3.784 -3.093 -11.885 1004 H GLN 134 H GLN 134 8.135 -1.242 -10.516 1005 HA GLN 134 HA GLN 134 8.831 -4.057 -10.732 1006 HB2 GLN 134 2HB GLN 134 11.204 -3.120 -10.293 1007 HB3 GLN 134 1HB GLN 134 10.416 -2.744 -11.818 1008 HG2 GLN 134 2HG GLN 134 9.816 -0.559 -11.014 1009 HG3 GLN 134 1HG GLN 134 10.481 -0.932 -9.426 1010 HE21 GLN 134 1HE2 GLN 134 11.135 0.107 -12.615 1011 HE22 GLN 134 2HE2 GLN 134 12.851 0.349 -12.428 1012 H GLY 135 H GLY 135 8.893 -1.536 -8.279 1013 HA2 GLY 135 2HA GLY 135 10.029 -3.128 -6.224 1014 HA3 GLY 135 1HA GLY 135 9.110 -1.634 -5.997 1015 H MET 136 H MET 136 6.872 -2.996 -7.638 1016 HA MET 136 HA MET 136 5.673 -4.286 -5.298 1017 HB2 MET 136 2HB MET 136 3.565 -3.887 -6.251 1018 HB3 MET 136 1HB MET 136 4.498 -2.450 -6.642 1019 HG2 MET 136 2HG MET 136 4.893 -3.329 -8.889 1020 HG3 MET 136 1HG MET 136 3.941 -4.756 -8.494 1021 HE1 MET 136 3HE MET 136 0.660 -4.232 -9.078 1022 HE2 MET 136 1HE MET 136 2.160 -5.116 -9.356 1023 HE3 MET 136 2HE MET 136 1.538 -4.023 -10.592 1024 H LYS 137 H LYS 137 6.203 -4.902 -8.751 1025 HA LYS 137 HA LYS 137 5.193 -7.497 -8.853 1026 HB2 LYS 137 2HB LYS 137 6.198 -7.698 -10.951 1027 HB3 LYS 137 1HB LYS 137 5.900 -5.975 -10.779 1028 HG2 LYS 137 2HG LYS 137 8.324 -5.838 -9.955 1029 HG3 LYS 137 1HG LYS 137 8.499 -7.454 -10.641 1030 HD2 LYS 137 2HD LYS 137 7.683 -4.941 -12.099 1031 HD3 LYS 137 1HD LYS 137 9.200 -5.823 -12.273 1032 HE2 LYS 137 2HE LYS 137 6.519 -7.061 -12.857 1033 HE3 LYS 137 1HE LYS 137 7.456 -6.195 -14.076 1034 HZ1 LYS 137 3HZ LYS 137 8.747 -8.343 -12.545 1035 HZ2 LYS 137 1HZ LYS 137 9.060 -7.808 -14.120 1036 HZ3 LYS 137 2HZ LYS 137 7.696 -8.758 -13.805 1037 H GLU 138 H GLU 138 7.916 -6.374 -7.209 1038 HA GLU 138 HA GLU 138 9.244 -8.976 -7.221 1039 HB2 GLU 138 2HB GLU 138 10.111 -6.215 -6.870 1040 HB3 GLU 138 1HB GLU 138 10.719 -7.271 -5.596 1041 HG2 GLU 138 2HG GLU 138 12.358 -7.245 -7.273 1042 HG3 GLU 138 1HG GLU 138 11.535 -8.806 -7.418 1043 H ALA 139 H ALA 139 8.262 -6.473 -4.912 1044 HA ALA 139 HA ALA 139 8.515 -7.929 -2.566 1045 HB1 ALA 139 1HB ALA 139 7.729 -5.411 -3.157 1046 HB2 ALA 139 2HB ALA 139 7.557 -6.151 -1.565 1047 HB3 ALA 139 3HB ALA 139 6.191 -6.128 -2.679 1048 H GLN 140 H GLN 140 6.137 -8.130 -5.068 1049 HA GLN 140 HA GLN 140 4.110 -9.382 -3.568 1050 HB2 GLN 140 2HB GLN 140 3.358 -10.159 -5.918 1051 HB3 GLN 140 1HB GLN 140 3.276 -8.450 -5.502 1052 HG2 GLN 140 2HG GLN 140 4.444 -8.019 -7.310 1053 HG3 GLN 140 1HG GLN 140 5.815 -8.871 -6.611 1054 HE21 GLN 140 1HE2 GLN 140 4.636 -11.474 -6.666 1055 HE22 GLN 140 2HE2 GLN 140 4.545 -11.966 -8.316 1056 H GLU 141 H GLU 141 7.049 -10.568 -4.883 1057 HA GLU 141 HA GLU 141 6.086 -13.329 -4.567 1058 HB2 GLU 141 2HB GLU 141 7.120 -13.894 -6.462 1059 HB3 GLU 141 1HB GLU 141 7.331 -12.164 -6.743 1060 HG2 GLU 141 2HG GLU 141 9.467 -12.442 -5.353 1061 HG3 GLU 141 1HG GLU 141 9.291 -14.158 -5.703 1062 H ARG 142 H ARG 142 8.140 -10.999 -3.213 1063 HA ARG 142 HA ARG 142 9.707 -13.074 -1.846 1064 HB2 ARG 142 2HB ARG 142 11.207 -11.131 -1.199 1065 HB3 ARG 142 1HB ARG 142 11.193 -11.588 -2.906 1066 HG2 ARG 142 2HG ARG 142 10.886 -9.423 -3.316 1067 HG3 ARG 142 1HG ARG 142 9.221 -9.676 -2.768 1068 HD2 ARG 142 2HD ARG 142 10.256 -7.761 -1.655 1069 HD3 ARG 142 1HD ARG 142 9.855 -9.045 -0.505 1070 HE ARG 142 HE ARG 142 12.576 -8.505 -1.514 1071 HH11 ARG 142 1HH1 ARG 142 10.414 -9.582 1.019 1072 HH12 ARG 142 2HH1 ARG 142 11.689 -9.836 2.159 1073 HH21 ARG 142 1HH2 ARG 142 14.242 -8.848 -0.007 1074 HH22 ARG 142 2HH2 ARG 142 13.856 -9.423 1.581 1075 H LEU 143 H LEU 143 7.195 -10.820 -1.344 1076 HA LEU 143 HA LEU 143 7.656 -10.899 1.559 1077 HB2 LEU 143 2HB LEU 143 6.773 -8.834 1.772 1078 HB3 LEU 143 1HB LEU 143 7.293 -8.703 0.093 1079 HG LEU 143 HG LEU 143 4.826 -9.582 -0.359 1080 HD11 LEU 143 1HD1 LEU 143 4.835 -8.719 2.457 1081 HD12 LEU 143 2HD1 LEU 143 3.774 -9.849 1.618 1082 HD13 LEU 143 3HD1 LEU 143 3.511 -8.111 1.464 1083 HD21 LEU 143 3HD2 LEU 143 4.502 -7.520 -1.179 1084 HD22 LEU 143 1HD2 LEU 143 6.143 -7.204 -0.616 1085 HD23 LEU 143 2HD2 LEU 143 4.764 -6.753 0.387 1086 H THR 144 H THR 144 5.403 -11.781 -0.962 1087 HA THR 144 HA THR 144 3.069 -12.198 0.442 1088 HB THR 144 HB THR 144 2.840 -14.214 -1.178 1089 HG1 THR 144 1HG THR 144 4.882 -14.528 -1.861 1090 HG21 THR 144 3HG2 THR 144 3.045 -11.358 -2.036 1091 HG22 THR 144 1HG2 THR 144 1.599 -12.302 -1.679 1092 HG23 THR 144 2HG2 THR 144 2.536 -12.643 -3.131 1093 H GLY 145 H GLY 145 3.262 -12.963 2.508 1094 HA2 GLY 145 2HA GLY 145 2.855 -15.219 3.534 1095 HA3 GLY 145 1HA GLY 145 4.378 -15.687 2.791 1096 H ASP 146 H ASP 146 6.101 -15.629 4.061 1097 HA ASP 146 HA ASP 146 6.471 -13.534 6.008 1098 HB2 ASP 146 2HB ASP 146 5.692 -16.295 6.796 1099 HB3 ASP 146 1HB ASP 146 6.953 -15.514 7.745 1100 H ALA 147 H ALA 147 7.794 -14.663 3.617 1101 HA ALA 147 HA ALA 147 10.208 -15.918 4.581 1102 HB1 ALA 147 1HB ALA 147 9.653 -14.829 1.826 1103 HB2 ALA 147 2HB ALA 147 9.186 -16.441 2.366 1104 HB3 ALA 147 3HB ALA 147 10.890 -15.998 2.288 1105 H PHE 148 H PHE 148 9.096 -12.708 3.908 1106 HA PHE 148 HA PHE 148 11.491 -11.388 3.391 1107 HB2 PHE 148 2HB PHE 148 10.362 -9.357 4.162 1108 HB3 PHE 148 1HB PHE 148 9.276 -10.335 3.164 1109 HD1 PHE 148 2HD PHE 148 7.440 -11.593 4.207 1110 HD2 PHE 148 1HD PHE 148 9.893 -8.941 6.457 1111 HE1 PHE 148 2HE PHE 148 5.760 -11.570 6.003 1112 HE2 PHE 148 1HE PHE 148 8.219 -8.914 8.259 1113 HZ PHE 148 HZ PHE 148 6.148 -10.229 8.032 1114 H ARG 149 H ARG 149 10.167 -12.593 6.385 1115 HA ARG 149 HA ARG 149 11.750 -11.125 8.181 1116 HB2 ARG 149 2HB ARG 149 10.799 -13.934 8.674 1117 HB3 ARG 149 1HB ARG 149 11.004 -12.629 9.832 1118 HG2 ARG 149 2HG ARG 149 9.158 -11.442 8.477 1119 HG3 ARG 149 1HG ARG 149 8.821 -13.051 7.841 1120 HD2 ARG 149 2HD ARG 149 9.093 -12.742 10.780 1121 HD3 ARG 149 1HD ARG 149 7.634 -12.113 10.020 1122 HE ARG 149 HE ARG 149 6.971 -14.275 9.528 1123 HH11 ARG 149 1HH1 ARG 149 10.206 -14.284 10.850 1124 HH12 ARG 149 2HH1 ARG 149 10.222 -15.994 11.118 1125 HH21 ARG 149 1HH2 ARG 149 6.998 -16.522 9.879 1126 HH22 ARG 149 2HH2 ARG 149 8.405 -17.264 10.565 1127 H LYS 150 H LYS 150 13.859 -11.209 8.567 1128 HA LYS 150 HA LYS 150 15.294 -13.735 8.176 1129 HB2 LYS 150 2HB LYS 150 15.723 -11.198 6.720 1130 HB3 LYS 150 1HB LYS 150 17.177 -11.985 7.320 1131 HG2 LYS 150 2HG LYS 150 17.130 -13.191 5.456 1132 HG3 LYS 150 1HG LYS 150 15.765 -14.053 6.167 1133 HD2 LYS 150 2HD LYS 150 14.760 -13.415 4.238 1134 HD3 LYS 150 1HD LYS 150 14.462 -11.943 5.165 1135 HE2 LYS 150 2HE LYS 150 15.822 -10.719 3.873 1136 HE3 LYS 150 1HE LYS 150 17.059 -11.975 3.830 1137 HZ1 LYS 150 3HZ LYS 150 14.647 -12.510 2.301 1138 HZ2 LYS 150 1HZ LYS 150 16.266 -12.812 1.913 1139 HZ3 LYS 150 2HZ LYS 150 15.624 -11.260 1.715 1140 H LYS 151 H LYS 151 16.909 -14.118 9.625 1141 HA LYS 151 HA LYS 151 18.294 -12.209 11.122 1142 HB2 LYS 151 2HB LYS 151 17.196 -12.695 13.370 1143 HB3 LYS 151 1HB LYS 151 16.331 -11.616 12.285 1144 HG2 LYS 151 2HG LYS 151 14.623 -12.957 12.979 1145 HG3 LYS 151 1HG LYS 151 15.143 -13.836 11.541 1146 HD2 LYS 151 2HD LYS 151 16.760 -14.922 13.435 1147 HD3 LYS 151 1HD LYS 151 15.308 -14.582 14.379 1148 HE2 LYS 151 2HE LYS 151 14.874 -16.707 13.592 1149 HE3 LYS 151 1HE LYS 151 14.074 -15.704 12.384 1150 HZ1 LYS 151 3HZ LYS 151 16.861 -16.593 12.002 1151 HZ2 LYS 151 1HZ LYS 151 15.737 -16.098 10.838 1152 HZ3 LYS 151 2HZ LYS 151 15.568 -17.603 11.590 1153 H HIS 152 H HIS 152 19.525 -13.191 12.943 1154 HA HIS 152 HA HIS 152 20.929 -14.801 13.729 1155 HB2 HIS 152 2HB HIS 152 18.489 -16.473 13.151 1156 HB3 HIS 152 1HB HIS 152 19.939 -17.132 13.897 1157 HD1 HIS 152 1HD HIS 152 19.531 -17.378 16.316 1158 HD2 HIS 152 2HD HIS 152 17.855 -13.882 14.820 1159 HE1 HIS 152 1HE HIS 152 18.532 -16.207 18.304 1160 HE2 HIS 152 2HE HIS 152 17.449 -14.138 17.361 1161 H LEU 153 H LEU 153 21.712 -17.230 13.084 1162 HA LEU 153 HA LEU 153 22.878 -18.494 11.599 1163 HB2 LEU 153 2HB LEU 153 20.672 -18.604 10.444 1164 HB3 LEU 153 1HB LEU 153 21.139 -17.206 9.494 1165 HG LEU 153 HG LEU 153 23.049 -19.443 9.395 1166 HD11 LEU 153 1HD1 LEU 153 20.196 -19.820 8.762 1167 HD12 LEU 153 2HD1 LEU 153 21.437 -21.003 9.176 1168 HD13 LEU 153 3HD1 LEU 153 21.341 -20.362 7.534 1169 HD21 LEU 153 3HD2 LEU 153 23.481 -17.658 7.951 1170 HD22 LEU 153 1HD2 LEU 153 21.789 -17.513 7.475 1171 HD23 LEU 153 2HD2 LEU 153 22.749 -18.883 6.914 1172 H GLU 154 H GLU 154 24.888 -17.643 11.760 1173 HA GLU 154 HA GLU 154 25.775 -15.955 9.578 1174 HB2 GLU 154 2HB GLU 154 25.199 -14.826 12.109 1175 HB3 GLU 154 1HB GLU 154 26.950 -14.871 11.963 1176 HG2 GLU 154 2HG GLU 154 26.992 -13.296 10.367 1177 HG3 GLU 154 1HG GLU 154 25.525 -13.891 9.590 1178 H ASP 155 H ASP 155 26.245 -18.670 10.255 1179 HA ASP 155 HA ASP 155 27.959 -20.164 10.295 1180 HB2 ASP 155 2HB ASP 155 29.120 -17.747 9.284 1181 HB3 ASP 155 1HB ASP 155 30.291 -18.540 10.332 1182 H GLU 156 H GLU 156 29.624 -17.496 11.945 1183 HA GLU 156 HA GLU 156 29.315 -18.854 14.507 1184 HB2 GLU 156 2HB GLU 156 31.572 -19.325 13.019 1185 HB3 GLU 156 1HB GLU 156 32.078 -17.976 14.041 1186 HG2 GLU 156 2HG GLU 156 30.856 -20.528 15.070 1187 HG3 GLU 156 1HG GLU 156 32.588 -20.213 14.979 1188 H LEU 157 H LEU 157 31.138 -16.184 12.994 1189 HA LEU 157 HA LEU 157 30.527 -14.495 15.293 1190 HB2 LEU 157 2HB LEU 157 32.060 -12.873 14.099 1191 HB3 LEU 157 1HB LEU 157 32.792 -14.357 14.680 1192 HG LEU 157 HG LEU 157 31.837 -14.459 11.894 1193 HD11 LEU 157 1HD1 LEU 157 32.664 -12.393 11.448 1194 HD12 LEU 157 2HD1 LEU 157 34.172 -13.304 11.356 1195 HD13 LEU 157 3HD1 LEU 157 33.767 -12.412 12.823 1196 HD21 LEU 157 3HD2 LEU 157 33.471 -15.998 11.685 1197 HD22 LEU 157 1HD2 LEU 157 33.382 -16.029 13.446 1198 HD23 LEU 157 2HD2 LEU 157 34.622 -15.066 12.643 Start of MODEL 9 1 H1 MET 1 1HT MET 1 -12.798 -11.694 26.263 2 H2 MET 1 2HT MET 1 -14.422 -11.214 25.981 3 H3 MET 1 3HT MET 1 -13.822 -11.324 27.587 4 HA MET 1 HA MET 1 -14.032 -9.058 26.617 5 HB2 MET 1 2HB MET 1 -11.970 -8.357 27.713 6 HB3 MET 1 1HB MET 1 -12.734 -9.651 28.628 7 HG2 MET 1 2HG MET 1 -11.046 -11.016 26.954 8 HG3 MET 1 1HG MET 1 -10.131 -9.556 27.325 9 HE1 MET 1 2HE MET 1 -11.082 -13.145 29.756 10 HE2 MET 1 3HE MET 1 -11.983 -12.512 28.377 11 HE3 MET 1 1HE MET 1 -12.426 -12.031 30.015 12 H HIS 2 H HIS 2 -13.399 -7.629 25.075 13 HA HIS 2 HA HIS 2 -11.249 -8.397 23.238 14 HB2 HIS 2 2HB HIS 2 -14.121 -8.051 22.578 15 HB3 HIS 2 1HB HIS 2 -12.966 -7.335 21.458 16 HD1 HIS 2 1HD HIS 2 -11.003 -9.163 20.696 17 HD2 HIS 2 2HD HIS 2 -14.659 -10.634 22.012 18 HE1 HIS 2 1HE HIS 2 -11.132 -11.518 19.823 19 HE2 HIS 2 2HE HIS 2 -13.318 -12.414 20.698 20 H HIS 3 H HIS 3 -10.068 -6.715 22.439 21 HA HIS 3 HA HIS 3 -10.936 -4.001 23.185 22 HB2 HIS 3 2HB HIS 3 -8.229 -5.285 23.487 23 HB3 HIS 3 1HB HIS 3 -8.421 -3.536 23.432 24 HD1 HIS 3 1HD HIS 3 -8.190 -6.192 25.775 25 HD2 HIS 3 2HD HIS 3 -10.445 -2.709 25.539 26 HE1 HIS 3 1HE HIS 3 -8.966 -5.731 28.124 27 HE2 HIS 3 2HE HIS 3 -10.404 -3.671 27.939 28 H HIS 4 H HIS 4 -8.716 -5.840 21.097 29 HA HIS 4 HA HIS 4 -8.545 -3.662 19.207 30 HB2 HIS 4 2HB HIS 4 -7.163 -5.304 17.892 31 HB3 HIS 4 1HB HIS 4 -6.556 -4.960 19.508 32 HD1 HIS 4 1HD HIS 4 -8.991 -7.543 18.110 33 HD2 HIS 4 2HD HIS 4 -5.691 -7.254 20.620 34 HE1 HIS 4 1HE HIS 4 -8.561 -9.883 18.927 35 HE2 HIS 4 2HE HIS 4 -6.511 -9.696 20.380 36 H HIS 5 H HIS 5 -8.935 -4.113 16.853 37 HA HIS 5 HA HIS 5 -10.384 -4.548 15.156 38 HB2 HIS 5 2HB HIS 5 -10.649 -7.082 16.766 39 HB3 HIS 5 1HB HIS 5 -11.534 -6.839 15.263 40 HD1 HIS 5 1HD HIS 5 -8.655 -8.465 16.366 41 HD2 HIS 5 2HD HIS 5 -9.428 -5.929 13.167 42 HE1 HIS 5 1HE HIS 5 -6.821 -8.903 14.702 43 HE2 HIS 5 2HE HIS 5 -7.257 -7.290 12.817 44 H HIS 6 H HIS 6 -11.296 -3.053 17.480 45 HA HIS 6 HA HIS 6 -14.185 -3.477 17.140 46 HB2 HIS 6 2HB HIS 6 -12.903 -4.044 19.483 47 HB3 HIS 6 1HB HIS 6 -13.370 -2.367 19.743 48 HD1 HIS 6 1HD HIS 6 -15.699 -1.991 20.525 49 HD2 HIS 6 2HD HIS 6 -15.213 -5.740 18.799 50 HE1 HIS 6 1HE HIS 6 -17.884 -3.184 20.883 51 HE2 HIS 6 2HE HIS 6 -17.597 -5.416 19.750 52 H HIS 7 H HIS 7 -15.485 -1.577 17.374 53 HA HIS 7 HA HIS 7 -16.000 0.600 16.968 54 HB2 HIS 7 2HB HIS 7 -13.588 0.737 18.685 55 HB3 HIS 7 1HB HIS 7 -14.015 2.213 17.822 56 HD1 HIS 7 1HD HIS 7 -16.665 2.923 18.200 57 HD2 HIS 7 2HD HIS 7 -14.889 0.464 21.040 58 HE1 HIS 7 1HE HIS 7 -18.106 3.116 20.251 59 HE2 HIS 7 2HE HIS 7 -17.062 1.550 21.926 60 H MET 8 H MET 8 -14.560 -0.949 14.962 61 HA MET 8 HA MET 8 -13.117 1.197 13.555 62 HB2 MET 8 2HB MET 8 -12.162 -1.249 14.090 63 HB3 MET 8 1HB MET 8 -12.991 -1.607 12.570 64 HG2 MET 8 2HG MET 8 -11.658 -0.085 11.370 65 HG3 MET 8 1HG MET 8 -11.037 0.657 12.845 66 HE1 MET 8 3HE MET 8 -8.422 -1.664 14.176 67 HE2 MET 8 1HE MET 8 -9.752 -0.584 14.592 68 HE3 MET 8 2HE MET 8 -8.436 -0.008 13.569 69 H SER 9 H SER 9 -14.066 2.103 11.858 70 HA SER 9 HA SER 9 -16.139 0.585 10.422 71 HB2 SER 9 2HB SER 9 -16.870 2.549 12.038 72 HB3 SER 9 1HB SER 9 -16.389 3.554 10.672 73 HG SER 9 HG SER 9 -18.679 2.588 10.894 74 H ASP 10 H ASP 10 -16.444 1.177 8.202 75 HA ASP 10 HA ASP 10 -14.062 2.448 7.024 76 HB2 ASP 10 2HB ASP 10 -14.805 -0.115 6.643 77 HB3 ASP 10 1HB ASP 10 -15.721 0.650 5.350 78 H GLY 11 H GLY 11 -14.525 3.286 4.732 79 HA2 GLY 11 2HA GLY 11 -17.131 4.682 4.756 80 HA3 GLY 11 1HA GLY 11 -15.635 5.455 4.250 81 H HIS 12 H HIS 12 -16.411 5.965 2.202 82 HA HIS 12 HA HIS 12 -16.298 3.765 0.311 83 HB2 HIS 12 2HB HIS 12 -18.762 5.382 0.839 84 HB3 HIS 12 1HB HIS 12 -18.425 4.835 -0.808 85 HD1 HIS 12 1HD HIS 12 -19.778 3.716 2.408 86 HD2 HIS 12 2HD HIS 12 -18.312 1.949 -1.055 87 HE1 HIS 12 1HE HIS 12 -20.547 1.324 2.497 88 HE2 HIS 12 2HE HIS 12 -19.712 0.292 0.355 89 H ASN 13 H ASN 13 -16.319 4.581 -1.971 90 HA ASN 13 HA ASN 13 -15.952 7.298 -2.592 91 HB2 ASN 13 2HB ASN 13 -13.588 5.867 -1.611 92 HB3 ASN 13 1HB ASN 13 -13.345 6.629 -3.179 93 HD21 ASN 13 1HD2 ASN 13 -13.154 7.076 0.073 94 HD22 ASN 13 2HD2 ASN 13 -13.188 8.803 0.128 95 H GLY 14 H GLY 14 -14.364 7.292 -4.757 96 HA2 GLY 14 2HA GLY 14 -15.788 5.450 -6.535 97 HA3 GLY 14 1HA GLY 14 -14.897 6.895 -7.026 98 H LEU 15 H LEU 15 -13.755 4.277 -4.938 99 HA LEU 15 HA LEU 15 -11.981 2.869 -5.101 100 HB2 LEU 15 2HB LEU 15 -12.442 3.033 -8.077 101 HB3 LEU 15 1HB LEU 15 -11.604 1.761 -7.208 102 HG LEU 15 HG LEU 15 -14.362 2.165 -6.306 103 HD11 LEU 15 1HD1 LEU 15 -13.821 1.257 -9.128 104 HD12 LEU 15 2HD1 LEU 15 -14.758 2.665 -8.628 105 HD13 LEU 15 3HD1 LEU 15 -15.348 1.041 -8.273 106 HD21 LEU 15 3HD2 LEU 15 -13.475 0.237 -5.474 107 HD22 LEU 15 1HD2 LEU 15 -12.482 -0.055 -6.903 108 HD23 LEU 15 2HD2 LEU 15 -14.210 -0.401 -6.944 109 H GLY 16 H GLY 16 -10.156 3.825 -4.483 110 HA2 GLY 16 2HA GLY 16 -8.042 4.713 -4.715 111 HA3 GLY 16 1HA GLY 16 -8.308 4.817 -6.445 112 H LYS 17 H LYS 17 -7.845 6.827 -6.990 113 HA LYS 17 HA LYS 17 -9.520 8.965 -6.579 114 HB2 LYS 17 2HB LYS 17 -8.150 8.545 -4.217 115 HB3 LYS 17 1HB LYS 17 -7.191 9.788 -4.998 116 HG2 LYS 17 2HG LYS 17 -10.165 10.027 -4.686 117 HG3 LYS 17 1HG LYS 17 -9.030 10.564 -3.445 118 HD2 LYS 17 2HD LYS 17 -8.400 12.374 -4.630 119 HD3 LYS 17 1HD LYS 17 -8.417 11.498 -6.162 120 HE2 LYS 17 2HE LYS 17 -10.235 12.730 -6.612 121 HE3 LYS 17 1HE LYS 17 -11.071 11.595 -5.552 122 HZ1 LYS 17 3HZ LYS 17 -11.445 13.994 -5.045 123 HZ2 LYS 17 1HZ LYS 17 -9.820 14.106 -4.588 124 HZ3 LYS 17 2HZ LYS 17 -10.870 13.087 -3.740 125 H GLY 18 H GLY 18 -8.495 8.245 -8.815 126 HA2 GLY 18 2HA GLY 18 -7.534 9.363 -10.643 127 HA3 GLY 18 1HA GLY 18 -6.642 10.390 -9.513 128 H PHE 19 H PHE 19 -6.824 6.868 -9.620 129 HA PHE 19 HA PHE 19 -3.907 6.795 -10.020 130 HB2 PHE 19 2HB PHE 19 -5.176 5.898 -7.855 131 HB3 PHE 19 1HB PHE 19 -5.380 4.467 -8.874 132 HD1 PHE 19 1HD PHE 19 -2.727 4.723 -10.357 133 HD2 PHE 19 2HD PHE 19 -3.756 4.971 -6.234 134 HE1 PHE 19 1HE PHE 19 -0.463 3.972 -9.744 135 HE2 PHE 19 2HE PHE 19 -1.497 4.219 -5.618 136 HZ PHE 19 HZ PHE 19 0.151 3.716 -7.376 137 H GLY 20 H GLY 20 -6.584 4.475 -10.361 138 HA2 GLY 20 2HA GLY 20 -6.033 4.171 -13.203 139 HA3 GLY 20 1HA GLY 20 -5.683 2.762 -12.198 140 H ASP 21 H ASP 21 -7.619 2.499 -10.486 141 HA ASP 21 HA ASP 21 -10.244 3.068 -11.256 142 HB2 ASP 21 2HB ASP 21 -9.024 0.714 -12.561 143 HB3 ASP 21 1HB ASP 21 -10.603 0.424 -11.816 144 H HIS 22 H HIS 22 -9.458 -0.239 -10.389 145 HA HIS 22 HA HIS 22 -10.472 0.258 -7.671 146 HB2 HIS 22 2HB HIS 22 -10.090 -2.535 -8.493 147 HB3 HIS 22 1HB HIS 22 -11.501 -1.761 -7.780 148 HD1 HIS 22 1HD HIS 22 -13.220 -0.686 -9.444 149 HD2 HIS 22 2HD HIS 22 -10.159 -2.846 -11.246 150 HE1 HIS 22 1HE HIS 22 -13.963 -1.051 -11.818 151 HE2 HIS 22 2HE HIS 22 -12.115 -2.398 -12.878 152 H ILE 23 H ILE 23 -8.285 -2.079 -9.151 153 HA ILE 23 HA ILE 23 -6.361 -3.057 -8.350 154 HB ILE 23 HB ILE 23 -5.620 -0.152 -8.212 155 HG12 ILE 23 2HG1 ILE 23 -7.030 -0.788 -10.231 156 HG13 ILE 23 1HG1 ILE 23 -5.472 -0.045 -10.564 157 HG21 ILE 23 1HG2 ILE 23 -3.776 -1.936 -9.545 158 HG22 ILE 23 2HG2 ILE 23 -4.060 -2.379 -7.864 159 HG23 ILE 23 3HG2 ILE 23 -3.505 -0.755 -8.269 160 HD11 ILE 23 3HD1 ILE 23 -6.114 -1.996 -12.009 161 HD12 ILE 23 1HD1 ILE 23 -5.887 -3.014 -10.586 162 HD13 ILE 23 2HD1 ILE 23 -4.532 -2.091 -11.236 163 H HIS 24 H HIS 24 -4.724 -0.777 -6.712 164 HA HIS 24 HA HIS 24 -4.932 -2.170 -4.222 165 HB2 HIS 24 2HB HIS 24 -3.199 0.230 -4.684 166 HB3 HIS 24 1HB HIS 24 -2.918 -1.167 -3.645 167 HD1 HIS 24 1HD HIS 24 -3.045 -3.499 -5.458 168 HD2 HIS 24 2HD HIS 24 -1.362 0.106 -6.655 169 HE1 HIS 24 1HE HIS 24 -1.505 -4.075 -7.359 170 HE2 HIS 24 2HE HIS 24 -0.424 -1.892 -8.003 171 H TRP 25 H TRP 25 -7.240 -0.532 -4.974 172 HA TRP 25 HA TRP 25 -7.366 1.005 -2.524 173 HB2 TRP 25 2HB TRP 25 -8.604 2.801 -4.109 174 HB3 TRP 25 1HB TRP 25 -6.918 2.906 -3.623 175 HD1 TRP 25 HD TRP 25 -9.121 2.520 -6.605 176 HE1 TRP 25 1HE TRP 25 -7.696 2.372 -8.714 177 HE3 TRP 25 3HE TRP 25 -4.500 1.959 -4.486 178 HZ2 TRP 25 2HZ TRP 25 -4.992 2.102 -9.438 179 HZ3 TRP 25 3HZ TRP 25 -2.550 1.764 -5.970 180 HH2 TRP 25 HH TRP 25 -2.788 1.836 -8.384 181 H ARG 26 H ARG 26 -8.833 -1.121 -4.640 182 HA ARG 26 HA ARG 26 -11.449 -0.482 -4.862 183 HB2 ARG 26 2HB ARG 26 -10.593 -3.117 -3.671 184 HB3 ARG 26 1HB ARG 26 -12.096 -2.794 -4.528 185 HG2 ARG 26 2HG ARG 26 -10.217 -2.075 -6.369 186 HG3 ARG 26 1HG ARG 26 -9.445 -3.435 -5.562 187 HD2 ARG 26 2HD ARG 26 -12.304 -3.636 -6.405 188 HD3 ARG 26 1HD ARG 26 -11.023 -3.864 -7.601 189 HE ARG 26 HE ARG 26 -10.214 -5.705 -6.199 190 HH11 ARG 26 1HH1 ARG 26 -13.515 -4.639 -5.739 191 HH12 ARG 26 2HH1 ARG 26 -14.031 -6.151 -5.075 192 HH21 ARG 26 1HH2 ARG 26 -10.904 -7.682 -5.327 193 HH22 ARG 26 2HH2 ARG 26 -12.555 -7.874 -4.839 194 H THR 27 H THR 27 -9.924 -1.617 -1.851 195 HA THR 27 HA THR 27 -11.111 -0.004 -0.051 196 HB THR 27 HB THR 27 -13.334 -0.540 -0.558 197 HG1 THR 27 1HG THR 27 -14.061 -1.561 1.261 198 HG21 THR 27 3HG2 THR 27 -13.396 -2.324 -1.987 199 HG22 THR 27 1HG2 THR 27 -14.033 -3.049 -0.512 200 HG23 THR 27 2HG2 THR 27 -12.351 -3.316 -0.970 201 H LEU 28 H LEU 28 -10.641 -0.534 2.081 202 HA LEU 28 HA LEU 28 -8.615 -2.524 2.407 203 HB2 LEU 28 2HB LEU 28 -8.694 -0.295 3.576 204 HB3 LEU 28 1HB LEU 28 -10.006 -0.937 4.566 205 HG LEU 28 HG LEU 28 -7.468 -2.488 4.483 206 HD11 LEU 28 1HD1 LEU 28 -6.202 -1.064 5.710 207 HD12 LEU 28 2HD1 LEU 28 -7.599 -0.290 6.461 208 HD13 LEU 28 3HD1 LEU 28 -7.134 0.135 4.813 209 HD21 LEU 28 3HD2 LEU 28 -8.225 -2.370 7.045 210 HD22 LEU 28 1HD2 LEU 28 -8.889 -3.537 5.901 211 HD23 LEU 28 2HD2 LEU 28 -9.781 -2.063 6.276 212 H GLU 29 H GLU 29 -11.965 -2.170 3.500 213 HA GLU 29 HA GLU 29 -12.129 -4.373 5.185 214 HB2 GLU 29 2HB GLU 29 -13.891 -2.623 4.861 215 HB3 GLU 29 1HB GLU 29 -14.315 -3.397 3.341 216 HG2 GLU 29 2HG GLU 29 -14.281 -5.072 5.789 217 HG3 GLU 29 1HG GLU 29 -15.598 -3.913 5.590 218 H ASP 30 H ASP 30 -13.372 -4.317 1.842 219 HA ASP 30 HA ASP 30 -13.597 -7.102 1.609 220 HB2 ASP 30 2HB ASP 30 -14.328 -4.952 0.068 221 HB3 ASP 30 1HB ASP 30 -13.039 -5.676 -0.905 222 H GLY 31 H GLY 31 -10.882 -4.974 1.246 223 HA2 GLY 31 2HA GLY 31 -9.257 -6.750 -0.296 224 HA3 GLY 31 1HA GLY 31 -8.700 -5.329 0.597 225 H LYS 32 H LYS 32 -9.762 -6.238 3.146 226 HA LYS 32 HA LYS 32 -7.521 -7.760 4.010 227 HB2 LYS 32 2HB LYS 32 -9.274 -6.090 5.251 228 HB3 LYS 32 1HB LYS 32 -9.872 -7.653 5.791 229 HG2 LYS 32 2HG LYS 32 -7.771 -8.203 6.770 230 HG3 LYS 32 1HG LYS 32 -7.002 -6.791 6.044 231 HD2 LYS 32 2HD LYS 32 -7.399 -5.851 8.053 232 HD3 LYS 32 1HD LYS 32 -9.026 -5.619 7.408 233 HE2 LYS 32 2HE LYS 32 -9.825 -7.573 8.507 234 HE3 LYS 32 1HE LYS 32 -8.191 -8.067 8.947 235 HZ1 LYS 32 3HZ LYS 32 -8.154 -5.838 10.205 236 HZ2 LYS 32 1HZ LYS 32 -8.995 -7.140 10.883 237 HZ3 LYS 32 2HZ LYS 32 -9.840 -5.910 10.089 238 H LYS 33 H LYS 33 -10.989 -8.513 3.753 239 HA LYS 33 HA LYS 33 -10.751 -11.206 4.565 240 HB2 LYS 33 2HB LYS 33 -13.006 -11.466 3.494 241 HB3 LYS 33 1HB LYS 33 -12.899 -10.165 4.671 242 HG2 LYS 33 2HG LYS 33 -13.823 -8.862 3.129 243 HG3 LYS 33 1HG LYS 33 -12.266 -8.928 2.283 244 HD2 LYS 33 2HD LYS 33 -13.604 -9.658 0.594 245 HD3 LYS 33 1HD LYS 33 -13.313 -11.209 1.385 246 HE2 LYS 33 2HE LYS 33 -15.447 -11.398 2.070 247 HE3 LYS 33 1HE LYS 33 -15.572 -9.686 2.472 248 HZ1 LYS 33 3HZ LYS 33 -16.073 -9.143 0.262 249 HZ2 LYS 33 1HZ LYS 33 -17.005 -10.518 0.585 250 HZ3 LYS 33 2HZ LYS 33 -15.586 -10.651 -0.326 251 H GLU 34 H GLU 34 -10.370 -9.602 1.488 252 HA GLU 34 HA GLU 34 -10.447 -11.987 -0.091 253 HB2 GLU 34 2HB GLU 34 -10.948 -9.707 -0.979 254 HB3 GLU 34 1HB GLU 34 -9.240 -9.307 -0.799 255 HG2 GLU 34 2HG GLU 34 -8.656 -10.408 -2.653 256 HG3 GLU 34 1HG GLU 34 -9.746 -11.762 -2.311 257 H ALA 35 H ALA 35 -7.829 -9.860 1.052 258 HA ALA 35 HA ALA 35 -5.674 -11.226 -0.039 259 HB1 ALA 35 1HB ALA 35 -5.090 -9.192 0.863 260 HB2 ALA 35 2HB ALA 35 -4.468 -10.299 2.087 261 HB3 ALA 35 3HB ALA 35 -6.002 -9.465 2.346 262 H ALA 36 H ALA 36 -7.716 -12.077 2.617 263 HA ALA 36 HA ALA 36 -5.970 -13.867 3.947 264 HB1 ALA 36 1HB ALA 36 -8.120 -14.795 4.893 265 HB2 ALA 36 2HB ALA 36 -8.967 -13.609 3.901 266 HB3 ALA 36 3HB ALA 36 -7.845 -13.073 5.152 267 H ALA 37 H ALA 37 -8.322 -14.258 1.341 268 HA ALA 37 HA ALA 37 -8.378 -17.038 1.187 269 HB1 ALA 37 1HB ALA 37 -9.134 -16.748 -1.109 270 HB2 ALA 37 2HB ALA 37 -8.584 -15.072 -1.092 271 HB3 ALA 37 3HB ALA 37 -9.911 -15.576 -0.045 272 H SER 38 H SER 38 -6.597 -14.991 -1.125 273 HA SER 38 HA SER 38 -4.869 -17.115 -1.894 274 HB2 SER 38 2HB SER 38 -4.713 -14.129 -2.378 275 HB3 SER 38 1HB SER 38 -3.622 -15.314 -3.118 276 HG SER 38 HG SER 38 -5.629 -14.610 -4.301 277 H GLY 39 H GLY 39 -4.689 -14.518 0.437 278 HA2 GLY 39 2HA GLY 39 -3.321 -14.428 2.318 279 HA3 GLY 39 1HA GLY 39 -2.391 -15.785 1.675 280 H LEU 40 H LEU 40 -3.085 -12.767 -0.040 281 HA LEU 40 HA LEU 40 -0.195 -12.328 -0.199 282 HB2 LEU 40 2HB LEU 40 -0.783 -10.697 -1.988 283 HB3 LEU 40 1HB LEU 40 -1.180 -12.361 -2.348 284 HG LEU 40 HG LEU 40 -3.548 -11.857 -1.767 285 HD11 LEU 40 1HD1 LEU 40 -3.851 -9.192 -2.006 286 HD12 LEU 40 2HD1 LEU 40 -2.351 -9.271 -1.086 287 HD13 LEU 40 3HD1 LEU 40 -3.806 -10.048 -0.465 288 HD21 LEU 40 3HD2 LEU 40 -2.054 -10.706 -4.022 289 HD22 LEU 40 1HD2 LEU 40 -3.693 -10.096 -3.788 290 HD23 LEU 40 2HD2 LEU 40 -3.417 -11.824 -4.013 291 HA PRO 41 HA PRO 41 -0.142 -8.852 2.476 292 HB2 PRO 41 2HB PRO 41 1.539 -7.136 1.184 293 HB3 PRO 41 1HB PRO 41 2.088 -8.577 2.048 294 HG2 PRO 41 2HG PRO 41 1.590 -8.200 -0.880 295 HG3 PRO 41 1HG PRO 41 2.956 -8.998 -0.074 296 HD2 PRO 41 2HD PRO 41 0.944 -10.412 -1.147 297 HD3 PRO 41 1HD PRO 41 1.734 -10.924 0.358 298 H LEU 42 H LEU 42 -0.656 -6.598 2.711 299 HA LEU 42 HA LEU 42 -2.755 -5.810 0.860 300 HB2 LEU 42 2HB LEU 42 -2.109 -5.296 3.670 301 HB3 LEU 42 1HB LEU 42 -2.688 -3.881 2.812 302 HG LEU 42 HG LEU 42 -4.738 -5.041 2.209 303 HD11 LEU 42 1HD1 LEU 42 -3.299 -7.346 2.522 304 HD12 LEU 42 2HD1 LEU 42 -5.050 -7.248 2.346 305 HD13 LEU 42 3HD1 LEU 42 -4.331 -7.346 3.952 306 HD21 LEU 42 3HD2 LEU 42 -4.233 -3.969 4.563 307 HD22 LEU 42 1HD2 LEU 42 -4.480 -5.627 5.112 308 HD23 LEU 42 2HD2 LEU 42 -5.761 -4.789 4.236 309 H MET 43 H MET 43 -2.862 -3.772 -0.125 310 HA MET 43 HA MET 43 -0.241 -2.476 -0.439 311 HB2 MET 43 2HB MET 43 -1.178 -3.606 -2.452 312 HB3 MET 43 1HB MET 43 -2.544 -2.484 -2.405 313 HG2 MET 43 2HG MET 43 -0.817 -1.830 -4.027 314 HG3 MET 43 1HG MET 43 -1.045 -0.617 -2.769 315 HE1 MET 43 3HE MET 43 1.715 0.457 -1.767 316 HE2 MET 43 1HE MET 43 1.781 -0.782 -0.513 317 HE3 MET 43 2HE MET 43 0.226 -0.121 -1.020 318 H VAL 44 H VAL 44 -0.601 -1.111 1.359 319 HA VAL 44 HA VAL 44 -2.831 0.729 1.295 320 HB VAL 44 HB VAL 44 -0.481 0.647 3.188 321 HG11 VAL 44 1HG1 VAL 44 -1.786 2.094 4.617 322 HG12 VAL 44 2HG1 VAL 44 -3.122 2.076 3.467 323 HG13 VAL 44 3HG1 VAL 44 -1.597 2.849 3.033 324 HG21 VAL 44 3HG2 VAL 44 -1.744 -1.381 3.385 325 HG22 VAL 44 1HG2 VAL 44 -3.263 -0.489 3.432 326 HG23 VAL 44 2HG2 VAL 44 -2.116 -0.352 4.765 327 H ILE 45 H ILE 45 -2.610 2.098 -0.408 328 HA ILE 45 HA ILE 45 -0.158 3.737 -0.463 329 HB ILE 45 HB ILE 45 -2.023 3.286 -2.790 330 HG12 ILE 45 2HG1 ILE 45 0.704 2.054 -2.383 331 HG13 ILE 45 1HG1 ILE 45 -0.808 1.212 -2.018 332 HG21 ILE 45 1HG2 ILE 45 0.436 4.040 -3.749 333 HG22 ILE 45 2HG2 ILE 45 0.255 5.018 -2.293 334 HG23 ILE 45 3HG2 ILE 45 -0.968 5.089 -3.560 335 HD11 ILE 45 3HD1 ILE 45 -0.042 2.286 -4.724 336 HD12 ILE 45 1HD1 ILE 45 -1.475 1.335 -4.330 337 HD13 ILE 45 2HD1 ILE 45 0.127 0.608 -4.207 338 H ILE 46 H ILE 46 -0.585 5.567 0.571 339 HA ILE 46 HA ILE 46 -3.164 6.892 0.059 340 HB ILE 46 HB ILE 46 -1.371 7.447 2.409 341 HG12 ILE 46 2HG1 ILE 46 -3.798 5.672 2.523 342 HG13 ILE 46 1HG1 ILE 46 -2.194 5.014 2.215 343 HG21 ILE 46 1HG2 ILE 46 -4.320 7.917 2.006 344 HG22 ILE 46 2HG2 ILE 46 -3.065 9.136 1.785 345 HG23 ILE 46 3HG2 ILE 46 -3.343 8.437 3.380 346 HD11 ILE 46 3HD1 ILE 46 -1.947 6.684 4.456 347 HD12 ILE 46 1HD1 ILE 46 -1.869 4.923 4.398 348 HD13 ILE 46 2HD1 ILE 46 -3.409 5.728 4.696 349 H HIS 47 H HIS 47 -3.199 9.039 -0.528 350 HA HIS 47 HA HIS 47 -0.621 10.396 -0.823 351 HB2 HIS 47 2HB HIS 47 -1.363 11.186 -3.100 352 HB3 HIS 47 1HB HIS 47 -0.932 9.474 -2.991 353 HD1 HIS 47 1HD HIS 47 -3.202 11.372 -4.711 354 HD2 HIS 47 2HD HIS 47 -3.686 8.090 -2.204 355 HE1 HIS 47 1HE HIS 47 -5.417 10.371 -5.338 356 HE2 HIS 47 2HE HIS 47 -5.649 8.333 -3.873 357 H LYS 48 H LYS 48 -0.716 12.292 0.144 358 HA LYS 48 HA LYS 48 -3.254 13.797 0.007 359 HB2 LYS 48 2HB LYS 48 -1.571 13.139 2.360 360 HB3 LYS 48 1HB LYS 48 -2.265 14.752 2.306 361 HG2 LYS 48 2HG LYS 48 -4.490 13.836 2.148 362 HG3 LYS 48 1HG LYS 48 -3.841 12.198 2.062 363 HD2 LYS 48 2HD LYS 48 -2.717 12.838 4.334 364 HD3 LYS 48 1HD LYS 48 -3.979 14.068 4.387 365 HE2 LYS 48 2HE LYS 48 -4.837 12.194 5.543 366 HE3 LYS 48 1HE LYS 48 -5.638 12.212 3.974 367 HZ1 LYS 48 3HZ LYS 48 -3.849 10.597 3.258 368 HZ2 LYS 48 1HZ LYS 48 -5.009 10.002 4.335 369 HZ3 LYS 48 2HZ LYS 48 -3.470 10.423 4.896 370 H SER 49 H SER 49 -3.067 16.108 0.105 371 HA SER 49 HA SER 49 -2.216 18.089 -0.622 372 HB2 SER 49 2HB SER 49 -0.601 17.274 1.399 373 HB3 SER 49 1HB SER 49 0.575 17.429 0.095 374 HG SER 49 HG SER 49 -1.126 19.404 1.182 375 H TRP 50 H TRP 50 0.145 18.880 -1.758 376 HA TRP 50 HA TRP 50 -0.106 18.137 -4.410 377 HB2 TRP 50 2HB TRP 50 2.100 19.177 -4.764 378 HB3 TRP 50 1HB TRP 50 1.079 20.161 -3.706 379 HD1 TRP 50 HD TRP 50 1.657 19.880 -0.973 380 HE1 TRP 50 1HE TRP 50 3.961 19.642 0.147 381 HE3 TRP 50 3HE TRP 50 4.374 18.351 -5.024 382 HZ2 TRP 50 2HZ TRP 50 6.584 18.904 -0.589 383 HZ3 TRP 50 3HZ TRP 50 6.776 17.900 -4.732 384 HH2 TRP 50 HH TRP 50 7.857 18.172 -2.560 385 H CYS 51 H CYS 51 -0.193 15.945 -4.743 386 HA CYS 51 HA CYS 51 2.247 14.419 -4.123 387 HB2 CYS 51 2HB CYS 51 0.542 13.322 -2.984 388 HB3 CYS 51 1HB CYS 51 -0.651 13.665 -4.229 389 H GLY 52 H GLY 52 3.524 14.310 -5.874 390 HA2 GLY 52 2HA GLY 52 2.335 14.219 -8.545 391 HA3 GLY 52 1HA GLY 52 4.054 14.395 -8.175 392 H ALA 53 H ALA 53 3.882 12.152 -6.225 393 HA ALA 53 HA ALA 53 4.731 10.060 -7.869 394 HB1 ALA 53 1HB ALA 53 4.131 8.688 -5.695 395 HB2 ALA 53 2HB ALA 53 3.976 10.304 -5.007 396 HB3 ALA 53 3HB ALA 53 5.501 9.799 -5.733 397 H CYS 54 H CYS 54 1.592 11.117 -7.068 398 HA CYS 54 HA CYS 54 0.434 8.612 -8.046 399 HB2 CYS 54 2HB CYS 54 -1.707 9.503 -7.069 400 HB3 CYS 54 1HB CYS 54 -0.435 9.185 -5.880 401 H LYS 55 H LYS 55 0.742 12.028 -8.598 402 HA LYS 55 HA LYS 55 -1.313 12.490 -10.409 403 HB2 LYS 55 2HB LYS 55 0.352 14.146 -9.358 404 HB3 LYS 55 1HB LYS 55 1.416 13.725 -10.693 405 HG2 LYS 55 2HG LYS 55 -0.886 14.283 -12.018 406 HG3 LYS 55 1HG LYS 55 -0.989 15.401 -10.647 407 HD2 LYS 55 2HD LYS 55 1.642 15.257 -11.966 408 HD3 LYS 55 1HD LYS 55 0.339 15.921 -12.955 409 HE2 LYS 55 2HE LYS 55 0.019 17.724 -11.560 410 HE3 LYS 55 1HE LYS 55 0.671 16.887 -10.153 411 HZ1 LYS 55 3HZ LYS 55 2.269 17.855 -12.465 412 HZ2 LYS 55 1HZ LYS 55 2.881 17.097 -11.080 413 HZ3 LYS 55 2HZ LYS 55 2.161 18.623 -10.961 414 H ALA 56 H ALA 56 2.057 11.509 -11.100 415 HA ALA 56 HA ALA 56 1.738 11.281 -13.887 416 HB1 ALA 56 1HB ALA 56 3.855 11.123 -12.267 417 HB2 ALA 56 2HB ALA 56 3.861 10.478 -13.909 418 HB3 ALA 56 3HB ALA 56 3.586 9.401 -12.540 419 H LEU 57 H LEU 57 1.041 9.080 -11.266 420 HA LEU 57 HA LEU 57 0.720 6.713 -12.714 421 HB2 LEU 57 2HB LEU 57 -0.899 7.449 -10.292 422 HB3 LEU 57 1HB LEU 57 -0.379 5.855 -10.799 423 HG LEU 57 HG LEU 57 1.297 8.042 -9.597 424 HD11 LEU 57 1HD1 LEU 57 -0.083 6.390 -8.204 425 HD12 LEU 57 2HD1 LEU 57 1.625 6.579 -7.807 426 HD13 LEU 57 3HD1 LEU 57 1.085 5.181 -8.734 427 HD21 LEU 57 3HD2 LEU 57 2.123 5.645 -11.173 428 HD22 LEU 57 1HD2 LEU 57 3.130 6.219 -9.844 429 HD23 LEU 57 2HD2 LEU 57 2.770 7.286 -11.202 430 H LYS 58 H LYS 58 -1.442 9.449 -12.379 431 HA LYS 58 HA LYS 58 -3.875 8.288 -12.931 432 HB2 LYS 58 2HB LYS 58 -2.700 10.958 -13.403 433 HB3 LYS 58 1HB LYS 58 -4.123 10.571 -14.360 434 HG2 LYS 58 2HG LYS 58 -5.240 9.930 -12.177 435 HG3 LYS 58 1HG LYS 58 -3.871 10.700 -11.373 436 HD2 LYS 58 2HD LYS 58 -5.557 12.103 -13.435 437 HD3 LYS 58 1HD LYS 58 -5.921 12.143 -11.708 438 HE2 LYS 58 2HE LYS 58 -4.139 13.472 -11.222 439 HE3 LYS 58 1HE LYS 58 -3.157 12.822 -12.534 440 HZ1 LYS 58 3HZ LYS 58 -5.395 14.754 -12.803 441 HZ2 LYS 58 1HZ LYS 58 -4.546 14.076 -14.100 442 HZ3 LYS 58 2HZ LYS 58 -3.750 15.088 -13.004 443 HA PRO 59 HA PRO 59 -3.326 8.378 -17.667 444 HB2 PRO 59 2HB PRO 59 -1.237 9.599 -18.821 445 HB3 PRO 59 1HB PRO 59 -2.653 10.512 -18.257 446 HG2 PRO 59 2HG PRO 59 0.006 10.121 -16.923 447 HG3 PRO 59 1HG PRO 59 -0.946 11.605 -17.103 448 HD2 PRO 59 2HD PRO 59 -0.931 10.097 -14.822 449 HD3 PRO 59 1HD PRO 59 -2.318 11.091 -15.340 450 H LYS 60 H LYS 60 -0.524 7.818 -15.720 451 HA LYS 60 HA LYS 60 0.702 6.014 -17.636 452 HB2 LYS 60 2HB LYS 60 2.363 7.100 -16.434 453 HB3 LYS 60 1HB LYS 60 1.436 7.079 -14.943 454 HG2 LYS 60 2HG LYS 60 3.208 5.590 -14.599 455 HG3 LYS 60 1HG LYS 60 1.795 4.574 -14.894 456 HD2 LYS 60 2HD LYS 60 3.629 3.677 -16.147 457 HD3 LYS 60 1HD LYS 60 2.525 4.439 -17.293 458 HE2 LYS 60 2HE LYS 60 4.213 6.499 -16.627 459 HE3 LYS 60 1HE LYS 60 5.291 5.103 -16.619 460 HZ1 LYS 60 3HZ LYS 60 3.797 6.283 -18.846 461 HZ2 LYS 60 1HZ LYS 60 4.086 4.616 -18.872 462 HZ3 LYS 60 2HZ LYS 60 5.383 5.699 -18.804 463 H PHE 61 H PHE 61 -0.254 5.718 -14.237 464 HA PHE 61 HA PHE 61 -0.285 2.964 -14.128 465 HB2 PHE 61 2HB PHE 61 -0.464 4.667 -12.228 466 HB3 PHE 61 1HB PHE 61 -2.199 4.653 -12.556 467 HD1 PHE 61 1HD PHE 61 0.669 2.534 -11.592 468 HD2 PHE 61 2HD PHE 61 -3.566 2.901 -11.776 469 HE1 PHE 61 1HE PHE 61 0.439 0.505 -10.220 470 HE2 PHE 61 2HE PHE 61 -3.802 0.876 -10.401 471 HZ PHE 61 HZ PHE 61 -1.801 -0.325 -9.621 472 H ALA 62 H ALA 62 -2.480 5.069 -15.746 473 HA ALA 62 HA ALA 62 -4.805 3.515 -15.708 474 HB1 ALA 62 1HB ALA 62 -4.010 5.813 -16.983 475 HB2 ALA 62 2HB ALA 62 -5.543 4.982 -17.245 476 HB3 ALA 62 3HB ALA 62 -4.179 4.675 -18.321 477 H GLU 63 H GLU 63 -1.703 2.982 -16.993 478 HA GLU 63 HA GLU 63 -2.299 0.993 -18.971 479 HB2 GLU 63 2HB GLU 63 -0.173 2.564 -18.609 480 HB3 GLU 63 1HB GLU 63 0.369 1.192 -17.635 481 HG2 GLU 63 2HG GLU 63 1.269 0.694 -19.684 482 HG3 GLU 63 1HG GLU 63 -0.250 -0.199 -19.746 483 H SER 64 H SER 64 -2.241 1.104 -15.647 484 HA SER 64 HA SER 64 -1.169 -1.204 -14.729 485 HB2 SER 64 2HB SER 64 -2.032 0.423 -13.222 486 HB3 SER 64 1HB SER 64 -3.668 0.229 -13.848 487 HG SER 64 HG SER 64 -3.136 -0.899 -11.819 488 H THR 65 H THR 65 -3.512 -1.203 -17.109 489 HA THR 65 HA THR 65 -5.346 -3.127 -16.468 490 HB THR 65 HB THR 65 -4.658 -3.929 -18.994 491 HG1 THR 65 1HG THR 65 -3.435 -2.517 -19.918 492 HG21 THR 65 3HG2 THR 65 -6.762 -2.636 -17.952 493 HG22 THR 65 1HG2 THR 65 -6.517 -2.879 -19.682 494 HG23 THR 65 2HG2 THR 65 -6.064 -1.348 -18.935 495 H GLU 66 H GLU 66 -1.945 -3.524 -17.241 496 HA GLU 66 HA GLU 66 -2.027 -6.394 -17.040 497 HB2 GLU 66 2HB GLU 66 0.535 -6.093 -16.907 498 HB3 GLU 66 1HB GLU 66 -0.266 -5.677 -18.419 499 HG2 GLU 66 2HG GLU 66 -0.040 -3.476 -16.516 500 HG3 GLU 66 1HG GLU 66 1.500 -4.100 -17.106 501 H ILE 67 H ILE 67 -1.195 -3.634 -15.065 502 HA ILE 67 HA ILE 67 -0.156 -5.080 -12.869 503 HB ILE 67 HB ILE 67 -1.138 -2.304 -13.310 504 HG12 ILE 67 2HG1 ILE 67 1.429 -3.429 -12.197 505 HG13 ILE 67 1HG1 ILE 67 1.149 -3.034 -13.898 506 HG21 ILE 67 1HG2 ILE 67 -1.689 -3.399 -10.856 507 HG22 ILE 67 2HG2 ILE 67 -1.456 -1.690 -11.193 508 HG23 ILE 67 3HG2 ILE 67 -0.108 -2.661 -10.615 509 HD11 ILE 67 3HD1 ILE 67 0.511 -0.761 -12.290 510 HD12 ILE 67 1HD1 ILE 67 1.758 -0.940 -13.523 511 HD13 ILE 67 2HD1 ILE 67 2.109 -1.360 -11.846 512 H SER 68 H SER 68 -3.320 -4.841 -14.098 513 HA SER 68 HA SER 68 -4.771 -5.056 -11.662 514 HB2 SER 68 2HB SER 68 -5.413 -4.807 -14.374 515 HB3 SER 68 1HB SER 68 -6.084 -6.365 -13.895 516 HG SER 68 HG SER 68 -6.493 -3.968 -12.439 517 H GLU 69 H GLU 69 -3.027 -7.331 -13.629 518 HA GLU 69 HA GLU 69 -3.907 -9.498 -11.835 519 HB2 GLU 69 2HB GLU 69 -3.277 -10.988 -13.890 520 HB3 GLU 69 1HB GLU 69 -4.850 -10.207 -13.809 521 HG2 GLU 69 2HG GLU 69 -3.806 -8.327 -15.162 522 HG3 GLU 69 1HG GLU 69 -2.469 -9.435 -15.456 523 H LEU 70 H LEU 70 -1.280 -7.732 -13.072 524 HA LEU 70 HA LEU 70 0.651 -9.809 -12.363 525 HB2 LEU 70 2HB LEU 70 1.567 -9.061 -14.264 526 HB3 LEU 70 1HB LEU 70 0.558 -7.628 -14.276 527 HG LEU 70 HG LEU 70 3.054 -7.284 -14.365 528 HD11 LEU 70 1HD1 LEU 70 1.509 -5.498 -13.889 529 HD12 LEU 70 2HD1 LEU 70 2.983 -5.322 -12.929 530 HD13 LEU 70 3HD1 LEU 70 1.510 -5.927 -12.173 531 HD21 LEU 70 3HD2 LEU 70 3.110 -8.950 -12.173 532 HD22 LEU 70 1HD2 LEU 70 3.370 -7.348 -11.484 533 HD23 LEU 70 2HD2 LEU 70 4.434 -7.942 -12.758 534 H SER 71 H SER 71 -0.679 -6.820 -11.294 535 HA SER 71 HA SER 71 1.327 -6.518 -9.180 536 HB2 SER 71 2HB SER 71 0.339 -4.585 -10.658 537 HB3 SER 71 1HB SER 71 -0.986 -4.671 -9.496 538 HG SER 71 HG SER 71 0.587 -4.376 -7.837 539 H HIS 72 H HIS 72 -1.681 -7.906 -9.710 540 HA HIS 72 HA HIS 72 -3.234 -7.485 -7.508 541 HB2 HIS 72 2HB HIS 72 -4.185 -9.689 -7.865 542 HB3 HIS 72 1HB HIS 72 -3.848 -8.937 -9.430 543 HD1 HIS 72 1HD HIS 72 -4.108 -12.031 -9.009 544 HD2 HIS 72 2HD HIS 72 -0.534 -9.918 -9.152 545 HE1 HIS 72 1HE HIS 72 -2.361 -13.711 -9.680 546 HE2 HIS 72 2HE HIS 72 -0.191 -12.432 -9.656 547 H ASN 73 H ASN 73 -0.138 -8.752 -7.595 548 HA ASN 73 HA ASN 73 0.270 -10.624 -5.769 549 HB2 ASN 73 2HB ASN 73 1.785 -8.014 -5.718 550 HB3 ASN 73 1HB ASN 73 2.367 -9.619 -5.293 551 HD21 ASN 73 1HD2 ASN 73 2.438 -7.329 -7.609 552 HD22 ASN 73 2HD2 ASN 73 2.814 -8.322 -8.991 553 H PHE 74 H PHE 74 -0.881 -7.405 -5.001 554 HA PHE 74 HA PHE 74 -1.191 -8.209 -2.211 555 HB2 PHE 74 2HB PHE 74 -1.131 -5.401 -2.257 556 HB3 PHE 74 1HB PHE 74 0.086 -6.495 -1.608 557 HD1 PHE 74 1HD PHE 74 1.996 -7.209 -3.050 558 HD2 PHE 74 2HD PHE 74 -0.702 -4.114 -4.177 559 HE1 PHE 74 1HE PHE 74 3.635 -6.377 -4.677 560 HE2 PHE 74 2HE PHE 74 0.938 -3.279 -5.809 561 HZ PHE 74 HZ PHE 74 3.109 -4.410 -6.054 562 H VAL 75 H VAL 75 -2.770 -5.847 -1.494 563 HA VAL 75 HA VAL 75 -4.996 -6.053 -3.385 564 HB VAL 75 HB VAL 75 -5.198 -7.827 -1.599 565 HG11 VAL 75 1HG1 VAL 75 -4.508 -6.263 0.257 566 HG12 VAL 75 2HG1 VAL 75 -5.931 -7.256 0.572 567 HG13 VAL 75 3HG1 VAL 75 -6.117 -5.555 0.142 568 HG21 VAL 75 3HG2 VAL 75 -7.395 -7.850 -2.033 569 HG22 VAL 75 1HG2 VAL 75 -7.074 -6.401 -2.982 570 HG23 VAL 75 2HG2 VAL 75 -7.649 -6.259 -1.322 571 H MET 76 H MET 76 -6.519 -4.568 -3.381 572 HA MET 76 HA MET 76 -6.233 -1.992 -3.298 573 HB2 MET 76 2HB MET 76 -8.727 -1.938 -2.881 574 HB3 MET 76 1HB MET 76 -8.167 -2.944 -4.199 575 HG2 MET 76 2HG MET 76 -8.182 -4.484 -1.802 576 HG3 MET 76 1HG MET 76 -9.730 -3.670 -1.962 577 HE1 MET 76 3HE MET 76 -7.341 -4.574 -4.643 578 HE2 MET 76 1HE MET 76 -8.479 -5.103 -5.874 579 HE3 MET 76 2HE MET 76 -7.615 -6.291 -4.902 580 H VAL 77 H VAL 77 -5.233 -0.820 -1.599 581 HA VAL 77 HA VAL 77 -7.005 -0.208 0.597 582 HB VAL 77 HB VAL 77 -4.562 -0.370 1.959 583 HG11 VAL 77 1HG1 VAL 77 -6.512 -2.538 2.377 584 HG12 VAL 77 2HG1 VAL 77 -7.132 -0.890 2.491 585 HG13 VAL 77 3HG1 VAL 77 -5.798 -1.405 3.526 586 HG21 VAL 77 3HG2 VAL 77 -5.079 -3.114 0.973 587 HG22 VAL 77 1HG2 VAL 77 -3.598 -2.394 1.607 588 HG23 VAL 77 2HG2 VAL 77 -4.128 -2.024 -0.030 589 H ASN 78 H ASN 78 -6.307 1.387 -1.530 590 HA ASN 78 HA ASN 78 -4.276 3.225 -0.531 591 HB2 ASN 78 2HB ASN 78 -3.797 3.272 -2.722 592 HB3 ASN 78 1HB ASN 78 -5.325 2.538 -3.151 593 HD21 ASN 78 1HD2 ASN 78 -4.571 5.659 -1.642 594 HD22 ASN 78 2HD2 ASN 78 -5.349 6.625 -2.855 595 H LEU 79 H LEU 79 -4.822 4.831 0.709 596 HA LEU 79 HA LEU 79 -7.598 5.792 0.693 597 HB2 LEU 79 2HB LEU 79 -5.526 6.498 2.747 598 HB3 LEU 79 1HB LEU 79 -7.270 6.570 2.892 599 HG LEU 79 HG LEU 79 -6.040 3.901 2.441 600 HD11 LEU 79 1HD1 LEU 79 -4.617 4.223 4.153 601 HD12 LEU 79 2HD1 LEU 79 -6.060 3.990 5.139 602 HD13 LEU 79 3HD1 LEU 79 -5.501 5.620 4.763 603 HD21 LEU 79 3HD2 LEU 79 -7.893 3.142 3.705 604 HD22 LEU 79 1HD2 LEU 79 -8.510 4.369 2.599 605 HD23 LEU 79 2HD2 LEU 79 -8.243 4.768 4.296 606 H GLU 80 H GLU 80 -7.772 8.205 1.331 607 HA GLU 80 HA GLU 80 -5.703 9.843 0.085 608 HB2 GLU 80 2HB GLU 80 -7.836 9.074 -1.428 609 HB3 GLU 80 1HB GLU 80 -8.437 10.586 -0.738 610 HG2 GLU 80 2HG GLU 80 -5.764 10.988 -1.648 611 HG3 GLU 80 1HG GLU 80 -6.703 10.217 -2.937 612 H ASP 81 H ASP 81 -6.928 12.263 0.061 613 HA ASP 81 HA ASP 81 -6.753 13.134 2.691 614 HB2 ASP 81 2HB ASP 81 -6.734 14.440 0.412 615 HB3 ASP 81 1HB ASP 81 -8.455 14.626 0.732 616 H GLU 82 H GLU 82 -9.495 11.920 0.909 617 HA GLU 82 HA GLU 82 -11.564 12.872 2.542 618 HB2 GLU 82 2HB GLU 82 -11.257 10.949 0.404 619 HB3 GLU 82 1HB GLU 82 -12.368 10.348 1.627 620 HG2 GLU 82 2HG GLU 82 -12.658 13.120 0.555 621 HG3 GLU 82 1HG GLU 82 -13.276 11.738 -0.349 622 H GLU 83 H GLU 83 -9.589 9.945 2.759 623 HA GLU 83 HA GLU 83 -10.998 8.952 5.059 624 HB2 GLU 83 2HB GLU 83 -8.624 8.094 3.469 625 HB3 GLU 83 1HB GLU 83 -8.817 7.450 5.094 626 HG2 GLU 83 2HG GLU 83 -10.932 7.291 2.960 627 HG3 GLU 83 1HG GLU 83 -9.751 6.016 3.289 628 H GLU 84 H GLU 84 -7.531 9.687 4.709 629 HA GLU 84 HA GLU 84 -6.030 10.665 6.107 630 HB2 GLU 84 2HB GLU 84 -7.643 12.565 5.985 631 HB3 GLU 84 1HB GLU 84 -8.440 11.934 7.420 632 HG2 GLU 84 2HG GLU 84 -6.426 12.271 8.722 633 HG3 GLU 84 1HG GLU 84 -5.567 12.823 7.285 634 HA PRO 85 HA PRO 85 -6.761 7.448 9.311 635 HB2 PRO 85 2HB PRO 85 -4.262 6.425 9.239 636 HB3 PRO 85 1HB PRO 85 -5.506 5.972 8.057 637 HG2 PRO 85 2HG PRO 85 -3.275 7.963 7.796 638 HG3 PRO 85 1HG PRO 85 -3.815 6.726 6.635 639 HD2 PRO 85 2HD PRO 85 -4.525 9.337 6.433 640 HD3 PRO 85 1HD PRO 85 -5.588 8.008 5.906 641 H LYS 86 H LYS 86 -4.842 6.839 11.082 642 HA LYS 86 HA LYS 86 -3.568 9.267 12.044 643 HB2 LYS 86 2HB LYS 86 -6.086 8.804 12.926 644 HB3 LYS 86 1HB LYS 86 -5.160 7.890 14.124 645 HG2 LYS 86 2HG LYS 86 -4.984 9.824 15.211 646 HG3 LYS 86 1HG LYS 86 -3.788 10.259 13.989 647 HD2 LYS 86 2HD LYS 86 -6.141 10.870 12.735 648 HD3 LYS 86 1HD LYS 86 -6.504 11.269 14.415 649 HE2 LYS 86 2HE LYS 86 -5.594 13.251 13.774 650 HE3 LYS 86 1HE LYS 86 -4.118 12.418 14.257 651 HZ1 LYS 86 3HZ LYS 86 -3.488 12.085 12.084 652 HZ2 LYS 86 1HZ LYS 86 -4.221 13.608 11.984 653 HZ3 LYS 86 2HZ LYS 86 -5.060 12.230 11.475 654 H ASP 87 H ASP 87 -1.984 7.487 11.210 655 HA ASP 87 HA ASP 87 -0.602 6.491 13.471 656 HB2 ASP 87 2HB ASP 87 -2.629 4.801 12.705 657 HB3 ASP 87 1HB ASP 87 -1.243 4.143 11.821 658 H GLU 88 H GLU 88 0.854 4.418 12.226 659 HA GLU 88 HA GLU 88 2.579 5.982 10.538 660 HB2 GLU 88 2HB GLU 88 2.699 3.161 11.586 661 HB3 GLU 88 1HB GLU 88 3.896 3.792 10.464 662 HG2 GLU 88 2HG GLU 88 3.274 4.902 13.191 663 HG3 GLU 88 1HG GLU 88 4.674 3.921 12.762 664 H ASP 89 H ASP 89 -0.068 3.930 10.002 665 HA ASP 89 HA ASP 89 0.564 2.610 7.652 666 HB2 ASP 89 2HB ASP 89 -1.839 3.278 9.121 667 HB3 ASP 89 1HB ASP 89 -2.122 3.344 7.376 668 H PHE 90 H PHE 90 0.306 5.986 8.102 669 HA PHE 90 HA PHE 90 -0.160 6.407 5.233 670 HB2 PHE 90 2HB PHE 90 -1.057 8.474 5.695 671 HB3 PHE 90 1HB PHE 90 -1.478 7.615 7.181 672 HD1 PHE 90 2HD PHE 90 0.906 7.677 8.769 673 HD2 PHE 90 1HD PHE 90 -0.652 10.674 6.190 674 HE1 PHE 90 2HE PHE 90 2.055 9.400 10.090 675 HE2 PHE 90 1HE PHE 90 0.493 12.407 7.505 676 HZ PHE 90 HZ PHE 90 1.849 11.772 9.459 677 H SER 91 H SER 91 2.201 6.740 7.749 678 HA SER 91 HA SER 91 4.298 7.180 5.870 679 HB2 SER 91 2HB SER 91 3.724 9.430 7.816 680 HB3 SER 91 1HB SER 91 5.048 9.361 6.642 681 HG SER 91 HG SER 91 3.254 9.168 5.040 682 HA PRO 92 HA PRO 92 5.910 5.301 9.660 683 HB2 PRO 92 2HB PRO 92 7.229 3.275 8.402 684 HB3 PRO 92 1HB PRO 92 5.498 3.234 8.780 685 HG2 PRO 92 2HG PRO 92 6.798 3.428 6.189 686 HG3 PRO 92 1HG PRO 92 5.092 3.150 6.557 687 HD2 PRO 92 2HD PRO 92 6.448 5.634 5.801 688 HD3 PRO 92 1HD PRO 92 4.713 5.264 5.823 689 H ASP 93 H ASP 93 8.153 4.801 6.947 690 HA ASP 93 HA ASP 93 10.467 5.282 8.398 691 HB2 ASP 93 2HB ASP 93 11.595 5.514 6.207 692 HB3 ASP 93 1HB ASP 93 10.503 4.123 6.258 693 H GLY 94 H GLY 94 8.750 7.552 6.231 694 HA2 GLY 94 2HA GLY 94 10.410 9.710 7.363 695 HA3 GLY 94 1HA GLY 94 9.585 9.774 5.802 696 H GLY 95 H GLY 95 8.917 11.891 6.721 697 HA2 GLY 95 2HA GLY 95 6.555 11.570 8.470 698 HA3 GLY 95 1HA GLY 95 7.580 13.008 8.462 699 H TYR 96 H TYR 96 7.262 11.948 5.316 700 HA TYR 96 HA TYR 96 5.893 14.161 4.387 701 HB2 TYR 96 2HB TYR 96 5.423 12.754 2.334 702 HB3 TYR 96 1HB TYR 96 7.119 12.850 2.825 703 HD1 TYR 96 2HD TYR 96 5.354 10.719 5.047 704 HD2 TYR 96 1HD TYR 96 7.099 10.822 1.167 705 HE1 TYR 96 2HE TYR 96 5.490 8.274 5.045 706 HE2 TYR 96 1HE TYR 96 7.228 8.368 1.158 707 HH TYR 96 HH TYR 96 6.610 6.489 3.993 708 H ILE 97 H ILE 97 3.738 13.794 2.975 709 HA ILE 97 HA ILE 97 1.808 12.184 4.377 710 HB ILE 97 HB ILE 97 0.307 13.959 5.020 711 HG12 ILE 97 2HG1 ILE 97 0.487 15.768 3.609 712 HG13 ILE 97 1HG1 ILE 97 1.402 16.333 5.001 713 HG21 ILE 97 1HG2 ILE 97 1.546 14.900 6.849 714 HG22 ILE 97 2HG2 ILE 97 3.073 14.569 6.030 715 HG23 ILE 97 3HG2 ILE 97 2.061 13.235 6.585 716 HD11 ILE 97 3HD1 ILE 97 3.487 15.659 3.851 717 HD12 ILE 97 1HD1 ILE 97 2.584 16.923 3.017 718 HD13 ILE 97 2HD1 ILE 97 2.523 15.262 2.428 719 HA PRO 98 HA PRO 98 1.318 10.354 3.377 720 HB2 PRO 98 2HB PRO 98 -1.216 9.878 1.755 721 HB3 PRO 98 1HB PRO 98 -0.618 8.966 3.168 722 HG2 PRO 98 2HG PRO 98 -2.072 11.437 3.105 723 HG3 PRO 98 1HG PRO 98 -1.554 10.472 4.518 724 HD2 PRO 98 2HD PRO 98 -0.388 12.724 4.218 725 HD3 PRO 98 1HD PRO 98 0.666 11.310 4.394 726 H ARG 99 H ARG 99 2.189 8.494 2.335 727 HA ARG 99 HA ARG 99 2.450 8.747 -0.593 728 HB2 ARG 99 2HB ARG 99 4.473 8.517 1.522 729 HB3 ARG 99 1HB ARG 99 4.719 7.418 0.161 730 HG2 ARG 99 2HG ARG 99 5.926 9.474 -0.168 731 HG3 ARG 99 1HG ARG 99 4.654 9.320 -1.374 732 HD2 ARG 99 2HD ARG 99 3.625 10.690 0.909 733 HD3 ARG 99 1HD ARG 99 5.136 11.453 0.419 734 HE ARG 99 HE ARG 99 3.375 10.960 -1.785 735 HH11 ARG 99 1HH1 ARG 99 4.093 13.169 0.822 736 HH12 ARG 99 2HH1 ARG 99 3.391 14.536 0.024 737 HH21 ARG 99 1HH2 ARG 99 2.456 12.758 -2.837 738 HH22 ARG 99 2HH2 ARG 99 2.461 14.303 -2.053 739 H ILE 100 H ILE 100 3.769 6.444 -1.198 740 HA ILE 100 HA ILE 100 1.690 4.473 -0.911 741 HB ILE 100 HB ILE 100 4.425 4.245 -2.185 742 HG12 ILE 100 2HG1 ILE 100 2.377 4.189 -4.120 743 HG13 ILE 100 1HG1 ILE 100 1.975 5.515 -3.032 744 HG21 ILE 100 1HG2 ILE 100 2.572 2.228 -1.518 745 HG22 ILE 100 2HG2 ILE 100 4.041 2.086 -2.481 746 HG23 ILE 100 3HG2 ILE 100 2.503 2.437 -3.268 747 HD11 ILE 100 3HD1 ILE 100 3.679 6.780 -3.746 748 HD12 ILE 100 1HD1 ILE 100 3.607 5.730 -5.162 749 HD13 ILE 100 2HD1 ILE 100 4.778 5.408 -3.886 750 H LEU 101 H LEU 101 1.690 2.662 0.386 751 HA LEU 101 HA LEU 101 4.076 2.116 2.008 752 HB2 LEU 101 2HB LEU 101 1.398 2.991 2.910 753 HB3 LEU 101 1HB LEU 101 2.159 1.721 3.842 754 HG LEU 101 HG LEU 101 4.113 3.188 4.207 755 HD11 LEU 101 1HD1 LEU 101 4.375 4.823 2.703 756 HD12 LEU 101 2HD1 LEU 101 3.268 5.725 3.735 757 HD13 LEU 101 3HD1 LEU 101 2.655 4.878 2.315 758 HD21 LEU 101 3HD2 LEU 101 3.166 4.122 6.031 759 HD22 LEU 101 1HD2 LEU 101 1.771 3.170 5.529 760 HD23 LEU 101 2HD2 LEU 101 1.871 4.875 5.100 761 H PHE 102 H PHE 102 4.605 -0.006 1.803 762 HA PHE 102 HA PHE 102 2.478 -1.909 1.114 763 HB2 PHE 102 2HB PHE 102 5.479 -2.010 1.042 764 HB3 PHE 102 1HB PHE 102 4.533 -3.487 0.950 765 HD1 PHE 102 1HD PHE 102 4.502 -0.094 -0.619 766 HD2 PHE 102 2HD PHE 102 4.205 -4.304 -1.157 767 HE1 PHE 102 1HE PHE 102 4.261 0.236 -3.045 768 HE2 PHE 102 2HE PHE 102 3.963 -3.982 -3.584 769 HZ PHE 102 HZ PHE 102 3.992 -1.709 -4.531 770 H LEU 103 H LEU 103 2.141 -3.857 2.360 771 HA LEU 103 HA LEU 103 3.512 -4.176 4.868 772 HB2 LEU 103 2HB LEU 103 1.054 -4.106 5.966 773 HB3 LEU 103 1HB LEU 103 2.193 -2.784 5.994 774 HG LEU 103 HG LEU 103 1.089 -1.729 4.105 775 HD11 LEU 103 1HD1 LEU 103 -1.218 -3.545 4.140 776 HD12 LEU 103 2HD1 LEU 103 0.248 -4.205 3.416 777 HD13 LEU 103 3HD1 LEU 103 -0.448 -2.712 2.792 778 HD21 LEU 103 3HD2 LEU 103 -0.095 -2.190 6.673 779 HD22 LEU 103 1HD2 LEU 103 -1.357 -2.000 5.458 780 HD23 LEU 103 2HD2 LEU 103 -0.139 -0.743 5.667 781 H ASP 104 H ASP 104 2.184 -5.809 6.300 782 HA ASP 104 HA ASP 104 1.941 -8.186 4.694 783 HB2 ASP 104 2HB ASP 104 1.832 -7.618 7.649 784 HB3 ASP 104 1HB ASP 104 1.402 -9.210 7.007 785 HA PRO 105 HA PRO 105 -2.385 -8.559 4.062 786 HB2 PRO 105 2HB PRO 105 -2.841 -11.134 5.021 787 HB3 PRO 105 1HB PRO 105 -2.302 -10.720 3.385 788 HG2 PRO 105 2HG PRO 105 -0.720 -11.662 5.729 789 HG3 PRO 105 1HG PRO 105 -0.498 -12.008 3.999 790 HD2 PRO 105 2HD PRO 105 1.076 -10.269 5.333 791 HD3 PRO 105 1HD PRO 105 0.647 -10.036 3.628 792 H SER 106 H SER 106 -3.160 -7.076 5.530 793 HA SER 106 HA SER 106 -5.083 -7.633 7.277 794 HB2 SER 106 2HB SER 106 -3.840 -7.387 9.567 795 HB3 SER 106 1HB SER 106 -3.900 -8.976 8.786 796 HG SER 106 HG SER 106 -1.755 -7.381 9.330 797 H GLY 107 H GLY 107 -2.302 -5.711 6.575 798 HA2 GLY 107 2HA GLY 107 -2.585 -3.359 6.139 799 HA3 GLY 107 1HA GLY 107 -3.788 -3.317 7.434 800 H LYS 108 H LYS 108 -0.598 -4.860 7.485 801 HA LYS 108 HA LYS 108 0.063 -3.143 9.788 802 HB2 LYS 108 2HB LYS 108 0.714 -5.940 9.035 803 HB3 LYS 108 1HB LYS 108 1.950 -5.044 9.909 804 HG2 LYS 108 2HG LYS 108 -0.711 -4.780 11.076 805 HG3 LYS 108 1HG LYS 108 -0.110 -6.447 11.038 806 HD2 LYS 108 2HD LYS 108 1.939 -5.733 12.164 807 HD3 LYS 108 1HD LYS 108 1.354 -4.069 12.187 808 HE2 LYS 108 2HE LYS 108 -0.353 -6.196 13.375 809 HE3 LYS 108 1HE LYS 108 1.067 -5.659 14.271 810 HZ1 LYS 108 3HZ LYS 108 -1.246 -4.489 14.554 811 HZ2 LYS 108 1HZ LYS 108 -0.738 -3.621 13.193 812 HZ3 LYS 108 2HZ LYS 108 0.192 -3.600 14.606 813 H VAL 109 H VAL 109 0.809 -1.340 8.602 814 HA VAL 109 HA VAL 109 2.690 -1.382 6.534 815 HB VAL 109 HB VAL 109 1.307 0.602 7.576 816 HG11 VAL 109 1HG1 VAL 109 4.006 1.042 8.847 817 HG12 VAL 109 2HG1 VAL 109 2.557 0.549 9.728 818 HG13 VAL 109 3HG1 VAL 109 2.606 2.114 8.917 819 HG21 VAL 109 3HG2 VAL 109 3.765 0.476 5.975 820 HG22 VAL 109 1HG2 VAL 109 3.368 2.065 6.624 821 HG23 VAL 109 2HG2 VAL 109 2.205 1.209 5.613 822 H HIS 110 H HIS 110 4.743 -1.678 6.376 823 HA HIS 110 HA HIS 110 6.372 -1.667 8.821 824 HB2 HIS 110 2HB HIS 110 5.969 -3.843 6.863 825 HB3 HIS 110 1HB HIS 110 7.649 -3.524 7.286 826 HD1 HIS 110 1HD HIS 110 7.597 -3.066 10.219 827 HD2 HIS 110 2HD HIS 110 5.189 -5.919 8.397 828 HE1 HIS 110 1HE HIS 110 7.017 -4.710 12.031 829 HE2 HIS 110 2HE HIS 110 5.627 -6.472 10.884 830 HA PRO 111 HA PRO 111 8.655 1.194 6.265 831 HB2 PRO 111 2HB PRO 111 10.818 1.464 7.904 832 HB3 PRO 111 1HB PRO 111 9.280 2.288 8.182 833 HG2 PRO 111 2HG PRO 111 10.354 -0.194 9.450 834 HG3 PRO 111 1HG PRO 111 9.467 1.148 10.190 835 HD2 PRO 111 2HD PRO 111 8.299 -1.216 9.556 836 HD3 PRO 111 1HD PRO 111 7.424 0.332 9.511 837 H GLU 112 H GLU 112 8.759 -1.550 5.565 838 HA GLU 112 HA GLU 112 11.633 -1.866 4.964 839 HB2 GLU 112 2HB GLU 112 9.545 -3.997 5.431 840 HB3 GLU 112 1HB GLU 112 11.165 -4.320 4.826 841 HG2 GLU 112 2HG GLU 112 11.865 -4.490 6.913 842 HG3 GLU 112 1HG GLU 112 11.504 -2.780 7.141 843 H ILE 113 H ILE 113 8.359 -2.593 3.742 844 HA ILE 113 HA ILE 113 9.437 -2.967 1.069 845 HB ILE 113 HB ILE 113 6.565 -3.135 1.973 846 HG12 ILE 113 2HG1 ILE 113 7.860 -4.795 3.156 847 HG13 ILE 113 1HG1 ILE 113 6.949 -5.602 1.871 848 HG21 ILE 113 1HG2 ILE 113 6.985 -2.735 -0.466 849 HG22 ILE 113 2HG2 ILE 113 6.135 -4.237 -0.102 850 HG23 ILE 113 3HG2 ILE 113 7.851 -4.270 -0.504 851 HD11 ILE 113 3HD1 ILE 113 8.855 -6.532 1.242 852 HD12 ILE 113 1HD1 ILE 113 9.786 -5.511 2.338 853 HD13 ILE 113 2HD1 ILE 113 9.393 -4.936 0.718 854 H ILE 114 H ILE 114 10.032 -1.097 0.210 855 HA ILE 114 HA ILE 114 8.000 1.017 -0.103 856 HB ILE 114 HB ILE 114 9.793 2.675 -0.115 857 HG12 ILE 114 2HG1 ILE 114 11.542 0.962 -0.902 858 HG13 ILE 114 1HG1 ILE 114 12.068 2.178 0.254 859 HG21 ILE 114 1HG2 ILE 114 9.216 2.823 2.019 860 HG22 ILE 114 2HG2 ILE 114 10.622 1.830 2.392 861 HG23 ILE 114 3HG2 ILE 114 9.043 1.075 2.171 862 HD11 ILE 114 3HD1 ILE 114 12.694 0.614 1.687 863 HD12 ILE 114 1HD1 ILE 114 12.347 -0.585 0.443 864 HD13 ILE 114 2HD1 ILE 114 11.109 -0.157 1.623 865 H ASN 115 H ASN 115 9.301 2.622 -1.900 866 HA ASN 115 HA ASN 115 8.852 1.353 -4.357 867 HB2 ASN 115 2HB ASN 115 8.703 3.766 -4.156 868 HB3 ASN 115 1HB ASN 115 10.409 3.866 -3.698 869 HD21 ASN 115 1HD2 ASN 115 9.861 5.466 -5.637 870 HD22 ASN 115 2HD2 ASN 115 10.336 4.844 -7.194 871 H GLU 116 H GLU 116 11.807 1.962 -2.545 872 HA GLU 116 HA GLU 116 13.865 0.992 -2.620 873 HB2 GLU 116 2HB GLU 116 12.174 -1.023 -3.476 874 HB3 GLU 116 1HB GLU 116 13.378 -0.932 -4.769 875 HG2 GLU 116 2HG GLU 116 14.061 -1.189 -1.849 876 HG3 GLU 116 1HG GLU 116 13.898 -2.556 -2.950 877 H ASN 117 H ASN 117 12.648 0.710 -5.964 878 HA ASN 117 HA ASN 117 15.094 1.526 -7.127 879 HB2 ASN 117 2HB ASN 117 13.352 0.163 -8.282 880 HB3 ASN 117 1HB ASN 117 12.338 1.611 -8.374 881 HD21 ASN 117 1HD2 ASN 117 12.720 3.101 -9.915 882 HD22 ASN 117 2HD2 ASN 117 13.960 2.952 -11.133 883 H GLY 118 H GLY 118 12.602 3.308 -5.633 884 HA2 GLY 118 2HA GLY 118 12.729 5.697 -7.158 885 HA3 GLY 118 1HA GLY 118 12.140 5.555 -5.499 886 H ASN 119 H ASN 119 13.113 7.499 -4.892 887 HA ASN 119 HA ASN 119 15.990 7.776 -5.133 888 HB2 ASN 119 2HB ASN 119 15.458 9.904 -3.701 889 HB3 ASN 119 1HB ASN 119 15.006 9.855 -5.412 890 HD21 ASN 119 1HD2 ASN 119 13.541 11.561 -4.743 891 HD22 ASN 119 2HD2 ASN 119 11.985 11.126 -4.086 892 HA PRO 120 HA PRO 120 16.887 6.083 -1.159 893 HB2 PRO 120 2HB PRO 120 19.322 7.126 -0.706 894 HB3 PRO 120 1HB PRO 120 19.038 5.927 -1.984 895 HG2 PRO 120 2HG PRO 120 19.288 8.908 -2.195 896 HG3 PRO 120 1HG PRO 120 19.984 7.645 -3.237 897 HD2 PRO 120 2HD PRO 120 17.714 9.050 -3.856 898 HD3 PRO 120 1HD PRO 120 18.048 7.403 -4.441 899 H SER 121 H SER 121 15.039 8.038 -0.745 900 HA SER 121 HA SER 121 15.759 9.014 1.836 901 HB2 SER 121 2HB SER 121 15.609 10.982 -0.457 902 HB3 SER 121 1HB SER 121 15.322 11.462 1.223 903 HG SER 121 HG SER 121 17.407 11.612 1.353 904 H TYR 122 H TYR 122 13.685 9.204 -0.952 905 HA TYR 122 HA TYR 122 11.337 9.785 0.656 906 HB2 TYR 122 2HB TYR 122 12.223 10.324 -1.983 907 HB3 TYR 122 1HB TYR 122 10.768 9.337 -2.102 908 HD1 TYR 122 2HD TYR 122 8.767 10.175 -0.541 909 HD2 TYR 122 1HD TYR 122 12.021 12.593 -1.828 910 HE1 TYR 122 2HE TYR 122 7.423 12.195 -0.134 911 HE2 TYR 122 1HE TYR 122 10.692 14.616 -1.418 912 HH TYR 122 HH TYR 122 8.406 15.307 -1.206 913 H LYS 123 H LYS 123 12.625 7.295 -1.491 914 HA LYS 123 HA LYS 123 12.017 5.143 -1.917 915 HB2 LYS 123 2HB LYS 123 11.626 5.476 1.030 916 HB3 LYS 123 1HB LYS 123 11.192 3.952 0.274 917 HG2 LYS 123 2HG LYS 123 13.903 5.263 0.307 918 HG3 LYS 123 1HG LYS 123 13.412 3.779 1.144 919 HD2 LYS 123 2HD LYS 123 14.082 2.621 -0.633 920 HD3 LYS 123 1HD LYS 123 12.791 3.386 -1.569 921 HE2 LYS 123 2HE LYS 123 14.215 4.768 -2.636 922 HE3 LYS 123 1HE LYS 123 15.196 5.031 -1.196 923 HZ1 LYS 123 3HZ LYS 123 15.573 3.171 -3.350 924 HZ2 LYS 123 1HZ LYS 123 15.703 2.445 -1.826 925 HZ3 LYS 123 2HZ LYS 123 16.690 3.759 -2.225 926 H TYR 124 H TYR 124 9.531 5.283 0.531 927 HA TYR 124 HA TYR 124 7.518 4.088 -0.774 928 HB2 TYR 124 2HB TYR 124 7.478 6.288 1.258 929 HB3 TYR 124 1HB TYR 124 5.969 5.597 0.644 930 HD1 TYR 124 2HD TYR 124 6.167 2.844 0.568 931 HD2 TYR 124 1HD TYR 124 8.145 5.451 3.276 932 HE1 TYR 124 2HE TYR 124 6.341 1.015 2.192 933 HE2 TYR 124 1HE TYR 124 8.335 3.625 4.906 934 HH TYR 124 HH TYR 124 7.696 0.371 4.100 935 H PHE 125 H PHE 125 8.610 7.314 -1.482 936 HA PHE 125 HA PHE 125 6.192 7.933 -2.983 937 HB2 PHE 125 2HB PHE 125 7.195 9.736 -1.692 938 HB3 PHE 125 1HB PHE 125 8.734 9.516 -2.539 939 HD1 PHE 125 2HD PHE 125 8.895 10.087 -4.949 940 HD2 PHE 125 1HD PHE 125 5.459 11.035 -2.623 941 HE1 PHE 125 2HE PHE 125 8.196 11.718 -6.653 942 HE2 PHE 125 1HE PHE 125 4.752 12.667 -4.324 943 HZ PHE 125 HZ PHE 125 6.123 13.010 -6.342 944 H TYR 126 H TYR 126 5.957 7.457 -5.073 945 HA TYR 126 HA TYR 126 8.323 7.375 -6.781 946 HB2 TYR 126 2HB TYR 126 7.712 5.274 -7.806 947 HB3 TYR 126 1HB TYR 126 7.886 5.048 -6.064 948 HD1 TYR 126 1HD TYR 126 5.206 5.806 -8.577 949 HD2 TYR 126 2HD TYR 126 6.297 3.789 -4.992 950 HE1 TYR 126 1HE TYR 126 2.988 4.751 -8.501 951 HE2 TYR 126 2HE TYR 126 4.080 2.731 -4.906 952 HH TYR 126 HH TYR 126 2.224 2.227 -6.229 953 H VAL 127 H VAL 127 8.030 8.158 -8.788 954 HA VAL 127 HA VAL 127 5.294 9.011 -9.492 955 HB VAL 127 HB VAL 127 6.294 10.878 -10.722 956 HG11 VAL 127 1HG1 VAL 127 6.679 10.502 -7.822 957 HG12 VAL 127 2HG1 VAL 127 5.774 11.736 -8.699 958 HG13 VAL 127 3HG1 VAL 127 7.526 11.867 -8.550 959 HG21 VAL 127 3HG2 VAL 127 8.476 11.085 -11.180 960 HG22 VAL 127 1HG2 VAL 127 8.593 9.384 -10.725 961 HG23 VAL 127 2HG2 VAL 127 8.955 10.641 -9.541 962 H SER 128 H SER 128 5.537 6.604 -10.365 963 HA SER 128 HA SER 128 5.224 6.595 -13.077 964 HB2 SER 128 2HB SER 128 7.670 7.290 -13.123 965 HB3 SER 128 1HB SER 128 8.050 5.675 -12.507 966 HG SER 128 HG SER 128 6.607 5.077 -14.461 967 H ALA 129 H ALA 129 4.755 4.574 -13.925 968 HA ALA 129 HA ALA 129 4.150 2.526 -12.027 969 HB1 ALA 129 1HB ALA 129 3.051 1.427 -13.761 970 HB2 ALA 129 2HB ALA 129 4.081 2.148 -14.997 971 HB3 ALA 129 3HB ALA 129 2.876 3.132 -14.167 972 H GLU 130 H GLU 130 6.715 3.132 -14.304 973 HA GLU 130 HA GLU 130 7.803 0.633 -14.687 974 HB2 GLU 130 2HB GLU 130 8.614 3.340 -15.061 975 HB3 GLU 130 1HB GLU 130 9.961 2.461 -14.326 976 HG2 GLU 130 2HG GLU 130 8.781 0.897 -16.429 977 HG3 GLU 130 1HG GLU 130 9.207 2.513 -17.020 978 H GLN 131 H GLN 131 8.527 2.886 -12.006 979 HA GLN 131 HA GLN 131 10.286 0.993 -10.790 980 HB2 GLN 131 2HB GLN 131 10.235 2.499 -8.842 981 HB3 GLN 131 1HB GLN 131 10.775 3.255 -10.333 982 HG2 GLN 131 2HG GLN 131 8.211 3.910 -10.484 983 HG3 GLN 131 1HG GLN 131 8.321 3.722 -8.736 984 HE21 GLN 131 1HE2 GLN 131 8.001 6.081 -10.584 985 HE22 GLN 131 2HE2 GLN 131 9.211 7.198 -10.066 986 H VAL 132 H VAL 132 7.078 2.264 -9.843 987 HA VAL 132 HA VAL 132 6.746 0.624 -7.627 988 HB VAL 132 HB VAL 132 5.172 2.325 -7.789 989 HG11 VAL 132 1HG1 VAL 132 3.609 1.727 -10.089 990 HG12 VAL 132 2HG1 VAL 132 5.302 1.863 -10.563 991 HG13 VAL 132 3HG1 VAL 132 4.516 3.190 -9.706 992 HG21 VAL 132 3HG2 VAL 132 4.193 0.253 -6.942 993 HG22 VAL 132 1HG2 VAL 132 3.678 -0.175 -8.573 994 HG23 VAL 132 2HG2 VAL 132 2.991 1.239 -7.773 995 H VAL 133 H VAL 133 6.773 -0.236 -10.949 996 HA VAL 133 HA VAL 133 5.293 -2.684 -10.517 997 HB VAL 133 HB VAL 133 5.195 -1.495 -12.723 998 HG11 VAL 133 1HG1 VAL 133 7.181 -0.803 -13.506 999 HG12 VAL 133 2HG1 VAL 133 7.322 -2.446 -14.129 1000 HG13 VAL 133 3HG1 VAL 133 8.076 -2.016 -12.595 1001 HG21 VAL 133 3HG2 VAL 133 5.070 -3.493 -13.986 1002 HG22 VAL 133 1HG2 VAL 133 4.670 -3.933 -12.327 1003 HG23 VAL 133 2HG2 VAL 133 6.271 -4.295 -12.972 1004 H GLN 134 H GLN 134 8.644 -1.596 -10.563 1005 HA GLN 134 HA GLN 134 9.628 -4.331 -10.691 1006 HB2 GLN 134 2HB GLN 134 11.831 -3.151 -9.943 1007 HB3 GLN 134 1HB GLN 134 11.230 -2.907 -11.576 1008 HG2 GLN 134 2HG GLN 134 10.255 -0.784 -10.901 1009 HG3 GLN 134 1HG GLN 134 10.851 -1.028 -9.262 1010 HE21 GLN 134 1HE2 GLN 134 13.358 -1.939 -9.636 1011 HE22 GLN 134 2HE2 GLN 134 14.329 -0.741 -10.451 1012 H GLY 135 H GLY 135 8.946 -1.900 -8.280 1013 HA2 GLY 135 2HA GLY 135 9.986 -3.447 -6.083 1014 HA3 GLY 135 1HA GLY 135 8.975 -1.998 -5.966 1015 H MET 136 H MET 136 7.120 -3.363 -7.964 1016 HA MET 136 HA MET 136 5.431 -4.643 -5.988 1017 HB2 MET 136 2HB MET 136 4.163 -3.283 -7.374 1018 HB3 MET 136 1HB MET 136 5.127 -3.653 -8.792 1019 HG2 MET 136 2HG MET 136 3.926 -6.067 -8.187 1020 HG3 MET 136 1HG MET 136 2.682 -4.876 -7.825 1021 HE1 MET 136 3HE MET 136 3.279 -2.646 -9.384 1022 HE2 MET 136 1HE MET 136 1.834 -2.983 -10.336 1023 HE3 MET 136 2HE MET 136 3.385 -2.749 -11.141 1024 H LYS 137 H LYS 137 7.027 -5.472 -9.029 1025 HA LYS 137 HA LYS 137 6.218 -8.181 -9.054 1026 HB2 LYS 137 2HB LYS 137 7.682 -8.450 -10.908 1027 HB3 LYS 137 1HB LYS 137 6.963 -6.856 -11.045 1028 HG2 LYS 137 2HG LYS 137 9.134 -6.075 -9.848 1029 HG3 LYS 137 1HG LYS 137 9.770 -7.623 -10.409 1030 HD2 LYS 137 2HD LYS 137 8.677 -5.355 -12.064 1031 HD3 LYS 137 1HD LYS 137 10.313 -6.013 -12.075 1032 HE2 LYS 137 2HE LYS 137 7.880 -7.598 -12.882 1033 HE3 LYS 137 1HE LYS 137 8.851 -6.669 -14.019 1034 HZ1 LYS 137 3HZ LYS 137 9.314 -9.206 -13.524 1035 HZ2 LYS 137 1HZ LYS 137 10.262 -8.547 -12.286 1036 HZ3 LYS 137 2HZ LYS 137 10.563 -8.128 -13.897 1037 H GLU 138 H GLU 138 8.505 -6.538 -7.183 1038 HA GLU 138 HA GLU 138 10.147 -8.910 -6.730 1039 HB2 GLU 138 2HB GLU 138 10.487 -6.016 -6.351 1040 HB3 GLU 138 1HB GLU 138 11.125 -6.996 -5.034 1041 HG2 GLU 138 2HG GLU 138 11.877 -8.062 -7.615 1042 HG3 GLU 138 1HG GLU 138 12.390 -6.379 -7.419 1043 H ALA 139 H ALA 139 8.769 -6.440 -4.590 1044 HA ALA 139 HA ALA 139 8.786 -7.920 -2.255 1045 HB1 ALA 139 1HB ALA 139 6.524 -6.055 -2.574 1046 HB2 ALA 139 2HB ALA 139 8.134 -5.389 -2.855 1047 HB3 ALA 139 3HB ALA 139 7.752 -6.151 -1.311 1048 H GLN 140 H GLN 140 6.629 -8.171 -4.933 1049 HA GLN 140 HA GLN 140 4.342 -9.177 -3.745 1050 HB2 GLN 140 2HB GLN 140 4.013 -10.354 -5.962 1051 HB3 GLN 140 1HB GLN 140 4.233 -8.607 -6.024 1052 HG2 GLN 140 2HG GLN 140 5.546 -9.371 -7.757 1053 HG3 GLN 140 1HG GLN 140 6.701 -9.159 -6.446 1054 HE21 GLN 140 1HE2 GLN 140 4.401 -11.744 -7.223 1055 HE22 GLN 140 2HE2 GLN 140 5.575 -13.010 -7.262 1056 H GLU 141 H GLU 141 7.435 -10.668 -3.948 1057 HA GLU 141 HA GLU 141 6.241 -13.273 -3.323 1058 HB2 GLU 141 2HB GLU 141 8.070 -14.370 -4.252 1059 HB3 GLU 141 1HB GLU 141 7.730 -13.041 -5.369 1060 HG2 GLU 141 2HG GLU 141 9.447 -11.729 -4.107 1061 HG3 GLU 141 1HG GLU 141 9.883 -13.236 -3.315 1062 H ARG 142 H ARG 142 8.798 -11.040 -2.361 1063 HA ARG 142 HA ARG 142 9.569 -12.652 -0.111 1064 HB2 ARG 142 2HB ARG 142 10.937 -10.608 0.495 1065 HB3 ARG 142 1HB ARG 142 11.293 -11.343 -1.073 1066 HG2 ARG 142 2HG ARG 142 10.157 -9.621 -2.237 1067 HG3 ARG 142 1HG ARG 142 9.449 -8.987 -0.740 1068 HD2 ARG 142 2HD ARG 142 11.372 -7.660 -1.639 1069 HD3 ARG 142 1HD ARG 142 11.574 -8.225 0.027 1070 HE ARG 142 HE ARG 142 12.725 -10.113 -1.681 1071 HH11 ARG 142 1HH1 ARG 142 13.238 -6.811 -0.679 1072 HH12 ARG 142 2HH1 ARG 142 14.952 -6.872 -0.922 1073 HH21 ARG 142 1HH2 ARG 142 14.976 -10.197 -2.001 1074 HH22 ARG 142 2HH2 ARG 142 15.939 -8.795 -1.675 1075 H LEU 143 H LEU 143 7.144 -10.307 -0.688 1076 HA LEU 143 HA LEU 143 6.876 -9.660 2.148 1077 HB2 LEU 143 2HB LEU 143 6.728 -7.880 0.403 1078 HB3 LEU 143 1HB LEU 143 5.256 -8.651 -0.191 1079 HG LEU 143 HG LEU 143 4.108 -8.177 1.878 1080 HD11 LEU 143 1HD1 LEU 143 5.535 -6.529 3.427 1081 HD12 LEU 143 2HD1 LEU 143 6.840 -7.548 2.818 1082 HD13 LEU 143 3HD1 LEU 143 5.481 -8.275 3.676 1083 HD21 LEU 143 3HD2 LEU 143 3.703 -6.337 0.643 1084 HD22 LEU 143 1HD2 LEU 143 5.412 -6.043 0.325 1085 HD23 LEU 143 2HD2 LEU 143 4.703 -5.547 1.861 1086 H THR 144 H THR 144 5.502 -11.709 -0.258 1087 HA THR 144 HA THR 144 3.080 -12.155 1.314 1088 HB THR 144 HB THR 144 2.906 -11.905 -1.145 1089 HG1 THR 144 1HG THR 144 2.232 -14.522 -0.299 1090 HG21 THR 144 3HG2 THR 144 3.607 -13.648 -2.635 1091 HG22 THR 144 1HG2 THR 144 4.307 -14.561 -1.300 1092 HG23 THR 144 2HG2 THR 144 5.011 -13.017 -1.777 1093 H GLY 145 H GLY 145 5.831 -13.023 2.159 1094 HA2 GLY 145 2HA GLY 145 5.070 -15.621 3.103 1095 HA3 GLY 145 1HA GLY 145 6.341 -15.702 1.893 1096 H ASP 146 H ASP 146 6.080 -13.014 4.103 1097 HA ASP 146 HA ASP 146 7.521 -12.193 5.663 1098 HB2 ASP 146 2HB ASP 146 7.146 -15.049 6.334 1099 HB3 ASP 146 1HB ASP 146 8.529 -14.265 7.094 1100 H ALA 147 H ALA 147 8.596 -13.075 3.010 1101 HA ALA 147 HA ALA 147 11.351 -13.770 3.690 1102 HB1 ALA 147 1HB ALA 147 11.239 -13.444 0.946 1103 HB2 ALA 147 2HB ALA 147 9.651 -14.092 1.357 1104 HB3 ALA 147 3HB ALA 147 11.109 -14.968 1.824 1105 H PHE 148 H PHE 148 9.933 -11.079 4.105 1106 HA PHE 148 HA PHE 148 11.788 -9.393 2.573 1107 HB2 PHE 148 2HB PHE 148 10.250 -7.555 2.957 1108 HB3 PHE 148 1HB PHE 148 9.365 -8.925 2.275 1109 HD1 PHE 148 2HD PHE 148 8.006 -10.368 3.830 1110 HD2 PHE 148 1HD PHE 148 9.643 -6.620 5.010 1111 HE1 PHE 148 2HE PHE 148 6.420 -10.272 5.708 1112 HE2 PHE 148 1HE PHE 148 8.060 -6.517 6.890 1113 HZ PHE 148 HZ PHE 148 6.445 -8.344 7.240 1114 H ARG 149 H ARG 149 10.780 -10.346 5.761 1115 HA ARG 149 HA ARG 149 11.835 -8.307 7.313 1116 HB2 ARG 149 2HB ARG 149 11.797 -11.255 7.968 1117 HB3 ARG 149 1HB ARG 149 11.890 -9.933 9.117 1118 HG2 ARG 149 2HG ARG 149 9.638 -9.216 7.944 1119 HG3 ARG 149 1HG ARG 149 9.572 -10.939 7.573 1120 HD2 ARG 149 2HD ARG 149 8.680 -11.199 9.601 1121 HD3 ARG 149 1HD ARG 149 10.298 -10.892 10.230 1122 HE ARG 149 HE ARG 149 8.760 -8.508 9.749 1123 HH11 ARG 149 1HH1 ARG 149 9.502 -11.027 12.049 1124 HH12 ARG 149 2HH1 ARG 149 9.055 -10.074 13.424 1125 HH21 ARG 149 1HH2 ARG 149 8.172 -7.255 11.557 1126 HH22 ARG 149 2HH2 ARG 149 8.299 -7.934 13.145 1127 H LYS 150 H LYS 150 13.429 -11.022 5.763 1128 HA LYS 150 HA LYS 150 15.951 -9.801 5.753 1129 HB2 LYS 150 2HB LYS 150 15.454 -10.678 8.258 1130 HB3 LYS 150 1HB LYS 150 16.163 -12.131 7.567 1131 HG2 LYS 150 2HG LYS 150 18.190 -11.289 7.822 1132 HG3 LYS 150 1HG LYS 150 17.766 -9.901 6.818 1133 HD2 LYS 150 2HD LYS 150 16.678 -8.933 8.915 1134 HD3 LYS 150 1HD LYS 150 17.537 -10.194 9.803 1135 HE2 LYS 150 2HE LYS 150 19.223 -8.732 9.914 1136 HE3 LYS 150 1HE LYS 150 19.508 -9.131 8.221 1137 HZ1 LYS 150 3HZ LYS 150 18.676 -7.169 7.526 1138 HZ2 LYS 150 1HZ LYS 150 19.117 -6.659 9.078 1139 HZ3 LYS 150 2HZ LYS 150 17.513 -7.080 8.750 1140 H LYS 151 H LYS 151 17.680 -11.286 4.990 1141 HA LYS 151 HA LYS 151 17.191 -13.916 4.162 1142 HB2 LYS 151 2HB LYS 151 16.935 -13.562 1.722 1143 HB3 LYS 151 1HB LYS 151 15.551 -12.993 2.646 1144 HG2 LYS 151 2HG LYS 151 15.798 -10.907 1.917 1145 HG3 LYS 151 1HG LYS 151 17.532 -10.912 2.240 1146 HD2 LYS 151 2HD LYS 151 17.162 -10.576 -0.121 1147 HD3 LYS 151 1HD LYS 151 17.878 -12.168 0.134 1148 HE2 LYS 151 2HE LYS 151 15.525 -13.091 0.083 1149 HE3 LYS 151 1HE LYS 151 15.009 -11.503 -0.480 1150 HZ1 LYS 151 3HZ LYS 151 15.528 -13.300 -2.207 1151 HZ2 LYS 151 1HZ LYS 151 17.155 -12.972 -1.873 1152 HZ3 LYS 151 2HZ LYS 151 16.151 -11.748 -2.465 1153 H HIS 152 H HIS 152 19.291 -12.423 5.319 1154 HA HIS 152 HA HIS 152 21.373 -12.712 3.253 1155 HB2 HIS 152 2HB HIS 152 21.284 -10.746 5.552 1156 HB3 HIS 152 1HB HIS 152 22.662 -10.975 4.480 1157 HD1 HIS 152 1HD HIS 152 19.536 -9.123 4.812 1158 HD2 HIS 152 2HD HIS 152 22.087 -10.221 1.720 1159 HE1 HIS 152 1HE HIS 152 18.927 -7.637 2.877 1160 HE2 HIS 152 2HE HIS 152 20.540 -8.260 1.046 1161 H LEU 153 H LEU 153 23.629 -12.674 4.655 1162 HA LEU 153 HA LEU 153 23.435 -14.408 6.967 1163 HB2 LEU 153 2HB LEU 153 25.185 -15.957 5.802 1164 HB3 LEU 153 1HB LEU 153 23.469 -16.203 5.544 1165 HG LEU 153 HG LEU 153 24.888 -16.392 3.490 1166 HD11 LEU 153 1HD1 LEU 153 23.118 -14.116 2.909 1167 HD12 LEU 153 2HD1 LEU 153 22.374 -15.469 3.763 1168 HD13 LEU 153 3HD1 LEU 153 23.163 -15.736 2.208 1169 HD21 LEU 153 3HD2 LEU 153 26.508 -14.681 3.865 1170 HD22 LEU 153 1HD2 LEU 153 25.258 -13.443 3.978 1171 HD23 LEU 153 2HD2 LEU 153 25.576 -14.236 2.437 1172 H GLU 154 H GLU 154 25.714 -14.973 7.770 1173 HA GLU 154 HA GLU 154 27.354 -12.549 7.524 1174 HB2 GLU 154 2HB GLU 154 27.051 -14.589 9.717 1175 HB3 GLU 154 1HB GLU 154 28.392 -13.452 9.687 1176 HG2 GLU 154 2HG GLU 154 27.062 -12.108 10.851 1177 HG3 GLU 154 1HG GLU 154 26.229 -11.818 9.324 1178 H ASP 155 H ASP 155 27.434 -14.740 5.606 1179 HA ASP 155 HA ASP 155 30.068 -15.923 6.123 1180 HB2 ASP 155 2HB ASP 155 27.840 -17.127 5.202 1181 HB3 ASP 155 1HB ASP 155 28.563 -16.646 3.670 1182 H GLU 156 H GLU 156 31.671 -15.926 4.415 1183 HA GLU 156 HA GLU 156 33.015 -14.888 2.906 1184 HB2 GLU 156 2HB GLU 156 30.493 -15.049 1.717 1185 HB3 GLU 156 1HB GLU 156 31.008 -13.380 1.446 1186 HG2 GLU 156 2HG GLU 156 31.696 -14.694 -0.418 1187 HG3 GLU 156 1HG GLU 156 33.133 -14.253 0.506 1188 H LEU 157 H LEU 157 33.455 -12.600 1.883 1189 HA LEU 157 HA LEU 157 33.227 -10.696 4.095 1190 HB2 LEU 157 2HB LEU 157 35.286 -11.380 2.223 1191 HB3 LEU 157 1HB LEU 157 34.903 -9.677 2.053 1192 HG LEU 157 HG LEU 157 36.744 -10.020 3.619 1193 HD11 LEU 157 1HD1 LEU 157 36.064 -8.419 5.078 1194 HD12 LEU 157 2HD1 LEU 157 34.530 -9.223 5.418 1195 HD13 LEU 157 3HD1 LEU 157 34.735 -8.308 3.923 1196 HD21 LEU 157 3HD2 LEU 157 35.514 -12.287 4.371 1197 HD22 LEU 157 1HD2 LEU 157 35.013 -11.220 5.682 1198 HD23 LEU 157 2HD2 LEU 157 36.728 -11.465 5.353 Start of MODEL 10 1 H1 MET 1 1HT MET 1 -28.749 2.155 13.068 2 H2 MET 1 2HT MET 1 -29.372 0.934 12.037 3 H3 MET 1 3HT MET 1 -30.288 1.471 13.385 4 HA MET 1 HA MET 1 -30.727 3.502 12.444 5 HB2 MET 1 2HB MET 1 -28.352 2.786 10.802 6 HB3 MET 1 1HB MET 1 -29.568 3.809 10.050 7 HG2 MET 1 2HG MET 1 -29.369 5.337 12.019 8 HG3 MET 1 1HG MET 1 -28.000 4.365 12.552 9 HE1 MET 1 2HE MET 1 -26.407 7.267 12.018 10 HE2 MET 1 3HE MET 1 -28.150 7.224 12.279 11 HE3 MET 1 1HE MET 1 -27.492 8.026 10.853 12 H HIS 2 H HIS 2 -31.808 0.847 12.265 13 HA HIS 2 HA HIS 2 -33.431 -0.302 11.166 14 HB2 HIS 2 2HB HIS 2 -33.803 2.466 10.443 15 HB3 HIS 2 1HB HIS 2 -34.267 1.424 9.102 16 HD1 HIS 2 1HD HIS 2 -34.802 0.961 12.842 17 HD2 HIS 2 2HD HIS 2 -36.956 1.225 9.299 18 HE1 HIS 2 1HE HIS 2 -37.198 0.543 13.479 19 HE2 HIS 2 2HE HIS 2 -38.470 0.618 11.306 20 H HIS 3 H HIS 3 -34.223 -0.526 8.579 21 HA HIS 3 HA HIS 3 -31.818 -1.616 7.329 22 HB2 HIS 3 2HB HIS 3 -34.024 -2.919 7.685 23 HB3 HIS 3 1HB HIS 3 -34.624 -1.993 6.315 24 HD1 HIS 3 1HD HIS 3 -31.800 -4.385 7.154 25 HD2 HIS 3 2HD HIS 3 -33.995 -3.049 3.888 26 HE1 HIS 3 1HE HIS 3 -31.062 -5.813 5.219 27 HE2 HIS 3 2HE HIS 3 -32.454 -5.032 3.268 28 H HIS 4 H HIS 4 -30.843 -0.644 5.688 29 HA HIS 4 HA HIS 4 -32.353 1.365 4.146 30 HB2 HIS 4 2HB HIS 4 -30.167 2.508 3.790 31 HB3 HIS 4 1HB HIS 4 -30.664 2.466 5.478 32 HD1 HIS 4 1HD HIS 4 -27.834 1.811 3.366 33 HD2 HIS 4 2HD HIS 4 -29.299 0.238 6.923 34 HE1 HIS 4 1HE HIS 4 -25.895 0.600 4.416 35 HE2 HIS 4 2HE HIS 4 -26.825 -0.407 6.529 36 H HIS 5 H HIS 5 -29.948 -1.199 4.043 37 HA HIS 5 HA HIS 5 -29.008 -2.375 2.334 38 HB2 HIS 5 2HB HIS 5 -30.570 -3.350 0.795 39 HB3 HIS 5 1HB HIS 5 -31.380 -3.173 2.347 40 HD1 HIS 5 1HD HIS 5 -31.276 -1.634 -1.098 41 HD2 HIS 5 2HD HIS 5 -33.654 -1.622 2.310 42 HE1 HIS 5 1HE HIS 5 -33.380 -0.419 -1.749 43 HE2 HIS 5 2HE HIS 5 -34.838 -0.498 0.304 44 H HIS 6 H HIS 6 -29.121 -2.451 -0.328 45 HA HIS 6 HA HIS 6 -28.428 -1.457 -2.251 46 HB2 HIS 6 2HB HIS 6 -30.447 0.155 -1.393 47 HB3 HIS 6 1HB HIS 6 -29.115 1.303 -1.461 48 HD1 HIS 6 1HD HIS 6 -31.667 -0.153 -3.520 49 HD2 HIS 6 2HD HIS 6 -27.796 1.225 -4.140 50 HE1 HIS 6 1HE HIS 6 -31.480 0.235 -5.998 51 HE2 HIS 6 2HE HIS 6 -29.159 1.155 -6.337 52 H HIS 7 H HIS 7 -27.917 1.236 0.024 53 HA HIS 7 HA HIS 7 -26.044 2.326 0.704 54 HB2 HIS 7 2HB HIS 7 -25.421 -0.317 0.977 55 HB3 HIS 7 1HB HIS 7 -24.129 0.231 -0.084 56 HD1 HIS 7 1HD HIS 7 -22.230 0.226 1.564 57 HD2 HIS 7 2HD HIS 7 -25.522 2.371 2.913 58 HE1 HIS 7 1HE HIS 7 -21.458 1.401 3.649 59 HE2 HIS 7 2HE HIS 7 -23.491 2.628 4.491 60 H MET 8 H MET 8 -24.655 0.370 -1.932 61 HA MET 8 HA MET 8 -24.471 2.711 -3.639 62 HB2 MET 8 2HB MET 8 -22.046 1.283 -2.540 63 HB3 MET 8 1HB MET 8 -21.992 2.299 -3.985 64 HG2 MET 8 2HG MET 8 -22.582 4.235 -2.733 65 HG3 MET 8 1HG MET 8 -22.936 3.273 -1.300 66 HE1 MET 8 3HE MET 8 -19.598 2.333 0.166 67 HE2 MET 8 1HE MET 8 -20.302 1.261 -1.043 68 HE3 MET 8 2HE MET 8 -21.345 2.097 0.108 69 H SER 9 H SER 9 -22.996 1.937 -5.658 70 HA SER 9 HA SER 9 -24.462 -0.281 -6.769 71 HB2 SER 9 2HB SER 9 -22.664 1.840 -7.799 72 HB3 SER 9 1HB SER 9 -22.688 0.329 -8.710 73 HG SER 9 HG SER 9 -25.071 0.597 -8.611 74 H ASP 10 H ASP 10 -21.381 0.204 -5.299 75 HA ASP 10 HA ASP 10 -19.696 -1.223 -4.764 76 HB2 ASP 10 2HB ASP 10 -21.979 -2.999 -5.261 77 HB3 ASP 10 1HB ASP 10 -20.416 -3.774 -5.509 78 H GLY 11 H GLY 11 -20.991 -3.003 -7.559 79 HA2 GLY 11 2HA GLY 11 -18.420 -3.264 -8.746 80 HA3 GLY 11 1HA GLY 11 -19.954 -3.677 -9.498 81 H HIS 12 H HIS 12 -17.989 -0.848 -8.609 82 HA HIS 12 HA HIS 12 -19.232 0.747 -10.683 83 HB2 HIS 12 2HB HIS 12 -16.953 1.388 -8.795 84 HB3 HIS 12 1HB HIS 12 -17.742 2.545 -9.876 85 HD1 HIS 12 1HD HIS 12 -18.048 0.942 -6.575 86 HD2 HIS 12 2HD HIS 12 -20.452 3.160 -9.138 87 HE1 HIS 12 1HE HIS 12 -19.995 1.707 -5.178 88 HE2 HIS 12 2HE HIS 12 -21.383 3.129 -6.724 89 H ASN 13 H ASN 13 -17.378 2.234 -11.815 90 HA ASN 13 HA ASN 13 -15.412 0.397 -13.003 91 HB2 ASN 13 2HB ASN 13 -17.489 2.057 -14.360 92 HB3 ASN 13 1HB ASN 13 -15.925 1.873 -15.150 93 HD21 ASN 13 1HD2 ASN 13 -15.282 -0.154 -15.871 94 HD22 ASN 13 2HD2 ASN 13 -16.399 -1.459 -16.060 95 H GLY 14 H GLY 14 -13.542 1.189 -12.243 96 HA2 GLY 14 2HA GLY 14 -11.740 2.715 -12.599 97 HA3 GLY 14 1HA GLY 14 -12.926 3.997 -12.867 98 H LEU 15 H LEU 15 -10.644 2.974 -10.783 99 HA LEU 15 HA LEU 15 -11.807 4.517 -8.601 100 HB2 LEU 15 2HB LEU 15 -11.254 1.623 -8.539 101 HB3 LEU 15 1HB LEU 15 -10.648 2.523 -7.163 102 HG LEU 15 HG LEU 15 -13.432 3.138 -7.871 103 HD11 LEU 15 1HD1 LEU 15 -12.891 0.532 -8.179 104 HD12 LEU 15 2HD1 LEU 15 -14.418 1.136 -7.539 105 HD13 LEU 15 3HD1 LEU 15 -13.161 0.574 -6.438 106 HD21 LEU 15 3HD2 LEU 15 -13.658 2.780 -5.390 107 HD22 LEU 15 1HD2 LEU 15 -12.531 4.047 -5.874 108 HD23 LEU 15 2HD2 LEU 15 -11.922 2.476 -5.354 109 H GLY 16 H GLY 16 -9.908 4.222 -6.687 110 HA2 GLY 16 2HA GLY 16 -7.741 4.726 -6.085 111 HA3 GLY 16 1HA GLY 16 -7.235 4.369 -7.732 112 H LYS 17 H LYS 17 -9.768 6.546 -7.839 113 HA LYS 17 HA LYS 17 -9.949 8.767 -8.260 114 HB2 LYS 17 2HB LYS 17 -8.657 8.736 -5.962 115 HB3 LYS 17 1HB LYS 17 -7.327 9.336 -6.942 116 HG2 LYS 17 2HG LYS 17 -8.479 11.295 -7.509 117 HG3 LYS 17 1HG LYS 17 -10.028 10.637 -6.978 118 HD2 LYS 17 2HD LYS 17 -9.088 10.567 -4.651 119 HD3 LYS 17 1HD LYS 17 -7.694 11.459 -5.260 120 HE2 LYS 17 2HE LYS 17 -9.909 12.874 -6.182 121 HE3 LYS 17 1HE LYS 17 -10.323 12.415 -4.532 122 HZ1 LYS 17 3HZ LYS 17 -8.275 14.239 -5.491 123 HZ2 LYS 17 1HZ LYS 17 -7.834 13.260 -4.185 124 HZ3 LYS 17 2HZ LYS 17 -9.177 14.279 -4.061 125 H GLY 18 H GLY 18 -9.220 7.561 -10.425 126 HA2 GLY 18 2HA GLY 18 -8.315 8.056 -12.498 127 HA3 GLY 18 1HA GLY 18 -7.514 9.452 -11.765 128 H PHE 19 H PHE 19 -6.950 6.613 -10.053 129 HA PHE 19 HA PHE 19 -4.183 6.622 -10.530 130 HB2 PHE 19 2HB PHE 19 -5.926 5.449 -8.715 131 HB3 PHE 19 1HB PHE 19 -5.227 4.075 -9.577 132 HD1 PHE 19 2HD PHE 19 -2.520 4.787 -10.065 133 HD2 PHE 19 1HD PHE 19 -4.929 5.668 -6.674 134 HE1 PHE 19 2HE PHE 19 -0.495 4.938 -8.668 135 HE2 PHE 19 1HE PHE 19 -2.914 5.830 -5.276 136 HZ PHE 19 HZ PHE 19 -0.692 5.460 -6.271 137 H GLY 20 H GLY 20 -6.504 4.048 -11.278 138 HA2 GLY 20 2HA GLY 20 -5.480 3.691 -13.944 139 HA3 GLY 20 1HA GLY 20 -4.954 2.426 -12.830 140 H ASP 21 H ASP 21 -7.099 2.080 -11.231 141 HA ASP 21 HA ASP 21 -9.611 1.911 -12.430 142 HB2 ASP 21 2HB ASP 21 -9.638 -0.658 -12.692 143 HB3 ASP 21 1HB ASP 21 -8.882 0.297 -13.972 144 H HIS 22 H HIS 22 -9.139 -1.094 -10.921 145 HA HIS 22 HA HIS 22 -10.130 0.024 -8.394 146 HB2 HIS 22 2HB HIS 22 -10.007 -2.916 -8.993 147 HB3 HIS 22 1HB HIS 22 -11.119 -2.045 -7.943 148 HD1 HIS 22 1HD HIS 22 -13.339 -1.454 -8.915 149 HD2 HIS 22 2HD HIS 22 -10.570 -2.501 -11.830 150 HE1 HIS 22 1HE HIS 22 -14.634 -1.544 -11.068 151 HE2 HIS 22 2HE HIS 22 -12.961 -2.301 -12.794 152 H ILE 23 H ILE 23 -7.805 -2.302 -9.628 153 HA ILE 23 HA ILE 23 -6.177 -3.474 -8.375 154 HB ILE 23 HB ILE 23 -5.086 -0.692 -8.729 155 HG12 ILE 23 2HG1 ILE 23 -5.348 -2.876 -10.800 156 HG13 ILE 23 1HG1 ILE 23 -6.373 -1.449 -10.710 157 HG21 ILE 23 1HG2 ILE 23 -3.404 -2.904 -9.512 158 HG22 ILE 23 2HG2 ILE 23 -3.887 -3.018 -7.821 159 HG23 ILE 23 3HG2 ILE 23 -3.079 -1.568 -8.412 160 HD11 ILE 23 3HD1 ILE 23 -4.712 -0.045 -11.433 161 HD12 ILE 23 1HD1 ILE 23 -4.347 -1.515 -12.335 162 HD13 ILE 23 2HD1 ILE 23 -3.420 -1.117 -10.887 163 H HIS 24 H HIS 24 -4.657 -0.760 -7.045 164 HA HIS 24 HA HIS 24 -4.898 -1.842 -4.395 165 HB2 HIS 24 2HB HIS 24 -3.399 0.668 -4.998 166 HB3 HIS 24 1HB HIS 24 -3.011 -0.627 -3.862 167 HD1 HIS 24 1HD HIS 24 -1.628 0.721 -6.731 168 HD2 HIS 24 2HD HIS 24 -2.655 -3.170 -5.695 169 HE1 HIS 24 1HE HIS 24 -0.217 -0.759 -8.194 170 HE2 HIS 24 2HE HIS 24 -0.933 -3.105 -7.624 171 H TRP 25 H TRP 25 -7.317 -0.637 -5.392 172 HA TRP 25 HA TRP 25 -7.875 1.150 -3.175 173 HB2 TRP 25 2HB TRP 25 -9.147 2.511 -5.233 174 HB3 TRP 25 1HB TRP 25 -7.676 3.032 -4.405 175 HD1 TRP 25 HD TRP 25 -8.927 1.663 -7.680 176 HE1 TRP 25 1HE TRP 25 -7.000 1.602 -9.357 177 HE3 TRP 25 3HE TRP 25 -5.094 2.793 -4.524 178 HZ2 TRP 25 2HZ TRP 25 -4.185 2.018 -9.360 179 HZ3 TRP 25 3HZ TRP 25 -2.826 2.952 -5.420 180 HH2 TRP 25 HH TRP 25 -2.371 2.572 -7.793 181 H ARG 26 H ARG 26 -8.741 -1.245 -5.347 182 HA ARG 26 HA ARG 26 -11.334 -1.099 -5.933 183 HB2 ARG 26 2HB ARG 26 -10.174 -3.071 -6.531 184 HB3 ARG 26 1HB ARG 26 -9.736 -3.395 -4.878 185 HG2 ARG 26 2HG ARG 26 -11.337 -4.999 -5.530 186 HG3 ARG 26 1HG ARG 26 -12.101 -3.907 -4.377 187 HD2 ARG 26 2HD ARG 26 -12.305 -3.457 -7.332 188 HD3 ARG 26 1HD ARG 26 -13.375 -4.603 -6.517 189 HE ARG 26 HE ARG 26 -13.281 -1.696 -6.056 190 HH11 ARG 26 1HH1 ARG 26 -14.908 -4.772 -5.683 191 HH12 ARG 26 2HH1 ARG 26 -16.377 -4.059 -5.113 192 HH21 ARG 26 1HH2 ARG 26 -15.214 -0.772 -5.304 193 HH22 ARG 26 2HH2 ARG 26 -16.551 -1.794 -4.897 194 H THR 27 H THR 27 -10.075 -1.617 -2.638 195 HA THR 27 HA THR 27 -11.895 -0.430 -1.126 196 HB THR 27 HB THR 27 -13.825 -1.476 -2.005 197 HG1 THR 27 1HG THR 27 -14.045 -1.493 0.167 198 HG21 THR 27 3HG2 THR 27 -13.769 -4.166 -1.606 199 HG22 THR 27 1HG2 THR 27 -12.143 -3.845 -2.207 200 HG23 THR 27 2HG2 THR 27 -13.548 -3.359 -3.158 201 H LEU 28 H LEU 28 -11.259 -0.576 0.942 202 HA LEU 28 HA LEU 28 -9.156 -2.342 1.660 203 HB2 LEU 28 2HB LEU 28 -9.434 -0.065 2.589 204 HB3 LEU 28 1HB LEU 28 -10.880 -0.609 3.436 205 HG LEU 28 HG LEU 28 -8.733 -0.430 4.794 206 HD11 LEU 28 1HD1 LEU 28 -10.915 -2.016 5.060 207 HD12 LEU 28 2HD1 LEU 28 -9.631 -1.865 6.260 208 HD13 LEU 28 3HD1 LEU 28 -9.614 -3.206 5.115 209 HD21 LEU 28 3HD2 LEU 28 -6.968 -1.780 4.436 210 HD22 LEU 28 1HD2 LEU 28 -7.599 -1.836 2.789 211 HD23 LEU 28 2HD2 LEU 28 -7.972 -3.135 3.922 212 H GLU 29 H GLU 29 -12.622 -2.386 2.121 213 HA GLU 29 HA GLU 29 -12.846 -4.245 4.175 214 HB2 GLU 29 2HB GLU 29 -14.645 -2.854 2.842 215 HB3 GLU 29 1HB GLU 29 -14.781 -4.334 1.902 216 HG2 GLU 29 2HG GLU 29 -14.823 -4.822 4.763 217 HG3 GLU 29 1HG GLU 29 -16.118 -3.747 4.234 218 H ASP 30 H ASP 30 -13.382 -5.048 0.730 219 HA ASP 30 HA ASP 30 -13.101 -7.823 1.153 220 HB2 ASP 30 2HB ASP 30 -13.549 -6.049 -1.107 221 HB3 ASP 30 1HB ASP 30 -12.488 -7.398 -1.536 222 H GLY 31 H GLY 31 -10.763 -5.353 0.946 223 HA2 GLY 31 2HA GLY 31 -8.609 -6.652 -0.276 224 HA3 GLY 31 1HA GLY 31 -8.471 -5.392 0.956 225 H LYS 32 H LYS 32 -9.393 -6.484 3.207 226 HA LYS 32 HA LYS 32 -7.321 -8.334 3.895 227 HB2 LYS 32 2HB LYS 32 -8.440 -8.308 6.152 228 HB3 LYS 32 1HB LYS 32 -7.920 -6.739 5.553 229 HG2 LYS 32 2HG LYS 32 -9.967 -5.958 5.834 230 HG3 LYS 32 1HG LYS 32 -10.580 -7.140 4.679 231 HD2 LYS 32 2HD LYS 32 -10.233 -8.644 6.950 232 HD3 LYS 32 1HD LYS 32 -10.765 -7.090 7.595 233 HE2 LYS 32 2HE LYS 32 -12.797 -7.179 6.469 234 HE3 LYS 32 1HE LYS 32 -12.207 -8.353 5.296 235 HZ1 LYS 32 3HZ LYS 32 -13.065 -9.945 6.549 236 HZ2 LYS 32 1HZ LYS 32 -13.560 -8.822 7.714 237 HZ3 LYS 32 2HZ LYS 32 -12.025 -9.527 7.815 238 H LYS 33 H LYS 33 -10.777 -8.561 3.292 239 HA LYS 33 HA LYS 33 -11.103 -11.209 4.255 240 HB2 LYS 33 2HB LYS 33 -12.953 -9.559 3.869 241 HB3 LYS 33 1HB LYS 33 -12.751 -9.815 2.142 242 HG2 LYS 33 2HG LYS 33 -13.006 -12.370 3.258 243 HG3 LYS 33 1HG LYS 33 -14.223 -11.363 4.061 244 HD2 LYS 33 2HD LYS 33 -15.462 -11.179 2.196 245 HD3 LYS 33 1HD LYS 33 -14.049 -10.950 1.164 246 HE2 LYS 33 2HE LYS 33 -13.749 -13.222 0.850 247 HE3 LYS 33 1HE LYS 33 -14.635 -13.645 2.313 248 HZ1 LYS 33 3HZ LYS 33 -16.183 -12.279 0.282 249 HZ2 LYS 33 1HZ LYS 33 -16.588 -13.614 1.240 250 HZ3 LYS 33 2HZ LYS 33 -15.648 -13.824 -0.149 251 H GLU 34 H GLU 34 -10.005 -9.866 1.234 252 HA GLU 34 HA GLU 34 -10.131 -12.453 -0.103 253 HB2 GLU 34 2HB GLU 34 -10.771 -10.379 -1.315 254 HB3 GLU 34 1HB GLU 34 -9.113 -9.801 -1.142 255 HG2 GLU 34 2HG GLU 34 -8.346 -11.104 -2.796 256 HG3 GLU 34 1HG GLU 34 -9.379 -12.469 -2.341 257 H ALA 35 H ALA 35 -7.771 -10.175 1.169 258 HA ALA 35 HA ALA 35 -5.436 -11.301 0.144 259 HB1 ALA 35 1HB ALA 35 -4.473 -10.355 2.404 260 HB2 ALA 35 2HB ALA 35 -6.076 -9.629 2.523 261 HB3 ALA 35 3HB ALA 35 -5.048 -9.274 1.135 262 H ALA 36 H ALA 36 -7.484 -12.324 2.773 263 HA ALA 36 HA ALA 36 -5.668 -14.033 4.090 264 HB1 ALA 36 1HB ALA 36 -7.581 -13.474 5.305 265 HB2 ALA 36 2HB ALA 36 -7.826 -15.167 4.879 266 HB3 ALA 36 3HB ALA 36 -8.662 -13.904 3.979 267 H ALA 37 H ALA 37 -8.186 -14.745 1.667 268 HA ALA 37 HA ALA 37 -7.791 -17.473 1.433 269 HB1 ALA 37 1HB ALA 37 -8.777 -17.280 -0.801 270 HB2 ALA 37 2HB ALA 37 -8.546 -15.532 -0.750 271 HB3 ALA 37 3HB ALA 37 -9.653 -16.310 0.382 272 H SER 38 H SER 38 -6.601 -15.188 -1.028 273 HA SER 38 HA SER 38 -4.705 -16.982 -2.081 274 HB2 SER 38 2HB SER 38 -5.358 -14.111 -2.421 275 HB3 SER 38 1HB SER 38 -3.709 -14.587 -2.863 276 HG SER 38 HG SER 38 -6.008 -15.962 -3.785 277 H GLY 39 H GLY 39 -4.602 -14.805 0.613 278 HA2 GLY 39 2HA GLY 39 -3.029 -14.585 2.279 279 HA3 GLY 39 1HA GLY 39 -2.124 -15.899 1.520 280 H LEU 40 H LEU 40 -3.026 -12.940 -0.145 281 HA LEU 40 HA LEU 40 -0.183 -12.365 -0.509 282 HB2 LEU 40 2HB LEU 40 -0.778 -11.057 -2.380 283 HB3 LEU 40 1HB LEU 40 -1.766 -12.500 -2.466 284 HG LEU 40 HG LEU 40 -3.411 -10.775 -1.110 285 HD11 LEU 40 1HD1 LEU 40 -3.113 -8.628 -1.665 286 HD12 LEU 40 2HD1 LEU 40 -2.617 -9.020 -3.312 287 HD13 LEU 40 3HD1 LEU 40 -1.449 -9.111 -1.994 288 HD21 LEU 40 3HD2 LEU 40 -3.548 -10.665 -4.058 289 HD22 LEU 40 1HD2 LEU 40 -4.787 -11.091 -2.878 290 HD23 LEU 40 2HD2 LEU 40 -3.558 -12.273 -3.329 291 HA PRO 41 HA PRO 41 -0.052 -8.978 2.296 292 HB2 PRO 41 2HB PRO 41 1.522 -7.212 0.908 293 HB3 PRO 41 1HB PRO 41 2.147 -8.617 1.780 294 HG2 PRO 41 2HG PRO 41 1.531 -8.316 -1.133 295 HG3 PRO 41 1HG PRO 41 2.941 -9.067 -0.365 296 HD2 PRO 41 2HD PRO 41 0.945 -10.555 -1.339 297 HD3 PRO 41 1HD PRO 41 1.769 -11.004 0.171 298 H LEU 42 H LEU 42 -0.580 -6.675 2.524 299 HA LEU 42 HA LEU 42 -2.758 -5.974 0.713 300 HB2 LEU 42 2HB LEU 42 -2.050 -5.303 3.517 301 HB3 LEU 42 1HB LEU 42 -2.940 -4.098 2.606 302 HG LEU 42 HG LEU 42 -3.868 -6.948 2.927 303 HD11 LEU 42 1HD1 LEU 42 -3.651 -5.743 5.100 304 HD12 LEU 42 2HD1 LEU 42 -5.299 -6.217 4.689 305 HD13 LEU 42 3HD1 LEU 42 -4.785 -4.542 4.484 306 HD21 LEU 42 3HD2 LEU 42 -4.656 -5.148 1.097 307 HD22 LEU 42 1HD2 LEU 42 -5.720 -4.707 2.433 308 HD23 LEU 42 2HD2 LEU 42 -5.733 -6.353 1.804 309 H MET 43 H MET 43 -2.960 -3.917 -0.203 310 HA MET 43 HA MET 43 -0.394 -2.550 -0.631 311 HB2 MET 43 2HB MET 43 -1.699 -3.650 -2.572 312 HB3 MET 43 1HB MET 43 -2.811 -2.289 -2.418 313 HG2 MET 43 2HG MET 43 -1.079 -1.993 -4.158 314 HG3 MET 43 1HG MET 43 -1.067 -0.735 -2.931 315 HE1 MET 43 3HE MET 43 1.119 -1.272 -0.608 316 HE2 MET 43 1HE MET 43 0.591 -0.012 -1.722 317 HE3 MET 43 2HE MET 43 2.277 -0.527 -1.711 318 H VAL 44 H VAL 44 -0.425 -1.040 1.030 319 HA VAL 44 HA VAL 44 -2.790 0.650 1.302 320 HB VAL 44 HB VAL 44 -0.274 0.874 2.926 321 HG11 VAL 44 1HG1 VAL 44 -1.697 1.899 4.566 322 HG12 VAL 44 2HG1 VAL 44 -3.134 1.532 3.611 323 HG13 VAL 44 3HG1 VAL 44 -1.958 2.704 3.018 324 HG21 VAL 44 3HG2 VAL 44 -0.655 -1.197 3.655 325 HG22 VAL 44 1HG2 VAL 44 -2.251 -1.266 2.905 326 HG23 VAL 44 2HG2 VAL 44 -2.051 -0.514 4.489 327 H ILE 45 H ILE 45 -2.443 1.617 -0.825 328 HA ILE 45 HA ILE 45 -0.212 3.475 -1.052 329 HB ILE 45 HB ILE 45 -2.482 2.761 -2.914 330 HG12 ILE 45 2HG1 ILE 45 0.514 2.371 -3.100 331 HG13 ILE 45 1HG1 ILE 45 -0.674 1.116 -2.734 332 HG21 ILE 45 1HG2 ILE 45 -0.869 5.158 -2.878 333 HG22 ILE 45 2HG2 ILE 45 -2.254 4.744 -3.884 334 HG23 ILE 45 3HG2 ILE 45 -0.635 4.244 -4.369 335 HD11 ILE 45 3HD1 ILE 45 -1.655 1.434 -4.951 336 HD12 ILE 45 1HD1 ILE 45 0.044 0.973 -5.034 337 HD13 ILE 45 2HD1 ILE 45 -0.430 2.648 -5.312 338 H ILE 46 H ILE 46 -0.368 5.462 -0.172 339 HA ILE 46 HA ILE 46 -3.058 6.659 -0.023 340 HB ILE 46 HB ILE 46 -0.848 7.139 1.969 341 HG12 ILE 46 2HG1 ILE 46 -3.188 5.612 2.853 342 HG13 ILE 46 1HG1 ILE 46 -2.204 4.760 1.666 343 HG21 ILE 46 1HG2 ILE 46 -2.350 8.376 3.185 344 HG22 ILE 46 2HG2 ILE 46 -3.752 7.574 2.478 345 HG23 ILE 46 3HG2 ILE 46 -2.855 8.767 1.539 346 HD11 ILE 46 3HD1 ILE 46 -1.647 4.362 4.092 347 HD12 ILE 46 1HD1 ILE 46 -1.066 6.026 4.139 348 HD13 ILE 46 2HD1 ILE 46 -0.301 4.855 3.063 349 H HIS 47 H HIS 47 -3.280 8.757 -0.637 350 HA HIS 47 HA HIS 47 -0.831 10.200 -1.394 351 HB2 HIS 47 2HB HIS 47 -2.046 10.912 -3.512 352 HB3 HIS 47 1HB HIS 47 -1.458 9.244 -3.458 353 HD1 HIS 47 1HD HIS 47 -4.182 10.902 -4.739 354 HD2 HIS 47 2HD HIS 47 -3.881 7.654 -2.163 355 HE1 HIS 47 1HE HIS 47 -6.381 9.697 -4.916 356 HE2 HIS 47 2HE HIS 47 -6.145 7.690 -3.410 357 H LYS 48 H LYS 48 -0.803 12.129 -0.497 358 HA LYS 48 HA LYS 48 -3.354 13.614 -0.348 359 HB2 LYS 48 2HB LYS 48 -1.514 12.951 1.867 360 HB3 LYS 48 1HB LYS 48 -2.162 14.581 1.853 361 HG2 LYS 48 2HG LYS 48 -4.450 13.444 1.571 362 HG3 LYS 48 1HG LYS 48 -3.619 11.980 2.104 363 HD2 LYS 48 2HD LYS 48 -2.805 13.903 3.921 364 HD3 LYS 48 1HD LYS 48 -4.506 14.282 3.639 365 HE2 LYS 48 2HE LYS 48 -4.836 11.714 3.952 366 HE3 LYS 48 1HE LYS 48 -3.273 11.802 4.762 367 HZ1 LYS 48 3HZ LYS 48 -4.182 13.452 6.270 368 HZ2 LYS 48 1HZ LYS 48 -5.102 12.031 6.324 369 HZ3 LYS 48 2HZ LYS 48 -5.681 13.383 5.487 370 H SER 49 H SER 49 -3.154 15.927 -0.215 371 HA SER 49 HA SER 49 -2.410 17.902 -1.065 372 HB2 SER 49 2HB SER 49 -0.618 17.073 0.858 373 HB3 SER 49 1HB SER 49 0.430 17.443 -0.510 374 HG SER 49 HG SER 49 -0.766 19.493 -0.609 375 H TRP 50 H TRP 50 -0.073 18.719 -2.289 376 HA TRP 50 HA TRP 50 -0.435 17.853 -4.922 377 HB2 TRP 50 2HB TRP 50 1.606 19.101 -5.450 378 HB3 TRP 50 1HB TRP 50 0.581 20.021 -4.340 379 HD1 TRP 50 HD TRP 50 1.401 19.933 -1.669 380 HE1 TRP 50 1HE TRP 50 3.798 19.930 -0.730 381 HE3 TRP 50 3HE TRP 50 3.910 18.413 -5.855 382 HZ2 TRP 50 2HZ TRP 50 6.407 19.359 -1.644 383 HZ3 TRP 50 3HZ TRP 50 6.355 18.163 -5.740 384 HH2 TRP 50 HH TRP 50 7.577 18.627 -3.676 385 H CYS 51 H CYS 51 -0.392 15.598 -4.897 386 HA CYS 51 HA CYS 51 2.141 14.296 -4.249 387 HB2 CYS 51 2HB CYS 51 0.803 12.187 -4.587 388 HB3 CYS 51 1HB CYS 51 0.233 13.223 -3.283 389 H GLY 52 H GLY 52 3.551 14.499 -5.958 390 HA2 GLY 52 2HA GLY 52 2.851 14.588 -8.675 391 HA3 GLY 52 1HA GLY 52 4.432 14.089 -8.063 392 H ALA 53 H ALA 53 3.280 11.916 -6.476 393 HA ALA 53 HA ALA 53 3.528 9.799 -8.274 394 HB1 ALA 53 1HB ALA 53 3.813 9.568 -5.840 395 HB2 ALA 53 2HB ALA 53 2.678 8.384 -6.488 396 HB3 ALA 53 3HB ALA 53 2.077 9.802 -5.630 397 H CYS 54 H CYS 54 0.908 11.884 -7.639 398 HA CYS 54 HA CYS 54 -0.989 10.057 -8.856 399 HB2 CYS 54 2HB CYS 54 -1.619 12.834 -7.869 400 HB3 CYS 54 1HB CYS 54 -2.715 11.456 -8.051 401 H LYS 55 H LYS 55 0.672 13.091 -9.393 402 HA LYS 55 HA LYS 55 -0.700 14.041 -11.618 403 HB2 LYS 55 2HB LYS 55 1.655 14.701 -10.224 404 HB3 LYS 55 1HB LYS 55 2.133 14.505 -11.904 405 HG2 LYS 55 2HG LYS 55 0.486 16.130 -12.603 406 HG3 LYS 55 1HG LYS 55 -0.102 16.279 -10.938 407 HD2 LYS 55 2HD LYS 55 1.305 18.083 -11.028 408 HD3 LYS 55 1HD LYS 55 2.430 16.847 -10.462 409 HE2 LYS 55 2HE LYS 55 2.161 17.070 -13.384 410 HE3 LYS 55 1HE LYS 55 2.880 18.467 -12.584 411 HZ1 LYS 55 3HZ LYS 55 3.831 15.727 -12.028 412 HZ2 LYS 55 1HZ LYS 55 4.632 17.196 -11.775 413 HZ3 LYS 55 2HZ LYS 55 4.421 16.607 -13.346 414 H ALA 56 H ALA 56 2.281 12.055 -11.588 415 HA ALA 56 HA ALA 56 2.090 11.543 -14.421 416 HB1 ALA 56 1HB ALA 56 4.040 11.224 -12.365 417 HB2 ALA 56 2HB ALA 56 4.250 11.133 -14.114 418 HB3 ALA 56 3HB ALA 56 3.835 9.683 -13.199 419 H LEU 57 H LEU 57 0.908 10.061 -11.560 420 HA LEU 57 HA LEU 57 0.617 7.408 -12.249 421 HB2 LEU 57 2HB LEU 57 -0.047 7.627 -10.129 422 HB3 LEU 57 1HB LEU 57 -0.501 9.293 -10.361 423 HG LEU 57 HG LEU 57 -2.263 6.899 -10.915 424 HD11 LEU 57 1HD1 LEU 57 -1.707 7.475 -8.510 425 HD12 LEU 57 2HD1 LEU 57 -3.418 7.458 -8.934 426 HD13 LEU 57 3HD1 LEU 57 -2.568 8.990 -8.776 427 HD21 LEU 57 3HD2 LEU 57 -3.345 8.348 -12.259 428 HD22 LEU 57 1HD2 LEU 57 -2.528 9.751 -11.574 429 HD23 LEU 57 2HD2 LEU 57 -3.916 9.050 -10.747 430 H LYS 58 H LYS 58 -1.340 10.157 -13.228 431 HA LYS 58 HA LYS 58 -3.588 8.867 -14.153 432 HB2 LYS 58 2HB LYS 58 -2.373 11.461 -14.492 433 HB3 LYS 58 1HB LYS 58 -3.174 10.945 -15.971 434 HG2 LYS 58 2HG LYS 58 -5.047 11.718 -15.068 435 HG3 LYS 58 1HG LYS 58 -5.000 10.309 -14.007 436 HD2 LYS 58 2HD LYS 58 -5.253 12.169 -12.580 437 HD3 LYS 58 1HD LYS 58 -3.554 11.707 -12.457 438 HE2 LYS 58 2HE LYS 58 -4.347 13.741 -14.483 439 HE3 LYS 58 1HE LYS 58 -4.270 14.221 -12.787 440 HZ1 LYS 58 3HZ LYS 58 -1.957 12.981 -12.995 441 HZ2 LYS 58 1HZ LYS 58 -2.136 14.621 -13.368 442 HZ3 LYS 58 2HZ LYS 58 -2.119 13.469 -14.605 443 HA PRO 59 HA PRO 59 -2.005 8.406 -18.630 444 HB2 PRO 59 2HB PRO 59 0.503 9.161 -19.292 445 HB3 PRO 59 1HB PRO 59 -0.875 10.280 -19.268 446 HG2 PRO 59 2HG PRO 59 1.237 9.832 -17.184 447 HG3 PRO 59 1HG PRO 59 0.591 11.356 -17.814 448 HD2 PRO 59 2HD PRO 59 -0.232 10.307 -15.467 449 HD3 PRO 59 1HD PRO 59 -1.318 11.236 -16.529 450 H LYS 60 H LYS 60 0.452 7.640 -16.190 451 HA LYS 60 HA LYS 60 1.268 5.344 -17.836 452 HB2 LYS 60 2HB LYS 60 3.150 5.097 -16.319 453 HB3 LYS 60 1HB LYS 60 3.060 6.742 -16.939 454 HG2 LYS 60 2HG LYS 60 1.677 7.143 -14.773 455 HG3 LYS 60 1HG LYS 60 2.529 5.715 -14.198 456 HD2 LYS 60 2HD LYS 60 3.710 7.802 -13.601 457 HD3 LYS 60 1HD LYS 60 4.671 6.777 -14.666 458 HE2 LYS 60 2HE LYS 60 2.951 8.828 -15.941 459 HE3 LYS 60 1HE LYS 60 4.380 9.392 -15.077 460 HZ1 LYS 60 3HZ LYS 60 4.962 7.165 -16.765 461 HZ2 LYS 60 1HZ LYS 60 5.699 8.687 -16.698 462 HZ3 LYS 60 2HZ LYS 60 4.312 8.459 -17.639 463 H PHE 61 H PHE 61 0.156 6.043 -14.510 464 HA PHE 61 HA PHE 61 0.055 3.308 -13.813 465 HB2 PHE 61 2HB PHE 61 0.012 5.486 -12.321 466 HB3 PHE 61 1HB PHE 61 -1.733 5.289 -12.482 467 HD1 PHE 61 1HD PHE 61 -2.651 2.901 -11.943 468 HD2 PHE 61 2HD PHE 61 1.133 4.366 -10.664 469 HE1 PHE 61 1HE PHE 61 -2.598 1.203 -10.164 470 HE2 PHE 61 2HE PHE 61 1.193 2.673 -8.882 471 HZ PHE 61 HZ PHE 61 -0.675 1.091 -8.629 472 H ALA 62 H ALA 62 -1.917 5.376 -15.696 473 HA ALA 62 HA ALA 62 -4.368 3.980 -15.502 474 HB1 ALA 62 1HB ALA 62 -4.590 6.040 -16.536 475 HB2 ALA 62 2HB ALA 62 -4.614 4.946 -17.918 476 HB3 ALA 62 3HB ALA 62 -3.137 5.822 -17.512 477 H GLU 63 H GLU 63 -1.328 3.342 -16.823 478 HA GLU 63 HA GLU 63 -2.034 1.377 -18.786 479 HB2 GLU 63 2HB GLU 63 0.062 2.858 -18.742 480 HB3 GLU 63 1HB GLU 63 0.660 1.777 -17.480 481 HG2 GLU 63 2HG GLU 63 0.422 -0.119 -19.058 482 HG3 GLU 63 1HG GLU 63 -0.048 1.025 -20.314 483 H SER 64 H SER 64 -1.850 1.466 -15.439 484 HA SER 64 HA SER 64 -0.845 -0.997 -14.714 485 HB2 SER 64 2HB SER 64 -3.003 0.708 -13.515 486 HB3 SER 64 1HB SER 64 -2.399 -0.740 -12.731 487 HG SER 64 HG SER 64 -0.836 0.449 -12.018 488 H THR 65 H THR 65 -3.227 -0.691 -16.926 489 HA THR 65 HA THR 65 -5.328 -2.309 -16.207 490 HB THR 65 HB THR 65 -4.261 -2.924 -18.880 491 HG1 THR 65 1HG THR 65 -4.487 -0.816 -19.646 492 HG21 THR 65 3HG2 THR 65 -6.651 -3.190 -18.091 493 HG22 THR 65 1HG2 THR 65 -6.407 -2.388 -19.642 494 HG23 THR 65 2HG2 THR 65 -6.771 -1.433 -18.204 495 H GLU 66 H GLU 66 -2.050 -3.160 -17.111 496 HA GLU 66 HA GLU 66 -2.529 -6.005 -16.937 497 HB2 GLU 66 2HB GLU 66 -0.089 -6.219 -17.234 498 HB3 GLU 66 1HB GLU 66 -0.810 -5.197 -18.483 499 HG2 GLU 66 2HG GLU 66 0.014 -3.632 -16.218 500 HG3 GLU 66 1HG GLU 66 1.353 -4.597 -16.835 501 H ILE 67 H ILE 67 -1.428 -3.374 -14.927 502 HA ILE 67 HA ILE 67 -0.384 -5.031 -12.851 503 HB ILE 67 HB ILE 67 -1.462 -2.218 -12.652 504 HG12 ILE 67 2HG1 ILE 67 1.386 -3.181 -13.001 505 HG13 ILE 67 1HG1 ILE 67 0.394 -2.463 -14.279 506 HG21 ILE 67 1HG2 ILE 67 0.293 -3.801 -10.787 507 HG22 ILE 67 2HG2 ILE 67 -1.354 -3.256 -10.479 508 HG23 ILE 67 3HG2 ILE 67 -0.050 -2.079 -10.628 509 HD11 ILE 67 3HD1 ILE 67 0.649 -0.862 -11.829 510 HD12 ILE 67 1HD1 ILE 67 0.718 -0.377 -13.522 511 HD13 ILE 67 2HD1 ILE 67 2.134 -1.091 -12.751 512 H SER 68 H SER 68 -3.516 -4.343 -13.976 513 HA SER 68 HA SER 68 -4.983 -4.581 -11.560 514 HB2 SER 68 2HB SER 68 -6.903 -4.694 -12.906 515 HB3 SER 68 1HB SER 68 -5.780 -3.774 -13.907 516 HG SER 68 HG SER 68 -6.727 -5.394 -15.143 517 H GLU 69 H GLU 69 -3.581 -6.824 -13.825 518 HA GLU 69 HA GLU 69 -4.828 -9.134 -12.618 519 HB2 GLU 69 2HB GLU 69 -2.513 -9.126 -14.554 520 HB3 GLU 69 1HB GLU 69 -3.645 -10.433 -14.238 521 HG2 GLU 69 2HG GLU 69 -4.222 -7.832 -15.632 522 HG3 GLU 69 1HG GLU 69 -4.166 -9.441 -16.351 523 H LEU 70 H LEU 70 -1.688 -7.544 -12.712 524 HA LEU 70 HA LEU 70 -0.249 -9.396 -11.151 525 HB2 LEU 70 2HB LEU 70 0.045 -6.506 -11.818 526 HB3 LEU 70 1HB LEU 70 1.007 -7.151 -10.492 527 HG LEU 70 HG LEU 70 1.215 -8.859 -12.811 528 HD11 LEU 70 1HD1 LEU 70 2.117 -7.430 -14.413 529 HD12 LEU 70 2HD1 LEU 70 2.296 -6.104 -13.263 530 HD13 LEU 70 3HD1 LEU 70 0.693 -6.561 -13.839 531 HD21 LEU 70 3HD2 LEU 70 3.678 -7.875 -12.409 532 HD22 LEU 70 1HD2 LEU 70 2.971 -9.142 -11.406 533 HD23 LEU 70 2HD2 LEU 70 2.945 -7.465 -10.857 534 H SER 71 H SER 71 -2.672 -7.098 -10.343 535 HA SER 71 HA SER 71 -2.191 -6.272 -7.810 536 HB2 SER 71 2HB SER 71 -4.437 -6.444 -9.439 537 HB3 SER 71 1HB SER 71 -4.886 -7.303 -7.966 538 HG SER 71 HG SER 71 -4.279 -5.452 -6.784 539 H HIS 72 H HIS 72 -2.578 -9.566 -8.739 540 HA HIS 72 HA HIS 72 -3.544 -10.677 -6.368 541 HB2 HIS 72 2HB HIS 72 -1.743 -11.736 -8.541 542 HB3 HIS 72 1HB HIS 72 -2.137 -12.716 -7.121 543 HD1 HIS 72 1HD HIS 72 -3.943 -14.301 -7.667 544 HD2 HIS 72 2HD HIS 72 -4.455 -10.668 -9.618 545 HE1 HIS 72 1HE HIS 72 -6.081 -14.532 -8.968 546 HE2 HIS 72 2HE HIS 72 -6.416 -12.291 -10.070 547 H ASN 73 H ASN 73 -0.692 -9.012 -7.014 548 HA ASN 73 HA ASN 73 0.990 -10.280 -5.067 549 HB2 ASN 73 2HB ASN 73 2.365 -8.149 -5.431 550 HB3 ASN 73 1HB ASN 73 2.138 -9.203 -6.828 551 HD21 ASN 73 1HD2 ASN 73 2.189 -7.836 -8.498 552 HD22 ASN 73 2HD2 ASN 73 1.141 -6.456 -8.676 553 H PHE 74 H PHE 74 -0.812 -7.236 -5.217 554 HA PHE 74 HA PHE 74 -1.049 -7.194 -2.322 555 HB2 PHE 74 2HB PHE 74 -0.253 -4.836 -4.046 556 HB3 PHE 74 1HB PHE 74 -0.473 -4.849 -2.303 557 HD1 PHE 74 1HD PHE 74 1.160 -5.864 -0.833 558 HD2 PHE 74 2HD PHE 74 1.714 -5.783 -5.049 559 HE1 PHE 74 1HE PHE 74 3.529 -6.477 -0.533 560 HE2 PHE 74 2HE PHE 74 4.077 -6.393 -4.760 561 HZ PHE 74 HZ PHE 74 4.986 -6.745 -2.504 562 H VAL 75 H VAL 75 -3.061 -6.269 -1.635 563 HA VAL 75 HA VAL 75 -4.887 -5.838 -3.894 564 HB VAL 75 HB VAL 75 -5.382 -7.743 -2.393 565 HG11 VAL 75 1HG1 VAL 75 -6.034 -5.565 -0.414 566 HG12 VAL 75 2HG1 VAL 75 -4.752 -6.769 -0.267 567 HG13 VAL 75 3HG1 VAL 75 -6.443 -7.270 -0.228 568 HG21 VAL 75 3HG2 VAL 75 -7.629 -7.538 -2.765 569 HG22 VAL 75 1HG2 VAL 75 -7.076 -6.192 -3.760 570 HG23 VAL 75 2HG2 VAL 75 -7.694 -5.896 -2.135 571 H MET 76 H MET 76 -6.588 -4.518 -3.779 572 HA MET 76 HA MET 76 -6.400 -1.935 -3.693 573 HB2 MET 76 2HB MET 76 -8.821 -1.905 -3.486 574 HB3 MET 76 1HB MET 76 -8.239 -3.168 -4.555 575 HG2 MET 76 2HG MET 76 -8.447 -4.198 -1.896 576 HG3 MET 76 1HG MET 76 -9.955 -3.417 -2.337 577 HE1 MET 76 3HE MET 76 -11.070 -5.487 -1.859 578 HE2 MET 76 1HE MET 76 -9.946 -6.846 -1.884 579 HE3 MET 76 2HE MET 76 -11.298 -6.799 -3.016 580 H VAL 77 H VAL 77 -5.285 -0.938 -1.894 581 HA VAL 77 HA VAL 77 -7.142 -0.321 0.267 582 HB VAL 77 HB VAL 77 -4.269 -1.029 0.871 583 HG11 VAL 77 1HG1 VAL 77 -4.996 0.648 2.381 584 HG12 VAL 77 2HG1 VAL 77 -5.100 -0.887 3.238 585 HG13 VAL 77 3HG1 VAL 77 -6.562 -0.135 2.599 586 HG21 VAL 77 3HG2 VAL 77 -6.714 -2.624 0.795 587 HG22 VAL 77 1HG2 VAL 77 -5.813 -2.745 2.305 588 HG23 VAL 77 2HG2 VAL 77 -5.025 -3.130 0.774 589 H ASN 78 H ASN 78 -7.149 1.503 -1.382 590 HA ASN 78 HA ASN 78 -4.910 3.340 -1.156 591 HB2 ASN 78 2HB ASN 78 -6.124 2.881 -3.318 592 HB3 ASN 78 1HB ASN 78 -7.494 3.747 -2.645 593 HD21 ASN 78 1HD2 ASN 78 -4.001 4.355 -2.565 594 HD22 ASN 78 2HD2 ASN 78 -4.095 5.945 -3.257 595 H LEU 79 H LEU 79 -4.910 4.378 0.783 596 HA LEU 79 HA LEU 79 -7.423 5.495 1.780 597 HB2 LEU 79 2HB LEU 79 -4.879 5.965 3.232 598 HB3 LEU 79 1HB LEU 79 -6.483 5.647 3.855 599 HG LEU 79 HG LEU 79 -4.643 3.576 2.653 600 HD11 LEU 79 1HD1 LEU 79 -5.308 4.337 5.478 601 HD12 LEU 79 2HD1 LEU 79 -3.723 4.127 4.733 602 HD13 LEU 79 3HD1 LEU 79 -4.738 2.722 5.061 603 HD21 LEU 79 3HD2 LEU 79 -6.305 2.067 2.788 604 HD22 LEU 79 1HD2 LEU 79 -7.348 3.486 2.684 605 HD23 LEU 79 2HD2 LEU 79 -6.972 2.778 4.257 606 H GLU 80 H GLU 80 -7.763 7.682 2.126 607 HA GLU 80 HA GLU 80 -5.782 9.527 0.982 608 HB2 GLU 80 2HB GLU 80 -8.131 8.821 -0.304 609 HB3 GLU 80 1HB GLU 80 -8.543 10.345 0.489 610 HG2 GLU 80 2HG GLU 80 -6.686 11.450 -0.596 611 HG3 GLU 80 1HG GLU 80 -6.177 9.921 -1.330 612 H ASP 81 H ASP 81 -7.076 11.893 1.316 613 HA ASP 81 HA ASP 81 -6.673 12.485 4.009 614 HB2 ASP 81 2HB ASP 81 -7.913 14.627 3.474 615 HB3 ASP 81 1HB ASP 81 -6.547 14.259 2.425 616 H GLU 82 H GLU 82 -9.625 11.673 2.265 617 HA GLU 82 HA GLU 82 -11.436 12.259 4.350 618 HB2 GLU 82 2HB GLU 82 -13.006 10.793 3.091 619 HB3 GLU 82 1HB GLU 82 -12.241 12.022 2.093 620 HG2 GLU 82 2HG GLU 82 -11.052 10.511 0.887 621 HG3 GLU 82 1HG GLU 82 -10.941 9.366 2.223 622 H GLU 83 H GLU 83 -9.474 9.464 3.608 623 HA GLU 83 HA GLU 83 -10.509 8.153 6.036 624 HB2 GLU 83 2HB GLU 83 -10.799 7.116 3.586 625 HB3 GLU 83 1HB GLU 83 -9.183 6.518 3.936 626 HG2 GLU 83 2HG GLU 83 -9.972 4.930 5.261 627 HG3 GLU 83 1HG GLU 83 -10.941 6.090 6.178 628 H GLU 84 H GLU 84 -8.851 9.440 7.131 629 HA GLU 84 HA GLU 84 -6.087 8.739 6.606 630 HB2 GLU 84 2HB GLU 84 -5.563 10.338 8.392 631 HB3 GLU 84 1HB GLU 84 -6.625 11.048 7.185 632 HG2 GLU 84 2HG GLU 84 -8.399 10.044 9.010 633 HG3 GLU 84 1HG GLU 84 -7.063 10.580 10.027 634 HA PRO 85 HA PRO 85 -6.232 5.383 9.545 635 HB2 PRO 85 2HB PRO 85 -3.607 4.751 9.528 636 HB3 PRO 85 1HB PRO 85 -4.684 4.366 8.170 637 HG2 PRO 85 2HG PRO 85 -2.760 6.648 8.481 638 HG3 PRO 85 1HG PRO 85 -3.043 5.603 7.069 639 HD2 PRO 85 2HD PRO 85 -4.116 8.093 7.309 640 HD3 PRO 85 1HD PRO 85 -4.919 6.772 6.423 641 H LYS 86 H LYS 86 -4.314 8.263 9.883 642 HA LYS 86 HA LYS 86 -3.588 9.422 11.697 643 HB2 LYS 86 2HB LYS 86 -5.791 7.776 12.729 644 HB3 LYS 86 1HB LYS 86 -4.626 8.266 13.965 645 HG2 LYS 86 2HG LYS 86 -5.246 10.426 13.879 646 HG3 LYS 86 1HG LYS 86 -5.507 10.395 12.134 647 HD2 LYS 86 2HD LYS 86 -7.700 10.261 12.480 648 HD3 LYS 86 1HD LYS 86 -7.464 8.721 13.307 649 HE2 LYS 86 2HE LYS 86 -8.407 9.832 15.033 650 HE3 LYS 86 1HE LYS 86 -6.756 10.400 15.276 651 HZ1 LYS 86 3HZ LYS 86 -7.276 12.471 14.618 652 HZ2 LYS 86 1HZ LYS 86 -8.848 12.021 15.055 653 HZ3 LYS 86 2HZ LYS 86 -8.369 11.958 13.434 654 H ASP 87 H ASP 87 -2.073 7.198 10.697 655 HA ASP 87 HA ASP 87 -0.437 6.698 13.067 656 HB2 ASP 87 2HB ASP 87 -1.942 4.673 11.594 657 HB3 ASP 87 1HB ASP 87 -0.212 4.310 11.671 658 H GLU 88 H GLU 88 1.692 5.600 12.349 659 HA GLU 88 HA GLU 88 2.902 7.306 10.411 660 HB2 GLU 88 2HB GLU 88 3.776 5.343 12.384 661 HB3 GLU 88 1HB GLU 88 4.736 5.302 10.911 662 HG2 GLU 88 2HG GLU 88 5.826 6.799 12.331 663 HG3 GLU 88 1HG GLU 88 4.979 7.805 11.159 664 H ASP 89 H ASP 89 1.262 4.340 10.179 665 HA ASP 89 HA ASP 89 2.550 2.910 8.226 666 HB2 ASP 89 2HB ASP 89 -0.435 3.379 8.435 667 HB3 ASP 89 1HB ASP 89 0.345 2.047 7.571 668 H PHE 90 H PHE 90 0.891 5.948 7.905 669 HA PHE 90 HA PHE 90 0.704 5.833 5.038 670 HB2 PHE 90 2HB PHE 90 -0.322 7.957 5.153 671 HB3 PHE 90 1HB PHE 90 -0.870 7.093 6.593 672 HD1 PHE 90 2HD PHE 90 1.861 7.528 8.080 673 HD2 PHE 90 1HD PHE 90 -0.840 10.113 6.053 674 HE1 PHE 90 2HE PHE 90 2.617 9.401 9.475 675 HE2 PHE 90 1HE PHE 90 -0.089 11.994 7.445 676 HZ PHE 90 HZ PHE 90 1.642 11.640 9.160 677 H SER 91 H SER 91 3.193 6.616 7.218 678 HA SER 91 HA SER 91 4.991 7.269 5.111 679 HB2 SER 91 2HB SER 91 4.682 9.516 7.082 680 HB3 SER 91 1HB SER 91 5.416 9.536 5.471 681 HG SER 91 HG SER 91 3.289 9.273 4.617 682 HA PRO 92 HA PRO 92 6.810 5.728 9.120 683 HB2 PRO 92 2HB PRO 92 7.272 3.177 8.494 684 HB3 PRO 92 1HB PRO 92 5.653 3.721 8.979 685 HG2 PRO 92 2HG PRO 92 6.732 3.176 6.238 686 HG3 PRO 92 1HG PRO 92 5.154 2.752 6.923 687 HD2 PRO 92 2HD PRO 92 5.626 4.938 5.301 688 HD3 PRO 92 1HD PRO 92 4.269 4.800 6.437 689 H ASP 93 H ASP 93 8.379 7.316 7.930 690 HA ASP 93 HA ASP 93 10.924 6.181 7.907 691 HB2 ASP 93 2HB ASP 93 11.553 6.278 5.556 692 HB3 ASP 93 1HB ASP 93 10.198 5.162 5.768 693 H GLY 94 H GLY 94 8.990 8.730 6.356 694 HA2 GLY 94 2HA GLY 94 10.976 10.678 7.355 695 HA3 GLY 94 1HA GLY 94 10.284 10.810 5.736 696 H GLY 95 H GLY 95 8.713 12.255 5.565 697 HA2 GLY 95 2HA GLY 95 6.640 12.412 7.582 698 HA3 GLY 95 1HA GLY 95 7.667 13.845 7.477 699 H TYR 96 H TYR 96 6.994 12.006 4.597 700 HA TYR 96 HA TYR 96 5.924 14.250 3.261 701 HB2 TYR 96 2HB TYR 96 5.195 12.476 1.535 702 HB3 TYR 96 1HB TYR 96 6.925 12.668 1.850 703 HD1 TYR 96 1HD TYR 96 3.987 10.512 2.399 704 HD2 TYR 96 2HD TYR 96 8.201 10.904 2.838 705 HE1 TYR 96 1HE TYR 96 4.151 8.104 2.891 706 HE2 TYR 96 2HE TYR 96 8.373 8.505 3.346 707 HH TYR 96 HH TYR 96 5.685 6.343 2.972 708 H ILE 97 H ILE 97 3.703 13.723 1.944 709 HA ILE 97 HA ILE 97 1.680 12.723 3.762 710 HB ILE 97 HB ILE 97 0.360 14.925 3.342 711 HG12 ILE 97 2HG1 ILE 97 3.000 16.258 3.449 712 HG13 ILE 97 1HG1 ILE 97 2.540 15.575 1.887 713 HG21 ILE 97 1HG2 ILE 97 2.650 14.753 5.291 714 HG22 ILE 97 2HG2 ILE 97 1.000 14.186 5.545 715 HG23 ILE 97 3HG2 ILE 97 1.327 15.913 5.388 716 HD11 ILE 97 3HD1 ILE 97 1.715 18.016 3.086 717 HD12 ILE 97 1HD1 ILE 97 0.305 16.980 2.861 718 HD13 ILE 97 2HD1 ILE 97 1.338 17.373 1.486 719 HA PRO 98 HA PRO 98 1.521 10.402 2.830 720 HB2 PRO 98 2HB PRO 98 -1.158 9.753 1.538 721 HB3 PRO 98 1HB PRO 98 -0.397 8.973 2.953 722 HG2 PRO 98 2HG PRO 98 -1.903 11.406 2.848 723 HG3 PRO 98 1HG PRO 98 -1.170 10.604 4.265 724 HD2 PRO 98 2HD PRO 98 -0.140 12.850 3.569 725 HD3 PRO 98 1HD PRO 98 0.978 11.484 3.782 726 H ARG 99 H ARG 99 2.300 8.461 1.951 727 HA ARG 99 HA ARG 99 2.366 8.332 -0.982 728 HB2 ARG 99 2HB ARG 99 4.538 8.233 1.015 729 HB3 ARG 99 1HB ARG 99 4.657 7.068 -0.298 730 HG2 ARG 99 2HG ARG 99 5.886 9.019 -0.869 731 HG3 ARG 99 1HG ARG 99 4.463 8.939 -1.904 732 HD2 ARG 99 2HD ARG 99 3.521 10.419 0.155 733 HD3 ARG 99 1HD ARG 99 5.213 10.900 0.161 734 HE ARG 99 HE ARG 99 4.454 11.082 -2.456 735 HH11 ARG 99 1HH1 ARG 99 3.286 12.436 0.538 736 HH12 ARG 99 2HH1 ARG 99 2.717 13.897 -0.197 737 HH21 ARG 99 1HH2 ARG 99 3.704 13.003 -3.428 738 HH22 ARG 99 2HH2 ARG 99 2.954 14.219 -2.448 739 H ILE 100 H ILE 100 3.664 5.937 -1.267 740 HA ILE 100 HA ILE 100 1.616 4.072 -0.293 741 HB ILE 100 HB ILE 100 2.055 2.689 -2.160 742 HG12 ILE 100 2HG1 ILE 100 3.961 3.863 -3.765 743 HG13 ILE 100 1HG1 ILE 100 4.646 4.055 -2.154 744 HG21 ILE 100 1HG2 ILE 100 0.977 5.080 -2.457 745 HG22 ILE 100 2HG2 ILE 100 1.239 4.009 -3.833 746 HG23 ILE 100 3HG2 ILE 100 2.374 5.315 -3.505 747 HD11 ILE 100 3HD1 ILE 100 4.584 1.751 -3.815 748 HD12 ILE 100 1HD1 ILE 100 3.681 1.414 -2.338 749 HD13 ILE 100 2HD1 ILE 100 5.354 1.966 -2.243 750 H LEU 101 H LEU 101 2.139 2.008 0.454 751 HA LEU 101 HA LEU 101 4.819 1.131 0.799 752 HB2 LEU 101 2HB LEU 101 4.577 0.997 3.361 753 HB3 LEU 101 1HB LEU 101 5.100 2.500 2.634 754 HG LEU 101 HG LEU 101 3.441 2.700 4.516 755 HD11 LEU 101 1HD1 LEU 101 3.851 4.274 2.396 756 HD12 LEU 101 2HD1 LEU 101 2.694 4.652 3.673 757 HD13 LEU 101 3HD1 LEU 101 2.138 3.919 2.167 758 HD21 LEU 101 3HD2 LEU 101 1.156 2.203 4.149 759 HD22 LEU 101 1HD2 LEU 101 2.068 0.750 3.736 760 HD23 LEU 101 2HD2 LEU 101 1.449 1.795 2.458 761 H PHE 102 H PHE 102 4.975 -1.022 1.482 762 HA PHE 102 HA PHE 102 2.433 -2.447 1.232 763 HB2 PHE 102 2HB PHE 102 5.198 -3.655 1.316 764 HB3 PHE 102 1HB PHE 102 3.715 -4.406 0.739 765 HD1 PHE 102 2HD PHE 102 2.742 -3.744 -1.408 766 HD2 PHE 102 1HD PHE 102 6.451 -2.159 -0.066 767 HE1 PHE 102 2HE PHE 102 3.242 -2.978 -3.695 768 HE2 PHE 102 1HE PHE 102 6.958 -1.388 -2.342 769 HZ PHE 102 HZ PHE 102 5.351 -1.799 -4.162 770 H LEU 103 H LEU 103 1.875 -4.201 2.645 771 HA LEU 103 HA LEU 103 3.223 -4.258 5.229 772 HB2 LEU 103 2HB LEU 103 1.347 -3.681 6.516 773 HB3 LEU 103 1HB LEU 103 1.470 -2.458 5.270 774 HG LEU 103 HG LEU 103 -0.491 -4.731 5.373 775 HD11 LEU 103 1HD1 LEU 103 -1.039 -2.910 6.862 776 HD12 LEU 103 2HD1 LEU 103 -2.142 -2.925 5.486 777 HD13 LEU 103 3HD1 LEU 103 -0.829 -1.750 5.555 778 HD21 LEU 103 3HD2 LEU 103 -0.268 -4.587 3.120 779 HD22 LEU 103 1HD2 LEU 103 0.371 -2.943 3.179 780 HD23 LEU 103 2HD2 LEU 103 -1.360 -3.222 3.353 781 H ASP 104 H ASP 104 2.022 -5.869 6.731 782 HA ASP 104 HA ASP 104 1.852 -8.337 5.251 783 HB2 ASP 104 2HB ASP 104 1.787 -9.430 7.422 784 HB3 ASP 104 1HB ASP 104 3.057 -8.198 7.412 785 HA PRO 105 HA PRO 105 -2.487 -8.702 4.582 786 HB2 PRO 105 2HB PRO 105 -2.099 -11.486 5.594 787 HB3 PRO 105 1HB PRO 105 -2.882 -10.921 4.105 788 HG2 PRO 105 2HG PRO 105 -0.440 -11.985 4.043 789 HG3 PRO 105 1HG PRO 105 -0.864 -10.600 3.011 790 HD2 PRO 105 2HD PRO 105 0.783 -10.685 5.496 791 HD3 PRO 105 1HD PRO 105 0.950 -9.651 4.064 792 H SER 106 H SER 106 -3.239 -7.383 6.232 793 HA SER 106 HA SER 106 -5.026 -8.285 8.031 794 HB2 SER 106 2HB SER 106 -2.271 -8.564 9.123 795 HB3 SER 106 1HB SER 106 -3.487 -7.869 10.210 796 HG SER 106 HG SER 106 -4.796 -9.769 9.558 797 H GLY 107 H GLY 107 -2.476 -6.021 7.368 798 HA2 GLY 107 2HA GLY 107 -3.127 -3.699 7.025 799 HA3 GLY 107 1HA GLY 107 -4.186 -3.862 8.431 800 H LYS 108 H LYS 108 -0.837 -4.997 8.105 801 HA LYS 108 HA LYS 108 -0.126 -3.085 10.249 802 HB2 LYS 108 2HB LYS 108 0.303 -5.973 9.997 803 HB3 LYS 108 1HB LYS 108 1.744 -5.079 10.463 804 HG2 LYS 108 2HG LYS 108 -0.524 -4.175 11.981 805 HG3 LYS 108 1HG LYS 108 -0.349 -5.934 12.108 806 HD2 LYS 108 2HD LYS 108 2.010 -5.627 12.743 807 HD3 LYS 108 1HD LYS 108 1.797 -3.877 12.659 808 HE2 LYS 108 2HE LYS 108 0.891 -3.806 14.694 809 HE3 LYS 108 1HE LYS 108 -0.226 -5.118 14.317 810 HZ1 LYS 108 3HZ LYS 108 1.504 -6.708 14.830 811 HZ2 LYS 108 1HZ LYS 108 1.260 -5.679 16.151 812 HZ3 LYS 108 2HZ LYS 108 2.605 -5.465 15.148 813 H VAL 109 H VAL 109 0.478 -1.570 8.548 814 HA VAL 109 HA VAL 109 2.396 -2.002 6.587 815 HB VAL 109 HB VAL 109 1.597 0.462 8.108 816 HG11 VAL 109 1HG1 VAL 109 2.810 1.726 6.327 817 HG12 VAL 109 2HG1 VAL 109 3.582 0.204 5.876 818 HG13 VAL 109 3HG1 VAL 109 3.836 0.880 7.485 819 HG21 VAL 109 3HG2 VAL 109 0.668 1.064 5.836 820 HG22 VAL 109 1HG2 VAL 109 -0.133 -0.263 6.676 821 HG23 VAL 109 2HG2 VAL 109 0.994 -0.603 5.363 822 H HIS 110 H HIS 110 4.500 -2.105 6.509 823 HA HIS 110 HA HIS 110 6.045 -1.348 8.883 824 HB2 HIS 110 2HB HIS 110 5.523 -3.897 8.713 825 HB3 HIS 110 1HB HIS 110 6.717 -3.884 7.419 826 HD1 HIS 110 1HD HIS 110 6.611 -2.498 10.972 827 HD2 HIS 110 2HD HIS 110 9.133 -4.564 8.396 828 HE1 HIS 110 1HE HIS 110 8.711 -2.928 12.288 829 HE2 HIS 110 2HE HIS 110 10.188 -4.253 10.737 830 HA PRO 111 HA PRO 111 8.436 0.552 5.673 831 HB2 PRO 111 2HB PRO 111 10.653 1.175 7.112 832 HB3 PRO 111 1HB PRO 111 9.133 2.065 7.266 833 HG2 PRO 111 2HG PRO 111 10.249 -0.093 9.012 834 HG3 PRO 111 1HG PRO 111 9.448 1.418 9.476 835 HD2 PRO 111 2HD PRO 111 8.175 -0.979 9.463 836 HD3 PRO 111 1HD PRO 111 7.342 0.554 9.119 837 H GLU 112 H GLU 112 8.442 -2.303 5.759 838 HA GLU 112 HA GLU 112 11.259 -3.043 5.516 839 HB2 GLU 112 2HB GLU 112 8.970 -4.398 6.415 840 HB3 GLU 112 1HB GLU 112 9.408 -5.175 4.901 841 HG2 GLU 112 2HG GLU 112 11.817 -5.110 5.993 842 HG3 GLU 112 1HG GLU 112 10.866 -5.072 7.478 843 H ILE 113 H ILE 113 8.415 -2.485 3.580 844 HA ILE 113 HA ILE 113 10.020 -3.069 1.180 845 HB ILE 113 HB ILE 113 7.037 -3.415 1.280 846 HG12 ILE 113 2HG1 ILE 113 8.359 -5.932 1.095 847 HG13 ILE 113 1HG1 ILE 113 9.008 -5.083 2.506 848 HG21 ILE 113 1HG2 ILE 113 8.929 -4.743 -0.614 849 HG22 ILE 113 2HG2 ILE 113 8.426 -3.074 -0.881 850 HG23 ILE 113 3HG2 ILE 113 7.220 -4.359 -0.825 851 HD11 ILE 113 3HD1 ILE 113 7.247 -6.115 3.478 852 HD12 ILE 113 1HD1 ILE 113 6.289 -6.134 1.998 853 HD13 ILE 113 2HD1 ILE 113 6.427 -4.650 2.939 854 H ILE 114 H ILE 114 10.525 -1.203 0.309 855 HA ILE 114 HA ILE 114 8.424 0.834 -0.033 856 HB ILE 114 HB ILE 114 10.043 2.581 0.258 857 HG12 ILE 114 2HG1 ILE 114 11.967 0.335 0.008 858 HG13 ILE 114 1HG1 ILE 114 12.071 1.978 -0.588 859 HG21 ILE 114 1HG2 ILE 114 10.652 2.310 2.578 860 HG22 ILE 114 2HG2 ILE 114 10.425 0.563 2.461 861 HG23 ILE 114 3HG2 ILE 114 9.041 1.645 2.294 862 HD11 ILE 114 3HD1 ILE 114 12.667 0.989 2.180 863 HD12 ILE 114 1HD1 ILE 114 12.532 2.699 1.771 864 HD13 ILE 114 2HD1 ILE 114 13.783 1.709 1.019 865 H ASN 115 H ASN 115 10.445 2.457 -1.574 866 HA ASN 115 HA ASN 115 10.206 0.982 -4.095 867 HB2 ASN 115 2HB ASN 115 9.235 3.304 -3.863 868 HB3 ASN 115 1HB ASN 115 10.892 3.902 -3.720 869 HD21 ASN 115 1HD2 ASN 115 9.598 4.999 -5.668 870 HD22 ASN 115 2HD2 ASN 115 10.020 4.330 -7.221 871 H GLU 116 H GLU 116 12.148 -0.165 -2.811 872 HA GLU 116 HA GLU 116 14.674 0.884 -2.645 873 HB2 GLU 116 2HB GLU 116 13.509 -1.716 -2.674 874 HB3 GLU 116 1HB GLU 116 14.942 -1.748 -3.707 875 HG2 GLU 116 2HG GLU 116 14.944 -0.672 -0.900 876 HG3 GLU 116 1HG GLU 116 15.310 -2.349 -1.301 877 H ASN 117 H ASN 117 12.906 0.053 -5.521 878 HA ASN 117 HA ASN 117 15.232 0.153 -7.234 879 HB2 ASN 117 2HB ASN 117 12.490 -0.718 -7.466 880 HB3 ASN 117 1HB ASN 117 12.905 0.354 -8.812 881 HD21 ASN 117 1HD2 ASN 117 13.849 -2.563 -7.089 882 HD22 ASN 117 2HD2 ASN 117 14.680 -3.305 -8.430 883 H GLY 118 H GLY 118 12.793 2.339 -6.085 884 HA2 GLY 118 2HA GLY 118 13.147 4.302 -8.151 885 HA3 GLY 118 1HA GLY 118 12.292 4.529 -6.622 886 H ASN 119 H ASN 119 13.436 6.681 -6.988 887 HA ASN 119 HA ASN 119 16.204 6.963 -6.688 888 HB2 ASN 119 2HB ASN 119 13.868 8.686 -6.642 889 HB3 ASN 119 1HB ASN 119 15.088 9.220 -5.480 890 HD21 ASN 119 1HD2 ASN 119 15.811 10.993 -6.512 891 HD22 ASN 119 2HD2 ASN 119 16.595 10.970 -8.069 892 HA PRO 120 HA PRO 120 16.602 5.893 -2.373 893 HB2 PRO 120 2HB PRO 120 19.311 6.922 -2.420 894 HB3 PRO 120 1HB PRO 120 18.764 5.238 -2.372 895 HG2 PRO 120 2HG PRO 120 20.018 6.368 -4.525 896 HG3 PRO 120 1HG PRO 120 18.888 5.000 -4.641 897 HD2 PRO 120 2HD PRO 120 18.414 7.912 -5.178 898 HD3 PRO 120 1HD PRO 120 17.830 6.482 -6.068 899 H SER 121 H SER 121 15.393 8.446 -2.925 900 HA SER 121 HA SER 121 16.454 9.944 -0.646 901 HB2 SER 121 2HB SER 121 16.945 10.805 -3.177 902 HB3 SER 121 1HB SER 121 15.398 11.607 -2.851 903 HG SER 121 HG SER 121 16.465 12.278 -0.808 904 H TYR 122 H TYR 122 13.882 8.377 -1.950 905 HA TYR 122 HA TYR 122 12.060 9.747 -0.177 906 HB2 TYR 122 2HB TYR 122 10.299 9.993 -1.895 907 HB3 TYR 122 1HB TYR 122 11.707 11.010 -2.190 908 HD1 TYR 122 1HD TYR 122 10.525 7.567 -3.119 909 HD2 TYR 122 2HD TYR 122 12.323 11.209 -4.381 910 HE1 TYR 122 1HE TYR 122 10.620 6.715 -5.419 911 HE2 TYR 122 2HE TYR 122 12.420 10.367 -6.687 912 HH TYR 122 HH TYR 122 10.721 8.133 -7.902 913 H LYS 123 H LYS 123 12.696 7.056 -2.341 914 HA LYS 123 HA LYS 123 11.934 4.912 -2.386 915 HB2 LYS 123 2HB LYS 123 11.819 5.594 0.540 916 HB3 LYS 123 1HB LYS 123 11.322 4.009 -0.029 917 HG2 LYS 123 2HG LYS 123 14.042 5.255 -0.383 918 HG3 LYS 123 1HG LYS 123 13.607 3.968 0.756 919 HD2 LYS 123 2HD LYS 123 13.952 2.424 -0.800 920 HD3 LYS 123 1HD LYS 123 12.795 3.209 -1.885 921 HE2 LYS 123 2HE LYS 123 15.445 4.474 -1.636 922 HE3 LYS 123 1HE LYS 123 15.410 2.907 -2.443 923 HZ1 LYS 123 3HZ LYS 123 14.144 5.439 -3.249 924 HZ2 LYS 123 1HZ LYS 123 13.477 3.972 -3.763 925 HZ3 LYS 123 2HZ LYS 123 15.069 4.367 -4.171 926 H TYR 124 H TYR 124 9.808 5.727 0.274 927 HA TYR 124 HA TYR 124 7.546 4.518 -0.600 928 HB2 TYR 124 2HB TYR 124 7.807 7.008 1.086 929 HB3 TYR 124 1HB TYR 124 6.299 6.100 0.896 930 HD1 TYR 124 1HD TYR 124 9.802 5.832 2.112 931 HD2 TYR 124 2HD TYR 124 5.885 4.178 2.184 932 HE1 TYR 124 1HE TYR 124 10.478 4.331 3.932 933 HE2 TYR 124 2HE TYR 124 6.550 2.673 4.011 934 HH TYR 124 HH TYR 124 9.653 2.969 5.598 935 H PHE 125 H PHE 125 8.721 7.656 -1.641 936 HA PHE 125 HA PHE 125 6.261 8.478 -2.846 937 HB2 PHE 125 2HB PHE 125 8.367 9.895 -2.177 938 HB3 PHE 125 1HB PHE 125 8.929 9.465 -3.797 939 HD1 PHE 125 2HD PHE 125 6.810 9.697 -5.569 940 HD2 PHE 125 1HD PHE 125 7.505 12.003 -2.061 941 HE1 PHE 125 2HE PHE 125 5.484 11.537 -6.520 942 HE2 PHE 125 1HE PHE 125 6.181 13.848 -3.007 943 HZ PHE 125 HZ PHE 125 5.171 13.616 -5.241 944 H TYR 126 H TYR 126 5.421 7.897 -4.771 945 HA TYR 126 HA TYR 126 7.188 6.457 -6.634 946 HB2 TYR 126 2HB TYR 126 4.540 5.718 -5.531 947 HB3 TYR 126 1HB TYR 126 4.803 5.376 -7.247 948 HD1 TYR 126 1HD TYR 126 5.880 4.597 -3.822 949 HD2 TYR 126 2HD TYR 126 6.367 3.679 -7.945 950 HE1 TYR 126 1HE TYR 126 7.084 2.543 -3.215 951 HE2 TYR 126 2HE TYR 126 7.575 1.621 -7.352 952 HH TYR 126 HH TYR 126 7.591 0.043 -5.235 953 H VAL 127 H VAL 127 7.563 8.029 -8.115 954 HA VAL 127 HA VAL 127 5.214 9.275 -9.385 955 HB VAL 127 HB VAL 127 7.343 10.668 -10.406 956 HG11 VAL 127 1HG1 VAL 127 5.796 12.139 -9.769 957 HG12 VAL 127 2HG1 VAL 127 6.630 12.168 -8.215 958 HG13 VAL 127 3HG1 VAL 127 5.237 11.112 -8.449 959 HG21 VAL 127 3HG2 VAL 127 7.977 10.341 -7.482 960 HG22 VAL 127 1HG2 VAL 127 8.903 11.204 -8.712 961 HG23 VAL 127 2HG2 VAL 127 8.814 9.443 -8.749 962 H SER 128 H SER 128 5.254 6.938 -10.271 963 HA SER 128 HA SER 128 5.578 6.902 -12.962 964 HB2 SER 128 2HB SER 128 7.907 7.181 -12.989 965 HB3 SER 128 1HB SER 128 8.141 6.133 -11.579 966 HG SER 128 HG SER 128 7.329 5.310 -14.176 967 H ALA 129 H ALA 129 4.327 5.264 -13.566 968 HA ALA 129 HA ALA 129 3.410 3.273 -11.822 969 HB1 ALA 129 1HB ALA 129 1.992 3.852 -13.597 970 HB2 ALA 129 2HB ALA 129 2.534 2.214 -13.966 971 HB3 ALA 129 3HB ALA 129 3.252 3.591 -14.803 972 H GLU 130 H GLU 130 5.965 3.250 -14.252 973 HA GLU 130 HA GLU 130 6.470 0.559 -14.489 974 HB2 GLU 130 2HB GLU 130 7.830 2.976 -15.103 975 HB3 GLU 130 1HB GLU 130 8.989 1.905 -14.308 976 HG2 GLU 130 2HG GLU 130 9.232 1.381 -16.546 977 HG3 GLU 130 1HG GLU 130 8.136 0.121 -15.957 978 H GLN 131 H GLN 131 8.185 2.711 -12.210 979 HA GLN 131 HA GLN 131 9.537 0.744 -10.830 980 HB2 GLN 131 2HB GLN 131 9.371 2.403 -8.853 981 HB3 GLN 131 1HB GLN 131 10.277 2.847 -10.291 982 HG2 GLN 131 2HG GLN 131 8.311 4.112 -11.093 983 HG3 GLN 131 1HG GLN 131 7.485 3.726 -9.584 984 HE21 GLN 131 1HE2 GLN 131 7.520 5.320 -8.193 985 HE22 GLN 131 2HE2 GLN 131 8.790 6.472 -7.980 986 H VAL 132 H VAL 132 6.247 1.918 -10.258 987 HA VAL 132 HA VAL 132 5.734 0.764 -7.808 988 HB VAL 132 HB VAL 132 3.516 1.093 -8.139 989 HG11 VAL 132 1HG1 VAL 132 4.552 2.617 -10.508 990 HG12 VAL 132 2HG1 VAL 132 4.673 3.143 -8.829 991 HG13 VAL 132 3HG1 VAL 132 3.090 2.962 -9.588 992 HG21 VAL 132 3HG2 VAL 132 2.475 0.865 -10.517 993 HG22 VAL 132 1HG2 VAL 132 2.818 -0.575 -9.558 994 HG23 VAL 132 2HG2 VAL 132 3.918 -0.090 -10.846 995 H VAL 133 H VAL 133 5.779 -0.776 -10.980 996 HA VAL 133 HA VAL 133 4.852 -3.300 -9.970 997 HB VAL 133 HB VAL 133 4.547 -2.557 -12.355 998 HG11 VAL 133 1HG1 VAL 133 6.875 -3.552 -13.527 999 HG12 VAL 133 2HG1 VAL 133 7.426 -2.482 -12.240 1000 HG13 VAL 133 3HG1 VAL 133 6.336 -1.872 -13.483 1001 HG21 VAL 133 3HG2 VAL 133 5.992 -5.180 -12.235 1002 HG22 VAL 133 1HG2 VAL 133 4.566 -4.740 -13.176 1003 HG23 VAL 133 2HG2 VAL 133 4.440 -4.950 -11.429 1004 H GLN 134 H GLN 134 7.936 -1.721 -10.300 1005 HA GLN 134 HA GLN 134 9.531 -4.089 -10.214 1006 HB2 GLN 134 2HB GLN 134 10.424 -1.388 -9.248 1007 HB3 GLN 134 1HB GLN 134 11.374 -2.651 -10.007 1008 HG2 GLN 134 2HG GLN 134 9.180 -1.318 -11.524 1009 HG3 GLN 134 1HG GLN 134 10.743 -0.544 -11.337 1010 HE21 GLN 134 1HE2 GLN 134 9.178 -3.497 -12.439 1011 HE22 GLN 134 2HE2 GLN 134 10.369 -3.892 -13.649 1012 H GLY 135 H GLY 135 8.760 -1.591 -7.834 1013 HA2 GLY 135 2HA GLY 135 9.851 -2.911 -5.593 1014 HA3 GLY 135 1HA GLY 135 8.608 -1.650 -5.539 1015 H MET 136 H MET 136 6.958 -3.314 -7.424 1016 HA MET 136 HA MET 136 5.595 -4.874 -5.378 1017 HB2 MET 136 2HB MET 136 4.970 -3.926 -8.128 1018 HB3 MET 136 1HB MET 136 4.174 -5.397 -7.588 1019 HG2 MET 136 2HG MET 136 2.996 -4.311 -5.929 1020 HG3 MET 136 1HG MET 136 4.130 -2.963 -5.865 1021 HE1 MET 136 3HE MET 136 1.305 -4.733 -7.579 1022 HE2 MET 136 1HE MET 136 2.126 -4.509 -9.124 1023 HE3 MET 136 2HE MET 136 0.659 -3.599 -8.765 1024 H LYS 137 H LYS 137 7.656 -5.232 -8.093 1025 HA LYS 137 HA LYS 137 7.326 -8.035 -8.496 1026 HB2 LYS 137 2HB LYS 137 8.907 -5.816 -9.594 1027 HB3 LYS 137 1HB LYS 137 9.734 -7.354 -9.627 1028 HG2 LYS 137 2HG LYS 137 7.180 -6.570 -10.982 1029 HG3 LYS 137 1HG LYS 137 8.671 -7.168 -11.705 1030 HD2 LYS 137 2HD LYS 137 8.228 -9.337 -10.453 1031 HD3 LYS 137 1HD LYS 137 6.616 -8.695 -10.127 1032 HE2 LYS 137 2HE LYS 137 5.918 -9.033 -12.236 1033 HE3 LYS 137 1HE LYS 137 7.455 -8.519 -12.931 1034 HZ1 LYS 137 3HZ LYS 137 6.776 -11.188 -11.832 1035 HZ2 LYS 137 1HZ LYS 137 8.355 -10.720 -12.219 1036 HZ3 LYS 137 2HZ LYS 137 7.177 -10.801 -13.429 1037 H GLU 138 H GLU 138 9.006 -6.140 -6.218 1038 HA GLU 138 HA GLU 138 11.079 -8.113 -5.723 1039 HB2 GLU 138 2HB GLU 138 11.529 -5.652 -5.582 1040 HB3 GLU 138 1HB GLU 138 10.467 -5.593 -4.175 1041 HG2 GLU 138 2HG GLU 138 12.494 -7.644 -3.906 1042 HG3 GLU 138 1HG GLU 138 13.198 -6.043 -4.183 1043 H ALA 139 H ALA 139 8.706 -6.474 -3.647 1044 HA ALA 139 HA ALA 139 8.829 -8.324 -1.549 1045 HB1 ALA 139 1HB ALA 139 6.359 -7.359 -1.210 1046 HB2 ALA 139 2HB ALA 139 6.975 -6.162 -2.351 1047 HB3 ALA 139 3HB ALA 139 7.809 -6.436 -0.821 1048 H GLN 140 H GLN 140 7.320 -8.543 -4.622 1049 HA GLN 140 HA GLN 140 5.191 -10.267 -4.083 1050 HB2 GLN 140 2HB GLN 140 6.583 -9.272 -6.396 1051 HB3 GLN 140 1HB GLN 140 6.244 -10.992 -6.594 1052 HG2 GLN 140 2HG GLN 140 3.891 -9.879 -5.583 1053 HG3 GLN 140 1HG GLN 140 4.470 -8.744 -6.800 1054 HE21 GLN 140 1HE2 GLN 140 5.185 -9.806 -8.880 1055 HE22 GLN 140 2HE2 GLN 140 4.179 -11.071 -9.489 1056 H GLU 141 H GLU 141 8.544 -10.862 -3.856 1057 HA GLU 141 HA GLU 141 8.159 -13.753 -4.163 1058 HB2 GLU 141 2HB GLU 141 9.972 -12.894 -5.481 1059 HB3 GLU 141 1HB GLU 141 10.658 -12.061 -4.082 1060 HG2 GLU 141 2HG GLU 141 11.534 -13.974 -3.199 1061 HG3 GLU 141 1HG GLU 141 10.322 -15.010 -3.950 1062 H ARG 142 H ARG 142 8.899 -11.301 -1.805 1063 HA ARG 142 HA ARG 142 9.609 -13.318 0.186 1064 HB2 ARG 142 2HB ARG 142 9.536 -10.314 0.500 1065 HB3 ARG 142 1HB ARG 142 10.284 -11.480 1.597 1066 HG2 ARG 142 2HG ARG 142 12.176 -11.478 0.437 1067 HG3 ARG 142 1HG ARG 142 11.320 -11.752 -1.090 1068 HD2 ARG 142 2HD ARG 142 10.855 -9.369 -1.276 1069 HD3 ARG 142 1HD ARG 142 11.649 -9.078 0.280 1070 HE ARG 142 HE ARG 142 12.919 -9.517 -2.269 1071 HH11 ARG 142 1HH1 ARG 142 13.312 -9.638 1.198 1072 HH12 ARG 142 2HH1 ARG 142 15.035 -9.484 1.132 1073 HH21 ARG 142 1HH2 ARG 142 15.186 -9.316 -2.356 1074 HH22 ARG 142 2HH2 ARG 142 16.100 -9.302 -0.886 1075 H LEU 143 H LEU 143 7.281 -10.647 -0.180 1076 HA LEU 143 HA LEU 143 5.870 -11.190 2.195 1077 HB2 LEU 143 2HB LEU 143 5.150 -9.696 -0.314 1078 HB3 LEU 143 1HB LEU 143 4.026 -9.852 1.036 1079 HG LEU 143 HG LEU 143 5.298 -7.706 1.004 1080 HD11 LEU 143 1HD1 LEU 143 4.491 -8.045 3.098 1081 HD12 LEU 143 2HD1 LEU 143 6.215 -8.137 3.459 1082 HD13 LEU 143 3HD1 LEU 143 5.275 -9.616 3.269 1083 HD21 LEU 143 3HD2 LEU 143 7.633 -7.682 1.596 1084 HD22 LEU 143 1HD2 LEU 143 7.416 -8.660 0.145 1085 HD23 LEU 143 2HD2 LEU 143 7.663 -9.441 1.706 1086 H THR 144 H THR 144 5.294 -12.215 -1.158 1087 HA THR 144 HA THR 144 2.827 -13.415 -0.859 1088 HB THR 144 HB THR 144 3.575 -14.908 -2.739 1089 HG1 THR 144 1HG THR 144 5.629 -14.432 -3.619 1090 HG21 THR 144 3HG2 THR 144 3.888 -13.146 -4.388 1091 HG22 THR 144 1HG2 THR 144 4.166 -11.984 -3.089 1092 HG23 THR 144 2HG2 THR 144 2.589 -12.757 -3.259 1093 H GLY 145 H GLY 145 5.985 -14.571 0.111 1094 HA2 GLY 145 2HA GLY 145 4.892 -17.189 0.824 1095 HA3 GLY 145 1HA GLY 145 6.587 -16.728 0.861 1096 H ASP 146 H ASP 146 7.431 -15.710 2.672 1097 HA ASP 146 HA ASP 146 5.880 -14.771 4.837 1098 HB2 ASP 146 2HB ASP 146 6.626 -17.639 4.844 1099 HB3 ASP 146 1HB ASP 146 6.914 -16.761 6.341 1100 H ALA 147 H ALA 147 8.106 -13.905 3.323 1101 HA ALA 147 HA ALA 147 10.400 -14.140 5.113 1102 HB1 ALA 147 1HB ALA 147 10.003 -13.332 2.299 1103 HB2 ALA 147 2HB ALA 147 11.291 -14.283 3.038 1104 HB3 ALA 147 3HB ALA 147 11.301 -12.524 3.177 1105 H PHE 148 H PHE 148 7.863 -12.573 5.687 1106 HA PHE 148 HA PHE 148 9.139 -9.958 6.158 1107 HB2 PHE 148 2HB PHE 148 6.843 -9.010 6.212 1108 HB3 PHE 148 1HB PHE 148 7.252 -9.728 4.646 1109 HD1 PHE 148 1HD PHE 148 6.345 -11.992 4.081 1110 HD2 PHE 148 2HD PHE 148 5.011 -9.774 7.460 1111 HE1 PHE 148 1HE PHE 148 4.323 -13.389 4.195 1112 HE2 PHE 148 2HE PHE 148 2.986 -11.168 7.579 1113 HZ PHE 148 HZ PHE 148 2.640 -12.978 5.945 1114 H ARG 149 H ARG 149 7.107 -12.504 7.504 1115 HA ARG 149 HA ARG 149 6.658 -11.314 10.019 1116 HB2 ARG 149 2HB ARG 149 6.677 -14.211 9.163 1117 HB3 ARG 149 1HB ARG 149 6.113 -13.644 10.725 1118 HG2 ARG 149 2HG ARG 149 4.531 -12.139 9.341 1119 HG3 ARG 149 1HG ARG 149 4.892 -13.262 8.030 1120 HD2 ARG 149 2HD ARG 149 3.402 -14.690 8.844 1121 HD3 ARG 149 1HD ARG 149 4.321 -14.794 10.346 1122 HE ARG 149 HE ARG 149 2.785 -13.417 11.348 1123 HH11 ARG 149 1HH1 ARG 149 2.322 -13.318 7.890 1124 HH12 ARG 149 2HH1 ARG 149 0.837 -12.431 7.989 1125 HH21 ARG 149 1HH2 ARG 149 0.834 -12.250 11.480 1126 HH22 ARG 149 2HH2 ARG 149 -0.007 -11.824 10.026 1127 H LYS 150 H LYS 150 8.065 -10.918 11.586 1128 HA LYS 150 HA LYS 150 9.887 -12.761 12.622 1129 HB2 LYS 150 2HB LYS 150 12.014 -11.504 11.944 1130 HB3 LYS 150 1HB LYS 150 11.288 -12.570 10.750 1131 HG2 LYS 150 2HG LYS 150 11.097 -10.904 9.309 1132 HG3 LYS 150 1HG LYS 150 10.182 -9.948 10.476 1133 HD2 LYS 150 2HD LYS 150 11.947 -8.654 10.948 1134 HD3 LYS 150 1HD LYS 150 13.032 -10.039 11.077 1135 HE2 LYS 150 2HE LYS 150 12.239 -9.555 8.336 1136 HE3 LYS 150 1HE LYS 150 12.987 -8.130 9.056 1137 HZ1 LYS 150 3HZ LYS 150 14.530 -9.755 7.945 1138 HZ2 LYS 150 1HZ LYS 150 14.210 -10.822 9.217 1139 HZ3 LYS 150 2HZ LYS 150 14.938 -9.328 9.530 1140 H LYS 151 H LYS 151 9.154 -9.365 12.078 1141 HA LYS 151 HA LYS 151 10.403 -8.469 14.497 1142 HB2 LYS 151 2HB LYS 151 9.373 -6.310 13.987 1143 HB3 LYS 151 1HB LYS 151 10.163 -6.980 12.564 1144 HG2 LYS 151 2HG LYS 151 7.339 -7.696 12.799 1145 HG3 LYS 151 1HG LYS 151 7.637 -5.964 12.636 1146 HD2 LYS 151 2HD LYS 151 8.542 -6.179 10.537 1147 HD3 LYS 151 1HD LYS 151 9.078 -7.836 10.822 1148 HE2 LYS 151 2HE LYS 151 7.313 -8.083 9.325 1149 HE3 LYS 151 1HE LYS 151 6.576 -8.415 10.891 1150 HZ1 LYS 151 3HZ LYS 151 5.069 -6.925 10.216 1151 HZ2 LYS 151 1HZ LYS 151 6.086 -6.248 9.046 1152 HZ3 LYS 151 2HZ LYS 151 6.217 -5.767 10.661 1153 H HIS 152 H HIS 152 9.341 -7.633 16.355 1154 HA HIS 152 HA HIS 152 6.577 -7.770 16.812 1155 HB2 HIS 152 2HB HIS 152 6.620 -9.727 18.432 1156 HB3 HIS 152 1HB HIS 152 6.694 -10.138 16.720 1157 HD1 HIS 152 1HD HIS 152 9.898 -8.903 17.865 1158 HD2 HIS 152 2HD HIS 152 7.923 -12.560 17.866 1159 HE1 HIS 152 1HE HIS 152 11.681 -10.629 18.252 1160 HE2 HIS 152 2HE HIS 152 10.452 -12.827 18.341 1161 H LEU 153 H LEU 153 6.919 -5.819 17.832 1162 HA LEU 153 HA LEU 153 8.856 -5.486 19.909 1163 HB2 LEU 153 2HB LEU 153 6.738 -3.838 18.655 1164 HB3 LEU 153 1HB LEU 153 7.198 -3.401 20.289 1165 HG LEU 153 HG LEU 153 9.585 -3.285 19.483 1166 HD11 LEU 153 1HD1 LEU 153 9.890 -4.311 17.503 1167 HD12 LEU 153 2HD1 LEU 153 9.412 -2.745 16.846 1168 HD13 LEU 153 3HD1 LEU 153 8.225 -4.042 16.986 1169 HD21 LEU 153 3HD2 LEU 153 8.939 -1.153 18.002 1170 HD22 LEU 153 1HD2 LEU 153 8.804 -1.178 19.760 1171 HD23 LEU 153 2HD2 LEU 153 7.377 -1.458 18.762 1172 H GLU 154 H GLU 154 5.346 -4.963 20.169 1173 HA GLU 154 HA GLU 154 3.863 -5.391 21.839 1174 HB2 GLU 154 2HB GLU 154 5.158 -7.781 21.290 1175 HB3 GLU 154 1HB GLU 154 5.260 -7.652 23.040 1176 HG2 GLU 154 2HG GLU 154 2.724 -7.459 21.432 1177 HG3 GLU 154 1HG GLU 154 3.284 -8.895 22.288 1178 H ASP 155 H ASP 155 6.139 -3.656 22.377 1179 HA ASP 155 HA ASP 155 5.889 -3.582 25.261 1180 HB2 ASP 155 2HB ASP 155 8.061 -4.921 24.282 1181 HB3 ASP 155 1HB ASP 155 8.701 -3.288 24.436 1182 H GLU 156 H GLU 156 7.436 -1.641 26.036 1183 HA GLU 156 HA GLU 156 7.685 0.500 24.140 1184 HB2 GLU 156 2HB GLU 156 5.172 0.222 25.168 1185 HB3 GLU 156 1HB GLU 156 5.902 1.334 26.333 1186 HG2 GLU 156 2HG GLU 156 5.825 1.749 23.351 1187 HG3 GLU 156 1HG GLU 156 4.718 2.483 24.510 1188 H LEU 157 H LEU 157 9.340 -0.935 26.054 1189 HA LEU 157 HA LEU 157 10.990 -0.524 27.563 1190 HB2 LEU 157 2HB LEU 157 11.007 1.590 25.902 1191 HB3 LEU 157 1HB LEU 157 10.653 2.415 27.409 1192 HG LEU 157 HG LEU 157 13.042 2.435 26.967 1193 HD11 LEU 157 1HD1 LEU 157 12.510 2.433 29.267 1194 HD12 LEU 157 2HD1 LEU 157 13.810 1.258 29.066 1195 HD13 LEU 157 3HD1 LEU 157 12.145 0.708 29.258 1196 HD21 LEU 157 3HD2 LEU 157 14.280 0.647 26.360 1197 HD22 LEU 157 1HD2 LEU 157 12.723 0.036 25.802 1198 HD23 LEU 157 2HD2 LEU 157 13.359 -0.469 27.368 Start of MODEL 11 1 H1 MET 1 1HT MET 1 -24.977 9.618 -7.566 2 H2 MET 1 2HT MET 1 -26.582 10.112 -7.219 3 H3 MET 1 3HT MET 1 -25.316 11.269 -7.253 4 HA MET 1 HA MET 1 -26.575 9.826 -9.466 5 HB2 MET 1 2HB MET 1 -27.469 12.002 -8.621 6 HB3 MET 1 1HB MET 1 -25.918 12.742 -8.998 7 HG2 MET 1 2HG MET 1 -26.306 11.920 -11.382 8 HG3 MET 1 1HG MET 1 -27.973 11.645 -10.879 9 HE1 MET 1 2HE MET 1 -25.232 13.711 -11.800 10 HE2 MET 1 3HE MET 1 -25.413 15.180 -10.842 11 HE3 MET 1 1HE MET 1 -26.023 15.126 -12.496 12 H HIS 2 H HIS 2 -25.119 8.815 -10.704 13 HA HIS 2 HA HIS 2 -22.723 10.315 -11.508 14 HB2 HIS 2 2HB HIS 2 -22.486 8.272 -9.791 15 HB3 HIS 2 1HB HIS 2 -22.485 7.359 -11.297 16 HD1 HIS 2 1HD HIS 2 -20.608 10.259 -9.710 17 HD2 HIS 2 2HD HIS 2 -20.055 7.230 -12.501 18 HE1 HIS 2 1HE HIS 2 -18.183 10.382 -10.365 19 HE2 HIS 2 2HE HIS 2 -17.854 8.493 -11.998 20 H HIS 3 H HIS 3 -24.815 7.534 -12.227 21 HA HIS 3 HA HIS 3 -24.185 7.866 -15.078 22 HB2 HIS 3 2HB HIS 3 -24.714 5.554 -13.377 23 HB3 HIS 3 1HB HIS 3 -25.691 5.548 -14.841 24 HD1 HIS 3 1HD HIS 3 -22.086 5.574 -13.727 25 HD2 HIS 3 2HD HIS 3 -24.346 4.884 -17.146 26 HE1 HIS 3 1HE HIS 3 -20.477 4.640 -15.421 27 HE2 HIS 3 2HE HIS 3 -21.885 4.151 -17.453 28 H HIS 4 H HIS 4 -27.031 6.742 -13.245 29 HA HIS 4 HA HIS 4 -28.724 8.831 -14.126 30 HB2 HIS 4 2HB HIS 4 -30.183 7.455 -15.623 31 HB3 HIS 4 1HB HIS 4 -28.591 7.794 -16.294 32 HD1 HIS 4 1HD HIS 4 -26.907 5.785 -16.408 33 HD2 HIS 4 2HD HIS 4 -30.759 4.779 -15.214 34 HE1 HIS 4 1HE HIS 4 -27.039 3.281 -16.604 35 HE2 HIS 4 2HE HIS 4 -29.405 2.703 -15.957 36 H HIS 5 H HIS 5 -30.859 8.655 -13.296 37 HA HIS 5 HA HIS 5 -32.406 8.093 -11.727 38 HB2 HIS 5 2HB HIS 5 -31.414 5.480 -12.720 39 HB3 HIS 5 1HB HIS 5 -32.313 5.450 -11.207 40 HD1 HIS 5 1HD HIS 5 -32.741 6.666 -14.779 41 HD2 HIS 5 2HD HIS 5 -35.014 5.464 -11.515 42 HE1 HIS 5 1HE HIS 5 -35.114 6.588 -15.605 43 HE2 HIS 5 2HE HIS 5 -36.482 5.946 -13.590 44 H HIS 6 H HIS 6 -32.661 6.934 -9.515 45 HA HIS 6 HA HIS 6 -32.012 6.792 -7.342 46 HB2 HIS 6 2HB HIS 6 -29.863 5.577 -8.876 47 HB3 HIS 6 1HB HIS 6 -29.271 6.281 -7.376 48 HD1 HIS 6 1HD HIS 6 -30.321 5.327 -5.144 49 HD2 HIS 6 2HD HIS 6 -31.284 3.234 -8.602 50 HE1 HIS 6 1HE HIS 6 -31.234 3.118 -4.360 51 HE2 HIS 6 2HE HIS 6 -31.892 1.905 -6.468 52 H HIS 7 H HIS 7 -32.029 8.634 -6.242 53 HA HIS 7 HA HIS 7 -29.681 10.378 -6.385 54 HB2 HIS 7 2HB HIS 7 -31.883 11.093 -7.764 55 HB3 HIS 7 1HB HIS 7 -32.298 11.762 -6.190 56 HD1 HIS 7 1HD HIS 7 -30.451 13.472 -5.179 57 HD2 HIS 7 2HD HIS 7 -30.209 12.645 -9.245 58 HE1 HIS 7 1HE HIS 7 -29.034 15.306 -6.156 59 HE2 HIS 7 2HE HIS 7 -28.834 14.739 -8.602 60 H MET 8 H MET 8 -29.047 9.688 -4.352 61 HA MET 8 HA MET 8 -30.284 11.021 -2.150 62 HB2 MET 8 2HB MET 8 -30.601 8.870 -0.821 63 HB3 MET 8 1HB MET 8 -31.806 9.216 -2.068 64 HG2 MET 8 2HG MET 8 -31.454 7.158 -2.806 65 HG3 MET 8 1HG MET 8 -29.897 7.731 -3.399 66 HE1 MET 8 3HE MET 8 -31.772 5.488 -0.867 67 HE2 MET 8 1HE MET 8 -31.423 6.893 0.143 68 HE3 MET 8 2HE MET 8 -30.632 5.351 0.471 69 H SER 9 H SER 9 -28.055 8.450 -3.141 70 HA SER 9 HA SER 9 -25.941 9.720 -1.606 71 HB2 SER 9 2HB SER 9 -27.086 7.031 -0.968 72 HB3 SER 9 1HB SER 9 -25.349 7.280 -0.776 73 HG SER 9 HG SER 9 -25.983 9.186 0.504 74 H ASP 10 H ASP 10 -23.841 9.126 -2.273 75 HA ASP 10 HA ASP 10 -23.638 8.446 -5.022 76 HB2 ASP 10 2HB ASP 10 -22.075 9.905 -3.492 77 HB3 ASP 10 1HB ASP 10 -21.269 8.369 -3.192 78 H GLY 11 H GLY 11 -23.842 6.464 -5.818 79 HA2 GLY 11 2HA GLY 11 -23.543 4.124 -4.189 80 HA3 GLY 11 1HA GLY 11 -23.890 4.157 -5.911 81 H HIS 12 H HIS 12 -21.758 3.019 -3.780 82 HA HIS 12 HA HIS 12 -19.637 2.212 -3.899 83 HB2 HIS 12 2HB HIS 12 -20.720 1.966 -6.486 84 HB3 HIS 12 1HB HIS 12 -19.080 2.594 -6.708 85 HD1 HIS 12 1HD HIS 12 -20.694 -0.180 -4.638 86 HD2 HIS 12 2HD HIS 12 -17.295 0.587 -6.902 87 HE1 HIS 12 1HE HIS 12 -19.370 -2.318 -4.610 88 HE2 HIS 12 2HE HIS 12 -17.368 -1.860 -6.069 89 H ASN 13 H ASN 13 -18.427 3.683 -2.822 90 HA ASN 13 HA ASN 13 -17.827 6.281 -3.645 91 HB2 ASN 13 2HB ASN 13 -16.668 4.378 -1.667 92 HB3 ASN 13 1HB ASN 13 -15.718 5.800 -2.088 93 HD21 ASN 13 1HD2 ASN 13 -15.916 6.728 -0.080 94 HD22 ASN 13 2HD2 ASN 13 -17.401 7.392 0.504 95 H GLY 14 H GLY 14 -15.296 6.878 -3.785 96 HA2 GLY 14 2HA GLY 14 -14.400 5.538 -6.241 97 HA3 GLY 14 1HA GLY 14 -13.905 7.144 -5.699 98 H LEU 15 H LEU 15 -12.527 4.456 -6.407 99 HA LEU 15 HA LEU 15 -10.516 4.690 -4.311 100 HB2 LEU 15 2HB LEU 15 -11.306 1.921 -5.087 101 HB3 LEU 15 1HB LEU 15 -10.534 2.489 -3.620 102 HG LEU 15 HG LEU 15 -12.818 3.604 -3.114 103 HD11 LEU 15 1HD1 LEU 15 -14.604 1.935 -4.122 104 HD12 LEU 15 2HD1 LEU 15 -13.438 1.870 -5.441 105 HD13 LEU 15 3HD1 LEU 15 -14.138 3.414 -4.960 106 HD21 LEU 15 3HD2 LEU 15 -13.093 0.665 -2.983 107 HD22 LEU 15 1HD2 LEU 15 -13.250 1.878 -1.714 108 HD23 LEU 15 2HD2 LEU 15 -11.650 1.361 -2.246 109 H GLY 16 H GLY 16 -8.932 5.400 -5.659 110 HA2 GLY 16 2HA GLY 16 -7.078 4.932 -7.020 111 HA3 GLY 16 1HA GLY 16 -7.884 3.467 -7.556 112 H LYS 17 H LYS 17 -9.988 6.084 -7.727 113 HA LYS 17 HA LYS 17 -10.043 6.006 -10.571 114 HB2 LYS 17 2HB LYS 17 -11.892 6.626 -8.753 115 HB3 LYS 17 1HB LYS 17 -11.325 8.254 -9.099 116 HG2 LYS 17 2HG LYS 17 -11.834 7.951 -11.455 117 HG3 LYS 17 1HG LYS 17 -12.355 6.295 -11.142 118 HD2 LYS 17 2HD LYS 17 -14.258 6.982 -9.989 119 HD3 LYS 17 1HD LYS 17 -13.610 8.595 -9.688 120 HE2 LYS 17 2HE LYS 17 -13.646 8.581 -12.384 121 HE3 LYS 17 1HE LYS 17 -15.013 7.519 -12.047 122 HZ1 LYS 17 3HZ LYS 17 -14.790 10.080 -10.623 123 HZ2 LYS 17 1HZ LYS 17 -16.174 9.191 -11.019 124 HZ3 LYS 17 2HZ LYS 17 -15.361 10.068 -12.215 125 H GLY 18 H GLY 18 -8.793 7.079 -11.948 126 HA2 GLY 18 2HA GLY 18 -7.984 9.224 -12.757 127 HA3 GLY 18 1HA GLY 18 -7.654 9.663 -11.078 128 H PHE 19 H PHE 19 -6.782 6.463 -11.622 129 HA PHE 19 HA PHE 19 -4.038 7.203 -12.365 130 HB2 PHE 19 2HB PHE 19 -4.802 5.321 -10.120 131 HB3 PHE 19 1HB PHE 19 -3.154 5.662 -10.667 132 HD1 PHE 19 2HD PHE 19 -3.502 8.638 -11.093 133 HD2 PHE 19 1HD PHE 19 -4.636 6.065 -7.898 134 HE1 PHE 19 2HE PHE 19 -3.391 10.537 -9.526 135 HE2 PHE 19 1HE PHE 19 -4.522 7.958 -6.327 136 HZ PHE 19 HZ PHE 19 -3.897 10.195 -7.141 137 H GLY 20 H GLY 20 -5.653 4.162 -11.452 138 HA2 GLY 20 2HA GLY 20 -4.997 3.148 -14.148 139 HA3 GLY 20 1HA GLY 20 -4.697 2.190 -12.698 140 H ASP 21 H ASP 21 -6.540 1.537 -11.406 141 HA ASP 21 HA ASP 21 -9.210 1.866 -12.127 142 HB2 ASP 21 2HB ASP 21 -7.777 -0.050 -13.776 143 HB3 ASP 21 1HB ASP 21 -9.113 -0.821 -12.906 144 H HIS 22 H HIS 22 -7.759 -1.304 -11.515 145 HA HIS 22 HA HIS 22 -8.670 -1.129 -8.718 146 HB2 HIS 22 2HB HIS 22 -9.194 -3.596 -8.900 147 HB3 HIS 22 1HB HIS 22 -10.265 -2.537 -9.812 148 HD1 HIS 22 1HD HIS 22 -9.978 -2.546 -12.427 149 HD2 HIS 22 2HD HIS 22 -7.763 -5.419 -10.402 150 HE1 HIS 22 1HE HIS 22 -9.240 -4.187 -14.183 151 HE2 HIS 22 2HE HIS 22 -7.985 -5.968 -12.918 152 H ILE 23 H ILE 23 -6.753 -0.879 -7.713 153 HA ILE 23 HA ILE 23 -4.880 -3.075 -7.757 154 HB ILE 23 HB ILE 23 -4.053 -0.284 -8.569 155 HG12 ILE 23 2HG1 ILE 23 -2.994 -1.878 -10.440 156 HG13 ILE 23 1HG1 ILE 23 -4.386 -2.861 -10.006 157 HG21 ILE 23 1HG2 ILE 23 -1.773 -1.486 -8.788 158 HG22 ILE 23 2HG2 ILE 23 -2.458 -2.617 -7.620 159 HG23 ILE 23 3HG2 ILE 23 -2.311 -0.909 -7.214 160 HD11 ILE 23 3HD1 ILE 23 -5.158 -0.115 -10.346 161 HD12 ILE 23 1HD1 ILE 23 -5.737 -1.557 -11.180 162 HD13 ILE 23 2HD1 ILE 23 -4.308 -0.711 -11.772 163 H HIS 24 H HIS 24 -3.971 0.182 -6.771 164 HA HIS 24 HA HIS 24 -3.672 -0.714 -4.052 165 HB2 HIS 24 2HB HIS 24 -3.123 2.075 -5.020 166 HB3 HIS 24 1HB HIS 24 -2.397 1.228 -3.650 167 HD1 HIS 24 1HD HIS 24 -2.030 1.801 -7.285 168 HD2 HIS 24 2HD HIS 24 -0.391 -0.665 -4.370 169 HE1 HIS 24 1HE HIS 24 0.057 0.839 -8.310 170 HE2 HIS 24 2HE HIS 24 0.984 -0.715 -6.560 171 H TRP 25 H TRP 25 -6.292 -0.685 -4.769 172 HA TRP 25 HA TRP 25 -7.416 1.033 -2.762 173 HB2 TRP 25 2HB TRP 25 -9.129 1.662 -4.819 174 HB3 TRP 25 1HB TRP 25 -7.847 2.713 -4.206 175 HD1 TRP 25 HD TRP 25 -8.691 0.414 -7.116 176 HE1 TRP 25 1HE TRP 25 -6.991 0.788 -8.992 177 HE3 TRP 25 3HE TRP 25 -5.451 3.541 -4.711 178 HZ2 TRP 25 2HZ TRP 25 -4.610 2.239 -9.433 179 HZ3 TRP 25 3HZ TRP 25 -3.504 4.372 -5.910 180 HH2 TRP 25 HH TRP 25 -3.078 3.742 -8.234 181 H ARG 26 H ARG 26 -7.160 -1.827 -3.980 182 HA ARG 26 HA ARG 26 -9.561 -2.849 -4.757 183 HB2 ARG 26 2HB ARG 26 -7.150 -3.927 -4.101 184 HB3 ARG 26 1HB ARG 26 -8.136 -4.497 -2.750 185 HG2 ARG 26 2HG ARG 26 -8.892 -4.881 -5.638 186 HG3 ARG 26 1HG ARG 26 -7.971 -6.058 -4.698 187 HD2 ARG 26 2HD ARG 26 -10.203 -5.363 -3.131 188 HD3 ARG 26 1HD ARG 26 -10.805 -5.607 -4.779 189 HE ARG 26 HE ARG 26 -9.816 -7.612 -2.984 190 HH11 ARG 26 1HH1 ARG 26 -10.224 -6.769 -6.345 191 HH12 ARG 26 2HH1 ARG 26 -10.232 -8.414 -6.886 192 HH21 ARG 26 1HH2 ARG 26 -9.826 -9.777 -3.692 193 HH22 ARG 26 2HH2 ARG 26 -10.005 -10.122 -5.381 194 H THR 27 H THR 27 -8.557 -1.768 -1.610 195 HA THR 27 HA THR 27 -10.018 -0.972 0.040 196 HB THR 27 HB THR 27 -12.000 -3.111 -0.738 197 HG1 THR 27 1HG THR 27 -12.363 -1.929 -2.423 198 HG21 THR 27 3HG2 THR 27 -12.851 -2.414 1.222 199 HG22 THR 27 1HG2 THR 27 -13.466 -1.096 0.224 200 HG23 THR 27 2HG2 THR 27 -11.997 -0.872 1.174 201 H LEU 28 H LEU 28 -10.150 -1.610 2.169 202 HA LEU 28 HA LEU 28 -8.539 -3.850 2.882 203 HB2 LEU 28 2HB LEU 28 -9.187 -1.485 4.077 204 HB3 LEU 28 1HB LEU 28 -10.193 -2.612 4.986 205 HG LEU 28 HG LEU 28 -7.964 -2.125 6.013 206 HD11 LEU 28 1HD1 LEU 28 -7.393 -4.735 6.075 207 HD12 LEU 28 2HD1 LEU 28 -9.016 -4.812 5.390 208 HD13 LEU 28 3HD1 LEU 28 -8.753 -4.024 6.945 209 HD21 LEU 28 3HD2 LEU 28 -5.964 -2.905 5.078 210 HD22 LEU 28 1HD2 LEU 28 -6.798 -2.109 3.745 211 HD23 LEU 28 2HD2 LEU 28 -6.804 -3.869 3.864 212 H GLU 29 H GLU 29 -11.994 -3.152 2.952 213 HA GLU 29 HA GLU 29 -12.890 -5.316 4.449 214 HB2 GLU 29 2HB GLU 29 -14.107 -3.261 3.188 215 HB3 GLU 29 1HB GLU 29 -14.528 -4.574 2.097 216 HG2 GLU 29 2HG GLU 29 -14.929 -5.056 4.984 217 HG3 GLU 29 1HG GLU 29 -16.007 -3.898 4.207 218 H ASP 30 H ASP 30 -12.776 -5.115 0.886 219 HA ASP 30 HA ASP 30 -13.109 -7.967 0.635 220 HB2 ASP 30 2HB ASP 30 -12.799 -5.683 -1.287 221 HB3 ASP 30 1HB ASP 30 -12.601 -7.347 -1.856 222 H GLY 31 H GLY 31 -10.478 -5.684 0.621 223 HA2 GLY 31 2HA GLY 31 -8.535 -7.335 -0.628 224 HA3 GLY 31 1HA GLY 31 -8.203 -5.940 0.405 225 H LYS 32 H LYS 32 -8.756 -6.442 2.825 226 HA LYS 32 HA LYS 32 -6.929 -8.343 3.728 227 HB2 LYS 32 2HB LYS 32 -7.667 -6.443 5.088 228 HB3 LYS 32 1HB LYS 32 -9.275 -7.142 5.209 229 HG2 LYS 32 2HG LYS 32 -8.386 -9.032 6.448 230 HG3 LYS 32 1HG LYS 32 -6.752 -8.386 6.284 231 HD2 LYS 32 2HD LYS 32 -7.165 -7.459 8.293 232 HD3 LYS 32 1HD LYS 32 -8.055 -6.258 7.356 233 HE2 LYS 32 2HE LYS 32 -9.607 -8.653 7.992 234 HE3 LYS 32 1HE LYS 32 -9.079 -7.749 9.410 235 HZ1 LYS 32 3HZ LYS 32 -11.060 -6.739 8.900 236 HZ2 LYS 32 1HZ LYS 32 -10.858 -6.901 7.227 237 HZ3 LYS 32 2HZ LYS 32 -9.976 -5.736 8.077 238 H LYS 33 H LYS 33 -10.481 -8.526 3.577 239 HA LYS 33 HA LYS 33 -10.798 -11.053 4.699 240 HB2 LYS 33 2HB LYS 33 -12.593 -9.353 4.060 241 HB3 LYS 33 1HB LYS 33 -12.488 -10.009 2.432 242 HG2 LYS 33 2HG LYS 33 -12.779 -12.260 3.986 243 HG3 LYS 33 1HG LYS 33 -13.810 -11.068 4.796 244 HD2 LYS 33 2HD LYS 33 -15.267 -10.957 3.062 245 HD3 LYS 33 1HD LYS 33 -14.007 -11.191 1.849 246 HE2 LYS 33 2HE LYS 33 -13.998 -13.607 3.077 247 HE3 LYS 33 1HE LYS 33 -15.696 -13.161 3.232 248 HZ1 LYS 33 3HZ LYS 33 -15.423 -12.588 0.722 249 HZ2 LYS 33 1HZ LYS 33 -15.682 -14.188 1.206 250 HZ3 LYS 33 2HZ LYS 33 -14.123 -13.667 0.807 251 H GLU 34 H GLU 34 -9.860 -10.101 1.466 252 HA GLU 34 HA GLU 34 -9.991 -12.834 0.482 253 HB2 GLU 34 2HB GLU 34 -10.610 -10.785 -0.897 254 HB3 GLU 34 1HB GLU 34 -8.883 -10.439 -0.976 255 HG2 GLU 34 2HG GLU 34 -8.572 -11.922 -2.593 256 HG3 GLU 34 1HG GLU 34 -9.444 -13.179 -1.699 257 H ALA 35 H ALA 35 -7.699 -10.662 1.856 258 HA ALA 35 HA ALA 35 -5.332 -11.792 0.773 259 HB1 ALA 35 1HB ALA 35 -5.880 -10.106 3.199 260 HB2 ALA 35 2HB ALA 35 -5.115 -9.635 1.681 261 HB3 ALA 35 3HB ALA 35 -4.261 -10.692 2.809 262 H ALA 36 H ALA 36 -7.463 -12.687 3.364 263 HA ALA 36 HA ALA 36 -5.670 -14.361 4.791 264 HB1 ALA 36 1HB ALA 36 -7.565 -13.675 5.982 265 HB2 ALA 36 2HB ALA 36 -7.850 -15.385 5.653 266 HB3 ALA 36 3HB ALA 36 -8.663 -14.153 4.687 267 H ALA 37 H ALA 37 -7.967 -14.923 2.162 268 HA ALA 37 HA ALA 37 -7.897 -17.700 2.063 269 HB1 ALA 37 1HB ALA 37 -8.288 -17.288 -0.472 270 HB2 ALA 37 2HB ALA 37 -8.361 -15.589 -0.004 271 HB3 ALA 37 3HB ALA 37 -9.498 -16.744 0.691 272 H SER 38 H SER 38 -6.152 -15.664 -0.281 273 HA SER 38 HA SER 38 -4.308 -17.717 -0.937 274 HB2 SER 38 2HB SER 38 -4.574 -14.806 -1.579 275 HB3 SER 38 1HB SER 38 -3.029 -15.609 -1.908 276 HG SER 38 HG SER 38 -5.591 -16.256 -2.936 277 H GLY 39 H GLY 39 -4.295 -15.051 1.329 278 HA2 GLY 39 2HA GLY 39 -3.021 -14.883 3.271 279 HA3 GLY 39 1HA GLY 39 -2.033 -16.232 2.709 280 H LEU 40 H LEU 40 -2.700 -13.255 0.892 281 HA LEU 40 HA LEU 40 0.183 -12.721 1.029 282 HB2 LEU 40 2HB LEU 40 -0.045 -11.467 -1.051 283 HB3 LEU 40 1HB LEU 40 -0.537 -13.132 -1.223 284 HG LEU 40 HG LEU 40 -1.860 -11.223 -2.363 285 HD11 LEU 40 1HD1 LEU 40 -3.624 -13.157 -0.981 286 HD12 LEU 40 2HD1 LEU 40 -2.381 -13.738 -2.092 287 HD13 LEU 40 3HD1 LEU 40 -3.620 -12.616 -2.661 288 HD21 LEU 40 3HD2 LEU 40 -3.705 -10.316 -1.169 289 HD22 LEU 40 1HD2 LEU 40 -2.237 -9.939 -0.275 290 HD23 LEU 40 2HD2 LEU 40 -3.291 -11.239 0.274 291 HA PRO 41 HA PRO 41 -0.392 -8.957 3.183 292 HB2 PRO 41 2HB PRO 41 1.510 -7.348 2.123 293 HB3 PRO 41 1HB PRO 41 1.890 -8.719 3.170 294 HG2 PRO 41 2HG PRO 41 1.980 -8.535 0.186 295 HG3 PRO 41 1HG PRO 41 3.143 -9.276 1.297 296 HD2 PRO 41 2HD PRO 41 1.330 -10.725 -0.087 297 HD3 PRO 41 1HD PRO 41 1.904 -11.199 1.522 298 H LEU 42 H LEU 42 -0.358 -6.448 2.787 299 HA LEU 42 HA LEU 42 -1.845 -5.825 0.342 300 HB2 LEU 42 2HB LEU 42 -3.542 -4.650 1.502 301 HB3 LEU 42 1HB LEU 42 -3.397 -6.215 2.276 302 HG LEU 42 HG LEU 42 -1.932 -3.869 3.419 303 HD11 LEU 42 1HD1 LEU 42 -4.276 -3.158 3.021 304 HD12 LEU 42 2HD1 LEU 42 -3.837 -3.236 4.728 305 HD13 LEU 42 3HD1 LEU 42 -4.813 -4.517 4.009 306 HD21 LEU 42 3HD2 LEU 42 -3.305 -5.836 5.105 307 HD22 LEU 42 1HD2 LEU 42 -1.674 -5.182 5.224 308 HD23 LEU 42 2HD2 LEU 42 -2.019 -6.493 4.096 309 H MET 43 H MET 43 -1.464 -3.864 -0.536 310 HA MET 43 HA MET 43 0.654 -2.265 0.728 311 HB2 MET 43 2HB MET 43 1.316 -3.018 -1.426 312 HB3 MET 43 1HB MET 43 -0.250 -2.609 -2.136 313 HG2 MET 43 2HG MET 43 0.282 -0.403 -2.350 314 HG3 MET 43 1HG MET 43 1.372 -0.411 -0.967 315 HE1 MET 43 3HE MET 43 2.674 -2.739 -4.672 316 HE2 MET 43 1HE MET 43 1.220 -1.761 -4.870 317 HE3 MET 43 2HE MET 43 1.267 -3.035 -3.652 318 H VAL 44 H VAL 44 0.487 0.114 0.529 319 HA VAL 44 HA VAL 44 -2.266 1.078 0.204 320 HB VAL 44 HB VAL 44 -0.515 1.802 2.553 321 HG11 VAL 44 1HG1 VAL 44 -3.224 2.748 1.665 322 HG12 VAL 44 2HG1 VAL 44 -1.790 3.709 2.020 323 HG13 VAL 44 3HG1 VAL 44 -2.663 2.914 3.329 324 HG21 VAL 44 3HG2 VAL 44 -1.695 -0.503 2.452 325 HG22 VAL 44 1HG2 VAL 44 -3.160 0.435 2.762 326 HG23 VAL 44 2HG2 VAL 44 -1.819 0.476 3.912 327 H ILE 45 H ILE 45 -2.370 2.815 -1.027 328 HA ILE 45 HA ILE 45 0.037 4.488 -1.297 329 HB ILE 45 HB ILE 45 -2.001 3.855 -3.440 330 HG12 ILE 45 2HG1 ILE 45 0.812 2.928 -2.899 331 HG13 ILE 45 1HG1 ILE 45 -0.618 1.965 -3.287 332 HG21 ILE 45 1HG2 ILE 45 -1.216 5.541 -4.684 333 HG22 ILE 45 2HG2 ILE 45 0.456 5.204 -4.246 334 HG23 ILE 45 3HG2 ILE 45 -0.552 6.177 -3.180 335 HD11 ILE 45 3HD1 ILE 45 -0.536 2.960 -5.587 336 HD12 ILE 45 1HD1 ILE 45 0.819 1.910 -5.170 337 HD13 ILE 45 2HD1 ILE 45 1.022 3.661 -5.152 338 H ILE 46 H ILE 46 -0.333 6.292 -0.210 339 HA ILE 46 HA ILE 46 -3.004 7.515 -0.364 340 HB ILE 46 HB ILE 46 -0.868 7.948 1.723 341 HG12 ILE 46 2HG1 ILE 46 -3.332 6.628 2.539 342 HG13 ILE 46 1HG1 ILE 46 -2.431 5.692 1.342 343 HG21 ILE 46 1HG2 ILE 46 -2.453 9.170 2.951 344 HG22 ILE 46 2HG2 ILE 46 -3.773 8.666 1.905 345 HG23 ILE 46 3HG2 ILE 46 -2.561 9.792 1.304 346 HD11 ILE 46 3HD1 ILE 46 -0.535 5.588 2.752 347 HD12 ILE 46 1HD1 ILE 46 -1.929 5.212 3.765 348 HD13 ILE 46 2HD1 ILE 46 -1.191 6.814 3.840 349 H HIS 47 H HIS 47 -3.161 9.781 -0.697 350 HA HIS 47 HA HIS 47 -0.682 11.036 -1.687 351 HB2 HIS 47 2HB HIS 47 -3.342 11.295 -3.086 352 HB3 HIS 47 1HB HIS 47 -1.756 11.823 -3.662 353 HD1 HIS 47 1HD HIS 47 -0.320 10.106 -4.857 354 HD2 HIS 47 2HD HIS 47 -3.779 8.484 -3.223 355 HE1 HIS 47 1HE HIS 47 -0.479 7.778 -5.793 356 HE2 HIS 47 2HE HIS 47 -2.650 6.869 -4.898 357 H LYS 48 H LYS 48 -0.319 12.690 -0.336 358 HA LYS 48 HA LYS 48 -2.591 14.515 0.184 359 HB2 LYS 48 2HB LYS 48 -0.976 13.214 2.081 360 HB3 LYS 48 1HB LYS 48 -0.449 14.886 2.071 361 HG2 LYS 48 2HG LYS 48 -2.104 14.847 3.688 362 HG3 LYS 48 1HG LYS 48 -2.926 15.482 2.264 363 HD2 LYS 48 2HD LYS 48 -4.374 13.790 2.262 364 HD3 LYS 48 1HD LYS 48 -3.071 12.601 2.333 365 HE2 LYS 48 2HE LYS 48 -4.660 12.489 4.249 366 HE3 LYS 48 1HE LYS 48 -2.981 12.739 4.719 367 HZ1 LYS 48 3HZ LYS 48 -4.203 15.242 4.357 368 HZ2 LYS 48 1HZ LYS 48 -3.572 14.573 5.776 369 HZ3 LYS 48 2HZ LYS 48 -5.190 14.311 5.363 370 H SER 49 H SER 49 -1.857 16.800 0.655 371 HA SER 49 HA SER 49 -0.923 18.725 -0.129 372 HB2 SER 49 2HB SER 49 1.115 17.215 0.928 373 HB3 SER 49 1HB SER 49 1.730 17.584 -0.682 374 HG SER 49 HG SER 49 1.972 19.138 1.274 375 H TRP 50 H TRP 50 1.167 19.132 -2.027 376 HA TRP 50 HA TRP 50 -0.187 19.197 -4.415 377 HB2 TRP 50 2HB TRP 50 2.082 19.349 -5.509 378 HB3 TRP 50 1HB TRP 50 1.822 20.479 -4.173 379 HD1 TRP 50 HD TRP 50 3.917 17.470 -5.194 380 HE1 TRP 50 1HE TRP 50 5.812 17.150 -3.482 381 HE3 TRP 50 3HE TRP 50 2.413 20.859 -1.675 382 HZ2 TRP 50 2HZ TRP 50 6.570 18.196 -0.973 383 HZ3 TRP 50 3HZ TRP 50 3.780 21.139 0.352 384 HH2 TRP 50 HH TRP 50 5.815 19.834 0.694 385 H CYS 51 H CYS 51 2.137 16.726 -3.359 386 HA CYS 51 HA CYS 51 2.466 14.569 -3.970 387 HB2 CYS 51 2HB CYS 51 0.316 14.074 -3.185 388 HB3 CYS 51 1HB CYS 51 -0.470 14.939 -4.500 389 H GLY 52 H GLY 52 3.456 13.614 -5.634 390 HA2 GLY 52 2HA GLY 52 2.803 14.553 -8.364 391 HA3 GLY 52 1HA GLY 52 4.430 14.094 -7.856 392 H ALA 53 H ALA 53 3.389 11.831 -6.277 393 HA ALA 53 HA ALA 53 3.607 9.807 -8.202 394 HB1 ALA 53 1HB ALA 53 2.566 9.722 -5.380 395 HB2 ALA 53 2HB ALA 53 4.202 9.352 -5.924 396 HB3 ALA 53 3HB ALA 53 2.864 8.292 -6.369 397 H CYS 54 H CYS 54 0.990 11.771 -7.388 398 HA CYS 54 HA CYS 54 -0.957 9.821 -8.262 399 HB2 CYS 54 2HB CYS 54 -2.552 11.854 -7.894 400 HB3 CYS 54 1HB CYS 54 -1.861 11.033 -6.490 401 H LYS 55 H LYS 55 0.473 12.873 -9.320 402 HA LYS 55 HA LYS 55 -1.127 13.105 -11.664 403 HB2 LYS 55 2HB LYS 55 0.332 14.878 -12.322 404 HB3 LYS 55 1HB LYS 55 0.128 14.997 -10.581 405 HG2 LYS 55 2HG LYS 55 2.294 14.102 -10.183 406 HG3 LYS 55 1HG LYS 55 2.489 13.667 -11.891 407 HD2 LYS 55 2HD LYS 55 3.741 15.652 -11.555 408 HD3 LYS 55 1HD LYS 55 2.274 16.127 -12.413 409 HE2 LYS 55 2HE LYS 55 2.130 16.192 -9.467 410 HE3 LYS 55 1HE LYS 55 3.200 17.378 -10.212 411 HZ1 LYS 55 3HZ LYS 55 1.172 18.454 -10.136 412 HZ2 LYS 55 1HZ LYS 55 0.285 17.067 -10.526 413 HZ3 LYS 55 2HZ LYS 55 1.195 17.853 -11.716 414 H ALA 56 H ALA 56 2.006 11.658 -10.931 415 HA ALA 56 HA ALA 56 2.663 11.002 -13.630 416 HB1 ALA 56 1HB ALA 56 3.746 10.391 -10.949 417 HB2 ALA 56 2HB ALA 56 4.562 10.964 -12.403 418 HB3 ALA 56 3HB ALA 56 4.142 9.260 -12.242 419 H LEU 57 H LEU 57 0.399 9.677 -11.463 420 HA LEU 57 HA LEU 57 0.586 6.984 -12.510 421 HB2 LEU 57 2HB LEU 57 -1.038 8.327 -10.400 422 HB3 LEU 57 1HB LEU 57 -1.555 6.775 -11.024 423 HG LEU 57 HG LEU 57 0.087 7.093 -8.895 424 HD11 LEU 57 1HD1 LEU 57 -1.025 5.026 -10.244 425 HD12 LEU 57 2HD1 LEU 57 0.011 4.862 -8.827 426 HD13 LEU 57 3HD1 LEU 57 0.694 4.690 -10.444 427 HD21 LEU 57 3HD2 LEU 57 1.862 8.003 -10.435 428 HD22 LEU 57 1HD2 LEU 57 1.952 6.395 -11.153 429 HD23 LEU 57 2HD2 LEU 57 2.346 6.624 -9.451 430 H LYS 58 H LYS 58 -1.823 9.622 -12.674 431 HA LYS 58 HA LYS 58 -3.874 8.336 -13.903 432 HB2 LYS 58 2HB LYS 58 -3.717 10.754 -15.347 433 HB3 LYS 58 1HB LYS 58 -4.723 10.378 -13.963 434 HG2 LYS 58 2HG LYS 58 -1.928 11.209 -13.432 435 HG3 LYS 58 1HG LYS 58 -3.067 12.432 -13.994 436 HD2 LYS 58 2HD LYS 58 -3.586 10.598 -11.658 437 HD3 LYS 58 1HD LYS 58 -2.918 12.224 -11.506 438 HE2 LYS 58 2HE LYS 58 -5.036 12.849 -12.951 439 HE3 LYS 58 1HE LYS 58 -5.662 11.354 -12.259 440 HZ1 LYS 58 3HZ LYS 58 -5.901 12.297 -10.264 441 HZ2 LYS 58 1HZ LYS 58 -5.773 13.774 -11.077 442 HZ3 LYS 58 2HZ LYS 58 -4.413 13.097 -10.336 443 HA PRO 59 HA PRO 59 -2.366 8.770 -18.395 444 HB2 PRO 59 2HB PRO 59 -0.042 10.017 -18.971 445 HB3 PRO 59 1HB PRO 59 -1.576 10.886 -18.774 446 HG2 PRO 59 2HG PRO 59 0.660 10.517 -16.812 447 HG3 PRO 59 1HG PRO 59 -0.264 11.979 -17.198 448 HD2 PRO 59 2HD PRO 59 -0.778 10.455 -15.014 449 HD3 PRO 59 1HD PRO 59 -2.042 11.365 -15.880 450 H LYS 60 H LYS 60 0.145 8.129 -16.029 451 HA LYS 60 HA LYS 60 1.435 6.269 -17.876 452 HB2 LYS 60 2HB LYS 60 3.178 7.303 -16.876 453 HB3 LYS 60 1HB LYS 60 2.258 7.697 -15.440 454 HG2 LYS 60 2HG LYS 60 3.967 6.226 -14.769 455 HG3 LYS 60 1HG LYS 60 2.477 5.277 -14.762 456 HD2 LYS 60 2HD LYS 60 4.195 3.956 -15.779 457 HD3 LYS 60 1HD LYS 60 3.100 4.485 -17.060 458 HE2 LYS 60 2HE LYS 60 4.995 6.504 -16.906 459 HE3 LYS 60 1HE LYS 60 5.929 5.022 -16.688 460 HZ1 LYS 60 3HZ LYS 60 5.800 5.553 -19.008 461 HZ2 LYS 60 1HZ LYS 60 4.112 5.645 -18.952 462 HZ3 LYS 60 2HZ LYS 60 4.887 4.158 -18.727 463 H PHE 61 H PHE 61 0.272 6.185 -14.482 464 HA PHE 61 HA PHE 61 0.392 3.415 -14.227 465 HB2 PHE 61 2HB PHE 61 0.010 5.109 -12.366 466 HB3 PHE 61 1HB PHE 61 -1.685 5.114 -12.861 467 HD1 PHE 61 1HD PHE 61 1.038 2.963 -11.584 468 HD2 PHE 61 2HD PHE 61 -3.143 3.392 -12.210 469 HE1 PHE 61 1HE PHE 61 0.632 0.958 -10.219 470 HE2 PHE 61 2HE PHE 61 -3.561 1.390 -10.844 471 HZ PHE 61 HZ PHE 61 -1.671 0.170 -9.846 472 H ALA 62 H ALA 62 -1.727 5.373 -16.076 473 HA ALA 62 HA ALA 62 -4.005 3.744 -16.190 474 HB1 ALA 62 1HB ALA 62 -2.871 5.941 -17.698 475 HB2 ALA 62 2HB ALA 62 -4.562 5.498 -17.462 476 HB3 ALA 62 3HB ALA 62 -3.632 4.758 -18.766 477 H GLU 63 H GLU 63 -0.794 3.296 -17.200 478 HA GLU 63 HA GLU 63 -1.184 1.287 -19.207 479 HB2 GLU 63 2HB GLU 63 0.865 2.901 -18.739 480 HB3 GLU 63 1HB GLU 63 1.363 1.597 -17.655 481 HG2 GLU 63 2HG GLU 63 0.645 0.383 -20.091 482 HG3 GLU 63 1HG GLU 63 1.618 1.795 -20.499 483 H SER 64 H SER 64 -1.377 1.403 -15.867 484 HA SER 64 HA SER 64 -0.363 -0.989 -14.967 485 HB2 SER 64 2HB SER 64 -2.755 0.605 -14.099 486 HB3 SER 64 1HB SER 64 -2.168 -0.784 -13.203 487 HG SER 64 HG SER 64 -0.646 1.526 -13.831 488 H THR 65 H THR 65 -2.530 -0.799 -17.436 489 HA THR 65 HA THR 65 -4.594 -2.522 -16.950 490 HB THR 65 HB THR 65 -3.160 -3.119 -19.457 491 HG1 THR 65 1HG THR 65 -3.954 -0.467 -18.844 492 HG21 THR 65 3HG2 THR 65 -5.535 -3.642 -19.110 493 HG22 THR 65 1HG2 THR 65 -5.257 -2.577 -20.488 494 HG23 THR 65 2HG2 THR 65 -5.871 -1.914 -18.973 495 H GLU 66 H GLU 66 -1.204 -3.248 -17.484 496 HA GLU 66 HA GLU 66 -1.595 -6.103 -17.262 497 HB2 GLU 66 2HB GLU 66 0.407 -4.542 -18.353 498 HB3 GLU 66 1HB GLU 66 1.132 -5.107 -16.845 499 HG2 GLU 66 2HG GLU 66 -0.080 -7.353 -17.952 500 HG3 GLU 66 1HG GLU 66 0.671 -6.519 -19.313 501 H ILE 67 H ILE 67 -0.738 -3.375 -15.245 502 HA ILE 67 HA ILE 67 0.139 -4.937 -13.028 503 HB ILE 67 HB ILE 67 -1.024 -2.150 -13.053 504 HG12 ILE 67 2HG1 ILE 67 1.826 -3.154 -13.105 505 HG13 ILE 67 1HG1 ILE 67 0.994 -2.264 -14.386 506 HG21 ILE 67 1HG2 ILE 67 -1.084 -2.342 -10.835 507 HG22 ILE 67 2HG2 ILE 67 0.678 -2.407 -10.872 508 HG23 ILE 67 3HG2 ILE 67 -0.260 -3.900 -10.882 509 HD11 ILE 67 3HD1 ILE 67 0.756 -0.420 -12.574 510 HD12 ILE 67 1HD1 ILE 67 2.293 -0.636 -13.409 511 HD13 ILE 67 2HD1 ILE 67 2.074 -1.282 -11.783 512 H SER 68 H SER 68 -2.901 -4.372 -14.461 513 HA SER 68 HA SER 68 -4.577 -4.605 -12.190 514 HB2 SER 68 2HB SER 68 -6.350 -4.821 -13.706 515 HB3 SER 68 1HB SER 68 -5.164 -3.918 -14.645 516 HG SER 68 HG SER 68 -6.116 -5.741 -15.755 517 H GLU 69 H GLU 69 -2.926 -6.861 -14.279 518 HA GLU 69 HA GLU 69 -4.169 -9.187 -13.125 519 HB2 GLU 69 2HB GLU 69 -1.686 -9.076 -14.840 520 HB3 GLU 69 1HB GLU 69 -2.724 -10.467 -14.560 521 HG2 GLU 69 2HG GLU 69 -3.534 -7.959 -16.012 522 HG3 GLU 69 1HG GLU 69 -3.050 -9.472 -16.775 523 H LEU 70 H LEU 70 -1.078 -7.494 -12.940 524 HA LEU 70 HA LEU 70 0.231 -9.277 -11.196 525 HB2 LEU 70 2HB LEU 70 0.532 -6.369 -11.840 526 HB3 LEU 70 1HB LEU 70 1.417 -7.043 -10.471 527 HG LEU 70 HG LEU 70 2.444 -8.702 -12.011 528 HD11 LEU 70 1HD1 LEU 70 2.222 -8.498 -14.373 529 HD12 LEU 70 2HD1 LEU 70 1.250 -7.034 -14.220 530 HD13 LEU 70 3HD1 LEU 70 0.598 -8.589 -13.691 531 HD21 LEU 70 3HD2 LEU 70 2.913 -5.890 -12.969 532 HD22 LEU 70 1HD2 LEU 70 4.071 -7.217 -12.861 533 HD23 LEU 70 2HD2 LEU 70 3.453 -6.464 -11.389 534 H SER 71 H SER 71 -2.147 -6.793 -10.672 535 HA SER 71 HA SER 71 -1.818 -6.533 -7.864 536 HB2 SER 71 2HB SER 71 -3.359 -5.294 -9.830 537 HB3 SER 71 1HB SER 71 -4.524 -6.090 -8.775 538 HG SER 71 HG SER 71 -3.993 -4.791 -7.176 539 H HIS 72 H HIS 72 -3.451 -8.824 -9.898 540 HA HIS 72 HA HIS 72 -5.345 -9.827 -8.106 541 HB2 HIS 72 2HB HIS 72 -4.608 -10.424 -10.679 542 HB3 HIS 72 1HB HIS 72 -4.039 -11.853 -9.802 543 HD1 HIS 72 1HD HIS 72 -5.841 -13.361 -8.708 544 HD2 HIS 72 2HD HIS 72 -7.379 -10.155 -10.857 545 HE1 HIS 72 1HE HIS 72 -8.293 -13.848 -8.979 546 HE2 HIS 72 2HE HIS 72 -9.221 -11.842 -10.190 547 H ASN 73 H ASN 73 -1.975 -9.910 -8.050 548 HA ASN 73 HA ASN 73 -1.490 -12.327 -6.696 549 HB2 ASN 73 2HB ASN 73 -0.025 -9.712 -6.943 550 HB3 ASN 73 1HB ASN 73 0.586 -11.000 -5.902 551 HD21 ASN 73 1HD2 ASN 73 -0.434 -10.285 -9.206 552 HD22 ASN 73 2HD2 ASN 73 0.615 -11.442 -9.965 553 H PHE 74 H PHE 74 -1.768 -9.007 -5.433 554 HA PHE 74 HA PHE 74 -2.872 -10.080 -2.961 555 HB2 PHE 74 2HB PHE 74 -1.473 -8.147 -1.821 556 HB3 PHE 74 1HB PHE 74 -0.760 -9.734 -2.109 557 HD1 PHE 74 1HD PHE 74 -1.277 -6.667 -4.164 558 HD2 PHE 74 2HD PHE 74 1.426 -9.604 -2.713 559 HE1 PHE 74 1HE PHE 74 0.548 -5.606 -5.437 560 HE2 PHE 74 2HE PHE 74 3.257 -8.555 -3.980 561 HZ PHE 74 HZ PHE 74 2.819 -6.554 -5.344 562 H VAL 75 H VAL 75 -3.167 -7.668 -1.560 563 HA VAL 75 HA VAL 75 -4.768 -6.063 -3.439 564 HB VAL 75 HB VAL 75 -6.640 -5.954 -1.918 565 HG11 VAL 75 1HG1 VAL 75 -6.277 -8.866 -1.888 566 HG12 VAL 75 2HG1 VAL 75 -5.989 -8.100 -3.450 567 HG13 VAL 75 3HG1 VAL 75 -7.537 -7.885 -2.635 568 HG21 VAL 75 3HG2 VAL 75 -6.230 -6.209 0.260 569 HG22 VAL 75 1HG2 VAL 75 -4.723 -7.073 -0.046 570 HG23 VAL 75 2HG2 VAL 75 -6.255 -7.948 -0.036 571 H MET 76 H MET 76 -4.565 -3.861 -3.175 572 HA MET 76 HA MET 76 -3.222 -2.996 -0.715 573 HB2 MET 76 2HB MET 76 -2.974 -0.943 -2.607 574 HB3 MET 76 1HB MET 76 -1.726 -2.006 -2.008 575 HG2 MET 76 2HG MET 76 -3.475 -2.786 -4.299 576 HG3 MET 76 1HG MET 76 -2.021 -1.832 -4.527 577 HE1 MET 76 3HE MET 76 -1.360 -5.563 -5.776 578 HE2 MET 76 1HE MET 76 -1.959 -3.977 -6.261 579 HE3 MET 76 2HE MET 76 -3.032 -5.113 -5.444 580 H VAL 77 H VAL 77 -3.630 -0.285 -0.826 581 HA VAL 77 HA VAL 77 -6.493 0.154 -1.075 582 HB VAL 77 HB VAL 77 -5.085 -0.275 1.472 583 HG11 VAL 77 1HG1 VAL 77 -5.372 1.901 2.076 584 HG12 VAL 77 2HG1 VAL 77 -6.925 1.224 2.574 585 HG13 VAL 77 3HG1 VAL 77 -6.801 2.119 1.059 586 HG21 VAL 77 3HG2 VAL 77 -6.795 -1.777 0.621 587 HG22 VAL 77 1HG2 VAL 77 -7.970 -0.461 0.639 588 HG23 VAL 77 2HG2 VAL 77 -7.288 -1.054 2.154 589 H ASN 78 H ASN 78 -7.056 2.210 -1.433 590 HA ASN 78 HA ASN 78 -4.940 4.222 -1.566 591 HB2 ASN 78 2HB ASN 78 -6.456 3.571 -3.557 592 HB3 ASN 78 1HB ASN 78 -7.696 4.500 -2.733 593 HD21 ASN 78 1HD2 ASN 78 -4.235 5.135 -2.918 594 HD22 ASN 78 2HD2 ASN 78 -4.378 6.650 -3.754 595 H LEU 79 H LEU 79 -4.840 5.596 0.070 596 HA LEU 79 HA LEU 79 -7.360 6.414 1.356 597 HB2 LEU 79 2HB LEU 79 -6.380 5.342 3.102 598 HB3 LEU 79 1HB LEU 79 -4.761 5.573 2.484 599 HG LEU 79 HG LEU 79 -4.982 8.006 3.228 600 HD11 LEU 79 1HD1 LEU 79 -6.958 7.208 5.239 601 HD12 LEU 79 2HD1 LEU 79 -7.598 7.369 3.605 602 HD13 LEU 79 3HD1 LEU 79 -6.775 8.729 4.368 603 HD21 LEU 79 3HD2 LEU 79 -4.640 5.595 4.890 604 HD22 LEU 79 1HD2 LEU 79 -4.879 7.111 5.760 605 HD23 LEU 79 2HD2 LEU 79 -3.547 6.950 4.614 606 H GLU 80 H GLU 80 -7.479 8.607 2.115 607 HA GLU 80 HA GLU 80 -5.460 10.475 1.171 608 HB2 GLU 80 2HB GLU 80 -7.629 9.898 -0.453 609 HB3 GLU 80 1HB GLU 80 -8.129 11.371 0.386 610 HG2 GLU 80 2HG GLU 80 -6.337 12.603 -0.475 611 HG3 GLU 80 1HG GLU 80 -5.457 11.145 -0.962 612 H ASP 81 H ASP 81 -6.237 12.810 1.710 613 HA ASP 81 HA ASP 81 -6.457 13.098 4.438 614 HB2 ASP 81 2HB ASP 81 -7.249 15.448 3.921 615 HB3 ASP 81 1HB ASP 81 -5.744 14.963 3.146 616 H GLU 82 H GLU 82 -8.986 12.503 2.142 617 HA GLU 82 HA GLU 82 -11.194 13.453 3.570 618 HB2 GLU 82 2HB GLU 82 -10.720 11.706 1.293 619 HB3 GLU 82 1HB GLU 82 -12.105 11.185 2.243 620 HG2 GLU 82 2HG GLU 82 -11.699 13.940 1.100 621 HG3 GLU 82 1HG GLU 82 -12.745 12.688 0.431 622 H GLU 83 H GLU 83 -9.339 10.499 3.896 623 HA GLU 83 HA GLU 83 -10.798 9.914 6.361 624 HB2 GLU 83 2HB GLU 83 -10.405 7.979 4.082 625 HB3 GLU 83 1HB GLU 83 -10.776 7.458 5.719 626 HG2 GLU 83 2HG GLU 83 -12.931 8.093 5.582 627 HG3 GLU 83 1HG GLU 83 -12.561 9.510 4.593 628 H GLU 84 H GLU 84 -8.187 11.020 5.851 629 HA GLU 84 HA GLU 84 -6.220 8.982 6.266 630 HB2 GLU 84 2HB GLU 84 -5.734 11.135 5.142 631 HB3 GLU 84 1HB GLU 84 -5.993 11.966 6.671 632 HG2 GLU 84 2HG GLU 84 -4.087 9.831 6.979 633 HG3 GLU 84 1HG GLU 84 -3.603 10.926 5.685 634 HA PRO 85 HA PRO 85 -7.206 8.648 10.661 635 HB2 PRO 85 2HB PRO 85 -4.897 6.800 10.626 636 HB3 PRO 85 1HB PRO 85 -6.568 6.510 11.143 637 HG2 PRO 85 2HG PRO 85 -5.609 5.468 8.868 638 HG3 PRO 85 1HG PRO 85 -7.292 6.038 8.996 639 HD2 PRO 85 2HD PRO 85 -4.920 7.376 7.737 640 HD3 PRO 85 1HD PRO 85 -6.604 7.278 7.163 641 H LYS 86 H LYS 86 -5.112 8.004 12.436 642 HA LYS 86 HA LYS 86 -3.242 10.252 12.144 643 HB2 LYS 86 2HB LYS 86 -4.747 9.560 14.678 644 HB3 LYS 86 1HB LYS 86 -3.549 10.847 14.496 645 HG2 LYS 86 2HG LYS 86 -5.016 12.249 13.536 646 HG3 LYS 86 1HG LYS 86 -5.799 10.967 12.611 647 HD2 LYS 86 2HD LYS 86 -7.345 11.914 14.233 648 HD3 LYS 86 1HD LYS 86 -6.977 10.237 14.637 649 HE2 LYS 86 2HE LYS 86 -5.047 11.608 16.013 650 HE3 LYS 86 1HE LYS 86 -6.429 12.696 16.123 651 HZ1 LYS 86 3HZ LYS 86 -7.742 10.759 16.916 652 HZ2 LYS 86 1HZ LYS 86 -6.501 11.224 17.968 653 HZ3 LYS 86 2HZ LYS 86 -6.310 9.860 16.985 654 H ASP 87 H ASP 87 -2.151 8.072 11.434 655 HA ASP 87 HA ASP 87 -0.487 7.262 13.683 656 HB2 ASP 87 2HB ASP 87 -2.539 5.635 13.124 657 HB3 ASP 87 1HB ASP 87 -1.381 5.033 11.927 658 H GLU 88 H GLU 88 1.370 5.872 12.909 659 HA GLU 88 HA GLU 88 2.756 7.221 10.864 660 HB2 GLU 88 2HB GLU 88 3.265 4.779 12.506 661 HB3 GLU 88 1HB GLU 88 4.288 5.089 11.111 662 HG2 GLU 88 2HG GLU 88 3.857 6.945 13.441 663 HG3 GLU 88 1HG GLU 88 5.287 5.957 13.145 664 H ASP 89 H ASP 89 0.452 4.728 10.686 665 HA ASP 89 HA ASP 89 1.236 3.087 8.654 666 HB2 ASP 89 2HB ASP 89 -1.457 4.230 9.347 667 HB3 ASP 89 1HB ASP 89 -1.264 3.121 7.982 668 H PHE 90 H PHE 90 0.443 6.476 8.377 669 HA PHE 90 HA PHE 90 0.356 6.285 5.461 670 HB2 PHE 90 2HB PHE 90 -0.122 8.772 5.602 671 HB3 PHE 90 1HB PHE 90 -1.346 7.703 6.297 672 HD1 PHE 90 2HD PHE 90 1.801 9.364 7.471 673 HD2 PHE 90 1HD PHE 90 -2.295 8.477 8.215 674 HE1 PHE 90 2HE PHE 90 1.918 10.612 9.586 675 HE2 PHE 90 1HE PHE 90 -2.184 9.729 10.330 676 HZ PHE 90 HZ PHE 90 -0.076 10.798 11.018 677 H SER 91 H SER 91 2.579 6.930 7.944 678 HA SER 91 HA SER 91 4.358 8.474 6.212 679 HB2 SER 91 2HB SER 91 4.500 7.779 9.155 680 HB3 SER 91 1HB SER 91 5.769 8.659 8.289 681 HG SER 91 HG SER 91 4.195 10.004 9.388 682 HA PRO 92 HA PRO 92 7.036 4.931 5.750 683 HB2 PRO 92 2HB PRO 92 9.116 6.153 4.658 684 HB3 PRO 92 1HB PRO 92 7.509 6.334 3.928 685 HG2 PRO 92 2HG PRO 92 9.082 8.285 5.514 686 HG3 PRO 92 1HG PRO 92 7.878 8.579 4.264 687 HD2 PRO 92 2HD PRO 92 7.515 8.543 7.130 688 HD3 PRO 92 1HD PRO 92 6.316 8.922 5.880 689 H ASP 93 H ASP 93 9.923 6.649 6.130 690 HA ASP 93 HA ASP 93 10.354 5.576 8.831 691 HB2 ASP 93 2HB ASP 93 12.628 5.016 8.227 692 HB3 ASP 93 1HB ASP 93 11.535 4.284 7.042 693 H GLY 94 H GLY 94 10.089 8.333 7.034 694 HA2 GLY 94 2HA GLY 94 11.951 9.823 8.777 695 HA3 GLY 94 1HA GLY 94 11.536 10.316 7.131 696 H GLY 95 H GLY 95 9.138 10.732 6.760 697 HA2 GLY 95 2HA GLY 95 7.168 11.108 8.520 698 HA3 GLY 95 1HA GLY 95 8.233 12.453 8.929 699 H TYR 96 H TYR 96 7.179 11.051 5.785 700 HA TYR 96 HA TYR 96 6.691 13.758 4.843 701 HB2 TYR 96 2HB TYR 96 6.172 12.680 2.656 702 HB3 TYR 96 1HB TYR 96 7.790 12.316 3.263 703 HD1 TYR 96 2HD TYR 96 4.841 10.568 4.634 704 HD2 TYR 96 1HD TYR 96 8.007 10.418 1.795 705 HE1 TYR 96 2HE TYR 96 4.417 8.179 4.293 706 HE2 TYR 96 1HE TYR 96 7.578 8.030 1.440 707 HH TYR 96 HH TYR 96 5.539 6.202 3.501 708 H ILE 97 H ILE 97 4.522 13.668 3.238 709 HA ILE 97 HA ILE 97 2.351 12.405 4.644 710 HB ILE 97 HB ILE 97 1.122 14.397 5.218 711 HG12 ILE 97 2HG1 ILE 97 1.555 16.163 3.844 712 HG13 ILE 97 1HG1 ILE 97 2.636 16.560 5.171 713 HG21 ILE 97 1HG2 ILE 97 2.447 15.191 7.051 714 HG22 ILE 97 2HG2 ILE 97 3.925 14.618 6.279 715 HG23 ILE 97 3HG2 ILE 97 2.717 13.461 6.840 716 HD11 ILE 97 3HD1 ILE 97 3.406 15.278 2.567 717 HD12 ILE 97 1HD1 ILE 97 4.503 15.547 3.921 718 HD13 ILE 97 2HD1 ILE 97 3.768 16.919 3.094 719 HA PRO 98 HA PRO 98 1.621 10.599 3.585 720 HB2 PRO 98 2HB PRO 98 -0.992 10.629 2.025 721 HB3 PRO 98 1HB PRO 98 -0.525 9.530 3.353 722 HG2 PRO 98 2HG PRO 98 -1.560 12.183 3.522 723 HG3 PRO 98 1HG PRO 98 -1.078 11.088 4.849 724 HD2 PRO 98 2HD PRO 98 0.348 13.196 4.489 725 HD3 PRO 98 1HD PRO 98 1.197 11.649 4.635 726 H ARG 99 H ARG 99 2.309 8.719 2.518 727 HA ARG 99 HA ARG 99 2.212 8.729 -0.399 728 HB2 ARG 99 2HB ARG 99 4.613 8.809 1.331 729 HB3 ARG 99 1HB ARG 99 4.694 7.825 -0.137 730 HG2 ARG 99 2HG ARG 99 4.459 9.633 -1.507 731 HG3 ARG 99 1HG ARG 99 3.638 10.600 -0.295 732 HD2 ARG 99 2HD ARG 99 5.666 11.010 0.869 733 HD3 ARG 99 1HD ARG 99 6.540 9.830 -0.106 734 HE ARG 99 HE ARG 99 6.873 11.464 -1.654 735 HH11 ARG 99 1HH1 ARG 99 4.148 12.381 0.321 736 HH12 ARG 99 2HH1 ARG 99 3.947 13.919 -0.449 737 HH21 ARG 99 1HH2 ARG 99 6.615 13.489 -2.667 738 HH22 ARG 99 2HH2 ARG 99 5.346 14.548 -2.145 739 H ILE 100 H ILE 100 3.717 6.450 -0.927 740 HA ILE 100 HA ILE 100 1.808 4.449 -0.098 741 HB ILE 100 HB ILE 100 2.792 3.008 -1.733 742 HG12 ILE 100 2HG1 ILE 100 4.876 4.918 -2.608 743 HG13 ILE 100 1HG1 ILE 100 5.203 4.084 -1.094 744 HG21 ILE 100 1HG2 ILE 100 2.988 5.652 -3.090 745 HG22 ILE 100 2HG2 ILE 100 1.459 5.170 -2.361 746 HG23 ILE 100 3HG2 ILE 100 2.191 4.171 -3.617 747 HD11 ILE 100 3HD1 ILE 100 4.762 2.895 -3.813 748 HD12 ILE 100 1HD1 ILE 100 4.728 1.935 -2.331 749 HD13 ILE 100 2HD1 ILE 100 6.197 2.799 -2.790 750 H LEU 101 H LEU 101 2.407 2.291 0.603 751 HA LEU 101 HA LEU 101 4.902 1.590 1.602 752 HB2 LEU 101 2HB LEU 101 4.249 1.595 4.094 753 HB3 LEU 101 1HB LEU 101 4.879 3.057 3.369 754 HG LEU 101 HG LEU 101 2.874 3.198 4.992 755 HD11 LEU 101 1HD1 LEU 101 2.464 5.255 4.187 756 HD12 LEU 101 2HD1 LEU 101 2.208 4.684 2.539 757 HD13 LEU 101 3HD1 LEU 101 3.848 4.883 3.160 758 HD21 LEU 101 3HD2 LEU 101 1.494 1.492 3.972 759 HD22 LEU 101 1HD2 LEU 101 1.445 2.405 2.465 760 HD23 LEU 101 2HD2 LEU 101 0.686 3.059 3.915 761 H PHE 102 H PHE 102 5.016 -0.550 1.858 762 HA PHE 102 HA PHE 102 2.535 -2.055 1.594 763 HB2 PHE 102 2HB PHE 102 5.166 -2.412 0.707 764 HB3 PHE 102 1HB PHE 102 4.916 -3.681 1.899 765 HD1 PHE 102 2HD PHE 102 2.687 -5.038 1.623 766 HD2 PHE 102 1HD PHE 102 4.546 -2.782 -1.470 767 HE1 PHE 102 2HE PHE 102 1.511 -6.389 -0.063 768 HE2 PHE 102 1HE PHE 102 3.377 -4.132 -3.163 769 HZ PHE 102 HZ PHE 102 1.856 -5.938 -2.458 770 H LEU 103 H LEU 103 1.996 -3.870 2.971 771 HA LEU 103 HA LEU 103 3.300 -3.954 5.569 772 HB2 LEU 103 2HB LEU 103 0.804 -3.986 6.498 773 HB3 LEU 103 1HB LEU 103 1.786 -2.552 6.403 774 HG LEU 103 HG LEU 103 -0.177 -3.317 4.283 775 HD11 LEU 103 1HD1 LEU 103 -0.623 -1.444 6.568 776 HD12 LEU 103 2HD1 LEU 103 -1.346 -3.039 6.381 777 HD13 LEU 103 3HD1 LEU 103 -1.735 -1.758 5.237 778 HD21 LEU 103 3HD2 LEU 103 0.068 -0.610 4.243 779 HD22 LEU 103 1HD2 LEU 103 0.945 -1.717 3.189 780 HD23 LEU 103 2HD2 LEU 103 1.704 -1.118 4.664 781 H ASP 104 H ASP 104 1.982 -5.572 7.028 782 HA ASP 104 HA ASP 104 2.030 -8.065 5.557 783 HB2 ASP 104 2HB ASP 104 1.951 -7.276 8.431 784 HB3 ASP 104 1HB ASP 104 1.374 -8.892 7.998 785 HA PRO 105 HA PRO 105 -2.226 -8.726 4.726 786 HB2 PRO 105 2HB PRO 105 -2.477 -11.345 5.704 787 HB3 PRO 105 1HB PRO 105 -2.018 -10.876 4.059 788 HG2 PRO 105 2HG PRO 105 -0.317 -11.738 6.338 789 HG3 PRO 105 1HG PRO 105 -0.077 -11.972 4.592 790 HD2 PRO 105 2HD PRO 105 1.334 -10.160 6.021 791 HD3 PRO 105 1HD PRO 105 0.896 -9.902 4.321 792 H SER 106 H SER 106 -3.224 -7.358 6.133 793 HA SER 106 HA SER 106 -5.107 -8.102 7.858 794 HB2 SER 106 2HB SER 106 -3.946 -7.631 10.158 795 HB3 SER 106 1HB SER 106 -3.802 -9.240 9.429 796 HG SER 106 HG SER 106 -1.886 -7.177 9.071 797 H GLY 107 H GLY 107 -2.611 -5.863 7.075 798 HA2 GLY 107 2HA GLY 107 -3.188 -3.580 6.581 799 HA3 GLY 107 1HA GLY 107 -4.382 -3.652 7.886 800 H LYS 108 H LYS 108 -0.969 -4.666 7.834 801 HA LYS 108 HA LYS 108 -0.532 -2.816 10.089 802 HB2 LYS 108 2HB LYS 108 0.127 -5.617 9.689 803 HB3 LYS 108 1HB LYS 108 1.532 -4.672 10.159 804 HG2 LYS 108 2HG LYS 108 -0.526 -3.825 11.850 805 HG3 LYS 108 1HG LYS 108 -0.678 -5.587 11.753 806 HD2 LYS 108 2HD LYS 108 2.076 -4.624 12.064 807 HD3 LYS 108 1HD LYS 108 1.016 -4.243 13.423 808 HE2 LYS 108 2HE LYS 108 0.864 -6.994 12.347 809 HE3 LYS 108 1HE LYS 108 2.347 -6.560 13.196 810 HZ1 LYS 108 3HZ LYS 108 1.056 -5.944 15.117 811 HZ2 LYS 108 1HZ LYS 108 0.662 -7.526 14.668 812 HZ3 LYS 108 2HZ LYS 108 -0.393 -6.256 14.303 813 H VAL 109 H VAL 109 -0.047 -1.137 8.443 814 HA VAL 109 HA VAL 109 1.922 -1.089 6.570 815 HB VAL 109 HB VAL 109 1.286 1.094 8.556 816 HG11 VAL 109 1HG1 VAL 109 2.243 2.619 7.017 817 HG12 VAL 109 2HG1 VAL 109 2.452 1.358 5.805 818 HG13 VAL 109 3HG1 VAL 109 3.419 1.335 7.277 819 HG21 VAL 109 3HG2 VAL 109 0.134 0.520 5.828 820 HG22 VAL 109 1HG2 VAL 109 -0.211 1.946 6.803 821 HG23 VAL 109 2HG2 VAL 109 -0.703 0.351 7.369 822 H HIS 110 H HIS 110 3.771 -2.146 6.872 823 HA HIS 110 HA HIS 110 5.407 -1.397 9.197 824 HB2 HIS 110 2HB HIS 110 4.779 -3.889 8.548 825 HB3 HIS 110 1HB HIS 110 6.119 -3.696 7.424 826 HD1 HIS 110 1HD HIS 110 5.372 -4.522 10.878 827 HD2 HIS 110 2HD HIS 110 8.624 -2.996 8.791 828 HE1 HIS 110 1HE HIS 110 7.349 -4.824 12.401 829 HE2 HIS 110 2HE HIS 110 9.321 -3.979 11.079 830 HA PRO 111 HA PRO 111 7.783 0.897 6.197 831 HB2 PRO 111 2HB PRO 111 9.833 1.608 7.835 832 HB3 PRO 111 1HB PRO 111 8.251 2.395 7.880 833 HG2 PRO 111 2HG PRO 111 9.359 0.265 9.662 834 HG3 PRO 111 1HG PRO 111 8.407 1.699 10.088 835 HD2 PRO 111 2HD PRO 111 7.327 -0.786 9.901 836 HD3 PRO 111 1HD PRO 111 6.414 0.692 9.526 837 H GLU 112 H GLU 112 7.973 -1.910 6.106 838 HA GLU 112 HA GLU 112 10.861 -2.444 6.061 839 HB2 GLU 112 2HB GLU 112 8.940 -3.975 7.097 840 HB3 GLU 112 1HB GLU 112 8.877 -4.575 5.447 841 HG2 GLU 112 2HG GLU 112 11.482 -4.398 6.898 842 HG3 GLU 112 1HG GLU 112 10.391 -5.756 7.167 843 H ILE 113 H ILE 113 7.995 -2.510 3.986 844 HA ILE 113 HA ILE 113 9.704 -3.072 1.673 845 HB ILE 113 HB ILE 113 6.701 -2.956 1.754 846 HG12 ILE 113 2HG1 ILE 113 7.605 -4.708 3.262 847 HG13 ILE 113 1HG1 ILE 113 6.715 -5.380 1.889 848 HG21 ILE 113 1HG2 ILE 113 7.545 -2.657 -0.466 849 HG22 ILE 113 2HG2 ILE 113 6.909 -4.295 -0.335 850 HG23 ILE 113 3HG2 ILE 113 8.650 -4.018 -0.279 851 HD11 ILE 113 3HD1 ILE 113 9.680 -5.071 1.739 852 HD12 ILE 113 1HD1 ILE 113 8.622 -6.204 0.897 853 HD13 ILE 113 2HD1 ILE 113 8.968 -6.430 2.611 854 H ILE 114 H ILE 114 10.633 -1.224 1.064 855 HA ILE 114 HA ILE 114 9.014 1.194 0.719 856 HB ILE 114 HB ILE 114 11.020 2.444 0.665 857 HG12 ILE 114 2HG1 ILE 114 12.261 0.850 -0.850 858 HG13 ILE 114 1HG1 ILE 114 13.236 1.554 0.428 859 HG21 ILE 114 1HG2 ILE 114 12.192 0.778 2.670 860 HG22 ILE 114 2HG2 ILE 114 10.436 0.726 2.812 861 HG23 ILE 114 3HG2 ILE 114 11.279 2.274 2.855 862 HD11 ILE 114 3HD1 ILE 114 13.924 -0.568 0.662 863 HD12 ILE 114 1HD1 ILE 114 12.449 -1.239 -0.034 864 HD13 ILE 114 2HD1 ILE 114 12.466 -0.705 1.645 865 H ASN 115 H ASN 115 10.452 2.488 -1.222 866 HA ASN 115 HA ASN 115 9.969 0.823 -3.601 867 HB2 ASN 115 2HB ASN 115 8.447 2.630 -3.695 868 HB3 ASN 115 1HB ASN 115 9.656 3.779 -3.119 869 HD21 ASN 115 1HD2 ASN 115 9.278 5.167 -4.849 870 HD22 ASN 115 2HD2 ASN 115 9.841 4.799 -6.458 871 H GLU 116 H GLU 116 11.994 -0.056 -3.766 872 HA GLU 116 HA GLU 116 14.446 1.119 -3.390 873 HB2 GLU 116 2HB GLU 116 13.539 -1.064 -5.248 874 HB3 GLU 116 1HB GLU 116 15.232 -0.555 -5.196 875 HG2 GLU 116 2HG GLU 116 13.712 -1.408 -2.752 876 HG3 GLU 116 1HG GLU 116 14.588 -2.542 -3.775 877 H ASN 117 H ASN 117 12.256 1.585 -6.049 878 HA ASN 117 HA ASN 117 14.226 2.719 -7.805 879 HB2 ASN 117 2HB ASN 117 11.600 1.784 -8.084 880 HB3 ASN 117 1HB ASN 117 11.513 3.516 -8.434 881 HD21 ASN 117 1HD2 ASN 117 13.321 0.579 -9.217 882 HD22 ASN 117 2HD2 ASN 117 13.676 1.028 -10.863 883 H GLY 118 H GLY 118 12.555 3.861 -5.087 884 HA2 GLY 118 2HA GLY 118 12.151 6.568 -5.819 885 HA3 GLY 118 1HA GLY 118 12.277 5.948 -4.170 886 H ASN 119 H ASN 119 13.390 7.991 -3.766 887 HA ASN 119 HA ASN 119 16.219 7.884 -4.592 888 HB2 ASN 119 2HB ASN 119 16.283 10.331 -4.315 889 HB3 ASN 119 1HB ASN 119 15.072 9.849 -5.511 890 HD21 ASN 119 1HD2 ASN 119 15.665 11.336 -2.472 891 HD22 ASN 119 2HD2 ASN 119 14.025 11.827 -2.147 892 HA PRO 120 HA PRO 120 17.399 7.773 -0.341 893 HB2 PRO 120 2HB PRO 120 19.477 9.787 -0.605 894 HB3 PRO 120 1HB PRO 120 19.641 8.027 -0.490 895 HG2 PRO 120 2HG PRO 120 20.204 9.445 -2.752 896 HG3 PRO 120 1HG PRO 120 19.659 7.753 -2.764 897 HD2 PRO 120 2HD PRO 120 18.089 10.260 -3.265 898 HD3 PRO 120 1HD PRO 120 18.022 8.695 -4.114 899 H SER 121 H SER 121 15.213 9.477 -0.601 900 HA SER 121 HA SER 121 15.255 10.936 1.757 901 HB2 SER 121 2HB SER 121 16.056 12.489 -0.677 902 HB3 SER 121 1HB SER 121 14.996 13.267 0.508 903 HG SER 121 HG SER 121 17.665 12.568 0.697 904 H TYR 122 H TYR 122 13.602 9.148 0.442 905 HA TYR 122 HA TYR 122 11.080 10.344 0.711 906 HB2 TYR 122 2HB TYR 122 12.346 10.652 -1.867 907 HB3 TYR 122 1HB TYR 122 10.865 9.707 -2.014 908 HD1 TYR 122 1HD TYR 122 9.025 10.883 -0.154 909 HD2 TYR 122 2HD TYR 122 11.965 12.809 -2.549 910 HE1 TYR 122 1HE TYR 122 7.721 12.965 -0.071 911 HE2 TYR 122 2HE TYR 122 10.671 14.895 -2.474 912 HH TYR 122 HH TYR 122 8.603 15.706 -0.422 913 H LYS 123 H LYS 123 12.997 7.828 -0.808 914 HA LYS 123 HA LYS 123 12.596 5.623 -1.255 915 HB2 LYS 123 2HB LYS 123 12.136 6.169 1.586 916 HB3 LYS 123 1HB LYS 123 11.420 4.664 1.037 917 HG2 LYS 123 2HG LYS 123 14.303 5.467 1.127 918 HG3 LYS 123 1HG LYS 123 13.512 4.027 1.793 919 HD2 LYS 123 2HD LYS 123 14.383 3.004 -0.008 920 HD3 LYS 123 1HD LYS 123 13.013 3.723 -0.863 921 HE2 LYS 123 2HE LYS 123 14.342 5.081 -2.043 922 HE3 LYS 123 1HE LYS 123 15.272 5.543 -0.617 923 HZ1 LYS 123 3HZ LYS 123 16.274 4.121 -2.622 924 HZ2 LYS 123 1HZ LYS 123 15.738 2.860 -1.630 925 HZ3 LYS 123 2HZ LYS 123 16.837 3.997 -1.032 926 H TYR 124 H TYR 124 9.805 5.893 0.868 927 HA TYR 124 HA TYR 124 8.145 4.346 -0.752 928 HB2 TYR 124 2HB TYR 124 7.493 6.264 1.474 929 HB3 TYR 124 1HB TYR 124 6.332 5.141 0.759 930 HD1 TYR 124 2HD TYR 124 9.366 5.441 2.807 931 HD2 TYR 124 1HD TYR 124 6.422 2.789 1.268 932 HE1 TYR 124 2HE TYR 124 10.137 3.700 4.359 933 HE2 TYR 124 1HE TYR 124 7.182 1.036 2.818 934 HH TYR 124 HH TYR 124 9.504 1.690 5.337 935 H PHE 125 H PHE 125 9.204 7.174 -1.799 936 HA PHE 125 HA PHE 125 6.628 8.194 -2.740 937 HB2 PHE 125 2HB PHE 125 8.302 9.801 -1.824 938 HB3 PHE 125 1HB PHE 125 9.399 9.350 -3.137 939 HD1 PHE 125 1HD PHE 125 5.734 9.849 -3.370 940 HD2 PHE 125 2HD PHE 125 9.600 11.377 -4.284 941 HE1 PHE 125 1HE PHE 125 4.713 11.560 -4.811 942 HE2 PHE 125 2HE PHE 125 8.585 13.090 -5.727 943 HZ PHE 125 HZ PHE 125 6.139 13.181 -5.993 944 H TYR 126 H TYR 126 5.872 7.344 -4.583 945 HA TYR 126 HA TYR 126 7.825 6.508 -6.618 946 HB2 TYR 126 2HB TYR 126 6.406 4.752 -7.282 947 HB3 TYR 126 1HB TYR 126 6.340 4.733 -5.515 948 HD1 TYR 126 2HD TYR 126 4.346 6.296 -4.555 949 HD2 TYR 126 1HD TYR 126 4.431 4.473 -8.397 950 HE1 TYR 126 2HE TYR 126 1.897 6.429 -4.666 951 HE2 TYR 126 1HE TYR 126 1.979 4.596 -8.516 952 HH TYR 126 HH TYR 126 0.156 6.418 -7.065 953 H VAL 127 H VAL 127 7.992 8.122 -8.034 954 HA VAL 127 HA VAL 127 5.575 9.534 -8.905 955 HB VAL 127 HB VAL 127 7.274 10.980 -10.165 956 HG11 VAL 127 1HG1 VAL 127 6.140 11.751 -8.174 957 HG12 VAL 127 2HG1 VAL 127 7.827 12.265 -8.138 958 HG13 VAL 127 3HG1 VAL 127 7.300 10.900 -7.154 959 HG21 VAL 127 3HG2 VAL 127 9.487 10.672 -9.939 960 HG22 VAL 127 1HG2 VAL 127 9.041 9.027 -9.484 961 HG23 VAL 127 2HG2 VAL 127 9.352 10.234 -8.235 962 H SER 128 H SER 128 5.638 6.952 -9.754 963 HA SER 128 HA SER 128 5.201 7.103 -12.476 964 HB2 SER 128 2HB SER 128 7.693 7.461 -12.578 965 HB3 SER 128 1HB SER 128 7.893 5.827 -11.930 966 HG SER 128 HG SER 128 6.419 5.298 -13.839 967 H ALA 129 H ALA 129 4.379 5.200 -13.311 968 HA ALA 129 HA ALA 129 3.629 3.216 -11.385 969 HB1 ALA 129 1HB ALA 129 2.218 2.323 -13.065 970 HB2 ALA 129 2HB ALA 129 3.124 3.129 -14.346 971 HB3 ALA 129 3HB ALA 129 2.149 4.077 -13.224 972 H GLU 130 H GLU 130 5.872 3.433 -14.069 973 HA GLU 130 HA GLU 130 6.467 0.771 -14.509 974 HB2 GLU 130 2HB GLU 130 7.340 2.977 -15.638 975 HB3 GLU 130 1HB GLU 130 8.676 2.790 -14.498 976 HG2 GLU 130 2HG GLU 130 8.298 0.271 -15.674 977 HG3 GLU 130 1HG GLU 130 8.198 1.452 -16.989 978 H GLN 131 H GLN 131 7.774 2.932 -12.013 979 HA GLN 131 HA GLN 131 9.575 0.923 -11.064 980 HB2 GLN 131 2HB GLN 131 9.641 2.514 -9.023 981 HB3 GLN 131 1HB GLN 131 10.454 2.941 -10.520 982 HG2 GLN 131 2HG GLN 131 9.119 4.701 -10.893 983 HG3 GLN 131 1HG GLN 131 7.678 3.861 -10.326 984 HE21 GLN 131 1HE2 GLN 131 9.441 6.463 -9.756 985 HE22 GLN 131 2HE2 GLN 131 9.258 6.623 -8.046 986 H VAL 132 H VAL 132 6.695 2.453 -9.571 987 HA VAL 132 HA VAL 132 6.550 0.835 -7.344 988 HB VAL 132 HB VAL 132 5.089 2.711 -7.491 989 HG11 VAL 132 1HG1 VAL 132 4.776 2.567 -9.966 990 HG12 VAL 132 2HG1 VAL 132 3.323 2.964 -9.050 991 HG13 VAL 132 3HG1 VAL 132 3.553 1.331 -9.674 992 HG21 VAL 132 3HG2 VAL 132 3.107 0.491 -7.599 993 HG22 VAL 132 1HG2 VAL 132 3.245 1.826 -6.454 994 HG23 VAL 132 2HG2 VAL 132 4.357 0.460 -6.357 995 H VAL 133 H VAL 133 5.868 0.016 -10.643 996 HA VAL 133 HA VAL 133 4.372 -2.350 -9.975 997 HB VAL 133 HB VAL 133 4.027 -1.167 -12.142 998 HG11 VAL 133 1HG1 VAL 133 6.870 -1.835 -12.421 999 HG12 VAL 133 2HG1 VAL 133 5.933 -0.528 -13.139 1000 HG13 VAL 133 3HG1 VAL 133 5.882 -2.139 -13.848 1001 HG21 VAL 133 3HG2 VAL 133 3.783 -3.181 -13.460 1002 HG22 VAL 133 1HG2 VAL 133 3.360 -3.517 -11.782 1003 HG23 VAL 133 2HG2 VAL 133 4.921 -4.035 -12.420 1004 H GLN 134 H GLN 134 7.762 -1.521 -10.608 1005 HA GLN 134 HA GLN 134 8.492 -4.322 -10.812 1006 HB2 GLN 134 2HB GLN 134 10.870 -3.358 -10.444 1007 HB3 GLN 134 1HB GLN 134 10.038 -3.009 -11.951 1008 HG2 GLN 134 2HG GLN 134 9.408 -0.827 -11.107 1009 HG3 GLN 134 1HG GLN 134 10.220 -1.172 -9.581 1010 HE21 GLN 134 1HE2 GLN 134 12.566 -1.943 -9.930 1011 HE22 GLN 134 2HE2 GLN 134 13.506 -0.972 -11.029 1012 H GLY 135 H GLY 135 8.217 -1.884 -8.363 1013 HA2 GLY 135 2HA GLY 135 9.541 -3.421 -6.318 1014 HA3 GLY 135 1HA GLY 135 8.596 -1.945 -6.083 1015 H MET 136 H MET 136 6.328 -3.191 -7.658 1016 HA MET 136 HA MET 136 5.140 -4.536 -5.371 1017 HB2 MET 136 2HB MET 136 3.059 -4.126 -6.311 1018 HB3 MET 136 1HB MET 136 3.994 -2.739 -6.841 1019 HG2 MET 136 2HG MET 136 3.067 -3.235 -8.822 1020 HG3 MET 136 1HG MET 136 4.408 -4.373 -8.922 1021 HE1 MET 136 3HE MET 136 0.229 -4.465 -8.948 1022 HE2 MET 136 1HE MET 136 1.038 -3.735 -7.562 1023 HE3 MET 136 2HE MET 136 0.250 -5.304 -7.398 1024 H LYS 137 H LYS 137 6.162 -5.246 -8.647 1025 HA LYS 137 HA LYS 137 5.100 -7.903 -8.653 1026 HB2 LYS 137 2HB LYS 137 6.082 -8.154 -10.776 1027 HB3 LYS 137 1HB LYS 137 5.611 -6.465 -10.697 1028 HG2 LYS 137 2HG LYS 137 8.044 -6.059 -9.940 1029 HG3 LYS 137 1HG LYS 137 8.346 -7.670 -10.592 1030 HD2 LYS 137 2HD LYS 137 7.265 -5.272 -12.069 1031 HD3 LYS 137 1HD LYS 137 8.829 -6.052 -12.302 1032 HE2 LYS 137 2HE LYS 137 6.205 -7.465 -12.736 1033 HE3 LYS 137 1HE LYS 137 7.046 -6.588 -14.013 1034 HZ1 LYS 137 3HZ LYS 137 9.026 -8.069 -13.332 1035 HZ2 LYS 137 1HZ LYS 137 7.798 -8.734 -14.286 1036 HZ3 LYS 137 2HZ LYS 137 7.850 -9.059 -12.627 1037 H GLU 138 H GLU 138 7.803 -6.446 -7.224 1038 HA GLU 138 HA GLU 138 9.486 -8.796 -7.225 1039 HB2 GLU 138 2HB GLU 138 9.900 -6.055 -6.764 1040 HB3 GLU 138 1HB GLU 138 10.185 -6.839 -5.210 1041 HG2 GLU 138 2HG GLU 138 11.439 -8.185 -7.488 1042 HG3 GLU 138 1HG GLU 138 12.032 -6.543 -7.183 1043 H ALA 139 H ALA 139 7.816 -6.876 -4.758 1044 HA ALA 139 HA ALA 139 8.121 -8.656 -2.624 1045 HB1 ALA 139 1HB ALA 139 5.675 -7.415 -2.197 1046 HB2 ALA 139 2HB ALA 139 6.578 -6.274 -3.193 1047 HB3 ALA 139 3HB ALA 139 7.256 -6.839 -1.666 1048 H GLN 140 H GLN 140 6.138 -8.810 -5.419 1049 HA GLN 140 HA GLN 140 3.968 -10.282 -4.587 1050 HB2 GLN 140 2HB GLN 140 5.431 -9.950 -7.143 1051 HB3 GLN 140 1HB GLN 140 4.356 -11.348 -7.029 1052 HG2 GLN 140 2HG GLN 140 2.496 -9.859 -6.466 1053 HG3 GLN 140 1HG GLN 140 3.574 -8.468 -6.593 1054 HE21 GLN 140 1HE2 GLN 140 3.192 -11.364 -8.606 1055 HE22 GLN 140 2HE2 GLN 140 2.863 -10.511 -10.071 1056 H GLU 141 H GLU 141 7.262 -11.271 -4.800 1057 HA GLU 141 HA GLU 141 6.448 -14.022 -4.199 1058 HB2 GLU 141 2HB GLU 141 8.048 -14.945 -5.570 1059 HB3 GLU 141 1HB GLU 141 7.518 -13.542 -6.506 1060 HG2 GLU 141 2HG GLU 141 9.414 -12.302 -5.419 1061 HG3 GLU 141 1HG GLU 141 10.000 -13.871 -4.884 1062 H ARG 142 H ARG 142 8.797 -11.477 -3.650 1063 HA ARG 142 HA ARG 142 10.198 -13.008 -1.640 1064 HB2 ARG 142 2HB ARG 142 11.560 -10.984 -1.349 1065 HB3 ARG 142 1HB ARG 142 11.447 -11.459 -3.049 1066 HG2 ARG 142 2HG ARG 142 11.103 -9.217 -3.246 1067 HG3 ARG 142 1HG ARG 142 9.433 -9.759 -3.029 1068 HD2 ARG 142 2HD ARG 142 10.078 -7.773 -1.653 1069 HD3 ARG 142 1HD ARG 142 9.458 -9.146 -0.723 1070 HE ARG 142 HE ARG 142 11.514 -9.360 0.273 1071 HH11 ARG 142 1HH1 ARG 142 11.804 -7.247 -2.492 1072 HH12 ARG 142 2HH1 ARG 142 13.419 -6.757 -2.105 1073 HH21 ARG 142 1HH2 ARG 142 13.638 -8.714 0.781 1074 HH22 ARG 142 2HH2 ARG 142 14.461 -7.589 -0.248 1075 H LEU 143 H LEU 143 7.473 -10.914 -1.716 1076 HA LEU 143 HA LEU 143 7.679 -10.528 1.198 1077 HB2 LEU 143 2HB LEU 143 7.607 -8.429 0.063 1078 HB3 LEU 143 1HB LEU 143 6.233 -8.941 -0.914 1079 HG LEU 143 HG LEU 143 4.886 -9.034 1.210 1080 HD11 LEU 143 1HD1 LEU 143 5.801 -8.677 3.197 1081 HD12 LEU 143 2HD1 LEU 143 6.518 -7.162 2.653 1082 HD13 LEU 143 3HD1 LEU 143 7.382 -8.680 2.414 1083 HD21 LEU 143 3HD2 LEU 143 5.959 -6.629 -0.122 1084 HD22 LEU 143 1HD2 LEU 143 5.079 -6.372 1.387 1085 HD23 LEU 143 2HD2 LEU 143 4.295 -7.194 0.037 1086 H THR 144 H THR 144 5.972 -12.185 -1.233 1087 HA THR 144 HA THR 144 3.517 -12.452 0.268 1088 HB THR 144 HB THR 144 2.920 -14.018 -1.591 1089 HG1 THR 144 1HG THR 144 4.869 -14.763 -2.266 1090 HG21 THR 144 3HG2 THR 144 2.319 -11.686 -1.825 1091 HG22 THR 144 1HG2 THR 144 2.806 -12.363 -3.377 1092 HG23 THR 144 2HG2 THR 144 3.916 -11.327 -2.480 1093 H GLY 145 H GLY 145 3.333 -13.839 1.908 1094 HA2 GLY 145 2HA GLY 145 3.277 -16.081 2.724 1095 HA3 GLY 145 1HA GLY 145 4.638 -16.462 1.679 1096 H ASP 146 H ASP 146 4.689 -13.554 3.573 1097 HA ASP 146 HA ASP 146 6.046 -12.851 5.255 1098 HB2 ASP 146 2HB ASP 146 5.142 -15.546 6.085 1099 HB3 ASP 146 1HB ASP 146 6.534 -14.900 6.951 1100 H ALA 147 H ALA 147 7.240 -14.050 2.820 1101 HA ALA 147 HA ALA 147 9.614 -15.433 3.650 1102 HB1 ALA 147 1HB ALA 147 8.636 -14.320 1.045 1103 HB2 ALA 147 2HB ALA 147 8.939 -15.998 1.497 1104 HB3 ALA 147 3HB ALA 147 10.293 -14.903 1.218 1105 H PHE 148 H PHE 148 8.699 -12.123 3.085 1106 HA PHE 148 HA PHE 148 11.204 -10.946 2.725 1107 HB2 PHE 148 2HB PHE 148 10.155 -8.866 3.454 1108 HB3 PHE 148 1HB PHE 148 9.058 -9.766 2.397 1109 HD1 PHE 148 1HD PHE 148 7.134 -10.985 3.382 1110 HD2 PHE 148 2HD PHE 148 9.582 -8.380 5.691 1111 HE1 PHE 148 1HE PHE 148 5.387 -10.881 5.111 1112 HE2 PHE 148 2HE PHE 148 7.838 -8.270 7.423 1113 HZ PHE 148 HZ PHE 148 5.738 -9.522 7.135 1114 H ARG 149 H ARG 149 9.460 -11.783 5.685 1115 HA ARG 149 HA ARG 149 11.062 -10.539 7.562 1116 HB2 ARG 149 2HB ARG 149 9.536 -13.138 7.686 1117 HB3 ARG 149 1HB ARG 149 10.299 -12.403 9.086 1118 HG2 ARG 149 2HG ARG 149 8.901 -10.310 8.374 1119 HG3 ARG 149 1HG ARG 149 7.917 -11.516 7.545 1120 HD2 ARG 149 2HD ARG 149 7.067 -12.310 9.462 1121 HD3 ARG 149 1HD ARG 149 8.622 -12.241 10.290 1122 HE ARG 149 HE ARG 149 6.542 -10.260 10.334 1123 HH11 ARG 149 1HH1 ARG 149 9.962 -10.820 10.733 1124 HH12 ARG 149 2HH1 ARG 149 10.200 -9.432 11.740 1125 HH21 ARG 149 1HH2 ARG 149 6.852 -8.432 11.658 1126 HH22 ARG 149 2HH2 ARG 149 8.435 -8.077 12.266 1127 H LYS 150 H LYS 150 13.217 -10.630 7.572 1128 HA LYS 150 HA LYS 150 14.714 -12.893 6.711 1129 HB2 LYS 150 2HB LYS 150 16.669 -11.641 7.444 1130 HB3 LYS 150 1HB LYS 150 15.574 -10.589 6.558 1131 HG2 LYS 150 2HG LYS 150 14.686 -10.105 9.020 1132 HG3 LYS 150 1HG LYS 150 16.348 -10.554 9.412 1133 HD2 LYS 150 2HD LYS 150 16.752 -8.888 7.315 1134 HD3 LYS 150 1HD LYS 150 15.303 -8.177 8.027 1135 HE2 LYS 150 2HE LYS 150 16.683 -7.129 9.434 1136 HE3 LYS 150 1HE LYS 150 16.891 -8.694 10.217 1137 HZ1 LYS 150 3HZ LYS 150 18.932 -8.980 9.311 1138 HZ2 LYS 150 1HZ LYS 150 18.923 -7.289 9.322 1139 HZ3 LYS 150 2HZ LYS 150 18.570 -8.127 7.897 1140 H LYS 151 H LYS 151 16.693 -13.358 8.443 1141 HA LYS 151 HA LYS 151 15.471 -15.049 10.379 1142 HB2 LYS 151 2HB LYS 151 18.381 -14.259 10.173 1143 HB3 LYS 151 1HB LYS 151 17.728 -15.664 11.005 1144 HG2 LYS 151 2HG LYS 151 17.147 -16.719 8.978 1145 HG3 LYS 151 1HG LYS 151 17.393 -15.237 8.051 1146 HD2 LYS 151 2HD LYS 151 19.731 -16.177 9.575 1147 HD3 LYS 151 1HD LYS 151 19.216 -17.230 8.256 1148 HE2 LYS 151 2HE LYS 151 20.511 -15.875 7.008 1149 HE3 LYS 151 1HE LYS 151 19.097 -14.823 7.039 1150 HZ1 LYS 151 3HZ LYS 151 21.594 -14.612 8.589 1151 HZ2 LYS 151 1HZ LYS 151 20.171 -13.904 9.172 1152 HZ3 LYS 151 2HZ LYS 151 20.802 -13.428 7.677 1153 H HIS 152 H HIS 152 16.582 -14.998 12.697 1154 HA HIS 152 HA HIS 152 16.641 -14.003 14.740 1155 HB2 HIS 152 2HB HIS 152 17.383 -11.566 13.108 1156 HB3 HIS 152 1HB HIS 152 17.502 -11.675 14.862 1157 HD1 HIS 152 1HD HIS 152 19.381 -12.290 11.816 1158 HD2 HIS 152 2HD HIS 152 19.429 -13.723 15.716 1159 HE1 HIS 152 1HE HIS 152 21.621 -13.397 12.097 1160 HE2 HIS 152 2HE HIS 152 21.661 -14.181 14.492 1161 H LEU 153 H LEU 153 14.802 -13.790 15.812 1162 HA LEU 153 HA LEU 153 12.631 -12.200 14.706 1163 HB2 LEU 153 2HB LEU 153 11.348 -13.136 16.650 1164 HB3 LEU 153 1HB LEU 153 11.959 -14.324 15.512 1165 HG LEU 153 HG LEU 153 13.752 -13.793 17.779 1166 HD11 LEU 153 1HD1 LEU 153 11.509 -13.600 18.839 1167 HD12 LEU 153 2HD1 LEU 153 12.468 -14.957 19.426 1168 HD13 LEU 153 3HD1 LEU 153 11.157 -15.235 18.281 1169 HD21 LEU 153 3HD2 LEU 153 14.111 -16.121 17.671 1170 HD22 LEU 153 1HD2 LEU 153 13.951 -15.584 15.998 1171 HD23 LEU 153 2HD2 LEU 153 12.603 -16.391 16.798 1172 H GLU 154 H GLU 154 14.866 -12.181 17.404 1173 HA GLU 154 HA GLU 154 13.910 -9.486 18.096 1174 HB2 GLU 154 2HB GLU 154 13.832 -11.807 19.746 1175 HB3 GLU 154 1HB GLU 154 15.038 -10.714 20.413 1176 HG2 GLU 154 2HG GLU 154 12.785 -9.155 19.738 1177 HG3 GLU 154 1HG GLU 154 12.202 -10.584 20.593 1178 H ASP 155 H ASP 155 16.595 -11.794 18.235 1179 HA ASP 155 HA ASP 155 18.846 -11.517 18.078 1180 HB2 ASP 155 2HB ASP 155 17.845 -9.736 16.290 1181 HB3 ASP 155 1HB ASP 155 18.742 -8.656 17.351 1182 H GLU 156 H GLU 156 20.497 -10.977 19.443 1183 HA GLU 156 HA GLU 156 21.523 -10.214 21.322 1184 HB2 GLU 156 2HB GLU 156 20.643 -7.970 19.996 1185 HB3 GLU 156 1HB GLU 156 19.964 -7.745 21.612 1186 HG2 GLU 156 2HG GLU 156 22.069 -6.672 21.584 1187 HG3 GLU 156 1HG GLU 156 22.260 -8.149 22.527 1188 H LEU 157 H LEU 157 19.051 -11.767 21.506 1189 HA LEU 157 HA LEU 157 17.605 -12.540 23.081 1190 HB2 LEU 157 2HB LEU 157 19.941 -11.763 24.426 1191 HB3 LEU 157 1HB LEU 157 18.621 -11.136 25.394 1192 HG LEU 157 HG LEU 157 17.647 -13.387 25.534 1193 HD11 LEU 157 1HD1 LEU 157 18.379 -14.343 23.465 1194 HD12 LEU 157 2HD1 LEU 157 19.029 -15.314 24.787 1195 HD13 LEU 157 3HD1 LEU 157 20.071 -14.178 23.932 1196 HD21 LEU 157 3HD2 LEU 157 19.575 -14.433 26.839 1197 HD22 LEU 157 1HD2 LEU 157 19.016 -12.842 27.356 1198 HD23 LEU 157 2HD2 LEU 157 20.493 -12.991 26.404 Start of MODEL 12 1 H1 MET 1 1HT MET 1 -31.019 -18.967 0.418 2 H2 MET 1 2HT MET 1 -29.548 -19.382 1.200 3 H3 MET 1 3HT MET 1 -30.159 -17.781 1.309 4 HA MET 1 HA MET 1 -32.166 -18.784 2.372 5 HB2 MET 1 2HB MET 1 -31.124 -21.106 1.572 6 HB3 MET 1 1HB MET 1 -30.352 -21.018 3.149 7 HG2 MET 1 2HG MET 1 -32.335 -21.208 4.287 8 HG3 MET 1 1HG MET 1 -33.289 -20.577 2.947 9 HE1 MET 1 2HE MET 1 -31.820 -24.051 4.513 10 HE2 MET 1 3HE MET 1 -30.637 -23.214 3.509 11 HE3 MET 1 1HE MET 1 -31.347 -24.729 2.955 12 H HIS 2 H HIS 2 -28.695 -19.073 3.049 13 HA HIS 2 HA HIS 2 -29.037 -17.319 5.351 14 HB2 HIS 2 2HB HIS 2 -27.714 -18.786 6.815 15 HB3 HIS 2 1HB HIS 2 -29.205 -19.569 6.300 16 HD1 HIS 2 1HD HIS 2 -28.960 -21.499 4.522 17 HD2 HIS 2 2HD HIS 2 -25.383 -20.066 6.079 18 HE1 HIS 2 1HE HIS 2 -27.225 -23.214 3.910 19 HE2 HIS 2 2HE HIS 2 -25.086 -22.369 4.939 20 H HIS 3 H HIS 3 -26.738 -19.189 3.393 21 HA HIS 3 HA HIS 3 -25.126 -16.834 2.976 22 HB2 HIS 3 2HB HIS 3 -24.438 -18.040 5.214 23 HB3 HIS 3 1HB HIS 3 -23.631 -19.160 4.121 24 HD1 HIS 3 1HD HIS 3 -23.527 -15.601 5.302 25 HD2 HIS 3 2HD HIS 3 -21.325 -18.187 2.909 26 HE1 HIS 3 1HE HIS 3 -21.357 -14.414 4.849 27 HE2 HIS 3 2HE HIS 3 -20.003 -16.038 3.479 28 H HIS 4 H HIS 4 -23.499 -17.133 1.346 29 HA HIS 4 HA HIS 4 -23.666 -19.648 -0.151 30 HB2 HIS 4 2HB HIS 4 -24.653 -17.037 -1.008 31 HB3 HIS 4 1HB HIS 4 -23.498 -17.727 -2.143 32 HD1 HIS 4 1HD HIS 4 -24.177 -20.571 -2.363 33 HD2 HIS 4 2HD HIS 4 -27.126 -17.687 -1.854 34 HE1 HIS 4 1HE HIS 4 -26.298 -21.621 -3.213 35 HE2 HIS 4 2HE HIS 4 -28.084 -19.888 -2.816 36 H HIS 5 H HIS 5 -22.026 -19.392 -2.132 37 HA HIS 5 HA HIS 5 -19.459 -18.919 -0.884 38 HB2 HIS 5 2HB HIS 5 -18.553 -19.867 -3.011 39 HB3 HIS 5 1HB HIS 5 -19.690 -20.932 -2.190 40 HD1 HIS 5 1HD HIS 5 -19.521 -18.574 -5.144 41 HD2 HIS 5 2HD HIS 5 -21.854 -21.689 -3.690 42 HE1 HIS 5 1HE HIS 5 -21.134 -19.123 -6.991 43 HE2 HIS 5 2HE HIS 5 -22.481 -21.067 -6.121 44 H HIS 6 H HIS 6 -21.350 -17.611 -3.567 45 HA HIS 6 HA HIS 6 -19.341 -15.788 -4.437 46 HB2 HIS 6 2HB HIS 6 -21.213 -14.741 -5.721 47 HB3 HIS 6 1HB HIS 6 -21.050 -16.473 -5.992 48 HD1 HIS 6 1HD HIS 6 -23.101 -17.845 -5.651 49 HD2 HIS 6 2HD HIS 6 -23.407 -14.094 -3.887 50 HE1 HIS 6 1HE HIS 6 -25.474 -17.678 -4.830 51 HE2 HIS 6 2HE HIS 6 -25.609 -15.435 -3.690 52 H HIS 7 H HIS 7 -19.228 -13.546 -4.146 53 HA HIS 7 HA HIS 7 -19.955 -12.646 -1.534 54 HB2 HIS 7 2HB HIS 7 -18.650 -11.285 -3.891 55 HB3 HIS 7 1HB HIS 7 -18.982 -10.448 -2.377 56 HD1 HIS 7 1HD HIS 7 -16.992 -13.400 -3.677 57 HD2 HIS 7 2HD HIS 7 -17.080 -10.783 -0.450 58 HE1 HIS 7 1HE HIS 7 -14.909 -13.892 -2.356 59 HE2 HIS 7 2HE HIS 7 -15.032 -12.359 -0.360 60 H MET 8 H MET 8 -20.784 -10.169 -1.555 61 HA MET 8 HA MET 8 -23.519 -10.357 -2.381 62 HB2 MET 8 2HB MET 8 -21.884 -8.255 -0.982 63 HB3 MET 8 1HB MET 8 -23.539 -7.922 -1.506 64 HG2 MET 8 2HG MET 8 -24.457 -9.344 0.027 65 HG3 MET 8 1HG MET 8 -23.022 -10.367 0.105 66 HE1 MET 8 3HE MET 8 -20.552 -8.859 1.051 67 HE2 MET 8 1HE MET 8 -21.308 -10.292 1.750 68 HE3 MET 8 2HE MET 8 -20.860 -8.936 2.787 69 H SER 9 H SER 9 -21.074 -7.844 -3.054 70 HA SER 9 HA SER 9 -21.682 -7.853 -5.860 71 HB2 SER 9 2HB SER 9 -22.395 -5.434 -5.886 72 HB3 SER 9 1HB SER 9 -23.575 -6.539 -5.180 73 HG SER 9 HG SER 9 -22.773 -5.910 -3.113 74 H ASP 10 H ASP 10 -20.524 -5.440 -3.500 75 HA ASP 10 HA ASP 10 -17.792 -5.770 -4.243 76 HB2 ASP 10 2HB ASP 10 -17.506 -3.474 -5.203 77 HB3 ASP 10 1HB ASP 10 -18.417 -4.575 -6.234 78 H GLY 11 H GLY 11 -20.165 -3.460 -2.949 79 HA2 GLY 11 2HA GLY 11 -20.129 -3.011 -0.554 80 HA3 GLY 11 1HA GLY 11 -18.376 -3.098 -0.628 81 H HIS 12 H HIS 12 -17.275 -1.409 -1.906 82 HA HIS 12 HA HIS 12 -18.726 1.006 -2.496 83 HB2 HIS 12 2HB HIS 12 -17.377 2.401 -0.901 84 HB3 HIS 12 1HB HIS 12 -18.555 1.335 -0.123 85 HD1 HIS 12 1HD HIS 12 -14.860 1.135 -1.062 86 HD2 HIS 12 2HD HIS 12 -17.473 0.037 1.976 87 HE1 HIS 12 1HE HIS 12 -13.426 0.056 0.699 88 HE2 HIS 12 2HE HIS 12 -15.041 -0.682 2.487 89 H ASN 13 H ASN 13 -17.121 2.801 -3.105 90 HA ASN 13 HA ASN 13 -14.478 2.029 -3.863 91 HB2 ASN 13 2HB ASN 13 -16.307 1.077 -5.602 92 HB3 ASN 13 1HB ASN 13 -16.059 2.681 -6.284 93 HD21 ASN 13 1HD2 ASN 13 -14.609 2.715 -7.823 94 HD22 ASN 13 2HD2 ASN 13 -13.196 1.726 -7.923 95 H GLY 14 H GLY 14 -13.786 3.788 -5.729 96 HA2 GLY 14 2HA GLY 14 -14.011 6.095 -6.386 97 HA3 GLY 14 1HA GLY 14 -14.854 6.397 -4.862 98 H LEU 15 H LEU 15 -11.693 5.262 -6.065 99 HA LEU 15 HA LEU 15 -10.378 7.122 -4.251 100 HB2 LEU 15 2HB LEU 15 -9.431 4.278 -4.282 101 HB3 LEU 15 1HB LEU 15 -9.069 5.545 -3.127 102 HG LEU 15 HG LEU 15 -11.635 5.384 -2.588 103 HD11 LEU 15 1HD1 LEU 15 -11.696 3.604 -4.557 104 HD12 LEU 15 2HD1 LEU 15 -12.744 3.481 -3.145 105 HD13 LEU 15 3HD1 LEU 15 -11.273 2.513 -3.237 106 HD21 LEU 15 3HD2 LEU 15 -9.966 4.950 -0.942 107 HD22 LEU 15 1HD2 LEU 15 -9.530 3.420 -1.702 108 HD23 LEU 15 2HD2 LEU 15 -11.097 3.598 -0.917 109 H GLY 16 H GLY 16 -9.426 4.317 -6.241 110 HA2 GLY 16 2HA GLY 16 -7.329 5.945 -7.469 111 HA3 GLY 16 1HA GLY 16 -7.495 4.201 -7.582 112 H LYS 17 H LYS 17 -9.629 6.949 -8.348 113 HA LYS 17 HA LYS 17 -10.116 5.721 -10.975 114 HB2 LYS 17 2HB LYS 17 -12.173 7.076 -11.030 115 HB3 LYS 17 1HB LYS 17 -12.125 6.011 -9.633 116 HG2 LYS 17 2HG LYS 17 -11.059 8.723 -9.215 117 HG3 LYS 17 1HG LYS 17 -12.794 8.608 -9.513 118 HD2 LYS 17 2HD LYS 17 -13.191 7.474 -7.572 119 HD3 LYS 17 1HD LYS 17 -11.600 6.711 -7.565 120 HE2 LYS 17 2HE LYS 17 -11.006 8.199 -6.020 121 HE3 LYS 17 1HE LYS 17 -11.069 9.424 -7.287 122 HZ1 LYS 17 3HZ LYS 17 -13.060 10.201 -6.564 123 HZ2 LYS 17 1HZ LYS 17 -12.468 9.635 -5.085 124 HZ3 LYS 17 2HZ LYS 17 -13.577 8.708 -5.964 125 H GLY 18 H GLY 18 -9.769 6.839 -12.844 126 HA2 GLY 18 2HA GLY 18 -9.524 8.932 -14.041 127 HA3 GLY 18 1HA GLY 18 -8.783 9.610 -12.588 128 H PHE 19 H PHE 19 -6.674 8.696 -11.944 129 HA PHE 19 HA PHE 19 -4.940 8.553 -14.219 130 HB2 PHE 19 2HB PHE 19 -3.145 8.266 -12.452 131 HB3 PHE 19 1HB PHE 19 -4.108 9.744 -12.333 132 HD1 PHE 19 2HD PHE 19 -3.480 6.434 -10.855 133 HD2 PHE 19 1HD PHE 19 -5.520 10.148 -10.460 134 HE1 PHE 19 2HE PHE 19 -4.025 5.883 -8.520 135 HE2 PHE 19 1HE PHE 19 -6.068 9.603 -8.124 136 HZ PHE 19 HZ PHE 19 -5.320 7.467 -7.151 137 H GLY 20 H GLY 20 -6.247 6.269 -11.904 138 HA2 GLY 20 2HA GLY 20 -4.894 4.110 -13.408 139 HA3 GLY 20 1HA GLY 20 -5.130 4.041 -11.661 140 H ASP 21 H ASP 21 -6.758 2.780 -11.041 141 HA ASP 21 HA ASP 21 -9.384 2.982 -11.930 142 HB2 ASP 21 2HB ASP 21 -7.697 1.214 -13.562 143 HB3 ASP 21 1HB ASP 21 -9.172 0.442 -12.960 144 H HIS 22 H HIS 22 -7.959 -0.217 -11.566 145 HA HIS 22 HA HIS 22 -8.858 -0.282 -8.764 146 HB2 HIS 22 2HB HIS 22 -9.682 -2.590 -9.133 147 HB3 HIS 22 1HB HIS 22 -10.565 -1.403 -10.088 148 HD1 HIS 22 1HD HIS 22 -8.572 -4.468 -10.371 149 HD2 HIS 22 2HD HIS 22 -9.868 -1.434 -12.895 150 HE1 HIS 22 1HE HIS 22 -8.263 -5.358 -12.701 151 HE2 HIS 22 2HE HIS 22 -9.135 -3.537 -14.210 152 H ILE 23 H ILE 23 -6.869 -0.246 -7.841 153 HA ILE 23 HA ILE 23 -5.215 -2.605 -8.137 154 HB ILE 23 HB ILE 23 -4.194 0.174 -8.738 155 HG12 ILE 23 2HG1 ILE 23 -3.291 -1.386 -10.740 156 HG13 ILE 23 1HG1 ILE 23 -4.776 -2.243 -10.347 157 HG21 ILE 23 1HG2 ILE 23 -2.617 -2.359 -8.364 158 HG22 ILE 23 2HG2 ILE 23 -2.607 -0.951 -7.305 159 HG23 ILE 23 3HG2 ILE 23 -1.978 -0.822 -8.946 160 HD11 ILE 23 3HD1 ILE 23 -5.166 0.626 -10.524 161 HD12 ILE 23 1HD1 ILE 23 -6.031 -0.689 -11.323 162 HD13 ILE 23 2HD1 ILE 23 -4.532 -0.071 -12.015 163 H HIS 24 H HIS 24 -4.130 0.515 -6.876 164 HA HIS 24 HA HIS 24 -3.840 -0.676 -4.257 165 HB2 HIS 24 2HB HIS 24 -3.004 2.116 -4.984 166 HB3 HIS 24 1HB HIS 24 -2.365 1.081 -3.704 167 HD1 HIS 24 1HD HIS 24 -2.160 1.656 -7.417 168 HD2 HIS 24 2HD HIS 24 -0.363 -0.679 -4.491 169 HE1 HIS 24 1HE HIS 24 -0.137 0.633 -8.510 170 HE2 HIS 24 2HE HIS 24 0.973 -0.713 -6.700 171 H TRP 25 H TRP 25 -6.427 -0.216 -5.124 172 HA TRP 25 HA TRP 25 -7.445 1.364 -2.926 173 HB2 TRP 25 2HB TRP 25 -9.066 2.278 -4.956 174 HB3 TRP 25 1HB TRP 25 -7.726 3.184 -4.240 175 HD1 TRP 25 HD TRP 25 -8.727 1.320 -7.386 176 HE1 TRP 25 1HE TRP 25 -6.931 1.684 -9.181 177 HE3 TRP 25 3HE TRP 25 -5.180 3.669 -4.573 178 HZ2 TRP 25 2HZ TRP 25 -4.372 2.842 -9.402 179 HZ3 TRP 25 3HZ TRP 25 -3.107 4.372 -5.628 180 HH2 TRP 25 HH TRP 25 -2.694 3.971 -8.006 181 H ARG 26 H ARG 26 -7.403 -1.363 -4.584 182 HA ARG 26 HA ARG 26 -9.898 -2.073 -5.379 183 HB2 ARG 26 2HB ARG 26 -7.578 -3.410 -5.082 184 HB3 ARG 26 1HB ARG 26 -8.495 -4.104 -3.739 185 HG2 ARG 26 2HG ARG 26 -8.747 -5.489 -5.685 186 HG3 ARG 26 1HG ARG 26 -10.287 -4.708 -5.323 187 HD2 ARG 26 2HD ARG 26 -9.138 -2.908 -7.020 188 HD3 ARG 26 1HD ARG 26 -8.535 -4.446 -7.660 189 HE ARG 26 HE ARG 26 -11.227 -3.455 -7.772 190 HH11 ARG 26 1HH1 ARG 26 -9.251 -6.330 -7.765 191 HH12 ARG 26 2HH1 ARG 26 -10.431 -7.294 -8.587 192 HH21 ARG 26 1HH2 ARG 26 -12.782 -4.721 -8.852 193 HH22 ARG 26 2HH2 ARG 26 -12.437 -6.381 -9.205 194 H THR 27 H THR 27 -8.606 -2.470 -2.078 195 HA THR 27 HA THR 27 -10.768 -1.541 -0.668 196 HB THR 27 HB THR 27 -11.548 -4.096 -0.039 197 HG1 THR 27 1HG THR 27 -10.950 -5.279 -1.666 198 HG21 THR 27 3HG2 THR 27 -13.416 -2.919 -0.269 199 HG22 THR 27 1HG2 THR 27 -13.377 -3.429 -1.956 200 HG23 THR 27 2HG2 THR 27 -12.710 -1.865 -1.492 201 H LEU 28 H LEU 28 -10.552 -1.761 1.549 202 HA LEU 28 HA LEU 28 -8.016 -2.927 2.410 203 HB2 LEU 28 2HB LEU 28 -8.566 -0.568 2.981 204 HB3 LEU 28 1HB LEU 28 -9.933 -1.153 3.932 205 HG LEU 28 HG LEU 28 -7.166 -2.124 4.552 206 HD11 LEU 28 1HD1 LEU 28 -7.589 0.535 4.432 207 HD12 LEU 28 2HD1 LEU 28 -6.499 -0.239 5.581 208 HD13 LEU 28 3HD1 LEU 28 -8.135 0.200 6.076 209 HD21 LEU 28 3HD2 LEU 28 -9.814 -1.976 5.894 210 HD22 LEU 28 1HD2 LEU 28 -8.364 -1.887 6.892 211 HD23 LEU 28 2HD2 LEU 28 -8.635 -3.287 5.857 212 H GLU 29 H GLU 29 -11.397 -2.813 3.542 213 HA GLU 29 HA GLU 29 -11.140 -4.828 5.477 214 HB2 GLU 29 2HB GLU 29 -13.086 -3.129 4.958 215 HB3 GLU 29 1HB GLU 29 -13.711 -4.458 3.990 216 HG2 GLU 29 2HG GLU 29 -12.922 -5.411 6.576 217 HG3 GLU 29 1HG GLU 29 -14.018 -4.039 6.739 218 H ASP 30 H ASP 30 -11.906 -4.954 2.043 219 HA ASP 30 HA ASP 30 -12.363 -7.806 2.085 220 HB2 ASP 30 2HB ASP 30 -12.760 -5.624 0.204 221 HB3 ASP 30 1HB ASP 30 -12.022 -7.030 -0.577 222 H GLY 31 H GLY 31 -9.798 -5.574 1.165 223 HA2 GLY 31 2HA GLY 31 -8.113 -7.359 -0.179 224 HA3 GLY 31 1HA GLY 31 -7.577 -5.920 0.697 225 H LYS 32 H LYS 32 -8.597 -6.820 3.260 226 HA LYS 32 HA LYS 32 -6.369 -8.519 3.987 227 HB2 LYS 32 2HB LYS 32 -7.097 -8.099 6.304 228 HB3 LYS 32 1HB LYS 32 -6.871 -6.608 5.400 229 HG2 LYS 32 2HG LYS 32 -9.002 -6.005 5.654 230 HG3 LYS 32 1HG LYS 32 -9.599 -7.618 5.264 231 HD2 LYS 32 2HD LYS 32 -8.537 -8.077 7.700 232 HD3 LYS 32 1HD LYS 32 -9.015 -6.388 7.882 233 HE2 LYS 32 2HE LYS 32 -11.243 -7.314 6.759 234 HE3 LYS 32 1HE LYS 32 -10.684 -8.812 7.502 235 HZ1 LYS 32 3HZ LYS 32 -12.196 -7.401 8.894 236 HZ2 LYS 32 1HZ LYS 32 -10.940 -6.272 9.007 237 HZ3 LYS 32 2HZ LYS 32 -10.735 -7.832 9.630 238 H LYS 33 H LYS 33 -9.839 -8.741 3.657 239 HA LYS 33 HA LYS 33 -10.250 -11.127 5.095 240 HB2 LYS 33 2HB LYS 33 -11.797 -9.371 3.470 241 HB3 LYS 33 1HB LYS 33 -12.051 -11.009 2.881 242 HG2 LYS 33 2HG LYS 33 -12.724 -11.737 5.090 243 HG3 LYS 33 1HG LYS 33 -12.393 -10.122 5.739 244 HD2 LYS 33 2HD LYS 33 -14.508 -9.594 5.279 245 HD3 LYS 33 1HD LYS 33 -14.100 -9.705 3.565 246 HE2 LYS 33 2HE LYS 33 -14.470 -12.323 4.195 247 HE3 LYS 33 1HE LYS 33 -15.626 -11.545 5.276 248 HZ1 LYS 33 3HZ LYS 33 -16.229 -12.192 2.803 249 HZ2 LYS 33 1HZ LYS 33 -15.587 -10.657 2.495 250 HZ3 LYS 33 2HZ LYS 33 -16.893 -10.831 3.556 251 H GLU 34 H GLU 34 -9.822 -10.597 1.597 252 HA GLU 34 HA GLU 34 -9.684 -13.372 0.983 253 HB2 GLU 34 2HB GLU 34 -10.339 -11.619 -0.655 254 HB3 GLU 34 1HB GLU 34 -8.677 -11.027 -0.642 255 HG2 GLU 34 2HG GLU 34 -7.943 -12.669 -1.976 256 HG3 GLU 34 1HG GLU 34 -8.963 -13.893 -1.205 257 H ALA 35 H ALA 35 -7.349 -10.928 1.850 258 HA ALA 35 HA ALA 35 -5.005 -12.249 1.030 259 HB1 ALA 35 1HB ALA 35 -4.629 -10.040 1.534 260 HB2 ALA 35 2HB ALA 35 -4.018 -10.820 2.992 261 HB3 ALA 35 3HB ALA 35 -5.622 -10.089 2.989 262 H ALA 36 H ALA 36 -7.150 -12.819 3.666 263 HA ALA 36 HA ALA 36 -5.293 -14.157 5.374 264 HB1 ALA 36 1HB ALA 36 -7.176 -13.301 6.464 265 HB2 ALA 36 2HB ALA 36 -7.456 -15.041 6.425 266 HB3 ALA 36 3HB ALA 36 -8.287 -13.989 5.280 267 H ALA 37 H ALA 37 -7.508 -15.154 2.828 268 HA ALA 37 HA ALA 37 -6.998 -17.968 3.286 269 HB1 ALA 37 1HB ALA 37 -9.206 -17.447 2.597 270 HB2 ALA 37 2HB ALA 37 -8.429 -18.243 1.228 271 HB3 ALA 37 3HB ALA 37 -8.628 -16.490 1.233 272 H SER 38 H SER 38 -6.759 -16.006 0.317 273 HA SER 38 HA SER 38 -5.013 -17.722 -1.015 274 HB2 SER 38 2HB SER 38 -5.574 -14.772 -1.328 275 HB3 SER 38 1HB SER 38 -4.453 -15.637 -2.395 276 HG SER 38 HG SER 38 -6.092 -16.528 -3.369 277 H GLY 39 H GLY 39 -4.389 -15.200 1.317 278 HA2 GLY 39 2HA GLY 39 -2.477 -14.824 2.562 279 HA3 GLY 39 1HA GLY 39 -1.702 -16.152 1.697 280 H LEU 40 H LEU 40 -2.830 -12.810 1.145 281 HA LEU 40 HA LEU 40 -0.291 -12.293 -0.219 282 HB2 LEU 40 2HB LEU 40 -1.362 -11.103 -2.021 283 HB3 LEU 40 1HB LEU 40 -1.991 -12.735 -1.946 284 HG LEU 40 HG LEU 40 -3.946 -11.691 -0.617 285 HD11 LEU 40 1HD1 LEU 40 -3.993 -9.240 -1.932 286 HD12 LEU 40 2HD1 LEU 40 -2.383 -9.365 -1.225 287 HD13 LEU 40 3HD1 LEU 40 -3.810 -9.520 -0.200 288 HD21 LEU 40 3HD2 LEU 40 -3.454 -12.050 -3.400 289 HD22 LEU 40 1HD2 LEU 40 -4.485 -10.633 -3.175 290 HD23 LEU 40 2HD2 LEU 40 -4.972 -12.197 -2.514 291 HA PRO 41 HA PRO 41 -0.407 -8.779 2.515 292 HB2 PRO 41 2HB PRO 41 1.705 -7.418 1.515 293 HB3 PRO 41 1HB PRO 41 1.897 -8.891 2.475 294 HG2 PRO 41 2HG PRO 41 1.976 -8.545 -0.499 295 HG3 PRO 41 1HG PRO 41 3.041 -9.505 0.544 296 HD2 PRO 41 2HD PRO 41 1.004 -10.596 -0.883 297 HD3 PRO 41 1HD PRO 41 1.544 -11.250 0.677 298 H LEU 42 H LEU 42 -0.221 -6.253 2.213 299 HA LEU 42 HA LEU 42 -1.663 -5.549 -0.234 300 HB2 LEU 42 2HB LEU 42 -2.467 -3.699 1.673 301 HB3 LEU 42 1HB LEU 42 -3.401 -5.023 1.020 302 HG LEU 42 HG LEU 42 -1.637 -5.572 3.354 303 HD11 LEU 42 1HD1 LEU 42 -4.382 -4.740 3.990 304 HD12 LEU 42 2HD1 LEU 42 -3.285 -3.439 3.522 305 HD13 LEU 42 3HD1 LEU 42 -2.880 -4.489 4.880 306 HD21 LEU 42 3HD2 LEU 42 -3.794 -6.952 3.847 307 HD22 LEU 42 1HD2 LEU 42 -2.652 -7.507 2.623 308 HD23 LEU 42 2HD2 LEU 42 -4.129 -6.674 2.138 309 H MET 43 H MET 43 -1.464 -3.387 -0.975 310 HA MET 43 HA MET 43 1.070 -2.119 -0.142 311 HB2 MET 43 2HB MET 43 1.350 -2.946 -2.353 312 HB3 MET 43 1HB MET 43 -0.239 -2.346 -2.853 313 HG2 MET 43 2HG MET 43 1.743 -1.057 -3.705 314 HG3 MET 43 1HG MET 43 0.520 -0.106 -2.868 315 HE1 MET 43 3HE MET 43 3.203 -2.495 -1.463 316 HE2 MET 43 1HE MET 43 4.462 -1.407 -0.874 317 HE3 MET 43 2HE MET 43 4.211 -1.608 -2.608 318 H VAL 44 H VAL 44 0.013 -0.794 1.417 319 HA VAL 44 HA VAL 44 -2.198 0.850 0.850 320 HB VAL 44 HB VAL 44 -0.046 1.066 2.947 321 HG11 VAL 44 1HG1 VAL 44 -1.554 2.710 4.067 322 HG12 VAL 44 2HG1 VAL 44 -2.485 2.799 2.570 323 HG13 VAL 44 3HG1 VAL 44 -0.798 3.314 2.592 324 HG21 VAL 44 3HG2 VAL 44 -1.726 0.255 4.435 325 HG22 VAL 44 1HG2 VAL 44 -1.661 -0.817 3.036 326 HG23 VAL 44 2HG2 VAL 44 -2.967 0.368 3.179 327 H ILE 45 H ILE 45 -2.141 2.183 -0.855 328 HA ILE 45 HA ILE 45 0.149 4.012 -1.137 329 HB ILE 45 HB ILE 45 -1.996 3.245 -3.131 330 HG12 ILE 45 2HG1 ILE 45 0.848 2.468 -2.684 331 HG13 ILE 45 1HG1 ILE 45 -0.515 1.494 -3.247 332 HG21 ILE 45 1HG2 ILE 45 -1.322 4.861 -4.586 333 HG22 ILE 45 2HG2 ILE 45 0.324 4.903 -3.956 334 HG23 ILE 45 3HG2 ILE 45 -0.975 5.705 -3.077 335 HD11 ILE 45 3HD1 ILE 45 1.173 3.410 -4.831 336 HD12 ILE 45 1HD1 ILE 45 -0.345 2.741 -5.428 337 HD13 ILE 45 2HD1 ILE 45 1.001 1.669 -5.046 338 H ILE 46 H ILE 46 -0.173 5.959 -0.219 339 HA ILE 46 HA ILE 46 -2.908 7.058 -0.295 340 HB ILE 46 HB ILE 46 -0.954 7.678 1.904 341 HG12 ILE 46 2HG1 ILE 46 -3.123 5.814 2.560 342 HG13 ILE 46 1HG1 ILE 46 -1.924 5.134 1.463 343 HG21 ILE 46 1HG2 ILE 46 -3.941 7.717 2.012 344 HG22 ILE 46 2HG2 ILE 46 -3.031 9.084 1.385 345 HG23 ILE 46 3HG2 ILE 46 -2.792 8.548 3.050 346 HD11 ILE 46 3HD1 ILE 46 -1.628 4.882 4.021 347 HD12 ILE 46 1HD1 ILE 46 -1.060 6.551 3.945 348 HD13 ILE 46 2HD1 ILE 46 -0.232 5.292 3.024 349 H HIS 47 H HIS 47 -3.126 9.233 -0.781 350 HA HIS 47 HA HIS 47 -0.672 10.763 -1.233 351 HB2 HIS 47 2HB HIS 47 -1.508 11.412 -3.517 352 HB3 HIS 47 1HB HIS 47 -0.960 9.737 -3.363 353 HD1 HIS 47 1HD HIS 47 -3.467 11.460 -5.020 354 HD2 HIS 47 2HD HIS 47 -3.532 8.146 -2.516 355 HE1 HIS 47 1HE HIS 47 -5.614 10.264 -5.547 356 HE2 HIS 47 2HE HIS 47 -5.669 8.305 -3.965 357 H LYS 48 H LYS 48 -0.916 12.640 -0.267 358 HA LYS 48 HA LYS 48 -3.516 14.015 -0.528 359 HB2 LYS 48 2HB LYS 48 -2.074 13.305 1.906 360 HB3 LYS 48 1HB LYS 48 -2.478 15.010 1.826 361 HG2 LYS 48 2HG LYS 48 -4.842 14.316 1.334 362 HG3 LYS 48 1HG LYS 48 -4.352 12.664 1.717 363 HD2 LYS 48 2HD LYS 48 -4.960 13.211 3.812 364 HD3 LYS 48 1HD LYS 48 -3.389 14.013 3.871 365 HE2 LYS 48 2HE LYS 48 -4.685 16.035 2.870 366 HE3 LYS 48 1HE LYS 48 -6.110 15.194 3.481 367 HZ1 LYS 48 3HZ LYS 48 -4.972 15.145 5.685 368 HZ2 LYS 48 1HZ LYS 48 -5.394 16.694 5.150 369 HZ3 LYS 48 2HZ LYS 48 -3.789 16.171 5.047 370 H SER 49 H SER 49 -3.237 16.439 0.056 371 HA SER 49 HA SER 49 -2.293 18.468 -0.384 372 HB2 SER 49 2HB SER 49 -0.304 17.318 0.852 373 HB3 SER 49 1HB SER 49 0.402 17.186 -0.759 374 HG SER 49 HG SER 49 1.058 19.110 0.225 375 H TRP 50 H TRP 50 -0.110 19.060 -2.177 376 HA TRP 50 HA TRP 50 -1.344 19.336 -4.590 377 HB2 TRP 50 2HB TRP 50 0.912 19.525 -5.606 378 HB3 TRP 50 1HB TRP 50 0.774 20.429 -4.091 379 HD1 TRP 50 HD TRP 50 1.916 19.191 -1.882 380 HE1 TRP 50 1HE TRP 50 4.041 17.744 -1.759 381 HE3 TRP 50 3HE TRP 50 2.323 17.925 -6.819 382 HZ2 TRP 50 2HZ TRP 50 5.674 16.263 -3.521 383 HZ3 TRP 50 3HZ TRP 50 4.196 16.489 -7.517 384 HH2 TRP 50 HH TRP 50 5.837 15.677 -5.902 385 H CYS 51 H CYS 51 0.657 16.605 -3.568 386 HA CYS 51 HA CYS 51 0.804 14.460 -4.286 387 HB2 CYS 51 2HB CYS 51 -1.599 14.400 -3.973 388 HB3 CYS 51 1HB CYS 51 -1.857 15.114 -5.560 389 H GLY 52 H GLY 52 2.219 13.774 -5.715 390 HA2 GLY 52 2HA GLY 52 2.068 14.817 -8.480 391 HA3 GLY 52 1HA GLY 52 3.575 14.360 -7.679 392 H ALA 53 H ALA 53 2.531 11.999 -6.441 393 HA ALA 53 HA ALA 53 3.109 10.061 -8.335 394 HB1 ALA 53 1HB ALA 53 3.171 9.611 -5.945 395 HB2 ALA 53 2HB ALA 53 2.120 8.454 -6.763 396 HB3 ALA 53 3HB ALA 53 1.419 9.793 -5.856 397 H CYS 54 H CYS 54 0.118 11.645 -7.598 398 HA CYS 54 HA CYS 54 -1.393 9.811 -9.200 399 HB2 CYS 54 2HB CYS 54 -3.275 11.459 -8.817 400 HB3 CYS 54 1HB CYS 54 -2.570 10.777 -7.344 401 H LYS 55 H LYS 55 0.238 12.841 -9.578 402 HA LYS 55 HA LYS 55 -1.012 13.627 -12.007 403 HB2 LYS 55 2HB LYS 55 1.289 14.512 -10.386 404 HB3 LYS 55 1HB LYS 55 1.421 14.841 -12.109 405 HG2 LYS 55 2HG LYS 55 -0.556 16.147 -12.105 406 HG3 LYS 55 1HG LYS 55 -0.974 15.620 -10.465 407 HD2 LYS 55 2HD LYS 55 1.457 16.674 -10.006 408 HD3 LYS 55 1HD LYS 55 0.957 17.668 -11.375 409 HE2 LYS 55 2HE LYS 55 -1.170 17.348 -9.430 410 HE3 LYS 55 1HE LYS 55 0.280 18.047 -8.712 411 HZ1 LYS 55 3HZ LYS 55 -0.793 19.898 -9.485 412 HZ2 LYS 55 1HZ LYS 55 -1.438 19.116 -10.840 413 HZ3 LYS 55 2HZ LYS 55 0.196 19.550 -10.813 414 H ALA 56 H ALA 56 2.036 11.933 -11.241 415 HA ALA 56 HA ALA 56 2.719 11.560 -14.003 416 HB1 ALA 56 1HB ALA 56 4.231 11.519 -11.860 417 HB2 ALA 56 2HB ALA 56 4.621 10.505 -13.250 418 HB3 ALA 56 3HB ALA 56 3.811 9.806 -11.849 419 H LEU 57 H LEU 57 1.021 9.717 -11.563 420 HA LEU 57 HA LEU 57 0.926 7.215 -12.769 421 HB2 LEU 57 2HB LEU 57 -0.669 8.684 -10.770 422 HB3 LEU 57 1HB LEU 57 -1.507 7.369 -11.567 423 HG LEU 57 HG LEU 57 -0.172 5.751 -10.620 424 HD11 LEU 57 1HD1 LEU 57 1.927 7.801 -10.760 425 HD12 LEU 57 2HD1 LEU 57 2.015 6.060 -11.029 426 HD13 LEU 57 3HD1 LEU 57 2.037 6.701 -9.387 427 HD21 LEU 57 3HD2 LEU 57 0.406 6.823 -8.206 428 HD22 LEU 57 1HD2 LEU 57 -1.200 6.288 -8.700 429 HD23 LEU 57 2HD2 LEU 57 -0.761 7.992 -8.819 430 H LYS 58 H LYS 58 -0.943 10.110 -13.432 431 HA LYS 58 HA LYS 58 -3.094 9.125 -14.772 432 HB2 LYS 58 2HB LYS 58 -1.459 11.575 -15.396 433 HB3 LYS 58 1HB LYS 58 -3.006 11.232 -16.155 434 HG2 LYS 58 2HG LYS 58 -2.999 11.105 -13.224 435 HG3 LYS 58 1HG LYS 58 -2.660 12.697 -13.906 436 HD2 LYS 58 2HD LYS 58 -5.054 10.967 -14.529 437 HD3 LYS 58 1HD LYS 58 -5.046 12.401 -13.500 438 HE2 LYS 58 2HE LYS 58 -3.882 13.118 -15.984 439 HE3 LYS 58 1HE LYS 58 -5.367 12.230 -16.326 440 HZ1 LYS 58 3HZ LYS 58 -5.339 14.398 -14.327 441 HZ2 LYS 58 1HZ LYS 58 -6.648 13.776 -15.201 442 HZ3 LYS 58 2HZ LYS 58 -5.499 14.749 -15.973 443 HA PRO 59 HA PRO 59 -1.034 8.643 -19.021 444 HB2 PRO 59 2HB PRO 59 1.414 9.561 -19.563 445 HB3 PRO 59 1HB PRO 59 0.010 10.649 -19.502 446 HG2 PRO 59 2HG PRO 59 2.079 10.110 -17.392 447 HG3 PRO 59 1HG PRO 59 1.454 11.667 -17.967 448 HD2 PRO 59 2HD PRO 59 0.545 10.466 -15.704 449 HD3 PRO 59 1HD PRO 59 -0.475 11.498 -16.737 450 H LYS 60 H LYS 60 1.066 8.007 -16.291 451 HA LYS 60 HA LYS 60 2.376 5.848 -17.778 452 HB2 LYS 60 2HB LYS 60 4.029 5.781 -16.106 453 HB3 LYS 60 1HB LYS 60 3.695 7.490 -16.356 454 HG2 LYS 60 2HG LYS 60 2.024 7.146 -14.397 455 HG3 LYS 60 1HG LYS 60 3.029 5.749 -14.032 456 HD2 LYS 60 2HD LYS 60 3.948 8.619 -14.264 457 HD3 LYS 60 1HD LYS 60 3.808 7.680 -12.779 458 HE2 LYS 60 2HE LYS 60 5.723 6.526 -13.170 459 HE3 LYS 60 1HE LYS 60 5.482 6.511 -14.915 460 HZ1 LYS 60 3HZ LYS 60 7.153 8.173 -13.430 461 HZ2 LYS 60 1HZ LYS 60 5.938 9.155 -14.081 462 HZ3 LYS 60 2HZ LYS 60 6.886 8.194 -15.100 463 H PHE 61 H PHE 61 0.604 6.308 -14.702 464 HA PHE 61 HA PHE 61 0.473 3.558 -14.121 465 HB2 PHE 61 2HB PHE 61 0.060 5.396 -12.465 466 HB3 PHE 61 1HB PHE 61 -1.501 5.662 -13.241 467 HD1 PHE 61 1HD PHE 61 -3.049 3.592 -13.432 468 HD2 PHE 61 2HD PHE 61 0.210 3.891 -10.716 469 HE1 PHE 61 1HE PHE 61 -4.056 1.834 -12.036 470 HE2 PHE 61 2HE PHE 61 -0.790 2.139 -9.316 471 HZ PHE 61 HZ PHE 61 -2.924 1.102 -9.974 472 H ALA 62 H ALA 62 -1.224 5.612 -16.319 473 HA ALA 62 HA ALA 62 -3.568 4.104 -16.680 474 HB1 ALA 62 1HB ALA 62 -3.046 5.053 -19.180 475 HB2 ALA 62 2HB ALA 62 -2.081 6.147 -18.186 476 HB3 ALA 62 3HB ALA 62 -3.814 5.990 -17.898 477 H GLU 63 H GLU 63 -0.297 3.513 -17.304 478 HA GLU 63 HA GLU 63 -0.539 1.541 -19.374 479 HB2 GLU 63 2HB GLU 63 1.481 3.050 -18.840 480 HB3 GLU 63 1HB GLU 63 1.795 1.941 -17.502 481 HG2 GLU 63 2HG GLU 63 2.867 0.579 -18.873 482 HG3 GLU 63 1HG GLU 63 1.409 0.386 -19.844 483 H SER 64 H SER 64 -1.059 1.632 -16.051 484 HA SER 64 HA SER 64 -0.236 -0.874 -15.185 485 HB2 SER 64 2HB SER 64 -2.519 0.879 -14.326 486 HB3 SER 64 1HB SER 64 -2.042 -0.568 -13.458 487 HG SER 64 HG SER 64 -0.320 1.617 -14.007 488 H THR 65 H THR 65 -2.240 -0.412 -17.738 489 HA THR 65 HA THR 65 -4.486 -1.950 -17.386 490 HB THR 65 HB THR 65 -2.902 -2.439 -19.862 491 HG1 THR 65 1HG THR 65 -3.946 0.103 -19.164 492 HG21 THR 65 3HG2 THR 65 -4.985 -1.955 -20.979 493 HG22 THR 65 1HG2 THR 65 -5.724 -1.494 -19.446 494 HG23 THR 65 2HG2 THR 65 -5.231 -3.165 -19.721 495 H GLU 66 H GLU 66 -1.151 -2.924 -17.813 496 HA GLU 66 HA GLU 66 -1.764 -5.744 -17.812 497 HB2 GLU 66 2HB GLU 66 0.343 -4.375 -18.793 498 HB3 GLU 66 1HB GLU 66 0.992 -4.808 -17.207 499 HG2 GLU 66 2HG GLU 66 -0.171 -7.142 -18.210 500 HG3 GLU 66 1HG GLU 66 0.689 -6.418 -19.568 501 H ILE 67 H ILE 67 -0.863 -3.237 -15.557 502 HA ILE 67 HA ILE 67 -0.248 -5.016 -13.397 503 HB ILE 67 HB ILE 67 -1.131 -2.126 -13.283 504 HG12 ILE 67 2HG1 ILE 67 1.650 -3.321 -13.320 505 HG13 ILE 67 1HG1 ILE 67 0.894 -2.420 -14.641 506 HG21 ILE 67 1HG2 ILE 67 0.106 -2.176 -11.090 507 HG22 ILE 67 2HG2 ILE 67 0.128 -3.934 -11.237 508 HG23 ILE 67 3HG2 ILE 67 -1.409 -3.078 -11.132 509 HD11 ILE 67 3HD1 ILE 67 2.140 -1.462 -12.155 510 HD12 ILE 67 1HD1 ILE 67 0.670 -0.625 -12.654 511 HD13 ILE 67 2HD1 ILE 67 2.048 -0.713 -13.750 512 H SER 68 H SER 68 -3.108 -4.097 -14.961 513 HA SER 68 HA SER 68 -4.915 -4.219 -12.766 514 HB2 SER 68 2HB SER 68 -5.085 -3.596 -15.493 515 HB3 SER 68 1HB SER 68 -6.103 -5.021 -15.290 516 HG SER 68 HG SER 68 -7.289 -3.132 -14.901 517 H GLU 69 H GLU 69 -3.304 -6.570 -14.720 518 HA GLU 69 HA GLU 69 -5.048 -8.697 -13.747 519 HB2 GLU 69 2HB GLU 69 -3.416 -10.103 -15.259 520 HB3 GLU 69 1HB GLU 69 -4.734 -9.180 -15.967 521 HG2 GLU 69 2HG GLU 69 -3.123 -7.338 -16.394 522 HG3 GLU 69 1HG GLU 69 -1.832 -8.408 -15.843 523 H LEU 70 H LEU 70 -1.701 -7.607 -13.671 524 HA LEU 70 HA LEU 70 -0.554 -9.725 -12.259 525 HB2 LEU 70 2HB LEU 70 0.045 -6.846 -12.624 526 HB3 LEU 70 1HB LEU 70 0.806 -7.628 -11.240 527 HG LEU 70 HG LEU 70 1.082 -9.115 -13.760 528 HD11 LEU 70 1HD1 LEU 70 1.992 -6.295 -13.484 529 HD12 LEU 70 2HD1 LEU 70 1.369 -7.143 -14.900 530 HD13 LEU 70 3HD1 LEU 70 3.013 -7.454 -14.336 531 HD21 LEU 70 3HD2 LEU 70 2.578 -8.532 -11.301 532 HD22 LEU 70 1HD2 LEU 70 3.570 -8.661 -12.755 533 HD23 LEU 70 2HD2 LEU 70 2.524 -9.999 -12.277 534 H SER 71 H SER 71 -2.498 -7.030 -11.193 535 HA SER 71 HA SER 71 -2.104 -6.867 -8.517 536 HB2 SER 71 2HB SER 71 -4.184 -6.168 -10.308 537 HB3 SER 71 1HB SER 71 -4.922 -6.934 -8.901 538 HG SER 71 HG SER 71 -2.991 -4.873 -8.704 539 H HIS 72 H HIS 72 -3.354 -9.637 -10.155 540 HA HIS 72 HA HIS 72 -4.846 -10.830 -8.113 541 HB2 HIS 72 2HB HIS 72 -3.439 -11.777 -10.553 542 HB3 HIS 72 1HB HIS 72 -3.798 -12.999 -9.323 543 HD1 HIS 72 1HD HIS 72 -6.459 -12.961 -8.554 544 HD2 HIS 72 2HD HIS 72 -5.491 -11.346 -12.258 545 HE1 HIS 72 1HE HIS 72 -8.615 -12.906 -9.847 546 HE2 HIS 72 2HE HIS 72 -8.024 -11.832 -12.047 547 H ASN 73 H ASN 73 -1.578 -10.072 -8.281 548 HA ASN 73 HA ASN 73 -0.476 -12.196 -6.742 549 HB2 ASN 73 2HB ASN 73 1.432 -10.544 -6.472 550 HB3 ASN 73 1HB ASN 73 1.008 -10.961 -8.132 551 HD21 ASN 73 1HD2 ASN 73 1.506 -9.176 -9.252 552 HD22 ASN 73 2HD2 ASN 73 0.882 -7.588 -8.903 553 H PHE 74 H PHE 74 -2.184 -9.301 -5.954 554 HA PHE 74 HA PHE 74 -2.632 -9.958 -3.329 555 HB2 PHE 74 2HB PHE 74 -1.236 -8.077 -2.282 556 HB3 PHE 74 1HB PHE 74 -0.418 -9.567 -2.757 557 HD1 PHE 74 2HD PHE 74 -1.378 -6.386 -4.428 558 HD2 PHE 74 1HD PHE 74 1.646 -9.261 -3.638 559 HE1 PHE 74 2HE PHE 74 0.201 -5.095 -5.809 560 HE2 PHE 74 1HE PHE 74 3.235 -7.979 -5.011 561 HZ PHE 74 HZ PHE 74 2.509 -5.896 -6.097 562 H VAL 75 H VAL 75 -2.986 -7.481 -2.110 563 HA VAL 75 HA VAL 75 -4.515 -5.889 -4.034 564 HB VAL 75 HB VAL 75 -6.137 -7.447 -3.094 565 HG11 VAL 75 1HG1 VAL 75 -6.352 -7.964 -0.904 566 HG12 VAL 75 2HG1 VAL 75 -5.941 -6.336 -0.365 567 HG13 VAL 75 3HG1 VAL 75 -4.665 -7.451 -0.852 568 HG21 VAL 75 3HG2 VAL 75 -6.672 -4.830 -1.736 569 HG22 VAL 75 1HG2 VAL 75 -7.795 -5.898 -2.575 570 HG23 VAL 75 2HG2 VAL 75 -6.629 -4.947 -3.494 571 H MET 76 H MET 76 -4.658 -3.662 -3.490 572 HA MET 76 HA MET 76 -3.227 -2.956 -1.028 573 HB2 MET 76 2HB MET 76 -2.963 -0.805 -2.783 574 HB3 MET 76 1HB MET 76 -1.736 -1.961 -2.306 575 HG2 MET 76 2HG MET 76 -3.592 -2.570 -4.558 576 HG3 MET 76 1HG MET 76 -2.164 -1.586 -4.810 577 HE1 MET 76 3HE MET 76 -3.107 -3.922 -6.209 578 HE2 MET 76 1HE MET 76 -2.725 -5.538 -5.613 579 HE3 MET 76 2HE MET 76 -1.555 -4.660 -6.598 580 H VAL 77 H VAL 77 -3.583 -0.342 -0.808 581 HA VAL 77 HA VAL 77 -6.455 0.198 -0.976 582 HB VAL 77 HB VAL 77 -4.904 -0.370 1.468 583 HG11 VAL 77 1HG1 VAL 77 -6.826 1.046 2.662 584 HG12 VAL 77 2HG1 VAL 77 -6.561 2.061 1.245 585 HG13 VAL 77 3HG1 VAL 77 -5.215 1.681 2.327 586 HG21 VAL 77 3HG2 VAL 77 -6.880 -1.415 2.163 587 HG22 VAL 77 1HG2 VAL 77 -6.752 -1.748 0.434 588 HG23 VAL 77 2HG2 VAL 77 -7.864 -0.504 1.016 589 H ASN 78 H ASN 78 -6.936 2.269 -1.345 590 HA ASN 78 HA ASN 78 -4.781 4.246 -1.258 591 HB2 ASN 78 2HB ASN 78 -6.167 3.640 -3.395 592 HB3 ASN 78 1HB ASN 78 -7.369 4.697 -2.676 593 HD21 ASN 78 1HD2 ASN 78 -3.836 4.885 -2.745 594 HD22 ASN 78 2HD2 ASN 78 -3.763 6.437 -3.520 595 H LEU 79 H LEU 79 -4.824 5.574 0.423 596 HA LEU 79 HA LEU 79 -7.450 6.330 1.526 597 HB2 LEU 79 2HB LEU 79 -4.814 6.632 2.950 598 HB3 LEU 79 1HB LEU 79 -6.422 6.735 3.630 599 HG LEU 79 HG LEU 79 -5.234 4.204 2.501 600 HD11 LEU 79 1HD1 LEU 79 -4.827 3.510 4.761 601 HD12 LEU 79 2HD1 LEU 79 -5.519 5.004 5.392 602 HD13 LEU 79 3HD1 LEU 79 -4.006 5.045 4.486 603 HD21 LEU 79 3HD2 LEU 79 -7.759 4.845 4.002 604 HD22 LEU 79 1HD2 LEU 79 -7.099 3.211 3.902 605 HD23 LEU 79 2HD2 LEU 79 -7.586 4.056 2.434 606 H GLU 80 H GLU 80 -7.772 8.545 2.152 607 HA GLU 80 HA GLU 80 -5.873 10.514 1.176 608 HB2 GLU 80 2HB GLU 80 -7.833 9.659 -0.554 609 HB3 GLU 80 1HB GLU 80 -8.576 11.083 0.184 610 HG2 GLU 80 2HG GLU 80 -6.316 12.230 -0.367 611 HG3 GLU 80 1HG GLU 80 -6.112 10.880 -1.497 612 H ASP 81 H ASP 81 -7.381 12.770 1.266 613 HA ASP 81 HA ASP 81 -7.483 13.428 3.943 614 HB2 ASP 81 2HB ASP 81 -7.491 15.007 1.966 615 HB3 ASP 81 1HB ASP 81 -9.221 14.710 1.831 616 H GLU 82 H GLU 82 -9.964 11.994 1.933 617 HA GLU 82 HA GLU 82 -12.149 12.413 3.682 618 HB2 GLU 82 2HB GLU 82 -11.634 10.448 1.460 619 HB3 GLU 82 1HB GLU 82 -13.124 10.416 2.394 620 HG2 GLU 82 2HG GLU 82 -13.370 12.874 1.758 621 HG3 GLU 82 1HG GLU 82 -12.111 12.560 0.564 622 H GLU 83 H GLU 83 -10.118 9.538 3.118 623 HA GLU 83 HA GLU 83 -11.252 8.082 5.293 624 HB2 GLU 83 2HB GLU 83 -8.742 7.658 3.668 625 HB3 GLU 83 1HB GLU 83 -9.303 6.536 4.899 626 HG2 GLU 83 2HG GLU 83 -11.507 6.534 3.540 627 HG3 GLU 83 1HG GLU 83 -10.497 7.179 2.239 628 H GLU 84 H GLU 84 -10.935 8.552 7.359 629 HA GLU 84 HA GLU 84 -8.377 9.765 8.156 630 HB2 GLU 84 2HB GLU 84 -10.818 10.768 8.611 631 HB3 GLU 84 1HB GLU 84 -10.689 9.731 10.025 632 HG2 GLU 84 2HG GLU 84 -8.479 10.858 10.492 633 HG3 GLU 84 1HG GLU 84 -8.915 12.022 9.242 634 HA PRO 85 HA PRO 85 -8.162 5.502 9.904 635 HB2 PRO 85 2HB PRO 85 -5.509 5.171 9.492 636 HB3 PRO 85 1HB PRO 85 -6.716 4.877 8.223 637 HG2 PRO 85 2HG PRO 85 -4.981 7.281 8.673 638 HG3 PRO 85 1HG PRO 85 -5.363 6.439 7.152 639 HD2 PRO 85 2HD PRO 85 -6.599 8.735 7.924 640 HD3 PRO 85 1HD PRO 85 -7.403 7.485 6.941 641 H LYS 86 H LYS 86 -6.213 8.374 10.427 642 HA LYS 86 HA LYS 86 -5.201 9.246 12.265 643 HB2 LYS 86 2HB LYS 86 -7.680 8.152 13.110 644 HB3 LYS 86 1HB LYS 86 -6.494 7.782 14.367 645 HG2 LYS 86 2HG LYS 86 -6.908 9.821 15.146 646 HG3 LYS 86 1HG LYS 86 -5.971 10.417 13.774 647 HD2 LYS 86 2HD LYS 86 -8.185 10.326 12.478 648 HD3 LYS 86 1HD LYS 86 -8.953 10.189 14.061 649 HE2 LYS 86 2HE LYS 86 -6.959 12.355 13.653 650 HE3 LYS 86 1HE LYS 86 -8.543 12.534 12.898 651 HZ1 LYS 86 3HZ LYS 86 -8.263 13.479 15.213 652 HZ2 LYS 86 1HZ LYS 86 -8.243 11.879 15.768 653 HZ3 LYS 86 2HZ LYS 86 -9.607 12.480 14.966 654 H ASP 87 H ASP 87 -3.313 7.977 11.511 655 HA ASP 87 HA ASP 87 -2.021 6.718 13.661 656 HB2 ASP 87 2HB ASP 87 -3.740 4.966 12.386 657 HB3 ASP 87 1HB ASP 87 -2.177 4.616 11.632 658 H GLU 88 H GLU 88 0.160 6.072 13.155 659 HA GLU 88 HA GLU 88 1.409 7.761 11.286 660 HB2 GLU 88 2HB GLU 88 2.217 5.837 13.291 661 HB3 GLU 88 1HB GLU 88 3.238 5.733 11.864 662 HG2 GLU 88 2HG GLU 88 4.285 7.269 13.276 663 HG3 GLU 88 1HG GLU 88 3.499 8.241 12.035 664 H ASP 89 H ASP 89 -0.110 4.753 10.843 665 HA ASP 89 HA ASP 89 1.340 3.403 8.975 666 HB2 ASP 89 2HB ASP 89 -1.613 3.808 9.302 667 HB3 ASP 89 1HB ASP 89 -0.995 2.875 7.931 668 H PHE 90 H PHE 90 -0.294 6.467 8.501 669 HA PHE 90 HA PHE 90 0.007 6.307 5.619 670 HB2 PHE 90 2HB PHE 90 -0.931 8.653 5.664 671 HB3 PHE 90 1HB PHE 90 -1.987 7.392 6.309 672 HD1 PHE 90 2HD PHE 90 0.736 9.575 7.682 673 HD2 PHE 90 1HD PHE 90 -3.225 8.072 8.093 674 HE1 PHE 90 2HE PHE 90 0.467 10.867 9.755 675 HE2 PHE 90 1HE PHE 90 -3.504 9.371 10.163 676 HZ PHE 90 HZ PHE 90 -1.656 10.768 10.998 677 H SER 91 H SER 91 1.872 7.368 8.268 678 HA SER 91 HA SER 91 3.975 8.224 6.526 679 HB2 SER 91 2HB SER 91 2.808 10.286 8.410 680 HB3 SER 91 1HB SER 91 4.197 10.504 7.334 681 HG SER 91 HG SER 91 1.769 11.077 6.750 682 HA PRO 92 HA PRO 92 5.505 6.703 10.579 683 HB2 PRO 92 2HB PRO 92 6.419 4.311 9.861 684 HB3 PRO 92 1HB PRO 92 4.680 4.580 10.094 685 HG2 PRO 92 2HG PRO 92 6.240 4.330 7.567 686 HG3 PRO 92 1HG PRO 92 4.585 3.809 7.924 687 HD2 PRO 92 2HD PRO 92 5.368 6.186 6.603 688 HD3 PRO 92 1HD PRO 92 3.741 5.776 7.178 689 H ASP 93 H ASP 93 6.766 8.117 8.055 690 HA ASP 93 HA ASP 93 9.545 7.295 8.554 691 HB2 ASP 93 2HB ASP 93 9.861 8.775 6.373 692 HB3 ASP 93 1HB ASP 93 9.360 7.081 6.275 693 H GLY 94 H GLY 94 8.666 10.365 7.088 694 HA2 GLY 94 2HA GLY 94 9.978 11.705 9.357 695 HA3 GLY 94 1HA GLY 94 9.892 12.337 7.709 696 H GLY 95 H GLY 95 7.790 13.066 6.926 697 HA2 GLY 95 2HA GLY 95 5.589 13.341 8.709 698 HA3 GLY 95 1HA GLY 95 6.539 14.828 8.659 699 H TYR 96 H TYR 96 6.265 12.824 5.790 700 HA TYR 96 HA TYR 96 5.176 15.002 4.324 701 HB2 TYR 96 2HB TYR 96 4.966 13.385 2.445 702 HB3 TYR 96 1HB TYR 96 6.578 13.407 3.164 703 HD1 TYR 96 1HD TYR 96 4.027 11.637 5.049 704 HD2 TYR 96 2HD TYR 96 6.927 11.238 1.963 705 HE1 TYR 96 1HE TYR 96 3.922 9.212 5.266 706 HE2 TYR 96 2HE TYR 96 6.824 8.789 2.190 707 HH TYR 96 HH TYR 96 5.240 7.262 4.822 708 H ILE 97 H ILE 97 3.117 14.338 2.814 709 HA ILE 97 HA ILE 97 1.113 12.956 4.329 710 HB ILE 97 HB ILE 97 -0.454 14.795 4.585 711 HG12 ILE 97 2HG1 ILE 97 -0.131 16.444 3.032 712 HG13 ILE 97 1HG1 ILE 97 0.712 17.142 4.409 713 HG21 ILE 97 1HG2 ILE 97 0.592 15.923 6.415 714 HG22 ILE 97 2HG2 ILE 97 2.196 15.527 5.800 715 HG23 ILE 97 3HG2 ILE 97 1.136 14.246 6.389 716 HD11 ILE 97 3HD1 ILE 97 2.844 16.333 3.486 717 HD12 ILE 97 1HD1 ILE 97 2.011 17.467 2.424 718 HD13 ILE 97 2HD1 ILE 97 1.971 15.740 2.073 719 HA PRO 98 HA PRO 98 0.728 10.978 3.533 720 HB2 PRO 98 2HB PRO 98 -1.707 10.324 1.828 721 HB3 PRO 98 1HB PRO 98 -1.166 9.510 3.323 722 HG2 PRO 98 2HG PRO 98 -2.661 11.932 3.056 723 HG3 PRO 98 1HG PRO 98 -2.114 11.115 4.550 724 HD2 PRO 98 2HD PRO 98 -1.031 13.385 4.005 725 HD3 PRO 98 1HD PRO 98 0.055 12.038 4.392 726 H ARG 99 H ARG 99 1.549 8.922 2.752 727 HA ARG 99 HA ARG 99 2.099 8.873 -0.140 728 HB2 ARG 99 2HB ARG 99 3.910 8.924 2.149 729 HB3 ARG 99 1HB ARG 99 4.290 7.667 0.970 730 HG2 ARG 99 2HG ARG 99 5.512 9.699 0.520 731 HG3 ARG 99 1HG ARG 99 4.386 9.353 -0.788 732 HD2 ARG 99 2HD ARG 99 3.218 11.022 1.284 733 HD3 ARG 99 1HD ARG 99 4.660 11.747 0.579 734 HE ARG 99 HE ARG 99 2.827 10.743 -1.383 735 HH11 ARG 99 1HH1 ARG 99 3.593 13.463 0.663 736 HH12 ARG 99 2HH1 ARG 99 2.787 14.612 -0.350 737 HH21 ARG 99 1HH2 ARG 99 1.766 12.253 -2.717 738 HH22 ARG 99 2HH2 ARG 99 1.749 13.925 -2.270 739 H ILE 100 H ILE 100 3.498 6.534 -0.322 740 HA ILE 100 HA ILE 100 1.408 4.576 0.305 741 HB ILE 100 HB ILE 100 2.114 3.265 -1.467 742 HG12 ILE 100 2HG1 ILE 100 4.581 4.468 -2.351 743 HG13 ILE 100 1HG1 ILE 100 4.729 3.986 -0.670 744 HG21 ILE 100 1HG2 ILE 100 1.194 5.435 -2.201 745 HG22 ILE 100 2HG2 ILE 100 2.275 4.701 -3.386 746 HG23 ILE 100 3HG2 ILE 100 2.841 6.038 -2.385 747 HD11 ILE 100 3HD1 ILE 100 4.328 1.742 -1.160 748 HD12 ILE 100 1HD1 ILE 100 5.393 2.300 -2.449 749 HD13 ILE 100 2HD1 ILE 100 3.665 2.116 -2.750 750 H LEU 101 H LEU 101 2.308 2.243 0.617 751 HA LEU 101 HA LEU 101 4.783 1.770 1.776 752 HB2 LEU 101 2HB LEU 101 3.705 1.469 4.196 753 HB3 LEU 101 1HB LEU 101 4.550 2.914 3.694 754 HG LEU 101 HG LEU 101 1.861 3.282 2.933 755 HD11 LEU 101 1HD1 LEU 101 0.611 2.906 4.886 756 HD12 LEU 101 2HD1 LEU 101 2.053 2.474 5.808 757 HD13 LEU 101 3HD1 LEU 101 1.462 1.402 4.539 758 HD21 LEU 101 3HD2 LEU 101 2.092 5.245 4.061 759 HD22 LEU 101 1HD2 LEU 101 3.795 4.802 3.924 760 HD23 LEU 101 2HD2 LEU 101 2.923 4.490 5.425 761 H PHE 102 H PHE 102 5.120 -0.348 2.339 762 HA PHE 102 HA PHE 102 2.976 -2.177 1.597 763 HB2 PHE 102 2HB PHE 102 5.811 -2.196 1.373 764 HB3 PHE 102 1HB PHE 102 5.363 -3.544 2.409 765 HD1 PHE 102 1HD PHE 102 2.805 -4.372 1.247 766 HD2 PHE 102 2HD PHE 102 6.407 -3.141 -0.650 767 HE1 PHE 102 1HE PHE 102 2.205 -5.693 -0.739 768 HE2 PHE 102 2HE PHE 102 5.816 -4.462 -2.639 769 HZ PHE 102 HZ PHE 102 3.712 -5.739 -2.686 770 H LEU 103 H LEU 103 2.151 -3.781 2.977 771 HA LEU 103 HA LEU 103 3.058 -3.795 5.744 772 HB2 LEU 103 2HB LEU 103 1.023 -3.195 6.707 773 HB3 LEU 103 1HB LEU 103 1.258 -2.033 5.421 774 HG LEU 103 HG LEU 103 -0.660 -4.345 5.490 775 HD11 LEU 103 1HD1 LEU 103 -0.932 -1.363 5.288 776 HD12 LEU 103 2HD1 LEU 103 -1.550 -2.434 6.545 777 HD13 LEU 103 3HD1 LEU 103 -2.247 -2.479 4.926 778 HD21 LEU 103 3HD2 LEU 103 0.012 -4.521 3.296 779 HD22 LEU 103 1HD2 LEU 103 0.425 -2.812 3.175 780 HD23 LEU 103 2HD2 LEU 103 -1.264 -3.314 3.163 781 H ASP 104 H ASP 104 2.063 -5.513 7.036 782 HA ASP 104 HA ASP 104 2.117 -7.976 5.664 783 HB2 ASP 104 2HB ASP 104 1.681 -7.088 8.458 784 HB3 ASP 104 1HB ASP 104 1.046 -8.684 8.033 785 HA PRO 105 HA PRO 105 -1.967 -8.614 4.135 786 HB2 PRO 105 2HB PRO 105 -1.745 -11.345 5.294 787 HB3 PRO 105 1HB PRO 105 -2.112 -10.847 3.631 788 HG2 PRO 105 2HG PRO 105 0.284 -11.849 4.320 789 HG3 PRO 105 1HG PRO 105 0.110 -10.589 3.079 790 HD2 PRO 105 2HD PRO 105 1.105 -10.381 5.873 791 HD3 PRO 105 1HD PRO 105 1.555 -9.440 4.439 792 H SER 106 H SER 106 -3.010 -7.243 5.661 793 HA SER 106 HA SER 106 -5.142 -8.185 7.014 794 HB2 SER 106 2HB SER 106 -2.688 -8.541 8.640 795 HB3 SER 106 1HB SER 106 -4.071 -7.818 9.479 796 HG SER 106 HG SER 106 -5.168 -9.642 9.273 797 H GLY 107 H GLY 107 -2.525 -5.899 6.985 798 HA2 GLY 107 2HA GLY 107 -3.173 -3.562 6.578 799 HA3 GLY 107 1HA GLY 107 -4.429 -3.791 7.801 800 H LYS 108 H LYS 108 -1.113 -4.976 8.030 801 HA LYS 108 HA LYS 108 -0.749 -3.170 10.336 802 HB2 LYS 108 2HB LYS 108 -0.533 -5.949 10.181 803 HB3 LYS 108 1HB LYS 108 1.129 -5.380 10.229 804 HG2 LYS 108 2HG LYS 108 -0.057 -3.879 12.189 805 HG3 LYS 108 1HG LYS 108 -0.901 -5.433 12.321 806 HD2 LYS 108 2HD LYS 108 1.538 -6.399 12.160 807 HD3 LYS 108 1HD LYS 108 1.988 -4.788 12.720 808 HE2 LYS 108 2HE LYS 108 1.679 -5.672 14.765 809 HE3 LYS 108 1HE LYS 108 -0.028 -5.375 14.429 810 HZ1 LYS 108 3HZ LYS 108 1.386 -7.930 13.880 811 HZ2 LYS 108 1HZ LYS 108 -0.269 -7.633 13.682 812 HZ3 LYS 108 2HZ LYS 108 0.409 -7.638 15.231 813 H VAL 109 H VAL 109 0.025 -1.465 8.954 814 HA VAL 109 HA VAL 109 2.023 -1.510 7.106 815 HB VAL 109 HB VAL 109 1.227 0.532 9.147 816 HG11 VAL 109 1HG1 VAL 109 2.706 2.137 7.918 817 HG12 VAL 109 2HG1 VAL 109 3.494 0.734 7.194 818 HG13 VAL 109 3HG1 VAL 109 3.535 0.966 8.941 819 HG21 VAL 109 3HG2 VAL 109 0.548 1.764 7.095 820 HG22 VAL 109 1HG2 VAL 109 -0.290 0.227 7.313 821 HG23 VAL 109 2HG2 VAL 109 1.027 0.357 6.146 822 H HIS 110 H HIS 110 3.963 -2.280 7.118 823 HA HIS 110 HA HIS 110 5.589 -2.030 9.558 824 HB2 HIS 110 2HB HIS 110 4.741 -4.414 8.775 825 HB3 HIS 110 1HB HIS 110 6.068 -4.267 7.628 826 HD1 HIS 110 1HD HIS 110 8.474 -3.671 8.870 827 HD2 HIS 110 2HD HIS 110 5.495 -5.457 11.151 828 HE1 HIS 110 1HE HIS 110 9.651 -4.646 10.866 829 HE2 HIS 110 2HE HIS 110 7.819 -5.662 12.268 830 HA PRO 111 HA PRO 111 8.213 0.225 6.768 831 HB2 PRO 111 2HB PRO 111 10.453 0.311 8.313 832 HB3 PRO 111 1HB PRO 111 9.040 1.333 8.600 833 HG2 PRO 111 2HG PRO 111 9.850 -1.205 9.958 834 HG3 PRO 111 1HG PRO 111 9.190 0.280 10.664 835 HD2 PRO 111 2HD PRO 111 7.682 -1.927 10.214 836 HD3 PRO 111 1HD PRO 111 7.023 -0.276 10.120 837 H GLU 112 H GLU 112 7.960 -2.620 6.332 838 HA GLU 112 HA GLU 112 10.623 -3.703 6.084 839 HB2 GLU 112 2HB GLU 112 7.966 -4.725 6.022 840 HB3 GLU 112 1HB GLU 112 8.735 -5.157 4.501 841 HG2 GLU 112 2HG GLU 112 9.023 -6.906 6.150 842 HG3 GLU 112 1HG GLU 112 10.575 -6.192 5.714 843 H ILE 113 H ILE 113 8.154 -3.549 3.541 844 HA ILE 113 HA ILE 113 10.243 -2.806 1.631 845 HB ILE 113 HB ILE 113 7.393 -3.537 0.975 846 HG12 ILE 113 2HG1 ILE 113 8.430 -5.358 2.287 847 HG13 ILE 113 1HG1 ILE 113 8.146 -5.831 0.606 848 HG21 ILE 113 1HG2 ILE 113 8.447 -2.512 -0.867 849 HG22 ILE 113 2HG2 ILE 113 8.523 -4.246 -1.182 850 HG23 ILE 113 3HG2 ILE 113 9.951 -3.392 -0.595 851 HD11 ILE 113 3HD1 ILE 113 10.799 -4.697 1.184 852 HD12 ILE 113 1HD1 ILE 113 10.337 -6.067 0.174 853 HD13 ILE 113 2HD1 ILE 113 10.445 -6.259 1.924 854 H ILE 114 H ILE 114 10.410 -0.781 0.880 855 HA ILE 114 HA ILE 114 8.071 0.984 1.168 856 HB ILE 114 HB ILE 114 9.872 2.833 1.439 857 HG12 ILE 114 2HG1 ILE 114 11.398 0.334 2.158 858 HG13 ILE 114 1HG1 ILE 114 11.901 1.654 1.119 859 HG21 ILE 114 1HG2 ILE 114 9.721 1.239 3.910 860 HG22 ILE 114 2HG2 ILE 114 8.185 1.616 3.128 861 HG23 ILE 114 3HG2 ILE 114 9.274 2.917 3.608 862 HD11 ILE 114 3HD1 ILE 114 11.945 1.438 4.071 863 HD12 ILE 114 1HD1 ILE 114 11.691 3.029 3.359 864 HD13 ILE 114 2HD1 ILE 114 13.142 2.108 2.964 865 H ASN 115 H ASN 115 11.309 1.244 -0.307 866 HA ASN 115 HA ASN 115 10.537 1.152 -2.968 867 HB2 ASN 115 2HB ASN 115 9.259 3.232 -2.278 868 HB3 ASN 115 1HB ASN 115 10.823 4.014 -2.016 869 HD21 ASN 115 1HD2 ASN 115 9.688 5.434 -3.671 870 HD22 ASN 115 2HD2 ASN 115 10.022 5.075 -5.344 871 H GLU 116 H GLU 116 12.672 0.281 -1.384 872 HA GLU 116 HA GLU 116 14.987 1.760 -1.350 873 HB2 GLU 116 2HB GLU 116 14.769 -1.174 -1.970 874 HB3 GLU 116 1HB GLU 116 16.208 -0.362 -1.379 875 HG2 GLU 116 2HG GLU 116 15.526 -0.714 0.643 876 HG3 GLU 116 1HG GLU 116 14.032 0.141 0.329 877 H ASN 117 H ASN 117 13.367 0.385 -4.089 878 HA ASN 117 HA ASN 117 15.667 0.748 -5.828 879 HB2 ASN 117 2HB ASN 117 13.644 -1.065 -5.869 880 HB3 ASN 117 1HB ASN 117 13.046 0.120 -7.039 881 HD21 ASN 117 1HD2 ASN 117 14.636 0.789 -8.703 882 HD22 ASN 117 2HD2 ASN 117 15.672 -0.446 -9.367 883 H GLY 118 H GLY 118 13.000 2.597 -4.750 884 HA2 GLY 118 2HA GLY 118 12.953 4.243 -7.172 885 HA3 GLY 118 1HA GLY 118 11.878 4.401 -5.782 886 H ASN 119 H ASN 119 12.155 6.569 -5.471 887 HA ASN 119 HA ASN 119 14.527 8.003 -5.556 888 HB2 ASN 119 2HB ASN 119 12.086 8.831 -5.352 889 HB3 ASN 119 1HB ASN 119 12.334 8.674 -3.606 890 HD21 ASN 119 1HD2 ASN 119 11.720 11.091 -4.535 891 HD22 ASN 119 2HD2 ASN 119 13.110 12.143 -4.510 892 HA PRO 120 HA PRO 120 16.418 6.307 -1.838 893 HB2 PRO 120 2HB PRO 120 18.883 7.284 -2.235 894 HB3 PRO 120 1HB PRO 120 18.249 5.943 -3.210 895 HG2 PRO 120 2HG PRO 120 18.454 8.856 -3.887 896 HG3 PRO 120 1HG PRO 120 18.815 7.438 -4.900 897 HD2 PRO 120 2HD PRO 120 16.469 8.870 -5.024 898 HD3 PRO 120 1HD PRO 120 16.624 7.160 -5.496 899 H SER 121 H SER 121 14.758 8.408 -1.324 900 HA SER 121 HA SER 121 15.929 9.656 0.885 901 HB2 SER 121 2HB SER 121 16.105 11.154 -1.682 902 HB3 SER 121 1HB SER 121 15.584 12.071 -0.258 903 HG SER 121 HG SER 121 17.715 12.209 -0.091 904 H TYR 122 H TYR 122 13.621 8.248 0.284 905 HA TYR 122 HA TYR 122 11.636 9.836 1.490 906 HB2 TYR 122 2HB TYR 122 11.840 10.045 -1.373 907 HB3 TYR 122 1HB TYR 122 10.303 9.295 -0.936 908 HD1 TYR 122 1HD TYR 122 8.962 10.542 0.962 909 HD2 TYR 122 2HD TYR 122 12.004 12.341 -1.405 910 HE1 TYR 122 1HE TYR 122 8.052 12.765 1.490 911 HE2 TYR 122 2HE TYR 122 11.102 14.568 -0.884 912 HH TYR 122 HH TYR 122 8.428 15.328 -0.079 913 H LYS 123 H LYS 123 12.398 7.055 -0.526 914 HA LYS 123 HA LYS 123 11.689 4.897 -0.515 915 HB2 LYS 123 2HB LYS 123 11.377 5.695 2.366 916 HB3 LYS 123 1HB LYS 123 10.999 4.068 1.830 917 HG2 LYS 123 2HG LYS 123 13.662 5.442 1.557 918 HG3 LYS 123 1HG LYS 123 13.243 4.188 2.738 919 HD2 LYS 123 2HD LYS 123 13.941 2.686 1.251 920 HD3 LYS 123 1HD LYS 123 12.535 3.111 0.266 921 HE2 LYS 123 2HE LYS 123 14.138 3.536 -1.278 922 HE3 LYS 123 1HE LYS 123 14.170 5.095 -0.457 923 HZ1 LYS 123 3HZ LYS 123 16.237 3.202 -0.713 924 HZ2 LYS 123 1HZ LYS 123 15.886 3.403 0.931 925 HZ3 LYS 123 2HZ LYS 123 16.296 4.742 -0.017 926 H TYR 124 H TYR 124 9.376 5.586 2.000 927 HA TYR 124 HA TYR 124 7.171 4.373 1.021 928 HB2 TYR 124 2HB TYR 124 7.318 6.956 2.578 929 HB3 TYR 124 1HB TYR 124 5.832 6.024 2.340 930 HD1 TYR 124 2HD TYR 124 6.106 3.445 2.964 931 HD2 TYR 124 1HD TYR 124 8.490 6.592 4.535 932 HE1 TYR 124 2HE TYR 124 6.642 2.051 4.917 933 HE2 TYR 124 1HE TYR 124 9.038 5.206 6.495 934 HH TYR 124 HH TYR 124 8.868 2.143 6.685 935 H PHE 125 H PHE 125 8.417 7.488 -0.034 936 HA PHE 125 HA PHE 125 6.130 8.418 -1.393 937 HB2 PHE 125 2HB PHE 125 8.325 9.657 -0.802 938 HB3 PHE 125 1HB PHE 125 8.935 8.986 -2.323 939 HD1 PHE 125 1HD PHE 125 6.146 11.013 -0.922 940 HD2 PHE 125 2HD PHE 125 8.543 10.095 -4.315 941 HE1 PHE 125 1HE PHE 125 5.113 12.878 -2.149 942 HE2 PHE 125 2HE PHE 125 7.517 11.959 -5.548 943 HZ PHE 125 HZ PHE 125 5.799 13.352 -4.467 944 H TYR 126 H TYR 126 5.197 7.809 -3.240 945 HA TYR 126 HA TYR 126 6.744 6.154 -5.125 946 HB2 TYR 126 2HB TYR 126 4.242 5.569 -3.757 947 HB3 TYR 126 1HB TYR 126 4.078 5.451 -5.511 948 HD1 TYR 126 2HD TYR 126 7.232 4.681 -3.759 949 HD2 TYR 126 1HD TYR 126 3.714 3.085 -5.534 950 HE1 TYR 126 2HE TYR 126 8.222 2.431 -3.692 951 HE2 TYR 126 1HE TYR 126 4.691 0.834 -5.461 952 HH TYR 126 HH TYR 126 7.475 0.090 -3.680 953 H VAL 127 H VAL 127 7.184 8.052 -6.371 954 HA VAL 127 HA VAL 127 4.843 9.269 -7.662 955 HB VAL 127 HB VAL 127 6.253 10.924 -6.654 956 HG11 VAL 127 1HG1 VAL 127 8.517 9.656 -8.187 957 HG12 VAL 127 2HG1 VAL 127 8.310 9.703 -6.437 958 HG13 VAL 127 3HG1 VAL 127 8.625 11.193 -7.328 959 HG21 VAL 127 3HG2 VAL 127 6.189 12.361 -8.380 960 HG22 VAL 127 1HG2 VAL 127 5.476 11.005 -9.253 961 HG23 VAL 127 2HG2 VAL 127 7.201 11.340 -9.402 962 H SER 128 H SER 128 4.813 7.111 -8.817 963 HA SER 128 HA SER 128 5.232 7.299 -11.463 964 HB2 SER 128 2HB SER 128 7.568 7.577 -11.398 965 HB3 SER 128 1HB SER 128 7.765 6.349 -10.134 966 HG SER 128 HG SER 128 7.631 6.070 -12.860 967 H ALA 129 H ALA 129 4.163 5.665 -12.386 968 HA ALA 129 HA ALA 129 3.287 3.447 -10.803 969 HB1 ALA 129 1HB ALA 129 2.884 3.774 -13.761 970 HB2 ALA 129 2HB ALA 129 1.930 4.649 -12.563 971 HB3 ALA 129 3HB ALA 129 1.883 2.887 -12.610 972 H GLU 130 H GLU 130 5.917 3.992 -12.965 973 HA GLU 130 HA GLU 130 6.284 1.323 -13.839 974 HB2 GLU 130 2HB GLU 130 8.413 2.018 -14.656 975 HB3 GLU 130 1HB GLU 130 7.299 3.366 -14.902 976 HG2 GLU 130 2HG GLU 130 8.683 4.699 -13.818 977 HG3 GLU 130 1HG GLU 130 8.499 3.710 -12.361 978 H GLN 131 H GLN 131 7.247 3.066 -10.948 979 HA GLN 131 HA GLN 131 9.024 0.968 -10.125 980 HB2 GLN 131 2HB GLN 131 8.943 2.183 -7.910 981 HB3 GLN 131 1HB GLN 131 9.711 3.002 -9.262 982 HG2 GLN 131 2HG GLN 131 7.580 4.249 -9.618 983 HG3 GLN 131 1HG GLN 131 6.971 3.526 -8.129 984 HE21 GLN 131 1HE2 GLN 131 6.766 5.553 -7.160 985 HE22 GLN 131 2HE2 GLN 131 8.139 6.437 -6.601 986 H VAL 132 H VAL 132 5.777 2.082 -9.305 987 HA VAL 132 HA VAL 132 5.274 0.368 -7.183 988 HB VAL 132 HB VAL 132 3.020 0.853 -7.398 989 HG11 VAL 132 1HG1 VAL 132 4.769 2.891 -7.591 990 HG12 VAL 132 2HG1 VAL 132 3.031 3.096 -7.384 991 HG13 VAL 132 3HG1 VAL 132 3.746 3.207 -8.991 992 HG21 VAL 132 3HG2 VAL 132 2.363 1.842 -9.860 993 HG22 VAL 132 1HG2 VAL 132 2.065 0.192 -9.311 994 HG23 VAL 132 2HG2 VAL 132 3.503 0.559 -10.263 995 H VAL 133 H VAL 133 5.540 -0.293 -10.566 996 HA VAL 133 HA VAL 133 4.199 -2.844 -10.372 997 HB VAL 133 HB VAL 133 4.099 -1.521 -12.471 998 HG11 VAL 133 1HG1 VAL 133 6.370 -2.113 -13.846 999 HG12 VAL 133 2HG1 VAL 133 7.007 -1.760 -12.239 1000 HG13 VAL 133 3HG1 VAL 133 6.028 -0.561 -13.082 1001 HG21 VAL 133 3HG2 VAL 133 3.665 -3.924 -12.473 1002 HG22 VAL 133 1HG2 VAL 133 5.381 -4.242 -12.729 1003 HG23 VAL 133 2HG2 VAL 133 4.441 -3.419 -13.973 1004 H GLN 134 H GLN 134 7.532 -1.616 -10.297 1005 HA GLN 134 HA GLN 134 8.620 -4.294 -10.572 1006 HB2 GLN 134 2HB GLN 134 10.738 -3.086 -9.605 1007 HB3 GLN 134 1HB GLN 134 10.217 -2.775 -11.254 1008 HG2 GLN 134 2HG GLN 134 9.097 -0.745 -10.509 1009 HG3 GLN 134 1HG GLN 134 9.651 -1.046 -8.862 1010 HE21 GLN 134 1HE2 GLN 134 12.204 -1.806 -9.175 1011 HE22 GLN 134 2HE2 GLN 134 13.143 -0.528 -9.899 1012 H GLY 135 H GLY 135 7.727 -2.137 -7.981 1013 HA2 GLY 135 2HA GLY 135 8.783 -3.844 -5.905 1014 HA3 GLY 135 1HA GLY 135 7.754 -2.422 -5.680 1015 H MET 136 H MET 136 5.974 -3.724 -7.850 1016 HA MET 136 HA MET 136 4.317 -5.192 -5.959 1017 HB2 MET 136 2HB MET 136 3.906 -3.866 -8.588 1018 HB3 MET 136 1HB MET 136 2.880 -5.242 -8.229 1019 HG2 MET 136 2HG MET 136 2.156 -2.794 -7.626 1020 HG3 MET 136 1HG MET 136 1.741 -4.158 -6.594 1021 HE1 MET 136 3HE MET 136 1.722 -3.811 -4.237 1022 HE2 MET 136 1HE MET 136 3.128 -3.328 -3.288 1023 HE3 MET 136 2HE MET 136 3.208 -4.757 -4.320 1024 H LYS 137 H LYS 137 6.055 -5.655 -8.966 1025 HA LYS 137 HA LYS 137 5.242 -8.375 -9.311 1026 HB2 LYS 137 2HB LYS 137 6.716 -8.404 -11.198 1027 HB3 LYS 137 1HB LYS 137 5.876 -6.866 -11.190 1028 HG2 LYS 137 2HG LYS 137 8.004 -6.031 -9.947 1029 HG3 LYS 137 1HG LYS 137 8.743 -7.469 -10.657 1030 HD2 LYS 137 2HD LYS 137 7.433 -5.168 -12.097 1031 HD3 LYS 137 1HD LYS 137 9.125 -5.656 -12.161 1032 HE2 LYS 137 2HE LYS 137 6.990 -7.566 -13.019 1033 HE3 LYS 137 1HE LYS 137 7.502 -6.283 -14.107 1034 HZ1 LYS 137 3HZ LYS 137 8.844 -8.712 -13.403 1035 HZ2 LYS 137 1HZ LYS 137 9.843 -7.358 -13.220 1036 HZ3 LYS 137 2HZ LYS 137 9.111 -7.674 -14.712 1037 H GLU 138 H GLU 138 7.509 -6.834 -7.336 1038 HA GLU 138 HA GLU 138 9.244 -9.176 -7.146 1039 HB2 GLU 138 2HB GLU 138 10.081 -6.730 -7.235 1040 HB3 GLU 138 1HB GLU 138 9.560 -6.649 -5.553 1041 HG2 GLU 138 2HG GLU 138 11.041 -8.945 -5.583 1042 HG3 GLU 138 1HG GLU 138 11.904 -7.920 -6.742 1043 H ALA 139 H ALA 139 7.744 -6.971 -4.804 1044 HA ALA 139 HA ALA 139 7.889 -8.608 -2.581 1045 HB1 ALA 139 1HB ALA 139 7.014 -6.104 -3.010 1046 HB2 ALA 139 2HB ALA 139 6.725 -7.000 -1.519 1047 HB3 ALA 139 3HB ALA 139 5.475 -6.931 -2.762 1048 H GLN 140 H GLN 140 5.717 -8.777 -5.269 1049 HA GLN 140 HA GLN 140 3.530 -10.066 -4.207 1050 HB2 GLN 140 2HB GLN 140 3.320 -11.097 -6.509 1051 HB3 GLN 140 1HB GLN 140 3.409 -9.337 -6.444 1052 HG2 GLN 140 2HG GLN 140 4.796 -9.905 -8.209 1053 HG3 GLN 140 1HG GLN 140 5.911 -9.657 -6.867 1054 HE21 GLN 140 1HE2 GLN 140 3.874 -12.363 -7.931 1055 HE22 GLN 140 2HE2 GLN 140 5.147 -13.531 -7.958 1056 H GLU 141 H GLU 141 6.730 -11.307 -4.482 1057 HA GLU 141 HA GLU 141 5.711 -13.991 -3.887 1058 HB2 GLU 141 2HB GLU 141 7.496 -15.002 -5.058 1059 HB3 GLU 141 1HB GLU 141 6.788 -13.781 -6.126 1060 HG2 GLU 141 2HG GLU 141 8.540 -12.221 -5.372 1061 HG3 GLU 141 1HG GLU 141 9.281 -13.553 -4.498 1062 H ARG 142 H ARG 142 8.240 -11.644 -3.235 1063 HA ARG 142 HA ARG 142 9.422 -13.296 -1.180 1064 HB2 ARG 142 2HB ARG 142 10.945 -11.389 -0.831 1065 HB3 ARG 142 1HB ARG 142 10.872 -11.891 -2.524 1066 HG2 ARG 142 2HG ARG 142 10.693 -9.664 -2.846 1067 HG3 ARG 142 1HG ARG 142 8.982 -10.005 -2.557 1068 HD2 ARG 142 2HD ARG 142 9.539 -8.122 -1.229 1069 HD3 ARG 142 1HD ARG 142 9.406 -9.500 -0.126 1070 HE ARG 142 HE ARG 142 11.862 -8.116 -0.919 1071 HH11 ARG 142 1HH1 ARG 142 10.321 -10.630 0.964 1072 HH12 ARG 142 2HH1 ARG 142 11.688 -10.854 2.001 1073 HH21 ARG 142 1HH2 ARG 142 13.653 -8.421 0.446 1074 HH22 ARG 142 2HH2 ARG 142 13.577 -9.605 1.708 1075 H LEU 143 H LEU 143 6.856 -11.057 -1.317 1076 HA LEU 143 HA LEU 143 7.057 -10.550 1.572 1077 HB2 LEU 143 2HB LEU 143 6.953 -8.586 0.046 1078 HB3 LEU 143 1HB LEU 143 5.353 -9.122 -0.465 1079 HG LEU 143 HG LEU 143 4.463 -8.756 1.746 1080 HD11 LEU 143 1HD1 LEU 143 7.253 -8.799 2.498 1081 HD12 LEU 143 2HD1 LEU 143 5.812 -8.989 3.496 1082 HD13 LEU 143 3HD1 LEU 143 6.431 -7.378 3.141 1083 HD21 LEU 143 3HD2 LEU 143 5.773 -6.655 0.203 1084 HD22 LEU 143 1HD2 LEU 143 5.468 -6.210 1.883 1085 HD23 LEU 143 2HD2 LEU 143 4.136 -6.737 0.855 1086 H THR 144 H THR 144 5.328 -12.344 -0.746 1087 HA THR 144 HA THR 144 2.954 -12.569 0.942 1088 HB THR 144 HB THR 144 2.701 -12.290 -1.515 1089 HG1 THR 144 1HG THR 144 1.215 -13.556 -0.094 1090 HG21 THR 144 3HG2 THR 144 3.890 -15.049 -1.660 1091 HG22 THR 144 1HG2 THR 144 4.580 -13.570 -2.328 1092 HG23 THR 144 2HG2 THR 144 3.071 -14.210 -2.979 1093 H GLY 145 H GLY 145 5.872 -14.252 0.243 1094 HA2 GLY 145 2HA GLY 145 4.904 -16.851 1.040 1095 HA3 GLY 145 1HA GLY 145 6.570 -16.415 0.705 1096 H ASP 146 H ASP 146 5.340 -14.186 2.849 1097 HA ASP 146 HA ASP 146 5.629 -13.799 5.066 1098 HB2 ASP 146 2HB ASP 146 5.265 -16.793 5.132 1099 HB3 ASP 146 1HB ASP 146 5.477 -15.836 6.592 1100 H ALA 147 H ALA 147 7.928 -14.683 3.193 1101 HA ALA 147 HA ALA 147 9.892 -15.598 5.136 1102 HB1 ALA 147 1HB ALA 147 11.187 -16.212 3.380 1103 HB2 ALA 147 2HB ALA 147 10.742 -14.802 2.418 1104 HB3 ALA 147 3HB ALA 147 9.640 -16.174 2.534 1105 H PHE 148 H PHE 148 8.734 -12.686 3.754 1106 HA PHE 148 HA PHE 148 10.973 -11.034 3.857 1107 HB2 PHE 148 2HB PHE 148 9.354 -9.173 4.029 1108 HB3 PHE 148 1HB PHE 148 8.888 -10.348 2.795 1109 HD1 PHE 148 1HD PHE 148 7.005 -11.876 3.198 1110 HD2 PHE 148 2HD PHE 148 8.010 -8.790 5.950 1111 HE1 PHE 148 1HE PHE 148 4.787 -12.088 4.239 1112 HE2 PHE 148 2HE PHE 148 5.795 -8.998 7.000 1113 HZ PHE 148 HZ PHE 148 4.179 -10.650 6.144 1114 H ARG 149 H ARG 149 8.682 -11.948 6.391 1115 HA ARG 149 HA ARG 149 9.568 -10.186 8.376 1116 HB2 ARG 149 2HB ARG 149 8.415 -12.955 8.733 1117 HB3 ARG 149 1HB ARG 149 8.442 -11.674 9.931 1118 HG2 ARG 149 2HG ARG 149 7.051 -10.312 8.322 1119 HG3 ARG 149 1HG ARG 149 6.843 -11.800 7.397 1120 HD2 ARG 149 2HD ARG 149 6.329 -12.092 10.259 1121 HD3 ARG 149 1HD ARG 149 5.238 -10.969 9.451 1122 HE ARG 149 HE ARG 149 5.228 -13.132 7.823 1123 HH11 ARG 149 1HH1 ARG 149 4.683 -12.704 11.243 1124 HH12 ARG 149 2HH1 ARG 149 3.586 -14.040 11.363 1125 HH21 ARG 149 1HH2 ARG 149 3.787 -14.888 7.980 1126 HH22 ARG 149 2HH2 ARG 149 3.078 -15.279 9.510 1127 H LYS 150 H LYS 150 11.426 -10.096 9.446 1128 HA LYS 150 HA LYS 150 13.523 -11.927 9.064 1129 HB2 LYS 150 2HB LYS 150 13.158 -9.423 10.348 1130 HB3 LYS 150 1HB LYS 150 13.888 -10.506 11.525 1131 HG2 LYS 150 2HG LYS 150 15.481 -11.066 9.495 1132 HG3 LYS 150 1HG LYS 150 14.979 -9.457 8.973 1133 HD2 LYS 150 2HD LYS 150 15.747 -9.677 11.805 1134 HD3 LYS 150 1HD LYS 150 17.054 -9.941 10.647 1135 HE2 LYS 150 2HE LYS 150 15.923 -7.757 9.569 1136 HE3 LYS 150 1HE LYS 150 15.522 -7.491 11.265 1137 HZ1 LYS 150 3HZ LYS 150 17.603 -6.458 10.818 1138 HZ2 LYS 150 1HZ LYS 150 18.228 -7.860 10.102 1139 HZ3 LYS 150 2HZ LYS 150 17.917 -7.824 11.764 1140 H LYS 151 H LYS 151 14.257 -13.637 10.228 1141 HA LYS 151 HA LYS 151 14.003 -15.547 11.454 1142 HB2 LYS 151 2HB LYS 151 14.461 -15.217 13.686 1143 HB3 LYS 151 1HB LYS 151 14.919 -13.659 13.016 1144 HG2 LYS 151 2HG LYS 151 12.279 -13.277 13.643 1145 HG3 LYS 151 1HG LYS 151 12.833 -14.340 14.935 1146 HD2 LYS 151 2HD LYS 151 14.884 -12.576 14.817 1147 HD3 LYS 151 1HD LYS 151 13.533 -11.541 14.350 1148 HE2 LYS 151 2HE LYS 151 12.692 -11.525 16.423 1149 HE3 LYS 151 1HE LYS 151 12.922 -13.261 16.622 1150 HZ1 LYS 151 3HZ LYS 151 15.341 -11.659 16.672 1151 HZ2 LYS 151 1HZ LYS 151 14.887 -12.969 17.643 1152 HZ3 LYS 151 2HZ LYS 151 14.290 -11.422 17.975 1153 H HIS 152 H HIS 152 12.503 -16.199 13.692 1154 HA HIS 152 HA HIS 152 10.484 -17.078 14.265 1155 HB2 HIS 152 2HB HIS 152 9.568 -14.513 12.968 1156 HB3 HIS 152 1HB HIS 152 8.474 -15.623 13.784 1157 HD1 HIS 152 1HD HIS 152 10.366 -12.679 14.409 1158 HD2 HIS 152 2HD HIS 152 9.450 -16.082 16.612 1159 HE1 HIS 152 1HE HIS 152 10.749 -12.048 16.813 1160 HE2 HIS 152 2HE HIS 152 10.072 -14.084 18.133 1161 H LEU 153 H LEU 153 10.670 -18.903 12.938 1162 HA LEU 153 HA LEU 153 9.395 -18.769 10.304 1163 HB2 LEU 153 2HB LEU 153 11.683 -20.022 11.127 1164 HB3 LEU 153 1HB LEU 153 10.522 -21.335 11.187 1165 HG LEU 153 HG LEU 153 11.709 -21.259 9.043 1166 HD11 LEU 153 1HD1 LEU 153 8.998 -20.415 8.247 1167 HD12 LEU 153 2HD1 LEU 153 9.095 -21.728 9.421 1168 HD13 LEU 153 3HD1 LEU 153 9.894 -21.883 7.855 1169 HD21 LEU 153 3HD2 LEU 153 11.605 -19.453 7.559 1170 HD22 LEU 153 1HD2 LEU 153 11.937 -18.718 9.127 1171 HD23 LEU 153 2HD2 LEU 153 10.305 -18.672 8.460 1172 H GLU 154 H GLU 154 7.657 -20.067 9.736 1173 HA GLU 154 HA GLU 154 6.424 -21.714 11.809 1174 HB2 GLU 154 2HB GLU 154 5.564 -19.157 11.519 1175 HB3 GLU 154 1HB GLU 154 4.527 -19.976 10.358 1176 HG2 GLU 154 2HG GLU 154 4.279 -21.627 12.472 1177 HG3 GLU 154 1HG GLU 154 4.549 -20.092 13.296 1178 H ASP 155 H ASP 155 4.359 -22.776 10.841 1179 HA ASP 155 HA ASP 155 5.194 -24.181 8.494 1180 HB2 ASP 155 2HB ASP 155 2.976 -24.379 10.447 1181 HB3 ASP 155 1HB ASP 155 2.642 -25.009 8.836 1182 H GLU 156 H GLU 156 2.268 -22.255 9.189 1183 HA GLU 156 HA GLU 156 0.918 -21.006 7.853 1184 HB2 GLU 156 2HB GLU 156 3.615 -20.544 6.914 1185 HB3 GLU 156 1HB GLU 156 2.460 -20.426 5.580 1186 HG2 GLU 156 2HG GLU 156 2.707 -18.255 6.472 1187 HG3 GLU 156 1HG GLU 156 1.133 -18.845 7.005 1188 H LEU 157 H LEU 157 0.040 -20.851 5.511 1189 HA LEU 157 HA LEU 157 -0.529 -23.566 4.673 1190 HB2 LEU 157 2HB LEU 157 -1.710 -20.887 4.216 1191 HB3 LEU 157 1HB LEU 157 -1.918 -22.059 2.929 1192 HG LEU 157 HG LEU 157 -2.691 -23.571 5.010 1193 HD11 LEU 157 1HD1 LEU 157 -3.861 -20.941 5.787 1194 HD12 LEU 157 2HD1 LEU 157 -2.289 -21.419 6.429 1195 HD13 LEU 157 3HD1 LEU 157 -3.707 -22.426 6.725 1196 HD21 LEU 157 3HD2 LEU 157 -3.973 -23.220 2.988 1197 HD22 LEU 157 1HD2 LEU 157 -4.392 -21.588 3.506 1198 HD23 LEU 157 2HD2 LEU 157 -5.003 -22.979 4.400 Start of MODEL 13 1 H1 MET 1 1HT MET 1 -16.130 12.847 17.282 2 H2 MET 1 2HT MET 1 -17.113 13.336 18.601 3 H3 MET 1 3HT MET 1 -17.215 11.731 18.000 4 HA MET 1 HA MET 1 -15.067 13.008 19.527 5 HB2 MET 1 2HB MET 1 -17.116 10.916 19.890 6 HB3 MET 1 1HB MET 1 -15.523 10.503 20.511 7 HG2 MET 1 2HG MET 1 -15.558 12.680 21.757 8 HG3 MET 1 1HG MET 1 -17.247 12.841 21.279 9 HE1 MET 1 2HE MET 1 -18.217 9.880 21.309 10 HE2 MET 1 3HE MET 1 -19.193 11.112 22.108 11 HE3 MET 1 1HE MET 1 -18.794 9.619 22.956 12 H HIS 2 H HIS 2 -15.843 10.498 17.197 13 HA HIS 2 HA HIS 2 -13.137 10.264 16.365 14 HB2 HIS 2 2HB HIS 2 -13.421 8.858 18.585 15 HB3 HIS 2 1HB HIS 2 -14.135 7.680 17.488 16 HD1 HIS 2 1HD HIS 2 -11.056 8.324 19.001 17 HD2 HIS 2 2HD HIS 2 -12.168 7.420 15.101 18 HE1 HIS 2 1HE HIS 2 -8.977 7.436 17.897 19 HE2 HIS 2 2HE HIS 2 -9.654 6.983 15.512 20 H HIS 3 H HIS 3 -13.029 9.467 14.335 21 HA HIS 3 HA HIS 3 -13.710 8.707 12.303 22 HB2 HIS 3 2HB HIS 3 -15.336 6.925 14.112 23 HB3 HIS 3 1HB HIS 3 -15.394 6.779 12.358 24 HD1 HIS 3 1HD HIS 3 -13.748 5.357 15.147 25 HD2 HIS 3 2HD HIS 3 -12.539 6.467 11.330 26 HE1 HIS 3 1HE HIS 3 -11.622 4.084 14.719 27 HE2 HIS 3 2HE HIS 3 -10.861 4.840 12.439 28 H HIS 4 H HIS 4 -14.704 10.266 11.190 29 HA HIS 4 HA HIS 4 -17.481 10.942 11.864 30 HB2 HIS 4 2HB HIS 4 -15.303 12.428 10.416 31 HB3 HIS 4 1HB HIS 4 -16.989 12.900 10.246 32 HD1 HIS 4 1HD HIS 4 -14.731 12.103 13.218 33 HD2 HIS 4 2HD HIS 4 -17.550 14.890 11.971 34 HE1 HIS 4 1HE HIS 4 -14.928 13.752 15.107 35 HE2 HIS 4 2HE HIS 4 -16.580 15.472 14.297 36 H HIS 5 H HIS 5 -18.974 9.922 10.715 37 HA HIS 5 HA HIS 5 -18.960 9.959 7.866 38 HB2 HIS 5 2HB HIS 5 -17.554 7.838 8.950 39 HB3 HIS 5 1HB HIS 5 -19.142 7.147 8.642 40 HD1 HIS 5 1HD HIS 5 -16.705 9.334 6.684 41 HD2 HIS 5 2HD HIS 5 -19.268 6.104 6.161 42 HE1 HIS 5 1HE HIS 5 -16.457 8.662 4.273 43 HE2 HIS 5 2HE HIS 5 -18.076 6.756 3.961 44 H HIS 6 H HIS 6 -20.288 8.464 10.786 45 HA HIS 6 HA HIS 6 -22.431 8.217 11.513 46 HB2 HIS 6 2HB HIS 6 -22.542 10.548 10.122 47 HB3 HIS 6 1HB HIS 6 -23.705 9.581 9.221 48 HD1 HIS 6 1HD HIS 6 -26.010 9.654 10.107 49 HD2 HIS 6 2HD HIS 6 -23.198 10.504 13.047 50 HE1 HIS 6 1HE HIS 6 -27.339 10.223 12.164 51 HE2 HIS 6 2HE HIS 6 -25.618 10.825 13.903 52 H HIS 7 H HIS 7 -24.289 6.919 11.127 53 HA HIS 7 HA HIS 7 -23.822 4.872 9.155 54 HB2 HIS 7 2HB HIS 7 -25.956 3.895 10.163 55 HB3 HIS 7 1HB HIS 7 -24.576 4.063 11.243 56 HD1 HIS 7 1HD HIS 7 -27.735 5.987 10.354 57 HD2 HIS 7 2HD HIS 7 -25.165 5.346 13.556 58 HE1 HIS 7 1HE HIS 7 -28.777 7.186 12.304 59 HE2 HIS 7 2HE HIS 7 -27.248 6.713 14.248 60 H MET 8 H MET 8 -26.098 4.008 8.187 61 HA MET 8 HA MET 8 -27.743 4.305 6.645 62 HB2 MET 8 2HB MET 8 -28.248 6.268 8.461 63 HB3 MET 8 1HB MET 8 -28.004 7.225 6.995 64 HG2 MET 8 2HG MET 8 -29.652 5.373 6.015 65 HG3 MET 8 1HG MET 8 -30.163 5.329 7.701 66 HE1 MET 8 3HE MET 8 -30.062 7.544 8.970 67 HE2 MET 8 1HE MET 8 -31.774 7.898 8.734 68 HE3 MET 8 2HE MET 8 -30.558 9.114 8.337 69 H SER 9 H SER 9 -26.074 7.455 6.555 70 HA SER 9 HA SER 9 -25.891 7.345 3.688 71 HB2 SER 9 2HB SER 9 -26.042 9.406 5.433 72 HB3 SER 9 1HB SER 9 -24.301 9.367 5.157 73 HG SER 9 HG SER 9 -26.204 9.381 3.059 74 H ASP 10 H ASP 10 -24.334 6.391 2.570 75 HA ASP 10 HA ASP 10 -21.921 5.501 3.922 76 HB2 ASP 10 2HB ASP 10 -23.326 4.820 1.395 77 HB3 ASP 10 1HB ASP 10 -21.577 4.617 1.407 78 H GLY 11 H GLY 11 -22.462 6.976 0.715 79 HA2 GLY 11 2HA GLY 11 -21.393 9.258 0.468 80 HA3 GLY 11 1HA GLY 11 -19.957 8.486 1.123 81 H HIS 12 H HIS 12 -18.991 9.302 -0.894 82 HA HIS 12 HA HIS 12 -19.756 7.926 -3.334 83 HB2 HIS 12 2HB HIS 12 -19.106 10.329 -3.363 84 HB3 HIS 12 1HB HIS 12 -17.475 9.860 -2.860 85 HD1 HIS 12 1HD HIS 12 -19.870 9.118 -5.731 86 HD2 HIS 12 2HD HIS 12 -15.803 9.453 -4.945 87 HE1 HIS 12 1HE HIS 12 -18.730 8.844 -7.955 88 HE2 HIS 12 2HE HIS 12 -16.267 8.958 -7.442 89 H ASN 13 H ASN 13 -17.160 7.921 -0.970 90 HA ASN 13 HA ASN 13 -15.479 6.456 -0.541 91 HB2 ASN 13 2HB ASN 13 -17.441 4.787 -2.037 92 HB3 ASN 13 1HB ASN 13 -15.824 4.132 -1.806 93 HD21 ASN 13 1HD2 ASN 13 -16.201 2.588 -0.336 94 HD22 ASN 13 2HD2 ASN 13 -16.864 2.865 1.235 95 H GLY 14 H GLY 14 -14.589 8.263 -2.153 96 HA2 GLY 14 2HA GLY 14 -13.532 7.020 -4.590 97 HA3 GLY 14 1HA GLY 14 -13.453 8.737 -4.177 98 H LEU 15 H LEU 15 -11.435 6.487 -4.892 99 HA LEU 15 HA LEU 15 -9.431 7.399 -2.985 100 HB2 LEU 15 2HB LEU 15 -9.686 4.459 -3.553 101 HB3 LEU 15 1HB LEU 15 -8.703 5.249 -2.337 102 HG LEU 15 HG LEU 15 -11.009 6.015 -1.365 103 HD11 LEU 15 1HD1 LEU 15 -12.061 3.448 -2.326 104 HD12 LEU 15 2HD1 LEU 15 -11.982 4.728 -3.537 105 HD13 LEU 15 3HD1 LEU 15 -12.885 4.982 -2.044 106 HD21 LEU 15 3HD2 LEU 15 -11.127 3.553 -0.344 107 HD22 LEU 15 1HD2 LEU 15 -9.870 4.709 0.100 108 HD23 LEU 15 2HD2 LEU 15 -9.536 3.461 -1.101 109 H GLY 16 H GLY 16 -9.569 4.789 -5.413 110 HA2 GLY 16 2HA GLY 16 -7.359 6.151 -6.833 111 HA3 GLY 16 1HA GLY 16 -7.504 4.412 -6.701 112 H LYS 17 H LYS 17 -9.734 7.032 -7.638 113 HA LYS 17 HA LYS 17 -10.338 5.489 -10.076 114 HB2 LYS 17 2HB LYS 17 -12.241 5.664 -8.527 115 HB3 LYS 17 1HB LYS 17 -12.118 7.416 -8.572 116 HG2 LYS 17 2HG LYS 17 -12.437 6.014 -11.160 117 HG3 LYS 17 1HG LYS 17 -13.830 6.060 -10.079 118 HD2 LYS 17 2HD LYS 17 -12.354 8.597 -10.522 119 HD3 LYS 17 1HD LYS 17 -13.339 7.984 -11.851 120 HE2 LYS 17 2HE LYS 17 -15.121 8.874 -10.867 121 HE3 LYS 17 1HE LYS 17 -14.916 7.723 -9.548 122 HZ1 LYS 17 3HZ LYS 17 -14.881 10.355 -9.212 123 HZ2 LYS 17 1HZ LYS 17 -13.227 10.084 -9.449 124 HZ3 LYS 17 2HZ LYS 17 -14.046 9.286 -8.203 125 H GLY 18 H GLY 18 -9.883 6.406 -11.976 126 HA2 GLY 18 2HA GLY 18 -10.084 8.399 -13.397 127 HA3 GLY 18 1HA GLY 18 -9.470 9.334 -12.029 128 H PHE 19 H PHE 19 -7.340 7.740 -11.232 129 HA PHE 19 HA PHE 19 -5.532 8.089 -13.521 130 HB2 PHE 19 2HB PHE 19 -3.730 8.259 -11.874 131 HB3 PHE 19 1HB PHE 19 -5.012 9.427 -11.524 132 HD1 PHE 19 1HD PHE 19 -3.479 6.244 -10.478 133 HD2 PHE 19 2HD PHE 19 -6.258 9.317 -9.507 134 HE1 PHE 19 1HE PHE 19 -3.642 5.367 -8.185 135 HE2 PHE 19 2HE PHE 19 -6.426 8.446 -7.212 136 HZ PHE 19 HZ PHE 19 -5.116 6.469 -6.548 137 H GLY 20 H GLY 20 -7.260 5.666 -12.698 138 HA2 GLY 20 2HA GLY 20 -5.407 3.688 -13.541 139 HA3 GLY 20 1HA GLY 20 -5.666 3.573 -11.801 140 H ASP 21 H ASP 21 -7.366 2.498 -11.065 141 HA ASP 21 HA ASP 21 -9.902 2.295 -12.081 142 HB2 ASP 21 2HB ASP 21 -7.982 0.694 -13.597 143 HB3 ASP 21 1HB ASP 21 -9.299 -0.289 -12.952 144 H HIS 22 H HIS 22 -9.852 -0.806 -11.657 145 HA HIS 22 HA HIS 22 -10.056 -0.643 -8.760 146 HB2 HIS 22 2HB HIS 22 -10.505 -3.259 -10.048 147 HB3 HIS 22 1HB HIS 22 -11.505 -2.392 -8.889 148 HD1 HIS 22 1HD HIS 22 -13.389 -0.927 -9.822 149 HD2 HIS 22 2HD HIS 22 -11.054 -2.710 -12.762 150 HE1 HIS 22 1HE HIS 22 -14.636 -0.573 -11.976 151 HE2 HIS 22 2HE HIS 22 -13.253 -1.745 -13.726 152 H ILE 23 H ILE 23 -7.979 -0.615 -7.953 153 HA ILE 23 HA ILE 23 -6.436 -3.076 -8.333 154 HB ILE 23 HB ILE 23 -5.327 -0.291 -8.699 155 HG12 ILE 23 2HG1 ILE 23 -4.666 -1.810 -10.911 156 HG13 ILE 23 1HG1 ILE 23 -6.306 -2.329 -10.539 157 HG21 ILE 23 1HG2 ILE 23 -3.336 -1.052 -8.168 158 HG22 ILE 23 2HG2 ILE 23 -3.449 -2.261 -9.446 159 HG23 ILE 23 3HG2 ILE 23 -4.012 -2.642 -7.819 160 HD11 ILE 23 3HD1 ILE 23 -7.166 -0.445 -11.328 161 HD12 ILE 23 1HD1 ILE 23 -5.563 -0.094 -11.978 162 HD13 ILE 23 2HD1 ILE 23 -6.035 0.544 -10.401 163 H HIS 24 H HIS 24 -4.831 -0.367 -6.919 164 HA HIS 24 HA HIS 24 -4.742 -1.692 -4.357 165 HB2 HIS 24 2HB HIS 24 -3.463 0.951 -4.958 166 HB3 HIS 24 1HB HIS 24 -2.933 -0.312 -3.843 167 HD1 HIS 24 1HD HIS 24 -1.726 1.141 -6.702 168 HD2 HIS 24 2HD HIS 24 -2.533 -2.823 -5.752 169 HE1 HIS 24 1HE HIS 24 -0.319 -0.227 -8.275 170 HE2 HIS 24 2HE HIS 24 -0.782 -2.623 -7.645 171 H TRP 25 H TRP 25 -7.238 -0.401 -5.313 172 HA TRP 25 HA TRP 25 -7.804 1.146 -2.912 173 HB2 TRP 25 2HB TRP 25 -9.193 2.571 -4.822 174 HB3 TRP 25 1HB TRP 25 -7.704 3.092 -4.045 175 HD1 TRP 25 HD TRP 25 -9.094 1.906 -7.324 176 HE1 TRP 25 1HE TRP 25 -7.279 2.097 -9.115 177 HE3 TRP 25 3HE TRP 25 -5.083 2.921 -4.338 178 HZ2 TRP 25 2HZ TRP 25 -4.505 2.612 -9.273 179 HZ3 TRP 25 3HZ TRP 25 -2.896 3.250 -5.378 180 HH2 TRP 25 HH TRP 25 -2.600 3.098 -7.798 181 H ARG 26 H ARG 26 -8.697 -1.182 -5.179 182 HA ARG 26 HA ARG 26 -11.334 -0.928 -5.643 183 HB2 ARG 26 2HB ARG 26 -10.193 -3.504 -4.583 184 HB3 ARG 26 1HB ARG 26 -11.582 -3.317 -5.648 185 HG2 ARG 26 2HG ARG 26 -9.666 -2.117 -7.117 186 HG3 ARG 26 1HG ARG 26 -8.706 -3.323 -6.259 187 HD2 ARG 26 2HD ARG 26 -11.266 -4.010 -7.662 188 HD3 ARG 26 1HD ARG 26 -9.705 -4.018 -8.491 189 HE ARG 26 HE ARG 26 -10.080 -5.638 -6.081 190 HH11 ARG 26 1HH1 ARG 26 -9.576 -5.469 -9.537 191 HH12 ARG 26 2HH1 ARG 26 -9.143 -7.139 -9.676 192 HH21 ARG 26 1HH2 ARG 26 -9.516 -7.834 -6.273 193 HH22 ARG 26 2HH2 ARG 26 -9.112 -8.480 -7.828 194 H THR 27 H THR 27 -9.901 -1.631 -2.483 195 HA THR 27 HA THR 27 -11.819 -0.547 -0.905 196 HB THR 27 HB THR 27 -12.832 -2.981 -0.184 197 HG1 THR 27 1HG THR 27 -13.518 -3.964 -2.126 198 HG21 THR 27 3HG2 THR 27 -13.853 -0.668 -1.620 199 HG22 THR 27 1HG2 THR 27 -14.569 -1.603 -0.308 200 HG23 THR 27 2HG2 THR 27 -14.723 -2.161 -1.974 201 H LEU 28 H LEU 28 -11.007 -0.455 1.087 202 HA LEU 28 HA LEU 28 -8.616 -1.838 1.737 203 HB2 LEU 28 2HB LEU 28 -9.058 0.387 2.600 204 HB3 LEU 28 1HB LEU 28 -10.490 -0.198 3.449 205 HG LEU 28 HG LEU 28 -7.806 -1.363 4.093 206 HD11 LEU 28 1HD1 LEU 28 -8.882 1.114 5.414 207 HD12 LEU 28 2HD1 LEU 28 -7.672 1.157 4.133 208 HD13 LEU 28 3HD1 LEU 28 -7.315 0.341 5.656 209 HD21 LEU 28 3HD2 LEU 28 -10.490 -1.146 5.363 210 HD22 LEU 28 1HD2 LEU 28 -9.066 -1.257 6.399 211 HD23 LEU 28 2HD2 LEU 28 -9.411 -2.535 5.233 212 H GLU 29 H GLU 29 -11.927 -2.052 3.030 213 HA GLU 29 HA GLU 29 -11.408 -4.185 4.799 214 HB2 GLU 29 2HB GLU 29 -13.376 -2.730 5.003 215 HB3 GLU 29 1HB GLU 29 -14.010 -3.370 3.493 216 HG2 GLU 29 2HG GLU 29 -13.386 -5.273 5.686 217 HG3 GLU 29 1HG GLU 29 -14.828 -4.270 5.819 218 H ASP 30 H ASP 30 -13.055 -4.201 1.630 219 HA ASP 30 HA ASP 30 -13.311 -6.966 1.388 220 HB2 ASP 30 2HB ASP 30 -13.812 -4.695 -0.232 221 HB3 ASP 30 1HB ASP 30 -12.831 -5.805 -1.201 222 H GLY 31 H GLY 31 -10.571 -4.885 0.868 223 HA2 GLY 31 2HA GLY 31 -9.031 -6.673 -0.709 224 HA3 GLY 31 1HA GLY 31 -8.406 -5.307 0.222 225 H LYS 32 H LYS 32 -9.338 -6.202 2.776 226 HA LYS 32 HA LYS 32 -7.161 -7.805 3.551 227 HB2 LYS 32 2HB LYS 32 -8.271 -6.269 5.095 228 HB3 LYS 32 1HB LYS 32 -9.742 -7.229 5.017 229 HG2 LYS 32 2HG LYS 32 -7.801 -9.052 5.760 230 HG3 LYS 32 1HG LYS 32 -7.375 -7.586 6.646 231 HD2 LYS 32 2HD LYS 32 -9.143 -7.770 8.011 232 HD3 LYS 32 1HD LYS 32 -10.236 -8.169 6.683 233 HE2 LYS 32 2HE LYS 32 -9.678 -10.457 6.777 234 HE3 LYS 32 1HE LYS 32 -8.265 -10.152 7.786 235 HZ1 LYS 32 3HZ LYS 32 -9.628 -9.670 9.631 236 HZ2 LYS 32 1HZ LYS 32 -10.257 -11.087 8.954 237 HZ3 LYS 32 2HZ LYS 32 -11.033 -9.607 8.693 238 H LYS 33 H LYS 33 -10.607 -8.581 3.165 239 HA LYS 33 HA LYS 33 -10.471 -11.269 3.922 240 HB2 LYS 33 2HB LYS 33 -12.576 -10.028 3.659 241 HB3 LYS 33 1HB LYS 33 -12.327 -9.974 1.918 242 HG2 LYS 33 2HG LYS 33 -12.159 -12.685 2.807 243 HG3 LYS 33 1HG LYS 33 -13.645 -11.947 3.431 244 HD2 LYS 33 2HD LYS 33 -14.565 -11.772 1.377 245 HD3 LYS 33 1HD LYS 33 -13.030 -11.357 0.611 246 HE2 LYS 33 2HE LYS 33 -12.689 -13.990 1.387 247 HE3 LYS 33 1HE LYS 33 -14.365 -13.930 0.842 248 HZ1 LYS 33 3HZ LYS 33 -12.388 -12.628 -0.857 249 HZ2 LYS 33 1HZ LYS 33 -13.755 -13.532 -1.281 250 HZ3 LYS 33 2HZ LYS 33 -12.337 -14.319 -0.802 251 H GLU 34 H GLU 34 -9.869 -9.704 0.829 252 HA GLU 34 HA GLU 34 -9.669 -12.115 -0.674 253 HB2 GLU 34 2HB GLU 34 -10.149 -9.893 -1.678 254 HB3 GLU 34 1HB GLU 34 -8.497 -9.399 -1.303 255 HG2 GLU 34 2HG GLU 34 -7.629 -10.526 -3.035 256 HG3 GLU 34 1HG GLU 34 -8.722 -11.903 -2.816 257 H ALA 35 H ALA 35 -7.265 -9.917 0.750 258 HA ALA 35 HA ALA 35 -4.956 -11.191 -0.121 259 HB1 ALA 35 1HB ALA 35 -4.409 -9.223 0.856 260 HB2 ALA 35 2HB ALA 35 -4.126 -10.266 2.250 261 HB3 ALA 35 3HB ALA 35 -5.641 -9.374 2.108 262 H ALA 36 H ALA 36 -7.231 -12.142 2.307 263 HA ALA 36 HA ALA 36 -5.560 -13.890 3.788 264 HB1 ALA 36 1HB ALA 36 -7.776 -14.902 4.493 265 HB2 ALA 36 2HB ALA 36 -8.540 -13.692 3.462 266 HB3 ALA 36 3HB ALA 36 -7.550 -13.185 4.832 267 H ALA 37 H ALA 37 -7.829 -14.435 1.105 268 HA ALA 37 HA ALA 37 -7.594 -17.206 0.927 269 HB1 ALA 37 1HB ALA 37 -8.847 -17.028 -0.946 270 HB2 ALA 37 2HB ALA 37 -7.850 -15.739 -1.621 271 HB3 ALA 37 3HB ALA 37 -9.051 -15.369 -0.384 272 H SER 38 H SER 38 -6.057 -14.935 -1.354 273 HA SER 38 HA SER 38 -4.168 -16.848 -2.250 274 HB2 SER 38 2HB SER 38 -4.589 -13.917 -2.652 275 HB3 SER 38 1HB SER 38 -3.025 -14.613 -3.107 276 HG SER 38 HG SER 38 -5.544 -14.991 -4.223 277 H GLY 39 H GLY 39 -4.223 -14.665 0.423 278 HA2 GLY 39 2HA GLY 39 -2.781 -14.564 2.229 279 HA3 GLY 39 1HA GLY 39 -1.752 -15.752 1.425 280 H LEU 40 H LEU 40 -2.698 -12.862 -0.255 281 HA LEU 40 HA LEU 40 0.094 -12.018 -0.290 282 HB2 LEU 40 2HB LEU 40 -0.488 -10.655 -2.169 283 HB3 LEU 40 1HB LEU 40 -1.177 -12.249 -2.406 284 HG LEU 40 HG LEU 40 -3.347 -11.223 -1.460 285 HD11 LEU 40 1HD1 LEU 40 -1.597 -8.896 -1.645 286 HD12 LEU 40 2HD1 LEU 40 -3.046 -9.155 -0.677 287 HD13 LEU 40 3HD1 LEU 40 -3.189 -8.684 -2.370 288 HD21 LEU 40 3HD2 LEU 40 -4.103 -10.910 -3.590 289 HD22 LEU 40 1HD2 LEU 40 -2.608 -11.787 -3.917 290 HD23 LEU 40 2HD2 LEU 40 -2.659 -10.031 -4.090 291 HA PRO 41 HA PRO 41 -0.444 -8.691 2.558 292 HB2 PRO 41 2HB PRO 41 1.395 -6.926 1.630 293 HB3 PRO 41 1HB PRO 41 1.837 -8.418 2.471 294 HG2 PRO 41 2HG PRO 41 1.727 -7.871 -0.475 295 HG3 PRO 41 1HG PRO 41 3.004 -8.673 0.459 296 HD2 PRO 41 2HD PRO 41 1.190 -10.072 -0.940 297 HD3 PRO 41 1HD PRO 41 1.804 -10.653 0.621 298 H LEU 42 H LEU 42 -1.084 -6.447 2.761 299 HA LEU 42 HA LEU 42 -2.880 -5.692 0.637 300 HB2 LEU 42 2HB LEU 42 -2.418 -4.137 3.154 301 HB3 LEU 42 1HB LEU 42 -3.855 -4.230 2.175 302 HG LEU 42 HG LEU 42 -2.788 -6.335 4.038 303 HD11 LEU 42 1HD1 LEU 42 -4.992 -4.360 4.092 304 HD12 LEU 42 2HD1 LEU 42 -3.995 -4.989 5.406 305 HD13 LEU 42 3HD1 LEU 42 -5.323 -5.958 4.766 306 HD21 LEU 42 3HD2 LEU 42 -5.172 -6.527 2.197 307 HD22 LEU 42 1HD2 LEU 42 -4.645 -7.738 3.367 308 HD23 LEU 42 2HD2 LEU 42 -3.638 -7.368 1.966 309 H MET 43 H MET 43 -2.940 -3.586 -0.278 310 HA MET 43 HA MET 43 -0.261 -2.421 -0.579 311 HB2 MET 43 2HB MET 43 -1.284 -3.352 -2.621 312 HB3 MET 43 1HB MET 43 -2.655 -2.253 -2.432 313 HG2 MET 43 2HG MET 43 -1.045 -1.472 -4.094 314 HG3 MET 43 1HG MET 43 -1.191 -0.350 -2.747 315 HE1 MET 43 3HE MET 43 1.910 -2.723 -4.521 316 HE2 MET 43 1HE MET 43 0.390 -3.408 -3.951 317 HE3 MET 43 2HE MET 43 1.854 -3.591 -2.988 318 H VAL 44 H VAL 44 -0.187 -0.905 1.025 319 HA VAL 44 HA VAL 44 -2.396 0.944 1.390 320 HB VAL 44 HB VAL 44 0.288 0.904 2.776 321 HG11 VAL 44 1HG1 VAL 44 -0.674 3.079 2.945 322 HG12 VAL 44 2HG1 VAL 44 -0.937 2.264 4.487 323 HG13 VAL 44 3HG1 VAL 44 -2.260 2.412 3.331 324 HG21 VAL 44 3HG2 VAL 44 -0.443 -0.757 4.038 325 HG22 VAL 44 1HG2 VAL 44 -1.881 -0.880 3.027 326 HG23 VAL 44 2HG2 VAL 44 -1.893 0.151 4.458 327 H ILE 45 H ILE 45 -2.568 2.428 -0.138 328 HA ILE 45 HA ILE 45 -0.180 4.023 -0.808 329 HB ILE 45 HB ILE 45 -2.565 3.620 -2.619 330 HG12 ILE 45 2HG1 ILE 45 0.026 2.092 -2.428 331 HG13 ILE 45 1HG1 ILE 45 -1.619 1.467 -2.478 332 HG21 ILE 45 1HG2 ILE 45 -0.679 5.566 -2.672 333 HG22 ILE 45 2HG2 ILE 45 -1.553 4.979 -4.088 334 HG23 ILE 45 3HG2 ILE 45 0.050 4.351 -3.721 335 HD11 ILE 45 3HD1 ILE 45 -1.800 1.825 -4.780 336 HD12 ILE 45 1HD1 ILE 45 -0.186 1.165 -4.546 337 HD13 ILE 45 2HD1 ILE 45 -0.400 2.892 -4.817 338 H ILE 46 H ILE 46 -0.467 5.727 0.608 339 HA ILE 46 HA ILE 46 -3.120 6.979 0.621 340 HB ILE 46 HB ILE 46 -0.909 7.509 2.592 341 HG12 ILE 46 2HG1 ILE 46 -3.159 5.882 3.511 342 HG13 ILE 46 1HG1 ILE 46 -2.170 5.071 2.295 343 HG21 ILE 46 1HG2 ILE 46 -3.835 7.812 3.099 344 HG22 ILE 46 2HG2 ILE 46 -2.959 9.064 2.219 345 HG23 ILE 46 3HG2 ILE 46 -2.472 8.631 3.861 346 HD11 ILE 46 3HD1 ILE 46 -1.510 4.646 4.663 347 HD12 ILE 46 1HD1 ILE 46 -1.076 6.351 4.785 348 HD13 ILE 46 2HD1 ILE 46 -0.221 5.303 3.651 349 H HIS 47 H HIS 47 -3.422 9.088 0.129 350 HA HIS 47 HA HIS 47 -1.054 10.687 -0.538 351 HB2 HIS 47 2HB HIS 47 -3.257 10.877 -2.507 352 HB3 HIS 47 1HB HIS 47 -1.510 11.003 -2.736 353 HD1 HIS 47 1HD HIS 47 -0.934 9.288 -4.420 354 HD2 HIS 47 2HD HIS 47 -3.613 7.837 -1.597 355 HE1 HIS 47 1HE HIS 47 -1.274 6.867 -4.998 356 HE2 HIS 47 2HE HIS 47 -3.010 6.054 -3.365 357 H LYS 48 H LYS 48 -1.195 12.588 0.413 358 HA LYS 48 HA LYS 48 -3.880 13.818 0.630 359 HB2 LYS 48 2HB LYS 48 -1.920 13.277 2.735 360 HB3 LYS 48 1HB LYS 48 -2.510 14.928 2.733 361 HG2 LYS 48 2HG LYS 48 -4.832 14.012 2.743 362 HG3 LYS 48 1HG LYS 48 -4.131 12.407 2.965 363 HD2 LYS 48 2HD LYS 48 -4.205 12.814 5.159 364 HD3 LYS 48 1HD LYS 48 -2.882 13.951 4.895 365 HE2 LYS 48 2HE LYS 48 -5.825 14.603 4.828 366 HE3 LYS 48 1HE LYS 48 -4.709 14.993 6.135 367 HZ1 LYS 48 3HZ LYS 48 -3.619 16.563 4.839 368 HZ2 LYS 48 1HZ LYS 48 -5.244 16.795 4.426 369 HZ3 LYS 48 2HZ LYS 48 -4.220 15.946 3.383 370 H SER 49 H SER 49 -3.996 16.088 0.482 371 HA SER 49 HA SER 49 -3.500 18.092 -0.481 372 HB2 SER 49 2HB SER 49 -1.652 19.200 0.387 373 HB3 SER 49 1HB SER 49 -1.870 17.908 1.567 374 HG SER 49 HG SER 49 0.317 18.401 0.405 375 H TRP 50 H TRP 50 -1.138 19.053 -1.700 376 HA TRP 50 HA TRP 50 -1.399 18.239 -4.308 377 HB2 TRP 50 2HB TRP 50 0.789 19.261 -4.738 378 HB3 TRP 50 1HB TRP 50 -0.167 20.259 -3.632 379 HD1 TRP 50 HD TRP 50 0.519 19.883 -0.912 380 HE1 TRP 50 1HE TRP 50 2.875 19.633 0.092 381 HE3 TRP 50 3HE TRP 50 3.055 18.499 -5.128 382 HZ2 TRP 50 2HZ TRP 50 5.467 18.939 -0.787 383 HZ3 TRP 50 3HZ TRP 50 5.470 18.059 -4.962 384 HH2 TRP 50 HH TRP 50 6.650 18.276 -2.835 385 H CYS 51 H CYS 51 -1.476 16.093 -4.719 386 HA CYS 51 HA CYS 51 0.757 14.420 -3.841 387 HB2 CYS 51 2HB CYS 51 -1.239 13.373 -3.251 388 HB3 CYS 51 1HB CYS 51 -2.057 13.872 -4.724 389 H GLY 52 H GLY 52 2.172 13.479 -5.223 390 HA2 GLY 52 2HA GLY 52 1.772 13.978 -8.115 391 HA3 GLY 52 1HA GLY 52 3.358 13.961 -7.340 392 H ALA 53 H ALA 53 2.630 11.660 -5.646 393 HA ALA 53 HA ALA 53 3.575 9.580 -7.268 394 HB1 ALA 53 1HB ALA 53 2.119 9.487 -4.630 395 HB2 ALA 53 2HB ALA 53 3.864 9.472 -4.884 396 HB3 ALA 53 3HB ALA 53 2.889 8.093 -5.391 397 H CYS 54 H CYS 54 0.512 10.968 -7.037 398 HA CYS 54 HA CYS 54 -0.770 8.613 -8.191 399 HB2 CYS 54 2HB CYS 54 -2.907 9.847 -7.716 400 HB3 CYS 54 1HB CYS 54 -1.967 9.445 -6.273 401 H LYS 55 H LYS 55 0.069 11.956 -8.708 402 HA LYS 55 HA LYS 55 -1.426 12.525 -10.984 403 HB2 LYS 55 2HB LYS 55 0.032 14.099 -9.594 404 HB3 LYS 55 1HB LYS 55 1.388 13.508 -10.543 405 HG2 LYS 55 2HG LYS 55 -0.115 14.178 -12.573 406 HG3 LYS 55 1HG LYS 55 -0.917 15.206 -11.372 407 HD2 LYS 55 2HD LYS 55 0.908 16.559 -11.119 408 HD3 LYS 55 1HD LYS 55 2.054 15.269 -11.492 409 HE2 LYS 55 2HE LYS 55 0.958 15.429 -13.876 410 HE3 LYS 55 1HE LYS 55 0.526 17.050 -13.332 411 HZ1 LYS 55 3HZ LYS 55 3.018 17.170 -12.698 412 HZ2 LYS 55 1HZ LYS 55 2.563 17.385 -14.314 413 HZ3 LYS 55 2HZ LYS 55 3.193 15.901 -13.802 414 H ALA 56 H ALA 56 1.915 11.265 -10.777 415 HA ALA 56 HA ALA 56 2.317 10.949 -13.532 416 HB1 ALA 56 1HB ALA 56 3.756 10.413 -11.210 417 HB2 ALA 56 2HB ALA 56 4.311 10.196 -12.871 418 HB3 ALA 56 3HB ALA 56 3.586 8.845 -12.001 419 H LEU 57 H LEU 57 0.710 8.894 -11.195 420 HA LEU 57 HA LEU 57 0.517 6.535 -12.640 421 HB2 LEU 57 2HB LEU 57 -1.667 7.631 -10.882 422 HB3 LEU 57 1HB LEU 57 -1.297 5.951 -11.195 423 HG LEU 57 HG LEU 57 0.250 7.895 -9.514 424 HD11 LEU 57 1HD1 LEU 57 -1.641 6.800 -8.443 425 HD12 LEU 57 2HD1 LEU 57 -0.117 6.214 -7.773 426 HD13 LEU 57 3HD1 LEU 57 -1.014 5.223 -8.924 427 HD21 LEU 57 3HD2 LEU 57 1.445 6.003 -11.127 428 HD22 LEU 57 1HD2 LEU 57 1.290 5.183 -9.576 429 HD23 LEU 57 2HD2 LEU 57 2.138 6.724 -9.678 430 H LYS 58 H LYS 58 -1.442 9.459 -12.881 431 HA LYS 58 HA LYS 58 -3.616 8.595 -14.263 432 HB2 LYS 58 2HB LYS 58 -2.032 11.109 -14.363 433 HB3 LYS 58 1HB LYS 58 -3.241 10.861 -15.617 434 HG2 LYS 58 2HG LYS 58 -4.634 10.219 -13.359 435 HG3 LYS 58 1HG LYS 58 -3.564 11.500 -12.782 436 HD2 LYS 58 2HD LYS 58 -5.366 11.690 -15.198 437 HD3 LYS 58 1HD LYS 58 -5.719 12.372 -13.610 438 HE2 LYS 58 2HE LYS 58 -3.515 13.630 -13.843 439 HE3 LYS 58 1HE LYS 58 -3.554 13.157 -15.542 440 HZ1 LYS 58 3HZ LYS 58 -5.633 14.308 -15.811 441 HZ2 LYS 58 1HZ LYS 58 -4.506 15.373 -15.133 442 HZ3 LYS 58 2HZ LYS 58 -5.704 14.676 -14.162 443 HA PRO 59 HA PRO 59 -1.624 8.706 -18.612 444 HB2 PRO 59 2HB PRO 59 0.972 9.401 -18.917 445 HB3 PRO 59 1HB PRO 59 -0.348 10.588 -18.863 446 HG2 PRO 59 2HG PRO 59 1.517 9.725 -16.675 447 HG3 PRO 59 1HG PRO 59 1.012 11.361 -17.135 448 HD2 PRO 59 2HD PRO 59 -0.097 10.052 -15.054 449 HD3 PRO 59 1HD PRO 59 -1.026 11.176 -16.073 450 H LYS 60 H LYS 60 0.636 7.558 -16.107 451 HA LYS 60 HA LYS 60 1.458 5.395 -17.914 452 HB2 LYS 60 2HB LYS 60 3.195 4.883 -16.297 453 HB3 LYS 60 1HB LYS 60 3.238 6.591 -16.720 454 HG2 LYS 60 2HG LYS 60 1.646 6.732 -14.612 455 HG3 LYS 60 1HG LYS 60 2.532 5.279 -14.162 456 HD2 LYS 60 2HD LYS 60 3.590 7.320 -13.265 457 HD3 LYS 60 1HD LYS 60 4.643 6.476 -14.399 458 HE2 LYS 60 2HE LYS 60 3.070 8.336 -15.863 459 HE3 LYS 60 1HE LYS 60 3.762 9.171 -14.476 460 HZ1 LYS 60 3HZ LYS 60 5.523 7.438 -16.039 461 HZ2 LYS 60 1HZ LYS 60 5.869 8.884 -15.231 462 HZ3 LYS 60 2HZ LYS 60 5.073 8.918 -16.723 463 H PHE 61 H PHE 61 0.178 5.768 -14.583 464 HA PHE 61 HA PHE 61 -0.176 3.011 -14.179 465 HB2 PHE 61 2HB PHE 61 -0.241 4.830 -12.406 466 HB3 PHE 61 1HB PHE 61 -1.893 5.157 -12.936 467 HD1 PHE 61 2HD PHE 61 -3.526 3.156 -12.903 468 HD2 PHE 61 1HD PHE 61 0.173 3.238 -10.804 469 HE1 PHE 61 2HE PHE 61 -4.337 1.376 -11.411 470 HE2 PHE 61 1HE PHE 61 -0.629 1.458 -9.308 471 HZ PHE 61 HZ PHE 61 -2.889 0.525 -9.610 472 H ALA 62 H ALA 62 -1.840 5.319 -16.102 473 HA ALA 62 HA ALA 62 -4.367 4.102 -16.295 474 HB1 ALA 62 1HB ALA 62 -4.434 6.095 -17.398 475 HB2 ALA 62 2HB ALA 62 -4.029 5.082 -18.783 476 HB3 ALA 62 3HB ALA 62 -2.760 5.970 -17.938 477 H GLU 63 H GLU 63 -1.239 3.271 -17.289 478 HA GLU 63 HA GLU 63 -1.822 1.372 -19.346 479 HB2 GLU 63 2HB GLU 63 0.332 2.738 -18.995 480 HB3 GLU 63 1HB GLU 63 0.710 1.581 -17.715 481 HG2 GLU 63 2HG GLU 63 0.437 -0.231 -19.471 482 HG3 GLU 63 1HG GLU 63 0.435 1.067 -20.664 483 H SER 64 H SER 64 -2.036 1.392 -16.000 484 HA SER 64 HA SER 64 -1.212 -1.053 -15.123 485 HB2 SER 64 2HB SER 64 -3.515 0.678 -14.331 486 HB3 SER 64 1HB SER 64 -3.178 -0.824 -13.489 487 HG SER 64 HG SER 64 -1.230 1.194 -13.874 488 H THR 65 H THR 65 -3.303 -0.785 -17.682 489 HA THR 65 HA THR 65 -5.386 -2.521 -17.232 490 HB THR 65 HB THR 65 -4.737 -3.345 -19.690 491 HG1 THR 65 1HG THR 65 -3.447 -0.837 -19.630 492 HG21 THR 65 3HG2 THR 65 -5.724 -1.234 -20.623 493 HG22 THR 65 1HG2 THR 65 -5.771 -0.619 -18.969 494 HG23 THR 65 2HG2 THR 65 -6.693 -2.058 -19.403 495 H GLU 66 H GLU 66 -1.983 -3.188 -17.728 496 HA GLU 66 HA GLU 66 -2.321 -6.048 -17.606 497 HB2 GLU 66 2HB GLU 66 0.151 -6.120 -17.570 498 HB3 GLU 66 1HB GLU 66 -0.463 -5.158 -18.916 499 HG2 GLU 66 2HG GLU 66 -0.011 -3.552 -16.562 500 HG3 GLU 66 1HG GLU 66 1.448 -4.402 -17.066 501 H ILE 67 H ILE 67 -1.609 -3.374 -15.481 502 HA ILE 67 HA ILE 67 -0.756 -4.965 -13.270 503 HB ILE 67 HB ILE 67 -1.907 -2.175 -13.289 504 HG12 ILE 67 2HG1 ILE 67 0.957 -3.156 -13.244 505 HG13 ILE 67 1HG1 ILE 67 0.152 -2.361 -14.604 506 HG21 ILE 67 1HG2 ILE 67 -0.306 -2.342 -11.092 507 HG22 ILE 67 2HG2 ILE 67 -1.032 -3.947 -11.131 508 HG23 ILE 67 3HG2 ILE 67 -2.061 -2.515 -11.078 509 HD11 ILE 67 3HD1 ILE 67 0.894 -0.431 -13.823 510 HD12 ILE 67 1HD1 ILE 67 1.524 -1.209 -12.371 511 HD13 ILE 67 2HD1 ILE 67 -0.145 -0.640 -12.414 512 H SER 68 H SER 68 -3.772 -4.471 -14.761 513 HA SER 68 HA SER 68 -5.504 -4.583 -12.533 514 HB2 SER 68 2HB SER 68 -5.841 -4.339 -15.257 515 HB3 SER 68 1HB SER 68 -6.481 -5.952 -14.943 516 HG SER 68 HG SER 68 -7.381 -3.464 -14.039 517 H GLU 69 H GLU 69 -3.755 -7.007 -14.325 518 HA GLU 69 HA GLU 69 -4.967 -9.143 -12.713 519 HB2 GLU 69 2HB GLU 69 -3.426 -10.519 -14.421 520 HB3 GLU 69 1HB GLU 69 -5.065 -10.021 -14.816 521 HG2 GLU 69 2HG GLU 69 -4.161 -8.037 -15.959 522 HG3 GLU 69 1HG GLU 69 -2.530 -8.608 -15.612 523 H LEU 70 H LEU 70 -1.991 -7.515 -13.487 524 HA LEU 70 HA LEU 70 -0.131 -9.196 -12.229 525 HB2 LEU 70 2HB LEU 70 -0.144 -6.746 -13.558 526 HB3 LEU 70 1HB LEU 70 0.468 -6.365 -11.949 527 HG LEU 70 HG LEU 70 1.632 -8.532 -13.695 528 HD11 LEU 70 1HD1 LEU 70 1.696 -6.264 -14.737 529 HD12 LEU 70 2HD1 LEU 70 3.283 -6.964 -14.404 530 HD13 LEU 70 3HD1 LEU 70 2.625 -5.718 -13.341 531 HD21 LEU 70 3HD2 LEU 70 3.586 -7.579 -12.037 532 HD22 LEU 70 1HD2 LEU 70 2.616 -9.020 -11.736 533 HD23 LEU 70 2HD2 LEU 70 2.156 -7.482 -11.008 534 H SER 71 H SER 71 -2.121 -6.571 -11.069 535 HA SER 71 HA SER 71 -1.190 -6.008 -8.587 536 HB2 SER 71 2HB SER 71 -3.876 -6.009 -9.810 537 HB3 SER 71 1HB SER 71 -3.827 -5.966 -8.048 538 HG SER 71 HG SER 71 -2.781 -4.119 -9.899 539 H HIS 72 H HIS 72 -2.282 -9.098 -9.517 540 HA HIS 72 HA HIS 72 -3.463 -10.132 -7.251 541 HB2 HIS 72 2HB HIS 72 -1.716 -11.327 -9.381 542 HB3 HIS 72 1HB HIS 72 -2.206 -12.308 -7.992 543 HD1 HIS 72 1HD HIS 72 -5.125 -11.276 -7.737 544 HD2 HIS 72 2HD HIS 72 -3.325 -12.433 -11.298 545 HE1 HIS 72 1HE HIS 72 -7.015 -11.898 -9.274 546 HE2 HIS 72 2HE HIS 72 -5.905 -12.527 -11.446 547 H ASN 73 H ASN 73 -0.345 -8.896 -7.638 548 HA ASN 73 HA ASN 73 1.076 -10.437 -5.741 549 HB2 ASN 73 2HB ASN 73 1.493 -7.673 -6.889 550 HB3 ASN 73 1HB ASN 73 2.657 -8.500 -5.859 551 HD21 ASN 73 1HD2 ASN 73 1.642 -7.973 -8.987 552 HD22 ASN 73 2HD2 ASN 73 2.508 -9.263 -9.766 553 H PHE 74 H PHE 74 -0.820 -7.456 -5.525 554 HA PHE 74 HA PHE 74 -0.776 -7.662 -2.622 555 HB2 PHE 74 2HB PHE 74 -0.076 -5.287 -4.321 556 HB3 PHE 74 1HB PHE 74 -0.695 -5.099 -2.684 557 HD1 PHE 74 1HD PHE 74 1.951 -6.872 -4.593 558 HD2 PHE 74 2HD PHE 74 0.778 -5.130 -0.892 559 HE1 PHE 74 1HE PHE 74 4.209 -7.266 -3.697 560 HE2 PHE 74 2HE PHE 74 3.035 -5.516 0.009 561 HZ PHE 74 HZ PHE 74 4.751 -6.590 -1.394 562 H VAL 75 H VAL 75 -2.510 -5.737 -1.852 563 HA VAL 75 HA VAL 75 -4.786 -6.011 -3.697 564 HB VAL 75 HB VAL 75 -4.868 -7.759 -1.931 565 HG11 VAL 75 1HG1 VAL 75 -4.253 -7.029 0.104 566 HG12 VAL 75 2HG1 VAL 75 -5.961 -6.614 0.247 567 HG13 VAL 75 3HG1 VAL 75 -4.788 -5.377 -0.204 568 HG21 VAL 75 3HG2 VAL 75 -6.882 -7.308 -3.052 569 HG22 VAL 75 1HG2 VAL 75 -7.082 -5.757 -2.242 570 HG23 VAL 75 2HG2 VAL 75 -7.293 -7.253 -1.339 571 H MET 76 H MET 76 -6.349 -4.604 -3.711 572 HA MET 76 HA MET 76 -6.181 -2.007 -3.699 573 HB2 MET 76 2HB MET 76 -8.635 -2.003 -3.415 574 HB3 MET 76 1HB MET 76 -8.064 -3.217 -4.538 575 HG2 MET 76 2HG MET 76 -8.164 -4.290 -1.881 576 HG3 MET 76 1HG MET 76 -9.706 -3.568 -2.296 577 HE1 MET 76 3HE MET 76 -8.293 -6.272 -5.668 578 HE2 MET 76 1HE MET 76 -7.070 -6.049 -4.425 579 HE3 MET 76 2HE MET 76 -7.730 -4.654 -5.268 580 H VAL 77 H VAL 77 -5.007 -1.042 -1.846 581 HA VAL 77 HA VAL 77 -6.888 -0.463 0.317 582 HB VAL 77 HB VAL 77 -4.001 -1.054 0.940 583 HG11 VAL 77 1HG1 VAL 77 -5.704 0.483 2.325 584 HG12 VAL 77 2HG1 VAL 77 -4.472 -0.520 3.090 585 HG13 VAL 77 3HG1 VAL 77 -6.135 -1.097 2.981 586 HG21 VAL 77 3HG2 VAL 77 -5.424 -2.989 2.188 587 HG22 VAL 77 1HG2 VAL 77 -4.608 -3.194 0.639 588 HG23 VAL 77 2HG2 VAL 77 -6.328 -2.816 0.685 589 H ASN 78 H ASN 78 -6.949 1.383 -1.262 590 HA ASN 78 HA ASN 78 -4.785 3.309 -1.084 591 HB2 ASN 78 2HB ASN 78 -6.299 2.794 -3.114 592 HB3 ASN 78 1HB ASN 78 -7.498 3.769 -2.289 593 HD21 ASN 78 1HD2 ASN 78 -5.073 5.412 -1.257 594 HD22 ASN 78 2HD2 ASN 78 -4.764 6.475 -2.585 595 H LEU 79 H LEU 79 -4.688 4.230 0.917 596 HA LEU 79 HA LEU 79 -7.181 5.113 2.169 597 HB2 LEU 79 2HB LEU 79 -5.870 3.932 3.694 598 HB3 LEU 79 1HB LEU 79 -4.390 4.700 3.167 599 HG LEU 79 HG LEU 79 -5.132 6.812 4.221 600 HD11 LEU 79 1HD1 LEU 79 -7.170 7.132 5.096 601 HD12 LEU 79 2HD1 LEU 79 -7.230 5.517 5.802 602 HD13 LEU 79 3HD1 LEU 79 -7.637 5.752 4.103 603 HD21 LEU 79 3HD2 LEU 79 -5.424 4.979 6.477 604 HD22 LEU 79 1HD2 LEU 79 -4.188 6.195 6.153 605 HD23 LEU 79 2HD2 LEU 79 -4.066 4.595 5.420 606 H GLU 80 H GLU 80 -7.589 7.229 2.783 607 HA GLU 80 HA GLU 80 -5.704 9.306 1.995 608 HB2 GLU 80 2HB GLU 80 -7.735 8.563 0.261 609 HB3 GLU 80 1HB GLU 80 -8.404 9.968 1.100 610 HG2 GLU 80 2HG GLU 80 -6.474 11.294 0.459 611 HG3 GLU 80 1HG GLU 80 -5.753 9.884 -0.338 612 H ASP 81 H ASP 81 -7.233 11.518 2.306 613 HA ASP 81 HA ASP 81 -7.375 11.821 5.085 614 HB2 ASP 81 2HB ASP 81 -8.397 14.002 4.615 615 HB3 ASP 81 1HB ASP 81 -7.033 13.700 3.544 616 H GLU 82 H GLU 82 -9.715 10.682 2.799 617 HA GLU 82 HA GLU 82 -12.111 11.228 4.078 618 HB2 GLU 82 2HB GLU 82 -11.183 9.038 2.270 619 HB3 GLU 82 1HB GLU 82 -12.761 8.897 3.033 620 HG2 GLU 82 2HG GLU 82 -13.001 11.371 2.095 621 HG3 GLU 82 1HG GLU 82 -11.821 10.762 0.935 622 H GLU 83 H GLU 83 -9.653 8.891 4.878 623 HA GLU 83 HA GLU 83 -11.299 8.009 7.158 624 HB2 GLU 83 2HB GLU 83 -9.782 6.453 5.172 625 HB3 GLU 83 1HB GLU 83 -9.515 5.968 6.842 626 HG2 GLU 83 2HG GLU 83 -11.896 5.631 7.152 627 HG3 GLU 83 1HG GLU 83 -12.204 6.186 5.503 628 H GLU 84 H GLU 84 -10.376 9.684 8.434 629 HA GLU 84 HA GLU 84 -7.746 10.334 8.799 630 HB2 GLU 84 2HB GLU 84 -10.186 10.545 10.363 631 HB3 GLU 84 1HB GLU 84 -8.771 10.366 11.387 632 HG2 GLU 84 2HG GLU 84 -7.822 12.341 10.649 633 HG3 GLU 84 1HG GLU 84 -8.772 12.360 9.164 634 HA PRO 85 HA PRO 85 -6.355 6.231 10.190 635 HB2 PRO 85 2HB PRO 85 -3.695 7.271 9.544 636 HB3 PRO 85 1HB PRO 85 -4.554 5.881 8.855 637 HG2 PRO 85 2HG PRO 85 -4.114 8.142 7.443 638 HG3 PRO 85 1HG PRO 85 -5.579 7.156 7.228 639 HD2 PRO 85 2HD PRO 85 -5.210 9.689 8.803 640 HD3 PRO 85 1HD PRO 85 -6.533 9.229 7.700 641 H LYS 86 H LYS 86 -4.612 9.248 10.855 642 HA LYS 86 HA LYS 86 -3.638 10.074 12.739 643 HB2 LYS 86 2HB LYS 86 -6.100 9.129 13.508 644 HB3 LYS 86 1HB LYS 86 -5.017 8.303 14.633 645 HG2 LYS 86 2HG LYS 86 -4.237 10.316 15.533 646 HG3 LYS 86 1HG LYS 86 -4.858 11.264 14.181 647 HD2 LYS 86 2HD LYS 86 -6.976 11.308 15.006 648 HD3 LYS 86 1HD LYS 86 -6.834 9.713 15.748 649 HE2 LYS 86 2HE LYS 86 -5.255 10.796 17.417 650 HE3 LYS 86 1HE LYS 86 -5.803 12.344 16.777 651 HZ1 LYS 86 3HZ LYS 86 -6.973 11.067 18.807 652 HZ2 LYS 86 1HZ LYS 86 -7.910 10.499 17.517 653 HZ3 LYS 86 2HZ LYS 86 -7.778 12.162 17.798 654 H ASP 87 H ASP 87 -2.600 7.597 11.430 655 HA ASP 87 HA ASP 87 -0.929 6.688 13.673 656 HB2 ASP 87 2HB ASP 87 -2.520 5.080 11.758 657 HB3 ASP 87 1HB ASP 87 -0.879 4.500 12.090 658 H GLU 88 H GLU 88 1.227 6.293 13.208 659 HA GLU 88 HA GLU 88 2.438 7.872 11.265 660 HB2 GLU 88 2HB GLU 88 3.332 5.747 13.122 661 HB3 GLU 88 1HB GLU 88 4.395 6.089 11.763 662 HG2 GLU 88 2HG GLU 88 3.417 8.083 13.795 663 HG3 GLU 88 1HG GLU 88 5.029 7.371 13.723 664 H ASP 89 H ASP 89 0.956 4.819 10.889 665 HA ASP 89 HA ASP 89 2.414 3.525 8.970 666 HB2 ASP 89 2HB ASP 89 -0.473 3.682 9.629 667 HB3 ASP 89 1HB ASP 89 -0.062 3.013 8.044 668 H PHE 90 H PHE 90 0.637 6.503 8.592 669 HA PHE 90 HA PHE 90 0.682 6.362 5.702 670 HB2 PHE 90 2HB PHE 90 -0.149 8.780 5.906 671 HB3 PHE 90 1HB PHE 90 -1.208 7.497 6.502 672 HD1 PHE 90 1HD PHE 90 1.660 9.414 7.972 673 HD2 PHE 90 2HD PHE 90 -2.396 8.179 8.324 674 HE1 PHE 90 1HE PHE 90 1.502 10.565 10.138 675 HE2 PHE 90 2HE PHE 90 -2.563 9.331 10.491 676 HZ PHE 90 HZ PHE 90 -0.611 10.525 11.401 677 H SER 91 H SER 91 2.836 7.353 8.138 678 HA SER 91 HA SER 91 4.784 8.172 6.217 679 HB2 SER 91 2HB SER 91 4.083 10.311 8.219 680 HB3 SER 91 1HB SER 91 5.021 10.453 6.721 681 HG SER 91 HG SER 91 3.223 10.653 5.610 682 HA PRO 92 HA PRO 92 6.415 6.706 10.317 683 HB2 PRO 92 2HB PRO 92 6.851 4.124 9.837 684 HB3 PRO 92 1HB PRO 92 5.221 4.713 10.222 685 HG2 PRO 92 2HG PRO 92 6.395 3.952 7.583 686 HG3 PRO 92 1HG PRO 92 4.755 3.690 8.200 687 HD2 PRO 92 2HD PRO 92 5.556 5.757 6.486 688 HD3 PRO 92 1HD PRO 92 4.044 5.696 7.405 689 H ASP 93 H ASP 93 7.693 7.871 7.851 690 HA ASP 93 HA ASP 93 10.374 6.862 8.386 691 HB2 ASP 93 2HB ASP 93 10.742 7.055 5.781 692 HB3 ASP 93 1HB ASP 93 10.116 5.562 6.501 693 H GLY 94 H GLY 94 8.851 9.060 6.009 694 HA2 GLY 94 2HA GLY 94 10.845 11.086 6.729 695 HA3 GLY 94 1HA GLY 94 9.834 11.093 5.281 696 H GLY 95 H GLY 95 8.692 12.926 5.365 697 HA2 GLY 95 2HA GLY 95 6.916 13.309 7.659 698 HA3 GLY 95 1HA GLY 95 8.029 14.623 7.269 699 H TYR 96 H TYR 96 6.796 12.746 4.645 700 HA TYR 96 HA TYR 96 5.600 15.021 3.440 701 HB2 TYR 96 2HB TYR 96 4.718 13.271 1.783 702 HB3 TYR 96 1HB TYR 96 6.471 13.420 1.943 703 HD1 TYR 96 2HD TYR 96 4.340 11.698 4.415 704 HD2 TYR 96 1HD TYR 96 6.989 11.225 1.121 705 HE1 TYR 96 2HE TYR 96 4.485 9.305 4.882 706 HE2 TYR 96 1HE TYR 96 7.132 8.808 1.585 707 HH TYR 96 HH TYR 96 5.207 7.328 4.172 708 H ILE 97 H ILE 97 3.213 14.197 2.344 709 HA ILE 97 HA ILE 97 1.449 13.290 4.440 710 HB ILE 97 HB ILE 97 0.020 15.370 4.252 711 HG12 ILE 97 2HG1 ILE 97 2.368 17.001 3.635 712 HG13 ILE 97 1HG1 ILE 97 1.828 16.014 2.274 713 HG21 ILE 97 1HG2 ILE 97 2.730 15.748 5.516 714 HG22 ILE 97 2HG2 ILE 97 1.410 14.814 6.223 715 HG23 ILE 97 3HG2 ILE 97 1.225 16.550 5.966 716 HD11 ILE 97 3HD1 ILE 97 0.047 17.859 3.840 717 HD12 ILE 97 1HD1 ILE 97 -0.351 16.981 2.361 718 HD13 ILE 97 2HD1 ILE 97 0.843 18.279 2.322 719 HA PRO 98 HA PRO 98 1.252 10.994 3.638 720 HB2 PRO 98 2HB PRO 98 -1.444 10.201 2.465 721 HB3 PRO 98 1HB PRO 98 -0.563 9.407 3.800 722 HG2 PRO 98 2HG PRO 98 -2.192 11.750 3.908 723 HG3 PRO 98 1HG PRO 98 -1.264 10.981 5.230 724 HD2 PRO 98 2HD PRO 98 -0.469 13.318 4.441 725 HD3 PRO 98 1HD PRO 98 0.752 12.035 4.574 726 H ARG 99 H ARG 99 1.972 8.945 2.710 727 HA ARG 99 HA ARG 99 2.121 9.041 -0.226 728 HB2 ARG 99 2HB ARG 99 4.171 9.122 1.792 729 HB3 ARG 99 1HB ARG 99 4.433 7.775 0.680 730 HG2 ARG 99 2HG ARG 99 5.592 9.764 -0.043 731 HG3 ARG 99 1HG ARG 99 4.343 9.320 -1.202 732 HD2 ARG 99 2HD ARG 99 3.140 11.061 0.650 733 HD3 ARG 99 1HD ARG 99 4.701 11.772 0.251 734 HE ARG 99 HE ARG 99 3.237 10.906 -2.055 735 HH11 ARG 99 1HH1 ARG 99 3.608 13.507 0.241 736 HH12 ARG 99 2HH1 ARG 99 3.064 14.727 -0.861 737 HH21 ARG 99 1HH2 ARG 99 2.515 12.504 -3.503 738 HH22 ARG 99 2HH2 ARG 99 2.447 14.156 -2.987 739 H ILE 100 H ILE 100 3.539 6.782 -0.719 740 HA ILE 100 HA ILE 100 1.552 4.718 -0.126 741 HB ILE 100 HB ILE 100 3.847 4.353 -2.016 742 HG12 ILE 100 2HG1 ILE 100 1.541 5.170 -3.465 743 HG13 ILE 100 1HG1 ILE 100 1.852 6.394 -2.242 744 HG21 ILE 100 1HG2 ILE 100 2.820 2.390 -2.208 745 HG22 ILE 100 2HG2 ILE 100 1.536 3.249 -3.059 746 HG23 ILE 100 3HG2 ILE 100 1.403 2.959 -1.327 747 HD11 ILE 100 3HD1 ILE 100 3.533 7.205 -3.418 748 HD12 ILE 100 1HD1 ILE 100 3.080 6.101 -4.718 749 HD13 ILE 100 2HD1 ILE 100 4.289 5.615 -3.532 750 H LEU 101 H LEU 101 2.290 2.485 0.226 751 HA LEU 101 HA LEU 101 4.853 1.751 1.029 752 HB2 LEU 101 2HB LEU 101 4.288 1.580 3.541 753 HB3 LEU 101 1HB LEU 101 4.821 3.118 2.897 754 HG LEU 101 HG LEU 101 2.037 3.178 2.652 755 HD11 LEU 101 1HD1 LEU 101 1.063 2.250 4.440 756 HD12 LEU 101 2HD1 LEU 101 2.432 2.594 5.496 757 HD13 LEU 101 3HD1 LEU 101 2.478 1.198 4.419 758 HD21 LEU 101 3HD2 LEU 101 3.870 4.392 4.712 759 HD22 LEU 101 1HD2 LEU 101 2.198 4.878 4.444 760 HD23 LEU 101 2HD2 LEU 101 3.393 5.096 3.168 761 H PHE 102 H PHE 102 4.941 -0.447 1.841 762 HA PHE 102 HA PHE 102 2.392 -1.846 1.357 763 HB2 PHE 102 2HB PHE 102 5.123 -3.113 1.349 764 HB3 PHE 102 1HB PHE 102 3.627 -3.761 0.694 765 HD1 PHE 102 1HD PHE 102 5.939 -0.867 0.274 766 HD2 PHE 102 2HD PHE 102 3.196 -3.545 -1.563 767 HE1 PHE 102 1HE PHE 102 6.482 0.093 -1.923 768 HE2 PHE 102 2HE PHE 102 3.737 -2.595 -3.765 769 HZ PHE 102 HZ PHE 102 5.379 -0.772 -3.948 770 H LEU 103 H LEU 103 1.815 -3.677 2.660 771 HA LEU 103 HA LEU 103 3.158 -3.921 5.238 772 HB2 LEU 103 2HB LEU 103 1.293 -3.358 6.555 773 HB3 LEU 103 1HB LEU 103 1.472 -2.062 5.391 774 HG LEU 103 HG LEU 103 -0.578 -4.263 5.358 775 HD11 LEU 103 1HD1 LEU 103 -1.221 -2.595 6.885 776 HD12 LEU 103 2HD1 LEU 103 -2.114 -2.262 5.402 777 HD13 LEU 103 3HD1 LEU 103 -0.695 -1.300 5.814 778 HD21 LEU 103 3HD2 LEU 103 0.362 -2.404 3.249 779 HD22 LEU 103 1HD2 LEU 103 -1.372 -2.681 3.384 780 HD23 LEU 103 2HD2 LEU 103 -0.284 -4.041 3.120 781 H ASP 104 H ASP 104 2.267 -5.660 6.583 782 HA ASP 104 HA ASP 104 1.903 -8.034 5.097 783 HB2 ASP 104 2HB ASP 104 2.560 -7.379 7.732 784 HB3 ASP 104 1HB ASP 104 1.030 -8.262 7.861 785 HA PRO 105 HA PRO 105 -2.426 -8.228 4.332 786 HB2 PRO 105 2HB PRO 105 -2.860 -10.917 4.807 787 HB3 PRO 105 1HB PRO 105 -2.239 -10.237 3.292 788 HG2 PRO 105 2HG PRO 105 -0.760 -11.506 5.559 789 HG3 PRO 105 1HG PRO 105 -0.473 -11.637 3.807 790 HD2 PRO 105 2HD PRO 105 1.047 -10.077 5.384 791 HD3 PRO 105 1HD PRO 105 0.656 -9.618 3.718 792 H SER 106 H SER 106 -3.145 -7.001 6.072 793 HA SER 106 HA SER 106 -5.062 -7.949 7.707 794 HB2 SER 106 2HB SER 106 -2.417 -8.621 8.812 795 HB3 SER 106 1HB SER 106 -3.466 -7.753 9.949 796 HG SER 106 HG SER 106 -3.816 -9.982 10.097 797 H GLY 107 H GLY 107 -2.368 -5.790 7.332 798 HA2 GLY 107 2HA GLY 107 -2.914 -3.410 7.172 799 HA3 GLY 107 1HA GLY 107 -3.974 -3.640 8.568 800 H LYS 108 H LYS 108 -0.643 -4.801 8.018 801 HA LYS 108 HA LYS 108 0.165 -3.161 10.346 802 HB2 LYS 108 2HB LYS 108 1.805 -5.067 10.814 803 HB3 LYS 108 1HB LYS 108 0.110 -5.346 11.192 804 HG2 LYS 108 2HG LYS 108 0.947 -6.122 8.484 805 HG3 LYS 108 1HG LYS 108 1.654 -7.065 9.811 806 HD2 LYS 108 2HD LYS 108 -1.295 -6.515 9.711 807 HD3 LYS 108 1HD LYS 108 -0.594 -7.840 8.781 808 HE2 LYS 108 2HE LYS 108 -0.656 -9.107 10.605 809 HE3 LYS 108 1HE LYS 108 0.491 -8.012 11.375 810 HZ1 LYS 108 3HZ LYS 108 -1.776 -6.665 11.710 811 HZ2 LYS 108 1HZ LYS 108 -1.181 -7.777 12.840 812 HZ3 LYS 108 2HZ LYS 108 -2.379 -8.245 11.741 813 H VAL 109 H VAL 109 0.864 -1.587 8.731 814 HA VAL 109 HA VAL 109 2.734 -1.970 6.736 815 HB VAL 109 HB VAL 109 2.269 0.392 8.548 816 HG11 VAL 109 1HG1 VAL 109 3.916 0.230 6.041 817 HG12 VAL 109 2HG1 VAL 109 4.509 0.528 7.673 818 HG13 VAL 109 3HG1 VAL 109 3.478 1.717 6.883 819 HG21 VAL 109 3HG2 VAL 109 0.382 -0.275 7.112 820 HG22 VAL 109 1HG2 VAL 109 1.423 -0.113 5.698 821 HG23 VAL 109 2HG2 VAL 109 1.033 1.303 6.674 822 H HIS 110 H HIS 110 4.851 -2.080 6.574 823 HA HIS 110 HA HIS 110 6.452 -1.864 9.026 824 HB2 HIS 110 2HB HIS 110 7.778 -3.890 7.968 825 HB3 HIS 110 1HB HIS 110 6.384 -4.169 9.003 826 HD1 HIS 110 1HD HIS 110 4.789 -5.796 8.088 827 HD2 HIS 110 2HD HIS 110 6.873 -3.837 5.076 828 HE1 HIS 110 1HE HIS 110 4.019 -6.853 5.942 829 HE2 HIS 110 2HE HIS 110 5.174 -5.543 4.129 830 HA PRO 111 HA PRO 111 8.901 0.575 6.261 831 HB2 PRO 111 2HB PRO 111 11.175 0.731 7.744 832 HB3 PRO 111 1HB PRO 111 9.717 1.659 8.112 833 HG2 PRO 111 2HG PRO 111 10.706 -0.879 9.343 834 HG3 PRO 111 1HG PRO 111 9.996 0.542 10.129 835 HD2 PRO 111 2HD PRO 111 8.586 -1.723 9.638 836 HD3 PRO 111 1HD PRO 111 7.842 -0.105 9.631 837 H GLU 112 H GLU 112 8.778 -2.296 5.783 838 HA GLU 112 HA GLU 112 11.567 -2.975 5.185 839 HB2 GLU 112 2HB GLU 112 9.243 -4.494 5.893 840 HB3 GLU 112 1HB GLU 112 9.811 -5.030 4.317 841 HG2 GLU 112 2HG GLU 112 10.775 -6.314 6.177 842 HG3 GLU 112 1HG GLU 112 11.995 -5.495 5.203 843 H ILE 113 H ILE 113 8.412 -3.060 3.527 844 HA ILE 113 HA ILE 113 9.769 -2.895 0.955 845 HB ILE 113 HB ILE 113 6.800 -3.001 1.423 846 HG12 ILE 113 2HG1 ILE 113 7.312 -5.513 0.725 847 HG13 ILE 113 1HG1 ILE 113 8.866 -5.153 1.490 848 HG21 ILE 113 1HG2 ILE 113 6.656 -3.718 -0.840 849 HG22 ILE 113 2HG2 ILE 113 8.405 -3.907 -0.954 850 HG23 ILE 113 3HG2 ILE 113 7.700 -2.297 -0.813 851 HD11 ILE 113 3HD1 ILE 113 7.992 -5.202 3.547 852 HD12 ILE 113 1HD1 ILE 113 6.684 -6.101 2.778 853 HD13 ILE 113 2HD1 ILE 113 6.518 -4.368 3.055 854 H ILE 114 H ILE 114 10.479 -0.910 0.590 855 HA ILE 114 HA ILE 114 8.818 1.403 1.208 856 HB ILE 114 HB ILE 114 10.938 2.610 0.268 857 HG12 ILE 114 2HG1 ILE 114 11.797 0.176 -0.396 858 HG13 ILE 114 1HG1 ILE 114 12.908 1.452 0.078 859 HG21 ILE 114 1HG2 ILE 114 10.424 1.367 2.901 860 HG22 ILE 114 2HG2 ILE 114 10.608 3.064 2.461 861 HG23 ILE 114 3HG2 ILE 114 12.032 2.041 2.633 862 HD11 ILE 114 3HD1 ILE 114 13.352 0.467 2.110 863 HD12 ILE 114 1HD1 ILE 114 13.137 -0.935 1.060 864 HD13 ILE 114 2HD1 ILE 114 11.830 -0.424 2.132 865 H ASN 115 H ASN 115 11.005 0.980 -1.534 866 HA ASN 115 HA ASN 115 9.132 0.769 -3.566 867 HB2 ASN 115 2HB ASN 115 8.502 2.870 -4.139 868 HB3 ASN 115 1HB ASN 115 8.892 3.240 -2.457 869 HD21 ASN 115 1HD2 ASN 115 8.892 4.900 -4.886 870 HD22 ASN 115 2HD2 ASN 115 10.490 5.584 -4.985 871 H GLU 116 H GLU 116 12.245 1.875 -2.454 872 HA GLU 116 HA GLU 116 14.344 1.595 -3.229 873 HB2 GLU 116 2HB GLU 116 12.943 -0.390 -5.013 874 HB3 GLU 116 1HB GLU 116 14.698 -0.174 -4.999 875 HG2 GLU 116 2HG GLU 116 13.119 -0.805 -2.526 876 HG3 GLU 116 1HG GLU 116 13.756 -2.056 -3.586 877 H ASN 117 H ASN 117 12.304 1.487 -6.169 878 HA ASN 117 HA ASN 117 14.012 2.699 -7.925 879 HB2 ASN 117 2HB ASN 117 11.674 1.761 -8.358 880 HB3 ASN 117 1HB ASN 117 11.070 3.356 -7.886 881 HD21 ASN 117 1HD2 ASN 117 13.478 1.862 -10.027 882 HD22 ASN 117 2HD2 ASN 117 13.221 2.961 -11.357 883 H GLY 118 H GLY 118 12.348 4.187 -5.268 884 HA2 GLY 118 2HA GLY 118 12.584 6.877 -6.248 885 HA3 GLY 118 1HA GLY 118 12.150 6.392 -4.605 886 H ASN 119 H ASN 119 13.581 8.443 -4.449 887 HA ASN 119 HA ASN 119 16.433 7.839 -4.470 888 HB2 ASN 119 2HB ASN 119 16.609 10.266 -3.732 889 HB3 ASN 119 1HB ASN 119 15.891 10.004 -5.327 890 HD21 ASN 119 1HD2 ASN 119 13.692 10.352 -5.620 891 HD22 ASN 119 2HD2 ASN 119 12.744 11.263 -4.474 892 HA PRO 120 HA PRO 120 16.721 7.115 -0.120 893 HB2 PRO 120 2HB PRO 120 19.067 8.242 0.576 894 HB3 PRO 120 1HB PRO 120 18.982 6.817 -0.480 895 HG2 PRO 120 2HG PRO 120 19.365 9.700 -1.204 896 HG3 PRO 120 1HG PRO 120 20.190 8.261 -1.844 897 HD2 PRO 120 2HD PRO 120 18.127 9.523 -3.122 898 HD3 PRO 120 1HD PRO 120 18.490 7.790 -3.310 899 H SER 121 H SER 121 14.924 9.117 -0.468 900 HA SER 121 HA SER 121 15.011 10.514 1.978 901 HB2 SER 121 2HB SER 121 16.002 11.927 -0.438 902 HB3 SER 121 1HB SER 121 14.828 12.813 0.549 903 HG SER 121 HG SER 121 17.125 11.564 1.643 904 H TYR 122 H TYR 122 13.322 8.785 0.468 905 HA TYR 122 HA TYR 122 10.836 10.124 0.769 906 HB2 TYR 122 2HB TYR 122 12.120 10.209 -1.816 907 HB3 TYR 122 1HB TYR 122 10.603 9.309 -1.912 908 HD1 TYR 122 1HD TYR 122 8.592 10.527 -0.596 909 HD2 TYR 122 2HD TYR 122 12.023 12.468 -2.194 910 HE1 TYR 122 1HE TYR 122 7.351 12.648 -0.666 911 HE2 TYR 122 2HE TYR 122 10.794 14.595 -2.267 912 HH TYR 122 HH TYR 122 8.893 15.661 -1.276 913 H LYS 123 H LYS 123 12.340 7.497 -1.082 914 HA LYS 123 HA LYS 123 11.780 5.298 -1.349 915 HB2 LYS 123 2HB LYS 123 11.641 5.845 1.581 916 HB3 LYS 123 1HB LYS 123 11.168 4.259 1.001 917 HG2 LYS 123 2HG LYS 123 13.840 5.600 0.655 918 HG3 LYS 123 1HG LYS 123 13.466 4.182 1.651 919 HD2 LYS 123 2HD LYS 123 14.187 3.019 -0.135 920 HD3 LYS 123 1HD LYS 123 12.583 3.373 -0.794 921 HE2 LYS 123 2HE LYS 123 13.410 4.753 -2.354 922 HE3 LYS 123 1HE LYS 123 14.528 5.513 -1.222 923 HZ1 LYS 123 3HZ LYS 123 16.120 4.428 -2.302 924 HZ2 LYS 123 1HZ LYS 123 15.017 3.468 -3.150 925 HZ3 LYS 123 2HZ LYS 123 15.537 3.000 -1.609 926 H TYR 124 H TYR 124 9.463 5.787 1.262 927 HA TYR 124 HA TYR 124 7.377 4.305 0.380 928 HB2 TYR 124 2HB TYR 124 7.475 6.840 1.977 929 HB3 TYR 124 1HB TYR 124 5.921 6.092 1.592 930 HD1 TYR 124 2HD TYR 124 9.065 4.252 2.304 931 HD2 TYR 124 1HD TYR 124 5.267 5.459 3.779 932 HE1 TYR 124 2HE TYR 124 9.327 2.723 4.209 933 HE2 TYR 124 1HE TYR 124 5.518 3.933 5.687 934 HH TYR 124 HH TYR 124 8.107 2.803 6.812 935 H PHE 125 H PHE 125 8.406 7.316 -1.007 936 HA PHE 125 HA PHE 125 5.910 7.621 -2.499 937 HB2 PHE 125 2HB PHE 125 6.725 9.665 -1.546 938 HB3 PHE 125 1HB PHE 125 8.345 9.387 -2.195 939 HD1 PHE 125 1HD PHE 125 8.786 9.715 -4.598 940 HD2 PHE 125 2HD PHE 125 4.994 10.604 -2.886 941 HE1 PHE 125 1HE PHE 125 8.209 11.046 -6.577 942 HE2 PHE 125 2HE PHE 125 4.408 11.934 -4.870 943 HZ PHE 125 HZ PHE 125 6.018 12.154 -6.721 944 H TYR 126 H TYR 126 5.705 6.771 -4.464 945 HA TYR 126 HA TYR 126 8.150 6.308 -6.040 946 HB2 TYR 126 2HB TYR 126 6.959 4.510 -7.219 947 HB3 TYR 126 1HB TYR 126 7.032 4.195 -5.483 948 HD1 TYR 126 1HD TYR 126 4.731 5.857 -7.937 949 HD2 TYR 126 2HD TYR 126 5.136 3.361 -4.519 950 HE1 TYR 126 1HE TYR 126 2.297 5.522 -7.902 951 HE2 TYR 126 2HE TYR 126 2.705 3.013 -4.483 952 HH TYR 126 HH TYR 126 0.749 3.371 -6.790 953 H VAL 127 H VAL 127 8.228 7.085 -8.122 954 HA VAL 127 HA VAL 127 5.892 8.670 -8.959 955 HB VAL 127 HB VAL 127 7.921 9.948 -8.078 956 HG11 VAL 127 1HG1 VAL 127 9.873 10.054 -9.189 957 HG12 VAL 127 2HG1 VAL 127 9.116 9.840 -10.768 958 HG13 VAL 127 3HG1 VAL 127 9.396 8.443 -9.728 959 HG21 VAL 127 3HG2 VAL 127 6.216 10.448 -10.374 960 HG22 VAL 127 1HG2 VAL 127 7.698 11.405 -10.386 961 HG23 VAL 127 2HG2 VAL 127 6.612 11.480 -8.997 962 H SER 128 H SER 128 5.541 6.465 -10.003 963 HA SER 128 HA SER 128 5.510 6.581 -12.686 964 HB2 SER 128 2HB SER 128 8.237 6.037 -11.839 965 HB3 SER 128 1HB SER 128 7.613 4.740 -12.869 966 HG SER 128 HG SER 128 7.425 6.112 -14.514 967 H ALA 129 H ALA 129 4.768 4.674 -13.704 968 HA ALA 129 HA ALA 129 3.603 2.772 -11.876 969 HB1 ALA 129 1HB ALA 129 2.065 3.147 -13.492 970 HB2 ALA 129 2HB ALA 129 2.908 1.813 -14.278 971 HB3 ALA 129 3HB ALA 129 3.280 3.478 -14.727 972 H GLU 130 H GLU 130 6.236 2.878 -14.162 973 HA GLU 130 HA GLU 130 6.657 0.127 -14.498 974 HB2 GLU 130 2HB GLU 130 7.712 2.157 -15.728 975 HB3 GLU 130 1HB GLU 130 8.921 2.099 -14.438 976 HG2 GLU 130 2HG GLU 130 8.406 -0.501 -15.659 977 HG3 GLU 130 1HG GLU 130 9.009 0.711 -16.801 978 H GLN 131 H GLN 131 7.549 2.305 -11.896 979 HA GLN 131 HA GLN 131 9.322 0.351 -10.726 980 HB2 GLN 131 2HB GLN 131 9.564 1.941 -8.879 981 HB3 GLN 131 1HB GLN 131 9.919 2.662 -10.442 982 HG2 GLN 131 2HG GLN 131 7.578 3.579 -10.420 983 HG3 GLN 131 1HG GLN 131 7.478 3.055 -8.740 984 HE21 GLN 131 1HE2 GLN 131 8.903 4.014 -7.208 985 HE22 GLN 131 2HE2 GLN 131 9.576 5.579 -7.490 986 H VAL 132 H VAL 132 6.136 1.753 -9.887 987 HA VAL 132 HA VAL 132 5.660 0.468 -7.519 988 HB VAL 132 HB VAL 132 3.407 0.823 -7.790 989 HG11 VAL 132 1HG1 VAL 132 3.946 2.632 -10.034 990 HG12 VAL 132 2HG1 VAL 132 5.006 2.808 -8.639 991 HG13 VAL 132 3HG1 VAL 132 3.261 2.962 -8.445 992 HG21 VAL 132 3HG2 VAL 132 2.774 -0.677 -9.454 993 HG22 VAL 132 1HG2 VAL 132 3.800 0.089 -10.664 994 HG23 VAL 132 2HG2 VAL 132 2.330 0.895 -10.120 995 H VAL 133 H VAL 133 5.765 -0.895 -10.718 996 HA VAL 133 HA VAL 133 4.678 -3.444 -9.905 997 HB VAL 133 HB VAL 133 4.264 -2.713 -12.177 998 HG11 VAL 133 1HG1 VAL 133 7.260 -2.624 -12.350 999 HG12 VAL 133 2HG1 VAL 133 6.110 -1.321 -12.648 1000 HG13 VAL 133 3HG1 VAL 133 6.226 -2.671 -13.779 1001 HG21 VAL 133 3HG2 VAL 133 5.077 -4.701 -13.396 1002 HG22 VAL 133 1HG2 VAL 133 4.415 -5.107 -11.811 1003 HG23 VAL 133 2HG2 VAL 133 6.163 -5.056 -12.050 1004 H GLN 134 H GLN 134 7.900 -2.037 -10.507 1005 HA GLN 134 HA GLN 134 9.271 -4.529 -10.420 1006 HB2 GLN 134 2HB GLN 134 11.271 -3.293 -10.346 1007 HB3 GLN 134 1HB GLN 134 10.168 -2.284 -11.265 1008 HG2 GLN 134 2HG GLN 134 9.868 -0.799 -9.460 1009 HG3 GLN 134 1HG GLN 134 10.623 -1.913 -8.326 1010 HE21 GLN 134 1HE2 GLN 134 12.919 -2.578 -9.108 1011 HE22 GLN 134 2HE2 GLN 134 13.946 -1.241 -9.553 1012 H GLY 135 H GLY 135 8.382 -2.160 -8.004 1013 HA2 GLY 135 2HA GLY 135 9.645 -3.497 -5.808 1014 HA3 GLY 135 1HA GLY 135 8.464 -2.182 -5.699 1015 H MET 136 H MET 136 6.607 -3.676 -7.471 1016 HA MET 136 HA MET 136 5.296 -5.213 -5.403 1017 HB2 MET 136 2HB MET 136 3.875 -3.842 -6.773 1018 HB3 MET 136 1HB MET 136 4.557 -4.513 -8.249 1019 HG2 MET 136 2HG MET 136 3.565 -6.682 -7.719 1020 HG3 MET 136 1HG MET 136 2.874 -6.003 -6.246 1021 HE1 MET 136 3HE MET 136 0.944 -5.143 -5.946 1022 HE2 MET 136 1HE MET 136 -0.036 -6.232 -6.929 1023 HE3 MET 136 2HE MET 136 -0.236 -4.484 -7.080 1024 H LYS 137 H LYS 137 7.315 -5.654 -8.117 1025 HA LYS 137 HA LYS 137 6.751 -8.417 -8.601 1026 HB2 LYS 137 2HB LYS 137 8.512 -6.311 -9.674 1027 HB3 LYS 137 1HB LYS 137 9.160 -7.934 -9.785 1028 HG2 LYS 137 2HG LYS 137 6.644 -6.847 -11.003 1029 HG3 LYS 137 1HG LYS 137 8.055 -7.515 -11.822 1030 HD2 LYS 137 2HD LYS 137 7.494 -9.708 -10.654 1031 HD3 LYS 137 1HD LYS 137 5.945 -8.967 -10.246 1032 HE2 LYS 137 2HE LYS 137 5.180 -9.071 -12.369 1033 HE3 LYS 137 1HE LYS 137 6.769 -8.767 -13.070 1034 HZ1 LYS 137 3HZ LYS 137 7.191 -11.172 -12.098 1035 HZ2 LYS 137 1HZ LYS 137 6.526 -10.934 -13.634 1036 HZ3 LYS 137 2HZ LYS 137 5.521 -11.298 -12.324 1037 H GLU 138 H GLU 138 8.657 -6.667 -6.376 1038 HA GLU 138 HA GLU 138 10.343 -8.999 -5.805 1039 HB2 GLU 138 2HB GLU 138 10.718 -6.102 -5.603 1040 HB3 GLU 138 1HB GLU 138 11.230 -6.974 -4.157 1041 HG2 GLU 138 2HG GLU 138 13.104 -6.728 -5.608 1042 HG3 GLU 138 1HG GLU 138 12.626 -8.433 -5.591 1043 H ALA 139 H ALA 139 8.539 -6.481 -4.076 1044 HA ALA 139 HA ALA 139 8.499 -7.648 -1.563 1045 HB1 ALA 139 1HB ALA 139 6.688 -6.198 -1.038 1046 HB2 ALA 139 2HB ALA 139 6.246 -6.040 -2.738 1047 HB3 ALA 139 3HB ALA 139 7.751 -5.335 -2.150 1048 H GLN 140 H GLN 140 6.695 -8.423 -4.418 1049 HA GLN 140 HA GLN 140 4.533 -9.778 -3.305 1050 HB2 GLN 140 2HB GLN 140 4.473 -10.959 -5.528 1051 HB3 GLN 140 1HB GLN 140 4.426 -9.201 -5.588 1052 HG2 GLN 140 2HG GLN 140 5.932 -9.621 -7.236 1053 HG3 GLN 140 1HG GLN 140 7.025 -9.478 -5.863 1054 HE21 GLN 140 1HE2 GLN 140 4.923 -12.106 -6.985 1055 HE22 GLN 140 2HE2 GLN 140 6.178 -13.286 -7.111 1056 H GLU 141 H GLU 141 7.827 -10.694 -3.292 1057 HA GLU 141 HA GLU 141 7.037 -13.438 -2.610 1058 HB2 GLU 141 2HB GLU 141 8.773 -14.382 -3.770 1059 HB3 GLU 141 1HB GLU 141 8.332 -13.026 -4.816 1060 HG2 GLU 141 2HG GLU 141 10.093 -11.717 -3.580 1061 HG3 GLU 141 1HG GLU 141 10.635 -13.259 -2.935 1062 H ARG 142 H ARG 142 9.112 -10.738 -1.838 1063 HA ARG 142 HA ARG 142 10.452 -12.183 0.281 1064 HB2 ARG 142 2HB ARG 142 11.509 -9.959 0.753 1065 HB3 ARG 142 1HB ARG 142 11.772 -10.572 -0.884 1066 HG2 ARG 142 2HG ARG 142 11.029 -8.638 -1.664 1067 HG3 ARG 142 1HG ARG 142 9.433 -9.048 -1.015 1068 HD2 ARG 142 2HD ARG 142 10.299 -6.824 -0.294 1069 HD3 ARG 142 1HD ARG 142 9.900 -7.918 1.039 1070 HE ARG 142 HE ARG 142 12.594 -7.136 0.165 1071 HH11 ARG 142 1HH1 ARG 142 10.536 -8.782 2.466 1072 HH12 ARG 142 2HH1 ARG 142 11.777 -8.908 3.664 1073 HH21 ARG 142 1HH2 ARG 142 14.220 -7.320 1.740 1074 HH22 ARG 142 2HH2 ARG 142 13.865 -8.084 3.253 1075 H LEU 143 H LEU 143 7.549 -10.431 -0.022 1076 HA LEU 143 HA LEU 143 7.439 -10.063 2.897 1077 HB2 LEU 143 2HB LEU 143 7.199 -7.919 2.190 1078 HB3 LEU 143 1HB LEU 143 6.533 -8.391 0.631 1079 HG LEU 143 HG LEU 143 4.378 -8.943 1.882 1080 HD11 LEU 143 1HD1 LEU 143 6.022 -7.782 4.060 1081 HD12 LEU 143 2HD1 LEU 143 4.771 -9.026 4.121 1082 HD13 LEU 143 3HD1 LEU 143 4.320 -7.326 3.983 1083 HD21 LEU 143 3HD2 LEU 143 3.620 -6.938 1.238 1084 HD22 LEU 143 1HD2 LEU 143 5.270 -6.674 0.673 1085 HD23 LEU 143 2HD2 LEU 143 4.770 -6.066 2.252 1086 H THR 144 H THR 144 6.043 -11.671 0.210 1087 HA THR 144 HA THR 144 3.448 -12.103 1.315 1088 HB THR 144 HB THR 144 3.435 -13.973 -0.434 1089 HG1 THR 144 1HG THR 144 5.692 -14.156 -0.653 1090 HG21 THR 144 3HG2 THR 144 3.212 -12.441 -2.311 1091 HG22 THR 144 1HG2 THR 144 3.945 -11.159 -1.348 1092 HG23 THR 144 2HG2 THR 144 2.387 -11.838 -0.876 1093 H GLY 145 H GLY 145 6.453 -13.307 2.220 1094 HA2 GLY 145 2HA GLY 145 5.149 -15.622 3.502 1095 HA3 GLY 145 1HA GLY 145 6.707 -15.796 2.711 1096 H ASP 146 H ASP 146 5.347 -13.381 4.966 1097 HA ASP 146 HA ASP 146 6.289 -12.380 6.802 1098 HB2 ASP 146 2HB ASP 146 6.318 -15.313 7.228 1099 HB3 ASP 146 1HB ASP 146 7.246 -14.349 8.371 1100 H ALA 147 H ALA 147 8.106 -12.607 4.531 1101 HA ALA 147 HA ALA 147 10.701 -13.067 5.801 1102 HB1 ALA 147 1HB ALA 147 10.960 -14.005 3.767 1103 HB2 ALA 147 2HB ALA 147 11.333 -12.351 3.281 1104 HB3 ALA 147 3HB ALA 147 9.714 -13.002 3.026 1105 H PHE 148 H PHE 148 9.095 -10.838 6.631 1106 HA PHE 148 HA PHE 148 10.857 -8.620 5.825 1107 HB2 PHE 148 2HB PHE 148 8.993 -7.086 5.951 1108 HB3 PHE 148 1HB PHE 148 8.538 -8.424 4.884 1109 HD1 PHE 148 2HD PHE 148 6.951 -10.131 5.648 1110 HD2 PHE 148 1HD PHE 148 7.870 -6.719 8.017 1111 HE1 PHE 148 2HE PHE 148 4.957 -10.554 7.026 1112 HE2 PHE 148 1HE PHE 148 5.881 -7.138 9.402 1113 HZ PHE 148 HZ PHE 148 4.421 -9.057 8.907 1114 H ARG 149 H ARG 149 8.716 -9.922 8.322 1115 HA ARG 149 HA ARG 149 9.139 -8.205 10.396 1116 HB2 ARG 149 2HB ARG 149 8.751 -11.185 10.345 1117 HB3 ARG 149 1HB ARG 149 8.829 -10.286 11.848 1118 HG2 ARG 149 2HG ARG 149 6.980 -8.823 10.674 1119 HG3 ARG 149 1HG ARG 149 6.722 -10.315 9.767 1120 HD2 ARG 149 2HD ARG 149 6.388 -11.545 11.827 1121 HD3 ARG 149 1HD ARG 149 6.736 -10.100 12.774 1122 HE ARG 149 HE ARG 149 4.268 -10.760 11.458 1123 HH11 ARG 149 1HH1 ARG 149 6.240 -8.165 12.706 1124 HH12 ARG 149 2HH1 ARG 149 4.903 -7.086 12.919 1125 HH21 ARG 149 1HH2 ARG 149 2.509 -9.343 11.738 1126 HH22 ARG 149 2HH2 ARG 149 2.784 -7.754 12.371 1127 H LYS 150 H LYS 150 10.774 -11.335 10.554 1128 HA LYS 150 HA LYS 150 12.877 -11.939 11.187 1129 HB2 LYS 150 2HB LYS 150 13.291 -9.922 9.414 1130 HB3 LYS 150 1HB LYS 150 14.069 -9.258 10.845 1131 HG2 LYS 150 2HG LYS 150 15.139 -11.701 10.891 1132 HG3 LYS 150 1HG LYS 150 14.837 -11.560 9.157 1133 HD2 LYS 150 2HD LYS 150 16.224 -9.680 8.955 1134 HD3 LYS 150 1HD LYS 150 16.216 -9.379 10.694 1135 HE2 LYS 150 2HE LYS 150 17.294 -11.982 9.779 1136 HE3 LYS 150 1HE LYS 150 18.260 -10.548 9.429 1137 HZ1 LYS 150 3HZ LYS 150 17.616 -11.773 11.998 1138 HZ2 LYS 150 1HZ LYS 150 17.721 -10.085 11.957 1139 HZ3 LYS 150 2HZ LYS 150 19.043 -11.026 11.484 1140 H LYS 151 H LYS 151 14.690 -11.295 12.787 1141 HA LYS 151 HA LYS 151 15.303 -10.768 14.912 1142 HB2 LYS 151 2HB LYS 151 13.656 -8.474 14.062 1143 HB3 LYS 151 1HB LYS 151 13.817 -8.666 15.802 1144 HG2 LYS 151 2HG LYS 151 16.392 -8.993 14.942 1145 HG3 LYS 151 1HG LYS 151 15.766 -7.779 13.824 1146 HD2 LYS 151 2HD LYS 151 15.155 -7.430 16.707 1147 HD3 LYS 151 1HD LYS 151 16.817 -7.141 16.188 1148 HE2 LYS 151 2HE LYS 151 15.473 -5.796 14.276 1149 HE3 LYS 151 1HE LYS 151 14.357 -5.614 15.628 1150 HZ1 LYS 151 3HZ LYS 151 16.255 -3.904 15.274 1151 HZ2 LYS 151 1HZ LYS 151 17.217 -5.070 16.036 1152 HZ3 LYS 151 2HZ LYS 151 15.877 -4.420 16.840 1153 H HIS 152 H HIS 152 14.783 -11.483 16.922 1154 HA HIS 152 HA HIS 152 12.196 -12.745 17.223 1155 HB2 HIS 152 2HB HIS 152 13.180 -13.649 19.336 1156 HB3 HIS 152 1HB HIS 152 14.108 -14.040 17.892 1157 HD1 HIS 152 1HD HIS 152 14.757 -10.615 18.743 1158 HD2 HIS 152 2HD HIS 152 16.145 -14.302 20.061 1159 HE1 HIS 152 1HE HIS 152 16.912 -10.133 19.934 1160 HE2 HIS 152 2HE HIS 152 17.692 -12.366 20.803 1161 H LEU 153 H LEU 153 10.909 -10.816 17.358 1162 HA LEU 153 HA LEU 153 10.972 -9.629 20.050 1163 HB2 LEU 153 2HB LEU 153 11.227 -8.305 17.505 1164 HB3 LEU 153 1HB LEU 153 9.778 -7.752 18.325 1165 HG LEU 153 HG LEU 153 11.653 -6.296 18.835 1166 HD11 LEU 153 1HD1 LEU 153 11.383 -6.186 21.166 1167 HD12 LEU 153 2HD1 LEU 153 11.102 -7.922 21.300 1168 HD13 LEU 153 3HD1 LEU 153 9.883 -6.887 20.559 1169 HD21 LEU 153 3HD2 LEU 153 13.082 -8.335 20.418 1170 HD22 LEU 153 1HD2 LEU 153 13.707 -6.978 19.481 1171 HD23 LEU 153 2HD2 LEU 153 13.228 -8.467 18.665 1172 H GLU 154 H GLU 154 8.853 -8.688 20.698 1173 HA GLU 154 HA GLU 154 6.629 -8.906 21.115 1174 HB2 GLU 154 2HB GLU 154 6.882 -8.999 18.228 1175 HB3 GLU 154 1HB GLU 154 5.509 -9.954 18.774 1176 HG2 GLU 154 2HG GLU 154 4.602 -8.043 19.944 1177 HG3 GLU 154 1HG GLU 154 6.012 -7.078 19.507 1178 H ASP 155 H ASP 155 5.907 -10.437 22.423 1179 HA ASP 155 HA ASP 155 6.359 -13.248 21.714 1180 HB2 ASP 155 2HB ASP 155 7.071 -12.110 23.975 1181 HB3 ASP 155 1HB ASP 155 5.385 -12.376 24.407 1182 H GLU 156 H GLU 156 4.692 -14.039 20.587 1183 HA GLU 156 HA GLU 156 2.029 -13.855 21.788 1184 HB2 GLU 156 2HB GLU 156 2.830 -12.582 19.329 1185 HB3 GLU 156 1HB GLU 156 1.601 -13.810 19.000 1186 HG2 GLU 156 2HG GLU 156 1.308 -11.658 21.085 1187 HG3 GLU 156 1HG GLU 156 0.726 -11.511 19.427 1188 H LEU 157 H LEU 157 3.739 -15.251 18.980 1189 HA LEU 157 HA LEU 157 2.321 -17.777 19.461 1190 HB2 LEU 157 2HB LEU 157 2.395 -16.523 17.176 1191 HB3 LEU 157 1HB LEU 157 4.000 -17.216 17.044 1192 HG LEU 157 HG LEU 157 2.430 -19.393 17.723 1193 HD11 LEU 157 1HD1 LEU 157 0.742 -19.079 15.688 1194 HD12 LEU 157 2HD1 LEU 157 0.838 -17.400 16.220 1195 HD13 LEU 157 3HD1 LEU 157 0.320 -18.654 17.346 1196 HD21 LEU 157 3HD2 LEU 157 2.812 -18.834 14.846 1197 HD22 LEU 157 1HD2 LEU 157 3.251 -20.253 15.797 1198 HD23 LEU 157 2HD2 LEU 157 4.256 -18.805 15.856 Start of MODEL 14 1 H1 MET 1 1HT MET 1 -26.071 -7.496 -27.889 2 H2 MET 1 2HT MET 1 -25.013 -7.570 -29.238 3 H3 MET 1 3HT MET 1 -25.290 -8.970 -28.285 4 HA MET 1 HA MET 1 -26.548 -9.295 -30.151 5 HB2 MET 1 2HB MET 1 -27.652 -9.095 -27.659 6 HB3 MET 1 1HB MET 1 -28.722 -8.058 -28.591 7 HG2 MET 1 2HG MET 1 -28.143 -10.597 -29.900 8 HG3 MET 1 1HG MET 1 -28.931 -10.775 -28.333 9 HE1 MET 1 2HE MET 1 -30.841 -9.976 -27.605 10 HE2 MET 1 3HE MET 1 -32.210 -10.420 -28.625 11 HE3 MET 1 1HE MET 1 -31.838 -8.721 -28.339 12 H HIS 2 H HIS 2 -26.708 -5.981 -29.025 13 HA HIS 2 HA HIS 2 -26.869 -4.907 -31.616 14 HB2 HIS 2 2HB HIS 2 -29.316 -5.857 -30.877 15 HB3 HIS 2 1HB HIS 2 -29.413 -4.193 -30.311 16 HD1 HIS 2 1HD HIS 2 -29.669 -6.246 -33.322 17 HD2 HIS 2 2HD HIS 2 -29.013 -2.242 -32.430 18 HE1 HIS 2 1HE HIS 2 -30.091 -5.004 -35.466 19 HE2 HIS 2 2HE HIS 2 -29.582 -2.594 -34.927 20 H HIS 3 H HIS 3 -27.224 -2.518 -31.578 21 HA HIS 3 HA HIS 3 -26.689 -0.459 -30.776 22 HB2 HIS 3 2HB HIS 3 -27.646 -1.660 -28.170 23 HB3 HIS 3 1HB HIS 3 -27.324 0.051 -28.425 24 HD1 HIS 3 1HD HIS 3 -28.901 1.234 -30.268 25 HD2 HIS 3 2HD HIS 3 -30.159 -2.465 -28.856 26 HE1 HIS 3 1HE HIS 3 -31.333 1.070 -30.885 27 HE2 HIS 3 2HE HIS 3 -32.096 -1.137 -29.939 28 H HIS 4 H HIS 4 -25.286 0.695 -29.054 29 HA HIS 4 HA HIS 4 -22.739 -0.635 -29.041 30 HB2 HIS 4 2HB HIS 4 -23.692 2.077 -28.149 31 HB3 HIS 4 1HB HIS 4 -22.057 1.525 -27.803 32 HD1 HIS 4 1HD HIS 4 -20.533 1.023 -29.934 33 HD2 HIS 4 2HD HIS 4 -24.087 3.040 -30.686 34 HE1 HIS 4 1HE HIS 4 -20.274 2.009 -32.232 35 HE2 HIS 4 2HE HIS 4 -22.471 3.147 -32.701 36 H HIS 5 H HIS 5 -21.411 -0.167 -26.866 37 HA HIS 5 HA HIS 5 -22.516 -1.947 -24.938 38 HB2 HIS 5 2HB HIS 5 -19.962 -0.899 -25.549 39 HB3 HIS 5 1HB HIS 5 -20.296 -0.457 -23.877 40 HD1 HIS 5 1HD HIS 5 -18.923 -3.119 -25.822 41 HD2 HIS 5 2HD HIS 5 -21.183 -2.892 -22.341 42 HE1 HIS 5 1HE HIS 5 -18.608 -5.332 -24.670 43 HE2 HIS 5 2HE HIS 5 -19.917 -5.140 -22.526 44 H HIS 6 H HIS 6 -21.699 1.520 -24.822 45 HA HIS 6 HA HIS 6 -22.478 3.225 -23.537 46 HB2 HIS 6 2HB HIS 6 -24.717 1.736 -24.280 47 HB3 HIS 6 1HB HIS 6 -24.914 1.986 -22.548 48 HD1 HIS 6 1HD HIS 6 -23.599 4.373 -25.205 49 HD2 HIS 6 2HD HIS 6 -26.624 4.075 -22.373 50 HE1 HIS 6 1HE HIS 6 -24.796 6.583 -25.266 51 HE2 HIS 6 2HE HIS 6 -26.574 6.408 -23.489 52 H HIS 7 H HIS 7 -21.303 3.531 -21.757 53 HA HIS 7 HA HIS 7 -21.884 1.845 -19.411 54 HB2 HIS 7 2HB HIS 7 -19.506 2.175 -18.732 55 HB3 HIS 7 1HB HIS 7 -19.689 1.250 -20.218 56 HD1 HIS 7 1HD HIS 7 -17.777 3.929 -18.847 57 HD2 HIS 7 2HD HIS 7 -19.362 3.083 -22.593 58 HE1 HIS 7 1HE HIS 7 -16.486 5.360 -20.462 59 HE2 HIS 7 2HE HIS 7 -17.404 4.765 -22.731 60 H MET 8 H MET 8 -22.781 2.972 -17.829 61 HA MET 8 HA MET 8 -22.244 5.860 -17.668 62 HB2 MET 8 2HB MET 8 -24.655 4.248 -17.384 63 HB3 MET 8 1HB MET 8 -24.409 5.325 -16.004 64 HG2 MET 8 2HG MET 8 -24.819 7.177 -17.208 65 HG3 MET 8 1HG MET 8 -24.029 6.548 -18.652 66 HE1 MET 8 3HE MET 8 -26.776 4.936 -16.476 67 HE2 MET 8 1HE MET 8 -28.258 5.223 -17.388 68 HE3 MET 8 2HE MET 8 -27.455 6.562 -16.568 69 H SER 9 H SER 9 -22.116 6.813 -15.516 70 HA SER 9 HA SER 9 -21.200 6.978 -13.443 71 HB2 SER 9 2HB SER 9 -23.102 5.075 -13.201 72 HB3 SER 9 1HB SER 9 -21.680 4.137 -12.746 73 HG SER 9 HG SER 9 -22.834 5.340 -11.025 74 H ASP 10 H ASP 10 -19.059 7.227 -13.551 75 HA ASP 10 HA ASP 10 -17.395 4.840 -13.997 76 HB2 ASP 10 2HB ASP 10 -17.352 7.125 -15.446 77 HB3 ASP 10 1HB ASP 10 -16.152 7.517 -14.219 78 H GLY 11 H GLY 11 -17.095 8.008 -12.369 79 HA2 GLY 11 2HA GLY 11 -15.247 6.948 -10.441 80 HA3 GLY 11 1HA GLY 11 -15.928 8.568 -10.452 81 H HIS 12 H HIS 12 -15.756 5.822 -8.695 82 HA HIS 12 HA HIS 12 -18.359 6.336 -7.410 83 HB2 HIS 12 2HB HIS 12 -18.026 4.081 -8.642 84 HB3 HIS 12 1HB HIS 12 -16.971 3.667 -7.282 85 HD1 HIS 12 1HD HIS 12 -20.570 4.585 -8.014 86 HD2 HIS 12 2HD HIS 12 -18.278 2.837 -5.022 87 HE1 HIS 12 1HE HIS 12 -22.219 3.691 -6.338 88 HE2 HIS 12 2HE HIS 12 -20.810 2.570 -4.575 89 H ASN 13 H ASN 13 -18.285 6.920 -5.345 90 HA ASN 13 HA ASN 13 -17.526 7.386 -3.256 91 HB2 ASN 13 2HB ASN 13 -16.000 4.880 -3.886 92 HB3 ASN 13 1HB ASN 13 -15.675 5.759 -2.397 93 HD21 ASN 13 1HD2 ASN 13 -17.449 6.096 -0.928 94 HD22 ASN 13 2HD2 ASN 13 -18.737 4.945 -0.868 95 H GLY 14 H GLY 14 -14.429 6.208 -4.518 96 HA2 GLY 14 2HA GLY 14 -13.164 8.364 -5.477 97 HA3 GLY 14 1HA GLY 14 -13.186 8.721 -3.747 98 H LEU 15 H LEU 15 -11.145 8.441 -3.100 99 HA LEU 15 HA LEU 15 -9.192 7.420 -2.548 100 HB2 LEU 15 2HB LEU 15 -11.002 5.092 -3.022 101 HB3 LEU 15 1HB LEU 15 -9.289 4.799 -2.800 102 HG LEU 15 HG LEU 15 -9.517 6.145 -0.627 103 HD11 LEU 15 1HD1 LEU 15 -11.991 6.724 -1.536 104 HD12 LEU 15 2HD1 LEU 15 -11.534 6.751 0.168 105 HD13 LEU 15 3HD1 LEU 15 -12.343 5.336 -0.508 106 HD21 LEU 15 3HD2 LEU 15 -9.151 3.988 -0.096 107 HD22 LEU 15 1HD2 LEU 15 -10.351 3.391 -1.241 108 HD23 LEU 15 2HD2 LEU 15 -10.863 4.004 0.332 109 H GLY 16 H GLY 16 -10.163 5.092 -5.038 110 HA2 GLY 16 2HA GLY 16 -7.919 6.052 -6.711 111 HA3 GLY 16 1HA GLY 16 -8.203 4.347 -6.406 112 H LYS 17 H LYS 17 -9.710 7.241 -7.783 113 HA LYS 17 HA LYS 17 -10.755 5.603 -9.959 114 HB2 LYS 17 2HB LYS 17 -12.979 6.704 -9.804 115 HB3 LYS 17 1HB LYS 17 -12.627 5.654 -8.440 116 HG2 LYS 17 2HG LYS 17 -13.220 7.344 -7.137 117 HG3 LYS 17 1HG LYS 17 -11.711 8.126 -7.613 118 HD2 LYS 17 2HD LYS 17 -12.800 9.698 -8.767 119 HD3 LYS 17 1HD LYS 17 -13.774 8.494 -9.612 120 HE2 LYS 17 2HE LYS 17 -15.536 8.819 -8.271 121 HE3 LYS 17 1HE LYS 17 -14.538 8.851 -6.819 122 HZ1 LYS 17 3HZ LYS 17 -13.871 11.180 -7.780 123 HZ2 LYS 17 1HZ LYS 17 -15.278 10.988 -6.858 124 HZ3 LYS 17 2HZ LYS 17 -15.375 11.062 -8.546 125 H GLY 18 H GLY 18 -8.975 6.731 -11.004 126 HA2 GLY 18 2HA GLY 18 -9.803 8.854 -12.601 127 HA3 GLY 18 1HA GLY 18 -8.920 9.556 -11.243 128 H PHE 19 H PHE 19 -7.156 7.116 -11.119 129 HA PHE 19 HA PHE 19 -5.427 7.911 -13.349 130 HB2 PHE 19 2HB PHE 19 -3.740 6.504 -11.772 131 HB3 PHE 19 1HB PHE 19 -4.002 8.244 -11.621 132 HD1 PHE 19 2HD PHE 19 -5.943 8.930 -9.998 133 HD2 PHE 19 1HD PHE 19 -3.936 5.176 -9.903 134 HE1 PHE 19 2HE PHE 19 -6.627 8.627 -7.655 135 HE2 PHE 19 1HE PHE 19 -4.615 4.870 -7.560 136 HZ PHE 19 HZ PHE 19 -5.962 6.596 -6.432 137 H GLY 20 H GLY 20 -5.484 4.928 -11.414 138 HA2 GLY 20 2HA GLY 20 -5.158 3.405 -13.883 139 HA3 GLY 20 1HA GLY 20 -4.967 2.790 -12.241 140 H ASP 21 H ASP 21 -6.556 1.682 -11.347 141 HA ASP 21 HA ASP 21 -9.292 2.004 -11.654 142 HB2 ASP 21 2HB ASP 21 -9.876 0.093 -13.128 143 HB3 ASP 21 1HB ASP 21 -8.981 1.349 -13.993 144 H HIS 22 H HIS 22 -9.523 -1.151 -11.798 145 HA HIS 22 HA HIS 22 -9.464 -1.565 -9.003 146 HB2 HIS 22 2HB HIS 22 -9.874 -3.927 -9.520 147 HB3 HIS 22 1HB HIS 22 -10.895 -2.896 -10.516 148 HD1 HIS 22 1HD HIS 22 -8.784 -5.755 -10.755 149 HD2 HIS 22 2HD HIS 22 -9.595 -2.508 -13.217 150 HE1 HIS 22 1HE HIS 22 -8.068 -6.463 -13.059 151 HE2 HIS 22 2HE HIS 22 -8.487 -4.451 -14.515 152 H ILE 23 H ILE 23 -7.375 -0.835 -8.410 153 HA ILE 23 HA ILE 23 -5.250 -2.800 -8.930 154 HB ILE 23 HB ILE 23 -4.942 0.197 -8.898 155 HG12 ILE 23 2HG1 ILE 23 -6.112 -0.848 -10.897 156 HG13 ILE 23 1HG1 ILE 23 -4.694 0.133 -11.246 157 HG21 ILE 23 1HG2 ILE 23 -2.716 -1.140 -10.050 158 HG22 ILE 23 2HG2 ILE 23 -3.027 -1.818 -8.452 159 HG23 ILE 23 3HG2 ILE 23 -2.777 -0.082 -8.645 160 HD11 ILE 23 3HD1 ILE 23 -4.575 -2.851 -10.988 161 HD12 ILE 23 1HD1 ILE 23 -3.371 -1.763 -11.677 162 HD13 ILE 23 2HD1 ILE 23 -4.901 -2.028 -12.515 163 H HIS 24 H HIS 24 -4.054 -0.151 -7.230 164 HA HIS 24 HA HIS 24 -4.029 -1.702 -4.798 165 HB2 HIS 24 2HB HIS 24 -2.699 0.962 -5.129 166 HB3 HIS 24 1HB HIS 24 -2.245 -0.384 -4.081 167 HD1 HIS 24 1HD HIS 24 -2.256 -2.598 -6.302 168 HD2 HIS 24 2HD HIS 24 -0.385 1.099 -6.599 169 HE1 HIS 24 1HE HIS 24 -0.444 -2.897 -8.018 170 HE2 HIS 24 2HE HIS 24 0.731 -0.671 -8.117 171 H TRP 25 H TRP 25 -6.424 -0.102 -5.859 172 HA TRP 25 HA TRP 25 -6.962 1.270 -3.325 173 HB2 TRP 25 2HB TRP 25 -8.485 2.704 -5.056 174 HB3 TRP 25 1HB TRP 25 -6.894 3.193 -4.475 175 HD1 TRP 25 HD TRP 25 -8.760 2.447 -7.574 176 HE1 TRP 25 1HE TRP 25 -7.177 2.492 -9.575 177 HE3 TRP 25 3HE TRP 25 -4.304 2.414 -5.104 178 HZ2 TRP 25 2HZ TRP 25 -4.395 2.516 -10.079 179 HZ3 TRP 25 3HZ TRP 25 -2.238 2.435 -6.404 180 HH2 TRP 25 HH TRP 25 -2.269 2.491 -8.841 181 H ARG 26 H ARG 26 -7.962 -1.098 -5.523 182 HA ARG 26 HA ARG 26 -10.560 -1.103 -5.926 183 HB2 ARG 26 2HB ARG 26 -9.290 -3.176 -6.072 184 HB3 ARG 26 1HB ARG 26 -9.216 -3.261 -4.312 185 HG2 ARG 26 2HG ARG 26 -10.835 -4.819 -5.280 186 HG3 ARG 26 1HG ARG 26 -11.572 -3.661 -4.176 187 HD2 ARG 26 2HD ARG 26 -11.475 -2.874 -7.011 188 HD3 ARG 26 1HD ARG 26 -12.531 -4.242 -6.631 189 HE ARG 26 HE ARG 26 -12.921 -2.007 -4.879 190 HH11 ARG 26 1HH1 ARG 26 -13.768 -3.348 -7.987 191 HH12 ARG 26 2HH1 ARG 26 -15.265 -2.484 -8.092 192 HH21 ARG 26 1HH2 ARG 26 -14.889 -0.870 -5.015 193 HH22 ARG 26 2HH2 ARG 26 -15.901 -1.076 -6.405 194 H THR 27 H THR 27 -9.367 -1.799 -2.636 195 HA THR 27 HA THR 27 -11.121 -0.134 -1.269 196 HB THR 27 HB THR 27 -12.459 -2.327 -0.337 197 HG1 THR 27 1HG THR 27 -11.939 -3.754 -1.872 198 HG21 THR 27 3HG2 THR 27 -14.007 -0.780 -0.707 199 HG22 THR 27 1HG2 THR 27 -14.150 -1.489 -2.315 200 HG23 THR 27 2HG2 THR 27 -13.118 -0.082 -2.061 201 H LEU 28 H LEU 28 -10.759 -0.150 0.936 202 HA LEU 28 HA LEU 28 -8.400 -1.533 1.793 203 HB2 LEU 28 2HB LEU 28 -9.079 0.812 2.456 204 HB3 LEU 28 1HB LEU 28 -10.291 0.076 3.504 205 HG LEU 28 HG LEU 28 -7.418 -0.716 3.792 206 HD11 LEU 28 1HD1 LEU 28 -6.770 1.164 4.849 207 HD12 LEU 28 2HD1 LEU 28 -8.376 1.479 5.504 208 HD13 LEU 28 3HD1 LEU 28 -8.005 1.909 3.835 209 HD21 LEU 28 3HD2 LEU 28 -8.950 -2.012 5.055 210 HD22 LEU 28 1HD2 LEU 28 -9.819 -0.578 5.601 211 HD23 LEU 28 2HD2 LEU 28 -8.185 -0.893 6.182 212 H GLU 29 H GLU 29 -11.633 -1.385 3.303 213 HA GLU 29 HA GLU 29 -11.365 -3.489 5.047 214 HB2 GLU 29 2HB GLU 29 -13.372 -1.810 4.477 215 HB3 GLU 29 1HB GLU 29 -13.991 -3.247 3.672 216 HG2 GLU 29 2HG GLU 29 -13.927 -4.492 5.720 217 HG3 GLU 29 1HG GLU 29 -13.121 -3.162 6.552 218 H ASP 30 H ASP 30 -12.644 -3.659 1.725 219 HA ASP 30 HA ASP 30 -13.076 -6.419 1.653 220 HB2 ASP 30 2HB ASP 30 -13.229 -4.260 -0.169 221 HB3 ASP 30 1HB ASP 30 -12.202 -5.485 -0.927 222 H GLY 31 H GLY 31 -10.172 -4.518 1.210 223 HA2 GLY 31 2HA GLY 31 -8.539 -6.470 0.021 224 HA3 GLY 31 1HA GLY 31 -7.968 -5.110 0.993 225 H LYS 32 H LYS 32 -9.471 -5.971 3.361 226 HA LYS 32 HA LYS 32 -7.480 -7.685 4.472 227 HB2 LYS 32 2HB LYS 32 -8.798 -5.857 5.673 228 HB3 LYS 32 1HB LYS 32 -10.128 -7.006 5.741 229 HG2 LYS 32 2HG LYS 32 -8.939 -8.465 7.145 230 HG3 LYS 32 1HG LYS 32 -7.404 -7.657 6.818 231 HD2 LYS 32 2HD LYS 32 -7.801 -6.009 8.317 232 HD3 LYS 32 1HD LYS 32 -9.531 -5.967 7.968 233 HE2 LYS 32 2HE LYS 32 -9.257 -6.742 10.209 234 HE3 LYS 32 1HE LYS 32 -9.759 -8.114 9.221 235 HZ1 LYS 32 3HZ LYS 32 -7.343 -8.693 9.061 236 HZ2 LYS 32 1HZ LYS 32 -8.018 -8.860 10.604 237 HZ3 LYS 32 2HZ LYS 32 -7.042 -7.526 10.247 238 H LYS 33 H LYS 33 -11.016 -8.121 4.195 239 HA LYS 33 HA LYS 33 -11.019 -10.841 4.845 240 HB2 LYS 33 2HB LYS 33 -13.245 -10.847 3.571 241 HB3 LYS 33 1HB LYS 33 -13.098 -9.778 4.959 242 HG2 LYS 33 2HG LYS 33 -12.260 -8.307 2.702 243 HG3 LYS 33 1HG LYS 33 -13.756 -9.145 2.258 244 HD2 LYS 33 2HD LYS 33 -14.433 -8.257 4.704 245 HD3 LYS 33 1HD LYS 33 -13.289 -6.997 4.236 246 HE2 LYS 33 2HE LYS 33 -14.765 -6.078 2.843 247 HE3 LYS 33 1HE LYS 33 -15.081 -7.628 2.064 248 HZ1 LYS 33 3HZ LYS 33 -16.908 -6.300 3.445 249 HZ2 LYS 33 1HZ LYS 33 -16.263 -7.242 4.694 250 HZ3 LYS 33 2HZ LYS 33 -16.903 -7.986 3.318 251 H GLU 34 H GLU 34 -10.227 -9.232 1.884 252 HA GLU 34 HA GLU 34 -10.538 -11.569 0.228 253 HB2 GLU 34 2HB GLU 34 -10.780 -9.189 -0.579 254 HB3 GLU 34 1HB GLU 34 -9.028 -9.040 -0.432 255 HG2 GLU 34 2HG GLU 34 -8.680 -10.088 -2.358 256 HG3 GLU 34 1HG GLU 34 -9.804 -11.391 -1.942 257 H ALA 35 H ALA 35 -7.825 -9.775 1.647 258 HA ALA 35 HA ALA 35 -5.707 -11.169 0.543 259 HB1 ALA 35 1HB ALA 35 -5.108 -9.287 1.762 260 HB2 ALA 35 2HB ALA 35 -4.553 -10.609 2.791 261 HB3 ALA 35 3HB ALA 35 -6.059 -9.769 3.166 262 H ALA 36 H ALA 36 -7.911 -12.121 3.065 263 HA ALA 36 HA ALA 36 -6.390 -14.259 4.136 264 HB1 ALA 36 1HB ALA 36 -8.153 -13.409 5.463 265 HB2 ALA 36 2HB ALA 36 -8.640 -15.037 4.990 266 HB3 ALA 36 3HB ALA 36 -9.332 -13.637 4.172 267 H ALA 37 H ALA 37 -8.530 -13.965 1.387 268 HA ALA 37 HA ALA 37 -9.158 -16.626 0.904 269 HB1 ALA 37 1HB ALA 37 -10.240 -14.949 -0.373 270 HB2 ALA 37 2HB ALA 37 -9.306 -15.919 -1.511 271 HB3 ALA 37 3HB ALA 37 -8.708 -14.341 -1.001 272 H SER 38 H SER 38 -6.815 -14.995 -1.197 273 HA SER 38 HA SER 38 -5.439 -17.437 -1.729 274 HB2 SER 38 2HB SER 38 -5.237 -14.613 -2.604 275 HB3 SER 38 1HB SER 38 -3.738 -15.554 -2.680 276 HG SER 38 HG SER 38 -5.674 -15.562 -4.422 277 H GLY 39 H GLY 39 -4.772 -14.586 0.251 278 HA2 GLY 39 2HA GLY 39 -3.587 -14.724 2.310 279 HA3 GLY 39 1HA GLY 39 -2.762 -16.162 1.702 280 H LEU 40 H LEU 40 -3.141 -12.761 0.656 281 HA LEU 40 HA LEU 40 -0.210 -12.613 0.510 282 HB2 LEU 40 2HB LEU 40 -0.628 -11.037 -1.496 283 HB3 LEU 40 1HB LEU 40 -0.645 -12.769 -1.746 284 HG LEU 40 HG LEU 40 -2.433 -11.511 -2.953 285 HD11 LEU 40 1HD1 LEU 40 -3.959 -13.242 -1.147 286 HD12 LEU 40 2HD1 LEU 40 -2.505 -13.972 -1.828 287 HD13 LEU 40 3HD1 LEU 40 -3.747 -13.319 -2.897 288 HD21 LEU 40 3HD2 LEU 40 -2.775 -10.043 -0.788 289 HD22 LEU 40 1HD2 LEU 40 -3.959 -11.295 -0.415 290 HD23 LEU 40 2HD2 LEU 40 -4.099 -10.363 -1.907 291 HA PRO 41 HA PRO 41 -0.411 -8.847 2.750 292 HB2 PRO 41 2HB PRO 41 1.369 -7.266 1.382 293 HB3 PRO 41 1HB PRO 41 1.846 -8.537 2.507 294 HG2 PRO 41 2HG PRO 41 1.680 -8.620 -0.477 295 HG3 PRO 41 1HG PRO 41 2.934 -9.270 0.590 296 HD2 PRO 41 2HD PRO 41 1.069 -10.855 -0.491 297 HD3 PRO 41 1HD PRO 41 1.667 -11.127 1.160 298 H LEU 42 H LEU 42 -0.805 -6.465 2.537 299 HA LEU 42 HA LEU 42 -2.550 -5.962 0.221 300 HB2 LEU 42 2HB LEU 42 -3.222 -4.022 2.036 301 HB3 LEU 42 1HB LEU 42 -4.094 -5.516 1.764 302 HG LEU 42 HG LEU 42 -1.885 -5.394 3.785 303 HD11 LEU 42 1HD1 LEU 42 -3.548 -3.548 4.176 304 HD12 LEU 42 2HD1 LEU 42 -3.391 -4.723 5.483 305 HD13 LEU 42 3HD1 LEU 42 -4.770 -4.802 4.386 306 HD21 LEU 42 3HD2 LEU 42 -3.335 -7.467 2.826 307 HD22 LEU 42 1HD2 LEU 42 -4.317 -6.980 4.209 308 HD23 LEU 42 2HD2 LEU 42 -2.622 -7.403 4.436 309 H MET 43 H MET 43 -2.594 -3.839 -0.663 310 HA MET 43 HA MET 43 0.018 -2.518 -0.481 311 HB2 MET 43 2HB MET 43 -0.679 -3.382 -2.692 312 HB3 MET 43 1HB MET 43 -2.102 -2.329 -2.645 313 HG2 MET 43 2HG MET 43 -0.527 -1.228 -3.993 314 HG3 MET 43 1HG MET 43 -0.473 -0.396 -2.439 315 HE1 MET 43 3HE MET 43 1.178 -3.836 -3.655 316 HE2 MET 43 1HE MET 43 2.745 -3.200 -4.156 317 HE3 MET 43 2HE MET 43 1.276 -2.675 -4.980 318 H VAL 44 H VAL 44 -0.253 -1.123 1.235 319 HA VAL 44 HA VAL 44 -2.585 0.586 1.370 320 HB VAL 44 HB VAL 44 -0.128 0.606 3.122 321 HG11 VAL 44 1HG1 VAL 44 -0.982 2.465 3.987 322 HG12 VAL 44 2HG1 VAL 44 -2.384 1.532 4.509 323 HG13 VAL 44 3HG1 VAL 44 -2.403 2.352 2.948 324 HG21 VAL 44 3HG2 VAL 44 -0.980 -1.054 4.348 325 HG22 VAL 44 1HG2 VAL 44 -1.927 -1.428 2.911 326 HG23 VAL 44 2HG2 VAL 44 -2.631 -0.455 4.204 327 H ILE 45 H ILE 45 -1.930 1.456 -0.835 328 HA ILE 45 HA ILE 45 0.191 3.428 -0.750 329 HB ILE 45 HB ILE 45 0.206 2.600 -2.879 330 HG12 ILE 45 2HG1 ILE 45 -1.915 4.565 -3.577 331 HG13 ILE 45 1HG1 ILE 45 -0.466 5.160 -2.757 332 HG21 ILE 45 1HG2 ILE 45 -1.408 1.092 -3.234 333 HG22 ILE 45 2HG2 ILE 45 -2.203 2.419 -4.083 334 HG23 ILE 45 3HG2 ILE 45 -2.637 2.053 -2.415 335 HD11 ILE 45 3HD1 ILE 45 -0.851 4.411 -5.511 336 HD12 ILE 45 1HD1 ILE 45 0.486 3.519 -4.787 337 HD13 ILE 45 2HD1 ILE 45 0.481 5.282 -4.753 338 H ILE 46 H ILE 46 -0.118 5.353 0.130 339 HA ILE 46 HA ILE 46 -2.823 6.512 -0.040 340 HB ILE 46 HB ILE 46 -0.899 7.140 2.181 341 HG12 ILE 46 2HG1 ILE 46 -3.106 5.298 2.812 342 HG13 ILE 46 1HG1 ILE 46 -1.846 4.600 1.798 343 HG21 ILE 46 1HG2 ILE 46 -3.891 7.217 2.266 344 HG22 ILE 46 2HG2 ILE 46 -2.960 8.553 1.591 345 HG23 ILE 46 3HG2 ILE 46 -2.729 8.076 3.274 346 HD11 ILE 46 3HD1 ILE 46 -0.201 4.948 3.434 347 HD12 ILE 46 1HD1 ILE 46 -1.605 4.330 4.305 348 HD13 ILE 46 2HD1 ILE 46 -1.229 6.052 4.348 349 H HIS 47 H HIS 47 -3.020 8.680 -0.392 350 HA HIS 47 HA HIS 47 -0.619 10.278 -0.835 351 HB2 HIS 47 2HB HIS 47 -2.748 10.603 -2.881 352 HB3 HIS 47 1HB HIS 47 -1.000 10.794 -3.022 353 HD1 HIS 47 1HD HIS 47 -0.122 9.203 -4.655 354 HD2 HIS 47 2HD HIS 47 -3.231 7.547 -2.453 355 HE1 HIS 47 1HE HIS 47 -0.429 6.884 -5.566 356 HE2 HIS 47 2HE HIS 47 -2.479 6.018 -4.395 357 H LYS 48 H LYS 48 -1.308 11.278 1.117 358 HA LYS 48 HA LYS 48 -3.929 12.512 1.202 359 HB2 LYS 48 2HB LYS 48 -1.763 12.057 3.070 360 HB3 LYS 48 1HB LYS 48 -2.404 13.682 3.223 361 HG2 LYS 48 2HG LYS 48 -4.277 11.365 3.122 362 HG3 LYS 48 1HG LYS 48 -3.411 11.729 4.616 363 HD2 LYS 48 2HD LYS 48 -4.268 14.156 4.193 364 HD3 LYS 48 1HD LYS 48 -5.457 13.355 3.163 365 HE2 LYS 48 2HE LYS 48 -5.010 13.014 6.116 366 HE3 LYS 48 1HE LYS 48 -6.468 13.555 5.285 367 HZ1 LYS 48 3HZ LYS 48 -5.316 10.819 5.142 368 HZ2 LYS 48 1HZ LYS 48 -6.724 11.339 4.360 369 HZ3 LYS 48 2HZ LYS 48 -6.670 11.269 6.049 370 H SER 49 H SER 49 -4.443 14.685 1.091 371 HA SER 49 HA SER 49 -4.353 16.806 0.280 372 HB2 SER 49 2HB SER 49 -2.688 18.155 1.137 373 HB3 SER 49 1HB SER 49 -2.506 16.739 2.174 374 HG SER 49 HG SER 49 -0.646 17.812 0.753 375 H TRP 50 H TRP 50 -2.463 18.271 -1.077 376 HA TRP 50 HA TRP 50 -2.732 17.493 -3.697 377 HB2 TRP 50 2HB TRP 50 -0.948 19.076 -4.236 378 HB3 TRP 50 1HB TRP 50 -2.001 19.743 -2.978 379 HD1 TRP 50 HD TRP 50 -0.973 19.570 -0.393 380 HE1 TRP 50 1HE TRP 50 1.467 19.827 0.389 381 HE3 TRP 50 3HE TRP 50 1.397 18.750 -4.848 382 HZ2 TRP 50 2HZ TRP 50 4.053 19.700 -0.736 383 HZ3 TRP 50 3HZ TRP 50 3.855 18.834 -4.908 384 HH2 TRP 50 HH TRP 50 5.154 19.301 -2.895 385 H CYS 51 H CYS 51 -1.788 16.030 -5.008 386 HA CYS 51 HA CYS 51 0.819 14.935 -4.296 387 HB2 CYS 51 2HB CYS 51 -0.284 13.260 -3.200 388 HB3 CYS 51 1HB CYS 51 -1.758 13.471 -4.133 389 H GLY 52 H GLY 52 2.046 14.653 -6.062 390 HA2 GLY 52 2HA GLY 52 0.720 14.692 -8.698 391 HA3 GLY 52 1HA GLY 52 2.406 15.126 -8.402 392 H ALA 53 H ALA 53 2.688 12.789 -6.572 393 HA ALA 53 HA ALA 53 3.758 10.948 -8.382 394 HB1 ALA 53 1HB ALA 53 3.530 9.388 -6.269 395 HB2 ALA 53 2HB ALA 53 3.152 10.914 -5.471 396 HB3 ALA 53 3HB ALA 53 4.693 10.712 -6.303 397 H CYS 54 H CYS 54 0.560 11.533 -7.522 398 HA CYS 54 HA CYS 54 -0.287 8.863 -8.308 399 HB2 CYS 54 2HB CYS 54 -2.601 9.816 -7.610 400 HB3 CYS 54 1HB CYS 54 -1.430 9.416 -6.348 401 H LYS 55 H LYS 55 -0.497 12.255 -9.210 402 HA LYS 55 HA LYS 55 -2.393 11.933 -11.274 403 HB2 LYS 55 2HB LYS 55 -1.969 14.135 -11.871 404 HB3 LYS 55 1HB LYS 55 -1.536 14.114 -10.172 405 HG2 LYS 55 2HG LYS 55 0.257 15.223 -10.950 406 HG3 LYS 55 1HG LYS 55 0.862 13.579 -11.211 407 HD2 LYS 55 2HD LYS 55 -0.028 13.699 -13.537 408 HD3 LYS 55 1HD LYS 55 -0.436 15.390 -13.246 409 HE2 LYS 55 2HE LYS 55 2.334 14.219 -13.021 410 HE3 LYS 55 1HE LYS 55 1.721 15.086 -14.428 411 HZ1 LYS 55 3HZ LYS 55 1.563 16.403 -11.814 412 HZ2 LYS 55 1HZ LYS 55 1.792 17.076 -13.350 413 HZ3 LYS 55 2HZ LYS 55 3.077 16.305 -12.564 414 H ALA 56 H ALA 56 1.145 11.691 -11.209 415 HA ALA 56 HA ALA 56 1.514 11.402 -14.000 416 HB1 ALA 56 1HB ALA 56 3.170 11.438 -11.792 417 HB2 ALA 56 2HB ALA 56 3.674 11.143 -13.455 418 HB3 ALA 56 3HB ALA 56 3.328 9.785 -12.385 419 H LEU 57 H LEU 57 0.579 9.187 -11.468 420 HA LEU 57 HA LEU 57 0.849 6.758 -12.837 421 HB2 LEU 57 2HB LEU 57 -1.324 7.403 -10.851 422 HB3 LEU 57 1HB LEU 57 -0.606 5.841 -11.174 423 HG LEU 57 HG LEU 57 0.682 8.170 -9.778 424 HD11 LEU 57 1HD1 LEU 57 0.288 5.393 -8.726 425 HD12 LEU 57 2HD1 LEU 57 -0.975 6.616 -8.590 426 HD13 LEU 57 3HD1 LEU 57 0.596 6.883 -7.836 427 HD21 LEU 57 3HD2 LEU 57 2.478 7.306 -10.944 428 HD22 LEU 57 1HD2 LEU 57 1.848 5.659 -10.898 429 HD23 LEU 57 2HD2 LEU 57 2.531 6.383 -9.442 430 H LYS 58 H LYS 58 -1.612 9.239 -12.933 431 HA LYS 58 HA LYS 58 -3.748 7.927 -13.996 432 HB2 LYS 58 2HB LYS 58 -2.721 10.675 -14.667 433 HB3 LYS 58 1HB LYS 58 -4.281 10.075 -15.201 434 HG2 LYS 58 2HG LYS 58 -4.969 9.795 -12.879 435 HG3 LYS 58 1HG LYS 58 -3.390 10.367 -12.339 436 HD2 LYS 58 2HD LYS 58 -5.559 11.909 -13.741 437 HD3 LYS 58 1HD LYS 58 -4.841 12.220 -12.161 438 HE2 LYS 58 2HE LYS 58 -2.721 12.796 -13.237 439 HE3 LYS 58 1HE LYS 58 -3.438 12.485 -14.818 440 HZ1 LYS 58 3HZ LYS 58 -4.850 14.374 -13.117 441 HZ2 LYS 58 1HZ LYS 58 -4.567 14.419 -14.786 442 HZ3 LYS 58 2HZ LYS 58 -3.351 14.889 -13.708 443 HA PRO 59 HA PRO 59 -2.370 8.196 -18.557 444 HB2 PRO 59 2HB PRO 59 -0.031 9.339 -19.245 445 HB3 PRO 59 1HB PRO 59 -1.518 10.280 -19.003 446 HG2 PRO 59 2HG PRO 59 0.758 9.818 -17.099 447 HG3 PRO 59 1HG PRO 59 -0.061 11.335 -17.511 448 HD2 PRO 59 2HD PRO 59 -0.658 9.961 -15.272 449 HD3 PRO 59 1HD PRO 59 -1.888 10.865 -16.187 450 H LYS 60 H LYS 60 0.348 7.627 -16.330 451 HA LYS 60 HA LYS 60 1.369 5.582 -18.166 452 HB2 LYS 60 2HB LYS 60 3.358 5.522 -16.848 453 HB3 LYS 60 1HB LYS 60 2.942 7.213 -17.109 454 HG2 LYS 60 2HG LYS 60 1.691 6.901 -14.834 455 HG3 LYS 60 1HG LYS 60 2.844 5.592 -14.622 456 HD2 LYS 60 2HD LYS 60 3.605 7.762 -13.655 457 HD3 LYS 60 1HD LYS 60 4.702 7.098 -14.864 458 HE2 LYS 60 2HE LYS 60 2.720 8.839 -16.059 459 HE3 LYS 60 1HE LYS 60 3.637 9.666 -14.800 460 HZ1 LYS 60 3HZ LYS 60 4.974 8.097 -16.920 461 HZ2 LYS 60 1HZ LYS 60 5.639 9.280 -15.908 462 HZ3 LYS 60 2HZ LYS 60 4.569 9.724 -17.141 463 H PHE 61 H PHE 61 0.358 5.825 -14.731 464 HA PHE 61 HA PHE 61 0.580 3.049 -14.288 465 HB2 PHE 61 2HB PHE 61 0.448 4.846 -12.497 466 HB3 PHE 61 1HB PHE 61 -1.294 4.875 -12.791 467 HD1 PHE 61 1HD PHE 61 -2.621 2.782 -12.410 468 HD2 PHE 61 2HD PHE 61 1.434 3.181 -11.183 469 HE1 PHE 61 1HE PHE 61 -2.899 0.872 -10.884 470 HE2 PHE 61 2HE PHE 61 1.164 1.272 -9.654 471 HZ PHE 61 HZ PHE 61 -1.004 0.114 -9.505 472 H ALA 62 H ALA 62 -1.657 4.956 -16.022 473 HA ALA 62 HA ALA 62 -3.965 3.368 -15.822 474 HB1 ALA 62 1HB ALA 62 -2.903 5.372 -17.702 475 HB2 ALA 62 2HB ALA 62 -4.527 5.195 -17.035 476 HB3 ALA 62 3HB ALA 62 -4.026 4.209 -18.409 477 H GLU 63 H GLU 63 -0.880 2.927 -17.140 478 HA GLU 63 HA GLU 63 -1.351 0.859 -19.040 479 HB2 GLU 63 2HB GLU 63 0.642 2.461 -18.881 480 HB3 GLU 63 1HB GLU 63 1.205 1.457 -17.540 481 HG2 GLU 63 2HG GLU 63 2.269 0.242 -19.064 482 HG3 GLU 63 1HG GLU 63 0.689 -0.374 -19.545 483 H SER 64 H SER 64 -1.356 1.017 -15.682 484 HA SER 64 HA SER 64 -0.279 -1.395 -14.870 485 HB2 SER 64 2HB SER 64 -2.467 0.326 -13.773 486 HB3 SER 64 1HB SER 64 -1.971 -1.144 -12.958 487 HG SER 64 HG SER 64 -0.243 1.001 -13.640 488 H THR 65 H THR 65 -2.567 -1.229 -17.165 489 HA THR 65 HA THR 65 -4.669 -2.853 -16.499 490 HB THR 65 HB THR 65 -4.458 -3.749 -18.887 491 HG1 THR 65 1HG THR 65 -2.766 -3.227 -20.031 492 HG21 THR 65 3HG2 THR 65 -5.796 -1.763 -18.426 493 HG22 THR 65 1HG2 THR 65 -4.962 -1.644 -19.975 494 HG23 THR 65 2HG2 THR 65 -4.352 -0.760 -18.575 495 H GLU 66 H GLU 66 -1.354 -3.714 -17.272 496 HA GLU 66 HA GLU 66 -1.845 -6.533 -16.861 497 HB2 GLU 66 2HB GLU 66 0.480 -6.864 -17.332 498 HB3 GLU 66 1HB GLU 66 -0.139 -5.688 -18.493 499 HG2 GLU 66 2HG GLU 66 0.902 -4.417 -16.120 500 HG3 GLU 66 1HG GLU 66 2.110 -5.431 -16.903 501 H ILE 67 H ILE 67 -0.739 -3.760 -15.060 502 HA ILE 67 HA ILE 67 0.334 -5.262 -12.883 503 HB ILE 67 HB ILE 67 -0.765 -2.451 -12.850 504 HG12 ILE 67 2HG1 ILE 67 2.089 -3.378 -13.231 505 HG13 ILE 67 1HG1 ILE 67 1.037 -2.799 -14.531 506 HG21 ILE 67 1HG2 ILE 67 -0.417 -3.668 -10.642 507 HG22 ILE 67 2HG2 ILE 67 0.376 -2.106 -10.830 508 HG23 ILE 67 3HG2 ILE 67 1.305 -3.594 -11.008 509 HD11 ILE 67 3HD1 ILE 67 2.765 -1.286 -12.994 510 HD12 ILE 67 1HD1 ILE 67 1.172 -0.918 -12.339 511 HD13 ILE 67 2HD1 ILE 67 1.494 -0.682 -14.056 512 H SER 68 H SER 68 -2.819 -4.626 -14.027 513 HA SER 68 HA SER 68 -4.253 -4.715 -11.581 514 HB2 SER 68 2HB SER 68 -4.871 -4.576 -14.366 515 HB3 SER 68 1HB SER 68 -5.790 -5.914 -13.675 516 HG SER 68 HG SER 68 -6.362 -4.314 -11.978 517 H GLU 69 H GLU 69 -2.903 -7.099 -13.739 518 HA GLU 69 HA GLU 69 -4.113 -9.335 -12.381 519 HB2 GLU 69 2HB GLU 69 -1.904 -9.251 -14.446 520 HB3 GLU 69 1HB GLU 69 -2.710 -10.705 -13.878 521 HG2 GLU 69 2HG GLU 69 -4.069 -8.433 -15.305 522 HG3 GLU 69 1HG GLU 69 -3.526 -9.927 -16.067 523 H LEU 70 H LEU 70 -1.010 -7.687 -12.520 524 HA LEU 70 HA LEU 70 0.456 -9.479 -10.907 525 HB2 LEU 70 2HB LEU 70 0.743 -6.592 -11.636 526 HB3 LEU 70 1HB LEU 70 1.754 -7.257 -10.356 527 HG LEU 70 HG LEU 70 2.678 -8.897 -11.916 528 HD11 LEU 70 1HD1 LEU 70 1.183 -7.507 -14.122 529 HD12 LEU 70 2HD1 LEU 70 0.563 -8.954 -13.317 530 HD13 LEU 70 3HD1 LEU 70 2.097 -9.017 -14.183 531 HD21 LEU 70 3HD2 LEU 70 2.872 -6.262 -13.318 532 HD22 LEU 70 1HD2 LEU 70 4.135 -7.447 -12.978 533 HD23 LEU 70 2HD2 LEU 70 3.497 -6.442 -11.678 534 H SER 71 H SER 71 -2.072 -7.311 -10.149 535 HA SER 71 HA SER 71 -1.368 -6.691 -7.474 536 HB2 SER 71 2HB SER 71 -3.593 -6.210 -9.245 537 HB3 SER 71 1HB SER 71 -4.155 -6.702 -7.648 538 HG SER 71 HG SER 71 -2.621 -4.466 -8.386 539 H HIS 72 H HIS 72 -2.475 -9.566 -8.929 540 HA HIS 72 HA HIS 72 -4.043 -10.667 -6.880 541 HB2 HIS 72 2HB HIS 72 -2.442 -11.777 -9.148 542 HB3 HIS 72 1HB HIS 72 -2.990 -12.890 -7.888 543 HD1 HIS 72 1HD HIS 72 -5.369 -13.663 -8.018 544 HD2 HIS 72 2HD HIS 72 -4.616 -10.427 -10.512 545 HE1 HIS 72 1HE HIS 72 -7.451 -13.383 -9.403 546 HE2 HIS 72 2HE HIS 72 -6.923 -11.496 -10.987 547 H ASN 73 H ASN 73 -0.778 -9.866 -6.997 548 HA ASN 73 HA ASN 73 0.198 -11.846 -5.159 549 HB2 ASN 73 2HB ASN 73 1.357 -9.300 -6.284 550 HB3 ASN 73 1HB ASN 73 2.242 -10.395 -5.217 551 HD21 ASN 73 1HD2 ASN 73 0.989 -9.882 -8.407 552 HD22 ASN 73 2HD2 ASN 73 1.709 -11.287 -9.134 553 H PHE 74 H PHE 74 -1.704 -9.173 -4.778 554 HA PHE 74 HA PHE 74 -1.577 -9.204 -1.960 555 HB2 PHE 74 2HB PHE 74 -0.995 -6.717 -1.775 556 HB3 PHE 74 1HB PHE 74 0.330 -7.836 -2.110 557 HD1 PHE 74 1HD PHE 74 -2.178 -5.943 -4.126 558 HD2 PHE 74 2HD PHE 74 1.886 -7.061 -3.549 559 HE1 PHE 74 1HE PHE 74 -1.541 -4.621 -6.100 560 HE2 PHE 74 2HE PHE 74 2.531 -5.741 -5.523 561 HZ PHE 74 HZ PHE 74 0.816 -4.519 -6.799 562 H VAL 75 H VAL 75 -2.765 -6.469 -1.691 563 HA VAL 75 HA VAL 75 -4.991 -6.608 -3.549 564 HB VAL 75 HB VAL 75 -5.568 -8.177 -1.696 565 HG11 VAL 75 1HG1 VAL 75 -5.755 -7.556 0.463 566 HG12 VAL 75 2HG1 VAL 75 -6.326 -5.936 0.061 567 HG13 VAL 75 3HG1 VAL 75 -4.605 -6.308 -0.016 568 HG21 VAL 75 3HG2 VAL 75 -7.881 -7.349 -1.490 569 HG22 VAL 75 1HG2 VAL 75 -7.276 -7.220 -3.138 570 HG23 VAL 75 2HG2 VAL 75 -7.370 -5.783 -2.122 571 H MET 76 H MET 76 -5.683 -4.774 -4.127 572 HA MET 76 HA MET 76 -4.854 -2.337 -3.767 573 HB2 MET 76 2HB MET 76 -7.777 -2.511 -3.846 574 HB3 MET 76 1HB MET 76 -6.665 -1.792 -4.987 575 HG2 MET 76 2HG MET 76 -7.616 -3.512 -6.221 576 HG3 MET 76 1HG MET 76 -6.108 -4.223 -5.674 577 HE1 MET 76 3HE MET 76 -7.195 -6.158 -6.682 578 HE2 MET 76 1HE MET 76 -8.367 -7.220 -5.902 579 HE3 MET 76 2HE MET 76 -6.714 -7.137 -5.296 580 H VAL 77 H VAL 77 -4.641 -0.910 -2.203 581 HA VAL 77 HA VAL 77 -6.784 -0.356 -0.363 582 HB VAL 77 HB VAL 77 -4.135 -1.375 0.670 583 HG11 VAL 77 1HG1 VAL 77 -6.087 0.478 1.895 584 HG12 VAL 77 2HG1 VAL 77 -4.359 0.290 2.196 585 HG13 VAL 77 3HG1 VAL 77 -5.507 -0.836 2.919 586 HG21 VAL 77 3HG2 VAL 77 -5.925 -2.662 2.101 587 HG22 VAL 77 1HG2 VAL 77 -5.464 -3.218 0.493 588 HG23 VAL 77 2HG2 VAL 77 -6.951 -2.298 0.713 589 H ASN 78 H ASN 78 -6.365 1.445 -2.020 590 HA ASN 78 HA ASN 78 -4.280 3.244 -1.046 591 HB2 ASN 78 2HB ASN 78 -3.810 3.243 -3.262 592 HB3 ASN 78 1HB ASN 78 -5.423 2.724 -3.706 593 HD21 ASN 78 1HD2 ASN 78 -4.287 5.565 -1.934 594 HD22 ASN 78 2HD2 ASN 78 -4.956 6.737 -3.026 595 H LEU 79 H LEU 79 -5.013 4.546 0.439 596 HA LEU 79 HA LEU 79 -7.667 5.781 0.047 597 HB2 LEU 79 2HB LEU 79 -7.939 5.986 2.361 598 HB3 LEU 79 1HB LEU 79 -7.262 4.385 2.137 599 HG LEU 79 HG LEU 79 -4.987 5.672 2.584 600 HD11 LEU 79 1HD1 LEU 79 -6.642 7.212 4.489 601 HD12 LEU 79 2HD1 LEU 79 -6.588 7.795 2.826 602 HD13 LEU 79 3HD1 LEU 79 -5.095 7.615 3.746 603 HD21 LEU 79 3HD2 LEU 79 -4.970 4.569 4.551 604 HD22 LEU 79 1HD2 LEU 79 -6.477 3.888 3.937 605 HD23 LEU 79 2HD2 LEU 79 -6.516 5.244 5.065 606 H GLU 80 H GLU 80 -7.890 8.050 0.651 607 HA GLU 80 HA GLU 80 -5.727 9.738 1.240 608 HB2 GLU 80 2HB GLU 80 -5.583 10.845 -1.062 609 HB3 GLU 80 1HB GLU 80 -4.752 9.299 -0.858 610 HG2 GLU 80 2HG GLU 80 -6.565 8.142 -1.963 611 HG3 GLU 80 1HG GLU 80 -7.475 9.655 -2.100 612 H ASP 81 H ASP 81 -7.657 10.266 2.542 613 HA ASP 81 HA ASP 81 -9.198 12.366 1.205 614 HB2 ASP 81 2HB ASP 81 -11.144 11.537 2.798 615 HB3 ASP 81 1HB ASP 81 -10.900 10.824 1.207 616 H GLU 82 H GLU 82 -10.056 11.411 4.424 617 HA GLU 82 HA GLU 82 -8.440 13.601 5.530 618 HB2 GLU 82 2HB GLU 82 -11.341 13.357 5.420 619 HB3 GLU 82 1HB GLU 82 -10.753 13.589 7.060 620 HG2 GLU 82 2HG GLU 82 -10.015 15.694 6.652 621 HG3 GLU 82 1HG GLU 82 -9.652 15.359 4.959 622 H GLU 83 H GLU 83 -9.513 10.375 5.787 623 HA GLU 83 HA GLU 83 -9.599 9.794 8.451 624 HB2 GLU 83 2HB GLU 83 -9.025 8.340 6.017 625 HB3 GLU 83 1HB GLU 83 -8.074 7.715 7.357 626 HG2 GLU 83 2HG GLU 83 -9.907 6.984 8.507 627 HG3 GLU 83 1HG GLU 83 -10.977 8.192 7.781 628 H GLU 84 H GLU 84 -6.605 8.974 6.738 629 HA GLU 84 HA GLU 84 -4.424 9.044 7.386 630 HB2 GLU 84 2HB GLU 84 -5.361 11.608 7.486 631 HB3 GLU 84 1HB GLU 84 -4.726 11.406 9.114 632 HG2 GLU 84 2HG GLU 84 -2.587 10.606 8.053 633 HG3 GLU 84 1HG GLU 84 -3.252 11.144 6.511 634 HA PRO 85 HA PRO 85 -5.219 6.978 11.397 635 HB2 PRO 85 2HB PRO 85 -3.123 5.233 11.120 636 HB3 PRO 85 1HB PRO 85 -4.748 4.941 10.471 637 HG2 PRO 85 2HG PRO 85 -2.300 5.969 9.082 638 HG3 PRO 85 1HG PRO 85 -3.507 4.792 8.514 639 HD2 PRO 85 2HD PRO 85 -3.519 7.358 7.695 640 HD3 PRO 85 1HD PRO 85 -5.026 6.441 7.937 641 H LYS 86 H LYS 86 -4.132 7.065 13.361 642 HA LYS 86 HA LYS 86 -1.979 9.011 13.477 643 HB2 LYS 86 2HB LYS 86 -2.338 8.906 15.926 644 HB3 LYS 86 1HB LYS 86 -3.820 9.276 15.035 645 HG2 LYS 86 2HG LYS 86 -4.811 7.318 15.604 646 HG3 LYS 86 1HG LYS 86 -3.288 6.428 15.645 647 HD2 LYS 86 2HD LYS 86 -3.444 6.540 17.871 648 HD3 LYS 86 1HD LYS 86 -3.023 8.245 17.707 649 HE2 LYS 86 2HE LYS 86 -5.181 8.949 18.005 650 HE3 LYS 86 1HE LYS 86 -5.870 7.458 17.365 651 HZ1 LYS 86 3HZ LYS 86 -6.278 7.052 19.521 652 HZ2 LYS 86 1HZ LYS 86 -5.090 8.122 20.076 653 HZ3 LYS 86 2HZ LYS 86 -4.659 6.566 19.570 654 H ASP 87 H ASP 87 -0.841 7.013 12.260 655 HA ASP 87 HA ASP 87 1.114 6.064 14.137 656 HB2 ASP 87 2HB ASP 87 -1.082 4.334 13.339 657 HB3 ASP 87 1HB ASP 87 0.484 3.651 12.876 658 H GLU 88 H GLU 88 2.371 4.143 12.682 659 HA GLU 88 HA GLU 88 3.607 5.682 10.614 660 HB2 GLU 88 2HB GLU 88 4.022 2.769 11.299 661 HB3 GLU 88 1HB GLU 88 5.109 3.793 10.370 662 HG2 GLU 88 2HG GLU 88 4.412 4.124 13.279 663 HG3 GLU 88 1HG GLU 88 5.919 3.478 12.633 664 H ASP 89 H ASP 89 0.949 3.573 10.682 665 HA ASP 89 HA ASP 89 1.057 2.191 8.312 666 HB2 ASP 89 2HB ASP 89 -1.228 3.362 9.861 667 HB3 ASP 89 1HB ASP 89 -1.519 2.534 8.326 668 H PHE 90 H PHE 90 0.821 5.617 8.680 669 HA PHE 90 HA PHE 90 0.055 5.859 5.848 670 HB2 PHE 90 2HB PHE 90 -0.847 7.999 6.279 671 HB3 PHE 90 1HB PHE 90 -1.397 6.980 7.616 672 HD1 PHE 90 2HD PHE 90 0.822 9.726 6.633 673 HD2 PHE 90 1HD PHE 90 -0.619 7.353 9.856 674 HE1 PHE 90 2HE PHE 90 1.759 11.340 8.234 675 HE2 PHE 90 1HE PHE 90 0.312 8.965 11.465 676 HZ PHE 90 HZ PHE 90 1.504 10.962 10.654 677 H SER 91 H SER 91 2.480 6.696 8.226 678 HA SER 91 HA SER 91 4.389 7.222 6.152 679 HB2 SER 91 2HB SER 91 3.742 9.512 8.026 680 HB3 SER 91 1HB SER 91 4.921 9.508 6.707 681 HG SER 91 HG SER 91 3.139 10.455 5.871 682 HA PRO 92 HA PRO 92 6.199 5.383 9.957 683 HB2 PRO 92 2HB PRO 92 8.055 3.903 8.594 684 HB3 PRO 92 1HB PRO 92 6.410 3.347 8.947 685 HG2 PRO 92 2HG PRO 92 7.526 4.498 6.424 686 HG3 PRO 92 1HG PRO 92 6.377 3.169 6.639 687 HD2 PRO 92 2HD PRO 92 5.611 5.666 5.920 688 HD3 PRO 92 1HD PRO 92 4.587 4.586 6.887 689 H ASP 93 H ASP 93 8.633 5.615 7.387 690 HA ASP 93 HA ASP 93 10.324 7.164 9.162 691 HB2 ASP 93 2HB ASP 93 10.977 5.143 7.591 692 HB3 ASP 93 1HB ASP 93 11.153 6.426 6.382 693 H GLY 94 H GLY 94 8.884 7.508 5.933 694 HA2 GLY 94 2HA GLY 94 9.963 10.093 5.457 695 HA3 GLY 94 1HA GLY 94 8.636 9.335 4.570 696 H GLY 95 H GLY 95 9.256 12.053 5.959 697 HA2 GLY 95 2HA GLY 95 7.040 12.294 7.811 698 HA3 GLY 95 1HA GLY 95 8.122 13.589 7.295 699 H TYR 96 H TYR 96 7.103 12.064 4.553 700 HA TYR 96 HA TYR 96 5.650 14.181 3.528 701 HB2 TYR 96 2HB TYR 96 4.718 12.358 1.925 702 HB3 TYR 96 1HB TYR 96 6.455 12.681 1.934 703 HD1 TYR 96 2HD TYR 96 5.062 10.849 4.753 704 HD2 TYR 96 1HD TYR 96 6.781 10.464 0.880 705 HE1 TYR 96 2HE TYR 96 5.497 8.474 5.189 706 HE2 TYR 96 1HE TYR 96 7.210 8.080 1.306 707 HH TYR 96 HH TYR 96 5.787 6.327 3.539 708 H ILE 97 H ILE 97 3.276 13.424 2.501 709 HA ILE 97 HA ILE 97 1.588 12.444 4.651 710 HB ILE 97 HB ILE 97 0.068 14.438 4.392 711 HG12 ILE 97 2HG1 ILE 97 2.360 16.102 3.587 712 HG13 ILE 97 1HG1 ILE 97 1.734 15.053 2.313 713 HG21 ILE 97 1HG2 ILE 97 1.320 14.202 6.404 714 HG22 ILE 97 2HG2 ILE 97 1.472 15.883 5.889 715 HG23 ILE 97 3HG2 ILE 97 2.800 14.755 5.619 716 HD11 ILE 97 3HD1 ILE 97 -0.535 16.007 2.798 717 HD12 ILE 97 1HD1 ILE 97 0.637 17.123 2.096 718 HD13 ILE 97 2HD1 ILE 97 0.273 17.196 3.821 719 HA PRO 98 HA PRO 98 1.670 10.057 3.770 720 HB2 PRO 98 2HB PRO 98 -1.034 8.996 2.863 721 HB3 PRO 98 1HB PRO 98 0.011 8.376 4.169 722 HG2 PRO 98 2HG PRO 98 -1.827 10.568 4.247 723 HG3 PRO 98 1HG PRO 98 -0.802 9.920 5.559 724 HD2 PRO 98 2HD PRO 98 -0.202 12.266 4.698 725 HD3 PRO 98 1HD PRO 98 1.116 11.074 4.768 726 H ARG 99 H ARG 99 2.399 8.024 2.785 727 HA ARG 99 HA ARG 99 2.299 8.107 -0.155 728 HB2 ARG 99 2HB ARG 99 4.514 8.171 1.700 729 HB3 ARG 99 1HB ARG 99 4.681 6.852 0.538 730 HG2 ARG 99 2HG ARG 99 5.768 8.897 -0.213 731 HG3 ARG 99 1HG ARG 99 4.468 8.411 -1.297 732 HD2 ARG 99 2HD ARG 99 3.421 10.144 0.724 733 HD3 ARG 99 1HD ARG 99 4.837 10.896 -0.007 734 HE ARG 99 HE ARG 99 3.110 9.848 -1.996 735 HH11 ARG 99 1HH1 ARG 99 3.453 12.510 0.234 736 HH12 ARG 99 2HH1 ARG 99 2.520 13.602 -0.731 737 HH21 ARG 99 1HH2 ARG 99 1.886 11.284 -3.270 738 HH22 ARG 99 2HH2 ARG 99 1.629 12.906 -2.721 739 H ILE 100 H ILE 100 3.695 5.851 -0.767 740 HA ILE 100 HA ILE 100 1.727 3.801 -0.225 741 HB ILE 100 HB ILE 100 4.211 3.674 -1.934 742 HG12 ILE 100 2HG1 ILE 100 2.361 3.781 -3.762 743 HG13 ILE 100 1HG1 ILE 100 1.365 4.460 -2.479 744 HG21 ILE 100 1HG2 ILE 100 2.078 1.730 -1.292 745 HG22 ILE 100 2HG2 ILE 100 3.767 1.462 -1.725 746 HG23 ILE 100 3HG2 ILE 100 2.580 1.825 -2.979 747 HD11 ILE 100 3HD1 ILE 100 4.034 5.656 -2.943 748 HD12 ILE 100 1HD1 ILE 100 2.528 6.409 -2.418 749 HD13 ILE 100 2HD1 ILE 100 2.756 5.979 -4.113 750 H LEU 101 H LEU 101 1.838 2.459 1.420 751 HA LEU 101 HA LEU 101 4.488 1.642 2.443 752 HB2 LEU 101 2HB LEU 101 1.902 2.127 3.926 753 HB3 LEU 101 1HB LEU 101 3.271 1.299 4.637 754 HG LEU 101 HG LEU 101 4.505 3.241 4.863 755 HD11 LEU 101 1HD1 LEU 101 4.567 4.073 2.661 756 HD12 LEU 101 2HD1 LEU 101 3.885 5.366 3.647 757 HD13 LEU 101 3HD1 LEU 101 2.829 4.372 2.645 758 HD21 LEU 101 3HD2 LEU 101 1.658 4.217 5.002 759 HD22 LEU 101 1HD2 LEU 101 3.049 4.912 5.833 760 HD23 LEU 101 2HD2 LEU 101 2.484 3.297 6.262 761 H PHE 102 H PHE 102 4.888 -0.537 2.287 762 HA PHE 102 HA PHE 102 2.659 -2.288 1.608 763 HB2 PHE 102 2HB PHE 102 5.492 -2.322 1.201 764 HB3 PHE 102 1HB PHE 102 5.029 -3.789 2.056 765 HD1 PHE 102 1HD PHE 102 2.675 -4.769 1.037 766 HD2 PHE 102 2HD PHE 102 5.642 -2.558 -1.065 767 HE1 PHE 102 1HE PHE 102 1.915 -5.767 -1.079 768 HE2 PHE 102 2HE PHE 102 4.886 -3.552 -3.185 769 HZ PHE 102 HZ PHE 102 3.021 -5.160 -3.194 770 H LEU 103 H LEU 103 1.750 -3.830 2.966 771 HA LEU 103 HA LEU 103 2.984 -4.123 5.615 772 HB2 LEU 103 2HB LEU 103 1.043 -3.620 6.808 773 HB3 LEU 103 1HB LEU 103 1.201 -2.348 5.617 774 HG LEU 103 HG LEU 103 -0.695 -4.678 5.491 775 HD11 LEU 103 1HD1 LEU 103 -1.060 -1.751 6.053 776 HD12 LEU 103 2HD1 LEU 103 -1.471 -3.116 7.084 777 HD13 LEU 103 3HD1 LEU 103 -2.386 -2.824 5.605 778 HD21 LEU 103 3HD2 LEU 103 -1.584 -3.233 3.538 779 HD22 LEU 103 1HD2 LEU 103 -0.182 -4.268 3.269 780 HD23 LEU 103 2HD2 LEU 103 0.039 -2.536 3.533 781 H ASP 104 H ASP 104 2.182 -5.910 6.885 782 HA ASP 104 HA ASP 104 2.049 -8.288 5.363 783 HB2 ASP 104 2HB ASP 104 1.934 -7.615 8.272 784 HB3 ASP 104 1HB ASP 104 1.455 -9.238 7.754 785 HA PRO 105 HA PRO 105 -2.205 -9.026 4.550 786 HB2 PRO 105 2HB PRO 105 -1.788 -11.781 5.569 787 HB3 PRO 105 1HB PRO 105 -2.364 -11.233 3.982 788 HG2 PRO 105 2HG PRO 105 0.105 -12.228 4.319 789 HG3 PRO 105 1HG PRO 105 -0.227 -10.907 3.175 790 HD2 PRO 105 2HD PRO 105 1.044 -10.815 5.873 791 HD3 PRO 105 1HD PRO 105 1.399 -9.857 4.423 792 H SER 106 H SER 106 -3.093 -7.748 6.229 793 HA SER 106 HA SER 106 -4.965 -8.758 7.852 794 HB2 SER 106 2HB SER 106 -2.298 -9.119 9.117 795 HB3 SER 106 1HB SER 106 -3.583 -8.483 10.158 796 HG SER 106 HG SER 106 -4.151 -10.498 10.319 797 H GLY 107 H GLY 107 -2.436 -6.426 7.463 798 HA2 GLY 107 2HA GLY 107 -3.119 -4.092 7.277 799 HA3 GLY 107 1HA GLY 107 -4.210 -4.379 8.637 800 H LYS 108 H LYS 108 -0.822 -5.388 8.261 801 HA LYS 108 HA LYS 108 -0.211 -3.724 10.627 802 HB2 LYS 108 2HB LYS 108 0.289 -6.536 10.058 803 HB3 LYS 108 1HB LYS 108 1.746 -5.681 10.545 804 HG2 LYS 108 2HG LYS 108 -0.607 -5.107 12.196 805 HG3 LYS 108 1HG LYS 108 -0.050 -6.789 12.250 806 HD2 LYS 108 2HD LYS 108 2.206 -5.026 12.396 807 HD3 LYS 108 1HD LYS 108 1.014 -4.551 13.607 808 HE2 LYS 108 2HE LYS 108 2.470 -6.145 14.618 809 HE3 LYS 108 1HE LYS 108 0.924 -6.943 14.335 810 HZ1 LYS 108 3HZ LYS 108 3.447 -7.269 12.821 811 HZ2 LYS 108 1HZ LYS 108 1.957 -7.791 12.214 812 HZ3 LYS 108 2HZ LYS 108 2.563 -8.450 13.648 813 H VAL 109 H VAL 109 0.297 -1.999 9.064 814 HA VAL 109 HA VAL 109 2.229 -2.059 7.105 815 HB VAL 109 HB VAL 109 1.246 0.071 8.952 816 HG11 VAL 109 1HG1 VAL 109 3.363 0.904 8.889 817 HG12 VAL 109 2HG1 VAL 109 2.707 1.612 7.412 818 HG13 VAL 109 3HG1 VAL 109 3.727 0.177 7.325 819 HG21 VAL 109 3HG2 VAL 109 1.150 -0.450 5.996 820 HG22 VAL 109 1HG2 VAL 109 0.708 1.109 6.690 821 HG23 VAL 109 2HG2 VAL 109 -0.188 -0.342 7.138 822 H HIS 110 H HIS 110 4.363 -2.004 6.996 823 HA HIS 110 HA HIS 110 5.952 -1.517 9.371 824 HB2 HIS 110 2HB HIS 110 5.431 -4.194 8.354 825 HB3 HIS 110 1HB HIS 110 7.152 -3.820 8.356 826 HD1 HIS 110 1HD HIS 110 4.435 -4.883 10.529 827 HD2 HIS 110 2HD HIS 110 8.123 -3.029 11.002 828 HE1 HIS 110 1HE HIS 110 4.998 -5.121 12.968 829 HE2 HIS 110 2HE HIS 110 7.275 -4.070 13.213 830 HA PRO 111 HA PRO 111 8.437 0.322 6.189 831 HB2 PRO 111 2HB PRO 111 10.724 0.694 7.610 832 HB3 PRO 111 1HB PRO 111 9.286 1.698 7.830 833 HG2 PRO 111 2HG PRO 111 10.241 -0.619 9.459 834 HG3 PRO 111 1HG PRO 111 9.576 0.930 10.004 835 HD2 PRO 111 2HD PRO 111 8.112 -1.347 9.918 836 HD3 PRO 111 1HD PRO 111 7.403 0.259 9.641 837 H GLU 112 H GLU 112 8.194 -2.464 6.047 838 HA GLU 112 HA GLU 112 10.901 -3.520 5.813 839 HB2 GLU 112 2HB GLU 112 9.702 -5.666 5.263 840 HB3 GLU 112 1HB GLU 112 9.392 -5.023 6.868 841 HG2 GLU 112 2HG GLU 112 7.268 -4.073 6.039 842 HG3 GLU 112 1HG GLU 112 7.576 -4.824 4.475 843 H ILE 113 H ILE 113 8.028 -3.042 3.749 844 HA ILE 113 HA ILE 113 9.820 -3.305 1.427 845 HB ILE 113 HB ILE 113 6.855 -3.832 1.505 846 HG12 ILE 113 2HG1 ILE 113 8.085 -5.569 2.681 847 HG13 ILE 113 1HG1 ILE 113 7.514 -6.192 1.125 848 HG21 ILE 113 1HG2 ILE 113 7.689 -2.946 -0.651 849 HG22 ILE 113 2HG2 ILE 113 7.086 -4.599 -0.771 850 HG23 ILE 113 3HG2 ILE 113 8.823 -4.294 -0.731 851 HD11 ILE 113 3HD1 ILE 113 9.643 -6.975 1.100 852 HD12 ILE 113 1HD1 ILE 113 10.272 -5.636 2.060 853 HD13 ILE 113 2HD1 ILE 113 9.913 -5.402 0.349 854 H ILE 114 H ILE 114 10.291 -1.511 0.500 855 HA ILE 114 HA ILE 114 8.275 0.607 0.182 856 HB ILE 114 HB ILE 114 9.878 2.318 0.644 857 HG12 ILE 114 2HG1 ILE 114 11.834 1.121 -0.382 858 HG13 ILE 114 1HG1 ILE 114 12.207 1.927 1.132 859 HG21 ILE 114 1HG2 ILE 114 8.806 0.936 2.558 860 HG22 ILE 114 2HG2 ILE 114 10.069 2.110 2.930 861 HG23 ILE 114 3HG2 ILE 114 10.457 0.392 2.849 862 HD11 ILE 114 3HD1 ILE 114 11.473 -0.635 1.886 863 HD12 ILE 114 1HD1 ILE 114 13.108 0.019 1.795 864 HD13 ILE 114 2HD1 ILE 114 12.429 -0.855 0.421 865 H ASN 115 H ASN 115 9.960 2.348 -1.261 866 HA ASN 115 HA ASN 115 10.250 0.840 -3.756 867 HB2 ASN 115 2HB ASN 115 8.800 2.804 -3.880 868 HB3 ASN 115 1HB ASN 115 10.101 3.821 -3.247 869 HD21 ASN 115 1HD2 ASN 115 9.486 4.976 -5.292 870 HD22 ASN 115 2HD2 ASN 115 10.351 4.523 -6.734 871 H GLU 116 H GLU 116 12.274 -0.107 -3.112 872 HA GLU 116 HA GLU 116 14.524 1.220 -2.228 873 HB2 GLU 116 2HB GLU 116 14.079 -1.261 -3.823 874 HB3 GLU 116 1HB GLU 116 15.728 -0.641 -3.674 875 HG2 GLU 116 2HG GLU 116 13.949 -1.162 -1.312 876 HG3 GLU 116 1HG GLU 116 15.030 -2.376 -1.990 877 H ASN 117 H ASN 117 13.072 1.292 -5.366 878 HA ASN 117 HA ASN 117 15.430 2.423 -6.630 879 HB2 ASN 117 2HB ASN 117 13.498 0.858 -7.638 880 HB3 ASN 117 1HB ASN 117 12.803 2.440 -8.021 881 HD21 ASN 117 1HD2 ASN 117 15.632 0.391 -8.421 882 HD22 ASN 117 2HD2 ASN 117 16.186 1.132 -9.898 883 H GLY 118 H GLY 118 13.178 3.639 -4.582 884 HA2 GLY 118 2HA GLY 118 12.636 6.121 -5.996 885 HA3 GLY 118 1HA GLY 118 12.113 5.703 -4.360 886 H ASN 119 H ASN 119 12.804 8.049 -4.132 887 HA ASN 119 HA ASN 119 15.476 8.847 -4.236 888 HB2 ASN 119 2HB ASN 119 13.000 9.922 -3.281 889 HB3 ASN 119 1HB ASN 119 14.240 10.183 -2.046 890 HD21 ASN 119 1HD2 ASN 119 12.862 11.366 -4.827 891 HD22 ASN 119 2HD2 ASN 119 14.111 12.493 -5.290 892 HA PRO 120 HA PRO 120 17.310 6.933 -0.706 893 HB2 PRO 120 2HB PRO 120 19.070 9.147 -0.162 894 HB3 PRO 120 1HB PRO 120 19.427 7.645 -1.030 895 HG2 PRO 120 2HG PRO 120 19.350 10.134 -2.201 896 HG3 PRO 120 1HG PRO 120 19.094 8.606 -3.071 897 HD2 PRO 120 2HD PRO 120 17.078 10.574 -2.049 898 HD3 PRO 120 1HD PRO 120 17.095 9.660 -3.580 899 H SER 121 H SER 121 14.900 8.311 0.015 900 HA SER 121 HA SER 121 15.231 8.504 2.803 901 HB2 SER 121 2HB SER 121 15.416 11.045 1.255 902 HB3 SER 121 1HB SER 121 14.415 11.061 2.715 903 HG SER 121 HG SER 121 16.556 11.608 3.214 904 H TYR 122 H TYR 122 13.477 9.527 -0.023 905 HA TYR 122 HA TYR 122 10.918 9.679 1.179 906 HB2 TYR 122 2HB TYR 122 12.138 10.062 -1.408 907 HB3 TYR 122 1HB TYR 122 10.615 9.187 -1.559 908 HD1 TYR 122 1HD TYR 122 8.631 10.265 -0.100 909 HD2 TYR 122 2HD TYR 122 12.082 12.346 -1.461 910 HE1 TYR 122 1HE TYR 122 7.429 12.397 0.128 911 HE2 TYR 122 2HE TYR 122 10.893 14.482 -1.236 912 HH TYR 122 HH TYR 122 8.805 15.275 0.300 913 H LYS 123 H LYS 123 12.471 7.273 -0.911 914 HA LYS 123 HA LYS 123 11.989 5.091 -1.369 915 HB2 LYS 123 2HB LYS 123 11.705 5.432 1.560 916 HB3 LYS 123 1HB LYS 123 11.072 3.935 0.891 917 HG2 LYS 123 2HG LYS 123 13.895 4.969 0.695 918 HG3 LYS 123 1HG LYS 123 13.318 3.570 1.618 919 HD2 LYS 123 2HD LYS 123 13.698 2.281 -0.150 920 HD3 LYS 123 1HD LYS 123 12.481 3.195 -1.053 921 HE2 LYS 123 2HE LYS 123 14.555 3.194 -2.275 922 HE3 LYS 123 1HE LYS 123 14.229 4.822 -1.685 923 HZ1 LYS 123 3HZ LYS 123 16.322 4.716 -0.946 924 HZ2 LYS 123 1HZ LYS 123 16.396 3.029 -1.042 925 HZ3 LYS 123 2HZ LYS 123 15.699 3.771 0.310 926 H TYR 124 H TYR 124 9.473 5.165 1.051 927 HA TYR 124 HA TYR 124 7.515 3.852 -0.221 928 HB2 TYR 124 2HB TYR 124 7.038 6.266 1.527 929 HB3 TYR 124 1HB TYR 124 5.905 4.943 1.238 930 HD1 TYR 124 2HD TYR 124 8.975 5.957 2.974 931 HD2 TYR 124 1HD TYR 124 6.209 2.793 2.317 932 HE1 TYR 124 2HE TYR 124 9.916 4.745 4.894 933 HE2 TYR 124 1HE TYR 124 7.141 1.573 4.236 934 HH TYR 124 HH TYR 124 10.039 2.221 5.594 935 H PHE 125 H PHE 125 8.479 7.118 -0.963 936 HA PHE 125 HA PHE 125 6.176 8.035 -2.263 937 HB2 PHE 125 2HB PHE 125 8.489 9.204 -1.711 938 HB3 PHE 125 1HB PHE 125 8.873 8.716 -3.367 939 HD1 PHE 125 1HD PHE 125 6.314 10.533 -1.369 940 HD2 PHE 125 2HD PHE 125 8.216 10.049 -5.145 941 HE1 PHE 125 1HE PHE 125 5.126 12.513 -2.218 942 HE2 PHE 125 2HE PHE 125 7.035 12.028 -5.999 943 HZ PHE 125 HZ PHE 125 5.487 13.263 -4.536 944 H TYR 126 H TYR 126 5.498 7.954 -4.420 945 HA TYR 126 HA TYR 126 6.977 6.270 -6.280 946 HB2 TYR 126 2HB TYR 126 4.489 5.469 -4.930 947 HB3 TYR 126 1HB TYR 126 4.458 5.281 -6.686 948 HD1 TYR 126 1HD TYR 126 7.318 4.549 -7.163 949 HD2 TYR 126 2HD TYR 126 4.571 3.259 -4.180 950 HE1 TYR 126 1HE TYR 126 8.548 2.430 -6.953 951 HE2 TYR 126 2HE TYR 126 5.795 1.138 -3.962 952 HH TYR 126 HH TYR 126 8.876 0.643 -5.312 953 H VAL 127 H VAL 127 7.226 8.291 -7.371 954 HA VAL 127 HA VAL 127 4.780 9.377 -8.574 955 HB VAL 127 HB VAL 127 6.224 11.011 -7.455 956 HG11 VAL 127 1HG1 VAL 127 8.312 9.536 -8.467 957 HG12 VAL 127 2HG1 VAL 127 8.439 11.111 -7.680 958 HG13 VAL 127 3HG1 VAL 127 8.352 11.008 -9.439 959 HG21 VAL 127 3HG2 VAL 127 5.780 12.605 -8.972 960 HG22 VAL 127 1HG2 VAL 127 5.036 11.287 -9.877 961 HG23 VAL 127 2HG2 VAL 127 6.685 11.790 -10.246 962 H SER 128 H SER 128 4.948 7.213 -9.798 963 HA SER 128 HA SER 128 5.143 7.476 -12.437 964 HB2 SER 128 2HB SER 128 7.899 7.278 -11.326 965 HB3 SER 128 1HB SER 128 7.552 6.328 -12.781 966 HG SER 128 HG SER 128 7.843 8.134 -13.801 967 H ALA 129 H ALA 129 4.106 5.714 -13.110 968 HA ALA 129 HA ALA 129 3.807 3.395 -11.565 969 HB1 ALA 129 1HB ALA 129 3.343 3.591 -14.531 970 HB2 ALA 129 2HB ALA 129 2.221 4.206 -13.317 971 HB3 ALA 129 3HB ALA 129 2.582 2.482 -13.392 972 H GLU 130 H GLU 130 6.308 4.330 -13.723 973 HA GLU 130 HA GLU 130 7.190 1.825 -14.626 974 HB2 GLU 130 2HB GLU 130 7.980 4.415 -15.013 975 HB3 GLU 130 1HB GLU 130 9.304 3.788 -14.022 976 HG2 GLU 130 2HG GLU 130 8.992 1.799 -15.859 977 HG3 GLU 130 1HG GLU 130 8.603 3.243 -16.810 978 H GLN 131 H GLN 131 8.203 3.735 -11.794 979 HA GLN 131 HA GLN 131 9.899 1.654 -10.847 980 HB2 GLN 131 2HB GLN 131 9.851 2.996 -8.704 981 HB3 GLN 131 1HB GLN 131 10.589 3.738 -10.117 982 HG2 GLN 131 2HG GLN 131 8.551 5.029 -10.504 983 HG3 GLN 131 1HG GLN 131 7.808 4.279 -9.092 984 HE21 GLN 131 1HE2 GLN 131 7.527 6.360 -8.196 985 HE22 GLN 131 2HE2 GLN 131 8.848 7.199 -7.464 986 H VAL 132 H VAL 132 6.658 2.796 -9.990 987 HA VAL 132 HA VAL 132 6.240 1.213 -7.753 988 HB VAL 132 HB VAL 132 4.002 1.705 -7.875 989 HG11 VAL 132 1HG1 VAL 132 4.407 3.879 -9.747 990 HG12 VAL 132 2HG1 VAL 132 5.721 3.733 -8.581 991 HG13 VAL 132 3HG1 VAL 132 4.059 3.918 -8.020 992 HG21 VAL 132 3HG2 VAL 132 3.137 0.617 -9.698 993 HG22 VAL 132 1HG2 VAL 132 4.287 1.349 -10.814 994 HG23 VAL 132 2HG2 VAL 132 2.940 2.298 -10.193 995 H VAL 133 H VAL 133 6.383 0.337 -11.094 996 HA VAL 133 HA VAL 133 5.074 -2.205 -10.676 997 HB VAL 133 HB VAL 133 4.924 -0.945 -12.851 998 HG11 VAL 133 1HG1 VAL 133 7.142 -1.929 -14.204 999 HG12 VAL 133 2HG1 VAL 133 7.788 -1.268 -12.705 1000 HG13 VAL 133 3HG1 VAL 133 6.823 -0.250 -13.771 1001 HG21 VAL 133 3HG2 VAL 133 4.836 -2.923 -14.164 1002 HG22 VAL 133 1HG2 VAL 133 4.418 -3.387 -12.515 1003 HG23 VAL 133 2HG2 VAL 133 6.029 -3.731 -13.145 1004 H GLN 134 H GLN 134 8.381 -0.955 -10.757 1005 HA GLN 134 HA GLN 134 9.484 -3.634 -10.968 1006 HB2 GLN 134 2HB GLN 134 11.632 -2.351 -10.166 1007 HB3 GLN 134 1HB GLN 134 11.036 -2.154 -11.807 1008 HG2 GLN 134 2HG GLN 134 9.947 -0.083 -11.176 1009 HG3 GLN 134 1HG GLN 134 10.511 -0.281 -9.518 1010 HE21 GLN 134 1HE2 GLN 134 13.067 -1.044 -9.792 1011 HE22 GLN 134 2HE2 GLN 134 13.997 0.189 -10.601 1012 H GLY 135 H GLY 135 8.955 -1.251 -8.428 1013 HA2 GLY 135 2HA GLY 135 10.052 -2.870 -6.342 1014 HA3 GLY 135 1HA GLY 135 9.024 -1.443 -6.131 1015 H MET 136 H MET 136 7.054 -2.785 -8.047 1016 HA MET 136 HA MET 136 5.601 -4.213 -5.965 1017 HB2 MET 136 2HB MET 136 4.339 -2.596 -7.221 1018 HB3 MET 136 1HB MET 136 4.842 -3.311 -8.746 1019 HG2 MET 136 2HG MET 136 3.538 -5.263 -7.085 1020 HG3 MET 136 1HG MET 136 2.523 -3.839 -7.301 1021 HE1 MET 136 3HE MET 136 0.928 -6.043 -8.513 1022 HE2 MET 136 1HE MET 136 0.668 -5.368 -10.122 1023 HE3 MET 136 2HE MET 136 0.699 -4.307 -8.718 1024 H LYS 137 H LYS 137 6.913 -4.788 -9.184 1025 HA LYS 137 HA LYS 137 6.052 -7.466 -9.408 1026 HB2 LYS 137 2HB LYS 137 7.331 -7.591 -11.372 1027 HB3 LYS 137 1HB LYS 137 6.801 -5.921 -11.285 1028 HG2 LYS 137 2HG LYS 137 9.078 -5.461 -10.203 1029 HG3 LYS 137 1HG LYS 137 9.532 -7.053 -10.810 1030 HD2 LYS 137 2HD LYS 137 8.600 -4.680 -12.422 1031 HD3 LYS 137 1HD LYS 137 10.210 -5.401 -12.417 1032 HE2 LYS 137 2HE LYS 137 7.773 -6.968 -13.214 1033 HE3 LYS 137 1HE LYS 137 8.648 -5.965 -14.369 1034 HZ1 LYS 137 3HZ LYS 137 10.652 -7.352 -13.301 1035 HZ2 LYS 137 1HZ LYS 137 9.802 -7.854 -14.677 1036 HZ3 LYS 137 2HZ LYS 137 9.410 -8.492 -13.161 1037 H GLU 138 H GLU 138 8.439 -6.056 -7.491 1038 HA GLU 138 HA GLU 138 10.090 -8.450 -7.356 1039 HB2 GLU 138 2HB GLU 138 10.683 -5.771 -7.114 1040 HB3 GLU 138 1HB GLU 138 10.665 -6.315 -5.437 1041 HG2 GLU 138 2HG GLU 138 12.153 -7.963 -7.405 1042 HG3 GLU 138 1HG GLU 138 12.846 -6.403 -6.934 1043 H ALA 139 H ALA 139 8.653 -6.317 -4.906 1044 HA ALA 139 HA ALA 139 8.726 -8.165 -2.816 1045 HB1 ALA 139 1HB ALA 139 8.112 -5.543 -3.002 1046 HB2 ALA 139 2HB ALA 139 7.818 -6.535 -1.575 1047 HB3 ALA 139 3HB ALA 139 6.514 -6.238 -2.724 1048 H GLN 140 H GLN 140 6.574 -7.979 -5.491 1049 HA GLN 140 HA GLN 140 4.280 -9.107 -4.371 1050 HB2 GLN 140 2HB GLN 140 3.741 -9.766 -6.717 1051 HB3 GLN 140 1HB GLN 140 4.133 -8.063 -6.504 1052 HG2 GLN 140 2HG GLN 140 5.190 -8.778 -8.480 1053 HG3 GLN 140 1HG GLN 140 6.446 -8.619 -7.258 1054 HE21 GLN 140 1HE2 GLN 140 4.125 -11.170 -8.090 1055 HE22 GLN 140 2HE2 GLN 140 5.302 -12.423 -8.254 1056 H GLU 141 H GLU 141 7.320 -10.543 -4.950 1057 HA GLU 141 HA GLU 141 6.119 -13.200 -4.649 1058 HB2 GLU 141 2HB GLU 141 7.894 -14.166 -5.969 1059 HB3 GLU 141 1HB GLU 141 7.038 -12.922 -6.893 1060 HG2 GLU 141 2HG GLU 141 8.779 -11.329 -6.296 1061 HG3 GLU 141 1HG GLU 141 9.640 -12.611 -5.460 1062 H ARG 142 H ARG 142 8.830 -11.119 -3.851 1063 HA ARG 142 HA ARG 142 10.024 -13.094 -2.120 1064 HB2 ARG 142 2HB ARG 142 11.599 -11.253 -1.514 1065 HB3 ARG 142 1HB ARG 142 11.525 -11.602 -3.244 1066 HG2 ARG 142 2HG ARG 142 11.465 -9.333 -3.304 1067 HG3 ARG 142 1HG ARG 142 9.729 -9.668 -3.198 1068 HD2 ARG 142 2HD ARG 142 10.412 -7.891 -1.654 1069 HD3 ARG 142 1HD ARG 142 9.789 -9.307 -0.793 1070 HE ARG 142 HE ARG 142 11.873 -9.639 0.116 1071 HH11 ARG 142 1HH1 ARG 142 12.105 -7.289 -2.455 1072 HH12 ARG 142 2HH1 ARG 142 13.730 -6.839 -2.064 1073 HH21 ARG 142 1HH2 ARG 142 14.010 -9.049 0.628 1074 HH22 ARG 142 2HH2 ARG 142 14.812 -7.838 -0.314 1075 H LEU 143 H LEU 143 7.664 -10.607 -1.803 1076 HA LEU 143 HA LEU 143 7.918 -10.659 1.118 1077 HB2 LEU 143 2HB LEU 143 7.519 -8.479 0.989 1078 HB3 LEU 143 1HB LEU 143 7.317 -8.604 -0.756 1079 HG LEU 143 HG LEU 143 4.887 -9.208 -0.291 1080 HD11 LEU 143 1HD1 LEU 143 5.869 -8.998 2.411 1081 HD12 LEU 143 2HD1 LEU 143 4.317 -9.592 1.823 1082 HD13 LEU 143 3HD1 LEU 143 4.541 -7.871 2.134 1083 HD21 LEU 143 3HD2 LEU 143 6.238 -6.696 -0.357 1084 HD22 LEU 143 1HD2 LEU 143 4.838 -6.567 0.709 1085 HD23 LEU 143 2HD2 LEU 143 4.631 -7.107 -0.957 1086 H THR 144 H THR 144 5.864 -11.623 -1.508 1087 HA THR 144 HA THR 144 3.522 -12.095 0.048 1088 HB THR 144 HB THR 144 2.801 -13.380 -1.977 1089 HG1 THR 144 1HG THR 144 4.816 -14.076 -2.703 1090 HG21 THR 144 3HG2 THR 144 2.419 -11.546 -3.337 1091 HG22 THR 144 1HG2 THR 144 3.936 -10.771 -2.879 1092 HG23 THR 144 2HG2 THR 144 2.599 -10.839 -1.731 1093 H GLY 145 H GLY 145 3.800 -13.470 1.742 1094 HA2 GLY 145 2HA GLY 145 3.473 -15.839 2.255 1095 HA3 GLY 145 1HA GLY 145 4.712 -16.196 1.062 1096 H ASP 146 H ASP 146 5.150 -13.514 3.223 1097 HA ASP 146 HA ASP 146 6.731 -13.090 4.808 1098 HB2 ASP 146 2HB ASP 146 5.630 -15.760 5.515 1099 HB3 ASP 146 1HB ASP 146 7.101 -15.255 6.343 1100 H ALA 147 H ALA 147 7.614 -14.150 2.216 1101 HA ALA 147 HA ALA 147 10.003 -15.678 2.928 1102 HB1 ALA 147 1HB ALA 147 8.511 -15.180 0.410 1103 HB2 ALA 147 2HB ALA 147 9.177 -16.680 1.054 1104 HB3 ALA 147 3HB ALA 147 10.242 -15.496 0.297 1105 H PHE 148 H PHE 148 9.585 -12.789 3.573 1106 HA PHE 148 HA PHE 148 11.891 -11.685 2.111 1107 HB2 PHE 148 2HB PHE 148 10.968 -9.448 2.604 1108 HB3 PHE 148 1HB PHE 148 9.844 -10.429 1.655 1109 HD1 PHE 148 2HD PHE 148 7.937 -11.569 2.863 1110 HD2 PHE 148 1HD PHE 148 10.329 -8.536 4.651 1111 HE1 PHE 148 2HE PHE 148 6.181 -11.179 4.540 1112 HE2 PHE 148 1HE PHE 148 8.578 -8.143 6.334 1113 HZ PHE 148 HZ PHE 148 6.500 -9.464 6.279 1114 H ARG 149 H ARG 149 10.290 -11.981 5.242 1115 HA ARG 149 HA ARG 149 11.993 -10.519 6.839 1116 HB2 ARG 149 2HB ARG 149 10.792 -13.155 7.658 1117 HB3 ARG 149 1HB ARG 149 11.146 -11.768 8.673 1118 HG2 ARG 149 2HG ARG 149 9.436 -10.545 7.151 1119 HG3 ARG 149 1HG ARG 149 8.902 -12.180 6.760 1120 HD2 ARG 149 2HD ARG 149 9.216 -11.206 9.579 1121 HD3 ARG 149 1HD ARG 149 7.713 -11.018 8.681 1122 HE ARG 149 HE ARG 149 8.018 -13.597 8.412 1123 HH11 ARG 149 1HH1 ARG 149 8.657 -11.683 11.271 1124 HH12 ARG 149 2HH1 ARG 149 8.340 -12.991 12.361 1125 HH21 ARG 149 1HH2 ARG 149 7.601 -15.305 9.850 1126 HH22 ARG 149 2HH2 ARG 149 7.741 -15.043 11.557 1127 H LYS 150 H LYS 150 14.146 -10.702 6.245 1128 HA LYS 150 HA LYS 150 15.495 -13.063 7.279 1129 HB2 LYS 150 2HB LYS 150 15.013 -13.219 4.707 1130 HB3 LYS 150 1HB LYS 150 16.349 -12.084 4.581 1131 HG2 LYS 150 2HG LYS 150 17.890 -13.641 5.071 1132 HG3 LYS 150 1HG LYS 150 16.868 -14.422 6.279 1133 HD2 LYS 150 2HD LYS 150 15.578 -15.494 4.501 1134 HD3 LYS 150 1HD LYS 150 16.582 -14.698 3.287 1135 HE2 LYS 150 2HE LYS 150 17.652 -16.706 3.386 1136 HE3 LYS 150 1HE LYS 150 18.521 -15.861 4.667 1137 HZ1 LYS 150 3HZ LYS 150 17.934 -17.931 5.555 1138 HZ2 LYS 150 1HZ LYS 150 16.356 -17.859 4.946 1139 HZ3 LYS 150 2HZ LYS 150 16.818 -16.851 6.223 1140 H LYS 151 H LYS 151 15.244 -10.290 8.104 1141 HA LYS 151 HA LYS 151 16.530 -8.633 8.977 1142 HB2 LYS 151 2HB LYS 151 18.846 -10.489 8.403 1143 HB3 LYS 151 1HB LYS 151 18.849 -9.127 9.516 1144 HG2 LYS 151 2HG LYS 151 16.857 -10.454 10.613 1145 HG3 LYS 151 1HG LYS 151 17.636 -11.822 9.813 1146 HD2 LYS 151 2HD LYS 151 19.200 -9.903 11.509 1147 HD3 LYS 151 1HD LYS 151 18.337 -11.267 12.223 1148 HE2 LYS 151 2HE LYS 151 19.794 -12.783 11.406 1149 HE3 LYS 151 1HE LYS 151 20.016 -11.908 9.892 1150 HZ1 LYS 151 3HZ LYS 151 21.239 -10.251 11.531 1151 HZ2 LYS 151 1HZ LYS 151 22.038 -11.556 10.810 1152 HZ3 LYS 151 2HZ LYS 151 21.481 -11.680 12.403 1153 H HIS 152 H HIS 152 16.439 -6.912 7.671 1154 HA HIS 152 HA HIS 152 18.631 -6.413 5.873 1155 HB2 HIS 152 2HB HIS 152 15.818 -6.705 4.810 1156 HB3 HIS 152 1HB HIS 152 17.111 -5.892 3.935 1157 HD1 HIS 152 1HD HIS 152 19.103 -7.403 3.107 1158 HD2 HIS 152 2HD HIS 152 15.861 -9.464 4.691 1159 HE1 HIS 152 1HE HIS 152 19.412 -9.793 2.391 1160 HE2 HIS 152 2HE HIS 152 17.383 -10.999 3.271 1161 H LEU 153 H LEU 153 19.029 -4.677 7.260 1162 HA LEU 153 HA LEU 153 18.920 -2.521 7.976 1163 HB2 LEU 153 2HB LEU 153 17.304 -2.467 5.469 1164 HB3 LEU 153 1HB LEU 153 17.279 -1.056 6.508 1165 HG LEU 153 HG LEU 153 18.930 -0.790 4.746 1166 HD11 LEU 153 1HD1 LEU 153 20.714 -1.244 7.048 1167 HD12 LEU 153 2HD1 LEU 153 19.307 -0.225 7.348 1168 HD13 LEU 153 3HD1 LEU 153 20.452 0.205 6.079 1169 HD21 LEU 153 3HD2 LEU 153 20.478 -2.324 4.157 1170 HD22 LEU 153 1HD2 LEU 153 19.327 -3.443 4.886 1171 HD23 LEU 153 2HD2 LEU 153 20.717 -2.880 5.814 1172 H GLU 154 H GLU 154 17.208 -4.450 9.199 1173 HA GLU 154 HA GLU 154 15.294 -2.626 10.406 1174 HB2 GLU 154 2HB GLU 154 14.498 -4.609 8.511 1175 HB3 GLU 154 1HB GLU 154 13.900 -5.088 10.093 1176 HG2 GLU 154 2HG GLU 154 13.465 -2.363 8.901 1177 HG3 GLU 154 1HG GLU 154 12.329 -3.701 8.738 1178 H ASP 155 H ASP 155 16.343 -6.033 10.349 1179 HA ASP 155 HA ASP 155 15.805 -6.505 13.084 1180 HB2 ASP 155 2HB ASP 155 16.733 -8.005 10.859 1181 HB3 ASP 155 1HB ASP 155 17.904 -8.220 12.156 1182 H GLU 156 H GLU 156 17.843 -7.490 14.385 1183 HA GLU 156 HA GLU 156 19.659 -7.007 15.659 1184 HB2 GLU 156 2HB GLU 156 20.464 -5.636 13.095 1185 HB3 GLU 156 1HB GLU 156 21.513 -5.673 14.517 1186 HG2 GLU 156 2HG GLU 156 20.425 -8.126 13.152 1187 HG3 GLU 156 1HG GLU 156 22.005 -7.418 12.816 1188 H LEU 157 H LEU 157 19.646 -3.947 13.867 1189 HA LEU 157 HA LEU 157 19.699 -2.442 16.303 1190 HB2 LEU 157 2HB LEU 157 20.498 -1.978 13.720 1191 HB3 LEU 157 1HB LEU 157 19.062 -0.980 13.842 1192 HG LEU 157 HG LEU 157 20.978 -0.730 16.077 1193 HD11 LEU 157 1HD1 LEU 157 21.659 0.694 13.542 1194 HD12 LEU 157 2HD1 LEU 157 22.291 -0.926 13.842 1195 HD13 LEU 157 3HD1 LEU 157 22.657 0.387 14.962 1196 HD21 LEU 157 3HD2 LEU 157 18.885 0.598 15.809 1197 HD22 LEU 157 1HD2 LEU 157 19.598 1.336 14.374 1198 HD23 LEU 157 2HD2 LEU 157 20.348 1.574 15.951 Start of MODEL 15 1 H1 MET 1 1HT MET 1 -25.665 -15.710 12.722 2 H2 MET 1 2HT MET 1 -24.312 -16.342 11.876 3 H3 MET 1 3HT MET 1 -25.808 -17.183 11.859 4 HA MET 1 HA MET 1 -25.376 -16.018 9.810 5 HB2 MET 1 2HB MET 1 -27.673 -15.374 11.618 6 HB3 MET 1 1HB MET 1 -27.591 -14.607 10.038 7 HG2 MET 1 2HG MET 1 -28.766 -16.413 9.414 8 HG3 MET 1 1HG MET 1 -27.168 -17.150 9.316 9 HE1 MET 1 2HE MET 1 -30.534 -17.717 12.203 10 HE2 MET 1 3HE MET 1 -30.620 -18.562 10.657 11 HE3 MET 1 1HE MET 1 -30.420 -16.808 10.696 12 H HIS 2 H HIS 2 -24.235 -14.408 8.973 13 HA HIS 2 HA HIS 2 -23.233 -12.390 8.664 14 HB2 HIS 2 2HB HIS 2 -25.547 -11.428 10.359 15 HB3 HIS 2 1HB HIS 2 -24.450 -10.374 9.471 16 HD1 HIS 2 1HD HIS 2 -25.228 -9.740 7.212 17 HD2 HIS 2 2HD HIS 2 -26.943 -13.302 8.493 18 HE1 HIS 2 1HE HIS 2 -26.853 -10.391 5.407 19 HE2 HIS 2 2HE HIS 2 -27.815 -12.593 6.163 20 H HIS 3 H HIS 3 -21.300 -12.167 9.567 21 HA HIS 3 HA HIS 3 -21.160 -11.680 12.472 22 HB2 HIS 3 2HB HIS 3 -19.667 -13.527 10.739 23 HB3 HIS 3 1HB HIS 3 -18.651 -12.569 11.813 24 HD1 HIS 3 1HD HIS 3 -20.591 -15.599 11.723 25 HD2 HIS 3 2HD HIS 3 -19.553 -12.827 14.638 26 HE1 HIS 3 1HE HIS 3 -20.971 -16.762 13.920 27 HE2 HIS 3 2HE HIS 3 -20.252 -15.095 15.668 28 H HIS 4 H HIS 4 -21.082 -9.478 12.476 29 HA HIS 4 HA HIS 4 -20.210 -7.387 12.287 30 HB2 HIS 4 2HB HIS 4 -17.796 -9.121 11.926 31 HB3 HIS 4 1HB HIS 4 -17.655 -7.384 11.682 32 HD1 HIS 4 1HD HIS 4 -17.122 -6.084 13.717 33 HD2 HIS 4 2HD HIS 4 -18.922 -9.717 14.628 34 HE1 HIS 4 1HE HIS 4 -17.112 -6.229 16.227 35 HE2 HIS 4 2HE HIS 4 -18.284 -8.395 16.757 36 H HIS 5 H HIS 5 -18.903 -5.913 10.694 37 HA HIS 5 HA HIS 5 -18.817 -4.941 8.640 38 HB2 HIS 5 2HB HIS 5 -18.573 -7.849 7.910 39 HB3 HIS 5 1HB HIS 5 -18.614 -6.604 6.667 40 HD1 HIS 5 1HD HIS 5 -16.805 -6.197 9.948 41 HD2 HIS 5 2HD HIS 5 -15.966 -6.817 5.926 42 HE1 HIS 5 1HE HIS 5 -14.316 -5.909 9.729 43 HE2 HIS 5 2HE HIS 5 -13.821 -6.383 7.304 44 H HIS 6 H HIS 6 -20.091 -4.413 6.767 45 HA HIS 6 HA HIS 6 -22.457 -5.730 6.039 46 HB2 HIS 6 2HB HIS 6 -22.752 -4.442 8.477 47 HB3 HIS 6 1HB HIS 6 -23.425 -3.293 7.325 48 HD1 HIS 6 1HD HIS 6 -23.724 -7.070 7.791 49 HD2 HIS 6 2HD HIS 6 -26.073 -3.715 7.085 50 HE1 HIS 6 1HE HIS 6 -26.086 -7.922 7.638 51 HE2 HIS 6 2HE HIS 6 -27.478 -5.885 7.129 52 H HIS 7 H HIS 7 -24.044 -3.925 4.998 53 HA HIS 7 HA HIS 7 -22.302 -2.447 3.172 54 HB2 HIS 7 2HB HIS 7 -24.368 -2.238 1.780 55 HB3 HIS 7 1HB HIS 7 -23.887 -3.904 2.088 56 HD1 HIS 7 1HD HIS 7 -26.536 -1.392 2.941 57 HD2 HIS 7 2HD HIS 7 -25.693 -5.413 3.579 58 HE1 HIS 7 1HE HIS 7 -28.647 -2.382 3.887 59 HE2 HIS 7 2HE HIS 7 -28.085 -4.795 4.344 60 H MET 8 H MET 8 -22.183 -0.290 3.131 61 HA MET 8 HA MET 8 -24.314 1.361 4.171 62 HB2 MET 8 2HB MET 8 -22.280 0.587 5.923 63 HB3 MET 8 1HB MET 8 -21.838 2.224 5.422 64 HG2 MET 8 2HG MET 8 -23.329 3.071 6.810 65 HG3 MET 8 1HG MET 8 -24.620 2.186 5.998 66 HE1 MET 8 3HE MET 8 -21.943 2.285 8.608 67 HE2 MET 8 1HE MET 8 -21.582 0.581 8.337 68 HE3 MET 8 2HE MET 8 -22.392 1.087 9.820 69 H SER 9 H SER 9 -20.886 1.378 3.216 70 HA SER 9 HA SER 9 -19.675 2.754 1.878 71 HB2 SER 9 2HB SER 9 -20.712 3.369 -0.263 72 HB3 SER 9 1HB SER 9 -21.090 1.702 0.169 73 HG SER 9 HG SER 9 -23.121 2.211 0.199 74 H ASP 10 H ASP 10 -22.638 4.560 1.231 75 HA ASP 10 HA ASP 10 -23.276 6.690 1.713 76 HB2 ASP 10 2HB ASP 10 -22.402 5.766 4.104 77 HB3 ASP 10 1HB ASP 10 -21.294 7.115 3.868 78 H GLY 11 H GLY 11 -19.816 6.749 2.584 79 HA2 GLY 11 2HA GLY 11 -18.503 7.626 0.480 80 HA3 GLY 11 1HA GLY 11 -19.474 9.054 0.809 81 H HIS 12 H HIS 12 -16.724 7.199 1.718 82 HA HIS 12 HA HIS 12 -16.160 9.085 3.908 83 HB2 HIS 12 2HB HIS 12 -15.402 6.205 3.490 84 HB3 HIS 12 1HB HIS 12 -14.448 7.243 4.558 85 HD1 HIS 12 1HD HIS 12 -15.757 8.246 6.655 86 HD2 HIS 12 2HD HIS 12 -17.716 5.223 4.583 87 HE1 HIS 12 1HE HIS 12 -17.576 7.443 8.196 88 HE2 HIS 12 2HE HIS 12 -18.703 5.568 6.948 89 H ASN 13 H ASN 13 -14.889 7.551 1.016 90 HA ASN 13 HA ASN 13 -13.216 9.709 0.370 91 HB2 ASN 13 2HB ASN 13 -11.000 8.603 0.695 92 HB3 ASN 13 1HB ASN 13 -11.811 9.014 2.202 93 HD21 ASN 13 1HD2 ASN 13 -12.057 7.475 3.669 94 HD22 ASN 13 2HD2 ASN 13 -11.818 5.785 3.402 95 H GLY 14 H GLY 14 -11.810 9.239 -1.520 96 HA2 GLY 14 2HA GLY 14 -13.209 7.760 -3.466 97 HA3 GLY 14 1HA GLY 14 -11.572 8.404 -3.647 98 H LEU 15 H LEU 15 -10.922 6.539 -4.797 99 HA LEU 15 HA LEU 15 -9.699 4.553 -3.260 100 HB2 LEU 15 2HB LEU 15 -11.094 2.592 -4.055 101 HB3 LEU 15 1HB LEU 15 -11.773 3.573 -2.770 102 HG LEU 15 HG LEU 15 -12.867 4.783 -4.938 103 HD11 LEU 15 1HD1 LEU 15 -12.246 3.432 -6.677 104 HD12 LEU 15 2HD1 LEU 15 -13.761 2.667 -6.202 105 HD13 LEU 15 3HD1 LEU 15 -12.224 1.975 -5.686 106 HD21 LEU 15 3HD2 LEU 15 -14.901 3.485 -4.408 107 HD22 LEU 15 1HD2 LEU 15 -14.089 4.104 -2.971 108 HD23 LEU 15 2HD2 LEU 15 -13.922 2.405 -3.414 109 H GLY 16 H GLY 16 -8.497 5.912 -5.096 110 HA2 GLY 16 2HA GLY 16 -7.237 5.760 -7.022 111 HA3 GLY 16 1HA GLY 16 -7.545 4.038 -6.939 112 H LYS 17 H LYS 17 -9.029 7.097 -7.946 113 HA LYS 17 HA LYS 17 -10.177 5.681 -10.252 114 HB2 LYS 17 2HB LYS 17 -11.592 7.605 -8.407 115 HB3 LYS 17 1HB LYS 17 -12.186 7.223 -10.017 116 HG2 LYS 17 2HG LYS 17 -13.068 5.298 -9.338 117 HG3 LYS 17 1HG LYS 17 -11.600 4.838 -8.474 118 HD2 LYS 17 2HD LYS 17 -13.519 5.033 -6.960 119 HD3 LYS 17 1HD LYS 17 -12.266 6.214 -6.577 120 HE2 LYS 17 2HE LYS 17 -13.503 7.984 -7.526 121 HE3 LYS 17 1HE LYS 17 -14.611 6.877 -8.336 122 HZ1 LYS 17 3HZ LYS 17 -15.139 8.103 -6.021 123 HZ2 LYS 17 1HZ LYS 17 -14.522 6.633 -5.453 124 HZ3 LYS 17 2HZ LYS 17 -15.851 6.645 -6.497 125 H GLY 18 H GLY 18 -9.701 6.624 -12.132 126 HA2 GLY 18 2HA GLY 18 -9.771 8.747 -13.416 127 HA3 GLY 18 1HA GLY 18 -8.872 9.465 -12.076 128 H PHE 19 H PHE 19 -6.951 7.557 -11.607 129 HA PHE 19 HA PHE 19 -5.342 7.783 -14.046 130 HB2 PHE 19 2HB PHE 19 -3.487 7.056 -12.306 131 HB3 PHE 19 1HB PHE 19 -4.049 8.731 -12.391 132 HD1 PHE 19 1HD PHE 19 -5.631 9.579 -10.696 133 HD2 PHE 19 2HD PHE 19 -3.850 5.726 -10.379 134 HE1 PHE 19 1HE PHE 19 -6.237 9.500 -8.313 135 HE2 PHE 19 2HE PHE 19 -4.457 5.641 -7.996 136 HZ PHE 19 HZ PHE 19 -5.651 7.527 -6.960 137 H GLY 20 H GLY 20 -6.189 5.444 -11.513 138 HA2 GLY 20 2HA GLY 20 -5.325 3.295 -13.348 139 HA3 GLY 20 1HA GLY 20 -5.350 3.153 -11.590 140 H ASP 21 H ASP 21 -7.047 2.149 -10.715 141 HA ASP 21 HA ASP 21 -9.713 2.510 -11.344 142 HB2 ASP 21 2HB ASP 21 -8.356 0.635 -13.150 143 HB3 ASP 21 1HB ASP 21 -9.797 -0.043 -12.375 144 H HIS 22 H HIS 22 -8.499 -0.788 -11.120 145 HA HIS 22 HA HIS 22 -9.225 -0.809 -8.263 146 HB2 HIS 22 2HB HIS 22 -9.993 -3.157 -8.604 147 HB3 HIS 22 1HB HIS 22 -10.953 -1.978 -9.490 148 HD1 HIS 22 1HD HIS 22 -10.548 -1.878 -12.106 149 HD2 HIS 22 2HD HIS 22 -8.753 -5.071 -10.146 150 HE1 HIS 22 1HE HIS 22 -9.922 -3.510 -13.915 151 HE2 HIS 22 2HE HIS 22 -8.761 -5.394 -12.711 152 H ILE 23 H ILE 23 -7.094 -0.567 -7.596 153 HA ILE 23 HA ILE 23 -5.463 -2.973 -7.839 154 HB ILE 23 HB ILE 23 -4.460 -0.201 -8.490 155 HG12 ILE 23 2HG1 ILE 23 -3.752 -1.755 -10.583 156 HG13 ILE 23 1HG1 ILE 23 -5.249 -2.548 -10.102 157 HG21 ILE 23 1HG2 ILE 23 -2.338 -0.881 -8.318 158 HG22 ILE 23 2HG2 ILE 23 -2.697 -2.525 -8.840 159 HG23 ILE 23 3HG2 ILE 23 -3.016 -2.039 -7.173 160 HD11 ILE 23 3HD1 ILE 23 -6.510 -0.879 -10.876 161 HD12 ILE 23 1HD1 ILE 23 -5.064 -0.412 -11.771 162 HD13 ILE 23 2HD1 ILE 23 -5.435 0.362 -10.231 163 H HIS 24 H HIS 24 -4.230 0.123 -6.698 164 HA HIS 24 HA HIS 24 -3.888 -1.022 -4.075 165 HB2 HIS 24 2HB HIS 24 -3.075 1.786 -4.645 166 HB3 HIS 24 1HB HIS 24 -2.280 0.574 -3.639 167 HD1 HIS 24 1HD HIS 24 -1.470 2.419 -6.402 168 HD2 HIS 24 2HD HIS 24 -1.473 -1.681 -5.752 169 HE1 HIS 24 1HE HIS 24 0.170 1.465 -8.054 170 HE2 HIS 24 2HE HIS 24 0.035 -1.023 -7.733 171 H TRP 25 H TRP 25 -6.499 -0.609 -4.793 172 HA TRP 25 HA TRP 25 -7.445 0.959 -2.589 173 HB2 TRP 25 2HB TRP 25 -9.000 2.118 -4.506 174 HB3 TRP 25 1HB TRP 25 -7.556 2.857 -3.809 175 HD1 TRP 25 HD TRP 25 -8.791 1.114 -6.967 176 HE1 TRP 25 1HE TRP 25 -7.085 1.495 -8.843 177 HE3 TRP 25 3HE TRP 25 -5.061 3.374 -4.294 178 HZ2 TRP 25 2HZ TRP 25 -4.532 2.612 -9.178 179 HZ3 TRP 25 3HZ TRP 25 -3.034 4.063 -5.462 180 HH2 TRP 25 HH TRP 25 -2.762 3.693 -7.862 181 H ARG 26 H ARG 26 -7.535 -1.721 -4.163 182 HA ARG 26 HA ARG 26 -10.057 -2.257 -5.097 183 HB2 ARG 26 2HB ARG 26 -7.789 -3.810 -4.132 184 HB3 ARG 26 1HB ARG 26 -9.331 -4.602 -3.787 185 HG2 ARG 26 2HG ARG 26 -9.047 -3.528 -6.512 186 HG3 ARG 26 1HG ARG 26 -7.964 -4.860 -6.100 187 HD2 ARG 26 2HD ARG 26 -10.143 -5.954 -5.154 188 HD3 ARG 26 1HD ARG 26 -10.950 -4.802 -6.232 189 HE ARG 26 HE ARG 26 -9.129 -5.974 -7.847 190 HH11 ARG 26 1HH1 ARG 26 -11.556 -7.254 -5.691 191 HH12 ARG 26 2HH1 ARG 26 -11.814 -8.685 -6.630 192 HH21 ARG 26 1HH2 ARG 26 -9.467 -7.855 -9.083 193 HH22 ARG 26 2HH2 ARG 26 -10.628 -9.027 -8.556 194 H THR 27 H THR 27 -8.857 -2.684 -1.774 195 HA THR 27 HA THR 27 -11.064 -1.716 -0.444 196 HB THR 27 HB THR 27 -11.828 -4.259 0.244 197 HG1 THR 27 1HG THR 27 -11.930 -4.427 -2.525 198 HG21 THR 27 3HG2 THR 27 -13.617 -3.692 -1.737 199 HG22 THR 27 1HG2 THR 27 -12.979 -2.100 -1.330 200 HG23 THR 27 2HG2 THR 27 -13.699 -3.107 -0.075 201 H LEU 28 H LEU 28 -10.890 -1.868 1.784 202 HA LEU 28 HA LEU 28 -8.347 -2.940 2.729 203 HB2 LEU 28 2HB LEU 28 -9.013 -0.604 3.265 204 HB3 LEU 28 1HB LEU 28 -10.381 -1.239 4.182 205 HG LEU 28 HG LEU 28 -7.586 -2.069 4.884 206 HD11 LEU 28 1HD1 LEU 28 -7.586 -0.197 6.538 207 HD12 LEU 28 2HD1 LEU 28 -8.957 0.492 5.669 208 HD13 LEU 28 3HD1 LEU 28 -7.402 0.306 4.858 209 HD21 LEU 28 3HD2 LEU 28 -9.027 -3.319 6.143 210 HD22 LEU 28 1HD2 LEU 28 -10.277 -2.075 6.151 211 HD23 LEU 28 2HD2 LEU 28 -8.861 -1.910 7.190 212 H GLU 29 H GLU 29 -11.798 -3.074 3.562 213 HA GLU 29 HA GLU 29 -11.403 -5.168 5.494 214 HB2 GLU 29 2HB GLU 29 -13.965 -4.152 4.250 215 HB3 GLU 29 1HB GLU 29 -13.845 -5.182 5.669 216 HG2 GLU 29 2HG GLU 29 -13.027 -3.470 7.001 217 HG3 GLU 29 1HG GLU 29 -12.527 -2.500 5.616 218 H ASP 30 H ASP 30 -12.369 -4.914 2.137 219 HA ASP 30 HA ASP 30 -13.130 -7.682 1.915 220 HB2 ASP 30 2HB ASP 30 -13.546 -5.365 0.393 221 HB3 ASP 30 1HB ASP 30 -12.535 -6.404 -0.621 222 H GLY 31 H GLY 31 -10.375 -5.683 0.900 223 HA2 GLY 31 2HA GLY 31 -8.940 -7.723 -0.409 224 HA3 GLY 31 1HA GLY 31 -8.241 -6.247 0.268 225 H LYS 32 H LYS 32 -9.018 -6.707 2.971 226 HA LYS 32 HA LYS 32 -6.849 -8.329 3.817 227 HB2 LYS 32 2HB LYS 32 -7.750 -6.362 5.074 228 HB3 LYS 32 1HB LYS 32 -9.165 -7.324 5.479 229 HG2 LYS 32 2HG LYS 32 -7.066 -8.932 6.254 230 HG3 LYS 32 1HG LYS 32 -6.516 -7.308 6.668 231 HD2 LYS 32 2HD LYS 32 -7.684 -8.221 8.557 232 HD3 LYS 32 1HD LYS 32 -8.676 -6.943 7.850 233 HE2 LYS 32 2HE LYS 32 -9.483 -9.226 6.510 234 HE3 LYS 32 1HE LYS 32 -9.233 -9.777 8.166 235 HZ1 LYS 32 3HZ LYS 32 -11.158 -7.827 7.126 236 HZ2 LYS 32 1HZ LYS 32 -10.583 -7.622 8.704 237 HZ3 LYS 32 2HZ LYS 32 -11.378 -9.051 8.272 238 H LYS 33 H LYS 33 -10.354 -8.794 3.724 239 HA LYS 33 HA LYS 33 -10.486 -11.231 5.087 240 HB2 LYS 33 2HB LYS 33 -12.469 -9.905 4.528 241 HB3 LYS 33 1HB LYS 33 -12.220 -10.233 2.818 242 HG2 LYS 33 2HG LYS 33 -12.310 -12.752 3.806 243 HG3 LYS 33 1HG LYS 33 -13.407 -11.909 4.916 244 HD2 LYS 33 2HD LYS 33 -14.774 -11.165 3.105 245 HD3 LYS 33 1HD LYS 33 -13.601 -11.723 1.911 246 HE2 LYS 33 2HE LYS 33 -13.976 -14.048 2.753 247 HE3 LYS 33 1HE LYS 33 -15.283 -13.415 3.753 248 HZ1 LYS 33 3HZ LYS 33 -15.136 -13.340 0.787 249 HZ2 LYS 33 1HZ LYS 33 -16.358 -12.618 1.708 250 HZ3 LYS 33 2HZ LYS 33 -16.171 -14.299 1.721 251 H GLU 34 H GLU 34 -10.385 -10.665 1.567 252 HA GLU 34 HA GLU 34 -10.049 -13.402 0.908 253 HB2 GLU 34 2HB GLU 34 -10.941 -11.786 -0.697 254 HB3 GLU 34 1HB GLU 34 -9.408 -10.915 -0.695 255 HG2 GLU 34 2HG GLU 34 -8.362 -12.465 -1.992 256 HG3 GLU 34 1HG GLU 34 -9.367 -13.798 -1.402 257 H ALA 35 H ALA 35 -7.854 -10.820 1.722 258 HA ALA 35 HA ALA 35 -5.469 -11.864 0.703 259 HB1 ALA 35 1HB ALA 35 -6.049 -10.056 3.032 260 HB2 ALA 35 2HB ALA 35 -5.424 -9.632 1.439 261 HB3 ALA 35 3HB ALA 35 -4.405 -10.509 2.579 262 H ALA 36 H ALA 36 -7.330 -12.719 3.515 263 HA ALA 36 HA ALA 36 -5.300 -14.105 4.925 264 HB1 ALA 36 1HB ALA 36 -7.280 -15.223 6.055 265 HB2 ALA 36 2HB ALA 36 -8.302 -14.226 5.021 266 HB3 ALA 36 3HB ALA 36 -7.197 -13.465 6.166 267 H ALA 37 H ALA 37 -7.856 -15.203 2.709 268 HA ALA 37 HA ALA 37 -7.276 -17.939 2.806 269 HB1 ALA 37 1HB ALA 37 -8.945 -16.194 1.249 270 HB2 ALA 37 2HB ALA 37 -9.141 -17.910 1.599 271 HB3 ALA 37 3HB ALA 37 -8.185 -17.398 0.208 272 H SER 38 H SER 38 -6.559 -15.853 0.007 273 HA SER 38 HA SER 38 -4.644 -17.578 -1.096 274 HB2 SER 38 2HB SER 38 -4.804 -14.578 -1.483 275 HB3 SER 38 1HB SER 38 -4.077 -15.757 -2.587 276 HG SER 38 HG SER 38 -5.979 -15.979 -3.426 277 H GLY 39 H GLY 39 -4.395 -15.040 1.293 278 HA2 GLY 39 2HA GLY 39 -2.695 -14.717 2.842 279 HA3 GLY 39 1HA GLY 39 -1.743 -15.948 2.007 280 H LEU 40 H LEU 40 -3.168 -12.991 0.658 281 HA LEU 40 HA LEU 40 -0.458 -12.183 -0.130 282 HB2 LEU 40 2HB LEU 40 -1.530 -10.808 -1.843 283 HB3 LEU 40 1HB LEU 40 -1.958 -12.500 -1.993 284 HG LEU 40 HG LEU 40 -4.075 -11.770 -0.617 285 HD11 LEU 40 1HD1 LEU 40 -2.801 -9.254 -1.210 286 HD12 LEU 40 2HD1 LEU 40 -4.189 -9.597 -0.178 287 HD13 LEU 40 3HD1 LEU 40 -4.418 -9.338 -1.908 288 HD21 LEU 40 3HD2 LEU 40 -4.392 -10.764 -3.326 289 HD22 LEU 40 1HD2 LEU 40 -5.156 -12.142 -2.531 290 HD23 LEU 40 2HD2 LEU 40 -3.557 -12.317 -3.256 291 HA PRO 41 HA PRO 41 -0.668 -8.958 2.941 292 HB2 PRO 41 2HB PRO 41 1.413 -7.461 1.964 293 HB3 PRO 41 1HB PRO 41 1.613 -8.898 2.973 294 HG2 PRO 41 2HG PRO 41 1.806 -8.631 -0.001 295 HG3 PRO 41 1HG PRO 41 2.829 -9.558 1.112 296 HD2 PRO 41 2HD PRO 41 0.931 -10.738 -0.371 297 HD3 PRO 41 1HD PRO 41 1.308 -11.289 1.274 298 H LEU 42 H LEU 42 -0.419 -6.403 2.826 299 HA LEU 42 HA LEU 42 -2.136 -5.523 0.614 300 HB2 LEU 42 2HB LEU 42 -2.092 -4.901 3.520 301 HB3 LEU 42 1HB LEU 42 -2.615 -3.649 2.416 302 HG LEU 42 HG LEU 42 -3.858 -6.381 2.350 303 HD11 LEU 42 1HD1 LEU 42 -5.648 -5.380 3.807 304 HD12 LEU 42 2HD1 LEU 42 -4.507 -4.088 4.183 305 HD13 LEU 42 3HD1 LEU 42 -4.125 -5.755 4.617 306 HD21 LEU 42 3HD2 LEU 42 -5.693 -4.317 1.843 307 HD22 LEU 42 1HD2 LEU 42 -5.001 -5.455 0.688 308 HD23 LEU 42 2HD2 LEU 42 -4.225 -3.895 0.963 309 H MET 43 H MET 43 -1.915 -3.335 -0.102 310 HA MET 43 HA MET 43 0.724 -2.122 0.443 311 HB2 MET 43 2HB MET 43 0.960 -3.295 -1.650 312 HB3 MET 43 1HB MET 43 -0.535 -2.584 -2.270 313 HG2 MET 43 2HG MET 43 1.313 -1.474 -3.287 314 HG3 MET 43 1HG MET 43 0.554 -0.356 -2.156 315 HE1 MET 43 3HE MET 43 1.752 1.045 -0.735 316 HE2 MET 43 1HE MET 43 3.192 0.654 0.204 317 HE3 MET 43 2HE MET 43 1.670 -0.173 0.539 318 H VAL 44 H VAL 44 -0.471 -0.659 1.839 319 HA VAL 44 HA VAL 44 -2.577 0.976 0.854 320 HB VAL 44 HB VAL 44 -0.761 1.468 3.218 321 HG11 VAL 44 1HG1 VAL 44 -1.851 3.375 3.554 322 HG12 VAL 44 2HG1 VAL 44 -3.399 2.530 3.520 323 HG13 VAL 44 3HG1 VAL 44 -2.697 3.144 2.023 324 HG21 VAL 44 3HG2 VAL 44 -3.544 0.364 3.337 325 HG22 VAL 44 1HG2 VAL 44 -2.255 0.286 4.544 326 HG23 VAL 44 2HG2 VAL 44 -2.151 -0.695 3.081 327 H ILE 45 H ILE 45 -2.163 2.211 -0.906 328 HA ILE 45 HA ILE 45 0.231 3.910 -0.899 329 HB ILE 45 HB ILE 45 -1.694 3.223 -3.125 330 HG12 ILE 45 2HG1 ILE 45 1.149 2.443 -2.482 331 HG13 ILE 45 1HG1 ILE 45 -0.248 1.385 -2.708 332 HG21 ILE 45 1HG2 ILE 45 0.698 4.515 -4.043 333 HG22 ILE 45 2HG2 ILE 45 -0.125 5.548 -2.878 334 HG23 ILE 45 3HG2 ILE 45 -0.986 4.971 -4.304 335 HD11 ILE 45 3HD1 ILE 45 0.406 1.095 -4.797 336 HD12 ILE 45 1HD1 ILE 45 1.668 2.312 -4.623 337 HD13 ILE 45 2HD1 ILE 45 0.042 2.792 -5.107 338 H ILE 46 H ILE 46 -0.104 5.810 0.121 339 HA ILE 46 HA ILE 46 -2.746 7.034 -0.017 340 HB ILE 46 HB ILE 46 -0.319 7.897 1.549 341 HG12 ILE 46 2HG1 ILE 46 -2.609 6.784 2.988 342 HG13 ILE 46 1HG1 ILE 46 -1.829 5.622 1.913 343 HG21 ILE 46 1HG2 ILE 46 -2.080 9.105 2.907 344 HG22 ILE 46 2HG2 ILE 46 -3.183 8.800 1.572 345 HG23 ILE 46 3HG2 ILE 46 -1.740 9.771 1.310 346 HD11 ILE 46 3HD1 ILE 46 0.309 6.076 3.015 347 HD12 ILE 46 1HD1 ILE 46 -0.912 5.504 4.153 348 HD13 ILE 46 2HD1 ILE 46 -0.497 7.217 4.091 349 H HIS 47 H HIS 47 -2.965 9.338 -0.482 350 HA HIS 47 HA HIS 47 -1.017 10.183 -2.515 351 HB2 HIS 47 2HB HIS 47 -3.998 10.484 -2.372 352 HB3 HIS 47 1HB HIS 47 -3.027 11.585 -3.357 353 HD1 HIS 47 1HD HIS 47 -3.568 10.810 -5.669 354 HD2 HIS 47 2HD HIS 47 -2.558 7.665 -3.148 355 HE1 HIS 47 1HE HIS 47 -3.421 8.783 -7.148 356 HE2 HIS 47 2HE HIS 47 -2.917 6.874 -5.584 357 H LYS 48 H LYS 48 0.296 11.273 -1.045 358 HA LYS 48 HA LYS 48 -0.167 13.038 0.915 359 HB2 LYS 48 2HB LYS 48 1.869 14.269 0.080 360 HB3 LYS 48 1HB LYS 48 2.063 12.526 0.225 361 HG2 LYS 48 2HG LYS 48 1.156 13.466 -2.405 362 HG3 LYS 48 1HG LYS 48 2.784 13.963 -1.942 363 HD2 LYS 48 2HD LYS 48 3.494 11.955 -2.593 364 HD3 LYS 48 1HD LYS 48 2.618 11.271 -1.227 365 HE2 LYS 48 2HE LYS 48 0.600 11.090 -2.670 366 HE3 LYS 48 1HE LYS 48 1.571 11.672 -4.026 367 HZ1 LYS 48 3HZ LYS 48 2.798 9.464 -2.685 368 HZ2 LYS 48 1HZ LYS 48 2.439 9.664 -4.327 369 HZ3 LYS 48 2HZ LYS 48 1.261 9.070 -3.269 370 H SER 49 H SER 49 -0.070 15.454 0.962 371 HA SER 49 HA SER 49 -2.242 16.634 -0.301 372 HB2 SER 49 2HB SER 49 -0.060 17.512 1.406 373 HB3 SER 49 1HB SER 49 -0.485 18.749 0.224 374 HG SER 49 HG SER 49 -2.432 17.417 1.783 375 H TRP 50 H TRP 50 0.983 17.978 -0.921 376 HA TRP 50 HA TRP 50 0.265 18.680 -3.607 377 HB2 TRP 50 2HB TRP 50 2.959 18.722 -2.209 378 HB3 TRP 50 1HB TRP 50 2.621 19.446 -3.787 379 HD1 TRP 50 HD TRP 50 0.711 21.499 -3.717 380 HE1 TRP 50 1HE TRP 50 0.396 23.321 -1.928 381 HE3 TRP 50 3HE TRP 50 3.185 19.265 0.160 382 HZ2 TRP 50 2HZ TRP 50 1.103 23.754 0.772 383 HZ3 TRP 50 3HZ TRP 50 3.320 20.450 2.311 384 HH2 TRP 50 HH TRP 50 2.300 22.648 2.610 385 H CYS 51 H CYS 51 -0.359 16.334 -3.909 386 HA CYS 51 HA CYS 51 1.711 14.412 -4.286 387 HB2 CYS 51 2HB CYS 51 -0.389 13.589 -3.586 388 HB3 CYS 51 1HB CYS 51 -1.247 14.465 -4.846 389 H GLY 52 H GLY 52 2.673 13.706 -6.111 390 HA2 GLY 52 2HA GLY 52 1.906 14.986 -8.669 391 HA3 GLY 52 1HA GLY 52 3.592 14.707 -8.227 392 H ALA 53 H ALA 53 3.174 12.140 -7.030 393 HA ALA 53 HA ALA 53 3.560 10.444 -9.191 394 HB1 ALA 53 1HB ALA 53 3.754 8.769 -7.666 395 HB2 ALA 53 2HB ALA 53 2.322 9.278 -6.771 396 HB3 ALA 53 3HB ALA 53 3.848 10.137 -6.557 397 H CYS 54 H CYS 54 0.675 11.731 -7.907 398 HA CYS 54 HA CYS 54 -0.980 9.756 -9.167 399 HB2 CYS 54 2HB CYS 54 -2.849 11.411 -8.494 400 HB3 CYS 54 1HB CYS 54 -1.975 10.582 -7.199 401 H LYS 55 H LYS 55 0.118 13.039 -9.667 402 HA LYS 55 HA LYS 55 -1.457 13.756 -11.859 403 HB2 LYS 55 2HB LYS 55 0.651 14.894 -10.441 404 HB3 LYS 55 1HB LYS 55 1.291 14.710 -12.067 405 HG2 LYS 55 2HG LYS 55 -0.804 15.863 -12.885 406 HG3 LYS 55 1HG LYS 55 -1.130 16.258 -11.187 407 HD2 LYS 55 2HD LYS 55 1.034 17.404 -11.051 408 HD3 LYS 55 1HD LYS 55 1.345 17.018 -12.744 409 HE2 LYS 55 2HE LYS 55 0.551 19.211 -12.802 410 HE3 LYS 55 1HE LYS 55 -0.855 18.236 -13.228 411 HZ1 LYS 55 3HZ LYS 55 -0.781 20.125 -11.290 412 HZ2 LYS 55 1HZ LYS 55 -0.603 18.694 -10.403 413 HZ3 LYS 55 2HZ LYS 55 -1.941 18.902 -11.416 414 H ALA 56 H ALA 56 1.812 12.297 -11.784 415 HA ALA 56 HA ALA 56 1.808 11.810 -14.621 416 HB1 ALA 56 1HB ALA 56 3.836 12.098 -13.062 417 HB2 ALA 56 2HB ALA 56 3.926 10.875 -14.329 418 HB3 ALA 56 3HB ALA 56 3.590 10.398 -12.664 419 H LEU 57 H LEU 57 0.398 10.265 -11.960 420 HA LEU 57 HA LEU 57 0.505 7.568 -12.760 421 HB2 LEU 57 2HB LEU 57 -0.621 9.097 -10.677 422 HB3 LEU 57 1HB LEU 57 -1.923 8.155 -11.360 423 HG LEU 57 HG LEU 57 -1.018 6.150 -10.684 424 HD11 LEU 57 1HD1 LEU 57 1.090 5.920 -11.501 425 HD12 LEU 57 2HD1 LEU 57 1.487 6.202 -9.807 426 HD13 LEU 57 3HD1 LEU 57 1.593 7.524 -10.969 427 HD21 LEU 57 3HD2 LEU 57 0.246 7.785 -8.535 428 HD22 LEU 57 1HD2 LEU 57 -0.732 6.322 -8.408 429 HD23 LEU 57 2HD2 LEU 57 -1.497 7.864 -8.791 430 H LYS 58 H LYS 58 -1.617 10.206 -13.691 431 HA LYS 58 HA LYS 58 -3.740 8.718 -14.698 432 HB2 LYS 58 2HB LYS 58 -2.842 11.196 -16.124 433 HB3 LYS 58 1HB LYS 58 -4.470 10.629 -15.803 434 HG2 LYS 58 2HG LYS 58 -3.384 11.016 -13.285 435 HG3 LYS 58 1HG LYS 58 -2.774 12.369 -14.238 436 HD2 LYS 58 2HD LYS 58 -5.633 11.718 -14.585 437 HD3 LYS 58 1HD LYS 58 -5.171 12.366 -13.010 438 HE2 LYS 58 2HE LYS 58 -3.834 14.018 -14.731 439 HE3 LYS 58 1HE LYS 58 -5.318 13.680 -15.620 440 HZ1 LYS 58 3HZ LYS 58 -5.773 15.557 -14.322 441 HZ2 LYS 58 1HZ LYS 58 -5.033 14.911 -12.945 442 HZ3 LYS 58 2HZ LYS 58 -6.506 14.281 -13.487 443 HA PRO 59 HA PRO 59 -1.651 8.433 -19.004 444 HB2 PRO 59 2HB PRO 59 0.850 9.323 -19.379 445 HB3 PRO 59 1HB PRO 59 -0.550 10.415 -19.425 446 HG2 PRO 59 2HG PRO 59 1.368 9.887 -17.174 447 HG3 PRO 59 1HG PRO 59 0.770 11.438 -17.791 448 HD2 PRO 59 2HD PRO 59 -0.273 10.241 -15.591 449 HD3 PRO 59 1HD PRO 59 -1.236 11.256 -16.689 450 H LYS 60 H LYS 60 0.367 7.770 -16.202 451 HA LYS 60 HA LYS 60 1.663 5.561 -17.637 452 HB2 LYS 60 2HB LYS 60 3.231 5.436 -15.839 453 HB3 LYS 60 1HB LYS 60 3.035 7.136 -16.251 454 HG2 LYS 60 2HG LYS 60 1.299 7.190 -14.401 455 HG3 LYS 60 1HG LYS 60 1.954 5.644 -13.884 456 HD2 LYS 60 2HD LYS 60 2.838 7.869 -12.824 457 HD3 LYS 60 1HD LYS 60 3.952 6.560 -13.205 458 HE2 LYS 60 2HE LYS 60 3.424 8.748 -15.187 459 HE3 LYS 60 1HE LYS 60 4.570 8.987 -13.870 460 HZ1 LYS 60 3HZ LYS 60 4.964 6.514 -15.273 461 HZ2 LYS 60 1HZ LYS 60 6.080 7.725 -14.884 462 HZ3 LYS 60 2HZ LYS 60 5.130 7.866 -16.275 463 H PHE 61 H PHE 61 -0.124 6.107 -14.583 464 HA PHE 61 HA PHE 61 -0.337 3.390 -13.930 465 HB2 PHE 61 2HB PHE 61 -0.920 5.594 -12.563 466 HB3 PHE 61 1HB PHE 61 -2.543 5.241 -13.168 467 HD1 PHE 61 1HD PHE 61 -3.474 2.895 -12.732 468 HD2 PHE 61 2HD PHE 61 -0.086 4.484 -10.713 469 HE1 PHE 61 1HE PHE 61 -3.760 1.228 -10.944 470 HE2 PHE 61 2HE PHE 61 -0.369 2.836 -8.924 471 HZ PHE 61 HZ PHE 61 -2.202 1.197 -9.035 472 H ALA 62 H ALA 62 -1.977 5.418 -16.196 473 HA ALA 62 HA ALA 62 -4.282 3.849 -16.614 474 HB1 ALA 62 1HB ALA 62 -2.796 5.892 -18.200 475 HB2 ALA 62 2HB ALA 62 -4.459 5.917 -17.612 476 HB3 ALA 62 3HB ALA 62 -4.029 4.919 -19.003 477 H GLU 63 H GLU 63 -1.003 3.386 -17.183 478 HA GLU 63 HA GLU 63 -1.217 1.430 -19.307 479 HB2 GLU 63 2HB GLU 63 0.691 3.158 -18.908 480 HB3 GLU 63 1HB GLU 63 1.233 2.037 -17.655 481 HG2 GLU 63 2HG GLU 63 1.076 0.277 -19.592 482 HG3 GLU 63 1HG GLU 63 1.202 1.706 -20.620 483 H SER 64 H SER 64 -1.432 1.587 -15.950 484 HA SER 64 HA SER 64 -0.326 -0.811 -15.091 485 HB2 SER 64 2HB SER 64 -2.750 0.619 -14.020 486 HB3 SER 64 1HB SER 64 -1.768 -0.542 -13.140 487 HG SER 64 HG SER 64 0.016 1.000 -13.606 488 H THR 65 H THR 65 -2.633 -0.572 -17.420 489 HA THR 65 HA THR 65 -4.697 -2.254 -16.808 490 HB THR 65 HB THR 65 -3.274 -2.615 -19.420 491 HG1 THR 65 1HG THR 65 -3.151 -0.494 -19.458 492 HG21 THR 65 3HG2 THR 65 -6.167 -2.010 -18.992 493 HG22 THR 65 1HG2 THR 65 -5.531 -3.648 -18.842 494 HG23 THR 65 2HG2 THR 65 -5.381 -2.780 -20.370 495 H GLU 66 H GLU 66 -1.378 -3.067 -17.655 496 HA GLU 66 HA GLU 66 -1.870 -5.907 -17.428 497 HB2 GLU 66 2HB GLU 66 0.494 -6.198 -17.849 498 HB3 GLU 66 1HB GLU 66 -0.144 -5.007 -18.987 499 HG2 GLU 66 2HG GLU 66 0.888 -3.862 -16.515 500 HG3 GLU 66 1HG GLU 66 2.098 -4.709 -17.473 501 H ILE 67 H ILE 67 -0.767 -3.264 -15.452 502 HA ILE 67 HA ILE 67 0.287 -4.872 -13.355 503 HB ILE 67 HB ILE 67 -0.864 -2.085 -13.176 504 HG12 ILE 67 2HG1 ILE 67 2.008 -2.964 -13.560 505 HG13 ILE 67 1HG1 ILE 67 0.977 -2.278 -14.824 506 HG21 ILE 67 1HG2 ILE 67 0.483 -3.866 -11.250 507 HG22 ILE 67 2HG2 ILE 67 -0.676 -2.564 -10.977 508 HG23 ILE 67 3HG2 ILE 67 1.023 -2.187 -11.265 509 HD11 ILE 67 3HD1 ILE 67 0.957 -0.521 -12.590 510 HD12 ILE 67 1HD1 ILE 67 1.584 -0.246 -14.215 511 HD13 ILE 67 2HD1 ILE 67 2.630 -0.933 -12.972 512 H SER 68 H SER 68 -2.865 -4.194 -14.482 513 HA SER 68 HA SER 68 -4.327 -4.444 -12.071 514 HB2 SER 68 2HB SER 68 -5.145 -3.679 -14.419 515 HB3 SER 68 1HB SER 68 -5.350 -5.401 -14.741 516 HG SER 68 HG SER 68 -6.558 -3.914 -12.645 517 H GLU 69 H GLU 69 -2.931 -6.690 -14.343 518 HA GLU 69 HA GLU 69 -4.116 -9.016 -13.124 519 HB2 GLU 69 2HB GLU 69 -1.755 -9.043 -14.990 520 HB3 GLU 69 1HB GLU 69 -2.981 -10.283 -14.759 521 HG2 GLU 69 2HG GLU 69 -3.378 -7.607 -16.082 522 HG3 GLU 69 1HG GLU 69 -3.272 -9.172 -16.888 523 H LEU 70 H LEU 70 -1.012 -7.351 -13.171 524 HA LEU 70 HA LEU 70 0.421 -9.210 -11.594 525 HB2 LEU 70 2HB LEU 70 0.759 -6.303 -12.239 526 HB3 LEU 70 1HB LEU 70 1.774 -7.044 -11.002 527 HG LEU 70 HG LEU 70 2.600 -8.665 -12.656 528 HD11 LEU 70 1HD1 LEU 70 2.030 -8.564 -14.950 529 HD12 LEU 70 2HD1 LEU 70 1.116 -7.070 -14.734 530 HD13 LEU 70 3HD1 LEU 70 0.510 -8.586 -14.054 531 HD21 LEU 70 3HD2 LEU 70 2.942 -5.993 -13.937 532 HD22 LEU 70 1HD2 LEU 70 4.140 -7.240 -13.596 533 HD23 LEU 70 2HD2 LEU 70 3.512 -6.240 -12.286 534 H SER 71 H SER 71 -1.871 -6.723 -10.818 535 HA SER 71 HA SER 71 -1.220 -6.541 -8.033 536 HB2 SER 71 2HB SER 71 -2.816 -5.094 -9.813 537 HB3 SER 71 1HB SER 71 -3.939 -5.814 -8.661 538 HG SER 71 HG SER 71 -3.352 -4.103 -7.545 539 H HIS 72 H HIS 72 -3.097 -8.680 -9.972 540 HA HIS 72 HA HIS 72 -4.997 -9.556 -8.104 541 HB2 HIS 72 2HB HIS 72 -4.389 -10.173 -10.719 542 HB3 HIS 72 1HB HIS 72 -3.940 -11.657 -9.866 543 HD1 HIS 72 1HD HIS 72 -5.861 -12.942 -8.648 544 HD2 HIS 72 2HD HIS 72 -7.111 -9.680 -10.899 545 HE1 HIS 72 1HE HIS 72 -8.353 -13.197 -8.876 546 HE2 HIS 72 2HE HIS 72 -9.098 -11.164 -10.165 547 H ASN 73 H ASN 73 -1.648 -9.838 -8.162 548 HA ASN 73 HA ASN 73 -1.352 -12.328 -6.807 549 HB2 ASN 73 2HB ASN 73 0.478 -9.982 -7.310 550 HB3 ASN 73 1HB ASN 73 0.989 -11.418 -6.419 551 HD21 ASN 73 1HD2 ASN 73 -0.169 -10.226 -9.509 552 HD22 ASN 73 2HD2 ASN 73 0.442 -11.550 -10.457 553 H PHE 74 H PHE 74 -2.259 -9.205 -5.818 554 HA PHE 74 HA PHE 74 -2.535 -10.015 -3.138 555 HB2 PHE 74 2HB PHE 74 -1.142 -8.206 -2.128 556 HB3 PHE 74 1HB PHE 74 -0.223 -9.480 -2.932 557 HD1 PHE 74 2HD PHE 74 -0.371 -8.588 -5.771 558 HD2 PHE 74 1HD PHE 74 0.247 -6.386 -2.179 559 HE1 PHE 74 2HE PHE 74 0.866 -6.884 -7.030 560 HE2 PHE 74 1HE PHE 74 1.493 -4.683 -3.437 561 HZ PHE 74 HZ PHE 74 1.804 -4.931 -5.862 562 H VAL 75 H VAL 75 -2.831 -7.407 -1.949 563 HA VAL 75 HA VAL 75 -4.688 -6.013 -3.707 564 HB VAL 75 HB VAL 75 -6.113 -7.738 -2.730 565 HG11 VAL 75 1HG1 VAL 75 -6.218 -6.870 -0.011 566 HG12 VAL 75 2HG1 VAL 75 -4.556 -7.291 -0.421 567 HG13 VAL 75 3HG1 VAL 75 -5.847 -8.470 -0.654 568 HG21 VAL 75 3HG2 VAL 75 -6.990 -5.381 -1.181 569 HG22 VAL 75 1HG2 VAL 75 -7.857 -6.343 -2.378 570 HG23 VAL 75 2HG2 VAL 75 -6.696 -5.123 -2.900 571 H MET 76 H MET 76 -4.910 -3.830 -3.157 572 HA MET 76 HA MET 76 -3.593 -3.075 -0.668 573 HB2 MET 76 2HB MET 76 -3.155 -1.002 -2.491 574 HB3 MET 76 1HB MET 76 -1.997 -2.097 -1.778 575 HG2 MET 76 2HG MET 76 -3.519 -2.763 -4.270 576 HG3 MET 76 1HG MET 76 -1.965 -1.948 -4.272 577 HE1 MET 76 3HE MET 76 -1.563 -5.026 -5.902 578 HE2 MET 76 1HE MET 76 -3.183 -4.417 -5.564 579 HE3 MET 76 2HE MET 76 -2.692 -6.000 -4.961 580 H VAL 77 H VAL 77 -3.874 -0.452 -0.568 581 HA VAL 77 HA VAL 77 -6.691 0.195 -0.990 582 HB VAL 77 HB VAL 77 -5.435 -0.399 1.604 583 HG11 VAL 77 1HG1 VAL 77 -6.948 2.126 1.182 584 HG12 VAL 77 2HG1 VAL 77 -5.600 1.775 2.269 585 HG13 VAL 77 3HG1 VAL 77 -7.222 1.202 2.658 586 HG21 VAL 77 3HG2 VAL 77 -7.535 -1.264 2.117 587 HG22 VAL 77 1HG2 VAL 77 -7.328 -1.598 0.396 588 HG23 VAL 77 2HG2 VAL 77 -8.343 -0.250 0.921 589 H ASN 78 H ASN 78 -7.093 2.327 -1.285 590 HA ASN 78 HA ASN 78 -4.778 4.094 -1.329 591 HB2 ASN 78 2HB ASN 78 -6.081 3.899 -3.394 592 HB3 ASN 78 1HB ASN 78 -7.513 4.462 -2.552 593 HD21 ASN 78 1HD2 ASN 78 -4.272 5.702 -2.038 594 HD22 ASN 78 2HD2 ASN 78 -4.581 7.283 -2.686 595 H LEU 79 H LEU 79 -4.462 5.401 0.263 596 HA LEU 79 HA LEU 79 -6.766 6.512 1.726 597 HB2 LEU 79 2HB LEU 79 -5.552 5.208 3.268 598 HB3 LEU 79 1HB LEU 79 -4.009 5.723 2.628 599 HG LEU 79 HG LEU 79 -4.519 8.024 3.564 600 HD11 LEU 79 1HD1 LEU 79 -6.395 6.805 5.484 601 HD12 LEU 79 2HD1 LEU 79 -7.037 7.115 3.869 602 HD13 LEU 79 3HD1 LEU 79 -6.353 8.437 4.815 603 HD21 LEU 79 3HD2 LEU 79 -4.495 6.217 5.884 604 HD22 LEU 79 1HD2 LEU 79 -3.366 7.492 5.421 605 HD23 LEU 79 2HD2 LEU 79 -3.266 5.903 4.659 606 H GLU 80 H GLU 80 -6.150 8.784 2.675 607 HA GLU 80 HA GLU 80 -4.324 10.239 0.891 608 HB2 GLU 80 2HB GLU 80 -7.190 10.308 0.708 609 HB3 GLU 80 1HB GLU 80 -6.617 11.889 1.256 610 HG2 GLU 80 2HG GLU 80 -5.464 12.296 -0.683 611 HG3 GLU 80 1HG GLU 80 -5.277 10.575 -1.057 612 H ASP 81 H ASP 81 -4.603 12.747 1.658 613 HA ASP 81 HA ASP 81 -3.619 12.744 4.356 614 HB2 ASP 81 2HB ASP 81 -2.749 14.204 2.477 615 HB3 ASP 81 1HB ASP 81 -4.222 15.156 2.643 616 H GLU 82 H GLU 82 -6.665 13.278 2.841 617 HA GLU 82 HA GLU 82 -7.895 15.037 4.614 618 HB2 GLU 82 2HB GLU 82 -10.008 14.118 3.831 619 HB3 GLU 82 1HB GLU 82 -8.894 14.308 2.483 620 HG2 GLU 82 2HG GLU 82 -8.340 11.879 2.718 621 HG3 GLU 82 1HG GLU 82 -9.655 11.762 3.887 622 H GLU 83 H GLU 83 -7.220 11.618 4.907 623 HA GLU 83 HA GLU 83 -8.521 11.612 7.547 624 HB2 GLU 83 2HB GLU 83 -8.980 9.897 5.483 625 HB3 GLU 83 1HB GLU 83 -7.743 9.021 6.374 626 HG2 GLU 83 2HG GLU 83 -9.232 8.354 7.862 627 HG3 GLU 83 1HG GLU 83 -9.682 10.028 8.212 628 H GLU 84 H GLU 84 -6.338 12.802 7.942 629 HA GLU 84 HA GLU 84 -3.868 11.632 7.970 630 HB2 GLU 84 2HB GLU 84 -5.036 13.334 10.179 631 HB3 GLU 84 1HB GLU 84 -3.324 13.067 9.881 632 HG2 GLU 84 2HG GLU 84 -3.367 14.910 8.655 633 HG3 GLU 84 1HG GLU 84 -4.276 13.988 7.458 634 HA PRO 85 HA PRO 85 -4.937 8.091 10.630 635 HB2 PRO 85 2HB PRO 85 -2.343 7.080 9.677 636 HB3 PRO 85 1HB PRO 85 -3.955 6.358 9.531 637 HG2 PRO 85 2HG PRO 85 -2.662 7.376 7.402 638 HG3 PRO 85 1HG PRO 85 -4.430 7.489 7.573 639 HD2 PRO 85 2HD PRO 85 -2.333 9.571 8.115 640 HD3 PRO 85 1HD PRO 85 -3.901 9.739 7.286 641 H LYS 86 H LYS 86 -4.542 8.206 12.740 642 HA LYS 86 HA LYS 86 -2.258 9.586 13.783 643 HB2 LYS 86 2HB LYS 86 -4.313 7.931 15.265 644 HB3 LYS 86 1HB LYS 86 -3.204 9.113 15.972 645 HG2 LYS 86 2HG LYS 86 -4.613 10.774 15.564 646 HG3 LYS 86 1HG LYS 86 -4.760 10.312 13.868 647 HD2 LYS 86 2HD LYS 86 -6.932 10.264 14.983 648 HD3 LYS 86 1HD LYS 86 -6.449 8.647 14.465 649 HE2 LYS 86 2HE LYS 86 -5.420 8.909 17.039 650 HE3 LYS 86 1HE LYS 86 -7.021 9.644 17.118 651 HZ1 LYS 86 3HZ LYS 86 -8.046 7.680 16.699 652 HZ2 LYS 86 1HZ LYS 86 -6.653 7.068 17.439 653 HZ3 LYS 86 2HZ LYS 86 -6.783 7.071 15.754 654 H ASP 87 H ASP 87 -0.886 7.913 12.483 655 HA ASP 87 HA ASP 87 0.591 6.410 14.306 656 HB2 ASP 87 2HB ASP 87 -1.729 5.063 13.756 657 HB3 ASP 87 1HB ASP 87 -0.623 4.373 12.559 658 H GLU 88 H GLU 88 1.719 4.450 12.827 659 HA GLU 88 HA GLU 88 3.260 5.939 10.927 660 HB2 GLU 88 2HB GLU 88 3.350 2.978 11.510 661 HB3 GLU 88 1HB GLU 88 4.592 3.931 10.712 662 HG2 GLU 88 2HG GLU 88 3.703 4.381 13.547 663 HG3 GLU 88 1HG GLU 88 5.070 3.367 13.088 664 H ASP 89 H ASP 89 0.404 4.127 10.717 665 HA ASP 89 HA ASP 89 0.491 2.772 8.358 666 HB2 ASP 89 2HB ASP 89 -1.495 3.541 10.104 667 HB3 ASP 89 1HB ASP 89 -1.976 4.321 8.589 668 H PHE 90 H PHE 90 0.945 6.158 8.645 669 HA PHE 90 HA PHE 90 0.349 6.519 5.788 670 HB2 PHE 90 2HB PHE 90 0.102 8.857 6.185 671 HB3 PHE 90 1HB PHE 90 -0.806 8.024 7.453 672 HD1 PHE 90 1HD PHE 90 2.338 9.828 6.721 673 HD2 PHE 90 2HD PHE 90 -0.293 8.350 9.721 674 HE1 PHE 90 1HE PHE 90 3.576 11.098 8.427 675 HE2 PHE 90 2HE PHE 90 0.939 9.618 11.432 676 HZ PHE 90 HZ PHE 90 2.876 10.995 10.785 677 H SER 91 H SER 91 2.841 6.668 8.207 678 HA SER 91 HA SER 91 4.911 6.622 6.238 679 HB2 SER 91 2HB SER 91 4.685 9.083 7.994 680 HB3 SER 91 1HB SER 91 6.056 8.692 6.943 681 HG SER 91 HG SER 91 4.497 10.158 6.012 682 HA PRO 92 HA PRO 92 6.312 4.746 10.123 683 HB2 PRO 92 2HB PRO 92 7.059 2.384 9.094 684 HB3 PRO 92 1HB PRO 92 5.353 2.790 9.350 685 HG2 PRO 92 2HG PRO 92 6.877 2.583 6.834 686 HG3 PRO 92 1HG PRO 92 5.134 2.449 7.107 687 HD2 PRO 92 2HD PRO 92 6.635 4.734 6.191 688 HD3 PRO 92 1HD PRO 92 4.882 4.584 6.392 689 H ASP 93 H ASP 93 7.974 6.632 8.738 690 HA ASP 93 HA ASP 93 10.497 5.895 9.662 691 HB2 ASP 93 2HB ASP 93 9.955 4.596 7.269 692 HB3 ASP 93 1HB ASP 93 10.947 5.976 6.780 693 H GLY 94 H GLY 94 9.733 7.475 6.564 694 HA2 GLY 94 2HA GLY 94 11.200 9.819 7.368 695 HA3 GLY 94 1HA GLY 94 10.371 9.572 5.828 696 H GLY 95 H GLY 95 10.121 11.994 6.727 697 HA2 GLY 95 2HA GLY 95 7.655 12.154 8.320 698 HA3 GLY 95 1HA GLY 95 8.764 13.491 7.999 699 H TYR 96 H TYR 96 7.971 11.478 5.326 700 HA TYR 96 HA TYR 96 6.923 13.592 3.818 701 HB2 TYR 96 2HB TYR 96 6.176 11.783 2.231 702 HB3 TYR 96 1HB TYR 96 7.889 11.739 2.668 703 HD1 TYR 96 2HD TYR 96 8.769 9.956 4.082 704 HD2 TYR 96 1HD TYR 96 4.676 10.021 2.913 705 HE1 TYR 96 2HE TYR 96 8.535 7.604 4.772 706 HE2 TYR 96 1HE TYR 96 4.443 7.659 3.571 707 HH TYR 96 HH TYR 96 5.717 5.739 4.024 708 H ILE 97 H ILE 97 4.705 13.523 2.758 709 HA ILE 97 HA ILE 97 2.636 12.639 4.634 710 HB ILE 97 HB ILE 97 1.466 14.822 4.282 711 HG12 ILE 97 2HG1 ILE 97 3.998 16.165 3.639 712 HG13 ILE 97 1HG1 ILE 97 3.355 15.173 2.328 713 HG21 ILE 97 1HG2 ILE 97 2.555 14.429 6.375 714 HG22 ILE 97 2HG2 ILE 97 2.923 16.080 5.871 715 HG23 ILE 97 3HG2 ILE 97 4.134 14.809 5.682 716 HD11 ILE 97 3HD1 ILE 97 1.635 16.558 1.943 717 HD12 ILE 97 1HD1 ILE 97 2.695 17.740 2.717 718 HD13 ILE 97 2HD1 ILE 97 1.424 16.950 3.653 719 HA PRO 98 HA PRO 98 2.530 10.239 3.633 720 HB2 PRO 98 2HB PRO 98 -0.210 9.546 2.549 721 HB3 PRO 98 1HB PRO 98 0.631 8.841 3.950 722 HG2 PRO 98 2HG PRO 98 -0.897 11.272 3.793 723 HG3 PRO 98 1HG PRO 98 -0.147 10.503 5.223 724 HD2 PRO 98 2HD PRO 98 0.903 12.697 4.478 725 HD3 PRO 98 1HD PRO 98 2.012 11.314 4.634 726 H ARG 99 H ARG 99 2.909 8.073 2.683 727 HA ARG 99 HA ARG 99 2.938 8.099 -0.253 728 HB2 ARG 99 2HB ARG 99 5.152 7.798 1.667 729 HB3 ARG 99 1HB ARG 99 5.161 6.663 0.327 730 HG2 ARG 99 2HG ARG 99 6.485 8.495 -0.271 731 HG3 ARG 99 1HG ARG 99 5.007 8.613 -1.216 732 HD2 ARG 99 2HD ARG 99 4.245 10.166 0.738 733 HD3 ARG 99 1HD ARG 99 5.969 10.289 1.063 734 HE ARG 99 HE ARG 99 5.708 10.801 -1.614 735 HH11 ARG 99 1HH1 ARG 99 4.415 12.179 1.318 736 HH12 ARG 99 2HH1 ARG 99 4.299 13.779 0.664 737 HH21 ARG 99 1HH2 ARG 99 5.559 12.904 -2.476 738 HH22 ARG 99 2HH2 ARG 99 4.948 14.190 -1.490 739 H ILE 100 H ILE 100 4.082 5.686 -0.706 740 HA ILE 100 HA ILE 100 1.922 3.869 -0.089 741 HB ILE 100 HB ILE 100 2.843 2.390 -1.692 742 HG12 ILE 100 2HG1 ILE 100 5.386 4.002 -1.444 743 HG13 ILE 100 1HG1 ILE 100 5.151 2.312 -1.019 744 HG21 ILE 100 1HG2 ILE 100 1.948 4.721 -2.412 745 HG22 ILE 100 2HG2 ILE 100 2.711 3.672 -3.605 746 HG23 ILE 100 3HG2 ILE 100 3.618 5.009 -2.899 747 HD11 ILE 100 3HD1 ILE 100 4.454 2.502 -3.713 748 HD12 ILE 100 1HD1 ILE 100 5.911 1.785 -3.026 749 HD13 ILE 100 2HD1 ILE 100 5.913 3.476 -3.526 750 H LEU 101 H LEU 101 1.898 2.480 1.538 751 HA LEU 101 HA LEU 101 4.443 1.739 2.814 752 HB2 LEU 101 2HB LEU 101 1.740 2.289 4.011 753 HB3 LEU 101 1HB LEU 101 2.996 1.438 4.886 754 HG LEU 101 HG LEU 101 4.320 3.347 5.100 755 HD11 LEU 101 1HD1 LEU 101 4.496 4.205 2.937 756 HD12 LEU 101 2HD1 LEU 101 3.690 5.483 3.846 757 HD13 LEU 101 3HD1 LEU 101 2.753 4.429 2.789 758 HD21 LEU 101 3HD2 LEU 101 1.677 4.722 5.110 759 HD22 LEU 101 1HD2 LEU 101 2.979 4.769 6.301 760 HD23 LEU 101 2HD2 LEU 101 1.938 3.351 6.191 761 H PHE 102 H PHE 102 4.926 -0.379 2.475 762 HA PHE 102 HA PHE 102 2.811 -2.240 1.831 763 HB2 PHE 102 2HB PHE 102 5.757 -2.284 1.872 764 HB3 PHE 102 1HB PHE 102 4.995 -3.813 2.296 765 HD1 PHE 102 2HD PHE 102 2.868 -4.306 0.653 766 HD2 PHE 102 1HD PHE 102 6.364 -2.084 -0.319 767 HE1 PHE 102 2HE PHE 102 2.506 -4.788 -1.734 768 HE2 PHE 102 1HE PHE 102 6.009 -2.558 -2.706 769 HZ PHE 102 HZ PHE 102 4.078 -3.913 -3.416 770 H LEU 103 H LEU 103 2.333 -4.157 3.147 771 HA LEU 103 HA LEU 103 3.275 -4.256 5.846 772 HB2 LEU 103 2HB LEU 103 1.418 -3.476 7.003 773 HB3 LEU 103 1HB LEU 103 1.658 -2.301 5.731 774 HG LEU 103 HG LEU 103 -0.453 -4.446 5.829 775 HD11 LEU 103 1HD1 LEU 103 -0.475 -1.469 6.092 776 HD12 LEU 103 2HD1 LEU 103 -1.171 -2.685 7.163 777 HD13 LEU 103 3HD1 LEU 103 -1.907 -2.368 5.593 778 HD21 LEU 103 3HD2 LEU 103 0.587 -2.789 3.601 779 HD22 LEU 103 1HD2 LEU 103 -1.159 -3.002 3.718 780 HD23 LEU 103 2HD2 LEU 103 -0.110 -4.411 3.582 781 H ASP 104 H ASP 104 1.539 -5.666 7.186 782 HA ASP 104 HA ASP 104 1.442 -8.152 5.721 783 HB2 ASP 104 2HB ASP 104 1.054 -7.341 8.564 784 HB3 ASP 104 1HB ASP 104 0.350 -8.872 8.023 785 HA PRO 105 HA PRO 105 -2.743 -8.160 4.408 786 HB2 PRO 105 2HB PRO 105 -3.366 -10.793 4.615 787 HB3 PRO 105 1HB PRO 105 -2.274 -10.146 3.376 788 HG2 PRO 105 2HG PRO 105 -1.608 -11.461 5.989 789 HG3 PRO 105 1HG PRO 105 -0.894 -11.732 4.381 790 HD2 PRO 105 2HD PRO 105 0.310 -10.190 6.232 791 HD3 PRO 105 1HD PRO 105 0.403 -9.824 4.498 792 H SER 106 H SER 106 -2.476 -7.508 7.239 793 HA SER 106 HA SER 106 -5.106 -8.425 8.104 794 HB2 SER 106 2HB SER 106 -3.446 -7.954 10.410 795 HB3 SER 106 1HB SER 106 -4.316 -9.426 9.955 796 HG SER 106 HG SER 106 -2.535 -10.236 9.108 797 H GLY 107 H GLY 107 -3.656 -6.007 6.877 798 HA2 GLY 107 2HA GLY 107 -4.005 -3.745 6.903 799 HA3 GLY 107 1HA GLY 107 -5.219 -4.018 8.158 800 H LYS 108 H LYS 108 -1.716 -4.730 8.151 801 HA LYS 108 HA LYS 108 -1.478 -2.780 10.364 802 HB2 LYS 108 2HB LYS 108 0.064 -4.312 11.515 803 HB3 LYS 108 1HB LYS 108 -1.549 -4.992 11.341 804 HG2 LYS 108 2HG LYS 108 0.147 -5.696 9.112 805 HG3 LYS 108 1HG LYS 108 0.851 -6.196 10.661 806 HD2 LYS 108 2HD LYS 108 -1.996 -6.777 9.864 807 HD3 LYS 108 1HD LYS 108 -0.660 -7.882 9.546 808 HE2 LYS 108 2HE LYS 108 -0.313 -7.314 12.195 809 HE3 LYS 108 1HE LYS 108 -2.069 -7.294 12.046 810 HZ1 LYS 108 3HZ LYS 108 -2.146 -9.494 11.689 811 HZ2 LYS 108 1HZ LYS 108 -0.628 -9.507 12.434 812 HZ3 LYS 108 2HZ LYS 108 -0.742 -9.518 10.747 813 H VAL 109 H VAL 109 -0.535 -1.221 9.069 814 HA VAL 109 HA VAL 109 1.511 -1.498 7.240 815 HB VAL 109 HB VAL 109 0.585 0.733 8.983 816 HG11 VAL 109 1HG1 VAL 109 2.878 1.178 9.086 817 HG12 VAL 109 2HG1 VAL 109 2.273 2.195 7.778 818 HG13 VAL 109 3HG1 VAL 109 3.133 0.700 7.409 819 HG21 VAL 109 3HG2 VAL 109 0.392 1.784 6.651 820 HG22 VAL 109 1HG2 VAL 109 -0.720 0.480 7.065 821 HG23 VAL 109 2HG2 VAL 109 0.680 0.154 6.043 822 H HIS 110 H HIS 110 3.687 -1.453 7.301 823 HA HIS 110 HA HIS 110 5.139 -1.093 9.747 824 HB2 HIS 110 2HB HIS 110 4.301 -3.736 9.018 825 HB3 HIS 110 1HB HIS 110 6.052 -3.633 8.861 826 HD1 HIS 110 1HD HIS 110 7.358 -3.884 10.961 827 HD2 HIS 110 2HD HIS 110 3.376 -2.949 11.696 828 HE1 HIS 110 1HE HIS 110 7.083 -4.034 13.455 829 HE2 HIS 110 2HE HIS 110 4.645 -3.552 13.868 830 HA PRO 111 HA PRO 111 7.992 0.197 6.602 831 HB2 PRO 111 2HB PRO 111 10.215 0.471 8.137 832 HB3 PRO 111 1HB PRO 111 8.879 1.630 8.167 833 HG2 PRO 111 2HG PRO 111 9.496 -0.598 10.063 834 HG3 PRO 111 1HG PRO 111 8.952 1.051 10.415 835 HD2 PRO 111 2HD PRO 111 7.279 -1.087 10.428 836 HD3 PRO 111 1HD PRO 111 6.748 0.550 9.976 837 H GLU 112 H GLU 112 7.480 -2.605 6.775 838 HA GLU 112 HA GLU 112 10.042 -3.943 6.875 839 HB2 GLU 112 2HB GLU 112 7.207 -4.750 6.667 840 HB3 GLU 112 1HB GLU 112 8.357 -5.805 5.856 841 HG2 GLU 112 2HG GLU 112 9.160 -5.045 8.556 842 HG3 GLU 112 1HG GLU 112 7.650 -5.950 8.485 843 H ILE 113 H ILE 113 7.869 -2.664 4.454 844 HA ILE 113 HA ILE 113 9.892 -3.266 2.431 845 HB ILE 113 HB ILE 113 6.962 -3.841 2.020 846 HG12 ILE 113 2HG1 ILE 113 8.157 -5.500 3.440 847 HG13 ILE 113 1HG1 ILE 113 7.589 -6.173 1.906 848 HG21 ILE 113 1HG2 ILE 113 9.280 -4.287 0.149 849 HG22 ILE 113 2HG2 ILE 113 8.120 -2.965 0.019 850 HG23 ILE 113 3HG2 ILE 113 7.582 -4.634 -0.172 851 HD11 ILE 113 3HD1 ILE 113 9.756 -6.235 1.016 852 HD12 ILE 113 1HD1 ILE 113 9.912 -6.829 2.668 853 HD13 ILE 113 2HD1 ILE 113 10.396 -5.180 2.276 854 H ILE 114 H ILE 114 10.427 -1.547 1.373 855 HA ILE 114 HA ILE 114 8.475 0.618 0.938 856 HB ILE 114 HB ILE 114 10.263 2.243 1.224 857 HG12 ILE 114 2HG1 ILE 114 11.914 -0.230 1.513 858 HG13 ILE 114 1HG1 ILE 114 12.277 1.254 0.656 859 HG21 ILE 114 1HG2 ILE 114 10.112 2.329 3.497 860 HG22 ILE 114 2HG2 ILE 114 10.480 0.616 3.699 861 HG23 ILE 114 3HG2 ILE 114 8.874 1.117 3.171 862 HD11 ILE 114 3HD1 ILE 114 12.780 0.512 3.455 863 HD12 ILE 114 1HD1 ILE 114 12.280 2.178 3.171 864 HD13 ILE 114 2HD1 ILE 114 13.710 1.536 2.362 865 H ASN 115 H ASN 115 9.897 2.255 -0.673 866 HA ASN 115 HA ASN 115 10.287 0.590 -3.048 867 HB2 ASN 115 2HB ASN 115 8.660 2.399 -3.261 868 HB3 ASN 115 1HB ASN 115 9.886 3.579 -2.774 869 HD21 ASN 115 1HD2 ASN 115 9.815 4.762 -4.632 870 HD22 ASN 115 2HD2 ASN 115 10.376 4.159 -6.168 871 H GLU 116 H GLU 116 12.397 -0.087 -2.169 872 HA GLU 116 HA GLU 116 14.550 1.557 -1.644 873 HB2 GLU 116 2HB GLU 116 14.177 -1.237 -2.474 874 HB3 GLU 116 1HB GLU 116 15.745 -0.555 -2.925 875 HG2 GLU 116 2HG GLU 116 14.619 -0.439 -0.139 876 HG3 GLU 116 1HG GLU 116 15.663 -1.737 -0.717 877 H ASN 117 H ASN 117 13.091 0.777 -4.702 878 HA ASN 117 HA ASN 117 15.217 1.477 -6.408 879 HB2 ASN 117 2HB ASN 117 13.136 0.256 -7.092 880 HB3 ASN 117 1HB ASN 117 12.259 1.790 -6.976 881 HD21 ASN 117 1HD2 ASN 117 15.188 0.431 -8.458 882 HD22 ASN 117 2HD2 ASN 117 15.011 1.270 -9.976 883 H GLY 118 H GLY 118 12.812 3.383 -4.721 884 HA2 GLY 118 2HA GLY 118 13.151 5.795 -6.164 885 HA3 GLY 118 1HA GLY 118 12.505 5.651 -4.526 886 H ASN 119 H ASN 119 13.740 7.782 -4.493 887 HA ASN 119 HA ASN 119 16.580 7.739 -4.415 888 HB2 ASN 119 2HB ASN 119 16.265 9.979 -3.229 889 HB3 ASN 119 1HB ASN 119 15.592 9.839 -4.859 890 HD21 ASN 119 1HD2 ASN 119 14.229 11.595 -4.333 891 HD22 ASN 119 2HD2 ASN 119 12.787 11.348 -3.386 892 HA PRO 120 HA PRO 120 17.237 6.255 -0.304 893 HB2 PRO 120 2HB PRO 120 19.716 7.159 0.170 894 HB3 PRO 120 1HB PRO 120 19.398 5.922 -1.064 895 HG2 PRO 120 2HG PRO 120 19.847 8.867 -1.396 896 HG3 PRO 120 1HG PRO 120 20.488 7.517 -2.360 897 HD2 PRO 120 2HD PRO 120 18.322 9.042 -3.095 898 HD3 PRO 120 1HD PRO 120 18.585 7.362 -3.626 899 H SER 121 H SER 121 15.510 8.317 -0.076 900 HA SER 121 HA SER 121 16.017 9.358 2.468 901 HB2 SER 121 2HB SER 121 16.826 11.094 0.178 902 HB3 SER 121 1HB SER 121 15.997 11.862 1.542 903 HG SER 121 HG SER 121 17.769 11.695 2.642 904 H TYR 122 H TYR 122 13.970 8.044 1.133 905 HA TYR 122 HA TYR 122 11.706 9.505 1.915 906 HB2 TYR 122 2HB TYR 122 12.692 10.090 -0.714 907 HB3 TYR 122 1HB TYR 122 11.124 9.298 -0.847 908 HD1 TYR 122 1HD TYR 122 9.174 10.330 0.459 909 HD2 TYR 122 2HD TYR 122 12.868 12.343 -0.169 910 HE1 TYR 122 1HE TYR 122 8.078 12.481 0.928 911 HE2 TYR 122 2HE TYR 122 11.785 14.497 0.309 912 HH TYR 122 HH TYR 122 9.598 15.494 0.319 913 H LYS 123 H LYS 123 13.007 7.065 -0.272 914 HA LYS 123 HA LYS 123 12.321 4.962 -0.841 915 HB2 LYS 123 2HB LYS 123 11.675 5.207 2.072 916 HB3 LYS 123 1HB LYS 123 11.289 3.728 1.209 917 HG2 LYS 123 2HG LYS 123 14.026 4.967 1.417 918 HG3 LYS 123 1HG LYS 123 13.439 3.584 2.355 919 HD2 LYS 123 2HD LYS 123 14.413 2.391 0.706 920 HD3 LYS 123 1HD LYS 123 12.907 2.735 -0.154 921 HE2 LYS 123 2HE LYS 123 14.159 3.663 -1.749 922 HE3 LYS 123 1HE LYS 123 14.492 4.970 -0.613 923 HZ1 LYS 123 3HZ LYS 123 16.567 4.231 -0.238 924 HZ2 LYS 123 1HZ LYS 123 16.384 3.486 -1.747 925 HZ3 LYS 123 2HZ LYS 123 16.141 2.597 -0.329 926 H TYR 124 H TYR 124 9.677 5.290 1.416 927 HA TYR 124 HA TYR 124 7.683 4.201 -0.011 928 HB2 TYR 124 2HB TYR 124 7.247 6.648 1.701 929 HB3 TYR 124 1HB TYR 124 6.114 5.322 1.403 930 HD1 TYR 124 1HD TYR 124 6.387 3.182 2.538 931 HD2 TYR 124 2HD TYR 124 9.086 6.387 3.265 932 HE1 TYR 124 1HE TYR 124 7.216 2.020 4.536 933 HE2 TYR 124 2HE TYR 124 9.925 5.232 5.264 934 HH TYR 124 HH TYR 124 9.385 2.024 5.899 935 H PHE 125 H PHE 125 9.022 7.369 -0.615 936 HA PHE 125 HA PHE 125 6.830 8.322 -2.186 937 HB2 PHE 125 2HB PHE 125 8.391 9.905 -1.194 938 HB3 PHE 125 1HB PHE 125 9.727 9.199 -2.113 939 HD1 PHE 125 2HD PHE 125 6.310 9.991 -3.325 940 HD2 PHE 125 1HD PHE 125 10.443 11.005 -3.405 941 HE1 PHE 125 2HE PHE 125 5.881 11.577 -5.156 942 HE2 PHE 125 1HE PHE 125 10.021 12.593 -5.237 943 HZ PHE 125 HZ PHE 125 7.738 12.879 -6.116 944 H TYR 126 H TYR 126 6.267 7.732 -4.159 945 HA TYR 126 HA TYR 126 8.279 6.395 -5.840 946 HB2 TYR 126 2HB TYR 126 6.469 5.176 -6.907 947 HB3 TYR 126 1HB TYR 126 6.398 4.942 -5.156 948 HD1 TYR 126 2HD TYR 126 4.765 6.491 -3.860 949 HD2 TYR 126 1HD TYR 126 4.568 5.835 -8.058 950 HE1 TYR 126 2HE TYR 126 2.417 7.222 -3.857 951 HE2 TYR 126 1HE TYR 126 2.219 6.565 -8.067 952 HH TYR 126 HH TYR 126 0.749 8.057 -6.599 953 H VAL 127 H VAL 127 7.811 6.600 -8.219 954 HA VAL 127 HA VAL 127 6.371 8.841 -9.202 955 HB VAL 127 HB VAL 127 8.496 9.965 -10.128 956 HG11 VAL 127 1HG1 VAL 127 8.278 10.361 -7.181 957 HG12 VAL 127 2HG1 VAL 127 6.885 10.701 -8.207 958 HG13 VAL 127 3HG1 VAL 127 8.403 11.557 -8.472 959 HG21 VAL 127 3HG2 VAL 127 9.731 8.644 -7.715 960 HG22 VAL 127 1HG2 VAL 127 10.512 9.752 -8.843 961 HG23 VAL 127 2HG2 VAL 127 10.023 8.146 -9.380 962 H SER 128 H SER 128 5.577 7.635 -10.811 963 HA SER 128 HA SER 128 5.686 7.027 -13.075 964 HB2 SER 128 2HB SER 128 7.638 6.556 -14.230 965 HB3 SER 128 1HB SER 128 8.229 7.658 -12.976 966 HG SER 128 HG SER 128 9.358 5.527 -13.383 967 H ALA 129 H ALA 129 5.020 5.102 -13.914 968 HA ALA 129 HA ALA 129 4.410 3.025 -12.107 969 HB1 ALA 129 1HB ALA 129 4.036 3.506 -15.002 970 HB2 ALA 129 2HB ALA 129 2.866 3.049 -13.765 971 HB3 ALA 129 3HB ALA 129 3.946 1.833 -14.449 972 H GLU 130 H GLU 130 7.245 3.682 -13.869 973 HA GLU 130 HA GLU 130 8.187 1.132 -14.484 974 HB2 GLU 130 2HB GLU 130 9.224 3.783 -14.436 975 HB3 GLU 130 1HB GLU 130 10.377 2.742 -13.594 976 HG2 GLU 130 2HG GLU 130 10.711 1.396 -15.480 977 HG3 GLU 130 1HG GLU 130 9.261 2.020 -16.286 978 H GLN 131 H GLN 131 8.736 3.058 -11.519 979 HA GLN 131 HA GLN 131 10.061 0.878 -10.253 980 HB2 GLN 131 2HB GLN 131 9.750 2.241 -8.161 981 HB3 GLN 131 1HB GLN 131 10.769 2.918 -9.422 982 HG2 GLN 131 2HG GLN 131 8.240 3.907 -9.986 983 HG3 GLN 131 1HG GLN 131 8.350 3.961 -8.228 984 HE21 GLN 131 1HE2 GLN 131 9.520 5.520 -7.294 985 HE22 GLN 131 2HE2 GLN 131 10.496 6.668 -8.140 986 H VAL 132 H VAL 132 6.841 2.351 -9.876 987 HA VAL 132 HA VAL 132 5.909 0.816 -7.788 988 HB VAL 132 HB VAL 132 3.760 1.446 -8.324 989 HG11 VAL 132 1HG1 VAL 132 3.919 3.671 -8.562 990 HG12 VAL 132 2HG1 VAL 132 4.834 3.551 -10.065 991 HG13 VAL 132 3HG1 VAL 132 5.653 3.344 -8.516 992 HG21 VAL 132 3HG2 VAL 132 3.070 2.035 -10.704 993 HG22 VAL 132 1HG2 VAL 132 3.330 0.329 -10.337 994 HG23 VAL 132 2HG2 VAL 132 4.563 1.243 -11.204 995 H VAL 133 H VAL 133 6.468 -0.127 -11.087 996 HA VAL 133 HA VAL 133 4.938 -2.559 -10.848 997 HB VAL 133 HB VAL 133 5.194 -1.362 -13.025 998 HG11 VAL 133 1HG1 VAL 133 8.007 -1.892 -12.463 999 HG12 VAL 133 2HG1 VAL 133 7.269 -0.703 -13.533 1000 HG13 VAL 133 3HG1 VAL 133 7.510 -2.359 -14.088 1001 HG21 VAL 133 3HG2 VAL 133 6.283 -4.142 -13.277 1002 HG22 VAL 133 1HG2 VAL 133 5.092 -3.316 -14.284 1003 HG23 VAL 133 2HG2 VAL 133 4.654 -3.857 -12.664 1004 H GLN 134 H GLN 134 8.325 -1.589 -10.455 1005 HA GLN 134 HA GLN 134 9.219 -4.348 -10.463 1006 HB2 GLN 134 2HB GLN 134 11.305 -3.244 -9.322 1007 HB3 GLN 134 1HB GLN 134 10.997 -2.997 -11.035 1008 HG2 GLN 134 2HG GLN 134 9.981 -0.848 -10.542 1009 HG3 GLN 134 1HG GLN 134 10.292 -1.089 -8.823 1010 HE21 GLN 134 1HE2 GLN 134 11.456 0.182 -11.686 1011 HE22 GLN 134 2HE2 GLN 134 13.107 0.463 -11.197 1012 H GLY 135 H GLY 135 8.255 -1.958 -8.104 1013 HA2 GLY 135 2HA GLY 135 8.936 -3.574 -5.826 1014 HA3 GLY 135 1HA GLY 135 7.949 -2.105 -5.818 1015 H MET 136 H MET 136 6.348 -3.435 -8.080 1016 HA MET 136 HA MET 136 4.430 -4.727 -6.317 1017 HB2 MET 136 2HB MET 136 3.671 -3.059 -7.966 1018 HB3 MET 136 1HB MET 136 4.278 -4.073 -9.266 1019 HG2 MET 136 2HG MET 136 2.443 -5.316 -9.283 1020 HG3 MET 136 1HG MET 136 2.472 -5.521 -7.536 1021 HE1 MET 136 3HE MET 136 2.472 -3.120 -6.325 1022 HE2 MET 136 1HE MET 136 0.787 -2.678 -6.054 1023 HE3 MET 136 2HE MET 136 1.803 -1.685 -7.101 1024 H LYS 137 H LYS 137 6.413 -5.451 -9.115 1025 HA LYS 137 HA LYS 137 5.542 -8.153 -9.403 1026 HB2 LYS 137 2HB LYS 137 7.100 -8.308 -11.170 1027 HB3 LYS 137 1HB LYS 137 6.470 -6.671 -11.234 1028 HG2 LYS 137 2HG LYS 137 8.557 -6.064 -9.844 1029 HG3 LYS 137 1HG LYS 137 9.172 -7.626 -10.385 1030 HD2 LYS 137 2HD LYS 137 8.300 -5.317 -12.118 1031 HD3 LYS 137 1HD LYS 137 9.943 -5.920 -11.898 1032 HE2 LYS 137 2HE LYS 137 7.688 -7.543 -13.067 1033 HE3 LYS 137 1HE LYS 137 8.844 -6.629 -14.031 1034 HZ1 LYS 137 3HZ LYS 137 9.182 -9.140 -12.630 1035 HZ2 LYS 137 1HZ LYS 137 10.473 -8.058 -12.465 1036 HZ3 LYS 137 2HZ LYS 137 9.974 -8.550 -14.005 1037 H GLU 138 H GLU 138 7.647 -6.648 -7.244 1038 HA GLU 138 HA GLU 138 9.295 -9.030 -6.861 1039 HB2 GLU 138 2HB GLU 138 9.578 -6.162 -6.218 1040 HB3 GLU 138 1HB GLU 138 10.209 -7.274 -5.005 1041 HG2 GLU 138 2HG GLU 138 11.893 -6.521 -6.653 1042 HG3 GLU 138 1HG GLU 138 11.685 -8.279 -6.594 1043 H ALA 139 H ALA 139 7.712 -6.706 -4.691 1044 HA ALA 139 HA ALA 139 7.610 -8.275 -2.431 1045 HB1 ALA 139 1HB ALA 139 6.427 -6.582 -1.561 1046 HB2 ALA 139 2HB ALA 139 5.177 -6.698 -2.801 1047 HB3 ALA 139 3HB ALA 139 6.658 -5.795 -3.122 1048 H GLN 140 H GLN 140 5.620 -8.400 -5.293 1049 HA GLN 140 HA GLN 140 3.540 -9.952 -4.239 1050 HB2 GLN 140 2HB GLN 140 2.934 -10.379 -6.556 1051 HB3 GLN 140 1HB GLN 140 3.330 -8.678 -6.316 1052 HG2 GLN 140 2HG GLN 140 4.366 -9.202 -8.312 1053 HG3 GLN 140 1HG GLN 140 5.667 -9.334 -7.132 1054 HE21 GLN 140 1HE2 GLN 140 3.063 -11.468 -8.259 1055 HE22 GLN 140 2HE2 GLN 140 4.084 -12.821 -8.593 1056 H GLU 141 H GLU 141 6.754 -10.747 -4.974 1057 HA GLU 141 HA GLU 141 6.092 -13.608 -5.128 1058 HB2 GLU 141 2HB GLU 141 7.298 -13.369 -7.036 1059 HB3 GLU 141 1HB GLU 141 8.129 -11.924 -6.452 1060 HG2 GLU 141 2HG GLU 141 9.606 -13.331 -5.100 1061 HG3 GLU 141 1HG GLU 141 8.783 -14.770 -5.702 1062 H ARG 142 H ARG 142 7.747 -11.183 -3.289 1063 HA ARG 142 HA ARG 142 8.907 -13.299 -1.600 1064 HB2 ARG 142 2HB ARG 142 10.434 -11.451 -0.774 1065 HB3 ARG 142 1HB ARG 142 10.687 -12.000 -2.435 1066 HG2 ARG 142 2HG ARG 142 9.660 -10.066 -3.327 1067 HG3 ARG 142 1HG ARG 142 9.036 -9.582 -1.740 1068 HD2 ARG 142 2HD ARG 142 10.932 -8.210 -2.252 1069 HD3 ARG 142 1HD ARG 142 11.389 -9.340 -0.966 1070 HE ARG 142 HE ARG 142 12.028 -10.225 -3.640 1071 HH11 ARG 142 1HH1 ARG 142 13.141 -8.477 -0.830 1072 HH12 ARG 142 2HH1 ARG 142 14.817 -8.687 -1.211 1073 HH21 ARG 142 1HH2 ARG 142 14.231 -10.500 -4.140 1074 HH22 ARG 142 2HH2 ARG 142 15.437 -9.834 -3.090 1075 H LEU 143 H LEU 143 7.158 -10.207 -1.517 1076 HA LEU 143 HA LEU 143 6.923 -10.243 1.341 1077 HB2 LEU 143 2HB LEU 143 6.905 -8.144 0.067 1078 HB3 LEU 143 1HB LEU 143 5.399 -8.629 -0.709 1079 HG LEU 143 HG LEU 143 4.150 -8.320 1.252 1080 HD11 LEU 143 1HD1 LEU 143 6.686 -8.025 2.848 1081 HD12 LEU 143 2HD1 LEU 143 5.737 -9.508 2.756 1082 HD13 LEU 143 3HD1 LEU 143 5.031 -8.055 3.460 1083 HD21 LEU 143 3HD2 LEU 143 5.309 -6.045 2.143 1084 HD22 LEU 143 1HD2 LEU 143 4.339 -6.162 0.675 1085 HD23 LEU 143 2HD2 LEU 143 6.098 -6.235 0.578 1086 H THR 144 H THR 144 5.242 -11.739 -1.237 1087 HA THR 144 HA THR 144 2.726 -12.038 0.091 1088 HB THR 144 HB THR 144 2.358 -13.755 -1.730 1089 HG1 THR 144 1HG THR 144 4.549 -14.252 -2.107 1090 HG21 THR 144 3HG2 THR 144 1.520 -11.589 -2.163 1091 HG22 THR 144 1HG2 THR 144 2.396 -12.102 -3.604 1092 HG23 THR 144 2HG2 THR 144 3.137 -10.959 -2.483 1093 H GLY 145 H GLY 145 4.092 -12.748 2.089 1094 HA2 GLY 145 2HA GLY 145 3.448 -15.029 3.159 1095 HA3 GLY 145 1HA GLY 145 4.632 -15.634 2.011 1096 H ASP 146 H ASP 146 6.799 -15.373 2.410 1097 HA ASP 146 HA ASP 146 7.787 -13.643 4.458 1098 HB2 ASP 146 2HB ASP 146 7.288 -16.516 5.067 1099 HB3 ASP 146 1HB ASP 146 8.778 -15.799 5.675 1100 H ALA 147 H ALA 147 8.269 -14.301 1.658 1101 HA ALA 147 HA ALA 147 10.862 -15.602 1.616 1102 HB1 ALA 147 1HB ALA 147 10.492 -14.560 -0.894 1103 HB2 ALA 147 2HB ALA 147 8.841 -14.856 -0.352 1104 HB3 ALA 147 3HB ALA 147 10.012 -16.174 -0.373 1105 H PHE 148 H PHE 148 9.552 -12.408 1.744 1106 HA PHE 148 HA PHE 148 11.620 -10.904 0.640 1107 HB2 PHE 148 2HB PHE 148 10.765 -9.041 1.971 1108 HB3 PHE 148 1HB PHE 148 9.430 -9.970 1.274 1109 HD1 PHE 148 1HD PHE 148 8.112 -11.491 2.721 1110 HD2 PHE 148 2HD PHE 148 11.030 -8.830 4.306 1111 HE1 PHE 148 1HE PHE 148 7.120 -11.744 4.957 1112 HE2 PHE 148 2HE PHE 148 10.043 -9.078 6.548 1113 HZ PHE 148 HZ PHE 148 8.086 -10.536 6.875 1114 H ARG 149 H ARG 149 11.387 -12.524 3.718 1115 HA ARG 149 HA ARG 149 13.513 -11.165 5.005 1116 HB2 ARG 149 2HB ARG 149 12.749 -13.993 5.634 1117 HB3 ARG 149 1HB ARG 149 13.269 -12.721 6.723 1118 HG2 ARG 149 2HG ARG 149 11.093 -11.550 6.180 1119 HG3 ARG 149 1HG ARG 149 10.591 -13.062 5.422 1120 HD2 ARG 149 2HD ARG 149 11.681 -13.122 8.192 1121 HD3 ARG 149 1HD ARG 149 10.034 -12.552 7.940 1122 HE ARG 149 HE ARG 149 9.393 -14.694 7.355 1123 HH11 ARG 149 1HH1 ARG 149 12.865 -14.548 7.721 1124 HH12 ARG 149 2HH1 ARG 149 13.061 -16.266 7.704 1125 HH21 ARG 149 1HH2 ARG 149 9.656 -16.953 7.336 1126 HH22 ARG 149 2HH2 ARG 149 11.242 -17.632 7.487 1127 H LYS 150 H LYS 150 13.399 -14.511 3.827 1128 HA LYS 150 HA LYS 150 15.719 -14.412 2.274 1129 HB2 LYS 150 2HB LYS 150 17.295 -15.638 3.759 1130 HB3 LYS 150 1HB LYS 150 16.947 -14.003 4.308 1131 HG2 LYS 150 2HG LYS 150 15.367 -14.891 5.949 1132 HG3 LYS 150 1HG LYS 150 15.725 -16.531 5.401 1133 HD2 LYS 150 2HD LYS 150 17.128 -16.366 7.214 1134 HD3 LYS 150 1HD LYS 150 18.199 -15.828 5.919 1135 HE2 LYS 150 2HE LYS 150 18.311 -13.732 6.717 1136 HE3 LYS 150 1HE LYS 150 16.598 -13.694 7.133 1137 HZ1 LYS 150 3HZ LYS 150 18.888 -14.501 8.753 1138 HZ2 LYS 150 1HZ LYS 150 17.447 -15.355 8.984 1139 HZ3 LYS 150 2HZ LYS 150 17.480 -13.680 9.203 1140 H LYS 151 H LYS 151 16.424 -16.548 1.552 1141 HA LYS 151 HA LYS 151 15.044 -18.897 2.386 1142 HB2 LYS 151 2HB LYS 151 13.381 -17.483 0.939 1143 HB3 LYS 151 1HB LYS 151 14.335 -18.087 -0.410 1144 HG2 LYS 151 2HG LYS 151 12.462 -19.524 -0.137 1145 HG3 LYS 151 1HG LYS 151 13.893 -20.401 0.407 1146 HD2 LYS 151 2HD LYS 151 13.306 -20.202 2.658 1147 HD3 LYS 151 1HD LYS 151 12.194 -18.869 2.346 1148 HE2 LYS 151 2HE LYS 151 10.587 -20.422 2.450 1149 HE3 LYS 151 1HE LYS 151 11.123 -20.880 0.833 1150 HZ1 LYS 151 3HZ LYS 151 12.416 -22.623 1.694 1151 HZ2 LYS 151 1HZ LYS 151 10.942 -22.724 2.517 1152 HZ3 LYS 151 2HZ LYS 151 12.294 -22.058 3.284 1153 H HIS 152 H HIS 152 16.252 -17.678 -0.743 1154 HA HIS 152 HA HIS 152 17.725 -20.069 -1.249 1155 HB2 HIS 152 2HB HIS 152 17.830 -17.372 -2.616 1156 HB3 HIS 152 1HB HIS 152 18.590 -18.841 -3.219 1157 HD1 HIS 152 1HD HIS 152 17.110 -20.525 -4.420 1158 HD2 HIS 152 2HD HIS 152 14.992 -17.341 -2.793 1159 HE1 HIS 152 1HE HIS 152 14.788 -20.708 -5.368 1160 HE2 HIS 152 2HE HIS 152 13.500 -18.825 -4.298 1161 H LEU 153 H LEU 153 18.986 -16.740 -1.118 1162 HA LEU 153 HA LEU 153 20.933 -17.332 0.869 1163 HB2 LEU 153 2HB LEU 153 21.644 -18.315 -1.557 1164 HB3 LEU 153 1HB LEU 153 22.325 -16.702 -1.655 1165 HG LEU 153 HG LEU 153 23.377 -17.277 0.659 1166 HD11 LEU 153 1HD1 LEU 153 23.944 -19.877 0.391 1167 HD12 LEU 153 2HD1 LEU 153 22.304 -19.871 -0.259 1168 HD13 LEU 153 3HD1 LEU 153 22.607 -19.278 1.373 1169 HD21 LEU 153 3HD2 LEU 153 24.331 -18.521 -1.917 1170 HD22 LEU 153 1HD2 LEU 153 25.321 -18.270 -0.479 1171 HD23 LEU 153 2HD2 LEU 153 24.668 -16.885 -1.353 1172 H GLU 154 H GLU 154 20.777 -15.308 -2.067 1173 HA GLU 154 HA GLU 154 20.694 -12.934 -0.341 1174 HB2 GLU 154 2HB GLU 154 23.019 -13.594 -1.434 1175 HB3 GLU 154 1HB GLU 154 22.316 -12.814 -2.843 1176 HG2 GLU 154 2HG GLU 154 21.854 -10.830 -1.330 1177 HG3 GLU 154 1HG GLU 154 22.914 -11.616 -0.159 1178 H ASP 155 H ASP 155 20.557 -13.983 -3.747 1179 HA ASP 155 HA ASP 155 17.966 -12.760 -4.070 1180 HB2 ASP 155 2HB ASP 155 20.421 -11.430 -5.001 1181 HB3 ASP 155 1HB ASP 155 19.175 -11.599 -6.235 1182 H GLU 156 H GLU 156 20.738 -13.826 -6.051 1183 HA GLU 156 HA GLU 156 20.912 -15.352 -7.727 1184 HB2 GLU 156 2HB GLU 156 19.646 -16.642 -5.706 1185 HB3 GLU 156 1HB GLU 156 18.444 -16.810 -6.992 1186 HG2 GLU 156 2HG GLU 156 19.811 -18.732 -7.068 1187 HG3 GLU 156 1HG GLU 156 20.273 -17.726 -8.441 1188 H LEU 157 H LEU 157 20.527 -14.421 -9.639 1189 HA LEU 157 HA LEU 157 17.902 -14.693 -10.815 1190 HB2 LEU 157 2HB LEU 157 17.776 -12.308 -11.488 1191 HB3 LEU 157 1HB LEU 157 17.595 -12.565 -9.762 1192 HG LEU 157 HG LEU 157 20.243 -12.090 -9.862 1193 HD11 LEU 157 1HD1 LEU 157 20.372 -10.020 -11.408 1194 HD12 LEU 157 2HD1 LEU 157 19.034 -10.785 -12.265 1195 HD13 LEU 157 3HD1 LEU 157 20.577 -11.627 -12.104 1196 HD21 LEU 157 3HD2 LEU 157 18.592 -9.645 -9.911 1197 HD22 LEU 157 1HD2 LEU 157 19.731 -10.226 -8.695 1198 HD23 LEU 157 2HD2 LEU 157 18.099 -10.893 -8.767 Start of MODEL 16 1 H1 MET 1 1HT MET 1 -31.034 -4.112 -19.676 2 H2 MET 1 2HT MET 1 -32.359 -5.015 -19.066 3 H3 MET 1 3HT MET 1 -31.028 -4.646 -18.048 4 HA MET 1 HA MET 1 -32.692 -2.584 -19.304 5 HB2 MET 1 2HB MET 1 -33.962 -2.506 -17.221 6 HB3 MET 1 1HB MET 1 -34.098 -4.097 -17.961 7 HG2 MET 1 2HG MET 1 -32.156 -4.742 -16.399 8 HG3 MET 1 1HG MET 1 -32.588 -3.280 -15.515 9 HE1 MET 1 2HE MET 1 -33.938 -3.398 -13.557 10 HE2 MET 1 3HE MET 1 -33.028 -4.887 -13.300 11 HE3 MET 1 1HE MET 1 -34.766 -4.853 -13.003 12 H HIS 2 H HIS 2 -31.917 -0.602 -18.907 13 HA HIS 2 HA HIS 2 -30.176 -0.144 -16.614 14 HB2 HIS 2 2HB HIS 2 -28.794 -0.786 -18.677 15 HB3 HIS 2 1HB HIS 2 -29.294 0.761 -19.350 16 HD1 HIS 2 1HD HIS 2 -28.469 2.919 -18.033 17 HD2 HIS 2 2HD HIS 2 -26.723 -0.670 -16.876 18 HE1 HIS 2 1HE HIS 2 -26.429 3.560 -16.710 19 HE2 HIS 2 2HE HIS 2 -25.338 1.373 -16.100 20 H HIS 3 H HIS 3 -30.635 1.733 -15.664 21 HA HIS 3 HA HIS 3 -32.072 3.770 -17.234 22 HB2 HIS 3 2HB HIS 3 -32.709 2.514 -14.670 23 HB3 HIS 3 1HB HIS 3 -32.745 4.273 -14.604 24 HD1 HIS 3 1HD HIS 3 -34.203 5.312 -16.783 25 HD2 HIS 3 2HD HIS 3 -35.090 1.491 -15.412 26 HE1 HIS 3 1HE HIS 3 -36.522 4.819 -17.621 27 HE2 HIS 3 2HE HIS 3 -37.001 2.467 -16.855 28 H HIS 4 H HIS 4 -31.544 5.923 -16.912 29 HA HIS 4 HA HIS 4 -29.259 6.477 -15.146 30 HB2 HIS 4 2HB HIS 4 -28.326 7.966 -16.916 31 HB3 HIS 4 1HB HIS 4 -28.324 6.262 -17.361 32 HD1 HIS 4 1HD HIS 4 -30.058 5.520 -19.187 33 HD2 HIS 4 2HD HIS 4 -29.849 9.617 -18.531 34 HE1 HIS 4 1HE HIS 4 -31.237 6.573 -21.141 35 HE2 HIS 4 2HE HIS 4 -31.021 9.055 -20.769 36 H HIS 5 H HIS 5 -28.903 8.999 -15.142 37 HA HIS 5 HA HIS 5 -29.682 11.021 -14.452 38 HB2 HIS 5 2HB HIS 5 -31.018 10.470 -16.803 39 HB3 HIS 5 1HB HIS 5 -32.329 10.852 -15.694 40 HD1 HIS 5 1HD HIS 5 -31.494 13.180 -14.160 41 HD2 HIS 5 2HD HIS 5 -30.325 12.710 -18.121 42 HE1 HIS 5 1HE HIS 5 -30.909 15.488 -14.968 43 HE2 HIS 5 2HE HIS 5 -30.119 15.167 -17.337 44 H HIS 6 H HIS 6 -30.129 11.163 -12.358 45 HA HIS 6 HA HIS 6 -31.218 11.052 -10.366 46 HB2 HIS 6 2HB HIS 6 -33.296 11.394 -12.369 47 HB3 HIS 6 1HB HIS 6 -33.889 10.516 -10.963 48 HD1 HIS 6 1HD HIS 6 -32.773 13.873 -12.085 49 HD2 HIS 6 2HD HIS 6 -33.878 11.997 -8.545 50 HE1 HIS 6 1HE HIS 6 -33.148 15.728 -10.430 51 HE2 HIS 6 2HE HIS 6 -33.900 14.574 -8.320 52 H HIS 7 H HIS 7 -32.493 9.596 -8.922 53 HA HIS 7 HA HIS 7 -32.839 7.547 -7.996 54 HB2 HIS 7 2HB HIS 7 -34.045 7.472 -10.523 55 HB3 HIS 7 1HB HIS 7 -33.139 5.967 -10.408 56 HD1 HIS 7 1HD HIS 7 -36.263 7.513 -9.402 57 HD2 HIS 7 2HD HIS 7 -33.863 4.419 -8.015 58 HE1 HIS 7 1HE HIS 7 -37.728 6.164 -7.868 59 HE2 HIS 7 2HE HIS 7 -36.280 4.245 -7.111 60 H MET 8 H MET 8 -31.883 5.429 -7.681 61 HA MET 8 HA MET 8 -30.097 4.034 -7.482 62 HB2 MET 8 2HB MET 8 -30.069 4.810 -10.354 63 HB3 MET 8 1HB MET 8 -28.620 4.023 -9.718 64 HG2 MET 8 2HG MET 8 -29.991 2.141 -8.958 65 HG3 MET 8 1HG MET 8 -31.425 2.926 -9.617 66 HE1 MET 8 3HE MET 8 -32.096 2.876 -12.181 67 HE2 MET 8 1HE MET 8 -30.855 2.805 -13.433 68 HE3 MET 8 2HE MET 8 -30.824 4.097 -12.233 69 H SER 9 H SER 9 -29.849 6.818 -6.677 70 HA SER 9 HA SER 9 -26.929 7.125 -6.928 71 HB2 SER 9 2HB SER 9 -29.033 9.284 -6.645 72 HB3 SER 9 1HB SER 9 -27.293 9.568 -6.585 73 HG SER 9 HG SER 9 -28.912 9.213 -8.734 74 H ASP 10 H ASP 10 -26.003 6.505 -5.095 75 HA ASP 10 HA ASP 10 -26.682 7.744 -2.610 76 HB2 ASP 10 2HB ASP 10 -27.164 5.625 -1.388 77 HB3 ASP 10 1HB ASP 10 -28.409 6.052 -2.559 78 H GLY 11 H GLY 11 -24.844 8.017 -1.524 79 HA2 GLY 11 2HA GLY 11 -22.857 7.220 -0.485 80 HA3 GLY 11 1HA GLY 11 -22.753 5.964 -1.711 81 H HIS 12 H HIS 12 -20.548 7.474 -1.032 82 HA HIS 12 HA HIS 12 -20.254 9.392 -3.236 83 HB2 HIS 12 2HB HIS 12 -19.616 9.737 -0.634 84 HB3 HIS 12 1HB HIS 12 -18.081 9.098 -1.240 85 HD1 HIS 12 1HD HIS 12 -20.425 11.494 -3.021 86 HD2 HIS 12 2HD HIS 12 -16.600 11.379 -1.403 87 HE1 HIS 12 1HE HIS 12 -19.361 13.681 -3.658 88 HE2 HIS 12 2HE HIS 12 -17.017 13.551 -2.743 89 H ASN 13 H ASN 13 -17.619 9.419 -3.713 90 HA ASN 13 HA ASN 13 -16.868 6.654 -4.367 91 HB2 ASN 13 2HB ASN 13 -17.378 8.897 -6.222 92 HB3 ASN 13 1HB ASN 13 -15.909 7.976 -6.535 93 HD21 ASN 13 1HD2 ASN 13 -16.057 5.848 -7.178 94 HD22 ASN 13 2HD2 ASN 13 -17.539 5.134 -7.700 95 H GLY 14 H GLY 14 -14.889 6.188 -3.693 96 HA2 GLY 14 2HA GLY 14 -12.761 8.160 -3.862 97 HA3 GLY 14 1HA GLY 14 -13.195 7.657 -2.225 98 H LEU 15 H LEU 15 -12.157 6.415 -5.382 99 HA LEU 15 HA LEU 15 -10.533 4.420 -3.982 100 HB2 LEU 15 2HB LEU 15 -12.322 3.784 -6.330 101 HB3 LEU 15 1HB LEU 15 -11.211 2.670 -5.558 102 HG LEU 15 HG LEU 15 -13.304 3.917 -3.854 103 HD11 LEU 15 1HD1 LEU 15 -14.759 1.899 -4.555 104 HD12 LEU 15 2HD1 LEU 15 -13.817 1.949 -6.046 105 HD13 LEU 15 3HD1 LEU 15 -14.768 3.351 -5.555 106 HD21 LEU 15 3HD2 LEU 15 -11.584 2.411 -2.939 107 HD22 LEU 15 1HD2 LEU 15 -12.159 1.133 -4.010 108 HD23 LEU 15 2HD2 LEU 15 -13.215 1.767 -2.748 109 H GLY 16 H GLY 16 -9.421 3.112 -6.069 110 HA2 GLY 16 2HA GLY 16 -7.529 4.986 -7.059 111 HA3 GLY 16 1HA GLY 16 -7.650 3.301 -7.508 112 H LYS 17 H LYS 17 -9.416 6.347 -8.003 113 HA LYS 17 HA LYS 17 -9.754 5.571 -10.827 114 HB2 LYS 17 2HB LYS 17 -11.797 5.879 -9.102 115 HB3 LYS 17 1HB LYS 17 -11.626 7.545 -9.643 116 HG2 LYS 17 2HG LYS 17 -11.847 5.269 -11.583 117 HG3 LYS 17 1HG LYS 17 -13.269 6.055 -10.894 118 HD2 LYS 17 2HD LYS 17 -11.175 7.807 -12.052 119 HD3 LYS 17 1HD LYS 17 -12.146 6.856 -13.179 120 HE2 LYS 17 2HE LYS 17 -13.647 8.242 -11.056 121 HE3 LYS 17 1HE LYS 17 -12.857 9.288 -12.235 122 HZ1 LYS 17 3HZ LYS 17 -14.323 7.033 -13.328 123 HZ2 LYS 17 1HZ LYS 17 -14.235 8.634 -13.869 124 HZ3 LYS 17 2HZ LYS 17 -15.267 8.227 -12.592 125 H GLY 18 H GLY 18 -8.614 6.803 -12.165 126 HA2 GLY 18 2HA GLY 18 -8.491 9.211 -12.948 127 HA3 GLY 18 1HA GLY 18 -7.959 9.553 -11.299 128 H PHE 19 H PHE 19 -6.663 6.614 -12.022 129 HA PHE 19 HA PHE 19 -4.422 7.564 -13.577 130 HB2 PHE 19 2HB PHE 19 -2.950 6.515 -11.567 131 HB3 PHE 19 1HB PHE 19 -3.311 8.240 -11.714 132 HD1 PHE 19 1HD PHE 19 -4.380 5.103 -10.057 133 HD2 PHE 19 2HD PHE 19 -4.560 9.355 -10.077 134 HE1 PHE 19 1HE PHE 19 -5.459 5.065 -7.846 135 HE2 PHE 19 2HE PHE 19 -5.636 9.324 -7.865 136 HZ PHE 19 HZ PHE 19 -6.087 7.177 -6.747 137 H GLY 20 H GLY 20 -5.645 4.913 -11.545 138 HA2 GLY 20 2HA GLY 20 -4.480 3.051 -13.524 139 HA3 GLY 20 1HA GLY 20 -4.649 2.674 -11.808 140 H ASP 21 H ASP 21 -6.398 1.588 -11.174 141 HA ASP 21 HA ASP 21 -9.002 1.901 -12.086 142 HB2 ASP 21 2HB ASP 21 -7.348 0.201 -13.805 143 HB3 ASP 21 1HB ASP 21 -8.803 -0.618 -13.220 144 H HIS 22 H HIS 22 -7.536 -1.300 -11.814 145 HA HIS 22 HA HIS 22 -8.618 -1.524 -9.084 146 HB2 HIS 22 2HB HIS 22 -9.060 -3.961 -9.661 147 HB3 HIS 22 1HB HIS 22 -10.131 -2.785 -10.417 148 HD1 HIS 22 1HD HIS 22 -9.752 -2.341 -12.986 149 HD2 HIS 22 2HD HIS 22 -7.573 -5.501 -11.398 150 HE1 HIS 22 1HE HIS 22 -8.934 -3.655 -14.967 151 HE2 HIS 22 2HE HIS 22 -7.728 -5.632 -13.976 152 H ILE 23 H ILE 23 -6.504 -1.022 -8.351 153 HA ILE 23 HA ILE 23 -4.685 -3.316 -8.417 154 HB ILE 23 HB ILE 23 -3.941 -0.453 -8.989 155 HG12 ILE 23 2HG1 ILE 23 -2.814 -2.342 -10.804 156 HG13 ILE 23 1HG1 ILE 23 -4.538 -2.671 -10.660 157 HG21 ILE 23 1HG2 ILE 23 -2.396 -2.511 -7.715 158 HG22 ILE 23 2HG2 ILE 23 -2.014 -0.817 -8.004 159 HG23 ILE 23 3HG2 ILE 23 -1.661 -2.018 -9.243 160 HD11 ILE 23 3HD1 ILE 23 -3.178 -0.515 -12.007 161 HD12 ILE 23 1HD1 ILE 23 -4.386 0.083 -10.871 162 HD13 ILE 23 2HD1 ILE 23 -4.853 -1.053 -12.139 163 H HIS 24 H HIS 24 -3.788 -0.174 -7.144 164 HA HIS 24 HA HIS 24 -3.509 -1.300 -4.526 165 HB2 HIS 24 2HB HIS 24 -3.042 1.589 -5.166 166 HB3 HIS 24 1HB HIS 24 -2.269 0.599 -3.928 167 HD1 HIS 24 1HD HIS 24 -1.825 1.849 -7.322 168 HD2 HIS 24 2HD HIS 24 -0.332 -1.282 -5.044 169 HE1 HIS 24 1HE HIS 24 0.276 1.112 -8.484 170 HE2 HIS 24 2HE HIS 24 1.216 -0.711 -7.029 171 H TRP 25 H TRP 25 -6.121 -1.264 -5.331 172 HA TRP 25 HA TRP 25 -7.381 0.077 -3.157 173 HB2 TRP 25 2HB TRP 25 -8.935 1.206 -5.075 174 HB3 TRP 25 1HB TRP 25 -7.601 2.029 -4.269 175 HD1 TRP 25 HD TRP 25 -8.467 0.278 -7.551 176 HE1 TRP 25 1HE TRP 25 -6.766 0.988 -9.332 177 HE3 TRP 25 3HE TRP 25 -5.222 2.971 -4.647 178 HZ2 TRP 25 2HZ TRP 25 -4.406 2.480 -9.527 179 HZ3 TRP 25 3HZ TRP 25 -3.282 3.999 -5.713 180 HH2 TRP 25 HH TRP 25 -2.871 3.764 -8.106 181 H ARG 26 H ARG 26 -7.067 -2.533 -4.596 182 HA ARG 26 HA ARG 26 -9.360 -3.318 -5.905 183 HB2 ARG 26 2HB ARG 26 -7.070 -4.588 -4.801 184 HB3 ARG 26 1HB ARG 26 -8.490 -5.483 -4.247 185 HG2 ARG 26 2HG ARG 26 -9.187 -5.369 -6.757 186 HG3 ARG 26 1HG ARG 26 -7.469 -5.064 -7.020 187 HD2 ARG 26 2HD ARG 26 -7.089 -7.247 -6.885 188 HD3 ARG 26 1HD ARG 26 -7.642 -7.215 -5.203 189 HE ARG 26 HE ARG 26 -9.613 -8.175 -5.869 190 HH11 ARG 26 1HH1 ARG 26 -7.916 -7.010 -8.686 191 HH12 ARG 26 2HH1 ARG 26 -9.000 -7.763 -9.806 192 HH21 ARG 26 1HH2 ARG 26 -11.041 -9.168 -7.341 193 HH22 ARG 26 2HH2 ARG 26 -10.774 -8.988 -9.042 194 H THR 27 H THR 27 -8.668 -3.315 -2.422 195 HA THR 27 HA THR 27 -11.252 -2.699 -1.619 196 HB THR 27 HB THR 27 -11.533 -5.260 -0.654 197 HG1 THR 27 1HG THR 27 -10.069 -6.202 -1.983 198 HG21 THR 27 3HG2 THR 27 -13.058 -5.382 -2.895 199 HG22 THR 27 1HG2 THR 27 -12.842 -3.643 -2.702 200 HG23 THR 27 2HG2 THR 27 -13.529 -4.597 -1.388 201 H LEU 28 H LEU 28 -11.368 -2.315 0.530 202 HA LEU 28 HA LEU 28 -8.943 -2.816 2.078 203 HB2 LEU 28 2HB LEU 28 -10.308 -0.548 1.802 204 HB3 LEU 28 1HB LEU 28 -11.215 -1.221 3.156 205 HG LEU 28 HG LEU 28 -8.221 -1.003 3.275 206 HD11 LEU 28 1HD1 LEU 28 -10.110 1.145 4.201 207 HD12 LEU 28 2HD1 LEU 28 -9.251 1.212 2.663 208 HD13 LEU 28 3HD1 LEU 28 -8.348 1.181 4.176 209 HD21 LEU 28 3HD2 LEU 28 -9.989 -2.194 4.931 210 HD22 LEU 28 1HD2 LEU 28 -9.950 -0.570 5.618 211 HD23 LEU 28 2HD2 LEU 28 -8.458 -1.498 5.460 212 H GLU 29 H GLU 29 -12.471 -3.111 2.441 213 HA GLU 29 HA GLU 29 -12.252 -4.661 4.840 214 HB2 GLU 29 2HB GLU 29 -14.299 -3.280 3.492 215 HB3 GLU 29 1HB GLU 29 -14.797 -4.966 3.512 216 HG2 GLU 29 2HG GLU 29 -14.965 -5.037 5.794 217 HG3 GLU 29 1HG GLU 29 -13.798 -3.736 6.030 218 H ASP 30 H ASP 30 -12.488 -5.328 1.427 219 HA ASP 30 HA ASP 30 -12.905 -8.176 1.897 220 HB2 ASP 30 2HB ASP 30 -13.081 -6.370 -0.463 221 HB3 ASP 30 1HB ASP 30 -12.646 -8.058 -0.765 222 H GLY 31 H GLY 31 -10.423 -5.931 0.826 223 HA2 GLY 31 2HA GLY 31 -8.593 -7.896 -0.115 224 HA3 GLY 31 1HA GLY 31 -8.198 -6.231 0.323 225 H LYS 32 H LYS 32 -9.306 -6.605 3.048 226 HA LYS 32 HA LYS 32 -6.924 -7.817 4.204 227 HB2 LYS 32 2HB LYS 32 -7.712 -5.572 4.944 228 HB3 LYS 32 1HB LYS 32 -9.168 -6.328 5.576 229 HG2 LYS 32 2HG LYS 32 -6.558 -7.388 6.497 230 HG3 LYS 32 1HG LYS 32 -7.067 -5.809 7.098 231 HD2 LYS 32 2HD LYS 32 -9.327 -7.458 7.284 232 HD3 LYS 32 1HD LYS 32 -7.974 -8.436 7.855 233 HE2 LYS 32 2HE LYS 32 -7.547 -5.971 9.033 234 HE3 LYS 32 1HE LYS 32 -9.297 -6.169 9.104 235 HZ1 LYS 32 3HZ LYS 32 -9.131 -7.970 10.469 236 HZ2 LYS 32 1HZ LYS 32 -7.759 -7.116 10.971 237 HZ3 LYS 32 2HZ LYS 32 -7.601 -8.421 9.906 238 H LYS 33 H LYS 33 -10.445 -8.157 4.331 239 HA LYS 33 HA LYS 33 -10.481 -10.260 6.224 240 HB2 LYS 33 2HB LYS 33 -12.440 -8.835 5.650 241 HB3 LYS 33 1HB LYS 33 -12.531 -9.641 4.090 242 HG2 LYS 33 2HG LYS 33 -12.630 -11.802 5.609 243 HG3 LYS 33 1HG LYS 33 -13.250 -10.635 6.793 244 HD2 LYS 33 2HD LYS 33 -15.090 -10.089 5.446 245 HD3 LYS 33 1HD LYS 33 -14.358 -10.795 4.004 246 HE2 LYS 33 2HE LYS 33 -14.796 -12.973 4.699 247 HE3 LYS 33 1HE LYS 33 -15.000 -12.496 6.384 248 HZ1 LYS 33 3HZ LYS 33 -16.971 -11.124 5.259 249 HZ2 LYS 33 1HZ LYS 33 -17.164 -12.699 5.848 250 HZ3 LYS 33 2HZ LYS 33 -16.912 -12.439 4.196 251 H GLU 34 H GLU 34 -10.274 -10.179 2.713 252 HA GLU 34 HA GLU 34 -10.500 -13.037 2.436 253 HB2 GLU 34 2HB GLU 34 -11.293 -11.563 0.656 254 HB3 GLU 34 1HB GLU 34 -9.665 -10.916 0.451 255 HG2 GLU 34 2HG GLU 34 -8.947 -12.703 -0.711 256 HG3 GLU 34 1HG GLU 34 -9.937 -13.841 0.214 257 H ALA 35 H ALA 35 -7.912 -10.647 2.439 258 HA ALA 35 HA ALA 35 -5.801 -12.258 1.598 259 HB1 ALA 35 1HB ALA 35 -6.011 -9.788 3.245 260 HB2 ALA 35 2HB ALA 35 -5.215 -10.047 1.693 261 HB3 ALA 35 3HB ALA 35 -4.467 -10.634 3.178 262 H ALA 36 H ALA 36 -7.414 -12.059 4.683 263 HA ALA 36 HA ALA 36 -5.466 -13.277 6.298 264 HB1 ALA 36 1HB ALA 36 -7.205 -12.202 7.428 265 HB2 ALA 36 2HB ALA 36 -7.499 -13.916 7.716 266 HB3 ALA 36 3HB ALA 36 -8.450 -13.050 6.510 267 H ALA 37 H ALA 37 -8.195 -14.682 4.502 268 HA ALA 37 HA ALA 37 -7.536 -17.365 5.275 269 HB1 ALA 37 1HB ALA 37 -9.510 -17.948 4.355 270 HB2 ALA 37 2HB ALA 37 -9.256 -16.957 2.919 271 HB3 ALA 37 3HB ALA 37 -9.813 -16.211 4.417 272 H SER 38 H SER 38 -7.618 -15.786 2.074 273 HA SER 38 HA SER 38 -6.190 -17.818 0.756 274 HB2 SER 38 2HB SER 38 -6.714 -14.921 0.084 275 HB3 SER 38 1HB SER 38 -5.791 -15.987 -0.991 276 HG SER 38 HG SER 38 -7.704 -17.417 -0.814 277 H GLY 39 H GLY 39 -5.131 -15.100 2.650 278 HA2 GLY 39 2HA GLY 39 -3.016 -14.726 3.535 279 HA3 GLY 39 1HA GLY 39 -2.414 -16.088 2.583 280 H LEU 40 H LEU 40 -4.191 -13.392 1.223 281 HA LEU 40 HA LEU 40 -1.984 -12.833 -0.565 282 HB2 LEU 40 2HB LEU 40 -4.857 -12.328 -0.490 283 HB3 LEU 40 1HB LEU 40 -3.948 -10.933 -1.042 284 HG LEU 40 HG LEU 40 -3.501 -13.638 -2.271 285 HD11 LEU 40 1HD1 LEU 40 -5.971 -12.431 -2.280 286 HD12 LEU 40 2HD1 LEU 40 -5.377 -13.589 -3.471 287 HD13 LEU 40 3HD1 LEU 40 -5.234 -11.859 -3.778 288 HD21 LEU 40 3HD2 LEU 40 -2.254 -11.213 -2.555 289 HD22 LEU 40 1HD2 LEU 40 -3.367 -11.256 -3.921 290 HD23 LEU 40 2HD2 LEU 40 -2.192 -12.553 -3.698 291 HA PRO 41 HA PRO 41 -0.234 -9.617 1.986 292 HB2 PRO 41 2HB PRO 41 1.076 -8.268 -0.017 293 HB3 PRO 41 1HB PRO 41 1.696 -9.728 0.760 294 HG2 PRO 41 2HG PRO 41 0.181 -9.447 -1.805 295 HG3 PRO 41 1HG PRO 41 1.631 -10.413 -1.474 296 HD2 PRO 41 2HD PRO 41 -0.758 -11.571 -1.557 297 HD3 PRO 41 1HD PRO 41 0.419 -12.044 -0.313 298 H LEU 42 H LEU 42 -0.244 -7.244 2.151 299 HA LEU 42 HA LEU 42 -2.434 -6.017 0.617 300 HB2 LEU 42 2HB LEU 42 -2.146 -6.385 3.502 301 HB3 LEU 42 1HB LEU 42 -2.532 -4.740 3.038 302 HG LEU 42 HG LEU 42 -4.460 -5.713 1.699 303 HD11 LEU 42 1HD1 LEU 42 -4.632 -8.048 3.414 304 HD12 LEU 42 2HD1 LEU 42 -3.249 -8.114 2.320 305 HD13 LEU 42 3HD1 LEU 42 -4.876 -7.899 1.674 306 HD21 LEU 42 3HD2 LEU 42 -5.263 -4.647 3.526 307 HD22 LEU 42 1HD2 LEU 42 -4.197 -5.511 4.634 308 HD23 LEU 42 2HD2 LEU 42 -5.653 -6.296 4.020 309 H MET 43 H MET 43 -1.730 -4.356 -0.501 310 HA MET 43 HA MET 43 0.500 -2.737 0.553 311 HB2 MET 43 2HB MET 43 1.270 -3.533 -1.484 312 HB3 MET 43 1HB MET 43 -0.344 -3.562 -2.195 313 HG2 MET 43 2HG MET 43 0.114 -1.677 -3.248 314 HG3 MET 43 1HG MET 43 0.294 -0.851 -1.710 315 HE1 MET 43 3HE MET 43 2.841 -0.386 -0.555 316 HE2 MET 43 1HE MET 43 4.089 -1.562 -0.968 317 HE3 MET 43 2HE MET 43 2.526 -2.110 -0.361 318 H VAL 44 H VAL 44 0.336 -0.383 0.269 319 HA VAL 44 HA VAL 44 -2.419 0.574 -0.135 320 HB VAL 44 HB VAL 44 -0.605 1.369 2.147 321 HG11 VAL 44 1HG1 VAL 44 -1.694 3.361 1.451 322 HG12 VAL 44 2HG1 VAL 44 -2.585 2.765 2.851 323 HG13 VAL 44 3HG1 VAL 44 -3.230 2.523 1.228 324 HG21 VAL 44 3HG2 VAL 44 -1.893 0.129 3.518 325 HG22 VAL 44 1HG2 VAL 44 -2.191 -0.780 2.037 326 HG23 VAL 44 2HG2 VAL 44 -3.366 0.421 2.583 327 H ILE 45 H ILE 45 -2.627 2.812 -0.637 328 HA ILE 45 HA ILE 45 -0.277 4.341 -1.334 329 HB ILE 45 HB ILE 45 -2.245 3.510 -3.474 330 HG12 ILE 45 2HG1 ILE 45 0.635 2.822 -2.916 331 HG13 ILE 45 1HG1 ILE 45 -0.721 1.734 -3.234 332 HG21 ILE 45 1HG2 ILE 45 0.068 4.971 -4.405 333 HG22 ILE 45 2HG2 ILE 45 -0.861 5.923 -3.249 334 HG23 ILE 45 3HG2 ILE 45 -1.644 5.277 -4.690 335 HD11 ILE 45 3HD1 ILE 45 0.887 3.362 -5.161 336 HD12 ILE 45 1HD1 ILE 45 -0.735 2.810 -5.574 337 HD13 ILE 45 2HD1 ILE 45 0.523 1.638 -5.182 338 H ILE 46 H ILE 46 -0.912 6.029 -0.059 339 HA ILE 46 HA ILE 46 -3.640 7.040 -0.311 340 HB ILE 46 HB ILE 46 -1.538 8.189 1.490 341 HG12 ILE 46 2HG1 ILE 46 -3.239 6.235 2.792 342 HG13 ILE 46 1HG1 ILE 46 -2.262 5.490 1.526 343 HG21 ILE 46 1HG2 ILE 46 -3.510 9.474 1.456 344 HG22 ILE 46 2HG2 ILE 46 -3.573 8.519 2.940 345 HG23 ILE 46 3HG2 ILE 46 -4.534 8.043 1.540 346 HD11 ILE 46 3HD1 ILE 46 -0.373 6.922 2.717 347 HD12 ILE 46 1HD1 ILE 46 -0.841 5.323 3.300 348 HD13 ILE 46 2HD1 ILE 46 -1.480 6.773 4.080 349 H HIS 47 H HIS 47 -4.082 9.230 -0.819 350 HA HIS 47 HA HIS 47 -1.868 10.679 -2.109 351 HB2 HIS 47 2HB HIS 47 -3.432 11.367 -3.912 352 HB3 HIS 47 1HB HIS 47 -3.138 9.622 -3.885 353 HD1 HIS 47 1HD HIS 47 -5.787 11.801 -4.468 354 HD2 HIS 47 2HD HIS 47 -5.380 8.437 -2.067 355 HE1 HIS 47 1HE HIS 47 -8.128 10.977 -4.064 356 HE2 HIS 47 2HE HIS 47 -7.849 8.890 -2.680 357 H LYS 48 H LYS 48 -1.948 11.767 0.052 358 HA LYS 48 HA LYS 48 -4.221 13.595 0.348 359 HB2 LYS 48 2HB LYS 48 -2.290 12.404 2.155 360 HB3 LYS 48 1HB LYS 48 -2.388 14.143 2.384 361 HG2 LYS 48 2HG LYS 48 -4.965 12.737 2.167 362 HG3 LYS 48 1HG LYS 48 -4.003 12.375 3.601 363 HD2 LYS 48 2HD LYS 48 -5.176 14.190 4.355 364 HD3 LYS 48 1HD LYS 48 -3.758 14.999 3.681 365 HE2 LYS 48 2HE LYS 48 -5.340 14.874 1.497 366 HE3 LYS 48 1HE LYS 48 -6.559 14.995 2.765 367 HZ1 LYS 48 3HZ LYS 48 -5.840 17.066 3.385 368 HZ2 LYS 48 1HZ LYS 48 -5.552 17.128 1.719 369 HZ3 LYS 48 2HZ LYS 48 -4.274 16.842 2.789 370 H SER 49 H SER 49 -3.985 15.854 0.419 371 HA SER 49 HA SER 49 -3.167 17.886 -0.205 372 HB2 SER 49 2HB SER 49 -1.134 16.757 1.230 373 HB3 SER 49 1HB SER 49 -0.331 17.079 -0.307 374 HG SER 49 HG SER 49 -0.219 18.853 1.156 375 H TRP 50 H TRP 50 -0.840 18.461 -1.817 376 HA TRP 50 HA TRP 50 -1.835 18.330 -4.364 377 HB2 TRP 50 2HB TRP 50 0.549 18.609 -5.138 378 HB3 TRP 50 1HB TRP 50 0.033 19.758 -3.895 379 HD1 TRP 50 HD TRP 50 2.413 16.836 -4.477 380 HE1 TRP 50 1HE TRP 50 4.069 16.707 -2.510 381 HE3 TRP 50 3HE TRP 50 0.267 20.293 -1.381 382 HZ2 TRP 50 2HZ TRP 50 4.420 17.912 0.017 383 HZ3 TRP 50 3HZ TRP 50 1.327 20.745 0.793 384 HH2 TRP 50 HH TRP 50 3.358 19.579 1.477 385 H CYS 51 H CYS 51 0.421 16.046 -2.854 386 HA CYS 51 HA CYS 51 1.074 13.939 -3.405 387 HB2 CYS 51 2HB CYS 51 -1.131 13.340 -2.747 388 HB3 CYS 51 1HB CYS 51 -1.818 13.926 -4.256 389 H GLY 52 H GLY 52 2.628 13.909 -4.929 390 HA2 GLY 52 2HA GLY 52 1.874 14.287 -7.744 391 HA3 GLY 52 1HA GLY 52 3.522 14.282 -7.109 392 H ALA 53 H ALA 53 2.675 11.835 -5.476 393 HA ALA 53 HA ALA 53 3.677 9.889 -7.265 394 HB1 ALA 53 1HB ALA 53 4.159 9.072 -5.239 395 HB2 ALA 53 2HB ALA 53 2.509 8.450 -5.237 396 HB3 ALA 53 3HB ALA 53 2.871 9.997 -4.469 397 H CYS 54 H CYS 54 0.589 11.190 -6.836 398 HA CYS 54 HA CYS 54 -0.667 8.837 -8.036 399 HB2 CYS 54 2HB CYS 54 -2.823 10.024 -7.429 400 HB3 CYS 54 1HB CYS 54 -1.827 9.503 -6.062 401 H LYS 55 H LYS 55 0.025 12.234 -8.539 402 HA LYS 55 HA LYS 55 -1.662 12.601 -10.781 403 HB2 LYS 55 2HB LYS 55 -0.606 14.673 -11.104 404 HB3 LYS 55 1HB LYS 55 -0.542 14.410 -9.368 405 HG2 LYS 55 2HG LYS 55 1.778 13.598 -9.629 406 HG3 LYS 55 1HG LYS 55 1.699 14.037 -11.343 407 HD2 LYS 55 2HD LYS 55 1.074 16.371 -10.552 408 HD3 LYS 55 1HD LYS 55 1.563 15.848 -8.940 409 HE2 LYS 55 2HE LYS 55 3.746 15.098 -10.181 410 HE3 LYS 55 1HE LYS 55 3.218 16.272 -11.387 411 HZ1 LYS 55 3HZ LYS 55 4.628 17.411 -9.905 412 HZ2 LYS 55 1HZ LYS 55 3.865 16.766 -8.538 413 HZ3 LYS 55 2HZ LYS 55 3.059 17.899 -9.501 414 H ALA 56 H ALA 56 1.827 11.816 -10.550 415 HA ALA 56 HA ALA 56 2.281 11.650 -13.326 416 HB1 ALA 56 1HB ALA 56 3.703 9.892 -11.356 417 HB2 ALA 56 2HB ALA 56 3.976 11.635 -11.380 418 HB3 ALA 56 3HB ALA 56 4.331 10.667 -12.810 419 H LEU 57 H LEU 57 1.197 9.270 -10.974 420 HA LEU 57 HA LEU 57 1.205 7.002 -12.592 421 HB2 LEU 57 2HB LEU 57 -0.548 7.818 -10.282 422 HB3 LEU 57 1HB LEU 57 -0.692 6.255 -11.052 423 HG LEU 57 HG LEU 57 0.797 6.692 -8.865 424 HD11 LEU 57 1HD1 LEU 57 0.225 4.548 -10.053 425 HD12 LEU 57 2HD1 LEU 57 1.783 4.590 -9.227 426 HD13 LEU 57 3HD1 LEU 57 1.710 4.769 -10.980 427 HD21 LEU 57 3HD2 LEU 57 2.372 8.210 -9.846 428 HD22 LEU 57 1HD2 LEU 57 2.681 7.103 -11.183 429 HD23 LEU 57 2HD2 LEU 57 3.190 6.677 -9.550 430 H LYS 58 H LYS 58 -0.930 9.745 -12.542 431 HA LYS 58 HA LYS 58 -3.226 8.717 -13.613 432 HB2 LYS 58 2HB LYS 58 -1.959 11.385 -14.186 433 HB3 LYS 58 1HB LYS 58 -3.611 10.965 -14.603 434 HG2 LYS 58 2HG LYS 58 -4.010 10.506 -12.184 435 HG3 LYS 58 1HG LYS 58 -2.404 11.147 -11.857 436 HD2 LYS 58 2HD LYS 58 -4.780 12.605 -12.994 437 HD3 LYS 58 1HD LYS 58 -3.954 12.901 -11.462 438 HE2 LYS 58 2HE LYS 58 -2.747 14.443 -12.514 439 HE3 LYS 58 1HE LYS 58 -1.965 13.135 -13.394 440 HZ1 LYS 58 3HZ LYS 58 -2.938 14.919 -14.808 441 HZ2 LYS 58 1HZ LYS 58 -4.475 14.432 -14.293 442 HZ3 LYS 58 2HZ LYS 58 -3.498 13.365 -15.170 443 HA PRO 59 HA PRO 59 -1.942 9.018 -18.168 444 HB2 PRO 59 2HB PRO 59 0.348 10.180 -18.945 445 HB3 PRO 59 1HB PRO 59 -1.104 11.130 -18.565 446 HG2 PRO 59 2HG PRO 59 1.287 10.554 -16.842 447 HG3 PRO 59 1HG PRO 59 0.466 12.099 -17.130 448 HD2 PRO 59 2HD PRO 59 0.003 10.601 -14.922 449 HD3 PRO 59 1HD PRO 59 -1.252 11.610 -15.684 450 H LYS 60 H LYS 60 0.674 8.260 -15.947 451 HA LYS 60 HA LYS 60 1.814 6.391 -17.891 452 HB2 LYS 60 2HB LYS 60 3.711 6.219 -16.485 453 HB3 LYS 60 1HB LYS 60 3.277 7.923 -16.518 454 HG2 LYS 60 2HG LYS 60 1.908 7.267 -14.392 455 HG3 LYS 60 1HG LYS 60 3.073 5.956 -14.299 456 HD2 LYS 60 2HD LYS 60 3.601 8.925 -14.242 457 HD3 LYS 60 1HD LYS 60 3.964 7.734 -12.993 458 HE2 LYS 60 2HE LYS 60 5.736 6.815 -14.260 459 HE3 LYS 60 1HE LYS 60 5.229 7.653 -15.724 460 HZ1 LYS 60 3HZ LYS 60 5.828 9.749 -14.696 461 HZ2 LYS 60 1HZ LYS 60 7.157 8.699 -14.712 462 HZ3 LYS 60 2HZ LYS 60 6.297 8.955 -13.278 463 H PHE 61 H PHE 61 0.542 6.325 -14.543 464 HA PHE 61 HA PHE 61 0.696 3.519 -14.343 465 HB2 PHE 61 2HB PHE 61 0.470 5.152 -12.409 466 HB3 PHE 61 1HB PHE 61 -1.243 5.238 -12.816 467 HD1 PHE 61 2HD PHE 61 1.446 2.867 -11.885 468 HD2 PHE 61 1HD PHE 61 -2.737 3.632 -12.027 469 HE1 PHE 61 2HE PHE 61 1.035 0.832 -10.568 470 HE2 PHE 61 1HE PHE 61 -3.155 1.597 -10.711 471 HZ PHE 61 HZ PHE 61 -1.271 0.194 -9.979 472 H ALA 62 H ALA 62 -1.394 5.634 -16.028 473 HA ALA 62 HA ALA 62 -3.741 4.089 -16.132 474 HB1 ALA 62 1HB ALA 62 -2.607 6.330 -17.569 475 HB2 ALA 62 2HB ALA 62 -4.301 5.901 -17.329 476 HB3 ALA 62 3HB ALA 62 -3.399 5.209 -18.677 477 H GLU 63 H GLU 63 -0.584 3.674 -17.274 478 HA GLU 63 HA GLU 63 -0.997 1.802 -19.387 479 HB2 GLU 63 2HB GLU 63 1.015 3.349 -18.966 480 HB3 GLU 63 1HB GLU 63 1.499 2.186 -17.727 481 HG2 GLU 63 2HG GLU 63 0.899 0.962 -20.314 482 HG3 GLU 63 1HG GLU 63 2.231 2.115 -20.363 483 H SER 64 H SER 64 -1.162 1.668 -16.030 484 HA SER 64 HA SER 64 -0.175 -0.837 -15.390 485 HB2 SER 64 2HB SER 64 -2.399 0.812 -14.240 486 HB3 SER 64 1HB SER 64 -1.903 -0.710 -13.524 487 HG SER 64 HG SER 64 -0.331 1.620 -13.886 488 H THR 65 H THR 65 -2.400 -0.375 -17.738 489 HA THR 65 HA THR 65 -4.543 -2.017 -17.264 490 HB THR 65 HB THR 65 -3.228 -2.462 -19.876 491 HG1 THR 65 1HG THR 65 -3.632 -0.297 -20.519 492 HG21 THR 65 3HG2 THR 65 -5.913 -1.311 -19.169 493 HG22 THR 65 1HG2 THR 65 -5.583 -3.011 -19.499 494 HG23 THR 65 2HG2 THR 65 -5.368 -1.809 -20.771 495 H GLU 66 H GLU 66 -1.218 -2.850 -18.013 496 HA GLU 66 HA GLU 66 -1.749 -5.695 -17.972 497 HB2 GLU 66 2HB GLU 66 0.344 -4.073 -18.943 498 HB3 GLU 66 1HB GLU 66 1.046 -5.039 -17.641 499 HG2 GLU 66 2HG GLU 66 -0.264 -6.970 -18.910 500 HG3 GLU 66 1HG GLU 66 -0.023 -5.876 -20.272 501 H ILE 67 H ILE 67 -0.676 -3.165 -15.819 502 HA ILE 67 HA ILE 67 0.229 -4.943 -13.766 503 HB ILE 67 HB ILE 67 -0.733 -2.097 -13.468 504 HG12 ILE 67 2HG1 ILE 67 2.085 -3.122 -13.878 505 HG13 ILE 67 1HG1 ILE 67 1.107 -2.328 -15.122 506 HG21 ILE 67 1HG2 ILE 67 0.726 -2.119 -11.459 507 HG22 ILE 67 2HG2 ILE 67 0.952 -3.852 -11.697 508 HG23 ILE 67 3HG2 ILE 67 -0.654 -3.211 -11.349 509 HD11 ILE 67 3HD1 ILE 67 1.115 -0.632 -12.874 510 HD12 ILE 67 1HD1 ILE 67 1.891 -0.382 -14.438 511 HD13 ILE 67 2HD1 ILE 67 2.776 -1.166 -13.130 512 H SER 68 H SER 68 -2.825 -4.101 -14.987 513 HA SER 68 HA SER 68 -4.353 -4.330 -12.592 514 HB2 SER 68 2HB SER 68 -4.864 -3.954 -15.420 515 HB3 SER 68 1HB SER 68 -5.973 -5.145 -14.744 516 HG SER 68 HG SER 68 -5.492 -2.567 -13.654 517 H GLU 69 H GLU 69 -2.999 -6.530 -14.915 518 HA GLU 69 HA GLU 69 -4.431 -8.821 -13.896 519 HB2 GLU 69 2HB GLU 69 -2.059 -8.814 -15.763 520 HB3 GLU 69 1HB GLU 69 -3.237 -10.099 -15.538 521 HG2 GLU 69 2HG GLU 69 -3.787 -7.395 -16.738 522 HG3 GLU 69 1HG GLU 69 -3.596 -8.904 -17.627 523 H LEU 70 H LEU 70 -1.166 -7.479 -13.811 524 HA LEU 70 HA LEU 70 0.088 -9.515 -12.349 525 HB2 LEU 70 2HB LEU 70 0.585 -6.596 -12.740 526 HB3 LEU 70 1HB LEU 70 1.492 -7.445 -11.489 527 HG LEU 70 HG LEU 70 2.329 -9.020 -13.207 528 HD11 LEU 70 1HD1 LEU 70 1.951 -8.682 -15.518 529 HD12 LEU 70 2HD1 LEU 70 1.128 -7.146 -15.235 530 HD13 LEU 70 3HD1 LEU 70 0.369 -8.661 -14.743 531 HD21 LEU 70 3HD2 LEU 70 3.375 -6.722 -12.533 532 HD22 LEU 70 1HD2 LEU 70 2.953 -6.267 -14.185 533 HD23 LEU 70 2HD2 LEU 70 4.034 -7.630 -13.894 534 H SER 71 H SER 71 -2.251 -7.199 -11.386 535 HA SER 71 HA SER 71 -1.583 -7.095 -8.613 536 HB2 SER 71 2HB SER 71 -3.380 -5.777 -10.345 537 HB3 SER 71 1HB SER 71 -4.342 -6.540 -9.079 538 HG SER 71 HG SER 71 -3.601 -5.139 -7.701 539 H HIS 72 H HIS 72 -3.297 -9.379 -10.553 540 HA HIS 72 HA HIS 72 -5.092 -10.374 -8.637 541 HB2 HIS 72 2HB HIS 72 -5.409 -12.227 -10.046 542 HB3 HIS 72 1HB HIS 72 -4.960 -10.923 -11.152 543 HD1 HIS 72 1HD HIS 72 -4.526 -14.223 -11.246 544 HD2 HIS 72 2HD HIS 72 -1.707 -11.192 -10.939 545 HE1 HIS 72 1HE HIS 72 -2.378 -15.216 -12.097 546 HE2 HIS 72 2HE HIS 72 -0.709 -13.332 -11.992 547 H ASN 73 H ASN 73 -1.736 -10.393 -8.732 548 HA ASN 73 HA ASN 73 -1.351 -12.812 -7.202 549 HB2 ASN 73 2HB ASN 73 0.615 -10.641 -7.956 550 HB3 ASN 73 1HB ASN 73 0.998 -12.261 -7.372 551 HD21 ASN 73 1HD2 ASN 73 0.576 -10.348 -10.073 552 HD22 ASN 73 2HD2 ASN 73 0.432 -11.609 -11.264 553 H PHE 74 H PHE 74 -2.032 -9.549 -6.513 554 HA PHE 74 HA PHE 74 -1.947 -9.972 -3.715 555 HB2 PHE 74 2HB PHE 74 -0.373 -8.109 -3.193 556 HB3 PHE 74 1HB PHE 74 0.378 -9.543 -3.898 557 HD1 PHE 74 1HD PHE 74 0.169 -9.259 -6.720 558 HD2 PHE 74 2HD PHE 74 0.745 -6.235 -3.786 559 HE1 PHE 74 1HE PHE 74 1.285 -7.860 -8.397 560 HE2 PHE 74 2HE PHE 74 1.860 -4.824 -5.462 561 HZ PHE 74 HZ PHE 74 2.134 -5.641 -7.771 562 H VAL 75 H VAL 75 -2.952 -8.245 -2.496 563 HA VAL 75 HA VAL 75 -4.485 -6.439 -4.255 564 HB VAL 75 HB VAL 75 -5.952 -8.144 -3.368 565 HG11 VAL 75 1HG1 VAL 75 -6.250 -8.572 -1.032 566 HG12 VAL 75 2HG1 VAL 75 -5.149 -7.261 -0.602 567 HG13 VAL 75 3HG1 VAL 75 -4.531 -8.706 -1.401 568 HG21 VAL 75 3HG2 VAL 75 -7.620 -6.705 -2.958 569 HG22 VAL 75 1HG2 VAL 75 -6.398 -5.453 -3.184 570 HG23 VAL 75 2HG2 VAL 75 -6.802 -6.008 -1.560 571 H MET 76 H MET 76 -4.602 -4.297 -3.717 572 HA MET 76 HA MET 76 -3.339 -3.551 -1.177 573 HB2 MET 76 2HB MET 76 -3.040 -1.417 -2.990 574 HB3 MET 76 1HB MET 76 -1.798 -2.428 -2.293 575 HG2 MET 76 2HG MET 76 -3.310 -3.195 -4.765 576 HG3 MET 76 1HG MET 76 -1.807 -2.291 -4.801 577 HE1 MET 76 3HE MET 76 -2.914 -5.439 -5.848 578 HE2 MET 76 1HE MET 76 -1.312 -6.173 -5.924 579 HE3 MET 76 2HE MET 76 -1.567 -4.547 -6.557 580 H VAL 77 H VAL 77 -3.838 -0.875 -1.104 581 HA VAL 77 HA VAL 77 -6.705 -0.515 -1.506 582 HB VAL 77 HB VAL 77 -5.383 -0.975 1.085 583 HG11 VAL 77 1HG1 VAL 77 -7.275 0.421 2.182 584 HG12 VAL 77 2HG1 VAL 77 -7.230 1.336 0.677 585 HG13 VAL 77 3HG1 VAL 77 -5.780 1.211 1.678 586 HG21 VAL 77 3HG2 VAL 77 -7.270 -2.248 -0.244 587 HG22 VAL 77 1HG2 VAL 77 -8.307 -1.126 0.642 588 HG23 VAL 77 2HG2 VAL 77 -7.230 -2.213 1.519 589 H ASN 78 H ASN 78 -7.300 1.549 -1.873 590 HA ASN 78 HA ASN 78 -5.214 3.587 -1.803 591 HB2 ASN 78 2HB ASN 78 -6.485 3.286 -3.906 592 HB3 ASN 78 1HB ASN 78 -7.959 3.715 -3.060 593 HD21 ASN 78 1HD2 ASN 78 -4.891 5.258 -2.380 594 HD22 ASN 78 2HD2 ASN 78 -5.307 6.795 -3.072 595 H LEU 79 H LEU 79 -5.120 4.906 -0.175 596 HA LEU 79 HA LEU 79 -7.463 5.318 1.532 597 HB2 LEU 79 2HB LEU 79 -5.128 4.660 2.359 598 HB3 LEU 79 1HB LEU 79 -4.671 6.302 1.988 599 HG LEU 79 HG LEU 79 -5.102 6.106 4.335 600 HD11 LEU 79 1HD1 LEU 79 -5.997 8.097 2.858 601 HD12 LEU 79 2HD1 LEU 79 -6.319 8.014 4.589 602 HD13 LEU 79 3HD1 LEU 79 -7.557 7.513 3.437 603 HD21 LEU 79 3HD2 LEU 79 -6.856 5.043 5.283 604 HD22 LEU 79 1HD2 LEU 79 -6.891 4.197 3.736 605 HD23 LEU 79 2HD2 LEU 79 -7.984 5.549 4.025 606 H GLU 80 H GLU 80 -8.466 7.284 1.718 607 HA GLU 80 HA GLU 80 -7.253 9.582 0.348 608 HB2 GLU 80 2HB GLU 80 -8.998 8.387 -1.074 609 HB3 GLU 80 1HB GLU 80 -10.190 8.936 0.110 610 HG2 GLU 80 2HG GLU 80 -9.692 11.234 -0.374 611 HG3 GLU 80 1HG GLU 80 -8.358 10.760 -1.437 612 H ASP 81 H ASP 81 -8.253 11.663 0.948 613 HA ASP 81 HA ASP 81 -8.264 12.123 3.657 614 HB2 ASP 81 2HB ASP 81 -8.160 13.812 1.728 615 HB3 ASP 81 1HB ASP 81 -9.922 13.778 1.759 616 H GLU 82 H GLU 82 -10.900 11.068 1.631 617 HA GLU 82 HA GLU 82 -13.072 11.668 3.280 618 HB2 GLU 82 2HB GLU 82 -12.534 9.808 1.058 619 HB3 GLU 82 1HB GLU 82 -13.839 9.318 2.129 620 HG2 GLU 82 2HG GLU 82 -15.210 10.953 1.432 621 HG3 GLU 82 1HG GLU 82 -13.904 12.128 1.277 622 H GLU 83 H GLU 83 -10.716 9.096 3.425 623 HA GLU 83 HA GLU 83 -11.989 8.128 5.900 624 HB2 GLU 83 2HB GLU 83 -11.968 6.571 3.830 625 HB3 GLU 83 1HB GLU 83 -10.251 6.395 4.167 626 HG2 GLU 83 2HG GLU 83 -10.629 4.961 5.814 627 HG3 GLU 83 1HG GLU 83 -11.845 6.013 6.548 628 H GLU 84 H GLU 84 -10.784 9.305 7.335 629 HA GLU 84 HA GLU 84 -7.870 9.206 7.135 630 HB2 GLU 84 2HB GLU 84 -9.559 11.245 7.811 631 HB3 GLU 84 1HB GLU 84 -9.067 10.659 9.394 632 HG2 GLU 84 2HG GLU 84 -6.798 10.894 7.637 633 HG3 GLU 84 1HG GLU 84 -7.688 12.414 7.731 634 HA PRO 85 HA PRO 85 -8.312 5.799 10.129 635 HB2 PRO 85 2HB PRO 85 -5.790 4.845 9.797 636 HB3 PRO 85 1HB PRO 85 -7.122 4.458 8.687 637 HG2 PRO 85 2HG PRO 85 -4.947 6.506 8.406 638 HG3 PRO 85 1HG PRO 85 -5.584 5.369 7.194 639 HD2 PRO 85 2HD PRO 85 -6.326 7.968 7.271 640 HD3 PRO 85 1HD PRO 85 -7.436 6.674 6.757 641 H LYS 86 H LYS 86 -6.067 8.433 9.952 642 HA LYS 86 HA LYS 86 -4.893 9.577 11.526 643 HB2 LYS 86 2HB LYS 86 -6.916 8.160 13.247 644 HB3 LYS 86 1HB LYS 86 -5.682 9.210 13.954 645 HG2 LYS 86 2HG LYS 86 -6.849 11.023 13.449 646 HG3 LYS 86 1HG LYS 86 -6.989 10.533 11.760 647 HD2 LYS 86 2HD LYS 86 -9.188 10.408 12.227 648 HD3 LYS 86 1HD LYS 86 -8.761 8.849 12.938 649 HE2 LYS 86 2HE LYS 86 -8.681 9.770 15.121 650 HE3 LYS 86 1HE LYS 86 -8.742 11.420 14.502 651 HZ1 LYS 86 3HZ LYS 86 -10.943 9.452 14.199 652 HZ2 LYS 86 1HZ LYS 86 -10.991 11.100 13.819 653 HZ3 LYS 86 2HZ LYS 86 -10.872 10.606 15.433 654 H ASP 87 H ASP 87 -3.445 7.610 10.575 655 HA ASP 87 HA ASP 87 -2.039 6.575 12.931 656 HB2 ASP 87 2HB ASP 87 -3.571 4.937 11.321 657 HB3 ASP 87 1HB ASP 87 -1.947 4.745 10.644 658 H GLU 88 H GLU 88 0.168 6.493 12.761 659 HA GLU 88 HA GLU 88 1.446 8.262 11.014 660 HB2 GLU 88 2HB GLU 88 2.265 6.326 13.065 661 HB3 GLU 88 1HB GLU 88 3.480 6.637 11.833 662 HG2 GLU 88 2HG GLU 88 3.915 8.163 13.544 663 HG3 GLU 88 1HG GLU 88 3.110 9.097 12.286 664 H ASP 89 H ASP 89 0.382 5.083 10.427 665 HA ASP 89 HA ASP 89 2.210 3.895 8.813 666 HB2 ASP 89 2HB ASP 89 -0.783 4.012 8.687 667 HB3 ASP 89 1HB ASP 89 0.117 3.157 7.425 668 H PHE 90 H PHE 90 0.431 6.807 8.077 669 HA PHE 90 HA PHE 90 0.749 6.769 5.274 670 HB2 PHE 90 2HB PHE 90 0.326 9.205 5.389 671 HB3 PHE 90 1HB PHE 90 -0.849 8.266 6.316 672 HD1 PHE 90 1HD PHE 90 2.394 10.057 6.782 673 HD2 PHE 90 2HD PHE 90 -1.370 8.960 8.432 674 HE1 PHE 90 1HE PHE 90 2.873 11.424 8.768 675 HE2 PHE 90 2HE PHE 90 -0.900 10.325 10.423 676 HZ PHE 90 HZ PHE 90 1.224 11.561 10.594 677 H SER 91 H SER 91 2.887 7.662 7.877 678 HA SER 91 HA SER 91 5.137 7.701 6.098 679 HB2 SER 91 2HB SER 91 4.157 10.064 5.962 680 HB3 SER 91 1HB SER 91 4.669 10.254 7.646 681 HG SER 91 HG SER 91 6.668 10.422 7.007 682 HA PRO 92 HA PRO 92 5.800 6.408 10.565 683 HB2 PRO 92 2HB PRO 92 6.721 3.907 9.987 684 HB3 PRO 92 1HB PRO 92 5.008 4.276 10.258 685 HG2 PRO 92 2HG PRO 92 6.496 3.935 7.687 686 HG3 PRO 92 1HG PRO 92 4.886 3.345 8.135 687 HD2 PRO 92 2HD PRO 92 5.256 5.545 6.601 688 HD3 PRO 92 1HD PRO 92 3.890 5.379 7.718 689 H ASP 93 H ASP 93 7.633 6.363 7.617 690 HA ASP 93 HA ASP 93 9.980 7.298 8.971 691 HB2 ASP 93 2HB ASP 93 9.944 4.673 9.061 692 HB3 ASP 93 1HB ASP 93 10.438 4.804 7.368 693 H GLY 94 H GLY 94 8.109 8.125 6.866 694 HA2 GLY 94 2HA GLY 94 9.874 8.172 4.509 695 HA3 GLY 94 1HA GLY 94 8.145 8.543 4.507 696 H GLY 95 H GLY 95 7.440 10.590 5.176 697 HA2 GLY 95 2HA GLY 95 8.460 12.660 6.405 698 HA3 GLY 95 1HA GLY 95 9.533 12.634 5.005 699 H TYR 96 H TYR 96 6.039 12.100 5.327 700 HA TYR 96 HA TYR 96 5.247 14.576 4.267 701 HB2 TYR 96 2HB TYR 96 4.331 13.333 2.061 702 HB3 TYR 96 1HB TYR 96 5.871 14.199 2.107 703 HD1 TYR 96 2HD TYR 96 4.495 10.789 2.778 704 HD2 TYR 96 1HD TYR 96 7.747 13.106 1.309 705 HE1 TYR 96 2HE TYR 96 5.646 8.731 2.100 706 HE2 TYR 96 1HE TYR 96 8.910 11.051 0.630 707 HH TYR 96 HH TYR 96 8.514 8.777 0.152 708 H ILE 97 H ILE 97 2.858 14.074 3.112 709 HA ILE 97 HA ILE 97 1.527 12.011 4.638 710 HB ILE 97 HB ILE 97 -0.003 13.447 5.802 711 HG12 ILE 97 2HG1 ILE 97 -0.472 15.260 4.375 712 HG13 ILE 97 1HG1 ILE 97 0.409 15.965 5.726 713 HG21 ILE 97 1HG2 ILE 97 2.201 13.049 6.807 714 HG22 ILE 97 2HG2 ILE 97 1.474 14.570 7.322 715 HG23 ILE 97 3HG2 ILE 97 2.763 14.572 6.119 716 HD11 ILE 97 3HD1 ILE 97 1.350 15.489 2.928 717 HD12 ILE 97 1HD1 ILE 97 2.486 15.729 4.256 718 HD13 ILE 97 2HD1 ILE 97 1.321 16.990 3.854 719 HA PRO 98 HA PRO 98 0.743 10.146 3.812 720 HB2 PRO 98 2HB PRO 98 -1.997 9.777 2.563 721 HB3 PRO 98 1HB PRO 98 -1.196 8.712 3.750 722 HG2 PRO 98 2HG PRO 98 -2.626 11.127 4.225 723 HG3 PRO 98 1HG PRO 98 -1.760 10.101 5.405 724 HD2 PRO 98 2HD PRO 98 -0.814 12.460 4.951 725 HD3 PRO 98 1HD PRO 98 0.320 11.100 4.914 726 H ARG 99 H ARG 99 1.727 8.530 2.653 727 HA ARG 99 HA ARG 99 1.477 8.638 -0.274 728 HB2 ARG 99 2HB ARG 99 3.841 8.800 1.493 729 HB3 ARG 99 1HB ARG 99 4.023 7.813 0.042 730 HG2 ARG 99 2HG ARG 99 4.780 10.069 -0.351 731 HG3 ARG 99 1HG ARG 99 3.360 9.722 -1.334 732 HD2 ARG 99 2HD ARG 99 1.959 10.983 0.136 733 HD3 ARG 99 1HD ARG 99 3.251 11.153 1.315 734 HE ARG 99 HE ARG 99 4.033 12.934 0.126 735 HH11 ARG 99 1HH1 ARG 99 1.950 11.049 -1.946 736 HH12 ARG 99 2HH1 ARG 99 1.994 12.195 -3.244 737 HH21 ARG 99 1HH2 ARG 99 4.087 14.445 -1.578 738 HH22 ARG 99 2HH2 ARG 99 3.205 14.124 -3.034 739 H ILE 100 H ILE 100 3.086 6.588 -0.997 740 HA ILE 100 HA ILE 100 1.463 4.298 -0.481 741 HB ILE 100 HB ILE 100 4.022 4.638 -2.042 742 HG12 ILE 100 2HG1 ILE 100 2.023 4.027 -3.804 743 HG13 ILE 100 1HG1 ILE 100 1.157 4.975 -2.602 744 HG21 ILE 100 1HG2 ILE 100 2.210 2.234 -1.883 745 HG22 ILE 100 2HG2 ILE 100 3.882 2.331 -1.336 746 HG23 ILE 100 3HG2 ILE 100 3.508 2.449 -3.055 747 HD11 ILE 100 3HD1 ILE 100 3.644 6.237 -3.297 748 HD12 ILE 100 1HD1 ILE 100 1.997 6.859 -3.400 749 HD13 ILE 100 2HD1 ILE 100 2.670 5.919 -4.733 750 H LEU 101 H LEU 101 2.140 2.242 0.295 751 HA LEU 101 HA LEU 101 4.585 1.636 1.469 752 HB2 LEU 101 2HB LEU 101 3.607 1.673 3.914 753 HB3 LEU 101 1HB LEU 101 4.459 3.045 3.239 754 HG LEU 101 HG LEU 101 1.714 3.365 2.583 755 HD11 LEU 101 1HD1 LEU 101 0.647 3.354 4.724 756 HD12 LEU 101 2HD1 LEU 101 2.145 2.856 5.515 757 HD13 LEU 101 3HD1 LEU 101 1.316 1.751 4.417 758 HD21 LEU 101 3HD2 LEU 101 3.471 4.758 4.597 759 HD22 LEU 101 1HD2 LEU 101 1.932 5.366 3.986 760 HD23 LEU 101 2HD2 LEU 101 3.302 5.176 2.893 761 H PHE 102 H PHE 102 4.716 -0.512 1.922 762 HA PHE 102 HA PHE 102 2.301 -2.070 1.483 763 HB2 PHE 102 2HB PHE 102 4.861 -2.465 0.715 764 HB3 PHE 102 1HB PHE 102 4.829 -3.437 2.182 765 HD1 PHE 102 1HD PHE 102 2.678 -4.999 2.370 766 HD2 PHE 102 2HD PHE 102 4.333 -3.511 -1.256 767 HE1 PHE 102 1HE PHE 102 1.621 -6.842 1.137 768 HE2 PHE 102 2HE PHE 102 3.278 -5.354 -2.498 769 HZ PHE 102 HZ PHE 102 1.919 -7.023 -1.302 770 H LEU 103 H LEU 103 1.416 -3.563 2.899 771 HA LEU 103 HA LEU 103 2.410 -3.572 5.656 772 HB2 LEU 103 2HB LEU 103 -0.465 -3.686 5.657 773 HB3 LEU 103 1HB LEU 103 0.600 -2.612 6.530 774 HG LEU 103 HG LEU 103 0.706 -1.344 4.229 775 HD11 LEU 103 1HD1 LEU 103 -1.152 -3.379 3.664 776 HD12 LEU 103 2HD1 LEU 103 -0.722 -1.996 2.658 777 HD13 LEU 103 3HD1 LEU 103 -2.070 -1.880 3.790 778 HD21 LEU 103 3HD2 LEU 103 -0.452 -0.860 6.600 779 HD22 LEU 103 1HD2 LEU 103 -1.887 -0.932 5.577 780 HD23 LEU 103 2HD2 LEU 103 -0.599 0.218 5.211 781 H ASP 104 H ASP 104 1.791 -5.381 6.909 782 HA ASP 104 HA ASP 104 1.716 -7.819 5.469 783 HB2 ASP 104 2HB ASP 104 2.590 -7.221 7.904 784 HB3 ASP 104 1HB ASP 104 0.953 -7.717 8.359 785 HA PRO 105 HA PRO 105 -2.551 -8.438 4.523 786 HB2 PRO 105 2HB PRO 105 -2.633 -11.129 5.444 787 HB3 PRO 105 1HB PRO 105 -2.394 -10.564 3.782 788 HG2 PRO 105 2HG PRO 105 -0.394 -11.434 5.798 789 HG3 PRO 105 1HG PRO 105 -0.335 -11.535 4.022 790 HD2 PRO 105 2HD PRO 105 1.135 -9.745 5.375 791 HD3 PRO 105 1HD PRO 105 0.413 -9.349 3.801 792 H SER 106 H SER 106 -3.286 -7.030 6.185 793 HA SER 106 HA SER 106 -5.221 -7.916 7.852 794 HB2 SER 106 2HB SER 106 -3.976 -7.644 10.142 795 HB3 SER 106 1HB SER 106 -3.886 -9.192 9.285 796 HG SER 106 HG SER 106 -1.886 -7.668 10.048 797 H GLY 107 H GLY 107 -2.564 -5.693 7.436 798 HA2 GLY 107 2HA GLY 107 -3.239 -3.356 7.018 799 HA3 GLY 107 1HA GLY 107 -4.309 -3.515 8.415 800 H LYS 108 H LYS 108 -1.010 -4.757 8.234 801 HA LYS 108 HA LYS 108 -0.253 -2.755 10.273 802 HB2 LYS 108 2HB LYS 108 0.077 -5.682 10.185 803 HB3 LYS 108 1HB LYS 108 1.503 -4.791 10.699 804 HG2 LYS 108 2HG LYS 108 -0.390 -3.581 12.195 805 HG3 LYS 108 1HG LYS 108 -1.065 -5.215 12.066 806 HD2 LYS 108 2HD LYS 108 1.079 -6.133 12.862 807 HD3 LYS 108 1HD LYS 108 1.705 -4.492 13.035 808 HE2 LYS 108 2HE LYS 108 1.010 -4.996 15.187 809 HE3 LYS 108 1HE LYS 108 -0.371 -4.117 14.532 810 HZ1 LYS 108 3HZ LYS 108 -0.136 -6.914 15.277 811 HZ2 LYS 108 1HZ LYS 108 -1.021 -6.604 13.868 812 HZ3 LYS 108 2HZ LYS 108 -1.480 -5.889 15.330 813 H VAL 109 H VAL 109 0.630 -1.303 8.766 814 HA VAL 109 HA VAL 109 2.465 -2.027 6.752 815 HB VAL 109 HB VAL 109 1.163 0.221 7.124 816 HG11 VAL 109 1HG1 VAL 109 2.305 0.749 9.262 817 HG12 VAL 109 2HG1 VAL 109 2.494 2.011 8.044 818 HG13 VAL 109 3HG1 VAL 109 3.824 0.900 8.376 819 HG21 VAL 109 3HG2 VAL 109 2.203 0.122 5.103 820 HG22 VAL 109 1HG2 VAL 109 3.756 -0.335 5.802 821 HG23 VAL 109 2HG2 VAL 109 3.221 1.342 5.867 822 H HIS 110 H HIS 110 4.527 -2.388 6.721 823 HA HIS 110 HA HIS 110 6.102 -1.832 9.136 824 HB2 HIS 110 2HB HIS 110 7.496 -3.870 8.346 825 HB3 HIS 110 1HB HIS 110 5.975 -4.173 9.178 826 HD1 HIS 110 1HD HIS 110 3.890 -4.223 7.141 827 HD2 HIS 110 2HD HIS 110 7.714 -5.612 6.310 828 HE1 HIS 110 1HE HIS 110 3.635 -5.770 5.175 829 HE2 HIS 110 2HE HIS 110 5.969 -6.544 4.648 830 HA PRO 111 HA PRO 111 8.367 0.625 6.204 831 HB2 PRO 111 2HB PRO 111 10.577 1.078 7.758 832 HB3 PRO 111 1HB PRO 111 9.054 1.954 7.936 833 HG2 PRO 111 2HG PRO 111 10.101 -0.361 9.510 834 HG3 PRO 111 1HG PRO 111 9.260 1.092 10.080 835 HD2 PRO 111 2HD PRO 111 8.010 -1.283 9.807 836 HD3 PRO 111 1HD PRO 111 7.184 0.262 9.504 837 H GLU 112 H GLU 112 8.507 -2.235 5.923 838 HA GLU 112 HA GLU 112 11.368 -2.707 5.449 839 HB2 GLU 112 2HB GLU 112 9.134 -4.382 6.255 840 HB3 GLU 112 1HB GLU 112 10.003 -5.069 4.891 841 HG2 GLU 112 2HG GLU 112 10.887 -5.916 6.967 842 HG3 GLU 112 1HG GLU 112 12.092 -4.917 6.156 843 H ILE 113 H ILE 113 8.216 -3.237 3.862 844 HA ILE 113 HA ILE 113 9.543 -3.411 1.273 845 HB ILE 113 HB ILE 113 6.588 -3.578 1.827 846 HG12 ILE 113 2HG1 ILE 113 7.777 -5.290 3.128 847 HG13 ILE 113 1HG1 ILE 113 6.854 -6.019 1.804 848 HG21 ILE 113 1HG2 ILE 113 6.638 -4.882 -0.321 849 HG22 ILE 113 2HG2 ILE 113 8.310 -4.354 -0.513 850 HG23 ILE 113 3HG2 ILE 113 7.009 -3.165 -0.472 851 HD11 ILE 113 3HD1 ILE 113 8.874 -6.274 0.504 852 HD12 ILE 113 1HD1 ILE 113 9.069 -7.027 2.087 853 HD13 ILE 113 2HD1 ILE 113 9.813 -5.462 1.757 854 H ILE 114 H ILE 114 10.257 -1.357 0.903 855 HA ILE 114 HA ILE 114 8.181 0.686 0.445 856 HB ILE 114 HB ILE 114 9.854 2.388 1.053 857 HG12 ILE 114 2HG1 ILE 114 11.794 0.745 0.565 858 HG13 ILE 114 1HG1 ILE 114 11.985 1.889 1.885 859 HG21 ILE 114 1HG2 ILE 114 9.921 1.851 3.528 860 HG22 ILE 114 2HG2 ILE 114 9.116 0.339 3.108 861 HG23 ILE 114 3HG2 ILE 114 8.334 1.880 2.760 862 HD11 ILE 114 3HD1 ILE 114 10.799 -0.595 2.773 863 HD12 ILE 114 1HD1 ILE 114 12.224 0.257 3.368 864 HD13 ILE 114 2HD1 ILE 114 12.362 -0.839 1.994 865 H ASN 115 H ASN 115 9.559 2.607 -0.775 866 HA ASN 115 HA ASN 115 10.201 1.461 -3.347 867 HB2 ASN 115 2HB ASN 115 8.876 3.481 -3.340 868 HB3 ASN 115 1HB ASN 115 10.072 4.318 -2.342 869 HD21 ASN 115 1HD2 ASN 115 9.775 5.865 -4.177 870 HD22 ASN 115 2HD2 ASN 115 10.825 5.675 -5.554 871 H GLU 116 H GLU 116 12.102 0.297 -2.612 872 HA GLU 116 HA GLU 116 14.340 1.342 -1.410 873 HB2 GLU 116 2HB GLU 116 13.886 -0.883 -3.342 874 HB3 GLU 116 1HB GLU 116 15.553 -0.402 -2.997 875 HG2 GLU 116 2HG GLU 116 13.564 -1.069 -0.848 876 HG3 GLU 116 1HG GLU 116 14.602 -2.275 -1.599 877 H ASN 117 H ASN 117 13.188 1.938 -4.619 878 HA ASN 117 HA ASN 117 15.730 3.055 -5.492 879 HB2 ASN 117 2HB ASN 117 13.150 2.355 -6.793 880 HB3 ASN 117 1HB ASN 117 14.077 3.683 -7.510 881 HD21 ASN 117 1HD2 ASN 117 14.832 0.523 -6.062 882 HD22 ASN 117 2HD2 ASN 117 15.840 -0.023 -7.375 883 H GLY 118 H GLY 118 13.345 4.143 -3.537 884 HA2 GLY 118 2HA GLY 118 12.972 6.779 -4.653 885 HA3 GLY 118 1HA GLY 118 12.406 6.211 -3.080 886 H ASN 119 H ASN 119 13.359 7.069 -1.359 887 HA ASN 119 HA ASN 119 16.173 7.807 -1.443 888 HB2 ASN 119 2HB ASN 119 14.214 9.733 -1.946 889 HB3 ASN 119 1HB ASN 119 14.643 9.973 -0.247 890 HD21 ASN 119 1HD2 ASN 119 15.296 12.050 -1.339 891 HD22 ASN 119 2HD2 ASN 119 16.947 12.151 -1.885 892 HA PRO 120 HA PRO 120 16.338 6.648 2.801 893 HB2 PRO 120 2HB PRO 120 17.566 9.259 3.483 894 HB3 PRO 120 1HB PRO 120 18.198 7.618 3.709 895 HG2 PRO 120 2HG PRO 120 19.177 9.218 1.810 896 HG3 PRO 120 1HG PRO 120 18.969 7.473 1.527 897 HD2 PRO 120 2HD PRO 120 17.271 9.767 0.607 898 HD3 PRO 120 1HD PRO 120 17.754 8.293 -0.269 899 H SER 121 H SER 121 14.580 9.399 1.855 900 HA SER 121 HA SER 121 13.025 9.277 4.320 901 HB2 SER 121 2HB SER 121 14.860 11.350 3.914 902 HB3 SER 121 1HB SER 121 13.300 12.043 3.445 903 HG SER 121 HG SER 121 14.134 11.031 5.929 904 H TYR 122 H TYR 122 12.838 8.468 1.511 905 HA TYR 122 HA TYR 122 10.248 9.660 0.906 906 HB2 TYR 122 2HB TYR 122 12.725 10.068 -0.559 907 HB3 TYR 122 1HB TYR 122 11.468 9.381 -1.581 908 HD1 TYR 122 1HD TYR 122 12.545 12.276 0.360 909 HD2 TYR 122 2HD TYR 122 9.453 10.691 -2.090 910 HE1 TYR 122 1HE TYR 122 11.614 14.531 0.092 911 HE2 TYR 122 2HE TYR 122 8.507 12.944 -2.364 912 HH TYR 122 HH TYR 122 8.523 15.101 -1.205 913 H LYS 123 H LYS 123 11.755 6.996 1.671 914 HA LYS 123 HA LYS 123 11.477 5.082 -0.294 915 HB2 LYS 123 2HB LYS 123 11.409 5.058 2.686 916 HB3 LYS 123 1HB LYS 123 10.967 3.590 1.835 917 HG2 LYS 123 2HG LYS 123 13.572 5.068 1.550 918 HG3 LYS 123 1HG LYS 123 13.309 3.582 2.480 919 HD2 LYS 123 2HD LYS 123 13.494 2.317 0.658 920 HD3 LYS 123 1HD LYS 123 12.348 3.321 -0.237 921 HE2 LYS 123 2HE LYS 123 14.522 3.279 -1.328 922 HE3 LYS 123 1HE LYS 123 14.136 4.901 -0.757 923 HZ1 LYS 123 3HZ LYS 123 16.238 3.089 0.092 924 HZ2 LYS 123 1HZ LYS 123 15.463 3.933 1.337 925 HZ3 LYS 123 2HZ LYS 123 16.206 4.779 0.075 926 H TYR 124 H TYR 124 8.948 6.778 1.269 927 HA TYR 124 HA TYR 124 6.994 4.661 0.740 928 HB2 TYR 124 2HB TYR 124 6.697 7.296 2.182 929 HB3 TYR 124 1HB TYR 124 5.452 6.045 2.055 930 HD1 TYR 124 2HD TYR 124 9.018 6.411 3.142 931 HD2 TYR 124 1HD TYR 124 5.245 4.577 3.815 932 HE1 TYR 124 2HE TYR 124 9.917 5.316 5.148 933 HE2 TYR 124 1HE TYR 124 6.130 3.472 5.821 934 HH TYR 124 HH TYR 124 8.380 4.243 7.502 935 H PHE 125 H PHE 125 8.294 7.148 -0.972 936 HA PHE 125 HA PHE 125 5.817 8.021 -2.233 937 HB2 PHE 125 2HB PHE 125 8.061 9.393 -1.632 938 HB3 PHE 125 1HB PHE 125 8.435 8.922 -3.295 939 HD1 PHE 125 1HD PHE 125 6.318 9.281 -4.936 940 HD2 PHE 125 2HD PHE 125 7.095 11.433 -1.350 941 HE1 PHE 125 1HE PHE 125 4.953 11.149 -5.765 942 HE2 PHE 125 2HE PHE 125 5.735 13.308 -2.177 943 HZ PHE 125 HZ PHE 125 4.663 13.165 -4.392 944 H TYR 126 H TYR 126 5.307 7.681 -4.376 945 HA TYR 126 HA TYR 126 7.071 6.046 -6.022 946 HB2 TYR 126 2HB TYR 126 4.487 5.138 -4.879 947 HB3 TYR 126 1HB TYR 126 4.762 4.770 -6.586 948 HD1 TYR 126 1HD TYR 126 7.045 3.628 -7.136 949 HD2 TYR 126 2HD TYR 126 5.301 3.702 -3.259 950 HE1 TYR 126 1HE TYR 126 8.402 1.680 -6.495 951 HE2 TYR 126 2HE TYR 126 6.652 1.755 -2.606 952 HH TYR 126 HH TYR 126 7.805 -0.140 -3.717 953 H VAL 127 H VAL 127 7.152 8.206 -7.013 954 HA VAL 127 HA VAL 127 4.759 8.977 -8.500 955 HB VAL 127 HB VAL 127 5.824 10.798 -7.355 956 HG11 VAL 127 1HG1 VAL 127 8.229 9.472 -8.078 957 HG12 VAL 127 2HG1 VAL 127 8.003 10.838 -6.985 958 HG13 VAL 127 3HG1 VAL 127 8.288 11.120 -8.703 959 HG21 VAL 127 3HG2 VAL 127 5.557 12.262 -9.028 960 HG22 VAL 127 1HG2 VAL 127 5.177 10.840 -9.999 961 HG23 VAL 127 2HG2 VAL 127 6.809 11.508 -10.017 962 H SER 128 H SER 128 5.199 6.866 -9.669 963 HA SER 128 HA SER 128 5.759 7.276 -12.298 964 HB2 SER 128 2HB SER 128 8.220 7.169 -10.808 965 HB3 SER 128 1HB SER 128 8.140 5.794 -11.922 966 HG SER 128 HG SER 128 8.927 8.077 -12.607 967 H ALA 129 H ALA 129 4.662 5.673 -13.202 968 HA ALA 129 HA ALA 129 3.926 3.320 -11.861 969 HB1 ALA 129 1HB ALA 129 3.810 4.087 -14.767 970 HB2 ALA 129 2HB ALA 129 2.503 4.098 -13.581 971 HB3 ALA 129 3HB ALA 129 3.167 2.566 -14.147 972 H GLU 130 H GLU 130 6.798 4.120 -13.547 973 HA GLU 130 HA GLU 130 7.531 1.528 -14.436 974 HB2 GLU 130 2HB GLU 130 8.832 4.163 -14.172 975 HB3 GLU 130 1HB GLU 130 9.925 2.778 -14.060 976 HG2 GLU 130 2HG GLU 130 7.958 3.130 -16.307 977 HG3 GLU 130 1HG GLU 130 9.605 3.781 -16.351 978 H GLN 131 H GLN 131 8.246 3.378 -11.486 979 HA GLN 131 HA GLN 131 9.830 1.274 -10.395 980 HB2 GLN 131 2HB GLN 131 9.489 2.563 -8.233 981 HB3 GLN 131 1HB GLN 131 10.435 3.315 -9.508 982 HG2 GLN 131 2HG GLN 131 8.619 4.742 -10.113 983 HG3 GLN 131 1HG GLN 131 7.519 3.881 -9.038 984 HE21 GLN 131 1HE2 GLN 131 7.894 6.632 -8.931 985 HE22 GLN 131 2HE2 GLN 131 8.656 7.032 -7.434 986 H VAL 132 H VAL 132 6.541 2.469 -9.799 987 HA VAL 132 HA VAL 132 5.824 0.829 -7.712 988 HB VAL 132 HB VAL 132 3.580 1.261 -8.211 989 HG11 VAL 132 1HG1 VAL 132 5.410 3.303 -8.246 990 HG12 VAL 132 2HG1 VAL 132 3.667 3.480 -8.045 991 HG13 VAL 132 3HG1 VAL 132 4.392 3.656 -9.643 992 HG21 VAL 132 3HG2 VAL 132 2.810 2.017 -10.468 993 HG22 VAL 132 1HG2 VAL 132 3.373 0.346 -10.403 994 HG23 VAL 132 2HG2 VAL 132 4.408 1.601 -11.078 995 H VAL 133 H VAL 133 6.294 0.030 -11.065 996 HA VAL 133 HA VAL 133 4.934 -2.504 -10.850 997 HB VAL 133 HB VAL 133 5.021 -1.230 -12.998 998 HG11 VAL 133 1HG1 VAL 133 7.013 -0.436 -13.613 999 HG12 VAL 133 2HG1 VAL 133 7.370 -2.073 -14.159 1000 HG13 VAL 133 3HG1 VAL 133 7.876 -1.550 -12.555 1001 HG21 VAL 133 3HG2 VAL 133 4.463 -3.620 -12.892 1002 HG22 VAL 133 1HG2 VAL 133 6.168 -4.017 -13.101 1003 HG23 VAL 133 2HG2 VAL 133 5.287 -3.198 -14.391 1004 H GLN 134 H GLN 134 8.270 -1.320 -10.590 1005 HA GLN 134 HA GLN 134 9.332 -4.020 -10.675 1006 HB2 GLN 134 2HB GLN 134 11.402 -2.817 -9.629 1007 HB3 GLN 134 1HB GLN 134 10.983 -2.524 -11.310 1008 HG2 GLN 134 2HG GLN 134 9.874 -0.460 -10.676 1009 HG3 GLN 134 1HG GLN 134 10.289 -0.748 -8.987 1010 HE21 GLN 134 1HE2 GLN 134 11.573 -0.075 -12.178 1011 HE22 GLN 134 2HE2 GLN 134 13.091 0.587 -11.635 1012 H GLY 135 H GLY 135 8.207 -1.772 -8.275 1013 HA2 GLY 135 2HA GLY 135 9.103 -3.347 -6.028 1014 HA3 GLY 135 1HA GLY 135 8.011 -1.954 -5.972 1015 H MET 136 H MET 136 6.413 -3.254 -8.185 1016 HA MET 136 HA MET 136 4.607 -4.710 -6.471 1017 HB2 MET 136 2HB MET 136 4.547 -3.547 -9.189 1018 HB3 MET 136 1HB MET 136 3.563 -4.987 -8.963 1019 HG2 MET 136 2HG MET 136 2.557 -3.825 -6.960 1020 HG3 MET 136 1HG MET 136 3.363 -2.363 -7.518 1021 HE1 MET 136 3HE MET 136 -0.608 -3.832 -8.495 1022 HE2 MET 136 1HE MET 136 -0.209 -2.465 -7.457 1023 HE3 MET 136 2HE MET 136 0.480 -4.053 -7.126 1024 H LYS 137 H LYS 137 6.699 -5.344 -9.224 1025 HA LYS 137 HA LYS 137 6.067 -8.142 -9.339 1026 HB2 LYS 137 2HB LYS 137 7.648 -8.252 -11.124 1027 HB3 LYS 137 1HB LYS 137 6.756 -6.754 -11.313 1028 HG2 LYS 137 2HG LYS 137 8.769 -5.744 -9.991 1029 HG3 LYS 137 1HG LYS 137 9.598 -7.194 -10.561 1030 HD2 LYS 137 2HD LYS 137 8.290 -5.045 -12.221 1031 HD3 LYS 137 1HD LYS 137 10.001 -5.465 -12.157 1032 HE2 LYS 137 2HE LYS 137 7.822 -7.299 -13.149 1033 HE3 LYS 137 1HE LYS 137 8.836 -6.299 -14.188 1034 HZ1 LYS 137 3HZ LYS 137 10.778 -7.482 -13.374 1035 HZ2 LYS 137 1HZ LYS 137 9.665 -8.565 -14.046 1036 HZ3 LYS 137 2HZ LYS 137 9.809 -8.436 -12.366 1037 H GLU 138 H GLU 138 8.103 -6.225 -7.425 1038 HA GLU 138 HA GLU 138 10.168 -8.160 -6.967 1039 HB2 GLU 138 2HB GLU 138 10.619 -5.774 -6.675 1040 HB3 GLU 138 1HB GLU 138 9.395 -5.682 -5.412 1041 HG2 GLU 138 2HG GLU 138 10.792 -7.417 -4.170 1042 HG3 GLU 138 1HG GLU 138 12.071 -7.037 -5.336 1043 H ALA 139 H ALA 139 7.875 -6.724 -4.676 1044 HA ALA 139 HA ALA 139 8.054 -8.765 -2.771 1045 HB1 ALA 139 1HB ALA 139 6.532 -7.574 -1.589 1046 HB2 ALA 139 2HB ALA 139 5.472 -7.343 -2.980 1047 HB3 ALA 139 3HB ALA 139 6.909 -6.337 -2.789 1048 H GLN 140 H GLN 140 6.341 -8.584 -5.754 1049 HA GLN 140 HA GLN 140 4.236 -10.343 -5.335 1050 HB2 GLN 140 2HB GLN 140 5.592 -9.162 -7.590 1051 HB3 GLN 140 1HB GLN 140 5.173 -10.841 -7.939 1052 HG2 GLN 140 2HG GLN 140 2.874 -9.881 -6.802 1053 HG3 GLN 140 1HG GLN 140 3.469 -8.489 -7.709 1054 HE21 GLN 140 1HE2 GLN 140 3.441 -11.998 -8.254 1055 HE22 GLN 140 2HE2 GLN 140 2.721 -11.922 -9.822 1056 H GLU 141 H GLU 141 7.602 -10.975 -5.380 1057 HA GLU 141 HA GLU 141 7.299 -13.784 -6.039 1058 HB2 GLU 141 2HB GLU 141 9.242 -12.777 -6.949 1059 HB3 GLU 141 1HB GLU 141 9.671 -12.035 -5.405 1060 HG2 GLU 141 2HG GLU 141 10.458 -14.028 -4.523 1061 HG3 GLU 141 1HG GLU 141 9.571 -15.010 -5.690 1062 H ARG 142 H ARG 142 7.653 -11.782 -3.195 1063 HA ARG 142 HA ARG 142 7.844 -14.226 -1.562 1064 HB2 ARG 142 2HB ARG 142 8.626 -12.540 0.246 1065 HB3 ARG 142 1HB ARG 142 9.756 -13.034 -1.018 1066 HG2 ARG 142 2HG ARG 142 9.143 -10.952 -2.261 1067 HG3 ARG 142 1HG ARG 142 8.221 -10.448 -0.833 1068 HD2 ARG 142 2HD ARG 142 10.357 -9.415 -0.685 1069 HD3 ARG 142 1HD ARG 142 10.332 -10.733 0.499 1070 HE ARG 142 HE ARG 142 11.412 -11.643 -1.948 1071 HH11 ARG 142 1HH1 ARG 142 12.199 -9.625 0.788 1072 HH12 ARG 142 2HH1 ARG 142 13.904 -9.890 0.651 1073 HH21 ARG 142 1HH2 ARG 142 13.656 -11.992 -2.129 1074 HH22 ARG 142 2HH2 ARG 142 14.732 -11.233 -1.004 1075 H LEU 143 H LEU 143 6.459 -10.933 -1.458 1076 HA LEU 143 HA LEU 143 4.810 -11.243 0.724 1077 HB2 LEU 143 2HB LEU 143 4.822 -9.507 -1.660 1078 HB3 LEU 143 1HB LEU 143 3.269 -9.653 -0.843 1079 HG LEU 143 HG LEU 143 4.573 -7.702 -0.080 1080 HD11 LEU 143 1HD1 LEU 143 3.697 -9.886 1.711 1081 HD12 LEU 143 2HD1 LEU 143 3.130 -8.221 1.585 1082 HD13 LEU 143 3HD1 LEU 143 4.632 -8.579 2.439 1083 HD21 LEU 143 3HD2 LEU 143 6.672 -7.811 0.787 1084 HD22 LEU 143 1HD2 LEU 143 6.767 -9.186 -0.312 1085 HD23 LEU 143 2HD2 LEU 143 6.454 -9.448 1.403 1086 H THR 144 H THR 144 4.321 -12.396 -2.549 1087 HA THR 144 HA THR 144 1.577 -13.104 -2.187 1088 HB THR 144 HB THR 144 1.764 -14.130 -4.349 1089 HG1 THR 144 1HG THR 144 3.526 -15.101 -4.872 1090 HG21 THR 144 3HG2 THR 144 3.367 -11.613 -4.135 1091 HG22 THR 144 1HG2 THR 144 1.686 -11.807 -4.631 1092 HG23 THR 144 2HG2 THR 144 2.985 -12.371 -5.682 1093 H GLY 145 H GLY 145 0.838 -14.780 -1.066 1094 HA2 GLY 145 2HA GLY 145 0.653 -17.051 -0.504 1095 HA3 GLY 145 1HA GLY 145 2.276 -17.314 -1.121 1096 H ASP 146 H ASP 146 1.972 -14.636 0.981 1097 HA ASP 146 HA ASP 146 2.826 -14.212 3.048 1098 HB2 ASP 146 2HB ASP 146 1.378 -16.802 3.381 1099 HB3 ASP 146 1HB ASP 146 2.368 -16.218 4.715 1100 H ALA 147 H ALA 147 4.513 -15.653 1.027 1101 HA ALA 147 HA ALA 147 6.232 -17.402 2.509 1102 HB1 ALA 147 1HB ALA 147 6.433 -17.974 0.333 1103 HB2 ALA 147 2HB ALA 147 7.717 -16.766 0.362 1104 HB3 ALA 147 3HB ALA 147 6.116 -16.337 -0.240 1105 H PHE 148 H PHE 148 6.086 -13.992 1.875 1106 HA PHE 148 HA PHE 148 8.735 -13.252 2.335 1107 HB2 PHE 148 2HB PHE 148 7.915 -11.035 2.698 1108 HB3 PHE 148 1HB PHE 148 6.860 -11.782 1.489 1109 HD1 PHE 148 2HD PHE 148 4.628 -12.689 2.244 1110 HD2 PHE 148 1HD PHE 148 7.048 -10.183 4.688 1111 HE1 PHE 148 2HE PHE 148 2.668 -12.153 3.629 1112 HE2 PHE 148 1HE PHE 148 5.093 -9.643 6.078 1113 HZ PHE 148 HZ PHE 148 2.898 -10.628 5.550 1114 H ARG 149 H ARG 149 6.118 -13.927 4.591 1115 HA ARG 149 HA ARG 149 7.332 -12.978 6.926 1116 HB2 ARG 149 2HB ARG 149 5.294 -15.162 6.488 1117 HB3 ARG 149 1HB ARG 149 5.748 -14.550 8.070 1118 HG2 ARG 149 2HG ARG 149 5.068 -12.256 7.198 1119 HG3 ARG 149 1HG ARG 149 4.306 -13.126 5.865 1120 HD2 ARG 149 2HD ARG 149 2.554 -13.654 7.127 1121 HD3 ARG 149 1HD ARG 149 3.595 -14.322 8.383 1122 HE ARG 149 HE ARG 149 2.375 -11.714 8.338 1123 HH11 ARG 149 1HH1 ARG 149 4.948 -13.661 9.668 1124 HH12 ARG 149 2HH1 ARG 149 5.140 -12.670 11.075 1125 HH21 ARG 149 1HH2 ARG 149 2.626 -10.409 10.188 1126 HH22 ARG 149 2HH2 ARG 149 3.822 -10.825 11.370 1127 H LYS 150 H LYS 150 7.547 -14.831 8.779 1128 HA LYS 150 HA LYS 150 9.685 -16.611 7.811 1129 HB2 LYS 150 2HB LYS 150 10.643 -16.460 10.075 1130 HB3 LYS 150 1HB LYS 150 10.529 -14.884 9.302 1131 HG2 LYS 150 2HG LYS 150 8.129 -15.225 10.710 1132 HG3 LYS 150 1HG LYS 150 9.414 -15.776 11.787 1133 HD2 LYS 150 2HD LYS 150 9.925 -13.258 10.331 1134 HD3 LYS 150 1HD LYS 150 8.660 -13.205 11.561 1135 HE2 LYS 150 2HE LYS 150 11.121 -14.579 12.380 1136 HE3 LYS 150 1HE LYS 150 11.313 -12.859 12.045 1137 HZ1 LYS 150 3HZ LYS 150 10.648 -13.635 14.403 1138 HZ2 LYS 150 1HZ LYS 150 9.095 -13.774 13.746 1139 HZ3 LYS 150 2HZ LYS 150 9.886 -12.280 13.734 1140 H LYS 151 H LYS 151 8.605 -18.498 7.471 1141 HA LYS 151 HA LYS 151 7.368 -19.724 9.839 1142 HB2 LYS 151 2HB LYS 151 6.082 -19.065 7.361 1143 HB3 LYS 151 1HB LYS 151 6.112 -20.812 7.545 1144 HG2 LYS 151 2HG LYS 151 5.270 -19.204 9.887 1145 HG3 LYS 151 1HG LYS 151 4.160 -19.313 8.520 1146 HD2 LYS 151 2HD LYS 151 4.408 -21.803 8.631 1147 HD3 LYS 151 1HD LYS 151 5.323 -21.586 10.123 1148 HE2 LYS 151 2HE LYS 151 2.926 -20.081 10.342 1149 HE3 LYS 151 1HE LYS 151 2.504 -21.690 9.758 1150 HZ1 LYS 151 3HZ LYS 151 2.482 -21.925 12.043 1151 HZ2 LYS 151 1HZ LYS 151 3.832 -20.931 12.278 1152 HZ3 LYS 151 2HZ LYS 151 4.026 -22.487 11.645 1153 H HIS 152 H HIS 152 8.637 -21.352 10.407 1154 HA HIS 152 HA HIS 152 9.886 -23.247 10.333 1155 HB2 HIS 152 2HB HIS 152 8.581 -23.527 7.619 1156 HB3 HIS 152 1HB HIS 152 9.563 -24.775 8.378 1157 HD1 HIS 152 1HD HIS 152 8.493 -26.141 10.253 1158 HD2 HIS 152 2HD HIS 152 6.044 -23.117 8.800 1159 HE1 HIS 152 1HE HIS 152 6.219 -26.592 11.229 1160 HE2 HIS 152 2HE HIS 152 4.777 -24.694 10.412 1161 H LEU 153 H LEU 153 10.066 -22.484 6.868 1162 HA LEU 153 HA LEU 153 12.707 -21.365 7.106 1163 HB2 LEU 153 2HB LEU 153 12.283 -24.188 6.367 1164 HB3 LEU 153 1HB LEU 153 13.352 -23.292 5.304 1165 HG LEU 153 HG LEU 153 13.896 -23.002 8.193 1166 HD11 LEU 153 1HD1 LEU 153 14.525 -25.113 8.675 1167 HD12 LEU 153 2HD1 LEU 153 14.998 -25.469 7.014 1168 HD13 LEU 153 3HD1 LEU 153 13.297 -25.519 7.476 1169 HD21 LEU 153 3HD2 LEU 153 15.291 -21.959 6.483 1170 HD22 LEU 153 1HD2 LEU 153 15.625 -23.542 5.782 1171 HD23 LEU 153 2HD2 LEU 153 16.201 -23.158 7.404 1172 H GLU 154 H GLU 154 10.513 -22.965 4.798 1173 HA GLU 154 HA GLU 154 10.450 -20.535 3.199 1174 HB2 GLU 154 2HB GLU 154 12.344 -22.199 2.456 1175 HB3 GLU 154 1HB GLU 154 11.007 -23.088 1.738 1176 HG2 GLU 154 2HG GLU 154 10.875 -21.683 0.029 1177 HG3 GLU 154 1HG GLU 154 10.879 -20.275 1.091 1178 H ASP 155 H ASP 155 8.535 -21.951 4.833 1179 HA ASP 155 HA ASP 155 6.351 -22.580 4.794 1180 HB2 ASP 155 2HB ASP 155 6.181 -20.570 3.322 1181 HB3 ASP 155 1HB ASP 155 6.395 -21.622 1.925 1182 H GLU 156 H GLU 156 6.306 -24.745 5.004 1183 HA GLU 156 HA GLU 156 6.334 -26.336 2.527 1184 HB2 GLU 156 2HB GLU 156 7.246 -28.218 3.977 1185 HB3 GLU 156 1HB GLU 156 8.365 -26.903 3.597 1186 HG2 GLU 156 2HG GLU 156 8.667 -27.432 5.878 1187 HG3 GLU 156 1HG GLU 156 7.788 -25.905 5.823 1188 H LEU 157 H LEU 157 5.164 -28.421 2.731 1189 HA LEU 157 HA LEU 157 3.059 -28.409 4.767 1190 HB2 LEU 157 2HB LEU 157 2.712 -27.905 1.911 1191 HB3 LEU 157 1HB LEU 157 1.714 -29.223 2.494 1192 HG LEU 157 HG LEU 157 1.682 -26.747 4.117 1193 HD11 LEU 157 1HD1 LEU 157 0.219 -25.556 2.664 1194 HD12 LEU 157 2HD1 LEU 157 0.193 -26.885 1.505 1195 HD13 LEU 157 3HD1 LEU 157 1.671 -25.952 1.745 1196 HD21 LEU 157 3HD2 LEU 157 0.301 -29.052 4.181 1197 HD22 LEU 157 1HD2 LEU 157 -0.767 -28.084 3.165 1198 HD23 LEU 157 2HD2 LEU 157 -0.333 -27.518 4.778 Start of MODEL 17 1 H1 MET 1 1HT MET 1 -29.563 5.050 -7.095 2 H2 MET 1 2HT MET 1 -30.478 5.978 -5.980 3 H3 MET 1 3HT MET 1 -29.869 6.706 -7.409 4 HA MET 1 HA MET 1 -32.065 6.364 -7.859 5 HB2 MET 1 2HB MET 1 -30.156 5.269 -9.364 6 HB3 MET 1 1HB MET 1 -31.014 3.793 -8.944 7 HG2 MET 1 2HG MET 1 -32.135 4.307 -10.832 8 HG3 MET 1 1HG MET 1 -33.099 5.249 -9.696 9 HE1 MET 1 2HE MET 1 -32.988 8.447 -10.140 10 HE2 MET 1 3HE MET 1 -33.967 6.988 -10.282 11 HE3 MET 1 1HE MET 1 -33.627 7.963 -11.710 12 H HIS 2 H HIS 2 -33.968 5.018 -7.875 13 HA HIS 2 HA HIS 2 -35.503 3.645 -6.916 14 HB2 HIS 2 2HB HIS 2 -33.041 1.975 -6.383 15 HB3 HIS 2 1HB HIS 2 -34.680 1.433 -6.042 16 HD1 HIS 2 1HD HIS 2 -36.099 0.655 -8.010 17 HD2 HIS 2 2HD HIS 2 -32.400 2.174 -9.140 18 HE1 HIS 2 1HE HIS 2 -35.840 0.058 -10.439 19 HE2 HIS 2 2HE HIS 2 -33.552 0.902 -11.074 20 H HIS 3 H HIS 3 -32.862 2.926 -4.657 21 HA HIS 3 HA HIS 3 -34.132 4.574 -2.611 22 HB2 HIS 3 2HB HIS 3 -34.630 1.836 -2.738 23 HB3 HIS 3 1HB HIS 3 -33.380 1.987 -1.508 24 HD1 HIS 3 1HD HIS 3 -36.940 2.127 -1.918 25 HD2 HIS 3 2HD HIS 3 -34.177 4.017 0.542 26 HE1 HIS 3 1HE HIS 3 -38.272 3.037 0.012 27 HE2 HIS 3 2HE HIS 3 -36.591 4.251 1.443 28 H HIS 4 H HIS 4 -32.777 4.792 -0.660 29 HA HIS 4 HA HIS 4 -29.949 4.814 -1.415 30 HB2 HIS 4 2HB HIS 4 -29.697 6.358 0.528 31 HB3 HIS 4 1HB HIS 4 -30.807 6.953 -0.702 32 HD1 HIS 4 1HD HIS 4 -33.386 6.819 -0.105 33 HD2 HIS 4 2HD HIS 4 -30.782 6.034 3.035 34 HE1 HIS 4 1HE HIS 4 -34.778 6.994 1.981 35 HE2 HIS 4 2HE HIS 4 -33.200 6.427 3.863 36 H HIS 5 H HIS 5 -29.002 2.930 -0.909 37 HA HIS 5 HA HIS 5 -28.720 2.220 1.855 38 HB2 HIS 5 2HB HIS 5 -29.547 -0.115 1.578 39 HB3 HIS 5 1HB HIS 5 -30.820 1.094 1.465 40 HD1 HIS 5 1HD HIS 5 -29.628 -1.839 -0.183 41 HD2 HIS 5 2HD HIS 5 -31.376 1.719 -1.428 42 HE1 HIS 5 1HE HIS 5 -30.521 -2.300 -2.488 43 HE2 HIS 5 2HE HIS 5 -31.497 -0.108 -3.256 44 H HIS 6 H HIS 6 -27.081 0.622 2.207 45 HA HIS 6 HA HIS 6 -25.364 0.190 -0.149 46 HB2 HIS 6 2HB HIS 6 -24.767 1.191 2.562 47 HB3 HIS 6 1HB HIS 6 -23.628 0.004 1.937 48 HD1 HIS 6 1HD HIS 6 -24.301 3.533 1.925 49 HD2 HIS 6 2HD HIS 6 -22.604 0.834 -0.740 50 HE1 HIS 6 1HE HIS 6 -22.984 4.930 0.302 51 HE2 HIS 6 2HE HIS 6 -22.034 3.281 -1.351 52 H HIS 7 H HIS 7 -25.599 -1.872 -0.740 53 HA HIS 7 HA HIS 7 -24.970 -3.949 1.188 54 HB2 HIS 7 2HB HIS 7 -27.614 -3.402 0.808 55 HB3 HIS 7 1HB HIS 7 -27.343 -4.629 -0.426 56 HD1 HIS 7 1HD HIS 7 -26.184 -6.915 0.558 57 HD2 HIS 7 2HD HIS 7 -28.084 -4.414 3.277 58 HE1 HIS 7 1HE HIS 7 -26.606 -8.332 2.591 59 HE2 HIS 7 2HE HIS 7 -27.827 -6.819 4.193 60 H MET 8 H MET 8 -23.705 -2.818 -1.172 61 HA MET 8 HA MET 8 -23.294 -5.309 -2.622 62 HB2 MET 8 2HB MET 8 -24.972 -3.427 -3.706 63 HB3 MET 8 1HB MET 8 -23.417 -2.993 -4.428 64 HG2 MET 8 2HG MET 8 -23.184 -5.364 -5.158 65 HG3 MET 8 1HG MET 8 -24.824 -5.650 -4.582 66 HE1 MET 8 3HE MET 8 -26.639 -4.158 -5.056 67 HE2 MET 8 1HE MET 8 -27.167 -4.548 -6.693 68 HE3 MET 8 2HE MET 8 -26.687 -2.899 -6.290 69 H SER 9 H SER 9 -21.440 -4.969 -4.276 70 HA SER 9 HA SER 9 -19.148 -4.202 -2.865 71 HB2 SER 9 2HB SER 9 -18.039 -4.340 -5.172 72 HB3 SER 9 1HB SER 9 -18.857 -5.792 -4.595 73 HG SER 9 HG SER 9 -19.931 -3.870 -6.390 74 H ASP 10 H ASP 10 -17.597 -2.522 -3.393 75 HA ASP 10 HA ASP 10 -18.953 -0.009 -4.045 76 HB2 ASP 10 2HB ASP 10 -16.555 -0.735 -2.424 77 HB3 ASP 10 1HB ASP 10 -16.614 0.867 -3.155 78 H GLY 11 H GLY 11 -18.166 -1.892 -6.115 79 HA2 GLY 11 2HA GLY 11 -15.890 -0.576 -7.402 80 HA3 GLY 11 1HA GLY 11 -16.662 -2.063 -7.932 81 H HIS 12 H HIS 12 -17.138 1.437 -7.688 82 HA HIS 12 HA HIS 12 -18.791 1.281 -10.121 83 HB2 HIS 12 2HB HIS 12 -19.881 1.921 -7.783 84 HB3 HIS 12 1HB HIS 12 -19.222 3.514 -8.187 85 HD1 HIS 12 1HD HIS 12 -20.900 0.999 -10.495 86 HD2 HIS 12 2HD HIS 12 -21.416 4.859 -9.047 87 HE1 HIS 12 1HE HIS 12 -22.884 1.921 -11.734 88 HE2 HIS 12 2HE HIS 12 -23.121 4.290 -10.907 89 H ASN 13 H ASN 13 -16.615 3.284 -8.172 90 HA ASN 13 HA ASN 13 -15.115 4.162 -10.376 91 HB2 ASN 13 2HB ASN 13 -17.309 5.428 -10.726 92 HB3 ASN 13 1HB ASN 13 -16.879 6.354 -9.291 93 HD21 ASN 13 1HD2 ASN 13 -16.381 8.296 -10.059 94 HD22 ASN 13 2HD2 ASN 13 -15.206 8.614 -11.285 95 H GLY 14 H GLY 14 -16.271 4.915 -7.126 96 HA2 GLY 14 2HA GLY 14 -13.900 6.380 -6.406 97 HA3 GLY 14 1HA GLY 14 -15.193 5.868 -5.315 98 H LEU 15 H LEU 15 -12.680 4.309 -7.329 99 HA LEU 15 HA LEU 15 -12.255 2.383 -5.167 100 HB2 LEU 15 2HB LEU 15 -12.067 2.296 -8.058 101 HB3 LEU 15 1HB LEU 15 -10.599 1.697 -7.305 102 HG LEU 15 HG LEU 15 -12.162 -0.121 -7.763 103 HD11 LEU 15 1HD1 LEU 15 -11.532 -1.202 -5.913 104 HD12 LEU 15 2HD1 LEU 15 -12.407 -0.093 -4.858 105 HD13 LEU 15 3HD1 LEU 15 -10.793 0.323 -5.428 106 HD21 LEU 15 3HD2 LEU 15 -14.245 -0.193 -6.282 107 HD22 LEU 15 1HD2 LEU 15 -14.287 0.864 -7.694 108 HD23 LEU 15 2HD2 LEU 15 -14.015 1.544 -6.089 109 H GLY 16 H GLY 16 -9.901 3.614 -7.529 110 HA2 GLY 16 2HA GLY 16 -7.883 3.765 -5.496 111 HA3 GLY 16 1HA GLY 16 -7.692 4.245 -7.175 112 H LYS 17 H LYS 17 -8.682 6.288 -7.820 113 HA LYS 17 HA LYS 17 -9.585 8.251 -6.064 114 HB2 LYS 17 2HB LYS 17 -7.365 8.126 -5.043 115 HB3 LYS 17 1HB LYS 17 -6.612 8.392 -6.608 116 HG2 LYS 17 2HG LYS 17 -6.518 10.453 -5.491 117 HG3 LYS 17 1HG LYS 17 -7.822 10.610 -6.670 118 HD2 LYS 17 2HD LYS 17 -8.948 9.587 -4.277 119 HD3 LYS 17 1HD LYS 17 -7.918 10.951 -3.840 120 HE2 LYS 17 2HE LYS 17 -9.652 12.243 -4.395 121 HE3 LYS 17 1HE LYS 17 -9.246 11.868 -6.068 122 HZ1 LYS 17 3HZ LYS 17 -11.464 10.947 -4.453 123 HZ2 LYS 17 1HZ LYS 17 -10.730 9.749 -5.397 124 HZ3 LYS 17 2HZ LYS 17 -11.351 11.141 -6.131 125 H GLY 18 H GLY 18 -7.709 7.495 -8.932 126 HA2 GLY 18 2HA GLY 18 -9.288 8.466 -10.866 127 HA3 GLY 18 1HA GLY 18 -8.501 9.939 -10.286 128 H PHE 19 H PHE 19 -7.246 6.634 -10.724 129 HA PHE 19 HA PHE 19 -5.456 7.638 -12.816 130 HB2 PHE 19 2HB PHE 19 -4.361 5.859 -10.653 131 HB3 PHE 19 1HB PHE 19 -3.488 6.888 -11.796 132 HD1 PHE 19 1HD PHE 19 -4.440 9.483 -11.543 133 HD2 PHE 19 2HD PHE 19 -4.130 6.537 -8.493 134 HE1 PHE 19 1HE PHE 19 -4.315 11.262 -9.844 135 HE2 PHE 19 2HE PHE 19 -4.003 8.304 -6.787 136 HZ PHE 19 HZ PHE 19 -4.096 10.670 -7.460 137 H GLY 20 H GLY 20 -5.799 4.605 -10.960 138 HA2 GLY 20 2HA GLY 20 -5.669 3.110 -13.455 139 HA3 GLY 20 1HA GLY 20 -5.624 2.435 -11.826 140 H ASP 21 H ASP 21 -7.440 1.577 -10.984 141 HA ASP 21 HA ASP 21 -10.069 2.387 -11.619 142 HB2 ASP 21 2HB ASP 21 -8.879 0.243 -13.286 143 HB3 ASP 21 1HB ASP 21 -10.504 -0.070 -12.659 144 H HIS 22 H HIS 22 -8.853 -0.926 -11.220 145 HA HIS 22 HA HIS 22 -9.689 -0.915 -8.412 146 HB2 HIS 22 2HB HIS 22 -10.882 -3.052 -8.682 147 HB3 HIS 22 1HB HIS 22 -11.620 -1.783 -9.653 148 HD1 HIS 22 1HD HIS 22 -11.135 -5.155 -9.944 149 HD2 HIS 22 2HD HIS 22 -10.048 -1.995 -12.415 150 HE1 HIS 22 1HE HIS 22 -10.805 -6.167 -12.223 151 HE2 HIS 22 2HE HIS 22 -10.113 -4.243 -13.695 152 H ILE 23 H ILE 23 -7.605 -1.114 -7.694 153 HA ILE 23 HA ILE 23 -6.342 -3.690 -7.906 154 HB ILE 23 HB ILE 23 -5.087 -1.230 -9.110 155 HG12 ILE 23 2HG1 ILE 23 -4.612 -3.303 -10.822 156 HG13 ILE 23 1HG1 ILE 23 -6.199 -3.720 -10.189 157 HG21 ILE 23 1HG2 ILE 23 -3.361 -2.064 -7.839 158 HG22 ILE 23 2HG2 ILE 23 -3.089 -2.775 -9.426 159 HG23 ILE 23 3HG2 ILE 23 -3.809 -3.739 -8.135 160 HD11 ILE 23 3HD1 ILE 23 -7.194 -2.091 -11.345 161 HD12 ILE 23 1HD1 ILE 23 -5.690 -2.003 -12.263 162 HD13 ILE 23 2HD1 ILE 23 -5.959 -0.909 -10.903 163 H HIS 24 H HIS 24 -4.758 -0.586 -7.413 164 HA HIS 24 HA HIS 24 -3.826 -1.369 -4.818 165 HB2 HIS 24 2HB HIS 24 -3.300 0.919 -6.676 166 HB3 HIS 24 1HB HIS 24 -2.816 1.047 -4.979 167 HD1 HIS 24 1HD HIS 24 -0.813 -0.363 -4.216 168 HD2 HIS 24 2HD HIS 24 -1.818 -0.918 -8.209 169 HE1 HIS 24 1HE HIS 24 1.122 -1.606 -5.232 170 HE2 HIS 24 2HE HIS 24 0.523 -1.868 -7.664 171 H TRP 25 H TRP 25 -6.579 -1.130 -4.841 172 HA TRP 25 HA TRP 25 -6.993 0.687 -2.695 173 HB2 TRP 25 2HB TRP 25 -8.900 1.778 -4.302 174 HB3 TRP 25 1HB TRP 25 -7.302 2.482 -4.030 175 HD1 TRP 25 HD TRP 25 -9.180 0.308 -6.568 176 HE1 TRP 25 1HE TRP 25 -7.995 0.481 -8.826 177 HE3 TRP 25 3HE TRP 25 -5.131 3.150 -5.252 178 HZ2 TRP 25 2HZ TRP 25 -5.734 1.665 -9.952 179 HZ3 TRP 25 3HZ TRP 25 -3.518 3.756 -6.992 180 HH2 TRP 25 HH TRP 25 -3.808 3.034 -9.290 181 H ARG 26 H ARG 26 -7.526 -2.123 -3.904 182 HA ARG 26 HA ARG 26 -10.226 -2.614 -4.158 183 HB2 ARG 26 2HB ARG 26 -7.895 -4.169 -3.824 184 HB3 ARG 26 1HB ARG 26 -9.038 -4.722 -2.595 185 HG2 ARG 26 2HG ARG 26 -10.739 -4.896 -4.469 186 HG3 ARG 26 1HG ARG 26 -9.382 -4.689 -5.579 187 HD2 ARG 26 2HD ARG 26 -8.313 -6.617 -4.184 188 HD3 ARG 26 1HD ARG 26 -9.989 -6.946 -3.716 189 HE ARG 26 HE ARG 26 -8.770 -7.437 -6.272 190 HH11 ARG 26 1HH1 ARG 26 -11.782 -6.834 -4.615 191 HH12 ARG 26 2HH1 ARG 26 -12.747 -7.607 -5.826 192 HH21 ARG 26 1HH2 ARG 26 -10.040 -8.453 -7.868 193 HH22 ARG 26 2HH2 ARG 26 -11.760 -8.526 -7.673 194 H THR 27 H THR 27 -8.397 -1.803 -1.331 195 HA THR 27 HA THR 27 -9.224 -0.945 0.648 196 HB THR 27 HB THR 27 -11.845 -2.362 0.284 197 HG1 THR 27 1HG THR 27 -12.247 -1.176 -1.378 198 HG21 THR 27 3HG2 THR 27 -12.201 -1.315 2.211 199 HG22 THR 27 1HG2 THR 27 -12.347 0.141 1.227 200 HG23 THR 27 2HG2 THR 27 -10.812 -0.249 2.000 201 H LEU 28 H LEU 28 -9.528 -1.786 2.790 202 HA LEU 28 HA LEU 28 -8.322 -4.342 3.122 203 HB2 LEU 28 2HB LEU 28 -9.421 -2.261 4.979 204 HB3 LEU 28 1HB LEU 28 -8.982 -3.854 5.600 205 HG LEU 28 HG LEU 28 -6.846 -2.768 3.979 206 HD11 LEU 28 1HD1 LEU 28 -6.242 -1.003 5.718 207 HD12 LEU 28 2HD1 LEU 28 -7.947 -1.038 6.167 208 HD13 LEU 28 3HD1 LEU 28 -7.476 -0.585 4.530 209 HD21 LEU 28 3HD2 LEU 28 -7.052 -4.530 5.980 210 HD22 LEU 28 1HD2 LEU 28 -6.578 -3.105 6.903 211 HD23 LEU 28 2HD2 LEU 28 -5.552 -3.688 5.592 212 H GLU 29 H GLU 29 -11.599 -3.206 3.043 213 HA GLU 29 HA GLU 29 -12.880 -5.213 4.498 214 HB2 GLU 29 2HB GLU 29 -13.695 -3.017 3.087 215 HB3 GLU 29 1HB GLU 29 -14.290 -4.324 2.071 216 HG2 GLU 29 2HG GLU 29 -14.897 -4.893 4.806 217 HG3 GLU 29 1HG GLU 29 -15.448 -3.267 4.403 218 H ASP 30 H ASP 30 -12.548 -5.033 0.950 219 HA ASP 30 HA ASP 30 -13.103 -7.872 0.729 220 HB2 ASP 30 2HB ASP 30 -13.457 -5.627 -0.944 221 HB3 ASP 30 1HB ASP 30 -12.277 -6.666 -1.760 222 H GLY 31 H GLY 31 -10.377 -5.723 0.674 223 HA2 GLY 31 2HA GLY 31 -8.557 -7.476 -0.652 224 HA3 GLY 31 1HA GLY 31 -8.129 -6.068 0.326 225 H LYS 32 H LYS 32 -9.190 -6.784 2.778 226 HA LYS 32 HA LYS 32 -7.196 -8.610 3.705 227 HB2 LYS 32 2HB LYS 32 -8.083 -6.605 4.975 228 HB3 LYS 32 1HB LYS 32 -9.537 -7.545 5.283 229 HG2 LYS 32 2HG LYS 32 -8.140 -9.261 6.391 230 HG3 LYS 32 1HG LYS 32 -6.739 -8.211 6.170 231 HD2 LYS 32 2HD LYS 32 -7.330 -7.557 8.268 232 HD3 LYS 32 1HD LYS 32 -8.365 -6.462 7.349 233 HE2 LYS 32 2HE LYS 32 -9.689 -8.982 7.715 234 HE3 LYS 32 1HE LYS 32 -9.136 -8.366 9.271 235 HZ1 LYS 32 3HZ LYS 32 -10.191 -6.182 8.500 236 HZ2 LYS 32 1HZ LYS 32 -11.221 -7.424 9.011 237 HZ3 LYS 32 2HZ LYS 32 -11.009 -7.126 7.360 238 H LYS 33 H LYS 33 -10.732 -8.719 3.427 239 HA LYS 33 HA LYS 33 -11.167 -11.208 4.598 240 HB2 LYS 33 2HB LYS 33 -12.930 -9.564 3.923 241 HB3 LYS 33 1HB LYS 33 -12.683 -10.054 2.252 242 HG2 LYS 33 2HG LYS 33 -13.100 -12.452 3.507 243 HG3 LYS 33 1HG LYS 33 -14.177 -11.357 4.391 244 HD2 LYS 33 2HD LYS 33 -15.519 -11.021 2.594 245 HD3 LYS 33 1HD LYS 33 -14.185 -11.120 1.443 246 HE2 LYS 33 2HE LYS 33 -14.130 -13.558 1.740 247 HE3 LYS 33 1HE LYS 33 -15.488 -13.443 2.859 248 HZ1 LYS 33 3HZ LYS 33 -15.579 -12.565 0.023 249 HZ2 LYS 33 1HZ LYS 33 -16.879 -12.638 1.103 250 HZ3 LYS 33 2HZ LYS 33 -16.137 -14.063 0.575 251 H GLU 34 H GLU 34 -10.098 -10.365 1.367 252 HA GLU 34 HA GLU 34 -10.173 -13.150 0.512 253 HB2 GLU 34 2HB GLU 34 -10.905 -11.446 -1.081 254 HB3 GLU 34 1HB GLU 34 -9.335 -10.649 -0.967 255 HG2 GLU 34 2HG GLU 34 -8.320 -12.144 -2.309 256 HG3 GLU 34 1HG GLU 34 -9.291 -13.500 -1.715 257 H ALA 35 H ALA 35 -7.912 -10.698 1.528 258 HA ALA 35 HA ALA 35 -5.528 -11.824 0.603 259 HB1 ALA 35 1HB ALA 35 -6.111 -10.101 2.997 260 HB2 ALA 35 2HB ALA 35 -5.458 -9.610 1.435 261 HB3 ALA 35 3HB ALA 35 -4.478 -10.579 2.534 262 H ALA 36 H ALA 36 -7.579 -12.669 3.275 263 HA ALA 36 HA ALA 36 -5.677 -14.238 4.702 264 HB1 ALA 36 1HB ALA 36 -7.433 -13.545 6.030 265 HB2 ALA 36 2HB ALA 36 -7.872 -15.219 5.692 266 HB3 ALA 36 3HB ALA 36 -8.644 -13.909 4.800 267 H ALA 37 H ALA 37 -8.144 -14.954 2.271 268 HA ALA 37 HA ALA 37 -8.129 -17.720 2.349 269 HB1 ALA 37 1HB ALA 37 -9.669 -16.332 0.992 270 HB2 ALA 37 2HB ALA 37 -8.966 -17.675 0.092 271 HB3 ALA 37 3HB ALA 37 -8.353 -16.038 -0.145 272 H SER 38 H SER 38 -6.372 -15.862 -0.138 273 HA SER 38 HA SER 38 -4.603 -18.065 -0.643 274 HB2 SER 38 2HB SER 38 -4.431 -15.210 -1.647 275 HB3 SER 38 1HB SER 38 -3.578 -16.614 -2.311 276 HG SER 38 HG SER 38 -6.366 -16.099 -2.322 277 H GLY 39 H GLY 39 -4.556 -15.222 1.340 278 HA2 GLY 39 2HA GLY 39 -3.099 -14.830 3.125 279 HA3 GLY 39 1HA GLY 39 -2.020 -16.074 2.486 280 H LEU 40 H LEU 40 -3.210 -13.587 0.372 281 HA LEU 40 HA LEU 40 -0.525 -12.708 -0.137 282 HB2 LEU 40 2HB LEU 40 -1.542 -11.229 -1.807 283 HB3 LEU 40 1HB LEU 40 -2.074 -12.889 -1.984 284 HG LEU 40 HG LEU 40 -4.116 -12.074 -0.556 285 HD11 LEU 40 1HD1 LEU 40 -4.251 -9.908 -0.127 286 HD12 LEU 40 2HD1 LEU 40 -4.163 -9.552 -1.854 287 HD13 LEU 40 3HD1 LEU 40 -2.684 -9.661 -0.901 288 HD21 LEU 40 3HD2 LEU 40 -4.450 -10.946 -3.206 289 HD22 LEU 40 1HD2 LEU 40 -5.234 -12.340 -2.463 290 HD23 LEU 40 2HD2 LEU 40 -3.662 -12.526 -3.240 291 HA PRO 41 HA PRO 41 -0.377 -9.487 2.892 292 HB2 PRO 41 2HB PRO 41 1.526 -7.912 1.708 293 HB3 PRO 41 1HB PRO 41 1.888 -9.388 2.609 294 HG2 PRO 41 2HG PRO 41 1.646 -8.987 -0.346 295 HG3 PRO 41 1HG PRO 41 2.845 -9.924 0.565 296 HD2 PRO 41 2HD PRO 41 0.784 -11.110 -0.676 297 HD3 PRO 41 1HD PRO 41 1.404 -11.706 0.878 298 H LEU 42 H LEU 42 -0.366 -7.023 2.988 299 HA LEU 42 HA LEU 42 -2.175 -5.982 0.914 300 HB2 LEU 42 2HB LEU 42 -2.245 -5.848 3.863 301 HB3 LEU 42 1HB LEU 42 -2.668 -4.370 3.022 302 HG LEU 42 HG LEU 42 -4.390 -5.658 1.748 303 HD11 LEU 42 1HD1 LEU 42 -4.487 -7.822 3.694 304 HD12 LEU 42 2HD1 LEU 42 -3.043 -7.861 2.680 305 HD13 LEU 42 3HD1 LEU 42 -4.643 -7.864 1.938 306 HD21 LEU 42 3HD2 LEU 42 -5.450 -4.501 3.381 307 HD22 LEU 42 1HD2 LEU 42 -4.423 -5.151 4.661 308 HD23 LEU 42 2HD2 LEU 42 -5.744 -6.123 4.009 309 H MET 43 H MET 43 -1.930 -3.862 0.252 310 HA MET 43 HA MET 43 0.554 -2.510 1.077 311 HB2 MET 43 2HB MET 43 0.912 -3.538 -1.105 312 HB3 MET 43 1HB MET 43 -0.561 -2.785 -1.723 313 HG2 MET 43 2HG MET 43 0.468 -0.847 -2.140 314 HG3 MET 43 1HG MET 43 1.356 -0.881 -0.620 315 HE1 MET 43 3HE MET 43 1.842 -4.128 -2.764 316 HE2 MET 43 1HE MET 43 2.738 -3.492 -4.142 317 HE3 MET 43 2HE MET 43 1.075 -2.983 -3.862 318 H VAL 44 H VAL 44 0.506 -0.143 0.670 319 HA VAL 44 HA VAL 44 -2.209 0.953 0.539 320 HB VAL 44 HB VAL 44 -0.150 1.720 2.613 321 HG11 VAL 44 1HG1 VAL 44 -1.265 3.709 2.169 322 HG12 VAL 44 2HG1 VAL 44 -2.196 3.028 3.502 323 HG13 VAL 44 3HG1 VAL 44 -2.796 2.896 1.850 324 HG21 VAL 44 3HG2 VAL 44 -1.362 0.579 4.186 325 HG22 VAL 44 1HG2 VAL 44 -1.586 -0.463 2.784 326 HG23 VAL 44 2HG2 VAL 44 -2.861 0.663 3.253 327 H ILE 45 H ILE 45 -2.390 2.613 -0.790 328 HA ILE 45 HA ILE 45 0.006 4.171 -1.472 329 HB ILE 45 HB ILE 45 -2.220 3.344 -3.345 330 HG12 ILE 45 2HG1 ILE 45 0.676 2.536 -3.081 331 HG13 ILE 45 1HG1 ILE 45 -0.755 1.497 -3.061 332 HG21 ILE 45 1HG2 ILE 45 -1.544 4.859 -4.860 333 HG22 ILE 45 2HG2 ILE 45 0.159 4.633 -4.470 334 HG23 ILE 45 3HG2 ILE 45 -0.839 5.693 -3.475 335 HD11 ILE 45 3HD1 ILE 45 -1.115 1.921 -5.422 336 HD12 ILE 45 1HD1 ILE 45 0.512 1.302 -5.143 337 HD13 ILE 45 2HD1 ILE 45 0.263 3.019 -5.453 338 H ILE 46 H ILE 46 -0.355 5.955 -0.263 339 HA ILE 46 HA ILE 46 -2.980 7.267 -0.512 340 HB ILE 46 HB ILE 46 -0.936 7.971 1.572 341 HG12 ILE 46 2HG1 ILE 46 -3.103 6.198 2.451 342 HG13 ILE 46 1HG1 ILE 46 -1.942 5.420 1.383 343 HG21 ILE 46 1HG2 ILE 46 -2.887 9.455 1.133 344 HG22 ILE 46 2HG2 ILE 46 -2.810 8.832 2.781 345 HG23 ILE 46 3HG2 ILE 46 -3.941 8.129 1.625 346 HD11 ILE 46 3HD1 ILE 46 -1.616 5.455 3.986 347 HD12 ILE 46 1HD1 ILE 46 -0.917 7.039 3.646 348 HD13 ILE 46 2HD1 ILE 46 -0.241 5.595 2.888 349 H HIS 47 H HIS 47 -3.090 9.450 -1.054 350 HA HIS 47 HA HIS 47 -0.557 10.758 -1.772 351 HB2 HIS 47 2HB HIS 47 -2.881 11.045 -3.635 352 HB3 HIS 47 1HB HIS 47 -1.154 11.233 -3.957 353 HD1 HIS 47 1HD HIS 47 0.005 9.281 -4.989 354 HD2 HIS 47 2HD HIS 47 -3.691 8.264 -3.399 355 HE1 HIS 47 1HE HIS 47 -0.413 6.915 -5.728 356 HE2 HIS 47 2HE HIS 47 -2.734 6.389 -4.899 357 H LYS 48 H LYS 48 -0.581 12.402 -0.340 358 HA LYS 48 HA LYS 48 -3.032 14.067 -0.293 359 HB2 LYS 48 2HB LYS 48 -1.407 13.018 1.861 360 HB3 LYS 48 1HB LYS 48 -1.558 14.763 1.965 361 HG2 LYS 48 2HG LYS 48 -4.036 13.234 1.447 362 HG3 LYS 48 1HG LYS 48 -3.317 13.084 3.052 363 HD2 LYS 48 2HD LYS 48 -4.688 14.900 3.367 364 HD3 LYS 48 1HD LYS 48 -3.189 15.701 2.896 365 HE2 LYS 48 2HE LYS 48 -4.292 15.326 0.473 366 HE3 LYS 48 1HE LYS 48 -5.753 15.459 1.447 367 HZ1 LYS 48 3HZ LYS 48 -5.339 17.620 1.945 368 HZ2 LYS 48 1HZ LYS 48 -4.563 17.563 0.443 369 HZ3 LYS 48 2HZ LYS 48 -3.658 17.453 1.868 370 H SER 49 H SER 49 -2.709 16.378 0.088 371 HA SER 49 HA SER 49 -1.839 18.399 -0.469 372 HB2 SER 49 2HB SER 49 0.401 16.866 0.602 373 HB3 SER 49 1HB SER 49 0.918 18.118 -0.527 374 HG SER 49 HG SER 49 -0.210 19.634 0.723 375 H TRP 50 H TRP 50 0.206 19.293 -1.962 376 HA TRP 50 HA TRP 50 -0.597 18.659 -4.603 377 HB2 TRP 50 2HB TRP 50 1.447 20.077 -5.220 378 HB3 TRP 50 1HB TRP 50 0.185 20.864 -4.263 379 HD1 TRP 50 HD TRP 50 3.767 19.518 -3.966 380 HE1 TRP 50 1HE TRP 50 4.851 20.540 -1.867 381 HE3 TRP 50 3HE TRP 50 -0.325 21.868 -1.996 382 HZ2 TRP 50 2HZ TRP 50 4.077 22.130 0.330 383 HZ3 TRP 50 3HZ TRP 50 -0.067 23.118 0.108 384 HH2 TRP 50 HH TRP 50 2.089 23.245 1.246 385 H CYS 51 H CYS 51 -0.244 16.296 -4.250 386 HA CYS 51 HA CYS 51 2.481 15.353 -4.354 387 HB2 CYS 51 2HB CYS 51 1.384 13.728 -3.243 388 HB3 CYS 51 1HB CYS 51 -0.177 14.229 -3.870 389 H GLY 52 H GLY 52 3.587 14.674 -6.135 390 HA2 GLY 52 2HA GLY 52 2.263 15.040 -8.740 391 HA3 GLY 52 1HA GLY 52 4.006 15.002 -8.473 392 H ALA 53 H ALA 53 3.772 12.640 -6.713 393 HA ALA 53 HA ALA 53 4.226 10.618 -8.589 394 HB1 ALA 53 1HB ALA 53 5.062 10.487 -6.304 395 HB2 ALA 53 2HB ALA 53 4.097 9.063 -6.697 396 HB3 ALA 53 3HB ALA 53 3.412 10.345 -5.697 397 H CYS 54 H CYS 54 1.334 12.012 -7.569 398 HA CYS 54 HA CYS 54 -0.223 9.699 -8.429 399 HB2 CYS 54 2HB CYS 54 -2.166 11.127 -7.488 400 HB3 CYS 54 1HB CYS 54 -1.049 10.386 -6.338 401 H LYS 55 H LYS 55 0.487 13.057 -9.068 402 HA LYS 55 HA LYS 55 -1.486 13.626 -10.959 403 HB2 LYS 55 2HB LYS 55 0.377 15.134 -9.884 404 HB3 LYS 55 1HB LYS 55 1.306 14.661 -11.300 405 HG2 LYS 55 2HG LYS 55 -0.735 15.441 -12.650 406 HG3 LYS 55 1HG LYS 55 -1.222 16.259 -11.154 407 HD2 LYS 55 2HD LYS 55 1.576 16.711 -11.841 408 HD3 LYS 55 1HD LYS 55 0.465 17.270 -13.094 409 HE2 LYS 55 2HE LYS 55 0.318 19.129 -11.850 410 HE3 LYS 55 1HE LYS 55 -0.758 18.171 -10.833 411 HZ1 LYS 55 3HZ LYS 55 0.697 18.823 -9.257 412 HZ2 LYS 55 1HZ LYS 55 1.977 19.037 -10.344 413 HZ3 LYS 55 2HZ LYS 55 1.576 17.486 -9.803 414 H ALA 56 H ALA 56 1.734 12.175 -11.322 415 HA ALA 56 HA ALA 56 1.447 11.810 -14.160 416 HB1 ALA 56 1HB ALA 56 3.642 11.495 -14.038 417 HB2 ALA 56 2HB ALA 56 3.417 10.064 -13.032 418 HB3 ALA 56 3HB ALA 56 3.541 11.657 -12.285 419 H LEU 57 H LEU 57 0.592 10.009 -11.330 420 HA LEU 57 HA LEU 57 0.496 7.411 -12.348 421 HB2 LEU 57 2HB LEU 57 -0.826 8.863 -10.125 422 HB3 LEU 57 1HB LEU 57 -1.533 7.338 -10.608 423 HG LEU 57 HG LEU 57 0.464 7.667 -8.759 424 HD11 LEU 57 1HD1 LEU 57 -0.827 5.472 -10.171 425 HD12 LEU 57 2HD1 LEU 57 -0.477 5.673 -8.456 426 HD13 LEU 57 3HD1 LEU 57 0.770 5.066 -9.543 427 HD21 LEU 57 3HD2 LEU 57 2.532 7.068 -9.567 428 HD22 LEU 57 1HD2 LEU 57 1.942 8.096 -10.872 429 HD23 LEU 57 2HD2 LEU 57 1.874 6.340 -11.030 430 H LYS 58 H LYS 58 -1.676 10.101 -12.784 431 HA LYS 58 HA LYS 58 -4.004 8.827 -13.517 432 HB2 LYS 58 2HB LYS 58 -2.773 11.433 -14.117 433 HB3 LYS 58 1HB LYS 58 -4.003 10.911 -15.261 434 HG2 LYS 58 2HG LYS 58 -5.565 10.602 -13.371 435 HG3 LYS 58 1HG LYS 58 -4.331 11.251 -12.289 436 HD2 LYS 58 2HD LYS 58 -5.596 12.690 -14.620 437 HD3 LYS 58 1HD LYS 58 -5.933 12.978 -12.914 438 HE2 LYS 58 2HE LYS 58 -3.377 13.401 -12.746 439 HE3 LYS 58 1HE LYS 58 -3.474 13.617 -14.492 440 HZ1 LYS 58 3HZ LYS 58 -5.271 15.085 -12.662 441 HZ2 LYS 58 1HZ LYS 58 -4.861 15.454 -14.263 442 HZ3 LYS 58 2HZ LYS 58 -3.725 15.667 -13.027 443 HA PRO 59 HA PRO 59 -2.871 8.375 -18.115 444 HB2 PRO 59 2HB PRO 59 -0.727 9.553 -19.185 445 HB3 PRO 59 1HB PRO 59 -2.205 10.469 -18.828 446 HG2 PRO 59 2HG PRO 59 0.326 10.261 -17.226 447 HG3 PRO 59 1HG PRO 59 -0.612 11.705 -17.645 448 HD2 PRO 59 2HD PRO 59 -0.819 10.434 -15.235 449 HD3 PRO 59 1HD PRO 59 -2.157 11.340 -15.990 450 H LYS 60 H LYS 60 -0.303 7.983 -15.838 451 HA LYS 60 HA LYS 60 1.063 6.060 -17.562 452 HB2 LYS 60 2HB LYS 60 2.892 6.182 -16.131 453 HB3 LYS 60 1HB LYS 60 2.243 7.817 -16.071 454 HG2 LYS 60 2HG LYS 60 1.003 7.138 -14.018 455 HG3 LYS 60 1HG LYS 60 1.914 5.637 -14.026 456 HD2 LYS 60 2HD LYS 60 2.672 8.220 -13.018 457 HD3 LYS 60 1HD LYS 60 3.500 6.676 -12.861 458 HE2 LYS 60 2HE LYS 60 5.070 8.049 -13.910 459 HE3 LYS 60 1HE LYS 60 4.373 7.132 -15.241 460 HZ1 LYS 60 3HZ LYS 60 3.827 9.036 -16.197 461 HZ2 LYS 60 1HZ LYS 60 4.475 9.910 -14.903 462 HZ3 LYS 60 2HZ LYS 60 2.847 9.448 -14.883 463 H PHE 61 H PHE 61 -0.495 6.193 -14.354 464 HA PHE 61 HA PHE 61 -0.237 3.443 -13.856 465 HB2 PHE 61 2HB PHE 61 -0.839 5.246 -12.157 466 HB3 PHE 61 1HB PHE 61 -2.484 5.146 -12.801 467 HD1 PHE 61 2HD PHE 61 -3.692 2.944 -12.692 468 HD2 PHE 61 1HD PHE 61 -0.036 3.645 -10.637 469 HE1 PHE 61 2HE PHE 61 -4.132 0.997 -11.254 470 HE2 PHE 61 1HE PHE 61 -0.465 1.700 -9.196 471 HZ PHE 61 HZ PHE 61 -2.513 0.374 -9.504 472 H ALA 62 H ALA 62 -2.292 5.306 -15.905 473 HA ALA 62 HA ALA 62 -4.442 3.530 -16.205 474 HB1 ALA 62 1HB ALA 62 -3.419 4.880 -18.636 475 HB2 ALA 62 2HB ALA 62 -3.854 5.921 -17.280 476 HB3 ALA 62 3HB ALA 62 -5.054 4.829 -17.975 477 H GLU 63 H GLU 63 -1.142 3.355 -16.997 478 HA GLU 63 HA GLU 63 -1.209 1.359 -19.045 479 HB2 GLU 63 2HB GLU 63 0.642 3.087 -18.521 480 HB3 GLU 63 1HB GLU 63 1.114 1.984 -17.224 481 HG2 GLU 63 2HG GLU 63 2.430 1.042 -18.755 482 HG3 GLU 63 1HG GLU 63 0.953 0.303 -19.375 483 H SER 64 H SER 64 -1.655 1.374 -15.714 484 HA SER 64 HA SER 64 -0.539 -1.020 -14.877 485 HB2 SER 64 2HB SER 64 -2.979 0.482 -13.986 486 HB3 SER 64 1HB SER 64 -2.404 -0.947 -13.153 487 HG SER 64 HG SER 64 -1.104 0.351 -12.151 488 H THR 65 H THR 65 -2.561 -0.807 -17.426 489 HA THR 65 HA THR 65 -4.635 -2.557 -17.105 490 HB THR 65 HB THR 65 -2.967 -2.997 -19.524 491 HG1 THR 65 1HG THR 65 -4.078 -0.477 -18.861 492 HG21 THR 65 3HG2 THR 65 -5.841 -2.191 -19.164 493 HG22 THR 65 1HG2 THR 65 -5.246 -3.828 -19.451 494 HG23 THR 65 2HG2 THR 65 -5.056 -2.589 -20.693 495 H GLU 66 H GLU 66 -1.203 -3.226 -17.457 496 HA GLU 66 HA GLU 66 -1.585 -6.088 -17.330 497 HB2 GLU 66 2HB GLU 66 0.619 -4.316 -17.916 498 HB3 GLU 66 1HB GLU 66 1.098 -5.483 -16.686 499 HG2 GLU 66 2HG GLU 66 0.271 -7.290 -18.179 500 HG3 GLU 66 1HG GLU 66 0.007 -6.073 -19.427 501 H ILE 67 H ILE 67 -0.824 -3.412 -15.197 502 HA ILE 67 HA ILE 67 -0.132 -5.038 -12.954 503 HB ILE 67 HB ILE 67 -1.195 -2.214 -12.956 504 HG12 ILE 67 2HG1 ILE 67 1.630 -3.281 -13.063 505 HG13 ILE 67 1HG1 ILE 67 0.814 -2.310 -14.294 506 HG21 ILE 67 1HG2 ILE 67 0.013 -2.085 -10.764 507 HG22 ILE 67 2HG2 ILE 67 0.205 -3.837 -10.848 508 HG23 ILE 67 3HG2 ILE 67 -1.409 -3.130 -10.772 509 HD11 ILE 67 3HD1 ILE 67 1.941 -0.626 -13.337 510 HD12 ILE 67 1HD1 ILE 67 2.160 -1.493 -11.816 511 HD13 ILE 67 2HD1 ILE 67 0.636 -0.669 -12.151 512 H SER 68 H SER 68 -3.057 -4.410 -14.556 513 HA SER 68 HA SER 68 -4.842 -4.571 -12.338 514 HB2 SER 68 2HB SER 68 -5.098 -4.061 -15.065 515 HB3 SER 68 1HB SER 68 -5.919 -5.607 -14.848 516 HG SER 68 HG SER 68 -6.999 -4.490 -13.016 517 H GLU 69 H GLU 69 -3.317 -6.854 -14.504 518 HA GLU 69 HA GLU 69 -4.616 -9.102 -13.170 519 HB2 GLU 69 2HB GLU 69 -2.666 -9.279 -15.459 520 HB3 GLU 69 1HB GLU 69 -3.859 -10.470 -14.954 521 HG2 GLU 69 2HG GLU 69 -4.383 -7.821 -16.279 522 HG3 GLU 69 1HG GLU 69 -4.601 -9.426 -16.974 523 H LEU 70 H LEU 70 -1.708 -7.321 -13.220 524 HA LEU 70 HA LEU 70 0.038 -9.360 -12.235 525 HB2 LEU 70 2HB LEU 70 0.335 -6.813 -13.276 526 HB3 LEU 70 1HB LEU 70 0.761 -6.605 -11.579 527 HG LEU 70 HG LEU 70 2.335 -8.614 -11.944 528 HD11 LEU 70 1HD1 LEU 70 1.597 -9.452 -14.004 529 HD12 LEU 70 2HD1 LEU 70 3.141 -8.669 -14.344 530 HD13 LEU 70 3HD1 LEU 70 1.628 -7.856 -14.765 531 HD21 LEU 70 3HD2 LEU 70 3.156 -6.212 -13.521 532 HD22 LEU 70 1HD2 LEU 70 4.087 -7.170 -12.370 533 HD23 LEU 70 2HD2 LEU 70 2.841 -6.063 -11.793 534 H SER 71 H SER 71 -1.272 -6.418 -10.739 535 HA SER 71 HA SER 71 -0.545 -6.827 -8.137 536 HB2 SER 71 2HB SER 71 -2.767 -5.370 -9.443 537 HB3 SER 71 1HB SER 71 -2.903 -5.662 -7.711 538 HG SER 71 HG SER 71 -1.498 -3.793 -8.904 539 H HIS 72 H HIS 72 -2.729 -8.782 -9.874 540 HA HIS 72 HA HIS 72 -4.554 -9.586 -7.941 541 HB2 HIS 72 2HB HIS 72 -3.470 -10.719 -10.443 542 HB3 HIS 72 1HB HIS 72 -4.128 -11.905 -9.308 543 HD1 HIS 72 1HD HIS 72 -6.368 -12.478 -10.185 544 HD2 HIS 72 2HD HIS 72 -5.659 -8.386 -10.312 545 HE1 HIS 72 1HE HIS 72 -8.525 -11.446 -10.961 546 HE2 HIS 72 2HE HIS 72 -8.047 -8.977 -11.110 547 H ASN 73 H ASN 73 -1.214 -9.942 -8.001 548 HA ASN 73 HA ASN 73 -0.903 -12.395 -6.627 549 HB2 ASN 73 2HB ASN 73 1.365 -11.184 -5.994 550 HB3 ASN 73 1HB ASN 73 1.077 -11.793 -7.625 551 HD21 ASN 73 1HD2 ASN 73 1.888 -10.432 -9.062 552 HD22 ASN 73 2HD2 ASN 73 1.795 -8.694 -8.981 553 H PHE 74 H PHE 74 -2.113 -9.438 -5.646 554 HA PHE 74 HA PHE 74 -2.641 -10.214 -3.062 555 HB2 PHE 74 2HB PHE 74 -1.218 -8.661 -1.774 556 HB3 PHE 74 1HB PHE 74 -0.294 -9.910 -2.612 557 HD1 PHE 74 1HD PHE 74 -1.428 -6.385 -3.022 558 HD2 PHE 74 2HD PHE 74 1.536 -9.323 -3.842 559 HE1 PHE 74 1HE PHE 74 0.003 -4.655 -4.029 560 HE2 PHE 74 2HE PHE 74 2.973 -7.600 -4.851 561 HZ PHE 74 HZ PHE 74 2.207 -5.264 -4.940 562 H VAL 75 H VAL 75 -2.967 -7.768 -1.753 563 HA VAL 75 HA VAL 75 -4.511 -6.187 -3.703 564 HB VAL 75 HB VAL 75 -6.082 -7.637 -2.536 565 HG11 VAL 75 1HG1 VAL 75 -6.094 -8.043 -0.330 566 HG12 VAL 75 2HG1 VAL 75 -5.761 -6.361 0.086 567 HG13 VAL 75 3HG1 VAL 75 -4.440 -7.430 -0.386 568 HG21 VAL 75 3HG2 VAL 75 -7.636 -6.030 -2.394 569 HG22 VAL 75 1HG2 VAL 75 -6.333 -4.950 -2.887 570 HG23 VAL 75 2HG2 VAL 75 -6.735 -5.124 -1.180 571 H MET 76 H MET 76 -4.658 -3.931 -3.294 572 HA MET 76 HA MET 76 -2.990 -3.050 -1.036 573 HB2 MET 76 2HB MET 76 -3.226 -1.429 -3.522 574 HB3 MET 76 1HB MET 76 -1.974 -1.398 -2.300 575 HG2 MET 76 2HG MET 76 -0.818 -2.524 -3.865 576 HG3 MET 76 1HG MET 76 -1.649 -3.902 -3.156 577 HE1 MET 76 3HE MET 76 -3.412 -5.512 -5.803 578 HE2 MET 76 1HE MET 76 -2.657 -5.470 -4.210 579 HE3 MET 76 2HE MET 76 -1.655 -5.565 -5.658 580 H VAL 77 H VAL 77 -3.373 -0.490 -0.785 581 HA VAL 77 HA VAL 77 -6.244 0.080 -0.838 582 HB VAL 77 HB VAL 77 -4.567 -0.297 1.594 583 HG11 VAL 77 1HG1 VAL 77 -5.055 1.841 2.207 584 HG12 VAL 77 2HG1 VAL 77 -6.519 1.032 2.770 585 HG13 VAL 77 3HG1 VAL 77 -6.530 1.903 1.236 586 HG21 VAL 77 3HG2 VAL 77 -7.497 -0.660 1.556 587 HG22 VAL 77 1HG2 VAL 77 -6.236 -1.670 2.265 588 HG23 VAL 77 2HG2 VAL 77 -6.545 -1.734 0.528 589 H ASN 78 H ASN 78 -6.259 1.916 -1.983 590 HA ASN 78 HA ASN 78 -4.280 3.978 -1.361 591 HB2 ASN 78 2HB ASN 78 -4.096 3.654 -3.633 592 HB3 ASN 78 1HB ASN 78 -5.786 3.220 -3.804 593 HD21 ASN 78 1HD2 ASN 78 -4.580 6.111 -2.243 594 HD22 ASN 78 2HD2 ASN 78 -5.232 7.227 -3.395 595 H LEU 79 H LEU 79 -4.928 5.511 -0.059 596 HA LEU 79 HA LEU 79 -7.726 6.420 -0.246 597 HB2 LEU 79 2HB LEU 79 -7.778 6.759 2.166 598 HB3 LEU 79 1HB LEU 79 -7.487 5.079 1.758 599 HG LEU 79 HG LEU 79 -4.945 5.904 2.052 600 HD11 LEU 79 1HD1 LEU 79 -4.774 7.395 3.956 601 HD12 LEU 79 2HD1 LEU 79 -6.530 7.560 4.008 602 HD13 LEU 79 3HD1 LEU 79 -5.627 8.191 2.631 603 HD21 LEU 79 3HD2 LEU 79 -5.057 4.965 4.325 604 HD22 LEU 79 1HD2 LEU 79 -5.931 3.982 3.150 605 HD23 LEU 79 2HD2 LEU 79 -6.818 5.037 4.252 606 H GLU 80 H GLU 80 -7.987 8.560 1.022 607 HA GLU 80 HA GLU 80 -5.687 10.333 0.680 608 HB2 GLU 80 2HB GLU 80 -8.012 10.268 -1.047 609 HB3 GLU 80 1HB GLU 80 -7.882 11.831 -0.231 610 HG2 GLU 80 2HG GLU 80 -6.722 12.047 -2.265 611 HG3 GLU 80 1HG GLU 80 -5.485 11.900 -1.005 612 H ASP 81 H ASP 81 -6.860 12.735 1.233 613 HA ASP 81 HA ASP 81 -7.055 12.778 3.985 614 HB2 ASP 81 2HB ASP 81 -8.283 15.014 3.608 615 HB3 ASP 81 1HB ASP 81 -6.647 14.850 2.980 616 H GLU 82 H GLU 82 -9.529 12.106 1.631 617 HA GLU 82 HA GLU 82 -11.843 12.597 3.073 618 HB2 GLU 82 2HB GLU 82 -11.470 11.731 0.632 619 HB3 GLU 82 1HB GLU 82 -11.621 10.142 1.370 620 HG2 GLU 82 2HG GLU 82 -13.833 10.425 1.864 621 HG3 GLU 82 1HG GLU 82 -13.701 12.182 1.953 622 H GLU 83 H GLU 83 -9.694 9.799 3.184 623 HA GLU 83 HA GLU 83 -11.380 8.459 5.131 624 HB2 GLU 83 2HB GLU 83 -8.999 7.747 3.514 625 HB3 GLU 83 1HB GLU 83 -9.155 6.943 5.071 626 HG2 GLU 83 2HG GLU 83 -11.679 6.861 3.769 627 HG3 GLU 83 1HG GLU 83 -10.439 6.332 2.626 628 H GLU 84 H GLU 84 -8.101 9.825 4.997 629 HA GLU 84 HA GLU 84 -6.694 10.583 6.614 630 HB2 GLU 84 2HB GLU 84 -8.977 11.855 7.062 631 HB3 GLU 84 1HB GLU 84 -8.947 10.908 8.542 632 HG2 GLU 84 2HG GLU 84 -7.069 11.969 9.348 633 HG3 GLU 84 1HG GLU 84 -6.537 12.471 7.743 634 HA PRO 85 HA PRO 85 -6.615 6.378 8.567 635 HB2 PRO 85 2HB PRO 85 -3.718 7.008 8.337 636 HB3 PRO 85 1HB PRO 85 -4.590 5.523 7.910 637 HG2 PRO 85 2HG PRO 85 -3.717 7.183 6.015 638 HG3 PRO 85 1HG PRO 85 -5.292 6.366 5.865 639 HD2 PRO 85 2HD PRO 85 -4.682 9.198 6.629 640 HD3 PRO 85 1HD PRO 85 -5.996 8.557 5.612 641 H LYS 86 H LYS 86 -5.009 9.403 9.316 642 HA LYS 86 HA LYS 86 -4.391 10.385 11.270 643 HB2 LYS 86 2HB LYS 86 -6.630 8.582 12.084 644 HB3 LYS 86 1HB LYS 86 -5.685 9.381 13.347 645 HG2 LYS 86 2HG LYS 86 -6.176 11.555 12.213 646 HG3 LYS 86 1HG LYS 86 -7.279 10.681 11.147 647 HD2 LYS 86 2HD LYS 86 -8.846 10.445 12.754 648 HD3 LYS 86 1HD LYS 86 -7.650 10.193 14.027 649 HE2 LYS 86 2HE LYS 86 -8.705 12.237 14.541 650 HE3 LYS 86 1HE LYS 86 -7.142 12.667 13.847 651 HZ1 LYS 86 3HZ LYS 86 -8.095 13.586 12.043 652 HZ2 LYS 86 1HZ LYS 86 -9.434 13.748 13.064 653 HZ3 LYS 86 2HZ LYS 86 -9.354 12.458 11.974 654 H ASP 87 H ASP 87 -2.997 7.927 10.313 655 HA ASP 87 HA ASP 87 -1.599 7.337 12.823 656 HB2 ASP 87 2HB ASP 87 -3.247 5.494 11.538 657 HB3 ASP 87 1HB ASP 87 -1.615 5.046 11.020 658 H GLU 88 H GLU 88 0.611 6.952 12.624 659 HA GLU 88 HA GLU 88 1.968 8.315 10.609 660 HB2 GLU 88 2HB GLU 88 2.682 6.641 12.894 661 HB3 GLU 88 1HB GLU 88 3.846 6.552 11.581 662 HG2 GLU 88 2HG GLU 88 4.598 8.272 12.965 663 HG3 GLU 88 1HG GLU 88 3.847 9.081 11.594 664 H ASP 89 H ASP 89 0.578 5.205 10.504 665 HA ASP 89 HA ASP 89 2.243 3.707 8.924 666 HB2 ASP 89 2HB ASP 89 -0.726 3.891 9.189 667 HB3 ASP 89 1HB ASP 89 -0.065 2.936 7.854 668 H PHE 90 H PHE 90 0.493 6.582 8.018 669 HA PHE 90 HA PHE 90 0.749 6.092 5.186 670 HB2 PHE 90 2HB PHE 90 0.007 8.570 5.067 671 HB3 PHE 90 1HB PHE 90 -1.147 7.358 5.635 672 HD1 PHE 90 2HD PHE 90 1.613 9.212 7.352 673 HD2 PHE 90 1HD PHE 90 -2.544 8.324 7.163 674 HE1 PHE 90 2HE PHE 90 1.244 10.535 9.390 675 HE2 PHE 90 1HE PHE 90 -2.922 9.654 9.200 676 HZ PHE 90 HZ PHE 90 -1.026 10.761 10.316 677 H SER 91 H SER 91 2.784 7.328 7.605 678 HA SER 91 HA SER 91 4.862 7.862 5.722 679 HB2 SER 91 2HB SER 91 4.324 10.270 7.393 680 HB3 SER 91 1HB SER 91 5.035 10.149 5.775 681 HG SER 91 HG SER 91 3.111 10.307 4.916 682 HA PRO 92 HA PRO 92 6.186 6.917 10.091 683 HB2 PRO 92 2HB PRO 92 6.344 4.268 10.103 684 HB3 PRO 92 1HB PRO 92 4.767 5.072 10.242 685 HG2 PRO 92 2HG PRO 92 6.017 3.736 7.882 686 HG3 PRO 92 1HG PRO 92 4.324 3.744 8.399 687 HD2 PRO 92 2HD PRO 92 5.465 5.395 6.432 688 HD3 PRO 92 1HD PRO 92 3.883 5.617 7.199 689 H ASP 93 H ASP 93 7.678 7.525 7.569 690 HA ASP 93 HA ASP 93 10.149 6.074 8.241 691 HB2 ASP 93 2HB ASP 93 8.728 5.956 5.788 692 HB3 ASP 93 1HB ASP 93 10.203 6.889 5.490 693 H GLY 94 H GLY 94 8.995 8.876 6.348 694 HA2 GLY 94 2HA GLY 94 11.221 10.424 7.535 695 HA3 GLY 94 1HA GLY 94 10.731 10.607 5.847 696 H GLY 95 H GLY 95 9.581 12.370 5.477 697 HA2 GLY 95 2HA GLY 95 7.497 13.138 7.388 698 HA3 GLY 95 1HA GLY 95 8.750 14.329 7.023 699 H TYR 96 H TYR 96 6.716 12.067 5.148 700 HA TYR 96 HA TYR 96 6.156 14.289 3.301 701 HB2 TYR 96 2HB TYR 96 5.423 12.276 1.778 702 HB3 TYR 96 1HB TYR 96 7.132 12.695 1.942 703 HD1 TYR 96 1HD TYR 96 8.507 11.358 3.664 704 HD2 TYR 96 2HD TYR 96 4.686 10.133 2.254 705 HE1 TYR 96 1HE TYR 96 8.980 9.062 4.397 706 HE2 TYR 96 2HE TYR 96 5.150 7.822 2.963 707 HH TYR 96 HH TYR 96 7.008 6.896 5.038 708 H ILE 97 H ILE 97 3.939 13.892 2.116 709 HA ILE 97 HA ILE 97 1.930 12.823 3.925 710 HB ILE 97 HB ILE 97 0.622 15.037 3.617 711 HG12 ILE 97 2HG1 ILE 97 3.235 16.400 3.655 712 HG13 ILE 97 1HG1 ILE 97 2.777 15.699 2.100 713 HG21 ILE 97 1HG2 ILE 97 1.757 16.011 5.625 714 HG22 ILE 97 2HG2 ILE 97 2.977 14.748 5.470 715 HG23 ILE 97 3HG2 ILE 97 1.297 14.317 5.787 716 HD11 ILE 97 3HD1 ILE 97 1.554 17.942 3.607 717 HD12 ILE 97 1HD1 ILE 97 0.512 16.937 2.596 718 HD13 ILE 97 2HD1 ILE 97 1.889 17.775 1.881 719 HA PRO 98 HA PRO 98 1.592 10.568 3.019 720 HB2 PRO 98 2HB PRO 98 -1.101 10.097 1.677 721 HB3 PRO 98 1HB PRO 98 -0.395 9.201 3.052 722 HG2 PRO 98 2HG PRO 98 -1.777 11.696 3.092 723 HG3 PRO 98 1HG PRO 98 -1.024 10.821 4.456 724 HD2 PRO 98 2HD PRO 98 0.047 13.071 3.765 725 HD3 PRO 98 1HD PRO 98 1.121 11.670 3.969 726 H ARG 99 H ARG 99 2.379 8.646 2.119 727 HA ARG 99 HA ARG 99 2.475 8.568 -0.824 728 HB2 ARG 99 2HB ARG 99 4.588 8.500 1.205 729 HB3 ARG 99 1HB ARG 99 4.759 7.285 -0.055 730 HG2 ARG 99 2HG ARG 99 5.991 9.273 -0.609 731 HG3 ARG 99 1HG ARG 99 4.667 9.045 -1.749 732 HD2 ARG 99 2HD ARG 99 3.565 10.617 0.234 733 HD3 ARG 99 1HD ARG 99 5.207 11.232 0.092 734 HE ARG 99 HE ARG 99 3.841 10.887 -2.422 735 HH11 ARG 99 1HH1 ARG 99 4.486 13.065 0.230 736 HH12 ARG 99 2HH1 ARG 99 4.186 14.490 -0.706 737 HH21 ARG 99 1HH2 ARG 99 3.451 12.760 -3.652 738 HH22 ARG 99 2HH2 ARG 99 3.597 14.318 -2.909 739 H ILE 100 H ILE 100 3.796 6.219 -1.188 740 HA ILE 100 HA ILE 100 1.744 4.275 -0.492 741 HB ILE 100 HB ILE 100 2.737 2.829 -2.153 742 HG12 ILE 100 2HG1 ILE 100 4.817 4.916 -2.765 743 HG13 ILE 100 1HG1 ILE 100 5.133 3.654 -1.577 744 HG21 ILE 100 1HG2 ILE 100 2.230 4.076 -4.081 745 HG22 ILE 100 2HG2 ILE 100 2.745 5.587 -3.331 746 HG23 ILE 100 3HG2 ILE 100 1.268 4.795 -2.792 747 HD11 ILE 100 3HD1 ILE 100 5.867 2.439 -3.281 748 HD12 ILE 100 1HD1 ILE 100 5.167 3.537 -4.468 749 HD13 ILE 100 2HD1 ILE 100 4.178 2.264 -3.755 750 H LEU 101 H LEU 101 2.460 2.014 0.097 751 HA LEU 101 HA LEU 101 4.975 1.470 1.191 752 HB2 LEU 101 2HB LEU 101 3.971 1.501 3.663 753 HB3 LEU 101 1HB LEU 101 4.869 2.839 2.975 754 HG LEU 101 HG LEU 101 2.157 3.241 2.265 755 HD11 LEU 101 1HD1 LEU 101 1.176 3.402 4.549 756 HD12 LEU 101 2HD1 LEU 101 2.540 2.447 5.129 757 HD13 LEU 101 3HD1 LEU 101 1.419 1.760 3.955 758 HD21 LEU 101 3HD2 LEU 101 3.476 4.683 4.518 759 HD22 LEU 101 1HD2 LEU 101 2.461 5.312 3.220 760 HD23 LEU 101 2HD2 LEU 101 4.125 4.833 2.886 761 H PHE 102 H PHE 102 5.166 -0.612 2.025 762 HA PHE 102 HA PHE 102 2.861 -2.323 1.505 763 HB2 PHE 102 2HB PHE 102 5.629 -2.588 1.085 764 HB3 PHE 102 1HB PHE 102 5.220 -3.759 2.333 765 HD1 PHE 102 2HD PHE 102 3.340 -5.393 1.869 766 HD2 PHE 102 1HD PHE 102 5.153 -3.014 -1.157 767 HE1 PHE 102 2HE PHE 102 2.484 -6.932 0.153 768 HE2 PHE 102 1HE PHE 102 4.299 -4.549 -2.881 769 HZ PHE 102 HZ PHE 102 2.963 -6.512 -2.226 770 H LEU 103 H LEU 103 2.331 -4.093 2.990 771 HA LEU 103 HA LEU 103 3.223 -3.905 5.714 772 HB2 LEU 103 2HB LEU 103 1.218 -3.204 6.722 773 HB3 LEU 103 1HB LEU 103 1.574 -2.046 5.460 774 HG LEU 103 HG LEU 103 -0.290 -4.278 4.890 775 HD11 LEU 103 1HD1 LEU 103 -0.696 -2.373 6.965 776 HD12 LEU 103 2HD1 LEU 103 -1.720 -3.706 6.432 777 HD13 LEU 103 3HD1 LEU 103 -1.864 -2.125 5.665 778 HD21 LEU 103 3HD2 LEU 103 -0.458 -1.419 4.032 779 HD22 LEU 103 1HD2 LEU 103 -1.155 -2.842 3.260 780 HD23 LEU 103 2HD2 LEU 103 0.586 -2.570 3.200 781 H ASP 104 H ASP 104 1.818 -5.365 7.160 782 HA ASP 104 HA ASP 104 1.738 -7.942 5.914 783 HB2 ASP 104 2HB ASP 104 1.647 -6.868 8.632 784 HB3 ASP 104 1HB ASP 104 0.567 -8.252 8.406 785 HA PRO 105 HA PRO 105 -2.449 -8.117 4.558 786 HB2 PRO 105 2HB PRO 105 -2.966 -10.783 5.140 787 HB3 PRO 105 1HB PRO 105 -2.197 -10.188 3.660 788 HG2 PRO 105 2HG PRO 105 -0.969 -11.377 6.103 789 HG3 PRO 105 1HG PRO 105 -0.474 -11.521 4.402 790 HD2 PRO 105 2HD PRO 105 0.821 -9.930 6.168 791 HD3 PRO 105 1HD PRO 105 0.691 -9.532 4.444 792 H SER 106 H SER 106 -3.324 -6.773 6.173 793 HA SER 106 HA SER 106 -5.467 -7.629 7.571 794 HB2 SER 106 2HB SER 106 -2.975 -8.172 9.093 795 HB3 SER 106 1HB SER 106 -4.301 -7.425 10.001 796 HG SER 106 HG SER 106 -4.517 -9.653 10.094 797 H GLY 107 H GLY 107 -2.722 -5.500 7.480 798 HA2 GLY 107 2HA GLY 107 -3.344 -3.110 7.163 799 HA3 GLY 107 1HA GLY 107 -4.427 -3.332 8.540 800 H LYS 108 H LYS 108 -1.052 -4.445 8.111 801 HA LYS 108 HA LYS 108 -0.377 -2.741 10.426 802 HB2 LYS 108 2HB LYS 108 -0.036 -5.627 10.026 803 HB3 LYS 108 1HB LYS 108 1.385 -4.807 10.658 804 HG2 LYS 108 2HG LYS 108 -0.468 -3.731 12.253 805 HG3 LYS 108 1HG LYS 108 -1.248 -5.287 11.907 806 HD2 LYS 108 2HD LYS 108 1.283 -6.094 12.425 807 HD3 LYS 108 1HD LYS 108 1.175 -4.681 13.476 808 HE2 LYS 108 2HE LYS 108 -0.478 -5.604 14.774 809 HE3 LYS 108 1HE LYS 108 -1.071 -6.635 13.473 810 HZ1 LYS 108 3HZ LYS 108 -0.016 -8.207 14.667 811 HZ2 LYS 108 1HZ LYS 108 1.050 -7.117 15.402 812 HZ3 LYS 108 2HZ LYS 108 1.349 -7.660 13.828 813 H VAL 109 H VAL 109 0.241 -1.298 8.503 814 HA VAL 109 HA VAL 109 2.420 -1.725 6.848 815 HB VAL 109 HB VAL 109 1.128 0.661 8.031 816 HG11 VAL 109 1HG1 VAL 109 3.837 0.782 6.737 817 HG12 VAL 109 2HG1 VAL 109 3.414 1.272 8.376 818 HG13 VAL 109 3HG1 VAL 109 2.786 2.172 6.998 819 HG21 VAL 109 3HG2 VAL 109 1.949 0.218 5.188 820 HG22 VAL 109 1HG2 VAL 109 0.653 1.232 5.822 821 HG23 VAL 109 2HG2 VAL 109 0.500 -0.522 5.867 822 H HIS 110 H HIS 110 4.558 -1.552 6.979 823 HA HIS 110 HA HIS 110 5.779 -0.742 9.494 824 HB2 HIS 110 2HB HIS 110 5.640 -3.534 8.541 825 HB3 HIS 110 1HB HIS 110 7.238 -2.993 9.044 826 HD1 HIS 110 1HD HIS 110 7.695 -2.949 11.499 827 HD2 HIS 110 2HD HIS 110 3.642 -3.296 10.651 828 HE1 HIS 110 1HE HIS 110 6.577 -3.365 13.714 829 HE2 HIS 110 2HE HIS 110 4.138 -3.668 13.161 830 HA PRO 111 HA PRO 111 8.664 0.919 6.572 831 HB2 PRO 111 2HB PRO 111 10.719 1.465 8.262 832 HB3 PRO 111 1HB PRO 111 9.245 2.439 8.198 833 HG2 PRO 111 2HG PRO 111 10.011 0.288 10.128 834 HG3 PRO 111 1HG PRO 111 9.235 1.848 10.445 835 HD2 PRO 111 2HD PRO 111 7.861 -0.490 10.336 836 HD3 PRO 111 1HD PRO 111 7.152 1.068 9.851 837 H GLU 112 H GLU 112 8.527 -1.951 6.746 838 HA GLU 112 HA GLU 112 11.368 -2.712 6.682 839 HB2 GLU 112 2HB GLU 112 10.459 -5.068 6.665 840 HB3 GLU 112 1HB GLU 112 10.153 -4.152 8.133 841 HG2 GLU 112 2HG GLU 112 7.875 -3.669 7.307 842 HG3 GLU 112 1HG GLU 112 8.197 -4.697 5.914 843 H ILE 113 H ILE 113 8.349 -3.037 4.851 844 HA ILE 113 HA ILE 113 9.924 -3.672 2.451 845 HB ILE 113 HB ILE 113 6.971 -4.039 2.971 846 HG12 ILE 113 2HG1 ILE 113 8.503 -5.598 4.181 847 HG13 ILE 113 1HG1 ILE 113 7.439 -6.404 3.021 848 HG21 ILE 113 1HG2 ILE 113 6.895 -5.187 0.825 849 HG22 ILE 113 2HG2 ILE 113 8.605 -4.838 0.564 850 HG23 ILE 113 3HG2 ILE 113 7.435 -3.520 0.622 851 HD11 ILE 113 3HD1 ILE 113 9.358 -6.346 1.398 852 HD12 ILE 113 1HD1 ILE 113 9.574 -7.388 2.804 853 HD13 ILE 113 2HD1 ILE 113 10.372 -5.815 2.741 854 H ILE 114 H ILE 114 10.555 -1.538 2.050 855 HA ILE 114 HA ILE 114 8.479 0.443 1.534 856 HB ILE 114 HB ILE 114 10.274 2.046 1.292 857 HG12 ILE 114 2HG1 ILE 114 11.888 0.209 0.373 858 HG13 ILE 114 1HG1 ILE 114 12.548 1.551 1.293 859 HG21 ILE 114 1HG2 ILE 114 9.851 2.196 3.473 860 HG22 ILE 114 2HG2 ILE 114 11.374 1.338 3.693 861 HG23 ILE 114 3HG2 ILE 114 9.854 0.445 3.687 862 HD11 ILE 114 3HD1 ILE 114 11.895 -0.580 3.080 863 HD12 ILE 114 1HD1 ILE 114 13.461 0.151 2.734 864 HD13 ILE 114 2HD1 ILE 114 12.880 -1.194 1.753 865 H ASN 115 H ASN 115 9.236 1.968 -0.403 866 HA ASN 115 HA ASN 115 8.583 0.659 -2.758 867 HB2 ASN 115 2HB ASN 115 8.382 3.093 -2.425 868 HB3 ASN 115 1HB ASN 115 10.147 3.233 -2.448 869 HD21 ASN 115 1HD2 ASN 115 9.278 4.796 -4.176 870 HD22 ASN 115 2HD2 ASN 115 9.236 4.159 -5.799 871 H GLU 116 H GLU 116 11.720 1.265 -1.314 872 HA GLU 116 HA GLU 116 13.810 0.509 -1.799 873 HB2 GLU 116 2HB GLU 116 12.002 -1.598 -2.508 874 HB3 GLU 116 1HB GLU 116 13.339 -1.579 -3.664 875 HG2 GLU 116 2HG GLU 116 13.709 -1.596 -0.678 876 HG3 GLU 116 1HG GLU 116 13.659 -3.052 -1.671 877 H ASN 117 H ASN 117 12.299 2.387 -3.660 878 HA ASN 117 HA ASN 117 14.163 2.141 -5.926 879 HB2 ASN 117 2HB ASN 117 11.248 2.307 -5.938 880 HB3 ASN 117 1HB ASN 117 12.001 3.573 -6.922 881 HD21 ASN 117 1HD2 ASN 117 13.366 2.959 -8.643 882 HD22 ASN 117 2HD2 ASN 117 13.217 1.386 -9.382 883 H GLY 118 H GLY 118 12.328 4.265 -3.798 884 HA2 GLY 118 2HA GLY 118 13.263 6.714 -4.872 885 HA3 GLY 118 1HA GLY 118 12.579 6.483 -3.259 886 H ASN 119 H ASN 119 14.308 8.224 -2.970 887 HA ASN 119 HA ASN 119 17.037 7.330 -2.864 888 HB2 ASN 119 2HB ASN 119 17.499 9.543 -1.912 889 HB3 ASN 119 1HB ASN 119 16.473 9.680 -3.346 890 HD21 ASN 119 1HD2 ASN 119 16.622 9.928 0.124 891 HD22 ASN 119 2HD2 ASN 119 15.120 10.793 0.323 892 HA PRO 120 HA PRO 120 17.246 5.902 1.307 893 HB2 PRO 120 2HB PRO 120 19.636 7.419 1.971 894 HB3 PRO 120 1HB PRO 120 19.478 5.694 1.606 895 HG2 PRO 120 2HG PRO 120 20.740 7.465 -0.037 896 HG3 PRO 120 1HG PRO 120 19.932 5.993 -0.621 897 HD2 PRO 120 2HD PRO 120 18.952 8.828 -0.626 898 HD3 PRO 120 1HD PRO 120 18.809 7.579 -1.888 899 H SER 121 H SER 121 15.439 7.957 1.258 900 HA SER 121 HA SER 121 15.299 8.788 3.908 901 HB2 SER 121 2HB SER 121 16.970 10.489 2.274 902 HB3 SER 121 1HB SER 121 15.536 11.383 2.807 903 HG SER 121 HG SER 121 17.702 10.782 4.209 904 H TYR 122 H TYR 122 13.690 7.632 1.958 905 HA TYR 122 HA TYR 122 11.322 9.182 2.188 906 HB2 TYR 122 2HB TYR 122 12.967 9.507 -0.176 907 HB3 TYR 122 1HB TYR 122 11.365 8.898 -0.591 908 HD1 TYR 122 2HD TYR 122 9.357 10.223 0.423 909 HD2 TYR 122 1HD TYR 122 13.307 11.770 0.125 910 HE1 TYR 122 2HE TYR 122 8.468 12.509 0.579 911 HE2 TYR 122 1HE TYR 122 12.431 14.060 0.287 912 HH TYR 122 HH TYR 122 10.083 15.177 -0.285 913 H LYS 123 H LYS 123 12.795 6.784 0.024 914 HA LYS 123 HA LYS 123 12.074 4.752 -0.732 915 HB2 LYS 123 2HB LYS 123 11.172 4.464 2.133 916 HB3 LYS 123 1HB LYS 123 11.543 3.166 1.012 917 HG2 LYS 123 2HG LYS 123 13.584 5.216 1.784 918 HG3 LYS 123 1HG LYS 123 13.301 3.755 2.744 919 HD2 LYS 123 2HD LYS 123 14.365 2.447 1.265 920 HD3 LYS 123 1HD LYS 123 13.600 3.237 -0.120 921 HE2 LYS 123 2HE LYS 123 15.345 4.621 -0.442 922 HE3 LYS 123 1HE LYS 123 15.581 4.882 1.286 923 HZ1 LYS 123 3HZ LYS 123 16.538 2.541 1.285 924 HZ2 LYS 123 1HZ LYS 123 17.482 3.758 0.583 925 HZ3 LYS 123 2HZ LYS 123 16.619 2.683 -0.398 926 H TYR 124 H TYR 124 9.502 5.002 1.674 927 HA TYR 124 HA TYR 124 7.427 3.961 0.312 928 HB2 TYR 124 2HB TYR 124 7.542 6.189 2.310 929 HB3 TYR 124 1HB TYR 124 5.991 5.689 1.628 930 HD1 TYR 124 1HD TYR 124 8.006 2.833 1.702 931 HD2 TYR 124 2HD TYR 124 5.809 5.395 4.298 932 HE1 TYR 124 1HE TYR 124 7.855 1.021 3.354 933 HE2 TYR 124 2HE TYR 124 5.655 3.583 5.953 934 HH TYR 124 HH TYR 124 5.907 0.620 5.470 935 H PHE 125 H PHE 125 8.821 7.112 -0.259 936 HA PHE 125 HA PHE 125 6.642 8.005 -1.930 937 HB2 PHE 125 2HB PHE 125 7.835 9.706 -0.722 938 HB3 PHE 125 1HB PHE 125 9.387 9.136 -1.349 939 HD1 PHE 125 2HD PHE 125 6.199 10.759 -2.319 940 HD2 PHE 125 1HD PHE 125 10.245 9.952 -3.364 941 HE1 PHE 125 2HE PHE 125 6.032 12.354 -4.183 942 HE2 PHE 125 1HE PHE 125 10.085 11.547 -5.231 943 HZ PHE 125 HZ PHE 125 7.976 12.749 -5.644 944 H TYR 126 H TYR 126 6.364 7.348 -3.959 945 HA TYR 126 HA TYR 126 8.723 6.454 -5.471 946 HB2 TYR 126 2HB TYR 126 7.375 4.884 -6.615 947 HB3 TYR 126 1HB TYR 126 6.885 4.761 -4.921 948 HD1 TYR 126 1HD TYR 126 4.814 6.239 -4.251 949 HD2 TYR 126 2HD TYR 126 5.755 5.103 -8.238 950 HE1 TYR 126 1HE TYR 126 2.479 6.642 -4.911 951 HE2 TYR 126 2HE TYR 126 3.423 5.494 -8.907 952 HH TYR 126 HH TYR 126 1.189 7.123 -6.910 953 H VAL 127 H VAL 127 8.006 6.499 -7.979 954 HA VAL 127 HA VAL 127 6.485 8.777 -8.771 955 HB VAL 127 HB VAL 127 8.512 9.853 -9.940 956 HG11 VAL 127 1HG1 VAL 127 8.560 10.204 -6.968 957 HG12 VAL 127 2HG1 VAL 127 7.147 10.676 -7.913 958 HG13 VAL 127 3HG1 VAL 127 8.715 11.418 -8.236 959 HG21 VAL 127 3HG2 VAL 127 10.015 7.914 -9.267 960 HG22 VAL 127 1HG2 VAL 127 10.031 8.630 -7.655 961 HG23 VAL 127 2HG2 VAL 127 10.656 9.540 -9.030 962 H SER 128 H SER 128 5.456 7.523 -10.223 963 HA SER 128 HA SER 128 5.215 6.946 -12.468 964 HB2 SER 128 2HB SER 128 7.632 7.743 -12.855 965 HB3 SER 128 1HB SER 128 8.079 6.044 -12.621 966 HG SER 128 HG SER 128 7.291 5.587 -14.520 967 H ALA 129 H ALA 129 4.639 5.006 -13.376 968 HA ALA 129 HA ALA 129 4.165 2.857 -11.666 969 HB1 ALA 129 1HB ALA 129 3.806 1.617 -13.926 970 HB2 ALA 129 2HB ALA 129 4.031 3.221 -14.625 971 HB3 ALA 129 3HB ALA 129 2.731 2.938 -13.467 972 H GLU 130 H GLU 130 6.871 3.584 -13.729 973 HA GLU 130 HA GLU 130 8.084 1.197 -14.184 974 HB2 GLU 130 2HB GLU 130 8.854 3.900 -14.207 975 HB3 GLU 130 1HB GLU 130 10.084 3.056 -13.258 976 HG2 GLU 130 2HG GLU 130 10.642 3.205 -15.649 977 HG3 GLU 130 1HG GLU 130 10.509 1.534 -15.073 978 H GLN 131 H GLN 131 8.781 3.160 -11.258 979 HA GLN 131 HA GLN 131 10.176 0.990 -10.066 980 HB2 GLN 131 2HB GLN 131 10.000 2.373 -7.968 981 HB3 GLN 131 1HB GLN 131 10.930 3.039 -9.302 982 HG2 GLN 131 2HG GLN 131 8.393 4.032 -9.730 983 HG3 GLN 131 1HG GLN 131 8.557 4.064 -7.977 984 HE21 GLN 131 1HE2 GLN 131 9.946 5.482 -7.034 985 HE22 GLN 131 2HE2 GLN 131 10.816 6.694 -7.901 986 H VAL 132 H VAL 132 7.046 2.524 -9.253 987 HA VAL 132 HA VAL 132 6.381 0.810 -7.178 988 HB VAL 132 HB VAL 132 4.919 2.569 -7.308 989 HG11 VAL 132 1HG1 VAL 132 3.582 2.573 -9.743 990 HG12 VAL 132 2HG1 VAL 132 5.279 2.307 -10.149 991 HG13 VAL 132 3HG1 VAL 132 4.811 3.713 -9.197 992 HG21 VAL 132 3HG2 VAL 132 2.706 1.710 -7.607 993 HG22 VAL 132 1HG2 VAL 132 3.718 0.418 -6.959 994 HG23 VAL 132 2HG2 VAL 132 3.294 0.432 -8.670 995 H VAL 133 H VAL 133 6.529 0.121 -10.553 996 HA VAL 133 HA VAL 133 4.848 -2.218 -10.325 997 HB VAL 133 HB VAL 133 5.030 -0.891 -12.463 998 HG11 VAL 133 1HG1 VAL 133 7.093 -0.458 -13.201 999 HG12 VAL 133 2HG1 VAL 133 7.151 -2.139 -13.726 1000 HG13 VAL 133 3HG1 VAL 133 7.803 -1.684 -12.153 1001 HG21 VAL 133 3HG2 VAL 133 4.227 -3.304 -12.168 1002 HG22 VAL 133 1HG2 VAL 133 5.776 -3.767 -12.875 1003 HG23 VAL 133 2HG2 VAL 133 4.646 -2.774 -13.797 1004 H GLN 134 H GLN 134 8.282 -1.436 -10.121 1005 HA GLN 134 HA GLN 134 9.040 -4.226 -10.372 1006 HB2 GLN 134 2HB GLN 134 11.272 -3.288 -9.380 1007 HB3 GLN 134 1HB GLN 134 10.822 -2.922 -11.038 1008 HG2 GLN 134 2HG GLN 134 9.986 -0.756 -10.346 1009 HG3 GLN 134 1HG GLN 134 10.402 -1.122 -8.674 1010 HE21 GLN 134 1HE2 GLN 134 12.837 -2.195 -8.798 1011 HE22 GLN 134 2HE2 GLN 134 13.984 -1.074 -9.480 1012 H GLY 135 H GLY 135 8.282 -1.966 -7.841 1013 HA2 GLY 135 2HA GLY 135 9.128 -3.692 -5.697 1014 HA3 GLY 135 1HA GLY 135 8.142 -2.228 -5.546 1015 H MET 136 H MET 136 6.321 -3.298 -7.693 1016 HA MET 136 HA MET 136 4.558 -4.757 -5.905 1017 HB2 MET 136 2HB MET 136 3.975 -2.894 -7.666 1018 HB3 MET 136 1HB MET 136 3.952 -4.238 -8.796 1019 HG2 MET 136 2HG MET 136 2.293 -4.054 -6.294 1020 HG3 MET 136 1HG MET 136 1.733 -3.657 -7.916 1021 HE1 MET 136 3HE MET 136 2.235 -5.482 -9.929 1022 HE2 MET 136 1HE MET 136 0.552 -5.356 -9.414 1023 HE3 MET 136 2HE MET 136 1.274 -6.941 -9.693 1024 H LYS 137 H LYS 137 6.267 -5.287 -8.940 1025 HA LYS 137 HA LYS 137 5.341 -7.945 -9.330 1026 HB2 LYS 137 2HB LYS 137 6.724 -8.015 -11.214 1027 HB3 LYS 137 1HB LYS 137 6.243 -6.332 -11.092 1028 HG2 LYS 137 2HG LYS 137 8.472 -6.038 -9.813 1029 HG3 LYS 137 1HG LYS 137 8.901 -7.582 -10.551 1030 HD2 LYS 137 2HD LYS 137 8.136 -5.029 -11.963 1031 HD3 LYS 137 1HD LYS 137 9.713 -5.817 -11.961 1032 HE2 LYS 137 2HE LYS 137 7.227 -7.124 -13.044 1033 HE3 LYS 137 1HE LYS 137 8.300 -6.138 -14.036 1034 HZ1 LYS 137 3HZ LYS 137 9.578 -8.234 -12.483 1035 HZ2 LYS 137 1HZ LYS 137 9.871 -7.730 -14.071 1036 HZ3 LYS 137 2HZ LYS 137 8.574 -8.764 -13.738 1037 H GLU 138 H GLU 138 7.624 -6.629 -7.216 1038 HA GLU 138 HA GLU 138 9.240 -9.050 -7.079 1039 HB2 GLU 138 2HB GLU 138 9.499 -6.269 -6.063 1040 HB3 GLU 138 1HB GLU 138 10.279 -7.548 -5.131 1041 HG2 GLU 138 2HG GLU 138 10.871 -7.915 -7.900 1042 HG3 GLU 138 1HG GLU 138 11.222 -6.240 -7.439 1043 H ALA 139 H ALA 139 7.938 -6.973 -4.524 1044 HA ALA 139 HA ALA 139 7.863 -8.809 -2.495 1045 HB1 ALA 139 1HB ALA 139 5.578 -6.953 -2.553 1046 HB2 ALA 139 2HB ALA 139 7.180 -6.226 -2.692 1047 HB3 ALA 139 3HB ALA 139 6.787 -7.237 -1.300 1048 H GLN 140 H GLN 140 5.691 -8.557 -5.192 1049 HA GLN 140 HA GLN 140 3.433 -9.781 -4.237 1050 HB2 GLN 140 2HB GLN 140 3.153 -10.608 -6.626 1051 HB3 GLN 140 1HB GLN 140 3.295 -8.866 -6.380 1052 HG2 GLN 140 2HG GLN 140 4.649 -9.258 -8.200 1053 HG3 GLN 140 1HG GLN 140 5.791 -9.237 -6.861 1054 HE21 GLN 140 1HE2 GLN 140 3.599 -11.716 -8.143 1055 HE22 GLN 140 2HE2 GLN 140 4.818 -12.917 -8.376 1056 H GLU 141 H GLU 141 6.518 -11.251 -4.647 1057 HA GLU 141 HA GLU 141 5.253 -13.878 -4.269 1058 HB2 GLU 141 2HB GLU 141 6.459 -14.840 -5.889 1059 HB3 GLU 141 1HB GLU 141 6.707 -13.188 -6.461 1060 HG2 GLU 141 2HG GLU 141 8.733 -13.187 -4.917 1061 HG3 GLU 141 1HG GLU 141 8.559 -14.937 -4.909 1062 H ARG 142 H ARG 142 7.982 -11.817 -3.443 1063 HA ARG 142 HA ARG 142 9.058 -13.748 -1.591 1064 HB2 ARG 142 2HB ARG 142 10.552 -11.780 -0.931 1065 HB3 ARG 142 1HB ARG 142 10.702 -12.397 -2.582 1066 HG2 ARG 142 2HG ARG 142 10.272 -10.389 -3.398 1067 HG3 ARG 142 1HG ARG 142 8.721 -10.352 -2.544 1068 HD2 ARG 142 2HD ARG 142 10.127 -8.435 -1.956 1069 HD3 ARG 142 1HD ARG 142 9.814 -9.471 -0.556 1070 HE ARG 142 HE ARG 142 12.361 -9.186 -1.986 1071 HH11 ARG 142 1HH1 ARG 142 10.556 -10.527 0.693 1072 HH12 ARG 142 2HH1 ARG 142 11.974 -10.980 1.575 1073 HH21 ARG 142 1HH2 ARG 142 14.215 -9.787 -0.821 1074 HH22 ARG 142 2HH2 ARG 142 14.047 -10.561 0.719 1075 H LEU 143 H LEU 143 6.698 -11.248 -1.464 1076 HA LEU 143 HA LEU 143 6.915 -10.962 1.420 1077 HB2 LEU 143 2HB LEU 143 6.163 -9.263 -0.601 1078 HB3 LEU 143 1HB LEU 143 4.614 -9.730 0.098 1079 HG LEU 143 HG LEU 143 5.470 -7.672 1.082 1080 HD11 LEU 143 1HD1 LEU 143 5.412 -8.398 3.482 1081 HD12 LEU 143 2HD1 LEU 143 5.395 -10.064 2.907 1082 HD13 LEU 143 3HD1 LEU 143 4.069 -8.977 2.495 1083 HD21 LEU 143 3HD2 LEU 143 7.701 -7.526 1.205 1084 HD22 LEU 143 1HD2 LEU 143 7.908 -9.273 1.305 1085 HD23 LEU 143 2HD2 LEU 143 7.512 -8.349 2.753 1086 H THR 144 H THR 144 5.054 -12.727 -0.905 1087 HA THR 144 HA THR 144 2.683 -13.176 0.460 1088 HB THR 144 HB THR 144 2.387 -15.077 -0.940 1089 HG1 THR 144 1HG THR 144 5.202 -15.066 -1.215 1090 HG21 THR 144 3HG2 THR 144 2.767 -14.275 -3.088 1091 HG22 THR 144 1HG2 THR 144 4.218 -13.399 -2.603 1092 HG23 THR 144 2HG2 THR 144 2.629 -12.825 -2.094 1093 H GLY 145 H GLY 145 2.445 -13.863 2.483 1094 HA2 GLY 145 2HA GLY 145 2.430 -15.636 4.063 1095 HA3 GLY 145 1HA GLY 145 3.882 -16.281 3.314 1096 H ASP 146 H ASP 146 5.417 -16.298 4.816 1097 HA ASP 146 HA ASP 146 5.878 -13.823 6.344 1098 HB2 ASP 146 2HB ASP 146 5.702 -16.643 7.267 1099 HB3 ASP 146 1HB ASP 146 6.936 -15.631 8.014 1100 H ALA 147 H ALA 147 7.036 -14.826 3.801 1101 HA ALA 147 HA ALA 147 9.720 -15.654 4.393 1102 HB1 ALA 147 1HB ALA 147 9.912 -16.048 2.186 1103 HB2 ALA 147 2HB ALA 147 9.177 -14.508 1.741 1104 HB3 ALA 147 3HB ALA 147 8.158 -15.873 2.197 1105 H PHE 148 H PHE 148 8.068 -12.637 4.004 1106 HA PHE 148 HA PHE 148 10.159 -10.956 3.257 1107 HB2 PHE 148 2HB PHE 148 8.845 -9.139 4.223 1108 HB3 PHE 148 1HB PHE 148 7.791 -10.260 3.350 1109 HD1 PHE 148 2HD PHE 148 6.355 -11.831 4.612 1110 HD2 PHE 148 1HD PHE 148 8.601 -8.779 6.546 1111 HE1 PHE 148 2HE PHE 148 4.953 -12.075 6.618 1112 HE2 PHE 148 1HE PHE 148 7.202 -9.018 8.556 1113 HZ PHE 148 HZ PHE 148 5.373 -10.667 8.593 1114 H ARG 149 H ARG 149 9.270 -12.231 6.416 1115 HA ARG 149 HA ARG 149 11.014 -10.620 7.941 1116 HB2 ARG 149 2HB ARG 149 9.730 -13.299 8.460 1117 HB3 ARG 149 1HB ARG 149 10.701 -12.456 9.654 1118 HG2 ARG 149 2HG ARG 149 9.067 -10.487 9.213 1119 HG3 ARG 149 1HG ARG 149 8.021 -11.749 8.558 1120 HD2 ARG 149 2HD ARG 149 7.625 -12.658 10.588 1121 HD3 ARG 149 1HD ARG 149 9.257 -12.329 11.171 1122 HE ARG 149 HE ARG 149 6.933 -10.664 11.476 1123 HH11 ARG 149 1HH1 ARG 149 10.422 -10.715 11.376 1124 HH12 ARG 149 2HH1 ARG 149 10.595 -9.263 12.304 1125 HH21 ARG 149 1HH2 ARG 149 7.159 -8.754 12.696 1126 HH22 ARG 149 2HH2 ARG 149 8.742 -8.150 13.054 1127 H LYS 150 H LYS 150 12.620 -12.071 9.439 1128 HA LYS 150 HA LYS 150 14.766 -12.751 7.656 1129 HB2 LYS 150 2HB LYS 150 14.432 -12.307 10.551 1130 HB3 LYS 150 1HB LYS 150 15.666 -13.484 10.125 1131 HG2 LYS 150 2HG LYS 150 17.025 -11.931 9.190 1132 HG3 LYS 150 1HG LYS 150 15.683 -10.927 8.639 1133 HD2 LYS 150 2HD LYS 150 15.340 -10.559 11.225 1134 HD3 LYS 150 1HD LYS 150 17.048 -10.998 11.287 1135 HE2 LYS 150 2HE LYS 150 16.215 -8.994 9.264 1136 HE3 LYS 150 1HE LYS 150 16.223 -8.488 10.952 1137 HZ1 LYS 150 3HZ LYS 150 18.526 -9.662 9.488 1138 HZ2 LYS 150 1HZ LYS 150 18.536 -9.176 11.108 1139 HZ3 LYS 150 2HZ LYS 150 18.337 -8.027 9.881 1140 H LYS 151 H LYS 151 15.680 -14.735 7.275 1141 HA LYS 151 HA LYS 151 15.789 -16.992 7.005 1142 HB2 LYS 151 2HB LYS 151 14.428 -16.995 9.704 1143 HB3 LYS 151 1HB LYS 151 15.126 -18.413 8.932 1144 HG2 LYS 151 2HG LYS 151 16.703 -15.943 9.613 1145 HG3 LYS 151 1HG LYS 151 16.554 -17.343 10.679 1146 HD2 LYS 151 2HD LYS 151 17.544 -17.557 7.845 1147 HD3 LYS 151 1HD LYS 151 18.622 -17.253 9.209 1148 HE2 LYS 151 2HE LYS 151 18.280 -19.344 10.119 1149 HE3 LYS 151 1HE LYS 151 16.714 -19.545 9.332 1150 HZ1 LYS 151 3HZ LYS 151 19.039 -19.345 7.586 1151 HZ2 LYS 151 1HZ LYS 151 17.659 -20.315 7.446 1152 HZ3 LYS 151 2HZ LYS 151 18.904 -20.762 8.499 1153 H HIS 152 H HIS 152 14.207 -19.084 7.304 1154 HA HIS 152 HA HIS 152 12.065 -18.573 5.499 1155 HB2 HIS 152 2HB HIS 152 12.850 -21.038 7.058 1156 HB3 HIS 152 1HB HIS 152 11.520 -21.000 5.903 1157 HD1 HIS 152 1HD HIS 152 15.079 -19.667 5.625 1158 HD2 HIS 152 2HD HIS 152 12.451 -22.243 3.694 1159 HE1 HIS 152 1HE HIS 152 16.299 -20.461 3.574 1160 HE2 HIS 152 2HE HIS 152 14.721 -22.080 2.466 1161 H LEU 153 H LEU 153 12.238 -19.328 8.952 1162 HA LEU 153 HA LEU 153 9.688 -18.051 9.384 1163 HB2 LEU 153 2HB LEU 153 8.725 -20.028 10.565 1164 HB3 LEU 153 1HB LEU 153 8.846 -20.206 8.824 1165 HG LEU 153 HG LEU 153 11.159 -21.252 10.308 1166 HD11 LEU 153 1HD1 LEU 153 8.403 -22.385 10.699 1167 HD12 LEU 153 2HD1 LEU 153 9.597 -21.958 11.924 1168 HD13 LEU 153 3HD1 LEU 153 9.865 -23.352 10.878 1169 HD21 LEU 153 3HD2 LEU 153 11.261 -21.891 8.134 1170 HD22 LEU 153 1HD2 LEU 153 9.508 -21.906 7.939 1171 HD23 LEU 153 2HD2 LEU 153 10.317 -23.246 8.752 1172 H GLU 154 H GLU 154 9.444 -17.311 11.458 1173 HA GLU 154 HA GLU 154 11.663 -17.899 13.306 1174 HB2 GLU 154 2HB GLU 154 11.351 -15.636 14.213 1175 HB3 GLU 154 1HB GLU 154 11.741 -15.601 12.499 1176 HG2 GLU 154 2HG GLU 154 10.014 -14.221 12.294 1177 HG3 GLU 154 1HG GLU 154 9.002 -15.651 12.486 1178 H ASP 155 H ASP 155 11.010 -17.295 15.652 1179 HA ASP 155 HA ASP 155 9.785 -17.820 17.494 1180 HB2 ASP 155 2HB ASP 155 8.141 -16.296 15.958 1181 HB3 ASP 155 1HB ASP 155 7.176 -17.762 16.108 1182 H GLU 156 H GLU 156 10.153 -19.880 18.044 1183 HA GLU 156 HA GLU 156 8.248 -21.891 17.183 1184 HB2 GLU 156 2HB GLU 156 10.237 -21.901 15.571 1185 HB3 GLU 156 1HB GLU 156 11.189 -22.504 16.933 1186 HG2 GLU 156 2HG GLU 156 10.535 -24.382 15.662 1187 HG3 GLU 156 1HG GLU 156 9.540 -24.384 17.117 1188 H LEU 157 H LEU 157 11.232 -21.298 19.022 1189 HA LEU 157 HA LEU 157 10.417 -23.259 21.019 1190 HB2 LEU 157 2HB LEU 157 12.929 -21.799 20.374 1191 HB3 LEU 157 1HB LEU 157 12.692 -22.323 22.031 1192 HG LEU 157 HG LEU 157 12.121 -24.480 20.192 1193 HD11 LEU 157 1HD1 LEU 157 14.756 -24.641 19.786 1194 HD12 LEU 157 2HD1 LEU 157 14.566 -22.888 19.723 1195 HD13 LEU 157 3HD1 LEU 157 13.648 -23.915 18.620 1196 HD21 LEU 157 3HD2 LEU 157 13.479 -25.718 21.657 1197 HD22 LEU 157 1HD2 LEU 157 12.670 -24.524 22.673 1198 HD23 LEU 157 2HD2 LEU 157 14.351 -24.282 22.196 Start of MODEL 18 1 H1 MET 1 1HT MET 1 -21.706 -19.118 1.377 2 H2 MET 1 2HT MET 1 -22.223 -19.241 -0.255 3 H3 MET 1 3HT MET 1 -21.825 -20.657 0.631 4 HA MET 1 HA MET 1 -24.091 -20.638 0.622 5 HB2 MET 1 2HB MET 1 -22.703 -19.735 3.062 6 HB3 MET 1 1HB MET 1 -24.449 -19.533 3.093 7 HG2 MET 1 2HG MET 1 -24.852 -21.778 3.054 8 HG3 MET 1 1HG MET 1 -23.350 -22.146 2.209 9 HE1 MET 1 2HE MET 1 -24.186 -22.169 6.627 10 HE2 MET 1 3HE MET 1 -25.293 -21.951 5.272 11 HE3 MET 1 1HE MET 1 -24.392 -20.575 5.904 12 H HIS 2 H HIS 2 -25.929 -19.607 0.094 13 HA HIS 2 HA HIS 2 -25.821 -16.792 -0.483 14 HB2 HIS 2 2HB HIS 2 -27.299 -18.989 -1.425 15 HB3 HIS 2 1HB HIS 2 -28.479 -17.915 -0.681 16 HD1 HIS 2 1HD HIS 2 -26.412 -18.342 -3.681 17 HD2 HIS 2 2HD HIS 2 -28.535 -15.272 -1.854 18 HE1 HIS 2 1HE HIS 2 -26.657 -16.557 -5.435 19 HE2 HIS 2 2HE HIS 2 -27.870 -14.675 -4.281 20 H HIS 3 H HIS 3 -26.705 -15.138 0.626 21 HA HIS 3 HA HIS 3 -28.606 -15.650 2.764 22 HB2 HIS 3 2HB HIS 3 -25.806 -14.680 3.207 23 HB3 HIS 3 1HB HIS 3 -27.099 -14.105 4.254 24 HD1 HIS 3 1HD HIS 3 -28.676 -16.457 4.983 25 HD2 HIS 3 2HD HIS 3 -24.563 -16.714 4.455 26 HE1 HIS 3 1HE HIS 3 -27.961 -18.504 6.255 27 HE2 HIS 3 2HE HIS 3 -25.457 -18.592 5.993 28 H HIS 4 H HIS 4 -26.535 -13.164 1.277 29 HA HIS 4 HA HIS 4 -28.860 -11.537 0.719 30 HB2 HIS 4 2HB HIS 4 -26.874 -10.844 2.830 31 HB3 HIS 4 1HB HIS 4 -27.471 -9.543 1.807 32 HD1 HIS 4 1HD HIS 4 -28.293 -11.447 4.777 33 HD2 HIS 4 2HD HIS 4 -30.408 -9.329 1.895 34 HE1 HIS 4 1HE HIS 4 -30.556 -11.017 5.786 35 HE2 HIS 4 2HE HIS 4 -31.787 -9.658 4.058 36 H HIS 5 H HIS 5 -28.527 -10.053 -0.922 37 HA HIS 5 HA HIS 5 -25.987 -10.362 -2.353 38 HB2 HIS 5 2HB HIS 5 -27.251 -9.435 -4.299 39 HB3 HIS 5 1HB HIS 5 -27.913 -10.943 -3.676 40 HD1 HIS 5 1HD HIS 5 -28.769 -7.427 -4.331 41 HD2 HIS 5 2HD HIS 5 -30.366 -10.620 -2.204 42 HE1 HIS 5 1HE HIS 5 -31.146 -6.778 -3.829 43 HE2 HIS 5 2HE HIS 5 -32.118 -8.762 -2.617 44 H HIS 6 H HIS 6 -24.767 -8.614 -3.017 45 HA HIS 6 HA HIS 6 -25.594 -5.976 -2.009 46 HB2 HIS 6 2HB HIS 6 -23.181 -5.553 -1.468 47 HB3 HIS 6 1HB HIS 6 -23.944 -6.780 -0.461 48 HD1 HIS 6 1HD HIS 6 -22.457 -8.705 -0.084 49 HD2 HIS 6 2HD HIS 6 -21.823 -6.990 -3.815 50 HE1 HIS 6 1HE HIS 6 -20.616 -10.054 -1.139 51 HE2 HIS 6 2HE HIS 6 -20.309 -9.051 -3.430 52 H HIS 7 H HIS 7 -24.390 -4.168 -3.047 53 HA HIS 7 HA HIS 7 -23.800 -2.993 -4.901 54 HB2 HIS 7 2HB HIS 7 -22.289 -5.509 -5.098 55 HB3 HIS 7 1HB HIS 7 -22.500 -4.669 -6.630 56 HD1 HIS 7 1HD HIS 7 -22.208 -1.765 -5.706 57 HD2 HIS 7 2HD HIS 7 -19.734 -4.856 -4.446 58 HE1 HIS 7 1HE HIS 7 -20.072 -0.659 -4.971 59 HE2 HIS 7 2HE HIS 7 -18.559 -2.557 -4.295 60 H MET 8 H MET 8 -25.491 -2.391 -6.088 61 HA MET 8 HA MET 8 -26.361 -4.111 -8.264 62 HB2 MET 8 2HB MET 8 -27.819 -4.539 -6.195 63 HB3 MET 8 1HB MET 8 -28.447 -2.907 -6.452 64 HG2 MET 8 2HG MET 8 -28.717 -3.977 -8.931 65 HG3 MET 8 1HG MET 8 -28.974 -5.393 -7.914 66 HE1 MET 8 3HE MET 8 -30.229 -4.689 -5.472 67 HE2 MET 8 1HE MET 8 -31.277 -5.742 -6.423 68 HE3 MET 8 2HE MET 8 -31.938 -4.295 -5.661 69 H SER 9 H SER 9 -25.807 -2.741 -9.860 70 HA SER 9 HA SER 9 -25.837 -0.933 -11.240 71 HB2 SER 9 2HB SER 9 -28.456 -1.227 -10.280 72 HB3 SER 9 1HB SER 9 -28.105 0.496 -10.140 73 HG SER 9 HG SER 9 -27.465 0.437 -12.355 74 H ASP 10 H ASP 10 -24.100 0.286 -10.780 75 HA ASP 10 HA ASP 10 -24.482 2.516 -8.919 76 HB2 ASP 10 2HB ASP 10 -22.159 2.193 -8.061 77 HB3 ASP 10 1HB ASP 10 -23.261 0.896 -7.613 78 H GLY 11 H GLY 11 -23.044 4.315 -9.293 79 HA2 GLY 11 2HA GLY 11 -22.049 4.365 -12.075 80 HA3 GLY 11 1HA GLY 11 -22.730 5.757 -11.249 81 H HIS 12 H HIS 12 -21.523 6.599 -9.380 82 HA HIS 12 HA HIS 12 -18.734 6.799 -10.016 83 HB2 HIS 12 2HB HIS 12 -18.650 8.349 -8.078 84 HB3 HIS 12 1HB HIS 12 -19.923 8.768 -9.234 85 HD1 HIS 12 1HD HIS 12 -19.360 7.745 -5.719 86 HD2 HIS 12 2HD HIS 12 -22.569 8.272 -8.306 87 HE1 HIS 12 1HE HIS 12 -21.405 7.773 -4.256 88 HE2 HIS 12 2HE HIS 12 -23.325 8.188 -5.834 89 H ASN 13 H ASN 13 -16.993 5.995 -8.913 90 HA ASN 13 HA ASN 13 -17.501 4.359 -6.534 91 HB2 ASN 13 2HB ASN 13 -16.571 3.409 -9.166 92 HB3 ASN 13 1HB ASN 13 -15.622 2.843 -7.795 93 HD21 ASN 13 1HD2 ASN 13 -17.326 1.331 -9.574 94 HD22 ASN 13 2HD2 ASN 13 -18.532 0.586 -8.584 95 H GLY 14 H GLY 14 -14.817 5.272 -8.715 96 HA2 GLY 14 2HA GLY 14 -12.744 6.153 -8.267 97 HA3 GLY 14 1HA GLY 14 -13.506 6.934 -6.878 98 H LEU 15 H LEU 15 -11.753 4.115 -7.995 99 HA LEU 15 HA LEU 15 -11.532 3.072 -5.284 100 HB2 LEU 15 2HB LEU 15 -11.524 1.934 -7.864 101 HB3 LEU 15 1HB LEU 15 -9.929 1.657 -7.196 102 HG LEU 15 HG LEU 15 -11.491 0.920 -5.095 103 HD11 LEU 15 1HD1 LEU 15 -13.458 -0.071 -5.708 104 HD12 LEU 15 2HD1 LEU 15 -12.940 -0.325 -7.375 105 HD13 LEU 15 3HD1 LEU 15 -13.428 1.284 -6.838 106 HD21 LEU 15 3HD2 LEU 15 -10.392 -0.667 -7.396 107 HD22 LEU 15 1HD2 LEU 15 -11.145 -1.435 -5.998 108 HD23 LEU 15 2HD2 LEU 15 -9.704 -0.438 -5.788 109 H GLY 16 H GLY 16 -9.192 3.742 -7.915 110 HA2 GLY 16 2HA GLY 16 -7.049 3.971 -5.987 111 HA3 GLY 16 1HA GLY 16 -6.904 4.162 -7.732 112 H LYS 17 H LYS 17 -9.433 6.061 -6.649 113 HA LYS 17 HA LYS 17 -9.722 8.304 -6.451 114 HB2 LYS 17 2HB LYS 17 -8.008 7.544 -4.456 115 HB3 LYS 17 1HB LYS 17 -7.100 8.835 -5.234 116 HG2 LYS 17 2HG LYS 17 -9.960 9.181 -4.394 117 HG3 LYS 17 1HG LYS 17 -8.611 9.473 -3.296 118 HD2 LYS 17 2HD LYS 17 -8.776 11.573 -4.122 119 HD3 LYS 17 1HD LYS 17 -7.780 10.897 -5.415 120 HE2 LYS 17 2HE LYS 17 -10.177 10.246 -6.372 121 HE3 LYS 17 1HE LYS 17 -10.652 11.646 -5.412 122 HZ1 LYS 17 3HZ LYS 17 -8.309 12.017 -7.078 123 HZ2 LYS 17 1HZ LYS 17 -9.618 13.053 -6.799 124 HZ3 LYS 17 2HZ LYS 17 -9.759 11.794 -7.920 125 H GLY 18 H GLY 18 -8.507 7.366 -8.883 126 HA2 GLY 18 2HA GLY 18 -7.962 8.685 -10.777 127 HA3 GLY 18 1HA GLY 18 -7.259 9.889 -9.695 128 H PHE 19 H PHE 19 -6.557 6.452 -9.505 129 HA PHE 19 HA PHE 19 -3.777 7.081 -10.176 130 HB2 PHE 19 2HB PHE 19 -4.641 5.841 -7.982 131 HB3 PHE 19 1HB PHE 19 -4.503 4.431 -9.043 132 HD1 PHE 19 2HD PHE 19 -2.152 5.204 -10.658 133 HD2 PHE 19 1HD PHE 19 -2.873 5.570 -6.482 134 HE1 PHE 19 2HE PHE 19 0.271 5.125 -10.232 135 HE2 PHE 19 1HE PHE 19 -0.448 5.495 -6.061 136 HZ PHE 19 HZ PHE 19 1.122 5.264 -7.933 137 H GLY 20 H GLY 20 -5.790 4.158 -10.508 138 HA2 GLY 20 2HA GLY 20 -5.078 4.077 -13.359 139 HA3 GLY 20 1HA GLY 20 -4.664 2.693 -12.348 140 H ASP 21 H ASP 21 -6.569 1.843 -11.011 141 HA ASP 21 HA ASP 21 -9.218 2.238 -11.867 142 HB2 ASP 21 2HB ASP 21 -7.617 0.268 -13.389 143 HB3 ASP 21 1HB ASP 21 -9.205 -0.295 -12.845 144 H HIS 22 H HIS 22 -8.002 -1.029 -11.427 145 HA HIS 22 HA HIS 22 -8.835 -0.956 -8.608 146 HB2 HIS 22 2HB HIS 22 -9.852 -3.205 -8.903 147 HB3 HIS 22 1HB HIS 22 -10.674 -1.957 -9.835 148 HD1 HIS 22 1HD HIS 22 -8.851 -5.144 -10.173 149 HD2 HIS 22 2HD HIS 22 -10.203 -2.102 -12.659 150 HE1 HIS 22 1HE HIS 22 -8.746 -6.083 -12.504 151 HE2 HIS 22 2HE HIS 22 -9.668 -4.261 -13.978 152 H ILE 23 H ILE 23 -6.808 -1.059 -7.761 153 HA ILE 23 HA ILE 23 -5.411 -3.568 -7.954 154 HB ILE 23 HB ILE 23 -4.081 -0.993 -8.805 155 HG12 ILE 23 2HG1 ILE 23 -3.494 -2.770 -10.741 156 HG13 ILE 23 1HG1 ILE 23 -5.060 -3.392 -10.242 157 HG21 ILE 23 1HG2 ILE 23 -2.662 -2.352 -7.314 158 HG22 ILE 23 2HG2 ILE 23 -2.021 -2.208 -8.949 159 HG23 ILE 23 3HG2 ILE 23 -2.817 -3.698 -8.444 160 HD11 ILE 23 3HD1 ILE 23 -6.133 -1.745 -11.278 161 HD12 ILE 23 1HD1 ILE 23 -4.591 -1.358 -12.040 162 HD13 ILE 23 2HD1 ILE 23 -5.083 -0.515 -10.571 163 H HIS 24 H HIS 24 -3.996 -0.458 -7.031 164 HA HIS 24 HA HIS 24 -3.553 -1.485 -4.368 165 HB2 HIS 24 2HB HIS 24 -2.682 1.262 -5.158 166 HB3 HIS 24 1HB HIS 24 -1.876 0.097 -4.109 167 HD1 HIS 24 1HD HIS 24 0.137 -0.920 -5.103 168 HD2 HIS 24 2HD HIS 24 -2.543 0.321 -8.024 169 HE1 HIS 24 1HE HIS 24 1.274 -1.378 -7.296 170 HE2 HIS 24 2HE HIS 24 -0.337 -0.554 -9.048 171 H TRP 25 H TRP 25 -6.199 -0.963 -4.977 172 HA TRP 25 HA TRP 25 -6.902 0.841 -2.829 173 HB2 TRP 25 2HB TRP 25 -8.656 1.701 -4.783 174 HB3 TRP 25 1HB TRP 25 -7.218 2.575 -4.237 175 HD1 TRP 25 HD TRP 25 -8.512 0.476 -7.127 176 HE1 TRP 25 1HE TRP 25 -6.839 0.592 -9.057 177 HE3 TRP 25 3HE TRP 25 -4.736 2.979 -4.794 178 HZ2 TRP 25 2HZ TRP 25 -4.266 1.644 -9.559 179 HZ3 TRP 25 3HZ TRP 25 -2.714 3.497 -6.047 180 HH2 TRP 25 HH TRP 25 -2.470 2.850 -8.392 181 H ARG 26 H ARG 26 -7.189 -2.003 -4.250 182 HA ARG 26 HA ARG 26 -9.783 -2.622 -4.748 183 HB2 ARG 26 2HB ARG 26 -7.453 -4.103 -3.714 184 HB3 ARG 26 1HB ARG 26 -9.016 -4.838 -3.339 185 HG2 ARG 26 2HG ARG 26 -9.016 -4.037 -6.073 186 HG3 ARG 26 1HG ARG 26 -7.545 -4.956 -5.750 187 HD2 ARG 26 2HD ARG 26 -10.105 -6.008 -4.669 188 HD3 ARG 26 1HD ARG 26 -9.831 -6.132 -6.414 189 HE ARG 26 HE ARG 26 -7.616 -7.069 -4.847 190 HH11 ARG 26 1HH1 ARG 26 -10.708 -7.946 -6.208 191 HH12 ARG 26 2HH1 ARG 26 -10.350 -9.640 -6.248 192 HH21 ARG 26 1HH2 ARG 26 -7.144 -9.296 -4.898 193 HH22 ARG 26 2HH2 ARG 26 -8.328 -10.407 -5.503 194 H THR 27 H THR 27 -8.308 -1.877 -1.683 195 HA THR 27 HA THR 27 -9.429 -1.053 0.184 196 HB THR 27 HB THR 27 -11.855 -2.694 -0.508 197 HG1 THR 27 1HG THR 27 -11.106 -0.138 -1.448 198 HG21 THR 27 3HG2 THR 27 -11.212 -0.655 1.481 199 HG22 THR 27 1HG2 THR 27 -12.470 -1.890 1.477 200 HG23 THR 27 2HG2 THR 27 -12.718 -0.376 0.606 201 H LEU 28 H LEU 28 -9.638 -1.890 2.269 202 HA LEU 28 HA LEU 28 -8.339 -4.375 2.679 203 HB2 LEU 28 2HB LEU 28 -8.066 -2.532 4.235 204 HB3 LEU 28 1HB LEU 28 -9.791 -2.558 4.606 205 HG LEU 28 HG LEU 28 -8.169 -5.017 5.115 206 HD11 LEU 28 1HD1 LEU 28 -8.343 -2.777 7.109 207 HD12 LEU 28 2HD1 LEU 28 -6.950 -3.005 6.052 208 HD13 LEU 28 3HD1 LEU 28 -7.396 -4.261 7.206 209 HD21 LEU 28 3HD2 LEU 28 -9.882 -4.628 7.196 210 HD22 LEU 28 1HD2 LEU 28 -10.243 -5.576 5.754 211 HD23 LEU 28 2HD2 LEU 28 -10.769 -3.895 5.859 212 H GLU 29 H GLU 29 -11.667 -3.444 2.434 213 HA GLU 29 HA GLU 29 -12.907 -5.481 3.878 214 HB2 GLU 29 2HB GLU 29 -13.955 -3.437 2.736 215 HB3 GLU 29 1HB GLU 29 -13.976 -4.409 1.273 216 HG2 GLU 29 2HG GLU 29 -15.104 -5.866 3.485 217 HG3 GLU 29 1HG GLU 29 -15.910 -4.312 3.271 218 H ASP 30 H ASP 30 -12.555 -5.418 0.330 219 HA ASP 30 HA ASP 30 -12.875 -8.283 0.199 220 HB2 ASP 30 2HB ASP 30 -13.544 -6.307 -1.515 221 HB3 ASP 30 1HB ASP 30 -11.993 -6.798 -2.210 222 H GLY 31 H GLY 31 -10.264 -6.035 0.340 223 HA2 GLY 31 2HA GLY 31 -8.298 -7.710 -0.904 224 HA3 GLY 31 1HA GLY 31 -7.987 -6.263 0.060 225 H LYS 32 H LYS 32 -9.412 -7.232 2.399 226 HA LYS 32 HA LYS 32 -7.266 -8.755 3.555 227 HB2 LYS 32 2HB LYS 32 -8.569 -6.924 4.727 228 HB3 LYS 32 1HB LYS 32 -9.903 -8.062 4.847 229 HG2 LYS 32 2HG LYS 32 -8.393 -9.605 6.085 230 HG3 LYS 32 1HG LYS 32 -7.169 -8.333 6.075 231 HD2 LYS 32 2HD LYS 32 -9.149 -6.901 7.075 232 HD3 LYS 32 1HD LYS 32 -9.741 -8.490 7.567 233 HE2 LYS 32 2HE LYS 32 -7.472 -8.896 8.578 234 HE3 LYS 32 1HE LYS 32 -7.114 -7.196 8.276 235 HZ1 LYS 32 3HZ LYS 32 -8.808 -8.399 10.292 236 HZ2 LYS 32 1HZ LYS 32 -9.459 -7.026 9.549 237 HZ3 LYS 32 2HZ LYS 32 -7.957 -6.938 10.324 238 H LYS 33 H LYS 33 -10.743 -9.320 3.034 239 HA LYS 33 HA LYS 33 -10.832 -11.933 4.013 240 HB2 LYS 33 2HB LYS 33 -12.869 -12.177 2.590 241 HB3 LYS 33 1HB LYS 33 -12.871 -10.734 3.594 242 HG2 LYS 33 2HG LYS 33 -13.588 -9.832 1.638 243 HG3 LYS 33 1HG LYS 33 -11.838 -9.646 1.421 244 HD2 LYS 33 2HD LYS 33 -12.161 -10.709 -0.527 245 HD3 LYS 33 1HD LYS 33 -12.276 -12.169 0.457 246 HE2 LYS 33 2HE LYS 33 -14.619 -12.147 0.418 247 HE3 LYS 33 1HE LYS 33 -14.680 -10.465 -0.108 248 HZ1 LYS 33 3HZ LYS 33 -13.900 -12.834 -1.706 249 HZ2 LYS 33 1HZ LYS 33 -13.611 -11.249 -2.220 250 HZ3 LYS 33 2HZ LYS 33 -15.197 -11.782 -1.974 251 H GLU 34 H GLU 34 -9.646 -10.676 1.001 252 HA GLU 34 HA GLU 34 -9.490 -13.335 -0.189 253 HB2 GLU 34 2HB GLU 34 -10.203 -11.306 -1.515 254 HB3 GLU 34 1HB GLU 34 -8.545 -10.721 -1.371 255 HG2 GLU 34 2HG GLU 34 -7.820 -12.058 -2.991 256 HG3 GLU 34 1HG GLU 34 -8.692 -13.458 -2.344 257 H ALA 35 H ALA 35 -7.395 -10.766 1.025 258 HA ALA 35 HA ALA 35 -4.922 -11.771 0.236 259 HB1 ALA 35 1HB ALA 35 -4.925 -9.602 1.114 260 HB2 ALA 35 2HB ALA 35 -4.073 -10.561 2.325 261 HB3 ALA 35 3HB ALA 35 -5.757 -10.101 2.586 262 H ALA 36 H ALA 36 -7.051 -12.763 2.810 263 HA ALA 36 HA ALA 36 -5.190 -14.261 4.323 264 HB1 ALA 36 1HB ALA 36 -7.226 -13.661 5.370 265 HB2 ALA 36 2HB ALA 36 -7.259 -15.416 5.193 266 HB3 ALA 36 3HB ALA 36 -8.186 -14.401 4.088 267 H ALA 37 H ALA 37 -7.362 -15.113 1.660 268 HA ALA 37 HA ALA 37 -6.997 -17.872 1.650 269 HB1 ALA 37 1HB ALA 37 -7.294 -17.374 -0.984 270 HB2 ALA 37 2HB ALA 37 -7.873 -15.852 -0.308 271 HB3 ALA 37 3HB ALA 37 -8.624 -17.373 0.172 272 H SER 38 H SER 38 -5.502 -15.776 -0.804 273 HA SER 38 HA SER 38 -3.448 -17.632 -1.384 274 HB2 SER 38 2HB SER 38 -3.966 -14.766 -2.115 275 HB3 SER 38 1HB SER 38 -2.409 -15.511 -2.514 276 HG SER 38 HG SER 38 -4.952 -16.544 -3.252 277 H GLY 39 H GLY 39 -3.738 -15.032 0.903 278 HA2 GLY 39 2HA GLY 39 -2.415 -14.673 2.783 279 HA3 GLY 39 1HA GLY 39 -1.251 -15.843 2.156 280 H LEU 40 H LEU 40 -2.398 -13.184 0.199 281 HA LEU 40 HA LEU 40 0.325 -12.162 0.094 282 HB2 LEU 40 2HB LEU 40 -0.375 -10.888 -1.827 283 HB3 LEU 40 1HB LEU 40 -0.908 -12.546 -2.006 284 HG LEU 40 HG LEU 40 -3.178 -11.683 -1.099 285 HD11 LEU 40 1HD1 LEU 40 -3.162 -9.540 -0.484 286 HD12 LEU 40 2HD1 LEU 40 -3.164 -9.173 -2.205 287 HD13 LEU 40 3HD1 LEU 40 -1.641 -9.227 -1.319 288 HD21 LEU 40 3HD2 LEU 40 -3.862 -11.842 -3.215 289 HD22 LEU 40 1HD2 LEU 40 -2.164 -12.084 -3.626 290 HD23 LEU 40 2HD2 LEU 40 -2.876 -10.471 -3.725 291 HA PRO 41 HA PRO 41 -0.545 -8.951 3.041 292 HB2 PRO 41 2HB PRO 41 1.645 -7.463 1.744 293 HB3 PRO 41 1HB PRO 41 1.494 -8.014 3.414 294 HG2 PRO 41 2HG PRO 41 3.189 -9.162 1.690 295 HG3 PRO 41 1HG PRO 41 2.362 -10.093 2.949 296 HD2 PRO 41 2HD PRO 41 1.780 -9.919 0.022 297 HD3 PRO 41 1HD PRO 41 1.684 -11.317 1.112 298 H LEU 42 H LEU 42 -0.154 -6.279 2.726 299 HA LEU 42 HA LEU 42 -1.519 -5.530 0.263 300 HB2 LEU 42 2HB LEU 42 -3.317 -4.423 1.309 301 HB3 LEU 42 1HB LEU 42 -3.226 -6.010 2.050 302 HG LEU 42 HG LEU 42 -2.053 -3.532 3.303 303 HD11 LEU 42 1HD1 LEU 42 -4.067 -3.701 4.814 304 HD12 LEU 42 2HD1 LEU 42 -4.778 -4.765 3.601 305 HD13 LEU 42 3HD1 LEU 42 -4.372 -3.100 3.185 306 HD21 LEU 42 3HD2 LEU 42 -2.417 -6.373 4.130 307 HD22 LEU 42 1HD2 LEU 42 -2.446 -5.100 5.347 308 HD23 LEU 42 2HD2 LEU 42 -1.022 -5.312 4.331 309 H MET 43 H MET 43 -1.120 -3.536 -0.474 310 HA MET 43 HA MET 43 0.923 -1.994 0.956 311 HB2 MET 43 2HB MET 43 1.678 -2.368 -1.225 312 HB3 MET 43 1HB MET 43 0.062 -2.204 -1.914 313 HG2 MET 43 2HG MET 43 0.356 -0.044 -2.312 314 HG3 MET 43 1HG MET 43 0.968 0.260 -0.691 315 HE1 MET 43 3HE MET 43 3.128 -1.356 -0.216 316 HE2 MET 43 1HE MET 43 3.955 0.201 -0.226 317 HE3 MET 43 2HE MET 43 4.607 -1.149 -1.157 318 H VAL 44 H VAL 44 0.638 0.297 1.240 319 HA VAL 44 HA VAL 44 -2.188 1.113 1.155 320 HB VAL 44 HB VAL 44 -1.425 0.725 3.455 321 HG11 VAL 44 1HG1 VAL 44 0.678 1.206 3.970 322 HG12 VAL 44 2HG1 VAL 44 0.196 2.902 4.018 323 HG13 VAL 44 3HG1 VAL 44 0.865 2.216 2.541 324 HG21 VAL 44 3HG2 VAL 44 -2.251 2.740 4.384 325 HG22 VAL 44 1HG2 VAL 44 -3.094 2.488 2.854 326 HG23 VAL 44 2HG2 VAL 44 -1.779 3.661 2.957 327 H ILE 45 H ILE 45 -1.473 1.876 -1.032 328 HA ILE 45 HA ILE 45 0.328 4.028 -1.324 329 HB ILE 45 HB ILE 45 -2.028 3.278 -3.058 330 HG12 ILE 45 2HG1 ILE 45 0.836 2.367 -2.951 331 HG13 ILE 45 1HG1 ILE 45 -0.639 1.397 -3.042 332 HG21 ILE 45 1HG2 ILE 45 -0.616 5.609 -3.164 333 HG22 ILE 45 2HG2 ILE 45 -1.459 4.864 -4.519 334 HG23 ILE 45 3HG2 ILE 45 0.268 4.593 -4.300 335 HD11 ILE 45 3HD1 ILE 45 0.517 1.259 -5.127 336 HD12 ILE 45 1HD1 ILE 45 0.608 3.015 -5.253 337 HD13 ILE 45 2HD1 ILE 45 -0.953 2.203 -5.366 338 H ILE 46 H ILE 46 0.119 6.107 -0.733 339 HA ILE 46 HA ILE 46 -2.589 7.236 -0.530 340 HB ILE 46 HB ILE 46 -0.463 7.869 1.502 341 HG12 ILE 46 2HG1 ILE 46 -2.708 6.152 2.345 342 HG13 ILE 46 1HG1 ILE 46 -1.534 5.368 1.298 343 HG21 ILE 46 1HG2 ILE 46 -2.404 9.421 1.088 344 HG22 ILE 46 2HG2 ILE 46 -2.212 8.855 2.748 345 HG23 ILE 46 3HG2 ILE 46 -3.446 8.144 1.711 346 HD11 ILE 46 3HD1 ILE 46 -1.283 5.361 3.910 347 HD12 ILE 46 1HD1 ILE 46 -0.534 6.929 3.611 348 HD13 ILE 46 2HD1 ILE 46 0.124 5.480 2.852 349 H HIS 47 H HIS 47 -2.746 9.494 -0.875 350 HA HIS 47 HA HIS 47 -0.275 10.858 -1.702 351 HB2 HIS 47 2HB HIS 47 -2.754 10.996 -3.412 352 HB3 HIS 47 1HB HIS 47 -1.129 11.576 -3.796 353 HD1 HIS 47 1HD HIS 47 0.254 10.054 -5.166 354 HD2 HIS 47 2HD HIS 47 -2.860 8.052 -3.281 355 HE1 HIS 47 1HE HIS 47 0.313 7.712 -6.077 356 HE2 HIS 47 2HE HIS 47 -1.715 6.599 -5.085 357 H LYS 48 H LYS 48 -0.240 12.483 -0.230 358 HA LYS 48 HA LYS 48 -2.688 14.146 -0.102 359 HB2 LYS 48 2HB LYS 48 -1.173 12.935 2.060 360 HB3 LYS 48 1HB LYS 48 -1.370 14.666 2.272 361 HG2 LYS 48 2HG LYS 48 -3.773 14.455 2.080 362 HG3 LYS 48 1HG LYS 48 -3.621 12.728 1.766 363 HD2 LYS 48 2HD LYS 48 -4.268 13.387 4.120 364 HD3 LYS 48 1HD LYS 48 -2.896 12.294 3.975 365 HE2 LYS 48 2HE LYS 48 -2.382 13.968 5.615 366 HE3 LYS 48 1HE LYS 48 -1.383 14.252 4.192 367 HZ1 LYS 48 3HZ LYS 48 -2.170 16.345 4.770 368 HZ2 LYS 48 1HZ LYS 48 -3.727 15.785 5.129 369 HZ3 LYS 48 2HZ LYS 48 -3.211 15.880 3.520 370 H SER 49 H SER 49 -2.448 16.377 0.251 371 HA SER 49 HA SER 49 -1.611 18.413 -0.321 372 HB2 SER 49 2HB SER 49 0.119 17.198 1.608 373 HB3 SER 49 1HB SER 49 1.086 18.200 0.526 374 HG SER 49 HG SER 49 -1.227 19.017 1.956 375 H TRP 50 H TRP 50 0.878 19.336 -1.060 376 HA TRP 50 HA TRP 50 0.968 19.096 -3.767 377 HB2 TRP 50 2HB TRP 50 3.519 19.320 -2.166 378 HB3 TRP 50 1HB TRP 50 3.141 20.048 -3.733 379 HD1 TRP 50 HD TRP 50 1.364 22.147 -3.675 380 HE1 TRP 50 1HE TRP 50 0.961 23.909 -1.842 381 HE3 TRP 50 3HE TRP 50 3.513 19.716 0.277 382 HZ2 TRP 50 2HZ TRP 50 1.484 24.226 0.913 383 HZ3 TRP 50 3HZ TRP 50 3.520 20.818 2.477 384 HH2 TRP 50 HH TRP 50 2.526 23.027 2.787 385 H CYS 51 H CYS 51 0.756 17.133 -4.703 386 HA CYS 51 HA CYS 51 2.967 15.242 -4.294 387 HB2 CYS 51 2HB CYS 51 1.405 13.956 -3.276 388 HB3 CYS 51 1HB CYS 51 0.066 14.839 -3.989 389 H GLY 52 H GLY 52 3.873 14.409 -6.117 390 HA2 GLY 52 2HA GLY 52 2.709 15.271 -8.693 391 HA3 GLY 52 1HA GLY 52 4.414 14.896 -8.430 392 H ALA 53 H ALA 53 3.703 12.517 -6.819 393 HA ALA 53 HA ALA 53 3.800 10.580 -8.835 394 HB1 ALA 53 1HB ALA 53 3.578 8.951 -7.107 395 HB2 ALA 53 2HB ALA 53 2.834 10.124 -6.021 396 HB3 ALA 53 3HB ALA 53 4.537 10.280 -6.455 397 H CYS 54 H CYS 54 1.219 12.407 -7.699 398 HA CYS 54 HA CYS 54 -0.746 10.451 -8.477 399 HB2 CYS 54 2HB CYS 54 -2.330 12.471 -7.863 400 HB3 CYS 54 1HB CYS 54 -1.597 11.470 -6.605 401 H LYS 55 H LYS 55 0.474 13.587 -9.494 402 HA LYS 55 HA LYS 55 -1.365 13.843 -11.661 403 HB2 LYS 55 2HB LYS 55 -0.113 15.753 -12.327 404 HB3 LYS 55 1HB LYS 55 -0.182 15.760 -10.572 405 HG2 LYS 55 2HG LYS 55 2.084 14.783 -10.520 406 HG3 LYS 55 1HG LYS 55 2.151 14.927 -12.285 407 HD2 LYS 55 2HD LYS 55 1.450 17.337 -10.680 408 HD3 LYS 55 1HD LYS 55 3.131 16.804 -10.697 409 HE2 LYS 55 2HE LYS 55 2.369 18.521 -12.452 410 HE3 LYS 55 1HE LYS 55 3.353 17.161 -12.984 411 HZ1 LYS 55 3HZ LYS 55 1.308 16.043 -13.691 412 HZ2 LYS 55 1HZ LYS 55 1.523 17.518 -14.488 413 HZ3 LYS 55 2HZ LYS 55 0.402 17.394 -13.228 414 H ALA 56 H ALA 56 1.779 12.346 -11.243 415 HA ALA 56 HA ALA 56 2.207 12.025 -14.082 416 HB1 ALA 56 1HB ALA 56 4.271 11.990 -13.212 417 HB2 ALA 56 2HB ALA 56 3.942 10.285 -12.904 418 HB3 ALA 56 3HB ALA 56 3.699 11.475 -11.624 419 H LEU 57 H LEU 57 1.113 9.962 -11.410 420 HA LEU 57 HA LEU 57 1.091 7.544 -12.810 421 HB2 LEU 57 2HB LEU 57 -0.589 6.805 -11.144 422 HB3 LEU 57 1HB LEU 57 0.879 7.472 -10.460 423 HG LEU 57 HG LEU 57 -0.397 9.644 -10.161 424 HD11 LEU 57 1HD1 LEU 57 -2.972 8.817 -9.890 425 HD12 LEU 57 2HD1 LEU 57 -2.478 7.961 -11.352 426 HD13 LEU 57 3HD1 LEU 57 -2.347 9.715 -11.269 427 HD21 LEU 57 3HD2 LEU 57 0.033 7.686 -8.470 428 HD22 LEU 57 1HD2 LEU 57 -1.710 7.483 -8.593 429 HD23 LEU 57 2HD2 LEU 57 -1.045 9.010 -8.044 430 H LYS 58 H LYS 58 -1.227 10.177 -12.821 431 HA LYS 58 HA LYS 58 -3.494 8.913 -13.699 432 HB2 LYS 58 2HB LYS 58 -2.403 11.607 -13.907 433 HB3 LYS 58 1HB LYS 58 -3.465 11.204 -15.250 434 HG2 LYS 58 2HG LYS 58 -5.246 11.532 -13.982 435 HG3 LYS 58 1HG LYS 58 -4.679 10.330 -12.822 436 HD2 LYS 58 2HD LYS 58 -4.907 12.309 -11.577 437 HD3 LYS 58 1HD LYS 58 -3.178 12.178 -11.900 438 HE2 LYS 58 2HE LYS 58 -3.319 13.792 -13.664 439 HE3 LYS 58 1HE LYS 58 -5.080 13.809 -13.573 440 HZ1 LYS 58 3HZ LYS 58 -3.493 15.576 -12.344 441 HZ2 LYS 58 1HZ LYS 58 -3.720 14.452 -11.100 442 HZ3 LYS 58 2HZ LYS 58 -5.057 15.192 -11.826 443 HA PRO 59 HA PRO 59 -2.300 8.994 -18.314 444 HB2 PRO 59 2HB PRO 59 -0.053 10.185 -19.167 445 HB3 PRO 59 1HB PRO 59 -1.528 11.105 -18.807 446 HG2 PRO 59 2HG PRO 59 0.914 10.700 -17.113 447 HG3 PRO 59 1HG PRO 59 0.005 12.189 -17.426 448 HD2 PRO 59 2HD PRO 59 -0.309 10.692 -15.166 449 HD3 PRO 59 1HD PRO 59 -1.606 11.685 -15.875 450 H LYS 60 H LYS 60 0.389 8.401 -16.122 451 HA LYS 60 HA LYS 60 1.515 6.468 -18.007 452 HB2 LYS 60 2HB LYS 60 3.465 6.421 -16.694 453 HB3 LYS 60 1HB LYS 60 2.961 8.108 -16.710 454 HG2 LYS 60 2HG LYS 60 1.725 7.437 -14.524 455 HG3 LYS 60 1HG LYS 60 2.902 6.130 -14.484 456 HD2 LYS 60 2HD LYS 60 3.451 9.102 -14.521 457 HD3 LYS 60 1HD LYS 60 3.797 7.964 -13.217 458 HE2 LYS 60 2HE LYS 60 5.855 7.898 -14.097 459 HE3 LYS 60 1HE LYS 60 5.136 6.845 -15.313 460 HZ1 LYS 60 3HZ LYS 60 6.458 8.728 -16.218 461 HZ2 LYS 60 1HZ LYS 60 5.306 9.795 -15.585 462 HZ3 LYS 60 2HZ LYS 60 4.862 8.679 -16.777 463 H PHE 61 H PHE 61 0.331 6.532 -14.630 464 HA PHE 61 HA PHE 61 0.525 3.731 -14.326 465 HB2 PHE 61 2HB PHE 61 0.378 5.348 -12.410 466 HB3 PHE 61 1HB PHE 61 -1.332 5.554 -12.801 467 HD1 PHE 61 2HD PHE 61 -2.893 3.656 -12.588 468 HD2 PHE 61 1HD PHE 61 1.146 3.396 -11.274 469 HE1 PHE 61 2HE PHE 61 -3.457 1.665 -11.258 470 HE2 PHE 61 1HE PHE 61 0.586 1.404 -9.941 471 HZ PHE 61 HZ PHE 61 -1.719 0.538 -9.929 472 H ALA 62 H ALA 62 -1.655 5.756 -16.017 473 HA ALA 62 HA ALA 62 -3.985 4.204 -15.950 474 HB1 ALA 62 1HB ALA 62 -2.898 6.324 -17.587 475 HB2 ALA 62 2HB ALA 62 -4.584 5.912 -17.272 476 HB3 ALA 62 3HB ALA 62 -3.713 5.122 -18.589 477 H GLU 63 H GLU 63 -0.864 3.703 -17.176 478 HA GLU 63 HA GLU 63 -1.290 1.710 -19.144 479 HB2 GLU 63 2HB GLU 63 0.773 3.176 -18.768 480 HB3 GLU 63 1HB GLU 63 1.159 2.109 -17.415 481 HG2 GLU 63 2HG GLU 63 2.195 0.750 -18.819 482 HG3 GLU 63 1HG GLU 63 0.662 0.441 -19.633 483 H SER 64 H SER 64 -1.552 1.735 -15.785 484 HA SER 64 HA SER 64 -0.725 -0.825 -15.068 485 HB2 SER 64 2HB SER 64 -2.734 1.091 -13.955 486 HB3 SER 64 1HB SER 64 -2.510 -0.491 -13.228 487 HG SER 64 HG SER 64 -0.651 1.621 -13.466 488 H THR 65 H THR 65 -2.845 -0.232 -17.438 489 HA THR 65 HA THR 65 -5.157 -1.639 -17.002 490 HB THR 65 HB THR 65 -4.821 -2.406 -19.471 491 HG1 THR 65 1HG THR 65 -3.184 -1.314 -20.542 492 HG21 THR 65 3HG2 THR 65 -5.194 -0.138 -20.354 493 HG22 THR 65 1HG2 THR 65 -4.822 0.514 -18.759 494 HG23 THR 65 2HG2 THR 65 -6.229 -0.526 -18.979 495 H GLU 66 H GLU 66 -1.913 -2.808 -17.620 496 HA GLU 66 HA GLU 66 -2.712 -5.583 -17.555 497 HB2 GLU 66 2HB GLU 66 -0.357 -6.093 -17.788 498 HB3 GLU 66 1HB GLU 66 -0.786 -4.818 -18.932 499 HG2 GLU 66 2HG GLU 66 0.077 -3.709 -16.426 500 HG3 GLU 66 1HG GLU 66 1.292 -4.805 -17.081 501 H ILE 67 H ILE 67 -1.538 -3.134 -15.378 502 HA ILE 67 HA ILE 67 -0.875 -4.972 -13.274 503 HB ILE 67 HB ILE 67 -1.535 -2.033 -13.068 504 HG12 ILE 67 2HG1 ILE 67 1.137 -3.430 -13.347 505 HG13 ILE 67 1HG1 ILE 67 0.353 -2.429 -14.580 506 HG21 ILE 67 1HG2 ILE 67 -0.844 -4.069 -11.108 507 HG22 ILE 67 2HG2 ILE 67 -1.515 -2.455 -10.876 508 HG23 ILE 67 3HG2 ILE 67 0.227 -2.668 -11.054 509 HD11 ILE 67 3HD1 ILE 67 1.505 -0.725 -13.762 510 HD12 ILE 67 1HD1 ILE 67 2.021 -1.659 -12.358 511 HD13 ILE 67 2HD1 ILE 67 0.476 -0.807 -12.333 512 H SER 68 H SER 68 -3.766 -3.848 -14.634 513 HA SER 68 HA SER 68 -5.430 -3.821 -12.333 514 HB2 SER 68 2HB SER 68 -5.734 -3.314 -15.093 515 HB3 SER 68 1HB SER 68 -6.867 -4.610 -14.711 516 HG SER 68 HG SER 68 -7.634 -2.384 -14.404 517 H GLU 69 H GLU 69 -4.125 -6.322 -14.333 518 HA GLU 69 HA GLU 69 -5.907 -8.310 -13.143 519 HB2 GLU 69 2HB GLU 69 -4.473 -9.833 -14.773 520 HB3 GLU 69 1HB GLU 69 -5.849 -8.904 -15.348 521 HG2 GLU 69 2HG GLU 69 -4.293 -7.120 -16.053 522 HG3 GLU 69 1HG GLU 69 -2.946 -8.152 -15.576 523 H LEU 70 H LEU 70 -2.536 -7.358 -13.362 524 HA LEU 70 HA LEU 70 -1.308 -9.512 -12.105 525 HB2 LEU 70 2HB LEU 70 -0.682 -6.720 -12.623 526 HB3 LEU 70 1HB LEU 70 0.014 -7.277 -11.102 527 HG LEU 70 HG LEU 70 0.608 -9.295 -12.947 528 HD11 LEU 70 1HD1 LEU 70 0.040 -7.047 -14.443 529 HD12 LEU 70 2HD1 LEU 70 1.010 -8.428 -14.955 530 HD13 LEU 70 3HD1 LEU 70 1.795 -7.005 -14.275 531 HD21 LEU 70 3HD2 LEU 70 2.918 -7.887 -12.761 532 HD22 LEU 70 1HD2 LEU 70 2.317 -8.980 -11.514 533 HD23 LEU 70 2HD2 LEU 70 2.024 -7.246 -11.381 534 H SER 71 H SER 71 -3.086 -6.817 -10.734 535 HA SER 71 HA SER 71 -2.453 -6.847 -8.096 536 HB2 SER 71 2HB SER 71 -4.444 -5.708 -9.549 537 HB3 SER 71 1HB SER 71 -5.347 -6.853 -8.555 538 HG SER 71 HG SER 71 -4.069 -5.904 -6.750 539 H HIS 72 H HIS 72 -3.926 -9.468 -9.791 540 HA HIS 72 HA HIS 72 -5.299 -10.722 -7.703 541 HB2 HIS 72 2HB HIS 72 -5.294 -12.683 -9.033 542 HB3 HIS 72 1HB HIS 72 -5.299 -11.345 -10.188 543 HD1 HIS 72 1HD HIS 72 -3.701 -14.468 -9.606 544 HD2 HIS 72 2HD HIS 72 -2.444 -10.780 -11.045 545 HE1 HIS 72 1HE HIS 72 -1.571 -14.926 -10.860 546 HE2 HIS 72 2HE HIS 72 -0.868 -12.692 -11.788 547 H ASN 73 H ASN 73 -2.017 -10.068 -8.121 548 HA ASN 73 HA ASN 73 -1.109 -12.296 -6.484 549 HB2 ASN 73 2HB ASN 73 1.129 -11.432 -6.969 550 HB3 ASN 73 1HB ASN 73 0.200 -11.649 -8.452 551 HD21 ASN 73 1HD2 ASN 73 0.699 -10.110 -9.840 552 HD22 ASN 73 2HD2 ASN 73 0.874 -8.421 -9.453 553 H PHE 74 H PHE 74 -1.678 -8.841 -6.214 554 HA PHE 74 HA PHE 74 -1.197 -9.016 -3.337 555 HB2 PHE 74 2HB PHE 74 0.404 -7.507 -5.265 556 HB3 PHE 74 1HB PHE 74 -0.228 -6.504 -3.958 557 HD1 PHE 74 1HD PHE 74 1.407 -9.825 -4.419 558 HD2 PHE 74 2HD PHE 74 1.082 -6.279 -2.093 559 HE1 PHE 74 1HE PHE 74 3.203 -10.629 -2.951 560 HE2 PHE 74 2HE PHE 74 2.888 -7.075 -0.622 561 HZ PHE 74 HZ PHE 74 3.952 -9.255 -1.054 562 H VAL 75 H VAL 75 -2.275 -7.337 -2.096 563 HA VAL 75 HA VAL 75 -4.301 -5.853 -3.652 564 HB VAL 75 HB VAL 75 -5.399 -7.770 -2.601 565 HG11 VAL 75 1HG1 VAL 75 -3.621 -7.496 -0.583 566 HG12 VAL 75 2HG1 VAL 75 -5.117 -8.423 -0.466 567 HG13 VAL 75 3HG1 VAL 75 -5.055 -6.769 0.142 568 HG21 VAL 75 3HG2 VAL 75 -6.254 -5.199 -2.571 569 HG22 VAL 75 1HG2 VAL 75 -6.392 -5.617 -0.864 570 HG23 VAL 75 2HG2 VAL 75 -7.236 -6.578 -2.078 571 H MET 76 H MET 76 -4.081 -3.689 -3.309 572 HA MET 76 HA MET 76 -2.953 -2.871 -0.733 573 HB2 MET 76 2HB MET 76 -2.723 -0.888 -2.834 574 HB3 MET 76 1HB MET 76 -1.513 -1.508 -1.742 575 HG2 MET 76 2HG MET 76 -2.398 -2.798 -4.316 576 HG3 MET 76 1HG MET 76 -0.888 -1.938 -4.041 577 HE1 MET 76 3HE MET 76 0.487 -3.705 -4.983 578 HE2 MET 76 1HE MET 76 1.132 -5.016 -3.994 579 HE3 MET 76 2HE MET 76 1.352 -3.341 -3.489 580 H VAL 77 H VAL 77 -3.355 -0.199 -0.770 581 HA VAL 77 HA VAL 77 -6.205 0.276 -1.178 582 HB VAL 77 HB VAL 77 -4.835 0.125 1.471 583 HG11 VAL 77 1HG1 VAL 77 -5.556 2.244 1.885 584 HG12 VAL 77 2HG1 VAL 77 -7.045 1.369 2.256 585 HG13 VAL 77 3HG1 VAL 77 -6.853 2.156 0.689 586 HG21 VAL 77 3HG2 VAL 77 -6.697 -1.140 2.101 587 HG22 VAL 77 1HG2 VAL 77 -6.345 -1.647 0.447 588 HG23 VAL 77 2HG2 VAL 77 -7.671 -0.527 0.766 589 H ASN 78 H ASN 78 -6.709 2.369 -1.609 590 HA ASN 78 HA ASN 78 -4.526 4.328 -1.481 591 HB2 ASN 78 2HB ASN 78 -5.690 3.535 -3.736 592 HB3 ASN 78 1HB ASN 78 -6.848 4.775 -3.279 593 HD21 ASN 78 1HD2 ASN 78 -3.346 4.637 -2.836 594 HD22 ASN 78 2HD2 ASN 78 -2.999 6.071 -3.742 595 H LEU 79 H LEU 79 -4.787 5.751 0.104 596 HA LEU 79 HA LEU 79 -7.504 6.793 0.562 597 HB2 LEU 79 2HB LEU 79 -7.171 6.862 2.914 598 HB3 LEU 79 1HB LEU 79 -6.784 5.243 2.369 599 HG LEU 79 HG LEU 79 -4.361 6.650 2.321 600 HD11 LEU 79 1HD1 LEU 79 -4.210 7.997 4.100 601 HD12 LEU 79 2HD1 LEU 79 -5.208 6.944 5.104 602 HD13 LEU 79 3HD1 LEU 79 -5.968 8.079 3.988 603 HD21 LEU 79 3HD2 LEU 79 -3.674 5.046 3.945 604 HD22 LEU 79 1HD2 LEU 79 -4.814 4.251 2.860 605 HD23 LEU 79 2HD2 LEU 79 -5.338 4.773 4.461 606 H GLU 80 H GLU 80 -7.321 8.853 2.016 607 HA GLU 80 HA GLU 80 -5.021 10.514 1.461 608 HB2 GLU 80 2HB GLU 80 -7.476 10.637 -0.142 609 HB3 GLU 80 1HB GLU 80 -7.010 12.195 0.549 610 HG2 GLU 80 2HG GLU 80 -5.314 12.434 -0.868 611 HG3 GLU 80 1HG GLU 80 -4.765 10.768 -0.630 612 H ASP 81 H ASP 81 -6.037 12.981 2.015 613 HA ASP 81 HA ASP 81 -6.101 13.169 4.729 614 HB2 ASP 81 2HB ASP 81 -7.213 15.377 4.429 615 HB3 ASP 81 1HB ASP 81 -5.854 15.130 3.336 616 H GLU 82 H GLU 82 -8.766 12.344 2.629 617 HA GLU 82 HA GLU 82 -10.921 12.810 4.334 618 HB2 GLU 82 2HB GLU 82 -10.435 11.360 1.886 619 HB3 GLU 82 1HB GLU 82 -11.514 10.445 2.929 620 HG2 GLU 82 2HG GLU 82 -13.077 11.678 1.888 621 HG3 GLU 82 1HG GLU 82 -12.658 12.848 3.139 622 H GLU 83 H GLU 83 -8.577 10.220 4.271 623 HA GLU 83 HA GLU 83 -10.023 8.718 6.312 624 HB2 GLU 83 2HB GLU 83 -8.388 7.957 4.205 625 HB3 GLU 83 1HB GLU 83 -7.363 7.739 5.618 626 HG2 GLU 83 2HG GLU 83 -8.478 5.934 6.285 627 HG3 GLU 83 1HG GLU 83 -10.049 6.694 6.000 628 H GLU 84 H GLU 84 -6.637 9.768 5.904 629 HA GLU 84 HA GLU 84 -5.091 10.538 7.383 630 HB2 GLU 84 2HB GLU 84 -7.658 11.584 8.452 631 HB3 GLU 84 1HB GLU 84 -6.265 11.642 9.524 632 HG2 GLU 84 2HG GLU 84 -5.030 12.816 7.674 633 HG3 GLU 84 1HG GLU 84 -6.575 12.941 6.834 634 HA PRO 85 HA PRO 85 -5.480 6.567 9.778 635 HB2 PRO 85 2HB PRO 85 -2.543 6.770 9.331 636 HB3 PRO 85 1HB PRO 85 -3.623 5.373 9.144 637 HG2 PRO 85 2HG PRO 85 -2.680 6.661 7.009 638 HG3 PRO 85 1HG PRO 85 -4.353 6.055 7.046 639 HD2 PRO 85 2HD PRO 85 -3.333 8.849 7.400 640 HD3 PRO 85 1HD PRO 85 -4.794 8.274 6.558 641 H LYS 86 H LYS 86 -3.453 9.406 10.090 642 HA LYS 86 HA LYS 86 -2.684 10.557 11.893 643 HB2 LYS 86 2HB LYS 86 -5.126 9.989 12.620 644 HB3 LYS 86 1HB LYS 86 -4.341 8.857 13.728 645 HG2 LYS 86 2HG LYS 86 -3.716 10.486 15.114 646 HG3 LYS 86 1HG LYS 86 -3.155 11.515 13.795 647 HD2 LYS 86 2HD LYS 86 -4.892 12.797 14.505 648 HD3 LYS 86 1HD LYS 86 -5.783 11.746 13.403 649 HE2 LYS 86 2HE LYS 86 -5.435 10.965 16.268 650 HE3 LYS 86 1HE LYS 86 -6.667 12.144 15.821 651 HZ1 LYS 86 3HZ LYS 86 -7.903 10.591 14.760 652 HZ2 LYS 86 1HZ LYS 86 -7.141 9.559 15.866 653 HZ3 LYS 86 2HZ LYS 86 -6.570 9.669 14.277 654 H ASP 87 H ASP 87 -1.149 8.405 11.005 655 HA ASP 87 HA ASP 87 0.579 8.032 13.206 656 HB2 ASP 87 2HB ASP 87 -1.526 6.182 13.130 657 HB3 ASP 87 1HB ASP 87 -0.127 5.314 12.482 658 H GLU 88 H GLU 88 1.959 5.776 12.468 659 HA GLU 88 HA GLU 88 3.470 6.695 10.273 660 HB2 GLU 88 2HB GLU 88 3.472 4.285 12.010 661 HB3 GLU 88 1HB GLU 88 4.308 4.157 10.467 662 HG2 GLU 88 2HG GLU 88 4.833 6.342 12.461 663 HG3 GLU 88 1HG GLU 88 5.730 4.825 12.412 664 H ASP 89 H ASP 89 0.573 4.919 10.379 665 HA ASP 89 HA ASP 89 0.781 3.187 8.232 666 HB2 ASP 89 2HB ASP 89 -1.237 3.987 9.938 667 HB3 ASP 89 1HB ASP 89 -1.815 4.528 8.355 668 H PHE 90 H PHE 90 0.934 6.596 8.154 669 HA PHE 90 HA PHE 90 0.439 6.549 5.252 670 HB2 PHE 90 2HB PHE 90 -0.282 8.847 5.347 671 HB3 PHE 90 1HB PHE 90 -1.205 7.913 6.531 672 HD1 PHE 90 2HD PHE 90 1.761 10.139 6.215 673 HD2 PHE 90 1HD PHE 90 -1.324 8.628 8.727 674 HE1 PHE 90 2HE PHE 90 2.408 11.742 7.965 675 HE2 PHE 90 1HE PHE 90 -0.685 10.232 10.481 676 HZ PHE 90 HZ PHE 90 1.183 11.790 10.102 677 H SER 91 H SER 91 2.679 7.251 7.761 678 HA SER 91 HA SER 91 4.446 8.768 5.999 679 HB2 SER 91 2HB SER 91 4.621 8.090 8.944 680 HB3 SER 91 1HB SER 91 5.867 8.986 8.059 681 HG SER 91 HG SER 91 4.122 10.483 7.506 682 HA PRO 92 HA PRO 92 7.163 5.257 5.531 683 HB2 PRO 92 2HB PRO 92 9.252 6.514 4.470 684 HB3 PRO 92 1HB PRO 92 7.658 6.623 3.704 685 HG2 PRO 92 2HG PRO 92 9.151 8.672 5.230 686 HG3 PRO 92 1HG PRO 92 7.900 8.883 4.003 687 HD2 PRO 92 2HD PRO 92 7.619 8.873 6.890 688 HD3 PRO 92 1HD PRO 92 6.392 9.239 5.664 689 H ASP 93 H ASP 93 10.027 7.001 5.908 690 HA ASP 93 HA ASP 93 10.483 5.919 8.602 691 HB2 ASP 93 2HB ASP 93 12.750 5.376 7.988 692 HB3 ASP 93 1HB ASP 93 11.673 4.671 6.771 693 H GLY 94 H GLY 94 10.188 8.671 6.789 694 HA2 GLY 94 2HA GLY 94 11.938 10.204 8.610 695 HA3 GLY 94 1HA GLY 94 11.659 10.661 6.924 696 H GLY 95 H GLY 95 9.139 10.758 6.435 697 HA2 GLY 95 2HA GLY 95 7.076 11.233 7.939 698 HA3 GLY 95 1HA GLY 95 8.074 12.584 8.478 699 H TYR 96 H TYR 96 6.988 11.158 5.351 700 HA TYR 96 HA TYR 96 6.801 13.867 4.290 701 HB2 TYR 96 2HB TYR 96 6.165 12.689 2.134 702 HB3 TYR 96 1HB TYR 96 7.794 12.380 2.736 703 HD1 TYR 96 1HD TYR 96 4.961 10.686 4.333 704 HD2 TYR 96 2HD TYR 96 7.942 10.420 1.310 705 HE1 TYR 96 1HE TYR 96 4.555 8.271 4.145 706 HE2 TYR 96 2HE TYR 96 7.533 8.004 1.114 707 HH TYR 96 HH TYR 96 5.302 6.465 1.719 708 H ILE 97 H ILE 97 4.564 13.462 2.495 709 HA ILE 97 HA ILE 97 2.346 12.788 4.226 710 HB ILE 97 HB ILE 97 1.297 15.050 3.940 711 HG12 ILE 97 2HG1 ILE 97 4.009 16.171 3.506 712 HG13 ILE 97 1HG1 ILE 97 3.208 15.465 2.099 713 HG21 ILE 97 1HG2 ILE 97 3.894 15.027 5.471 714 HG22 ILE 97 2HG2 ILE 97 2.390 14.296 6.033 715 HG23 ILE 97 3HG2 ILE 97 2.484 16.040 5.786 716 HD11 ILE 97 3HD1 ILE 97 2.680 17.965 3.499 717 HD12 ILE 97 1HD1 ILE 97 1.236 17.015 3.150 718 HD13 ILE 97 2HD1 ILE 97 2.322 17.482 1.839 719 HA PRO 98 HA PRO 98 1.995 10.425 3.160 720 HB2 PRO 98 2HB PRO 98 -0.771 10.237 1.898 721 HB3 PRO 98 1HB PRO 98 -0.107 9.249 3.228 722 HG2 PRO 98 2HG PRO 98 -1.268 11.838 3.368 723 HG3 PRO 98 1HG PRO 98 -0.546 10.876 4.687 724 HD2 PRO 98 2HD PRO 98 0.658 13.056 3.998 725 HD3 PRO 98 1HD PRO 98 1.634 11.579 4.168 726 H ARG 99 H ARG 99 2.623 8.499 2.167 727 HA ARG 99 HA ARG 99 2.328 8.356 -0.734 728 HB2 ARG 99 2HB ARG 99 4.812 8.471 0.859 729 HB3 ARG 99 1HB ARG 99 4.806 7.438 -0.574 730 HG2 ARG 99 2HG ARG 99 4.716 9.179 -1.970 731 HG3 ARG 99 1HG ARG 99 3.662 10.120 -0.932 732 HD2 ARG 99 2HD ARG 99 5.496 10.808 0.428 733 HD3 ARG 99 1HD ARG 99 6.590 9.693 -0.394 734 HE ARG 99 HE ARG 99 6.873 11.252 -2.034 735 HH11 ARG 99 1HH1 ARG 99 3.996 12.053 -0.230 736 HH12 ARG 99 2HH1 ARG 99 3.757 13.563 -1.043 737 HH21 ARG 99 1HH2 ARG 99 6.562 13.237 -3.103 738 HH22 ARG 99 2HH2 ARG 99 5.213 14.236 -2.675 739 H ILE 100 H ILE 100 3.807 6.039 -1.223 740 HA ILE 100 HA ILE 100 1.887 4.105 -0.241 741 HB ILE 100 HB ILE 100 2.686 2.611 -1.898 742 HG12 ILE 100 2HG1 ILE 100 4.752 3.964 -3.246 743 HG13 ILE 100 1HG1 ILE 100 5.181 4.028 -1.543 744 HG21 ILE 100 1HG2 ILE 100 3.042 5.124 -3.417 745 HG22 ILE 100 2HG2 ILE 100 1.552 4.950 -2.491 746 HG23 ILE 100 3HG2 ILE 100 1.972 3.756 -3.719 747 HD11 ILE 100 3HD1 ILE 100 4.620 1.570 -3.179 748 HD12 ILE 100 1HD1 ILE 100 4.887 1.570 -1.436 749 HD13 ILE 100 2HD1 ILE 100 6.173 2.090 -2.524 750 H LEU 101 H LEU 101 2.117 2.848 1.447 751 HA LEU 101 HA LEU 101 4.818 2.030 2.313 752 HB2 LEU 101 2HB LEU 101 2.443 2.325 4.143 753 HB3 LEU 101 1HB LEU 101 4.084 1.975 4.603 754 HG LEU 101 HG LEU 101 4.631 4.145 4.766 755 HD11 LEU 101 1HD1 LEU 101 3.907 5.926 3.245 756 HD12 LEU 101 2HD1 LEU 101 2.927 4.759 2.368 757 HD13 LEU 101 3HD1 LEU 101 4.684 4.589 2.401 758 HD21 LEU 101 3HD2 LEU 101 2.189 5.478 4.684 759 HD22 LEU 101 1HD2 LEU 101 2.972 4.768 6.094 760 HD23 LEU 101 2HD2 LEU 101 1.799 3.829 5.168 761 H PHE 102 H PHE 102 5.138 -0.185 2.439 762 HA PHE 102 HA PHE 102 2.830 -1.878 1.866 763 HB2 PHE 102 2HB PHE 102 5.644 -2.058 1.394 764 HB3 PHE 102 1HB PHE 102 5.175 -3.434 2.385 765 HD1 PHE 102 2HD PHE 102 2.396 -3.833 1.316 766 HD2 PHE 102 1HD PHE 102 6.099 -3.105 -0.650 767 HE1 PHE 102 2HE PHE 102 1.560 -4.996 -0.681 768 HE2 PHE 102 1HE PHE 102 5.269 -4.268 -2.651 769 HZ PHE 102 HZ PHE 102 2.995 -5.216 -2.669 770 H LEU 103 H LEU 103 2.278 -3.750 3.193 771 HA LEU 103 HA LEU 103 3.329 -3.825 5.890 772 HB2 LEU 103 2HB LEU 103 0.865 -3.749 6.732 773 HB3 LEU 103 1HB LEU 103 1.785 -2.288 6.497 774 HG LEU 103 HG LEU 103 -0.110 -3.351 4.453 775 HD11 LEU 103 1HD1 LEU 103 -1.681 -1.622 5.249 776 HD12 LEU 103 2HD1 LEU 103 -0.659 -1.438 6.670 777 HD13 LEU 103 3HD1 LEU 103 -1.443 -2.981 6.343 778 HD21 LEU 103 3HD2 LEU 103 -0.047 -0.709 4.060 779 HD22 LEU 103 1HD2 LEU 103 1.055 -1.830 3.259 780 HD23 LEU 103 2HD2 LEU 103 1.578 -0.957 4.700 781 H ASP 104 H ASP 104 1.878 -5.378 7.257 782 HA ASP 104 HA ASP 104 1.952 -7.904 5.876 783 HB2 ASP 104 2HB ASP 104 2.097 -7.029 8.567 784 HB3 ASP 104 1HB ASP 104 0.699 -8.109 8.455 785 HA PRO 105 HA PRO 105 -2.198 -8.298 4.460 786 HB2 PRO 105 2HB PRO 105 -2.657 -10.951 5.175 787 HB3 PRO 105 1HB PRO 105 -1.893 -10.401 3.672 788 HG2 PRO 105 2HG PRO 105 -0.643 -11.415 6.187 789 HG3 PRO 105 1HG PRO 105 -0.143 -11.657 4.499 790 HD2 PRO 105 2HD PRO 105 1.132 -9.930 6.117 791 HD3 PRO 105 1HD PRO 105 0.917 -9.605 4.387 792 H SER 106 H SER 106 -3.251 -6.946 5.882 793 HA SER 106 HA SER 106 -5.361 -7.782 7.324 794 HB2 SER 106 2HB SER 106 -2.877 -8.060 8.929 795 HB3 SER 106 1HB SER 106 -4.243 -7.281 9.745 796 HG SER 106 HG SER 106 -4.193 -9.594 9.966 797 H GLY 107 H GLY 107 -2.670 -5.578 7.189 798 HA2 GLY 107 2HA GLY 107 -3.276 -3.253 6.587 799 HA3 GLY 107 1HA GLY 107 -4.500 -3.355 7.858 800 H LYS 108 H LYS 108 -1.069 -4.361 7.815 801 HA LYS 108 HA LYS 108 -0.694 -2.594 10.152 802 HB2 LYS 108 2HB LYS 108 0.070 -5.390 9.644 803 HB3 LYS 108 1HB LYS 108 1.310 -4.405 10.406 804 HG2 LYS 108 2HG LYS 108 -0.622 -3.704 12.007 805 HG3 LYS 108 1HG LYS 108 -1.377 -5.198 11.427 806 HD2 LYS 108 2HD LYS 108 1.453 -5.424 12.219 807 HD3 LYS 108 1HD LYS 108 0.324 -5.071 13.529 808 HE2 LYS 108 2HE LYS 108 -0.783 -7.067 13.296 809 HE3 LYS 108 1HE LYS 108 -0.368 -7.221 11.591 810 HZ1 LYS 108 3HZ LYS 108 1.692 -8.074 12.077 811 HZ2 LYS 108 1HZ LYS 108 0.777 -8.724 13.342 812 HZ3 LYS 108 2HZ LYS 108 1.759 -7.375 13.616 813 H VAL 109 H VAL 109 -0.124 -0.911 8.498 814 HA VAL 109 HA VAL 109 2.045 -0.963 6.798 815 HB VAL 109 HB VAL 109 1.059 1.334 8.481 816 HG11 VAL 109 1HG1 VAL 109 3.281 1.734 7.598 817 HG12 VAL 109 2HG1 VAL 109 2.088 2.753 6.795 818 HG13 VAL 109 3HG1 VAL 109 2.720 1.323 5.980 819 HG21 VAL 109 3HG2 VAL 109 -0.733 0.458 7.140 820 HG22 VAL 109 1HG2 VAL 109 0.303 0.406 5.716 821 HG23 VAL 109 2HG2 VAL 109 -0.166 1.957 6.405 822 H HIS 110 H HIS 110 3.977 -1.678 7.286 823 HA HIS 110 HA HIS 110 5.252 -0.688 9.747 824 HB2 HIS 110 2HB HIS 110 4.846 -3.286 9.215 825 HB3 HIS 110 1HB HIS 110 6.359 -3.069 8.342 826 HD1 HIS 110 1HD HIS 110 8.420 -2.203 9.826 827 HD2 HIS 110 2HD HIS 110 5.104 -3.568 11.924 828 HE1 HIS 110 1HE HIS 110 9.229 -2.609 12.171 829 HE2 HIS 110 2HE HIS 110 7.188 -3.365 13.441 830 HA PRO 111 HA PRO 111 7.836 1.490 6.835 831 HB2 PRO 111 2HB PRO 111 9.721 2.355 8.598 832 HB3 PRO 111 1HB PRO 111 8.125 3.101 8.444 833 HG2 PRO 111 2HG PRO 111 9.108 1.127 10.461 834 HG3 PRO 111 1HG PRO 111 8.083 2.552 10.698 835 HD2 PRO 111 2HD PRO 111 7.093 0.028 10.588 836 HD3 PRO 111 1HD PRO 111 6.180 1.445 10.021 837 H GLU 112 H GLU 112 8.135 -1.322 6.950 838 HA GLU 112 HA GLU 112 11.060 -1.661 7.013 839 HB2 GLU 112 2HB GLU 112 9.566 -3.159 8.432 840 HB3 GLU 112 1HB GLU 112 9.014 -3.872 6.924 841 HG2 GLU 112 2HG GLU 112 11.931 -3.730 7.301 842 HG3 GLU 112 1HG GLU 112 11.056 -4.830 8.365 843 H ILE 113 H ILE 113 8.172 -2.198 5.057 844 HA ILE 113 HA ILE 113 9.839 -3.020 2.797 845 HB ILE 113 HB ILE 113 6.841 -3.034 3.119 846 HG12 ILE 113 2HG1 ILE 113 8.652 -5.419 2.810 847 HG13 ILE 113 1HG1 ILE 113 8.313 -4.719 4.398 848 HG21 ILE 113 1HG2 ILE 113 7.448 -2.650 0.794 849 HG22 ILE 113 2HG2 ILE 113 6.797 -4.275 1.002 850 HG23 ILE 113 3HG2 ILE 113 8.536 -4.036 0.834 851 HD11 ILE 113 3HD1 ILE 113 6.426 -6.043 2.487 852 HD12 ILE 113 1HD1 ILE 113 5.854 -5.009 3.795 853 HD13 ILE 113 2HD1 ILE 113 6.781 -6.461 4.163 854 H ILE 114 H ILE 114 10.698 -1.282 1.864 855 HA ILE 114 HA ILE 114 9.030 1.057 1.321 856 HB ILE 114 HB ILE 114 11.001 2.292 0.923 857 HG12 ILE 114 2HG1 ILE 114 12.148 0.549 -0.473 858 HG13 ILE 114 1HG1 ILE 114 13.212 1.387 0.646 859 HG21 ILE 114 1HG2 ILE 114 10.621 0.900 3.324 860 HG22 ILE 114 2HG2 ILE 114 11.481 2.421 3.080 861 HG23 ILE 114 3HG2 ILE 114 12.358 0.893 3.023 862 HD11 ILE 114 3HD1 ILE 114 13.908 -0.747 0.960 863 HD12 ILE 114 1HD1 ILE 114 12.321 -1.437 0.625 864 HD13 ILE 114 2HD1 ILE 114 12.641 -0.675 2.184 865 H ASN 115 H ASN 115 10.338 2.046 -0.932 866 HA ASN 115 HA ASN 115 9.181 0.349 -2.970 867 HB2 ASN 115 2HB ASN 115 8.735 2.713 -3.156 868 HB3 ASN 115 1HB ASN 115 10.463 3.087 -3.097 869 HD21 ASN 115 1HD2 ASN 115 9.296 4.202 -5.128 870 HD22 ASN 115 2HD2 ASN 115 9.576 3.337 -6.614 871 H GLU 116 H GLU 116 12.358 1.606 -2.093 872 HA GLU 116 HA GLU 116 14.435 0.678 -2.404 873 HB2 GLU 116 2HB GLU 116 12.842 -1.507 -2.908 874 HB3 GLU 116 1HB GLU 116 13.724 -1.325 -4.429 875 HG2 GLU 116 2HG GLU 116 14.889 -1.680 -1.676 876 HG3 GLU 116 1HG GLU 116 14.917 -2.835 -3.009 877 H ASN 117 H ASN 117 12.499 0.545 -5.402 878 HA ASN 117 HA ASN 117 14.733 1.742 -6.854 879 HB2 ASN 117 2HB ASN 117 12.748 -0.156 -7.522 880 HB3 ASN 117 1HB ASN 117 12.421 1.279 -8.505 881 HD21 ASN 117 1HD2 ASN 117 14.723 -1.224 -7.738 882 HD22 ASN 117 2HD2 ASN 117 15.720 -1.013 -9.154 883 H GLY 118 H GLY 118 12.870 3.172 -4.911 884 HA2 GLY 118 2HA GLY 118 11.428 5.022 -6.611 885 HA3 GLY 118 1HA GLY 118 11.527 5.070 -4.850 886 H ASN 119 H ASN 119 13.628 5.780 -3.946 887 HA ASN 119 HA ASN 119 15.509 7.210 -5.508 888 HB2 ASN 119 2HB ASN 119 13.195 8.608 -5.329 889 HB3 ASN 119 1HB ASN 119 14.013 9.167 -3.862 890 HD21 ASN 119 1HD2 ASN 119 14.643 11.149 -4.357 891 HD22 ASN 119 2HD2 ASN 119 15.630 11.579 -5.728 892 HA PRO 120 HA PRO 120 17.583 6.710 -1.614 893 HB2 PRO 120 2HB PRO 120 19.797 8.177 -2.046 894 HB3 PRO 120 1HB PRO 120 19.503 6.647 -2.897 895 HG2 PRO 120 2HG PRO 120 19.100 9.460 -3.848 896 HG3 PRO 120 1HG PRO 120 19.793 8.069 -4.713 897 HD2 PRO 120 2HD PRO 120 17.212 8.934 -5.031 898 HD3 PRO 120 1HD PRO 120 17.731 7.253 -5.295 899 H SER 121 H SER 121 15.498 8.564 -1.437 900 HA SER 121 HA SER 121 16.091 10.019 0.824 901 HB2 SER 121 2HB SER 121 16.663 11.485 -1.714 902 HB3 SER 121 1HB SER 121 15.836 12.374 -0.426 903 HG SER 121 HG SER 121 17.561 11.880 0.950 904 H TYR 122 H TYR 122 14.078 8.418 -0.163 905 HA TYR 122 HA TYR 122 11.757 9.849 0.509 906 HB2 TYR 122 2HB TYR 122 12.587 10.012 -2.254 907 HB3 TYR 122 1HB TYR 122 11.032 9.190 -2.124 908 HD1 TYR 122 1HD TYR 122 9.452 10.479 -0.248 909 HD2 TYR 122 2HD TYR 122 12.441 12.245 -2.708 910 HE1 TYR 122 1HE TYR 122 8.340 12.661 -0.026 911 HE2 TYR 122 2HE TYR 122 11.340 14.429 -2.493 912 HH TYR 122 HH TYR 122 8.832 15.010 -0.226 913 H LYS 123 H LYS 123 13.113 7.174 -1.335 914 HA LYS 123 HA LYS 123 12.568 4.976 -1.530 915 HB2 LYS 123 2HB LYS 123 12.098 5.660 1.333 916 HB3 LYS 123 1HB LYS 123 11.618 4.067 0.777 917 HG2 LYS 123 2HG LYS 123 14.372 5.274 0.773 918 HG3 LYS 123 1HG LYS 123 13.792 3.870 1.688 919 HD2 LYS 123 2HD LYS 123 14.592 2.608 0.034 920 HD3 LYS 123 1HD LYS 123 13.267 3.223 -0.963 921 HE2 LYS 123 2HE LYS 123 15.191 5.222 -1.053 922 HE3 LYS 123 1HE LYS 123 16.118 3.727 -1.138 923 HZ1 LYS 123 3HZ LYS 123 15.198 4.802 -3.289 924 HZ2 LYS 123 1HZ LYS 123 13.748 4.054 -2.845 925 HZ3 LYS 123 2HZ LYS 123 15.135 3.123 -3.104 926 H TYR 124 H TYR 124 9.978 5.440 0.777 927 HA TYR 124 HA TYR 124 8.068 4.028 -0.611 928 HB2 TYR 124 2HB TYR 124 7.655 6.219 1.421 929 HB3 TYR 124 1HB TYR 124 6.433 5.038 0.932 930 HD1 TYR 124 2HD TYR 124 9.580 5.541 2.764 931 HD2 TYR 124 1HD TYR 124 6.531 2.762 1.734 932 HE1 TYR 124 2HE TYR 124 10.398 4.005 4.500 933 HE2 TYR 124 1HE TYR 124 7.338 1.221 3.468 934 HH TYR 124 HH TYR 124 9.586 2.154 5.855 935 H PHE 125 H PHE 125 9.239 7.031 -1.549 936 HA PHE 125 HA PHE 125 6.821 8.187 -2.541 937 HB2 PHE 125 2HB PHE 125 8.735 9.618 -2.118 938 HB3 PHE 125 1HB PHE 125 9.724 8.677 -3.244 939 HD1 PHE 125 1HD PHE 125 6.275 10.045 -3.593 940 HD2 PHE 125 2HD PHE 125 10.302 10.087 -4.963 941 HE1 PHE 125 1HE PHE 125 5.631 11.556 -5.427 942 HE2 PHE 125 2HE PHE 125 9.667 11.596 -6.799 943 HZ PHE 125 HZ PHE 125 7.329 12.332 -7.033 944 H TYR 126 H TYR 126 5.683 7.466 -4.233 945 HA TYR 126 HA TYR 126 7.004 5.678 -6.133 946 HB2 TYR 126 2HB TYR 126 4.324 5.861 -5.012 947 HB3 TYR 126 1HB TYR 126 4.302 5.711 -6.775 948 HD1 TYR 126 2HD TYR 126 7.000 4.235 -4.765 949 HD2 TYR 126 1HD TYR 126 3.288 3.517 -6.714 950 HE1 TYR 126 2HE TYR 126 7.359 1.814 -4.545 951 HE2 TYR 126 1HE TYR 126 3.634 1.096 -6.488 952 HH TYR 126 HH TYR 126 6.436 -0.318 -5.955 953 H VAL 127 H VAL 127 6.589 5.856 -8.386 954 HA VAL 127 HA VAL 127 5.423 8.158 -9.566 955 HB VAL 127 HB VAL 127 7.598 8.943 -10.647 956 HG11 VAL 127 1HG1 VAL 127 6.227 10.010 -8.700 957 HG12 VAL 127 2HG1 VAL 127 7.820 10.642 -9.115 958 HG13 VAL 127 3HG1 VAL 127 7.631 9.567 -7.731 959 HG21 VAL 127 3HG2 VAL 127 9.383 7.679 -10.175 960 HG22 VAL 127 1HG2 VAL 127 8.628 6.982 -8.745 961 HG23 VAL 127 2HG2 VAL 127 9.425 8.551 -8.642 962 H SER 128 H SER 128 4.422 6.880 -11.010 963 HA SER 128 HA SER 128 4.323 6.000 -13.166 964 HB2 SER 128 2HB SER 128 6.165 5.429 -14.422 965 HB3 SER 128 1HB SER 128 6.916 6.528 -13.254 966 HG SER 128 HG SER 128 7.317 4.529 -11.996 967 H ALA 129 H ALA 129 3.541 4.071 -13.791 968 HA ALA 129 HA ALA 129 3.036 2.117 -11.810 969 HB1 ALA 129 1HB ALA 129 2.483 0.946 -14.282 970 HB2 ALA 129 2HB ALA 129 2.186 2.669 -14.506 971 HB3 ALA 129 3HB ALA 129 1.354 1.790 -13.223 972 H GLU 130 H GLU 130 5.686 2.606 -13.884 973 HA GLU 130 HA GLU 130 6.475 -0.042 -14.392 974 HB2 GLU 130 2HB GLU 130 7.428 2.499 -15.003 975 HB3 GLU 130 1HB GLU 130 8.716 1.779 -14.031 976 HG2 GLU 130 2HG GLU 130 9.157 1.333 -16.332 977 HG3 GLU 130 1HG GLU 130 8.686 -0.184 -15.550 978 H GLN 131 H GLN 131 7.269 2.155 -11.689 979 HA GLN 131 HA GLN 131 8.947 0.162 -10.511 980 HB2 GLN 131 2HB GLN 131 8.958 1.668 -8.527 981 HB3 GLN 131 1HB GLN 131 9.641 2.327 -10.006 982 HG2 GLN 131 2HG GLN 131 7.339 3.394 -10.364 983 HG3 GLN 131 1HG GLN 131 7.049 3.011 -8.668 984 HE21 GLN 131 1HE2 GLN 131 7.918 4.269 -7.128 985 HE22 GLN 131 2HE2 GLN 131 8.939 5.630 -7.428 986 H VAL 132 H VAL 132 5.660 1.320 -10.030 987 HA VAL 132 HA VAL 132 5.105 0.072 -7.617 988 HB VAL 132 HB VAL 132 2.847 0.345 -8.047 989 HG11 VAL 132 1HG1 VAL 132 4.492 2.403 -8.569 990 HG12 VAL 132 2HG1 VAL 132 2.734 2.536 -8.529 991 HG13 VAL 132 3HG1 VAL 132 3.571 2.347 -10.069 992 HG21 VAL 132 3HG2 VAL 132 2.254 0.720 -10.662 993 HG22 VAL 132 1HG2 VAL 132 2.103 -0.820 -9.814 994 HG23 VAL 132 2HG2 VAL 132 3.541 -0.478 -10.771 995 H VAL 133 H VAL 133 5.467 -1.297 -10.797 996 HA VAL 133 HA VAL 133 4.299 -3.822 -10.050 997 HB VAL 133 HB VAL 133 4.174 -3.120 -12.389 998 HG11 VAL 133 1HG1 VAL 133 7.102 -2.936 -12.065 999 HG12 VAL 133 2HG1 VAL 133 6.001 -1.945 -13.020 1000 HG13 VAL 133 3HG1 VAL 133 6.504 -3.529 -13.612 1001 HG21 VAL 133 3HG2 VAL 133 4.630 -5.212 -13.355 1002 HG22 VAL 133 1HG2 VAL 133 4.332 -5.564 -11.654 1003 HG23 VAL 133 2HG2 VAL 133 5.985 -5.520 -12.268 1004 H GLN 134 H GLN 134 7.590 -2.451 -10.309 1005 HA GLN 134 HA GLN 134 8.809 -5.026 -9.831 1006 HB2 GLN 134 2HB GLN 134 10.815 -3.466 -9.128 1007 HB3 GLN 134 1HB GLN 134 10.372 -3.660 -10.817 1008 HG2 GLN 134 2HG GLN 134 9.105 -1.578 -10.713 1009 HG3 GLN 134 1HG GLN 134 9.588 -1.377 -9.029 1010 HE21 GLN 134 1HE2 GLN 134 10.231 -0.424 -12.080 1011 HE22 GLN 134 2HE2 GLN 134 11.904 0.035 -11.905 1012 H GLY 135 H GLY 135 7.323 -2.620 -7.938 1013 HA2 GLY 135 2HA GLY 135 8.522 -3.488 -5.435 1014 HA3 GLY 135 1HA GLY 135 7.270 -2.251 -5.633 1015 H MET 136 H MET 136 5.710 -4.071 -7.403 1016 HA MET 136 HA MET 136 4.186 -5.360 -5.325 1017 HB2 MET 136 2HB MET 136 3.385 -4.260 -7.583 1018 HB3 MET 136 1HB MET 136 3.713 -5.858 -8.236 1019 HG2 MET 136 2HG MET 136 1.951 -6.801 -7.193 1020 HG3 MET 136 1HG MET 136 2.099 -5.768 -5.773 1021 HE1 MET 136 3HE MET 136 1.166 -4.842 -9.799 1022 HE2 MET 136 1HE MET 136 -0.486 -5.328 -9.413 1023 HE3 MET 136 2HE MET 136 0.851 -6.447 -9.138 1024 H LYS 137 H LYS 137 6.155 -6.329 -8.067 1025 HA LYS 137 HA LYS 137 5.908 -9.131 -7.560 1026 HB2 LYS 137 2HB LYS 137 7.510 -9.386 -9.382 1027 HB3 LYS 137 1HB LYS 137 6.236 -8.264 -9.818 1028 HG2 LYS 137 2HG LYS 137 8.019 -6.514 -8.930 1029 HG3 LYS 137 1HG LYS 137 9.123 -7.802 -9.406 1030 HD2 LYS 137 2HD LYS 137 7.432 -6.037 -11.076 1031 HD3 LYS 137 1HD LYS 137 9.020 -6.715 -11.400 1032 HE2 LYS 137 2HE LYS 137 7.832 -7.920 -12.910 1033 HE3 LYS 137 1HE LYS 137 7.584 -8.956 -11.514 1034 HZ1 LYS 137 3HZ LYS 137 5.437 -8.725 -11.999 1035 HZ2 LYS 137 1HZ LYS 137 5.687 -7.361 -12.967 1036 HZ3 LYS 137 2HZ LYS 137 5.564 -7.196 -11.287 1037 H GLU 138 H GLU 138 7.777 -6.638 -6.229 1038 HA GLU 138 HA GLU 138 10.126 -8.123 -5.582 1039 HB2 GLU 138 2HB GLU 138 9.126 -5.445 -5.160 1040 HB3 GLU 138 1HB GLU 138 9.806 -6.087 -3.666 1041 HG2 GLU 138 2HG GLU 138 11.409 -6.478 -6.115 1042 HG3 GLU 138 1HG GLU 138 11.254 -4.818 -5.518 1043 H ALA 139 H ALA 139 7.523 -6.886 -3.509 1044 HA ALA 139 HA ALA 139 8.121 -8.518 -1.294 1045 HB1 ALA 139 1HB ALA 139 6.500 -6.416 -1.657 1046 HB2 ALA 139 2HB ALA 139 6.356 -7.521 -0.290 1047 HB3 ALA 139 3HB ALA 139 5.307 -7.714 -1.694 1048 H GLN 140 H GLN 140 6.561 -9.175 -4.284 1049 HA GLN 140 HA GLN 140 4.796 -11.198 -3.646 1050 HB2 GLN 140 2HB GLN 140 6.260 -10.338 -6.027 1051 HB3 GLN 140 1HB GLN 140 5.850 -12.057 -6.024 1052 HG2 GLN 140 2HG GLN 140 3.564 -10.609 -5.180 1053 HG3 GLN 140 1HG GLN 140 4.200 -9.832 -6.630 1054 HE21 GLN 140 1HE2 GLN 140 2.848 -12.738 -5.286 1055 HE22 GLN 140 2HE2 GLN 140 2.482 -13.507 -6.789 1056 H GLU 141 H GLU 141 8.191 -11.231 -3.272 1057 HA GLU 141 HA GLU 141 8.176 -14.168 -3.111 1058 HB2 GLU 141 2HB GLU 141 9.790 -13.889 -4.672 1059 HB3 GLU 141 1HB GLU 141 10.124 -12.227 -4.179 1060 HG2 GLU 141 2HG GLU 141 11.428 -13.052 -2.289 1061 HG3 GLU 141 1HG GLU 141 11.088 -14.714 -2.774 1062 H ARG 142 H ARG 142 9.586 -11.269 -1.578 1063 HA ARG 142 HA ARG 142 10.456 -12.827 0.699 1064 HB2 ARG 142 2HB ARG 142 11.382 -10.731 1.533 1065 HB3 ARG 142 1HB ARG 142 11.844 -11.002 -0.152 1066 HG2 ARG 142 2HG ARG 142 10.050 -9.462 -0.858 1067 HG3 ARG 142 1HG ARG 142 9.687 -9.146 0.848 1068 HD2 ARG 142 2HD ARG 142 11.125 -7.417 -0.190 1069 HD3 ARG 142 1HD ARG 142 11.883 -8.221 1.194 1070 HE ARG 142 HE ARG 142 12.679 -8.397 -1.598 1071 HH11 ARG 142 1HH1 ARG 142 13.042 -9.656 1.643 1072 HH12 ARG 142 2HH1 ARG 142 14.580 -10.379 1.319 1073 HH21 ARG 142 1HH2 ARG 142 14.698 -9.354 -2.018 1074 HH22 ARG 142 2HH2 ARG 142 15.519 -10.209 -0.755 1075 H LEU 143 H LEU 143 7.604 -11.168 -0.140 1076 HA LEU 143 HA LEU 143 6.869 -10.803 2.675 1077 HB2 LEU 143 2HB LEU 143 6.208 -9.440 0.191 1078 HB3 LEU 143 1HB LEU 143 4.779 -9.824 1.145 1079 HG LEU 143 HG LEU 143 5.679 -7.568 1.592 1080 HD11 LEU 143 1HD1 LEU 143 6.149 -8.315 4.202 1081 HD12 LEU 143 2HD1 LEU 143 5.167 -9.635 3.569 1082 HD13 LEU 143 3HD1 LEU 143 4.574 -7.977 3.483 1083 HD21 LEU 143 3HD2 LEU 143 7.932 -7.480 1.477 1084 HD22 LEU 143 1HD2 LEU 143 8.132 -9.134 2.052 1085 HD23 LEU 143 2HD2 LEU 143 7.821 -7.836 3.201 1086 H THR 144 H THR 144 5.568 -12.205 -0.333 1087 HA THR 144 HA THR 144 3.234 -13.295 0.587 1088 HB THR 144 HB THR 144 3.650 -15.099 -1.138 1089 HG1 THR 144 1HG THR 144 5.952 -15.034 -0.978 1090 HG21 THR 144 3HG2 THR 144 2.572 -12.918 -1.675 1091 HG22 THR 144 1HG2 THR 144 3.415 -13.682 -3.022 1092 HG23 THR 144 2HG2 THR 144 4.159 -12.330 -2.169 1093 H GLY 145 H GLY 145 6.487 -14.332 1.265 1094 HA2 GLY 145 2HA GLY 145 5.536 -16.828 2.468 1095 HA3 GLY 145 1HA GLY 145 7.214 -16.387 2.192 1096 H ASP 146 H ASP 146 8.352 -15.390 3.786 1097 HA ASP 146 HA ASP 146 7.095 -14.086 6.000 1098 HB2 ASP 146 2HB ASP 146 7.873 -16.929 6.214 1099 HB3 ASP 146 1HB ASP 146 8.407 -15.895 7.536 1100 H ALA 147 H ALA 147 9.165 -13.594 3.998 1101 HA ALA 147 HA ALA 147 11.673 -13.570 5.437 1102 HB1 ALA 147 1HB ALA 147 12.096 -12.013 3.239 1103 HB2 ALA 147 2HB ALA 147 10.792 -13.065 2.690 1104 HB3 ALA 147 3HB ALA 147 12.295 -13.765 3.291 1105 H PHE 148 H PHE 148 9.008 -11.434 4.882 1106 HA PHE 148 HA PHE 148 10.196 -8.943 5.251 1107 HB2 PHE 148 2HB PHE 148 7.977 -8.150 5.888 1108 HB3 PHE 148 1HB PHE 148 7.858 -9.275 4.528 1109 HD1 PHE 148 1HD PHE 148 6.994 -11.551 4.883 1110 HD2 PHE 148 2HD PHE 148 6.996 -8.646 7.993 1111 HE1 PHE 148 1HE PHE 148 5.372 -12.905 6.145 1112 HE2 PHE 148 2HE PHE 148 5.374 -9.994 9.259 1113 HZ PHE 148 HZ PHE 148 4.561 -12.127 8.335 1114 H ARG 149 H ARG 149 9.237 -11.382 7.582 1115 HA ARG 149 HA ARG 149 9.492 -9.761 9.889 1116 HB2 ARG 149 2HB ARG 149 9.500 -12.743 9.453 1117 HB3 ARG 149 1HB ARG 149 9.620 -12.018 11.047 1118 HG2 ARG 149 2HG ARG 149 7.456 -10.758 10.335 1119 HG3 ARG 149 1HG ARG 149 7.317 -12.067 9.159 1120 HD2 ARG 149 2HD ARG 149 7.082 -13.687 10.800 1121 HD3 ARG 149 1HD ARG 149 7.829 -12.681 12.041 1122 HE ARG 149 HE ARG 149 5.414 -11.513 11.136 1123 HH11 ARG 149 1HH1 ARG 149 6.620 -14.127 13.108 1124 HH12 ARG 149 2HH1 ARG 149 5.218 -14.173 14.123 1125 HH21 ARG 149 1HH2 ARG 149 3.570 -11.572 12.471 1126 HH22 ARG 149 2HH2 ARG 149 3.486 -12.723 13.762 1127 H LYS 150 H LYS 150 11.095 -10.856 11.660 1128 HA LYS 150 HA LYS 150 13.689 -10.010 10.861 1129 HB2 LYS 150 2HB LYS 150 12.414 -10.990 13.340 1130 HB3 LYS 150 1HB LYS 150 14.144 -11.275 13.215 1131 HG2 LYS 150 2HG LYS 150 13.598 -8.593 12.421 1132 HG3 LYS 150 1HG LYS 150 12.809 -8.910 13.967 1133 HD2 LYS 150 2HD LYS 150 15.232 -10.061 14.376 1134 HD3 LYS 150 1HD LYS 150 15.668 -8.731 13.301 1135 HE2 LYS 150 2HE LYS 150 14.076 -8.457 15.848 1136 HE3 LYS 150 1HE LYS 150 15.799 -8.117 15.688 1137 HZ1 LYS 150 3HZ LYS 150 13.607 -6.715 14.257 1138 HZ2 LYS 150 1HZ LYS 150 15.257 -6.407 14.053 1139 HZ3 LYS 150 2HZ LYS 150 14.516 -6.092 15.539 1140 H LYS 151 H LYS 151 15.660 -11.342 11.138 1141 HA LYS 151 HA LYS 151 15.302 -13.890 9.780 1142 HB2 LYS 151 2HB LYS 151 17.104 -11.954 9.369 1143 HB3 LYS 151 1HB LYS 151 18.007 -12.913 10.533 1144 HG2 LYS 151 2HG LYS 151 17.420 -14.902 8.989 1145 HG3 LYS 151 1HG LYS 151 17.081 -13.653 7.791 1146 HD2 LYS 151 2HD LYS 151 19.295 -14.036 7.351 1147 HD3 LYS 151 1HD LYS 151 19.440 -12.759 8.561 1148 HE2 LYS 151 2HE LYS 151 19.297 -15.485 9.647 1149 HE3 LYS 151 1HE LYS 151 20.726 -15.152 8.670 1150 HZ1 LYS 151 3HZ LYS 151 21.149 -14.639 10.971 1151 HZ2 LYS 151 1HZ LYS 151 19.819 -13.596 11.030 1152 HZ3 LYS 151 2HZ LYS 151 21.156 -13.208 10.069 1153 H HIS 152 H HIS 152 16.427 -15.819 10.489 1154 HA HIS 152 HA HIS 152 16.255 -16.125 13.380 1155 HB2 HIS 152 2HB HIS 152 16.694 -18.198 11.220 1156 HB3 HIS 152 1HB HIS 152 16.404 -18.535 12.924 1157 HD1 HIS 152 1HD HIS 152 14.141 -19.547 12.986 1158 HD2 HIS 152 2HD HIS 152 14.276 -16.184 10.550 1159 HE1 HIS 152 1HE HIS 152 11.766 -19.143 12.264 1160 HE2 HIS 152 2HE HIS 152 11.886 -17.158 10.720 1161 H LEU 153 H LEU 153 17.939 -17.767 14.295 1162 HA LEU 153 HA LEU 153 20.557 -17.783 13.229 1163 HB2 LEU 153 2HB LEU 153 20.243 -15.355 13.953 1164 HB3 LEU 153 1HB LEU 153 20.250 -15.957 15.599 1165 HG LEU 153 HG LEU 153 22.536 -17.072 14.705 1166 HD11 LEU 153 1HD1 LEU 153 22.643 -14.391 13.399 1167 HD12 LEU 153 2HD1 LEU 153 22.040 -15.784 12.502 1168 HD13 LEU 153 3HD1 LEU 153 23.677 -15.799 13.159 1169 HD21 LEU 153 3HD2 LEU 153 21.883 -15.322 16.607 1170 HD22 LEU 153 1HD2 LEU 153 22.761 -14.238 15.528 1171 HD23 LEU 153 2HD2 LEU 153 23.556 -15.674 16.172 1172 H GLU 154 H GLU 154 21.783 -19.291 14.238 1173 HA GLU 154 HA GLU 154 20.949 -20.215 16.897 1174 HB2 GLU 154 2HB GLU 154 21.245 -22.568 16.144 1175 HB3 GLU 154 1HB GLU 154 19.900 -21.750 15.363 1176 HG2 GLU 154 2HG GLU 154 20.731 -22.419 13.427 1177 HG3 GLU 154 1HG GLU 154 22.058 -21.288 13.683 1178 H ASP 155 H ASP 155 22.658 -19.866 18.148 1179 HA ASP 155 HA ASP 155 25.132 -21.180 17.674 1180 HB2 ASP 155 2HB ASP 155 25.007 -18.838 16.309 1181 HB3 ASP 155 1HB ASP 155 25.655 -18.275 17.846 1182 H GLU 156 H GLU 156 23.904 -18.260 19.321 1183 HA GLU 156 HA GLU 156 24.085 -19.476 21.895 1184 HB2 GLU 156 2HB GLU 156 26.465 -18.343 20.913 1185 HB3 GLU 156 1HB GLU 156 25.826 -17.178 22.078 1186 HG2 GLU 156 2HG GLU 156 26.291 -20.103 22.631 1187 HG3 GLU 156 1HG GLU 156 27.387 -18.796 23.076 1188 H LEU 157 H LEU 157 22.097 -18.763 22.430 1189 HA LEU 157 HA LEU 157 21.755 -15.862 22.688 1190 HB2 LEU 157 2HB LEU 157 20.214 -17.669 20.999 1191 HB3 LEU 157 1HB LEU 157 19.202 -16.782 22.122 1192 HG LEU 157 HG LEU 157 19.380 -15.645 19.960 1193 HD11 LEU 157 1HD1 LEU 157 20.154 -14.469 22.517 1194 HD12 LEU 157 2HD1 LEU 157 18.961 -13.936 21.335 1195 HD13 LEU 157 3HD1 LEU 157 20.660 -13.522 21.118 1196 HD21 LEU 157 3HD2 LEU 157 21.337 -15.046 18.951 1197 HD22 LEU 157 1HD2 LEU 157 21.867 -16.518 19.766 1198 HD23 LEU 157 2HD2 LEU 157 22.220 -14.941 20.475 Start of MODEL 19 1 H1 MET 1 1HT MET 1 -26.823 4.841 -16.375 2 H2 MET 1 2HT MET 1 -27.803 5.483 -17.629 3 H3 MET 1 3HT MET 1 -28.529 4.803 -16.230 4 HA MET 1 HA MET 1 -26.907 7.251 -16.398 5 HB2 MET 1 2HB MET 1 -29.824 6.615 -16.021 6 HB3 MET 1 1HB MET 1 -29.151 8.137 -15.451 7 HG2 MET 1 2HG MET 1 -28.483 7.456 -18.223 8 HG3 MET 1 1HG MET 1 -30.195 7.733 -17.913 9 HE1 MET 1 2HE MET 1 -26.740 10.528 -18.138 10 HE2 MET 1 3HE MET 1 -26.710 8.813 -17.730 11 HE3 MET 1 1HE MET 1 -26.848 10.020 -16.452 12 H HIS 2 H HIS 2 -27.244 8.512 -14.277 13 HA HIS 2 HA HIS 2 -27.318 6.760 -11.938 14 HB2 HIS 2 2HB HIS 2 -24.903 7.610 -13.051 15 HB3 HIS 2 1HB HIS 2 -25.164 8.693 -11.688 16 HD1 HIS 2 1HD HIS 2 -24.999 4.974 -12.427 17 HD2 HIS 2 2HD HIS 2 -24.506 7.629 -9.269 18 HE1 HIS 2 1HE HIS 2 -24.136 3.590 -10.513 19 HE2 HIS 2 2HE HIS 2 -23.921 5.203 -8.589 20 H HIS 3 H HIS 3 -28.809 7.620 -10.662 21 HA HIS 3 HA HIS 3 -29.348 10.474 -10.737 22 HB2 HIS 3 2HB HIS 3 -31.247 9.889 -9.228 23 HB3 HIS 3 1HB HIS 3 -31.271 9.018 -10.757 24 HD1 HIS 3 1HD HIS 3 -30.146 8.432 -7.172 25 HD2 HIS 3 2HD HIS 3 -31.551 6.338 -10.473 26 HE1 HIS 3 1HE HIS 3 -30.446 6.062 -6.387 27 HE2 HIS 3 2HE HIS 3 -31.378 4.831 -8.378 28 H HIS 4 H HIS 4 -29.933 11.425 -8.461 29 HA HIS 4 HA HIS 4 -28.565 10.571 -6.169 30 HB2 HIS 4 2HB HIS 4 -26.702 12.172 -6.107 31 HB3 HIS 4 1HB HIS 4 -26.542 11.061 -7.461 32 HD1 HIS 4 1HD HIS 4 -27.524 12.134 -9.823 33 HD2 HIS 4 2HD HIS 4 -26.385 14.763 -6.813 34 HE1 HIS 4 1HE HIS 4 -27.179 14.349 -10.961 35 HE2 HIS 4 2HE HIS 4 -26.404 15.902 -9.134 36 H HIS 5 H HIS 5 -28.028 12.805 -4.801 37 HA HIS 5 HA HIS 5 -28.952 14.532 -3.651 38 HB2 HIS 5 2HB HIS 5 -30.045 15.007 -6.403 39 HB3 HIS 5 1HB HIS 5 -30.607 15.993 -5.058 40 HD1 HIS 5 1HD HIS 5 -27.999 16.467 -3.555 41 HD2 HIS 5 2HD HIS 5 -28.342 16.681 -7.691 42 HE1 HIS 5 1HE HIS 5 -26.092 17.922 -4.315 43 HE2 HIS 5 2HE HIS 5 -26.271 17.968 -6.827 44 H HIS 6 H HIS 6 -31.768 13.887 -5.710 45 HA HIS 6 HA HIS 6 -33.608 13.912 -3.609 46 HB2 HIS 6 2HB HIS 6 -35.183 12.893 -5.223 47 HB3 HIS 6 1HB HIS 6 -34.296 14.247 -5.918 48 HD1 HIS 6 1HD HIS 6 -34.619 10.518 -6.118 49 HD2 HIS 6 2HD HIS 6 -32.613 13.604 -8.044 50 HE1 HIS 6 1HE HIS 6 -33.652 9.494 -8.201 51 HE2 HIS 6 2HE HIS 6 -32.533 11.405 -9.402 52 H HIS 7 H HIS 7 -33.642 12.561 -1.943 53 HA HIS 7 HA HIS 7 -33.704 10.653 -0.708 54 HB2 HIS 7 2HB HIS 7 -35.118 10.064 -3.001 55 HB3 HIS 7 1HB HIS 7 -33.941 8.756 -2.928 56 HD1 HIS 7 1HD HIS 7 -37.098 9.905 -1.479 57 HD2 HIS 7 2HD HIS 7 -34.099 7.210 -0.477 58 HE1 HIS 7 1HE HIS 7 -38.090 8.426 0.296 59 HE2 HIS 7 2HE HIS 7 -36.225 6.864 0.954 60 H MET 8 H MET 8 -32.185 9.350 0.163 61 HA MET 8 HA MET 8 -30.179 8.333 0.486 62 HB2 MET 8 2HB MET 8 -31.201 7.024 -1.549 63 HB3 MET 8 1HB MET 8 -29.908 7.823 -2.452 64 HG2 MET 8 2HG MET 8 -28.277 6.872 -0.843 65 HG3 MET 8 1HG MET 8 -29.599 5.982 -0.091 66 HE1 MET 8 3HE MET 8 -29.972 3.130 -1.251 67 HE2 MET 8 1HE MET 8 -30.903 3.678 -2.644 68 HE3 MET 8 2HE MET 8 -31.051 4.516 -1.100 69 H SER 9 H SER 9 -27.882 8.589 0.211 70 HA SER 9 HA SER 9 -27.199 11.163 -1.047 71 HB2 SER 9 2HB SER 9 -25.238 11.117 0.566 72 HB3 SER 9 1HB SER 9 -26.828 11.306 1.305 73 HG SER 9 HG SER 9 -25.282 9.678 2.214 74 H ASP 10 H ASP 10 -26.374 7.783 -0.813 75 HA ASP 10 HA ASP 10 -25.007 6.445 -2.041 76 HB2 ASP 10 2HB ASP 10 -25.476 8.760 -3.860 77 HB3 ASP 10 1HB ASP 10 -24.204 7.620 -4.289 78 H GLY 11 H GLY 11 -22.743 6.290 -2.993 79 HA2 GLY 11 2HA GLY 11 -20.594 7.606 -3.105 80 HA3 GLY 11 1HA GLY 11 -20.969 8.085 -1.456 81 H HIS 12 H HIS 12 -19.493 5.757 -3.446 82 HA HIS 12 HA HIS 12 -18.237 4.461 -1.278 83 HB2 HIS 12 2HB HIS 12 -20.811 3.481 -1.791 84 HB3 HIS 12 1HB HIS 12 -19.717 2.304 -2.533 85 HD1 HIS 12 1HD HIS 12 -20.869 3.601 0.753 86 HD2 HIS 12 2HD HIS 12 -18.033 0.939 -0.710 87 HE1 HIS 12 1HE HIS 12 -20.095 2.279 2.748 88 HE2 HIS 12 2HE HIS 12 -18.449 0.611 1.821 89 H ASN 13 H ASN 13 -19.306 4.161 -4.635 90 HA ASN 13 HA ASN 13 -17.280 2.422 -5.513 91 HB2 ASN 13 2HB ASN 13 -17.836 3.287 -7.788 92 HB3 ASN 13 1HB ASN 13 -19.247 2.779 -6.864 93 HD21 ASN 13 1HD2 ASN 13 -17.333 5.612 -7.740 94 HD22 ASN 13 2HD2 ASN 13 -18.648 6.731 -7.714 95 H GLY 14 H GLY 14 -15.787 3.294 -7.430 96 HA2 GLY 14 2HA GLY 14 -14.406 5.226 -8.082 97 HA3 GLY 14 1HA GLY 14 -14.329 5.638 -6.366 98 H LEU 15 H LEU 15 -13.593 3.493 -5.067 99 HA LEU 15 HA LEU 15 -11.829 2.190 -4.498 100 HB2 LEU 15 2HB LEU 15 -11.981 1.732 -7.455 101 HB3 LEU 15 1HB LEU 15 -10.684 1.019 -6.518 102 HG LEU 15 HG LEU 15 -12.291 -0.196 -5.150 103 HD11 LEU 15 1HD1 LEU 15 -14.667 -0.163 -5.660 104 HD12 LEU 15 2HD1 LEU 15 -14.397 1.058 -6.905 105 HD13 LEU 15 3HD1 LEU 15 -14.104 1.448 -5.210 106 HD21 LEU 15 3HD2 LEU 15 -13.235 -1.663 -6.932 107 HD22 LEU 15 1HD2 LEU 15 -11.510 -1.331 -7.108 108 HD23 LEU 15 2HD2 LEU 15 -12.680 -0.487 -8.123 109 H GLY 16 H GLY 16 -10.009 2.661 -7.416 110 HA2 GLY 16 2HA GLY 16 -7.916 3.962 -5.963 111 HA3 GLY 16 1HA GLY 16 -7.927 3.639 -7.691 112 H LYS 17 H LYS 17 -10.026 4.992 -8.633 113 HA LYS 17 HA LYS 17 -10.477 7.053 -9.505 114 HB2 LYS 17 2HB LYS 17 -11.087 7.020 -6.665 115 HB3 LYS 17 1HB LYS 17 -10.783 8.651 -7.247 116 HG2 LYS 17 2HG LYS 17 -12.592 6.916 -8.837 117 HG3 LYS 17 1HG LYS 17 -13.187 7.581 -7.313 118 HD2 LYS 17 2HD LYS 17 -13.778 9.309 -8.659 119 HD3 LYS 17 1HD LYS 17 -12.108 9.796 -8.357 120 HE2 LYS 17 2HE LYS 17 -12.437 9.969 -10.693 121 HE3 LYS 17 1HE LYS 17 -11.484 8.507 -10.435 122 HZ1 LYS 17 3HZ LYS 17 -13.077 7.781 -11.893 123 HZ2 LYS 17 1HZ LYS 17 -14.294 8.770 -11.256 124 HZ3 LYS 17 2HZ LYS 17 -13.806 7.382 -10.420 125 H GLY 18 H GLY 18 -8.153 7.122 -10.241 126 HA2 GLY 18 2HA GLY 18 -7.080 9.555 -10.340 127 HA3 GLY 18 1HA GLY 18 -6.474 9.001 -8.775 128 H PHE 19 H PHE 19 -5.801 6.440 -9.167 129 HA PHE 19 HA PHE 19 -3.459 6.694 -10.800 130 HB2 PHE 19 2HB PHE 19 -4.230 5.143 -8.561 131 HB3 PHE 19 1HB PHE 19 -3.824 4.011 -9.857 132 HD1 PHE 19 1HD PHE 19 -1.746 6.048 -11.081 133 HD2 PHE 19 2HD PHE 19 -2.366 4.396 -7.216 134 HE1 PHE 19 1HE PHE 19 0.654 6.301 -10.586 135 HE2 PHE 19 2HE PHE 19 0.024 4.655 -6.710 136 HZ PHE 19 HZ PHE 19 1.540 5.610 -8.398 137 H GLY 20 H GLY 20 -5.560 3.839 -10.680 138 HA2 GLY 20 2HA GLY 20 -5.597 3.908 -13.635 139 HA3 GLY 20 1HA GLY 20 -5.324 2.419 -12.733 140 H ASP 21 H ASP 21 -7.061 1.543 -11.470 141 HA ASP 21 HA ASP 21 -9.699 2.638 -11.646 142 HB2 ASP 21 2HB ASP 21 -10.440 0.354 -12.832 143 HB3 ASP 21 1HB ASP 21 -10.058 1.818 -13.749 144 H HIS 22 H HIS 22 -8.612 -0.752 -11.624 145 HA HIS 22 HA HIS 22 -9.381 -0.921 -8.790 146 HB2 HIS 22 2HB HIS 22 -10.111 -3.361 -9.516 147 HB3 HIS 22 1HB HIS 22 -11.221 -2.004 -9.649 148 HD1 HIS 22 1HD HIS 22 -12.478 -2.156 -11.762 149 HD2 HIS 22 2HD HIS 22 -8.560 -3.463 -12.216 150 HE1 HIS 22 1HE HIS 22 -12.256 -2.783 -14.186 151 HE2 HIS 22 2HE HIS 22 -9.903 -3.655 -14.417 152 H ILE 23 H ILE 23 -7.400 -1.125 -7.904 153 HA ILE 23 HA ILE 23 -5.937 -3.559 -8.317 154 HB ILE 23 HB ILE 23 -4.655 -0.909 -9.001 155 HG12 ILE 23 2HG1 ILE 23 -4.001 -2.596 -11.016 156 HG13 ILE 23 1HG1 ILE 23 -5.584 -3.229 -10.584 157 HG21 ILE 23 1HG2 ILE 23 -3.141 -2.157 -7.626 158 HG22 ILE 23 2HG2 ILE 23 -2.584 -2.219 -9.299 159 HG23 ILE 23 3HG2 ILE 23 -3.401 -3.610 -8.590 160 HD11 ILE 23 3HD1 ILE 23 -6.588 -1.559 -11.645 161 HD12 ILE 23 1HD1 ILE 23 -5.003 -1.045 -12.227 162 HD13 ILE 23 2HD1 ILE 23 -5.663 -0.362 -10.739 163 H HIS 24 H HIS 24 -4.559 -0.497 -7.197 164 HA HIS 24 HA HIS 24 -4.092 -1.684 -4.610 165 HB2 HIS 24 2HB HIS 24 -3.278 1.116 -5.322 166 HB3 HIS 24 1HB HIS 24 -2.496 -0.008 -4.214 167 HD1 HIS 24 1HD HIS 24 -3.060 0.336 -7.975 168 HD2 HIS 24 2HD HIS 24 -0.301 -1.178 -5.266 169 HE1 HIS 24 1HE HIS 24 -1.107 -0.446 -9.354 170 HE2 HIS 24 2HE HIS 24 0.572 -1.292 -7.689 171 H TRP 25 H TRP 25 -6.750 -1.188 -5.173 172 HA TRP 25 HA TRP 25 -7.488 0.448 -2.908 173 HB2 TRP 25 2HB TRP 25 -9.258 1.411 -4.794 174 HB3 TRP 25 1HB TRP 25 -7.837 2.269 -4.191 175 HD1 TRP 25 HD TRP 25 -9.115 0.376 -7.221 176 HE1 TRP 25 1HE TRP 25 -7.452 0.654 -9.143 177 HE3 TRP 25 3HE TRP 25 -5.350 2.761 -4.737 178 HZ2 TRP 25 2HZ TRP 25 -4.905 1.763 -9.590 179 HZ3 TRP 25 3HZ TRP 25 -3.344 3.394 -5.974 180 HH2 TRP 25 HH TRP 25 -3.117 2.905 -8.358 181 H ARG 26 H ARG 26 -7.716 -2.299 -4.487 182 HA ARG 26 HA ARG 26 -10.273 -2.933 -5.084 183 HB2 ARG 26 2HB ARG 26 -7.913 -4.374 -4.351 184 HB3 ARG 26 1HB ARG 26 -9.302 -5.122 -3.553 185 HG2 ARG 26 2HG ARG 26 -10.185 -5.863 -5.493 186 HG3 ARG 26 1HG ARG 26 -9.638 -4.459 -6.410 187 HD2 ARG 26 2HD ARG 26 -7.387 -5.328 -6.489 188 HD3 ARG 26 1HD ARG 26 -7.845 -6.684 -5.444 189 HE ARG 26 HE ARG 26 -9.441 -6.614 -7.792 190 HH11 ARG 26 1HH1 ARG 26 -6.259 -7.472 -6.641 191 HH12 ARG 26 2HH1 ARG 26 -5.999 -8.662 -7.871 192 HH21 ARG 26 1HH2 ARG 26 -9.098 -8.179 -9.411 193 HH22 ARG 26 2HH2 ARG 26 -7.610 -9.062 -9.445 194 H THR 27 H THR 27 -8.830 -2.927 -1.837 195 HA THR 27 HA THR 27 -10.849 -1.882 -0.384 196 HB THR 27 HB THR 27 -12.515 -3.405 -1.061 197 HG1 THR 27 1HG THR 27 -12.731 -3.254 1.093 198 HG21 THR 27 3HG2 THR 27 -11.268 -5.905 -0.220 199 HG22 THR 27 1HG2 THR 27 -10.540 -5.175 -1.651 200 HG23 THR 27 2HG2 THR 27 -12.264 -5.546 -1.629 201 H LEU 28 H LEU 28 -10.535 -1.977 1.838 202 HA LEU 28 HA LEU 28 -8.017 -3.220 2.642 203 HB2 LEU 28 2HB LEU 28 -8.568 -0.776 3.077 204 HB3 LEU 28 1HB LEU 28 -9.735 -1.351 4.268 205 HG LEU 28 HG LEU 28 -6.953 -2.353 4.533 206 HD11 LEU 28 1HD1 LEU 28 -6.622 -0.160 5.955 207 HD12 LEU 28 2HD1 LEU 28 -7.726 0.509 4.752 208 HD13 LEU 28 3HD1 LEU 28 -6.201 -0.215 4.243 209 HD21 LEU 28 3HD2 LEU 28 -9.152 -1.481 6.391 210 HD22 LEU 28 1HD2 LEU 28 -7.532 -1.905 6.944 211 HD23 LEU 28 2HD2 LEU 28 -8.529 -3.110 6.130 212 H GLU 29 H GLU 29 -11.359 -2.939 3.840 213 HA GLU 29 HA GLU 29 -11.091 -4.806 5.925 214 HB2 GLU 29 2HB GLU 29 -13.044 -3.088 5.147 215 HB3 GLU 29 1HB GLU 29 -13.738 -4.617 4.628 216 HG2 GLU 29 2HG GLU 29 -12.783 -5.096 7.199 217 HG3 GLU 29 1HG GLU 29 -13.520 -3.497 7.271 218 H ASP 30 H ASP 30 -12.142 -5.163 2.563 219 HA ASP 30 HA ASP 30 -12.534 -8.015 2.885 220 HB2 ASP 30 2HB ASP 30 -13.022 -6.022 0.730 221 HB3 ASP 30 1HB ASP 30 -12.757 -7.700 0.236 222 H GLY 31 H GLY 31 -10.133 -5.815 1.580 223 HA2 GLY 31 2HA GLY 31 -8.632 -7.677 0.087 224 HA3 GLY 31 1HA GLY 31 -8.011 -6.172 0.777 225 H LYS 32 H LYS 32 -8.692 -6.937 3.516 226 HA LYS 32 HA LYS 32 -6.326 -8.518 4.046 227 HB2 LYS 32 2HB LYS 32 -6.642 -7.913 6.360 228 HB3 LYS 32 1HB LYS 32 -6.852 -6.480 5.366 229 HG2 LYS 32 2HG LYS 32 -8.659 -6.188 6.668 230 HG3 LYS 32 1HG LYS 32 -9.403 -7.303 5.521 231 HD2 LYS 32 2HD LYS 32 -8.466 -9.129 7.143 232 HD3 LYS 32 1HD LYS 32 -8.441 -7.800 8.304 233 HE2 LYS 32 2HE LYS 32 -10.905 -8.297 6.697 234 HE3 LYS 32 1HE LYS 32 -10.552 -9.334 8.077 235 HZ1 LYS 32 3HZ LYS 32 -10.336 -6.471 8.537 236 HZ2 LYS 32 1HZ LYS 32 -10.965 -7.684 9.535 237 HZ3 LYS 32 2HZ LYS 32 -11.900 -7.059 8.271 238 H LYS 33 H LYS 33 -9.821 -8.815 4.373 239 HA LYS 33 HA LYS 33 -9.830 -11.225 5.851 240 HB2 LYS 33 2HB LYS 33 -11.790 -9.708 5.602 241 HB3 LYS 33 1HB LYS 33 -11.933 -10.215 3.926 242 HG2 LYS 33 2HG LYS 33 -12.091 -12.603 4.908 243 HG3 LYS 33 1HG LYS 33 -12.474 -11.766 6.422 244 HD2 LYS 33 2HD LYS 33 -14.524 -11.182 5.712 245 HD3 LYS 33 1HD LYS 33 -13.955 -10.785 4.088 246 HE2 LYS 33 2HE LYS 33 -13.771 -13.307 3.730 247 HE3 LYS 33 1HE LYS 33 -14.735 -13.465 5.198 248 HZ1 LYS 33 3HZ LYS 33 -15.609 -11.827 2.890 249 HZ2 LYS 33 1HZ LYS 33 -16.539 -12.365 4.197 250 HZ3 LYS 33 2HZ LYS 33 -15.994 -13.467 3.037 251 H GLU 34 H GLU 34 -9.840 -10.512 2.399 252 HA GLU 34 HA GLU 34 -9.983 -13.299 1.657 253 HB2 GLU 34 2HB GLU 34 -10.975 -11.444 0.287 254 HB3 GLU 34 1HB GLU 34 -9.334 -10.918 -0.091 255 HG2 GLU 34 2HG GLU 34 -9.053 -12.508 -1.629 256 HG3 GLU 34 1HG GLU 34 -9.805 -13.751 -0.617 257 H ALA 35 H ALA 35 -7.534 -10.872 2.153 258 HA ALA 35 HA ALA 35 -5.402 -12.011 0.755 259 HB1 ALA 35 1HB ALA 35 -4.840 -9.926 1.462 260 HB2 ALA 35 2HB ALA 35 -4.088 -10.850 2.761 261 HB3 ALA 35 3HB ALA 35 -5.667 -10.106 3.008 262 H ALA 36 H ALA 36 -6.807 -12.806 3.853 263 HA ALA 36 HA ALA 36 -4.693 -14.385 4.861 264 HB1 ALA 36 1HB ALA 36 -6.620 -15.457 6.206 265 HB2 ALA 36 2HB ALA 36 -7.625 -14.219 5.450 266 HB3 ALA 36 3HB ALA 36 -6.256 -13.749 6.458 267 H ALA 37 H ALA 37 -7.463 -15.124 2.805 268 HA ALA 37 HA ALA 37 -7.265 -17.917 2.826 269 HB1 ALA 37 1HB ALA 37 -8.863 -16.019 1.562 270 HB2 ALA 37 2HB ALA 37 -9.033 -17.773 1.485 271 HB3 ALA 37 3HB ALA 37 -8.106 -16.922 0.249 272 H SER 38 H SER 38 -6.396 -15.940 -0.000 273 HA SER 38 HA SER 38 -4.671 -17.896 -1.075 274 HB2 SER 38 2HB SER 38 -4.169 -16.323 -2.774 275 HB3 SER 38 1HB SER 38 -5.836 -15.966 -2.298 276 HG SER 38 HG SER 38 -4.927 -14.320 -0.911 277 H GLY 39 H GLY 39 -4.173 -15.257 1.146 278 HA2 GLY 39 2HA GLY 39 -2.381 -15.046 2.633 279 HA3 GLY 39 1HA GLY 39 -1.489 -16.244 1.690 280 H LEU 40 H LEU 40 -3.022 -13.287 0.496 281 HA LEU 40 HA LEU 40 -0.379 -12.409 -0.430 282 HB2 LEU 40 2HB LEU 40 -1.481 -11.152 -2.131 283 HB3 LEU 40 1HB LEU 40 -2.161 -12.769 -2.130 284 HG LEU 40 HG LEU 40 -3.996 -11.668 -0.600 285 HD11 LEU 40 1HD1 LEU 40 -2.463 -9.392 -1.579 286 HD12 LEU 40 2HD1 LEU 40 -3.640 -9.487 -0.268 287 HD13 LEU 40 3HD1 LEU 40 -4.185 -9.281 -1.933 288 HD21 LEU 40 3HD2 LEU 40 -3.813 -12.373 -3.268 289 HD22 LEU 40 1HD2 LEU 40 -4.478 -10.739 -3.305 290 HD23 LEU 40 2HD2 LEU 40 -5.292 -12.002 -2.381 291 HA PRO 41 HA PRO 41 -0.533 -9.098 2.538 292 HB2 PRO 41 2HB PRO 41 1.429 -7.539 1.520 293 HB3 PRO 41 1HB PRO 41 1.767 -9.058 2.359 294 HG2 PRO 41 2HG PRO 41 1.638 -8.509 -0.581 295 HG3 PRO 41 1HG PRO 41 2.826 -9.462 0.326 296 HD2 PRO 41 2HD PRO 41 0.784 -10.596 -1.047 297 HD3 PRO 41 1HD PRO 41 1.450 -11.306 0.437 298 H LEU 42 H LEU 42 -0.551 -6.559 2.438 299 HA LEU 42 HA LEU 42 -2.019 -5.724 0.040 300 HB2 LEU 42 2HB LEU 42 -3.728 -4.672 1.268 301 HB3 LEU 42 1HB LEU 42 -3.556 -6.277 1.948 302 HG LEU 42 HG LEU 42 -2.109 -4.003 3.240 303 HD11 LEU 42 1HD1 LEU 42 -4.914 -4.651 4.035 304 HD12 LEU 42 2HD1 LEU 42 -4.604 -3.467 2.764 305 HD13 LEU 42 3HD1 LEU 42 -3.952 -3.214 4.383 306 HD21 LEU 42 3HD2 LEU 42 -1.909 -5.412 4.985 307 HD22 LEU 42 1HD2 LEU 42 -2.196 -6.649 3.759 308 HD23 LEU 42 2HD2 LEU 42 -3.526 -6.079 4.767 309 H MET 43 H MET 43 -1.770 -3.668 -0.633 310 HA MET 43 HA MET 43 0.343 -2.121 0.717 311 HB2 MET 43 2HB MET 43 1.084 -2.668 -1.460 312 HB3 MET 43 1HB MET 43 -0.502 -2.348 -2.169 313 HG2 MET 43 2HG MET 43 -0.199 0.035 -1.796 314 HG3 MET 43 1HG MET 43 1.361 -0.266 -1.032 315 HE1 MET 43 3HE MET 43 3.264 -1.666 -2.337 316 HE2 MET 43 1HE MET 43 3.358 -1.787 -4.093 317 HE3 MET 43 2HE MET 43 2.202 -2.776 -3.203 318 H VAL 44 H VAL 44 0.110 0.311 0.410 319 HA VAL 44 HA VAL 44 -2.677 1.183 0.292 320 HB VAL 44 HB VAL 44 -0.821 1.845 2.582 321 HG11 VAL 44 1HG1 VAL 44 -2.109 3.789 2.067 322 HG12 VAL 44 2HG1 VAL 44 -2.821 3.038 3.492 323 HG13 VAL 44 3HG1 VAL 44 -3.586 2.841 1.916 324 HG21 VAL 44 3HG2 VAL 44 -3.481 0.454 2.721 325 HG22 VAL 44 1HG2 VAL 44 -2.237 0.583 3.969 326 HG23 VAL 44 2HG2 VAL 44 -1.953 -0.422 2.548 327 H ILE 45 H ILE 45 -2.593 2.539 -1.376 328 HA ILE 45 HA ILE 45 -0.332 4.389 -1.619 329 HB ILE 45 HB ILE 45 -2.525 3.710 -3.586 330 HG12 ILE 45 2HG1 ILE 45 0.395 2.934 -3.424 331 HG13 ILE 45 1HG1 ILE 45 -1.007 1.860 -3.343 332 HG21 ILE 45 1HG2 ILE 45 -1.219 5.006 -5.210 333 HG22 ILE 45 2HG2 ILE 45 -0.109 5.484 -3.926 334 HG23 ILE 45 3HG2 ILE 45 -1.793 6.007 -3.875 335 HD11 ILE 45 3HD1 ILE 45 -1.404 3.003 -5.751 336 HD12 ILE 45 1HD1 ILE 45 -0.509 1.504 -5.499 337 HD13 ILE 45 2HD1 ILE 45 0.358 3.030 -5.666 338 H ILE 46 H ILE 46 -0.729 6.126 -0.312 339 HA ILE 46 HA ILE 46 -3.363 7.406 -0.530 340 HB ILE 46 HB ILE 46 -1.341 8.027 1.600 341 HG12 ILE 46 2HG1 ILE 46 -3.442 6.203 2.438 342 HG13 ILE 46 1HG1 ILE 46 -2.396 5.480 1.215 343 HG21 ILE 46 1HG2 ILE 46 -3.377 9.459 1.197 344 HG22 ILE 46 2HG2 ILE 46 -3.187 8.821 2.833 345 HG23 ILE 46 3HG2 ILE 46 -4.335 8.080 1.726 346 HD11 ILE 46 3HD1 ILE 46 -1.754 5.125 3.631 347 HD12 ILE 46 1HD1 ILE 46 -1.345 6.842 3.675 348 HD13 ILE 46 2HD1 ILE 46 -0.488 5.757 2.576 349 H HIS 47 H HIS 47 -3.515 9.472 -1.263 350 HA HIS 47 HA HIS 47 -0.982 10.886 -1.798 351 HB2 HIS 47 2HB HIS 47 -2.045 11.728 -3.929 352 HB3 HIS 47 1HB HIS 47 -1.623 10.010 -3.915 353 HD1 HIS 47 1HD HIS 47 -4.182 12.054 -5.101 354 HD2 HIS 47 2HD HIS 47 -4.170 8.532 -2.898 355 HE1 HIS 47 1HE HIS 47 -6.458 11.042 -5.442 356 HE2 HIS 47 2HE HIS 47 -6.398 8.868 -4.169 357 H LYS 48 H LYS 48 -1.099 12.413 -0.243 358 HA LYS 48 HA LYS 48 -3.429 14.225 -0.391 359 HB2 LYS 48 2HB LYS 48 -2.024 13.111 1.998 360 HB3 LYS 48 1HB LYS 48 -2.730 14.716 2.098 361 HG2 LYS 48 2HG LYS 48 -4.875 13.604 1.230 362 HG3 LYS 48 1HG LYS 48 -4.092 12.085 1.669 363 HD2 LYS 48 2HD LYS 48 -5.337 12.642 3.565 364 HD3 LYS 48 1HD LYS 48 -3.703 13.183 3.960 365 HE2 LYS 48 2HE LYS 48 -4.455 15.454 3.017 366 HE3 LYS 48 1HE LYS 48 -6.092 14.821 3.177 367 HZ1 LYS 48 3HZ LYS 48 -4.162 15.527 5.265 368 HZ2 LYS 48 1HZ LYS 48 -5.256 14.274 5.579 369 HZ3 LYS 48 2HZ LYS 48 -5.826 15.820 5.192 370 H SER 49 H SER 49 -3.010 16.460 0.087 371 HA SER 49 HA SER 49 -1.876 18.404 -0.269 372 HB2 SER 49 2HB SER 49 -0.092 16.744 1.413 373 HB3 SER 49 1HB SER 49 0.672 18.119 0.614 374 HG SER 49 HG SER 49 -1.516 18.128 2.410 375 H TRP 50 H TRP 50 0.574 19.148 -1.064 376 HA TRP 50 HA TRP 50 0.654 18.733 -3.775 377 HB2 TRP 50 2HB TRP 50 3.077 19.440 -3.638 378 HB3 TRP 50 1HB TRP 50 1.932 20.522 -2.833 379 HD1 TRP 50 HD TRP 50 4.771 18.071 -2.097 380 HE1 TRP 50 1HE TRP 50 5.527 18.392 0.343 381 HE3 TRP 50 3HE TRP 50 1.106 21.272 -0.525 382 HZ2 TRP 50 2HZ TRP 50 4.682 19.814 2.630 383 HZ3 TRP 50 3HZ TRP 50 1.153 22.065 1.803 384 HH2 TRP 50 HH TRP 50 2.904 21.350 3.349 385 H CYS 51 H CYS 51 1.553 17.260 -5.166 386 HA CYS 51 HA CYS 51 3.475 15.332 -4.374 387 HB2 CYS 51 2HB CYS 51 2.137 13.837 -3.378 388 HB3 CYS 51 1HB CYS 51 0.702 14.742 -3.821 389 H GLY 52 H GLY 52 4.334 14.219 -6.123 390 HA2 GLY 52 2HA GLY 52 3.277 15.035 -8.755 391 HA3 GLY 52 1HA GLY 52 4.931 14.503 -8.444 392 H ALA 53 H ALA 53 4.009 12.275 -6.753 393 HA ALA 53 HA ALA 53 3.917 10.245 -8.669 394 HB1 ALA 53 1HB ALA 53 3.110 10.234 -5.768 395 HB2 ALA 53 2HB ALA 53 4.650 9.722 -6.456 396 HB3 ALA 53 3HB ALA 53 3.191 8.784 -6.769 397 H CYS 54 H CYS 54 1.526 12.379 -7.664 398 HA CYS 54 HA CYS 54 -0.617 10.610 -8.494 399 HB2 CYS 54 2HB CYS 54 -2.025 12.714 -7.787 400 HB3 CYS 54 1HB CYS 54 -1.357 11.637 -6.556 401 H LYS 55 H LYS 55 0.978 13.644 -9.293 402 HA LYS 55 HA LYS 55 -0.698 14.497 -11.355 403 HB2 LYS 55 2HB LYS 55 0.870 16.095 -11.779 404 HB3 LYS 55 1HB LYS 55 1.446 15.577 -10.203 405 HG2 LYS 55 2HG LYS 55 3.019 14.025 -11.420 406 HG3 LYS 55 1HG LYS 55 2.554 14.867 -12.907 407 HD2 LYS 55 2HD LYS 55 3.361 16.959 -12.024 408 HD3 LYS 55 1HD LYS 55 3.689 16.217 -10.457 409 HE2 LYS 55 2HE LYS 55 4.975 14.933 -12.776 410 HE3 LYS 55 1HE LYS 55 5.543 16.557 -12.393 411 HZ1 LYS 55 3HZ LYS 55 6.770 14.720 -11.271 412 HZ2 LYS 55 1HZ LYS 55 5.369 14.382 -10.386 413 HZ3 LYS 55 2HZ LYS 55 6.136 15.879 -10.217 414 H ALA 56 H ALA 56 2.186 12.387 -11.509 415 HA ALA 56 HA ALA 56 1.744 11.873 -14.336 416 HB1 ALA 56 1HB ALA 56 3.805 11.176 -12.331 417 HB2 ALA 56 2HB ALA 56 3.982 11.733 -13.996 418 HB3 ALA 56 3HB ALA 56 3.582 10.047 -13.667 419 H LEU 57 H LEU 57 0.925 10.488 -11.298 420 HA LEU 57 HA LEU 57 0.529 7.845 -11.704 421 HB2 LEU 57 2HB LEU 57 -0.138 8.209 -9.618 422 HB3 LEU 57 1HB LEU 57 -0.444 9.886 -9.963 423 HG LEU 57 HG LEU 57 -2.549 7.967 -10.779 424 HD11 LEU 57 1HD1 LEU 57 -1.552 7.482 -8.363 425 HD12 LEU 57 2HD1 LEU 57 -3.282 7.403 -8.703 426 HD13 LEU 57 3HD1 LEU 57 -2.595 8.844 -7.952 427 HD21 LEU 57 3HD2 LEU 57 -4.004 9.765 -10.041 428 HD22 LEU 57 1HD2 LEU 57 -2.779 10.385 -11.142 429 HD23 LEU 57 2HD2 LEU 57 -2.616 10.649 -9.409 430 H LYS 58 H LYS 58 -1.754 10.392 -12.681 431 HA LYS 58 HA LYS 58 -3.774 8.656 -13.548 432 HB2 LYS 58 2HB LYS 58 -4.078 10.833 -15.225 433 HB3 LYS 58 1HB LYS 58 -4.811 10.619 -13.646 434 HG2 LYS 58 2HG LYS 58 -2.101 11.752 -13.589 435 HG3 LYS 58 1HG LYS 58 -3.310 12.744 -14.396 436 HD2 LYS 58 2HD LYS 58 -4.143 11.564 -11.828 437 HD3 LYS 58 1HD LYS 58 -2.867 12.780 -11.736 438 HE2 LYS 58 2HE LYS 58 -4.426 14.161 -13.285 439 HE3 LYS 58 1HE LYS 58 -5.679 13.052 -12.726 440 HZ1 LYS 58 3HZ LYS 58 -4.014 14.855 -11.057 441 HZ2 LYS 58 1HZ LYS 58 -5.050 13.677 -10.425 442 HZ3 LYS 58 2HZ LYS 58 -5.680 14.962 -11.325 443 HA PRO 59 HA PRO 59 -2.287 8.871 -18.099 444 HB2 PRO 59 2HB PRO 59 -0.044 10.213 -18.738 445 HB3 PRO 59 1HB PRO 59 -1.617 11.019 -18.570 446 HG2 PRO 59 2HG PRO 59 0.633 10.828 -16.594 447 HG3 PRO 59 1HG PRO 59 -0.333 12.241 -17.057 448 HD2 PRO 59 2HD PRO 59 -0.821 10.806 -14.801 449 HD3 PRO 59 1HD PRO 59 -2.106 11.629 -15.727 450 H LYS 60 H LYS 60 0.004 8.355 -15.576 451 HA LYS 60 HA LYS 60 1.712 6.691 -17.243 452 HB2 LYS 60 2HB LYS 60 3.042 7.796 -15.697 453 HB3 LYS 60 1HB LYS 60 1.831 7.690 -14.428 454 HG2 LYS 60 2HG LYS 60 3.755 6.269 -13.957 455 HG3 LYS 60 1HG LYS 60 2.267 5.323 -14.153 456 HD2 LYS 60 2HD LYS 60 4.053 4.212 -15.331 457 HD3 LYS 60 1HD LYS 60 2.946 4.901 -16.518 458 HE2 LYS 60 2HE LYS 60 4.707 6.947 -16.168 459 HE3 LYS 60 1HE LYS 60 5.755 5.544 -15.953 460 HZ1 LYS 60 3HZ LYS 60 4.109 6.236 -18.316 461 HZ2 LYS 60 1HZ LYS 60 4.778 4.697 -18.096 462 HZ3 LYS 60 2HZ LYS 60 5.787 6.047 -18.233 463 H PHE 61 H PHE 61 -0.027 6.303 -14.189 464 HA PHE 61 HA PHE 61 0.090 3.555 -14.019 465 HB2 PHE 61 2HB PHE 61 -0.666 5.247 -12.304 466 HB3 PHE 61 1HB PHE 61 -2.236 5.212 -13.106 467 HD1 PHE 61 2HD PHE 61 -3.482 3.038 -13.241 468 HD2 PHE 61 1HD PHE 61 -0.055 3.566 -10.778 469 HE1 PHE 61 2HE PHE 61 -4.119 1.052 -11.936 470 HE2 PHE 61 1HE PHE 61 -0.681 1.579 -9.471 471 HZ PHE 61 HZ PHE 61 -2.719 0.321 -10.050 472 H ALA 62 H ALA 62 -1.772 5.537 -16.142 473 HA ALA 62 HA ALA 62 -3.920 3.867 -16.713 474 HB1 ALA 62 1HB ALA 62 -2.923 6.221 -17.727 475 HB2 ALA 62 2HB ALA 62 -4.315 5.342 -18.364 476 HB3 ALA 62 3HB ALA 62 -2.719 5.101 -19.076 477 H GLU 63 H GLU 63 -0.564 3.488 -17.229 478 HA GLU 63 HA GLU 63 -0.642 1.506 -19.302 479 HB2 GLU 63 2HB GLU 63 1.284 3.165 -18.504 480 HB3 GLU 63 1HB GLU 63 1.689 1.800 -17.458 481 HG2 GLU 63 2HG GLU 63 1.673 0.385 -19.574 482 HG3 GLU 63 1HG GLU 63 1.661 1.910 -20.458 483 H SER 64 H SER 64 -1.247 1.532 -16.001 484 HA SER 64 HA SER 64 -0.281 -0.891 -15.087 485 HB2 SER 64 2HB SER 64 -2.732 0.689 -14.376 486 HB3 SER 64 1HB SER 64 -2.259 -0.752 -13.498 487 HG SER 64 HG SER 64 -0.501 1.425 -13.894 488 H THR 65 H THR 65 -2.185 -0.622 -17.749 489 HA THR 65 HA THR 65 -4.286 -2.368 -17.514 490 HB THR 65 HB THR 65 -2.583 -2.803 -19.899 491 HG1 THR 65 1HG THR 65 -2.640 -0.767 -20.603 492 HG21 THR 65 3HG2 THR 65 -5.406 -1.799 -19.663 493 HG22 THR 65 1HG2 THR 65 -4.950 -3.497 -19.801 494 HG23 THR 65 2HG2 THR 65 -4.597 -2.379 -21.119 495 H GLU 66 H GLU 66 -0.854 -3.038 -17.726 496 HA GLU 66 HA GLU 66 -1.211 -5.907 -17.699 497 HB2 GLU 66 2HB GLU 66 0.901 -4.163 -18.359 498 HB3 GLU 66 1HB GLU 66 1.441 -5.036 -16.923 499 HG2 GLU 66 2HG GLU 66 0.469 -7.081 -18.365 500 HG3 GLU 66 1HG GLU 66 0.962 -5.999 -19.667 501 H ILE 67 H ILE 67 -0.656 -3.281 -15.462 502 HA ILE 67 HA ILE 67 -0.000 -4.945 -13.232 503 HB ILE 67 HB ILE 67 -1.163 -2.155 -13.290 504 HG12 ILE 67 2HG1 ILE 67 1.681 -3.150 -13.014 505 HG13 ILE 67 1HG1 ILE 67 1.005 -2.246 -14.375 506 HG21 ILE 67 1HG2 ILE 67 -1.462 -2.374 -11.099 507 HG22 ILE 67 2HG2 ILE 67 0.286 -2.523 -10.932 508 HG23 ILE 67 3HG2 ILE 67 -0.709 -3.968 -11.102 509 HD11 ILE 67 3HD1 ILE 67 2.156 -1.287 -11.921 510 HD12 ILE 67 1HD1 ILE 67 0.521 -0.661 -12.137 511 HD13 ILE 67 2HD1 ILE 67 1.737 -0.407 -13.390 512 H SER 68 H SER 68 -2.858 -4.355 -14.976 513 HA SER 68 HA SER 68 -4.772 -4.677 -12.901 514 HB2 SER 68 2HB SER 68 -4.938 -3.999 -15.530 515 HB3 SER 68 1HB SER 68 -5.470 -5.680 -15.600 516 HG SER 68 HG SER 68 -7.032 -3.809 -15.103 517 H GLU 69 H GLU 69 -2.851 -6.827 -14.851 518 HA GLU 69 HA GLU 69 -4.258 -9.197 -13.975 519 HB2 GLU 69 2HB GLU 69 -1.617 -9.130 -15.421 520 HB3 GLU 69 1HB GLU 69 -2.813 -10.419 -15.402 521 HG2 GLU 69 2HG GLU 69 -3.245 -7.721 -16.657 522 HG3 GLU 69 1HG GLU 69 -2.715 -9.158 -17.530 523 H LEU 70 H LEU 70 -1.154 -7.597 -13.451 524 HA LEU 70 HA LEU 70 -0.055 -9.519 -11.703 525 HB2 LEU 70 2HB LEU 70 0.458 -6.633 -12.273 526 HB3 LEU 70 1HB LEU 70 1.191 -7.350 -10.838 527 HG LEU 70 HG LEU 70 2.154 -9.125 -12.384 528 HD11 LEU 70 1HD1 LEU 70 0.622 -8.657 -14.270 529 HD12 LEU 70 2HD1 LEU 70 2.324 -8.610 -14.727 530 HD13 LEU 70 3HD1 LEU 70 1.431 -7.106 -14.504 531 HD21 LEU 70 3HD2 LEU 70 3.158 -6.389 -13.073 532 HD22 LEU 70 1HD2 LEU 70 4.070 -7.865 -12.757 533 HD23 LEU 70 2HD2 LEU 70 3.287 -7.010 -11.427 534 H SER 71 H SER 71 -2.626 -7.345 -11.266 535 HA SER 71 HA SER 71 -2.372 -6.790 -8.501 536 HB2 SER 71 2HB SER 71 -3.905 -5.748 -10.389 537 HB3 SER 71 1HB SER 71 -5.039 -6.965 -9.795 538 HG SER 71 HG SER 71 -5.465 -5.514 -8.334 539 H HIS 72 H HIS 72 -3.796 -9.464 -10.285 540 HA HIS 72 HA HIS 72 -5.383 -10.518 -8.227 541 HB2 HIS 72 2HB HIS 72 -5.447 -12.570 -9.483 542 HB3 HIS 72 1HB HIS 72 -5.505 -11.219 -10.620 543 HD1 HIS 72 1HD HIS 72 -4.317 -11.974 -12.644 544 HD2 HIS 72 2HD HIS 72 -2.316 -13.111 -9.184 545 HE1 HIS 72 1HE HIS 72 -2.200 -13.082 -13.424 546 HE2 HIS 72 2HE HIS 72 -0.964 -13.680 -11.312 547 H ASN 73 H ASN 73 -2.050 -10.264 -8.503 548 HA ASN 73 HA ASN 73 -1.345 -12.584 -6.968 549 HB2 ASN 73 2HB ASN 73 0.198 -10.161 -7.898 550 HB3 ASN 73 1HB ASN 73 0.916 -11.491 -6.993 551 HD21 ASN 73 1HD2 ASN 73 -0.650 -10.583 -9.979 552 HD22 ASN 73 2HD2 ASN 73 -0.059 -11.924 -10.918 553 H PHE 74 H PHE 74 -2.725 -9.667 -6.139 554 HA PHE 74 HA PHE 74 -2.541 -10.070 -3.402 555 HB2 PHE 74 2HB PHE 74 -1.052 -8.243 -2.708 556 HB3 PHE 74 1HB PHE 74 -0.197 -9.467 -3.648 557 HD1 PHE 74 2HD PHE 74 -1.397 -8.325 -6.364 558 HD2 PHE 74 1HD PHE 74 0.700 -6.629 -3.068 559 HE1 PHE 74 2HE PHE 74 -0.520 -6.570 -7.834 560 HE2 PHE 74 1HE PHE 74 1.580 -4.870 -4.542 561 HZ PHE 74 HZ PHE 74 0.970 -4.839 -6.926 562 H VAL 75 H VAL 75 -2.819 -7.479 -2.369 563 HA VAL 75 HA VAL 75 -4.685 -6.032 -4.059 564 HB VAL 75 HB VAL 75 -6.118 -7.797 -3.134 565 HG11 VAL 75 1HG1 VAL 75 -6.104 -6.764 -0.398 566 HG12 VAL 75 2HG1 VAL 75 -4.610 -7.574 -0.870 567 HG13 VAL 75 3HG1 VAL 75 -6.150 -8.426 -0.985 568 HG21 VAL 75 3HG2 VAL 75 -6.570 -5.016 -3.039 569 HG22 VAL 75 1HG2 VAL 75 -7.307 -5.702 -1.590 570 HG23 VAL 75 2HG2 VAL 75 -7.762 -6.308 -3.182 571 H MET 76 H MET 76 -4.659 -3.856 -3.575 572 HA MET 76 HA MET 76 -3.474 -3.138 -1.003 573 HB2 MET 76 2HB MET 76 -3.335 -1.040 -2.996 574 HB3 MET 76 1HB MET 76 -2.104 -1.652 -1.928 575 HG2 MET 76 2HG MET 76 -2.839 -2.654 -4.656 576 HG3 MET 76 1HG MET 76 -1.317 -1.977 -4.110 577 HE1 MET 76 3HE MET 76 -3.334 -4.796 -4.959 578 HE2 MET 76 1HE MET 76 -2.306 -6.188 -4.643 579 HE3 MET 76 2HE MET 76 -1.772 -4.941 -5.763 580 H VAL 77 H VAL 77 -3.919 -0.463 -0.956 581 HA VAL 77 HA VAL 77 -6.800 -0.077 -1.223 582 HB VAL 77 HB VAL 77 -5.292 -0.390 1.298 583 HG11 VAL 77 1HG1 VAL 77 -5.757 1.733 1.931 584 HG12 VAL 77 2HG1 VAL 77 -7.298 0.982 2.355 585 HG13 VAL 77 3HG1 VAL 77 -7.145 1.882 0.846 586 HG21 VAL 77 3HG2 VAL 77 -7.127 -1.609 1.941 587 HG22 VAL 77 1HG2 VAL 77 -7.098 -1.874 0.196 588 HG23 VAL 77 2HG2 VAL 77 -8.227 -0.707 0.897 589 H ASN 78 H ASN 78 -7.376 1.972 -1.689 590 HA ASN 78 HA ASN 78 -5.250 3.986 -1.776 591 HB2 ASN 78 2HB ASN 78 -6.415 3.474 -3.900 592 HB3 ASN 78 1HB ASN 78 -7.927 3.995 -3.177 593 HD21 ASN 78 1HD2 ASN 78 -4.730 5.431 -2.804 594 HD22 ASN 78 2HD2 ASN 78 -5.138 6.953 -3.535 595 H LEU 79 H LEU 79 -5.219 5.424 -0.228 596 HA LEU 79 HA LEU 79 -7.767 6.254 0.998 597 HB2 LEU 79 2HB LEU 79 -6.614 5.244 2.733 598 HB3 LEU 79 1HB LEU 79 -5.054 5.770 2.143 599 HG LEU 79 HG LEU 79 -5.513 8.046 2.921 600 HD11 LEU 79 1HD1 LEU 79 -8.169 7.248 2.862 601 HD12 LEU 79 2HD1 LEU 79 -7.539 8.770 3.489 602 HD13 LEU 79 3HD1 LEU 79 -7.799 7.410 4.578 603 HD21 LEU 79 3HD2 LEU 79 -4.379 7.072 4.611 604 HD22 LEU 79 1HD2 LEU 79 -5.487 5.705 4.712 605 HD23 LEU 79 2HD2 LEU 79 -5.918 7.246 5.456 606 H GLU 80 H GLU 80 -8.138 8.466 1.314 607 HA GLU 80 HA GLU 80 -6.121 10.345 0.344 608 HB2 GLU 80 2HB GLU 80 -7.962 9.490 -1.420 609 HB3 GLU 80 1HB GLU 80 -8.868 10.812 -0.675 610 HG2 GLU 80 2HG GLU 80 -6.309 11.830 -1.196 611 HG3 GLU 80 1HG GLU 80 -6.769 10.902 -2.631 612 H ASP 81 H ASP 81 -7.406 12.667 0.365 613 HA ASP 81 HA ASP 81 -7.539 13.447 2.990 614 HB2 ASP 81 2HB ASP 81 -7.524 14.841 0.783 615 HB3 ASP 81 1HB ASP 81 -9.277 14.811 0.961 616 H GLU 82 H GLU 82 -10.037 11.952 1.080 617 HA GLU 82 HA GLU 82 -12.332 12.651 2.445 618 HB2 GLU 82 2HB GLU 82 -11.520 10.086 1.098 619 HB3 GLU 82 1HB GLU 82 -13.108 10.275 1.832 620 HG2 GLU 82 2HG GLU 82 -12.195 12.348 -0.086 621 HG3 GLU 82 1HG GLU 82 -12.682 10.777 -0.719 622 H GLU 83 H GLU 83 -9.733 10.592 3.458 623 HA GLU 83 HA GLU 83 -11.030 10.287 6.065 624 HB2 GLU 83 2HB GLU 83 -10.660 8.166 4.214 625 HB3 GLU 83 1HB GLU 83 -9.510 7.919 5.520 626 HG2 GLU 83 2HG GLU 83 -11.646 8.429 7.000 627 HG3 GLU 83 1HG GLU 83 -12.473 7.844 5.551 628 H GLU 84 H GLU 84 -9.716 11.026 7.598 629 HA GLU 84 HA GLU 84 -6.812 10.743 7.217 630 HB2 GLU 84 2HB GLU 84 -7.608 13.073 6.733 631 HB3 GLU 84 1HB GLU 84 -8.155 13.176 8.400 632 HG2 GLU 84 2HG GLU 84 -5.663 12.489 8.902 633 HG3 GLU 84 1HG GLU 84 -5.398 13.176 7.300 634 HA PRO 85 HA PRO 85 -8.300 8.945 11.297 635 HB2 PRO 85 2HB PRO 85 -6.183 7.003 10.554 636 HB3 PRO 85 1HB PRO 85 -7.819 6.712 11.176 637 HG2 PRO 85 2HG PRO 85 -7.224 6.248 8.615 638 HG3 PRO 85 1HG PRO 85 -8.797 6.935 9.086 639 HD2 PRO 85 2HD PRO 85 -6.397 8.302 7.923 640 HD3 PRO 85 1HD PRO 85 -8.124 8.558 7.577 641 H LYS 86 H LYS 86 -5.305 9.950 9.893 642 HA LYS 86 HA LYS 86 -3.411 10.852 10.759 643 HB2 LYS 86 2HB LYS 86 -5.236 11.134 13.146 644 HB3 LYS 86 1HB LYS 86 -3.570 11.721 13.154 645 HG2 LYS 86 2HG LYS 86 -4.057 13.498 11.874 646 HG3 LYS 86 1HG LYS 86 -5.179 12.593 10.857 647 HD2 LYS 86 2HD LYS 86 -6.765 13.793 11.897 648 HD3 LYS 86 1HD LYS 86 -6.519 12.663 13.230 649 HE2 LYS 86 2HE LYS 86 -4.779 14.236 14.115 650 HE3 LYS 86 1HE LYS 86 -5.282 15.388 12.879 651 HZ1 LYS 86 3HZ LYS 86 -6.650 16.077 14.506 652 HZ2 LYS 86 1HZ LYS 86 -6.616 14.601 15.334 653 HZ3 LYS 86 2HZ LYS 86 -7.625 14.794 13.990 654 H ASP 87 H ASP 87 -1.900 9.296 10.755 655 HA ASP 87 HA ASP 87 -0.993 8.164 13.153 656 HB2 ASP 87 2HB ASP 87 -3.129 6.783 12.618 657 HB3 ASP 87 1HB ASP 87 -2.130 6.026 11.368 658 H GLU 88 H GLU 88 0.809 6.610 12.796 659 HA GLU 88 HA GLU 88 2.516 7.540 10.740 660 HB2 GLU 88 2HB GLU 88 2.696 5.328 12.761 661 HB3 GLU 88 1HB GLU 88 3.929 5.505 11.520 662 HG2 GLU 88 2HG GLU 88 3.139 7.662 13.464 663 HG3 GLU 88 1HG GLU 88 4.511 6.574 13.671 664 H ASP 89 H ASP 89 0.086 5.165 10.745 665 HA ASP 89 HA ASP 89 1.096 3.258 8.971 666 HB2 ASP 89 2HB ASP 89 -1.030 3.088 10.312 667 HB3 ASP 89 1HB ASP 89 -1.784 4.174 9.134 668 H PHE 90 H PHE 90 0.249 6.532 8.408 669 HA PHE 90 HA PHE 90 -0.055 6.086 5.527 670 HB2 PHE 90 2HB PHE 90 -0.315 8.744 6.921 671 HB3 PHE 90 1HB PHE 90 -1.007 8.236 5.373 672 HD1 PHE 90 1HD PHE 90 -2.565 6.052 5.639 673 HD2 PHE 90 2HD PHE 90 -1.778 8.940 8.663 674 HE1 PHE 90 1HE PHE 90 -4.651 5.420 6.779 675 HE2 PHE 90 2HE PHE 90 -3.863 8.313 9.810 676 HZ PHE 90 HZ PHE 90 -5.300 6.552 8.867 677 H SER 91 H SER 91 2.232 7.147 7.852 678 HA SER 91 HA SER 91 4.254 7.465 5.854 679 HB2 SER 91 2HB SER 91 4.059 9.930 7.497 680 HB3 SER 91 1HB SER 91 4.577 9.725 5.814 681 HG SER 91 HG SER 91 2.652 10.736 5.678 682 HA PRO 92 HA PRO 92 5.453 5.914 10.128 683 HB2 PRO 92 2HB PRO 92 7.045 4.123 8.368 684 HB3 PRO 92 1HB PRO 92 6.079 3.734 9.804 685 HG2 PRO 92 2HG PRO 92 5.211 3.118 7.356 686 HG3 PRO 92 1HG PRO 92 4.093 3.679 8.613 687 HD2 PRO 92 2HD PRO 92 5.219 5.165 6.276 688 HD3 PRO 92 1HD PRO 92 3.594 5.240 6.985 689 H ASP 93 H ASP 93 7.785 5.674 7.433 690 HA ASP 93 HA ASP 93 9.650 7.287 9.035 691 HB2 ASP 93 2HB ASP 93 10.013 4.809 7.834 692 HB3 ASP 93 1HB ASP 93 10.812 5.930 6.721 693 H GLY 94 H GLY 94 8.085 9.011 8.055 694 HA2 GLY 94 2HA GLY 94 9.586 10.509 6.187 695 HA3 GLY 94 1HA GLY 94 8.216 9.753 5.366 696 H GLY 95 H GLY 95 8.982 12.609 6.167 697 HA2 GLY 95 2HA GLY 95 6.872 13.376 7.989 698 HA3 GLY 95 1HA GLY 95 7.983 14.462 7.145 699 H TYR 96 H TYR 96 7.230 13.058 4.561 700 HA TYR 96 HA TYR 96 5.446 14.891 3.561 701 HB2 TYR 96 2HB TYR 96 4.868 12.951 1.874 702 HB3 TYR 96 1HB TYR 96 6.461 13.719 1.864 703 HD1 TYR 96 1HD TYR 96 8.410 12.533 2.781 704 HD2 TYR 96 2HD TYR 96 4.604 10.646 2.530 705 HE1 TYR 96 1HE TYR 96 9.480 10.345 3.097 706 HE2 TYR 96 2HE TYR 96 5.664 8.446 2.832 707 HH TYR 96 HH TYR 96 9.109 8.050 2.773 708 H ILE 97 H ILE 97 3.261 14.195 2.508 709 HA ILE 97 HA ILE 97 1.644 12.475 4.143 710 HB ILE 97 HB ILE 97 0.058 14.181 4.884 711 HG12 ILE 97 2HG1 ILE 97 0.066 16.012 3.485 712 HG13 ILE 97 1HG1 ILE 97 1.049 16.604 4.820 713 HG21 ILE 97 1HG2 ILE 97 2.830 14.956 5.728 714 HG22 ILE 97 2HG2 ILE 97 1.992 13.507 6.282 715 HG23 ILE 97 3HG2 ILE 97 1.339 15.101 6.658 716 HD11 ILE 97 3HD1 ILE 97 2.063 17.272 2.774 717 HD12 ILE 97 1HD1 ILE 97 2.031 15.621 2.157 718 HD13 ILE 97 2HD1 ILE 97 3.077 16.036 3.515 719 HA PRO 98 HA PRO 98 0.836 10.630 3.406 720 HB2 PRO 98 2HB PRO 98 -1.717 10.266 1.798 721 HB3 PRO 98 1HB PRO 98 -1.123 9.240 3.136 722 HG2 PRO 98 2HG PRO 98 -2.501 11.728 3.308 723 HG3 PRO 98 1HG PRO 98 -1.822 10.745 4.638 724 HD2 PRO 98 2HD PRO 98 -0.727 13.049 4.172 725 HD3 PRO 98 1HD PRO 98 0.342 11.647 4.355 726 H ARG 99 H ARG 99 1.701 8.740 2.501 727 HA ARG 99 HA ARG 99 2.155 8.843 -0.404 728 HB2 ARG 99 2HB ARG 99 4.003 8.748 1.854 729 HB3 ARG 99 1HB ARG 99 4.326 7.496 0.652 730 HG2 ARG 99 2HG ARG 99 5.599 9.592 0.317 731 HG3 ARG 99 1HG ARG 99 4.611 9.131 -1.068 732 HD2 ARG 99 2HD ARG 99 2.851 10.715 0.026 733 HD3 ARG 99 1HD ARG 99 4.239 11.378 0.871 734 HE ARG 99 HE ARG 99 4.749 11.227 -1.904 735 HH11 ARG 99 1HH1 ARG 99 2.948 13.064 0.452 736 HH12 ARG 99 2HH1 ARG 99 2.959 14.518 -0.490 737 HH21 ARG 99 1HH2 ARG 99 4.768 13.139 -3.142 738 HH22 ARG 99 2HH2 ARG 99 3.991 14.561 -2.529 739 H ILE 100 H ILE 100 3.507 6.520 -0.767 740 HA ILE 100 HA ILE 100 1.402 4.524 -0.403 741 HB ILE 100 HB ILE 100 3.917 4.387 -2.065 742 HG12 ILE 100 2HG1 ILE 100 1.589 4.491 -3.673 743 HG13 ILE 100 1HG1 ILE 100 1.444 5.785 -2.487 744 HG21 ILE 100 1HG2 ILE 100 3.263 2.175 -1.670 745 HG22 ILE 100 2HG2 ILE 100 2.564 2.567 -3.240 746 HG23 ILE 100 3HG2 ILE 100 1.547 2.566 -1.801 747 HD11 ILE 100 3HD1 ILE 100 2.994 5.699 -4.860 748 HD12 ILE 100 1HD1 ILE 100 4.086 5.835 -3.483 749 HD13 ILE 100 2HD1 ILE 100 2.800 7.022 -3.709 750 H LEU 101 H LEU 101 2.012 2.256 0.154 751 HA LEU 101 HA LEU 101 4.488 1.627 1.343 752 HB2 LEU 101 2HB LEU 101 3.225 1.419 3.713 753 HB3 LEU 101 1HB LEU 101 4.250 2.760 3.256 754 HG LEU 101 HG LEU 101 1.585 3.288 2.339 755 HD11 LEU 101 1HD1 LEU 101 0.433 3.381 4.469 756 HD12 LEU 101 2HD1 LEU 101 1.818 2.625 5.259 757 HD13 LEU 101 3HD1 LEU 101 0.886 1.728 4.059 758 HD21 LEU 101 3HD2 LEU 101 3.598 4.798 3.079 759 HD22 LEU 101 1HD2 LEU 101 2.829 4.678 4.661 760 HD23 LEU 101 2HD2 LEU 101 1.933 5.342 3.292 761 H PHE 102 H PHE 102 4.676 -0.498 1.998 762 HA PHE 102 HA PHE 102 2.396 -2.229 1.321 763 HB2 PHE 102 2HB PHE 102 5.145 -2.308 0.676 764 HB3 PHE 102 1HB PHE 102 4.868 -3.647 1.777 765 HD1 PHE 102 2HD PHE 102 2.406 -4.810 1.124 766 HD2 PHE 102 1HD PHE 102 5.188 -2.943 -1.497 767 HE1 PHE 102 2HE PHE 102 1.539 -6.152 -0.747 768 HE2 PHE 102 1HE PHE 102 4.329 -4.282 -3.371 769 HZ PHE 102 HZ PHE 102 2.505 -5.890 -2.998 770 H LEU 103 H LEU 103 1.795 -3.973 2.731 771 HA LEU 103 HA LEU 103 3.065 -4.036 5.348 772 HB2 LEU 103 2HB LEU 103 0.521 -4.154 6.206 773 HB3 LEU 103 1HB LEU 103 1.512 -2.725 6.216 774 HG LEU 103 HG LEU 103 -0.381 -3.379 4.001 775 HD11 LEU 103 1HD1 LEU 103 -1.611 -3.167 6.060 776 HD12 LEU 103 2HD1 LEU 103 -1.938 -1.826 4.969 777 HD13 LEU 103 3HD1 LEU 103 -0.866 -1.597 6.351 778 HD21 LEU 103 3HD2 LEU 103 -0.100 -0.678 4.069 779 HD22 LEU 103 1HD2 LEU 103 0.793 -1.759 3.000 780 HD23 LEU 103 2HD2 LEU 103 1.516 -1.225 4.516 781 H ASP 104 H ASP 104 1.981 -5.714 6.787 782 HA ASP 104 HA ASP 104 2.098 -8.204 5.386 783 HB2 ASP 104 2HB ASP 104 2.333 -7.306 8.090 784 HB3 ASP 104 1HB ASP 104 1.134 -8.606 8.034 785 HA PRO 105 HA PRO 105 -2.077 -9.081 4.310 786 HB2 PRO 105 2HB PRO 105 -1.601 -11.719 5.626 787 HB3 PRO 105 1HB PRO 105 -2.215 -11.360 3.999 788 HG2 PRO 105 2HG PRO 105 0.288 -12.200 4.350 789 HG3 PRO 105 1HG PRO 105 -0.094 -10.942 3.152 790 HD2 PRO 105 2HD PRO 105 1.172 -10.679 5.843 791 HD3 PRO 105 1HD PRO 105 1.491 -9.775 4.349 792 H SER 106 H SER 106 -3.183 -7.743 5.683 793 HA SER 106 HA SER 106 -5.091 -8.603 7.344 794 HB2 SER 106 2HB SER 106 -4.051 -8.030 9.672 795 HB3 SER 106 1HB SER 106 -3.747 -9.628 8.969 796 HG SER 106 HG SER 106 -1.939 -8.030 9.801 797 H GLY 107 H GLY 107 -2.664 -6.226 6.709 798 HA2 GLY 107 2HA GLY 107 -3.343 -3.992 6.113 799 HA3 GLY 107 1HA GLY 107 -4.623 -4.114 7.327 800 H LYS 108 H LYS 108 -1.143 -4.890 7.526 801 HA LYS 108 HA LYS 108 -0.979 -2.892 9.699 802 HB2 LYS 108 2HB LYS 108 -0.260 -5.719 9.635 803 HB3 LYS 108 1HB LYS 108 1.038 -4.694 10.229 804 HG2 LYS 108 2HG LYS 108 -0.988 -3.672 11.642 805 HG3 LYS 108 1HG LYS 108 -1.587 -5.327 11.424 806 HD2 LYS 108 2HD LYS 108 1.236 -5.190 12.174 807 HD3 LYS 108 1HD LYS 108 0.153 -4.494 13.382 808 HE2 LYS 108 2HE LYS 108 -1.176 -6.770 12.754 809 HE3 LYS 108 1HE LYS 108 0.493 -7.288 12.523 810 HZ1 LYS 108 3HZ LYS 108 0.909 -6.301 14.800 811 HZ2 LYS 108 1HZ LYS 108 0.003 -7.728 14.753 812 HZ3 LYS 108 2HZ LYS 108 -0.771 -6.243 14.985 813 H VAL 109 H VAL 109 -0.219 -1.282 8.209 814 HA VAL 109 HA VAL 109 1.797 -1.307 6.424 815 HB VAL 109 HB VAL 109 1.041 0.756 8.463 816 HG11 VAL 109 1HG1 VAL 109 2.403 2.355 7.139 817 HG12 VAL 109 2HG1 VAL 109 3.121 0.976 6.307 818 HG13 VAL 109 3HG1 VAL 109 3.348 1.175 8.043 819 HG21 VAL 109 3HG2 VAL 109 0.641 0.489 5.489 820 HG22 VAL 109 1HG2 VAL 109 0.174 1.897 6.438 821 HG23 VAL 109 2HG2 VAL 109 -0.589 0.338 6.742 822 H HIS 110 H HIS 110 3.577 -2.479 6.643 823 HA HIS 110 HA HIS 110 5.229 -2.059 9.037 824 HB2 HIS 110 2HB HIS 110 4.472 -4.428 7.698 825 HB3 HIS 110 1HB HIS 110 6.180 -4.194 7.342 826 HD1 HIS 110 1HD HIS 110 7.756 -3.920 9.521 827 HD2 HIS 110 2HD HIS 110 3.952 -5.461 10.166 828 HE1 HIS 110 1HE HIS 110 7.845 -5.003 11.789 829 HE2 HIS 110 2HE HIS 110 5.512 -5.866 12.188 830 HA PRO 111 HA PRO 111 7.870 0.330 6.366 831 HB2 PRO 111 2HB PRO 111 10.053 0.433 7.996 832 HB3 PRO 111 1HB PRO 111 8.615 1.433 8.231 833 HG2 PRO 111 2HG PRO 111 9.402 -1.104 9.602 834 HG3 PRO 111 1HG PRO 111 8.695 0.366 10.292 835 HD2 PRO 111 2HD PRO 111 7.232 -1.849 9.775 836 HD3 PRO 111 1HD PRO 111 6.560 -0.207 9.637 837 H GLU 112 H GLU 112 7.718 -2.531 5.904 838 HA GLU 112 HA GLU 112 10.476 -3.408 5.609 839 HB2 GLU 112 2HB GLU 112 7.792 -4.680 5.263 840 HB3 GLU 112 1HB GLU 112 9.170 -5.379 4.423 841 HG2 GLU 112 2HG GLU 112 9.521 -4.796 7.297 842 HG3 GLU 112 1HG GLU 112 8.426 -6.112 6.875 843 H ILE 113 H ILE 113 7.838 -3.748 3.262 844 HA ILE 113 HA ILE 113 9.670 -3.033 1.122 845 HB ILE 113 HB ILE 113 6.748 -3.740 0.857 846 HG12 ILE 113 2HG1 ILE 113 8.113 -5.989 0.106 847 HG13 ILE 113 1HG1 ILE 113 9.088 -5.424 1.469 848 HG21 ILE 113 1HG2 ILE 113 7.217 -3.075 -1.238 849 HG22 ILE 113 2HG2 ILE 113 8.000 -4.650 -1.372 850 HG23 ILE 113 3HG2 ILE 113 8.957 -3.215 -1.002 851 HD11 ILE 113 3HD1 ILE 113 7.602 -6.180 2.918 852 HD12 ILE 113 1HD1 ILE 113 6.756 -6.934 1.567 853 HD13 ILE 113 2HD1 ILE 113 6.288 -5.323 2.111 854 H ILE 114 H ILE 114 10.020 -0.876 1.159 855 HA ILE 114 HA ILE 114 7.746 0.948 1.354 856 HB ILE 114 HB ILE 114 9.623 2.697 1.289 857 HG12 ILE 114 2HG1 ILE 114 11.247 0.708 0.579 858 HG13 ILE 114 1HG1 ILE 114 11.825 2.075 1.509 859 HG21 ILE 114 1HG2 ILE 114 10.193 2.154 3.742 860 HG22 ILE 114 2HG2 ILE 114 9.072 0.805 3.534 861 HG23 ILE 114 3HG2 ILE 114 8.512 2.462 3.304 862 HD11 ILE 114 3HD1 ILE 114 10.806 -0.221 3.051 863 HD12 ILE 114 1HD1 ILE 114 12.191 0.829 3.352 864 HD13 ILE 114 2HD1 ILE 114 12.306 -0.465 2.159 865 H ASN 115 H ASN 115 10.462 0.240 -0.799 866 HA ASN 115 HA ASN 115 9.227 0.470 -3.208 867 HB2 ASN 115 2HB ASN 115 8.565 2.740 -2.792 868 HB3 ASN 115 1HB ASN 115 10.179 3.172 -2.216 869 HD21 ASN 115 1HD2 ASN 115 9.238 4.818 -3.985 870 HD22 ASN 115 2HD2 ASN 115 9.922 4.566 -5.567 871 H GLU 116 H GLU 116 12.065 1.561 -1.432 872 HA GLU 116 HA GLU 116 14.281 1.139 -1.661 873 HB2 GLU 116 2HB GLU 116 13.378 -0.946 -3.660 874 HB3 GLU 116 1HB GLU 116 15.006 -0.808 -2.984 875 HG2 GLU 116 2HG GLU 116 12.543 -1.241 -1.312 876 HG3 GLU 116 1HG GLU 116 13.540 -2.551 -1.939 877 H ASN 117 H ASN 117 12.867 0.822 -4.933 878 HA ASN 117 HA ASN 117 14.957 1.876 -6.381 879 HB2 ASN 117 2HB ASN 117 12.603 0.903 -7.098 880 HB3 ASN 117 1HB ASN 117 12.171 2.618 -7.175 881 HD21 ASN 117 1HD2 ASN 117 14.130 0.078 -8.514 882 HD22 ASN 117 2HD2 ASN 117 14.608 0.932 -9.957 883 H GLY 118 H GLY 118 12.746 3.537 -4.281 884 HA2 GLY 118 2HA GLY 118 13.087 6.143 -5.397 885 HA3 GLY 118 1HA GLY 118 12.455 5.767 -3.791 886 H ASN 119 H ASN 119 13.799 7.861 -3.556 887 HA ASN 119 HA ASN 119 16.651 7.438 -3.312 888 HB2 ASN 119 2HB ASN 119 16.756 9.780 -2.674 889 HB3 ASN 119 1HB ASN 119 15.713 9.608 -4.090 890 HD21 ASN 119 1HD2 ASN 119 15.873 10.330 -0.701 891 HD22 ASN 119 2HD2 ASN 119 14.259 10.966 -0.552 892 HA PRO 120 HA PRO 120 16.699 6.388 0.979 893 HB2 PRO 120 2HB PRO 120 19.019 7.451 1.831 894 HB3 PRO 120 1HB PRO 120 18.971 6.095 0.687 895 HG2 PRO 120 2HG PRO 120 19.388 9.016 0.156 896 HG3 PRO 120 1HG PRO 120 20.241 7.616 -0.534 897 HD2 PRO 120 2HD PRO 120 18.237 8.949 -1.824 898 HD3 PRO 120 1HD PRO 120 18.599 7.227 -2.089 899 H SER 121 H SER 121 14.967 8.503 0.621 900 HA SER 121 HA SER 121 14.876 9.668 3.172 901 HB2 SER 121 2HB SER 121 16.377 11.161 1.155 902 HB3 SER 121 1HB SER 121 15.015 12.089 1.802 903 HG SER 121 HG SER 121 16.857 10.726 3.468 904 H TYR 122 H TYR 122 13.270 8.221 1.339 905 HA TYR 122 HA TYR 122 10.860 9.727 1.481 906 HB2 TYR 122 2HB TYR 122 12.425 9.803 -0.959 907 HB3 TYR 122 1HB TYR 122 10.829 9.104 -1.242 908 HD1 TYR 122 2HD TYR 122 8.840 10.496 -0.128 909 HD2 TYR 122 1HD TYR 122 12.662 12.080 -1.128 910 HE1 TYR 122 2HE TYR 122 7.879 12.758 -0.189 911 HE2 TYR 122 1HE TYR 122 11.712 14.349 -1.188 912 HH TYR 122 HH TYR 122 8.750 15.137 0.103 913 H LYS 123 H LYS 123 12.274 7.128 -0.493 914 HA LYS 123 HA LYS 123 11.551 5.003 -0.953 915 HB2 LYS 123 2HB LYS 123 11.122 5.223 2.022 916 HB3 LYS 123 1HB LYS 123 10.971 3.713 1.145 917 HG2 LYS 123 2HG LYS 123 13.464 5.380 1.072 918 HG3 LYS 123 1HG LYS 123 13.172 4.126 2.290 919 HD2 LYS 123 2HD LYS 123 14.048 2.673 0.844 920 HD3 LYS 123 1HD LYS 123 12.584 2.888 -0.124 921 HE2 LYS 123 2HE LYS 123 13.808 3.747 -1.758 922 HE3 LYS 123 1HE LYS 123 14.293 5.066 -0.694 923 HZ1 LYS 123 3HZ LYS 123 15.677 2.471 -1.085 924 HZ2 LYS 123 1HZ LYS 123 16.081 3.572 0.136 925 HZ3 LYS 123 2HZ LYS 123 16.247 4.012 -1.488 926 H TYR 124 H TYR 124 9.202 5.362 1.634 927 HA TYR 124 HA TYR 124 7.025 4.166 0.678 928 HB2 TYR 124 2HB TYR 124 7.004 6.857 2.062 929 HB3 TYR 124 1HB TYR 124 5.619 5.767 1.932 930 HD1 TYR 124 1HD TYR 124 9.044 6.067 3.373 931 HD2 TYR 124 2HD TYR 124 5.323 4.019 3.465 932 HE1 TYR 124 1HE TYR 124 9.729 4.928 5.436 933 HE2 TYR 124 2HE TYR 124 5.997 2.869 5.528 934 HH TYR 124 HH TYR 124 9.027 2.603 6.578 935 H PHE 125 H PHE 125 8.116 7.357 -0.345 936 HA PHE 125 HA PHE 125 5.834 7.858 -2.021 937 HB2 PHE 125 2HB PHE 125 6.873 9.791 -1.130 938 HB3 PHE 125 1HB PHE 125 8.486 9.234 -1.595 939 HD1 PHE 125 2HD PHE 125 5.226 9.953 -3.290 940 HD2 PHE 125 1HD PHE 125 9.460 10.383 -3.306 941 HE1 PHE 125 2HE PHE 125 5.080 11.286 -5.353 942 HE2 PHE 125 1HE PHE 125 9.320 11.713 -5.371 943 HZ PHE 125 HZ PHE 125 7.129 12.165 -6.398 944 H TYR 126 H TYR 126 5.528 7.111 -4.019 945 HA TYR 126 HA TYR 126 7.795 5.904 -5.434 946 HB2 TYR 126 2HB TYR 126 4.833 5.500 -5.506 947 HB3 TYR 126 1HB TYR 126 5.772 5.137 -6.958 948 HD1 TYR 126 2HD TYR 126 7.668 3.451 -6.760 949 HD2 TYR 126 1HD TYR 126 4.729 3.975 -3.733 950 HE1 TYR 126 2HE TYR 126 8.228 1.240 -5.841 951 HE2 TYR 126 1HE TYR 126 5.279 1.766 -2.805 952 HH TYR 126 HH TYR 126 7.095 -0.519 -4.457 953 H VAL 127 H VAL 127 7.433 6.064 -7.938 954 HA VAL 127 HA VAL 127 6.298 8.451 -8.971 955 HB VAL 127 HB VAL 127 8.563 9.315 -9.843 956 HG11 VAL 127 1HG1 VAL 127 6.977 10.273 -8.020 957 HG12 VAL 127 2HG1 VAL 127 8.607 10.928 -8.193 958 HG13 VAL 127 3HG1 VAL 127 8.252 9.772 -6.909 959 HG21 VAL 127 3HG2 VAL 127 9.547 7.892 -7.375 960 HG22 VAL 127 1HG2 VAL 127 10.489 8.922 -8.452 961 HG23 VAL 127 2HG2 VAL 127 9.871 7.376 -9.030 962 H SER 128 H SER 128 5.400 7.325 -10.574 963 HA SER 128 HA SER 128 5.371 6.589 -12.771 964 HB2 SER 128 2HB SER 128 7.266 6.226 -14.028 965 HB3 SER 128 1HB SER 128 7.947 7.240 -12.747 966 HG SER 128 HG SER 128 8.504 4.667 -13.385 967 H ALA 129 H ALA 129 4.763 4.623 -13.585 968 HA ALA 129 HA ALA 129 4.190 2.583 -11.742 969 HB1 ALA 129 1HB ALA 129 3.173 1.430 -13.525 970 HB2 ALA 129 2HB ALA 129 4.180 2.242 -14.725 971 HB3 ALA 129 3HB ALA 129 2.934 3.145 -13.862 972 H GLU 130 H GLU 130 6.800 3.011 -14.033 973 HA GLU 130 HA GLU 130 7.818 0.504 -14.344 974 HB2 GLU 130 2HB GLU 130 8.688 3.002 -14.950 975 HB3 GLU 130 1HB GLU 130 9.863 2.538 -13.713 976 HG2 GLU 130 2HG GLU 130 9.727 0.311 -15.334 977 HG3 GLU 130 1HG GLU 130 9.601 1.663 -16.472 978 H GLN 131 H GLN 131 8.495 2.649 -11.569 979 HA GLN 131 HA GLN 131 10.061 0.600 -10.321 980 HB2 GLN 131 2HB GLN 131 9.790 2.188 -8.285 981 HB3 GLN 131 1HB GLN 131 10.904 2.562 -9.587 982 HG2 GLN 131 2HG GLN 131 9.067 3.989 -10.577 983 HG3 GLN 131 1HG GLN 131 8.207 3.773 -9.052 984 HE21 GLN 131 1HE2 GLN 131 8.889 4.864 -7.259 985 HE22 GLN 131 2HE2 GLN 131 10.138 6.054 -7.283 986 H VAL 132 H VAL 132 6.983 2.190 -9.401 987 HA VAL 132 HA VAL 132 6.420 0.547 -7.242 988 HB VAL 132 HB VAL 132 4.965 2.329 -7.378 989 HG11 VAL 132 1HG1 VAL 132 5.188 1.957 -10.201 990 HG12 VAL 132 2HG1 VAL 132 4.663 3.377 -9.297 991 HG13 VAL 132 3HG1 VAL 132 3.490 2.141 -9.756 992 HG21 VAL 132 3HG2 VAL 132 3.088 0.340 -8.578 993 HG22 VAL 132 1HG2 VAL 132 2.843 1.440 -7.222 994 HG23 VAL 132 2HG2 VAL 132 3.852 0.007 -7.023 995 H VAL 133 H VAL 133 6.399 -0.240 -10.599 996 HA VAL 133 HA VAL 133 4.716 -2.557 -10.275 997 HB VAL 133 HB VAL 133 4.880 -1.386 -12.480 998 HG11 VAL 133 1HG1 VAL 133 7.068 -2.519 -13.680 999 HG12 VAL 133 2HG1 VAL 133 7.690 -2.059 -12.099 1000 HG13 VAL 133 3HG1 VAL 133 6.952 -0.847 -13.140 1001 HG21 VAL 133 3HG2 VAL 133 5.000 -3.470 -13.811 1002 HG22 VAL 133 1HG2 VAL 133 4.016 -3.645 -12.356 1003 HG23 VAL 133 2HG2 VAL 133 5.655 -4.304 -12.399 1004 H GLN 134 H GLN 134 8.183 -1.807 -10.208 1005 HA GLN 134 HA GLN 134 8.881 -4.623 -10.260 1006 HB2 GLN 134 2HB GLN 134 11.162 -3.700 -9.448 1007 HB3 GLN 134 1HB GLN 134 10.635 -3.344 -11.086 1008 HG2 GLN 134 2HG GLN 134 9.887 -1.147 -10.372 1009 HG3 GLN 134 1HG GLN 134 10.407 -1.498 -8.724 1010 HE21 GLN 134 1HE2 GLN 134 11.315 -0.378 -11.795 1011 HE22 GLN 134 2HE2 GLN 134 13.017 -0.176 -11.483 1012 H GLY 135 H GLY 135 8.303 -2.147 -7.875 1013 HA2 GLY 135 2HA GLY 135 9.183 -3.732 -5.646 1014 HA3 GLY 135 1HA GLY 135 8.269 -2.220 -5.567 1015 H MET 136 H MET 136 6.308 -3.549 -7.552 1016 HA MET 136 HA MET 136 4.734 -4.853 -5.444 1017 HB2 MET 136 2HB MET 136 2.797 -4.317 -6.666 1018 HB3 MET 136 1HB MET 136 3.828 -2.903 -6.815 1019 HG2 MET 136 2HG MET 136 3.110 -3.134 -8.965 1020 HG3 MET 136 1HG MET 136 4.600 -4.070 -9.021 1021 HE1 MET 136 3HE MET 136 0.374 -4.981 -8.831 1022 HE2 MET 136 1HE MET 136 0.781 -5.085 -10.543 1023 HE3 MET 136 2HE MET 136 1.217 -3.647 -9.619 1024 H LYS 137 H LYS 137 6.046 -5.390 -8.639 1025 HA LYS 137 HA LYS 137 4.839 -7.951 -8.995 1026 HB2 LYS 137 2HB LYS 137 6.070 -8.110 -11.014 1027 HB3 LYS 137 1HB LYS 137 5.585 -6.432 -10.861 1028 HG2 LYS 137 2HG LYS 137 7.938 -6.127 -9.810 1029 HG3 LYS 137 1HG LYS 137 8.293 -7.654 -10.617 1030 HD2 LYS 137 2HD LYS 137 7.394 -5.068 -11.882 1031 HD3 LYS 137 1HD LYS 137 8.930 -5.901 -12.107 1032 HE2 LYS 137 2HE LYS 137 8.035 -6.873 -13.891 1033 HE3 LYS 137 1HE LYS 137 7.000 -7.781 -12.794 1034 HZ1 LYS 137 3HZ LYS 137 5.740 -6.650 -14.523 1035 HZ2 LYS 137 1HZ LYS 137 6.331 -5.154 -13.998 1036 HZ3 LYS 137 2HZ LYS 137 5.329 -6.070 -12.988 1037 H GLU 138 H GLU 138 7.425 -6.841 -7.148 1038 HA GLU 138 HA GLU 138 8.730 -9.465 -7.097 1039 HB2 GLU 138 2HB GLU 138 9.940 -7.102 -7.318 1040 HB3 GLU 138 1HB GLU 138 9.811 -7.153 -5.562 1041 HG2 GLU 138 2HG GLU 138 10.793 -9.613 -6.040 1042 HG3 GLU 138 1HG GLU 138 11.502 -8.716 -7.394 1043 H ALA 139 H ALA 139 7.683 -6.915 -4.853 1044 HA ALA 139 HA ALA 139 7.830 -8.343 -2.483 1045 HB1 ALA 139 1HB ALA 139 5.571 -6.437 -2.972 1046 HB2 ALA 139 2HB ALA 139 7.236 -5.856 -2.904 1047 HB3 ALA 139 3HB ALA 139 6.532 -6.678 -1.512 1048 H GLN 140 H GLN 140 5.520 -8.501 -5.055 1049 HA GLN 140 HA GLN 140 3.406 -9.752 -3.722 1050 HB2 GLN 140 2HB GLN 140 2.737 -10.491 -6.013 1051 HB3 GLN 140 1HB GLN 140 3.031 -8.760 -5.858 1052 HG2 GLN 140 2HG GLN 140 4.112 -9.183 -7.805 1053 HG3 GLN 140 1HG GLN 140 5.432 -9.441 -6.669 1054 HE21 GLN 140 1HE2 GLN 140 2.693 -11.397 -7.800 1055 HE22 GLN 140 2HE2 GLN 140 3.640 -12.771 -8.248 1056 H GLU 141 H GLU 141 6.496 -10.943 -4.526 1057 HA GLU 141 HA GLU 141 5.548 -13.716 -4.327 1058 HB2 GLU 141 2HB GLU 141 6.912 -14.232 -6.010 1059 HB3 GLU 141 1HB GLU 141 7.266 -12.510 -6.179 1060 HG2 GLU 141 2HG GLU 141 9.038 -12.899 -4.395 1061 HG3 GLU 141 1HG GLU 141 8.831 -14.614 -4.738 1062 H ARG 142 H ARG 142 7.830 -11.393 -2.997 1063 HA ARG 142 HA ARG 142 8.926 -13.363 -1.171 1064 HB2 ARG 142 2HB ARG 142 10.294 -11.461 -0.329 1065 HB3 ARG 142 1HB ARG 142 10.470 -11.751 -2.063 1066 HG2 ARG 142 2HG ARG 142 9.107 -9.871 -2.593 1067 HG3 ARG 142 1HG ARG 142 8.644 -9.658 -0.895 1068 HD2 ARG 142 2HD ARG 142 10.356 -8.039 -1.636 1069 HD3 ARG 142 1HD ARG 142 10.910 -9.073 -0.307 1070 HE ARG 142 HE ARG 142 11.625 -10.098 -2.883 1071 HH11 ARG 142 1HH1 ARG 142 12.537 -7.831 -0.391 1072 HH12 ARG 142 2HH1 ARG 142 14.211 -7.826 -0.835 1073 HH21 ARG 142 1HH2 ARG 142 13.826 -10.092 -3.469 1074 HH22 ARG 142 2HH2 ARG 142 14.943 -9.109 -2.582 1075 H LEU 143 H LEU 143 6.861 -10.494 -1.010 1076 HA LEU 143 HA LEU 143 6.600 -10.516 1.816 1077 HB2 LEU 143 2HB LEU 143 6.193 -8.547 0.319 1078 HB3 LEU 143 1HB LEU 143 4.699 -9.325 -0.203 1079 HG LEU 143 HG LEU 143 3.778 -9.168 2.024 1080 HD11 LEU 143 1HD1 LEU 143 5.315 -9.370 3.658 1081 HD12 LEU 143 2HD1 LEU 143 5.334 -7.608 3.571 1082 HD13 LEU 143 3HD1 LEU 143 6.569 -8.546 2.729 1083 HD21 LEU 143 3HD2 LEU 143 3.269 -7.249 0.828 1084 HD22 LEU 143 1HD2 LEU 143 4.938 -6.686 0.823 1085 HD23 LEU 143 2HD2 LEU 143 3.985 -6.603 2.305 1086 H THR 144 H THR 144 4.947 -12.153 -0.778 1087 HA THR 144 HA THR 144 2.626 -12.892 0.674 1088 HB THR 144 HB THR 144 2.453 -14.652 -1.143 1089 HG1 THR 144 1HG THR 144 3.898 -14.338 -2.896 1090 HG21 THR 144 3HG2 THR 144 1.946 -13.105 -2.925 1091 HG22 THR 144 1HG2 THR 144 2.835 -11.829 -2.095 1092 HG23 THR 144 2HG2 THR 144 1.358 -12.481 -1.384 1093 H GLY 145 H GLY 145 2.739 -14.050 2.489 1094 HA2 GLY 145 2HA GLY 145 2.899 -16.272 3.415 1095 HA3 GLY 145 1HA GLY 145 4.327 -16.532 2.426 1096 H ASP 146 H ASP 146 6.319 -15.837 3.144 1097 HA ASP 146 HA ASP 146 6.654 -14.130 5.397 1098 HB2 ASP 146 2HB ASP 146 6.598 -17.073 5.815 1099 HB3 ASP 146 1HB ASP 146 7.863 -16.171 6.645 1100 H ALA 147 H ALA 147 7.652 -14.443 2.695 1101 HA ALA 147 HA ALA 147 10.463 -15.158 3.093 1102 HB1 ALA 147 1HB ALA 147 9.738 -16.130 1.123 1103 HB2 ALA 147 2HB ALA 147 10.503 -14.649 0.550 1104 HB3 ALA 147 3HB ALA 147 8.746 -14.740 0.681 1105 H PHE 148 H PHE 148 9.070 -12.668 4.120 1106 HA PHE 148 HA PHE 148 10.823 -10.682 2.828 1107 HB2 PHE 148 2HB PHE 148 9.197 -8.973 3.660 1108 HB3 PHE 148 1HB PHE 148 8.514 -10.090 2.470 1109 HD1 PHE 148 2HD PHE 148 7.063 -11.972 3.275 1110 HD2 PHE 148 1HD PHE 148 8.277 -8.770 5.803 1111 HE1 PHE 148 2HE PHE 148 5.245 -12.522 4.838 1112 HE2 PHE 148 1HE PHE 148 6.461 -9.316 7.371 1113 HZ PHE 148 HZ PHE 148 4.942 -11.194 6.889 1114 H ARG 149 H ARG 149 9.805 -12.139 5.821 1115 HA ARG 149 HA ARG 149 10.724 -10.333 7.692 1116 HB2 ARG 149 2HB ARG 149 11.034 -13.314 7.969 1117 HB3 ARG 149 1HB ARG 149 10.764 -12.133 9.239 1118 HG2 ARG 149 2HG ARG 149 8.538 -11.673 7.993 1119 HG3 ARG 149 1HG ARG 149 8.832 -13.253 7.264 1120 HD2 ARG 149 2HD ARG 149 8.057 -14.253 9.087 1121 HD3 ARG 149 1HD ARG 149 9.296 -13.464 10.062 1122 HE ARG 149 HE ARG 149 7.420 -11.541 9.799 1123 HH11 ARG 149 1HH1 ARG 149 7.266 -14.880 10.805 1124 HH12 ARG 149 2HH1 ARG 149 5.922 -14.627 11.867 1125 HH21 ARG 149 1HH2 ARG 149 5.653 -11.207 11.194 1126 HH22 ARG 149 2HH2 ARG 149 5.005 -12.542 12.087 1127 H LYS 150 H LYS 150 12.538 -13.218 6.688 1128 HA LYS 150 HA LYS 150 14.984 -11.664 6.535 1129 HB2 LYS 150 2HB LYS 150 14.396 -12.844 8.929 1130 HB3 LYS 150 1HB LYS 150 15.341 -14.100 8.141 1131 HG2 LYS 150 2HG LYS 150 17.189 -12.581 7.839 1132 HG3 LYS 150 1HG LYS 150 16.238 -11.248 8.497 1133 HD2 LYS 150 2HD LYS 150 16.012 -12.708 10.595 1134 HD3 LYS 150 1HD LYS 150 17.334 -13.659 9.915 1135 HE2 LYS 150 2HE LYS 150 18.870 -12.027 10.270 1136 HE3 LYS 150 1HE LYS 150 17.710 -10.726 9.996 1137 HZ1 LYS 150 3HZ LYS 150 16.772 -11.752 12.261 1138 HZ2 LYS 150 1HZ LYS 150 17.910 -10.502 12.213 1139 HZ3 LYS 150 2HZ LYS 150 18.417 -12.096 12.459 1140 H LYS 151 H LYS 151 14.235 -15.114 6.881 1141 HA LYS 151 HA LYS 151 15.454 -15.551 4.234 1142 HB2 LYS 151 2HB LYS 151 15.445 -17.375 6.643 1143 HB3 LYS 151 1HB LYS 151 16.071 -17.813 5.060 1144 HG2 LYS 151 2HG LYS 151 17.978 -16.660 5.349 1145 HG3 LYS 151 1HG LYS 151 17.175 -15.339 6.200 1146 HD2 LYS 151 2HD LYS 151 18.379 -16.225 7.928 1147 HD3 LYS 151 1HD LYS 151 16.909 -17.189 8.074 1148 HE2 LYS 151 2HE LYS 151 18.014 -18.917 6.629 1149 HE3 LYS 151 1HE LYS 151 19.502 -17.979 6.757 1150 HZ1 LYS 151 3HZ LYS 151 18.084 -19.504 8.836 1151 HZ2 LYS 151 1HZ LYS 151 19.052 -18.191 9.284 1152 HZ3 LYS 151 2HZ LYS 151 19.730 -19.497 8.449 1153 H HIS 152 H HIS 152 14.698 -17.604 3.173 1154 HA HIS 152 HA HIS 152 11.784 -17.714 3.347 1155 HB2 HIS 152 2HB HIS 152 11.959 -18.919 1.155 1156 HB3 HIS 152 1HB HIS 152 12.605 -17.282 1.135 1157 HD1 HIS 152 1HD HIS 152 14.931 -19.528 2.764 1158 HD2 HIS 152 2HD HIS 152 14.066 -18.434 -1.152 1159 HE1 HIS 152 1HE HIS 152 16.926 -20.229 1.415 1160 HE2 HIS 152 2HE HIS 152 16.348 -19.639 -0.965 1161 H LEU 153 H LEU 153 10.653 -19.730 3.327 1162 HA LEU 153 HA LEU 153 12.149 -22.136 3.957 1163 HB2 LEU 153 2HB LEU 153 11.123 -20.521 6.015 1164 HB3 LEU 153 1HB LEU 153 10.026 -21.882 5.891 1165 HG LEU 153 HG LEU 153 11.768 -22.302 7.546 1166 HD11 LEU 153 1HD1 LEU 153 12.181 -24.485 6.950 1167 HD12 LEU 153 2HD1 LEU 153 12.467 -24.082 5.257 1168 HD13 LEU 153 3HD1 LEU 153 10.824 -24.085 5.898 1169 HD21 LEU 153 3HD2 LEU 153 14.024 -22.176 7.154 1170 HD22 LEU 153 1HD2 LEU 153 13.442 -20.866 6.128 1171 HD23 LEU 153 2HD2 LEU 153 13.848 -22.428 5.418 1172 H GLU 154 H GLU 154 10.879 -24.062 3.832 1173 HA GLU 154 HA GLU 154 9.302 -25.415 2.910 1174 HB2 GLU 154 2HB GLU 154 7.911 -23.745 4.503 1175 HB3 GLU 154 1HB GLU 154 7.181 -23.345 2.956 1176 HG2 GLU 154 2HG GLU 154 7.354 -26.178 3.182 1177 HG3 GLU 154 1HG GLU 154 6.623 -25.530 4.650 1178 H ASP 155 H ASP 155 9.764 -25.789 0.833 1179 HA ASP 155 HA ASP 155 9.799 -23.804 -1.185 1180 HB2 ASP 155 2HB ASP 155 10.027 -25.730 -2.748 1181 HB3 ASP 155 1HB ASP 155 11.168 -25.785 -1.407 1182 H GLU 156 H GLU 156 8.506 -24.156 -3.279 1183 HA GLU 156 HA GLU 156 5.675 -24.245 -2.536 1184 HB2 GLU 156 2HB GLU 156 7.256 -22.641 -4.339 1185 HB3 GLU 156 1HB GLU 156 5.924 -23.405 -5.214 1186 HG2 GLU 156 2HG GLU 156 5.613 -21.786 -2.693 1187 HG3 GLU 156 1HG GLU 156 5.388 -21.160 -4.327 1188 H LEU 157 H LEU 157 7.653 -25.216 -5.345 1189 HA LEU 157 HA LEU 157 5.790 -27.450 -5.771 1190 HB2 LEU 157 2HB LEU 157 6.989 -25.559 -7.539 1191 HB3 LEU 157 1HB LEU 157 7.582 -27.154 -7.962 1192 HG LEU 157 HG LEU 157 5.018 -27.780 -7.840 1193 HD11 LEU 157 1HD1 LEU 157 4.796 -24.942 -8.772 1194 HD12 LEU 157 2HD1 LEU 157 4.543 -25.373 -7.082 1195 HD13 LEU 157 3HD1 LEU 157 3.516 -26.072 -8.332 1196 HD21 LEU 157 3HD2 LEU 157 6.706 -26.655 -9.989 1197 HD22 LEU 157 1HD2 LEU 157 4.978 -26.778 -10.322 1198 HD23 LEU 157 2HD2 LEU 157 5.896 -28.218 -9.880 Start of MODEL 20 1 H1 MET 1 1HT MET 1 -39.930 2.778 2.386 2 H2 MET 1 2HT MET 1 -38.807 2.218 1.215 3 H3 MET 1 3HT MET 1 -39.642 3.697 0.969 4 HA MET 1 HA MET 1 -37.567 4.335 1.632 5 HB2 MET 1 2HB MET 1 -39.700 4.360 3.708 6 HB3 MET 1 1HB MET 1 -38.096 4.886 4.199 7 HG2 MET 1 2HG MET 1 -38.597 6.890 3.414 8 HG3 MET 1 1HG MET 1 -38.560 6.198 1.793 9 HE1 MET 1 2HE MET 1 -40.269 7.529 4.656 10 HE2 MET 1 3HE MET 1 -42.009 7.470 4.372 11 HE3 MET 1 1HE MET 1 -41.017 8.662 3.530 12 H HIS 2 H HIS 2 -38.767 1.934 3.977 13 HA HIS 2 HA HIS 2 -36.088 1.429 4.948 14 HB2 HIS 2 2HB HIS 2 -38.790 0.902 5.848 15 HB3 HIS 2 1HB HIS 2 -37.800 -0.551 5.957 16 HD1 HIS 2 1HD HIS 2 -35.224 0.256 7.035 17 HD2 HIS 2 2HD HIS 2 -38.711 2.183 8.211 18 HE1 HIS 2 1HE HIS 2 -34.686 1.326 9.246 19 HE2 HIS 2 2HE HIS 2 -36.787 2.555 9.899 20 H HIS 3 H HIS 3 -35.036 -0.612 4.859 21 HA HIS 3 HA HIS 3 -35.098 -1.840 2.325 22 HB2 HIS 3 2HB HIS 3 -33.494 -3.447 3.283 23 HB3 HIS 3 1HB HIS 3 -33.069 -1.785 3.682 24 HD1 HIS 3 1HD HIS 3 -33.572 -1.027 6.180 25 HD2 HIS 3 2HD HIS 3 -33.907 -5.101 5.436 26 HE1 HIS 3 1HE HIS 3 -33.555 -2.126 8.442 27 HE2 HIS 3 2HE HIS 3 -33.671 -4.598 7.963 28 H HIS 4 H HIS 4 -36.983 -2.798 1.747 29 HA HIS 4 HA HIS 4 -37.738 -5.196 3.248 30 HB2 HIS 4 2HB HIS 4 -39.458 -2.825 2.715 31 HB3 HIS 4 1HB HIS 4 -40.198 -4.415 2.564 32 HD1 HIS 4 1HD HIS 4 -38.894 -1.997 5.061 33 HD2 HIS 4 2HD HIS 4 -40.394 -5.872 4.987 34 HE1 HIS 4 1HE HIS 4 -39.385 -2.575 7.459 35 HE2 HIS 4 2HE HIS 4 -40.370 -4.892 7.379 36 H HIS 5 H HIS 5 -38.284 -3.271 0.310 37 HA HIS 5 HA HIS 5 -38.039 -5.702 -1.279 38 HB2 HIS 5 2HB HIS 5 -40.067 -5.158 -2.594 39 HB3 HIS 5 1HB HIS 5 -40.435 -5.549 -0.918 40 HD1 HIS 5 1HD HIS 5 -40.791 -2.904 -3.444 41 HD2 HIS 5 2HD HIS 5 -41.150 -3.259 0.681 42 HE1 HIS 5 1HE HIS 5 -42.039 -0.852 -2.698 43 HE2 HIS 5 2HE HIS 5 -42.167 -1.047 -0.190 44 H HIS 6 H HIS 6 -36.089 -4.851 -2.032 45 HA HIS 6 HA HIS 6 -36.354 -3.049 -4.252 46 HB2 HIS 6 2HB HIS 6 -35.940 -1.755 -1.922 47 HB3 HIS 6 1HB HIS 6 -34.272 -2.100 -2.368 48 HD1 HIS 6 1HD HIS 6 -37.341 -0.629 -4.084 49 HD2 HIS 6 2HD HIS 6 -33.217 -0.156 -3.907 50 HE1 HIS 6 1HE HIS 6 -36.826 1.337 -5.565 51 HE2 HIS 6 2HE HIS 6 -34.336 1.660 -5.371 52 H HIS 7 H HIS 7 -33.633 -3.905 -2.114 53 HA HIS 7 HA HIS 7 -31.587 -4.799 -2.595 54 HB2 HIS 7 2HB HIS 7 -33.608 -6.675 -3.082 55 HB3 HIS 7 1HB HIS 7 -32.500 -6.838 -4.441 56 HD1 HIS 7 1HD HIS 7 -32.687 -7.252 -0.720 57 HD2 HIS 7 2HD HIS 7 -30.010 -7.927 -3.825 58 HE1 HIS 7 1HE HIS 7 -30.849 -8.653 0.271 59 HE2 HIS 7 2HE HIS 7 -29.194 -8.968 -1.603 60 H MET 8 H MET 8 -32.487 -2.683 -4.404 61 HA MET 8 HA MET 8 -31.363 -3.479 -6.979 62 HB2 MET 8 2HB MET 8 -32.978 -1.159 -6.003 63 HB3 MET 8 1HB MET 8 -31.988 -0.960 -7.453 64 HG2 MET 8 2HG MET 8 -33.436 -2.086 -8.702 65 HG3 MET 8 1HG MET 8 -33.540 -3.401 -7.536 66 HE1 MET 8 3HE MET 8 -34.365 0.401 -7.499 67 HE2 MET 8 1HE MET 8 -36.129 0.409 -7.482 68 HE3 MET 8 2HE MET 8 -35.264 -0.139 -8.918 69 H SER 9 H SER 9 -29.659 -2.300 -7.980 70 HA SER 9 HA SER 9 -27.641 -1.441 -6.083 71 HB2 SER 9 2HB SER 9 -27.336 -2.955 -8.210 72 HB3 SER 9 1HB SER 9 -27.229 -1.410 -9.053 73 HG SER 9 HG SER 9 -25.490 -0.855 -7.732 74 H ASP 10 H ASP 10 -26.827 0.590 -5.870 75 HA ASP 10 HA ASP 10 -27.235 2.692 -7.716 76 HB2 ASP 10 2HB ASP 10 -28.727 4.084 -6.211 77 HB3 ASP 10 1HB ASP 10 -29.515 2.739 -7.032 78 H GLY 11 H GLY 11 -25.277 3.559 -7.462 79 HA2 GLY 11 2HA GLY 11 -23.962 5.173 -6.253 80 HA3 GLY 11 1HA GLY 11 -24.520 4.441 -4.755 81 H HIS 12 H HIS 12 -21.805 4.981 -5.459 82 HA HIS 12 HA HIS 12 -20.758 2.233 -5.428 83 HB2 HIS 12 2HB HIS 12 -19.639 4.612 -6.923 84 HB3 HIS 12 1HB HIS 12 -18.736 3.115 -6.648 85 HD1 HIS 12 1HD HIS 12 -19.495 1.017 -7.971 86 HD2 HIS 12 2HD HIS 12 -21.617 4.472 -8.884 87 HE1 HIS 12 1HE HIS 12 -20.762 0.492 -10.079 88 HE2 HIS 12 2HE HIS 12 -22.109 2.566 -10.561 89 H ASN 13 H ASN 13 -18.218 2.515 -4.821 90 HA ASN 13 HA ASN 13 -18.150 4.214 -2.415 91 HB2 ASN 13 2HB ASN 13 -18.201 1.483 -2.389 92 HB3 ASN 13 1HB ASN 13 -16.468 1.797 -2.371 93 HD21 ASN 13 1HD2 ASN 13 -19.498 2.475 -0.729 94 HD22 ASN 13 2HD2 ASN 13 -18.801 2.800 0.818 95 H GLY 14 H GLY 14 -15.678 4.172 -1.598 96 HA2 GLY 14 2HA GLY 14 -14.257 5.768 -3.419 97 HA3 GLY 14 1HA GLY 14 -13.580 5.028 -1.964 98 H LEU 15 H LEU 15 -12.362 5.410 -4.597 99 HA LEU 15 HA LEU 15 -11.345 2.725 -4.921 100 HB2 LEU 15 2HB LEU 15 -12.778 4.139 -7.169 101 HB3 LEU 15 1HB LEU 15 -11.726 2.759 -7.404 102 HG LEU 15 HG LEU 15 -14.254 2.738 -5.756 103 HD11 LEU 15 1HD1 LEU 15 -15.164 2.786 -7.826 104 HD12 LEU 15 2HD1 LEU 15 -14.761 1.070 -7.778 105 HD13 LEU 15 3HD1 LEU 15 -13.695 2.204 -8.609 106 HD21 LEU 15 3HD2 LEU 15 -13.947 0.329 -5.704 107 HD22 LEU 15 1HD2 LEU 15 -12.551 1.141 -4.996 108 HD23 LEU 15 2HD2 LEU 15 -12.452 0.482 -6.630 109 H GLY 16 H GLY 16 -9.863 2.944 -7.157 110 HA2 GLY 16 2HA GLY 16 -7.778 4.722 -6.361 111 HA3 GLY 16 1HA GLY 16 -7.782 3.729 -7.809 112 H LYS 17 H LYS 17 -10.463 4.944 -8.508 113 HA LYS 17 HA LYS 17 -11.235 6.523 -9.926 114 HB2 LYS 17 2HB LYS 17 -11.198 7.774 -7.787 115 HB3 LYS 17 1HB LYS 17 -9.604 8.389 -8.199 116 HG2 LYS 17 2HG LYS 17 -10.696 10.124 -9.073 117 HG3 LYS 17 1HG LYS 17 -11.067 9.042 -10.417 118 HD2 LYS 17 2HD LYS 17 -12.977 8.461 -8.465 119 HD3 LYS 17 1HD LYS 17 -12.834 10.219 -8.456 120 HE2 LYS 17 2HE LYS 17 -12.942 8.980 -11.122 121 HE3 LYS 17 1HE LYS 17 -14.409 8.812 -10.158 122 HZ1 LYS 17 3HZ LYS 17 -13.179 11.458 -10.269 123 HZ2 LYS 17 1HZ LYS 17 -14.816 11.024 -10.221 124 HZ3 LYS 17 2HZ LYS 17 -13.952 10.910 -11.670 125 H GLY 18 H GLY 18 -8.270 8.372 -9.415 126 HA2 GLY 18 2HA GLY 18 -7.802 8.248 -12.298 127 HA3 GLY 18 1HA GLY 18 -7.069 9.392 -11.168 128 H PHE 19 H PHE 19 -6.562 6.896 -9.408 129 HA PHE 19 HA PHE 19 -3.872 6.577 -9.979 130 HB2 PHE 19 2HB PHE 19 -5.501 5.783 -7.959 131 HB3 PHE 19 1HB PHE 19 -5.184 4.236 -8.757 132 HD1 PHE 19 1HD PHE 19 -2.512 4.245 -9.574 133 HD2 PHE 19 2HD PHE 19 -4.188 6.071 -6.119 134 HE1 PHE 19 1HE PHE 19 -0.328 4.103 -8.442 135 HE2 PHE 19 2HE PHE 19 -2.012 5.939 -4.984 136 HZ PHE 19 HZ PHE 19 -0.077 4.951 -6.144 137 H GLY 20 H GLY 20 -6.567 4.437 -10.809 138 HA2 GLY 20 2HA GLY 20 -5.351 3.666 -13.282 139 HA3 GLY 20 1HA GLY 20 -5.231 2.391 -12.066 140 H ASP 21 H ASP 21 -7.362 1.983 -10.874 141 HA ASP 21 HA ASP 21 -9.850 2.559 -11.946 142 HB2 ASP 21 2HB ASP 21 -8.432 0.356 -13.333 143 HB3 ASP 21 1HB ASP 21 -10.110 0.026 -12.877 144 H HIS 22 H HIS 22 -9.533 -0.848 -11.472 145 HA HIS 22 HA HIS 22 -10.259 -0.527 -8.636 146 HB2 HIS 22 2HB HIS 22 -11.533 -2.763 -9.079 147 HB3 HIS 22 1HB HIS 22 -12.273 -1.239 -9.557 148 HD1 HIS 22 1HD HIS 22 -12.876 -0.977 -11.975 149 HD2 HIS 22 2HD HIS 22 -10.386 -4.235 -11.299 150 HE1 HIS 22 1HE HIS 22 -12.774 -2.212 -14.164 151 HE2 HIS 22 2HE HIS 22 -11.335 -4.227 -13.705 152 H ILE 23 H ILE 23 -8.157 -0.888 -7.930 153 HA ILE 23 HA ILE 23 -7.294 -3.676 -8.047 154 HB ILE 23 HB ILE 23 -5.442 -1.364 -8.640 155 HG12 ILE 23 2HG1 ILE 23 -5.375 -2.910 -10.863 156 HG13 ILE 23 1HG1 ILE 23 -7.058 -3.106 -10.388 157 HG21 ILE 23 1HG2 ILE 23 -4.608 -3.497 -7.463 158 HG22 ILE 23 2HG2 ILE 23 -3.719 -2.865 -8.847 159 HG23 ILE 23 3HG2 ILE 23 -4.799 -4.244 -9.049 160 HD11 ILE 23 3HD1 ILE 23 -6.261 -0.344 -10.239 161 HD12 ILE 23 1HD1 ILE 23 -7.573 -1.092 -11.151 162 HD13 ILE 23 2HD1 ILE 23 -5.951 -1.016 -11.841 163 H HIS 24 H HIS 24 -5.308 -0.982 -6.963 164 HA HIS 24 HA HIS 24 -5.224 -2.094 -4.290 165 HB2 HIS 24 2HB HIS 24 -3.778 0.388 -5.157 166 HB3 HIS 24 1HB HIS 24 -3.310 -0.800 -3.938 167 HD1 HIS 24 1HD HIS 24 -3.470 -3.366 -5.598 168 HD2 HIS 24 2HD HIS 24 -1.748 0.165 -6.949 169 HE1 HIS 24 1HE HIS 24 -1.860 -4.052 -7.402 170 HE2 HIS 24 2HE HIS 24 -0.867 -1.895 -8.245 171 H TRP 25 H TRP 25 -7.699 -0.955 -5.094 172 HA TRP 25 HA TRP 25 -8.119 0.925 -2.940 173 HB2 TRP 25 2HB TRP 25 -9.431 2.239 -4.998 174 HB3 TRP 25 1HB TRP 25 -7.917 2.748 -4.250 175 HD1 TRP 25 HD TRP 25 -9.290 1.099 -7.384 176 HE1 TRP 25 1HE TRP 25 -7.435 1.007 -9.135 177 HE3 TRP 25 3HE TRP 25 -5.397 2.651 -4.503 178 HZ2 TRP 25 2HZ TRP 25 -4.643 1.538 -9.294 179 HZ3 TRP 25 3HZ TRP 25 -3.181 2.829 -5.492 180 HH2 TRP 25 HH TRP 25 -2.794 2.286 -7.852 181 H ARG 26 H ARG 26 -9.198 -1.503 -5.062 182 HA ARG 26 HA ARG 26 -11.830 -1.150 -5.459 183 HB2 ARG 26 2HB ARG 26 -10.840 -3.725 -4.255 184 HB3 ARG 26 1HB ARG 26 -12.191 -3.499 -5.362 185 HG2 ARG 26 2HG ARG 26 -10.229 -2.545 -6.900 186 HG3 ARG 26 1HG ARG 26 -9.287 -3.655 -5.904 187 HD2 ARG 26 2HD ARG 26 -10.271 -4.552 -8.091 188 HD3 ARG 26 1HD ARG 26 -10.484 -5.522 -6.627 189 HE ARG 26 HE ARG 26 -12.559 -3.963 -8.003 190 HH11 ARG 26 1HH1 ARG 26 -11.669 -6.259 -5.518 191 HH12 ARG 26 2HH1 ARG 26 -13.298 -6.776 -5.248 192 HH21 ARG 26 1HH2 ARG 26 -14.695 -4.646 -7.637 193 HH22 ARG 26 2HH2 ARG 26 -15.013 -5.863 -6.446 194 H THR 27 H THR 27 -10.363 -1.880 -2.308 195 HA THR 27 HA THR 27 -12.106 -0.566 -0.707 196 HB THR 27 HB THR 27 -14.019 -1.777 -1.386 197 HG1 THR 27 1HG THR 27 -14.361 -1.851 0.687 198 HG21 THR 27 3HG2 THR 27 -14.179 -4.222 -1.358 199 HG22 THR 27 1HG2 THR 27 -12.450 -4.317 -1.025 200 HG23 THR 27 2HG2 THR 27 -13.018 -3.639 -2.549 201 H LEU 28 H LEU 28 -11.370 -0.625 1.351 202 HA LEU 28 HA LEU 28 -9.063 -2.215 1.917 203 HB2 LEU 28 2HB LEU 28 -9.632 0.176 2.719 204 HB3 LEU 28 1HB LEU 28 -10.583 -0.631 3.967 205 HG LEU 28 HG LEU 28 -7.672 -1.273 3.557 206 HD11 LEU 28 1HD1 LEU 28 -7.792 1.124 3.888 207 HD12 LEU 28 2HD1 LEU 28 -7.164 0.338 5.337 208 HD13 LEU 28 3HD1 LEU 28 -8.836 0.899 5.290 209 HD21 LEU 28 3HD2 LEU 28 -8.680 -2.873 4.924 210 HD22 LEU 28 1HD2 LEU 28 -9.699 -1.679 5.730 211 HD23 LEU 28 2HD2 LEU 28 -7.968 -1.732 6.064 212 H GLU 29 H GLU 29 -12.412 -2.184 3.067 213 HA GLU 29 HA GLU 29 -12.219 -4.077 5.087 214 HB2 GLU 29 2HB GLU 29 -14.249 -2.629 4.042 215 HB3 GLU 29 1HB GLU 29 -14.643 -4.216 3.397 216 HG2 GLU 29 2HG GLU 29 -14.115 -4.802 5.999 217 HG3 GLU 29 1HG GLU 29 -14.821 -3.193 6.129 218 H ASP 30 H ASP 30 -13.270 -4.684 1.728 219 HA ASP 30 HA ASP 30 -13.281 -7.476 1.918 220 HB2 ASP 30 2HB ASP 30 -13.937 -5.633 -0.024 221 HB3 ASP 30 1HB ASP 30 -12.540 -6.457 -0.729 222 H GLY 31 H GLY 31 -10.680 -5.222 1.460 223 HA2 GLY 31 2HA GLY 31 -8.769 -6.940 0.311 224 HA3 GLY 31 1HA GLY 31 -8.411 -5.500 1.271 225 H LYS 32 H LYS 32 -9.691 -6.403 3.675 226 HA LYS 32 HA LYS 32 -7.540 -7.912 4.777 227 HB2 LYS 32 2HB LYS 32 -9.995 -6.613 5.778 228 HB3 LYS 32 1HB LYS 32 -9.442 -7.992 6.717 229 HG2 LYS 32 2HG LYS 32 -7.398 -5.992 5.978 230 HG3 LYS 32 1HG LYS 32 -8.613 -5.496 7.157 231 HD2 LYS 32 2HD LYS 32 -7.453 -8.159 7.609 232 HD3 LYS 32 1HD LYS 32 -6.321 -6.813 7.771 233 HE2 LYS 32 2HE LYS 32 -8.526 -5.901 9.120 234 HE3 LYS 32 1HE LYS 32 -8.539 -7.624 9.492 235 HZ1 LYS 32 3HZ LYS 32 -5.971 -7.059 9.872 236 HZ2 LYS 32 1HZ LYS 32 -7.132 -6.977 11.102 237 HZ3 LYS 32 2HZ LYS 32 -6.654 -5.570 10.296 238 H LYS 33 H LYS 33 -10.996 -8.634 4.297 239 HA LYS 33 HA LYS 33 -10.817 -11.322 5.158 240 HB2 LYS 33 2HB LYS 33 -12.936 -10.096 5.106 241 HB3 LYS 33 1HB LYS 33 -12.853 -10.007 3.351 242 HG2 LYS 33 2HG LYS 33 -12.617 -12.712 3.886 243 HG3 LYS 33 1HG LYS 33 -13.811 -12.140 5.064 244 HD2 LYS 33 2HD LYS 33 -15.358 -11.736 3.478 245 HD3 LYS 33 1HD LYS 33 -14.170 -11.097 2.340 246 HE2 LYS 33 2HE LYS 33 -13.637 -13.208 1.520 247 HE3 LYS 33 1HE LYS 33 -14.280 -14.027 2.942 248 HZ1 LYS 33 3HZ LYS 33 -15.908 -14.419 1.397 249 HZ2 LYS 33 1HZ LYS 33 -15.717 -12.923 0.630 250 HZ3 LYS 33 2HZ LYS 33 -16.507 -13.012 2.122 251 H GLU 34 H GLU 34 -10.227 -9.758 2.106 252 HA GLU 34 HA GLU 34 -10.294 -12.173 0.553 253 HB2 GLU 34 2HB GLU 34 -10.808 -9.992 -0.454 254 HB3 GLU 34 1HB GLU 34 -9.162 -9.452 -0.122 255 HG2 GLU 34 2HG GLU 34 -8.303 -10.563 -1.869 256 HG3 GLU 34 1HG GLU 34 -9.379 -11.953 -1.650 257 H ALA 35 H ALA 35 -7.677 -9.951 1.523 258 HA ALA 35 HA ALA 35 -5.509 -11.327 0.563 259 HB1 ALA 35 1HB ALA 35 -4.335 -10.357 2.679 260 HB2 ALA 35 2HB ALA 35 -5.887 -9.559 2.938 261 HB3 ALA 35 3HB ALA 35 -4.981 -9.268 1.452 262 H ALA 36 H ALA 36 -7.488 -12.092 3.324 263 HA ALA 36 HA ALA 36 -5.736 -13.878 4.629 264 HB1 ALA 36 1HB ALA 36 -7.919 -14.799 5.590 265 HB2 ALA 36 2HB ALA 36 -8.717 -13.534 4.656 266 HB3 ALA 36 3HB ALA 36 -7.542 -13.104 5.899 267 H ALA 37 H ALA 37 -8.429 -14.492 2.373 268 HA ALA 37 HA ALA 37 -8.284 -17.244 2.242 269 HB1 ALA 37 1HB ALA 37 -8.994 -16.715 -0.283 270 HB2 ALA 37 2HB ALA 37 -9.252 -15.121 0.428 271 HB3 ALA 37 3HB ALA 37 -10.091 -16.526 1.085 272 H SER 38 H SER 38 -7.093 -15.322 -0.492 273 HA SER 38 HA SER 38 -5.362 -17.311 -1.435 274 HB2 SER 38 2HB SER 38 -5.266 -14.316 -1.890 275 HB3 SER 38 1HB SER 38 -4.374 -15.518 -2.836 276 HG SER 38 HG SER 38 -6.355 -16.380 -3.506 277 H GLY 39 H GLY 39 -4.949 -14.884 1.011 278 HA2 GLY 39 2HA GLY 39 -3.297 -14.786 2.639 279 HA3 GLY 39 1HA GLY 39 -2.426 -16.065 1.789 280 H LEU 40 H LEU 40 -3.467 -13.226 0.068 281 HA LEU 40 HA LEU 40 -0.662 -12.503 -0.311 282 HB2 LEU 40 2HB LEU 40 -1.316 -11.340 -2.253 283 HB3 LEU 40 1HB LEU 40 -2.202 -12.841 -2.277 284 HG LEU 40 HG LEU 40 -3.965 -11.142 -1.030 285 HD11 LEU 40 1HD1 LEU 40 -3.899 -9.049 -1.879 286 HD12 LEU 40 2HD1 LEU 40 -3.077 -9.553 -3.357 287 HD13 LEU 40 3HD1 LEU 40 -2.173 -9.401 -1.851 288 HD21 LEU 40 3HD2 LEU 40 -3.636 -12.256 -3.753 289 HD22 LEU 40 1HD2 LEU 40 -4.841 -10.985 -3.539 290 HD23 LEU 40 2HD2 LEU 40 -4.946 -12.470 -2.592 291 HA PRO 41 HA PRO 41 -0.818 -9.062 2.445 292 HB2 PRO 41 2HB PRO 41 0.918 -7.371 1.140 293 HB3 PRO 41 1HB PRO 41 1.417 -8.714 2.171 294 HG2 PRO 41 2HG PRO 41 1.199 -8.594 -0.810 295 HG3 PRO 41 1HG PRO 41 2.462 -9.333 0.193 296 HD2 PRO 41 2HD PRO 41 0.558 -10.815 -0.973 297 HD3 PRO 41 1HD PRO 41 1.178 -11.213 0.642 298 H LEU 42 H LEU 42 -1.085 -6.602 2.399 299 HA LEU 42 HA LEU 42 -3.119 -5.983 0.405 300 HB2 LEU 42 2HB LEU 42 -2.945 -4.083 2.575 301 HB3 LEU 42 1HB LEU 42 -4.305 -4.997 1.985 302 HG LEU 42 HG LEU 42 -2.313 -6.345 3.749 303 HD11 LEU 42 1HD1 LEU 42 -2.684 -4.816 5.330 304 HD12 LEU 42 2HD1 LEU 42 -4.282 -5.548 5.461 305 HD13 LEU 42 3HD1 LEU 42 -4.049 -4.111 4.464 306 HD21 LEU 42 3HD2 LEU 42 -4.069 -7.657 2.635 307 HD22 LEU 42 1HD2 LEU 42 -5.294 -6.632 3.380 308 HD23 LEU 42 2HD2 LEU 42 -4.265 -7.649 4.389 309 H MET 43 H MET 43 -3.254 -3.824 -0.386 310 HA MET 43 HA MET 43 -0.619 -2.579 -0.729 311 HB2 MET 43 2HB MET 43 -1.764 -3.553 -2.758 312 HB3 MET 43 1HB MET 43 -3.025 -2.330 -2.561 313 HG2 MET 43 2HG MET 43 -1.434 -1.617 -4.217 314 HG3 MET 43 1HG MET 43 -1.297 -0.586 -2.800 315 HE1 MET 43 3HE MET 43 0.283 -0.774 -1.056 316 HE2 MET 43 1HE MET 43 1.456 0.044 -2.089 317 HE3 MET 43 2HE MET 43 1.930 -1.391 -1.180 318 H VAL 44 H VAL 44 -0.777 -1.265 1.127 319 HA VAL 44 HA VAL 44 -3.046 0.488 1.445 320 HB VAL 44 HB VAL 44 -1.956 -0.364 3.449 321 HG11 VAL 44 1HG1 VAL 44 0.438 0.755 2.157 322 HG12 VAL 44 2HG1 VAL 44 0.256 -0.695 3.138 323 HG13 VAL 44 3HG1 VAL 44 0.342 0.889 3.908 324 HG21 VAL 44 3HG2 VAL 44 -1.163 2.423 3.765 325 HG22 VAL 44 1HG2 VAL 44 -2.414 1.498 4.597 326 HG23 VAL 44 2HG2 VAL 44 -2.752 2.224 3.025 327 H ILE 45 H ILE 45 -2.462 1.210 -0.893 328 HA ILE 45 HA ILE 45 -0.398 3.239 -1.016 329 HB ILE 45 HB ILE 45 -2.451 2.284 -3.013 330 HG12 ILE 45 2HG1 ILE 45 0.547 2.289 -3.291 331 HG13 ILE 45 1HG1 ILE 45 -0.292 0.986 -2.437 332 HG21 ILE 45 1HG2 ILE 45 -0.833 4.748 -3.009 333 HG22 ILE 45 2HG2 ILE 45 -2.357 4.390 -3.819 334 HG23 ILE 45 3HG2 ILE 45 -0.837 3.822 -4.509 335 HD11 ILE 45 3HD1 ILE 45 -0.037 0.173 -4.592 336 HD12 ILE 45 1HD1 ILE 45 -0.407 1.729 -5.333 337 HD13 ILE 45 2HD1 ILE 45 -1.692 0.781 -4.583 338 H ILE 46 H ILE 46 -0.709 5.307 -0.460 339 HA ILE 46 HA ILE 46 -3.476 6.313 -0.400 340 HB ILE 46 HB ILE 46 -1.379 7.041 1.633 341 HG12 ILE 46 2HG1 ILE 46 -3.640 5.290 2.403 342 HG13 ILE 46 1HG1 ILE 46 -2.381 4.538 1.433 343 HG21 ILE 46 1HG2 ILE 46 -4.353 7.278 1.889 344 HG22 ILE 46 2HG2 ILE 46 -3.387 8.546 1.144 345 HG23 ILE 46 3HG2 ILE 46 -3.102 8.088 2.823 346 HD11 ILE 46 3HD1 ILE 46 -1.995 4.228 3.815 347 HD12 ILE 46 1HD1 ILE 46 -1.969 5.976 4.045 348 HD13 ILE 46 2HD1 ILE 46 -0.715 5.195 3.082 349 H HIS 47 H HIS 47 -3.779 8.520 -0.813 350 HA HIS 47 HA HIS 47 -1.411 10.000 -1.732 351 HB2 HIS 47 2HB HIS 47 -2.770 10.762 -3.732 352 HB3 HIS 47 1HB HIS 47 -2.226 9.079 -3.764 353 HD1 HIS 47 1HD HIS 47 -5.000 10.839 -4.779 354 HD2 HIS 47 2HD HIS 47 -4.573 7.512 -2.320 355 HE1 HIS 47 1HE HIS 47 -7.236 9.688 -4.808 356 HE2 HIS 47 2HE HIS 47 -6.977 7.725 -3.250 357 H LYS 48 H LYS 48 -1.347 11.801 -0.591 358 HA LYS 48 HA LYS 48 -3.823 13.365 -0.302 359 HB2 LYS 48 2HB LYS 48 -2.031 12.385 1.845 360 HB3 LYS 48 1HB LYS 48 -2.587 14.045 1.990 361 HG2 LYS 48 2HG LYS 48 -4.932 13.118 1.650 362 HG3 LYS 48 1HG LYS 48 -4.217 11.530 1.931 363 HD2 LYS 48 2HD LYS 48 -4.668 11.962 4.093 364 HD3 LYS 48 1HD LYS 48 -3.202 12.941 4.019 365 HE2 LYS 48 2HE LYS 48 -5.529 14.390 3.071 366 HE3 LYS 48 1HE LYS 48 -5.743 13.805 4.720 367 HZ1 LYS 48 3HZ LYS 48 -4.507 16.080 4.107 368 HZ2 LYS 48 1HZ LYS 48 -3.178 15.034 4.150 369 HZ3 LYS 48 2HZ LYS 48 -4.177 15.190 5.506 370 H SER 49 H SER 49 -3.467 15.664 0.015 371 HA SER 49 HA SER 49 -2.494 17.662 -0.485 372 HB2 SER 49 2HB SER 49 -0.353 16.061 0.656 373 HB3 SER 49 1HB SER 49 0.265 17.215 -0.526 374 HG SER 49 HG SER 49 -0.007 17.933 1.757 375 H TRP 50 H TRP 50 -0.428 18.492 -2.005 376 HA TRP 50 HA TRP 50 -1.258 18.126 -4.598 377 HB2 TRP 50 2HB TRP 50 1.139 18.856 -5.236 378 HB3 TRP 50 1HB TRP 50 0.146 19.967 -4.285 379 HD1 TRP 50 HD TRP 50 0.747 20.018 -1.558 380 HE1 TRP 50 1HE TRP 50 3.042 19.804 -0.416 381 HE3 TRP 50 3HE TRP 50 3.360 17.849 -5.381 382 HZ2 TRP 50 2HZ TRP 50 5.622 18.847 -1.052 383 HZ3 TRP 50 3HZ TRP 50 5.737 17.321 -5.034 384 HH2 TRP 50 HH TRP 50 6.844 17.811 -2.914 385 H CYS 51 H CYS 51 1.774 16.706 -3.347 386 HA CYS 51 HA CYS 51 2.895 14.815 -3.885 387 HB2 CYS 51 2HB CYS 51 1.517 13.310 -2.958 388 HB3 CYS 51 1HB CYS 51 0.090 14.146 -3.547 389 H GLY 52 H GLY 52 3.878 13.769 -5.584 390 HA2 GLY 52 2HA GLY 52 2.945 14.576 -8.268 391 HA3 GLY 52 1HA GLY 52 4.607 14.142 -7.862 392 H ALA 53 H ALA 53 3.753 11.852 -6.249 393 HA ALA 53 HA ALA 53 3.884 9.829 -8.171 394 HB1 ALA 53 1HB ALA 53 4.565 9.237 -6.007 395 HB2 ALA 53 2HB ALA 53 3.058 8.353 -6.254 396 HB3 ALA 53 3HB ALA 53 3.067 9.828 -5.284 397 H CYS 54 H CYS 54 1.304 11.790 -7.275 398 HA CYS 54 HA CYS 54 -0.681 9.879 -8.150 399 HB2 CYS 54 2HB CYS 54 -2.230 11.955 -7.636 400 HB3 CYS 54 1HB CYS 54 -1.613 10.938 -6.328 401 H LYS 55 H LYS 55 0.841 12.877 -9.081 402 HA LYS 55 HA LYS 55 -0.816 13.440 -11.308 403 HB2 LYS 55 2HB LYS 55 1.781 14.397 -10.261 404 HB3 LYS 55 1HB LYS 55 1.540 14.595 -11.992 405 HG2 LYS 55 2HG LYS 55 -0.331 15.983 -11.683 406 HG3 LYS 55 1HG LYS 55 -0.481 15.532 -9.976 407 HD2 LYS 55 2HD LYS 55 0.497 17.639 -9.876 408 HD3 LYS 55 1HD LYS 55 1.885 16.557 -9.749 409 HE2 LYS 55 2HE LYS 55 2.747 17.806 -11.401 410 HE3 LYS 55 1HE LYS 55 1.682 16.865 -12.443 411 HZ1 LYS 55 3HZ LYS 55 0.516 19.215 -11.183 412 HZ2 LYS 55 1HZ LYS 55 0.292 18.599 -12.744 413 HZ3 LYS 55 2HZ LYS 55 1.672 19.508 -12.381 414 H ALA 56 H ALA 56 2.202 11.631 -10.894 415 HA ALA 56 HA ALA 56 2.523 11.068 -13.683 416 HB1 ALA 56 1HB ALA 56 3.827 9.186 -11.898 417 HB2 ALA 56 2HB ALA 56 4.111 10.863 -11.435 418 HB3 ALA 56 3HB ALA 56 4.525 10.314 -13.059 419 H LEU 57 H LEU 57 1.543 8.983 -10.944 420 HA LEU 57 HA LEU 57 1.083 6.669 -12.331 421 HB2 LEU 57 2HB LEU 57 -0.546 6.065 -10.588 422 HB3 LEU 57 1HB LEU 57 0.945 6.713 -9.942 423 HG LEU 57 HG LEU 57 -0.250 8.914 -9.665 424 HD11 LEU 57 1HD1 LEU 57 -2.376 7.349 -10.905 425 HD12 LEU 57 2HD1 LEU 57 -2.185 9.095 -10.765 426 HD13 LEU 57 3HD1 LEU 57 -2.869 8.177 -9.428 427 HD21 LEU 57 3HD2 LEU 57 -0.791 8.327 -7.542 428 HD22 LEU 57 1HD2 LEU 57 -0.015 6.814 -8.006 429 HD23 LEU 57 2HD2 LEU 57 -1.772 6.960 -8.060 430 H LYS 58 H LYS 58 -0.917 9.541 -12.345 431 HA LYS 58 HA LYS 58 -3.346 8.576 -13.130 432 HB2 LYS 58 2HB LYS 58 -1.870 11.079 -13.630 433 HB3 LYS 58 1HB LYS 58 -3.202 10.753 -14.732 434 HG2 LYS 58 2HG LYS 58 -4.539 10.299 -12.545 435 HG3 LYS 58 1HG LYS 58 -3.254 11.244 -11.791 436 HD2 LYS 58 2HD LYS 58 -5.007 12.139 -14.081 437 HD3 LYS 58 1HD LYS 58 -5.149 12.660 -12.400 438 HE2 LYS 58 2HE LYS 58 -3.035 13.759 -12.483 439 HE3 LYS 58 1HE LYS 58 -2.661 13.048 -14.053 440 HZ1 LYS 58 3HZ LYS 58 -5.065 14.707 -13.817 441 HZ2 LYS 58 1HZ LYS 58 -4.027 14.492 -15.138 442 HZ3 LYS 58 2HZ LYS 58 -3.561 15.483 -13.848 443 HA PRO 59 HA PRO 59 -2.437 8.316 -17.791 444 HB2 PRO 59 2HB PRO 59 -0.137 9.245 -18.836 445 HB3 PRO 59 1HB PRO 59 -1.517 10.304 -18.486 446 HG2 PRO 59 2HG PRO 59 0.949 9.808 -16.848 447 HG3 PRO 59 1HG PRO 59 0.174 11.347 -17.260 448 HD2 PRO 59 2HD PRO 59 -0.206 10.139 -14.874 449 HD3 PRO 59 1HD PRO 59 -1.476 11.096 -15.674 450 H LYS 60 H LYS 60 0.336 7.591 -15.731 451 HA LYS 60 HA LYS 60 1.148 5.464 -17.580 452 HB2 LYS 60 2HB LYS 60 3.129 5.209 -16.204 453 HB3 LYS 60 1HB LYS 60 2.915 6.896 -16.653 454 HG2 LYS 60 2HG LYS 60 1.605 6.922 -14.359 455 HG3 LYS 60 1HG LYS 60 2.699 5.589 -14.005 456 HD2 LYS 60 2HD LYS 60 3.583 7.807 -13.296 457 HD3 LYS 60 1HD LYS 60 4.617 6.974 -14.454 458 HE2 LYS 60 2HE LYS 60 2.677 8.662 -15.781 459 HE3 LYS 60 1HE LYS 60 3.662 9.578 -14.642 460 HZ1 LYS 60 3HZ LYS 60 4.409 9.057 -17.134 461 HZ2 LYS 60 1HZ LYS 60 5.096 7.722 -16.353 462 HZ3 LYS 60 2HZ LYS 60 5.509 9.289 -15.870 463 H PHE 61 H PHE 61 0.276 5.807 -14.119 464 HA PHE 61 HA PHE 61 0.287 3.024 -13.659 465 HB2 PHE 61 2HB PHE 61 0.328 4.922 -11.918 466 HB3 PHE 61 1HB PHE 61 -1.427 4.947 -12.110 467 HD1 PHE 61 1HD PHE 61 -2.683 2.751 -11.726 468 HD2 PHE 61 2HD PHE 61 1.337 3.399 -10.493 469 HE1 PHE 61 1HE PHE 61 -2.873 0.882 -10.138 470 HE2 PHE 61 2HE PHE 61 1.155 1.531 -8.903 471 HZ PHE 61 HZ PHE 61 -0.951 0.269 -8.726 472 H ALA 62 H ALA 62 -1.867 5.138 -15.266 473 HA ALA 62 HA ALA 62 -4.262 3.675 -15.006 474 HB1 ALA 62 1HB ALA 62 -4.581 5.757 -15.966 475 HB2 ALA 62 2HB ALA 62 -4.653 4.704 -17.380 476 HB3 ALA 62 3HB ALA 62 -3.174 5.600 -17.020 477 H GLU 63 H GLU 63 -1.287 3.155 -16.525 478 HA GLU 63 HA GLU 63 -2.026 1.207 -18.486 479 HB2 GLU 63 2HB GLU 63 0.036 2.743 -18.474 480 HB3 GLU 63 1HB GLU 63 0.704 1.637 -17.268 481 HG2 GLU 63 2HG GLU 63 1.135 0.030 -18.787 482 HG3 GLU 63 1HG GLU 63 -0.322 0.368 -19.721 483 H SER 64 H SER 64 -1.730 1.223 -15.151 484 HA SER 64 HA SER 64 -0.618 -1.199 -14.494 485 HB2 SER 64 2HB SER 64 -2.787 0.430 -13.232 486 HB3 SER 64 1HB SER 64 -2.238 -1.066 -12.505 487 HG SER 64 HG SER 64 -0.715 1.262 -13.036 488 H THR 65 H THR 65 -3.007 -1.042 -16.691 489 HA THR 65 HA THR 65 -5.018 -2.765 -15.945 490 HB THR 65 HB THR 65 -4.443 -3.625 -18.507 491 HG1 THR 65 1HG THR 65 -3.761 -0.891 -18.494 492 HG21 THR 65 3HG2 THR 65 -6.591 -2.699 -17.754 493 HG22 THR 65 1HG2 THR 65 -6.066 -2.040 -19.303 494 HG23 THR 65 2HG2 THR 65 -5.898 -1.079 -17.834 495 H GLU 66 H GLU 66 -1.696 -3.424 -16.832 496 HA GLU 66 HA GLU 66 -1.983 -6.288 -16.601 497 HB2 GLU 66 2HB GLU 66 0.585 -6.193 -16.590 498 HB3 GLU 66 1HB GLU 66 -0.231 -5.671 -18.061 499 HG2 GLU 66 2HG GLU 66 0.178 -3.493 -16.209 500 HG3 GLU 66 1HG GLU 66 1.689 -4.281 -16.654 501 H ILE 67 H ILE 67 -0.969 -3.550 -14.692 502 HA ILE 67 HA ILE 67 0.104 -5.020 -12.520 503 HB ILE 67 HB ILE 67 -0.901 -2.223 -12.846 504 HG12 ILE 67 2HG1 ILE 67 1.856 -3.287 -12.287 505 HG13 ILE 67 1HG1 ILE 67 1.219 -3.018 -13.913 506 HG21 ILE 67 1HG2 ILE 67 -1.106 -3.216 -10.413 507 HG22 ILE 67 2HG2 ILE 67 -0.497 -1.589 -10.698 508 HG23 ILE 67 3HG2 ILE 67 0.630 -2.910 -10.408 509 HD11 ILE 67 3HD1 ILE 67 2.662 -1.213 -12.523 510 HD12 ILE 67 1HD1 ILE 67 1.024 -0.717 -12.096 511 HD13 ILE 67 2HD1 ILE 67 1.507 -0.797 -13.790 512 H SER 68 H SER 68 -3.079 -4.641 -13.644 513 HA SER 68 HA SER 68 -4.490 -4.743 -11.183 514 HB2 SER 68 2HB SER 68 -5.304 -4.300 -13.672 515 HB3 SER 68 1HB SER 68 -5.601 -6.039 -13.640 516 HG SER 68 HG SER 68 -7.240 -4.295 -12.805 517 H GLU 69 H GLU 69 -2.866 -7.107 -13.144 518 HA GLU 69 HA GLU 69 -3.749 -9.245 -11.318 519 HB2 GLU 69 2HB GLU 69 -2.836 -10.689 -13.357 520 HB3 GLU 69 1HB GLU 69 -4.490 -10.101 -13.303 521 HG2 GLU 69 2HG GLU 69 -3.696 -8.112 -14.637 522 HG3 GLU 69 1HG GLU 69 -2.183 -8.985 -14.868 523 H LEU 70 H LEU 70 -1.045 -8.325 -13.429 524 HA LEU 70 HA LEU 70 0.926 -9.931 -12.328 525 HB2 LEU 70 2HB LEU 70 1.742 -9.031 -14.224 526 HB3 LEU 70 1HB LEU 70 0.735 -7.605 -14.086 527 HG LEU 70 HG LEU 70 3.233 -7.270 -14.213 528 HD11 LEU 70 1HD1 LEU 70 3.194 -5.412 -12.650 529 HD12 LEU 70 2HD1 LEU 70 1.746 -6.073 -11.892 530 HD13 LEU 70 3HD1 LEU 70 1.693 -5.527 -13.575 531 HD21 LEU 70 3HD2 LEU 70 3.292 -9.078 -12.112 532 HD22 LEU 70 1HD2 LEU 70 3.650 -7.517 -11.372 533 HD23 LEU 70 2HD2 LEU 70 4.630 -8.103 -12.716 534 H SER 71 H SER 71 -0.530 -7.055 -11.095 535 HA SER 71 HA SER 71 1.457 -6.902 -8.936 536 HB2 SER 71 2HB SER 71 0.364 -4.894 -10.528 537 HB3 SER 71 1HB SER 71 -0.418 -4.708 -8.957 538 HG SER 71 HG SER 71 2.342 -4.666 -9.565 539 H HIS 72 H HIS 72 -1.659 -7.953 -9.599 540 HA HIS 72 HA HIS 72 -3.257 -7.345 -7.475 541 HB2 HIS 72 2HB HIS 72 -3.672 -8.893 -9.526 542 HB3 HIS 72 1HB HIS 72 -3.130 -10.185 -8.446 543 HD1 HIS 72 1HD HIS 72 -5.091 -11.350 -7.517 544 HD2 HIS 72 2HD HIS 72 -5.781 -7.271 -7.907 545 HE1 HIS 72 1HE HIS 72 -7.413 -10.972 -6.629 546 HE2 HIS 72 2HE HIS 72 -7.844 -8.513 -6.964 547 H ASN 73 H ASN 73 -0.319 -8.955 -7.379 548 HA ASN 73 HA ASN 73 -0.324 -10.818 -5.451 549 HB2 ASN 73 2HB ASN 73 1.690 -8.575 -5.455 550 HB3 ASN 73 1HB ASN 73 1.931 -10.276 -5.065 551 HD21 ASN 73 1HD2 ASN 73 2.181 -7.942 -7.441 552 HD22 ASN 73 2HD2 ASN 73 2.442 -8.998 -8.804 553 H PHE 74 H PHE 74 -1.120 -7.489 -4.963 554 HA PHE 74 HA PHE 74 -1.323 -7.924 -2.081 555 HB2 PHE 74 2HB PHE 74 -1.368 -5.166 -2.463 556 HB3 PHE 74 1HB PHE 74 -0.037 -6.125 -1.817 557 HD1 PHE 74 2HD PHE 74 1.730 -6.963 -3.370 558 HD2 PHE 74 1HD PHE 74 -1.172 -4.073 -4.520 559 HE1 PHE 74 2HE PHE 74 3.146 -6.307 -5.271 560 HE2 PHE 74 1HE PHE 74 0.245 -3.408 -6.424 561 HZ PHE 74 HZ PHE 74 2.398 -4.530 -6.800 562 H VAL 75 H VAL 75 -3.025 -5.833 -1.380 563 HA VAL 75 HA VAL 75 -5.303 -6.247 -3.200 564 HB VAL 75 HB VAL 75 -5.338 -7.793 -1.217 565 HG11 VAL 75 1HG1 VAL 75 -6.612 -5.963 0.575 566 HG12 VAL 75 2HG1 VAL 75 -4.988 -5.389 0.206 567 HG13 VAL 75 3HG1 VAL 75 -5.222 -7.011 0.856 568 HG21 VAL 75 3HG2 VAL 75 -7.284 -7.046 -2.690 569 HG22 VAL 75 1HG2 VAL 75 -7.748 -6.011 -1.339 570 HG23 VAL 75 2HG2 VAL 75 -7.676 -7.760 -1.125 571 H MET 76 H MET 76 -6.851 -4.809 -3.375 572 HA MET 76 HA MET 76 -6.600 -2.208 -3.524 573 HB2 MET 76 2HB MET 76 -9.082 -2.112 -3.163 574 HB3 MET 76 1HB MET 76 -8.521 -3.254 -4.362 575 HG2 MET 76 2HG MET 76 -8.747 -4.352 -1.665 576 HG3 MET 76 1HG MET 76 -10.272 -3.815 -2.363 577 HE1 MET 76 3HE MET 76 -11.033 -7.339 -3.341 578 HE2 MET 76 1HE MET 76 -11.530 -5.820 -2.597 579 HE3 MET 76 2HE MET 76 -10.376 -6.868 -1.774 580 H VAL 77 H VAL 77 -5.480 -1.107 -1.803 581 HA VAL 77 HA VAL 77 -7.292 -0.387 0.370 582 HB VAL 77 HB VAL 77 -4.413 -1.136 0.886 583 HG11 VAL 77 1HG1 VAL 77 -4.828 0.573 2.396 584 HG12 VAL 77 2HG1 VAL 77 -5.291 -0.861 3.313 585 HG13 VAL 77 3HG1 VAL 77 -6.532 0.147 2.563 586 HG21 VAL 77 3HG2 VAL 77 -5.241 -3.000 2.104 587 HG22 VAL 77 1HG2 VAL 77 -6.010 -3.027 0.518 588 HG23 VAL 77 2HG2 VAL 77 -6.907 -2.451 1.922 589 H ASN 78 H ASN 78 -7.392 1.430 -1.244 590 HA ASN 78 HA ASN 78 -5.143 3.273 -1.076 591 HB2 ASN 78 2HB ASN 78 -6.283 2.746 -3.262 592 HB3 ASN 78 1HB ASN 78 -7.682 3.612 -2.650 593 HD21 ASN 78 1HD2 ASN 78 -4.178 4.104 -2.831 594 HD22 ASN 78 2HD2 ASN 78 -4.265 5.738 -3.408 595 H LEU 79 H LEU 79 -5.229 4.364 0.852 596 HA LEU 79 HA LEU 79 -7.789 5.371 1.805 597 HB2 LEU 79 2HB LEU 79 -5.129 6.054 3.021 598 HB3 LEU 79 1HB LEU 79 -6.702 6.028 3.783 599 HG LEU 79 HG LEU 79 -5.443 3.498 2.777 600 HD11 LEU 79 1HD1 LEU 79 -4.236 3.181 4.715 601 HD12 LEU 79 2HD1 LEU 79 -5.176 4.367 5.620 602 HD13 LEU 79 3HD1 LEU 79 -3.994 4.903 4.427 603 HD21 LEU 79 3HD2 LEU 79 -6.833 2.649 4.754 604 HD22 LEU 79 1HD2 LEU 79 -7.699 3.177 3.310 605 HD23 LEU 79 2HD2 LEU 79 -7.609 4.232 4.721 606 H GLU 80 H GLU 80 -8.112 7.649 2.298 607 HA GLU 80 HA GLU 80 -6.425 9.560 0.907 608 HB2 GLU 80 2HB GLU 80 -8.588 8.489 -0.445 609 HB3 GLU 80 1HB GLU 80 -9.232 9.999 0.212 610 HG2 GLU 80 2HG GLU 80 -7.381 11.225 -0.827 611 HG3 GLU 80 1HG GLU 80 -6.775 9.709 -1.512 612 H ASP 81 H ASP 81 -7.844 11.808 1.024 613 HA ASP 81 HA ASP 81 -7.704 12.667 3.630 614 HB2 ASP 81 2HB ASP 81 -9.256 14.530 2.897 615 HB3 ASP 81 1HB ASP 81 -7.826 14.293 1.896 616 H GLU 82 H GLU 82 -10.296 10.951 2.067 617 HA GLU 82 HA GLU 82 -12.326 11.541 3.967 618 HB2 GLU 82 2HB GLU 82 -11.990 9.751 1.663 619 HB3 GLU 82 1HB GLU 82 -13.049 9.116 2.914 620 HG2 GLU 82 2HG GLU 82 -13.362 11.842 1.688 621 HG3 GLU 82 1HG GLU 82 -14.192 10.399 1.107 622 H GLU 83 H GLU 83 -10.042 8.852 3.595 623 HA GLU 83 HA GLU 83 -10.979 7.288 5.724 624 HB2 GLU 83 2HB GLU 83 -8.342 7.500 4.297 625 HB3 GLU 83 1HB GLU 83 -8.515 6.447 5.694 626 HG2 GLU 83 2HG GLU 83 -10.223 6.293 3.220 627 HG3 GLU 83 1HG GLU 83 -8.801 5.290 3.530 628 H GLU 84 H GLU 84 -9.083 6.798 7.512 629 HA GLU 84 HA GLU 84 -8.226 9.327 8.685 630 HB2 GLU 84 2HB GLU 84 -9.875 7.324 10.233 631 HB3 GLU 84 1HB GLU 84 -9.230 8.841 10.843 632 HG2 GLU 84 2HG GLU 84 -11.288 9.596 10.392 633 HG3 GLU 84 1HG GLU 84 -10.659 9.746 8.753 634 HA PRO 85 HA PRO 85 -5.216 5.850 9.370 635 HB2 PRO 85 2HB PRO 85 -3.273 7.189 7.741 636 HB3 PRO 85 1HB PRO 85 -4.104 5.659 7.414 637 HG2 PRO 85 2HG PRO 85 -4.461 7.994 5.970 638 HG3 PRO 85 1HG PRO 85 -5.622 6.650 6.036 639 HD2 PRO 85 2HD PRO 85 -5.632 9.249 7.525 640 HD3 PRO 85 1HD PRO 85 -6.994 8.337 6.824 641 H LYS 86 H LYS 86 -4.683 6.337 11.447 642 HA LYS 86 HA LYS 86 -2.995 8.708 11.897 643 HB2 LYS 86 2HB LYS 86 -5.272 7.632 13.334 644 HB3 LYS 86 1HB LYS 86 -3.864 7.777 14.394 645 HG2 LYS 86 2HG LYS 86 -4.954 9.814 14.624 646 HG3 LYS 86 1HG LYS 86 -3.664 10.160 13.470 647 HD2 LYS 86 2HD LYS 86 -5.374 9.711 11.648 648 HD3 LYS 86 1HD LYS 86 -6.595 9.753 12.922 649 HE2 LYS 86 2HE LYS 86 -5.463 12.027 13.528 650 HE3 LYS 86 1HE LYS 86 -4.868 11.952 11.871 651 HZ1 LYS 86 3HZ LYS 86 -7.436 11.398 11.489 652 HZ2 LYS 86 1HZ LYS 86 -6.814 12.973 11.454 653 HZ3 LYS 86 2HZ LYS 86 -7.566 12.391 12.854 654 H ASP 87 H ASP 87 -1.377 7.063 10.966 655 HA ASP 87 HA ASP 87 0.374 6.277 13.005 656 HB2 ASP 87 2HB ASP 87 -1.668 4.444 12.766 657 HB3 ASP 87 1HB ASP 87 -0.408 3.746 11.739 658 H GLU 88 H GLU 88 1.828 4.273 11.848 659 HA GLU 88 HA GLU 88 3.205 5.624 9.795 660 HB2 GLU 88 2HB GLU 88 3.344 2.715 10.605 661 HB3 GLU 88 1HB GLU 88 4.510 3.538 9.577 662 HG2 GLU 88 2HG GLU 88 3.915 4.201 12.452 663 HG3 GLU 88 1HG GLU 88 5.322 3.318 11.859 664 H ASP 89 H ASP 89 0.397 3.715 9.698 665 HA ASP 89 HA ASP 89 0.578 2.383 7.276 666 HB2 ASP 89 2HB ASP 89 -1.771 3.568 8.743 667 HB3 ASP 89 1HB ASP 89 -1.966 2.670 7.229 668 H PHE 90 H PHE 90 0.552 5.770 7.759 669 HA PHE 90 HA PHE 90 -0.245 6.178 4.957 670 HB2 PHE 90 2HB PHE 90 -0.765 8.488 5.517 671 HB3 PHE 90 1HB PHE 90 -1.652 7.384 6.576 672 HD1 PHE 90 1HD PHE 90 1.513 9.360 6.470 673 HD2 PHE 90 2HD PHE 90 -1.650 7.778 8.833 674 HE1 PHE 90 1HE PHE 90 2.392 10.547 8.435 675 HE2 PHE 90 2HE PHE 90 -0.777 8.961 10.803 676 HZ PHE 90 HZ PHE 90 1.248 10.349 10.608 677 H SER 91 H SER 91 2.287 6.624 7.289 678 HA SER 91 HA SER 91 4.225 7.038 5.240 679 HB2 SER 91 2HB SER 91 3.605 9.370 7.074 680 HB3 SER 91 1HB SER 91 5.026 9.259 6.025 681 HG SER 91 HG SER 91 3.410 8.966 4.280 682 HA PRO 92 HA PRO 92 5.804 4.941 9.014 683 HB2 PRO 92 2HB PRO 92 7.542 3.637 7.020 684 HB3 PRO 92 1HB PRO 92 6.469 2.909 8.232 685 HG2 PRO 92 2HG PRO 92 5.881 2.848 5.611 686 HG3 PRO 92 1HG PRO 92 4.621 3.014 6.850 687 HD2 PRO 92 2HD PRO 92 5.850 5.113 5.099 688 HD3 PRO 92 1HD PRO 92 4.149 4.887 5.561 689 H ASP 93 H ASP 93 8.110 5.403 6.334 690 HA ASP 93 HA ASP 93 9.691 7.156 8.088 691 HB2 ASP 93 2HB ASP 93 10.517 4.688 7.810 692 HB3 ASP 93 1HB ASP 93 11.057 5.246 6.219 693 H GLY 94 H GLY 94 7.829 7.669 5.837 694 HA2 GLY 94 2HA GLY 94 9.656 8.663 3.766 695 HA3 GLY 94 1HA GLY 94 7.896 8.553 3.634 696 H GLY 95 H GLY 95 7.557 9.791 6.318 697 HA2 GLY 95 2HA GLY 95 7.627 11.888 7.335 698 HA3 GLY 95 1HA GLY 95 8.656 12.459 6.020 699 H TYR 96 H TYR 96 7.340 12.307 3.798 700 HA TYR 96 HA TYR 96 5.470 14.352 3.849 701 HB2 TYR 96 2HB TYR 96 4.746 13.235 1.556 702 HB3 TYR 96 1HB TYR 96 6.293 14.070 1.732 703 HD1 TYR 96 2HD TYR 96 4.754 10.681 1.876 704 HD2 TYR 96 1HD TYR 96 8.284 12.958 1.238 705 HE1 TYR 96 2HE TYR 96 5.915 8.649 1.134 706 HE2 TYR 96 1HE TYR 96 9.462 10.939 0.512 707 HH TYR 96 HH TYR 96 8.678 8.637 -0.557 708 H ILE 97 H ILE 97 3.193 13.830 2.596 709 HA ILE 97 HA ILE 97 1.852 11.607 3.882 710 HB ILE 97 HB ILE 97 0.229 12.931 5.079 711 HG12 ILE 97 2HG1 ILE 97 -0.148 14.846 3.715 712 HG13 ILE 97 1HG1 ILE 97 0.533 15.438 5.229 713 HG21 ILE 97 1HG2 ILE 97 2.950 14.062 5.630 714 HG22 ILE 97 2HG2 ILE 97 2.399 12.465 6.135 715 HG23 ILE 97 3HG2 ILE 97 1.608 13.912 6.764 716 HD11 ILE 97 3HD1 ILE 97 2.787 15.357 3.982 717 HD12 ILE 97 1HD1 ILE 97 1.659 16.667 3.639 718 HD13 ILE 97 2HD1 ILE 97 1.793 15.303 2.527 719 HA PRO 98 HA PRO 98 0.899 9.805 3.013 720 HB2 PRO 98 2HB PRO 98 -1.771 9.607 1.573 721 HB3 PRO 98 1HB PRO 98 -1.108 8.507 2.814 722 HG2 PRO 98 2HG PRO 98 -2.428 11.008 3.190 723 HG3 PRO 98 1HG PRO 98 -1.740 9.913 4.425 724 HD2 PRO 98 2HD PRO 98 -0.591 12.192 4.106 725 HD3 PRO 98 1HD PRO 98 0.449 10.758 4.108 726 H ARG 99 H ARG 99 1.855 8.167 1.892 727 HA ARG 99 HA ARG 99 1.792 8.356 -1.043 728 HB2 ARG 99 2HB ARG 99 4.050 8.274 0.858 729 HB3 ARG 99 1HB ARG 99 4.232 7.312 -0.612 730 HG2 ARG 99 2HG ARG 99 5.172 9.520 -0.912 731 HG3 ARG 99 1HG ARG 99 3.774 9.301 -1.963 732 HD2 ARG 99 2HD ARG 99 2.425 10.693 -0.639 733 HD3 ARG 99 1HD ARG 99 3.513 10.591 0.732 734 HE ARG 99 HE ARG 99 4.685 12.345 -0.130 735 HH11 ARG 99 1HH1 ARG 99 2.791 10.917 -2.689 736 HH12 ARG 99 2HH1 ARG 99 3.192 12.148 -3.840 737 HH21 ARG 99 1HH2 ARG 99 5.216 13.963 -1.643 738 HH22 ARG 99 2HH2 ARG 99 4.568 13.878 -3.247 739 H ILE 100 H ILE 100 3.283 6.173 -1.719 740 HA ILE 100 HA ILE 100 1.389 4.049 -1.277 741 HB ILE 100 HB ILE 100 3.928 4.198 -2.896 742 HG12 ILE 100 2HG1 ILE 100 1.608 3.547 -4.409 743 HG13 ILE 100 1HG1 ILE 100 1.187 4.891 -3.353 744 HG21 ILE 100 1HG2 ILE 100 2.258 1.849 -2.193 745 HG22 ILE 100 2HG2 ILE 100 3.985 1.952 -2.527 746 HG23 ILE 100 3HG2 ILE 100 2.827 1.980 -3.856 747 HD11 ILE 100 3HD1 ILE 100 2.203 6.285 -4.726 748 HD12 ILE 100 1HD1 ILE 100 2.616 4.937 -5.785 749 HD13 ILE 100 2HD1 ILE 100 3.726 5.423 -4.503 750 H LEU 101 H LEU 101 1.512 2.364 0.059 751 HA LEU 101 HA LEU 101 4.060 1.796 1.439 752 HB2 LEU 101 2HB LEU 101 1.342 2.327 2.552 753 HB3 LEU 101 1HB LEU 101 2.407 1.229 3.399 754 HG LEU 101 HG LEU 101 4.000 2.989 3.787 755 HD11 LEU 101 1HD1 LEU 101 4.093 4.435 2.032 756 HD12 LEU 101 2HD1 LEU 101 3.052 5.369 3.102 757 HD13 LEU 101 3HD1 LEU 101 2.347 4.427 1.790 758 HD21 LEU 101 3HD2 LEU 101 1.829 4.633 4.592 759 HD22 LEU 101 1HD2 LEU 101 2.766 3.493 5.562 760 HD23 LEU 101 2HD2 LEU 101 1.315 2.949 4.714 761 H PHE 102 H PHE 102 4.522 -0.374 1.792 762 HA PHE 102 HA PHE 102 2.483 -2.288 0.845 763 HB2 PHE 102 2HB PHE 102 5.430 -2.216 0.707 764 HB3 PHE 102 1HB PHE 102 4.749 -3.780 1.136 765 HD1 PHE 102 1HD PHE 102 4.461 -1.064 -1.389 766 HD2 PHE 102 2HD PHE 102 4.001 -5.203 -0.520 767 HE1 PHE 102 1HE PHE 102 3.995 -1.508 -3.764 768 HE2 PHE 102 2HE PHE 102 3.536 -5.655 -2.890 769 HZ PHE 102 HZ PHE 102 3.532 -3.807 -4.516 770 H LEU 103 H LEU 103 1.534 -3.640 2.321 771 HA LEU 103 HA LEU 103 2.886 -3.936 4.915 772 HB2 LEU 103 2HB LEU 103 1.050 -3.311 6.174 773 HB3 LEU 103 1HB LEU 103 1.103 -2.114 4.900 774 HG LEU 103 HG LEU 103 -0.753 -4.486 5.007 775 HD11 LEU 103 1HD1 LEU 103 -2.499 -2.841 5.417 776 HD12 LEU 103 2HD1 LEU 103 -1.289 -1.559 5.462 777 HD13 LEU 103 3HD1 LEU 103 -1.285 -2.819 6.697 778 HD21 LEU 103 3HD2 LEU 103 -1.744 -2.649 3.210 779 HD22 LEU 103 1HD2 LEU 103 -0.915 -4.154 2.817 780 HD23 LEU 103 2HD2 LEU 103 -0.010 -2.642 2.886 781 H ASP 104 H ASP 104 2.101 -5.662 6.258 782 HA ASP 104 HA ASP 104 1.846 -8.092 4.871 783 HB2 ASP 104 2HB ASP 104 1.251 -7.465 7.777 784 HB3 ASP 104 1HB ASP 104 1.452 -9.089 7.102 785 HA PRO 105 HA PRO 105 -2.464 -8.514 4.097 786 HB2 PRO 105 2HB PRO 105 -2.860 -11.174 4.515 787 HB3 PRO 105 1HB PRO 105 -2.025 -10.517 3.095 788 HG2 PRO 105 2HG PRO 105 -0.878 -11.683 5.606 789 HG3 PRO 105 1HG PRO 105 -0.372 -11.927 3.918 790 HD2 PRO 105 2HD PRO 105 0.927 -10.247 5.592 791 HD3 PRO 105 1HD PRO 105 0.795 -9.939 3.849 792 H SER 106 H SER 106 -1.740 -7.834 6.917 793 HA SER 106 HA SER 106 -4.257 -8.675 8.120 794 HB2 SER 106 2HB SER 106 -1.595 -8.693 9.577 795 HB3 SER 106 1HB SER 106 -3.176 -9.042 10.295 796 HG SER 106 HG SER 106 -1.574 -10.775 9.254 797 H GLY 107 H GLY 107 -2.931 -6.264 6.811 798 HA2 GLY 107 2HA GLY 107 -3.134 -3.989 7.028 799 HA3 GLY 107 1HA GLY 107 -4.115 -4.289 8.466 800 H LYS 108 H LYS 108 -0.701 -5.035 7.683 801 HA LYS 108 HA LYS 108 0.030 -3.355 10.005 802 HB2 LYS 108 2HB LYS 108 0.485 -6.212 9.594 803 HB3 LYS 108 1HB LYS 108 1.945 -5.329 10.017 804 HG2 LYS 108 2HG LYS 108 -0.398 -4.668 11.653 805 HG3 LYS 108 1HG LYS 108 0.174 -6.339 11.802 806 HD2 LYS 108 2HD LYS 108 2.362 -5.599 12.425 807 HD3 LYS 108 1HD LYS 108 1.961 -3.922 12.050 808 HE2 LYS 108 2HE LYS 108 0.192 -5.224 14.003 809 HE3 LYS 108 1HE LYS 108 1.861 -5.013 14.533 810 HZ1 LYS 108 3HZ LYS 108 -0.190 -3.018 14.023 811 HZ2 LYS 108 1HZ LYS 108 1.370 -2.612 13.511 812 HZ3 LYS 108 2HZ LYS 108 1.085 -3.001 15.133 813 H VAL 109 H VAL 109 0.556 -1.723 8.375 814 HA VAL 109 HA VAL 109 2.455 -2.023 6.342 815 HB VAL 109 HB VAL 109 0.975 0.045 7.021 816 HG11 VAL 109 1HG1 VAL 109 3.616 0.766 8.289 817 HG12 VAL 109 2HG1 VAL 109 2.129 0.420 9.172 818 HG13 VAL 109 3HG1 VAL 109 2.215 1.820 8.106 819 HG21 VAL 109 3HG2 VAL 109 3.625 0.849 5.956 820 HG22 VAL 109 1HG2 VAL 109 2.006 1.191 5.346 821 HG23 VAL 109 2HG2 VAL 109 2.729 -0.397 5.085 822 H HIS 110 H HIS 110 4.530 -2.228 6.228 823 HA HIS 110 HA HIS 110 6.098 -1.829 8.689 824 HB2 HIS 110 2HB HIS 110 5.634 -4.275 7.511 825 HB3 HIS 110 1HB HIS 110 7.174 -3.804 6.800 826 HD1 HIS 110 1HD HIS 110 5.848 -5.510 9.633 827 HD2 HIS 110 2HD HIS 110 9.085 -2.985 8.988 828 HE1 HIS 110 1HE HIS 110 7.407 -5.908 11.566 829 HE2 HIS 110 2HE HIS 110 9.316 -4.307 11.200 830 HA PRO 111 HA PRO 111 8.254 0.960 5.959 831 HB2 PRO 111 2HB PRO 111 10.362 1.500 7.603 832 HB3 PRO 111 1HB PRO 111 8.767 2.231 7.803 833 HG2 PRO 111 2HG PRO 111 9.983 -0.083 9.252 834 HG3 PRO 111 1HG PRO 111 9.016 1.255 9.894 835 HD2 PRO 111 2HD PRO 111 7.983 -1.204 9.429 836 HD3 PRO 111 1HD PRO 111 7.025 0.284 9.256 837 H GLU 112 H GLU 112 8.565 -1.888 5.600 838 HA GLU 112 HA GLU 112 11.462 -2.075 5.069 839 HB2 GLU 112 2HB GLU 112 9.453 -4.034 5.989 840 HB3 GLU 112 1HB GLU 112 10.575 -4.626 4.773 841 HG2 GLU 112 2HG GLU 112 12.132 -3.249 6.649 842 HG3 GLU 112 1HG GLU 112 10.980 -4.207 7.577 843 H ILE 113 H ILE 113 8.252 -2.810 3.754 844 HA ILE 113 HA ILE 113 9.413 -3.229 1.115 845 HB ILE 113 HB ILE 113 6.510 -3.402 1.904 846 HG12 ILE 113 2HG1 ILE 113 7.821 -4.996 3.210 847 HG13 ILE 113 1HG1 ILE 113 6.875 -5.847 1.980 848 HG21 ILE 113 1HG2 ILE 113 7.981 -4.546 -0.470 849 HG22 ILE 113 2HG2 ILE 113 6.993 -3.085 -0.504 850 HG23 ILE 113 3HG2 ILE 113 6.249 -4.646 -0.155 851 HD11 ILE 113 3HD1 ILE 113 9.655 -5.955 2.455 852 HD12 ILE 113 1HD1 ILE 113 9.412 -5.208 0.877 853 HD13 ILE 113 2HD1 ILE 113 8.717 -6.792 1.219 854 H ILE 114 H ILE 114 10.022 -1.340 0.328 855 HA ILE 114 HA ILE 114 7.952 0.666 -0.234 856 HB ILE 114 HB ILE 114 9.604 2.458 0.194 857 HG12 ILE 114 2HG1 ILE 114 11.562 0.792 -0.092 858 HG13 ILE 114 1HG1 ILE 114 11.732 2.061 1.110 859 HG21 ILE 114 1HG2 ILE 114 9.440 2.459 2.590 860 HG22 ILE 114 2HG2 ILE 114 9.172 0.716 2.611 861 HG23 ILE 114 3HG2 ILE 114 7.960 1.785 1.906 862 HD11 ILE 114 3HD1 ILE 114 12.118 -0.643 1.489 863 HD12 ILE 114 1HD1 ILE 114 10.551 -0.328 2.231 864 HD13 ILE 114 2HD1 ILE 114 11.969 0.583 2.746 865 H ASN 115 H ASN 115 9.371 2.455 -1.641 866 HA ASN 115 HA ASN 115 10.074 1.007 -4.047 867 HB2 ASN 115 2HB ASN 115 8.678 3.044 -4.184 868 HB3 ASN 115 1HB ASN 115 10.005 3.991 -3.496 869 HD21 ASN 115 1HD2 ASN 115 8.920 4.698 -5.884 870 HD22 ASN 115 2HD2 ASN 115 10.057 4.388 -7.168 871 H GLU 116 H GLU 116 12.005 -0.004 -3.240 872 HA GLU 116 HA GLU 116 14.174 1.252 -2.088 873 HB2 GLU 116 2HB GLU 116 13.828 -1.191 -3.752 874 HB3 GLU 116 1HB GLU 116 15.474 -0.609 -3.476 875 HG2 GLU 116 2HG GLU 116 13.523 -1.080 -1.245 876 HG3 GLU 116 1HG GLU 116 14.575 -2.347 -1.867 877 H ASN 117 H ASN 117 13.060 1.443 -5.353 878 HA ASN 117 HA ASN 117 15.563 2.548 -6.329 879 HB2 ASN 117 2HB ASN 117 13.349 1.241 -7.517 880 HB3 ASN 117 1HB ASN 117 13.401 2.876 -8.192 881 HD21 ASN 117 1HD2 ASN 117 14.828 -0.224 -8.125 882 HD22 ASN 117 2HD2 ASN 117 16.104 0.088 -9.270 883 H GLY 118 H GLY 118 13.122 3.745 -4.503 884 HA2 GLY 118 2HA GLY 118 12.626 6.236 -5.840 885 HA3 GLY 118 1HA GLY 118 12.174 5.823 -4.183 886 H ASN 119 H ASN 119 13.357 6.620 -2.532 887 HA ASN 119 HA ASN 119 16.070 7.508 -2.898 888 HB2 ASN 119 2HB ASN 119 14.029 9.350 -3.463 889 HB3 ASN 119 1HB ASN 119 14.617 9.786 -1.852 890 HD21 ASN 119 1HD2 ASN 119 15.190 11.733 -3.172 891 HD22 ASN 119 2HD2 ASN 119 16.771 11.748 -3.906 892 HA PRO 120 HA PRO 120 16.456 6.716 1.415 893 HB2 PRO 120 2HB PRO 120 17.901 9.286 1.720 894 HB3 PRO 120 1HB PRO 120 18.442 7.635 2.076 895 HG2 PRO 120 2HG PRO 120 19.371 8.958 -0.049 896 HG3 PRO 120 1HG PRO 120 19.030 7.214 -0.128 897 HD2 PRO 120 2HD PRO 120 17.414 9.517 -1.165 898 HD3 PRO 120 1HD PRO 120 17.733 7.931 -1.911 899 H SER 121 H SER 121 14.823 9.471 0.284 900 HA SER 121 HA SER 121 13.477 9.758 2.863 901 HB2 SER 121 2HB SER 121 15.140 11.814 1.558 902 HB3 SER 121 1HB SER 121 13.509 12.364 1.978 903 HG SER 121 HG SER 121 14.020 11.379 4.120 904 H TYR 122 H TYR 122 13.020 8.575 0.204 905 HA TYR 122 HA TYR 122 10.384 9.660 -0.261 906 HB2 TYR 122 2HB TYR 122 12.689 10.223 -1.948 907 HB3 TYR 122 1HB TYR 122 11.385 9.449 -2.841 908 HD1 TYR 122 2HD TYR 122 8.975 10.567 -1.678 909 HD2 TYR 122 1HD TYR 122 12.698 12.459 -2.480 910 HE1 TYR 122 2HE TYR 122 7.829 12.735 -1.843 911 HE2 TYR 122 1HE TYR 122 11.567 14.634 -2.642 912 HH TYR 122 HH TYR 122 8.580 15.242 -1.502 913 H LYS 123 H LYS 123 11.842 7.138 0.577 914 HA LYS 123 HA LYS 123 11.817 5.101 -1.237 915 HB2 LYS 123 2HB LYS 123 11.339 5.288 1.683 916 HB3 LYS 123 1HB LYS 123 10.888 3.779 0.905 917 HG2 LYS 123 2HG LYS 123 13.613 5.062 0.904 918 HG3 LYS 123 1HG LYS 123 13.116 3.607 1.787 919 HD2 LYS 123 2HD LYS 123 13.731 2.392 0.032 920 HD3 LYS 123 1HD LYS 123 12.438 3.155 -0.902 921 HE2 LYS 123 2HE LYS 123 13.929 4.203 -2.164 922 HE3 LYS 123 1HE LYS 123 14.655 4.950 -0.744 923 HZ1 LYS 123 3HZ LYS 123 15.781 3.037 -2.393 924 HZ2 LYS 123 1HZ LYS 123 15.449 2.239 -0.940 925 HZ3 LYS 123 2HZ LYS 123 16.407 3.631 -0.940 926 H TYR 124 H TYR 124 9.038 6.802 -0.076 927 HA TYR 124 HA TYR 124 7.283 4.694 -1.130 928 HB2 TYR 124 2HB TYR 124 6.407 7.033 0.552 929 HB3 TYR 124 1HB TYR 124 5.543 5.521 0.249 930 HD1 TYR 124 2HD TYR 124 8.517 6.961 1.945 931 HD2 TYR 124 1HD TYR 124 5.838 3.668 1.675 932 HE1 TYR 124 2HE TYR 124 9.484 6.013 3.997 933 HE2 TYR 124 1HE TYR 124 6.793 2.713 3.727 934 HH TYR 124 HH TYR 124 8.890 2.832 5.010 935 H PHE 125 H PHE 125 8.733 6.754 -2.732 936 HA PHE 125 HA PHE 125 6.428 8.196 -3.855 937 HB2 PHE 125 2HB PHE 125 8.632 9.388 -3.127 938 HB3 PHE 125 1HB PHE 125 9.273 8.746 -4.645 939 HD1 PHE 125 2HD PHE 125 6.122 10.413 -3.519 940 HD2 PHE 125 1HD PHE 125 9.272 10.236 -6.375 941 HE1 PHE 125 2HE PHE 125 5.115 12.297 -4.741 942 HE2 PHE 125 1HE PHE 125 8.270 12.120 -7.603 943 HZ PHE 125 HZ PHE 125 6.187 13.149 -6.785 944 H TYR 126 H TYR 126 5.529 7.292 -5.592 945 HA TYR 126 HA TYR 126 7.256 5.721 -7.389 946 HB2 TYR 126 2HB TYR 126 4.459 5.268 -6.426 947 HB3 TYR 126 1HB TYR 126 4.933 4.661 -8.017 948 HD1 TYR 126 2HD TYR 126 7.646 3.731 -7.616 949 HD2 TYR 126 1HD TYR 126 4.299 3.445 -5.006 950 HE1 TYR 126 2HE TYR 126 8.642 1.745 -6.566 951 HE2 TYR 126 1HE TYR 126 5.286 1.457 -3.950 952 HH TYR 126 HH TYR 126 7.904 0.598 -3.731 953 H VAL 127 H VAL 127 7.553 8.037 -8.237 954 HA VAL 127 HA VAL 127 5.360 9.029 -9.852 955 HB VAL 127 HB VAL 127 6.865 10.626 -8.742 956 HG11 VAL 127 1HG1 VAL 127 8.886 8.960 -9.395 957 HG12 VAL 127 2HG1 VAL 127 9.108 10.648 -8.938 958 HG13 VAL 127 3HG1 VAL 127 9.071 10.194 -10.641 959 HG21 VAL 127 3HG2 VAL 127 5.980 11.803 -10.445 960 HG22 VAL 127 1HG2 VAL 127 6.397 10.581 -11.645 961 HG23 VAL 127 2HG2 VAL 127 7.617 11.729 -11.096 962 H SER 128 H SER 128 5.610 6.646 -10.781 963 HA SER 128 HA SER 128 6.086 6.784 -13.467 964 HB2 SER 128 2HB SER 128 8.576 6.295 -11.933 965 HB3 SER 128 1HB SER 128 8.307 5.250 -13.339 966 HG SER 128 HG SER 128 8.184 7.071 -14.631 967 H ALA 129 H ALA 129 5.123 5.060 -14.360 968 HA ALA 129 HA ALA 129 4.145 2.936 -12.726 969 HB1 ALA 129 1HB ALA 129 4.067 3.442 -15.691 970 HB2 ALA 129 2HB ALA 129 2.766 3.629 -14.514 971 HB3 ALA 129 3HB ALA 129 3.344 2.019 -14.943 972 H GLU 130 H GLU 130 6.963 3.378 -14.691 973 HA GLU 130 HA GLU 130 7.555 0.644 -15.166 974 HB2 GLU 130 2HB GLU 130 8.478 2.619 -16.435 975 HB3 GLU 130 1HB GLU 130 9.526 2.929 -15.046 976 HG2 GLU 130 2HG GLU 130 10.598 0.785 -15.327 977 HG3 GLU 130 1HG GLU 130 9.488 0.373 -16.646 978 H GLN 131 H GLN 131 8.542 2.933 -12.632 979 HA GLN 131 HA GLN 131 10.277 1.013 -11.420 980 HB2 GLN 131 2HB GLN 131 10.349 2.573 -9.515 981 HB3 GLN 131 1HB GLN 131 10.869 3.266 -11.045 982 HG2 GLN 131 2HG GLN 131 8.507 4.194 -11.239 983 HG3 GLN 131 1HG GLN 131 8.314 3.750 -9.545 984 HE21 GLN 131 1HE2 GLN 131 7.964 6.030 -9.216 985 HE22 GLN 131 2HE2 GLN 131 9.320 7.086 -9.048 986 H VAL 132 H VAL 132 7.162 2.441 -10.417 987 HA VAL 132 HA VAL 132 6.783 0.957 -8.129 988 HB VAL 132 HB VAL 132 5.256 2.717 -8.569 989 HG11 VAL 132 1HG1 VAL 132 3.767 1.427 -10.742 990 HG12 VAL 132 2HG1 VAL 132 5.374 2.012 -11.173 991 HG13 VAL 132 3HG1 VAL 132 4.183 3.123 -10.494 992 HG21 VAL 132 3HG2 VAL 132 3.415 1.758 -7.693 993 HG22 VAL 132 1HG2 VAL 132 4.450 0.333 -7.619 994 HG23 VAL 132 2HG2 VAL 132 3.319 0.533 -8.958 995 H VAL 133 H VAL 133 6.583 -0.072 -11.439 996 HA VAL 133 HA VAL 133 5.146 -2.483 -10.816 997 HB VAL 133 HB VAL 133 5.012 -1.437 -13.072 998 HG11 VAL 133 1HG1 VAL 133 6.998 -0.737 -13.861 999 HG12 VAL 133 2HG1 VAL 133 7.101 -2.378 -14.494 1000 HG13 VAL 133 3HG1 VAL 133 7.902 -1.965 -12.979 1001 HG21 VAL 133 3HG2 VAL 133 4.842 -3.477 -14.225 1002 HG22 VAL 133 1HG2 VAL 133 4.563 -3.887 -12.531 1003 HG23 VAL 133 2HG2 VAL 133 6.129 -4.219 -13.272 1004 H GLN 134 H GLN 134 8.550 -1.505 -11.059 1005 HA GLN 134 HA GLN 134 9.434 -4.268 -11.025 1006 HB2 GLN 134 2HB GLN 134 11.692 -3.154 -10.387 1007 HB3 GLN 134 1HB GLN 134 11.058 -2.933 -12.009 1008 HG2 GLN 134 2HG GLN 134 10.206 -0.752 -11.387 1009 HG3 GLN 134 1HG GLN 134 10.817 -0.967 -9.749 1010 HE21 GLN 134 1HE2 GLN 134 11.759 -0.711 -13.129 1011 HE22 GLN 134 2HE2 GLN 134 13.362 -0.096 -12.827 1012 H GLY 135 H GLY 135 8.865 -1.703 -8.730 1013 HA2 GLY 135 2HA GLY 135 9.913 -3.157 -6.474 1014 HA3 GLY 135 1HA GLY 135 8.955 -1.669 -6.419 1015 H MET 136 H MET 136 6.949 -3.065 -8.245 1016 HA MET 136 HA MET 136 5.390 -4.239 -6.086 1017 HB2 MET 136 2HB MET 136 4.817 -3.261 -8.850 1018 HB3 MET 136 1HB MET 136 3.714 -4.422 -8.130 1019 HG2 MET 136 2HG MET 136 3.406 -2.905 -6.216 1020 HG3 MET 136 1HG MET 136 4.460 -1.733 -6.996 1021 HE1 MET 136 3HE MET 136 2.123 -1.603 -10.413 1022 HE2 MET 136 1HE MET 136 3.239 -2.901 -9.990 1023 HE3 MET 136 2HE MET 136 3.752 -1.219 -9.857 1024 H LYS 137 H LYS 137 6.928 -5.152 -9.093 1025 HA LYS 137 HA LYS 137 5.916 -7.829 -9.109 1026 HB2 LYS 137 2HB LYS 137 7.129 -8.146 -11.080 1027 HB3 LYS 137 1HB LYS 137 6.677 -6.451 -11.130 1028 HG2 LYS 137 2HG LYS 137 8.999 -6.020 -10.109 1029 HG3 LYS 137 1HG LYS 137 9.362 -7.669 -10.622 1030 HD2 LYS 137 2HD LYS 137 8.489 -5.369 -12.368 1031 HD3 LYS 137 1HD LYS 137 10.074 -6.143 -12.342 1032 HE2 LYS 137 2HE LYS 137 7.540 -7.614 -13.030 1033 HE3 LYS 137 1HE LYS 137 8.537 -6.805 -14.237 1034 HZ1 LYS 137 3HZ LYS 137 9.688 -8.800 -12.386 1035 HZ2 LYS 137 1HZ LYS 137 10.292 -8.266 -13.875 1036 HZ3 LYS 137 2HZ LYS 137 8.934 -9.272 -13.826 1037 H GLU 138 H GLU 138 8.321 -6.257 -7.366 1038 HA GLU 138 HA GLU 138 9.915 -8.674 -6.957 1039 HB2 GLU 138 2HB GLU 138 10.389 -5.769 -6.623 1040 HB3 GLU 138 1HB GLU 138 11.143 -6.818 -5.424 1041 HG2 GLU 138 2HG GLU 138 11.571 -7.884 -8.048 1042 HG3 GLU 138 1HG GLU 138 12.069 -6.185 -7.993 1043 H ALA 139 H ALA 139 8.579 -6.066 -4.956 1044 HA ALA 139 HA ALA 139 8.711 -7.293 -2.492 1045 HB1 ALA 139 1HB ALA 139 8.074 -4.936 -2.857 1046 HB2 ALA 139 2HB ALA 139 6.971 -5.775 -1.766 1047 HB3 ALA 139 3HB ALA 139 6.497 -5.474 -3.438 1048 H GLN 140 H GLN 140 6.542 -7.878 -5.124 1049 HA GLN 140 HA GLN 140 4.518 -9.201 -3.688 1050 HB2 GLN 140 2HB GLN 140 3.815 -10.024 -5.897 1051 HB3 GLN 140 1HB GLN 140 4.072 -8.280 -5.867 1052 HG2 GLN 140 2HG GLN 140 5.044 -8.913 -7.851 1053 HG3 GLN 140 1HG GLN 140 6.420 -8.870 -6.750 1054 HE21 GLN 140 1HE2 GLN 140 3.873 -11.229 -7.484 1055 HE22 GLN 140 2HE2 GLN 140 4.942 -12.554 -7.768 1056 H GLU 141 H GLU 141 7.672 -10.165 -4.536 1057 HA GLU 141 HA GLU 141 6.959 -13.005 -4.315 1058 HB2 GLU 141 2HB GLU 141 8.301 -13.262 -6.074 1059 HB3 GLU 141 1HB GLU 141 8.783 -11.565 -5.998 1060 HG2 GLU 141 2HG GLU 141 10.442 -12.245 -4.235 1061 HG3 GLU 141 1HG GLU 141 10.074 -13.918 -4.649 1062 H ARG 142 H ARG 142 8.777 -10.453 -2.823 1063 HA ARG 142 HA ARG 142 10.082 -12.302 -0.985 1064 HB2 ARG 142 2HB ARG 142 11.062 -10.107 -0.068 1065 HB3 ARG 142 1HB ARG 142 11.577 -10.642 -1.673 1066 HG2 ARG 142 2HG ARG 142 10.065 -9.072 -2.719 1067 HG3 ARG 142 1HG ARG 142 9.436 -8.584 -1.136 1068 HD2 ARG 142 2HD ARG 142 11.103 -7.012 -2.118 1069 HD3 ARG 142 1HD ARG 142 11.544 -7.639 -0.523 1070 HE ARG 142 HE ARG 142 12.846 -8.222 -3.063 1071 HH11 ARG 142 1HH1 ARG 142 12.579 -8.930 0.350 1072 HH12 ARG 142 2HH1 ARG 142 14.125 -9.706 0.432 1073 HH21 ARG 142 1HH2 ARG 142 14.872 -9.242 -2.948 1074 HH22 ARG 142 2HH2 ARG 142 15.426 -9.882 -1.437 1075 H LEU 143 H LEU 143 7.667 -9.732 -0.966 1076 HA LEU 143 HA LEU 143 7.313 -9.775 1.871 1077 HB2 LEU 143 2HB LEU 143 6.835 -7.810 0.414 1078 HB3 LEU 143 1HB LEU 143 5.453 -8.689 -0.241 1079 HG LEU 143 HG LEU 143 4.362 -8.677 1.915 1080 HD11 LEU 143 1HD1 LEU 143 5.582 -7.117 3.666 1081 HD12 LEU 143 2HD1 LEU 143 7.016 -7.729 2.843 1082 HD13 LEU 143 3HD1 LEU 143 5.886 -8.852 3.597 1083 HD21 LEU 143 3HD2 LEU 143 5.292 -6.175 0.661 1084 HD22 LEU 143 1HD2 LEU 143 4.569 -6.022 2.262 1085 HD23 LEU 143 2HD2 LEU 143 3.653 -6.763 0.949 1086 H THR 144 H THR 144 5.458 -11.070 -0.878 1087 HA THR 144 HA THR 144 3.277 -12.094 0.437 1088 HB THR 144 HB THR 144 3.282 -13.845 -1.384 1089 HG1 THR 144 1HG THR 144 5.348 -14.125 -1.938 1090 HG21 THR 144 3HG2 THR 144 2.769 -12.359 -3.155 1091 HG22 THR 144 1HG2 THR 144 3.726 -11.070 -2.427 1092 HG23 THR 144 2HG2 THR 144 2.232 -11.602 -1.654 1093 H GLY 145 H GLY 145 3.163 -13.382 2.149 1094 HA2 GLY 145 2HA GLY 145 3.384 -15.555 3.112 1095 HA3 GLY 145 1HA GLY 145 4.899 -15.752 2.244 1096 H ASP 146 H ASP 146 6.763 -15.303 3.265 1097 HA ASP 146 HA ASP 146 7.001 -13.415 5.374 1098 HB2 ASP 146 2HB ASP 146 6.518 -16.264 6.075 1099 HB3 ASP 146 1HB ASP 146 7.767 -15.418 6.983 1100 H ALA 147 H ALA 147 8.303 -14.167 2.892 1101 HA ALA 147 HA ALA 147 10.886 -15.238 3.683 1102 HB1 ALA 147 1HB ALA 147 9.658 -14.462 1.062 1103 HB2 ALA 147 2HB ALA 147 10.252 -16.037 1.591 1104 HB3 ALA 147 3HB ALA 147 11.393 -14.749 1.204 1105 H PHE 148 H PHE 148 9.366 -12.183 3.122 1106 HA PHE 148 HA PHE 148 11.557 -10.578 2.509 1107 HB2 PHE 148 2HB PHE 148 10.213 -8.710 3.428 1108 HB3 PHE 148 1HB PHE 148 9.281 -9.749 2.342 1109 HD1 PHE 148 1HD PHE 148 7.597 -11.293 3.261 1110 HD2 PHE 148 2HD PHE 148 9.646 -8.489 5.720 1111 HE1 PHE 148 1HE PHE 148 5.887 -11.580 5.007 1112 HE2 PHE 148 2HE PHE 148 7.942 -8.772 7.472 1113 HZ PHE 148 HZ PHE 148 6.059 -10.319 7.116 1114 H ARG 149 H ARG 149 10.412 -11.792 5.609 1115 HA ARG 149 HA ARG 149 12.010 -10.182 7.269 1116 HB2 ARG 149 2HB ARG 149 11.184 -13.007 7.907 1117 HB3 ARG 149 1HB ARG 149 11.419 -11.663 9.011 1118 HG2 ARG 149 2HG ARG 149 9.455 -10.546 7.975 1119 HG3 ARG 149 1HG ARG 149 9.181 -12.014 7.036 1120 HD2 ARG 149 2HD ARG 149 9.372 -12.032 10.027 1121 HD3 ARG 149 1HD ARG 149 7.852 -11.742 9.189 1122 HE ARG 149 HE ARG 149 7.933 -13.957 8.344 1123 HH11 ARG 149 1HH1 ARG 149 10.486 -13.267 10.636 1124 HH12 ARG 149 2HH1 ARG 149 10.809 -14.935 10.957 1125 HH21 ARG 149 1HH2 ARG 149 8.369 -16.144 8.770 1126 HH22 ARG 149 2HH2 ARG 149 9.611 -16.567 9.898 1127 H LYS 150 H LYS 150 13.434 -11.883 8.890 1128 HA LYS 150 HA LYS 150 15.533 -12.913 7.094 1129 HB2 LYS 150 2HB LYS 150 15.911 -10.739 8.547 1130 HB3 LYS 150 1HB LYS 150 16.202 -11.909 9.827 1131 HG2 LYS 150 2HG LYS 150 18.199 -12.490 9.009 1132 HG3 LYS 150 1HG LYS 150 17.625 -12.492 7.341 1133 HD2 LYS 150 2HD LYS 150 17.841 -9.846 8.632 1134 HD3 LYS 150 1HD LYS 150 19.365 -10.683 8.325 1135 HE2 LYS 150 2HE LYS 150 19.187 -9.710 6.299 1136 HE3 LYS 150 1HE LYS 150 18.120 -11.074 5.967 1137 HZ1 LYS 150 3HZ LYS 150 17.104 -8.514 7.053 1138 HZ2 LYS 150 1HZ LYS 150 16.230 -9.759 6.311 1139 HZ3 LYS 150 2HZ LYS 150 17.259 -8.784 5.389 1140 H LYS 151 H LYS 151 17.103 -14.372 8.443 1141 HA LYS 151 HA LYS 151 15.416 -16.413 9.680 1142 HB2 LYS 151 2HB LYS 151 18.036 -16.403 8.277 1143 HB3 LYS 151 1HB LYS 151 17.802 -17.621 9.523 1144 HG2 LYS 151 2HG LYS 151 16.376 -18.810 8.271 1145 HG3 LYS 151 1HG LYS 151 15.573 -17.372 7.640 1146 HD2 LYS 151 2HD LYS 151 16.571 -18.042 5.717 1147 HD3 LYS 151 1HD LYS 151 17.925 -17.132 6.387 1148 HE2 LYS 151 2HE LYS 151 17.870 -19.856 7.372 1149 HE3 LYS 151 1HE LYS 151 17.929 -19.800 5.610 1150 HZ1 LYS 151 3HZ LYS 151 20.146 -19.807 6.448 1151 HZ2 LYS 151 1HZ LYS 151 19.827 -18.519 7.499 1152 HZ3 LYS 151 2HZ LYS 151 19.842 -18.265 5.826 1153 H HIS 152 H HIS 152 18.112 -14.291 10.389 1154 HA HIS 152 HA HIS 152 18.889 -15.462 12.838 1155 HB2 HIS 152 2HB HIS 152 19.174 -12.621 11.845 1156 HB3 HIS 152 1HB HIS 152 19.962 -13.255 13.285 1157 HD1 HIS 152 1HD HIS 152 21.932 -14.904 12.927 1158 HD2 HIS 152 2HD HIS 152 20.311 -13.389 9.414 1159 HE1 HIS 152 1HE HIS 152 23.584 -15.481 11.120 1160 HE2 HIS 152 2HE HIS 152 22.540 -14.631 8.992 1161 H LEU 153 H LEU 153 18.827 -13.769 14.846 1162 HA LEU 153 HA LEU 153 17.570 -12.964 16.561 1163 HB2 LEU 153 2HB LEU 153 16.893 -11.443 14.478 1164 HB3 LEU 153 1HB LEU 153 15.336 -12.201 14.756 1165 HG LEU 153 HG LEU 153 16.673 -11.035 17.129 1166 HD11 LEU 153 1HD1 LEU 153 16.769 -9.486 14.935 1167 HD12 LEU 153 2HD1 LEU 153 16.539 -8.857 16.566 1168 HD13 LEU 153 3HD1 LEU 153 15.147 -9.101 15.512 1169 HD21 LEU 153 3HD2 LEU 153 14.565 -11.998 17.510 1170 HD22 LEU 153 1HD2 LEU 153 13.875 -11.263 16.063 1171 HD23 LEU 153 2HD2 LEU 153 14.272 -10.259 17.458 1172 H GLU 154 H GLU 154 16.699 -14.376 17.915 1173 HA GLU 154 HA GLU 154 14.341 -15.904 17.026 1174 HB2 GLU 154 2HB GLU 154 16.773 -16.812 18.528 1175 HB3 GLU 154 1HB GLU 154 15.234 -17.627 18.777 1176 HG2 GLU 154 2HG GLU 154 15.317 -18.666 16.798 1177 HG3 GLU 154 1HG GLU 154 15.964 -17.252 15.967 1178 H ASP 155 H ASP 155 16.111 -15.074 20.015 1179 HA ASP 155 HA ASP 155 13.567 -14.188 21.181 1180 HB2 ASP 155 2HB ASP 155 14.766 -16.573 21.886 1181 HB3 ASP 155 1HB ASP 155 15.353 -15.463 23.120 1182 H GLU 156 H GLU 156 13.688 -12.275 22.171 1183 HA GLU 156 HA GLU 156 16.039 -11.362 23.520 1184 HB2 GLU 156 2HB GLU 156 15.638 -10.651 20.719 1185 HB3 GLU 156 1HB GLU 156 15.758 -9.229 21.763 1186 HG2 GLU 156 2HG GLU 156 17.764 -11.474 21.661 1187 HG3 GLU 156 1HG GLU 156 17.918 -9.935 20.816 1188 H LEU 157 H LEU 157 13.208 -11.753 24.041 1189 HA LEU 157 HA LEU 157 11.513 -10.750 25.175 1190 HB2 LEU 157 2HB LEU 157 13.860 -9.055 25.712 1191 HB3 LEU 157 1HB LEU 157 12.312 -8.272 25.974 1192 HG LEU 157 HG LEU 157 12.811 -10.957 27.191 1193 HD11 LEU 157 1HD1 LEU 157 14.780 -9.724 27.818 1194 HD12 LEU 157 2HD1 LEU 157 13.692 -9.820 29.203 1195 HD13 LEU 157 3HD1 LEU 157 13.804 -8.327 28.272 1196 HD21 LEU 157 3HD2 LEU 157 11.458 -9.519 28.999 1197 HD22 LEU 157 1HD2 LEU 157 10.674 -10.414 27.697 1198 HD23 LEU 157 2HD2 LEU 157 10.959 -8.682 27.529 Start of MODEL 21 1 H1 MET 1 1HT MET 1 -22.451 11.946 18.517 2 H2 MET 1 2HT MET 1 -23.029 12.122 20.125 3 H3 MET 1 3HT MET 1 -23.829 11.067 19.033 4 HA MET 1 HA MET 1 -21.631 9.877 18.876 5 HB2 MET 1 2HB MET 1 -20.149 10.159 20.741 6 HB3 MET 1 1HB MET 1 -20.437 11.745 20.044 7 HG2 MET 1 2HG MET 1 -22.369 11.702 21.914 8 HG3 MET 1 1HG MET 1 -21.163 10.675 22.685 9 HE1 MET 1 2HE MET 1 -22.539 13.781 23.032 10 HE2 MET 1 3HE MET 1 -22.004 14.356 21.453 11 HE3 MET 1 1HE MET 1 -21.328 15.058 22.923 12 H HIS 2 H HIS 2 -22.308 7.883 19.275 13 HA HIS 2 HA HIS 2 -23.430 7.170 21.841 14 HB2 HIS 2 2HB HIS 2 -25.281 8.004 20.113 15 HB3 HIS 2 1HB HIS 2 -25.129 6.348 19.535 16 HD1 HIS 2 1HD HIS 2 -26.495 4.659 20.733 17 HD2 HIS 2 2HD HIS 2 -25.938 8.100 22.995 18 HE1 HIS 2 1HE HIS 2 -27.900 4.343 22.795 19 HE2 HIS 2 2HE HIS 2 -27.611 6.472 24.108 20 H HIS 3 H HIS 3 -23.157 5.966 18.493 21 HA HIS 3 HA HIS 3 -22.179 3.414 19.565 22 HB2 HIS 3 2HB HIS 3 -24.014 4.039 17.511 23 HB3 HIS 3 1HB HIS 3 -22.594 3.365 16.716 24 HD1 HIS 3 1HD HIS 3 -22.452 0.887 16.671 25 HD2 HIS 3 2HD HIS 3 -25.054 2.247 19.611 26 HE1 HIS 3 1HE HIS 3 -23.521 -1.178 17.630 27 HE2 HIS 3 2HE HIS 3 -25.155 -0.324 19.348 28 H HIS 4 H HIS 4 -20.769 2.385 17.520 29 HA HIS 4 HA HIS 4 -18.534 4.280 17.199 30 HB2 HIS 4 2HB HIS 4 -18.529 1.295 17.634 31 HB3 HIS 4 1HB HIS 4 -17.113 2.172 17.064 32 HD1 HIS 4 1HD HIS 4 -16.537 4.336 18.786 33 HD2 HIS 4 2HD HIS 4 -18.514 1.015 20.314 34 HE1 HIS 4 1HE HIS 4 -16.187 4.430 21.273 35 HE2 HIS 4 2HE HIS 4 -17.318 2.365 22.167 36 H HIS 5 H HIS 5 -17.419 4.322 15.240 37 HA HIS 5 HA HIS 5 -17.182 4.256 12.980 38 HB2 HIS 5 2HB HIS 5 -17.873 1.545 13.769 39 HB3 HIS 5 1HB HIS 5 -18.409 1.902 12.131 40 HD1 HIS 5 1HD HIS 5 -16.686 1.717 10.349 41 HD2 HIS 5 2HD HIS 5 -14.998 2.047 14.130 42 HE1 HIS 5 1HE HIS 5 -14.215 1.392 10.011 43 HE2 HIS 5 2HE HIS 5 -13.206 1.684 12.301 44 H HIS 6 H HIS 6 -18.361 4.361 10.924 45 HA HIS 6 HA HIS 6 -21.085 5.325 11.375 46 HB2 HIS 6 2HB HIS 6 -18.899 6.121 9.675 47 HB3 HIS 6 1HB HIS 6 -20.334 5.812 8.703 48 HD1 HIS 6 1HD HIS 6 -22.587 6.983 10.122 49 HD2 HIS 6 2HD HIS 6 -18.825 8.739 10.293 50 HE1 HIS 6 1HE HIS 6 -22.993 9.381 10.759 51 HE2 HIS 6 2HE HIS 6 -20.698 10.403 10.938 52 H HIS 7 H HIS 7 -19.539 2.553 10.278 53 HA HIS 7 HA HIS 7 -20.273 0.655 9.268 54 HB2 HIS 7 2HB HIS 7 -22.765 1.977 10.154 55 HB3 HIS 7 1HB HIS 7 -22.959 0.771 8.885 56 HD1 HIS 7 1HD HIS 7 -22.823 1.080 12.454 57 HD2 HIS 7 2HD HIS 7 -21.666 -1.807 9.699 58 HE1 HIS 7 1HE HIS 7 -22.586 -1.049 13.770 59 HE2 HIS 7 2HE HIS 7 -21.801 -2.762 12.098 60 H MET 8 H MET 8 -20.951 -0.187 7.219 61 HA MET 8 HA MET 8 -20.312 1.446 5.043 62 HB2 MET 8 2HB MET 8 -21.903 -1.129 5.026 63 HB3 MET 8 1HB MET 8 -21.086 -0.404 3.637 64 HG2 MET 8 2HG MET 8 -19.044 -1.103 4.300 65 HG3 MET 8 1HG MET 8 -19.420 -0.945 6.015 66 HE1 MET 8 3HE MET 8 -20.390 -4.085 7.295 67 HE2 MET 8 1HE MET 8 -21.858 -3.306 6.699 68 HE3 MET 8 2HE MET 8 -20.552 -2.330 7.369 69 H SER 9 H SER 9 -22.053 1.223 3.046 70 HA SER 9 HA SER 9 -23.931 2.086 2.097 71 HB2 SER 9 2HB SER 9 -25.501 2.201 4.604 72 HB3 SER 9 1HB SER 9 -25.925 1.516 3.035 73 HG SER 9 HG SER 9 -25.221 0.198 5.160 74 H ASP 10 H ASP 10 -21.904 3.770 3.421 75 HA ASP 10 HA ASP 10 -23.028 6.278 2.986 76 HB2 ASP 10 2HB ASP 10 -23.004 7.124 5.384 77 HB3 ASP 10 1HB ASP 10 -24.350 6.074 4.950 78 H GLY 11 H GLY 11 -21.231 7.117 2.143 79 HA2 GLY 11 2HA GLY 11 -19.189 8.317 3.217 80 HA3 GLY 11 1HA GLY 11 -18.670 6.664 3.512 81 H HIS 12 H HIS 12 -17.677 8.967 1.773 82 HA HIS 12 HA HIS 12 -17.943 8.081 -0.927 83 HB2 HIS 12 2HB HIS 12 -16.077 9.702 -1.361 84 HB3 HIS 12 1HB HIS 12 -17.471 10.404 -0.528 85 HD1 HIS 12 1HD HIS 12 -13.855 9.661 -0.119 86 HD2 HIS 12 2HD HIS 12 -17.003 11.104 2.179 87 HE1 HIS 12 1HE HIS 12 -12.792 10.648 1.935 88 HE2 HIS 12 2HE HIS 12 -14.721 11.438 3.350 89 H ASN 13 H ASN 13 -15.305 7.904 1.455 90 HA ASN 13 HA ASN 13 -13.588 6.437 1.709 91 HB2 ASN 13 2HB ASN 13 -15.602 4.904 0.274 92 HB3 ASN 13 1HB ASN 13 -13.971 4.381 -0.134 93 HD21 ASN 13 1HD2 ASN 13 -13.964 2.472 0.925 94 HD22 ASN 13 2HD2 ASN 13 -14.093 2.316 2.641 95 H GLY 14 H GLY 14 -14.393 6.181 -1.764 96 HA2 GLY 14 2HA GLY 14 -13.173 7.157 -3.537 97 HA3 GLY 14 1HA GLY 14 -11.856 7.493 -2.410 98 H LEU 15 H LEU 15 -11.919 6.140 -5.084 99 HA LEU 15 HA LEU 15 -10.432 3.760 -4.247 100 HB2 LEU 15 2HB LEU 15 -12.529 3.816 -6.415 101 HB3 LEU 15 1HB LEU 15 -11.428 2.481 -6.130 102 HG LEU 15 HG LEU 15 -12.486 2.620 -3.690 103 HD11 LEU 15 1HD1 LEU 15 -13.885 4.599 -4.460 104 HD12 LEU 15 2HD1 LEU 15 -14.736 3.290 -3.639 105 HD13 LEU 15 3HD1 LEU 15 -14.820 3.433 -5.395 106 HD21 LEU 15 3HD2 LEU 15 -13.404 1.229 -6.165 107 HD22 LEU 15 1HD2 LEU 15 -14.311 1.026 -4.666 108 HD23 LEU 15 2HD2 LEU 15 -12.607 0.573 -4.735 109 H GLY 16 H GLY 16 -8.474 4.741 -4.741 110 HA2 GLY 16 2HA GLY 16 -6.764 5.553 -6.058 111 HA3 GLY 16 1HA GLY 16 -7.376 4.404 -7.229 112 H LYS 17 H LYS 17 -9.176 7.186 -6.071 113 HA LYS 17 HA LYS 17 -9.994 8.075 -8.554 114 HB2 LYS 17 2HB LYS 17 -10.816 8.771 -6.228 115 HB3 LYS 17 1HB LYS 17 -9.509 9.948 -6.247 116 HG2 LYS 17 2HG LYS 17 -10.704 10.412 -8.650 117 HG3 LYS 17 1HG LYS 17 -12.079 9.960 -7.642 118 HD2 LYS 17 2HD LYS 17 -10.051 12.104 -7.005 119 HD3 LYS 17 1HD LYS 17 -11.691 12.378 -7.598 120 HE2 LYS 17 2HE LYS 17 -12.004 10.720 -5.383 121 HE3 LYS 17 1HE LYS 17 -10.755 11.872 -4.907 122 HZ1 LYS 17 3HZ LYS 17 -12.773 12.866 -4.326 123 HZ2 LYS 17 1HZ LYS 17 -13.526 12.435 -5.779 124 HZ3 LYS 17 2HZ LYS 17 -12.334 13.634 -5.768 125 H GLY 18 H GLY 18 -6.951 8.568 -6.968 126 HA2 GLY 18 2HA GLY 18 -6.128 10.318 -9.206 127 HA3 GLY 18 1HA GLY 18 -5.551 10.560 -7.553 128 H PHE 19 H PHE 19 -5.912 7.642 -9.554 129 HA PHE 19 HA PHE 19 -3.049 7.320 -9.762 130 HB2 PHE 19 2HB PHE 19 -3.998 6.383 -7.465 131 HB3 PHE 19 1HB PHE 19 -4.449 5.010 -8.485 132 HD1 PHE 19 2HD PHE 19 -1.965 5.414 -10.357 133 HD2 PHE 19 1HD PHE 19 -2.477 5.080 -6.144 134 HE1 PHE 19 2HE PHE 19 0.317 4.515 -10.150 135 HE2 PHE 19 1HE PHE 19 -0.198 4.180 -5.933 136 HZ PHE 19 HZ PHE 19 1.201 3.894 -7.938 137 H GLY 20 H GLY 20 -5.960 5.253 -9.860 138 HA2 GLY 20 2HA GLY 20 -5.596 4.920 -12.743 139 HA3 GLY 20 1HA GLY 20 -5.480 3.468 -11.750 140 H ASP 21 H ASP 21 -7.313 2.506 -10.999 141 HA ASP 21 HA ASP 21 -9.864 3.871 -11.163 142 HB2 ASP 21 2HB ASP 21 -8.995 1.832 -13.123 143 HB3 ASP 21 1HB ASP 21 -10.613 1.596 -12.444 144 H HIS 22 H HIS 22 -9.346 0.377 -11.266 145 HA HIS 22 HA HIS 22 -10.047 0.224 -8.411 146 HB2 HIS 22 2HB HIS 22 -11.314 -1.908 -9.047 147 HB3 HIS 22 1HB HIS 22 -12.067 -0.378 -9.485 148 HD1 HIS 22 1HD HIS 22 -12.448 0.077 -11.951 149 HD2 HIS 22 2HD HIS 22 -10.248 -3.378 -11.249 150 HE1 HIS 22 1HE HIS 22 -12.311 -1.096 -14.171 151 HE2 HIS 22 2HE HIS 22 -10.907 -3.142 -13.739 152 H ILE 23 H ILE 23 -7.852 -0.105 -7.918 153 HA ILE 23 HA ILE 23 -6.909 -2.815 -8.478 154 HB ILE 23 HB ILE 23 -5.437 -0.266 -9.089 155 HG12 ILE 23 2HG1 ILE 23 -5.047 -2.466 -10.913 156 HG13 ILE 23 1HG1 ILE 23 -6.764 -2.202 -10.636 157 HG21 ILE 23 1HG2 ILE 23 -3.598 -2.244 -9.564 158 HG22 ILE 23 2HG2 ILE 23 -4.289 -2.703 -8.008 159 HG23 ILE 23 3HG2 ILE 23 -3.582 -1.102 -8.223 160 HD11 ILE 23 3HD1 ILE 23 -6.772 -0.272 -11.764 161 HD12 ILE 23 1HD1 ILE 23 -5.282 -0.894 -12.473 162 HD13 ILE 23 2HD1 ILE 23 -5.211 0.233 -11.118 163 H HIS 24 H HIS 24 -4.914 -0.276 -7.064 164 HA HIS 24 HA HIS 24 -4.798 -1.785 -4.586 165 HB2 HIS 24 2HB HIS 24 -3.300 0.762 -5.166 166 HB3 HIS 24 1HB HIS 24 -2.883 -0.521 -4.024 167 HD1 HIS 24 1HD HIS 24 -2.942 -2.976 -5.770 168 HD2 HIS 24 2HD HIS 24 -1.335 0.645 -7.024 169 HE1 HIS 24 1HE HIS 24 -1.331 -3.557 -7.612 170 HE2 HIS 24 2HE HIS 24 -0.446 -1.341 -8.421 171 H TRP 25 H TRP 25 -7.235 -0.468 -5.242 172 HA TRP 25 HA TRP 25 -7.614 1.075 -2.823 173 HB2 TRP 25 2HB TRP 25 -9.033 2.629 -4.576 174 HB3 TRP 25 1HB TRP 25 -7.440 3.035 -3.931 175 HD1 TRP 25 HD TRP 25 -9.213 2.015 -7.101 176 HE1 TRP 25 1HE TRP 25 -7.556 2.111 -9.057 177 HE3 TRP 25 3HE TRP 25 -4.874 2.688 -4.499 178 HZ2 TRP 25 2HZ TRP 25 -4.798 2.445 -9.473 179 HZ3 TRP 25 3HZ TRP 25 -2.769 2.899 -5.754 180 HH2 TRP 25 HH TRP 25 -2.730 2.771 -8.190 181 H ARG 26 H ARG 26 -8.674 -1.145 -5.108 182 HA ARG 26 HA ARG 26 -11.322 -0.945 -5.422 183 HB2 ARG 26 2HB ARG 26 -10.239 -2.840 -6.335 184 HB3 ARG 26 1HB ARG 26 -9.698 -3.389 -4.766 185 HG2 ARG 26 2HG ARG 26 -11.405 -4.842 -5.499 186 HG3 ARG 26 1HG ARG 26 -12.047 -3.880 -4.172 187 HD2 ARG 26 2HD ARG 26 -12.433 -2.724 -6.838 188 HD3 ARG 26 1HD ARG 26 -13.270 -4.262 -6.576 189 HE ARG 26 HE ARG 26 -13.653 -2.325 -4.474 190 HH11 ARG 26 1HH1 ARG 26 -14.825 -3.517 -7.541 191 HH12 ARG 26 2HH1 ARG 26 -16.429 -2.910 -7.304 192 HH21 ARG 26 1HH2 ARG 26 -15.764 -1.526 -4.165 193 HH22 ARG 26 2HH2 ARG 26 -16.962 -1.779 -5.390 194 H THR 27 H THR 27 -9.772 -1.507 -2.289 195 HA THR 27 HA THR 27 -11.516 -0.495 -0.609 196 HB THR 27 HB THR 27 -12.723 -3.040 -1.611 197 HG1 THR 27 1HG THR 27 -13.736 -0.540 -0.744 198 HG21 THR 27 3HG2 THR 27 -14.115 -3.295 0.342 199 HG22 THR 27 1HG2 THR 27 -13.257 -1.987 1.158 200 HG23 THR 27 2HG2 THR 27 -12.420 -3.494 0.782 201 H LEU 28 H LEU 28 -11.037 -0.848 1.529 202 HA LEU 28 HA LEU 28 -8.676 -2.389 2.041 203 HB2 LEU 28 2HB LEU 28 -9.156 -0.195 3.109 204 HB3 LEU 28 1HB LEU 28 -10.472 -0.958 4.004 205 HG LEU 28 HG LEU 28 -7.776 -2.179 4.266 206 HD11 LEU 28 1HD1 LEU 28 -7.608 -0.399 6.254 207 HD12 LEU 28 2HD1 LEU 28 -8.421 0.595 5.046 208 HD13 LEU 28 3HD1 LEU 28 -6.867 -0.151 4.674 209 HD21 LEU 28 3HD2 LEU 28 -8.620 -3.018 6.181 210 HD22 LEU 28 1HD2 LEU 28 -10.166 -2.654 5.413 211 HD23 LEU 28 2HD2 LEU 28 -9.475 -1.529 6.582 212 H GLU 29 H GLU 29 -12.106 -2.713 2.777 213 HA GLU 29 HA GLU 29 -11.883 -4.863 4.588 214 HB2 GLU 29 2HB GLU 29 -13.923 -3.299 3.862 215 HB3 GLU 29 1HB GLU 29 -14.283 -4.682 2.840 216 HG2 GLU 29 2HG GLU 29 -14.281 -6.130 4.820 217 HG3 GLU 29 1HG GLU 29 -13.969 -4.719 5.832 218 H ASP 30 H ASP 30 -13.254 -5.115 1.303 219 HA ASP 30 HA ASP 30 -13.114 -7.825 1.003 220 HB2 ASP 30 2HB ASP 30 -12.794 -5.620 -1.031 221 HB3 ASP 30 1HB ASP 30 -12.838 -7.328 -1.495 222 H GLY 31 H GLY 31 -10.520 -5.486 0.475 223 HA2 GLY 31 2HA GLY 31 -8.645 -7.211 -0.698 224 HA3 GLY 31 1HA GLY 31 -8.252 -5.761 0.233 225 H LYS 32 H LYS 32 -9.579 -6.771 2.648 226 HA LYS 32 HA LYS 32 -7.352 -8.286 3.678 227 HB2 LYS 32 2HB LYS 32 -8.375 -6.482 5.000 228 HB3 LYS 32 1HB LYS 32 -9.894 -7.368 5.034 229 HG2 LYS 32 2HG LYS 32 -8.555 -9.243 6.151 230 HG3 LYS 32 1HG LYS 32 -7.312 -8.017 6.407 231 HD2 LYS 32 2HD LYS 32 -8.429 -7.612 8.317 232 HD3 LYS 32 1HD LYS 32 -9.529 -6.707 7.274 233 HE2 LYS 32 2HE LYS 32 -11.187 -8.189 7.548 234 HE3 LYS 32 1HE LYS 32 -10.103 -9.569 7.378 235 HZ1 LYS 32 3HZ LYS 32 -11.302 -8.926 9.654 236 HZ2 LYS 32 1HZ LYS 32 -9.862 -8.056 9.847 237 HZ3 LYS 32 2HZ LYS 32 -9.815 -9.728 9.590 238 H LYS 33 H LYS 33 -10.784 -8.839 3.044 239 HA LYS 33 HA LYS 33 -11.031 -11.359 4.225 240 HB2 LYS 33 2HB LYS 33 -12.947 -10.037 3.443 241 HB3 LYS 33 1HB LYS 33 -12.445 -10.290 1.776 242 HG2 LYS 33 2HG LYS 33 -12.630 -12.820 2.412 243 HG3 LYS 33 1HG LYS 33 -13.680 -12.203 3.700 244 HD2 LYS 33 2HD LYS 33 -15.352 -11.801 2.271 245 HD3 LYS 33 1HD LYS 33 -14.277 -11.012 1.114 246 HE2 LYS 33 2HE LYS 33 -13.508 -13.368 0.492 247 HE3 LYS 33 1HE LYS 33 -14.920 -13.935 1.383 248 HZ1 LYS 33 3HZ LYS 33 -16.314 -13.240 -0.218 249 HZ2 LYS 33 1HZ LYS 33 -14.947 -13.327 -1.210 250 HZ3 LYS 33 2HZ LYS 33 -15.426 -11.841 -0.561 251 H GLU 34 H GLU 34 -10.048 -10.454 0.944 252 HA GLU 34 HA GLU 34 -9.669 -13.187 0.129 253 HB2 GLU 34 2HB GLU 34 -10.323 -11.475 -1.497 254 HB3 GLU 34 1HB GLU 34 -8.819 -10.603 -1.193 255 HG2 GLU 34 2HG GLU 34 -7.583 -12.018 -2.440 256 HG3 GLU 34 1HG GLU 34 -8.560 -13.429 -2.007 257 H ALA 35 H ALA 35 -7.627 -10.524 1.199 258 HA ALA 35 HA ALA 35 -5.128 -11.637 0.631 259 HB1 ALA 35 1HB ALA 35 -4.449 -10.179 2.698 260 HB2 ALA 35 2HB ALA 35 -6.106 -9.590 2.566 261 HB3 ALA 35 3HB ALA 35 -4.998 -9.417 1.205 262 H ALA 36 H ALA 36 -7.447 -12.486 3.027 263 HA ALA 36 HA ALA 36 -5.637 -13.683 4.887 264 HB1 ALA 36 1HB ALA 36 -7.805 -14.800 5.697 265 HB2 ALA 36 2HB ALA 36 -8.610 -13.769 4.512 266 HB3 ALA 36 3HB ALA 36 -7.674 -13.047 5.822 267 H ALA 37 H ALA 37 -7.938 -15.058 2.529 268 HA ALA 37 HA ALA 37 -7.078 -17.729 2.878 269 HB1 ALA 37 1HB ALA 37 -9.181 -17.616 1.967 270 HB2 ALA 37 2HB ALA 37 -8.215 -17.944 0.529 271 HB3 ALA 37 3HB ALA 37 -8.755 -16.300 0.871 272 H SER 38 H SER 38 -6.736 -15.805 -0.100 273 HA SER 38 HA SER 38 -4.752 -17.384 -1.242 274 HB2 SER 38 2HB SER 38 -5.176 -14.416 -1.675 275 HB3 SER 38 1HB SER 38 -4.364 -15.537 -2.782 276 HG SER 38 HG SER 38 -6.450 -16.694 -2.780 277 H GLY 39 H GLY 39 -4.510 -14.907 1.183 278 HA2 GLY 39 2HA GLY 39 -2.718 -14.391 2.554 279 HA3 GLY 39 1HA GLY 39 -1.766 -15.602 1.686 280 H LEU 40 H LEU 40 -3.372 -12.552 0.761 281 HA LEU 40 HA LEU 40 -0.870 -11.756 -0.562 282 HB2 LEU 40 2HB LEU 40 -3.489 -11.832 -1.500 283 HB3 LEU 40 1HB LEU 40 -3.191 -10.133 -1.196 284 HG LEU 40 HG LEU 40 -0.950 -11.279 -2.594 285 HD11 LEU 40 1HD1 LEU 40 -2.697 -11.349 -4.715 286 HD12 LEU 40 2HD1 LEU 40 -3.573 -12.205 -3.447 287 HD13 LEU 40 3HD1 LEU 40 -1.966 -12.747 -3.926 288 HD21 LEU 40 3HD2 LEU 40 -2.824 -9.008 -2.817 289 HD22 LEU 40 1HD2 LEU 40 -2.014 -9.513 -4.302 290 HD23 LEU 40 2HD2 LEU 40 -1.063 -9.045 -2.893 291 HA PRO 41 HA PRO 41 -0.316 -8.535 2.419 292 HB2 PRO 41 2HB PRO 41 1.181 -6.803 0.961 293 HB3 PRO 41 1HB PRO 41 1.823 -8.311 1.620 294 HG2 PRO 41 2HG PRO 41 0.861 -7.716 -1.154 295 HG3 PRO 41 1HG PRO 41 2.299 -8.616 -0.637 296 HD2 PRO 41 2HD PRO 41 0.036 -9.850 -1.447 297 HD3 PRO 41 1HD PRO 41 1.093 -10.535 -0.197 298 H LEU 42 H LEU 42 -0.696 -6.206 2.761 299 HA LEU 42 HA LEU 42 -3.059 -5.358 1.269 300 HB2 LEU 42 2HB LEU 42 -1.955 -4.849 3.971 301 HB3 LEU 42 1HB LEU 42 -2.845 -3.531 3.235 302 HG LEU 42 HG LEU 42 -4.056 -5.271 4.780 303 HD11 LEU 42 1HD1 LEU 42 -6.124 -4.774 3.686 304 HD12 LEU 42 2HD1 LEU 42 -5.295 -4.438 2.167 305 HD13 LEU 42 3HD1 LEU 42 -5.065 -3.370 3.551 306 HD21 LEU 42 3HD2 LEU 42 -4.648 -7.276 3.931 307 HD22 LEU 42 1HD2 LEU 42 -3.193 -7.060 2.963 308 HD23 LEU 42 2HD2 LEU 42 -4.769 -6.665 2.282 309 H MET 43 H MET 43 -2.862 -3.973 -0.337 310 HA MET 43 HA MET 43 -0.463 -2.405 -0.681 311 HB2 MET 43 2HB MET 43 -1.963 -3.588 -2.494 312 HB3 MET 43 1HB MET 43 -2.899 -2.095 -2.405 313 HG2 MET 43 2HG MET 43 -1.214 -2.150 -4.226 314 HG3 MET 43 1HG MET 43 -1.037 -0.797 -3.115 315 HE1 MET 43 3HE MET 43 1.161 -0.024 -2.495 316 HE2 MET 43 1HE MET 43 2.392 -1.045 -1.752 317 HE3 MET 43 2HE MET 43 0.793 -0.916 -1.020 318 H VAL 44 H VAL 44 -0.668 -1.080 1.206 319 HA VAL 44 HA VAL 44 -2.885 0.752 1.390 320 HB VAL 44 HB VAL 44 -0.361 0.555 3.025 321 HG11 VAL 44 1HG1 VAL 44 -0.892 2.696 3.539 322 HG12 VAL 44 2HG1 VAL 44 -2.070 1.915 4.594 323 HG13 VAL 44 3HG1 VAL 44 -2.567 2.519 3.015 324 HG21 VAL 44 3HG2 VAL 44 -2.201 -0.159 4.738 325 HG22 VAL 44 1HG2 VAL 44 -1.559 -1.327 3.583 326 HG23 VAL 44 2HG2 VAL 44 -3.118 -0.556 3.286 327 H ILE 45 H ILE 45 -2.573 1.748 -0.696 328 HA ILE 45 HA ILE 45 -0.264 3.525 -0.925 329 HB ILE 45 HB ILE 45 -2.465 3.013 -2.928 330 HG12 ILE 45 2HG1 ILE 45 0.266 1.760 -2.590 331 HG13 ILE 45 1HG1 ILE 45 -1.302 0.949 -2.528 332 HG21 ILE 45 1HG2 ILE 45 -0.642 5.067 -2.858 333 HG22 ILE 45 2HG2 ILE 45 -1.474 4.470 -4.295 334 HG23 ILE 45 3HG2 ILE 45 0.137 3.879 -3.902 335 HD11 ILE 45 3HD1 ILE 45 -0.359 0.413 -4.613 336 HD12 ILE 45 1HD1 ILE 45 0.113 2.084 -4.919 337 HD13 ILE 45 2HD1 ILE 45 -1.590 1.630 -4.944 338 H ILE 46 H ILE 46 -0.538 5.331 0.251 339 HA ILE 46 HA ILE 46 -3.136 6.702 0.099 340 HB ILE 46 HB ILE 46 -0.993 7.177 2.163 341 HG12 ILE 46 2HG1 ILE 46 -3.415 5.651 2.898 342 HG13 ILE 46 1HG1 ILE 46 -2.255 4.796 1.886 343 HG21 ILE 46 1HG2 ILE 46 -2.458 8.544 3.223 344 HG22 ILE 46 2HG2 ILE 46 -3.865 7.631 2.694 345 HG23 ILE 46 3HG2 ILE 46 -3.073 8.750 1.583 346 HD11 ILE 46 3HD1 ILE 46 -0.523 5.130 3.518 347 HD12 ILE 46 1HD1 ILE 46 -1.936 4.431 4.310 348 HD13 ILE 46 2HD1 ILE 46 -1.586 6.151 4.487 349 H HIS 47 H HIS 47 -3.250 8.875 -0.402 350 HA HIS 47 HA HIS 47 -0.748 10.234 -1.101 351 HB2 HIS 47 2HB HIS 47 -2.975 10.499 -3.052 352 HB3 HIS 47 1HB HIS 47 -1.227 10.578 -3.309 353 HD1 HIS 47 1HD HIS 47 -0.390 8.677 -4.616 354 HD2 HIS 47 2HD HIS 47 -3.684 7.610 -2.325 355 HE1 HIS 47 1HE HIS 47 -0.852 6.278 -5.189 356 HE2 HIS 47 2HE HIS 47 -2.942 5.700 -3.903 357 H LYS 48 H LYS 48 -0.719 12.171 -0.197 358 HA LYS 48 HA LYS 48 -3.233 13.704 -0.138 359 HB2 LYS 48 2HB LYS 48 -2.384 12.522 2.121 360 HB3 LYS 48 1HB LYS 48 -1.489 14.029 2.229 361 HG2 LYS 48 2HG LYS 48 -3.665 14.079 3.398 362 HG3 LYS 48 1HG LYS 48 -3.510 15.310 2.147 363 HD2 LYS 48 2HD LYS 48 -4.641 12.809 1.160 364 HD3 LYS 48 1HD LYS 48 -5.613 13.553 2.429 365 HE2 LYS 48 2HE LYS 48 -4.600 15.118 0.074 366 HE3 LYS 48 1HE LYS 48 -6.115 14.218 0.015 367 HZ1 LYS 48 3HZ LYS 48 -6.542 15.546 2.222 368 HZ2 LYS 48 1HZ LYS 48 -6.868 16.233 0.710 369 HZ3 LYS 48 2HZ LYS 48 -5.443 16.629 1.530 370 H SER 49 H SER 49 -2.888 16.030 0.394 371 HA SER 49 HA SER 49 -1.983 18.047 -0.138 372 HB2 SER 49 2HB SER 49 0.213 16.456 0.964 373 HB3 SER 49 1HB SER 49 0.762 17.754 -0.092 374 HG SER 49 HG SER 49 -0.171 19.235 1.216 375 H TRP 50 H TRP 50 0.232 18.845 -1.545 376 HA TRP 50 HA TRP 50 -0.540 18.344 -4.216 377 HB2 TRP 50 2HB TRP 50 1.490 19.641 -4.823 378 HB3 TRP 50 1HB TRP 50 0.506 20.453 -3.598 379 HD1 TRP 50 HD TRP 50 1.479 20.307 -1.014 380 HE1 TRP 50 1HE TRP 50 3.917 20.258 -0.190 381 HE3 TRP 50 3HE TRP 50 3.782 18.896 -5.358 382 HZ2 TRP 50 2HZ TRP 50 6.475 19.699 -1.240 383 HZ3 TRP 50 3HZ TRP 50 6.226 18.628 -5.362 384 HH2 TRP 50 HH TRP 50 7.544 19.023 -3.346 385 H CYS 51 H CYS 51 -0.437 15.934 -3.852 386 HA CYS 51 HA CYS 51 2.153 14.700 -3.899 387 HB2 CYS 51 2HB CYS 51 0.592 13.365 -2.822 388 HB3 CYS 51 1HB CYS 51 -0.686 13.757 -3.962 389 H GLY 52 H GLY 52 3.382 14.740 -5.694 390 HA2 GLY 52 2HA GLY 52 2.105 14.926 -8.319 391 HA3 GLY 52 1HA GLY 52 3.830 15.104 -7.988 392 H ALA 53 H ALA 53 4.084 12.710 -6.428 393 HA ALA 53 HA ALA 53 4.817 10.858 -8.325 394 HB1 ALA 53 1HB ALA 53 5.676 10.173 -6.361 395 HB2 ALA 53 2HB ALA 53 4.190 9.233 -6.244 396 HB3 ALA 53 3HB ALA 53 4.313 10.795 -5.434 397 H CYS 54 H CYS 54 1.674 11.540 -7.069 398 HA CYS 54 HA CYS 54 0.586 9.161 -8.325 399 HB2 CYS 54 2HB CYS 54 -1.585 9.950 -7.301 400 HB3 CYS 54 1HB CYS 54 -0.304 9.552 -6.149 401 H LYS 55 H LYS 55 0.799 12.609 -8.759 402 HA LYS 55 HA LYS 55 -1.312 12.874 -10.614 403 HB2 LYS 55 2HB LYS 55 -0.607 15.053 -10.939 404 HB3 LYS 55 1HB LYS 55 0.042 14.712 -9.345 405 HG2 LYS 55 2HG LYS 55 1.906 15.606 -10.216 406 HG3 LYS 55 1HG LYS 55 2.139 13.975 -10.863 407 HD2 LYS 55 2HD LYS 55 2.264 14.962 -12.867 408 HD3 LYS 55 1HD LYS 55 0.515 15.156 -12.743 409 HE2 LYS 55 2HE LYS 55 1.566 17.268 -13.324 410 HE3 LYS 55 1HE LYS 55 0.841 17.362 -11.719 411 HZ1 LYS 55 3HZ LYS 55 2.840 17.578 -10.732 412 HZ2 LYS 55 1HZ LYS 55 3.311 18.163 -12.248 413 HZ3 LYS 55 2HZ LYS 55 3.634 16.558 -11.823 414 H ALA 56 H ALA 56 2.093 12.038 -10.936 415 HA ALA 56 HA ALA 56 1.997 11.956 -13.824 416 HB1 ALA 56 1HB ALA 56 4.249 11.207 -13.724 417 HB2 ALA 56 2HB ALA 56 4.081 10.714 -12.040 418 HB3 ALA 56 3HB ALA 56 4.071 12.425 -12.463 419 H LEU 57 H LEU 57 1.006 9.937 -11.301 420 HA LEU 57 HA LEU 57 1.296 7.467 -12.787 421 HB2 LEU 57 2HB LEU 57 0.440 8.223 -10.042 422 HB3 LEU 57 1HB LEU 57 -0.134 6.701 -10.692 423 HG LEU 57 HG LEU 57 1.996 5.764 -10.745 424 HD11 LEU 57 1HD1 LEU 57 2.934 8.577 -10.929 425 HD12 LEU 57 2HD1 LEU 57 3.423 7.156 -11.852 426 HD13 LEU 57 3HD1 LEU 57 4.010 7.384 -10.205 427 HD21 LEU 57 3HD2 LEU 57 2.914 7.170 -8.456 428 HD22 LEU 57 1HD2 LEU 57 2.111 5.606 -8.540 429 HD23 LEU 57 2HD2 LEU 57 1.156 7.081 -8.377 430 H LYS 58 H LYS 58 -1.058 9.946 -12.440 431 HA LYS 58 HA LYS 58 -3.394 8.405 -12.759 432 HB2 LYS 58 2HB LYS 58 -3.236 11.137 -13.974 433 HB3 LYS 58 1HB LYS 58 -4.554 10.379 -13.103 434 HG2 LYS 58 2HG LYS 58 -3.403 10.679 -11.005 435 HG3 LYS 58 1HG LYS 58 -1.995 11.335 -11.838 436 HD2 LYS 58 2HD LYS 58 -4.740 12.567 -11.972 437 HD3 LYS 58 1HD LYS 58 -3.503 13.050 -10.810 438 HE2 LYS 58 2HE LYS 58 -2.323 14.185 -12.350 439 HE3 LYS 58 1HE LYS 58 -2.594 12.969 -13.597 440 HZ1 LYS 58 3HZ LYS 58 -5.026 13.997 -13.410 441 HZ2 LYS 58 1HZ LYS 58 -3.851 14.608 -14.463 442 HZ3 LYS 58 2HZ LYS 58 -4.126 15.361 -12.974 443 HA PRO 59 HA PRO 59 -2.928 8.951 -17.497 444 HB2 PRO 59 2HB PRO 59 -0.786 10.201 -18.520 445 HB3 PRO 59 1HB PRO 59 -2.191 11.112 -17.927 446 HG2 PRO 59 2HG PRO 59 0.424 10.565 -16.565 447 HG3 PRO 59 1HG PRO 59 -0.488 12.082 -16.665 448 HD2 PRO 59 2HD PRO 59 -0.560 10.427 -14.493 449 HD3 PRO 59 1HD PRO 59 -1.909 11.488 -14.968 450 H LYS 60 H LYS 60 -0.164 8.313 -15.515 451 HA LYS 60 HA LYS 60 1.107 6.542 -17.427 452 HB2 LYS 60 2HB LYS 60 2.682 7.647 -16.099 453 HB3 LYS 60 1HB LYS 60 1.716 7.464 -14.646 454 HG2 LYS 60 2HG LYS 60 3.579 6.029 -14.428 455 HG3 LYS 60 1HG LYS 60 2.171 5.007 -14.733 456 HD2 LYS 60 2HD LYS 60 4.097 4.270 -16.046 457 HD3 LYS 60 1HD LYS 60 2.816 4.873 -17.102 458 HE2 LYS 60 2HE LYS 60 4.449 7.085 -16.449 459 HE3 LYS 60 1HE LYS 60 5.532 5.754 -16.869 460 HZ1 LYS 60 3HZ LYS 60 3.295 6.761 -18.543 461 HZ2 LYS 60 1HZ LYS 60 4.319 5.475 -18.945 462 HZ3 LYS 60 2HZ LYS 60 4.939 7.043 -18.816 463 H PHE 61 H PHE 61 0.179 6.079 -14.033 464 HA PHE 61 HA PHE 61 0.083 3.335 -14.052 465 HB2 PHE 61 2HB PHE 61 -0.110 4.941 -12.068 466 HB3 PHE 61 1HB PHE 61 -1.839 4.971 -12.428 467 HD1 PHE 61 2HD PHE 61 0.969 2.712 -11.578 468 HD2 PHE 61 1HD PHE 61 -3.250 3.264 -11.665 469 HE1 PHE 61 2HE PHE 61 0.678 0.644 -10.279 470 HE2 PHE 61 1HE PHE 61 -3.548 1.195 -10.365 471 HZ PHE 61 HZ PHE 61 -1.582 -0.117 -9.672 472 H ALA 62 H ALA 62 -2.104 5.527 -15.575 473 HA ALA 62 HA ALA 62 -4.439 4.008 -15.646 474 HB1 ALA 62 1HB ALA 62 -4.303 5.063 -18.174 475 HB2 ALA 62 2HB ALA 62 -3.237 6.133 -17.262 476 HB3 ALA 62 3HB ALA 62 -4.911 5.911 -16.752 477 H GLU 63 H GLU 63 -1.336 3.523 -16.969 478 HA GLU 63 HA GLU 63 -1.918 1.625 -19.018 479 HB2 GLU 63 2HB GLU 63 0.205 3.157 -18.553 480 HB3 GLU 63 1HB GLU 63 0.730 1.746 -17.626 481 HG2 GLU 63 2HG GLU 63 1.662 1.321 -19.674 482 HG3 GLU 63 1HG GLU 63 0.137 0.447 -19.807 483 H SER 64 H SER 64 -1.886 1.520 -15.666 484 HA SER 64 HA SER 64 -0.860 -0.926 -14.977 485 HB2 SER 64 2HB SER 64 -3.115 0.699 -13.881 486 HB3 SER 64 1HB SER 64 -2.661 -0.826 -13.142 487 HG SER 64 HG SER 64 -0.875 1.330 -13.600 488 H THR 65 H THR 65 -3.184 -0.613 -17.296 489 HA THR 65 HA THR 65 -5.192 -2.399 -16.741 490 HB THR 65 HB THR 65 -4.786 -3.114 -19.269 491 HG1 THR 65 1HG THR 65 -3.414 -0.649 -19.221 492 HG21 THR 65 3HG2 THR 65 -5.969 -1.184 -20.064 493 HG22 THR 65 1HG2 THR 65 -5.549 -0.282 -18.608 494 HG23 THR 65 2HG2 THR 65 -6.629 -1.673 -18.503 495 H GLU 66 H GLU 66 -1.847 -3.011 -17.572 496 HA GLU 66 HA GLU 66 -2.147 -5.886 -17.482 497 HB2 GLU 66 2HB GLU 66 0.300 -5.932 -17.770 498 HB3 GLU 66 1HB GLU 66 -0.477 -4.921 -18.993 499 HG2 GLU 66 2HG GLU 66 0.194 -3.328 -16.724 500 HG3 GLU 66 1HG GLU 66 1.612 -4.241 -17.239 501 H ILE 67 H ILE 67 -1.244 -3.246 -15.382 502 HA ILE 67 HA ILE 67 -0.128 -4.903 -13.340 503 HB ILE 67 HB ILE 67 -1.364 -2.158 -13.078 504 HG12 ILE 67 2HG1 ILE 67 1.546 -2.936 -13.375 505 HG13 ILE 67 1HG1 ILE 67 0.544 -2.283 -14.678 506 HG21 ILE 67 1HG2 ILE 67 -0.074 -3.985 -11.171 507 HG22 ILE 67 2HG2 ILE 67 -1.218 -2.671 -10.892 508 HG23 ILE 67 3HG2 ILE 67 0.494 -2.315 -11.123 509 HD11 ILE 67 3HD1 ILE 67 0.643 -0.180 -13.869 510 HD12 ILE 67 1HD1 ILE 67 2.140 -0.783 -13.161 511 HD13 ILE 67 2HD1 ILE 67 0.673 -0.704 -12.186 512 H SER 68 H SER 68 -3.281 -4.367 -14.504 513 HA SER 68 HA SER 68 -4.782 -4.710 -12.129 514 HB2 SER 68 2HB SER 68 -5.419 -4.140 -14.721 515 HB3 SER 68 1HB SER 68 -5.925 -5.826 -14.616 516 HG SER 68 HG SER 68 -7.013 -3.587 -13.461 517 H GLU 69 H GLU 69 -3.176 -6.874 -14.336 518 HA GLU 69 HA GLU 69 -4.311 -9.246 -13.115 519 HB2 GLU 69 2HB GLU 69 -2.031 -9.136 -15.089 520 HB3 GLU 69 1HB GLU 69 -3.097 -10.492 -14.750 521 HG2 GLU 69 2HG GLU 69 -3.959 -7.904 -16.023 522 HG3 GLU 69 1HG GLU 69 -3.568 -9.383 -16.900 523 H LEU 70 H LEU 70 -1.261 -7.482 -13.257 524 HA LEU 70 HA LEU 70 0.278 -9.270 -11.706 525 HB2 LEU 70 2HB LEU 70 0.444 -6.336 -12.277 526 HB3 LEU 70 1HB LEU 70 1.516 -7.058 -11.079 527 HG LEU 70 HG LEU 70 1.509 -8.533 -13.594 528 HD11 LEU 70 1HD1 LEU 70 1.057 -6.156 -14.335 529 HD12 LEU 70 2HD1 LEU 70 2.502 -6.925 -14.997 530 HD13 LEU 70 3HD1 LEU 70 2.645 -5.755 -13.682 531 HD21 LEU 70 3HD2 LEU 70 3.310 -9.094 -12.339 532 HD22 LEU 70 1HD2 LEU 70 3.400 -7.513 -11.562 533 HD23 LEU 70 2HD2 LEU 70 4.039 -7.734 -13.191 534 H SER 71 H SER 71 -2.280 -7.158 -10.877 535 HA SER 71 HA SER 71 -1.831 -6.275 -8.352 536 HB2 SER 71 2HB SER 71 -4.154 -6.904 -9.922 537 HB3 SER 71 1HB SER 71 -4.422 -7.344 -8.237 538 HG SER 71 HG SER 71 -3.780 -4.821 -9.322 539 H HIS 72 H HIS 72 -1.935 -9.587 -9.270 540 HA HIS 72 HA HIS 72 -2.795 -10.818 -6.925 541 HB2 HIS 72 2HB HIS 72 -0.804 -11.639 -9.039 542 HB3 HIS 72 1HB HIS 72 -1.163 -12.676 -7.651 543 HD1 HIS 72 1HD HIS 72 -3.895 -13.156 -7.405 544 HD2 HIS 72 2HD HIS 72 -2.414 -12.122 -11.147 545 HE1 HIS 72 1HE HIS 72 -5.637 -13.918 -9.051 546 HE2 HIS 72 2HE HIS 72 -4.764 -13.190 -11.301 547 H ASN 73 H ASN 73 -0.129 -8.840 -7.498 548 HA ASN 73 HA ASN 73 1.653 -9.928 -5.542 549 HB2 ASN 73 2HB ASN 73 2.775 -7.642 -5.863 550 HB3 ASN 73 1HB ASN 73 2.709 -8.713 -7.261 551 HD21 ASN 73 1HD2 ASN 73 2.579 -7.407 -8.959 552 HD22 ASN 73 2HD2 ASN 73 1.412 -6.130 -9.155 553 H PHE 74 H PHE 74 -0.538 -7.137 -5.652 554 HA PHE 74 HA PHE 74 -0.817 -7.202 -2.766 555 HB2 PHE 74 2HB PHE 74 0.292 -4.946 -4.408 556 HB3 PHE 74 1HB PHE 74 -0.567 -4.636 -2.904 557 HD1 PHE 74 1HD PHE 74 2.303 -6.453 -4.349 558 HD2 PHE 74 2HD PHE 74 0.530 -4.844 -0.832 559 HE1 PHE 74 1HE PHE 74 4.376 -6.903 -3.104 560 HE2 PHE 74 2HE PHE 74 2.602 -5.289 0.419 561 HZ PHE 74 HZ PHE 74 4.529 -6.322 -0.718 562 H VAL 75 H VAL 75 -2.822 -6.135 -2.059 563 HA VAL 75 HA VAL 75 -4.626 -5.655 -4.342 564 HB VAL 75 HB VAL 75 -5.082 -7.731 -2.956 565 HG11 VAL 75 1HG1 VAL 75 -4.732 -6.406 -0.777 566 HG12 VAL 75 2HG1 VAL 75 -6.032 -7.597 -0.842 567 HG13 VAL 75 3HG1 VAL 75 -6.399 -5.879 -1.006 568 HG21 VAL 75 3HG2 VAL 75 -6.860 -5.868 -4.176 569 HG22 VAL 75 1HG2 VAL 75 -7.651 -6.489 -2.729 570 HG23 VAL 75 2HG2 VAL 75 -7.069 -7.602 -3.963 571 H MET 76 H MET 76 -6.425 -4.432 -4.006 572 HA MET 76 HA MET 76 -6.334 -1.864 -3.707 573 HB2 MET 76 2HB MET 76 -8.805 -2.166 -3.011 574 HB3 MET 76 1HB MET 76 -8.229 -2.773 -4.552 575 HG2 MET 76 2HG MET 76 -8.566 -4.914 -3.987 576 HG3 MET 76 1HG MET 76 -7.947 -4.679 -2.359 577 HE1 MET 76 3HE MET 76 -10.424 -6.037 -4.159 578 HE2 MET 76 1HE MET 76 -11.939 -5.899 -3.266 579 HE3 MET 76 2HE MET 76 -10.563 -6.738 -2.546 580 H VAL 77 H VAL 77 -5.280 -0.793 -1.944 581 HA VAL 77 HA VAL 77 -7.016 -0.409 0.310 582 HB VAL 77 HB VAL 77 -4.415 -0.708 1.498 583 HG11 VAL 77 1HG1 VAL 77 -5.620 -1.472 3.232 584 HG12 VAL 77 2HG1 VAL 77 -6.570 -2.568 2.228 585 HG13 VAL 77 3HG1 VAL 77 -6.986 -0.857 2.301 586 HG21 VAL 77 3HG2 VAL 77 -4.102 -3.075 1.311 587 HG22 VAL 77 1HG2 VAL 77 -4.098 -2.350 -0.294 588 HG23 VAL 77 2HG2 VAL 77 -5.524 -3.216 0.276 589 H ASN 78 H ASN 78 -6.596 1.410 -1.516 590 HA ASN 78 HA ASN 78 -4.416 3.136 -0.681 591 HB2 ASN 78 2HB ASN 78 -4.450 3.539 -2.882 592 HB3 ASN 78 1HB ASN 78 -6.052 2.841 -3.061 593 HD21 ASN 78 1HD2 ASN 78 -4.319 5.732 -2.112 594 HD22 ASN 78 2HD2 ASN 78 -5.565 6.860 -2.558 595 H LEU 79 H LEU 79 -4.657 4.533 0.877 596 HA LEU 79 HA LEU 79 -7.367 5.557 1.453 597 HB2 LEU 79 2HB LEU 79 -5.195 5.664 3.493 598 HB3 LEU 79 1HB LEU 79 -6.929 5.584 3.717 599 HG LEU 79 HG LEU 79 -5.686 3.198 2.491 600 HD11 LEU 79 1HD1 LEU 79 -4.113 4.042 4.333 601 HD12 LEU 79 2HD1 LEU 79 -4.669 2.370 4.416 602 HD13 LEU 79 3HD1 LEU 79 -5.407 3.597 5.446 603 HD21 LEU 79 3HD2 LEU 79 -7.489 3.222 4.861 604 HD22 LEU 79 1HD2 LEU 79 -7.418 2.091 3.510 605 HD23 LEU 79 2HD2 LEU 79 -8.140 3.685 3.288 606 H GLU 80 H GLU 80 -6.867 7.589 3.115 607 HA GLU 80 HA GLU 80 -5.140 9.470 1.660 608 HB2 GLU 80 2HB GLU 80 -7.909 9.500 1.528 609 HB3 GLU 80 1HB GLU 80 -7.551 10.692 2.782 610 HG2 GLU 80 2HG GLU 80 -6.772 12.173 1.310 611 HG3 GLU 80 1HG GLU 80 -5.860 10.947 0.415 612 H ASP 81 H ASP 81 -5.532 11.714 3.194 613 HA ASP 81 HA ASP 81 -3.833 11.459 5.310 614 HB2 ASP 81 2HB ASP 81 -5.300 13.526 4.268 615 HB3 ASP 81 1HB ASP 81 -6.003 13.362 5.871 616 H GLU 82 H GLU 82 -7.390 11.369 5.544 617 HA GLU 82 HA GLU 82 -7.152 10.313 8.261 618 HB2 GLU 82 2HB GLU 82 -9.476 11.419 6.690 619 HB3 GLU 82 1HB GLU 82 -9.687 10.603 8.234 620 HG2 GLU 82 2HG GLU 82 -7.664 12.536 8.587 621 HG3 GLU 82 1HG GLU 82 -8.983 13.312 7.712 622 H GLU 83 H GLU 83 -9.822 9.545 6.105 623 HA GLU 83 HA GLU 83 -10.689 7.575 5.384 624 HB2 GLU 83 2HB GLU 83 -7.953 7.532 4.720 625 HB3 GLU 83 1HB GLU 83 -8.326 5.932 5.344 626 HG2 GLU 83 2HG GLU 83 -8.843 5.590 3.169 627 HG3 GLU 83 1HG GLU 83 -10.407 6.192 3.728 628 H GLU 84 H GLU 84 -7.980 6.254 7.255 629 HA GLU 84 HA GLU 84 -9.792 5.364 9.340 630 HB2 GLU 84 2HB GLU 84 -9.064 3.639 7.224 631 HB3 GLU 84 1HB GLU 84 -8.164 3.106 8.638 632 HG2 GLU 84 2HG GLU 84 -10.481 3.313 9.825 633 HG3 GLU 84 1HG GLU 84 -11.105 3.191 8.181 634 HA PRO 85 HA PRO 85 -5.241 4.589 10.771 635 HB2 PRO 85 2HB PRO 85 -3.579 5.726 8.626 636 HB3 PRO 85 1HB PRO 85 -3.440 4.164 9.452 637 HG2 PRO 85 2HG PRO 85 -4.257 4.358 6.892 638 HG3 PRO 85 1HG PRO 85 -4.889 3.115 7.997 639 HD2 PRO 85 2HD PRO 85 -6.142 5.695 7.122 640 HD3 PRO 85 1HD PRO 85 -6.885 4.089 7.330 641 H LYS 86 H LYS 86 -3.628 6.066 11.693 642 HA LYS 86 HA LYS 86 -3.756 8.865 11.082 643 HB2 LYS 86 2HB LYS 86 -5.828 8.117 12.595 644 HB3 LYS 86 1HB LYS 86 -4.622 8.291 13.875 645 HG2 LYS 86 2HG LYS 86 -4.253 10.592 13.279 646 HG3 LYS 86 1HG LYS 86 -5.320 10.439 11.880 647 HD2 LYS 86 2HD LYS 86 -7.187 10.625 13.127 648 HD3 LYS 86 1HD LYS 86 -6.520 9.661 14.448 649 HE2 LYS 86 2HE LYS 86 -5.283 12.303 14.065 650 HE3 LYS 86 1HE LYS 86 -6.971 12.331 14.572 651 HZ1 LYS 86 3HZ LYS 86 -5.268 12.307 16.398 652 HZ2 LYS 86 1HZ LYS 86 -4.915 10.712 15.960 653 HZ3 LYS 86 2HZ LYS 86 -6.463 11.116 16.505 654 H ASP 87 H ASP 87 -1.556 7.519 10.936 655 HA ASP 87 HA ASP 87 0.172 8.661 12.844 656 HB2 ASP 87 2HB ASP 87 -1.031 6.478 13.910 657 HB3 ASP 87 1HB ASP 87 0.376 5.723 13.148 658 H GLU 88 H GLU 88 2.197 6.551 12.686 659 HA GLU 88 HA GLU 88 3.512 7.285 10.359 660 HB2 GLU 88 2HB GLU 88 3.824 4.820 12.072 661 HB3 GLU 88 1HB GLU 88 4.933 5.249 10.777 662 HG2 GLU 88 2HG GLU 88 4.330 7.039 13.115 663 HG3 GLU 88 1HG GLU 88 5.669 5.892 13.074 664 H ASP 89 H ASP 89 0.894 5.120 10.688 665 HA ASP 89 HA ASP 89 1.413 3.249 8.695 666 HB2 ASP 89 2HB ASP 89 -1.058 4.313 9.978 667 HB3 ASP 89 1HB ASP 89 -1.232 3.347 8.506 668 H PHE 90 H PHE 90 0.885 6.610 8.323 669 HA PHE 90 HA PHE 90 0.096 6.222 5.515 670 HB2 PHE 90 2HB PHE 90 -0.394 8.731 5.616 671 HB3 PHE 90 1HB PHE 90 -1.474 7.657 6.512 672 HD1 PHE 90 1HD PHE 90 1.757 9.438 7.150 673 HD2 PHE 90 2HD PHE 90 -2.141 8.450 8.541 674 HE1 PHE 90 1HE PHE 90 2.158 10.752 9.190 675 HE2 PHE 90 2HE PHE 90 -1.747 9.765 10.585 676 HZ PHE 90 HZ PHE 90 0.404 10.918 10.910 677 H SER 91 H SER 91 2.710 7.214 7.508 678 HA SER 91 HA SER 91 4.419 7.527 5.236 679 HB2 SER 91 2HB SER 91 4.163 9.978 6.980 680 HB3 SER 91 1HB SER 91 5.007 9.814 5.431 681 HG SER 91 HG SER 91 2.610 10.699 5.751 682 HA PRO 92 HA PRO 92 6.492 6.289 9.201 683 HB2 PRO 92 2HB PRO 92 7.119 3.761 8.581 684 HB3 PRO 92 1HB PRO 92 5.499 4.193 9.163 685 HG2 PRO 92 2HG PRO 92 6.437 3.652 6.376 686 HG3 PRO 92 1HG PRO 92 4.926 3.169 7.162 687 HD2 PRO 92 2HD PRO 92 5.191 5.329 5.460 688 HD3 PRO 92 1HD PRO 92 3.909 5.148 6.669 689 H ASP 93 H ASP 93 8.616 6.679 9.455 690 HA ASP 93 HA ASP 93 10.841 6.931 9.025 691 HB2 ASP 93 2HB ASP 93 10.301 4.534 7.908 692 HB3 ASP 93 1HB ASP 93 10.790 5.431 6.462 693 H GLY 94 H GLY 94 8.660 8.593 7.766 694 HA2 GLY 94 2HA GLY 94 10.406 10.252 6.203 695 HA3 GLY 94 1HA GLY 94 9.171 9.457 5.221 696 H GLY 95 H GLY 95 9.642 12.324 5.929 697 HA2 GLY 95 2HA GLY 95 7.364 13.012 7.593 698 HA3 GLY 95 1HA GLY 95 8.490 14.139 6.830 699 H TYR 96 H TYR 96 7.678 12.153 4.385 700 HA TYR 96 HA TYR 96 6.180 14.014 2.980 701 HB2 TYR 96 2HB TYR 96 5.609 12.145 1.447 702 HB3 TYR 96 1HB TYR 96 7.330 12.205 1.852 703 HD1 TYR 96 1HD TYR 96 8.302 10.515 3.370 704 HD2 TYR 96 2HD TYR 96 4.252 10.291 2.089 705 HE1 TYR 96 1HE TYR 96 8.205 8.167 4.097 706 HE2 TYR 96 2HE TYR 96 4.149 7.934 2.788 707 HH TYR 96 HH TYR 96 5.462 6.127 3.376 708 H ILE 97 H ILE 97 3.906 13.592 2.090 709 HA ILE 97 HA ILE 97 2.105 12.341 3.990 710 HB ILE 97 HB ILE 97 0.708 14.491 4.039 711 HG12 ILE 97 2HG1 ILE 97 3.179 16.055 3.815 712 HG13 ILE 97 1HG1 ILE 97 2.627 15.358 2.289 713 HG21 ILE 97 1HG2 ILE 97 1.795 13.655 6.020 714 HG22 ILE 97 2HG2 ILE 97 2.000 15.407 5.936 715 HG23 ILE 97 3HG2 ILE 97 3.337 14.341 5.504 716 HD11 ILE 97 3HD1 ILE 97 1.256 17.332 4.060 717 HD12 ILE 97 1HD1 ILE 97 0.347 16.354 2.908 718 HD13 ILE 97 2HD1 ILE 97 1.620 17.434 2.334 719 HA PRO 98 HA PRO 98 1.651 10.203 3.050 720 HB2 PRO 98 2HB PRO 98 -1.111 9.732 1.852 721 HB3 PRO 98 1HB PRO 98 -0.309 8.811 3.157 722 HG2 PRO 98 2HG PRO 98 -1.720 11.290 3.341 723 HG3 PRO 98 1HG PRO 98 -0.908 10.372 4.642 724 HD2 PRO 98 2HD PRO 98 0.135 12.641 4.008 725 HD3 PRO 98 1HD PRO 98 1.219 11.236 4.074 726 H ARG 99 H ARG 99 2.372 8.307 2.017 727 HA ARG 99 HA ARG 99 2.280 8.390 -0.928 728 HB2 ARG 99 2HB ARG 99 4.552 8.254 0.917 729 HB3 ARG 99 1HB ARG 99 4.620 7.079 -0.387 730 HG2 ARG 99 2HG ARG 99 5.804 9.092 -0.960 731 HG3 ARG 99 1HG ARG 99 4.409 8.879 -2.016 732 HD2 ARG 99 2HD ARG 99 3.293 10.395 -0.120 733 HD3 ARG 99 1HD ARG 99 4.960 10.935 0.046 734 HE ARG 99 HE ARG 99 4.045 10.922 -2.670 735 HH11 ARG 99 1HH1 ARG 99 4.110 12.761 0.295 736 HH12 ARG 99 2HH1 ARG 99 3.926 14.287 -0.500 737 HH21 ARG 99 1HH2 ARG 99 3.804 12.930 -3.718 738 HH22 ARG 99 2HH2 ARG 99 3.754 14.384 -2.777 739 H ILE 100 H ILE 100 3.588 6.086 -1.488 740 HA ILE 100 HA ILE 100 1.562 4.110 -0.963 741 HB ILE 100 HB ILE 100 4.144 3.806 -2.494 742 HG12 ILE 100 2HG1 ILE 100 2.235 3.954 -4.395 743 HG13 ILE 100 1HG1 ILE 100 1.527 5.013 -3.179 744 HG21 ILE 100 1HG2 ILE 100 2.196 1.913 -1.709 745 HG22 ILE 100 2HG2 ILE 100 3.581 1.680 -2.775 746 HG23 ILE 100 3HG2 ILE 100 2.024 2.160 -3.447 747 HD11 ILE 100 3HD1 ILE 100 4.337 5.560 -3.637 748 HD12 ILE 100 1HD1 ILE 100 2.951 6.648 -3.637 749 HD13 ILE 100 2HD1 ILE 100 3.353 5.732 -5.088 750 H LEU 101 H LEU 101 1.573 2.744 0.682 751 HA LEU 101 HA LEU 101 4.155 1.970 1.878 752 HB2 LEU 101 2HB LEU 101 1.531 2.648 3.174 753 HB3 LEU 101 1HB LEU 101 2.724 1.665 3.997 754 HG LEU 101 HG LEU 101 4.269 3.454 4.126 755 HD11 LEU 101 1HD1 LEU 101 4.302 4.503 2.070 756 HD12 LEU 101 2HD1 LEU 101 3.536 5.717 3.094 757 HD13 LEU 101 3HD1 LEU 101 2.552 4.712 2.031 758 HD21 LEU 101 3HD2 LEU 101 1.448 4.317 4.672 759 HD22 LEU 101 1HD2 LEU 101 2.840 5.307 5.105 760 HD23 LEU 101 2HD2 LEU 101 2.651 3.702 5.807 761 H PHE 102 H PHE 102 4.548 -0.166 2.082 762 HA PHE 102 HA PHE 102 2.366 -2.006 1.362 763 HB2 PHE 102 2HB PHE 102 5.346 -2.515 1.441 764 HB3 PHE 102 1HB PHE 102 4.119 -3.609 0.812 765 HD1 PHE 102 1HD PHE 102 5.227 -0.068 0.310 766 HD2 PHE 102 2HD PHE 102 3.900 -3.697 -1.466 767 HE1 PHE 102 1HE PHE 102 5.478 0.935 -1.915 768 HE2 PHE 102 2HE PHE 102 4.150 -2.701 -3.698 769 HZ PHE 102 HZ PHE 102 4.941 -0.380 -3.927 770 H LEU 103 H LEU 103 1.689 -3.596 2.791 771 HA LEU 103 HA LEU 103 3.236 -3.947 5.249 772 HB2 LEU 103 2HB LEU 103 0.738 -3.903 6.300 773 HB3 LEU 103 1HB LEU 103 1.880 -2.585 6.344 774 HG LEU 103 HG LEU 103 -0.165 -2.868 4.173 775 HD11 LEU 103 1HD1 LEU 103 -1.783 -2.163 5.468 776 HD12 LEU 103 2HD1 LEU 103 -0.807 -0.801 6.017 777 HD13 LEU 103 3HD1 LEU 103 -0.710 -2.348 6.848 778 HD21 LEU 103 3HD2 LEU 103 0.446 -0.197 4.628 779 HD22 LEU 103 1HD2 LEU 103 0.976 -1.192 3.274 780 HD23 LEU 103 2HD2 LEU 103 1.992 -1.039 4.706 781 H ASP 104 H ASP 104 1.811 -5.502 6.752 782 HA ASP 104 HA ASP 104 1.792 -7.991 5.324 783 HB2 ASP 104 2HB ASP 104 1.498 -7.144 8.169 784 HB3 ASP 104 1HB ASP 104 0.901 -8.746 7.711 785 HA PRO 105 HA PRO 105 -2.401 -8.459 4.070 786 HB2 PRO 105 2HB PRO 105 -2.201 -11.156 5.331 787 HB3 PRO 105 1HB PRO 105 -2.726 -10.709 3.696 788 HG2 PRO 105 2HG PRO 105 -0.320 -11.769 4.101 789 HG3 PRO 105 1HG PRO 105 -0.551 -10.452 2.926 790 HD2 PRO 105 2HD PRO 105 0.643 -10.369 5.661 791 HD3 PRO 105 1HD PRO 105 1.085 -9.457 4.204 792 H SER 106 H SER 106 -3.366 -7.014 5.516 793 HA SER 106 HA SER 106 -5.440 -7.759 7.038 794 HB2 SER 106 2HB SER 106 -4.444 -7.434 9.436 795 HB3 SER 106 1HB SER 106 -4.303 -9.017 8.651 796 HG SER 106 HG SER 106 -2.358 -7.436 9.535 797 H GLY 107 H GLY 107 -2.733 -5.620 6.700 798 HA2 GLY 107 2HA GLY 107 -3.218 -3.290 6.199 799 HA3 GLY 107 1HA GLY 107 -4.490 -3.361 7.424 800 H LYS 108 H LYS 108 -1.173 -4.608 7.628 801 HA LYS 108 HA LYS 108 -0.775 -2.799 9.924 802 HB2 LYS 108 2HB LYS 108 -0.246 -5.622 9.512 803 HB3 LYS 108 1HB LYS 108 1.193 -4.768 10.055 804 HG2 LYS 108 2HG LYS 108 -1.073 -3.929 11.600 805 HG3 LYS 108 1HG LYS 108 -0.952 -5.697 11.605 806 HD2 LYS 108 2HD LYS 108 1.638 -5.011 11.990 807 HD3 LYS 108 1HD LYS 108 0.825 -3.665 12.791 808 HE2 LYS 108 2HE LYS 108 0.845 -5.081 14.552 809 HE3 LYS 108 1HE LYS 108 -0.613 -5.701 13.776 810 HZ1 LYS 108 3HZ LYS 108 0.815 -7.349 12.638 811 HZ2 LYS 108 1HZ LYS 108 0.803 -7.526 14.321 812 HZ3 LYS 108 2HZ LYS 108 2.130 -6.813 13.555 813 H VAL 109 H VAL 109 -0.059 -1.071 8.487 814 HA VAL 109 HA VAL 109 1.884 -0.999 6.630 815 HB VAL 109 HB VAL 109 1.487 0.956 8.891 816 HG11 VAL 109 1HG1 VAL 109 3.647 1.304 7.930 817 HG12 VAL 109 2HG1 VAL 109 2.564 2.570 7.356 818 HG13 VAL 109 3HG1 VAL 109 2.982 1.222 6.302 819 HG21 VAL 109 3HG2 VAL 109 0.473 1.090 6.056 820 HG22 VAL 109 1HG2 VAL 109 0.077 2.168 7.393 821 HG23 VAL 109 2HG2 VAL 109 -0.483 0.498 7.414 822 H HIS 110 H HIS 110 3.774 -1.919 6.558 823 HA HIS 110 HA HIS 110 5.521 -1.713 8.917 824 HB2 HIS 110 2HB HIS 110 4.563 -4.072 8.106 825 HB3 HIS 110 1HB HIS 110 5.911 -3.950 6.982 826 HD1 HIS 110 1HD HIS 110 8.304 -4.031 7.985 827 HD2 HIS 110 2HD HIS 110 5.260 -4.538 10.766 828 HE1 HIS 110 1HE HIS 110 9.431 -4.885 10.065 829 HE2 HIS 110 2HE HIS 110 7.583 -5.079 11.767 830 HA PRO 111 HA PRO 111 8.023 0.507 5.978 831 HB2 PRO 111 2HB PRO 111 10.302 0.647 7.466 832 HB3 PRO 111 1HB PRO 111 8.899 1.681 7.746 833 HG2 PRO 111 2HG PRO 111 9.734 -0.808 9.178 834 HG3 PRO 111 1HG PRO 111 9.096 0.706 9.844 835 HD2 PRO 111 2HD PRO 111 7.567 -1.505 9.517 836 HD3 PRO 111 1HD PRO 111 6.913 0.142 9.360 837 H GLU 112 H GLU 112 7.765 -2.363 5.679 838 HA GLU 112 HA GLU 112 10.460 -3.379 5.320 839 HB2 GLU 112 2HB GLU 112 7.994 -4.562 5.793 840 HB3 GLU 112 1HB GLU 112 8.321 -4.951 4.110 841 HG2 GLU 112 2HG GLU 112 10.721 -5.451 5.397 842 HG3 GLU 112 1HG GLU 112 9.493 -6.027 6.523 843 H ILE 113 H ILE 113 7.677 -3.351 3.101 844 HA ILE 113 HA ILE 113 9.525 -2.883 0.886 845 HB ILE 113 HB ILE 113 6.587 -3.572 0.784 846 HG12 ILE 113 2HG1 ILE 113 8.032 -5.337 1.805 847 HG13 ILE 113 1HG1 ILE 113 7.254 -5.836 0.295 848 HG21 ILE 113 1HG2 ILE 113 7.584 -2.355 -1.186 849 HG22 ILE 113 2HG2 ILE 113 6.858 -3.923 -1.538 850 HG23 ILE 113 3HG2 ILE 113 8.610 -3.768 -1.428 851 HD11 ILE 113 3HD1 ILE 113 9.387 -5.289 -0.880 852 HD12 ILE 113 1HD1 ILE 113 9.498 -6.620 0.273 853 HD13 ILE 113 2HD1 ILE 113 10.123 -5.028 0.701 854 H ILE 114 H ILE 114 9.890 -0.879 0.327 855 HA ILE 114 HA ILE 114 7.781 1.139 0.683 856 HB ILE 114 HB ILE 114 9.622 2.799 0.721 857 HG12 ILE 114 2HG1 ILE 114 11.230 0.321 0.349 858 HG13 ILE 114 1HG1 ILE 114 11.517 1.942 -0.261 859 HG21 ILE 114 1HG2 ILE 114 10.266 0.912 2.908 860 HG22 ILE 114 2HG2 ILE 114 8.583 1.401 2.730 861 HG23 ILE 114 3HG2 ILE 114 9.834 2.621 2.969 862 HD11 ILE 114 3HD1 ILE 114 12.024 2.478 2.238 863 HD12 ILE 114 1HD1 ILE 114 13.234 1.682 1.234 864 HD13 ILE 114 2HD1 ILE 114 12.261 0.735 2.356 865 H ASN 115 H ASN 115 10.547 0.369 -1.441 866 HA ASN 115 HA ASN 115 9.230 0.516 -3.846 867 HB2 ASN 115 2HB ASN 115 8.648 2.812 -3.443 868 HB3 ASN 115 1HB ASN 115 10.304 3.208 -2.964 869 HD21 ASN 115 1HD2 ASN 115 9.617 4.895 -4.660 870 HD22 ASN 115 2HD2 ASN 115 10.102 4.542 -6.296 871 H GLU 116 H GLU 116 12.179 1.692 -2.286 872 HA GLU 116 HA GLU 116 14.388 1.410 -2.753 873 HB2 GLU 116 2HB GLU 116 13.102 -1.189 -3.355 874 HB3 GLU 116 1HB GLU 116 14.742 -0.970 -3.977 875 HG2 GLU 116 2HG GLU 116 13.980 -0.504 -1.105 876 HG3 GLU 116 1HG GLU 116 14.554 -2.054 -1.721 877 H ASN 117 H ASN 117 12.640 2.644 -4.827 878 HA ASN 117 HA ASN 117 14.492 2.302 -7.085 879 HB2 ASN 117 2HB ASN 117 12.134 1.236 -7.360 880 HB3 ASN 117 1HB ASN 117 11.586 2.907 -7.557 881 HD21 ASN 117 1HD2 ASN 117 14.283 0.879 -8.684 882 HD22 ASN 117 2HD2 ASN 117 14.161 1.361 -10.354 883 H GLY 118 H GLY 118 12.242 4.396 -5.356 884 HA2 GLY 118 2HA GLY 118 12.626 6.724 -6.895 885 HA3 GLY 118 1HA GLY 118 12.084 6.681 -5.213 886 H ASN 119 H ASN 119 13.276 8.279 -4.326 887 HA ASN 119 HA ASN 119 16.180 8.235 -4.741 888 HB2 ASN 119 2HB ASN 119 16.177 10.529 -3.864 889 HB3 ASN 119 1HB ASN 119 15.065 10.368 -5.234 890 HD21 ASN 119 1HD2 ASN 119 15.382 10.928 -1.838 891 HD22 ASN 119 2HD2 ASN 119 13.722 11.371 -1.544 892 HA PRO 120 HA PRO 120 16.934 6.953 -0.585 893 HB2 PRO 120 2HB PRO 120 19.259 8.670 -0.307 894 HB3 PRO 120 1HB PRO 120 19.196 6.922 -0.592 895 HG2 PRO 120 2HG PRO 120 20.087 8.723 -2.442 896 HG3 PRO 120 1HG PRO 120 19.353 7.159 -2.863 897 HD2 PRO 120 2HD PRO 120 18.124 9.895 -2.850 898 HD3 PRO 120 1HD PRO 120 17.940 8.576 -4.035 899 H SER 121 H SER 121 14.968 8.811 -0.475 900 HA SER 121 HA SER 121 15.145 9.849 2.109 901 HB2 SER 121 2HB SER 121 16.003 11.688 -0.071 902 HB3 SER 121 1HB SER 121 14.920 12.355 1.161 903 HG SER 121 HG SER 121 17.556 11.513 1.370 904 H TYR 122 H TYR 122 13.365 8.375 0.497 905 HA TYR 122 HA TYR 122 10.926 9.702 1.074 906 HB2 TYR 122 2HB TYR 122 12.109 10.188 -1.483 907 HB3 TYR 122 1HB TYR 122 10.631 9.249 -1.709 908 HD1 TYR 122 1HD TYR 122 8.525 10.164 -0.425 909 HD2 TYR 122 2HD TYR 122 11.982 12.477 -1.311 910 HE1 TYR 122 1HE TYR 122 7.204 12.225 -0.179 911 HE2 TYR 122 2HE TYR 122 10.676 14.542 -1.064 912 HH TYR 122 HH TYR 122 7.991 15.064 -1.333 913 H LYS 123 H LYS 123 12.446 7.239 -0.969 914 HA LYS 123 HA LYS 123 11.901 5.061 -1.418 915 HB2 LYS 123 2HB LYS 123 11.200 5.377 1.485 916 HB3 LYS 123 1HB LYS 123 11.047 3.830 0.671 917 HG2 LYS 123 2HG LYS 123 13.570 5.442 0.964 918 HG3 LYS 123 1HG LYS 123 13.150 3.962 1.844 919 HD2 LYS 123 2HD LYS 123 14.245 2.879 0.227 920 HD3 LYS 123 1HD LYS 123 12.839 3.222 -0.787 921 HE2 LYS 123 2HE LYS 123 13.967 4.692 -2.041 922 HE3 LYS 123 1HE LYS 123 14.738 5.436 -0.641 923 HZ1 LYS 123 3HZ LYS 123 16.485 3.953 -0.708 924 HZ2 LYS 123 1HZ LYS 123 16.177 4.187 -2.355 925 HZ3 LYS 123 2HZ LYS 123 15.624 2.788 -1.582 926 H TYR 124 H TYR 124 9.251 5.416 0.856 927 HA TYR 124 HA TYR 124 7.326 4.076 -0.490 928 HB2 TYR 124 2HB TYR 124 6.846 6.555 1.175 929 HB3 TYR 124 1HB TYR 124 5.666 5.284 0.830 930 HD1 TYR 124 1HD TYR 124 8.733 6.117 2.693 931 HD2 TYR 124 2HD TYR 124 5.715 3.195 2.024 932 HE1 TYR 124 1HE TYR 124 9.474 4.900 4.697 933 HE2 TYR 124 2HE TYR 124 6.445 1.973 4.027 934 HH TYR 124 HH TYR 124 9.375 2.647 5.624 935 H PHE 125 H PHE 125 8.462 7.275 -1.236 936 HA PHE 125 HA PHE 125 6.224 8.003 -2.881 937 HB2 PHE 125 2HB PHE 125 7.404 9.834 -1.996 938 HB3 PHE 125 1HB PHE 125 8.972 9.139 -2.416 939 HD1 PHE 125 2HD PHE 125 9.630 9.055 -4.848 940 HD2 PHE 125 1HD PHE 125 6.319 11.321 -3.430 941 HE1 PHE 125 2HE PHE 125 9.682 10.407 -6.901 942 HE2 PHE 125 1HE PHE 125 6.364 12.678 -5.483 943 HZ PHE 125 HZ PHE 125 8.047 12.220 -7.221 944 H TYR 126 H TYR 126 5.803 7.192 -4.828 945 HA TYR 126 HA TYR 126 7.940 5.828 -6.293 946 HB2 TYR 126 2HB TYR 126 4.994 5.546 -6.127 947 HB3 TYR 126 1HB TYR 126 5.727 5.216 -7.704 948 HD1 TYR 126 1HD TYR 126 7.659 3.526 -7.761 949 HD2 TYR 126 2HD TYR 126 4.993 3.904 -4.471 950 HE1 TYR 126 1HE TYR 126 8.277 1.269 -7.011 951 HE2 TYR 126 2HE TYR 126 5.599 1.647 -3.712 952 HH TYR 126 HH TYR 126 8.126 -0.226 -5.322 953 H VAL 127 H VAL 127 7.853 5.951 -8.688 954 HA VAL 127 HA VAL 127 6.789 8.379 -9.847 955 HB VAL 127 HB VAL 127 9.173 8.749 -10.898 956 HG11 VAL 127 1HG1 VAL 127 8.120 9.703 -8.273 957 HG12 VAL 127 2HG1 VAL 127 8.231 10.556 -9.812 958 HG13 VAL 127 3HG1 VAL 127 9.686 10.262 -8.859 959 HG21 VAL 127 3HG2 VAL 127 11.015 8.277 -9.462 960 HG22 VAL 127 1HG2 VAL 127 10.120 6.773 -9.680 961 HG23 VAL 127 2HG2 VAL 127 9.947 7.694 -8.185 962 H SER 128 H SER 128 5.611 7.119 -11.210 963 HA SER 128 HA SER 128 5.333 6.322 -13.386 964 HB2 SER 128 2HB SER 128 7.908 6.758 -13.672 965 HB3 SER 128 1HB SER 128 8.032 5.012 -13.407 966 HG SER 128 HG SER 128 7.751 5.157 -15.545 967 H ALA 129 H ALA 129 4.516 4.357 -14.052 968 HA ALA 129 HA ALA 129 4.045 2.452 -11.992 969 HB1 ALA 129 1HB ALA 129 3.395 1.826 -14.823 970 HB2 ALA 129 2HB ALA 129 2.579 3.188 -14.052 971 HB3 ALA 129 3HB ALA 129 2.444 1.572 -13.360 972 H GLU 130 H GLU 130 6.217 2.597 -14.732 973 HA GLU 130 HA GLU 130 6.888 -0.016 -15.158 974 HB2 GLU 130 2HB GLU 130 7.839 2.180 -16.184 975 HB3 GLU 130 1HB GLU 130 9.066 2.036 -14.920 976 HG2 GLU 130 2HG GLU 130 9.151 -0.452 -15.923 977 HG3 GLU 130 1HG GLU 130 8.656 0.444 -17.368 978 H GLN 131 H GLN 131 8.131 2.075 -12.565 979 HA GLN 131 HA GLN 131 9.716 -0.082 -11.512 980 HB2 GLN 131 2HB GLN 131 10.236 1.485 -9.668 981 HB3 GLN 131 1HB GLN 131 10.641 2.098 -11.265 982 HG2 GLN 131 2HG GLN 131 8.446 3.342 -11.207 983 HG3 GLN 131 1HG GLN 131 8.343 2.895 -9.504 984 HE21 GLN 131 1HE2 GLN 131 9.456 4.040 -8.040 985 HE22 GLN 131 2HE2 GLN 131 10.523 5.346 -8.411 986 H VAL 132 H VAL 132 6.766 1.648 -10.480 987 HA VAL 132 HA VAL 132 6.376 0.431 -8.045 988 HB VAL 132 HB VAL 132 4.162 1.066 -8.098 989 HG11 VAL 132 1HG1 VAL 132 4.600 2.959 -10.234 990 HG12 VAL 132 2HG1 VAL 132 5.994 2.827 -9.163 991 HG13 VAL 132 3HG1 VAL 132 4.409 3.228 -8.504 992 HG21 VAL 132 3HG2 VAL 132 2.986 -0.040 -9.669 993 HG22 VAL 132 1HG2 VAL 132 4.228 0.170 -10.901 994 HG23 VAL 132 2HG2 VAL 132 3.119 1.492 -10.535 995 H VAL 133 H VAL 133 6.046 -0.914 -11.232 996 HA VAL 133 HA VAL 133 4.670 -3.278 -10.310 997 HB VAL 133 HB VAL 133 4.247 -2.505 -12.591 998 HG11 VAL 133 1HG1 VAL 133 6.194 -3.061 -14.243 999 HG12 VAL 133 2HG1 VAL 133 7.202 -2.812 -12.818 1000 HG13 VAL 133 3HG1 VAL 133 6.161 -1.514 -13.397 1001 HG21 VAL 133 3HG2 VAL 133 5.707 -5.147 -12.511 1002 HG22 VAL 133 1HG2 VAL 133 4.547 -4.643 -13.741 1003 HG23 VAL 133 2HG2 VAL 133 4.016 -4.887 -12.077 1004 H GLN 134 H GLN 134 7.994 -2.287 -11.051 1005 HA GLN 134 HA GLN 134 9.051 -4.934 -10.988 1006 HB2 GLN 134 2HB GLN 134 11.191 -3.951 -11.022 1007 HB3 GLN 134 1HB GLN 134 10.180 -2.823 -11.912 1008 HG2 GLN 134 2HG GLN 134 10.273 -1.227 -10.258 1009 HG3 GLN 134 1HG GLN 134 10.623 -2.400 -8.997 1010 HE21 GLN 134 1HE2 GLN 134 12.751 -3.707 -9.709 1011 HE22 GLN 134 2HE2 GLN 134 14.109 -2.658 -10.011 1012 H GLY 135 H GLY 135 8.418 -2.481 -8.579 1013 HA2 GLY 135 2HA GLY 135 9.650 -3.963 -6.430 1014 HA3 GLY 135 1HA GLY 135 8.688 -2.488 -6.277 1015 H MET 136 H MET 136 6.592 -3.888 -8.010 1016 HA MET 136 HA MET 136 5.150 -5.051 -5.783 1017 HB2 MET 136 2HB MET 136 4.487 -3.928 -8.396 1018 HB3 MET 136 1HB MET 136 3.576 -5.386 -8.031 1019 HG2 MET 136 2HG MET 136 2.990 -4.312 -5.822 1020 HG3 MET 136 1HG MET 136 3.661 -2.819 -6.478 1021 HE1 MET 136 3HE MET 136 2.828 -2.657 -9.445 1022 HE2 MET 136 1HE MET 136 2.601 -1.368 -8.261 1023 HE3 MET 136 2HE MET 136 1.265 -1.852 -9.306 1024 H LYS 137 H LYS 137 6.693 -6.029 -8.744 1025 HA LYS 137 HA LYS 137 5.738 -8.740 -8.647 1026 HB2 LYS 137 2HB LYS 137 7.117 -9.075 -10.623 1027 HB3 LYS 137 1HB LYS 137 6.163 -7.612 -10.786 1028 HG2 LYS 137 2HG LYS 137 8.262 -6.401 -9.950 1029 HG3 LYS 137 1HG LYS 137 9.103 -7.904 -10.330 1030 HD2 LYS 137 2HD LYS 137 7.545 -6.141 -12.215 1031 HD3 LYS 137 1HD LYS 137 9.279 -6.461 -12.233 1032 HE2 LYS 137 2HE LYS 137 7.161 -8.559 -12.672 1033 HE3 LYS 137 1HE LYS 137 7.988 -7.699 -13.968 1034 HZ1 LYS 137 3HZ LYS 137 9.695 -8.961 -11.985 1035 HZ2 LYS 137 1HZ LYS 137 9.869 -8.872 -13.665 1036 HZ3 LYS 137 2HZ LYS 137 8.828 -10.015 -12.983 1037 H GLU 138 H GLU 138 8.255 -7.014 -7.167 1038 HA GLU 138 HA GLU 138 9.828 -9.453 -6.732 1039 HB2 GLU 138 2HB GLU 138 10.535 -6.688 -7.115 1040 HB3 GLU 138 1HB GLU 138 11.148 -7.254 -5.562 1041 HG2 GLU 138 2HG GLU 138 12.189 -9.175 -6.747 1042 HG3 GLU 138 1HG GLU 138 11.690 -8.436 -8.278 1043 H ALA 139 H ALA 139 8.707 -6.600 -4.947 1044 HA ALA 139 HA ALA 139 9.154 -7.535 -2.372 1045 HB1 ALA 139 1HB ALA 139 7.564 -5.870 -1.631 1046 HB2 ALA 139 2HB ALA 139 6.889 -5.746 -3.255 1047 HB3 ALA 139 3HB ALA 139 8.540 -5.209 -2.941 1048 H GLN 140 H GLN 140 6.537 -8.186 -4.603 1049 HA GLN 140 HA GLN 140 4.639 -9.258 -2.908 1050 HB2 GLN 140 2HB GLN 140 3.932 -10.591 -4.902 1051 HB3 GLN 140 1HB GLN 140 4.109 -8.864 -5.201 1052 HG2 GLN 140 2HG GLN 140 5.121 -9.743 -7.050 1053 HG3 GLN 140 1HG GLN 140 6.505 -9.548 -5.976 1054 HE21 GLN 140 1HE2 GLN 140 3.946 -11.987 -6.306 1055 HE22 GLN 140 2HE2 GLN 140 5.013 -13.339 -6.428 1056 H GLU 141 H GLU 141 7.665 -10.590 -3.971 1057 HA GLU 141 HA GLU 141 7.025 -13.291 -3.181 1058 HB2 GLU 141 2HB GLU 141 8.511 -13.053 -5.035 1059 HB3 GLU 141 1HB GLU 141 9.563 -11.961 -4.129 1060 HG2 GLU 141 2HG GLU 141 10.495 -13.677 -2.897 1061 HG3 GLU 141 1HG GLU 141 9.134 -14.761 -3.176 1062 H ARG 142 H ARG 142 8.945 -10.611 -1.906 1063 HA ARG 142 HA ARG 142 10.147 -11.979 0.221 1064 HB2 ARG 142 2HB ARG 142 9.439 -9.066 -0.122 1065 HB3 ARG 142 1HB ARG 142 10.375 -9.684 1.243 1066 HG2 ARG 142 2HG ARG 142 12.182 -9.337 0.001 1067 HG3 ARG 142 1HG ARG 142 11.667 -10.729 -0.970 1068 HD2 ARG 142 2HD ARG 142 10.432 -9.245 -2.459 1069 HD3 ARG 142 1HD ARG 142 10.898 -7.851 -1.472 1070 HE ARG 142 HE ARG 142 12.526 -9.242 -3.404 1071 HH11 ARG 142 1HH1 ARG 142 12.522 -7.132 -0.623 1072 HH12 ARG 142 2HH1 ARG 142 14.080 -6.464 -0.973 1073 HH21 ARG 142 1HH2 ARG 142 14.575 -8.362 -3.865 1074 HH22 ARG 142 2HH2 ARG 142 15.245 -7.162 -2.812 1075 H LEU 143 H LEU 143 6.884 -10.959 -0.177 1076 HA LEU 143 HA LEU 143 6.410 -11.236 2.713 1077 HB2 LEU 143 2HB LEU 143 4.553 -10.098 0.626 1078 HB3 LEU 143 1HB LEU 143 4.325 -10.069 2.375 1079 HG LEU 143 HG LEU 143 6.519 -8.627 0.877 1080 HD11 LEU 143 1HD1 LEU 143 5.320 -6.638 1.196 1081 HD12 LEU 143 2HD1 LEU 143 4.190 -7.397 2.319 1082 HD13 LEU 143 3HD1 LEU 143 4.131 -7.796 0.601 1083 HD21 LEU 143 3HD2 LEU 143 6.448 -7.476 3.288 1084 HD22 LEU 143 1HD2 LEU 143 7.493 -8.845 2.909 1085 HD23 LEU 143 2HD2 LEU 143 5.960 -9.109 3.740 1086 H THR 144 H THR 144 4.454 -11.904 -0.200 1087 HA THR 144 HA THR 144 2.841 -13.458 -0.525 1088 HB THR 144 HB THR 144 3.784 -15.430 -1.187 1089 HG1 THR 144 1HG THR 144 5.627 -16.355 -0.193 1090 HG21 THR 144 3HG2 THR 144 6.248 -14.993 -1.734 1091 HG22 THR 144 1HG2 THR 144 5.936 -13.388 -1.075 1092 HG23 THR 144 2HG2 THR 144 5.008 -13.969 -2.458 1093 H GLY 145 H GLY 145 4.509 -15.568 1.758 1094 HA2 GLY 145 2HA GLY 145 2.105 -15.438 3.471 1095 HA3 GLY 145 1HA GLY 145 2.893 -16.957 3.071 1096 H ASP 146 H ASP 146 3.633 -13.786 4.518 1097 HA ASP 146 HA ASP 146 4.939 -13.191 6.281 1098 HB2 ASP 146 2HB ASP 146 3.784 -15.807 7.048 1099 HB3 ASP 146 1HB ASP 146 5.171 -15.273 7.990 1100 H ALA 147 H ALA 147 6.155 -14.502 3.907 1101 HA ALA 147 HA ALA 147 8.329 -16.115 4.782 1102 HB1 ALA 147 1HB ALA 147 8.738 -14.640 2.289 1103 HB2 ALA 147 2HB ALA 147 7.223 -15.538 2.355 1104 HB3 ALA 147 3HB ALA 147 8.756 -16.375 2.599 1105 H PHE 148 H PHE 148 7.786 -12.695 4.557 1106 HA PHE 148 HA PHE 148 10.404 -11.745 4.433 1107 HB2 PHE 148 2HB PHE 148 9.535 -9.665 5.340 1108 HB3 PHE 148 1HB PHE 148 8.375 -10.339 4.186 1109 HD1 PHE 148 2HD PHE 148 6.284 -11.336 4.982 1110 HD2 PHE 148 1HD PHE 148 9.007 -9.452 7.654 1111 HE1 PHE 148 2HE PHE 148 4.518 -11.219 6.691 1112 HE2 PHE 148 1HE PHE 148 7.248 -9.332 9.369 1113 HZ PHE 148 HZ PHE 148 4.999 -10.216 8.888 1114 H ARG 149 H ARG 149 8.589 -13.081 7.096 1115 HA ARG 149 HA ARG 149 10.274 -12.160 9.180 1116 HB2 ARG 149 2HB ARG 149 8.320 -14.454 9.013 1117 HB3 ARG 149 1HB ARG 149 9.144 -13.984 10.489 1118 HG2 ARG 149 2HG ARG 149 8.138 -11.645 10.013 1119 HG3 ARG 149 1HG ARG 149 7.030 -12.534 8.967 1120 HD2 ARG 149 2HD ARG 149 5.901 -13.385 10.703 1121 HD3 ARG 149 1HD ARG 149 7.374 -13.748 11.599 1122 HE ARG 149 HE ARG 149 6.709 -10.950 11.537 1123 HH11 ARG 149 1HH1 ARG 149 6.206 -13.978 13.199 1124 HH12 ARG 149 2HH1 ARG 149 5.772 -13.226 14.697 1125 HH21 ARG 149 1HH2 ARG 149 6.139 -9.960 13.507 1126 HH22 ARG 149 2HH2 ARG 149 5.733 -10.946 14.872 1127 H LYS 150 H LYS 150 11.089 -14.170 10.688 1128 HA LYS 150 HA LYS 150 13.222 -15.365 9.104 1129 HB2 LYS 150 2HB LYS 150 12.810 -14.729 11.975 1130 HB3 LYS 150 1HB LYS 150 13.832 -16.112 11.606 1131 HG2 LYS 150 2HG LYS 150 15.399 -14.799 10.470 1132 HG3 LYS 150 1HG LYS 150 14.281 -13.441 10.320 1133 HD2 LYS 150 2HD LYS 150 14.378 -13.674 13.001 1134 HD3 LYS 150 1HD LYS 150 15.992 -14.254 12.586 1135 HE2 LYS 150 2HE LYS 150 15.091 -11.797 11.218 1136 HE3 LYS 150 1HE LYS 150 15.392 -11.659 12.951 1137 HZ1 LYS 150 3HZ LYS 150 17.429 -13.047 11.415 1138 HZ2 LYS 150 1HZ LYS 150 17.595 -11.935 12.679 1139 HZ3 LYS 150 2HZ LYS 150 17.285 -11.390 11.109 1140 H LYS 151 H LYS 151 10.499 -16.303 11.117 1141 HA LYS 151 HA LYS 151 11.025 -19.043 11.317 1142 HB2 LYS 151 2HB LYS 151 9.137 -17.466 12.350 1143 HB3 LYS 151 1HB LYS 151 8.202 -18.146 11.025 1144 HG2 LYS 151 2HG LYS 151 7.717 -19.707 12.576 1145 HG3 LYS 151 1HG LYS 151 9.240 -20.401 12.014 1146 HD2 LYS 151 2HD LYS 151 9.705 -20.393 14.233 1147 HD3 LYS 151 1HD LYS 151 10.189 -18.733 13.881 1148 HE2 LYS 151 2HE LYS 151 7.343 -18.989 14.438 1149 HE3 LYS 151 1HE LYS 151 8.351 -19.531 15.779 1150 HZ1 LYS 151 3HZ LYS 151 9.583 -17.282 15.213 1151 HZ2 LYS 151 1HZ LYS 151 8.249 -17.331 16.252 1152 HZ3 LYS 151 2HZ LYS 151 8.048 -16.858 14.641 1153 H HIS 152 H HIS 152 11.788 -19.830 9.346 1154 HA HIS 152 HA HIS 152 10.709 -19.510 6.845 1155 HB2 HIS 152 2HB HIS 152 11.839 -21.537 6.189 1156 HB3 HIS 152 1HB HIS 152 12.850 -20.664 7.336 1157 HD1 HIS 152 1HD HIS 152 11.542 -21.629 9.955 1158 HD2 HIS 152 2HD HIS 152 12.532 -24.110 6.776 1159 HE1 HIS 152 1HE HIS 152 11.756 -23.915 10.937 1160 HE2 HIS 152 2HE HIS 152 12.474 -25.390 9.024 1161 H LEU 153 H LEU 153 9.631 -21.661 9.396 1162 HA LEU 153 HA LEU 153 7.898 -23.150 9.530 1163 HB2 LEU 153 2HB LEU 153 6.985 -20.613 9.153 1164 HB3 LEU 153 1HB LEU 153 6.149 -21.466 7.869 1165 HG LEU 153 HG LEU 153 5.622 -23.137 9.905 1166 HD11 LEU 153 1HD1 LEU 153 6.607 -22.076 11.705 1167 HD12 LEU 153 2HD1 LEU 153 4.942 -21.503 11.799 1168 HD13 LEU 153 3HD1 LEU 153 6.194 -20.466 11.116 1169 HD21 LEU 153 3HD2 LEU 153 3.508 -21.648 10.210 1170 HD22 LEU 153 1HD2 LEU 153 3.824 -22.412 8.653 1171 HD23 LEU 153 2HD2 LEU 153 4.209 -20.708 8.892 1172 H GLU 154 H GLU 154 8.597 -24.900 8.309 1173 HA GLU 154 HA GLU 154 8.411 -25.027 5.484 1174 HB2 GLU 154 2HB GLU 154 8.865 -27.407 5.742 1175 HB3 GLU 154 1HB GLU 154 9.923 -26.466 6.785 1176 HG2 GLU 154 2HG GLU 154 9.014 -27.287 8.681 1177 HG3 GLU 154 1HG GLU 154 7.399 -27.408 7.986 1178 H ASP 155 H ASP 155 6.885 -25.946 4.152 1179 HA ASP 155 HA ASP 155 4.586 -27.321 5.116 1180 HB2 ASP 155 2HB ASP 155 4.327 -24.671 5.517 1181 HB3 ASP 155 1HB ASP 155 3.746 -24.769 3.857 1182 H GLU 156 H GLU 156 3.380 -28.248 3.464 1183 HA GLU 156 HA GLU 156 4.115 -27.580 0.710 1184 HB2 GLU 156 2HB GLU 156 5.095 -29.849 2.079 1185 HB3 GLU 156 1HB GLU 156 3.867 -30.439 0.953 1186 HG2 GLU 156 2HG GLU 156 6.188 -28.676 0.195 1187 HG3 GLU 156 1HG GLU 156 6.153 -30.430 0.020 1188 H LEU 157 H LEU 157 2.578 -28.213 -0.864 1189 HA LEU 157 HA LEU 157 0.475 -28.493 -1.683 1190 HB2 LEU 157 2HB LEU 157 0.334 -30.340 0.694 1191 HB3 LEU 157 1HB LEU 157 -0.972 -30.180 -0.465 1192 HG LEU 157 HG LEU 157 1.046 -30.713 -2.161 1193 HD11 LEU 157 1HD1 LEU 157 2.199 -32.719 -0.928 1194 HD12 LEU 157 2HD1 LEU 157 1.866 -31.750 0.507 1195 HD13 LEU 157 3HD1 LEU 157 2.848 -31.084 -0.798 1196 HD21 LEU 157 3HD2 LEU 157 0.290 -33.086 -2.053 1197 HD22 LEU 157 1HD2 LEU 157 -1.024 -31.913 -2.153 1198 HD23 LEU 157 2HD2 LEU 157 -0.636 -32.674 -0.610 Start of MODEL 22 1 H1 MET 1 1HT MET 1 -18.563 -3.098 17.238 2 H2 MET 1 2HT MET 1 -18.822 -4.415 18.307 3 H3 MET 1 3HT MET 1 -20.146 -3.455 17.789 4 HA MET 1 HA MET 1 -18.458 -4.966 15.928 5 HB2 MET 1 2HB MET 1 -20.409 -5.907 17.873 6 HB3 MET 1 1HB MET 1 -20.873 -6.320 16.229 7 HG2 MET 1 2HG MET 1 -19.595 -8.119 16.575 8 HG3 MET 1 1HG MET 1 -18.269 -7.021 16.196 9 HE1 MET 1 2HE MET 1 -17.856 -9.775 17.964 10 HE2 MET 1 3HE MET 1 -19.550 -9.579 18.414 11 HE3 MET 1 1HE MET 1 -18.304 -9.607 19.662 12 H HIS 2 H HIS 2 -18.793 -4.032 14.022 13 HA HIS 2 HA HIS 2 -21.531 -3.459 13.188 14 HB2 HIS 2 2HB HIS 2 -20.057 -1.388 14.112 15 HB3 HIS 2 1HB HIS 2 -19.566 -1.380 12.422 16 HD1 HIS 2 1HD HIS 2 -22.217 -0.273 14.650 17 HD2 HIS 2 2HD HIS 2 -21.841 -1.105 10.596 18 HE1 HIS 2 1HE HIS 2 -24.201 0.817 13.554 19 HE2 HIS 2 2HE HIS 2 -23.903 0.376 11.091 20 H HIS 3 H HIS 3 -21.828 -3.432 10.924 21 HA HIS 3 HA HIS 3 -19.517 -4.241 9.308 22 HB2 HIS 3 2HB HIS 3 -21.979 -5.797 9.846 23 HB3 HIS 3 1HB HIS 3 -21.439 -5.762 8.170 24 HD1 HIS 3 1HD HIS 3 -20.102 -6.653 11.608 25 HD2 HIS 3 2HD HIS 3 -19.440 -7.519 7.599 26 HE1 HIS 3 1HE HIS 3 -18.387 -8.493 11.592 27 HE2 HIS 3 2HE HIS 3 -18.066 -9.058 9.158 28 H HIS 4 H HIS 4 -19.436 -3.333 7.331 29 HA HIS 4 HA HIS 4 -19.936 -1.965 5.585 30 HB2 HIS 4 2HB HIS 4 -22.480 -3.379 6.148 31 HB3 HIS 4 1HB HIS 4 -22.599 -1.932 5.152 32 HD1 HIS 4 1HD HIS 4 -22.086 -5.450 4.870 33 HD2 HIS 4 2HD HIS 4 -20.630 -2.110 2.874 34 HE1 HIS 4 1HE HIS 4 -21.207 -6.308 2.676 35 HE2 HIS 4 2HE HIS 4 -20.256 -4.282 1.520 36 H HIS 5 H HIS 5 -19.548 0.112 5.997 37 HA HIS 5 HA HIS 5 -20.856 1.595 8.035 38 HB2 HIS 5 2HB HIS 5 -18.547 1.908 6.573 39 HB3 HIS 5 1HB HIS 5 -19.578 3.177 5.920 40 HD1 HIS 5 1HD HIS 5 -18.794 1.940 9.444 41 HD2 HIS 5 2HD HIS 5 -19.152 5.464 7.274 42 HE1 HIS 5 1HE HIS 5 -18.318 3.788 11.081 43 HE2 HIS 5 2HE HIS 5 -18.630 5.914 9.767 44 H HIS 6 H HIS 6 -20.934 1.957 4.485 45 HA HIS 6 HA HIS 6 -23.716 2.248 4.312 46 HB2 HIS 6 2HB HIS 6 -23.841 4.687 3.807 47 HB3 HIS 6 1HB HIS 6 -23.448 4.339 5.488 48 HD1 HIS 6 1HD HIS 6 -22.212 6.089 2.506 49 HD2 HIS 6 2HD HIS 6 -20.685 4.828 6.158 50 HE1 HIS 6 1HE HIS 6 -20.048 7.337 2.797 51 HE2 HIS 6 2HE HIS 6 -19.100 6.493 4.974 52 H HIS 7 H HIS 7 -20.598 3.224 2.975 53 HA HIS 7 HA HIS 7 -21.398 3.582 0.314 54 HB2 HIS 7 2HB HIS 7 -18.874 3.276 1.764 55 HB3 HIS 7 1HB HIS 7 -18.810 2.635 0.126 56 HD1 HIS 7 1HD HIS 7 -19.518 4.397 -1.799 57 HD2 HIS 7 2HD HIS 7 -18.627 5.984 1.935 58 HE1 HIS 7 1HE HIS 7 -19.101 6.846 -2.191 59 HE2 HIS 7 2HE HIS 7 -18.669 7.803 0.097 60 H MET 8 H MET 8 -21.014 2.198 -1.532 61 HA MET 8 HA MET 8 -21.130 -0.674 -0.894 62 HB2 MET 8 2HB MET 8 -23.044 0.997 -2.370 63 HB3 MET 8 1HB MET 8 -22.570 -0.478 -3.223 64 HG2 MET 8 2HG MET 8 -24.181 -1.461 -2.051 65 HG3 MET 8 1HG MET 8 -23.054 -1.401 -0.698 66 HE1 MET 8 3HE MET 8 -25.174 1.451 -2.495 67 HE2 MET 8 1HE MET 8 -26.569 1.489 -1.418 68 HE3 MET 8 2HE MET 8 -26.225 0.041 -2.365 69 H SER 9 H SER 9 -19.749 -1.920 -1.995 70 HA SER 9 HA SER 9 -18.769 -1.111 -4.603 71 HB2 SER 9 2HB SER 9 -17.307 -0.234 -2.504 72 HB3 SER 9 1HB SER 9 -16.583 -1.826 -2.735 73 HG SER 9 HG SER 9 -15.481 -0.428 -4.043 74 H ASP 10 H ASP 10 -17.640 -2.800 -5.717 75 HA ASP 10 HA ASP 10 -17.458 -5.414 -4.510 76 HB2 ASP 10 2HB ASP 10 -19.900 -4.829 -5.541 77 HB3 ASP 10 1HB ASP 10 -19.102 -5.487 -6.965 78 H GLY 11 H GLY 11 -17.453 -3.568 -7.545 79 HA2 GLY 11 2HA GLY 11 -14.829 -3.980 -8.233 80 HA3 GLY 11 1HA GLY 11 -15.676 -5.379 -8.875 81 H HIS 12 H HIS 12 -15.509 -1.855 -8.968 82 HA HIS 12 HA HIS 12 -16.254 -1.932 -11.781 83 HB2 HIS 12 2HB HIS 12 -17.890 -0.063 -11.466 84 HB3 HIS 12 1HB HIS 12 -18.407 -1.600 -10.757 85 HD1 HIS 12 1HD HIS 12 -18.378 1.844 -9.994 86 HD2 HIS 12 2HD HIS 12 -17.556 -1.596 -7.813 87 HE1 HIS 12 1HE HIS 12 -18.605 2.509 -7.579 88 HE2 HIS 12 2HE HIS 12 -18.191 0.389 -6.282 89 H ASN 13 H ASN 13 -15.432 0.171 -9.032 90 HA ASN 13 HA ASN 13 -13.226 1.300 -10.492 91 HB2 ASN 13 2HB ASN 13 -15.684 2.940 -9.901 92 HB3 ASN 13 1HB ASN 13 -14.100 3.681 -10.111 93 HD21 ASN 13 1HD2 ASN 13 -16.710 1.999 -11.655 94 HD22 ASN 13 2HD2 ASN 13 -16.207 2.290 -13.283 95 H GLY 14 H GLY 14 -15.169 2.785 -7.922 96 HA2 GLY 14 2HA GLY 14 -14.761 2.973 -5.651 97 HA3 GLY 14 1HA GLY 14 -13.421 1.837 -5.835 98 H LEU 15 H LEU 15 -11.864 2.905 -4.733 99 HA LEU 15 HA LEU 15 -11.391 5.715 -5.043 100 HB2 LEU 15 2HB LEU 15 -9.885 3.496 -3.672 101 HB3 LEU 15 1HB LEU 15 -9.285 5.141 -3.720 102 HG LEU 15 HG LEU 15 -11.155 5.940 -2.443 103 HD11 LEU 15 1HD1 LEU 15 -12.937 4.614 -3.348 104 HD12 LEU 15 2HD1 LEU 15 -12.881 4.366 -1.602 105 HD13 LEU 15 3HD1 LEU 15 -12.233 3.138 -2.690 106 HD21 LEU 15 3HD2 LEU 15 -9.940 3.425 -1.314 107 HD22 LEU 15 1HD2 LEU 15 -10.884 4.575 -0.367 108 HD23 LEU 15 2HD2 LEU 15 -9.368 5.080 -1.113 109 H GLY 16 H GLY 16 -8.741 6.105 -5.281 110 HA2 GLY 16 2HA GLY 16 -7.144 6.433 -6.912 111 HA3 GLY 16 1HA GLY 16 -7.252 4.699 -7.122 112 H LYS 17 H LYS 17 -9.893 6.924 -7.718 113 HA LYS 17 HA LYS 17 -10.146 5.972 -10.427 114 HB2 LYS 17 2HB LYS 17 -12.125 7.447 -10.512 115 HB3 LYS 17 1HB LYS 17 -12.154 6.374 -9.118 116 HG2 LYS 17 2HG LYS 17 -10.909 8.616 -8.134 117 HG3 LYS 17 1HG LYS 17 -12.109 9.281 -9.244 118 HD2 LYS 17 2HD LYS 17 -13.558 9.049 -7.554 119 HD3 LYS 17 1HD LYS 17 -13.520 7.325 -7.926 120 HE2 LYS 17 2HE LYS 17 -11.496 7.233 -6.352 121 HE3 LYS 17 1HE LYS 17 -12.016 8.826 -5.805 122 HZ1 LYS 17 3HZ LYS 17 -13.072 7.421 -4.341 123 HZ2 LYS 17 1HZ LYS 17 -13.372 6.231 -5.505 124 HZ3 LYS 17 2HZ LYS 17 -14.282 7.656 -5.500 125 H GLY 18 H GLY 18 -9.023 6.779 -12.057 126 HA2 GLY 18 2HA GLY 18 -8.833 8.952 -13.362 127 HA3 GLY 18 1HA GLY 18 -8.100 9.580 -11.880 128 H PHE 19 H PHE 19 -6.773 6.995 -11.353 129 HA PHE 19 HA PHE 19 -4.789 6.950 -13.512 130 HB2 PHE 19 2HB PHE 19 -2.998 6.784 -11.769 131 HB3 PHE 19 1HB PHE 19 -3.801 8.359 -11.832 132 HD1 PHE 19 2HD PHE 19 -5.645 8.809 -10.147 133 HD2 PHE 19 1HD PHE 19 -2.889 5.589 -9.789 134 HE1 PHE 19 2HE PHE 19 -6.149 8.655 -7.743 135 HE2 PHE 19 1HE PHE 19 -3.386 5.427 -7.381 136 HZ PHE 19 HZ PHE 19 -5.018 6.961 -6.357 137 H GLY 20 H GLY 20 -5.522 4.984 -14.250 138 HA2 GLY 20 2HA GLY 20 -4.831 2.676 -14.219 139 HA3 GLY 20 1HA GLY 20 -4.934 2.718 -12.460 140 H ASP 21 H ASP 21 -6.866 2.371 -11.445 141 HA ASP 21 HA ASP 21 -9.423 2.567 -12.385 142 HB2 ASP 21 2HB ASP 21 -8.063 0.175 -13.448 143 HB3 ASP 21 1HB ASP 21 -9.629 -0.145 -12.689 144 H HIS 22 H HIS 22 -8.585 -0.620 -11.182 145 HA HIS 22 HA HIS 22 -9.719 0.112 -8.573 146 HB2 HIS 22 2HB HIS 22 -9.045 -2.699 -9.394 147 HB3 HIS 22 1HB HIS 22 -10.279 -2.141 -8.275 148 HD1 HIS 22 1HD HIS 22 -12.595 -2.056 -9.170 149 HD2 HIS 22 2HD HIS 22 -9.747 -2.091 -12.195 150 HE1 HIS 22 1HE HIS 22 -13.895 -2.239 -11.316 151 HE2 HIS 22 2HE HIS 22 -12.145 -2.377 -13.121 152 H ILE 23 H ILE 23 -7.174 -1.941 -9.885 153 HA ILE 23 HA ILE 23 -5.268 -2.760 -8.871 154 HB ILE 23 HB ILE 23 -4.811 0.219 -8.952 155 HG12 ILE 23 2HG1 ILE 23 -3.819 -1.030 -11.273 156 HG13 ILE 23 1HG1 ILE 23 -5.437 -1.681 -11.029 157 HG21 ILE 23 1HG2 ILE 23 -2.695 -0.178 -8.489 158 HG22 ILE 23 2HG2 ILE 23 -2.586 -1.344 -9.807 159 HG23 ILE 23 3HG2 ILE 23 -3.092 -1.873 -8.203 160 HD11 ILE 23 3HD1 ILE 23 -6.351 0.182 -11.785 161 HD12 ILE 23 1HD1 ILE 23 -4.734 0.749 -12.196 162 HD13 ILE 23 2HD1 ILE 23 -5.441 1.159 -10.633 163 H HIS 24 H HIS 24 -4.129 -0.109 -7.188 164 HA HIS 24 HA HIS 24 -4.340 -1.518 -4.691 165 HB2 HIS 24 2HB HIS 24 -2.952 1.113 -4.998 166 HB3 HIS 24 1HB HIS 24 -2.552 -0.252 -3.951 167 HD1 HIS 24 1HD HIS 24 -2.290 -2.519 -5.930 168 HD2 HIS 24 2HD HIS 24 -0.817 1.296 -6.664 169 HE1 HIS 24 1HE HIS 24 -0.486 -2.815 -7.656 170 HE2 HIS 24 2HE HIS 24 0.343 -0.487 -8.133 171 H TRP 25 H TRP 25 -6.780 -0.219 -5.715 172 HA TRP 25 HA TRP 25 -7.394 1.288 -3.302 173 HB2 TRP 25 2HB TRP 25 -8.725 2.830 -5.117 174 HB3 TRP 25 1HB TRP 25 -7.184 3.250 -4.368 175 HD1 TRP 25 HD TRP 25 -8.738 2.360 -7.672 176 HE1 TRP 25 1HE TRP 25 -6.953 2.539 -9.494 177 HE3 TRP 25 3HE TRP 25 -4.611 2.867 -4.735 178 HZ2 TRP 25 2HZ TRP 25 -4.150 2.858 -9.691 179 HZ3 TRP 25 3HZ TRP 25 -2.423 3.105 -5.794 180 HH2 TRP 25 HH TRP 25 -2.184 3.098 -8.232 181 H ARG 26 H ARG 26 -8.299 -0.956 -5.647 182 HA ARG 26 HA ARG 26 -10.903 -0.788 -6.195 183 HB2 ARG 26 2HB ARG 26 -9.275 -2.827 -6.190 184 HB3 ARG 26 1HB ARG 26 -10.097 -3.223 -4.680 185 HG2 ARG 26 2HG ARG 26 -11.639 -2.759 -7.202 186 HG3 ARG 26 1HG ARG 26 -10.875 -4.318 -6.843 187 HD2 ARG 26 2HD ARG 26 -12.678 -2.964 -4.863 188 HD3 ARG 26 1HD ARG 26 -13.323 -3.985 -6.157 189 HE ARG 26 HE ARG 26 -11.952 -4.854 -3.789 190 HH11 ARG 26 1HH1 ARG 26 -12.725 -5.656 -7.097 191 HH12 ARG 26 2HH1 ARG 26 -12.529 -7.360 -6.863 192 HH21 ARG 26 1HH2 ARG 26 -11.689 -7.100 -3.480 193 HH22 ARG 26 2HH2 ARG 26 -11.943 -8.181 -4.810 194 H THR 27 H THR 27 -9.778 -1.852 -2.984 195 HA THR 27 HA THR 27 -11.588 -0.389 -1.463 196 HB THR 27 HB THR 27 -12.892 -2.659 -0.772 197 HG1 THR 27 1HG THR 27 -13.524 -3.655 -2.751 198 HG21 THR 27 3HG2 THR 27 -14.458 -1.707 -2.867 199 HG22 THR 27 1HG2 THR 27 -13.564 -0.308 -2.273 200 HG23 THR 27 2HG2 THR 27 -14.552 -1.259 -1.165 201 H LEU 28 H LEU 28 -11.141 -0.583 0.707 202 HA LEU 28 HA LEU 28 -8.805 -2.118 1.381 203 HB2 LEU 28 2HB LEU 28 -9.309 0.211 2.212 204 HB3 LEU 28 1HB LEU 28 -10.539 -0.509 3.251 205 HG LEU 28 HG LEU 28 -7.796 -1.630 3.444 206 HD11 LEU 28 1HD1 LEU 28 -8.275 0.770 5.087 207 HD12 LEU 28 2HD1 LEU 28 -7.896 1.051 3.388 208 HD13 LEU 28 3HD1 LEU 28 -6.778 0.139 4.403 209 HD21 LEU 28 3HD2 LEU 28 -9.380 -0.810 5.792 210 HD22 LEU 28 1HD2 LEU 28 -8.487 -2.300 5.486 211 HD23 LEU 28 2HD2 LEU 28 -10.087 -2.069 4.778 212 H GLU 29 H GLU 29 -12.208 -2.114 2.409 213 HA GLU 29 HA GLU 29 -11.980 -4.211 4.269 214 HB2 GLU 29 2HB GLU 29 -13.910 -2.646 4.112 215 HB3 GLU 29 1HB GLU 29 -14.414 -3.464 2.641 216 HG2 GLU 29 2HG GLU 29 -13.994 -5.257 4.908 217 HG3 GLU 29 1HG GLU 29 -15.266 -4.063 5.159 218 H ASP 30 H ASP 30 -12.489 -4.195 0.796 219 HA ASP 30 HA ASP 30 -13.082 -7.001 0.644 220 HB2 ASP 30 2HB ASP 30 -13.163 -4.752 -1.123 221 HB3 ASP 30 1HB ASP 30 -12.207 -6.032 -1.884 222 H GLY 31 H GLY 31 -10.215 -5.054 0.633 223 HA2 GLY 31 2HA GLY 31 -8.526 -6.994 -0.641 224 HA3 GLY 31 1HA GLY 31 -7.997 -5.561 0.244 225 H LYS 32 H LYS 32 -9.103 -6.061 2.742 226 HA LYS 32 HA LYS 32 -7.178 -7.812 3.839 227 HB2 LYS 32 2HB LYS 32 -8.409 -7.453 5.977 228 HB3 LYS 32 1HB LYS 32 -7.970 -5.967 5.149 229 HG2 LYS 32 2HG LYS 32 -10.089 -5.379 5.532 230 HG3 LYS 32 1HG LYS 32 -10.457 -6.416 4.152 231 HD2 LYS 32 2HD LYS 32 -11.415 -8.002 5.440 232 HD3 LYS 32 1HD LYS 32 -10.233 -7.805 6.736 233 HE2 LYS 32 2HE LYS 32 -11.698 -5.429 6.718 234 HE3 LYS 32 1HE LYS 32 -12.892 -6.705 6.482 235 HZ1 LYS 32 3HZ LYS 32 -11.333 -6.054 8.817 236 HZ2 LYS 32 1HZ LYS 32 -11.354 -7.706 8.454 237 HZ3 LYS 32 2HZ LYS 32 -12.808 -6.876 8.694 238 H LYS 33 H LYS 33 -10.659 -8.173 3.265 239 HA LYS 33 HA LYS 33 -10.920 -10.690 4.512 240 HB2 LYS 33 2HB LYS 33 -13.039 -10.867 3.265 241 HB3 LYS 33 1HB LYS 33 -12.858 -9.304 4.052 242 HG2 LYS 33 2HG LYS 33 -13.245 -8.308 2.118 243 HG3 LYS 33 1HG LYS 33 -11.772 -9.044 1.464 244 HD2 LYS 33 2HD LYS 33 -13.400 -9.772 -0.019 245 HD3 LYS 33 1HD LYS 33 -13.275 -11.127 1.105 246 HE2 LYS 33 2HE LYS 33 -15.357 -10.822 1.895 247 HE3 LYS 33 1HE LYS 33 -15.210 -9.066 1.884 248 HZ1 LYS 33 3HZ LYS 33 -16.007 -8.917 -0.223 249 HZ2 LYS 33 1HZ LYS 33 -16.814 -10.328 0.248 250 HZ3 LYS 33 2HZ LYS 33 -15.412 -10.429 -0.693 251 H GLU 34 H GLU 34 -9.914 -9.749 1.290 252 HA GLU 34 HA GLU 34 -10.014 -12.483 0.321 253 HB2 GLU 34 2HB GLU 34 -10.587 -10.575 -1.159 254 HB3 GLU 34 1HB GLU 34 -8.920 -10.011 -1.032 255 HG2 GLU 34 2HG GLU 34 -8.158 -11.530 -2.493 256 HG3 GLU 34 1HG GLU 34 -9.219 -12.807 -1.876 257 H ALA 35 H ALA 35 -7.653 -10.206 1.526 258 HA ALA 35 HA ALA 35 -5.318 -11.466 0.608 259 HB1 ALA 35 1HB ALA 35 -5.851 -9.707 2.988 260 HB2 ALA 35 2HB ALA 35 -5.099 -9.276 1.452 261 HB3 ALA 35 3HB ALA 35 -4.241 -10.309 2.594 262 H ALA 36 H ALA 36 -7.427 -12.149 3.305 263 HA ALA 36 HA ALA 36 -5.718 -13.786 4.813 264 HB1 ALA 36 1HB ALA 36 -8.710 -13.692 4.561 265 HB2 ALA 36 2HB ALA 36 -7.699 -13.032 5.845 266 HB3 ALA 36 3HB ALA 36 -7.881 -14.778 5.675 267 H ALA 37 H ALA 37 -8.099 -14.644 2.309 268 HA ALA 37 HA ALA 37 -7.737 -17.407 2.370 269 HB1 ALA 37 1HB ALA 37 -8.237 -16.538 -0.318 270 HB2 ALA 37 2HB ALA 37 -9.182 -15.572 0.815 271 HB3 ALA 37 3HB ALA 37 -9.325 -17.328 0.821 272 H SER 38 H SER 38 -6.571 -15.447 -0.355 273 HA SER 38 HA SER 38 -4.652 -17.304 -1.183 274 HB2 SER 38 2HB SER 38 -5.397 -14.551 -1.867 275 HB3 SER 38 1HB SER 38 -3.677 -14.897 -2.116 276 HG SER 38 HG SER 38 -4.947 -15.405 -3.958 277 H GLY 39 H GLY 39 -4.516 -14.801 1.231 278 HA2 GLY 39 2HA GLY 39 -2.944 -14.501 2.906 279 HA3 GLY 39 1HA GLY 39 -2.002 -15.820 2.203 280 H LEU 40 H LEU 40 -3.064 -12.972 0.435 281 HA LEU 40 HA LEU 40 -0.253 -12.322 -0.053 282 HB2 LEU 40 2HB LEU 40 -1.155 -10.854 -1.851 283 HB3 LEU 40 1HB LEU 40 -1.516 -12.555 -2.057 284 HG LEU 40 HG LEU 40 -3.805 -12.112 -1.155 285 HD11 LEU 40 1HD1 LEU 40 -2.647 -9.428 -0.873 286 HD12 LEU 40 2HD1 LEU 40 -3.949 -10.203 0.023 287 HD13 LEU 40 3HD1 LEU 40 -4.272 -9.485 -1.554 288 HD21 LEU 40 3HD2 LEU 40 -3.201 -12.187 -3.594 289 HD22 LEU 40 1HD2 LEU 40 -3.168 -10.425 -3.559 290 HD23 LEU 40 2HD2 LEU 40 -4.665 -11.285 -3.200 291 HA PRO 41 HA PRO 41 -0.295 -8.758 2.511 292 HB2 PRO 41 2HB PRO 41 1.414 -7.111 1.178 293 HB3 PRO 41 1HB PRO 41 1.940 -8.520 2.106 294 HG2 PRO 41 2HG PRO 41 1.559 -8.227 -0.841 295 HG3 PRO 41 1HG PRO 41 2.841 -9.066 0.045 296 HD2 PRO 41 2HD PRO 41 0.746 -10.359 -1.104 297 HD3 PRO 41 1HD PRO 41 1.568 -10.954 0.352 298 H LEU 42 H LEU 42 -0.748 -6.458 2.598 299 HA LEU 42 HA LEU 42 -2.799 -5.734 0.663 300 HB2 LEU 42 2HB LEU 42 -2.172 -4.980 3.473 301 HB3 LEU 42 1HB LEU 42 -2.990 -3.792 2.480 302 HG LEU 42 HG LEU 42 -4.655 -4.957 3.703 303 HD11 LEU 42 1HD1 LEU 42 -5.958 -4.980 1.920 304 HD12 LEU 42 2HD1 LEU 42 -5.280 -6.528 1.425 305 HD13 LEU 42 3HD1 LEU 42 -4.535 -5.024 0.882 306 HD21 LEU 42 3HD2 LEU 42 -4.893 -7.422 3.550 307 HD22 LEU 42 1HD2 LEU 42 -3.427 -6.901 4.379 308 HD23 LEU 42 2HD2 LEU 42 -3.339 -7.483 2.716 309 H MET 43 H MET 43 -2.797 -3.783 -0.442 310 HA MET 43 HA MET 43 -0.150 -2.550 -0.682 311 HB2 MET 43 2HB MET 43 -1.163 -3.570 -2.723 312 HB3 MET 43 1HB MET 43 -2.474 -2.388 -2.618 313 HG2 MET 43 2HG MET 43 -0.699 -1.804 -4.249 314 HG3 MET 43 1HG MET 43 -0.962 -0.583 -3.010 315 HE1 MET 43 3HE MET 43 1.375 -3.867 -3.562 316 HE2 MET 43 1HE MET 43 0.664 -3.805 -1.950 317 HE3 MET 43 2HE MET 43 2.397 -3.565 -2.158 318 H VAL 44 H VAL 44 -0.208 -1.089 0.967 319 HA VAL 44 HA VAL 44 -2.416 0.739 1.286 320 HB VAL 44 HB VAL 44 0.286 0.679 2.636 321 HG11 VAL 44 1HG1 VAL 44 -1.170 2.091 4.337 322 HG12 VAL 44 2HG1 VAL 44 -2.029 2.530 2.862 323 HG13 VAL 44 3HG1 VAL 44 -0.302 2.854 3.005 324 HG21 VAL 44 3HG2 VAL 44 -2.016 0.130 4.292 325 HG22 VAL 44 1HG2 VAL 44 -0.542 -0.811 4.054 326 HG23 VAL 44 2HG2 VAL 44 -1.901 -1.005 2.947 327 H ILE 45 H ILE 45 -2.660 2.274 -0.181 328 HA ILE 45 HA ILE 45 -0.298 3.869 -0.906 329 HB ILE 45 HB ILE 45 -2.616 3.295 -2.747 330 HG12 ILE 45 2HG1 ILE 45 -0.134 1.798 -2.191 331 HG13 ILE 45 1HG1 ILE 45 -1.658 1.245 -2.891 332 HG21 ILE 45 1HG2 ILE 45 0.011 4.301 -3.684 333 HG22 ILE 45 2HG2 ILE 45 -1.050 5.426 -2.846 334 HG23 ILE 45 3HG2 ILE 45 -1.607 4.611 -4.305 335 HD11 ILE 45 3HD1 ILE 45 0.011 0.950 -4.530 336 HD12 ILE 45 1HD1 ILE 45 0.645 2.576 -4.288 337 HD13 ILE 45 2HD1 ILE 45 -0.935 2.350 -5.029 338 H ILE 46 H ILE 46 -0.642 5.584 0.436 339 HA ILE 46 HA ILE 46 -3.285 6.847 0.351 340 HB ILE 46 HB ILE 46 -1.112 7.518 2.311 341 HG12 ILE 46 2HG1 ILE 46 -3.266 5.814 3.310 342 HG13 ILE 46 1HG1 ILE 46 -2.241 5.004 2.126 343 HG21 ILE 46 1HG2 ILE 46 -2.851 8.460 3.615 344 HG22 ILE 46 2HG2 ILE 46 -4.096 7.734 2.599 345 HG23 ILE 46 3HG2 ILE 46 -3.092 9.036 1.964 346 HD11 ILE 46 3HD1 ILE 46 -1.220 6.431 4.568 347 HD12 ILE 46 1HD1 ILE 46 -0.298 5.417 3.457 348 HD13 ILE 46 2HD1 ILE 46 -1.538 4.696 4.483 349 H HIS 47 H HIS 47 -3.556 8.870 -0.393 350 HA HIS 47 HA HIS 47 -1.130 10.369 -1.148 351 HB2 HIS 47 2HB HIS 47 -3.490 10.564 -2.951 352 HB3 HIS 47 1HB HIS 47 -1.767 10.677 -3.326 353 HD1 HIS 47 1HD HIS 47 -1.269 8.887 -4.950 354 HD2 HIS 47 2HD HIS 47 -3.820 7.566 -1.947 355 HE1 HIS 47 1HE HIS 47 -1.665 6.451 -5.427 356 HE2 HIS 47 2HE HIS 47 -3.271 5.691 -3.642 357 H LYS 48 H LYS 48 -1.163 12.126 0.118 358 HA LYS 48 HA LYS 48 -3.740 13.582 0.291 359 HB2 LYS 48 2HB LYS 48 -2.178 12.588 2.405 360 HB3 LYS 48 1HB LYS 48 -1.956 14.330 2.420 361 HG2 LYS 48 2HG LYS 48 -4.007 14.696 3.195 362 HG3 LYS 48 1HG LYS 48 -4.733 13.566 2.054 363 HD2 LYS 48 2HD LYS 48 -5.147 12.785 4.288 364 HD3 LYS 48 1HD LYS 48 -3.993 11.698 3.514 365 HE2 LYS 48 2HE LYS 48 -2.931 11.982 5.503 366 HE3 LYS 48 1HE LYS 48 -2.257 13.362 4.638 367 HZ1 LYS 48 3HZ LYS 48 -4.611 13.466 6.447 368 HZ2 LYS 48 1HZ LYS 48 -3.900 14.784 5.660 369 HZ3 LYS 48 2HZ LYS 48 -3.046 13.954 6.860 370 H SER 49 H SER 49 -3.531 15.932 0.696 371 HA SER 49 HA SER 49 -2.812 18.009 0.114 372 HB2 SER 49 2HB SER 49 -0.581 18.535 0.415 373 HB3 SER 49 1HB SER 49 -0.674 17.006 1.284 374 HG SER 49 HG SER 49 1.089 17.345 -0.346 375 H TRP 50 H TRP 50 -0.941 18.901 -1.735 376 HA TRP 50 HA TRP 50 -2.247 18.764 -4.140 377 HB2 TRP 50 2HB TRP 50 -0.037 19.394 -5.192 378 HB3 TRP 50 1HB TRP 50 -0.538 20.413 -3.835 379 HD1 TRP 50 HD TRP 50 1.974 17.613 -4.688 380 HE1 TRP 50 1HE TRP 50 3.923 17.742 -3.012 381 HE3 TRP 50 3HE TRP 50 0.135 21.234 -1.582 382 HZ2 TRP 50 2HZ TRP 50 4.592 19.188 -0.682 383 HZ3 TRP 50 3HZ TRP 50 1.491 21.931 0.349 384 HH2 TRP 50 HH TRP 50 3.674 20.929 0.788 385 H CYS 51 H CYS 51 0.330 16.678 -2.952 386 HA CYS 51 HA CYS 51 1.065 14.628 -3.568 387 HB2 CYS 51 2HB CYS 51 -1.157 13.885 -3.127 388 HB3 CYS 51 1HB CYS 51 -1.757 14.549 -4.641 389 H GLY 52 H GLY 52 1.954 13.411 -5.305 390 HA2 GLY 52 2HA GLY 52 1.719 14.629 -7.982 391 HA3 GLY 52 1HA GLY 52 3.314 14.350 -7.282 392 H ALA 53 H ALA 53 2.902 11.883 -6.070 393 HA ALA 53 HA ALA 53 3.385 10.093 -8.138 394 HB1 ALA 53 1HB ALA 53 2.152 8.942 -5.730 395 HB2 ALA 53 2HB ALA 53 3.572 9.950 -5.449 396 HB3 ALA 53 3HB ALA 53 3.680 8.551 -6.518 397 H CYS 54 H CYS 54 0.425 11.369 -7.020 398 HA CYS 54 HA CYS 54 -1.112 9.226 -8.179 399 HB2 CYS 54 2HB CYS 54 -3.086 10.651 -7.506 400 HB3 CYS 54 1HB CYS 54 -2.038 10.160 -6.170 401 H LYS 55 H LYS 55 -0.234 12.563 -8.869 402 HA LYS 55 HA LYS 55 -1.936 12.860 -11.116 403 HB2 LYS 55 2HB LYS 55 -1.028 14.947 -11.360 404 HB3 LYS 55 1HB LYS 55 -0.581 14.638 -9.690 405 HG2 LYS 55 2HG LYS 55 1.654 13.914 -10.460 406 HG3 LYS 55 1HG LYS 55 1.187 14.347 -12.113 407 HD2 LYS 55 2HD LYS 55 0.874 16.658 -11.444 408 HD3 LYS 55 1HD LYS 55 1.232 16.247 -9.765 409 HE2 LYS 55 2HE LYS 55 3.457 15.313 -10.838 410 HE3 LYS 55 1HE LYS 55 3.059 16.474 -12.105 411 HZ1 LYS 55 3HZ LYS 55 3.211 18.249 -10.623 412 HZ2 LYS 55 1HZ LYS 55 4.520 17.264 -10.197 413 HZ3 LYS 55 2HZ LYS 55 3.115 17.259 -9.255 414 H ALA 56 H ALA 56 1.502 11.992 -10.781 415 HA ALA 56 HA ALA 56 1.941 11.629 -13.575 416 HB1 ALA 56 1HB ALA 56 3.878 10.134 -12.566 417 HB2 ALA 56 2HB ALA 56 3.424 10.977 -11.084 418 HB3 ALA 56 3HB ALA 56 3.937 11.895 -12.500 419 H LEU 57 H LEU 57 0.252 9.789 -11.279 420 HA LEU 57 HA LEU 57 0.691 7.246 -12.583 421 HB2 LEU 57 2HB LEU 57 -0.654 8.210 -10.142 422 HB3 LEU 57 1HB LEU 57 -1.405 6.826 -10.904 423 HG LEU 57 HG LEU 57 0.440 5.446 -10.526 424 HD11 LEU 57 1HD1 LEU 57 1.957 7.972 -10.552 425 HD12 LEU 57 2HD1 LEU 57 2.382 6.380 -11.181 426 HD13 LEU 57 3HD1 LEU 57 2.555 6.722 -9.461 427 HD21 LEU 57 3HD2 LEU 57 1.152 6.286 -8.061 428 HD22 LEU 57 1HD2 LEU 57 -0.358 5.454 -8.426 429 HD23 LEU 57 2HD2 LEU 57 -0.327 7.213 -8.307 430 H LYS 58 H LYS 58 -1.613 9.854 -12.739 431 HA LYS 58 HA LYS 58 -3.863 8.566 -13.682 432 HB2 LYS 58 2HB LYS 58 -2.828 11.273 -13.748 433 HB3 LYS 58 1HB LYS 58 -3.767 10.900 -15.188 434 HG2 LYS 58 2HG LYS 58 -5.687 10.992 -14.079 435 HG3 LYS 58 1HG LYS 58 -5.073 9.973 -12.776 436 HD2 LYS 58 2HD LYS 58 -5.619 12.055 -11.791 437 HD3 LYS 58 1HD LYS 58 -3.860 12.014 -11.918 438 HE2 LYS 58 2HE LYS 58 -4.677 13.128 -14.317 439 HE3 LYS 58 1HE LYS 58 -5.772 13.832 -13.128 440 HZ1 LYS 58 3HZ LYS 58 -4.110 15.273 -12.812 441 HZ2 LYS 58 1HZ LYS 58 -2.944 14.262 -13.508 442 HZ3 LYS 58 2HZ LYS 58 -3.398 14.043 -11.893 443 HA PRO 59 HA PRO 59 -2.535 8.731 -18.248 444 HB2 PRO 59 2HB PRO 59 -0.254 9.946 -18.998 445 HB3 PRO 59 1HB PRO 59 -1.759 10.850 -18.728 446 HG2 PRO 59 2HG PRO 59 0.588 10.488 -16.894 447 HG3 PRO 59 1HG PRO 59 -0.316 11.965 -17.277 448 HD2 PRO 59 2HD PRO 59 -0.750 10.517 -15.017 449 HD3 PRO 59 1HD PRO 59 -2.031 11.446 -15.839 450 H LYS 60 H LYS 60 -0.015 8.212 -15.892 451 HA LYS 60 HA LYS 60 1.353 6.308 -17.630 452 HB2 LYS 60 2HB LYS 60 3.004 7.401 -16.513 453 HB3 LYS 60 1HB LYS 60 1.991 7.726 -15.122 454 HG2 LYS 60 2HG LYS 60 3.532 6.283 -14.247 455 HG3 LYS 60 1HG LYS 60 2.232 5.170 -14.670 456 HD2 LYS 60 2HD LYS 60 4.386 4.285 -15.381 457 HD3 LYS 60 1HD LYS 60 3.396 4.680 -16.790 458 HE2 LYS 60 2HE LYS 60 4.893 6.993 -16.081 459 HE3 LYS 60 1HE LYS 60 5.998 5.615 -16.128 460 HZ1 LYS 60 3HZ LYS 60 5.360 5.142 -18.354 461 HZ2 LYS 60 1HZ LYS 60 5.717 6.794 -18.282 462 HZ3 LYS 60 2HZ LYS 60 4.107 6.278 -18.316 463 H PHE 61 H PHE 61 0.121 6.243 -14.274 464 HA PHE 61 HA PHE 61 0.207 3.484 -13.994 465 HB2 PHE 61 2HB PHE 61 -0.222 5.355 -12.236 466 HB3 PHE 61 1HB PHE 61 -1.919 5.095 -12.643 467 HD1 PHE 61 2HD PHE 61 1.094 3.582 -11.203 468 HD2 PHE 61 1HD PHE 61 -3.063 3.100 -11.966 469 HE1 PHE 61 2HE PHE 61 1.044 1.651 -9.680 470 HE2 PHE 61 1HE PHE 61 -3.121 1.165 -10.446 471 HZ PHE 61 HZ PHE 61 -1.064 0.439 -9.303 472 H ALA 62 H ALA 62 -1.908 5.441 -15.852 473 HA ALA 62 HA ALA 62 -4.189 3.828 -15.947 474 HB1 ALA 62 1HB ALA 62 -4.751 5.524 -17.288 475 HB2 ALA 62 2HB ALA 62 -3.758 4.792 -18.549 476 HB3 ALA 62 3HB ALA 62 -3.063 6.001 -17.466 477 H GLU 63 H GLU 63 -0.980 3.378 -16.978 478 HA GLU 63 HA GLU 63 -1.339 1.351 -18.957 479 HB2 GLU 63 2HB GLU 63 0.701 2.960 -18.447 480 HB3 GLU 63 1HB GLU 63 1.173 1.655 -17.350 481 HG2 GLU 63 2HG GLU 63 1.090 0.082 -19.256 482 HG3 GLU 63 1HG GLU 63 0.735 1.438 -20.325 483 H SER 64 H SER 64 -1.586 1.447 -15.608 484 HA SER 64 HA SER 64 -0.589 -0.985 -14.758 485 HB2 SER 64 2HB SER 64 -2.875 0.709 -13.825 486 HB3 SER 64 1HB SER 64 -2.438 -0.774 -12.996 487 HG SER 64 HG SER 64 -0.585 1.299 -13.521 488 H THR 65 H THR 65 -2.747 -0.711 -17.210 489 HA THR 65 HA THR 65 -4.855 -2.399 -16.725 490 HB THR 65 HB THR 65 -3.458 -2.950 -19.268 491 HG1 THR 65 1HG THR 65 -4.192 -0.315 -18.530 492 HG21 THR 65 3HG2 THR 65 -6.135 -1.666 -18.864 493 HG22 THR 65 1HG2 THR 65 -5.889 -3.410 -18.768 494 HG23 THR 65 2HG2 THR 65 -5.540 -2.551 -20.269 495 H GLU 66 H GLU 66 -1.481 -3.158 -17.287 496 HA GLU 66 HA GLU 66 -1.900 -6.010 -17.164 497 HB2 GLU 66 2HB GLU 66 0.557 -6.166 -17.225 498 HB3 GLU 66 1HB GLU 66 -0.055 -5.140 -18.524 499 HG2 GLU 66 2HG GLU 66 0.508 -3.597 -16.166 500 HG3 GLU 66 1HG GLU 66 1.920 -4.525 -16.662 501 H ILE 67 H ILE 67 -1.077 -3.365 -15.044 502 HA ILE 67 HA ILE 67 -0.222 -5.017 -12.867 503 HB ILE 67 HB ILE 67 -1.312 -2.200 -12.786 504 HG12 ILE 67 2HG1 ILE 67 1.555 -3.162 -12.896 505 HG13 ILE 67 1HG1 ILE 67 0.672 -2.435 -14.247 506 HG21 ILE 67 1HG2 ILE 67 -1.398 -2.864 -10.587 507 HG22 ILE 67 2HG2 ILE 67 0.240 -2.217 -10.687 508 HG23 ILE 67 3HG2 ILE 67 -0.026 -3.959 -10.754 509 HD11 ILE 67 3HD1 ILE 67 1.262 -0.421 -13.561 510 HD12 ILE 67 1HD1 ILE 67 2.183 -1.151 -12.247 511 HD13 ILE 67 2HD1 ILE 67 0.498 -0.700 -11.996 512 H SER 68 H SER 68 -3.220 -4.372 -14.305 513 HA SER 68 HA SER 68 -4.911 -4.536 -12.030 514 HB2 SER 68 2HB SER 68 -5.233 -4.171 -14.819 515 HB3 SER 68 1HB SER 68 -6.188 -5.588 -14.386 516 HG SER 68 HG SER 68 -7.581 -4.280 -13.541 517 H GLU 69 H GLU 69 -3.244 -6.859 -13.992 518 HA GLU 69 HA GLU 69 -4.717 -9.068 -12.793 519 HB2 GLU 69 2HB GLU 69 -3.020 -10.402 -14.310 520 HB3 GLU 69 1HB GLU 69 -4.463 -9.666 -14.989 521 HG2 GLU 69 2HG GLU 69 -3.078 -7.697 -15.614 522 HG3 GLU 69 1HG GLU 69 -1.656 -8.599 -15.089 523 H LEU 70 H LEU 70 -1.471 -7.705 -12.977 524 HA LEU 70 HA LEU 70 -0.055 -9.597 -11.504 525 HB2 LEU 70 2HB LEU 70 0.208 -6.700 -12.043 526 HB3 LEU 70 1HB LEU 70 1.087 -7.299 -10.639 527 HG LEU 70 HG LEU 70 1.478 -8.919 -13.054 528 HD11 LEU 70 1HD1 LEU 70 1.227 -6.444 -13.797 529 HD12 LEU 70 2HD1 LEU 70 2.598 -7.393 -14.375 530 HD13 LEU 70 3HD1 LEU 70 2.812 -6.249 -13.048 531 HD21 LEU 70 3HD2 LEU 70 3.078 -7.774 -10.811 532 HD22 LEU 70 1HD2 LEU 70 3.912 -8.281 -12.279 533 HD23 LEU 70 2HD2 LEU 70 2.949 -9.442 -11.366 534 H SER 71 H SER 71 -2.361 -7.214 -10.514 535 HA SER 71 HA SER 71 -1.888 -6.729 -7.895 536 HB2 SER 71 2HB SER 71 -4.220 -6.770 -9.589 537 HB3 SER 71 1HB SER 71 -4.624 -7.284 -7.949 538 HG SER 71 HG SER 71 -3.940 -5.362 -7.165 539 H HIS 72 H HIS 72 -2.596 -9.850 -9.195 540 HA HIS 72 HA HIS 72 -3.763 -11.114 -7.001 541 HB2 HIS 72 2HB HIS 72 -2.666 -13.202 -7.900 542 HB3 HIS 72 1HB HIS 72 -3.621 -12.298 -9.082 543 HD1 HIS 72 1HD HIS 72 -2.485 -12.358 -11.264 544 HD2 HIS 72 2HD HIS 72 0.231 -12.063 -8.134 545 HE1 HIS 72 1HE HIS 72 -0.219 -12.235 -12.350 546 HE2 HIS 72 2HE HIS 72 1.401 -11.972 -10.438 547 H ASN 73 H ASN 73 -0.736 -9.689 -7.341 548 HA ASN 73 HA ASN 73 0.835 -11.276 -5.601 549 HB2 ASN 73 2HB ASN 73 2.161 -9.058 -5.436 550 HB3 ASN 73 1HB ASN 73 2.063 -9.859 -7.007 551 HD21 ASN 73 1HD2 ASN 73 2.136 -8.224 -8.425 552 HD22 ASN 73 2HD2 ASN 73 1.057 -6.855 -8.416 553 H PHE 74 H PHE 74 -1.166 -8.430 -5.141 554 HA PHE 74 HA PHE 74 -1.475 -8.988 -2.315 555 HB2 PHE 74 2HB PHE 74 -1.095 -6.361 -2.037 556 HB3 PHE 74 1HB PHE 74 0.246 -7.506 -1.959 557 HD1 PHE 74 1HD PHE 74 -1.529 -5.191 -4.227 558 HD2 PHE 74 2HD PHE 74 2.012 -7.402 -3.440 559 HE1 PHE 74 1HE PHE 74 -0.409 -4.052 -6.101 560 HE2 PHE 74 2HE PHE 74 3.147 -6.266 -5.307 561 HZ PHE 74 HZ PHE 74 1.934 -4.593 -6.641 562 H VAL 75 H VAL 75 -2.753 -6.192 -2.042 563 HA VAL 75 HA VAL 75 -4.758 -6.301 -4.108 564 HB VAL 75 HB VAL 75 -5.431 -8.085 -2.474 565 HG11 VAL 75 1HG1 VAL 75 -6.480 -7.471 -0.424 566 HG12 VAL 75 2HG1 VAL 75 -6.279 -5.753 -0.771 567 HG13 VAL 75 3HG1 VAL 75 -4.866 -6.760 -0.445 568 HG21 VAL 75 3HG2 VAL 75 -7.597 -7.820 -3.103 569 HG22 VAL 75 1HG2 VAL 75 -6.912 -6.535 -4.100 570 HG23 VAL 75 2HG2 VAL 75 -7.669 -6.147 -2.554 571 H MET 76 H MET 76 -5.978 -4.683 -4.388 572 HA MET 76 HA MET 76 -5.476 -2.152 -4.143 573 HB2 MET 76 2HB MET 76 -8.260 -2.284 -3.937 574 HB3 MET 76 1HB MET 76 -7.317 -2.294 -5.413 575 HG2 MET 76 2HG MET 76 -7.766 -4.845 -3.934 576 HG3 MET 76 1HG MET 76 -9.039 -4.211 -4.934 577 HE1 MET 76 3HE MET 76 -9.032 -4.237 -7.576 578 HE2 MET 76 1HE MET 76 -7.556 -4.401 -8.527 579 HE3 MET 76 2HE MET 76 -7.769 -3.014 -7.459 580 H VAL 77 H VAL 77 -4.806 -1.104 -2.275 581 HA VAL 77 HA VAL 77 -6.899 -0.554 -0.332 582 HB VAL 77 HB VAL 77 -4.237 -1.733 0.450 583 HG11 VAL 77 1HG1 VAL 77 -5.398 -1.312 2.825 584 HG12 VAL 77 2HG1 VAL 77 -6.018 0.092 1.957 585 HG13 VAL 77 3HG1 VAL 77 -4.279 -0.161 2.092 586 HG21 VAL 77 3HG2 VAL 77 -6.020 -3.022 1.917 587 HG22 VAL 77 1HG2 VAL 77 -5.639 -3.510 0.267 588 HG23 VAL 77 2HG2 VAL 77 -7.078 -2.544 0.591 589 H ASN 78 H ASN 78 -6.635 1.443 -1.716 590 HA ASN 78 HA ASN 78 -4.346 3.074 -0.909 591 HB2 ASN 78 2HB ASN 78 -4.413 3.671 -3.066 592 HB3 ASN 78 1HB ASN 78 -5.978 2.914 -3.293 593 HD21 ASN 78 1HD2 ASN 78 -4.581 5.766 -1.741 594 HD22 ASN 78 2HD2 ASN 78 -5.807 6.876 -2.272 595 H LEU 79 H LEU 79 -4.637 4.138 0.902 596 HA LEU 79 HA LEU 79 -7.287 4.989 1.733 597 HB2 LEU 79 2HB LEU 79 -6.167 4.115 3.539 598 HB3 LEU 79 1HB LEU 79 -4.619 4.742 3.026 599 HG LEU 79 HG LEU 79 -5.522 7.052 3.671 600 HD11 LEU 79 1HD1 LEU 79 -7.901 5.873 3.866 601 HD12 LEU 79 2HD1 LEU 79 -7.457 7.277 4.838 602 HD13 LEU 79 3HD1 LEU 79 -7.359 5.658 5.530 603 HD21 LEU 79 3HD2 LEU 79 -4.436 6.847 5.630 604 HD22 LEU 79 1HD2 LEU 79 -4.060 5.233 5.027 605 HD23 LEU 79 2HD2 LEU 79 -5.403 5.466 6.144 606 H GLU 80 H GLU 80 -7.757 7.182 2.388 607 HA GLU 80 HA GLU 80 -6.043 9.229 1.165 608 HB2 GLU 80 2HB GLU 80 -8.282 8.392 -0.105 609 HB3 GLU 80 1HB GLU 80 -8.962 9.663 0.918 610 HG2 GLU 80 2HG GLU 80 -7.941 11.320 -0.226 611 HG3 GLU 80 1HG GLU 80 -6.501 10.345 -0.569 612 H ASP 81 H ASP 81 -7.430 11.472 1.688 613 HA ASP 81 HA ASP 81 -6.934 11.966 4.385 614 HB2 ASP 81 2HB ASP 81 -7.407 13.544 2.260 615 HB3 ASP 81 1HB ASP 81 -8.979 13.653 3.051 616 H GLU 82 H GLU 82 -9.738 10.646 2.836 617 HA GLU 82 HA GLU 82 -11.795 11.259 4.546 618 HB2 GLU 82 2HB GLU 82 -11.545 9.600 2.440 619 HB3 GLU 82 1HB GLU 82 -11.623 8.414 3.736 620 HG2 GLU 82 2HG GLU 82 -13.828 8.570 3.570 621 HG3 GLU 82 1HG GLU 82 -13.673 10.150 4.340 622 H GLU 83 H GLU 83 -9.077 9.168 5.118 623 HA GLU 83 HA GLU 83 -9.980 8.818 7.886 624 HB2 GLU 83 2HB GLU 83 -9.305 6.692 5.919 625 HB3 GLU 83 1HB GLU 83 -8.718 6.476 7.562 626 HG2 GLU 83 2HG GLU 83 -10.693 5.562 7.991 627 HG3 GLU 83 1HG GLU 83 -11.338 7.205 7.941 628 H GLU 84 H GLU 84 -8.469 9.414 9.295 629 HA GLU 84 HA GLU 84 -5.691 9.624 8.341 630 HB2 GLU 84 2HB GLU 84 -7.398 11.383 9.983 631 HB3 GLU 84 1HB GLU 84 -5.743 11.203 10.548 632 HG2 GLU 84 2HG GLU 84 -6.223 11.807 7.676 633 HG3 GLU 84 1HG GLU 84 -6.401 13.095 8.867 634 HA PRO 85 HA PRO 85 -5.373 6.212 11.378 635 HB2 PRO 85 2HB PRO 85 -2.688 6.060 10.134 636 HB3 PRO 85 1HB PRO 85 -3.895 4.783 10.382 637 HG2 PRO 85 2HG PRO 85 -3.423 5.788 7.948 638 HG3 PRO 85 1HG PRO 85 -5.067 5.335 8.463 639 HD2 PRO 85 2HD PRO 85 -3.811 8.051 8.278 640 HD3 PRO 85 1HD PRO 85 -5.461 7.535 7.849 641 H LYS 86 H LYS 86 -3.507 9.062 10.829 642 HA LYS 86 HA LYS 86 -1.997 10.231 12.066 643 HB2 LYS 86 2HB LYS 86 -2.664 10.694 14.300 644 HB3 LYS 86 1HB LYS 86 -4.144 10.410 13.378 645 HG2 LYS 86 2HG LYS 86 -4.683 8.573 14.564 646 HG3 LYS 86 1HG LYS 86 -3.008 8.048 14.728 647 HD2 LYS 86 2HD LYS 86 -3.268 8.671 16.873 648 HD3 LYS 86 1HD LYS 86 -2.987 10.295 16.241 649 HE2 LYS 86 2HE LYS 86 -5.310 10.762 16.163 650 HE3 LYS 86 1HE LYS 86 -5.728 9.072 16.444 651 HZ1 LYS 86 3HZ LYS 86 -5.602 10.980 18.350 652 HZ2 LYS 86 1HZ LYS 86 -4.096 10.224 18.518 653 HZ3 LYS 86 2HZ LYS 86 -5.517 9.316 18.640 654 H ASP 87 H ASP 87 -1.071 7.654 11.351 655 HA ASP 87 HA ASP 87 0.875 7.265 13.495 656 HB2 ASP 87 2HB ASP 87 -1.234 5.516 13.216 657 HB3 ASP 87 1HB ASP 87 0.047 4.726 12.283 658 H GLU 88 H GLU 88 2.302 5.202 12.522 659 HA GLU 88 HA GLU 88 3.840 6.386 10.473 660 HB2 GLU 88 2HB GLU 88 3.884 3.849 12.002 661 HB3 GLU 88 1HB GLU 88 4.758 3.865 10.477 662 HG2 GLU 88 2HG GLU 88 6.346 4.461 12.048 663 HG3 GLU 88 1HG GLU 88 5.856 6.001 11.347 664 H ASP 89 H ASP 89 1.024 4.494 10.327 665 HA ASP 89 HA ASP 89 1.393 2.972 8.035 666 HB2 ASP 89 2HB ASP 89 -0.640 3.312 9.795 667 HB3 ASP 89 1HB ASP 89 -1.296 4.140 8.374 668 H PHE 90 H PHE 90 1.241 6.399 8.235 669 HA PHE 90 HA PHE 90 0.603 6.513 5.359 670 HB2 PHE 90 2HB PHE 90 -0.160 8.800 5.680 671 HB3 PHE 90 1HB PHE 90 -1.019 7.705 6.771 672 HD1 PHE 90 1HD PHE 90 1.842 10.078 6.648 673 HD2 PHE 90 2HD PHE 90 -1.112 8.165 9.039 674 HE1 PHE 90 1HE PHE 90 2.465 11.508 8.550 675 HE2 PHE 90 2HE PHE 90 -0.494 9.592 10.947 676 HZ PHE 90 HZ PHE 90 1.295 11.265 10.705 677 H SER 91 H SER 91 2.834 7.728 7.828 678 HA SER 91 HA SER 91 4.871 8.039 5.816 679 HB2 SER 91 2HB SER 91 3.879 10.488 7.302 680 HB3 SER 91 1HB SER 91 5.338 10.421 6.302 681 HG SER 91 HG SER 91 3.366 11.224 5.259 682 HA PRO 92 HA PRO 92 6.616 7.023 9.909 683 HB2 PRO 92 2HB PRO 92 7.821 4.733 9.230 684 HB3 PRO 92 1HB PRO 92 6.076 4.808 9.517 685 HG2 PRO 92 2HG PRO 92 7.574 4.653 6.955 686 HG3 PRO 92 1HG PRO 92 6.004 3.959 7.386 687 HD2 PRO 92 2HD PRO 92 6.448 6.336 5.943 688 HD3 PRO 92 1HD PRO 92 4.908 5.795 6.634 689 H ASP 93 H ASP 93 8.363 6.454 6.836 690 HA ASP 93 HA ASP 93 10.773 7.578 8.077 691 HB2 ASP 93 2HB ASP 93 10.276 5.537 5.991 692 HB3 ASP 93 1HB ASP 93 11.652 6.612 5.698 693 H GLY 94 H GLY 94 9.437 9.656 7.752 694 HA2 GLY 94 2HA GLY 94 10.641 11.411 6.110 695 HA3 GLY 94 1HA GLY 94 9.440 10.684 5.036 696 H GLY 95 H GLY 95 8.924 13.132 5.099 697 HA2 GLY 95 2HA GLY 95 7.004 13.612 7.297 698 HA3 GLY 95 1HA GLY 95 7.905 14.894 6.487 699 H TYR 96 H TYR 96 7.386 13.328 3.884 700 HA TYR 96 HA TYR 96 5.443 14.857 2.776 701 HB2 TYR 96 2HB TYR 96 4.976 12.757 1.270 702 HB3 TYR 96 1HB TYR 96 6.537 13.581 1.197 703 HD1 TYR 96 1HD TYR 96 8.485 12.574 2.474 704 HD2 TYR 96 2HD TYR 96 4.833 10.484 1.840 705 HE1 TYR 96 1HE TYR 96 9.624 10.450 2.950 706 HE2 TYR 96 2HE TYR 96 5.965 8.349 2.308 707 HH TYR 96 HH TYR 96 8.138 7.708 3.739 708 H ILE 97 H ILE 97 3.214 14.408 2.121 709 HA ILE 97 HA ILE 97 1.761 12.681 3.987 710 HB ILE 97 HB ILE 97 0.025 14.661 4.015 711 HG12 ILE 97 2HG1 ILE 97 2.357 16.442 4.122 712 HG13 ILE 97 1HG1 ILE 97 1.973 15.845 2.502 713 HG21 ILE 97 1HG2 ILE 97 0.831 13.919 6.063 714 HG22 ILE 97 2HG2 ILE 97 1.316 15.616 6.024 715 HG23 ILE 97 3HG2 ILE 97 2.496 14.351 5.675 716 HD11 ILE 97 3HD1 ILE 97 0.451 17.661 4.271 717 HD12 ILE 97 1HD1 ILE 97 -0.460 16.574 3.221 718 HD13 ILE 97 2HD1 ILE 97 0.697 17.707 2.522 719 HA PRO 98 HA PRO 98 1.362 10.528 3.257 720 HB2 PRO 98 2HB PRO 98 -1.341 9.751 2.095 721 HB3 PRO 98 1HB PRO 98 -0.445 8.941 3.411 722 HG2 PRO 98 2HG PRO 98 -2.090 11.261 3.572 723 HG3 PRO 98 1HG PRO 98 -1.139 10.483 4.869 724 HD2 PRO 98 2HD PRO 98 -0.389 12.842 4.104 725 HD3 PRO 98 1HD PRO 98 0.849 11.579 4.228 726 H ARG 99 H ARG 99 2.171 8.594 2.321 727 HA ARG 99 HA ARG 99 2.256 8.632 -0.620 728 HB2 ARG 99 2HB ARG 99 4.346 8.668 1.390 729 HB3 ARG 99 1HB ARG 99 4.560 7.340 0.248 730 HG2 ARG 99 2HG ARG 99 5.752 9.372 -0.408 731 HG3 ARG 99 1HG ARG 99 4.550 8.884 -1.603 732 HD2 ARG 99 2HD ARG 99 3.178 10.594 0.091 733 HD3 ARG 99 1HD ARG 99 4.769 11.334 -0.066 734 HE ARG 99 HE ARG 99 3.662 10.533 -2.582 735 HH11 ARG 99 1HH1 ARG 99 3.668 13.051 -0.167 736 HH12 ARG 99 2HH1 ARG 99 3.215 14.296 -1.284 737 HH21 ARG 99 1HH2 ARG 99 3.066 12.167 -4.052 738 HH22 ARG 99 2HH2 ARG 99 2.872 13.793 -3.488 739 H ILE 100 H ILE 100 3.622 6.345 -1.102 740 HA ILE 100 HA ILE 100 1.625 4.306 -0.506 741 HB ILE 100 HB ILE 100 4.051 4.061 -2.279 742 HG12 ILE 100 2HG1 ILE 100 1.898 4.288 -3.961 743 HG13 ILE 100 1HG1 ILE 100 1.489 5.442 -2.694 744 HG21 ILE 100 1HG2 ILE 100 3.345 1.908 -1.973 745 HG22 ILE 100 2HG2 ILE 100 2.348 2.368 -3.352 746 HG23 ILE 100 3HG2 ILE 100 1.664 2.377 -1.728 747 HD11 ILE 100 3HD1 ILE 100 3.028 5.973 -4.861 748 HD12 ILE 100 1HD1 ILE 100 4.249 5.619 -3.638 749 HD13 ILE 100 2HD1 ILE 100 3.058 6.887 -3.352 750 H LEU 101 H LEU 101 2.258 2.137 0.154 751 HA LEU 101 HA LEU 101 4.825 1.501 1.087 752 HB2 LEU 101 2HB LEU 101 4.071 1.465 3.586 753 HB3 LEU 101 1HB LEU 101 4.745 2.910 2.865 754 HG LEU 101 HG LEU 101 1.864 2.860 2.578 755 HD11 LEU 101 1HD1 LEU 101 1.117 2.703 4.712 756 HD12 LEU 101 2HD1 LEU 101 2.653 3.233 5.407 757 HD13 LEU 101 3HD1 LEU 101 2.472 1.578 4.822 758 HD21 LEU 101 3HD2 LEU 101 2.070 5.081 3.019 759 HD22 LEU 101 1HD2 LEU 101 3.739 4.747 2.565 760 HD23 LEU 101 2HD2 LEU 101 3.292 4.833 4.265 761 H PHE 102 H PHE 102 5.005 -0.559 1.985 762 HA PHE 102 HA PHE 102 2.744 -2.311 1.379 763 HB2 PHE 102 2HB PHE 102 5.553 -2.456 1.075 764 HB3 PHE 102 1HB PHE 102 5.114 -3.695 2.243 765 HD1 PHE 102 2HD PHE 102 2.581 -4.691 1.309 766 HD2 PHE 102 1HD PHE 102 5.989 -3.464 -0.919 767 HE1 PHE 102 2HE PHE 102 1.919 -6.192 -0.526 768 HE2 PHE 102 1HE PHE 102 5.338 -4.960 -2.757 769 HZ PHE 102 HZ PHE 102 3.305 -6.328 -2.557 770 H LEU 103 H LEU 103 1.739 -3.652 2.891 771 HA LEU 103 HA LEU 103 2.840 -3.607 5.618 772 HB2 LEU 103 2HB LEU 103 0.832 -3.012 6.651 773 HB3 LEU 103 1HB LEU 103 1.012 -1.875 5.331 774 HG LEU 103 HG LEU 103 -0.782 -4.284 5.369 775 HD11 LEU 103 1HD1 LEU 103 -1.797 -2.703 6.724 776 HD12 LEU 103 2HD1 LEU 103 -2.527 -2.439 5.141 777 HD13 LEU 103 3HD1 LEU 103 -1.263 -1.359 5.724 778 HD21 LEU 103 3HD2 LEU 103 0.155 -2.496 3.227 779 HD22 LEU 103 1HD2 LEU 103 -1.576 -2.824 3.260 780 HD23 LEU 103 2HD2 LEU 103 -0.430 -4.158 3.150 781 H ASP 104 H ASP 104 2.068 -5.319 6.995 782 HA ASP 104 HA ASP 104 1.985 -7.809 5.676 783 HB2 ASP 104 2HB ASP 104 2.022 -6.844 8.439 784 HB3 ASP 104 1HB ASP 104 1.090 -8.336 8.239 785 HA PRO 105 HA PRO 105 -2.251 -8.397 4.586 786 HB2 PRO 105 2HB PRO 105 -2.393 -11.117 5.242 787 HB3 PRO 105 1HB PRO 105 -1.917 -10.441 3.674 788 HG2 PRO 105 2HG PRO 105 -0.220 -11.439 5.915 789 HG3 PRO 105 1HG PRO 105 0.052 -11.533 4.160 790 HD2 PRO 105 2HD PRO 105 1.384 -9.783 5.701 791 HD3 PRO 105 1HD PRO 105 0.878 -9.370 4.048 792 H SER 106 H SER 106 -3.124 -7.144 6.272 793 HA SER 106 HA SER 106 -5.038 -8.226 7.850 794 HB2 SER 106 2HB SER 106 -2.378 -8.473 9.131 795 HB3 SER 106 1HB SER 106 -3.660 -7.812 10.158 796 HG SER 106 HG SER 106 -4.742 -9.671 10.032 797 H GLY 107 H GLY 107 -2.572 -5.806 7.494 798 HA2 GLY 107 2HA GLY 107 -3.388 -3.510 7.191 799 HA3 GLY 107 1HA GLY 107 -4.453 -3.800 8.571 800 H LYS 108 H LYS 108 -1.027 -4.696 8.249 801 HA LYS 108 HA LYS 108 -0.463 -2.807 10.451 802 HB2 LYS 108 2HB LYS 108 0.232 -5.686 10.146 803 HB3 LYS 108 1HB LYS 108 1.378 -4.637 10.969 804 HG2 LYS 108 2HG LYS 108 -1.120 -4.028 12.071 805 HG3 LYS 108 1HG LYS 108 -1.065 -5.794 11.937 806 HD2 LYS 108 2HD LYS 108 1.443 -5.134 12.895 807 HD3 LYS 108 1HD LYS 108 0.374 -4.007 13.732 808 HE2 LYS 108 2HE LYS 108 0.149 -5.729 15.175 809 HE3 LYS 108 1HE LYS 108 -1.046 -6.271 13.998 810 HZ1 LYS 108 3HZ LYS 108 1.128 -7.347 12.959 811 HZ2 LYS 108 1HZ LYS 108 0.187 -8.143 14.119 812 HZ3 LYS 108 2HZ LYS 108 1.602 -7.336 14.582 813 H VAL 109 H VAL 109 0.204 -1.312 8.734 814 HA VAL 109 HA VAL 109 2.189 -1.690 6.870 815 HB VAL 109 HB VAL 109 1.277 0.676 8.445 816 HG11 VAL 109 1HG1 VAL 109 2.827 2.075 7.041 817 HG12 VAL 109 2HG1 VAL 109 3.701 0.586 6.682 818 HG13 VAL 109 3HG1 VAL 109 3.576 1.155 8.345 819 HG21 VAL 109 3HG2 VAL 109 -0.038 -0.097 6.538 820 HG22 VAL 109 1HG2 VAL 109 1.370 0.076 5.490 821 HG23 VAL 109 2HG2 VAL 109 0.643 1.500 6.237 822 H HIS 110 H HIS 110 4.299 -1.844 6.836 823 HA HIS 110 HA HIS 110 5.834 -1.320 9.273 824 HB2 HIS 110 2HB HIS 110 7.174 -3.435 8.686 825 HB3 HIS 110 1HB HIS 110 5.603 -3.662 9.447 826 HD1 HIS 110 1HD HIS 110 6.430 -3.120 5.774 827 HD2 HIS 110 2HD HIS 110 4.655 -5.917 8.280 828 HE1 HIS 110 1HE HIS 110 5.526 -4.905 4.253 829 HE2 HIS 110 2HE HIS 110 4.380 -6.544 5.785 830 HA PRO 111 HA PRO 111 8.358 0.757 6.277 831 HB2 PRO 111 2HB PRO 111 10.641 1.011 7.738 832 HB3 PRO 111 1HB PRO 111 9.208 2.010 8.000 833 HG2 PRO 111 2HG PRO 111 10.130 -0.408 9.499 834 HG3 PRO 111 1HG PRO 111 9.457 1.105 10.126 835 HD2 PRO 111 2HD PRO 111 7.989 -1.156 9.881 836 HD3 PRO 111 1HD PRO 111 7.286 0.468 9.686 837 H GLU 112 H GLU 112 8.198 -2.153 6.095 838 HA GLU 112 HA GLU 112 10.922 -3.074 5.744 839 HB2 GLU 112 2HB GLU 112 8.213 -4.302 5.595 840 HB3 GLU 112 1HB GLU 112 9.504 -5.069 4.681 841 HG2 GLU 112 2HG GLU 112 9.128 -6.000 6.961 842 HG3 GLU 112 1HG GLU 112 10.776 -5.463 6.643 843 H ILE 113 H ILE 113 8.261 -3.557 3.451 844 HA ILE 113 HA ILE 113 10.070 -2.975 1.258 845 HB ILE 113 HB ILE 113 7.135 -3.615 1.015 846 HG12 ILE 113 2HG1 ILE 113 8.582 -5.951 0.486 847 HG13 ILE 113 1HG1 ILE 113 9.295 -5.308 1.973 848 HG21 ILE 113 1HG2 ILE 113 8.292 -2.753 -0.978 849 HG22 ILE 113 2HG2 ILE 113 7.748 -4.417 -1.187 850 HG23 ILE 113 3HG2 ILE 113 9.448 -4.080 -0.863 851 HD11 ILE 113 3HD1 ILE 113 7.616 -6.185 3.104 852 HD12 ILE 113 1HD1 ILE 113 6.849 -6.720 1.611 853 HD13 ILE 113 2HD1 ILE 113 6.501 -5.116 2.254 854 H ILE 114 H ILE 114 10.461 -0.808 1.284 855 HA ILE 114 HA ILE 114 8.259 1.069 1.450 856 HB ILE 114 HB ILE 114 10.126 2.772 1.187 857 HG12 ILE 114 2HG1 ILE 114 11.679 0.785 0.332 858 HG13 ILE 114 1HG1 ILE 114 12.339 2.168 1.178 859 HG21 ILE 114 1HG2 ILE 114 9.510 1.042 3.463 860 HG22 ILE 114 2HG2 ILE 114 9.530 2.801 3.339 861 HG23 ILE 114 3HG2 ILE 114 11.031 1.922 3.600 862 HD11 ILE 114 3HD1 ILE 114 12.896 -0.374 1.798 863 HD12 ILE 114 1HD1 ILE 114 11.520 -0.099 2.865 864 HD13 ILE 114 2HD1 ILE 114 12.936 0.946 2.968 865 H ASN 115 H ASN 115 10.854 0.344 -0.881 866 HA ASN 115 HA ASN 115 9.446 0.371 -3.203 867 HB2 ASN 115 2HB ASN 115 8.644 2.614 -2.823 868 HB3 ASN 115 1HB ASN 115 10.271 3.189 -2.436 869 HD21 ASN 115 1HD2 ASN 115 8.979 4.626 -4.233 870 HD22 ASN 115 2HD2 ASN 115 9.560 4.318 -5.846 871 H GLU 116 H GLU 116 12.315 1.703 -1.661 872 HA GLU 116 HA GLU 116 14.534 1.414 -2.038 873 HB2 GLU 116 2HB GLU 116 13.319 -0.919 -3.358 874 HB3 GLU 116 1HB GLU 116 14.915 -0.476 -3.977 875 HG2 GLU 116 2HG GLU 116 14.325 -0.872 -1.056 876 HG3 GLU 116 1HG GLU 116 14.876 -2.166 -2.119 877 H ASN 117 H ASN 117 13.031 0.850 -5.230 878 HA ASN 117 HA ASN 117 14.980 2.248 -6.680 879 HB2 ASN 117 2HB ASN 117 12.630 0.793 -7.255 880 HB3 ASN 117 1HB ASN 117 12.427 2.380 -8.009 881 HD21 ASN 117 1HD2 ASN 117 14.636 -0.357 -7.723 882 HD22 ASN 117 2HD2 ASN 117 15.347 -0.176 -9.305 883 H GLY 118 H GLY 118 12.447 3.421 -4.705 884 HA2 GLY 118 2HA GLY 118 11.723 5.798 -5.968 885 HA3 GLY 118 1HA GLY 118 11.735 5.547 -4.219 886 H ASN 119 H ASN 119 13.209 6.596 -3.024 887 HA ASN 119 HA ASN 119 15.611 7.671 -4.279 888 HB2 ASN 119 2HB ASN 119 13.419 9.286 -4.129 889 HB3 ASN 119 1HB ASN 119 14.207 9.638 -2.583 890 HD21 ASN 119 1HD2 ASN 119 15.114 11.550 -2.862 891 HD22 ASN 119 2HD2 ASN 119 16.207 11.972 -4.154 892 HA PRO 120 HA PRO 120 17.322 6.831 -0.290 893 HB2 PRO 120 2HB PRO 120 19.285 8.930 -0.449 894 HB3 PRO 120 1HB PRO 120 19.491 7.204 -0.786 895 HG2 PRO 120 2HG PRO 120 19.627 9.192 -2.690 896 HG3 PRO 120 1HG PRO 120 19.234 7.492 -3.033 897 HD2 PRO 120 2HD PRO 120 17.406 9.849 -2.749 898 HD3 PRO 120 1HD PRO 120 17.329 8.483 -3.893 899 H SER 121 H SER 121 15.157 8.935 -0.367 900 HA SER 121 HA SER 121 15.356 9.785 2.318 901 HB2 SER 121 2HB SER 121 16.458 11.578 0.303 902 HB3 SER 121 1HB SER 121 15.117 12.330 1.184 903 HG SER 121 HG SER 121 16.243 11.655 3.133 904 H TYR 122 H TYR 122 13.568 8.409 0.592 905 HA TYR 122 HA TYR 122 11.146 9.830 1.195 906 HB2 TYR 122 2HB TYR 122 12.327 9.965 -1.440 907 HB3 TYR 122 1HB TYR 122 10.747 9.180 -1.504 908 HD1 TYR 122 2HD TYR 122 8.836 10.451 -0.186 909 HD2 TYR 122 1HD TYR 122 12.436 12.261 -1.553 910 HE1 TYR 122 2HE TYR 122 7.754 12.658 -0.100 911 HE2 TYR 122 1HE TYR 122 11.366 14.470 -1.467 912 HH TYR 122 HH TYR 122 9.169 15.457 -1.487 913 H LYS 123 H LYS 123 12.496 7.188 -0.742 914 HA LYS 123 HA LYS 123 11.856 5.025 -1.045 915 HB2 LYS 123 2HB LYS 123 11.182 5.362 1.880 916 HB3 LYS 123 1HB LYS 123 11.298 3.822 1.054 917 HG2 LYS 123 2HG LYS 123 13.560 5.788 1.290 918 HG3 LYS 123 1HG LYS 123 13.305 4.398 2.363 919 HD2 LYS 123 2HD LYS 123 14.053 2.924 0.835 920 HD3 LYS 123 1HD LYS 123 13.282 3.773 -0.510 921 HE2 LYS 123 2HE LYS 123 15.285 5.498 0.318 922 HE3 LYS 123 1HE LYS 123 16.017 3.902 0.462 923 HZ1 LYS 123 3HZ LYS 123 15.802 3.503 -1.779 924 HZ2 LYS 123 1HZ LYS 123 16.140 5.162 -1.773 925 HZ3 LYS 123 2HZ LYS 123 14.550 4.621 -1.986 926 H TYR 124 H TYR 124 9.347 5.383 1.407 927 HA TYR 124 HA TYR 124 7.289 4.152 0.220 928 HB2 TYR 124 2HB TYR 124 7.391 6.498 2.055 929 HB3 TYR 124 1HB TYR 124 5.827 6.045 1.368 930 HD1 TYR 124 2HD TYR 124 7.910 3.194 1.724 931 HD2 TYR 124 1HD TYR 124 5.373 5.807 3.921 932 HE1 TYR 124 2HE TYR 124 7.649 1.480 3.448 933 HE2 TYR 124 1HE TYR 124 5.104 4.086 5.655 934 HH TYR 124 HH TYR 124 6.148 0.848 5.217 935 H PHE 125 H PHE 125 8.409 7.363 -0.647 936 HA PHE 125 HA PHE 125 6.135 7.998 -2.259 937 HB2 PHE 125 2HB PHE 125 7.391 9.837 -1.387 938 HB3 PHE 125 1HB PHE 125 8.900 9.202 -2.057 939 HD1 PHE 125 1HD PHE 125 9.214 9.206 -4.549 940 HD2 PHE 125 2HD PHE 125 5.999 11.247 -2.648 941 HE1 PHE 125 1HE PHE 125 8.884 10.559 -6.573 942 HE2 PHE 125 2HE PHE 125 5.664 12.605 -4.673 943 HZ PHE 125 HZ PHE 125 7.107 12.259 -6.640 944 H TYR 126 H TYR 126 5.659 7.038 -4.109 945 HA TYR 126 HA TYR 126 7.773 5.778 -5.676 946 HB2 TYR 126 2HB TYR 126 4.806 5.539 -5.554 947 HB3 TYR 126 1HB TYR 126 5.579 5.224 -7.111 948 HD1 TYR 126 1HD TYR 126 7.689 3.603 -6.939 949 HD2 TYR 126 2HD TYR 126 4.493 3.749 -4.137 950 HE1 TYR 126 1HE TYR 126 8.221 1.314 -6.221 951 HE2 TYR 126 2HE TYR 126 5.018 1.460 -3.406 952 HH TYR 126 HH TYR 126 7.900 -0.150 -4.341 953 H VAL 127 H VAL 127 7.177 5.980 -8.187 954 HA VAL 127 HA VAL 127 6.131 8.339 -9.194 955 HB VAL 127 HB VAL 127 8.163 9.239 -7.877 956 HG11 VAL 127 1HG1 VAL 127 9.646 8.362 -10.343 957 HG12 VAL 127 2HG1 VAL 127 9.776 7.572 -8.771 958 HG13 VAL 127 3HG1 VAL 127 10.286 9.248 -8.958 959 HG21 VAL 127 3HG2 VAL 127 8.432 10.284 -10.589 960 HG22 VAL 127 1HG2 VAL 127 7.950 11.091 -9.096 961 HG23 VAL 127 2HG2 VAL 127 6.767 10.163 -10.018 962 H SER 128 H SER 128 5.442 7.418 -10.960 963 HA SER 128 HA SER 128 5.543 6.688 -13.143 964 HB2 SER 128 2HB SER 128 7.999 7.557 -13.062 965 HB3 SER 128 1HB SER 128 8.418 5.851 -12.838 966 HG SER 128 HG SER 128 8.156 5.624 -14.899 967 H ALA 129 H ALA 129 4.367 4.918 -13.280 968 HA ALA 129 HA ALA 129 4.286 2.733 -11.681 969 HB1 ALA 129 1HB ALA 129 2.672 2.086 -13.060 970 HB2 ALA 129 2HB ALA 129 3.791 1.928 -14.415 971 HB3 ALA 129 3HB ALA 129 3.067 3.494 -14.047 972 H GLU 130 H GLU 130 6.629 3.355 -14.176 973 HA GLU 130 HA GLU 130 7.585 0.890 -14.839 974 HB2 GLU 130 2HB GLU 130 8.537 3.558 -14.945 975 HB3 GLU 130 1HB GLU 130 9.847 2.564 -14.295 976 HG2 GLU 130 2HG GLU 130 9.983 1.263 -16.210 977 HG3 GLU 130 1HG GLU 130 8.359 1.720 -16.753 978 H GLN 131 H GLN 131 8.864 2.803 -12.085 979 HA GLN 131 HA GLN 131 10.267 0.536 -11.090 980 HB2 GLN 131 2HB GLN 131 10.697 1.923 -9.100 981 HB3 GLN 131 1HB GLN 131 11.227 2.642 -10.615 982 HG2 GLN 131 2HG GLN 131 9.812 4.374 -10.435 983 HG3 GLN 131 1HG GLN 131 8.516 3.381 -9.775 984 HE21 GLN 131 1HE2 GLN 131 8.984 5.869 -8.792 985 HE22 GLN 131 2HE2 GLN 131 9.621 5.765 -7.191 986 H VAL 132 H VAL 132 7.206 2.080 -10.285 987 HA VAL 132 HA VAL 132 6.712 0.772 -7.872 988 HB VAL 132 HB VAL 132 4.588 1.566 -7.942 989 HG11 VAL 132 1HG1 VAL 132 6.198 3.381 -8.634 990 HG12 VAL 132 2HG1 VAL 132 4.491 3.677 -8.966 991 HG13 VAL 132 3HG1 VAL 132 5.569 3.182 -10.270 992 HG21 VAL 132 3HG2 VAL 132 3.485 0.237 -9.471 993 HG22 VAL 132 1HG2 VAL 132 4.541 0.709 -10.800 994 HG23 VAL 132 2HG2 VAL 132 3.329 1.837 -10.196 995 H VAL 133 H VAL 133 6.641 -0.386 -11.133 996 HA VAL 133 HA VAL 133 5.125 -2.753 -10.473 997 HB VAL 133 HB VAL 133 5.054 -1.623 -12.741 998 HG11 VAL 133 1HG1 VAL 133 7.132 -3.074 -13.980 999 HG12 VAL 133 2HG1 VAL 133 7.844 -2.196 -12.629 1000 HG13 VAL 133 3HG1 VAL 133 6.940 -1.325 -13.866 1001 HG21 VAL 133 3HG2 VAL 133 5.763 -4.546 -12.845 1002 HG22 VAL 133 1HG2 VAL 133 4.640 -3.661 -13.877 1003 HG23 VAL 133 2HG2 VAL 133 4.241 -3.944 -12.184 1004 H GLN 134 H GLN 134 8.538 -1.850 -10.811 1005 HA GLN 134 HA GLN 134 9.384 -4.619 -10.812 1006 HB2 GLN 134 2HB GLN 134 11.661 -3.437 -10.139 1007 HB3 GLN 134 1HB GLN 134 11.065 -3.424 -11.791 1008 HG2 GLN 134 2HG GLN 134 10.124 -1.203 -11.426 1009 HG3 GLN 134 1HG GLN 134 10.747 -1.217 -9.777 1010 HE21 GLN 134 1HE2 GLN 134 13.139 -1.630 -9.616 1011 HE22 GLN 134 2HE2 GLN 134 14.153 -0.822 -10.780 1012 H GLY 135 H GLY 135 9.009 -2.058 -8.457 1013 HA2 GLY 135 2HA GLY 135 10.114 -3.569 -6.279 1014 HA3 GLY 135 1HA GLY 135 9.189 -2.066 -6.155 1015 H MET 136 H MET 136 7.057 -3.414 -7.887 1016 HA MET 136 HA MET 136 5.653 -4.631 -5.635 1017 HB2 MET 136 2HB MET 136 4.799 -3.559 -8.304 1018 HB3 MET 136 1HB MET 136 3.732 -4.613 -7.387 1019 HG2 MET 136 2HG MET 136 4.838 -1.959 -6.496 1020 HG3 MET 136 1HG MET 136 3.176 -2.306 -6.968 1021 HE1 MET 136 3HE MET 136 4.197 -1.792 -2.897 1022 HE2 MET 136 1HE MET 136 3.350 -0.867 -4.139 1023 HE3 MET 136 2HE MET 136 5.059 -1.253 -4.338 1024 H LYS 137 H LYS 137 6.941 -5.439 -8.777 1025 HA LYS 137 HA LYS 137 5.776 -8.056 -8.852 1026 HB2 LYS 137 2HB LYS 137 6.889 -8.370 -10.889 1027 HB3 LYS 137 1HB LYS 137 6.505 -6.659 -10.866 1028 HG2 LYS 137 2HG LYS 137 8.882 -6.341 -9.954 1029 HG3 LYS 137 1HG LYS 137 9.161 -7.993 -10.507 1030 HD2 LYS 137 2HD LYS 137 8.301 -5.633 -12.180 1031 HD3 LYS 137 1HD LYS 137 9.858 -6.463 -12.232 1032 HE2 LYS 137 2HE LYS 137 7.268 -7.879 -12.805 1033 HE3 LYS 137 1HE LYS 137 8.164 -7.023 -14.058 1034 HZ1 LYS 137 3HZ LYS 137 8.597 -9.503 -13.757 1035 HZ2 LYS 137 1HZ LYS 137 9.471 -9.069 -12.375 1036 HZ3 LYS 137 2HZ LYS 137 9.943 -8.489 -13.891 1037 H GLU 138 H GLU 138 8.352 -6.677 -7.189 1038 HA GLU 138 HA GLU 138 9.898 -9.136 -6.995 1039 HB2 GLU 138 2HB GLU 138 10.838 -6.706 -7.166 1040 HB3 GLU 138 1HB GLU 138 10.481 -6.640 -5.441 1041 HG2 GLU 138 2HG GLU 138 11.833 -8.891 -5.404 1042 HG3 GLU 138 1HG GLU 138 12.512 -8.246 -6.906 1043 H ALA 139 H ALA 139 8.656 -6.788 -4.638 1044 HA ALA 139 HA ALA 139 8.810 -8.446 -2.404 1045 HB1 ALA 139 1HB ALA 139 6.614 -6.482 -2.436 1046 HB2 ALA 139 2HB ALA 139 8.232 -5.857 -2.759 1047 HB3 ALA 139 3HB ALA 139 7.907 -6.730 -1.261 1048 H GLN 140 H GLN 140 6.538 -8.448 -4.976 1049 HA GLN 140 HA GLN 140 4.266 -9.430 -3.722 1050 HB2 GLN 140 2HB GLN 140 3.694 -10.330 -5.987 1051 HB3 GLN 140 1HB GLN 140 4.104 -8.619 -5.945 1052 HG2 GLN 140 2HG GLN 140 5.146 -9.531 -7.849 1053 HG3 GLN 140 1HG GLN 140 6.411 -9.267 -6.653 1054 HE21 GLN 140 1HE2 GLN 140 4.055 -11.880 -7.088 1055 HE22 GLN 140 2HE2 GLN 140 5.223 -13.147 -7.183 1056 H GLU 141 H GLU 141 7.261 -11.020 -4.172 1057 HA GLU 141 HA GLU 141 5.965 -13.592 -3.617 1058 HB2 GLU 141 2HB GLU 141 7.628 -14.754 -4.856 1059 HB3 GLU 141 1HB GLU 141 6.973 -13.466 -5.878 1060 HG2 GLU 141 2HG GLU 141 8.876 -12.063 -5.196 1061 HG3 GLU 141 1HG GLU 141 9.543 -13.454 -4.358 1062 H ARG 142 H ARG 142 8.764 -11.566 -2.980 1063 HA ARG 142 HA ARG 142 9.872 -13.411 -1.077 1064 HB2 ARG 142 2HB ARG 142 11.418 -11.487 -0.540 1065 HB3 ARG 142 1HB ARG 142 11.442 -12.047 -2.216 1066 HG2 ARG 142 2HG ARG 142 11.212 -9.907 -2.770 1067 HG3 ARG 142 1HG ARG 142 9.527 -10.078 -2.250 1068 HD2 ARG 142 2HD ARG 142 10.555 -8.129 -1.219 1069 HD3 ARG 142 1HD ARG 142 10.151 -9.347 0.002 1070 HE ARG 142 HE ARG 142 12.728 -9.902 -0.575 1071 HH11 ARG 142 1HH1 ARG 142 11.084 -6.945 0.287 1072 HH12 ARG 142 2HH1 ARG 142 12.472 -6.252 1.059 1073 HH21 ARG 142 1HH2 ARG 142 14.552 -8.991 0.441 1074 HH22 ARG 142 2HH2 ARG 142 14.440 -7.414 1.147 1075 H LEU 143 H LEU 143 7.402 -11.078 -0.945 1076 HA LEU 143 HA LEU 143 7.688 -10.845 1.970 1077 HB2 LEU 143 2HB LEU 143 7.082 -8.717 1.778 1078 HB3 LEU 143 1HB LEU 143 7.188 -8.915 0.029 1079 HG LEU 143 HG LEU 143 4.712 -9.705 0.222 1080 HD11 LEU 143 1HD1 LEU 143 4.011 -9.816 2.346 1081 HD12 LEU 143 2HD1 LEU 143 3.852 -8.064 2.218 1082 HD13 LEU 143 3HD1 LEU 143 5.302 -8.768 2.932 1083 HD21 LEU 143 3HD2 LEU 143 4.441 -6.933 0.695 1084 HD22 LEU 143 1HD2 LEU 143 4.472 -7.783 -0.850 1085 HD23 LEU 143 2HD2 LEU 143 5.971 -7.175 -0.147 1086 H THR 144 H THR 144 5.497 -11.847 -0.588 1087 HA THR 144 HA THR 144 3.144 -12.222 0.807 1088 HB THR 144 HB THR 144 2.855 -14.197 -0.823 1089 HG1 THR 144 1HG THR 144 4.952 -14.604 -1.371 1090 HG21 THR 144 3HG2 THR 144 1.806 -12.113 -1.304 1091 HG22 THR 144 1HG2 THR 144 2.586 -12.703 -2.770 1092 HG23 THR 144 2HG2 THR 144 3.338 -11.414 -1.829 1093 H GLY 145 H GLY 145 6.061 -14.160 0.845 1094 HA2 GLY 145 2HA GLY 145 4.723 -16.149 2.550 1095 HA3 GLY 145 1HA GLY 145 6.245 -16.391 1.709 1096 H ASP 146 H ASP 146 5.638 -13.437 3.443 1097 HA ASP 146 HA ASP 146 6.693 -12.480 5.221 1098 HB2 ASP 146 2HB ASP 146 5.977 -15.212 6.098 1099 HB3 ASP 146 1HB ASP 146 7.177 -14.385 7.088 1100 H ALA 147 H ALA 147 8.325 -13.715 3.043 1101 HA ALA 147 HA ALA 147 10.704 -14.740 4.256 1102 HB1 ALA 147 1HB ALA 147 9.695 -14.346 1.588 1103 HB2 ALA 147 2HB ALA 147 10.949 -15.445 2.161 1104 HB3 ALA 147 3HB ALA 147 11.365 -13.794 1.708 1105 H PHE 148 H PHE 148 9.489 -11.587 3.492 1106 HA PHE 148 HA PHE 148 11.847 -10.116 3.308 1107 HB2 PHE 148 2HB PHE 148 10.516 -8.175 3.837 1108 HB3 PHE 148 1HB PHE 148 9.544 -9.261 2.833 1109 HD1 PHE 148 2HD PHE 148 7.779 -10.660 3.916 1110 HD2 PHE 148 1HD PHE 148 9.829 -7.567 5.998 1111 HE1 PHE 148 2HE PHE 148 6.001 -10.633 5.616 1112 HE2 PHE 148 1HE PHE 148 8.055 -7.534 7.703 1113 HZ PHE 148 HZ PHE 148 6.137 -9.067 7.513 1114 H ARG 149 H ARG 149 10.166 -11.386 6.102 1115 HA ARG 149 HA ARG 149 11.300 -9.884 8.132 1116 HB2 ARG 149 2HB ARG 149 10.647 -12.830 8.238 1117 HB3 ARG 149 1HB ARG 149 10.739 -11.723 9.597 1118 HG2 ARG 149 2HG ARG 149 8.886 -10.442 8.211 1119 HG3 ARG 149 1HG ARG 149 8.610 -12.064 7.571 1120 HD2 ARG 149 2HD ARG 149 7.290 -12.313 9.368 1121 HD3 ARG 149 1HD ARG 149 8.804 -12.564 10.236 1122 HE ARG 149 HE ARG 149 8.483 -9.883 10.328 1123 HH11 ARG 149 1HH1 ARG 149 6.397 -12.558 11.143 1124 HH12 ARG 149 2HH1 ARG 149 5.557 -11.687 12.383 1125 HH21 ARG 149 1HH2 ARG 149 7.381 -8.738 11.958 1126 HH22 ARG 149 2HH2 ARG 149 6.116 -9.518 12.846 1127 H LYS 150 H LYS 150 13.333 -9.611 8.748 1128 HA LYS 150 HA LYS 150 15.357 -11.548 7.903 1129 HB2 LYS 150 2HB LYS 150 15.536 -8.714 8.922 1130 HB3 LYS 150 1HB LYS 150 16.951 -9.733 8.694 1131 HG2 LYS 150 2HG LYS 150 16.239 -10.003 6.299 1132 HG3 LYS 150 1HG LYS 150 15.029 -8.755 6.601 1133 HD2 LYS 150 2HD LYS 150 17.377 -7.672 7.600 1134 HD3 LYS 150 1HD LYS 150 17.884 -8.504 6.129 1135 HE2 LYS 150 2HE LYS 150 15.534 -6.629 6.215 1136 HE3 LYS 150 1HE LYS 150 17.175 -6.083 5.874 1137 HZ1 LYS 150 3HZ LYS 150 15.485 -7.911 4.276 1138 HZ2 LYS 150 1HZ LYS 150 17.161 -7.826 4.055 1139 HZ3 LYS 150 2HZ LYS 150 16.203 -6.456 3.798 1140 H LYS 151 H LYS 151 17.313 -11.461 9.629 1141 HA LYS 151 HA LYS 151 16.179 -12.663 12.023 1142 HB2 LYS 151 2HB LYS 151 18.985 -12.544 10.921 1143 HB3 LYS 151 1HB LYS 151 18.598 -13.260 12.479 1144 HG2 LYS 151 2HG LYS 151 16.841 -14.375 10.554 1145 HG3 LYS 151 1HG LYS 151 18.479 -14.438 9.901 1146 HD2 LYS 151 2HD LYS 151 18.632 -16.338 11.099 1147 HD3 LYS 151 1HD LYS 151 18.905 -15.246 12.457 1148 HE2 LYS 151 2HE LYS 151 16.838 -15.599 13.336 1149 HE3 LYS 151 1HE LYS 151 16.091 -15.843 11.757 1150 HZ1 LYS 151 3HZ LYS 151 17.660 -17.983 11.894 1151 HZ2 LYS 151 1HZ LYS 151 16.058 -17.971 12.443 1152 HZ3 LYS 151 2HZ LYS 151 17.330 -17.772 13.540 1153 H HIS 152 H HIS 152 15.932 -11.577 13.850 1154 HA HIS 152 HA HIS 152 16.147 -10.023 15.495 1155 HB2 HIS 152 2HB HIS 152 18.967 -9.878 14.412 1156 HB3 HIS 152 1HB HIS 152 18.437 -9.104 15.902 1157 HD1 HIS 152 1HD HIS 152 17.882 -10.669 17.916 1158 HD2 HIS 152 2HD HIS 152 19.425 -12.613 14.584 1159 HE1 HIS 152 1HE HIS 152 18.536 -12.961 18.718 1160 HE2 HIS 152 2HE HIS 152 19.389 -14.148 16.666 1161 H LEU 153 H LEU 153 14.997 -8.229 15.274 1162 HA LEU 153 HA LEU 153 16.108 -5.976 13.827 1163 HB2 LEU 153 2HB LEU 153 14.002 -5.590 12.567 1164 HB3 LEU 153 1HB LEU 153 14.891 -7.010 12.047 1165 HG LEU 153 HG LEU 153 12.771 -7.458 14.067 1166 HD11 LEU 153 1HD1 LEU 153 10.955 -7.104 12.728 1167 HD12 LEU 153 2HD1 LEU 153 11.886 -7.251 11.237 1168 HD13 LEU 153 3HD1 LEU 153 11.989 -5.776 12.199 1169 HD21 LEU 153 3HD2 LEU 153 14.102 -8.883 11.845 1170 HD22 LEU 153 1HD2 LEU 153 12.414 -9.293 12.156 1171 HD23 LEU 153 2HD2 LEU 153 13.613 -9.464 13.438 1172 H GLU 154 H GLU 154 14.622 -4.016 14.081 1173 HA GLU 154 HA GLU 154 14.086 -3.672 16.849 1174 HB2 GLU 154 2HB GLU 154 14.468 -2.005 14.617 1175 HB3 GLU 154 1HB GLU 154 12.859 -1.631 15.217 1176 HG2 GLU 154 2HG GLU 154 14.296 -1.691 17.523 1177 HG3 GLU 154 1HG GLU 154 15.484 -1.070 16.378 1178 H ASP 155 H ASP 155 12.324 -4.213 17.935 1179 HA ASP 155 HA ASP 155 9.763 -4.364 16.487 1180 HB2 ASP 155 2HB ASP 155 11.157 -6.426 17.921 1181 HB3 ASP 155 1HB ASP 155 9.638 -6.077 18.742 1182 H GLU 156 H GLU 156 8.086 -4.826 18.609 1183 HA GLU 156 HA GLU 156 8.081 -2.217 19.879 1184 HB2 GLU 156 2HB GLU 156 6.097 -4.370 19.398 1185 HB3 GLU 156 1HB GLU 156 5.861 -3.390 20.851 1186 HG2 GLU 156 2HG GLU 156 4.589 -2.399 19.122 1187 HG3 GLU 156 1HG GLU 156 5.989 -1.362 19.391 1188 H LEU 157 H LEU 157 8.509 -5.583 20.737 1189 HA LEU 157 HA LEU 157 9.191 -6.610 22.648 1190 HB2 LEU 157 2HB LEU 157 10.124 -3.837 23.394 1191 HB3 LEU 157 1HB LEU 157 10.607 -5.324 24.189 1192 HG LEU 157 HG LEU 157 11.258 -5.804 21.550 1193 HD11 LEU 157 1HD1 LEU 157 11.796 -2.917 22.209 1194 HD12 LEU 157 2HD1 LEU 157 10.880 -3.558 20.847 1195 HD13 LEU 157 3HD1 LEU 157 12.622 -3.807 20.932 1196 HD21 LEU 157 3HD2 LEU 157 12.517 -6.212 23.729 1197 HD22 LEU 157 1HD2 LEU 157 13.164 -4.583 23.524 1198 HD23 LEU 157 2HD2 LEU 157 13.479 -5.818 22.304 Start of MODEL 23 1 H1 MET 1 1HT MET 1 -8.317 12.858 24.821 2 H2 MET 1 2HT MET 1 -8.230 11.647 26.032 3 H3 MET 1 3HT MET 1 -8.328 13.301 26.477 4 HA MET 1 HA MET 1 -10.392 11.934 26.670 5 HB2 MET 1 2HB MET 1 -9.872 14.591 26.135 6 HB3 MET 1 1HB MET 1 -11.063 14.179 24.909 7 HG2 MET 1 2HG MET 1 -12.536 13.315 26.704 8 HG3 MET 1 1HG MET 1 -11.361 13.883 27.888 9 HE1 MET 1 2HE MET 1 -14.903 15.691 26.614 10 HE2 MET 1 3HE MET 1 -14.434 15.712 28.313 11 HE3 MET 1 1HE MET 1 -14.333 14.213 27.390 12 H HIS 2 H HIS 2 -8.943 10.683 24.440 13 HA HIS 2 HA HIS 2 -9.379 9.442 22.586 14 HB2 HIS 2 2HB HIS 2 -11.928 9.652 23.997 15 HB3 HIS 2 1HB HIS 2 -12.129 9.383 22.270 16 HD1 HIS 2 1HD HIS 2 -9.977 7.872 25.032 17 HD2 HIS 2 2HD HIS 2 -12.187 6.753 21.695 18 HE1 HIS 2 1HE HIS 2 -9.813 5.365 24.928 19 HE2 HIS 2 2HE HIS 2 -11.226 4.704 22.949 20 H HIS 3 H HIS 3 -10.186 9.533 20.362 21 HA HIS 3 HA HIS 3 -9.881 12.099 19.244 22 HB2 HIS 3 2HB HIS 3 -10.922 9.530 18.040 23 HB3 HIS 3 1HB HIS 3 -10.583 10.984 17.109 24 HD1 HIS 3 1HD HIS 3 -8.910 8.161 18.887 25 HD2 HIS 3 2HD HIS 3 -7.861 11.541 16.710 26 HE1 HIS 3 1HE HIS 3 -6.461 7.901 18.383 27 HE2 HIS 3 2HE HIS 3 -5.830 9.997 17.135 28 H HIS 4 H HIS 4 -11.499 13.051 17.673 29 HA HIS 4 HA HIS 4 -14.115 13.163 19.001 30 HB2 HIS 4 2HB HIS 4 -14.375 15.330 17.776 31 HB3 HIS 4 1HB HIS 4 -13.024 15.307 18.904 32 HD1 HIS 4 1HD HIS 4 -10.606 14.944 17.762 33 HD2 HIS 4 2HD HIS 4 -13.717 15.998 15.217 34 HE1 HIS 4 1HE HIS 4 -9.503 15.758 15.653 35 HE2 HIS 4 2HE HIS 4 -11.404 16.462 14.157 36 H HIS 5 H HIS 5 -15.104 11.393 18.029 37 HA HIS 5 HA HIS 5 -16.333 10.285 16.469 38 HB2 HIS 5 2HB HIS 5 -16.948 12.923 16.139 39 HB3 HIS 5 1HB HIS 5 -16.403 12.495 14.519 40 HD1 HIS 5 1HD HIS 5 -18.043 11.301 13.064 41 HD2 HIS 5 2HD HIS 5 -19.166 11.270 17.064 42 HE1 HIS 5 1HE HIS 5 -20.352 10.308 13.105 43 HE2 HIS 5 2HE HIS 5 -21.046 10.382 15.527 44 H HIS 6 H HIS 6 -16.416 9.979 13.872 45 HA HIS 6 HA HIS 6 -13.812 10.160 12.642 46 HB2 HIS 6 2HB HIS 6 -14.262 7.932 14.197 47 HB3 HIS 6 1HB HIS 6 -14.714 7.372 12.593 48 HD1 HIS 6 1HD HIS 6 -11.772 9.082 14.287 49 HD2 HIS 6 2HD HIS 6 -12.607 6.573 11.082 50 HE1 HIS 6 1HE HIS 6 -9.534 8.434 13.340 51 HE2 HIS 6 2HE HIS 6 -10.068 6.985 11.350 52 H HIS 7 H HIS 7 -14.736 11.219 10.934 53 HA HIS 7 HA HIS 7 -17.111 10.302 9.638 54 HB2 HIS 7 2HB HIS 7 -15.556 12.636 9.602 55 HB3 HIS 7 1HB HIS 7 -15.467 11.999 7.964 56 HD1 HIS 7 1HD HIS 7 -17.719 13.719 10.321 57 HD2 HIS 7 2HD HIS 7 -18.008 11.805 6.644 58 HE1 HIS 7 1HE HIS 7 -19.947 14.404 9.380 59 HE2 HIS 7 2HE HIS 7 -20.137 13.167 7.194 60 H MET 8 H MET 8 -17.070 9.910 7.198 61 HA MET 8 HA MET 8 -14.878 8.043 6.568 62 HB2 MET 8 2HB MET 8 -17.833 7.842 6.191 63 HB3 MET 8 1HB MET 8 -16.779 7.073 4.999 64 HG2 MET 8 2HG MET 8 -15.731 5.757 6.744 65 HG3 MET 8 1HG MET 8 -16.716 6.560 7.967 66 HE1 MET 8 3HE MET 8 -19.301 6.230 8.248 67 HE2 MET 8 1HE MET 8 -20.302 5.277 7.150 68 HE3 MET 8 2HE MET 8 -19.549 6.771 6.586 69 H SER 9 H SER 9 -15.117 7.555 4.004 70 HA SER 9 HA SER 9 -14.345 10.024 2.763 71 HB2 SER 9 2HB SER 9 -14.296 7.152 2.057 72 HB3 SER 9 1HB SER 9 -14.440 8.266 0.697 73 HG SER 9 HG SER 9 -12.453 8.895 1.007 74 H ASP 10 H ASP 10 -15.469 11.289 1.395 75 HA ASP 10 HA ASP 10 -18.310 10.910 1.209 76 HB2 ASP 10 2HB ASP 10 -16.881 13.128 1.374 77 HB3 ASP 10 1HB ASP 10 -16.881 12.998 -0.382 78 H GLY 11 H GLY 11 -19.335 11.425 -1.039 79 HA2 GLY 11 2HA GLY 11 -19.483 10.985 -3.331 80 HA3 GLY 11 1HA GLY 11 -17.892 10.241 -3.268 81 H HIS 12 H HIS 12 -18.529 8.424 -4.427 82 HA HIS 12 HA HIS 12 -20.701 6.785 -3.409 83 HB2 HIS 12 2HB HIS 12 -20.196 5.324 -5.340 84 HB3 HIS 12 1HB HIS 12 -20.468 7.003 -5.824 85 HD1 HIS 12 1HD HIS 12 -18.493 8.268 -6.853 86 HD2 HIS 12 2HD HIS 12 -17.550 4.401 -5.656 87 HE1 HIS 12 1HE HIS 12 -16.237 7.785 -7.854 88 HE2 HIS 12 2HE HIS 12 -15.648 5.473 -7.042 89 H ASN 13 H ASN 13 -17.219 6.885 -3.369 90 HA ASN 13 HA ASN 13 -17.048 5.036 -1.235 91 HB2 ASN 13 2HB ASN 13 -17.174 3.833 -3.776 92 HB3 ASN 13 1HB ASN 13 -15.482 3.755 -3.297 93 HD21 ASN 13 1HD2 ASN 13 -17.830 1.801 -3.488 94 HD22 ASN 13 2HD2 ASN 13 -17.754 0.938 -1.995 95 H GLY 14 H GLY 14 -15.351 6.520 -3.967 96 HA2 GLY 14 2HA GLY 14 -13.421 7.774 -4.015 97 HA3 GLY 14 1HA GLY 14 -13.478 7.810 -2.249 98 H LEU 15 H LEU 15 -11.724 6.783 -4.863 99 HA LEU 15 HA LEU 15 -9.782 5.467 -3.323 100 HB2 LEU 15 2HB LEU 15 -10.007 3.185 -4.020 101 HB3 LEU 15 1HB LEU 15 -11.509 3.691 -3.274 102 HG LEU 15 HG LEU 15 -11.602 4.117 -6.133 103 HD11 LEU 15 1HD1 LEU 15 -9.955 2.169 -5.930 104 HD12 LEU 15 2HD1 LEU 15 -11.362 1.955 -6.973 105 HD13 LEU 15 3HD1 LEU 15 -11.338 1.233 -5.364 106 HD21 LEU 15 3HD2 LEU 15 -13.580 2.538 -5.815 107 HD22 LEU 15 1HD2 LEU 15 -13.618 4.068 -4.939 108 HD23 LEU 15 2HD2 LEU 15 -13.184 2.579 -4.097 109 H GLY 16 H GLY 16 -8.548 3.845 -5.141 110 HA2 GLY 16 2HA GLY 16 -7.240 5.637 -6.834 111 HA3 GLY 16 1HA GLY 16 -7.169 3.893 -6.967 112 H LYS 17 H LYS 17 -8.846 6.792 -7.979 113 HA LYS 17 HA LYS 17 -9.733 5.379 -10.394 114 HB2 LYS 17 2HB LYS 17 -11.897 6.498 -10.327 115 HB3 LYS 17 1HB LYS 17 -11.665 5.534 -8.876 116 HG2 LYS 17 2HG LYS 17 -10.978 7.614 -7.688 117 HG3 LYS 17 1HG LYS 17 -11.428 8.521 -9.133 118 HD2 LYS 17 2HD LYS 17 -13.587 8.464 -8.585 119 HD3 LYS 17 1HD LYS 17 -13.541 6.717 -8.348 120 HE2 LYS 17 2HE LYS 17 -13.424 6.913 -6.122 121 HE3 LYS 17 1HE LYS 17 -12.221 8.199 -6.212 122 HZ1 LYS 17 3HZ LYS 17 -13.897 9.444 -5.431 123 HZ2 LYS 17 1HZ LYS 17 -15.099 8.374 -5.953 124 HZ3 LYS 17 2HZ LYS 17 -14.417 9.475 -7.038 125 H GLY 18 H GLY 18 -9.633 6.564 -12.265 126 HA2 GLY 18 2HA GLY 18 -9.545 8.634 -13.478 127 HA3 GLY 18 1HA GLY 18 -8.879 9.404 -12.034 128 H PHE 19 H PHE 19 -6.776 7.995 -11.315 129 HA PHE 19 HA PHE 19 -4.950 8.359 -13.546 130 HB2 PHE 19 2HB PHE 19 -3.203 7.854 -11.739 131 HB3 PHE 19 1HB PHE 19 -4.138 9.343 -11.563 132 HD1 PHE 19 2HD PHE 19 -3.598 5.953 -10.265 133 HD2 PHE 19 1HD PHE 19 -5.686 9.628 -9.763 134 HE1 PHE 19 2HE PHE 19 -4.265 5.264 -7.998 135 HE2 PHE 19 1HE PHE 19 -6.354 8.944 -7.496 136 HZ PHE 19 HZ PHE 19 -5.642 6.760 -6.612 137 H GLY 20 H GLY 20 -6.356 5.802 -11.653 138 HA2 GLY 20 2HA GLY 20 -4.936 3.854 -13.356 139 HA3 GLY 20 1HA GLY 20 -5.101 3.589 -11.619 140 H ASP 21 H ASP 21 -6.911 2.650 -10.847 141 HA ASP 21 HA ASP 21 -9.484 2.765 -11.741 142 HB2 ASP 21 2HB ASP 21 -7.848 1.067 -13.481 143 HB3 ASP 21 1HB ASP 21 -9.269 0.234 -12.835 144 H HIS 22 H HIS 22 -7.948 -0.397 -11.470 145 HA HIS 22 HA HIS 22 -8.774 -0.572 -8.659 146 HB2 HIS 22 2HB HIS 22 -9.681 -2.825 -9.038 147 HB3 HIS 22 1HB HIS 22 -10.546 -1.628 -9.998 148 HD1 HIS 22 1HD HIS 22 -8.673 -4.758 -10.265 149 HD2 HIS 22 2HD HIS 22 -9.821 -1.681 -12.811 150 HE1 HIS 22 1HE HIS 22 -8.390 -5.669 -12.591 151 HE2 HIS 22 2HE HIS 22 -9.009 -3.761 -14.116 152 H ILE 23 H ILE 23 -6.760 -0.623 -7.795 153 HA ILE 23 HA ILE 23 -5.134 -2.962 -8.338 154 HB ILE 23 HB ILE 23 -4.269 -0.162 -8.961 155 HG12 ILE 23 2HG1 ILE 23 -3.147 -1.866 -10.796 156 HG13 ILE 23 1HG1 ILE 23 -4.671 -2.666 -10.425 157 HG21 ILE 23 1HG2 ILE 23 -2.681 -2.091 -7.578 158 HG22 ILE 23 2HG2 ILE 23 -2.291 -0.450 -8.086 159 HG23 ILE 23 3HG2 ILE 23 -2.011 -1.797 -9.186 160 HD11 ILE 23 3HD1 ILE 23 -4.322 -0.673 -12.254 161 HD12 ILE 23 1HD1 ILE 23 -4.935 0.204 -10.850 162 HD13 ILE 23 2HD1 ILE 23 -5.860 -1.137 -11.528 163 H HIS 24 H HIS 24 -3.882 0.028 -6.920 164 HA HIS 24 HA HIS 24 -3.479 -1.404 -4.450 165 HB2 HIS 24 2HB HIS 24 -2.686 1.456 -4.668 166 HB3 HIS 24 1HB HIS 24 -1.855 0.122 -3.870 167 HD1 HIS 24 1HD HIS 24 -1.040 -1.753 -5.944 168 HD2 HIS 24 2HD HIS 24 -1.186 2.326 -6.709 169 HE1 HIS 24 1HE HIS 24 0.557 -1.369 -7.844 170 HE2 HIS 24 2HE HIS 24 0.551 1.124 -8.196 171 H TRP 25 H TRP 25 -6.114 -0.784 -5.167 172 HA TRP 25 HA TRP 25 -6.976 0.536 -2.746 173 HB2 TRP 25 2HB TRP 25 -8.658 1.751 -4.502 174 HB3 TRP 25 1HB TRP 25 -7.186 2.490 -3.864 175 HD1 TRP 25 HD TRP 25 -8.672 1.082 -7.048 176 HE1 TRP 25 1HE TRP 25 -7.051 1.518 -8.987 177 HE3 TRP 25 3HE TRP 25 -4.627 2.781 -4.434 178 HZ2 TRP 25 2HZ TRP 25 -4.443 2.465 -9.391 179 HZ3 TRP 25 3HZ TRP 25 -2.622 3.430 -5.664 180 HH2 TRP 25 HH TRP 25 -2.519 3.278 -8.099 181 H ARG 26 H ARG 26 -7.007 -2.065 -4.369 182 HA ARG 26 HA ARG 26 -9.437 -2.757 -5.343 183 HB2 ARG 26 2HB ARG 26 -7.145 -4.125 -4.472 184 HB3 ARG 26 1HB ARG 26 -8.492 -4.872 -3.602 185 HG2 ARG 26 2HG ARG 26 -8.623 -4.436 -6.563 186 HG3 ARG 26 1HG ARG 26 -7.793 -5.836 -5.881 187 HD2 ARG 26 2HD ARG 26 -10.658 -5.081 -5.306 188 HD3 ARG 26 1HD ARG 26 -10.151 -6.293 -6.493 189 HE ARG 26 HE ARG 26 -9.137 -6.757 -3.838 190 HH11 ARG 26 1HH1 ARG 26 -11.807 -7.290 -6.023 191 HH12 ARG 26 2HH1 ARG 26 -12.371 -8.699 -5.190 192 HH21 ARG 26 1HH2 ARG 26 -9.877 -8.611 -2.742 193 HH22 ARG 26 2HH2 ARG 26 -11.277 -9.450 -3.327 194 H THR 27 H THR 27 -8.453 -2.775 -1.932 195 HA THR 27 HA THR 27 -10.740 -1.822 -0.801 196 HB THR 27 HB THR 27 -11.564 -4.300 0.010 197 HG1 THR 27 1HG THR 27 -11.799 -5.511 -1.923 198 HG21 THR 27 3HG2 THR 27 -13.397 -3.165 -0.532 199 HG22 THR 27 1HG2 THR 27 -13.210 -3.905 -2.122 200 HG23 THR 27 2HG2 THR 27 -12.585 -2.282 -1.826 201 H LEU 28 H LEU 28 -10.680 -1.796 1.426 202 HA LEU 28 HA LEU 28 -8.214 -2.799 2.602 203 HB2 LEU 28 2HB LEU 28 -8.983 -0.441 2.944 204 HB3 LEU 28 1HB LEU 28 -10.353 -1.074 3.855 205 HG LEU 28 HG LEU 28 -7.559 -1.766 4.690 206 HD11 LEU 28 1HD1 LEU 28 -8.887 0.871 4.875 207 HD12 LEU 28 2HD1 LEU 28 -7.173 0.463 4.812 208 HD13 LEU 28 3HD1 LEU 28 -8.067 0.279 6.320 209 HD21 LEU 28 3HD2 LEU 28 -8.776 -1.644 6.940 210 HD22 LEU 28 1HD2 LEU 28 -9.165 -2.989 5.867 211 HD23 LEU 28 2HD2 LEU 28 -10.260 -1.611 5.987 212 H GLU 29 H GLU 29 -11.702 -2.890 3.291 213 HA GLU 29 HA GLU 29 -11.385 -4.920 5.304 214 HB2 GLU 29 2HB GLU 29 -13.576 -3.279 4.230 215 HB3 GLU 29 1HB GLU 29 -14.060 -4.901 4.712 216 HG2 GLU 29 2HG GLU 29 -12.980 -4.471 6.926 217 HG3 GLU 29 1HG GLU 29 -12.755 -2.798 6.418 218 H ASP 30 H ASP 30 -12.393 -4.767 1.934 219 HA ASP 30 HA ASP 30 -13.078 -7.566 1.829 220 HB2 ASP 30 2HB ASP 30 -13.257 -5.247 0.031 221 HB3 ASP 30 1HB ASP 30 -12.861 -6.764 -0.791 222 H GLY 31 H GLY 31 -10.351 -5.520 0.958 223 HA2 GLY 31 2HA GLY 31 -8.916 -7.436 -0.548 224 HA3 GLY 31 1HA GLY 31 -8.221 -6.027 0.263 225 H LYS 32 H LYS 32 -9.144 -6.812 2.901 226 HA LYS 32 HA LYS 32 -6.943 -8.484 3.624 227 HB2 LYS 32 2HB LYS 32 -7.714 -6.684 5.095 228 HB3 LYS 32 1HB LYS 32 -9.271 -7.480 5.274 229 HG2 LYS 32 2HG LYS 32 -8.238 -9.335 6.422 230 HG3 LYS 32 1HG LYS 32 -6.638 -8.643 6.157 231 HD2 LYS 32 2HD LYS 32 -7.098 -6.810 7.596 232 HD3 LYS 32 1HD LYS 32 -8.814 -7.213 7.668 233 HE2 LYS 32 2HE LYS 32 -7.418 -9.505 8.516 234 HE3 LYS 32 1HE LYS 32 -6.662 -8.132 9.324 235 HZ1 LYS 32 3HZ LYS 32 -9.568 -8.164 9.308 236 HZ2 LYS 32 1HZ LYS 32 -8.494 -7.725 10.541 237 HZ3 LYS 32 2HZ LYS 32 -8.824 -9.357 10.248 238 H LYS 33 H LYS 33 -10.462 -8.901 3.537 239 HA LYS 33 HA LYS 33 -10.584 -11.470 4.628 240 HB2 LYS 33 2HB LYS 33 -12.502 -9.860 4.086 241 HB3 LYS 33 1HB LYS 33 -12.418 -10.493 2.447 242 HG2 LYS 33 2HG LYS 33 -12.515 -12.777 3.963 243 HG3 LYS 33 1HG LYS 33 -13.566 -11.664 4.856 244 HD2 LYS 33 2HD LYS 33 -15.184 -12.073 3.385 245 HD3 LYS 33 1HD LYS 33 -14.187 -11.350 2.121 246 HE2 LYS 33 2HE LYS 33 -13.048 -13.703 2.087 247 HE3 LYS 33 1HE LYS 33 -14.554 -14.223 2.843 248 HZ1 LYS 33 3HZ LYS 33 -14.791 -12.549 0.471 249 HZ2 LYS 33 1HZ LYS 33 -15.728 -13.871 0.962 250 HZ3 LYS 33 2HZ LYS 33 -14.226 -14.124 0.227 251 H GLU 34 H GLU 34 -10.170 -10.406 1.277 252 HA GLU 34 HA GLU 34 -10.056 -13.092 0.256 253 HB2 GLU 34 2HB GLU 34 -10.799 -10.938 -0.979 254 HB3 GLU 34 1HB GLU 34 -9.074 -10.659 -1.213 255 HG2 GLU 34 2HG GLU 34 -9.016 -12.073 -2.912 256 HG3 GLU 34 1HG GLU 34 -9.741 -13.357 -1.929 257 H ALA 35 H ALA 35 -7.760 -10.592 1.167 258 HA ALA 35 HA ALA 35 -5.423 -11.685 0.105 259 HB1 ALA 35 1HB ALA 35 -5.919 -9.965 2.521 260 HB2 ALA 35 2HB ALA 35 -5.309 -9.484 0.938 261 HB3 ALA 35 3HB ALA 35 -4.296 -10.442 2.021 262 H ALA 36 H ALA 36 -7.292 -12.569 2.900 263 HA ALA 36 HA ALA 36 -5.308 -14.104 4.228 264 HB1 ALA 36 1HB ALA 36 -8.318 -14.217 4.382 265 HB2 ALA 36 2HB ALA 36 -7.237 -13.300 5.432 266 HB3 ALA 36 3HB ALA 36 -7.220 -15.063 5.474 267 H ALA 37 H ALA 37 -7.761 -14.852 1.803 268 HA ALA 37 HA ALA 37 -7.681 -17.621 1.835 269 HB1 ALA 37 1HB ALA 37 -7.943 -17.035 -0.841 270 HB2 ALA 37 2HB ALA 37 -8.498 -15.559 -0.052 271 HB3 ALA 37 3HB ALA 37 -9.255 -17.104 0.336 272 H SER 38 H SER 38 -6.066 -15.797 -0.752 273 HA SER 38 HA SER 38 -4.195 -17.888 -1.233 274 HB2 SER 38 2HB SER 38 -5.107 -15.815 -2.727 275 HB3 SER 38 1HB SER 38 -3.536 -15.173 -2.219 276 HG SER 38 HG SER 38 -4.110 -17.490 -3.724 277 H GLY 39 H GLY 39 -4.231 -15.066 0.780 278 HA2 GLY 39 2HA GLY 39 -2.813 -14.680 2.599 279 HA3 GLY 39 1HA GLY 39 -1.688 -15.875 1.947 280 H LEU 40 H LEU 40 -2.911 -13.376 -0.136 281 HA LEU 40 HA LEU 40 -0.239 -12.399 -0.537 282 HB2 LEU 40 2HB LEU 40 -1.270 -10.905 -2.204 283 HB3 LEU 40 1HB LEU 40 -1.644 -12.594 -2.461 284 HG LEU 40 HG LEU 40 -3.846 -12.065 -1.213 285 HD11 LEU 40 1HD1 LEU 40 -2.617 -9.524 -1.142 286 HD12 LEU 40 2HD1 LEU 40 -4.214 -9.987 -0.557 287 HD13 LEU 40 3HD1 LEU 40 -4.013 -9.418 -2.213 288 HD21 LEU 40 3HD2 LEU 40 -3.158 -12.207 -3.855 289 HD22 LEU 40 1HD2 LEU 40 -3.992 -10.655 -3.762 290 HD23 LEU 40 2HD2 LEU 40 -4.805 -12.129 -3.230 291 HA PRO 41 HA PRO 41 -0.254 -9.180 2.475 292 HB2 PRO 41 2HB PRO 41 1.564 -7.493 1.361 293 HB3 PRO 41 1HB PRO 41 2.001 -9.024 2.132 294 HG2 PRO 41 2HG PRO 41 1.594 -8.424 -0.781 295 HG3 PRO 41 1HG PRO 41 2.914 -9.316 -0.001 296 HD2 PRO 41 2HD PRO 41 0.893 -10.598 -1.193 297 HD3 PRO 41 1HD PRO 41 1.618 -11.216 0.306 298 H LEU 42 H LEU 42 -0.233 -6.709 2.628 299 HA LEU 42 HA LEU 42 -2.119 -5.572 0.674 300 HB2 LEU 42 2HB LEU 42 -2.195 -5.704 3.619 301 HB3 LEU 42 1HB LEU 42 -2.603 -4.144 2.933 302 HG LEU 42 HG LEU 42 -4.559 -5.618 3.388 303 HD11 LEU 42 1HD1 LEU 42 -3.912 -4.332 0.825 304 HD12 LEU 42 2HD1 LEU 42 -5.271 -4.072 1.918 305 HD13 LEU 42 3HD1 LEU 42 -5.292 -5.432 0.796 306 HD21 LEU 42 3HD2 LEU 42 -4.153 -7.208 0.972 307 HD22 LEU 42 1HD2 LEU 42 -4.775 -7.682 2.552 308 HD23 LEU 42 2HD2 LEU 42 -3.035 -7.596 2.276 309 H MET 43 H MET 43 -1.341 -3.855 -0.369 310 HA MET 43 HA MET 43 0.964 -2.440 0.805 311 HB2 MET 43 2HB MET 43 1.353 -3.411 -1.387 312 HB3 MET 43 1HB MET 43 -0.038 -2.541 -2.042 313 HG2 MET 43 2HG MET 43 1.416 -0.491 -1.050 314 HG3 MET 43 1HG MET 43 2.694 -1.616 -1.494 315 HE1 MET 43 3HE MET 43 2.726 -2.520 -4.560 316 HE2 MET 43 1HE MET 43 1.053 -2.431 -5.105 317 HE3 MET 43 2HE MET 43 1.438 -3.205 -3.569 318 H VAL 44 H VAL 44 -0.339 -1.078 2.213 319 HA VAL 44 HA VAL 44 -2.450 0.523 1.471 320 HB VAL 44 HB VAL 44 -0.290 0.862 3.503 321 HG11 VAL 44 1HG1 VAL 44 -2.291 2.998 2.781 322 HG12 VAL 44 2HG1 VAL 44 -0.533 3.135 2.780 323 HG13 VAL 44 3HG1 VAL 44 -1.401 2.946 4.303 324 HG21 VAL 44 3HG2 VAL 44 -3.298 0.768 3.661 325 HG22 VAL 44 1HG2 VAL 44 -2.175 0.771 5.028 326 HG23 VAL 44 2HG2 VAL 44 -2.201 -0.595 3.913 327 H ILE 45 H ILE 45 -2.632 2.700 0.856 328 HA ILE 45 HA ILE 45 -0.385 4.126 -0.232 329 HB ILE 45 HB ILE 45 -2.565 3.122 -2.071 330 HG12 ILE 45 2HG1 ILE 45 0.362 2.519 -1.754 331 HG13 ILE 45 1HG1 ILE 45 -0.994 1.399 -1.909 332 HG21 ILE 45 1HG2 ILE 45 -1.187 5.568 -2.197 333 HG22 ILE 45 2HG2 ILE 45 -2.191 4.831 -3.444 334 HG23 ILE 45 3HG2 ILE 45 -0.457 4.534 -3.420 335 HD11 ILE 45 3HD1 ILE 45 -0.161 1.149 -3.979 336 HD12 ILE 45 1HD1 ILE 45 0.620 2.728 -3.978 337 HD13 ILE 45 2HD1 ILE 45 -1.107 2.601 -4.308 338 H ILE 46 H ILE 46 -0.768 6.303 -0.178 339 HA ILE 46 HA ILE 46 -3.554 7.180 0.090 340 HB ILE 46 HB ILE 46 -1.425 8.257 1.914 341 HG12 ILE 46 2HG1 ILE 46 -3.449 6.210 2.779 342 HG13 ILE 46 1HG1 ILE 46 -1.887 5.712 2.133 343 HG21 ILE 46 1HG2 ILE 46 -4.428 8.230 2.177 344 HG22 ILE 46 2HG2 ILE 46 -3.504 9.567 1.493 345 HG23 ILE 46 3HG2 ILE 46 -3.275 9.109 3.181 346 HD11 ILE 46 3HD1 ILE 46 -1.006 5.966 4.138 347 HD12 ILE 46 1HD1 ILE 46 -2.554 6.533 4.764 348 HD13 ILE 46 2HD1 ILE 46 -1.399 7.684 4.091 349 H HIS 47 H HIS 47 -4.001 9.135 -0.806 350 HA HIS 47 HA HIS 47 -1.711 10.569 -2.001 351 HB2 HIS 47 2HB HIS 47 -3.265 11.185 -3.865 352 HB3 HIS 47 1HB HIS 47 -2.903 9.455 -3.766 353 HD1 HIS 47 1HD HIS 47 -5.654 11.707 -4.158 354 HD2 HIS 47 2HD HIS 47 -5.102 8.044 -2.279 355 HE1 HIS 47 1HE HIS 47 -7.962 10.758 -3.848 356 HE2 HIS 47 2HE HIS 47 -7.596 8.499 -2.792 357 H LYS 48 H LYS 48 -1.520 12.170 -0.444 358 HA LYS 48 HA LYS 48 -3.900 13.914 -0.173 359 HB2 LYS 48 2HB LYS 48 -2.148 12.809 1.810 360 HB3 LYS 48 1HB LYS 48 -2.080 14.561 1.872 361 HG2 LYS 48 2HG LYS 48 -4.758 13.306 1.713 362 HG3 LYS 48 1HG LYS 48 -3.870 13.164 3.233 363 HD2 LYS 48 2HD LYS 48 -4.944 15.144 3.611 364 HD3 LYS 48 1HD LYS 48 -3.486 15.754 2.828 365 HE2 LYS 48 2HE LYS 48 -5.111 15.237 0.692 366 HE3 LYS 48 1HE LYS 48 -6.267 15.770 1.911 367 HZ1 LYS 48 3HZ LYS 48 -3.808 17.309 1.361 368 HZ2 LYS 48 1HZ LYS 48 -5.242 17.833 2.091 369 HZ3 LYS 48 2HZ LYS 48 -5.201 17.528 0.428 370 H SER 49 H SER 49 -3.664 16.132 -0.362 371 HA SER 49 HA SER 49 -2.858 18.051 -1.287 372 HB2 SER 49 2HB SER 49 -0.724 16.994 0.431 373 HB3 SER 49 1HB SER 49 -0.151 18.114 -0.804 374 HG SER 49 HG SER 49 -1.376 19.699 0.042 375 H TRP 50 H TRP 50 -0.610 18.811 -2.585 376 HA TRP 50 HA TRP 50 -0.892 17.700 -5.130 377 HB2 TRP 50 2HB TRP 50 1.169 18.939 -5.709 378 HB3 TRP 50 1HB TRP 50 0.030 19.934 -4.790 379 HD1 TRP 50 HD TRP 50 0.665 20.264 -2.107 380 HE1 TRP 50 1HE TRP 50 2.981 20.466 -1.005 381 HE3 TRP 50 3HE TRP 50 3.517 18.243 -5.836 382 HZ2 TRP 50 2HZ TRP 50 5.664 19.850 -1.632 383 HZ3 TRP 50 3HZ TRP 50 5.950 18.086 -5.506 384 HH2 TRP 50 HH TRP 50 7.000 18.874 -3.448 385 H CYS 51 H CYS 51 -0.759 15.447 -4.920 386 HA CYS 51 HA CYS 51 1.785 14.296 -4.085 387 HB2 CYS 51 2HB CYS 51 0.578 12.123 -4.339 388 HB3 CYS 51 1HB CYS 51 -0.183 13.226 -3.197 389 H GLY 52 H GLY 52 3.329 14.254 -5.630 390 HA2 GLY 52 2HA GLY 52 2.822 14.276 -8.414 391 HA3 GLY 52 1HA GLY 52 4.363 13.859 -7.657 392 H ALA 53 H ALA 53 2.999 11.718 -6.082 393 HA ALA 53 HA ALA 53 3.504 9.553 -7.815 394 HB1 ALA 53 1HB ALA 53 3.246 8.245 -5.989 395 HB2 ALA 53 2HB ALA 53 1.770 9.066 -5.478 396 HB3 ALA 53 3HB ALA 53 3.345 9.790 -5.144 397 H CYS 54 H CYS 54 0.808 11.574 -7.502 398 HA CYS 54 HA CYS 54 -0.942 9.568 -8.720 399 HB2 CYS 54 2HB CYS 54 -1.957 12.242 -7.833 400 HB3 CYS 54 1HB CYS 54 -2.779 10.675 -7.847 401 H LYS 55 H LYS 55 0.719 12.551 -9.252 402 HA LYS 55 HA LYS 55 -0.760 13.420 -11.520 403 HB2 LYS 55 2HB LYS 55 1.562 14.294 -10.017 404 HB3 LYS 55 1HB LYS 55 1.806 14.492 -11.746 405 HG2 LYS 55 2HG LYS 55 -0.153 15.857 -11.936 406 HG3 LYS 55 1HG LYS 55 -0.593 15.531 -10.248 407 HD2 LYS 55 2HD LYS 55 1.810 16.527 -9.798 408 HD3 LYS 55 1HD LYS 55 1.539 17.295 -11.363 409 HE2 LYS 55 2HE LYS 55 -0.722 17.460 -9.494 410 HE3 LYS 55 1HE LYS 55 0.731 18.311 -8.972 411 HZ1 LYS 55 3HZ LYS 55 -0.653 19.781 -10.243 412 HZ2 LYS 55 1HZ LYS 55 -0.712 18.695 -11.540 413 HZ3 LYS 55 2HZ LYS 55 0.746 19.451 -11.135 414 H ALA 56 H ALA 56 2.419 11.788 -11.208 415 HA ALA 56 HA ALA 56 2.695 11.479 -14.042 416 HB1 ALA 56 1HB ALA 56 4.768 11.435 -13.132 417 HB2 ALA 56 2HB ALA 56 4.455 9.700 -13.101 418 HB3 ALA 56 3HB ALA 56 4.220 10.665 -11.643 419 H LEU 57 H LEU 57 1.581 9.425 -11.415 420 HA LEU 57 HA LEU 57 1.425 7.019 -12.838 421 HB2 LEU 57 2HB LEU 57 -0.049 8.071 -10.442 422 HB3 LEU 57 1HB LEU 57 -0.390 6.483 -11.101 423 HG LEU 57 HG LEU 57 1.218 6.601 -9.127 424 HD11 LEU 57 1HD1 LEU 57 2.626 4.825 -9.998 425 HD12 LEU 57 2HD1 LEU 57 2.157 5.245 -11.644 426 HD13 LEU 57 3HD1 LEU 57 0.954 4.619 -10.516 427 HD21 LEU 57 3HD2 LEU 57 3.170 7.469 -11.252 428 HD22 LEU 57 1HD2 LEU 57 3.501 7.171 -9.546 429 HD23 LEU 57 2HD2 LEU 57 2.506 8.544 -10.022 430 H LYS 58 H LYS 58 -0.664 9.815 -12.825 431 HA LYS 58 HA LYS 58 -3.050 8.746 -13.677 432 HB2 LYS 58 2HB LYS 58 -1.716 11.349 -13.949 433 HB3 LYS 58 1HB LYS 58 -2.935 11.027 -15.173 434 HG2 LYS 58 2HG LYS 58 -4.474 10.417 -13.230 435 HG3 LYS 58 1HG LYS 58 -3.270 11.196 -12.201 436 HD2 LYS 58 2HD LYS 58 -4.580 12.525 -14.570 437 HD3 LYS 58 1HD LYS 58 -5.153 12.684 -12.908 438 HE2 LYS 58 2HE LYS 58 -3.213 13.819 -12.234 439 HE3 LYS 58 1HE LYS 58 -2.321 13.323 -13.671 440 HZ1 LYS 58 3HZ LYS 58 -2.847 15.475 -14.184 441 HZ2 LYS 58 1HZ LYS 58 -4.330 15.443 -13.369 442 HZ3 LYS 58 2HZ LYS 58 -4.172 14.680 -14.870 443 HA PRO 59 HA PRO 59 -1.902 8.833 -18.309 444 HB2 PRO 59 2HB PRO 59 0.459 9.812 -19.143 445 HB3 PRO 59 1HB PRO 59 -0.929 10.860 -18.788 446 HG2 PRO 59 2HG PRO 59 1.445 10.214 -17.070 447 HG3 PRO 59 1HG PRO 59 0.691 11.786 -17.390 448 HD2 PRO 59 2HD PRO 59 0.198 10.355 -15.136 449 HD3 PRO 59 1HD PRO 59 -1.012 11.424 -15.888 450 H LYS 60 H LYS 60 0.735 7.955 -16.147 451 HA LYS 60 HA LYS 60 1.646 5.941 -18.065 452 HB2 LYS 60 2HB LYS 60 3.591 5.667 -16.740 453 HB3 LYS 60 1HB LYS 60 3.287 7.399 -16.820 454 HG2 LYS 60 2HG LYS 60 1.992 6.968 -14.611 455 HG3 LYS 60 1HG LYS 60 2.999 5.528 -14.522 456 HD2 LYS 60 2HD LYS 60 3.867 8.414 -14.594 457 HD3 LYS 60 1HD LYS 60 4.156 7.223 -13.329 458 HE2 LYS 60 2HE LYS 60 5.355 7.271 -16.096 459 HE3 LYS 60 1HE LYS 60 6.190 7.581 -14.575 460 HZ1 LYS 60 3HZ LYS 60 6.377 5.274 -15.680 461 HZ2 LYS 60 1HZ LYS 60 4.849 4.996 -15.011 462 HZ3 LYS 60 2HZ LYS 60 6.158 5.366 -14.006 463 H PHE 61 H PHE 61 0.534 6.093 -14.663 464 HA PHE 61 HA PHE 61 0.459 3.306 -14.313 465 HB2 PHE 61 2HB PHE 61 0.341 4.957 -12.438 466 HB3 PHE 61 1HB PHE 61 -1.311 5.324 -12.931 467 HD1 PHE 61 1HD PHE 61 0.880 2.817 -11.418 468 HD2 PHE 61 2HD PHE 61 -3.104 3.770 -12.557 469 HE1 PHE 61 1HE PHE 61 0.049 0.933 -10.073 470 HE2 PHE 61 2HE PHE 61 -3.944 1.891 -11.212 471 HZ PHE 61 HZ PHE 61 -2.366 0.470 -9.969 472 H ALA 62 H ALA 62 -1.513 5.480 -16.093 473 HA ALA 62 HA ALA 62 -3.929 4.061 -16.142 474 HB1 ALA 62 1HB ALA 62 -2.670 6.164 -17.676 475 HB2 ALA 62 2HB ALA 62 -4.385 5.849 -17.408 476 HB3 ALA 62 3HB ALA 62 -3.538 5.048 -18.731 477 H GLU 63 H GLU 63 -0.802 3.424 -17.282 478 HA GLU 63 HA GLU 63 -1.322 1.473 -19.295 479 HB2 GLU 63 2HB GLU 63 0.789 2.901 -18.958 480 HB3 GLU 63 1HB GLU 63 1.196 1.780 -17.656 481 HG2 GLU 63 2HG GLU 63 2.320 0.755 -19.322 482 HG3 GLU 63 1HG GLU 63 0.748 0.004 -19.597 483 H SER 64 H SER 64 -1.533 1.499 -15.945 484 HA SER 64 HA SER 64 -0.672 -0.990 -15.140 485 HB2 SER 64 2HB SER 64 -2.872 0.805 -14.198 486 HB3 SER 64 1HB SER 64 -2.565 -0.731 -13.410 487 HG SER 64 HG SER 64 -0.758 1.435 -13.708 488 H THR 65 H THR 65 -2.786 -0.592 -17.612 489 HA THR 65 HA THR 65 -4.966 -2.199 -17.181 490 HB THR 65 HB THR 65 -4.367 -3.015 -19.657 491 HG1 THR 65 1HG THR 65 -3.080 -1.406 -20.659 492 HG21 THR 65 3HG2 THR 65 -4.976 -0.108 -19.300 493 HG22 THR 65 1HG2 THR 65 -6.154 -1.361 -18.914 494 HG23 THR 65 2HG2 THR 65 -5.531 -1.210 -20.558 495 H GLU 66 H GLU 66 -1.613 -3.076 -17.689 496 HA GLU 66 HA GLU 66 -2.134 -5.907 -17.618 497 HB2 GLU 66 2HB GLU 66 0.323 -6.150 -17.591 498 HB3 GLU 66 1HB GLU 66 -0.220 -5.109 -18.910 499 HG2 GLU 66 2HG GLU 66 0.338 -3.600 -16.517 500 HG3 GLU 66 1HG GLU 66 1.734 -4.546 -17.030 501 H ILE 67 H ILE 67 -1.244 -3.328 -15.440 502 HA ILE 67 HA ILE 67 -0.520 -5.044 -13.266 503 HB ILE 67 HB ILE 67 -1.435 -2.165 -13.205 504 HG12 ILE 67 2HG1 ILE 67 1.324 -3.403 -13.300 505 HG13 ILE 67 1HG1 ILE 67 0.575 -2.385 -14.535 506 HG21 ILE 67 1HG2 ILE 67 -0.077 -3.844 -11.106 507 HG22 ILE 67 2HG2 ILE 67 -1.705 -3.173 -11.033 508 HG23 ILE 67 3HG2 ILE 67 -0.306 -2.098 -11.004 509 HD11 ILE 67 3HD1 ILE 67 0.476 -0.730 -12.408 510 HD12 ILE 67 1HD1 ILE 67 1.805 -0.780 -13.566 511 HD13 ILE 67 2HD1 ILE 67 1.934 -1.650 -12.036 512 H SER 68 H SER 68 -3.460 -4.255 -14.750 513 HA SER 68 HA SER 68 -5.188 -4.354 -12.495 514 HB2 SER 68 2HB SER 68 -6.963 -4.402 -14.043 515 HB3 SER 68 1HB SER 68 -5.696 -3.516 -14.891 516 HG SER 68 HG SER 68 -5.711 -5.019 -16.346 517 H GLU 69 H GLU 69 -3.752 -6.743 -14.606 518 HA GLU 69 HA GLU 69 -5.215 -8.896 -13.285 519 HB2 GLU 69 2HB GLU 69 -3.265 -9.049 -15.588 520 HB3 GLU 69 1HB GLU 69 -4.278 -10.358 -14.997 521 HG2 GLU 69 2HG GLU 69 -5.181 -7.828 -16.348 522 HG3 GLU 69 1HG GLU 69 -5.245 -9.468 -16.992 523 H LEU 70 H LEU 70 -2.009 -7.570 -13.671 524 HA LEU 70 HA LEU 70 -0.438 -9.556 -12.533 525 HB2 LEU 70 2HB LEU 70 -0.183 -6.837 -13.266 526 HB3 LEU 70 1HB LEU 70 0.416 -6.973 -11.614 527 HG LEU 70 HG LEU 70 1.390 -8.877 -13.709 528 HD11 LEU 70 1HD1 LEU 70 3.107 -7.329 -14.355 529 HD12 LEU 70 2HD1 LEU 70 2.500 -6.126 -13.217 530 HD13 LEU 70 3HD1 LEU 70 1.532 -6.574 -14.623 531 HD21 LEU 70 3HD2 LEU 70 3.409 -7.950 -11.976 532 HD22 LEU 70 1HD2 LEU 70 2.637 -9.536 -11.986 533 HD23 LEU 70 2HD2 LEU 70 1.988 -8.247 -10.972 534 H SER 71 H SER 71 -2.298 -6.982 -11.040 535 HA SER 71 HA SER 71 -1.559 -7.056 -8.429 536 HB2 SER 71 2HB SER 71 -4.023 -6.387 -9.854 537 HB3 SER 71 1HB SER 71 -4.278 -6.879 -8.180 538 HG SER 71 HG SER 71 -2.324 -4.970 -8.905 539 H HIS 72 H HIS 72 -2.915 -9.726 -10.091 540 HA HIS 72 HA HIS 72 -4.362 -11.039 -8.126 541 HB2 HIS 72 2HB HIS 72 -2.988 -11.775 -10.596 542 HB3 HIS 72 1HB HIS 72 -2.942 -13.071 -9.392 543 HD1 HIS 72 1HD HIS 72 -5.103 -14.317 -8.934 544 HD2 HIS 72 2HD HIS 72 -5.602 -11.064 -11.471 545 HE1 HIS 72 1HE HIS 72 -7.437 -14.527 -9.847 546 HE2 HIS 72 2HE HIS 72 -7.749 -12.498 -11.305 547 H ASN 73 H ASN 73 -1.081 -10.208 -8.235 548 HA ASN 73 HA ASN 73 0.054 -12.238 -6.638 549 HB2 ASN 73 2HB ASN 73 0.860 -9.365 -7.143 550 HB3 ASN 73 1HB ASN 73 1.876 -10.576 -6.364 551 HD21 ASN 73 1HD2 ASN 73 1.300 -9.062 -9.200 552 HD22 ASN 73 2HD2 ASN 73 1.868 -10.280 -10.304 553 H PHE 74 H PHE 74 -1.367 -9.092 -5.912 554 HA PHE 74 HA PHE 74 -2.223 -9.860 -3.368 555 HB2 PHE 74 2HB PHE 74 -0.875 -8.328 -1.983 556 HB3 PHE 74 1HB PHE 74 0.084 -9.617 -2.714 557 HD1 PHE 74 1HD PHE 74 0.760 -8.671 -5.328 558 HD2 PHE 74 2HD PHE 74 0.420 -6.483 -1.696 559 HE1 PHE 74 1HE PHE 74 2.342 -7.008 -6.185 560 HE2 PHE 74 2HE PHE 74 1.999 -4.811 -2.554 561 HZ PHE 74 HZ PHE 74 2.958 -5.069 -4.798 562 H VAL 75 H VAL 75 -2.974 -7.727 -2.098 563 HA VAL 75 HA VAL 75 -4.061 -5.902 -4.137 564 HB VAL 75 HB VAL 75 -6.221 -5.931 -3.188 565 HG11 VAL 75 1HG1 VAL 75 -6.873 -7.954 -3.915 566 HG12 VAL 75 2HG1 VAL 75 -5.812 -8.811 -2.797 567 HG13 VAL 75 3HG1 VAL 75 -5.166 -8.165 -4.306 568 HG21 VAL 75 3HG2 VAL 75 -4.842 -7.019 -0.816 569 HG22 VAL 75 1HG2 VAL 75 -6.470 -7.624 -1.115 570 HG23 VAL 75 2HG2 VAL 75 -6.193 -5.893 -0.926 571 H MET 76 H MET 76 -4.216 -3.735 -3.556 572 HA MET 76 HA MET 76 -3.089 -3.136 -0.933 573 HB2 MET 76 2HB MET 76 -2.788 -0.972 -2.793 574 HB3 MET 76 1HB MET 76 -1.595 -1.794 -1.824 575 HG2 MET 76 2HG MET 76 -2.577 -2.707 -4.514 576 HG3 MET 76 1HG MET 76 -1.037 -1.927 -4.175 577 HE1 MET 76 3HE MET 76 -0.298 -5.683 -5.176 578 HE2 MET 76 1HE MET 76 -0.727 -4.102 -5.830 579 HE3 MET 76 2HE MET 76 -1.994 -5.249 -5.391 580 H VAL 77 H VAL 77 -3.515 -0.481 -0.700 581 HA VAL 77 HA VAL 77 -6.389 -0.047 -1.052 582 HB VAL 77 HB VAL 77 -4.952 -0.498 1.501 583 HG11 VAL 77 1HG1 VAL 77 -7.094 0.715 2.529 584 HG12 VAL 77 2HG1 VAL 77 -6.846 1.734 1.112 585 HG13 VAL 77 3HG1 VAL 77 -5.543 1.522 2.291 586 HG21 VAL 77 3HG2 VAL 77 -7.858 -0.930 1.046 587 HG22 VAL 77 1HG2 VAL 77 -6.704 -1.878 1.982 588 HG23 VAL 77 2HG2 VAL 77 -6.693 -1.969 0.219 589 H ASN 78 H ASN 78 -6.874 2.010 -1.549 590 HA ASN 78 HA ASN 78 -4.876 4.094 -0.999 591 HB2 ASN 78 2HB ASN 78 -5.370 3.503 -3.427 592 HB3 ASN 78 1HB ASN 78 -6.944 4.236 -3.177 593 HD21 ASN 78 1HD2 ASN 78 -3.702 5.132 -2.078 594 HD22 ASN 78 2HD2 ASN 78 -3.718 6.721 -2.773 595 H LEU 79 H LEU 79 -5.496 5.431 0.571 596 HA LEU 79 HA LEU 79 -8.357 6.103 0.746 597 HB2 LEU 79 2HB LEU 79 -8.340 6.021 3.041 598 HB3 LEU 79 1HB LEU 79 -7.255 4.708 2.637 599 HG LEU 79 HG LEU 79 -5.387 6.507 2.953 600 HD11 LEU 79 1HD1 LEU 79 -7.785 7.903 3.806 601 HD12 LEU 79 2HD1 LEU 79 -6.168 8.528 3.477 602 HD13 LEU 79 3HD1 LEU 79 -6.548 7.854 5.062 603 HD21 LEU 79 3HD2 LEU 79 -4.966 5.526 4.945 604 HD22 LEU 79 1HD2 LEU 79 -6.286 4.467 4.446 605 HD23 LEU 79 2HD2 LEU 79 -6.599 5.808 5.551 606 H GLU 80 H GLU 80 -8.715 8.236 1.940 607 HA GLU 80 HA GLU 80 -6.670 10.194 1.133 608 HB2 GLU 80 2HB GLU 80 -9.094 9.891 -0.108 609 HB3 GLU 80 1HB GLU 80 -9.450 11.150 1.080 610 HG2 GLU 80 2HG GLU 80 -7.457 12.399 0.207 611 HG3 GLU 80 1HG GLU 80 -7.369 11.199 -1.096 612 H ASP 81 H ASP 81 -7.139 12.396 2.171 613 HA ASP 81 HA ASP 81 -6.753 12.322 4.864 614 HB2 ASP 81 2HB ASP 81 -6.677 14.300 3.156 615 HB3 ASP 81 1HB ASP 81 -8.319 14.602 3.713 616 H GLU 82 H GLU 82 -9.797 12.063 3.198 617 HA GLU 82 HA GLU 82 -11.663 12.828 5.031 618 HB2 GLU 82 2HB GLU 82 -11.570 10.673 2.987 619 HB3 GLU 82 1HB GLU 82 -12.888 10.624 4.150 620 HG2 GLU 82 2HG GLU 82 -13.959 11.989 2.765 621 HG3 GLU 82 1HG GLU 82 -12.879 13.249 3.358 622 H GLU 83 H GLU 83 -9.767 9.848 5.087 623 HA GLU 83 HA GLU 83 -11.144 8.609 7.220 624 HB2 GLU 83 2HB GLU 83 -9.231 7.794 5.500 625 HB3 GLU 83 1HB GLU 83 -8.246 8.073 6.930 626 HG2 GLU 83 2HG GLU 83 -8.798 6.018 7.547 627 HG3 GLU 83 1HG GLU 83 -10.399 6.670 7.916 628 H GLU 84 H GLU 84 -8.035 10.348 7.197 629 HA GLU 84 HA GLU 84 -6.999 11.619 8.763 630 HB2 GLU 84 2HB GLU 84 -9.741 11.978 9.331 631 HB3 GLU 84 1HB GLU 84 -8.947 11.713 10.877 632 HG2 GLU 84 2HG GLU 84 -8.183 13.787 8.834 633 HG3 GLU 84 1HG GLU 84 -9.074 14.077 10.326 634 HA PRO 85 HA PRO 85 -5.971 8.008 11.342 635 HB2 PRO 85 2HB PRO 85 -3.476 7.692 10.558 636 HB3 PRO 85 1HB PRO 85 -4.793 7.349 9.418 637 HG2 PRO 85 2HG PRO 85 -3.064 9.796 9.634 638 HG3 PRO 85 1HG PRO 85 -3.541 8.889 8.185 639 HD2 PRO 85 2HD PRO 85 -4.797 11.182 9.114 640 HD3 PRO 85 1HD PRO 85 -5.524 9.989 8.010 641 H LYS 86 H LYS 86 -3.384 7.852 12.333 642 HA LYS 86 HA LYS 86 -2.426 10.261 13.467 643 HB2 LYS 86 2HB LYS 86 -4.654 9.702 14.723 644 HB3 LYS 86 1HB LYS 86 -3.667 8.483 15.539 645 HG2 LYS 86 2HG LYS 86 -3.669 10.400 16.918 646 HG3 LYS 86 1HG LYS 86 -2.082 10.337 16.148 647 HD2 LYS 86 2HD LYS 86 -4.128 11.863 14.684 648 HD3 LYS 86 1HD LYS 86 -3.649 12.546 16.240 649 HE2 LYS 86 2HE LYS 86 -1.585 13.082 15.513 650 HE3 LYS 86 1HE LYS 86 -1.433 11.615 14.548 651 HZ1 LYS 86 3HZ LYS 86 -1.513 13.293 12.978 652 HZ2 LYS 86 1HZ LYS 86 -2.682 14.184 13.816 653 HZ3 LYS 86 2HZ LYS 86 -3.118 12.760 13.014 654 H ASP 87 H ASP 87 -1.310 8.072 12.092 655 HA ASP 87 HA ASP 87 0.718 7.285 14.012 656 HB2 ASP 87 2HB ASP 87 -1.326 5.532 13.640 657 HB3 ASP 87 1HB ASP 87 -0.202 5.004 12.378 658 H GLU 88 H GLU 88 2.028 5.384 12.461 659 HA GLU 88 HA GLU 88 3.259 7.085 10.483 660 HB2 GLU 88 2HB GLU 88 3.963 4.664 11.958 661 HB3 GLU 88 1HB GLU 88 4.490 4.622 10.281 662 HG2 GLU 88 2HG GLU 88 5.083 6.893 12.159 663 HG3 GLU 88 1HG GLU 88 6.162 5.523 11.898 664 H ASP 89 H ASP 89 0.799 4.747 10.456 665 HA ASP 89 HA ASP 89 1.107 3.340 8.131 666 HB2 ASP 89 2HB ASP 89 -0.921 3.664 9.936 667 HB3 ASP 89 1HB ASP 89 -1.624 4.366 8.473 668 H PHE 90 H PHE 90 0.864 6.742 8.324 669 HA PHE 90 HA PHE 90 0.198 6.885 5.455 670 HB2 PHE 90 2HB PHE 90 -0.264 8.868 7.681 671 HB3 PHE 90 1HB PHE 90 -0.375 9.306 5.972 672 HD1 PHE 90 1HD PHE 90 -1.587 6.431 8.036 673 HD2 PHE 90 2HD PHE 90 -2.531 9.545 5.289 674 HE1 PHE 90 1HE PHE 90 -3.935 5.701 8.020 675 HE2 PHE 90 2HE PHE 90 -4.878 8.821 5.270 676 HZ PHE 90 HZ PHE 90 -5.584 6.902 6.642 677 H SER 91 H SER 91 2.357 7.956 7.996 678 HA SER 91 HA SER 91 3.971 9.549 6.179 679 HB2 SER 91 2HB SER 91 4.290 8.973 9.134 680 HB3 SER 91 1HB SER 91 5.290 10.097 8.197 681 HG SER 91 HG SER 91 3.724 11.340 9.080 682 HA PRO 92 HA PRO 92 7.147 6.421 5.857 683 HB2 PRO 92 2HB PRO 92 9.002 7.923 4.667 684 HB3 PRO 92 1HB PRO 92 7.407 7.712 3.929 685 HG2 PRO 92 2HG PRO 92 8.559 10.095 5.233 686 HG3 PRO 92 1HG PRO 92 7.233 9.987 4.072 687 HD2 PRO 92 2HD PRO 92 7.111 10.120 6.983 688 HD3 PRO 92 1HD PRO 92 5.788 10.259 5.810 689 H ASP 93 H ASP 93 9.688 8.645 6.063 690 HA ASP 93 HA ASP 93 10.314 7.926 8.838 691 HB2 ASP 93 2HB ASP 93 12.665 7.639 8.221 692 HB3 ASP 93 1HB ASP 93 11.645 6.534 7.286 693 H GLY 94 H GLY 94 9.571 10.353 6.811 694 HA2 GLY 94 2HA GLY 94 11.224 12.302 8.287 695 HA3 GLY 94 1HA GLY 94 10.840 12.495 6.570 696 H GLY 95 H GLY 95 8.307 12.210 6.200 697 HA2 GLY 95 2HA GLY 95 6.252 12.635 7.725 698 HA3 GLY 95 1HA GLY 95 7.086 14.159 8.032 699 H TYR 96 H TYR 96 6.119 12.202 5.160 700 HA TYR 96 HA TYR 96 5.544 14.692 3.766 701 HB2 TYR 96 2HB TYR 96 4.946 13.159 1.831 702 HB3 TYR 96 1HB TYR 96 6.632 13.144 2.349 703 HD1 TYR 96 2HD TYR 96 4.194 11.343 4.392 704 HD2 TYR 96 1HD TYR 96 6.916 11.031 1.138 705 HE1 TYR 96 2HE TYR 96 4.120 8.895 4.557 706 HE2 TYR 96 1HE TYR 96 6.832 8.578 1.296 707 HH TYR 96 HH TYR 96 5.523 6.965 3.963 708 H ILE 97 H ILE 97 3.329 14.156 2.229 709 HA ILE 97 HA ILE 97 1.242 13.276 4.056 710 HB ILE 97 HB ILE 97 -0.046 15.406 3.655 711 HG12 ILE 97 2HG1 ILE 97 2.510 16.808 3.171 712 HG13 ILE 97 1HG1 ILE 97 1.854 15.907 1.802 713 HG21 ILE 97 1HG2 ILE 97 0.942 14.993 5.804 714 HG22 ILE 97 2HG2 ILE 97 1.220 16.681 5.374 715 HG23 ILE 97 3HG2 ILE 97 2.526 15.505 5.222 716 HD11 ILE 97 3HD1 ILE 97 0.850 17.889 1.421 717 HD12 ILE 97 1HD1 ILE 97 0.843 18.346 3.126 718 HD13 ILE 97 2HD1 ILE 97 -0.350 17.199 2.516 719 HA PRO 98 HA PRO 98 1.075 10.873 3.193 720 HB2 PRO 98 2HB PRO 98 -1.646 10.296 1.949 721 HB3 PRO 98 1HB PRO 98 -0.884 9.468 3.335 722 HG2 PRO 98 2HG PRO 98 -2.324 11.921 3.334 723 HG3 PRO 98 1HG PRO 98 -1.487 11.129 4.697 724 HD2 PRO 98 2HD PRO 98 -0.533 13.384 3.853 725 HD3 PRO 98 1HD PRO 98 0.598 12.037 4.114 726 H ARG 99 H ARG 99 1.932 8.947 2.324 727 HA ARG 99 HA ARG 99 1.928 8.829 -0.626 728 HB2 ARG 99 2HB ARG 99 4.058 8.927 1.337 729 HB3 ARG 99 1HB ARG 99 4.274 7.625 0.165 730 HG2 ARG 99 2HG ARG 99 5.404 9.555 -0.625 731 HG3 ARG 99 1HG ARG 99 3.983 9.314 -1.638 732 HD2 ARG 99 2HD ARG 99 2.910 10.957 0.151 733 HD3 ARG 99 1HD ARG 99 4.590 11.455 0.333 734 HE ARG 99 HE ARG 99 3.809 11.368 -2.403 735 HH11 ARG 99 1HH1 ARG 99 3.548 13.289 0.494 736 HH12 ARG 99 2HH1 ARG 99 3.395 14.787 -0.361 737 HH21 ARG 99 1HH2 ARG 99 3.610 13.335 -3.532 738 HH22 ARG 99 2HH2 ARG 99 3.430 14.813 -2.647 739 H ILE 100 H ILE 100 3.320 6.501 -1.047 740 HA ILE 100 HA ILE 100 1.296 4.551 -0.305 741 HB ILE 100 HB ILE 100 2.119 3.145 -2.013 742 HG12 ILE 100 2HG1 ILE 100 4.359 4.727 -2.993 743 HG13 ILE 100 1HG1 ILE 100 4.650 4.108 -1.375 744 HG21 ILE 100 1HG2 ILE 100 2.613 5.766 -3.321 745 HG22 ILE 100 2HG2 ILE 100 1.046 5.479 -2.564 746 HG23 ILE 100 3HG2 ILE 100 1.617 4.409 -3.845 747 HD11 ILE 100 3HD1 ILE 100 3.719 1.884 -2.517 748 HD12 ILE 100 1HD1 ILE 100 5.422 2.342 -2.538 749 HD13 ILE 100 2HD1 ILE 100 4.402 2.677 -3.938 750 H LEU 101 H LEU 101 1.529 2.894 1.060 751 HA LEU 101 HA LEU 101 4.186 2.378 2.209 752 HB2 LEU 101 2HB LEU 101 1.584 2.961 3.506 753 HB3 LEU 101 1HB LEU 101 2.657 1.819 4.285 754 HG LEU 101 HG LEU 101 4.321 3.449 4.638 755 HD11 LEU 101 1HD1 LEU 101 4.555 4.633 2.674 756 HD12 LEU 101 2HD1 LEU 101 3.885 5.833 3.773 757 HD13 LEU 101 3HD1 LEU 101 2.840 5.041 2.595 758 HD21 LEU 101 3HD2 LEU 101 3.284 4.730 6.190 759 HD22 LEU 101 1HD2 LEU 101 1.943 3.648 5.823 760 HD23 LEU 101 2HD2 LEU 101 2.014 5.239 5.072 761 H PHE 102 H PHE 102 4.829 0.267 2.228 762 HA PHE 102 HA PHE 102 2.845 -1.750 1.442 763 HB2 PHE 102 2HB PHE 102 5.839 -1.633 1.495 764 HB3 PHE 102 1HB PHE 102 5.035 -3.197 1.468 765 HD1 PHE 102 2HD PHE 102 5.187 0.044 -0.350 766 HD2 PHE 102 1HD PHE 102 4.415 -4.137 -0.551 767 HE1 PHE 102 2HE PHE 102 5.007 0.197 -2.799 768 HE2 PHE 102 1HE PHE 102 4.240 -3.991 -3.001 769 HZ PHE 102 HZ PHE 102 4.534 -1.820 -4.128 770 H LEU 103 H LEU 103 2.307 -3.539 2.760 771 HA LEU 103 HA LEU 103 3.685 -3.925 5.266 772 HB2 LEU 103 2HB LEU 103 1.279 -3.750 6.402 773 HB3 LEU 103 1HB LEU 103 2.427 -2.438 6.347 774 HG LEU 103 HG LEU 103 0.540 -2.602 4.098 775 HD11 LEU 103 1HD1 LEU 103 -0.361 -1.825 6.840 776 HD12 LEU 103 2HD1 LEU 103 -0.948 -3.177 5.874 777 HD13 LEU 103 3HD1 LEU 103 -1.251 -1.521 5.351 778 HD21 LEU 103 3HD2 LEU 103 2.354 -0.774 4.914 779 HD22 LEU 103 1HD2 LEU 103 0.868 -0.124 5.607 780 HD23 LEU 103 2HD2 LEU 103 0.979 -0.425 3.874 781 H ASP 104 H ASP 104 2.170 -5.423 6.725 782 HA ASP 104 HA ASP 104 1.990 -7.878 5.270 783 HB2 ASP 104 2HB ASP 104 1.861 -7.015 8.071 784 HB3 ASP 104 1HB ASP 104 0.803 -8.385 7.702 785 HA PRO 105 HA PRO 105 -2.197 -8.020 3.949 786 HB2 PRO 105 2HB PRO 105 -2.839 -10.629 4.631 787 HB3 PRO 105 1HB PRO 105 -1.994 -10.134 3.155 788 HG2 PRO 105 2HG PRO 105 -0.895 -11.241 5.698 789 HG3 PRO 105 1HG PRO 105 -0.371 -11.522 4.022 790 HD2 PRO 105 2HD PRO 105 0.969 -9.887 5.703 791 HD3 PRO 105 1HD PRO 105 0.876 -9.582 3.957 792 H SER 106 H SER 106 -3.167 -6.614 5.372 793 HA SER 106 HA SER 106 -5.340 -7.270 6.779 794 HB2 SER 106 2HB SER 106 -4.623 -7.222 9.206 795 HB3 SER 106 1HB SER 106 -4.172 -8.695 8.334 796 HG SER 106 HG SER 106 -2.100 -7.428 7.968 797 H GLY 107 H GLY 107 -2.514 -5.293 6.577 798 HA2 GLY 107 2HA GLY 107 -2.842 -2.917 6.159 799 HA3 GLY 107 1HA GLY 107 -4.134 -2.954 7.365 800 H LYS 108 H LYS 108 -0.859 -4.349 7.484 801 HA LYS 108 HA LYS 108 -0.417 -2.741 9.919 802 HB2 LYS 108 2HB LYS 108 0.181 -5.548 9.220 803 HB3 LYS 108 1HB LYS 108 1.405 -4.710 10.162 804 HG2 LYS 108 2HG LYS 108 -0.866 -4.035 11.502 805 HG3 LYS 108 1HG LYS 108 -1.249 -5.671 10.939 806 HD2 LYS 108 2HD LYS 108 1.073 -6.301 11.845 807 HD3 LYS 108 1HD LYS 108 1.002 -4.764 12.709 808 HE2 LYS 108 2HE LYS 108 -0.065 -5.881 14.318 809 HE3 LYS 108 1HE LYS 108 -1.454 -5.894 13.233 810 HZ1 LYS 108 3HZ LYS 108 -1.158 -8.061 12.730 811 HZ2 LYS 108 1HZ LYS 108 -0.415 -8.095 14.251 812 HZ3 LYS 108 2HZ LYS 108 0.528 -7.995 12.850 813 H VAL 109 H VAL 109 0.392 -0.986 8.518 814 HA VAL 109 HA VAL 109 2.505 -1.018 6.796 815 HB VAL 109 HB VAL 109 1.098 0.970 7.942 816 HG11 VAL 109 1HG1 VAL 109 3.891 1.358 9.001 817 HG12 VAL 109 2HG1 VAL 109 2.518 0.866 9.993 818 HG13 VAL 109 3HG1 VAL 109 2.511 2.438 9.195 819 HG21 VAL 109 3HG2 VAL 109 3.200 2.346 6.865 820 HG22 VAL 109 1HG2 VAL 109 1.847 1.662 5.966 821 HG23 VAL 109 2HG2 VAL 109 3.354 0.759 6.114 822 H HIS 110 H HIS 110 4.541 -1.433 6.797 823 HA HIS 110 HA HIS 110 5.990 -1.515 9.349 824 HB2 HIS 110 2HB HIS 110 5.416 -3.731 7.641 825 HB3 HIS 110 1HB HIS 110 7.143 -3.405 7.543 826 HD1 HIS 110 1HD HIS 110 4.558 -3.754 10.325 827 HD2 HIS 110 2HD HIS 110 8.510 -4.706 9.467 828 HE1 HIS 110 1HE HIS 110 5.394 -5.024 12.326 829 HE2 HIS 110 2HE HIS 110 7.761 -5.664 11.749 830 HA PRO 111 HA PRO 111 8.582 1.252 7.005 831 HB2 PRO 111 2HB PRO 111 10.695 1.328 8.728 832 HB3 PRO 111 1HB PRO 111 9.195 2.225 8.992 833 HG2 PRO 111 2HG PRO 111 10.083 -0.374 10.173 834 HG3 PRO 111 1HG PRO 111 9.260 0.987 10.955 835 HD2 PRO 111 2HD PRO 111 7.959 -1.260 10.183 836 HD3 PRO 111 1HD PRO 111 7.189 0.343 10.177 837 H GLU 112 H GLU 112 8.568 -1.519 6.261 838 HA GLU 112 HA GLU 112 11.420 -2.122 5.897 839 HB2 GLU 112 2HB GLU 112 8.987 -3.745 6.158 840 HB3 GLU 112 1HB GLU 112 10.067 -4.278 4.878 841 HG2 GLU 112 2HG GLU 112 10.638 -5.478 6.836 842 HG3 GLU 112 1HG GLU 112 11.916 -4.298 6.553 843 H ILE 113 H ILE 113 8.465 -2.602 3.952 844 HA ILE 113 HA ILE 113 9.998 -2.179 1.532 845 HB ILE 113 HB ILE 113 7.106 -2.909 1.968 846 HG12 ILE 113 2HG1 ILE 113 8.209 -4.935 0.562 847 HG13 ILE 113 1HG1 ILE 113 9.625 -4.381 1.466 848 HG21 ILE 113 1HG2 ILE 113 8.603 -2.587 -0.632 849 HG22 ILE 113 2HG2 ILE 113 7.268 -1.586 -0.064 850 HG23 ILE 113 3HG2 ILE 113 6.990 -3.281 -0.464 851 HD11 ILE 113 3HD1 ILE 113 8.482 -6.173 2.629 852 HD12 ILE 113 1HD1 ILE 113 6.990 -5.233 2.647 853 HD13 ILE 113 2HD1 ILE 113 8.396 -4.673 3.554 854 H ILE 114 H ILE 114 10.535 -0.118 1.330 855 HA ILE 114 HA ILE 114 8.521 1.982 1.597 856 HB ILE 114 HB ILE 114 10.633 3.440 1.097 857 HG12 ILE 114 2HG1 ILE 114 11.907 1.157 0.679 858 HG13 ILE 114 1HG1 ILE 114 12.726 2.531 1.400 859 HG21 ILE 114 1HG2 ILE 114 11.253 2.948 3.670 860 HG22 ILE 114 2HG2 ILE 114 9.660 2.199 3.574 861 HG23 ILE 114 3HG2 ILE 114 9.865 3.899 3.152 862 HD11 ILE 114 3HD1 ILE 114 13.010 1.471 3.359 863 HD12 ILE 114 1HD1 ILE 114 12.775 0.024 2.378 864 HD13 ILE 114 2HD1 ILE 114 11.425 0.699 3.294 865 H ASN 115 H ASN 115 11.184 1.292 -0.652 866 HA ASN 115 HA ASN 115 9.716 1.216 -2.994 867 HB2 ASN 115 2HB ASN 115 9.134 3.548 -2.566 868 HB3 ASN 115 1HB ASN 115 10.842 3.958 -2.355 869 HD21 ASN 115 1HD2 ASN 115 9.437 5.407 -4.101 870 HD22 ASN 115 2HD2 ASN 115 9.870 5.001 -5.740 871 H GLU 116 H GLU 116 12.671 2.312 -1.448 872 HA GLU 116 HA GLU 116 14.861 1.857 -1.808 873 HB2 GLU 116 2HB GLU 116 13.673 -0.323 -3.522 874 HB3 GLU 116 1HB GLU 116 15.413 -0.135 -3.277 875 HG2 GLU 116 2HG GLU 116 13.467 -0.430 -1.009 876 HG3 GLU 116 1HG GLU 116 14.228 -1.808 -1.800 877 H ASN 117 H ASN 117 13.302 1.369 -4.988 878 HA ASN 117 HA ASN 117 15.379 2.600 -6.440 879 HB2 ASN 117 2HB ASN 117 12.898 1.315 -7.015 880 HB3 ASN 117 1HB ASN 117 12.923 2.863 -7.873 881 HD21 ASN 117 1HD2 ASN 117 14.167 3.088 -9.630 882 HD22 ASN 117 2HD2 ASN 117 15.207 1.843 -10.268 883 H GLY 118 H GLY 118 12.946 3.947 -4.472 884 HA2 GLY 118 2HA GLY 118 12.424 6.357 -5.848 885 HA3 GLY 118 1HA GLY 118 12.244 6.101 -4.109 886 H ASN 119 H ASN 119 12.970 8.452 -4.319 887 HA ASN 119 HA ASN 119 15.846 8.753 -4.665 888 HB2 ASN 119 2HB ASN 119 15.433 11.153 -4.421 889 HB3 ASN 119 1HB ASN 119 14.339 10.454 -5.624 890 HD21 ASN 119 1HD2 ASN 119 14.595 12.289 -2.817 891 HD22 ASN 119 2HD2 ASN 119 12.902 12.372 -2.416 892 HA PRO 120 HA PRO 120 16.804 8.717 -0.362 893 HB2 PRO 120 2HB PRO 120 18.770 10.840 -0.605 894 HB3 PRO 120 1HB PRO 120 19.033 9.096 -0.445 895 HG2 PRO 120 2HG PRO 120 19.590 10.504 -2.718 896 HG3 PRO 120 1HG PRO 120 19.158 8.778 -2.710 897 HD2 PRO 120 2HD PRO 120 17.447 11.164 -3.329 898 HD3 PRO 120 1HD PRO 120 17.516 9.577 -4.138 899 H SER 121 H SER 121 14.514 10.196 -0.644 900 HA SER 121 HA SER 121 14.456 11.785 1.627 901 HB2 SER 121 2HB SER 121 15.153 13.250 -0.877 902 HB3 SER 121 1HB SER 121 13.977 14.008 0.210 903 HG SER 121 HG SER 121 16.550 14.109 0.441 904 H TYR 122 H TYR 122 12.922 9.804 0.459 905 HA TYR 122 HA TYR 122 10.325 10.865 0.683 906 HB2 TYR 122 2HB TYR 122 11.538 11.001 -1.929 907 HB3 TYR 122 1HB TYR 122 10.133 9.935 -1.965 908 HD1 TYR 122 2HD TYR 122 8.148 11.080 -0.341 909 HD2 TYR 122 1HD TYR 122 11.062 13.112 -2.678 910 HE1 TYR 122 2HE TYR 122 6.680 13.051 -0.445 911 HE2 TYR 122 1HE TYR 122 9.607 15.089 -2.788 912 HH TYR 122 HH TYR 122 7.021 15.583 -0.792 913 H LYS 123 H LYS 123 12.312 8.323 -0.738 914 HA LYS 123 HA LYS 123 12.076 6.063 -0.875 915 HB2 LYS 123 2HB LYS 123 11.424 6.862 1.899 916 HB3 LYS 123 1HB LYS 123 11.007 5.216 1.459 917 HG2 LYS 123 2HG LYS 123 13.725 6.505 1.404 918 HG3 LYS 123 1HG LYS 123 13.170 5.170 2.429 919 HD2 LYS 123 2HD LYS 123 14.129 3.849 0.890 920 HD3 LYS 123 1HD LYS 123 12.695 4.200 -0.086 921 HE2 LYS 123 2HE LYS 123 14.072 6.293 -0.824 922 HE3 LYS 123 1HE LYS 123 15.451 5.344 -0.269 923 HZ1 LYS 123 3HZ LYS 123 13.525 4.067 -2.068 924 HZ2 LYS 123 1HZ LYS 123 15.193 3.826 -1.928 925 HZ3 LYS 123 2HZ LYS 123 14.600 5.193 -2.727 926 H TYR 124 H TYR 124 9.259 6.245 1.223 927 HA TYR 124 HA TYR 124 7.675 4.514 -0.209 928 HB2 TYR 124 2HB TYR 124 7.061 6.687 1.752 929 HB3 TYR 124 1HB TYR 124 5.752 5.755 1.012 930 HD1 TYR 124 1HD TYR 124 6.029 3.134 1.186 931 HD2 TYR 124 2HD TYR 124 8.016 5.927 3.697 932 HE1 TYR 124 1HE TYR 124 6.319 1.390 2.887 933 HE2 TYR 124 2HE TYR 124 8.323 4.191 5.399 934 HH TYR 124 HH TYR 124 7.926 0.941 4.805 935 H PHE 125 H PHE 125 8.588 7.492 -1.387 936 HA PHE 125 HA PHE 125 6.095 8.166 -2.686 937 HB2 PHE 125 2HB PHE 125 7.801 9.868 -1.904 938 HB3 PHE 125 1HB PHE 125 8.831 9.324 -3.234 939 HD1 PHE 125 1HD PHE 125 5.195 10.086 -2.939 940 HD2 PHE 125 2HD PHE 125 8.875 10.890 -4.912 941 HE1 PHE 125 1HE PHE 125 4.037 11.642 -4.449 942 HE2 PHE 125 2HE PHE 125 7.726 12.451 -6.427 943 HZ PHE 125 HZ PHE 125 5.304 12.827 -6.198 944 H TYR 126 H TYR 126 5.432 7.085 -4.430 945 HA TYR 126 HA TYR 126 7.471 5.987 -6.248 946 HB2 TYR 126 2HB TYR 126 4.896 4.943 -5.244 947 HB3 TYR 126 1HB TYR 126 5.194 4.686 -6.969 948 HD1 TYR 126 1HD TYR 126 6.406 3.950 -3.566 949 HD2 TYR 126 2HD TYR 126 6.871 3.147 -7.714 950 HE1 TYR 126 1HE TYR 126 7.825 2.014 -3.028 951 HE2 TYR 126 2HE TYR 126 8.295 1.214 -7.185 952 HH TYR 126 HH TYR 126 9.734 0.443 -5.317 953 H VAL 127 H VAL 127 7.643 8.020 -7.313 954 HA VAL 127 HA VAL 127 5.331 9.060 -8.716 955 HB VAL 127 HB VAL 127 6.969 10.617 -7.752 956 HG11 VAL 127 1HG1 VAL 127 8.837 8.936 -9.219 957 HG12 VAL 127 2HG1 VAL 127 9.114 10.011 -7.850 958 HG13 VAL 127 3HG1 VAL 127 9.100 10.658 -9.490 959 HG21 VAL 127 3HG2 VAL 127 5.617 11.063 -9.894 960 HG22 VAL 127 1HG2 VAL 127 7.163 10.897 -10.728 961 HG23 VAL 127 2HG2 VAL 127 6.952 12.148 -9.503 962 H SER 128 H SER 128 5.374 6.717 -9.681 963 HA SER 128 HA SER 128 5.651 6.844 -12.396 964 HB2 SER 128 2HB SER 128 8.213 6.179 -11.058 965 HB3 SER 128 1HB SER 128 7.773 5.172 -12.448 966 HG SER 128 HG SER 128 7.867 8.012 -12.448 967 H ALA 129 H ALA 129 4.380 5.266 -13.124 968 HA ALA 129 HA ALA 129 3.451 3.176 -11.466 969 HB1 ALA 129 1HB ALA 129 2.178 2.443 -13.364 970 HB2 ALA 129 2HB ALA 129 3.199 3.371 -14.461 971 HB3 ALA 129 3HB ALA 129 2.151 4.205 -13.314 972 H GLU 130 H GLU 130 6.108 3.421 -13.673 973 HA GLU 130 HA GLU 130 6.443 0.666 -14.232 974 HB2 GLU 130 2HB GLU 130 8.752 1.332 -14.912 975 HB3 GLU 130 1HB GLU 130 7.471 2.284 -15.673 976 HG2 GLU 130 2HG GLU 130 8.199 4.186 -14.772 977 HG3 GLU 130 1HG GLU 130 8.447 3.447 -13.183 978 H GLN 131 H GLN 131 7.562 2.719 -11.596 979 HA GLN 131 HA GLN 131 9.328 0.660 -10.628 980 HB2 GLN 131 2HB GLN 131 9.285 2.249 -8.534 981 HB3 GLN 131 1HB GLN 131 10.243 2.626 -9.956 982 HG2 GLN 131 2HG GLN 131 8.530 4.151 -10.737 983 HG3 GLN 131 1HG GLN 131 7.504 3.729 -9.369 984 HE21 GLN 131 1HE2 GLN 131 7.488 5.978 -8.848 985 HE22 GLN 131 2HE2 GLN 131 8.823 6.686 -8.011 986 H VAL 132 H VAL 132 6.312 2.148 -9.425 987 HA VAL 132 HA VAL 132 5.951 0.580 -7.185 988 HB VAL 132 HB VAL 132 4.407 2.305 -7.394 989 HG11 VAL 132 1HG1 VAL 132 2.788 1.749 -9.625 990 HG12 VAL 132 2HG1 VAL 132 4.464 1.657 -10.167 991 HG13 VAL 132 3HG1 VAL 132 3.873 3.116 -9.372 992 HG21 VAL 132 3HG2 VAL 132 3.429 0.167 -6.547 993 HG22 VAL 132 1HG2 VAL 132 2.754 -0.094 -8.154 994 HG23 VAL 132 2HG2 VAL 132 2.251 1.303 -7.204 995 H VAL 133 H VAL 133 5.664 -0.306 -10.527 996 HA VAL 133 HA VAL 133 4.268 -2.767 -9.958 997 HB VAL 133 HB VAL 133 3.942 -1.702 -12.149 998 HG11 VAL 133 1HG1 VAL 133 5.903 -0.683 -12.776 999 HG12 VAL 133 2HG1 VAL 133 5.938 -2.131 -13.781 1000 HG13 VAL 133 3HG1 VAL 133 6.895 -2.060 -12.301 1001 HG21 VAL 133 3HG2 VAL 133 3.586 -4.085 -11.973 1002 HG22 VAL 133 1HG2 VAL 133 5.303 -4.392 -12.238 1003 HG23 VAL 133 2HG2 VAL 133 4.316 -3.716 -13.536 1004 H GLN 134 H GLN 134 7.599 -1.663 -10.355 1005 HA GLN 134 HA GLN 134 8.685 -4.311 -10.574 1006 HB2 GLN 134 2HB GLN 134 10.822 -3.312 -10.413 1007 HB3 GLN 134 1HB GLN 134 9.836 -2.134 -11.264 1008 HG2 GLN 134 2HG GLN 134 9.900 -0.638 -9.553 1009 HG3 GLN 134 1HG GLN 134 10.047 -1.880 -8.320 1010 HE21 GLN 134 1HE2 GLN 134 11.825 -0.446 -11.022 1011 HE22 GLN 134 2HE2 GLN 134 13.394 -0.548 -10.269 1012 H GLY 135 H GLY 135 7.963 -2.099 -7.963 1013 HA2 GLY 135 2HA GLY 135 9.104 -3.802 -5.925 1014 HA3 GLY 135 1HA GLY 135 8.141 -2.339 -5.660 1015 H MET 136 H MET 136 6.118 -3.462 -7.605 1016 HA MET 136 HA MET 136 4.508 -4.815 -5.641 1017 HB2 MET 136 2HB MET 136 3.428 -3.222 -7.089 1018 HB3 MET 136 1HB MET 136 4.050 -4.024 -8.519 1019 HG2 MET 136 2HG MET 136 2.671 -6.035 -7.791 1020 HG3 MET 136 1HG MET 136 1.877 -4.930 -6.671 1021 HE1 MET 136 3HE MET 136 2.959 -5.376 -10.378 1022 HE2 MET 136 1HE MET 136 1.422 -5.135 -11.207 1023 HE3 MET 136 2HE MET 136 1.624 -6.495 -10.103 1024 H LYS 137 H LYS 137 6.211 -5.571 -8.586 1025 HA LYS 137 HA LYS 137 5.329 -8.294 -8.706 1026 HB2 LYS 137 2HB LYS 137 6.832 -8.497 -10.599 1027 HB3 LYS 137 1HB LYS 137 5.884 -7.027 -10.737 1028 HG2 LYS 137 2HG LYS 137 7.923 -5.879 -9.682 1029 HG3 LYS 137 1HG LYS 137 8.789 -7.349 -10.132 1030 HD2 LYS 137 2HD LYS 137 7.396 -5.373 -11.924 1031 HD3 LYS 137 1HD LYS 137 9.093 -5.850 -11.932 1032 HE2 LYS 137 2HE LYS 137 6.838 -7.744 -12.567 1033 HE3 LYS 137 1HE LYS 137 7.679 -6.797 -13.790 1034 HZ1 LYS 137 3HZ LYS 137 8.689 -8.922 -13.710 1035 HZ2 LYS 137 1HZ LYS 137 8.831 -8.881 -12.025 1036 HZ3 LYS 137 2HZ LYS 137 9.772 -7.849 -12.978 1037 H GLU 138 H GLU 138 7.641 -6.623 -6.909 1038 HA GLU 138 HA GLU 138 9.347 -8.971 -6.547 1039 HB2 GLU 138 2HB GLU 138 9.744 -6.102 -6.354 1040 HB3 GLU 138 1HB GLU 138 10.297 -6.927 -4.896 1041 HG2 GLU 138 2HG GLU 138 11.492 -8.517 -6.562 1042 HG3 GLU 138 1HG GLU 138 11.270 -7.185 -7.708 1043 H ALA 139 H ALA 139 7.895 -6.503 -4.441 1044 HA ALA 139 HA ALA 139 8.060 -7.819 -2.029 1045 HB1 ALA 139 1HB ALA 139 6.736 -6.178 -1.205 1046 HB2 ALA 139 2HB ALA 139 5.531 -6.356 -2.482 1047 HB3 ALA 139 3HB ALA 139 7.020 -5.459 -2.790 1048 H GLN 140 H GLN 140 5.858 -8.353 -4.667 1049 HA GLN 140 HA GLN 140 3.846 -9.761 -3.396 1050 HB2 GLN 140 2HB GLN 140 3.490 -10.817 -5.637 1051 HB3 GLN 140 1HB GLN 140 3.533 -9.054 -5.641 1052 HG2 GLN 140 2HG GLN 140 4.790 -9.659 -7.491 1053 HG3 GLN 140 1HG GLN 140 5.998 -9.323 -6.253 1054 HE21 GLN 140 1HE2 GLN 140 3.972 -12.129 -7.037 1055 HE22 GLN 140 2HE2 GLN 140 5.275 -13.260 -7.121 1056 H GLU 141 H GLU 141 7.103 -10.697 -3.837 1057 HA GLU 141 HA GLU 141 6.442 -13.543 -3.627 1058 HB2 GLU 141 2HB GLU 141 8.016 -13.046 -5.366 1059 HB3 GLU 141 1HB GLU 141 9.025 -12.110 -4.257 1060 HG2 GLU 141 2HG GLU 141 9.892 -13.985 -3.251 1061 HG3 GLU 141 1HG GLU 141 8.518 -14.996 -3.699 1062 H ARG 142 H ARG 142 8.304 -11.026 -1.954 1063 HA ARG 142 HA ARG 142 9.100 -12.828 0.147 1064 HB2 ARG 142 2HB ARG 142 9.300 -9.813 0.084 1065 HB3 ARG 142 1HB ARG 142 10.198 -10.918 1.133 1066 HG2 ARG 142 2HG ARG 142 11.724 -11.364 -0.440 1067 HG3 ARG 142 1HG ARG 142 10.513 -11.455 -1.731 1068 HD2 ARG 142 2HD ARG 142 10.544 -9.139 -2.079 1069 HD3 ARG 142 1HD ARG 142 11.322 -8.829 -0.519 1070 HE ARG 142 HE ARG 142 12.932 -10.385 -2.321 1071 HH11 ARG 142 1HH1 ARG 142 12.015 -7.151 -1.381 1072 HH12 ARG 142 2HH1 ARG 142 13.470 -6.430 -1.981 1073 HH21 ARG 142 1HH2 ARG 142 14.845 -9.438 -3.109 1074 HH22 ARG 142 2HH2 ARG 142 15.078 -7.729 -2.963 1075 H LEU 143 H LEU 143 6.883 -10.056 -0.078 1076 HA LEU 143 HA LEU 143 6.029 -10.153 2.602 1077 HB2 LEU 143 2HB LEU 143 4.838 -8.974 0.109 1078 HB3 LEU 143 1HB LEU 143 4.019 -8.868 1.669 1079 HG LEU 143 HG LEU 143 5.266 -6.827 1.184 1080 HD11 LEU 143 1HD1 LEU 143 5.685 -6.593 3.353 1081 HD12 LEU 143 2HD1 LEU 143 7.020 -7.744 3.286 1082 HD13 LEU 143 3HD1 LEU 143 5.372 -8.319 3.534 1083 HD21 LEU 143 3HD2 LEU 143 7.012 -8.085 -0.191 1084 HD22 LEU 143 1HD2 LEU 143 7.806 -8.414 1.348 1085 HD23 LEU 143 2HD2 LEU 143 7.574 -6.751 0.813 1086 H THR 144 H THR 144 5.330 -12.251 0.017 1087 HA THR 144 HA THR 144 2.770 -13.027 0.159 1088 HB THR 144 HB THR 144 3.655 -15.410 -0.080 1089 HG1 THR 144 1HG THR 144 6.126 -14.052 -0.257 1090 HG21 THR 144 3HG2 THR 144 5.091 -13.849 -2.094 1091 HG22 THR 144 1HG2 THR 144 3.379 -13.463 -1.913 1092 HG23 THR 144 2HG2 THR 144 3.877 -15.114 -2.281 1093 H GLY 145 H GLY 145 4.912 -15.160 1.982 1094 HA2 GLY 145 2HA GLY 145 3.204 -14.816 4.348 1095 HA3 GLY 145 1HA GLY 145 3.384 -16.420 3.659 1096 H ASP 146 H ASP 146 4.733 -14.044 5.698 1097 HA ASP 146 HA ASP 146 6.562 -13.976 7.043 1098 HB2 ASP 146 2HB ASP 146 6.477 -16.984 6.735 1099 HB3 ASP 146 1HB ASP 146 7.279 -16.091 8.024 1100 H ALA 147 H ALA 147 6.929 -14.091 4.039 1101 HA ALA 147 HA ALA 147 9.670 -15.131 3.923 1102 HB1 ALA 147 1HB ALA 147 8.623 -15.989 2.072 1103 HB2 ALA 147 2HB ALA 147 9.268 -14.493 1.398 1104 HB3 ALA 147 3HB ALA 147 7.573 -14.585 1.877 1105 H PHE 148 H PHE 148 8.758 -12.605 5.238 1106 HA PHE 148 HA PHE 148 10.348 -10.686 3.669 1107 HB2 PHE 148 2HB PHE 148 9.071 -8.926 4.925 1108 HB3 PHE 148 1HB PHE 148 8.078 -9.913 3.844 1109 HD1 PHE 148 2HD PHE 148 6.617 -11.674 4.794 1110 HD2 PHE 148 1HD PHE 148 8.700 -8.899 7.257 1111 HE1 PHE 148 2HE PHE 148 5.123 -12.224 6.670 1112 HE2 PHE 148 1HE PHE 148 7.211 -9.444 9.138 1113 HZ PHE 148 HZ PHE 148 5.419 -11.108 8.845 1114 H ARG 149 H ARG 149 9.744 -12.050 6.852 1115 HA ARG 149 HA ARG 149 11.365 -10.411 8.397 1116 HB2 ARG 149 2HB ARG 149 11.021 -13.379 8.809 1117 HB3 ARG 149 1HB ARG 149 11.329 -12.152 10.027 1118 HG2 ARG 149 2HG ARG 149 9.086 -11.158 9.394 1119 HG3 ARG 149 1HG ARG 149 8.800 -12.648 8.493 1120 HD2 ARG 149 2HD ARG 149 9.756 -13.075 11.225 1121 HD3 ARG 149 1HD ARG 149 8.200 -12.249 11.133 1122 HE ARG 149 HE ARG 149 7.868 -14.318 9.443 1123 HH11 ARG 149 1HH1 ARG 149 9.018 -14.129 12.733 1124 HH12 ARG 149 2HH1 ARG 149 8.448 -15.707 13.155 1125 HH21 ARG 149 1HH2 ARG 149 7.118 -16.396 9.997 1126 HH22 ARG 149 2HH2 ARG 149 7.369 -16.995 11.603 1127 H LYS 150 H LYS 150 13.305 -11.687 9.616 1128 HA LYS 150 HA LYS 150 15.092 -13.223 8.114 1129 HB2 LYS 150 2HB LYS 150 15.037 -10.918 6.867 1130 HB3 LYS 150 1HB LYS 150 16.067 -10.390 8.190 1131 HG2 LYS 150 2HG LYS 150 16.808 -12.887 6.771 1132 HG3 LYS 150 1HG LYS 150 17.054 -11.351 5.937 1133 HD2 LYS 150 2HD LYS 150 18.033 -10.896 8.490 1134 HD3 LYS 150 1HD LYS 150 18.549 -12.542 8.125 1135 HE2 LYS 150 2HE LYS 150 19.328 -11.572 5.874 1136 HE3 LYS 150 1HE LYS 150 19.176 -10.002 6.660 1137 HZ1 LYS 150 3HZ LYS 150 21.427 -10.861 6.821 1138 HZ2 LYS 150 1HZ LYS 150 20.869 -12.250 7.612 1139 HZ3 LYS 150 2HZ LYS 150 20.728 -10.739 8.358 1140 H LYS 151 H LYS 151 15.694 -14.261 9.936 1141 HA LYS 151 HA LYS 151 17.346 -12.793 11.823 1142 HB2 LYS 151 2HB LYS 151 14.727 -13.142 12.482 1143 HB3 LYS 151 1HB LYS 151 15.442 -14.595 13.169 1144 HG2 LYS 151 2HG LYS 151 16.372 -13.469 14.847 1145 HG3 LYS 151 1HG LYS 151 16.978 -12.204 13.775 1146 HD2 LYS 151 2HD LYS 151 15.494 -11.004 15.049 1147 HD3 LYS 151 1HD LYS 151 14.450 -11.492 13.712 1148 HE2 LYS 151 2HE LYS 151 13.105 -12.124 15.426 1149 HE3 LYS 151 1HE LYS 151 14.074 -13.591 15.309 1150 HZ1 LYS 151 3HZ LYS 151 13.715 -12.306 17.577 1151 HZ2 LYS 151 1HZ LYS 151 15.086 -11.474 17.039 1152 HZ3 LYS 151 2HZ LYS 151 15.140 -13.152 17.238 1153 H HIS 152 H HIS 152 15.762 -15.987 11.786 1154 HA HIS 152 HA HIS 152 18.287 -17.257 12.415 1155 HB2 HIS 152 2HB HIS 152 15.514 -18.395 12.012 1156 HB3 HIS 152 1HB HIS 152 16.918 -19.342 12.490 1157 HD1 HIS 152 1HD HIS 152 18.126 -18.176 14.782 1158 HD2 HIS 152 2HD HIS 152 14.048 -17.680 14.155 1159 HE1 HIS 152 1HE HIS 152 17.166 -17.590 17.030 1160 HE2 HIS 152 2HE HIS 152 14.711 -17.210 16.610 1161 H LEU 153 H LEU 153 19.650 -18.047 10.965 1162 HA LEU 153 HA LEU 153 18.648 -18.587 8.246 1163 HB2 LEU 153 2HB LEU 153 20.976 -18.162 7.495 1164 HB3 LEU 153 1HB LEU 153 20.192 -16.761 8.198 1165 HG LEU 153 HG LEU 153 21.901 -18.449 9.963 1166 HD11 LEU 153 1HD1 LEU 153 22.849 -16.828 7.666 1167 HD12 LEU 153 2HD1 LEU 153 23.535 -18.282 8.387 1168 HD13 LEU 153 3HD1 LEU 153 23.745 -16.722 9.181 1169 HD21 LEU 153 3HD2 LEU 153 20.459 -16.223 10.400 1170 HD22 LEU 153 1HD2 LEU 153 22.001 -15.501 9.938 1171 HD23 LEU 153 2HD2 LEU 153 21.925 -16.625 11.295 1172 H GLU 154 H GLU 154 20.679 -19.739 10.872 1173 HA GLU 154 HA GLU 154 20.350 -22.456 10.001 1174 HB2 GLU 154 2HB GLU 154 23.034 -21.103 9.823 1175 HB3 GLU 154 1HB GLU 154 22.887 -22.843 10.021 1176 HG2 GLU 154 2HG GLU 154 21.365 -22.729 7.948 1177 HG3 GLU 154 1HG GLU 154 22.082 -21.139 7.701 1178 H ASP 155 H ASP 155 22.607 -20.542 11.999 1179 HA ASP 155 HA ASP 155 21.672 -22.047 14.344 1180 HB2 ASP 155 2HB ASP 155 24.371 -21.948 13.217 1181 HB3 ASP 155 1HB ASP 155 24.319 -21.520 14.924 1182 H GLU 156 H GLU 156 22.812 -20.921 16.384 1183 HA GLU 156 HA GLU 156 21.798 -18.217 16.357 1184 HB2 GLU 156 2HB GLU 156 21.764 -20.134 18.250 1185 HB3 GLU 156 1HB GLU 156 23.210 -19.249 18.753 1186 HG2 GLU 156 2HG GLU 156 21.392 -18.342 19.955 1187 HG3 GLU 156 1HG GLU 156 21.820 -17.163 18.716 1188 H LEU 157 H LEU 157 23.093 -16.750 15.422 1189 HA LEU 157 HA LEU 157 25.838 -16.526 16.450 1190 HB2 LEU 157 2HB LEU 157 25.347 -17.403 13.945 1191 HB3 LEU 157 1HB LEU 157 25.378 -15.674 13.657 1192 HG LEU 157 HG LEU 157 27.642 -15.923 15.096 1193 HD11 LEU 157 1HD1 LEU 157 28.806 -17.909 14.646 1194 HD12 LEU 157 2HD1 LEU 157 27.618 -18.436 13.453 1195 HD13 LEU 157 3HD1 LEU 157 27.203 -18.430 15.168 1196 HD21 LEU 157 3HD2 LEU 157 27.379 -16.412 12.131 1197 HD22 LEU 157 1HD2 LEU 157 28.835 -15.875 12.968 1198 HD23 LEU 157 2HD2 LEU 157 27.411 -14.836 12.921 Start of MODEL 24 1 H1 MET 1 1HT MET 1 3.185 0.465 25.518 2 H2 MET 1 2HT MET 1 4.781 0.995 25.172 3 H3 MET 1 3HT MET 1 4.466 0.075 26.587 4 HA MET 1 HA MET 1 4.459 -0.777 23.785 5 HB2 MET 1 2HB MET 1 6.043 -2.422 24.639 6 HB3 MET 1 1HB MET 1 6.566 -0.798 25.064 7 HG2 MET 1 2HG MET 1 5.928 -1.074 27.316 8 HG3 MET 1 1HG MET 1 5.020 -2.542 26.956 9 HE1 MET 1 2HE MET 1 8.228 -0.933 26.170 10 HE2 MET 1 3HE MET 1 9.213 -2.323 25.717 11 HE3 MET 1 1HE MET 1 9.332 -1.650 27.343 12 H HIS 2 H HIS 2 3.131 -1.356 26.973 13 HA HIS 2 HA HIS 2 1.891 -3.852 26.113 14 HB2 HIS 2 2HB HIS 2 2.344 -2.497 28.722 15 HB3 HIS 2 1HB HIS 2 0.931 -3.539 28.592 16 HD1 HIS 2 1HD HIS 2 4.590 -3.611 28.975 17 HD2 HIS 2 2HD HIS 2 1.555 -6.292 28.045 18 HE1 HIS 2 1HE HIS 2 5.606 -5.895 29.245 19 HE2 HIS 2 2HE HIS 2 3.778 -7.499 28.585 20 H HIS 3 H HIS 3 0.916 -0.660 27.339 21 HA HIS 3 HA HIS 3 -1.801 -1.185 26.341 22 HB2 HIS 3 2HB HIS 3 -1.135 -0.425 28.834 23 HB3 HIS 3 1HB HIS 3 -1.288 1.161 28.085 24 HD1 HIS 3 1HD HIS 3 -3.297 -1.880 28.984 25 HD2 HIS 3 2HD HIS 3 -3.885 1.955 27.498 26 HE1 HIS 3 1HE HIS 3 -5.782 -1.500 29.066 27 HE2 HIS 3 2HE HIS 3 -6.104 0.861 28.249 28 H HIS 4 H HIS 4 -1.764 -0.527 24.252 29 HA HIS 4 HA HIS 4 -1.571 2.308 23.761 30 HB2 HIS 4 2HB HIS 4 0.761 0.913 23.437 31 HB3 HIS 4 1HB HIS 4 0.076 0.836 21.816 32 HD1 HIS 4 1HD HIS 4 0.716 2.733 20.376 33 HD2 HIS 4 2HD HIS 4 0.758 3.775 24.398 34 HE1 HIS 4 1HE HIS 4 1.523 5.114 20.445 35 HE2 HIS 4 2HE HIS 4 1.467 5.748 22.883 36 H HIS 5 H HIS 5 -1.459 -0.744 21.909 37 HA HIS 5 HA HIS 5 -3.804 0.212 20.400 38 HB2 HIS 5 2HB HIS 5 -1.332 -1.216 19.565 39 HB3 HIS 5 1HB HIS 5 -2.829 -1.663 18.755 40 HD1 HIS 5 1HD HIS 5 -0.919 1.534 19.551 41 HD2 HIS 5 2HD HIS 5 -3.374 -0.096 16.620 42 HE1 HIS 5 1HE HIS 5 -1.012 3.254 17.719 43 HE2 HIS 5 2HE HIS 5 -2.570 2.282 15.994 44 H HIS 6 H HIS 6 -2.187 -2.789 21.450 45 HA HIS 6 HA HIS 6 -3.004 -4.788 22.161 46 HB2 HIS 6 2HB HIS 6 -4.594 -2.827 23.381 47 HB3 HIS 6 1HB HIS 6 -5.731 -4.025 22.772 48 HD1 HIS 6 1HD HIS 6 -5.700 -6.354 23.866 49 HD2 HIS 6 2HD HIS 6 -2.903 -3.716 25.442 50 HE1 HIS 6 1HE HIS 6 -4.865 -7.440 25.974 51 HE2 HIS 6 2HE HIS 6 -3.117 -5.863 26.870 52 H HIS 7 H HIS 7 -3.289 -6.264 20.632 53 HA HIS 7 HA HIS 7 -4.207 -7.493 18.953 54 HB2 HIS 7 2HB HIS 7 -6.232 -7.108 20.636 55 HB3 HIS 7 1HB HIS 7 -6.871 -6.193 19.275 56 HD1 HIS 7 1HD HIS 7 -8.154 -7.520 17.628 57 HD2 HIS 7 2HD HIS 7 -5.515 -9.881 19.803 58 HE1 HIS 7 1HE HIS 7 -8.592 -9.880 16.880 59 HE2 HIS 7 2HE HIS 7 -7.054 -11.300 18.284 60 H MET 8 H MET 8 -5.682 -7.223 16.879 61 HA MET 8 HA MET 8 -4.561 -4.970 15.451 62 HB2 MET 8 2HB MET 8 -6.077 -7.440 14.668 63 HB3 MET 8 1HB MET 8 -5.904 -6.105 13.521 64 HG2 MET 8 2HG MET 8 -3.678 -6.454 13.239 65 HG3 MET 8 1HG MET 8 -3.454 -7.090 14.868 66 HE1 MET 8 3HE MET 8 -4.684 -9.397 15.579 67 HE2 MET 8 1HE MET 8 -2.964 -9.603 15.247 68 HE3 MET 8 2HE MET 8 -4.127 -10.783 14.641 69 H SER 9 H SER 9 -6.168 -4.029 13.695 70 HA SER 9 HA SER 9 -8.792 -3.472 14.847 71 HB2 SER 9 2HB SER 9 -6.577 -1.505 14.586 72 HB3 SER 9 1HB SER 9 -8.190 -0.954 14.130 73 HG SER 9 HG SER 9 -7.459 -2.121 16.614 74 H ASP 10 H ASP 10 -10.032 -1.945 13.276 75 HA ASP 10 HA ASP 10 -9.698 -3.083 10.602 76 HB2 ASP 10 2HB ASP 10 -11.925 -2.889 12.114 77 HB3 ASP 10 1HB ASP 10 -12.049 -1.384 11.207 78 H GLY 11 H GLY 11 -10.827 -1.335 8.939 79 HA2 GLY 11 2HA GLY 11 -9.980 1.367 9.316 80 HA3 GLY 11 1HA GLY 11 -8.853 0.478 8.302 81 H HIS 12 H HIS 12 -9.692 2.368 6.902 82 HA HIS 12 HA HIS 12 -11.687 1.239 5.105 83 HB2 HIS 12 2HB HIS 12 -12.145 3.573 6.811 84 HB3 HIS 12 1HB HIS 12 -12.415 3.907 5.094 85 HD1 HIS 12 1HD HIS 12 -14.713 3.440 4.341 86 HD2 HIS 12 2HD HIS 12 -13.658 1.084 7.598 87 HE1 HIS 12 1HE HIS 12 -16.769 2.103 4.898 88 HE2 HIS 12 2HE HIS 12 -16.086 0.634 6.827 89 H ASN 13 H ASN 13 -11.901 2.819 3.123 90 HA ASN 13 HA ASN 13 -9.744 4.507 2.468 91 HB2 ASN 13 2HB ASN 13 -8.543 3.107 0.860 92 HB3 ASN 13 1HB ASN 13 -8.459 2.410 2.475 93 HD21 ASN 13 1HD2 ASN 13 -7.913 0.446 1.362 94 HD22 ASN 13 2HD2 ASN 13 -9.167 -0.551 0.717 95 H GLY 14 H GLY 14 -9.917 5.409 0.372 96 HA2 GLY 14 2HA GLY 14 -12.596 5.424 -0.642 97 HA3 GLY 14 1HA GLY 14 -11.222 6.322 -1.296 98 H LEU 15 H LEU 15 -10.531 5.726 -3.241 99 HA LEU 15 HA LEU 15 -10.464 2.968 -4.057 100 HB2 LEU 15 2HB LEU 15 -12.408 4.899 -5.310 101 HB3 LEU 15 1HB LEU 15 -11.848 3.458 -6.138 102 HG LEU 15 HG LEU 15 -12.703 2.315 -3.874 103 HD11 LEU 15 1HD1 LEU 15 -13.505 4.901 -3.439 104 HD12 LEU 15 2HD1 LEU 15 -14.184 3.469 -2.664 105 HD13 LEU 15 3HD1 LEU 15 -14.959 4.149 -4.094 106 HD21 LEU 15 3HD2 LEU 15 -14.790 3.045 -5.876 107 HD22 LEU 15 1HD2 LEU 15 -14.453 1.490 -5.115 108 HD23 LEU 15 2HD2 LEU 15 -13.393 2.097 -6.386 109 H GLY 16 H GLY 16 -9.892 2.959 -6.577 110 HA2 GLY 16 2HA GLY 16 -7.586 4.738 -6.809 111 HA3 GLY 16 1HA GLY 16 -7.876 3.309 -7.770 112 H LYS 17 H LYS 17 -9.955 6.123 -7.137 113 HA LYS 17 HA LYS 17 -10.924 6.334 -9.750 114 HB2 LYS 17 2HB LYS 17 -10.786 8.229 -7.428 115 HB3 LYS 17 1HB LYS 17 -11.355 8.800 -8.990 116 HG2 LYS 17 2HG LYS 17 -12.971 6.793 -8.884 117 HG3 LYS 17 1HG LYS 17 -12.583 6.781 -7.162 118 HD2 LYS 17 2HD LYS 17 -13.341 9.065 -6.934 119 HD3 LYS 17 1HD LYS 17 -13.616 9.180 -8.674 120 HE2 LYS 17 2HE LYS 17 -15.273 7.324 -8.449 121 HE3 LYS 17 1HE LYS 17 -15.080 7.434 -6.700 122 HZ1 LYS 17 3HZ LYS 17 -16.828 8.823 -6.950 123 HZ2 LYS 17 1HZ LYS 17 -16.430 9.250 -8.539 124 HZ3 LYS 17 2HZ LYS 17 -15.607 9.957 -7.241 125 H GLY 18 H GLY 18 -9.966 6.988 -11.582 126 HA2 GLY 18 2HA GLY 18 -8.466 7.991 -13.017 127 HA3 GLY 18 1HA GLY 18 -8.277 9.246 -11.784 128 H PHE 19 H PHE 19 -7.711 6.000 -10.884 129 HA PHE 19 HA PHE 19 -4.844 6.527 -10.592 130 HB2 PHE 19 2HB PHE 19 -6.651 5.667 -8.782 131 HB3 PHE 19 1HB PHE 19 -6.101 4.109 -9.411 132 HD1 PHE 19 2HD PHE 19 -3.526 3.782 -9.486 133 HD2 PHE 19 1HD PHE 19 -5.520 6.682 -7.097 134 HE1 PHE 19 2HE PHE 19 -1.570 3.897 -7.990 135 HE2 PHE 19 1HE PHE 19 -3.569 6.805 -5.609 136 HZ PHE 19 HZ PHE 19 -1.596 5.419 -6.052 137 H GLY 20 H GLY 20 -6.898 3.702 -11.193 138 HA2 GLY 20 2HA GLY 20 -5.423 2.999 -13.583 139 HA3 GLY 20 1HA GLY 20 -5.163 1.915 -12.215 140 H ASP 21 H ASP 21 -7.661 1.915 -11.058 141 HA ASP 21 HA ASP 21 -9.959 1.645 -12.414 142 HB2 ASP 21 2HB ASP 21 -8.119 -0.511 -13.217 143 HB3 ASP 21 1HB ASP 21 -9.723 -1.069 -12.721 144 H HIS 22 H HIS 22 -9.026 -1.451 -11.084 145 HA HIS 22 HA HIS 22 -10.436 -0.775 -8.576 146 HB2 HIS 22 2HB HIS 22 -10.899 -3.261 -8.475 147 HB3 HIS 22 1HB HIS 22 -11.684 -2.421 -9.803 148 HD1 HIS 22 1HD HIS 22 -9.415 -5.199 -9.071 149 HD2 HIS 22 2HD HIS 22 -10.378 -2.873 -12.368 150 HE1 HIS 22 1HE HIS 22 -8.549 -6.465 -11.059 151 HE2 HIS 22 2HE HIS 22 -9.102 -5.014 -13.042 152 H ILE 23 H ILE 23 -7.979 -2.856 -9.943 153 HA ILE 23 HA ILE 23 -6.370 -4.129 -8.741 154 HB ILE 23 HB ILE 23 -5.448 -1.288 -9.112 155 HG12 ILE 23 2HG1 ILE 23 -4.678 -2.586 -11.347 156 HG13 ILE 23 1HG1 ILE 23 -6.159 -3.464 -10.983 157 HG21 ILE 23 1HG2 ILE 23 -3.416 -1.943 -8.643 158 HG22 ILE 23 2HG2 ILE 23 -3.514 -3.243 -9.831 159 HG23 ILE 23 3HG2 ILE 23 -4.043 -3.520 -8.171 160 HD11 ILE 23 3HD1 ILE 23 -6.806 -0.767 -10.693 161 HD12 ILE 23 1HD1 ILE 23 -7.272 -1.853 -12.002 162 HD13 ILE 23 2HD1 ILE 23 -5.817 -0.870 -12.148 163 H HIS 24 H HIS 24 -4.855 -1.445 -7.331 164 HA HIS 24 HA HIS 24 -4.988 -2.658 -4.733 165 HB2 HIS 24 2HB HIS 24 -3.579 -0.070 -5.151 166 HB3 HIS 24 1HB HIS 24 -3.115 -1.470 -4.184 167 HD1 HIS 24 1HD HIS 24 -1.934 0.273 -6.943 168 HD2 HIS 24 2HD HIS 24 -2.604 -3.766 -6.242 169 HE1 HIS 24 1HE HIS 24 -0.502 -0.941 -8.611 170 HE2 HIS 24 2HE HIS 24 -1.083 -3.368 -8.299 171 H TRP 25 H TRP 25 -7.456 -1.400 -5.672 172 HA TRP 25 HA TRP 25 -7.900 0.302 -3.358 173 HB2 TRP 25 2HB TRP 25 -9.279 1.735 -5.231 174 HB3 TRP 25 1HB TRP 25 -7.694 2.171 -4.588 175 HD1 TRP 25 HD TRP 25 -9.415 1.001 -7.721 176 HE1 TRP 25 1HE TRP 25 -7.711 0.948 -9.620 177 HE3 TRP 25 3HE TRP 25 -5.138 1.716 -5.055 178 HZ2 TRP 25 2HZ TRP 25 -4.929 1.185 -9.992 179 HZ3 TRP 25 3HZ TRP 25 -2.998 1.802 -6.240 180 HH2 TRP 25 HH TRP 25 -2.892 1.536 -8.665 181 H ARG 26 H ARG 26 -8.977 -2.126 -5.427 182 HA ARG 26 HA ARG 26 -11.605 -1.831 -5.842 183 HB2 ARG 26 2HB ARG 26 -10.822 -4.313 -4.349 184 HB3 ARG 26 1HB ARG 26 -11.977 -4.127 -5.663 185 HG2 ARG 26 2HG ARG 26 -9.926 -3.551 -7.098 186 HG3 ARG 26 1HG ARG 26 -8.995 -4.271 -5.792 187 HD2 ARG 26 2HD ARG 26 -9.411 -5.981 -7.401 188 HD3 ARG 26 1HD ARG 26 -10.422 -6.309 -5.987 189 HE ARG 26 HE ARG 26 -11.326 -5.427 -8.620 190 HH11 ARG 26 1HH1 ARG 26 -12.131 -6.242 -5.318 191 HH12 ARG 26 2HH1 ARG 26 -13.818 -6.436 -5.651 192 HH21 ARG 26 1HH2 ARG 26 -13.543 -5.677 -9.049 193 HH22 ARG 26 2HH2 ARG 26 -14.619 -6.114 -7.764 194 H THR 27 H THR 27 -10.181 -2.375 -2.619 195 HA THR 27 HA THR 27 -11.782 -0.824 -1.120 196 HB THR 27 HB THR 27 -13.344 -2.855 -0.203 197 HG1 THR 27 1HG THR 27 -13.868 -3.146 -2.897 198 HG21 THR 27 3HG2 THR 27 -14.629 -1.049 -0.460 199 HG22 THR 27 1HG2 THR 27 -15.055 -1.799 -1.997 200 HG23 THR 27 2HG2 THR 27 -13.815 -0.546 -1.942 201 H LEU 28 H LEU 28 -11.763 -1.253 1.170 202 HA LEU 28 HA LEU 28 -9.419 -2.781 1.923 203 HB2 LEU 28 2HB LEU 28 -10.246 -0.413 2.763 204 HB3 LEU 28 1HB LEU 28 -11.155 -1.390 3.915 205 HG LEU 28 HG LEU 28 -8.259 -1.986 3.645 206 HD11 LEU 28 1HD1 LEU 28 -8.961 0.247 5.461 207 HD12 LEU 28 2HD1 LEU 28 -8.793 0.618 3.744 208 HD13 LEU 28 3HD1 LEU 28 -7.448 -0.107 4.626 209 HD21 LEU 28 3HD2 LEU 28 -8.540 -2.163 6.135 210 HD22 LEU 28 1HD2 LEU 28 -9.515 -3.287 5.187 211 HD23 LEU 28 2HD2 LEU 28 -10.259 -1.852 5.892 212 H GLU 29 H GLU 29 -12.887 -2.743 2.661 213 HA GLU 29 HA GLU 29 -12.928 -4.805 4.540 214 HB2 GLU 29 2HB GLU 29 -14.810 -3.192 3.771 215 HB3 GLU 29 1HB GLU 29 -15.148 -4.414 2.553 216 HG2 GLU 29 2HG GLU 29 -14.900 -5.605 5.165 217 HG3 GLU 29 1HG GLU 29 -16.103 -4.316 5.166 218 H ASP 30 H ASP 30 -13.590 -4.993 1.043 219 HA ASP 30 HA ASP 30 -13.687 -7.834 1.005 220 HB2 ASP 30 2HB ASP 30 -13.516 -5.708 -1.117 221 HB3 ASP 30 1HB ASP 30 -13.391 -7.422 -1.540 222 H GLY 31 H GLY 31 -11.143 -5.475 0.690 223 HA2 GLY 31 2HA GLY 31 -9.229 -7.264 -0.482 224 HA3 GLY 31 1HA GLY 31 -8.890 -5.682 0.228 225 H LYS 32 H LYS 32 -10.213 -6.489 2.773 226 HA LYS 32 HA LYS 32 -7.889 -7.555 4.049 227 HB2 LYS 32 2HB LYS 32 -9.834 -5.941 4.920 228 HB3 LYS 32 1HB LYS 32 -10.492 -7.470 5.486 229 HG2 LYS 32 2HG LYS 32 -8.437 -7.903 6.730 230 HG3 LYS 32 1HG LYS 32 -7.768 -6.375 6.155 231 HD2 LYS 32 2HD LYS 32 -9.241 -5.106 7.432 232 HD3 LYS 32 1HD LYS 32 -10.384 -6.438 7.613 233 HE2 LYS 32 2HE LYS 32 -8.630 -7.615 8.977 234 HE3 LYS 32 1HE LYS 32 -7.701 -6.117 8.943 235 HZ1 LYS 32 3HZ LYS 32 -10.486 -6.258 9.949 236 HZ2 LYS 32 1HZ LYS 32 -9.373 -4.997 10.144 237 HZ3 LYS 32 2HZ LYS 32 -9.138 -6.466 10.949 238 H LYS 33 H LYS 33 -11.206 -8.754 3.595 239 HA LYS 33 HA LYS 33 -10.693 -11.312 4.711 240 HB2 LYS 33 2HB LYS 33 -12.957 -10.324 4.531 241 HB3 LYS 33 1HB LYS 33 -12.869 -10.478 2.780 242 HG2 LYS 33 2HG LYS 33 -12.316 -13.027 3.621 243 HG3 LYS 33 1HG LYS 33 -13.502 -12.469 4.813 244 HD2 LYS 33 2HD LYS 33 -15.174 -12.342 3.283 245 HD3 LYS 33 1HD LYS 33 -14.087 -11.870 1.974 246 HE2 LYS 33 2HE LYS 33 -13.208 -14.303 2.173 247 HE3 LYS 33 1HE LYS 33 -14.726 -14.603 3.017 248 HZ1 LYS 33 3HZ LYS 33 -15.449 -14.992 0.935 249 HZ2 LYS 33 1HZ LYS 33 -14.243 -14.056 0.205 250 HZ3 LYS 33 2HZ LYS 33 -15.608 -13.309 0.870 251 H GLU 34 H GLU 34 -10.378 -9.940 1.521 252 HA GLU 34 HA GLU 34 -10.161 -12.375 0.082 253 HB2 GLU 34 2HB GLU 34 -10.686 -10.287 -1.046 254 HB3 GLU 34 1HB GLU 34 -9.125 -9.613 -0.569 255 HG2 GLU 34 2HG GLU 34 -8.014 -10.689 -2.186 256 HG3 GLU 34 1HG GLU 34 -9.001 -12.151 -2.041 257 H ALA 35 H ALA 35 -7.572 -10.000 0.672 258 HA ALA 35 HA ALA 35 -5.405 -11.535 0.051 259 HB1 ALA 35 1HB ALA 35 -4.151 -10.142 1.751 260 HB2 ALA 35 2HB ALA 35 -5.707 -9.419 2.165 261 HB3 ALA 35 3HB ALA 35 -5.065 -9.254 0.531 262 H ALA 36 H ALA 36 -7.367 -11.697 2.920 263 HA ALA 36 HA ALA 36 -5.641 -13.184 4.571 264 HB1 ALA 36 1HB ALA 36 -7.471 -12.177 5.628 265 HB2 ALA 36 2HB ALA 36 -7.845 -13.901 5.657 266 HB3 ALA 36 3HB ALA 36 -8.622 -12.850 4.471 267 H ALA 37 H ALA 37 -8.064 -14.157 2.183 268 HA ALA 37 HA ALA 37 -8.018 -16.915 2.665 269 HB1 ALA 37 1HB ALA 37 -9.228 -15.168 0.811 270 HB2 ALA 37 2HB ALA 37 -9.598 -16.867 1.107 271 HB3 ALA 37 3HB ALA 37 -8.413 -16.423 -0.122 272 H SER 38 H SER 38 -6.647 -15.485 -0.287 273 HA SER 38 HA SER 38 -4.892 -17.611 -0.779 274 HB2 SER 38 2HB SER 38 -5.262 -14.862 -1.838 275 HB3 SER 38 1HB SER 38 -3.678 -15.607 -2.117 276 HG SER 38 HG SER 38 -6.221 -16.619 -2.867 277 H GLY 39 H GLY 39 -4.543 -14.691 1.107 278 HA2 GLY 39 2HA GLY 39 -3.030 -14.357 2.852 279 HA3 GLY 39 1HA GLY 39 -2.119 -15.765 2.300 280 H LEU 40 H LEU 40 -3.035 -13.170 0.138 281 HA LEU 40 HA LEU 40 -0.218 -12.659 -0.362 282 HB2 LEU 40 2HB LEU 40 -1.032 -11.261 -2.233 283 HB3 LEU 40 1HB LEU 40 -1.579 -12.923 -2.314 284 HG LEU 40 HG LEU 40 -3.756 -12.072 -1.260 285 HD11 LEU 40 1HD1 LEU 40 -2.275 -9.570 -1.669 286 HD12 LEU 40 2HD1 LEU 40 -3.555 -9.958 -0.523 287 HD13 LEU 40 3HD1 LEU 40 -3.955 -9.564 -2.194 288 HD21 LEU 40 3HD2 LEU 40 -3.375 -10.876 -3.952 289 HD22 LEU 40 1HD2 LEU 40 -4.681 -11.889 -3.341 290 HD23 LEU 40 2HD2 LEU 40 -3.129 -12.612 -3.758 291 HA PRO 41 HA PRO 41 0.313 -9.027 2.015 292 HB2 PRO 41 2HB PRO 41 1.514 -7.350 0.172 293 HB3 PRO 41 1HB PRO 41 2.347 -8.582 1.124 294 HG2 PRO 41 2HG PRO 41 1.297 -8.733 -1.668 295 HG3 PRO 41 1HG PRO 41 2.845 -9.321 -1.026 296 HD2 PRO 41 2HD PRO 41 0.853 -11.026 -1.467 297 HD3 PRO 41 1HD PRO 41 1.842 -11.174 0.002 298 H LEU 42 H LEU 42 -0.167 -6.757 2.178 299 HA LEU 42 HA LEU 42 -2.604 -6.054 0.698 300 HB2 LEU 42 2HB LEU 42 -1.925 -6.000 3.472 301 HB3 LEU 42 1HB LEU 42 -2.216 -4.354 2.945 302 HG LEU 42 HG LEU 42 -4.414 -5.274 1.953 303 HD11 LEU 42 1HD1 LEU 42 -3.467 -7.684 2.561 304 HD12 LEU 42 2HD1 LEU 42 -5.192 -7.319 2.569 305 HD13 LEU 42 3HD1 LEU 42 -4.287 -7.332 4.081 306 HD21 LEU 42 3HD2 LEU 42 -4.445 -5.409 4.922 307 HD22 LEU 42 1HD2 LEU 42 -5.515 -4.546 3.818 308 HD23 LEU 42 2HD2 LEU 42 -3.903 -3.916 4.156 309 H MET 43 H MET 43 -2.451 -4.505 -0.756 310 HA MET 43 HA MET 43 -0.095 -2.830 -0.875 311 HB2 MET 43 2HB MET 43 -0.952 -3.838 -2.929 312 HB3 MET 43 1HB MET 43 -2.507 -3.016 -2.711 313 HG2 MET 43 2HG MET 43 -1.235 -1.825 -4.338 314 HG3 MET 43 1HG MET 43 -1.282 -0.848 -2.874 315 HE1 MET 43 3HE MET 43 2.223 -2.836 -4.926 316 HE2 MET 43 1HE MET 43 0.501 -3.152 -5.144 317 HE3 MET 43 2HE MET 43 1.385 -3.943 -3.839 318 H VAL 44 H VAL 44 -0.244 -1.356 0.795 319 HA VAL 44 HA VAL 44 -2.657 0.254 1.055 320 HB VAL 44 HB VAL 44 -0.111 0.439 2.667 321 HG11 VAL 44 1HG1 VAL 44 -1.532 1.611 4.294 322 HG12 VAL 44 2HG1 VAL 44 -2.884 1.521 3.164 323 HG13 VAL 44 3HG1 VAL 44 -1.450 2.463 2.752 324 HG21 VAL 44 3HG2 VAL 44 -2.075 -0.655 4.271 325 HG22 VAL 44 1HG2 VAL 44 -0.723 -1.515 3.534 326 HG23 VAL 44 2HG2 VAL 44 -2.289 -1.481 2.727 327 H ILE 45 H ILE 45 -2.323 1.166 -1.106 328 HA ILE 45 HA ILE 45 -0.185 3.135 -1.316 329 HB ILE 45 HB ILE 45 -0.429 1.993 -3.329 330 HG12 ILE 45 2HG1 ILE 45 -2.206 4.172 -4.213 331 HG13 ILE 45 1HG1 ILE 45 -0.759 4.672 -3.323 332 HG21 ILE 45 1HG2 ILE 45 -2.258 0.774 -3.582 333 HG22 ILE 45 2HG2 ILE 45 -2.965 2.207 -4.327 334 HG23 ILE 45 3HG2 ILE 45 -3.228 1.883 -2.614 335 HD11 ILE 45 3HD1 ILE 45 0.148 4.636 -5.383 336 HD12 ILE 45 1HD1 ILE 45 -1.026 3.476 -6.002 337 HD13 ILE 45 2HD1 ILE 45 0.334 2.918 -5.032 338 H ILE 46 H ILE 46 -0.472 5.094 -0.544 339 HA ILE 46 HA ILE 46 -3.185 6.240 -0.608 340 HB ILE 46 HB ILE 46 -1.150 6.982 1.470 341 HG12 ILE 46 2HG1 ILE 46 -3.237 5.181 2.405 342 HG13 ILE 46 1HG1 ILE 46 -2.189 4.412 1.217 343 HG21 ILE 46 1HG2 ILE 46 -3.078 7.725 2.713 344 HG22 ILE 46 2HG2 ILE 46 -4.156 7.088 1.473 345 HG23 ILE 46 3HG2 ILE 46 -3.100 8.444 1.102 346 HD11 ILE 46 3HD1 ILE 46 -0.293 4.717 2.563 347 HD12 ILE 46 1HD1 ILE 46 -1.565 4.211 3.677 348 HD13 ILE 46 2HD1 ILE 46 -1.107 5.912 3.576 349 H HIS 47 H HIS 47 -3.370 8.392 -1.157 350 HA HIS 47 HA HIS 47 -0.915 9.861 -1.780 351 HB2 HIS 47 2HB HIS 47 -1.836 10.413 -4.065 352 HB3 HIS 47 1HB HIS 47 -1.300 8.737 -3.853 353 HD1 HIS 47 1HD HIS 47 -3.932 10.519 -5.330 354 HD2 HIS 47 2HD HIS 47 -3.759 7.104 -2.945 355 HE1 HIS 47 1HE HIS 47 -6.120 9.338 -5.694 356 HE2 HIS 47 2HE HIS 47 -6.060 7.375 -4.119 357 H LYS 48 H LYS 48 -1.193 11.685 -0.674 358 HA LYS 48 HA LYS 48 -3.820 13.024 -0.933 359 HB2 LYS 48 2HB LYS 48 -2.352 12.312 1.431 360 HB3 LYS 48 1HB LYS 48 -2.531 14.056 1.353 361 HG2 LYS 48 2HG LYS 48 -5.005 13.599 0.913 362 HG3 LYS 48 1HG LYS 48 -4.664 11.957 1.460 363 HD2 LYS 48 2HD LYS 48 -3.482 13.507 3.402 364 HD3 LYS 48 1HD LYS 48 -4.928 14.431 2.991 365 HE2 LYS 48 2HE LYS 48 -5.545 11.625 3.203 366 HE3 LYS 48 1HE LYS 48 -4.747 12.194 4.668 367 HZ1 LYS 48 3HZ LYS 48 -6.977 13.722 3.491 368 HZ2 LYS 48 1HZ LYS 48 -6.418 13.714 5.089 369 HZ3 LYS 48 2HZ LYS 48 -7.285 12.392 4.488 370 H SER 49 H SER 49 -3.750 15.401 -0.718 371 HA SER 49 HA SER 49 -3.007 17.458 -1.340 372 HB2 SER 49 2HB SER 49 -0.664 16.178 -0.193 373 HB3 SER 49 1HB SER 49 -0.219 17.321 -1.460 374 HG SER 49 HG SER 49 -1.490 18.889 -0.356 375 H TRP 50 H TRP 50 -1.151 18.441 -2.972 376 HA TRP 50 HA TRP 50 -1.841 17.230 -5.511 377 HB2 TRP 50 2HB TRP 50 -0.625 19.234 -6.451 378 HB3 TRP 50 1HB TRP 50 -2.013 19.613 -5.421 379 HD1 TRP 50 HD TRP 50 1.819 19.784 -5.468 380 HE1 TRP 50 1HE TRP 50 2.585 21.416 -3.631 381 HE3 TRP 50 3HE TRP 50 -2.685 20.624 -3.197 382 HZ2 TRP 50 2HZ TRP 50 1.432 22.869 -1.502 383 HZ3 TRP 50 3HZ TRP 50 -2.766 22.148 -1.267 384 HH2 TRP 50 HH TRP 50 -0.749 23.246 -0.438 385 H CYS 51 H CYS 51 -0.379 15.387 -4.379 386 HA CYS 51 HA CYS 51 2.403 15.546 -4.533 387 HB2 CYS 51 2HB CYS 51 2.190 12.973 -4.878 388 HB3 CYS 51 1HB CYS 51 1.648 13.687 -3.366 389 H GLY 52 H GLY 52 3.705 14.065 -6.076 390 HA2 GLY 52 2HA GLY 52 2.964 14.832 -8.823 391 HA3 GLY 52 1HA GLY 52 4.589 14.402 -8.281 392 H ALA 53 H ALA 53 3.884 12.074 -6.828 393 HA ALA 53 HA ALA 53 3.985 10.119 -8.832 394 HB1 ALA 53 1HB ALA 53 2.868 9.277 -6.243 395 HB2 ALA 53 2HB ALA 53 4.426 10.100 -6.167 396 HB3 ALA 53 3HB ALA 53 4.245 8.643 -7.143 397 H CYS 54 H CYS 54 1.373 11.861 -7.519 398 HA CYS 54 HA CYS 54 -0.568 9.925 -8.458 399 HB2 CYS 54 2HB CYS 54 -2.229 11.664 -7.570 400 HB3 CYS 54 1HB CYS 54 -1.202 10.862 -6.373 401 H LYS 55 H LYS 55 0.661 13.140 -9.151 402 HA LYS 55 HA LYS 55 -1.154 13.920 -11.125 403 HB2 LYS 55 2HB LYS 55 1.514 14.732 -10.239 404 HB3 LYS 55 1HB LYS 55 1.245 15.002 -11.956 405 HG2 LYS 55 2HG LYS 55 -0.754 16.304 -11.451 406 HG3 LYS 55 1HG LYS 55 -0.501 16.020 -9.719 407 HD2 LYS 55 2HD LYS 55 1.198 17.518 -9.593 408 HD3 LYS 55 1HD LYS 55 1.787 17.150 -11.215 409 HE2 LYS 55 2HE LYS 55 -0.743 18.328 -11.545 410 HE3 LYS 55 1HE LYS 55 0.094 19.295 -10.330 411 HZ1 LYS 55 3HZ LYS 55 2.021 18.990 -12.139 412 HZ2 LYS 55 1HZ LYS 55 0.940 20.292 -12.143 413 HZ3 LYS 55 2HZ LYS 55 0.669 18.965 -13.156 414 H ALA 56 H ALA 56 2.090 12.464 -11.594 415 HA ALA 56 HA ALA 56 1.620 11.962 -14.373 416 HB1 ALA 56 1HB ALA 56 3.869 12.226 -13.120 417 HB2 ALA 56 2HB ALA 56 3.759 11.060 -14.438 418 HB3 ALA 56 3HB ALA 56 3.686 10.508 -12.764 419 H LEU 57 H LEU 57 0.643 10.411 -11.539 420 HA LEU 57 HA LEU 57 0.620 7.715 -12.359 421 HB2 LEU 57 2HB LEU 57 0.307 7.685 -10.160 422 HB3 LEU 57 1HB LEU 57 -0.316 9.317 -10.146 423 HG LEU 57 HG LEU 57 -2.109 7.103 -11.043 424 HD11 LEU 57 1HD1 LEU 57 -2.794 6.803 -8.695 425 HD12 LEU 57 2HD1 LEU 57 -1.406 7.764 -8.194 426 HD13 LEU 57 3HD1 LEU 57 -1.164 6.226 -9.023 427 HD21 LEU 57 3HD2 LEU 57 -2.639 9.587 -9.419 428 HD22 LEU 57 1HD2 LEU 57 -3.829 8.524 -10.170 429 HD23 LEU 57 2HD2 LEU 57 -2.768 9.511 -11.174 430 H LYS 58 H LYS 58 -1.629 10.357 -12.891 431 HA LYS 58 HA LYS 58 -3.932 8.945 -13.483 432 HB2 LYS 58 2HB LYS 58 -3.041 11.598 -13.793 433 HB3 LYS 58 1HB LYS 58 -3.647 11.100 -15.368 434 HG2 LYS 58 2HG LYS 58 -5.594 11.832 -14.501 435 HG3 LYS 58 1HG LYS 58 -5.645 10.193 -13.852 436 HD2 LYS 58 2HD LYS 58 -5.392 10.897 -11.734 437 HD3 LYS 58 1HD LYS 58 -4.177 12.098 -12.178 438 HE2 LYS 58 2HE LYS 58 -5.868 13.484 -11.517 439 HE3 LYS 58 1HE LYS 58 -6.267 13.318 -13.228 440 HZ1 LYS 58 3HZ LYS 58 -7.664 12.300 -10.891 441 HZ2 LYS 58 1HZ LYS 58 -7.607 11.262 -12.226 442 HZ3 LYS 58 2HZ LYS 58 -8.276 12.807 -12.384 443 HA PRO 59 HA PRO 59 -2.667 8.323 -18.037 444 HB2 PRO 59 2HB PRO 59 -0.483 9.433 -19.068 445 HB3 PRO 59 1HB PRO 59 -1.928 10.409 -18.732 446 HG2 PRO 59 2HG PRO 59 0.583 10.122 -17.115 447 HG3 PRO 59 1HG PRO 59 -0.319 11.592 -17.524 448 HD2 PRO 59 2HD PRO 59 -0.552 10.243 -15.128 449 HD3 PRO 59 1HD PRO 59 -1.812 11.292 -15.821 450 H LYS 60 H LYS 60 -0.125 7.972 -15.686 451 HA LYS 60 HA LYS 60 1.191 5.901 -17.299 452 HB2 LYS 60 2HB LYS 60 3.053 6.098 -15.888 453 HB3 LYS 60 1HB LYS 60 2.452 7.747 -16.018 454 HG2 LYS 60 2HG LYS 60 1.184 7.316 -13.891 455 HG3 LYS 60 1HG LYS 60 2.102 5.828 -13.725 456 HD2 LYS 60 2HD LYS 60 2.824 8.280 -12.715 457 HD3 LYS 60 1HD LYS 60 3.907 6.916 -12.959 458 HE2 LYS 60 2HE LYS 60 3.397 9.045 -15.032 459 HE3 LYS 60 1HE LYS 60 4.718 9.110 -13.866 460 HZ1 LYS 60 3HZ LYS 60 5.876 7.979 -15.368 461 HZ2 LYS 60 1HZ LYS 60 4.507 7.600 -16.288 462 HZ3 LYS 60 2HZ LYS 60 4.937 6.629 -14.970 463 H PHE 61 H PHE 61 -0.333 6.370 -14.151 464 HA PHE 61 HA PHE 61 -0.120 3.625 -13.421 465 HB2 PHE 61 2HB PHE 61 -0.490 5.954 -12.037 466 HB3 PHE 61 1HB PHE 61 -2.118 5.276 -12.027 467 HD1 PHE 61 2HD PHE 61 -1.985 2.564 -11.594 468 HD2 PHE 61 1HD PHE 61 0.739 5.506 -10.181 469 HE1 PHE 61 2HE PHE 61 -1.309 1.055 -9.769 470 HE2 PHE 61 1HE PHE 61 1.425 4.004 -8.355 471 HZ PHE 61 HZ PHE 61 0.399 1.776 -8.148 472 H ALA 62 H ALA 62 -2.356 5.603 -15.173 473 HA ALA 62 HA ALA 62 -4.626 3.947 -14.988 474 HB1 ALA 62 1HB ALA 62 -5.062 4.928 -17.358 475 HB2 ALA 62 2HB ALA 62 -3.654 5.931 -17.005 476 HB3 ALA 62 3HB ALA 62 -5.073 6.005 -15.961 477 H GLU 63 H GLU 63 -1.579 3.688 -16.459 478 HA GLU 63 HA GLU 63 -2.103 1.729 -18.454 479 HB2 GLU 63 2HB GLU 63 -0.101 3.346 -18.245 480 HB3 GLU 63 1HB GLU 63 0.539 2.187 -17.074 481 HG2 GLU 63 2HG GLU 63 0.880 0.562 -18.675 482 HG3 GLU 63 1HG GLU 63 -0.307 1.251 -19.782 483 H SER 64 H SER 64 -1.995 1.660 -15.092 484 HA SER 64 HA SER 64 -0.831 -0.753 -14.453 485 HB2 SER 64 2HB SER 64 -3.049 0.835 -13.259 486 HB3 SER 64 1HB SER 64 -2.656 -0.737 -12.593 487 HG SER 64 HG SER 64 -1.128 0.256 -11.568 488 H THR 65 H THR 65 -3.202 -0.494 -16.701 489 HA THR 65 HA THR 65 -5.170 -2.315 -16.161 490 HB THR 65 HB THR 65 -4.854 -3.014 -18.655 491 HG1 THR 65 1HG THR 65 -3.562 -1.491 -19.795 492 HG21 THR 65 3HG2 THR 65 -5.710 -0.873 -19.496 493 HG22 THR 65 1HG2 THR 65 -5.337 -0.133 -17.940 494 HG23 THR 65 2HG2 THR 65 -6.545 -1.413 -18.040 495 H GLU 66 H GLU 66 -1.819 -2.897 -17.019 496 HA GLU 66 HA GLU 66 -2.097 -5.771 -16.886 497 HB2 GLU 66 2HB GLU 66 0.278 -5.852 -17.328 498 HB3 GLU 66 1HB GLU 66 -0.466 -4.687 -18.427 499 HG2 GLU 66 2HG GLU 66 0.392 -3.402 -16.008 500 HG3 GLU 66 1HG GLU 66 1.724 -4.289 -16.747 501 H ILE 67 H ILE 67 -1.184 -3.107 -14.822 502 HA ILE 67 HA ILE 67 -0.024 -4.744 -12.787 503 HB ILE 67 HB ILE 67 -1.273 -2.005 -12.526 504 HG12 ILE 67 2HG1 ILE 67 1.617 -2.809 -12.926 505 HG13 ILE 67 1HG1 ILE 67 0.581 -2.058 -14.148 506 HG21 ILE 67 1HG2 ILE 67 0.431 -1.961 -10.559 507 HG22 ILE 67 2HG2 ILE 67 0.302 -3.717 -10.658 508 HG23 ILE 67 3HG2 ILE 67 -1.136 -2.744 -10.347 509 HD11 ILE 67 3HD1 ILE 67 0.983 -0.023 -13.351 510 HD12 ILE 67 1HD1 ILE 67 2.276 -0.761 -12.407 511 HD13 ILE 67 2HD1 ILE 67 0.685 -0.523 -11.687 512 H SER 68 H SER 68 -3.192 -4.219 -13.915 513 HA SER 68 HA SER 68 -4.664 -4.623 -11.524 514 HB2 SER 68 2HB SER 68 -6.549 -4.830 -12.899 515 HB3 SER 68 1HB SER 68 -5.476 -3.841 -13.888 516 HG SER 68 HG SER 68 -6.358 -6.428 -14.269 517 H GLU 69 H GLU 69 -3.158 -6.705 -13.896 518 HA GLU 69 HA GLU 69 -4.194 -9.139 -12.792 519 HB2 GLU 69 2HB GLU 69 -1.819 -8.767 -14.624 520 HB3 GLU 69 1HB GLU 69 -2.702 -10.261 -14.339 521 HG2 GLU 69 2HG GLU 69 -4.060 -7.846 -15.472 522 HG3 GLU 69 1HG GLU 69 -3.159 -8.964 -16.496 523 H LEU 70 H LEU 70 -1.223 -7.263 -12.617 524 HA LEU 70 HA LEU 70 0.245 -9.076 -11.008 525 HB2 LEU 70 2HB LEU 70 0.434 -6.120 -11.512 526 HB3 LEU 70 1HB LEU 70 1.460 -6.889 -10.303 527 HG LEU 70 HG LEU 70 2.264 -8.440 -12.129 528 HD11 LEU 70 1HD1 LEU 70 1.908 -7.842 -14.411 529 HD12 LEU 70 2HD1 LEU 70 1.008 -6.397 -13.950 530 HD13 LEU 70 3HD1 LEU 70 0.332 -7.996 -13.636 531 HD21 LEU 70 3HD2 LEU 70 2.877 -5.598 -12.836 532 HD22 LEU 70 1HD2 LEU 70 3.959 -6.989 -12.756 533 HD23 LEU 70 2HD2 LEU 70 3.357 -6.250 -11.270 534 H SER 71 H SER 71 -2.432 -7.087 -10.320 535 HA SER 71 HA SER 71 -2.027 -6.387 -7.651 536 HB2 SER 71 2HB SER 71 -4.016 -5.946 -9.387 537 HB3 SER 71 1HB SER 71 -4.722 -7.281 -8.472 538 HG SER 71 HG SER 71 -4.482 -6.073 -6.591 539 H HIS 72 H HIS 72 -2.725 -9.454 -9.099 540 HA HIS 72 HA HIS 72 -3.939 -10.809 -6.994 541 HB2 HIS 72 2HB HIS 72 -2.159 -11.673 -9.255 542 HB3 HIS 72 1HB HIS 72 -2.644 -12.839 -8.018 543 HD1 HIS 72 1HD HIS 72 -5.352 -13.062 -7.729 544 HD2 HIS 72 2HD HIS 72 -3.957 -11.364 -11.256 545 HE1 HIS 72 1HE HIS 72 -7.274 -13.194 -9.347 546 HE2 HIS 72 2HE HIS 72 -6.382 -12.230 -11.497 547 H ASN 73 H ASN 73 -0.807 -9.547 -7.314 548 HA ASN 73 HA ASN 73 0.517 -11.292 -5.478 549 HB2 ASN 73 2HB ASN 73 1.213 -8.594 -6.642 550 HB3 ASN 73 1HB ASN 73 2.296 -9.539 -5.619 551 HD21 ASN 73 1HD2 ASN 73 1.229 -8.969 -8.746 552 HD22 ASN 73 2HD2 ASN 73 1.945 -10.350 -9.518 553 H PHE 74 H PHE 74 -1.228 -8.267 -5.220 554 HA PHE 74 HA PHE 74 -1.016 -8.420 -2.312 555 HB2 PHE 74 2HB PHE 74 -1.210 -5.700 -2.837 556 HB3 PHE 74 1HB PHE 74 0.234 -6.576 -2.328 557 HD1 PHE 74 2HD PHE 74 -1.622 -5.483 -5.336 558 HD2 PHE 74 1HD PHE 74 2.122 -6.658 -3.676 559 HE1 PHE 74 2HE PHE 74 -0.499 -4.881 -7.443 560 HE2 PHE 74 1HE PHE 74 3.249 -6.050 -5.777 561 HZ PHE 74 HZ PHE 74 1.939 -5.161 -7.664 562 H VAL 75 H VAL 75 -2.703 -6.177 -1.756 563 HA VAL 75 HA VAL 75 -5.122 -6.799 -3.286 564 HB VAL 75 HB VAL 75 -5.098 -8.312 -1.354 565 HG11 VAL 75 1HG1 VAL 75 -4.282 -7.528 0.564 566 HG12 VAL 75 2HG1 VAL 75 -5.846 -6.744 0.785 567 HG13 VAL 75 3HG1 VAL 75 -4.505 -5.854 0.067 568 HG21 VAL 75 3HG2 VAL 75 -7.198 -7.501 -2.389 569 HG22 VAL 75 1HG2 VAL 75 -7.273 -6.238 -1.162 570 HG23 VAL 75 2HG2 VAL 75 -7.374 -7.933 -0.688 571 H MET 76 H MET 76 -6.444 -5.227 -3.684 572 HA MET 76 HA MET 76 -6.117 -2.652 -3.713 573 HB2 MET 76 2HB MET 76 -8.598 -2.478 -3.557 574 HB3 MET 76 1HB MET 76 -7.995 -3.666 -4.695 575 HG2 MET 76 2HG MET 76 -8.471 -4.659 -1.977 576 HG3 MET 76 1HG MET 76 -9.910 -4.151 -2.848 577 HE1 MET 76 3HE MET 76 -10.784 -7.521 -3.887 578 HE2 MET 76 1HE MET 76 -11.104 -6.069 -2.939 579 HE3 MET 76 2HE MET 76 -10.115 -7.364 -2.263 580 H VAL 77 H VAL 77 -5.119 -1.631 -1.926 581 HA VAL 77 HA VAL 77 -7.054 -0.842 0.108 582 HB VAL 77 HB VAL 77 -4.232 -1.701 0.768 583 HG11 VAL 77 1HG1 VAL 77 -5.290 -1.141 3.158 584 HG12 VAL 77 2HG1 VAL 77 -6.163 0.046 2.190 585 HG13 VAL 77 3HG1 VAL 77 -4.397 0.055 2.218 586 HG21 VAL 77 3HG2 VAL 77 -5.711 -3.560 0.651 587 HG22 VAL 77 1HG2 VAL 77 -6.947 -2.696 1.563 588 HG23 VAL 77 2HG2 VAL 77 -5.452 -3.191 2.355 589 H ASN 78 H ASN 78 -6.927 0.766 -1.761 590 HA ASN 78 HA ASN 78 -4.770 2.689 -1.304 591 HB2 ASN 78 2HB ASN 78 -4.730 2.273 -3.548 592 HB3 ASN 78 1HB ASN 78 -6.446 1.959 -3.633 593 HD21 ASN 78 1HD2 ASN 78 -4.168 4.558 -2.995 594 HD22 ASN 78 2HD2 ASN 78 -5.056 5.784 -3.838 595 H LEU 79 H LEU 79 -5.320 4.138 0.161 596 HA LEU 79 HA LEU 79 -8.060 5.214 0.089 597 HB2 LEU 79 2HB LEU 79 -7.647 6.098 2.335 598 HB3 LEU 79 1HB LEU 79 -7.460 4.358 2.258 599 HG LEU 79 HG LEU 79 -4.900 5.439 1.823 600 HD11 LEU 79 1HD1 LEU 79 -4.580 6.736 3.905 601 HD12 LEU 79 2HD1 LEU 79 -6.328 6.741 4.137 602 HD13 LEU 79 3HD1 LEU 79 -5.622 7.553 2.740 603 HD21 LEU 79 3HD2 LEU 79 -4.423 4.349 3.994 604 HD22 LEU 79 1HD2 LEU 79 -5.326 3.319 2.882 605 HD23 LEU 79 2HD2 LEU 79 -6.156 4.114 4.219 606 H GLU 80 H GLU 80 -8.470 7.399 -0.012 607 HA GLU 80 HA GLU 80 -6.233 9.024 -1.017 608 HB2 GLU 80 2HB GLU 80 -8.690 8.454 -2.177 609 HB3 GLU 80 1HB GLU 80 -8.903 10.081 -1.523 610 HG2 GLU 80 2HG GLU 80 -6.413 10.142 -2.761 611 HG3 GLU 80 1HG GLU 80 -7.440 9.197 -3.848 612 H ASP 81 H ASP 81 -7.275 11.521 -0.862 613 HA ASP 81 HA ASP 81 -6.749 12.316 1.749 614 HB2 ASP 81 2HB ASP 81 -6.713 13.757 -0.327 615 HB3 ASP 81 1HB ASP 81 -8.467 13.846 -0.211 616 H GLU 82 H GLU 82 -9.738 11.309 0.257 617 HA GLU 82 HA GLU 82 -11.585 12.350 2.071 618 HB2 GLU 82 2HB GLU 82 -11.546 10.090 0.149 619 HB3 GLU 82 1HB GLU 82 -12.788 10.044 1.392 620 HG2 GLU 82 2HG GLU 82 -13.774 12.027 0.645 621 HG3 GLU 82 1HG GLU 82 -12.358 12.475 -0.305 622 H GLU 83 H GLU 83 -9.689 9.368 2.180 623 HA GLU 83 HA GLU 83 -10.826 8.682 4.776 624 HB2 GLU 83 2HB GLU 83 -9.745 7.194 2.616 625 HB3 GLU 83 1HB GLU 83 -8.701 6.924 4.004 626 HG2 GLU 83 2HG GLU 83 -10.252 5.239 4.215 627 HG3 GLU 83 1HG GLU 83 -10.907 6.489 5.278 628 H GLU 84 H GLU 84 -10.003 9.844 6.397 629 HA GLU 84 HA GLU 84 -7.112 10.352 6.455 630 HB2 GLU 84 2HB GLU 84 -9.239 12.040 6.920 631 HB3 GLU 84 1HB GLU 84 -8.736 11.604 8.547 632 HG2 GLU 84 2HG GLU 84 -6.382 12.177 7.137 633 HG3 GLU 84 1HG GLU 84 -7.538 13.433 6.698 634 HA PRO 85 HA PRO 85 -7.454 6.910 9.478 635 HB2 PRO 85 2HB PRO 85 -4.853 6.140 9.223 636 HB3 PRO 85 1HB PRO 85 -6.140 5.591 8.134 637 HG2 PRO 85 2HG PRO 85 -4.127 7.778 7.744 638 HG3 PRO 85 1HG PRO 85 -4.678 6.539 6.593 639 HD2 PRO 85 2HD PRO 85 -5.604 9.075 6.532 640 HD3 PRO 85 1HD PRO 85 -6.625 7.683 6.101 641 H LYS 86 H LYS 86 -5.161 9.540 9.179 642 HA LYS 86 HA LYS 86 -4.042 10.793 10.709 643 HB2 LYS 86 2HB LYS 86 -6.447 10.838 11.627 644 HB3 LYS 86 1HB LYS 86 -5.867 9.676 12.827 645 HG2 LYS 86 2HG LYS 86 -5.335 11.456 14.050 646 HG3 LYS 86 1HG LYS 86 -3.973 11.657 12.945 647 HD2 LYS 86 2HD LYS 86 -4.974 13.757 12.937 648 HD3 LYS 86 1HD LYS 86 -5.642 12.990 11.494 649 HE2 LYS 86 2HE LYS 86 -7.527 12.234 13.152 650 HE3 LYS 86 1HE LYS 86 -6.952 13.602 14.104 651 HZ1 LYS 86 3HZ LYS 86 -7.951 13.694 11.309 652 HZ2 LYS 86 1HZ LYS 86 -7.297 15.015 12.140 653 HZ3 LYS 86 2HZ LYS 86 -8.732 14.303 12.681 654 H ASP 87 H ASP 87 -2.505 8.847 10.170 655 HA ASP 87 HA ASP 87 -1.278 8.114 12.680 656 HB2 ASP 87 2HB ASP 87 -3.037 6.288 11.655 657 HB3 ASP 87 1HB ASP 87 -1.514 5.760 10.924 658 H GLU 88 H GLU 88 0.911 7.608 12.483 659 HA GLU 88 HA GLU 88 2.318 8.809 10.408 660 HB2 GLU 88 2HB GLU 88 2.949 7.216 12.756 661 HB3 GLU 88 1HB GLU 88 4.073 6.925 11.437 662 HG2 GLU 88 2HG GLU 88 5.014 8.657 12.682 663 HG3 GLU 88 1HG GLU 88 4.308 9.439 11.272 664 H ASP 89 H ASP 89 0.827 5.730 10.497 665 HA ASP 89 HA ASP 89 2.333 4.079 8.959 666 HB2 ASP 89 2HB ASP 89 -0.010 3.718 9.949 667 HB3 ASP 89 1HB ASP 89 -0.616 4.391 8.429 668 H PHE 90 H PHE 90 0.365 6.787 7.752 669 HA PHE 90 HA PHE 90 0.764 6.173 5.009 670 HB2 PHE 90 2HB PHE 90 -0.015 8.511 4.591 671 HB3 PHE 90 1HB PHE 90 -1.104 7.556 5.603 672 HD1 PHE 90 1HD PHE 90 1.846 9.817 6.081 673 HD2 PHE 90 2HD PHE 90 -2.047 8.661 7.353 674 HE1 PHE 90 1HE PHE 90 1.881 11.588 7.786 675 HE2 PHE 90 2HE PHE 90 -2.018 10.431 9.062 676 HZ PHE 90 HZ PHE 90 -0.052 11.898 9.279 677 H SER 91 H SER 91 2.755 7.712 7.361 678 HA SER 91 HA SER 91 4.913 7.916 5.479 679 HB2 SER 91 2HB SER 91 3.819 10.462 6.713 680 HB3 SER 91 1HB SER 91 5.326 10.333 5.792 681 HG SER 91 HG SER 91 3.094 10.921 4.767 682 HA PRO 92 HA PRO 92 6.125 7.387 9.923 683 HB2 PRO 92 2HB PRO 92 6.672 4.774 9.973 684 HB3 PRO 92 1HB PRO 92 5.003 5.365 10.085 685 HG2 PRO 92 2HG PRO 92 6.438 4.150 7.772 686 HG3 PRO 92 1HG PRO 92 4.740 3.995 8.252 687 HD2 PRO 92 2HD PRO 92 5.757 5.707 6.271 688 HD3 PRO 92 1HD PRO 92 4.139 5.783 6.993 689 H ASP 93 H ASP 93 7.795 8.631 8.251 690 HA ASP 93 HA ASP 93 10.340 7.778 9.046 691 HB2 ASP 93 2HB ASP 93 11.316 7.058 6.917 692 HB3 ASP 93 1HB ASP 93 10.002 5.978 7.406 693 H GLY 94 H GLY 94 8.665 9.407 6.354 694 HA2 GLY 94 2HA GLY 94 10.629 11.599 6.599 695 HA3 GLY 94 1HA GLY 94 9.716 11.228 5.133 696 H GLY 95 H GLY 95 8.610 13.078 4.794 697 HA2 GLY 95 2HA GLY 95 6.574 13.757 6.785 698 HA3 GLY 95 1HA GLY 95 7.700 15.031 6.309 699 H TYR 96 H TYR 96 5.927 12.509 4.508 700 HA TYR 96 HA TYR 96 4.957 14.641 2.724 701 HB2 TYR 96 2HB TYR 96 4.469 12.449 1.256 702 HB3 TYR 96 1HB TYR 96 6.016 13.302 1.210 703 HD1 TYR 96 2HD TYR 96 7.820 12.439 2.908 704 HD2 TYR 96 1HD TYR 96 4.447 10.172 1.651 705 HE1 TYR 96 2HE TYR 96 8.971 10.371 3.561 706 HE2 TYR 96 1HE TYR 96 5.593 8.092 2.289 707 HH TYR 96 HH TYR 96 7.599 7.613 4.145 708 H ILE 97 H ILE 97 2.815 13.897 1.590 709 HA ILE 97 HA ILE 97 1.055 12.501 3.434 710 HB ILE 97 HB ILE 97 -0.613 14.492 3.077 711 HG12 ILE 97 2HG1 ILE 97 1.753 16.233 3.285 712 HG13 ILE 97 1HG1 ILE 97 1.504 15.511 1.693 713 HG21 ILE 97 1HG2 ILE 97 1.659 14.394 5.039 714 HG22 ILE 97 2HG2 ILE 97 -0.012 13.875 5.265 715 HG23 ILE 97 3HG2 ILE 97 0.369 15.593 5.148 716 HD11 ILE 97 3HD1 ILE 97 -0.241 17.412 3.198 717 HD12 ILE 97 1HD1 ILE 97 -0.908 16.378 1.934 718 HD13 ILE 97 2HD1 ILE 97 0.381 17.520 1.548 719 HA PRO 98 HA PRO 98 0.890 10.246 2.723 720 HB2 PRO 98 2HB PRO 98 -1.648 9.388 1.284 721 HB3 PRO 98 1HB PRO 98 -0.901 8.625 2.718 722 HG2 PRO 98 2HG PRO 98 -2.579 10.925 2.627 723 HG3 PRO 98 1HG PRO 98 -1.757 10.210 4.044 724 HD2 PRO 98 2HD PRO 98 -0.966 12.557 3.270 725 HD3 PRO 98 1HD PRO 98 0.271 11.320 3.575 726 H ARG 99 H ARG 99 1.708 8.182 1.954 727 HA ARG 99 HA ARG 99 2.173 8.145 -0.949 728 HB2 ARG 99 2HB ARG 99 4.036 8.208 1.292 729 HB3 ARG 99 1HB ARG 99 4.381 6.908 0.145 730 HG2 ARG 99 2HG ARG 99 5.559 9.077 -0.274 731 HG3 ARG 99 1HG ARG 99 4.643 8.441 -1.639 732 HD2 ARG 99 2HD ARG 99 3.219 10.295 0.170 733 HD3 ARG 99 1HD ARG 99 4.498 10.991 -0.821 734 HE ARG 99 HE ARG 99 1.958 9.947 -1.726 735 HH11 ARG 99 1HH1 ARG 99 5.187 10.919 -2.632 736 HH12 ARG 99 2HH1 ARG 99 4.771 11.199 -4.288 737 HH21 ARG 99 1HH2 ARG 99 1.410 10.312 -3.900 738 HH22 ARG 99 2HH2 ARG 99 2.625 10.854 -5.009 739 H ILE 100 H ILE 100 3.583 5.812 -1.182 740 HA ILE 100 HA ILE 100 1.475 3.843 -0.644 741 HB ILE 100 HB ILE 100 3.869 3.395 -2.406 742 HG12 ILE 100 2HG1 ILE 100 1.196 4.391 -3.385 743 HG13 ILE 100 1HG1 ILE 100 2.523 5.486 -3.021 744 HG21 ILE 100 1HG2 ILE 100 2.929 1.358 -2.326 745 HG22 ILE 100 2HG2 ILE 100 1.808 2.039 -3.504 746 HG23 ILE 100 3HG2 ILE 100 1.368 1.982 -1.799 747 HD11 ILE 100 3HD1 ILE 100 3.132 5.210 -5.135 748 HD12 ILE 100 1HD1 ILE 100 2.080 3.814 -5.344 749 HD13 ILE 100 2HD1 ILE 100 3.687 3.606 -4.656 750 H LEU 101 H LEU 101 1.830 1.871 0.347 751 HA LEU 101 HA LEU 101 4.452 1.113 1.288 752 HB2 LEU 101 2HB LEU 101 3.084 1.019 3.669 753 HB3 LEU 101 1HB LEU 101 4.347 2.146 3.248 754 HG LEU 101 HG LEU 101 1.591 2.889 2.441 755 HD11 LEU 101 1HD1 LEU 101 2.537 2.857 5.292 756 HD12 LEU 101 2HD1 LEU 101 1.118 2.047 4.623 757 HD13 LEU 101 3HD1 LEU 101 1.172 3.807 4.712 758 HD21 LEU 101 3HD2 LEU 101 3.885 4.183 2.268 759 HD22 LEU 101 1HD2 LEU 101 3.482 4.636 3.920 760 HD23 LEU 101 2HD2 LEU 101 2.374 5.025 2.602 761 H PHE 102 H PHE 102 4.601 -1.028 1.913 762 HA PHE 102 HA PHE 102 2.155 -2.629 1.506 763 HB2 PHE 102 2HB PHE 102 5.047 -3.509 1.378 764 HB3 PHE 102 1HB PHE 102 3.645 -4.506 1.009 765 HD1 PHE 102 2HD PHE 102 5.013 -1.180 -0.020 766 HD2 PHE 102 1HD PHE 102 3.234 -4.861 -1.204 767 HE1 PHE 102 2HE PHE 102 5.127 -0.474 -2.373 768 HE2 PHE 102 1HE PHE 102 3.351 -4.164 -3.559 769 HZ PHE 102 HZ PHE 102 4.298 -1.967 -4.147 770 H LEU 103 H LEU 103 1.758 -4.450 2.964 771 HA LEU 103 HA LEU 103 3.373 -4.610 5.370 772 HB2 LEU 103 2HB LEU 103 1.010 -4.293 6.630 773 HB3 LEU 103 1HB LEU 103 2.216 -3.047 6.439 774 HG LEU 103 HG LEU 103 1.007 -2.251 4.417 775 HD11 LEU 103 1HD1 LEU 103 -0.705 -4.561 5.151 776 HD12 LEU 103 2HD1 LEU 103 -0.258 -3.942 3.561 777 HD13 LEU 103 3HD1 LEU 103 -1.489 -3.116 4.514 778 HD21 LEU 103 3HD2 LEU 103 0.547 -0.955 6.263 779 HD22 LEU 103 1HD2 LEU 103 -0.267 -2.267 7.115 780 HD23 LEU 103 2HD2 LEU 103 -1.061 -1.470 5.758 781 H ASP 104 H ASP 104 2.109 -5.949 7.095 782 HA ASP 104 HA ASP 104 1.692 -8.523 5.995 783 HB2 ASP 104 2HB ASP 104 1.574 -7.289 8.702 784 HB3 ASP 104 1HB ASP 104 0.666 -8.791 8.475 785 HA PRO 105 HA PRO 105 -2.447 -7.927 4.471 786 HB2 PRO 105 2HB PRO 105 -3.114 -10.656 4.726 787 HB3 PRO 105 1HB PRO 105 -2.471 -9.848 3.284 788 HG2 PRO 105 2HG PRO 105 -1.055 -11.438 5.366 789 HG3 PRO 105 1HG PRO 105 -0.727 -11.306 3.624 790 HD2 PRO 105 2HD PRO 105 0.816 -10.072 5.419 791 HD3 PRO 105 1HD PRO 105 0.416 -9.296 3.873 792 H SER 106 H SER 106 -3.331 -6.773 6.199 793 HA SER 106 HA SER 106 -5.096 -6.509 7.657 794 HB2 SER 106 2HB SER 106 -5.098 -9.431 8.370 795 HB3 SER 106 1HB SER 106 -6.444 -8.278 8.377 796 HG SER 106 HG SER 106 -6.091 -8.247 5.999 797 H GLY 107 H GLY 107 -2.323 -6.370 8.134 798 HA2 GLY 107 2HA GLY 107 -2.288 -6.951 11.019 799 HA3 GLY 107 1HA GLY 107 -0.877 -7.213 9.991 800 H LYS 108 H LYS 108 0.035 -5.297 8.899 801 HA LYS 108 HA LYS 108 -0.667 -2.665 9.540 802 HB2 LYS 108 2HB LYS 108 0.670 -4.048 11.723 803 HB3 LYS 108 1HB LYS 108 1.512 -2.578 11.248 804 HG2 LYS 108 2HG LYS 108 -1.049 -1.697 11.324 805 HG3 LYS 108 1HG LYS 108 -1.068 -2.933 12.595 806 HD2 LYS 108 2HD LYS 108 1.074 -1.806 13.447 807 HD3 LYS 108 1HD LYS 108 0.630 -0.460 12.396 808 HE2 LYS 108 2HE LYS 108 -1.521 -1.474 14.130 809 HE3 LYS 108 1HE LYS 108 -0.168 -0.715 14.970 810 HZ1 LYS 108 3HZ LYS 108 -1.517 1.071 14.556 811 HZ2 LYS 108 1HZ LYS 108 -2.077 0.468 13.077 812 HZ3 LYS 108 2HZ LYS 108 -0.522 1.124 13.189 813 H VAL 109 H VAL 109 0.819 -1.047 8.846 814 HA VAL 109 HA VAL 109 2.512 -1.802 6.737 815 HB VAL 109 HB VAL 109 1.392 0.509 7.316 816 HG11 VAL 109 1HG1 VAL 109 2.958 2.163 8.099 817 HG12 VAL 109 2HG1 VAL 109 4.227 0.947 8.246 818 HG13 VAL 109 3HG1 VAL 109 2.823 0.890 9.314 819 HG21 VAL 109 3HG2 VAL 109 3.534 1.404 5.892 820 HG22 VAL 109 1HG2 VAL 109 2.144 0.552 5.220 821 HG23 VAL 109 2HG2 VAL 109 3.612 -0.336 5.624 822 H HIS 110 H HIS 110 4.498 -2.379 6.587 823 HA HIS 110 HA HIS 110 6.249 -2.060 8.931 824 HB2 HIS 110 2HB HIS 110 5.633 -4.419 7.286 825 HB3 HIS 110 1HB HIS 110 7.358 -4.128 7.483 826 HD1 HIS 110 1HD HIS 110 4.398 -5.423 9.232 827 HD2 HIS 110 2HD HIS 110 8.238 -4.186 10.230 828 HE1 HIS 110 1HE HIS 110 4.811 -6.310 11.550 829 HE2 HIS 110 2HE HIS 110 7.158 -5.591 12.114 830 HA PRO 111 HA PRO 111 8.533 0.432 6.031 831 HB2 PRO 111 2HB PRO 111 10.864 0.612 7.453 832 HB3 PRO 111 1HB PRO 111 9.425 1.575 7.805 833 HG2 PRO 111 2HG PRO 111 10.400 -0.926 9.125 834 HG3 PRO 111 1HG PRO 111 9.718 0.535 9.862 835 HD2 PRO 111 2HD PRO 111 8.269 -1.714 9.509 836 HD3 PRO 111 1HD PRO 111 7.546 -0.092 9.390 837 H GLU 112 H GLU 112 8.473 -2.487 5.663 838 HA GLU 112 HA GLU 112 11.227 -3.207 5.061 839 HB2 GLU 112 2HB GLU 112 8.632 -4.632 5.224 840 HB3 GLU 112 1HB GLU 112 9.786 -5.256 4.054 841 HG2 GLU 112 2HG GLU 112 10.142 -6.470 6.029 842 HG3 GLU 112 1HG GLU 112 11.471 -5.316 5.927 843 H ILE 113 H ILE 113 8.255 -3.583 3.144 844 HA ILE 113 HA ILE 113 9.765 -2.954 0.731 845 HB ILE 113 HB ILE 113 6.850 -3.701 0.880 846 HG12 ILE 113 2HG1 ILE 113 8.108 -5.985 0.078 847 HG13 ILE 113 1HG1 ILE 113 9.265 -5.354 1.257 848 HG21 ILE 113 1HG2 ILE 113 7.059 -4.267 -1.410 849 HG22 ILE 113 2HG2 ILE 113 8.817 -4.139 -1.353 850 HG23 ILE 113 3HG2 ILE 113 7.823 -2.689 -1.217 851 HD11 ILE 113 3HD1 ILE 113 7.282 -6.966 1.935 852 HD12 ILE 113 1HD1 ILE 113 6.409 -5.437 2.042 853 HD13 ILE 113 2HD1 ILE 113 7.862 -5.692 3.007 854 H ILE 114 H ILE 114 10.105 -0.781 0.888 855 HA ILE 114 HA ILE 114 7.768 0.984 1.077 856 HB ILE 114 HB ILE 114 9.623 2.778 1.213 857 HG12 ILE 114 2HG1 ILE 114 11.365 0.897 0.632 858 HG13 ILE 114 1HG1 ILE 114 11.785 2.164 1.768 859 HG21 ILE 114 1HG2 ILE 114 9.246 0.867 3.508 860 HG22 ILE 114 2HG2 ILE 114 8.109 2.129 3.033 861 HG23 ILE 114 3HG2 ILE 114 9.718 2.564 3.612 862 HD11 ILE 114 3HD1 ILE 114 12.120 -0.489 2.190 863 HD12 ILE 114 1HD1 ILE 114 10.575 -0.201 2.990 864 HD13 ILE 114 2HD1 ILE 114 11.999 0.726 3.463 865 H ASN 115 H ASN 115 10.753 0.600 -0.800 866 HA ASN 115 HA ASN 115 9.728 0.838 -3.321 867 HB2 ASN 115 2HB ASN 115 8.858 3.023 -2.861 868 HB3 ASN 115 1HB ASN 115 10.367 3.534 -2.090 869 HD21 ASN 115 1HD2 ASN 115 9.393 5.171 -3.900 870 HD22 ASN 115 2HD2 ASN 115 10.285 5.094 -5.396 871 H GLU 116 H GLU 116 12.294 1.961 -1.190 872 HA GLU 116 HA GLU 116 14.545 1.676 -1.218 873 HB2 GLU 116 2HB GLU 116 13.993 -0.255 -3.482 874 HB3 GLU 116 1HB GLU 116 15.519 -0.103 -2.602 875 HG2 GLU 116 2HG GLU 116 12.901 -0.824 -1.303 876 HG3 GLU 116 1HG GLU 116 14.064 -2.009 -1.895 877 H ASN 117 H ASN 117 13.500 1.575 -4.636 878 HA ASN 117 HA ASN 117 15.669 2.907 -5.722 879 HB2 ASN 117 2HB ASN 117 13.504 1.778 -6.791 880 HB3 ASN 117 1HB ASN 117 12.975 3.464 -6.871 881 HD21 ASN 117 1HD2 ASN 117 15.544 1.240 -7.796 882 HD22 ASN 117 2HD2 ASN 117 16.055 2.133 -9.204 883 H GLY 118 H GLY 118 13.114 4.175 -3.774 884 HA2 GLY 118 2HA GLY 118 13.004 6.826 -4.656 885 HA3 GLY 118 1HA GLY 118 12.688 6.294 -3.002 886 H ASN 119 H ASN 119 14.143 6.744 -1.444 887 HA ASN 119 HA ASN 119 16.895 7.201 -1.878 888 HB2 ASN 119 2HB ASN 119 16.990 9.621 -1.475 889 HB3 ASN 119 1HB ASN 119 16.076 9.261 -2.946 890 HD21 ASN 119 1HD2 ASN 119 15.909 10.366 0.347 891 HD22 ASN 119 2HD2 ASN 119 14.295 11.019 0.255 892 HA PRO 120 HA PRO 120 16.943 6.823 2.515 893 HB2 PRO 120 2HB PRO 120 19.143 8.687 2.873 894 HB3 PRO 120 1HB PRO 120 19.165 6.915 2.935 895 HG2 PRO 120 2HG PRO 120 20.359 8.367 0.956 896 HG3 PRO 120 1HG PRO 120 19.731 6.719 0.724 897 HD2 PRO 120 2HD PRO 120 18.495 9.350 -0.020 898 HD3 PRO 120 1HD PRO 120 18.543 7.821 -0.937 899 H SER 121 H SER 121 15.012 8.694 1.800 900 HA SER 121 HA SER 121 14.577 10.080 4.172 901 HB2 SER 121 2HB SER 121 16.015 11.616 2.049 902 HB3 SER 121 1HB SER 121 14.728 12.442 2.941 903 HG SER 121 HG SER 121 15.831 11.928 4.868 904 H TYR 122 H TYR 122 13.229 8.416 2.357 905 HA TYR 122 HA TYR 122 10.772 9.775 2.102 906 HB2 TYR 122 2HB TYR 122 12.620 9.978 -0.110 907 HB3 TYR 122 1HB TYR 122 11.138 9.157 -0.602 908 HD1 TYR 122 2HD TYR 122 9.063 10.513 0.908 909 HD2 TYR 122 1HD TYR 122 12.546 12.130 -0.922 910 HE1 TYR 122 2HE TYR 122 7.948 12.697 0.727 911 HE2 TYR 122 1HE TYR 122 11.442 14.319 -1.104 912 HH TYR 122 HH TYR 122 8.612 14.955 -1.167 913 H LYS 123 H LYS 123 12.525 7.265 0.281 914 HA LYS 123 HA LYS 123 11.999 5.091 -0.203 915 HB2 LYS 123 2HB LYS 123 11.210 5.417 2.672 916 HB3 LYS 123 1HB LYS 123 10.963 3.882 1.860 917 HG2 LYS 123 2HG LYS 123 13.583 5.319 2.221 918 HG3 LYS 123 1HG LYS 123 13.051 3.851 3.060 919 HD2 LYS 123 2HD LYS 123 14.126 2.740 1.440 920 HD3 LYS 123 1HD LYS 123 12.756 3.179 0.412 921 HE2 LYS 123 2HE LYS 123 14.611 3.855 -0.822 922 HE3 LYS 123 1HE LYS 123 14.054 5.341 -0.053 923 HZ1 LYS 123 3HZ LYS 123 16.513 4.911 0.028 924 HZ2 LYS 123 1HZ LYS 123 16.190 3.648 1.107 925 HZ3 LYS 123 2HZ LYS 123 15.784 5.237 1.519 926 H TYR 124 H TYR 124 9.243 5.400 1.939 927 HA TYR 124 HA TYR 124 7.324 4.168 0.497 928 HB2 TYR 124 2HB TYR 124 6.895 6.658 2.154 929 HB3 TYR 124 1HB TYR 124 5.656 5.479 1.717 930 HD1 TYR 124 2HD TYR 124 8.707 6.009 3.751 931 HD2 TYR 124 1HD TYR 124 5.424 3.448 2.919 932 HE1 TYR 124 2HE TYR 124 9.203 4.723 5.786 933 HE2 TYR 124 1HE TYR 124 5.904 2.153 4.950 934 HH TYR 124 HH TYR 124 8.161 3.228 7.322 935 H PHE 125 H PHE 125 8.645 7.320 -0.162 936 HA PHE 125 HA PHE 125 6.567 8.295 -1.826 937 HB2 PHE 125 2HB PHE 125 8.193 9.818 -0.857 938 HB3 PHE 125 1HB PHE 125 9.507 9.002 -1.713 939 HD1 PHE 125 1HD PHE 125 9.371 9.029 -4.318 940 HD2 PHE 125 2HD PHE 125 7.184 11.670 -1.790 941 HE1 PHE 125 1HE PHE 125 9.110 10.595 -6.185 942 HE2 PHE 125 2HE PHE 125 6.916 13.238 -3.666 943 HZ PHE 125 HZ PHE 125 7.880 12.696 -5.869 944 H TYR 126 H TYR 126 5.946 7.446 -3.681 945 HA TYR 126 HA TYR 126 7.893 5.961 -5.290 946 HB2 TYR 126 2HB TYR 126 4.922 5.903 -5.036 947 HB3 TYR 126 1HB TYR 126 5.633 5.455 -6.594 948 HD1 TYR 126 2HD TYR 126 5.553 4.616 -2.992 949 HD2 TYR 126 1HD TYR 126 6.686 3.348 -6.890 950 HE1 TYR 126 2HE TYR 126 6.001 2.363 -2.120 951 HE2 TYR 126 1HE TYR 126 7.141 1.090 -6.028 952 HH TYR 126 HH TYR 126 7.638 -0.027 -3.961 953 H VAL 127 H VAL 127 7.320 6.184 -7.781 954 HA VAL 127 HA VAL 127 6.333 8.583 -8.789 955 HB VAL 127 HB VAL 127 8.256 9.514 -7.478 956 HG11 VAL 127 1HG1 VAL 127 10.445 9.062 -7.915 957 HG12 VAL 127 2HG1 VAL 127 10.128 8.565 -9.578 958 HG13 VAL 127 3HG1 VAL 127 9.730 7.483 -8.244 959 HG21 VAL 127 3HG2 VAL 127 8.432 11.214 -8.911 960 HG22 VAL 127 1HG2 VAL 127 7.250 10.303 -9.851 961 HG23 VAL 127 2HG2 VAL 127 8.966 10.184 -10.239 962 H SER 128 H SER 128 5.650 7.667 -10.587 963 HA SER 128 HA SER 128 5.840 7.040 -12.810 964 HB2 SER 128 2HB SER 128 8.445 7.587 -12.390 965 HB3 SER 128 1HB SER 128 8.540 5.827 -12.565 966 HG SER 128 HG SER 128 8.611 6.409 -14.614 967 H ALA 129 H ALA 129 4.821 5.279 -13.461 968 HA ALA 129 HA ALA 129 4.386 3.053 -11.831 969 HB1 ALA 129 1HB ALA 129 3.171 4.021 -14.006 970 HB2 ALA 129 2HB ALA 129 2.929 2.376 -13.421 971 HB3 ALA 129 3HB ALA 129 4.054 2.685 -14.743 972 H GLU 130 H GLU 130 7.048 3.759 -13.866 973 HA GLU 130 HA GLU 130 7.824 1.207 -14.692 974 HB2 GLU 130 2HB GLU 130 9.052 3.849 -14.466 975 HB3 GLU 130 1HB GLU 130 10.209 2.536 -14.209 976 HG2 GLU 130 2HG GLU 130 8.379 2.327 -16.538 977 HG3 GLU 130 1HG GLU 130 9.684 3.524 -16.610 978 H GLN 131 H GLN 131 9.415 3.004 -12.049 979 HA GLN 131 HA GLN 131 10.655 0.780 -10.958 980 HB2 GLN 131 2HB GLN 131 10.906 2.078 -8.906 981 HB3 GLN 131 1HB GLN 131 11.377 2.981 -10.342 982 HG2 GLN 131 2HG GLN 131 10.135 4.610 -9.433 983 HG3 GLN 131 1HG GLN 131 8.780 3.705 -10.109 984 HE21 GLN 131 1HE2 GLN 131 9.199 5.430 -7.654 985 HE22 GLN 131 2HE2 GLN 131 8.553 4.482 -6.364 986 H VAL 132 H VAL 132 7.489 2.175 -10.170 987 HA VAL 132 HA VAL 132 6.942 0.675 -7.909 988 HB VAL 132 HB VAL 132 4.753 1.301 -8.053 989 HG11 VAL 132 1HG1 VAL 132 4.892 3.495 -8.352 990 HG12 VAL 132 2HG1 VAL 132 5.246 3.325 -10.070 991 HG13 VAL 132 3HG1 VAL 132 6.547 3.200 -8.887 992 HG21 VAL 132 3HG2 VAL 132 3.727 0.217 -9.749 993 HG22 VAL 132 1HG2 VAL 132 4.987 0.615 -10.915 994 HG23 VAL 132 2HG2 VAL 132 3.778 1.821 -10.478 995 H VAL 133 H VAL 133 7.038 -0.285 -11.231 996 HA VAL 133 HA VAL 133 5.572 -2.715 -10.869 997 HB VAL 133 HB VAL 133 6.026 -1.412 -13.090 998 HG11 VAL 133 1HG1 VAL 133 8.609 -2.045 -12.593 999 HG12 VAL 133 2HG1 VAL 133 7.962 -1.741 -14.204 1000 HG13 VAL 133 3HG1 VAL 133 8.135 -3.395 -13.619 1001 HG21 VAL 133 3HG2 VAL 133 4.711 -3.496 -12.780 1002 HG22 VAL 133 1HG2 VAL 133 6.191 -4.418 -13.043 1003 HG23 VAL 133 2HG2 VAL 133 5.542 -3.405 -14.334 1004 H GLN 134 H GLN 134 8.974 -1.761 -10.736 1005 HA GLN 134 HA GLN 134 9.859 -4.515 -10.612 1006 HB2 GLN 134 2HB GLN 134 12.054 -3.361 -9.823 1007 HB3 GLN 134 1HB GLN 134 11.530 -3.168 -11.490 1008 HG2 GLN 134 2HG GLN 134 10.665 -0.989 -11.031 1009 HG3 GLN 134 1HG GLN 134 10.974 -1.190 -9.309 1010 HE21 GLN 134 1HE2 GLN 134 12.292 -0.381 -12.372 1011 HE22 GLN 134 2HE2 GLN 134 13.894 0.034 -11.822 1012 H GLY 135 H GLY 135 9.116 -1.952 -8.355 1013 HA2 GLY 135 2HA GLY 135 10.083 -3.344 -6.044 1014 HA3 GLY 135 1HA GLY 135 9.031 -1.922 -6.051 1015 H MET 136 H MET 136 7.193 -3.463 -7.954 1016 HA MET 136 HA MET 136 5.687 -4.766 -5.817 1017 HB2 MET 136 2HB MET 136 3.774 -4.509 -7.117 1018 HB3 MET 136 1HB MET 136 4.709 -3.076 -7.515 1019 HG2 MET 136 2HG MET 136 5.403 -4.035 -9.596 1020 HG3 MET 136 1HG MET 136 4.672 -5.582 -9.182 1021 HE1 MET 136 3HE MET 136 3.759 -1.912 -8.911 1022 HE2 MET 136 1HE MET 136 2.252 -1.738 -9.808 1023 HE3 MET 136 2HE MET 136 3.781 -1.886 -10.675 1024 H LYS 137 H LYS 137 7.047 -5.462 -8.986 1025 HA LYS 137 HA LYS 137 6.204 -8.155 -9.109 1026 HB2 LYS 137 2HB LYS 137 7.442 -8.319 -11.077 1027 HB3 LYS 137 1HB LYS 137 6.978 -6.628 -11.018 1028 HG2 LYS 137 2HG LYS 137 9.290 -6.281 -9.916 1029 HG3 LYS 137 1HG LYS 137 9.661 -7.870 -10.590 1030 HD2 LYS 137 2HD LYS 137 8.823 -5.389 -12.087 1031 HD3 LYS 137 1HD LYS 137 10.381 -6.210 -12.161 1032 HE2 LYS 137 2HE LYS 137 7.868 -7.655 -12.913 1033 HE3 LYS 137 1HE LYS 137 8.650 -6.574 -14.061 1034 HZ1 LYS 137 3HZ LYS 137 9.473 -9.185 -13.130 1035 HZ2 LYS 137 1HZ LYS 137 10.721 -8.045 -13.215 1036 HZ3 LYS 137 2HZ LYS 137 9.806 -8.404 -14.592 1037 H GLU 138 H GLU 138 8.580 -6.650 -7.242 1038 HA GLU 138 HA GLU 138 10.202 -9.062 -6.981 1039 HB2 GLU 138 2HB GLU 138 11.088 -6.603 -7.184 1040 HB3 GLU 138 1HB GLU 138 10.722 -6.537 -5.461 1041 HG2 GLU 138 2HG GLU 138 12.117 -8.741 -5.380 1042 HG3 GLU 138 1HG GLU 138 12.767 -8.147 -6.916 1043 H ALA 139 H ALA 139 8.837 -6.677 -4.727 1044 HA ALA 139 HA ALA 139 8.967 -8.247 -2.437 1045 HB1 ALA 139 1HB ALA 139 7.025 -6.051 -3.139 1046 HB2 ALA 139 2HB ALA 139 8.567 -5.882 -2.298 1047 HB3 ALA 139 3HB ALA 139 7.228 -6.731 -1.525 1048 H GLN 140 H GLN 140 6.771 -8.417 -5.093 1049 HA GLN 140 HA GLN 140 4.576 -9.603 -3.834 1050 HB2 GLN 140 2HB GLN 140 3.988 -10.398 -6.114 1051 HB3 GLN 140 1HB GLN 140 4.330 -8.670 -6.021 1052 HG2 GLN 140 2HG GLN 140 5.412 -9.319 -7.944 1053 HG3 GLN 140 1HG GLN 140 6.698 -9.339 -6.744 1054 HE21 GLN 140 1HE2 GLN 140 4.138 -11.625 -7.644 1055 HE22 GLN 140 2HE2 GLN 140 5.190 -12.968 -7.904 1056 H GLU 141 H GLU 141 7.678 -10.881 -4.430 1057 HA GLU 141 HA GLU 141 6.662 -13.630 -4.309 1058 HB2 GLU 141 2HB GLU 141 8.233 -14.155 -5.799 1059 HB3 GLU 141 1HB GLU 141 8.637 -12.440 -5.898 1060 HG2 GLU 141 2HG GLU 141 10.135 -12.902 -3.878 1061 HG3 GLU 141 1HG GLU 141 9.972 -14.598 -4.321 1062 H ARG 142 H ARG 142 8.746 -11.348 -2.650 1063 HA ARG 142 HA ARG 142 9.572 -13.350 -0.715 1064 HB2 ARG 142 2HB ARG 142 10.770 -11.368 0.333 1065 HB3 ARG 142 1HB ARG 142 11.294 -11.843 -1.286 1066 HG2 ARG 142 2HG ARG 142 10.130 -10.009 -2.275 1067 HG3 ARG 142 1HG ARG 142 9.349 -9.608 -0.734 1068 HD2 ARG 142 2HD ARG 142 11.290 -8.144 -1.359 1069 HD3 ARG 142 1HD ARG 142 11.417 -8.926 0.225 1070 HE ARG 142 HE ARG 142 12.679 -10.487 -1.779 1071 HH11 ARG 142 1HH1 ARG 142 13.103 -7.605 0.143 1072 HH12 ARG 142 2HH1 ARG 142 14.832 -7.673 0.092 1073 HH21 ARG 142 1HH2 ARG 142 14.957 -10.578 -1.847 1074 HH22 ARG 142 2HH2 ARG 142 15.884 -9.361 -1.038 1075 H LEU 143 H LEU 143 7.572 -10.434 -0.796 1076 HA LEU 143 HA LEU 143 6.950 -10.496 1.980 1077 HB2 LEU 143 2HB LEU 143 6.858 -8.446 0.651 1078 HB3 LEU 143 1HB LEU 143 5.532 -9.118 -0.298 1079 HG LEU 143 HG LEU 143 4.113 -9.146 1.705 1080 HD11 LEU 143 1HD1 LEU 143 6.657 -8.542 3.010 1081 HD12 LEU 143 2HD1 LEU 143 5.195 -9.285 3.656 1082 HD13 LEU 143 3HD1 LEU 143 5.315 -7.530 3.546 1083 HD21 LEU 143 3HD2 LEU 143 3.741 -7.215 0.516 1084 HD22 LEU 143 1HD2 LEU 143 5.382 -6.618 0.762 1085 HD23 LEU 143 2HD2 LEU 143 4.215 -6.560 2.084 1086 H THR 144 H THR 144 5.838 -12.349 -0.644 1087 HA THR 144 HA THR 144 3.227 -12.822 -0.422 1088 HB THR 144 HB THR 144 3.766 -15.269 -0.789 1089 HG1 THR 144 1HG THR 144 6.408 -14.261 -0.695 1090 HG21 THR 144 3HG2 THR 144 4.329 -14.978 -2.983 1091 HG22 THR 144 1HG2 THR 144 5.433 -13.649 -2.635 1092 HG23 THR 144 2HG2 THR 144 3.690 -13.385 -2.576 1093 H GLY 145 H GLY 145 5.108 -15.270 1.287 1094 HA2 GLY 145 2HA GLY 145 3.442 -14.807 3.677 1095 HA3 GLY 145 1HA GLY 145 3.571 -16.416 2.983 1096 H ASP 146 H ASP 146 5.293 -13.863 4.659 1097 HA ASP 146 HA ASP 146 7.181 -13.844 5.923 1098 HB2 ASP 146 2HB ASP 146 6.552 -16.778 6.307 1099 HB3 ASP 146 1HB ASP 146 7.580 -15.790 7.340 1100 H ALA 147 H ALA 147 7.339 -14.650 3.021 1101 HA ALA 147 HA ALA 147 9.790 -16.254 3.040 1102 HB1 ALA 147 1HB ALA 147 7.839 -15.478 0.902 1103 HB2 ALA 147 2HB ALA 147 8.359 -17.086 1.406 1104 HB3 ALA 147 3HB ALA 147 9.453 -16.053 0.487 1105 H PHE 148 H PHE 148 9.466 -13.358 3.879 1106 HA PHE 148 HA PHE 148 11.365 -12.139 1.995 1107 HB2 PHE 148 2HB PHE 148 10.603 -9.970 2.856 1108 HB3 PHE 148 1HB PHE 148 9.240 -10.923 2.252 1109 HD1 PHE 148 2HD PHE 148 7.691 -11.999 3.843 1110 HD2 PHE 148 1HD PHE 148 10.751 -9.339 5.135 1111 HE1 PHE 148 2HE PHE 148 6.539 -11.732 6.001 1112 HE2 PHE 148 1HE PHE 148 9.607 -9.067 7.297 1113 HZ PHE 148 HZ PHE 148 7.498 -10.263 7.731 1114 H ARG 149 H ARG 149 10.772 -12.982 5.336 1115 HA ARG 149 HA ARG 149 13.023 -11.599 6.402 1116 HB2 ARG 149 2HB ARG 149 11.409 -13.884 7.540 1117 HB3 ARG 149 1HB ARG 149 12.548 -12.892 8.433 1118 HG2 ARG 149 2HG ARG 149 11.046 -10.922 7.645 1119 HG3 ARG 149 1HG ARG 149 9.846 -12.192 7.395 1120 HD2 ARG 149 2HD ARG 149 9.400 -12.245 9.568 1121 HD3 ARG 149 1HD ARG 149 11.093 -12.567 9.940 1122 HE ARG 149 HE ARG 149 10.539 -9.800 9.393 1123 HH11 ARG 149 1HH1 ARG 149 10.581 -12.275 11.851 1124 HH12 ARG 149 2HH1 ARG 149 10.748 -11.152 13.157 1125 HH21 ARG 149 1HH2 ARG 149 10.758 -8.318 11.113 1126 HH22 ARG 149 2HH2 ARG 149 10.847 -8.907 12.740 1127 H LYS 150 H LYS 150 12.376 -14.909 5.374 1128 HA LYS 150 HA LYS 150 13.728 -16.689 4.956 1129 HB2 LYS 150 2HB LYS 150 15.206 -14.325 4.102 1130 HB3 LYS 150 1HB LYS 150 16.267 -15.659 4.530 1131 HG2 LYS 150 2HG LYS 150 13.944 -16.238 2.776 1132 HG3 LYS 150 1HG LYS 150 15.313 -15.361 2.090 1133 HD2 LYS 150 2HD LYS 150 16.686 -17.158 2.192 1134 HD3 LYS 150 1HD LYS 150 15.979 -17.743 3.700 1135 HE2 LYS 150 2HE LYS 150 13.964 -18.432 2.363 1136 HE3 LYS 150 1HE LYS 150 14.887 -18.054 0.910 1137 HZ1 LYS 150 3HZ LYS 150 15.656 -20.050 2.970 1138 HZ2 LYS 150 1HZ LYS 150 16.533 -19.693 1.568 1139 HZ3 LYS 150 2HZ LYS 150 15.004 -20.407 1.451 1140 H LYS 151 H LYS 151 15.745 -17.863 5.678 1141 HA LYS 151 HA LYS 151 17.064 -16.999 8.056 1142 HB2 LYS 151 2HB LYS 151 14.557 -18.119 8.472 1143 HB3 LYS 151 1HB LYS 151 15.662 -19.456 8.760 1144 HG2 LYS 151 2HG LYS 151 16.932 -17.865 10.288 1145 HG3 LYS 151 1HG LYS 151 15.514 -16.821 10.180 1146 HD2 LYS 151 2HD LYS 151 14.795 -18.000 11.956 1147 HD3 LYS 151 1HD LYS 151 14.360 -19.210 10.748 1148 HE2 LYS 151 2HE LYS 151 15.658 -20.618 11.894 1149 HE3 LYS 151 1HE LYS 151 17.025 -19.724 11.233 1150 HZ1 LYS 151 3HZ LYS 151 17.321 -19.804 13.556 1151 HZ2 LYS 151 1HZ LYS 151 15.720 -19.350 13.866 1152 HZ3 LYS 151 2HZ LYS 151 16.807 -18.229 13.217 1153 H HIS 152 H HIS 152 18.075 -19.186 9.113 1154 HA HIS 152 HA HIS 152 19.419 -20.486 6.854 1155 HB2 HIS 152 2HB HIS 152 20.237 -20.298 9.760 1156 HB3 HIS 152 1HB HIS 152 21.176 -21.066 8.484 1157 HD1 HIS 152 1HD HIS 152 20.605 -17.855 10.111 1158 HD2 HIS 152 2HD HIS 152 22.107 -19.171 6.467 1159 HE1 HIS 152 1HE HIS 152 21.860 -15.896 9.155 1160 HE2 HIS 152 2HE HIS 152 22.836 -16.746 6.992 1161 H LEU 153 H LEU 153 18.335 -21.353 10.139 1162 HA LEU 153 HA LEU 153 17.737 -23.364 11.043 1163 HB2 LEU 153 2HB LEU 153 15.764 -24.280 10.126 1164 HB3 LEU 153 1HB LEU 153 15.711 -22.560 9.797 1165 HG LEU 153 HG LEU 153 16.873 -24.161 7.622 1166 HD11 LEU 153 1HD1 LEU 153 15.281 -25.799 8.129 1167 HD12 LEU 153 2HD1 LEU 153 14.526 -24.815 6.873 1168 HD13 LEU 153 3HD1 LEU 153 14.059 -24.603 8.561 1169 HD21 LEU 153 3HD2 LEU 153 16.486 -22.020 6.951 1170 HD22 LEU 153 1HD2 LEU 153 15.084 -21.825 8.004 1171 HD23 LEU 153 2HD2 LEU 153 14.938 -22.735 6.499 1172 H GLU 154 H GLU 154 20.158 -23.457 9.424 1173 HA GLU 154 HA GLU 154 21.642 -24.972 8.608 1174 HB2 GLU 154 2HB GLU 154 20.413 -26.186 10.699 1175 HB3 GLU 154 1HB GLU 154 20.051 -27.327 9.412 1176 HG2 GLU 154 2HG GLU 154 22.585 -27.165 8.899 1177 HG3 GLU 154 1HG GLU 154 22.695 -26.527 10.538 1178 H ASP 155 H ASP 155 21.691 -24.993 6.451 1179 HA ASP 155 HA ASP 155 20.179 -26.993 5.029 1180 HB2 ASP 155 2HB ASP 155 19.155 -24.356 5.153 1181 HB3 ASP 155 1HB ASP 155 19.805 -24.571 3.531 1182 H GLU 156 H GLU 156 21.664 -27.928 3.804 1183 HA GLU 156 HA GLU 156 23.445 -28.265 2.430 1184 HB2 GLU 156 2HB GLU 156 22.232 -25.752 1.545 1185 HB3 GLU 156 1HB GLU 156 23.946 -25.878 1.131 1186 HG2 GLU 156 2HG GLU 156 21.911 -27.999 0.491 1187 HG3 GLU 156 1HG GLU 156 22.356 -26.699 -0.613 1188 H LEU 157 H LEU 157 25.223 -28.577 3.629 1189 HA LEU 157 HA LEU 157 27.140 -26.479 3.871 1190 HB2 LEU 157 2HB LEU 157 25.327 -26.570 5.938 1191 HB3 LEU 157 1HB LEU 157 26.654 -27.532 6.560 1192 HG LEU 157 HG LEU 157 27.444 -24.963 5.349 1193 HD11 LEU 157 1HD1 LEU 157 26.492 -23.522 6.821 1194 HD12 LEU 157 2HD1 LEU 157 26.345 -24.738 8.090 1195 HD13 LEU 157 3HD1 LEU 157 25.199 -24.721 6.750 1196 HD21 LEU 157 3HD2 LEU 157 28.143 -26.561 7.792 1197 HD22 LEU 157 1HD2 LEU 157 28.746 -24.924 7.539 1198 HD23 LEU 157 2HD2 LEU 157 29.146 -26.199 6.386 Start of MODEL 25 1 H1 MET 1 1HT MET 1 -37.581 0.675 1.274 2 H2 MET 1 2HT MET 1 -36.148 1.449 0.729 3 H3 MET 1 3HT MET 1 -36.049 0.015 1.665 4 HA MET 1 HA MET 1 -35.642 -0.665 -0.466 5 HB2 MET 1 2HB MET 1 -38.454 -1.084 0.483 6 HB3 MET 1 1HB MET 1 -37.946 -1.777 -1.051 7 HG2 MET 1 2HG MET 1 -36.661 -3.343 -0.074 8 HG3 MET 1 1HG MET 1 -36.150 -2.269 1.226 9 HE1 MET 1 2HE MET 1 -38.906 -5.567 1.074 10 HE2 MET 1 3HE MET 1 -38.458 -4.556 -0.299 11 HE3 MET 1 1HE MET 1 -39.995 -4.292 0.526 12 H HIS 2 H HIS 2 -35.470 -0.054 -2.524 13 HA HIS 2 HA HIS 2 -35.799 1.027 -4.495 14 HB2 HIS 2 2HB HIS 2 -38.657 0.880 -3.538 15 HB3 HIS 2 1HB HIS 2 -38.216 1.575 -5.093 16 HD1 HIS 2 1HD HIS 2 -37.944 -0.017 -6.997 17 HD2 HIS 2 2HD HIS 2 -37.950 -1.942 -3.315 18 HE1 HIS 2 1HE HIS 2 -37.967 -2.476 -7.525 19 HE2 HIS 2 2HE HIS 2 -37.882 -3.621 -5.282 20 H HIS 3 H HIS 3 -38.347 2.703 -2.679 21 HA HIS 3 HA HIS 3 -38.619 4.883 -2.088 22 HB2 HIS 3 2HB HIS 3 -35.749 4.391 -1.747 23 HB3 HIS 3 1HB HIS 3 -36.138 6.084 -2.033 24 HD1 HIS 3 1HD HIS 3 -37.720 7.236 -0.264 25 HD2 HIS 3 2HD HIS 3 -36.401 3.430 0.755 26 HE1 HIS 3 1HE HIS 3 -38.192 6.997 2.193 27 HE2 HIS 3 2HE HIS 3 -37.458 4.657 2.772 28 H HIS 4 H HIS 4 -38.720 6.995 -2.982 29 HA HIS 4 HA HIS 4 -37.690 7.226 -5.728 30 HB2 HIS 4 2HB HIS 4 -40.312 6.772 -5.209 31 HB3 HIS 4 1HB HIS 4 -40.282 8.531 -5.169 32 HD1 HIS 4 1HD HIS 4 -40.871 9.486 -7.361 33 HD2 HIS 4 2HD HIS 4 -38.811 5.898 -7.755 34 HE1 HIS 4 1HE HIS 4 -40.690 9.083 -9.837 35 HE2 HIS 4 2HE HIS 4 -39.364 6.952 -10.052 36 H HIS 5 H HIS 5 -39.331 9.132 -3.196 37 HA HIS 5 HA HIS 5 -38.080 11.568 -4.039 38 HB2 HIS 5 2HB HIS 5 -40.342 11.041 -2.659 39 HB3 HIS 5 1HB HIS 5 -39.257 11.418 -1.325 40 HD1 HIS 5 1HD HIS 5 -39.188 13.812 -0.733 41 HD2 HIS 5 2HD HIS 5 -40.235 13.242 -4.713 42 HE1 HIS 5 1HE HIS 5 -39.653 16.110 -1.642 43 HE2 HIS 5 2HE HIS 5 -40.200 15.747 -4.074 44 H HIS 6 H HIS 6 -36.010 11.994 -3.684 45 HA HIS 6 HA HIS 6 -33.972 12.167 -2.690 46 HB2 HIS 6 2HB HIS 6 -35.829 12.145 -0.339 47 HB3 HIS 6 1HB HIS 6 -34.089 12.100 -0.070 48 HD1 HIS 6 1HD HIS 6 -36.362 14.205 -2.299 49 HD2 HIS 6 2HD HIS 6 -33.201 14.603 0.367 50 HE1 HIS 6 1HE HIS 6 -35.865 16.668 -2.211 51 HE2 HIS 6 2HE HIS 6 -34.001 16.893 -0.531 52 H HIS 7 H HIS 7 -32.414 11.006 -1.145 53 HA HIS 7 HA HIS 7 -32.941 8.345 -0.349 54 HB2 HIS 7 2HB HIS 7 -31.397 7.256 -2.048 55 HB3 HIS 7 1HB HIS 7 -32.982 7.735 -2.644 56 HD1 HIS 7 1HD HIS 7 -29.620 7.778 -3.665 57 HD2 HIS 7 2HD HIS 7 -32.698 10.565 -3.817 58 HE1 HIS 7 1HE HIS 7 -28.953 9.420 -5.451 59 HE2 HIS 7 2HE HIS 7 -30.790 11.145 -5.464 60 H MET 8 H MET 8 -30.360 10.422 -1.652 61 HA MET 8 HA MET 8 -28.983 10.632 0.784 62 HB2 MET 8 2HB MET 8 -27.032 9.230 0.363 63 HB3 MET 8 1HB MET 8 -28.500 8.247 0.409 64 HG2 MET 8 2HG MET 8 -28.524 8.355 -2.098 65 HG3 MET 8 1HG MET 8 -26.925 9.092 -2.008 66 HE1 MET 8 3HE MET 8 -24.764 7.769 -0.888 67 HE2 MET 8 1HE MET 8 -24.966 6.200 -0.107 68 HE3 MET 8 2HE MET 8 -25.788 7.621 0.539 69 H SER 9 H SER 9 -26.518 11.245 0.239 70 HA SER 9 HA SER 9 -26.603 13.030 -2.105 71 HB2 SER 9 2HB SER 9 -26.666 13.962 0.402 72 HB3 SER 9 1HB SER 9 -24.920 13.773 0.236 73 HG SER 9 HG SER 9 -24.955 15.552 -0.859 74 H ASP 10 H ASP 10 -24.599 13.460 -3.150 75 HA ASP 10 HA ASP 10 -22.917 11.192 -3.377 76 HB2 ASP 10 2HB ASP 10 -23.347 13.633 -4.796 77 HB3 ASP 10 1HB ASP 10 -21.621 13.472 -4.492 78 H GLY 11 H GLY 11 -20.696 10.975 -2.879 79 HA2 GLY 11 2HA GLY 11 -19.586 12.934 -0.995 80 HA3 GLY 11 1HA GLY 11 -19.717 11.257 -0.486 81 H HIS 12 H HIS 12 -18.616 9.644 -1.909 82 HA HIS 12 HA HIS 12 -16.209 10.789 -3.158 83 HB2 HIS 12 2HB HIS 12 -14.948 8.812 -2.269 84 HB3 HIS 12 1HB HIS 12 -15.519 9.929 -1.020 85 HD1 HIS 12 1HD HIS 12 -16.794 6.730 -2.664 86 HD2 HIS 12 2HD HIS 12 -16.686 8.628 1.031 87 HE1 HIS 12 1HE HIS 12 -17.880 5.132 -1.055 88 HE2 HIS 12 2HE HIS 12 -17.733 6.268 1.188 89 H ASN 13 H ASN 13 -15.346 9.662 -4.917 90 HA ASN 13 HA ASN 13 -16.903 7.389 -5.925 91 HB2 ASN 13 2HB ASN 13 -16.922 10.039 -7.018 92 HB3 ASN 13 1HB ASN 13 -16.154 8.953 -8.172 93 HD21 ASN 13 1HD2 ASN 13 -17.382 7.611 -9.338 94 HD22 ASN 13 2HD2 ASN 13 -19.092 7.433 -9.162 95 H GLY 14 H GLY 14 -15.664 6.896 -8.267 96 HA2 GLY 14 2HA GLY 14 -13.801 5.913 -9.177 97 HA3 GLY 14 1HA GLY 14 -12.872 7.154 -8.330 98 H LEU 15 H LEU 15 -11.208 5.653 -7.912 99 HA LEU 15 HA LEU 15 -11.743 3.983 -5.578 100 HB2 LEU 15 2HB LEU 15 -10.394 3.000 -8.090 101 HB3 LEU 15 1HB LEU 15 -10.370 2.143 -6.560 102 HG LEU 15 HG LEU 15 -13.035 2.852 -7.654 103 HD11 LEU 15 1HD1 LEU 15 -12.130 2.108 -9.687 104 HD12 LEU 15 2HD1 LEU 15 -12.939 0.698 -9.004 105 HD13 LEU 15 3HD1 LEU 15 -11.185 0.842 -8.901 106 HD21 LEU 15 3HD2 LEU 15 -13.745 1.101 -6.396 107 HD22 LEU 15 1HD2 LEU 15 -12.267 1.475 -5.509 108 HD23 LEU 15 2HD2 LEU 15 -12.282 0.157 -6.682 109 H GLY 16 H GLY 16 -8.953 4.333 -7.775 110 HA2 GLY 16 2HA GLY 16 -7.228 4.804 -5.495 111 HA3 GLY 16 1HA GLY 16 -6.716 4.654 -7.170 112 H LYS 17 H LYS 17 -9.245 6.803 -7.095 113 HA LYS 17 HA LYS 17 -9.448 9.068 -7.157 114 HB2 LYS 17 2HB LYS 17 -7.656 8.650 -5.073 115 HB3 LYS 17 1HB LYS 17 -6.840 9.821 -6.099 116 HG2 LYS 17 2HG LYS 17 -9.418 10.788 -5.954 117 HG3 LYS 17 1HG LYS 17 -9.119 10.155 -4.335 118 HD2 LYS 17 2HD LYS 17 -7.492 11.683 -3.888 119 HD3 LYS 17 1HD LYS 17 -6.968 11.775 -5.572 120 HE2 LYS 17 2HE LYS 17 -7.950 13.865 -5.091 121 HE3 LYS 17 1HE LYS 17 -9.143 12.981 -6.042 122 HZ1 LYS 17 3HZ LYS 17 -10.560 12.857 -4.313 123 HZ2 LYS 17 1HZ LYS 17 -9.713 14.216 -3.765 124 HZ3 LYS 17 2HZ LYS 17 -9.336 12.684 -3.158 125 H GLY 18 H GLY 18 -8.418 7.633 -9.350 126 HA2 GLY 18 2HA GLY 18 -7.821 8.505 -11.473 127 HA3 GLY 18 1HA GLY 18 -6.930 9.796 -10.660 128 H PHE 19 H PHE 19 -6.541 6.542 -9.564 129 HA PHE 19 HA PHE 19 -3.743 6.608 -10.176 130 HB2 PHE 19 2HB PHE 19 -5.218 5.436 -8.209 131 HB3 PHE 19 1HB PHE 19 -4.886 4.056 -9.267 132 HD1 PHE 19 1HD PHE 19 -2.182 4.875 -10.262 133 HD2 PHE 19 2HD PHE 19 -3.886 4.942 -6.364 134 HE1 PHE 19 1HE PHE 19 0.065 4.671 -9.276 135 HE2 PHE 19 2HE PHE 19 -1.646 4.733 -5.376 136 HZ PHE 19 HZ PHE 19 0.334 4.598 -6.832 137 H GLY 20 H GLY 20 -6.112 4.043 -10.810 138 HA2 GLY 20 2HA GLY 20 -5.367 3.914 -13.606 139 HA3 GLY 20 1HA GLY 20 -4.787 2.559 -12.637 140 H ASP 21 H ASP 21 -6.839 2.163 -10.896 141 HA ASP 21 HA ASP 21 -9.432 2.123 -11.888 142 HB2 ASP 21 2HB ASP 21 -8.495 0.657 -13.649 143 HB3 ASP 21 1HB ASP 21 -7.966 -0.482 -12.405 144 H HIS 22 H HIS 22 -8.694 -1.031 -10.765 145 HA HIS 22 HA HIS 22 -9.766 -0.382 -8.136 146 HB2 HIS 22 2HB HIS 22 -9.043 -3.045 -9.385 147 HB3 HIS 22 1HB HIS 22 -9.862 -2.836 -7.843 148 HD1 HIS 22 1HD HIS 22 -12.238 -1.386 -8.141 149 HD2 HIS 22 2HD HIS 22 -10.750 -3.445 -11.430 150 HE1 HIS 22 1HE HIS 22 -14.186 -1.645 -9.709 151 HE2 HIS 22 2HE HIS 22 -13.280 -2.952 -11.662 152 H ILE 23 H ILE 23 -7.180 -2.515 -9.228 153 HA ILE 23 HA ILE 23 -5.278 -3.218 -8.147 154 HB ILE 23 HB ILE 23 -4.696 -0.278 -8.225 155 HG12 ILE 23 2HG1 ILE 23 -4.029 -1.137 -10.714 156 HG13 ILE 23 1HG1 ILE 23 -5.474 -2.097 -10.415 157 HG21 ILE 23 1HG2 ILE 23 -2.582 -0.882 -8.068 158 HG22 ILE 23 2HG2 ILE 23 -2.747 -2.001 -9.421 159 HG23 ILE 23 3HG2 ILE 23 -3.119 -2.538 -7.782 160 HD11 ILE 23 3HD1 ILE 23 -5.196 0.880 -10.521 161 HD12 ILE 23 1HD1 ILE 23 -6.591 0.098 -9.780 162 HD13 ILE 23 2HD1 ILE 23 -6.233 -0.171 -11.485 163 H HIS 24 H HIS 24 -3.928 -0.716 -6.571 164 HA HIS 24 HA HIS 24 -4.367 -1.905 -4.005 165 HB2 HIS 24 2HB HIS 24 -2.837 0.619 -4.145 166 HB3 HIS 24 1HB HIS 24 -2.460 -0.896 -3.325 167 HD1 HIS 24 1HD HIS 24 -2.398 -2.758 -5.817 168 HD2 HIS 24 2HD HIS 24 -0.546 0.952 -5.572 169 HE1 HIS 24 1HE HIS 24 -0.525 -2.824 -7.498 170 HE2 HIS 24 2HE HIS 24 0.528 -0.541 -7.387 171 H TRP 25 H TRP 25 -6.681 -0.401 -5.178 172 HA TRP 25 HA TRP 25 -7.166 1.274 -2.830 173 HB2 TRP 25 2HB TRP 25 -8.430 2.757 -4.749 174 HB3 TRP 25 1HB TRP 25 -6.850 3.133 -4.053 175 HD1 TRP 25 HD TRP 25 -8.516 2.233 -7.256 176 HE1 TRP 25 1HE TRP 25 -6.763 1.977 -9.092 177 HE3 TRP 25 3HE TRP 25 -4.310 2.289 -4.374 178 HZ2 TRP 25 2HZ TRP 25 -3.947 1.861 -9.325 179 HZ3 TRP 25 3HZ TRP 25 -2.120 2.104 -5.481 180 HH2 TRP 25 HH TRP 25 -1.942 1.890 -7.904 181 H ARG 26 H ARG 26 -8.272 -1.050 -5.016 182 HA ARG 26 HA ARG 26 -10.897 -0.717 -5.445 183 HB2 ARG 26 2HB ARG 26 -9.290 -2.888 -5.413 184 HB3 ARG 26 1HB ARG 26 -10.323 -3.235 -4.028 185 HG2 ARG 26 2HG ARG 26 -11.346 -2.671 -6.789 186 HG3 ARG 26 1HG ARG 26 -11.037 -4.285 -6.117 187 HD2 ARG 26 2HD ARG 26 -13.040 -4.275 -5.164 188 HD3 ARG 26 1HD ARG 26 -12.609 -2.822 -4.248 189 HE ARG 26 HE ARG 26 -13.313 -1.705 -6.514 190 HH11 ARG 26 1HH1 ARG 26 -14.865 -4.369 -4.868 191 HH12 ARG 26 2HH1 ARG 26 -16.435 -3.999 -5.493 192 HH21 ARG 26 1HH2 ARG 26 -15.381 -1.221 -7.330 193 HH22 ARG 26 2HH2 ARG 26 -16.728 -2.214 -6.887 194 H THR 27 H THR 27 -9.571 -1.776 -2.297 195 HA THR 27 HA THR 27 -10.970 -0.284 -0.564 196 HB THR 27 HB THR 27 -13.123 -0.865 -1.309 197 HG1 THR 27 1HG THR 27 -13.964 -2.145 0.382 198 HG21 THR 27 3HG2 THR 27 -13.601 -2.672 -2.478 199 HG22 THR 27 1HG2 THR 27 -13.218 -3.705 -1.102 200 HG23 THR 27 2HG2 THR 27 -11.949 -3.237 -2.234 201 H LEU 28 H LEU 28 -10.672 -0.894 1.584 202 HA LEU 28 HA LEU 28 -8.674 -2.928 1.972 203 HB2 LEU 28 2HB LEU 28 -8.712 -0.692 3.136 204 HB3 LEU 28 1HB LEU 28 -10.077 -1.287 4.081 205 HG LEU 28 HG LEU 28 -7.562 -2.894 4.068 206 HD11 LEU 28 1HD1 LEU 28 -6.332 -1.497 5.336 207 HD12 LEU 28 2HD1 LEU 28 -7.743 -0.811 6.142 208 HD13 LEU 28 3HD1 LEU 28 -7.291 -0.256 4.531 209 HD21 LEU 28 3HD2 LEU 28 -8.441 -2.863 6.589 210 HD22 LEU 28 1HD2 LEU 28 -9.062 -3.978 5.372 211 HD23 LEU 28 2HD2 LEU 28 -9.957 -2.509 5.760 212 H GLU 29 H GLU 29 -12.073 -2.483 2.810 213 HA GLU 29 HA GLU 29 -12.447 -4.569 4.581 214 HB2 GLU 29 2HB GLU 29 -14.116 -2.797 3.744 215 HB3 GLU 29 1HB GLU 29 -14.459 -3.925 2.440 216 HG2 GLU 29 2HG GLU 29 -14.541 -5.116 5.108 217 HG3 GLU 29 1HG GLU 29 -15.742 -3.854 4.835 218 H ASP 30 H ASP 30 -12.893 -4.699 1.042 219 HA ASP 30 HA ASP 30 -13.224 -7.531 1.014 220 HB2 ASP 30 2HB ASP 30 -13.828 -5.564 -0.745 221 HB3 ASP 30 1HB ASP 30 -12.344 -6.192 -1.476 222 H GLY 31 H GLY 31 -10.495 -5.394 0.870 223 HA2 GLY 31 2HA GLY 31 -8.643 -7.140 -0.369 224 HA3 GLY 31 1HA GLY 31 -8.239 -5.767 0.669 225 H LYS 32 H LYS 32 -9.427 -6.580 3.054 226 HA LYS 32 HA LYS 32 -7.446 -8.374 4.029 227 HB2 LYS 32 2HB LYS 32 -8.682 -8.195 6.181 228 HB3 LYS 32 1HB LYS 32 -8.271 -6.637 5.477 229 HG2 LYS 32 2HG LYS 32 -10.442 -6.101 5.045 230 HG3 LYS 32 1HG LYS 32 -10.938 -7.784 4.854 231 HD2 LYS 32 2HD LYS 32 -10.295 -7.853 7.435 232 HD3 LYS 32 1HD LYS 32 -10.689 -6.137 7.312 233 HE2 LYS 32 2HE LYS 32 -12.799 -7.125 6.026 234 HE3 LYS 32 1HE LYS 32 -12.437 -8.519 7.043 235 HZ1 LYS 32 3HZ LYS 32 -12.381 -6.051 8.495 236 HZ2 LYS 32 1HZ LYS 32 -13.219 -7.482 8.832 237 HZ3 LYS 32 2HZ LYS 32 -13.887 -6.338 7.780 238 H LYS 33 H LYS 33 -10.815 -8.710 3.111 239 HA LYS 33 HA LYS 33 -11.180 -11.307 4.215 240 HB2 LYS 33 2HB LYS 33 -12.972 -9.601 3.500 241 HB3 LYS 33 1HB LYS 33 -12.719 -10.214 1.871 242 HG2 LYS 33 2HG LYS 33 -13.060 -12.522 3.277 243 HG3 LYS 33 1HG LYS 33 -14.131 -11.405 4.141 244 HD2 LYS 33 2HD LYS 33 -15.623 -11.933 2.546 245 HD3 LYS 33 1HD LYS 33 -14.696 -10.821 1.536 246 HE2 LYS 33 2HE LYS 33 -13.271 -12.819 0.896 247 HE3 LYS 33 1HE LYS 33 -14.500 -13.821 1.666 248 HZ1 LYS 33 3HZ LYS 33 -15.375 -13.807 -0.391 249 HZ2 LYS 33 1HZ LYS 33 -14.595 -12.376 -0.850 250 HZ3 LYS 33 2HZ LYS 33 -16.009 -12.309 0.076 251 H GLU 34 H GLU 34 -10.467 -10.138 0.935 252 HA GLU 34 HA GLU 34 -10.293 -12.748 -0.194 253 HB2 GLU 34 2HB GLU 34 -10.810 -10.761 -1.546 254 HB3 GLU 34 1HB GLU 34 -9.195 -10.128 -1.225 255 HG2 GLU 34 2HG GLU 34 -8.230 -11.457 -2.746 256 HG3 GLU 34 1HG GLU 34 -9.261 -12.840 -2.343 257 H ALA 35 H ALA 35 -7.843 -10.340 0.732 258 HA ALA 35 HA ALA 35 -5.549 -11.684 0.041 259 HB1 ALA 35 1HB ALA 35 -5.464 -9.427 0.856 260 HB2 ALA 35 2HB ALA 35 -4.443 -10.434 1.882 261 HB3 ALA 35 3HB ALA 35 -6.038 -9.932 2.444 262 H ALA 36 H ALA 36 -7.663 -12.247 2.768 263 HA ALA 36 HA ALA 36 -5.957 -13.892 4.293 264 HB1 ALA 36 1HB ALA 36 -8.952 -13.670 4.140 265 HB2 ALA 36 2HB ALA 36 -7.867 -13.004 5.361 266 HB3 ALA 36 3HB ALA 36 -8.128 -14.745 5.271 267 H ALA 37 H ALA 37 -8.130 -14.565 1.609 268 HA ALA 37 HA ALA 37 -8.243 -17.344 1.775 269 HB1 ALA 37 1HB ALA 37 -8.969 -15.336 -0.116 270 HB2 ALA 37 2HB ALA 37 -9.583 -16.982 0.045 271 HB3 ALA 37 3HB ALA 37 -8.174 -16.660 -0.965 272 H SER 38 H SER 38 -6.381 -15.799 -0.817 273 HA SER 38 HA SER 38 -4.597 -17.990 -1.032 274 HB2 SER 38 2HB SER 38 -5.231 -15.727 -2.568 275 HB3 SER 38 1HB SER 38 -3.515 -15.555 -2.170 276 HG SER 38 HG SER 38 -4.193 -16.857 -4.116 277 H GLY 39 H GLY 39 -4.501 -14.954 0.696 278 HA2 GLY 39 2HA GLY 39 -3.178 -14.535 2.591 279 HA3 GLY 39 1HA GLY 39 -2.142 -15.890 2.138 280 H LEU 40 H LEU 40 -3.121 -13.166 0.100 281 HA LEU 40 HA LEU 40 -0.312 -12.619 -0.413 282 HB2 LEU 40 2HB LEU 40 -1.191 -11.035 -2.135 283 HB3 LEU 40 1HB LEU 40 -1.634 -12.711 -2.379 284 HG LEU 40 HG LEU 40 -3.859 -12.101 -1.257 285 HD11 LEU 40 1HD1 LEU 40 -2.532 -9.603 -1.049 286 HD12 LEU 40 2HD1 LEU 40 -4.152 -10.039 -0.515 287 HD13 LEU 40 3HD1 LEU 40 -3.899 -9.418 -2.144 288 HD21 LEU 40 3HD2 LEU 40 -4.812 -11.703 -3.317 289 HD22 LEU 40 1HD2 LEU 40 -3.267 -12.425 -3.764 290 HD23 LEU 40 2HD2 LEU 40 -3.481 -10.677 -3.850 291 HA PRO 41 HA PRO 41 0.110 -9.194 2.304 292 HB2 PRO 41 2HB PRO 41 1.713 -7.557 0.802 293 HB3 PRO 41 1HB PRO 41 2.292 -8.978 1.677 294 HG2 PRO 41 2HG PRO 41 1.530 -8.714 -1.208 295 HG3 PRO 41 1HG PRO 41 2.955 -9.502 -0.504 296 HD2 PRO 41 2HD PRO 41 0.867 -10.952 -1.299 297 HD3 PRO 41 1HD PRO 41 1.727 -11.360 0.201 298 H LEU 42 H LEU 42 -0.280 -6.922 2.550 299 HA LEU 42 HA LEU 42 -2.500 -6.040 0.889 300 HB2 LEU 42 2HB LEU 42 -1.541 -5.478 3.620 301 HB3 LEU 42 1HB LEU 42 -2.217 -4.101 2.773 302 HG LEU 42 HG LEU 42 -3.615 -6.700 3.395 303 HD11 LEU 42 1HD1 LEU 42 -3.222 -4.645 5.051 304 HD12 LEU 42 2HD1 LEU 42 -4.701 -5.606 5.051 305 HD13 LEU 42 3HD1 LEU 42 -4.654 -4.058 4.208 306 HD21 LEU 42 3HD2 LEU 42 -5.165 -6.265 1.859 307 HD22 LEU 42 1HD2 LEU 42 -4.063 -5.066 1.185 308 HD23 LEU 42 2HD2 LEU 42 -5.285 -4.579 2.358 309 H MET 43 H MET 43 -2.469 -4.287 -0.396 310 HA MET 43 HA MET 43 0.132 -2.967 -0.752 311 HB2 MET 43 2HB MET 43 -0.920 -4.255 -2.678 312 HB3 MET 43 1HB MET 43 -2.161 -2.994 -2.724 313 HG2 MET 43 2HG MET 43 -0.354 -2.687 -4.380 314 HG3 MET 43 1HG MET 43 -0.520 -1.332 -3.265 315 HE1 MET 43 3HE MET 43 0.696 -0.820 -1.474 316 HE2 MET 43 1HE MET 43 2.316 -0.444 -2.060 317 HE3 MET 43 2HE MET 43 2.094 -1.647 -0.788 318 H VAL 44 H VAL 44 -0.132 -1.398 0.876 319 HA VAL 44 HA VAL 44 -2.420 0.387 0.576 320 HB VAL 44 HB VAL 44 -0.338 0.373 2.758 321 HG11 VAL 44 1HG1 VAL 44 -1.183 2.431 3.090 322 HG12 VAL 44 2HG1 VAL 44 -2.544 1.559 3.797 323 HG13 VAL 44 3HG1 VAL 44 -2.623 2.107 2.123 324 HG21 VAL 44 3HG2 VAL 44 -3.133 -0.513 3.220 325 HG22 VAL 44 1HG2 VAL 44 -1.638 -1.010 4.005 326 HG23 VAL 44 2HG2 VAL 44 -2.035 -1.628 2.404 327 H ILE 45 H ILE 45 -2.282 2.485 0.116 328 HA ILE 45 HA ILE 45 0.226 3.861 -0.087 329 HB ILE 45 HB ILE 45 0.309 2.722 -2.216 330 HG12 ILE 45 2HG1 ILE 45 -0.569 5.596 -2.595 331 HG13 ILE 45 1HG1 ILE 45 1.060 5.068 -2.154 332 HG21 ILE 45 1HG2 ILE 45 -2.261 3.972 -3.076 333 HG22 ILE 45 2HG2 ILE 45 -2.248 2.424 -2.232 334 HG23 ILE 45 3HG2 ILE 45 -1.397 2.601 -3.766 335 HD11 ILE 45 3HD1 ILE 45 1.574 4.470 -4.257 336 HD12 ILE 45 1HD1 ILE 45 0.295 5.613 -4.664 337 HD13 ILE 45 2HD1 ILE 45 -0.051 3.885 -4.608 338 H ILE 46 H ILE 46 -0.143 5.875 0.502 339 HA ILE 46 HA ILE 46 -2.882 6.913 0.241 340 HB ILE 46 HB ILE 46 -0.852 7.738 2.302 341 HG12 ILE 46 2HG1 ILE 46 -3.214 6.062 2.996 342 HG13 ILE 46 1HG1 ILE 46 -1.833 5.266 2.250 343 HG21 ILE 46 1HG2 ILE 46 -2.665 9.349 1.732 344 HG22 ILE 46 2HG2 ILE 46 -2.689 8.809 3.411 345 HG23 ILE 46 3HG2 ILE 46 -3.836 8.141 2.251 346 HD11 ILE 46 3HD1 ILE 46 -1.810 5.189 4.713 347 HD12 ILE 46 1HD1 ILE 46 -1.698 6.949 4.740 348 HD13 ILE 46 2HD1 ILE 46 -0.398 5.994 4.030 349 H HIS 47 H HIS 47 -3.197 9.030 -0.414 350 HA HIS 47 HA HIS 47 -0.773 10.397 -1.409 351 HB2 HIS 47 2HB HIS 47 -3.405 10.440 -2.871 352 HB3 HIS 47 1HB HIS 47 -1.814 10.944 -3.456 353 HD1 HIS 47 1HD HIS 47 -1.083 9.359 -5.188 354 HD2 HIS 47 2HD HIS 47 -3.028 7.428 -2.067 355 HE1 HIS 47 1HE HIS 47 -0.987 6.917 -5.751 356 HE2 HIS 47 2HE HIS 47 -2.131 5.760 -3.826 357 H LYS 48 H LYS 48 -0.543 12.154 -0.174 358 HA LYS 48 HA LYS 48 -2.929 13.885 0.092 359 HB2 LYS 48 2HB LYS 48 -1.254 12.807 2.184 360 HB3 LYS 48 1HB LYS 48 -1.238 14.562 2.216 361 HG2 LYS 48 2HG LYS 48 -3.703 14.551 2.261 362 HG3 LYS 48 1HG LYS 48 -3.664 12.787 2.334 363 HD2 LYS 48 2HD LYS 48 -2.103 13.196 4.388 364 HD3 LYS 48 1HD LYS 48 -2.850 14.795 4.394 365 HE2 LYS 48 2HE LYS 48 -3.957 13.086 5.866 366 HE3 LYS 48 1HE LYS 48 -5.017 13.878 4.701 367 HZ1 LYS 48 3HZ LYS 48 -3.735 11.305 4.042 368 HZ2 LYS 48 1HZ LYS 48 -5.152 11.983 3.410 369 HZ3 LYS 48 2HZ LYS 48 -5.145 11.340 4.975 370 H SER 49 H SER 49 -2.668 16.045 -0.270 371 HA SER 49 HA SER 49 -1.656 18.036 -0.792 372 HB2 SER 49 2HB SER 49 1.045 16.708 -0.860 373 HB3 SER 49 1HB SER 49 0.656 18.398 -0.544 374 HG SER 49 HG SER 49 0.399 17.931 1.485 375 H TRP 50 H TRP 50 0.162 18.760 -2.593 376 HA TRP 50 HA TRP 50 -0.962 18.354 -5.046 377 HB2 TRP 50 2HB TRP 50 1.274 19.024 -6.009 378 HB3 TRP 50 1HB TRP 50 0.635 20.108 -4.765 379 HD1 TRP 50 HD TRP 50 1.828 19.949 -2.307 380 HE1 TRP 50 1HE TRP 50 4.242 19.317 -1.675 381 HE3 TRP 50 3HE TRP 50 3.212 17.595 -6.630 382 HZ2 TRP 50 2HZ TRP 50 6.440 17.996 -2.852 383 HZ3 TRP 50 3HZ TRP 50 5.488 16.675 -6.795 384 HH2 TRP 50 HH TRP 50 7.068 16.873 -4.945 385 H CYS 51 H CYS 51 1.784 16.553 -3.701 386 HA CYS 51 HA CYS 51 2.879 14.681 -4.437 387 HB2 CYS 51 2HB CYS 51 1.395 12.720 -4.541 388 HB3 CYS 51 1HB CYS 51 0.999 13.771 -3.189 389 H GLY 52 H GLY 52 3.934 15.057 -6.376 390 HA2 GLY 52 2HA GLY 52 2.663 15.325 -8.882 391 HA3 GLY 52 1HA GLY 52 4.354 14.884 -8.648 392 H ALA 53 H ALA 53 3.714 12.533 -7.062 393 HA ALA 53 HA ALA 53 3.644 10.608 -9.079 394 HB1 ALA 53 1HB ALA 53 4.233 10.540 -6.450 395 HB2 ALA 53 2HB ALA 53 3.961 9.099 -7.431 396 HB3 ALA 53 3HB ALA 53 2.654 9.756 -6.445 397 H CYS 54 H CYS 54 1.124 12.426 -7.745 398 HA CYS 54 HA CYS 54 -0.885 10.480 -8.358 399 HB2 CYS 54 2HB CYS 54 -1.225 13.386 -7.590 400 HB3 CYS 54 1HB CYS 54 -2.487 12.146 -7.586 401 H LYS 55 H LYS 55 0.254 13.558 -9.673 402 HA LYS 55 HA LYS 55 -1.621 13.590 -11.824 403 HB2 LYS 55 2HB LYS 55 -0.104 15.345 -12.777 404 HB3 LYS 55 1HB LYS 55 -0.672 15.679 -11.147 405 HG2 LYS 55 2HG LYS 55 1.394 15.269 -10.201 406 HG3 LYS 55 1HG LYS 55 1.958 14.334 -11.596 407 HD2 LYS 55 2HD LYS 55 3.097 16.342 -11.839 408 HD3 LYS 55 1HD LYS 55 1.689 16.574 -12.880 409 HE2 LYS 55 2HE LYS 55 0.659 17.539 -10.639 410 HE3 LYS 55 1HE LYS 55 2.359 17.828 -10.269 411 HZ1 LYS 55 3HZ LYS 55 0.999 19.632 -11.488 412 HZ2 LYS 55 1HZ LYS 55 1.257 18.680 -12.863 413 HZ3 LYS 55 2HZ LYS 55 2.575 19.303 -12.005 414 H ALA 56 H ALA 56 1.605 12.285 -11.342 415 HA ALA 56 HA ALA 56 2.021 11.710 -14.131 416 HB1 ALA 56 1HB ALA 56 3.839 10.157 -12.976 417 HB2 ALA 56 2HB ALA 56 3.481 11.203 -11.602 418 HB3 ALA 56 3HB ALA 56 4.047 11.903 -13.119 419 H LEU 57 H LEU 57 0.903 9.838 -11.329 420 HA LEU 57 HA LEU 57 0.978 7.330 -12.578 421 HB2 LEU 57 2HB LEU 57 -0.616 6.602 -10.839 422 HB3 LEU 57 1HB LEU 57 0.788 7.438 -10.209 423 HG LEU 57 HG LEU 57 -0.654 9.510 -10.052 424 HD11 LEU 57 1HD1 LEU 57 -2.562 7.665 -11.226 425 HD12 LEU 57 2HD1 LEU 57 -2.614 9.419 -11.101 426 HD13 LEU 57 3HD1 LEU 57 -3.165 8.428 -9.755 427 HD21 LEU 57 3HD2 LEU 57 -1.734 8.769 -7.975 428 HD22 LEU 57 1HD2 LEU 57 -0.075 8.188 -8.100 429 HD23 LEU 57 2HD2 LEU 57 -1.419 7.095 -8.421 430 H LYS 58 H LYS 58 -1.509 9.837 -12.714 431 HA LYS 58 HA LYS 58 -3.637 8.286 -13.569 432 HB2 LYS 58 2HB LYS 58 -3.528 10.775 -15.089 433 HB3 LYS 58 1HB LYS 58 -4.733 10.197 -13.954 434 HG2 LYS 58 2HG LYS 58 -2.904 10.854 -12.189 435 HG3 LYS 58 1HG LYS 58 -2.357 11.911 -13.487 436 HD2 LYS 58 2HD LYS 58 -5.138 11.828 -12.321 437 HD3 LYS 58 1HD LYS 58 -3.910 13.049 -11.977 438 HE2 LYS 58 2HE LYS 58 -4.367 12.691 -14.827 439 HE3 LYS 58 1HE LYS 58 -5.828 13.164 -13.962 440 HZ1 LYS 58 3HZ LYS 58 -3.422 14.680 -14.489 441 HZ2 LYS 58 1HZ LYS 58 -4.018 14.833 -12.911 442 HZ3 LYS 58 2HZ LYS 58 -5.005 15.216 -14.231 443 HA PRO 59 HA PRO 59 -2.437 8.644 -18.195 444 HB2 PRO 59 2HB PRO 59 0.251 9.799 -18.318 445 HB3 PRO 59 1HB PRO 59 -1.231 10.293 -19.155 446 HG2 PRO 59 2HG PRO 59 -0.142 11.763 -17.183 447 HG3 PRO 59 1HG PRO 59 -1.894 11.676 -17.434 448 HD2 PRO 59 2HD PRO 59 -0.187 10.228 -15.439 449 HD3 PRO 59 1HD PRO 59 -1.757 11.030 -15.204 450 H LYS 60 H LYS 60 0.301 7.935 -16.040 451 HA LYS 60 HA LYS 60 1.187 5.870 -17.922 452 HB2 LYS 60 2HB LYS 60 3.180 5.666 -16.556 453 HB3 LYS 60 1HB LYS 60 2.903 7.352 -16.978 454 HG2 LYS 60 2HG LYS 60 1.611 7.318 -14.689 455 HG3 LYS 60 1HG LYS 60 2.710 5.987 -14.351 456 HD2 LYS 60 2HD LYS 60 3.556 8.226 -13.606 457 HD3 LYS 60 1HD LYS 60 4.627 7.386 -14.726 458 HE2 LYS 60 2HE LYS 60 2.720 9.094 -16.097 459 HE3 LYS 60 1HE LYS 60 3.716 9.990 -14.954 460 HZ1 LYS 60 3HZ LYS 60 5.407 9.886 -16.358 461 HZ2 LYS 60 1HZ LYS 60 4.416 9.121 -17.496 462 HZ3 LYS 60 2HZ LYS 60 5.333 8.199 -16.414 463 H PHE 61 H PHE 61 0.262 6.136 -14.462 464 HA PHE 61 HA PHE 61 0.417 3.352 -14.041 465 HB2 PHE 61 2HB PHE 61 0.327 5.196 -12.251 466 HB3 PHE 61 1HB PHE 61 -1.423 5.153 -12.485 467 HD1 PHE 61 2HD PHE 61 -2.665 3.037 -12.027 468 HD2 PHE 61 1HD PHE 61 1.441 3.529 -11.025 469 HE1 PHE 61 2HE PHE 61 -2.803 1.101 -10.515 470 HE2 PHE 61 1HE PHE 61 1.307 1.594 -9.510 471 HZ PHE 61 HZ PHE 61 -0.818 0.380 -9.251 472 H ALA 62 H ALA 62 -1.783 5.331 -15.728 473 HA ALA 62 HA ALA 62 -4.126 3.792 -15.544 474 HB1 ALA 62 1HB ALA 62 -3.022 5.813 -17.376 475 HB2 ALA 62 2HB ALA 62 -4.658 5.641 -16.738 476 HB3 ALA 62 3HB ALA 62 -4.146 4.679 -18.126 477 H GLU 63 H GLU 63 -1.051 3.329 -16.891 478 HA GLU 63 HA GLU 63 -1.543 1.311 -18.825 479 HB2 GLU 63 2HB GLU 63 0.494 2.824 -18.638 480 HB3 GLU 63 1HB GLU 63 1.002 1.826 -17.272 481 HG2 GLU 63 2HG GLU 63 1.154 -0.118 -18.696 482 HG3 GLU 63 1HG GLU 63 0.515 0.793 -20.064 483 H SER 64 H SER 64 -1.637 1.358 -15.469 484 HA SER 64 HA SER 64 -0.652 -1.125 -14.738 485 HB2 SER 64 2HB SER 64 -2.759 0.672 -13.627 486 HB3 SER 64 1HB SER 64 -2.465 -0.894 -12.893 487 HG SER 64 HG SER 64 -0.654 1.258 -13.191 488 H THR 65 H THR 65 -2.839 -0.764 -17.094 489 HA THR 65 HA THR 65 -5.019 -2.358 -16.578 490 HB THR 65 HB THR 65 -4.504 -3.178 -19.072 491 HG1 THR 65 1HG THR 65 -2.345 -2.212 -18.885 492 HG21 THR 65 3HG2 THR 65 -6.355 -1.750 -18.647 493 HG22 THR 65 1HG2 THR 65 -5.404 -1.030 -19.945 494 HG23 THR 65 2HG2 THR 65 -5.295 -0.382 -18.308 495 H GLU 66 H GLU 66 -1.683 -3.231 -17.187 496 HA GLU 66 HA GLU 66 -2.203 -6.066 -17.115 497 HB2 GLU 66 2HB GLU 66 0.251 -6.310 -17.147 498 HB3 GLU 66 1HB GLU 66 -0.313 -5.255 -18.442 499 HG2 GLU 66 2HG GLU 66 0.295 -3.775 -16.044 500 HG3 GLU 66 1HG GLU 66 1.677 -4.718 -16.596 501 H ILE 67 H ILE 67 -1.280 -3.489 -14.953 502 HA ILE 67 HA ILE 67 -0.481 -5.198 -12.803 503 HB ILE 67 HB ILE 67 -1.469 -2.351 -12.671 504 HG12 ILE 67 2HG1 ILE 67 1.350 -3.442 -12.842 505 HG13 ILE 67 1HG1 ILE 67 0.493 -2.597 -14.138 506 HG21 ILE 67 1HG2 ILE 67 -0.014 -2.395 -10.560 507 HG22 ILE 67 2HG2 ILE 67 -0.134 -4.150 -10.682 508 HG23 ILE 67 3HG2 ILE 67 -1.593 -3.177 -10.493 509 HD11 ILE 67 3HD1 ILE 67 0.491 -1.013 -11.743 510 HD12 ILE 67 1HD1 ILE 67 1.138 -0.637 -13.340 511 HD13 ILE 67 2HD1 ILE 67 2.134 -1.495 -12.166 512 H SER 68 H SER 68 -3.481 -4.459 -14.204 513 HA SER 68 HA SER 68 -5.167 -4.534 -11.939 514 HB2 SER 68 2HB SER 68 -5.637 -4.015 -14.518 515 HB3 SER 68 1HB SER 68 -6.117 -5.713 -14.511 516 HG SER 68 HG SER 68 -7.218 -3.544 -13.095 517 H GLU 69 H GLU 69 -3.725 -7.017 -13.955 518 HA GLU 69 HA GLU 69 -5.047 -9.137 -12.452 519 HB2 GLU 69 2HB GLU 69 -3.003 -9.518 -14.631 520 HB3 GLU 69 1HB GLU 69 -4.238 -10.647 -14.090 521 HG2 GLU 69 2HG GLU 69 -4.650 -8.109 -15.653 522 HG3 GLU 69 1HG GLU 69 -4.872 -9.764 -16.218 523 H LEU 70 H LEU 70 -1.870 -7.774 -13.049 524 HA LEU 70 HA LEU 70 -0.240 -9.559 -11.672 525 HB2 LEU 70 2HB LEU 70 -0.051 -6.973 -12.803 526 HB3 LEU 70 1HB LEU 70 0.573 -6.847 -11.161 527 HG LEU 70 HG LEU 70 1.583 -9.069 -12.865 528 HD11 LEU 70 1HD1 LEU 70 2.955 -6.467 -13.100 529 HD12 LEU 70 2HD1 LEU 70 1.468 -6.667 -14.033 530 HD13 LEU 70 3HD1 LEU 70 2.816 -7.785 -14.264 531 HD21 LEU 70 3HD2 LEU 70 2.607 -9.147 -10.817 532 HD22 LEU 70 1HD2 LEU 70 2.491 -7.404 -10.569 533 HD23 LEU 70 2HD2 LEU 70 3.715 -8.062 -11.656 534 H SER 71 H SER 71 -2.208 -6.900 -10.576 535 HA SER 71 HA SER 71 -1.445 -6.441 -8.021 536 HB2 SER 71 2HB SER 71 -3.937 -6.210 -9.502 537 HB3 SER 71 1HB SER 71 -4.194 -6.486 -7.779 538 HG SER 71 HG SER 71 -2.776 -4.708 -7.389 539 H HIS 72 H HIS 72 -2.675 -9.458 -9.139 540 HA HIS 72 HA HIS 72 -3.908 -10.479 -6.868 541 HB2 HIS 72 2HB HIS 72 -2.280 -11.773 -9.048 542 HB3 HIS 72 1HB HIS 72 -2.948 -12.726 -7.714 543 HD1 HIS 72 1HD HIS 72 -3.712 -12.147 -11.021 544 HD2 HIS 72 2HD HIS 72 -5.954 -11.765 -7.543 545 HE1 HIS 72 1HE HIS 72 -6.117 -12.248 -11.756 546 HE2 HIS 72 2HE HIS 72 -7.454 -11.926 -9.645 547 H ASN 73 H ASN 73 -0.731 -9.480 -7.327 548 HA ASN 73 HA ASN 73 0.703 -11.171 -5.587 549 HB2 ASN 73 2HB ASN 73 2.114 -8.889 -5.424 550 HB3 ASN 73 1HB ASN 73 2.186 -9.949 -6.837 551 HD21 ASN 73 1HD2 ASN 73 2.465 -8.562 -8.495 552 HD22 ASN 73 2HD2 ASN 73 1.415 -7.216 -8.841 553 H PHE 74 H PHE 74 -1.172 -8.271 -5.089 554 HA PHE 74 HA PHE 74 -1.310 -8.749 -2.236 555 HB2 PHE 74 2HB PHE 74 -0.963 -6.101 -2.078 556 HB3 PHE 74 1HB PHE 74 0.391 -7.233 -2.003 557 HD1 PHE 74 2HD PHE 74 -1.613 -5.541 -4.655 558 HD2 PHE 74 1HD PHE 74 2.231 -6.662 -3.214 559 HE1 PHE 74 2HE PHE 74 -0.573 -4.470 -6.606 560 HE2 PHE 74 1HE PHE 74 3.278 -5.592 -5.162 561 HZ PHE 74 HZ PHE 74 1.876 -4.497 -6.864 562 H VAL 75 H VAL 75 -2.723 -6.232 -1.678 563 HA VAL 75 HA VAL 75 -4.810 -6.222 -3.703 564 HB VAL 75 HB VAL 75 -5.274 -8.081 -2.002 565 HG11 VAL 75 1HG1 VAL 75 -6.254 -5.727 -0.397 566 HG12 VAL 75 2HG1 VAL 75 -4.862 -6.731 0.008 567 HG13 VAL 75 3HG1 VAL 75 -6.480 -7.433 -0.010 568 HG21 VAL 75 3HG2 VAL 75 -7.418 -8.022 -2.708 569 HG22 VAL 75 1HG2 VAL 75 -6.836 -6.684 -3.697 570 HG23 VAL 75 2HG2 VAL 75 -7.666 -6.363 -2.174 571 H MET 76 H MET 76 -6.275 -4.683 -3.690 572 HA MET 76 HA MET 76 -5.819 -2.122 -3.465 573 HB2 MET 76 2HB MET 76 -8.330 -1.939 -3.169 574 HB3 MET 76 1HB MET 76 -7.734 -2.881 -4.524 575 HG2 MET 76 2HG MET 76 -8.029 -4.514 -2.164 576 HG3 MET 76 1HG MET 76 -9.538 -3.708 -2.571 577 HE1 MET 76 3HE MET 76 -10.477 -7.035 -4.187 578 HE2 MET 76 1HE MET 76 -11.004 -5.643 -3.240 579 HE3 MET 76 2HE MET 76 -9.770 -6.729 -2.601 580 H VAL 77 H VAL 77 -4.961 -0.994 -1.711 581 HA VAL 77 HA VAL 77 -6.806 -0.488 0.450 582 HB VAL 77 HB VAL 77 -4.346 -0.714 1.824 583 HG11 VAL 77 1HG1 VAL 77 -5.637 -1.628 3.399 584 HG12 VAL 77 2HG1 VAL 77 -6.343 -2.805 2.289 585 HG13 VAL 77 3HG1 VAL 77 -6.961 -1.154 2.334 586 HG21 VAL 77 3HG2 VAL 77 -5.053 -3.361 0.640 587 HG22 VAL 77 1HG2 VAL 77 -3.607 -2.891 1.536 588 HG23 VAL 77 2HG2 VAL 77 -3.859 -2.301 -0.105 589 H ASN 78 H ASN 78 -6.401 1.332 -1.322 590 HA ASN 78 HA ASN 78 -4.228 3.073 -0.418 591 HB2 ASN 78 2HB ASN 78 -4.021 3.233 -2.661 592 HB3 ASN 78 1HB ASN 78 -5.668 2.714 -2.951 593 HD21 ASN 78 1HD2 ASN 78 -3.714 5.459 -1.937 594 HD22 ASN 78 2HD2 ASN 78 -4.780 6.682 -2.556 595 H LEU 79 H LEU 79 -4.656 4.552 1.020 596 HA LEU 79 HA LEU 79 -7.424 5.533 1.244 597 HB2 LEU 79 2HB LEU 79 -7.276 5.351 3.454 598 HB3 LEU 79 1HB LEU 79 -5.805 4.443 3.182 599 HG LEU 79 HG LEU 79 -4.794 6.946 3.225 600 HD11 LEU 79 1HD1 LEU 79 -6.491 7.347 5.527 601 HD12 LEU 79 2HD1 LEU 79 -7.413 7.370 4.023 602 HD13 LEU 79 3HD1 LEU 79 -6.050 8.468 4.239 603 HD21 LEU 79 3HD2 LEU 79 -4.465 4.738 4.663 604 HD22 LEU 79 1HD2 LEU 79 -5.287 5.719 5.874 605 HD23 LEU 79 2HD2 LEU 79 -3.784 6.289 5.149 606 H GLU 80 H GLU 80 -7.655 7.812 2.038 607 HA GLU 80 HA GLU 80 -5.517 9.613 1.227 608 HB2 GLU 80 2HB GLU 80 -7.321 8.949 -0.671 609 HB3 GLU 80 1HB GLU 80 -8.163 10.306 0.089 610 HG2 GLU 80 2HG GLU 80 -5.568 11.218 -0.230 611 HG3 GLU 80 1HG GLU 80 -5.887 10.290 -1.705 612 H ASP 81 H ASP 81 -6.823 11.990 1.251 613 HA ASP 81 HA ASP 81 -6.996 12.686 3.898 614 HB2 ASP 81 2HB ASP 81 -6.985 14.130 1.700 615 HB3 ASP 81 1HB ASP 81 -8.731 14.125 1.929 616 H GLU 82 H GLU 82 -9.462 11.245 1.904 617 HA GLU 82 HA GLU 82 -11.778 11.896 3.258 618 HB2 GLU 82 2HB GLU 82 -12.616 9.637 2.512 619 HB3 GLU 82 1HB GLU 82 -11.946 10.648 1.240 620 HG2 GLU 82 2HG GLU 82 -9.875 9.393 1.295 621 HG3 GLU 82 1HG GLU 82 -10.484 8.414 2.628 622 H GLU 83 H GLU 83 -9.406 9.393 4.027 623 HA GLU 83 HA GLU 83 -10.730 9.035 6.637 624 HB2 GLU 83 2HB GLU 83 -9.254 7.074 4.892 625 HB3 GLU 83 1HB GLU 83 -9.478 6.784 6.611 626 HG2 GLU 83 2HG GLU 83 -11.917 7.497 5.136 627 HG3 GLU 83 1HG GLU 83 -11.177 5.957 4.685 628 H GLU 84 H GLU 84 -9.504 9.232 8.468 629 HA GLU 84 HA GLU 84 -6.613 9.589 8.150 630 HB2 GLU 84 2HB GLU 84 -8.180 11.767 8.315 631 HB3 GLU 84 1HB GLU 84 -7.955 11.448 10.028 632 HG2 GLU 84 2HG GLU 84 -5.410 11.222 9.061 633 HG3 GLU 84 1HG GLU 84 -6.088 12.496 8.049 634 HA PRO 85 HA PRO 85 -7.846 6.732 11.686 635 HB2 PRO 85 2HB PRO 85 -5.373 5.438 10.648 636 HB3 PRO 85 1HB PRO 85 -6.907 4.704 11.157 637 HG2 PRO 85 2HG PRO 85 -6.292 4.894 8.574 638 HG3 PRO 85 1HG PRO 85 -7.956 5.185 9.138 639 HD2 PRO 85 2HD PRO 85 -5.847 7.153 8.332 640 HD3 PRO 85 1HD PRO 85 -7.597 7.176 8.004 641 H LYS 86 H LYS 86 -5.028 8.496 10.695 642 HA LYS 86 HA LYS 86 -3.382 9.553 11.849 643 HB2 LYS 86 2HB LYS 86 -5.473 9.137 13.923 644 HB3 LYS 86 1HB LYS 86 -3.856 9.581 14.480 645 HG2 LYS 86 2HG LYS 86 -3.906 11.588 13.139 646 HG3 LYS 86 1HG LYS 86 -5.466 11.126 12.456 647 HD2 LYS 86 2HD LYS 86 -5.982 11.008 15.129 648 HD3 LYS 86 1HD LYS 86 -4.824 12.338 15.050 649 HE2 LYS 86 2HE LYS 86 -6.293 13.708 14.058 650 HE3 LYS 86 1HE LYS 86 -6.875 12.446 12.973 651 HZ1 LYS 86 3HZ LYS 86 -7.730 12.957 15.764 652 HZ2 LYS 86 1HZ LYS 86 -8.149 11.558 14.908 653 HZ3 LYS 86 2HZ LYS 86 -8.668 13.072 14.361 654 H ASP 87 H ASP 87 -1.631 8.278 11.561 655 HA ASP 87 HA ASP 87 -0.394 7.020 13.682 656 HB2 ASP 87 2HB ASP 87 -2.461 5.385 12.722 657 HB3 ASP 87 1HB ASP 87 -0.977 4.686 12.059 658 H GLU 88 H GLU 88 1.165 5.104 12.614 659 HA GLU 88 HA GLU 88 2.879 6.577 10.879 660 HB2 GLU 88 2HB GLU 88 2.941 3.962 12.253 661 HB3 GLU 88 1HB GLU 88 3.908 4.078 10.788 662 HG2 GLU 88 2HG GLU 88 5.354 4.654 12.515 663 HG3 GLU 88 1HG GLU 88 4.892 6.190 11.789 664 H ASP 89 H ASP 89 0.196 4.582 10.311 665 HA ASP 89 HA ASP 89 0.808 3.250 7.973 666 HB2 ASP 89 2HB ASP 89 -1.781 4.451 8.942 667 HB3 ASP 89 1HB ASP 89 -1.676 3.509 7.447 668 H PHE 90 H PHE 90 0.752 6.628 8.420 669 HA PHE 90 HA PHE 90 0.219 7.169 5.598 670 HB2 PHE 90 2HB PHE 90 0.820 9.075 7.880 671 HB3 PHE 90 1HB PHE 90 0.392 9.552 6.231 672 HD1 PHE 90 1HD PHE 90 -1.894 8.828 5.356 673 HD2 PHE 90 2HD PHE 90 -0.817 8.727 9.469 674 HE1 PHE 90 1HE PHE 90 -4.274 8.815 5.975 675 HE2 PHE 90 2HE PHE 90 -3.192 8.710 10.095 676 HZ PHE 90 HZ PHE 90 -4.923 8.758 8.350 677 H SER 91 H SER 91 2.765 7.743 8.011 678 HA SER 91 HA SER 91 4.820 7.328 6.019 679 HB2 SER 91 2HB SER 91 4.117 9.816 5.964 680 HB3 SER 91 1HB SER 91 4.917 9.928 7.540 681 HG SER 91 HG SER 91 6.221 8.821 5.291 682 HA PRO 92 HA PRO 92 6.012 5.802 10.183 683 HB2 PRO 92 2HB PRO 92 7.215 3.545 9.312 684 HB3 PRO 92 1HB PRO 92 5.457 3.663 9.525 685 HG2 PRO 92 2HG PRO 92 7.088 3.877 7.022 686 HG3 PRO 92 1HG PRO 92 5.555 3.028 7.290 687 HD2 PRO 92 2HD PRO 92 5.723 5.479 6.109 688 HD3 PRO 92 1HD PRO 92 4.314 4.945 7.043 689 H ASP 93 H ASP 93 7.871 6.070 7.211 690 HA ASP 93 HA ASP 93 10.060 7.299 8.619 691 HB2 ASP 93 2HB ASP 93 10.155 4.504 8.189 692 HB3 ASP 93 1HB ASP 93 11.267 5.229 7.019 693 H GLY 94 H GLY 94 8.124 7.898 6.478 694 HA2 GLY 94 2HA GLY 94 9.842 8.106 4.114 695 HA3 GLY 94 1HA GLY 94 8.106 8.426 4.171 696 H GLY 95 H GLY 95 7.433 10.402 5.361 697 HA2 GLY 95 2HA GLY 95 8.581 12.482 6.376 698 HA3 GLY 95 1HA GLY 95 9.377 12.535 4.802 699 H TYR 96 H TYR 96 7.715 12.445 2.885 700 HA TYR 96 HA TYR 96 5.997 14.695 3.305 701 HB2 TYR 96 2HB TYR 96 5.858 14.927 1.049 702 HB3 TYR 96 1HB TYR 96 7.363 14.004 1.151 703 HD1 TYR 96 2HD TYR 96 3.685 13.559 0.672 704 HD2 TYR 96 1HD TYR 96 7.590 12.060 -0.144 705 HE1 TYR 96 2HE TYR 96 2.724 11.896 -0.861 706 HE2 TYR 96 1HE TYR 96 6.621 10.392 -1.682 707 HH TYR 96 HH TYR 96 4.542 9.284 -2.126 708 H ILE 97 H ILE 97 3.933 14.825 3.545 709 HA ILE 97 HA ILE 97 2.439 12.488 4.222 710 HB ILE 97 HB ILE 97 0.764 14.011 5.034 711 HG12 ILE 97 2HG1 ILE 97 0.396 15.707 3.492 712 HG13 ILE 97 1HG1 ILE 97 1.299 16.532 4.750 713 HG21 ILE 97 1HG2 ILE 97 3.231 13.842 6.018 714 HG22 ILE 97 2HG2 ILE 97 1.962 14.816 6.760 715 HG23 ILE 97 3HG2 ILE 97 3.163 15.580 5.718 716 HD11 ILE 97 3HD1 ILE 97 2.594 15.466 2.263 717 HD12 ILE 97 1HD1 ILE 97 3.275 16.569 3.459 718 HD13 ILE 97 2HD1 ILE 97 1.961 17.102 2.415 719 HA PRO 98 HA PRO 98 1.752 10.515 3.476 720 HB2 PRO 98 2HB PRO 98 -0.873 9.941 2.052 721 HB3 PRO 98 1HB PRO 98 -0.160 9.061 3.433 722 HG2 PRO 98 2HG PRO 98 -1.661 11.489 3.462 723 HG3 PRO 98 1HG PRO 98 -0.929 10.613 4.838 724 HD2 PRO 98 2HD PRO 98 0.072 12.909 4.244 725 HD3 PRO 98 1HD PRO 98 1.202 11.562 4.450 726 H ARG 99 H ARG 99 2.499 8.530 2.517 727 HA ARG 99 HA ARG 99 2.722 8.645 -0.427 728 HB2 ARG 99 2HB ARG 99 4.943 7.391 1.072 729 HB3 ARG 99 1HB ARG 99 4.977 8.393 -0.383 730 HG2 ARG 99 2HG ARG 99 5.538 10.169 0.808 731 HG3 ARG 99 1HG ARG 99 4.147 9.975 1.859 732 HD2 ARG 99 2HD ARG 99 5.392 9.148 3.505 733 HD3 ARG 99 1HD ARG 99 6.238 8.048 2.420 734 HE ARG 99 HE ARG 99 7.219 10.486 3.428 735 HH11 ARG 99 1HH1 ARG 99 7.136 8.664 0.457 736 HH12 ARG 99 2HH1 ARG 99 8.660 9.269 -0.099 737 HH21 ARG 99 1HH2 ARG 99 9.224 11.278 2.700 738 HH22 ARG 99 2HH2 ARG 99 9.847 10.743 1.178 739 H ILE 100 H ILE 100 4.081 6.358 -0.946 740 HA ILE 100 HA ILE 100 2.028 4.369 -0.635 741 HB ILE 100 HB ILE 100 3.098 3.121 -2.233 742 HG12 ILE 100 2HG1 ILE 100 5.709 4.235 -1.195 743 HG13 ILE 100 1HG1 ILE 100 5.127 2.582 -1.071 744 HG21 ILE 100 1HG2 ILE 100 2.823 5.679 -2.818 745 HG22 ILE 100 2HG2 ILE 100 3.533 4.541 -3.960 746 HG23 ILE 100 3HG2 ILE 100 4.575 5.583 -2.991 747 HD11 ILE 100 3HD1 ILE 100 5.478 2.187 -3.372 748 HD12 ILE 100 1HD1 ILE 100 6.926 2.995 -2.771 749 HD13 ILE 100 2HD1 ILE 100 5.734 3.901 -3.699 750 H LEU 101 H LEU 101 1.946 2.622 0.687 751 HA LEU 101 HA LEU 101 4.279 2.025 2.370 752 HB2 LEU 101 2HB LEU 101 1.580 2.932 3.193 753 HB3 LEU 101 1HB LEU 101 2.338 1.697 4.172 754 HG LEU 101 HG LEU 101 4.276 3.195 4.524 755 HD11 LEU 101 1HD1 LEU 101 2.826 4.810 2.561 756 HD12 LEU 101 2HD1 LEU 101 4.536 4.803 2.990 757 HD13 LEU 101 3HD1 LEU 101 3.387 5.706 3.970 758 HD21 LEU 101 3HD2 LEU 101 1.631 3.446 5.556 759 HD22 LEU 101 1HD2 LEU 101 2.388 5.037 5.519 760 HD23 LEU 101 2HD2 LEU 101 3.169 3.709 6.375 761 H PHE 102 H PHE 102 4.771 -0.103 2.207 762 HA PHE 102 HA PHE 102 2.632 -1.977 1.469 763 HB2 PHE 102 2HB PHE 102 5.622 -2.375 1.675 764 HB3 PHE 102 1HB PHE 102 4.474 -3.588 1.123 765 HD1 PHE 102 2HD PHE 102 5.406 -0.052 0.363 766 HD2 PHE 102 1HD PHE 102 4.249 -3.864 -1.135 767 HE1 PHE 102 2HE PHE 102 5.628 0.789 -1.938 768 HE2 PHE 102 1HE PHE 102 4.471 -3.029 -3.439 769 HZ PHE 102 HZ PHE 102 5.161 -0.701 -3.843 770 H LEU 103 H LEU 103 1.994 -3.700 2.799 771 HA LEU 103 HA LEU 103 3.373 -4.059 5.337 772 HB2 LEU 103 2HB LEU 103 0.808 -3.998 6.260 773 HB3 LEU 103 1HB LEU 103 1.993 -2.733 6.444 774 HG LEU 103 HG LEU 103 1.088 -1.507 4.586 775 HD11 LEU 103 1HD1 LEU 103 0.046 -2.514 2.910 776 HD12 LEU 103 2HD1 LEU 103 -1.273 -2.971 3.987 777 HD13 LEU 103 3HD1 LEU 103 0.113 -4.044 3.785 778 HD21 LEU 103 3HD2 LEU 103 -0.335 -2.102 6.954 779 HD22 LEU 103 1HD2 LEU 103 -1.514 -1.993 5.651 780 HD23 LEU 103 2HD2 LEU 103 -0.422 -0.645 5.966 781 H ASP 104 H ASP 104 1.822 -5.613 6.740 782 HA ASP 104 HA ASP 104 1.672 -8.030 5.140 783 HB2 ASP 104 2HB ASP 104 2.023 -7.375 7.977 784 HB3 ASP 104 1HB ASP 104 0.950 -8.755 7.700 785 HA PRO 105 HA PRO 105 -2.650 -8.356 4.421 786 HB2 PRO 105 2HB PRO 105 -2.439 -11.053 5.683 787 HB3 PRO 105 1HB PRO 105 -3.124 -10.587 4.114 788 HG2 PRO 105 2HG PRO 105 -0.735 -11.764 4.277 789 HG3 PRO 105 1HG PRO 105 -1.049 -10.472 3.097 790 HD2 PRO 105 2HD PRO 105 0.492 -10.383 5.645 791 HD3 PRO 105 1HD PRO 105 0.757 -9.496 4.132 792 H SER 106 H SER 106 -3.451 -6.888 5.888 793 HA SER 106 HA SER 106 -5.345 -7.529 7.667 794 HB2 SER 106 2HB SER 106 -2.677 -7.877 8.932 795 HB3 SER 106 1HB SER 106 -3.897 -7.020 9.889 796 HG SER 106 HG SER 106 -3.661 -9.586 9.664 797 H GLY 107 H GLY 107 -2.671 -5.469 6.909 798 HA2 GLY 107 2HA GLY 107 -3.054 -3.155 6.398 799 HA3 GLY 107 1HA GLY 107 -4.311 -3.137 7.640 800 H LYS 108 H LYS 108 -1.129 -4.607 8.009 801 HA LYS 108 HA LYS 108 -0.593 -2.630 10.138 802 HB2 LYS 108 2HB LYS 108 -0.453 -5.449 10.101 803 HB3 LYS 108 1HB LYS 108 1.206 -4.876 10.198 804 HG2 LYS 108 2HG LYS 108 -0.479 -3.401 12.008 805 HG3 LYS 108 1HG LYS 108 -0.624 -5.145 12.284 806 HD2 LYS 108 2HD LYS 108 2.065 -4.873 11.990 807 HD3 LYS 108 1HD LYS 108 1.647 -3.334 12.746 808 HE2 LYS 108 2HE LYS 108 0.300 -4.775 14.409 809 HE3 LYS 108 1HE LYS 108 1.261 -6.117 13.791 810 HZ1 LYS 108 3HZ LYS 108 2.077 -3.847 15.433 811 HZ2 LYS 108 1HZ LYS 108 3.193 -4.406 14.292 812 HZ3 LYS 108 2HZ LYS 108 2.598 -5.456 15.477 813 H VAL 109 H VAL 109 0.422 -0.975 9.008 814 HA VAL 109 HA VAL 109 2.272 -1.274 6.957 815 HB VAL 109 HB VAL 109 1.173 0.888 7.954 816 HG11 VAL 109 1HG1 VAL 109 2.423 0.722 10.107 817 HG12 VAL 109 2HG1 VAL 109 2.658 2.251 9.260 818 HG13 VAL 109 3HG1 VAL 109 3.913 1.014 9.208 819 HG21 VAL 109 3HG2 VAL 109 3.624 1.868 7.004 820 HG22 VAL 109 1HG2 VAL 109 2.143 1.589 6.091 821 HG23 VAL 109 2HG2 VAL 109 3.363 0.323 6.198 822 H HIS 110 H HIS 110 4.281 -1.779 6.768 823 HA HIS 110 HA HIS 110 6.001 -1.851 9.134 824 HB2 HIS 110 2HB HIS 110 5.049 -4.162 8.497 825 HB3 HIS 110 1HB HIS 110 6.068 -4.047 7.066 826 HD1 HIS 110 1HD HIS 110 8.701 -3.177 8.011 827 HD2 HIS 110 2HD HIS 110 6.324 -5.703 10.298 828 HE1 HIS 110 1HE HIS 110 10.280 -4.351 9.576 829 HE2 HIS 110 2HE HIS 110 8.807 -5.799 11.018 830 HA PRO 111 HA PRO 111 8.426 0.479 6.199 831 HB2 PRO 111 2HB PRO 111 10.734 0.561 7.676 832 HB3 PRO 111 1HB PRO 111 9.354 1.632 7.943 833 HG2 PRO 111 2HG PRO 111 10.135 -0.851 9.407 834 HG3 PRO 111 1HG PRO 111 9.495 0.672 10.045 835 HD2 PRO 111 2HD PRO 111 7.963 -1.535 9.730 836 HD3 PRO 111 1HD PRO 111 7.319 0.111 9.533 837 H GLU 112 H GLU 112 8.156 -2.321 5.753 838 HA GLU 112 HA GLU 112 10.847 -3.348 5.352 839 HB2 GLU 112 2HB GLU 112 8.920 -4.781 6.139 840 HB3 GLU 112 1HB GLU 112 8.237 -4.622 4.527 841 HG2 GLU 112 2HG GLU 112 10.211 -5.682 3.574 842 HG3 GLU 112 1HG GLU 112 10.917 -5.825 5.182 843 H ILE 113 H ILE 113 7.982 -3.062 3.222 844 HA ILE 113 HA ILE 113 9.834 -2.674 0.981 845 HB ILE 113 HB ILE 113 6.910 -3.089 0.557 846 HG12 ILE 113 2HG1 ILE 113 8.198 -5.605 0.339 847 HG13 ILE 113 1HG1 ILE 113 8.613 -4.953 1.929 848 HG21 ILE 113 1HG2 ILE 113 8.655 -2.517 -1.232 849 HG22 ILE 113 2HG2 ILE 113 7.537 -3.843 -1.551 850 HG23 ILE 113 3HG2 ILE 113 9.190 -4.186 -1.038 851 HD11 ILE 113 3HD1 ILE 113 5.995 -5.800 0.841 852 HD12 ILE 113 1HD1 ILE 113 6.018 -4.464 1.992 853 HD13 ILE 113 2HD1 ILE 113 6.689 -6.030 2.446 854 H ILE 114 H ILE 114 10.180 -0.756 0.285 855 HA ILE 114 HA ILE 114 8.094 1.309 0.490 856 HB ILE 114 HB ILE 114 10.140 2.915 0.561 857 HG12 ILE 114 2HG1 ILE 114 11.464 0.372 0.755 858 HG13 ILE 114 1HG1 ILE 114 12.165 1.974 0.685 859 HG21 ILE 114 1HG2 ILE 114 9.537 1.369 3.061 860 HG22 ILE 114 2HG2 ILE 114 8.398 2.491 2.319 861 HG23 ILE 114 3HG2 ILE 114 9.959 3.075 2.900 862 HD11 ILE 114 3HD1 ILE 114 12.874 0.619 2.630 863 HD12 ILE 114 1HD1 ILE 114 11.212 0.668 3.216 864 HD13 ILE 114 2HD1 ILE 114 12.137 2.162 3.062 865 H ASN 115 H ASN 115 11.318 1.304 -0.975 866 HA ASN 115 HA ASN 115 10.700 0.871 -3.620 867 HB2 ASN 115 2HB ASN 115 9.221 2.820 -3.497 868 HB3 ASN 115 1HB ASN 115 10.552 3.807 -2.879 869 HD21 ASN 115 1HD2 ASN 115 9.648 5.022 -4.834 870 HD22 ASN 115 2HD2 ASN 115 10.459 4.721 -6.348 871 H GLU 116 H GLU 116 12.789 0.074 -2.315 872 HA GLU 116 HA GLU 116 15.017 1.636 -1.949 873 HB2 GLU 116 2HB GLU 116 14.740 -1.223 -2.853 874 HB3 GLU 116 1HB GLU 116 16.320 -0.486 -2.554 875 HG2 GLU 116 2HG GLU 116 14.123 -0.541 -0.506 876 HG3 GLU 116 1HG GLU 116 15.320 -1.824 -0.664 877 H ASN 117 H ASN 117 13.598 0.621 -4.951 878 HA ASN 117 HA ASN 117 15.914 1.253 -6.537 879 HB2 ASN 117 2HB ASN 117 14.235 0.958 -8.443 880 HB3 ASN 117 1HB ASN 117 14.567 -0.459 -7.440 881 HD21 ASN 117 1HD2 ASN 117 12.243 1.912 -8.394 882 HD22 ASN 117 2HD2 ASN 117 10.868 1.186 -7.607 883 H GLY 118 H GLY 118 13.429 3.058 -5.100 884 HA2 GLY 118 2HA GLY 118 13.215 5.091 -7.128 885 HA3 GLY 118 1HA GLY 118 12.574 5.171 -5.484 886 H ASN 119 H ASN 119 13.302 7.041 -4.687 887 HA ASN 119 HA ASN 119 15.981 7.974 -5.274 888 HB2 ASN 119 2HB ASN 119 13.496 9.146 -4.341 889 HB3 ASN 119 1HB ASN 119 14.859 9.659 -3.337 890 HD21 ASN 119 1HD2 ASN 119 14.648 11.770 -4.115 891 HD22 ASN 119 2HD2 ASN 119 15.200 12.211 -5.708 892 HA PRO 120 HA PRO 120 17.715 6.462 -1.482 893 HB2 PRO 120 2HB PRO 120 20.050 7.744 -1.504 894 HB3 PRO 120 1HB PRO 120 19.650 6.561 -2.767 895 HG2 PRO 120 2HG PRO 120 19.589 9.550 -2.871 896 HG3 PRO 120 1HG PRO 120 20.113 8.390 -4.112 897 HD2 PRO 120 2HD PRO 120 17.620 9.637 -4.006 898 HD3 PRO 120 1HD PRO 120 18.004 8.168 -4.935 899 H SER 121 H SER 121 15.859 8.794 -1.239 900 HA SER 121 HA SER 121 16.485 9.535 1.415 901 HB2 SER 121 2HB SER 121 17.875 11.074 -0.395 902 HB3 SER 121 1HB SER 121 16.415 12.041 -0.129 903 HG SER 121 HG SER 121 18.424 12.146 1.370 904 H TYR 122 H TYR 122 14.372 8.391 -0.022 905 HA TYR 122 HA TYR 122 12.195 10.030 0.866 906 HB2 TYR 122 2HB TYR 122 13.029 10.032 -1.925 907 HB3 TYR 122 1HB TYR 122 11.354 9.522 -1.729 908 HD1 TYR 122 1HD TYR 122 9.693 11.085 -0.783 909 HD2 TYR 122 2HD TYR 122 13.717 12.279 -1.468 910 HE1 TYR 122 1HE TYR 122 9.022 13.440 -0.574 911 HE2 TYR 122 2HE TYR 122 13.060 14.638 -1.258 912 HH TYR 122 HH TYR 122 11.157 15.924 -0.105 913 H LYS 123 H LYS 123 13.231 7.234 -1.020 914 HA LYS 123 HA LYS 123 12.425 5.114 -1.224 915 HB2 LYS 123 2HB LYS 123 12.104 5.805 1.662 916 HB3 LYS 123 1HB LYS 123 11.449 4.280 1.090 917 HG2 LYS 123 2HG LYS 123 14.315 5.194 0.983 918 HG3 LYS 123 1HG LYS 123 13.628 3.883 1.960 919 HD2 LYS 123 2HD LYS 123 14.199 2.507 0.305 920 HD3 LYS 123 1HD LYS 123 12.897 3.245 -0.638 921 HE2 LYS 123 2HE LYS 123 14.504 3.760 -2.100 922 HE3 LYS 123 1HE LYS 123 14.921 5.044 -0.968 923 HZ1 LYS 123 3HZ LYS 123 16.579 3.058 -1.822 924 HZ2 LYS 123 1HZ LYS 123 16.126 2.542 -0.274 925 HZ3 LYS 123 2HZ LYS 123 16.841 4.060 -0.485 926 H TYR 124 H TYR 124 9.987 5.794 1.172 927 HA TYR 124 HA TYR 124 7.856 4.623 0.051 928 HB2 TYR 124 2HB TYR 124 7.785 7.217 1.597 929 HB3 TYR 124 1HB TYR 124 6.416 6.122 1.366 930 HD1 TYR 124 2HD TYR 124 9.691 6.544 3.008 931 HD2 TYR 124 1HD TYR 124 6.219 4.116 2.668 932 HE1 TYR 124 2HE TYR 124 10.368 5.304 5.021 933 HE2 TYR 124 1HE TYR 124 6.881 2.873 4.682 934 HH TYR 124 HH TYR 124 8.783 2.401 6.015 935 H PHE 125 H PHE 125 9.225 7.630 -1.052 936 HA PHE 125 HA PHE 125 6.919 8.414 -2.584 937 HB2 PHE 125 2HB PHE 125 8.446 10.145 -1.856 938 HB3 PHE 125 1HB PHE 125 9.800 9.338 -2.655 939 HD1 PHE 125 1HD PHE 125 6.377 10.495 -3.626 940 HD2 PHE 125 2HD PHE 125 10.529 10.370 -4.552 941 HE1 PHE 125 1HE PHE 125 5.958 11.799 -5.669 942 HE2 PHE 125 2HE PHE 125 10.117 11.675 -6.597 943 HZ PHE 125 HZ PHE 125 7.829 12.390 -7.157 944 H TYR 126 H TYR 126 6.615 8.202 -4.807 945 HA TYR 126 HA TYR 126 8.528 6.489 -6.233 946 HB2 TYR 126 2HB TYR 126 6.710 5.196 -7.218 947 HB3 TYR 126 1HB TYR 126 6.652 5.089 -5.453 948 HD1 TYR 126 1HD TYR 126 5.117 6.981 -4.340 949 HD2 TYR 126 2HD TYR 126 4.720 5.526 -8.317 950 HE1 TYR 126 1HE TYR 126 2.772 7.722 -4.370 951 HE2 TYR 126 2HE TYR 126 2.374 6.262 -8.360 952 HH TYR 126 HH TYR 126 0.592 6.807 -6.870 953 H VAL 127 H VAL 127 7.730 6.377 -8.667 954 HA VAL 127 HA VAL 127 6.495 8.740 -9.692 955 HB VAL 127 HB VAL 127 8.600 9.368 -11.038 956 HG11 VAL 127 1HG1 VAL 127 9.097 11.075 -9.540 957 HG12 VAL 127 2HG1 VAL 127 8.822 10.051 -8.132 958 HG13 VAL 127 3HG1 VAL 127 7.455 10.612 -9.093 959 HG21 VAL 127 3HG2 VAL 127 10.719 8.993 -9.785 960 HG22 VAL 127 1HG2 VAL 127 10.018 7.522 -10.461 961 HG23 VAL 127 2HG2 VAL 127 9.849 7.870 -8.741 962 H SER 128 H SER 128 5.238 7.468 -10.941 963 HA SER 128 HA SER 128 4.707 6.565 -12.988 964 HB2 SER 128 2HB SER 128 6.244 6.225 -14.662 965 HB3 SER 128 1HB SER 128 7.172 7.319 -13.622 966 HG SER 128 HG SER 128 8.173 5.239 -14.392 967 H ALA 129 H ALA 129 3.921 4.603 -13.487 968 HA ALA 129 HA ALA 129 3.965 2.595 -11.534 969 HB1 ALA 129 1HB ALA 129 3.173 1.715 -14.209 970 HB2 ALA 129 2HB ALA 129 2.369 3.184 -13.657 971 HB3 ALA 129 3HB ALA 129 2.270 1.708 -12.695 972 H GLU 130 H GLU 130 6.158 3.243 -14.079 973 HA GLU 130 HA GLU 130 7.048 0.721 -14.804 974 HB2 GLU 130 2HB GLU 130 7.925 3.394 -15.133 975 HB3 GLU 130 1HB GLU 130 9.308 2.472 -14.533 976 HG2 GLU 130 2HG GLU 130 9.020 0.863 -16.352 977 HG3 GLU 130 1HG GLU 130 7.640 1.796 -16.954 978 H GLN 131 H GLN 131 8.451 2.798 -12.243 979 HA GLN 131 HA GLN 131 10.055 0.675 -11.257 980 HB2 GLN 131 2HB GLN 131 10.230 2.179 -9.209 981 HB3 GLN 131 1HB GLN 131 10.943 2.734 -10.717 982 HG2 GLN 131 2HG GLN 131 9.555 4.485 -10.873 983 HG3 GLN 131 1HG GLN 131 8.163 3.564 -10.306 984 HE21 GLN 131 1HE2 GLN 131 10.529 5.845 -9.519 985 HE22 GLN 131 2HE2 GLN 131 10.172 5.999 -7.835 986 H VAL 132 H VAL 132 6.967 2.081 -10.215 987 HA VAL 132 HA VAL 132 6.695 0.661 -7.840 988 HB VAL 132 HB VAL 132 4.521 1.340 -7.736 989 HG11 VAL 132 1HG1 VAL 132 4.600 3.523 -8.186 990 HG12 VAL 132 2HG1 VAL 132 4.868 3.260 -9.908 991 HG13 VAL 132 3HG1 VAL 132 6.222 3.175 -8.783 992 HG21 VAL 132 3HG2 VAL 132 3.347 0.141 -9.292 993 HG22 VAL 132 1HG2 VAL 132 4.379 0.656 -10.626 994 HG23 VAL 132 2HG2 VAL 132 3.190 1.768 -9.952 995 H VAL 133 H VAL 133 6.468 -0.418 -11.109 996 HA VAL 133 HA VAL 133 5.004 -2.810 -10.469 997 HB VAL 133 HB VAL 133 5.011 -1.629 -12.751 998 HG11 VAL 133 1HG1 VAL 133 6.875 -1.571 -13.960 999 HG12 VAL 133 2HG1 VAL 133 7.046 -3.322 -13.844 1000 HG13 VAL 133 3HG1 VAL 133 7.743 -2.285 -12.604 1001 HG21 VAL 133 3HG2 VAL 133 4.607 -3.730 -13.902 1002 HG22 VAL 133 1HG2 VAL 133 3.935 -3.782 -12.272 1003 HG23 VAL 133 2HG2 VAL 133 5.452 -4.608 -12.626 1004 H GLN 134 H GLN 134 8.388 -1.853 -10.785 1005 HA GLN 134 HA GLN 134 9.275 -4.619 -10.768 1006 HB2 GLN 134 2HB GLN 134 11.558 -3.472 -10.289 1007 HB3 GLN 134 1HB GLN 134 10.819 -3.281 -11.873 1008 HG2 GLN 134 2HG GLN 134 10.034 -1.097 -11.310 1009 HG3 GLN 134 1HG GLN 134 10.574 -1.288 -9.644 1010 HE21 GLN 134 1HE2 GLN 134 11.770 -1.312 -12.975 1011 HE22 GLN 134 2HE2 GLN 134 13.312 -0.585 -12.611 1012 H GLY 135 H GLY 135 9.030 -1.965 -8.472 1013 HA2 GLY 135 2HA GLY 135 10.191 -3.410 -6.295 1014 HA3 GLY 135 1HA GLY 135 9.267 -1.906 -6.183 1015 H MET 136 H MET 136 7.096 -3.442 -7.805 1016 HA MET 136 HA MET 136 5.830 -4.558 -5.408 1017 HB2 MET 136 2HB MET 136 3.742 -4.277 -6.497 1018 HB3 MET 136 1HB MET 136 4.659 -2.813 -6.796 1019 HG2 MET 136 2HG MET 136 3.822 -3.186 -8.870 1020 HG3 MET 136 1HG MET 136 5.334 -4.080 -8.990 1021 HE1 MET 136 3HE MET 136 1.916 -3.763 -9.301 1022 HE2 MET 136 1HE MET 136 1.097 -5.237 -8.778 1023 HE3 MET 136 2HE MET 136 1.686 -5.095 -10.436 1024 H LYS 137 H LYS 137 6.768 -5.405 -8.682 1025 HA LYS 137 HA LYS 137 5.656 -8.022 -8.636 1026 HB2 LYS 137 2HB LYS 137 6.718 -8.369 -10.711 1027 HB3 LYS 137 1HB LYS 137 6.265 -6.676 -10.697 1028 HG2 LYS 137 2HG LYS 137 8.660 -6.243 -9.897 1029 HG3 LYS 137 1HG LYS 137 8.984 -7.894 -10.426 1030 HD2 LYS 137 2HD LYS 137 7.967 -5.608 -12.110 1031 HD3 LYS 137 1HD LYS 137 9.545 -6.388 -12.216 1032 HE2 LYS 137 2HE LYS 137 6.996 -7.921 -12.626 1033 HE3 LYS 137 1HE LYS 137 7.760 -7.036 -13.941 1034 HZ1 LYS 137 3HZ LYS 137 9.280 -8.989 -12.329 1035 HZ2 LYS 137 1HZ LYS 137 9.623 -8.403 -13.880 1036 HZ3 LYS 137 2HZ LYS 137 8.344 -9.486 -13.648 1037 H GLU 138 H GLU 138 8.331 -6.661 -7.109 1038 HA GLU 138 HA GLU 138 9.760 -9.208 -6.915 1039 HB2 GLU 138 2HB GLU 138 10.738 -6.703 -7.313 1040 HB3 GLU 138 1HB GLU 138 10.865 -6.831 -5.559 1041 HG2 GLU 138 2HG GLU 138 11.948 -9.171 -6.193 1042 HG3 GLU 138 1HG GLU 138 12.314 -8.295 -7.688 1043 H ALA 139 H ALA 139 8.852 -6.535 -4.754 1044 HA ALA 139 HA ALA 139 9.173 -7.820 -2.330 1045 HB1 ALA 139 1HB ALA 139 7.580 -6.216 -1.411 1046 HB2 ALA 139 2HB ALA 139 7.064 -5.791 -3.043 1047 HB3 ALA 139 3HB ALA 139 8.710 -5.434 -2.517 1048 H GLN 140 H GLN 140 6.652 -8.124 -4.687 1049 HA GLN 140 HA GLN 140 4.705 -9.343 -3.075 1050 HB2 GLN 140 2HB GLN 140 3.679 -10.006 -5.193 1051 HB3 GLN 140 1HB GLN 140 4.186 -8.319 -5.225 1052 HG2 GLN 140 2HG GLN 140 4.851 -9.103 -7.286 1053 HG3 GLN 140 1HG GLN 140 6.324 -9.226 -6.328 1054 HE21 GLN 140 1HE2 GLN 140 3.632 -11.030 -7.667 1055 HE22 GLN 140 2HE2 GLN 140 4.418 -12.567 -7.674 1056 H GLU 141 H GLU 141 7.676 -10.492 -4.245 1057 HA GLU 141 HA GLU 141 6.902 -13.264 -4.426 1058 HB2 GLU 141 2HB GLU 141 8.638 -12.341 -5.895 1059 HB3 GLU 141 1HB GLU 141 9.642 -11.993 -4.483 1060 HG2 GLU 141 2HG GLU 141 10.293 -14.134 -4.252 1061 HG3 GLU 141 1HG GLU 141 8.732 -14.781 -4.757 1062 H ARG 142 H ARG 142 8.502 -11.195 -2.046 1063 HA ARG 142 HA ARG 142 9.063 -13.524 -0.374 1064 HB2 ARG 142 2HB ARG 142 9.589 -10.904 0.828 1065 HB3 ARG 142 1HB ARG 142 10.649 -12.303 0.648 1066 HG2 ARG 142 2HG ARG 142 11.792 -11.000 -0.755 1067 HG3 ARG 142 1HG ARG 142 10.508 -11.370 -1.918 1068 HD2 ARG 142 2HD ARG 142 10.686 -9.033 -1.957 1069 HD3 ARG 142 1HD ARG 142 9.281 -9.357 -0.929 1070 HE ARG 142 HE ARG 142 10.427 -8.494 0.862 1071 HH11 ARG 142 1HH1 ARG 142 12.655 -9.009 -1.773 1072 HH12 ARG 142 2HH1 ARG 142 13.951 -8.150 -1.011 1073 HH21 ARG 142 1HH2 ARG 142 12.130 -7.363 1.867 1074 HH22 ARG 142 2HH2 ARG 142 13.653 -7.216 1.055 1075 H LEU 143 H LEU 143 7.077 -10.602 -0.322 1076 HA LEU 143 HA LEU 143 6.046 -10.875 2.259 1077 HB2 LEU 143 2HB LEU 143 5.113 -9.525 -0.236 1078 HB3 LEU 143 1HB LEU 143 4.009 -9.652 1.131 1079 HG LEU 143 HG LEU 143 5.106 -7.511 1.195 1080 HD11 LEU 143 1HD1 LEU 143 4.929 -9.205 3.294 1081 HD12 LEU 143 2HD1 LEU 143 5.436 -7.519 3.413 1082 HD13 LEU 143 3HD1 LEU 143 6.646 -8.801 3.335 1083 HD21 LEU 143 3HD2 LEU 143 7.078 -7.723 -0.011 1084 HD22 LEU 143 1HD2 LEU 143 7.598 -9.141 0.898 1085 HD23 LEU 143 2HD2 LEU 143 7.647 -7.548 1.649 1086 H THR 144 H THR 144 5.000 -12.307 -0.793 1087 HA THR 144 HA THR 144 2.612 -13.443 0.278 1088 HB THR 144 HB THR 144 2.618 -14.737 -1.864 1089 HG1 THR 144 1HG THR 144 4.972 -14.715 -2.021 1090 HG21 THR 144 3HG2 THR 144 1.443 -12.796 -2.164 1091 HG22 THR 144 1HG2 THR 144 2.709 -12.631 -3.379 1092 HG23 THR 144 2HG2 THR 144 2.842 -11.772 -1.844 1093 H GLY 145 H GLY 145 2.459 -15.164 1.547 1094 HA2 GLY 145 2HA GLY 145 2.809 -17.394 2.173 1095 HA3 GLY 145 1HA GLY 145 4.238 -17.433 1.152 1096 H ASP 146 H ASP 146 3.861 -14.804 3.369 1097 HA ASP 146 HA ASP 146 5.100 -14.135 5.157 1098 HB2 ASP 146 2HB ASP 146 4.443 -16.980 5.700 1099 HB3 ASP 146 1HB ASP 146 5.681 -16.245 6.713 1100 H ALA 147 H ALA 147 6.493 -15.043 2.683 1101 HA ALA 147 HA ALA 147 8.912 -16.337 3.435 1102 HB1 ALA 147 1HB ALA 147 7.720 -15.322 1.024 1103 HB2 ALA 147 2HB ALA 147 8.974 -16.545 1.225 1104 HB3 ALA 147 3HB ALA 147 9.415 -14.840 1.119 1105 H PHE 148 H PHE 148 7.828 -13.027 3.406 1106 HA PHE 148 HA PHE 148 10.296 -11.706 3.455 1107 HB2 PHE 148 2HB PHE 148 9.089 -9.803 4.337 1108 HB3 PHE 148 1HB PHE 148 8.077 -10.610 3.132 1109 HD1 PHE 148 1HD PHE 148 6.174 -12.022 3.879 1110 HD2 PHE 148 2HD PHE 148 8.403 -9.609 6.586 1111 HE1 PHE 148 1HE PHE 148 4.355 -12.193 5.526 1112 HE2 PHE 148 2HE PHE 148 6.588 -9.777 8.238 1113 HZ PHE 148 HZ PHE 148 4.559 -11.070 7.709 1114 H ARG 149 H ARG 149 8.516 -13.385 5.937 1115 HA ARG 149 HA ARG 149 9.687 -12.363 8.236 1116 HB2 ARG 149 2HB ARG 149 8.403 -14.933 7.502 1117 HB3 ARG 149 1HB ARG 149 9.310 -14.879 9.006 1118 HG2 ARG 149 2HG ARG 149 6.988 -13.125 8.236 1119 HG3 ARG 149 1HG ARG 149 6.997 -14.415 9.434 1120 HD2 ARG 149 2HD ARG 149 8.423 -11.772 9.560 1121 HD3 ARG 149 1HD ARG 149 7.146 -12.367 10.617 1122 HE ARG 149 HE ARG 149 9.677 -13.825 10.558 1123 HH11 ARG 149 1HH1 ARG 149 7.526 -11.653 12.256 1124 HH12 ARG 149 2HH1 ARG 149 8.297 -11.894 13.785 1125 HH21 ARG 149 1HH2 ARG 149 10.686 -14.133 12.571 1126 HH22 ARG 149 2HH2 ARG 149 10.088 -13.298 13.966 1127 H LYS 150 H LYS 150 11.796 -12.161 8.630 1128 HA LYS 150 HA LYS 150 13.495 -14.511 8.463 1129 HB2 LYS 150 2HB LYS 150 13.615 -13.244 6.245 1130 HB3 LYS 150 1HB LYS 150 14.421 -11.966 7.144 1131 HG2 LYS 150 2HG LYS 150 16.359 -13.027 7.019 1132 HG3 LYS 150 1HG LYS 150 15.658 -14.484 7.725 1133 HD2 LYS 150 2HD LYS 150 15.049 -13.908 4.877 1134 HD3 LYS 150 1HD LYS 150 16.686 -14.441 5.270 1135 HE2 LYS 150 2HE LYS 150 15.146 -16.186 6.707 1136 HE3 LYS 150 1HE LYS 150 14.166 -15.930 5.264 1137 HZ1 LYS 150 3HZ LYS 150 16.563 -16.290 4.173 1138 HZ2 LYS 150 1HZ LYS 150 15.475 -17.554 4.459 1139 HZ3 LYS 150 2HZ LYS 150 16.733 -17.257 5.551 1140 H LYS 151 H LYS 151 14.320 -14.625 10.436 1141 HA LYS 151 HA LYS 151 16.055 -12.713 11.507 1142 HB2 LYS 151 2HB LYS 151 14.736 -11.900 13.424 1143 HB3 LYS 151 1HB LYS 151 14.075 -11.355 11.889 1144 HG2 LYS 151 2HG LYS 151 12.198 -12.650 12.075 1145 HG3 LYS 151 1HG LYS 151 12.990 -13.842 13.109 1146 HD2 LYS 151 2HD LYS 151 11.850 -12.840 14.765 1147 HD3 LYS 151 1HD LYS 151 13.116 -11.615 14.665 1148 HE2 LYS 151 2HE LYS 151 10.932 -11.250 12.747 1149 HE3 LYS 151 1HE LYS 151 10.436 -11.136 14.436 1150 HZ1 LYS 151 3HZ LYS 151 12.207 -9.489 14.769 1151 HZ2 LYS 151 1HZ LYS 151 11.069 -8.980 13.625 1152 HZ3 LYS 151 2HZ LYS 151 12.577 -9.555 13.120 1153 H HIS 152 H HIS 152 17.256 -13.597 13.116 1154 HA HIS 152 HA HIS 152 16.381 -15.489 14.975 1155 HB2 HIS 152 2HB HIS 152 17.409 -17.539 14.133 1156 HB3 HIS 152 1HB HIS 152 16.158 -16.970 13.032 1157 HD1 HIS 152 1HD HIS 152 17.667 -14.953 11.374 1158 HD2 HIS 152 2HD HIS 152 19.260 -18.627 12.472 1159 HE1 HIS 152 1HE HIS 152 19.477 -15.414 9.719 1160 HE2 HIS 152 2HE HIS 152 20.359 -17.696 10.323 1161 H LEU 153 H LEU 153 19.084 -14.341 13.034 1162 HA LEU 153 HA LEU 153 21.168 -15.098 14.744 1163 HB2 LEU 153 2HB LEU 153 22.459 -13.288 13.638 1164 HB3 LEU 153 1HB LEU 153 21.660 -14.377 12.519 1165 HG LEU 153 HG LEU 153 19.950 -12.128 13.083 1166 HD11 LEU 153 1HD1 LEU 153 21.638 -10.632 11.649 1167 HD12 LEU 153 2HD1 LEU 153 22.806 -11.545 12.604 1168 HD13 LEU 153 3HD1 LEU 153 21.568 -10.584 13.412 1169 HD21 LEU 153 3HD2 LEU 153 21.342 -12.852 10.516 1170 HD22 LEU 153 1HD2 LEU 153 19.811 -12.001 10.720 1171 HD23 LEU 153 2HD2 LEU 153 19.930 -13.714 11.126 1172 H GLU 154 H GLU 154 18.982 -12.363 14.819 1173 HA GLU 154 HA GLU 154 19.510 -11.846 17.555 1174 HB2 GLU 154 2HB GLU 154 21.415 -10.723 15.961 1175 HB3 GLU 154 1HB GLU 154 20.244 -9.417 16.058 1176 HG2 GLU 154 2HG GLU 154 20.326 -9.627 18.540 1177 HG3 GLU 154 1HG GLU 154 21.641 -10.784 18.343 1178 H ASP 155 H ASP 155 18.351 -9.817 18.298 1179 HA ASP 155 HA ASP 155 16.160 -9.051 16.509 1180 HB2 ASP 155 2HB ASP 155 15.892 -10.338 19.214 1181 HB3 ASP 155 1HB ASP 155 14.639 -9.263 18.600 1182 H GLU 156 H GLU 156 17.566 -8.537 19.744 1183 HA GLU 156 HA GLU 156 16.949 -5.673 19.468 1184 HB2 GLU 156 2HB GLU 156 16.391 -7.409 21.554 1185 HB3 GLU 156 1HB GLU 156 17.829 -6.547 22.113 1186 HG2 GLU 156 2HG GLU 156 15.920 -5.371 22.892 1187 HG3 GLU 156 1HG GLU 156 16.654 -4.411 21.607 1188 H LEU 157 H LEU 157 18.531 -4.128 19.917 1189 HA LEU 157 HA LEU 157 21.224 -4.948 20.567 1190 HB2 LEU 157 2HB LEU 157 22.234 -4.014 18.542 1191 HB3 LEU 157 1HB LEU 157 21.200 -5.384 18.183 1192 HG LEU 157 HG LEU 157 19.450 -3.335 17.835 1193 HD11 LEU 157 1HD1 LEU 157 22.122 -2.320 16.878 1194 HD12 LEU 157 2HD1 LEU 157 21.206 -1.663 18.235 1195 HD13 LEU 157 3HD1 LEU 157 20.550 -1.568 16.600 1196 HD21 LEU 157 3HD2 LEU 157 19.724 -3.707 15.475 1197 HD22 LEU 157 1HD2 LEU 157 19.932 -5.240 16.322 1198 HD23 LEU 157 2HD2 LEU 157 21.342 -4.365 15.727 Start of MODEL 26 1 H1 MET 1 1HT MET 1 -27.520 -8.533 -18.975 2 H2 MET 1 2HT MET 1 -25.995 -7.754 -18.847 3 H3 MET 1 3HT MET 1 -27.245 -7.386 -17.731 4 HA MET 1 HA MET 1 -25.860 -8.762 -16.574 5 HB2 MET 1 2HB MET 1 -28.276 -10.045 -17.763 6 HB3 MET 1 1HB MET 1 -27.218 -11.042 -16.776 7 HG2 MET 1 2HG MET 1 -28.531 -8.477 -15.905 8 HG3 MET 1 1HG MET 1 -29.057 -10.105 -15.481 9 HE1 MET 1 2HE MET 1 -27.111 -7.204 -15.002 10 HE2 MET 1 3HE MET 1 -25.756 -7.542 -13.925 11 HE3 MET 1 1HE MET 1 -27.381 -7.351 -13.266 12 H HIS 2 H HIS 2 -26.771 -10.818 -19.339 13 HA HIS 2 HA HIS 2 -25.530 -12.110 -20.749 14 HB2 HIS 2 2HB HIS 2 -23.758 -10.007 -20.079 15 HB3 HIS 2 1HB HIS 2 -22.834 -11.501 -19.963 16 HD1 HIS 2 1HD HIS 2 -22.084 -12.541 -22.116 17 HD2 HIS 2 2HD HIS 2 -24.943 -9.582 -22.692 18 HE1 HIS 2 1HE HIS 2 -22.205 -12.199 -24.604 19 HE2 HIS 2 2HE HIS 2 -23.876 -10.341 -24.922 20 H HIS 3 H HIS 3 -23.230 -11.898 -18.045 21 HA HIS 3 HA HIS 3 -23.883 -14.666 -17.330 22 HB2 HIS 3 2HB HIS 3 -21.452 -15.179 -17.143 23 HB3 HIS 3 1HB HIS 3 -21.977 -14.864 -18.794 24 HD1 HIS 3 1HD HIS 3 -21.182 -12.620 -19.875 25 HD2 HIS 3 2HD HIS 3 -19.580 -13.404 -16.123 26 HE1 HIS 3 1HE HIS 3 -19.255 -11.025 -19.621 27 HE2 HIS 3 2HE HIS 3 -18.255 -11.569 -17.374 28 H HIS 4 H HIS 4 -22.393 -11.610 -16.433 29 HA HIS 4 HA HIS 4 -21.782 -10.712 -14.438 30 HB2 HIS 4 2HB HIS 4 -23.603 -11.332 -12.584 31 HB3 HIS 4 1HB HIS 4 -23.935 -10.208 -13.894 32 HD1 HIS 4 1HD HIS 4 -25.182 -13.232 -12.339 33 HD2 HIS 4 2HD HIS 4 -25.382 -11.506 -16.112 34 HE1 HIS 4 1HE HIS 4 -27.103 -14.367 -13.495 35 HE2 HIS 4 2HE HIS 4 -27.152 -13.368 -15.808 36 H HIS 5 H HIS 5 -23.256 -13.445 -12.774 37 HA HIS 5 HA HIS 5 -22.400 -15.071 -11.439 38 HB2 HIS 5 2HB HIS 5 -20.732 -15.067 -13.647 39 HB3 HIS 5 1HB HIS 5 -19.612 -14.935 -12.297 40 HD1 HIS 5 1HD HIS 5 -20.117 -16.840 -10.336 41 HD2 HIS 5 2HD HIS 5 -21.420 -17.617 -14.204 42 HE1 HIS 5 1HE HIS 5 -20.478 -19.327 -10.436 43 HE2 HIS 5 2HE HIS 5 -21.370 -19.758 -12.752 44 H HIS 6 H HIS 6 -19.525 -13.006 -11.834 45 HA HIS 6 HA HIS 6 -18.971 -12.995 -9.048 46 HB2 HIS 6 2HB HIS 6 -17.905 -11.343 -11.339 47 HB3 HIS 6 1HB HIS 6 -17.319 -11.179 -9.688 48 HD1 HIS 6 1HD HIS 6 -15.327 -12.547 -9.194 49 HD2 HIS 6 2HD HIS 6 -17.615 -14.207 -12.240 50 HE1 HIS 6 1HE HIS 6 -14.059 -14.581 -9.956 51 HE2 HIS 6 2HE HIS 6 -15.416 -15.514 -11.863 52 H HIS 7 H HIS 7 -19.351 -11.477 -7.494 53 HA HIS 7 HA HIS 7 -21.639 -9.869 -7.708 54 HB2 HIS 7 2HB HIS 7 -20.857 -8.886 -5.528 55 HB3 HIS 7 1HB HIS 7 -20.962 -10.644 -5.546 56 HD1 HIS 7 1HD HIS 7 -18.208 -8.127 -6.350 57 HD2 HIS 7 2HD HIS 7 -18.813 -11.697 -4.312 58 HE1 HIS 7 1HE HIS 7 -15.975 -8.724 -5.361 59 HE2 HIS 7 2HE HIS 7 -16.347 -10.930 -4.203 60 H MET 8 H MET 8 -21.397 -7.434 -6.882 61 HA MET 8 HA MET 8 -19.259 -6.048 -8.297 62 HB2 MET 8 2HB MET 8 -21.289 -6.439 -9.841 63 HB3 MET 8 1HB MET 8 -22.110 -5.242 -8.832 64 HG2 MET 8 2HG MET 8 -20.936 -3.523 -9.684 65 HG3 MET 8 1HG MET 8 -19.457 -4.466 -9.845 66 HE1 MET 8 3HE MET 8 -19.198 -6.352 -11.492 67 HE2 MET 8 1HE MET 8 -19.835 -6.329 -13.137 68 HE3 MET 8 2HE MET 8 -20.792 -7.025 -11.829 69 H SER 9 H SER 9 -18.734 -4.102 -7.407 70 HA SER 9 HA SER 9 -20.434 -2.522 -5.815 71 HB2 SER 9 2HB SER 9 -19.180 -2.938 -3.614 72 HB3 SER 9 1HB SER 9 -20.361 -4.153 -4.103 73 HG SER 9 HG SER 9 -17.550 -4.277 -4.163 74 H ASP 10 H ASP 10 -19.551 -0.539 -5.448 75 HA ASP 10 HA ASP 10 -16.719 -0.099 -5.403 76 HB2 ASP 10 2HB ASP 10 -16.744 1.413 -7.425 77 HB3 ASP 10 1HB ASP 10 -16.871 -0.308 -7.777 78 H GLY 11 H GLY 11 -19.863 1.450 -6.027 79 HA2 GLY 11 2HA GLY 11 -20.875 3.230 -4.973 80 HA3 GLY 11 1HA GLY 11 -19.645 3.112 -3.723 81 H HIS 12 H HIS 12 -20.435 5.575 -4.315 82 HA HIS 12 HA HIS 12 -18.715 6.715 -6.360 83 HB2 HIS 12 2HB HIS 12 -21.091 7.492 -5.918 84 HB3 HIS 12 1HB HIS 12 -20.483 8.208 -4.419 85 HD1 HIS 12 1HD HIS 12 -19.571 10.515 -4.598 86 HD2 HIS 12 2HD HIS 12 -19.804 8.635 -8.296 87 HE1 HIS 12 1HE HIS 12 -18.956 12.274 -6.287 88 HE2 HIS 12 2HE HIS 12 -19.014 11.089 -8.509 89 H ASN 13 H ASN 13 -17.356 8.614 -5.826 90 HA ASN 13 HA ASN 13 -15.418 9.314 -4.832 91 HB2 ASN 13 2HB ASN 13 -15.744 10.292 -2.633 92 HB3 ASN 13 1HB ASN 13 -17.170 10.582 -3.626 93 HD21 ASN 13 1HD2 ASN 13 -19.040 10.208 -2.698 94 HD22 ASN 13 2HD2 ASN 13 -19.320 9.163 -1.350 95 H GLY 14 H GLY 14 -15.711 6.430 -4.935 96 HA2 GLY 14 2HA GLY 14 -14.964 5.194 -2.518 97 HA3 GLY 14 1HA GLY 14 -14.686 4.540 -4.135 98 H LEU 15 H LEU 15 -12.649 4.336 -4.775 99 HA LEU 15 HA LEU 15 -10.595 6.147 -3.803 100 HB2 LEU 15 2HB LEU 15 -9.985 3.239 -3.546 101 HB3 LEU 15 1HB LEU 15 -9.282 4.604 -2.699 102 HG LEU 15 HG LEU 15 -11.567 4.802 -1.524 103 HD11 LEU 15 1HD1 LEU 15 -11.987 1.937 -1.776 104 HD12 LEU 15 2HD1 LEU 15 -12.254 2.804 -3.289 105 HD13 LEU 15 3HD1 LEU 15 -13.147 3.265 -1.840 106 HD21 LEU 15 3HD2 LEU 15 -9.761 4.163 -0.199 107 HD22 LEU 15 1HD2 LEU 15 -9.542 2.642 -1.066 108 HD23 LEU 15 2HD2 LEU 15 -10.918 2.849 0.018 109 H GLY 16 H GLY 16 -8.508 5.818 -4.956 110 HA2 GLY 16 2HA GLY 16 -7.330 5.616 -6.919 111 HA3 GLY 16 1HA GLY 16 -8.180 4.096 -7.121 112 H LYS 17 H LYS 17 -9.913 7.101 -6.880 113 HA LYS 17 HA LYS 17 -10.762 6.784 -9.670 114 HB2 LYS 17 2HB LYS 17 -12.033 8.521 -7.553 115 HB3 LYS 17 1HB LYS 17 -12.720 8.041 -9.098 116 HG2 LYS 17 2HG LYS 17 -12.008 5.732 -7.528 117 HG3 LYS 17 1HG LYS 17 -13.082 6.807 -6.631 118 HD2 LYS 17 2HD LYS 17 -14.569 6.836 -8.665 119 HD3 LYS 17 1HD LYS 17 -13.558 5.549 -9.327 120 HE2 LYS 17 2HE LYS 17 -14.099 4.113 -7.459 121 HE3 LYS 17 1HE LYS 17 -15.012 5.410 -6.689 122 HZ1 LYS 17 3HZ LYS 17 -16.233 5.283 -9.045 123 HZ2 LYS 17 1HZ LYS 17 -16.725 4.386 -7.697 124 HZ3 LYS 17 2HZ LYS 17 -15.761 3.665 -8.885 125 H GLY 18 H GLY 18 -9.541 7.941 -11.025 126 HA2 GLY 18 2HA GLY 18 -9.524 10.431 -11.691 127 HA3 GLY 18 1HA GLY 18 -8.643 10.614 -10.170 128 H PHE 19 H PHE 19 -6.959 8.456 -10.202 129 HA PHE 19 HA PHE 19 -5.232 9.121 -12.478 130 HB2 PHE 19 2HB PHE 19 -3.435 8.031 -11.000 131 HB3 PHE 19 1HB PHE 19 -4.066 9.608 -10.501 132 HD1 PHE 19 2HD PHE 19 -4.606 5.961 -9.951 133 HD2 PHE 19 1HD PHE 19 -4.782 9.894 -8.337 134 HE1 PHE 19 2HE PHE 19 -5.166 5.029 -7.743 135 HE2 PHE 19 1HE PHE 19 -5.338 8.968 -6.126 136 HZ PHE 19 HZ PHE 19 -5.531 6.531 -5.828 137 H GLY 20 H GLY 20 -6.760 6.460 -10.804 138 HA2 GLY 20 2HA GLY 20 -5.789 4.669 -12.950 139 HA3 GLY 20 1HA GLY 20 -6.002 4.130 -11.283 140 H ASP 21 H ASP 21 -7.806 3.055 -10.893 141 HA ASP 21 HA ASP 21 -10.373 3.872 -11.580 142 HB2 ASP 21 2HB ASP 21 -9.719 3.326 -13.886 143 HB3 ASP 21 1HB ASP 21 -9.327 1.675 -13.389 144 H HIS 22 H HIS 22 -9.568 0.477 -12.022 145 HA HIS 22 HA HIS 22 -10.412 -0.068 -9.252 146 HB2 HIS 22 2HB HIS 22 -11.350 -2.262 -10.395 147 HB3 HIS 22 1HB HIS 22 -12.318 -0.794 -10.333 148 HD1 HIS 22 1HD HIS 22 -13.598 -0.820 -12.460 149 HD2 HIS 22 2HD HIS 22 -9.590 -1.745 -13.049 150 HE1 HIS 22 1HE HIS 22 -13.303 -0.982 -14.953 151 HE2 HIS 22 2HE HIS 22 -10.882 -1.595 -15.283 152 H ILE 23 H ILE 23 -8.722 -0.983 -8.205 153 HA ILE 23 HA ILE 23 -7.510 -3.365 -8.988 154 HB ILE 23 HB ILE 23 -6.542 -2.282 -10.843 155 HG12 ILE 23 2HG1 ILE 23 -4.473 -2.421 -8.651 156 HG13 ILE 23 1HG1 ILE 23 -4.914 -3.701 -9.774 157 HG21 ILE 23 1HG2 ILE 23 -6.243 -0.116 -10.970 158 HG22 ILE 23 2HG2 ILE 23 -4.980 -0.180 -9.741 159 HG23 ILE 23 3HG2 ILE 23 -6.667 0.021 -9.264 160 HD11 ILE 23 3HD1 ILE 23 -2.956 -1.643 -10.060 161 HD12 ILE 23 1HD1 ILE 23 -4.162 -1.487 -11.340 162 HD13 ILE 23 2HD1 ILE 23 -3.299 -3.013 -11.119 163 H HIS 24 H HIS 24 -5.481 -0.679 -7.911 164 HA HIS 24 HA HIS 24 -4.951 -2.020 -5.422 165 HB2 HIS 24 2HB HIS 24 -3.885 0.555 -6.584 166 HB3 HIS 24 1HB HIS 24 -3.330 -0.163 -5.072 167 HD1 HIS 24 1HD HIS 24 -1.398 0.356 -7.402 168 HD2 HIS 24 2HD HIS 24 -3.348 -3.254 -6.762 169 HE1 HIS 24 1HE HIS 24 -0.001 -1.373 -8.568 170 HE2 HIS 24 2HE HIS 24 -1.281 -3.523 -8.298 171 H TRP 25 H TRP 25 -7.637 -0.868 -5.882 172 HA TRP 25 HA TRP 25 -7.860 0.583 -3.396 173 HB2 TRP 25 2HB TRP 25 -9.338 2.265 -4.973 174 HB3 TRP 25 1HB TRP 25 -7.711 2.595 -4.372 175 HD1 TRP 25 HD TRP 25 -9.577 1.547 -7.531 176 HE1 TRP 25 1HE TRP 25 -8.010 1.880 -9.527 177 HE3 TRP 25 3HE TRP 25 -5.288 2.619 -5.020 178 HZ2 TRP 25 2HZ TRP 25 -5.292 2.533 -9.998 179 HZ3 TRP 25 3HZ TRP 25 -3.246 3.099 -6.293 180 HH2 TRP 25 HH TRP 25 -3.241 3.048 -8.739 181 H ARG 26 H ARG 26 -9.137 -1.547 -5.660 182 HA ARG 26 HA ARG 26 -11.793 -1.085 -5.818 183 HB2 ARG 26 2HB ARG 26 -10.765 -3.800 -5.006 184 HB3 ARG 26 1HB ARG 26 -12.246 -3.436 -5.882 185 HG2 ARG 26 2HG ARG 26 -10.392 -2.309 -7.506 186 HG3 ARG 26 1HG ARG 26 -9.489 -3.676 -6.851 187 HD2 ARG 26 2HD ARG 26 -10.597 -4.364 -8.873 188 HD3 ARG 26 1HD ARG 26 -11.361 -5.168 -7.493 189 HE ARG 26 HE ARG 26 -12.508 -3.015 -9.123 190 HH11 ARG 26 1HH1 ARG 26 -12.880 -5.331 -6.530 191 HH12 ARG 26 2HH1 ARG 26 -14.602 -5.170 -6.478 192 HH21 ARG 26 1HH2 ARG 26 -14.767 -2.809 -9.044 193 HH22 ARG 26 2HH2 ARG 26 -15.673 -3.742 -7.899 194 H THR 27 H THR 27 -10.069 -1.975 -2.846 195 HA THR 27 HA THR 27 -11.695 -0.788 -1.064 196 HB THR 27 HB THR 27 -13.699 -1.843 -1.602 197 HG1 THR 27 1HG THR 27 -14.181 -2.785 0.239 198 HG21 THR 27 3HG2 THR 27 -12.029 -4.154 -2.278 199 HG22 THR 27 1HG2 THR 27 -13.524 -3.573 -3.009 200 HG23 THR 27 2HG2 THR 27 -13.581 -4.533 -1.532 201 H LEU 28 H LEU 28 -11.024 -1.056 0.995 202 HA LEU 28 HA LEU 28 -8.697 -2.682 1.418 203 HB2 LEU 28 2HB LEU 28 -8.769 -0.486 2.400 204 HB3 LEU 28 1HB LEU 28 -10.277 -0.860 3.234 205 HG LEU 28 HG LEU 28 -7.838 -2.484 3.838 206 HD11 LEU 28 1HD1 LEU 28 -7.375 -0.815 5.682 207 HD12 LEU 28 2HD1 LEU 28 -8.391 0.315 4.786 208 HD13 LEU 28 3HD1 LEU 28 -6.920 -0.321 4.052 209 HD21 LEU 28 3HD2 LEU 28 -9.564 -3.364 5.027 210 HD22 LEU 28 1HD2 LEU 28 -10.447 -1.838 5.089 211 HD23 LEU 28 2HD2 LEU 28 -9.074 -2.106 6.162 212 H GLU 29 H GLU 29 -12.081 -2.770 2.346 213 HA GLU 29 HA GLU 29 -11.968 -4.711 4.351 214 HB2 GLU 29 2HB GLU 29 -13.990 -3.386 2.833 215 HB3 GLU 29 1HB GLU 29 -14.345 -5.109 2.830 216 HG2 GLU 29 2HG GLU 29 -14.034 -5.022 5.346 217 HG3 GLU 29 1HG GLU 29 -14.076 -3.266 5.182 218 H ASP 30 H ASP 30 -12.641 -5.139 0.877 219 HA ASP 30 HA ASP 30 -12.690 -7.947 0.920 220 HB2 ASP 30 2HB ASP 30 -12.188 -5.928 -1.257 221 HB3 ASP 30 1HB ASP 30 -12.118 -7.665 -1.584 222 H GLY 31 H GLY 31 -10.077 -5.637 0.702 223 HA2 GLY 31 2HA GLY 31 -8.051 -7.368 -0.209 224 HA3 GLY 31 1HA GLY 31 -7.798 -5.887 0.720 225 H LYS 32 H LYS 32 -9.389 -6.831 2.991 226 HA LYS 32 HA LYS 32 -7.295 -8.352 4.285 227 HB2 LYS 32 2HB LYS 32 -9.836 -7.062 5.265 228 HB3 LYS 32 1HB LYS 32 -8.844 -8.077 6.303 229 HG2 LYS 32 2HG LYS 32 -7.012 -6.582 6.170 230 HG3 LYS 32 1HG LYS 32 -7.772 -5.666 4.866 231 HD2 LYS 32 2HD LYS 32 -8.531 -4.290 6.452 232 HD3 LYS 32 1HD LYS 32 -9.647 -5.582 6.896 233 HE2 LYS 32 2HE LYS 32 -6.873 -5.269 8.033 234 HE3 LYS 32 1HE LYS 32 -8.334 -4.654 8.803 235 HZ1 LYS 32 3HZ LYS 32 -7.443 -6.932 9.513 236 HZ2 LYS 32 1HZ LYS 32 -8.105 -7.502 8.062 237 HZ3 LYS 32 2HZ LYS 32 -9.103 -6.784 9.223 238 H LYS 33 H LYS 33 -10.720 -8.771 3.490 239 HA LYS 33 HA LYS 33 -10.971 -11.345 4.646 240 HB2 LYS 33 2HB LYS 33 -12.923 -9.961 4.209 241 HB3 LYS 33 1HB LYS 33 -12.591 -9.990 2.482 242 HG2 LYS 33 2HG LYS 33 -12.774 -12.673 3.478 243 HG3 LYS 33 1HG LYS 33 -14.204 -11.744 3.961 244 HD2 LYS 33 2HD LYS 33 -14.472 -11.033 1.598 245 HD3 LYS 33 1HD LYS 33 -13.125 -12.086 1.162 246 HE2 LYS 33 2HE LYS 33 -14.325 -14.018 1.602 247 HE3 LYS 33 1HE LYS 33 -15.462 -13.189 2.663 248 HZ1 LYS 33 3HZ LYS 33 -16.712 -12.478 0.925 249 HZ2 LYS 33 1HZ LYS 33 -16.101 -13.891 0.222 250 HZ3 LYS 33 2HZ LYS 33 -15.408 -12.394 -0.149 251 H GLU 34 H GLU 34 -9.821 -10.195 1.570 252 HA GLU 34 HA GLU 34 -9.868 -12.843 0.380 253 HB2 GLU 34 2HB GLU 34 -10.369 -10.784 -0.947 254 HB3 GLU 34 1HB GLU 34 -8.690 -10.290 -0.729 255 HG2 GLU 34 2HG GLU 34 -7.945 -11.682 -2.307 256 HG3 GLU 34 1HG GLU 34 -9.010 -12.999 -1.786 257 H ALA 35 H ALA 35 -7.463 -10.459 1.443 258 HA ALA 35 HA ALA 35 -5.154 -11.831 0.724 259 HB1 ALA 35 1HB ALA 35 -4.915 -9.594 1.412 260 HB2 ALA 35 2HB ALA 35 -4.100 -10.552 2.650 261 HB3 ALA 35 3HB ALA 35 -5.710 -9.900 2.958 262 H ALA 36 H ALA 36 -7.408 -12.477 3.262 263 HA ALA 36 HA ALA 36 -5.687 -13.973 4.956 264 HB1 ALA 36 1HB ALA 36 -7.615 -13.202 6.001 265 HB2 ALA 36 2HB ALA 36 -7.940 -14.921 5.774 266 HB3 ALA 36 3HB ALA 36 -8.660 -13.735 4.682 267 H ALA 37 H ALA 37 -8.125 -14.969 2.551 268 HA ALA 37 HA ALA 37 -7.524 -17.738 2.763 269 HB1 ALA 37 1HB ALA 37 -9.169 -16.054 0.953 270 HB2 ALA 37 2HB ALA 37 -9.626 -17.451 1.929 271 HB3 ALA 37 3HB ALA 37 -8.743 -17.680 0.419 272 H SER 38 H SER 38 -7.061 -15.614 -0.064 273 HA SER 38 HA SER 38 -5.305 -17.309 -1.413 274 HB2 SER 38 2HB SER 38 -6.065 -14.447 -1.609 275 HB3 SER 38 1HB SER 38 -4.542 -14.913 -2.384 276 HG SER 38 HG SER 38 -5.720 -16.510 -3.531 277 H GLY 39 H GLY 39 -4.734 -15.110 1.211 278 HA2 GLY 39 2HA GLY 39 -2.860 -14.802 2.515 279 HA3 GLY 39 1HA GLY 39 -2.114 -16.144 1.641 280 H LEU 40 H LEU 40 -3.294 -12.973 0.525 281 HA LEU 40 HA LEU 40 -0.568 -12.438 -0.458 282 HB2 LEU 40 2HB LEU 40 -1.692 -11.058 -2.234 283 HB3 LEU 40 1HB LEU 40 -1.908 -12.792 -2.371 284 HG LEU 40 HG LEU 40 -4.153 -12.424 -1.183 285 HD11 LEU 40 1HD1 LEU 40 -3.175 -9.695 -1.402 286 HD12 LEU 40 2HD1 LEU 40 -4.491 -10.355 -0.429 287 HD13 LEU 40 3HD1 LEU 40 -4.776 -9.908 -2.110 288 HD21 LEU 40 3HD2 LEU 40 -3.489 -12.656 -3.773 289 HD22 LEU 40 1HD2 LEU 40 -4.275 -11.077 -3.804 290 HD23 LEU 40 2HD2 LEU 40 -5.151 -12.486 -3.206 291 HA PRO 41 HA PRO 41 -0.598 -8.792 2.040 292 HB2 PRO 41 2HB PRO 41 1.170 -7.267 0.642 293 HB3 PRO 41 1HB PRO 41 1.656 -8.630 1.657 294 HG2 PRO 41 2HG PRO 41 1.266 -8.524 -1.309 295 HG3 PRO 41 1HG PRO 41 2.576 -9.280 -0.381 296 HD2 PRO 41 2HD PRO 41 0.533 -10.711 -1.400 297 HD3 PRO 41 1HD PRO 41 1.296 -11.131 0.147 298 H LEU 42 H LEU 42 -0.891 -6.392 1.859 299 HA LEU 42 HA LEU 42 -2.817 -5.823 -0.278 300 HB2 LEU 42 2HB LEU 42 -3.070 -3.838 1.675 301 HB3 LEU 42 1HB LEU 42 -4.171 -5.153 1.333 302 HG LEU 42 HG LEU 42 -1.872 -5.507 3.232 303 HD11 LEU 42 1HD1 LEU 42 -2.935 -4.498 4.927 304 HD12 LEU 42 2HD1 LEU 42 -4.527 -5.017 4.375 305 HD13 LEU 42 3HD1 LEU 42 -3.758 -3.606 3.648 306 HD21 LEU 42 3HD2 LEU 42 -2.734 -7.589 2.743 307 HD22 LEU 42 1HD2 LEU 42 -4.375 -6.977 2.539 308 HD23 LEU 42 2HD2 LEU 42 -3.688 -7.131 4.154 309 H MET 43 H MET 43 -2.891 -3.715 -1.164 310 HA MET 43 HA MET 43 -0.230 -2.512 -1.378 311 HB2 MET 43 2HB MET 43 -1.196 -3.305 -3.468 312 HB3 MET 43 1HB MET 43 -2.656 -2.343 -3.195 313 HG2 MET 43 2HG MET 43 -1.643 -0.832 -4.494 314 HG3 MET 43 1HG MET 43 -0.698 -0.448 -3.057 315 HE1 MET 43 3HE MET 43 2.238 -0.579 -3.357 316 HE2 MET 43 1HE MET 43 2.521 -2.318 -3.432 317 HE3 MET 43 2HE MET 43 1.270 -1.674 -2.369 318 H VAL 44 H VAL 44 -0.139 -1.085 0.309 319 HA VAL 44 HA VAL 44 -2.340 0.671 0.909 320 HB VAL 44 HB VAL 44 0.476 0.661 1.999 321 HG11 VAL 44 1HG1 VAL 44 -1.983 2.117 2.970 322 HG12 VAL 44 2HG1 VAL 44 -0.558 2.855 2.242 323 HG13 VAL 44 3HG1 VAL 44 -0.433 2.051 3.807 324 HG21 VAL 44 3HG2 VAL 44 -1.622 -0.112 3.820 325 HG22 VAL 44 1HG2 VAL 44 -0.148 -0.970 3.371 326 HG23 VAL 44 2HG2 VAL 44 -1.604 -1.148 2.393 327 H ILE 45 H ILE 45 -2.551 1.744 -1.116 328 HA ILE 45 HA ILE 45 -0.416 3.635 -1.788 329 HB ILE 45 HB ILE 45 -2.961 3.148 -3.324 330 HG12 ILE 45 2HG1 ILE 45 -0.303 1.738 -3.458 331 HG13 ILE 45 1HG1 ILE 45 -1.917 1.035 -3.334 332 HG21 ILE 45 1HG2 ILE 45 -1.172 5.176 -3.548 333 HG22 ILE 45 2HG2 ILE 45 -2.198 4.591 -4.857 334 HG23 ILE 45 3HG2 ILE 45 -0.538 4.018 -4.714 335 HD11 ILE 45 3HD1 ILE 45 -0.893 2.501 -5.754 336 HD12 ILE 45 1HD1 ILE 45 -2.392 1.590 -5.606 337 HD13 ILE 45 2HD1 ILE 45 -0.846 0.752 -5.547 338 H ILE 46 H ILE 46 -0.559 5.539 -0.710 339 HA ILE 46 HA ILE 46 -3.273 6.588 -0.253 340 HB ILE 46 HB ILE 46 -0.900 7.456 1.366 341 HG12 ILE 46 2HG1 ILE 46 -2.648 5.456 2.613 342 HG13 ILE 46 1HG1 ILE 46 -1.707 4.816 1.265 343 HG21 ILE 46 1HG2 ILE 46 -3.055 8.725 1.403 344 HG22 ILE 46 2HG2 ILE 46 -2.548 8.098 2.973 345 HG23 ILE 46 3HG2 ILE 46 -3.825 7.285 2.067 346 HD11 ILE 46 3HD1 ILE 46 -0.664 4.602 3.536 347 HD12 ILE 46 1HD1 ILE 46 -0.494 6.358 3.540 348 HD13 ILE 46 2HD1 ILE 46 0.336 5.393 2.317 349 H HIS 47 H HIS 47 -3.766 8.608 -0.886 350 HA HIS 47 HA HIS 47 -1.622 10.192 -2.136 351 HB2 HIS 47 2HB HIS 47 -3.139 10.724 -3.995 352 HB3 HIS 47 1HB HIS 47 -2.841 8.983 -3.882 353 HD1 HIS 47 1HD HIS 47 -5.468 11.045 -4.717 354 HD2 HIS 47 2HD HIS 47 -5.143 7.947 -1.956 355 HE1 HIS 47 1HE HIS 47 -7.822 10.271 -4.292 356 HE2 HIS 47 2HE HIS 47 -7.593 8.349 -2.681 357 H LYS 48 H LYS 48 -1.514 11.812 -0.602 358 HA LYS 48 HA LYS 48 -4.020 13.073 0.241 359 HB2 LYS 48 2HB LYS 48 -1.532 12.772 1.454 360 HB3 LYS 48 1HB LYS 48 -1.636 14.485 1.084 361 HG2 LYS 48 2HG LYS 48 -4.063 13.368 2.275 362 HG3 LYS 48 1HG LYS 48 -2.640 13.293 3.315 363 HD2 LYS 48 2HD LYS 48 -2.623 15.514 3.639 364 HD3 LYS 48 1HD LYS 48 -2.950 15.856 1.940 365 HE2 LYS 48 2HE LYS 48 -5.202 14.702 3.443 366 HE3 LYS 48 1HE LYS 48 -4.697 16.309 3.968 367 HZ1 LYS 48 3HZ LYS 48 -4.820 16.922 1.527 368 HZ2 LYS 48 1HZ LYS 48 -6.291 16.674 2.323 369 HZ3 LYS 48 2HZ LYS 48 -5.669 15.476 1.303 370 H SER 49 H SER 49 -3.940 15.578 0.318 371 HA SER 49 HA SER 49 -4.232 16.594 -2.206 372 HB2 SER 49 2HB SER 49 -3.560 17.967 0.391 373 HB3 SER 49 1HB SER 49 -3.844 18.875 -1.094 374 HG SER 49 HG SER 49 -5.777 18.693 0.017 375 H TRP 50 H TRP 50 -3.011 17.842 -3.613 376 HA TRP 50 HA TRP 50 -1.138 18.136 -4.894 377 HB2 TRP 50 2HB TRP 50 0.521 19.618 -3.860 378 HB3 TRP 50 1HB TRP 50 -1.127 20.126 -3.472 379 HD1 TRP 50 HD TRP 50 -1.959 19.663 -0.914 380 HE1 TRP 50 1HE TRP 50 -0.610 19.519 1.273 381 HE3 TRP 50 3HE TRP 50 2.698 18.903 -2.881 382 HZ2 TRP 50 2HZ TRP 50 2.074 19.139 2.060 383 HZ3 TRP 50 3HZ TRP 50 4.603 18.661 -1.343 384 HH2 TRP 50 HH TRP 50 4.296 18.776 1.076 385 H CYS 51 H CYS 51 -0.441 16.091 -5.410 386 HA CYS 51 HA CYS 51 2.001 15.246 -4.063 387 HB2 CYS 51 2HB CYS 51 1.162 12.857 -4.059 388 HB3 CYS 51 1HB CYS 51 0.412 13.923 -2.877 389 H GLY 52 H GLY 52 3.456 15.142 -5.684 390 HA2 GLY 52 2HA GLY 52 2.776 14.908 -8.416 391 HA3 GLY 52 1HA GLY 52 4.394 14.686 -7.746 392 H ALA 53 H ALA 53 3.694 12.524 -5.995 393 HA ALA 53 HA ALA 53 4.164 10.327 -7.627 394 HB1 ALA 53 1HB ALA 53 2.907 10.413 -4.890 395 HB2 ALA 53 2HB ALA 53 4.624 10.244 -5.258 396 HB3 ALA 53 3HB ALA 53 3.500 8.951 -5.679 397 H CYS 54 H CYS 54 1.244 11.985 -6.971 398 HA CYS 54 HA CYS 54 -0.354 9.776 -7.960 399 HB2 CYS 54 2HB CYS 54 -1.462 12.480 -7.252 400 HB3 CYS 54 1HB CYS 54 -2.245 10.897 -7.147 401 H LYS 55 H LYS 55 0.736 12.989 -8.849 402 HA LYS 55 HA LYS 55 -0.847 13.441 -11.101 403 HB2 LYS 55 2HB LYS 55 1.527 14.568 -9.928 404 HB3 LYS 55 1HB LYS 55 1.721 14.468 -11.673 405 HG2 LYS 55 2HG LYS 55 -0.633 15.551 -11.749 406 HG3 LYS 55 1HG LYS 55 -0.273 16.014 -10.074 407 HD2 LYS 55 2HD LYS 55 1.814 16.537 -12.119 408 HD3 LYS 55 1HD LYS 55 0.368 17.549 -12.160 409 HE2 LYS 55 2HE LYS 55 0.894 18.604 -10.237 410 HE3 LYS 55 1HE LYS 55 1.545 17.143 -9.495 411 HZ1 LYS 55 3HZ LYS 55 2.893 19.146 -11.150 412 HZ2 LYS 55 1HZ LYS 55 3.425 17.545 -11.261 413 HZ3 LYS 55 2HZ LYS 55 3.444 18.341 -9.769 414 H ALA 56 H ALA 56 2.482 12.138 -11.024 415 HA ALA 56 HA ALA 56 2.475 11.332 -13.750 416 HB1 ALA 56 1HB ALA 56 4.548 11.731 -12.554 417 HB2 ALA 56 2HB ALA 56 4.505 10.076 -13.161 418 HB3 ALA 56 3HB ALA 56 4.196 10.399 -11.454 419 H LEU 57 H LEU 57 0.975 10.010 -11.010 420 HA LEU 57 HA LEU 57 1.041 7.279 -11.935 421 HB2 LEU 57 2HB LEU 57 0.136 8.714 -9.535 422 HB3 LEU 57 1HB LEU 57 -0.828 7.314 -9.960 423 HG LEU 57 HG LEU 57 1.122 7.004 -8.311 424 HD11 LEU 57 1HD1 LEU 57 -0.220 5.267 -9.724 425 HD12 LEU 57 2HD1 LEU 57 1.240 4.780 -8.864 426 HD13 LEU 57 3HD1 LEU 57 1.304 5.100 -10.596 427 HD21 LEU 57 3HD2 LEU 57 2.793 6.679 -10.767 428 HD22 LEU 57 1HD2 LEU 57 3.291 6.868 -9.087 429 HD23 LEU 57 2HD2 LEU 57 2.674 8.254 -9.986 430 H LYS 58 H LYS 58 -0.954 10.000 -12.584 431 HA LYS 58 HA LYS 58 -3.375 8.526 -12.917 432 HB2 LYS 58 2HB LYS 58 -2.954 11.126 -14.325 433 HB3 LYS 58 1HB LYS 58 -4.397 10.491 -13.565 434 HG2 LYS 58 2HG LYS 58 -2.754 10.714 -11.430 435 HG3 LYS 58 1HG LYS 58 -2.200 12.060 -12.426 436 HD2 LYS 58 2HD LYS 58 -5.129 11.696 -12.085 437 HD3 LYS 58 1HD LYS 58 -4.210 12.305 -10.706 438 HE2 LYS 58 2HE LYS 58 -3.389 14.154 -11.992 439 HE3 LYS 58 1HE LYS 58 -4.090 13.499 -13.471 440 HZ1 LYS 58 3HZ LYS 58 -5.882 14.698 -13.021 441 HZ2 LYS 58 1HZ LYS 58 -5.294 15.142 -11.498 442 HZ3 LYS 58 2HZ LYS 58 -6.176 13.711 -11.681 443 HA PRO 59 HA PRO 59 -2.649 8.575 -17.611 444 HB2 PRO 59 2HB PRO 59 -0.515 9.762 -18.707 445 HB3 PRO 59 1HB PRO 59 -1.944 10.692 -18.216 446 HG2 PRO 59 2HG PRO 59 0.663 10.325 -16.786 447 HG3 PRO 59 1HG PRO 59 -0.290 11.799 -17.021 448 HD2 PRO 59 2HD PRO 59 -0.334 10.316 -14.719 449 HD3 PRO 59 1HD PRO 59 -1.689 11.329 -15.278 450 H LYS 60 H LYS 60 -0.011 7.959 -15.496 451 HA LYS 60 HA LYS 60 1.203 6.090 -17.380 452 HB2 LYS 60 2HB LYS 60 3.002 7.070 -16.445 453 HB3 LYS 60 1HB LYS 60 2.112 7.577 -15.027 454 HG2 LYS 60 2HG LYS 60 3.735 6.123 -14.227 455 HG3 LYS 60 1HG LYS 60 2.259 5.147 -14.260 456 HD2 LYS 60 2HD LYS 60 4.129 3.880 -15.154 457 HD3 LYS 60 1HD LYS 60 2.978 4.234 -16.444 458 HE2 LYS 60 2HE LYS 60 4.831 6.381 -16.316 459 HE3 LYS 60 1HE LYS 60 5.750 4.873 -16.300 460 HZ1 LYS 60 3HZ LYS 60 3.723 5.675 -18.317 461 HZ2 LYS 60 1HZ LYS 60 4.508 4.177 -18.283 462 HZ3 LYS 60 2HZ LYS 60 5.395 5.591 -18.551 463 H PHE 61 H PHE 61 -0.005 6.100 -14.003 464 HA PHE 61 HA PHE 61 0.141 3.325 -13.655 465 HB2 PHE 61 2HB PHE 61 -0.282 5.012 -11.831 466 HB3 PHE 61 1HB PHE 61 -1.942 5.119 -12.423 467 HD1 PHE 61 1HD PHE 61 -3.461 3.220 -12.245 468 HD2 PHE 61 2HD PHE 61 0.448 3.113 -10.567 469 HE1 PHE 61 1HE PHE 61 -4.101 1.268 -10.890 470 HE2 PHE 61 2HE PHE 61 -0.185 1.164 -9.205 471 HZ PHE 61 HZ PHE 61 -2.463 0.239 -9.370 472 H ALA 62 H ALA 62 -2.018 5.299 -15.490 473 HA ALA 62 HA ALA 62 -4.236 3.605 -15.641 474 HB1 ALA 62 1HB ALA 62 -3.216 5.891 -17.068 475 HB2 ALA 62 2HB ALA 62 -4.881 5.323 -16.925 476 HB3 ALA 62 3HB ALA 62 -3.847 4.701 -18.212 477 H GLU 63 H GLU 63 -1.026 3.287 -16.744 478 HA GLU 63 HA GLU 63 -1.414 1.316 -18.784 479 HB2 GLU 63 2HB GLU 63 0.613 2.957 -18.300 480 HB3 GLU 63 1HB GLU 63 1.163 1.614 -17.292 481 HG2 GLU 63 2HG GLU 63 2.204 1.255 -19.336 482 HG3 GLU 63 1HG GLU 63 0.821 0.162 -19.369 483 H SER 64 H SER 64 -1.540 1.328 -15.437 484 HA SER 64 HA SER 64 -0.456 -1.071 -14.633 485 HB2 SER 64 2HB SER 64 -2.839 0.476 -13.668 486 HB3 SER 64 1HB SER 64 -2.266 -0.961 -12.842 487 HG SER 64 HG SER 64 -0.746 1.382 -13.350 488 H THR 65 H THR 65 -2.654 -0.848 -17.058 489 HA THR 65 HA THR 65 -4.686 -2.624 -16.609 490 HB THR 65 HB THR 65 -3.274 -3.114 -19.150 491 HG1 THR 65 1HG THR 65 -4.083 -0.493 -18.438 492 HG21 THR 65 3HG2 THR 65 -5.351 -2.758 -20.148 493 HG22 THR 65 1HG2 THR 65 -5.955 -1.843 -18.767 494 HG23 THR 65 2HG2 THR 65 -5.710 -3.584 -18.631 495 H GLU 66 H GLU 66 -1.290 -3.269 -17.217 496 HA GLU 66 HA GLU 66 -1.621 -6.136 -17.071 497 HB2 GLU 66 2HB GLU 66 0.810 -6.240 -17.264 498 HB3 GLU 66 1HB GLU 66 0.151 -5.154 -18.494 499 HG2 GLU 66 2HG GLU 66 0.766 -3.698 -16.108 500 HG3 GLU 66 1HG GLU 66 2.171 -4.624 -16.631 501 H ILE 67 H ILE 67 -0.822 -3.451 -14.990 502 HA ILE 67 HA ILE 67 0.157 -5.038 -12.832 503 HB ILE 67 HB ILE 67 -1.082 -2.285 -12.836 504 HG12 ILE 67 2HG1 ILE 67 1.790 -3.230 -12.725 505 HG13 ILE 67 1HG1 ILE 67 1.012 -2.361 -14.056 506 HG21 ILE 67 1HG2 ILE 67 -1.259 -2.478 -10.629 507 HG22 ILE 67 2HG2 ILE 67 0.501 -2.525 -10.566 508 HG23 ILE 67 3HG2 ILE 67 -0.420 -4.026 -10.632 509 HD11 ILE 67 3HD1 ILE 67 0.641 -0.710 -11.866 510 HD12 ILE 67 1HD1 ILE 67 1.837 -0.513 -13.147 511 HD13 ILE 67 2HD1 ILE 67 2.272 -1.346 -11.656 512 H SER 68 H SER 68 -2.923 -4.504 -14.210 513 HA SER 68 HA SER 68 -4.583 -4.893 -11.954 514 HB2 SER 68 2HB SER 68 -6.345 -5.132 -13.477 515 HB3 SER 68 1HB SER 68 -5.192 -4.170 -14.400 516 HG SER 68 HG SER 68 -6.105 -6.030 -15.518 517 H GLU 69 H GLU 69 -2.899 -7.009 -14.174 518 HA GLU 69 HA GLU 69 -3.994 -9.439 -13.131 519 HB2 GLU 69 2HB GLU 69 -1.443 -9.068 -14.712 520 HB3 GLU 69 1HB GLU 69 -2.356 -10.559 -14.518 521 HG2 GLU 69 2HG GLU 69 -3.383 -8.097 -15.909 522 HG3 GLU 69 1HG GLU 69 -2.655 -9.482 -16.721 523 H LEU 70 H LEU 70 -1.033 -7.565 -12.743 524 HA LEU 70 HA LEU 70 0.271 -9.312 -10.940 525 HB2 LEU 70 2HB LEU 70 0.502 -6.391 -11.563 526 HB3 LEU 70 1HB LEU 70 1.375 -7.062 -10.188 527 HG LEU 70 HG LEU 70 2.263 -8.781 -11.957 528 HD11 LEU 70 1HD1 LEU 70 2.457 -7.893 -14.184 529 HD12 LEU 70 2HD1 LEU 70 1.594 -6.427 -13.717 530 HD13 LEU 70 3HD1 LEU 70 0.753 -7.977 -13.741 531 HD21 LEU 70 3HD2 LEU 70 3.448 -6.883 -10.671 532 HD22 LEU 70 1HD2 LEU 70 3.332 -5.993 -12.189 533 HD23 LEU 70 2HD2 LEU 70 4.209 -7.522 -12.129 534 H SER 71 H SER 71 -2.478 -7.348 -10.559 535 HA SER 71 HA SER 71 -2.226 -6.626 -7.849 536 HB2 SER 71 2HB SER 71 -4.067 -6.176 -9.874 537 HB3 SER 71 1HB SER 71 -4.949 -7.120 -8.676 538 HG SER 71 HG SER 71 -3.537 -4.705 -8.222 539 H HIS 72 H HIS 72 -3.127 -9.604 -9.392 540 HA HIS 72 HA HIS 72 -4.612 -10.756 -7.300 541 HB2 HIS 72 2HB HIS 72 -4.154 -12.904 -8.349 542 HB3 HIS 72 1HB HIS 72 -4.519 -11.698 -9.590 543 HD1 HIS 72 1HD HIS 72 -3.178 -12.410 -11.545 544 HD2 HIS 72 2HD HIS 72 -0.963 -12.535 -8.031 545 HE1 HIS 72 1HE HIS 72 -0.834 -12.985 -12.246 546 HE2 HIS 72 2HE HIS 72 0.501 -13.004 -10.109 547 H ASN 73 H ASN 73 -1.359 -9.906 -7.525 548 HA ASN 73 HA ASN 73 -0.333 -11.906 -5.734 549 HB2 ASN 73 2HB ASN 73 0.903 -9.319 -6.692 550 HB3 ASN 73 1HB ASN 73 1.738 -10.665 -5.916 551 HD21 ASN 73 1HD2 ASN 73 1.062 -9.277 -8.808 552 HD22 ASN 73 2HD2 ASN 73 1.265 -10.658 -9.847 553 H PHE 74 H PHE 74 -1.836 -8.830 -5.425 554 HA PHE 74 HA PHE 74 -1.699 -9.014 -2.539 555 HB2 PHE 74 2HB PHE 74 -1.209 -6.458 -2.491 556 HB3 PHE 74 1HB PHE 74 0.132 -7.579 -2.742 557 HD1 PHE 74 2HD PHE 74 -2.426 -5.956 -4.908 558 HD2 PHE 74 1HD PHE 74 1.688 -6.822 -4.235 559 HE1 PHE 74 2HE PHE 74 -1.846 -4.803 -6.995 560 HE2 PHE 74 1HE PHE 74 2.273 -5.668 -6.327 561 HZ PHE 74 HZ PHE 74 0.505 -4.656 -7.708 562 H VAL 75 H VAL 75 -2.919 -6.200 -2.357 563 HA VAL 75 HA VAL 75 -5.246 -6.433 -4.039 564 HB VAL 75 HB VAL 75 -5.627 -8.148 -2.279 565 HG11 VAL 75 1HG1 VAL 75 -4.626 -6.653 -0.458 566 HG12 VAL 75 2HG1 VAL 75 -6.068 -7.585 -0.052 567 HG13 VAL 75 3HG1 VAL 75 -6.203 -5.866 -0.420 568 HG21 VAL 75 3HG2 VAL 75 -7.933 -7.714 -2.139 569 HG22 VAL 75 1HG2 VAL 75 -7.402 -6.922 -3.621 570 HG23 VAL 75 2HG2 VAL 75 -7.690 -5.967 -2.167 571 H MET 76 H MET 76 -6.436 -4.716 -4.272 572 HA MET 76 HA MET 76 -5.809 -2.195 -4.004 573 HB2 MET 76 2HB MET 76 -8.343 -1.831 -3.818 574 HB3 MET 76 1HB MET 76 -7.722 -2.711 -5.199 575 HG2 MET 76 2HG MET 76 -8.427 -4.319 -2.838 576 HG3 MET 76 1HG MET 76 -9.766 -3.554 -3.679 577 HE1 MET 76 3HE MET 76 -10.586 -5.764 -3.642 578 HE2 MET 76 1HE MET 76 -9.864 -7.205 -4.358 579 HE3 MET 76 2HE MET 76 -10.890 -6.155 -5.335 580 H VAL 77 H VAL 77 -4.980 -1.219 -2.216 581 HA VAL 77 HA VAL 77 -6.893 -0.667 -0.102 582 HB VAL 77 HB VAL 77 -4.064 -1.566 0.470 583 HG11 VAL 77 1HG1 VAL 77 -5.997 0.014 2.059 584 HG12 VAL 77 2HG1 VAL 77 -4.233 -0.015 2.119 585 HG13 VAL 77 3HG1 VAL 77 -5.163 -1.290 2.906 586 HG21 VAL 77 3HG2 VAL 77 -5.367 -3.186 1.956 587 HG22 VAL 77 1HG2 VAL 77 -5.384 -3.473 0.217 588 HG23 VAL 77 2HG2 VAL 77 -6.773 -2.722 1.000 589 H ASN 78 H ASN 78 -6.787 1.147 -1.780 590 HA ASN 78 HA ASN 78 -4.621 3.006 -1.162 591 HB2 ASN 78 2HB ASN 78 -4.734 2.945 -3.440 592 HB3 ASN 78 1HB ASN 78 -6.452 2.598 -3.454 593 HD21 ASN 78 1HD2 ASN 78 -4.164 5.164 -2.659 594 HD22 ASN 78 2HD2 ASN 78 -5.148 6.463 -3.253 595 H LEU 79 H LEU 79 -5.078 4.151 0.588 596 HA LEU 79 HA LEU 79 -7.770 5.327 0.826 597 HB2 LEU 79 2HB LEU 79 -7.269 5.508 3.266 598 HB3 LEU 79 1HB LEU 79 -7.403 3.870 2.659 599 HG LEU 79 HG LEU 79 -4.710 4.309 2.457 600 HD11 LEU 79 1HD1 LEU 79 -4.683 6.402 3.560 601 HD12 LEU 79 2HD1 LEU 79 -4.098 5.213 4.723 602 HD13 LEU 79 3HD1 LEU 79 -5.750 5.821 4.838 603 HD21 LEU 79 3HD2 LEU 79 -5.655 2.297 3.323 604 HD22 LEU 79 1HD2 LEU 79 -6.325 3.148 4.716 605 HD23 LEU 79 2HD2 LEU 79 -4.579 2.958 4.555 606 H GLU 80 H GLU 80 -7.408 7.276 2.631 607 HA GLU 80 HA GLU 80 -5.452 9.079 1.371 608 HB2 GLU 80 2HB GLU 80 -8.173 9.358 1.297 609 HB3 GLU 80 1HB GLU 80 -7.758 10.325 2.717 610 HG2 GLU 80 2HG GLU 80 -6.640 11.887 1.500 611 HG3 GLU 80 1HG GLU 80 -6.167 10.735 0.242 612 H ASP 81 H ASP 81 -5.588 11.207 3.056 613 HA ASP 81 HA ASP 81 -3.818 10.670 5.060 614 HB2 ASP 81 2HB ASP 81 -4.681 12.935 4.196 615 HB3 ASP 81 1HB ASP 81 -5.939 12.775 5.419 616 H GLU 82 H GLU 82 -7.332 10.432 5.224 617 HA GLU 82 HA GLU 82 -7.049 9.294 7.929 618 HB2 GLU 82 2HB GLU 82 -8.600 11.480 7.140 619 HB3 GLU 82 1HB GLU 82 -9.749 10.158 7.303 620 HG2 GLU 82 2HG GLU 82 -8.373 9.811 9.565 621 HG3 GLU 82 1HG GLU 82 -8.154 11.548 9.355 622 H GLU 83 H GLU 83 -9.767 9.280 5.642 623 HA GLU 83 HA GLU 83 -11.114 7.581 4.941 624 HB2 GLU 83 2HB GLU 83 -8.342 6.869 4.258 625 HB3 GLU 83 1HB GLU 83 -9.476 5.526 4.215 626 HG2 GLU 83 2HG GLU 83 -9.842 8.130 2.750 627 HG3 GLU 83 1HG GLU 83 -9.198 6.646 2.037 628 H GLU 84 H GLU 84 -8.700 5.262 6.023 629 HA GLU 84 HA GLU 84 -10.622 4.328 8.047 630 HB2 GLU 84 2HB GLU 84 -9.250 2.927 5.910 631 HB3 GLU 84 1HB GLU 84 -8.927 2.186 7.473 632 HG2 GLU 84 2HG GLU 84 -10.855 1.124 7.269 633 HG3 GLU 84 1HG GLU 84 -11.660 2.677 7.486 634 HA PRO 85 HA PRO 85 -6.359 3.773 10.106 635 HB2 PRO 85 2HB PRO 85 -4.213 4.630 8.398 636 HB3 PRO 85 1HB PRO 85 -4.574 2.991 8.966 637 HG2 PRO 85 2HG PRO 85 -4.773 3.820 6.342 638 HG3 PRO 85 1HG PRO 85 -5.641 2.432 7.033 639 HD2 PRO 85 2HD PRO 85 -6.613 5.218 6.507 640 HD3 PRO 85 1HD PRO 85 -7.453 3.664 6.284 641 H LYS 86 H LYS 86 -4.314 5.243 10.720 642 HA LYS 86 HA LYS 86 -4.322 7.975 10.135 643 HB2 LYS 86 2HB LYS 86 -6.590 7.529 11.439 644 HB3 LYS 86 1HB LYS 86 -5.524 7.621 12.847 645 HG2 LYS 86 2HG LYS 86 -4.979 9.844 12.439 646 HG3 LYS 86 1HG LYS 86 -5.508 9.768 10.757 647 HD2 LYS 86 2HD LYS 86 -7.596 10.337 11.300 648 HD3 LYS 86 1HD LYS 86 -7.662 9.133 12.589 649 HE2 LYS 86 2HE LYS 86 -6.540 10.658 14.106 650 HE3 LYS 86 1HE LYS 86 -6.364 11.848 12.816 651 HZ1 LYS 86 3HZ LYS 86 -8.823 11.914 12.686 652 HZ2 LYS 86 1HZ LYS 86 -8.214 12.454 14.170 653 HZ3 LYS 86 2HZ LYS 86 -8.898 10.914 14.047 654 H ASP 87 H ASP 87 -2.138 6.873 10.204 655 HA ASP 87 HA ASP 87 -0.861 7.575 12.712 656 HB2 ASP 87 2HB ASP 87 -1.575 4.963 12.407 657 HB3 ASP 87 1HB ASP 87 0.053 4.952 11.718 658 H GLU 88 H GLU 88 1.638 6.522 12.247 659 HA GLU 88 HA GLU 88 2.622 8.311 10.235 660 HB2 GLU 88 2HB GLU 88 3.869 6.454 12.223 661 HB3 GLU 88 1HB GLU 88 4.849 7.106 10.916 662 HG2 GLU 88 2HG GLU 88 3.258 8.807 12.817 663 HG3 GLU 88 1HG GLU 88 4.951 8.378 13.061 664 H ASP 89 H ASP 89 1.594 5.070 10.211 665 HA ASP 89 HA ASP 89 3.242 3.714 8.524 666 HB2 ASP 89 2HB ASP 89 0.345 3.666 9.074 667 HB3 ASP 89 1HB ASP 89 0.815 2.959 7.520 668 H PHE 90 H PHE 90 1.069 6.332 7.656 669 HA PHE 90 HA PHE 90 1.081 6.004 4.868 670 HB2 PHE 90 2HB PHE 90 0.953 8.664 6.289 671 HB3 PHE 90 1HB PHE 90 0.237 8.227 4.731 672 HD1 PHE 90 2HD PHE 90 -1.066 5.679 5.355 673 HD2 PHE 90 1HD PHE 90 -0.821 9.266 7.633 674 HE1 PHE 90 2HE PHE 90 -3.170 5.099 6.491 675 HE2 PHE 90 1HE PHE 90 -2.925 8.691 8.773 676 HZ PHE 90 HZ PHE 90 -4.102 6.606 8.201 677 H SER 91 H SER 91 3.577 6.999 6.978 678 HA SER 91 HA SER 91 5.281 7.697 4.699 679 HB2 SER 91 2HB SER 91 5.743 9.240 7.195 680 HB3 SER 91 1HB SER 91 5.920 9.740 5.505 681 HG SER 91 HG SER 91 3.857 10.134 7.179 682 HA PRO 92 HA PRO 92 8.008 5.062 7.111 683 HB2 PRO 92 2HB PRO 92 9.634 4.370 5.170 684 HB3 PRO 92 1HB PRO 92 7.913 3.956 5.031 685 HG2 PRO 92 2HG PRO 92 9.448 6.153 3.708 686 HG3 PRO 92 1HG PRO 92 8.165 5.137 3.048 687 HD2 PRO 92 2HD PRO 92 7.876 7.729 4.148 688 HD3 PRO 92 1HD PRO 92 6.568 6.610 3.730 689 H ASP 93 H ASP 93 8.947 6.696 8.513 690 HA ASP 93 HA ASP 93 10.674 7.934 9.345 691 HB2 ASP 93 2HB ASP 93 11.998 5.961 8.639 692 HB3 ASP 93 1HB ASP 93 12.229 6.704 7.047 693 H GLY 94 H GLY 94 8.945 8.900 7.015 694 HA2 GLY 94 2HA GLY 94 10.748 11.072 6.130 695 HA3 GLY 94 1HA GLY 94 9.438 10.428 5.137 696 H GLY 95 H GLY 95 9.024 12.846 5.100 697 HA2 GLY 95 2HA GLY 95 7.082 13.443 7.234 698 HA3 GLY 95 1HA GLY 95 8.291 14.651 6.791 699 H TYR 96 H TYR 96 6.907 12.579 4.365 700 HA TYR 96 HA TYR 96 5.834 14.883 2.993 701 HB2 TYR 96 2HB TYR 96 5.423 13.342 1.147 702 HB3 TYR 96 1HB TYR 96 7.059 13.122 1.773 703 HD1 TYR 96 1HD TYR 96 4.619 11.660 3.949 704 HD2 TYR 96 2HD TYR 96 6.806 10.981 0.367 705 HE1 TYR 96 1HE TYR 96 4.179 9.271 4.141 706 HE2 TYR 96 2HE TYR 96 6.375 8.566 0.562 707 HH TYR 96 HH TYR 96 4.130 7.235 2.136 708 H ILE 97 H ILE 97 3.623 13.410 1.699 709 HA ILE 97 HA ILE 97 1.780 12.432 3.545 710 HB ILE 97 HB ILE 97 0.267 14.645 3.295 711 HG12 ILE 97 2HG1 ILE 97 2.824 15.947 4.012 712 HG13 ILE 97 1HG1 ILE 97 2.573 15.611 2.296 713 HG21 ILE 97 1HG2 ILE 97 0.336 14.658 5.524 714 HG22 ILE 97 2HG2 ILE 97 2.086 14.868 5.570 715 HG23 ILE 97 3HG2 ILE 97 1.397 13.260 5.341 716 HD11 ILE 97 3HD1 ILE 97 0.304 16.866 3.671 717 HD12 ILE 97 1HD1 ILE 97 1.004 17.193 2.084 718 HD13 ILE 97 2HD1 ILE 97 1.757 17.856 3.536 719 HA PRO 98 HA PRO 98 1.269 10.218 2.606 720 HB2 PRO 98 2HB PRO 98 -1.485 9.863 1.353 721 HB3 PRO 98 1HB PRO 98 -0.767 8.940 2.703 722 HG2 PRO 98 2HG PRO 98 -2.063 11.487 2.778 723 HG3 PRO 98 1HG PRO 98 -1.337 10.564 4.126 724 HD2 PRO 98 2HD PRO 98 -0.178 12.762 3.473 725 HD3 PRO 98 1HD PRO 98 0.846 11.320 3.614 726 H ARG 99 H ARG 99 2.124 8.401 1.565 727 HA ARG 99 HA ARG 99 1.967 8.481 -1.385 728 HB2 ARG 99 2HB ARG 99 4.216 8.321 0.465 729 HB3 ARG 99 1HB ARG 99 4.313 7.185 -0.873 730 HG2 ARG 99 2HG ARG 99 5.465 9.270 -1.369 731 HG3 ARG 99 1HG ARG 99 4.101 9.016 -2.459 732 HD2 ARG 99 2HD ARG 99 2.891 10.448 -0.539 733 HD3 ARG 99 1HD ARG 99 4.526 11.069 -0.375 734 HE ARG 99 HE ARG 99 3.431 11.025 -3.062 735 HH11 ARG 99 1HH1 ARG 99 4.041 12.884 -0.168 736 HH12 ARG 99 2HH1 ARG 99 3.950 14.409 -0.979 737 HH21 ARG 99 1HH2 ARG 99 3.307 13.036 -4.125 738 HH22 ARG 99 2HH2 ARG 99 3.542 14.495 -3.222 739 H ILE 100 H ILE 100 3.313 6.203 -2.023 740 HA ILE 100 HA ILE 100 1.337 4.155 -1.322 741 HB ILE 100 HB ILE 100 3.475 4.006 -3.437 742 HG12 ILE 100 2HG1 ILE 100 1.322 4.438 -4.908 743 HG13 ILE 100 1HG1 ILE 100 0.768 5.261 -3.454 744 HG21 ILE 100 1HG2 ILE 100 1.361 2.227 -2.512 745 HG22 ILE 100 2HG2 ILE 100 2.811 1.878 -3.452 746 HG23 ILE 100 3HG2 ILE 100 1.364 2.483 -4.257 747 HD11 ILE 100 3HD1 ILE 100 1.943 7.047 -3.994 748 HD12 ILE 100 1HD1 ILE 100 2.437 6.246 -5.486 749 HD13 ILE 100 2HD1 ILE 100 3.427 6.094 -4.034 750 H LEU 101 H LEU 101 1.884 2.099 -0.556 751 HA LEU 101 HA LEU 101 4.589 1.304 -0.125 752 HB2 LEU 101 2HB LEU 101 4.062 1.194 2.471 753 HB3 LEU 101 1HB LEU 101 4.839 2.571 1.721 754 HG LEU 101 HG LEU 101 1.873 2.617 1.928 755 HD11 LEU 101 1HD1 LEU 101 3.020 1.841 4.144 756 HD12 LEU 101 2HD1 LEU 101 1.771 3.088 4.165 757 HD13 LEU 101 3HD1 LEU 101 3.473 3.540 4.256 758 HD21 LEU 101 3HD2 LEU 101 2.247 4.700 1.277 759 HD22 LEU 101 1HD2 LEU 101 3.986 4.429 1.325 760 HD23 LEU 101 2HD2 LEU 101 3.144 5.000 2.763 761 H PHE 102 H PHE 102 4.822 -0.762 0.909 762 HA PHE 102 HA PHE 102 2.422 -2.410 0.518 763 HB2 PHE 102 2HB PHE 102 4.986 -2.753 -0.365 764 HB3 PHE 102 1HB PHE 102 4.973 -3.764 1.073 765 HD1 PHE 102 2HD PHE 102 2.290 -3.090 -1.415 766 HD2 PHE 102 1HD PHE 102 4.928 -5.937 0.328 767 HE1 PHE 102 2HE PHE 102 1.193 -4.885 -2.692 768 HE2 PHE 102 1HE PHE 102 3.839 -7.734 -0.947 769 HZ PHE 102 HZ PHE 102 1.972 -7.210 -2.457 770 H LEU 103 H LEU 103 1.721 -3.923 2.073 771 HA LEU 103 HA LEU 103 3.002 -3.799 4.697 772 HB2 LEU 103 2HB LEU 103 1.103 -3.152 5.879 773 HB3 LEU 103 1HB LEU 103 1.181 -2.053 4.521 774 HG LEU 103 HG LEU 103 -0.648 -4.421 4.794 775 HD11 LEU 103 1HD1 LEU 103 -1.001 -1.478 5.132 776 HD12 LEU 103 2HD1 LEU 103 -1.533 -2.794 6.168 777 HD13 LEU 103 3HD1 LEU 103 -2.353 -2.494 4.635 778 HD21 LEU 103 3HD2 LEU 103 -0.458 -4.369 2.534 779 HD22 LEU 103 1HD2 LEU 103 0.097 -2.694 2.508 780 HD23 LEU 103 2HD2 LEU 103 -1.619 -3.055 2.708 781 H ASP 104 H ASP 104 2.505 -5.505 6.101 782 HA ASP 104 HA ASP 104 2.242 -8.006 4.891 783 HB2 ASP 104 2HB ASP 104 2.605 -6.964 7.574 784 HB3 ASP 104 1HB ASP 104 1.559 -8.390 7.574 785 HA PRO 105 HA PRO 105 -2.069 -8.689 4.234 786 HB2 PRO 105 2HB PRO 105 -1.535 -11.418 5.303 787 HB3 PRO 105 1HB PRO 105 -2.274 -10.928 3.766 788 HG2 PRO 105 2HG PRO 105 0.227 -11.865 3.865 789 HG3 PRO 105 1HG PRO 105 -0.229 -10.554 2.752 790 HD2 PRO 105 2HD PRO 105 1.296 -10.429 5.313 791 HD3 PRO 105 1HD PRO 105 1.485 -9.466 3.835 792 H SER 106 H SER 106 -2.834 -7.360 5.917 793 HA SER 106 HA SER 106 -4.577 -8.372 7.717 794 HB2 SER 106 2HB SER 106 -1.816 -8.556 8.758 795 HB3 SER 106 1HB SER 106 -2.985 -7.816 9.863 796 HG SER 106 HG SER 106 -2.685 -10.251 9.799 797 H GLY 107 H GLY 107 -2.176 -5.950 7.044 798 HA2 GLY 107 2HA GLY 107 -3.049 -3.677 6.707 799 HA3 GLY 107 1HA GLY 107 -3.989 -3.914 8.184 800 H LYS 108 H LYS 108 -0.589 -4.798 7.621 801 HA LYS 108 HA LYS 108 0.125 -2.823 9.702 802 HB2 LYS 108 2HB LYS 108 0.910 -5.684 9.372 803 HB3 LYS 108 1HB LYS 108 2.054 -4.571 10.110 804 HG2 LYS 108 2HG LYS 108 -0.305 -4.022 11.428 805 HG3 LYS 108 1HG LYS 108 -0.349 -5.780 11.205 806 HD2 LYS 108 2HD LYS 108 2.153 -5.590 12.034 807 HD3 LYS 108 1HD LYS 108 1.557 -4.097 12.762 808 HE2 LYS 108 2HE LYS 108 0.640 -6.917 13.254 809 HE3 LYS 108 1HE LYS 108 1.293 -5.758 14.413 810 HZ1 LYS 108 3HZ LYS 108 -0.868 -5.460 14.888 811 HZ2 LYS 108 1HZ LYS 108 -1.407 -6.036 13.392 812 HZ3 LYS 108 2HZ LYS 108 -0.853 -4.445 13.535 813 H VAL 109 H VAL 109 0.605 -1.326 7.946 814 HA VAL 109 HA VAL 109 2.502 -1.759 5.932 815 HB VAL 109 HB VAL 109 1.240 0.575 7.177 816 HG11 VAL 109 1HG1 VAL 109 3.987 0.863 5.976 817 HG12 VAL 109 2HG1 VAL 109 3.489 1.289 7.612 818 HG13 VAL 109 3HG1 VAL 109 2.866 2.198 6.237 819 HG21 VAL 109 3HG2 VAL 109 0.488 -0.292 5.071 820 HG22 VAL 109 1HG2 VAL 109 2.095 -0.095 4.372 821 HG23 VAL 109 2HG2 VAL 109 1.150 1.321 4.831 822 H HIS 110 H HIS 110 4.631 -1.775 5.822 823 HA HIS 110 HA HIS 110 6.148 -0.991 8.213 824 HB2 HIS 110 2HB HIS 110 5.973 -3.676 6.997 825 HB3 HIS 110 1HB HIS 110 7.606 -3.124 7.356 826 HD1 HIS 110 1HD HIS 110 7.993 -2.377 9.933 827 HD2 HIS 110 2HD HIS 110 4.619 -4.670 9.140 828 HE1 HIS 110 1HE HIS 110 7.262 -3.289 12.159 829 HE2 HIS 110 2HE HIS 110 5.266 -4.737 11.644 830 HA PRO 111 HA PRO 111 8.579 1.095 5.153 831 HB2 PRO 111 2HB PRO 111 10.834 1.517 6.613 832 HB3 PRO 111 1HB PRO 111 9.350 2.451 6.839 833 HG2 PRO 111 2HG PRO 111 10.385 0.127 8.415 834 HG3 PRO 111 1HG PRO 111 9.644 1.630 8.995 835 HD2 PRO 111 2HD PRO 111 8.276 -0.700 8.825 836 HD3 PRO 111 1HD PRO 111 7.503 0.884 8.570 837 H GLU 112 H GLU 112 8.567 -1.857 5.168 838 HA GLU 112 HA GLU 112 11.374 -2.515 4.662 839 HB2 GLU 112 2HB GLU 112 8.869 -4.128 5.023 840 HB3 GLU 112 1HB GLU 112 10.265 -4.841 4.228 841 HG2 GLU 112 2HG GLU 112 11.212 -3.611 6.577 842 HG3 GLU 112 1HG GLU 112 9.752 -4.499 7.013 843 H ILE 113 H ILE 113 8.229 -2.446 3.061 844 HA ILE 113 HA ILE 113 9.534 -2.882 0.473 845 HB ILE 113 HB ILE 113 6.575 -2.742 1.010 846 HG12 ILE 113 2HG1 ILE 113 7.502 -4.546 2.360 847 HG13 ILE 113 1HG1 ILE 113 6.615 -5.222 0.986 848 HG21 ILE 113 1HG2 ILE 113 6.445 -3.997 -1.116 849 HG22 ILE 113 2HG2 ILE 113 8.194 -3.847 -1.280 850 HG23 ILE 113 3HG2 ILE 113 7.179 -2.404 -1.303 851 HD11 ILE 113 3HD1 ILE 113 9.171 -5.014 0.017 852 HD12 ILE 113 1HD1 ILE 113 8.424 -6.473 0.667 853 HD13 ILE 113 2HD1 ILE 113 9.422 -5.456 1.705 854 H ILE 114 H ILE 114 10.475 -0.748 0.603 855 HA ILE 114 HA ILE 114 8.626 1.480 0.161 856 HB ILE 114 HB ILE 114 10.557 2.932 0.546 857 HG12 ILE 114 2HG1 ILE 114 12.141 1.004 -0.343 858 HG13 ILE 114 1HG1 ILE 114 12.734 2.212 0.783 859 HG21 ILE 114 1HG2 ILE 114 9.610 2.721 2.574 860 HG22 ILE 114 2HG2 ILE 114 11.102 1.862 2.951 861 HG23 ILE 114 3HG2 ILE 114 9.646 0.959 2.531 862 HD11 ILE 114 3HD1 ILE 114 13.005 -0.474 1.066 863 HD12 ILE 114 1HD1 ILE 114 11.593 -0.148 2.071 864 HD13 ILE 114 2HD1 ILE 114 13.108 0.699 2.379 865 H ASN 115 H ASN 115 10.289 3.183 -1.241 866 HA ASN 115 HA ASN 115 10.362 1.885 -3.865 867 HB2 ASN 115 2HB ASN 115 8.992 3.909 -3.679 868 HB3 ASN 115 1HB ASN 115 10.397 4.814 -3.102 869 HD21 ASN 115 1HD2 ASN 115 8.672 5.226 -5.435 870 HD22 ASN 115 2HD2 ASN 115 9.738 5.226 -6.815 871 H GLU 116 H GLU 116 12.367 0.819 -3.604 872 HA GLU 116 HA GLU 116 14.749 1.916 -2.723 873 HB2 GLU 116 2HB GLU 116 14.075 -0.282 -4.642 874 HB3 GLU 116 1HB GLU 116 15.759 0.220 -4.455 875 HG2 GLU 116 2HG GLU 116 14.003 -0.603 -2.157 876 HG3 GLU 116 1HG GLU 116 15.041 -1.720 -3.043 877 H ASN 117 H ASN 117 13.050 2.488 -5.678 878 HA ASN 117 HA ASN 117 15.324 3.559 -7.086 879 HB2 ASN 117 2HB ASN 117 12.506 2.989 -7.678 880 HB3 ASN 117 1HB ASN 117 13.113 4.460 -8.451 881 HD21 ASN 117 1HD2 ASN 117 13.980 4.188 -10.359 882 HD22 ASN 117 2HD2 ASN 117 14.717 2.727 -10.958 883 H GLY 118 H GLY 118 13.314 4.738 -4.650 884 HA2 GLY 118 2HA GLY 118 13.413 7.505 -5.571 885 HA3 GLY 118 1HA GLY 118 12.599 6.910 -4.120 886 H ASN 119 H ASN 119 13.953 9.133 -3.787 887 HA ASN 119 HA ASN 119 16.703 8.780 -3.115 888 HB2 ASN 119 2HB ASN 119 16.474 11.024 -2.039 889 HB3 ASN 119 1HB ASN 119 15.923 10.984 -3.720 890 HD21 ASN 119 1HD2 ASN 119 13.709 11.080 -4.159 891 HD22 ASN 119 2HD2 ASN 119 12.573 11.684 -2.981 892 HA PRO 120 HA PRO 120 16.368 7.167 0.968 893 HB2 PRO 120 2HB PRO 120 18.532 8.211 2.188 894 HB3 PRO 120 1HB PRO 120 18.665 7.001 0.897 895 HG2 PRO 120 2HG PRO 120 18.975 9.982 0.746 896 HG3 PRO 120 1HG PRO 120 19.975 8.710 0.007 897 HD2 PRO 120 2HD PRO 120 18.064 10.082 -1.362 898 HD3 PRO 120 1HD PRO 120 18.515 8.402 -1.742 899 H SER 121 H SER 121 14.434 8.986 0.896 900 HA SER 121 HA SER 121 14.359 9.999 3.555 901 HB2 SER 121 2HB SER 121 14.900 11.921 1.301 902 HB3 SER 121 1HB SER 121 13.935 12.433 2.695 903 HG SER 121 HG SER 121 15.746 12.690 3.707 904 H TYR 122 H TYR 122 13.151 10.100 0.295 905 HA TYR 122 HA TYR 122 10.433 10.651 1.094 906 HB2 TYR 122 2HB TYR 122 12.049 10.808 -1.274 907 HB3 TYR 122 1HB TYR 122 10.591 9.877 -1.613 908 HD1 TYR 122 2HD TYR 122 8.399 11.057 -0.471 909 HD2 TYR 122 1HD TYR 122 11.939 13.045 -1.722 910 HE1 TYR 122 2HE TYR 122 7.138 13.160 -0.668 911 HE2 TYR 122 1HE TYR 122 10.696 15.154 -1.920 912 HH TYR 122 HH TYR 122 8.022 15.682 -2.344 913 H LYS 123 H LYS 123 12.363 7.977 -0.123 914 HA LYS 123 HA LYS 123 11.940 5.770 -0.452 915 HB2 LYS 123 2HB LYS 123 10.752 6.467 2.191 916 HB3 LYS 123 1HB LYS 123 10.442 4.860 1.565 917 HG2 LYS 123 2HG LYS 123 13.026 6.093 2.416 918 HG3 LYS 123 1HG LYS 123 12.301 4.543 2.883 919 HD2 LYS 123 2HD LYS 123 13.865 3.730 1.467 920 HD3 LYS 123 1HD LYS 123 12.636 4.110 0.254 921 HE2 LYS 123 2HE LYS 123 13.769 6.419 0.154 922 HE3 LYS 123 1HE LYS 123 15.119 5.633 0.971 923 HZ1 LYS 123 3HZ LYS 123 15.602 4.366 -0.845 924 HZ2 LYS 123 1HZ LYS 123 14.980 5.732 -1.628 925 HZ3 LYS 123 2HZ LYS 123 14.012 4.359 -1.425 926 H TYR 124 H TYR 124 8.843 5.896 1.102 927 HA TYR 124 HA TYR 124 7.448 4.513 -0.788 928 HB2 TYR 124 2HB TYR 124 6.535 6.473 1.296 929 HB3 TYR 124 1HB TYR 124 5.387 5.586 0.286 930 HD1 TYR 124 2HD TYR 124 7.660 3.179 0.399 931 HD2 TYR 124 1HD TYR 124 5.270 5.333 3.185 932 HE1 TYR 124 2HE TYR 124 7.773 1.287 1.952 933 HE2 TYR 124 1HE TYR 124 5.385 3.442 4.748 934 HH TYR 124 HH TYR 124 6.430 0.374 3.844 935 H PHE 125 H PHE 125 8.672 7.514 -1.458 936 HA PHE 125 HA PHE 125 6.472 8.653 -2.869 937 HB2 PHE 125 2HB PHE 125 8.524 9.881 -1.983 938 HB3 PHE 125 1HB PHE 125 9.392 9.224 -3.377 939 HD1 PHE 125 2HD PHE 125 5.916 10.529 -3.148 940 HD2 PHE 125 1HD PHE 125 9.834 11.055 -4.721 941 HE1 PHE 125 2HE PHE 125 5.107 12.390 -4.532 942 HE2 PHE 125 1HE PHE 125 9.029 12.921 -6.109 943 HZ PHE 125 HZ PHE 125 6.661 13.588 -6.016 944 H TYR 126 H TYR 126 5.620 7.813 -4.655 945 HA TYR 126 HA TYR 126 7.427 6.503 -6.581 946 HB2 TYR 126 2HB TYR 126 4.573 5.822 -5.853 947 HB3 TYR 126 1HB TYR 126 5.390 5.177 -7.282 948 HD1 TYR 126 2HD TYR 126 7.233 3.572 -7.033 949 HD2 TYR 126 1HD TYR 126 5.102 5.024 -3.656 950 HE1 TYR 126 2HE TYR 126 8.149 1.737 -5.677 951 HE2 TYR 126 1HE TYR 126 6.008 3.195 -2.285 952 HH TYR 126 HH TYR 126 7.655 1.583 -2.212 953 H VAL 127 H VAL 127 7.770 8.242 -7.915 954 HA VAL 127 HA VAL 127 5.463 9.701 -8.955 955 HB VAL 127 HB VAL 127 7.252 11.045 -10.168 956 HG11 VAL 127 1HG1 VAL 127 6.178 11.929 -8.215 957 HG12 VAL 127 2HG1 VAL 127 7.904 12.270 -8.103 958 HG13 VAL 127 3HG1 VAL 127 7.201 10.960 -7.155 959 HG21 VAL 127 3HG2 VAL 127 9.119 9.706 -8.223 960 HG22 VAL 127 1HG2 VAL 127 9.518 10.857 -9.499 961 HG23 VAL 127 2HG2 VAL 127 8.984 9.229 -9.915 962 H SER 128 H SER 128 5.479 7.059 -9.719 963 HA SER 128 HA SER 128 5.009 7.087 -12.396 964 HB2 SER 128 2HB SER 128 7.230 5.717 -13.050 965 HB3 SER 128 1HB SER 128 7.098 7.474 -13.238 966 HG SER 128 HG SER 128 8.936 6.314 -11.936 967 H ALA 129 H ALA 129 3.751 5.392 -12.634 968 HA ALA 129 HA ALA 129 3.448 3.294 -10.879 969 HB1 ALA 129 1HB ALA 129 1.846 3.998 -12.669 970 HB2 ALA 129 2HB ALA 129 2.060 2.255 -12.509 971 HB3 ALA 129 3HB ALA 129 2.854 3.124 -13.823 972 H GLU 130 H GLU 130 5.841 3.748 -13.307 973 HA GLU 130 HA GLU 130 6.541 1.146 -13.964 974 HB2 GLU 130 2HB GLU 130 7.408 3.430 -14.859 975 HB3 GLU 130 1HB GLU 130 8.623 3.272 -13.585 976 HG2 GLU 130 2HG GLU 130 9.018 0.922 -14.615 977 HG3 GLU 130 1HG GLU 130 8.209 1.611 -16.034 978 H GLN 131 H GLN 131 8.291 3.172 -11.566 979 HA GLN 131 HA GLN 131 9.757 1.033 -10.546 980 HB2 GLN 131 2HB GLN 131 10.024 2.453 -8.493 981 HB3 GLN 131 1HB GLN 131 10.589 3.146 -10.008 982 HG2 GLN 131 2HG GLN 131 7.908 3.938 -9.715 983 HG3 GLN 131 1HG GLN 131 8.674 4.168 -8.146 984 HE21 GLN 131 1HE2 GLN 131 8.306 6.435 -8.535 985 HE22 GLN 131 2HE2 GLN 131 9.424 7.329 -9.502 986 H VAL 132 H VAL 132 6.715 2.441 -9.314 987 HA VAL 132 HA VAL 132 6.528 0.812 -7.054 988 HB VAL 132 HB VAL 132 5.007 2.619 -7.186 989 HG11 VAL 132 1HG1 VAL 132 3.698 3.189 -8.922 990 HG12 VAL 132 2HG1 VAL 132 3.342 1.514 -9.350 991 HG13 VAL 132 3HG1 VAL 132 4.880 2.237 -9.817 992 HG21 VAL 132 3HG2 VAL 132 2.918 1.600 -6.626 993 HG22 VAL 132 1HG2 VAL 132 4.215 0.551 -6.051 994 HG23 VAL 132 2HG2 VAL 132 3.334 0.140 -7.522 995 H VAL 133 H VAL 133 6.242 -0.017 -10.366 996 HA VAL 133 HA VAL 133 4.672 -2.383 -9.921 997 HB VAL 133 HB VAL 133 4.952 -1.031 -12.157 998 HG11 VAL 133 1HG1 VAL 133 6.780 -1.357 -13.409 999 HG12 VAL 133 2HG1 VAL 133 6.811 -3.087 -13.062 1000 HG13 VAL 133 3HG1 VAL 133 7.540 -1.949 -11.934 1001 HG21 VAL 133 3HG2 VAL 133 3.692 -3.215 -11.583 1002 HG22 VAL 133 1HG2 VAL 133 5.020 -4.003 -12.435 1003 HG23 VAL 133 2HG2 VAL 133 4.009 -2.825 -13.273 1004 H GLN 134 H GLN 134 8.075 -1.514 -10.048 1005 HA GLN 134 HA GLN 134 8.914 -4.290 -10.098 1006 HB2 GLN 134 2HB GLN 134 11.200 -3.182 -9.539 1007 HB3 GLN 134 1HB GLN 134 10.502 -2.954 -11.136 1008 HG2 GLN 134 2HG GLN 134 9.734 -0.764 -10.553 1009 HG3 GLN 134 1HG GLN 134 10.218 -1.003 -8.879 1010 HE21 GLN 134 1HE2 GLN 134 11.306 -0.409 -12.124 1011 HE22 GLN 134 2HE2 GLN 134 12.930 0.071 -11.709 1012 H GLY 135 H GLY 135 8.647 -1.684 -7.749 1013 HA2 GLY 135 2HA GLY 135 9.744 -3.155 -5.568 1014 HA3 GLY 135 1HA GLY 135 8.758 -1.693 -5.451 1015 H MET 136 H MET 136 6.680 -3.182 -7.169 1016 HA MET 136 HA MET 136 5.369 -4.453 -4.878 1017 HB2 MET 136 2HB MET 136 3.322 -4.134 -5.995 1018 HB3 MET 136 1HB MET 136 4.243 -2.677 -6.325 1019 HG2 MET 136 2HG MET 136 4.837 -3.539 -8.520 1020 HG3 MET 136 1HG MET 136 3.938 -5.014 -8.193 1021 HE1 MET 136 3HE MET 136 1.926 -3.899 -10.832 1022 HE2 MET 136 1HE MET 136 1.054 -4.813 -9.600 1023 HE3 MET 136 2HE MET 136 2.752 -5.163 -9.922 1024 H LYS 137 H LYS 137 6.225 -5.136 -8.247 1025 HA LYS 137 HA LYS 137 5.237 -7.764 -8.326 1026 HB2 LYS 137 2HB LYS 137 6.347 -8.000 -10.378 1027 HB3 LYS 137 1HB LYS 137 5.947 -6.294 -10.284 1028 HG2 LYS 137 2HG LYS 137 8.340 -6.025 -9.351 1029 HG3 LYS 137 1HG LYS 137 8.610 -7.627 -10.039 1030 HD2 LYS 137 2HD LYS 137 7.739 -5.133 -11.497 1031 HD3 LYS 137 1HD LYS 137 9.278 -5.981 -11.658 1032 HE2 LYS 137 2HE LYS 137 6.631 -7.260 -12.303 1033 HE3 LYS 137 1HE LYS 137 7.579 -6.373 -13.493 1034 HZ1 LYS 137 3HZ LYS 137 8.022 -9.000 -12.364 1035 HZ2 LYS 137 1HZ LYS 137 9.412 -8.043 -12.486 1036 HZ3 LYS 137 2HZ LYS 137 8.490 -8.372 -13.864 1037 H GLU 138 H GLU 138 7.850 -6.486 -6.626 1038 HA GLU 138 HA GLU 138 9.269 -9.040 -6.506 1039 HB2 GLU 138 2HB GLU 138 10.425 -6.743 -6.861 1040 HB3 GLU 138 1HB GLU 138 10.148 -6.517 -5.134 1041 HG2 GLU 138 2HG GLU 138 11.290 -8.873 -4.969 1042 HG3 GLU 138 1HG GLU 138 11.959 -8.412 -6.543 1043 H ALA 139 H ALA 139 8.147 -6.504 -4.289 1044 HA ALA 139 HA ALA 139 8.352 -7.941 -1.912 1045 HB1 ALA 139 1HB ALA 139 7.146 -6.244 -0.923 1046 HB2 ALA 139 2HB ALA 139 6.064 -6.060 -2.308 1047 HB3 ALA 139 3HB ALA 139 7.716 -5.437 -2.385 1048 H GLN 140 H GLN 140 5.890 -7.901 -4.382 1049 HA GLN 140 HA GLN 140 3.884 -9.259 -2.992 1050 HB2 GLN 140 2HB GLN 140 2.841 -9.559 -5.131 1051 HB3 GLN 140 1HB GLN 140 3.556 -7.953 -5.069 1052 HG2 GLN 140 2HG GLN 140 4.096 -8.701 -7.182 1053 HG3 GLN 140 1HG GLN 140 5.557 -9.034 -6.254 1054 HE21 GLN 140 1HE2 GLN 140 5.754 -10.433 -8.273 1055 HE22 GLN 140 2HE2 GLN 140 5.171 -12.054 -8.135 1056 H GLU 141 H GLU 141 6.858 -10.371 -4.198 1057 HA GLU 141 HA GLU 141 5.933 -13.128 -4.458 1058 HB2 GLU 141 2HB GLU 141 7.361 -12.825 -6.206 1059 HB3 GLU 141 1HB GLU 141 8.303 -11.592 -5.361 1060 HG2 GLU 141 2HG GLU 141 9.439 -13.306 -4.083 1061 HG3 GLU 141 1HG GLU 141 8.457 -14.556 -4.844 1062 H ARG 142 H ARG 142 7.414 -11.086 -2.149 1063 HA ARG 142 HA ARG 142 8.365 -13.426 -0.639 1064 HB2 ARG 142 2HB ARG 142 9.449 -11.316 0.694 1065 HB3 ARG 142 1HB ARG 142 10.265 -12.221 -0.585 1066 HG2 ARG 142 2HG ARG 142 9.814 -10.570 -2.190 1067 HG3 ARG 142 1HG ARG 142 8.591 -9.794 -1.169 1068 HD2 ARG 142 2HD ARG 142 10.304 -8.361 -0.775 1069 HD3 ARG 142 1HD ARG 142 10.692 -9.572 0.459 1070 HE ARG 142 HE ARG 142 12.044 -10.443 -1.717 1071 HH11 ARG 142 1HH1 ARG 142 11.901 -7.370 -0.070 1072 HH12 ARG 142 2HH1 ARG 142 13.526 -6.934 -0.479 1073 HH21 ARG 142 1HH2 ARG 142 14.181 -9.872 -2.257 1074 HH22 ARG 142 2HH2 ARG 142 14.821 -8.354 -1.722 1075 H LEU 143 H LEU 143 6.854 -10.237 -0.112 1076 HA LEU 143 HA LEU 143 6.141 -10.512 2.527 1077 HB2 LEU 143 2HB LEU 143 5.305 -8.869 0.288 1078 HB3 LEU 143 1HB LEU 143 3.964 -9.200 1.384 1079 HG LEU 143 HG LEU 143 5.126 -7.100 1.925 1080 HD11 LEU 143 1HD1 LEU 143 5.059 -9.375 3.849 1081 HD12 LEU 143 2HD1 LEU 143 4.063 -7.921 3.786 1082 HD13 LEU 143 3HD1 LEU 143 5.728 -7.825 4.360 1083 HD21 LEU 143 3HD2 LEU 143 7.354 -6.926 2.376 1084 HD22 LEU 143 1HD2 LEU 143 7.405 -8.259 1.221 1085 HD23 LEU 143 2HD2 LEU 143 7.480 -8.588 2.953 1086 H THR 144 H THR 144 4.759 -12.126 -0.216 1087 HA THR 144 HA THR 144 2.230 -12.771 0.701 1088 HB THR 144 HB THR 144 2.526 -14.851 -0.709 1089 HG1 THR 144 1HG THR 144 4.787 -15.033 -0.470 1090 HG21 THR 144 3HG2 THR 144 1.562 -13.126 -1.898 1091 HG22 THR 144 1HG2 THR 144 2.992 -13.512 -2.852 1092 HG23 THR 144 2HG2 THR 144 2.998 -12.110 -1.781 1093 H GLY 145 H GLY 145 1.693 -13.624 2.595 1094 HA2 GLY 145 2HA GLY 145 1.502 -15.333 4.166 1095 HA3 GLY 145 1HA GLY 145 2.866 -16.144 3.412 1096 H ASP 146 H ASP 146 4.902 -15.832 4.199 1097 HA ASP 146 HA ASP 146 5.560 -13.721 6.009 1098 HB2 ASP 146 2HB ASP 146 4.749 -16.375 7.066 1099 HB3 ASP 146 1HB ASP 146 6.176 -15.640 7.787 1100 H ALA 147 H ALA 147 6.546 -14.950 3.554 1101 HA ALA 147 HA ALA 147 8.978 -16.339 4.249 1102 HB1 ALA 147 1HB ALA 147 9.327 -15.778 1.654 1103 HB2 ALA 147 2HB ALA 147 7.574 -15.611 1.754 1104 HB3 ALA 147 3HB ALA 147 8.343 -17.126 2.224 1105 H PHE 148 H PHE 148 7.989 -13.075 3.608 1106 HA PHE 148 HA PHE 148 10.390 -11.908 2.832 1107 HB2 PHE 148 2HB PHE 148 9.464 -9.803 3.711 1108 HB3 PHE 148 1HB PHE 148 8.252 -10.712 2.798 1109 HD1 PHE 148 2HD PHE 148 6.427 -11.858 3.973 1110 HD2 PHE 148 1HD PHE 148 9.209 -9.389 6.039 1111 HE1 PHE 148 2HE PHE 148 4.898 -11.753 5.896 1112 HE2 PHE 148 1HE PHE 148 7.686 -9.280 7.967 1113 HZ PHE 148 HZ PHE 148 5.527 -10.462 7.898 1114 H ARG 149 H ARG 149 9.251 -12.849 6.019 1115 HA ARG 149 HA ARG 149 11.212 -11.500 7.527 1116 HB2 ARG 149 2HB ARG 149 9.891 -14.085 8.324 1117 HB3 ARG 149 1HB ARG 149 10.455 -12.787 9.362 1118 HG2 ARG 149 2HG ARG 149 8.678 -11.349 8.639 1119 HG3 ARG 149 1HG ARG 149 8.159 -12.530 7.436 1120 HD2 ARG 149 2HD ARG 149 8.110 -12.863 10.424 1121 HD3 ARG 149 1HD ARG 149 6.715 -12.636 9.372 1122 HE ARG 149 HE ARG 149 7.886 -14.861 8.378 1123 HH11 ARG 149 1HH1 ARG 149 6.871 -13.932 11.585 1124 HH12 ARG 149 2HH1 ARG 149 6.528 -15.556 12.083 1125 HH21 ARG 149 1HH2 ARG 149 7.434 -16.996 9.029 1126 HH22 ARG 149 2HH2 ARG 149 6.848 -17.295 10.631 1127 H LYS 150 H LYS 150 11.118 -14.644 5.968 1128 HA LYS 150 HA LYS 150 12.765 -16.123 5.437 1129 HB2 LYS 150 2HB LYS 150 14.059 -13.665 5.455 1130 HB3 LYS 150 1HB LYS 150 15.066 -14.679 6.479 1131 HG2 LYS 150 2HG LYS 150 14.678 -16.357 4.418 1132 HG3 LYS 150 1HG LYS 150 14.571 -14.808 3.578 1133 HD2 LYS 150 2HD LYS 150 16.823 -15.479 5.457 1134 HD3 LYS 150 1HD LYS 150 16.877 -15.869 3.736 1135 HE2 LYS 150 2HE LYS 150 17.299 -13.748 3.160 1136 HE3 LYS 150 1HE LYS 150 16.079 -13.114 4.265 1137 HZ1 LYS 150 3HZ LYS 150 18.647 -14.122 5.303 1138 HZ2 LYS 150 1HZ LYS 150 17.584 -13.001 5.994 1139 HZ3 LYS 150 2HZ LYS 150 18.540 -12.556 4.672 1140 H LYS 151 H LYS 151 14.056 -14.511 8.322 1141 HA LYS 151 HA LYS 151 15.026 -16.810 9.558 1142 HB2 LYS 151 2HB LYS 151 14.782 -14.046 10.193 1143 HB3 LYS 151 1HB LYS 151 14.195 -14.965 11.572 1144 HG2 LYS 151 2HG LYS 151 16.629 -16.122 10.586 1145 HG3 LYS 151 1HG LYS 151 16.850 -14.398 10.887 1146 HD2 LYS 151 2HD LYS 151 16.547 -14.613 13.130 1147 HD3 LYS 151 1HD LYS 151 15.400 -15.942 12.957 1148 HE2 LYS 151 2HE LYS 151 17.172 -17.499 12.533 1149 HE3 LYS 151 1HE LYS 151 18.361 -16.198 12.461 1150 HZ1 LYS 151 3HZ LYS 151 18.641 -17.009 14.579 1151 HZ2 LYS 151 1HZ LYS 151 16.996 -17.334 14.807 1152 HZ3 LYS 151 2HZ LYS 151 17.559 -15.740 14.860 1153 H HIS 152 H HIS 152 14.103 -17.148 12.027 1154 HA HIS 152 HA HIS 152 11.715 -18.649 11.636 1155 HB2 HIS 152 2HB HIS 152 13.199 -17.950 14.179 1156 HB3 HIS 152 1HB HIS 152 11.898 -19.132 14.061 1157 HD1 HIS 152 1HD HIS 152 15.514 -18.644 13.337 1158 HD2 HIS 152 2HD HIS 152 12.600 -21.554 12.789 1159 HE1 HIS 152 1HE HIS 152 16.761 -20.735 12.709 1160 HE2 HIS 152 2HE HIS 152 14.984 -22.503 12.468 1161 H LEU 153 H LEU 153 10.076 -18.399 13.675 1162 HA LEU 153 HA LEU 153 8.627 -16.019 13.109 1163 HB2 LEU 153 2HB LEU 153 8.226 -18.094 15.265 1164 HB3 LEU 153 1HB LEU 153 7.082 -16.825 14.874 1165 HG LEU 153 HG LEU 153 7.657 -18.215 12.463 1166 HD11 LEU 153 1HD1 LEU 153 8.267 -20.225 13.303 1167 HD12 LEU 153 2HD1 LEU 153 6.521 -20.417 13.459 1168 HD13 LEU 153 3HD1 LEU 153 7.485 -19.941 14.858 1169 HD21 LEU 153 3HD2 LEU 153 5.582 -16.996 13.141 1170 HD22 LEU 153 1HD2 LEU 153 5.184 -18.368 14.176 1171 HD23 LEU 153 2HD2 LEU 153 5.301 -18.585 12.430 1172 H GLU 154 H GLU 154 10.432 -17.155 15.947 1173 HA GLU 154 HA GLU 154 10.066 -14.578 17.256 1174 HB2 GLU 154 2HB GLU 154 10.972 -17.279 18.095 1175 HB3 GLU 154 1HB GLU 154 11.648 -15.909 18.964 1176 HG2 GLU 154 2HG GLU 154 9.591 -15.260 19.805 1177 HG3 GLU 154 1HG GLU 154 8.696 -16.142 18.568 1178 H ASP 155 H ASP 155 11.329 -13.084 16.264 1179 HA ASP 155 HA ASP 155 14.227 -13.608 16.259 1180 HB2 ASP 155 2HB ASP 155 14.366 -12.103 14.258 1181 HB3 ASP 155 1HB ASP 155 13.527 -13.622 13.959 1182 H GLU 156 H GLU 156 14.569 -12.575 18.216 1183 HA GLU 156 HA GLU 156 14.718 -9.706 18.081 1184 HB2 GLU 156 2HB GLU 156 12.555 -11.044 19.556 1185 HB3 GLU 156 1HB GLU 156 13.470 -9.880 20.522 1186 HG2 GLU 156 2HG GLU 156 12.207 -9.269 17.857 1187 HG3 GLU 156 1HG GLU 156 11.465 -8.932 19.421 1188 H LEU 157 H LEU 157 15.555 -8.845 20.287 1189 HA LEU 157 HA LEU 157 17.240 -8.811 21.812 1190 HB2 LEU 157 2HB LEU 157 15.921 -11.379 22.150 1191 HB3 LEU 157 1HB LEU 157 17.610 -11.449 22.614 1192 HG LEU 157 HG LEU 157 16.070 -9.158 23.678 1193 HD11 LEU 157 1HD1 LEU 157 15.099 -10.508 25.477 1194 HD12 LEU 157 2HD1 LEU 157 15.630 -11.975 24.656 1195 HD13 LEU 157 3HD1 LEU 157 14.426 -10.930 23.903 1196 HD21 LEU 157 3HD2 LEU 157 17.421 -9.583 25.633 1197 HD22 LEU 157 1HD2 LEU 157 18.447 -9.580 24.199 1198 HD23 LEU 157 2HD2 LEU 157 17.986 -11.108 24.950 Start of MODEL 27 1 H1 MET 1 1HT MET 1 5.110 12.862 21.717 2 H2 MET 1 2HT MET 1 4.672 12.417 23.315 3 H3 MET 1 3HT MET 1 5.911 13.575 23.053 4 HA MET 1 HA MET 1 3.021 13.831 22.663 5 HB2 MET 1 2HB MET 1 5.137 14.898 24.430 6 HB3 MET 1 1HB MET 1 3.952 16.075 23.879 7 HG2 MET 1 2HG MET 1 2.154 14.723 24.779 8 HG3 MET 1 1HG MET 1 3.308 13.485 25.271 9 HE1 MET 1 2HE MET 1 1.694 15.713 28.333 10 HE2 MET 1 3HE MET 1 1.824 14.021 27.856 11 HE3 MET 1 1HE MET 1 1.023 15.178 26.792 12 H HIS 2 H HIS 2 2.255 15.101 21.095 13 HA HIS 2 HA HIS 2 3.933 17.141 19.884 14 HB2 HIS 2 2HB HIS 2 3.412 16.299 17.578 15 HB3 HIS 2 1HB HIS 2 4.507 15.268 18.494 16 HD1 HIS 2 1HD HIS 2 1.224 15.293 16.810 17 HD2 HIS 2 2HD HIS 2 3.333 12.817 19.397 18 HE1 HIS 2 1HE HIS 2 0.030 13.081 16.748 19 HE2 HIS 2 2HE HIS 2 1.367 11.576 18.262 20 H HIS 3 H HIS 3 0.824 15.430 19.746 21 HA HIS 3 HA HIS 3 -0.580 17.957 19.881 22 HB2 HIS 3 2HB HIS 3 -0.256 16.512 17.380 23 HB3 HIS 3 1HB HIS 3 -1.954 16.686 17.810 24 HD1 HIS 3 1HD HIS 3 0.759 18.448 16.215 25 HD2 HIS 3 2HD HIS 3 -2.649 19.521 18.335 26 HE1 HIS 3 1HE HIS 3 0.354 20.866 15.656 27 HE2 HIS 3 2HE HIS 3 -1.664 21.517 17.017 28 H HIS 4 H HIS 4 -3.039 17.512 19.840 29 HA HIS 4 HA HIS 4 -3.528 15.406 21.761 30 HB2 HIS 4 2HB HIS 4 -4.870 17.868 20.903 31 HB3 HIS 4 1HB HIS 4 -5.981 16.540 21.228 32 HD1 HIS 4 1HD HIS 4 -4.728 15.249 23.657 33 HD2 HIS 4 2HD HIS 4 -4.984 19.366 23.156 34 HE1 HIS 4 1HE HIS 4 -4.599 16.219 25.975 35 HE2 HIS 4 2HE HIS 4 -4.677 18.714 25.639 36 H HIS 5 H HIS 5 -5.915 14.413 21.398 37 HA HIS 5 HA HIS 5 -5.609 12.585 19.249 38 HB2 HIS 5 2HB HIS 5 -7.512 13.009 21.459 39 HB3 HIS 5 1HB HIS 5 -8.203 12.247 20.030 40 HD1 HIS 5 1HD HIS 5 -7.087 9.949 19.288 41 HD2 HIS 5 2HD HIS 5 -5.955 11.377 23.023 42 HE1 HIS 5 1HE HIS 5 -6.026 7.994 20.462 43 HE2 HIS 5 2HE HIS 5 -5.437 8.856 22.755 44 H HIS 6 H HIS 6 -7.417 15.544 19.683 45 HA HIS 6 HA HIS 6 -8.620 16.836 18.248 46 HB2 HIS 6 2HB HIS 6 -6.472 16.076 16.825 47 HB3 HIS 6 1HB HIS 6 -7.731 15.334 15.844 48 HD1 HIS 6 1HD HIS 6 -7.245 18.763 17.445 49 HD2 HIS 6 2HD HIS 6 -8.497 17.018 13.888 50 HE1 HIS 6 1HE HIS 6 -7.829 20.679 15.924 51 HE2 HIS 6 2HE HIS 6 -8.661 19.598 13.807 52 H HIS 7 H HIS 7 -10.257 16.683 16.344 53 HA HIS 7 HA HIS 7 -12.218 14.758 17.110 54 HB2 HIS 7 2HB HIS 7 -12.364 17.219 15.998 55 HB3 HIS 7 1HB HIS 7 -12.593 16.222 14.566 56 HD1 HIS 7 1HD HIS 7 -14.523 17.888 16.969 57 HD2 HIS 7 2HD HIS 7 -14.705 14.089 15.296 58 HE1 HIS 7 1HE HIS 7 -16.881 17.101 17.346 59 HE2 HIS 7 2HE HIS 7 -16.955 14.779 16.371 60 H MET 8 H MET 8 -13.096 13.066 15.894 61 HA MET 8 HA MET 8 -11.926 12.327 13.364 62 HB2 MET 8 2HB MET 8 -11.279 10.026 14.260 63 HB3 MET 8 1HB MET 8 -10.206 11.372 14.666 64 HG2 MET 8 2HG MET 8 -11.129 11.502 16.878 65 HG3 MET 8 1HG MET 8 -12.345 10.288 16.488 66 HE1 MET 8 3HE MET 8 -11.633 8.037 15.422 67 HE2 MET 8 1HE MET 8 -11.837 7.610 17.122 68 HE3 MET 8 2HE MET 8 -10.436 7.023 16.226 69 H SER 9 H SER 9 -13.682 11.828 12.239 70 HA SER 9 HA SER 9 -15.320 9.633 12.837 71 HB2 SER 9 2HB SER 9 -16.105 11.477 14.518 72 HB3 SER 9 1HB SER 9 -16.903 12.171 13.108 73 HG SER 9 HG SER 9 -18.214 10.681 14.332 74 H ASP 10 H ASP 10 -15.121 12.769 11.224 75 HA ASP 10 HA ASP 10 -16.909 12.273 9.133 76 HB2 ASP 10 2HB ASP 10 -15.548 14.014 7.894 77 HB3 ASP 10 1HB ASP 10 -16.158 14.508 9.471 78 H GLY 11 H GLY 11 -16.182 12.140 6.770 79 HA2 GLY 11 2HA GLY 11 -13.902 11.097 5.768 80 HA3 GLY 11 1HA GLY 11 -14.669 9.690 6.488 81 H HIS 12 H HIS 12 -14.127 10.859 3.631 82 HA HIS 12 HA HIS 12 -16.797 10.166 2.594 83 HB2 HIS 12 2HB HIS 12 -15.347 12.602 2.251 84 HB3 HIS 12 1HB HIS 12 -15.425 11.781 0.686 85 HD1 HIS 12 1HD HIS 12 -18.015 12.223 3.456 86 HD2 HIS 12 2HD HIS 12 -17.535 12.825 -0.627 87 HE1 HIS 12 1HE HIS 12 -20.230 13.088 2.640 88 HE2 HIS 12 2HE HIS 12 -19.943 13.361 0.152 89 H ASN 13 H ASN 13 -16.213 10.081 -0.087 90 HA ASN 13 HA ASN 13 -14.577 7.670 -0.218 91 HB2 ASN 13 2HB ASN 13 -15.587 7.338 -2.423 92 HB3 ASN 13 1HB ASN 13 -16.829 7.617 -1.207 93 HD21 ASN 13 1HD2 ASN 13 -15.593 8.556 -4.183 94 HD22 ASN 13 2HD2 ASN 13 -16.536 9.985 -4.411 95 H GLY 14 H GLY 14 -13.650 7.582 -2.728 96 HA2 GLY 14 2HA GLY 14 -12.491 9.128 -4.318 97 HA3 GLY 14 1HA GLY 14 -11.840 9.917 -2.877 98 H LEU 15 H LEU 15 -11.488 7.352 -5.127 99 HA LEU 15 HA LEU 15 -8.942 6.632 -3.883 100 HB2 LEU 15 2HB LEU 15 -10.805 4.496 -4.891 101 HB3 LEU 15 1HB LEU 15 -9.325 4.295 -3.975 102 HG LEU 15 HG LEU 15 -10.860 5.785 -2.256 103 HD11 LEU 15 1HD1 LEU 15 -12.830 5.602 -3.648 104 HD12 LEU 15 2HD1 LEU 15 -13.045 4.661 -2.173 105 HD13 LEU 15 3HD1 LEU 15 -12.666 3.846 -3.691 106 HD21 LEU 15 3HD2 LEU 15 -10.041 2.975 -2.531 107 HD22 LEU 15 1HD2 LEU 15 -11.390 3.263 -1.431 108 HD23 LEU 15 2HD2 LEU 15 -9.852 4.089 -1.176 109 H GLY 16 H GLY 16 -8.182 4.610 -5.558 110 HA2 GLY 16 2HA GLY 16 -7.068 5.824 -7.738 111 HA3 GLY 16 1HA GLY 16 -7.406 4.109 -7.654 112 H LYS 17 H LYS 17 -8.485 7.195 -8.828 113 HA LYS 17 HA LYS 17 -10.431 5.811 -10.553 114 HB2 LYS 17 2HB LYS 17 -10.700 8.219 -8.897 115 HB3 LYS 17 1HB LYS 17 -11.267 8.426 -10.547 116 HG2 LYS 17 2HG LYS 17 -13.157 7.405 -10.030 117 HG3 LYS 17 1HG LYS 17 -12.259 5.946 -9.608 118 HD2 LYS 17 2HD LYS 17 -12.062 7.932 -7.516 119 HD3 LYS 17 1HD LYS 17 -13.748 7.572 -7.893 120 HE2 LYS 17 2HE LYS 17 -12.571 5.083 -7.854 121 HE3 LYS 17 1HE LYS 17 -11.735 5.938 -6.560 122 HZ1 LYS 17 3HZ LYS 17 -13.611 4.949 -5.586 123 HZ2 LYS 17 1HZ LYS 17 -14.642 5.444 -6.834 124 HZ3 LYS 17 2HZ LYS 17 -14.016 6.583 -5.750 125 H GLY 18 H GLY 18 -7.950 8.276 -10.284 126 HA2 GLY 18 2HA GLY 18 -8.071 8.782 -13.173 127 HA3 GLY 18 1HA GLY 18 -7.164 9.730 -11.989 128 H PHE 19 H PHE 19 -5.969 7.442 -10.695 129 HA PHE 19 HA PHE 19 -3.627 7.193 -12.224 130 HB2 PHE 19 2HB PHE 19 -4.439 5.232 -10.087 131 HB3 PHE 19 1HB PHE 19 -2.813 5.776 -10.522 132 HD1 PHE 19 2HD PHE 19 -3.764 8.772 -10.691 133 HD2 PHE 19 1HD PHE 19 -4.077 5.715 -7.745 134 HE1 PHE 19 2HE PHE 19 -3.872 10.487 -8.927 135 HE2 PHE 19 1HE PHE 19 -4.188 7.424 -5.977 136 HZ PHE 19 HZ PHE 19 -4.085 9.813 -6.567 137 H GLY 20 H GLY 20 -5.806 4.518 -11.316 138 HA2 GLY 20 2HA GLY 20 -5.295 3.371 -13.992 139 HA3 GLY 20 1HA GLY 20 -5.283 2.379 -12.535 140 H ASP 21 H ASP 21 -7.246 1.969 -11.441 141 HA ASP 21 HA ASP 21 -9.754 2.967 -12.153 142 HB2 ASP 21 2HB ASP 21 -8.747 0.792 -13.864 143 HB3 ASP 21 1HB ASP 21 -10.361 0.507 -13.193 144 H HIS 22 H HIS 22 -9.287 -0.511 -11.873 145 HA HIS 22 HA HIS 22 -10.093 -0.359 -9.040 146 HB2 HIS 22 2HB HIS 22 -11.278 -2.566 -9.469 147 HB3 HIS 22 1HB HIS 22 -12.022 -1.146 -10.196 148 HD1 HIS 22 1HD HIS 22 -12.057 -1.008 -12.758 149 HD2 HIS 22 2HD HIS 22 -10.148 -4.396 -11.292 150 HE1 HIS 22 1HE HIS 22 -11.748 -2.520 -14.746 151 HE2 HIS 22 2HE HIS 22 -10.499 -4.516 -13.851 152 H ILE 23 H ILE 23 -7.897 -0.519 -8.443 153 HA ILE 23 HA ILE 23 -6.816 -3.236 -8.676 154 HB ILE 23 HB ILE 23 -5.365 -0.669 -9.305 155 HG12 ILE 23 2HG1 ILE 23 -5.022 -2.906 -11.126 156 HG13 ILE 23 1HG1 ILE 23 -6.719 -2.480 -10.926 157 HG21 ILE 23 1HG2 ILE 23 -3.618 -2.805 -9.732 158 HG22 ILE 23 2HG2 ILE 23 -4.295 -3.044 -8.121 159 HG23 ILE 23 3HG2 ILE 23 -3.495 -1.525 -8.526 160 HD11 ILE 23 3HD1 ILE 23 -4.818 -1.244 -12.560 161 HD12 ILE 23 1HD1 ILE 23 -5.153 -0.107 -11.254 162 HD13 ILE 23 2HD1 ILE 23 -6.474 -0.727 -12.246 163 H HIS 24 H HIS 24 -4.977 -0.543 -7.407 164 HA HIS 24 HA HIS 24 -4.911 -1.803 -4.802 165 HB2 HIS 24 2HB HIS 24 -3.478 0.709 -5.652 166 HB3 HIS 24 1HB HIS 24 -3.080 -0.359 -4.300 167 HD1 HIS 24 1HD HIS 24 -1.332 0.463 -6.959 168 HD2 HIS 24 2HD HIS 24 -3.105 -3.183 -6.051 169 HE1 HIS 24 1HE HIS 24 -0.059 -1.250 -8.285 170 HE2 HIS 24 2HE HIS 24 -1.248 -3.425 -7.834 171 H TRP 25 H TRP 25 -7.393 -0.641 -5.608 172 HA TRP 25 HA TRP 25 -7.854 1.121 -3.351 173 HB2 TRP 25 2HB TRP 25 -9.326 2.397 -5.316 174 HB3 TRP 25 1HB TRP 25 -7.818 2.982 -4.612 175 HD1 TRP 25 HD TRP 25 -9.266 1.551 -7.779 176 HE1 TRP 25 1HE TRP 25 -7.475 1.603 -9.604 177 HE3 TRP 25 3HE TRP 25 -5.224 2.798 -4.929 178 HZ2 TRP 25 2HZ TRP 25 -4.709 2.124 -9.835 179 HZ3 TRP 25 3HZ TRP 25 -3.048 3.054 -6.015 180 HH2 TRP 25 HH TRP 25 -2.784 2.722 -8.425 181 H ARG 26 H ARG 26 -8.893 -1.221 -5.616 182 HA ARG 26 HA ARG 26 -11.512 -1.165 -5.919 183 HB2 ARG 26 2HB ARG 26 -10.472 -3.178 -6.540 184 HB3 ARG 26 1HB ARG 26 -9.800 -3.389 -4.955 185 HG2 ARG 26 2HG ARG 26 -11.454 -5.053 -5.267 186 HG3 ARG 26 1HG ARG 26 -12.065 -3.895 -4.091 187 HD2 ARG 26 2HD ARG 26 -13.889 -3.834 -5.360 188 HD3 ARG 26 1HD ARG 26 -12.909 -2.854 -6.459 189 HE ARG 26 HE ARG 26 -12.918 -4.587 -7.943 190 HH11 ARG 26 1HH1 ARG 26 -13.797 -5.821 -4.798 191 HH12 ARG 26 2HH1 ARG 26 -14.151 -7.412 -5.383 192 HH21 ARG 26 1HH2 ARG 26 -13.383 -6.678 -8.713 193 HH22 ARG 26 2HH2 ARG 26 -13.916 -7.898 -7.606 194 H THR 27 H THR 27 -10.020 -1.906 -2.750 195 HA THR 27 HA THR 27 -11.694 -0.571 -1.108 196 HB THR 27 HB THR 27 -13.659 -1.697 -1.882 197 HG1 THR 27 1HG THR 27 -14.375 -2.114 0.044 198 HG21 THR 27 3HG2 THR 27 -11.956 -4.023 -2.015 199 HG22 THR 27 1HG2 THR 27 -13.505 -3.704 -2.800 200 HG23 THR 27 2HG2 THR 27 -13.465 -4.351 -1.160 201 H LEU 28 H LEU 28 -10.876 -0.670 0.889 202 HA LEU 28 HA LEU 28 -8.719 -2.457 1.438 203 HB2 LEU 28 2HB LEU 28 -8.773 -0.141 2.264 204 HB3 LEU 28 1HB LEU 28 -10.166 -0.537 3.270 205 HG LEU 28 HG LEU 28 -7.676 -2.131 3.648 206 HD11 LEU 28 1HD1 LEU 28 -7.863 0.347 5.232 207 HD12 LEU 28 2HD1 LEU 28 -7.356 0.535 3.553 208 HD13 LEU 28 3HD1 LEU 28 -6.448 -0.520 4.636 209 HD21 LEU 28 3HD2 LEU 28 -10.135 -1.469 5.100 210 HD22 LEU 28 1HD2 LEU 28 -8.674 -1.456 6.087 211 HD23 LEU 28 2HD2 LEU 28 -9.115 -2.905 5.186 212 H GLU 29 H GLU 29 -12.114 -2.537 1.995 213 HA GLU 29 HA GLU 29 -12.208 -4.184 4.274 214 HB2 GLU 29 2HB GLU 29 -14.123 -2.890 3.268 215 HB3 GLU 29 1HB GLU 29 -14.223 -4.131 2.028 216 HG2 GLU 29 2HG GLU 29 -14.424 -5.763 4.028 217 HG3 GLU 29 1HG GLU 29 -14.852 -4.315 4.939 218 H ASP 30 H ASP 30 -12.934 -5.177 0.918 219 HA ASP 30 HA ASP 30 -12.743 -7.926 1.435 220 HB2 ASP 30 2HB ASP 30 -13.134 -6.227 -0.867 221 HB3 ASP 30 1HB ASP 30 -12.049 -7.564 -1.270 222 H GLY 31 H GLY 31 -10.302 -5.543 0.774 223 HA2 GLY 31 2HA GLY 31 -8.230 -7.160 -0.170 224 HA3 GLY 31 1HA GLY 31 -8.011 -5.665 0.745 225 H LYS 32 H LYS 32 -9.012 -6.306 3.203 226 HA LYS 32 HA LYS 32 -6.892 -7.874 4.283 227 HB2 LYS 32 2HB LYS 32 -8.182 -5.884 5.343 228 HB3 LYS 32 1HB LYS 32 -9.348 -7.107 5.832 229 HG2 LYS 32 2HG LYS 32 -7.486 -8.328 6.955 230 HG3 LYS 32 1HG LYS 32 -6.441 -6.954 6.592 231 HD2 LYS 32 2HD LYS 32 -7.111 -6.228 8.618 232 HD3 LYS 32 1HD LYS 32 -8.545 -5.694 7.738 233 HE2 LYS 32 2HE LYS 32 -9.860 -7.223 8.723 234 HE3 LYS 32 1HE LYS 32 -8.642 -8.492 8.592 235 HZ1 LYS 32 3HZ LYS 32 -8.092 -6.393 10.525 236 HZ2 LYS 32 1HZ LYS 32 -7.850 -8.064 10.640 237 HZ3 LYS 32 2HZ LYS 32 -9.389 -7.412 10.898 238 H LYS 33 H LYS 33 -10.394 -8.380 3.975 239 HA LYS 33 HA LYS 33 -10.461 -10.896 5.240 240 HB2 LYS 33 2HB LYS 33 -12.459 -9.511 4.875 241 HB3 LYS 33 1HB LYS 33 -12.324 -9.775 3.141 242 HG2 LYS 33 2HG LYS 33 -12.356 -12.332 4.079 243 HG3 LYS 33 1HG LYS 33 -13.415 -11.505 5.233 244 HD2 LYS 33 2HD LYS 33 -15.040 -11.237 3.712 245 HD3 LYS 33 1HD LYS 33 -13.905 -10.759 2.449 246 HE2 LYS 33 2HE LYS 33 -13.278 -13.220 2.304 247 HE3 LYS 33 1HE LYS 33 -14.706 -13.532 3.287 248 HZ1 LYS 33 3HZ LYS 33 -15.807 -12.042 1.431 249 HZ2 LYS 33 1HZ LYS 33 -15.613 -13.712 1.231 250 HZ3 LYS 33 2HZ LYS 33 -14.519 -12.641 0.511 251 H GLU 34 H GLU 34 -9.614 -9.933 2.006 252 HA GLU 34 HA GLU 34 -9.745 -12.663 1.012 253 HB2 GLU 34 2HB GLU 34 -10.426 -10.639 -0.352 254 HB3 GLU 34 1HB GLU 34 -8.711 -10.237 -0.451 255 HG2 GLU 34 2HG GLU 34 -8.358 -11.721 -2.064 256 HG3 GLU 34 1HG GLU 34 -9.225 -12.993 -1.186 257 H ALA 35 H ALA 35 -7.343 -10.253 1.906 258 HA ALA 35 HA ALA 35 -5.056 -11.470 0.886 259 HB1 ALA 35 1HB ALA 35 -5.520 -9.657 3.227 260 HB2 ALA 35 2HB ALA 35 -4.761 -9.301 1.676 261 HB3 ALA 35 3HB ALA 35 -3.912 -10.285 2.867 262 H ALA 36 H ALA 36 -6.935 -12.202 3.736 263 HA ALA 36 HA ALA 36 -5.035 -13.808 5.074 264 HB1 ALA 36 1HB ALA 36 -7.091 -14.768 6.206 265 HB2 ALA 36 2HB ALA 36 -8.034 -13.673 5.196 266 HB3 ALA 36 3HB ALA 36 -6.858 -13.025 6.341 267 H ALA 37 H ALA 37 -7.657 -14.629 2.816 268 HA ALA 37 HA ALA 37 -7.429 -17.395 2.892 269 HB1 ALA 37 1HB ALA 37 -8.205 -17.089 0.371 270 HB2 ALA 37 2HB ALA 37 -8.471 -15.437 0.926 271 HB3 ALA 37 3HB ALA 37 -9.283 -16.779 1.731 272 H SER 38 H SER 38 -6.367 -15.631 0.009 273 HA SER 38 HA SER 38 -4.532 -17.610 -0.773 274 HB2 SER 38 2HB SER 38 -5.638 -15.459 -2.004 275 HB3 SER 38 1HB SER 38 -3.999 -14.853 -1.711 276 HG SER 38 HG SER 38 -4.730 -17.228 -3.085 277 H GLY 39 H GLY 39 -4.213 -14.852 1.331 278 HA2 GLY 39 2HA GLY 39 -2.511 -14.516 2.901 279 HA3 GLY 39 1HA GLY 39 -1.554 -15.760 2.089 280 H LEU 40 H LEU 40 -3.023 -13.081 0.377 281 HA LEU 40 HA LEU 40 -0.344 -12.179 -0.366 282 HB2 LEU 40 2HB LEU 40 -1.486 -10.886 -2.128 283 HB3 LEU 40 1HB LEU 40 -1.809 -12.606 -2.221 284 HG LEU 40 HG LEU 40 -3.998 -12.104 -1.011 285 HD11 LEU 40 1HD1 LEU 40 -4.432 -9.513 -1.919 286 HD12 LEU 40 2HD1 LEU 40 -2.863 -9.458 -1.118 287 HD13 LEU 40 3HD1 LEU 40 -4.278 -10.041 -0.245 288 HD21 LEU 40 3HD2 LEU 40 -5.041 -12.066 -3.013 289 HD22 LEU 40 1HD2 LEU 40 -3.404 -12.327 -3.616 290 HD23 LEU 40 2HD2 LEU 40 -4.091 -10.703 -3.602 291 HA PRO 41 HA PRO 41 -0.496 -8.657 2.285 292 HB2 PRO 41 2HB PRO 41 1.161 -6.984 0.911 293 HB3 PRO 41 1HB PRO 41 1.735 -8.347 1.877 294 HG2 PRO 41 2HG PRO 41 1.294 -8.175 -1.081 295 HG3 PRO 41 1HG PRO 41 2.656 -8.887 -0.194 296 HD2 PRO 41 2HD PRO 41 0.690 -10.407 -1.218 297 HD3 PRO 41 1HD PRO 41 1.478 -10.814 0.318 298 H LEU 42 H LEU 42 -1.055 -6.386 2.325 299 HA LEU 42 HA LEU 42 -3.087 -5.762 0.321 300 HB2 LEU 42 2HB LEU 42 -2.724 -5.218 3.164 301 HB3 LEU 42 1HB LEU 42 -3.208 -3.793 2.262 302 HG LEU 42 HG LEU 42 -5.151 -5.077 1.375 303 HD11 LEU 42 1HD1 LEU 42 -5.689 -7.135 2.869 304 HD12 LEU 42 2HD1 LEU 42 -3.944 -7.186 3.111 305 HD13 LEU 42 3HD1 LEU 42 -4.614 -7.318 1.484 306 HD21 LEU 42 3HD2 LEU 42 -5.953 -3.808 3.055 307 HD22 LEU 42 1HD2 LEU 42 -4.716 -4.339 4.193 308 HD23 LEU 42 2HD2 LEU 42 -6.119 -5.360 3.877 309 H MET 43 H MET 43 -2.626 -4.427 -1.267 310 HA MET 43 HA MET 43 -0.195 -2.903 -1.282 311 HB2 MET 43 2HB MET 43 -1.157 -4.104 -3.270 312 HB3 MET 43 1HB MET 43 -2.432 -2.876 -3.323 313 HG2 MET 43 2HG MET 43 -0.642 -2.414 -4.920 314 HG3 MET 43 1HG MET 43 -0.765 -1.149 -3.701 315 HE1 MET 43 3HE MET 43 1.314 -1.506 -1.279 316 HE2 MET 43 1HE MET 43 0.798 -0.300 -2.458 317 HE3 MET 43 2HE MET 43 2.502 -0.735 -2.330 318 H VAL 44 H VAL 44 -0.156 -1.114 -0.027 319 HA VAL 44 HA VAL 44 -2.508 0.612 0.045 320 HB VAL 44 HB VAL 44 0.055 0.978 1.590 321 HG11 VAL 44 1HG1 VAL 44 -2.627 2.276 1.597 322 HG12 VAL 44 2HG1 VAL 44 -1.023 2.996 1.738 323 HG13 VAL 44 3HG1 VAL 44 -1.733 2.148 3.112 324 HG21 VAL 44 3HG2 VAL 44 -0.535 -0.620 3.006 325 HG22 VAL 44 1HG2 VAL 44 -1.800 -1.098 1.872 326 HG23 VAL 44 2HG2 VAL 44 -2.160 0.047 3.166 327 H ILE 45 H ILE 45 -2.471 2.763 -0.468 328 HA ILE 45 HA ILE 45 -0.136 4.006 -1.604 329 HB ILE 45 HB ILE 45 -2.544 3.419 -3.341 330 HG12 ILE 45 2HG1 ILE 45 0.371 2.629 -3.575 331 HG13 ILE 45 1HG1 ILE 45 -0.988 1.551 -3.232 332 HG21 ILE 45 1HG2 ILE 45 -2.094 5.254 -4.505 333 HG22 ILE 45 2HG2 ILE 45 -0.460 4.667 -4.805 334 HG23 ILE 45 3HG2 ILE 45 -0.793 5.658 -3.386 335 HD11 ILE 45 3HD1 ILE 45 -0.905 3.141 -5.763 336 HD12 ILE 45 1HD1 ILE 45 -1.766 1.644 -5.408 337 HD13 ILE 45 2HD1 ILE 45 -0.015 1.626 -5.611 338 H ILE 46 H ILE 46 -0.317 5.749 -0.259 339 HA ILE 46 HA ILE 46 -2.937 7.060 -0.156 340 HB ILE 46 HB ILE 46 -0.662 7.618 1.722 341 HG12 ILE 46 2HG1 ILE 46 -2.782 5.892 2.744 342 HG13 ILE 46 1HG1 ILE 46 -1.847 5.127 1.456 343 HG21 ILE 46 1HG2 ILE 46 -2.618 9.177 1.563 344 HG22 ILE 46 2HG2 ILE 46 -2.348 8.479 3.161 345 HG23 ILE 46 3HG2 ILE 46 -3.631 7.852 2.128 346 HD11 ILE 46 3HD1 ILE 46 -0.852 6.246 4.059 347 HD12 ILE 46 1HD1 ILE 46 0.209 5.728 2.749 348 HD13 ILE 46 2HD1 ILE 46 -0.855 4.560 3.536 349 H HIS 47 H HIS 47 -3.212 9.081 -0.839 350 HA HIS 47 HA HIS 47 -0.816 10.574 -1.684 351 HB2 HIS 47 2HB HIS 47 -2.126 11.303 -3.714 352 HB3 HIS 47 1HB HIS 47 -1.633 9.604 -3.701 353 HD1 HIS 47 1HD HIS 47 -4.369 11.482 -4.708 354 HD2 HIS 47 2HD HIS 47 -4.014 8.084 -2.342 355 HE1 HIS 47 1HE HIS 47 -6.632 10.385 -4.762 356 HE2 HIS 47 2HE HIS 47 -6.371 8.293 -3.383 357 H LYS 48 H LYS 48 -0.867 12.131 -0.133 358 HA LYS 48 HA LYS 48 -3.367 13.438 0.546 359 HB2 LYS 48 2HB LYS 48 -1.010 13.101 1.888 360 HB3 LYS 48 1HB LYS 48 -0.890 14.777 1.381 361 HG2 LYS 48 2HG LYS 48 -1.868 14.493 3.627 362 HG3 LYS 48 1HG LYS 48 -2.945 15.316 2.499 363 HD2 LYS 48 2HD LYS 48 -4.506 13.737 2.717 364 HD3 LYS 48 1HD LYS 48 -3.335 12.451 2.424 365 HE2 LYS 48 2HE LYS 48 -4.246 12.096 4.592 366 HE3 LYS 48 1HE LYS 48 -2.604 12.698 4.807 367 HZ1 LYS 48 3HZ LYS 48 -3.781 14.980 4.954 368 HZ2 LYS 48 1HZ LYS 48 -3.789 13.957 6.302 369 HZ3 LYS 48 2HZ LYS 48 -5.158 14.067 5.314 370 H SER 49 H SER 49 -2.772 16.080 0.788 371 HA SER 49 HA SER 49 -3.347 17.146 -1.686 372 HB2 SER 49 2HB SER 49 -3.727 18.449 0.294 373 HB3 SER 49 1HB SER 49 -2.011 18.437 0.700 374 HG SER 49 HG SER 49 -3.394 19.976 -1.145 375 H TRP 50 H TRP 50 -0.259 17.956 -0.128 376 HA TRP 50 HA TRP 50 1.030 18.516 -2.581 377 HB2 TRP 50 2HB TRP 50 2.463 17.809 -0.020 378 HB3 TRP 50 1HB TRP 50 2.994 18.900 -1.307 379 HD1 TRP 50 HD TRP 50 0.773 18.767 1.792 380 HE1 TRP 50 1HE TRP 50 0.069 21.164 2.413 381 HE3 TRP 50 3HE TRP 50 2.542 21.228 -2.327 382 HZ2 TRP 50 2HZ TRP 50 0.242 23.754 1.304 383 HZ3 TRP 50 3HZ TRP 50 2.232 23.664 -2.468 384 HH2 TRP 50 HH TRP 50 1.105 24.899 -0.690 385 H CYS 51 H CYS 51 0.499 16.564 -3.769 386 HA CYS 51 HA CYS 51 2.554 14.521 -3.404 387 HB2 CYS 51 2HB CYS 51 0.837 13.390 -2.309 388 HB3 CYS 51 1HB CYS 51 -0.411 14.078 -3.339 389 H GLY 52 H GLY 52 3.518 14.047 -5.289 390 HA2 GLY 52 2HA GLY 52 2.148 14.859 -7.775 391 HA3 GLY 52 1HA GLY 52 3.895 14.753 -7.583 392 H ALA 53 H ALA 53 3.761 12.218 -6.148 393 HA ALA 53 HA ALA 53 4.035 10.456 -8.303 394 HB1 ALA 53 1HB ALA 53 5.035 10.199 -6.010 395 HB2 ALA 53 2HB ALA 53 4.343 8.733 -6.701 396 HB3 ALA 53 3HB ALA 53 3.454 9.633 -5.471 397 H CYS 54 H CYS 54 1.231 11.599 -6.800 398 HA CYS 54 HA CYS 54 -0.314 9.279 -7.551 399 HB2 CYS 54 2HB CYS 54 -2.258 10.839 -6.739 400 HB3 CYS 54 1HB CYS 54 -1.163 10.116 -5.555 401 H LYS 55 H LYS 55 0.088 12.652 -8.526 402 HA LYS 55 HA LYS 55 -1.919 12.577 -10.532 403 HB2 LYS 55 2HB LYS 55 -0.660 14.595 -11.457 404 HB3 LYS 55 1HB LYS 55 -1.306 14.741 -9.829 405 HG2 LYS 55 2HG LYS 55 0.851 14.388 -8.870 406 HG3 LYS 55 1HG LYS 55 1.541 14.012 -10.456 407 HD2 LYS 55 2HD LYS 55 0.269 16.547 -10.628 408 HD3 LYS 55 1HD LYS 55 1.276 16.545 -9.179 409 HE2 LYS 55 2HE LYS 55 2.298 15.599 -11.842 410 HE3 LYS 55 1HE LYS 55 2.364 17.295 -11.361 411 HZ1 LYS 55 3HZ LYS 55 3.740 14.988 -10.124 412 HZ2 LYS 55 1HZ LYS 55 3.551 16.455 -9.303 413 HZ3 LYS 55 2HZ LYS 55 4.420 16.402 -10.753 414 H ALA 56 H ALA 56 1.626 12.115 -10.605 415 HA ALA 56 HA ALA 56 1.901 11.719 -13.366 416 HB1 ALA 56 1HB ALA 56 3.926 10.489 -12.844 417 HB2 ALA 56 2HB ALA 56 3.405 10.292 -11.171 418 HB3 ALA 56 3HB ALA 56 3.796 11.896 -11.789 419 H LEU 57 H LEU 57 0.726 9.659 -10.826 420 HA LEU 57 HA LEU 57 0.698 7.187 -12.153 421 HB2 LEU 57 2HB LEU 57 -0.245 8.316 -9.696 422 HB3 LEU 57 1HB LEU 57 -1.532 7.361 -10.402 423 HG LEU 57 HG LEU 57 0.262 5.503 -10.600 424 HD11 LEU 57 1HD1 LEU 57 1.509 6.770 -8.234 425 HD12 LEU 57 2HD1 LEU 57 2.004 7.337 -9.830 426 HD13 LEU 57 3HD1 LEU 57 2.184 5.635 -9.403 427 HD21 LEU 57 3HD2 LEU 57 -0.092 5.214 -7.952 428 HD22 LEU 57 1HD2 LEU 57 -1.348 4.887 -9.146 429 HD23 LEU 57 2HD2 LEU 57 -1.320 6.432 -8.297 430 H LYS 58 H LYS 58 -1.580 9.874 -12.131 431 HA LYS 58 HA LYS 58 -3.859 8.763 -13.092 432 HB2 LYS 58 2HB LYS 58 -2.606 11.408 -13.749 433 HB3 LYS 58 1HB LYS 58 -4.207 10.967 -14.327 434 HG2 LYS 58 2HG LYS 58 -5.011 10.764 -12.072 435 HG3 LYS 58 1HG LYS 58 -3.387 11.009 -11.430 436 HD2 LYS 58 2HD LYS 58 -5.242 12.991 -12.700 437 HD3 LYS 58 1HD LYS 58 -4.384 13.091 -11.164 438 HE2 LYS 58 2HE LYS 58 -2.259 13.303 -12.400 439 HE3 LYS 58 1HE LYS 58 -3.162 13.289 -13.914 440 HZ1 LYS 58 3HZ LYS 58 -2.561 15.538 -13.098 441 HZ2 LYS 58 1HZ LYS 58 -3.575 15.294 -11.765 442 HZ3 LYS 58 2HZ LYS 58 -4.222 15.322 -13.326 443 HA PRO 59 HA PRO 59 -2.801 8.810 -17.728 444 HB2 PRO 59 2HB PRO 59 -0.623 10.043 -18.688 445 HB3 PRO 59 1HB PRO 59 -2.090 10.949 -18.265 446 HG2 PRO 59 2HG PRO 59 0.415 10.549 -16.655 447 HG3 PRO 59 1HG PRO 59 -0.477 12.049 -16.975 448 HD2 PRO 59 2HD PRO 59 -0.772 10.642 -14.671 449 HD3 PRO 59 1HD PRO 59 -2.099 11.575 -15.413 450 H LYS 60 H LYS 60 -0.155 8.328 -15.541 451 HA LYS 60 HA LYS 60 1.252 6.519 -17.319 452 HB2 LYS 60 2HB LYS 60 2.772 7.649 -15.977 453 HB3 LYS 60 1HB LYS 60 1.717 7.604 -14.575 454 HG2 LYS 60 2HG LYS 60 3.523 6.165 -14.115 455 HG3 LYS 60 1HG LYS 60 2.127 5.133 -14.446 456 HD2 LYS 60 2HD LYS 60 4.079 4.251 -15.576 457 HD3 LYS 60 1HD LYS 60 2.949 4.882 -16.776 458 HE2 LYS 60 2HE LYS 60 4.606 7.036 -16.079 459 HE3 LYS 60 1HE LYS 60 5.676 5.644 -16.257 460 HZ1 LYS 60 3HZ LYS 60 5.293 5.519 -18.458 461 HZ2 LYS 60 1HZ LYS 60 4.884 7.153 -18.293 462 HZ3 LYS 60 2HZ LYS 60 3.670 5.976 -18.332 463 H PHE 61 H PHE 61 0.052 6.223 -14.005 464 HA PHE 61 HA PHE 61 0.044 3.486 -13.832 465 HB2 PHE 61 2HB PHE 61 -0.417 5.310 -12.057 466 HB3 PHE 61 1HB PHE 61 -2.101 5.116 -12.532 467 HD1 PHE 61 2HD PHE 61 -3.244 2.953 -12.150 468 HD2 PHE 61 1HD PHE 61 0.724 3.662 -10.786 469 HE1 PHE 61 2HE PHE 61 -3.404 0.995 -10.665 470 HE2 PHE 61 1HE PHE 61 0.569 1.709 -9.300 471 HZ PHE 61 HZ PHE 61 -1.496 0.375 -9.237 472 H ALA 62 H ALA 62 -2.068 5.528 -15.658 473 HA ALA 62 HA ALA 62 -4.335 3.930 -15.865 474 HB1 ALA 62 1HB ALA 62 -4.898 5.205 -17.695 475 HB2 ALA 62 2HB ALA 62 -3.249 5.230 -18.318 476 HB3 ALA 62 3HB ALA 62 -3.690 6.251 -16.948 477 H GLU 63 H GLU 63 -1.114 3.461 -16.896 478 HA GLU 63 HA GLU 63 -1.516 1.459 -18.900 479 HB2 GLU 63 2HB GLU 63 0.530 3.087 -18.377 480 HB3 GLU 63 1HB GLU 63 1.047 1.719 -17.386 481 HG2 GLU 63 2HG GLU 63 1.931 0.819 -19.200 482 HG3 GLU 63 1HG GLU 63 0.301 0.615 -19.842 483 H SER 64 H SER 64 -1.654 1.507 -15.542 484 HA SER 64 HA SER 64 -0.596 -0.904 -14.736 485 HB2 SER 64 2HB SER 64 -2.902 0.724 -13.745 486 HB3 SER 64 1HB SER 64 -2.414 -0.753 -12.936 487 HG SER 64 HG SER 64 -0.627 1.369 -13.488 488 H THR 65 H THR 65 -2.807 -0.700 -17.141 489 HA THR 65 HA THR 65 -4.860 -2.440 -16.625 490 HB THR 65 HB THR 65 -4.514 -3.218 -19.054 491 HG1 THR 65 1HG THR 65 -2.591 -1.143 -19.055 492 HG21 THR 65 3HG2 THR 65 -6.033 -1.393 -18.546 493 HG22 THR 65 1HG2 THR 65 -5.145 -1.086 -20.039 494 HG23 THR 65 2HG2 THR 65 -4.683 -0.259 -18.553 495 H GLU 66 H GLU 66 -1.489 -3.134 -17.304 496 HA GLU 66 HA GLU 66 -1.866 -5.989 -17.079 497 HB2 GLU 66 2HB GLU 66 0.488 -6.187 -17.460 498 HB3 GLU 66 1HB GLU 66 -0.122 -4.955 -18.567 499 HG2 GLU 66 2HG GLU 66 0.696 -3.736 -16.117 500 HG3 GLU 66 1HG GLU 66 1.997 -4.748 -16.739 501 H ILE 67 H ILE 67 -0.987 -3.278 -15.064 502 HA ILE 67 HA ILE 67 0.060 -4.846 -12.926 503 HB ILE 67 HB ILE 67 -1.225 -2.116 -12.803 504 HG12 ILE 67 2HG1 ILE 67 1.707 -2.850 -12.938 505 HG13 ILE 67 1HG1 ILE 67 0.755 -2.275 -14.315 506 HG21 ILE 67 1HG2 ILE 67 0.268 -1.961 -10.725 507 HG22 ILE 67 2HG2 ILE 67 0.336 -3.722 -10.812 508 HG23 ILE 67 3HG2 ILE 67 -1.216 -2.909 -10.607 509 HD11 ILE 67 3HD1 ILE 67 0.565 -0.516 -12.012 510 HD12 ILE 67 1HD1 ILE 67 0.973 -0.155 -13.689 511 HD13 ILE 67 2HD1 ILE 67 2.221 -0.724 -12.582 512 H SER 68 H SER 68 -3.069 -4.323 -14.197 513 HA SER 68 HA SER 68 -4.627 -4.686 -11.862 514 HB2 SER 68 2HB SER 68 -5.133 -4.276 -14.588 515 HB3 SER 68 1HB SER 68 -5.829 -5.859 -14.239 516 HG SER 68 HG SER 68 -6.429 -3.366 -13.052 517 H GLU 69 H GLU 69 -3.007 -6.826 -14.094 518 HA GLU 69 HA GLU 69 -4.103 -9.230 -12.956 519 HB2 GLU 69 2HB GLU 69 -1.718 -8.897 -14.787 520 HB3 GLU 69 1HB GLU 69 -2.565 -10.399 -14.444 521 HG2 GLU 69 2HG GLU 69 -3.817 -8.016 -15.787 522 HG3 GLU 69 1HG GLU 69 -3.118 -9.391 -16.641 523 H LEU 70 H LEU 70 -1.154 -7.332 -12.755 524 HA LEU 70 HA LEU 70 0.297 -9.123 -11.097 525 HB2 LEU 70 2HB LEU 70 0.509 -6.199 -11.720 526 HB3 LEU 70 1HB LEU 70 1.484 -6.890 -10.424 527 HG LEU 70 HG LEU 70 2.468 -8.477 -12.052 528 HD11 LEU 70 1HD1 LEU 70 1.109 -6.836 -14.176 529 HD12 LEU 70 2HD1 LEU 70 0.495 -8.391 -13.605 530 HD13 LEU 70 3HD1 LEU 70 2.077 -8.298 -14.378 531 HD21 LEU 70 3HD2 LEU 70 3.531 -6.304 -11.505 532 HD22 LEU 70 1HD2 LEU 70 2.734 -5.601 -12.913 533 HD23 LEU 70 2HD2 LEU 70 3.921 -6.889 -13.123 534 H SER 71 H SER 71 -2.401 -7.148 -10.498 535 HA SER 71 HA SER 71 -1.963 -6.436 -7.805 536 HB2 SER 71 2HB SER 71 -3.933 -5.958 -9.673 537 HB3 SER 71 1HB SER 71 -4.730 -7.005 -8.499 538 HG SER 71 HG SER 71 -4.652 -5.464 -7.054 539 H HIS 72 H HIS 72 -2.762 -9.443 -9.283 540 HA HIS 72 HA HIS 72 -4.211 -10.681 -7.234 541 HB2 HIS 72 2HB HIS 72 -2.342 -11.769 -9.340 542 HB3 HIS 72 1HB HIS 72 -3.173 -12.824 -8.189 543 HD1 HIS 72 1HD HIS 72 -5.280 -13.741 -9.076 544 HD2 HIS 72 2HD HIS 72 -4.406 -10.034 -10.738 545 HE1 HIS 72 1HE HIS 72 -7.128 -13.292 -10.723 546 HE2 HIS 72 2HE HIS 72 -6.631 -10.998 -11.640 547 H ASN 73 H ASN 73 -1.023 -9.588 -7.334 548 HA ASN 73 HA ASN 73 0.103 -11.454 -5.471 549 HB2 ASN 73 2HB ASN 73 1.031 -8.811 -6.593 550 HB3 ASN 73 1HB ASN 73 1.992 -9.802 -5.496 551 HD21 ASN 73 1HD2 ASN 73 0.877 -9.365 -8.704 552 HD22 ASN 73 2HD2 ASN 73 1.683 -10.730 -9.409 553 H PHE 74 H PHE 74 -1.652 -8.489 -5.249 554 HA PHE 74 HA PHE 74 -1.687 -8.652 -2.372 555 HB2 PHE 74 2HB PHE 74 -1.360 -5.966 -2.583 556 HB3 PHE 74 1HB PHE 74 -0.060 -7.106 -2.234 557 HD1 PHE 74 1HD PHE 74 -1.797 -5.923 -5.316 558 HD2 PHE 74 2HD PHE 74 1.879 -6.646 -3.301 559 HE1 PHE 74 1HE PHE 74 -0.563 -5.165 -7.307 560 HE2 PHE 74 2HE PHE 74 3.123 -5.886 -5.287 561 HZ PHE 74 HZ PHE 74 1.900 -5.145 -7.294 562 H VAL 75 H VAL 75 -3.043 -6.065 -2.039 563 HA VAL 75 HA VAL 75 -5.228 -6.222 -3.940 564 HB VAL 75 HB VAL 75 -5.783 -7.949 -2.272 565 HG11 VAL 75 1HG1 VAL 75 -6.319 -5.738 -0.319 566 HG12 VAL 75 2HG1 VAL 75 -4.769 -6.578 -0.358 567 HG13 VAL 75 3HG1 VAL 75 -6.251 -7.478 -0.037 568 HG21 VAL 75 3HG2 VAL 75 -7.422 -6.064 -3.449 569 HG22 VAL 75 1HG2 VAL 75 -7.937 -6.040 -1.766 570 HG23 VAL 75 2HG2 VAL 75 -7.955 -7.550 -2.672 571 H MET 76 H MET 76 -6.593 -4.649 -4.052 572 HA MET 76 HA MET 76 -6.122 -2.094 -3.982 573 HB2 MET 76 2HB MET 76 -8.674 -1.928 -3.570 574 HB3 MET 76 1HB MET 76 -8.067 -2.761 -4.986 575 HG2 MET 76 2HG MET 76 -8.374 -4.461 -2.622 576 HG3 MET 76 1HG MET 76 -9.880 -3.786 -3.224 577 HE1 MET 76 3HE MET 76 -9.411 -7.484 -3.928 578 HE2 MET 76 1HE MET 76 -10.830 -6.729 -4.648 579 HE3 MET 76 2HE MET 76 -10.274 -6.220 -3.054 580 H VAL 77 H VAL 77 -5.229 -0.913 -2.325 581 HA VAL 77 HA VAL 77 -6.981 -0.358 -0.068 582 HB VAL 77 HB VAL 77 -4.072 -1.073 0.317 583 HG11 VAL 77 1HG1 VAL 77 -4.298 0.524 1.931 584 HG12 VAL 77 2HG1 VAL 77 -4.981 -0.847 2.807 585 HG13 VAL 77 3HG1 VAL 77 -6.048 0.327 2.034 586 HG21 VAL 77 3HG2 VAL 77 -5.646 -2.970 0.022 587 HG22 VAL 77 1HG2 VAL 77 -6.532 -2.391 1.433 588 HG23 VAL 77 2HG2 VAL 77 -4.861 -2.927 1.600 589 H ASN 78 H ASN 78 -7.090 1.465 -1.757 590 HA ASN 78 HA ASN 78 -4.882 3.337 -1.653 591 HB2 ASN 78 2HB ASN 78 -6.139 2.972 -3.743 592 HB3 ASN 78 1HB ASN 78 -7.586 3.585 -2.964 593 HD21 ASN 78 1HD2 ASN 78 -4.396 4.935 -2.432 594 HD22 ASN 78 2HD2 ASN 78 -4.705 6.438 -3.243 595 H LEU 79 H LEU 79 -4.711 4.426 0.206 596 HA LEU 79 HA LEU 79 -7.121 5.417 1.527 597 HB2 LEU 79 2HB LEU 79 -5.628 4.437 3.050 598 HB3 LEU 79 1HB LEU 79 -4.240 5.218 2.328 599 HG LEU 79 HG LEU 79 -4.956 7.374 3.235 600 HD11 LEU 79 1HD1 LEU 79 -7.105 7.680 3.698 601 HD12 LEU 79 2HD1 LEU 79 -6.873 6.692 5.142 602 HD13 LEU 79 3HD1 LEU 79 -7.426 5.947 3.641 603 HD21 LEU 79 3HD2 LEU 79 -3.505 6.495 4.741 604 HD22 LEU 79 1HD2 LEU 79 -4.454 5.025 4.967 605 HD23 LEU 79 2HD2 LEU 79 -4.948 6.524 5.757 606 H GLU 80 H GLU 80 -7.809 7.463 1.361 607 HA GLU 80 HA GLU 80 -6.051 9.388 -0.010 608 HB2 GLU 80 2HB GLU 80 -8.501 8.571 -0.804 609 HB3 GLU 80 1HB GLU 80 -8.948 9.963 0.190 610 HG2 GLU 80 2HG GLU 80 -7.917 11.464 -1.205 611 HG3 GLU 80 1HG GLU 80 -6.784 10.260 -1.841 612 H ASP 81 H ASP 81 -6.920 11.753 0.488 613 HA ASP 81 HA ASP 81 -6.149 12.340 3.118 614 HB2 ASP 81 2HB ASP 81 -6.889 14.642 2.613 615 HB3 ASP 81 1HB ASP 81 -5.913 13.961 1.316 616 H GLU 82 H GLU 82 -9.268 11.663 1.723 617 HA GLU 82 HA GLU 82 -11.047 12.806 3.455 618 HB2 GLU 82 2HB GLU 82 -11.021 10.293 1.880 619 HB3 GLU 82 1HB GLU 82 -12.239 10.412 3.144 620 HG2 GLU 82 2HG GLU 82 -13.318 11.212 1.255 621 HG3 GLU 82 1HG GLU 82 -12.826 12.675 2.105 622 H GLU 83 H GLU 83 -8.892 10.141 4.060 623 HA GLU 83 HA GLU 83 -9.661 10.202 6.887 624 HB2 GLU 83 2HB GLU 83 -10.048 7.988 5.076 625 HB3 GLU 83 1HB GLU 83 -8.913 7.541 6.342 626 HG2 GLU 83 2HG GLU 83 -10.471 7.865 8.033 627 HG3 GLU 83 1HG GLU 83 -11.515 8.859 7.009 628 H GLU 84 H GLU 84 -7.848 11.188 7.617 629 HA GLU 84 HA GLU 84 -5.258 9.996 6.880 630 HB2 GLU 84 2HB GLU 84 -4.293 12.188 7.626 631 HB3 GLU 84 1HB GLU 84 -5.325 12.284 6.206 632 HG2 GLU 84 2HG GLU 84 -6.814 13.602 7.220 633 HG3 GLU 84 1HG GLU 84 -6.733 12.700 8.733 634 HA PRO 85 HA PRO 85 -5.752 8.585 11.219 635 HB2 PRO 85 2HB PRO 85 -3.426 6.952 10.361 636 HB3 PRO 85 1HB PRO 85 -4.931 6.448 11.153 637 HG2 PRO 85 2HG PRO 85 -4.492 5.918 8.573 638 HG3 PRO 85 1HG PRO 85 -6.109 6.369 9.160 639 HD2 PRO 85 2HD PRO 85 -4.083 8.029 7.704 640 HD3 PRO 85 1HD PRO 85 -5.853 7.975 7.512 641 H LYS 86 H LYS 86 -3.331 7.741 12.430 642 HA LYS 86 HA LYS 86 -1.499 9.995 12.195 643 HB2 LYS 86 2HB LYS 86 -3.010 9.301 14.716 644 HB3 LYS 86 1HB LYS 86 -1.553 10.302 14.703 645 HG2 LYS 86 2HG LYS 86 -3.065 11.968 14.592 646 HG3 LYS 86 1HG LYS 86 -3.003 11.605 12.865 647 HD2 LYS 86 2HD LYS 86 -5.215 11.318 12.981 648 HD3 LYS 86 1HD LYS 86 -4.873 9.816 13.839 649 HE2 LYS 86 2HE LYS 86 -4.683 11.660 15.841 650 HE3 LYS 86 1HE LYS 86 -5.947 12.357 14.830 651 HZ1 LYS 86 3HZ LYS 86 -6.730 9.814 14.936 652 HZ2 LYS 86 1HZ LYS 86 -7.249 10.996 16.030 653 HZ3 LYS 86 2HZ LYS 86 -5.987 9.950 16.447 654 H ASP 87 H ASP 87 -0.905 7.505 11.363 655 HA ASP 87 HA ASP 87 1.082 6.663 13.339 656 HB2 ASP 87 2HB ASP 87 -1.258 5.177 12.739 657 HB3 ASP 87 1HB ASP 87 0.102 4.323 11.994 658 H GLU 88 H GLU 88 2.169 4.547 12.032 659 HA GLU 88 HA GLU 88 3.766 5.797 10.052 660 HB2 GLU 88 2HB GLU 88 3.543 3.011 11.130 661 HB3 GLU 88 1HB GLU 88 4.565 3.346 9.742 662 HG2 GLU 88 2HG GLU 88 6.014 3.491 11.521 663 HG3 GLU 88 1HG GLU 88 5.597 5.174 11.222 664 H ASP 89 H ASP 89 0.754 4.251 9.881 665 HA ASP 89 HA ASP 89 0.740 2.872 7.520 666 HB2 ASP 89 2HB ASP 89 -1.294 4.381 9.057 667 HB3 ASP 89 1HB ASP 89 -1.706 3.962 7.388 668 H PHE 90 H PHE 90 1.350 6.245 7.802 669 HA PHE 90 HA PHE 90 0.789 6.544 4.926 670 HB2 PHE 90 2HB PHE 90 0.628 9.015 5.397 671 HB3 PHE 90 1HB PHE 90 -0.659 8.025 6.099 672 HD1 PHE 90 1HD PHE 90 2.651 9.495 6.966 673 HD2 PHE 90 2HD PHE 90 -1.203 8.311 8.315 674 HE1 PHE 90 1HE PHE 90 3.140 10.451 9.180 675 HE2 PHE 90 2HE PHE 90 -0.725 9.265 10.532 676 HZ PHE 90 HZ PHE 90 1.449 10.337 10.967 677 H SER 91 H SER 91 3.131 7.161 7.479 678 HA SER 91 HA SER 91 5.302 7.081 5.647 679 HB2 SER 91 2HB SER 91 4.525 9.787 6.756 680 HB3 SER 91 1HB SER 91 6.133 9.424 6.106 681 HG SER 91 HG SER 91 4.912 10.284 4.460 682 HA PRO 92 HA PRO 92 6.620 6.141 9.893 683 HB2 PRO 92 2HB PRO 92 8.061 3.958 9.329 684 HB3 PRO 92 1HB PRO 92 6.288 3.915 9.364 685 HG2 PRO 92 2HG PRO 92 8.138 3.990 7.029 686 HG3 PRO 92 1HG PRO 92 6.599 3.136 7.217 687 HD2 PRO 92 2HD PRO 92 6.967 5.570 5.897 688 HD3 PRO 92 1HD PRO 92 5.413 4.914 6.447 689 H ASP 93 H ASP 93 8.798 5.849 7.074 690 HA ASP 93 HA ASP 93 10.830 7.317 8.621 691 HB2 ASP 93 2HB ASP 93 11.205 4.775 8.156 692 HB3 ASP 93 1HB ASP 93 11.595 5.317 6.515 693 H GLY 94 H GLY 94 10.351 9.307 7.703 694 HA2 GLY 94 2HA GLY 94 11.721 10.114 5.469 695 HA3 GLY 94 1HA GLY 94 10.129 9.654 4.864 696 H GLY 95 H GLY 95 8.260 10.652 6.123 697 HA2 GLY 95 2HA GLY 95 7.717 12.574 7.628 698 HA3 GLY 95 1HA GLY 95 8.952 13.464 6.729 699 H TYR 96 H TYR 96 8.054 12.139 4.196 700 HA TYR 96 HA TYR 96 6.487 14.122 3.140 701 HB2 TYR 96 2HB TYR 96 5.692 12.193 1.508 702 HB3 TYR 96 1HB TYR 96 7.347 12.809 1.470 703 HD1 TYR 96 1HD TYR 96 9.164 11.479 2.563 704 HD2 TYR 96 2HD TYR 96 5.236 9.934 2.065 705 HE1 TYR 96 1HE TYR 96 10.022 9.205 2.908 706 HE2 TYR 96 2HE TYR 96 6.076 7.650 2.391 707 HH TYR 96 HH TYR 96 8.668 6.855 3.820 708 H ILE 97 H ILE 97 4.223 13.793 2.172 709 HA ILE 97 HA ILE 97 2.427 12.324 3.915 710 HB ILE 97 HB ILE 97 1.026 14.548 4.048 711 HG12 ILE 97 2HG1 ILE 97 3.563 15.948 4.436 712 HG13 ILE 97 1HG1 ILE 97 3.256 15.512 2.750 713 HG21 ILE 97 1HG2 ILE 97 3.394 13.918 5.792 714 HG22 ILE 97 2HG2 ILE 97 1.739 13.340 5.986 715 HG23 ILE 97 3HG2 ILE 97 2.111 15.050 6.219 716 HD11 ILE 97 3HD1 ILE 97 1.389 16.840 2.608 717 HD12 ILE 97 1HD1 ILE 97 2.440 17.791 3.660 718 HD13 ILE 97 2HD1 ILE 97 1.125 16.840 4.354 719 HA PRO 98 HA PRO 98 1.613 10.361 3.077 720 HB2 PRO 98 2HB PRO 98 -1.089 10.215 1.680 721 HB3 PRO 98 1HB PRO 98 -0.483 9.168 2.996 722 HG2 PRO 98 2HG PRO 98 -1.630 11.772 3.199 723 HG3 PRO 98 1HG PRO 98 -0.968 10.747 4.506 724 HD2 PRO 98 2HD PRO 98 0.304 12.927 3.959 725 HD3 PRO 98 1HD PRO 98 1.250 11.432 4.071 726 H ARG 99 H ARG 99 2.404 8.532 2.085 727 HA ARG 99 HA ARG 99 2.446 8.580 -0.858 728 HB2 ARG 99 2HB ARG 99 4.617 8.355 1.138 729 HB3 ARG 99 1HB ARG 99 4.757 7.313 -0.280 730 HG2 ARG 99 2HG ARG 99 5.944 9.414 -0.590 731 HG3 ARG 99 1HG ARG 99 4.617 9.254 -1.740 732 HD2 ARG 99 2HD ARG 99 3.251 10.756 -0.437 733 HD3 ARG 99 1HD ARG 99 4.461 10.815 0.834 734 HE ARG 99 HE ARG 99 5.755 12.232 -0.469 735 HH11 ARG 99 1HH1 ARG 99 2.951 11.151 -2.253 736 HH12 ARG 99 2HH1 ARG 99 3.099 12.381 -3.463 737 HH21 ARG 99 1HH2 ARG 99 5.944 13.844 -2.057 738 HH22 ARG 99 2HH2 ARG 99 4.798 13.907 -3.354 739 H ILE 100 H ILE 100 3.757 6.258 -1.363 740 HA ILE 100 HA ILE 100 1.703 4.280 -0.754 741 HB ILE 100 HB ILE 100 3.994 4.257 -2.715 742 HG12 ILE 100 2HG1 ILE 100 1.008 4.479 -3.111 743 HG13 ILE 100 1HG1 ILE 100 2.166 5.794 -3.278 744 HG21 ILE 100 1HG2 ILE 100 3.812 2.033 -2.655 745 HG22 ILE 100 2HG2 ILE 100 2.286 2.267 -3.507 746 HG23 ILE 100 3HG2 ILE 100 2.299 2.091 -1.753 747 HD11 ILE 100 3HD1 ILE 100 1.618 3.502 -5.081 748 HD12 ILE 100 1HD1 ILE 100 3.250 4.169 -5.035 749 HD13 ILE 100 2HD1 ILE 100 1.885 5.204 -5.457 750 H LEU 101 H LEU 101 2.063 2.304 0.203 751 HA LEU 101 HA LEU 101 4.715 1.482 0.997 752 HB2 LEU 101 2HB LEU 101 3.341 1.282 3.421 753 HB3 LEU 101 1HB LEU 101 4.684 2.343 3.053 754 HG LEU 101 HG LEU 101 1.902 3.228 2.409 755 HD11 LEU 101 1HD1 LEU 101 3.143 2.960 5.097 756 HD12 LEU 101 2HD1 LEU 101 1.464 2.739 4.602 757 HD13 LEU 101 3HD1 LEU 101 2.135 4.363 4.751 758 HD21 LEU 101 3HD2 LEU 101 3.537 5.242 3.510 759 HD22 LEU 101 1HD2 LEU 101 3.008 5.060 1.837 760 HD23 LEU 101 2HD2 LEU 101 4.533 4.344 2.365 761 H PHE 102 H PHE 102 4.772 -0.706 1.866 762 HA PHE 102 HA PHE 102 2.566 -2.280 0.809 763 HB2 PHE 102 2HB PHE 102 5.360 -2.843 1.661 764 HB3 PHE 102 1HB PHE 102 4.204 -4.170 1.685 765 HD1 PHE 102 2HD PHE 102 5.853 -1.673 -0.463 766 HD2 PHE 102 1HD PHE 102 3.456 -5.185 -0.319 767 HE1 PHE 102 2HE PHE 102 6.179 -1.989 -2.880 768 HE2 PHE 102 1HE PHE 102 3.778 -5.510 -2.736 769 HZ PHE 102 HZ PHE 102 5.141 -3.911 -4.020 770 H LEU 103 H LEU 103 0.999 -3.139 1.963 771 HA LEU 103 HA LEU 103 1.059 -2.893 4.867 772 HB2 LEU 103 2HB LEU 103 -0.906 -2.476 2.986 773 HB3 LEU 103 1HB LEU 103 -1.337 -4.034 3.645 774 HG LEU 103 HG LEU 103 -2.510 -2.205 4.778 775 HD11 LEU 103 1HD1 LEU 103 -1.739 -2.789 7.128 776 HD12 LEU 103 2HD1 LEU 103 -0.542 -3.826 6.353 777 HD13 LEU 103 3HD1 LEU 103 -2.261 -4.120 6.097 778 HD21 LEU 103 3HD2 LEU 103 -1.321 -0.306 4.927 779 HD22 LEU 103 1HD2 LEU 103 0.223 -1.151 5.006 780 HD23 LEU 103 2HD2 LEU 103 -0.774 -0.998 6.451 781 H ASP 104 H ASP 104 1.264 -4.569 6.229 782 HA ASP 104 HA ASP 104 1.899 -7.157 5.239 783 HB2 ASP 104 2HB ASP 104 2.522 -5.941 7.523 784 HB3 ASP 104 1HB ASP 104 1.063 -6.768 8.085 785 HA PRO 105 HA PRO 105 -2.222 -8.693 4.720 786 HB2 PRO 105 2HB PRO 105 -1.709 -11.377 4.918 787 HB3 PRO 105 1HB PRO 105 -1.414 -10.407 3.463 788 HG2 PRO 105 2HG PRO 105 0.502 -11.309 5.574 789 HG3 PRO 105 1HG PRO 105 0.729 -11.209 3.813 790 HD2 PRO 105 2HD PRO 105 1.727 -9.359 5.523 791 HD3 PRO 105 1HD PRO 105 1.199 -8.954 3.877 792 H SER 106 H SER 106 -1.105 -8.158 7.542 793 HA SER 106 HA SER 106 -2.883 -9.986 8.989 794 HB2 SER 106 2HB SER 106 -0.264 -9.673 9.512 795 HB3 SER 106 1HB SER 106 -0.899 -8.327 10.471 796 HG SER 106 HG SER 106 -0.723 -10.510 11.488 797 H GLY 107 H GLY 107 -2.324 -6.815 7.916 798 HA2 GLY 107 2HA GLY 107 -4.198 -5.290 7.985 799 HA3 GLY 107 1HA GLY 107 -4.508 -5.860 9.626 800 H LYS 108 H LYS 108 -1.392 -4.875 8.187 801 HA LYS 108 HA LYS 108 -1.401 -2.302 9.379 802 HB2 LYS 108 2HB LYS 108 -1.222 -3.211 11.502 803 HB3 LYS 108 1HB LYS 108 -0.247 -4.566 10.953 804 HG2 LYS 108 2HG LYS 108 1.688 -3.442 11.167 805 HG3 LYS 108 1HG LYS 108 0.973 -1.901 10.661 806 HD2 LYS 108 2HD LYS 108 -0.281 -2.190 12.999 807 HD3 LYS 108 1HD LYS 108 1.176 -3.117 13.363 808 HE2 LYS 108 2HE LYS 108 2.109 -1.155 13.879 809 HE3 LYS 108 1HE LYS 108 2.170 -0.865 12.141 810 HZ1 LYS 108 3HZ LYS 108 0.286 0.185 14.133 811 HZ2 LYS 108 1HZ LYS 108 -0.233 0.001 12.533 812 HZ3 LYS 108 2HZ LYS 108 1.091 0.995 12.885 813 H VAL 109 H VAL 109 0.036 -1.075 8.349 814 HA VAL 109 HA VAL 109 1.812 -2.140 6.406 815 HB VAL 109 HB VAL 109 0.735 0.258 6.598 816 HG11 VAL 109 1HG1 VAL 109 3.384 0.653 7.983 817 HG12 VAL 109 2HG1 VAL 109 1.783 0.945 8.661 818 HG13 VAL 109 3HG1 VAL 109 2.379 1.945 7.336 819 HG21 VAL 109 3HG2 VAL 109 1.762 0.014 4.608 820 HG22 VAL 109 1HG2 VAL 109 3.203 -0.710 5.321 821 HG23 VAL 109 2HG2 VAL 109 2.990 1.039 5.350 822 H HIS 110 H HIS 110 3.834 -2.715 6.470 823 HA HIS 110 HA HIS 110 5.254 -2.404 9.027 824 HB2 HIS 110 2HB HIS 110 5.069 -4.588 7.055 825 HB3 HIS 110 1HB HIS 110 6.703 -4.255 7.623 826 HD1 HIS 110 1HD HIS 110 7.340 -5.295 9.788 827 HD2 HIS 110 2HD HIS 110 3.218 -5.140 9.279 828 HE1 HIS 110 1HE HIS 110 6.373 -6.551 11.741 829 HE2 HIS 110 2HE HIS 110 3.884 -6.529 11.357 830 HA PRO 111 HA PRO 111 7.856 0.421 6.766 831 HB2 PRO 111 2HB PRO 111 9.856 0.647 8.594 832 HB3 PRO 111 1HB PRO 111 8.293 1.453 8.776 833 HG2 PRO 111 2HG PRO 111 9.272 -1.086 10.024 834 HG3 PRO 111 1HG PRO 111 8.353 0.242 10.760 835 HD2 PRO 111 2HD PRO 111 7.192 -2.073 9.953 836 HD3 PRO 111 1HD PRO 111 6.347 -0.507 9.905 837 H GLU 112 H GLU 112 7.974 -2.372 6.107 838 HA GLU 112 HA GLU 112 10.883 -2.798 5.856 839 HB2 GLU 112 2HB GLU 112 8.575 -4.651 6.163 840 HB3 GLU 112 1HB GLU 112 9.929 -5.193 5.181 841 HG2 GLU 112 2HG GLU 112 10.174 -5.961 7.456 842 HG3 GLU 112 1HG GLU 112 11.447 -4.807 7.057 843 H ILE 113 H ILE 113 8.141 -4.074 3.990 844 HA ILE 113 HA ILE 113 9.553 -3.907 1.548 845 HB ILE 113 HB ILE 113 6.572 -4.190 1.914 846 HG12 ILE 113 2HG1 ILE 113 7.691 -5.905 3.200 847 HG13 ILE 113 1HG1 ILE 113 7.027 -6.634 1.731 848 HG21 ILE 113 1HG2 ILE 113 7.532 -3.619 -0.381 849 HG22 ILE 113 2HG2 ILE 113 6.489 -5.037 -0.272 850 HG23 ILE 113 3HG2 ILE 113 8.240 -5.234 -0.353 851 HD11 ILE 113 3HD1 ILE 113 9.287 -7.438 2.301 852 HD12 ILE 113 1HD1 ILE 113 9.897 -5.798 2.081 853 HD13 ILE 113 2HD1 ILE 113 9.203 -6.671 0.715 854 H ILE 114 H ILE 114 10.191 -2.003 0.830 855 HA ILE 114 HA ILE 114 8.170 0.092 0.396 856 HB ILE 114 HB ILE 114 9.684 1.808 0.933 857 HG12 ILE 114 2HG1 ILE 114 11.671 0.965 -0.209 858 HG13 ILE 114 1HG1 ILE 114 12.069 1.431 1.436 859 HG21 ILE 114 1HG2 ILE 114 9.663 1.547 3.147 860 HG22 ILE 114 2HG2 ILE 114 10.702 0.122 3.083 861 HG23 ILE 114 3HG2 ILE 114 8.964 -0.038 2.817 862 HD11 ILE 114 3HD1 ILE 114 11.933 -1.280 0.222 863 HD12 ILE 114 1HD1 ILE 114 11.691 -1.080 1.957 864 HD13 ILE 114 2HD1 ILE 114 13.197 -0.548 1.210 865 H ASN 115 H ASN 115 9.771 1.836 -1.056 866 HA ASN 115 HA ASN 115 10.048 0.351 -3.556 867 HB2 ASN 115 2HB ASN 115 8.671 2.416 -3.522 868 HB3 ASN 115 1HB ASN 115 10.112 3.337 -3.073 869 HD21 ASN 115 1HD2 ASN 115 10.008 4.601 -4.918 870 HD22 ASN 115 2HD2 ASN 115 10.427 3.975 -6.489 871 H GLU 116 H GLU 116 12.038 -0.652 -3.346 872 HA GLU 116 HA GLU 116 14.376 0.426 -2.332 873 HB2 GLU 116 2HB GLU 116 14.200 -1.493 -4.640 874 HB3 GLU 116 1HB GLU 116 15.560 -1.300 -3.549 875 HG2 GLU 116 2HG GLU 116 14.656 -2.667 -2.127 876 HG3 GLU 116 1HG GLU 116 13.087 -1.900 -2.224 877 H ASN 117 H ASN 117 12.769 1.114 -5.307 878 HA ASN 117 HA ASN 117 15.007 2.152 -6.723 879 HB2 ASN 117 2HB ASN 117 12.033 2.264 -7.066 880 HB3 ASN 117 1HB ASN 117 13.060 3.348 -8.017 881 HD21 ASN 117 1HD2 ASN 117 13.877 2.603 -9.837 882 HD22 ASN 117 2HD2 ASN 117 13.939 0.928 -10.313 883 H GLY 118 H GLY 118 13.033 3.397 -4.189 884 HA2 GLY 118 2HA GLY 118 13.555 6.170 -4.829 885 HA3 GLY 118 1HA GLY 118 12.698 5.555 -3.410 886 H ASN 119 H ASN 119 14.813 7.561 -3.650 887 HA ASN 119 HA ASN 119 17.328 6.777 -2.888 888 HB2 ASN 119 2HB ASN 119 17.337 8.967 -1.511 889 HB3 ASN 119 1HB ASN 119 17.064 9.076 -3.256 890 HD21 ASN 119 1HD2 ASN 119 16.182 10.458 -0.557 891 HD22 ASN 119 2HD2 ASN 119 14.509 10.822 -0.881 892 HA PRO 120 HA PRO 120 17.060 4.991 1.127 893 HB2 PRO 120 2HB PRO 120 19.342 5.807 2.321 894 HB3 PRO 120 1HB PRO 120 19.331 4.653 0.972 895 HG2 PRO 120 2HG PRO 120 19.876 7.603 0.946 896 HG3 PRO 120 1HG PRO 120 20.742 6.292 0.110 897 HD2 PRO 120 2HD PRO 120 18.908 7.880 -1.121 898 HD3 PRO 120 1HD PRO 120 19.193 6.187 -1.589 899 H SER 121 H SER 121 15.265 6.900 1.257 900 HA SER 121 HA SER 121 15.253 7.728 3.947 901 HB2 SER 121 2HB SER 121 16.082 9.781 1.905 902 HB3 SER 121 1HB SER 121 15.148 10.266 3.329 903 HG SER 121 HG SER 121 16.844 9.139 4.561 904 H TYR 122 H TYR 122 14.183 8.248 0.683 905 HA TYR 122 HA TYR 122 11.527 9.067 1.455 906 HB2 TYR 122 2HB TYR 122 13.235 9.286 -0.817 907 HB3 TYR 122 1HB TYR 122 11.735 8.505 -1.314 908 HD1 TYR 122 1HD TYR 122 12.039 11.011 1.385 909 HD2 TYR 122 2HD TYR 122 10.851 10.287 -2.629 910 HE1 TYR 122 1HE TYR 122 10.968 13.220 1.315 911 HE2 TYR 122 2HE TYR 122 9.768 12.495 -2.715 912 HH TYR 122 HH TYR 122 10.363 14.903 -0.914 913 H LYS 123 H LYS 123 12.920 6.450 -0.498 914 HA LYS 123 HA LYS 123 12.123 4.395 -1.097 915 HB2 LYS 123 2HB LYS 123 11.488 4.601 1.832 916 HB3 LYS 123 1HB LYS 123 11.143 3.134 0.930 917 HG2 LYS 123 2HG LYS 123 13.859 4.417 1.196 918 HG3 LYS 123 1HG LYS 123 13.277 3.021 2.122 919 HD2 LYS 123 2HD LYS 123 13.748 1.615 0.458 920 HD3 LYS 123 1HD LYS 123 12.939 2.640 -0.735 921 HE2 LYS 123 2HE LYS 123 15.093 2.675 -1.508 922 HE3 LYS 123 1HE LYS 123 15.092 4.102 -0.474 923 HZ1 LYS 123 3HZ LYS 123 16.534 1.617 -0.186 924 HZ2 LYS 123 1HZ LYS 123 15.809 2.164 1.243 925 HZ3 LYS 123 2HZ LYS 123 16.899 3.156 0.413 926 H TYR 124 H TYR 124 9.531 4.689 1.230 927 HA TYR 124 HA TYR 124 7.504 3.712 -0.237 928 HB2 TYR 124 2HB TYR 124 7.489 5.759 1.945 929 HB3 TYR 124 1HB TYR 124 5.985 5.155 1.239 930 HD1 TYR 124 1HD TYR 124 6.489 2.369 0.781 931 HD2 TYR 124 2HD TYR 124 7.732 4.788 4.052 932 HE1 TYR 124 1HE TYR 124 6.632 0.368 2.195 933 HE2 TYR 124 2HE TYR 124 7.877 2.786 5.475 934 HH TYR 124 HH TYR 124 6.518 -0.156 4.658 935 H PHE 125 H PHE 125 8.929 6.792 -0.861 936 HA PHE 125 HA PHE 125 6.608 7.850 -2.223 937 HB2 PHE 125 2HB PHE 125 8.122 9.444 -1.216 938 HB3 PHE 125 1HB PHE 125 9.490 8.776 -2.118 939 HD1 PHE 125 1HD PHE 125 6.281 10.595 -2.502 940 HD2 PHE 125 2HD PHE 125 10.024 9.573 -4.250 941 HE1 PHE 125 1HE PHE 125 5.875 12.211 -4.313 942 HE2 PHE 125 2HE PHE 125 9.627 11.190 -6.058 943 HZ PHE 125 HZ PHE 125 7.550 12.510 -6.094 944 H TYR 126 H TYR 126 5.999 7.231 -4.208 945 HA TYR 126 HA TYR 126 7.992 5.937 -5.938 946 HB2 TYR 126 2HB TYR 126 4.974 5.789 -5.919 947 HB3 TYR 126 1HB TYR 126 5.978 5.081 -7.191 948 HD1 TYR 126 2HD TYR 126 5.917 5.103 -3.457 949 HD2 TYR 126 1HD TYR 126 6.291 2.808 -7.008 950 HE1 TYR 126 2HE TYR 126 6.141 3.061 -2.101 951 HE2 TYR 126 1HE TYR 126 6.513 0.757 -5.672 952 HH TYR 126 HH TYR 126 7.114 0.059 -3.456 953 H VAL 127 H VAL 127 7.525 6.196 -8.327 954 HA VAL 127 HA VAL 127 6.275 8.545 -9.302 955 HB VAL 127 HB VAL 127 8.473 9.505 -10.245 956 HG11 VAL 127 1HG1 VAL 127 8.508 11.109 -8.588 957 HG12 VAL 127 2HG1 VAL 127 8.244 9.931 -7.303 958 HG13 VAL 127 3HG1 VAL 127 6.914 10.388 -8.364 959 HG21 VAL 127 3HG2 VAL 127 9.772 7.490 -9.323 960 HG22 VAL 127 1HG2 VAL 127 9.688 8.326 -7.772 961 HG23 VAL 127 2HG2 VAL 127 10.486 9.093 -9.144 962 H SER 128 H SER 128 5.384 7.386 -10.903 963 HA SER 128 HA SER 128 5.331 6.646 -13.099 964 HB2 SER 128 2HB SER 128 7.780 7.522 -13.249 965 HB3 SER 128 1HB SER 128 8.222 5.823 -13.009 966 HG SER 128 HG SER 128 7.910 5.679 -15.081 967 H ALA 129 H ALA 129 4.669 4.690 -13.778 968 HA ALA 129 HA ALA 129 4.411 2.593 -11.951 969 HB1 ALA 129 1HB ALA 129 4.184 2.003 -14.850 970 HB2 ALA 129 2HB ALA 129 3.107 3.219 -14.164 971 HB3 ALA 129 3HB ALA 129 3.109 1.577 -13.518 972 H GLU 130 H GLU 130 6.960 3.329 -14.163 973 HA GLU 130 HA GLU 130 8.051 0.886 -14.765 974 HB2 GLU 130 2HB GLU 130 9.136 3.612 -14.352 975 HB3 GLU 130 1HB GLU 130 10.311 2.293 -14.300 976 HG2 GLU 130 2HG GLU 130 8.358 2.653 -16.560 977 HG3 GLU 130 1HG GLU 130 9.962 3.404 -16.536 978 H GLN 131 H GLN 131 8.918 2.839 -11.897 979 HA GLN 131 HA GLN 131 10.346 0.669 -10.743 980 HB2 GLN 131 2HB GLN 131 10.446 2.056 -8.722 981 HB3 GLN 131 1HB GLN 131 11.068 2.854 -10.160 982 HG2 GLN 131 2HG GLN 131 8.632 3.812 -10.298 983 HG3 GLN 131 1HG GLN 131 8.610 3.425 -8.578 984 HE21 GLN 131 1HE2 GLN 131 9.058 5.110 -7.378 985 HE22 GLN 131 2HE2 GLN 131 10.196 6.356 -7.742 986 H VAL 132 H VAL 132 7.186 2.148 -10.076 987 HA VAL 132 HA VAL 132 6.498 0.717 -7.824 988 HB VAL 132 HB VAL 132 4.332 1.370 -8.100 989 HG11 VAL 132 1HG1 VAL 132 6.157 3.221 -8.896 990 HG12 VAL 132 2HG1 VAL 132 4.458 3.545 -8.557 991 HG13 VAL 132 3HG1 VAL 132 4.988 3.264 -10.214 992 HG21 VAL 132 3HG2 VAL 132 4.678 0.708 -10.989 993 HG22 VAL 132 1HG2 VAL 132 3.328 1.714 -10.464 994 HG23 VAL 132 2HG2 VAL 132 3.510 0.079 -9.827 995 H VAL 133 H VAL 133 6.681 -0.369 -11.121 996 HA VAL 133 HA VAL 133 5.212 -2.792 -10.606 997 HB VAL 133 HB VAL 133 5.244 -1.674 -12.852 998 HG11 VAL 133 1HG1 VAL 133 7.228 -1.124 -13.692 999 HG12 VAL 133 2HG1 VAL 133 7.458 -2.836 -14.046 1000 HG13 VAL 133 3HG1 VAL 133 8.079 -2.155 -12.544 1001 HG21 VAL 133 3HG2 VAL 133 6.229 -4.508 -13.013 1002 HG22 VAL 133 1HG2 VAL 133 5.038 -3.696 -14.030 1003 HG23 VAL 133 2HG2 VAL 133 4.641 -4.100 -12.359 1004 H GLN 134 H GLN 134 8.619 -1.803 -10.660 1005 HA GLN 134 HA GLN 134 9.522 -4.552 -10.637 1006 HB2 GLN 134 2HB GLN 134 11.717 -3.362 -9.785 1007 HB3 GLN 134 1HB GLN 134 11.231 -3.278 -11.470 1008 HG2 GLN 134 2HG GLN 134 10.220 -1.084 -11.044 1009 HG3 GLN 134 1HG GLN 134 10.788 -1.169 -9.378 1010 HE21 GLN 134 1HE2 GLN 134 11.431 0.114 -12.297 1011 HE22 GLN 134 2HE2 GLN 134 13.157 0.324 -12.165 1012 H GLY 135 H GLY 135 8.917 -2.040 -8.272 1013 HA2 GLY 135 2HA GLY 135 9.874 -3.567 -6.043 1014 HA3 GLY 135 1HA GLY 135 8.901 -2.091 -5.966 1015 H MET 136 H MET 136 6.966 -3.498 -7.902 1016 HA MET 136 HA MET 136 5.405 -4.760 -5.780 1017 HB2 MET 136 2HB MET 136 4.799 -3.526 -8.404 1018 HB3 MET 136 1HB MET 136 3.763 -4.854 -7.912 1019 HG2 MET 136 2HG MET 136 2.942 -2.575 -7.302 1020 HG3 MET 136 1HG MET 136 3.060 -3.715 -5.965 1021 HE1 MET 136 3HE MET 136 4.283 0.382 -5.582 1022 HE2 MET 136 1HE MET 136 2.783 -0.535 -5.431 1023 HE3 MET 136 2HE MET 136 3.512 -0.290 -7.019 1024 H LYS 137 H LYS 137 6.927 -5.512 -8.842 1025 HA LYS 137 HA LYS 137 5.871 -8.156 -9.036 1026 HB2 LYS 137 2HB LYS 137 7.175 -8.395 -10.972 1027 HB3 LYS 137 1HB LYS 137 6.728 -6.698 -10.946 1028 HG2 LYS 137 2HG LYS 137 8.997 -6.307 -9.831 1029 HG3 LYS 137 1HG LYS 137 9.388 -7.944 -10.362 1030 HD2 LYS 137 2HD LYS 137 8.600 -5.606 -12.098 1031 HD3 LYS 137 1HD LYS 137 10.185 -6.374 -12.007 1032 HE2 LYS 137 2HE LYS 137 7.711 -7.868 -12.838 1033 HE3 LYS 137 1HE LYS 137 8.715 -6.991 -13.989 1034 HZ1 LYS 137 3HZ LYS 137 10.538 -8.389 -13.543 1035 HZ2 LYS 137 1HZ LYS 137 9.211 -9.425 -13.720 1036 HZ3 LYS 137 2HZ LYS 137 9.805 -9.066 -12.178 1037 H GLU 138 H GLU 138 8.312 -6.770 -7.146 1038 HA GLU 138 HA GLU 138 9.772 -9.287 -6.863 1039 HB2 GLU 138 2HB GLU 138 10.463 -6.491 -6.616 1040 HB3 GLU 138 1HB GLU 138 10.905 -7.374 -5.154 1041 HG2 GLU 138 2HG GLU 138 11.645 -8.776 -7.595 1042 HG3 GLU 138 1HG GLU 138 12.400 -7.180 -7.447 1043 H ALA 139 H ALA 139 8.586 -6.770 -4.656 1044 HA ALA 139 HA ALA 139 8.645 -8.263 -2.322 1045 HB1 ALA 139 1HB ALA 139 8.334 -5.840 -2.371 1046 HB2 ALA 139 2HB ALA 139 7.093 -6.630 -1.399 1047 HB3 ALA 139 3HB ALA 139 6.710 -6.060 -3.023 1048 H GLN 140 H GLN 140 6.431 -8.437 -4.952 1049 HA GLN 140 HA GLN 140 4.158 -9.428 -3.700 1050 HB2 GLN 140 2HB GLN 140 3.734 -10.514 -5.964 1051 HB3 GLN 140 1HB GLN 140 3.919 -8.761 -5.931 1052 HG2 GLN 140 2HG GLN 140 5.188 -9.330 -7.743 1053 HG3 GLN 140 1HG GLN 140 6.401 -9.301 -6.469 1054 HE21 GLN 140 1HE2 GLN 140 3.994 -11.701 -7.485 1055 HE22 GLN 140 2HE2 GLN 140 5.121 -12.992 -7.696 1056 H GLU 141 H GLU 141 7.207 -10.954 -4.034 1057 HA GLU 141 HA GLU 141 5.956 -13.569 -3.534 1058 HB2 GLU 141 2HB GLU 141 7.346 -14.536 -4.987 1059 HB3 GLU 141 1HB GLU 141 7.730 -12.900 -5.526 1060 HG2 GLU 141 2HG GLU 141 9.495 -12.942 -3.683 1061 HG3 GLU 141 1HG GLU 141 9.273 -14.689 -3.701 1062 H ARG 142 H ARG 142 8.449 -11.344 -2.451 1063 HA ARG 142 HA ARG 142 9.336 -13.147 -0.372 1064 HB2 ARG 142 2HB ARG 142 10.726 -11.146 0.334 1065 HB3 ARG 142 1HB ARG 142 11.044 -11.785 -1.283 1066 HG2 ARG 142 2HG ARG 142 9.882 -9.995 -2.313 1067 HG3 ARG 142 1HG ARG 142 9.226 -9.443 -0.761 1068 HD2 ARG 142 2HD ARG 142 11.138 -8.086 -1.648 1069 HD3 ARG 142 1HD ARG 142 11.375 -8.736 -0.018 1070 HE ARG 142 HE ARG 142 12.446 -10.416 -2.087 1071 HH11 ARG 142 1HH1 ARG 142 13.081 -7.666 -0.034 1072 HH12 ARG 142 2HH1 ARG 142 14.801 -7.846 -0.112 1073 HH21 ARG 142 1HH2 ARG 142 14.710 -10.654 -2.192 1074 HH22 ARG 142 2HH2 ARG 142 15.727 -9.543 -1.339 1075 H LEU 143 H LEU 143 7.130 -10.470 -0.682 1076 HA LEU 143 HA LEU 143 6.893 -10.073 2.169 1077 HB2 LEU 143 2HB LEU 143 6.636 -8.208 0.578 1078 HB3 LEU 143 1HB LEU 143 5.206 -8.993 -0.090 1079 HG LEU 143 HG LEU 143 3.989 -8.672 1.957 1080 HD11 LEU 143 1HD1 LEU 143 5.359 -7.140 3.682 1081 HD12 LEU 143 2HD1 LEU 143 6.675 -8.128 3.046 1082 HD13 LEU 143 3HD1 LEU 143 5.277 -8.898 3.796 1083 HD21 LEU 143 3HD2 LEU 143 4.583 -6.039 2.184 1084 HD22 LEU 143 1HD2 LEU 143 3.588 -6.729 0.901 1085 HD23 LEU 143 2HD2 LEU 143 5.300 -6.411 0.616 1086 H THR 144 H THR 144 5.176 -11.811 -0.343 1087 HA THR 144 HA THR 144 2.749 -12.274 0.921 1088 HB THR 144 HB THR 144 2.752 -14.409 -0.452 1089 HG1 THR 144 1HG THR 144 5.121 -14.497 -0.462 1090 HG21 THR 144 3HG2 THR 144 3.316 -11.792 -1.805 1091 HG22 THR 144 1HG2 THR 144 1.742 -12.487 -1.417 1092 HG23 THR 144 2HG2 THR 144 2.762 -13.241 -2.644 1093 H GLY 145 H GLY 145 3.038 -12.627 3.128 1094 HA2 GLY 145 2HA GLY 145 2.750 -14.670 4.533 1095 HA3 GLY 145 1HA GLY 145 4.259 -15.227 3.826 1096 H ASP 146 H ASP 146 5.942 -15.031 5.131 1097 HA ASP 146 HA ASP 146 6.370 -12.583 6.617 1098 HB2 ASP 146 2HB ASP 146 5.466 -15.077 7.896 1099 HB3 ASP 146 1HB ASP 146 6.889 -14.350 8.637 1100 H ALA 147 H ALA 147 7.637 -14.211 4.463 1101 HA ALA 147 HA ALA 147 10.106 -15.154 5.657 1102 HB1 ALA 147 1HB ALA 147 8.852 -15.286 2.982 1103 HB2 ALA 147 2HB ALA 147 9.696 -16.530 3.903 1104 HB3 ALA 147 3HB ALA 147 10.613 -15.298 3.035 1105 H PHE 148 H PHE 148 8.872 -12.298 4.145 1106 HA PHE 148 HA PHE 148 11.191 -11.124 3.156 1107 HB2 PHE 148 2HB PHE 148 10.016 -8.955 3.515 1108 HB3 PHE 148 1HB PHE 148 9.015 -10.166 2.704 1109 HD1 PHE 148 2HD PHE 148 7.126 -11.177 3.842 1110 HD2 PHE 148 1HD PHE 148 9.510 -8.211 5.745 1111 HE1 PHE 148 2HE PHE 148 5.380 -10.876 5.548 1112 HE2 PHE 148 1HE PHE 148 7.769 -7.904 7.456 1113 HZ PHE 148 HZ PHE 148 5.700 -9.236 7.358 1114 H ARG 149 H ARG 149 9.980 -11.351 6.439 1115 HA ARG 149 HA ARG 149 11.682 -9.453 7.624 1116 HB2 ARG 149 2HB ARG 149 10.426 -11.923 8.828 1117 HB3 ARG 149 1HB ARG 149 11.105 -10.580 9.727 1118 HG2 ARG 149 2HG ARG 149 9.385 -9.177 8.345 1119 HG3 ARG 149 1HG ARG 149 8.573 -10.734 8.181 1120 HD2 ARG 149 2HD ARG 149 7.651 -10.342 10.167 1121 HD3 ARG 149 1HD ARG 149 9.250 -10.591 10.868 1122 HE ARG 149 HE ARG 149 8.772 -7.908 9.935 1123 HH11 ARG 149 1HH1 ARG 149 8.482 -10.112 12.628 1124 HH12 ARG 149 2HH1 ARG 149 8.446 -8.852 13.815 1125 HH21 ARG 149 1HH2 ARG 149 8.724 -6.252 11.496 1126 HH22 ARG 149 2HH2 ARG 149 8.582 -6.661 13.174 1127 H LYS 150 H LYS 150 13.699 -9.949 6.508 1128 HA LYS 150 HA LYS 150 15.822 -10.755 6.464 1129 HB2 LYS 150 2HB LYS 150 14.937 -11.049 9.209 1130 HB3 LYS 150 1HB LYS 150 16.116 -12.281 8.785 1131 HG2 LYS 150 2HG LYS 150 16.571 -9.360 8.259 1132 HG3 LYS 150 1HG LYS 150 17.019 -10.142 9.776 1133 HD2 LYS 150 2HD LYS 150 17.919 -11.463 7.287 1134 HD3 LYS 150 1HD LYS 150 18.687 -9.926 7.687 1135 HE2 LYS 150 2HE LYS 150 18.495 -11.596 10.023 1136 HE3 LYS 150 1HE LYS 150 19.297 -12.461 8.712 1137 HZ1 LYS 150 3HZ LYS 150 20.499 -10.723 10.386 1138 HZ2 LYS 150 1HZ LYS 150 20.197 -9.744 9.040 1139 HZ3 LYS 150 2HZ LYS 150 21.094 -11.168 8.866 1140 H LYS 151 H LYS 151 14.554 -13.448 8.366 1141 HA LYS 151 HA LYS 151 14.039 -15.214 6.250 1142 HB2 LYS 151 2HB LYS 151 16.467 -14.981 5.849 1143 HB3 LYS 151 1HB LYS 151 16.780 -15.549 7.483 1144 HG2 LYS 151 2HG LYS 151 15.633 -17.680 6.881 1145 HG3 LYS 151 1HG LYS 151 15.553 -17.100 5.217 1146 HD2 LYS 151 2HD LYS 151 17.689 -17.633 4.837 1147 HD3 LYS 151 1HD LYS 151 18.223 -16.850 6.325 1148 HE2 LYS 151 2HE LYS 151 16.904 -19.161 7.158 1149 HE3 LYS 151 1HE LYS 151 17.838 -19.657 5.746 1150 HZ1 LYS 151 3HZ LYS 151 18.944 -18.210 8.093 1151 HZ2 LYS 151 1HZ LYS 151 19.822 -18.782 6.765 1152 HZ3 LYS 151 2HZ LYS 151 19.085 -19.874 7.827 1153 H HIS 152 H HIS 152 13.550 -17.362 6.970 1154 HA HIS 152 HA HIS 152 13.489 -17.709 9.887 1155 HB2 HIS 152 2HB HIS 152 11.174 -18.111 7.985 1156 HB3 HIS 152 1HB HIS 152 11.190 -18.683 9.650 1157 HD1 HIS 152 1HD HIS 152 11.235 -16.804 11.524 1158 HD2 HIS 152 2HD HIS 152 10.519 -15.461 7.658 1159 HE1 HIS 152 1HE HIS 152 10.314 -14.479 11.781 1160 HE2 HIS 152 2HE HIS 152 9.801 -13.722 9.433 1161 H LEU 153 H LEU 153 12.761 -20.044 10.413 1162 HA LEU 153 HA LEU 153 14.627 -21.806 9.198 1163 HB2 LEU 153 2HB LEU 153 13.756 -21.863 11.589 1164 HB3 LEU 153 1HB LEU 153 12.307 -22.612 10.942 1165 HG LEU 153 HG LEU 153 14.173 -24.253 9.890 1166 HD11 LEU 153 1HD1 LEU 153 15.807 -22.759 11.360 1167 HD12 LEU 153 2HD1 LEU 153 16.065 -24.486 11.121 1168 HD13 LEU 153 3HD1 LEU 153 15.310 -23.906 12.603 1169 HD21 LEU 153 3HD2 LEU 153 12.603 -24.287 12.417 1170 HD22 LEU 153 1HD2 LEU 153 13.770 -25.578 12.132 1171 HD23 LEU 153 2HD2 LEU 153 12.460 -25.303 10.982 1172 H GLU 154 H GLU 154 11.087 -21.571 9.074 1173 HA GLU 154 HA GLU 154 11.145 -23.003 6.523 1174 HB2 GLU 154 2HB GLU 154 10.112 -24.073 8.992 1175 HB3 GLU 154 1HB GLU 154 8.806 -23.888 7.830 1176 HG2 GLU 154 2HG GLU 154 9.630 -25.475 6.439 1177 HG3 GLU 154 1HG GLU 154 11.308 -25.128 6.856 1178 H ASP 155 H ASP 155 10.561 -21.259 5.323 1179 HA ASP 155 HA ASP 155 7.813 -20.452 5.414 1180 HB2 ASP 155 2HB ASP 155 9.933 -18.689 6.504 1181 HB3 ASP 155 1HB ASP 155 8.759 -17.926 5.436 1182 H GLU 156 H GLU 156 11.023 -19.524 4.189 1183 HA GLU 156 HA GLU 156 9.832 -19.322 1.501 1184 HB2 GLU 156 2HB GLU 156 11.306 -17.393 2.976 1185 HB3 GLU 156 1HB GLU 156 12.329 -17.925 1.636 1186 HG2 GLU 156 2HG GLU 156 9.494 -16.962 1.329 1187 HG3 GLU 156 1HG GLU 156 10.919 -15.944 1.134 1188 H LEU 157 H LEU 157 10.558 -20.726 0.049 1189 HA LEU 157 HA LEU 157 11.796 -22.333 -0.974 1190 HB2 LEU 157 2HB LEU 157 14.063 -20.888 0.399 1191 HB3 LEU 157 1HB LEU 157 14.270 -22.123 -0.830 1192 HG LEU 157 HG LEU 157 12.547 -20.245 -1.988 1193 HD11 LEU 157 1HD1 LEU 157 14.121 -18.211 -1.794 1194 HD12 LEU 157 2HD1 LEU 157 14.639 -18.954 -0.280 1195 HD13 LEU 157 3HD1 LEU 157 12.948 -18.504 -0.509 1196 HD21 LEU 157 3HD2 LEU 157 14.003 -21.137 -3.474 1197 HD22 LEU 157 1HD2 LEU 157 15.336 -21.166 -2.322 1198 HD23 LEU 157 2HD2 LEU 157 14.897 -19.659 -3.123 Start of MODEL 28 1 H1 MET 1 1HT MET 1 -22.204 -23.843 -19.559 2 H2 MET 1 2HT MET 1 -22.716 -23.906 -21.196 3 H3 MET 1 3HT MET 1 -22.491 -22.390 -20.422 4 HA MET 1 HA MET 1 -20.724 -23.122 -21.987 5 HB2 MET 1 2HB MET 1 -20.679 -21.448 -19.980 6 HB3 MET 1 1HB MET 1 -19.698 -22.680 -19.200 7 HG2 MET 1 2HG MET 1 -18.655 -22.285 -21.797 8 HG3 MET 1 1HG MET 1 -18.923 -20.697 -21.085 9 HE1 MET 1 2HE MET 1 -17.340 -21.192 -17.636 10 HE2 MET 1 3HE MET 1 -18.593 -20.428 -18.613 11 HE3 MET 1 1HE MET 1 -16.923 -19.879 -18.737 12 H HIS 2 H HIS 2 -19.839 -24.951 -22.682 13 HA HIS 2 HA HIS 2 -18.364 -26.649 -20.889 14 HB2 HIS 2 2HB HIS 2 -19.605 -28.727 -21.578 15 HB3 HIS 2 1HB HIS 2 -20.506 -27.653 -20.513 16 HD1 HIS 2 1HD HIS 2 -20.176 -28.092 -24.288 17 HD2 HIS 2 2HD HIS 2 -23.040 -27.350 -21.372 18 HE1 HIS 2 1HE HIS 2 -22.365 -27.949 -25.517 19 HE2 HIS 2 2HE HIS 2 -24.095 -27.592 -23.722 20 H HIS 3 H HIS 3 -17.862 -25.008 -23.233 21 HA HIS 3 HA HIS 3 -16.511 -27.032 -24.840 22 HB2 HIS 3 2HB HIS 3 -18.818 -25.548 -25.743 23 HB3 HIS 3 1HB HIS 3 -17.414 -25.157 -26.730 24 HD1 HIS 3 1HD HIS 3 -16.139 -27.365 -27.731 25 HD2 HIS 3 2HD HIS 3 -20.066 -27.846 -26.460 26 HE1 HIS 3 1HE HIS 3 -16.941 -29.487 -28.815 27 HE2 HIS 3 2HE HIS 3 -19.291 -29.803 -27.963 28 H HIS 4 H HIS 4 -17.092 -23.550 -24.413 29 HA HIS 4 HA HIS 4 -14.449 -22.902 -25.401 30 HB2 HIS 4 2HB HIS 4 -16.839 -21.337 -24.521 31 HB3 HIS 4 1HB HIS 4 -15.267 -20.543 -24.533 32 HD1 HIS 4 1HD HIS 4 -17.909 -21.900 -26.785 33 HD2 HIS 4 2HD HIS 4 -14.175 -20.098 -27.091 34 HE1 HIS 4 1HE HIS 4 -17.669 -21.256 -29.204 35 HE2 HIS 4 2HE HIS 4 -15.378 -20.220 -29.378 36 H HIS 5 H HIS 5 -13.396 -21.016 -23.936 37 HA HIS 5 HA HIS 5 -13.299 -21.959 -21.157 38 HB2 HIS 5 2HB HIS 5 -10.805 -21.706 -21.221 39 HB3 HIS 5 1HB HIS 5 -11.420 -23.032 -22.202 40 HD1 HIS 5 1HD HIS 5 -10.331 -19.418 -22.679 41 HD2 HIS 5 2HD HIS 5 -10.474 -23.022 -24.740 42 HE1 HIS 5 1HE HIS 5 -9.178 -18.984 -24.871 43 HE2 HIS 5 2HE HIS 5 -9.366 -21.152 -26.141 44 H HIS 6 H HIS 6 -11.696 -20.358 -19.923 45 HA HIS 6 HA HIS 6 -11.433 -18.276 -19.049 46 HB2 HIS 6 2HB HIS 6 -11.364 -17.840 -21.980 47 HB3 HIS 6 1HB HIS 6 -11.620 -16.410 -20.987 48 HD1 HIS 6 1HD HIS 6 -8.981 -17.947 -22.594 49 HD2 HIS 6 2HD HIS 6 -9.502 -16.671 -18.675 50 HE1 HIS 6 1HE HIS 6 -6.661 -17.658 -21.666 51 HE2 HIS 6 2HE HIS 6 -7.003 -16.969 -19.267 52 H HIS 7 H HIS 7 -12.527 -15.923 -19.169 53 HA HIS 7 HA HIS 7 -14.381 -14.701 -18.681 54 HB2 HIS 7 2HB HIS 7 -14.833 -15.487 -21.132 55 HB3 HIS 7 1HB HIS 7 -16.049 -16.517 -20.388 56 HD1 HIS 7 1HD HIS 7 -17.581 -14.907 -18.551 57 HD2 HIS 7 2HD HIS 7 -15.975 -13.205 -21.985 58 HE1 HIS 7 1HE HIS 7 -18.937 -12.832 -18.971 59 HE2 HIS 7 2HE HIS 7 -17.892 -11.772 -21.004 60 H MET 8 H MET 8 -14.616 -15.192 -16.530 61 HA MET 8 HA MET 8 -16.743 -17.115 -15.908 62 HB2 MET 8 2HB MET 8 -13.955 -17.087 -14.866 63 HB3 MET 8 1HB MET 8 -15.246 -17.449 -13.715 64 HG2 MET 8 2HG MET 8 -15.855 -19.392 -14.819 65 HG3 MET 8 1HG MET 8 -15.085 -18.899 -16.325 66 HE1 MET 8 3HE MET 8 -11.867 -19.788 -16.508 67 HE2 MET 8 1HE MET 8 -11.517 -18.606 -15.248 68 HE3 MET 8 2HE MET 8 -12.769 -18.275 -16.444 69 H SER 9 H SER 9 -14.628 -14.652 -14.427 70 HA SER 9 HA SER 9 -16.966 -13.669 -12.931 71 HB2 SER 9 2HB SER 9 -14.008 -13.392 -12.355 72 HB3 SER 9 1HB SER 9 -15.277 -12.596 -11.425 73 HG SER 9 HG SER 9 -14.544 -14.627 -10.539 74 H ASP 10 H ASP 10 -17.185 -11.354 -12.658 75 HA ASP 10 HA ASP 10 -15.718 -9.637 -14.475 76 HB2 ASP 10 2HB ASP 10 -17.769 -8.787 -15.573 77 HB3 ASP 10 1HB ASP 10 -17.464 -10.483 -15.942 78 H GLY 11 H GLY 11 -15.871 -7.443 -13.968 79 HA2 GLY 11 2HA GLY 11 -17.675 -6.149 -12.358 80 HA3 GLY 11 1HA GLY 11 -16.542 -6.890 -11.238 81 H HIS 12 H HIS 12 -17.131 -4.283 -13.351 82 HA HIS 12 HA HIS 12 -14.361 -3.336 -13.020 83 HB2 HIS 12 2HB HIS 12 -15.801 -3.604 -15.360 84 HB3 HIS 12 1HB HIS 12 -15.999 -1.888 -14.973 85 HD1 HIS 12 1HD HIS 12 -13.087 -4.355 -15.101 86 HD2 HIS 12 2HD HIS 12 -14.012 -0.413 -16.035 87 HE1 HIS 12 1HE HIS 12 -10.999 -3.399 -16.125 88 HE2 HIS 12 2HE HIS 12 -11.556 -0.990 -16.607 89 H ASN 13 H ASN 13 -13.994 -1.230 -12.317 90 HA ASN 13 HA ASN 13 -16.061 0.647 -11.827 91 HB2 ASN 13 2HB ASN 13 -15.939 -1.358 -9.909 92 HB3 ASN 13 1HB ASN 13 -15.042 -0.029 -9.181 93 HD21 ASN 13 1HD2 ASN 13 -16.389 0.819 -7.749 94 HD22 ASN 13 2HD2 ASN 13 -18.000 1.350 -8.077 95 H GLY 14 H GLY 14 -15.027 2.495 -12.173 96 HA2 GLY 14 2HA GLY 14 -12.240 2.806 -12.136 97 HA3 GLY 14 1HA GLY 14 -13.414 4.126 -12.145 98 H LEU 15 H LEU 15 -10.896 2.835 -10.474 99 HA LEU 15 HA LEU 15 -11.610 4.345 -8.084 100 HB2 LEU 15 2HB LEU 15 -11.152 1.418 -8.204 101 HB3 LEU 15 1HB LEU 15 -10.444 2.279 -6.852 102 HG LEU 15 HG LEU 15 -13.297 2.840 -7.393 103 HD11 LEU 15 1HD1 LEU 15 -13.755 0.638 -7.614 104 HD12 LEU 15 2HD1 LEU 15 -13.626 0.674 -5.856 105 HD13 LEU 15 3HD1 LEU 15 -12.259 0.134 -6.830 106 HD21 LEU 15 3HD2 LEU 15 -13.397 2.827 -4.963 107 HD22 LEU 15 1HD2 LEU 15 -12.075 3.850 -5.523 108 HD23 LEU 15 2HD2 LEU 15 -11.735 2.242 -4.883 109 H GLY 16 H GLY 16 -9.532 3.985 -6.485 110 HA2 GLY 16 2HA GLY 16 -7.238 4.201 -6.201 111 HA3 GLY 16 1HA GLY 16 -7.014 4.019 -7.931 112 H LYS 17 H LYS 17 -9.331 6.245 -7.857 113 HA LYS 17 HA LYS 17 -9.476 8.510 -7.939 114 HB2 LYS 17 2HB LYS 17 -8.044 8.280 -5.768 115 HB3 LYS 17 1HB LYS 17 -6.724 8.824 -6.792 116 HG2 LYS 17 2HG LYS 17 -7.773 10.659 -5.549 117 HG3 LYS 17 1HG LYS 17 -7.906 10.868 -7.297 118 HD2 LYS 17 2HD LYS 17 -10.140 9.438 -6.017 119 HD3 LYS 17 1HD LYS 17 -9.973 11.136 -5.569 120 HE2 LYS 17 2HE LYS 17 -9.675 10.655 -8.433 121 HE3 LYS 17 1HE LYS 17 -11.252 10.179 -7.805 122 HZ1 LYS 17 3HZ LYS 17 -10.952 12.555 -6.648 123 HZ2 LYS 17 1HZ LYS 17 -11.709 12.339 -8.145 124 HZ3 LYS 17 2HZ LYS 17 -10.088 12.823 -8.077 125 H GLY 18 H GLY 18 -8.648 7.099 -10.168 126 HA2 GLY 18 2HA GLY 18 -8.061 7.997 -12.295 127 HA3 GLY 18 1HA GLY 18 -6.990 9.141 -11.480 128 H PHE 19 H PHE 19 -6.275 6.520 -9.867 129 HA PHE 19 HA PHE 19 -3.763 6.092 -10.787 130 HB2 PHE 19 2HB PHE 19 -5.525 4.830 -8.957 131 HB3 PHE 19 1HB PHE 19 -4.732 3.566 -9.910 132 HD1 PHE 19 1HD PHE 19 -2.135 4.481 -10.415 133 HD2 PHE 19 2HD PHE 19 -4.484 5.063 -6.928 134 HE1 PHE 19 1HE PHE 19 -0.077 4.749 -9.087 135 HE2 PHE 19 2HE PHE 19 -2.446 5.349 -5.593 136 HZ PHE 19 HZ PHE 19 -0.231 5.187 -6.669 137 H GLY 20 H GLY 20 -6.127 3.523 -11.316 138 HA2 GLY 20 2HA GLY 20 -5.445 3.419 -14.148 139 HA3 GLY 20 1HA GLY 20 -4.925 2.040 -13.176 140 H ASP 21 H ASP 21 -6.905 1.510 -11.509 141 HA ASP 21 HA ASP 21 -9.493 1.601 -12.719 142 HB2 ASP 21 2HB ASP 21 -7.823 -0.883 -12.939 143 HB3 ASP 21 1HB ASP 21 -9.580 -1.015 -12.778 144 H HIS 22 H HIS 22 -8.811 -1.320 -10.987 145 HA HIS 22 HA HIS 22 -9.965 -0.114 -8.559 146 HB2 HIS 22 2HB HIS 22 -10.713 -2.571 -8.159 147 HB3 HIS 22 1HB HIS 22 -11.594 -1.588 -9.312 148 HD1 HIS 22 1HD HIS 22 -12.008 -2.685 -11.481 149 HD2 HIS 22 2HD HIS 22 -8.644 -4.233 -9.595 150 HE1 HIS 22 1HE HIS 22 -11.198 -4.544 -12.969 151 HE2 HIS 22 2HE HIS 22 -9.118 -5.416 -11.845 152 H ILE 23 H ILE 23 -7.700 -2.463 -9.795 153 HA ILE 23 HA ILE 23 -6.306 -3.892 -8.444 154 HB ILE 23 HB ILE 23 -5.107 -1.196 -9.031 155 HG12 ILE 23 2HG1 ILE 23 -4.210 -2.875 -10.952 156 HG13 ILE 23 1HG1 ILE 23 -5.785 -3.590 -10.621 157 HG21 ILE 23 1HG2 ILE 23 -3.176 -3.229 -9.279 158 HG22 ILE 23 2HG2 ILE 23 -3.922 -3.400 -7.689 159 HG23 ILE 23 3HG2 ILE 23 -3.202 -1.862 -8.168 160 HD11 ILE 23 3HD1 ILE 23 -5.411 -1.659 -12.410 161 HD12 ILE 23 1HD1 ILE 23 -5.705 -0.663 -10.985 162 HD13 ILE 23 2HD1 ILE 23 -6.909 -1.843 -11.499 163 H HIS 24 H HIS 24 -4.695 -1.153 -7.123 164 HA HIS 24 HA HIS 24 -4.933 -2.270 -4.479 165 HB2 HIS 24 2HB HIS 24 -3.353 0.187 -5.137 166 HB3 HIS 24 1HB HIS 24 -3.061 -1.020 -3.885 167 HD1 HIS 24 1HD HIS 24 -2.980 -3.584 -5.477 168 HD2 HIS 24 2HD HIS 24 -1.214 -0.055 -6.780 169 HE1 HIS 24 1HE HIS 24 -1.180 -4.287 -7.086 170 HE2 HIS 24 2HE HIS 24 -0.056 -2.142 -7.777 171 H TRP 25 H TRP 25 -7.288 -0.960 -5.559 172 HA TRP 25 HA TRP 25 -7.758 0.890 -3.358 173 HB2 TRP 25 2HB TRP 25 -9.074 2.175 -5.414 174 HB3 TRP 25 1HB TRP 25 -7.538 2.679 -4.705 175 HD1 TRP 25 HD TRP 25 -9.037 1.309 -7.852 176 HE1 TRP 25 1HE TRP 25 -7.212 1.060 -9.612 177 HE3 TRP 25 3HE TRP 25 -4.979 2.164 -4.925 178 HZ2 TRP 25 2HZ TRP 25 -4.384 1.243 -9.779 179 HZ3 TRP 25 3HZ TRP 25 -2.751 2.127 -5.932 180 HH2 TRP 25 HH TRP 25 -2.450 1.672 -8.320 181 H ARG 26 H ARG 26 -8.791 -1.669 -5.276 182 HA ARG 26 HA ARG 26 -11.408 -1.373 -5.799 183 HB2 ARG 26 2HB ARG 26 -10.469 -3.741 -4.195 184 HB3 ARG 26 1HB ARG 26 -11.836 -3.686 -5.300 185 HG2 ARG 26 2HG ARG 26 -9.644 -2.948 -6.840 186 HG3 ARG 26 1HG ARG 26 -9.063 -4.268 -5.836 187 HD2 ARG 26 2HD ARG 26 -11.718 -4.546 -7.130 188 HD3 ARG 26 1HD ARG 26 -10.276 -4.716 -8.138 189 HE ARG 26 HE ARG 26 -9.602 -6.470 -6.460 190 HH11 ARG 26 1HH1 ARG 26 -12.960 -5.750 -7.118 191 HH12 ARG 26 2HH1 ARG 26 -13.509 -7.323 -6.659 192 HH21 ARG 26 1HH2 ARG 26 -10.334 -8.536 -5.861 193 HH22 ARG 26 2HH2 ARG 26 -12.025 -8.903 -5.948 194 H THR 27 H THR 27 -10.080 -1.935 -2.547 195 HA THR 27 HA THR 27 -11.797 -0.308 -1.148 196 HB THR 27 HB THR 27 -13.079 -2.495 -0.108 197 HG1 THR 27 1HG THR 27 -13.519 -2.883 -2.826 198 HG21 THR 27 3HG2 THR 27 -14.898 -1.685 -1.964 199 HG22 THR 27 1HG2 THR 27 -13.842 -0.279 -1.839 200 HG23 THR 27 2HG2 THR 27 -14.626 -0.924 -0.398 201 H LEU 28 H LEU 28 -10.978 -0.062 0.842 202 HA LEU 28 HA LEU 28 -8.690 -1.472 1.649 203 HB2 LEU 28 2HB LEU 28 -9.330 0.855 2.334 204 HB3 LEU 28 1HB LEU 28 -10.523 0.144 3.422 205 HG LEU 28 HG LEU 28 -7.654 -0.674 3.660 206 HD11 LEU 28 1HD1 LEU 28 -7.780 1.263 5.507 207 HD12 LEU 28 2HD1 LEU 28 -8.779 1.990 4.248 208 HD13 LEU 28 3HD1 LEU 28 -7.122 1.508 3.889 209 HD21 LEU 28 3HD2 LEU 28 -9.122 -0.205 6.091 210 HD22 LEU 28 1HD2 LEU 28 -8.388 -1.692 5.491 211 HD23 LEU 28 2HD2 LEU 28 -10.030 -1.264 5.012 212 H GLU 29 H GLU 29 -11.898 -1.446 3.216 213 HA GLU 29 HA GLU 29 -11.444 -3.502 5.016 214 HB2 GLU 29 2HB GLU 29 -13.421 -2.008 5.036 215 HB3 GLU 29 1HB GLU 29 -14.057 -2.863 3.637 216 HG2 GLU 29 2HG GLU 29 -13.778 -4.957 5.193 217 HG3 GLU 29 1HG GLU 29 -13.851 -3.742 6.468 218 H ASP 30 H ASP 30 -12.971 -3.751 1.802 219 HA ASP 30 HA ASP 30 -13.278 -6.530 1.793 220 HB2 ASP 30 2HB ASP 30 -14.155 -4.673 0.149 221 HB3 ASP 30 1HB ASP 30 -12.677 -5.056 -0.748 222 H GLY 31 H GLY 31 -10.491 -4.535 1.220 223 HA2 GLY 31 2HA GLY 31 -8.909 -6.360 -0.229 224 HA3 GLY 31 1HA GLY 31 -8.299 -5.035 0.766 225 H LYS 32 H LYS 32 -9.101 -5.757 3.274 226 HA LYS 32 HA LYS 32 -7.137 -7.588 4.051 227 HB2 LYS 32 2HB LYS 32 -8.108 -5.870 5.540 228 HB3 LYS 32 1HB LYS 32 -9.617 -6.772 5.576 229 HG2 LYS 32 2HG LYS 32 -8.636 -8.557 6.771 230 HG3 LYS 32 1HG LYS 32 -7.005 -7.946 6.482 231 HD2 LYS 32 2HD LYS 32 -7.237 -7.105 8.564 232 HD3 LYS 32 1HD LYS 32 -8.107 -5.819 7.726 233 HE2 LYS 32 2HE LYS 32 -10.217 -6.841 8.215 234 HE3 LYS 32 1HE LYS 32 -9.428 -8.280 8.856 235 HZ1 LYS 32 3HZ LYS 32 -9.862 -5.693 10.101 236 HZ2 LYS 32 1HZ LYS 32 -8.358 -6.408 10.406 237 HZ3 LYS 32 2HZ LYS 32 -9.782 -7.231 10.799 238 H LYS 33 H LYS 33 -10.655 -8.014 3.761 239 HA LYS 33 HA LYS 33 -10.771 -10.679 4.594 240 HB2 LYS 33 2HB LYS 33 -12.758 -9.268 4.362 241 HB3 LYS 33 1HB LYS 33 -12.541 -9.232 2.617 242 HG2 LYS 33 2HG LYS 33 -12.611 -11.917 3.130 243 HG3 LYS 33 1HG LYS 33 -13.750 -11.269 4.324 244 HD2 LYS 33 2HD LYS 33 -15.273 -10.787 2.757 245 HD3 LYS 33 1HD LYS 33 -14.068 -10.076 1.680 246 HE2 LYS 33 2HE LYS 33 -13.931 -12.999 1.932 247 HE3 LYS 33 1HE LYS 33 -15.411 -12.389 1.194 248 HZ1 LYS 33 3HZ LYS 33 -13.668 -10.963 -0.148 249 HZ2 LYS 33 1HZ LYS 33 -14.099 -12.526 -0.634 250 HZ3 LYS 33 2HZ LYS 33 -12.660 -12.271 0.217 251 H GLU 34 H GLU 34 -10.144 -9.278 1.422 252 HA GLU 34 HA GLU 34 -10.192 -11.765 0.023 253 HB2 GLU 34 2HB GLU 34 -10.504 -9.407 -0.939 254 HB3 GLU 34 1HB GLU 34 -8.745 -9.286 -0.892 255 HG2 GLU 34 2HG GLU 34 -8.538 -10.451 -2.763 256 HG3 GLU 34 1HG GLU 34 -9.573 -11.748 -2.142 257 H ALA 35 H ALA 35 -7.678 -9.819 1.537 258 HA ALA 35 HA ALA 35 -5.425 -11.109 0.519 259 HB1 ALA 35 1HB ALA 35 -4.878 -9.196 1.652 260 HB2 ALA 35 2HB ALA 35 -4.463 -10.408 2.866 261 HB3 ALA 35 3HB ALA 35 -5.990 -9.531 2.979 262 H ALA 36 H ALA 36 -7.669 -12.072 3.006 263 HA ALA 36 HA ALA 36 -6.083 -14.042 4.261 264 HB1 ALA 36 1HB ALA 36 -7.991 -13.297 5.428 265 HB2 ALA 36 2HB ALA 36 -8.332 -14.969 4.981 266 HB3 ALA 36 3HB ALA 36 -9.056 -13.645 4.067 267 H ALA 37 H ALA 37 -8.552 -14.303 1.705 268 HA ALA 37 HA ALA 37 -8.427 -17.054 1.318 269 HB1 ALA 37 1HB ALA 37 -9.863 -15.032 0.219 270 HB2 ALA 37 2HB ALA 37 -9.854 -16.692 -0.378 271 HB3 ALA 37 3HB ALA 37 -8.817 -15.479 -1.128 272 H SER 38 H SER 38 -6.992 -14.701 -0.941 273 HA SER 38 HA SER 38 -5.275 -16.582 -2.141 274 HB2 SER 38 2HB SER 38 -5.218 -13.558 -2.087 275 HB3 SER 38 1HB SER 38 -4.103 -14.533 -3.059 276 HG SER 38 HG SER 38 -6.940 -14.503 -3.238 277 H GLY 39 H GLY 39 -4.928 -14.538 0.661 278 HA2 GLY 39 2HA GLY 39 -3.376 -14.700 2.372 279 HA3 GLY 39 1HA GLY 39 -2.559 -15.974 1.462 280 H LEU 40 H LEU 40 -3.270 -12.798 0.148 281 HA LEU 40 HA LEU 40 -0.374 -12.293 0.037 282 HB2 LEU 40 2HB LEU 40 -0.952 -10.722 -1.830 283 HB3 LEU 40 1HB LEU 40 -1.246 -12.415 -2.164 284 HG LEU 40 HG LEU 40 -3.676 -11.975 -1.573 285 HD11 LEU 40 1HD1 LEU 40 -3.945 -9.329 -2.221 286 HD12 LEU 40 2HD1 LEU 40 -2.549 -9.333 -1.145 287 HD13 LEU 40 3HD1 LEU 40 -4.081 -10.015 -0.601 288 HD21 LEU 40 3HD2 LEU 40 -4.199 -11.143 -3.767 289 HD22 LEU 40 1HD2 LEU 40 -2.817 -12.234 -3.874 290 HD23 LEU 40 2HD2 LEU 40 -2.571 -10.487 -3.943 291 HA PRO 41 HA PRO 41 -0.727 -8.881 2.805 292 HB2 PRO 41 2HB PRO 41 1.118 -7.173 1.679 293 HB3 PRO 41 1HB PRO 41 1.529 -8.535 2.726 294 HG2 PRO 41 2HG PRO 41 1.563 -8.364 -0.259 295 HG3 PRO 41 1HG PRO 41 2.734 -9.125 0.834 296 HD2 PRO 41 2HD PRO 41 0.931 -10.579 -0.518 297 HD3 PRO 41 1HD PRO 41 1.413 -11.008 1.138 298 H LEU 42 H LEU 42 -1.153 -6.487 2.816 299 HA LEU 42 HA LEU 42 -2.972 -5.879 0.619 300 HB2 LEU 42 2HB LEU 42 -3.156 -3.832 2.538 301 HB3 LEU 42 1HB LEU 42 -4.316 -5.094 2.192 302 HG LEU 42 HG LEU 42 -2.096 -5.291 4.223 303 HD11 LEU 42 1HD1 LEU 42 -3.741 -3.709 4.962 304 HD12 LEU 42 2HD1 LEU 42 -3.964 -5.214 5.854 305 HD13 LEU 42 3HD1 LEU 42 -5.053 -4.805 4.528 306 HD21 LEU 42 3HD2 LEU 42 -4.250 -7.165 4.526 307 HD22 LEU 42 1HD2 LEU 42 -2.521 -7.457 4.360 308 HD23 LEU 42 2HD2 LEU 42 -3.530 -7.314 2.922 309 H MET 43 H MET 43 -3.099 -3.673 -0.158 310 HA MET 43 HA MET 43 -0.421 -2.495 -0.402 311 HB2 MET 43 2HB MET 43 -1.343 -3.486 -2.470 312 HB3 MET 43 1HB MET 43 -2.719 -2.376 -2.384 313 HG2 MET 43 2HG MET 43 -1.107 -1.523 -3.945 314 HG3 MET 43 1HG MET 43 -1.108 -0.488 -2.523 315 HE1 MET 43 3HE MET 43 2.092 -0.171 -1.333 316 HE2 MET 43 1HE MET 43 1.444 -1.528 -0.411 317 HE3 MET 43 2HE MET 43 0.373 -0.232 -0.943 318 H VAL 44 H VAL 44 -0.522 -1.042 1.250 319 HA VAL 44 HA VAL 44 -2.774 0.712 1.591 320 HB VAL 44 HB VAL 44 -0.058 0.899 2.893 321 HG11 VAL 44 1HG1 VAL 44 -2.077 2.732 2.902 322 HG12 VAL 44 2HG1 VAL 44 -0.869 2.550 4.177 323 HG13 VAL 44 3HG1 VAL 44 -2.448 1.779 4.341 324 HG21 VAL 44 3HG2 VAL 44 -1.996 -0.153 4.661 325 HG22 VAL 44 1HG2 VAL 44 -0.545 -0.937 4.036 326 HG23 VAL 44 2HG2 VAL 44 -2.075 -1.097 3.173 327 H ILE 45 H ILE 45 -2.261 1.226 -0.866 328 HA ILE 45 HA ILE 45 -0.259 3.220 -1.320 329 HB ILE 45 HB ILE 45 -0.760 2.147 -3.294 330 HG12 ILE 45 2HG1 ILE 45 -2.420 3.689 -4.629 331 HG13 ILE 45 1HG1 ILE 45 -2.299 4.708 -3.191 332 HG21 ILE 45 1HG2 ILE 45 -3.544 2.035 -2.282 333 HG22 ILE 45 2HG2 ILE 45 -2.514 0.751 -2.909 334 HG23 ILE 45 3HG2 ILE 45 -3.262 1.898 -4.018 335 HD11 ILE 45 3HD1 ILE 45 0.141 4.719 -3.462 336 HD12 ILE 45 1HD1 ILE 45 -0.711 5.437 -4.821 337 HD13 ILE 45 2HD1 ILE 45 -0.044 3.809 -4.960 338 H ILE 46 H ILE 46 -0.406 5.115 -0.282 339 HA ILE 46 HA ILE 46 -3.046 6.430 -0.219 340 HB ILE 46 HB ILE 46 -0.924 7.062 1.786 341 HG12 ILE 46 2HG1 ILE 46 -2.942 5.144 2.697 342 HG13 ILE 46 1HG1 ILE 46 -1.821 4.480 1.509 343 HG21 ILE 46 1HG2 ILE 46 -2.996 8.444 1.499 344 HG22 ILE 46 2HG2 ILE 46 -2.734 7.807 3.123 345 HG23 ILE 46 3HG2 ILE 46 -3.916 7.048 2.059 346 HD11 ILE 46 3HD1 ILE 46 -1.346 4.464 4.128 347 HD12 ILE 46 1HD1 ILE 46 -0.668 6.044 3.740 348 HD13 ILE 46 2HD1 ILE 46 -0.057 4.599 2.932 349 H HIS 47 H HIS 47 -3.113 8.672 -0.527 350 HA HIS 47 HA HIS 47 -0.599 9.974 -1.286 351 HB2 HIS 47 2HB HIS 47 -1.803 10.879 -3.373 352 HB3 HIS 47 1HB HIS 47 -1.204 9.214 -3.418 353 HD1 HIS 47 1HD HIS 47 -3.985 11.006 -4.492 354 HD2 HIS 47 2HD HIS 47 -3.552 7.449 -2.374 355 HE1 HIS 47 1HE HIS 47 -6.163 9.781 -4.785 356 HE2 HIS 47 2HE HIS 47 -5.917 7.688 -3.405 357 H LYS 48 H LYS 48 -0.528 11.722 -0.070 358 HA LYS 48 HA LYS 48 -2.883 13.485 -0.035 359 HB2 LYS 48 2HB LYS 48 -1.544 12.247 2.282 360 HB3 LYS 48 1HB LYS 48 -1.863 13.968 2.434 361 HG2 LYS 48 2HG LYS 48 -4.236 13.541 1.912 362 HG3 LYS 48 1HG LYS 48 -3.886 11.811 1.869 363 HD2 LYS 48 2HD LYS 48 -4.398 11.828 4.049 364 HD3 LYS 48 1HD LYS 48 -2.818 12.576 4.278 365 HE2 LYS 48 2HE LYS 48 -4.699 14.589 3.534 366 HE3 LYS 48 1HE LYS 48 -5.366 13.646 4.866 367 HZ1 LYS 48 3HZ LYS 48 -3.913 15.643 5.429 368 HZ2 LYS 48 1HZ LYS 48 -2.602 14.682 4.961 369 HZ3 LYS 48 2HZ LYS 48 -3.593 14.195 6.242 370 H SER 49 H SER 49 -2.203 15.706 0.955 371 HA SER 49 HA SER 49 -0.947 17.601 0.777 372 HB2 SER 49 2HB SER 49 0.739 16.105 1.989 373 HB3 SER 49 1HB SER 49 1.483 15.842 0.412 374 HG SER 49 HG SER 49 1.111 18.340 1.711 375 H TRP 50 H TRP 50 1.472 17.938 -0.852 376 HA TRP 50 HA TRP 50 0.441 18.743 -3.257 377 HB2 TRP 50 2HB TRP 50 3.203 17.544 -3.159 378 HB3 TRP 50 1HB TRP 50 2.640 18.958 -4.063 379 HD1 TRP 50 HD TRP 50 5.047 18.555 -1.668 380 HE1 TRP 50 1HE TRP 50 5.129 20.405 0.119 381 HE3 TRP 50 3HE TRP 50 0.372 20.521 -2.318 382 HZ2 TRP 50 2HZ TRP 50 3.437 22.429 1.121 383 HZ3 TRP 50 3HZ TRP 50 -0.318 22.414 -0.905 384 HH2 TRP 50 HH TRP 50 1.184 23.346 0.779 385 H CYS 51 H CYS 51 2.257 15.719 -2.804 386 HA CYS 51 HA CYS 51 2.149 13.698 -3.819 387 HB2 CYS 51 2HB CYS 51 -0.044 13.494 -2.962 388 HB3 CYS 51 1HB CYS 51 -0.694 14.642 -4.125 389 H GLY 52 H GLY 52 3.174 13.197 -5.605 390 HA2 GLY 52 2HA GLY 52 2.432 14.565 -8.122 391 HA3 GLY 52 1HA GLY 52 4.042 13.922 -7.775 392 H ALA 53 H ALA 53 2.924 11.520 -6.508 393 HA ALA 53 HA ALA 53 2.922 9.798 -8.707 394 HB1 ALA 53 1HB ALA 53 2.397 8.049 -7.185 395 HB2 ALA 53 2HB ALA 53 1.704 9.187 -6.029 396 HB3 ALA 53 3HB ALA 53 3.442 9.182 -6.327 397 H CYS 54 H CYS 54 0.462 11.775 -7.467 398 HA CYS 54 HA CYS 54 -1.658 10.151 -8.449 399 HB2 CYS 54 2HB CYS 54 -2.912 12.510 -8.161 400 HB3 CYS 54 1HB CYS 54 -2.599 11.422 -6.806 401 H LYS 55 H LYS 55 0.169 12.907 -9.593 402 HA LYS 55 HA LYS 55 -1.427 13.174 -11.983 403 HB2 LYS 55 2HB LYS 55 0.383 14.776 -12.670 404 HB3 LYS 55 1HB LYS 55 -0.410 15.181 -11.154 405 HG2 LYS 55 2HG LYS 55 1.434 14.481 -9.876 406 HG3 LYS 55 1HG LYS 55 2.169 13.652 -11.261 407 HD2 LYS 55 2HD LYS 55 2.272 15.964 -12.353 408 HD3 LYS 55 1HD LYS 55 1.937 16.607 -10.743 409 HE2 LYS 55 2HE LYS 55 4.085 14.601 -10.879 410 HE3 LYS 55 1HE LYS 55 4.420 16.118 -11.715 411 HZ1 LYS 55 3HZ LYS 55 4.174 15.584 -8.878 412 HZ2 LYS 55 1HZ LYS 55 3.425 17.007 -9.402 413 HZ3 LYS 55 2HZ LYS 55 5.076 16.767 -9.683 414 H ALA 56 H ALA 56 1.578 11.655 -10.977 415 HA ALA 56 HA ALA 56 2.379 10.923 -13.643 416 HB1 ALA 56 1HB ALA 56 3.715 11.157 -11.312 417 HB2 ALA 56 2HB ALA 56 4.303 10.237 -12.699 418 HB3 ALA 56 3HB ALA 56 3.483 9.408 -11.374 419 H LEU 57 H LEU 57 0.076 9.641 -11.465 420 HA LEU 57 HA LEU 57 0.371 6.942 -12.517 421 HB2 LEU 57 2HB LEU 57 -1.428 6.335 -10.949 422 HB3 LEU 57 1HB LEU 57 -0.046 7.070 -10.164 423 HG LEU 57 HG LEU 57 -1.361 9.238 -10.157 424 HD11 LEU 57 1HD1 LEU 57 -3.955 8.193 -10.103 425 HD12 LEU 57 2HD1 LEU 57 -3.223 7.603 -11.593 426 HD13 LEU 57 3HD1 LEU 57 -3.275 9.332 -11.265 427 HD21 LEU 57 3HD2 LEU 57 -2.421 6.898 -8.593 428 HD22 LEU 57 1HD2 LEU 57 -2.672 8.590 -8.188 429 HD23 LEU 57 2HD2 LEU 57 -1.047 7.904 -8.154 430 H LYS 58 H LYS 58 -1.909 9.626 -12.713 431 HA LYS 58 HA LYS 58 -4.102 8.420 -13.760 432 HB2 LYS 58 2HB LYS 58 -2.911 11.098 -14.064 433 HB3 LYS 58 1HB LYS 58 -4.114 10.657 -15.268 434 HG2 LYS 58 2HG LYS 58 -5.789 10.930 -13.834 435 HG3 LYS 58 1HG LYS 58 -4.974 9.990 -12.583 436 HD2 LYS 58 2HD LYS 58 -5.280 12.191 -11.725 437 HD3 LYS 58 1HD LYS 58 -3.568 12.015 -12.114 438 HE2 LYS 58 2HE LYS 58 -3.828 13.965 -13.191 439 HE3 LYS 58 1HE LYS 58 -4.558 12.979 -14.457 440 HZ1 LYS 58 3HZ LYS 58 -6.728 13.425 -13.532 441 HZ2 LYS 58 1HZ LYS 58 -5.937 14.885 -13.853 442 HZ3 LYS 58 2HZ LYS 58 -6.050 14.318 -12.265 443 HA PRO 59 HA PRO 59 -2.845 8.412 -18.317 444 HB2 PRO 59 2HB PRO 59 -0.693 9.731 -19.220 445 HB3 PRO 59 1HB PRO 59 -2.228 10.558 -18.883 446 HG2 PRO 59 2HG PRO 59 0.236 10.371 -17.180 447 HG3 PRO 59 1HG PRO 59 -0.762 11.789 -17.551 448 HD2 PRO 59 2HD PRO 59 -0.996 10.378 -15.234 449 HD3 PRO 59 1HD PRO 59 -2.360 11.233 -16.001 450 H LYS 60 H LYS 60 -0.202 8.061 -16.063 451 HA LYS 60 HA LYS 60 1.142 6.198 -17.867 452 HB2 LYS 60 2HB LYS 60 2.840 7.386 -16.954 453 HB3 LYS 60 1HB LYS 60 1.942 7.753 -15.494 454 HG2 LYS 60 2HG LYS 60 3.803 6.384 -14.911 455 HG3 LYS 60 1HG LYS 60 2.336 5.418 -14.728 456 HD2 LYS 60 2HD LYS 60 4.062 4.108 -15.815 457 HD3 LYS 60 1HD LYS 60 2.766 4.443 -16.964 458 HE2 LYS 60 2HE LYS 60 4.615 6.569 -17.158 459 HE3 LYS 60 1HE LYS 60 5.551 5.073 -17.144 460 HZ1 LYS 60 3HZ LYS 60 4.729 4.432 -19.128 461 HZ2 LYS 60 1HZ LYS 60 4.478 6.092 -19.342 462 HZ3 LYS 60 2HZ LYS 60 3.199 5.099 -18.854 463 H PHE 61 H PHE 61 0.002 6.191 -14.462 464 HA PHE 61 HA PHE 61 0.350 3.423 -14.146 465 HB2 PHE 61 2HB PHE 61 -0.013 5.192 -12.319 466 HB3 PHE 61 1HB PHE 61 -1.734 4.990 -12.656 467 HD1 PHE 61 2HD PHE 61 -2.770 2.718 -12.363 468 HD2 PHE 61 1HD PHE 61 1.160 3.643 -11.010 469 HE1 PHE 61 2HE PHE 61 -2.823 0.756 -10.878 470 HE2 PHE 61 1HE PHE 61 1.113 1.683 -9.524 471 HZ PHE 61 HZ PHE 61 -0.879 0.238 -9.456 472 H ALA 62 H ALA 62 -1.985 5.251 -15.859 473 HA ALA 62 HA ALA 62 -4.175 3.512 -15.785 474 HB1 ALA 62 1HB ALA 62 -4.063 4.456 -18.395 475 HB2 ALA 62 2HB ALA 62 -3.236 5.698 -17.448 476 HB3 ALA 62 3HB ALA 62 -4.884 5.224 -17.035 477 H GLU 63 H GLU 63 -1.023 3.240 -17.068 478 HA GLU 63 HA GLU 63 -1.422 1.177 -18.999 479 HB2 GLU 63 2HB GLU 63 0.575 2.872 -18.642 480 HB3 GLU 63 1HB GLU 63 1.173 1.615 -17.556 481 HG2 GLU 63 2HG GLU 63 1.703 0.221 -19.244 482 HG3 GLU 63 1HG GLU 63 0.320 0.702 -20.225 483 H SER 64 H SER 64 -1.447 1.283 -15.641 484 HA SER 64 HA SER 64 -0.316 -1.145 -14.909 485 HB2 SER 64 2HB SER 64 -2.468 0.559 -13.717 486 HB3 SER 64 1HB SER 64 -1.986 -0.949 -12.963 487 HG SER 64 HG SER 64 -0.375 1.322 -13.474 488 H THR 65 H THR 65 -2.622 -0.918 -17.164 489 HA THR 65 HA THR 65 -4.710 -2.581 -16.500 490 HB THR 65 HB THR 65 -3.452 -3.129 -19.130 491 HG1 THR 65 1HG THR 65 -2.886 -1.053 -19.168 492 HG21 THR 65 3HG2 THR 65 -5.802 -3.741 -18.537 493 HG22 THR 65 1HG2 THR 65 -5.624 -2.776 -20.003 494 HG23 THR 65 2HG2 THR 65 -6.171 -2.016 -18.508 495 H GLU 66 H GLU 66 -1.378 -3.335 -17.265 496 HA GLU 66 HA GLU 66 -1.767 -6.196 -17.073 497 HB2 GLU 66 2HB GLU 66 0.726 -6.281 -17.222 498 HB3 GLU 66 1HB GLU 66 -0.029 -5.427 -18.571 499 HG2 GLU 66 2HG GLU 66 0.568 -3.597 -16.452 500 HG3 GLU 66 1HG GLU 66 2.008 -4.518 -16.881 501 H ILE 67 H ILE 67 -0.811 -3.511 -15.062 502 HA ILE 67 HA ILE 67 0.186 -5.132 -12.927 503 HB ILE 67 HB ILE 67 -0.920 -2.328 -12.784 504 HG12 ILE 67 2HG1 ILE 67 1.941 -3.257 -13.112 505 HG13 ILE 67 1HG1 ILE 67 0.948 -2.554 -14.397 506 HG21 ILE 67 1HG2 ILE 67 -0.811 -3.375 -10.608 507 HG22 ILE 67 2HG2 ILE 67 0.454 -2.155 -10.748 508 HG23 ILE 67 3HG2 ILE 67 0.856 -3.863 -10.904 509 HD11 ILE 67 3HD1 ILE 67 0.989 -0.839 -12.089 510 HD12 ILE 67 1HD1 ILE 67 1.474 -0.505 -13.751 511 HD13 ILE 67 2HD1 ILE 67 2.627 -1.219 -12.624 512 H SER 68 H SER 68 -2.909 -4.519 -14.175 513 HA SER 68 HA SER 68 -4.447 -4.700 -11.795 514 HB2 SER 68 2HB SER 68 -6.329 -4.899 -13.197 515 HB3 SER 68 1HB SER 68 -5.199 -3.953 -14.166 516 HG SER 68 HG SER 68 -5.695 -5.478 -15.565 517 H GLU 69 H GLU 69 -2.951 -6.988 -13.955 518 HA GLU 69 HA GLU 69 -4.215 -9.282 -12.735 519 HB2 GLU 69 2HB GLU 69 -1.837 -9.284 -14.597 520 HB3 GLU 69 1HB GLU 69 -2.954 -10.604 -14.281 521 HG2 GLU 69 2HG GLU 69 -3.613 -8.033 -15.698 522 HG3 GLU 69 1HG GLU 69 -3.358 -9.605 -16.455 523 H LEU 70 H LEU 70 -1.082 -7.669 -12.758 524 HA LEU 70 HA LEU 70 0.361 -9.464 -11.166 525 HB2 LEU 70 2HB LEU 70 0.523 -6.482 -11.515 526 HB3 LEU 70 1HB LEU 70 1.612 -7.340 -10.427 527 HG LEU 70 HG LEU 70 1.487 -8.444 -13.154 528 HD11 LEU 70 1HD1 LEU 70 2.109 -5.604 -12.620 529 HD12 LEU 70 2HD1 LEU 70 1.477 -6.373 -14.078 530 HD13 LEU 70 3HD1 LEU 70 3.199 -6.478 -13.698 531 HD21 LEU 70 3HD2 LEU 70 4.068 -8.005 -12.647 532 HD22 LEU 70 1HD2 LEU 70 3.196 -9.390 -11.986 533 HD23 LEU 70 2HD2 LEU 70 3.459 -7.956 -10.992 534 H SER 71 H SER 71 -2.198 -7.316 -10.352 535 HA SER 71 HA SER 71 -1.836 -6.583 -7.772 536 HB2 SER 71 2HB SER 71 -4.193 -7.294 -9.380 537 HB3 SER 71 1HB SER 71 -4.423 -7.361 -7.634 538 HG SER 71 HG SER 71 -3.224 -5.138 -8.896 539 H HIS 72 H HIS 72 -2.015 -9.851 -8.833 540 HA HIS 72 HA HIS 72 -3.054 -11.126 -6.586 541 HB2 HIS 72 2HB HIS 72 -1.073 -11.941 -8.694 542 HB3 HIS 72 1HB HIS 72 -1.385 -13.006 -7.316 543 HD1 HIS 72 1HD HIS 72 -3.039 -14.735 -7.896 544 HD2 HIS 72 2HD HIS 72 -3.820 -11.156 -9.857 545 HE1 HIS 72 1HE HIS 72 -5.101 -15.159 -9.272 546 HE2 HIS 72 2HE HIS 72 -5.507 -13.003 -10.513 547 H ASN 73 H ASN 73 -0.263 -9.266 -6.940 548 HA ASN 73 HA ASN 73 1.462 -10.482 -5.070 549 HB2 ASN 73 2HB ASN 73 1.239 -7.590 -5.929 550 HB3 ASN 73 1HB ASN 73 2.630 -8.344 -5.149 551 HD21 ASN 73 1HD2 ASN 73 1.810 -7.178 -7.950 552 HD22 ASN 73 2HD2 ASN 73 2.526 -8.326 -9.039 553 H PHE 74 H PHE 74 -0.745 -7.701 -4.731 554 HA PHE 74 HA PHE 74 -1.028 -8.321 -1.911 555 HB2 PHE 74 2HB PHE 74 -1.076 -5.547 -1.938 556 HB3 PHE 74 1HB PHE 74 0.224 -6.582 -1.356 557 HD1 PHE 74 1HD PHE 74 2.203 -7.023 -2.756 558 HD2 PHE 74 2HD PHE 74 -0.850 -4.297 -3.936 559 HE1 PHE 74 1HE PHE 74 3.734 -6.010 -4.385 560 HE2 PHE 74 2HE PHE 74 0.684 -3.283 -5.565 561 HZ PHE 74 HZ PHE 74 2.971 -4.138 -5.779 562 H VAL 75 H VAL 75 -2.705 -5.911 -1.422 563 HA VAL 75 HA VAL 75 -4.882 -6.412 -3.312 564 HB VAL 75 HB VAL 75 -5.014 -7.970 -1.320 565 HG11 VAL 75 1HG1 VAL 75 -4.815 -5.569 0.116 566 HG12 VAL 75 2HG1 VAL 75 -5.107 -7.188 0.752 567 HG13 VAL 75 3HG1 VAL 75 -6.467 -6.141 0.344 568 HG21 VAL 75 3HG2 VAL 75 -7.236 -6.200 -2.249 569 HG22 VAL 75 1HG2 VAL 75 -7.532 -7.472 -1.065 570 HG23 VAL 75 2HG2 VAL 75 -6.904 -7.880 -2.662 571 H MET 76 H MET 76 -6.391 -4.960 -3.571 572 HA MET 76 HA MET 76 -6.198 -2.382 -3.707 573 HB2 MET 76 2HB MET 76 -8.697 -2.363 -3.486 574 HB3 MET 76 1HB MET 76 -8.048 -3.549 -4.600 575 HG2 MET 76 2HG MET 76 -8.198 -4.712 -2.005 576 HG3 MET 76 1HG MET 76 -9.740 -3.959 -2.374 577 HE1 MET 76 3HE MET 76 -7.450 -5.194 -5.185 578 HE2 MET 76 1HE MET 76 -8.057 -6.793 -5.597 579 HE3 MET 76 2HE MET 76 -7.066 -6.574 -4.162 580 H VAL 77 H VAL 77 -5.127 -1.319 -1.878 581 HA VAL 77 HA VAL 77 -7.091 -0.534 0.124 582 HB VAL 77 HB VAL 77 -4.313 -1.457 0.868 583 HG11 VAL 77 1HG1 VAL 77 -4.455 0.192 2.405 584 HG12 VAL 77 2HG1 VAL 77 -5.542 -0.929 3.223 585 HG13 VAL 77 3HG1 VAL 77 -6.201 0.358 2.212 586 HG21 VAL 77 3HG2 VAL 77 -5.880 -2.802 2.494 587 HG22 VAL 77 1HG2 VAL 77 -5.550 -3.372 0.859 588 HG23 VAL 77 2HG2 VAL 77 -7.057 -2.526 1.210 589 H ASN 78 H ASN 78 -6.945 1.158 -1.623 590 HA ASN 78 HA ASN 78 -4.737 3.013 -1.175 591 HB2 ASN 78 2HB ASN 78 -5.005 2.584 -3.458 592 HB3 ASN 78 1HB ASN 78 -6.750 2.652 -3.355 593 HD21 ASN 78 1HD2 ASN 78 -3.997 4.723 -2.611 594 HD22 ASN 78 2HD2 ASN 78 -4.636 6.139 -3.377 595 H LEU 79 H LEU 79 -5.158 4.318 0.503 596 HA LEU 79 HA LEU 79 -7.834 5.543 0.638 597 HB2 LEU 79 2HB LEU 79 -7.407 5.998 2.988 598 HB3 LEU 79 1HB LEU 79 -7.256 4.289 2.634 599 HG LEU 79 HG LEU 79 -4.668 5.286 2.369 600 HD11 LEU 79 1HD1 LEU 79 -5.600 6.218 5.035 601 HD12 LEU 79 2HD1 LEU 79 -5.801 7.286 3.648 602 HD13 LEU 79 3HD1 LEU 79 -4.194 6.714 4.094 603 HD21 LEU 79 3HD2 LEU 79 -5.448 4.132 4.971 604 HD22 LEU 79 1HD2 LEU 79 -4.185 3.641 3.842 605 HD23 LEU 79 2HD2 LEU 79 -5.863 3.186 3.539 606 H GLU 80 H GLU 80 -7.953 7.779 1.380 607 HA GLU 80 HA GLU 80 -5.609 9.399 0.659 608 HB2 GLU 80 2HB GLU 80 -7.653 9.114 -1.073 609 HB3 GLU 80 1HB GLU 80 -8.274 10.458 -0.108 610 HG2 GLU 80 2HG GLU 80 -5.685 11.220 -0.602 611 HG3 GLU 80 1HG GLU 80 -6.144 10.393 -2.099 612 H ASP 81 H ASP 81 -6.626 11.894 1.031 613 HA ASP 81 HA ASP 81 -6.405 12.400 3.697 614 HB2 ASP 81 2HB ASP 81 -6.523 14.050 1.735 615 HB3 ASP 81 1HB ASP 81 -8.267 14.023 1.972 616 H GLU 82 H GLU 82 -9.256 11.315 1.998 617 HA GLU 82 HA GLU 82 -11.228 11.956 3.865 618 HB2 GLU 82 2HB GLU 82 -10.941 10.007 1.662 619 HB3 GLU 82 1HB GLU 82 -12.146 9.601 2.876 620 HG2 GLU 82 2HG GLU 82 -12.292 12.375 2.011 621 HG3 GLU 82 1HG GLU 82 -12.527 11.222 0.698 622 H GLU 83 H GLU 83 -8.918 9.324 3.777 623 HA GLU 83 HA GLU 83 -9.890 8.449 6.418 624 HB2 GLU 83 2HB GLU 83 -8.909 6.874 4.067 625 HB3 GLU 83 1HB GLU 83 -8.671 6.242 5.688 626 HG2 GLU 83 2HG GLU 83 -11.230 6.750 5.929 627 HG3 GLU 83 1HG GLU 83 -11.191 6.665 4.163 628 H GLU 84 H GLU 84 -8.487 9.874 7.499 629 HA GLU 84 HA GLU 84 -5.615 9.445 7.099 630 HB2 GLU 84 2HB GLU 84 -5.442 11.465 8.653 631 HB3 GLU 84 1HB GLU 84 -6.094 11.748 7.044 632 HG2 GLU 84 2HG GLU 84 -8.321 11.857 7.885 633 HG3 GLU 84 1HG GLU 84 -7.802 11.320 9.482 634 HA PRO 85 HA PRO 85 -6.341 6.811 10.797 635 HB2 PRO 85 2HB PRO 85 -4.007 5.402 10.445 636 HB3 PRO 85 1HB PRO 85 -5.561 4.956 9.718 637 HG2 PRO 85 2HG PRO 85 -3.241 6.413 8.513 638 HG3 PRO 85 1HG PRO 85 -4.292 5.172 7.792 639 HD2 PRO 85 2HD PRO 85 -4.583 7.798 7.241 640 HD3 PRO 85 1HD PRO 85 -5.971 6.687 7.320 641 H LYS 86 H LYS 86 -4.257 6.049 12.334 642 HA LYS 86 HA LYS 86 -2.627 8.436 12.817 643 HB2 LYS 86 2HB LYS 86 -4.863 8.116 14.261 644 HB3 LYS 86 1HB LYS 86 -3.770 7.112 15.219 645 HG2 LYS 86 2HG LYS 86 -2.312 8.948 15.620 646 HG3 LYS 86 1HG LYS 86 -3.170 9.960 14.456 647 HD2 LYS 86 2HD LYS 86 -4.827 10.453 15.911 648 HD3 LYS 86 1HD LYS 86 -4.815 8.840 16.628 649 HE2 LYS 86 2HE LYS 86 -2.519 9.606 17.604 650 HE3 LYS 86 1HE LYS 86 -3.141 11.225 17.285 651 HZ1 LYS 86 3HZ LYS 86 -4.080 9.216 19.203 652 HZ2 LYS 86 1HZ LYS 86 -5.212 10.288 18.543 653 HZ3 LYS 86 2HZ LYS 86 -3.882 10.884 19.401 654 H ASP 87 H ASP 87 -1.115 6.858 11.789 655 HA ASP 87 HA ASP 87 0.628 5.784 13.703 656 HB2 ASP 87 2HB ASP 87 -1.479 4.071 13.298 657 HB3 ASP 87 1HB ASP 87 -0.282 3.459 12.148 658 H GLU 88 H GLU 88 2.168 4.077 12.454 659 HA GLU 88 HA GLU 88 3.452 5.572 10.450 660 HB2 GLU 88 2HB GLU 88 3.769 2.636 11.095 661 HB3 GLU 88 1HB GLU 88 4.907 3.620 10.184 662 HG2 GLU 88 2HG GLU 88 4.153 4.030 13.068 663 HG3 GLU 88 1HG GLU 88 5.633 3.269 12.487 664 H ASP 89 H ASP 89 0.761 3.515 10.254 665 HA ASP 89 HA ASP 89 0.971 2.201 7.871 666 HB2 ASP 89 2HB ASP 89 -1.090 2.826 9.656 667 HB3 ASP 89 1HB ASP 89 -1.658 3.389 8.078 668 H PHE 90 H PHE 90 0.994 5.631 8.234 669 HA PHE 90 HA PHE 90 0.401 5.915 5.366 670 HB2 PHE 90 2HB PHE 90 0.178 8.414 5.969 671 HB3 PHE 90 1HB PHE 90 -1.128 7.315 6.429 672 HD1 PHE 90 1HD PHE 90 2.142 8.279 7.977 673 HD2 PHE 90 2HD PHE 90 -2.073 7.928 8.399 674 HE1 PHE 90 1HE PHE 90 2.318 9.053 10.301 675 HE2 PHE 90 2HE PHE 90 -1.909 8.701 10.724 676 HZ PHE 90 HZ PHE 90 0.289 9.267 11.682 677 H SER 91 H SER 91 2.863 6.226 7.744 678 HA SER 91 HA SER 91 4.871 6.624 5.793 679 HB2 SER 91 2HB SER 91 5.063 8.956 7.571 680 HB3 SER 91 1HB SER 91 5.317 8.837 5.822 681 HG SER 91 HG SER 91 3.280 9.354 5.480 682 HA PRO 92 HA PRO 92 6.420 4.772 9.669 683 HB2 PRO 92 2HB PRO 92 7.942 2.979 7.991 684 HB3 PRO 92 1HB PRO 92 6.575 2.601 9.054 685 HG2 PRO 92 2HG PRO 92 6.477 2.458 6.317 686 HG3 PRO 92 1HG PRO 92 5.062 2.728 7.350 687 HD2 PRO 92 2HD PRO 92 6.674 4.706 5.789 688 HD3 PRO 92 1HD PRO 92 4.919 4.615 6.018 689 H ASP 93 H ASP 93 8.650 4.527 6.909 690 HA ASP 93 HA ASP 93 10.548 6.234 8.383 691 HB2 ASP 93 2HB ASP 93 10.972 3.622 8.106 692 HB3 ASP 93 1HB ASP 93 11.573 4.136 6.522 693 H GLY 94 H GLY 94 9.559 7.961 7.082 694 HA2 GLY 94 2HA GLY 94 11.038 8.271 4.587 695 HA3 GLY 94 1HA GLY 94 9.277 8.317 4.463 696 H GLY 95 H GLY 95 8.178 9.925 5.907 697 HA2 GLY 95 2HA GLY 95 8.478 11.959 7.255 698 HA3 GLY 95 1HA GLY 95 9.864 12.333 6.225 699 H TYR 96 H TYR 96 6.651 11.175 5.295 700 HA TYR 96 HA TYR 96 5.990 13.782 4.163 701 HB2 TYR 96 2HB TYR 96 5.204 12.194 2.092 702 HB3 TYR 96 1HB TYR 96 6.719 13.106 2.125 703 HD1 TYR 96 2HD TYR 96 8.839 11.962 2.649 704 HD2 TYR 96 1HD TYR 96 5.198 9.799 2.233 705 HE1 TYR 96 2HE TYR 96 10.112 9.873 2.435 706 HE2 TYR 96 1HE TYR 96 6.461 7.699 2.016 707 HH TYR 96 HH TYR 96 9.840 7.519 2.689 708 H ILE 97 H ILE 97 3.723 13.284 2.857 709 HA ILE 97 HA ILE 97 2.074 11.457 4.347 710 HB ILE 97 HB ILE 97 0.516 13.090 5.228 711 HG12 ILE 97 2HG1 ILE 97 0.484 14.930 3.782 712 HG13 ILE 97 1HG1 ILE 97 1.290 15.535 5.224 713 HG21 ILE 97 1HG2 ILE 97 3.308 13.888 5.996 714 HG22 ILE 97 2HG2 ILE 97 2.478 12.440 6.566 715 HG23 ILE 97 3HG2 ILE 97 1.848 14.036 6.973 716 HD11 ILE 97 3HD1 ILE 97 2.515 14.826 2.588 717 HD12 ILE 97 1HD1 ILE 97 3.473 15.052 4.051 718 HD13 ILE 97 2HD1 ILE 97 2.506 16.383 3.415 719 HA PRO 98 HA PRO 98 1.314 9.644 3.471 720 HB2 PRO 98 2HB PRO 98 -1.274 9.322 1.904 721 HB3 PRO 98 1HB PRO 98 -0.658 8.289 3.224 722 HG2 PRO 98 2HG PRO 98 -2.036 10.779 3.426 723 HG3 PRO 98 1HG PRO 98 -1.392 9.752 4.740 724 HD2 PRO 98 2HD PRO 98 -0.261 12.041 4.377 725 HD3 PRO 98 1HD PRO 98 0.794 10.622 4.494 726 H ARG 99 H ARG 99 2.077 7.750 2.431 727 HA ARG 99 HA ARG 99 2.393 7.965 -0.482 728 HB2 ARG 99 2HB ARG 99 4.392 7.873 1.626 729 HB3 ARG 99 1HB ARG 99 4.621 6.580 0.444 730 HG2 ARG 99 2HG ARG 99 5.843 8.744 0.029 731 HG3 ARG 99 1HG ARG 99 4.908 8.100 -1.318 732 HD2 ARG 99 2HD ARG 99 3.481 9.965 0.459 733 HD3 ARG 99 1HD ARG 99 4.800 10.666 -0.477 734 HE ARG 99 HE ARG 99 2.995 9.051 -2.029 735 HH11 ARG 99 1HH1 ARG 99 3.620 12.242 -0.762 736 HH12 ARG 99 2HH1 ARG 99 2.678 13.043 -1.974 737 HH21 ARG 99 1HH2 ARG 99 1.758 10.100 -3.622 738 HH22 ARG 99 2HH2 ARG 99 1.623 11.827 -3.598 739 H ILE 100 H ILE 100 3.716 5.655 -1.005 740 HA ILE 100 HA ILE 100 1.630 3.664 -0.580 741 HB ILE 100 HB ILE 100 4.101 3.406 -2.288 742 HG12 ILE 100 2HG1 ILE 100 1.870 3.885 -3.924 743 HG13 ILE 100 1HG1 ILE 100 1.769 5.081 -2.637 744 HG21 ILE 100 1HG2 ILE 100 1.706 1.772 -1.798 745 HG22 ILE 100 2HG2 ILE 100 3.320 1.296 -2.326 746 HG23 ILE 100 3HG2 ILE 100 2.169 1.951 -3.491 747 HD11 ILE 100 3HD1 ILE 100 4.347 4.677 -4.067 748 HD12 ILE 100 1HD1 ILE 100 3.721 6.111 -3.256 749 HD13 ILE 100 2HD1 ILE 100 3.058 5.617 -4.815 750 H LEU 101 H LEU 101 1.802 2.484 1.235 751 HA LEU 101 HA LEU 101 4.477 1.525 2.041 752 HB2 LEU 101 2HB LEU 101 1.983 1.984 3.678 753 HB3 LEU 101 1HB LEU 101 3.415 1.186 4.291 754 HG LEU 101 HG LEU 101 4.587 3.139 4.507 755 HD11 LEU 101 1HD1 LEU 101 2.884 4.314 2.319 756 HD12 LEU 101 2HD1 LEU 101 4.580 3.836 2.213 757 HD13 LEU 101 3HD1 LEU 101 4.113 5.202 3.224 758 HD21 LEU 101 3HD2 LEU 101 2.368 3.168 5.765 759 HD22 LEU 101 1HD2 LEU 101 1.844 4.351 4.567 760 HD23 LEU 101 2HD2 LEU 101 3.228 4.695 5.601 761 H PHE 102 H PHE 102 4.864 -0.644 2.021 762 HA PHE 102 HA PHE 102 2.635 -2.398 1.330 763 HB2 PHE 102 2HB PHE 102 5.616 -2.664 1.389 764 HB3 PHE 102 1HB PHE 102 4.624 -4.119 1.405 765 HD1 PHE 102 1HD PHE 102 4.020 -0.923 -0.387 766 HD2 PHE 102 2HD PHE 102 5.002 -5.054 -0.690 767 HE1 PHE 102 1HE PHE 102 3.815 -0.789 -2.835 768 HE2 PHE 102 2HE PHE 102 4.800 -4.926 -3.137 769 HZ PHE 102 HZ PHE 102 4.206 -2.793 -4.214 770 H LEU 103 H LEU 103 1.635 -3.775 2.762 771 HA LEU 103 HA LEU 103 2.954 -4.136 5.365 772 HB2 LEU 103 2HB LEU 103 1.055 -3.591 6.609 773 HB3 LEU 103 1HB LEU 103 1.238 -2.311 5.438 774 HG LEU 103 HG LEU 103 -0.793 -4.525 5.414 775 HD11 LEU 103 1HD1 LEU 103 -0.881 -1.564 5.865 776 HD12 LEU 103 2HD1 LEU 103 -1.491 -2.855 6.892 777 HD13 LEU 103 3HD1 LEU 103 -2.312 -2.472 5.380 778 HD21 LEU 103 3HD2 LEU 103 -0.446 -4.325 3.165 779 HD22 LEU 103 1HD2 LEU 103 0.121 -2.658 3.285 780 HD23 LEU 103 2HD2 LEU 103 -1.602 -3.016 3.410 781 H ASP 104 H ASP 104 2.300 -5.928 6.611 782 HA ASP 104 HA ASP 104 2.014 -8.284 5.097 783 HB2 ASP 104 2HB ASP 104 1.906 -7.748 8.062 784 HB3 ASP 104 1HB ASP 104 1.780 -9.377 7.380 785 HA PRO 105 HA PRO 105 -2.279 -9.097 4.589 786 HB2 PRO 105 2HB PRO 105 -1.694 -11.799 5.694 787 HB3 PRO 105 1HB PRO 105 -2.474 -11.342 4.167 788 HG2 PRO 105 2HG PRO 105 0.033 -12.239 4.199 789 HG3 PRO 105 1HG PRO 105 -0.451 -10.915 3.113 790 HD2 PRO 105 2HD PRO 105 1.086 -10.807 5.674 791 HD3 PRO 105 1HD PRO 105 1.294 -9.856 4.191 792 H SER 106 H SER 106 -3.036 -7.739 6.250 793 HA SER 106 HA SER 106 -4.802 -8.657 8.042 794 HB2 SER 106 2HB SER 106 -2.055 -8.937 9.148 795 HB3 SER 106 1HB SER 106 -3.279 -8.255 10.233 796 HG SER 106 HG SER 106 -4.261 -10.131 10.312 797 H GLY 107 H GLY 107 -2.275 -6.371 7.390 798 HA2 GLY 107 2HA GLY 107 -2.927 -4.050 7.084 799 HA3 GLY 107 1HA GLY 107 -3.997 -4.233 8.478 800 H LYS 108 H LYS 108 -0.607 -5.252 8.066 801 HA LYS 108 HA LYS 108 0.054 -3.465 10.327 802 HB2 LYS 108 2HB LYS 108 0.259 -6.257 10.188 803 HB3 LYS 108 1HB LYS 108 1.907 -5.663 10.049 804 HG2 LYS 108 2HG LYS 108 1.063 -4.151 12.097 805 HG3 LYS 108 1HG LYS 108 0.043 -5.580 12.331 806 HD2 LYS 108 2HD LYS 108 2.868 -6.154 11.752 807 HD3 LYS 108 1HD LYS 108 2.582 -5.312 13.276 808 HE2 LYS 108 2HE LYS 108 1.658 -7.117 14.230 809 HE3 LYS 108 1HE LYS 108 0.724 -7.512 12.788 810 HZ1 LYS 108 3HZ LYS 108 2.287 -8.928 12.057 811 HZ2 LYS 108 1HZ LYS 108 2.759 -8.978 13.680 812 HZ3 LYS 108 2HZ LYS 108 3.579 -7.976 12.592 813 H VAL 109 H VAL 109 0.617 -1.801 8.771 814 HA VAL 109 HA VAL 109 2.527 -2.037 6.747 815 HB VAL 109 HB VAL 109 1.354 0.169 8.298 816 HG11 VAL 109 1HG1 VAL 109 3.619 0.763 8.757 817 HG12 VAL 109 2HG1 VAL 109 3.026 1.827 7.484 818 HG13 VAL 109 3HG1 VAL 109 4.090 0.479 7.083 819 HG21 VAL 109 3HG2 VAL 109 1.542 1.181 5.910 820 HG22 VAL 109 1HG2 VAL 109 0.399 -0.125 6.221 821 HG23 VAL 109 2HG2 VAL 109 1.943 -0.471 5.442 822 H HIS 110 H HIS 110 4.581 -2.440 6.719 823 HA HIS 110 HA HIS 110 6.142 -1.944 9.171 824 HB2 HIS 110 2HB HIS 110 7.545 -3.948 8.349 825 HB3 HIS 110 1HB HIS 110 5.995 -4.288 9.109 826 HD1 HIS 110 1HD HIS 110 7.573 -4.104 5.676 827 HD2 HIS 110 2HD HIS 110 4.231 -5.697 7.561 828 HE1 HIS 110 1HE HIS 110 6.467 -5.565 3.957 829 HE2 HIS 110 2HE HIS 110 4.484 -6.574 5.139 830 HA PRO 111 HA PRO 111 8.647 0.461 6.401 831 HB2 PRO 111 2HB PRO 111 10.835 0.765 7.972 832 HB3 PRO 111 1HB PRO 111 9.325 1.634 8.272 833 HG2 PRO 111 2HG PRO 111 10.383 -0.833 9.592 834 HG3 PRO 111 1HG PRO 111 9.590 0.575 10.322 835 HD2 PRO 111 2HD PRO 111 8.292 -1.763 9.829 836 HD3 PRO 111 1HD PRO 111 7.482 -0.179 9.789 837 H GLU 112 H GLU 112 8.587 -2.367 5.971 838 HA GLU 112 HA GLU 112 11.424 -3.025 5.567 839 HB2 GLU 112 2HB GLU 112 9.417 -4.540 6.640 840 HB3 GLU 112 1HB GLU 112 9.429 -5.099 4.973 841 HG2 GLU 112 2HG GLU 112 12.005 -4.902 6.452 842 HG3 GLU 112 1HG GLU 112 10.916 -6.247 6.787 843 H ILE 113 H ILE 113 8.313 -3.381 3.841 844 HA ILE 113 HA ILE 113 9.779 -3.505 1.330 845 HB ILE 113 HB ILE 113 6.836 -3.875 1.856 846 HG12 ILE 113 2HG1 ILE 113 8.128 -5.649 2.869 847 HG13 ILE 113 1HG1 ILE 113 7.356 -6.273 1.406 848 HG21 ILE 113 1HG2 ILE 113 8.494 -4.081 -0.639 849 HG22 ILE 113 2HG2 ILE 113 6.996 -3.188 -0.380 850 HG23 ILE 113 3HG2 ILE 113 6.969 -4.950 -0.463 851 HD11 ILE 113 3HD1 ILE 113 9.571 -7.110 1.472 852 HD12 ILE 113 1HD1 ILE 113 10.238 -5.506 1.781 853 HD13 ILE 113 2HD1 ILE 113 9.516 -5.876 0.214 854 H ILE 114 H ILE 114 10.402 -1.627 0.633 855 HA ILE 114 HA ILE 114 8.435 0.543 0.313 856 HB ILE 114 HB ILE 114 10.149 2.177 0.674 857 HG12 ILE 114 2HG1 ILE 114 11.980 0.837 -0.445 858 HG13 ILE 114 1HG1 ILE 114 12.476 1.702 1.000 859 HG21 ILE 114 1HG2 ILE 114 10.040 2.044 2.886 860 HG22 ILE 114 2HG2 ILE 114 11.005 0.572 2.932 861 HG23 ILE 114 3HG2 ILE 114 9.268 0.477 2.654 862 HD11 ILE 114 3HD1 ILE 114 11.685 -0.813 1.898 863 HD12 ILE 114 1HD1 ILE 114 13.330 -0.199 1.733 864 HD13 ILE 114 2HD1 ILE 114 12.591 -1.104 0.413 865 H ASN 115 H ASN 115 10.267 2.170 -1.208 866 HA ASN 115 HA ASN 115 10.241 0.684 -3.735 867 HB2 ASN 115 2HB ASN 115 9.032 2.836 -3.699 868 HB3 ASN 115 1HB ASN 115 10.525 3.652 -3.210 869 HD21 ASN 115 1HD2 ASN 115 9.297 4.585 -5.372 870 HD22 ASN 115 2HD2 ASN 115 10.162 4.147 -6.822 871 H GLU 116 H GLU 116 12.192 -0.494 -3.131 872 HA GLU 116 HA GLU 116 14.615 0.625 -2.417 873 HB2 GLU 116 2HB GLU 116 13.790 -1.873 -3.795 874 HB3 GLU 116 1HB GLU 116 15.496 -1.424 -3.900 875 HG2 GLU 116 2HG GLU 116 14.016 -1.571 -1.295 876 HG3 GLU 116 1HG GLU 116 14.823 -2.964 -2.008 877 H ASN 117 H ASN 117 12.989 0.759 -5.457 878 HA ASN 117 HA ASN 117 15.358 1.503 -6.946 879 HB2 ASN 117 2HB ASN 117 13.603 0.196 -8.049 880 HB3 ASN 117 1HB ASN 117 12.437 1.494 -7.748 881 HD21 ASN 117 1HD2 ASN 117 12.398 3.245 -9.058 882 HD22 ASN 117 2HD2 ASN 117 13.386 3.410 -10.486 883 H GLY 118 H GLY 118 13.403 3.100 -4.791 884 HA2 GLY 118 2HA GLY 118 13.350 5.637 -6.225 885 HA3 GLY 118 1HA GLY 118 12.662 5.318 -4.630 886 H ASN 119 H ASN 119 13.856 7.581 -4.655 887 HA ASN 119 HA ASN 119 16.690 7.375 -4.085 888 HB2 ASN 119 2HB ASN 119 16.480 9.854 -3.675 889 HB3 ASN 119 1HB ASN 119 16.001 9.328 -5.296 890 HD21 ASN 119 1HD2 ASN 119 13.869 9.451 -5.908 891 HD22 ASN 119 2HD2 ASN 119 12.673 10.318 -4.982 892 HA PRO 120 HA PRO 120 16.331 7.099 0.306 893 HB2 PRO 120 2HB PRO 120 18.504 8.432 1.173 894 HB3 PRO 120 1HB PRO 120 18.632 6.898 0.289 895 HG2 PRO 120 2HG PRO 120 18.973 9.705 -0.713 896 HG3 PRO 120 1HG PRO 120 19.959 8.263 -1.053 897 HD2 PRO 120 2HD PRO 120 18.048 9.218 -2.755 898 HD3 PRO 120 1HD PRO 120 18.510 7.502 -2.663 899 H SER 121 H SER 121 14.480 8.907 -0.457 900 HA SER 121 HA SER 121 14.134 10.536 1.782 901 HB2 SER 121 2HB SER 121 15.438 11.844 -0.578 902 HB3 SER 121 1HB SER 121 14.232 12.759 0.342 903 HG SER 121 HG SER 121 16.662 11.634 1.276 904 H TYR 122 H TYR 122 12.695 8.690 0.266 905 HA TYR 122 HA TYR 122 10.217 9.981 -0.025 906 HB2 TYR 122 2HB TYR 122 11.974 10.026 -2.328 907 HB3 TYR 122 1HB TYR 122 10.480 9.161 -2.687 908 HD1 TYR 122 2HD TYR 122 8.514 10.676 -1.092 909 HD2 TYR 122 1HD TYR 122 11.796 12.053 -3.420 910 HE1 TYR 122 2HE TYR 122 7.374 12.831 -1.412 911 HE2 TYR 122 1HE TYR 122 10.671 14.211 -3.744 912 HH TYR 122 HH TYR 122 8.077 14.961 -3.702 913 H LYS 123 H LYS 123 12.229 7.329 -1.185 914 HA LYS 123 HA LYS 123 11.726 5.134 -1.674 915 HB2 LYS 123 2HB LYS 123 11.155 5.711 1.180 916 HB3 LYS 123 1HB LYS 123 10.653 4.140 0.580 917 HG2 LYS 123 2HG LYS 123 13.428 5.283 0.708 918 HG3 LYS 123 1HG LYS 123 12.788 3.837 1.510 919 HD2 LYS 123 2HD LYS 123 13.685 2.693 -0.189 920 HD3 LYS 123 1HD LYS 123 12.340 3.316 -1.157 921 HE2 LYS 123 2HE LYS 123 13.927 4.167 -2.480 922 HE3 LYS 123 1HE LYS 123 14.129 5.388 -1.228 923 HZ1 LYS 123 3HZ LYS 123 15.722 3.579 -0.241 924 HZ2 LYS 123 1HZ LYS 123 16.259 4.646 -1.440 925 HZ3 LYS 123 2HZ LYS 123 15.807 3.068 -1.851 926 H TYR 124 H TYR 124 9.020 5.256 0.521 927 HA TYR 124 HA TYR 124 7.256 3.790 -0.904 928 HB2 TYR 124 2HB TYR 124 6.525 6.140 0.846 929 HB3 TYR 124 1HB TYR 124 5.486 4.766 0.452 930 HD1 TYR 124 1HD TYR 124 6.570 2.403 1.044 931 HD2 TYR 124 2HD TYR 124 7.645 6.093 2.860 932 HE1 TYR 124 1HE TYR 124 7.445 1.182 2.988 933 HE2 TYR 124 2HE TYR 124 8.530 4.884 4.806 934 HH TYR 124 HH TYR 124 9.115 1.578 4.808 935 H PHE 125 H PHE 125 8.101 7.084 -1.602 936 HA PHE 125 HA PHE 125 5.774 7.765 -3.073 937 HB2 PHE 125 2HB PHE 125 7.480 9.383 -2.150 938 HB3 PHE 125 1HB PHE 125 8.544 8.901 -3.480 939 HD1 PHE 125 2HD PHE 125 4.910 9.735 -3.235 940 HD2 PHE 125 1HD PHE 125 8.662 10.542 -5.078 941 HE1 PHE 125 2HE PHE 125 3.835 11.404 -4.687 942 HE2 PHE 125 1HE PHE 125 7.592 12.215 -6.529 943 HZ PHE 125 HZ PHE 125 5.177 12.646 -6.337 944 H TYR 126 H TYR 126 5.108 6.858 -4.892 945 HA TYR 126 HA TYR 126 7.120 5.813 -6.780 946 HB2 TYR 126 2HB TYR 126 4.373 4.881 -6.040 947 HB3 TYR 126 1HB TYR 126 4.963 4.580 -7.676 948 HD1 TYR 126 2HD TYR 126 7.682 3.812 -7.424 949 HD2 TYR 126 1HD TYR 126 4.462 2.960 -4.776 950 HE1 TYR 126 2HE TYR 126 8.861 1.801 -6.640 951 HE2 TYR 126 1HE TYR 126 5.635 0.951 -3.986 952 HH TYR 126 HH TYR 126 8.244 0.250 -3.909 953 H VAL 127 H VAL 127 7.370 7.919 -7.719 954 HA VAL 127 HA VAL 127 5.077 9.165 -8.974 955 HB VAL 127 HB VAL 127 6.826 10.561 -7.979 956 HG11 VAL 127 1HG1 VAL 127 8.561 8.998 -9.795 957 HG12 VAL 127 2HG1 VAL 127 8.884 9.638 -8.184 958 HG13 VAL 127 3HG1 VAL 127 8.948 10.706 -9.586 959 HG21 VAL 127 3HG2 VAL 127 7.120 11.159 -10.865 960 HG22 VAL 127 1HG2 VAL 127 6.657 12.211 -9.526 961 HG23 VAL 127 2HG2 VAL 127 5.483 11.086 -10.210 962 H SER 128 H SER 128 5.071 6.795 -10.054 963 HA SER 128 HA SER 128 4.948 6.949 -12.710 964 HB2 SER 128 2HB SER 128 7.160 7.617 -13.149 965 HB3 SER 128 1HB SER 128 7.830 6.511 -11.938 966 HG SER 128 HG SER 128 7.861 4.977 -13.382 967 H ALA 129 H ALA 129 4.461 4.990 -13.694 968 HA ALA 129 HA ALA 129 3.893 2.825 -11.925 969 HB1 ALA 129 1HB ALA 129 2.602 1.972 -13.588 970 HB2 ALA 129 2HB ALA 129 3.744 2.419 -14.855 971 HB3 ALA 129 3HB ALA 129 2.695 3.643 -14.141 972 H GLU 130 H GLU 130 6.469 3.599 -14.108 973 HA GLU 130 HA GLU 130 7.506 1.086 -14.677 974 HB2 GLU 130 2HB GLU 130 8.300 3.763 -15.030 975 HB3 GLU 130 1HB GLU 130 9.642 2.966 -14.201 976 HG2 GLU 130 2HG GLU 130 9.733 1.270 -15.937 977 HG3 GLU 130 1HG GLU 130 8.349 2.013 -16.755 978 H GLN 131 H GLN 131 8.149 3.179 -11.870 979 HA GLN 131 HA GLN 131 9.960 1.272 -10.749 980 HB2 GLN 131 2HB GLN 131 9.529 2.704 -8.630 981 HB3 GLN 131 1HB GLN 131 10.541 3.307 -9.933 982 HG2 GLN 131 2HG GLN 131 8.595 4.572 -10.797 983 HG3 GLN 131 1HG GLN 131 7.665 4.032 -9.401 984 HE21 GLN 131 1HE2 GLN 131 8.005 6.694 -9.929 985 HE22 GLN 131 2HE2 GLN 131 9.019 7.402 -8.724 986 H VAL 132 H VAL 132 6.729 2.410 -9.689 987 HA VAL 132 HA VAL 132 6.407 0.612 -7.619 988 HB VAL 132 HB VAL 132 4.774 2.294 -7.777 989 HG11 VAL 132 1HG1 VAL 132 3.887 3.077 -9.645 990 HG12 VAL 132 2HG1 VAL 132 3.320 1.481 -10.141 991 HG13 VAL 132 3HG1 VAL 132 4.972 1.983 -10.503 992 HG21 VAL 132 3HG2 VAL 132 2.930 1.113 -7.212 993 HG22 VAL 132 1HG2 VAL 132 4.060 -0.239 -7.304 994 HG23 VAL 132 2HG2 VAL 132 2.991 0.112 -8.663 995 H VAL 133 H VAL 133 6.363 -0.001 -11.025 996 HA VAL 133 HA VAL 133 5.000 -2.518 -10.798 997 HB VAL 133 HB VAL 133 4.996 -1.160 -12.909 998 HG11 VAL 133 1HG1 VAL 133 7.847 -1.625 -12.637 999 HG12 VAL 133 2HG1 VAL 133 6.982 -0.447 -13.622 1000 HG13 VAL 133 3HG1 VAL 133 7.232 -2.085 -14.225 1001 HG21 VAL 133 3HG2 VAL 133 6.036 -3.973 -13.214 1002 HG22 VAL 133 1HG2 VAL 133 5.022 -3.084 -14.352 1003 HG23 VAL 133 2HG2 VAL 133 4.375 -3.564 -12.781 1004 H GLN 134 H GLN 134 8.336 -1.377 -10.682 1005 HA GLN 134 HA GLN 134 9.345 -4.112 -10.892 1006 HB2 GLN 134 2HB GLN 134 11.561 -2.961 -10.276 1007 HB3 GLN 134 1HB GLN 134 10.843 -2.574 -11.833 1008 HG2 GLN 134 2HG GLN 134 9.980 -0.502 -10.960 1009 HG3 GLN 134 1HG GLN 134 10.579 -0.898 -9.352 1010 HE21 GLN 134 1HE2 GLN 134 11.253 0.592 -12.289 1011 HE22 GLN 134 2HE2 GLN 134 12.951 0.894 -12.035 1012 H GLY 135 H GLY 135 8.769 -1.690 -8.436 1013 HA2 GLY 135 2HA GLY 135 9.927 -3.201 -6.299 1014 HA3 GLY 135 1HA GLY 135 8.891 -1.777 -6.139 1015 H MET 136 H MET 136 6.936 -3.287 -8.016 1016 HA MET 136 HA MET 136 5.556 -4.620 -5.810 1017 HB2 MET 136 2HB MET 136 3.598 -4.609 -7.202 1018 HB3 MET 136 1HB MET 136 4.322 -3.011 -7.242 1019 HG2 MET 136 2HG MET 136 4.100 -3.152 -9.438 1020 HG3 MET 136 1HG MET 136 5.470 -4.255 -9.390 1021 HE1 MET 136 3HE MET 136 1.855 -5.216 -7.927 1022 HE2 MET 136 1HE MET 136 1.051 -5.532 -9.465 1023 HE3 MET 136 2HE MET 136 1.665 -3.918 -9.105 1024 H LYS 137 H LYS 137 6.986 -5.328 -8.924 1025 HA LYS 137 HA LYS 137 6.111 -8.046 -8.992 1026 HB2 LYS 137 2HB LYS 137 7.446 -8.267 -10.957 1027 HB3 LYS 137 1HB LYS 137 6.680 -6.690 -11.017 1028 HG2 LYS 137 2HG LYS 137 8.887 -5.829 -10.020 1029 HG3 LYS 137 1HG LYS 137 9.547 -7.381 -10.535 1030 HD2 LYS 137 2HD LYS 137 8.375 -5.185 -12.222 1031 HD3 LYS 137 1HD LYS 137 9.978 -5.910 -12.323 1032 HE2 LYS 137 2HE LYS 137 7.410 -7.372 -12.928 1033 HE3 LYS 137 1HE LYS 137 8.414 -6.594 -14.146 1034 HZ1 LYS 137 3HZ LYS 137 8.782 -9.037 -13.829 1035 HZ2 LYS 137 1HZ LYS 137 9.446 -8.681 -12.314 1036 HZ3 LYS 137 2HZ LYS 137 10.174 -8.083 -13.718 1037 H GLU 138 H GLU 138 8.493 -6.423 -7.252 1038 HA GLU 138 HA GLU 138 10.208 -8.774 -6.974 1039 HB2 GLU 138 2HB GLU 138 10.617 -5.929 -6.809 1040 HB3 GLU 138 1HB GLU 138 11.127 -6.691 -5.306 1041 HG2 GLU 138 2HG GLU 138 12.035 -8.079 -7.716 1042 HG3 GLU 138 1HG GLU 138 12.660 -6.432 -7.536 1043 H ALA 139 H ALA 139 9.053 -6.327 -4.694 1044 HA ALA 139 HA ALA 139 9.248 -7.792 -2.383 1045 HB1 ALA 139 1HB ALA 139 8.319 -5.293 -3.046 1046 HB2 ALA 139 2HB ALA 139 8.372 -5.984 -1.425 1047 HB3 ALA 139 3HB ALA 139 6.892 -6.085 -2.377 1048 H GLN 140 H GLN 140 6.856 -8.069 -4.877 1049 HA GLN 140 HA GLN 140 4.819 -9.280 -3.392 1050 HB2 GLN 140 2HB GLN 140 3.991 -10.070 -5.567 1051 HB3 GLN 140 1HB GLN 140 4.405 -8.358 -5.580 1052 HG2 GLN 140 2HG GLN 140 5.227 -9.190 -7.592 1053 HG3 GLN 140 1HG GLN 140 6.631 -9.070 -6.536 1054 HE21 GLN 140 1HE2 GLN 140 4.065 -11.482 -6.972 1055 HE22 GLN 140 2HE2 GLN 140 5.129 -12.822 -7.212 1056 H GLU 141 H GLU 141 7.876 -10.475 -4.296 1057 HA GLU 141 HA GLU 141 6.985 -13.257 -4.072 1058 HB2 GLU 141 2HB GLU 141 8.417 -13.635 -5.736 1059 HB3 GLU 141 1HB GLU 141 8.918 -11.943 -5.700 1060 HG2 GLU 141 2HG GLU 141 10.490 -12.607 -3.837 1061 HG3 GLU 141 1HG GLU 141 10.141 -14.277 -4.267 1062 H ARG 142 H ARG 142 9.074 -10.879 -2.587 1063 HA ARG 142 HA ARG 142 10.058 -12.797 -0.632 1064 HB2 ARG 142 2HB ARG 142 11.286 -10.734 0.244 1065 HB3 ARG 142 1HB ARG 142 11.737 -11.317 -1.362 1066 HG2 ARG 142 2HG ARG 142 10.541 -9.573 -2.429 1067 HG3 ARG 142 1HG ARG 142 9.748 -9.102 -0.917 1068 HD2 ARG 142 2HD ARG 142 11.670 -7.645 -1.730 1069 HD3 ARG 142 1HD ARG 142 11.725 -8.183 -0.043 1070 HE ARG 142 HE ARG 142 13.470 -9.036 -2.220 1071 HH11 ARG 142 1HH1 ARG 142 12.479 -9.433 1.109 1072 HH12 ARG 142 2HH1 ARG 142 13.924 -10.270 1.565 1073 HH21 ARG 142 1HH2 ARG 142 15.364 -10.139 -1.614 1074 HH22 ARG 142 2HH2 ARG 142 15.559 -10.671 0.021 1075 H LEU 143 H LEU 143 7.473 -10.609 -0.943 1076 HA LEU 143 HA LEU 143 7.198 -10.276 1.946 1077 HB2 LEU 143 2HB LEU 143 6.979 -8.334 0.369 1078 HB3 LEU 143 1HB LEU 143 5.507 -9.083 -0.247 1079 HG LEU 143 HG LEU 143 4.412 -8.824 1.874 1080 HD11 LEU 143 1HD1 LEU 143 6.232 -9.275 3.380 1081 HD12 LEU 143 2HD1 LEU 143 5.545 -7.696 3.765 1082 HD13 LEU 143 3HD1 LEU 143 7.064 -7.802 2.875 1083 HD21 LEU 143 3HD2 LEU 143 5.078 -6.192 2.126 1084 HD22 LEU 143 1HD2 LEU 143 3.946 -6.841 0.939 1085 HD23 LEU 143 2HD2 LEU 143 5.627 -6.551 0.490 1086 H THR 144 H THR 144 5.337 -11.477 -0.847 1087 HA THR 144 HA THR 144 3.026 -12.242 0.445 1088 HB THR 144 HB THR 144 2.855 -13.982 -1.367 1089 HG1 THR 144 1HG THR 144 5.109 -14.330 -1.610 1090 HG21 THR 144 3HG2 THR 144 3.547 -11.180 -2.191 1091 HG22 THR 144 1HG2 THR 144 1.946 -11.822 -1.824 1092 HG23 THR 144 2HG2 THR 144 2.816 -12.386 -3.251 1093 H GLY 145 H GLY 145 6.106 -13.933 0.245 1094 HA2 GLY 145 2HA GLY 145 5.044 -16.242 1.662 1095 HA3 GLY 145 1HA GLY 145 6.686 -16.050 1.063 1096 H ASP 146 H ASP 146 8.253 -15.376 2.423 1097 HA ASP 146 HA ASP 146 7.767 -13.893 4.795 1098 HB2 ASP 146 2HB ASP 146 8.565 -15.757 6.355 1099 HB3 ASP 146 1HB ASP 146 6.906 -15.866 5.776 1100 H ALA 147 H ALA 147 9.525 -13.946 2.465 1101 HA ALA 147 HA ALA 147 12.159 -14.529 3.550 1102 HB1 ALA 147 1HB ALA 147 11.495 -15.009 1.158 1103 HB2 ALA 147 2HB ALA 147 13.003 -14.122 1.376 1104 HB3 ALA 147 3HB ALA 147 11.540 -13.266 0.889 1105 H PHE 148 H PHE 148 10.014 -11.865 3.109 1106 HA PHE 148 HA PHE 148 11.774 -9.713 3.027 1107 HB2 PHE 148 2HB PHE 148 9.928 -8.353 3.750 1108 HB3 PHE 148 1HB PHE 148 9.293 -9.615 2.689 1109 HD1 PHE 148 2HD PHE 148 8.179 -11.619 3.750 1110 HD2 PHE 148 1HD PHE 148 9.132 -8.085 5.923 1111 HE1 PHE 148 2HE PHE 148 6.565 -12.259 5.493 1112 HE2 PHE 148 1HE PHE 148 7.518 -8.718 7.668 1113 HZ PHE 148 HZ PHE 148 6.232 -10.808 7.454 1114 H ARG 149 H ARG 149 10.673 -11.658 5.735 1115 HA ARG 149 HA ARG 149 11.628 -9.977 7.795 1116 HB2 ARG 149 2HB ARG 149 11.417 -12.970 8.007 1117 HB3 ARG 149 1HB ARG 149 11.165 -11.762 9.256 1118 HG2 ARG 149 2HG ARG 149 9.171 -10.987 7.874 1119 HG3 ARG 149 1HG ARG 149 9.353 -12.503 6.991 1120 HD2 ARG 149 2HD ARG 149 9.385 -12.776 9.910 1121 HD3 ARG 149 1HD ARG 149 7.864 -12.180 9.249 1122 HE ARG 149 HE ARG 149 8.408 -14.300 7.675 1123 HH11 ARG 149 1HH1 ARG 149 8.293 -13.895 11.140 1124 HH12 ARG 149 2HH1 ARG 149 7.812 -15.532 11.441 1125 HH21 ARG 149 1HH2 ARG 149 7.778 -16.451 8.068 1126 HH22 ARG 149 2HH2 ARG 149 7.519 -16.983 9.696 1127 H LYS 150 H LYS 150 13.644 -9.571 8.401 1128 HA LYS 150 HA LYS 150 15.750 -11.491 7.651 1129 HB2 LYS 150 2HB LYS 150 17.289 -9.629 7.418 1130 HB3 LYS 150 1HB LYS 150 15.886 -9.373 6.389 1131 HG2 LYS 150 2HG LYS 150 14.957 -7.819 8.010 1132 HG3 LYS 150 1HG LYS 150 16.333 -8.097 9.081 1133 HD2 LYS 150 2HD LYS 150 17.502 -7.431 6.660 1134 HD3 LYS 150 1HD LYS 150 16.099 -6.364 6.758 1135 HE2 LYS 150 2HE LYS 150 16.840 -5.378 8.742 1136 HE3 LYS 150 1HE LYS 150 17.962 -6.695 9.083 1137 HZ1 LYS 150 3HZ LYS 150 19.454 -5.248 8.270 1138 HZ2 LYS 150 1HZ LYS 150 18.306 -4.355 7.406 1139 HZ3 LYS 150 2HZ LYS 150 18.918 -5.796 6.762 1140 H LYS 151 H LYS 151 17.039 -12.240 9.225 1141 HA LYS 151 HA LYS 151 17.914 -12.620 11.290 1142 HB2 LYS 151 2HB LYS 151 18.307 -9.972 10.861 1143 HB3 LYS 151 1HB LYS 151 17.335 -9.912 12.326 1144 HG2 LYS 151 2HG LYS 151 18.962 -11.514 13.359 1145 HG3 LYS 151 1HG LYS 151 19.977 -11.292 11.932 1146 HD2 LYS 151 2HD LYS 151 19.018 -8.866 13.358 1147 HD3 LYS 151 1HD LYS 151 20.292 -9.823 14.116 1148 HE2 LYS 151 2HE LYS 151 21.827 -9.058 12.693 1149 HE3 LYS 151 1HE LYS 151 20.805 -9.412 11.299 1150 HZ1 LYS 151 3HZ LYS 151 19.580 -7.302 11.899 1151 HZ2 LYS 151 1HZ LYS 151 21.141 -7.108 11.275 1152 HZ3 LYS 151 2HZ LYS 151 20.868 -6.948 12.936 1153 H HIS 152 H HIS 152 17.311 -13.051 13.471 1154 HA HIS 152 HA HIS 152 14.611 -13.680 13.832 1155 HB2 HIS 152 2HB HIS 152 16.771 -13.359 15.926 1156 HB3 HIS 152 1HB HIS 152 15.227 -14.168 16.172 1157 HD1 HIS 152 1HD HIS 152 15.121 -16.597 15.587 1158 HD2 HIS 152 2HD HIS 152 18.492 -14.737 14.024 1159 HE1 HIS 152 1HE HIS 152 16.524 -18.448 14.621 1160 HE2 HIS 152 2HE HIS 152 18.591 -17.306 13.745 1161 H LEU 153 H LEU 153 13.104 -12.870 15.421 1162 HA LEU 153 HA LEU 153 13.431 -10.427 16.777 1163 HB2 LEU 153 2HB LEU 153 12.752 -10.224 13.978 1164 HB3 LEU 153 1HB LEU 153 11.461 -9.571 14.967 1165 HG LEU 153 HG LEU 153 13.941 -8.570 15.967 1166 HD11 LEU 153 1HD1 LEU 153 13.666 -7.552 13.220 1167 HD12 LEU 153 2HD1 LEU 153 14.356 -9.168 13.375 1168 HD13 LEU 153 3HD1 LEU 153 15.109 -7.805 14.202 1169 HD21 LEU 153 3HD2 LEU 153 12.800 -6.617 16.006 1170 HD22 LEU 153 1HD2 LEU 153 11.423 -7.692 15.766 1171 HD23 LEU 153 2HD2 LEU 153 12.132 -6.846 14.391 1172 H GLU 154 H GLU 154 12.339 -11.277 18.468 1173 HA GLU 154 HA GLU 154 9.482 -11.366 18.325 1174 HB2 GLU 154 2HB GLU 154 10.681 -13.729 17.638 1175 HB3 GLU 154 1HB GLU 154 10.441 -13.945 19.366 1176 HG2 GLU 154 2HG GLU 154 8.020 -13.025 18.709 1177 HG3 GLU 154 1HG GLU 154 8.467 -13.778 17.179 1178 H ASP 155 H ASP 155 9.015 -10.252 20.098 1179 HA ASP 155 HA ASP 155 9.795 -11.222 22.683 1180 HB2 ASP 155 2HB ASP 155 10.874 -9.109 23.420 1181 HB3 ASP 155 1HB ASP 155 11.803 -9.958 22.188 1182 H GLU 156 H GLU 156 7.802 -11.236 23.517 1183 HA GLU 156 HA GLU 156 6.374 -8.688 23.687 1184 HB2 GLU 156 2HB GLU 156 5.482 -11.078 22.241 1185 HB3 GLU 156 1HB GLU 156 4.301 -10.480 23.412 1186 HG2 GLU 156 2HG GLU 156 3.844 -9.493 21.289 1187 HG3 GLU 156 1HG GLU 156 4.471 -8.244 22.364 1188 H LEU 157 H LEU 157 6.304 -12.107 24.687 1189 HA LEU 157 HA LEU 157 6.092 -11.264 27.464 1190 HB2 LEU 157 2HB LEU 157 3.811 -11.999 26.034 1191 HB3 LEU 157 1HB LEU 157 4.226 -13.429 26.961 1192 HG LEU 157 HG LEU 157 4.405 -11.655 28.932 1193 HD11 LEU 157 1HD1 LEU 157 3.957 -9.669 27.735 1194 HD12 LEU 157 2HD1 LEU 157 2.488 -10.035 28.643 1195 HD13 LEU 157 3HD1 LEU 157 2.570 -10.389 26.917 1196 HD21 LEU 157 3HD2 LEU 157 2.979 -13.575 29.021 1197 HD22 LEU 157 1HD2 LEU 157 1.875 -12.872 27.837 1198 HD23 LEU 157 2HD2 LEU 157 2.019 -12.159 29.443 Start of MODEL 29 1 H1 MET 1 1HT MET 1 -44.266 3.401 8.638 2 H2 MET 1 2HT MET 1 -43.913 3.531 6.963 3 H3 MET 1 3HT MET 1 -45.542 3.447 7.494 4 HA MET 1 HA MET 1 -45.227 5.642 7.016 5 HB2 MET 1 2HB MET 1 -45.852 4.792 9.514 6 HB3 MET 1 1HB MET 1 -44.500 5.854 9.876 7 HG2 MET 1 2HG MET 1 -45.624 7.689 8.736 8 HG3 MET 1 1HG MET 1 -46.975 6.625 8.346 9 HE1 MET 1 2HE MET 1 -47.953 9.385 10.974 10 HE2 MET 1 3HE MET 1 -46.968 9.334 9.513 11 HE3 MET 1 1HE MET 1 -46.195 9.447 11.092 12 H HIS 2 H HIS 2 -43.667 6.702 5.978 13 HA HIS 2 HA HIS 2 -41.033 6.944 7.277 14 HB2 HIS 2 2HB HIS 2 -40.141 7.278 4.945 15 HB3 HIS 2 1HB HIS 2 -40.760 5.665 5.277 16 HD1 HIS 2 1HD HIS 2 -42.339 8.874 3.945 17 HD2 HIS 2 2HD HIS 2 -42.156 4.801 3.142 18 HE1 HIS 2 1HE HIS 2 -43.778 8.524 1.913 19 HE2 HIS 2 2HE HIS 2 -43.574 6.068 1.389 20 H HIS 3 H HIS 3 -39.811 8.936 6.491 21 HA HIS 3 HA HIS 3 -41.673 11.219 6.446 22 HB2 HIS 3 2HB HIS 3 -39.732 12.495 7.459 23 HB3 HIS 3 1HB HIS 3 -40.462 11.271 8.494 24 HD1 HIS 3 1HD HIS 3 -37.269 12.336 7.108 25 HD2 HIS 3 2HD HIS 3 -38.874 8.817 8.626 26 HE1 HIS 3 1HE HIS 3 -35.295 10.864 7.623 27 HE2 HIS 3 2HE HIS 3 -36.289 8.770 8.614 28 H HIS 4 H HIS 4 -41.794 12.072 4.480 29 HA HIS 4 HA HIS 4 -41.219 12.959 2.467 30 HB2 HIS 4 2HB HIS 4 -38.747 13.334 4.090 31 HB3 HIS 4 1HB HIS 4 -38.640 13.599 2.353 32 HD1 HIS 4 1HD HIS 4 -41.188 15.064 1.738 33 HD2 HIS 4 2HD HIS 4 -38.939 15.811 5.151 34 HE1 HIS 4 1HE HIS 4 -41.813 17.391 2.459 35 HE2 HIS 4 2HE HIS 4 -40.497 17.793 4.568 36 H HIS 5 H HIS 5 -40.978 10.048 3.002 37 HA HIS 5 HA HIS 5 -40.121 8.128 2.108 38 HB2 HIS 5 2HB HIS 5 -39.916 8.481 -0.543 39 HB3 HIS 5 1HB HIS 5 -41.461 8.324 0.284 40 HD1 HIS 5 1HD HIS 5 -39.653 10.493 -1.968 41 HD2 HIS 5 2HD HIS 5 -42.649 10.974 0.871 42 HE1 HIS 5 1HE HIS 5 -40.722 12.709 -2.489 43 HE2 HIS 5 2HE HIS 5 -42.482 13.014 -0.711 44 H HIS 6 H HIS 6 -38.510 10.011 -0.385 45 HA HIS 6 HA HIS 6 -36.345 9.953 -1.103 46 HB2 HIS 6 2HB HIS 6 -34.749 10.868 0.455 47 HB3 HIS 6 1HB HIS 6 -36.301 11.657 0.716 48 HD1 HIS 6 1HD HIS 6 -34.077 9.020 2.268 49 HD2 HIS 6 2HD HIS 6 -37.282 11.469 3.265 50 HE1 HIS 6 1HE HIS 6 -34.381 8.752 4.750 51 HE2 HIS 6 2HE HIS 6 -36.385 10.171 5.315 52 H HIS 7 H HIS 7 -33.967 9.135 -0.093 53 HA HIS 7 HA HIS 7 -34.136 6.500 1.036 54 HB2 HIS 7 2HB HIS 7 -33.554 6.878 -1.894 55 HB3 HIS 7 1HB HIS 7 -32.956 5.479 -1.008 56 HD1 HIS 7 1HD HIS 7 -35.027 4.159 0.335 57 HD2 HIS 7 2HD HIS 7 -35.969 6.434 -3.014 58 HE1 HIS 7 1HE HIS 7 -37.269 3.322 -0.439 59 HE2 HIS 7 2HE HIS 7 -37.785 4.665 -2.508 60 H MET 8 H MET 8 -31.901 5.435 1.001 61 HA MET 8 HA MET 8 -29.675 7.271 0.758 62 HB2 MET 8 2HB MET 8 -30.797 7.550 3.078 63 HB3 MET 8 1HB MET 8 -30.079 5.975 3.441 64 HG2 MET 8 2HG MET 8 -28.263 7.075 4.068 65 HG3 MET 8 1HG MET 8 -27.988 7.429 2.364 66 HE1 MET 8 3HE MET 8 -28.334 10.154 1.365 67 HE2 MET 8 1HE MET 8 -29.848 10.827 1.974 68 HE3 MET 8 2HE MET 8 -29.804 9.181 1.342 69 H SER 9 H SER 9 -27.668 6.243 0.685 70 HA SER 9 HA SER 9 -27.794 3.300 0.565 71 HB2 SER 9 2HB SER 9 -26.549 5.314 -1.227 72 HB3 SER 9 1HB SER 9 -25.636 3.832 -0.951 73 HG SER 9 HG SER 9 -27.514 2.672 -1.606 74 H ASP 10 H ASP 10 -25.656 2.227 0.938 75 HA ASP 10 HA ASP 10 -24.352 3.489 3.242 76 HB2 ASP 10 2HB ASP 10 -25.390 0.985 2.994 77 HB3 ASP 10 1HB ASP 10 -23.701 0.683 2.596 78 H GLY 11 H GLY 11 -23.712 4.282 0.532 79 HA2 GLY 11 2HA GLY 11 -21.560 5.064 -0.148 80 HA3 GLY 11 1HA GLY 11 -20.844 3.645 0.600 81 H HIS 12 H HIS 12 -20.298 4.561 -2.032 82 HA HIS 12 HA HIS 12 -20.632 2.126 -3.457 83 HB2 HIS 12 2HB HIS 12 -21.911 3.112 -5.386 84 HB3 HIS 12 1HB HIS 12 -22.858 2.891 -3.908 85 HD1 HIS 12 1HD HIS 12 -22.225 5.306 -6.463 86 HD2 HIS 12 2HD HIS 12 -22.951 5.485 -2.376 87 HE1 HIS 12 1HE HIS 12 -22.967 7.666 -6.013 88 HE2 HIS 12 2HE HIS 12 -23.486 7.726 -3.550 89 H ASN 13 H ASN 13 -20.100 5.619 -3.877 90 HA ASN 13 HA ASN 13 -18.170 5.206 -5.974 91 HB2 ASN 13 2HB ASN 13 -17.902 7.633 -5.931 92 HB3 ASN 13 1HB ASN 13 -19.611 7.209 -5.929 93 HD21 ASN 13 1HD2 ASN 13 -20.810 7.469 -4.018 94 HD22 ASN 13 2HD2 ASN 13 -20.278 8.529 -2.762 95 H GLY 14 H GLY 14 -15.955 6.150 -5.816 96 HA2 GLY 14 2HA GLY 14 -14.364 6.935 -3.932 97 HA3 GLY 14 1HA GLY 14 -14.775 5.363 -3.237 98 H LEU 15 H LEU 15 -13.496 3.712 -3.732 99 HA LEU 15 HA LEU 15 -11.877 2.456 -4.671 100 HB2 LEU 15 2HB LEU 15 -12.823 3.920 -7.136 101 HB3 LEU 15 1HB LEU 15 -11.628 2.638 -7.181 102 HG LEU 15 HG LEU 15 -13.940 1.917 -7.779 103 HD11 LEU 15 1HD1 LEU 15 -13.575 -0.157 -6.960 104 HD12 LEU 15 2HD1 LEU 15 -13.295 0.417 -5.316 105 HD13 LEU 15 3HD1 LEU 15 -12.020 0.552 -6.527 106 HD21 LEU 15 3HD2 LEU 15 -15.634 1.726 -6.124 107 HD22 LEU 15 1HD2 LEU 15 -15.055 3.391 -6.080 108 HD23 LEU 15 2HD2 LEU 15 -14.535 2.243 -4.845 109 H GLY 16 H GLY 16 -10.551 4.035 -7.189 110 HA2 GLY 16 2HA GLY 16 -8.586 5.370 -5.447 111 HA3 GLY 16 1HA GLY 16 -8.175 4.610 -6.974 112 H LYS 17 H LYS 17 -9.806 7.352 -5.479 113 HA LYS 17 HA LYS 17 -10.763 8.770 -7.591 114 HB2 LYS 17 2HB LYS 17 -10.378 9.339 -4.986 115 HB3 LYS 17 1HB LYS 17 -9.132 10.357 -5.692 116 HG2 LYS 17 2HG LYS 17 -12.066 10.420 -6.363 117 HG3 LYS 17 1HG LYS 17 -11.191 11.597 -5.382 118 HD2 LYS 17 2HD LYS 17 -9.696 11.559 -7.663 119 HD3 LYS 17 1HD LYS 17 -11.323 11.293 -8.296 120 HE2 LYS 17 2HE LYS 17 -12.060 13.353 -7.649 121 HE3 LYS 17 1HE LYS 17 -10.965 13.431 -6.268 122 HZ1 LYS 17 3HZ LYS 17 -10.591 14.877 -8.418 123 HZ2 LYS 17 1HZ LYS 17 -9.784 13.484 -8.942 124 HZ3 LYS 17 2HZ LYS 17 -9.290 14.268 -7.527 125 H GLY 18 H GLY 18 -9.689 8.632 -9.523 126 HA2 GLY 18 2HA GLY 18 -8.261 9.466 -11.133 127 HA3 GLY 18 1HA GLY 18 -7.439 10.387 -9.867 128 H PHE 19 H PHE 19 -5.496 9.757 -10.960 129 HA PHE 19 HA PHE 19 -3.686 8.431 -11.402 130 HB2 PHE 19 2HB PHE 19 -2.881 7.206 -9.365 131 HB3 PHE 19 1HB PHE 19 -3.265 8.912 -9.105 132 HD1 PHE 19 1HD PHE 19 -4.771 5.519 -8.838 133 HD2 PHE 19 2HD PHE 19 -4.617 9.497 -7.336 134 HE1 PHE 19 1HE PHE 19 -6.264 4.880 -6.989 135 HE2 PHE 19 2HE PHE 19 -6.112 8.865 -5.488 136 HZ PHE 19 HZ PHE 19 -6.937 6.551 -5.312 137 H GLY 20 H GLY 20 -6.320 7.197 -12.149 138 HA2 GLY 20 2HA GLY 20 -5.775 4.980 -13.414 139 HA3 GLY 20 1HA GLY 20 -5.706 4.349 -11.769 140 H ASP 21 H ASP 21 -7.525 3.518 -10.972 141 HA ASP 21 HA ASP 21 -10.091 4.648 -11.359 142 HB2 ASP 21 2HB ASP 21 -10.880 2.365 -12.534 143 HB3 ASP 21 1HB ASP 21 -10.424 3.808 -13.452 144 H HIS 22 H HIS 22 -9.384 1.174 -11.300 145 HA HIS 22 HA HIS 22 -9.976 1.093 -8.428 146 HB2 HIS 22 2HB HIS 22 -11.482 -0.875 -8.827 147 HB3 HIS 22 1HB HIS 22 -12.117 0.649 -9.436 148 HD1 HIS 22 1HD HIS 22 -13.045 0.508 -11.718 149 HD2 HIS 22 2HD HIS 22 -10.122 -2.380 -11.071 150 HE1 HIS 22 1HE HIS 22 -12.966 -0.857 -13.829 151 HE2 HIS 22 2HE HIS 22 -11.243 -2.640 -13.387 152 H ILE 23 H ILE 23 -8.738 -0.361 -7.327 153 HA ILE 23 HA ILE 23 -7.825 -2.812 -8.076 154 HB ILE 23 HB ILE 23 -6.718 -2.041 -9.994 155 HG12 ILE 23 2HG1 ILE 23 -4.605 -2.234 -7.842 156 HG13 ILE 23 1HG1 ILE 23 -5.314 -3.583 -8.724 157 HG21 ILE 23 1HG2 ILE 23 -6.059 0.029 -10.313 158 HG22 ILE 23 2HG2 ILE 23 -4.859 -0.097 -9.028 159 HG23 ILE 23 3HG2 ILE 23 -6.514 0.383 -8.649 160 HD11 ILE 23 3HD1 ILE 23 -3.899 -3.323 -10.414 161 HD12 ILE 23 1HD1 ILE 23 -3.009 -2.208 -9.378 162 HD13 ILE 23 2HD1 ILE 23 -4.212 -1.589 -10.512 163 H HIS 24 H HIS 24 -5.430 -0.372 -7.154 164 HA HIS 24 HA HIS 24 -5.036 -1.715 -4.630 165 HB2 HIS 24 2HB HIS 24 -3.602 0.641 -5.869 166 HB3 HIS 24 1HB HIS 24 -3.116 -0.184 -4.381 167 HD1 HIS 24 1HD HIS 24 -1.578 0.047 -7.257 168 HD2 HIS 24 2HD HIS 24 -3.442 -3.276 -5.599 169 HE1 HIS 24 1HE HIS 24 -0.496 -1.944 -8.348 170 HE2 HIS 24 2HE HIS 24 -1.580 -3.944 -7.266 171 H TRP 25 H TRP 25 -7.541 -0.405 -4.925 172 HA TRP 25 HA TRP 25 -7.484 1.274 -2.584 173 HB2 TRP 25 2HB TRP 25 -9.073 2.843 -4.177 174 HB3 TRP 25 1HB TRP 25 -7.406 3.201 -3.728 175 HD1 TRP 25 HD TRP 25 -9.544 2.082 -6.646 176 HE1 TRP 25 1HE TRP 25 -8.127 2.151 -8.773 177 HE3 TRP 25 3HE TRP 25 -4.969 2.896 -4.542 178 HZ2 TRP 25 2HZ TRP 25 -5.412 2.512 -9.495 179 HZ3 TRP 25 3HZ TRP 25 -3.007 3.100 -6.020 180 HH2 TRP 25 HH TRP 25 -3.225 2.902 -8.445 181 H ARG 26 H ARG 26 -9.084 -0.821 -4.746 182 HA ARG 26 HA ARG 26 -11.695 -0.586 -4.690 183 HB2 ARG 26 2HB ARG 26 -10.019 -2.728 -4.749 184 HB3 ARG 26 1HB ARG 26 -10.972 -3.063 -3.304 185 HG2 ARG 26 2HG ARG 26 -12.048 -2.632 -6.073 186 HG3 ARG 26 1HG ARG 26 -11.830 -4.185 -5.239 187 HD2 ARG 26 2HD ARG 26 -13.750 -3.948 -4.128 188 HD3 ARG 26 1HD ARG 26 -13.336 -2.300 -3.628 189 HE ARG 26 HE ARG 26 -14.178 -2.462 -6.362 190 HH11 ARG 26 1HH1 ARG 26 -15.295 -2.252 -3.061 191 HH12 ARG 26 2HH1 ARG 26 -16.812 -1.535 -3.489 192 HH21 ARG 26 1HH2 ARG 26 -16.174 -1.520 -6.926 193 HH22 ARG 26 2HH2 ARG 26 -17.311 -1.120 -5.683 194 H THR 27 H THR 27 -9.925 -1.523 -1.725 195 HA THR 27 HA THR 27 -11.039 0.016 0.144 196 HB THR 27 HB THR 27 -13.003 -2.125 -0.599 197 HG1 THR 27 1HG THR 27 -13.341 0.506 0.399 198 HG21 THR 27 3HG2 THR 27 -14.135 -1.971 1.527 199 HG22 THR 27 1HG2 THR 27 -12.858 -0.934 2.162 200 HG23 THR 27 2HG2 THR 27 -12.509 -2.613 1.754 201 H LEU 28 H LEU 28 -10.277 -0.470 2.151 202 HA LEU 28 HA LEU 28 -8.314 -2.494 2.361 203 HB2 LEU 28 2HB LEU 28 -8.353 -0.294 3.588 204 HB3 LEU 28 1HB LEU 28 -9.596 -0.982 4.635 205 HG LEU 28 HG LEU 28 -7.041 -2.484 4.356 206 HD11 LEU 28 1HD1 LEU 28 -7.069 -0.398 6.439 207 HD12 LEU 28 2HD1 LEU 28 -6.785 0.154 4.788 208 HD13 LEU 28 3HD1 LEU 28 -5.725 -1.058 5.506 209 HD21 LEU 28 3HD2 LEU 28 -7.659 -2.465 6.961 210 HD22 LEU 28 1HD2 LEU 28 -8.353 -3.613 5.815 211 HD23 LEU 28 2HD2 LEU 28 -9.261 -2.175 6.282 212 H GLU 29 H GLU 29 -11.635 -2.236 3.527 213 HA GLU 29 HA GLU 29 -11.734 -4.400 5.248 214 HB2 GLU 29 2HB GLU 29 -13.564 -2.624 4.226 215 HB3 GLU 29 1HB GLU 29 -14.110 -4.151 3.546 216 HG2 GLU 29 2HG GLU 29 -13.647 -4.828 6.146 217 HG3 GLU 29 1HG GLU 29 -14.215 -3.166 6.294 218 H ASP 30 H ASP 30 -12.851 -4.497 1.858 219 HA ASP 30 HA ASP 30 -12.992 -7.297 1.720 220 HB2 ASP 30 2HB ASP 30 -13.802 -5.276 0.106 221 HB3 ASP 30 1HB ASP 30 -12.392 -5.856 -0.795 222 H GLY 31 H GLY 31 -10.278 -5.216 1.672 223 HA2 GLY 31 2HA GLY 31 -8.586 -6.916 0.087 224 HA3 GLY 31 1HA GLY 31 -8.077 -5.515 1.034 225 H LYS 32 H LYS 32 -9.179 -6.523 3.552 226 HA LYS 32 HA LYS 32 -6.931 -8.144 4.282 227 HB2 LYS 32 2HB LYS 32 -7.669 -7.921 6.543 228 HB3 LYS 32 1HB LYS 32 -7.896 -6.369 5.751 229 HG2 LYS 32 2HG LYS 32 -9.892 -6.473 6.779 230 HG3 LYS 32 1HG LYS 32 -10.325 -7.420 5.359 231 HD2 LYS 32 2HD LYS 32 -10.034 -9.467 6.525 232 HD3 LYS 32 1HD LYS 32 -9.252 -8.655 7.884 233 HE2 LYS 32 2HE LYS 32 -11.243 -7.792 8.684 234 HE3 LYS 32 1HE LYS 32 -12.044 -7.918 7.118 235 HZ1 LYS 32 3HZ LYS 32 -12.308 -10.220 7.371 236 HZ2 LYS 32 1HZ LYS 32 -12.735 -9.569 8.873 237 HZ3 LYS 32 2HZ LYS 32 -11.225 -10.304 8.668 238 H LYS 33 H LYS 33 -10.439 -8.713 4.078 239 HA LYS 33 HA LYS 33 -10.204 -11.425 4.953 240 HB2 LYS 33 2HB LYS 33 -12.587 -11.593 4.054 241 HB3 LYS 33 1HB LYS 33 -12.301 -10.484 5.385 242 HG2 LYS 33 2HG LYS 33 -11.945 -8.949 3.083 243 HG3 LYS 33 1HG LYS 33 -13.352 -9.973 2.754 244 HD2 LYS 33 2HD LYS 33 -14.003 -9.238 5.214 245 HD3 LYS 33 1HD LYS 33 -12.970 -7.864 4.823 246 HE2 LYS 33 2HE LYS 33 -15.469 -7.645 4.335 247 HE3 LYS 33 1HE LYS 33 -14.349 -7.186 3.057 248 HZ1 LYS 33 3HZ LYS 33 -16.376 -8.692 2.534 249 HZ2 LYS 33 1HZ LYS 33 -15.395 -9.931 3.139 250 HZ3 LYS 33 2HZ LYS 33 -14.883 -9.019 1.809 251 H GLU 34 H GLU 34 -9.868 -9.816 1.926 252 HA GLU 34 HA GLU 34 -10.227 -12.253 0.381 253 HB2 GLU 34 2HB GLU 34 -11.007 -10.116 -0.548 254 HB3 GLU 34 1HB GLU 34 -9.361 -9.487 -0.489 255 HG2 GLU 34 2HG GLU 34 -8.726 -10.592 -2.336 256 HG3 GLU 34 1HG GLU 34 -9.701 -12.018 -1.950 257 H ALA 35 H ALA 35 -7.620 -10.014 1.256 258 HA ALA 35 HA ALA 35 -5.534 -11.215 -0.143 259 HB1 ALA 35 1HB ALA 35 -4.098 -10.239 1.744 260 HB2 ALA 35 2HB ALA 35 -5.614 -9.618 2.395 261 HB3 ALA 35 3HB ALA 35 -5.076 -9.122 0.791 262 H ALA 36 H ALA 36 -7.085 -12.118 2.847 263 HA ALA 36 HA ALA 36 -5.160 -13.860 3.894 264 HB1 ALA 36 1HB ALA 36 -7.220 -14.982 4.945 265 HB2 ALA 36 2HB ALA 36 -8.141 -13.701 4.159 266 HB3 ALA 36 3HB ALA 36 -6.896 -13.294 5.341 267 H ALA 37 H ALA 37 -7.564 -14.303 1.380 268 HA ALA 37 HA ALA 37 -7.695 -17.051 1.185 269 HB1 ALA 37 1HB ALA 37 -7.587 -15.195 -1.186 270 HB2 ALA 37 2HB ALA 37 -9.003 -15.389 -0.153 271 HB3 ALA 37 3HB ALA 37 -8.391 -16.760 -1.077 272 H SER 38 H SER 38 -5.615 -15.080 -0.940 273 HA SER 38 HA SER 38 -3.945 -17.343 -1.530 274 HB2 SER 38 2HB SER 38 -3.908 -14.435 -2.319 275 HB3 SER 38 1HB SER 38 -2.560 -15.511 -2.723 276 HG SER 38 HG SER 38 -5.281 -15.944 -3.421 277 H GLY 39 H GLY 39 -3.885 -14.669 0.687 278 HA2 GLY 39 2HA GLY 39 -2.591 -14.621 2.653 279 HA3 GLY 39 1HA GLY 39 -1.485 -15.789 1.927 280 H LEU 40 H LEU 40 -2.405 -13.085 -0.005 281 HA LEU 40 HA LEU 40 0.327 -12.110 0.078 282 HB2 LEU 40 2HB LEU 40 -0.120 -10.995 -1.895 283 HB3 LEU 40 1HB LEU 40 -1.166 -12.392 -2.026 284 HG LEU 40 HG LEU 40 -2.760 -10.477 -0.796 285 HD11 LEU 40 1HD1 LEU 40 -1.039 -8.815 -1.326 286 HD12 LEU 40 2HD1 LEU 40 -2.561 -8.507 -2.163 287 HD13 LEU 40 3HD1 LEU 40 -1.200 -9.218 -3.030 288 HD21 LEU 40 3HD2 LEU 40 -3.466 -12.097 -2.487 289 HD22 LEU 40 1HD2 LEU 40 -2.574 -11.201 -3.718 290 HD23 LEU 40 2HD2 LEU 40 -3.960 -10.458 -2.917 291 HA PRO 41 HA PRO 41 -0.539 -8.634 2.647 292 HB2 PRO 41 2HB PRO 41 1.190 -6.783 1.363 293 HB3 PRO 41 1HB PRO 41 1.571 -7.858 2.708 294 HG2 PRO 41 2HG PRO 41 2.614 -8.025 0.125 295 HG3 PRO 41 1HG PRO 41 2.697 -9.286 1.365 296 HD2 PRO 41 2HD PRO 41 0.872 -9.038 -0.973 297 HD3 PRO 41 1HD PRO 41 1.518 -10.495 -0.188 298 H LEU 42 H LEU 42 -0.693 -6.073 2.527 299 HA LEU 42 HA LEU 42 -2.832 -5.537 0.595 300 HB2 LEU 42 2HB LEU 42 -2.299 -4.706 3.380 301 HB3 LEU 42 1HB LEU 42 -3.017 -3.490 2.340 302 HG LEU 42 HG LEU 42 -4.796 -5.226 1.778 303 HD11 LEU 42 1HD1 LEU 42 -3.426 -6.576 4.086 304 HD12 LEU 42 2HD1 LEU 42 -3.814 -7.241 2.500 305 HD13 LEU 42 3HD1 LEU 42 -5.106 -6.901 3.652 306 HD21 LEU 42 3HD2 LEU 42 -6.144 -4.404 3.431 307 HD22 LEU 42 1HD2 LEU 42 -4.807 -3.258 3.530 308 HD23 LEU 42 2HD2 LEU 42 -4.914 -4.589 4.681 309 H MET 43 H MET 43 -2.904 -3.647 -0.580 310 HA MET 43 HA MET 43 -0.307 -2.353 -1.000 311 HB2 MET 43 2HB MET 43 -1.534 -3.528 -2.891 312 HB3 MET 43 1HB MET 43 -2.729 -2.231 -2.810 313 HG2 MET 43 2HG MET 43 -1.060 -1.877 -4.572 314 HG3 MET 43 1HG MET 43 -1.037 -0.599 -3.360 315 HE1 MET 43 3HE MET 43 2.013 0.004 -2.387 316 HE2 MET 43 1HE MET 43 1.707 -1.216 -1.152 317 HE3 MET 43 2HE MET 43 0.386 -0.205 -1.739 318 H VAL 44 H VAL 44 -0.417 -0.803 0.678 319 HA VAL 44 HA VAL 44 -2.688 0.997 0.686 320 HB VAL 44 HB VAL 44 -0.281 0.808 2.483 321 HG11 VAL 44 1HG1 VAL 44 -1.551 2.528 3.871 322 HG12 VAL 44 2HG1 VAL 44 -2.456 2.883 2.401 323 HG13 VAL 44 3HG1 VAL 44 -0.709 3.122 2.441 324 HG21 VAL 44 3HG2 VAL 44 -1.814 0.053 4.132 325 HG22 VAL 44 1HG2 VAL 44 -2.154 -0.865 2.667 326 HG23 VAL 44 2HG2 VAL 44 -3.205 0.471 3.132 327 H ILE 45 H ILE 45 -2.740 2.499 -0.792 328 HA ILE 45 HA ILE 45 -0.288 4.031 -1.372 329 HB ILE 45 HB ILE 45 -2.608 3.469 -3.227 330 HG12 ILE 45 2HG1 ILE 45 0.240 2.595 -3.641 331 HG13 ILE 45 1HG1 ILE 45 -0.887 1.612 -2.694 332 HG21 ILE 45 1HG2 ILE 45 -0.548 5.497 -3.272 333 HG22 ILE 45 2HG2 ILE 45 -1.981 5.321 -4.283 334 HG23 ILE 45 3HG2 ILE 45 -0.493 4.476 -4.710 335 HD11 ILE 45 3HD1 ILE 45 -0.983 0.720 -4.838 336 HD12 ILE 45 1HD1 ILE 45 -0.982 2.309 -5.604 337 HD13 ILE 45 2HD1 ILE 45 -2.410 1.750 -4.738 338 H ILE 46 H ILE 46 -0.474 5.915 -0.261 339 HA ILE 46 HA ILE 46 -3.108 7.216 -0.239 340 HB ILE 46 HB ILE 46 -0.877 7.896 1.647 341 HG12 ILE 46 2HG1 ILE 46 -2.951 6.119 2.702 342 HG13 ILE 46 1HG1 ILE 46 -1.935 5.355 1.484 343 HG21 ILE 46 1HG2 ILE 46 -2.661 8.701 3.047 344 HG22 ILE 46 2HG2 ILE 46 -3.863 8.067 1.928 345 HG23 ILE 46 3HG2 ILE 46 -2.828 9.403 1.435 346 HD11 ILE 46 3HD1 ILE 46 -1.231 5.151 3.918 347 HD12 ILE 46 1HD1 ILE 46 -0.775 6.850 3.806 348 HD13 ILE 46 2HD1 ILE 46 0.000 5.657 2.762 349 H HIS 47 H HIS 47 -3.276 9.420 -0.642 350 HA HIS 47 HA HIS 47 -0.872 10.734 -1.717 351 HB2 HIS 47 2HB HIS 47 -2.348 11.691 -3.542 352 HB3 HIS 47 1HB HIS 47 -1.972 9.967 -3.681 353 HD1 HIS 47 1HD HIS 47 -4.660 12.040 -4.310 354 HD2 HIS 47 2HD HIS 47 -4.294 8.538 -2.102 355 HE1 HIS 47 1HE HIS 47 -6.983 11.090 -4.166 356 HE2 HIS 47 2HE HIS 47 -6.754 9.028 -2.738 357 H LYS 48 H LYS 48 -0.633 12.195 -0.073 358 HA LYS 48 HA LYS 48 -2.858 14.107 0.253 359 HB2 LYS 48 2HB LYS 48 -1.250 12.722 2.345 360 HB3 LYS 48 1HB LYS 48 -1.799 14.359 2.654 361 HG2 LYS 48 2HG LYS 48 -4.123 13.463 1.994 362 HG3 LYS 48 1HG LYS 48 -3.411 11.873 2.267 363 HD2 LYS 48 2HD LYS 48 -2.616 13.256 4.493 364 HD3 LYS 48 1HD LYS 48 -4.218 13.931 4.187 365 HE2 LYS 48 2HE LYS 48 -5.279 11.951 4.590 366 HE3 LYS 48 1HE LYS 48 -3.912 10.982 4.042 367 HZ1 LYS 48 3HZ LYS 48 -4.036 12.473 6.609 368 HZ2 LYS 48 1HZ LYS 48 -2.757 11.493 6.088 369 HZ3 LYS 48 2HZ LYS 48 -4.263 10.805 6.436 370 H SER 49 H SER 49 -2.358 16.233 0.390 371 HA SER 49 HA SER 49 -1.190 18.114 -0.198 372 HB2 SER 49 2HB SER 49 0.879 17.004 1.700 373 HB3 SER 49 1HB SER 49 0.512 18.698 1.372 374 HG SER 49 HG SER 49 -1.343 18.531 2.503 375 H TRP 50 H TRP 50 -0.454 18.253 -2.226 376 HA TRP 50 HA TRP 50 0.843 17.943 -4.091 377 HB2 TRP 50 2HB TRP 50 3.291 17.918 -2.383 378 HB3 TRP 50 1HB TRP 50 2.951 18.834 -3.858 379 HD1 TRP 50 HD TRP 50 1.228 21.005 -3.500 380 HE1 TRP 50 1HE TRP 50 1.081 22.621 -1.503 381 HE3 TRP 50 3HE TRP 50 3.568 18.146 0.033 382 HZ2 TRP 50 2HZ TRP 50 1.854 22.677 1.212 383 HZ3 TRP 50 3HZ TRP 50 3.824 19.053 2.306 384 HH2 TRP 50 HH TRP 50 2.983 21.273 2.881 385 H CYS 51 H CYS 51 0.211 15.793 -4.557 386 HA CYS 51 HA CYS 51 2.203 13.757 -3.812 387 HB2 CYS 51 2HB CYS 51 0.239 12.959 -2.882 388 HB3 CYS 51 1HB CYS 51 -0.766 13.641 -4.155 389 H GLY 52 H GLY 52 3.560 13.360 -5.447 390 HA2 GLY 52 2HA GLY 52 2.666 13.746 -8.208 391 HA3 GLY 52 1HA GLY 52 4.330 13.476 -7.680 392 H ALA 53 H ALA 53 3.475 11.189 -5.983 393 HA ALA 53 HA ALA 53 3.941 9.103 -7.789 394 HB1 ALA 53 1HB ALA 53 4.384 8.909 -5.388 395 HB2 ALA 53 2HB ALA 53 3.346 7.602 -5.957 396 HB3 ALA 53 3HB ALA 53 2.650 8.955 -5.066 397 H CYS 54 H CYS 54 1.105 10.840 -7.065 398 HA CYS 54 HA CYS 54 -0.545 8.804 -8.369 399 HB2 CYS 54 2HB CYS 54 -2.485 10.018 -7.379 400 HB3 CYS 54 1HB CYS 54 -1.378 9.351 -6.169 401 H LYS 55 H LYS 55 0.714 12.018 -8.593 402 HA LYS 55 HA LYS 55 -1.121 13.121 -10.407 403 HB2 LYS 55 2HB LYS 55 0.296 14.918 -10.545 404 HB3 LYS 55 1HB LYS 55 0.869 14.195 -9.051 405 HG2 LYS 55 2HG LYS 55 2.695 13.115 -10.275 406 HG3 LYS 55 1HG LYS 55 2.120 13.865 -11.773 407 HD2 LYS 55 2HD LYS 55 2.316 16.023 -10.125 408 HD3 LYS 55 1HD LYS 55 3.641 15.017 -9.538 409 HE2 LYS 55 2HE LYS 55 4.344 14.785 -11.966 410 HE3 LYS 55 1HE LYS 55 3.200 16.081 -12.314 411 HZ1 LYS 55 3HZ LYS 55 4.572 17.160 -10.309 412 HZ2 LYS 55 1HZ LYS 55 4.997 17.355 -11.936 413 HZ3 LYS 55 2HZ LYS 55 5.781 16.194 -10.991 414 H ALA 56 H ALA 56 1.963 11.419 -10.990 415 HA ALA 56 HA ALA 56 1.503 11.444 -13.860 416 HB1 ALA 56 1HB ALA 56 3.642 10.512 -14.085 417 HB2 ALA 56 2HB ALA 56 3.621 9.846 -12.452 418 HB3 ALA 56 3HB ALA 56 3.783 11.586 -12.692 419 H LEU 57 H LEU 57 0.813 9.471 -11.180 420 HA LEU 57 HA LEU 57 0.724 6.895 -12.165 421 HB2 LEU 57 2HB LEU 57 0.129 8.131 -9.846 422 HB3 LEU 57 1HB LEU 57 -1.483 7.771 -10.410 423 HG LEU 57 HG LEU 57 -0.914 5.379 -10.493 424 HD11 LEU 57 1HD1 LEU 57 1.631 6.018 -10.754 425 HD12 LEU 57 2HD1 LEU 57 1.140 4.504 -9.993 426 HD13 LEU 57 3HD1 LEU 57 1.606 5.883 -8.997 427 HD21 LEU 57 3HD2 LEU 57 -0.106 5.745 -7.783 428 HD22 LEU 57 1HD2 LEU 57 -1.688 5.295 -8.421 429 HD23 LEU 57 2HD2 LEU 57 -1.273 6.996 -8.212 430 H LYS 58 H LYS 58 -1.782 9.401 -12.338 431 HA LYS 58 HA LYS 58 -3.890 7.963 -13.291 432 HB2 LYS 58 2HB LYS 58 -4.000 10.312 -14.833 433 HB3 LYS 58 1HB LYS 58 -4.818 9.975 -13.320 434 HG2 LYS 58 2HG LYS 58 -2.022 10.905 -13.131 435 HG3 LYS 58 1HG LYS 58 -3.219 12.070 -13.689 436 HD2 LYS 58 2HD LYS 58 -3.620 10.419 -11.209 437 HD3 LYS 58 1HD LYS 58 -2.796 11.979 -11.183 438 HE2 LYS 58 2HE LYS 58 -4.760 13.073 -12.073 439 HE3 LYS 58 1HE LYS 58 -5.583 11.522 -12.235 440 HZ1 LYS 58 3HZ LYS 58 -5.256 11.316 -9.745 441 HZ2 LYS 58 1HZ LYS 58 -6.396 12.453 -10.268 442 HZ3 LYS 58 2HZ LYS 58 -4.869 12.962 -9.753 443 HA PRO 59 HA PRO 59 -2.768 8.260 -17.880 444 HB2 PRO 59 2HB PRO 59 -0.606 9.599 -18.740 445 HB3 PRO 59 1HB PRO 59 -2.130 10.415 -18.337 446 HG2 PRO 59 2HG PRO 59 0.361 10.138 -16.696 447 HG3 PRO 59 1HG PRO 59 -0.663 11.557 -16.949 448 HD2 PRO 59 2HD PRO 59 -0.807 9.979 -14.729 449 HD3 PRO 59 1HD PRO 59 -2.180 10.911 -15.371 450 H LYS 60 H LYS 60 -0.074 7.641 -15.727 451 HA LYS 60 HA LYS 60 1.077 5.842 -17.743 452 HB2 LYS 60 2HB LYS 60 3.125 5.942 -16.624 453 HB3 LYS 60 1HB LYS 60 2.501 7.581 -16.521 454 HG2 LYS 60 2HG LYS 60 1.557 6.780 -14.239 455 HG3 LYS 60 1HG LYS 60 2.784 5.523 -14.380 456 HD2 LYS 60 2HD LYS 60 3.181 8.511 -14.299 457 HD3 LYS 60 1HD LYS 60 3.774 7.306 -13.158 458 HE2 LYS 60 2HE LYS 60 5.661 7.808 -14.418 459 HE3 LYS 60 1HE LYS 60 5.049 6.346 -15.190 460 HZ1 LYS 60 3HZ LYS 60 4.523 7.450 -17.061 461 HZ2 LYS 60 1HZ LYS 60 5.682 8.558 -16.520 462 HZ3 LYS 60 2HZ LYS 60 4.039 8.852 -16.249 463 H PHE 61 H PHE 61 0.123 5.860 -14.315 464 HA PHE 61 HA PHE 61 0.455 3.040 -14.043 465 HB2 PHE 61 2HB PHE 61 0.542 4.711 -12.148 466 HB3 PHE 61 1HB PHE 61 -1.213 4.838 -12.291 467 HD1 PHE 61 2HD PHE 61 1.531 2.432 -11.642 468 HD2 PHE 61 1HD PHE 61 -2.613 3.305 -11.234 469 HE1 PHE 61 2HE PHE 61 1.269 0.480 -10.169 470 HE2 PHE 61 1HE PHE 61 -2.884 1.353 -9.759 471 HZ PHE 61 HZ PHE 61 -0.941 -0.062 -9.225 472 H ALA 62 H ALA 62 -2.048 5.091 -15.263 473 HA ALA 62 HA ALA 62 -4.232 3.334 -14.903 474 HB1 ALA 62 1HB ALA 62 -4.842 5.469 -15.634 475 HB2 ALA 62 2HB ALA 62 -5.050 4.482 -17.083 476 HB3 ALA 62 3HB ALA 62 -3.613 5.493 -16.903 477 H GLU 63 H GLU 63 -1.414 3.324 -16.809 478 HA GLU 63 HA GLU 63 -2.112 1.503 -18.863 479 HB2 GLU 63 2HB GLU 63 -0.074 3.069 -18.724 480 HB3 GLU 63 1HB GLU 63 0.632 1.855 -17.651 481 HG2 GLU 63 2HG GLU 63 0.218 0.188 -19.529 482 HG3 GLU 63 1HG GLU 63 -0.085 1.588 -20.556 483 H SER 64 H SER 64 -1.749 1.193 -15.542 484 HA SER 64 HA SER 64 -0.626 -1.308 -15.218 485 HB2 SER 64 2HB SER 64 -2.562 0.315 -13.637 486 HB3 SER 64 1HB SER 64 -2.284 -1.351 -13.177 487 HG SER 64 HG SER 64 -0.281 0.636 -13.473 488 H THR 65 H THR 65 -3.000 -0.841 -17.297 489 HA THR 65 HA THR 65 -5.111 -2.515 -16.729 490 HB THR 65 HB THR 65 -4.626 -3.169 -19.338 491 HG1 THR 65 1HG THR 65 -3.717 -1.287 -20.281 492 HG21 THR 65 3HG2 THR 65 -6.648 -2.174 -19.072 493 HG22 THR 65 1HG2 THR 65 -5.764 -0.845 -19.823 494 HG23 THR 65 2HG2 THR 65 -6.003 -0.868 -18.076 495 H GLU 66 H GLU 66 -1.814 -3.244 -17.637 496 HA GLU 66 HA GLU 66 -2.229 -6.106 -17.677 497 HB2 GLU 66 2HB GLU 66 0.317 -6.150 -17.731 498 HB3 GLU 66 1HB GLU 66 -0.474 -5.374 -19.105 499 HG2 GLU 66 2HG GLU 66 0.161 -3.574 -16.900 500 HG3 GLU 66 1HG GLU 66 1.567 -4.315 -17.661 501 H ILE 67 H ILE 67 -1.184 -3.586 -15.513 502 HA ILE 67 HA ILE 67 -0.221 -5.329 -13.501 503 HB ILE 67 HB ILE 67 -0.536 -2.481 -13.787 504 HG12 ILE 67 2HG1 ILE 67 1.277 -4.080 -11.990 505 HG13 ILE 67 1HG1 ILE 67 1.559 -3.887 -13.723 506 HG21 ILE 67 1HG2 ILE 67 -0.723 -1.869 -11.469 507 HG22 ILE 67 2HG2 ILE 67 -0.872 -3.559 -10.998 508 HG23 ILE 67 3HG2 ILE 67 -2.150 -2.795 -11.935 509 HD11 ILE 67 3HD1 ILE 67 1.118 -1.328 -12.461 510 HD12 ILE 67 1HD1 ILE 67 2.494 -1.899 -13.405 511 HD13 ILE 67 2HD1 ILE 67 2.424 -2.211 -11.671 512 H SER 68 H SER 68 -3.288 -4.667 -14.624 513 HA SER 68 HA SER 68 -4.798 -4.958 -12.237 514 HB2 SER 68 2HB SER 68 -6.686 -5.102 -13.632 515 HB3 SER 68 1HB SER 68 -5.566 -4.114 -14.571 516 HG SER 68 HG SER 68 -5.954 -5.569 -16.048 517 H GLU 69 H GLU 69 -2.874 -7.109 -14.035 518 HA GLU 69 HA GLU 69 -4.204 -9.423 -12.797 519 HB2 GLU 69 2HB GLU 69 -2.823 -10.623 -14.744 520 HB3 GLU 69 1HB GLU 69 -4.458 -10.025 -14.968 521 HG2 GLU 69 2HG GLU 69 -3.378 -7.871 -15.803 522 HG3 GLU 69 1HG GLU 69 -1.880 -8.798 -15.882 523 H LEU 70 H LEU 70 -0.955 -8.663 -14.163 524 HA LEU 70 HA LEU 70 0.353 -10.504 -12.472 525 HB2 LEU 70 2HB LEU 70 2.276 -9.940 -13.519 526 HB3 LEU 70 1HB LEU 70 1.135 -9.329 -14.703 527 HG LEU 70 HG LEU 70 2.832 -7.721 -14.529 528 HD11 LEU 70 1HD1 LEU 70 1.107 -6.320 -14.611 529 HD12 LEU 70 2HD1 LEU 70 1.560 -5.954 -12.938 530 HD13 LEU 70 3HD1 LEU 70 0.274 -7.118 -13.271 531 HD21 LEU 70 3HD2 LEU 70 3.440 -8.762 -12.129 532 HD22 LEU 70 1HD2 LEU 70 2.650 -7.270 -11.617 533 HD23 LEU 70 2HD2 LEU 70 4.044 -7.205 -12.695 534 H SER 71 H SER 71 -0.900 -7.444 -11.762 535 HA SER 71 HA SER 71 0.773 -7.299 -9.342 536 HB2 SER 71 2HB SER 71 0.011 -5.249 -11.279 537 HB3 SER 71 1HB SER 71 -0.268 -4.789 -9.598 538 HG SER 71 HG SER 71 2.145 -5.488 -10.874 539 H HIS 72 H HIS 72 -2.381 -7.700 -10.537 540 HA HIS 72 HA HIS 72 -3.983 -6.455 -8.659 541 HB2 HIS 72 2HB HIS 72 -4.395 -8.289 -10.711 542 HB3 HIS 72 1HB HIS 72 -4.942 -9.143 -9.261 543 HD1 HIS 72 1HD HIS 72 -7.415 -8.959 -9.313 544 HD2 HIS 72 2HD HIS 72 -5.571 -5.341 -10.192 545 HE1 HIS 72 1HE HIS 72 -9.279 -7.281 -9.492 546 HE2 HIS 72 2HE HIS 72 -8.130 -5.082 -9.930 547 H ASN 73 H ASN 73 -1.739 -8.925 -8.261 548 HA ASN 73 HA ASN 73 -2.594 -10.506 -6.224 549 HB2 ASN 73 2HB ASN 73 0.125 -9.170 -6.332 550 HB3 ASN 73 1HB ASN 73 -0.279 -10.725 -5.609 551 HD21 ASN 73 1HD2 ASN 73 0.211 -8.992 -8.596 552 HD22 ASN 73 2HD2 ASN 73 0.367 -10.400 -9.611 553 H PHE 74 H PHE 74 -0.708 -7.544 -5.652 554 HA PHE 74 HA PHE 74 -1.325 -7.217 -2.961 555 HB2 PHE 74 2HB PHE 74 -0.568 -5.230 -5.105 556 HB3 PHE 74 1HB PHE 74 -0.746 -4.791 -3.404 557 HD1 PHE 74 1HD PHE 74 1.115 -7.051 -5.681 558 HD2 PHE 74 2HD PHE 74 1.008 -5.088 -1.905 559 HE1 PHE 74 1HE PHE 74 3.420 -7.776 -5.244 560 HE2 PHE 74 2HE PHE 74 3.319 -5.805 -1.465 561 HZ PHE 74 HZ PHE 74 4.526 -7.151 -3.138 562 H VAL 75 H VAL 75 -3.141 -6.499 -1.915 563 HA VAL 75 HA VAL 75 -5.383 -5.908 -3.680 564 HB VAL 75 HB VAL 75 -5.586 -7.713 -2.020 565 HG11 VAL 75 1HG1 VAL 75 -4.330 -6.553 -0.218 566 HG12 VAL 75 2HG1 VAL 75 -5.866 -7.242 0.308 567 HG13 VAL 75 3HG1 VAL 75 -5.729 -5.506 0.023 568 HG21 VAL 75 3HG2 VAL 75 -7.661 -5.756 -1.221 569 HG22 VAL 75 1HG2 VAL 75 -7.829 -7.390 -1.862 570 HG23 VAL 75 2HG2 VAL 75 -7.467 -6.052 -2.948 571 H MET 76 H MET 76 -6.723 -4.318 -3.595 572 HA MET 76 HA MET 76 -6.259 -1.754 -3.436 573 HB2 MET 76 2HB MET 76 -8.732 -1.614 -2.816 574 HB3 MET 76 1HB MET 76 -8.288 -2.509 -4.256 575 HG2 MET 76 2HG MET 76 -8.280 -4.168 -1.883 576 HG3 MET 76 1HG MET 76 -9.843 -3.422 -2.161 577 HE1 MET 76 3HE MET 76 -10.368 -6.157 -2.139 578 HE2 MET 76 1HE MET 76 -10.910 -6.695 -3.729 579 HE3 MET 76 2HE MET 76 -11.503 -5.174 -3.065 580 H VAL 77 H VAL 77 -5.333 -0.501 -1.834 581 HA VAL 77 HA VAL 77 -6.904 -0.043 0.518 582 HB VAL 77 HB VAL 77 -4.365 -0.207 1.698 583 HG11 VAL 77 1HG1 VAL 77 -6.933 -0.874 2.324 584 HG12 VAL 77 2HG1 VAL 77 -5.515 -1.171 3.331 585 HG13 VAL 77 3HG1 VAL 77 -6.135 -2.445 2.280 586 HG21 VAL 77 3HG2 VAL 77 -4.832 -2.964 0.827 587 HG22 VAL 77 1HG2 VAL 77 -3.326 -2.088 1.102 588 HG23 VAL 77 2HG2 VAL 77 -4.201 -1.877 -0.409 589 H ASN 78 H ASN 78 -6.585 1.734 -1.403 590 HA ASN 78 HA ASN 78 -4.380 3.493 -0.684 591 HB2 ASN 78 2HB ASN 78 -4.434 3.867 -2.885 592 HB3 ASN 78 1HB ASN 78 -5.984 3.063 -3.043 593 HD21 ASN 78 1HD2 ASN 78 -4.392 6.088 -2.374 594 HD22 ASN 78 2HD2 ASN 78 -5.725 7.118 -2.805 595 H LEU 79 H LEU 79 -4.577 5.033 0.725 596 HA LEU 79 HA LEU 79 -7.257 5.889 1.550 597 HB2 LEU 79 2HB LEU 79 -6.333 5.411 3.536 598 HB3 LEU 79 1HB LEU 79 -4.706 5.476 2.903 599 HG LEU 79 HG LEU 79 -5.098 8.084 3.029 600 HD11 LEU 79 1HD1 LEU 79 -6.847 7.168 5.287 601 HD12 LEU 79 2HD1 LEU 79 -7.511 7.667 3.733 602 HD13 LEU 79 3HD1 LEU 79 -6.578 8.808 4.701 603 HD21 LEU 79 3HD2 LEU 79 -3.333 7.296 4.264 604 HD22 LEU 79 1HD2 LEU 79 -4.324 6.130 5.139 605 HD23 LEU 79 2HD2 LEU 79 -4.414 7.844 5.544 606 H GLU 80 H GLU 80 -7.702 8.149 1.902 607 HA GLU 80 HA GLU 80 -6.056 9.925 0.218 608 HB2 GLU 80 2HB GLU 80 -8.542 9.174 -0.425 609 HB3 GLU 80 1HB GLU 80 -8.939 10.534 0.632 610 HG2 GLU 80 2HG GLU 80 -8.174 12.070 -0.830 611 HG3 GLU 80 1HG GLU 80 -6.870 11.026 -1.417 612 H ASP 81 H ASP 81 -6.955 12.344 0.730 613 HA ASP 81 HA ASP 81 -5.817 13.150 3.085 614 HB2 ASP 81 2HB ASP 81 -7.680 14.363 1.146 615 HB3 ASP 81 1HB ASP 81 -7.657 15.117 2.737 616 H GLU 82 H GLU 82 -8.967 11.786 2.640 617 HA GLU 82 HA GLU 82 -10.424 12.743 4.751 618 HB2 GLU 82 2HB GLU 82 -10.587 10.557 2.990 619 HB3 GLU 82 1HB GLU 82 -10.756 9.883 4.603 620 HG2 GLU 82 2HG GLU 82 -12.931 10.351 4.131 621 HG3 GLU 82 1HG GLU 82 -12.453 11.861 4.906 622 H GLU 83 H GLU 83 -7.619 10.713 4.876 623 HA GLU 83 HA GLU 83 -6.539 9.622 6.565 624 HB2 GLU 83 2HB GLU 83 -6.290 11.029 8.643 625 HB3 GLU 83 1HB GLU 83 -5.855 11.820 7.136 626 HG2 GLU 83 2HG GLU 83 -7.937 13.030 7.115 627 HG3 GLU 83 1HG GLU 83 -8.492 12.160 8.549 628 H GLU 84 H GLU 84 -7.906 7.820 6.753 629 HA GLU 84 HA GLU 84 -10.092 7.853 8.635 630 HB2 GLU 84 2HB GLU 84 -8.936 5.885 6.726 631 HB3 GLU 84 1HB GLU 84 -9.849 5.253 8.091 632 HG2 GLU 84 2HG GLU 84 -11.808 5.907 7.241 633 HG3 GLU 84 1HG GLU 84 -11.167 7.453 6.686 634 HA PRO 85 HA PRO 85 -7.092 5.116 11.157 635 HB2 PRO 85 2HB PRO 85 -4.545 4.789 10.374 636 HB3 PRO 85 1HB PRO 85 -5.864 3.810 9.702 637 HG2 PRO 85 2HG PRO 85 -4.456 6.172 8.525 638 HG3 PRO 85 1HG PRO 85 -5.010 4.679 7.734 639 HD2 PRO 85 2HD PRO 85 -6.355 7.093 7.671 640 HD3 PRO 85 1HD PRO 85 -7.110 5.506 7.398 641 H LYS 86 H LYS 86 -5.174 7.669 9.607 642 HA LYS 86 HA LYS 86 -4.006 9.435 10.442 643 HB2 LYS 86 2HB LYS 86 -6.406 9.634 11.556 644 HB3 LYS 86 1HB LYS 86 -5.487 9.311 13.032 645 HG2 LYS 86 2HG LYS 86 -4.186 11.263 12.759 646 HG3 LYS 86 1HG LYS 86 -4.750 11.497 11.102 647 HD2 LYS 86 2HD LYS 86 -5.904 13.064 12.482 648 HD3 LYS 86 1HD LYS 86 -7.058 11.808 12.029 649 HE2 LYS 86 2HE LYS 86 -5.889 10.897 14.389 650 HE3 LYS 86 1HE LYS 86 -6.145 12.622 14.647 651 HZ1 LYS 86 3HZ LYS 86 -8.187 10.610 13.880 652 HZ2 LYS 86 1HZ LYS 86 -8.472 12.278 13.921 653 HZ3 LYS 86 2HZ LYS 86 -8.084 11.450 15.344 654 H ASP 87 H ASP 87 -2.345 7.576 10.568 655 HA ASP 87 HA ASP 87 -0.945 7.872 13.058 656 HB2 ASP 87 2HB ASP 87 -2.695 5.802 13.072 657 HB3 ASP 87 1HB ASP 87 -1.265 5.004 12.401 658 H GLU 88 H GLU 88 0.942 5.936 12.873 659 HA GLU 88 HA GLU 88 2.680 6.881 10.913 660 HB2 GLU 88 2HB GLU 88 2.694 4.805 12.935 661 HB3 GLU 88 1HB GLU 88 3.558 4.298 11.491 662 HG2 GLU 88 2HG GLU 88 5.166 5.287 12.854 663 HG3 GLU 88 1HG GLU 88 4.795 6.503 11.635 664 H ASP 89 H ASP 89 0.089 4.680 10.597 665 HA ASP 89 HA ASP 89 0.986 2.994 8.571 666 HB2 ASP 89 2HB ASP 89 -1.695 3.936 9.484 667 HB3 ASP 89 1HB ASP 89 -1.583 3.068 7.946 668 H PHE 90 H PHE 90 0.429 6.372 8.414 669 HA PHE 90 HA PHE 90 0.016 6.259 5.519 670 HB2 PHE 90 2HB PHE 90 -0.253 8.784 5.751 671 HB3 PHE 90 1HB PHE 90 -1.513 7.774 6.469 672 HD1 PHE 90 1HD PHE 90 1.820 9.043 7.627 673 HD2 PHE 90 2HD PHE 90 -2.354 8.691 8.372 674 HE1 PHE 90 1HE PHE 90 2.110 10.214 9.768 675 HE2 PHE 90 2HE PHE 90 -2.073 9.865 10.515 676 HZ PHE 90 HZ PHE 90 0.162 10.627 11.215 677 H SER 91 H SER 91 2.491 6.797 7.819 678 HA SER 91 HA SER 91 4.470 7.043 5.793 679 HB2 SER 91 2HB SER 91 4.408 9.464 7.568 680 HB3 SER 91 1HB SER 91 5.172 9.249 5.986 681 HG SER 91 HG SER 91 2.965 10.447 6.367 682 HA PRO 92 HA PRO 92 5.736 5.260 9.920 683 HB2 PRO 92 2HB PRO 92 7.069 3.145 8.771 684 HB3 PRO 92 1HB PRO 92 5.375 3.099 9.291 685 HG2 PRO 92 2HG PRO 92 6.522 3.488 6.561 686 HG3 PRO 92 1HG PRO 92 5.090 2.574 7.058 687 HD2 PRO 92 2HD PRO 92 4.922 5.019 5.926 688 HD3 PRO 92 1HD PRO 92 3.762 4.452 7.144 689 H ASP 93 H ASP 93 7.966 4.482 7.267 690 HA ASP 93 HA ASP 93 10.090 5.864 8.722 691 HB2 ASP 93 2HB ASP 93 10.005 3.424 7.388 692 HB3 ASP 93 1HB ASP 93 10.911 4.477 6.292 693 H GLY 94 H GLY 94 8.159 7.464 7.389 694 HA2 GLY 94 2HA GLY 94 9.960 8.922 5.610 695 HA3 GLY 94 1HA GLY 94 8.412 8.406 4.932 696 H GLY 95 H GLY 95 9.904 11.011 6.077 697 HA2 GLY 95 2HA GLY 95 8.042 12.068 7.953 698 HA3 GLY 95 1HA GLY 95 9.246 12.991 7.049 699 H TYR 96 H TYR 96 8.078 11.888 4.492 700 HA TYR 96 HA TYR 96 6.471 14.048 3.815 701 HB2 TYR 96 2HB TYR 96 5.640 12.385 1.943 702 HB3 TYR 96 1HB TYR 96 7.289 13.022 1.931 703 HD1 TYR 96 2HD TYR 96 9.179 11.580 2.473 704 HD2 TYR 96 1HD TYR 96 5.212 10.044 2.424 705 HE1 TYR 96 2HE TYR 96 10.073 9.292 2.437 706 HE2 TYR 96 1HE TYR 96 6.094 7.748 2.381 707 HH TYR 96 HH TYR 96 9.449 7.079 1.877 708 H ILE 97 H ILE 97 4.171 13.629 2.799 709 HA ILE 97 HA ILE 97 2.513 11.888 4.380 710 HB ILE 97 HB ILE 97 1.111 13.614 5.360 711 HG12 ILE 97 2HG1 ILE 97 1.099 15.519 4.065 712 HG13 ILE 97 1HG1 ILE 97 2.197 15.989 5.355 713 HG21 ILE 97 1HG2 ILE 97 2.578 14.394 7.067 714 HG22 ILE 97 2HG2 ILE 97 3.981 14.201 6.018 715 HG23 ILE 97 3HG2 ILE 97 3.097 12.781 6.577 716 HD11 ILE 97 3HD1 ILE 97 2.944 15.129 2.577 717 HD12 ILE 97 1HD1 ILE 97 4.102 15.409 3.877 718 HD13 ILE 97 2HD1 ILE 97 3.101 16.734 3.286 719 HA PRO 98 HA PRO 98 1.548 10.144 3.513 720 HB2 PRO 98 2HB PRO 98 -1.142 10.107 2.095 721 HB3 PRO 98 1HB PRO 98 -0.539 8.940 3.306 722 HG2 PRO 98 2HG PRO 98 -1.692 11.506 3.755 723 HG3 PRO 98 1HG PRO 98 -1.015 10.372 4.958 724 HD2 PRO 98 2HD PRO 98 0.236 12.606 4.587 725 HD3 PRO 98 1HD PRO 98 1.194 11.117 4.585 726 H ARG 99 H ARG 99 2.285 8.346 2.404 727 HA ARG 99 HA ARG 99 2.367 8.557 -0.527 728 HB2 ARG 99 2HB ARG 99 4.501 8.287 1.471 729 HB3 ARG 99 1HB ARG 99 4.628 7.151 0.126 730 HG2 ARG 99 2HG ARG 99 5.904 9.140 -0.313 731 HG3 ARG 99 1HG ARG 99 4.559 9.028 -1.446 732 HD2 ARG 99 2HD ARG 99 3.442 10.487 0.536 733 HD3 ARG 99 1HD ARG 99 5.117 11.004 0.662 734 HE ARG 99 HE ARG 99 4.257 11.080 -2.030 735 HH11 ARG 99 1HH1 ARG 99 3.927 12.776 1.003 736 HH12 ARG 99 2HH1 ARG 99 3.636 14.311 0.258 737 HH21 ARG 99 1HH2 ARG 99 3.879 13.103 -3.013 738 HH22 ARG 99 2HH2 ARG 99 3.608 14.496 -2.023 739 H ILE 100 H ILE 100 3.587 6.190 -1.135 740 HA ILE 100 HA ILE 100 1.468 4.284 -0.521 741 HB ILE 100 HB ILE 100 3.767 4.068 -2.465 742 HG12 ILE 100 2HG1 ILE 100 1.205 4.167 -3.714 743 HG13 ILE 100 1HG1 ILE 100 1.314 5.517 -2.592 744 HG21 ILE 100 1HG2 ILE 100 2.198 2.254 -3.425 745 HG22 ILE 100 2HG2 ILE 100 1.484 2.249 -1.813 746 HG23 ILE 100 3HG2 ILE 100 3.192 1.865 -2.021 747 HD11 ILE 100 3HD1 ILE 100 2.952 4.921 -5.006 748 HD12 ILE 100 1HD1 ILE 100 3.603 5.936 -3.719 749 HD13 ILE 100 2HD1 ILE 100 2.122 6.408 -4.551 750 H LEU 101 H LEU 101 1.678 2.958 1.144 751 HA LEU 101 HA LEU 101 4.370 2.039 1.922 752 HB2 LEU 101 2HB LEU 101 1.873 2.425 3.575 753 HB3 LEU 101 1HB LEU 101 3.312 1.625 4.166 754 HG LEU 101 HG LEU 101 4.462 3.582 4.441 755 HD11 LEU 101 1HD1 LEU 101 4.436 4.307 2.142 756 HD12 LEU 101 2HD1 LEU 101 4.034 5.656 3.200 757 HD13 LEU 101 3HD1 LEU 101 2.760 4.834 2.296 758 HD21 LEU 101 3HD2 LEU 101 3.002 5.260 5.383 759 HD22 LEU 101 1HD2 LEU 101 2.428 3.652 5.817 760 HD23 LEU 101 2HD2 LEU 101 1.617 4.564 4.544 761 H PHE 102 H PHE 102 4.756 -0.140 2.172 762 HA PHE 102 HA PHE 102 2.588 -1.924 1.318 763 HB2 PHE 102 2HB PHE 102 5.573 -2.150 1.413 764 HB3 PHE 102 1HB PHE 102 4.597 -3.614 1.400 765 HD1 PHE 102 2HD PHE 102 4.303 -0.349 -0.380 766 HD2 PHE 102 1HD PHE 102 4.691 -4.577 -0.689 767 HE1 PHE 102 2HE PHE 102 4.123 -0.183 -2.827 768 HE2 PHE 102 1HE PHE 102 4.515 -4.417 -3.137 769 HZ PHE 102 HZ PHE 102 4.228 -2.219 -4.209 770 H LEU 103 H LEU 103 1.673 -3.421 2.685 771 HA LEU 103 HA LEU 103 2.900 -3.725 5.333 772 HB2 LEU 103 2HB LEU 103 0.936 -3.205 6.514 773 HB3 LEU 103 1HB LEU 103 1.192 -1.904 5.376 774 HG LEU 103 HG LEU 103 -0.860 -4.095 5.213 775 HD11 LEU 103 1HD1 LEU 103 -2.425 -2.209 5.259 776 HD12 LEU 103 2HD1 LEU 103 -1.065 -1.101 5.446 777 HD13 LEU 103 3HD1 LEU 103 -1.424 -2.274 6.708 778 HD21 LEU 103 3HD2 LEU 103 0.179 -2.215 3.151 779 HD22 LEU 103 1HD2 LEU 103 -1.541 -2.595 3.173 780 HD23 LEU 103 2HD2 LEU 103 -0.359 -3.888 2.991 781 H ASP 104 H ASP 104 1.902 -5.422 6.658 782 HA ASP 104 HA ASP 104 1.701 -7.834 5.147 783 HB2 ASP 104 2HB ASP 104 2.197 -7.093 7.865 784 HB3 ASP 104 1HB ASP 104 0.893 -8.287 7.840 785 HA PRO 105 HA PRO 105 -2.598 -8.343 4.443 786 HB2 PRO 105 2HB PRO 105 -2.904 -10.991 5.251 787 HB3 PRO 105 1HB PRO 105 -2.374 -10.456 3.650 788 HG2 PRO 105 2HG PRO 105 -0.757 -11.406 5.970 789 HG3 PRO 105 1HG PRO 105 -0.508 -11.680 4.231 790 HD2 PRO 105 2HD PRO 105 0.965 -9.907 5.613 791 HD3 PRO 105 1HD PRO 105 0.497 -9.618 3.927 792 H SER 106 H SER 106 -3.391 -6.963 6.045 793 HA SER 106 HA SER 106 -5.294 -7.756 7.744 794 HB2 SER 106 2HB SER 106 -4.040 -7.576 10.038 795 HB3 SER 106 1HB SER 106 -4.031 -9.117 9.163 796 HG SER 106 HG SER 106 -1.987 -7.180 8.865 797 H GLY 107 H GLY 107 -2.596 -5.644 7.232 798 HA2 GLY 107 2HA GLY 107 -3.106 -3.281 6.913 799 HA3 GLY 107 1HA GLY 107 -4.207 -3.406 8.288 800 H LYS 108 H LYS 108 -0.888 -4.648 7.935 801 HA LYS 108 HA LYS 108 -0.159 -2.948 10.241 802 HB2 LYS 108 2HB LYS 108 0.296 -5.797 9.669 803 HB3 LYS 108 1HB LYS 108 1.698 -4.941 10.292 804 HG2 LYS 108 2HG LYS 108 -0.540 -4.187 11.861 805 HG3 LYS 108 1HG LYS 108 -0.547 -5.952 11.705 806 HD2 LYS 108 2HD LYS 108 2.089 -4.766 12.245 807 HD3 LYS 108 1HD LYS 108 0.907 -4.556 13.539 808 HE2 LYS 108 2HE LYS 108 0.561 -6.909 13.707 809 HE3 LYS 108 1HE LYS 108 1.499 -7.209 12.244 810 HZ1 LYS 108 3HZ LYS 108 3.109 -7.630 13.739 811 HZ2 LYS 108 1HZ LYS 108 2.406 -6.684 14.954 812 HZ3 LYS 108 2HZ LYS 108 3.305 -5.950 13.724 813 H VAL 109 H VAL 109 0.393 -1.310 8.573 814 HA VAL 109 HA VAL 109 2.423 -1.618 6.670 815 HB VAL 109 HB VAL 109 1.069 0.629 7.971 816 HG11 VAL 109 1HG1 VAL 109 3.215 1.367 8.656 817 HG12 VAL 109 2HG1 VAL 109 2.795 2.296 7.216 818 HG13 VAL 109 3HG1 VAL 109 3.930 0.951 7.099 819 HG21 VAL 109 3HG2 VAL 109 2.019 -0.095 5.230 820 HG22 VAL 109 1HG2 VAL 109 1.468 1.544 5.583 821 HG23 VAL 109 2HG2 VAL 109 0.377 0.177 5.809 822 H HIS 110 H HIS 110 4.505 -1.897 6.761 823 HA HIS 110 HA HIS 110 5.851 -1.357 9.331 824 HB2 HIS 110 2HB HIS 110 5.589 -3.814 8.043 825 HB3 HIS 110 1HB HIS 110 7.222 -3.292 7.642 826 HD1 HIS 110 1HD HIS 110 8.965 -3.648 9.392 827 HD2 HIS 110 2HD HIS 110 5.113 -3.922 10.927 828 HE1 HIS 110 1HE HIS 110 9.242 -4.416 11.770 829 HE2 HIS 110 2HE HIS 110 6.904 -4.496 12.703 830 HA PRO 111 HA PRO 111 8.370 1.408 6.949 831 HB2 PRO 111 2HB PRO 111 10.448 1.679 8.672 832 HB3 PRO 111 1HB PRO 111 8.881 2.449 8.939 833 HG2 PRO 111 2HG PRO 111 9.981 -0.067 10.127 834 HG3 PRO 111 1HG PRO 111 9.072 1.237 10.913 835 HD2 PRO 111 2HD PRO 111 7.928 -1.105 10.158 836 HD3 PRO 111 1HD PRO 111 7.042 0.437 10.171 837 H GLU 112 H GLU 112 8.528 -1.398 6.299 838 HA GLU 112 HA GLU 112 11.425 -1.667 5.805 839 HB2 GLU 112 2HB GLU 112 10.532 -3.435 7.258 840 HB3 GLU 112 1HB GLU 112 9.348 -3.852 6.027 841 HG2 GLU 112 2HG GLU 112 10.957 -4.746 4.606 842 HG3 GLU 112 1HG GLU 112 12.279 -3.928 5.435 843 H ILE 113 H ILE 113 8.426 -3.007 4.417 844 HA ILE 113 HA ILE 113 9.506 -3.162 1.809 845 HB ILE 113 HB ILE 113 6.580 -3.137 2.529 846 HG12 ILE 113 2HG1 ILE 113 7.695 -4.778 3.922 847 HG13 ILE 113 1HG1 ILE 113 6.802 -5.613 2.642 848 HG21 ILE 113 1HG2 ILE 113 6.261 -4.355 0.498 849 HG22 ILE 113 2HG2 ILE 113 7.999 -4.506 0.250 850 HG23 ILE 113 3HG2 ILE 113 7.223 -2.928 0.119 851 HD11 ILE 113 3HD1 ILE 113 8.815 -6.738 2.706 852 HD12 ILE 113 1HD1 ILE 113 9.751 -5.268 2.974 853 HD13 ILE 113 2HD1 ILE 113 9.054 -5.594 1.386 854 H ILE 114 H ILE 114 10.298 -1.224 1.161 855 HA ILE 114 HA ILE 114 8.340 0.919 0.661 856 HB ILE 114 HB ILE 114 10.029 2.554 0.985 857 HG12 ILE 114 2HG1 ILE 114 11.883 0.229 0.732 858 HG13 ILE 114 1HG1 ILE 114 11.997 1.826 0.021 859 HG21 ILE 114 1HG2 ILE 114 10.844 0.828 3.230 860 HG22 ILE 114 2HG2 ILE 114 9.111 1.052 3.005 861 HG23 ILE 114 3HG2 ILE 114 10.159 2.452 3.233 862 HD11 ILE 114 3HD1 ILE 114 12.386 2.525 2.539 863 HD12 ILE 114 1HD1 ILE 114 13.700 1.944 1.516 864 HD13 ILE 114 2HD1 ILE 114 12.922 0.850 2.657 865 H ASN 115 H ASN 115 10.305 2.419 -0.922 866 HA ASN 115 HA ASN 115 10.343 0.723 -3.331 867 HB2 ASN 115 2HB ASN 115 8.832 2.812 -3.261 868 HB3 ASN 115 1HB ASN 115 10.339 3.732 -3.359 869 HD21 ASN 115 1HD2 ASN 115 9.065 4.425 -5.339 870 HD22 ASN 115 2HD2 ASN 115 9.392 3.537 -6.805 871 H GLU 116 H GLU 116 12.459 -0.055 -2.690 872 HA GLU 116 HA GLU 116 14.674 1.574 -2.209 873 HB2 GLU 116 2HB GLU 116 14.220 -1.240 -2.965 874 HB3 GLU 116 1HB GLU 116 15.799 -0.591 -3.423 875 HG2 GLU 116 2HG GLU 116 14.671 -0.398 -0.643 876 HG3 GLU 116 1HG GLU 116 15.686 -1.730 -1.190 877 H ASN 117 H ASN 117 12.984 0.927 -5.135 878 HA ASN 117 HA ASN 117 15.144 1.559 -6.914 879 HB2 ASN 117 2HB ASN 117 13.233 0.112 -7.573 880 HB3 ASN 117 1HB ASN 117 12.166 1.520 -7.465 881 HD21 ASN 117 1HD2 ASN 117 15.181 0.463 -9.008 882 HD22 ASN 117 2HD2 ASN 117 14.884 1.268 -10.524 883 H GLY 118 H GLY 118 12.512 3.321 -5.393 884 HA2 GLY 118 2HA GLY 118 12.565 5.657 -6.931 885 HA3 GLY 118 1HA GLY 118 12.071 5.568 -5.237 886 H ASN 119 H ASN 119 13.054 7.768 -5.252 887 HA ASN 119 HA ASN 119 15.932 7.909 -5.399 888 HB2 ASN 119 2HB ASN 119 15.653 10.273 -4.858 889 HB3 ASN 119 1HB ASN 119 14.530 9.801 -6.141 890 HD21 ASN 119 1HD2 ASN 119 12.328 9.619 -5.671 891 HD22 ASN 119 2HD2 ASN 119 11.631 10.384 -4.267 892 HA PRO 120 HA PRO 120 16.757 7.171 -1.124 893 HB2 PRO 120 2HB PRO 120 19.047 8.953 -1.145 894 HB3 PRO 120 1HB PRO 120 19.017 7.182 -1.175 895 HG2 PRO 120 2HG PRO 120 19.834 8.722 -3.281 896 HG3 PRO 120 1HG PRO 120 19.141 7.094 -3.457 897 HD2 PRO 120 2HD PRO 120 17.834 9.769 -3.827 898 HD3 PRO 120 1HD PRO 120 17.666 8.281 -4.792 899 H SER 121 H SER 121 14.741 8.987 -1.223 900 HA SER 121 HA SER 121 14.977 10.387 1.177 901 HB2 SER 121 2HB SER 121 15.684 11.932 -1.281 902 HB3 SER 121 1HB SER 121 14.697 12.738 -0.052 903 HG SER 121 HG SER 121 16.353 12.757 1.280 904 H TYR 122 H TYR 122 13.176 8.671 -0.103 905 HA TYR 122 HA TYR 122 10.733 9.996 0.372 906 HB2 TYR 122 2HB TYR 122 11.821 10.217 -2.286 907 HB3 TYR 122 1HB TYR 122 10.308 9.307 -2.325 908 HD1 TYR 122 2HD TYR 122 8.531 10.507 -0.509 909 HD2 TYR 122 1HD TYR 122 11.537 12.418 -2.835 910 HE1 TYR 122 2HE TYR 122 7.280 12.619 -0.381 911 HE2 TYR 122 1HE TYR 122 10.298 14.536 -2.710 912 HH TYR 122 HH TYR 122 7.814 15.089 -0.550 913 H LYS 123 H LYS 123 12.320 7.362 -1.366 914 HA LYS 123 HA LYS 123 11.789 5.159 -1.642 915 HB2 LYS 123 2HB LYS 123 11.152 5.742 1.226 916 HB3 LYS 123 1HB LYS 123 10.858 4.140 0.576 917 HG2 LYS 123 2HG LYS 123 13.493 5.584 0.732 918 HG3 LYS 123 1HG LYS 123 12.992 4.146 1.637 919 HD2 LYS 123 2HD LYS 123 14.129 3.063 0.015 920 HD3 LYS 123 1HD LYS 123 12.626 3.277 -0.893 921 HE2 LYS 123 2HE LYS 123 13.545 4.767 -2.296 922 HE3 LYS 123 1HE LYS 123 14.484 5.545 -1.024 923 HZ1 LYS 123 3HZ LYS 123 15.229 3.402 -2.828 924 HZ2 LYS 123 1HZ LYS 123 15.736 3.200 -1.226 925 HZ3 LYS 123 2HZ LYS 123 16.192 4.582 -2.090 926 H TYR 124 H TYR 124 9.118 5.542 0.608 927 HA TYR 124 HA TYR 124 7.239 4.130 -0.743 928 HB2 TYR 124 2HB TYR 124 6.859 6.532 1.038 929 HB3 TYR 124 1HB TYR 124 5.521 5.520 0.477 930 HD1 TYR 124 1HD TYR 124 6.722 2.833 0.667 931 HD2 TYR 124 2HD TYR 124 6.951 6.137 3.335 932 HE1 TYR 124 1HE TYR 124 7.094 1.287 2.540 933 HE2 TYR 124 2HE TYR 124 7.332 4.601 5.214 934 HH TYR 124 HH TYR 124 6.882 1.215 4.939 935 H PHE 125 H PHE 125 8.399 7.232 -1.672 936 HA PHE 125 HA PHE 125 6.123 8.102 -3.137 937 HB2 PHE 125 2HB PHE 125 8.193 9.442 -2.306 938 HB3 PHE 125 1HB PHE 125 8.946 8.891 -3.808 939 HD1 PHE 125 2HD PHE 125 5.442 9.954 -3.148 940 HD2 PHE 125 1HD PHE 125 9.116 10.776 -5.130 941 HE1 PHE 125 2HE PHE 125 4.370 11.804 -4.359 942 HE2 PHE 125 1HE PHE 125 8.050 12.631 -6.345 943 HZ PHE 125 HZ PHE 125 5.672 13.143 -5.960 944 H TYR 126 H TYR 126 5.345 7.219 -4.953 945 HA TYR 126 HA TYR 126 7.228 5.839 -6.756 946 HB2 TYR 126 2HB TYR 126 4.341 5.219 -6.129 947 HB3 TYR 126 1HB TYR 126 5.188 4.538 -7.523 948 HD1 TYR 126 2HD TYR 126 4.926 4.534 -3.869 949 HD2 TYR 126 1HD TYR 126 6.847 2.807 -7.239 950 HE1 TYR 126 2HE TYR 126 5.749 2.705 -2.447 951 HE2 TYR 126 1HE TYR 126 7.676 0.968 -5.832 952 HH TYR 126 HH TYR 126 7.469 1.041 -2.401 953 H VAL 127 H VAL 127 7.581 7.870 -7.852 954 HA VAL 127 HA VAL 127 5.300 9.026 -9.251 955 HB VAL 127 HB VAL 127 7.145 10.538 -10.243 956 HG11 VAL 127 1HG1 VAL 127 7.208 11.892 -8.126 957 HG12 VAL 127 2HG1 VAL 127 6.368 10.556 -7.337 958 HG13 VAL 127 3HG1 VAL 127 5.602 11.415 -8.673 959 HG21 VAL 127 3HG2 VAL 127 8.696 9.635 -7.836 960 HG22 VAL 127 1HG2 VAL 127 9.227 10.649 -9.177 961 HG23 VAL 127 2HG2 VAL 127 8.957 8.925 -9.429 962 H SER 128 H SER 128 5.434 6.554 -10.114 963 HA SER 128 HA SER 128 5.579 6.632 -12.833 964 HB2 SER 128 2HB SER 128 7.891 7.013 -12.960 965 HB3 SER 128 1HB SER 128 8.236 5.905 -11.621 966 HG SER 128 HG SER 128 8.251 5.379 -14.211 967 H ALA 129 H ALA 129 4.783 4.797 -13.722 968 HA ALA 129 HA ALA 129 3.866 2.733 -11.957 969 HB1 ALA 129 1HB ALA 129 2.545 3.552 -13.876 970 HB2 ALA 129 2HB ALA 129 2.782 1.805 -13.902 971 HB3 ALA 129 3HB ALA 129 3.734 2.839 -14.967 972 H GLU 130 H GLU 130 6.646 3.191 -13.927 973 HA GLU 130 HA GLU 130 7.279 0.488 -14.469 974 HB2 GLU 130 2HB GLU 130 8.247 2.822 -15.364 975 HB3 GLU 130 1HB GLU 130 9.481 2.455 -14.152 976 HG2 GLU 130 2HG GLU 130 9.268 0.072 -15.442 977 HG3 GLU 130 1HG GLU 130 8.960 1.220 -16.757 978 H GLN 131 H GLN 131 8.212 2.678 -11.822 979 HA GLN 131 HA GLN 131 9.921 0.715 -10.655 980 HB2 GLN 131 2HB GLN 131 9.906 2.188 -8.666 981 HB3 GLN 131 1HB GLN 131 10.504 2.931 -10.143 982 HG2 GLN 131 2HG GLN 131 7.887 3.615 -10.246 983 HG3 GLN 131 1HG GLN 131 8.154 3.580 -8.507 984 HE21 GLN 131 1HE2 GLN 131 7.698 5.877 -8.697 985 HE22 GLN 131 2HE2 GLN 131 8.984 6.957 -9.096 986 H VAL 132 H VAL 132 6.779 2.079 -9.636 987 HA VAL 132 HA VAL 132 6.367 0.489 -7.426 988 HB VAL 132 HB VAL 132 4.803 2.197 -7.735 989 HG11 VAL 132 1HG1 VAL 132 3.313 1.406 -10.044 990 HG12 VAL 132 2HG1 VAL 132 5.016 1.588 -10.461 991 HG13 VAL 132 3HG1 VAL 132 4.144 2.926 -9.712 992 HG21 VAL 132 3HG2 VAL 132 2.867 1.149 -7.188 993 HG22 VAL 132 1HG2 VAL 132 3.944 -0.244 -7.110 994 HG23 VAL 132 2HG2 VAL 132 2.958 0.028 -8.546 995 H VAL 133 H VAL 133 6.262 -0.422 -10.775 996 HA VAL 133 HA VAL 133 4.835 -2.871 -10.265 997 HB VAL 133 HB VAL 133 4.689 -1.742 -12.474 998 HG11 VAL 133 1HG1 VAL 133 6.674 -0.949 -13.190 999 HG12 VAL 133 2HG1 VAL 133 6.783 -2.538 -13.948 1000 HG13 VAL 133 3HG1 VAL 133 7.594 -2.236 -12.411 1001 HG21 VAL 133 3HG2 VAL 133 4.592 -3.734 -13.727 1002 HG22 VAL 133 1HG2 VAL 133 4.285 -4.215 -12.057 1003 HG23 VAL 133 2HG2 VAL 133 5.873 -4.489 -12.776 1004 H GLN 134 H GLN 134 8.223 -1.836 -10.448 1005 HA GLN 134 HA GLN 134 9.152 -4.588 -10.504 1006 HB2 GLN 134 2HB GLN 134 11.391 -3.465 -9.839 1007 HB3 GLN 134 1HB GLN 134 10.747 -3.176 -11.448 1008 HG2 GLN 134 2HG GLN 134 9.875 -1.039 -10.731 1009 HG3 GLN 134 1HG GLN 134 10.473 -1.323 -9.098 1010 HE21 GLN 134 1HE2 GLN 134 11.148 -0.010 -12.105 1011 HE22 GLN 134 2HE2 GLN 134 12.856 0.261 -11.891 1012 H GLY 135 H GLY 135 8.449 -2.131 -8.146 1013 HA2 GLY 135 2HA GLY 135 9.543 -3.600 -5.919 1014 HA3 GLY 135 1HA GLY 135 8.514 -2.161 -5.833 1015 H MET 136 H MET 136 6.617 -3.554 -7.751 1016 HA MET 136 HA MET 136 5.020 -4.846 -5.706 1017 HB2 MET 136 2HB MET 136 4.571 -3.915 -8.511 1018 HB3 MET 136 1HB MET 136 3.489 -5.130 -7.846 1019 HG2 MET 136 2HG MET 136 4.009 -2.700 -6.227 1020 HG3 MET 136 1HG MET 136 2.989 -2.545 -7.658 1021 HE1 MET 136 3HE MET 136 1.094 -4.234 -8.166 1022 HE2 MET 136 1HE MET 136 0.092 -5.004 -6.937 1023 HE3 MET 136 2HE MET 136 1.620 -5.742 -7.417 1024 H LYS 137 H LYS 137 6.693 -5.691 -8.690 1025 HA LYS 137 HA LYS 137 5.849 -8.428 -8.641 1026 HB2 LYS 137 2HB LYS 137 7.247 -8.731 -10.552 1027 HB3 LYS 137 1HB LYS 137 6.465 -7.170 -10.721 1028 HG2 LYS 137 2HG LYS 137 8.660 -6.278 -9.633 1029 HG3 LYS 137 1HG LYS 137 9.322 -7.818 -10.185 1030 HD2 LYS 137 2HD LYS 137 8.073 -5.639 -11.849 1031 HD3 LYS 137 1HD LYS 137 9.735 -6.225 -11.906 1032 HE2 LYS 137 2HE LYS 137 7.314 -7.880 -12.614 1033 HE3 LYS 137 1HE LYS 137 8.312 -7.020 -13.785 1034 HZ1 LYS 137 3HZ LYS 137 9.836 -8.696 -12.021 1035 HZ2 LYS 137 1HZ LYS 137 9.863 -8.598 -13.711 1036 HZ3 LYS 137 2HZ LYS 137 8.711 -9.564 -12.936 1037 H GLU 138 H GLU 138 8.211 -6.648 -6.983 1038 HA GLU 138 HA GLU 138 10.069 -8.827 -6.608 1039 HB2 GLU 138 2HB GLU 138 9.995 -5.981 -6.043 1040 HB3 GLU 138 1HB GLU 138 10.563 -6.894 -4.645 1041 HG2 GLU 138 2HG GLU 138 11.796 -7.788 -7.115 1042 HG3 GLU 138 1HG GLU 138 12.072 -6.066 -6.801 1043 H ALA 139 H ALA 139 8.060 -6.907 -4.405 1044 HA ALA 139 HA ALA 139 8.255 -8.631 -2.205 1045 HB1 ALA 139 1HB ALA 139 5.904 -7.433 -1.732 1046 HB2 ALA 139 2HB ALA 139 6.535 -6.360 -2.980 1047 HB3 ALA 139 3HB ALA 139 7.459 -6.635 -1.502 1048 H GLN 140 H GLN 140 6.457 -8.894 -5.111 1049 HA GLN 140 HA GLN 140 4.213 -10.301 -4.372 1050 HB2 GLN 140 2HB GLN 140 5.802 -9.974 -6.801 1051 HB3 GLN 140 1HB GLN 140 4.974 -11.535 -6.724 1052 HG2 GLN 140 2HG GLN 140 3.073 -9.649 -5.938 1053 HG3 GLN 140 1HG GLN 140 3.922 -8.919 -7.301 1054 HE21 GLN 140 1HE2 GLN 140 2.562 -12.051 -6.329 1055 HE22 GLN 140 2HE2 GLN 140 1.870 -12.422 -7.867 1056 H GLU 141 H GLU 141 7.506 -11.355 -4.284 1057 HA GLU 141 HA GLU 141 6.590 -14.051 -3.586 1058 HB2 GLU 141 2HB GLU 141 8.560 -15.003 -4.541 1059 HB3 GLU 141 1HB GLU 141 7.776 -13.976 -5.751 1060 HG2 GLU 141 2HG GLU 141 9.308 -12.173 -5.137 1061 HG3 GLU 141 1HG GLU 141 10.132 -13.282 -4.052 1062 H ARG 142 H ARG 142 8.962 -11.537 -2.969 1063 HA ARG 142 HA ARG 142 10.090 -12.956 -0.721 1064 HB2 ARG 142 2HB ARG 142 11.465 -10.919 -0.423 1065 HB3 ARG 142 1HB ARG 142 11.558 -11.581 -2.059 1066 HG2 ARG 142 2HG ARG 142 11.234 -9.449 -2.672 1067 HG3 ARG 142 1HG ARG 142 9.533 -9.814 -2.347 1068 HD2 ARG 142 2HD ARG 142 10.285 -7.706 -1.303 1069 HD3 ARG 142 1HD ARG 142 9.722 -8.901 -0.122 1070 HE ARG 142 HE ARG 142 12.576 -8.891 -0.606 1071 HH11 ARG 142 1HH1 ARG 142 9.960 -7.652 1.344 1072 HH12 ARG 142 2HH1 ARG 142 10.982 -7.253 2.683 1073 HH21 ARG 142 1HH2 ARG 142 13.920 -8.365 1.153 1074 HH22 ARG 142 2HH2 ARG 142 13.230 -7.656 2.574 1075 H LEU 143 H LEU 143 7.418 -10.895 -1.196 1076 HA LEU 143 HA LEU 143 7.385 -10.156 1.653 1077 HB2 LEU 143 2HB LEU 143 7.234 -8.319 -0.010 1078 HB3 LEU 143 1HB LEU 143 5.743 -9.033 -0.615 1079 HG LEU 143 HG LEU 143 4.570 -8.523 1.384 1080 HD11 LEU 143 1HD1 LEU 143 7.291 -7.995 2.515 1081 HD12 LEU 143 2HD1 LEU 143 5.994 -9.007 3.151 1082 HD13 LEU 143 3HD1 LEU 143 5.857 -7.250 3.221 1083 HD21 LEU 143 3HD2 LEU 143 6.279 -6.338 0.278 1084 HD22 LEU 143 1HD2 LEU 143 5.164 -6.005 1.605 1085 HD23 LEU 143 2HD2 LEU 143 4.551 -6.626 0.072 1086 H THR 144 H THR 144 5.739 -11.969 -0.812 1087 HA THR 144 HA THR 144 3.318 -12.353 0.670 1088 HB THR 144 HB THR 144 2.914 -14.118 -1.085 1089 HG1 THR 144 1HG THR 144 4.879 -14.724 -1.758 1090 HG21 THR 144 3HG2 THR 144 1.951 -12.072 -1.622 1091 HG22 THR 144 1HG2 THR 144 2.926 -12.478 -3.035 1092 HG23 THR 144 2HG2 THR 144 3.517 -11.298 -1.866 1093 H GLY 145 H GLY 145 4.828 -12.943 2.601 1094 HA2 GLY 145 2HA GLY 145 4.350 -15.556 3.360 1095 HA3 GLY 145 1HA GLY 145 5.964 -15.557 2.662 1096 H ASP 146 H ASP 146 7.596 -15.156 4.004 1097 HA ASP 146 HA ASP 146 7.278 -13.299 6.203 1098 HB2 ASP 146 2HB ASP 146 8.209 -15.036 7.834 1099 HB3 ASP 146 1HB ASP 146 6.515 -15.197 7.382 1100 H ALA 147 H ALA 147 8.953 -13.854 3.706 1101 HA ALA 147 HA ALA 147 11.629 -14.162 4.747 1102 HB1 ALA 147 1HB ALA 147 10.388 -13.930 2.076 1103 HB2 ALA 147 2HB ALA 147 11.672 -14.996 2.643 1104 HB3 ALA 147 3HB ALA 147 12.036 -13.320 2.228 1105 H PHE 148 H PHE 148 9.409 -11.619 4.154 1106 HA PHE 148 HA PHE 148 11.282 -9.494 3.843 1107 HB2 PHE 148 2HB PHE 148 9.353 -8.035 4.091 1108 HB3 PHE 148 1HB PHE 148 8.938 -9.391 3.035 1109 HD1 PHE 148 2HD PHE 148 7.452 -11.164 3.834 1110 HD2 PHE 148 1HD PHE 148 8.308 -7.739 6.209 1111 HE1 PHE 148 2HE PHE 148 5.523 -11.682 5.271 1112 HE2 PHE 148 1HE PHE 148 6.381 -8.252 7.652 1113 HZ PHE 148 HZ PHE 148 4.986 -10.227 7.183 1114 H ARG 149 H ARG 149 10.161 -11.283 6.531 1115 HA ARG 149 HA ARG 149 10.060 -9.561 8.629 1116 HB2 ARG 149 2HB ARG 149 11.064 -12.354 8.359 1117 HB3 ARG 149 1HB ARG 149 11.231 -11.521 9.895 1118 HG2 ARG 149 2HG ARG 149 8.671 -12.051 8.410 1119 HG3 ARG 149 1HG ARG 149 9.216 -12.823 9.892 1120 HD2 ARG 149 2HD ARG 149 8.454 -9.936 9.529 1121 HD3 ARG 149 1HD ARG 149 7.573 -11.160 10.437 1122 HE ARG 149 HE ARG 149 10.260 -10.737 11.368 1123 HH11 ARG 149 1HH1 ARG 149 6.947 -9.670 11.604 1124 HH12 ARG 149 2HH1 ARG 149 7.144 -9.001 13.189 1125 HH21 ARG 149 1HH2 ARG 149 10.523 -9.858 13.453 1126 HH22 ARG 149 2HH2 ARG 149 9.174 -9.107 14.238 1127 H LYS 150 H LYS 150 11.379 -8.180 9.574 1128 HA LYS 150 HA LYS 150 13.876 -7.489 8.604 1129 HB2 LYS 150 2HB LYS 150 12.192 -6.726 10.824 1130 HB3 LYS 150 1HB LYS 150 13.887 -6.717 11.298 1131 HG2 LYS 150 2HG LYS 150 14.425 -5.206 9.495 1132 HG3 LYS 150 1HG LYS 150 12.764 -5.278 8.903 1133 HD2 LYS 150 2HD LYS 150 13.027 -4.528 11.729 1134 HD3 LYS 150 1HD LYS 150 13.734 -3.377 10.594 1135 HE2 LYS 150 2HE LYS 150 10.979 -4.460 10.150 1136 HE3 LYS 150 1HE LYS 150 11.246 -3.124 11.269 1137 HZ1 LYS 150 3HZ LYS 150 12.118 -3.118 8.430 1138 HZ2 LYS 150 1HZ LYS 150 12.164 -1.817 9.512 1139 HZ3 LYS 150 2HZ LYS 150 10.678 -2.423 8.980 1140 H LYS 151 H LYS 151 13.633 -8.586 11.956 1141 HA LYS 151 HA LYS 151 15.849 -10.454 11.459 1142 HB2 LYS 151 2HB LYS 151 16.787 -9.735 13.693 1143 HB3 LYS 151 1HB LYS 151 16.927 -8.558 12.393 1144 HG2 LYS 151 2HG LYS 151 15.229 -7.206 13.284 1145 HG3 LYS 151 1HG LYS 151 14.661 -8.485 14.359 1146 HD2 LYS 151 2HD LYS 151 17.259 -8.210 15.147 1147 HD3 LYS 151 1HD LYS 151 16.839 -6.553 14.710 1148 HE2 LYS 151 2HE LYS 151 15.236 -8.300 16.574 1149 HE3 LYS 151 1HE LYS 151 16.406 -7.087 17.092 1150 HZ1 LYS 151 3HZ LYS 151 13.809 -6.598 16.791 1151 HZ2 LYS 151 1HZ LYS 151 14.361 -6.160 15.252 1152 HZ3 LYS 151 2HZ LYS 151 15.003 -5.410 16.626 1153 H HIS 152 H HIS 152 16.219 -11.877 13.447 1154 HA HIS 152 HA HIS 152 13.907 -12.399 15.092 1155 HB2 HIS 152 2HB HIS 152 14.652 -14.176 12.807 1156 HB3 HIS 152 1HB HIS 152 13.988 -14.865 14.283 1157 HD1 HIS 152 1HD HIS 152 12.593 -14.763 11.401 1158 HD2 HIS 152 2HD HIS 152 11.741 -12.358 14.680 1159 HE1 HIS 152 1HE HIS 152 10.231 -13.977 11.061 1160 HE2 HIS 152 2HE HIS 152 9.706 -12.596 13.102 1161 H LEU 153 H LEU 153 14.376 -14.699 16.219 1162 HA LEU 153 HA LEU 153 17.123 -14.471 17.240 1163 HB2 LEU 153 2HB LEU 153 14.530 -14.962 18.473 1164 HB3 LEU 153 1HB LEU 153 15.730 -16.146 18.956 1165 HG LEU 153 HG LEU 153 15.685 -14.339 20.555 1166 HD11 LEU 153 1HD1 LEU 153 17.921 -14.216 20.801 1167 HD12 LEU 153 2HD1 LEU 153 18.181 -13.650 19.150 1168 HD13 LEU 153 3HD1 LEU 153 17.915 -15.365 19.463 1169 HD21 LEU 153 3HD2 LEU 153 16.189 -12.569 18.169 1170 HD22 LEU 153 1HD2 LEU 153 16.362 -12.046 19.844 1171 HD23 LEU 153 2HD2 LEU 153 14.786 -12.555 19.237 1172 H GLU 154 H GLU 154 14.828 -16.639 15.770 1173 HA GLU 154 HA GLU 154 16.951 -18.657 15.543 1174 HB2 GLU 154 2HB GLU 154 15.163 -20.414 15.718 1175 HB3 GLU 154 1HB GLU 154 15.484 -19.537 17.209 1176 HG2 GLU 154 2HG GLU 154 13.373 -18.357 15.570 1177 HG3 GLU 154 1HG GLU 154 13.020 -19.990 16.134 1178 H ASP 155 H ASP 155 17.441 -18.906 13.471 1179 HA ASP 155 HA ASP 155 15.442 -18.280 11.435 1180 HB2 ASP 155 2HB ASP 155 18.367 -18.195 11.588 1181 HB3 ASP 155 1HB ASP 155 17.763 -18.874 10.078 1182 H GLU 156 H GLU 156 17.775 -20.861 12.197 1183 HA GLU 156 HA GLU 156 17.784 -23.089 11.740 1184 HB2 GLU 156 2HB GLU 156 14.854 -22.460 11.771 1185 HB3 GLU 156 1HB GLU 156 15.394 -24.068 11.272 1186 HG2 GLU 156 2HG GLU 156 16.115 -22.768 13.889 1187 HG3 GLU 156 1HG GLU 156 14.777 -23.894 13.668 1188 H LEU 157 H LEU 157 18.896 -23.367 9.892 1189 HA LEU 157 HA LEU 157 17.367 -23.282 7.375 1190 HB2 LEU 157 2HB LEU 157 19.687 -21.795 8.096 1191 HB3 LEU 157 1HB LEU 157 20.148 -22.938 6.850 1192 HG LEU 157 HG LEU 157 17.676 -21.379 6.358 1193 HD11 LEU 157 1HD1 LEU 157 18.674 -19.354 5.909 1194 HD12 LEU 157 2HD1 LEU 157 20.288 -20.053 5.790 1195 HD13 LEU 157 3HD1 LEU 157 19.529 -19.852 7.369 1196 HD21 LEU 157 3HD2 LEU 157 18.125 -22.631 4.525 1197 HD22 LEU 157 1HD2 LEU 157 19.859 -22.674 4.840 1198 HD23 LEU 157 2HD2 LEU 157 19.128 -21.238 4.121 Start of MODEL 30 1 H1 MET 1 1HT MET 1 -11.378 -15.601 -10.272 2 H2 MET 1 2HT MET 1 -11.779 -15.999 -11.892 3 H3 MET 1 3HT MET 1 -12.920 -16.256 -10.635 4 HA MET 1 HA MET 1 -11.844 -13.606 -11.278 5 HB2 MET 1 2HB MET 1 -13.906 -13.285 -12.615 6 HB3 MET 1 1HB MET 1 -12.835 -14.498 -13.304 7 HG2 MET 1 2HG MET 1 -14.358 -16.109 -13.117 8 HG3 MET 1 1HG MET 1 -14.793 -15.631 -11.478 9 HE1 MET 1 2HE MET 1 -16.586 -16.916 -13.023 10 HE2 MET 1 3HE MET 1 -17.375 -16.162 -14.408 11 HE3 MET 1 1HE MET 1 -18.066 -15.984 -12.796 12 H HIS 2 H HIS 2 -12.747 -12.021 -10.057 13 HA HIS 2 HA HIS 2 -14.935 -12.774 -8.238 14 HB2 HIS 2 2HB HIS 2 -13.822 -11.343 -6.496 15 HB3 HIS 2 1HB HIS 2 -12.951 -12.820 -6.892 16 HD1 HIS 2 1HD HIS 2 -12.306 -9.423 -6.245 17 HD2 HIS 2 2HD HIS 2 -10.903 -12.125 -9.072 18 HE1 HIS 2 1HE HIS 2 -10.135 -8.461 -7.074 19 HE2 HIS 2 2HE HIS 2 -9.350 -10.069 -8.848 20 H HIS 3 H HIS 3 -16.634 -11.585 -8.787 21 HA HIS 3 HA HIS 3 -16.207 -8.731 -9.382 22 HB2 HIS 3 2HB HIS 3 -17.333 -10.721 -11.068 23 HB3 HIS 3 1HB HIS 3 -18.643 -9.657 -10.572 24 HD1 HIS 3 1HD HIS 3 -15.189 -9.412 -12.132 25 HD2 HIS 3 2HD HIS 3 -18.792 -7.348 -11.995 26 HE1 HIS 3 1HE HIS 3 -14.942 -7.518 -13.768 27 HE2 HIS 3 2HE HIS 3 -17.101 -6.230 -13.600 28 H HIS 4 H HIS 4 -18.408 -7.523 -9.189 29 HA HIS 4 HA HIS 4 -19.618 -8.347 -6.634 30 HB2 HIS 4 2HB HIS 4 -18.347 -5.982 -7.246 31 HB3 HIS 4 1HB HIS 4 -20.045 -5.566 -7.461 32 HD1 HIS 4 1HD HIS 4 -21.245 -4.904 -5.400 33 HD2 HIS 4 2HD HIS 4 -17.865 -7.172 -4.568 34 HE1 HIS 4 1HE HIS 4 -21.055 -4.932 -2.892 35 HE2 HIS 4 2HE HIS 4 -19.053 -6.382 -2.409 36 H HIS 5 H HIS 5 -21.894 -7.432 -6.338 37 HA HIS 5 HA HIS 5 -23.587 -8.567 -8.264 38 HB2 HIS 5 2HB HIS 5 -23.906 -7.054 -5.763 39 HB3 HIS 5 1HB HIS 5 -25.242 -6.872 -6.893 40 HD1 HIS 5 1HD HIS 5 -26.707 -8.941 -7.338 41 HD2 HIS 5 2HD HIS 5 -23.606 -9.620 -4.657 42 HE1 HIS 5 1HE HIS 5 -27.212 -11.163 -6.274 43 HE2 HIS 5 2HE HIS 5 -25.277 -11.594 -4.721 44 H HIS 6 H HIS 6 -22.102 -5.481 -8.137 45 HA HIS 6 HA HIS 6 -22.119 -3.722 -9.580 46 HB2 HIS 6 2HB HIS 6 -23.004 -5.920 -11.149 47 HB3 HIS 6 1HB HIS 6 -24.012 -4.539 -11.567 48 HD1 HIS 6 1HD HIS 6 -20.437 -5.696 -11.614 49 HD2 HIS 6 2HD HIS 6 -22.750 -2.544 -13.020 50 HE1 HIS 6 1HE HIS 6 -18.956 -4.434 -13.207 51 HE2 HIS 6 2HE HIS 6 -20.408 -2.585 -14.116 52 H HIS 7 H HIS 7 -23.638 -2.070 -10.580 53 HA HIS 7 HA HIS 7 -25.204 -0.480 -10.089 54 HB2 HIS 7 2HB HIS 7 -27.494 -1.218 -10.397 55 HB3 HIS 7 1HB HIS 7 -26.448 -2.054 -11.537 56 HD1 HIS 7 1HD HIS 7 -28.254 -2.669 -8.266 57 HD2 HIS 7 2HD HIS 7 -26.587 -4.781 -11.432 58 HE1 HIS 7 1HE HIS 7 -28.902 -5.068 -7.888 59 HE2 HIS 7 2HE HIS 7 -27.958 -6.315 -9.864 60 H MET 8 H MET 8 -23.871 -1.590 -7.768 61 HA MET 8 HA MET 8 -25.884 -0.872 -5.764 62 HB2 MET 8 2HB MET 8 -24.980 -3.497 -6.139 63 HB3 MET 8 1HB MET 8 -24.091 -2.904 -4.732 64 HG2 MET 8 2HG MET 8 -26.133 -2.383 -3.594 65 HG3 MET 8 1HG MET 8 -27.083 -2.756 -5.030 66 HE1 MET 8 3HE MET 8 -28.172 -5.125 -5.389 67 HE2 MET 8 1HE MET 8 -27.128 -6.540 -5.255 68 HE3 MET 8 2HE MET 8 -26.634 -5.171 -6.251 69 H SER 9 H SER 9 -22.524 -2.035 -5.611 70 HA SER 9 HA SER 9 -20.616 -1.092 -4.811 71 HB2 SER 9 2HB SER 9 -21.946 1.007 -6.181 72 HB3 SER 9 1HB SER 9 -21.296 1.691 -4.691 73 HG SER 9 HG SER 9 -19.269 0.675 -5.307 74 H ASP 10 H ASP 10 -22.902 1.325 -3.567 75 HA ASP 10 HA ASP 10 -23.448 1.960 -1.453 76 HB2 ASP 10 2HB ASP 10 -23.211 -0.957 -1.315 77 HB3 ASP 10 1HB ASP 10 -22.962 -0.161 0.236 78 H GLY 11 H GLY 11 -22.058 3.464 -0.753 79 HA2 GLY 11 2HA GLY 11 -20.394 4.332 0.597 80 HA3 GLY 11 1HA GLY 11 -19.937 2.690 1.026 81 H HIS 12 H HIS 12 -18.966 5.440 -0.555 82 HA HIS 12 HA HIS 12 -16.522 4.364 -1.400 83 HB2 HIS 12 2HB HIS 12 -16.872 4.729 -3.904 84 HB3 HIS 12 1HB HIS 12 -17.602 3.276 -3.204 85 HD1 HIS 12 1HD HIS 12 -20.085 3.011 -3.459 86 HD2 HIS 12 2HD HIS 12 -18.775 6.821 -4.476 87 HE1 HIS 12 1HE HIS 12 -22.080 4.159 -4.475 88 HE2 HIS 12 2HE HIS 12 -21.238 6.431 -5.165 89 H ASN 13 H ASN 13 -15.127 5.997 -1.355 90 HA ASN 13 HA ASN 13 -15.823 8.596 -2.424 91 HB2 ASN 13 2HB ASN 13 -15.654 8.045 0.485 92 HB3 ASN 13 1HB ASN 13 -14.846 9.503 -0.082 93 HD21 ASN 13 1HD2 ASN 13 -16.056 11.174 -0.950 94 HD22 ASN 13 2HD2 ASN 13 -17.769 11.274 -0.748 95 H GLY 14 H GLY 14 -14.061 9.724 -3.119 96 HA2 GLY 14 2HA GLY 14 -11.887 10.091 -3.759 97 HA3 GLY 14 1HA GLY 14 -11.445 9.500 -2.153 98 H LEU 15 H LEU 15 -10.483 7.556 -1.977 99 HA LEU 15 HA LEU 15 -9.288 5.753 -2.609 100 HB2 LEU 15 2HB LEU 15 -10.533 3.982 -3.480 101 HB3 LEU 15 1HB LEU 15 -11.703 4.970 -2.629 102 HG LEU 15 HG LEU 15 -11.483 5.655 -5.467 103 HD11 LEU 15 1HD1 LEU 15 -11.043 3.323 -5.773 104 HD12 LEU 15 2HD1 LEU 15 -12.722 3.636 -6.213 105 HD13 LEU 15 3HD1 LEU 15 -12.342 2.883 -4.664 106 HD21 LEU 15 3HD2 LEU 15 -13.238 6.349 -3.755 107 HD22 LEU 15 1HD2 LEU 15 -13.885 4.718 -3.926 108 HD23 LEU 15 2HD2 LEU 15 -13.823 5.792 -5.323 109 H GLY 16 H GLY 16 -9.056 4.298 -4.842 110 HA2 GLY 16 2HA GLY 16 -7.304 5.854 -6.441 111 HA3 GLY 16 1HA GLY 16 -7.789 4.200 -6.752 112 H LYS 17 H LYS 17 -9.268 7.451 -6.816 113 HA LYS 17 HA LYS 17 -10.828 6.687 -9.161 114 HB2 LYS 17 2HB LYS 17 -11.579 8.132 -7.049 115 HB3 LYS 17 1HB LYS 17 -10.931 9.443 -8.026 116 HG2 LYS 17 2HG LYS 17 -12.444 8.858 -9.840 117 HG3 LYS 17 1HG LYS 17 -13.073 7.510 -8.891 118 HD2 LYS 17 2HD LYS 17 -13.589 9.332 -7.116 119 HD3 LYS 17 1HD LYS 17 -13.428 10.454 -8.469 120 HE2 LYS 17 2HE LYS 17 -15.044 8.502 -9.511 121 HE3 LYS 17 1HE LYS 17 -15.572 8.571 -7.830 122 HZ1 LYS 17 3HZ LYS 17 -16.424 10.625 -8.090 123 HZ2 LYS 17 1HZ LYS 17 -16.505 10.180 -9.721 124 HZ3 LYS 17 2HZ LYS 17 -15.221 11.129 -9.165 125 H GLY 18 H GLY 18 -9.076 6.518 -10.617 126 HA2 GLY 18 2HA GLY 18 -8.497 7.993 -12.576 127 HA3 GLY 18 1HA GLY 18 -7.837 9.099 -11.361 128 H PHE 19 H PHE 19 -6.889 6.830 -9.731 129 HA PHE 19 HA PHE 19 -4.242 6.680 -10.474 130 HB2 PHE 19 2HB PHE 19 -5.541 5.913 -8.315 131 HB3 PHE 19 1HB PHE 19 -5.552 4.342 -9.126 132 HD1 PHE 19 1HD PHE 19 -2.722 4.988 -10.439 133 HD2 PHE 19 2HD PHE 19 -4.275 4.978 -6.476 134 HE1 PHE 19 1HE PHE 19 -0.473 4.519 -9.558 135 HE2 PHE 19 2HE PHE 19 -2.029 4.508 -5.594 136 HZ PHE 19 HZ PHE 19 -0.124 4.279 -7.134 137 H GLY 20 H GLY 20 -6.583 4.021 -10.807 138 HA2 GLY 20 2HA GLY 20 -5.537 3.379 -13.452 139 HA3 GLY 20 1HA GLY 20 -5.307 2.151 -12.202 140 H ASP 21 H ASP 21 -7.439 1.843 -10.862 141 HA ASP 21 HA ASP 21 -9.956 2.200 -11.975 142 HB2 ASP 21 2HB ASP 21 -9.158 0.793 -13.825 143 HB3 ASP 21 1HB ASP 21 -8.751 -0.494 -12.681 144 H HIS 22 H HIS 22 -9.028 -1.037 -10.949 145 HA HIS 22 HA HIS 22 -10.459 -0.594 -8.427 146 HB2 HIS 22 2HB HIS 22 -10.366 -3.168 -8.371 147 HB3 HIS 22 1HB HIS 22 -11.413 -2.426 -9.562 148 HD1 HIS 22 1HD HIS 22 -8.596 -4.734 -9.192 149 HD2 HIS 22 2HD HIS 22 -10.336 -2.535 -12.258 150 HE1 HIS 22 1HE HIS 22 -7.734 -5.751 -11.323 151 HE2 HIS 22 2HE HIS 22 -8.866 -4.456 -13.163 152 H ILE 23 H ILE 23 -7.701 -2.475 -9.569 153 HA ILE 23 HA ILE 23 -5.822 -3.218 -8.452 154 HB ILE 23 HB ILE 23 -5.490 -0.247 -8.258 155 HG12 ILE 23 2HG1 ILE 23 -6.602 -1.028 -10.421 156 HG13 ILE 23 1HG1 ILE 23 -5.136 -0.074 -10.579 157 HG21 ILE 23 1HG2 ILE 23 -3.304 -0.572 -8.188 158 HG22 ILE 23 2HG2 ILE 23 -3.343 -1.854 -9.394 159 HG23 ILE 23 3HG2 ILE 23 -3.713 -2.220 -7.710 160 HD11 ILE 23 3HD1 ILE 23 -5.086 -3.066 -10.637 161 HD12 ILE 23 1HD1 ILE 23 -3.866 -1.927 -11.205 162 HD13 ILE 23 2HD1 ILE 23 -5.388 -2.098 -12.081 163 H HIS 24 H HIS 24 -4.672 -0.794 -6.693 164 HA HIS 24 HA HIS 24 -4.992 -2.162 -4.208 165 HB2 HIS 24 2HB HIS 24 -3.524 0.425 -4.461 166 HB3 HIS 24 1HB HIS 24 -3.144 -0.996 -3.486 167 HD1 HIS 24 1HD HIS 24 -2.804 -3.200 -5.411 168 HD2 HIS 24 2HD HIS 24 -1.580 0.667 -6.316 169 HE1 HIS 24 1HE HIS 24 -1.074 -3.448 -7.218 170 HE2 HIS 24 2HE HIS 24 -0.284 -1.102 -7.687 171 H TRP 25 H TRP 25 -7.391 -0.795 -5.194 172 HA TRP 25 HA TRP 25 -7.904 0.749 -2.790 173 HB2 TRP 25 2HB TRP 25 -9.202 2.355 -4.536 174 HB3 TRP 25 1HB TRP 25 -7.591 2.677 -3.896 175 HD1 TRP 25 HD TRP 25 -9.432 1.971 -7.073 176 HE1 TRP 25 1HE TRP 25 -7.782 1.995 -9.027 177 HE3 TRP 25 3HE TRP 25 -5.030 2.008 -4.472 178 HZ2 TRP 25 2HZ TRP 25 -5.007 2.031 -9.457 179 HZ3 TRP 25 3HZ TRP 25 -2.921 2.031 -5.747 180 HH2 TRP 25 HH TRP 25 -2.909 2.042 -8.178 181 H ARG 26 H ARG 26 -8.912 -1.552 -4.995 182 HA ARG 26 HA ARG 26 -11.545 -1.244 -5.465 183 HB2 ARG 26 2HB ARG 26 -10.656 -3.793 -4.135 184 HB3 ARG 26 1HB ARG 26 -11.886 -3.579 -5.376 185 HG2 ARG 26 2HG ARG 26 -9.927 -2.803 -6.851 186 HG3 ARG 26 1HG ARG 26 -8.913 -3.596 -5.654 187 HD2 ARG 26 2HD ARG 26 -9.393 -5.137 -7.452 188 HD3 ARG 26 1HD ARG 26 -10.191 -5.677 -5.967 189 HE ARG 26 HE ARG 26 -12.113 -4.236 -7.211 190 HH11 ARG 26 1HH1 ARG 26 -10.048 -6.849 -8.253 191 HH12 ARG 26 2HH1 ARG 26 -11.203 -7.480 -9.379 192 HH21 ARG 26 1HH2 ARG 26 -13.634 -5.064 -8.690 193 HH22 ARG 26 2HH2 ARG 26 -13.239 -6.466 -9.627 194 H THR 27 H THR 27 -10.161 -1.997 -2.273 195 HA THR 27 HA THR 27 -11.995 -0.623 -0.764 196 HB THR 27 HB THR 27 -13.108 -2.974 0.102 197 HG1 THR 27 1HG THR 27 -13.542 -3.178 -2.634 198 HG21 THR 27 3HG2 THR 27 -14.043 -0.700 -1.476 199 HG22 THR 27 1HG2 THR 27 -14.750 -1.474 -0.059 200 HG23 THR 27 2HG2 THR 27 -15.004 -2.166 -1.661 201 H LEU 28 H LEU 28 -11.120 -0.417 1.190 202 HA LEU 28 HA LEU 28 -8.772 -1.763 1.922 203 HB2 LEU 28 2HB LEU 28 -9.478 0.490 2.728 204 HB3 LEU 28 1HB LEU 28 -10.679 -0.299 3.751 205 HG LEU 28 HG LEU 28 -7.776 -1.011 4.009 206 HD11 LEU 28 1HD1 LEU 28 -7.969 0.734 5.976 207 HD12 LEU 28 2HD1 LEU 28 -9.123 1.492 4.878 208 HD13 LEU 28 3HD1 LEU 28 -7.458 1.221 4.359 209 HD21 LEU 28 3HD2 LEU 28 -10.240 -1.193 5.702 210 HD22 LEU 28 1HD2 LEU 28 -8.634 -1.244 6.430 211 HD23 LEU 28 2HD2 LEU 28 -9.106 -2.463 5.246 212 H GLU 29 H GLU 29 -12.055 -2.053 3.282 213 HA GLU 29 HA GLU 29 -11.503 -4.125 5.071 214 HB2 GLU 29 2HB GLU 29 -13.594 -2.707 4.964 215 HB3 GLU 29 1HB GLU 29 -14.127 -3.724 3.634 216 HG2 GLU 29 2HG GLU 29 -13.386 -5.474 5.694 217 HG3 GLU 29 1HG GLU 29 -14.305 -4.175 6.456 218 H ASP 30 H ASP 30 -13.017 -4.366 1.848 219 HA ASP 30 HA ASP 30 -13.040 -7.158 1.716 220 HB2 ASP 30 2HB ASP 30 -13.366 -4.928 -0.183 221 HB3 ASP 30 1HB ASP 30 -12.809 -6.442 -0.910 222 H GLY 31 H GLY 31 -10.497 -4.851 1.116 223 HA2 GLY 31 2HA GLY 31 -8.759 -6.413 -0.427 224 HA3 GLY 31 1HA GLY 31 -8.262 -5.117 0.667 225 H LYS 32 H LYS 32 -9.162 -6.241 3.088 226 HA LYS 32 HA LYS 32 -6.972 -7.940 3.693 227 HB2 LYS 32 2HB LYS 32 -8.081 -6.339 5.287 228 HB3 LYS 32 1HB LYS 32 -9.430 -7.462 5.383 229 HG2 LYS 32 2HG LYS 32 -6.862 -8.736 5.878 230 HG3 LYS 32 1HG LYS 32 -7.224 -7.437 7.016 231 HD2 LYS 32 2HD LYS 32 -9.363 -9.411 6.386 232 HD3 LYS 32 1HD LYS 32 -8.042 -9.912 7.443 233 HE2 LYS 32 2HE LYS 32 -8.571 -7.632 8.639 234 HE3 LYS 32 1HE LYS 32 -10.143 -7.842 7.873 235 HZ1 LYS 32 3HZ LYS 32 -8.836 -9.852 9.624 236 HZ2 LYS 32 1HZ LYS 32 -10.388 -9.957 8.959 237 HZ3 LYS 32 2HZ LYS 32 -10.045 -8.779 10.123 238 H LYS 33 H LYS 33 -10.428 -8.492 3.213 239 HA LYS 33 HA LYS 33 -10.416 -11.228 3.934 240 HB2 LYS 33 2HB LYS 33 -12.457 -9.803 3.800 241 HB3 LYS 33 1HB LYS 33 -12.308 -9.812 2.048 242 HG2 LYS 33 2HG LYS 33 -12.281 -12.455 2.506 243 HG3 LYS 33 1HG LYS 33 -13.256 -11.914 3.885 244 HD2 LYS 33 2HD LYS 33 -14.998 -11.328 2.577 245 HD3 LYS 33 1HD LYS 33 -13.958 -10.700 1.298 246 HE2 LYS 33 2HE LYS 33 -13.878 -13.616 1.663 247 HE3 LYS 33 1HE LYS 33 -15.424 -12.974 1.112 248 HZ1 LYS 33 3HZ LYS 33 -13.848 -13.600 -0.691 249 HZ2 LYS 33 1HZ LYS 33 -12.833 -12.344 -0.187 250 HZ3 LYS 33 2HZ LYS 33 -14.383 -11.997 -0.767 251 H GLU 34 H GLU 34 -9.900 -9.531 0.894 252 HA GLU 34 HA GLU 34 -9.868 -11.872 -0.731 253 HB2 GLU 34 2HB GLU 34 -10.335 -9.629 -1.643 254 HB3 GLU 34 1HB GLU 34 -8.682 -9.139 -1.264 255 HG2 GLU 34 2HG GLU 34 -7.809 -10.216 -3.037 256 HG3 GLU 34 1HG GLU 34 -8.961 -11.558 -2.927 257 H ALA 35 H ALA 35 -7.317 -9.810 0.640 258 HA ALA 35 HA ALA 35 -5.109 -11.151 -0.393 259 HB1 ALA 35 1HB ALA 35 -5.595 -9.340 1.886 260 HB2 ALA 35 2HB ALA 35 -4.410 -9.238 0.584 261 HB3 ALA 35 3HB ALA 35 -4.122 -10.308 1.956 262 H ALA 36 H ALA 36 -7.290 -12.068 2.126 263 HA ALA 36 HA ALA 36 -5.639 -13.874 3.531 264 HB1 ALA 36 1HB ALA 36 -8.621 -13.651 3.235 265 HB2 ALA 36 2HB ALA 36 -7.616 -13.182 4.606 266 HB3 ALA 36 3HB ALA 36 -7.859 -14.889 4.232 267 H ALA 37 H ALA 37 -7.745 -14.255 0.719 268 HA ALA 37 HA ALA 37 -7.739 -17.020 0.487 269 HB1 ALA 37 1HB ALA 37 -9.134 -16.248 -1.092 270 HB2 ALA 37 2HB ALA 37 -7.704 -16.228 -2.121 271 HB3 ALA 37 3HB ALA 37 -8.223 -14.753 -1.306 272 H SER 38 H SER 38 -5.795 -15.012 -1.704 273 HA SER 38 HA SER 38 -3.935 -17.103 -2.196 274 HB2 SER 38 2HB SER 38 -2.609 -14.979 -3.142 275 HB3 SER 38 1HB SER 38 -3.990 -15.683 -4.000 276 HG SER 38 HG SER 38 -4.849 -13.784 -3.811 277 H GLY 39 H GLY 39 -4.166 -14.646 0.207 278 HA2 GLY 39 2HA GLY 39 -2.916 -14.443 2.151 279 HA3 GLY 39 1HA GLY 39 -1.801 -15.663 1.526 280 H LEU 40 H LEU 40 -2.618 -12.915 -0.437 281 HA LEU 40 HA LEU 40 0.146 -12.088 -0.425 282 HB2 LEU 40 2HB LEU 40 -0.366 -10.749 -2.276 283 HB3 LEU 40 1HB LEU 40 -1.355 -12.181 -2.471 284 HG LEU 40 HG LEU 40 -3.054 -10.493 -1.130 285 HD11 LEU 40 1HD1 LEU 40 -2.807 -8.327 -1.736 286 HD12 LEU 40 2HD1 LEU 40 -1.974 -8.727 -3.238 287 HD13 LEU 40 3HD1 LEU 40 -1.106 -8.793 -1.704 288 HD21 LEU 40 3HD2 LEU 40 -4.342 -10.663 -3.004 289 HD22 LEU 40 1HD2 LEU 40 -3.170 -11.937 -3.345 290 HD23 LEU 40 2HD2 LEU 40 -2.990 -10.349 -4.094 291 HA PRO 41 HA PRO 41 -0.046 -8.854 2.537 292 HB2 PRO 41 2HB PRO 41 1.527 -6.942 1.404 293 HB3 PRO 41 1HB PRO 41 2.168 -8.424 2.123 294 HG2 PRO 41 2HG PRO 41 1.579 -7.825 -0.755 295 HG3 PRO 41 1HG PRO 41 3.028 -8.565 -0.051 296 HD2 PRO 41 2HD PRO 41 1.133 -10.063 -1.192 297 HD3 PRO 41 1HD PRO 41 1.963 -10.611 0.281 298 H LEU 42 H LEU 42 -0.701 -6.648 2.964 299 HA LEU 42 HA LEU 42 -2.901 -5.866 1.265 300 HB2 LEU 42 2HB LEU 42 -1.892 -5.077 3.960 301 HB3 LEU 42 1HB LEU 42 -2.928 -3.958 3.099 302 HG LEU 42 HG LEU 42 -3.635 -6.782 3.893 303 HD11 LEU 42 1HD1 LEU 42 -5.169 -4.450 4.844 304 HD12 LEU 42 2HD1 LEU 42 -3.553 -4.655 5.520 305 HD13 LEU 42 3HD1 LEU 42 -4.743 -5.948 5.670 306 HD21 LEU 42 3HD2 LEU 42 -5.908 -5.303 3.129 307 HD22 LEU 42 1HD2 LEU 42 -5.212 -6.716 2.336 308 HD23 LEU 42 2HD2 LEU 42 -4.712 -5.096 1.850 309 H MET 43 H MET 43 -3.156 -3.731 0.427 310 HA MET 43 HA MET 43 -0.593 -2.440 -0.214 311 HB2 MET 43 2HB MET 43 -2.067 -3.638 -2.030 312 HB3 MET 43 1HB MET 43 -3.035 -2.166 -1.943 313 HG2 MET 43 2HG MET 43 -1.293 -2.250 -3.752 314 HG3 MET 43 1HG MET 43 -1.247 -0.835 -2.709 315 HE1 MET 43 3HE MET 43 1.917 -1.043 -0.769 316 HE2 MET 43 1HE MET 43 0.231 -0.528 -0.791 317 HE3 MET 43 2HE MET 43 1.339 0.021 -2.051 318 H VAL 44 H VAL 44 -0.736 -1.089 1.627 319 HA VAL 44 HA VAL 44 -3.015 0.674 1.882 320 HB VAL 44 HB VAL 44 -1.943 -0.228 3.906 321 HG11 VAL 44 1HG1 VAL 44 0.261 -0.339 3.996 322 HG12 VAL 44 2HG1 VAL 44 0.268 1.401 4.279 323 HG13 VAL 44 3HG1 VAL 44 0.432 0.772 2.643 324 HG21 VAL 44 3HG2 VAL 44 -3.227 1.811 4.054 325 HG22 VAL 44 1HG2 VAL 44 -1.806 2.765 3.623 326 HG23 VAL 44 2HG2 VAL 44 -1.846 1.885 5.151 327 H ILE 45 H ILE 45 -2.621 1.599 -0.294 328 HA ILE 45 HA ILE 45 -0.406 3.496 -0.405 329 HB ILE 45 HB ILE 45 -2.463 3.162 -2.567 330 HG12 ILE 45 2HG1 ILE 45 -0.074 1.400 -1.986 331 HG13 ILE 45 1HG1 ILE 45 -1.769 0.908 -2.111 332 HG21 ILE 45 1HG2 ILE 45 -0.509 4.936 -2.382 333 HG22 ILE 45 2HG2 ILE 45 -0.952 4.202 -3.924 334 HG23 ILE 45 3HG2 ILE 45 0.436 3.594 -3.024 335 HD11 ILE 45 3HD1 ILE 45 -0.343 0.314 -4.067 336 HD12 ILE 45 1HD1 ILE 45 -0.185 2.037 -4.405 337 HD13 ILE 45 2HD1 ILE 45 -1.771 1.270 -4.457 338 H ILE 46 H ILE 46 -0.746 5.374 0.594 339 HA ILE 46 HA ILE 46 -3.425 6.556 0.420 340 HB ILE 46 HB ILE 46 -1.260 7.226 2.409 341 HG12 ILE 46 2HG1 ILE 46 -3.767 5.788 3.143 342 HG13 ILE 46 1HG1 ILE 46 -2.479 4.865 2.373 343 HG21 ILE 46 1HG2 ILE 46 -4.158 7.838 2.760 344 HG22 ILE 46 2HG2 ILE 46 -3.177 8.881 1.734 345 HG23 ILE 46 3HG2 ILE 46 -2.747 8.656 3.429 346 HD11 ILE 46 3HD1 ILE 46 -1.837 6.586 4.714 347 HD12 ILE 46 1HD1 ILE 46 -1.067 5.098 4.159 348 HD13 ILE 46 2HD1 ILE 46 -2.634 5.034 4.966 349 H HIS 47 H HIS 47 -3.720 8.579 -0.359 350 HA HIS 47 HA HIS 47 -1.321 10.010 -1.294 351 HB2 HIS 47 2HB HIS 47 -3.834 9.842 -2.946 352 HB3 HIS 47 1HB HIS 47 -2.215 10.346 -3.448 353 HD1 HIS 47 1HD HIS 47 -1.160 8.644 -4.881 354 HD2 HIS 47 2HD HIS 47 -3.610 6.916 -2.007 355 HE1 HIS 47 1HE HIS 47 -0.985 6.169 -5.255 356 HE2 HIS 47 2HE HIS 47 -2.631 5.161 -3.634 357 H LYS 48 H LYS 48 -1.265 11.911 -0.320 358 HA LYS 48 HA LYS 48 -3.826 13.354 0.031 359 HB2 LYS 48 2HB LYS 48 -1.803 12.713 1.947 360 HB3 LYS 48 1HB LYS 48 -1.880 14.459 1.771 361 HG2 LYS 48 2HG LYS 48 -4.282 14.394 2.224 362 HG3 LYS 48 1HG LYS 48 -4.196 12.641 2.412 363 HD2 LYS 48 2HD LYS 48 -2.755 12.863 4.323 364 HD3 LYS 48 1HD LYS 48 -2.633 14.607 4.082 365 HE2 LYS 48 2HE LYS 48 -5.280 13.269 4.533 366 HE3 LYS 48 1HE LYS 48 -4.246 13.735 5.883 367 HZ1 LYS 48 3HZ LYS 48 -5.232 15.587 3.780 368 HZ2 LYS 48 1HZ LYS 48 -4.315 16.011 5.137 369 HZ3 LYS 48 2HZ LYS 48 -5.895 15.439 5.329 370 H SER 49 H SER 49 -3.864 15.585 -0.340 371 HA SER 49 HA SER 49 -3.370 17.511 -1.443 372 HB2 SER 49 2HB SER 49 -0.557 16.633 -0.769 373 HB3 SER 49 1HB SER 49 -0.941 18.190 -1.502 374 HG SER 49 HG SER 49 -0.831 18.423 0.729 375 H TRP 50 H TRP 50 -1.814 18.363 -3.341 376 HA TRP 50 HA TRP 50 -2.564 17.126 -5.667 377 HB2 TRP 50 2HB TRP 50 -0.551 18.313 -6.705 378 HB3 TRP 50 1HB TRP 50 -1.710 19.324 -5.834 379 HD1 TRP 50 HD TRP 50 -0.906 20.340 -3.468 380 HE1 TRP 50 1HE TRP 50 1.445 20.779 -2.518 381 HE3 TRP 50 3HE TRP 50 1.821 17.429 -6.668 382 HZ2 TRP 50 2HZ TRP 50 4.103 19.996 -3.054 383 HZ3 TRP 50 3HZ TRP 50 4.262 17.331 -6.380 384 HH2 TRP 50 HH TRP 50 5.379 18.589 -4.611 385 H CYS 51 H CYS 51 0.487 16.707 -3.924 386 HA CYS 51 HA CYS 51 2.223 15.247 -4.214 387 HB2 CYS 51 2HB CYS 51 1.545 12.925 -3.864 388 HB3 CYS 51 1HB CYS 51 0.629 14.013 -2.828 389 H GLY 52 H GLY 52 3.299 15.516 -6.135 390 HA2 GLY 52 2HA GLY 52 2.281 14.899 -8.686 391 HA3 GLY 52 1HA GLY 52 3.994 15.038 -8.285 392 H ALA 53 H ALA 53 3.745 12.894 -6.240 393 HA ALA 53 HA ALA 53 4.500 10.707 -7.823 394 HB1 ALA 53 1HB ALA 53 3.501 9.868 -5.252 395 HB2 ALA 53 2HB ALA 53 4.496 11.315 -5.102 396 HB3 ALA 53 3HB ALA 53 5.154 9.869 -5.866 397 H CYS 54 H CYS 54 1.436 11.940 -7.119 398 HA CYS 54 HA CYS 54 0.153 9.394 -7.764 399 HB2 CYS 54 2HB CYS 54 -1.439 11.776 -6.920 400 HB3 CYS 54 1HB CYS 54 -1.704 10.062 -6.568 401 H LYS 55 H LYS 55 0.555 12.716 -8.742 402 HA LYS 55 HA LYS 55 -1.425 12.886 -10.709 403 HB2 LYS 55 2HB LYS 55 0.669 14.507 -9.760 404 HB3 LYS 55 1HB LYS 55 0.949 14.334 -11.487 405 HG2 LYS 55 2HG LYS 55 -1.230 15.192 -11.991 406 HG3 LYS 55 1HG LYS 55 -1.668 15.199 -10.274 407 HD2 LYS 55 2HD LYS 55 0.401 16.754 -10.026 408 HD3 LYS 55 1HD LYS 55 0.209 16.997 -11.764 409 HE2 LYS 55 2HE LYS 55 -2.012 17.836 -11.467 410 HE3 LYS 55 1HE LYS 55 -2.007 17.391 -9.761 411 HZ1 LYS 55 3HZ LYS 55 -1.626 19.758 -10.069 412 HZ2 LYS 55 1HZ LYS 55 -0.259 19.442 -11.014 413 HZ3 LYS 55 2HZ LYS 55 -0.271 19.023 -9.374 414 H ALA 56 H ALA 56 2.004 11.931 -10.994 415 HA ALA 56 HA ALA 56 1.928 11.432 -13.764 416 HB1 ALA 56 1HB ALA 56 3.917 11.588 -12.028 417 HB2 ALA 56 2HB ALA 56 4.073 10.692 -13.539 418 HB3 ALA 56 3HB ALA 56 3.739 9.834 -12.034 419 H LEU 57 H LEU 57 0.819 9.584 -11.053 420 HA LEU 57 HA LEU 57 0.842 7.024 -12.257 421 HB2 LEU 57 2HB LEU 57 -1.077 7.917 -10.129 422 HB3 LEU 57 1HB LEU 57 -0.475 6.300 -10.434 423 HG LEU 57 HG LEU 57 1.046 8.620 -9.271 424 HD11 LEU 57 1HD1 LEU 57 0.907 5.979 -7.962 425 HD12 LEU 57 2HD1 LEU 57 -0.587 6.914 -7.999 426 HD13 LEU 57 3HD1 LEU 57 0.863 7.598 -7.263 427 HD21 LEU 57 3HD2 LEU 57 2.754 7.686 -10.447 428 HD22 LEU 57 1HD2 LEU 57 1.990 6.099 -10.513 429 HD23 LEU 57 2HD2 LEU 57 2.786 6.633 -9.032 430 H LYS 58 H LYS 58 -1.478 9.660 -12.298 431 HA LYS 58 HA LYS 58 -3.750 8.322 -13.096 432 HB2 LYS 58 2HB LYS 58 -2.813 11.034 -13.155 433 HB3 LYS 58 1HB LYS 58 -3.704 10.686 -14.631 434 HG2 LYS 58 2HG LYS 58 -5.588 9.874 -13.257 435 HG3 LYS 58 1HG LYS 58 -4.695 10.342 -11.808 436 HD2 LYS 58 2HD LYS 58 -5.584 12.185 -14.028 437 HD3 LYS 58 1HD LYS 58 -6.310 12.062 -12.423 438 HE2 LYS 58 2HE LYS 58 -3.734 12.512 -11.758 439 HE3 LYS 58 1HE LYS 58 -3.819 13.381 -13.289 440 HZ1 LYS 58 3HZ LYS 58 -5.931 14.408 -12.297 441 HZ2 LYS 58 1HZ LYS 58 -4.434 14.956 -11.727 442 HZ3 LYS 58 2HZ LYS 58 -5.339 13.863 -10.809 443 HA PRO 59 HA PRO 59 -2.637 8.477 -17.727 444 HB2 PRO 59 2HB PRO 59 -0.070 9.709 -18.181 445 HB3 PRO 59 1HB PRO 59 -1.674 10.269 -18.683 446 HG2 PRO 59 2HG PRO 59 -0.113 11.526 -16.806 447 HG3 PRO 59 1HG PRO 59 -1.878 11.661 -16.889 448 HD2 PRO 59 2HD PRO 59 -0.181 9.964 -15.097 449 HD3 PRO 59 1HD PRO 59 -1.671 10.866 -14.731 450 H LYS 60 H LYS 60 0.012 7.758 -15.561 451 HA LYS 60 HA LYS 60 1.141 5.876 -17.500 452 HB2 LYS 60 2HB LYS 60 3.081 5.798 -16.192 453 HB3 LYS 60 1HB LYS 60 2.560 7.474 -16.076 454 HG2 LYS 60 2HG LYS 60 1.366 6.747 -13.945 455 HG3 LYS 60 1HG LYS 60 2.355 5.299 -14.020 456 HD2 LYS 60 2HD LYS 60 3.040 7.691 -12.807 457 HD3 LYS 60 1HD LYS 60 4.137 6.377 -13.208 458 HE2 LYS 60 2HE LYS 60 4.562 7.447 -15.397 459 HE3 LYS 60 1HE LYS 60 3.517 8.783 -14.921 460 HZ1 LYS 60 3HZ LYS 60 5.506 9.636 -14.309 461 HZ2 LYS 60 1HZ LYS 60 6.217 8.128 -14.030 462 HZ3 LYS 60 2HZ LYS 60 5.172 8.796 -12.881 463 H PHE 61 H PHE 61 -0.083 5.902 -14.157 464 HA PHE 61 HA PHE 61 0.023 3.100 -13.861 465 HB2 PHE 61 2HB PHE 61 -0.164 4.868 -12.007 466 HB3 PHE 61 1HB PHE 61 -1.894 4.871 -12.365 467 HD1 PHE 61 1HD PHE 61 0.908 2.923 -11.046 468 HD2 PHE 61 2HD PHE 61 -3.281 2.983 -11.790 469 HE1 PHE 61 1HE PHE 61 0.627 0.947 -9.607 470 HE2 PHE 61 2HE PHE 61 -3.568 1.011 -10.351 471 HZ PHE 61 HZ PHE 61 -1.614 -0.011 -9.256 472 H ALA 62 H ALA 62 -2.114 5.221 -15.530 473 HA ALA 62 HA ALA 62 -4.447 3.650 -15.554 474 HB1 ALA 62 1HB ALA 62 -5.056 5.453 -16.740 475 HB2 ALA 62 2HB ALA 62 -4.213 4.742 -18.116 476 HB3 ALA 62 3HB ALA 62 -3.376 5.880 -17.060 477 H GLU 63 H GLU 63 -1.325 3.280 -16.827 478 HA GLU 63 HA GLU 63 -1.786 1.381 -18.898 479 HB2 GLU 63 2HB GLU 63 0.240 2.937 -18.533 480 HB3 GLU 63 1HB GLU 63 0.767 1.752 -17.334 481 HG2 GLU 63 2HG GLU 63 0.828 0.025 -19.049 482 HG3 GLU 63 1HG GLU 63 0.258 1.180 -20.253 483 H SER 64 H SER 64 -1.878 1.259 -15.547 484 HA SER 64 HA SER 64 -0.823 -1.176 -14.847 485 HB2 SER 64 2HB SER 64 -3.139 0.400 -13.804 486 HB3 SER 64 1HB SER 64 -2.681 -1.126 -13.068 487 HG SER 64 HG SER 64 -1.072 -0.152 -12.139 488 H THR 65 H THR 65 -3.039 -0.888 -17.254 489 HA THR 65 HA THR 65 -5.062 -2.688 -16.800 490 HB THR 65 HB THR 65 -4.518 -3.388 -19.310 491 HG1 THR 65 1HG THR 65 -3.357 -1.695 -20.327 492 HG21 THR 65 3HG2 THR 65 -5.459 -0.662 -18.472 493 HG22 THR 65 1HG2 THR 65 -6.442 -2.076 -18.852 494 HG23 THR 65 2HG2 THR 65 -5.532 -1.265 -20.127 495 H GLU 66 H GLU 66 -1.675 -3.276 -17.489 496 HA GLU 66 HA GLU 66 -1.964 -6.150 -17.418 497 HB2 GLU 66 2HB GLU 66 0.465 -6.213 -17.662 498 HB3 GLU 66 1HB GLU 66 -0.236 -5.107 -18.849 499 HG2 GLU 66 2HG GLU 66 0.404 -3.691 -16.448 500 HG3 GLU 66 1HG GLU 66 1.811 -4.595 -17.003 501 H ILE 67 H ILE 67 -1.188 -3.517 -15.270 502 HA ILE 67 HA ILE 67 -0.156 -5.195 -13.188 503 HB ILE 67 HB ILE 67 -1.360 -2.435 -12.944 504 HG12 ILE 67 2HG1 ILE 67 1.546 -3.233 -13.242 505 HG13 ILE 67 1HG1 ILE 67 0.551 -2.546 -14.535 506 HG21 ILE 67 1HG2 ILE 67 -1.246 -3.027 -10.765 507 HG22 ILE 67 2HG2 ILE 67 0.446 -2.573 -10.971 508 HG23 ILE 67 3HG2 ILE 67 -0.028 -4.270 -11.055 509 HD11 ILE 67 3HD1 ILE 67 0.649 -0.458 -13.676 510 HD12 ILE 67 1HD1 ILE 67 2.162 -1.080 -13.015 511 HD13 ILE 67 2HD1 ILE 67 0.717 -1.022 -12.006 512 H SER 68 H SER 68 -3.237 -4.627 -14.484 513 HA SER 68 HA SER 68 -4.845 -4.897 -12.172 514 HB2 SER 68 2HB SER 68 -5.295 -4.496 -14.902 515 HB3 SER 68 1HB SER 68 -6.046 -6.054 -14.559 516 HG SER 68 HG SER 68 -7.063 -3.721 -14.086 517 H GLU 69 H GLU 69 -3.211 -7.156 -14.272 518 HA GLU 69 HA GLU 69 -4.460 -9.437 -12.986 519 HB2 GLU 69 2HB GLU 69 -2.673 -10.675 -14.470 520 HB3 GLU 69 1HB GLU 69 -4.145 -10.033 -15.183 521 HG2 GLU 69 2HG GLU 69 -2.882 -8.011 -15.837 522 HG3 GLU 69 1HG GLU 69 -1.414 -8.778 -15.233 523 H LEU 70 H LEU 70 -1.329 -7.837 -13.202 524 HA LEU 70 HA LEU 70 0.096 -9.627 -11.530 525 HB2 LEU 70 2HB LEU 70 0.455 -6.770 -12.343 526 HB3 LEU 70 1HB LEU 70 1.459 -7.435 -11.058 527 HG LEU 70 HG LEU 70 1.401 -9.110 -13.457 528 HD11 LEU 70 1HD1 LEU 70 2.427 -7.702 -14.974 529 HD12 LEU 70 2HD1 LEU 70 2.899 -6.542 -13.730 530 HD13 LEU 70 3HD1 LEU 70 1.216 -6.644 -14.248 531 HD21 LEU 70 3HD2 LEU 70 3.077 -9.724 -12.046 532 HD22 LEU 70 1HD2 LEU 70 3.331 -8.083 -11.450 533 HD23 LEU 70 2HD2 LEU 70 3.967 -8.558 -13.024 534 H SER 71 H SER 71 -2.294 -7.266 -10.905 535 HA SER 71 HA SER 71 -1.810 -6.220 -8.457 536 HB2 SER 71 2HB SER 71 -4.135 -6.752 -10.032 537 HB3 SER 71 1HB SER 71 -4.487 -7.097 -8.339 538 HG SER 71 HG SER 71 -3.318 -4.694 -9.295 539 H HIS 72 H HIS 72 -2.202 -9.585 -9.087 540 HA HIS 72 HA HIS 72 -3.190 -10.507 -6.651 541 HB2 HIS 72 2HB HIS 72 -1.853 -12.599 -7.170 542 HB3 HIS 72 1HB HIS 72 -2.957 -12.068 -8.447 543 HD1 HIS 72 1HD HIS 72 0.694 -11.323 -7.608 544 HD2 HIS 72 2HD HIS 72 -1.736 -12.302 -10.834 545 HE1 HIS 72 1HE HIS 72 2.228 -11.430 -9.598 546 HE2 HIS 72 2HE HIS 72 0.752 -12.121 -11.519 547 H ASN 73 H ASN 73 -0.342 -8.864 -7.368 548 HA ASN 73 HA ASN 73 1.406 -9.924 -5.409 549 HB2 ASN 73 2HB ASN 73 2.516 -7.601 -5.736 550 HB3 ASN 73 1HB ASN 73 2.491 -8.726 -7.094 551 HD21 ASN 73 1HD2 ASN 73 2.414 -7.434 -8.818 552 HD22 ASN 73 2HD2 ASN 73 1.210 -6.205 -9.088 553 H PHE 74 H PHE 74 -0.632 -7.002 -5.437 554 HA PHE 74 HA PHE 74 -0.651 -7.047 -2.517 555 HB2 PHE 74 2HB PHE 74 -0.053 -4.778 -4.390 556 HB3 PHE 74 1HB PHE 74 -0.698 -4.484 -2.775 557 HD1 PHE 74 2HD PHE 74 0.573 -5.531 -0.799 558 HD2 PHE 74 1HD PHE 74 2.223 -5.075 -4.694 559 HE1 PHE 74 2HE PHE 74 2.837 -5.759 0.137 560 HE2 PHE 74 1HE PHE 74 4.489 -5.305 -3.767 561 HZ PHE 74 HZ PHE 74 4.799 -5.649 -1.348 562 H VAL 75 H VAL 75 -2.585 -5.860 -1.604 563 HA VAL 75 HA VAL 75 -4.817 -6.086 -3.520 564 HB VAL 75 HB VAL 75 -4.788 -7.852 -1.824 565 HG11 VAL 75 1HG1 VAL 75 -4.431 -5.589 -0.048 566 HG12 VAL 75 2HG1 VAL 75 -4.128 -7.304 0.228 567 HG13 VAL 75 3HG1 VAL 75 -5.747 -6.645 0.466 568 HG21 VAL 75 3HG2 VAL 75 -6.899 -7.228 -2.807 569 HG22 VAL 75 1HG2 VAL 75 -7.088 -5.914 -1.647 570 HG23 VAL 75 2HG2 VAL 75 -7.139 -7.588 -1.096 571 H MET 76 H MET 76 -6.452 -4.731 -3.576 572 HA MET 76 HA MET 76 -6.389 -2.133 -3.421 573 HB2 MET 76 2HB MET 76 -8.837 -2.210 -3.162 574 HB3 MET 76 1HB MET 76 -8.197 -3.317 -4.359 575 HG2 MET 76 2HG MET 76 -8.414 -4.469 -1.692 576 HG3 MET 76 1HG MET 76 -9.957 -3.964 -2.375 577 HE1 MET 76 3HE MET 76 -10.874 -7.199 -3.750 578 HE2 MET 76 1HE MET 76 -11.221 -5.763 -2.787 579 HE3 MET 76 2HE MET 76 -10.266 -7.076 -2.098 580 H VAL 77 H VAL 77 -5.299 -1.214 -1.572 581 HA VAL 77 HA VAL 77 -7.198 -0.642 0.545 582 HB VAL 77 HB VAL 77 -4.402 -1.578 1.213 583 HG11 VAL 77 1HG1 VAL 77 -4.735 -0.077 2.894 584 HG12 VAL 77 2HG1 VAL 77 -5.628 -1.436 3.579 585 HG13 VAL 77 3HG1 VAL 77 -6.493 -0.146 2.747 586 HG21 VAL 77 3HG2 VAL 77 -5.700 -3.323 2.501 587 HG22 VAL 77 1HG2 VAL 77 -5.698 -3.485 0.745 588 HG23 VAL 77 2HG2 VAL 77 -7.108 -2.818 1.568 589 H ASN 78 H ASN 78 -6.760 1.079 -1.354 590 HA ASN 78 HA ASN 78 -4.595 2.862 -0.605 591 HB2 ASN 78 2HB ASN 78 -4.625 3.076 -2.850 592 HB3 ASN 78 1HB ASN 78 -6.265 2.462 -2.974 593 HD21 ASN 78 1HD2 ASN 78 -4.682 5.319 -1.613 594 HD22 ASN 78 2HD2 ASN 78 -5.750 6.476 -2.341 595 H LEU 79 H LEU 79 -4.988 3.982 1.163 596 HA LEU 79 HA LEU 79 -7.658 4.983 1.735 597 HB2 LEU 79 2HB LEU 79 -6.822 4.251 3.710 598 HB3 LEU 79 1HB LEU 79 -5.163 4.558 3.252 599 HG LEU 79 HG LEU 79 -5.662 7.030 3.645 600 HD11 LEU 79 1HD1 LEU 79 -8.173 6.608 3.624 601 HD12 LEU 79 2HD1 LEU 79 -7.546 7.655 4.896 602 HD13 LEU 79 3HD1 LEU 79 -7.964 5.982 5.260 603 HD21 LEU 79 3HD2 LEU 79 -5.776 6.494 6.257 604 HD22 LEU 79 1HD2 LEU 79 -4.321 6.243 5.291 605 HD23 LEU 79 2HD2 LEU 79 -5.383 4.882 5.656 606 H GLU 80 H GLU 80 -8.287 7.090 1.734 607 HA GLU 80 HA GLU 80 -6.430 8.989 0.483 608 HB2 GLU 80 2HB GLU 80 -8.910 8.321 -0.329 609 HB3 GLU 80 1HB GLU 80 -9.305 9.669 0.745 610 HG2 GLU 80 2HG GLU 80 -8.911 10.992 -0.991 611 HG3 GLU 80 1HG GLU 80 -7.194 10.635 -0.745 612 H ASP 81 H ASP 81 -7.393 11.384 1.095 613 HA ASP 81 HA ASP 81 -6.458 11.854 3.706 614 HB2 ASP 81 2HB ASP 81 -7.259 14.171 3.352 615 HB3 ASP 81 1HB ASP 81 -6.326 13.566 1.987 616 H GLU 82 H GLU 82 -9.567 10.963 2.537 617 HA GLU 82 HA GLU 82 -11.315 12.085 4.343 618 HB2 GLU 82 2HB GLU 82 -11.619 10.338 2.354 619 HB3 GLU 82 1HB GLU 82 -11.687 9.204 3.696 620 HG2 GLU 82 2HG GLU 82 -13.354 11.552 4.106 621 HG3 GLU 82 1HG GLU 82 -13.793 10.628 2.670 622 H GLU 83 H GLU 83 -9.012 9.514 4.847 623 HA GLU 83 HA GLU 83 -9.861 9.374 7.666 624 HB2 GLU 83 2HB GLU 83 -9.702 7.273 5.772 625 HB3 GLU 83 1HB GLU 83 -8.379 7.037 6.905 626 HG2 GLU 83 2HG GLU 83 -9.849 6.908 8.748 627 HG3 GLU 83 1HG GLU 83 -11.211 7.501 7.791 628 H GLU 84 H GLU 84 -8.366 9.916 9.119 629 HA GLU 84 HA GLU 84 -5.574 10.141 8.211 630 HB2 GLU 84 2HB GLU 84 -7.291 11.860 9.908 631 HB3 GLU 84 1HB GLU 84 -5.612 11.701 10.405 632 HG2 GLU 84 2HG GLU 84 -5.120 12.252 7.904 633 HG3 GLU 84 1HG GLU 84 -6.753 12.920 7.939 634 HA PRO 85 HA PRO 85 -5.411 6.562 11.110 635 HB2 PRO 85 2HB PRO 85 -2.652 6.683 9.978 636 HB3 PRO 85 1HB PRO 85 -3.708 5.281 10.235 637 HG2 PRO 85 2HG PRO 85 -3.355 6.286 7.793 638 HG3 PRO 85 1HG PRO 85 -4.951 5.702 8.320 639 HD2 PRO 85 2HD PRO 85 -3.956 8.502 8.011 640 HD3 PRO 85 1HD PRO 85 -5.582 7.836 7.724 641 H LYS 86 H LYS 86 -3.398 9.397 10.746 642 HA LYS 86 HA LYS 86 -2.191 10.638 12.220 643 HB2 LYS 86 2HB LYS 86 -4.291 9.360 13.864 644 HB3 LYS 86 1HB LYS 86 -2.903 9.994 14.757 645 HG2 LYS 86 2HG LYS 86 -3.701 12.049 14.596 646 HG3 LYS 86 1HG LYS 86 -3.736 11.934 12.835 647 HD2 LYS 86 2HD LYS 86 -5.952 11.484 12.777 648 HD3 LYS 86 1HD LYS 86 -5.904 10.530 14.263 649 HE2 LYS 86 2HE LYS 86 -5.459 12.868 15.369 650 HE3 LYS 86 1HE LYS 86 -6.221 13.473 13.899 651 HZ1 LYS 86 3HZ LYS 86 -8.226 12.670 14.500 652 HZ2 LYS 86 1HZ LYS 86 -7.586 12.800 16.061 653 HZ3 LYS 86 2HZ LYS 86 -7.593 11.305 15.271 654 H ASP 87 H ASP 87 -1.218 7.999 11.371 655 HA ASP 87 HA ASP 87 0.852 7.713 13.402 656 HB2 ASP 87 2HB ASP 87 -1.210 5.949 13.464 657 HB3 ASP 87 1HB ASP 87 -0.120 5.131 12.334 658 H GLU 88 H GLU 88 2.278 5.659 12.433 659 HA GLU 88 HA GLU 88 3.556 6.780 10.169 660 HB2 GLU 88 2HB GLU 88 3.928 4.000 11.280 661 HB3 GLU 88 1HB GLU 88 5.070 4.919 10.313 662 HG2 GLU 88 2HG GLU 88 4.144 5.752 13.047 663 HG3 GLU 88 1HG GLU 88 5.606 4.814 12.739 664 H ASP 89 H ASP 89 0.871 4.726 10.449 665 HA ASP 89 HA ASP 89 1.096 3.011 8.296 666 HB2 ASP 89 2HB ASP 89 -1.228 4.263 9.697 667 HB3 ASP 89 1HB ASP 89 -1.512 3.342 8.212 668 H PHE 90 H PHE 90 0.934 6.430 8.137 669 HA PHE 90 HA PHE 90 0.083 6.268 5.324 670 HB2 PHE 90 2HB PHE 90 -0.378 8.722 5.504 671 HB3 PHE 90 1HB PHE 90 -1.397 7.709 6.536 672 HD1 PHE 90 1HD PHE 90 1.879 9.510 6.745 673 HD2 PHE 90 2HD PHE 90 -1.782 8.470 8.650 674 HE1 PHE 90 1HE PHE 90 2.514 10.868 8.695 675 HE2 PHE 90 2HE PHE 90 -1.153 9.828 10.603 676 HZ PHE 90 HZ PHE 90 0.996 11.029 10.627 677 H SER 91 H SER 91 2.660 7.176 7.441 678 HA SER 91 HA SER 91 4.520 7.327 5.292 679 HB2 SER 91 2HB SER 91 4.091 9.914 6.808 680 HB3 SER 91 1HB SER 91 5.193 9.630 5.449 681 HG SER 91 HG SER 91 2.893 10.609 5.186 682 HA PRO 92 HA PRO 92 6.272 6.167 9.390 683 HB2 PRO 92 2HB PRO 92 7.627 3.978 8.473 684 HB3 PRO 92 1HB PRO 92 5.954 3.931 9.051 685 HG2 PRO 92 2HG PRO 92 7.005 3.856 6.288 686 HG3 PRO 92 1HG PRO 92 5.531 3.145 6.952 687 HD2 PRO 92 2HD PRO 92 5.667 5.469 5.427 688 HD3 PRO 92 1HD PRO 92 4.304 4.983 6.448 689 H ASP 93 H ASP 93 8.341 5.165 6.682 690 HA ASP 93 HA ASP 93 10.534 6.684 7.821 691 HB2 ASP 93 2HB ASP 93 10.534 4.249 6.737 692 HB3 ASP 93 1HB ASP 93 10.835 5.179 5.263 693 H GLY 94 H GLY 94 8.769 8.501 7.060 694 HA2 GLY 94 2HA GLY 94 10.170 10.042 5.134 695 HA3 GLY 94 1HA GLY 94 8.700 9.369 4.422 696 H GLY 95 H GLY 95 9.130 12.118 4.673 697 HA2 GLY 95 2HA GLY 95 7.348 12.873 6.901 698 HA3 GLY 95 1HA GLY 95 8.474 13.964 6.090 699 H TYR 96 H TYR 96 7.434 12.531 3.510 700 HA TYR 96 HA TYR 96 5.792 14.562 2.605 701 HB2 TYR 96 2HB TYR 96 4.931 12.568 1.012 702 HB3 TYR 96 1HB TYR 96 6.480 13.389 0.791 703 HD1 TYR 96 2HD TYR 96 8.575 12.277 1.494 704 HD2 TYR 96 1HD TYR 96 4.827 10.270 1.672 705 HE1 TYR 96 2HE TYR 96 9.744 10.125 1.675 706 HE2 TYR 96 1HE TYR 96 5.985 8.105 1.838 707 HH TYR 96 HH TYR 96 8.852 7.485 1.002 708 H ILE 97 H ILE 97 3.458 13.897 1.625 709 HA ILE 97 HA ILE 97 1.872 12.500 3.611 710 HB ILE 97 HB ILE 97 0.300 14.612 3.602 711 HG12 ILE 97 2HG1 ILE 97 2.751 16.217 3.713 712 HG13 ILE 97 1HG1 ILE 97 2.370 15.611 2.096 713 HG21 ILE 97 1HG2 ILE 97 1.384 15.380 5.669 714 HG22 ILE 97 2HG2 ILE 97 2.797 14.400 5.272 715 HG23 ILE 97 3HG2 ILE 97 1.247 13.622 5.593 716 HD11 ILE 97 3HD1 ILE 97 0.490 16.865 1.918 717 HD12 ILE 97 1HD1 ILE 97 1.446 17.911 2.970 718 HD13 ILE 97 2HD1 ILE 97 0.195 16.877 3.661 719 HA PRO 98 HA PRO 98 1.344 10.369 2.895 720 HB2 PRO 98 2HB PRO 98 -1.413 9.762 1.752 721 HB3 PRO 98 1HB PRO 98 -0.566 8.913 3.077 722 HG2 PRO 98 2HG PRO 98 -2.048 11.349 3.204 723 HG3 PRO 98 1HG PRO 98 -1.162 10.517 4.515 724 HD2 PRO 98 2HD PRO 98 -0.232 12.802 3.737 725 HD3 PRO 98 1HD PRO 98 0.911 11.450 3.859 726 H ARG 99 H ARG 99 2.204 8.514 1.951 727 HA ARG 99 HA ARG 99 2.125 8.504 -0.999 728 HB2 ARG 99 2HB ARG 99 4.327 8.506 0.913 729 HB3 ARG 99 1HB ARG 99 4.479 7.249 -0.314 730 HG2 ARG 99 2HG ARG 99 5.613 9.310 -0.952 731 HG3 ARG 99 1HG ARG 99 4.315 8.901 -2.071 732 HD2 ARG 99 2HD ARG 99 2.907 10.480 -0.518 733 HD3 ARG 99 1HD ARG 99 4.487 11.112 -0.077 734 HE ARG 99 HE ARG 99 4.147 10.964 -2.902 735 HH11 ARG 99 1HH1 ARG 99 3.359 12.871 -0.087 736 HH12 ARG 99 2HH1 ARG 99 3.259 14.357 -0.967 737 HH21 ARG 99 1HH2 ARG 99 4.015 12.922 -4.061 738 HH22 ARG 99 2HH2 ARG 99 3.634 14.387 -3.221 739 H ILE 100 H ILE 100 3.479 6.203 -1.538 740 HA ILE 100 HA ILE 100 1.446 4.229 -1.027 741 HB ILE 100 HB ILE 100 2.617 2.801 -2.539 742 HG12 ILE 100 2HG1 ILE 100 4.902 4.347 -3.290 743 HG13 ILE 100 1HG1 ILE 100 4.950 4.109 -1.549 744 HG21 ILE 100 1HG2 ILE 100 1.940 4.012 -4.267 745 HG22 ILE 100 2HG2 ILE 100 3.316 5.102 -4.102 746 HG23 ILE 100 3HG2 ILE 100 1.834 5.412 -3.199 747 HD11 ILE 100 3HD1 ILE 100 6.095 2.390 -3.061 748 HD12 ILE 100 1HD1 ILE 100 4.463 1.817 -3.404 749 HD13 ILE 100 2HD1 ILE 100 5.074 1.799 -1.749 750 H LEU 101 H LEU 101 1.578 2.384 0.236 751 HA LEU 101 HA LEU 101 4.043 1.973 1.778 752 HB2 LEU 101 2HB LEU 101 1.336 2.635 2.780 753 HB3 LEU 101 1HB LEU 101 2.235 1.426 3.667 754 HG LEU 101 HG LEU 101 4.047 3.048 4.008 755 HD11 LEU 101 1HD1 LEU 101 2.980 5.504 3.578 756 HD12 LEU 101 2HD1 LEU 101 2.403 4.623 2.165 757 HD13 LEU 101 3HD1 LEU 101 4.132 4.709 2.508 758 HD21 LEU 101 3HD2 LEU 101 3.023 3.631 5.897 759 HD22 LEU 101 1HD2 LEU 101 1.565 2.881 5.237 760 HD23 LEU 101 2HD2 LEU 101 1.841 4.614 5.033 761 H PHE 102 H PHE 102 4.562 -0.134 2.178 762 HA PHE 102 HA PHE 102 2.609 -2.151 1.283 763 HB2 PHE 102 2HB PHE 102 5.619 -2.283 1.531 764 HB3 PHE 102 1HB PHE 102 4.605 -3.661 1.118 765 HD1 PHE 102 2HD PHE 102 2.967 -3.212 -0.922 766 HD2 PHE 102 1HD PHE 102 6.577 -1.091 -0.187 767 HE1 PHE 102 2HE PHE 102 3.086 -2.590 -3.301 768 HE2 PHE 102 1HE PHE 102 6.698 -0.459 -2.557 769 HZ PHE 102 HZ PHE 102 4.950 -1.210 -4.120 770 H LEU 103 H LEU 103 1.876 -3.696 2.738 771 HA LEU 103 HA LEU 103 3.238 -3.850 5.325 772 HB2 LEU 103 2HB LEU 103 1.387 -3.260 6.620 773 HB3 LEU 103 1HB LEU 103 1.489 -2.041 5.368 774 HG LEU 103 HG LEU 103 -0.460 -4.330 5.490 775 HD11 LEU 103 1HD1 LEU 103 -2.125 -2.544 5.611 776 HD12 LEU 103 2HD1 LEU 103 -0.828 -1.351 5.682 777 HD13 LEU 103 3HD1 LEU 103 -1.023 -2.521 6.986 778 HD21 LEU 103 3HD2 LEU 103 -0.199 -4.167 3.243 779 HD22 LEU 103 1HD2 LEU 103 0.339 -2.489 3.306 780 HD23 LEU 103 2HD2 LEU 103 -1.374 -2.876 3.482 781 H ASP 104 H ASP 104 2.072 -5.423 6.819 782 HA ASP 104 HA ASP 104 1.987 -7.954 5.528 783 HB2 ASP 104 2HB ASP 104 2.879 -7.726 7.784 784 HB3 ASP 104 1HB ASP 104 1.315 -7.139 8.368 785 HA PRO 105 HA PRO 105 -2.264 -8.264 4.372 786 HB2 PRO 105 2HB PRO 105 -2.607 -10.977 4.903 787 HB3 PRO 105 1HB PRO 105 -1.992 -10.288 3.391 788 HG2 PRO 105 2HG PRO 105 -0.508 -11.494 5.676 789 HG3 PRO 105 1HG PRO 105 -0.146 -11.546 3.936 790 HD2 PRO 105 2HD PRO 105 1.208 -9.954 5.646 791 HD3 PRO 105 1HD PRO 105 0.895 -9.488 3.966 792 H SER 106 H SER 106 -3.112 -7.027 6.052 793 HA SER 106 HA SER 106 -5.100 -8.039 7.587 794 HB2 SER 106 2HB SER 106 -3.952 -7.873 9.935 795 HB3 SER 106 1HB SER 106 -3.792 -9.368 8.998 796 HG SER 106 HG SER 106 -1.818 -8.299 9.967 797 H GLY 107 H GLY 107 -2.516 -5.735 7.298 798 HA2 GLY 107 2HA GLY 107 -3.211 -3.399 7.012 799 HA3 GLY 107 1HA GLY 107 -4.315 -3.651 8.369 800 H LYS 108 H LYS 108 -0.934 -4.703 8.083 801 HA LYS 108 HA LYS 108 -0.339 -2.937 10.378 802 HB2 LYS 108 2HB LYS 108 0.453 -5.757 9.791 803 HB3 LYS 108 1HB LYS 108 1.543 -4.743 10.729 804 HG2 LYS 108 2HG LYS 108 -0.671 -4.239 12.085 805 HG3 LYS 108 1HG LYS 108 -1.130 -5.822 11.430 806 HD2 LYS 108 2HD LYS 108 0.954 -6.769 12.352 807 HD3 LYS 108 1HD LYS 108 1.340 -5.196 13.053 808 HE2 LYS 108 2HE LYS 108 -0.470 -5.300 14.549 809 HE3 LYS 108 1HE LYS 108 -1.238 -6.612 13.656 810 HZ1 LYS 108 3HZ LYS 108 1.417 -7.155 14.713 811 HZ2 LYS 108 1HZ LYS 108 0.056 -8.156 14.636 812 HZ3 LYS 108 2HZ LYS 108 0.182 -6.993 15.858 813 H VAL 109 H VAL 109 0.243 -1.276 8.803 814 HA VAL 109 HA VAL 109 2.178 -1.437 6.848 815 HB VAL 109 HB VAL 109 1.434 0.804 8.712 816 HG11 VAL 109 1HG1 VAL 109 3.213 0.919 6.293 817 HG12 VAL 109 2HG1 VAL 109 3.699 1.185 7.966 818 HG13 VAL 109 3HG1 VAL 109 2.593 2.309 7.180 819 HG21 VAL 109 3HG2 VAL 109 -0.348 0.170 7.246 820 HG22 VAL 109 1HG2 VAL 109 0.737 0.157 5.857 821 HG23 VAL 109 2HG2 VAL 109 0.340 1.682 6.650 822 H HIS 110 H HIS 110 4.258 -1.756 6.779 823 HA HIS 110 HA HIS 110 5.813 -1.251 9.225 824 HB2 HIS 110 2HB HIS 110 7.190 -3.304 8.581 825 HB3 HIS 110 1HB HIS 110 5.604 -3.603 9.283 826 HD1 HIS 110 1HD HIS 110 4.345 -5.355 8.099 827 HD2 HIS 110 2HD HIS 110 6.940 -3.350 5.547 828 HE1 HIS 110 1HE HIS 110 4.098 -6.483 5.867 829 HE2 HIS 110 2HE HIS 110 5.611 -5.193 4.317 830 HA PRO 111 HA PRO 111 8.252 1.010 6.287 831 HB2 PRO 111 2HB PRO 111 10.435 1.452 7.843 832 HB3 PRO 111 1HB PRO 111 8.920 2.342 8.038 833 HG2 PRO 111 2HG PRO 111 9.963 0.011 9.597 834 HG3 PRO 111 1HG PRO 111 9.153 1.476 10.181 835 HD2 PRO 111 2HD PRO 111 7.871 -0.896 9.895 836 HD3 PRO 111 1HD PRO 111 7.056 0.670 9.672 837 H GLU 112 H GLU 112 8.261 -1.888 6.150 838 HA GLU 112 HA GLU 112 11.089 -2.573 5.853 839 HB2 GLU 112 2HB GLU 112 8.656 -4.039 6.383 840 HB3 GLU 112 1HB GLU 112 9.504 -4.736 5.011 841 HG2 GLU 112 2HG GLU 112 10.709 -4.217 7.719 842 HG3 GLU 112 1HG GLU 112 10.129 -5.777 7.137 843 H ILE 113 H ILE 113 8.109 -2.747 3.911 844 HA ILE 113 HA ILE 113 9.777 -2.643 1.496 845 HB ILE 113 HB ILE 113 6.892 -3.503 1.744 846 HG12 ILE 113 2HG1 ILE 113 8.315 -5.119 2.828 847 HG13 ILE 113 1HG1 ILE 113 7.815 -5.776 1.263 848 HG21 ILE 113 1HG2 ILE 113 6.784 -3.685 -0.492 849 HG22 ILE 113 2HG2 ILE 113 8.440 -4.273 -0.623 850 HG23 ILE 113 3HG2 ILE 113 8.127 -2.544 -0.484 851 HD11 ILE 113 3HD1 ILE 113 10.083 -6.296 1.459 852 HD12 ILE 113 1HD1 ILE 113 10.492 -4.692 2.068 853 HD13 ILE 113 2HD1 ILE 113 10.032 -4.903 0.378 854 H ILE 114 H ILE 114 9.973 -0.746 0.605 855 HA ILE 114 HA ILE 114 7.822 1.234 0.897 856 HB ILE 114 HB ILE 114 9.719 2.843 0.210 857 HG12 ILE 114 2HG1 ILE 114 11.250 0.773 -0.227 858 HG13 ILE 114 1HG1 ILE 114 11.936 2.203 0.519 859 HG21 ILE 114 1HG2 ILE 114 10.567 2.509 2.774 860 HG22 ILE 114 2HG2 ILE 114 9.008 1.684 2.796 861 HG23 ILE 114 3HG2 ILE 114 9.106 3.371 2.292 862 HD11 ILE 114 3HD1 ILE 114 12.275 -0.301 1.432 863 HD12 ILE 114 1HD1 ILE 114 10.869 0.189 2.377 864 HD13 ILE 114 2HD1 ILE 114 12.356 1.136 2.450 865 H ASN 115 H ASN 115 10.407 0.418 -1.408 866 HA ASN 115 HA ASN 115 8.880 0.021 -3.658 867 HB2 ASN 115 2HB ASN 115 8.035 2.276 -3.506 868 HB3 ASN 115 1HB ASN 115 9.662 2.930 -3.271 869 HD21 ASN 115 1HD2 ASN 115 8.565 4.237 -5.108 870 HD22 ASN 115 2HD2 ASN 115 8.953 3.700 -6.719 871 H GLU 116 H GLU 116 11.777 1.457 -2.305 872 HA GLU 116 HA GLU 116 13.984 1.166 -2.719 873 HB2 GLU 116 2HB GLU 116 12.850 -1.214 -4.161 874 HB3 GLU 116 1HB GLU 116 14.580 -0.852 -4.234 875 HG2 GLU 116 2HG GLU 116 13.068 -1.158 -1.655 876 HG3 GLU 116 1HG GLU 116 13.855 -2.503 -2.477 877 H ASN 117 H ASN 117 12.441 0.327 -5.829 878 HA ASN 117 HA ASN 117 14.373 1.664 -7.384 879 HB2 ASN 117 2HB ASN 117 12.507 -0.133 -7.987 880 HB3 ASN 117 1HB ASN 117 11.608 1.320 -8.443 881 HD21 ASN 117 1HD2 ASN 117 14.785 -0.200 -8.857 882 HD22 ASN 117 2HD2 ASN 117 14.995 0.293 -10.515 883 H GLY 118 H GLY 118 11.866 2.915 -5.471 884 HA2 GLY 118 2HA GLY 118 10.907 5.077 -6.928 885 HA3 GLY 118 1HA GLY 118 11.097 5.057 -5.171 886 H ASN 119 H ASN 119 13.204 5.653 -4.312 887 HA ASN 119 HA ASN 119 15.210 6.851 -5.895 888 HB2 ASN 119 2HB ASN 119 13.253 8.510 -6.084 889 HB3 ASN 119 1HB ASN 119 13.573 8.884 -4.384 890 HD21 ASN 119 1HD2 ASN 119 14.720 10.640 -4.151 891 HD22 ASN 119 2HD2 ASN 119 16.001 11.186 -5.199 892 HA PRO 120 HA PRO 120 17.254 6.350 -2.002 893 HB2 PRO 120 2HB PRO 120 19.336 8.226 -2.771 894 HB3 PRO 120 1HB PRO 120 19.408 6.457 -2.677 895 HG2 PRO 120 2HG PRO 120 19.512 7.844 -5.024 896 HG3 PRO 120 1HG PRO 120 18.870 6.191 -4.887 897 HD2 PRO 120 2HD PRO 120 17.395 8.799 -5.036 898 HD3 PRO 120 1HD PRO 120 17.029 7.242 -5.825 899 H SER 121 H SER 121 15.187 8.296 -1.860 900 HA SER 121 HA SER 121 15.784 9.651 0.467 901 HB2 SER 121 2HB SER 121 16.493 11.165 -2.007 902 HB3 SER 121 1HB SER 121 15.682 12.052 -0.707 903 HG SER 121 HG SER 121 17.346 11.471 0.681 904 H TYR 122 H TYR 122 13.686 8.194 -0.621 905 HA TYR 122 HA TYR 122 11.471 9.815 0.025 906 HB2 TYR 122 2HB TYR 122 12.367 9.910 -2.701 907 HB3 TYR 122 1HB TYR 122 10.769 9.169 -2.624 908 HD1 TYR 122 2HD TYR 122 9.214 10.540 -0.769 909 HD2 TYR 122 1HD TYR 122 12.335 12.142 -3.175 910 HE1 TYR 122 2HE TYR 122 8.212 12.778 -0.569 911 HE2 TYR 122 1HE TYR 122 11.347 14.383 -2.979 912 HH TYR 122 HH TYR 122 8.980 15.159 -0.728 913 H LYS 123 H LYS 123 12.590 6.980 -1.757 914 HA LYS 123 HA LYS 123 11.836 4.832 -1.871 915 HB2 LYS 123 2HB LYS 123 11.044 5.558 0.945 916 HB3 LYS 123 1HB LYS 123 11.016 3.924 0.311 917 HG2 LYS 123 2HG LYS 123 13.447 5.681 0.532 918 HG3 LYS 123 1HG LYS 123 13.030 4.330 1.600 919 HD2 LYS 123 2HD LYS 123 14.111 2.957 0.224 920 HD3 LYS 123 1HD LYS 123 12.930 3.334 -1.037 921 HE2 LYS 123 2HE LYS 123 14.414 4.537 -2.187 922 HE3 LYS 123 1HE LYS 123 14.918 5.425 -0.749 923 HZ1 LYS 123 3HZ LYS 123 16.506 3.760 -2.062 924 HZ2 LYS 123 1HZ LYS 123 15.840 2.675 -0.945 925 HZ3 LYS 123 2HZ LYS 123 16.656 4.056 -0.403 926 H TYR 124 H TYR 124 9.207 5.679 0.315 927 HA TYR 124 HA TYR 124 7.212 4.391 -1.060 928 HB2 TYR 124 2HB TYR 124 7.010 6.798 0.748 929 HB3 TYR 124 1HB TYR 124 5.617 5.870 0.187 930 HD1 TYR 124 1HD TYR 124 6.306 3.130 0.474 931 HD2 TYR 124 2HD TYR 124 7.401 6.390 2.973 932 HE1 TYR 124 1HE TYR 124 6.538 1.589 2.374 933 HE2 TYR 124 2HE TYR 124 7.651 4.859 4.872 934 HH TYR 124 HH TYR 124 6.375 1.922 5.041 935 H PHE 125 H PHE 125 8.716 7.299 -2.012 936 HA PHE 125 HA PHE 125 6.546 8.538 -3.362 937 HB2 PHE 125 2HB PHE 125 8.594 9.748 -2.720 938 HB3 PHE 125 1HB PHE 125 9.523 8.760 -3.854 939 HD1 PHE 125 2HD PHE 125 6.385 10.796 -3.990 940 HD2 PHE 125 1HD PHE 125 10.142 9.848 -5.748 941 HE1 PHE 125 2HE PHE 125 5.965 12.442 -5.772 942 HE2 PHE 125 1HE PHE 125 9.730 11.492 -7.530 943 HZ PHE 125 HZ PHE 125 7.639 12.790 -7.544 944 H TYR 126 H TYR 126 5.538 7.820 -5.131 945 HA TYR 126 HA TYR 126 6.898 5.865 -6.820 946 HB2 TYR 126 2HB TYR 126 4.112 6.391 -6.094 947 HB3 TYR 126 1HB TYR 126 4.331 6.125 -7.827 948 HD1 TYR 126 2HD TYR 126 6.825 4.177 -7.124 949 HD2 TYR 126 1HD TYR 126 2.714 4.365 -6.043 950 HE1 TYR 126 2HE TYR 126 6.819 1.750 -6.744 951 HE2 TYR 126 1HE TYR 126 2.699 1.937 -5.661 952 HH TYR 126 HH TYR 126 4.454 -0.110 -6.760 953 H VAL 127 H VAL 127 7.187 6.107 -8.999 954 HA VAL 127 HA VAL 127 6.254 8.395 -10.439 955 HB VAL 127 HB VAL 127 8.641 9.111 -11.052 956 HG11 VAL 127 1HG1 VAL 127 7.827 9.777 -8.239 957 HG12 VAL 127 2HG1 VAL 127 6.943 10.366 -9.647 958 HG13 VAL 127 3HG1 VAL 127 8.636 10.806 -9.419 959 HG21 VAL 127 3HG2 VAL 127 9.146 7.454 -8.613 960 HG22 VAL 127 1HG2 VAL 127 10.159 8.852 -8.966 961 HG23 VAL 127 2HG2 VAL 127 10.052 7.527 -10.124 962 H SER 128 H SER 128 5.517 7.078 -11.989 963 HA SER 128 HA SER 128 5.814 6.193 -14.140 964 HB2 SER 128 2HB SER 128 7.841 5.480 -14.998 965 HB3 SER 128 1HB SER 128 8.388 6.631 -13.769 966 HG SER 128 HG SER 128 9.491 4.986 -13.062 967 H ALA 129 H ALA 129 4.751 4.403 -14.653 968 HA ALA 129 HA ALA 129 4.088 2.494 -12.668 969 HB1 ALA 129 1HB ALA 129 2.442 1.940 -14.070 970 HB2 ALA 129 2HB ALA 129 3.558 1.650 -15.406 971 HB3 ALA 129 3HB ALA 129 3.001 3.288 -15.061 972 H GLU 130 H GLU 130 6.752 2.722 -14.770 973 HA GLU 130 HA GLU 130 7.248 -0.022 -15.241 974 HB2 GLU 130 2HB GLU 130 8.665 2.516 -15.614 975 HB3 GLU 130 1HB GLU 130 9.738 1.156 -15.264 976 HG2 GLU 130 2HG GLU 130 9.433 0.250 -17.278 977 HG3 GLU 130 1HG GLU 130 7.685 0.539 -17.247 978 H GLN 131 H GLN 131 8.404 2.207 -12.702 979 HA GLN 131 HA GLN 131 9.961 0.148 -11.487 980 HB2 GLN 131 2HB GLN 131 10.061 1.755 -9.551 981 HB3 GLN 131 1HB GLN 131 10.821 2.253 -11.056 982 HG2 GLN 131 2HG GLN 131 9.546 4.060 -11.184 983 HG3 GLN 131 1HG GLN 131 8.079 3.113 -10.964 984 HE21 GLN 131 1HE2 GLN 131 9.690 5.621 -9.758 985 HE22 GLN 131 2HE2 GLN 131 9.215 5.542 -8.099 986 H VAL 132 H VAL 132 6.866 1.711 -10.693 987 HA VAL 132 HA VAL 132 6.337 0.478 -8.294 988 HB VAL 132 HB VAL 132 4.079 0.993 -8.574 989 HG11 VAL 132 1HG1 VAL 132 4.269 3.198 -8.842 990 HG12 VAL 132 2HG1 VAL 132 4.845 3.040 -10.502 991 HG13 VAL 132 3HG1 VAL 132 5.972 2.863 -9.158 992 HG21 VAL 132 3HG2 VAL 132 3.006 1.369 -10.773 993 HG22 VAL 132 1HG2 VAL 132 3.583 -0.284 -10.551 994 HG23 VAL 132 2HG2 VAL 132 4.499 0.846 -11.550 995 H VAL 133 H VAL 133 6.251 -0.864 -11.512 996 HA VAL 133 HA VAL 133 4.816 -3.225 -10.712 997 HB VAL 133 HB VAL 133 4.660 -2.377 -13.030 998 HG11 VAL 133 1HG1 VAL 133 7.565 -2.783 -12.915 999 HG12 VAL 133 2HG1 VAL 133 6.611 -1.662 -13.883 1000 HG13 VAL 133 3HG1 VAL 133 6.783 -3.342 -14.391 1001 HG21 VAL 133 3HG2 VAL 133 5.878 -5.119 -13.089 1002 HG22 VAL 133 1HG2 VAL 133 4.519 -4.487 -14.022 1003 HG23 VAL 133 2HG2 VAL 133 4.330 -4.814 -12.298 1004 H GLN 134 H GLN 134 8.232 -2.295 -11.077 1005 HA GLN 134 HA GLN 134 9.101 -5.048 -10.819 1006 HB2 GLN 134 2HB GLN 134 11.354 -3.863 -10.208 1007 HB3 GLN 134 1HB GLN 134 10.761 -3.824 -11.861 1008 HG2 GLN 134 2HG GLN 134 9.845 -1.601 -11.466 1009 HG3 GLN 134 1HG GLN 134 10.482 -1.635 -9.823 1010 HE21 GLN 134 1HE2 GLN 134 11.075 -0.772 -12.997 1011 HE22 GLN 134 2HE2 GLN 134 12.789 -0.478 -12.873 1012 H GLY 135 H GLY 135 8.432 -2.372 -8.703 1013 HA2 GLY 135 2HA GLY 135 9.504 -3.645 -6.350 1014 HA3 GLY 135 1HA GLY 135 8.503 -2.186 -6.396 1015 H MET 136 H MET 136 6.645 -3.856 -8.212 1016 HA MET 136 HA MET 136 4.992 -4.847 -6.043 1017 HB2 MET 136 2HB MET 136 4.573 -3.907 -8.760 1018 HB3 MET 136 1HB MET 136 3.713 -5.409 -8.457 1019 HG2 MET 136 2HG MET 136 2.689 -4.376 -6.463 1020 HG3 MET 136 1HG MET 136 3.480 -2.859 -6.882 1021 HE1 MET 136 3HE MET 136 2.120 -1.042 -8.025 1022 HE2 MET 136 1HE MET 136 1.456 -1.355 -9.628 1023 HE3 MET 136 2HE MET 136 3.145 -1.723 -9.286 1024 H LYS 137 H LYS 137 6.631 -6.023 -8.919 1025 HA LYS 137 HA LYS 137 5.791 -8.731 -8.630 1026 HB2 LYS 137 2HB LYS 137 7.203 -9.192 -10.496 1027 HB3 LYS 137 1HB LYS 137 6.432 -7.645 -10.790 1028 HG2 LYS 137 2HG LYS 137 8.621 -6.677 -9.770 1029 HG3 LYS 137 1HG LYS 137 9.282 -8.261 -10.180 1030 HD2 LYS 137 2HD LYS 137 8.063 -6.224 -12.033 1031 HD3 LYS 137 1HD LYS 137 9.718 -6.830 -12.030 1032 HE2 LYS 137 2HE LYS 137 7.282 -8.511 -12.611 1033 HE3 LYS 137 1HE LYS 137 8.296 -7.766 -13.845 1034 HZ1 LYS 137 3HZ LYS 137 9.002 -10.001 -13.574 1035 HZ2 LYS 137 1HZ LYS 137 9.088 -9.852 -11.891 1036 HZ3 LYS 137 2HZ LYS 137 10.192 -9.025 -12.872 1037 H GLU 138 H GLU 138 8.152 -6.878 -7.050 1038 HA GLU 138 HA GLU 138 9.761 -9.235 -6.383 1039 HB2 GLU 138 2HB GLU 138 10.333 -6.409 -6.670 1040 HB3 GLU 138 1HB GLU 138 10.877 -7.009 -5.106 1041 HG2 GLU 138 2HG GLU 138 11.570 -8.764 -7.334 1042 HG3 GLU 138 1HG GLU 138 12.278 -7.145 -7.449 1043 H ALA 139 H ALA 139 8.636 -6.368 -4.618 1044 HA ALA 139 HA ALA 139 8.795 -7.343 -2.059 1045 HB1 ALA 139 1HB ALA 139 6.717 -5.463 -3.173 1046 HB2 ALA 139 2HB ALA 139 8.297 -5.021 -2.527 1047 HB3 ALA 139 3HB ALA 139 7.064 -5.694 -1.460 1048 H GLN 140 H GLN 140 6.436 -8.097 -4.501 1049 HA GLN 140 HA GLN 140 4.379 -9.082 -2.904 1050 HB2 GLN 140 2HB GLN 140 3.716 -10.356 -4.923 1051 HB3 GLN 140 1HB GLN 140 4.019 -8.650 -5.233 1052 HG2 GLN 140 2HG GLN 140 5.029 -9.712 -7.022 1053 HG3 GLN 140 1HG GLN 140 6.371 -9.411 -5.920 1054 HE21 GLN 140 1HE2 GLN 140 3.861 -11.915 -6.122 1055 HE22 GLN 140 2HE2 GLN 140 4.955 -13.252 -6.108 1056 H GLU 141 H GLU 141 7.508 -10.348 -3.393 1057 HA GLU 141 HA GLU 141 6.669 -13.073 -2.734 1058 HB2 GLU 141 2HB GLU 141 8.261 -12.833 -4.569 1059 HB3 GLU 141 1HB GLU 141 9.381 -11.974 -3.505 1060 HG2 GLU 141 2HG GLU 141 10.061 -13.871 -2.460 1061 HG3 GLU 141 1HG GLU 141 8.508 -14.680 -2.671 1062 H ARG 142 H ARG 142 8.495 -10.370 -1.429 1063 HA ARG 142 HA ARG 142 9.648 -11.709 0.762 1064 HB2 ARG 142 2HB ARG 142 9.014 -8.827 0.191 1065 HB3 ARG 142 1HB ARG 142 9.675 -9.318 1.755 1066 HG2 ARG 142 2HG ARG 142 11.700 -9.171 0.874 1067 HG3 ARG 142 1HG ARG 142 11.297 -10.549 -0.166 1068 HD2 ARG 142 2HD ARG 142 11.886 -9.000 -1.748 1069 HD3 ARG 142 1HD ARG 142 10.149 -8.684 -1.624 1070 HE ARG 142 HE ARG 142 10.622 -6.628 -0.723 1071 HH11 ARG 142 1HH1 ARG 142 13.515 -8.580 -0.680 1072 HH12 ARG 142 2HH1 ARG 142 14.542 -7.268 -0.206 1073 HH21 ARG 142 1HH2 ARG 142 11.973 -4.902 -0.102 1074 HH22 ARG 142 2HH2 ARG 142 13.667 -5.181 0.122 1075 H LEU 143 H LEU 143 6.874 -9.456 0.816 1076 HA LEU 143 HA LEU 143 6.101 -9.995 3.437 1077 HB2 LEU 143 2HB LEU 143 4.344 -9.152 1.135 1078 HB3 LEU 143 1HB LEU 143 3.937 -9.012 2.843 1079 HG LEU 143 HG LEU 143 4.607 -6.872 2.458 1080 HD11 LEU 143 1HD1 LEU 143 6.181 -7.919 4.107 1081 HD12 LEU 143 2HD1 LEU 143 6.786 -6.467 3.306 1082 HD13 LEU 143 3HD1 LEU 143 7.352 -8.058 2.794 1083 HD21 LEU 143 3HD2 LEU 143 6.878 -7.483 0.647 1084 HD22 LEU 143 1HD2 LEU 143 5.769 -6.112 0.654 1085 HD23 LEU 143 2HD2 LEU 143 5.240 -7.672 0.024 1086 H THR 144 H THR 144 4.813 -11.392 0.415 1087 HA THR 144 HA THR 144 2.832 -12.991 1.387 1088 HB THR 144 HB THR 144 3.515 -14.585 -0.489 1089 HG1 THR 144 1HG THR 144 5.227 -14.122 -1.641 1090 HG21 THR 144 3HG2 THR 144 1.808 -13.016 -0.950 1091 HG22 THR 144 1HG2 THR 144 2.959 -12.953 -2.286 1092 HG23 THR 144 2HG2 THR 144 2.972 -11.694 -1.050 1093 H GLY 145 H GLY 145 6.274 -13.455 1.710 1094 HA2 GLY 145 2HA GLY 145 5.845 -16.119 2.876 1095 HA3 GLY 145 1HA GLY 145 7.393 -15.464 2.363 1096 H ASP 146 H ASP 146 8.619 -14.300 3.781 1097 HA ASP 146 HA ASP 146 7.619 -13.188 6.195 1098 HB2 ASP 146 2HB ASP 146 8.956 -14.754 7.706 1099 HB3 ASP 146 1HB ASP 146 7.445 -15.382 7.058 1100 H ALA 147 H ALA 147 9.223 -12.310 4.045 1101 HA ALA 147 HA ALA 147 11.931 -12.143 5.135 1102 HB1 ALA 147 1HB ALA 147 11.815 -12.670 2.797 1103 HB2 ALA 147 2HB ALA 147 12.470 -11.041 2.974 1104 HB3 ALA 147 3HB ALA 147 10.790 -11.268 2.486 1105 H PHE 148 H PHE 148 9.487 -10.729 6.229 1106 HA PHE 148 HA PHE 148 10.522 -7.977 6.043 1107 HB2 PHE 148 2HB PHE 148 8.224 -7.233 6.648 1108 HB3 PHE 148 1HB PHE 148 8.290 -8.096 5.104 1109 HD1 PHE 148 1HD PHE 148 7.515 -10.462 5.000 1110 HD2 PHE 148 2HD PHE 148 6.919 -8.025 8.437 1111 HE1 PHE 148 1HE PHE 148 5.775 -12.011 5.793 1112 HE2 PHE 148 2HE PHE 148 5.179 -9.570 9.236 1113 HZ PHE 148 HZ PHE 148 4.604 -11.566 7.914 1114 H ARG 149 H ARG 149 9.198 -10.463 8.166 1115 HA ARG 149 HA ARG 149 9.268 -9.030 10.568 1116 HB2 ARG 149 2HB ARG 149 9.639 -11.995 10.113 1117 HB3 ARG 149 1HB ARG 149 9.234 -11.238 11.641 1118 HG2 ARG 149 2HG ARG 149 7.224 -10.277 10.207 1119 HG3 ARG 149 1HG ARG 149 7.544 -11.736 9.266 1120 HD2 ARG 149 2HD ARG 149 6.735 -13.087 10.865 1121 HD3 ARG 149 1HD ARG 149 7.498 -12.166 12.161 1122 HE ARG 149 HE ARG 149 5.227 -10.853 10.980 1123 HH11 ARG 149 1HH1 ARG 149 6.277 -13.133 13.405 1124 HH12 ARG 149 2HH1 ARG 149 4.877 -12.910 14.400 1125 HH21 ARG 149 1HH2 ARG 149 3.387 -10.559 12.288 1126 HH22 ARG 149 2HH2 ARG 149 3.236 -11.449 13.766 1127 H LYS 150 H LYS 150 11.093 -7.922 11.061 1128 HA LYS 150 HA LYS 150 13.610 -9.449 11.166 1129 HB2 LYS 150 2HB LYS 150 14.776 -7.287 10.956 1130 HB3 LYS 150 1HB LYS 150 13.746 -7.626 9.572 1131 HG2 LYS 150 2HG LYS 150 12.473 -5.828 9.932 1132 HG3 LYS 150 1HG LYS 150 12.413 -6.102 11.674 1133 HD2 LYS 150 2HD LYS 150 13.528 -3.995 11.159 1134 HD3 LYS 150 1HD LYS 150 14.649 -5.136 11.905 1135 HE2 LYS 150 2HE LYS 150 16.005 -4.630 10.196 1136 HE3 LYS 150 1HE LYS 150 14.961 -5.687 9.249 1137 HZ1 LYS 150 3HZ LYS 150 15.477 -3.175 8.583 1138 HZ2 LYS 150 1HZ LYS 150 14.087 -2.927 9.515 1139 HZ3 LYS 150 2HZ LYS 150 14.033 -3.954 8.175 1140 H LYS 151 H LYS 151 11.437 -7.322 12.898 1141 HA LYS 151 HA LYS 151 12.882 -7.963 15.368 1142 HB2 LYS 151 2HB LYS 151 12.436 -5.292 14.213 1143 HB3 LYS 151 1HB LYS 151 11.999 -5.436 15.909 1144 HG2 LYS 151 2HG LYS 151 14.133 -5.096 16.396 1145 HG3 LYS 151 1HG LYS 151 14.472 -6.689 15.716 1146 HD2 LYS 151 2HD LYS 151 15.380 -5.835 13.835 1147 HD3 LYS 151 1HD LYS 151 14.215 -4.510 13.755 1148 HE2 LYS 151 2HE LYS 151 16.001 -3.254 14.310 1149 HE3 LYS 151 1HE LYS 151 15.612 -3.789 15.945 1150 HZ1 LYS 151 3HZ LYS 151 17.876 -4.206 15.707 1151 HZ2 LYS 151 1HZ LYS 151 17.713 -4.805 14.132 1152 HZ3 LYS 151 2HZ LYS 151 17.167 -5.720 15.446 1153 H HIS 152 H HIS 152 10.370 -8.891 14.067 1154 HA HIS 152 HA HIS 152 8.278 -9.520 14.690 1155 HB2 HIS 152 2HB HIS 152 9.204 -8.567 17.408 1156 HB3 HIS 152 1HB HIS 152 7.735 -9.492 17.114 1157 HD1 HIS 152 1HD HIS 152 8.089 -11.836 17.784 1158 HD2 HIS 152 2HD HIS 152 11.505 -10.196 16.080 1159 HE1 HIS 152 1HE HIS 152 9.789 -13.689 17.769 1160 HE2 HIS 152 2HE HIS 152 11.824 -12.695 16.666 1161 H LEU 153 H LEU 153 8.546 -6.818 16.977 1162 HA LEU 153 HA LEU 153 7.358 -4.897 17.211 1163 HB2 LEU 153 2HB LEU 153 8.143 -5.030 14.515 1164 HB3 LEU 153 1HB LEU 153 6.467 -4.515 14.497 1165 HG LEU 153 HG LEU 153 8.072 -2.630 14.499 1166 HD11 LEU 153 1HD1 LEU 153 5.713 -2.742 15.693 1167 HD12 LEU 153 2HD1 LEU 153 6.739 -1.310 15.786 1168 HD13 LEU 153 3HD1 LEU 153 6.702 -2.456 17.126 1169 HD21 LEU 153 3HD2 LEU 153 9.745 -3.834 15.954 1170 HD22 LEU 153 1HD2 LEU 153 8.714 -3.429 17.326 1171 HD23 LEU 153 2HD2 LEU 153 9.445 -2.146 16.364 1172 H GLU 154 H GLU 154 5.202 -4.008 17.229 1173 HA GLU 154 HA GLU 154 2.954 -4.173 17.521 1174 HB2 GLU 154 2HB GLU 154 3.233 -6.007 15.137 1175 HB3 GLU 154 1HB GLU 154 1.692 -5.466 15.784 1176 HG2 GLU 154 2HG GLU 154 1.847 -3.773 14.359 1177 HG3 GLU 154 1HG GLU 154 3.076 -3.118 15.440 1178 H ASP 155 H ASP 155 1.098 -6.027 17.594 1179 HA ASP 155 HA ASP 155 0.267 -7.795 18.758 1180 HB2 ASP 155 2HB ASP 155 2.381 -8.823 17.315 1181 HB3 ASP 155 1HB ASP 155 2.750 -9.338 18.959 1182 H GLU 156 H GLU 156 -0.190 -7.179 20.776 1183 HA GLU 156 HA GLU 156 1.971 -7.315 22.772 1184 HB2 GLU 156 2HB GLU 156 -0.023 -5.171 22.256 1185 HB3 GLU 156 1HB GLU 156 0.337 -5.544 23.947 1186 HG2 GLU 156 2HG GLU 156 1.771 -3.782 23.307 1187 HG3 GLU 156 1HG GLU 156 2.761 -5.236 23.395 1188 H LEU 157 H LEU 157 -1.579 -7.234 22.440 1189 HA LEU 157 HA LEU 157 -3.231 -8.408 23.471 1190 HB2 LEU 157 2HB LEU 157 -1.057 -10.255 23.090 1191 HB3 LEU 157 1HB LEU 157 -1.916 -10.645 24.567 1192 HG LEU 157 HG LEU 157 -2.810 -11.912 22.696 1193 HD11 LEU 157 1HD1 LEU 157 -4.305 -11.128 24.527 1194 HD12 LEU 157 2HD1 LEU 157 -5.131 -11.426 22.997 1195 HD13 LEU 157 3HD1 LEU 157 -4.774 -9.773 23.499 1196 HD21 LEU 157 3HD2 LEU 157 -2.846 -9.246 21.424 1197 HD22 LEU 157 1HD2 LEU 157 -4.201 -10.314 21.063 1198 HD23 LEU 157 2HD2 LEU 157 -2.551 -10.835 20.722 Start of MODEL 31 1 H1 MET 1 1HT MET 1 -21.927 -18.863 -17.199 2 H2 MET 1 2HT MET 1 -22.897 -18.708 -18.608 3 H3 MET 1 3HT MET 1 -23.632 -18.747 -17.056 4 HA MET 1 HA MET 1 -23.665 -16.551 -17.679 5 HB2 MET 1 2HB MET 1 -22.359 -17.451 -15.456 6 HB3 MET 1 1HB MET 1 -21.149 -16.382 -16.151 7 HG2 MET 1 2HG MET 1 -23.219 -14.747 -16.322 8 HG3 MET 1 1HG MET 1 -23.806 -15.752 -14.997 9 HE1 MET 1 2HE MET 1 -23.225 -14.691 -12.398 10 HE2 MET 1 3HE MET 1 -21.554 -15.179 -12.112 11 HE3 MET 1 1HE MET 1 -22.653 -16.258 -12.971 12 H HIS 2 H HIS 2 -23.150 -15.234 -19.294 13 HA HIS 2 HA HIS 2 -20.382 -15.248 -20.300 14 HB2 HIS 2 2HB HIS 2 -22.271 -16.370 -21.744 15 HB3 HIS 2 1HB HIS 2 -22.676 -14.705 -22.146 16 HD1 HIS 2 1HD HIS 2 -20.236 -13.332 -22.829 17 HD2 HIS 2 2HD HIS 2 -20.647 -17.390 -23.630 18 HE1 HIS 2 1HE HIS 2 -18.551 -13.837 -24.626 19 HE2 HIS 2 2HE HIS 2 -18.758 -16.314 -25.033 20 H HIS 3 H HIS 3 -23.418 -13.416 -20.132 21 HA HIS 3 HA HIS 3 -22.158 -10.933 -20.825 22 HB2 HIS 3 2HB HIS 3 -24.361 -9.940 -20.239 23 HB3 HIS 3 1HB HIS 3 -24.490 -11.266 -21.389 24 HD1 HIS 3 1HD HIS 3 -25.539 -10.197 -18.012 25 HD2 HIS 3 2HD HIS 3 -25.621 -13.658 -20.312 26 HE1 HIS 3 1HE HIS 3 -27.151 -11.740 -16.850 27 HE2 HIS 3 2HE HIS 3 -27.118 -13.857 -18.213 28 H HIS 4 H HIS 4 -20.926 -9.785 -19.508 29 HA HIS 4 HA HIS 4 -21.548 -9.796 -16.628 30 HB2 HIS 4 2HB HIS 4 -19.105 -9.572 -16.200 31 HB3 HIS 4 1HB HIS 4 -19.542 -11.106 -16.945 32 HD1 HIS 4 1HD HIS 4 -19.188 -11.097 -19.684 33 HD2 HIS 4 2HD HIS 4 -17.069 -8.307 -17.452 34 HE1 HIS 4 1HE HIS 4 -17.303 -10.343 -21.168 35 HE2 HIS 4 2HE HIS 4 -16.086 -8.591 -19.828 36 H HIS 5 H HIS 5 -22.679 -7.864 -16.712 37 HA HIS 5 HA HIS 5 -21.083 -5.493 -17.434 38 HB2 HIS 5 2HB HIS 5 -23.583 -6.280 -18.434 39 HB3 HIS 5 1HB HIS 5 -23.927 -4.967 -17.315 40 HD1 HIS 5 1HD HIS 5 -21.585 -5.640 -20.239 41 HD2 HIS 5 2HD HIS 5 -23.648 -2.518 -18.429 42 HE1 HIS 5 1HE HIS 5 -21.186 -3.633 -21.701 43 HE2 HIS 5 2HE HIS 5 -22.373 -1.738 -20.540 44 H HIS 6 H HIS 6 -20.467 -4.352 -15.733 45 HA HIS 6 HA HIS 6 -22.230 -4.280 -13.371 46 HB2 HIS 6 2HB HIS 6 -20.149 -4.001 -12.009 47 HB3 HIS 6 1HB HIS 6 -20.275 -5.567 -12.806 48 HD1 HIS 6 1HD HIS 6 -18.283 -2.409 -12.801 49 HD2 HIS 6 2HD HIS 6 -18.361 -6.050 -14.799 50 HE1 HIS 6 1HE HIS 6 -16.108 -2.532 -14.056 51 HE2 HIS 6 2HE HIS 6 -16.216 -4.706 -15.327 52 H HIS 7 H HIS 7 -22.906 -2.328 -12.775 53 HA HIS 7 HA HIS 7 -21.277 0.023 -13.341 54 HB2 HIS 7 2HB HIS 7 -23.259 1.221 -14.294 55 HB3 HIS 7 1HB HIS 7 -22.645 -0.074 -15.317 56 HD1 HIS 7 1HD HIS 7 -25.639 1.022 -13.443 57 HD2 HIS 7 2HD HIS 7 -24.330 -2.374 -15.448 58 HE1 HIS 7 1HE HIS 7 -27.688 -0.397 -13.768 59 HE2 HIS 7 2HE HIS 7 -26.887 -2.406 -15.061 60 H MET 8 H MET 8 -21.004 0.308 -11.140 61 HA MET 8 HA MET 8 -23.274 1.493 -9.770 62 HB2 MET 8 2HB MET 8 -21.885 -1.006 -8.840 63 HB3 MET 8 1HB MET 8 -22.628 0.101 -7.680 64 HG2 MET 8 2HG MET 8 -24.746 -0.136 -9.073 65 HG3 MET 8 1HG MET 8 -23.946 -1.502 -9.846 66 HE1 MET 8 3HE MET 8 -23.228 -3.837 -6.840 67 HE2 MET 8 1HE MET 8 -22.440 -2.989 -8.170 68 HE3 MET 8 2HE MET 8 -23.804 -4.060 -8.491 69 H SER 9 H SER 9 -22.560 2.414 -7.607 70 HA SER 9 HA SER 9 -20.026 3.780 -8.024 71 HB2 SER 9 2HB SER 9 -22.250 4.214 -6.020 72 HB3 SER 9 1HB SER 9 -20.782 5.187 -6.091 73 HG SER 9 HG SER 9 -22.485 4.842 -8.322 74 H ASP 10 H ASP 10 -21.632 2.129 -5.297 75 HA ASP 10 HA ASP 10 -20.807 0.950 -3.535 76 HB2 ASP 10 2HB ASP 10 -18.839 0.415 -5.704 77 HB3 ASP 10 1HB ASP 10 -18.388 -0.047 -4.067 78 H GLY 11 H GLY 11 -20.477 2.323 -1.883 79 HA2 GLY 11 2HA GLY 11 -19.200 3.430 -0.302 80 HA3 GLY 11 1HA GLY 11 -17.785 3.159 -1.309 81 H HIS 12 H HIS 12 -18.207 5.553 0.038 82 HA HIS 12 HA HIS 12 -18.273 7.388 -2.215 83 HB2 HIS 12 2HB HIS 12 -20.050 7.785 0.205 84 HB3 HIS 12 1HB HIS 12 -19.831 8.939 -1.118 85 HD1 HIS 12 1HD HIS 12 -21.129 5.406 -0.576 86 HD2 HIS 12 2HD HIS 12 -21.605 8.632 -3.151 87 HE1 HIS 12 1HE HIS 12 -23.014 4.767 -2.112 88 HE2 HIS 12 2HE HIS 12 -23.231 6.701 -3.713 89 H ASN 13 H ASN 13 -16.081 7.729 -1.850 90 HA ASN 13 HA ASN 13 -15.471 9.672 0.172 91 HB2 ASN 13 2HB ASN 13 -14.432 6.860 0.389 92 HB3 ASN 13 1HB ASN 13 -13.484 8.213 0.999 93 HD21 ASN 13 1HD2 ASN 13 -16.170 6.159 1.511 94 HD22 ASN 13 2HD2 ASN 13 -16.663 6.808 3.035 95 H GLY 14 H GLY 14 -13.352 7.295 -1.401 96 HA2 GLY 14 2HA GLY 14 -12.622 8.672 -3.672 97 HA3 GLY 14 1HA GLY 14 -11.614 9.343 -2.384 98 H LEU 15 H LEU 15 -11.250 7.452 -4.842 99 HA LEU 15 HA LEU 15 -9.278 5.782 -3.516 100 HB2 LEU 15 2HB LEU 15 -11.675 4.711 -4.961 101 HB3 LEU 15 1HB LEU 15 -10.181 3.798 -4.932 102 HG LEU 15 HG LEU 15 -11.577 4.715 -2.426 103 HD11 LEU 15 1HD1 LEU 15 -13.188 3.283 -3.110 104 HD12 LEU 15 2HD1 LEU 15 -12.063 2.092 -2.459 105 HD13 LEU 15 3HD1 LEU 15 -12.106 2.406 -4.193 106 HD21 LEU 15 3HD2 LEU 15 -9.367 2.762 -3.016 107 HD22 LEU 15 1HD2 LEU 15 -10.233 2.802 -1.482 108 HD23 LEU 15 2HD2 LEU 15 -9.302 4.206 -2.006 109 H GLY 16 H GLY 16 -8.431 4.198 -5.478 110 HA2 GLY 16 2HA GLY 16 -6.991 5.915 -7.196 111 HA3 GLY 16 1HA GLY 16 -7.044 4.164 -7.297 112 H LYS 17 H LYS 17 -9.186 6.948 -7.940 113 HA LYS 17 HA LYS 17 -10.145 5.531 -10.332 114 HB2 LYS 17 2HB LYS 17 -11.412 7.438 -8.432 115 HB3 LYS 17 1HB LYS 17 -11.915 7.520 -10.115 116 HG2 LYS 17 2HG LYS 17 -12.421 5.083 -10.014 117 HG3 LYS 17 1HG LYS 17 -12.080 5.138 -8.284 118 HD2 LYS 17 2HD LYS 17 -13.902 7.244 -8.993 119 HD3 LYS 17 1HD LYS 17 -14.512 5.698 -9.581 120 HE2 LYS 17 2HE LYS 17 -13.780 4.930 -7.143 121 HE3 LYS 17 1HE LYS 17 -14.062 6.636 -6.803 122 HZ1 LYS 17 3HZ LYS 17 -15.990 4.628 -7.797 123 HZ2 LYS 17 1HZ LYS 17 -16.283 6.289 -7.940 124 HZ3 LYS 17 2HZ LYS 17 -16.095 5.590 -6.410 125 H GLY 18 H GLY 18 -8.082 6.231 -11.320 126 HA2 GLY 18 2HA GLY 18 -8.375 8.188 -13.211 127 HA3 GLY 18 1HA GLY 18 -7.648 9.023 -11.833 128 H PHE 19 H PHE 19 -6.188 6.572 -11.025 129 HA PHE 19 HA PHE 19 -3.841 7.027 -12.596 130 HB2 PHE 19 2HB PHE 19 -4.339 4.955 -10.450 131 HB3 PHE 19 1HB PHE 19 -2.762 5.436 -11.092 132 HD1 PHE 19 2HD PHE 19 -3.275 8.407 -11.226 133 HD2 PHE 19 1HD PHE 19 -4.047 5.525 -8.191 134 HE1 PHE 19 2HE PHE 19 -3.122 10.171 -9.515 135 HE2 PHE 19 1HE PHE 19 -3.895 7.282 -6.476 136 HZ PHE 19 HZ PHE 19 -3.432 9.609 -7.137 137 H GLY 20 H GLY 20 -5.711 4.067 -11.901 138 HA2 GLY 20 2HA GLY 20 -5.110 3.182 -14.644 139 HA3 GLY 20 1HA GLY 20 -4.744 2.117 -13.288 140 H ASP 21 H ASP 21 -6.587 1.609 -11.826 141 HA ASP 21 HA ASP 21 -9.272 1.929 -12.513 142 HB2 ASP 21 2HB ASP 21 -8.298 0.472 -14.470 143 HB3 ASP 21 1HB ASP 21 -8.404 -0.842 -13.292 144 H HIS 22 H HIS 22 -9.557 -1.186 -11.844 145 HA HIS 22 HA HIS 22 -9.600 -0.738 -8.977 146 HB2 HIS 22 2HB HIS 22 -10.722 -2.922 -8.867 147 HB3 HIS 22 1HB HIS 22 -11.504 -1.870 -10.041 148 HD1 HIS 22 1HD HIS 22 -10.059 -5.181 -9.671 149 HD2 HIS 22 2HD HIS 22 -10.760 -2.544 -12.804 150 HE1 HIS 22 1HE HIS 22 -9.916 -6.570 -11.763 151 HE2 HIS 22 2HE HIS 22 -10.253 -4.934 -13.650 152 H ILE 23 H ILE 23 -7.525 -0.766 -8.209 153 HA ILE 23 HA ILE 23 -6.089 -3.316 -8.458 154 HB ILE 23 HB ILE 23 -4.848 -0.591 -8.848 155 HG12 ILE 23 2HG1 ILE 23 -4.336 -2.260 -11.050 156 HG13 ILE 23 1HG1 ILE 23 -6.048 -2.450 -10.693 157 HG21 ILE 23 1HG2 ILE 23 -3.640 -2.839 -7.824 158 HG22 ILE 23 2HG2 ILE 23 -2.836 -1.457 -8.567 159 HG23 ILE 23 3HG2 ILE 23 -3.215 -2.880 -9.536 160 HD11 ILE 23 3HD1 ILE 23 -5.385 0.312 -10.547 161 HD12 ILE 23 1HD1 ILE 23 -6.482 -0.514 -11.656 162 HD13 ILE 23 2HD1 ILE 23 -4.774 -0.353 -12.063 163 H HIS 24 H HIS 24 -4.453 -0.583 -7.097 164 HA HIS 24 HA HIS 24 -4.417 -1.848 -4.502 165 HB2 HIS 24 2HB HIS 24 -3.133 0.794 -5.050 166 HB3 HIS 24 1HB HIS 24 -2.595 -0.513 -3.993 167 HD1 HIS 24 1HD HIS 24 -1.461 1.069 -6.842 168 HD2 HIS 24 2HD HIS 24 -2.115 -2.935 -5.950 169 HE1 HIS 24 1HE HIS 24 -0.019 -0.221 -8.448 170 HE2 HIS 24 2HE HIS 24 -0.479 -2.643 -7.932 171 H TRP 25 H TRP 25 -6.928 -0.718 -5.417 172 HA TRP 25 HA TRP 25 -7.533 0.921 -3.105 173 HB2 TRP 25 2HB TRP 25 -8.904 2.292 -5.079 174 HB3 TRP 25 1HB TRP 25 -7.457 2.854 -4.245 175 HD1 TRP 25 HD TRP 25 -8.675 1.570 -7.572 176 HE1 TRP 25 1HE TRP 25 -6.784 1.784 -9.280 177 HE3 TRP 25 3HE TRP 25 -4.850 2.774 -4.418 178 HZ2 TRP 25 2HZ TRP 25 -4.026 2.395 -9.313 179 HZ3 TRP 25 3HZ TRP 25 -2.622 3.155 -5.362 180 HH2 TRP 25 HH TRP 25 -2.210 2.970 -7.762 181 H ARG 26 H ARG 26 -8.404 -1.338 -5.495 182 HA ARG 26 HA ARG 26 -10.980 -1.302 -6.001 183 HB2 ARG 26 2HB ARG 26 -10.025 -3.345 -6.554 184 HB3 ARG 26 1HB ARG 26 -9.274 -3.493 -4.998 185 HG2 ARG 26 2HG ARG 26 -11.035 -5.178 -5.453 186 HG3 ARG 26 1HG ARG 26 -11.276 -4.245 -3.977 187 HD2 ARG 26 2HD ARG 26 -13.309 -3.747 -4.708 188 HD3 ARG 26 1HD ARG 26 -12.541 -2.797 -5.986 189 HE ARG 26 HE ARG 26 -12.513 -5.247 -7.048 190 HH11 ARG 26 1HH1 ARG 26 -15.070 -3.458 -5.484 191 HH12 ARG 26 2HH1 ARG 26 -16.331 -4.228 -6.387 192 HH21 ARG 26 1HH2 ARG 26 -14.170 -6.259 -8.236 193 HH22 ARG 26 2HH2 ARG 26 -15.821 -5.818 -7.948 194 H THR 27 H THR 27 -9.743 -2.025 -2.721 195 HA THR 27 HA THR 27 -11.587 -0.714 -1.231 196 HB THR 27 HB THR 27 -12.935 -3.004 -0.585 197 HG1 THR 27 1HG THR 27 -13.632 -3.898 -2.559 198 HG21 THR 27 3HG2 THR 27 -14.704 -1.743 -0.982 199 HG22 THR 27 1HG2 THR 27 -14.356 -1.687 -2.709 200 HG23 THR 27 2HG2 THR 27 -13.608 -0.519 -1.621 201 H LEU 28 H LEU 28 -11.304 -1.018 0.966 202 HA LEU 28 HA LEU 28 -8.963 -2.525 1.698 203 HB2 LEU 28 2HB LEU 28 -9.385 -0.296 2.629 204 HB3 LEU 28 1HB LEU 28 -10.866 -0.886 3.382 205 HG LEU 28 HG LEU 28 -8.810 -0.622 4.874 206 HD11 LEU 28 1HD1 LEU 28 -10.952 -2.074 5.207 207 HD12 LEU 28 2HD1 LEU 28 -9.575 -2.256 6.294 208 HD13 LEU 28 3HD1 LEU 28 -9.832 -3.419 4.994 209 HD21 LEU 28 3HD2 LEU 28 -8.014 -3.237 3.611 210 HD22 LEU 28 1HD2 LEU 28 -7.158 -2.336 4.863 211 HD23 LEU 28 2HD2 LEU 28 -7.257 -1.692 3.225 212 H GLU 29 H GLU 29 -12.400 -2.577 2.635 213 HA GLU 29 HA GLU 29 -12.278 -4.737 4.393 214 HB2 GLU 29 2HB GLU 29 -14.226 -3.191 4.066 215 HB3 GLU 29 1HB GLU 29 -14.598 -4.057 2.582 216 HG2 GLU 29 2HG GLU 29 -14.291 -5.819 4.875 217 HG3 GLU 29 1HG GLU 29 -15.575 -4.629 5.082 218 H ASP 30 H ASP 30 -13.216 -4.764 0.950 219 HA ASP 30 HA ASP 30 -13.440 -7.544 0.710 220 HB2 ASP 30 2HB ASP 30 -13.315 -5.244 -1.109 221 HB3 ASP 30 1HB ASP 30 -12.677 -6.739 -1.807 222 H GLY 31 H GLY 31 -10.667 -5.422 0.584 223 HA2 GLY 31 2HA GLY 31 -8.863 -7.268 -0.609 224 HA3 GLY 31 1HA GLY 31 -8.420 -5.831 0.318 225 H LYS 32 H LYS 32 -9.824 -6.646 2.719 226 HA LYS 32 HA LYS 32 -7.754 -8.185 3.914 227 HB2 LYS 32 2HB LYS 32 -9.101 -6.434 5.089 228 HB3 LYS 32 1HB LYS 32 -10.472 -7.534 5.061 229 HG2 LYS 32 2HG LYS 32 -8.598 -9.117 6.188 230 HG3 LYS 32 1HG LYS 32 -8.078 -7.532 6.764 231 HD2 LYS 32 2HD LYS 32 -9.573 -7.963 8.408 232 HD3 LYS 32 1HD LYS 32 -10.720 -7.339 7.219 233 HE2 LYS 32 2HE LYS 32 -11.038 -9.703 6.435 234 HE3 LYS 32 1HE LYS 32 -10.076 -10.221 7.818 235 HZ1 LYS 32 3HZ LYS 32 -12.725 -8.908 7.819 236 HZ2 LYS 32 1HZ LYS 32 -11.748 -8.937 9.201 237 HZ3 LYS 32 2HZ LYS 32 -12.283 -10.387 8.513 238 H LYS 33 H LYS 33 -11.068 -8.886 2.920 239 HA LYS 33 HA LYS 33 -11.196 -11.496 3.990 240 HB2 LYS 33 2HB LYS 33 -13.177 -10.182 3.291 241 HB3 LYS 33 1HB LYS 33 -12.683 -10.364 1.613 242 HG2 LYS 33 2HG LYS 33 -12.726 -12.950 2.393 243 HG3 LYS 33 1HG LYS 33 -14.003 -12.269 3.418 244 HD2 LYS 33 2HD LYS 33 -15.405 -12.158 1.690 245 HD3 LYS 33 1HD LYS 33 -14.228 -11.265 0.727 246 HE2 LYS 33 2HE LYS 33 -13.584 -14.095 0.990 247 HE3 LYS 33 1HE LYS 33 -15.142 -13.808 0.214 248 HZ1 LYS 33 3HZ LYS 33 -12.856 -13.818 -1.110 249 HZ2 LYS 33 1HZ LYS 33 -12.911 -12.177 -0.702 250 HZ3 LYS 33 2HZ LYS 33 -14.176 -12.872 -1.582 251 H GLU 34 H GLU 34 -10.334 -10.289 0.765 252 HA GLU 34 HA GLU 34 -9.874 -12.864 -0.349 253 HB2 GLU 34 2HB GLU 34 -10.378 -10.908 -1.742 254 HB3 GLU 34 1HB GLU 34 -8.859 -10.162 -1.248 255 HG2 GLU 34 2HG GLU 34 -7.628 -11.423 -2.642 256 HG3 GLU 34 1HG GLU 34 -8.638 -12.859 -2.408 257 H ALA 35 H ALA 35 -7.719 -10.360 0.956 258 HA ALA 35 HA ALA 35 -5.282 -11.588 0.442 259 HB1 ALA 35 1HB ALA 35 -6.098 -9.784 2.713 260 HB2 ALA 35 2HB ALA 35 -5.338 -9.322 1.190 261 HB3 ALA 35 3HB ALA 35 -4.431 -10.257 2.380 262 H ALA 36 H ALA 36 -7.714 -12.401 2.757 263 HA ALA 36 HA ALA 36 -6.069 -13.841 4.575 264 HB1 ALA 36 1HB ALA 36 -9.019 -13.771 4.047 265 HB2 ALA 36 2HB ALA 36 -8.127 -13.170 5.446 266 HB3 ALA 36 3HB ALA 36 -8.319 -14.906 5.201 267 H ALA 37 H ALA 37 -8.256 -14.909 1.970 268 HA ALA 37 HA ALA 37 -7.716 -17.642 2.157 269 HB1 ALA 37 1HB ALA 37 -8.570 -15.993 -0.215 270 HB2 ALA 37 2HB ALA 37 -9.608 -16.866 0.911 271 HB3 ALA 37 3HB ALA 37 -8.552 -17.756 -0.185 272 H SER 38 H SER 38 -6.633 -15.691 -0.608 273 HA SER 38 HA SER 38 -4.609 -17.415 -1.411 274 HB2 SER 38 2HB SER 38 -5.370 -14.622 -1.984 275 HB3 SER 38 1HB SER 38 -3.668 -15.010 -2.289 276 HG SER 38 HG SER 38 -5.975 -16.217 -3.403 277 H GLY 39 H GLY 39 -4.577 -14.898 1.017 278 HA2 GLY 39 2HA GLY 39 -3.058 -14.549 2.727 279 HA3 GLY 39 1HA GLY 39 -2.127 -15.921 2.117 280 H LEU 40 H LEU 40 -3.061 -12.846 0.578 281 HA LEU 40 HA LEU 40 -0.205 -12.386 0.034 282 HB2 LEU 40 2HB LEU 40 -1.042 -10.884 -1.794 283 HB3 LEU 40 1HB LEU 40 -1.361 -12.592 -2.017 284 HG LEU 40 HG LEU 40 -3.691 -12.175 -1.164 285 HD11 LEU 40 1HD1 LEU 40 -4.138 -9.547 -1.688 286 HD12 LEU 40 2HD1 LEU 40 -2.562 -9.488 -0.900 287 HD13 LEU 40 3HD1 LEU 40 -3.931 -10.232 -0.076 288 HD21 LEU 40 3HD2 LEU 40 -2.855 -10.674 -3.642 289 HD22 LEU 40 1HD2 LEU 40 -4.486 -11.235 -3.268 290 HD23 LEU 40 2HD2 LEU 40 -3.193 -12.402 -3.545 291 HA PRO 41 HA PRO 41 -0.135 -8.780 2.548 292 HB2 PRO 41 2HB PRO 41 1.525 -7.162 1.105 293 HB3 PRO 41 1HB PRO 41 2.087 -8.531 2.069 294 HG2 PRO 41 2HG PRO 41 1.569 -8.374 -0.875 295 HG3 PRO 41 1HG PRO 41 2.926 -9.128 -0.017 296 HD2 PRO 41 2HD PRO 41 0.882 -10.584 -0.977 297 HD3 PRO 41 1HD PRO 41 1.692 -11.004 0.544 298 H LEU 42 H LEU 42 -0.576 -6.461 2.592 299 HA LEU 42 HA LEU 42 -2.655 -5.786 0.653 300 HB2 LEU 42 2HB LEU 42 -2.133 -5.109 3.485 301 HB3 LEU 42 1HB LEU 42 -2.853 -3.842 2.508 302 HG LEU 42 HG LEU 42 -4.652 -5.488 1.870 303 HD11 LEU 42 1HD1 LEU 42 -3.913 -7.086 4.263 304 HD12 LEU 42 2HD1 LEU 42 -3.082 -7.415 2.742 305 HD13 LEU 42 3HD1 LEU 42 -4.838 -7.547 2.835 306 HD21 LEU 42 3HD2 LEU 42 -4.495 -3.773 3.945 307 HD22 LEU 42 1HD2 LEU 42 -4.808 -5.281 4.804 308 HD23 LEU 42 2HD2 LEU 42 -5.930 -4.725 3.563 309 H MET 43 H MET 43 -2.742 -3.760 -0.339 310 HA MET 43 HA MET 43 -0.117 -2.478 -0.631 311 HB2 MET 43 2HB MET 43 -1.249 -3.550 -2.633 312 HB3 MET 43 1HB MET 43 -2.467 -2.268 -2.529 313 HG2 MET 43 2HG MET 43 -0.837 -1.672 -4.173 314 HG3 MET 43 1HG MET 43 -0.647 -0.608 -2.784 315 HE1 MET 43 3HE MET 43 2.499 -1.567 -1.100 316 HE2 MET 43 1HE MET 43 0.904 -0.815 -1.038 317 HE3 MET 43 2HE MET 43 2.165 -0.130 -2.064 318 H VAL 44 H VAL 44 -0.344 -1.131 1.196 319 HA VAL 44 HA VAL 44 -2.578 0.667 1.418 320 HB VAL 44 HB VAL 44 0.013 0.824 2.942 321 HG11 VAL 44 1HG1 VAL 44 -1.712 2.730 2.941 322 HG12 VAL 44 2HG1 VAL 44 -1.127 2.135 4.495 323 HG13 VAL 44 3HG1 VAL 44 -2.709 1.636 3.898 324 HG21 VAL 44 3HG2 VAL 44 -1.917 -1.264 2.965 325 HG22 VAL 44 1HG2 VAL 44 -2.026 -0.383 4.491 326 HG23 VAL 44 2HG2 VAL 44 -0.486 -1.064 3.974 327 H ILE 45 H ILE 45 -2.260 1.609 -0.765 328 HA ILE 45 HA ILE 45 -0.038 3.473 -0.996 329 HB ILE 45 HB ILE 45 -2.272 2.707 -2.871 330 HG12 ILE 45 2HG1 ILE 45 0.741 2.561 -3.100 331 HG13 ILE 45 1HG1 ILE 45 -0.324 1.206 -2.709 332 HG21 ILE 45 1HG2 ILE 45 -2.180 4.905 -3.483 333 HG22 ILE 45 2HG2 ILE 45 -0.855 4.274 -4.460 334 HG23 ILE 45 3HG2 ILE 45 -0.514 5.102 -2.941 335 HD11 ILE 45 3HD1 ILE 45 -1.433 1.625 -4.941 336 HD12 ILE 45 1HD1 ILE 45 0.209 0.989 -4.985 337 HD13 ILE 45 2HD1 ILE 45 -0.084 2.700 -5.300 338 H ILE 46 H ILE 46 -0.209 5.381 0.021 339 HA ILE 46 HA ILE 46 -2.879 6.602 0.180 340 HB ILE 46 HB ILE 46 -0.622 7.262 2.049 341 HG12 ILE 46 2HG1 ILE 46 -2.768 5.470 2.999 342 HG13 ILE 46 1HG1 ILE 46 -1.600 4.736 1.902 343 HG21 ILE 46 1HG2 ILE 46 -2.734 8.697 1.737 344 HG22 ILE 46 2HG2 ILE 46 -2.245 8.269 3.378 345 HG23 ILE 46 3HG2 ILE 46 -3.559 7.399 2.593 346 HD11 ILE 46 3HD1 ILE 46 -0.576 4.334 3.894 347 HD12 ILE 46 1HD1 ILE 46 -1.260 5.769 4.658 348 HD13 ILE 46 2HD1 ILE 46 0.104 5.927 3.549 349 H HIS 47 H HIS 47 -3.119 8.743 -0.370 350 HA HIS 47 HA HIS 47 -0.714 10.174 -1.246 351 HB2 HIS 47 2HB HIS 47 -1.837 10.784 -3.388 352 HB3 HIS 47 1HB HIS 47 -1.430 9.066 -3.252 353 HD1 HIS 47 1HD HIS 47 -3.936 10.892 -4.684 354 HD2 HIS 47 2HD HIS 47 -4.031 7.853 -1.847 355 HE1 HIS 47 1HE HIS 47 -6.258 9.936 -4.801 356 HE2 HIS 47 2HE HIS 47 -6.274 8.061 -3.117 357 H LYS 48 H LYS 48 -0.725 12.077 -0.287 358 HA LYS 48 HA LYS 48 -3.289 13.546 -0.195 359 HB2 LYS 48 2HB LYS 48 -1.866 12.626 2.049 360 HB3 LYS 48 1HB LYS 48 -1.601 14.362 1.986 361 HG2 LYS 48 2HG LYS 48 -3.703 14.829 2.573 362 HG3 LYS 48 1HG LYS 48 -4.377 13.579 1.527 363 HD2 LYS 48 2HD LYS 48 -4.897 13.033 3.804 364 HD3 LYS 48 1HD LYS 48 -3.694 11.885 3.216 365 HE2 LYS 48 2HE LYS 48 -2.918 12.463 5.338 366 HE3 LYS 48 1HE LYS 48 -1.964 13.473 4.252 367 HZ1 LYS 48 3HZ LYS 48 -3.707 15.237 4.671 368 HZ2 LYS 48 1HZ LYS 48 -2.673 14.881 5.962 369 HZ3 LYS 48 2HZ LYS 48 -4.251 14.274 5.951 370 H SER 49 H SER 49 -3.110 15.874 -0.121 371 HA SER 49 HA SER 49 -2.317 17.878 -0.850 372 HB2 SER 49 2HB SER 49 0.082 16.527 0.212 373 HB3 SER 49 1HB SER 49 0.408 17.829 -0.929 374 HG SER 49 HG SER 49 -0.869 19.195 0.386 375 H TRP 50 H TRP 50 -0.344 18.694 -2.506 376 HA TRP 50 HA TRP 50 -1.194 17.708 -5.027 377 HB2 TRP 50 2HB TRP 50 0.775 19.131 -5.876 378 HB3 TRP 50 1HB TRP 50 -0.530 19.966 -5.023 379 HD1 TRP 50 HD TRP 50 3.108 18.798 -4.502 380 HE1 TRP 50 1HE TRP 50 4.143 20.210 -2.616 381 HE3 TRP 50 3HE TRP 50 -1.058 21.375 -3.034 382 HZ2 TRP 50 2HZ TRP 50 3.305 22.159 -0.752 383 HZ3 TRP 50 3HZ TRP 50 -0.855 22.994 -1.194 384 HH2 TRP 50 HH TRP 50 1.282 23.376 -0.076 385 H CYS 51 H CYS 51 -0.677 15.429 -4.332 386 HA CYS 51 HA CYS 51 2.002 14.521 -4.258 387 HB2 CYS 51 2HB CYS 51 0.934 12.259 -4.630 388 HB3 CYS 51 1HB CYS 51 0.324 13.161 -3.245 389 H GLY 52 H GLY 52 3.313 14.877 -6.001 390 HA2 GLY 52 2HA GLY 52 2.462 14.978 -8.687 391 HA3 GLY 52 1HA GLY 52 4.125 14.695 -8.161 392 H ALA 53 H ALA 53 3.305 12.333 -6.592 393 HA ALA 53 HA ALA 53 3.758 10.343 -8.517 394 HB1 ALA 53 1HB ALA 53 4.136 10.292 -5.960 395 HB2 ALA 53 2HB ALA 53 3.649 8.806 -6.778 396 HB3 ALA 53 3HB ALA 53 2.457 9.756 -5.888 397 H CYS 54 H CYS 54 0.946 12.032 -7.709 398 HA CYS 54 HA CYS 54 -0.778 9.914 -8.698 399 HB2 CYS 54 2HB CYS 54 -1.610 12.660 -7.744 400 HB3 CYS 54 1HB CYS 54 -2.625 11.220 -7.907 401 H LYS 55 H LYS 55 0.670 12.912 -9.626 402 HA LYS 55 HA LYS 55 -1.034 13.422 -11.875 403 HB2 LYS 55 2HB LYS 55 0.652 14.981 -10.481 404 HB3 LYS 55 1HB LYS 55 1.726 14.523 -11.796 405 HG2 LYS 55 2HG LYS 55 -0.739 15.253 -12.963 406 HG3 LYS 55 1HG LYS 55 -0.338 16.488 -11.757 407 HD2 LYS 55 2HD LYS 55 2.007 15.777 -13.262 408 HD3 LYS 55 1HD LYS 55 0.697 16.216 -14.359 409 HE2 LYS 55 2HE LYS 55 0.505 18.155 -12.449 410 HE3 LYS 55 1HE LYS 55 2.244 17.875 -12.505 411 HZ1 LYS 55 3HZ LYS 55 1.695 17.992 -15.097 412 HZ2 LYS 55 1HZ LYS 55 2.108 19.354 -14.181 413 HZ3 LYS 55 2HZ LYS 55 0.485 19.021 -14.514 414 H ALA 56 H ALA 56 2.242 12.097 -11.432 415 HA ALA 56 HA ALA 56 2.573 11.500 -14.226 416 HB1 ALA 56 1HB ALA 56 4.621 10.353 -13.502 417 HB2 ALA 56 2HB ALA 56 4.145 10.584 -11.820 418 HB3 ALA 56 3HB ALA 56 4.504 11.981 -12.834 419 H LEU 57 H LEU 57 0.920 9.966 -11.682 420 HA LEU 57 HA LEU 57 1.239 7.298 -12.774 421 HB2 LEU 57 2HB LEU 57 -0.030 8.470 -10.353 422 HB3 LEU 57 1HB LEU 57 -0.613 6.917 -10.916 423 HG LEU 57 HG LEU 57 1.226 6.973 -9.107 424 HD11 LEU 57 1HD1 LEU 57 2.022 4.879 -9.785 425 HD12 LEU 57 2HD1 LEU 57 1.834 5.268 -11.494 426 HD13 LEU 57 3HD1 LEU 57 0.410 5.009 -10.489 427 HD21 LEU 57 3HD2 LEU 57 3.174 7.020 -11.341 428 HD22 LEU 57 1HD2 LEU 57 3.377 7.459 -9.645 429 HD23 LEU 57 2HD2 LEU 57 2.569 8.569 -10.751 430 H LYS 58 H LYS 58 -1.083 9.906 -12.945 431 HA LYS 58 HA LYS 58 -3.373 8.474 -13.595 432 HB2 LYS 58 2HB LYS 58 -2.563 11.195 -13.669 433 HB3 LYS 58 1HB LYS 58 -3.329 10.821 -15.207 434 HG2 LYS 58 2HG LYS 58 -5.356 10.271 -14.208 435 HG3 LYS 58 1HG LYS 58 -4.623 10.064 -12.616 436 HD2 LYS 58 2HD LYS 58 -5.922 12.133 -12.742 437 HD3 LYS 58 1HD LYS 58 -4.208 12.463 -12.486 438 HE2 LYS 58 2HE LYS 58 -4.820 14.004 -14.120 439 HE3 LYS 58 1HE LYS 58 -4.084 12.696 -15.044 440 HZ1 LYS 58 3HZ LYS 58 -6.046 12.124 -15.972 441 HZ2 LYS 58 1HZ LYS 58 -6.426 13.743 -15.661 442 HZ3 LYS 58 2HZ LYS 58 -6.959 12.532 -14.609 443 HA PRO 59 HA PRO 59 -2.382 8.552 -18.270 444 HB2 PRO 59 2HB PRO 59 -0.131 9.720 -19.176 445 HB3 PRO 59 1HB PRO 59 -1.607 10.648 -18.848 446 HG2 PRO 59 2HG PRO 59 0.836 10.309 -17.142 447 HG3 PRO 59 1HG PRO 59 -0.082 11.782 -17.504 448 HD2 PRO 59 2HD PRO 59 -0.385 10.381 -15.192 449 HD3 PRO 59 1HD PRO 59 -1.705 11.311 -15.947 450 H LYS 60 H LYS 60 0.216 8.038 -16.028 451 HA LYS 60 HA LYS 60 1.570 6.136 -17.757 452 HB2 LYS 60 2HB LYS 60 3.135 7.276 -16.480 453 HB3 LYS 60 1HB LYS 60 2.090 7.319 -15.069 454 HG2 LYS 60 2HG LYS 60 3.907 5.850 -14.611 455 HG3 LYS 60 1HG LYS 60 2.435 4.886 -14.782 456 HD2 LYS 60 2HD LYS 60 4.236 3.788 -15.950 457 HD3 LYS 60 1HD LYS 60 3.103 4.433 -17.140 458 HE2 LYS 60 2HE LYS 60 4.895 6.507 -16.729 459 HE3 LYS 60 1HE LYS 60 5.906 5.061 -16.706 460 HZ1 LYS 60 3HZ LYS 60 4.217 6.100 -18.884 461 HZ2 LYS 60 1HZ LYS 60 4.609 4.454 -18.826 462 HZ3 LYS 60 2HZ LYS 60 5.837 5.613 -18.930 463 H PHE 61 H PHE 61 0.301 5.997 -14.433 464 HA PHE 61 HA PHE 61 0.278 3.256 -14.184 465 HB2 PHE 61 2HB PHE 61 -0.135 5.035 -12.396 466 HB3 PHE 61 1HB PHE 61 -1.816 5.000 -12.932 467 HD1 PHE 61 1HD PHE 61 0.838 3.141 -11.235 468 HD2 PHE 61 2HD PHE 61 -3.214 3.079 -12.516 469 HE1 PHE 61 1HE PHE 61 0.419 1.189 -9.800 470 HE2 PHE 61 2HE PHE 61 -3.645 1.132 -11.081 471 HZ PHE 61 HZ PHE 61 -1.827 0.182 -9.720 472 H ALA 62 H ALA 62 -1.728 5.249 -16.135 473 HA ALA 62 HA ALA 62 -4.050 3.727 -16.320 474 HB1 ALA 62 1HB ALA 62 -4.532 5.010 -18.133 475 HB2 ALA 62 2HB ALA 62 -2.938 4.776 -18.852 476 HB3 ALA 62 3HB ALA 62 -3.154 5.950 -17.552 477 H GLU 63 H GLU 63 -0.814 3.080 -17.214 478 HA GLU 63 HA GLU 63 -1.244 0.977 -19.110 479 HB2 GLU 63 2HB GLU 63 0.858 2.531 -18.644 480 HB3 GLU 63 1HB GLU 63 1.273 1.241 -17.509 481 HG2 GLU 63 2HG GLU 63 0.593 0.620 -20.360 482 HG3 GLU 63 1HG GLU 63 2.211 1.153 -19.905 483 H SER 64 H SER 64 -1.500 1.248 -15.774 484 HA SER 64 HA SER 64 -0.618 -1.190 -14.809 485 HB2 SER 64 2HB SER 64 -2.818 0.653 -13.940 486 HB3 SER 64 1HB SER 64 -2.409 -0.791 -13.035 487 HG SER 64 HG SER 64 -0.704 1.398 -13.618 488 H THR 65 H THR 65 -2.745 -0.942 -17.275 489 HA THR 65 HA THR 65 -4.953 -2.463 -16.696 490 HB THR 65 HB THR 65 -3.542 -3.205 -19.195 491 HG1 THR 65 1HG THR 65 -4.296 -0.535 -18.618 492 HG21 THR 65 3HG2 THR 65 -5.906 -3.727 -18.847 493 HG22 THR 65 1HG2 THR 65 -5.645 -2.673 -20.235 494 HG23 THR 65 2HG2 THR 65 -6.253 -2.000 -18.722 495 H GLU 66 H GLU 66 -1.627 -3.440 -17.200 496 HA GLU 66 HA GLU 66 -2.217 -6.252 -16.917 497 HB2 GLU 66 2HB GLU 66 -0.057 -4.816 -17.942 498 HB3 GLU 66 1HB GLU 66 0.564 -5.508 -16.442 499 HG2 GLU 66 2HG GLU 66 -0.690 -7.649 -17.492 500 HG3 GLU 66 1HG GLU 66 -0.194 -6.812 -18.963 501 H ILE 67 H ILE 67 -1.199 -3.539 -14.952 502 HA ILE 67 HA ILE 67 -0.462 -5.083 -12.672 503 HB ILE 67 HB ILE 67 -1.445 -2.233 -12.736 504 HG12 ILE 67 2HG1 ILE 67 1.404 -3.245 -12.787 505 HG13 ILE 67 1HG1 ILE 67 0.525 -2.683 -14.217 506 HG21 ILE 67 1HG2 ILE 67 0.299 -2.372 -10.680 507 HG22 ILE 67 2HG2 ILE 67 -0.403 -3.988 -10.624 508 HG23 ILE 67 3HG2 ILE 67 -1.446 -2.569 -10.512 509 HD11 ILE 67 3HD1 ILE 67 2.095 -1.156 -12.544 510 HD12 ILE 67 1HD1 ILE 67 0.449 -0.753 -12.057 511 HD13 ILE 67 2HD1 ILE 67 0.945 -0.558 -13.739 512 H SER 68 H SER 68 -3.442 -4.396 -14.150 513 HA SER 68 HA SER 68 -5.121 -4.370 -11.855 514 HB2 SER 68 2HB SER 68 -6.929 -4.513 -13.359 515 HB3 SER 68 1HB SER 68 -5.687 -3.671 -14.284 516 HG SER 68 HG SER 68 -6.834 -5.530 -15.305 517 H GLU 69 H GLU 69 -3.622 -6.845 -13.785 518 HA GLU 69 HA GLU 69 -5.095 -8.960 -12.417 519 HB2 GLU 69 2HB GLU 69 -2.941 -9.348 -14.487 520 HB3 GLU 69 1HB GLU 69 -4.224 -10.462 -14.029 521 HG2 GLU 69 2HG GLU 69 -4.502 -7.897 -15.575 522 HG3 GLU 69 1HG GLU 69 -4.734 -9.540 -16.170 523 H LEU 70 H LEU 70 -1.890 -7.568 -12.694 524 HA LEU 70 HA LEU 70 -0.399 -9.482 -11.313 525 HB2 LEU 70 2HB LEU 70 -0.067 -6.766 -12.193 526 HB3 LEU 70 1HB LEU 70 0.589 -6.940 -10.566 527 HG LEU 70 HG LEU 70 1.848 -8.977 -11.523 528 HD11 LEU 70 1HD1 LEU 70 2.251 -8.957 -13.885 529 HD12 LEU 70 2HD1 LEU 70 1.250 -7.518 -14.090 530 HD13 LEU 70 3HD1 LEU 70 0.513 -9.045 -13.602 531 HD21 LEU 70 3HD2 LEU 70 3.532 -7.329 -12.633 532 HD22 LEU 70 1HD2 LEU 70 3.190 -7.197 -10.908 533 HD23 LEU 70 2HD2 LEU 70 2.423 -6.090 -12.047 534 H SER 71 H SER 71 -2.632 -7.076 -10.213 535 HA SER 71 HA SER 71 -2.007 -6.589 -7.624 536 HB2 SER 71 2HB SER 71 -4.436 -6.624 -9.178 537 HB3 SER 71 1HB SER 71 -4.741 -7.130 -7.517 538 HG SER 71 HG SER 71 -3.235 -4.819 -8.141 539 H HIS 72 H HIS 72 -2.764 -9.708 -8.872 540 HA HIS 72 HA HIS 72 -3.835 -10.971 -6.635 541 HB2 HIS 72 2HB HIS 72 -2.046 -11.992 -8.845 542 HB3 HIS 72 1HB HIS 72 -2.702 -13.050 -7.587 543 HD1 HIS 72 1HD HIS 72 -3.379 -12.167 -10.907 544 HD2 HIS 72 2HD HIS 72 -5.753 -12.535 -7.517 545 HE1 HIS 72 1HE HIS 72 -5.726 -12.470 -11.760 546 HE2 HIS 72 2HE HIS 72 -7.156 -12.597 -9.690 547 H ASN 73 H ASN 73 -0.820 -9.536 -7.081 548 HA ASN 73 HA ASN 73 0.749 -11.166 -5.348 549 HB2 ASN 73 2HB ASN 73 2.146 -8.927 -5.302 550 HB3 ASN 73 1HB ASN 73 2.126 -9.950 -6.739 551 HD21 ASN 73 1HD2 ASN 73 2.180 -8.672 -8.463 552 HD22 ASN 73 2HD2 ASN 73 1.218 -7.235 -8.685 553 H PHE 74 H PHE 74 -1.141 -8.231 -4.939 554 HA PHE 74 HA PHE 74 -1.245 -8.658 -2.065 555 HB2 PHE 74 2HB PHE 74 -0.970 -5.993 -1.987 556 HB3 PHE 74 1HB PHE 74 0.412 -7.088 -1.889 557 HD1 PHE 74 2HD PHE 74 -1.617 -5.252 -4.418 558 HD2 PHE 74 1HD PHE 74 2.189 -6.773 -3.278 559 HE1 PHE 74 2HE PHE 74 -0.609 -4.203 -6.403 560 HE2 PHE 74 1HE PHE 74 3.205 -5.730 -5.260 561 HZ PHE 74 HZ PHE 74 1.805 -4.448 -6.825 562 H VAL 75 H VAL 75 -2.656 -6.024 -1.687 563 HA VAL 75 HA VAL 75 -4.802 -6.224 -3.613 564 HB VAL 75 HB VAL 75 -5.378 -7.985 -1.995 565 HG11 VAL 75 1HG1 VAL 75 -5.856 -7.591 0.234 566 HG12 VAL 75 2HG1 VAL 75 -6.069 -5.858 -0.010 567 HG13 VAL 75 3HG1 VAL 75 -4.451 -6.558 -0.033 568 HG21 VAL 75 3HG2 VAL 75 -7.552 -7.603 -2.430 569 HG22 VAL 75 1HG2 VAL 75 -6.998 -6.124 -3.210 570 HG23 VAL 75 2HG2 VAL 75 -7.557 -6.083 -1.543 571 H MET 76 H MET 76 -6.150 -4.684 -3.788 572 HA MET 76 HA MET 76 -5.727 -2.123 -3.654 573 HB2 MET 76 2HB MET 76 -8.294 -2.001 -3.425 574 HB3 MET 76 1HB MET 76 -7.585 -2.827 -4.797 575 HG2 MET 76 2HG MET 76 -8.041 -4.523 -2.451 576 HG3 MET 76 1HG MET 76 -9.504 -3.869 -3.172 577 HE1 MET 76 3HE MET 76 -10.324 -6.817 -4.633 578 HE2 MET 76 1HE MET 76 -9.897 -6.285 -3.008 579 HE3 MET 76 2HE MET 76 -8.964 -7.557 -3.792 580 H VAL 77 H VAL 77 -4.886 -1.061 -1.848 581 HA VAL 77 HA VAL 77 -6.841 -0.543 0.258 582 HB VAL 77 HB VAL 77 -3.949 -1.135 0.895 583 HG11 VAL 77 1HG1 VAL 77 -4.570 0.406 2.492 584 HG12 VAL 77 2HG1 VAL 77 -5.032 -1.107 3.271 585 HG13 VAL 77 3HG1 VAL 77 -6.257 -0.110 2.485 586 HG21 VAL 77 3HG2 VAL 77 -5.512 -3.083 0.302 587 HG22 VAL 77 1HG2 VAL 77 -6.304 -2.724 1.832 588 HG23 VAL 77 2HG2 VAL 77 -4.599 -3.172 1.806 589 H ASN 78 H ASN 78 -6.844 1.297 -1.418 590 HA ASN 78 HA ASN 78 -4.686 3.195 -1.148 591 HB2 ASN 78 2HB ASN 78 -5.923 2.821 -3.280 592 HB3 ASN 78 1HB ASN 78 -7.343 3.528 -2.529 593 HD21 ASN 78 1HD2 ASN 78 -4.019 4.614 -2.089 594 HD22 ASN 78 2HD2 ASN 78 -4.238 6.150 -2.865 595 H LEU 79 H LEU 79 -4.597 4.196 0.770 596 HA LEU 79 HA LEU 79 -7.069 5.170 1.991 597 HB2 LEU 79 2HB LEU 79 -5.853 4.173 3.659 598 HB3 LEU 79 1HB LEU 79 -4.314 4.615 2.957 599 HG LEU 79 HG LEU 79 -4.724 6.968 3.725 600 HD11 LEU 79 1HD1 LEU 79 -6.542 7.586 4.925 601 HD12 LEU 79 2HD1 LEU 79 -6.746 5.993 5.647 602 HD13 LEU 79 3HD1 LEU 79 -7.291 6.288 3.996 603 HD21 LEU 79 3HD2 LEU 79 -3.781 4.759 5.118 604 HD22 LEU 79 1HD2 LEU 79 -4.846 5.580 6.258 605 HD23 LEU 79 2HD2 LEU 79 -3.508 6.456 5.514 606 H GLU 80 H GLU 80 -7.491 7.336 2.360 607 HA GLU 80 HA GLU 80 -5.595 9.277 1.229 608 HB2 GLU 80 2HB GLU 80 -7.868 8.505 -0.092 609 HB3 GLU 80 1HB GLU 80 -8.433 9.925 0.796 610 HG2 GLU 80 2HG GLU 80 -6.252 11.011 -0.172 611 HG3 GLU 80 1HG GLU 80 -6.398 9.715 -1.370 612 H ASP 81 H ASP 81 -6.893 11.590 1.615 613 HA ASP 81 HA ASP 81 -6.557 12.102 4.348 614 HB2 ASP 81 2HB ASP 81 -6.515 13.725 2.326 615 HB3 ASP 81 1HB ASP 81 -8.254 13.839 2.576 616 H GLU 82 H GLU 82 -9.318 11.025 2.548 617 HA GLU 82 HA GLU 82 -11.451 11.837 4.081 618 HB2 GLU 82 2HB GLU 82 -10.898 9.392 2.460 619 HB3 GLU 82 1HB GLU 82 -12.341 9.423 3.464 620 HG2 GLU 82 2HG GLU 82 -11.720 11.628 1.534 621 HG3 GLU 82 1HG GLU 82 -12.556 10.159 1.032 622 H GLU 83 H GLU 83 -9.004 9.489 4.848 623 HA GLU 83 HA GLU 83 -10.290 9.069 7.462 624 HB2 GLU 83 2HB GLU 83 -10.110 7.095 5.630 625 HB3 GLU 83 1HB GLU 83 -8.553 6.905 6.424 626 HG2 GLU 83 2HG GLU 83 -10.111 5.451 7.483 627 HG3 GLU 83 1HG GLU 83 -9.747 6.772 8.601 628 H GLU 84 H GLU 84 -8.953 10.824 8.191 629 HA GLU 84 HA GLU 84 -6.219 11.055 7.986 630 HB2 GLU 84 2HB GLU 84 -8.130 12.451 9.271 631 HB3 GLU 84 1HB GLU 84 -7.368 11.665 10.646 632 HG2 GLU 84 2HG GLU 84 -5.702 13.089 8.621 633 HG3 GLU 84 1HG GLU 84 -6.545 13.994 9.878 634 HA PRO 85 HA PRO 85 -5.067 7.111 9.923 635 HB2 PRO 85 2HB PRO 85 -2.386 8.325 9.462 636 HB3 PRO 85 1HB PRO 85 -2.981 6.704 9.050 637 HG2 PRO 85 2HG PRO 85 -2.668 8.556 7.160 638 HG3 PRO 85 1HG PRO 85 -4.058 7.445 7.131 639 HD2 PRO 85 2HD PRO 85 -3.938 10.320 7.952 640 HD3 PRO 85 1HD PRO 85 -5.210 9.448 7.062 641 H LYS 86 H LYS 86 -3.323 6.633 11.666 642 HA LYS 86 HA LYS 86 -2.883 8.863 13.487 643 HB2 LYS 86 2HB LYS 86 -3.855 7.611 15.400 644 HB3 LYS 86 1HB LYS 86 -5.057 8.090 14.195 645 HG2 LYS 86 2HG LYS 86 -5.423 5.934 13.506 646 HG3 LYS 86 1HG LYS 86 -3.824 5.383 14.014 647 HD2 LYS 86 2HD LYS 86 -4.598 4.756 16.006 648 HD3 LYS 86 1HD LYS 86 -5.346 6.332 16.275 649 HE2 LYS 86 2HE LYS 86 -7.381 5.580 15.731 650 HE3 LYS 86 1HE LYS 86 -6.777 4.694 14.332 651 HZ1 LYS 86 3HZ LYS 86 -5.999 2.959 15.899 652 HZ2 LYS 86 1HZ LYS 86 -7.680 3.144 15.877 653 HZ3 LYS 86 2HZ LYS 86 -6.776 3.782 17.155 654 H ASP 87 H ASP 87 -1.063 7.357 11.948 655 HA ASP 87 HA ASP 87 0.858 6.704 13.879 656 HB2 ASP 87 2HB ASP 87 -0.980 4.604 13.416 657 HB3 ASP 87 1HB ASP 87 0.531 4.138 12.620 658 H GLU 88 H GLU 88 2.515 4.992 12.624 659 HA GLU 88 HA GLU 88 3.635 6.564 10.567 660 HB2 GLU 88 2HB GLU 88 4.320 4.183 12.058 661 HB3 GLU 88 1HB GLU 88 4.767 4.017 10.369 662 HG2 GLU 88 2HG GLU 88 6.647 4.921 11.377 663 HG3 GLU 88 1HG GLU 88 5.864 6.308 10.622 664 H ASP 89 H ASP 89 1.157 4.250 10.477 665 HA ASP 89 HA ASP 89 1.455 2.883 8.136 666 HB2 ASP 89 2HB ASP 89 -0.977 3.976 9.509 667 HB3 ASP 89 1HB ASP 89 -1.125 3.103 7.975 668 H PHE 90 H PHE 90 1.237 6.301 8.345 669 HA PHE 90 HA PHE 90 0.334 6.467 5.566 670 HB2 PHE 90 2HB PHE 90 -0.146 8.788 5.939 671 HB3 PHE 90 1HB PHE 90 -0.848 7.847 7.261 672 HD1 PHE 90 2HD PHE 90 2.139 9.863 6.360 673 HD2 PHE 90 1HD PHE 90 -0.388 8.408 9.454 674 HE1 PHE 90 2HE PHE 90 3.317 11.279 7.982 675 HE2 PHE 90 1HE PHE 90 0.782 9.823 11.085 676 HZ PHE 90 HZ PHE 90 2.643 11.264 10.353 677 H SER 91 H SER 91 3.111 7.150 7.602 678 HA SER 91 HA SER 91 4.803 7.298 5.295 679 HB2 SER 91 2HB SER 91 4.340 9.813 6.910 680 HB3 SER 91 1HB SER 91 5.692 9.586 5.791 681 HG SER 91 HG SER 91 4.187 9.334 4.116 682 HA PRO 92 HA PRO 92 7.057 6.017 9.086 683 HB2 PRO 92 2HB PRO 92 7.531 3.432 8.166 684 HB3 PRO 92 1HB PRO 92 6.212 3.917 9.240 685 HG2 PRO 92 2HG PRO 92 6.021 2.980 6.553 686 HG3 PRO 92 1HG PRO 92 4.711 3.539 7.601 687 HD2 PRO 92 2HD PRO 92 6.139 4.974 5.445 688 HD3 PRO 92 1HD PRO 92 4.511 5.240 6.091 689 H ASP 93 H ASP 93 8.592 7.574 7.974 690 HA ASP 93 HA ASP 93 11.092 6.408 7.621 691 HB2 ASP 93 2HB ASP 93 9.477 6.465 5.199 692 HB3 ASP 93 1HB ASP 93 10.988 7.366 5.005 693 H GLY 94 H GLY 94 9.890 8.977 5.504 694 HA2 GLY 94 2HA GLY 94 11.673 10.842 6.907 695 HA3 GLY 94 1HA GLY 94 11.005 11.065 5.285 696 H GLY 95 H GLY 95 9.465 12.536 5.125 697 HA2 GLY 95 2HA GLY 95 7.416 12.765 7.160 698 HA3 GLY 95 1HA GLY 95 8.483 14.165 7.029 699 H TYR 96 H TYR 96 6.692 12.001 4.816 700 HA TYR 96 HA TYR 96 5.982 14.376 3.245 701 HB2 TYR 96 2HB TYR 96 5.111 12.292 1.718 702 HB3 TYR 96 1HB TYR 96 6.700 13.052 1.569 703 HD1 TYR 96 1HD TYR 96 8.577 11.994 3.098 704 HD2 TYR 96 2HD TYR 96 4.980 10.017 1.990 705 HE1 TYR 96 1HE TYR 96 9.645 9.820 3.528 706 HE2 TYR 96 2HE TYR 96 6.035 7.834 2.408 707 HH TYR 96 HH TYR 96 9.223 7.350 2.617 708 H ILE 97 H ILE 97 3.718 13.659 1.967 709 HA ILE 97 HA ILE 97 1.802 12.649 3.877 710 HB ILE 97 HB ILE 97 0.403 14.750 3.705 711 HG12 ILE 97 2HG1 ILE 97 2.845 16.335 3.267 712 HG13 ILE 97 1HG1 ILE 97 2.260 15.475 1.840 713 HG21 ILE 97 1HG2 ILE 97 1.513 15.810 5.551 714 HG22 ILE 97 2HG2 ILE 97 3.045 15.049 5.122 715 HG23 ILE 97 3HG2 ILE 97 1.705 14.063 5.707 716 HD11 ILE 97 3HD1 ILE 97 0.744 17.471 3.502 717 HD12 ILE 97 1HD1 ILE 97 0.045 16.524 2.188 718 HD13 ILE 97 2HD1 ILE 97 1.338 17.676 1.853 719 HA PRO 98 HA PRO 98 1.584 10.386 3.027 720 HB2 PRO 98 2HB PRO 98 -1.098 9.709 1.757 721 HB3 PRO 98 1HB PRO 98 -0.298 8.886 3.126 722 HG2 PRO 98 2HG PRO 98 -1.848 11.275 3.173 723 HG3 PRO 98 1HG PRO 98 -0.994 10.481 4.525 724 HD2 PRO 98 2HD PRO 98 -0.111 12.793 3.763 725 HD3 PRO 98 1HD PRO 98 1.066 11.479 3.967 726 H ARG 99 H ARG 99 2.377 8.418 2.146 727 HA ARG 99 HA ARG 99 2.537 8.402 -0.797 728 HB2 ARG 99 2HB ARG 99 4.577 8.330 1.285 729 HB3 ARG 99 1HB ARG 99 4.779 7.065 0.076 730 HG2 ARG 99 2HG ARG 99 6.052 9.034 -0.498 731 HG3 ARG 99 1HG ARG 99 4.787 8.748 -1.689 732 HD2 ARG 99 2HD ARG 99 3.460 10.421 -0.098 733 HD3 ARG 99 1HD ARG 99 5.094 10.937 0.297 734 HE ARG 99 HE ARG 99 5.365 11.740 -1.862 735 HH11 ARG 99 1HH1 ARG 99 2.262 10.167 -1.524 736 HH12 ARG 99 2HH1 ARG 99 1.642 10.811 -3.005 737 HH21 ARG 99 1HH2 ARG 99 4.545 12.580 -3.803 738 HH22 ARG 99 2HH2 ARG 99 2.934 12.178 -4.297 739 H ILE 100 H ILE 100 3.842 6.051 -1.212 740 HA ILE 100 HA ILE 100 1.733 4.115 -0.694 741 HB ILE 100 HB ILE 100 4.251 3.917 -2.347 742 HG12 ILE 100 2HG1 ILE 100 2.407 3.772 -4.183 743 HG13 ILE 100 1HG1 ILE 100 1.370 4.497 -2.960 744 HG21 ILE 100 1HG2 ILE 100 2.735 1.906 -3.265 745 HG22 ILE 100 2HG2 ILE 100 2.251 1.890 -1.570 746 HG23 ILE 100 3HG2 ILE 100 3.951 1.703 -2.002 747 HD11 ILE 100 3HD1 ILE 100 2.264 6.513 -3.250 748 HD12 ILE 100 1HD1 ILE 100 2.925 5.851 -4.746 749 HD13 ILE 100 2HD1 ILE 100 3.910 5.880 -3.282 750 H LEU 101 H LEU 101 1.863 2.361 0.622 751 HA LEU 101 HA LEU 101 4.435 1.781 1.944 752 HB2 LEU 101 2HB LEU 101 1.772 2.347 3.188 753 HB3 LEU 101 1HB LEU 101 2.905 1.288 3.996 754 HG LEU 101 HG LEU 101 4.521 3.087 4.180 755 HD11 LEU 101 1HD1 LEU 101 4.417 4.537 2.456 756 HD12 LEU 101 2HD1 LEU 101 3.367 5.421 3.560 757 HD13 LEU 101 3HD1 LEU 101 2.665 4.400 2.304 758 HD21 LEU 101 3HD2 LEU 101 2.366 4.682 5.160 759 HD22 LEU 101 1HD2 LEU 101 3.488 3.660 6.058 760 HD23 LEU 101 2HD2 LEU 101 1.993 2.978 5.424 761 H PHE 102 H PHE 102 4.905 -0.380 2.131 762 HA PHE 102 HA PHE 102 2.795 -2.253 1.313 763 HB2 PHE 102 2HB PHE 102 5.792 -2.428 1.405 764 HB3 PHE 102 1HB PHE 102 4.818 -3.889 1.340 765 HD1 PHE 102 1HD PHE 102 5.591 -0.741 -0.439 766 HD2 PHE 102 2HD PHE 102 3.894 -4.636 -0.685 767 HE1 PHE 102 1HE PHE 102 5.438 -0.515 -2.884 768 HE2 PHE 102 2HE PHE 102 3.738 -4.418 -3.131 769 HZ PHE 102 HZ PHE 102 4.511 -2.356 -4.234 770 H LEU 103 H LEU 103 1.978 -3.787 2.720 771 HA LEU 103 HA LEU 103 3.275 -4.033 5.336 772 HB2 LEU 103 2HB LEU 103 1.421 -3.408 6.584 773 HB3 LEU 103 1HB LEU 103 1.521 -2.201 5.323 774 HG LEU 103 HG LEU 103 -0.413 -4.499 5.466 775 HD11 LEU 103 1HD1 LEU 103 -1.173 -2.823 6.898 776 HD12 LEU 103 2HD1 LEU 103 -2.037 -2.537 5.390 777 HD13 LEU 103 3HD1 LEU 103 -0.651 -1.535 5.819 778 HD21 LEU 103 3HD2 LEU 103 -0.166 -4.375 3.207 779 HD22 LEU 103 1HD2 LEU 103 0.392 -2.700 3.247 780 HD23 LEU 103 2HD2 LEU 103 -1.325 -3.065 3.429 781 H ASP 104 H ASP 104 2.016 -5.631 6.755 782 HA ASP 104 HA ASP 104 1.847 -8.096 5.282 783 HB2 ASP 104 2HB ASP 104 1.913 -7.301 8.148 784 HB3 ASP 104 1HB ASP 104 1.159 -8.854 7.757 785 HA PRO 105 HA PRO 105 -2.480 -8.435 4.577 786 HB2 PRO 105 2HB PRO 105 -2.860 -11.096 5.237 787 HB3 PRO 105 1HB PRO 105 -2.257 -10.509 3.677 788 HG2 PRO 105 2HG PRO 105 -0.740 -11.575 6.024 789 HG3 PRO 105 1HG PRO 105 -0.464 -11.841 4.286 790 HD2 PRO 105 2HD PRO 105 1.046 -10.134 5.705 791 HD3 PRO 105 1HD PRO 105 0.601 -9.799 4.019 792 H SER 106 H SER 106 -3.306 -7.139 6.188 793 HA SER 106 HA SER 106 -5.174 -7.977 7.899 794 HB2 SER 106 2HB SER 106 -3.856 -7.794 10.178 795 HB3 SER 106 1HB SER 106 -3.915 -9.334 9.307 796 HG SER 106 HG SER 106 -1.800 -9.030 9.741 797 H GLY 107 H GLY 107 -2.502 -5.833 7.384 798 HA2 GLY 107 2HA GLY 107 -3.028 -3.469 7.102 799 HA3 GLY 107 1HA GLY 107 -4.122 -3.622 8.483 800 H LYS 108 H LYS 108 -0.782 -4.792 8.056 801 HA LYS 108 HA LYS 108 -0.049 -3.108 10.373 802 HB2 LYS 108 2HB LYS 108 0.541 -5.953 9.744 803 HB3 LYS 108 1HB LYS 108 1.790 -5.024 10.562 804 HG2 LYS 108 2HG LYS 108 -0.680 -4.503 11.860 805 HG3 LYS 108 1HG LYS 108 -0.514 -6.255 11.661 806 HD2 LYS 108 2HD LYS 108 1.716 -6.142 12.693 807 HD3 LYS 108 1HD LYS 108 1.518 -4.403 12.914 808 HE2 LYS 108 2HE LYS 108 0.138 -4.654 14.680 809 HE3 LYS 108 1HE LYS 108 -0.666 -6.060 13.983 810 HZ1 LYS 108 3HZ LYS 108 0.949 -7.486 14.798 811 HZ2 LYS 108 1HZ LYS 108 0.768 -6.377 16.063 812 HZ3 LYS 108 2HZ LYS 108 2.092 -6.258 15.017 813 H VAL 109 H VAL 109 0.519 -1.460 8.752 814 HA VAL 109 HA VAL 109 2.470 -1.724 6.786 815 HB VAL 109 HB VAL 109 1.494 0.562 8.454 816 HG11 VAL 109 1HG1 VAL 109 2.903 2.075 7.077 817 HG12 VAL 109 2HG1 VAL 109 3.791 0.659 6.521 818 HG13 VAL 109 3HG1 VAL 109 3.797 1.090 8.230 819 HG21 VAL 109 3HG2 VAL 109 1.302 -0.264 5.582 820 HG22 VAL 109 1HG2 VAL 109 0.979 1.397 6.076 821 HG23 VAL 109 2HG2 VAL 109 0.010 0.077 6.730 822 H HIS 110 H HIS 110 4.581 -1.895 6.756 823 HA HIS 110 HA HIS 110 6.054 -1.341 9.241 824 HB2 HIS 110 2HB HIS 110 7.517 -3.363 8.569 825 HB3 HIS 110 1HB HIS 110 5.968 -3.682 9.340 826 HD1 HIS 110 1HD HIS 110 7.172 -3.286 5.741 827 HD2 HIS 110 2HD HIS 110 4.658 -5.652 8.053 828 HE1 HIS 110 1HE HIS 110 6.213 -4.992 4.162 829 HE2 HIS 110 2HE HIS 110 4.763 -6.466 5.602 830 HA PRO 111 HA PRO 111 8.565 0.956 6.390 831 HB2 PRO 111 2HB PRO 111 10.726 1.366 7.977 832 HB3 PRO 111 1HB PRO 111 9.206 2.240 8.193 833 HG2 PRO 111 2HG PRO 111 10.250 -0.138 9.679 834 HG3 PRO 111 1HG PRO 111 9.439 1.306 10.309 835 HD2 PRO 111 2HD PRO 111 8.158 -1.057 9.941 836 HD3 PRO 111 1HD PRO 111 7.343 0.516 9.769 837 H GLU 112 H GLU 112 8.566 -1.921 6.152 838 HA GLU 112 HA GLU 112 11.418 -2.542 5.813 839 HB2 GLU 112 2HB GLU 112 8.951 -4.241 6.047 840 HB3 GLU 112 1HB GLU 112 10.434 -4.897 5.370 841 HG2 GLU 112 2HG GLU 112 10.542 -3.518 8.004 842 HG3 GLU 112 1HG GLU 112 9.880 -5.150 7.912 843 H ILE 113 H ILE 113 8.350 -3.064 4.065 844 HA ILE 113 HA ILE 113 9.840 -3.232 1.566 845 HB ILE 113 HB ILE 113 6.905 -3.681 2.110 846 HG12 ILE 113 2HG1 ILE 113 8.319 -5.366 3.165 847 HG13 ILE 113 1HG1 ILE 113 7.458 -6.063 1.786 848 HG21 ILE 113 1HG2 ILE 113 6.805 -4.623 -0.135 849 HG22 ILE 113 2HG2 ILE 113 8.508 -4.237 -0.387 850 HG23 ILE 113 3HG2 ILE 113 7.328 -2.940 -0.192 851 HD11 ILE 113 3HD1 ILE 113 9.472 -5.857 0.429 852 HD12 ILE 113 1HD1 ILE 113 9.758 -6.827 1.873 853 HD13 ILE 113 2HD1 ILE 113 10.330 -5.160 1.804 854 H ILE 114 H ILE 114 10.419 -1.249 0.940 855 HA ILE 114 HA ILE 114 8.310 0.779 0.585 856 HB ILE 114 HB ILE 114 9.981 2.497 0.789 857 HG12 ILE 114 2HG1 ILE 114 11.828 1.013 -0.207 858 HG13 ILE 114 1HG1 ILE 114 12.295 2.136 1.056 859 HG21 ILE 114 1HG2 ILE 114 10.919 1.320 3.177 860 HG22 ILE 114 2HG2 ILE 114 9.284 0.721 2.896 861 HG23 ILE 114 3HG2 ILE 114 9.590 2.457 2.961 862 HD11 ILE 114 3HD1 ILE 114 11.577 -0.344 2.257 863 HD12 ILE 114 1HD1 ILE 114 13.138 0.475 2.241 864 HD13 ILE 114 2HD1 ILE 114 12.714 -0.641 0.943 865 H ASN 115 H ASN 115 9.726 2.511 -1.049 866 HA ASN 115 HA ASN 115 9.965 0.927 -3.510 867 HB2 ASN 115 2HB ASN 115 8.243 2.567 -3.727 868 HB3 ASN 115 1HB ASN 115 9.265 3.824 -3.018 869 HD21 ASN 115 1HD2 ASN 115 8.855 5.130 -4.832 870 HD22 ASN 115 2HD2 ASN 115 9.672 4.847 -6.346 871 H GLU 116 H GLU 116 12.118 0.310 -3.175 872 HA GLU 116 HA GLU 116 14.261 1.855 -2.431 873 HB2 GLU 116 2HB GLU 116 13.948 -0.562 -4.140 874 HB3 GLU 116 1HB GLU 116 15.511 0.265 -4.163 875 HG2 GLU 116 2HG GLU 116 14.141 -0.643 -1.644 876 HG3 GLU 116 1HG GLU 116 15.313 -1.618 -2.530 877 H ASN 117 H ASN 117 12.580 1.860 -5.480 878 HA ASN 117 HA ASN 117 14.608 3.216 -6.957 879 HB2 ASN 117 2HB ASN 117 11.792 2.413 -7.407 880 HB3 ASN 117 1HB ASN 117 12.359 3.810 -8.336 881 HD21 ASN 117 1HD2 ASN 117 13.909 0.795 -7.284 882 HD22 ASN 117 2HD2 ASN 117 14.402 0.295 -8.880 883 H GLY 118 H GLY 118 12.345 4.228 -4.602 884 HA2 GLY 118 2HA GLY 118 11.797 6.850 -5.461 885 HA3 GLY 118 1HA GLY 118 11.774 6.294 -3.784 886 H ASN 119 H ASN 119 13.264 7.085 -2.447 887 HA ASN 119 HA ASN 119 15.741 8.189 -3.575 888 HB2 ASN 119 2HB ASN 119 13.618 9.734 -2.557 889 HB3 ASN 119 1HB ASN 119 14.871 9.752 -1.307 890 HD21 ASN 119 1HD2 ASN 119 15.513 11.825 -1.564 891 HD22 ASN 119 2HD2 ASN 119 16.285 12.430 -3.005 892 HA PRO 120 HA PRO 120 17.849 6.354 -0.168 893 HB2 PRO 120 2HB PRO 120 19.261 8.774 0.639 894 HB3 PRO 120 1HB PRO 120 19.882 7.342 -0.199 895 HG2 PRO 120 2HG PRO 120 19.631 9.765 -1.400 896 HG3 PRO 120 1HG PRO 120 19.483 8.226 -2.279 897 HD2 PRO 120 2HD PRO 120 17.330 10.062 -1.280 898 HD3 PRO 120 1HD PRO 120 17.443 9.186 -2.828 899 H SER 121 H SER 121 15.424 8.384 0.523 900 HA SER 121 HA SER 121 15.528 7.773 3.345 901 HB2 SER 121 2HB SER 121 16.069 10.494 2.306 902 HB3 SER 121 1HB SER 121 14.866 10.405 3.602 903 HG SER 121 HG SER 121 16.374 9.533 4.943 904 H TYR 122 H TYR 122 14.004 9.476 0.704 905 HA TYR 122 HA TYR 122 11.415 9.686 1.728 906 HB2 TYR 122 2HB TYR 122 12.801 10.022 -0.802 907 HB3 TYR 122 1HB TYR 122 11.166 9.397 -1.024 908 HD1 TYR 122 2HD TYR 122 9.306 10.704 0.358 909 HD2 TYR 122 1HD TYR 122 13.119 12.287 -0.668 910 HE1 TYR 122 2HE TYR 122 8.434 12.983 0.649 911 HE2 TYR 122 1HE TYR 122 12.261 14.568 -0.371 912 HH TYR 122 HH TYR 122 9.243 15.223 1.095 913 H LYS 123 H LYS 123 12.963 7.178 -0.223 914 HA LYS 123 HA LYS 123 12.341 5.062 -0.798 915 HB2 LYS 123 2HB LYS 123 11.236 5.255 2.001 916 HB3 LYS 123 1HB LYS 123 11.300 3.756 1.093 917 HG2 LYS 123 2HG LYS 123 13.644 5.437 1.955 918 HG3 LYS 123 1HG LYS 123 13.149 3.871 2.620 919 HD2 LYS 123 2HD LYS 123 14.114 2.722 0.953 920 HD3 LYS 123 1HD LYS 123 13.589 3.871 -0.282 921 HE2 LYS 123 2HE LYS 123 15.825 4.254 -0.370 922 HE3 LYS 123 1HE LYS 123 15.410 5.388 0.912 923 HZ1 LYS 123 3HZ LYS 123 16.000 2.698 1.803 924 HZ2 LYS 123 1HZ LYS 123 16.500 4.185 2.438 925 HZ3 LYS 123 2HZ LYS 123 17.310 3.515 1.112 926 H TYR 124 H TYR 124 9.490 5.401 1.210 927 HA TYR 124 HA TYR 124 7.705 4.284 -0.525 928 HB2 TYR 124 2HB TYR 124 7.288 6.297 1.675 929 HB3 TYR 124 1HB TYR 124 5.949 5.506 0.831 930 HD1 TYR 124 2HD TYR 124 6.727 2.779 0.548 931 HD2 TYR 124 1HD TYR 124 7.493 5.409 3.800 932 HE1 TYR 124 2HE TYR 124 6.892 0.854 2.058 933 HE2 TYR 124 1HE TYR 124 7.668 3.484 5.320 934 HH TYR 124 HH TYR 124 6.550 0.854 5.089 935 H PHE 125 H PHE 125 9.104 7.374 -0.931 936 HA PHE 125 HA PHE 125 6.928 8.678 -2.199 937 HB2 PHE 125 2HB PHE 125 8.869 9.916 -1.327 938 HB3 PHE 125 1HB PHE 125 9.895 9.165 -2.556 939 HD1 PHE 125 1HD PHE 125 9.221 9.568 -5.025 940 HD2 PHE 125 2HD PHE 125 7.810 11.925 -1.772 941 HE1 PHE 125 1HE PHE 125 8.665 11.379 -6.584 942 HE2 PHE 125 2HE PHE 125 7.245 13.739 -3.333 943 HZ PHE 125 HZ PHE 125 7.671 13.464 -5.744 944 H TYR 126 H TYR 126 5.973 7.981 -3.978 945 HA TYR 126 HA TYR 126 7.598 6.664 -6.041 946 HB2 TYR 126 2HB TYR 126 4.841 6.310 -5.075 947 HB3 TYR 126 1HB TYR 126 5.001 6.304 -6.837 948 HD1 TYR 126 1HD TYR 126 7.303 4.895 -7.514 949 HD2 TYR 126 2HD TYR 126 4.765 4.197 -4.176 950 HE1 TYR 126 1HE TYR 126 8.055 2.553 -7.439 951 HE2 TYR 126 2HE TYR 126 5.509 1.856 -4.091 952 HH TYR 126 HH TYR 126 7.802 0.620 -4.944 953 H VAL 127 H VAL 127 6.845 7.128 -8.337 954 HA VAL 127 HA VAL 127 5.453 9.507 -8.922 955 HB VAL 127 HB VAL 127 7.572 10.383 -7.818 956 HG11 VAL 127 1HG1 VAL 127 9.607 10.039 -8.662 957 HG12 VAL 127 2HG1 VAL 127 9.057 10.237 -10.325 958 HG13 VAL 127 3HG1 VAL 127 8.867 8.683 -9.513 959 HG21 VAL 127 3HG2 VAL 127 7.578 11.602 -10.475 960 HG22 VAL 127 1HG2 VAL 127 7.245 12.307 -8.893 961 HG23 VAL 127 2HG2 VAL 127 5.979 11.426 -9.750 962 H SER 128 H SER 128 5.240 7.042 -9.957 963 HA SER 128 HA SER 128 4.962 7.195 -12.591 964 HB2 SER 128 2HB SER 128 7.161 7.795 -13.176 965 HB3 SER 128 1HB SER 128 7.874 6.660 -12.020 966 HG SER 128 HG SER 128 6.379 5.868 -14.299 967 H ALA 129 H ALA 129 3.624 5.517 -12.778 968 HA ALA 129 HA ALA 129 3.436 3.296 -11.194 969 HB1 ALA 129 1HB ALA 129 1.877 4.150 -13.070 970 HB2 ALA 129 2HB ALA 129 1.924 2.425 -12.709 971 HB3 ALA 129 3HB ALA 129 2.799 3.057 -14.103 972 H GLU 130 H GLU 130 5.703 3.850 -13.770 973 HA GLU 130 HA GLU 130 6.423 1.291 -14.501 974 HB2 GLU 130 2HB GLU 130 7.329 3.724 -15.160 975 HB3 GLU 130 1HB GLU 130 8.632 3.237 -14.068 976 HG2 GLU 130 2HG GLU 130 8.672 1.070 -15.487 977 HG3 GLU 130 1HG GLU 130 7.796 2.044 -16.680 978 H GLN 131 H GLN 131 8.247 3.207 -12.090 979 HA GLN 131 HA GLN 131 9.701 1.063 -11.110 980 HB2 GLN 131 2HB GLN 131 9.974 2.417 -9.034 981 HB3 GLN 131 1HB GLN 131 10.456 3.214 -10.527 982 HG2 GLN 131 2HG GLN 131 8.350 4.446 -10.553 983 HG3 GLN 131 1HG GLN 131 7.858 3.643 -9.064 984 HE21 GLN 131 1HE2 GLN 131 8.316 6.494 -9.714 985 HE22 GLN 131 2HE2 GLN 131 9.452 7.053 -8.537 986 H VAL 132 H VAL 132 6.531 2.251 -10.137 987 HA VAL 132 HA VAL 132 6.226 0.805 -7.786 988 HB VAL 132 HB VAL 132 4.030 1.363 -7.782 989 HG11 VAL 132 1HG1 VAL 132 3.630 3.459 -8.856 990 HG12 VAL 132 2HG1 VAL 132 4.882 3.135 -10.051 991 HG13 VAL 132 3HG1 VAL 132 5.321 3.387 -8.367 992 HG21 VAL 132 3HG2 VAL 132 4.011 0.360 -10.550 993 HG22 VAL 132 1HG2 VAL 132 2.835 1.621 -10.185 994 HG23 VAL 132 2HG2 VAL 132 2.850 0.129 -9.248 995 H VAL 133 H VAL 133 6.212 -0.265 -11.074 996 HA VAL 133 HA VAL 133 4.932 -2.778 -10.516 997 HB VAL 133 HB VAL 133 4.994 -1.534 -12.788 998 HG11 VAL 133 1HG1 VAL 133 6.845 -1.571 -14.056 999 HG12 VAL 133 2HG1 VAL 133 7.242 -3.225 -13.593 1000 HG13 VAL 133 3HG1 VAL 133 7.693 -1.886 -12.543 1001 HG21 VAL 133 3HG2 VAL 133 4.655 -3.608 -13.957 1002 HG22 VAL 133 1HG2 VAL 133 3.995 -3.755 -12.328 1003 HG23 VAL 133 2HG2 VAL 133 5.548 -4.494 -12.719 1004 H GLN 134 H GLN 134 8.244 -1.570 -10.715 1005 HA GLN 134 HA GLN 134 9.344 -4.251 -10.685 1006 HB2 GLN 134 2HB GLN 134 11.503 -2.905 -10.067 1007 HB3 GLN 134 1HB GLN 134 10.847 -2.819 -11.695 1008 HG2 GLN 134 2HG GLN 134 9.812 -0.707 -11.214 1009 HG3 GLN 134 1HG GLN 134 10.327 -0.806 -9.532 1010 HE21 GLN 134 1HE2 GLN 134 11.071 0.343 -12.576 1011 HE22 GLN 134 2HE2 GLN 134 12.737 0.774 -12.296 1012 H GLY 135 H GLY 135 8.886 -1.646 -8.353 1013 HA2 GLY 135 2HA GLY 135 10.052 -3.065 -6.168 1014 HA3 GLY 135 1HA GLY 135 9.029 -1.626 -6.057 1015 H MET 136 H MET 136 7.004 -3.253 -7.769 1016 HA MET 136 HA MET 136 5.764 -4.515 -5.435 1017 HB2 MET 136 2HB MET 136 3.681 -4.276 -6.495 1018 HB3 MET 136 1HB MET 136 4.536 -2.782 -6.825 1019 HG2 MET 136 2HG MET 136 3.787 -3.154 -8.907 1020 HG3 MET 136 1HG MET 136 5.219 -4.173 -9.008 1021 HE1 MET 136 3HE MET 136 1.545 -3.788 -8.695 1022 HE2 MET 136 1HE MET 136 0.868 -5.344 -9.179 1023 HE3 MET 136 2HE MET 136 1.734 -4.355 -10.355 1024 H LYS 137 H LYS 137 6.837 -5.220 -8.706 1025 HA LYS 137 HA LYS 137 5.824 -7.873 -8.768 1026 HB2 LYS 137 2HB LYS 137 7.030 -8.153 -10.787 1027 HB3 LYS 137 1HB LYS 137 6.462 -6.494 -10.780 1028 HG2 LYS 137 2HG LYS 137 8.781 -5.913 -9.854 1029 HG3 LYS 137 1HG LYS 137 9.241 -7.531 -10.385 1030 HD2 LYS 137 2HD LYS 137 8.142 -5.301 -12.096 1031 HD3 LYS 137 1HD LYS 137 9.783 -5.947 -12.121 1032 HE2 LYS 137 2HE LYS 137 7.379 -7.656 -12.701 1033 HE3 LYS 137 1HE LYS 137 8.186 -6.721 -13.957 1034 HZ1 LYS 137 3HZ LYS 137 10.261 -7.966 -12.852 1035 HZ2 LYS 137 1HZ LYS 137 9.389 -8.592 -14.159 1036 HZ3 LYS 137 2HZ LYS 137 9.061 -9.125 -12.588 1037 H GLU 138 H GLU 138 8.395 -6.442 -7.115 1038 HA GLU 138 HA GLU 138 9.891 -8.945 -6.879 1039 HB2 GLU 138 2HB GLU 138 10.530 -6.083 -6.532 1040 HB3 GLU 138 1HB GLU 138 11.283 -7.169 -5.368 1041 HG2 GLU 138 2HG GLU 138 12.771 -6.808 -7.218 1042 HG3 GLU 138 1HG GLU 138 12.211 -8.489 -7.224 1043 H ALA 139 H ALA 139 8.773 -6.355 -4.722 1044 HA ALA 139 HA ALA 139 9.033 -7.756 -2.327 1045 HB1 ALA 139 1HB ALA 139 8.111 -5.941 -1.341 1046 HB2 ALA 139 2HB ALA 139 6.803 -5.827 -2.518 1047 HB3 ALA 139 3HB ALA 139 8.411 -5.229 -2.927 1048 H GLN 140 H GLN 140 6.662 -8.035 -4.800 1049 HA GLN 140 HA GLN 140 4.489 -8.992 -3.328 1050 HB2 GLN 140 2HB GLN 140 3.782 -9.997 -5.508 1051 HB3 GLN 140 1HB GLN 140 4.144 -8.277 -5.568 1052 HG2 GLN 140 2HG GLN 140 5.157 -9.034 -7.470 1053 HG3 GLN 140 1HG GLN 140 6.494 -9.084 -6.327 1054 HE21 GLN 140 1HE2 GLN 140 3.769 -11.283 -6.906 1055 HE22 GLN 140 2HE2 GLN 140 4.741 -12.678 -7.208 1056 H GLU 141 H GLU 141 7.499 -10.486 -3.933 1057 HA GLU 141 HA GLU 141 6.352 -13.129 -3.371 1058 HB2 GLU 141 2HB GLU 141 7.865 -14.111 -4.722 1059 HB3 GLU 141 1HB GLU 141 7.916 -12.503 -5.451 1060 HG2 GLU 141 2HG GLU 141 9.778 -12.025 -3.804 1061 HG3 GLU 141 1HG GLU 141 9.850 -13.765 -3.563 1062 H ARG 142 H ARG 142 8.899 -10.896 -2.414 1063 HA ARG 142 HA ARG 142 9.856 -12.630 -0.324 1064 HB2 ARG 142 2HB ARG 142 11.200 -10.571 0.322 1065 HB3 ARG 142 1HB ARG 142 11.497 -11.227 -1.294 1066 HG2 ARG 142 2HG ARG 142 10.308 -9.487 -2.333 1067 HG3 ARG 142 1HG ARG 142 9.575 -8.968 -0.804 1068 HD2 ARG 142 2HD ARG 142 11.311 -7.418 -1.425 1069 HD3 ARG 142 1HD ARG 142 11.825 -8.329 0.006 1070 HE ARG 142 HE ARG 142 12.912 -9.755 -1.987 1071 HH11 ARG 142 1HH1 ARG 142 12.930 -6.327 -1.321 1072 HH12 ARG 142 2HH1 ARG 142 14.467 -6.064 -2.070 1073 HH21 ARG 142 1HH2 ARG 142 14.935 -9.408 -2.971 1074 HH22 ARG 142 2HH2 ARG 142 15.607 -7.811 -3.006 1075 H LEU 143 H LEU 143 7.474 -10.134 -0.610 1076 HA LEU 143 HA LEU 143 7.346 -9.632 2.232 1077 HB2 LEU 143 2HB LEU 143 6.912 -7.869 0.533 1078 HB3 LEU 143 1HB LEU 143 5.462 -8.747 0.046 1079 HG LEU 143 HG LEU 143 4.373 -8.290 2.097 1080 HD11 LEU 143 1HD1 LEU 143 5.952 -8.675 3.764 1081 HD12 LEU 143 2HD1 LEU 143 5.638 -6.945 3.881 1082 HD13 LEU 143 3HD1 LEU 143 7.099 -7.523 3.079 1083 HD21 LEU 143 3HD2 LEU 143 5.747 -6.045 0.754 1084 HD22 LEU 143 1HD2 LEU 143 4.969 -5.691 2.296 1085 HD23 LEU 143 2HD2 LEU 143 4.024 -6.361 0.966 1086 H THR 144 H THR 144 5.130 -11.016 -0.202 1087 HA THR 144 HA THR 144 3.119 -11.803 1.548 1088 HB THR 144 HB THR 144 2.811 -11.821 -0.865 1089 HG1 THR 144 1HG THR 144 1.443 -13.411 -0.737 1090 HG21 THR 144 3HG2 THR 144 5.115 -12.716 -1.394 1091 HG22 THR 144 1HG2 THR 144 3.774 -13.347 -2.347 1092 HG23 THR 144 2HG2 THR 144 4.458 -14.315 -1.042 1093 H GLY 145 H GLY 145 3.445 -12.939 3.345 1094 HA2 GLY 145 2HA GLY 145 3.585 -15.268 4.132 1095 HA3 GLY 145 1HA GLY 145 5.015 -15.434 3.124 1096 H ASP 146 H ASP 146 6.943 -15.101 4.034 1097 HA ASP 146 HA ASP 146 7.315 -13.275 6.221 1098 HB2 ASP 146 2HB ASP 146 7.189 -16.225 6.682 1099 HB3 ASP 146 1HB ASP 146 8.374 -15.286 7.584 1100 H ALA 147 H ALA 147 8.353 -13.825 3.517 1101 HA ALA 147 HA ALA 147 11.142 -14.523 4.077 1102 HB1 ALA 147 1HB ALA 147 11.384 -14.547 1.601 1103 HB2 ALA 147 2HB ALA 147 9.662 -14.191 1.473 1104 HB3 ALA 147 3HB ALA 147 10.196 -15.700 2.211 1105 H PHE 148 H PHE 148 9.845 -11.975 4.870 1106 HA PHE 148 HA PHE 148 11.568 -10.125 3.359 1107 HB2 PHE 148 2HB PHE 148 9.949 -8.336 4.015 1108 HB3 PHE 148 1HB PHE 148 9.261 -9.564 2.943 1109 HD1 PHE 148 1HD PHE 148 7.867 -11.407 3.997 1110 HD2 PHE 148 2HD PHE 148 8.964 -7.851 6.062 1111 HE1 PHE 148 1HE PHE 148 6.044 -11.783 5.605 1112 HE2 PHE 148 2HE PHE 148 7.143 -8.222 7.676 1113 HZ PHE 148 HZ PHE 148 5.682 -10.189 7.448 1114 H ARG 149 H ARG 149 10.257 -10.969 6.530 1115 HA ARG 149 HA ARG 149 11.539 -9.027 8.058 1116 HB2 ARG 149 2HB ARG 149 11.023 -11.856 8.958 1117 HB3 ARG 149 1HB ARG 149 11.060 -10.401 9.939 1118 HG2 ARG 149 2HG ARG 149 9.078 -9.654 8.435 1119 HG3 ARG 149 1HG ARG 149 8.935 -11.381 8.100 1120 HD2 ARG 149 2HD ARG 149 9.262 -10.745 10.932 1121 HD3 ARG 149 1HD ARG 149 7.801 -10.067 10.219 1122 HE ARG 149 HE ARG 149 8.078 -12.781 9.483 1123 HH11 ARG 149 1HH1 ARG 149 7.262 -10.766 12.213 1124 HH12 ARG 149 2HH1 ARG 149 6.253 -11.962 12.954 1125 HH21 ARG 149 1HH2 ARG 149 6.750 -14.356 10.457 1126 HH22 ARG 149 2HH2 ARG 149 5.962 -14.000 11.957 1127 H LYS 150 H LYS 150 12.702 -12.060 6.749 1128 HA LYS 150 HA LYS 150 15.152 -12.026 8.260 1129 HB2 LYS 150 2HB LYS 150 13.773 -14.000 7.010 1130 HB3 LYS 150 1HB LYS 150 15.009 -13.666 5.807 1131 HG2 LYS 150 2HG LYS 150 16.594 -13.819 7.916 1132 HG3 LYS 150 1HG LYS 150 15.267 -14.807 8.531 1133 HD2 LYS 150 2HD LYS 150 16.388 -16.462 7.476 1134 HD3 LYS 150 1HD LYS 150 15.517 -15.853 6.068 1135 HE2 LYS 150 2HE LYS 150 17.546 -14.283 5.778 1136 HE3 LYS 150 1HE LYS 150 18.370 -15.401 6.865 1137 HZ1 LYS 150 3HZ LYS 150 18.516 -15.776 4.338 1138 HZ2 LYS 150 1HZ LYS 150 16.957 -16.419 4.487 1139 HZ3 LYS 150 2HZ LYS 150 18.244 -17.110 5.341 1140 H LYS 151 H LYS 151 15.990 -9.956 7.734 1141 HA LYS 151 HA LYS 151 17.788 -9.964 5.541 1142 HB2 LYS 151 2HB LYS 151 15.323 -9.242 4.715 1143 HB3 LYS 151 1HB LYS 151 15.933 -7.676 5.229 1144 HG2 LYS 151 2HG LYS 151 17.819 -7.880 3.729 1145 HG3 LYS 151 1HG LYS 151 17.302 -9.501 3.264 1146 HD2 LYS 151 2HD LYS 151 15.079 -8.309 2.612 1147 HD3 LYS 151 1HD LYS 151 16.079 -6.854 2.597 1148 HE2 LYS 151 2HE LYS 151 16.503 -7.424 0.469 1149 HE3 LYS 151 1HE LYS 151 17.625 -8.584 1.178 1150 HZ1 LYS 151 3HZ LYS 151 16.276 -10.317 0.701 1151 HZ2 LYS 151 1HZ LYS 151 15.736 -9.283 -0.524 1152 HZ3 LYS 151 2HZ LYS 151 14.849 -9.434 0.909 1153 H HIS 152 H HIS 152 19.386 -8.437 5.775 1154 HA HIS 152 HA HIS 152 19.076 -6.558 8.025 1155 HB2 HIS 152 2HB HIS 152 21.508 -8.191 7.273 1156 HB3 HIS 152 1HB HIS 152 21.513 -6.901 8.470 1157 HD1 HIS 152 1HD HIS 152 19.523 -7.365 10.422 1158 HD2 HIS 152 2HD HIS 152 21.176 -10.608 8.417 1159 HE1 HIS 152 1HE HIS 152 19.057 -9.363 11.876 1160 HE2 HIS 152 2HE HIS 152 19.989 -11.325 10.600 1161 H LEU 153 H LEU 153 19.435 -4.494 7.549 1162 HA LEU 153 HA LEU 153 20.545 -3.839 4.925 1163 HB2 LEU 153 2HB LEU 153 19.632 -1.595 5.326 1164 HB3 LEU 153 1HB LEU 153 18.407 -2.844 5.446 1165 HG LEU 153 HG LEU 153 19.242 -2.575 8.059 1166 HD11 LEU 153 1HD1 LEU 153 20.355 -0.403 6.916 1167 HD12 LEU 153 2HD1 LEU 153 19.792 -0.458 8.586 1168 HD13 LEU 153 3HD1 LEU 153 18.764 0.236 7.334 1169 HD21 LEU 153 3HD2 LEU 153 16.934 -2.786 7.143 1170 HD22 LEU 153 1HD2 LEU 153 16.979 -1.064 6.763 1171 HD23 LEU 153 2HD2 LEU 153 17.089 -1.601 8.439 1172 H GLU 154 H GLU 154 22.668 -3.524 4.859 1173 HA GLU 154 HA GLU 154 23.885 -1.665 6.734 1174 HB2 GLU 154 2HB GLU 154 24.085 -4.174 7.503 1175 HB3 GLU 154 1HB GLU 154 25.345 -4.236 6.279 1176 HG2 GLU 154 2HG GLU 154 25.469 -1.987 8.187 1177 HG3 GLU 154 1HG GLU 154 25.804 -3.595 8.829 1178 H ASP 155 H ASP 155 24.704 -0.208 5.381 1179 HA ASP 155 HA ASP 155 26.539 -1.112 3.298 1180 HB2 ASP 155 2HB ASP 155 23.928 -0.256 2.699 1181 HB3 ASP 155 1HB ASP 155 24.976 1.097 2.284 1182 H GLU 156 H GLU 156 25.046 1.782 4.749 1183 HA GLU 156 HA GLU 156 27.742 2.908 5.060 1184 HB2 GLU 156 2HB GLU 156 25.810 3.856 3.255 1185 HB3 GLU 156 1HB GLU 156 25.785 4.991 4.609 1186 HG2 GLU 156 2HG GLU 156 28.277 4.167 3.133 1187 HG3 GLU 156 1HG GLU 156 27.333 5.613 2.770 1188 H LEU 157 H LEU 157 27.957 4.453 6.771 1189 HA LEU 157 HA LEU 157 26.220 3.844 9.008 1190 HB2 LEU 157 2HB LEU 157 28.881 5.101 8.642 1191 HB3 LEU 157 1HB LEU 157 27.955 5.609 10.042 1192 HG LEU 157 HG LEU 157 27.718 3.018 10.442 1193 HD11 LEU 157 1HD1 LEU 157 29.546 1.712 9.680 1194 HD12 LEU 157 2HD1 LEU 157 30.349 3.122 8.987 1195 HD13 LEU 157 3HD1 LEU 157 28.861 2.509 8.263 1196 HD21 LEU 157 3HD2 LEU 157 28.744 4.451 12.042 1197 HD22 LEU 157 1HD2 LEU 157 30.160 4.683 11.017 1198 HD23 LEU 157 2HD2 LEU 157 29.854 3.110 11.753 Start of MODEL 32 1 H1 MET 1 1HT MET 1 -39.506 21.262 5.676 2 H2 MET 1 2HT MET 1 -40.663 20.070 6.107 3 H3 MET 1 3HT MET 1 -40.229 20.292 4.461 4 HA MET 1 HA MET 1 -39.259 18.345 5.685 5 HB2 MET 1 2HB MET 1 -37.140 18.639 4.459 6 HB3 MET 1 1HB MET 1 -38.528 19.116 3.491 7 HG2 MET 1 2HG MET 1 -37.974 21.496 4.430 8 HG3 MET 1 1HG MET 1 -36.379 20.791 4.681 9 HE1 MET 1 2HE MET 1 -34.671 20.679 1.587 10 HE2 MET 1 3HE MET 1 -34.751 20.702 3.349 11 HE3 MET 1 1HE MET 1 -34.848 22.212 2.444 12 H HIS 2 H HIS 2 -38.038 17.670 7.353 13 HA HIS 2 HA HIS 2 -37.076 19.675 9.227 14 HB2 HIS 2 2HB HIS 2 -38.245 17.142 9.500 15 HB3 HIS 2 1HB HIS 2 -36.581 16.939 10.033 16 HD1 HIS 2 1HD HIS 2 -39.664 18.982 10.801 17 HD2 HIS 2 2HD HIS 2 -36.022 17.960 12.519 18 HE1 HIS 2 1HE HIS 2 -39.774 19.832 13.165 19 HE2 HIS 2 2HE HIS 2 -37.526 19.279 14.158 20 H HIS 3 H HIS 3 -35.795 16.819 7.534 21 HA HIS 3 HA HIS 3 -33.104 17.302 8.369 22 HB2 HIS 3 2HB HIS 3 -34.384 15.120 7.418 23 HB3 HIS 3 1HB HIS 3 -33.578 15.662 5.948 24 HD1 HIS 3 1HD HIS 3 -32.714 14.743 9.530 25 HD2 HIS 3 2HD HIS 3 -30.973 14.905 5.761 26 HE1 HIS 3 1HE HIS 3 -30.435 13.715 9.797 27 HE2 HIS 3 2HE HIS 3 -29.435 13.746 7.486 28 H HIS 4 H HIS 4 -31.434 18.254 7.285 29 HA HIS 4 HA HIS 4 -32.164 20.087 5.164 30 HB2 HIS 4 2HB HIS 4 -29.886 19.774 7.035 31 HB3 HIS 4 1HB HIS 4 -29.515 20.497 5.474 32 HD1 HIS 4 1HD HIS 4 -32.155 21.004 8.177 33 HD2 HIS 4 2HD HIS 4 -29.802 23.177 5.530 34 HE1 HIS 4 1HE HIS 4 -32.678 23.421 8.640 35 HE2 HIS 4 2HE HIS 4 -31.176 24.718 7.086 36 H HIS 5 H HIS 5 -30.944 20.269 3.180 37 HA HIS 5 HA HIS 5 -30.308 17.646 2.087 38 HB2 HIS 5 2HB HIS 5 -30.281 18.867 -0.101 39 HB3 HIS 5 1HB HIS 5 -31.811 18.975 0.763 40 HD1 HIS 5 1HD HIS 5 -28.748 21.046 -0.020 41 HD2 HIS 5 2HD HIS 5 -32.648 21.526 1.330 42 HE1 HIS 5 1HE HIS 5 -29.149 23.527 0.007 43 HE2 HIS 5 2HE HIS 5 -31.545 23.790 0.742 44 H HIS 6 H HIS 6 -28.392 17.257 0.853 45 HA HIS 6 HA HIS 6 -26.141 17.240 0.533 46 HB2 HIS 6 2HB HIS 6 -26.622 20.201 0.821 47 HB3 HIS 6 1HB HIS 6 -25.017 19.546 0.517 48 HD1 HIS 6 1HD HIS 6 -25.897 17.341 -1.534 49 HD2 HIS 6 2HD HIS 6 -27.051 21.331 -1.644 50 HE1 HIS 6 1HE HIS 6 -26.520 17.794 -3.928 51 HE2 HIS 6 2HE HIS 6 -27.293 20.192 -3.953 52 H HIS 7 H HIS 7 -24.989 16.245 2.044 53 HA HIS 7 HA HIS 7 -24.892 17.290 4.755 54 HB2 HIS 7 2HB HIS 7 -23.568 15.159 5.173 55 HB3 HIS 7 1HB HIS 7 -25.239 14.947 4.663 56 HD1 HIS 7 1HD HIS 7 -25.631 13.560 2.616 57 HD2 HIS 7 2HD HIS 7 -21.648 14.661 3.049 58 HE1 HIS 7 1HE HIS 7 -24.385 12.286 0.842 59 HE2 HIS 7 2HE HIS 7 -21.994 13.047 1.057 60 H MET 8 H MET 8 -22.817 16.902 1.968 61 HA MET 8 HA MET 8 -20.739 17.686 1.477 62 HB2 MET 8 2HB MET 8 -21.983 19.683 2.976 63 HB3 MET 8 1HB MET 8 -20.392 19.499 3.726 64 HG2 MET 8 2HG MET 8 -19.681 20.896 2.152 65 HG3 MET 8 1HG MET 8 -19.782 19.515 1.061 66 HE1 MET 8 3HE MET 8 -21.143 22.926 2.107 67 HE2 MET 8 1HE MET 8 -22.480 21.956 2.725 68 HE3 MET 8 2HE MET 8 -22.730 23.027 1.347 69 H SER 9 H SER 9 -18.479 18.073 2.492 70 HA SER 9 HA SER 9 -16.705 17.291 3.673 71 HB2 SER 9 2HB SER 9 -16.908 16.948 5.956 72 HB3 SER 9 1HB SER 9 -18.362 17.887 5.626 73 HG SER 9 HG SER 9 -19.275 16.250 6.604 74 H ASP 10 H ASP 10 -19.304 14.913 4.293 75 HA ASP 10 HA ASP 10 -19.399 12.662 3.977 76 HB2 ASP 10 2HB ASP 10 -18.405 13.823 1.559 77 HB3 ASP 10 1HB ASP 10 -17.612 12.269 1.799 78 H GLY 11 H GLY 11 -17.964 10.618 3.646 79 HA2 GLY 11 2HA GLY 11 -15.333 11.014 4.902 80 HA3 GLY 11 1HA GLY 11 -16.477 9.891 5.622 81 H HIS 12 H HIS 12 -17.531 8.697 3.360 82 HA HIS 12 HA HIS 12 -15.352 6.943 2.641 83 HB2 HIS 12 2HB HIS 12 -17.139 5.623 1.503 84 HB3 HIS 12 1HB HIS 12 -17.481 5.941 3.208 85 HD1 HIS 12 1HD HIS 12 -19.334 7.759 3.705 86 HD2 HIS 12 2HD HIS 12 -19.004 6.599 -0.271 87 HE1 HIS 12 1HE HIS 12 -21.445 8.558 2.595 88 HE2 HIS 12 2HE HIS 12 -21.183 7.920 0.171 89 H ASN 13 H ASN 13 -16.121 6.131 0.076 90 HA ASN 13 HA ASN 13 -15.794 6.589 -2.124 91 HB2 ASN 13 2HB ASN 13 -16.785 9.295 -1.226 92 HB3 ASN 13 1HB ASN 13 -16.383 8.943 -2.903 93 HD21 ASN 13 1HD2 ASN 13 -18.938 9.632 -1.600 94 HD22 ASN 13 2HD2 ASN 13 -20.030 8.365 -2.035 95 H GLY 14 H GLY 14 -14.488 8.102 -3.646 96 HA2 GLY 14 2HA GLY 14 -12.490 9.116 -4.183 97 HA3 GLY 14 1HA GLY 14 -12.371 9.635 -2.498 98 H LEU 15 H LEU 15 -11.566 7.152 -4.813 99 HA LEU 15 HA LEU 15 -9.313 6.353 -3.223 100 HB2 LEU 15 2HB LEU 15 -9.876 3.997 -3.046 101 HB3 LEU 15 1HB LEU 15 -11.041 4.983 -2.193 102 HG LEU 15 HG LEU 15 -12.388 3.404 -3.193 103 HD11 LEU 15 1HD1 LEU 15 -13.683 4.454 -4.868 104 HD12 LEU 15 2HD1 LEU 15 -12.323 5.442 -5.399 105 HD13 LEU 15 3HD1 LEU 15 -13.063 5.732 -3.824 106 HD21 LEU 15 3HD2 LEU 15 -10.247 3.264 -5.158 107 HD22 LEU 15 1HD2 LEU 15 -11.853 3.115 -5.866 108 HD23 LEU 15 2HD2 LEU 15 -11.349 2.013 -4.585 109 H GLY 16 H GLY 16 -7.683 6.086 -4.577 110 HA2 GLY 16 2HA GLY 16 -6.550 5.892 -6.588 111 HA3 GLY 16 1HA GLY 16 -7.455 4.394 -6.686 112 H LYS 17 H LYS 17 -9.041 7.498 -6.716 113 HA LYS 17 HA LYS 17 -9.791 7.025 -9.519 114 HB2 LYS 17 2HB LYS 17 -11.641 7.045 -7.865 115 HB3 LYS 17 1HB LYS 17 -11.212 8.696 -7.437 116 HG2 LYS 17 2HG LYS 17 -12.418 9.500 -9.110 117 HG3 LYS 17 1HG LYS 17 -11.566 8.485 -10.274 118 HD2 LYS 17 2HD LYS 17 -13.655 7.251 -8.541 119 HD3 LYS 17 1HD LYS 17 -14.162 8.247 -9.907 120 HE2 LYS 17 2HE LYS 17 -13.215 6.813 -11.466 121 HE3 LYS 17 1HE LYS 17 -12.119 6.094 -10.286 122 HZ1 LYS 17 3HZ LYS 17 -15.055 5.739 -10.136 123 HZ2 LYS 17 1HZ LYS 17 -13.852 4.847 -9.348 124 HZ3 LYS 17 2HZ LYS 17 -14.064 4.691 -11.019 125 H GLY 18 H GLY 18 -8.793 8.266 -10.949 126 HA2 GLY 18 2HA GLY 18 -8.726 10.728 -11.596 127 HA3 GLY 18 1HA GLY 18 -7.847 10.923 -10.075 128 H PHE 19 H PHE 19 -6.576 8.197 -10.638 129 HA PHE 19 HA PHE 19 -4.748 9.033 -12.772 130 HB2 PHE 19 2HB PHE 19 -2.807 8.448 -11.477 131 HB3 PHE 19 1HB PHE 19 -3.784 9.579 -10.531 132 HD1 PHE 19 1HD PHE 19 -2.607 6.128 -10.825 133 HD2 PHE 19 2HD PHE 19 -4.895 8.872 -8.513 134 HE1 PHE 19 1HE PHE 19 -2.616 4.534 -8.951 135 HE2 PHE 19 2HE PHE 19 -4.908 7.284 -6.635 136 HZ PHE 19 HZ PHE 19 -3.768 5.111 -6.851 137 H GLY 20 H GLY 20 -5.716 6.338 -10.653 138 HA2 GLY 20 2HA GLY 20 -5.007 4.495 -12.852 139 HA3 GLY 20 1HA GLY 20 -5.026 4.052 -11.146 140 H ASP 21 H ASP 21 -6.539 2.511 -10.993 141 HA ASP 21 HA ASP 21 -9.265 3.139 -11.071 142 HB2 ASP 21 2HB ASP 21 -8.183 2.460 -13.629 143 HB3 ASP 21 1HB ASP 21 -9.265 1.156 -13.115 144 H HIS 22 H HIS 22 -10.434 1.658 -9.995 145 HA HIS 22 HA HIS 22 -10.131 0.076 -8.150 146 HB2 HIS 22 2HB HIS 22 -11.373 -1.903 -9.159 147 HB3 HIS 22 1HB HIS 22 -12.145 -0.327 -9.310 148 HD1 HIS 22 1HD HIS 22 -12.521 0.574 -11.655 149 HD2 HIS 22 2HD HIS 22 -10.319 -2.951 -11.590 150 HE1 HIS 22 1HE HIS 22 -12.380 -0.176 -14.051 151 HE2 HIS 22 2HE HIS 22 -10.965 -2.259 -13.997 152 H ILE 23 H ILE 23 -7.875 -0.261 -7.797 153 HA ILE 23 HA ILE 23 -7.009 -2.919 -8.616 154 HB ILE 23 HB ILE 23 -5.560 -0.385 -9.319 155 HG12 ILE 23 2HG1 ILE 23 -5.723 -2.904 -10.941 156 HG13 ILE 23 1HG1 ILE 23 -7.076 -1.781 -10.891 157 HG21 ILE 23 1HG2 ILE 23 -3.758 -2.364 -9.929 158 HG22 ILE 23 2HG2 ILE 23 -4.321 -2.812 -8.319 159 HG23 ILE 23 3HG2 ILE 23 -3.637 -1.211 -8.601 160 HD11 ILE 23 3HD1 ILE 23 -4.788 -1.678 -12.515 161 HD12 ILE 23 1HD1 ILE 23 -4.686 -0.320 -11.393 162 HD13 ILE 23 2HD1 ILE 23 -6.109 -0.513 -12.417 163 H HIS 24 H HIS 24 -4.877 -0.430 -7.297 164 HA HIS 24 HA HIS 24 -4.595 -2.033 -4.891 165 HB2 HIS 24 2HB HIS 24 -3.081 0.510 -5.404 166 HB3 HIS 24 1HB HIS 24 -2.605 -0.891 -4.442 167 HD1 HIS 24 1HD HIS 24 -2.751 -3.168 -6.344 168 HD2 HIS 24 2HD HIS 24 -1.385 0.582 -7.499 169 HE1 HIS 24 1HE HIS 24 -1.323 -3.569 -8.373 170 HE2 HIS 24 2HE HIS 24 -0.596 -1.273 -9.118 171 H TRP 25 H TRP 25 -7.052 -0.577 -5.387 172 HA TRP 25 HA TRP 25 -7.186 0.898 -2.892 173 HB2 TRP 25 2HB TRP 25 -8.674 2.542 -4.500 174 HB3 TRP 25 1HB TRP 25 -7.031 2.870 -3.949 175 HD1 TRP 25 HD TRP 25 -9.033 2.027 -7.032 176 HE1 TRP 25 1HE TRP 25 -7.488 2.123 -9.077 177 HE3 TRP 25 3HE TRP 25 -4.524 2.420 -4.671 178 HZ2 TRP 25 2HZ TRP 25 -4.743 2.347 -9.642 179 HZ3 TRP 25 3HZ TRP 25 -2.490 2.573 -6.030 180 HH2 TRP 25 HH TRP 25 -2.591 2.533 -8.469 181 H ARG 26 H ARG 26 -8.620 -1.165 -5.197 182 HA ARG 26 HA ARG 26 -11.224 -0.939 -5.364 183 HB2 ARG 26 2HB ARG 26 -10.222 -3.056 -5.834 184 HB3 ARG 26 1HB ARG 26 -9.807 -3.271 -4.143 185 HG2 ARG 26 2HG ARG 26 -11.599 -4.734 -4.780 186 HG3 ARG 26 1HG ARG 26 -12.125 -3.573 -3.568 187 HD2 ARG 26 2HD ARG 26 -12.477 -2.896 -6.435 188 HD3 ARG 26 1HD ARG 26 -13.553 -4.109 -5.731 189 HE ARG 26 HE ARG 26 -13.442 -1.265 -5.080 190 HH11 ARG 26 1HH1 ARG 26 -14.790 -4.415 -4.382 191 HH12 ARG 26 2HH1 ARG 26 -16.150 -3.776 -3.524 192 HH21 ARG 26 1HH2 ARG 26 -15.230 -0.433 -3.947 193 HH22 ARG 26 2HH2 ARG 26 -16.400 -1.520 -3.276 194 H THR 27 H THR 27 -9.788 -1.860 -2.233 195 HA THR 27 HA THR 27 -11.318 -0.223 -0.622 196 HB THR 27 HB THR 27 -12.717 -2.376 0.307 197 HG1 THR 27 1HG THR 27 -13.252 -2.531 -2.420 198 HG21 THR 27 3HG2 THR 27 -14.156 -0.686 0.186 199 HG22 THR 27 1HG2 THR 27 -14.534 -1.308 -1.421 200 HG23 THR 27 2HG2 THR 27 -13.372 0.006 -1.235 201 H LEU 28 H LEU 28 -10.811 -0.436 1.554 202 HA LEU 28 HA LEU 28 -8.459 -1.971 2.108 203 HB2 LEU 28 2HB LEU 28 -9.049 0.346 3.007 204 HB3 LEU 28 1HB LEU 28 -10.128 -0.486 4.127 205 HG LEU 28 HG LEU 28 -7.195 -1.150 3.963 206 HD11 LEU 28 1HD1 LEU 28 -6.594 0.567 5.290 207 HD12 LEU 28 2HD1 LEU 28 -8.133 0.584 6.150 208 HD13 LEU 28 3HD1 LEU 28 -7.999 1.348 4.565 209 HD21 LEU 28 3HD2 LEU 28 -9.398 -1.627 5.951 210 HD22 LEU 28 1HD2 LEU 28 -7.692 -1.801 6.365 211 HD23 LEU 28 2HD2 LEU 28 -8.403 -2.815 5.110 212 H GLU 29 H GLU 29 -11.733 -1.941 3.530 213 HA GLU 29 HA GLU 29 -11.416 -4.113 5.234 214 HB2 GLU 29 2HB GLU 29 -13.347 -2.574 5.276 215 HB3 GLU 29 1HB GLU 29 -13.932 -3.283 3.777 216 HG2 GLU 29 2HG GLU 29 -13.439 -5.285 5.813 217 HG3 GLU 29 1HG GLU 29 -14.595 -4.061 6.339 218 H ASP 30 H ASP 30 -12.773 -4.103 1.937 219 HA ASP 30 HA ASP 30 -13.186 -6.854 1.721 220 HB2 ASP 30 2HB ASP 30 -13.397 -4.591 0.030 221 HB3 ASP 30 1HB ASP 30 -12.410 -5.780 -0.831 222 H GLY 31 H GLY 31 -10.289 -4.938 1.342 223 HA2 GLY 31 2HA GLY 31 -8.700 -6.790 -0.054 224 HA3 GLY 31 1HA GLY 31 -8.094 -5.519 1.013 225 H LYS 32 H LYS 32 -9.192 -6.347 3.437 226 HA LYS 32 HA LYS 32 -7.306 -8.277 4.252 227 HB2 LYS 32 2HB LYS 32 -9.302 -6.598 5.490 228 HB3 LYS 32 1HB LYS 32 -9.334 -8.207 6.198 229 HG2 LYS 32 2HG LYS 32 -7.063 -8.063 6.851 230 HG3 LYS 32 1HG LYS 32 -6.810 -6.606 5.888 231 HD2 LYS 32 2HD LYS 32 -7.289 -5.402 7.699 232 HD3 LYS 32 1HD LYS 32 -8.941 -6.013 7.608 233 HE2 LYS 32 2HE LYS 32 -8.342 -7.900 9.019 234 HE3 LYS 32 1HE LYS 32 -6.666 -7.359 9.063 235 HZ1 LYS 32 3HZ LYS 32 -9.000 -6.297 10.459 236 HZ2 LYS 32 1HZ LYS 32 -7.832 -5.180 9.954 237 HZ3 LYS 32 2HZ LYS 32 -7.400 -6.449 10.987 238 H LYS 33 H LYS 33 -10.683 -8.498 3.327 239 HA LYS 33 HA LYS 33 -11.152 -11.122 4.266 240 HB2 LYS 33 2HB LYS 33 -12.965 -9.574 3.687 241 HB3 LYS 33 1HB LYS 33 -12.479 -9.629 1.997 242 HG2 LYS 33 2HG LYS 33 -12.832 -12.290 2.680 243 HG3 LYS 33 1HG LYS 33 -14.152 -11.443 3.508 244 HD2 LYS 33 2HD LYS 33 -14.598 -10.290 1.288 245 HD3 LYS 33 1HD LYS 33 -13.503 -11.471 0.567 246 HE2 LYS 33 2HE LYS 33 -14.975 -13.178 0.801 247 HE3 LYS 33 1HE LYS 33 -15.632 -12.545 2.310 248 HZ1 LYS 33 3HZ LYS 33 -16.473 -12.059 -0.426 249 HZ2 LYS 33 1HZ LYS 33 -16.492 -10.710 0.594 250 HZ3 LYS 33 2HZ LYS 33 -17.385 -12.088 0.998 251 H GLU 34 H GLU 34 -10.575 -9.979 0.931 252 HA GLU 34 HA GLU 34 -10.275 -12.559 -0.161 253 HB2 GLU 34 2HB GLU 34 -10.777 -10.446 -1.431 254 HB3 GLU 34 1HB GLU 34 -9.078 -10.008 -1.248 255 HG2 GLU 34 2HG GLU 34 -8.440 -11.360 -2.896 256 HG3 GLU 34 1HG GLU 34 -9.451 -12.692 -2.311 257 H ALA 35 H ALA 35 -7.862 -10.168 0.888 258 HA ALA 35 HA ALA 35 -5.539 -11.427 0.142 259 HB1 ALA 35 1HB ALA 35 -4.508 -10.321 2.162 260 HB2 ALA 35 2HB ALA 35 -6.132 -9.789 2.594 261 HB3 ALA 35 3HB ALA 35 -5.406 -9.256 1.080 262 H ALA 36 H ALA 36 -7.647 -12.191 2.833 263 HA ALA 36 HA ALA 36 -5.916 -13.917 4.233 264 HB1 ALA 36 1HB ALA 36 -7.829 -13.128 5.370 265 HB2 ALA 36 2HB ALA 36 -8.071 -14.864 5.161 266 HB3 ALA 36 3HB ALA 36 -8.915 -13.723 4.113 267 H ALA 37 H ALA 37 -8.400 -14.582 1.773 268 HA ALA 37 HA ALA 37 -8.215 -17.350 1.713 269 HB1 ALA 37 1HB ALA 37 -9.015 -17.141 -0.658 270 HB2 ALA 37 2HB ALA 37 -8.850 -15.394 -0.485 271 HB3 ALA 37 3HB ALA 37 -9.981 -16.277 0.539 272 H SER 38 H SER 38 -6.875 -15.391 -0.929 273 HA SER 38 HA SER 38 -5.046 -17.348 -1.756 274 HB2 SER 38 2HB SER 38 -3.978 -15.491 -3.051 275 HB3 SER 38 1HB SER 38 -5.733 -15.590 -3.273 276 HG SER 38 HG SER 38 -5.999 -13.808 -2.044 277 H GLY 39 H GLY 39 -4.848 -14.879 0.682 278 HA2 GLY 39 2HA GLY 39 -3.328 -14.741 2.430 279 HA3 GLY 39 1HA GLY 39 -2.375 -16.017 1.665 280 H LEU 40 H LEU 40 -3.326 -13.200 -0.151 281 HA LEU 40 HA LEU 40 -0.527 -12.509 -0.474 282 HB2 LEU 40 2HB LEU 40 -1.355 -10.879 -2.150 283 HB3 LEU 40 1HB LEU 40 -1.817 -12.535 -2.487 284 HG LEU 40 HG LEU 40 -4.070 -11.989 -1.465 285 HD11 LEU 40 1HD1 LEU 40 -2.714 -9.479 -1.028 286 HD12 LEU 40 2HD1 LEU 40 -4.243 -10.061 -0.376 287 HD13 LEU 40 3HD1 LEU 40 -4.199 -9.263 -1.948 288 HD21 LEU 40 3HD2 LEU 40 -4.871 -11.523 -3.524 289 HD22 LEU 40 1HD2 LEU 40 -3.203 -11.850 -3.996 290 HD23 LEU 40 2HD2 LEU 40 -3.748 -10.186 -3.776 291 HA PRO 41 HA PRO 41 -0.439 -9.304 2.540 292 HB2 PRO 41 2HB PRO 41 1.387 -7.624 1.386 293 HB3 PRO 41 1HB PRO 41 1.810 -9.116 2.233 294 HG2 PRO 41 2HG PRO 41 1.519 -8.626 -0.706 295 HG3 PRO 41 1HG PRO 41 2.761 -9.550 0.158 296 HD2 PRO 41 2HD PRO 41 0.722 -10.761 -1.097 297 HD3 PRO 41 1HD PRO 41 1.389 -11.393 0.423 298 H LEU 42 H LEU 42 -0.645 -6.910 2.792 299 HA LEU 42 HA LEU 42 -2.742 -5.974 1.001 300 HB2 LEU 42 2HB LEU 42 -1.972 -5.486 3.790 301 HB3 LEU 42 1HB LEU 42 -2.496 -4.052 2.930 302 HG LEU 42 HG LEU 42 -4.626 -5.104 2.399 303 HD11 LEU 42 1HD1 LEU 42 -4.247 -7.393 4.189 304 HD12 LEU 42 2HD1 LEU 42 -3.331 -7.474 2.684 305 HD13 LEU 42 3HD1 LEU 42 -5.084 -7.284 2.641 306 HD21 LEU 42 3HD2 LEU 42 -4.426 -5.682 5.287 307 HD22 LEU 42 1HD2 LEU 42 -5.549 -4.643 4.409 308 HD23 LEU 42 2HD2 LEU 42 -3.918 -4.074 4.773 309 H MET 43 H MET 43 -2.753 -3.941 0.048 310 HA MET 43 HA MET 43 -0.082 -2.779 -0.391 311 HB2 MET 43 2HB MET 43 -1.052 -3.845 -2.386 312 HB3 MET 43 1HB MET 43 -2.486 -2.820 -2.242 313 HG2 MET 43 2HG MET 43 -1.036 -1.958 -3.950 314 HG3 MET 43 1HG MET 43 -1.063 -0.842 -2.588 315 HE1 MET 43 3HE MET 43 2.014 -0.017 -1.712 316 HE2 MET 43 1HE MET 43 1.857 -1.406 -0.638 317 HE3 MET 43 2HE MET 43 0.438 -0.442 -1.045 318 H VAL 44 H VAL 44 -0.190 -1.275 1.297 319 HA VAL 44 HA VAL 44 -2.435 0.542 1.454 320 HB VAL 44 HB VAL 44 0.076 0.247 3.082 321 HG11 VAL 44 1HG1 VAL 44 -0.085 2.556 3.157 322 HG12 VAL 44 2HG1 VAL 44 -1.081 2.077 4.530 323 HG13 VAL 44 3HG1 VAL 44 -1.842 2.543 3.009 324 HG21 VAL 44 3HG2 VAL 44 -2.185 -1.108 3.288 325 HG22 VAL 44 1HG2 VAL 44 -2.670 0.318 4.204 326 HG23 VAL 44 2HG2 VAL 44 -1.263 -0.614 4.706 327 H ILE 45 H ILE 45 -2.378 1.690 -0.461 328 HA ILE 45 HA ILE 45 -0.034 3.423 -0.861 329 HB ILE 45 HB ILE 45 -2.178 2.579 -2.818 330 HG12 ILE 45 2HG1 ILE 45 0.801 2.068 -2.868 331 HG13 ILE 45 1HG1 ILE 45 -0.387 0.918 -2.233 332 HG21 ILE 45 1HG2 ILE 45 0.105 3.944 -3.964 333 HG22 ILE 45 2HG2 ILE 45 -0.787 4.977 -2.851 334 HG23 ILE 45 3HG2 ILE 45 -1.616 4.221 -4.210 335 HD11 ILE 45 3HD1 ILE 45 -1.007 0.260 -4.279 336 HD12 ILE 45 1HD1 ILE 45 0.537 0.952 -4.779 337 HD13 ILE 45 2HD1 ILE 45 -0.946 1.893 -4.940 338 H ILE 46 H ILE 46 -0.384 5.272 0.215 339 HA ILE 46 HA ILE 46 -3.039 6.507 0.013 340 HB ILE 46 HB ILE 46 -0.952 7.151 2.086 341 HG12 ILE 46 2HG1 ILE 46 -3.307 5.283 2.383 342 HG13 ILE 46 1HG1 ILE 46 -1.653 4.740 2.126 343 HG21 ILE 46 1HG2 ILE 46 -3.905 7.506 2.350 344 HG22 ILE 46 2HG2 ILE 46 -2.944 8.699 1.484 345 HG23 ILE 46 3HG2 ILE 46 -2.605 8.353 3.179 346 HD11 ILE 46 3HD1 ILE 46 -2.824 5.058 4.542 347 HD12 ILE 46 1HD1 ILE 46 -1.986 6.600 4.359 348 HD13 ILE 46 2HD1 ILE 46 -1.088 5.086 4.252 349 H HIS 47 H HIS 47 -3.239 8.636 -0.604 350 HA HIS 47 HA HIS 47 -0.772 10.054 -1.327 351 HB2 HIS 47 2HB HIS 47 -2.947 10.301 -3.312 352 HB3 HIS 47 1HB HIS 47 -1.197 10.223 -3.545 353 HD1 HIS 47 1HD HIS 47 -0.926 8.398 -5.199 354 HD2 HIS 47 2HD HIS 47 -3.513 7.326 -2.125 355 HE1 HIS 47 1HE HIS 47 -1.483 5.981 -5.600 356 HE2 HIS 47 2HE HIS 47 -3.149 5.394 -3.803 357 H LYS 48 H LYS 48 -0.806 11.982 -0.422 358 HA LYS 48 HA LYS 48 -3.407 13.376 -0.225 359 HB2 LYS 48 2HB LYS 48 -1.544 12.726 1.841 360 HB3 LYS 48 1HB LYS 48 -1.605 14.472 1.676 361 HG2 LYS 48 2HG LYS 48 -4.138 14.223 1.776 362 HG3 LYS 48 1HG LYS 48 -3.832 12.577 2.335 363 HD2 LYS 48 2HD LYS 48 -2.164 14.021 3.935 364 HD3 LYS 48 1HD LYS 48 -3.516 15.138 3.733 365 HE2 LYS 48 2HE LYS 48 -4.742 12.705 4.190 366 HE3 LYS 48 1HE LYS 48 -3.343 12.669 5.263 367 HZ1 LYS 48 3HZ LYS 48 -4.134 14.378 6.504 368 HZ2 LYS 48 1HZ LYS 48 -5.617 13.756 5.977 369 HZ3 LYS 48 2HZ LYS 48 -4.950 15.111 5.216 370 H SER 49 H SER 49 -3.360 15.689 -0.401 371 HA SER 49 HA SER 49 -2.754 17.657 -1.367 372 HB2 SER 49 2HB SER 49 -0.415 16.714 -0.071 373 HB3 SER 49 1HB SER 49 0.089 17.347 -1.638 374 HG SER 49 HG SER 49 -0.032 18.905 0.138 375 H TRP 50 H TRP 50 -0.766 18.317 -3.197 376 HA TRP 50 HA TRP 50 -1.821 17.575 -5.621 377 HB2 TRP 50 2HB TRP 50 0.319 18.319 -6.631 378 HB3 TRP 50 1HB TRP 50 -0.276 19.442 -5.400 379 HD1 TRP 50 HD TRP 50 2.459 16.781 -5.937 380 HE1 TRP 50 1HE TRP 50 4.361 17.229 -4.263 381 HE3 TRP 50 3HE TRP 50 0.284 20.526 -3.218 382 HZ2 TRP 50 2HZ TRP 50 4.873 18.943 -2.079 383 HZ3 TRP 50 3HZ TRP 50 1.548 21.516 -1.353 384 HH2 TRP 50 HH TRP 50 3.794 20.739 -0.795 385 H CYS 51 H CYS 51 0.631 15.955 -3.724 386 HA CYS 51 HA CYS 51 1.851 14.048 -4.062 387 HB2 CYS 51 2HB CYS 51 0.413 12.073 -4.338 388 HB3 CYS 51 1HB CYS 51 -0.273 13.224 -3.198 389 H GLY 52 H GLY 52 3.303 14.336 -5.749 390 HA2 GLY 52 2HA GLY 52 2.657 14.418 -8.479 391 HA3 GLY 52 1HA GLY 52 4.232 13.950 -7.830 392 H ALA 53 H ALA 53 2.924 11.754 -6.283 393 HA ALA 53 HA ALA 53 3.317 9.669 -8.126 394 HB1 ALA 53 1HB ALA 53 1.834 9.524 -5.509 395 HB2 ALA 53 2HB ALA 53 3.588 9.451 -5.671 396 HB3 ALA 53 3HB ALA 53 2.584 8.186 -6.379 397 H CYS 54 H CYS 54 0.664 11.713 -7.648 398 HA CYS 54 HA CYS 54 -1.179 9.760 -8.788 399 HB2 CYS 54 2HB CYS 54 -1.969 12.527 -7.912 400 HB3 CYS 54 1HB CYS 54 -2.957 11.063 -7.988 401 H LYS 55 H LYS 55 0.478 12.747 -9.499 402 HA LYS 55 HA LYS 55 -1.081 13.389 -11.812 403 HB2 LYS 55 2HB LYS 55 0.332 15.231 -12.104 404 HB3 LYS 55 1HB LYS 55 0.269 15.004 -10.364 405 HG2 LYS 55 2HG LYS 55 2.439 13.946 -10.380 406 HG3 LYS 55 1HG LYS 55 2.496 14.034 -12.149 407 HD2 LYS 55 2HD LYS 55 3.810 15.835 -11.334 408 HD3 LYS 55 1HD LYS 55 2.297 16.537 -11.910 409 HE2 LYS 55 2HE LYS 55 1.554 16.211 -9.420 410 HE3 LYS 55 1HE LYS 55 3.291 16.188 -9.117 411 HZ1 LYS 55 3HZ LYS 55 1.822 18.414 -9.211 412 HZ2 LYS 55 1HZ LYS 55 2.357 18.343 -10.815 413 HZ3 LYS 55 2HZ LYS 55 3.478 18.369 -9.550 414 H ALA 56 H ALA 56 2.151 11.925 -11.358 415 HA ALA 56 HA ALA 56 2.514 11.611 -14.202 416 HB1 ALA 56 1HB ALA 56 4.110 10.278 -12.028 417 HB2 ALA 56 2HB ALA 56 4.372 11.947 -12.533 418 HB3 ALA 56 3HB ALA 56 4.607 10.629 -13.682 419 H LEU 57 H LEU 57 0.849 9.839 -11.839 420 HA LEU 57 HA LEU 57 1.201 7.307 -13.202 421 HB2 LEU 57 2HB LEU 57 -0.311 8.140 -10.742 422 HB3 LEU 57 1HB LEU 57 -0.465 6.534 -11.429 423 HG LEU 57 HG LEU 57 1.161 6.780 -9.498 424 HD11 LEU 57 1HD1 LEU 57 2.920 5.388 -10.631 425 HD12 LEU 57 2HD1 LEU 57 2.043 5.648 -12.138 426 HD13 LEU 57 3HD1 LEU 57 1.264 4.809 -10.796 427 HD21 LEU 57 3HD2 LEU 57 3.228 7.814 -9.778 428 HD22 LEU 57 1HD2 LEU 57 2.095 8.958 -10.497 429 HD23 LEU 57 2HD2 LEU 57 3.056 7.900 -11.531 430 H LYS 58 H LYS 58 -1.174 9.889 -13.085 431 HA LYS 58 HA LYS 58 -3.431 8.530 -13.911 432 HB2 LYS 58 2HB LYS 58 -3.473 10.899 -15.447 433 HB3 LYS 58 1HB LYS 58 -4.297 10.578 -13.935 434 HG2 LYS 58 2HG LYS 58 -1.995 11.282 -12.895 435 HG3 LYS 58 1HG LYS 58 -1.786 12.083 -14.448 436 HD2 LYS 58 2HD LYS 58 -4.421 12.581 -13.416 437 HD3 LYS 58 1HD LYS 58 -3.202 13.013 -12.213 438 HE2 LYS 58 2HE LYS 58 -2.703 13.872 -15.003 439 HE3 LYS 58 1HE LYS 58 -4.010 14.684 -14.143 440 HZ1 LYS 58 3HZ LYS 58 -1.131 14.639 -13.515 441 HZ2 LYS 58 1HZ LYS 58 -2.262 14.951 -12.295 442 HZ3 LYS 58 2HZ LYS 58 -2.172 15.966 -13.646 443 HA PRO 59 HA PRO 59 -2.393 8.869 -18.571 444 HB2 PRO 59 2HB PRO 59 -0.020 9.934 -19.335 445 HB3 PRO 59 1HB PRO 59 -1.479 10.911 -19.078 446 HG2 PRO 59 2HG PRO 59 0.839 10.442 -17.234 447 HG3 PRO 59 1HG PRO 59 0.003 11.956 -17.618 448 HD2 PRO 59 2HD PRO 59 -0.504 10.572 -15.357 449 HD3 PRO 59 1HD PRO 59 -1.768 11.490 -16.216 450 H LYS 60 H LYS 60 0.352 8.209 -16.439 451 HA LYS 60 HA LYS 60 1.350 6.188 -18.282 452 HB2 LYS 60 2HB LYS 60 3.287 6.807 -17.371 453 HB3 LYS 60 1HB LYS 60 2.467 7.726 -16.124 454 HG2 LYS 60 2HG LYS 60 2.975 6.222 -14.582 455 HG3 LYS 60 1HG LYS 60 2.342 4.898 -15.545 456 HD2 LYS 60 2HD LYS 60 4.662 4.471 -15.147 457 HD3 LYS 60 1HD LYS 60 4.484 4.927 -16.841 458 HE2 LYS 60 2HE LYS 60 4.950 7.224 -15.131 459 HE3 LYS 60 1HE LYS 60 6.242 6.032 -15.007 460 HZ1 LYS 60 3HZ LYS 60 6.779 6.257 -17.220 461 HZ2 LYS 60 1HZ LYS 60 6.352 7.845 -16.822 462 HZ3 LYS 60 2HZ LYS 60 5.261 6.858 -17.657 463 H PHE 61 H PHE 61 0.442 6.201 -14.818 464 HA PHE 61 HA PHE 61 0.330 3.442 -14.541 465 HB2 PHE 61 2HB PHE 61 0.220 5.218 -12.718 466 HB3 PHE 61 1HB PHE 61 -1.509 5.292 -13.057 467 HD1 PHE 61 2HD PHE 61 1.216 3.109 -11.878 468 HD2 PHE 61 1HD PHE 61 -2.989 3.605 -12.296 469 HE1 PHE 61 2HE PHE 61 0.846 1.174 -10.406 470 HE2 PHE 61 1HE PHE 61 -3.366 1.669 -10.826 471 HZ PHE 61 HZ PHE 61 -1.447 0.451 -9.878 472 H ALA 62 H ALA 62 -1.702 5.476 -16.358 473 HA ALA 62 HA ALA 62 -4.124 4.081 -16.240 474 HB1 ALA 62 1HB ALA 62 -4.646 5.718 -17.666 475 HB2 ALA 62 2HB ALA 62 -3.717 4.889 -18.916 476 HB3 ALA 62 3HB ALA 62 -2.937 6.099 -17.894 477 H GLU 63 H GLU 63 -1.035 3.255 -17.298 478 HA GLU 63 HA GLU 63 -1.634 1.200 -19.201 479 HB2 GLU 63 2HB GLU 63 0.535 2.661 -18.843 480 HB3 GLU 63 1HB GLU 63 0.941 1.407 -17.668 481 HG2 GLU 63 2HG GLU 63 1.927 0.462 -19.455 482 HG3 GLU 63 1HG GLU 63 0.300 -0.138 -19.766 483 H SER 64 H SER 64 -1.742 1.507 -15.869 484 HA SER 64 HA SER 64 -0.886 -0.820 -14.762 485 HB2 SER 64 2HB SER 64 -1.683 0.944 -13.400 486 HB3 SER 64 1HB SER 64 -3.292 0.867 -14.108 487 HG SER 64 HG SER 64 -2.292 -0.510 -12.026 488 H THR 65 H THR 65 -3.205 -0.691 -17.203 489 HA THR 65 HA THR 65 -5.141 -2.513 -16.564 490 HB THR 65 HB THR 65 -4.617 -3.344 -19.070 491 HG1 THR 65 1HG THR 65 -2.624 -2.048 -18.981 492 HG21 THR 65 3HG2 THR 65 -6.638 -2.165 -18.493 493 HG22 THR 65 1HG2 THR 65 -5.918 -1.460 -19.940 494 HG23 THR 65 2HG2 THR 65 -5.751 -0.645 -18.385 495 H GLU 66 H GLU 66 -1.764 -3.095 -17.331 496 HA GLU 66 HA GLU 66 -2.017 -5.965 -17.151 497 HB2 GLU 66 2HB GLU 66 0.465 -5.958 -17.309 498 HB3 GLU 66 1HB GLU 66 -0.312 -5.080 -18.632 499 HG2 GLU 66 2HG GLU 66 0.296 -3.372 -16.378 500 HG3 GLU 66 1HG GLU 66 1.730 -4.165 -17.025 501 H ILE 67 H ILE 67 -1.113 -3.272 -15.101 502 HA ILE 67 HA ILE 67 -0.090 -4.877 -12.979 503 HB ILE 67 HB ILE 67 -1.351 -2.137 -12.784 504 HG12 ILE 67 2HG1 ILE 67 1.569 -2.858 -13.125 505 HG13 ILE 67 1HG1 ILE 67 0.527 -2.248 -14.418 506 HG21 ILE 67 1HG2 ILE 67 0.217 -3.837 -10.907 507 HG22 ILE 67 2HG2 ILE 67 -1.198 -2.829 -10.601 508 HG23 ILE 67 3HG2 ILE 67 0.385 -2.084 -10.825 509 HD11 ILE 67 3HD1 ILE 67 0.270 -0.432 -12.306 510 HD12 ILE 67 1HD1 ILE 67 1.122 -0.203 -13.833 511 HD13 ILE 67 2HD1 ILE 67 1.990 -0.807 -12.422 512 H SER 68 H SER 68 -3.205 -4.332 -14.240 513 HA SER 68 HA SER 68 -4.731 -4.697 -11.863 514 HB2 SER 68 2HB SER 68 -5.300 -4.078 -14.520 515 HB3 SER 68 1HB SER 68 -6.012 -5.676 -14.299 516 HG SER 68 HG SER 68 -6.966 -4.724 -12.325 517 H GLU 69 H GLU 69 -3.110 -6.762 -14.131 518 HA GLU 69 HA GLU 69 -4.350 -9.182 -13.164 519 HB2 GLU 69 2HB GLU 69 -1.972 -8.818 -14.996 520 HB3 GLU 69 1HB GLU 69 -2.819 -10.329 -14.698 521 HG2 GLU 69 2HG GLU 69 -4.255 -7.945 -15.796 522 HG3 GLU 69 1HG GLU 69 -3.339 -9.026 -16.845 523 H LEU 70 H LEU 70 -1.299 -7.456 -12.873 524 HA LEU 70 HA LEU 70 0.135 -9.357 -11.384 525 HB2 LEU 70 2HB LEU 70 0.248 -6.367 -11.582 526 HB3 LEU 70 1HB LEU 70 1.248 -7.213 -10.402 527 HG LEU 70 HG LEU 70 1.569 -8.459 -12.969 528 HD11 LEU 70 1HD1 LEU 70 0.945 -6.466 -14.060 529 HD12 LEU 70 2HD1 LEU 70 2.709 -6.466 -14.041 530 HD13 LEU 70 3HD1 LEU 70 1.814 -5.467 -12.897 531 HD21 LEU 70 3HD2 LEU 70 3.947 -7.426 -12.506 532 HD22 LEU 70 1HD2 LEU 70 3.328 -8.756 -11.526 533 HD23 LEU 70 2HD2 LEU 70 3.253 -7.102 -10.916 534 H SER 71 H SER 71 -2.560 -7.424 -10.527 535 HA SER 71 HA SER 71 -2.343 -6.844 -7.891 536 HB2 SER 71 2HB SER 71 -4.439 -7.069 -9.694 537 HB3 SER 71 1HB SER 71 -4.868 -8.165 -8.379 538 HG SER 71 HG SER 71 -4.932 -5.475 -8.431 539 H HIS 72 H HIS 72 -2.367 -10.049 -9.215 540 HA HIS 72 HA HIS 72 -3.329 -11.533 -7.072 541 HB2 HIS 72 2HB HIS 72 -1.241 -12.116 -9.168 542 HB3 HIS 72 1HB HIS 72 -1.650 -13.304 -7.921 543 HD1 HIS 72 1HD HIS 72 -4.623 -13.252 -7.825 544 HD2 HIS 72 2HD HIS 72 -2.528 -12.919 -11.399 545 HE1 HIS 72 1HE HIS 72 -6.236 -13.962 -9.619 546 HE2 HIS 72 2HE HIS 72 -4.976 -13.664 -11.779 547 H ASN 73 H ASN 73 -0.556 -9.597 -7.362 548 HA ASN 73 HA ASN 73 1.204 -10.821 -5.539 549 HB2 ASN 73 2HB ASN 73 0.820 -7.940 -6.375 550 HB3 ASN 73 1HB ASN 73 2.188 -8.529 -5.431 551 HD21 ASN 73 1HD2 ASN 73 1.318 -7.658 -8.405 552 HD22 ASN 73 2HD2 ASN 73 2.344 -8.690 -9.355 553 H PHE 74 H PHE 74 -1.104 -8.159 -5.077 554 HA PHE 74 HA PHE 74 -1.494 -8.902 -2.296 555 HB2 PHE 74 2HB PHE 74 -1.255 -6.276 -1.874 556 HB3 PHE 74 1HB PHE 74 0.137 -7.364 -1.799 557 HD1 PHE 74 1HD PHE 74 -1.735 -5.272 -4.244 558 HD2 PHE 74 2HD PHE 74 2.021 -6.846 -3.005 559 HE1 PHE 74 1HE PHE 74 -0.615 -3.989 -6.020 560 HE2 PHE 74 2HE PHE 74 3.146 -5.565 -4.775 561 HZ PHE 74 HZ PHE 74 1.825 -4.142 -6.284 562 H VAL 75 H VAL 75 -2.995 -6.497 -1.632 563 HA VAL 75 HA VAL 75 -5.027 -6.476 -3.740 564 HB VAL 75 HB VAL 75 -5.783 -8.178 -2.160 565 HG11 VAL 75 1HG1 VAL 75 -5.447 -5.960 -0.181 566 HG12 VAL 75 2HG1 VAL 75 -4.894 -7.632 -0.089 567 HG13 VAL 75 3HG1 VAL 75 -6.606 -7.257 0.105 568 HG21 VAL 75 3HG2 VAL 75 -7.506 -5.685 -1.993 569 HG22 VAL 75 1HG2 VAL 75 -8.046 -7.357 -1.847 570 HG23 VAL 75 2HG2 VAL 75 -7.435 -6.761 -3.387 571 H MET 76 H MET 76 -6.181 -4.795 -4.001 572 HA MET 76 HA MET 76 -5.560 -2.289 -3.757 573 HB2 MET 76 2HB MET 76 -8.305 -2.283 -3.373 574 HB3 MET 76 1HB MET 76 -7.475 -2.393 -4.911 575 HG2 MET 76 2HG MET 76 -7.555 -4.977 -3.691 576 HG3 MET 76 1HG MET 76 -9.161 -4.316 -3.704 577 HE1 MET 76 3HE MET 76 -6.066 -5.411 -5.891 578 HE2 MET 76 1HE MET 76 -7.010 -6.335 -7.060 579 HE3 MET 76 2HE MET 76 -7.128 -6.709 -5.341 580 H VAL 77 H VAL 77 -4.796 -1.218 -1.965 581 HA VAL 77 HA VAL 77 -6.748 -0.643 0.090 582 HB VAL 77 HB VAL 77 -4.067 -1.854 0.758 583 HG11 VAL 77 1HG1 VAL 77 -3.978 -0.305 2.405 584 HG12 VAL 77 2HG1 VAL 77 -5.161 -1.358 3.180 585 HG13 VAL 77 3HG1 VAL 77 -5.697 0.069 2.292 586 HG21 VAL 77 3HG2 VAL 77 -5.797 -3.079 2.340 587 HG22 VAL 77 1HG2 VAL 77 -5.505 -3.608 0.682 588 HG23 VAL 77 2HG2 VAL 77 -6.909 -2.608 1.056 589 H ASN 78 H ASN 78 -6.363 1.190 -1.593 590 HA ASN 78 HA ASN 78 -4.153 2.883 -0.721 591 HB2 ASN 78 2HB ASN 78 -3.982 3.183 -2.941 592 HB3 ASN 78 1HB ASN 78 -5.584 2.538 -3.232 593 HD21 ASN 78 1HD2 ASN 78 -4.375 5.396 -1.519 594 HD22 ASN 78 2HD2 ASN 78 -5.338 6.542 -2.398 595 H LEU 79 H LEU 79 -4.595 4.124 0.905 596 HA LEU 79 HA LEU 79 -7.315 5.067 1.363 597 HB2 LEU 79 2HB LEU 79 -6.608 4.494 3.419 598 HB3 LEU 79 1HB LEU 79 -4.920 4.646 2.996 599 HG LEU 79 HG LEU 79 -5.300 7.190 3.204 600 HD11 LEU 79 1HD1 LEU 79 -7.808 6.908 3.278 601 HD12 LEU 79 2HD1 LEU 79 -7.111 7.927 4.535 602 HD13 LEU 79 3HD1 LEU 79 -7.602 6.276 4.911 603 HD21 LEU 79 3HD2 LEU 79 -4.025 6.726 4.960 604 HD22 LEU 79 1HD2 LEU 79 -4.756 5.133 5.149 605 HD23 LEU 79 2HD2 LEU 79 -5.501 6.541 5.906 606 H GLU 80 H GLU 80 -7.946 7.209 1.395 607 HA GLU 80 HA GLU 80 -6.081 9.065 0.081 608 HB2 GLU 80 2HB GLU 80 -8.654 8.335 -0.631 609 HB3 GLU 80 1HB GLU 80 -8.884 9.895 0.169 610 HG2 GLU 80 2HG GLU 80 -7.364 10.961 -1.349 611 HG3 GLU 80 1HG GLU 80 -6.930 9.403 -2.074 612 H ASP 81 H ASP 81 -7.258 11.460 0.575 613 HA ASP 81 HA ASP 81 -6.431 11.977 3.265 614 HB2 ASP 81 2HB ASP 81 -6.953 14.319 2.750 615 HB3 ASP 81 1HB ASP 81 -6.002 13.585 1.463 616 H GLU 82 H GLU 82 -9.438 11.263 1.755 617 HA GLU 82 HA GLU 82 -11.288 12.572 3.328 618 HB2 GLU 82 2HB GLU 82 -11.443 10.734 1.346 619 HB3 GLU 82 1HB GLU 82 -11.910 9.746 2.724 620 HG2 GLU 82 2HG GLU 82 -13.935 10.533 1.980 621 HG3 GLU 82 1HG GLU 82 -13.537 11.688 3.251 622 H GLU 83 H GLU 83 -9.271 9.844 4.127 623 HA GLU 83 HA GLU 83 -10.515 9.755 6.797 624 HB2 GLU 83 2HB GLU 83 -10.466 7.678 5.087 625 HB3 GLU 83 1HB GLU 83 -8.911 7.437 5.874 626 HG2 GLU 83 2HG GLU 83 -9.839 6.850 7.845 627 HG3 GLU 83 1HG GLU 83 -11.216 7.941 7.648 628 H GLU 84 H GLU 84 -9.269 10.502 8.368 629 HA GLU 84 HA GLU 84 -6.365 10.610 7.939 630 HB2 GLU 84 2HB GLU 84 -6.463 12.267 9.874 631 HB3 GLU 84 1HB GLU 84 -7.174 12.786 8.352 632 HG2 GLU 84 2HG GLU 84 -9.303 12.744 9.165 633 HG3 GLU 84 1HG GLU 84 -8.942 11.489 10.351 634 HA PRO 85 HA PRO 85 -6.718 7.241 11.041 635 HB2 PRO 85 2HB PRO 85 -4.386 6.034 10.329 636 HB3 PRO 85 1HB PRO 85 -5.926 5.736 9.497 637 HG2 PRO 85 2HG PRO 85 -3.661 7.540 8.715 638 HG3 PRO 85 1HG PRO 85 -4.621 6.435 7.702 639 HD2 PRO 85 2HD PRO 85 -5.076 9.102 7.778 640 HD3 PRO 85 1HD PRO 85 -6.383 7.917 7.536 641 H LYS 86 H LYS 86 -4.562 6.311 12.307 642 HA LYS 86 HA LYS 86 -2.905 8.565 13.144 643 HB2 LYS 86 2HB LYS 86 -3.379 8.049 15.552 644 HB3 LYS 86 1HB LYS 86 -4.745 8.744 14.671 645 HG2 LYS 86 2HG LYS 86 -5.952 7.067 15.483 646 HG3 LYS 86 1HG LYS 86 -5.085 6.021 14.358 647 HD2 LYS 86 2HD LYS 86 -3.709 5.179 15.985 648 HD3 LYS 86 1HD LYS 86 -3.812 6.635 16.976 649 HE2 LYS 86 2HE LYS 86 -6.319 5.914 17.225 650 HE3 LYS 86 1HE LYS 86 -5.691 4.325 16.787 651 HZ1 LYS 86 3HZ LYS 86 -5.778 5.221 19.280 652 HZ2 LYS 86 1HZ LYS 86 -4.229 5.750 18.854 653 HZ3 LYS 86 2HZ LYS 86 -4.623 4.109 18.742 654 H ASP 87 H ASP 87 -1.954 6.551 11.656 655 HA ASP 87 HA ASP 87 -0.158 5.209 13.514 656 HB2 ASP 87 2HB ASP 87 -2.331 3.850 12.277 657 HB3 ASP 87 1HB ASP 87 -0.839 3.277 11.516 658 H GLU 88 H GLU 88 1.557 3.957 12.220 659 HA GLU 88 HA GLU 88 2.847 5.781 10.486 660 HB2 GLU 88 2HB GLU 88 3.397 2.937 11.288 661 HB3 GLU 88 1HB GLU 88 4.393 3.754 10.091 662 HG2 GLU 88 2HG GLU 88 3.934 4.696 12.912 663 HG3 GLU 88 1HG GLU 88 5.365 3.846 12.333 664 H ASP 89 H ASP 89 0.445 3.458 9.900 665 HA ASP 89 HA ASP 89 1.009 2.373 7.455 666 HB2 ASP 89 2HB ASP 89 -1.649 3.380 8.484 667 HB3 ASP 89 1HB ASP 89 -1.456 2.341 7.064 668 H PHE 90 H PHE 90 0.567 5.725 8.093 669 HA PHE 90 HA PHE 90 -0.027 6.301 5.289 670 HB2 PHE 90 2HB PHE 90 -0.804 8.367 5.939 671 HB3 PHE 90 1HB PHE 90 -1.115 7.444 7.414 672 HD1 PHE 90 2HD PHE 90 1.157 7.376 8.968 673 HD2 PHE 90 1HD PHE 90 -0.009 10.473 6.295 674 HE1 PHE 90 2HE PHE 90 2.501 8.984 10.253 675 HE2 PHE 90 1HE PHE 90 1.334 12.088 7.574 676 HZ PHE 90 HZ PHE 90 2.591 11.345 9.557 677 H SER 91 H SER 91 2.505 6.600 7.664 678 HA SER 91 HA SER 91 4.500 6.970 5.644 679 HB2 SER 91 2HB SER 91 4.298 9.191 7.676 680 HB3 SER 91 1HB SER 91 5.283 9.133 6.205 681 HG SER 91 HG SER 91 3.271 10.421 6.144 682 HA PRO 92 HA PRO 92 6.300 4.971 9.259 683 HB2 PRO 92 2HB PRO 92 7.776 3.167 7.863 684 HB3 PRO 92 1HB PRO 92 6.047 2.970 8.192 685 HG2 PRO 92 2HG PRO 92 7.392 3.528 5.665 686 HG3 PRO 92 1HG PRO 92 5.724 3.014 5.953 687 HD2 PRO 92 2HD PRO 92 6.755 5.682 5.414 688 HD3 PRO 92 1HD PRO 92 5.072 5.125 5.465 689 H ASP 93 H ASP 93 8.679 4.761 6.630 690 HA ASP 93 HA ASP 93 10.842 5.443 8.250 691 HB2 ASP 93 2HB ASP 93 12.177 5.330 6.336 692 HB3 ASP 93 1HB ASP 93 10.812 4.277 5.942 693 H GLY 94 H GLY 94 9.054 7.482 5.941 694 HA2 GLY 94 2HA GLY 94 10.442 9.821 7.081 695 HA3 GLY 94 1HA GLY 94 9.683 9.768 5.488 696 H GLY 95 H GLY 95 8.835 11.853 6.472 697 HA2 GLY 95 2HA GLY 95 6.311 11.247 7.890 698 HA3 GLY 95 1HA GLY 95 7.275 12.683 8.249 699 H TYR 96 H TYR 96 6.933 11.564 4.963 700 HA TYR 96 HA TYR 96 5.997 14.038 4.044 701 HB2 TYR 96 2HB TYR 96 5.414 12.711 1.935 702 HB3 TYR 96 1HB TYR 96 7.099 12.688 2.465 703 HD1 TYR 96 2HD TYR 96 4.780 10.664 4.391 704 HD2 TYR 96 1HD TYR 96 7.352 10.696 1.001 705 HE1 TYR 96 2HE TYR 96 4.721 8.213 4.324 706 HE2 TYR 96 1HE TYR 96 7.288 8.241 0.926 707 HH TYR 96 HH TYR 96 6.415 6.352 3.364 708 H ILE 97 H ILE 97 3.787 13.455 2.333 709 HA ILE 97 HA ILE 97 1.679 12.486 4.069 710 HB ILE 97 HB ILE 97 0.406 14.631 3.908 711 HG12 ILE 97 2HG1 ILE 97 2.902 16.119 3.418 712 HG13 ILE 97 1HG1 ILE 97 2.253 15.279 2.009 713 HG21 ILE 97 1HG2 ILE 97 1.742 13.927 5.898 714 HG22 ILE 97 2HG2 ILE 97 1.558 15.675 5.729 715 HG23 ILE 97 3HG2 ILE 97 3.076 14.899 5.273 716 HD11 ILE 97 3HD1 ILE 97 0.533 16.690 1.802 717 HD12 ILE 97 1HD1 ILE 97 1.553 17.771 2.751 718 HD13 ILE 97 2HD1 ILE 97 0.293 16.827 3.546 719 HA PRO 98 HA PRO 98 1.340 10.214 3.143 720 HB2 PRO 98 2HB PRO 98 -1.332 9.772 1.744 721 HB3 PRO 98 1HB PRO 98 -0.678 8.897 3.157 722 HG2 PRO 98 2HG PRO 98 -2.017 11.420 3.097 723 HG3 PRO 98 1HG PRO 98 -1.343 10.549 4.505 724 HD2 PRO 98 2HD PRO 98 -0.187 12.757 3.840 725 HD3 PRO 98 1HD PRO 98 0.847 11.332 4.086 726 H ARG 99 H ARG 99 2.057 8.202 2.179 727 HA ARG 99 HA ARG 99 1.962 8.196 -0.760 728 HB2 ARG 99 2HB ARG 99 4.570 7.693 0.627 729 HB3 ARG 99 1HB ARG 99 4.266 8.147 -1.057 730 HG2 ARG 99 2HG ARG 99 3.196 10.261 0.257 731 HG3 ARG 99 1HG ARG 99 4.504 9.823 1.337 732 HD2 ARG 99 2HD ARG 99 5.302 11.459 -0.198 733 HD3 ARG 99 1HD ARG 99 6.045 9.910 -0.619 734 HE ARG 99 HE ARG 99 4.910 9.934 -2.616 735 HH11 ARG 99 1HH1 ARG 99 3.582 12.386 -0.515 736 HH12 ARG 99 2HH1 ARG 99 2.608 13.098 -1.756 737 HH21 ARG 99 1HH2 ARG 99 3.628 10.869 -4.248 738 HH22 ARG 99 2HH2 ARG 99 2.634 12.236 -3.876 739 H ILE 100 H ILE 100 3.668 6.147 -1.336 740 HA ILE 100 HA ILE 100 1.988 3.911 -0.823 741 HB ILE 100 HB ILE 100 4.670 4.130 -2.173 742 HG12 ILE 100 2HG1 ILE 100 3.256 3.607 -4.191 743 HG13 ILE 100 1HG1 ILE 100 1.839 3.746 -3.159 744 HG21 ILE 100 1HG2 ILE 100 3.998 1.793 -3.058 745 HG22 ILE 100 2HG2 ILE 100 2.995 1.714 -1.611 746 HG23 ILE 100 3HG2 ILE 100 4.739 1.920 -1.465 747 HD11 ILE 100 3HD1 ILE 100 2.029 6.021 -2.975 748 HD12 ILE 100 1HD1 ILE 100 2.631 5.756 -4.610 749 HD13 ILE 100 2HD1 ILE 100 3.765 6.011 -3.284 750 H LEU 101 H LEU 101 2.142 2.257 0.541 751 HA LEU 101 HA LEU 101 4.543 1.876 2.163 752 HB2 LEU 101 2HB LEU 101 1.852 2.716 3.089 753 HB3 LEU 101 1HB LEU 101 2.681 1.517 4.060 754 HG LEU 101 HG LEU 101 4.587 3.090 4.294 755 HD11 LEU 101 1HD1 LEU 101 4.705 4.726 2.776 756 HD12 LEU 101 2HD1 LEU 101 3.531 5.558 3.792 757 HD13 LEU 101 3HD1 LEU 101 2.983 4.627 2.401 758 HD21 LEU 101 3HD2 LEU 101 2.288 4.666 5.234 759 HD22 LEU 101 1HD2 LEU 101 3.647 3.989 6.137 760 HD23 LEU 101 2HD2 LEU 101 2.283 2.962 5.689 761 H PHE 102 H PHE 102 5.069 -0.273 1.921 762 HA PHE 102 HA PHE 102 2.956 -2.156 1.242 763 HB2 PHE 102 2HB PHE 102 5.884 -2.117 1.114 764 HB3 PHE 102 1HB PHE 102 5.225 -3.671 1.617 765 HD1 PHE 102 2HD PHE 102 3.855 -4.985 0.117 766 HD2 PHE 102 1HD PHE 102 5.475 -1.242 -1.095 767 HE1 PHE 102 2HE PHE 102 3.343 -5.526 -2.227 768 HE2 PHE 102 1HE PHE 102 4.965 -1.776 -3.442 769 HZ PHE 102 HZ PHE 102 3.897 -3.920 -4.010 770 H LEU 103 H LEU 103 2.192 -3.841 2.559 771 HA LEU 103 HA LEU 103 3.344 -4.090 5.226 772 HB2 LEU 103 2HB LEU 103 1.402 -3.509 6.417 773 HB3 LEU 103 1HB LEU 103 1.700 -2.217 5.279 774 HG LEU 103 HG LEU 103 -0.288 -4.399 4.774 775 HD11 LEU 103 1HD1 LEU 103 -1.964 -2.609 5.377 776 HD12 LEU 103 2HD1 LEU 103 -0.625 -1.768 6.158 777 HD13 LEU 103 3HD1 LEU 103 -1.097 -3.373 6.706 778 HD21 LEU 103 3HD2 LEU 103 0.458 -3.236 2.791 779 HD22 LEU 103 1HD2 LEU 103 0.163 -1.681 3.557 780 HD23 LEU 103 2HD2 LEU 103 -1.188 -2.746 3.173 781 H ASP 104 H ASP 104 2.145 -5.703 6.581 782 HA ASP 104 HA ASP 104 1.916 -8.144 5.115 783 HB2 ASP 104 2HB ASP 104 2.393 -7.389 7.795 784 HB3 ASP 104 1HB ASP 104 0.922 -8.373 7.812 785 HA PRO 105 HA PRO 105 -2.396 -8.312 4.275 786 HB2 PRO 105 2HB PRO 105 -2.894 -10.987 4.697 787 HB3 PRO 105 1HB PRO 105 -2.171 -10.315 3.225 788 HG2 PRO 105 2HG PRO 105 -0.866 -11.663 5.543 789 HG3 PRO 105 1HG PRO 105 -0.460 -11.739 3.814 790 HD2 PRO 105 2HD PRO 105 0.939 -10.248 5.608 791 HD3 PRO 105 1HD PRO 105 0.786 -9.812 3.897 792 H SER 106 H SER 106 -3.193 -7.097 5.980 793 HA SER 106 HA SER 106 -5.167 -7.990 7.543 794 HB2 SER 106 2HB SER 106 -3.949 -9.541 8.823 795 HB3 SER 106 1HB SER 106 -2.541 -8.473 8.942 796 HG SER 106 HG SER 106 -4.569 -8.725 10.642 797 H GLY 107 H GLY 107 -2.397 -5.926 7.292 798 HA2 GLY 107 2HA GLY 107 -2.916 -3.516 7.198 799 HA3 GLY 107 1HA GLY 107 -3.923 -3.775 8.626 800 H LYS 108 H LYS 108 -0.624 -4.929 7.859 801 HA LYS 108 HA LYS 108 0.258 -3.520 10.299 802 HB2 LYS 108 2HB LYS 108 0.516 -6.313 9.504 803 HB3 LYS 108 1HB LYS 108 2.048 -5.596 9.984 804 HG2 LYS 108 2HG LYS 108 0.457 -4.706 11.972 805 HG3 LYS 108 1HG LYS 108 -0.324 -6.252 11.590 806 HD2 LYS 108 2HD LYS 108 2.616 -6.332 11.767 807 HD3 LYS 108 1HD LYS 108 1.780 -5.976 13.280 808 HE2 LYS 108 2HE LYS 108 1.242 -8.337 11.481 809 HE3 LYS 108 1HE LYS 108 2.153 -8.381 12.990 810 HZ1 LYS 108 3HZ LYS 108 -0.731 -8.090 12.568 811 HZ2 LYS 108 1HZ LYS 108 -0.043 -7.340 13.919 812 HZ3 LYS 108 2HZ LYS 108 0.103 -9.012 13.715 813 H VAL 109 H VAL 109 0.649 -1.820 8.500 814 HA VAL 109 HA VAL 109 2.723 -2.016 6.643 815 HB VAL 109 HB VAL 109 1.292 0.171 7.968 816 HG11 VAL 109 1HG1 VAL 109 2.973 1.898 7.269 817 HG12 VAL 109 2HG1 VAL 109 4.147 0.590 7.112 818 HG13 VAL 109 3HG1 VAL 109 3.421 0.941 8.681 819 HG21 VAL 109 3HG2 VAL 109 2.376 -0.321 5.206 820 HG22 VAL 109 1HG2 VAL 109 1.511 1.147 5.659 821 HG23 VAL 109 2HG2 VAL 109 0.701 -0.414 5.750 822 H HIS 110 H HIS 110 4.853 -1.921 6.684 823 HA HIS 110 HA HIS 110 6.189 -1.260 9.202 824 HB2 HIS 110 2HB HIS 110 6.010 -3.921 8.031 825 HB3 HIS 110 1HB HIS 110 7.681 -3.398 8.222 826 HD1 HIS 110 1HD HIS 110 8.481 -2.892 10.675 827 HD2 HIS 110 2HD HIS 110 4.693 -4.570 10.373 828 HE1 HIS 110 1HE HIS 110 7.911 -3.684 12.991 829 HE2 HIS 110 2HE HIS 110 5.570 -4.599 12.805 830 HA PRO 111 HA PRO 111 8.808 0.914 6.367 831 HB2 PRO 111 2HB PRO 111 10.934 1.355 7.996 832 HB3 PRO 111 1HB PRO 111 9.418 2.246 8.143 833 HG2 PRO 111 2HG PRO 111 10.407 -0.082 9.733 834 HG3 PRO 111 1HG PRO 111 9.571 1.377 10.289 835 HD2 PRO 111 2HD PRO 111 8.316 -1.008 9.951 836 HD3 PRO 111 1HD PRO 111 7.499 0.555 9.719 837 H GLU 112 H GLU 112 8.811 -1.931 6.125 838 HA GLU 112 HA GLU 112 11.687 -2.486 5.773 839 HB2 GLU 112 2HB GLU 112 9.975 -3.937 7.250 840 HB3 GLU 112 1HB GLU 112 9.744 -4.720 5.693 841 HG2 GLU 112 2HG GLU 112 12.500 -4.269 6.748 842 HG3 GLU 112 1HG GLU 112 11.530 -5.618 7.340 843 H ILE 113 H ILE 113 8.780 -1.930 4.087 844 HA ILE 113 HA ILE 113 10.059 -2.922 1.634 845 HB ILE 113 HB ILE 113 7.115 -3.161 2.218 846 HG12 ILE 113 2HG1 ILE 113 8.557 -4.691 3.566 847 HG13 ILE 113 1HG1 ILE 113 7.481 -5.536 2.446 848 HG21 ILE 113 1HG2 ILE 113 8.571 -4.498 -0.031 849 HG22 ILE 113 2HG2 ILE 113 8.016 -2.834 -0.195 850 HG23 ILE 113 3HG2 ILE 113 6.856 -4.123 0.123 851 HD11 ILE 113 3HD1 ILE 113 9.295 -5.952 0.937 852 HD12 ILE 113 1HD1 ILE 113 9.766 -6.475 2.553 853 HD13 ILE 113 2HD1 ILE 113 10.384 -4.956 1.905 854 H ILE 114 H ILE 114 10.706 -1.027 0.867 855 HA ILE 114 HA ILE 114 8.743 1.117 0.454 856 HB ILE 114 HB ILE 114 10.544 2.650 0.250 857 HG12 ILE 114 2HG1 ILE 114 12.052 1.030 -1.010 858 HG13 ILE 114 1HG1 ILE 114 12.853 2.104 0.126 859 HG21 ILE 114 1HG2 ILE 114 10.591 2.751 2.456 860 HG22 ILE 114 2HG2 ILE 114 11.879 1.546 2.470 861 HG23 ILE 114 3HG2 ILE 114 10.194 1.036 2.571 862 HD11 ILE 114 3HD1 ILE 114 12.455 -0.011 1.720 863 HD12 ILE 114 1HD1 ILE 114 13.887 0.195 0.713 864 HD13 ILE 114 2HD1 ILE 114 12.560 -0.825 0.160 865 H ASN 115 H ASN 115 10.238 2.421 -1.611 866 HA ASN 115 HA ASN 115 9.389 0.796 -3.857 867 HB2 ASN 115 2HB ASN 115 8.774 3.187 -3.733 868 HB3 ASN 115 1HB ASN 115 10.491 3.611 -3.791 869 HD21 ASN 115 1HD2 ASN 115 8.646 4.570 -5.614 870 HD22 ASN 115 2HD2 ASN 115 9.002 3.896 -7.183 871 H GLU 116 H GLU 116 12.349 2.166 -2.549 872 HA GLU 116 HA GLU 116 14.533 1.565 -2.849 873 HB2 GLU 116 2HB GLU 116 13.199 -0.754 -3.498 874 HB3 GLU 116 1HB GLU 116 14.138 -0.432 -4.962 875 HG2 GLU 116 2HG GLU 116 15.258 -0.617 -2.172 876 HG3 GLU 116 1HG GLU 116 15.314 -1.892 -3.387 877 H ASN 117 H ASN 117 12.939 1.084 -6.008 878 HA ASN 117 HA ASN 117 15.015 2.289 -7.493 879 HB2 ASN 117 2HB ASN 117 12.933 0.753 -8.177 880 HB3 ASN 117 1HB ASN 117 12.244 2.333 -8.578 881 HD21 ASN 117 1HD2 ASN 117 15.099 0.307 -9.085 882 HD22 ASN 117 2HD2 ASN 117 15.435 0.883 -10.696 883 H GLY 118 H GLY 118 12.416 3.620 -5.669 884 HA2 GLY 118 2HA GLY 118 11.933 6.019 -7.010 885 HA3 GLY 118 1HA GLY 118 11.770 5.782 -5.268 886 H ASN 119 H ASN 119 12.461 8.112 -5.397 887 HA ASN 119 HA ASN 119 15.123 8.780 -6.103 888 HB2 ASN 119 2HB ASN 119 12.923 10.111 -4.568 889 HB3 ASN 119 1HB ASN 119 14.557 10.779 -4.475 890 HD21 ASN 119 1HD2 ASN 119 11.803 11.371 -5.858 891 HD22 ASN 119 2HD2 ASN 119 12.304 11.915 -7.437 892 HA PRO 120 HA PRO 120 17.293 7.636 -2.417 893 HB2 PRO 120 2HB PRO 120 19.331 9.359 -2.376 894 HB3 PRO 120 1HB PRO 120 19.135 8.208 -3.713 895 HG2 PRO 120 2HG PRO 120 18.464 11.123 -3.600 896 HG3 PRO 120 1HG PRO 120 19.199 10.187 -4.922 897 HD2 PRO 120 2HD PRO 120 16.513 10.878 -4.750 898 HD3 PRO 120 1HD PRO 120 17.167 9.551 -5.739 899 H SER 121 H SER 121 15.050 9.626 -2.035 900 HA SER 121 HA SER 121 15.569 10.253 0.688 901 HB2 SER 121 2HB SER 121 16.125 12.305 -1.336 902 HB3 SER 121 1HB SER 121 14.960 12.832 -0.111 903 HG SER 121 HG SER 121 16.684 13.177 1.043 904 H TYR 122 H TYR 122 13.657 8.841 -0.886 905 HA TYR 122 HA TYR 122 11.251 10.009 0.169 906 HB2 TYR 122 2HB TYR 122 12.028 10.436 -2.576 907 HB3 TYR 122 1HB TYR 122 10.523 9.520 -2.496 908 HD1 TYR 122 1HD TYR 122 8.847 10.538 -0.593 909 HD2 TYR 122 2HD TYR 122 11.812 12.706 -2.738 910 HE1 TYR 122 1HE TYR 122 7.623 12.627 -0.163 911 HE2 TYR 122 2HE TYR 122 10.599 14.799 -2.315 912 HH TYR 122 HH TYR 122 7.913 15.295 -1.781 913 H LYS 123 H LYS 123 12.678 7.529 -1.912 914 HA LYS 123 HA LYS 123 12.185 5.322 -2.240 915 HB2 LYS 123 2HB LYS 123 11.694 5.749 0.687 916 HB3 LYS 123 1HB LYS 123 11.440 4.169 -0.034 917 HG2 LYS 123 2HG LYS 123 14.009 5.733 0.051 918 HG3 LYS 123 1HG LYS 123 13.627 4.236 0.920 919 HD2 LYS 123 2HD LYS 123 14.499 3.111 -0.791 920 HD3 LYS 123 1HD LYS 123 13.140 3.671 -1.775 921 HE2 LYS 123 2HE LYS 123 15.139 5.730 -1.555 922 HE3 LYS 123 1HE LYS 123 15.864 4.231 -2.133 923 HZ1 LYS 123 3HZ LYS 123 13.636 4.347 -3.609 924 HZ2 LYS 123 1HZ LYS 123 15.133 4.958 -4.108 925 HZ3 LYS 123 2HZ LYS 123 13.977 5.996 -3.439 926 H TYR 124 H TYR 124 9.660 5.672 0.174 927 HA TYR 124 HA TYR 124 7.711 4.278 -1.154 928 HB2 TYR 124 2HB TYR 124 7.438 6.498 0.866 929 HB3 TYR 124 1HB TYR 124 6.100 5.462 0.356 930 HD1 TYR 124 2HD TYR 124 6.666 2.854 0.526 931 HD2 TYR 124 1HD TYR 124 8.579 5.916 2.769 932 HE1 TYR 124 2HE TYR 124 7.315 1.201 2.219 933 HE2 TYR 124 1HE TYR 124 9.241 4.264 4.468 934 HH TYR 124 HH TYR 124 8.809 0.848 3.975 935 H PHE 125 H PHE 125 8.881 7.315 -2.080 936 HA PHE 125 HA PHE 125 6.465 8.402 -3.164 937 HB2 PHE 125 2HB PHE 125 8.550 9.706 -2.526 938 HB3 PHE 125 1HB PHE 125 9.298 9.063 -3.993 939 HD1 PHE 125 1HD PHE 125 6.609 11.220 -2.692 940 HD2 PHE 125 2HD PHE 125 8.794 9.972 -6.122 941 HE1 PHE 125 1HE PHE 125 5.634 13.073 -3.981 942 HE2 PHE 125 2HE PHE 125 7.828 11.827 -7.415 943 HZ PHE 125 HZ PHE 125 6.243 13.376 -6.346 944 H TYR 126 H TYR 126 5.436 7.595 -4.891 945 HA TYR 126 HA TYR 126 7.039 6.222 -6.951 946 HB2 TYR 126 2HB TYR 126 4.243 5.701 -5.957 947 HB3 TYR 126 1HB TYR 126 4.808 5.087 -7.515 948 HD1 TYR 126 2HD TYR 126 5.186 4.853 -3.874 949 HD2 TYR 126 1HD TYR 126 6.371 3.246 -7.622 950 HE1 TYR 126 2HE TYR 126 6.125 2.892 -2.727 951 HE2 TYR 126 1HE TYR 126 7.304 1.275 -6.492 952 HH TYR 126 HH TYR 126 6.997 0.064 -4.357 953 H VAL 127 H VAL 127 7.403 7.916 -8.333 954 HA VAL 127 HA VAL 127 5.021 9.232 -9.463 955 HB VAL 127 HB VAL 127 6.534 10.826 -8.426 956 HG11 VAL 127 1HG1 VAL 127 8.812 11.123 -9.635 957 HG12 VAL 127 2HG1 VAL 127 8.584 9.440 -10.102 958 HG13 VAL 127 3HG1 VAL 127 8.643 9.880 -8.396 959 HG21 VAL 127 3HG2 VAL 127 5.383 11.167 -10.769 960 HG22 VAL 127 1HG2 VAL 127 7.055 11.259 -11.322 961 HG23 VAL 127 2HG2 VAL 127 6.468 12.384 -10.097 962 H SER 128 H SER 128 5.309 6.843 -10.446 963 HA SER 128 HA SER 128 5.455 7.015 -13.152 964 HB2 SER 128 2HB SER 128 7.698 5.936 -13.661 965 HB3 SER 128 1HB SER 128 7.770 7.625 -13.144 966 HG SER 128 HG SER 128 9.004 5.565 -12.069 967 H ALA 129 H ALA 129 3.984 5.451 -13.307 968 HA ALA 129 HA ALA 129 3.518 3.251 -11.808 969 HB1 ALA 129 1HB ALA 129 2.164 4.125 -13.742 970 HB2 ALA 129 2HB ALA 129 2.231 2.371 -13.569 971 HB3 ALA 129 3HB ALA 129 3.216 3.175 -14.792 972 H GLU 130 H GLU 130 6.105 3.586 -14.132 973 HA GLU 130 HA GLU 130 6.657 0.909 -14.643 974 HB2 GLU 130 2HB GLU 130 9.088 1.759 -14.887 975 HB3 GLU 130 1HB GLU 130 7.847 2.396 -15.972 976 HG2 GLU 130 2HG GLU 130 8.338 4.453 -15.345 977 HG3 GLU 130 1HG GLU 130 7.940 4.051 -13.667 978 H GLN 131 H GLN 131 8.333 2.940 -12.204 979 HA GLN 131 HA GLN 131 9.636 0.745 -11.025 980 HB2 GLN 131 2HB GLN 131 10.097 2.250 -9.142 981 HB3 GLN 131 1HB GLN 131 10.526 2.945 -10.700 982 HG2 GLN 131 2HG GLN 131 8.326 4.154 -10.647 983 HG3 GLN 131 1HG GLN 131 8.150 3.605 -8.981 984 HE21 GLN 131 1HE2 GLN 131 8.037 6.046 -8.814 985 HE22 GLN 131 2HE2 GLN 131 9.528 6.864 -8.506 986 H VAL 132 H VAL 132 6.428 1.988 -10.594 987 HA VAL 132 HA VAL 132 5.964 1.033 -8.000 988 HB VAL 132 HB VAL 132 3.742 1.488 -8.276 989 HG11 VAL 132 1HG1 VAL 132 4.937 3.057 -10.538 990 HG12 VAL 132 2HG1 VAL 132 5.006 3.489 -8.833 991 HG13 VAL 132 3HG1 VAL 132 3.456 3.447 -9.672 992 HG21 VAL 132 3HG2 VAL 132 2.750 0.099 -9.746 993 HG22 VAL 132 1HG2 VAL 132 4.041 0.257 -10.933 994 HG23 VAL 132 2HG2 VAL 132 2.816 1.513 -10.797 995 H VAL 133 H VAL 133 5.821 -0.530 -11.148 996 HA VAL 133 HA VAL 133 4.730 -2.973 -10.105 997 HB VAL 133 HB VAL 133 4.357 -2.388 -12.456 998 HG11 VAL 133 1HG1 VAL 133 7.289 -2.217 -12.435 999 HG12 VAL 133 2HG1 VAL 133 6.107 -1.358 -13.426 1000 HG13 VAL 133 3HG1 VAL 133 6.590 -3.001 -13.853 1001 HG21 VAL 133 3HG2 VAL 133 5.028 -4.572 -13.451 1002 HG22 VAL 133 1HG2 VAL 133 4.237 -4.723 -11.883 1003 HG23 VAL 133 2HG2 VAL 133 5.992 -4.887 -12.007 1004 H GLN 134 H GLN 134 7.928 -1.606 -10.506 1005 HA GLN 134 HA GLN 134 9.301 -4.118 -10.378 1006 HB2 GLN 134 2HB GLN 134 10.508 -1.508 -9.514 1007 HB3 GLN 134 1HB GLN 134 11.275 -2.868 -10.310 1008 HG2 GLN 134 2HG GLN 134 9.157 -1.442 -11.804 1009 HG3 GLN 134 1HG GLN 134 10.692 -0.624 -11.563 1010 HE21 GLN 134 1HE2 GLN 134 12.552 -1.433 -12.516 1011 HE22 GLN 134 2HE2 GLN 134 12.496 -2.618 -13.792 1012 H GLY 135 H GLY 135 8.588 -1.536 -8.071 1013 HA2 GLY 135 2HA GLY 135 9.683 -2.961 -5.834 1014 HA3 GLY 135 1HA GLY 135 8.697 -1.493 -5.766 1015 H MET 136 H MET 136 6.787 -3.141 -7.616 1016 HA MET 136 HA MET 136 5.280 -4.269 -5.369 1017 HB2 MET 136 2HB MET 136 4.542 -3.385 -8.138 1018 HB3 MET 136 1HB MET 136 3.485 -4.465 -7.241 1019 HG2 MET 136 2HG MET 136 3.086 -2.868 -5.567 1020 HG3 MET 136 1HG MET 136 4.431 -1.862 -6.094 1021 HE1 MET 136 3HE MET 136 0.945 -2.526 -8.971 1022 HE2 MET 136 1HE MET 136 1.933 -3.748 -8.171 1023 HE3 MET 136 2HE MET 136 2.609 -2.792 -9.489 1024 H LYS 137 H LYS 137 6.901 -5.167 -8.289 1025 HA LYS 137 HA LYS 137 5.845 -7.846 -8.317 1026 HB2 LYS 137 2HB LYS 137 7.172 -8.183 -10.287 1027 HB3 LYS 137 1HB LYS 137 6.379 -6.626 -10.405 1028 HG2 LYS 137 2HG LYS 137 8.608 -5.699 -9.492 1029 HG3 LYS 137 1HG LYS 137 9.264 -7.255 -9.999 1030 HD2 LYS 137 2HD LYS 137 7.949 -5.145 -11.699 1031 HD3 LYS 137 1HD LYS 137 9.583 -5.793 -11.834 1032 HE2 LYS 137 2HE LYS 137 8.733 -7.106 -13.433 1033 HE3 LYS 137 1HE LYS 137 8.048 -8.038 -12.107 1034 HZ1 LYS 137 3HZ LYS 137 6.392 -7.509 -13.776 1035 HZ2 LYS 137 1HZ LYS 137 6.678 -5.853 -13.574 1036 HZ3 LYS 137 2HZ LYS 137 6.014 -6.761 -12.310 1037 H GLU 138 H GLU 138 8.293 -6.235 -6.684 1038 HA GLU 138 HA GLU 138 9.897 -8.654 -6.295 1039 HB2 GLU 138 2HB GLU 138 10.514 -5.859 -6.430 1040 HB3 GLU 138 1HB GLU 138 10.972 -6.466 -4.840 1041 HG2 GLU 138 2HG GLU 138 11.897 -8.399 -6.601 1042 HG3 GLU 138 1HG GLU 138 12.237 -6.859 -7.408 1043 H ALA 139 H ALA 139 8.596 -5.986 -4.352 1044 HA ALA 139 HA ALA 139 8.844 -7.157 -1.849 1045 HB1 ALA 139 1HB ALA 139 6.770 -5.206 -2.842 1046 HB2 ALA 139 2HB ALA 139 8.315 -4.818 -2.081 1047 HB3 ALA 139 3HB ALA 139 7.043 -5.604 -1.145 1048 H GLN 140 H GLN 140 6.384 -7.542 -4.307 1049 HA GLN 140 HA GLN 140 4.381 -8.744 -2.840 1050 HB2 GLN 140 2HB GLN 140 3.664 -9.735 -4.973 1051 HB3 GLN 140 1HB GLN 140 4.059 -8.025 -5.119 1052 HG2 GLN 140 2HG GLN 140 5.029 -8.915 -6.996 1053 HG3 GLN 140 1HG GLN 140 6.381 -8.894 -5.865 1054 HE21 GLN 140 1HE2 GLN 140 7.575 -10.634 -6.141 1055 HE22 GLN 140 2HE2 GLN 140 6.993 -12.240 -6.399 1056 H GLU 141 H GLU 141 7.489 -9.978 -3.604 1057 HA GLU 141 HA GLU 141 6.692 -12.754 -3.258 1058 HB2 GLU 141 2HB GLU 141 8.314 -12.486 -4.947 1059 HB3 GLU 141 1HB GLU 141 9.285 -11.390 -3.957 1060 HG2 GLU 141 2HG GLU 141 10.131 -13.135 -2.659 1061 HG3 GLU 141 1HG GLU 141 8.875 -14.256 -3.179 1062 H ARG 142 H ARG 142 8.122 -10.167 -1.434 1063 HA ARG 142 HA ARG 142 9.128 -11.920 0.638 1064 HB2 ARG 142 2HB ARG 142 8.898 -8.912 0.747 1065 HB3 ARG 142 1HB ARG 142 9.963 -9.952 1.701 1066 HG2 ARG 142 2HG ARG 142 11.504 -10.102 0.066 1067 HG3 ARG 142 1HG ARG 142 10.290 -10.121 -1.227 1068 HD2 ARG 142 2HD ARG 142 11.095 -8.051 -1.632 1069 HD3 ARG 142 1HD ARG 142 9.982 -7.603 -0.330 1070 HE ARG 142 HE ARG 142 11.784 -7.116 0.991 1071 HH11 ARG 142 1HH1 ARG 142 12.871 -9.033 -1.716 1072 HH12 ARG 142 2HH1 ARG 142 14.551 -8.828 -1.345 1073 HH21 ARG 142 1HH2 ARG 142 13.991 -6.846 1.478 1074 HH22 ARG 142 2HH2 ARG 142 15.187 -7.587 0.468 1075 H LEU 143 H LEU 143 6.642 -9.371 0.451 1076 HA LEU 143 HA LEU 143 5.656 -9.736 3.052 1077 HB2 LEU 143 2HB LEU 143 4.342 -8.612 0.583 1078 HB3 LEU 143 1HB LEU 143 3.612 -8.563 2.185 1079 HG LEU 143 HG LEU 143 4.536 -6.454 1.988 1080 HD11 LEU 143 1HD1 LEU 143 6.018 -6.312 3.707 1081 HD12 LEU 143 2HD1 LEU 143 7.007 -7.647 3.115 1082 HD13 LEU 143 3HD1 LEU 143 5.480 -7.977 3.935 1083 HD21 LEU 143 3HD2 LEU 143 7.128 -7.510 0.912 1084 HD22 LEU 143 1HD2 LEU 143 6.489 -5.869 0.850 1085 HD23 LEU 143 2HD2 LEU 143 5.764 -7.131 -0.141 1086 H THR 144 H THR 144 5.302 -11.735 0.318 1087 HA THR 144 HA THR 144 2.818 -12.775 0.339 1088 HB THR 144 HB THR 144 3.959 -15.020 -0.080 1089 HG1 THR 144 1HG THR 144 6.274 -13.400 -0.106 1090 HG21 THR 144 3HG2 THR 144 3.607 -12.849 -1.729 1091 HG22 THR 144 1HG2 THR 144 4.014 -14.492 -2.226 1092 HG23 THR 144 2HG2 THR 144 5.293 -13.304 -1.977 1093 H GLY 145 H GLY 145 5.238 -14.684 2.078 1094 HA2 GLY 145 2HA GLY 145 3.243 -15.044 4.229 1095 HA3 GLY 145 1HA GLY 145 4.238 -16.359 3.625 1096 H ASP 146 H ASP 146 4.218 -13.391 5.488 1097 HA ASP 146 HA ASP 146 5.728 -12.468 6.941 1098 HB2 ASP 146 2HB ASP 146 5.414 -15.333 7.615 1099 HB3 ASP 146 1HB ASP 146 6.763 -14.506 8.388 1100 H ALA 147 H ALA 147 6.850 -13.075 4.336 1101 HA ALA 147 HA ALA 147 9.591 -13.883 4.964 1102 HB1 ALA 147 1HB ALA 147 9.736 -14.614 2.857 1103 HB2 ALA 147 2HB ALA 147 9.058 -13.125 2.201 1104 HB3 ALA 147 3HB ALA 147 7.988 -14.397 2.789 1105 H PHE 148 H PHE 148 8.588 -11.406 5.988 1106 HA PHE 148 HA PHE 148 10.400 -9.542 4.614 1107 HB2 PHE 148 2HB PHE 148 8.853 -7.719 4.956 1108 HB3 PHE 148 1HB PHE 148 8.008 -9.023 4.112 1109 HD1 PHE 148 2HD PHE 148 6.752 -10.708 5.708 1110 HD2 PHE 148 1HD PHE 148 7.816 -6.718 6.738 1111 HE1 PHE 148 2HE PHE 148 5.006 -10.692 7.444 1112 HE2 PHE 148 1HE PHE 148 6.075 -6.696 8.474 1113 HZ PHE 148 HZ PHE 148 4.667 -8.684 8.829 1114 H ARG 149 H ARG 149 8.730 -10.385 7.620 1115 HA ARG 149 HA ARG 149 9.777 -8.603 9.394 1116 HB2 ARG 149 2HB ARG 149 9.338 -11.563 9.811 1117 HB3 ARG 149 1HB ARG 149 9.534 -10.382 11.094 1118 HG2 ARG 149 2HG ARG 149 7.519 -9.193 10.087 1119 HG3 ARG 149 1HG ARG 149 7.262 -10.677 9.168 1120 HD2 ARG 149 2HD ARG 149 6.520 -11.806 10.964 1121 HD3 ARG 149 1HD ARG 149 7.724 -11.089 12.032 1122 HE ARG 149 HE ARG 149 5.030 -10.185 11.601 1123 HH11 ARG 149 1HH1 ARG 149 8.235 -9.246 12.612 1124 HH12 ARG 149 2HH1 ARG 149 7.679 -7.906 13.558 1125 HH21 ARG 149 1HH2 ARG 149 4.297 -8.423 12.843 1126 HH22 ARG 149 2HH2 ARG 149 5.444 -7.438 13.689 1127 H LYS 150 H LYS 150 11.755 -8.049 9.996 1128 HA LYS 150 HA LYS 150 13.867 -10.068 10.086 1129 HB2 LYS 150 2HB LYS 150 13.947 -8.867 7.868 1130 HB3 LYS 150 1HB LYS 150 14.286 -7.389 8.757 1131 HG2 LYS 150 2HG LYS 150 16.317 -8.425 9.672 1132 HG3 LYS 150 1HG LYS 150 15.982 -9.876 8.724 1133 HD2 LYS 150 2HD LYS 150 17.376 -8.842 7.258 1134 HD3 LYS 150 1HD LYS 150 15.870 -8.065 6.765 1135 HE2 LYS 150 2HE LYS 150 16.400 -6.219 8.370 1136 HE3 LYS 150 1HE LYS 150 17.977 -6.967 8.616 1137 HZ1 LYS 150 3HZ LYS 150 18.701 -6.328 6.586 1138 HZ2 LYS 150 1HZ LYS 150 17.561 -5.096 6.811 1139 HZ3 LYS 150 2HZ LYS 150 17.177 -6.443 5.861 1140 H LYS 151 H LYS 151 13.932 -9.974 12.306 1141 HA LYS 151 HA LYS 151 14.727 -7.384 13.469 1142 HB2 LYS 151 2HB LYS 151 12.731 -9.334 14.292 1143 HB3 LYS 151 1HB LYS 151 13.877 -8.988 15.580 1144 HG2 LYS 151 2HG LYS 151 13.352 -6.488 14.788 1145 HG3 LYS 151 1HG LYS 151 11.830 -7.260 14.340 1146 HD2 LYS 151 2HD LYS 151 11.235 -7.637 16.495 1147 HD3 LYS 151 1HD LYS 151 12.897 -7.925 17.014 1148 HE2 LYS 151 2HE LYS 151 12.034 -5.176 16.219 1149 HE3 LYS 151 1HE LYS 151 11.630 -5.795 17.818 1150 HZ1 LYS 151 3HZ LYS 151 13.877 -4.518 17.317 1151 HZ2 LYS 151 1HZ LYS 151 14.398 -6.086 16.951 1152 HZ3 LYS 151 2HZ LYS 151 13.776 -5.738 18.486 1153 H HIS 152 H HIS 152 15.703 -8.079 15.854 1154 HA HIS 152 HA HIS 152 18.277 -9.063 15.263 1155 HB2 HIS 152 2HB HIS 152 16.884 -8.670 17.920 1156 HB3 HIS 152 1HB HIS 152 18.596 -9.038 17.744 1157 HD1 HIS 152 1HD HIS 152 20.010 -7.170 16.381 1158 HD2 HIS 152 2HD HIS 152 16.281 -6.018 17.809 1159 HE1 HIS 152 1HE HIS 152 20.023 -4.656 16.342 1160 HE2 HIS 152 2HE HIS 152 17.727 -3.982 17.130 1161 H LEU 153 H LEU 153 19.138 -10.813 17.030 1162 HA LEU 153 HA LEU 153 19.303 -13.025 17.525 1163 HB2 LEU 153 2HB LEU 153 16.872 -12.298 18.436 1164 HB3 LEU 153 1HB LEU 153 16.397 -13.522 17.274 1165 HG LEU 153 HG LEU 153 18.248 -14.941 18.530 1166 HD11 LEU 153 1HD1 LEU 153 17.722 -14.250 21.059 1167 HD12 LEU 153 2HD1 LEU 153 17.697 -12.652 20.314 1168 HD13 LEU 153 3HD1 LEU 153 19.132 -13.669 20.175 1169 HD21 LEU 153 3HD2 LEU 153 15.477 -14.435 19.609 1170 HD22 LEU 153 1HD2 LEU 153 16.475 -15.849 19.952 1171 HD23 LEU 153 2HD2 LEU 153 15.903 -15.552 18.311 1172 H GLU 154 H GLU 154 20.250 -14.102 15.916 1173 HA GLU 154 HA GLU 154 18.540 -15.101 13.740 1174 HB2 GLU 154 2HB GLU 154 21.213 -13.756 13.569 1175 HB3 GLU 154 1HB GLU 154 20.762 -14.954 12.363 1176 HG2 GLU 154 2HG GLU 154 19.091 -13.646 11.487 1177 HG3 GLU 154 1HG GLU 154 18.884 -12.726 12.975 1178 H ASP 155 H ASP 155 21.595 -15.522 15.499 1179 HA ASP 155 HA ASP 155 21.878 -18.253 14.623 1180 HB2 ASP 155 2HB ASP 155 23.620 -16.334 15.599 1181 HB3 ASP 155 1HB ASP 155 23.490 -17.475 16.934 1182 H GLU 156 H GLU 156 21.232 -20.054 15.641 1183 HA GLU 156 HA GLU 156 20.151 -19.786 18.370 1184 HB2 GLU 156 2HB GLU 156 18.532 -20.127 16.291 1185 HB3 GLU 156 1HB GLU 156 19.003 -21.817 16.508 1186 HG2 GLU 156 2HG GLU 156 17.000 -21.496 17.715 1187 HG3 GLU 156 1HG GLU 156 18.297 -21.600 18.904 1188 H LEU 157 H LEU 157 20.849 -21.234 19.823 1189 HA LEU 157 HA LEU 157 21.961 -23.776 18.959 1190 HB2 LEU 157 2HB LEU 157 23.642 -21.591 19.426 1191 HB3 LEU 157 1HB LEU 157 23.759 -22.564 20.881 1192 HG LEU 157 HG LEU 157 24.073 -24.507 19.061 1193 HD11 LEU 157 1HD1 LEU 157 24.103 -23.513 17.027 1194 HD12 LEU 157 2HD1 LEU 157 25.801 -23.279 17.443 1195 HD13 LEU 157 3HD1 LEU 157 24.649 -21.963 17.666 1196 HD21 LEU 157 3HD2 LEU 157 26.211 -24.611 19.814 1197 HD22 LEU 157 1HD2 LEU 157 25.593 -23.426 20.967 1198 HD23 LEU 157 2HD2 LEU 157 26.505 -22.892 19.554 Start of MODEL 33 1 H1 MET 1 1HT MET 1 -28.238 -14.516 26.668 2 H2 MET 1 2HT MET 1 -26.903 -15.369 27.328 3 H3 MET 1 3HT MET 1 -27.646 -15.919 25.881 4 HA MET 1 HA MET 1 -26.035 -13.501 26.311 5 HB2 MET 1 2HB MET 1 -25.798 -15.976 24.592 6 HB3 MET 1 1HB MET 1 -24.758 -14.569 24.414 7 HG2 MET 1 2HG MET 1 -25.019 -15.981 27.039 8 HG3 MET 1 1HG MET 1 -23.912 -16.555 25.794 9 HE1 MET 1 2HE MET 1 -22.226 -14.869 28.861 10 HE2 MET 1 3HE MET 1 -21.309 -15.655 27.576 11 HE3 MET 1 1HE MET 1 -22.824 -16.362 28.138 12 H HIS 2 H HIS 2 -25.888 -12.037 24.566 13 HA HIS 2 HA HIS 2 -27.827 -12.310 22.402 14 HB2 HIS 2 2HB HIS 2 -28.626 -9.968 22.788 15 HB3 HIS 2 1HB HIS 2 -29.105 -11.104 24.045 16 HD1 HIS 2 1HD HIS 2 -27.976 -10.836 26.376 17 HD2 HIS 2 2HD HIS 2 -26.933 -7.917 23.608 18 HE1 HIS 2 1HE HIS 2 -26.869 -9.014 27.707 19 HE2 HIS 2 2HE HIS 2 -26.167 -7.298 26.001 20 H HIS 3 H HIS 3 -25.324 -10.250 23.859 21 HA HIS 3 HA HIS 3 -23.850 -10.180 21.401 22 HB2 HIS 3 2HB HIS 3 -25.691 -8.016 22.039 23 HB3 HIS 3 1HB HIS 3 -24.037 -7.443 21.857 24 HD1 HIS 3 1HD HIS 3 -26.819 -9.076 19.941 25 HD2 HIS 3 2HD HIS 3 -23.038 -7.490 19.262 26 HE1 HIS 3 1HE HIS 3 -26.589 -8.931 17.440 27 HE2 HIS 3 2HE HIS 3 -24.261 -8.050 17.053 28 H HIS 4 H HIS 4 -21.725 -9.567 21.694 29 HA HIS 4 HA HIS 4 -20.727 -8.112 23.875 30 HB2 HIS 4 2HB HIS 4 -19.620 -9.990 25.112 31 HB3 HIS 4 1HB HIS 4 -21.373 -9.957 25.275 32 HD1 HIS 4 1HD HIS 4 -22.710 -11.825 24.010 33 HD2 HIS 4 2HD HIS 4 -18.577 -12.256 23.909 34 HE1 HIS 4 1HE HIS 4 -22.298 -14.185 23.241 35 HE2 HIS 4 2HE HIS 4 -19.790 -14.393 23.105 36 H HIS 5 H HIS 5 -19.112 -7.193 22.795 37 HA HIS 5 HA HIS 5 -17.209 -6.906 21.585 38 HB2 HIS 5 2HB HIS 5 -16.838 -9.323 23.079 39 HB3 HIS 5 1HB HIS 5 -16.070 -9.504 21.505 40 HD1 HIS 5 1HD HIS 5 -14.544 -7.196 20.901 41 HD2 HIS 5 2HD HIS 5 -15.155 -8.236 24.876 42 HE1 HIS 5 1HE HIS 5 -12.720 -6.034 22.187 43 HE2 HIS 5 2HE HIS 5 -13.051 -6.761 24.576 44 H HIS 6 H HIS 6 -15.960 -7.801 19.618 45 HA HIS 6 HA HIS 6 -15.983 -8.359 17.415 46 HB2 HIS 6 2HB HIS 6 -17.721 -10.438 18.652 47 HB3 HIS 6 1HB HIS 6 -17.720 -10.309 16.897 48 HD1 HIS 6 1HD HIS 6 -15.801 -11.649 19.709 49 HD2 HIS 6 2HD HIS 6 -15.107 -10.739 15.715 50 HE1 HIS 6 1HE HIS 6 -13.669 -12.839 19.109 51 HE2 HIS 6 2HE HIS 6 -13.311 -12.337 16.666 52 H HIS 7 H HIS 7 -17.515 -8.593 15.446 53 HA HIS 7 HA HIS 7 -19.074 -7.628 14.100 54 HB2 HIS 7 2HB HIS 7 -20.542 -7.914 16.689 55 HB3 HIS 7 1HB HIS 7 -21.284 -6.980 15.394 56 HD1 HIS 7 1HD HIS 7 -21.336 -10.241 16.695 57 HD2 HIS 7 2HD HIS 7 -21.139 -8.699 12.841 58 HE1 HIS 7 1HE HIS 7 -22.104 -12.100 15.185 59 HE2 HIS 7 2HE HIS 7 -21.893 -11.173 12.853 60 H MET 8 H MET 8 -18.503 -5.714 13.311 61 HA MET 8 HA MET 8 -19.070 -3.321 14.900 62 HB2 MET 8 2HB MET 8 -16.427 -4.274 14.150 63 HB3 MET 8 1HB MET 8 -16.747 -2.659 13.503 64 HG2 MET 8 2HG MET 8 -16.171 -1.849 15.477 65 HG3 MET 8 1HG MET 8 -17.645 -2.560 16.131 66 HE1 MET 8 3HE MET 8 -14.193 -3.191 14.970 67 HE2 MET 8 1HE MET 8 -13.585 -4.562 15.896 68 HE3 MET 8 2HE MET 8 -13.531 -2.940 16.584 69 H SER 9 H SER 9 -18.332 -1.357 13.250 70 HA SER 9 HA SER 9 -19.119 -1.891 10.528 71 HB2 SER 9 2HB SER 9 -20.922 -0.340 12.391 72 HB3 SER 9 1HB SER 9 -21.019 -0.214 10.634 73 HG SER 9 HG SER 9 -21.267 -2.580 10.695 74 H ASP 10 H ASP 10 -18.203 -0.467 9.172 75 HA ASP 10 HA ASP 10 -17.752 2.260 9.745 76 HB2 ASP 10 2HB ASP 10 -15.613 0.355 10.477 77 HB3 ASP 10 1HB ASP 10 -15.093 1.756 9.544 78 H GLY 11 H GLY 11 -16.834 3.397 7.973 79 HA2 GLY 11 2HA GLY 11 -15.702 2.157 5.708 80 HA3 GLY 11 1HA GLY 11 -17.430 2.339 5.450 81 H HIS 12 H HIS 12 -15.692 3.590 3.766 82 HA HIS 12 HA HIS 12 -16.543 6.277 3.918 83 HB2 HIS 12 2HB HIS 12 -14.219 7.291 4.102 84 HB3 HIS 12 1HB HIS 12 -14.904 6.643 5.598 85 HD1 HIS 12 1HD HIS 12 -12.937 5.807 6.857 86 HD2 HIS 12 2HD HIS 12 -12.830 4.659 2.864 87 HE1 HIS 12 1HE HIS 12 -10.957 4.271 6.652 88 HE2 HIS 12 2HE HIS 12 -10.861 3.657 4.210 89 H ASN 13 H ASN 13 -15.005 7.640 2.302 90 HA ASN 13 HA ASN 13 -14.426 5.904 -0.005 91 HB2 ASN 13 2HB ASN 13 -16.060 8.434 0.080 92 HB3 ASN 13 1HB ASN 13 -15.305 7.874 -1.410 93 HD21 ASN 13 1HD2 ASN 13 -15.712 5.428 -1.775 94 HD22 ASN 13 2HD2 ASN 13 -17.359 4.933 -1.602 95 H GLY 14 H GLY 14 -13.387 7.505 -1.794 96 HA2 GLY 14 2HA GLY 14 -11.790 9.212 -2.213 97 HA3 GLY 14 1HA GLY 14 -11.433 9.260 -0.483 98 H LEU 15 H LEU 15 -10.768 7.708 -3.520 99 HA LEU 15 HA LEU 15 -8.233 6.783 -2.557 100 HB2 LEU 15 2HB LEU 15 -8.731 4.382 -3.320 101 HB3 LEU 15 1HB LEU 15 -9.302 4.888 -1.745 102 HG LEU 15 HG LEU 15 -10.903 3.497 -3.111 103 HD11 LEU 15 1HD1 LEU 15 -11.378 5.382 -1.269 104 HD12 LEU 15 2HD1 LEU 15 -12.651 4.430 -2.034 105 HD13 LEU 15 3HD1 LEU 15 -12.289 6.054 -2.620 106 HD21 LEU 15 3HD2 LEU 15 -12.069 4.438 -4.929 107 HD22 LEU 15 1HD2 LEU 15 -10.360 4.732 -5.254 108 HD23 LEU 15 2HD2 LEU 15 -11.379 6.037 -4.646 109 H GLY 16 H GLY 16 -7.476 5.051 -4.486 110 HA2 GLY 16 2HA GLY 16 -6.652 6.493 -6.614 111 HA3 GLY 16 1HA GLY 16 -6.977 4.774 -6.716 112 H LYS 17 H LYS 17 -8.142 7.970 -7.398 113 HA LYS 17 HA LYS 17 -10.212 6.813 -9.143 114 HB2 LYS 17 2HB LYS 17 -10.379 9.089 -7.214 115 HB3 LYS 17 1HB LYS 17 -11.312 9.182 -8.702 116 HG2 LYS 17 2HG LYS 17 -12.228 6.890 -8.079 117 HG3 LYS 17 1HG LYS 17 -11.535 7.178 -6.483 118 HD2 LYS 17 2HD LYS 17 -13.076 9.447 -7.453 119 HD3 LYS 17 1HD LYS 17 -14.038 7.971 -7.354 120 HE2 LYS 17 2HE LYS 17 -12.985 7.722 -5.007 121 HE3 LYS 17 1HE LYS 17 -12.589 9.432 -5.177 122 HZ1 LYS 17 3HZ LYS 17 -15.201 8.148 -4.880 123 HZ2 LYS 17 1HZ LYS 17 -15.118 9.551 -5.823 124 HZ3 LYS 17 2HZ LYS 17 -14.622 9.588 -4.206 125 H GLY 18 H GLY 18 -8.412 6.883 -10.694 126 HA2 GLY 18 2HA GLY 18 -8.543 8.533 -12.738 127 HA3 GLY 18 1HA GLY 18 -7.655 9.561 -11.608 128 H PHE 19 H PHE 19 -6.288 7.232 -10.430 129 HA PHE 19 HA PHE 19 -3.992 7.222 -12.097 130 HB2 PHE 19 2HB PHE 19 -4.433 5.221 -9.902 131 HB3 PHE 19 1HB PHE 19 -2.933 6.016 -10.400 132 HD1 PHE 19 2HD PHE 19 -4.105 8.842 -10.495 133 HD2 PHE 19 1HD PHE 19 -4.304 5.736 -7.593 134 HE1 PHE 19 2HE PHE 19 -4.421 10.523 -8.721 135 HE2 PHE 19 1HE PHE 19 -4.621 7.408 -5.816 136 HZ PHE 19 HZ PHE 19 -4.679 9.804 -6.379 137 H GLY 20 H GLY 20 -6.312 4.678 -11.207 138 HA2 GLY 20 2HA GLY 20 -5.885 3.431 -13.809 139 HA3 GLY 20 1HA GLY 20 -5.470 2.465 -12.394 140 H ASP 21 H ASP 21 -7.068 1.793 -10.985 141 HA ASP 21 HA ASP 21 -9.769 2.378 -11.049 142 HB2 ASP 21 2HB ASP 21 -9.254 1.234 -13.421 143 HB3 ASP 21 1HB ASP 21 -9.482 -0.234 -12.462 144 H HIS 22 H HIS 22 -10.491 -0.595 -10.886 145 HA HIS 22 HA HIS 22 -10.132 -0.913 -8.113 146 HB2 HIS 22 2HB HIS 22 -10.913 -3.270 -8.542 147 HB3 HIS 22 1HB HIS 22 -11.977 -2.018 -9.175 148 HD1 HIS 22 1HD HIS 22 -12.052 -1.735 -11.769 149 HD2 HIS 22 2HD HIS 22 -9.762 -4.937 -10.442 150 HE1 HIS 22 1HE HIS 22 -11.660 -3.167 -13.797 151 HE2 HIS 22 2HE HIS 22 -10.186 -5.043 -12.990 152 H ILE 23 H ILE 23 -7.878 -0.629 -7.771 153 HA ILE 23 HA ILE 23 -6.325 -3.057 -8.324 154 HB ILE 23 HB ILE 23 -5.399 -0.213 -8.754 155 HG12 ILE 23 2HG1 ILE 23 -4.999 -2.176 -10.883 156 HG13 ILE 23 1HG1 ILE 23 -6.695 -1.944 -10.475 157 HG21 ILE 23 1HG2 ILE 23 -3.866 -2.527 -8.049 158 HG22 ILE 23 2HG2 ILE 23 -3.339 -0.862 -8.311 159 HG23 ILE 23 3HG2 ILE 23 -3.437 -1.979 -9.671 160 HD11 ILE 23 3HD1 ILE 23 -5.427 0.601 -10.646 161 HD12 ILE 23 1HD1 ILE 23 -6.736 -0.061 -11.627 162 HD13 ILE 23 2HD1 ILE 23 -5.057 -0.335 -12.094 163 H HIS 24 H HIS 24 -4.579 -0.419 -6.946 164 HA HIS 24 HA HIS 24 -4.447 -1.834 -4.425 165 HB2 HIS 24 2HB HIS 24 -2.992 0.722 -5.044 166 HB3 HIS 24 1HB HIS 24 -2.546 -0.555 -3.910 167 HD1 HIS 24 1HD HIS 24 -3.027 -2.862 -6.107 168 HD2 HIS 24 2HD HIS 24 -0.603 0.491 -6.471 169 HE1 HIS 24 1HE HIS 24 -1.323 -3.453 -7.856 170 HE2 HIS 24 2HE HIS 24 0.165 -1.427 -8.025 171 H TRP 25 H TRP 25 -6.789 -0.118 -5.441 172 HA TRP 25 HA TRP 25 -7.237 1.261 -2.903 173 HB2 TRP 25 2HB TRP 25 -8.531 2.928 -4.625 174 HB3 TRP 25 1HB TRP 25 -6.925 3.226 -3.955 175 HD1 TRP 25 HD TRP 25 -8.710 2.527 -7.193 176 HE1 TRP 25 1HE TRP 25 -7.008 2.599 -9.107 177 HE3 TRP 25 3HE TRP 25 -4.413 2.616 -4.472 178 HZ2 TRP 25 2HZ TRP 25 -4.199 2.699 -9.437 179 HZ3 TRP 25 3HZ TRP 25 -2.267 2.707 -5.630 180 HH2 TRP 25 HH TRP 25 -2.151 2.744 -8.074 181 H ARG 26 H ARG 26 -8.291 -0.945 -5.145 182 HA ARG 26 HA ARG 26 -10.902 -0.608 -5.660 183 HB2 ARG 26 2HB ARG 26 -9.866 -2.669 -6.280 184 HB3 ARG 26 1HB ARG 26 -9.509 -3.036 -4.615 185 HG2 ARG 26 2HG ARG 26 -11.249 -4.469 -5.391 186 HG3 ARG 26 1HG ARG 26 -11.879 -3.382 -4.159 187 HD2 ARG 26 2HD ARG 26 -12.066 -2.696 -7.059 188 HD3 ARG 26 1HD ARG 26 -13.223 -3.820 -6.334 189 HE ARG 26 HE ARG 26 -12.860 -1.011 -5.507 190 HH11 ARG 26 1HH1 ARG 26 -14.866 -3.861 -5.830 191 HH12 ARG 26 2HH1 ARG 26 -16.297 -3.057 -5.284 192 HH21 ARG 26 1HH2 ARG 26 -14.744 0.031 -4.790 193 HH22 ARG 26 2HH2 ARG 26 -16.230 -0.854 -4.694 194 H THR 27 H THR 27 -9.594 -1.447 -2.446 195 HA THR 27 HA THR 27 -11.193 -0.080 -0.815 196 HB THR 27 HB THR 27 -13.269 -0.832 -1.625 197 HG1 THR 27 1HG THR 27 -14.111 -1.662 0.157 198 HG21 THR 27 3HG2 THR 27 -13.275 -2.646 -2.914 199 HG22 THR 27 1HG2 THR 27 -13.511 -3.538 -1.412 200 HG23 THR 27 2HG2 THR 27 -11.890 -3.357 -2.085 201 H LEU 28 H LEU 28 -10.740 -0.501 1.309 202 HA LEU 28 HA LEU 28 -8.714 -2.445 1.836 203 HB2 LEU 28 2HB LEU 28 -8.930 -0.174 2.926 204 HB3 LEU 28 1HB LEU 28 -10.266 -0.842 3.866 205 HG LEU 28 HG LEU 28 -7.540 -2.112 3.914 206 HD11 LEU 28 1HD1 LEU 28 -8.485 -0.021 5.856 207 HD12 LEU 28 2HD1 LEU 28 -7.427 0.339 4.493 208 HD13 LEU 28 3HD1 LEU 28 -6.894 -0.774 5.754 209 HD21 LEU 28 3HD2 LEU 28 -8.814 -3.580 5.046 210 HD22 LEU 28 1HD2 LEU 28 -10.095 -2.404 5.337 211 HD23 LEU 28 2HD2 LEU 28 -8.660 -2.416 6.361 212 H GLU 29 H GLU 29 -12.166 -2.254 2.349 213 HA GLU 29 HA GLU 29 -12.440 -4.327 4.224 214 HB2 GLU 29 2HB GLU 29 -14.151 -2.604 2.834 215 HB3 GLU 29 1HB GLU 29 -14.660 -4.220 2.363 216 HG2 GLU 29 2HG GLU 29 -14.587 -4.706 4.909 217 HG3 GLU 29 1HG GLU 29 -14.652 -2.951 5.063 218 H ASP 30 H ASP 30 -13.226 -4.509 0.746 219 HA ASP 30 HA ASP 30 -13.406 -7.282 0.613 220 HB2 ASP 30 2HB ASP 30 -12.612 -5.317 -1.550 221 HB3 ASP 30 1HB ASP 30 -13.058 -7.005 -1.837 222 H GLY 31 H GLY 31 -10.612 -5.188 0.492 223 HA2 GLY 31 2HA GLY 31 -8.766 -7.064 -0.559 224 HA3 GLY 31 1HA GLY 31 -8.359 -5.626 0.386 225 H LYS 32 H LYS 32 -9.889 -6.408 2.714 226 HA LYS 32 HA LYS 32 -7.901 -8.001 3.998 227 HB2 LYS 32 2HB LYS 32 -9.445 -6.130 4.969 228 HB3 LYS 32 1HB LYS 32 -10.586 -7.445 5.212 229 HG2 LYS 32 2HG LYS 32 -8.033 -8.249 6.193 230 HG3 LYS 32 1HG LYS 32 -8.436 -6.666 6.860 231 HD2 LYS 32 2HD LYS 32 -10.427 -8.910 6.862 232 HD3 LYS 32 1HD LYS 32 -9.212 -8.764 8.133 233 HE2 LYS 32 2HE LYS 32 -10.243 -7.008 9.086 234 HE3 LYS 32 1HE LYS 32 -10.654 -6.282 7.532 235 HZ1 LYS 32 3HZ LYS 32 -12.724 -6.898 8.024 236 HZ2 LYS 32 1HZ LYS 32 -12.235 -7.968 9.240 237 HZ3 LYS 32 2HZ LYS 32 -12.243 -8.470 7.625 238 H LYS 33 H LYS 33 -11.274 -8.556 3.050 239 HA LYS 33 HA LYS 33 -11.428 -11.190 4.086 240 HB2 LYS 33 2HB LYS 33 -13.382 -9.714 3.521 241 HB3 LYS 33 1HB LYS 33 -13.051 -10.023 1.821 242 HG2 LYS 33 2HG LYS 33 -13.239 -12.521 2.499 243 HG3 LYS 33 1HG LYS 33 -14.086 -11.881 3.918 244 HD2 LYS 33 2HD LYS 33 -15.902 -12.031 2.591 245 HD3 LYS 33 1HD LYS 33 -15.310 -10.506 1.930 246 HE2 LYS 33 2HE LYS 33 -14.278 -11.604 0.096 247 HE3 LYS 33 1HE LYS 33 -14.516 -13.191 0.825 248 HZ1 LYS 33 3HZ LYS 33 -16.281 -13.217 -0.548 249 HZ2 LYS 33 1HZ LYS 33 -16.384 -11.531 -0.655 250 HZ3 LYS 33 2HZ LYS 33 -17.026 -12.334 0.687 251 H GLU 34 H GLU 34 -10.638 -9.886 0.895 252 HA GLU 34 HA GLU 34 -10.415 -12.440 -0.361 253 HB2 GLU 34 2HB GLU 34 -10.867 -10.236 -1.521 254 HB3 GLU 34 1HB GLU 34 -9.161 -9.854 -1.286 255 HG2 GLU 34 2HG GLU 34 -8.541 -11.110 -3.009 256 HG3 GLU 34 1HG GLU 34 -9.548 -12.470 -2.482 257 H ALA 35 H ALA 35 -8.047 -10.090 0.867 258 HA ALA 35 HA ALA 35 -5.711 -11.403 0.169 259 HB1 ALA 35 1HB ALA 35 -6.342 -9.652 2.531 260 HB2 ALA 35 2HB ALA 35 -5.550 -9.203 1.021 261 HB3 ALA 35 3HB ALA 35 -4.716 -10.239 2.180 262 H ALA 36 H ALA 36 -7.992 -12.134 2.688 263 HA ALA 36 HA ALA 36 -6.338 -13.769 4.295 264 HB1 ALA 36 1HB ALA 36 -8.567 -14.737 5.052 265 HB2 ALA 36 2HB ALA 36 -9.317 -13.595 3.936 266 HB3 ALA 36 3HB ALA 36 -8.333 -13.002 5.276 267 H ALA 37 H ALA 37 -8.584 -14.532 1.642 268 HA ALA 37 HA ALA 37 -8.328 -17.310 1.693 269 HB1 ALA 37 1HB ALA 37 -8.583 -16.097 -0.977 270 HB2 ALA 37 2HB ALA 37 -9.771 -15.569 0.214 271 HB3 ALA 37 3HB ALA 37 -9.604 -17.282 -0.163 272 H SER 38 H SER 38 -6.803 -15.215 -0.758 273 HA SER 38 HA SER 38 -4.912 -17.149 -1.545 274 HB2 SER 38 2HB SER 38 -4.899 -14.138 -1.878 275 HB3 SER 38 1HB SER 38 -3.770 -15.239 -2.684 276 HG SER 38 HG SER 38 -6.601 -15.314 -2.929 277 H GLY 39 H GLY 39 -4.889 -14.672 0.918 278 HA2 GLY 39 2HA GLY 39 -3.515 -14.466 2.761 279 HA3 GLY 39 1HA GLY 39 -2.630 -15.889 2.208 280 H LEU 40 H LEU 40 -3.166 -12.861 0.436 281 HA LEU 40 HA LEU 40 -0.247 -12.558 0.320 282 HB2 LEU 40 2HB LEU 40 -0.749 -10.983 -1.577 283 HB3 LEU 40 1HB LEU 40 -1.103 -12.672 -1.869 284 HG LEU 40 HG LEU 40 -3.506 -12.180 -1.421 285 HD11 LEU 40 1HD1 LEU 40 -3.789 -9.512 -1.827 286 HD12 LEU 40 2HD1 LEU 40 -2.374 -9.568 -0.778 287 HD13 LEU 40 3HD1 LEU 40 -3.884 -10.311 -0.257 288 HD21 LEU 40 3HD2 LEU 40 -2.138 -11.937 -3.703 289 HD22 LEU 40 1HD2 LEU 40 -2.779 -10.301 -3.569 290 HD23 LEU 40 2HD2 LEU 40 -3.878 -11.680 -3.588 291 HA PRO 41 HA PRO 41 -0.232 -8.890 2.734 292 HB2 PRO 41 2HB PRO 41 1.508 -7.274 1.403 293 HB3 PRO 41 1HB PRO 41 2.017 -8.674 2.353 294 HG2 PRO 41 2HG PRO 41 1.614 -8.437 -0.602 295 HG3 PRO 41 1HG PRO 41 2.937 -9.218 0.285 296 HD2 PRO 41 2HD PRO 41 0.914 -10.633 -0.788 297 HD3 PRO 41 1HD PRO 41 1.682 -11.109 0.739 298 H LEU 42 H LEU 42 -0.741 -6.603 2.790 299 HA LEU 42 HA LEU 42 -2.742 -5.959 0.778 300 HB2 LEU 42 2HB LEU 42 -2.232 -5.182 3.577 301 HB3 LEU 42 1HB LEU 42 -2.892 -3.921 2.554 302 HG LEU 42 HG LEU 42 -4.838 -5.243 2.058 303 HD11 LEU 42 1HD1 LEU 42 -4.507 -7.450 1.917 304 HD12 LEU 42 2HD1 LEU 42 -4.827 -7.459 3.651 305 HD13 LEU 42 3HD1 LEU 42 -3.166 -7.420 3.061 306 HD21 LEU 42 3HD2 LEU 42 -5.430 -5.816 4.618 307 HD22 LEU 42 1HD2 LEU 42 -5.440 -4.180 3.955 308 HD23 LEU 42 2HD2 LEU 42 -4.037 -4.760 4.853 309 H MET 43 H MET 43 -2.744 -4.158 -0.466 310 HA MET 43 HA MET 43 -0.144 -2.904 -0.892 311 HB2 MET 43 2HB MET 43 -1.800 -3.975 -2.675 312 HB3 MET 43 1HB MET 43 -2.519 -2.361 -2.640 313 HG2 MET 43 2HG MET 43 0.323 -3.089 -3.334 314 HG3 MET 43 1HG MET 43 -0.923 -2.502 -4.431 315 HE1 MET 43 3HE MET 43 0.939 -1.200 -0.968 316 HE2 MET 43 1HE MET 43 1.973 -0.155 -1.943 317 HE3 MET 43 2HE MET 43 1.902 -1.885 -2.277 318 H VAL 44 H VAL 44 -0.050 -1.398 0.806 319 HA VAL 44 HA VAL 44 -2.248 0.455 1.148 320 HB VAL 44 HB VAL 44 0.394 0.313 2.586 321 HG11 VAL 44 1HG1 VAL 44 -2.063 1.963 3.164 322 HG12 VAL 44 2HG1 VAL 44 -0.489 2.570 2.654 323 HG13 VAL 44 3HG1 VAL 44 -0.669 1.807 4.232 324 HG21 VAL 44 3HG2 VAL 44 -2.106 -0.294 3.990 325 HG22 VAL 44 1HG2 VAL 44 -0.532 -1.082 4.074 326 HG23 VAL 44 2HG2 VAL 44 -1.637 -1.457 2.751 327 H ILE 45 H ILE 45 -2.318 2.524 0.598 328 HA ILE 45 HA ILE 45 -0.002 4.008 -0.235 329 HB ILE 45 HB ILE 45 -2.180 3.502 -2.265 330 HG12 ILE 45 2HG1 ILE 45 0.687 2.536 -2.187 331 HG13 ILE 45 1HG1 ILE 45 -0.768 1.538 -2.061 332 HG21 ILE 45 1HG2 ILE 45 -0.128 5.533 -2.008 333 HG22 ILE 45 2HG2 ILE 45 -1.519 5.462 -3.087 334 HG23 ILE 45 3HG2 ILE 45 -0.015 4.661 -3.536 335 HD11 ILE 45 3HD1 ILE 45 -1.048 1.475 -4.271 336 HD12 ILE 45 1HD1 ILE 45 0.635 1.997 -4.344 337 HD13 ILE 45 2HD1 ILE 45 -0.664 3.183 -4.472 338 H ILE 46 H ILE 46 -0.327 5.923 0.698 339 HA ILE 46 HA ILE 46 -3.096 6.918 0.857 340 HB ILE 46 HB ILE 46 -0.784 7.587 2.680 341 HG12 ILE 46 2HG1 ILE 46 -3.205 6.191 3.665 342 HG13 ILE 46 1HG1 ILE 46 -2.105 5.244 2.665 343 HG21 ILE 46 1HG2 ILE 46 -2.521 9.377 2.324 344 HG22 ILE 46 2HG2 ILE 46 -2.317 8.838 3.991 345 HG23 ILE 46 3HG2 ILE 46 -3.692 8.270 3.043 346 HD11 ILE 46 3HD1 ILE 46 -1.689 6.429 5.358 347 HD12 ILE 46 1HD1 ILE 46 -0.300 6.226 4.291 348 HD13 ILE 46 2HD1 ILE 46 -1.271 4.827 4.751 349 H HIS 47 H HIS 47 -3.407 8.318 -0.715 350 HA HIS 47 HA HIS 47 -1.220 9.992 -1.652 351 HB2 HIS 47 2HB HIS 47 -2.714 10.610 -3.479 352 HB3 HIS 47 1HB HIS 47 -2.643 8.852 -3.303 353 HD1 HIS 47 1HD HIS 47 -4.979 11.381 -3.977 354 HD2 HIS 47 2HD HIS 47 -5.035 8.031 -1.515 355 HE1 HIS 47 1HE HIS 47 -7.408 10.875 -3.584 356 HE2 HIS 47 2HE HIS 47 -7.412 8.752 -2.231 357 H LYS 48 H LYS 48 -0.894 11.516 -0.049 358 HA LYS 48 HA LYS 48 -3.218 13.265 0.512 359 HB2 LYS 48 2HB LYS 48 -1.113 12.190 2.185 360 HB3 LYS 48 1HB LYS 48 -1.221 13.935 2.329 361 HG2 LYS 48 2HG LYS 48 -3.785 13.421 2.581 362 HG3 LYS 48 1HG LYS 48 -3.186 11.840 3.084 363 HD2 LYS 48 2HD LYS 48 -2.067 12.718 4.928 364 HD3 LYS 48 1HD LYS 48 -2.051 14.351 4.262 365 HE2 LYS 48 2HE LYS 48 -4.716 13.190 4.723 366 HE3 LYS 48 1HE LYS 48 -3.766 13.502 6.174 367 HZ1 LYS 48 3HZ LYS 48 -5.141 15.400 5.566 368 HZ2 LYS 48 1HZ LYS 48 -4.378 15.496 4.058 369 HZ3 LYS 48 2HZ LYS 48 -3.499 15.791 5.471 370 H SER 49 H SER 49 -2.920 15.531 0.587 371 HA SER 49 HA SER 49 -2.274 17.515 -0.314 372 HB2 SER 49 2HB SER 49 0.175 16.245 0.704 373 HB3 SER 49 1HB SER 49 0.462 17.490 -0.512 374 HG SER 49 HG SER 49 -0.429 18.985 0.778 375 H TRP 50 H TRP 50 -0.554 18.449 -2.059 376 HA TRP 50 HA TRP 50 -1.403 17.374 -4.535 377 HB2 TRP 50 2HB TRP 50 0.177 19.015 -5.540 378 HB3 TRP 50 1HB TRP 50 -0.904 19.738 -4.341 379 HD1 TRP 50 HD TRP 50 0.239 20.279 -1.889 380 HE1 TRP 50 1HE TRP 50 2.650 20.976 -1.324 381 HE3 TRP 50 3HE TRP 50 2.547 18.775 -6.196 382 HZ2 TRP 50 2HZ TRP 50 5.194 20.901 -2.544 383 HZ3 TRP 50 3HZ TRP 50 4.972 19.125 -6.417 384 HH2 TRP 50 HH TRP 50 6.267 20.168 -4.628 385 H CYS 51 H CYS 51 -0.703 15.146 -4.093 386 HA CYS 51 HA CYS 51 2.118 14.566 -4.199 387 HB2 CYS 51 2HB CYS 51 1.345 12.191 -4.239 388 HB3 CYS 51 1HB CYS 51 0.720 13.115 -2.878 389 H GLY 52 H GLY 52 3.128 14.906 -6.108 390 HA2 GLY 52 2HA GLY 52 1.895 14.840 -8.639 391 HA3 GLY 52 1HA GLY 52 3.634 14.735 -8.351 392 H ALA 53 H ALA 53 3.424 12.334 -6.725 393 HA ALA 53 HA ALA 53 3.765 10.383 -8.686 394 HB1 ALA 53 1HB ALA 53 3.027 9.923 -5.803 395 HB2 ALA 53 2HB ALA 53 4.662 10.234 -6.388 396 HB3 ALA 53 3HB ALA 53 3.809 8.773 -6.887 397 H CYS 54 H CYS 54 0.914 11.641 -7.308 398 HA CYS 54 HA CYS 54 -0.652 9.352 -8.136 399 HB2 CYS 54 2HB CYS 54 -1.784 11.918 -7.040 400 HB3 CYS 54 1HB CYS 54 -2.446 10.282 -6.930 401 H LYS 55 H LYS 55 -0.106 12.725 -8.980 402 HA LYS 55 HA LYS 55 -2.121 12.923 -10.943 403 HB2 LYS 55 2HB LYS 55 -1.341 15.026 -11.308 404 HB3 LYS 55 1HB LYS 55 -0.480 14.726 -9.806 405 HG2 LYS 55 2HG LYS 55 1.448 13.917 -11.237 406 HG3 LYS 55 1HG LYS 55 0.579 14.611 -12.615 407 HD2 LYS 55 2HD LYS 55 0.509 16.778 -11.309 408 HD3 LYS 55 1HD LYS 55 1.646 16.035 -10.182 409 HE2 LYS 55 2HE LYS 55 2.762 15.553 -12.669 410 HE3 LYS 55 1HE LYS 55 2.110 17.184 -12.809 411 HZ1 LYS 55 3HZ LYS 55 3.302 17.276 -10.410 412 HZ2 LYS 55 1HZ LYS 55 4.037 17.759 -11.856 413 HZ3 LYS 55 2HZ LYS 55 4.331 16.215 -11.233 414 H ALA 56 H ALA 56 1.283 11.941 -11.079 415 HA ALA 56 HA ALA 56 1.280 11.535 -13.913 416 HB1 ALA 56 1HB ALA 56 3.318 9.976 -13.011 417 HB2 ALA 56 2HB ALA 56 3.152 11.126 -11.684 418 HB3 ALA 56 3HB ALA 56 3.449 11.705 -13.323 419 H LEU 57 H LEU 57 0.325 9.729 -11.134 420 HA LEU 57 HA LEU 57 0.433 7.112 -12.117 421 HB2 LEU 57 2HB LEU 57 -0.407 8.401 -9.796 422 HB3 LEU 57 1HB LEU 57 -1.859 7.634 -10.402 423 HG LEU 57 HG LEU 57 -0.949 5.471 -10.178 424 HD11 LEU 57 1HD1 LEU 57 1.495 5.242 -9.392 425 HD12 LEU 57 2HD1 LEU 57 1.695 6.869 -10.046 426 HD13 LEU 57 3HD1 LEU 57 1.181 5.552 -11.100 427 HD21 LEU 57 3HD2 LEU 57 -0.964 5.370 -7.941 428 HD22 LEU 57 1HD2 LEU 57 -1.241 7.110 -8.029 429 HD23 LEU 57 2HD2 LEU 57 0.390 6.488 -7.781 430 H LYS 58 H LYS 58 -1.869 9.689 -12.636 431 HA LYS 58 HA LYS 58 -4.038 8.189 -13.525 432 HB2 LYS 58 2HB LYS 58 -3.384 10.850 -14.744 433 HB3 LYS 58 1HB LYS 58 -4.954 10.157 -14.393 434 HG2 LYS 58 2HG LYS 58 -4.590 10.442 -12.019 435 HG3 LYS 58 1HG LYS 58 -2.963 11.050 -12.315 436 HD2 LYS 58 2HD LYS 58 -5.548 12.343 -13.175 437 HD3 LYS 58 1HD LYS 58 -4.471 12.890 -11.888 438 HE2 LYS 58 2HE LYS 58 -3.346 14.102 -13.366 439 HE3 LYS 58 1HE LYS 58 -2.906 12.628 -14.227 440 HZ1 LYS 58 3HZ LYS 58 -5.416 14.152 -14.673 441 HZ2 LYS 58 1HZ LYS 58 -4.878 12.815 -15.558 442 HZ3 LYS 58 2HZ LYS 58 -4.032 14.276 -15.638 443 HA PRO 59 HA PRO 59 -2.549 8.416 -18.079 444 HB2 PRO 59 2HB PRO 59 -0.116 9.412 -18.663 445 HB3 PRO 59 1HB PRO 59 -1.548 10.445 -18.486 446 HG2 PRO 59 2HG PRO 59 0.608 9.844 -16.485 447 HG3 PRO 59 1HG PRO 59 -0.093 11.409 -16.933 448 HD2 PRO 59 2HD PRO 59 -0.876 10.082 -14.722 449 HD3 PRO 59 1HD PRO 59 -2.002 11.063 -15.688 450 H LYS 60 H LYS 60 -0.132 7.608 -15.650 451 HA LYS 60 HA LYS 60 0.980 5.556 -17.422 452 HB2 LYS 60 2HB LYS 60 2.812 5.377 -15.898 453 HB3 LYS 60 1HB LYS 60 2.504 7.085 -16.174 454 HG2 LYS 60 2HG LYS 60 1.019 6.861 -14.059 455 HG3 LYS 60 1HG LYS 60 1.992 5.433 -13.741 456 HD2 LYS 60 2HD LYS 60 2.614 7.988 -12.950 457 HD3 LYS 60 1HD LYS 60 3.751 6.654 -13.071 458 HE2 LYS 60 2HE LYS 60 4.694 8.564 -14.167 459 HE3 LYS 60 1HE LYS 60 4.266 7.377 -15.395 460 HZ1 LYS 60 3HZ LYS 60 3.281 10.043 -15.007 461 HZ2 LYS 60 1HZ LYS 60 2.039 8.911 -15.204 462 HZ3 LYS 60 2HZ LYS 60 3.237 9.068 -16.387 463 H PHE 61 H PHE 61 -0.336 5.814 -14.097 464 HA PHE 61 HA PHE 61 -0.353 3.022 -13.699 465 HB2 PHE 61 2HB PHE 61 -0.593 4.975 -11.967 466 HB3 PHE 61 1HB PHE 61 -2.318 4.785 -12.298 467 HD1 PHE 61 2HD PHE 61 -3.325 2.456 -12.016 468 HD2 PHE 61 1HD PHE 61 0.493 3.554 -10.488 469 HE1 PHE 61 2HE PHE 61 -3.393 0.539 -10.474 470 HE2 PHE 61 1HE PHE 61 0.434 1.636 -8.946 471 HZ PHE 61 HZ PHE 61 -1.510 0.127 -8.940 472 H ALA 62 H ALA 62 -2.284 5.115 -15.561 473 HA ALA 62 HA ALA 62 -4.699 3.642 -15.610 474 HB1 ALA 62 1HB ALA 62 -4.941 5.716 -16.597 475 HB2 ALA 62 2HB ALA 62 -4.741 4.704 -18.028 476 HB3 ALA 62 3HB ALA 62 -3.376 5.633 -17.404 477 H GLU 63 H GLU 63 -1.549 3.090 -16.632 478 HA GLU 63 HA GLU 63 -1.995 1.175 -18.728 479 HB2 GLU 63 2HB GLU 63 0.038 2.723 -18.415 480 HB3 GLU 63 1HB GLU 63 0.530 1.613 -17.131 481 HG2 GLU 63 2HG GLU 63 1.695 0.737 -18.881 482 HG3 GLU 63 1HG GLU 63 0.202 -0.190 -19.025 483 H SER 64 H SER 64 -2.154 1.216 -15.397 484 HA SER 64 HA SER 64 -1.119 -1.114 -14.470 485 HB2 SER 64 2HB SER 64 -2.054 0.433 -12.954 486 HB3 SER 64 1HB SER 64 -3.642 0.339 -13.710 487 HG SER 64 HG SER 64 -2.668 -1.140 -11.719 488 H THR 65 H THR 65 -3.256 -1.106 -17.018 489 HA THR 65 HA THR 65 -5.149 -3.021 -16.543 490 HB THR 65 HB THR 65 -4.354 -3.844 -18.986 491 HG1 THR 65 1HG THR 65 -3.449 -1.173 -18.954 492 HG21 THR 65 3HG2 THR 65 -6.186 -1.874 -18.033 493 HG22 THR 65 1HG2 THR 65 -6.272 -2.874 -19.483 494 HG23 THR 65 2HG2 THR 65 -5.445 -1.317 -19.533 495 H GLU 66 H GLU 66 -1.698 -3.475 -17.102 496 HA GLU 66 HA GLU 66 -1.865 -6.344 -16.863 497 HB2 GLU 66 2HB GLU 66 0.668 -6.157 -16.645 498 HB3 GLU 66 1HB GLU 66 -0.021 -5.598 -18.166 499 HG2 GLU 66 2HG GLU 66 0.099 -3.446 -16.284 500 HG3 GLU 66 1HG GLU 66 1.678 -4.210 -16.435 501 H ILE 67 H ILE 67 -1.098 -3.565 -14.899 502 HA ILE 67 HA ILE 67 -0.191 -4.965 -12.621 503 HB ILE 67 HB ILE 67 -1.374 -2.221 -12.969 504 HG12 ILE 67 2HG1 ILE 67 1.470 -3.072 -12.451 505 HG13 ILE 67 1HG1 ILE 67 0.802 -2.853 -14.073 506 HG21 ILE 67 1HG2 ILE 67 -0.925 -1.625 -10.797 507 HG22 ILE 67 2HG2 ILE 67 0.216 -2.944 -10.562 508 HG23 ILE 67 3HG2 ILE 67 -1.516 -3.271 -10.583 509 HD11 ILE 67 3HD1 ILE 67 1.457 -0.738 -13.921 510 HD12 ILE 67 1HD1 ILE 67 1.794 -0.891 -12.196 511 HD13 ILE 67 2HD1 ILE 67 0.163 -0.502 -12.745 512 H SER 68 H SER 68 -3.285 -4.725 -14.028 513 HA SER 68 HA SER 68 -4.905 -4.854 -11.707 514 HB2 SER 68 2HB SER 68 -5.318 -4.834 -14.492 515 HB3 SER 68 1HB SER 68 -6.039 -6.336 -13.918 516 HG SER 68 HG SER 68 -6.847 -3.750 -13.550 517 H GLU 69 H GLU 69 -3.012 -7.193 -13.445 518 HA GLU 69 HA GLU 69 -3.946 -9.307 -11.616 519 HB2 GLU 69 2HB GLU 69 -2.931 -10.805 -13.551 520 HB3 GLU 69 1HB GLU 69 -4.586 -10.216 -13.623 521 HG2 GLU 69 2HG GLU 69 -3.680 -8.266 -14.965 522 HG3 GLU 69 1HG GLU 69 -2.180 -9.182 -15.088 523 H LEU 70 H LEU 70 -1.176 -8.317 -13.604 524 HA LEU 70 HA LEU 70 0.800 -9.851 -12.429 525 HB2 LEU 70 2HB LEU 70 1.655 -8.848 -14.264 526 HB3 LEU 70 1HB LEU 70 0.618 -7.450 -14.098 527 HG LEU 70 HG LEU 70 3.135 -7.102 -14.084 528 HD11 LEU 70 1HD1 LEU 70 2.957 -5.263 -12.519 529 HD12 LEU 70 2HD1 LEU 70 1.483 -5.962 -11.847 530 HD13 LEU 70 3HD1 LEU 70 1.509 -5.397 -13.526 531 HD21 LEU 70 3HD2 LEU 70 3.307 -7.421 -11.207 532 HD22 LEU 70 1HD2 LEU 70 4.438 -7.896 -12.472 533 HD23 LEU 70 2HD2 LEU 70 3.098 -8.958 -12.044 534 H SER 71 H SER 71 -0.794 -7.007 -11.243 535 HA SER 71 HA SER 71 1.070 -6.749 -9.004 536 HB2 SER 71 2HB SER 71 -0.116 -4.840 -10.495 537 HB3 SER 71 1HB SER 71 -1.246 -4.952 -9.146 538 HG SER 71 HG SER 71 0.425 -3.443 -8.731 539 H HIS 72 H HIS 72 -1.867 -8.223 -9.719 540 HA HIS 72 HA HIS 72 -3.462 -7.924 -7.504 541 HB2 HIS 72 2HB HIS 72 -3.403 -9.630 -9.726 542 HB3 HIS 72 1HB HIS 72 -3.412 -10.706 -8.321 543 HD1 HIS 72 1HD HIS 72 -5.800 -11.490 -8.374 544 HD2 HIS 72 2HD HIS 72 -5.477 -7.353 -8.584 545 HE1 HIS 72 1HE HIS 72 -8.152 -10.621 -8.186 546 HE2 HIS 72 2HE HIS 72 -7.940 -8.122 -8.427 547 H ASN 73 H ASN 73 -0.361 -9.207 -7.663 548 HA ASN 73 HA ASN 73 -0.060 -11.219 -5.931 549 HB2 ASN 73 2HB ASN 73 2.015 -9.896 -5.128 550 HB3 ASN 73 1HB ASN 73 1.912 -10.374 -6.819 551 HD21 ASN 73 1HD2 ASN 73 2.648 -8.844 -8.084 552 HD22 ASN 73 2HD2 ASN 73 2.440 -7.130 -7.852 553 H PHE 74 H PHE 74 -1.000 -7.968 -5.081 554 HA PHE 74 HA PHE 74 -1.587 -8.856 -2.366 555 HB2 PHE 74 2HB PHE 74 -1.138 -6.268 -1.850 556 HB3 PHE 74 1HB PHE 74 0.128 -7.492 -1.737 557 HD1 PHE 74 2HD PHE 74 -1.377 -5.331 -4.395 558 HD2 PHE 74 1HD PHE 74 2.145 -6.903 -2.593 559 HE1 PHE 74 2HE PHE 74 0.006 -4.042 -5.970 560 HE2 PHE 74 1HE PHE 74 3.529 -5.614 -4.159 561 HZ PHE 74 HZ PHE 74 2.460 -4.180 -5.846 562 H VAL 75 H VAL 75 -2.953 -6.397 -1.582 563 HA VAL 75 HA VAL 75 -4.901 -6.171 -3.766 564 HB VAL 75 HB VAL 75 -5.640 -7.985 -2.243 565 HG11 VAL 75 1HG1 VAL 75 -6.242 -7.648 -0.056 566 HG12 VAL 75 2HG1 VAL 75 -6.506 -5.920 -0.280 567 HG13 VAL 75 3HG1 VAL 75 -4.865 -6.555 -0.187 568 HG21 VAL 75 3HG2 VAL 75 -7.796 -7.527 -2.767 569 HG22 VAL 75 1HG2 VAL 75 -7.088 -6.157 -3.619 570 HG23 VAL 75 2HG2 VAL 75 -7.758 -5.942 -2.003 571 H MET 76 H MET 76 -6.364 -4.624 -3.744 572 HA MET 76 HA MET 76 -5.865 -2.081 -3.619 573 HB2 MET 76 2HB MET 76 -8.315 -1.783 -3.402 574 HB3 MET 76 1HB MET 76 -7.830 -2.981 -4.583 575 HG2 MET 76 2HG MET 76 -8.166 -4.218 -2.019 576 HG3 MET 76 1HG MET 76 -9.595 -3.289 -2.412 577 HE1 MET 76 3HE MET 76 -8.772 -4.339 -6.040 578 HE2 MET 76 1HE MET 76 -8.260 -6.009 -5.822 579 HE3 MET 76 2HE MET 76 -7.336 -4.702 -5.090 580 H VAL 77 H VAL 77 -4.850 -1.060 -1.871 581 HA VAL 77 HA VAL 77 -6.641 -0.425 0.314 582 HB VAL 77 HB VAL 77 -3.888 -1.550 0.839 583 HG11 VAL 77 1HG1 VAL 77 -5.086 -1.171 3.284 584 HG12 VAL 77 2HG1 VAL 77 -5.533 0.286 2.399 585 HG13 VAL 77 3HG1 VAL 77 -3.834 -0.146 2.584 586 HG21 VAL 77 3HG2 VAL 77 -5.187 -3.146 2.250 587 HG22 VAL 77 1HG2 VAL 77 -5.500 -3.282 0.520 588 HG23 VAL 77 2HG2 VAL 77 -6.660 -2.460 1.563 589 H ASN 78 H ASN 78 -6.403 1.398 -1.371 590 HA ASN 78 HA ASN 78 -4.242 3.192 -0.510 591 HB2 ASN 78 2HB ASN 78 -3.835 2.993 -2.758 592 HB3 ASN 78 1HB ASN 78 -5.516 2.680 -3.139 593 HD21 ASN 78 1HD2 ASN 78 -3.863 5.367 -1.528 594 HD22 ASN 78 2HD2 ASN 78 -4.473 6.597 -2.583 595 H LEU 79 H LEU 79 -5.156 4.312 1.114 596 HA LEU 79 HA LEU 79 -7.872 5.334 0.822 597 HB2 LEU 79 2HB LEU 79 -7.682 5.976 3.169 598 HB3 LEU 79 1HB LEU 79 -7.305 4.281 2.928 599 HG LEU 79 HG LEU 79 -4.823 5.438 2.782 600 HD11 LEU 79 1HD1 LEU 79 -4.694 6.915 4.769 601 HD12 LEU 79 2HD1 LEU 79 -6.457 6.949 4.811 602 HD13 LEU 79 3HD1 LEU 79 -5.595 7.616 3.424 603 HD21 LEU 79 3HD2 LEU 79 -4.369 4.274 4.731 604 HD22 LEU 79 1HD2 LEU 79 -5.790 3.435 4.113 605 HD23 LEU 79 2HD2 LEU 79 -5.957 4.605 5.422 606 H GLU 80 H GLU 80 -8.302 7.574 1.589 607 HA GLU 80 HA GLU 80 -6.282 9.434 0.516 608 HB2 GLU 80 2HB GLU 80 -8.547 9.142 -0.678 609 HB3 GLU 80 1HB GLU 80 -9.240 9.993 0.706 610 HG2 GLU 80 2HG GLU 80 -8.121 11.976 0.195 611 HG3 GLU 80 1HG GLU 80 -6.980 11.159 -0.888 612 H ASP 81 H ASP 81 -6.653 11.739 1.423 613 HA ASP 81 HA ASP 81 -6.004 11.823 4.095 614 HB2 ASP 81 2HB ASP 81 -6.446 14.212 4.008 615 HB3 ASP 81 1HB ASP 81 -5.689 13.693 2.506 616 H GLU 82 H GLU 82 -9.152 11.580 2.656 617 HA GLU 82 HA GLU 82 -10.855 12.581 4.545 618 HB2 GLU 82 2HB GLU 82 -10.991 10.484 2.510 619 HB3 GLU 82 1HB GLU 82 -12.099 10.215 3.850 620 HG2 GLU 82 2HG GLU 82 -13.415 11.946 3.286 621 HG3 GLU 82 1HG GLU 82 -12.060 12.948 2.766 622 H GLU 83 H GLU 83 -8.881 9.717 4.781 623 HA GLU 83 HA GLU 83 -9.807 9.375 7.548 624 HB2 GLU 83 2HB GLU 83 -9.545 6.910 7.265 625 HB3 GLU 83 1HB GLU 83 -10.860 7.601 6.324 626 HG2 GLU 83 2HG GLU 83 -9.977 6.919 4.405 627 HG3 GLU 83 1HG GLU 83 -8.376 7.533 4.835 628 H GLU 84 H GLU 84 -7.919 10.628 8.073 629 HA GLU 84 HA GLU 84 -5.299 9.797 7.380 630 HB2 GLU 84 2HB GLU 84 -4.578 11.342 9.176 631 HB3 GLU 84 1HB GLU 84 -5.720 12.078 8.060 632 HG2 GLU 84 2HG GLU 84 -6.754 12.763 9.914 633 HG3 GLU 84 1HG GLU 84 -7.397 11.122 9.960 634 HA PRO 85 HA PRO 85 -5.269 6.127 10.009 635 HB2 PRO 85 2HB PRO 85 -2.362 6.386 9.391 636 HB3 PRO 85 1HB PRO 85 -3.423 4.967 9.272 637 HG2 PRO 85 2HG PRO 85 -2.661 6.280 7.083 638 HG3 PRO 85 1HG PRO 85 -4.317 5.645 7.238 639 HD2 PRO 85 2HD PRO 85 -3.322 8.453 7.505 640 HD3 PRO 85 1HD PRO 85 -4.846 7.851 6.806 641 H LYS 86 H LYS 86 -3.282 8.991 10.311 642 HA LYS 86 HA LYS 86 -2.398 10.072 12.104 643 HB2 LYS 86 2HB LYS 86 -4.814 9.497 12.918 644 HB3 LYS 86 1HB LYS 86 -3.987 8.333 13.962 645 HG2 LYS 86 2HG LYS 86 -2.676 10.141 14.944 646 HG3 LYS 86 1HG LYS 86 -3.483 11.306 13.892 647 HD2 LYS 86 2HD LYS 86 -5.477 11.160 15.033 648 HD3 LYS 86 1HD LYS 86 -5.142 9.531 15.622 649 HE2 LYS 86 2HE LYS 86 -4.390 10.366 17.536 650 HE3 LYS 86 1HE LYS 86 -3.159 11.283 16.667 651 HZ1 LYS 86 3HZ LYS 86 -5.719 12.159 17.734 652 HZ2 LYS 86 1HZ LYS 86 -5.279 12.813 16.236 653 HZ3 LYS 86 2HZ LYS 86 -4.264 13.006 17.575 654 H ASP 87 H ASP 87 -1.179 7.603 11.094 655 HA ASP 87 HA ASP 87 0.533 7.070 13.402 656 HB2 ASP 87 2HB ASP 87 -1.368 5.250 12.795 657 HB3 ASP 87 1HB ASP 87 -0.068 4.701 11.726 658 H GLU 88 H GLU 88 2.517 5.790 12.693 659 HA GLU 88 HA GLU 88 3.858 7.216 10.686 660 HB2 GLU 88 2HB GLU 88 4.457 5.000 12.495 661 HB3 GLU 88 1HB GLU 88 5.325 4.901 10.970 662 HG2 GLU 88 2HG GLU 88 6.734 6.083 12.394 663 HG3 GLU 88 1HG GLU 88 5.998 7.313 11.372 664 H ASP 89 H ASP 89 1.687 4.610 10.414 665 HA ASP 89 HA ASP 89 2.603 3.082 8.345 666 HB2 ASP 89 2HB ASP 89 -0.199 4.033 8.945 667 HB3 ASP 89 1HB ASP 89 0.160 2.841 7.687 668 H PHE 90 H PHE 90 1.595 6.412 8.173 669 HA PHE 90 HA PHE 90 1.522 6.303 5.248 670 HB2 PHE 90 2HB PHE 90 0.765 8.686 5.415 671 HB3 PHE 90 1HB PHE 90 -0.307 7.521 6.201 672 HD1 PHE 90 2HD PHE 90 2.640 9.658 7.070 673 HD2 PHE 90 1HD PHE 90 -1.148 8.107 8.239 674 HE1 PHE 90 2HE PHE 90 2.747 10.972 9.146 675 HE2 PHE 90 1HE PHE 90 -1.049 9.425 10.314 676 HZ PHE 90 HZ PHE 90 0.901 10.857 10.772 677 H SER 91 H SER 91 3.529 7.386 7.853 678 HA SER 91 HA SER 91 5.641 8.035 5.977 679 HB2 SER 91 2HB SER 91 4.578 10.071 7.952 680 HB3 SER 91 1HB SER 91 6.125 10.224 7.100 681 HG SER 91 HG SER 91 4.768 9.968 5.132 682 HA PRO 92 HA PRO 92 7.043 6.068 9.918 683 HB2 PRO 92 2HB PRO 92 7.749 3.665 8.984 684 HB3 PRO 92 1HB PRO 92 6.053 4.061 9.321 685 HG2 PRO 92 2HG PRO 92 7.494 3.921 6.712 686 HG3 PRO 92 1HG PRO 92 5.836 3.441 7.107 687 HD2 PRO 92 2HD PRO 92 6.599 5.840 5.899 688 HD3 PRO 92 1HD PRO 92 5.033 5.522 6.671 689 H ASP 93 H ASP 93 8.577 5.733 6.711 690 HA ASP 93 HA ASP 93 11.209 5.695 7.938 691 HB2 ASP 93 2HB ASP 93 12.006 5.423 5.571 692 HB3 ASP 93 1HB ASP 93 10.912 4.152 6.134 693 H GLY 94 H GLY 94 9.514 7.711 5.514 694 HA2 GLY 94 2HA GLY 94 11.563 9.779 5.940 695 HA3 GLY 94 1HA GLY 94 10.455 9.696 4.568 696 H GLY 95 H GLY 95 10.100 11.979 5.053 697 HA2 GLY 95 2HA GLY 95 8.050 12.274 7.160 698 HA3 GLY 95 1HA GLY 95 9.311 13.490 6.933 699 H TYR 96 H TYR 96 7.318 11.718 4.573 700 HA TYR 96 HA TYR 96 6.619 14.289 3.367 701 HB2 TYR 96 2HB TYR 96 5.495 12.306 1.764 702 HB3 TYR 96 1HB TYR 96 7.008 13.169 1.468 703 HD1 TYR 96 2HD TYR 96 9.156 12.120 2.428 704 HD2 TYR 96 1HD TYR 96 5.485 10.009 2.056 705 HE1 TYR 96 2HE TYR 96 10.379 9.988 2.529 706 HE2 TYR 96 1HE TYR 96 6.694 7.868 2.147 707 HH TYR 96 HH TYR 96 8.802 6.980 2.941 708 H ILE 97 H ILE 97 4.214 13.692 2.131 709 HA ILE 97 HA ILE 97 2.390 12.785 4.193 710 HB ILE 97 HB ILE 97 1.036 14.898 4.001 711 HG12 ILE 97 2HG1 ILE 97 3.475 16.389 3.274 712 HG13 ILE 97 1HG1 ILE 97 2.732 15.478 1.958 713 HG21 ILE 97 1HG2 ILE 97 3.777 15.058 5.246 714 HG22 ILE 97 2HG2 ILE 97 2.312 14.423 5.996 715 HG23 ILE 97 3HG2 ILE 97 2.433 16.141 5.612 716 HD11 ILE 97 3HD1 ILE 97 1.658 17.786 3.503 717 HD12 ILE 97 1HD1 ILE 97 0.549 16.635 2.757 718 HD13 ILE 97 2HD1 ILE 97 1.707 17.515 1.758 719 HA PRO 98 HA PRO 98 2.207 10.428 3.297 720 HB2 PRO 98 2HB PRO 98 -0.594 9.754 2.305 721 HB3 PRO 98 1HB PRO 98 0.342 8.927 3.578 722 HG2 PRO 98 2HG PRO 98 -1.196 11.311 3.798 723 HG3 PRO 98 1HG PRO 98 -0.201 10.514 5.049 724 HD2 PRO 98 2HD PRO 98 0.582 12.830 4.199 725 HD3 PRO 98 1HD PRO 98 1.783 11.523 4.288 726 H ARG 99 H ARG 99 2.981 8.520 2.339 727 HA ARG 99 HA ARG 99 2.838 8.482 -0.607 728 HB2 ARG 99 2HB ARG 99 5.065 8.341 1.276 729 HB3 ARG 99 1HB ARG 99 5.120 7.101 0.029 730 HG2 ARG 99 2HG ARG 99 6.376 9.098 -0.594 731 HG3 ARG 99 1HG ARG 99 5.039 8.783 -1.701 732 HD2 ARG 99 2HD ARG 99 3.976 10.433 0.280 733 HD3 ARG 99 1HD ARG 99 5.573 11.095 -0.055 734 HE ARG 99 HE ARG 99 3.972 10.509 -2.390 735 HH11 ARG 99 1HH1 ARG 99 4.880 12.907 -0.022 736 HH12 ARG 99 2HH1 ARG 99 4.469 14.247 -1.037 737 HH21 ARG 99 1HH2 ARG 99 3.427 12.275 -3.725 738 HH22 ARG 99 2HH2 ARG 99 3.643 13.889 -3.137 739 H ILE 100 H ILE 100 4.057 6.099 -1.149 740 HA ILE 100 HA ILE 100 1.974 4.203 -0.377 741 HB ILE 100 HB ILE 100 2.664 2.854 -2.207 742 HG12 ILE 100 2HG1 ILE 100 4.800 4.210 -3.443 743 HG13 ILE 100 1HG1 ILE 100 5.236 4.096 -1.741 744 HG21 ILE 100 1HG2 ILE 100 3.167 5.372 -3.602 745 HG22 ILE 100 2HG2 ILE 100 1.763 5.404 -2.536 746 HG23 ILE 100 3HG2 ILE 100 1.875 4.192 -3.814 747 HD11 ILE 100 3HD1 ILE 100 4.179 1.609 -2.815 748 HD12 ILE 100 1HD1 ILE 100 5.652 1.919 -1.894 749 HD13 ILE 100 2HD1 ILE 100 5.635 2.167 -3.639 750 H LEU 101 H LEU 101 2.482 1.991 0.172 751 HA LEU 101 HA LEU 101 4.995 1.010 0.794 752 HB2 LEU 101 2HB LEU 101 4.802 1.003 3.326 753 HB3 LEU 101 1HB LEU 101 5.313 2.488 2.559 754 HG LEU 101 HG LEU 101 3.589 2.515 4.519 755 HD11 LEU 101 1HD1 LEU 101 3.265 4.660 3.985 756 HD12 LEU 101 2HD1 LEU 101 2.645 4.278 2.378 757 HD13 LEU 101 3HD1 LEU 101 4.385 4.311 2.669 758 HD21 LEU 101 3HD2 LEU 101 2.047 0.941 3.396 759 HD22 LEU 101 1HD2 LEU 101 1.741 2.173 2.173 760 HD23 LEU 101 2HD2 LEU 101 1.297 2.469 3.853 761 H PHE 102 H PHE 102 4.972 -1.096 1.784 762 HA PHE 102 HA PHE 102 2.321 -2.332 1.455 763 HB2 PHE 102 2HB PHE 102 4.956 -3.792 1.533 764 HB3 PHE 102 1HB PHE 102 3.412 -4.370 0.919 765 HD1 PHE 102 2HD PHE 102 6.019 -1.788 0.307 766 HD2 PHE 102 1HD PHE 102 2.909 -4.184 -1.335 767 HE1 PHE 102 2HE PHE 102 6.626 -1.020 -1.946 768 HE2 PHE 102 1HE PHE 102 3.512 -3.418 -3.594 769 HZ PHE 102 HZ PHE 102 5.371 -1.834 -3.903 770 H LEU 103 H LEU 103 1.865 -4.280 2.819 771 HA LEU 103 HA LEU 103 3.131 -4.309 5.424 772 HB2 LEU 103 2HB LEU 103 1.289 -3.626 6.690 773 HB3 LEU 103 1HB LEU 103 1.458 -2.432 5.424 774 HG LEU 103 HG LEU 103 -0.581 -4.635 5.545 775 HD11 LEU 103 1HD1 LEU 103 -1.766 -3.181 6.703 776 HD12 LEU 103 2HD1 LEU 103 -1.787 -2.137 5.287 777 HD13 LEU 103 3HD1 LEU 103 -0.536 -1.937 6.513 778 HD21 LEU 103 3HD2 LEU 103 0.298 -2.815 3.367 779 HD22 LEU 103 1HD2 LEU 103 -1.427 -3.146 3.535 780 HD23 LEU 103 2HD2 LEU 103 -0.298 -4.475 3.290 781 H ASP 104 H ASP 104 1.603 -5.723 6.955 782 HA ASP 104 HA ASP 104 1.394 -8.269 5.590 783 HB2 ASP 104 2HB ASP 104 0.938 -9.164 7.878 784 HB3 ASP 104 1HB ASP 104 2.464 -8.277 7.749 785 HA PRO 105 HA PRO 105 -2.932 -8.329 4.813 786 HB2 PRO 105 2HB PRO 105 -3.473 -10.972 5.416 787 HB3 PRO 105 1HB PRO 105 -2.803 -10.399 3.877 788 HG2 PRO 105 2HG PRO 105 -1.405 -11.596 6.235 789 HG3 PRO 105 1HG PRO 105 -1.103 -11.838 4.499 790 HD2 PRO 105 2HD PRO 105 0.460 -10.249 6.008 791 HD3 PRO 105 1HD PRO 105 0.103 -9.872 4.311 792 H SER 106 H SER 106 -3.744 -7.031 6.399 793 HA SER 106 HA SER 106 -5.634 -7.872 8.124 794 HB2 SER 106 2HB SER 106 -4.226 -9.151 9.520 795 HB3 SER 106 1HB SER 106 -2.926 -7.949 9.454 796 HG SER 106 HG SER 106 -4.931 -8.168 11.220 797 H GLY 107 H GLY 107 -2.995 -5.686 7.549 798 HA2 GLY 107 2HA GLY 107 -3.611 -3.351 7.129 799 HA3 GLY 107 1HA GLY 107 -4.675 -3.467 8.535 800 H LYS 108 H LYS 108 -1.326 -4.649 8.206 801 HA LYS 108 HA LYS 108 -0.599 -2.706 10.317 802 HB2 LYS 108 2HB LYS 108 -0.651 -5.459 10.563 803 HB3 LYS 108 1HB LYS 108 1.047 -5.111 10.269 804 HG2 LYS 108 2HG LYS 108 0.350 -3.211 12.129 805 HG3 LYS 108 1HG LYS 108 -0.584 -4.633 12.631 806 HD2 LYS 108 2HD LYS 108 1.787 -5.797 12.136 807 HD3 LYS 108 1HD LYS 108 2.343 -4.185 12.594 808 HE2 LYS 108 2HE LYS 108 1.023 -4.359 14.673 809 HE3 LYS 108 1HE LYS 108 0.563 -5.999 14.220 810 HZ1 LYS 108 3HZ LYS 108 3.204 -6.173 14.037 811 HZ2 LYS 108 1HZ LYS 108 2.354 -6.508 15.463 812 HZ3 LYS 108 2HZ LYS 108 3.089 -4.999 15.250 813 H VAL 109 H VAL 109 0.109 -1.276 8.588 814 HA VAL 109 HA VAL 109 2.113 -1.908 6.730 815 HB VAL 109 HB VAL 109 0.952 0.581 7.812 816 HG11 VAL 109 1HG1 VAL 109 3.665 0.526 6.514 817 HG12 VAL 109 2HG1 VAL 109 3.241 1.173 8.100 818 HG13 VAL 109 3HG1 VAL 109 2.657 1.969 6.639 819 HG21 VAL 109 3HG2 VAL 109 0.978 1.114 5.335 820 HG22 VAL 109 1HG2 VAL 109 -0.022 -0.246 5.840 821 HG23 VAL 109 2HG2 VAL 109 1.549 -0.536 5.091 822 H HIS 110 H HIS 110 4.211 -2.035 6.766 823 HA HIS 110 HA HIS 110 5.615 -1.216 9.217 824 HB2 HIS 110 2HB HIS 110 5.122 -3.791 8.907 825 HB3 HIS 110 1HB HIS 110 6.476 -3.702 7.784 826 HD1 HIS 110 1HD HIS 110 8.816 -3.110 8.802 827 HD2 HIS 110 2HD HIS 110 5.793 -3.686 11.594 828 HE1 HIS 110 1HE HIS 110 9.984 -3.365 11.013 829 HE2 HIS 110 2HE HIS 110 8.129 -3.595 12.703 830 HA PRO 111 HA PRO 111 8.223 0.723 6.225 831 HB2 PRO 111 2HB PRO 111 10.376 1.257 7.781 832 HB3 PRO 111 1HB PRO 111 8.859 2.155 7.915 833 HG2 PRO 111 2HG PRO 111 9.890 -0.090 9.603 834 HG3 PRO 111 1HG PRO 111 9.074 1.403 10.103 835 HD2 PRO 111 2HD PRO 111 7.802 -0.995 9.915 836 HD3 PRO 111 1HD PRO 111 6.985 0.559 9.640 837 H GLU 112 H GLU 112 8.182 -2.124 6.160 838 HA GLU 112 HA GLU 112 11.021 -2.845 5.951 839 HB2 GLU 112 2HB GLU 112 8.998 -4.214 7.114 840 HB3 GLU 112 1HB GLU 112 8.956 -4.910 5.499 841 HG2 GLU 112 2HG GLU 112 11.504 -4.719 7.062 842 HG3 GLU 112 1HG GLU 112 10.385 -6.065 7.266 843 H ILE 113 H ILE 113 8.074 -2.540 4.069 844 HA ILE 113 HA ILE 113 9.570 -3.334 1.662 845 HB ILE 113 HB ILE 113 6.596 -3.003 1.710 846 HG12 ILE 113 2HG1 ILE 113 7.158 -4.516 3.578 847 HG13 ILE 113 1HG1 ILE 113 6.348 -5.377 2.261 848 HG21 ILE 113 1HG2 ILE 113 8.340 -4.874 0.122 849 HG22 ILE 113 2HG2 ILE 113 7.898 -3.255 -0.419 850 HG23 ILE 113 3HG2 ILE 113 6.646 -4.472 -0.166 851 HD11 ILE 113 3HD1 ILE 113 8.251 -6.604 3.263 852 HD12 ILE 113 1HD1 ILE 113 9.327 -5.335 2.679 853 HD13 ILE 113 2HD1 ILE 113 8.420 -6.319 1.531 854 H ILE 114 H ILE 114 10.506 -1.572 0.874 855 HA ILE 114 HA ILE 114 8.883 0.856 0.467 856 HB ILE 114 HB ILE 114 10.950 2.128 0.408 857 HG12 ILE 114 2HG1 ILE 114 12.262 0.061 -0.492 858 HG13 ILE 114 1HG1 ILE 114 13.099 1.230 0.519 859 HG21 ILE 114 1HG2 ILE 114 11.793 1.208 2.826 860 HG22 ILE 114 2HG2 ILE 114 10.163 0.541 2.733 861 HG23 ILE 114 3HG2 ILE 114 10.414 2.277 2.573 862 HD11 ILE 114 3HD1 ILE 114 13.026 -1.501 0.871 863 HD12 ILE 114 1HD1 ILE 114 11.898 -0.891 2.082 864 HD13 ILE 114 2HD1 ILE 114 13.560 -0.304 2.051 865 H ASN 115 H ASN 115 10.292 2.176 -1.391 866 HA ASN 115 HA ASN 115 9.947 0.507 -3.762 867 HB2 ASN 115 2HB ASN 115 8.878 2.791 -3.576 868 HB3 ASN 115 1HB ASN 115 10.507 3.479 -3.645 869 HD21 ASN 115 1HD2 ASN 115 8.523 4.084 -5.494 870 HD22 ASN 115 2HD2 ASN 115 8.994 3.445 -7.046 871 H GLU 116 H GLU 116 11.839 -0.740 -3.581 872 HA GLU 116 HA GLU 116 14.414 0.130 -3.139 873 HB2 GLU 116 2HB GLU 116 13.290 -2.148 -4.734 874 HB3 GLU 116 1HB GLU 116 15.035 -1.865 -4.685 875 HG2 GLU 116 2HG GLU 116 13.340 -2.175 -2.222 876 HG3 GLU 116 1HG GLU 116 14.134 -3.526 -3.026 877 H ASN 117 H ASN 117 12.466 0.594 -5.968 878 HA ASN 117 HA ASN 117 14.806 1.454 -7.506 879 HB2 ASN 117 2HB ASN 117 13.130 -0.100 -8.550 880 HB3 ASN 117 1HB ASN 117 11.950 1.218 -8.469 881 HD21 ASN 117 1HD2 ASN 117 15.262 0.587 -9.585 882 HD22 ASN 117 2HD2 ASN 117 15.123 1.513 -11.054 883 H GLY 118 H GLY 118 13.057 2.878 -5.265 884 HA2 GLY 118 2HA GLY 118 12.406 5.316 -6.738 885 HA3 GLY 118 1HA GLY 118 12.008 4.974 -5.049 886 H ASN 119 H ASN 119 12.980 7.396 -5.550 887 HA ASN 119 HA ASN 119 15.727 7.772 -5.615 888 HB2 ASN 119 2HB ASN 119 15.177 9.908 -4.262 889 HB3 ASN 119 1HB ASN 119 14.460 9.720 -5.868 890 HD21 ASN 119 1HD2 ASN 119 12.942 11.299 -5.079 891 HD22 ASN 119 2HD2 ASN 119 11.573 10.771 -4.139 892 HA PRO 120 HA PRO 120 17.066 6.197 -1.699 893 HB2 PRO 120 2HB PRO 120 19.443 7.875 -1.840 894 HB3 PRO 120 1HB PRO 120 19.299 6.123 -2.055 895 HG2 PRO 120 2HG PRO 120 19.903 7.830 -4.086 896 HG3 PRO 120 1HG PRO 120 19.040 6.294 -4.326 897 HD2 PRO 120 2HD PRO 120 17.950 9.086 -4.171 898 HD3 PRO 120 1HD PRO 120 17.509 7.756 -5.273 899 H SER 121 H SER 121 15.186 8.140 -1.216 900 HA SER 121 HA SER 121 16.076 9.204 1.272 901 HB2 SER 121 2HB SER 121 15.647 11.127 -1.031 902 HB3 SER 121 1HB SER 121 15.602 11.619 0.668 903 HG SER 121 HG SER 121 17.684 11.803 -0.517 904 H TYR 122 H TYR 122 13.785 9.251 -1.348 905 HA TYR 122 HA TYR 122 11.575 9.808 0.464 906 HB2 TYR 122 2HB TYR 122 12.225 10.496 -2.186 907 HB3 TYR 122 1HB TYR 122 10.820 9.436 -2.275 908 HD1 TYR 122 2HD TYR 122 8.816 10.078 -0.707 909 HD2 TYR 122 1HD TYR 122 11.972 12.734 -1.741 910 HE1 TYR 122 2HE TYR 122 7.395 11.995 -0.106 911 HE2 TYR 122 1HE TYR 122 10.566 14.655 -1.138 912 HH TYR 122 HH TYR 122 8.177 15.193 -0.925 913 H LYS 123 H LYS 123 12.831 7.324 -1.685 914 HA LYS 123 HA LYS 123 12.223 5.164 -2.098 915 HB2 LYS 123 2HB LYS 123 11.869 5.576 0.818 916 HB3 LYS 123 1HB LYS 123 11.214 4.093 0.138 917 HG2 LYS 123 2HG LYS 123 14.073 5.034 0.021 918 HG3 LYS 123 1HG LYS 123 13.426 3.675 0.957 919 HD2 LYS 123 2HD LYS 123 13.961 2.382 -0.781 920 HD3 LYS 123 1HD LYS 123 12.619 3.145 -1.643 921 HE2 LYS 123 2HE LYS 123 14.617 3.265 -2.992 922 HE3 LYS 123 1HE LYS 123 14.175 4.884 -2.449 923 HZ1 LYS 123 3HZ LYS 123 16.586 4.342 -2.277 924 HZ2 LYS 123 1HZ LYS 123 16.203 3.201 -1.088 925 HZ3 LYS 123 2HZ LYS 123 15.883 4.841 -0.821 926 H TYR 124 H TYR 124 9.652 5.580 0.269 927 HA TYR 124 HA TYR 124 7.663 4.299 -1.068 928 HB2 TYR 124 2HB TYR 124 7.505 6.612 0.856 929 HB3 TYR 124 1HB TYR 124 6.068 5.776 0.254 930 HD1 TYR 124 1HD TYR 124 8.217 3.172 0.329 931 HD2 TYR 124 2HD TYR 124 6.347 5.851 3.055 932 HE1 TYR 124 1HE TYR 124 8.409 1.493 2.110 933 HE2 TYR 124 2HE TYR 124 6.543 4.175 4.836 934 HH TYR 124 HH TYR 124 8.259 1.143 4.334 935 H PHE 125 H PHE 125 8.925 7.396 -1.891 936 HA PHE 125 HA PHE 125 6.734 8.585 -3.145 937 HB2 PHE 125 2HB PHE 125 8.892 9.725 -2.728 938 HB3 PHE 125 1HB PHE 125 9.646 8.726 -3.977 939 HD1 PHE 125 2HD PHE 125 6.310 10.360 -4.056 940 HD2 PHE 125 1HD PHE 125 10.287 10.293 -5.571 941 HE1 PHE 125 2HE PHE 125 5.686 12.023 -5.759 942 HE2 PHE 125 1HE PHE 125 9.670 11.958 -7.273 943 HZ PHE 125 HZ PHE 125 7.368 12.824 -7.371 944 H TYR 126 H TYR 126 5.825 8.407 -5.162 945 HA TYR 126 HA TYR 126 6.801 6.178 -6.816 946 HB2 TYR 126 2HB TYR 126 4.095 6.981 -5.967 947 HB3 TYR 126 1HB TYR 126 4.235 6.584 -7.682 948 HD1 TYR 126 2HD TYR 126 6.578 4.472 -6.894 949 HD2 TYR 126 1HD TYR 126 2.524 5.092 -5.758 950 HE1 TYR 126 2HE TYR 126 6.373 2.088 -6.350 951 HE2 TYR 126 1HE TYR 126 2.311 2.706 -5.213 952 HH TYR 126 HH TYR 126 4.568 0.390 -6.164 953 H VAL 127 H VAL 127 6.943 6.420 -9.017 954 HA VAL 127 HA VAL 127 6.088 8.744 -10.411 955 HB VAL 127 HB VAL 127 8.496 9.359 -11.106 956 HG11 VAL 127 1HG1 VAL 127 8.493 11.135 -9.633 957 HG12 VAL 127 2HG1 VAL 127 7.899 10.156 -8.292 958 HG13 VAL 127 3HG1 VAL 127 6.806 10.622 -9.595 959 HG21 VAL 127 3HG2 VAL 127 10.218 8.999 -9.449 960 HG22 VAL 127 1HG2 VAL 127 9.565 7.446 -9.966 961 HG23 VAL 127 2HG2 VAL 127 9.084 8.131 -8.416 962 H SER 128 H SER 128 5.272 7.452 -11.962 963 HA SER 128 HA SER 128 5.397 6.431 -14.034 964 HB2 SER 128 2HB SER 128 7.377 6.050 -15.123 965 HB3 SER 128 1HB SER 128 7.956 7.171 -13.880 966 HG SER 128 HG SER 128 8.547 5.318 -12.637 967 H ALA 129 H ALA 129 4.471 4.540 -14.373 968 HA ALA 129 HA ALA 129 4.177 2.612 -12.370 969 HB1 ALA 129 1HB ALA 129 3.600 2.633 -15.307 970 HB2 ALA 129 2HB ALA 129 2.477 2.641 -13.947 971 HB3 ALA 129 3HB ALA 129 3.359 1.170 -14.351 972 H GLU 130 H GLU 130 6.760 3.109 -14.558 973 HA GLU 130 HA GLU 130 7.682 0.515 -14.982 974 HB2 GLU 130 2HB GLU 130 8.540 3.028 -15.668 975 HB3 GLU 130 1HB GLU 130 9.794 2.510 -14.531 976 HG2 GLU 130 2HG GLU 130 9.540 0.301 -16.090 977 HG3 GLU 130 1HG GLU 130 9.203 1.593 -17.253 978 H GLN 131 H GLN 131 8.580 2.800 -12.376 979 HA GLN 131 HA GLN 131 10.162 0.823 -11.071 980 HB2 GLN 131 2HB GLN 131 10.276 2.405 -9.204 981 HB3 GLN 131 1HB GLN 131 10.779 3.099 -10.741 982 HG2 GLN 131 2HG GLN 131 8.594 4.187 -10.950 983 HG3 GLN 131 1HG GLN 131 8.116 3.506 -9.395 984 HE21 GLN 131 1HE2 GLN 131 8.079 5.070 -7.957 985 HE22 GLN 131 2HE2 GLN 131 9.291 6.279 -7.734 986 H VAL 132 H VAL 132 6.977 2.255 -10.402 987 HA VAL 132 HA VAL 132 6.387 0.985 -8.032 988 HB VAL 132 HB VAL 132 4.158 1.469 -8.361 989 HG11 VAL 132 1HG1 VAL 132 4.199 3.649 -8.867 990 HG12 VAL 132 2HG1 VAL 132 4.894 3.374 -10.465 991 HG13 VAL 132 3HG1 VAL 132 5.934 3.380 -9.040 992 HG21 VAL 132 3HG2 VAL 132 3.406 0.180 -10.109 993 HG22 VAL 132 1HG2 VAL 132 4.631 0.786 -11.222 994 HG23 VAL 132 2HG2 VAL 132 3.257 1.802 -10.786 995 H VAL 133 H VAL 133 6.560 -0.359 -11.244 996 HA VAL 133 HA VAL 133 5.216 -2.803 -10.486 997 HB VAL 133 HB VAL 133 5.016 -1.901 -12.795 998 HG11 VAL 133 1HG1 VAL 133 7.931 -2.225 -12.676 999 HG12 VAL 133 2HG1 VAL 133 6.949 -1.136 -13.653 1000 HG13 VAL 133 3HG1 VAL 133 7.174 -2.810 -14.156 1001 HG21 VAL 133 3HG2 VAL 133 6.307 -4.556 -13.107 1002 HG22 VAL 133 1HG2 VAL 133 4.738 -3.983 -13.677 1003 HG23 VAL 133 2HG2 VAL 133 4.951 -4.432 -11.985 1004 H GLN 134 H GLN 134 8.545 -1.648 -10.699 1005 HA GLN 134 HA GLN 134 9.584 -4.353 -10.613 1006 HB2 GLN 134 2HB GLN 134 11.738 -2.971 -9.840 1007 HB3 GLN 134 1HB GLN 134 11.265 -3.129 -11.523 1008 HG2 GLN 134 2HG GLN 134 10.066 -0.953 -11.293 1009 HG3 GLN 134 1HG GLN 134 10.802 -0.792 -9.701 1010 HE21 GLN 134 1HE2 GLN 134 13.309 -1.884 -10.278 1011 HE22 GLN 134 2HE2 GLN 134 14.147 -0.795 -11.351 1012 H GLY 135 H GLY 135 9.006 -1.735 -8.340 1013 HA2 GLY 135 2HA GLY 135 10.040 -3.170 -6.076 1014 HA3 GLY 135 1HA GLY 135 9.036 -1.713 -6.026 1015 H MET 136 H MET 136 7.121 -3.168 -7.896 1016 HA MET 136 HA MET 136 5.497 -4.344 -5.801 1017 HB2 MET 136 2HB MET 136 4.266 -2.950 -7.223 1018 HB3 MET 136 1HB MET 136 5.060 -3.562 -8.664 1019 HG2 MET 136 2HG MET 136 3.598 -5.641 -7.287 1020 HG3 MET 136 1HG MET 136 2.569 -4.272 -7.702 1021 HE1 MET 136 3HE MET 136 2.552 -3.143 -9.719 1022 HE2 MET 136 1HE MET 136 1.720 -4.201 -10.857 1023 HE3 MET 136 2HE MET 136 3.333 -3.597 -11.235 1024 H LYS 137 H LYS 137 7.120 -5.325 -8.759 1025 HA LYS 137 HA LYS 137 6.194 -8.014 -8.703 1026 HB2 LYS 137 2HB LYS 137 7.507 -8.379 -10.605 1027 HB3 LYS 137 1HB LYS 137 7.000 -6.704 -10.735 1028 HG2 LYS 137 2HG LYS 137 9.271 -6.177 -9.627 1029 HG3 LYS 137 1HG LYS 137 9.701 -7.817 -10.113 1030 HD2 LYS 137 2HD LYS 137 8.801 -5.565 -11.907 1031 HD3 LYS 137 1HD LYS 137 10.410 -6.285 -11.831 1032 HE2 LYS 137 2HE LYS 137 7.947 -7.857 -12.553 1033 HE3 LYS 137 1HE LYS 137 8.927 -7.018 -13.753 1034 HZ1 LYS 137 3HZ LYS 137 10.859 -8.322 -12.766 1035 HZ2 LYS 137 1HZ LYS 137 9.755 -9.179 -13.721 1036 HZ3 LYS 137 2HZ LYS 137 9.687 -9.299 -12.036 1037 H GLU 138 H GLU 138 8.516 -6.374 -6.903 1038 HA GLU 138 HA GLU 138 10.193 -8.710 -6.453 1039 HB2 GLU 138 2HB GLU 138 10.668 -5.959 -6.434 1040 HB3 GLU 138 1HB GLU 138 10.749 -6.436 -4.740 1041 HG2 GLU 138 2HG GLU 138 12.205 -8.131 -6.676 1042 HG3 GLU 138 1HG GLU 138 12.850 -6.508 -6.374 1043 H ALA 139 H ALA 139 8.775 -6.328 -4.247 1044 HA ALA 139 HA ALA 139 8.808 -7.915 -1.975 1045 HB1 ALA 139 1HB ALA 139 6.724 -5.816 -2.483 1046 HB2 ALA 139 2HB ALA 139 8.410 -5.422 -2.145 1047 HB3 ALA 139 3HB ALA 139 7.452 -6.293 -0.949 1048 H GLN 140 H GLN 140 6.676 -8.080 -4.668 1049 HA GLN 140 HA GLN 140 4.398 -9.116 -3.436 1050 HB2 GLN 140 2HB GLN 140 3.875 -10.024 -5.701 1051 HB3 GLN 140 1HB GLN 140 4.226 -8.298 -5.658 1052 HG2 GLN 140 2HG GLN 140 5.317 -9.154 -7.549 1053 HG3 GLN 140 1HG GLN 140 6.566 -8.891 -6.336 1054 HE21 GLN 140 1HE2 GLN 140 4.254 -11.516 -6.933 1055 HE22 GLN 140 2HE2 GLN 140 5.439 -12.772 -7.002 1056 H GLU 141 H GLU 141 7.457 -10.573 -3.861 1057 HA GLU 141 HA GLU 141 6.275 -13.195 -3.290 1058 HB2 GLU 141 2HB GLU 141 7.973 -14.291 -4.590 1059 HB3 GLU 141 1HB GLU 141 7.118 -13.103 -5.586 1060 HG2 GLU 141 2HG GLU 141 8.919 -11.508 -5.143 1061 HG3 GLU 141 1HG GLU 141 9.777 -12.768 -4.271 1062 H ARG 142 H ARG 142 8.511 -10.835 -2.293 1063 HA ARG 142 HA ARG 142 9.890 -12.786 -0.588 1064 HB2 ARG 142 2HB ARG 142 11.544 -10.925 -0.193 1065 HB3 ARG 142 1HB ARG 142 11.477 -11.556 -1.843 1066 HG2 ARG 142 2HG ARG 142 11.535 -9.325 -2.273 1067 HG3 ARG 142 1HG ARG 142 9.784 -9.558 -2.166 1068 HD2 ARG 142 2HD ARG 142 10.590 -7.579 -0.916 1069 HD3 ARG 142 1HD ARG 142 9.770 -8.771 0.109 1070 HE ARG 142 HE ARG 142 12.658 -8.996 -0.019 1071 HH11 ARG 142 1HH1 ARG 142 9.904 -7.679 1.692 1072 HH12 ARG 142 2HH1 ARG 142 10.770 -7.478 3.179 1073 HH21 ARG 142 1HH2 ARG 142 13.791 -8.727 1.936 1074 HH22 ARG 142 2HH2 ARG 142 12.974 -8.071 3.317 1075 H LEU 143 H LEU 143 7.519 -10.346 -0.448 1076 HA LEU 143 HA LEU 143 7.985 -9.951 2.422 1077 HB2 LEU 143 2HB LEU 143 7.009 -7.915 2.286 1078 HB3 LEU 143 1HB LEU 143 7.513 -8.062 0.603 1079 HG LEU 143 HG LEU 143 5.123 -9.043 0.240 1080 HD11 LEU 143 1HD1 LEU 143 3.729 -7.493 2.002 1081 HD12 LEU 143 2HD1 LEU 143 5.029 -8.120 3.015 1082 HD13 LEU 143 3HD1 LEU 143 3.969 -9.234 2.151 1083 HD21 LEU 143 3HD2 LEU 143 6.040 -6.244 0.518 1084 HD22 LEU 143 1HD2 LEU 143 4.306 -6.507 0.344 1085 HD23 LEU 143 2HD2 LEU 143 5.415 -7.100 -0.892 1086 H THR 144 H THR 144 5.680 -11.244 0.125 1087 HA THR 144 HA THR 144 3.408 -11.535 1.634 1088 HB THR 144 HB THR 144 2.800 -13.324 0.185 1089 HG1 THR 144 1HG THR 144 4.178 -14.720 -0.582 1090 HG21 THR 144 3HG2 THR 144 3.152 -12.475 -1.957 1091 HG22 THR 144 1HG2 THR 144 4.709 -11.776 -1.517 1092 HG23 THR 144 2HG2 THR 144 3.218 -11.068 -0.894 1093 H GLY 145 H GLY 145 3.048 -12.419 3.557 1094 HA2 GLY 145 2HA GLY 145 2.972 -14.516 4.828 1095 HA3 GLY 145 1HA GLY 145 4.631 -14.793 4.325 1096 H ASP 146 H ASP 146 6.067 -14.466 5.878 1097 HA ASP 146 HA ASP 146 5.767 -12.162 7.646 1098 HB2 ASP 146 2HB ASP 146 6.519 -13.785 9.564 1099 HB3 ASP 146 1HB ASP 146 4.817 -13.660 9.132 1100 H ALA 147 H ALA 147 7.573 -13.039 5.431 1101 HA ALA 147 HA ALA 147 10.109 -13.668 6.555 1102 HB1 ALA 147 1HB ALA 147 9.291 -13.948 4.122 1103 HB2 ALA 147 2HB ALA 147 10.967 -13.476 4.404 1104 HB3 ALA 147 3HB ALA 147 9.778 -12.264 3.930 1105 H PHE 148 H PHE 148 8.298 -10.765 6.211 1106 HA PHE 148 HA PHE 148 10.537 -8.970 6.398 1107 HB2 PHE 148 2HB PHE 148 8.931 -7.216 6.361 1108 HB3 PHE 148 1HB PHE 148 8.307 -8.466 5.277 1109 HD1 PHE 148 2HD PHE 148 7.903 -6.838 8.545 1110 HD2 PHE 148 1HD PHE 148 6.293 -9.649 5.785 1111 HE1 PHE 148 2HE PHE 148 5.795 -6.871 9.815 1112 HE2 PHE 148 1HE PHE 148 4.182 -9.687 7.049 1113 HZ PHE 148 HZ PHE 148 3.932 -8.296 9.068 1114 H ARG 149 H ARG 149 8.433 -10.628 8.599 1115 HA ARG 149 HA ARG 149 8.535 -9.057 10.860 1116 HB2 ARG 149 2HB ARG 149 8.274 -11.975 10.373 1117 HB3 ARG 149 1HB ARG 149 8.563 -11.432 12.018 1118 HG2 ARG 149 2HG ARG 149 6.335 -10.417 10.275 1119 HG3 ARG 149 1HG ARG 149 6.175 -11.719 11.444 1120 HD2 ARG 149 2HD ARG 149 7.017 -8.902 12.078 1121 HD3 ARG 149 1HD ARG 149 5.409 -9.570 12.347 1122 HE ARG 149 HE ARG 149 7.755 -9.987 13.957 1123 HH11 ARG 149 1HH1 ARG 149 4.643 -11.275 13.044 1124 HH12 ARG 149 2HH1 ARG 149 4.459 -12.199 14.496 1125 HH21 ARG 149 1HH2 ARG 149 7.515 -11.201 15.870 1126 HH22 ARG 149 2HH2 ARG 149 6.089 -12.157 16.101 1127 H LYS 150 H LYS 150 10.128 -8.370 12.117 1128 HA LYS 150 HA LYS 150 12.711 -9.780 12.012 1129 HB2 LYS 150 2HB LYS 150 12.354 -7.247 11.316 1130 HB3 LYS 150 1HB LYS 150 12.492 -6.992 13.050 1131 HG2 LYS 150 2HG LYS 150 14.638 -8.485 12.763 1132 HG3 LYS 150 1HG LYS 150 14.531 -7.917 11.096 1133 HD2 LYS 150 2HD LYS 150 15.777 -6.214 11.927 1134 HD3 LYS 150 1HD LYS 150 14.186 -5.587 12.368 1135 HE2 LYS 150 2HE LYS 150 14.703 -7.124 14.518 1136 HE3 LYS 150 1HE LYS 150 16.345 -6.665 14.067 1137 HZ1 LYS 150 3HZ LYS 150 15.867 -4.876 15.319 1138 HZ2 LYS 150 1HZ LYS 150 14.193 -5.037 15.136 1139 HZ3 LYS 150 2HZ LYS 150 15.111 -4.314 13.913 1140 H LYS 151 H LYS 151 10.259 -8.434 14.116 1141 HA LYS 151 HA LYS 151 11.773 -9.165 16.499 1142 HB2 LYS 151 2HB LYS 151 10.165 -7.051 16.036 1143 HB3 LYS 151 1HB LYS 151 8.999 -8.158 16.747 1144 HG2 LYS 151 2HG LYS 151 9.836 -6.873 18.524 1145 HG3 LYS 151 1HG LYS 151 10.631 -8.443 18.657 1146 HD2 LYS 151 2HD LYS 151 12.615 -7.534 17.554 1147 HD3 LYS 151 1HD LYS 151 11.819 -5.966 17.406 1148 HE2 LYS 151 2HE LYS 151 12.824 -5.490 19.350 1149 HE3 LYS 151 1HE LYS 151 11.554 -6.478 20.071 1150 HZ1 LYS 151 3HZ LYS 151 13.073 -7.918 20.752 1151 HZ2 LYS 151 1HZ LYS 151 14.295 -6.919 20.146 1152 HZ3 LYS 151 2HZ LYS 151 13.646 -8.143 19.177 1153 H HIS 152 H HIS 152 11.180 -10.753 17.929 1154 HA HIS 152 HA HIS 152 8.733 -12.236 17.603 1155 HB2 HIS 152 2HB HIS 152 11.391 -13.529 16.966 1156 HB3 HIS 152 1HB HIS 152 9.900 -14.420 17.247 1157 HD1 HIS 152 1HD HIS 152 7.940 -13.944 15.468 1158 HD2 HIS 152 2HD HIS 152 11.742 -12.648 14.406 1159 HE1 HIS 152 1HE HIS 152 7.847 -13.551 12.985 1160 HE2 HIS 152 2HE HIS 152 10.186 -12.862 12.350 1161 H LEU 153 H LEU 153 8.075 -12.824 19.562 1162 HA LEU 153 HA LEU 153 9.689 -14.059 21.504 1163 HB2 LEU 153 2HB LEU 153 10.243 -11.412 21.437 1164 HB3 LEU 153 1HB LEU 153 8.922 -11.422 22.589 1165 HG LEU 153 HG LEU 153 10.926 -13.471 23.153 1166 HD11 LEU 153 1HD1 LEU 153 11.916 -10.775 23.833 1167 HD12 LEU 153 2HD1 LEU 153 12.104 -11.282 22.155 1168 HD13 LEU 153 3HD1 LEU 153 12.802 -12.252 23.451 1169 HD21 LEU 153 3HD2 LEU 153 10.608 -12.765 25.377 1170 HD22 LEU 153 1HD2 LEU 153 9.026 -12.625 24.611 1171 HD23 LEU 153 2HD2 LEU 153 10.007 -11.185 24.875 1172 H GLU 154 H GLU 154 7.128 -11.588 21.752 1173 HA GLU 154 HA GLU 154 5.504 -13.504 23.250 1174 HB2 GLU 154 2HB GLU 154 5.997 -10.806 23.607 1175 HB3 GLU 154 1HB GLU 154 4.388 -10.827 22.899 1176 HG2 GLU 154 2HG GLU 154 3.515 -11.369 24.852 1177 HG3 GLU 154 1HG GLU 154 4.496 -12.833 24.903 1178 H ASP 155 H ASP 155 5.236 -11.302 20.474 1179 HA ASP 155 HA ASP 155 3.892 -11.317 18.640 1180 HB2 ASP 155 2HB ASP 155 4.706 -13.923 18.982 1181 HB3 ASP 155 1HB ASP 155 2.954 -14.084 18.900 1182 H GLU 156 H GLU 156 1.594 -11.722 17.889 1183 HA GLU 156 HA GLU 156 -0.189 -11.058 20.088 1184 HB2 GLU 156 2HB GLU 156 0.027 -10.089 17.544 1185 HB3 GLU 156 1HB GLU 156 -1.314 -11.227 17.371 1186 HG2 GLU 156 2HG GLU 156 -2.257 -9.121 17.860 1187 HG3 GLU 156 1HG GLU 156 -2.395 -10.090 19.327 1188 H LEU 157 H LEU 157 -0.280 -13.284 17.301 1189 HA LEU 157 HA LEU 157 -1.649 -15.243 18.997 1190 HB2 LEU 157 2HB LEU 157 -2.629 -14.082 16.423 1191 HB3 LEU 157 1HB LEU 157 -3.007 -15.750 16.807 1192 HG LEU 157 HG LEU 157 -3.836 -14.685 19.084 1193 HD11 LEU 157 1HD1 LEU 157 -5.037 -12.495 18.310 1194 HD12 LEU 157 2HD1 LEU 157 -3.694 -12.404 17.172 1195 HD13 LEU 157 3HD1 LEU 157 -3.378 -12.444 18.907 1196 HD21 LEU 157 3HD2 LEU 157 -5.489 -15.820 18.035 1197 HD22 LEU 157 1HD2 LEU 157 -5.140 -15.096 16.464 1198 HD23 LEU 157 2HD2 LEU 157 -6.055 -14.189 17.670 Start of MODEL 34 1 H1 MET 1 1HT MET 1 -20.456 -7.956 -15.982 2 H2 MET 1 2HT MET 1 -21.117 -6.415 -16.352 3 H3 MET 1 3HT MET 1 -19.976 -6.579 -15.079 4 HA MET 1 HA MET 1 -18.770 -5.702 -16.787 5 HB2 MET 1 2HB MET 1 -18.258 -8.207 -15.780 6 HB3 MET 1 1HB MET 1 -18.135 -8.477 -17.512 7 HG2 MET 1 2HG MET 1 -16.741 -6.093 -16.525 8 HG3 MET 1 1HG MET 1 -16.110 -7.630 -15.938 9 HE1 MET 1 2HE MET 1 -14.194 -6.379 -16.870 10 HE2 MET 1 3HE MET 1 -13.909 -5.994 -18.568 11 HE3 MET 1 1HE MET 1 -13.466 -7.580 -17.938 12 H HIS 2 H HIS 2 -20.819 -8.334 -17.969 13 HA HIS 2 HA HIS 2 -20.779 -7.063 -20.623 14 HB2 HIS 2 2HB HIS 2 -19.682 -9.514 -20.106 15 HB3 HIS 2 1HB HIS 2 -21.314 -9.956 -20.593 16 HD1 HIS 2 1HD HIS 2 -18.101 -9.449 -21.993 17 HD2 HIS 2 2HD HIS 2 -21.967 -8.512 -23.196 18 HE1 HIS 2 1HE HIS 2 -17.962 -9.081 -24.477 19 HE2 HIS 2 2HE HIS 2 -20.327 -8.595 -25.195 20 H HIS 3 H HIS 3 -22.636 -6.554 -18.541 21 HA HIS 3 HA HIS 3 -24.874 -6.227 -18.304 22 HB2 HIS 3 2HB HIS 3 -24.580 -6.923 -21.100 23 HB3 HIS 3 1HB HIS 3 -26.110 -7.513 -20.463 24 HD1 HIS 3 1HD HIS 3 -27.838 -5.741 -19.697 25 HD2 HIS 3 2HD HIS 3 -24.350 -4.145 -21.297 26 HE1 HIS 3 1HE HIS 3 -28.338 -3.311 -20.111 27 HE2 HIS 3 2HE HIS 3 -26.191 -2.351 -21.014 28 H HIS 4 H HIS 4 -24.607 -9.408 -19.917 29 HA HIS 4 HA HIS 4 -26.625 -10.678 -18.515 30 HB2 HIS 4 2HB HIS 4 -25.518 -12.798 -19.139 31 HB3 HIS 4 1HB HIS 4 -25.611 -11.670 -20.487 32 HD1 HIS 4 1HD HIS 4 -23.617 -12.634 -21.740 33 HD2 HIS 4 2HD HIS 4 -22.700 -11.434 -17.868 34 HE1 HIS 4 1HE HIS 4 -21.108 -12.706 -21.589 35 HE2 HIS 4 2HE HIS 4 -20.574 -11.898 -19.263 36 H HIS 5 H HIS 5 -25.913 -12.828 -17.181 37 HA HIS 5 HA HIS 5 -25.272 -13.639 -15.157 38 HB2 HIS 5 2HB HIS 5 -22.993 -11.936 -15.968 39 HB3 HIS 5 1HB HIS 5 -23.081 -12.328 -14.255 40 HD1 HIS 5 1HD HIS 5 -22.128 -14.522 -13.589 41 HD2 HIS 5 2HD HIS 5 -22.988 -14.359 -17.651 42 HE1 HIS 5 1HE HIS 5 -21.245 -16.671 -14.550 43 HE2 HIS 5 2HE HIS 5 -21.697 -16.511 -17.023 44 H HIS 6 H HIS 6 -25.351 -13.181 -12.892 45 HA HIS 6 HA HIS 6 -26.799 -10.712 -12.329 46 HB2 HIS 6 2HB HIS 6 -26.377 -13.196 -10.652 47 HB3 HIS 6 1HB HIS 6 -27.349 -11.810 -10.169 48 HD1 HIS 6 1HD HIS 6 -29.731 -12.411 -10.377 49 HD2 HIS 6 2HD HIS 6 -27.472 -13.987 -13.489 50 HE1 HIS 6 1HE HIS 6 -31.375 -13.583 -11.875 51 HE2 HIS 6 2HE HIS 6 -29.976 -14.597 -13.709 52 H HIS 7 H HIS 7 -26.005 -9.075 -11.155 53 HA HIS 7 HA HIS 7 -23.789 -9.462 -9.340 54 HB2 HIS 7 2HB HIS 7 -23.278 -8.662 -12.008 55 HB3 HIS 7 1HB HIS 7 -23.053 -7.236 -11.000 56 HD1 HIS 7 1HD HIS 7 -21.209 -7.419 -9.114 57 HD2 HIS 7 2HD HIS 7 -21.297 -10.569 -11.825 58 HE1 HIS 7 1HE HIS 7 -19.024 -8.628 -8.813 59 HE2 HIS 7 2HE HIS 7 -19.131 -10.572 -10.411 60 H MET 8 H MET 8 -26.610 -8.528 -9.322 61 HA MET 8 HA MET 8 -27.867 -6.984 -8.229 62 HB2 MET 8 2HB MET 8 -25.289 -6.911 -6.957 63 HB3 MET 8 1HB MET 8 -25.976 -5.282 -6.990 64 HG2 MET 8 2HG MET 8 -27.088 -5.860 -5.161 65 HG3 MET 8 1HG MET 8 -28.101 -6.851 -6.208 66 HE1 MET 8 3HE MET 8 -25.083 -6.461 -4.200 67 HE2 MET 8 1HE MET 8 -24.218 -7.964 -4.520 68 HE3 MET 8 2HE MET 8 -25.191 -7.800 -3.059 69 H SER 9 H SER 9 -25.032 -4.909 -8.711 70 HA SER 9 HA SER 9 -26.065 -3.612 -11.024 71 HB2 SER 9 2HB SER 9 -26.729 -2.512 -8.353 72 HB3 SER 9 1HB SER 9 -26.151 -1.351 -9.549 73 HG SER 9 HG SER 9 -27.805 -2.057 -10.941 74 H ASP 10 H ASP 10 -24.005 -3.296 -8.160 75 HA ASP 10 HA ASP 10 -21.821 -2.713 -7.915 76 HB2 ASP 10 2HB ASP 10 -21.986 -3.830 -10.577 77 HB3 ASP 10 1HB ASP 10 -20.769 -2.559 -10.514 78 H GLY 11 H GLY 11 -22.318 -1.278 -11.127 79 HA2 GLY 11 2HA GLY 11 -22.703 0.974 -11.657 80 HA3 GLY 11 1HA GLY 11 -22.516 1.383 -9.958 81 H HIS 12 H HIS 12 -20.883 0.837 -12.983 82 HA HIS 12 HA HIS 12 -18.829 1.444 -13.751 83 HB2 HIS 12 2HB HIS 12 -19.612 3.609 -12.553 84 HB3 HIS 12 1HB HIS 12 -18.446 3.151 -11.303 85 HD1 HIS 12 1HD HIS 12 -18.674 5.147 -14.228 86 HD2 HIS 12 2HD HIS 12 -15.748 2.673 -12.619 87 HE1 HIS 12 1HE HIS 12 -16.522 5.858 -15.314 88 HE2 HIS 12 2HE HIS 12 -14.780 4.289 -14.391 89 H ASN 13 H ASN 13 -16.611 0.965 -13.513 90 HA ASN 13 HA ASN 13 -15.977 -0.632 -11.120 91 HB2 ASN 13 2HB ASN 13 -14.435 -1.927 -12.620 92 HB3 ASN 13 1HB ASN 13 -16.145 -2.108 -13.007 93 HD21 ASN 13 1HD2 ASN 13 -16.978 -0.687 -14.733 94 HD22 ASN 13 2HD2 ASN 13 -15.941 -0.345 -16.073 95 H GLY 14 H GLY 14 -15.367 1.700 -10.471 96 HA2 GLY 14 2HA GLY 14 -12.571 2.201 -11.302 97 HA3 GLY 14 1HA GLY 14 -13.698 3.481 -10.838 98 H LEU 15 H LEU 15 -11.023 2.436 -9.779 99 HA LEU 15 HA LEU 15 -11.721 2.744 -6.985 100 HB2 LEU 15 2HB LEU 15 -10.701 0.201 -8.149 101 HB3 LEU 15 1HB LEU 15 -10.078 0.693 -6.586 102 HG LEU 15 HG LEU 15 -13.034 0.535 -7.081 103 HD11 LEU 15 1HD1 LEU 15 -11.163 -1.706 -6.356 104 HD12 LEU 15 2HD1 LEU 15 -12.291 -1.630 -7.709 105 HD13 LEU 15 3HD1 LEU 15 -12.900 -1.751 -6.059 106 HD21 LEU 15 3HD2 LEU 15 -11.465 0.092 -4.554 107 HD22 LEU 15 1HD2 LEU 15 -13.193 0.391 -4.728 108 HD23 LEU 15 2HD2 LEU 15 -12.037 1.681 -5.060 109 H GLY 16 H GLY 16 -9.611 2.656 -5.627 110 HA2 GLY 16 2HA GLY 16 -7.325 3.153 -5.407 111 HA3 GLY 16 1HA GLY 16 -7.258 3.549 -7.122 112 H LYS 17 H LYS 17 -9.521 5.322 -7.118 113 HA LYS 17 HA LYS 17 -10.049 7.509 -6.803 114 HB2 LYS 17 2HB LYS 17 -8.939 6.694 -4.204 115 HB3 LYS 17 1HB LYS 17 -8.851 8.420 -4.517 116 HG2 LYS 17 2HG LYS 17 -11.418 6.982 -4.985 117 HG3 LYS 17 1HG LYS 17 -10.935 7.394 -3.340 118 HD2 LYS 17 2HD LYS 17 -10.740 9.743 -3.977 119 HD3 LYS 17 1HD LYS 17 -11.192 9.339 -5.635 120 HE2 LYS 17 2HE LYS 17 -13.243 9.945 -4.878 121 HE3 LYS 17 1HE LYS 17 -13.275 8.258 -4.365 122 HZ1 LYS 17 3HZ LYS 17 -13.096 8.818 -2.197 123 HZ2 LYS 17 1HZ LYS 17 -13.808 10.258 -2.730 124 HZ3 LYS 17 2HZ LYS 17 -12.135 10.179 -2.493 125 H GLY 18 H GLY 18 -8.745 7.991 -8.648 126 HA2 GLY 18 2HA GLY 18 -7.260 9.415 -9.694 127 HA3 GLY 18 1HA GLY 18 -6.741 9.962 -8.095 128 H PHE 19 H PHE 19 -6.375 7.360 -10.468 129 HA PHE 19 HA PHE 19 -3.582 7.263 -10.255 130 HB2 PHE 19 2HB PHE 19 -4.769 6.046 -8.071 131 HB3 PHE 19 1HB PHE 19 -4.431 4.689 -9.154 132 HD1 PHE 19 1HD PHE 19 -2.002 4.762 -10.224 133 HD2 PHE 19 2HD PHE 19 -3.147 6.666 -6.594 134 HE1 PHE 19 1HE PHE 19 0.346 4.757 -9.480 135 HE2 PHE 19 2HE PHE 19 -0.805 6.669 -5.850 136 HZ PHE 19 HZ PHE 19 0.948 5.713 -7.292 137 H GLY 20 H GLY 20 -6.338 5.045 -10.645 138 HA2 GLY 20 2HA GLY 20 -5.719 4.681 -13.444 139 HA3 GLY 20 1HA GLY 20 -5.412 3.255 -12.451 140 H ASP 21 H ASP 21 -7.179 2.323 -11.280 141 HA ASP 21 HA ASP 21 -9.828 3.085 -11.340 142 HB2 ASP 21 2HB ASP 21 -8.929 1.843 -13.866 143 HB3 ASP 21 1HB ASP 21 -10.389 1.127 -13.168 144 H HIS 22 H HIS 22 -9.164 -0.159 -12.489 145 HA HIS 22 HA HIS 22 -9.635 -1.156 -9.762 146 HB2 HIS 22 2HB HIS 22 -11.287 -1.860 -11.481 147 HB3 HIS 22 1HB HIS 22 -9.983 -2.600 -12.404 148 HD1 HIS 22 1HD HIS 22 -10.282 -2.913 -8.663 149 HD2 HIS 22 2HD HIS 22 -10.851 -5.208 -12.081 150 HE1 HIS 22 1HE HIS 22 -10.641 -5.264 -7.843 151 HE2 HIS 22 2HE HIS 22 -11.075 -6.618 -9.923 152 H ILE 23 H ILE 23 -7.692 -1.502 -8.819 153 HA ILE 23 HA ILE 23 -5.875 -3.333 -10.141 154 HB ILE 23 HB ILE 23 -5.380 -0.472 -10.014 155 HG12 ILE 23 2HG1 ILE 23 -3.332 -1.715 -11.424 156 HG13 ILE 23 1HG1 ILE 23 -4.704 -2.800 -11.619 157 HG21 ILE 23 1HG2 ILE 23 -3.061 -0.502 -9.358 158 HG22 ILE 23 2HG2 ILE 23 -3.142 -2.227 -9.020 159 HG23 ILE 23 3HG2 ILE 23 -4.055 -1.090 -8.027 160 HD11 ILE 23 3HD1 ILE 23 -4.225 -0.153 -12.744 161 HD12 ILE 23 1HD1 ILE 23 -5.844 -0.370 -12.078 162 HD13 ILE 23 2HD1 ILE 23 -5.247 -1.469 -13.322 163 H HIS 24 H HIS 24 -4.033 -3.943 -8.808 164 HA HIS 24 HA HIS 24 -4.188 -5.299 -6.713 165 HB2 HIS 24 2HB HIS 24 -2.356 -2.900 -6.743 166 HB3 HIS 24 1HB HIS 24 -2.203 -4.242 -5.601 167 HD1 HIS 24 1HD HIS 24 0.234 -4.357 -6.804 168 HD2 HIS 24 2HD HIS 24 -3.029 -5.541 -9.078 169 HE1 HIS 24 1HE HIS 24 1.189 -5.691 -8.708 170 HE2 HIS 24 2HE HIS 24 -0.795 -6.254 -10.151 171 H TRP 25 H TRP 25 -4.484 -1.736 -6.218 172 HA TRP 25 HA TRP 25 -4.957 -1.591 -3.595 173 HB2 TRP 25 2HB TRP 25 -7.030 0.007 -4.387 174 HB3 TRP 25 1HB TRP 25 -5.351 0.504 -4.186 175 HD1 TRP 25 HD TRP 25 -7.850 -0.500 -6.950 176 HE1 TRP 25 1HE TRP 25 -7.056 0.572 -9.145 177 HE3 TRP 25 3HE TRP 25 -3.384 1.394 -5.354 178 HZ2 TRP 25 2HZ TRP 25 -4.825 2.029 -10.083 179 HZ3 TRP 25 3HZ TRP 25 -1.985 2.619 -6.957 180 HH2 TRP 25 HH TRP 25 -2.690 2.928 -9.273 181 H ARG 26 H ARG 26 -7.944 -1.556 -5.437 182 HA ARG 26 HA ARG 26 -9.919 -2.638 -5.125 183 HB2 ARG 26 2HB ARG 26 -8.359 -4.603 -3.430 184 HB3 ARG 26 1HB ARG 26 -9.972 -4.844 -4.113 185 HG2 ARG 26 2HG ARG 26 -8.755 -4.426 -6.384 186 HG3 ARG 26 1HG ARG 26 -7.315 -4.869 -5.466 187 HD2 ARG 26 2HD ARG 26 -9.347 -6.746 -4.835 188 HD3 ARG 26 1HD ARG 26 -9.311 -6.562 -6.596 189 HE ARG 26 HE ARG 26 -6.696 -6.874 -5.503 190 HH11 ARG 26 1HH1 ARG 26 -9.567 -8.630 -6.427 191 HH12 ARG 26 2HH1 ARG 26 -8.718 -10.110 -6.722 192 HH21 ARG 26 1HH2 ARG 26 -5.578 -8.819 -5.891 193 HH22 ARG 26 2HH2 ARG 26 -6.452 -10.217 -6.418 194 H THR 27 H THR 27 -7.981 -1.542 -2.493 195 HA THR 27 HA THR 27 -8.592 -0.369 -0.639 196 HB THR 27 HB THR 27 -11.460 -1.153 -1.184 197 HG1 THR 27 1HG THR 27 -10.278 0.080 -2.891 198 HG21 THR 27 3HG2 THR 27 -11.548 -0.255 0.909 199 HG22 THR 27 1HG2 THR 27 -11.724 1.196 -0.079 200 HG23 THR 27 2HG2 THR 27 -10.162 0.799 0.638 201 H LEU 28 H LEU 28 -9.348 -0.773 1.576 202 HA LEU 28 HA LEU 28 -8.491 -3.203 2.555 203 HB2 LEU 28 2HB LEU 28 -9.256 -0.841 3.658 204 HB3 LEU 28 1HB LEU 28 -10.585 -1.886 4.161 205 HG LEU 28 HG LEU 28 -8.008 -3.144 4.628 206 HD11 LEU 28 1HD1 LEU 28 -7.308 -1.664 6.464 207 HD12 LEU 28 2HD1 LEU 28 -8.528 -0.493 5.963 208 HD13 LEU 28 3HD1 LEU 28 -7.187 -0.883 4.885 209 HD21 LEU 28 3HD2 LEU 28 -9.750 -2.363 6.866 210 HD22 LEU 28 1HD2 LEU 28 -9.072 -3.936 6.446 211 HD23 LEU 28 2HD2 LEU 28 -10.512 -3.347 5.616 212 H GLU 29 H GLU 29 -11.730 -2.246 1.571 213 HA GLU 29 HA GLU 29 -13.291 -4.217 2.660 214 HB2 GLU 29 2HB GLU 29 -13.498 -2.380 0.481 215 HB3 GLU 29 1HB GLU 29 -14.120 -3.935 -0.049 216 HG2 GLU 29 2HG GLU 29 -15.671 -3.985 1.803 217 HG3 GLU 29 1HG GLU 29 -15.005 -2.478 2.431 218 H ASP 30 H ASP 30 -12.335 -4.509 -0.744 219 HA ASP 30 HA ASP 30 -12.517 -7.356 -0.665 220 HB2 ASP 30 2HB ASP 30 -12.883 -5.733 -2.665 221 HB3 ASP 30 1HB ASP 30 -11.126 -5.833 -2.850 222 H GLY 31 H GLY 31 -10.044 -5.137 0.106 223 HA2 GLY 31 2HA GLY 31 -7.814 -6.823 -0.549 224 HA3 GLY 31 1HA GLY 31 -7.771 -5.356 0.437 225 H LYS 32 H LYS 32 -9.968 -6.570 2.155 226 HA LYS 32 HA LYS 32 -8.145 -7.999 3.917 227 HB2 LYS 32 2HB LYS 32 -9.929 -6.099 4.495 228 HB3 LYS 32 1HB LYS 32 -10.973 -7.500 4.696 229 HG2 LYS 32 2HG LYS 32 -8.946 -8.365 6.146 230 HG3 LYS 32 1HG LYS 32 -8.624 -6.636 6.289 231 HD2 LYS 32 2HD LYS 32 -11.326 -7.835 6.846 232 HD3 LYS 32 1HD LYS 32 -10.084 -7.674 8.087 233 HE2 LYS 32 2HE LYS 32 -10.777 -5.287 6.454 234 HE3 LYS 32 1HE LYS 32 -11.910 -5.804 7.702 235 HZ1 LYS 32 3HZ LYS 32 -10.410 -4.211 8.627 236 HZ2 LYS 32 1HZ LYS 32 -9.059 -5.072 8.083 237 HZ3 LYS 32 2HZ LYS 32 -10.043 -5.720 9.297 238 H LYS 33 H LYS 33 -11.505 -8.491 2.783 239 HA LYS 33 HA LYS 33 -11.726 -11.135 3.646 240 HB2 LYS 33 2HB LYS 33 -13.541 -11.314 1.898 241 HB3 LYS 33 1HB LYS 33 -13.719 -10.005 3.058 242 HG2 LYS 33 2HG LYS 33 -12.339 -8.789 1.034 243 HG3 LYS 33 1HG LYS 33 -13.388 -9.920 0.160 244 HD2 LYS 33 2HD LYS 33 -15.262 -9.006 1.675 245 HD3 LYS 33 1HD LYS 33 -14.147 -7.680 2.005 246 HE2 LYS 33 2HE LYS 33 -14.594 -6.718 0.046 247 HE3 LYS 33 1HE LYS 33 -14.308 -8.223 -0.826 248 HZ1 LYS 33 3HZ LYS 33 -16.823 -7.126 0.213 249 HZ2 LYS 33 1HZ LYS 33 -16.653 -8.808 0.113 250 HZ3 LYS 33 2HZ LYS 33 -16.502 -7.858 -1.278 251 H GLU 34 H GLU 34 -10.074 -9.814 0.913 252 HA GLU 34 HA GLU 34 -9.894 -12.394 -0.423 253 HB2 GLU 34 2HB GLU 34 -10.176 -10.223 -1.678 254 HB3 GLU 34 1HB GLU 34 -8.527 -9.817 -1.198 255 HG2 GLU 34 2HG GLU 34 -7.650 -11.086 -2.792 256 HG3 GLU 34 1HG GLU 34 -8.692 -12.456 -2.378 257 H ALA 35 H ALA 35 -7.593 -9.969 0.836 258 HA ALA 35 HA ALA 35 -5.257 -11.395 0.572 259 HB1 ALA 35 1HB ALA 35 -5.192 -9.111 1.269 260 HB2 ALA 35 2HB ALA 35 -4.424 -10.080 2.529 261 HB3 ALA 35 3HB ALA 35 -6.068 -9.483 2.753 262 H ALA 36 H ALA 36 -7.832 -11.866 2.855 263 HA ALA 36 HA ALA 36 -6.420 -13.428 4.748 264 HB1 ALA 36 1HB ALA 36 -9.326 -13.084 4.095 265 HB2 ALA 36 2HB ALA 36 -8.432 -12.515 5.505 266 HB3 ALA 36 3HB ALA 36 -8.786 -14.234 5.318 267 H ALA 37 H ALA 37 -8.733 -14.411 2.208 268 HA ALA 37 HA ALA 37 -8.333 -17.167 2.478 269 HB1 ALA 37 1HB ALA 37 -9.522 -15.392 0.435 270 HB2 ALA 37 2HB ALA 37 -10.199 -16.803 1.248 271 HB3 ALA 37 3HB ALA 37 -9.070 -17.014 -0.090 272 H SER 38 H SER 38 -7.183 -15.184 -0.254 273 HA SER 38 HA SER 38 -5.361 -17.065 -1.223 274 HB2 SER 38 2HB SER 38 -5.849 -14.168 -1.629 275 HB3 SER 38 1HB SER 38 -4.240 -14.757 -2.078 276 HG SER 38 HG SER 38 -6.662 -15.955 -2.948 277 H GLY 39 H GLY 39 -5.059 -14.674 1.307 278 HA2 GLY 39 2HA GLY 39 -3.473 -14.533 2.985 279 HA3 GLY 39 1HA GLY 39 -2.655 -15.925 2.269 280 H LEU 40 H LEU 40 -3.432 -12.939 0.566 281 HA LEU 40 HA LEU 40 -0.558 -12.547 0.148 282 HB2 LEU 40 2HB LEU 40 -1.237 -11.063 -1.723 283 HB3 LEU 40 1HB LEU 40 -1.764 -12.723 -1.908 284 HG LEU 40 HG LEU 40 -4.030 -11.987 -1.064 285 HD11 LEU 40 1HD1 LEU 40 -4.058 -9.970 -0.097 286 HD12 LEU 40 2HD1 LEU 40 -4.125 -9.347 -1.744 287 HD13 LEU 40 3HD1 LEU 40 -2.579 -9.458 -0.906 288 HD21 LEU 40 3HD2 LEU 40 -3.811 -10.380 -3.448 289 HD22 LEU 40 1HD2 LEU 40 -4.604 -11.939 -3.209 290 HD23 LEU 40 2HD2 LEU 40 -2.886 -11.875 -3.606 291 HA PRO 41 HA PRO 41 -0.517 -8.958 2.733 292 HB2 PRO 41 2HB PRO 41 1.629 -7.668 1.695 293 HB3 PRO 41 1HB PRO 41 1.789 -9.138 2.659 294 HG2 PRO 41 2HG PRO 41 1.827 -8.816 -0.316 295 HG3 PRO 41 1HG PRO 41 2.884 -9.798 0.716 296 HD2 PRO 41 2HD PRO 41 0.809 -10.856 -0.658 297 HD3 PRO 41 1HD PRO 41 1.334 -11.491 0.914 298 H LEU 42 H LEU 42 -0.463 -6.486 2.530 299 HA LEU 42 HA LEU 42 -1.861 -5.738 0.059 300 HB2 LEU 42 2HB LEU 42 -2.379 -3.734 1.916 301 HB3 LEU 42 1HB LEU 42 -3.478 -4.976 1.362 302 HG LEU 42 HG LEU 42 -1.661 -5.519 3.678 303 HD11 LEU 42 1HD1 LEU 42 -2.827 -4.278 5.128 304 HD12 LEU 42 2HD1 LEU 42 -4.367 -4.647 4.351 305 HD13 LEU 42 3HD1 LEU 42 -3.340 -3.366 3.708 306 HD21 LEU 42 3HD2 LEU 42 -4.322 -6.557 2.728 307 HD22 LEU 42 1HD2 LEU 42 -3.633 -6.948 4.303 308 HD23 LEU 42 2HD2 LEU 42 -2.794 -7.431 2.828 309 H MET 43 H MET 43 -1.694 -3.279 -0.316 310 HA MET 43 HA MET 43 1.035 -2.338 0.211 311 HB2 MET 43 2HB MET 43 0.671 -3.454 -2.101 312 HB3 MET 43 1HB MET 43 -0.241 -1.990 -2.491 313 HG2 MET 43 2HG MET 43 2.594 -1.946 -1.489 314 HG3 MET 43 1HG MET 43 2.176 -2.030 -3.199 315 HE1 MET 43 3HE MET 43 1.903 1.521 -0.373 316 HE2 MET 43 1HE MET 43 3.346 0.544 -0.636 317 HE3 MET 43 2HE MET 43 1.908 -0.182 0.080 318 H VAL 44 H VAL 44 -0.139 -1.027 1.797 319 HA VAL 44 HA VAL 44 -2.180 0.744 1.239 320 HB VAL 44 HB VAL 44 0.062 0.855 3.230 321 HG11 VAL 44 1HG1 VAL 44 -1.412 2.753 4.257 322 HG12 VAL 44 2HG1 VAL 44 -1.908 3.007 2.585 323 HG13 VAL 44 3HG1 VAL 44 -0.206 3.139 3.029 324 HG21 VAL 44 3HG2 VAL 44 -2.930 0.566 3.495 325 HG22 VAL 44 1HG2 VAL 44 -1.759 0.519 4.817 326 HG23 VAL 44 2HG2 VAL 44 -1.745 -0.742 3.586 327 H ILE 45 H ILE 45 -2.005 1.721 -0.738 328 HA ILE 45 HA ILE 45 0.295 3.456 -1.236 329 HB ILE 45 HB ILE 45 -0.306 2.092 -3.113 330 HG12 ILE 45 2HG1 ILE 45 -1.585 4.557 -4.101 331 HG13 ILE 45 1HG1 ILE 45 -0.037 4.787 -3.278 332 HG21 ILE 45 1HG2 ILE 45 -2.355 1.381 -3.452 333 HG22 ILE 45 2HG2 ILE 45 -2.856 3.017 -3.869 334 HG23 ILE 45 3HG2 ILE 45 -2.943 2.468 -2.197 335 HD11 ILE 45 3HD1 ILE 45 -0.638 3.249 -5.772 336 HD12 ILE 45 1HD1 ILE 45 0.820 2.933 -4.834 337 HD13 ILE 45 2HD1 ILE 45 0.539 4.535 -5.516 338 H ILE 46 H ILE 46 0.074 5.364 -0.155 339 HA ILE 46 HA ILE 46 -2.516 6.750 -0.438 340 HB ILE 46 HB ILE 46 -0.626 7.463 1.763 341 HG12 ILE 46 2HG1 ILE 46 -2.731 5.528 2.473 342 HG13 ILE 46 1HG1 ILE 46 -1.423 4.858 1.498 343 HG21 ILE 46 1HG2 ILE 46 -2.404 8.948 1.650 344 HG22 ILE 46 2HG2 ILE 46 -2.951 7.790 2.860 345 HG23 ILE 46 3HG2 ILE 46 -3.553 7.691 1.207 346 HD11 ILE 46 3HD1 ILE 46 -0.687 6.528 3.835 347 HD12 ILE 46 1HD1 ILE 46 0.112 5.109 3.156 348 HD13 ILE 46 2HD1 ILE 46 -1.338 4.918 4.141 349 H HIS 47 H HIS 47 -2.534 8.886 -1.018 350 HA HIS 47 HA HIS 47 0.033 10.210 -1.462 351 HB2 HIS 47 2HB HIS 47 -2.022 9.727 -3.624 352 HB3 HIS 47 1HB HIS 47 -0.633 10.810 -3.777 353 HD1 HIS 47 1HD HIS 47 1.339 9.798 -4.810 354 HD2 HIS 47 2HD HIS 47 -1.086 6.932 -3.011 355 HE1 HIS 47 1HE HIS 47 2.424 7.589 -5.321 356 HE2 HIS 47 2HE HIS 47 0.968 5.877 -4.201 357 H LYS 48 H LYS 48 -0.160 12.075 -0.416 358 HA LYS 48 HA LYS 48 -2.660 13.607 -0.848 359 HB2 LYS 48 2HB LYS 48 -1.601 12.675 1.633 360 HB3 LYS 48 1HB LYS 48 -1.519 14.430 1.619 361 HG2 LYS 48 2HG LYS 48 -3.647 14.451 2.222 362 HG3 LYS 48 1HG LYS 48 -4.042 13.844 0.614 363 HD2 LYS 48 2HD LYS 48 -5.035 12.224 1.876 364 HD3 LYS 48 1HD LYS 48 -3.421 11.528 1.743 365 HE2 LYS 48 2HE LYS 48 -4.060 11.373 4.028 366 HE3 LYS 48 1HE LYS 48 -2.862 12.661 3.912 367 HZ1 LYS 48 3HZ LYS 48 -5.680 12.808 4.594 368 HZ2 LYS 48 1HZ LYS 48 -5.108 14.048 3.597 369 HZ3 LYS 48 2HZ LYS 48 -4.390 13.776 5.103 370 H SER 49 H SER 49 -2.024 15.967 0.341 371 HA SER 49 HA SER 49 -0.825 17.904 0.171 372 HB2 SER 49 2HB SER 49 1.465 17.840 0.018 373 HB3 SER 49 1HB SER 49 1.173 16.140 0.372 374 HG SER 49 HG SER 49 2.372 17.157 -1.737 375 H TRP 50 H TRP 50 0.846 18.796 -1.939 376 HA TRP 50 HA TRP 50 -0.916 19.745 -3.802 377 HB2 TRP 50 2HB TRP 50 1.186 19.801 -5.366 378 HB3 TRP 50 1HB TRP 50 1.168 20.771 -3.887 379 HD1 TRP 50 HD TRP 50 2.807 17.663 -5.415 380 HE1 TRP 50 1HE TRP 50 4.874 17.052 -4.009 381 HE3 TRP 50 3HE TRP 50 2.164 20.951 -1.552 382 HZ2 TRP 50 2HZ TRP 50 6.072 17.855 -1.583 383 HZ3 TRP 50 3HZ TRP 50 3.816 20.965 0.271 384 HH2 TRP 50 HH TRP 50 5.729 19.448 0.255 385 H CYS 51 H CYS 51 0.592 16.622 -3.681 386 HA CYS 51 HA CYS 51 0.042 14.677 -4.703 387 HB2 CYS 51 2HB CYS 51 -2.241 16.183 -5.110 388 HB3 CYS 51 1HB CYS 51 -1.795 15.704 -6.741 389 H GLY 52 H GLY 52 1.595 13.871 -5.946 390 HA2 GLY 52 2HA GLY 52 2.021 15.011 -8.637 391 HA3 GLY 52 1HA GLY 52 3.402 14.697 -7.585 392 H ALA 53 H ALA 53 3.164 12.380 -6.528 393 HA ALA 53 HA ALA 53 3.507 10.504 -8.605 394 HB1 ALA 53 1HB ALA 53 4.559 10.315 -6.366 395 HB2 ALA 53 2HB ALA 53 3.721 8.846 -6.866 396 HB3 ALA 53 3HB ALA 53 2.976 9.932 -5.696 397 H CYS 54 H CYS 54 0.768 11.812 -7.208 398 HA CYS 54 HA CYS 54 -0.891 9.525 -7.815 399 HB2 CYS 54 2HB CYS 54 -2.646 11.517 -7.081 400 HB3 CYS 54 1HB CYS 54 -1.938 10.332 -5.976 401 H LYS 55 H LYS 55 -0.338 12.851 -8.874 402 HA LYS 55 HA LYS 55 -2.373 12.731 -10.896 403 HB2 LYS 55 2HB LYS 55 -1.497 14.914 -11.621 404 HB3 LYS 55 1HB LYS 55 -1.837 14.870 -9.897 405 HG2 LYS 55 2HG LYS 55 0.286 15.266 -9.344 406 HG3 LYS 55 1HG LYS 55 0.916 14.163 -10.580 407 HD2 LYS 55 2HD LYS 55 1.216 15.818 -12.071 408 HD3 LYS 55 1HD LYS 55 -0.301 16.612 -11.643 409 HE2 LYS 55 2HE LYS 55 0.779 17.512 -9.616 410 HE3 LYS 55 1HE LYS 55 2.297 16.767 -10.116 411 HZ1 LYS 55 3HZ LYS 55 1.053 19.192 -11.037 412 HZ2 LYS 55 1HZ LYS 55 1.570 18.189 -12.299 413 HZ3 LYS 55 2HZ LYS 55 2.671 18.706 -11.124 414 H ALA 56 H ALA 56 1.142 12.285 -10.807 415 HA ALA 56 HA ALA 56 1.372 12.114 -13.676 416 HB1 ALA 56 1HB ALA 56 3.601 12.050 -13.333 417 HB2 ALA 56 2HB ALA 56 3.470 10.883 -12.018 418 HB3 ALA 56 3HB ALA 56 3.163 12.593 -11.714 419 H LEU 57 H LEU 57 0.280 10.008 -11.268 420 HA LEU 57 HA LEU 57 0.963 7.641 -12.826 421 HB2 LEU 57 2HB LEU 57 -0.071 8.076 -10.051 422 HB3 LEU 57 1HB LEU 57 -0.182 6.500 -10.815 423 HG LEU 57 HG LEU 57 1.823 6.907 -9.295 424 HD11 LEU 57 1HD1 LEU 57 1.656 5.047 -10.897 425 HD12 LEU 57 2HD1 LEU 57 3.309 5.625 -10.707 426 HD13 LEU 57 3HD1 LEU 57 2.378 6.070 -12.137 427 HD21 LEU 57 3HD2 LEU 57 3.057 8.273 -11.651 428 HD22 LEU 57 1HD2 LEU 57 3.586 8.242 -9.969 429 HD23 LEU 57 2HD2 LEU 57 2.192 9.215 -10.438 430 H LYS 58 H LYS 58 -1.737 9.739 -12.262 431 HA LYS 58 HA LYS 58 -3.838 7.937 -12.662 432 HB2 LYS 58 2HB LYS 58 -4.135 10.594 -13.958 433 HB3 LYS 58 1HB LYS 58 -5.238 9.725 -12.912 434 HG2 LYS 58 2HG LYS 58 -3.936 10.350 -10.968 435 HG3 LYS 58 1HG LYS 58 -2.769 11.181 -11.999 436 HD2 LYS 58 2HD LYS 58 -5.670 11.912 -12.085 437 HD3 LYS 58 1HD LYS 58 -4.616 12.562 -10.828 438 HE2 LYS 58 2HE LYS 58 -3.081 13.336 -12.659 439 HE3 LYS 58 1HE LYS 58 -4.335 12.878 -13.809 440 HZ1 LYS 58 3HZ LYS 58 -4.954 15.006 -13.508 441 HZ2 LYS 58 1HZ LYS 58 -4.227 15.136 -11.985 442 HZ3 LYS 58 2HZ LYS 58 -5.737 14.392 -12.141 443 HA PRO 59 HA PRO 59 -3.464 8.556 -17.401 444 HB2 PRO 59 2HB PRO 59 -1.491 10.076 -18.414 445 HB3 PRO 59 1HB PRO 59 -3.018 10.782 -17.848 446 HG2 PRO 59 2HG PRO 59 -0.364 10.636 -16.464 447 HG3 PRO 59 1HG PRO 59 -1.504 11.990 -16.562 448 HD2 PRO 59 2HD PRO 59 -1.313 10.328 -14.398 449 HD3 PRO 59 1HD PRO 59 -2.804 11.185 -14.860 450 H LYS 60 H LYS 60 -0.550 8.336 -15.495 451 HA LYS 60 HA LYS 60 0.844 6.703 -17.443 452 HB2 LYS 60 2HB LYS 60 2.334 7.990 -16.191 453 HB3 LYS 60 1HB LYS 60 1.454 7.717 -14.696 454 HG2 LYS 60 2HG LYS 60 3.473 6.502 -14.542 455 HG3 LYS 60 1HG LYS 60 2.188 5.322 -14.790 456 HD2 LYS 60 2HD LYS 60 4.057 4.742 -16.191 457 HD3 LYS 60 1HD LYS 60 2.759 5.346 -17.223 458 HE2 LYS 60 2HE LYS 60 4.188 7.623 -16.585 459 HE3 LYS 60 1HE LYS 60 5.439 6.394 -16.784 460 HZ1 LYS 60 3HZ LYS 60 4.658 5.920 -18.971 461 HZ2 LYS 60 1HZ LYS 60 4.856 7.597 -18.855 462 HZ3 LYS 60 2HZ LYS 60 3.308 6.921 -18.781 463 H PHE 61 H PHE 61 0.117 6.156 -14.016 464 HA PHE 61 HA PHE 61 0.385 3.433 -13.985 465 HB2 PHE 61 2HB PHE 61 0.035 4.964 -12.011 466 HB3 PHE 61 1HB PHE 61 -1.693 4.891 -12.368 467 HD1 PHE 61 2HD PHE 61 -2.879 2.705 -12.244 468 HD2 PHE 61 1HD PHE 61 1.125 3.197 -10.889 469 HE1 PHE 61 2HE PHE 61 -3.062 0.618 -10.955 470 HE2 PHE 61 1HE PHE 61 0.952 1.112 -9.599 471 HZ PHE 61 HZ PHE 61 -1.144 -0.183 -9.629 472 H ALA 62 H ALA 62 -2.111 5.263 -15.510 473 HA ALA 62 HA ALA 62 -4.224 3.476 -15.515 474 HB1 ALA 62 1HB ALA 62 -3.677 5.817 -16.791 475 HB2 ALA 62 2HB ALA 62 -5.078 4.800 -17.127 476 HB3 ALA 62 3HB ALA 62 -3.634 4.670 -18.132 477 H GLU 63 H GLU 63 -1.078 3.257 -16.857 478 HA GLU 63 HA GLU 63 -1.461 1.227 -18.810 479 HB2 GLU 63 2HB GLU 63 0.527 2.903 -18.424 480 HB3 GLU 63 1HB GLU 63 1.115 1.656 -17.320 481 HG2 GLU 63 2HG GLU 63 2.155 0.901 -19.158 482 HG3 GLU 63 1HG GLU 63 0.595 0.150 -19.489 483 H SER 64 H SER 64 -1.497 1.234 -15.449 484 HA SER 64 HA SER 64 -0.419 -1.277 -14.850 485 HB2 SER 64 2HB SER 64 -2.415 0.503 -13.507 486 HB3 SER 64 1HB SER 64 -2.027 -1.073 -12.839 487 HG SER 64 HG SER 64 -0.347 1.163 -13.192 488 H THR 65 H THR 65 -2.776 -0.778 -17.000 489 HA THR 65 HA THR 65 -4.950 -2.332 -16.377 490 HB THR 65 HB THR 65 -3.632 -2.666 -19.054 491 HG1 THR 65 1HG THR 65 -3.686 -0.617 -19.434 492 HG21 THR 65 3HG2 THR 65 -5.811 -3.694 -18.724 493 HG22 THR 65 1HG2 THR 65 -5.887 -2.386 -19.904 494 HG23 THR 65 2HG2 THR 65 -6.484 -2.129 -18.265 495 H GLU 66 H GLU 66 -1.684 -3.264 -17.211 496 HA GLU 66 HA GLU 66 -2.265 -6.095 -17.217 497 HB2 GLU 66 2HB GLU 66 -0.173 -4.531 -18.200 498 HB3 GLU 66 1HB GLU 66 0.541 -5.394 -16.835 499 HG2 GLU 66 2HG GLU 66 -0.511 -7.487 -17.893 500 HG3 GLU 66 1HG GLU 66 -0.658 -6.497 -19.345 501 H ILE 67 H ILE 67 -1.109 -3.633 -15.017 502 HA ILE 67 HA ILE 67 -0.285 -5.473 -12.987 503 HB ILE 67 HB ILE 67 -1.182 -2.606 -12.653 504 HG12 ILE 67 2HG1 ILE 67 1.599 -3.721 -13.086 505 HG13 ILE 67 1HG1 ILE 67 0.657 -2.817 -14.281 506 HG21 ILE 67 1HG2 ILE 67 -1.154 -3.552 -10.518 507 HG22 ILE 67 2HG2 ILE 67 0.417 -2.765 -10.670 508 HG23 ILE 67 3HG2 ILE 67 0.284 -4.512 -10.866 509 HD11 ILE 67 3HD1 ILE 67 0.797 -1.290 -11.885 510 HD12 ILE 67 1HD1 ILE 67 1.452 -0.919 -13.481 511 HD13 ILE 67 2HD1 ILE 67 2.421 -1.826 -12.317 512 H SER 68 H SER 68 -3.287 -4.499 -14.214 513 HA SER 68 HA SER 68 -4.883 -4.751 -11.879 514 HB2 SER 68 2HB SER 68 -5.636 -3.612 -13.974 515 HB3 SER 68 1HB SER 68 -5.706 -5.188 -14.763 516 HG SER 68 HG SER 68 -7.745 -4.562 -13.951 517 H GLU 69 H GLU 69 -3.602 -6.972 -14.254 518 HA GLU 69 HA GLU 69 -5.129 -9.175 -13.180 519 HB2 GLU 69 2HB GLU 69 -3.571 -10.512 -14.800 520 HB3 GLU 69 1HB GLU 69 -4.900 -9.556 -15.438 521 HG2 GLU 69 2HG GLU 69 -3.289 -7.720 -15.857 522 HG3 GLU 69 1HG GLU 69 -1.992 -8.812 -15.375 523 H LEU 70 H LEU 70 -1.934 -7.817 -13.003 524 HA LEU 70 HA LEU 70 -0.571 -9.950 -11.790 525 HB2 LEU 70 2HB LEU 70 -0.207 -7.057 -12.064 526 HB3 LEU 70 1HB LEU 70 0.481 -7.705 -10.579 527 HG LEU 70 HG LEU 70 1.456 -9.478 -12.384 528 HD11 LEU 70 1HD1 LEU 70 1.867 -6.947 -13.863 529 HD12 LEU 70 2HD1 LEU 70 0.329 -7.780 -14.088 530 HD13 LEU 70 3HD1 LEU 70 1.843 -8.611 -14.444 531 HD21 LEU 70 3HD2 LEU 70 2.510 -7.812 -10.610 532 HD22 LEU 70 1HD2 LEU 70 2.958 -6.933 -12.072 533 HD23 LEU 70 2HD2 LEU 70 3.494 -8.596 -11.846 534 H SER 71 H SER 71 -3.044 -7.867 -10.627 535 HA SER 71 HA SER 71 -2.737 -7.633 -7.944 536 HB2 SER 71 2HB SER 71 -5.043 -7.935 -9.735 537 HB3 SER 71 1HB SER 71 -5.351 -8.388 -8.062 538 HG SER 71 HG SER 71 -5.315 -5.975 -9.045 539 H HIS 72 H HIS 72 -3.052 -10.629 -9.624 540 HA HIS 72 HA HIS 72 -4.152 -12.253 -7.638 541 HB2 HIS 72 2HB HIS 72 -2.887 -14.109 -8.795 542 HB3 HIS 72 1HB HIS 72 -3.920 -13.137 -9.853 543 HD1 HIS 72 1HD HIS 72 -2.772 -12.910 -12.025 544 HD2 HIS 72 2HD HIS 72 -0.112 -12.609 -8.847 545 HE1 HIS 72 1HE HIS 72 -0.534 -12.427 -13.065 546 HE2 HIS 72 2HE HIS 72 1.044 -12.169 -11.119 547 H ASN 73 H ASN 73 -1.245 -10.546 -7.718 548 HA ASN 73 HA ASN 73 0.194 -12.363 -5.980 549 HB2 ASN 73 2HB ASN 73 1.972 -10.656 -6.107 550 HB3 ASN 73 1HB ASN 73 1.439 -11.209 -7.694 551 HD21 ASN 73 1HD2 ASN 73 1.501 -9.597 -9.076 552 HD22 ASN 73 2HD2 ASN 73 0.968 -7.969 -8.765 553 H PHE 74 H PHE 74 -1.409 -9.222 -5.736 554 HA PHE 74 HA PHE 74 -2.097 -9.523 -3.059 555 HB2 PHE 74 2HB PHE 74 -0.605 -7.791 -2.048 556 HB3 PHE 74 1HB PHE 74 0.203 -9.292 -2.510 557 HD1 PHE 74 1HD PHE 74 -0.524 -5.890 -3.859 558 HD2 PHE 74 2HD PHE 74 2.170 -9.178 -3.646 559 HE1 PHE 74 1HE PHE 74 1.141 -4.609 -5.144 560 HE2 PHE 74 2HE PHE 74 3.837 -7.904 -4.929 561 HZ PHE 74 HZ PHE 74 3.325 -5.620 -5.683 562 H VAL 75 H VAL 75 -2.721 -7.279 -2.069 563 HA VAL 75 HA VAL 75 -3.887 -5.669 -4.243 564 HB VAL 75 HB VAL 75 -5.862 -5.308 -2.910 565 HG11 VAL 75 1HG1 VAL 75 -6.786 -7.276 -3.450 566 HG12 VAL 75 2HG1 VAL 75 -5.695 -8.179 -2.398 567 HG13 VAL 75 3HG1 VAL 75 -5.175 -7.715 -4.019 568 HG21 VAL 75 3HG2 VAL 75 -4.163 -6.362 -0.754 569 HG22 VAL 75 1HG2 VAL 75 -5.839 -6.906 -0.724 570 HG23 VAL 75 2HG2 VAL 75 -5.472 -5.182 -0.694 571 H MET 76 H MET 76 -4.398 -3.351 -3.668 572 HA MET 76 HA MET 76 -2.437 -2.391 -1.662 573 HB2 MET 76 2HB MET 76 -3.446 -0.580 -3.813 574 HB3 MET 76 1HB MET 76 -1.929 -0.531 -2.937 575 HG2 MET 76 2HG MET 76 -1.794 -2.913 -4.299 576 HG3 MET 76 1HG MET 76 -2.604 -1.829 -5.426 577 HE1 MET 76 3HE MET 76 -1.275 1.059 -5.169 578 HE2 MET 76 1HE MET 76 -1.695 0.062 -6.562 579 HE3 MET 76 2HE MET 76 -0.074 0.743 -6.422 580 H VAL 77 H VAL 77 -2.983 -0.107 -0.910 581 HA VAL 77 HA VAL 77 -5.859 0.125 -0.329 582 HB VAL 77 HB VAL 77 -3.886 1.053 1.702 583 HG11 VAL 77 1HG1 VAL 77 -6.390 1.392 1.817 584 HG12 VAL 77 2HG1 VAL 77 -5.624 0.675 3.236 585 HG13 VAL 77 3HG1 VAL 77 -6.511 -0.345 2.103 586 HG21 VAL 77 3HG2 VAL 77 -2.931 -0.977 1.786 587 HG22 VAL 77 1HG2 VAL 77 -4.251 -1.751 0.907 588 HG23 VAL 77 2HG2 VAL 77 -4.405 -1.433 2.638 589 H ASN 78 H ASN 78 -5.592 1.547 -2.263 590 HA ASN 78 HA ASN 78 -4.091 3.950 -1.912 591 HB2 ASN 78 2HB ASN 78 -4.619 2.736 -4.124 592 HB3 ASN 78 1HB ASN 78 -6.159 3.561 -4.031 593 HD21 ASN 78 1HD2 ASN 78 -3.431 5.206 -2.699 594 HD22 ASN 78 2HD2 ASN 78 -3.224 6.336 -4.002 595 H LEU 79 H LEU 79 -4.698 5.439 -0.549 596 HA LEU 79 HA LEU 79 -7.523 6.277 -0.625 597 HB2 LEU 79 2HB LEU 79 -7.691 6.458 1.685 598 HB3 LEU 79 1HB LEU 79 -6.835 4.948 1.448 599 HG LEU 79 HG LEU 79 -4.705 6.436 1.786 600 HD11 LEU 79 1HD1 LEU 79 -6.196 8.007 3.718 601 HD12 LEU 79 2HD1 LEU 79 -6.651 8.379 2.057 602 HD13 LEU 79 3HD1 LEU 79 -4.966 8.512 2.560 603 HD21 LEU 79 3HD2 LEU 79 -6.111 6.100 4.346 604 HD22 LEU 79 1HD2 LEU 79 -4.553 5.470 3.812 605 HD23 LEU 79 2HD2 LEU 79 -6.044 4.665 3.322 606 H GLU 80 H GLU 80 -7.919 8.502 -0.059 607 HA GLU 80 HA GLU 80 -5.567 10.230 -0.463 608 HB2 GLU 80 2HB GLU 80 -7.525 9.889 -2.306 609 HB3 GLU 80 1HB GLU 80 -8.184 11.247 -1.386 610 HG2 GLU 80 2HG GLU 80 -5.477 11.844 -1.826 611 HG3 GLU 80 1HG GLU 80 -6.105 11.216 -3.359 612 H ASP 81 H ASP 81 -6.698 12.675 -0.146 613 HA ASP 81 HA ASP 81 -6.647 13.175 2.529 614 HB2 ASP 81 2HB ASP 81 -6.787 14.782 0.466 615 HB3 ASP 81 1HB ASP 81 -8.511 14.786 0.826 616 H GLU 82 H GLU 82 -9.337 11.923 0.706 617 HA GLU 82 HA GLU 82 -11.524 12.530 2.223 618 HB2 GLU 82 2HB GLU 82 -10.811 10.494 0.332 619 HB3 GLU 82 1HB GLU 82 -11.763 9.772 1.623 620 HG2 GLU 82 2HG GLU 82 -12.821 12.306 0.609 621 HG3 GLU 82 1HG GLU 82 -12.780 10.999 -0.573 622 H GLU 83 H GLU 83 -8.899 10.396 3.058 623 HA GLU 83 HA GLU 83 -10.221 9.845 5.633 624 HB2 GLU 83 2HB GLU 83 -9.153 8.017 3.710 625 HB3 GLU 83 1HB GLU 83 -8.174 7.926 5.168 626 HG2 GLU 83 2HG GLU 83 -9.886 6.302 5.358 627 HG3 GLU 83 1HG GLU 83 -10.282 7.616 6.471 628 H GLU 84 H GLU 84 -9.319 11.534 6.763 629 HA GLU 84 HA GLU 84 -6.557 12.202 6.637 630 HB2 GLU 84 2HB GLU 84 -8.915 13.075 8.174 631 HB3 GLU 84 1HB GLU 84 -7.376 13.269 9.001 632 HG2 GLU 84 2HG GLU 84 -6.681 14.906 7.620 633 HG3 GLU 84 1HG GLU 84 -7.472 14.205 6.209 634 HA PRO 85 HA PRO 85 -5.379 8.783 9.339 635 HB2 PRO 85 2HB PRO 85 -2.714 9.029 9.010 636 HB3 PRO 85 1HB PRO 85 -3.758 8.298 7.777 637 HG2 PRO 85 2HG PRO 85 -2.642 11.079 7.916 638 HG3 PRO 85 1HG PRO 85 -2.747 9.981 6.520 639 HD2 PRO 85 2HD PRO 85 -4.516 12.005 6.956 640 HD3 PRO 85 1HD PRO 85 -4.953 10.495 6.125 641 H LYS 86 H LYS 86 -3.234 8.754 10.910 642 HA LYS 86 HA LYS 86 -2.542 11.109 12.259 643 HB2 LYS 86 2HB LYS 86 -3.854 10.864 14.327 644 HB3 LYS 86 1HB LYS 86 -4.889 11.180 12.929 645 HG2 LYS 86 2HG LYS 86 -6.071 9.373 13.402 646 HG3 LYS 86 1HG LYS 86 -4.635 8.371 13.190 647 HD2 LYS 86 2HD LYS 86 -4.935 7.845 15.352 648 HD3 LYS 86 1HD LYS 86 -4.216 9.425 15.672 649 HE2 LYS 86 2HE LYS 86 -6.831 10.074 15.239 650 HE3 LYS 86 1HE LYS 86 -6.975 8.499 16.017 651 HZ1 LYS 86 3HZ LYS 86 -6.897 9.833 17.837 652 HZ2 LYS 86 1HZ LYS 86 -5.946 11.016 17.090 653 HZ3 LYS 86 2HZ LYS 86 -5.237 9.584 17.642 654 H ASP 87 H ASP 87 -1.292 8.748 11.344 655 HA ASP 87 HA ASP 87 0.100 7.988 13.756 656 HB2 ASP 87 2HB ASP 87 -1.998 6.389 13.102 657 HB3 ASP 87 1HB ASP 87 -0.695 5.612 12.193 658 H GLU 88 H GLU 88 1.533 5.839 12.804 659 HA GLU 88 HA GLU 88 3.224 7.147 10.830 660 HB2 GLU 88 2HB GLU 88 3.602 4.745 12.608 661 HB3 GLU 88 1HB GLU 88 4.761 5.183 11.362 662 HG2 GLU 88 2HG GLU 88 3.937 6.891 13.699 663 HG3 GLU 88 1HG GLU 88 5.454 6.010 13.534 664 H ASP 89 H ASP 89 0.805 4.761 10.901 665 HA ASP 89 HA ASP 89 1.669 2.972 8.936 666 HB2 ASP 89 2HB ASP 89 -0.962 3.759 10.073 667 HB3 ASP 89 1HB ASP 89 -0.977 2.891 8.531 668 H PHE 90 H PHE 90 0.868 6.269 8.613 669 HA PHE 90 HA PHE 90 0.299 5.955 5.750 670 HB2 PHE 90 2HB PHE 90 -0.263 8.147 7.725 671 HB3 PHE 90 1HB PHE 90 -0.270 8.473 5.986 672 HD1 PHE 90 1HD PHE 90 -1.649 5.951 8.375 673 HD2 PHE 90 2HD PHE 90 -2.290 8.353 4.920 674 HE1 PHE 90 1HE PHE 90 -3.960 5.121 8.231 675 HE2 PHE 90 2HE PHE 90 -4.603 7.530 4.772 676 HZ PHE 90 HZ PHE 90 -5.442 5.911 6.428 677 H SER 91 H SER 91 2.696 7.053 7.972 678 HA SER 91 HA SER 91 4.600 7.444 5.887 679 HB2 SER 91 2HB SER 91 3.873 9.919 7.474 680 HB3 SER 91 1HB SER 91 5.086 9.790 6.189 681 HG SER 91 HG SER 91 3.175 9.092 4.866 682 HA PRO 92 HA PRO 92 6.341 6.377 10.040 683 HB2 PRO 92 2HB PRO 92 7.513 4.064 9.373 684 HB3 PRO 92 1HB PRO 92 5.773 4.156 9.714 685 HG2 PRO 92 2HG PRO 92 7.189 4.079 7.074 686 HG3 PRO 92 1HG PRO 92 5.725 3.218 7.584 687 HD2 PRO 92 2HD PRO 92 5.704 5.523 6.093 688 HD3 PRO 92 1HD PRO 92 4.376 5.012 7.151 689 H ASP 93 H ASP 93 7.909 5.910 6.874 690 HA ASP 93 HA ASP 93 10.373 7.044 8.025 691 HB2 ASP 93 2HB ASP 93 10.013 4.593 6.728 692 HB3 ASP 93 1HB ASP 93 10.786 5.631 5.523 693 H GLY 94 H GLY 94 9.349 9.142 7.536 694 HA2 GLY 94 2HA GLY 94 10.476 10.561 5.557 695 HA3 GLY 94 1HA GLY 94 9.081 9.858 4.733 696 H GLY 95 H GLY 95 8.524 12.176 4.453 697 HA2 GLY 95 2HA GLY 95 6.714 12.956 6.595 698 HA3 GLY 95 1HA GLY 95 8.013 14.096 6.237 699 H TYR 96 H TYR 96 6.851 12.320 3.525 700 HA TYR 96 HA TYR 96 5.569 14.758 2.563 701 HB2 TYR 96 2HB TYR 96 6.625 14.264 0.661 702 HB3 TYR 96 1HB TYR 96 7.221 12.761 1.369 703 HD1 TYR 96 2HD TYR 96 4.032 14.071 -0.108 704 HD2 TYR 96 1HD TYR 96 6.805 10.860 0.179 705 HE1 TYR 96 2HE TYR 96 2.702 12.790 -1.736 706 HE2 TYR 96 1HE TYR 96 5.486 9.569 -1.452 707 HH TYR 96 HH TYR 96 2.942 10.972 -3.284 708 H ILE 97 H ILE 97 3.576 14.850 3.312 709 HA ILE 97 HA ILE 97 1.849 12.765 3.885 710 HB ILE 97 HB ILE 97 0.031 14.563 3.586 711 HG12 ILE 97 2HG1 ILE 97 2.055 16.653 3.659 712 HG13 ILE 97 1HG1 ILE 97 2.035 15.780 2.125 713 HG21 ILE 97 1HG2 ILE 97 0.868 14.082 5.762 714 HG22 ILE 97 2HG2 ILE 97 0.841 15.836 5.573 715 HG23 ILE 97 3HG2 ILE 97 2.367 14.959 5.442 716 HD11 ILE 97 3HD1 ILE 97 -0.399 17.005 3.393 717 HD12 ILE 97 1HD1 ILE 97 -0.260 16.309 1.777 718 HD13 ILE 97 2HD1 ILE 97 0.598 17.799 2.171 719 HA PRO 98 HA PRO 98 1.624 10.563 3.215 720 HB2 PRO 98 2HB PRO 98 -0.814 9.642 1.645 721 HB3 PRO 98 1HB PRO 98 -0.184 8.976 3.177 722 HG2 PRO 98 2HG PRO 98 -1.840 11.265 2.790 723 HG3 PRO 98 1HG PRO 98 -1.186 10.610 4.317 724 HD2 PRO 98 2HD PRO 98 -0.293 12.900 3.553 725 HD3 PRO 98 1HD PRO 98 0.898 11.672 4.011 726 H ARG 99 H ARG 99 2.239 8.323 2.482 727 HA ARG 99 HA ARG 99 2.924 8.288 -0.389 728 HB2 ARG 99 2HB ARG 99 5.062 7.088 0.415 729 HB3 ARG 99 1HB ARG 99 4.960 8.841 0.600 730 HG2 ARG 99 2HG ARG 99 4.026 7.202 2.877 731 HG3 ARG 99 1HG ARG 99 5.760 7.215 2.557 732 HD2 ARG 99 2HD ARG 99 4.049 9.676 2.893 733 HD3 ARG 99 1HD ARG 99 5.034 8.958 4.166 734 HE ARG 99 HE ARG 99 5.929 10.673 2.101 735 HH11 ARG 99 1HH1 ARG 99 6.888 7.906 3.993 736 HH12 ARG 99 2HH1 ARG 99 8.583 8.195 3.791 737 HH21 ARG 99 1HH2 ARG 99 8.158 11.067 1.840 738 HH22 ARG 99 2HH2 ARG 99 9.307 9.995 2.571 739 H ILE 100 H ILE 100 4.092 5.879 -0.677 740 HA ILE 100 HA ILE 100 1.890 4.031 -0.116 741 HB ILE 100 HB ILE 100 2.816 2.622 -1.858 742 HG12 ILE 100 2HG1 ILE 100 4.783 4.150 -3.106 743 HG13 ILE 100 1HG1 ILE 100 5.191 4.247 -1.398 744 HG21 ILE 100 1HG2 ILE 100 1.939 3.843 -3.515 745 HG22 ILE 100 2HG2 ILE 100 3.026 5.202 -3.236 746 HG23 ILE 100 3HG2 ILE 100 1.588 5.002 -2.233 747 HD11 ILE 100 3HD1 ILE 100 4.596 1.562 -1.873 748 HD12 ILE 100 1HD1 ILE 100 6.183 2.284 -1.605 749 HD13 ILE 100 2HD1 ILE 100 5.567 2.091 -3.247 750 H LEU 101 H LEU 101 2.095 2.842 1.678 751 HA LEU 101 HA LEU 101 4.757 1.860 2.447 752 HB2 LEU 101 2HB LEU 101 2.277 2.298 4.100 753 HB3 LEU 101 1HB LEU 101 3.739 1.550 4.703 754 HG LEU 101 HG LEU 101 4.824 3.531 4.940 755 HD11 LEU 101 1HD1 LEU 101 4.864 4.055 2.557 756 HD12 LEU 101 2HD1 LEU 101 4.543 5.487 3.530 757 HD13 LEU 101 3HD1 LEU 101 3.222 4.693 2.667 758 HD21 LEU 101 3HD2 LEU 101 3.279 5.325 5.589 759 HD22 LEU 101 1HD2 LEU 101 2.817 3.760 6.254 760 HD23 LEU 101 2HD2 LEU 101 1.948 4.421 4.867 761 H PHE 102 H PHE 102 5.146 -0.302 2.616 762 HA PHE 102 HA PHE 102 3.020 -2.097 1.757 763 HB2 PHE 102 2HB PHE 102 5.979 -2.317 2.114 764 HB3 PHE 102 1HB PHE 102 5.016 -3.792 2.131 765 HD1 PHE 102 2HD PHE 102 6.161 -0.964 0.107 766 HD2 PHE 102 1HD PHE 102 3.932 -4.588 0.136 767 HE1 PHE 102 2HE PHE 102 6.153 -0.973 -2.353 768 HE2 PHE 102 1HE PHE 102 3.921 -4.606 -2.324 769 HZ PHE 102 HZ PHE 102 5.030 -2.795 -3.572 770 H LEU 103 H LEU 103 2.206 -3.823 3.026 771 HA LEU 103 HA LEU 103 3.061 -3.974 5.803 772 HB2 LEU 103 2HB LEU 103 0.930 -3.509 6.746 773 HB3 LEU 103 1HB LEU 103 1.361 -2.179 5.696 774 HG LEU 103 HG LEU 103 -0.701 -4.305 5.229 775 HD11 LEU 103 1HD1 LEU 103 -0.809 -1.306 5.377 776 HD12 LEU 103 2HD1 LEU 103 -1.443 -2.448 6.559 777 HD13 LEU 103 3HD1 LEU 103 -2.165 -2.348 4.953 778 HD21 LEU 103 3HD2 LEU 103 -1.051 -2.942 3.056 779 HD22 LEU 103 1HD2 LEU 103 0.216 -4.166 3.102 780 HD23 LEU 103 2HD2 LEU 103 0.630 -2.460 3.284 781 H ASP 104 H ASP 104 1.942 -5.688 7.027 782 HA ASP 104 HA ASP 104 1.863 -8.099 5.470 783 HB2 ASP 104 2HB ASP 104 2.887 -8.400 7.543 784 HB3 ASP 104 1HB ASP 104 1.676 -7.434 8.393 785 HA PRO 105 HA PRO 105 -2.418 -8.560 4.544 786 HB2 PRO 105 2HB PRO 105 -2.728 -11.236 5.300 787 HB3 PRO 105 1HB PRO 105 -2.220 -10.654 3.704 788 HG2 PRO 105 2HG PRO 105 -0.577 -11.673 5.976 789 HG3 PRO 105 1HG PRO 105 -0.328 -11.860 4.225 790 HD2 PRO 105 2HD PRO 105 1.134 -10.141 5.680 791 HD3 PRO 105 1HD PRO 105 0.643 -9.768 4.019 792 H SER 106 H SER 106 -3.168 -7.192 6.192 793 HA SER 106 HA SER 106 -5.141 -8.033 7.821 794 HB2 SER 106 2HB SER 106 -3.946 -7.870 10.137 795 HB3 SER 106 1HB SER 106 -3.867 -9.395 9.239 796 HG SER 106 HG SER 106 -1.876 -7.476 9.695 797 H GLY 107 H GLY 107 -2.505 -5.867 7.281 798 HA2 GLY 107 2HA GLY 107 -2.996 -3.518 6.994 799 HA3 GLY 107 1HA GLY 107 -4.158 -3.658 8.318 800 H LYS 108 H LYS 108 -0.838 -4.904 8.146 801 HA LYS 108 HA LYS 108 -0.216 -3.179 10.460 802 HB2 LYS 108 2HB LYS 108 -0.038 -6.005 10.150 803 HB3 LYS 108 1HB LYS 108 1.592 -5.374 10.339 804 HG2 LYS 108 2HG LYS 108 0.021 -4.055 12.256 805 HG3 LYS 108 1HG LYS 108 -0.447 -5.764 12.310 806 HD2 LYS 108 2HD LYS 108 2.453 -5.121 12.187 807 HD3 LYS 108 1HD LYS 108 1.609 -4.809 13.705 808 HE2 LYS 108 2HE LYS 108 0.880 -7.388 12.643 809 HE3 LYS 108 1HE LYS 108 2.631 -7.249 12.792 810 HZ1 LYS 108 3HZ LYS 108 1.076 -7.988 14.793 811 HZ2 LYS 108 1HZ LYS 108 1.052 -6.316 15.054 812 HZ3 LYS 108 2HZ LYS 108 2.525 -7.148 15.032 813 H VAL 109 H VAL 109 0.402 -1.580 8.754 814 HA VAL 109 HA VAL 109 2.581 -1.950 7.019 815 HB VAL 109 HB VAL 109 1.018 0.301 7.964 816 HG11 VAL 109 1HG1 VAL 109 2.993 1.109 9.056 817 HG12 VAL 109 2HG1 VAL 109 2.760 2.044 7.579 818 HG13 VAL 109 3HG1 VAL 109 3.980 0.773 7.633 819 HG21 VAL 109 3HG2 VAL 109 0.812 -0.233 5.719 820 HG22 VAL 109 1HG2 VAL 109 2.551 -0.421 5.500 821 HG23 VAL 109 2HG2 VAL 109 1.852 1.188 5.688 822 H HIS 110 H HIS 110 4.726 -1.625 7.182 823 HA HIS 110 HA HIS 110 5.877 -0.859 9.733 824 HB2 HIS 110 2HB HIS 110 5.712 -3.608 8.852 825 HB3 HIS 110 1HB HIS 110 7.393 -3.105 8.988 826 HD1 HIS 110 1HD HIS 110 8.293 -2.602 11.341 827 HD2 HIS 110 2HD HIS 110 4.290 -3.713 11.278 828 HE1 HIS 110 1HE HIS 110 7.684 -3.059 13.738 829 HE2 HIS 110 2HE HIS 110 5.228 -3.614 13.685 830 HA PRO 111 HA PRO 111 8.703 1.069 6.928 831 HB2 PRO 111 2HB PRO 111 10.758 1.562 8.631 832 HB3 PRO 111 1HB PRO 111 9.249 2.483 8.662 833 HG2 PRO 111 2HG PRO 111 10.105 0.200 10.398 834 HG3 PRO 111 1HG PRO 111 9.309 1.716 10.860 835 HD2 PRO 111 2HD PRO 111 7.961 -0.612 10.591 836 HD3 PRO 111 1HD PRO 111 7.231 0.963 10.203 837 H GLU 112 H GLU 112 8.651 -1.772 6.824 838 HA GLU 112 HA GLU 112 11.509 -2.460 6.706 839 HB2 GLU 112 2HB GLU 112 10.785 -4.806 6.717 840 HB3 GLU 112 1HB GLU 112 10.193 -3.936 8.125 841 HG2 GLU 112 2HG GLU 112 7.998 -3.820 7.239 842 HG3 GLU 112 1HG GLU 112 8.536 -4.391 5.662 843 H ILE 113 H ILE 113 8.546 -2.305 4.818 844 HA ILE 113 HA ILE 113 10.134 -3.005 2.435 845 HB ILE 113 HB ILE 113 7.194 -3.498 2.904 846 HG12 ILE 113 2HG1 ILE 113 9.193 -5.615 2.229 847 HG13 ILE 113 1HG1 ILE 113 9.140 -4.997 3.887 848 HG21 ILE 113 1HG2 ILE 113 7.158 -4.522 0.701 849 HG22 ILE 113 2HG2 ILE 113 8.860 -4.123 0.468 850 HG23 ILE 113 3HG2 ILE 113 7.659 -2.836 0.578 851 HD11 ILE 113 3HD1 ILE 113 7.246 -6.714 2.437 852 HD12 ILE 113 1HD1 ILE 113 6.525 -5.476 3.465 853 HD13 ILE 113 2HD1 ILE 113 7.648 -6.648 4.153 854 H ILE 114 H ILE 114 10.670 -1.174 1.503 855 HA ILE 114 HA ILE 114 8.621 0.901 1.081 856 HB ILE 114 HB ILE 114 10.429 2.504 0.833 857 HG12 ILE 114 2HG1 ILE 114 12.052 0.647 0.005 858 HG13 ILE 114 1HG1 ILE 114 12.705 2.001 0.913 859 HG21 ILE 114 1HG2 ILE 114 9.919 1.029 3.276 860 HG22 ILE 114 2HG2 ILE 114 10.021 2.767 3.000 861 HG23 ILE 114 3HG2 ILE 114 11.488 1.834 3.287 862 HD11 ILE 114 3HD1 ILE 114 11.945 -0.177 2.655 863 HD12 ILE 114 1HD1 ILE 114 13.492 0.654 2.489 864 HD13 ILE 114 2HD1 ILE 114 13.093 -0.689 1.419 865 H ASN 115 H ASN 115 9.675 2.343 -0.908 866 HA ASN 115 HA ASN 115 9.614 0.484 -3.166 867 HB2 ASN 115 2HB ASN 115 7.998 2.312 -3.238 868 HB3 ASN 115 1HB ASN 115 9.296 3.496 -3.050 869 HD21 ASN 115 1HD2 ASN 115 8.613 4.487 -4.983 870 HD22 ASN 115 2HD2 ASN 115 9.017 3.796 -6.529 871 H GLU 116 H GLU 116 11.761 -0.266 -2.970 872 HA GLU 116 HA GLU 116 14.076 1.141 -2.659 873 HB2 GLU 116 2HB GLU 116 13.414 -1.338 -4.197 874 HB3 GLU 116 1HB GLU 116 15.041 -0.658 -4.312 875 HG2 GLU 116 2HG GLU 116 13.707 -1.319 -1.701 876 HG3 GLU 116 1HG GLU 116 14.722 -2.454 -2.589 877 H ASN 117 H ASN 117 12.042 1.061 -5.486 878 HA ASN 117 HA ASN 117 13.917 2.048 -7.352 879 HB2 ASN 117 2HB ASN 117 10.996 1.679 -7.241 880 HB3 ASN 117 1HB ASN 117 11.535 2.993 -8.297 881 HD21 ASN 117 1HD2 ASN 117 12.168 -0.405 -7.532 882 HD22 ASN 117 2HD2 ASN 117 12.547 -0.881 -9.166 883 H GLY 118 H GLY 118 12.029 3.573 -4.861 884 HA2 GLY 118 2HA GLY 118 11.975 6.209 -5.789 885 HA3 GLY 118 1HA GLY 118 11.985 5.732 -4.089 886 H ASN 119 H ASN 119 13.207 7.847 -4.057 887 HA ASN 119 HA ASN 119 16.029 7.516 -4.785 888 HB2 ASN 119 2HB ASN 119 16.214 9.944 -4.405 889 HB3 ASN 119 1HB ASN 119 14.944 9.567 -5.577 890 HD21 ASN 119 1HD2 ASN 119 15.651 10.663 -2.350 891 HD22 ASN 119 2HD2 ASN 119 14.066 11.301 -2.005 892 HA PRO 120 HA PRO 120 17.370 7.163 -0.596 893 HB2 PRO 120 2HB PRO 120 19.535 9.084 -0.881 894 HB3 PRO 120 1HB PRO 120 19.615 7.314 -0.831 895 HG2 PRO 120 2HG PRO 120 20.156 8.776 -3.068 896 HG3 PRO 120 1HG PRO 120 19.514 7.117 -3.113 897 HD2 PRO 120 2HD PRO 120 18.068 9.724 -3.451 898 HD3 PRO 120 1HD PRO 120 17.880 8.201 -4.357 899 H SER 121 H SER 121 15.256 8.925 -0.632 900 HA SER 121 HA SER 121 15.437 10.289 1.747 901 HB2 SER 121 2HB SER 121 16.477 11.841 -0.549 902 HB3 SER 121 1HB SER 121 15.284 12.687 0.451 903 HG SER 121 HG SER 121 17.683 12.718 1.018 904 H TYR 122 H TYR 122 13.642 8.691 0.438 905 HA TYR 122 HA TYR 122 11.224 10.126 0.713 906 HB2 TYR 122 2HB TYR 122 12.489 10.088 -1.902 907 HB3 TYR 122 1HB TYR 122 10.889 9.354 -1.943 908 HD1 TYR 122 2HD TYR 122 9.284 10.928 -0.162 909 HD2 TYR 122 1HD TYR 122 12.399 12.211 -2.758 910 HE1 TYR 122 2HE TYR 122 8.287 13.174 -0.248 911 HE2 TYR 122 1HE TYR 122 11.410 14.459 -2.849 912 HH TYR 122 HH TYR 122 9.734 15.805 -1.038 913 H LYS 123 H LYS 123 12.768 7.400 -0.923 914 HA LYS 123 HA LYS 123 12.254 5.193 -1.090 915 HB2 LYS 123 2HB LYS 123 11.321 5.882 1.677 916 HB3 LYS 123 1HB LYS 123 11.140 4.252 1.052 917 HG2 LYS 123 2HG LYS 123 13.679 5.778 1.551 918 HG3 LYS 123 1HG LYS 123 13.137 4.263 2.294 919 HD2 LYS 123 2HD LYS 123 14.511 3.316 0.784 920 HD3 LYS 123 1HD LYS 123 13.158 3.570 -0.327 921 HE2 LYS 123 2HE LYS 123 14.197 5.276 -1.412 922 HE3 LYS 123 1HE LYS 123 15.042 5.826 0.033 923 HZ1 LYS 123 3HZ LYS 123 16.579 3.996 -0.188 924 HZ2 LYS 123 1HZ LYS 123 16.551 4.890 -1.625 925 HZ3 LYS 123 2HZ LYS 123 15.745 3.404 -1.537 926 H TYR 124 H TYR 124 9.396 5.755 0.871 927 HA TYR 124 HA TYR 124 7.679 4.328 -0.762 928 HB2 TYR 124 2HB TYR 124 6.982 6.537 1.177 929 HB3 TYR 124 1HB TYR 124 5.853 5.341 0.530 930 HD1 TYR 124 2HD TYR 124 7.099 2.812 0.781 931 HD2 TYR 124 1HD TYR 124 7.414 6.149 3.395 932 HE1 TYR 124 2HE TYR 124 7.614 1.298 2.647 933 HE2 TYR 124 1HE TYR 124 7.932 4.645 5.267 934 HH TYR 124 HH TYR 124 8.717 1.367 4.819 935 H PHE 125 H PHE 125 8.944 7.395 -1.431 936 HA PHE 125 HA PHE 125 6.755 8.652 -2.663 937 HB2 PHE 125 2HB PHE 125 8.841 9.844 -2.111 938 HB3 PHE 125 1HB PHE 125 9.694 8.903 -3.341 939 HD1 PHE 125 2HD PHE 125 9.022 9.179 -5.755 940 HD2 PHE 125 1HD PHE 125 7.668 11.790 -2.676 941 HE1 PHE 125 2HE PHE 125 8.443 10.866 -7.445 942 HE2 PHE 125 1HE PHE 125 7.084 13.481 -4.365 943 HZ PHE 125 HZ PHE 125 7.474 13.019 -6.753 944 H TYR 126 H TYR 126 5.612 7.909 -4.316 945 HA TYR 126 HA TYR 126 6.862 6.056 -6.172 946 HB2 TYR 126 2HB TYR 126 4.137 6.565 -5.258 947 HB3 TYR 126 1HB TYR 126 4.241 6.379 -7.013 948 HD1 TYR 126 1HD TYR 126 6.762 4.395 -6.590 949 HD2 TYR 126 2HD TYR 126 2.747 4.544 -5.185 950 HE1 TYR 126 1HE TYR 126 6.768 1.953 -6.320 951 HE2 TYR 126 2HE TYR 126 2.748 2.103 -4.907 952 HH TYR 126 HH TYR 126 4.279 0.278 -4.649 953 H VAL 127 H VAL 127 6.377 6.275 -8.485 954 HA VAL 127 HA VAL 127 5.581 8.601 -9.751 955 HB VAL 127 HB VAL 127 7.391 9.797 -8.741 956 HG11 VAL 127 1HG1 VAL 127 9.709 9.120 -8.867 957 HG12 VAL 127 2HG1 VAL 127 9.265 7.677 -9.779 958 HG13 VAL 127 3HG1 VAL 127 8.748 7.854 -8.102 959 HG21 VAL 127 3HG2 VAL 127 8.605 10.593 -10.648 960 HG22 VAL 127 1HG2 VAL 127 6.955 10.217 -11.146 961 HG23 VAL 127 2HG2 VAL 127 8.269 9.108 -11.538 962 H SER 128 H SER 128 4.854 7.500 -11.426 963 HA SER 128 HA SER 128 5.009 6.555 -13.531 964 HB2 SER 128 2HB SER 128 7.004 5.962 -14.525 965 HB3 SER 128 1HB SER 128 7.593 7.074 -13.280 966 HG SER 128 HG SER 128 8.728 5.457 -12.593 967 H ALA 129 H ALA 129 4.274 4.575 -14.192 968 HA ALA 129 HA ALA 129 3.698 2.668 -12.116 969 HB1 ALA 129 1HB ALA 129 1.924 2.297 -13.387 970 HB2 ALA 129 2HB ALA 129 2.954 1.667 -14.674 971 HB3 ALA 129 3HB ALA 129 2.573 3.389 -14.612 972 H GLU 130 H GLU 130 6.218 3.031 -14.391 973 HA GLU 130 HA GLU 130 6.762 0.281 -14.853 974 HB2 GLU 130 2HB GLU 130 8.856 1.004 -15.796 975 HB3 GLU 130 1HB GLU 130 7.590 2.128 -16.304 976 HG2 GLU 130 2HG GLU 130 9.026 3.711 -15.683 977 HG3 GLU 130 1HG GLU 130 8.515 3.319 -14.035 978 H GLN 131 H GLN 131 7.807 2.604 -12.398 979 HA GLN 131 HA GLN 131 9.649 0.704 -11.276 980 HB2 GLN 131 2HB GLN 131 9.889 2.355 -9.457 981 HB3 GLN 131 1HB GLN 131 10.328 2.949 -11.053 982 HG2 GLN 131 2HG GLN 131 9.017 4.694 -10.648 983 HG3 GLN 131 1HG GLN 131 7.644 3.598 -10.794 984 HE21 GLN 131 1HE2 GLN 131 8.868 5.916 -8.932 985 HE22 GLN 131 2HE2 GLN 131 8.259 5.446 -7.387 986 H VAL 132 H VAL 132 6.500 2.075 -10.410 987 HA VAL 132 HA VAL 132 6.181 0.884 -7.927 988 HB VAL 132 HB VAL 132 3.877 1.283 -8.104 989 HG11 VAL 132 1HG1 VAL 132 4.156 3.449 -9.877 990 HG12 VAL 132 2HG1 VAL 132 5.712 3.234 -9.077 991 HG13 VAL 132 3HG1 VAL 132 4.252 3.462 -8.117 992 HG21 VAL 132 3HG2 VAL 132 3.092 0.156 -9.955 993 HG22 VAL 132 1HG2 VAL 132 4.274 0.899 -11.033 994 HG23 VAL 132 2HG2 VAL 132 2.900 1.837 -10.453 995 H VAL 133 H VAL 133 6.108 -0.491 -11.102 996 HA VAL 133 HA VAL 133 4.787 -2.916 -10.255 997 HB VAL 133 HB VAL 133 4.466 -2.068 -12.549 998 HG11 VAL 133 1HG1 VAL 133 6.344 -1.181 -13.427 999 HG12 VAL 133 2HG1 VAL 133 6.559 -2.820 -14.045 1000 HG13 VAL 133 3HG1 VAL 133 7.402 -2.310 -12.583 1001 HG21 VAL 133 3HG2 VAL 133 4.176 -4.465 -11.984 1002 HG22 VAL 133 1HG2 VAL 133 5.841 -4.753 -12.494 1003 HG23 VAL 133 2HG2 VAL 133 4.643 -4.201 -13.664 1004 H GLN 134 H GLN 134 8.127 -1.793 -10.805 1005 HA GLN 134 HA GLN 134 9.151 -4.498 -10.583 1006 HB2 GLN 134 2HB GLN 134 11.376 -3.169 -10.121 1007 HB3 GLN 134 1HB GLN 134 10.702 -3.260 -11.740 1008 HG2 GLN 134 2HG GLN 134 9.646 -1.060 -11.370 1009 HG3 GLN 134 1HG GLN 134 10.473 -0.967 -9.815 1010 HE21 GLN 134 1HE2 GLN 134 10.629 -0.192 -13.042 1011 HE22 GLN 134 2HE2 GLN 134 12.334 0.153 -13.158 1012 H GLY 135 H GLY 135 8.442 -1.857 -8.457 1013 HA2 GLY 135 2HA GLY 135 9.751 -3.039 -6.167 1014 HA3 GLY 135 1HA GLY 135 8.680 -1.628 -6.160 1015 H MET 136 H MET 136 6.662 -3.131 -7.750 1016 HA MET 136 HA MET 136 5.207 -4.245 -5.538 1017 HB2 MET 136 2HB MET 136 4.678 -3.664 -8.397 1018 HB3 MET 136 1HB MET 136 3.732 -4.961 -7.678 1019 HG2 MET 136 2HG MET 136 2.902 -3.471 -5.976 1020 HG3 MET 136 1HG MET 136 3.927 -2.169 -6.576 1021 HE1 MET 136 3HE MET 136 1.888 -0.778 -6.396 1022 HE2 MET 136 1HE MET 136 0.788 -0.531 -7.755 1023 HE3 MET 136 2HE MET 136 2.511 -0.202 -7.942 1024 H LYS 137 H LYS 137 6.711 -5.475 -8.482 1025 HA LYS 137 HA LYS 137 6.087 -8.202 -7.974 1026 HB2 LYS 137 2HB LYS 137 7.490 -8.697 -9.860 1027 HB3 LYS 137 1HB LYS 137 6.533 -7.276 -10.233 1028 HG2 LYS 137 2HG LYS 137 8.636 -5.987 -9.420 1029 HG3 LYS 137 1HG LYS 137 9.458 -7.517 -9.725 1030 HD2 LYS 137 2HD LYS 137 7.984 -5.760 -11.672 1031 HD3 LYS 137 1HD LYS 137 9.665 -6.289 -11.727 1032 HE2 LYS 137 2HE LYS 137 7.289 -8.127 -12.004 1033 HE3 LYS 137 1HE LYS 137 8.179 -7.444 -13.361 1034 HZ1 LYS 137 3HZ LYS 137 9.748 -8.838 -11.340 1035 HZ2 LYS 137 1HZ LYS 137 9.928 -8.812 -13.022 1036 HZ3 LYS 137 2HZ LYS 137 8.751 -9.799 -12.312 1037 H GLU 138 H GLU 138 8.373 -6.070 -6.672 1038 HA GLU 138 HA GLU 138 10.462 -7.932 -6.120 1039 HB2 GLU 138 2HB GLU 138 10.368 -5.258 -6.044 1040 HB3 GLU 138 1HB GLU 138 10.029 -5.581 -4.345 1041 HG2 GLU 138 2HG GLU 138 12.361 -6.884 -5.687 1042 HG3 GLU 138 1HG GLU 138 12.468 -5.207 -5.124 1043 H ALA 139 H ALA 139 7.882 -6.487 -4.176 1044 HA ALA 139 HA ALA 139 8.329 -8.216 -1.931 1045 HB1 ALA 139 1HB ALA 139 7.111 -5.819 -2.214 1046 HB2 ALA 139 2HB ALA 139 6.868 -6.894 -0.837 1047 HB3 ALA 139 3HB ALA 139 5.712 -6.892 -2.169 1048 H GLN 140 H GLN 140 6.743 -8.536 -4.908 1049 HA GLN 140 HA GLN 140 4.531 -10.087 -4.367 1050 HB2 GLN 140 2HB GLN 140 6.335 -9.707 -6.674 1051 HB3 GLN 140 1HB GLN 140 5.374 -11.190 -6.690 1052 HG2 GLN 140 2HG GLN 140 3.414 -9.542 -6.140 1053 HG3 GLN 140 1HG GLN 140 4.498 -8.353 -6.850 1054 HE21 GLN 140 1HE2 GLN 140 3.755 -11.737 -7.620 1055 HE22 GLN 140 2HE2 GLN 140 3.342 -11.448 -9.271 1056 H GLU 141 H GLU 141 7.850 -10.951 -3.982 1057 HA GLU 141 HA GLU 141 7.043 -13.739 -3.565 1058 HB2 GLU 141 2HB GLU 141 9.155 -14.511 -4.347 1059 HB3 GLU 141 1HB GLU 141 8.476 -13.416 -5.561 1060 HG2 GLU 141 2HG GLU 141 9.825 -11.612 -4.605 1061 HG3 GLU 141 1HG GLU 141 10.566 -12.782 -3.524 1062 H ARG 142 H ARG 142 9.101 -11.123 -2.463 1063 HA ARG 142 HA ARG 142 10.038 -12.666 -0.202 1064 HB2 ARG 142 2HB ARG 142 11.265 -10.600 0.408 1065 HB3 ARG 142 1HB ARG 142 11.604 -11.151 -1.236 1066 HG2 ARG 142 2HG ARG 142 11.327 -8.944 -1.655 1067 HG3 ARG 142 1HG ARG 142 9.637 -9.456 -1.792 1068 HD2 ARG 142 2HD ARG 142 9.561 -7.558 -0.430 1069 HD3 ARG 142 1HD ARG 142 9.469 -8.910 0.706 1070 HE ARG 142 HE ARG 142 11.738 -7.109 0.302 1071 HH11 ARG 142 1HH1 ARG 142 10.359 -9.842 1.994 1072 HH12 ARG 142 2HH1 ARG 142 11.536 -9.801 3.262 1073 HH21 ARG 142 1HH2 ARG 142 13.279 -7.064 1.969 1074 HH22 ARG 142 2HH2 ARG 142 13.191 -8.226 3.251 1075 H LEU 143 H LEU 143 7.347 -10.683 -0.869 1076 HA LEU 143 HA LEU 143 6.920 -10.244 2.011 1077 HB2 LEU 143 2HB LEU 143 7.027 -8.191 0.675 1078 HB3 LEU 143 1HB LEU 143 5.708 -8.780 -0.335 1079 HG LEU 143 HG LEU 143 4.132 -8.553 1.425 1080 HD11 LEU 143 1HD1 LEU 143 4.801 -9.104 3.477 1081 HD12 LEU 143 2HD1 LEU 143 5.365 -7.441 3.614 1082 HD13 LEU 143 3HD1 LEU 143 6.484 -8.713 3.129 1083 HD21 LEU 143 3HD2 LEU 143 4.890 -6.089 2.227 1084 HD22 LEU 143 1HD2 LEU 143 4.180 -6.445 0.652 1085 HD23 LEU 143 2HD2 LEU 143 5.930 -6.311 0.820 1086 H THR 144 H THR 144 5.668 -11.766 -0.838 1087 HA THR 144 HA THR 144 3.009 -12.154 0.052 1088 HB THR 144 HB THR 144 3.065 -14.037 -1.658 1089 HG1 THR 144 1HG THR 144 4.860 -14.158 -2.952 1090 HG21 THR 144 3HG2 THR 144 3.964 -11.374 -2.708 1091 HG22 THR 144 1HG2 THR 144 2.316 -11.732 -2.191 1092 HG23 THR 144 2HG2 THR 144 3.022 -12.602 -3.553 1093 H GLY 145 H GLY 145 2.349 -13.358 1.699 1094 HA2 GLY 145 2HA GLY 145 2.089 -15.462 2.782 1095 HA3 GLY 145 1HA GLY 145 3.692 -15.916 2.218 1096 H ASP 146 H ASP 146 5.369 -15.701 3.575 1097 HA ASP 146 HA ASP 146 5.312 -13.783 5.733 1098 HB2 ASP 146 2HB ASP 146 5.859 -15.699 7.400 1099 HB3 ASP 146 1HB ASP 146 4.177 -15.397 6.979 1100 H ALA 147 H ALA 147 6.948 -14.520 3.353 1101 HA ALA 147 HA ALA 147 9.424 -15.571 4.323 1102 HB1 ALA 147 1HB ALA 147 8.413 -15.384 1.868 1103 HB2 ALA 147 2HB ALA 147 10.150 -15.456 2.168 1104 HB3 ALA 147 3HB ALA 147 9.371 -13.902 1.871 1105 H PHE 148 H PHE 148 7.955 -12.441 4.139 1106 HA PHE 148 HA PHE 148 10.358 -10.917 4.442 1107 HB2 PHE 148 2HB PHE 148 8.883 -9.018 4.761 1108 HB3 PHE 148 1HB PHE 148 8.280 -10.006 3.424 1109 HD1 PHE 148 2HD PHE 148 6.276 -11.400 3.732 1110 HD2 PHE 148 1HD PHE 148 7.623 -8.719 6.748 1111 HE1 PHE 148 2HE PHE 148 4.078 -11.535 4.828 1112 HE2 PHE 148 1HE PHE 148 5.429 -8.849 7.851 1113 HZ PHE 148 HZ PHE 148 3.652 -10.258 6.890 1114 H ARG 149 H ARG 149 8.210 -12.575 6.581 1115 HA ARG 149 HA ARG 149 8.532 -11.188 8.950 1116 HB2 ARG 149 2HB ARG 149 7.941 -14.012 8.243 1117 HB3 ARG 149 1HB ARG 149 8.343 -13.648 9.913 1118 HG2 ARG 149 2HG ARG 149 6.087 -12.490 8.298 1119 HG3 ARG 149 1HG ARG 149 5.972 -13.604 9.655 1120 HD2 ARG 149 2HD ARG 149 6.793 -10.719 9.686 1121 HD3 ARG 149 1HD ARG 149 5.435 -11.475 10.515 1122 HE ARG 149 HE ARG 149 7.720 -12.689 11.490 1123 HH11 ARG 149 1HH1 ARG 149 6.362 -9.475 11.418 1124 HH12 ARG 149 2HH1 ARG 149 7.108 -8.991 12.905 1125 HH21 ARG 149 1HH2 ARG 149 8.702 -12.055 13.445 1126 HH22 ARG 149 2HH2 ARG 149 8.436 -10.457 14.056 1127 H LYS 150 H LYS 150 9.651 -12.611 10.868 1128 HA LYS 150 HA LYS 150 12.166 -13.751 10.395 1129 HB2 LYS 150 2HB LYS 150 12.718 -11.457 9.629 1130 HB3 LYS 150 1HB LYS 150 12.290 -10.845 11.221 1131 HG2 LYS 150 2HG LYS 150 14.639 -11.007 11.179 1132 HG3 LYS 150 1HG LYS 150 14.070 -12.362 12.157 1133 HD2 LYS 150 2HD LYS 150 15.425 -13.589 10.850 1134 HD3 LYS 150 1HD LYS 150 14.114 -13.475 9.676 1135 HE2 LYS 150 2HE LYS 150 16.433 -11.557 9.857 1136 HE3 LYS 150 1HE LYS 150 16.334 -12.910 8.730 1137 HZ1 LYS 150 3HZ LYS 150 14.910 -10.364 8.709 1138 HZ2 LYS 150 1HZ LYS 150 14.057 -11.722 8.170 1139 HZ3 LYS 150 2HZ LYS 150 15.507 -11.281 7.418 1140 H LYS 151 H LYS 151 12.902 -14.705 12.226 1141 HA LYS 151 HA LYS 151 13.062 -15.333 14.409 1142 HB2 LYS 151 2HB LYS 151 12.517 -12.495 14.563 1143 HB3 LYS 151 1HB LYS 151 11.764 -13.346 15.907 1144 HG2 LYS 151 2HG LYS 151 14.673 -13.456 15.139 1145 HG3 LYS 151 1HG LYS 151 13.980 -12.583 16.508 1146 HD2 LYS 151 2HD LYS 151 13.806 -14.445 17.760 1147 HD3 LYS 151 1HD LYS 151 13.281 -15.431 16.394 1148 HE2 LYS 151 2HE LYS 151 15.746 -15.219 15.619 1149 HE3 LYS 151 1HE LYS 151 16.057 -14.765 17.294 1150 HZ1 LYS 151 3HZ LYS 151 16.381 -17.082 17.142 1151 HZ2 LYS 151 1HZ LYS 151 14.939 -17.319 16.289 1152 HZ3 LYS 151 2HZ LYS 151 14.894 -16.879 17.921 1153 H HIS 152 H HIS 152 9.973 -13.559 14.115 1154 HA HIS 152 HA HIS 152 7.815 -14.205 14.414 1155 HB2 HIS 152 2HB HIS 152 8.925 -17.019 14.279 1156 HB3 HIS 152 1HB HIS 152 7.224 -16.584 14.192 1157 HD1 HIS 152 1HD HIS 152 6.314 -16.232 11.914 1158 HD2 HIS 152 2HD HIS 152 10.454 -15.890 12.008 1159 HE1 HIS 152 1HE HIS 152 7.021 -15.956 9.516 1160 HE2 HIS 152 2HE HIS 152 9.535 -15.810 9.591 1161 H LEU 153 H LEU 153 6.352 -15.013 16.041 1162 HA LEU 153 HA LEU 153 7.635 -15.108 18.661 1163 HB2 LEU 153 2HB LEU 153 5.295 -14.764 19.498 1164 HB3 LEU 153 1HB LEU 153 5.940 -13.463 18.518 1165 HG LEU 153 HG LEU 153 4.520 -15.343 16.854 1166 HD11 LEU 153 1HD1 LEU 153 3.408 -15.431 19.288 1167 HD12 LEU 153 2HD1 LEU 153 2.476 -15.539 17.794 1168 HD13 LEU 153 3HD1 LEU 153 2.597 -14.001 18.648 1169 HD21 LEU 153 3HD2 LEU 153 5.024 -13.071 16.196 1170 HD22 LEU 153 1HD2 LEU 153 4.082 -12.442 17.549 1171 HD23 LEU 153 2HD2 LEU 153 3.276 -13.306 16.239 1172 H GLU 154 H GLU 154 6.061 -16.425 20.279 1173 HA GLU 154 HA GLU 154 6.208 -19.175 19.308 1174 HB2 GLU 154 2HB GLU 154 5.906 -19.769 21.711 1175 HB3 GLU 154 1HB GLU 154 7.325 -18.779 21.400 1176 HG2 GLU 154 2HG GLU 154 6.208 -16.820 22.225 1177 HG3 GLU 154 1HG GLU 154 4.696 -17.710 22.397 1178 H ASP 155 H ASP 155 3.905 -16.852 20.607 1179 HA ASP 155 HA ASP 155 1.632 -16.809 20.657 1180 HB2 ASP 155 2HB ASP 155 2.226 -17.617 18.179 1181 HB3 ASP 155 1HB ASP 155 1.390 -19.066 18.730 1182 H GLU 156 H GLU 156 -0.318 -18.078 21.239 1183 HA GLU 156 HA GLU 156 0.400 -20.109 23.174 1184 HB2 GLU 156 2HB GLU 156 -1.379 -18.128 23.323 1185 HB3 GLU 156 1HB GLU 156 -2.443 -19.379 22.670 1186 HG2 GLU 156 2HG GLU 156 -0.764 -19.728 25.144 1187 HG3 GLU 156 1HG GLU 156 -2.440 -19.179 25.157 1188 H LEU 157 H LEU 157 -0.322 -22.226 23.195 1189 HA LEU 157 HA LEU 157 -0.941 -23.329 20.581 1190 HB2 LEU 157 2HB LEU 157 -0.228 -24.557 23.236 1191 HB3 LEU 157 1HB LEU 157 -0.728 -25.527 21.864 1192 HG LEU 157 HG LEU 157 1.193 -24.410 20.586 1193 HD11 LEU 157 1HD1 LEU 157 3.066 -23.702 22.088 1194 HD12 LEU 157 2HD1 LEU 157 1.905 -23.669 23.415 1195 HD13 LEU 157 3HD1 LEU 157 1.698 -22.589 22.035 1196 HD21 LEU 157 3HD2 LEU 157 1.099 -26.763 21.516 1197 HD22 LEU 157 1HD2 LEU 157 2.030 -26.156 22.887 1198 HD23 LEU 157 2HD2 LEU 157 2.708 -26.088 21.260 Start of MODEL 35 1 H1 MET 1 1HT MET 1 -23.226 -18.039 1.496 2 H2 MET 1 2HT MET 1 -24.346 -17.034 0.670 3 H3 MET 1 3HT MET 1 -22.696 -17.055 0.198 4 HA MET 1 HA MET 1 -23.762 -18.314 -1.371 5 HB2 MET 1 2HB MET 1 -22.225 -19.687 0.742 6 HB3 MET 1 1HB MET 1 -23.115 -20.750 -0.340 7 HG2 MET 1 2HG MET 1 -21.253 -20.623 -1.576 8 HG3 MET 1 1HG MET 1 -21.970 -19.113 -2.135 9 HE1 MET 1 2HE MET 1 -18.956 -17.333 -2.180 10 HE2 MET 1 3HE MET 1 -20.361 -16.514 -1.499 11 HE3 MET 1 1HE MET 1 -20.572 -17.717 -2.770 12 H HIS 2 H HIS 2 -24.624 -19.701 1.804 13 HA HIS 2 HA HIS 2 -27.197 -20.534 0.640 14 HB2 HIS 2 2HB HIS 2 -25.297 -21.872 2.383 15 HB3 HIS 2 1HB HIS 2 -26.910 -21.850 3.085 16 HD1 HIS 2 1HD HIS 2 -28.545 -23.521 2.204 17 HD2 HIS 2 2HD HIS 2 -25.214 -23.120 -0.249 18 HE1 HIS 2 1HE HIS 2 -28.766 -25.328 0.469 19 HE2 HIS 2 2HE HIS 2 -26.784 -25.011 -1.054 20 H HIS 3 H HIS 3 -25.770 -19.406 3.706 21 HA HIS 3 HA HIS 3 -28.305 -18.640 4.790 22 HB2 HIS 3 2HB HIS 3 -25.452 -18.203 5.648 23 HB3 HIS 3 1HB HIS 3 -26.797 -17.465 6.513 24 HD1 HIS 3 1HD HIS 3 -28.441 -19.104 7.746 25 HD2 HIS 3 2HD HIS 3 -25.048 -20.892 6.146 26 HE1 HIS 3 1HE HIS 3 -28.308 -21.374 8.819 27 HE2 HIS 3 2HE HIS 3 -26.202 -22.405 7.899 28 H HIS 4 H HIS 4 -25.443 -16.693 3.911 29 HA HIS 4 HA HIS 4 -27.064 -14.298 3.790 30 HB2 HIS 4 2HB HIS 4 -24.253 -14.920 4.040 31 HB3 HIS 4 1HB HIS 4 -24.508 -13.726 2.775 32 HD1 HIS 4 1HD HIS 4 -25.840 -14.202 6.319 33 HD2 HIS 4 2HD HIS 4 -24.359 -11.243 3.805 34 HE1 HIS 4 1HE HIS 4 -25.858 -12.090 7.683 35 HE2 HIS 4 2HE HIS 4 -25.038 -10.297 6.114 36 H HIS 5 H HIS 5 -27.202 -12.933 1.924 37 HA HIS 5 HA HIS 5 -26.865 -14.366 -0.627 38 HB2 HIS 5 2HB HIS 5 -29.288 -13.685 0.522 39 HB3 HIS 5 1HB HIS 5 -29.008 -12.377 -0.621 40 HD1 HIS 5 1HD HIS 5 -30.081 -15.874 -0.408 41 HD2 HIS 5 2HD HIS 5 -28.713 -13.284 -3.357 42 HE1 HIS 5 1HE HIS 5 -30.677 -16.967 -2.592 43 HE2 HIS 5 2HE HIS 5 -29.758 -15.427 -4.362 44 H HIS 6 H HIS 6 -27.390 -11.126 0.764 45 HA HIS 6 HA HIS 6 -25.323 -10.098 -1.044 46 HB2 HIS 6 2HB HIS 6 -26.722 -8.072 -1.457 47 HB3 HIS 6 1HB HIS 6 -27.391 -9.543 -2.153 48 HD1 HIS 6 1HD HIS 6 -29.549 -10.501 -1.044 49 HD2 HIS 6 2HD HIS 6 -28.268 -6.869 0.515 50 HE1 HIS 6 1HE HIS 6 -31.482 -9.633 0.310 51 HE2 HIS 6 2HE HIS 6 -30.650 -7.477 1.317 52 H HIS 7 H HIS 7 -24.820 -7.722 -0.404 53 HA HIS 7 HA HIS 7 -24.857 -7.495 2.532 54 HB2 HIS 7 2HB HIS 7 -22.580 -6.454 2.337 55 HB3 HIS 7 1HB HIS 7 -22.635 -8.165 1.929 56 HD1 HIS 7 1HD HIS 7 -22.540 -8.735 -0.675 57 HD2 HIS 7 2HD HIS 7 -21.638 -4.811 0.354 58 HE1 HIS 7 1HE HIS 7 -21.395 -7.758 -2.690 59 HE2 HIS 7 2HE HIS 7 -20.780 -5.410 -2.011 60 H MET 8 H MET 8 -23.887 -5.110 3.021 61 HA MET 8 HA MET 8 -25.917 -3.335 2.071 62 HB2 MET 8 2HB MET 8 -23.790 -3.290 4.105 63 HB3 MET 8 1HB MET 8 -24.134 -1.717 3.375 64 HG2 MET 8 2HG MET 8 -26.552 -2.116 3.913 65 HG3 MET 8 1HG MET 8 -26.038 -3.523 4.842 66 HE1 MET 8 3HE MET 8 -23.947 -2.267 7.609 67 HE2 MET 8 1HE MET 8 -24.489 -3.579 6.563 68 HE3 MET 8 2HE MET 8 -25.572 -2.928 7.793 69 H SER 9 H SER 9 -24.897 -0.927 1.666 70 HA SER 9 HA SER 9 -23.162 -1.258 -0.692 71 HB2 SER 9 2HB SER 9 -25.587 0.384 -0.197 72 HB3 SER 9 1HB SER 9 -24.313 1.126 -1.164 73 HG SER 9 HG SER 9 -25.937 -1.068 -1.726 74 H ASP 10 H ASP 10 -22.322 1.188 -1.235 75 HA ASP 10 HA ASP 10 -20.809 1.955 1.166 76 HB2 ASP 10 2HB ASP 10 -20.130 2.483 -1.734 77 HB3 ASP 10 1HB ASP 10 -19.105 2.819 -0.343 78 H GLY 11 H GLY 11 -19.906 4.399 0.630 79 HA2 GLY 11 2HA GLY 11 -22.358 6.005 0.253 80 HA3 GLY 11 1HA GLY 11 -21.125 6.392 1.442 81 H HIS 12 H HIS 12 -19.735 7.930 0.886 82 HA HIS 12 HA HIS 12 -19.786 9.228 -1.590 83 HB2 HIS 12 2HB HIS 12 -17.775 9.236 0.659 84 HB3 HIS 12 1HB HIS 12 -17.571 10.232 -0.788 85 HD1 HIS 12 1HD HIS 12 -20.669 9.621 1.345 86 HD2 HIS 12 2HD HIS 12 -18.253 12.726 0.006 87 HE1 HIS 12 1HE HIS 12 -21.770 11.730 2.162 88 HE2 HIS 12 2HE HIS 12 -20.257 13.593 1.394 89 H ASN 13 H ASN 13 -17.509 6.842 -0.292 90 HA ASN 13 HA ASN 13 -16.029 5.442 -1.297 91 HB2 ASN 13 2HB ASN 13 -18.209 5.317 -2.875 92 HB3 ASN 13 1HB ASN 13 -17.045 5.947 -4.037 93 HD21 ASN 13 1HD2 ASN 13 -18.184 3.216 -2.400 94 HD22 ASN 13 2HD2 ASN 13 -17.000 2.088 -2.955 95 H GLY 14 H GLY 14 -14.396 7.040 -0.787 96 HA2 GLY 14 2HA GLY 14 -13.444 8.564 -3.128 97 HA3 GLY 14 1HA GLY 14 -13.029 8.915 -1.446 98 H LEU 15 H LEU 15 -12.561 6.598 -4.075 99 HA LEU 15 HA LEU 15 -9.995 5.843 -2.834 100 HB2 LEU 15 2HB LEU 15 -12.045 4.179 -4.255 101 HB3 LEU 15 1HB LEU 15 -10.368 3.675 -4.208 102 HG LEU 15 HG LEU 15 -11.585 2.546 -2.465 103 HD11 LEU 15 1HD1 LEU 15 -9.999 2.789 -0.882 104 HD12 LEU 15 2HD1 LEU 15 -10.182 4.541 -0.811 105 HD13 LEU 15 3HD1 LEU 15 -9.240 3.804 -2.107 106 HD21 LEU 15 3HD2 LEU 15 -12.971 3.540 -0.923 107 HD22 LEU 15 1HD2 LEU 15 -13.280 4.528 -2.351 108 HD23 LEU 15 2HD2 LEU 15 -12.202 5.118 -1.087 109 H GLY 16 H GLY 16 -8.631 4.640 -4.649 110 HA2 GLY 16 2HA GLY 16 -7.647 6.531 -6.404 111 HA3 GLY 16 1HA GLY 16 -7.417 4.802 -6.588 112 H LYS 17 H LYS 17 -9.456 7.534 -7.431 113 HA LYS 17 HA LYS 17 -10.314 6.068 -9.824 114 HB2 LYS 17 2HB LYS 17 -12.004 6.767 -7.682 115 HB3 LYS 17 1HB LYS 17 -12.364 7.909 -8.970 116 HG2 LYS 17 2HG LYS 17 -12.989 6.202 -10.456 117 HG3 LYS 17 1HG LYS 17 -12.259 4.949 -9.450 118 HD2 LYS 17 2HD LYS 17 -14.431 4.653 -8.846 119 HD3 LYS 17 1HD LYS 17 -14.001 5.908 -7.683 120 HE2 LYS 17 2HE LYS 17 -14.741 7.462 -9.722 121 HE3 LYS 17 1HE LYS 17 -15.728 6.048 -10.086 122 HZ1 LYS 17 3HZ LYS 17 -16.537 7.961 -8.471 123 HZ2 LYS 17 1HZ LYS 17 -15.742 6.998 -7.330 124 HZ3 LYS 17 2HZ LYS 17 -16.999 6.348 -8.257 125 H GLY 18 H GLY 18 -8.660 7.234 -10.896 126 HA2 GLY 18 2HA GLY 18 -9.464 9.494 -12.280 127 HA3 GLY 18 1HA GLY 18 -8.530 10.077 -10.898 128 H PHE 19 H PHE 19 -6.802 7.683 -10.911 129 HA PHE 19 HA PHE 19 -5.149 8.436 -13.217 130 HB2 PHE 19 2HB PHE 19 -3.328 7.247 -11.716 131 HB3 PHE 19 1HB PHE 19 -3.790 8.929 -11.424 132 HD1 PHE 19 2HD PHE 19 -5.486 9.403 -9.611 133 HD2 PHE 19 1HD PHE 19 -3.574 5.626 -10.055 134 HE1 PHE 19 2HE PHE 19 -6.069 8.840 -7.288 135 HE2 PHE 19 1HE PHE 19 -4.152 5.058 -7.731 136 HZ PHE 19 HZ PHE 19 -5.402 6.665 -6.346 137 H GLY 20 H GLY 20 -5.790 5.606 -11.137 138 HA2 GLY 20 2HA GLY 20 -5.203 3.889 -13.461 139 HA3 GLY 20 1HA GLY 20 -5.159 3.375 -11.774 140 H ASP 21 H ASP 21 -6.898 2.397 -10.936 141 HA ASP 21 HA ASP 21 -9.572 2.904 -11.813 142 HB2 ASP 21 2HB ASP 21 -8.132 0.449 -12.763 143 HB3 ASP 21 1HB ASP 21 -9.862 0.353 -12.396 144 H HIS 22 H HIS 22 -8.856 -0.350 -10.812 145 HA HIS 22 HA HIS 22 -9.957 0.242 -8.159 146 HB2 HIS 22 2HB HIS 22 -9.341 -2.525 -9.175 147 HB3 HIS 22 1HB HIS 22 -10.553 -2.023 -8.004 148 HD1 HIS 22 1HD HIS 22 -12.684 -0.762 -9.022 149 HD2 HIS 22 2HD HIS 22 -10.246 -2.734 -11.750 150 HE1 HIS 22 1HE HIS 22 -14.061 -0.986 -11.114 151 HE2 HIS 22 2HE HIS 22 -12.605 -2.277 -12.713 152 H ILE 23 H ILE 23 -7.414 -1.730 -9.602 153 HA ILE 23 HA ILE 23 -5.448 -2.552 -8.706 154 HB ILE 23 HB ILE 23 -5.058 0.405 -8.341 155 HG12 ILE 23 2HG1 ILE 23 -6.300 -0.277 -10.480 156 HG13 ILE 23 1HG1 ILE 23 -4.863 0.717 -10.660 157 HG21 ILE 23 1HG2 ILE 23 -2.935 -0.110 -8.086 158 HG22 ILE 23 2HG2 ILE 23 -2.918 -0.780 -9.712 159 HG23 ILE 23 3HG2 ILE 23 -3.284 -1.820 -8.338 160 HD11 ILE 23 3HD1 ILE 23 -5.127 -1.195 -12.277 161 HD12 ILE 23 1HD1 ILE 23 -4.793 -2.267 -10.916 162 HD13 ILE 23 2HD1 ILE 23 -3.583 -1.091 -11.431 163 H HIS 24 H HIS 24 -4.251 -0.179 -6.794 164 HA HIS 24 HA HIS 24 -4.504 -1.761 -4.414 165 HB2 HIS 24 2HB HIS 24 -3.061 0.866 -4.552 166 HB3 HIS 24 1HB HIS 24 -2.710 -0.549 -3.554 167 HD1 HIS 24 1HD HIS 24 -0.656 0.930 -5.482 168 HD2 HIS 24 2HD HIS 24 -2.689 -2.601 -6.296 169 HE1 HIS 24 1HE HIS 24 0.730 -0.259 -7.212 170 HE2 HIS 24 2HE HIS 24 -0.571 -2.347 -7.758 171 H TRP 25 H TRP 25 -6.865 -0.254 -5.433 172 HA TRP 25 HA TRP 25 -7.483 1.096 -2.925 173 HB2 TRP 25 2HB TRP 25 -8.815 2.718 -4.630 174 HB3 TRP 25 1HB TRP 25 -7.242 3.087 -3.931 175 HD1 TRP 25 HD TRP 25 -8.979 2.588 -7.163 176 HE1 TRP 25 1HE TRP 25 -7.300 2.744 -9.085 177 HE3 TRP 25 3HE TRP 25 -4.624 2.383 -4.496 178 HZ2 TRP 25 2HZ TRP 25 -4.519 2.795 -9.464 179 HZ3 TRP 25 3HZ TRP 25 -2.493 2.485 -5.730 180 HH2 TRP 25 HH TRP 25 -2.441 2.687 -8.160 181 H ARG 26 H ARG 26 -8.412 -1.036 -5.371 182 HA ARG 26 HA ARG 26 -11.040 -0.822 -5.818 183 HB2 ARG 26 2HB ARG 26 -9.938 -2.809 -6.558 184 HB3 ARG 26 1HB ARG 26 -9.522 -3.230 -4.925 185 HG2 ARG 26 2HG ARG 26 -11.204 -4.723 -5.640 186 HG3 ARG 26 1HG ARG 26 -11.906 -3.649 -4.441 187 HD2 ARG 26 2HD ARG 26 -12.096 -3.037 -7.364 188 HD3 ARG 26 1HD ARG 26 -13.211 -4.187 -6.613 189 HE ARG 26 HE ARG 26 -13.022 -1.604 -5.318 190 HH11 ARG 26 1HH1 ARG 26 -14.706 -3.563 -7.663 191 HH12 ARG 26 2HH1 ARG 26 -16.151 -2.613 -7.599 192 HH21 ARG 26 1HH2 ARG 26 -14.919 -0.354 -5.235 193 HH22 ARG 26 2HH2 ARG 26 -16.273 -0.791 -6.222 194 H THR 27 H THR 27 -9.675 -1.887 -2.687 195 HA THR 27 HA THR 27 -11.384 -0.653 -1.002 196 HB THR 27 HB THR 27 -12.804 -2.922 -0.471 197 HG1 THR 27 1HG THR 27 -13.247 -2.755 -3.196 198 HG21 THR 27 3HG2 THR 27 -13.417 -0.377 -1.774 199 HG22 THR 27 1HG2 THR 27 -14.228 -1.204 -0.445 200 HG23 THR 27 2HG2 THR 27 -14.556 -1.680 -2.111 201 H LEU 28 H LEU 28 -10.819 -0.982 1.068 202 HA LEU 28 HA LEU 28 -8.599 -2.705 1.597 203 HB2 LEU 28 2HB LEU 28 -8.849 -0.486 2.637 204 HB3 LEU 28 1HB LEU 28 -10.280 -1.059 3.493 205 HG LEU 28 HG LEU 28 -7.833 -2.651 3.933 206 HD11 LEU 28 1HD1 LEU 28 -7.371 0.001 3.890 207 HD12 LEU 28 2HD1 LEU 28 -6.542 -1.122 4.965 208 HD13 LEU 28 3HD1 LEU 28 -7.923 -0.195 5.553 209 HD21 LEU 28 3HD2 LEU 28 -8.715 -2.257 6.331 210 HD22 LEU 28 1HD2 LEU 28 -9.637 -3.290 5.240 211 HD23 LEU 28 2HD2 LEU 28 -10.150 -1.627 5.524 212 H GLU 29 H GLU 29 -11.900 -2.534 2.936 213 HA GLU 29 HA GLU 29 -11.810 -4.787 4.535 214 HB2 GLU 29 2HB GLU 29 -14.338 -4.891 4.061 215 HB3 GLU 29 1HB GLU 29 -13.695 -3.434 4.805 216 HG2 GLU 29 2HG GLU 29 -13.572 -3.070 2.011 217 HG3 GLU 29 1HG GLU 29 -15.169 -3.717 2.388 218 H ASP 30 H ASP 30 -12.621 -4.552 1.096 219 HA ASP 30 HA ASP 30 -13.261 -7.300 0.780 220 HB2 ASP 30 2HB ASP 30 -12.577 -5.087 -1.146 221 HB3 ASP 30 1HB ASP 30 -12.833 -6.746 -1.703 222 H GLY 31 H GLY 31 -10.302 -5.428 0.478 223 HA2 GLY 31 2HA GLY 31 -8.788 -7.617 -0.631 224 HA3 GLY 31 1HA GLY 31 -8.146 -6.066 -0.080 225 H LYS 32 H LYS 32 -9.651 -6.592 2.545 226 HA LYS 32 HA LYS 32 -7.443 -7.982 3.815 227 HB2 LYS 32 2HB LYS 32 -8.627 -5.817 4.637 228 HB3 LYS 32 1HB LYS 32 -9.849 -6.916 5.261 229 HG2 LYS 32 2HG LYS 32 -7.729 -8.106 6.302 230 HG3 LYS 32 1HG LYS 32 -7.052 -6.483 6.146 231 HD2 LYS 32 2HD LYS 32 -8.016 -6.647 8.322 232 HD3 LYS 32 1HD LYS 32 -9.077 -5.624 7.353 233 HE2 LYS 32 2HE LYS 32 -10.167 -8.048 6.880 234 HE3 LYS 32 1HE LYS 32 -9.550 -8.292 8.513 235 HZ1 LYS 32 3HZ LYS 32 -11.923 -7.227 7.989 236 HZ2 LYS 32 1HZ LYS 32 -10.994 -5.814 8.058 237 HZ3 LYS 32 2HZ LYS 32 -11.035 -6.865 9.383 238 H LYS 33 H LYS 33 -10.998 -8.263 3.793 239 HA LYS 33 HA LYS 33 -11.172 -10.648 5.233 240 HB2 LYS 33 2HB LYS 33 -13.108 -9.217 4.763 241 HB3 LYS 33 1HB LYS 33 -13.002 -9.622 3.055 242 HG2 LYS 33 2HG LYS 33 -13.143 -12.086 4.301 243 HG3 LYS 33 1HG LYS 33 -14.249 -11.065 5.238 244 HD2 LYS 33 2HD LYS 33 -15.751 -11.505 3.639 245 HD3 LYS 33 1HD LYS 33 -14.830 -10.383 2.635 246 HE2 LYS 33 2HE LYS 33 -13.404 -12.662 2.300 247 HE3 LYS 33 1HE LYS 33 -15.026 -13.318 2.516 248 HZ1 LYS 33 3HZ LYS 33 -14.375 -12.795 0.172 249 HZ2 LYS 33 1HZ LYS 33 -14.406 -11.155 0.587 250 HZ3 LYS 33 2HZ LYS 33 -15.818 -12.079 0.686 251 H GLU 34 H GLU 34 -10.505 -10.043 1.855 252 HA GLU 34 HA GLU 34 -10.739 -12.810 1.082 253 HB2 GLU 34 2HB GLU 34 -11.254 -11.085 -0.546 254 HB3 GLU 34 1HB GLU 34 -9.635 -10.405 -0.378 255 HG2 GLU 34 2HG GLU 34 -8.686 -11.982 -1.677 256 HG3 GLU 34 1HG GLU 34 -9.794 -13.252 -1.137 257 H ALA 35 H ALA 35 -8.072 -10.490 1.463 258 HA ALA 35 HA ALA 35 -5.941 -12.128 0.832 259 HB1 ALA 35 1HB ALA 35 -4.725 -10.655 2.614 260 HB2 ALA 35 2HB ALA 35 -6.252 -9.774 2.635 261 HB3 ALA 35 3HB ALA 35 -5.342 -9.927 1.131 262 H ALA 36 H ALA 36 -7.871 -12.044 3.735 263 HA ALA 36 HA ALA 36 -6.153 -13.431 5.468 264 HB1 ALA 36 1HB ALA 36 -7.946 -12.373 6.501 265 HB2 ALA 36 2HB ALA 36 -8.381 -14.080 6.591 266 HB3 ALA 36 3HB ALA 36 -9.119 -13.045 5.368 267 H ALA 37 H ALA 37 -8.715 -14.611 3.306 268 HA ALA 37 HA ALA 37 -8.628 -17.304 3.987 269 HB1 ALA 37 1HB ALA 37 -9.511 -17.693 1.667 270 HB2 ALA 37 2HB ALA 37 -9.287 -15.970 1.371 271 HB3 ALA 37 3HB ALA 37 -10.404 -16.511 2.623 272 H SER 38 H SER 38 -7.367 -16.239 0.849 273 HA SER 38 HA SER 38 -5.601 -18.423 0.620 274 HB2 SER 38 2HB SER 38 -5.981 -15.858 -0.888 275 HB3 SER 38 1HB SER 38 -4.577 -16.881 -1.234 276 HG SER 38 HG SER 38 -7.283 -17.751 -1.277 277 H GLY 39 H GLY 39 -5.000 -15.004 1.414 278 HA2 GLY 39 2HA GLY 39 -3.368 -14.540 3.189 279 HA3 GLY 39 1HA GLY 39 -2.390 -15.853 2.524 280 H LEU 40 H LEU 40 -4.066 -13.351 0.696 281 HA LEU 40 HA LEU 40 -1.619 -12.678 -0.680 282 HB2 LEU 40 2HB LEU 40 -4.409 -12.531 -1.207 283 HB3 LEU 40 1HB LEU 40 -3.762 -10.907 -1.338 284 HG LEU 40 HG LEU 40 -2.428 -13.179 -2.767 285 HD11 LEU 40 1HD1 LEU 40 -5.104 -12.445 -3.191 286 HD12 LEU 40 2HD1 LEU 40 -4.080 -13.446 -4.220 287 HD13 LEU 40 3HD1 LEU 40 -4.176 -11.706 -4.496 288 HD21 LEU 40 3HD2 LEU 40 -1.831 -10.514 -2.466 289 HD22 LEU 40 1HD2 LEU 40 -2.643 -10.564 -4.031 290 HD23 LEU 40 2HD2 LEU 40 -1.226 -11.573 -3.740 291 HA PRO 41 HA PRO 41 -0.475 -9.322 2.022 292 HB2 PRO 41 2HB PRO 41 0.998 -7.885 0.198 293 HB3 PRO 41 1HB PRO 41 1.607 -9.276 1.101 294 HG2 PRO 41 2HG PRO 41 0.521 -9.152 -1.682 295 HG3 PRO 41 1HG PRO 41 1.945 -10.022 -1.078 296 HD2 PRO 41 2HD PRO 41 -0.349 -11.308 -1.541 297 HD3 PRO 41 1HD PRO 41 0.659 -11.718 -0.136 298 H LEU 42 H LEU 42 -0.605 -6.938 2.090 299 HA LEU 42 HA LEU 42 -2.887 -6.001 0.487 300 HB2 LEU 42 2HB LEU 42 -2.197 -5.783 3.322 301 HB3 LEU 42 1HB LEU 42 -2.683 -4.259 2.604 302 HG LEU 42 HG LEU 42 -4.792 -5.285 1.860 303 HD11 LEU 42 1HD1 LEU 42 -3.459 -7.682 2.257 304 HD12 LEU 42 2HD1 LEU 42 -5.169 -7.475 1.877 305 HD13 LEU 42 3HD1 LEU 42 -4.652 -7.625 3.556 306 HD21 LEU 42 3HD2 LEU 42 -3.973 -5.041 4.678 307 HD22 LEU 42 1HD2 LEU 42 -5.480 -5.911 4.390 308 HD23 LEU 42 2HD2 LEU 42 -5.290 -4.258 3.804 309 H MET 43 H MET 43 -2.443 -4.554 -1.003 310 HA MET 43 HA MET 43 0.046 -3.053 -0.893 311 HB2 MET 43 2HB MET 43 -0.581 -4.115 -3.008 312 HB3 MET 43 1HB MET 43 -2.097 -3.201 -3.034 313 HG2 MET 43 2HG MET 43 -0.344 -2.293 -4.529 314 HG3 MET 43 1HG MET 43 -0.912 -1.142 -3.324 315 HE1 MET 43 3HE MET 43 3.214 -3.161 -3.467 316 HE2 MET 43 1HE MET 43 2.011 -3.161 -4.758 317 HE3 MET 43 2HE MET 43 1.737 -4.109 -3.296 318 H VAL 44 H VAL 44 -0.299 -1.532 0.722 319 HA VAL 44 HA VAL 44 -2.630 0.196 0.483 320 HB VAL 44 HB VAL 44 -0.488 0.293 2.603 321 HG11 VAL 44 1HG1 VAL 44 -2.032 1.601 3.863 322 HG12 VAL 44 2HG1 VAL 44 -3.314 1.332 2.682 323 HG13 VAL 44 3HG1 VAL 44 -1.916 2.320 2.257 324 HG21 VAL 44 3HG2 VAL 44 -1.794 -1.902 2.379 325 HG22 VAL 44 1HG2 VAL 44 -3.184 -0.975 2.945 326 HG23 VAL 44 2HG2 VAL 44 -1.750 -1.121 3.960 327 H ILE 45 H ILE 45 -2.570 2.320 0.032 328 HA ILE 45 HA ILE 45 -0.081 3.731 -0.172 329 HB ILE 45 HB ILE 45 -0.012 2.725 -2.343 330 HG12 ILE 45 2HG1 ILE 45 -1.028 5.570 -2.544 331 HG13 ILE 45 1HG1 ILE 45 0.645 5.078 -2.245 332 HG21 ILE 45 1HG2 ILE 45 -1.753 2.355 -3.720 333 HG22 ILE 45 2HG2 ILE 45 -2.544 3.875 -3.310 334 HG23 ILE 45 3HG2 ILE 45 -2.673 2.491 -2.221 335 HD11 ILE 45 3HD1 ILE 45 0.488 5.693 -4.523 336 HD12 ILE 45 1HD1 ILE 45 -0.966 4.722 -4.758 337 HD13 ILE 45 2HD1 ILE 45 0.585 3.932 -4.480 338 H ILE 46 H ILE 46 -0.402 5.698 0.519 339 HA ILE 46 HA ILE 46 -3.143 6.752 0.504 340 HB ILE 46 HB ILE 46 -0.907 7.721 2.261 341 HG12 ILE 46 2HG1 ILE 46 -2.916 6.002 3.516 342 HG13 ILE 46 1HG1 ILE 46 -1.889 5.153 2.365 343 HG21 ILE 46 1HG2 ILE 46 -2.750 8.532 3.661 344 HG22 ILE 46 2HG2 ILE 46 -3.907 7.906 2.487 345 HG23 ILE 46 3HG2 ILE 46 -2.812 9.212 2.034 346 HD11 ILE 46 3HD1 ILE 46 -0.971 4.999 4.586 347 HD12 ILE 46 1HD1 ILE 46 -0.989 6.755 4.745 348 HD13 ILE 46 2HD1 ILE 46 0.085 5.987 3.574 349 H HIS 47 H HIS 47 -3.557 8.835 -0.159 350 HA HIS 47 HA HIS 47 -1.294 10.248 -1.424 351 HB2 HIS 47 2HB HIS 47 -4.092 10.062 -2.556 352 HB3 HIS 47 1HB HIS 47 -2.690 10.838 -3.306 353 HD1 HIS 47 1HD HIS 47 -1.521 9.434 -4.971 354 HD2 HIS 47 2HD HIS 47 -3.559 7.131 -2.177 355 HE1 HIS 47 1HE HIS 47 -1.242 7.055 -5.732 356 HE2 HIS 47 2HE HIS 47 -2.580 5.689 -4.091 357 H LYS 48 H LYS 48 -1.018 11.830 0.097 358 HA LYS 48 HA LYS 48 -3.393 13.513 0.641 359 HB2 LYS 48 2HB LYS 48 -1.550 12.342 2.424 360 HB3 LYS 48 1HB LYS 48 -1.252 14.072 2.461 361 HG2 LYS 48 2HG LYS 48 -2.864 14.038 4.021 362 HG3 LYS 48 1HG LYS 48 -3.929 14.072 2.616 363 HD2 LYS 48 2HD LYS 48 -4.816 12.142 3.265 364 HD3 LYS 48 1HD LYS 48 -3.242 11.367 3.076 365 HE2 LYS 48 2HE LYS 48 -4.232 11.072 5.334 366 HE3 LYS 48 1HE LYS 48 -2.660 11.868 5.352 367 HZ1 LYS 48 3HZ LYS 48 -5.097 12.798 6.387 368 HZ2 LYS 48 1HZ LYS 48 -4.618 13.849 5.150 369 HZ3 LYS 48 2HZ LYS 48 -3.578 13.539 6.449 370 H SER 49 H SER 49 -2.745 15.838 1.247 371 HA SER 49 HA SER 49 -2.019 17.864 0.504 372 HB2 SER 49 2HB SER 49 0.321 16.216 0.854 373 HB3 SER 49 1HB SER 49 0.576 17.344 -0.476 374 HG SER 49 HG SER 49 0.684 18.914 0.910 375 H TRP 50 H TRP 50 -0.385 18.679 -1.565 376 HA TRP 50 HA TRP 50 -1.997 18.663 -3.781 377 HB2 TRP 50 2HB TRP 50 0.031 19.261 -5.101 378 HB3 TRP 50 1HB TRP 50 -0.111 20.184 -3.598 379 HD1 TRP 50 HD TRP 50 1.949 17.341 -5.176 380 HE1 TRP 50 1HE TRP 50 4.168 17.136 -3.888 381 HE3 TRP 50 3HE TRP 50 1.008 20.662 -1.405 382 HZ2 TRP 50 2HZ TRP 50 5.361 18.236 -1.579 383 HZ3 TRP 50 3HZ TRP 50 2.740 21.028 0.305 384 HH2 TRP 50 HH TRP 50 4.871 19.838 0.218 385 H CYS 51 H CYS 51 0.470 16.362 -2.853 386 HA CYS 51 HA CYS 51 1.087 14.324 -3.629 387 HB2 CYS 51 2HB CYS 51 -0.998 13.604 -2.801 388 HB3 CYS 51 1HB CYS 51 -1.884 14.363 -4.116 389 H GLY 52 H GLY 52 2.420 14.160 -5.333 390 HA2 GLY 52 2HA GLY 52 1.416 14.909 -7.994 391 HA3 GLY 52 1HA GLY 52 3.115 14.735 -7.556 392 H ALA 53 H ALA 53 2.549 12.209 -6.116 393 HA ALA 53 HA ALA 53 3.118 10.427 -8.198 394 HB1 ALA 53 1HB ALA 53 3.796 10.007 -5.891 395 HB2 ALA 53 2HB ALA 53 2.863 8.658 -6.538 396 HB3 ALA 53 3HB ALA 53 2.104 9.803 -5.433 397 H CYS 54 H CYS 54 0.136 11.640 -7.060 398 HA CYS 54 HA CYS 54 -1.347 9.430 -8.157 399 HB2 CYS 54 2HB CYS 54 -3.344 11.049 -7.684 400 HB3 CYS 54 1HB CYS 54 -2.506 10.287 -6.329 401 H LYS 55 H LYS 55 -0.672 12.803 -8.979 402 HA LYS 55 HA LYS 55 -2.292 12.852 -11.301 403 HB2 LYS 55 2HB LYS 55 -0.904 14.812 -11.974 404 HB3 LYS 55 1HB LYS 55 -1.567 14.943 -10.352 405 HG2 LYS 55 2HG LYS 55 0.555 14.325 -9.394 406 HG3 LYS 55 1HG LYS 55 1.239 14.086 -11.010 407 HD2 LYS 55 2HD LYS 55 0.324 16.608 -11.252 408 HD3 LYS 55 1HD LYS 55 0.678 16.583 -9.524 409 HE2 LYS 55 2HE LYS 55 2.945 15.576 -10.233 410 HE3 LYS 55 1HE LYS 55 2.541 16.179 -11.839 411 HZ1 LYS 55 3HZ LYS 55 2.111 18.376 -10.551 412 HZ2 LYS 55 1HZ LYS 55 3.694 17.932 -10.954 413 HZ3 LYS 55 2HZ LYS 55 3.119 17.685 -9.383 414 H ALA 56 H ALA 56 1.122 12.031 -10.726 415 HA ALA 56 HA ALA 56 1.822 11.643 -13.430 416 HB1 ALA 56 1HB ALA 56 3.193 11.562 -11.098 417 HB2 ALA 56 2HB ALA 56 3.815 10.943 -12.628 418 HB3 ALA 56 3HB ALA 56 3.078 9.841 -11.466 419 H LEU 57 H LEU 57 0.635 9.363 -10.970 420 HA LEU 57 HA LEU 57 0.662 7.026 -12.403 421 HB2 LEU 57 2HB LEU 57 -1.329 8.051 -10.393 422 HB3 LEU 57 1HB LEU 57 -1.436 6.439 -11.062 423 HG LEU 57 HG LEU 57 0.031 7.296 -8.812 424 HD11 LEU 57 1HD1 LEU 57 0.681 4.638 -9.771 425 HD12 LEU 57 2HD1 LEU 57 -1.049 4.981 -9.812 426 HD13 LEU 57 3HD1 LEU 57 -0.152 5.147 -8.304 427 HD21 LEU 57 3HD2 LEU 57 1.856 6.295 -10.994 428 HD22 LEU 57 1HD2 LEU 57 2.292 6.548 -9.304 429 HD23 LEU 57 2HD2 LEU 57 1.860 7.923 -10.319 430 H LYS 58 H LYS 58 -1.514 9.737 -12.762 431 HA LYS 58 HA LYS 58 -3.644 8.604 -14.044 432 HB2 LYS 58 2HB LYS 58 -2.334 11.262 -14.570 433 HB3 LYS 58 1HB LYS 58 -3.879 10.795 -15.261 434 HG2 LYS 58 2HG LYS 58 -4.791 10.536 -13.003 435 HG3 LYS 58 1HG LYS 58 -3.236 11.017 -12.326 436 HD2 LYS 58 2HD LYS 58 -5.207 12.678 -13.872 437 HD3 LYS 58 1HD LYS 58 -4.552 12.957 -12.257 438 HE2 LYS 58 2HE LYS 58 -2.374 13.456 -13.193 439 HE3 LYS 58 1HE LYS 58 -2.958 13.087 -14.815 440 HZ1 LYS 58 3HZ LYS 58 -2.982 15.535 -13.574 441 HZ2 LYS 58 1HZ LYS 58 -4.598 15.032 -13.541 442 HZ3 LYS 58 2HZ LYS 58 -3.771 15.126 -15.013 443 HA PRO 59 HA PRO 59 -1.854 8.716 -18.450 444 HB2 PRO 59 2HB PRO 59 0.545 9.816 -18.978 445 HB3 PRO 59 1HB PRO 59 -0.938 10.786 -18.859 446 HG2 PRO 59 2HG PRO 59 1.181 10.308 -16.782 447 HG3 PRO 59 1HG PRO 59 0.432 11.837 -17.280 448 HD2 PRO 59 2HD PRO 59 -0.373 10.519 -15.073 449 HD3 PRO 59 1HD PRO 59 -1.506 11.428 -16.102 450 H LYS 60 H LYS 60 0.542 8.080 -15.937 451 HA LYS 60 HA LYS 60 1.813 6.065 -17.643 452 HB2 LYS 60 2HB LYS 60 3.531 5.916 -15.919 453 HB3 LYS 60 1HB LYS 60 3.295 7.582 -16.430 454 HG2 LYS 60 2HG LYS 60 1.564 7.436 -14.386 455 HG3 LYS 60 1HG LYS 60 2.794 6.307 -13.829 456 HD2 LYS 60 2HD LYS 60 3.203 8.640 -13.061 457 HD3 LYS 60 1HD LYS 60 4.512 8.004 -14.050 458 HE2 LYS 60 2HE LYS 60 2.536 9.325 -15.681 459 HE3 LYS 60 1HE LYS 60 3.135 10.397 -14.419 460 HZ1 LYS 60 3HZ LYS 60 5.424 9.721 -15.152 461 HZ2 LYS 60 1HZ LYS 60 4.557 10.666 -16.256 462 HZ3 LYS 60 2HZ LYS 60 4.705 8.999 -16.503 463 H PHE 61 H PHE 61 0.340 6.251 -14.370 464 HA PHE 61 HA PHE 61 0.469 3.449 -14.007 465 HB2 PHE 61 2HB PHE 61 0.195 5.250 -12.195 466 HB3 PHE 61 1HB PHE 61 -1.520 5.223 -12.613 467 HD1 PHE 61 1HD PHE 61 1.287 3.071 -11.512 468 HD2 PHE 61 2HD PHE 61 -2.929 3.589 -11.723 469 HE1 PHE 61 1HE PHE 61 0.980 1.114 -10.055 470 HE2 PHE 61 2HE PHE 61 -3.243 1.632 -10.261 471 HZ PHE 61 HZ PHE 61 -1.288 0.393 -9.425 472 H ALA 62 H ALA 62 -1.528 5.482 -15.862 473 HA ALA 62 HA ALA 62 -3.889 3.946 -15.963 474 HB1 ALA 62 1HB ALA 62 -4.250 5.891 -17.096 475 HB2 ALA 62 2HB ALA 62 -3.744 4.914 -18.475 476 HB3 ALA 62 3HB ALA 62 -2.587 5.982 -17.678 477 H GLU 63 H GLU 63 -0.696 3.527 -17.003 478 HA GLU 63 HA GLU 63 -0.986 1.586 -19.050 479 HB2 GLU 63 2HB GLU 63 1.024 3.084 -18.587 480 HB3 GLU 63 1HB GLU 63 1.380 2.029 -17.217 481 HG2 GLU 63 2HG GLU 63 2.701 1.034 -18.761 482 HG3 GLU 63 1HG GLU 63 1.207 0.167 -19.114 483 H SER 64 H SER 64 -1.424 1.542 -15.721 484 HA SER 64 HA SER 64 -0.530 -0.933 -14.898 485 HB2 SER 64 2HB SER 64 -2.841 0.780 -14.079 486 HB3 SER 64 1HB SER 64 -2.542 -0.760 -13.293 487 HG SER 64 HG SER 64 -0.710 1.400 -13.481 488 H THR 65 H THR 65 -2.534 -0.526 -17.477 489 HA THR 65 HA THR 65 -4.671 -2.221 -17.204 490 HB THR 65 HB THR 65 -3.902 -2.967 -19.661 491 HG1 THR 65 1HG THR 65 -2.601 -0.477 -19.427 492 HG21 THR 65 3HG2 THR 65 -4.889 -0.908 -20.585 493 HG22 THR 65 1HG2 THR 65 -4.880 -0.208 -18.966 494 HG23 THR 65 2HG2 THR 65 -5.865 -1.630 -19.306 495 H GLU 66 H GLU 66 -1.273 -2.982 -17.565 496 HA GLU 66 HA GLU 66 -1.705 -5.829 -17.583 497 HB2 GLU 66 2HB GLU 66 0.778 -5.960 -17.371 498 HB3 GLU 66 1HB GLU 66 0.244 -5.011 -18.759 499 HG2 GLU 66 2HG GLU 66 0.637 -3.448 -16.335 500 HG3 GLU 66 1HG GLU 66 2.099 -4.234 -16.923 501 H ILE 67 H ILE 67 -0.990 -3.272 -15.317 502 HA ILE 67 HA ILE 67 -0.313 -4.980 -13.130 503 HB ILE 67 HB ILE 67 -1.399 -2.164 -13.050 504 HG12 ILE 67 2HG1 ILE 67 1.471 -3.121 -12.988 505 HG13 ILE 67 1HG1 ILE 67 0.680 -2.397 -14.394 506 HG21 ILE 67 1HG2 ILE 67 -0.274 -3.996 -10.993 507 HG22 ILE 67 2HG2 ILE 67 -1.614 -2.857 -10.877 508 HG23 ILE 67 3HG2 ILE 67 0.048 -2.267 -10.862 509 HD11 ILE 67 3HD1 ILE 67 2.092 -1.091 -12.384 510 HD12 ILE 67 1HD1 ILE 67 0.398 -0.713 -12.077 511 HD13 ILE 67 2HD1 ILE 67 1.110 -0.357 -13.651 512 H SER 68 H SER 68 -3.226 -4.306 -14.748 513 HA SER 68 HA SER 68 -5.082 -4.418 -12.629 514 HB2 SER 68 2HB SER 68 -6.742 -4.767 -14.292 515 HB3 SER 68 1HB SER 68 -5.509 -3.779 -15.076 516 HG SER 68 HG SER 68 -6.398 -5.820 -16.142 517 H GLU 69 H GLU 69 -3.432 -6.882 -14.495 518 HA GLU 69 HA GLU 69 -4.780 -8.996 -12.976 519 HB2 GLU 69 2HB GLU 69 -3.229 -10.396 -14.651 520 HB3 GLU 69 1HB GLU 69 -4.823 -9.812 -15.102 521 HG2 GLU 69 2HG GLU 69 -3.787 -7.852 -16.157 522 HG3 GLU 69 1HG GLU 69 -2.197 -8.489 -15.744 523 H LEU 70 H LEU 70 -1.694 -7.504 -13.576 524 HA LEU 70 HA LEU 70 0.039 -9.294 -12.310 525 HB2 LEU 70 2HB LEU 70 0.215 -6.825 -13.529 526 HB3 LEU 70 1HB LEU 70 0.628 -6.458 -11.855 527 HG LEU 70 HG LEU 70 2.003 -8.644 -13.403 528 HD11 LEU 70 1HD1 LEU 70 3.109 -5.891 -13.064 529 HD12 LEU 70 2HD1 LEU 70 2.067 -6.275 -14.438 530 HD13 LEU 70 3HD1 LEU 70 3.583 -7.151 -14.204 531 HD21 LEU 70 3HD2 LEU 70 2.085 -7.760 -10.717 532 HD22 LEU 70 1HD2 LEU 70 3.599 -7.265 -11.474 533 HD23 LEU 70 2HD2 LEU 70 3.112 -8.960 -11.501 534 H SER 71 H SER 71 -1.852 -6.616 -11.083 535 HA SER 71 HA SER 71 -1.031 -6.315 -8.515 536 HB2 SER 71 2HB SER 71 -3.588 -5.942 -9.917 537 HB3 SER 71 1HB SER 71 -3.706 -6.095 -8.163 538 HG SER 71 HG SER 71 -2.013 -4.443 -8.097 539 H HIS 72 H HIS 72 -2.341 -9.223 -9.729 540 HA HIS 72 HA HIS 72 -3.763 -10.259 -7.600 541 HB2 HIS 72 2HB HIS 72 -2.363 -11.323 -9.924 542 HB3 HIS 72 1HB HIS 72 -2.285 -12.425 -8.543 543 HD1 HIS 72 1HD HIS 72 -4.269 -13.875 -8.197 544 HD2 HIS 72 2HD HIS 72 -5.139 -10.592 -10.591 545 HE1 HIS 72 1HE HIS 72 -6.630 -14.227 -8.989 546 HE2 HIS 72 2HE HIS 72 -7.165 -12.183 -10.362 547 H ASN 73 H ASN 73 -0.500 -9.379 -7.770 548 HA ASN 73 HA ASN 73 0.671 -11.157 -5.933 549 HB2 ASN 73 2HB ASN 73 1.361 -8.326 -6.740 550 HB3 ASN 73 1HB ASN 73 2.406 -9.379 -5.791 551 HD21 ASN 73 1HD2 ASN 73 1.776 -8.293 -8.826 552 HD22 ASN 73 2HD2 ASN 73 2.473 -9.596 -9.742 553 H PHE 74 H PHE 74 -1.109 -8.176 -5.546 554 HA PHE 74 HA PHE 74 -1.371 -8.635 -2.686 555 HB2 PHE 74 2HB PHE 74 -1.081 -5.969 -2.601 556 HB3 PHE 74 1HB PHE 74 0.275 -7.083 -2.400 557 HD1 PHE 74 1HD PHE 74 -1.536 -5.174 -5.029 558 HD2 PHE 74 2HD PHE 74 2.131 -6.883 -3.720 559 HE1 PHE 74 1HE PHE 74 -0.385 -4.164 -6.957 560 HE2 PHE 74 2HE PHE 74 3.293 -5.876 -5.643 561 HZ PHE 74 HZ PHE 74 2.033 -4.515 -7.265 562 H VAL 75 H VAL 75 -2.885 -6.353 -2.036 563 HA VAL 75 HA VAL 75 -4.908 -6.220 -4.139 564 HB VAL 75 HB VAL 75 -5.567 -8.120 -2.727 565 HG11 VAL 75 1HG1 VAL 75 -4.642 -7.075 -0.603 566 HG12 VAL 75 2HG1 VAL 75 -6.192 -7.905 -0.472 567 HG13 VAL 75 3HG1 VAL 75 -6.138 -6.143 -0.540 568 HG21 VAL 75 3HG2 VAL 75 -7.738 -6.287 -2.078 569 HG22 VAL 75 1HG2 VAL 75 -7.708 -7.648 -3.195 570 HG23 VAL 75 2HG2 VAL 75 -7.135 -6.068 -3.717 571 H MET 76 H MET 76 -6.279 -4.624 -4.152 572 HA MET 76 HA MET 76 -5.808 -2.104 -3.770 573 HB2 MET 76 2HB MET 76 -8.334 -1.922 -3.571 574 HB3 MET 76 1HB MET 76 -7.683 -2.783 -4.947 575 HG2 MET 76 2HG MET 76 -8.112 -4.520 -2.663 576 HG3 MET 76 1HG MET 76 -9.587 -3.711 -3.153 577 HE1 MET 76 3HE MET 76 -6.801 -4.604 -5.830 578 HE2 MET 76 1HE MET 76 -8.178 -3.702 -6.463 579 HE3 MET 76 2HE MET 76 -7.892 -5.359 -6.987 580 H VAL 77 H VAL 77 -5.063 -1.030 -1.936 581 HA VAL 77 HA VAL 77 -6.994 -0.669 0.187 582 HB VAL 77 HB VAL 77 -4.455 -0.928 1.514 583 HG11 VAL 77 1HG1 VAL 77 -5.714 -1.819 3.166 584 HG12 VAL 77 2HG1 VAL 77 -6.666 -2.811 2.060 585 HG13 VAL 77 3HG1 VAL 77 -7.017 -1.091 2.227 586 HG21 VAL 77 3HG2 VAL 77 -3.998 -2.543 -0.269 587 HG22 VAL 77 1HG2 VAL 77 -5.444 -3.437 0.197 588 HG23 VAL 77 2HG2 VAL 77 -4.094 -3.291 1.325 589 H ASN 78 H ASN 78 -6.584 1.233 -1.510 590 HA ASN 78 HA ASN 78 -4.470 2.992 -0.532 591 HB2 ASN 78 2HB ASN 78 -4.332 3.329 -2.758 592 HB3 ASN 78 1HB ASN 78 -5.945 2.717 -3.046 593 HD21 ASN 78 1HD2 ASN 78 -4.577 5.489 -1.307 594 HD22 ASN 78 2HD2 ASN 78 -5.571 6.684 -2.079 595 H LEU 79 H LEU 79 -4.924 4.279 1.076 596 HA LEU 79 HA LEU 79 -7.692 5.260 1.356 597 HB2 LEU 79 2HB LEU 79 -7.230 5.612 3.713 598 HB3 LEU 79 1HB LEU 79 -6.926 3.948 3.254 599 HG LEU 79 HG LEU 79 -4.452 5.160 2.966 600 HD11 LEU 79 1HD1 LEU 79 -4.504 5.991 5.563 601 HD12 LEU 79 2HD1 LEU 79 -6.047 6.591 4.961 602 HD13 LEU 79 3HD1 LEU 79 -4.548 7.056 4.158 603 HD21 LEU 79 3HD2 LEU 79 -3.780 3.587 4.469 604 HD22 LEU 79 1HD2 LEU 79 -5.374 2.941 4.079 605 HD23 LEU 79 2HD2 LEU 79 -5.141 3.879 5.553 606 H GLU 80 H GLU 80 -7.843 7.432 2.494 607 HA GLU 80 HA GLU 80 -5.734 9.265 1.592 608 HB2 GLU 80 2HB GLU 80 -8.132 8.995 0.265 609 HB3 GLU 80 1HB GLU 80 -8.448 10.353 1.352 610 HG2 GLU 80 2HG GLU 80 -6.917 11.708 0.332 611 HG3 GLU 80 1HG GLU 80 -5.934 10.351 -0.243 612 H ASP 81 H ASP 81 -6.803 11.638 2.363 613 HA ASP 81 HA ASP 81 -6.220 11.839 5.042 614 HB2 ASP 81 2HB ASP 81 -7.513 14.012 4.960 615 HB3 ASP 81 1HB ASP 81 -6.279 13.821 3.718 616 H GLU 82 H GLU 82 -9.206 10.852 3.562 617 HA GLU 82 HA GLU 82 -11.030 11.334 5.599 618 HB2 GLU 82 2HB GLU 82 -10.838 9.392 3.361 619 HB3 GLU 82 1HB GLU 82 -11.992 9.020 4.634 620 HG2 GLU 82 2HG GLU 82 -12.725 11.512 4.255 621 HG3 GLU 82 1HG GLU 82 -11.977 11.257 2.679 622 H GLU 83 H GLU 83 -8.560 8.886 5.334 623 HA GLU 83 HA GLU 83 -9.354 7.868 7.984 624 HB2 GLU 83 2HB GLU 83 -8.793 6.434 5.491 625 HB3 GLU 83 1HB GLU 83 -7.883 5.824 6.865 626 HG2 GLU 83 2HG GLU 83 -9.678 4.883 7.787 627 HG3 GLU 83 1HG GLU 83 -10.693 6.295 7.470 628 H GLU 84 H GLU 84 -7.906 9.669 8.651 629 HA GLU 84 HA GLU 84 -5.122 9.567 8.110 630 HB2 GLU 84 2HB GLU 84 -4.982 11.117 10.107 631 HB3 GLU 84 1HB GLU 84 -6.009 11.657 8.784 632 HG2 GLU 84 2HG GLU 84 -7.894 11.521 10.007 633 HG3 GLU 84 1HG GLU 84 -7.344 10.105 10.901 634 HA PRO 85 HA PRO 85 -4.408 6.019 10.823 635 HB2 PRO 85 2HB PRO 85 -1.594 6.525 10.072 636 HB3 PRO 85 1HB PRO 85 -2.565 5.052 9.892 637 HG2 PRO 85 2HG PRO 85 -1.900 6.555 7.775 638 HG3 PRO 85 1HG PRO 85 -3.479 5.742 7.882 639 HD2 PRO 85 2HD PRO 85 -2.783 8.618 8.373 640 HD3 PRO 85 1HD PRO 85 -4.192 7.922 7.535 641 H LYS 86 H LYS 86 -2.678 9.075 10.828 642 HA LYS 86 HA LYS 86 -1.814 10.349 12.502 643 HB2 LYS 86 2HB LYS 86 -4.095 9.721 13.505 644 HB3 LYS 86 1HB LYS 86 -3.199 8.553 14.485 645 HG2 LYS 86 2HG LYS 86 -1.812 10.432 15.340 646 HG3 LYS 86 1HG LYS 86 -2.865 11.547 14.464 647 HD2 LYS 86 2HD LYS 86 -4.176 11.577 16.266 648 HD3 LYS 86 1HD LYS 86 -4.603 9.905 15.897 649 HE2 LYS 86 2HE LYS 86 -2.473 9.290 17.193 650 HE3 LYS 86 1HE LYS 86 -2.531 10.944 17.805 651 HZ1 LYS 86 3HZ LYS 86 -4.213 8.676 18.444 652 HZ2 LYS 86 1HZ LYS 86 -5.041 10.137 18.234 653 HZ3 LYS 86 2HZ LYS 86 -3.806 10.022 19.385 654 H ASP 87 H ASP 87 -0.452 7.897 11.574 655 HA ASP 87 HA ASP 87 1.592 7.844 13.604 656 HB2 ASP 87 2HB ASP 87 -0.333 5.948 13.907 657 HB3 ASP 87 1HB ASP 87 0.799 5.099 12.844 658 H GLU 88 H GLU 88 3.073 5.705 12.760 659 HA GLU 88 HA GLU 88 4.379 6.695 10.497 660 HB2 GLU 88 2HB GLU 88 4.473 3.965 11.782 661 HB3 GLU 88 1HB GLU 88 5.570 4.486 10.514 662 HG2 GLU 88 2HG GLU 88 5.270 5.910 13.142 663 HG3 GLU 88 1HG GLU 88 6.467 4.651 12.836 664 H ASP 89 H ASP 89 1.532 4.847 10.700 665 HA ASP 89 HA ASP 89 1.659 3.237 8.439 666 HB2 ASP 89 2HB ASP 89 -0.234 3.788 10.361 667 HB3 ASP 89 1HB ASP 89 -0.984 4.400 8.879 668 H PHE 90 H PHE 90 1.635 6.658 8.539 669 HA PHE 90 HA PHE 90 0.637 6.751 5.778 670 HB2 PHE 90 2HB PHE 90 0.475 9.242 6.162 671 HB3 PHE 90 1HB PHE 90 -0.630 8.245 7.114 672 HD1 PHE 90 2HD PHE 90 2.834 9.633 7.427 673 HD2 PHE 90 1HD PHE 90 -0.917 8.871 9.284 674 HE1 PHE 90 2HE PHE 90 3.633 10.727 9.476 675 HE2 PHE 90 1HE PHE 90 -0.128 9.974 11.336 676 HZ PHE 90 HZ PHE 90 2.152 10.902 11.435 677 H SER 91 H SER 91 3.461 7.273 7.719 678 HA SER 91 HA SER 91 5.081 7.509 5.363 679 HB2 SER 91 2HB SER 91 5.128 9.859 7.270 680 HB3 SER 91 1HB SER 91 6.013 9.687 5.745 681 HG SER 91 HG SER 91 3.980 10.973 5.755 682 HA PRO 92 HA PRO 92 7.300 5.759 8.994 683 HB2 PRO 92 2HB PRO 92 7.576 3.229 8.062 684 HB3 PRO 92 1HB PRO 92 6.142 3.784 8.940 685 HG2 PRO 92 2HG PRO 92 6.459 3.149 6.091 686 HG3 PRO 92 1HG PRO 92 4.989 3.232 7.069 687 HD2 PRO 92 2HD PRO 92 6.025 5.202 5.254 688 HD3 PRO 92 1HD PRO 92 4.547 5.278 6.226 689 H ASP 93 H ASP 93 8.498 7.350 7.038 690 HA ASP 93 HA ASP 93 11.117 6.224 6.968 691 HB2 ASP 93 2HB ASP 93 9.424 6.101 4.536 692 HB3 ASP 93 1HB ASP 93 11.082 6.676 4.307 693 H GLY 94 H GLY 94 9.620 8.443 4.637 694 HA2 GLY 94 2HA GLY 94 11.503 10.511 5.499 695 HA3 GLY 94 1HA GLY 94 10.539 10.528 4.019 696 H GLY 95 H GLY 95 9.996 12.726 4.562 697 HA2 GLY 95 2HA GLY 95 8.114 12.974 6.819 698 HA3 GLY 95 1HA GLY 95 8.976 14.316 6.060 699 H TYR 96 H TYR 96 8.162 12.694 3.449 700 HA TYR 96 HA TYR 96 6.266 14.399 2.484 701 HB2 TYR 96 2HB TYR 96 5.536 12.356 1.020 702 HB3 TYR 96 1HB TYR 96 7.155 13.042 0.841 703 HD1 TYR 96 1HD TYR 96 9.102 11.849 1.902 704 HD2 TYR 96 2HD TYR 96 5.224 10.115 1.685 705 HE1 TYR 96 1HE TYR 96 10.079 9.628 2.297 706 HE2 TYR 96 2HE TYR 96 6.190 7.886 2.075 707 HH TYR 96 HH TYR 96 9.602 7.326 2.023 708 H ILE 97 H ILE 97 3.955 14.013 1.946 709 HA ILE 97 HA ILE 97 2.541 12.407 3.934 710 HB ILE 97 HB ILE 97 0.957 14.472 4.168 711 HG12 ILE 97 2HG1 ILE 97 3.313 16.187 4.011 712 HG13 ILE 97 1HG1 ILE 97 2.816 15.551 2.438 713 HG21 ILE 97 1HG2 ILE 97 3.635 14.231 5.518 714 HG22 ILE 97 2HG2 ILE 97 2.086 13.588 6.063 715 HG23 ILE 97 3HG2 ILE 97 2.363 15.330 6.054 716 HD11 ILE 97 3HD1 ILE 97 0.613 16.459 2.720 717 HD12 ILE 97 1HD1 ILE 97 1.812 17.730 2.958 718 HD13 ILE 97 2HD1 ILE 97 1.009 17.004 4.353 719 HA PRO 98 HA PRO 98 1.887 10.317 3.262 720 HB2 PRO 98 2HB PRO 98 -0.965 9.787 2.331 721 HB3 PRO 98 1HB PRO 98 -0.038 8.895 3.570 722 HG2 PRO 98 2HG PRO 98 -1.445 11.352 3.865 723 HG3 PRO 98 1HG PRO 98 -0.457 10.491 5.074 724 HD2 PRO 98 2HD PRO 98 0.421 12.772 4.231 725 HD3 PRO 98 1HD PRO 98 1.553 11.410 4.265 726 H ARG 99 H ARG 99 2.667 8.480 2.265 727 HA ARG 99 HA ARG 99 2.424 8.449 -0.678 728 HB2 ARG 99 2HB ARG 99 4.686 8.327 1.132 729 HB3 ARG 99 1HB ARG 99 4.708 7.016 -0.048 730 HG2 ARG 99 2HG ARG 99 5.958 8.998 -0.788 731 HG3 ARG 99 1HG ARG 99 4.619 8.597 -1.865 732 HD2 ARG 99 2HD ARG 99 3.510 10.338 -0.012 733 HD3 ARG 99 1HD ARG 99 5.111 11.004 -0.326 734 HE ARG 99 HE ARG 99 3.720 10.304 -2.725 735 HH11 ARG 99 1HH1 ARG 99 4.070 12.771 -0.280 736 HH12 ARG 99 2HH1 ARG 99 3.544 14.052 -1.320 737 HH21 ARG 99 1HH2 ARG 99 3.029 11.990 -4.094 738 HH22 ARG 99 2HH2 ARG 99 2.953 13.609 -3.483 739 H ILE 100 H ILE 100 3.610 6.062 -1.275 740 HA ILE 100 HA ILE 100 1.482 4.223 -0.573 741 HB ILE 100 HB ILE 100 1.826 3.206 -2.518 742 HG12 ILE 100 2HG1 ILE 100 3.844 2.026 -1.560 743 HG13 ILE 100 1HG1 ILE 100 3.851 2.233 -3.304 744 HG21 ILE 100 1HG2 ILE 100 3.942 5.084 -3.396 745 HG22 ILE 100 2HG2 ILE 100 2.394 5.753 -2.886 746 HG23 ILE 100 3HG2 ILE 100 2.456 4.582 -4.199 747 HD11 ILE 100 3HD1 ILE 100 5.259 4.172 -1.520 748 HD12 ILE 100 1HD1 ILE 100 5.519 3.842 -3.231 749 HD13 ILE 100 2HD1 ILE 100 6.014 2.661 -2.018 750 H LEU 101 H LEU 101 1.577 2.576 0.806 751 HA LEU 101 HA LEU 101 4.205 1.793 1.891 752 HB2 LEU 101 2HB LEU 101 1.681 2.570 3.280 753 HB3 LEU 101 1HB LEU 101 2.749 1.407 4.029 754 HG LEU 101 HG LEU 101 4.496 3.002 4.243 755 HD11 LEU 101 1HD1 LEU 101 3.963 5.412 3.426 756 HD12 LEU 101 2HD1 LEU 101 2.886 4.590 2.298 757 HD13 LEU 101 3HD1 LEU 101 4.614 4.223 2.300 758 HD21 LEU 101 3HD2 LEU 101 2.782 5.023 5.086 759 HD22 LEU 101 1HD2 LEU 101 3.390 3.678 6.050 760 HD23 LEU 101 2HD2 LEU 101 1.839 3.541 5.224 761 H PHE 102 H PHE 102 4.587 -0.386 2.036 762 HA PHE 102 HA PHE 102 2.330 -2.155 1.365 763 HB2 PHE 102 2HB PHE 102 4.664 -2.147 0.161 764 HB3 PHE 102 1HB PHE 102 5.162 -3.088 1.557 765 HD1 PHE 102 1HD PHE 102 3.405 -5.045 2.152 766 HD2 PHE 102 2HD PHE 102 4.043 -3.334 -1.690 767 HE1 PHE 102 1HE PHE 102 2.517 -7.082 1.104 768 HE2 PHE 102 2HE PHE 102 3.158 -5.371 -2.748 769 HZ PHE 102 HZ PHE 102 2.391 -7.248 -1.351 770 H LEU 103 H LEU 103 1.652 -3.788 2.757 771 HA LEU 103 HA LEU 103 3.162 -4.247 5.200 772 HB2 LEU 103 2HB LEU 103 0.805 -3.974 6.399 773 HB3 LEU 103 1HB LEU 103 1.965 -2.678 6.253 774 HG LEU 103 HG LEU 103 0.747 -1.829 4.281 775 HD11 LEU 103 1HD1 LEU 103 -1.754 -3.013 4.548 776 HD12 LEU 103 2HD1 LEU 103 -0.615 -4.360 4.572 777 HD13 LEU 103 3HD1 LEU 103 -0.616 -3.229 3.220 778 HD21 LEU 103 3HD2 LEU 103 -1.495 -1.566 5.854 779 HD22 LEU 103 1HD2 LEU 103 -0.066 -0.537 5.900 780 HD23 LEU 103 2HD2 LEU 103 -0.213 -1.890 7.018 781 H ASP 104 H ASP 104 1.825 -5.756 6.695 782 HA ASP 104 HA ASP 104 1.371 -8.154 5.189 783 HB2 ASP 104 2HB ASP 104 2.255 -7.627 7.728 784 HB3 ASP 104 1HB ASP 104 0.600 -8.178 8.029 785 HA PRO 105 HA PRO 105 -2.956 -8.181 4.403 786 HB2 PRO 105 2HB PRO 105 -2.913 -10.838 5.777 787 HB3 PRO 105 1HB PRO 105 -3.610 -10.388 4.208 788 HG2 PRO 105 2HG PRO 105 -1.297 -11.706 4.348 789 HG3 PRO 105 1HG PRO 105 -1.556 -10.431 3.136 790 HD2 PRO 105 2HD PRO 105 0.065 -10.376 5.632 791 HD3 PRO 105 1HD PRO 105 0.323 -9.524 4.097 792 H SER 106 H SER 106 -3.552 -6.565 5.890 793 HA SER 106 HA SER 106 -5.536 -6.980 7.638 794 HB2 SER 106 2HB SER 106 -2.947 -7.656 8.936 795 HB3 SER 106 1HB SER 106 -4.066 -6.663 9.884 796 HG SER 106 HG SER 106 -5.628 -8.270 9.636 797 H GLY 107 H GLY 107 -2.591 -5.260 6.993 798 HA2 GLY 107 2HA GLY 107 -2.760 -2.900 6.463 799 HA3 GLY 107 1HA GLY 107 -3.950 -2.756 7.762 800 H LYS 108 H LYS 108 -0.853 -4.488 7.844 801 HA LYS 108 HA LYS 108 -0.061 -2.706 10.059 802 HB2 LYS 108 2HB LYS 108 0.159 -5.584 9.602 803 HB3 LYS 108 1HB LYS 108 1.668 -4.857 10.137 804 HG2 LYS 108 2HG LYS 108 -0.042 -3.723 11.881 805 HG3 LYS 108 1HG LYS 108 -0.858 -5.268 11.588 806 HD2 LYS 108 2HD LYS 108 1.365 -6.380 12.049 807 HD3 LYS 108 1HD LYS 108 1.939 -4.810 12.613 808 HE2 LYS 108 2HE LYS 108 -0.026 -4.796 14.196 809 HE3 LYS 108 1HE LYS 108 -0.294 -6.481 13.747 810 HZ1 LYS 108 3HZ LYS 108 2.185 -6.726 14.398 811 HZ2 LYS 108 1HZ LYS 108 1.007 -6.672 15.612 812 HZ3 LYS 108 2HZ LYS 108 1.930 -5.297 15.265 813 H VAL 109 H VAL 109 0.845 -1.052 8.774 814 HA VAL 109 HA VAL 109 2.697 -1.376 6.711 815 HB VAL 109 HB VAL 109 1.494 0.770 7.728 816 HG11 VAL 109 1HG1 VAL 109 3.117 2.268 8.784 817 HG12 VAL 109 2HG1 VAL 109 4.300 0.967 8.822 818 HG13 VAL 109 3HG1 VAL 109 2.823 0.841 9.776 819 HG21 VAL 109 3HG2 VAL 109 3.953 1.663 6.537 820 HG22 VAL 109 1HG2 VAL 109 2.319 1.652 5.878 821 HG23 VAL 109 2HG2 VAL 109 3.342 0.228 5.714 822 H HIS 110 H HIS 110 4.671 -1.967 6.563 823 HA HIS 110 HA HIS 110 6.320 -2.002 9.002 824 HB2 HIS 110 2HB HIS 110 5.747 -4.127 7.045 825 HB3 HIS 110 1HB HIS 110 7.459 -3.914 7.396 826 HD1 HIS 110 1HD HIS 110 4.238 -4.984 8.964 827 HD2 HIS 110 2HD HIS 110 8.256 -4.649 9.975 828 HE1 HIS 110 1HE HIS 110 4.491 -6.221 11.140 829 HE2 HIS 110 2HE HIS 110 6.907 -5.918 11.781 830 HA PRO 111 HA PRO 111 8.715 0.762 6.426 831 HB2 PRO 111 2HB PRO 111 10.834 1.048 8.111 832 HB3 PRO 111 1HB PRO 111 9.299 1.895 8.339 833 HG2 PRO 111 2HG PRO 111 10.312 -0.585 9.671 834 HG3 PRO 111 1HG PRO 111 9.451 0.794 10.378 835 HD2 PRO 111 2HD PRO 111 8.217 -1.543 9.779 836 HD3 PRO 111 1HD PRO 111 7.392 0.030 9.676 837 H GLU 112 H GLU 112 8.773 -2.033 5.870 838 HA GLU 112 HA GLU 112 11.650 -2.415 5.316 839 HB2 GLU 112 2HB GLU 112 9.703 -4.187 6.529 840 HB3 GLU 112 1HB GLU 112 10.419 -4.917 5.098 841 HG2 GLU 112 2HG GLU 112 12.647 -4.036 6.246 842 HG3 GLU 112 1HG GLU 112 11.652 -4.209 7.692 843 H ILE 113 H ILE 113 8.360 -2.742 4.091 844 HA ILE 113 HA ILE 113 9.437 -3.354 1.433 845 HB ILE 113 HB ILE 113 6.569 -3.477 2.348 846 HG12 ILE 113 2HG1 ILE 113 7.855 -5.121 3.566 847 HG13 ILE 113 1HG1 ILE 113 6.922 -5.948 2.310 848 HG21 ILE 113 1HG2 ILE 113 7.968 -4.311 -0.183 849 HG22 ILE 113 2HG2 ILE 113 6.612 -3.196 -0.002 850 HG23 ILE 113 3HG2 ILE 113 6.377 -4.923 0.274 851 HD11 ILE 113 3HD1 ILE 113 8.972 -6.964 2.134 852 HD12 ILE 113 1HD1 ILE 113 9.861 -5.486 2.500 853 HD13 ILE 113 2HD1 ILE 113 9.107 -5.694 0.919 854 H ILE 114 H ILE 114 10.108 -1.433 0.708 855 HA ILE 114 HA ILE 114 8.082 0.662 0.268 856 HB ILE 114 HB ILE 114 9.726 2.352 0.479 857 HG12 ILE 114 2HG1 ILE 114 11.547 1.069 -0.707 858 HG13 ILE 114 1HG1 ILE 114 12.092 2.001 0.676 859 HG21 ILE 114 1HG2 ILE 114 10.846 0.962 2.742 860 HG22 ILE 114 2HG2 ILE 114 9.117 0.652 2.592 861 HG23 ILE 114 3HG2 ILE 114 9.710 2.310 2.694 862 HD11 ILE 114 3HD1 ILE 114 13.106 0.154 1.359 863 HD12 ILE 114 1HD1 ILE 114 12.253 -0.836 0.175 864 HD13 ILE 114 2HD1 ILE 114 11.506 -0.487 1.735 865 H ASN 115 H ASN 115 9.591 2.231 -1.466 866 HA ASN 115 HA ASN 115 9.689 0.508 -3.837 867 HB2 ASN 115 2HB ASN 115 8.182 2.388 -4.064 868 HB3 ASN 115 1HB ASN 115 9.443 3.510 -3.540 869 HD21 ASN 115 1HD2 ASN 115 9.293 4.732 -5.406 870 HD22 ASN 115 2HD2 ASN 115 9.885 4.160 -6.943 871 H GLU 116 H GLU 116 11.773 -0.331 -3.205 872 HA GLU 116 HA GLU 116 14.064 1.017 -2.611 873 HB2 GLU 116 2HB GLU 116 13.567 -1.482 -4.189 874 HB3 GLU 116 1HB GLU 116 15.213 -0.862 -4.011 875 HG2 GLU 116 2HG GLU 116 13.403 -1.398 -1.676 876 HG3 GLU 116 1HG GLU 116 14.480 -2.614 -2.354 877 H ASN 117 H ASN 117 12.454 0.904 -5.701 878 HA ASN 117 HA ASN 117 14.607 1.770 -7.310 879 HB2 ASN 117 2HB ASN 117 12.497 0.779 -8.191 880 HB3 ASN 117 1HB ASN 117 11.655 2.274 -7.755 881 HD21 ASN 117 1HD2 ASN 117 12.278 4.223 -8.816 882 HD22 ASN 117 2HD2 ASN 117 12.969 4.165 -10.415 883 H GLY 118 H GLY 118 12.435 3.449 -5.166 884 HA2 GLY 118 2HA GLY 118 12.647 6.049 -6.189 885 HA3 GLY 118 1HA GLY 118 12.342 5.640 -4.497 886 H ASN 119 H ASN 119 13.650 7.719 -4.367 887 HA ASN 119 HA ASN 119 16.520 7.312 -4.670 888 HB2 ASN 119 2HB ASN 119 16.715 9.691 -4.077 889 HB3 ASN 119 1HB ASN 119 15.572 9.450 -5.409 890 HD21 ASN 119 1HD2 ASN 119 15.945 10.263 -2.043 891 HD22 ASN 119 2HD2 ASN 119 14.348 10.925 -1.822 892 HA PRO 120 HA PRO 120 17.353 6.562 -0.403 893 HB2 PRO 120 2HB PRO 120 19.623 8.383 -0.317 894 HB3 PRO 120 1HB PRO 120 19.616 6.611 -0.379 895 HG2 PRO 120 2HG PRO 120 20.468 8.173 -2.440 896 HG3 PRO 120 1HG PRO 120 19.743 6.565 -2.670 897 HD2 PRO 120 2HD PRO 120 18.484 9.276 -2.961 898 HD3 PRO 120 1HD PRO 120 18.319 7.835 -3.998 899 H SER 121 H SER 121 15.348 8.450 -0.542 900 HA SER 121 HA SER 121 15.360 9.636 1.952 901 HB2 SER 121 2HB SER 121 16.664 11.270 -0.134 902 HB3 SER 121 1HB SER 121 15.395 12.109 0.772 903 HG SER 121 HG SER 121 17.862 11.686 1.534 904 H TYR 122 H TYR 122 13.646 8.194 0.318 905 HA TYR 122 HA TYR 122 11.273 9.744 0.494 906 HB2 TYR 122 2HB TYR 122 12.756 9.743 -1.995 907 HB3 TYR 122 1HB TYR 122 11.134 9.083 -2.213 908 HD1 TYR 122 2HD TYR 122 9.446 10.647 -0.495 909 HD2 TYR 122 1HD TYR 122 12.822 11.904 -2.757 910 HE1 TYR 122 2HE TYR 122 8.551 12.936 -0.550 911 HE2 TYR 122 1HE TYR 122 11.940 14.196 -2.814 912 HH TYR 122 HH TYR 122 9.770 15.340 -2.608 913 H LYS 123 H LYS 123 12.675 7.021 -1.303 914 HA LYS 123 HA LYS 123 11.949 4.885 -1.657 915 HB2 LYS 123 2HB LYS 123 11.216 5.352 1.223 916 HB3 LYS 123 1HB LYS 123 10.990 3.793 0.450 917 HG2 LYS 123 2HG LYS 123 13.579 5.256 0.898 918 HG3 LYS 123 1HG LYS 123 13.049 3.732 1.631 919 HD2 LYS 123 2HD LYS 123 14.190 2.722 -0.002 920 HD3 LYS 123 1HD LYS 123 12.877 3.226 -1.075 921 HE2 LYS 123 2HE LYS 123 14.142 4.781 -2.089 922 HE3 LYS 123 1HE LYS 123 14.909 5.282 -0.581 923 HZ1 LYS 123 3HZ LYS 123 15.628 2.944 -2.260 924 HZ2 LYS 123 1HZ LYS 123 16.276 3.236 -0.725 925 HZ3 LYS 123 2HZ LYS 123 16.561 4.328 -1.984 926 H TYR 124 H TYR 124 9.316 5.371 0.590 927 HA TYR 124 HA TYR 124 7.344 4.237 -0.897 928 HB2 TYR 124 2HB TYR 124 7.125 6.443 1.148 929 HB3 TYR 124 1HB TYR 124 5.738 5.540 0.519 930 HD1 TYR 124 2HD TYR 124 6.598 2.808 0.447 931 HD2 TYR 124 1HD TYR 124 7.507 5.796 3.334 932 HE1 TYR 124 2HE TYR 124 6.959 1.058 2.134 933 HE2 TYR 124 1HE TYR 124 7.873 4.055 5.029 934 HH TYR 124 HH TYR 124 7.991 0.686 4.214 935 H PHE 125 H PHE 125 8.739 7.315 -1.537 936 HA PHE 125 HA PHE 125 6.505 8.522 -2.806 937 HB2 PHE 125 2HB PHE 125 8.434 9.845 -2.073 938 HB3 PHE 125 1HB PHE 125 9.469 8.994 -3.229 939 HD1 PHE 125 1HD PHE 125 6.226 10.856 -3.260 940 HD2 PHE 125 2HD PHE 125 9.973 10.132 -5.144 941 HE1 PHE 125 1HE PHE 125 5.683 12.534 -4.976 942 HE2 PHE 125 2HE PHE 125 9.437 11.809 -6.863 943 HZ PHE 125 HZ PHE 125 7.289 13.011 -6.780 944 H TYR 126 H TYR 126 5.510 7.729 -4.543 945 HA TYR 126 HA TYR 126 7.012 6.079 -6.430 946 HB2 TYR 126 2HB TYR 126 4.206 6.261 -5.578 947 HB3 TYR 126 1HB TYR 126 4.404 6.078 -7.324 948 HD1 TYR 126 1HD TYR 126 7.170 4.397 -6.406 949 HD2 TYR 126 2HD TYR 126 2.956 4.063 -5.917 950 HE1 TYR 126 1HE TYR 126 7.402 1.975 -6.102 951 HE2 TYR 126 2HE TYR 126 3.181 1.636 -5.610 952 HH TYR 126 HH TYR 126 6.129 -0.032 -6.241 953 H VAL 127 H VAL 127 7.019 6.430 -8.640 954 HA VAL 127 HA VAL 127 5.804 8.724 -9.840 955 HB VAL 127 HB VAL 127 8.075 9.622 -10.647 956 HG11 VAL 127 1HG1 VAL 127 8.078 11.262 -8.991 957 HG12 VAL 127 2HG1 VAL 127 7.579 10.130 -7.735 958 HG13 VAL 127 3HG1 VAL 127 6.426 10.647 -8.965 959 HG21 VAL 127 3HG2 VAL 127 9.910 9.359 -8.996 960 HG22 VAL 127 1HG2 VAL 127 9.508 7.869 -9.847 961 HG23 VAL 127 2HG2 VAL 127 8.956 8.115 -8.190 962 H SER 128 H SER 128 4.986 7.393 -11.366 963 HA SER 128 HA SER 128 5.086 6.558 -13.544 964 HB2 SER 128 2HB SER 128 7.049 6.147 -14.694 965 HB3 SER 128 1HB SER 128 7.614 7.320 -13.493 966 HG SER 128 HG SER 128 9.022 5.597 -13.483 967 H ALA 129 H ALA 129 4.449 4.567 -14.184 968 HA ALA 129 HA ALA 129 4.114 2.597 -12.155 969 HB1 ALA 129 1HB ALA 129 2.994 1.294 -13.916 970 HB2 ALA 129 2HB ALA 129 3.518 2.485 -15.107 971 HB3 ALA 129 3HB ALA 129 2.404 2.954 -13.825 972 H GLU 130 H GLU 130 6.593 3.163 -14.459 973 HA GLU 130 HA GLU 130 7.436 0.520 -14.933 974 HB2 GLU 130 2HB GLU 130 9.648 1.568 -15.488 975 HB3 GLU 130 1HB GLU 130 8.265 2.255 -16.349 976 HG2 GLU 130 2HG GLU 130 8.292 4.209 -15.051 977 HG3 GLU 130 1HG GLU 130 9.361 3.485 -13.837 978 H GLN 131 H GLN 131 8.274 2.827 -12.360 979 HA GLN 131 HA GLN 131 10.153 0.973 -11.228 980 HB2 GLN 131 2HB GLN 131 9.994 2.618 -9.257 981 HB3 GLN 131 1HB GLN 131 10.840 3.091 -10.723 982 HG2 GLN 131 2HG GLN 131 9.467 4.800 -11.067 983 HG3 GLN 131 1HG GLN 131 8.043 3.786 -10.851 984 HE21 GLN 131 1HE2 GLN 131 10.151 6.074 -9.418 985 HE22 GLN 131 2HE2 GLN 131 9.320 6.225 -7.912 986 H VAL 132 H VAL 132 6.941 2.213 -10.354 987 HA VAL 132 HA VAL 132 6.605 0.841 -7.975 988 HB VAL 132 HB VAL 132 4.346 1.282 -8.089 989 HG11 VAL 132 1HG1 VAL 132 4.403 3.476 -8.391 990 HG12 VAL 132 2HG1 VAL 132 4.663 3.307 -10.126 991 HG13 VAL 132 3HG1 VAL 132 6.034 3.260 -9.018 992 HG21 VAL 132 3HG2 VAL 132 4.517 0.974 -11.076 993 HG22 VAL 132 1HG2 VAL 132 3.073 1.522 -10.226 994 HG23 VAL 132 2HG2 VAL 132 3.713 -0.095 -9.927 995 H VAL 133 H VAL 133 6.575 -0.308 -11.242 996 HA VAL 133 HA VAL 133 5.314 -2.802 -10.612 997 HB VAL 133 HB VAL 133 5.221 -1.732 -12.886 998 HG11 VAL 133 1HG1 VAL 133 8.077 -2.077 -12.655 999 HG12 VAL 133 2HG1 VAL 133 7.147 -1.138 -13.819 1000 HG13 VAL 133 3HG1 VAL 133 7.448 -2.852 -14.106 1001 HG21 VAL 133 3HG2 VAL 133 4.579 -4.063 -12.458 1002 HG22 VAL 133 1HG2 VAL 133 6.240 -4.567 -12.766 1003 HG23 VAL 133 2HG2 VAL 133 5.279 -3.857 -14.063 1004 H GLN 134 H GLN 134 8.661 -1.617 -10.858 1005 HA GLN 134 HA GLN 134 9.717 -4.316 -10.730 1006 HB2 GLN 134 2HB GLN 134 11.882 -3.003 -10.077 1007 HB3 GLN 134 1HB GLN 134 11.276 -2.932 -11.725 1008 HG2 GLN 134 2HG GLN 134 10.216 -0.795 -11.236 1009 HG3 GLN 134 1HG GLN 134 10.838 -0.863 -9.591 1010 HE21 GLN 134 1HE2 GLN 134 13.367 -1.683 -9.878 1011 HE22 GLN 134 2HE2 GLN 134 14.286 -0.545 -10.826 1012 H GLY 135 H GLY 135 9.162 -1.676 -8.508 1013 HA2 GLY 135 2HA GLY 135 10.256 -2.930 -6.204 1014 HA3 GLY 135 1HA GLY 135 9.138 -1.559 -6.214 1015 H MET 136 H MET 136 7.180 -3.076 -7.862 1016 HA MET 136 HA MET 136 5.956 -4.508 -5.636 1017 HB2 MET 136 2HB MET 136 3.912 -4.372 -6.774 1018 HB3 MET 136 1HB MET 136 4.697 -2.841 -7.120 1019 HG2 MET 136 2HG MET 136 4.056 -3.307 -9.214 1020 HG3 MET 136 1HG MET 136 5.534 -4.263 -9.228 1021 HE1 MET 136 3HE MET 136 2.490 -3.921 -10.349 1022 HE2 MET 136 1HE MET 136 1.343 -5.010 -9.571 1023 HE3 MET 136 2HE MET 136 2.181 -5.515 -11.038 1024 H LYS 137 H LYS 137 7.660 -5.055 -8.539 1025 HA LYS 137 HA LYS 137 6.803 -7.729 -9.035 1026 HB2 LYS 137 2HB LYS 137 8.774 -5.840 -10.121 1027 HB3 LYS 137 1HB LYS 137 9.276 -7.514 -10.204 1028 HG2 LYS 137 2HG LYS 137 6.865 -6.238 -11.460 1029 HG3 LYS 137 1HG LYS 137 8.225 -7.030 -12.256 1030 HD2 LYS 137 2HD LYS 137 7.490 -9.156 -11.084 1031 HD3 LYS 137 1HD LYS 137 6.011 -8.290 -10.657 1032 HE2 LYS 137 2HE LYS 137 5.218 -8.318 -12.780 1033 HE3 LYS 137 1HE LYS 137 6.825 -8.195 -13.496 1034 HZ1 LYS 137 3HZ LYS 137 7.017 -10.610 -12.516 1035 HZ2 LYS 137 1HZ LYS 137 6.316 -10.329 -14.029 1036 HZ3 LYS 137 2HZ LYS 137 5.334 -10.573 -12.673 1037 H GLU 138 H GLU 138 8.821 -6.281 -6.738 1038 HA GLU 138 HA GLU 138 10.414 -8.691 -6.295 1039 HB2 GLU 138 2HB GLU 138 10.871 -5.905 -5.934 1040 HB3 GLU 138 1HB GLU 138 10.945 -6.670 -4.348 1041 HG2 GLU 138 2HG GLU 138 12.456 -7.772 -6.690 1042 HG3 GLU 138 1HG GLU 138 13.106 -6.466 -5.685 1043 H ALA 139 H ALA 139 8.756 -6.389 -4.164 1044 HA ALA 139 HA ALA 139 8.510 -8.045 -1.962 1045 HB1 ALA 139 1HB ALA 139 7.981 -5.921 -1.385 1046 HB2 ALA 139 2HB ALA 139 6.342 -6.527 -1.623 1047 HB3 ALA 139 3HB ALA 139 7.134 -5.602 -2.898 1048 H GLN 140 H GLN 140 6.704 -8.085 -4.914 1049 HA GLN 140 HA GLN 140 4.351 -9.301 -4.045 1050 HB2 GLN 140 2HB GLN 140 4.148 -10.076 -6.397 1051 HB3 GLN 140 1HB GLN 140 4.462 -8.352 -6.237 1052 HG2 GLN 140 2HG GLN 140 5.827 -9.050 -7.989 1053 HG3 GLN 140 1HG GLN 140 6.908 -8.954 -6.601 1054 HE21 GLN 140 1HE2 GLN 140 4.626 -11.398 -7.796 1055 HE22 GLN 140 2HE2 GLN 140 5.762 -12.698 -7.807 1056 H GLU 141 H GLU 141 7.514 -10.570 -4.176 1057 HA GLU 141 HA GLU 141 6.596 -13.329 -4.412 1058 HB2 GLU 141 2HB GLU 141 8.565 -12.784 -5.682 1059 HB3 GLU 141 1HB GLU 141 9.359 -12.115 -4.251 1060 HG2 GLU 141 2HG GLU 141 9.833 -14.181 -3.383 1061 HG3 GLU 141 1HG GLU 141 8.500 -14.968 -4.228 1062 H ARG 142 H ARG 142 8.317 -11.261 -2.089 1063 HA ARG 142 HA ARG 142 8.430 -13.318 -0.093 1064 HB2 ARG 142 2HB ARG 142 8.824 -10.362 0.357 1065 HB3 ARG 142 1HB ARG 142 9.494 -11.704 1.291 1066 HG2 ARG 142 2HG ARG 142 11.287 -11.804 -0.011 1067 HG3 ARG 142 1HG ARG 142 10.291 -11.893 -1.474 1068 HD2 ARG 142 2HD ARG 142 10.057 -9.444 -1.443 1069 HD3 ARG 142 1HD ARG 142 11.086 -9.376 -0.003 1070 HE ARG 142 HE ARG 142 11.932 -9.748 -2.729 1071 HH11 ARG 142 1HH1 ARG 142 12.765 -10.240 0.625 1072 HH12 ARG 142 2HH1 ARG 142 14.469 -10.308 0.322 1073 HH21 ARG 142 1HH2 ARG 142 14.172 -9.836 -3.129 1074 HH22 ARG 142 2HH2 ARG 142 15.268 -10.079 -1.810 1075 H LEU 143 H LEU 143 6.479 -10.415 -0.594 1076 HA LEU 143 HA LEU 143 5.035 -10.589 1.826 1077 HB2 LEU 143 2HB LEU 143 4.490 -9.189 -0.783 1078 HB3 LEU 143 1HB LEU 143 3.394 -9.084 0.592 1079 HG LEU 143 HG LEU 143 5.097 -7.188 0.242 1080 HD11 LEU 143 1HD1 LEU 143 3.744 -8.013 2.390 1081 HD12 LEU 143 2HD1 LEU 143 4.856 -6.644 2.423 1082 HD13 LEU 143 3HD1 LEU 143 5.386 -8.226 2.992 1083 HD21 LEU 143 3HD2 LEU 143 7.283 -7.549 1.267 1084 HD22 LEU 143 1HD2 LEU 143 7.057 -8.587 -0.138 1085 HD23 LEU 143 2HD2 LEU 143 6.902 -9.256 1.485 1086 H THR 144 H THR 144 4.848 -12.468 -0.999 1087 HA THR 144 HA THR 144 2.274 -13.064 -1.493 1088 HB THR 144 HB THR 144 3.043 -15.444 -1.832 1089 HG1 THR 144 1HG THR 144 4.911 -16.034 -1.101 1090 HG21 THR 144 3HG2 THR 144 5.039 -13.622 -3.069 1091 HG22 THR 144 1HG2 THR 144 3.334 -13.487 -3.493 1092 HG23 THR 144 2HG2 THR 144 4.193 -15.003 -3.767 1093 H GLY 145 H GLY 145 3.860 -15.472 0.546 1094 HA2 GLY 145 2HA GLY 145 1.711 -15.184 2.528 1095 HA3 GLY 145 1HA GLY 145 1.933 -16.738 1.744 1096 H ASP 146 H ASP 146 3.066 -14.567 4.157 1097 HA ASP 146 HA ASP 146 4.568 -14.757 5.850 1098 HB2 ASP 146 2HB ASP 146 4.400 -17.735 5.377 1099 HB3 ASP 146 1HB ASP 146 4.801 -16.909 6.880 1100 H ALA 147 H ALA 147 5.502 -14.828 2.944 1101 HA ALA 147 HA ALA 147 8.110 -16.117 3.309 1102 HB1 ALA 147 1HB ALA 147 8.379 -16.060 0.975 1103 HB2 ALA 147 2HB ALA 147 7.126 -14.836 0.774 1104 HB3 ALA 147 3HB ALA 147 6.685 -16.483 1.224 1105 H PHE 148 H PHE 148 7.130 -13.525 4.522 1106 HA PHE 148 HA PHE 148 9.175 -11.720 3.420 1107 HB2 PHE 148 2HB PHE 148 7.870 -9.900 4.516 1108 HB3 PHE 148 1HB PHE 148 6.955 -10.765 3.275 1109 HD1 PHE 148 1HD PHE 148 5.229 -12.418 3.962 1110 HD2 PHE 148 2HD PHE 148 7.162 -9.861 6.762 1111 HE1 PHE 148 1HE PHE 148 3.437 -12.855 5.592 1112 HE2 PHE 148 2HE PHE 148 5.374 -10.294 8.397 1113 HZ PHE 148 HZ PHE 148 3.511 -11.792 7.814 1114 H ARG 149 H ARG 149 7.811 -13.056 6.389 1115 HA ARG 149 HA ARG 149 9.480 -11.723 8.210 1116 HB2 ARG 149 2HB ARG 149 8.295 -14.478 8.544 1117 HB3 ARG 149 1HB ARG 149 8.749 -13.355 9.811 1118 HG2 ARG 149 2HG ARG 149 6.992 -11.803 8.983 1119 HG3 ARG 149 1HG ARG 149 6.480 -13.066 7.863 1120 HD2 ARG 149 2HD ARG 149 6.714 -14.134 10.520 1121 HD3 ARG 149 1HD ARG 149 5.684 -12.702 10.532 1122 HE ARG 149 HE ARG 149 4.733 -14.119 8.438 1123 HH11 ARG 149 1HH1 ARG 149 5.380 -14.945 11.767 1124 HH12 ARG 149 2HH1 ARG 149 4.129 -16.139 11.845 1125 HH21 ARG 149 1HH2 ARG 149 3.087 -15.688 8.538 1126 HH22 ARG 149 2HH2 ARG 149 2.827 -16.562 10.011 1127 H LYS 150 H LYS 150 10.709 -13.598 9.760 1128 HA LYS 150 HA LYS 150 13.133 -14.046 8.336 1129 HB2 LYS 150 2HB LYS 150 13.873 -15.156 10.441 1130 HB3 LYS 150 1HB LYS 150 13.234 -13.537 10.684 1131 HG2 LYS 150 2HG LYS 150 11.129 -15.473 10.926 1132 HG3 LYS 150 1HG LYS 150 12.476 -15.893 11.986 1133 HD2 LYS 150 2HD LYS 150 11.579 -13.057 11.919 1134 HD3 LYS 150 1HD LYS 150 10.557 -14.230 12.750 1135 HE2 LYS 150 2HE LYS 150 12.434 -14.901 14.147 1136 HE3 LYS 150 1HE LYS 150 13.490 -13.781 13.289 1137 HZ1 LYS 150 3HZ LYS 150 12.938 -12.443 14.993 1138 HZ2 LYS 150 1HZ LYS 150 11.491 -13.252 15.328 1139 HZ3 LYS 150 2HZ LYS 150 11.562 -12.131 14.064 1140 H LYS 151 H LYS 151 14.177 -16.387 8.881 1141 HA LYS 151 HA LYS 151 12.309 -18.349 7.721 1142 HB2 LYS 151 2HB LYS 151 14.668 -17.423 6.629 1143 HB3 LYS 151 1HB LYS 151 15.155 -18.934 7.383 1144 HG2 LYS 151 2HG LYS 151 13.249 -20.032 6.166 1145 HG3 LYS 151 1HG LYS 151 13.055 -18.522 5.273 1146 HD2 LYS 151 2HD LYS 151 15.656 -20.035 5.406 1147 HD3 LYS 151 1HD LYS 151 14.452 -20.296 4.143 1148 HE2 LYS 151 2HE LYS 151 15.025 -18.425 3.061 1149 HE3 LYS 151 1HE LYS 151 15.092 -17.482 4.548 1150 HZ1 LYS 151 3HZ LYS 151 17.261 -17.498 3.684 1151 HZ2 LYS 151 1HZ LYS 151 17.224 -19.160 3.362 1152 HZ3 LYS 151 2HZ LYS 151 17.290 -18.608 4.959 1153 H HIS 152 H HIS 152 13.431 -20.679 8.053 1154 HA HIS 152 HA HIS 152 13.821 -22.371 9.520 1155 HB2 HIS 152 2HB HIS 152 15.268 -20.196 11.044 1156 HB3 HIS 152 1HB HIS 152 15.359 -21.912 11.421 1157 HD1 HIS 152 1HD HIS 152 16.875 -19.328 9.341 1158 HD2 HIS 152 2HD HIS 152 16.618 -23.475 9.306 1159 HE1 HIS 152 1HE HIS 152 18.677 -20.101 7.767 1160 HE2 HIS 152 2HE HIS 152 18.447 -22.608 7.698 1161 H LEU 153 H LEU 153 12.115 -23.177 10.532 1162 HA LEU 153 HA LEU 153 11.332 -22.318 13.111 1163 HB2 LEU 153 2HB LEU 153 10.300 -20.524 11.713 1164 HB3 LEU 153 1HB LEU 153 9.335 -21.754 10.921 1165 HG LEU 153 HG LEU 153 8.579 -22.305 13.384 1166 HD11 LEU 153 1HD1 LEU 153 8.454 -20.323 14.784 1167 HD12 LEU 153 2HD1 LEU 153 9.357 -19.400 13.582 1168 HD13 LEU 153 3HD1 LEU 153 10.134 -20.733 14.436 1169 HD21 LEU 153 3HD2 LEU 153 7.416 -21.132 11.265 1170 HD22 LEU 153 1HD2 LEU 153 7.351 -19.802 12.421 1171 HD23 LEU 153 2HD2 LEU 153 6.612 -21.354 12.818 1172 H GLU 154 H GLU 154 9.876 -23.749 14.105 1173 HA GLU 154 HA GLU 154 9.893 -26.384 13.064 1174 HB2 GLU 154 2HB GLU 154 8.497 -26.933 15.033 1175 HB3 GLU 154 1HB GLU 154 9.930 -26.006 15.456 1176 HG2 GLU 154 2HG GLU 154 8.721 -24.111 15.961 1177 HG3 GLU 154 1HG GLU 154 7.346 -24.597 14.970 1178 H ASP 155 H ASP 155 8.323 -27.587 12.093 1179 HA ASP 155 HA ASP 155 6.157 -26.123 10.854 1180 HB2 ASP 155 2HB ASP 155 7.733 -28.157 9.978 1181 HB3 ASP 155 1HB ASP 155 6.298 -29.049 10.478 1182 H GLU 156 H GLU 156 3.992 -27.374 10.688 1183 HA GLU 156 HA GLU 156 3.188 -28.981 12.889 1184 HB2 GLU 156 2HB GLU 156 3.437 -26.499 13.753 1185 HB3 GLU 156 1HB GLU 156 1.866 -26.299 12.968 1186 HG2 GLU 156 2HG GLU 156 1.447 -26.789 15.239 1187 HG3 GLU 156 1HG GLU 156 1.055 -28.244 14.324 1188 H LEU 157 H LEU 157 1.502 -30.151 12.242 1189 HA LEU 157 HA LEU 157 -0.390 -28.995 10.322 1190 HB2 LEU 157 2HB LEU 157 1.535 -30.652 9.443 1191 HB3 LEU 157 1HB LEU 157 0.340 -31.840 9.926 1192 HG LEU 157 HG LEU 157 -1.242 -30.230 8.482 1193 HD11 LEU 157 1HD1 LEU 157 1.530 -29.615 7.667 1194 HD12 LEU 157 2HD1 LEU 157 0.073 -28.627 7.578 1195 HD13 LEU 157 3HD1 LEU 157 0.361 -29.882 6.373 1196 HD21 LEU 157 3HD2 LEU 157 -1.277 -31.910 6.919 1197 HD22 LEU 157 1HD2 LEU 157 -0.521 -32.742 8.279 1198 HD23 LEU 157 2HD2 LEU 157 0.472 -32.131 6.955 Start of MODEL 36 1 H1 MET 1 1HT MET 1 -7.854 -18.121 24.486 2 H2 MET 1 2HT MET 1 -6.313 -18.630 25.043 3 H3 MET 1 3HT MET 1 -6.471 -17.890 23.503 4 HA MET 1 HA MET 1 -7.184 -16.543 26.009 5 HB2 MET 1 2HB MET 1 -4.691 -17.430 25.513 6 HB3 MET 1 1HB MET 1 -4.643 -15.925 24.604 7 HG2 MET 1 2HG MET 1 -5.529 -14.836 26.749 8 HG3 MET 1 1HG MET 1 -5.044 -16.333 27.542 9 HE1 MET 1 2HE MET 1 -3.094 -13.265 25.262 10 HE2 MET 1 3HE MET 1 -2.760 -12.729 26.908 11 HE3 MET 1 1HE MET 1 -4.415 -13.088 26.417 12 H HIS 2 H HIS 2 -8.111 -14.627 25.639 13 HA HIS 2 HA HIS 2 -7.538 -13.047 23.321 14 HB2 HIS 2 2HB HIS 2 -9.681 -14.934 23.160 15 HB3 HIS 2 1HB HIS 2 -10.364 -13.312 23.167 16 HD1 HIS 2 1HD HIS 2 -9.069 -15.763 20.922 17 HD2 HIS 2 2HD HIS 2 -8.964 -11.615 21.110 18 HE1 HIS 2 1HE HIS 2 -8.507 -14.999 18.593 19 HE2 HIS 2 2HE HIS 2 -8.362 -12.489 18.752 20 H HIS 3 H HIS 3 -8.027 -10.929 23.646 21 HA HIS 3 HA HIS 3 -9.554 -10.280 26.083 22 HB2 HIS 3 2HB HIS 3 -7.052 -9.032 24.961 23 HB3 HIS 3 1HB HIS 3 -8.081 -8.180 26.110 24 HD1 HIS 3 1HD HIS 3 -7.846 -8.785 28.546 25 HD2 HIS 3 2HD HIS 3 -5.795 -11.383 26.034 26 HE1 HIS 3 1HE HIS 3 -6.454 -10.229 30.063 27 HE2 HIS 3 2HE HIS 3 -5.290 -11.851 28.527 28 H HIS 4 H HIS 4 -8.464 -8.901 22.982 29 HA HIS 4 HA HIS 4 -10.876 -7.232 22.935 30 HB2 HIS 4 2HB HIS 4 -8.142 -6.916 21.961 31 HB3 HIS 4 1HB HIS 4 -9.344 -6.519 20.737 32 HD1 HIS 4 1HD HIS 4 -11.125 -4.637 21.462 33 HD2 HIS 4 2HD HIS 4 -7.741 -4.984 23.847 34 HE1 HIS 4 1HE HIS 4 -11.018 -2.504 22.791 35 HE2 HIS 4 2HE HIS 4 -8.912 -2.699 24.161 36 H HIS 5 H HIS 5 -12.211 -7.150 21.081 37 HA HIS 5 HA HIS 5 -11.829 -8.928 18.876 38 HB2 HIS 5 2HB HIS 5 -13.004 -10.061 21.150 39 HB3 HIS 5 1HB HIS 5 -14.350 -9.729 20.064 40 HD1 HIS 5 1HD HIS 5 -11.942 -12.258 20.801 41 HD2 HIS 5 2HD HIS 5 -13.745 -10.849 17.332 42 HE1 HIS 5 1HE HIS 5 -11.640 -14.082 19.096 43 HE2 HIS 5 2HE HIS 5 -12.658 -13.169 16.980 44 H HIS 6 H HIS 6 -14.276 -7.164 20.759 45 HA HIS 6 HA HIS 6 -15.808 -6.504 18.418 46 HB2 HIS 6 2HB HIS 6 -17.139 -5.110 19.993 47 HB3 HIS 6 1HB HIS 6 -16.968 -6.780 20.523 48 HD1 HIS 6 1HD HIS 6 -15.287 -7.201 22.529 49 HD2 HIS 6 2HD HIS 6 -16.159 -3.216 21.731 50 HE1 HIS 6 1HE HIS 6 -14.532 -5.928 24.562 51 HE2 HIS 6 2HE HIS 6 -15.144 -3.530 24.090 52 H HIS 7 H HIS 7 -15.160 -5.032 17.001 53 HA HIS 7 HA HIS 7 -14.358 -2.407 17.885 54 HB2 HIS 7 2HB HIS 7 -12.311 -4.185 17.556 55 HB3 HIS 7 1HB HIS 7 -12.407 -3.468 15.950 56 HD1 HIS 7 1HD HIS 7 -12.667 -1.908 19.419 57 HD2 HIS 7 2HD HIS 7 -10.525 -1.537 15.877 58 HE1 HIS 7 1HE HIS 7 -11.144 0.063 19.759 59 HE2 HIS 7 2HE HIS 7 -9.919 0.322 17.573 60 H MET 8 H MET 8 -14.630 -0.831 16.316 61 HA MET 8 HA MET 8 -15.534 -1.736 13.670 62 HB2 MET 8 2HB MET 8 -17.012 -0.116 15.676 63 HB3 MET 8 1HB MET 8 -17.145 0.385 13.987 64 HG2 MET 8 2HG MET 8 -18.623 -1.208 13.593 65 HG3 MET 8 1HG MET 8 -17.495 -2.443 14.152 66 HE1 MET 8 3HE MET 8 -20.873 -0.468 16.540 67 HE2 MET 8 1HE MET 8 -20.487 -0.231 14.836 68 HE3 MET 8 2HE MET 8 -19.485 0.516 16.079 69 H SER 9 H SER 9 -15.594 0.066 12.067 70 HA SER 9 HA SER 9 -14.046 2.422 12.628 71 HB2 SER 9 2HB SER 9 -12.513 0.262 12.068 72 HB3 SER 9 1HB SER 9 -12.812 0.860 10.435 73 HG SER 9 HG SER 9 -11.355 1.989 12.507 74 H ASP 10 H ASP 10 -14.112 3.958 10.938 75 HA ASP 10 HA ASP 10 -16.156 3.367 8.903 76 HB2 ASP 10 2HB ASP 10 -16.487 5.846 8.830 77 HB3 ASP 10 1HB ASP 10 -16.871 5.124 10.390 78 H GLY 11 H GLY 11 -15.918 4.500 6.819 79 HA2 GLY 11 2HA GLY 11 -13.094 5.002 6.127 80 HA3 GLY 11 1HA GLY 11 -14.085 3.937 5.142 81 H HIS 12 H HIS 12 -13.711 5.278 3.325 82 HA HIS 12 HA HIS 12 -15.596 7.478 3.156 83 HB2 HIS 12 2HB HIS 12 -12.628 7.817 2.989 84 HB3 HIS 12 1HB HIS 12 -13.659 8.803 1.943 85 HD1 HIS 12 1HD HIS 12 -12.912 8.169 5.584 86 HD2 HIS 12 2HD HIS 12 -14.943 10.897 3.198 87 HE1 HIS 12 1HE HIS 12 -13.540 10.063 7.115 88 HE2 HIS 12 2HE HIS 12 -14.840 11.663 5.666 89 H ASN 13 H ASN 13 -15.816 8.271 0.889 90 HA ASN 13 HA ASN 13 -15.803 6.001 -0.909 91 HB2 ASN 13 2HB ASN 13 -16.847 8.819 -1.263 92 HB3 ASN 13 1HB ASN 13 -17.060 7.513 -2.428 93 HD21 ASN 13 1HD2 ASN 13 -18.085 8.877 0.558 94 HD22 ASN 13 2HD2 ASN 13 -19.406 7.802 0.846 95 H GLY 14 H GLY 14 -15.274 6.578 -3.306 96 HA2 GLY 14 2HA GLY 14 -13.782 7.389 -4.892 97 HA3 GLY 14 1HA GLY 14 -13.068 8.420 -3.648 98 H LEU 15 H LEU 15 -11.058 7.928 -3.102 99 HA LEU 15 HA LEU 15 -9.123 6.781 -2.761 100 HB2 LEU 15 2HB LEU 15 -11.235 4.799 -2.163 101 HB3 LEU 15 1HB LEU 15 -9.639 4.144 -2.474 102 HG LEU 15 HG LEU 15 -8.819 5.833 -0.704 103 HD11 LEU 15 1HD1 LEU 15 -10.763 7.204 -0.504 104 HD12 LEU 15 2HD1 LEU 15 -10.561 6.325 1.011 105 HD13 LEU 15 3HD1 LEU 15 -11.779 5.806 -0.155 106 HD21 LEU 15 3HD2 LEU 15 -9.380 3.220 -0.599 107 HD22 LEU 15 1HD2 LEU 15 -10.532 3.806 0.602 108 HD23 LEU 15 2HD2 LEU 15 -8.811 4.135 0.797 109 H GLY 16 H GLY 16 -7.669 6.435 -4.310 110 HA2 GLY 16 2HA GLY 16 -6.785 5.896 -6.365 111 HA3 GLY 16 1HA GLY 16 -7.444 4.322 -5.971 112 H LYS 17 H LYS 17 -8.860 7.442 -6.923 113 HA LYS 17 HA LYS 17 -10.119 6.095 -9.216 114 HB2 LYS 17 2HB LYS 17 -11.590 6.730 -7.095 115 HB3 LYS 17 1HB LYS 17 -11.570 8.317 -7.852 116 HG2 LYS 17 2HG LYS 17 -13.453 7.466 -8.796 117 HG3 LYS 17 1HG LYS 17 -12.263 6.925 -9.983 118 HD2 LYS 17 2HD LYS 17 -12.838 4.811 -9.615 119 HD3 LYS 17 1HD LYS 17 -12.407 4.978 -7.912 120 HE2 LYS 17 2HE LYS 17 -14.592 5.591 -7.307 121 HE3 LYS 17 1HE LYS 17 -15.050 5.924 -8.976 122 HZ1 LYS 17 3HZ LYS 17 -15.982 3.893 -8.764 123 HZ2 LYS 17 1HZ LYS 17 -14.908 3.382 -7.560 124 HZ3 LYS 17 2HZ LYS 17 -14.431 3.367 -9.183 125 H GLY 18 H GLY 18 -10.207 7.260 -11.106 126 HA2 GLY 18 2HA GLY 18 -10.166 9.359 -12.309 127 HA3 GLY 18 1HA GLY 18 -9.139 10.011 -11.028 128 H PHE 19 H PHE 19 -7.270 7.988 -10.785 129 HA PHE 19 HA PHE 19 -5.873 8.218 -13.360 130 HB2 PHE 19 2HB PHE 19 -3.852 7.555 -11.837 131 HB3 PHE 19 1HB PHE 19 -4.472 9.210 -11.795 132 HD1 PHE 19 2HD PHE 19 -4.987 5.929 -10.089 133 HD2 PHE 19 1HD PHE 19 -4.852 10.168 -9.749 134 HE1 PHE 19 2HE PHE 19 -5.310 5.741 -7.659 135 HE2 PHE 19 1HE PHE 19 -5.175 9.987 -7.317 136 HZ PHE 19 HZ PHE 19 -5.407 7.771 -6.269 137 H GLY 20 H GLY 20 -7.112 5.973 -11.022 138 HA2 GLY 20 2HA GLY 20 -6.191 3.762 -12.751 139 HA3 GLY 20 1HA GLY 20 -6.140 3.639 -10.992 140 H ASP 21 H ASP 21 -7.851 2.801 -9.982 141 HA ASP 21 HA ASP 21 -10.516 3.195 -10.413 142 HB2 ASP 21 2HB ASP 21 -9.388 1.385 -12.421 143 HB3 ASP 21 1HB ASP 21 -10.745 0.672 -11.535 144 H HIS 22 H HIS 22 -9.297 -0.114 -10.421 145 HA HIS 22 HA HIS 22 -9.661 -0.266 -7.509 146 HB2 HIS 22 2HB HIS 22 -10.688 -2.545 -7.861 147 HB3 HIS 22 1HB HIS 22 -11.692 -1.196 -8.383 148 HD1 HIS 22 1HD HIS 22 -11.930 -0.845 -10.979 149 HD2 HIS 22 2HD HIS 22 -9.957 -4.322 -9.847 150 HE1 HIS 22 1HE HIS 22 -11.879 -2.289 -13.037 151 HE2 HIS 22 2HE HIS 22 -10.759 -4.423 -12.302 152 H ILE 23 H ILE 23 -7.388 -0.188 -7.369 153 HA ILE 23 HA ILE 23 -6.078 -2.737 -7.935 154 HB ILE 23 HB ILE 23 -5.076 -0.043 -8.844 155 HG12 ILE 23 2HG1 ILE 23 -4.894 -1.785 -10.959 156 HG13 ILE 23 1HG1 ILE 23 -6.380 -2.302 -10.166 157 HG21 ILE 23 1HG2 ILE 23 -3.026 -0.977 -9.424 158 HG22 ILE 23 2HG2 ILE 23 -3.597 -2.624 -9.160 159 HG23 ILE 23 3HG2 ILE 23 -3.341 -1.547 -7.787 160 HD11 ILE 23 3HD1 ILE 23 -5.976 -0.101 -11.884 161 HD12 ILE 23 1HD1 ILE 23 -6.369 0.535 -10.286 162 HD13 ILE 23 2HD1 ILE 23 -7.461 -0.605 -11.077 163 H HIS 24 H HIS 24 -4.498 0.304 -7.150 164 HA HIS 24 HA HIS 24 -3.339 -0.835 -4.795 165 HB2 HIS 24 2HB HIS 24 -2.920 1.579 -6.448 166 HB3 HIS 24 1HB HIS 24 -2.470 1.713 -4.745 167 HD1 HIS 24 1HD HIS 24 -1.715 -0.450 -7.774 168 HD2 HIS 24 2HD HIS 24 -0.011 0.711 -4.167 169 HE1 HIS 24 1HE HIS 24 0.627 -1.365 -7.812 170 HE2 HIS 24 2HE HIS 24 1.668 -0.569 -5.660 171 H TRP 25 H TRP 25 -6.180 -0.428 -4.777 172 HA TRP 25 HA TRP 25 -6.437 0.954 -2.273 173 HB2 TRP 25 2HB TRP 25 -8.441 2.226 -3.605 174 HB3 TRP 25 1HB TRP 25 -6.843 2.914 -3.292 175 HD1 TRP 25 HD TRP 25 -8.916 1.348 -6.079 176 HE1 TRP 25 1HE TRP 25 -7.759 1.817 -8.311 177 HE3 TRP 25 3HE TRP 25 -4.573 3.439 -4.403 178 HZ2 TRP 25 2HZ TRP 25 -5.390 2.945 -9.276 179 HZ3 TRP 25 3HZ TRP 25 -2.923 4.186 -6.043 180 HH2 TRP 25 HH TRP 25 -3.312 3.947 -8.437 181 H ARG 26 H ARG 26 -6.932 -1.665 -3.722 182 HA ARG 26 HA ARG 26 -9.560 -2.261 -4.119 183 HB2 ARG 26 2HB ARG 26 -7.493 -3.786 -4.287 184 HB3 ARG 26 1HB ARG 26 -7.750 -4.119 -2.571 185 HG2 ARG 26 2HG ARG 26 -8.765 -5.875 -3.779 186 HG3 ARG 26 1HG ARG 26 -10.071 -4.859 -3.169 187 HD2 ARG 26 2HD ARG 26 -9.915 -3.676 -5.459 188 HD3 ARG 26 1HD ARG 26 -9.022 -5.119 -5.967 189 HE ARG 26 HE ARG 26 -11.541 -5.689 -4.696 190 HH11 ARG 26 1HH1 ARG 26 -9.958 -4.945 -7.715 191 HH12 ARG 26 2HH1 ARG 26 -11.198 -5.663 -8.686 192 HH21 ARG 26 1HH2 ARG 26 -13.174 -6.634 -5.972 193 HH22 ARG 26 2HH2 ARG 26 -13.025 -6.622 -7.696 194 H THR 27 H THR 27 -7.909 -1.640 -1.118 195 HA THR 27 HA THR 27 -8.738 -1.078 0.937 196 HB THR 27 HB THR 27 -11.505 -1.884 0.071 197 HG1 THR 27 1HG THR 27 -11.751 0.002 -0.942 198 HG21 THR 27 3HG2 THR 27 -11.737 0.406 1.494 199 HG22 THR 27 1HG2 THR 27 -10.365 -0.363 2.292 200 HG23 THR 27 2HG2 THR 27 -11.901 -1.219 2.162 201 H LEU 28 H LEU 28 -9.639 -2.128 2.877 202 HA LEU 28 HA LEU 28 -8.790 -4.822 3.033 203 HB2 LEU 28 2HB LEU 28 -10.108 -2.895 4.895 204 HB3 LEU 28 1HB LEU 28 -10.090 -4.606 5.324 205 HG LEU 28 HG LEU 28 -7.451 -4.025 4.595 206 HD11 LEU 28 1HD1 LEU 28 -8.014 -2.021 6.673 207 HD12 LEU 28 2HD1 LEU 28 -8.523 -1.589 5.040 208 HD13 LEU 28 3HD1 LEU 28 -6.838 -2.001 5.358 209 HD21 LEU 28 3HD2 LEU 28 -8.432 -5.495 6.425 210 HD22 LEU 28 1HD2 LEU 28 -8.496 -4.034 7.412 211 HD23 LEU 28 2HD2 LEU 28 -6.947 -4.625 6.810 212 H GLU 29 H GLU 29 -11.876 -3.326 2.448 213 HA GLU 29 HA GLU 29 -13.654 -5.308 3.178 214 HB2 GLU 29 2HB GLU 29 -13.759 -2.946 1.684 215 HB3 GLU 29 1HB GLU 29 -14.366 -4.187 0.599 216 HG2 GLU 29 2HG GLU 29 -15.396 -3.669 3.380 217 HG3 GLU 29 1HG GLU 29 -16.140 -3.082 1.893 218 H ASP 30 H ASP 30 -12.584 -4.868 -0.191 219 HA ASP 30 HA ASP 30 -13.103 -7.671 -0.730 220 HB2 ASP 30 2HB ASP 30 -13.569 -5.571 -2.264 221 HB3 ASP 30 1HB ASP 30 -11.889 -5.829 -2.751 222 H GLY 31 H GLY 31 -10.397 -5.528 -0.254 223 HA2 GLY 31 2HA GLY 31 -8.385 -7.195 -1.366 224 HA3 GLY 31 1HA GLY 31 -8.128 -5.876 -0.221 225 H LYS 32 H LYS 32 -9.486 -6.737 1.993 226 HA LYS 32 HA LYS 32 -7.684 -8.725 3.001 227 HB2 LYS 32 2HB LYS 32 -8.791 -6.665 4.205 228 HB3 LYS 32 1HB LYS 32 -10.084 -7.812 4.533 229 HG2 LYS 32 2HG LYS 32 -7.284 -8.596 5.163 230 HG3 LYS 32 1HG LYS 32 -8.116 -7.459 6.227 231 HD2 LYS 32 2HD LYS 32 -9.922 -9.566 5.675 232 HD3 LYS 32 1HD LYS 32 -8.371 -10.303 6.079 233 HE2 LYS 32 2HE LYS 32 -8.498 -9.676 8.231 234 HE3 LYS 32 1HE LYS 32 -9.131 -8.081 7.827 235 HZ1 LYS 32 3HZ LYS 32 -10.564 -9.967 9.027 236 HZ2 LYS 32 1HZ LYS 32 -10.948 -10.309 7.415 237 HZ3 LYS 32 2HZ LYS 32 -11.247 -8.769 8.048 238 H LYS 33 H LYS 33 -11.085 -8.622 2.092 239 HA LYS 33 HA LYS 33 -11.949 -11.027 3.184 240 HB2 LYS 33 2HB LYS 33 -13.474 -9.419 2.161 241 HB3 LYS 33 1HB LYS 33 -12.777 -9.733 0.579 242 HG2 LYS 33 2HG LYS 33 -13.500 -12.223 1.205 243 HG3 LYS 33 1HG LYS 33 -14.691 -11.331 2.170 244 HD2 LYS 33 2HD LYS 33 -15.790 -10.580 0.345 245 HD3 LYS 33 1HD LYS 33 -14.310 -10.376 -0.593 246 HE2 LYS 33 2HE LYS 33 -14.430 -13.082 -0.365 247 HE3 LYS 33 1HE LYS 33 -16.142 -12.665 -0.422 248 HZ1 LYS 33 3HZ LYS 33 -14.107 -12.440 -2.487 249 HZ2 LYS 33 1HZ LYS 33 -15.227 -11.173 -2.411 250 HZ3 LYS 33 2HZ LYS 33 -15.762 -12.764 -2.627 251 H GLU 34 H GLU 34 -10.125 -10.409 0.244 252 HA GLU 34 HA GLU 34 -10.151 -13.263 -0.406 253 HB2 GLU 34 2HB GLU 34 -10.589 -11.474 -2.159 254 HB3 GLU 34 1HB GLU 34 -8.882 -11.054 -2.019 255 HG2 GLU 34 2HG GLU 34 -8.275 -12.735 -3.325 256 HG3 GLU 34 1HG GLU 34 -9.229 -13.894 -2.383 257 H ALA 35 H ALA 35 -7.946 -10.642 0.436 258 HA ALA 35 HA ALA 35 -5.508 -11.915 0.074 259 HB1 ALA 35 1HB ALA 35 -5.410 -9.635 0.574 260 HB2 ALA 35 2HB ALA 35 -4.748 -10.414 2.012 261 HB3 ALA 35 3HB ALA 35 -6.406 -9.814 2.017 262 H ALA 36 H ALA 36 -7.850 -12.220 2.647 263 HA ALA 36 HA ALA 36 -6.217 -13.612 4.492 264 HB1 ALA 36 1HB ALA 36 -8.102 -12.718 5.468 265 HB2 ALA 36 2HB ALA 36 -8.565 -14.413 5.306 266 HB3 ALA 36 3HB ALA 36 -9.157 -13.222 4.146 267 H ALA 37 H ALA 37 -8.222 -14.628 1.788 268 HA ALA 37 HA ALA 37 -8.280 -17.386 2.328 269 HB1 ALA 37 1HB ALA 37 -8.407 -17.350 -0.360 270 HB2 ALA 37 2HB ALA 37 -8.795 -15.666 -0.012 271 HB3 ALA 37 3HB ALA 37 -9.771 -16.957 0.686 272 H SER 38 H SER 38 -6.488 -16.065 -0.433 273 HA SER 38 HA SER 38 -4.637 -18.181 -0.505 274 HB2 SER 38 2HB SER 38 -4.918 -15.540 -1.842 275 HB3 SER 38 1HB SER 38 -3.304 -16.272 -1.853 276 HG SER 38 HG SER 38 -5.636 -17.679 -2.632 277 H GLY 39 H GLY 39 -4.650 -15.118 1.167 278 HA2 GLY 39 2HA GLY 39 -3.397 -14.608 3.075 279 HA3 GLY 39 1HA GLY 39 -2.341 -15.978 2.718 280 H LEU 40 H LEU 40 -3.174 -13.476 0.389 281 HA LEU 40 HA LEU 40 -0.367 -12.915 0.010 282 HB2 LEU 40 2HB LEU 40 -1.148 -11.383 -1.779 283 HB3 LEU 40 1HB LEU 40 -1.712 -13.031 -1.968 284 HG LEU 40 HG LEU 40 -3.897 -12.258 -0.923 285 HD11 LEU 40 1HD1 LEU 40 -3.578 -10.243 0.087 286 HD12 LEU 40 2HD1 LEU 40 -4.165 -9.697 -1.482 287 HD13 LEU 40 3HD1 LEU 40 -2.437 -9.686 -1.133 288 HD21 LEU 40 3HD2 LEU 40 -3.980 -10.703 -3.293 289 HD22 LEU 40 1HD2 LEU 40 -4.566 -12.346 -3.031 290 HD23 LEU 40 2HD2 LEU 40 -2.910 -12.078 -3.572 291 HA PRO 41 HA PRO 41 -0.099 -9.356 2.583 292 HB2 PRO 41 2HB PRO 41 1.760 -7.874 1.306 293 HB3 PRO 41 1HB PRO 41 2.156 -9.386 2.131 294 HG2 PRO 41 2HG PRO 41 1.690 -8.888 -0.785 295 HG3 PRO 41 1HG PRO 41 2.954 -9.858 -0.005 296 HD2 PRO 41 2HD PRO 41 0.723 -10.952 -1.101 297 HD3 PRO 41 1HD PRO 41 1.554 -11.662 0.297 298 H LEU 42 H LEU 42 -0.232 -6.944 2.596 299 HA LEU 42 HA LEU 42 -1.975 -5.994 0.424 300 HB2 LEU 42 2HB LEU 42 -2.275 -5.919 3.348 301 HB3 LEU 42 1HB LEU 42 -2.614 -4.397 2.546 302 HG LEU 42 HG LEU 42 -4.233 -5.628 1.069 303 HD11 LEU 42 1HD1 LEU 42 -4.426 -7.815 3.026 304 HD12 LEU 42 2HD1 LEU 42 -3.038 -7.877 1.941 305 HD13 LEU 42 3HD1 LEU 42 -4.671 -7.824 1.280 306 HD21 LEU 42 3HD2 LEU 42 -5.202 -6.093 3.813 307 HD22 LEU 42 1HD2 LEU 42 -5.912 -5.158 2.498 308 HD23 LEU 42 2HD2 LEU 42 -4.607 -4.471 3.465 309 H MET 43 H MET 43 -1.139 -4.365 -0.717 310 HA MET 43 HA MET 43 1.093 -2.855 0.415 311 HB2 MET 43 2HB MET 43 1.525 -3.751 -1.773 312 HB3 MET 43 1HB MET 43 0.018 -3.081 -2.402 313 HG2 MET 43 2HG MET 43 0.856 -0.894 -2.386 314 HG3 MET 43 1HG MET 43 2.192 -1.323 -1.320 315 HE1 MET 43 3HE MET 43 1.443 -3.858 -4.262 316 HE2 MET 43 1HE MET 43 1.972 -2.895 -5.641 317 HE3 MET 43 2HE MET 43 0.587 -2.376 -4.681 318 H VAL 44 H VAL 44 1.126 -0.438 -0.065 319 HA VAL 44 HA VAL 44 -1.581 0.688 -0.024 320 HB VAL 44 HB VAL 44 0.216 0.621 2.200 321 HG11 VAL 44 1HG1 VAL 44 -0.544 3.418 1.377 322 HG12 VAL 44 2HG1 VAL 44 1.085 2.760 1.298 323 HG13 VAL 44 3HG1 VAL 44 0.289 2.943 2.854 324 HG21 VAL 44 3HG2 VAL 44 -2.530 1.673 1.672 325 HG22 VAL 44 1HG2 VAL 44 -1.769 1.797 3.256 326 HG23 VAL 44 2HG2 VAL 44 -2.045 0.215 2.535 327 H ILE 45 H ILE 45 -1.623 3.045 -0.354 328 HA ILE 45 HA ILE 45 0.682 4.212 -1.645 329 HB ILE 45 HB ILE 45 -0.435 3.074 -3.505 330 HG12 ILE 45 2HG1 ILE 45 -0.848 6.061 -3.626 331 HG13 ILE 45 1HG1 ILE 45 0.708 5.253 -3.849 332 HG21 ILE 45 1HG2 ILE 45 -2.821 4.823 -3.053 333 HG22 ILE 45 2HG2 ILE 45 -2.715 3.167 -2.453 334 HG23 ILE 45 3HG2 ILE 45 -2.639 3.486 -4.183 335 HD11 ILE 45 3HD1 ILE 45 -1.500 5.622 -5.711 336 HD12 ILE 45 1HD1 ILE 45 -0.888 3.969 -5.660 337 HD13 ILE 45 2HD1 ILE 45 0.207 5.304 -6.016 338 H ILE 46 H ILE 46 0.629 5.702 0.072 339 HA ILE 46 HA ILE 46 -1.757 7.376 0.263 340 HB ILE 46 HB ILE 46 0.535 7.831 2.089 341 HG12 ILE 46 2HG1 ILE 46 -1.234 5.746 3.106 342 HG13 ILE 46 1HG1 ILE 46 -0.300 5.210 1.715 343 HG21 ILE 46 1HG2 ILE 46 -1.608 9.095 2.150 344 HG22 ILE 46 2HG2 ILE 46 -1.175 8.309 3.670 345 HG23 ILE 46 3HG2 ILE 46 -2.405 7.601 2.629 346 HD11 ILE 46 3HD1 ILE 46 1.116 6.662 3.869 347 HD12 ILE 46 1HD1 ILE 46 1.677 5.351 2.830 348 HD13 ILE 46 2HD1 ILE 46 0.600 5.004 4.184 349 H HIS 47 H HIS 47 -1.747 9.475 -0.345 350 HA HIS 47 HA HIS 47 0.785 10.799 -0.820 351 HB2 HIS 47 2HB HIS 47 -0.537 11.490 -3.155 352 HB3 HIS 47 1HB HIS 47 0.870 10.437 -3.015 353 HD1 HIS 47 1HD HIS 47 -0.193 9.511 -5.304 354 HD2 HIS 47 2HD HIS 47 -2.282 8.580 -1.835 355 HE1 HIS 47 1HE HIS 47 -1.727 7.623 -5.924 356 HE2 HIS 47 2HE HIS 47 -2.903 7.015 -3.785 357 H LYS 48 H LYS 48 0.535 12.542 0.354 358 HA LYS 48 HA LYS 48 -2.034 13.991 0.124 359 HB2 LYS 48 2HB LYS 48 -0.630 13.231 2.417 360 HB3 LYS 48 1HB LYS 48 -0.340 14.958 2.266 361 HG2 LYS 48 2HG LYS 48 -2.434 15.485 2.823 362 HG3 LYS 48 1HG LYS 48 -3.125 14.197 1.838 363 HD2 LYS 48 2HD LYS 48 -3.611 13.882 4.220 364 HD3 LYS 48 1HD LYS 48 -2.621 12.572 3.579 365 HE2 LYS 48 2HE LYS 48 -1.268 12.943 5.315 366 HE3 LYS 48 1HE LYS 48 -0.752 14.394 4.455 367 HZ1 LYS 48 3HZ LYS 48 -1.823 14.360 6.928 368 HZ2 LYS 48 1HZ LYS 48 -3.172 14.738 5.979 369 HZ3 LYS 48 2HZ LYS 48 -1.790 15.710 5.910 370 H SER 49 H SER 49 -1.675 16.465 0.623 371 HA SER 49 HA SER 49 -0.912 18.463 -0.161 372 HB2 SER 49 2HB SER 49 1.769 17.131 -0.583 373 HB3 SER 49 1HB SER 49 1.444 18.833 -0.260 374 HG SER 49 HG SER 49 1.398 18.415 1.796 375 H TRP 50 H TRP 50 1.032 18.981 -2.210 376 HA TRP 50 HA TRP 50 -0.461 18.888 -4.505 377 HB2 TRP 50 2HB TRP 50 1.796 19.001 -5.727 378 HB3 TRP 50 1HB TRP 50 1.455 20.266 -4.540 379 HD1 TRP 50 HD TRP 50 2.880 20.228 -2.265 380 HE1 TRP 50 1HE TRP 50 5.131 19.132 -1.676 381 HE3 TRP 50 3HE TRP 50 3.238 16.953 -6.176 382 HZ2 TRP 50 2HZ TRP 50 6.837 17.144 -2.729 383 HZ3 TRP 50 3HZ TRP 50 5.212 15.491 -6.312 384 HH2 TRP 50 HH TRP 50 6.973 15.586 -4.623 385 H CYS 51 H CYS 51 1.911 16.521 -3.399 386 HA CYS 51 HA CYS 51 2.362 14.383 -3.968 387 HB2 CYS 51 2HB CYS 51 0.568 12.947 -3.920 388 HB3 CYS 51 1HB CYS 51 -0.165 14.397 -3.250 389 H GLY 52 H GLY 52 3.339 13.383 -5.605 390 HA2 GLY 52 2HA GLY 52 2.670 14.278 -8.341 391 HA3 GLY 52 1HA GLY 52 4.257 13.690 -7.834 392 H ALA 53 H ALA 53 2.984 11.538 -6.231 393 HA ALA 53 HA ALA 53 3.059 9.485 -8.141 394 HB1 ALA 53 1HB ALA 53 2.732 9.701 -5.290 395 HB2 ALA 53 2HB ALA 53 3.379 8.367 -6.243 396 HB3 ALA 53 3HB ALA 53 1.643 8.484 -5.956 397 H CYS 54 H CYS 54 0.590 11.648 -7.304 398 HA CYS 54 HA CYS 54 -1.489 9.874 -8.262 399 HB2 CYS 54 2HB CYS 54 -2.121 12.730 -7.735 400 HB3 CYS 54 1HB CYS 54 -3.017 11.276 -7.280 401 H LYS 55 H LYS 55 0.292 12.739 -9.192 402 HA LYS 55 HA LYS 55 -1.212 13.393 -11.482 403 HB2 LYS 55 2HB LYS 55 1.363 14.182 -10.314 404 HB3 LYS 55 1HB LYS 55 1.310 14.290 -12.069 405 HG2 LYS 55 2HG LYS 55 -0.389 15.877 -12.052 406 HG3 LYS 55 1HG LYS 55 -0.870 15.476 -10.394 407 HD2 LYS 55 2HD LYS 55 0.330 17.275 -9.804 408 HD3 LYS 55 1HD LYS 55 1.743 16.255 -10.083 409 HE2 LYS 55 2HE LYS 55 2.405 17.652 -11.677 410 HE3 LYS 55 1HE LYS 55 0.952 17.263 -12.596 411 HZ1 LYS 55 3HZ LYS 55 1.554 19.599 -10.980 412 HZ2 LYS 55 1HZ LYS 55 -0.029 19.014 -10.859 413 HZ3 LYS 55 2HZ LYS 55 0.596 19.460 -12.367 414 H ALA 56 H ALA 56 1.990 11.739 -11.285 415 HA ALA 56 HA ALA 56 2.036 11.019 -14.001 416 HB1 ALA 56 1HB ALA 56 3.372 9.088 -12.310 417 HB2 ALA 56 2HB ALA 56 3.714 10.740 -11.800 418 HB3 ALA 56 3HB ALA 56 4.051 10.242 -13.457 419 H LEU 57 H LEU 57 0.538 9.549 -11.222 420 HA LEU 57 HA LEU 57 0.045 6.974 -12.112 421 HB2 LEU 57 2HB LEU 57 -0.898 8.721 -10.041 422 HB3 LEU 57 1HB LEU 57 -2.246 7.820 -10.700 423 HG LEU 57 HG LEU 57 -1.289 5.742 -10.100 424 HD11 LEU 57 1HD1 LEU 57 1.051 6.033 -8.793 425 HD12 LEU 57 2HD1 LEU 57 1.219 7.280 -10.028 426 HD13 LEU 57 3HD1 LEU 57 0.922 5.607 -10.500 427 HD21 LEU 57 3HD2 LEU 57 -1.822 5.962 -7.954 428 HD22 LEU 57 1HD2 LEU 57 -1.888 7.704 -8.226 429 HD23 LEU 57 2HD2 LEU 57 -0.403 6.960 -7.634 430 H LYS 58 H LYS 58 -1.754 9.936 -12.800 431 HA LYS 58 HA LYS 58 -4.072 8.921 -13.830 432 HB2 LYS 58 2HB LYS 58 -2.477 11.358 -14.424 433 HB3 LYS 58 1HB LYS 58 -3.827 10.975 -15.484 434 HG2 LYS 58 2HG LYS 58 -5.158 10.746 -13.263 435 HG3 LYS 58 1HG LYS 58 -3.835 11.700 -12.590 436 HD2 LYS 58 2HD LYS 58 -5.646 12.471 -14.876 437 HD3 LYS 58 1HD LYS 58 -5.621 13.175 -13.259 438 HE2 LYS 58 2HE LYS 58 -3.075 13.589 -13.910 439 HE3 LYS 58 1HE LYS 58 -3.757 13.561 -15.536 440 HZ1 LYS 58 3HZ LYS 58 -3.788 15.793 -14.794 441 HZ2 LYS 58 1HZ LYS 58 -4.483 15.378 -13.307 442 HZ3 LYS 58 2HZ LYS 58 -5.389 15.251 -14.730 443 HA PRO 59 HA PRO 59 -2.482 8.362 -18.286 444 HB2 PRO 59 2HB PRO 59 -0.002 9.087 -19.006 445 HB3 PRO 59 1HB PRO 59 -1.325 10.263 -18.872 446 HG2 PRO 59 2HG PRO 59 0.843 9.621 -16.896 447 HG3 PRO 59 1HG PRO 59 0.267 11.206 -17.445 448 HD2 PRO 59 2HD PRO 59 -0.542 10.082 -15.109 449 HD3 PRO 59 1HD PRO 59 -1.585 11.152 -16.082 450 H LYS 60 H LYS 60 -0.231 7.496 -15.751 451 HA LYS 60 HA LYS 60 0.775 5.270 -17.375 452 HB2 LYS 60 2HB LYS 60 2.520 5.012 -15.787 453 HB3 LYS 60 1HB LYS 60 2.348 6.739 -16.084 454 HG2 LYS 60 2HG LYS 60 0.827 6.731 -14.031 455 HG3 LYS 60 1HG LYS 60 1.523 5.156 -13.677 456 HD2 LYS 60 2HD LYS 60 2.550 7.381 -12.682 457 HD3 LYS 60 1HD LYS 60 3.570 6.030 -13.155 458 HE2 LYS 60 2HE LYS 60 2.941 8.299 -15.028 459 HE3 LYS 60 1HE LYS 60 4.293 8.356 -13.903 460 HZ1 LYS 60 3HZ LYS 60 5.501 7.114 -15.254 461 HZ2 LYS 60 1HZ LYS 60 4.279 7.236 -16.416 462 HZ3 LYS 60 2HZ LYS 60 4.308 5.921 -15.354 463 H PHE 61 H PHE 61 -0.683 5.840 -14.165 464 HA PHE 61 HA PHE 61 -0.980 3.119 -13.555 465 HB2 PHE 61 2HB PHE 61 -1.223 5.228 -12.029 466 HB3 PHE 61 1HB PHE 61 -2.916 5.165 -12.534 467 HD1 PHE 61 1HD PHE 61 -4.114 2.887 -12.230 468 HD2 PHE 61 2HD PHE 61 -0.498 3.949 -10.254 469 HE1 PHE 61 1HE PHE 61 -4.529 1.152 -10.537 470 HE2 PHE 61 2HE PHE 61 -0.911 2.219 -8.554 471 HZ PHE 61 HZ PHE 61 -2.930 0.818 -8.696 472 H ALA 62 H ALA 62 -2.686 5.298 -15.622 473 HA ALA 62 HA ALA 62 -5.124 3.892 -15.865 474 HB1 ALA 62 1HB ALA 62 -4.776 4.963 -18.337 475 HB2 ALA 62 2HB ALA 62 -3.682 5.966 -17.383 476 HB3 ALA 62 3HB ALA 62 -5.389 5.863 -16.950 477 H GLU 63 H GLU 63 -1.928 3.275 -16.760 478 HA GLU 63 HA GLU 63 -2.453 1.330 -18.837 479 HB2 GLU 63 2HB GLU 63 -0.442 2.995 -18.629 480 HB3 GLU 63 1HB GLU 63 0.202 1.795 -17.504 481 HG2 GLU 63 2HG GLU 63 0.708 0.342 -19.142 482 HG3 GLU 63 1HG GLU 63 -0.739 0.720 -20.076 483 H SER 64 H SER 64 -2.304 1.461 -15.479 484 HA SER 64 HA SER 64 -1.145 -0.929 -14.729 485 HB2 SER 64 2HB SER 64 -3.478 0.519 -13.496 486 HB3 SER 64 1HB SER 64 -2.536 -0.725 -12.696 487 HG SER 64 HG SER 64 -0.682 0.731 -13.190 488 H THR 65 H THR 65 -3.604 -0.755 -16.903 489 HA THR 65 HA THR 65 -5.581 -2.490 -16.142 490 HB THR 65 HB THR 65 -4.459 -2.994 -18.838 491 HG1 THR 65 1HG THR 65 -5.354 -0.423 -18.048 492 HG21 THR 65 3HG2 THR 65 -6.803 -3.571 -17.965 493 HG22 THR 65 1HG2 THR 65 -6.642 -2.865 -19.572 494 HG23 THR 65 2HG2 THR 65 -7.147 -1.859 -18.213 495 H GLU 66 H GLU 66 -2.295 -3.187 -17.174 496 HA GLU 66 HA GLU 66 -2.643 -6.043 -16.938 497 HB2 GLU 66 2HB GLU 66 -0.255 -6.193 -17.423 498 HB3 GLU 66 1HB GLU 66 -1.040 -5.110 -18.577 499 HG2 GLU 66 2HG GLU 66 -0.086 -3.675 -16.273 500 HG3 GLU 66 1HG GLU 66 1.213 -4.589 -17.037 501 H ILE 67 H ILE 67 -1.546 -3.350 -15.009 502 HA ILE 67 HA ILE 67 -0.329 -4.923 -12.965 503 HB ILE 67 HB ILE 67 -1.527 -2.149 -12.826 504 HG12 ILE 67 2HG1 ILE 67 1.298 -3.144 -13.232 505 HG13 ILE 67 1HG1 ILE 67 0.327 -2.184 -14.355 506 HG21 ILE 67 1HG2 ILE 67 0.148 -3.657 -10.830 507 HG22 ILE 67 2HG2 ILE 67 -1.482 -3.025 -10.608 508 HG23 ILE 67 3HG2 ILE 67 -0.121 -1.915 -10.769 509 HD11 ILE 67 3HD1 ILE 67 1.468 -0.454 -13.529 510 HD12 ILE 67 1HD1 ILE 67 1.979 -1.346 -12.096 511 HD13 ILE 67 2HD1 ILE 67 0.387 -0.587 -12.141 512 H SER 68 H SER 68 -3.547 -4.353 -13.944 513 HA SER 68 HA SER 68 -4.853 -4.739 -11.443 514 HB2 SER 68 2HB SER 68 -6.848 -4.795 -12.662 515 HB3 SER 68 1HB SER 68 -5.807 -3.846 -13.722 516 HG SER 68 HG SER 68 -6.955 -5.538 -14.811 517 H GLU 69 H GLU 69 -3.538 -6.778 -13.938 518 HA GLU 69 HA GLU 69 -4.627 -9.217 -12.889 519 HB2 GLU 69 2HB GLU 69 -2.329 -8.889 -14.823 520 HB3 GLU 69 1HB GLU 69 -3.306 -10.329 -14.574 521 HG2 GLU 69 2HG GLU 69 -4.372 -7.726 -15.637 522 HG3 GLU 69 1HG GLU 69 -3.839 -9.070 -16.645 523 H LEU 70 H LEU 70 -1.635 -7.405 -12.716 524 HA LEU 70 HA LEU 70 -0.026 -9.293 -11.413 525 HB2 LEU 70 2HB LEU 70 -0.062 -6.311 -11.576 526 HB3 LEU 70 1HB LEU 70 0.969 -7.071 -10.363 527 HG LEU 70 HG LEU 70 2.088 -8.353 -12.167 528 HD11 LEU 70 1HD1 LEU 70 1.674 -7.953 -14.448 529 HD12 LEU 70 2HD1 LEU 70 0.633 -6.571 -14.101 530 HD13 LEU 70 3HD1 LEU 70 0.092 -8.204 -13.710 531 HD21 LEU 70 3HD2 LEU 70 3.339 -6.515 -11.593 532 HD22 LEU 70 1HD2 LEU 70 2.089 -5.373 -12.091 533 HD23 LEU 70 2HD2 LEU 70 3.059 -6.205 -13.307 534 H SER 71 H SER 71 -2.731 -7.482 -10.307 535 HA SER 71 HA SER 71 -2.216 -7.358 -7.556 536 HB2 SER 71 2HB SER 71 -4.357 -6.736 -9.267 537 HB3 SER 71 1HB SER 71 -4.988 -7.880 -8.081 538 HG SER 71 HG SER 71 -4.839 -5.421 -7.644 539 H HIS 72 H HIS 72 -2.916 -10.053 -9.573 540 HA HIS 72 HA HIS 72 -4.246 -11.751 -7.800 541 HB2 HIS 72 2HB HIS 72 -3.730 -13.500 -9.260 542 HB3 HIS 72 1HB HIS 72 -3.662 -12.084 -10.316 543 HD1 HIS 72 1HD HIS 72 -1.723 -14.961 -9.224 544 HD2 HIS 72 2HD HIS 72 -0.904 -11.215 -10.825 545 HE1 HIS 72 1HE HIS 72 0.634 -15.101 -10.090 546 HE2 HIS 72 2HE HIS 72 1.074 -12.852 -11.137 547 H ASN 73 H ASN 73 -1.121 -10.471 -7.754 548 HA ASN 73 HA ASN 73 0.079 -12.524 -6.124 549 HB2 ASN 73 2HB ASN 73 0.981 -9.752 -6.941 550 HB3 ASN 73 1HB ASN 73 1.964 -10.903 -6.035 551 HD21 ASN 73 1HD2 ASN 73 0.712 -10.006 -9.105 552 HD22 ASN 73 2HD2 ASN 73 1.526 -11.226 -10.036 553 H PHE 74 H PHE 74 -1.493 -9.436 -5.710 554 HA PHE 74 HA PHE 74 -2.186 -9.861 -3.061 555 HB2 PHE 74 2HB PHE 74 -0.764 -8.047 -2.023 556 HB3 PHE 74 1HB PHE 74 0.052 -9.559 -2.425 557 HD1 PHE 74 1HD PHE 74 -0.785 -6.759 -4.728 558 HD2 PHE 74 2HD PHE 74 2.252 -8.894 -2.656 559 HE1 PHE 74 1HE PHE 74 0.929 -5.510 -5.967 560 HE2 PHE 74 2HE PHE 74 3.972 -7.646 -3.888 561 HZ PHE 74 HZ PHE 74 3.314 -5.954 -5.546 562 H VAL 75 H VAL 75 -2.959 -7.718 -1.998 563 HA VAL 75 HA VAL 75 -4.096 -6.010 -4.125 564 HB VAL 75 HB VAL 75 -6.072 -5.663 -2.710 565 HG11 VAL 75 1HG1 VAL 75 -7.138 -7.515 -3.463 566 HG12 VAL 75 2HG1 VAL 75 -5.921 -8.616 -2.820 567 HG13 VAL 75 3HG1 VAL 75 -5.616 -7.743 -4.322 568 HG21 VAL 75 3HG2 VAL 75 -6.243 -6.321 -0.582 569 HG22 VAL 75 1HG2 VAL 75 -4.498 -6.562 -0.649 570 HG23 VAL 75 2HG2 VAL 75 -5.588 -7.920 -0.927 571 H MET 76 H MET 76 -4.284 -3.734 -3.655 572 HA MET 76 HA MET 76 -2.675 -2.958 -1.327 573 HB2 MET 76 2HB MET 76 -2.578 -0.893 -3.268 574 HB3 MET 76 1HB MET 76 -1.270 -1.869 -2.634 575 HG2 MET 76 2HG MET 76 -3.030 -2.677 -4.941 576 HG3 MET 76 1HG MET 76 -1.447 -1.924 -5.101 577 HE1 MET 76 3HE MET 76 -1.029 -5.573 -6.320 578 HE2 MET 76 1HE MET 76 -1.882 -4.077 -6.701 579 HE3 MET 76 2HE MET 76 -2.723 -5.386 -5.869 580 H VAL 77 H VAL 77 -2.969 -0.468 -0.883 581 HA VAL 77 HA VAL 77 -5.800 0.275 -1.053 582 HB VAL 77 HB VAL 77 -4.212 0.020 1.494 583 HG11 VAL 77 1HG1 VAL 77 -6.530 1.756 0.860 584 HG12 VAL 77 2HG1 VAL 77 -5.217 1.990 2.015 585 HG13 VAL 77 3HG1 VAL 77 -6.553 0.904 2.403 586 HG21 VAL 77 3HG2 VAL 77 -6.744 -1.027 1.837 587 HG22 VAL 77 1HG2 VAL 77 -5.259 -1.936 1.551 588 HG23 VAL 77 2HG2 VAL 77 -6.304 -1.503 0.198 589 H ASN 78 H ASN 78 -6.159 2.473 -1.217 590 HA ASN 78 HA ASN 78 -3.761 4.167 -1.170 591 HB2 ASN 78 2HB ASN 78 -4.686 4.331 -3.318 592 HB3 ASN 78 1HB ASN 78 -6.325 4.383 -2.715 593 HD21 ASN 78 1HD2 ASN 78 -3.602 6.188 -1.493 594 HD22 ASN 78 2HD2 ASN 78 -4.195 7.762 -1.940 595 H LEU 79 H LEU 79 -3.530 5.296 0.587 596 HA LEU 79 HA LEU 79 -5.910 6.202 2.049 597 HB2 LEU 79 2HB LEU 79 -4.501 4.988 3.486 598 HB3 LEU 79 1HB LEU 79 -3.055 5.735 2.844 599 HG LEU 79 HG LEU 79 -3.529 7.796 3.981 600 HD11 LEU 79 1HD1 LEU 79 -5.776 7.013 5.592 601 HD12 LEU 79 2HD1 LEU 79 -6.192 6.927 3.881 602 HD13 LEU 79 3HD1 LEU 79 -5.575 8.430 4.564 603 HD21 LEU 79 3HD2 LEU 79 -3.491 5.251 5.476 604 HD22 LEU 79 1HD2 LEU 79 -3.898 6.698 6.398 605 HD23 LEU 79 2HD2 LEU 79 -2.372 6.613 5.518 606 H GLU 80 H GLU 80 -6.294 8.361 2.435 607 HA GLU 80 HA GLU 80 -4.334 10.314 1.481 608 HB2 GLU 80 2HB GLU 80 -6.483 9.556 -0.092 609 HB3 GLU 80 1HB GLU 80 -7.049 11.039 0.687 610 HG2 GLU 80 2HG GLU 80 -5.212 12.283 -0.183 611 HG3 GLU 80 1HG GLU 80 -4.426 10.811 -0.775 612 H ASP 81 H ASP 81 -5.749 12.611 1.704 613 HA ASP 81 HA ASP 81 -5.673 13.175 4.425 614 HB2 ASP 81 2HB ASP 81 -5.682 14.747 2.331 615 HB3 ASP 81 1HB ASP 81 -7.424 14.774 2.592 616 H GLU 82 H GLU 82 -8.277 11.932 2.474 617 HA GLU 82 HA GLU 82 -10.520 12.591 3.915 618 HB2 GLU 82 2HB GLU 82 -9.770 10.515 2.047 619 HB3 GLU 82 1HB GLU 82 -10.870 9.882 3.264 620 HG2 GLU 82 2HG GLU 82 -12.522 10.696 2.035 621 HG3 GLU 82 1HG GLU 82 -12.000 12.301 2.546 622 H GLU 83 H GLU 83 -8.003 10.324 4.736 623 HA GLU 83 HA GLU 83 -9.132 10.074 7.419 624 HB2 GLU 83 2HB GLU 83 -8.345 7.744 5.663 625 HB3 GLU 83 1HB GLU 83 -8.560 7.618 7.404 626 HG2 GLU 83 2HG GLU 83 -10.741 7.372 7.170 627 HG3 GLU 83 1HG GLU 83 -10.856 8.872 6.244 628 H GLU 84 H GLU 84 -7.517 11.232 8.370 629 HA GLU 84 HA GLU 84 -4.750 10.370 7.876 630 HB2 GLU 84 2HB GLU 84 -5.686 12.867 7.725 631 HB3 GLU 84 1HB GLU 84 -5.335 12.827 9.447 632 HG2 GLU 84 2HG GLU 84 -3.158 11.763 7.853 633 HG3 GLU 84 1HG GLU 84 -3.566 13.424 7.421 634 HA PRO 85 HA PRO 85 -5.730 8.724 12.099 635 HB2 PRO 85 2HB PRO 85 -4.523 6.328 11.761 636 HB3 PRO 85 1HB PRO 85 -6.190 6.636 11.232 637 HG2 PRO 85 2HG PRO 85 -3.654 6.634 9.627 638 HG3 PRO 85 1HG PRO 85 -5.236 5.925 9.227 639 HD2 PRO 85 2HD PRO 85 -4.400 8.315 8.241 640 HD3 PRO 85 1HD PRO 85 -6.113 7.947 8.558 641 H LYS 86 H LYS 86 -4.400 9.648 13.533 642 HA LYS 86 HA LYS 86 -1.756 10.353 13.168 643 HB2 LYS 86 2HB LYS 86 -3.640 10.461 15.268 644 HB3 LYS 86 1HB LYS 86 -2.190 9.706 15.940 645 HG2 LYS 86 2HG LYS 86 -1.093 11.638 15.971 646 HG3 LYS 86 1HG LYS 86 -1.555 12.018 14.311 647 HD2 LYS 86 2HD LYS 86 -3.835 12.642 15.261 648 HD3 LYS 86 1HD LYS 86 -3.068 12.583 16.849 649 HE2 LYS 86 2HE LYS 86 -3.118 14.861 15.945 650 HE3 LYS 86 1HE LYS 86 -1.468 14.279 16.161 651 HZ1 LYS 86 3HZ LYS 86 -1.955 15.466 14.015 652 HZ2 LYS 86 1HZ LYS 86 -2.881 14.122 13.563 653 HZ3 LYS 86 2HZ LYS 86 -1.225 13.948 13.860 654 H ASP 87 H ASP 87 -0.500 8.740 12.275 655 HA ASP 87 HA ASP 87 0.809 6.997 14.070 656 HB2 ASP 87 2HB ASP 87 -1.502 5.867 13.476 657 HB3 ASP 87 1HB ASP 87 -0.652 5.415 11.992 658 H GLU 88 H GLU 88 2.662 6.085 13.196 659 HA GLU 88 HA GLU 88 3.835 7.417 11.031 660 HB2 GLU 88 2HB GLU 88 4.599 4.836 12.400 661 HB3 GLU 88 1HB GLU 88 5.611 5.654 11.216 662 HG2 GLU 88 2HG GLU 88 4.689 6.859 13.814 663 HG3 GLU 88 1HG GLU 88 6.263 6.112 13.546 664 H ASP 89 H ASP 89 1.633 4.822 11.020 665 HA ASP 89 HA ASP 89 2.346 3.170 8.996 666 HB2 ASP 89 2HB ASP 89 -0.223 4.131 10.060 667 HB3 ASP 89 1HB ASP 89 -0.306 3.511 8.406 668 H PHE 90 H PHE 90 1.555 6.550 8.645 669 HA PHE 90 HA PHE 90 1.272 6.260 5.764 670 HB2 PHE 90 2HB PHE 90 0.982 8.828 5.903 671 HB3 PHE 90 1HB PHE 90 -0.305 7.784 6.519 672 HD1 PHE 90 1HD PHE 90 2.885 9.175 7.891 673 HD2 PHE 90 2HD PHE 90 -1.300 8.612 8.391 674 HE1 PHE 90 1HE PHE 90 2.992 10.343 10.049 675 HE2 PHE 90 2HE PHE 90 -1.203 9.778 10.553 676 HZ PHE 90 HZ PHE 90 0.945 10.648 11.387 677 H SER 91 H SER 91 3.725 7.043 8.031 678 HA SER 91 HA SER 91 5.683 7.242 5.969 679 HB2 SER 91 2HB SER 91 5.781 9.727 7.588 680 HB3 SER 91 1HB SER 91 6.178 9.460 5.885 681 HG SER 91 HG SER 91 4.125 9.780 5.331 682 HA PRO 92 HA PRO 92 7.221 5.759 10.058 683 HB2 PRO 92 2HB PRO 92 8.423 3.525 9.131 684 HB3 PRO 92 1HB PRO 92 6.687 3.591 9.498 685 HG2 PRO 92 2HG PRO 92 8.079 3.780 6.855 686 HG3 PRO 92 1HG PRO 92 6.599 2.906 7.281 687 HD2 PRO 92 2HD PRO 92 6.615 5.336 6.031 688 HD3 PRO 92 1HD PRO 92 5.289 4.775 7.069 689 H ASP 93 H ASP 93 8.983 5.538 6.960 690 HA ASP 93 HA ASP 93 11.292 6.794 8.290 691 HB2 ASP 93 2HB ASP 93 11.344 4.206 7.563 692 HB3 ASP 93 1HB ASP 93 11.822 4.940 6.024 693 H GLY 94 H GLY 94 10.355 8.784 7.419 694 HA2 GLY 94 2HA GLY 94 11.530 9.429 4.881 695 HA3 GLY 94 1HA GLY 94 9.768 9.371 4.820 696 H GLY 95 H GLY 95 8.726 11.206 5.230 697 HA2 GLY 95 2HA GLY 95 9.173 12.965 7.302 698 HA3 GLY 95 1HA GLY 95 10.177 13.546 5.973 699 H TYR 96 H TYR 96 8.672 13.268 3.756 700 HA TYR 96 HA TYR 96 6.851 15.396 4.014 701 HB2 TYR 96 2HB TYR 96 6.069 14.617 1.664 702 HB3 TYR 96 1HB TYR 96 7.707 15.245 1.869 703 HD1 TYR 96 2HD TYR 96 5.678 12.267 1.182 704 HD2 TYR 96 1HD TYR 96 9.634 13.780 1.624 705 HE1 TYR 96 2HE TYR 96 6.571 10.239 0.125 706 HE2 TYR 96 1HE TYR 96 10.528 11.761 0.566 707 HH TYR 96 HH TYR 96 8.643 8.974 0.024 708 H ILE 97 H ILE 97 4.536 14.949 2.803 709 HA ILE 97 HA ILE 97 3.268 12.726 4.221 710 HB ILE 97 HB ILE 97 1.561 14.103 5.180 711 HG12 ILE 97 2HG1 ILE 97 1.061 15.729 3.509 712 HG13 ILE 97 1HG1 ILE 97 1.643 16.618 4.915 713 HG21 ILE 97 1HG2 ILE 97 2.773 15.256 6.783 714 HG22 ILE 97 2HG2 ILE 97 4.027 15.725 5.635 715 HG23 ILE 97 3HG2 ILE 97 3.911 14.051 6.179 716 HD11 ILE 97 3HD1 ILE 97 3.019 16.137 2.303 717 HD12 ILE 97 1HD1 ILE 97 3.923 16.577 3.752 718 HD13 ILE 97 2HD1 ILE 97 2.681 17.658 3.127 719 HA PRO 98 HA PRO 98 2.458 10.768 3.593 720 HB2 PRO 98 2HB PRO 98 -0.093 10.226 2.029 721 HB3 PRO 98 1HB PRO 98 0.561 9.298 3.410 722 HG2 PRO 98 2HG PRO 98 -0.932 11.716 3.476 723 HG3 PRO 98 1HG PRO 98 -0.197 10.832 4.844 724 HD2 PRO 98 2HD PRO 98 0.771 13.163 4.258 725 HD3 PRO 98 1HD PRO 98 1.915 11.836 4.509 726 H ARG 99 H ARG 99 2.936 8.609 2.666 727 HA ARG 99 HA ARG 99 3.727 8.821 -0.169 728 HB2 ARG 99 2HB ARG 99 5.325 6.960 1.411 729 HB3 ARG 99 1HB ARG 99 5.843 8.257 0.328 730 HG2 ARG 99 2HG ARG 99 6.146 9.712 2.016 731 HG3 ARG 99 1HG ARG 99 4.766 9.128 2.931 732 HD2 ARG 99 2HD ARG 99 6.419 8.389 4.295 733 HD3 ARG 99 1HD ARG 99 6.325 7.004 3.208 734 HE ARG 99 HE ARG 99 8.493 7.439 2.714 735 HH11 ARG 99 1HH1 ARG 99 6.987 10.488 3.501 736 HH12 ARG 99 2HH1 ARG 99 8.402 11.415 3.136 737 HH21 ARG 99 1HH2 ARG 99 10.351 8.652 2.256 738 HH22 ARG 99 2HH2 ARG 99 10.315 10.374 2.443 739 H ILE 100 H ILE 100 4.585 6.355 -0.727 740 HA ILE 100 HA ILE 100 2.224 4.656 -0.254 741 HB ILE 100 HB ILE 100 2.122 4.983 -2.535 742 HG12 ILE 100 2HG1 ILE 100 4.087 2.816 -2.940 743 HG13 ILE 100 1HG1 ILE 100 2.817 2.481 -1.779 744 HG21 ILE 100 1HG2 ILE 100 4.344 6.261 -2.526 745 HG22 ILE 100 2HG2 ILE 100 3.842 5.463 -4.014 746 HG23 ILE 100 3HG2 ILE 100 5.064 4.719 -2.988 747 HD11 ILE 100 3HD1 ILE 100 2.682 2.177 -4.516 748 HD12 ILE 100 1HD1 ILE 100 1.770 3.651 -4.203 749 HD13 ILE 100 2HD1 ILE 100 1.326 2.151 -3.391 750 H LEU 101 H LEU 101 2.519 2.688 0.662 751 HA LEU 101 HA LEU 101 5.025 1.349 0.496 752 HB2 LEU 101 2HB LEU 101 5.882 1.628 2.567 753 HB3 LEU 101 1HB LEU 101 5.077 3.164 2.378 754 HG LEU 101 HG LEU 101 4.648 1.056 4.344 755 HD11 LEU 101 1HD1 LEU 101 4.295 2.807 5.747 756 HD12 LEU 101 2HD1 LEU 101 3.468 3.774 4.512 757 HD13 LEU 101 3HD1 LEU 101 5.230 3.617 4.487 758 HD21 LEU 101 3HD2 LEU 101 2.603 0.474 3.572 759 HD22 LEU 101 1HD2 LEU 101 2.331 2.020 2.769 760 HD23 LEU 101 2HD2 LEU 101 2.165 1.886 4.519 761 H PHE 102 H PHE 102 5.089 -0.738 1.711 762 HA PHE 102 HA PHE 102 2.583 -2.064 1.149 763 HB2 PHE 102 2HB PHE 102 5.280 -3.047 2.031 764 HB3 PHE 102 1HB PHE 102 3.895 -4.124 1.894 765 HD1 PHE 102 2HD PHE 102 5.907 -1.681 -0.047 766 HD2 PHE 102 1HD PHE 102 3.349 -5.079 -0.146 767 HE1 PHE 102 2HE PHE 102 6.338 -1.930 -2.456 768 HE2 PHE 102 1HE PHE 102 3.774 -5.336 -2.555 769 HZ PHE 102 HZ PHE 102 5.266 -3.758 -3.711 770 H LEU 103 H LEU 103 2.164 -4.044 2.786 771 HA LEU 103 HA LEU 103 2.384 -3.500 5.538 772 HB2 LEU 103 2HB LEU 103 0.342 -2.635 6.129 773 HB3 LEU 103 1HB LEU 103 0.756 -1.723 4.702 774 HG LEU 103 HG LEU 103 -0.891 -4.053 4.168 775 HD11 LEU 103 1HD1 LEU 103 -2.811 -2.304 5.073 776 HD12 LEU 103 2HD1 LEU 103 -1.609 -2.344 6.363 777 HD13 LEU 103 3HD1 LEU 103 -2.351 -3.843 5.801 778 HD21 LEU 103 3HD2 LEU 103 -1.846 -1.372 3.516 779 HD22 LEU 103 1HD2 LEU 103 -1.600 -2.764 2.465 780 HD23 LEU 103 2HD2 LEU 103 -0.233 -1.734 2.895 781 H ASP 104 H ASP 104 1.392 -5.057 6.886 782 HA ASP 104 HA ASP 104 1.278 -7.634 5.732 783 HB2 ASP 104 2HB ASP 104 1.380 -6.550 8.344 784 HB3 ASP 104 1HB ASP 104 -0.049 -7.593 8.289 785 HA PRO 105 HA PRO 105 -2.937 -8.066 4.540 786 HB2 PRO 105 2HB PRO 105 -3.156 -10.769 5.594 787 HB3 PRO 105 1HB PRO 105 -3.021 -10.231 3.911 788 HG2 PRO 105 2HG PRO 105 -1.048 -11.578 5.238 789 HG3 PRO 105 1HG PRO 105 -0.747 -10.459 3.892 790 HD2 PRO 105 2HD PRO 105 -0.438 -10.025 6.834 791 HD3 PRO 105 1HD PRO 105 0.576 -9.448 5.495 792 H SER 106 H SER 106 -2.677 -6.898 7.165 793 HA SER 106 HA SER 106 -5.310 -7.526 8.163 794 HB2 SER 106 2HB SER 106 -3.260 -8.871 9.356 795 HB3 SER 106 1HB SER 106 -3.329 -7.408 10.353 796 HG SER 106 HG SER 106 -5.684 -7.883 10.432 797 H GLY 107 H GLY 107 -3.642 -5.291 6.948 798 HA2 GLY 107 2HA GLY 107 -3.895 -2.990 7.062 799 HA3 GLY 107 1HA GLY 107 -4.737 -3.192 8.601 800 H LYS 108 H LYS 108 -1.459 -4.200 7.594 801 HA LYS 108 HA LYS 108 -0.437 -2.643 9.886 802 HB2 LYS 108 2HB LYS 108 0.036 -5.338 8.992 803 HB3 LYS 108 1HB LYS 108 1.553 -4.447 9.042 804 HG2 LYS 108 2HG LYS 108 0.320 -3.730 11.393 805 HG3 LYS 108 1HG LYS 108 -0.102 -5.442 11.210 806 HD2 LYS 108 2HD LYS 108 2.236 -6.029 10.984 807 HD3 LYS 108 1HD LYS 108 2.700 -4.327 11.032 808 HE2 LYS 108 2HE LYS 108 1.571 -4.264 13.321 809 HE3 LYS 108 1HE LYS 108 1.579 -6.025 13.242 810 HZ1 LYS 108 3HZ LYS 108 3.985 -5.964 12.999 811 HZ2 LYS 108 1HZ LYS 108 3.505 -5.190 14.426 812 HZ3 LYS 108 2HZ LYS 108 3.973 -4.274 13.084 813 H VAL 109 H VAL 109 -0.810 -1.058 7.868 814 HA VAL 109 HA VAL 109 1.193 -0.908 5.901 815 HB VAL 109 HB VAL 109 0.234 1.730 6.456 816 HG11 VAL 109 1HG1 VAL 109 -0.010 1.727 4.229 817 HG12 VAL 109 2HG1 VAL 109 -0.890 0.200 4.226 818 HG13 VAL 109 3HG1 VAL 109 0.867 0.201 4.321 819 HG21 VAL 109 3HG2 VAL 109 -1.902 -0.402 6.323 820 HG22 VAL 109 1HG2 VAL 109 -2.181 1.321 6.072 821 HG23 VAL 109 2HG2 VAL 109 -1.630 0.737 7.640 822 H HIS 110 H HIS 110 3.105 -1.255 6.899 823 HA HIS 110 HA HIS 110 4.644 1.002 7.329 824 HB2 HIS 110 2HB HIS 110 5.117 0.776 9.809 825 HB3 HIS 110 1HB HIS 110 3.563 1.476 9.375 826 HD1 HIS 110 1HD HIS 110 1.446 -0.048 9.748 827 HD2 HIS 110 2HD HIS 110 5.002 -1.560 11.276 828 HE1 HIS 110 1HE HIS 110 0.770 -1.867 11.342 829 HE2 HIS 110 2HE HIS 110 2.935 -2.739 12.290 830 HA PRO 111 HA PRO 111 6.928 -3.069 7.603 831 HB2 PRO 111 2HB PRO 111 6.895 -4.238 5.232 832 HB3 PRO 111 1HB PRO 111 5.499 -4.383 6.312 833 HG2 PRO 111 2HG PRO 111 5.889 -2.592 3.950 834 HG3 PRO 111 1HG PRO 111 4.451 -3.504 4.442 835 HD2 PRO 111 2HD PRO 111 4.903 -0.801 4.972 836 HD3 PRO 111 1HD PRO 111 3.751 -1.850 5.829 837 H GLU 112 H GLU 112 7.202 -0.227 6.141 838 HA GLU 112 HA GLU 112 9.020 0.985 5.487 839 HB2 GLU 112 2HB GLU 112 10.625 -1.575 5.453 840 HB3 GLU 112 1HB GLU 112 11.242 0.070 5.471 841 HG2 GLU 112 2HG GLU 112 10.002 0.275 7.720 842 HG3 GLU 112 1HG GLU 112 9.973 -1.487 7.684 843 H ILE 113 H ILE 113 9.027 -2.230 3.917 844 HA ILE 113 HA ILE 113 9.945 -2.205 1.556 845 HB ILE 113 HB ILE 113 6.947 -2.350 1.488 846 HG12 ILE 113 2HG1 ILE 113 7.622 -3.506 3.533 847 HG13 ILE 113 1HG1 ILE 113 7.111 -4.677 2.308 848 HG21 ILE 113 1HG2 ILE 113 7.312 -4.074 -0.145 849 HG22 ILE 113 2HG2 ILE 113 9.048 -4.055 0.161 850 HG23 ILE 113 3HG2 ILE 113 8.270 -2.661 -0.590 851 HD11 ILE 113 3HD1 ILE 113 9.202 -5.196 3.676 852 HD12 ILE 113 1HD1 ILE 113 9.998 -3.970 2.689 853 HD13 ILE 113 2HD1 ILE 113 9.292 -5.396 1.926 854 H ILE 114 H ILE 114 10.694 -0.276 0.838 855 HA ILE 114 HA ILE 114 8.795 1.769 -0.034 856 HB ILE 114 HB ILE 114 10.605 3.298 -0.075 857 HG12 ILE 114 2HG1 ILE 114 12.249 0.841 -0.287 858 HG13 ILE 114 1HG1 ILE 114 12.466 2.408 -1.044 859 HG21 ILE 114 1HG2 ILE 114 9.760 2.693 2.147 860 HG22 ILE 114 2HG2 ILE 114 11.442 3.218 2.181 861 HG23 ILE 114 3HG2 ILE 114 11.052 1.502 2.298 862 HD11 ILE 114 3HD1 ILE 114 13.135 3.173 1.346 863 HD12 ILE 114 1HD1 ILE 114 14.286 2.287 0.346 864 HD13 ILE 114 2HD1 ILE 114 13.394 1.449 1.616 865 H ASN 115 H ASN 115 10.477 2.998 -1.918 866 HA ASN 115 HA ASN 115 9.763 1.670 -4.290 867 HB2 ASN 115 2HB ASN 115 9.936 4.072 -4.192 868 HB3 ASN 115 1HB ASN 115 11.640 3.980 -3.742 869 HD21 ASN 115 1HD2 ASN 115 10.104 5.208 -6.023 870 HD22 ASN 115 2HD2 ASN 115 10.925 4.636 -7.451 871 H GLU 116 H GLU 116 12.932 2.223 -2.811 872 HA GLU 116 HA GLU 116 14.899 1.108 -2.931 873 HB2 GLU 116 2HB GLU 116 12.912 -0.980 -3.585 874 HB3 GLU 116 1HB GLU 116 14.562 -1.311 -4.124 875 HG2 GLU 116 2HG GLU 116 13.668 -0.718 -1.310 876 HG3 GLU 116 1HG GLU 116 14.185 -2.276 -1.949 877 H ASN 117 H ASN 117 14.076 2.864 -4.989 878 HA ASN 117 HA ASN 117 16.013 2.157 -6.991 879 HB2 ASN 117 2HB ASN 117 13.701 1.096 -7.624 880 HB3 ASN 117 1HB ASN 117 13.289 2.752 -8.093 881 HD21 ASN 117 1HD2 ASN 117 16.058 0.541 -8.426 882 HD22 ASN 117 2HD2 ASN 117 16.306 0.847 -10.123 883 H GLY 118 H GLY 118 13.560 4.372 -5.797 884 HA2 GLY 118 2HA GLY 118 14.217 6.584 -7.423 885 HA3 GLY 118 1HA GLY 118 13.397 6.658 -5.859 886 H ASN 119 H ASN 119 14.561 8.594 -5.421 887 HA ASN 119 HA ASN 119 17.446 8.444 -5.165 888 HB2 ASN 119 2HB ASN 119 17.279 10.809 -4.474 889 HB3 ASN 119 1HB ASN 119 16.442 10.509 -6.004 890 HD21 ASN 119 1HD2 ASN 119 14.380 11.069 -6.180 891 HD22 ASN 119 2HD2 ASN 119 13.369 11.609 -4.866 892 HA PRO 120 HA PRO 120 17.527 7.484 -0.856 893 HB2 PRO 120 2HB PRO 120 19.811 8.656 -0.056 894 HB3 PRO 120 1HB PRO 120 19.806 7.273 -1.169 895 HG2 PRO 120 2HG PRO 120 20.099 10.197 -1.771 896 HG3 PRO 120 1HG PRO 120 21.003 8.817 -2.436 897 HD2 PRO 120 2HD PRO 120 18.929 10.037 -3.735 898 HD3 PRO 120 1HD PRO 120 19.368 8.330 -3.970 899 H SER 121 H SER 121 15.678 9.461 -1.207 900 HA SER 121 HA SER 121 15.658 10.756 1.297 901 HB2 SER 121 2HB SER 121 16.760 12.275 -0.989 902 HB3 SER 121 1HB SER 121 15.497 13.112 -0.072 903 HG SER 121 HG SER 121 17.910 12.009 0.946 904 H TYR 122 H TYR 122 14.050 9.083 -0.355 905 HA TYR 122 HA TYR 122 11.531 10.363 -0.077 906 HB2 TYR 122 2HB TYR 122 12.910 10.567 -2.605 907 HB3 TYR 122 1HB TYR 122 11.402 9.671 -2.796 908 HD1 TYR 122 2HD TYR 122 9.251 10.793 -2.278 909 HD2 TYR 122 1HD TYR 122 12.937 12.904 -2.160 910 HE1 TYR 122 2HE TYR 122 8.023 12.921 -2.343 911 HE2 TYR 122 1HE TYR 122 11.724 15.041 -2.224 912 HH TYR 122 HH TYR 122 8.405 15.287 -1.678 913 H LYS 123 H LYS 123 13.153 7.852 -1.983 914 HA LYS 123 HA LYS 123 12.624 5.656 -2.377 915 HB2 LYS 123 2HB LYS 123 12.666 6.109 0.561 916 HB3 LYS 123 1HB LYS 123 12.112 4.538 0.005 917 HG2 LYS 123 2HG LYS 123 14.782 5.825 -0.528 918 HG3 LYS 123 1HG LYS 123 14.448 4.408 0.481 919 HD2 LYS 123 2HD LYS 123 14.904 3.181 -1.329 920 HD3 LYS 123 1HD LYS 123 13.352 3.743 -1.965 921 HE2 LYS 123 2HE LYS 123 14.442 4.707 -3.639 922 HE3 LYS 123 1HE LYS 123 15.193 5.799 -2.476 923 HZ1 LYS 123 3HZ LYS 123 16.959 4.799 -3.603 924 HZ2 LYS 123 1HZ LYS 123 16.257 3.260 -3.558 925 HZ3 LYS 123 2HZ LYS 123 16.877 3.949 -2.143 926 H TYR 124 H TYR 124 10.475 5.691 0.355 927 HA TYR 124 HA TYR 124 8.442 4.199 -0.414 928 HB2 TYR 124 2HB TYR 124 8.224 6.808 1.079 929 HB3 TYR 124 1HB TYR 124 6.905 5.637 0.963 930 HD1 TYR 124 2HD TYR 124 10.381 6.089 2.209 931 HD2 TYR 124 1HD TYR 124 6.804 3.800 2.418 932 HE1 TYR 124 2HE TYR 124 11.260 4.906 4.174 933 HE2 TYR 124 1HE TYR 124 7.669 2.613 4.392 934 HH TYR 124 HH TYR 124 9.961 3.600 6.272 935 H PHE 125 H PHE 125 8.958 7.407 -1.724 936 HA PHE 125 HA PHE 125 6.327 7.617 -2.856 937 HB2 PHE 125 2HB PHE 125 7.677 9.580 -2.181 938 HB3 PHE 125 1HB PHE 125 8.820 9.210 -3.478 939 HD1 PHE 125 1HD PHE 125 5.180 9.827 -2.955 940 HD2 PHE 125 2HD PHE 125 8.569 10.280 -5.486 941 HE1 PHE 125 1HE PHE 125 3.833 11.177 -4.508 942 HE2 PHE 125 2HE PHE 125 7.231 11.631 -7.044 943 HZ PHE 125 HZ PHE 125 4.861 12.079 -6.557 944 H TYR 126 H TYR 126 5.675 6.447 -4.581 945 HA TYR 126 HA TYR 126 7.651 5.914 -6.706 946 HB2 TYR 126 2HB TYR 126 5.216 4.200 -6.528 947 HB3 TYR 126 1HB TYR 126 6.821 3.810 -7.144 948 HD1 TYR 126 1HD TYR 126 8.163 4.827 -4.449 949 HD2 TYR 126 2HD TYR 126 5.059 2.101 -5.410 950 HE1 TYR 126 1HE TYR 126 8.616 3.596 -2.369 951 HE2 TYR 126 2HE TYR 126 5.499 0.851 -3.338 952 HH TYR 126 HH TYR 126 7.381 0.511 -1.763 953 H VAL 127 H VAL 127 7.161 7.671 -8.012 954 HA VAL 127 HA VAL 127 4.428 8.290 -8.673 955 HB VAL 127 HB VAL 127 5.783 9.577 -10.627 956 HG11 VAL 127 1HG1 VAL 127 4.878 10.243 -7.928 957 HG12 VAL 127 2HG1 VAL 127 4.575 11.052 -9.465 958 HG13 VAL 127 3HG1 VAL 127 6.076 11.357 -8.591 959 HG21 VAL 127 3HG2 VAL 127 7.931 10.245 -10.039 960 HG22 VAL 127 1HG2 VAL 127 7.923 8.530 -9.630 961 HG23 VAL 127 2HG2 VAL 127 7.737 9.740 -8.361 962 H SER 128 H SER 128 6.831 7.955 -11.190 963 HA SER 128 HA SER 128 5.300 6.840 -13.114 964 HB2 SER 128 2HB SER 128 7.232 6.417 -14.293 965 HB3 SER 128 1HB SER 128 7.841 7.543 -13.070 966 HG SER 128 HG SER 128 9.215 5.946 -12.793 967 H ALA 129 H ALA 129 4.819 4.797 -13.896 968 HA ALA 129 HA ALA 129 4.195 2.825 -11.987 969 HB1 ALA 129 1HB ALA 129 4.302 2.651 -14.994 970 HB2 ALA 129 2HB ALA 129 2.896 3.062 -14.010 971 HB3 ALA 129 3HB ALA 129 3.583 1.439 -13.935 972 H GLU 130 H GLU 130 7.052 3.511 -13.729 973 HA GLU 130 HA GLU 130 8.210 1.005 -14.031 974 HB2 GLU 130 2HB GLU 130 9.231 3.789 -13.801 975 HB3 GLU 130 1HB GLU 130 10.397 2.472 -13.618 976 HG2 GLU 130 2HG GLU 130 9.263 1.607 -15.827 977 HG3 GLU 130 1HG GLU 130 8.824 3.315 -16.001 978 H GLN 131 H GLN 131 8.374 3.212 -11.207 979 HA GLN 131 HA GLN 131 10.003 1.328 -9.797 980 HB2 GLN 131 2HB GLN 131 9.455 2.822 -7.822 981 HB3 GLN 131 1HB GLN 131 10.493 3.452 -9.091 982 HG2 GLN 131 2HG GLN 131 7.713 4.041 -9.610 983 HG3 GLN 131 1HG GLN 131 8.221 4.645 -8.037 984 HE21 GLN 131 1HE2 GLN 131 8.815 6.672 -8.123 985 HE22 GLN 131 2HE2 GLN 131 9.672 7.436 -9.414 986 H VAL 132 H VAL 132 6.636 2.484 -9.431 987 HA VAL 132 HA VAL 132 6.008 0.858 -7.243 988 HB VAL 132 HB VAL 132 4.483 2.579 -7.864 989 HG11 VAL 132 1HG1 VAL 132 3.279 1.317 -10.190 990 HG12 VAL 132 2HG1 VAL 132 4.949 1.816 -10.458 991 HG13 VAL 132 3HG1 VAL 132 3.751 2.996 -9.926 992 HG21 VAL 132 3HG2 VAL 132 3.544 0.615 -6.732 993 HG22 VAL 132 1HG2 VAL 132 3.151 -0.089 -8.303 994 HG23 VAL 132 2HG2 VAL 132 2.363 1.400 -7.781 995 H VAL 133 H VAL 133 6.518 0.020 -10.538 996 HA VAL 133 HA VAL 133 5.108 -2.487 -10.353 997 HB VAL 133 HB VAL 133 5.371 -1.236 -12.520 998 HG11 VAL 133 1HG1 VAL 133 8.156 -1.598 -11.850 999 HG12 VAL 133 2HG1 VAL 133 7.421 -0.562 -13.070 1000 HG13 VAL 133 3HG1 VAL 133 7.789 -2.244 -13.446 1001 HG21 VAL 133 3HG2 VAL 133 5.656 -3.249 -13.851 1002 HG22 VAL 133 1HG2 VAL 133 4.707 -3.598 -12.405 1003 HG23 VAL 133 2HG2 VAL 133 6.405 -4.069 -12.481 1004 H GLN 134 H GLN 134 8.428 -1.304 -9.943 1005 HA GLN 134 HA GLN 134 9.472 -4.015 -9.897 1006 HB2 GLN 134 2HB GLN 134 11.557 -2.840 -8.990 1007 HB3 GLN 134 1HB GLN 134 11.067 -2.466 -10.635 1008 HG2 GLN 134 2HG GLN 134 10.086 -0.406 -9.928 1009 HG3 GLN 134 1HG GLN 134 10.404 -0.784 -8.237 1010 HE21 GLN 134 1HE2 GLN 134 12.946 -1.708 -8.289 1011 HE22 GLN 134 2HE2 GLN 134 14.034 -0.456 -8.824 1012 H GLY 135 H GLY 135 8.381 -1.612 -7.634 1013 HA2 GLY 135 2HA GLY 135 9.295 -3.004 -5.301 1014 HA3 GLY 135 1HA GLY 135 8.144 -1.660 -5.343 1015 H MET 136 H MET 136 6.492 -3.134 -7.384 1016 HA MET 136 HA MET 136 5.016 -4.719 -5.415 1017 HB2 MET 136 2HB MET 136 3.130 -4.552 -6.842 1018 HB3 MET 136 1HB MET 136 3.893 -2.971 -6.840 1019 HG2 MET 136 2HG MET 136 3.914 -3.018 -9.040 1020 HG3 MET 136 1HG MET 136 5.027 -4.381 -8.984 1021 HE1 MET 136 3HE MET 136 3.037 -6.435 -7.466 1022 HE2 MET 136 1HE MET 136 4.042 -7.009 -8.796 1023 HE3 MET 136 2HE MET 136 2.308 -7.330 -8.799 1024 H LYS 137 H LYS 137 6.764 -5.131 -8.424 1025 HA LYS 137 HA LYS 137 5.924 -7.844 -8.802 1026 HB2 LYS 137 2HB LYS 137 7.257 -7.875 -10.716 1027 HB3 LYS 137 1HB LYS 137 6.707 -6.211 -10.610 1028 HG2 LYS 137 2HG LYS 137 8.959 -5.822 -9.378 1029 HG3 LYS 137 1HG LYS 137 9.428 -7.343 -10.140 1030 HD2 LYS 137 2HD LYS 137 8.487 -4.834 -11.528 1031 HD3 LYS 137 1HD LYS 137 10.117 -5.504 -11.544 1032 HE2 LYS 137 2HE LYS 137 8.039 -7.371 -12.434 1033 HE3 LYS 137 1HE LYS 137 8.206 -5.942 -13.450 1034 HZ1 LYS 137 3HZ LYS 137 9.645 -8.016 -13.921 1035 HZ2 LYS 137 1HZ LYS 137 10.602 -7.451 -12.644 1036 HZ3 LYS 137 2HZ LYS 137 10.356 -6.485 -14.011 1037 H GLU 138 H GLU 138 8.180 -6.373 -6.757 1038 HA GLU 138 HA GLU 138 9.794 -8.810 -6.540 1039 HB2 GLU 138 2HB GLU 138 10.521 -6.131 -6.482 1040 HB3 GLU 138 1HB GLU 138 10.570 -6.614 -4.790 1041 HG2 GLU 138 2HG GLU 138 11.923 -8.645 -5.699 1042 HG3 GLU 138 1HG GLU 138 12.197 -7.586 -7.092 1043 H ALA 139 H ALA 139 8.346 -6.418 -4.353 1044 HA ALA 139 HA ALA 139 8.427 -7.881 -2.013 1045 HB1 ALA 139 1HB ALA 139 5.989 -6.268 -2.411 1046 HB2 ALA 139 2HB ALA 139 7.523 -5.431 -2.653 1047 HB3 ALA 139 3HB ALA 139 7.185 -6.222 -1.114 1048 H GLN 140 H GLN 140 6.338 -8.238 -4.754 1049 HA GLN 140 HA GLN 140 4.213 -9.624 -3.601 1050 HB2 GLN 140 2HB GLN 140 3.892 -10.541 -5.917 1051 HB3 GLN 140 1HB GLN 140 3.982 -8.783 -5.815 1052 HG2 GLN 140 2HG GLN 140 5.270 -9.312 -7.667 1053 HG3 GLN 140 1HG GLN 140 6.454 -9.076 -6.384 1054 HE21 GLN 140 1HE2 GLN 140 4.385 -11.781 -7.381 1055 HE22 GLN 140 2HE2 GLN 140 5.661 -12.938 -7.497 1056 H GLU 141 H GLU 141 7.454 -10.604 -3.999 1057 HA GLU 141 HA GLU 141 6.701 -13.436 -3.776 1058 HB2 GLU 141 2HB GLU 141 8.146 -13.676 -5.467 1059 HB3 GLU 141 1HB GLU 141 8.762 -12.034 -5.263 1060 HG2 GLU 141 2HG GLU 141 10.191 -12.895 -3.405 1061 HG3 GLU 141 1HG GLU 141 9.676 -14.524 -3.841 1062 H ARG 142 H ARG 142 8.690 -10.907 -2.339 1063 HA ARG 142 HA ARG 142 9.671 -12.714 -0.293 1064 HB2 ARG 142 2HB ARG 142 10.781 -10.591 0.572 1065 HB3 ARG 142 1HB ARG 142 11.290 -11.170 -1.018 1066 HG2 ARG 142 2HG ARG 142 10.016 -9.489 -2.123 1067 HG3 ARG 142 1HG ARG 142 9.222 -9.018 -0.610 1068 HD2 ARG 142 2HD ARG 142 10.965 -7.426 -1.215 1069 HD3 ARG 142 1HD ARG 142 11.370 -8.277 0.284 1070 HE ARG 142 HE ARG 142 12.618 -9.745 -1.609 1071 HH11 ARG 142 1HH1 ARG 142 12.602 -6.331 -0.887 1072 HH12 ARG 142 2HH1 ARG 142 14.213 -6.075 -1.463 1073 HH21 ARG 142 1HH2 ARG 142 14.740 -9.410 -2.366 1074 HH22 ARG 142 2HH2 ARG 142 15.428 -7.822 -2.303 1075 H LEU 143 H LEU 143 7.478 -9.941 -0.501 1076 HA LEU 143 HA LEU 143 6.992 -9.757 2.277 1077 HB2 LEU 143 2HB LEU 143 6.553 -7.950 0.635 1078 HB3 LEU 143 1HB LEU 143 5.201 -8.891 0.007 1079 HG LEU 143 HG LEU 143 3.974 -8.639 2.034 1080 HD11 LEU 143 1HD1 LEU 143 5.792 -8.910 3.627 1081 HD12 LEU 143 2HD1 LEU 143 4.861 -7.455 3.984 1082 HD13 LEU 143 3HD1 LEU 143 6.430 -7.326 3.188 1083 HD21 LEU 143 3HD2 LEU 143 3.507 -6.749 0.862 1084 HD22 LEU 143 1HD2 LEU 143 5.189 -6.217 0.832 1085 HD23 LEU 143 2HD2 LEU 143 4.224 -6.016 2.296 1086 H THR 144 H THR 144 5.718 -11.828 -0.199 1087 HA THR 144 HA THR 144 3.261 -12.543 0.868 1088 HB THR 144 HB THR 144 3.717 -14.765 -0.276 1089 HG1 THR 144 1HG THR 144 5.567 -14.919 -1.479 1090 HG21 THR 144 3HG2 THR 144 3.858 -13.754 -2.576 1091 HG22 THR 144 1HG2 THR 144 3.971 -12.187 -1.775 1092 HG23 THR 144 2HG2 THR 144 2.537 -13.189 -1.554 1093 H GLY 145 H GLY 145 6.484 -13.429 1.858 1094 HA2 GLY 145 2HA GLY 145 5.352 -15.289 3.850 1095 HA3 GLY 145 1HA GLY 145 7.010 -15.333 3.267 1096 H ASP 146 H ASP 146 8.456 -14.607 4.667 1097 HA ASP 146 HA ASP 146 7.908 -12.210 6.216 1098 HB2 ASP 146 2HB ASP 146 8.753 -13.416 8.318 1099 HB3 ASP 146 1HB ASP 146 7.097 -13.737 7.813 1100 H ALA 147 H ALA 147 9.782 -13.242 4.083 1101 HA ALA 147 HA ALA 147 12.373 -13.197 5.370 1102 HB1 ALA 147 1HB ALA 147 13.283 -13.728 3.285 1103 HB2 ALA 147 2HB ALA 147 11.913 -13.046 2.410 1104 HB3 ALA 147 3HB ALA 147 11.728 -14.560 3.294 1105 H PHE 148 H PHE 148 10.199 -10.966 3.897 1106 HA PHE 148 HA PHE 148 11.947 -8.979 3.020 1107 HB2 PHE 148 2HB PHE 148 10.044 -7.439 3.244 1108 HB3 PHE 148 1HB PHE 148 9.554 -8.966 2.498 1109 HD1 PHE 148 2HD PHE 148 8.283 -10.629 3.836 1110 HD2 PHE 148 1HD PHE 148 9.112 -6.713 5.283 1111 HE1 PHE 148 2HE PHE 148 6.512 -10.883 5.522 1112 HE2 PHE 148 1HE PHE 148 7.339 -6.959 6.971 1113 HZ PHE 148 HZ PHE 148 6.036 -9.045 7.092 1114 H ARG 149 H ARG 149 10.666 -9.653 6.241 1115 HA ARG 149 HA ARG 149 11.517 -7.310 7.510 1116 HB2 ARG 149 2HB ARG 149 11.343 -10.048 8.761 1117 HB3 ARG 149 1HB ARG 149 11.194 -8.496 9.566 1118 HG2 ARG 149 2HG ARG 149 9.150 -8.104 8.119 1119 HG3 ARG 149 1HG ARG 149 9.248 -9.818 7.710 1120 HD2 ARG 149 2HD ARG 149 9.439 -9.262 10.570 1121 HD3 ARG 149 1HD ARG 149 7.907 -8.770 9.852 1122 HE ARG 149 HE ARG 149 7.867 -11.150 8.956 1123 HH11 ARG 149 1HH1 ARG 149 9.378 -10.282 11.991 1124 HH12 ARG 149 2HH1 ARG 149 9.150 -11.848 12.688 1125 HH21 ARG 149 1HH2 ARG 149 7.566 -13.200 9.886 1126 HH22 ARG 149 2HH2 ARG 149 8.123 -13.503 11.498 1127 H LYS 150 H LYS 150 13.003 -10.509 7.900 1128 HA LYS 150 HA LYS 150 15.608 -9.809 7.207 1129 HB2 LYS 150 2HB LYS 150 14.804 -9.026 9.922 1130 HB3 LYS 150 1HB LYS 150 16.274 -9.988 9.860 1131 HG2 LYS 150 2HG LYS 150 16.315 -7.928 7.847 1132 HG3 LYS 150 1HG LYS 150 16.024 -7.246 9.448 1133 HD2 LYS 150 2HD LYS 150 18.183 -9.277 9.091 1134 HD3 LYS 150 1HD LYS 150 18.470 -7.612 8.580 1135 HE2 LYS 150 2HE LYS 150 17.392 -7.219 11.034 1136 HE3 LYS 150 1HE LYS 150 18.222 -8.753 11.281 1137 HZ1 LYS 150 3HZ LYS 150 19.468 -6.270 10.230 1138 HZ2 LYS 150 1HZ LYS 150 20.263 -7.742 10.487 1139 HZ3 LYS 150 2HZ LYS 150 19.649 -6.873 11.800 1140 H LYS 151 H LYS 151 14.493 -11.457 10.137 1141 HA LYS 151 HA LYS 151 14.671 -14.061 8.960 1142 HB2 LYS 151 2HB LYS 151 17.029 -12.926 10.149 1143 HB3 LYS 151 1HB LYS 151 16.495 -14.301 11.106 1144 HG2 LYS 151 2HG LYS 151 16.653 -15.768 9.255 1145 HG3 LYS 151 1HG LYS 151 16.863 -14.427 8.127 1146 HD2 LYS 151 2HD LYS 151 19.058 -14.178 8.623 1147 HD3 LYS 151 1HD LYS 151 18.830 -14.601 10.321 1148 HE2 LYS 151 2HE LYS 151 19.910 -16.486 9.706 1149 HE3 LYS 151 1HE LYS 151 18.299 -16.975 9.185 1150 HZ1 LYS 151 3HZ LYS 151 18.795 -16.425 6.963 1151 HZ2 LYS 151 1HZ LYS 151 20.133 -17.296 7.524 1152 HZ3 LYS 151 2HZ LYS 151 20.217 -15.612 7.385 1153 H HIS 152 H HIS 152 15.206 -12.701 12.217 1154 HA HIS 152 HA HIS 152 14.134 -13.032 14.196 1155 HB2 HIS 152 2HB HIS 152 11.810 -13.390 12.304 1156 HB3 HIS 152 1HB HIS 152 11.635 -13.364 14.056 1157 HD1 HIS 152 1HD HIS 152 13.791 -11.055 11.959 1158 HD2 HIS 152 2HD HIS 152 10.442 -10.941 14.417 1159 HE1 HIS 152 1HE HIS 152 13.233 -8.617 12.224 1160 HE2 HIS 152 2HE HIS 152 11.150 -8.578 13.640 1161 H LEU 153 H LEU 153 12.454 -14.703 15.288 1162 HA LEU 153 HA LEU 153 12.843 -17.402 14.290 1163 HB2 LEU 153 2HB LEU 153 14.738 -16.430 15.980 1164 HB3 LEU 153 1HB LEU 153 13.604 -17.123 17.124 1165 HG LEU 153 HG LEU 153 14.319 -18.868 14.855 1166 HD11 LEU 153 1HD1 LEU 153 16.478 -19.485 15.766 1167 HD12 LEU 153 2HD1 LEU 153 16.334 -18.241 17.007 1168 HD13 LEU 153 3HD1 LEU 153 16.473 -17.782 15.309 1169 HD21 LEU 153 3HD2 LEU 153 12.974 -19.242 17.126 1170 HD22 LEU 153 1HD2 LEU 153 14.592 -19.650 17.697 1171 HD23 LEU 153 2HD2 LEU 153 13.888 -20.529 16.339 1172 H GLU 154 H GLU 154 10.933 -18.351 14.464 1173 HA GLU 154 HA GLU 154 8.782 -17.333 15.944 1174 HB2 GLU 154 2HB GLU 154 9.309 -19.675 14.272 1175 HB3 GLU 154 1HB GLU 154 8.150 -19.994 15.554 1176 HG2 GLU 154 2HG GLU 154 6.690 -19.256 14.014 1177 HG3 GLU 154 1HG GLU 154 7.165 -17.679 14.648 1178 H ASP 155 H ASP 155 8.982 -17.117 18.103 1179 HA ASP 155 HA ASP 155 8.691 -19.339 19.786 1180 HB2 ASP 155 2HB ASP 155 11.295 -19.159 19.033 1181 HB3 ASP 155 1HB ASP 155 11.307 -18.156 20.479 1182 H GLU 156 H GLU 156 10.404 -16.211 19.956 1183 HA GLU 156 HA GLU 156 10.090 -14.376 21.259 1184 HB2 GLU 156 2HB GLU 156 7.509 -15.210 20.402 1185 HB3 GLU 156 1HB GLU 156 7.368 -14.683 22.084 1186 HG2 GLU 156 2HG GLU 156 6.931 -12.845 20.581 1187 HG3 GLU 156 1HG GLU 156 8.412 -12.550 21.492 1188 H LEU 157 H LEU 157 11.268 -14.655 23.066 1189 HA LEU 157 HA LEU 157 11.792 -15.086 25.236 1190 HB2 LEU 157 2HB LEU 157 9.327 -14.014 25.301 1191 HB3 LEU 157 1HB LEU 157 8.976 -15.578 26.012 1192 HG LEU 157 HG LEU 157 9.395 -13.990 27.770 1193 HD11 LEU 157 1HD1 LEU 157 11.353 -15.073 28.876 1194 HD12 LEU 157 2HD1 LEU 157 11.654 -15.941 27.371 1195 HD13 LEU 157 3HD1 LEU 157 10.151 -16.202 28.255 1196 HD21 LEU 157 3HD2 LEU 157 10.667 -12.252 27.074 1197 HD22 LEU 157 1HD2 LEU 157 11.693 -13.265 26.057 1198 HD23 LEU 157 2HD2 LEU 157 11.955 -13.213 27.799 Start of MODEL 37 1 H1 MET 1 1HT MET 1 -0.288 -3.009 -33.838 2 H2 MET 1 2HT MET 1 -0.268 -4.656 -33.357 3 H3 MET 1 3HT MET 1 1.015 -3.611 -32.901 4 HA MET 1 HA MET 1 -0.240 -3.800 -31.020 5 HB2 MET 1 2HB MET 1 -0.844 -1.342 -32.640 6 HB3 MET 1 1HB MET 1 -1.483 -1.513 -31.010 7 HG2 MET 1 2HG MET 1 0.459 -0.341 -30.652 8 HG3 MET 1 1HG MET 1 0.970 -2.001 -30.358 9 HE1 MET 1 2HE MET 1 1.592 1.167 -32.895 10 HE2 MET 1 3HE MET 1 3.283 0.799 -32.552 11 HE3 MET 1 1HE MET 1 2.127 0.947 -31.229 12 H HIS 2 H HIS 2 -1.900 -4.946 -30.292 13 HA HIS 2 HA HIS 2 -4.577 -4.450 -31.304 14 HB2 HIS 2 2HB HIS 2 -3.030 -6.758 -32.087 15 HB3 HIS 2 1HB HIS 2 -4.449 -7.258 -31.172 16 HD1 HIS 2 1HD HIS 2 -6.448 -7.615 -32.566 17 HD2 HIS 2 2HD HIS 2 -3.870 -4.833 -34.261 18 HE1 HIS 2 1HE HIS 2 -7.496 -6.978 -34.764 19 HE2 HIS 2 2HE HIS 2 -5.870 -5.367 -35.813 20 H HIS 3 H HIS 3 -6.238 -5.196 -29.908 21 HA HIS 3 HA HIS 3 -5.546 -5.121 -27.156 22 HB2 HIS 3 2HB HIS 3 -8.071 -5.451 -28.711 23 HB3 HIS 3 1HB HIS 3 -8.081 -5.891 -27.006 24 HD1 HIS 3 1HD HIS 3 -6.904 -2.892 -29.049 25 HD2 HIS 3 2HD HIS 3 -8.798 -3.802 -25.464 26 HE1 HIS 3 1HE HIS 3 -7.454 -0.675 -27.998 27 HE2 HIS 3 2HE HIS 3 -8.525 -1.250 -25.792 28 H HIS 4 H HIS 4 -6.165 -6.769 -25.559 29 HA HIS 4 HA HIS 4 -5.237 -9.378 -26.415 30 HB2 HIS 4 2HB HIS 4 -5.388 -9.896 -23.945 31 HB3 HIS 4 1HB HIS 4 -4.287 -8.593 -24.375 32 HD1 HIS 4 1HD HIS 4 -5.052 -6.156 -23.765 33 HD2 HIS 4 2HD HIS 4 -7.503 -9.181 -22.312 34 HE1 HIS 4 1HE HIS 4 -6.508 -5.066 -22.028 35 HE2 HIS 4 2HE HIS 4 -8.043 -6.895 -21.227 36 H HIS 5 H HIS 5 -6.387 -11.312 -25.322 37 HA HIS 5 HA HIS 5 -9.059 -11.377 -26.349 38 HB2 HIS 5 2HB HIS 5 -7.197 -13.342 -25.094 39 HB3 HIS 5 1HB HIS 5 -8.915 -13.725 -25.113 40 HD1 HIS 5 1HD HIS 5 -6.060 -14.445 -26.975 41 HD2 HIS 5 2HD HIS 5 -9.880 -13.183 -28.019 42 HE1 HIS 5 1HE HIS 5 -6.342 -15.080 -29.393 43 HE2 HIS 5 2HE HIS 5 -8.630 -14.235 -30.024 44 H HIS 6 H HIS 6 -10.616 -12.784 -24.746 45 HA HIS 6 HA HIS 6 -12.014 -12.709 -22.955 46 HB2 HIS 6 2HB HIS 6 -9.382 -12.066 -21.823 47 HB3 HIS 6 1HB HIS 6 -10.732 -11.449 -20.876 48 HD1 HIS 6 1HD HIS 6 -10.292 -14.773 -22.684 49 HD2 HIS 6 2HD HIS 6 -11.105 -13.254 -18.903 50 HE1 HIS 6 1HE HIS 6 -10.713 -16.781 -21.230 51 HE2 HIS 6 2HE HIS 6 -11.292 -15.834 -18.967 52 H HIS 7 H HIS 7 -12.982 -11.082 -21.287 53 HA HIS 7 HA HIS 7 -12.722 -8.304 -21.822 54 HB2 HIS 7 2HB HIS 7 -14.701 -9.855 -23.369 55 HB3 HIS 7 1HB HIS 7 -15.325 -8.393 -22.611 56 HD1 HIS 7 1HD HIS 7 -13.300 -6.323 -23.049 57 HD2 HIS 7 2HD HIS 7 -14.029 -9.251 -25.904 58 HE1 HIS 7 1HE HIS 7 -12.467 -5.365 -25.220 59 HE2 HIS 7 2HE HIS 7 -12.841 -7.189 -26.917 60 H MET 8 H MET 8 -15.039 -7.258 -21.017 61 HA MET 8 HA MET 8 -16.366 -6.841 -19.219 62 HB2 MET 8 2HB MET 8 -16.785 -9.491 -19.764 63 HB3 MET 8 1HB MET 8 -16.270 -9.551 -18.074 64 HG2 MET 8 2HG MET 8 -18.017 -7.794 -17.611 65 HG3 MET 8 1HG MET 8 -18.611 -8.078 -19.246 66 HE1 MET 8 3HE MET 8 -19.438 -11.932 -19.026 67 HE2 MET 8 1HE MET 8 -17.719 -11.568 -18.872 68 HE3 MET 8 2HE MET 8 -18.705 -10.683 -20.035 69 H SER 9 H SER 9 -15.693 -5.756 -17.502 70 HA SER 9 HA SER 9 -14.037 -7.003 -15.493 71 HB2 SER 9 2HB SER 9 -12.951 -5.040 -17.432 72 HB3 SER 9 1HB SER 9 -12.522 -4.782 -15.741 73 HG SER 9 HG SER 9 -10.997 -6.150 -16.443 74 H ASP 10 H ASP 10 -14.571 -6.257 -13.537 75 HA ASP 10 HA ASP 10 -16.582 -4.246 -13.282 76 HB2 ASP 10 2HB ASP 10 -15.174 -6.122 -11.476 77 HB3 ASP 10 1HB ASP 10 -15.791 -4.651 -10.728 78 H GLY 11 H GLY 11 -16.398 -2.354 -11.864 79 HA2 GLY 11 2HA GLY 11 -13.991 -1.261 -10.973 80 HA3 GLY 11 1HA GLY 11 -14.230 -0.702 -12.621 81 H HIS 12 H HIS 12 -16.460 -1.218 -9.892 82 HA HIS 12 HA HIS 12 -17.579 1.438 -10.395 83 HB2 HIS 12 2HB HIS 12 -19.438 0.692 -8.935 84 HB3 HIS 12 1HB HIS 12 -19.186 -0.387 -10.314 85 HD1 HIS 12 1HD HIS 12 -19.318 -0.324 -6.647 86 HD2 HIS 12 2HD HIS 12 -17.904 -2.881 -9.601 87 HE1 HIS 12 1HE HIS 12 -18.957 -2.536 -5.504 88 HE2 HIS 12 2HE HIS 12 -18.007 -4.037 -7.290 89 H ASN 13 H ASN 13 -18.509 2.386 -8.177 90 HA ASN 13 HA ASN 13 -18.001 3.514 -6.268 91 HB2 ASN 13 2HB ASN 13 -16.539 0.924 -5.841 92 HB3 ASN 13 1HB ASN 13 -16.416 2.226 -4.662 93 HD21 ASN 13 1HD2 ASN 13 -17.640 1.716 -3.000 94 HD22 ASN 13 2HD2 ASN 13 -19.264 1.133 -3.074 95 H GLY 14 H GLY 14 -16.383 3.905 -8.694 96 HA2 GLY 14 2HA GLY 14 -14.613 5.241 -9.303 97 HA3 GLY 14 1HA GLY 14 -14.425 5.644 -7.593 98 H LEU 15 H LEU 15 -13.335 3.963 -6.244 99 HA LEU 15 HA LEU 15 -11.528 2.671 -5.768 100 HB2 LEU 15 2HB LEU 15 -12.507 1.597 -8.338 101 HB3 LEU 15 1HB LEU 15 -10.849 1.195 -7.937 102 HG LEU 15 HG LEU 15 -13.175 0.672 -6.092 103 HD11 LEU 15 1HD1 LEU 15 -13.672 -0.744 -7.845 104 HD12 LEU 15 2HD1 LEU 15 -12.637 -1.755 -6.836 105 HD13 LEU 15 3HD1 LEU 15 -11.977 -0.977 -8.275 106 HD21 LEU 15 3HD2 LEU 15 -11.707 -0.375 -4.698 107 HD22 LEU 15 1HD2 LEU 15 -10.637 0.856 -5.370 108 HD23 LEU 15 2HD2 LEU 15 -10.592 -0.792 -6.000 109 H GLY 16 H GLY 16 -9.431 3.162 -5.649 110 HA2 GLY 16 2HA GLY 16 -7.429 4.181 -6.089 111 HA3 GLY 16 1HA GLY 16 -7.696 3.725 -7.764 112 H LYS 17 H LYS 17 -9.918 5.801 -6.060 113 HA LYS 17 HA LYS 17 -10.498 7.981 -6.298 114 HB2 LYS 17 2HB LYS 17 -8.172 8.444 -5.642 115 HB3 LYS 17 1HB LYS 17 -7.678 8.331 -7.323 116 HG2 LYS 17 2HG LYS 17 -7.843 10.631 -6.795 117 HG3 LYS 17 1HG LYS 17 -9.227 10.234 -7.817 118 HD2 LYS 17 2HD LYS 17 -10.186 9.772 -5.280 119 HD3 LYS 17 1HD LYS 17 -9.142 11.178 -5.054 120 HE2 LYS 17 2HE LYS 17 -10.492 12.533 -6.249 121 HE3 LYS 17 1HE LYS 17 -10.896 11.273 -7.415 122 HZ1 LYS 17 3HZ LYS 17 -12.882 11.507 -6.361 123 HZ2 LYS 17 1HZ LYS 17 -12.193 11.943 -4.878 124 HZ3 LYS 17 2HZ LYS 17 -12.197 10.323 -5.364 125 H GLY 18 H GLY 18 -8.281 7.620 -9.081 126 HA2 GLY 18 2HA GLY 18 -10.211 7.157 -11.030 127 HA3 GLY 18 1HA GLY 18 -10.076 8.908 -10.858 128 H PHE 19 H PHE 19 -8.288 5.956 -11.646 129 HA PHE 19 HA PHE 19 -6.990 7.088 -13.832 130 HB2 PHE 19 2HB PHE 19 -4.602 6.960 -12.764 131 HB3 PHE 19 1HB PHE 19 -5.569 8.433 -12.631 132 HD1 PHE 19 2HD PHE 19 -4.402 5.432 -10.830 133 HD2 PHE 19 1HD PHE 19 -6.275 9.241 -10.524 134 HE1 PHE 19 2HE PHE 19 -4.148 5.357 -8.383 135 HE2 PHE 19 1HE PHE 19 -6.020 9.175 -8.078 136 HZ PHE 19 HZ PHE 19 -4.956 7.231 -7.005 137 H GLY 20 H GLY 20 -6.429 4.771 -11.184 138 HA2 GLY 20 2HA GLY 20 -5.354 2.879 -13.149 139 HA3 GLY 20 1HA GLY 20 -5.247 2.725 -11.397 140 H ASP 21 H ASP 21 -7.532 2.610 -10.334 141 HA ASP 21 HA ASP 21 -9.607 1.653 -10.142 142 HB2 ASP 21 2HB ASP 21 -9.526 2.041 -12.853 143 HB3 ASP 21 1HB ASP 21 -9.702 0.282 -12.742 144 H HIS 22 H HIS 22 -10.006 -0.143 -9.075 145 HA HIS 22 HA HIS 22 -9.526 -2.104 -8.000 146 HB2 HIS 22 2HB HIS 22 -10.904 -2.608 -10.108 147 HB3 HIS 22 1HB HIS 22 -9.410 -3.265 -10.768 148 HD1 HIS 22 1HD HIS 22 -11.942 -3.869 -8.054 149 HD2 HIS 22 2HD HIS 22 -8.694 -5.764 -9.822 150 HE1 HIS 22 1HE HIS 22 -11.978 -6.224 -7.175 151 HE2 HIS 22 2HE HIS 22 -9.951 -7.325 -8.187 152 H ILE 23 H ILE 23 -7.302 -1.367 -7.382 153 HA ILE 23 HA ILE 23 -5.428 -3.444 -7.921 154 HB ILE 23 HB ILE 23 -4.813 -0.714 -9.049 155 HG12 ILE 23 2HG1 ILE 23 -3.812 -2.881 -10.607 156 HG13 ILE 23 1HG1 ILE 23 -5.481 -3.240 -10.196 157 HG21 ILE 23 1HG2 ILE 23 -3.006 -2.629 -7.756 158 HG22 ILE 23 2HG2 ILE 23 -2.797 -0.914 -8.099 159 HG23 ILE 23 3HG2 ILE 23 -2.492 -2.103 -9.362 160 HD11 ILE 23 3HD1 ILE 23 -6.056 -1.952 -11.907 161 HD12 ILE 23 1HD1 ILE 23 -4.410 -1.344 -12.081 162 HD13 ILE 23 2HD1 ILE 23 -5.518 -0.572 -10.945 163 H HIS 24 H HIS 24 -4.323 -0.180 -7.217 164 HA HIS 24 HA HIS 24 -3.483 -1.040 -4.603 165 HB2 HIS 24 2HB HIS 24 -2.990 1.455 -6.207 166 HB3 HIS 24 1HB HIS 24 -2.489 1.328 -4.519 167 HD1 HIS 24 1HD HIS 24 -0.632 -0.538 -4.024 168 HD2 HIS 24 2HD HIS 24 -1.289 0.348 -8.028 169 HE1 HIS 24 1HE HIS 24 1.363 -1.453 -5.253 170 HE2 HIS 24 2HE HIS 24 0.901 -0.979 -7.682 171 H TRP 25 H TRP 25 -6.254 -0.868 -4.982 172 HA TRP 25 HA TRP 25 -6.971 0.854 -2.785 173 HB2 TRP 25 2HB TRP 25 -8.926 1.601 -4.546 174 HB3 TRP 25 1HB TRP 25 -7.490 2.558 -4.169 175 HD1 TRP 25 HD TRP 25 -8.978 0.346 -6.882 176 HE1 TRP 25 1HE TRP 25 -7.579 0.598 -9.012 177 HE3 TRP 25 3HE TRP 25 -5.128 3.161 -5.058 178 HZ2 TRP 25 2HZ TRP 25 -5.193 1.825 -9.841 179 HZ3 TRP 25 3HZ TRP 25 -3.344 3.833 -6.569 180 HH2 TRP 25 HH TRP 25 -3.362 3.186 -8.927 181 H ARG 26 H ARG 26 -7.056 -2.021 -3.993 182 HA ARG 26 HA ARG 26 -9.576 -2.922 -4.459 183 HB2 ARG 26 2HB ARG 26 -7.113 -4.081 -3.704 184 HB3 ARG 26 1HB ARG 26 -8.329 -4.748 -2.608 185 HG2 ARG 26 2HG ARG 26 -8.728 -4.701 -5.583 186 HG3 ARG 26 1HG ARG 26 -7.863 -6.009 -4.772 187 HD2 ARG 26 2HD ARG 26 -9.933 -6.158 -3.254 188 HD3 ARG 26 1HD ARG 26 -10.741 -5.195 -4.501 189 HE ARG 26 HE ARG 26 -9.397 -7.527 -5.518 190 HH11 ARG 26 1HH1 ARG 26 -12.358 -6.307 -4.131 191 HH12 ARG 26 2HH1 ARG 26 -13.339 -7.565 -4.804 192 HH21 ARG 26 1HH2 ARG 26 -10.687 -9.182 -6.405 193 HH22 ARG 26 2HH2 ARG 26 -12.390 -9.199 -6.094 194 H THR 27 H THR 27 -8.271 -1.759 -1.455 195 HA THR 27 HA THR 27 -9.430 -0.947 0.363 196 HB THR 27 HB THR 27 -11.851 -2.591 -0.293 197 HG1 THR 27 1HG THR 27 -11.192 -0.083 -1.441 198 HG21 THR 27 3HG2 THR 27 -11.233 -0.313 1.423 199 HG22 THR 27 1HG2 THR 27 -12.537 -1.495 1.522 200 HG23 THR 27 2HG2 THR 27 -12.685 -0.109 0.441 201 H LEU 28 H LEU 28 -9.663 -1.684 2.457 202 HA LEU 28 HA LEU 28 -8.459 -4.174 3.026 203 HB2 LEU 28 2HB LEU 28 -9.030 -1.825 4.418 204 HB3 LEU 28 1HB LEU 28 -9.959 -3.069 5.255 205 HG LEU 28 HG LEU 28 -7.193 -3.858 4.684 206 HD11 LEU 28 1HD1 LEU 28 -6.021 -2.309 5.838 207 HD12 LEU 28 2HD1 LEU 28 -7.367 -1.930 6.913 208 HD13 LEU 28 3HD1 LEU 28 -7.321 -1.253 5.284 209 HD21 LEU 28 3HD2 LEU 28 -8.605 -5.183 6.103 210 HD22 LEU 28 1HD2 LEU 28 -8.935 -3.797 7.142 211 HD23 LEU 28 2HD2 LEU 28 -7.312 -4.488 7.082 212 H GLU 29 H GLU 29 -11.764 -3.190 2.633 213 HA GLU 29 HA GLU 29 -13.095 -5.154 4.088 214 HB2 GLU 29 2HB GLU 29 -13.757 -3.214 2.089 215 HB3 GLU 29 1HB GLU 29 -14.536 -4.735 1.675 216 HG2 GLU 29 2HG GLU 29 -14.854 -4.227 4.471 217 HG3 GLU 29 1HG GLU 29 -15.364 -2.817 3.547 218 H ASP 30 H ASP 30 -12.903 -5.273 0.542 219 HA ASP 30 HA ASP 30 -13.169 -8.113 0.509 220 HB2 ASP 30 2HB ASP 30 -13.703 -6.191 -1.308 221 HB3 ASP 30 1HB ASP 30 -12.127 -6.734 -1.904 222 H GLY 31 H GLY 31 -10.503 -5.905 0.590 223 HA2 GLY 31 2HA GLY 31 -8.511 -7.645 -0.460 224 HA3 GLY 31 1HA GLY 31 -8.227 -6.204 0.522 225 H LYS 32 H LYS 32 -9.823 -7.133 2.761 226 HA LYS 32 HA LYS 32 -7.798 -8.647 4.100 227 HB2 LYS 32 2HB LYS 32 -9.081 -6.932 5.281 228 HB3 LYS 32 1HB LYS 32 -10.568 -7.828 5.000 229 HG2 LYS 32 2HG LYS 32 -10.168 -9.277 6.672 230 HG3 LYS 32 1HG LYS 32 -8.430 -9.318 6.365 231 HD2 LYS 32 2HD LYS 32 -8.141 -7.197 7.482 232 HD3 LYS 32 1HD LYS 32 -9.887 -7.028 7.682 233 HE2 LYS 32 2HE LYS 32 -9.571 -9.387 8.876 234 HE3 LYS 32 1HE LYS 32 -7.956 -8.734 9.150 235 HZ1 LYS 32 3HZ LYS 32 -9.086 -6.718 10.072 236 HZ2 LYS 32 1HZ LYS 32 -9.271 -8.125 10.995 237 HZ3 LYS 32 2HZ LYS 32 -10.541 -7.578 10.020 238 H LYS 33 H LYS 33 -11.026 -9.316 2.853 239 HA LYS 33 HA LYS 33 -11.232 -11.938 3.912 240 HB2 LYS 33 2HB LYS 33 -13.169 -10.584 3.154 241 HB3 LYS 33 1HB LYS 33 -12.618 -10.766 1.495 242 HG2 LYS 33 2HG LYS 33 -12.742 -13.328 2.084 243 HG3 LYS 33 1HG LYS 33 -13.888 -12.750 3.307 244 HD2 LYS 33 2HD LYS 33 -15.435 -12.144 1.758 245 HD3 LYS 33 1HD LYS 33 -14.219 -11.691 0.562 246 HE2 LYS 33 2HE LYS 33 -14.736 -13.590 -0.487 247 HE3 LYS 33 1HE LYS 33 -13.888 -14.419 0.818 248 HZ1 LYS 33 3HZ LYS 33 -15.962 -14.650 2.001 249 HZ2 LYS 33 1HZ LYS 33 -16.124 -15.301 0.446 250 HZ3 LYS 33 2HZ LYS 33 -16.791 -13.789 0.804 251 H GLU 34 H GLU 34 -9.619 -10.613 1.156 252 HA GLU 34 HA GLU 34 -9.299 -13.245 -0.072 253 HB2 GLU 34 2HB GLU 34 -9.870 -11.329 -1.516 254 HB3 GLU 34 1HB GLU 34 -8.367 -10.540 -1.038 255 HG2 GLU 34 2HG GLU 34 -7.136 -11.762 -2.438 256 HG3 GLU 34 1HG GLU 34 -8.008 -13.254 -2.055 257 H ALA 35 H ALA 35 -7.145 -10.519 0.757 258 HA ALA 35 HA ALA 35 -4.711 -11.704 0.480 259 HB1 ALA 35 1HB ALA 35 -4.677 -9.447 1.031 260 HB2 ALA 35 2HB ALA 35 -4.008 -10.224 2.465 261 HB3 ALA 35 3HB ALA 35 -5.686 -9.677 2.457 262 H ALA 36 H ALA 36 -7.029 -12.241 3.026 263 HA ALA 36 HA ALA 36 -5.305 -13.567 4.847 264 HB1 ALA 36 1HB ALA 36 -8.297 -13.604 4.498 265 HB2 ALA 36 2HB ALA 36 -7.354 -12.676 5.667 266 HB3 ALA 36 3HB ALA 36 -7.458 -14.431 5.812 267 H ALA 37 H ALA 37 -7.531 -14.734 2.337 268 HA ALA 37 HA ALA 37 -6.875 -17.492 2.793 269 HB1 ALA 37 1HB ALA 37 -8.456 -18.002 1.181 270 HB2 ALA 37 2HB ALA 37 -8.195 -16.498 0.300 271 HB3 ALA 37 3HB ALA 37 -9.061 -16.481 1.836 272 H SER 38 H SER 38 -6.358 -15.305 0.019 273 HA SER 38 HA SER 38 -4.661 -17.000 -1.414 274 HB2 SER 38 2HB SER 38 -5.273 -14.090 -1.444 275 HB3 SER 38 1HB SER 38 -3.782 -14.603 -2.251 276 HG SER 38 HG SER 38 -6.141 -14.656 -3.278 277 H GLY 39 H GLY 39 -3.751 -14.194 0.599 278 HA2 GLY 39 2HA GLY 39 -1.993 -14.420 2.256 279 HA3 GLY 39 1HA GLY 39 -1.210 -15.584 1.181 280 H LEU 40 H LEU 40 -2.508 -12.290 0.737 281 HA LEU 40 HA LEU 40 0.162 -11.479 -0.205 282 HB2 LEU 40 2HB LEU 40 -1.207 -9.850 -1.706 283 HB3 LEU 40 1HB LEU 40 -0.946 -11.504 -2.221 284 HG LEU 40 HG LEU 40 -3.275 -11.896 -1.039 285 HD11 LEU 40 1HD1 LEU 40 -3.219 -9.441 -0.307 286 HD12 LEU 40 2HD1 LEU 40 -4.720 -10.083 -0.976 287 HD13 LEU 40 3HD1 LEU 40 -3.662 -9.085 -1.974 288 HD21 LEU 40 3HD2 LEU 40 -2.664 -12.181 -3.460 289 HD22 LEU 40 1HD2 LEU 40 -3.187 -10.514 -3.705 290 HD23 LEU 40 2HD2 LEU 40 -4.338 -11.726 -3.146 291 HA PRO 41 HA PRO 41 -0.302 -8.246 2.784 292 HB2 PRO 41 2HB PRO 41 1.661 -6.593 2.019 293 HB3 PRO 41 1HB PRO 41 2.011 -8.194 2.685 294 HG2 PRO 41 2HG PRO 41 1.891 -7.331 -0.182 295 HG3 PRO 41 1HG PRO 41 3.141 -8.285 0.634 296 HD2 PRO 41 2HD PRO 41 1.184 -9.420 -0.856 297 HD3 PRO 41 1HD PRO 41 1.878 -10.219 0.570 298 H LEU 42 H LEU 42 -0.271 -5.730 2.824 299 HA LEU 42 HA LEU 42 -1.984 -4.790 0.633 300 HB2 LEU 42 2HB LEU 42 -2.543 -4.943 3.340 301 HB3 LEU 42 1HB LEU 42 -2.161 -3.252 3.082 302 HG LEU 42 HG LEU 42 -3.883 -3.857 0.992 303 HD11 LEU 42 1HD1 LEU 42 -4.332 -6.004 2.269 304 HD12 LEU 42 2HD1 LEU 42 -5.736 -5.017 1.859 305 HD13 LEU 42 3HD1 LEU 42 -5.089 -4.990 3.499 306 HD21 LEU 42 3HD2 LEU 42 -4.338 -1.833 1.847 307 HD22 LEU 42 1HD2 LEU 42 -3.904 -2.317 3.487 308 HD23 LEU 42 2HD2 LEU 42 -5.501 -2.708 2.844 309 H MET 43 H MET 43 -1.174 -3.279 -0.608 310 HA MET 43 HA MET 43 1.108 -1.697 0.323 311 HB2 MET 43 2HB MET 43 1.446 -2.876 -1.763 312 HB3 MET 43 1HB MET 43 -0.036 -2.188 -2.441 313 HG2 MET 43 2HG MET 43 1.415 -0.758 -3.395 314 HG3 MET 43 1HG MET 43 1.306 0.068 -1.844 315 HE1 MET 43 3HE MET 43 3.092 -1.501 0.216 316 HE2 MET 43 1HE MET 43 3.029 0.227 -0.129 317 HE3 MET 43 2HE MET 43 4.581 -0.608 -0.091 318 H VAL 44 H VAL 44 -0.404 -0.434 1.689 319 HA VAL 44 HA VAL 44 -2.494 1.118 0.693 320 HB VAL 44 HB VAL 44 -0.662 1.790 2.993 321 HG11 VAL 44 1HG1 VAL 44 -3.501 2.636 2.924 322 HG12 VAL 44 2HG1 VAL 44 -2.363 3.530 1.919 323 HG13 VAL 44 3HG1 VAL 44 -2.103 3.417 3.659 324 HG21 VAL 44 3HG2 VAL 44 -2.048 0.553 4.387 325 HG22 VAL 44 1HG2 VAL 44 -1.879 -0.463 2.956 326 HG23 VAL 44 2HG2 VAL 44 -3.350 0.491 3.192 327 H ILE 45 H ILE 45 -1.890 1.998 -1.290 328 HA ILE 45 HA ILE 45 0.310 3.850 -1.508 329 HB ILE 45 HB ILE 45 -1.959 3.165 -3.385 330 HG12 ILE 45 2HG1 ILE 45 0.772 2.126 -2.940 331 HG13 ILE 45 1HG1 ILE 45 -0.667 1.312 -3.558 332 HG21 ILE 45 1HG2 ILE 45 -1.217 5.461 -3.762 333 HG22 ILE 45 2HG2 ILE 45 -0.791 4.411 -5.111 334 HG23 ILE 45 3HG2 ILE 45 0.441 4.898 -3.951 335 HD11 ILE 45 3HD1 ILE 45 -0.307 2.328 -5.742 336 HD12 ILE 45 1HD1 ILE 45 1.106 1.410 -5.225 337 HD13 ILE 45 2HD1 ILE 45 1.114 3.168 -5.126 338 H ILE 46 H ILE 46 0.140 5.884 -0.571 339 HA ILE 46 HA ILE 46 -2.525 7.125 -0.788 340 HB ILE 46 HB ILE 46 -0.530 7.468 1.439 341 HG12 ILE 46 2HG1 ILE 46 -3.256 6.496 1.970 342 HG13 ILE 46 1HG1 ILE 46 -2.263 5.393 1.018 343 HG21 ILE 46 1HG2 ILE 46 -2.663 8.629 2.426 344 HG22 ILE 46 2HG2 ILE 46 -3.051 8.886 0.725 345 HG23 ILE 46 3HG2 ILE 46 -1.551 9.525 1.392 346 HD11 ILE 46 3HD1 ILE 46 -2.318 5.378 3.678 347 HD12 ILE 46 1HD1 ILE 46 -1.039 6.567 3.442 348 HD13 ILE 46 2HD1 ILE 46 -0.877 4.951 2.755 349 H HIS 47 H HIS 47 -2.708 9.241 -1.199 350 HA HIS 47 HA HIS 47 -0.330 10.818 -1.822 351 HB2 HIS 47 2HB HIS 47 -2.680 10.721 -3.717 352 HB3 HIS 47 1HB HIS 47 -1.086 11.430 -3.989 353 HD1 HIS 47 1HD HIS 47 0.715 9.924 -4.918 354 HD2 HIS 47 2HD HIS 47 -2.755 7.873 -3.911 355 HE1 HIS 47 1HE HIS 47 0.984 7.628 -5.904 356 HE2 HIS 47 2HE HIS 47 -1.223 6.495 -5.476 357 H LYS 48 H LYS 48 -1.539 11.232 0.430 358 HA LYS 48 HA LYS 48 -3.921 12.795 0.306 359 HB2 LYS 48 2HB LYS 48 -1.936 12.108 2.402 360 HB3 LYS 48 1HB LYS 48 -2.938 13.525 2.686 361 HG2 LYS 48 2HG LYS 48 -4.939 12.225 2.517 362 HG3 LYS 48 1HG LYS 48 -4.033 10.810 1.985 363 HD2 LYS 48 2HD LYS 48 -3.483 10.236 4.079 364 HD3 LYS 48 1HD LYS 48 -3.109 11.899 4.533 365 HE2 LYS 48 2HE LYS 48 -5.250 12.332 5.225 366 HE3 LYS 48 1HE LYS 48 -5.960 11.130 4.155 367 HZ1 LYS 48 3HZ LYS 48 -5.876 9.610 5.754 368 HZ2 LYS 48 1HZ LYS 48 -5.473 10.847 6.836 369 HZ3 LYS 48 2HZ LYS 48 -4.252 9.934 6.102 370 H SER 49 H SER 49 -4.263 14.929 0.116 371 HA SER 49 HA SER 49 -3.891 17.144 -0.259 372 HB2 SER 49 2HB SER 49 -2.264 16.658 1.806 373 HB3 SER 49 1HB SER 49 -1.039 17.027 0.594 374 HG SER 49 HG SER 49 -3.186 18.672 1.442 375 H TRP 50 H TRP 50 -2.031 18.638 -1.367 376 HA TRP 50 HA TRP 50 -1.915 17.938 -4.020 377 HB2 TRP 50 2HB TRP 50 0.049 19.568 -4.150 378 HB3 TRP 50 1HB TRP 50 -1.457 20.194 -3.464 379 HD1 TRP 50 HD TRP 50 2.134 19.309 -2.512 380 HE1 TRP 50 1HE TRP 50 2.636 20.283 -0.184 381 HE3 TRP 50 3HE TRP 50 -2.573 20.851 -1.246 382 HZ2 TRP 50 2HZ TRP 50 1.224 21.541 1.913 383 HZ3 TRP 50 3HZ TRP 50 -2.912 21.930 0.940 384 HH2 TRP 50 HH TRP 50 -1.052 22.266 2.486 385 H CYS 51 H CYS 51 -0.551 16.803 -5.336 386 HA CYS 51 HA CYS 51 2.025 15.915 -4.484 387 HB2 CYS 51 2HB CYS 51 1.440 14.037 -3.424 388 HB3 CYS 51 1HB CYS 51 -0.254 14.313 -3.792 389 H GLY 52 H GLY 52 3.240 14.988 -6.173 390 HA2 GLY 52 2HA GLY 52 2.012 15.317 -8.831 391 HA3 GLY 52 1HA GLY 52 3.745 15.339 -8.494 392 H ALA 53 H ALA 53 3.675 12.985 -6.799 393 HA ALA 53 HA ALA 53 4.171 10.986 -8.682 394 HB1 ALA 53 1HB ALA 53 3.645 10.909 -5.734 395 HB2 ALA 53 2HB ALA 53 5.166 10.666 -6.594 396 HB3 ALA 53 3HB ALA 53 3.909 9.429 -6.657 397 H CYS 54 H CYS 54 1.236 12.213 -7.595 398 HA CYS 54 HA CYS 54 -0.210 9.798 -8.315 399 HB2 CYS 54 2HB CYS 54 -2.221 11.265 -7.523 400 HB3 CYS 54 1HB CYS 54 -1.126 10.579 -6.318 401 H LYS 55 H LYS 55 0.335 13.121 -9.249 402 HA LYS 55 HA LYS 55 -1.669 13.293 -11.232 403 HB2 LYS 55 2HB LYS 55 0.450 14.944 -10.244 404 HB3 LYS 55 1HB LYS 55 0.529 14.912 -12.001 405 HG2 LYS 55 2HG LYS 55 -1.765 15.646 -12.163 406 HG3 LYS 55 1HG LYS 55 -1.937 15.575 -10.400 407 HD2 LYS 55 2HD LYS 55 0.028 17.235 -10.355 408 HD3 LYS 55 1HD LYS 55 -0.323 17.486 -12.066 409 HE2 LYS 55 2HE LYS 55 -2.484 17.689 -9.999 410 HE3 LYS 55 1HE LYS 55 -1.415 19.052 -10.326 411 HZ1 LYS 55 3HZ LYS 55 -3.642 18.793 -11.612 412 HZ2 LYS 55 1HZ LYS 55 -2.757 17.720 -12.573 413 HZ3 LYS 55 2HZ LYS 55 -2.257 19.328 -12.422 414 H ALA 56 H ALA 56 1.771 12.356 -11.358 415 HA ALA 56 HA ALA 56 1.699 11.845 -14.183 416 HB1 ALA 56 1HB ALA 56 3.732 10.503 -12.498 417 HB2 ALA 56 2HB ALA 56 3.724 12.267 -12.485 418 HB3 ALA 56 3HB ALA 56 3.921 11.396 -14.006 419 H LEU 57 H LEU 57 0.745 10.170 -11.367 420 HA LEU 57 HA LEU 57 0.963 7.510 -12.352 421 HB2 LEU 57 2HB LEU 57 -0.135 8.862 -9.988 422 HB3 LEU 57 1HB LEU 57 -0.974 7.392 -10.438 423 HG LEU 57 HG LEU 57 1.054 7.375 -8.743 424 HD11 LEU 57 1HD1 LEU 57 1.096 5.182 -10.754 425 HD12 LEU 57 2HD1 LEU 57 -0.388 5.491 -9.851 426 HD13 LEU 57 3HD1 LEU 57 1.102 5.103 -8.991 427 HD21 LEU 57 3HD2 LEU 57 2.453 8.327 -10.800 428 HD22 LEU 57 1HD2 LEU 57 2.622 6.605 -11.136 429 HD23 LEU 57 2HD2 LEU 57 3.160 7.256 -9.589 430 H LYS 58 H LYS 58 -1.361 10.052 -12.761 431 HA LYS 58 HA LYS 58 -3.602 8.451 -13.312 432 HB2 LYS 58 2HB LYS 58 -2.899 11.274 -14.042 433 HB3 LYS 58 1HB LYS 58 -4.393 10.533 -14.593 434 HG2 LYS 58 2HG LYS 58 -4.550 9.959 -11.983 435 HG3 LYS 58 1HG LYS 58 -3.594 11.440 -11.903 436 HD2 LYS 58 2HD LYS 58 -6.070 11.332 -13.581 437 HD3 LYS 58 1HD LYS 58 -6.189 11.580 -11.838 438 HE2 LYS 58 2HE LYS 58 -6.151 13.701 -13.089 439 HE3 LYS 58 1HE LYS 58 -4.784 13.544 -11.986 440 HZ1 LYS 58 3HZ LYS 58 -4.527 12.756 -14.817 441 HZ2 LYS 58 1HZ LYS 58 -3.315 13.202 -13.724 442 HZ3 LYS 58 2HZ LYS 58 -4.357 14.374 -14.357 443 HA PRO 59 HA PRO 59 -2.575 8.649 -17.955 444 HB2 PRO 59 2HB PRO 59 -0.045 9.892 -18.475 445 HB3 PRO 59 1HB PRO 59 -1.663 10.475 -18.898 446 HG2 PRO 59 2HG PRO 59 0.022 11.654 -17.050 447 HG3 PRO 59 1HG PRO 59 -1.730 11.892 -17.128 448 HD2 PRO 59 2HD PRO 59 -0.124 10.142 -15.316 449 HD3 PRO 59 1HD PRO 59 -1.603 11.071 -14.982 450 H LYS 60 H LYS 60 -0.049 7.939 -15.703 451 HA LYS 60 HA LYS 60 1.219 6.076 -17.576 452 HB2 LYS 60 2HB LYS 60 3.066 6.009 -16.137 453 HB3 LYS 60 1HB LYS 60 2.529 7.684 -16.065 454 HG2 LYS 60 2HG LYS 60 1.179 6.951 -14.031 455 HG3 LYS 60 1HG LYS 60 2.182 5.512 -14.024 456 HD2 LYS 60 2HD LYS 60 2.739 7.977 -12.819 457 HD3 LYS 60 1HD LYS 60 3.823 6.607 -12.987 458 HE2 LYS 60 2HE LYS 60 3.526 8.834 -15.004 459 HE3 LYS 60 1HE LYS 60 4.792 8.743 -13.784 460 HZ1 LYS 60 3HZ LYS 60 4.754 6.320 -15.184 461 HZ2 LYS 60 1HZ LYS 60 5.970 7.496 -15.157 462 HZ3 LYS 60 2HZ LYS 60 4.747 7.569 -16.323 463 H PHE 61 H PHE 61 -0.326 6.119 -14.362 464 HA PHE 61 HA PHE 61 -0.149 3.319 -14.021 465 HB2 PHE 61 2HB PHE 61 -0.513 5.039 -12.181 466 HB3 PHE 61 1HB PHE 61 -2.197 5.099 -12.714 467 HD1 PHE 61 1HD PHE 61 -3.518 2.941 -12.695 468 HD2 PHE 61 2HD PHE 61 0.231 3.369 -10.742 469 HE1 PHE 61 1HE PHE 61 -4.023 0.970 -11.313 470 HE2 PHE 61 2HE PHE 61 -0.261 1.400 -9.353 471 HZ PHE 61 HZ PHE 61 -2.388 0.199 -9.640 472 H ALA 62 H ALA 62 -2.161 5.385 -15.885 473 HA ALA 62 HA ALA 62 -4.472 3.803 -16.103 474 HB1 ALA 62 1HB ALA 62 -4.999 5.551 -17.398 475 HB2 ALA 62 2HB ALA 62 -3.950 4.885 -18.649 476 HB3 ALA 62 3HB ALA 62 -3.308 6.044 -17.485 477 H GLU 63 H GLU 63 -1.249 3.398 -17.056 478 HA GLU 63 HA GLU 63 -1.544 1.474 -19.145 479 HB2 GLU 63 2HB GLU 63 0.432 3.065 -18.648 480 HB3 GLU 63 1HB GLU 63 0.881 1.900 -17.399 481 HG2 GLU 63 2HG GLU 63 1.950 0.704 -18.921 482 HG3 GLU 63 1HG GLU 63 0.433 0.437 -19.776 483 H SER 64 H SER 64 -1.839 1.422 -15.794 484 HA SER 64 HA SER 64 -0.839 -1.046 -15.046 485 HB2 SER 64 2HB SER 64 -3.147 0.577 -14.028 486 HB3 SER 64 1HB SER 64 -2.620 -0.900 -13.243 487 HG SER 64 HG SER 64 -0.922 1.311 -13.757 488 H THR 65 H THR 65 -3.003 -0.688 -17.483 489 HA THR 65 HA THR 65 -5.118 -2.372 -17.025 490 HB THR 65 HB THR 65 -3.723 -2.853 -19.588 491 HG1 THR 65 1HG THR 65 -3.095 -0.807 -19.579 492 HG21 THR 65 3HG2 THR 65 -6.450 -1.738 -18.994 493 HG22 THR 65 1HG2 THR 65 -6.078 -3.442 -19.252 494 HG23 THR 65 2HG2 THR 65 -5.847 -2.282 -20.561 495 H GLU 66 H GLU 66 -1.758 -3.139 -17.679 496 HA GLU 66 HA GLU 66 -2.211 -5.996 -17.572 497 HB2 GLU 66 2HB GLU 66 -0.188 -4.389 -18.615 498 HB3 GLU 66 1HB GLU 66 0.554 -5.141 -17.199 499 HG2 GLU 66 2HG GLU 66 -0.703 -7.256 -18.381 500 HG3 GLU 66 1HG GLU 66 -0.200 -6.298 -19.772 501 H ILE 67 H ILE 67 -1.263 -3.386 -15.457 502 HA ILE 67 HA ILE 67 -0.361 -5.088 -13.344 503 HB ILE 67 HB ILE 67 -1.409 -2.263 -13.131 504 HG12 ILE 67 2HG1 ILE 67 1.453 -3.197 -13.443 505 HG13 ILE 67 1HG1 ILE 67 0.476 -2.511 -14.750 506 HG21 ILE 67 1HG2 ILE 67 -1.311 -2.899 -10.949 507 HG22 ILE 67 2HG2 ILE 67 0.375 -2.429 -11.171 508 HG23 ILE 67 3HG2 ILE 67 -0.085 -4.130 -11.249 509 HD11 ILE 67 3HD1 ILE 67 2.052 -1.174 -12.804 510 HD12 ILE 67 1HD1 ILE 67 0.365 -0.719 -12.564 511 HD13 ILE 67 2HD1 ILE 67 1.124 -0.491 -14.140 512 H SER 68 H SER 68 -3.404 -4.357 -14.655 513 HA SER 68 HA SER 68 -5.002 -4.550 -12.312 514 HB2 SER 68 2HB SER 68 -5.726 -3.682 -14.609 515 HB3 SER 68 1HB SER 68 -5.855 -5.372 -15.095 516 HG SER 68 HG SER 68 -7.169 -4.340 -12.812 517 H GLU 69 H GLU 69 -3.575 -6.819 -14.545 518 HA GLU 69 HA GLU 69 -4.912 -9.105 -13.418 519 HB2 GLU 69 2HB GLU 69 -2.479 -9.153 -15.195 520 HB3 GLU 69 1HB GLU 69 -3.689 -10.412 -14.987 521 HG2 GLU 69 2HG GLU 69 -4.227 -7.729 -16.235 522 HG3 GLU 69 1HG GLU 69 -3.847 -9.194 -17.138 523 H LEU 70 H LEU 70 -1.703 -7.639 -13.331 524 HA LEU 70 HA LEU 70 -0.465 -9.562 -11.685 525 HB2 LEU 70 2HB LEU 70 0.060 -6.703 -12.363 526 HB3 LEU 70 1HB LEU 70 0.926 -7.411 -11.002 527 HG LEU 70 HG LEU 70 1.600 -9.267 -12.668 528 HD11 LEU 70 1HD1 LEU 70 0.852 -7.078 -14.605 529 HD12 LEU 70 2HD1 LEU 70 0.014 -8.621 -14.423 530 HD13 LEU 70 3HD1 LEU 70 1.681 -8.586 -14.997 531 HD21 LEU 70 3HD2 LEU 70 2.811 -6.622 -13.344 532 HD22 LEU 70 1HD2 LEU 70 3.595 -8.176 -13.055 533 HD23 LEU 70 2HD2 LEU 70 2.944 -7.250 -11.700 534 H SER 71 H SER 71 -2.715 -7.028 -11.008 535 HA SER 71 HA SER 71 -2.169 -6.719 -8.235 536 HB2 SER 71 2HB SER 71 -3.799 -5.456 -10.097 537 HB3 SER 71 1HB SER 71 -4.926 -6.222 -8.978 538 HG SER 71 HG SER 71 -2.735 -4.672 -8.089 539 H HIS 72 H HIS 72 -4.028 -9.005 -10.080 540 HA HIS 72 HA HIS 72 -5.797 -9.905 -8.105 541 HB2 HIS 72 2HB HIS 72 -4.535 -11.287 -10.476 542 HB3 HIS 72 1HB HIS 72 -5.701 -12.099 -9.420 543 HD1 HIS 72 1HD HIS 72 -5.794 -10.838 -12.562 544 HD2 HIS 72 2HD HIS 72 -7.994 -9.848 -9.178 545 HE1 HIS 72 1HE HIS 72 -7.896 -9.756 -13.419 546 HE2 HIS 72 2HE HIS 72 -9.166 -9.081 -11.352 547 H ASN 73 H ASN 73 -2.440 -10.080 -8.301 548 HA ASN 73 HA ASN 73 -2.196 -12.443 -6.632 549 HB2 ASN 73 2HB ASN 73 0.009 -10.655 -7.652 550 HB3 ASN 73 1HB ASN 73 0.114 -12.333 -7.127 551 HD21 ASN 73 1HD2 ASN 73 -0.098 -10.311 -9.747 552 HD22 ASN 73 2HD2 ASN 73 -0.581 -11.476 -10.948 553 H PHE 74 H PHE 74 -2.332 -9.031 -6.286 554 HA PHE 74 HA PHE 74 -1.542 -9.266 -3.473 555 HB2 PHE 74 2HB PHE 74 -0.339 -7.593 -5.580 556 HB3 PHE 74 1HB PHE 74 -0.744 -6.727 -4.095 557 HD1 PHE 74 2HD PHE 74 0.706 -10.077 -4.895 558 HD2 PHE 74 1HD PHE 74 1.073 -6.431 -2.735 559 HE1 PHE 74 2HE PHE 74 2.775 -10.904 -3.866 560 HE2 PHE 74 1HE PHE 74 3.153 -7.252 -1.706 561 HZ PHE 74 HZ PHE 74 4.006 -9.490 -2.270 562 H VAL 75 H VAL 75 -2.176 -7.084 -2.305 563 HA VAL 75 HA VAL 75 -4.599 -5.918 -3.449 564 HB VAL 75 HB VAL 75 -5.271 -7.922 -2.052 565 HG11 VAL 75 1HG1 VAL 75 -5.187 -7.790 0.328 566 HG12 VAL 75 2HG1 VAL 75 -4.508 -6.168 0.271 567 HG13 VAL 75 3HG1 VAL 75 -3.551 -7.540 -0.279 568 HG21 VAL 75 3HG2 VAL 75 -6.642 -5.914 -0.572 569 HG22 VAL 75 1HG2 VAL 75 -7.209 -6.859 -1.948 570 HG23 VAL 75 2HG2 VAL 75 -6.375 -5.328 -2.214 571 H MET 76 H MET 76 -4.341 -3.757 -3.278 572 HA MET 76 HA MET 76 -2.885 -2.757 -0.947 573 HB2 MET 76 2HB MET 76 -2.841 -0.896 -3.115 574 HB3 MET 76 1HB MET 76 -1.511 -1.670 -2.286 575 HG2 MET 76 2HG MET 76 -3.062 -2.993 -4.491 576 HG3 MET 76 1HG MET 76 -1.589 -2.079 -4.756 577 HE1 MET 76 3HE MET 76 -1.247 -5.231 -5.802 578 HE2 MET 76 1HE MET 76 0.413 -5.061 -5.229 579 HE3 MET 76 2HE MET 76 -0.437 -3.668 -5.901 580 H VAL 77 H VAL 77 -3.317 -0.136 -0.955 581 HA VAL 77 HA VAL 77 -6.198 0.320 -1.170 582 HB VAL 77 HB VAL 77 -4.655 0.097 1.348 583 HG11 VAL 77 1HG1 VAL 77 -5.120 2.215 1.943 584 HG12 VAL 77 2HG1 VAL 77 -6.697 1.523 2.319 585 HG13 VAL 77 3HG1 VAL 77 -6.452 2.373 0.796 586 HG21 VAL 77 3HG2 VAL 77 -6.575 -0.989 2.123 587 HG22 VAL 77 1HG2 VAL 77 -6.418 -1.490 0.436 588 HG23 VAL 77 2HG2 VAL 77 -7.593 -0.251 0.886 589 H ASN 78 H ASN 78 -6.741 2.358 -1.703 590 HA ASN 78 HA ASN 78 -4.605 4.362 -1.803 591 HB2 ASN 78 2HB ASN 78 -5.995 3.462 -3.879 592 HB3 ASN 78 1HB ASN 78 -7.113 4.709 -3.356 593 HD21 ASN 78 1HD2 ASN 78 -3.584 4.603 -3.325 594 HD22 ASN 78 2HD2 ASN 78 -3.356 6.006 -4.322 595 H LEU 79 H LEU 79 -4.718 5.892 -0.334 596 HA LEU 79 HA LEU 79 -7.386 6.798 0.548 597 HB2 LEU 79 2HB LEU 79 -6.698 6.416 2.632 598 HB3 LEU 79 1HB LEU 79 -5.087 6.013 2.079 599 HG LEU 79 HG LEU 79 -4.552 8.471 2.108 600 HD11 LEU 79 1HD1 LEU 79 -6.077 10.025 2.545 601 HD12 LEU 79 2HD1 LEU 79 -6.630 9.171 3.986 602 HD13 LEU 79 3HD1 LEU 79 -7.296 8.758 2.406 603 HD21 LEU 79 3HD2 LEU 79 -4.459 8.587 4.624 604 HD22 LEU 79 1HD2 LEU 79 -3.738 7.151 3.897 605 HD23 LEU 79 2HD2 LEU 79 -5.334 7.056 4.642 606 H GLU 80 H GLU 80 -7.845 8.968 0.483 607 HA GLU 80 HA GLU 80 -6.003 11.051 0.274 608 HB2 GLU 80 2HB GLU 80 -6.430 11.623 -2.186 609 HB3 GLU 80 1HB GLU 80 -5.283 10.322 -1.842 610 HG2 GLU 80 2HG GLU 80 -6.967 8.661 -2.347 611 HG3 GLU 80 1HG GLU 80 -8.175 9.933 -2.604 612 H ASP 81 H ASP 81 -7.924 11.268 1.814 613 HA ASP 81 HA ASP 81 -9.924 12.945 0.476 614 HB2 ASP 81 2HB ASP 81 -11.496 11.975 2.398 615 HB3 ASP 81 1HB ASP 81 -11.356 11.193 0.826 616 H GLU 82 H GLU 82 -9.275 11.893 3.820 617 HA GLU 82 HA GLU 82 -9.847 14.357 5.001 618 HB2 GLU 82 2HB GLU 82 -7.840 12.405 6.115 619 HB3 GLU 82 1HB GLU 82 -8.915 13.481 6.997 620 HG2 GLU 82 2HG GLU 82 -10.820 12.120 5.970 621 HG3 GLU 82 1HG GLU 82 -9.577 10.939 5.560 622 H GLU 83 H GLU 83 -6.876 13.070 3.657 623 HA GLU 83 HA GLU 83 -4.929 14.054 3.036 624 HB2 GLU 83 2HB GLU 83 -6.366 16.642 3.609 625 HB3 GLU 83 1HB GLU 83 -4.858 16.479 2.724 626 HG2 GLU 83 2HG GLU 83 -5.895 15.922 0.831 627 HG3 GLU 83 1HG GLU 83 -7.016 14.835 1.657 628 H GLU 84 H GLU 84 -5.960 13.872 6.070 629 HA GLU 84 HA GLU 84 -3.392 14.452 7.156 630 HB2 GLU 84 2HB GLU 84 -5.475 16.481 7.323 631 HB3 GLU 84 1HB GLU 84 -4.905 15.990 8.912 632 HG2 GLU 84 2HG GLU 84 -3.091 16.863 6.678 633 HG3 GLU 84 1HG GLU 84 -3.718 17.945 7.922 634 HA PRO 85 HA PRO 85 -5.665 11.193 9.430 635 HB2 PRO 85 2HB PRO 85 -3.609 9.472 9.624 636 HB3 PRO 85 1HB PRO 85 -4.566 9.624 8.136 637 HG2 PRO 85 2HG PRO 85 -1.887 10.796 8.803 638 HG3 PRO 85 1HG PRO 85 -2.433 10.025 7.295 639 HD2 PRO 85 2HD PRO 85 -2.311 12.736 7.656 640 HD3 PRO 85 1HD PRO 85 -3.446 11.940 6.540 641 H LYS 86 H LYS 86 -4.452 9.784 11.370 642 HA LYS 86 HA LYS 86 -3.027 11.694 13.076 643 HB2 LYS 86 2HB LYS 86 -5.625 11.513 13.449 644 HB3 LYS 86 1HB LYS 86 -5.193 10.015 14.282 645 HG2 LYS 86 2HG LYS 86 -4.572 11.132 16.090 646 HG3 LYS 86 1HG LYS 86 -3.489 12.160 15.149 647 HD2 LYS 86 2HD LYS 86 -6.397 12.720 14.972 648 HD3 LYS 86 1HD LYS 86 -5.585 13.126 16.484 649 HE2 LYS 86 2HE LYS 86 -3.952 14.464 15.253 650 HE3 LYS 86 1HE LYS 86 -4.753 14.053 13.738 651 HZ1 LYS 86 3HZ LYS 86 -5.552 15.931 15.809 652 HZ2 LYS 86 1HZ LYS 86 -6.801 15.040 15.095 653 HZ3 LYS 86 2HZ LYS 86 -5.791 15.999 14.135 654 H ASP 87 H ASP 87 -1.582 9.866 11.912 655 HA ASP 87 HA ASP 87 -0.551 8.297 14.019 656 HB2 ASP 87 2HB ASP 87 -2.727 7.075 12.911 657 HB3 ASP 87 1HB ASP 87 -1.414 6.398 11.935 658 H GLU 88 H GLU 88 1.247 6.862 13.269 659 HA GLU 88 HA GLU 88 2.705 8.220 11.158 660 HB2 GLU 88 2HB GLU 88 3.385 6.469 13.439 661 HB3 GLU 88 1HB GLU 88 4.412 6.303 12.022 662 HG2 GLU 88 2HG GLU 88 3.825 8.930 13.359 663 HG3 GLU 88 1HG GLU 88 5.221 7.922 13.738 664 H ASP 89 H ASP 89 0.789 5.434 11.488 665 HA ASP 89 HA ASP 89 1.966 3.553 9.853 666 HB2 ASP 89 2HB ASP 89 -0.706 4.128 10.834 667 HB3 ASP 89 1HB ASP 89 -0.753 3.438 9.206 668 H PHE 90 H PHE 90 0.580 6.601 8.971 669 HA PHE 90 HA PHE 90 0.378 5.914 6.159 670 HB2 PHE 90 2HB PHE 90 0.044 8.651 7.392 671 HB3 PHE 90 1HB PHE 90 -0.595 8.066 5.851 672 HD1 PHE 90 1HD PHE 90 -0.913 7.781 9.517 673 HD2 PHE 90 2HD PHE 90 -2.652 6.927 5.730 674 HE1 PHE 90 1HE PHE 90 -3.009 7.132 10.630 675 HE2 PHE 90 2HE PHE 90 -4.752 6.279 6.835 676 HZ PHE 90 HZ PHE 90 -4.932 6.382 9.289 677 H SER 91 H SER 91 2.758 7.087 8.279 678 HA SER 91 HA SER 91 4.595 7.483 6.093 679 HB2 SER 91 2HB SER 91 4.725 9.755 7.970 680 HB3 SER 91 1HB SER 91 4.926 9.721 6.211 681 HG SER 91 HG SER 91 3.045 10.769 6.498 682 HA PRO 92 HA PRO 92 6.547 5.502 9.727 683 HB2 PRO 92 2HB PRO 92 8.160 3.875 8.271 684 HB3 PRO 92 1HB PRO 92 6.473 3.477 8.652 685 HG2 PRO 92 2HG PRO 92 7.640 4.604 6.138 686 HG3 PRO 92 1HG PRO 92 6.398 3.356 6.335 687 HD2 PRO 92 2HD PRO 92 5.819 5.937 5.722 688 HD3 PRO 92 1HD PRO 92 4.724 4.897 6.655 689 H ASP 93 H ASP 93 8.434 6.189 6.754 690 HA ASP 93 HA ASP 93 10.426 7.515 8.474 691 HB2 ASP 93 2HB ASP 93 12.184 6.694 7.159 692 HB3 ASP 93 1HB ASP 93 11.074 5.321 7.256 693 H GLY 94 H GLY 94 8.800 7.586 5.337 694 HA2 GLY 94 2HA GLY 94 10.010 10.001 4.457 695 HA3 GLY 94 1HA GLY 94 8.556 9.257 3.785 696 H GLY 95 H GLY 95 9.533 12.044 4.820 697 HA2 GLY 95 2HA GLY 95 7.586 12.724 6.823 698 HA3 GLY 95 1HA GLY 95 8.632 13.849 5.952 699 H TYR 96 H TYR 96 7.176 12.030 3.637 700 HA TYR 96 HA TYR 96 5.651 14.054 2.536 701 HB2 TYR 96 2HB TYR 96 4.477 12.102 1.322 702 HB3 TYR 96 1HB TYR 96 6.224 12.279 1.111 703 HD1 TYR 96 2HD TYR 96 4.274 10.778 3.923 704 HD2 TYR 96 1HD TYR 96 7.042 10.122 0.757 705 HE1 TYR 96 2HE TYR 96 4.591 8.477 4.686 706 HE2 TYR 96 1HE TYR 96 7.356 7.798 1.516 707 HH TYR 96 HH TYR 96 7.041 6.612 3.980 708 H ILE 97 H ILE 97 3.132 13.315 1.970 709 HA ILE 97 HA ILE 97 1.747 12.620 4.412 710 HB ILE 97 HB ILE 97 0.301 14.643 4.293 711 HG12 ILE 97 2HG1 ILE 97 2.430 16.200 2.977 712 HG13 ILE 97 1HG1 ILE 97 1.571 15.088 1.905 713 HG21 ILE 97 1HG2 ILE 97 1.981 14.419 6.015 714 HG22 ILE 97 2HG2 ILE 97 1.917 16.095 5.468 715 HG23 ILE 97 3HG2 ILE 97 3.222 15.038 4.925 716 HD11 ILE 97 3HD1 ILE 97 0.512 17.209 1.793 717 HD12 ILE 97 1HD1 ILE 97 0.401 17.314 3.551 718 HD13 ILE 97 2HD1 ILE 97 -0.558 16.119 2.676 719 HA PRO 98 HA PRO 98 1.785 10.257 3.637 720 HB2 PRO 98 2HB PRO 98 -0.931 8.990 3.170 721 HB3 PRO 98 1HB PRO 98 0.338 8.516 4.323 722 HG2 PRO 98 2HG PRO 98 -1.615 10.595 4.578 723 HG3 PRO 98 1HG PRO 98 -0.388 10.056 5.759 724 HD2 PRO 98 2HD PRO 98 -0.038 12.390 4.755 725 HD3 PRO 98 1HD PRO 98 1.336 11.264 4.660 726 H ARG 99 H ARG 99 2.390 8.174 2.717 727 HA ARG 99 HA ARG 99 2.150 8.138 -0.201 728 HB2 ARG 99 2HB ARG 99 4.403 8.460 1.520 729 HB3 ARG 99 1HB ARG 99 4.606 6.987 0.569 730 HG2 ARG 99 2HG ARG 99 5.616 8.866 -0.526 731 HG3 ARG 99 1HG ARG 99 4.243 8.295 -1.472 732 HD2 ARG 99 2HD ARG 99 3.137 10.194 0.198 733 HD3 ARG 99 1HD ARG 99 4.715 10.869 -0.198 734 HE ARG 99 HE ARG 99 3.055 9.905 -2.394 735 HH11 ARG 99 1HH1 ARG 99 4.346 12.622 -0.609 736 HH12 ARG 99 2HH1 ARG 99 4.057 13.753 -1.886 737 HH21 ARG 99 1HH2 ARG 99 2.679 11.393 -4.066 738 HH22 ARG 99 2HH2 ARG 99 3.108 13.057 -3.848 739 H ILE 100 H ILE 100 3.619 5.918 -0.726 740 HA ILE 100 HA ILE 100 1.757 3.806 -0.057 741 HB ILE 100 HB ILE 100 4.216 3.720 -1.796 742 HG12 ILE 100 2HG1 ILE 100 1.889 3.679 -3.371 743 HG13 ILE 100 1HG1 ILE 100 1.648 4.973 -2.202 744 HG21 ILE 100 1HG2 ILE 100 2.028 1.796 -1.218 745 HG22 ILE 100 2HG2 ILE 100 3.751 1.512 -1.461 746 HG23 ILE 100 3HG2 ILE 100 2.710 1.840 -2.844 747 HD11 ILE 100 3HD1 ILE 100 4.160 5.502 -2.987 748 HD12 ILE 100 1HD1 ILE 100 2.724 6.184 -3.747 749 HD13 ILE 100 2HD1 ILE 100 3.511 4.775 -4.456 750 H LEU 101 H LEU 101 2.092 2.113 1.278 751 HA LEU 101 HA LEU 101 4.739 1.265 1.994 752 HB2 LEU 101 2HB LEU 101 3.972 1.310 4.516 753 HB3 LEU 101 1HB LEU 101 4.827 2.649 3.782 754 HG LEU 101 HG LEU 101 2.890 3.280 5.236 755 HD11 LEU 101 1HD1 LEU 101 2.266 4.234 2.506 756 HD12 LEU 101 2HD1 LEU 101 3.881 4.534 3.147 757 HD13 LEU 101 3HD1 LEU 101 2.463 5.140 4.005 758 HD21 LEU 101 3HD2 LEU 101 1.462 1.364 4.386 759 HD22 LEU 101 1HD2 LEU 101 1.174 2.352 2.955 760 HD23 LEU 101 2HD2 LEU 101 0.670 2.933 4.541 761 H PHE 102 H PHE 102 4.854 -0.855 2.312 762 HA PHE 102 HA PHE 102 2.423 -2.392 2.047 763 HB2 PHE 102 2HB PHE 102 5.285 -2.834 1.721 764 HB3 PHE 102 1HB PHE 102 4.493 -4.182 2.528 765 HD1 PHE 102 1HD PHE 102 2.061 -4.679 1.325 766 HD2 PHE 102 2HD PHE 102 5.563 -3.117 -0.518 767 HE1 PHE 102 1HE PHE 102 1.288 -5.523 -0.853 768 HE2 PHE 102 2HE PHE 102 4.795 -3.956 -2.699 769 HZ PHE 102 HZ PHE 102 2.655 -5.162 -2.869 770 H LEU 103 H LEU 103 1.917 -4.216 3.501 771 HA LEU 103 HA LEU 103 3.011 -4.102 6.177 772 HB2 LEU 103 2HB LEU 103 0.576 -3.975 7.066 773 HB3 LEU 103 1HB LEU 103 1.470 -2.522 6.706 774 HG LEU 103 HG LEU 103 0.279 -2.679 4.404 775 HD11 LEU 103 1HD1 LEU 103 -2.114 -3.604 5.002 776 HD12 LEU 103 2HD1 LEU 103 -1.184 -4.627 6.096 777 HD13 LEU 103 3HD1 LEU 103 -0.854 -4.661 4.364 778 HD21 LEU 103 3HD2 LEU 103 -0.063 -0.875 5.963 779 HD22 LEU 103 1HD2 LEU 103 -1.165 -1.877 6.911 780 HD23 LEU 103 2HD2 LEU 103 -1.602 -1.387 5.275 781 H ASP 104 H ASP 104 1.715 -5.593 7.664 782 HA ASP 104 HA ASP 104 1.803 -8.194 6.599 783 HB2 ASP 104 2HB ASP 104 1.180 -6.950 9.160 784 HB3 ASP 104 1HB ASP 104 0.152 -8.354 8.840 785 HA PRO 105 HA PRO 105 -1.831 -8.320 4.031 786 HB2 PRO 105 2HB PRO 105 -1.774 -11.107 5.141 787 HB3 PRO 105 1HB PRO 105 -2.062 -10.564 3.477 788 HG2 PRO 105 2HG PRO 105 0.321 -11.501 4.217 789 HG3 PRO 105 1HG PRO 105 0.181 -10.135 3.088 790 HD2 PRO 105 2HD PRO 105 1.053 -10.164 5.915 791 HD3 PRO 105 1HD PRO 105 1.441 -9.011 4.625 792 H SER 106 H SER 106 -3.153 -6.966 5.382 793 HA SER 106 HA SER 106 -5.187 -6.612 6.373 794 HB2 SER 106 2HB SER 106 -6.731 -8.312 6.611 795 HB3 SER 106 1HB SER 106 -5.616 -9.088 5.476 796 HG SER 106 HG SER 106 -6.156 -10.428 7.273 797 H GLY 107 H GLY 107 -2.775 -6.302 7.563 798 HA2 GLY 107 2HA GLY 107 -3.408 -6.909 10.369 799 HA3 GLY 107 1HA GLY 107 -1.774 -7.094 9.723 800 H LYS 108 H LYS 108 -0.766 -5.100 8.786 801 HA LYS 108 HA LYS 108 -1.794 -2.537 9.278 802 HB2 LYS 108 2HB LYS 108 -0.503 -1.903 11.342 803 HB3 LYS 108 1HB LYS 108 -1.882 -2.960 11.602 804 HG2 LYS 108 2HG LYS 108 0.521 -4.491 11.153 805 HG3 LYS 108 1HG LYS 108 0.728 -3.340 12.485 806 HD2 LYS 108 2HD LYS 108 -1.761 -4.981 12.370 807 HD3 LYS 108 1HD LYS 108 -0.262 -5.743 12.906 808 HE2 LYS 108 2HE LYS 108 -1.312 -4.962 14.864 809 HE3 LYS 108 1HE LYS 108 -0.023 -3.807 14.524 810 HZ1 LYS 108 3HZ LYS 108 -1.635 -2.311 13.564 811 HZ2 LYS 108 1HZ LYS 108 -2.110 -2.721 15.135 812 HZ3 LYS 108 2HZ LYS 108 -2.881 -3.430 13.807 813 H VAL 109 H VAL 109 -0.500 -0.883 8.649 814 HA VAL 109 HA VAL 109 1.580 -1.145 6.935 815 HB VAL 109 HB VAL 109 1.417 1.166 8.852 816 HG11 VAL 109 1HG1 VAL 109 3.169 1.697 7.565 817 HG12 VAL 109 2HG1 VAL 109 1.925 2.169 6.410 818 HG13 VAL 109 3HG1 VAL 109 2.693 0.591 6.282 819 HG21 VAL 109 3HG2 VAL 109 -0.043 1.485 6.343 820 HG22 VAL 109 1HG2 VAL 109 -0.501 1.934 7.982 821 HG23 VAL 109 2HG2 VAL 109 -0.763 0.290 7.417 822 H HIS 110 H HIS 110 3.250 -2.432 7.357 823 HA HIS 110 HA HIS 110 4.792 -1.954 9.803 824 HB2 HIS 110 2HB HIS 110 4.294 -4.305 8.109 825 HB3 HIS 110 1HB HIS 110 5.987 -4.095 8.544 826 HD1 HIS 110 1HD HIS 110 2.771 -5.258 9.859 827 HD2 HIS 110 2HD HIS 110 6.450 -4.097 11.404 828 HE1 HIS 110 1HE HIS 110 2.799 -6.097 12.229 829 HE2 HIS 110 2HE HIS 110 5.060 -5.440 13.125 830 HA PRO 111 HA PRO 111 7.447 0.409 7.061 831 HB2 PRO 111 2HB PRO 111 9.350 1.013 8.918 832 HB3 PRO 111 1HB PRO 111 7.812 1.871 8.791 833 HG2 PRO 111 2HG PRO 111 8.614 -0.311 10.670 834 HG3 PRO 111 1HG PRO 111 7.681 1.160 10.996 835 HD2 PRO 111 2HD PRO 111 6.515 -1.263 10.681 836 HD3 PRO 111 1HD PRO 111 5.725 0.249 10.180 837 H GLU 112 H GLU 112 7.576 -2.406 6.951 838 HA GLU 112 HA GLU 112 10.448 -2.997 7.130 839 HB2 GLU 112 2HB GLU 112 7.979 -4.672 7.122 840 HB3 GLU 112 1HB GLU 112 9.475 -5.378 6.528 841 HG2 GLU 112 2HG GLU 112 10.555 -5.040 8.623 842 HG3 GLU 112 1HG GLU 112 9.204 -4.081 9.226 843 H ILE 113 H ILE 113 7.709 -3.323 4.881 844 HA ILE 113 HA ILE 113 9.587 -3.766 2.688 845 HB ILE 113 HB ILE 113 6.572 -3.885 2.681 846 HG12 ILE 113 2HG1 ILE 113 7.474 -5.649 4.066 847 HG13 ILE 113 1HG1 ILE 113 6.941 -6.348 2.529 848 HG21 ILE 113 1HG2 ILE 113 6.817 -4.978 0.509 849 HG22 ILE 113 2HG2 ILE 113 8.564 -4.747 0.587 850 HG23 ILE 113 3HG2 ILE 113 7.494 -3.348 0.485 851 HD11 ILE 113 3HD1 ILE 113 9.242 -6.397 1.747 852 HD12 ILE 113 1HD1 ILE 113 9.064 -7.283 3.261 853 HD13 ILE 113 2HD1 ILE 113 9.783 -5.673 3.261 854 H ILE 114 H ILE 114 10.449 -1.901 2.053 855 HA ILE 114 HA ILE 114 8.843 0.507 1.756 856 HB ILE 114 HB ILE 114 10.954 1.608 1.185 857 HG12 ILE 114 2HG1 ILE 114 11.837 -0.701 0.209 858 HG13 ILE 114 1HG1 ILE 114 12.942 0.535 0.787 859 HG21 ILE 114 1HG2 ILE 114 10.693 1.800 3.426 860 HG22 ILE 114 2HG2 ILE 114 12.181 0.856 3.413 861 HG23 ILE 114 3HG2 ILE 114 10.634 0.056 3.685 862 HD11 ILE 114 3HD1 ILE 114 12.102 -1.349 2.853 863 HD12 ILE 114 1HD1 ILE 114 13.709 -0.763 2.428 864 HD13 ILE 114 2HD1 ILE 114 12.981 -2.084 1.514 865 H ASN 115 H ASN 115 10.014 1.735 -0.394 866 HA ASN 115 HA ASN 115 8.798 0.291 -2.596 867 HB2 ASN 115 2HB ASN 115 8.388 2.729 -2.205 868 HB3 ASN 115 1HB ASN 115 10.085 3.026 -2.602 869 HD21 ASN 115 1HD2 ASN 115 8.649 4.407 -4.132 870 HD22 ASN 115 2HD2 ASN 115 8.368 3.697 -5.699 871 H GLU 116 H GLU 116 11.965 1.175 -1.453 872 HA GLU 116 HA GLU 116 14.034 0.434 -2.055 873 HB2 GLU 116 2HB GLU 116 12.357 -1.538 -3.089 874 HB3 GLU 116 1HB GLU 116 13.378 -1.073 -4.455 875 HG2 GLU 116 2HG GLU 116 14.469 -1.795 -1.750 876 HG3 GLU 116 1HG GLU 116 14.214 -2.972 -3.036 877 H ASN 117 H ASN 117 12.152 0.813 -5.070 878 HA ASN 117 HA ASN 117 14.309 2.113 -6.415 879 HB2 ASN 117 2HB ASN 117 11.549 1.292 -7.057 880 HB3 ASN 117 1HB ASN 117 12.131 2.715 -7.936 881 HD21 ASN 117 1HD2 ASN 117 12.952 2.241 -9.817 882 HD22 ASN 117 2HD2 ASN 117 13.841 0.797 -10.222 883 H GLY 118 H GLY 118 12.198 3.221 -4.074 884 HA2 GLY 118 2HA GLY 118 11.383 5.731 -4.934 885 HA3 GLY 118 1HA GLY 118 11.749 5.315 -3.257 886 H ASN 119 H ASN 119 13.562 6.110 -2.328 887 HA ASN 119 HA ASN 119 15.819 7.035 -3.800 888 HB2 ASN 119 2HB ASN 119 13.681 8.844 -3.640 889 HB3 ASN 119 1HB ASN 119 14.837 9.386 -2.415 890 HD21 ASN 119 1HD2 ASN 119 15.046 11.262 -3.774 891 HD22 ASN 119 2HD2 ASN 119 16.125 11.212 -5.143 892 HA PRO 120 HA PRO 120 17.706 6.797 0.184 893 HB2 PRO 120 2HB PRO 120 19.326 9.184 -0.117 894 HB3 PRO 120 1HB PRO 120 19.809 7.486 -0.264 895 HG2 PRO 120 2HG PRO 120 19.723 9.220 -2.374 896 HG3 PRO 120 1HG PRO 120 19.499 7.463 -2.532 897 HD2 PRO 120 2HD PRO 120 17.442 9.644 -2.464 898 HD3 PRO 120 1HD PRO 120 17.517 8.190 -3.493 899 H SER 121 H SER 121 15.410 8.977 -0.231 900 HA SER 121 HA SER 121 15.364 9.766 2.520 901 HB2 SER 121 2HB SER 121 16.475 11.591 0.556 902 HB3 SER 121 1HB SER 121 15.012 12.266 1.286 903 HG SER 121 HG SER 121 17.086 11.131 2.840 904 H TYR 122 H TYR 122 13.787 8.261 0.664 905 HA TYR 122 HA TYR 122 11.243 9.559 1.083 906 HB2 TYR 122 2HB TYR 122 12.608 9.551 -1.483 907 HB3 TYR 122 1HB TYR 122 11.027 8.774 -1.576 908 HD1 TYR 122 2HD TYR 122 9.227 10.237 -0.015 909 HD2 TYR 122 1HD TYR 122 12.580 11.733 -2.163 910 HE1 TYR 122 2HE TYR 122 8.166 12.454 -0.118 911 HE2 TYR 122 1HE TYR 122 11.532 13.952 -2.270 912 HH TYR 122 HH TYR 122 9.821 15.247 -0.973 913 H LYS 123 H LYS 123 12.717 6.924 -0.786 914 HA LYS 123 HA LYS 123 12.201 4.715 -0.993 915 HB2 LYS 123 2HB LYS 123 12.003 5.353 1.881 916 HB3 LYS 123 1HB LYS 123 11.239 3.848 1.403 917 HG2 LYS 123 2HG LYS 123 14.128 4.633 1.105 918 HG3 LYS 123 1HG LYS 123 13.441 3.324 2.083 919 HD2 LYS 123 2HD LYS 123 14.005 2.024 0.344 920 HD3 LYS 123 1HD LYS 123 12.539 2.674 -0.402 921 HE2 LYS 123 2HE LYS 123 13.738 3.656 -1.996 922 HE3 LYS 123 1HE LYS 123 14.722 4.490 -0.796 923 HZ1 LYS 123 3HZ LYS 123 15.688 2.697 -2.501 924 HZ2 LYS 123 1HZ LYS 123 15.332 1.681 -1.195 925 HZ3 LYS 123 2HZ LYS 123 16.374 2.997 -0.984 926 H TYR 124 H TYR 124 9.704 5.102 1.416 927 HA TYR 124 HA TYR 124 7.730 3.747 0.096 928 HB2 TYR 124 2HB TYR 124 7.537 5.921 2.170 929 HB3 TYR 124 1HB TYR 124 6.158 4.934 1.665 930 HD1 TYR 124 1HD TYR 124 6.429 2.370 1.888 931 HD2 TYR 124 2HD TYR 124 8.952 5.172 3.854 932 HE1 TYR 124 1HE TYR 124 7.117 0.625 3.476 933 HE2 TYR 124 2HE TYR 124 9.647 3.432 5.449 934 HH TYR 124 HH TYR 124 9.007 0.137 4.967 935 H PHE 125 H PHE 125 8.835 6.885 -0.697 936 HA PHE 125 HA PHE 125 6.346 7.725 -1.918 937 HB2 PHE 125 2HB PHE 125 7.672 9.489 -1.004 938 HB3 PHE 125 1HB PHE 125 9.121 8.919 -1.841 939 HD1 PHE 125 2HD PHE 125 5.644 9.976 -2.718 940 HD2 PHE 125 1HD PHE 125 9.795 10.164 -3.636 941 HE1 PHE 125 2HE PHE 125 5.158 11.508 -4.581 942 HE2 PHE 125 1HE PHE 125 9.318 11.695 -5.502 943 HZ PHE 125 HZ PHE 125 6.997 12.369 -5.976 944 H TYR 126 H TYR 126 5.713 7.098 -3.878 945 HA TYR 126 HA TYR 126 7.668 5.833 -5.645 946 HB2 TYR 126 2HB TYR 126 4.658 5.803 -5.555 947 HB3 TYR 126 1HB TYR 126 5.562 5.171 -6.937 948 HD1 TYR 126 2HD TYR 126 6.005 4.904 -3.225 949 HD2 TYR 126 1HD TYR 126 5.539 2.866 -6.928 950 HE1 TYR 126 2HE TYR 126 6.255 2.752 -2.064 951 HE2 TYR 126 1HE TYR 126 5.787 0.708 -5.778 952 HH TYR 126 HH TYR 126 6.801 -0.157 -3.682 953 H VAL 127 H VAL 127 7.247 6.145 -8.028 954 HA VAL 127 HA VAL 127 6.142 8.526 -9.047 955 HB VAL 127 HB VAL 127 8.431 9.439 -9.834 956 HG11 VAL 127 1HG1 VAL 127 8.126 9.946 -6.935 957 HG12 VAL 127 2HG1 VAL 127 6.731 10.262 -7.964 958 HG13 VAL 127 3HG1 VAL 127 8.260 11.083 -8.277 959 HG21 VAL 127 3HG2 VAL 127 9.738 7.519 -8.969 960 HG22 VAL 127 1HG2 VAL 127 9.331 8.022 -7.329 961 HG23 VAL 127 2HG2 VAL 127 10.302 9.074 -8.357 962 H SER 128 H SER 128 5.364 7.461 -10.767 963 HA SER 128 HA SER 128 5.600 6.822 -13.019 964 HB2 SER 128 2HB SER 128 8.156 7.229 -12.737 965 HB3 SER 128 1HB SER 128 8.228 5.480 -12.461 966 HG SER 128 HG SER 128 7.025 5.330 -14.512 967 H ALA 129 H ALA 129 4.538 5.085 -13.719 968 HA ALA 129 HA ALA 129 3.796 3.007 -11.986 969 HB1 ALA 129 1HB ALA 129 2.275 3.535 -13.681 970 HB2 ALA 129 2HB ALA 129 2.913 1.954 -14.135 971 HB3 ALA 129 3HB ALA 129 3.502 3.406 -14.942 972 H GLU 130 H GLU 130 6.489 3.349 -14.129 973 HA GLU 130 HA GLU 130 7.100 0.707 -14.715 974 HB2 GLU 130 2HB GLU 130 8.317 3.188 -15.069 975 HB3 GLU 130 1HB GLU 130 9.487 2.257 -14.129 976 HG2 GLU 130 2HG GLU 130 9.935 2.006 -16.480 977 HG3 GLU 130 1HG GLU 130 9.376 0.463 -15.808 978 H GLN 131 H GLN 131 8.430 2.634 -12.002 979 HA GLN 131 HA GLN 131 9.722 0.433 -10.849 980 HB2 GLN 131 2HB GLN 131 9.844 1.788 -8.790 981 HB3 GLN 131 1HB GLN 131 10.499 2.569 -10.224 982 HG2 GLN 131 2HG GLN 131 8.116 3.621 -10.380 983 HG3 GLN 131 1HG GLN 131 8.039 3.210 -8.667 984 HE21 GLN 131 1HE2 GLN 131 8.727 4.713 -7.327 985 HE22 GLN 131 2HE2 GLN 131 9.840 5.980 -7.697 986 H VAL 132 H VAL 132 6.522 1.820 -10.261 987 HA VAL 132 HA VAL 132 5.837 0.468 -7.960 988 HB VAL 132 HB VAL 132 3.660 1.025 -8.313 989 HG11 VAL 132 1HG1 VAL 132 4.796 2.716 -10.508 990 HG12 VAL 132 2HG1 VAL 132 5.140 2.996 -8.805 991 HG13 VAL 132 3HG1 VAL 132 3.484 3.106 -9.400 992 HG21 VAL 132 3HG2 VAL 132 4.082 0.025 -11.069 993 HG22 VAL 132 1HG2 VAL 132 2.796 1.205 -10.820 994 HG23 VAL 132 2HG2 VAL 132 2.787 -0.314 -9.924 995 H VAL 133 H VAL 133 6.145 -0.796 -11.192 996 HA VAL 133 HA VAL 133 4.796 -3.262 -10.540 997 HB VAL 133 HB VAL 133 4.806 -2.254 -12.856 998 HG11 VAL 133 1HG1 VAL 133 6.738 -1.812 -13.852 999 HG12 VAL 133 2HG1 VAL 133 7.117 -3.534 -13.854 1000 HG13 VAL 133 3HG1 VAL 133 7.621 -2.522 -12.504 1001 HG21 VAL 133 3HG2 VAL 133 5.831 -5.079 -12.817 1002 HG22 VAL 133 1HG2 VAL 133 4.642 -4.356 -13.900 1003 HG23 VAL 133 2HG2 VAL 133 4.232 -4.647 -12.211 1004 H GLN 134 H GLN 134 8.151 -2.113 -10.697 1005 HA GLN 134 HA GLN 134 9.209 -4.794 -10.493 1006 HB2 GLN 134 2HB GLN 134 11.318 -3.434 -9.684 1007 HB3 GLN 134 1HB GLN 134 10.847 -3.451 -11.376 1008 HG2 GLN 134 2HG GLN 134 9.715 -1.313 -11.075 1009 HG3 GLN 134 1HG GLN 134 10.221 -1.290 -9.387 1010 HE21 GLN 134 1HE2 GLN 134 10.913 -0.157 -12.377 1011 HE22 GLN 134 2HE2 GLN 134 12.607 0.200 -12.174 1012 H GLY 135 H GLY 135 8.202 -2.298 -8.301 1013 HA2 GLY 135 2HA GLY 135 9.306 -3.561 -5.958 1014 HA3 GLY 135 1HA GLY 135 8.142 -2.225 -5.987 1015 H MET 136 H MET 136 6.392 -3.761 -7.849 1016 HA MET 136 HA MET 136 4.846 -5.113 -5.834 1017 HB2 MET 136 2HB MET 136 4.454 -4.186 -8.587 1018 HB3 MET 136 1HB MET 136 3.664 -5.721 -8.250 1019 HG2 MET 136 2HG MET 136 2.881 -4.370 -6.089 1020 HG3 MET 136 1HG MET 136 3.094 -3.020 -7.202 1021 HE1 MET 136 3HE MET 136 0.186 -6.540 -7.781 1022 HE2 MET 136 1HE MET 136 1.408 -6.399 -6.517 1023 HE3 MET 136 2HE MET 136 1.892 -6.738 -8.179 1024 H LYS 137 H LYS 137 6.720 -6.002 -8.680 1025 HA LYS 137 HA LYS 137 6.181 -8.801 -8.428 1026 HB2 LYS 137 2HB LYS 137 7.670 -9.092 -10.273 1027 HB3 LYS 137 1HB LYS 137 6.711 -7.657 -10.586 1028 HG2 LYS 137 2HG LYS 137 8.763 -6.434 -9.524 1029 HG3 LYS 137 1HG LYS 137 9.608 -7.916 -9.976 1030 HD2 LYS 137 2HD LYS 137 8.166 -5.969 -11.762 1031 HD3 LYS 137 1HD LYS 137 9.866 -6.439 -11.806 1032 HE2 LYS 137 2HE LYS 137 7.560 -8.292 -12.396 1033 HE3 LYS 137 1HE LYS 137 8.493 -7.441 -13.623 1034 HZ1 LYS 137 3HZ LYS 137 9.588 -9.401 -11.676 1035 HZ2 LYS 137 1HZ LYS 137 10.475 -8.596 -12.871 1036 HZ3 LYS 137 2HZ LYS 137 9.278 -9.708 -13.310 1037 H GLU 138 H GLU 138 8.264 -6.651 -6.841 1038 HA GLU 138 HA GLU 138 10.421 -8.449 -6.308 1039 HB2 GLU 138 2HB GLU 138 10.141 -5.764 -6.055 1040 HB3 GLU 138 1HB GLU 138 9.894 -6.264 -4.384 1041 HG2 GLU 138 2HG GLU 138 12.254 -7.207 -5.978 1042 HG3 GLU 138 1HG GLU 138 12.259 -5.658 -5.116 1043 H ALA 139 H ALA 139 8.096 -6.996 -4.056 1044 HA ALA 139 HA ALA 139 8.478 -8.933 -2.042 1045 HB1 ALA 139 1HB ALA 139 7.440 -6.578 -1.880 1046 HB2 ALA 139 2HB ALA 139 6.780 -7.860 -0.863 1047 HB3 ALA 139 3HB ALA 139 5.933 -7.376 -2.332 1048 H GLN 140 H GLN 140 6.733 -9.022 -4.971 1049 HA GLN 140 HA GLN 140 4.641 -10.762 -4.335 1050 HB2 GLN 140 2HB GLN 140 5.869 -9.680 -6.718 1051 HB3 GLN 140 1HB GLN 140 5.422 -11.374 -6.957 1052 HG2 GLN 140 2HG GLN 140 3.161 -10.539 -5.864 1053 HG3 GLN 140 1HG GLN 140 3.709 -8.993 -6.511 1054 HE21 GLN 140 1HE2 GLN 140 2.641 -12.208 -7.267 1055 HE22 GLN 140 2HE2 GLN 140 2.371 -11.944 -8.953 1056 H GLU 141 H GLU 141 7.999 -11.330 -4.468 1057 HA GLU 141 HA GLU 141 7.666 -14.198 -4.915 1058 HB2 GLU 141 2HB GLU 141 9.424 -13.239 -6.202 1059 HB3 GLU 141 1HB GLU 141 10.091 -12.411 -4.788 1060 HG2 GLU 141 2HG GLU 141 11.082 -14.294 -3.982 1061 HG3 GLU 141 1HG GLU 141 9.907 -15.372 -4.729 1062 H ARG 142 H ARG 142 8.078 -11.971 -2.338 1063 HA ARG 142 HA ARG 142 8.743 -14.204 -0.534 1064 HB2 ARG 142 2HB ARG 142 9.279 -11.590 0.620 1065 HB3 ARG 142 1HB ARG 142 10.330 -13.004 0.489 1066 HG2 ARG 142 2HG ARG 142 11.387 -12.213 -1.338 1067 HG3 ARG 142 1HG ARG 142 9.927 -11.460 -2.000 1068 HD2 ARG 142 2HD ARG 142 10.288 -9.497 -0.936 1069 HD3 ARG 142 1HD ARG 142 10.994 -10.279 0.487 1070 HE ARG 142 HE ARG 142 12.674 -10.428 -1.833 1071 HH11 ARG 142 1HH1 ARG 142 11.726 -8.427 0.864 1072 HH12 ARG 142 2HH1 ARG 142 13.210 -7.535 0.885 1073 HH21 ARG 142 1HH2 ARG 142 14.626 -9.257 -1.807 1074 HH22 ARG 142 2HH2 ARG 142 14.857 -8.005 -0.631 1075 H LEU 143 H LEU 143 7.132 -11.021 -0.573 1076 HA LEU 143 HA LEU 143 5.756 -11.304 1.826 1077 HB2 LEU 143 2HB LEU 143 5.721 -9.522 -0.441 1078 HB3 LEU 143 1HB LEU 143 4.082 -9.814 0.142 1079 HG LEU 143 HG LEU 143 5.060 -7.827 1.181 1080 HD11 LEU 143 1HD1 LEU 143 5.064 -9.698 3.460 1081 HD12 LEU 143 2HD1 LEU 143 3.639 -9.741 2.422 1082 HD13 LEU 143 3HD1 LEU 143 4.123 -8.230 3.194 1083 HD21 LEU 143 3HD2 LEU 143 7.246 -9.742 1.836 1084 HD22 LEU 143 1HD2 LEU 143 6.901 -8.421 2.954 1085 HD23 LEU 143 2HD2 LEU 143 7.338 -8.071 1.283 1086 H THR 144 H THR 144 5.111 -12.752 -1.257 1087 HA THR 144 HA THR 144 2.363 -13.276 -0.955 1088 HB THR 144 HB THR 144 2.867 -15.173 -2.565 1089 HG1 THR 144 1HG THR 144 5.105 -15.343 -1.872 1090 HG21 THR 144 3HG2 THR 144 3.255 -13.777 -4.451 1091 HG22 THR 144 1HG2 THR 144 3.937 -12.509 -3.433 1092 HG23 THR 144 2HG2 THR 144 2.222 -12.902 -3.320 1093 H GLY 145 H GLY 145 2.218 -13.871 1.300 1094 HA2 GLY 145 2HA GLY 145 1.545 -16.278 2.035 1095 HA3 GLY 145 1HA GLY 145 3.284 -16.523 1.966 1096 H ASP 146 H ASP 146 4.154 -16.504 3.922 1097 HA ASP 146 HA ASP 146 3.624 -14.303 5.721 1098 HB2 ASP 146 2HB ASP 146 3.100 -15.825 7.641 1099 HB3 ASP 146 1HB ASP 146 1.844 -15.769 6.408 1100 H ALA 147 H ALA 147 5.875 -15.568 4.203 1101 HA ALA 147 HA ALA 147 7.638 -16.523 6.308 1102 HB1 ALA 147 1HB ALA 147 7.484 -17.307 3.792 1103 HB2 ALA 147 2HB ALA 147 9.022 -17.296 4.660 1104 HB3 ALA 147 3HB ALA 147 8.624 -15.981 3.554 1105 H PHE 148 H PHE 148 6.898 -13.600 4.645 1106 HA PHE 148 HA PHE 148 9.278 -12.182 4.796 1107 HB2 PHE 148 2HB PHE 148 7.881 -10.157 4.777 1108 HB3 PHE 148 1HB PHE 148 7.292 -11.358 3.619 1109 HD1 PHE 148 1HD PHE 148 5.213 -12.553 4.026 1110 HD2 PHE 148 2HD PHE 148 6.600 -9.557 6.711 1111 HE1 PHE 148 1HE PHE 148 2.983 -12.452 5.060 1112 HE2 PHE 148 2HE PHE 148 4.372 -9.450 7.749 1113 HZ PHE 148 HZ PHE 148 2.561 -10.901 6.926 1114 H ARG 149 H ARG 149 6.695 -12.445 7.220 1115 HA ARG 149 HA ARG 149 7.810 -10.761 9.134 1116 HB2 ARG 149 2HB ARG 149 6.503 -12.584 10.690 1117 HB3 ARG 149 1HB ARG 149 5.757 -11.198 9.910 1118 HG2 ARG 149 2HG ARG 149 4.830 -12.469 8.237 1119 HG3 ARG 149 1HG ARG 149 5.988 -13.778 8.453 1120 HD2 ARG 149 2HD ARG 149 3.984 -13.054 10.570 1121 HD3 ARG 149 1HD ARG 149 3.597 -14.176 9.266 1122 HE ARG 149 HE ARG 149 5.883 -15.192 10.281 1123 HH11 ARG 149 1HH1 ARG 149 2.867 -14.215 11.742 1124 HH12 ARG 149 2HH1 ARG 149 2.974 -15.366 13.031 1125 HH21 ARG 149 1HH2 ARG 149 6.025 -16.709 11.976 1126 HH22 ARG 149 2HH2 ARG 149 4.766 -16.782 13.163 1127 H LYS 150 H LYS 150 9.593 -10.899 10.300 1128 HA LYS 150 HA LYS 150 11.440 -11.714 11.345 1129 HB2 LYS 150 2HB LYS 150 9.328 -13.091 12.373 1130 HB3 LYS 150 1HB LYS 150 10.330 -14.411 11.784 1131 HG2 LYS 150 2HG LYS 150 11.615 -14.248 13.575 1132 HG3 LYS 150 1HG LYS 150 12.009 -12.580 13.158 1133 HD2 LYS 150 2HD LYS 150 9.521 -12.287 14.205 1134 HD3 LYS 150 1HD LYS 150 10.131 -13.641 15.156 1135 HE2 LYS 150 2HE LYS 150 11.035 -12.043 16.447 1136 HE3 LYS 150 1HE LYS 150 12.268 -11.967 15.189 1137 HZ1 LYS 150 3HZ LYS 150 10.538 -10.300 14.152 1138 HZ2 LYS 150 1HZ LYS 150 11.681 -9.791 15.293 1139 HZ3 LYS 150 2HZ LYS 150 10.089 -10.107 15.771 1140 H LYS 151 H LYS 151 13.184 -13.347 11.221 1141 HA LYS 151 HA LYS 151 13.183 -15.295 9.143 1142 HB2 LYS 151 2HB LYS 151 14.241 -12.576 8.585 1143 HB3 LYS 151 1HB LYS 151 15.201 -13.935 8.019 1144 HG2 LYS 151 2HG LYS 151 12.527 -14.466 7.299 1145 HG3 LYS 151 1HG LYS 151 12.856 -12.785 6.873 1146 HD2 LYS 151 2HD LYS 151 13.700 -13.689 4.989 1147 HD3 LYS 151 1HD LYS 151 15.121 -13.982 5.994 1148 HE2 LYS 151 2HE LYS 151 14.828 -16.086 5.189 1149 HE3 LYS 151 1HE LYS 151 13.764 -16.185 6.591 1150 HZ1 LYS 151 3HZ LYS 151 13.074 -15.986 3.747 1151 HZ2 LYS 151 1HZ LYS 151 12.008 -15.332 4.885 1152 HZ3 LYS 151 2HZ LYS 151 12.409 -16.974 4.948 1153 H HIS 152 H HIS 152 13.850 -15.076 11.950 1154 HA HIS 152 HA HIS 152 16.541 -16.195 11.812 1155 HB2 HIS 152 2HB HIS 152 15.761 -13.985 13.725 1156 HB3 HIS 152 1HB HIS 152 17.259 -14.905 13.805 1157 HD1 HIS 152 1HD HIS 152 19.156 -14.158 12.324 1158 HD2 HIS 152 2HD HIS 152 15.571 -12.251 11.438 1159 HE1 HIS 152 1HE HIS 152 19.747 -12.336 10.694 1160 HE2 HIS 152 2HE HIS 152 17.576 -11.142 10.238 1161 H LEU 153 H LEU 153 15.303 -18.151 12.105 1162 HA LEU 153 HA LEU 153 14.673 -19.919 13.393 1163 HB2 LEU 153 2HB LEU 153 16.342 -18.509 15.037 1164 HB3 LEU 153 1HB LEU 153 14.873 -18.564 15.992 1165 HG LEU 153 HG LEU 153 14.925 -21.114 15.495 1166 HD11 LEU 153 1HD1 LEU 153 17.558 -20.191 14.520 1167 HD12 LEU 153 2HD1 LEU 153 16.581 -21.572 14.023 1168 HD13 LEU 153 3HD1 LEU 153 17.542 -21.656 15.500 1169 HD21 LEU 153 3HD2 LEU 153 15.190 -20.719 17.707 1170 HD22 LEU 153 1HD2 LEU 153 16.438 -19.499 17.455 1171 HD23 LEU 153 2HD2 LEU 153 16.847 -21.212 17.358 1172 H GLU 154 H GLU 154 13.578 -17.049 15.219 1173 HA GLU 154 HA GLU 154 11.488 -16.288 15.721 1174 HB2 GLU 154 2HB GLU 154 11.092 -17.176 13.255 1175 HB3 GLU 154 1HB GLU 154 10.142 -18.397 14.093 1176 HG2 GLU 154 2HG GLU 154 9.675 -15.544 14.770 1177 HG3 GLU 154 1HG GLU 154 9.074 -16.153 13.227 1178 H ASP 155 H ASP 155 10.096 -16.681 17.381 1179 HA ASP 155 HA ASP 155 10.583 -18.857 19.071 1180 HB2 ASP 155 2HB ASP 155 8.913 -16.503 19.076 1181 HB3 ASP 155 1HB ASP 155 8.022 -17.879 19.719 1182 H GLU 156 H GLU 156 8.678 -20.245 19.932 1183 HA GLU 156 HA GLU 156 7.846 -21.929 17.772 1184 HB2 GLU 156 2HB GLU 156 8.449 -22.465 20.309 1185 HB3 GLU 156 1HB GLU 156 6.705 -22.255 20.508 1186 HG2 GLU 156 2HG GLU 156 7.950 -24.128 18.508 1187 HG3 GLU 156 1HG GLU 156 7.463 -24.605 20.134 1188 H LEU 157 H LEU 157 6.169 -19.821 20.084 1189 HA LEU 157 HA LEU 157 3.686 -20.168 18.563 1190 HB2 LEU 157 2HB LEU 157 4.094 -20.200 21.242 1191 HB3 LEU 157 1HB LEU 157 3.683 -18.512 21.007 1192 HG LEU 157 HG LEU 157 1.717 -19.834 21.603 1193 HD11 LEU 157 1HD1 LEU 157 1.135 -17.968 20.351 1194 HD12 LEU 157 2HD1 LEU 157 0.352 -19.291 19.489 1195 HD13 LEU 157 3HD1 LEU 157 1.858 -18.609 18.875 1196 HD21 LEU 157 3HD2 LEU 157 2.754 -21.877 20.286 1197 HD22 LEU 157 1HD2 LEU 157 1.754 -21.236 18.983 1198 HD23 LEU 157 2HD2 LEU 157 1.012 -21.711 20.512 Start of MODEL 38 1 H1 MET 1 1HT MET 1 -17.281 -4.618 19.283 2 H2 MET 1 2HT MET 1 -16.658 -5.736 20.428 3 H3 MET 1 3HT MET 1 -16.559 -4.050 20.731 4 HA MET 1 HA MET 1 -18.898 -5.810 20.760 5 HB2 MET 1 2HB MET 1 -17.192 -4.979 22.704 6 HB3 MET 1 1HB MET 1 -18.395 -3.696 22.767 7 HG2 MET 1 2HG MET 1 -20.153 -5.359 23.093 8 HG3 MET 1 1HG MET 1 -18.947 -6.643 23.028 9 HE1 MET 1 2HE MET 1 -21.111 -6.147 24.934 10 HE2 MET 1 3HE MET 1 -20.917 -4.795 26.051 11 HE3 MET 1 1HE MET 1 -20.441 -6.421 26.542 12 H HIS 2 H HIS 2 -17.870 -2.410 20.638 13 HA HIS 2 HA HIS 2 -20.563 -1.725 19.653 14 HB2 HIS 2 2HB HIS 2 -18.802 -0.366 21.639 15 HB3 HIS 2 1HB HIS 2 -19.793 0.641 20.590 16 HD1 HIS 2 1HD HIS 2 -22.441 0.148 20.722 17 HD2 HIS 2 2HD HIS 2 -20.114 -1.427 23.783 18 HE1 HIS 2 1HE HIS 2 -24.051 -0.410 22.571 19 HE2 HIS 2 2HE HIS 2 -22.631 -1.441 24.378 20 H HIS 3 H HIS 3 -17.186 -0.576 19.661 21 HA HIS 3 HA HIS 3 -17.596 0.805 17.147 22 HB2 HIS 3 2HB HIS 3 -15.564 0.790 19.267 23 HB3 HIS 3 1HB HIS 3 -14.897 0.930 17.643 24 HD1 HIS 3 1HD HIS 3 -14.392 3.328 17.311 25 HD2 HIS 3 2HD HIS 3 -18.067 2.764 19.167 26 HE1 HIS 3 1HE HIS 3 -15.391 5.625 17.535 27 HE2 HIS 3 2HE HIS 3 -17.651 5.249 18.582 28 H HIS 4 H HIS 4 -17.476 -0.227 15.276 29 HA HIS 4 HA HIS 4 -15.262 -1.899 14.614 30 HB2 HIS 4 2HB HIS 4 -17.117 -3.308 15.927 31 HB3 HIS 4 1HB HIS 4 -17.820 -3.387 14.316 32 HD1 HIS 4 1HD HIS 4 -14.206 -3.725 15.477 33 HD2 HIS 4 2HD HIS 4 -17.097 -5.792 13.322 34 HE1 HIS 4 1HE HIS 4 -13.064 -5.803 14.639 35 HE2 HIS 4 2HE HIS 4 -14.807 -6.993 13.265 36 H HIS 5 H HIS 5 -15.051 -2.219 12.408 37 HA HIS 5 HA HIS 5 -15.193 -1.481 10.248 38 HB2 HIS 5 2HB HIS 5 -17.331 -2.103 9.138 39 HB3 HIS 5 1HB HIS 5 -16.671 -3.387 10.145 40 HD1 HIS 5 1HD HIS 5 -17.934 -3.889 12.391 41 HD2 HIS 5 2HD HIS 5 -19.823 -1.165 9.887 42 HE1 HIS 5 1HE HIS 5 -20.285 -3.695 13.262 43 HE2 HIS 5 2HE HIS 5 -21.383 -1.975 11.785 44 H HIS 6 H HIS 6 -14.811 0.711 10.368 45 HA HIS 6 HA HIS 6 -17.116 2.487 10.699 46 HB2 HIS 6 2HB HIS 6 -14.159 2.823 10.948 47 HB3 HIS 6 1HB HIS 6 -15.128 4.231 10.529 48 HD1 HIS 6 1HD HIS 6 -14.545 1.778 13.311 49 HD2 HIS 6 2HD HIS 6 -16.645 5.292 12.598 50 HE1 HIS 6 1HE HIS 6 -15.353 2.546 15.564 51 HE2 HIS 6 2HE HIS 6 -16.688 4.632 15.099 52 H HIS 7 H HIS 7 -16.775 0.900 8.297 53 HA HIS 7 HA HIS 7 -16.362 3.053 6.328 54 HB2 HIS 7 2HB HIS 7 -15.037 0.633 6.455 55 HB3 HIS 7 1HB HIS 7 -16.295 0.328 5.262 56 HD1 HIS 7 1HD HIS 7 -13.121 2.167 5.787 57 HD2 HIS 7 2HD HIS 7 -16.099 1.897 2.901 58 HE1 HIS 7 1HE HIS 7 -12.167 3.258 3.732 59 HE2 HIS 7 2HE HIS 7 -13.953 3.002 1.973 60 H MET 8 H MET 8 -18.093 3.669 5.219 61 HA MET 8 HA MET 8 -20.220 1.767 4.636 62 HB2 MET 8 2HB MET 8 -21.971 3.326 5.452 63 HB3 MET 8 1HB MET 8 -20.951 2.693 6.750 64 HG2 MET 8 2HG MET 8 -20.222 4.720 7.313 65 HG3 MET 8 1HG MET 8 -19.968 5.199 5.636 66 HE1 MET 8 3HE MET 8 -22.909 5.280 8.597 67 HE2 MET 8 1HE MET 8 -22.886 3.855 7.558 68 HE3 MET 8 2HE MET 8 -24.172 5.050 7.389 69 H SER 9 H SER 9 -21.102 2.097 2.679 70 HA SER 9 HA SER 9 -20.767 4.712 1.395 71 HB2 SER 9 2HB SER 9 -20.048 3.636 -0.699 72 HB3 SER 9 1HB SER 9 -18.916 3.297 0.612 73 HG SER 9 HG SER 9 -20.050 1.272 0.871 74 H ASP 10 H ASP 10 -22.265 5.159 -0.282 75 HA ASP 10 HA ASP 10 -24.602 3.365 -0.320 76 HB2 ASP 10 2HB ASP 10 -24.527 5.940 0.699 77 HB3 ASP 10 1HB ASP 10 -25.194 6.164 -0.915 78 H GLY 11 H GLY 11 -22.849 5.880 -2.117 79 HA2 GLY 11 2HA GLY 11 -23.670 4.517 -4.604 80 HA3 GLY 11 1HA GLY 11 -23.744 6.268 -4.467 81 H HIS 12 H HIS 12 -21.850 3.631 -5.356 82 HA HIS 12 HA HIS 12 -19.378 5.219 -5.261 83 HB2 HIS 12 2HB HIS 12 -19.949 2.440 -4.792 84 HB3 HIS 12 1HB HIS 12 -18.804 2.589 -6.131 85 HD1 HIS 12 1HD HIS 12 -16.427 2.855 -5.478 86 HD2 HIS 12 2HD HIS 12 -19.008 3.895 -2.392 87 HE1 HIS 12 1HE HIS 12 -14.950 3.334 -3.501 88 HE2 HIS 12 2HE HIS 12 -16.540 3.883 -1.622 89 H ASN 13 H ASN 13 -17.960 5.157 -7.131 90 HA ASN 13 HA ASN 13 -19.162 4.397 -9.669 91 HB2 ASN 13 2HB ASN 13 -19.337 7.051 -8.737 92 HB3 ASN 13 1HB ASN 13 -18.080 7.054 -9.970 93 HD21 ASN 13 1HD2 ASN 13 -18.608 6.381 -12.083 94 HD22 ASN 13 2HD2 ASN 13 -20.241 6.420 -12.648 95 H GLY 14 H GLY 14 -16.446 6.334 -8.383 96 HA2 GLY 14 2HA GLY 14 -14.629 4.580 -9.923 97 HA3 GLY 14 1HA GLY 14 -14.421 6.336 -9.895 98 H LEU 15 H LEU 15 -12.833 3.878 -8.907 99 HA LEU 15 HA LEU 15 -12.435 4.801 -6.142 100 HB2 LEU 15 2HB LEU 15 -11.730 2.155 -7.412 101 HB3 LEU 15 1HB LEU 15 -11.360 2.604 -5.758 102 HG LEU 15 HG LEU 15 -13.999 3.004 -5.691 103 HD11 LEU 15 1HD1 LEU 15 -13.514 1.119 -7.959 104 HD12 LEU 15 2HD1 LEU 15 -14.665 2.448 -7.833 105 HD13 LEU 15 3HD1 LEU 15 -14.947 0.950 -6.946 106 HD21 LEU 15 3HD2 LEU 15 -13.458 0.159 -5.458 107 HD22 LEU 15 1HD2 LEU 15 -13.916 1.329 -4.221 108 HD23 LEU 15 2HD2 LEU 15 -12.223 1.149 -4.680 109 H GLY 16 H GLY 16 -10.124 4.486 -5.362 110 HA2 GLY 16 2HA GLY 16 -7.787 4.570 -5.788 111 HA3 GLY 16 1HA GLY 16 -8.131 5.002 -7.456 112 H LYS 17 H LYS 17 -10.139 7.006 -6.628 113 HA LYS 17 HA LYS 17 -10.250 9.241 -6.251 114 HB2 LYS 17 2HB LYS 17 -9.244 8.216 -3.974 115 HB3 LYS 17 1HB LYS 17 -7.909 9.265 -4.432 116 HG2 LYS 17 2HG LYS 17 -8.993 11.051 -3.704 117 HG3 LYS 17 1HG LYS 17 -10.386 10.675 -4.718 118 HD2 LYS 17 2HD LYS 17 -9.968 9.158 -2.181 119 HD3 LYS 17 1HD LYS 17 -10.631 10.792 -2.113 120 HE2 LYS 17 2HE LYS 17 -12.620 9.841 -2.462 121 HE3 LYS 17 1HE LYS 17 -12.089 9.610 -4.126 122 HZ1 LYS 17 3HZ LYS 17 -11.047 7.456 -3.147 123 HZ2 LYS 17 1HZ LYS 17 -12.692 7.497 -3.538 124 HZ3 LYS 17 2HZ LYS 17 -12.200 7.667 -1.928 125 H GLY 18 H GLY 18 -8.830 8.455 -8.482 126 HA2 GLY 18 2HA GLY 18 -7.740 9.870 -10.054 127 HA3 GLY 18 1HA GLY 18 -6.941 10.692 -8.710 128 H PHE 19 H PHE 19 -7.169 7.339 -9.919 129 HA PHE 19 HA PHE 19 -4.259 7.265 -10.139 130 HB2 PHE 19 2HB PHE 19 -5.488 6.241 -7.894 131 HB3 PHE 19 1HB PHE 19 -5.327 4.816 -8.931 132 HD1 PHE 19 2HD PHE 19 -2.966 4.491 -10.008 133 HD2 PHE 19 1HD PHE 19 -3.730 6.847 -6.548 134 HE1 PHE 19 2HE PHE 19 -0.605 4.280 -9.345 135 HE2 PHE 19 1HE PHE 19 -1.372 6.642 -5.881 136 HZ PHE 19 HZ PHE 19 0.194 5.356 -7.279 137 H GLY 20 H GLY 20 -6.846 4.813 -10.196 138 HA2 GLY 20 2HA GLY 20 -6.376 4.461 -13.077 139 HA3 GLY 20 1HA GLY 20 -6.198 3.067 -12.011 140 H ASP 21 H ASP 21 -8.005 2.071 -11.167 141 HA ASP 21 HA ASP 21 -10.634 3.198 -11.558 142 HB2 ASP 21 2HB ASP 21 -9.525 1.180 -13.391 143 HB3 ASP 21 1HB ASP 21 -11.104 0.755 -12.715 144 H HIS 22 H HIS 22 -9.935 -0.255 -11.444 145 HA HIS 22 HA HIS 22 -10.694 -0.282 -8.598 146 HB2 HIS 22 2HB HIS 22 -11.809 -2.523 -9.136 147 HB3 HIS 22 1HB HIS 22 -12.642 -1.071 -9.676 148 HD1 HIS 22 1HD HIS 22 -13.863 -2.486 -11.494 149 HD2 HIS 22 2HD HIS 22 -9.730 -2.335 -11.911 150 HE1 HIS 22 1HE HIS 22 -13.389 -3.340 -13.811 151 HE2 HIS 22 2HE HIS 22 -10.889 -3.164 -14.069 152 H ILE 23 H ILE 23 -8.446 -0.398 -8.119 153 HA ILE 23 HA ILE 23 -7.366 -3.100 -8.406 154 HB ILE 23 HB ILE 23 -5.971 -0.562 -9.239 155 HG12 ILE 23 2HG1 ILE 23 -5.567 -2.713 -11.036 156 HG13 ILE 23 1HG1 ILE 23 -7.276 -2.705 -10.623 157 HG21 ILE 23 1HG2 ILE 23 -4.108 -1.384 -8.354 158 HG22 ILE 23 2HG2 ILE 23 -4.146 -2.544 -9.681 159 HG23 ILE 23 3HG2 ILE 23 -4.811 -2.981 -8.108 160 HD11 ILE 23 3HD1 ILE 23 -7.627 -0.997 -11.974 161 HD12 ILE 23 1HD1 ILE 23 -5.936 -1.076 -12.466 162 HD13 ILE 23 2HD1 ILE 23 -6.416 -0.033 -11.128 163 H HIS 24 H HIS 24 -5.440 -0.373 -7.332 164 HA HIS 24 HA HIS 24 -5.192 -1.586 -4.714 165 HB2 HIS 24 2HB HIS 24 -3.809 0.876 -5.769 166 HB3 HIS 24 1HB HIS 24 -3.346 -0.087 -4.361 167 HD1 HIS 24 1HD HIS 24 -3.828 -2.834 -6.075 168 HD2 HIS 24 2HD HIS 24 -1.325 0.357 -6.974 169 HE1 HIS 24 1HE HIS 24 -2.059 -3.776 -7.595 170 HE2 HIS 24 2HE HIS 24 -0.634 -1.795 -8.228 171 H TRP 25 H TRP 25 -7.744 -0.463 -5.251 172 HA TRP 25 HA TRP 25 -7.930 1.393 -3.036 173 HB2 TRP 25 2HB TRP 25 -9.569 2.667 -4.851 174 HB3 TRP 25 1HB TRP 25 -7.961 3.213 -4.357 175 HD1 TRP 25 HD TRP 25 -9.829 1.659 -7.263 176 HE1 TRP 25 1HE TRP 25 -8.268 1.575 -9.287 177 HE3 TRP 25 3HE TRP 25 -5.478 3.012 -5.003 178 HZ2 TRP 25 2HZ TRP 25 -5.545 2.044 -9.885 179 HZ3 TRP 25 3HZ TRP 25 -3.441 3.180 -6.349 180 HH2 TRP 25 HH TRP 25 -3.465 2.702 -8.748 181 H ARG 26 H ARG 26 -9.250 -1.049 -5.016 182 HA ARG 26 HA ARG 26 -11.886 -0.981 -5.093 183 HB2 ARG 26 2HB ARG 26 -10.250 -3.006 -5.147 184 HB3 ARG 26 1HB ARG 26 -10.764 -3.221 -3.473 185 HG2 ARG 26 2HG ARG 26 -12.482 -3.348 -5.935 186 HG3 ARG 26 1HG ARG 26 -11.982 -4.683 -4.882 187 HD2 ARG 26 2HD ARG 26 -13.950 -4.363 -3.864 188 HD3 ARG 26 1HD ARG 26 -13.166 -2.969 -3.111 189 HE ARG 26 HE ARG 26 -14.432 -1.572 -4.431 190 HH11 ARG 26 1HH1 ARG 26 -14.752 -4.857 -5.572 191 HH12 ARG 26 2HH1 ARG 26 -16.061 -4.489 -6.645 192 HH21 ARG 26 1HH2 ARG 26 -16.152 -1.088 -5.845 193 HH22 ARG 26 2HH2 ARG 26 -16.855 -2.351 -6.800 194 H THR 27 H THR 27 -10.285 -1.786 -2.009 195 HA THR 27 HA THR 27 -11.706 -0.109 -0.339 196 HB THR 27 HB THR 27 -13.745 -1.263 -0.981 197 HG1 THR 27 1HG THR 27 -14.433 -1.809 1.056 198 HG21 THR 27 3HG2 THR 27 -12.951 -3.829 0.236 199 HG22 THR 27 1HG2 THR 27 -12.347 -3.491 -1.386 200 HG23 THR 27 2HG2 THR 27 -14.083 -3.490 -1.073 201 H LEU 28 H LEU 28 -11.216 -0.446 1.878 202 HA LEU 28 HA LEU 28 -8.837 -2.015 2.287 203 HB2 LEU 28 2HB LEU 28 -9.485 0.318 3.275 204 HB3 LEU 28 1HB LEU 28 -10.321 -0.642 4.497 205 HG LEU 28 HG LEU 28 -7.446 -1.223 3.906 206 HD11 LEU 28 1HD1 LEU 28 -8.508 1.125 5.444 207 HD12 LEU 28 2HD1 LEU 28 -7.263 1.094 4.196 208 HD13 LEU 28 3HD1 LEU 28 -6.932 0.414 5.789 209 HD21 LEU 28 3HD2 LEU 28 -7.564 -1.618 6.430 210 HD22 LEU 28 1HD2 LEU 28 -8.412 -2.759 5.385 211 HD23 LEU 28 2HD2 LEU 28 -9.314 -1.507 6.239 212 H GLU 29 H GLU 29 -12.226 -2.251 3.107 213 HA GLU 29 HA GLU 29 -11.999 -4.246 5.096 214 HB2 GLU 29 2HB GLU 29 -14.102 -2.847 3.744 215 HB3 GLU 29 1HB GLU 29 -14.473 -4.566 3.749 216 HG2 GLU 29 2HG GLU 29 -13.517 -3.610 6.322 217 HG3 GLU 29 1HG GLU 29 -14.978 -2.785 5.778 218 H ASP 30 H ASP 30 -13.461 -4.732 1.887 219 HA ASP 30 HA ASP 30 -13.179 -7.496 1.851 220 HB2 ASP 30 2HB ASP 30 -13.111 -5.745 -0.613 221 HB3 ASP 30 1HB ASP 30 -13.707 -7.407 -0.481 222 H GLY 31 H GLY 31 -10.895 -4.989 0.989 223 HA2 GLY 31 2HA GLY 31 -9.066 -6.481 -0.506 224 HA3 GLY 31 1HA GLY 31 -8.658 -5.073 0.482 225 H LYS 32 H LYS 32 -9.301 -6.073 3.012 226 HA LYS 32 HA LYS 32 -6.945 -7.544 3.597 227 HB2 LYS 32 2HB LYS 32 -8.236 -5.887 5.093 228 HB3 LYS 32 1HB LYS 32 -9.273 -7.254 5.480 229 HG2 LYS 32 2HG LYS 32 -6.351 -7.649 5.753 230 HG3 LYS 32 1HG LYS 32 -7.149 -6.608 6.934 231 HD2 LYS 32 2HD LYS 32 -7.904 -8.395 8.018 232 HD3 LYS 32 1HD LYS 32 -8.747 -8.937 6.563 233 HE2 LYS 32 2HE LYS 32 -7.013 -10.320 5.918 234 HE3 LYS 32 1HE LYS 32 -5.812 -9.417 6.838 235 HZ1 LYS 32 3HZ LYS 32 -6.591 -10.351 8.850 236 HZ2 LYS 32 1HZ LYS 32 -6.426 -11.638 7.766 237 HZ3 LYS 32 2HZ LYS 32 -7.960 -11.017 8.111 238 H LYS 33 H LYS 33 -10.396 -8.409 3.791 239 HA LYS 33 HA LYS 33 -10.034 -11.069 4.578 240 HB2 LYS 33 2HB LYS 33 -12.191 -9.681 4.508 241 HB3 LYS 33 1HB LYS 33 -12.297 -10.150 2.817 242 HG2 LYS 33 2HG LYS 33 -11.846 -12.536 4.168 243 HG3 LYS 33 1HG LYS 33 -12.978 -11.640 5.197 244 HD2 LYS 33 2HD LYS 33 -14.658 -11.802 3.698 245 HD3 LYS 33 1HD LYS 33 -13.583 -11.588 2.314 246 HE2 LYS 33 2HE LYS 33 -12.760 -13.968 2.868 247 HE3 LYS 33 1HE LYS 33 -14.232 -14.091 3.831 248 HZ1 LYS 33 3HZ LYS 33 -15.519 -14.196 2.008 249 HZ2 LYS 33 1HZ LYS 33 -14.099 -14.716 1.249 250 HZ3 LYS 33 2HZ LYS 33 -14.580 -13.099 1.127 251 H GLU 34 H GLU 34 -9.941 -9.565 1.416 252 HA GLU 34 HA GLU 34 -10.033 -11.981 -0.086 253 HB2 GLU 34 2HB GLU 34 -10.591 -9.742 -1.013 254 HB3 GLU 34 1HB GLU 34 -8.886 -9.305 -0.900 255 HG2 GLU 34 2HG GLU 34 -8.340 -10.444 -2.745 256 HG3 GLU 34 1HG GLU 34 -9.408 -11.800 -2.345 257 H ALA 35 H ALA 35 -7.367 -9.829 0.872 258 HA ALA 35 HA ALA 35 -5.272 -11.230 -0.296 259 HB1 ALA 35 1HB ALA 35 -4.051 -10.237 1.877 260 HB2 ALA 35 2HB ALA 35 -5.533 -9.280 1.903 261 HB3 ALA 35 3HB ALA 35 -4.492 -9.256 0.480 262 H ALA 36 H ALA 36 -7.159 -11.997 2.497 263 HA ALA 36 HA ALA 36 -5.339 -13.709 3.814 264 HB1 ALA 36 1HB ALA 36 -7.154 -12.968 5.094 265 HB2 ALA 36 2HB ALA 36 -7.484 -14.677 4.813 266 HB3 ALA 36 3HB ALA 36 -8.329 -13.449 3.869 267 H ALA 37 H ALA 37 -7.744 -14.248 1.287 268 HA ALA 37 HA ALA 37 -7.784 -17.024 1.246 269 HB1 ALA 37 1HB ALA 37 -8.893 -15.011 -0.274 270 HB2 ALA 37 2HB ALA 37 -9.112 -16.743 -0.524 271 HB3 ALA 37 3HB ALA 37 -7.870 -15.873 -1.424 272 H SER 38 H SER 38 -6.046 -15.135 -1.219 273 HA SER 38 HA SER 38 -4.297 -17.307 -1.815 274 HB2 SER 38 2HB SER 38 -4.629 -14.497 -2.751 275 HB3 SER 38 1HB SER 38 -3.059 -15.271 -3.031 276 HG SER 38 HG SER 38 -4.647 -15.562 -4.737 277 H GLY 39 H GLY 39 -4.155 -14.548 0.301 278 HA2 GLY 39 2HA GLY 39 -2.719 -14.322 2.137 279 HA3 GLY 39 1HA GLY 39 -1.686 -15.582 1.452 280 H LEU 40 H LEU 40 -2.758 -12.871 -0.468 281 HA LEU 40 HA LEU 40 0.016 -12.047 -0.768 282 HB2 LEU 40 2HB LEU 40 -0.657 -10.861 -2.696 283 HB3 LEU 40 1HB LEU 40 -1.508 -12.392 -2.734 284 HG LEU 40 HG LEU 40 -3.324 -10.770 -1.477 285 HD11 LEU 40 1HD1 LEU 40 -3.277 -8.639 -2.201 286 HD12 LEU 40 2HD1 LEU 40 -2.534 -9.065 -3.744 287 HD13 LEU 40 3HD1 LEU 40 -1.544 -8.958 -2.289 288 HD21 LEU 40 3HD2 LEU 40 -3.924 -10.564 -4.187 289 HD22 LEU 40 1HD2 LEU 40 -4.448 -11.829 -3.077 290 HD23 LEU 40 2HD2 LEU 40 -2.988 -12.051 -4.042 291 HA PRO 41 HA PRO 41 -0.158 -8.573 1.920 292 HB2 PRO 41 2HB PRO 41 1.420 -6.795 0.568 293 HB3 PRO 41 1HB PRO 41 2.047 -8.165 1.490 294 HG2 PRO 41 2HG PRO 41 1.555 -7.934 -1.454 295 HG3 PRO 41 1HG PRO 41 2.952 -8.623 -0.606 296 HD2 PRO 41 2HD PRO 41 1.037 -10.184 -1.643 297 HD3 PRO 41 1HD PRO 41 1.829 -10.593 -0.107 298 H LEU 42 H LEU 42 -0.720 -6.290 2.075 299 HA LEU 42 HA LEU 42 -2.884 -5.636 0.229 300 HB2 LEU 42 2HB LEU 42 -2.210 -4.980 3.028 301 HB3 LEU 42 1HB LEU 42 -2.996 -3.703 2.121 302 HG LEU 42 HG LEU 42 -4.890 -5.162 1.650 303 HD11 LEU 42 1HD1 LEU 42 -5.005 -7.380 2.136 304 HD12 LEU 42 2HD1 LEU 42 -3.907 -7.252 3.511 305 HD13 LEU 42 3HD1 LEU 42 -3.268 -7.244 1.869 306 HD21 LEU 42 3HD2 LEU 42 -5.881 -4.833 3.660 307 HD22 LEU 42 1HD2 LEU 42 -4.408 -3.912 3.960 308 HD23 LEU 42 2HD2 LEU 42 -4.553 -5.565 4.560 309 H MET 43 H MET 43 -2.871 -3.957 -1.132 310 HA MET 43 HA MET 43 -0.398 -2.458 -1.444 311 HB2 MET 43 2HB MET 43 -1.766 -3.600 -3.345 312 HB3 MET 43 1HB MET 43 -2.816 -2.190 -3.213 313 HG2 MET 43 2HG MET 43 -1.076 -2.064 -4.996 314 HG3 MET 43 1HG MET 43 -1.078 -0.723 -3.856 315 HE1 MET 43 3HE MET 43 1.829 -1.077 -1.698 316 HE2 MET 43 1HE MET 43 0.294 -0.323 -2.129 317 HE3 MET 43 2HE MET 43 1.752 0.059 -3.044 318 H VAL 44 H VAL 44 -0.293 -0.773 -0.062 319 HA VAL 44 HA VAL 44 -2.674 0.874 0.310 320 HB VAL 44 HB VAL 44 -0.068 0.998 1.817 321 HG11 VAL 44 1HG1 VAL 44 -1.059 3.089 2.085 322 HG12 VAL 44 2HG1 VAL 44 -1.637 2.186 3.485 323 HG13 VAL 44 3HG1 VAL 44 -2.692 2.422 2.090 324 HG21 VAL 44 3HG2 VAL 44 -2.561 -0.574 2.196 325 HG22 VAL 44 1HG2 VAL 44 -1.726 0.042 3.621 326 HG23 VAL 44 2HG2 VAL 44 -0.884 -1.021 2.495 327 H ILE 45 H ILE 45 -2.919 2.726 -0.655 328 HA ILE 45 HA ILE 45 -0.572 4.261 -1.500 329 HB ILE 45 HB ILE 45 -2.974 3.699 -3.250 330 HG12 ILE 45 2HG1 ILE 45 -0.162 3.108 -4.060 331 HG13 ILE 45 1HG1 ILE 45 -0.952 2.008 -2.921 332 HG21 ILE 45 1HG2 ILE 45 -1.265 5.948 -3.200 333 HG22 ILE 45 2HG2 ILE 45 -2.503 5.543 -4.388 334 HG23 ILE 45 3HG2 ILE 45 -0.842 5.002 -4.629 335 HD11 ILE 45 3HD1 ILE 45 -2.870 2.195 -4.775 336 HD12 ILE 45 1HD1 ILE 45 -1.586 0.987 -4.819 337 HD13 ILE 45 2HD1 ILE 45 -1.450 2.457 -5.788 338 H ILE 46 H ILE 46 -0.813 5.906 -0.069 339 HA ILE 46 HA ILE 46 -3.440 7.203 0.047 340 HB ILE 46 HB ILE 46 -1.231 7.489 2.073 341 HG12 ILE 46 2HG1 ILE 46 -3.602 5.924 2.808 342 HG13 ILE 46 1HG1 ILE 46 -2.599 5.160 1.577 343 HG21 ILE 46 1HG2 ILE 46 -3.111 9.217 1.823 344 HG22 ILE 46 2HG2 ILE 46 -2.802 8.555 3.428 345 HG23 ILE 46 3HG2 ILE 46 -4.158 7.962 2.474 346 HD11 ILE 46 3HD1 ILE 46 -2.104 4.579 3.986 347 HD12 ILE 46 1HD1 ILE 46 -1.481 6.220 4.152 348 HD13 ILE 46 2HD1 ILE 46 -0.733 5.104 3.010 349 H HIS 47 H HIS 47 -3.621 9.388 -0.201 350 HA HIS 47 HA HIS 47 -1.209 10.932 -0.803 351 HB2 HIS 47 2HB HIS 47 -2.293 11.767 -2.919 352 HB3 HIS 47 1HB HIS 47 -1.779 10.074 -2.967 353 HD1 HIS 47 1HD HIS 47 -4.397 11.949 -4.185 354 HD2 HIS 47 2HD HIS 47 -4.299 8.487 -1.873 355 HE1 HIS 47 1HE HIS 47 -6.648 10.875 -4.485 356 HE2 HIS 47 2HE HIS 47 -6.615 8.868 -2.966 357 H LYS 48 H LYS 48 -1.379 12.686 0.456 358 HA LYS 48 HA LYS 48 -4.060 13.936 0.658 359 HB2 LYS 48 2HB LYS 48 -2.137 13.222 2.739 360 HB3 LYS 48 1HB LYS 48 -2.715 14.875 2.862 361 HG2 LYS 48 2HG LYS 48 -5.060 13.795 2.593 362 HG3 LYS 48 1HG LYS 48 -4.233 12.314 3.076 363 HD2 LYS 48 2HD LYS 48 -4.493 12.951 5.193 364 HD3 LYS 48 1HD LYS 48 -3.355 14.263 4.875 365 HE2 LYS 48 2HE LYS 48 -6.165 14.689 4.050 366 HE3 LYS 48 1HE LYS 48 -5.836 14.675 5.781 367 HZ1 LYS 48 3HZ LYS 48 -5.392 16.832 5.418 368 HZ2 LYS 48 1HZ LYS 48 -5.080 16.621 3.769 369 HZ3 LYS 48 2HZ LYS 48 -3.883 16.262 4.909 370 H SER 49 H SER 49 -3.590 15.243 -1.171 371 HA SER 49 HA SER 49 -2.914 17.141 -2.228 372 HB2 SER 49 2HB SER 49 -2.913 17.841 0.655 373 HB3 SER 49 1HB SER 49 -2.075 18.956 -0.423 374 HG SER 49 HG SER 49 -4.698 18.031 -0.936 375 H TRP 50 H TRP 50 -1.052 18.544 -2.744 376 HA TRP 50 HA TRP 50 1.117 18.623 -3.476 377 HB2 TRP 50 2HB TRP 50 2.100 17.916 -0.752 378 HB3 TRP 50 1HB TRP 50 2.572 19.250 -1.815 379 HD1 TRP 50 HD TRP 50 0.213 18.367 1.013 380 HE1 TRP 50 1HE TRP 50 -1.026 20.489 1.779 381 HE3 TRP 50 3HE TRP 50 1.634 21.539 -2.737 382 HZ2 TRP 50 2HZ TRP 50 -1.357 23.152 0.911 383 HZ3 TRP 50 3HZ TRP 50 0.811 23.857 -2.696 384 HH2 TRP 50 HH TRP 50 -0.654 24.646 -0.908 385 H CYS 51 H CYS 51 -0.149 16.015 -3.621 386 HA CYS 51 HA CYS 51 2.123 14.214 -3.175 387 HB2 CYS 51 2HB CYS 51 0.253 13.277 -2.133 388 HB3 CYS 51 1HB CYS 51 -0.840 13.790 -3.409 389 H GLY 52 H GLY 52 3.419 14.315 -4.954 390 HA2 GLY 52 2HA GLY 52 2.241 14.428 -7.618 391 HA3 GLY 52 1HA GLY 52 3.965 14.464 -7.238 392 H ALA 53 H ALA 53 3.611 12.102 -5.440 393 HA ALA 53 HA ALA 53 4.340 10.082 -7.231 394 HB1 ALA 53 1HB ALA 53 3.675 10.231 -4.360 395 HB2 ALA 53 2HB ALA 53 5.073 9.521 -5.166 396 HB3 ALA 53 3HB ALA 53 3.546 8.641 -5.113 397 H CYS 54 H CYS 54 1.267 11.295 -6.378 398 HA CYS 54 HA CYS 54 -0.032 8.938 -7.539 399 HB2 CYS 54 2HB CYS 54 -2.121 9.847 -6.487 400 HB3 CYS 54 1HB CYS 54 -0.866 9.386 -5.329 401 H LYS 55 H LYS 55 0.667 12.273 -7.984 402 HA LYS 55 HA LYS 55 -1.434 12.998 -9.712 403 HB2 LYS 55 2HB LYS 55 0.467 14.413 -8.533 404 HB3 LYS 55 1HB LYS 55 1.279 14.178 -10.075 405 HG2 LYS 55 2HG LYS 55 -0.803 15.083 -11.175 406 HG3 LYS 55 1HG LYS 55 -1.347 15.546 -9.554 407 HD2 LYS 55 2HD LYS 55 0.537 16.996 -9.271 408 HD3 LYS 55 1HD LYS 55 1.283 16.405 -10.756 409 HE2 LYS 55 2HE LYS 55 -0.385 17.431 -12.101 410 HE3 LYS 55 1HE LYS 55 -1.390 17.784 -10.699 411 HZ1 LYS 55 3HZ LYS 55 0.288 19.335 -9.925 412 HZ2 LYS 55 1HZ LYS 55 -0.222 19.750 -11.483 413 HZ3 LYS 55 2HZ LYS 55 1.270 18.984 -11.255 414 H ALA 56 H ALA 56 1.929 12.002 -10.502 415 HA ALA 56 HA ALA 56 1.232 11.743 -13.301 416 HB1 ALA 56 1HB ALA 56 3.593 10.808 -13.443 417 HB2 ALA 56 2HB ALA 56 3.741 11.204 -11.731 418 HB3 ALA 56 3HB ALA 56 3.437 12.481 -12.909 419 H LEU 57 H LEU 57 1.177 9.760 -10.522 420 HA LEU 57 HA LEU 57 1.476 7.258 -11.833 421 HB2 LEU 57 2HB LEU 57 0.786 8.209 -9.138 422 HB3 LEU 57 1HB LEU 57 0.106 6.655 -9.575 423 HG LEU 57 HG LEU 57 2.276 6.499 -8.371 424 HD11 LEU 57 1HD1 LEU 57 1.680 4.612 -9.642 425 HD12 LEU 57 2HD1 LEU 57 3.354 4.964 -10.074 426 HD13 LEU 57 3HD1 LEU 57 2.045 5.422 -11.165 427 HD21 LEU 57 3HD2 LEU 57 3.529 7.543 -10.895 428 HD22 LEU 57 1HD2 LEU 57 4.303 7.198 -9.349 429 HD23 LEU 57 2HD2 LEU 57 3.208 8.572 -9.501 430 H LYS 58 H LYS 58 -1.154 9.484 -11.567 431 HA LYS 58 HA LYS 58 -3.240 7.557 -11.780 432 HB2 LYS 58 2HB LYS 58 -3.713 9.750 -10.880 433 HB3 LYS 58 1HB LYS 58 -3.245 10.514 -12.387 434 HG2 LYS 58 2HG LYS 58 -5.140 9.041 -13.403 435 HG3 LYS 58 1HG LYS 58 -5.705 8.970 -11.733 436 HD2 LYS 58 2HD LYS 58 -6.738 10.906 -12.148 437 HD3 LYS 58 1HD LYS 58 -5.136 11.646 -12.104 438 HE2 LYS 58 2HE LYS 58 -5.248 10.675 -14.655 439 HE3 LYS 58 1HE LYS 58 -6.923 11.145 -14.369 440 HZ1 LYS 58 3HZ LYS 58 -6.255 13.185 -14.903 441 HZ2 LYS 58 1HZ LYS 58 -4.615 12.788 -14.782 442 HZ3 LYS 58 2HZ LYS 58 -5.479 13.242 -13.400 443 HA PRO 59 HA PRO 59 -3.335 8.620 -16.471 444 HB2 PRO 59 2HB PRO 59 -0.838 9.993 -17.102 445 HB3 PRO 59 1HB PRO 59 -2.507 10.494 -17.425 446 HG2 PRO 59 2HG PRO 59 -0.925 11.728 -15.609 447 HG3 PRO 59 1HG PRO 59 -2.686 11.630 -15.440 448 HD2 PRO 59 2HD PRO 59 -0.552 10.003 -14.106 449 HD3 PRO 59 1HD PRO 59 -2.049 10.679 -13.426 450 H LYS 60 H LYS 60 -0.369 7.759 -14.883 451 HA LYS 60 HA LYS 60 0.494 6.128 -17.152 452 HB2 LYS 60 2HB LYS 60 2.570 5.897 -16.096 453 HB3 LYS 60 1HB LYS 60 2.085 7.542 -15.705 454 HG2 LYS 60 2HG LYS 60 1.264 6.760 -13.539 455 HG3 LYS 60 1HG LYS 60 1.818 5.135 -13.917 456 HD2 LYS 60 2HD LYS 60 3.408 6.377 -12.484 457 HD3 LYS 60 1HD LYS 60 4.102 5.883 -14.024 458 HE2 LYS 60 2HE LYS 60 3.035 8.419 -14.486 459 HE3 LYS 60 1HE LYS 60 3.807 8.524 -12.907 460 HZ1 LYS 60 3HZ LYS 60 5.848 8.237 -13.788 461 HZ2 LYS 60 1HZ LYS 60 5.113 8.866 -15.178 462 HZ3 LYS 60 2HZ LYS 60 5.317 7.195 -15.009 463 H PHE 61 H PHE 61 -0.528 5.814 -13.763 464 HA PHE 61 HA PHE 61 -0.284 3.015 -13.642 465 HB2 PHE 61 2HB PHE 61 -0.662 4.578 -11.677 466 HB3 PHE 61 1HB PHE 61 -2.367 4.604 -12.144 467 HD1 PHE 61 1HD PHE 61 -3.736 2.583 -11.880 468 HD2 PHE 61 2HD PHE 61 0.351 2.675 -10.701 469 HE1 PHE 61 1HE PHE 61 -4.064 0.514 -10.584 470 HE2 PHE 61 2HE PHE 61 0.031 0.611 -9.405 471 HZ PHE 61 HZ PHE 61 -2.171 -0.471 -9.346 472 H ALA 62 H ALA 62 -2.397 5.083 -15.329 473 HA ALA 62 HA ALA 62 -4.667 3.462 -15.615 474 HB1 ALA 62 1HB ALA 62 -3.746 5.883 -16.677 475 HB2 ALA 62 2HB ALA 62 -5.313 5.126 -16.974 476 HB3 ALA 62 3HB ALA 62 -3.965 4.822 -18.071 477 H GLU 63 H GLU 63 -1.448 3.238 -16.638 478 HA GLU 63 HA GLU 63 -1.684 1.429 -18.830 479 HB2 GLU 63 2HB GLU 63 0.242 3.058 -18.260 480 HB3 GLU 63 1HB GLU 63 0.739 1.844 -17.078 481 HG2 GLU 63 2HG GLU 63 1.663 0.555 -18.639 482 HG3 GLU 63 1HG GLU 63 0.265 0.694 -19.705 483 H SER 64 H SER 64 -1.981 1.176 -15.498 484 HA SER 64 HA SER 64 -0.880 -1.259 -14.836 485 HB2 SER 64 2HB SER 64 -3.323 0.170 -13.846 486 HB3 SER 64 1HB SER 64 -2.755 -1.321 -13.114 487 HG SER 64 HG SER 64 -1.215 -0.251 -12.167 488 H THR 65 H THR 65 -2.962 -0.920 -17.341 489 HA THR 65 HA THR 65 -4.984 -2.746 -17.079 490 HB THR 65 HB THR 65 -3.477 -3.092 -19.577 491 HG1 THR 65 1HG THR 65 -4.388 -0.494 -18.907 492 HG21 THR 65 3HG2 THR 65 -6.200 -1.941 -19.047 493 HG22 THR 65 1HG2 THR 65 -5.846 -3.640 -19.369 494 HG23 THR 65 2HG2 THR 65 -5.546 -2.426 -20.612 495 H GLU 66 H GLU 66 -1.560 -3.285 -17.604 496 HA GLU 66 HA GLU 66 -1.840 -6.161 -17.627 497 HB2 GLU 66 2HB GLU 66 0.083 -4.448 -18.598 498 HB3 GLU 66 1HB GLU 66 0.843 -5.070 -17.126 499 HG2 GLU 66 2HG GLU 66 -0.273 -7.292 -18.388 500 HG3 GLU 66 1HG GLU 66 0.464 -6.341 -19.678 501 H ILE 67 H ILE 67 -1.152 -3.591 -15.379 502 HA ILE 67 HA ILE 67 -0.232 -5.322 -13.291 503 HB ILE 67 HB ILE 67 -1.418 -2.558 -13.036 504 HG12 ILE 67 2HG1 ILE 67 1.478 -3.393 -13.305 505 HG13 ILE 67 1HG1 ILE 67 0.520 -2.606 -14.567 506 HG21 ILE 67 1HG2 ILE 67 0.317 -2.739 -11.012 507 HG22 ILE 67 2HG2 ILE 67 -0.144 -4.436 -11.149 508 HG23 ILE 67 3HG2 ILE 67 -1.378 -3.207 -10.869 509 HD11 ILE 67 3HD1 ILE 67 2.137 -1.341 -12.775 510 HD12 ILE 67 1HD1 ILE 67 0.546 -1.158 -12.033 511 HD13 ILE 67 2HD1 ILE 67 0.824 -0.585 -13.680 512 H SER 68 H SER 68 -3.244 -4.707 -14.712 513 HA SER 68 HA SER 68 -4.950 -5.020 -12.470 514 HB2 SER 68 2HB SER 68 -5.266 -4.583 -15.237 515 HB3 SER 68 1HB SER 68 -6.113 -6.090 -14.892 516 HG SER 68 HG SER 68 -7.541 -4.438 -14.528 517 H GLU 69 H GLU 69 -3.275 -7.224 -14.600 518 HA GLU 69 HA GLU 69 -4.586 -9.535 -13.448 519 HB2 GLU 69 2HB GLU 69 -2.743 -10.731 -14.901 520 HB3 GLU 69 1HB GLU 69 -4.183 -10.058 -15.647 521 HG2 GLU 69 2HG GLU 69 -2.885 -8.015 -16.172 522 HG3 GLU 69 1HG GLU 69 -1.446 -8.821 -15.550 523 H LEU 70 H LEU 70 -1.439 -7.961 -13.461 524 HA LEU 70 HA LEU 70 -0.129 -9.830 -11.765 525 HB2 LEU 70 2HB LEU 70 0.361 -7.029 -12.651 526 HB3 LEU 70 1HB LEU 70 1.220 -7.592 -11.219 527 HG LEU 70 HG LEU 70 1.498 -9.555 -13.283 528 HD11 LEU 70 1HD1 LEU 70 2.218 -6.743 -14.089 529 HD12 LEU 70 2HD1 LEU 70 1.008 -7.772 -14.858 530 HD13 LEU 70 3HD1 LEU 70 2.716 -8.209 -14.936 531 HD21 LEU 70 3HD2 LEU 70 3.945 -8.428 -12.993 532 HD22 LEU 70 1HD2 LEU 70 3.264 -9.615 -11.880 533 HD23 LEU 70 2HD2 LEU 70 3.160 -7.894 -11.506 534 H SER 71 H SER 71 -2.449 -7.369 -11.246 535 HA SER 71 HA SER 71 -2.042 -6.338 -8.783 536 HB2 SER 71 2HB SER 71 -4.282 -6.725 -10.479 537 HB3 SER 71 1HB SER 71 -4.761 -7.168 -8.839 538 HG SER 71 HG SER 71 -3.760 -5.091 -8.224 539 H HIS 72 H HIS 72 -2.578 -9.691 -9.421 540 HA HIS 72 HA HIS 72 -3.668 -10.508 -6.981 541 HB2 HIS 72 2HB HIS 72 -3.658 -12.221 -8.534 542 HB3 HIS 72 1HB HIS 72 -2.042 -11.816 -9.124 543 HD1 HIS 72 1HD HIS 72 -3.804 -14.186 -7.021 544 HD2 HIS 72 2HD HIS 72 0.052 -12.657 -7.238 545 HE1 HIS 72 1HE HIS 72 -2.374 -15.786 -5.709 546 HE2 HIS 72 2HE HIS 72 -0.064 -14.782 -5.763 547 H ASN 73 H ASN 73 -0.710 -9.085 -7.713 548 HA ASN 73 HA ASN 73 0.983 -10.255 -5.785 549 HB2 ASN 73 2HB ASN 73 2.207 -7.983 -6.055 550 HB3 ASN 73 1HB ASN 73 2.103 -9.061 -7.447 551 HD21 ASN 73 1HD2 ASN 73 2.086 -7.706 -9.130 552 HD22 ASN 73 2HD2 ASN 73 0.934 -6.418 -9.350 553 H PHE 74 H PHE 74 -0.857 -7.204 -5.697 554 HA PHE 74 HA PHE 74 -0.903 -7.358 -2.784 555 HB2 PHE 74 2HB PHE 74 -0.488 -4.895 -4.490 556 HB3 PHE 74 1HB PHE 74 -0.618 -4.936 -2.734 557 HD1 PHE 74 2HD PHE 74 1.437 -6.035 -5.580 558 HD2 PHE 74 1HD PHE 74 1.257 -5.440 -1.375 559 HE1 PHE 74 2HE PHE 74 3.851 -6.455 -5.426 560 HE2 PHE 74 1HE PHE 74 3.677 -5.859 -1.211 561 HZ PHE 74 HZ PHE 74 4.978 -6.370 -3.240 562 H VAL 75 H VAL 75 -2.735 -5.626 -2.008 563 HA VAL 75 HA VAL 75 -4.954 -5.913 -3.921 564 HB VAL 75 HB VAL 75 -5.088 -7.652 -2.178 565 HG11 VAL 75 1HG1 VAL 75 -4.865 -5.313 -0.427 566 HG12 VAL 75 2HG1 VAL 75 -4.471 -7.004 -0.124 567 HG13 VAL 75 3HG1 VAL 75 -6.136 -6.447 0.026 568 HG21 VAL 75 3HG2 VAL 75 -7.441 -5.886 -1.706 569 HG22 VAL 75 1HG2 VAL 75 -7.378 -7.595 -2.133 570 HG23 VAL 75 2HG2 VAL 75 -7.088 -6.368 -3.365 571 H MET 76 H MET 76 -6.565 -4.567 -3.939 572 HA MET 76 HA MET 76 -6.431 -1.960 -3.938 573 HB2 MET 76 2HB MET 76 -9.031 -2.415 -3.092 574 HB3 MET 76 1HB MET 76 -8.450 -2.435 -4.740 575 HG2 MET 76 2HG MET 76 -8.245 -4.903 -3.082 576 HG3 MET 76 1HG MET 76 -9.781 -4.476 -3.790 577 HE1 MET 76 3HE MET 76 -10.544 -5.397 -5.804 578 HE2 MET 76 1HE MET 76 -9.625 -5.681 -7.281 579 HE3 MET 76 2HE MET 76 -9.900 -4.033 -6.718 580 H VAL 77 H VAL 77 -5.478 -0.737 -2.324 581 HA VAL 77 HA VAL 77 -7.183 -0.144 -0.088 582 HB VAL 77 HB VAL 77 -4.441 -1.291 0.408 583 HG11 VAL 77 1HG1 VAL 77 -5.308 -0.743 2.885 584 HG12 VAL 77 2HG1 VAL 77 -6.032 0.614 2.022 585 HG13 VAL 77 3HG1 VAL 77 -4.287 0.361 1.963 586 HG21 VAL 77 3HG2 VAL 77 -5.951 -3.035 0.404 587 HG22 VAL 77 1HG2 VAL 77 -7.241 -2.044 1.085 588 HG23 VAL 77 2HG2 VAL 77 -5.907 -2.577 2.107 589 H ASN 78 H ASN 78 -7.068 1.712 -1.691 590 HA ASN 78 HA ASN 78 -4.770 3.444 -1.146 591 HB2 ASN 78 2HB ASN 78 -4.941 3.716 -3.375 592 HB3 ASN 78 1HB ASN 78 -6.581 3.088 -3.417 593 HD21 ASN 78 1HD2 ASN 78 -4.746 5.931 -2.436 594 HD22 ASN 78 2HD2 ASN 78 -5.937 7.093 -2.925 595 H LEU 79 H LEU 79 -5.032 4.681 0.562 596 HA LEU 79 HA LEU 79 -7.718 5.574 1.312 597 HB2 LEU 79 2HB LEU 79 -6.883 4.737 3.233 598 HB3 LEU 79 1HB LEU 79 -5.220 4.992 2.752 599 HG LEU 79 HG LEU 79 -5.602 7.459 3.284 600 HD11 LEU 79 1HD1 LEU 79 -7.442 8.142 4.498 601 HD12 LEU 79 2HD1 LEU 79 -7.848 6.500 5.002 602 HD13 LEU 79 3HD1 LEU 79 -8.162 7.018 3.346 603 HD21 LEU 79 3HD2 LEU 79 -5.347 5.198 5.164 604 HD22 LEU 79 1HD2 LEU 79 -5.677 6.781 5.869 605 HD23 LEU 79 2HD2 LEU 79 -4.255 6.546 4.853 606 H GLU 80 H GLU 80 -8.312 7.683 1.523 607 HA GLU 80 HA GLU 80 -6.363 9.722 0.674 608 HB2 GLU 80 2HB GLU 80 -8.552 8.914 -0.797 609 HB3 GLU 80 1HB GLU 80 -9.162 10.337 0.054 610 HG2 GLU 80 2HG GLU 80 -6.515 10.723 -1.118 611 HG3 GLU 80 1HG GLU 80 -7.775 10.345 -2.305 612 H ASP 81 H ASP 81 -7.479 12.007 1.125 613 HA ASP 81 HA ASP 81 -7.476 12.374 3.878 614 HB2 ASP 81 2HB ASP 81 -8.273 14.642 3.424 615 HB3 ASP 81 1HB ASP 81 -7.038 14.173 2.260 616 H GLU 82 H GLU 82 -10.043 11.364 1.810 617 HA GLU 82 HA GLU 82 -12.329 12.215 3.049 618 HB2 GLU 82 2HB GLU 82 -12.114 10.726 1.006 619 HB3 GLU 82 1HB GLU 82 -11.947 9.372 2.116 620 HG2 GLU 82 2HG GLU 82 -14.152 9.197 2.061 621 HG3 GLU 82 1HG GLU 82 -14.213 10.685 3.005 622 H GLU 83 H GLU 83 -10.014 9.899 4.234 623 HA GLU 83 HA GLU 83 -11.778 9.113 6.426 624 HB2 GLU 83 2HB GLU 83 -10.388 7.424 5.177 625 HB3 GLU 83 1HB GLU 83 -8.961 8.172 5.882 626 HG2 GLU 83 2HG GLU 83 -9.216 7.066 7.785 627 HG3 GLU 83 1HG GLU 83 -10.915 7.540 7.908 628 H GLU 84 H GLU 84 -8.496 10.435 6.000 629 HA GLU 84 HA GLU 84 -7.204 11.762 7.319 630 HB2 GLU 84 2HB GLU 84 -9.232 13.235 7.029 631 HB3 GLU 84 1HB GLU 84 -9.796 12.649 8.588 632 HG2 GLU 84 2HG GLU 84 -7.185 13.479 9.048 633 HG3 GLU 84 1HG GLU 84 -7.867 14.700 7.975 634 HA PRO 85 HA PRO 85 -7.834 8.909 10.995 635 HB2 PRO 85 2HB PRO 85 -6.080 6.965 10.431 636 HB3 PRO 85 1HB PRO 85 -7.716 6.962 9.744 637 HG2 PRO 85 2HG PRO 85 -5.127 7.789 8.484 638 HG3 PRO 85 1HG PRO 85 -6.468 6.854 7.786 639 HD2 PRO 85 2HD PRO 85 -6.061 9.552 7.374 640 HD3 PRO 85 1HD PRO 85 -7.635 8.736 7.224 641 H LYS 86 H LYS 86 -6.772 9.614 12.737 642 HA LYS 86 HA LYS 86 -4.281 10.988 12.548 643 HB2 LYS 86 2HB LYS 86 -6.180 11.375 14.235 644 HB3 LYS 86 1HB LYS 86 -5.517 9.989 15.109 645 HG2 LYS 86 2HG LYS 86 -4.456 11.700 16.179 646 HG3 LYS 86 1HG LYS 86 -3.280 11.349 14.912 647 HD2 LYS 86 2HD LYS 86 -3.398 13.543 14.465 648 HD3 LYS 86 1HD LYS 86 -4.924 13.146 13.673 649 HE2 LYS 86 2HE LYS 86 -6.068 13.550 15.859 650 HE3 LYS 86 1HE LYS 86 -4.529 14.132 16.494 651 HZ1 LYS 86 3HZ LYS 86 -4.742 15.594 14.282 652 HZ2 LYS 86 1HZ LYS 86 -5.318 16.098 15.791 653 HZ3 LYS 86 2HZ LYS 86 -6.380 15.414 14.665 654 H ASP 87 H ASP 87 -3.050 9.239 11.535 655 HA ASP 87 HA ASP 87 -1.855 7.500 13.577 656 HB2 ASP 87 2HB ASP 87 -3.530 6.493 11.684 657 HB3 ASP 87 1HB ASP 87 -1.973 6.364 10.852 658 H GLU 88 H GLU 88 -0.005 6.252 11.883 659 HA GLU 88 HA GLU 88 1.576 8.496 10.828 660 HB2 GLU 88 2HB GLU 88 2.170 6.871 13.114 661 HB3 GLU 88 1HB GLU 88 3.384 6.594 11.871 662 HG2 GLU 88 2HG GLU 88 4.205 8.343 13.186 663 HG3 GLU 88 1HG GLU 88 3.606 9.105 11.715 664 H ASP 89 H ASP 89 0.370 5.339 10.403 665 HA ASP 89 HA ASP 89 2.232 4.054 8.853 666 HB2 ASP 89 2HB ASP 89 -0.687 3.946 9.154 667 HB3 ASP 89 1HB ASP 89 -0.106 3.381 7.582 668 H PHE 90 H PHE 90 0.322 6.843 8.008 669 HA PHE 90 HA PHE 90 0.576 6.586 5.193 670 HB2 PHE 90 2HB PHE 90 0.013 9.040 5.160 671 HB3 PHE 90 1HB PHE 90 -1.150 8.011 6.006 672 HD1 PHE 90 2HD PHE 90 1.931 9.987 6.766 673 HD2 PHE 90 1HD PHE 90 -1.960 8.781 7.993 674 HE1 PHE 90 2HE PHE 90 2.117 11.422 8.754 675 HE2 PHE 90 1HE PHE 90 -1.784 10.216 9.979 676 HZ PHE 90 HZ PHE 90 0.258 11.540 10.365 677 H SER 91 H SER 91 2.724 7.717 7.664 678 HA SER 91 HA SER 91 4.864 7.910 5.772 679 HB2 SER 91 2HB SER 91 3.802 10.145 5.502 680 HB3 SER 91 1HB SER 91 4.085 10.454 7.224 681 HG SER 91 HG SER 91 6.365 10.020 6.702 682 HA PRO 92 HA PRO 92 5.777 6.716 10.275 683 HB2 PRO 92 2HB PRO 92 7.116 4.507 8.807 684 HB3 PRO 92 1HB PRO 92 6.110 4.449 10.268 685 HG2 PRO 92 2HG PRO 92 5.164 3.604 7.920 686 HG3 PRO 92 1HG PRO 92 4.132 4.483 9.064 687 HD2 PRO 92 2HD PRO 92 5.452 5.459 6.563 688 HD3 PRO 92 1HD PRO 92 3.843 5.833 7.209 689 H ASP 93 H ASP 93 7.766 6.434 7.337 690 HA ASP 93 HA ASP 93 9.896 7.911 8.714 691 HB2 ASP 93 2HB ASP 93 10.002 5.142 7.913 692 HB3 ASP 93 1HB ASP 93 11.196 6.079 7.002 693 H GLY 94 H GLY 94 7.874 8.640 6.698 694 HA2 GLY 94 2HA GLY 94 9.515 9.046 4.301 695 HA3 GLY 94 1HA GLY 94 7.772 9.305 4.423 696 H GLY 95 H GLY 95 6.990 11.235 5.321 697 HA2 GLY 95 2HA GLY 95 8.243 13.254 6.606 698 HA3 GLY 95 1HA GLY 95 8.778 13.470 4.939 699 H TYR 96 H TYR 96 6.940 13.504 3.287 700 HA TYR 96 HA TYR 96 5.106 15.528 4.124 701 HB2 TYR 96 2HB TYR 96 4.348 15.593 1.823 702 HB3 TYR 96 1HB TYR 96 6.114 15.546 1.876 703 HD1 TYR 96 1HD TYR 96 3.108 13.427 1.320 704 HD2 TYR 96 2HD TYR 96 7.297 13.891 0.679 705 HE1 TYR 96 1HE TYR 96 3.079 11.529 -0.248 706 HE2 TYR 96 2HE TYR 96 7.268 12.003 -0.885 707 HH TYR 96 HH TYR 96 4.393 10.663 -2.112 708 H ILE 97 H ILE 97 2.749 15.372 3.495 709 HA ILE 97 HA ILE 97 1.702 12.795 4.434 710 HB ILE 97 HB ILE 97 0.015 13.919 5.669 711 HG12 ILE 97 2HG1 ILE 97 -0.797 15.591 4.145 712 HG13 ILE 97 1HG1 ILE 97 -0.254 16.415 5.606 713 HG21 ILE 97 1HG2 ILE 97 1.280 15.520 7.070 714 HG22 ILE 97 2HG2 ILE 97 2.588 15.445 5.890 715 HG23 ILE 97 3HG2 ILE 97 2.117 13.995 6.776 716 HD11 ILE 97 3HD1 ILE 97 1.129 16.305 2.939 717 HD12 ILE 97 1HD1 ILE 97 1.897 16.900 4.411 718 HD13 ILE 97 2HD1 ILE 97 0.468 17.711 3.773 719 HA PRO 98 HA PRO 98 0.899 10.825 3.629 720 HB2 PRO 98 2HB PRO 98 -1.727 10.408 2.156 721 HB3 PRO 98 1HB PRO 98 -0.977 9.329 3.367 722 HG2 PRO 98 2HG PRO 98 -2.504 11.679 3.832 723 HG3 PRO 98 1HG PRO 98 -1.645 10.666 5.029 724 HD2 PRO 98 2HD PRO 98 -0.787 13.087 4.640 725 HD3 PRO 98 1HD PRO 98 0.407 11.779 4.681 726 H ARG 99 H ARG 99 1.466 8.849 2.491 727 HA ARG 99 HA ARG 99 1.862 9.212 -0.401 728 HB2 ARG 99 2HB ARG 99 4.135 7.908 0.269 729 HB3 ARG 99 1HB ARG 99 4.015 9.663 0.137 730 HG2 ARG 99 2HG ARG 99 3.246 9.105 2.753 731 HG3 ARG 99 1HG ARG 99 4.587 8.012 2.441 732 HD2 ARG 99 2HD ARG 99 4.574 11.003 2.096 733 HD3 ARG 99 1HD ARG 99 5.404 10.089 3.354 734 HE ARG 99 HE ARG 99 6.172 9.381 0.670 735 HH11 ARG 99 1HH1 ARG 99 6.764 11.511 3.360 736 HH12 ARG 99 2HH1 ARG 99 8.409 11.819 2.918 737 HH21 ARG 99 1HH2 ARG 99 8.335 9.794 0.079 738 HH22 ARG 99 2HH2 ARG 99 9.297 10.842 1.066 739 H ILE 100 H ILE 100 3.219 6.957 -1.015 740 HA ILE 100 HA ILE 100 1.208 4.883 -0.549 741 HB ILE 100 HB ILE 100 3.542 4.805 -2.461 742 HG12 ILE 100 2HG1 ILE 100 0.683 5.636 -3.000 743 HG13 ILE 100 1HG1 ILE 100 2.061 6.730 -2.933 744 HG21 ILE 100 1HG2 ILE 100 0.968 3.237 -2.429 745 HG22 ILE 100 2HG2 ILE 100 2.528 2.636 -1.874 746 HG23 ILE 100 3HG2 ILE 100 2.298 3.054 -3.571 747 HD11 ILE 100 3HD1 ILE 100 2.764 4.745 -4.768 748 HD12 ILE 100 1HD1 ILE 100 2.321 6.419 -5.103 749 HD13 ILE 100 2HD1 ILE 100 1.087 5.160 -5.119 750 H LEU 101 H LEU 101 1.745 2.765 0.101 751 HA LEU 101 HA LEU 101 4.400 2.050 0.902 752 HB2 LEU 101 2HB LEU 101 3.315 1.640 3.337 753 HB3 LEU 101 1HB LEU 101 4.306 3.017 2.924 754 HG LEU 101 HG LEU 101 1.473 3.441 2.339 755 HD11 LEU 101 1HD1 LEU 101 2.340 2.997 5.184 756 HD12 LEU 101 2HD1 LEU 101 1.189 2.015 4.279 757 HD13 LEU 101 3HD1 LEU 101 0.801 3.689 4.676 758 HD21 LEU 101 3HD2 LEU 101 3.252 5.177 2.342 759 HD22 LEU 101 1HD2 LEU 101 3.404 4.959 4.086 760 HD23 LEU 101 2HD2 LEU 101 1.889 5.552 3.396 761 H PHE 102 H PHE 102 4.383 -0.103 2.104 762 HA PHE 102 HA PHE 102 2.086 -1.722 1.208 763 HB2 PHE 102 2HB PHE 102 4.971 -2.617 1.260 764 HB3 PHE 102 1HB PHE 102 3.595 -3.527 0.644 765 HD1 PHE 102 2HD PHE 102 5.283 -0.238 0.122 766 HD2 PHE 102 1HD PHE 102 3.245 -3.539 -1.619 767 HE1 PHE 102 2HE PHE 102 5.656 0.717 -2.112 768 HE2 PHE 102 1HE PHE 102 3.614 -2.592 -3.859 769 HZ PHE 102 HZ PHE 102 4.821 -0.460 -4.108 770 H LEU 103 H LEU 103 1.326 -3.301 2.587 771 HA LEU 103 HA LEU 103 2.718 -3.563 5.172 772 HB2 LEU 103 2HB LEU 103 -0.007 -3.886 5.729 773 HB3 LEU 103 1HB LEU 103 1.040 -2.591 6.236 774 HG LEU 103 HG LEU 103 0.347 -1.719 3.768 775 HD11 LEU 103 1HD1 LEU 103 -1.640 -3.691 4.610 776 HD12 LEU 103 2HD1 LEU 103 -1.345 -2.982 3.022 777 HD13 LEU 103 3HD1 LEU 103 -2.320 -2.113 4.208 778 HD21 LEU 103 3HD2 LEU 103 -1.642 -0.735 5.455 779 HD22 LEU 103 1HD2 LEU 103 -0.057 -0.026 5.146 780 HD23 LEU 103 2HD2 LEU 103 -0.283 -1.116 6.514 781 H ASP 104 H ASP 104 1.816 -5.402 6.483 782 HA ASP 104 HA ASP 104 1.860 -7.782 4.862 783 HB2 ASP 104 2HB ASP 104 1.518 -7.449 7.859 784 HB3 ASP 104 1HB ASP 104 1.811 -8.977 7.019 785 HA PRO 105 HA PRO 105 -2.414 -8.545 4.181 786 HB2 PRO 105 2HB PRO 105 -2.486 -11.168 5.280 787 HB3 PRO 105 1HB PRO 105 -2.287 -10.716 3.577 788 HG2 PRO 105 2HG PRO 105 -0.242 -11.471 5.591 789 HG3 PRO 105 1HG PRO 105 -0.228 -11.686 3.827 790 HD2 PRO 105 2HD PRO 105 1.287 -9.826 5.037 791 HD3 PRO 105 1HD PRO 105 0.543 -9.533 3.451 792 H SER 106 H SER 106 -3.040 -7.006 5.783 793 HA SER 106 HA SER 106 -4.957 -7.707 7.542 794 HB2 SER 106 2HB SER 106 -2.314 -8.273 8.692 795 HB3 SER 106 1HB SER 106 -3.313 -7.226 9.714 796 HG SER 106 HG SER 106 -4.808 -8.800 9.882 797 H GLY 107 H GLY 107 -2.201 -5.654 6.951 798 HA2 GLY 107 2HA GLY 107 -2.688 -3.310 6.447 799 HA3 GLY 107 1HA GLY 107 -3.822 -3.335 7.802 800 H LYS 108 H LYS 108 -0.573 -4.741 7.777 801 HA LYS 108 HA LYS 108 0.151 -2.779 9.869 802 HB2 LYS 108 2HB LYS 108 0.607 -5.689 9.604 803 HB3 LYS 108 1HB LYS 108 1.949 -4.755 10.252 804 HG2 LYS 108 2HG LYS 108 -0.626 -4.080 11.449 805 HG3 LYS 108 1HG LYS 108 -0.133 -5.765 11.703 806 HD2 LYS 108 2HD LYS 108 1.926 -5.079 12.705 807 HD3 LYS 108 1HD LYS 108 1.651 -3.396 12.250 808 HE2 LYS 108 2HE LYS 108 -0.032 -3.116 13.840 809 HE3 LYS 108 1HE LYS 108 -0.283 -4.852 14.015 810 HZ1 LYS 108 3HZ LYS 108 1.395 -5.035 15.481 811 HZ2 LYS 108 1HZ LYS 108 1.107 -3.388 15.741 812 HZ3 LYS 108 2HZ LYS 108 2.361 -3.876 14.716 813 H VAL 109 H VAL 109 0.887 -1.273 8.256 814 HA VAL 109 HA VAL 109 2.811 -1.849 6.305 815 HB VAL 109 HB VAL 109 1.386 0.337 6.772 816 HG11 VAL 109 1HG1 VAL 109 2.632 0.918 8.832 817 HG12 VAL 109 2HG1 VAL 109 2.715 2.176 7.598 818 HG13 VAL 109 3HG1 VAL 109 4.093 1.107 7.861 819 HG21 VAL 109 3HG2 VAL 109 3.460 1.475 5.433 820 HG22 VAL 109 1HG2 VAL 109 2.251 0.416 4.704 821 HG23 VAL 109 2HG2 VAL 109 3.804 -0.241 5.223 822 H HIS 110 H HIS 110 4.892 -2.066 6.256 823 HA HIS 110 HA HIS 110 6.371 -1.679 8.775 824 HB2 HIS 110 2HB HIS 110 6.136 -3.985 7.174 825 HB3 HIS 110 1HB HIS 110 7.752 -3.359 6.865 826 HD1 HIS 110 1HD HIS 110 5.587 -4.630 9.677 827 HD2 HIS 110 2HD HIS 110 9.570 -3.734 8.903 828 HE1 HIS 110 1HE HIS 110 6.869 -5.504 11.656 829 HE2 HIS 110 2HE HIS 110 9.265 -4.861 11.210 830 HA PRO 111 HA PRO 111 8.477 1.501 6.490 831 HB2 PRO 111 2HB PRO 111 10.632 1.795 8.142 832 HB3 PRO 111 1HB PRO 111 9.039 2.473 8.489 833 HG2 PRO 111 2HG PRO 111 10.298 -0.028 9.532 834 HG3 PRO 111 1HG PRO 111 9.338 1.184 10.395 835 HD2 PRO 111 2HD PRO 111 8.305 -1.180 9.583 836 HD3 PRO 111 1HD PRO 111 7.338 0.315 9.641 837 H GLU 112 H GLU 112 8.869 -1.286 5.704 838 HA GLU 112 HA GLU 112 11.703 -1.172 4.897 839 HB2 GLU 112 2HB GLU 112 9.975 -3.493 5.690 840 HB3 GLU 112 1HB GLU 112 11.318 -3.740 4.583 841 HG2 GLU 112 2HG GLU 112 12.885 -2.949 6.220 842 HG3 GLU 112 1HG GLU 112 11.576 -2.509 7.317 843 H ILE 113 H ILE 113 8.613 -2.668 3.933 844 HA ILE 113 HA ILE 113 9.333 -2.651 1.152 845 HB ILE 113 HB ILE 113 6.574 -3.070 2.300 846 HG12 ILE 113 2HG1 ILE 113 8.570 -5.252 1.694 847 HG13 ILE 113 1HG1 ILE 113 8.414 -4.541 3.307 848 HG21 ILE 113 1HG2 ILE 113 6.707 -2.707 -0.122 849 HG22 ILE 113 2HG2 ILE 113 6.184 -4.345 0.270 850 HG23 ILE 113 3HG2 ILE 113 7.842 -4.051 -0.253 851 HD11 ILE 113 3HD1 ILE 113 7.120 -6.496 3.333 852 HD12 ILE 113 1HD1 ILE 113 6.392 -6.137 1.767 853 HD13 ILE 113 2HD1 ILE 113 5.964 -5.172 3.181 854 H ILE 114 H ILE 114 9.795 -0.436 0.843 855 HA ILE 114 HA ILE 114 7.422 1.307 0.746 856 HB ILE 114 HB ILE 114 9.193 3.185 0.775 857 HG12 ILE 114 2HG1 ILE 114 10.914 0.955 0.931 858 HG13 ILE 114 1HG1 ILE 114 11.349 2.650 1.058 859 HG21 ILE 114 1HG2 ILE 114 8.614 1.580 3.256 860 HG22 ILE 114 2HG2 ILE 114 7.574 2.810 2.540 861 HG23 ILE 114 3HG2 ILE 114 9.139 3.264 3.216 862 HD11 ILE 114 3HD1 ILE 114 11.311 2.578 3.406 863 HD12 ILE 114 1HD1 ILE 114 12.144 1.110 2.892 864 HD13 ILE 114 2HD1 ILE 114 10.464 1.031 3.425 865 H ASN 115 H ASN 115 10.630 1.795 -0.644 866 HA ASN 115 HA ASN 115 10.081 1.117 -3.288 867 HB2 ASN 115 2HB ASN 115 8.444 2.899 -3.284 868 HB3 ASN 115 1HB ASN 115 9.606 4.021 -2.560 869 HD21 ASN 115 1HD2 ASN 115 9.173 5.436 -4.300 870 HD22 ASN 115 2HD2 ASN 115 9.914 5.181 -5.857 871 H GLU 116 H GLU 116 12.206 0.497 -2.012 872 HA GLU 116 HA GLU 116 14.303 2.217 -1.610 873 HB2 GLU 116 2HB GLU 116 14.257 -0.644 -2.545 874 HB3 GLU 116 1HB GLU 116 15.768 0.208 -2.202 875 HG2 GLU 116 2HG GLU 116 13.538 -0.010 -0.205 876 HG3 GLU 116 1HG GLU 116 14.800 -1.227 -0.349 877 H ASN 117 H ASN 117 12.960 1.158 -4.621 878 HA ASN 117 HA ASN 117 15.215 1.869 -6.236 879 HB2 ASN 117 2HB ASN 117 12.507 0.811 -6.660 880 HB3 ASN 117 1HB ASN 117 13.067 1.889 -7.948 881 HD21 ASN 117 1HD2 ASN 117 13.907 -0.982 -6.081 882 HD22 ASN 117 2HD2 ASN 117 14.878 -1.723 -7.324 883 H GLY 118 H GLY 118 12.649 3.617 -4.759 884 HA2 GLY 118 2HA GLY 118 12.718 5.812 -6.659 885 HA3 GLY 118 1HA GLY 118 11.783 5.744 -5.163 886 H ASN 119 H ASN 119 12.389 7.831 -4.546 887 HA ASN 119 HA ASN 119 14.971 8.860 -4.478 888 HB2 ASN 119 2HB ASN 119 12.414 9.476 -3.101 889 HB3 ASN 119 1HB ASN 119 13.885 10.129 -2.367 890 HD21 ASN 119 1HD2 ASN 119 13.618 12.233 -2.838 891 HD22 ASN 119 2HD2 ASN 119 13.558 12.874 -4.457 892 HA PRO 120 HA PRO 120 16.798 6.555 -1.161 893 HB2 PRO 120 2HB PRO 120 18.908 8.474 -0.852 894 HB3 PRO 120 1HB PRO 120 18.945 6.938 -1.730 895 HG2 PRO 120 2HG PRO 120 19.105 9.441 -2.901 896 HG3 PRO 120 1HG PRO 120 18.613 7.952 -3.739 897 HD2 PRO 120 2HD PRO 120 16.929 10.163 -2.632 898 HD3 PRO 120 1HD PRO 120 16.712 9.198 -4.115 899 H SER 121 H SER 121 14.699 8.378 -0.290 900 HA SER 121 HA SER 121 15.357 8.543 2.450 901 HB2 SER 121 2HB SER 121 15.748 11.000 0.801 902 HB3 SER 121 1HB SER 121 14.960 11.191 2.377 903 HG SER 121 HG SER 121 17.388 9.769 2.065 904 H TYR 122 H TYR 122 13.454 9.773 -0.201 905 HA TYR 122 HA TYR 122 11.124 10.337 1.314 906 HB2 TYR 122 2HB TYR 122 12.055 10.595 -1.389 907 HB3 TYR 122 1HB TYR 122 10.442 9.895 -1.385 908 HD1 TYR 122 1HD TYR 122 11.658 12.258 1.167 909 HD2 TYR 122 2HD TYR 122 9.345 11.802 -2.372 910 HE1 TYR 122 1HE TYR 122 10.742 14.515 1.483 911 HE2 TYR 122 2HE TYR 122 8.418 14.059 -2.065 912 HH TYR 122 HH TYR 122 8.937 16.126 -0.950 913 H LYS 123 H LYS 123 12.268 7.578 -0.553 914 HA LYS 123 HA LYS 123 11.455 5.466 -0.866 915 HB2 LYS 123 2HB LYS 123 10.692 6.014 2.002 916 HB3 LYS 123 1HB LYS 123 10.551 4.427 1.261 917 HG2 LYS 123 2HG LYS 123 13.088 6.011 1.606 918 HG3 LYS 123 1HG LYS 123 12.588 4.597 2.552 919 HD2 LYS 123 2HD LYS 123 13.545 3.267 1.051 920 HD3 LYS 123 1HD LYS 123 12.461 3.894 -0.198 921 HE2 LYS 123 2HE LYS 123 14.276 5.903 0.001 922 HE3 LYS 123 1HE LYS 123 15.284 4.499 0.343 923 HZ1 LYS 123 3HZ LYS 123 15.252 3.917 -1.785 924 HZ2 LYS 123 1HZ LYS 123 14.528 5.406 -2.133 925 HZ3 LYS 123 2HZ LYS 123 13.568 4.037 -1.884 926 H TYR 124 H TYR 124 8.863 6.141 1.385 927 HA TYR 124 HA TYR 124 6.767 4.994 0.204 928 HB2 TYR 124 2HB TYR 124 6.687 7.691 1.563 929 HB3 TYR 124 1HB TYR 124 5.307 6.609 1.332 930 HD1 TYR 124 1HD TYR 124 5.118 4.559 2.617 931 HD2 TYR 124 2HD TYR 124 8.377 7.214 3.233 932 HE1 TYR 124 1HE TYR 124 5.645 3.407 4.725 933 HE2 TYR 124 2HE TYR 124 8.918 6.072 5.342 934 HH TYR 124 HH TYR 124 6.802 3.812 6.806 935 H PHE 125 H PHE 125 8.206 7.988 -0.886 936 HA PHE 125 HA PHE 125 6.079 8.820 -2.578 937 HB2 PHE 125 2HB PHE 125 7.736 10.413 -1.824 938 HB3 PHE 125 1HB PHE 125 9.031 9.478 -2.577 939 HD1 PHE 125 1HD PHE 125 5.792 11.058 -3.584 940 HD2 PHE 125 2HD PHE 125 9.873 10.308 -4.526 941 HE1 PHE 125 1HE PHE 125 5.561 12.398 -5.632 942 HE2 PHE 125 2HE PHE 125 9.648 11.645 -6.580 943 HZ PHE 125 HZ PHE 125 7.488 12.690 -7.133 944 H TYR 126 H TYR 126 5.402 7.788 -4.339 945 HA TYR 126 HA TYR 126 7.253 6.053 -5.800 946 HB2 TYR 126 2HB TYR 126 4.427 5.970 -5.215 947 HB3 TYR 126 1HB TYR 126 4.691 5.881 -6.962 948 HD1 TYR 126 1HD TYR 126 6.506 4.162 -7.735 949 HD2 TYR 126 2HD TYR 126 4.545 4.027 -3.964 950 HE1 TYR 126 1HE TYR 126 7.060 1.774 -7.540 951 HE2 TYR 126 2HE TYR 126 5.093 1.639 -3.756 952 HH TYR 126 HH TYR 126 7.328 0.129 -5.236 953 H VAL 127 H VAL 127 7.172 6.087 -8.182 954 HA VAL 127 HA VAL 127 6.157 8.336 -9.587 955 HB VAL 127 HB VAL 127 8.510 9.097 -10.320 956 HG11 VAL 127 1HG1 VAL 127 8.392 10.892 -8.885 957 HG12 VAL 127 2HG1 VAL 127 7.926 9.891 -7.508 958 HG13 VAL 127 3HG1 VAL 127 6.753 10.246 -8.775 959 HG21 VAL 127 3HG2 VAL 127 9.613 7.189 -9.062 960 HG22 VAL 127 1HG2 VAL 127 9.273 8.094 -7.588 961 HG23 VAL 127 2HG2 VAL 127 10.316 8.789 -8.829 962 H SER 128 H SER 128 5.429 7.042 -11.160 963 HA SER 128 HA SER 128 5.748 6.188 -13.325 964 HB2 SER 128 2HB SER 128 7.768 5.463 -14.179 965 HB3 SER 128 1HB SER 128 8.309 6.612 -12.946 966 HG SER 128 HG SER 128 8.864 4.020 -13.143 967 H ALA 129 H ALA 129 4.973 4.285 -14.073 968 HA ALA 129 HA ALA 129 4.198 2.322 -12.121 969 HB1 ALA 129 1HB ALA 129 2.879 1.352 -13.849 970 HB2 ALA 129 2HB ALA 129 3.786 2.198 -15.103 971 HB3 ALA 129 3HB ALA 129 2.742 3.103 -14.007 972 H GLU 130 H GLU 130 6.865 2.740 -14.189 973 HA GLU 130 HA GLU 130 7.451 0.041 -14.799 974 HB2 GLU 130 2HB GLU 130 8.941 2.619 -14.827 975 HB3 GLU 130 1HB GLU 130 9.900 1.135 -14.812 976 HG2 GLU 130 2HG GLU 130 9.641 1.009 -17.002 977 HG3 GLU 130 1HG GLU 130 7.909 0.740 -16.744 978 H GLN 131 H GLN 131 8.308 2.166 -12.102 979 HA GLN 131 HA GLN 131 9.929 0.148 -10.887 980 HB2 GLN 131 2HB GLN 131 10.061 1.632 -8.965 981 HB3 GLN 131 1HB GLN 131 10.570 2.394 -10.464 982 HG2 GLN 131 2HG GLN 131 8.209 3.353 -10.573 983 HG3 GLN 131 1HG GLN 131 8.060 2.853 -8.889 984 HE21 GLN 131 1HE2 GLN 131 8.474 4.403 -7.499 985 HE22 GLN 131 2HE2 GLN 131 9.582 5.709 -7.722 986 H VAL 132 H VAL 132 6.649 1.401 -10.375 987 HA VAL 132 HA VAL 132 6.097 0.116 -7.980 988 HB VAL 132 HB VAL 132 3.807 0.366 -8.408 989 HG11 VAL 132 1HG1 VAL 132 3.865 2.631 -9.874 990 HG12 VAL 132 2HG1 VAL 132 5.554 2.501 -9.379 991 HG13 VAL 132 3HG1 VAL 132 4.278 2.532 -8.164 992 HG21 VAL 132 3HG2 VAL 132 4.417 0.510 -11.345 993 HG22 VAL 132 1HG2 VAL 132 2.826 0.715 -10.620 994 HG23 VAL 132 2HG2 VAL 132 3.654 -0.838 -10.507 995 H VAL 133 H VAL 133 6.408 -1.168 -11.190 996 HA VAL 133 HA VAL 133 5.144 -3.675 -10.530 997 HB VAL 133 HB VAL 133 5.012 -2.784 -12.827 998 HG11 VAL 133 1HG1 VAL 133 6.916 -1.813 -13.533 999 HG12 VAL 133 2HG1 VAL 133 7.284 -3.436 -14.115 1000 HG13 VAL 133 3HG1 VAL 133 7.941 -2.881 -12.578 1001 HG21 VAL 133 3HG2 VAL 133 4.680 -5.152 -12.453 1002 HG22 VAL 133 1HG2 VAL 133 6.417 -5.439 -12.550 1003 HG23 VAL 133 2HG2 VAL 133 5.531 -4.901 -13.978 1004 H GLN 134 H GLN 134 8.469 -2.412 -10.742 1005 HA GLN 134 HA GLN 134 9.593 -5.068 -10.463 1006 HB2 GLN 134 2HB GLN 134 11.694 -3.652 -9.781 1007 HB3 GLN 134 1HB GLN 134 11.160 -3.694 -11.454 1008 HG2 GLN 134 2HG GLN 134 10.014 -1.576 -11.146 1009 HG3 GLN 134 1HG GLN 134 10.547 -1.527 -9.466 1010 HE21 GLN 134 1HE2 GLN 134 11.293 -0.770 -12.671 1011 HE22 GLN 134 2HE2 GLN 134 12.935 -0.237 -12.422 1012 H GLY 135 H GLY 135 8.482 -2.550 -8.385 1013 HA2 GLY 135 2HA GLY 135 9.637 -3.710 -5.990 1014 HA3 GLY 135 1HA GLY 135 8.543 -2.320 -6.068 1015 H MET 136 H MET 136 6.827 -4.044 -7.929 1016 HA MET 136 HA MET 136 5.186 -5.173 -5.831 1017 HB2 MET 136 2HB MET 136 4.843 -4.522 -8.712 1018 HB3 MET 136 1HB MET 136 3.836 -5.802 -8.051 1019 HG2 MET 136 2HG MET 136 2.795 -4.356 -6.534 1020 HG3 MET 136 1HG MET 136 4.028 -3.114 -6.741 1021 HE1 MET 136 3HE MET 136 0.920 -4.869 -8.094 1022 HE2 MET 136 1HE MET 136 0.148 -3.534 -8.946 1023 HE3 MET 136 2HE MET 136 0.478 -3.402 -7.219 1024 H LYS 137 H LYS 137 7.084 -6.203 -8.590 1025 HA LYS 137 HA LYS 137 6.436 -8.984 -8.285 1026 HB2 LYS 137 2HB LYS 137 7.990 -9.345 -10.105 1027 HB3 LYS 137 1HB LYS 137 6.950 -7.983 -10.481 1028 HG2 LYS 137 2HG LYS 137 8.926 -6.593 -9.490 1029 HG3 LYS 137 1HG LYS 137 9.858 -8.043 -9.865 1030 HD2 LYS 137 2HD LYS 137 8.264 -6.330 -11.767 1031 HD3 LYS 137 1HD LYS 137 10.009 -6.593 -11.756 1032 HE2 LYS 137 2HE LYS 137 7.984 -8.772 -12.240 1033 HE3 LYS 137 1HE LYS 137 8.756 -7.851 -13.527 1034 HZ1 LYS 137 3HZ LYS 137 10.692 -8.937 -13.262 1035 HZ2 LYS 137 1HZ LYS 137 9.718 -10.137 -12.574 1036 HZ3 LYS 137 2HZ LYS 137 10.547 -9.049 -11.580 1037 H GLU 138 H GLU 138 8.607 -6.850 -6.785 1038 HA GLU 138 HA GLU 138 10.622 -8.826 -6.166 1039 HB2 GLU 138 2HB GLU 138 10.350 -5.956 -5.928 1040 HB3 GLU 138 1HB GLU 138 10.908 -6.652 -4.410 1041 HG2 GLU 138 2HG GLU 138 12.850 -6.115 -5.591 1042 HG3 GLU 138 1HG GLU 138 12.665 -7.865 -5.779 1043 H ALA 139 H ALA 139 8.458 -6.833 -4.182 1044 HA ALA 139 HA ALA 139 8.718 -8.353 -1.835 1045 HB1 ALA 139 1HB ALA 139 6.258 -7.251 -1.547 1046 HB2 ALA 139 2HB ALA 139 6.940 -6.216 -2.803 1047 HB3 ALA 139 3HB ALA 139 7.771 -6.392 -1.256 1048 H GLN 140 H GLN 140 6.971 -8.908 -4.732 1049 HA GLN 140 HA GLN 140 4.864 -10.503 -3.802 1050 HB2 GLN 140 2HB GLN 140 6.062 -9.797 -6.335 1051 HB3 GLN 140 1HB GLN 140 5.612 -11.504 -6.313 1052 HG2 GLN 140 2HG GLN 140 3.451 -10.086 -5.201 1053 HG3 GLN 140 1HG GLN 140 3.960 -9.194 -6.636 1054 HE21 GLN 140 1HE2 GLN 140 3.113 -12.427 -5.490 1055 HE22 GLN 140 2HE2 GLN 140 2.446 -12.978 -6.985 1056 H GLU 141 H GLU 141 8.214 -11.126 -3.860 1057 HA GLU 141 HA GLU 141 7.845 -14.024 -3.909 1058 HB2 GLU 141 2HB GLU 141 9.610 -13.427 -5.314 1059 HB3 GLU 141 1HB GLU 141 10.221 -12.213 -4.185 1060 HG2 GLU 141 2HG GLU 141 11.182 -13.833 -2.794 1061 HG3 GLU 141 1HG GLU 141 10.270 -15.142 -3.543 1062 H ARG 142 H ARG 142 8.443 -11.456 -1.673 1063 HA ARG 142 HA ARG 142 9.179 -13.418 0.393 1064 HB2 ARG 142 2HB ARG 142 9.682 -11.095 1.635 1065 HB3 ARG 142 1HB ARG 142 10.868 -11.927 0.624 1066 HG2 ARG 142 2HG ARG 142 10.093 -10.507 -1.290 1067 HG3 ARG 142 1HG ARG 142 9.133 -9.581 -0.123 1068 HD2 ARG 142 2HD ARG 142 11.117 -8.367 -0.305 1069 HD3 ARG 142 1HD ARG 142 11.337 -9.322 1.171 1070 HE ARG 142 HE ARG 142 12.372 -10.570 -1.211 1071 HH11 ARG 142 1HH1 ARG 142 13.065 -8.390 1.425 1072 HH12 ARG 142 2HH1 ARG 142 14.778 -8.624 1.333 1073 HH21 ARG 142 1HH2 ARG 142 14.623 -10.878 -1.333 1074 HH22 ARG 142 2HH2 ARG 142 15.663 -10.036 -0.234 1075 H LEU 143 H LEU 143 6.628 -11.427 -0.640 1076 HA LEU 143 HA LEU 143 5.439 -11.295 2.027 1077 HB2 LEU 143 2HB LEU 143 4.822 -9.991 -0.601 1078 HB3 LEU 143 1HB LEU 143 3.598 -10.059 0.665 1079 HG LEU 143 HG LEU 143 4.976 -7.930 0.523 1080 HD11 LEU 143 1HD1 LEU 143 4.514 -7.547 2.686 1081 HD12 LEU 143 2HD1 LEU 143 5.420 -8.956 3.238 1082 HD13 LEU 143 3HD1 LEU 143 3.779 -9.148 2.618 1083 HD21 LEU 143 3HD2 LEU 143 7.185 -7.866 1.162 1084 HD22 LEU 143 1HD2 LEU 143 7.130 -9.383 0.265 1085 HD23 LEU 143 2HD2 LEU 143 7.093 -9.400 2.027 1086 H THR 144 H THR 144 4.542 -12.390 -1.247 1087 HA THR 144 HA THR 144 2.182 -13.708 -0.439 1088 HB THR 144 HB THR 144 2.085 -14.549 -2.649 1089 HG1 THR 144 1HG THR 144 4.881 -14.150 -2.706 1090 HG21 THR 144 3HG2 THR 144 2.566 -11.867 -2.247 1091 HG22 THR 144 1HG2 THR 144 1.916 -12.613 -3.707 1092 HG23 THR 144 2HG2 THR 144 3.647 -12.303 -3.570 1093 H GLY 145 H GLY 145 5.534 -14.678 -0.553 1094 HA2 GLY 145 2HA GLY 145 4.862 -17.484 -0.123 1095 HA3 GLY 145 1HA GLY 145 6.475 -16.821 -0.336 1096 H ASP 146 H ASP 146 4.512 -15.146 1.910 1097 HA ASP 146 HA ASP 146 4.662 -14.864 4.161 1098 HB2 ASP 146 2HB ASP 146 4.956 -17.850 3.915 1099 HB3 ASP 146 1HB ASP 146 4.958 -17.047 5.482 1100 H ALA 147 H ALA 147 7.094 -14.610 2.533 1101 HA ALA 147 HA ALA 147 9.209 -15.510 4.331 1102 HB1 ALA 147 1HB ALA 147 10.073 -13.850 2.114 1103 HB2 ALA 147 2HB ALA 147 9.075 -15.205 1.585 1104 HB3 ALA 147 3HB ALA 147 10.528 -15.501 2.537 1105 H PHE 148 H PHE 148 7.180 -13.262 4.843 1106 HA PHE 148 HA PHE 148 9.106 -11.104 5.378 1107 HB2 PHE 148 2HB PHE 148 7.196 -9.586 5.452 1108 HB3 PHE 148 1HB PHE 148 7.205 -10.481 3.927 1109 HD1 PHE 148 1HD PHE 148 5.640 -12.412 3.645 1110 HD2 PHE 148 2HD PHE 148 5.373 -9.713 6.924 1111 HE1 PHE 148 1HE PHE 148 3.332 -13.156 4.064 1112 HE2 PHE 148 2HE PHE 148 3.066 -10.454 7.350 1113 HZ PHE 148 HZ PHE 148 2.042 -12.177 5.919 1114 H ARG 149 H ARG 149 7.064 -13.460 6.811 1115 HA ARG 149 HA ARG 149 6.936 -12.127 9.380 1116 HB2 ARG 149 2HB ARG 149 5.930 -14.796 8.392 1117 HB3 ARG 149 1HB ARG 149 5.724 -14.224 10.036 1118 HG2 ARG 149 2HG ARG 149 4.593 -12.181 8.981 1119 HG3 ARG 149 1HG ARG 149 4.504 -13.166 7.521 1120 HD2 ARG 149 2HD ARG 149 3.098 -14.736 8.522 1121 HD3 ARG 149 1HD ARG 149 3.518 -14.211 10.151 1122 HE ARG 149 HE ARG 149 1.504 -13.095 8.431 1123 HH11 ARG 149 1HH1 ARG 149 3.627 -12.470 11.130 1124 HH12 ARG 149 2HH1 ARG 149 2.641 -11.200 11.772 1125 HH21 ARG 149 1HH2 ARG 149 0.207 -11.422 9.274 1126 HH22 ARG 149 2HH2 ARG 149 0.700 -10.604 10.720 1127 H LYS 150 H LYS 150 9.571 -12.611 8.564 1128 HA LYS 150 HA LYS 150 11.542 -13.504 9.264 1129 HB2 LYS 150 2HB LYS 150 10.089 -12.908 11.505 1130 HB3 LYS 150 1HB LYS 150 10.478 -14.602 11.775 1131 HG2 LYS 150 2HG LYS 150 12.894 -13.913 11.206 1132 HG3 LYS 150 1HG LYS 150 12.327 -12.268 11.498 1133 HD2 LYS 150 2HD LYS 150 11.374 -13.331 13.704 1134 HD3 LYS 150 1HD LYS 150 12.617 -14.547 13.400 1135 HE2 LYS 150 2HE LYS 150 14.325 -13.098 13.793 1136 HE3 LYS 150 1HE LYS 150 13.425 -11.704 13.198 1137 HZ1 LYS 150 3HZ LYS 150 13.530 -12.842 15.875 1138 HZ2 LYS 150 1HZ LYS 150 12.023 -12.262 15.368 1139 HZ3 LYS 150 2HZ LYS 150 13.363 -11.230 15.388 1140 H LYS 151 H LYS 151 12.598 -15.581 10.154 1141 HA LYS 151 HA LYS 151 11.285 -17.836 8.827 1142 HB2 LYS 151 2HB LYS 151 14.136 -17.580 9.802 1143 HB3 LYS 151 1HB LYS 151 13.485 -18.892 8.830 1144 HG2 LYS 151 2HG LYS 151 13.436 -17.642 6.917 1145 HG3 LYS 151 1HG LYS 151 13.274 -16.115 7.790 1146 HD2 LYS 151 2HD LYS 151 15.784 -17.724 8.035 1147 HD3 LYS 151 1HD LYS 151 15.524 -16.703 6.619 1148 HE2 LYS 151 2HE LYS 151 16.061 -14.877 7.769 1149 HE3 LYS 151 1HE LYS 151 14.877 -15.258 9.018 1150 HZ1 LYS 151 3HZ LYS 151 16.436 -16.150 10.350 1151 HZ2 LYS 151 1HZ LYS 151 17.492 -15.174 9.457 1152 HZ3 LYS 151 2HZ LYS 151 17.329 -16.813 9.075 1153 H HIS 152 H HIS 152 13.081 -17.158 11.830 1154 HA HIS 152 HA HIS 152 11.263 -18.494 13.497 1155 HB2 HIS 152 2HB HIS 152 12.743 -20.448 14.114 1156 HB3 HIS 152 1HB HIS 152 11.964 -20.559 12.538 1157 HD1 HIS 152 1HD HIS 152 14.727 -18.253 12.349 1158 HD2 HIS 152 2HD HIS 152 14.274 -22.377 12.154 1159 HE1 HIS 152 1HE HIS 152 16.829 -19.107 11.274 1160 HE2 HIS 152 2HE HIS 152 16.496 -21.597 11.082 1161 H LEU 153 H LEU 153 12.484 -19.119 15.678 1162 HA LEU 153 HA LEU 153 14.853 -17.701 16.307 1163 HB2 LEU 153 2HB LEU 153 12.785 -15.988 16.057 1164 HB3 LEU 153 1HB LEU 153 12.597 -16.436 17.741 1165 HG LEU 153 HG LEU 153 13.906 -14.419 17.594 1166 HD11 LEU 153 1HD1 LEU 153 15.437 -16.883 18.371 1167 HD12 LEU 153 2HD1 LEU 153 14.562 -15.759 19.411 1168 HD13 LEU 153 3HD1 LEU 153 16.064 -15.256 18.634 1169 HD21 LEU 153 3HD2 LEU 153 15.316 -15.937 15.488 1170 HD22 LEU 153 1HD2 LEU 153 16.308 -14.897 16.510 1171 HD23 LEU 153 2HD2 LEU 153 14.959 -14.213 15.603 1172 H GLU 154 H GLU 154 11.733 -18.646 17.750 1173 HA GLU 154 HA GLU 154 12.972 -20.640 19.380 1174 HB2 GLU 154 2HB GLU 154 12.960 -18.045 20.433 1175 HB3 GLU 154 1HB GLU 154 11.636 -18.871 21.242 1176 HG2 GLU 154 2HG GLU 154 13.268 -20.719 21.765 1177 HG3 GLU 154 1HG GLU 154 14.538 -19.638 21.195 1178 H ASP 155 H ASP 155 10.135 -18.562 18.934 1179 HA ASP 155 HA ASP 155 7.909 -19.015 18.855 1180 HB2 ASP 155 2HB ASP 155 9.198 -21.489 17.911 1181 HB3 ASP 155 1HB ASP 155 7.559 -21.707 18.516 1182 H GLU 156 H GLU 156 6.132 -20.339 19.934 1183 HA GLU 156 HA GLU 156 6.976 -21.393 22.536 1184 HB2 GLU 156 2HB GLU 156 6.044 -18.849 22.334 1185 HB3 GLU 156 1HB GLU 156 4.533 -19.730 22.583 1186 HG2 GLU 156 2HG GLU 156 6.941 -19.982 24.373 1187 HG3 GLU 156 1HG GLU 156 5.609 -18.863 24.660 1188 H LEU 157 H LEU 157 4.157 -20.809 20.437 1189 HA LEU 157 HA LEU 157 3.005 -23.343 21.369 1190 HB2 LEU 157 2HB LEU 157 1.682 -21.173 21.426 1191 HB3 LEU 157 1HB LEU 157 1.652 -21.253 19.674 1192 HG LEU 157 HG LEU 157 0.684 -23.691 20.205 1193 HD11 LEU 157 1HD1 LEU 157 -0.600 -22.134 22.402 1194 HD12 LEU 157 2HD1 LEU 157 0.903 -23.004 22.712 1195 HD13 LEU 157 3HD1 LEU 157 -0.524 -23.877 22.154 1196 HD21 LEU 157 3HD2 LEU 157 -1.333 -21.559 20.499 1197 HD22 LEU 157 1HD2 LEU 157 -1.241 -22.889 19.343 1198 HD23 LEU 157 2HD2 LEU 157 -0.271 -21.437 19.095 Start of MODEL 39 1 H1 MET 1 1HT MET 1 -6.244 -25.595 -25.545 2 H2 MET 1 2HT MET 1 -5.769 -27.195 -25.947 3 H3 MET 1 3HT MET 1 -6.736 -26.285 -27.035 4 HA MET 1 HA MET 1 -4.062 -25.427 -26.193 5 HB2 MET 1 2HB MET 1 -4.855 -27.638 -27.907 6 HB3 MET 1 1HB MET 1 -3.906 -26.448 -28.788 7 HG2 MET 1 2HG MET 1 -2.446 -26.690 -26.524 8 HG3 MET 1 1HG MET 1 -3.109 -28.315 -26.671 9 HE1 MET 1 2HE MET 1 -0.515 -28.739 -26.573 10 HE2 MET 1 3HE MET 1 0.307 -29.140 -28.080 11 HE3 MET 1 1HE MET 1 -1.172 -29.988 -27.632 12 H HIS 2 H HIS 2 -6.392 -25.578 -28.895 13 HA HIS 2 HA HIS 2 -5.519 -22.959 -29.809 14 HB2 HIS 2 2HB HIS 2 -7.437 -24.996 -30.940 15 HB3 HIS 2 1HB HIS 2 -7.198 -23.409 -31.661 16 HD1 HIS 2 1HD HIS 2 -4.294 -23.031 -31.830 17 HD2 HIS 2 2HD HIS 2 -6.014 -26.772 -32.379 18 HE1 HIS 2 1HE HIS 2 -2.608 -24.360 -33.142 19 HE2 HIS 2 2HE HIS 2 -3.635 -26.648 -33.385 20 H HIS 3 H HIS 3 -6.396 -21.196 -28.964 21 HA HIS 3 HA HIS 3 -7.889 -19.726 -28.084 22 HB2 HIS 3 2HB HIS 3 -9.178 -20.958 -30.217 23 HB3 HIS 3 1HB HIS 3 -10.345 -21.064 -28.901 24 HD1 HIS 3 1HD HIS 3 -9.181 -18.829 -31.478 25 HD2 HIS 3 2HD HIS 3 -10.839 -18.395 -27.692 26 HE1 HIS 3 1HE HIS 3 -10.030 -16.464 -31.383 27 HE2 HIS 3 2HE HIS 3 -11.106 -16.252 -29.115 28 H HIS 4 H HIS 4 -9.665 -19.479 -26.490 29 HA HIS 4 HA HIS 4 -9.594 -21.712 -24.591 30 HB2 HIS 4 2HB HIS 4 -10.383 -19.985 -22.944 31 HB3 HIS 4 1HB HIS 4 -8.799 -19.662 -23.640 32 HD1 HIS 4 1HD HIS 4 -12.363 -18.742 -24.646 33 HD2 HIS 4 2HD HIS 4 -8.602 -17.034 -24.197 34 HE1 HIS 4 1HE HIS 4 -12.643 -16.325 -25.278 35 HE2 HIS 4 2HE HIS 4 -10.374 -15.292 -24.914 36 H HIS 5 H HIS 5 -11.558 -22.147 -23.324 37 HA HIS 5 HA HIS 5 -13.856 -22.295 -25.081 38 HB2 HIS 5 2HB HIS 5 -13.283 -23.432 -22.343 39 HB3 HIS 5 1HB HIS 5 -14.833 -23.629 -23.158 40 HD1 HIS 5 1HD HIS 5 -13.989 -24.351 -25.966 41 HD2 HIS 5 2HD HIS 5 -12.110 -25.859 -22.581 42 HE1 HIS 5 1HE HIS 5 -12.884 -26.486 -26.705 43 HE2 HIS 5 2HE HIS 5 -11.680 -27.334 -24.660 44 H HIS 6 H HIS 6 -13.161 -21.023 -21.831 45 HA HIS 6 HA HIS 6 -14.986 -18.834 -22.247 46 HB2 HIS 6 2HB HIS 6 -16.174 -21.061 -21.277 47 HB3 HIS 6 1HB HIS 6 -15.646 -20.316 -19.773 48 HD1 HIS 6 1HD HIS 6 -18.082 -19.938 -22.553 49 HD2 HIS 6 2HD HIS 6 -16.903 -17.859 -19.152 50 HE1 HIS 6 1HE HIS 6 -19.857 -18.196 -22.179 51 HE2 HIS 6 2HE HIS 6 -19.167 -17.009 -20.067 52 H HIS 7 H HIS 7 -14.406 -17.083 -21.079 53 HA HIS 7 HA HIS 7 -12.660 -17.442 -18.756 54 HB2 HIS 7 2HB HIS 7 -11.751 -16.579 -21.307 55 HB3 HIS 7 1HB HIS 7 -11.713 -15.184 -20.234 56 HD1 HIS 7 1HD HIS 7 -10.455 -18.769 -20.306 57 HD2 HIS 7 2HD HIS 7 -9.520 -15.080 -18.639 58 HE1 HIS 7 1HE HIS 7 -8.257 -19.101 -19.133 59 HE2 HIS 7 2HE HIS 7 -7.752 -16.877 -18.061 60 H MET 8 H MET 8 -12.920 -15.934 -17.170 61 HA MET 8 HA MET 8 -15.045 -13.955 -17.615 62 HB2 MET 8 2HB MET 8 -14.570 -15.839 -15.538 63 HB3 MET 8 1HB MET 8 -14.395 -14.223 -14.843 64 HG2 MET 8 2HG MET 8 -16.585 -13.651 -15.296 65 HG3 MET 8 1HG MET 8 -16.757 -14.875 -16.552 66 HE1 MET 8 3HE MET 8 -17.443 -17.075 -16.346 67 HE2 MET 8 1HE MET 8 -17.863 -17.978 -14.891 68 HE3 MET 8 2HE MET 8 -16.170 -17.773 -15.343 69 H SER 9 H SER 9 -14.276 -11.998 -18.056 70 HA SER 9 HA SER 9 -11.772 -11.125 -16.803 71 HB2 SER 9 2HB SER 9 -13.184 -10.460 -19.328 72 HB3 SER 9 1HB SER 9 -12.312 -9.142 -18.544 73 HG SER 9 HG SER 9 -11.131 -11.667 -19.028 74 H ASP 10 H ASP 10 -11.614 -9.044 -15.832 75 HA ASP 10 HA ASP 10 -14.183 -7.874 -15.001 76 HB2 ASP 10 2HB ASP 10 -12.234 -9.174 -13.341 77 HB3 ASP 10 1HB ASP 10 -12.321 -7.471 -12.904 78 H GLY 11 H GLY 11 -14.315 -5.812 -15.568 79 HA2 GLY 11 2HA GLY 11 -12.618 -3.768 -14.948 80 HA3 GLY 11 1HA GLY 11 -12.000 -4.370 -16.479 81 H HIS 12 H HIS 12 -13.495 -1.854 -15.493 82 HA HIS 12 HA HIS 12 -14.798 -1.273 -17.909 83 HB2 HIS 12 2HB HIS 12 -17.147 -1.123 -17.062 84 HB3 HIS 12 1HB HIS 12 -16.542 -2.780 -17.200 85 HD1 HIS 12 1HD HIS 12 -15.901 -3.968 -14.913 86 HD2 HIS 12 2HD HIS 12 -17.954 -0.374 -14.547 87 HE1 HIS 12 1HE HIS 12 -16.741 -3.912 -12.543 88 HE2 HIS 12 2HE HIS 12 -18.057 -1.771 -12.372 89 H ASN 13 H ASN 13 -14.653 -0.629 -14.441 90 HA ASN 13 HA ASN 13 -14.634 2.254 -15.058 91 HB2 ASN 13 2HB ASN 13 -15.618 2.603 -12.784 92 HB3 ASN 13 1HB ASN 13 -16.688 1.760 -13.899 93 HD21 ASN 13 1HD2 ASN 13 -17.844 0.933 -12.126 94 HD22 ASN 13 2HD2 ASN 13 -17.230 -0.383 -11.190 95 H GLY 14 H GLY 14 -13.392 3.585 -13.561 96 HA2 GLY 14 2HA GLY 14 -10.975 2.163 -12.699 97 HA3 GLY 14 1HA GLY 14 -11.117 3.904 -12.974 98 H LEU 15 H LEU 15 -9.868 3.523 -10.790 99 HA LEU 15 HA LEU 15 -11.518 4.527 -8.743 100 HB2 LEU 15 2HB LEU 15 -11.076 1.603 -8.803 101 HB3 LEU 15 1HB LEU 15 -10.850 2.380 -7.250 102 HG LEU 15 HG LEU 15 -13.298 3.326 -8.389 103 HD11 LEU 15 1HD1 LEU 15 -13.209 0.330 -8.119 104 HD12 LEU 15 2HD1 LEU 15 -13.146 1.171 -9.668 105 HD13 LEU 15 3HD1 LEU 15 -14.565 1.333 -8.633 106 HD21 LEU 15 3HD2 LEU 15 -13.302 3.437 -6.128 107 HD22 LEU 15 1HD2 LEU 15 -12.336 1.975 -5.941 108 HD23 LEU 15 2HD2 LEU 15 -14.060 1.853 -6.293 109 H GLY 16 H GLY 16 -10.182 4.027 -6.480 110 HA2 GLY 16 2HA GLY 16 -8.048 4.018 -5.454 111 HA3 GLY 16 1HA GLY 16 -7.311 4.354 -7.017 112 H LYS 17 H LYS 17 -8.688 6.508 -7.892 113 HA LYS 17 HA LYS 17 -9.270 8.590 -6.198 114 HB2 LYS 17 2HB LYS 17 -6.533 7.969 -5.986 115 HB3 LYS 17 1HB LYS 17 -6.610 9.427 -6.969 116 HG2 LYS 17 2HG LYS 17 -8.049 9.173 -4.346 117 HG3 LYS 17 1HG LYS 17 -6.384 9.744 -4.472 118 HD2 LYS 17 2HD LYS 17 -7.315 11.774 -4.697 119 HD3 LYS 17 1HD LYS 17 -7.636 11.267 -6.357 120 HE2 LYS 17 2HE LYS 17 -9.853 11.030 -5.995 121 HE3 LYS 17 1HE LYS 17 -9.627 10.426 -4.354 122 HZ1 LYS 17 3HZ LYS 17 -9.195 12.691 -3.623 123 HZ2 LYS 17 1HZ LYS 17 -10.716 12.577 -4.356 124 HZ3 LYS 17 2HZ LYS 17 -9.421 13.267 -5.196 125 H GLY 18 H GLY 18 -7.678 7.563 -9.137 126 HA2 GLY 18 2HA GLY 18 -9.198 8.513 -11.055 127 HA3 GLY 18 1HA GLY 18 -8.463 10.026 -10.514 128 H PHE 19 H PHE 19 -7.038 6.780 -10.849 129 HA PHE 19 HA PHE 19 -5.508 7.630 -13.153 130 HB2 PHE 19 2HB PHE 19 -3.332 6.962 -11.997 131 HB3 PHE 19 1HB PHE 19 -4.036 8.517 -11.532 132 HD1 PHE 19 2HD PHE 19 -3.394 5.061 -10.472 133 HD2 PHE 19 1HD PHE 19 -4.882 8.880 -9.326 134 HE1 PHE 19 2HE PHE 19 -3.348 4.366 -8.112 135 HE2 PHE 19 1HE PHE 19 -4.836 8.193 -6.963 136 HZ PHE 19 HZ PHE 19 -4.069 5.933 -6.354 137 H GLY 20 H GLY 20 -5.901 5.117 -10.665 138 HA2 GLY 20 2HA GLY 20 -5.117 3.096 -12.637 139 HA3 GLY 20 1HA GLY 20 -5.315 2.834 -10.904 140 H ASP 21 H ASP 21 -6.710 1.164 -10.907 141 HA ASP 21 HA ASP 21 -9.465 1.707 -11.388 142 HB2 ASP 21 2HB ASP 21 -9.735 -0.253 -13.012 143 HB3 ASP 21 1HB ASP 21 -9.066 1.245 -13.673 144 H HIS 22 H HIS 22 -10.765 0.333 -10.264 145 HA HIS 22 HA HIS 22 -10.532 -0.814 -8.048 146 HB2 HIS 22 2HB HIS 22 -11.870 -2.816 -8.639 147 HB3 HIS 22 1HB HIS 22 -12.486 -1.337 -9.365 148 HD1 HIS 22 1HD HIS 22 -13.547 -3.553 -10.811 149 HD2 HIS 22 2HD HIS 22 -9.665 -2.282 -11.573 150 HE1 HIS 22 1HE HIS 22 -12.987 -4.438 -13.096 151 HE2 HIS 22 2HE HIS 22 -10.604 -3.730 -13.499 152 H ILE 23 H ILE 23 -8.287 -1.100 -7.570 153 HA ILE 23 HA ILE 23 -7.435 -3.874 -7.898 154 HB ILE 23 HB ILE 23 -5.853 -1.478 -8.815 155 HG12 ILE 23 2HG1 ILE 23 -5.994 -4.081 -10.264 156 HG13 ILE 23 1HG1 ILE 23 -7.404 -3.029 -10.290 157 HG21 ILE 23 1HG2 ILE 23 -3.996 -2.347 -8.005 158 HG22 ILE 23 2HG2 ILE 23 -4.196 -3.673 -9.148 159 HG23 ILE 23 3HG2 ILE 23 -4.813 -3.824 -7.503 160 HD11 ILE 23 3HD1 ILE 23 -5.027 -2.871 -11.836 161 HD12 ILE 23 1HD1 ILE 23 -5.159 -1.418 -10.843 162 HD13 ILE 23 2HD1 ILE 23 -6.477 -1.872 -11.924 163 H HIS 24 H HIS 24 -5.262 -1.312 -6.883 164 HA HIS 24 HA HIS 24 -5.112 -2.490 -4.237 165 HB2 HIS 24 2HB HIS 24 -3.519 -0.128 -5.198 166 HB3 HIS 24 1HB HIS 24 -3.104 -1.296 -3.943 167 HD1 HIS 24 1HD HIS 24 -1.895 -0.428 -7.031 168 HD2 HIS 24 2HD HIS 24 -3.178 -4.068 -5.490 169 HE1 HIS 24 1HE HIS 24 -0.807 -2.186 -8.462 170 HE2 HIS 24 2HE HIS 24 -1.520 -4.381 -7.450 171 H TRP 25 H TRP 25 -7.512 -1.101 -4.962 172 HA TRP 25 HA TRP 25 -7.694 0.704 -2.720 173 HB2 TRP 25 2HB TRP 25 -8.959 2.260 -4.577 174 HB3 TRP 25 1HB TRP 25 -7.315 2.527 -3.990 175 HD1 TRP 25 HD TRP 25 -9.249 1.336 -7.035 176 HE1 TRP 25 1HE TRP 25 -7.633 1.139 -9.011 177 HE3 TRP 25 3HE TRP 25 -4.836 2.039 -4.578 178 HZ2 TRP 25 2HZ TRP 25 -4.862 1.277 -9.496 179 HZ3 TRP 25 3HZ TRP 25 -2.749 1.996 -5.866 180 HH2 TRP 25 HH TRP 25 -2.759 1.619 -8.274 181 H ARG 26 H ARG 26 -9.018 -1.617 -4.744 182 HA ARG 26 HA ARG 26 -11.646 -1.092 -5.076 183 HB2 ARG 26 2HB ARG 26 -10.778 -3.715 -3.882 184 HB3 ARG 26 1HB ARG 26 -12.131 -3.414 -4.972 185 HG2 ARG 26 2HG ARG 26 -10.211 -2.601 -6.578 186 HG3 ARG 26 1HG ARG 26 -9.229 -3.657 -5.564 187 HD2 ARG 26 2HD ARG 26 -11.821 -4.675 -6.629 188 HD3 ARG 26 1HD ARG 26 -10.421 -4.580 -7.709 189 HE ARG 26 HE ARG 26 -9.458 -5.861 -5.521 190 HH11 ARG 26 1HH1 ARG 26 -12.184 -6.407 -7.631 191 HH12 ARG 26 2HH1 ARG 26 -12.159 -8.126 -7.423 192 HH21 ARG 26 1HH2 ARG 26 -9.422 -8.121 -5.249 193 HH22 ARG 26 2HH2 ARG 26 -10.591 -9.099 -6.071 194 H THR 27 H THR 27 -10.139 -1.845 -1.948 195 HA THR 27 HA THR 27 -11.871 -0.420 -0.384 196 HB THR 27 HB THR 27 -13.041 -2.730 0.537 197 HG1 THR 27 1HG THR 27 -13.888 -3.759 -1.289 198 HG21 THR 27 3HG2 THR 27 -13.919 -0.318 -0.505 199 HG22 THR 27 1HG2 THR 27 -14.895 -1.559 0.279 200 HG23 THR 27 2HG2 THR 27 -14.723 -1.549 -1.476 201 H LEU 28 H LEU 28 -10.989 -0.267 1.582 202 HA LEU 28 HA LEU 28 -8.685 -1.777 2.248 203 HB2 LEU 28 2HB LEU 28 -9.046 0.560 2.962 204 HB3 LEU 28 1HB LEU 28 -10.358 0.020 4.011 205 HG LEU 28 HG LEU 28 -7.587 -1.085 4.351 206 HD11 LEU 28 1HD1 LEU 28 -8.515 1.645 4.927 207 HD12 LEU 28 2HD1 LEU 28 -6.880 1.018 4.713 208 HD13 LEU 28 3HD1 LEU 28 -7.705 0.820 6.260 209 HD21 LEU 28 3HD2 LEU 28 -8.541 -1.003 6.783 210 HD22 LEU 28 1HD2 LEU 28 -9.034 -2.285 5.676 211 HD23 LEU 28 2HD2 LEU 28 -10.095 -0.905 5.954 212 H GLU 29 H GLU 29 -11.876 -1.595 3.843 213 HA GLU 29 HA GLU 29 -11.493 -3.613 5.702 214 HB2 GLU 29 2HB GLU 29 -14.028 -2.792 4.276 215 HB3 GLU 29 1HB GLU 29 -13.982 -3.848 5.681 216 HG2 GLU 29 2HG GLU 29 -13.892 -2.121 7.060 217 HG3 GLU 29 1HG GLU 29 -12.514 -1.436 6.199 218 H ASP 30 H ASP 30 -13.078 -3.919 2.520 219 HA ASP 30 HA ASP 30 -13.249 -6.744 2.625 220 HB2 ASP 30 2HB ASP 30 -13.676 -4.643 0.565 221 HB3 ASP 30 1HB ASP 30 -13.382 -6.288 -0.019 222 H GLY 31 H GLY 31 -10.717 -4.551 1.780 223 HA2 GLY 31 2HA GLY 31 -9.192 -6.194 0.073 224 HA3 GLY 31 1HA GLY 31 -8.563 -4.870 1.061 225 H LYS 32 H LYS 32 -9.123 -5.821 3.612 226 HA LYS 32 HA LYS 32 -6.955 -7.613 3.991 227 HB2 LYS 32 2HB LYS 32 -7.767 -7.650 6.386 228 HB3 LYS 32 1HB LYS 32 -7.377 -6.063 5.736 229 HG2 LYS 32 2HG LYS 32 -9.660 -5.492 5.508 230 HG3 LYS 32 1HG LYS 32 -10.175 -7.154 5.807 231 HD2 LYS 32 2HD LYS 32 -8.707 -6.572 8.051 232 HD3 LYS 32 1HD LYS 32 -9.488 -5.030 7.695 233 HE2 LYS 32 2HE LYS 32 -11.517 -5.793 8.272 234 HE3 LYS 32 1HE LYS 32 -11.267 -7.340 7.463 235 HZ1 LYS 32 3HZ LYS 32 -9.879 -8.003 9.384 236 HZ2 LYS 32 1HZ LYS 32 -11.497 -7.721 9.793 237 HZ3 LYS 32 2HZ LYS 32 -10.317 -6.569 10.168 238 H LYS 33 H LYS 33 -10.466 -7.992 4.054 239 HA LYS 33 HA LYS 33 -10.472 -10.688 4.919 240 HB2 LYS 33 2HB LYS 33 -12.421 -9.013 4.871 241 HB3 LYS 33 1HB LYS 33 -12.593 -9.450 3.175 242 HG2 LYS 33 2HG LYS 33 -12.768 -11.857 3.964 243 HG3 LYS 33 1HG LYS 33 -12.956 -11.189 5.596 244 HD2 LYS 33 2HD LYS 33 -15.150 -11.231 5.048 245 HD3 LYS 33 1HD LYS 33 -14.761 -9.696 4.270 246 HE2 LYS 33 2HE LYS 33 -15.640 -10.624 2.432 247 HE3 LYS 33 1HE LYS 33 -14.111 -11.495 2.324 248 HZ1 LYS 33 3HZ LYS 33 -15.419 -13.103 3.951 249 HZ2 LYS 33 1HZ LYS 33 -15.514 -13.246 2.269 250 HZ3 LYS 33 2HZ LYS 33 -16.743 -12.457 3.120 251 H GLU 34 H GLU 34 -10.035 -9.158 1.827 252 HA GLU 34 HA GLU 34 -10.394 -11.601 0.322 253 HB2 GLU 34 2HB GLU 34 -11.026 -9.455 -0.670 254 HB3 GLU 34 1HB GLU 34 -9.362 -8.887 -0.523 255 HG2 GLU 34 2HG GLU 34 -8.664 -10.039 -2.323 256 HG3 GLU 34 1HG GLU 34 -9.738 -11.409 -2.000 257 H ALA 35 H ALA 35 -7.733 -9.615 1.495 258 HA ALA 35 HA ALA 35 -5.625 -10.809 0.113 259 HB1 ALA 35 1HB ALA 35 -5.646 -9.605 2.879 260 HB2 ALA 35 2HB ALA 35 -5.326 -8.762 1.364 261 HB3 ALA 35 3HB ALA 35 -4.196 -9.983 1.950 262 H ALA 36 H ALA 36 -7.430 -11.880 2.899 263 HA ALA 36 HA ALA 36 -5.647 -13.830 3.864 264 HB1 ALA 36 1HB ALA 36 -7.790 -14.866 4.801 265 HB2 ALA 36 2HB ALA 36 -8.622 -13.491 4.075 266 HB3 ALA 36 3HB ALA 36 -7.389 -13.225 5.307 267 H ALA 37 H ALA 37 -8.167 -13.949 1.390 268 HA ALA 37 HA ALA 37 -8.315 -16.679 0.954 269 HB1 ALA 37 1HB ALA 37 -8.375 -15.147 -1.523 270 HB2 ALA 37 2HB ALA 37 -9.364 -14.439 -0.247 271 HB3 ALA 37 3HB ALA 37 -9.638 -16.107 -0.752 272 H SER 38 H SER 38 -6.509 -14.524 -1.234 273 HA SER 38 HA SER 38 -4.883 -16.633 -2.217 274 HB2 SER 38 2HB SER 38 -4.898 -13.648 -2.519 275 HB3 SER 38 1HB SER 38 -3.496 -14.574 -3.082 276 HG SER 38 HG SER 38 -6.198 -14.973 -3.869 277 H GLY 39 H GLY 39 -4.603 -14.377 0.411 278 HA2 GLY 39 2HA GLY 39 -3.187 -14.510 2.243 279 HA3 GLY 39 1HA GLY 39 -2.310 -15.812 1.434 280 H LEU 40 H LEU 40 -2.906 -12.755 -0.151 281 HA LEU 40 HA LEU 40 -0.020 -12.287 -0.161 282 HB2 LEU 40 2HB LEU 40 -0.410 -10.768 -1.996 283 HB3 LEU 40 1HB LEU 40 -1.165 -12.309 -2.326 284 HG LEU 40 HG LEU 40 -3.319 -11.146 -1.420 285 HD11 LEU 40 1HD1 LEU 40 -3.013 -8.660 -2.368 286 HD12 LEU 40 2HD1 LEU 40 -1.416 -8.926 -1.671 287 HD13 LEU 40 3HD1 LEU 40 -2.855 -9.086 -0.665 288 HD21 LEU 40 3HD2 LEU 40 -3.679 -11.641 -3.569 289 HD22 LEU 40 1HD2 LEU 40 -2.043 -11.187 -4.043 290 HD23 LEU 40 2HD2 LEU 40 -3.287 -9.949 -3.872 291 HA PRO 41 HA PRO 41 -0.056 -8.930 2.665 292 HB2 PRO 41 2HB PRO 41 1.548 -7.081 1.457 293 HB3 PRO 41 1HB PRO 41 2.161 -8.543 2.240 294 HG2 PRO 41 2HG PRO 41 1.579 -8.053 -0.658 295 HG3 PRO 41 1HG PRO 41 3.020 -8.791 0.074 296 HD2 PRO 41 2HD PRO 41 1.118 -10.316 -0.998 297 HD3 PRO 41 1HD PRO 41 1.908 -10.799 0.518 298 H LEU 42 H LEU 42 -0.743 -6.764 3.049 299 HA LEU 42 HA LEU 42 -2.917 -5.991 1.347 300 HB2 LEU 42 2HB LEU 42 -1.808 -4.877 3.912 301 HB3 LEU 42 1HB LEU 42 -3.173 -4.168 3.082 302 HG LEU 42 HG LEU 42 -2.989 -6.762 4.558 303 HD11 LEU 42 1HD1 LEU 42 -4.789 -5.951 5.786 304 HD12 LEU 42 2HD1 LEU 42 -5.235 -4.783 4.543 305 HD13 LEU 42 3HD1 LEU 42 -3.789 -4.523 5.519 306 HD21 LEU 42 3HD2 LEU 42 -5.139 -6.092 2.555 307 HD22 LEU 42 1HD2 LEU 42 -5.092 -7.497 3.620 308 HD23 LEU 42 2HD2 LEU 42 -3.893 -7.321 2.341 309 H MET 43 H MET 43 -3.079 -4.205 0.090 310 HA MET 43 HA MET 43 -0.560 -2.866 -0.544 311 HB2 MET 43 2HB MET 43 -2.105 -4.080 -2.259 312 HB3 MET 43 1HB MET 43 -3.078 -2.610 -2.173 313 HG2 MET 43 2HG MET 43 -1.440 -2.688 -4.051 314 HG3 MET 43 1HG MET 43 -1.287 -1.285 -3.001 315 HE1 MET 43 3HE MET 43 1.868 -1.701 -1.103 316 HE2 MET 43 1HE MET 43 0.244 -1.022 -1.209 317 HE3 MET 43 2HE MET 43 1.467 -0.572 -2.397 318 H VAL 44 H VAL 44 -0.626 -1.475 1.285 319 HA VAL 44 HA VAL 44 -2.781 0.435 1.505 320 HB VAL 44 HB VAL 44 -0.242 0.087 3.084 321 HG11 VAL 44 1HG1 VAL 44 -0.477 2.309 3.481 322 HG12 VAL 44 2HG1 VAL 44 -1.690 1.735 4.625 323 HG13 VAL 44 3HG1 VAL 44 -2.183 2.320 3.035 324 HG21 VAL 44 3HG2 VAL 44 -2.502 -1.365 3.192 325 HG22 VAL 44 1HG2 VAL 44 -2.909 -0.075 4.325 326 HG23 VAL 44 2HG2 VAL 44 -1.468 -1.056 4.584 327 H ILE 45 H ILE 45 -2.420 1.274 -0.683 328 HA ILE 45 HA ILE 45 -0.101 3.020 -0.982 329 HB ILE 45 HB ILE 45 -2.339 2.395 -2.917 330 HG12 ILE 45 2HG1 ILE 45 0.533 1.445 -2.943 331 HG13 ILE 45 1HG1 ILE 45 -0.820 0.488 -2.328 332 HG21 ILE 45 1HG2 ILE 45 -0.676 4.578 -2.962 333 HG22 ILE 45 2HG2 ILE 45 -1.510 3.885 -4.353 334 HG23 ILE 45 3HG2 ILE 45 0.157 3.428 -4.008 335 HD11 ILE 45 3HD1 ILE 45 -0.419 -0.273 -4.511 336 HD12 ILE 45 1HD1 ILE 45 -0.289 1.367 -5.147 337 HD13 ILE 45 2HD1 ILE 45 -1.854 0.746 -4.622 338 H ILE 46 H ILE 46 -0.286 4.982 -0.047 339 HA ILE 46 HA ILE 46 -2.926 6.283 -0.174 340 HB ILE 46 HB ILE 46 -0.833 6.962 1.870 341 HG12 ILE 46 2HG1 ILE 46 -3.128 5.092 2.410 342 HG13 ILE 46 1HG1 ILE 46 -1.583 4.477 1.843 343 HG21 ILE 46 1HG2 ILE 46 -2.517 8.118 2.954 344 HG22 ILE 46 2HG2 ILE 46 -3.797 7.182 2.190 345 HG23 ILE 46 3HG2 ILE 46 -2.917 8.394 1.261 346 HD11 ILE 46 3HD1 ILE 46 -0.528 5.634 3.799 347 HD12 ILE 46 1HD1 ILE 46 -1.588 4.281 4.189 348 HD13 ILE 46 2HD1 ILE 46 -2.159 5.936 4.398 349 H HIS 47 H HIS 47 -3.071 8.416 -0.730 350 HA HIS 47 HA HIS 47 -0.623 9.827 -1.483 351 HB2 HIS 47 2HB HIS 47 -2.766 10.019 -3.504 352 HB3 HIS 47 1HB HIS 47 -1.014 9.917 -3.714 353 HD1 HIS 47 1HD HIS 47 -0.649 7.999 -5.233 354 HD2 HIS 47 2HD HIS 47 -3.453 7.107 -2.292 355 HE1 HIS 47 1HE HIS 47 -1.254 5.589 -5.591 356 HE2 HIS 47 2HE HIS 47 -3.015 5.096 -3.858 357 H LYS 48 H LYS 48 -0.768 11.686 -0.389 358 HA LYS 48 HA LYS 48 -3.350 13.121 -0.505 359 HB2 LYS 48 2HB LYS 48 -1.671 12.490 1.871 360 HB3 LYS 48 1HB LYS 48 -2.517 14.028 1.838 361 HG2 LYS 48 2HG LYS 48 -4.633 12.798 1.444 362 HG3 LYS 48 1HG LYS 48 -3.744 11.287 1.643 363 HD2 LYS 48 2HD LYS 48 -4.559 11.604 3.771 364 HD3 LYS 48 1HD LYS 48 -2.979 12.379 3.895 365 HE2 LYS 48 2HE LYS 48 -4.844 14.303 2.944 366 HE3 LYS 48 1HE LYS 48 -5.547 13.503 4.349 367 HZ1 LYS 48 3HZ LYS 48 -3.048 13.946 5.187 368 HZ2 LYS 48 1HZ LYS 48 -4.338 15.004 5.466 369 HZ3 LYS 48 2HZ LYS 48 -3.275 15.288 4.183 370 H SER 49 H SER 49 -3.134 15.461 0.089 371 HA SER 49 HA SER 49 -2.339 17.530 -0.407 372 HB2 SER 49 2HB SER 49 -0.202 16.104 0.879 373 HB3 SER 49 1HB SER 49 0.468 17.217 -0.314 374 HG SER 49 HG SER 49 0.171 18.625 1.224 375 H TRP 50 H TRP 50 -0.116 18.470 -1.713 376 HA TRP 50 HA TRP 50 -0.782 18.013 -4.423 377 HB2 TRP 50 2HB TRP 50 1.141 19.466 -4.934 378 HB3 TRP 50 1HB TRP 50 0.127 20.156 -3.659 379 HD1 TRP 50 HD TRP 50 1.129 19.888 -1.086 380 HE1 TRP 50 1HE TRP 50 3.574 19.935 -0.284 381 HE3 TRP 50 3HE TRP 50 3.464 18.919 -5.531 382 HZ2 TRP 50 2HZ TRP 50 6.150 19.608 -1.388 383 HZ3 TRP 50 3HZ TRP 50 5.922 18.804 -5.571 384 HH2 TRP 50 HH TRP 50 7.235 19.142 -3.541 385 H CYS 51 H CYS 51 -0.542 15.602 -4.123 386 HA CYS 51 HA CYS 51 2.156 14.580 -4.201 387 HB2 CYS 51 2HB CYS 51 0.912 13.036 -3.082 388 HB3 CYS 51 1HB CYS 51 -0.573 13.475 -3.912 389 H GLY 52 H GLY 52 3.310 14.277 -6.014 390 HA2 GLY 52 2HA GLY 52 1.944 14.542 -8.601 391 HA3 GLY 52 1HA GLY 52 3.684 14.663 -8.335 392 H ALA 53 H ALA 53 3.654 12.230 -6.638 393 HA ALA 53 HA ALA 53 4.307 10.332 -8.586 394 HB1 ALA 53 1HB ALA 53 4.961 10.409 -6.100 395 HB2 ALA 53 2HB ALA 53 4.680 8.832 -6.837 396 HB3 ALA 53 3HB ALA 53 3.437 9.565 -5.823 397 H CYS 54 H CYS 54 1.283 11.372 -7.491 398 HA CYS 54 HA CYS 54 -0.013 8.933 -8.436 399 HB2 CYS 54 2HB CYS 54 -2.099 10.057 -7.434 400 HB3 CYS 54 1HB CYS 54 -0.876 9.462 -6.306 401 H LYS 55 H LYS 55 0.302 12.372 -8.968 402 HA LYS 55 HA LYS 55 -1.751 12.775 -10.818 403 HB2 LYS 55 2HB LYS 55 -0.396 14.594 -9.821 404 HB3 LYS 55 1HB LYS 55 0.984 14.071 -10.777 405 HG2 LYS 55 2HG LYS 55 -1.070 14.424 -12.626 406 HG3 LYS 55 1HG LYS 55 -1.216 15.786 -11.502 407 HD2 LYS 55 2HD LYS 55 1.390 15.912 -11.833 408 HD3 LYS 55 1HD LYS 55 1.025 15.054 -13.331 409 HE2 LYS 55 2HE LYS 55 -0.459 16.809 -14.036 410 HE3 LYS 55 1HE LYS 55 -0.293 17.628 -12.483 411 HZ1 LYS 55 3HZ LYS 55 1.653 17.415 -14.682 412 HZ2 LYS 55 1HZ LYS 55 2.195 17.675 -13.100 413 HZ3 LYS 55 2HZ LYS 55 1.151 18.787 -13.830 414 H ALA 56 H ALA 56 1.636 11.833 -11.313 415 HA ALA 56 HA ALA 56 1.469 11.547 -14.122 416 HB1 ALA 56 1HB ALA 56 3.646 11.053 -13.977 417 HB2 ALA 56 2HB ALA 56 3.367 9.753 -12.818 418 HB3 ALA 56 3HB ALA 56 3.481 11.423 -12.262 419 H LEU 57 H LEU 57 0.651 9.404 -11.475 420 HA LEU 57 HA LEU 57 0.566 6.975 -12.867 421 HB2 LEU 57 2HB LEU 57 -1.019 7.971 -10.506 422 HB3 LEU 57 1HB LEU 57 -1.186 6.348 -11.131 423 HG LEU 57 HG LEU 57 0.803 7.437 -9.340 424 HD11 LEU 57 1HD1 LEU 57 1.150 4.681 -9.650 425 HD12 LEU 57 2HD1 LEU 57 -0.573 4.981 -9.870 426 HD13 LEU 57 3HD1 LEU 57 0.236 5.523 -8.399 427 HD21 LEU 57 3HD2 LEU 57 2.755 6.268 -10.266 428 HD22 LEU 57 1HD2 LEU 57 2.224 7.597 -11.297 429 HD23 LEU 57 2HD2 LEU 57 1.840 5.932 -11.737 430 H LYS 58 H LYS 58 -1.647 9.671 -12.817 431 HA LYS 58 HA LYS 58 -3.984 8.510 -13.653 432 HB2 LYS 58 2HB LYS 58 -4.118 10.780 -13.195 433 HB3 LYS 58 1HB LYS 58 -2.760 11.182 -14.228 434 HG2 LYS 58 2HG LYS 58 -4.079 11.495 -16.004 435 HG3 LYS 58 1HG LYS 58 -4.993 10.018 -15.695 436 HD2 LYS 58 2HD LYS 58 -6.592 11.098 -14.499 437 HD3 LYS 58 1HD LYS 58 -5.457 12.278 -13.844 438 HE2 LYS 58 2HE LYS 58 -6.030 12.383 -16.752 439 HE3 LYS 58 1HE LYS 58 -7.298 12.921 -15.652 440 HZ1 LYS 58 3HZ LYS 58 -5.335 14.257 -14.604 441 HZ2 LYS 58 1HZ LYS 58 -6.143 14.849 -15.967 442 HZ3 LYS 58 2HZ LYS 58 -4.647 14.079 -16.139 443 HA PRO 59 HA PRO 59 -2.931 8.614 -18.301 444 HB2 PRO 59 2HB PRO 59 -0.606 9.645 -19.186 445 HB3 PRO 59 1HB PRO 59 -2.024 10.655 -18.838 446 HG2 PRO 59 2HG PRO 59 0.382 10.116 -17.128 447 HG3 PRO 59 1HG PRO 59 -0.415 11.659 -17.479 448 HD2 PRO 59 2HD PRO 59 -0.859 10.296 -15.186 449 HD3 PRO 59 1HD PRO 59 -2.115 11.278 -15.977 450 H LYS 60 H LYS 60 -0.216 7.847 -16.177 451 HA LYS 60 HA LYS 60 0.666 5.800 -18.086 452 HB2 LYS 60 2HB LYS 60 2.714 5.691 -16.962 453 HB3 LYS 60 1HB LYS 60 2.298 7.400 -16.938 454 HG2 LYS 60 2HG LYS 60 1.327 6.989 -14.655 455 HG3 LYS 60 1HG LYS 60 2.108 5.413 -14.692 456 HD2 LYS 60 2HD LYS 60 3.417 7.214 -13.526 457 HD3 LYS 60 1HD LYS 60 4.275 6.401 -14.834 458 HE2 LYS 60 2HE LYS 60 2.768 8.820 -15.592 459 HE3 LYS 60 1HE LYS 60 4.157 9.080 -14.539 460 HZ1 LYS 60 3HZ LYS 60 5.610 8.239 -16.113 461 HZ2 LYS 60 1HZ LYS 60 4.512 9.114 -17.058 462 HZ3 LYS 60 2HZ LYS 60 4.397 7.429 -16.971 463 H PHE 61 H PHE 61 -0.188 6.025 -14.602 464 HA PHE 61 HA PHE 61 -0.127 3.245 -14.205 465 HB2 PHE 61 2HB PHE 61 -0.226 5.143 -12.434 466 HB3 PHE 61 1HB PHE 61 -1.974 5.022 -12.647 467 HD1 PHE 61 1HD PHE 61 -3.147 2.935 -12.066 468 HD2 PHE 61 2HD PHE 61 1.002 3.466 -11.287 469 HE1 PHE 61 1HE PHE 61 -3.195 1.018 -10.525 470 HE2 PHE 61 2HE PHE 61 0.961 1.551 -9.742 471 HZ PHE 61 HZ PHE 61 -1.138 0.323 -9.362 472 H ALA 62 H ALA 62 -2.346 5.331 -15.792 473 HA ALA 62 HA ALA 62 -4.697 3.795 -15.627 474 HB1 ALA 62 1HB ALA 62 -3.624 5.887 -17.420 475 HB2 ALA 62 2HB ALA 62 -5.213 5.751 -16.664 476 HB3 ALA 62 3HB ALA 62 -4.851 4.831 -18.124 477 H GLU 63 H GLU 63 -1.679 3.379 -17.104 478 HA GLU 63 HA GLU 63 -2.343 1.436 -19.097 479 HB2 GLU 63 2HB GLU 63 -0.336 3.072 -19.009 480 HB3 GLU 63 1HB GLU 63 0.374 1.911 -17.882 481 HG2 GLU 63 2HG GLU 63 0.944 0.513 -19.523 482 HG3 GLU 63 1HG GLU 63 -0.628 0.652 -20.309 483 H SER 64 H SER 64 -2.001 1.396 -15.746 484 HA SER 64 HA SER 64 -0.815 -1.070 -15.285 485 HB2 SER 64 2HB SER 64 -2.774 0.567 -13.717 486 HB3 SER 64 1HB SER 64 -2.199 -0.977 -13.130 487 HG SER 64 HG SER 64 -0.523 1.181 -13.879 488 H THR 65 H THR 65 -3.292 -0.837 -17.293 489 HA THR 65 HA THR 65 -5.307 -2.520 -16.389 490 HB THR 65 HB THR 65 -5.022 -3.281 -19.020 491 HG1 THR 65 1HG THR 65 -3.924 -1.848 -20.091 492 HG21 THR 65 3HG2 THR 65 -6.535 -1.366 -19.578 493 HG22 THR 65 1HG2 THR 65 -6.364 -0.840 -17.903 494 HG23 THR 65 2HG2 THR 65 -7.082 -2.409 -18.266 495 H GLU 66 H GLU 66 -2.082 -3.157 -17.557 496 HA GLU 66 HA GLU 66 -2.362 -6.028 -17.482 497 HB2 GLU 66 2HB GLU 66 0.178 -5.951 -17.658 498 HB3 GLU 66 1HB GLU 66 -0.713 -5.250 -19.010 499 HG2 GLU 66 2HG GLU 66 -0.088 -3.349 -16.898 500 HG3 GLU 66 1HG GLU 66 1.335 -4.056 -17.663 501 H ILE 67 H ILE 67 -1.366 -3.405 -15.414 502 HA ILE 67 HA ILE 67 -0.154 -5.019 -13.449 503 HB ILE 67 HB ILE 67 -0.750 -2.225 -13.724 504 HG12 ILE 67 2HG1 ILE 67 1.220 -3.662 -11.948 505 HG13 ILE 67 1HG1 ILE 67 1.469 -3.418 -13.679 506 HG21 ILE 67 1HG2 ILE 67 -2.282 -2.468 -11.891 507 HG22 ILE 67 2HG2 ILE 67 -0.802 -1.716 -11.291 508 HG23 ILE 67 3HG2 ILE 67 -1.112 -3.423 -10.985 509 HD11 ILE 67 3HD1 ILE 67 2.326 -1.419 -13.273 510 HD12 ILE 67 1HD1 ILE 67 2.092 -1.672 -11.544 511 HD13 ILE 67 2HD1 ILE 67 0.824 -0.908 -12.502 512 H SER 68 H SER 68 -3.360 -4.691 -14.365 513 HA SER 68 HA SER 68 -4.595 -5.167 -11.844 514 HB2 SER 68 2HB SER 68 -5.445 -4.786 -14.535 515 HB3 SER 68 1HB SER 68 -6.132 -6.312 -13.978 516 HG SER 68 HG SER 68 -6.918 -3.845 -13.393 517 H GLU 69 H GLU 69 -2.662 -7.053 -13.905 518 HA GLU 69 HA GLU 69 -3.634 -9.550 -12.700 519 HB2 GLU 69 2HB GLU 69 -1.939 -9.349 -15.181 520 HB3 GLU 69 1HB GLU 69 -2.856 -10.734 -14.604 521 HG2 GLU 69 2HG GLU 69 -3.990 -8.163 -15.679 522 HG3 GLU 69 1HG GLU 69 -3.953 -9.723 -16.501 523 H LEU 70 H LEU 70 -0.523 -8.455 -14.122 524 HA LEU 70 HA LEU 70 1.019 -10.135 -12.488 525 HB2 LEU 70 2HB LEU 70 2.845 -9.343 -13.562 526 HB3 LEU 70 1HB LEU 70 1.611 -8.851 -14.709 527 HG LEU 70 HG LEU 70 3.120 -7.064 -14.552 528 HD11 LEU 70 1HD1 LEU 70 1.722 -5.430 -12.982 529 HD12 LEU 70 2HD1 LEU 70 0.562 -6.750 -13.153 530 HD13 LEU 70 3HD1 LEU 70 1.190 -5.934 -14.592 531 HD21 LEU 70 3HD2 LEU 70 3.828 -8.059 -12.124 532 HD22 LEU 70 1HD2 LEU 70 2.976 -6.585 -11.661 533 HD23 LEU 70 2HD2 LEU 70 4.351 -6.502 -12.764 534 H SER 71 H SER 71 -0.568 -7.280 -11.644 535 HA SER 71 HA SER 71 1.224 -6.892 -9.346 536 HB2 SER 71 2HB SER 71 0.100 -5.021 -11.170 537 HB3 SER 71 1HB SER 71 -0.575 -4.714 -9.571 538 HG SER 71 HG SER 71 1.706 -4.845 -8.849 539 H HIS 72 H HIS 72 -1.872 -8.022 -10.188 540 HA HIS 72 HA HIS 72 -3.485 -7.188 -8.098 541 HB2 HIS 72 2HB HIS 72 -4.743 -9.321 -8.373 542 HB3 HIS 72 1HB HIS 72 -4.461 -8.458 -9.888 543 HD1 HIS 72 1HD HIS 72 -1.800 -10.678 -8.394 544 HD2 HIS 72 2HD HIS 72 -4.646 -10.760 -11.414 545 HE1 HIS 72 1HE HIS 72 -1.268 -12.712 -9.756 546 HE2 HIS 72 2HE HIS 72 -3.056 -12.793 -11.526 547 H ASN 73 H ASN 73 -0.684 -8.989 -7.966 548 HA ASN 73 HA ASN 73 -0.936 -10.778 -5.921 549 HB2 ASN 73 2HB ASN 73 1.404 -8.912 -6.352 550 HB3 ASN 73 1HB ASN 73 1.431 -10.511 -5.612 551 HD21 ASN 73 1HD2 ASN 73 1.144 -8.737 -8.594 552 HD22 ASN 73 2HD2 ASN 73 1.424 -10.093 -9.653 553 H PHE 74 H PHE 74 -1.219 -7.368 -5.741 554 HA PHE 74 HA PHE 74 -1.048 -7.397 -2.821 555 HB2 PHE 74 2HB PHE 74 -0.754 -5.180 -4.858 556 HB3 PHE 74 1HB PHE 74 -0.904 -4.893 -3.127 557 HD1 PHE 74 2HD PHE 74 0.847 -5.824 -1.580 558 HD2 PHE 74 1HD PHE 74 1.299 -5.769 -5.812 559 HE1 PHE 74 2HE PHE 74 3.274 -6.133 -1.322 560 HE2 PHE 74 1HE PHE 74 3.726 -6.077 -5.561 561 HZ PHE 74 HZ PHE 74 4.716 -6.259 -3.314 562 H VAL 75 H VAL 75 -2.830 -6.335 -1.649 563 HA VAL 75 HA VAL 75 -5.271 -6.433 -3.284 564 HB VAL 75 HB VAL 75 -5.139 -8.046 -1.437 565 HG11 VAL 75 1HG1 VAL 75 -5.811 -6.784 0.834 566 HG12 VAL 75 2HG1 VAL 75 -4.734 -5.579 0.127 567 HG13 VAL 75 3HG1 VAL 75 -4.154 -7.220 0.415 568 HG21 VAL 75 3HG2 VAL 75 -7.374 -6.222 -0.729 569 HG22 VAL 75 1HG2 VAL 75 -7.389 -7.955 -1.066 570 HG23 VAL 75 2HG2 VAL 75 -7.267 -6.797 -2.394 571 H MET 76 H MET 76 -6.825 -5.047 -3.260 572 HA MET 76 HA MET 76 -6.641 -2.440 -3.406 573 HB2 MET 76 2HB MET 76 -9.049 -2.369 -3.001 574 HB3 MET 76 1HB MET 76 -8.581 -3.710 -4.024 575 HG2 MET 76 2HG MET 76 -8.587 -4.473 -1.248 576 HG3 MET 76 1HG MET 76 -10.144 -3.804 -1.729 577 HE1 MET 76 3HE MET 76 -11.249 -5.608 -1.106 578 HE2 MET 76 1HE MET 76 -10.954 -7.302 -1.502 579 HE3 MET 76 2HE MET 76 -11.975 -6.316 -2.549 580 H VAL 77 H VAL 77 -5.309 -1.423 -1.726 581 HA VAL 77 HA VAL 77 -6.994 -0.576 0.472 582 HB VAL 77 HB VAL 77 -4.270 -1.753 1.026 583 HG11 VAL 77 1HG1 VAL 77 -5.288 -1.310 3.454 584 HG12 VAL 77 2HG1 VAL 77 -6.058 0.021 2.590 585 HG13 VAL 77 3HG1 VAL 77 -4.299 -0.117 2.611 586 HG21 VAL 77 3HG2 VAL 77 -5.788 -3.143 2.601 587 HG22 VAL 77 1HG2 VAL 77 -5.686 -3.564 0.892 588 HG23 VAL 77 2HG2 VAL 77 -7.069 -2.651 1.494 589 H ASN 78 H ASN 78 -6.678 1.135 -1.350 590 HA ASN 78 HA ASN 78 -4.320 2.748 -0.737 591 HB2 ASN 78 2HB ASN 78 -4.268 2.876 -2.981 592 HB3 ASN 78 1HB ASN 78 -5.932 2.337 -3.133 593 HD21 ASN 78 1HD2 ASN 78 -4.265 5.177 -1.821 594 HD22 ASN 78 2HD2 ASN 78 -5.254 6.346 -2.641 595 H LEU 79 H LEU 79 -4.648 4.058 0.892 596 HA LEU 79 HA LEU 79 -7.291 5.150 1.418 597 HB2 LEU 79 2HB LEU 79 -4.780 5.734 2.965 598 HB3 LEU 79 1HB LEU 79 -6.438 5.907 3.501 599 HG LEU 79 HG LEU 79 -5.256 3.226 2.815 600 HD11 LEU 79 1HD1 LEU 79 -3.992 4.492 4.632 601 HD12 LEU 79 2HD1 LEU 79 -4.607 2.890 5.039 602 HD13 LEU 79 3HD1 LEU 79 -5.458 4.330 5.597 603 HD21 LEU 79 3HD2 LEU 79 -7.262 2.428 3.344 604 HD22 LEU 79 1HD2 LEU 79 -7.849 4.090 3.395 605 HD23 LEU 79 2HD2 LEU 79 -7.272 3.312 4.870 606 H GLU 80 H GLU 80 -7.805 7.331 1.541 607 HA GLU 80 HA GLU 80 -5.944 9.161 0.176 608 HB2 GLU 80 2HB GLU 80 -8.153 8.293 -1.020 609 HB3 GLU 80 1HB GLU 80 -8.895 9.569 -0.046 610 HG2 GLU 80 2HG GLU 80 -6.554 10.604 -1.311 611 HG3 GLU 80 1HG GLU 80 -7.564 9.796 -2.522 612 H ASP 81 H ASP 81 -7.065 11.535 0.479 613 HA ASP 81 HA ASP 81 -6.535 12.308 3.078 614 HB2 ASP 81 2HB ASP 81 -6.673 13.826 1.098 615 HB3 ASP 81 1HB ASP 81 -8.428 13.716 1.186 616 H GLU 82 H GLU 82 -9.465 11.018 1.727 617 HA GLU 82 HA GLU 82 -11.291 11.892 3.683 618 HB2 GLU 82 2HB GLU 82 -11.506 10.506 1.358 619 HB3 GLU 82 1HB GLU 82 -11.745 9.214 2.526 620 HG2 GLU 82 2HG GLU 82 -13.345 11.252 3.476 621 HG3 GLU 82 1HG GLU 82 -13.529 11.351 1.726 622 H GLU 83 H GLU 83 -10.048 8.566 3.336 623 HA GLU 83 HA GLU 83 -10.681 7.904 6.033 624 HB2 GLU 83 2HB GLU 83 -8.822 6.425 4.165 625 HB3 GLU 83 1HB GLU 83 -9.650 5.772 5.573 626 HG2 GLU 83 2HG GLU 83 -11.084 6.847 3.160 627 HG3 GLU 83 1HG GLU 83 -10.630 5.151 3.355 628 H GLU 84 H GLU 84 -9.559 8.353 7.805 629 HA GLU 84 HA GLU 84 -6.648 8.708 7.580 630 HB2 GLU 84 2HB GLU 84 -6.926 10.501 9.389 631 HB3 GLU 84 1HB GLU 84 -7.379 10.931 7.745 632 HG2 GLU 84 2HG GLU 84 -9.737 10.474 8.317 633 HG3 GLU 84 1HG GLU 84 -9.242 10.162 9.981 634 HA PRO 85 HA PRO 85 -7.454 5.672 10.922 635 HB2 PRO 85 2HB PRO 85 -5.287 4.141 10.446 636 HB3 PRO 85 1HB PRO 85 -6.776 3.994 9.492 637 HG2 PRO 85 2HG PRO 85 -4.234 5.442 8.832 638 HG3 PRO 85 1HG PRO 85 -5.234 4.397 7.796 639 HD2 PRO 85 2HD PRO 85 -5.344 7.119 7.722 640 HD3 PRO 85 1HD PRO 85 -6.736 6.077 7.339 641 H LYS 86 H LYS 86 -5.172 8.063 10.371 642 HA LYS 86 HA LYS 86 -3.446 8.978 11.550 643 HB2 LYS 86 2HB LYS 86 -3.957 9.209 14.014 644 HB3 LYS 86 1HB LYS 86 -5.196 9.803 12.903 645 HG2 LYS 86 2HG LYS 86 -6.522 7.816 13.271 646 HG3 LYS 86 1HG LYS 86 -5.261 7.132 14.299 647 HD2 LYS 86 2HD LYS 86 -5.860 8.381 16.071 648 HD3 LYS 86 1HD LYS 86 -6.144 9.815 15.082 649 HE2 LYS 86 2HE LYS 86 -8.323 9.126 14.524 650 HE3 LYS 86 1HE LYS 86 -8.032 7.478 15.081 651 HZ1 LYS 86 3HZ LYS 86 -7.596 8.877 17.317 652 HZ2 LYS 86 1HZ LYS 86 -9.090 8.199 16.904 653 HZ3 LYS 86 2HZ LYS 86 -8.787 9.831 16.588 654 H ASP 87 H ASP 87 -1.770 7.553 11.081 655 HA ASP 87 HA ASP 87 -0.433 6.428 13.250 656 HB2 ASP 87 2HB ASP 87 -2.471 4.762 12.632 657 HB3 ASP 87 1HB ASP 87 -1.220 4.129 11.552 658 H GLU 88 H GLU 88 1.273 4.695 12.326 659 HA GLU 88 HA GLU 88 2.869 6.124 10.497 660 HB2 GLU 88 2HB GLU 88 3.039 3.588 11.966 661 HB3 GLU 88 1HB GLU 88 3.922 3.600 10.446 662 HG2 GLU 88 2HG GLU 88 5.458 4.291 12.054 663 HG3 GLU 88 1HG GLU 88 4.962 5.769 11.236 664 H ASP 89 H ASP 89 0.271 3.970 9.985 665 HA ASP 89 HA ASP 89 0.974 2.715 7.602 666 HB2 ASP 89 2HB ASP 89 -1.754 3.664 8.508 667 HB3 ASP 89 1HB ASP 89 -1.462 2.526 7.184 668 H PHE 90 H PHE 90 0.501 6.040 8.171 669 HA PHE 90 HA PHE 90 -0.267 6.655 5.437 670 HB2 PHE 90 2HB PHE 90 -0.060 8.137 7.992 671 HB3 PHE 90 1HB PHE 90 0.326 9.071 6.541 672 HD1 PHE 90 2HD PHE 90 -1.592 7.825 4.626 673 HD2 PHE 90 1HD PHE 90 -2.079 9.068 8.666 674 HE1 PHE 90 2HE PHE 90 -3.992 8.188 4.221 675 HE2 PHE 90 1HE PHE 90 -4.478 9.435 8.268 676 HZ PHE 90 HZ PHE 90 -5.436 8.996 6.042 677 H SER 91 H SER 91 2.492 7.208 7.596 678 HA SER 91 HA SER 91 4.403 6.926 5.514 679 HB2 SER 91 2HB SER 91 3.499 9.663 6.251 680 HB3 SER 91 1HB SER 91 5.241 9.417 6.054 681 HG SER 91 HG SER 91 3.632 9.904 4.148 682 HA PRO 92 HA PRO 92 6.155 6.315 9.684 683 HB2 PRO 92 2HB PRO 92 7.251 3.834 8.960 684 HB3 PRO 92 1HB PRO 92 5.735 4.102 9.834 685 HG2 PRO 92 2HG PRO 92 6.049 3.057 7.219 686 HG3 PRO 92 1HG PRO 92 4.536 3.478 8.030 687 HD2 PRO 92 2HD PRO 92 6.072 4.989 6.001 688 HD3 PRO 92 1HD PRO 92 4.341 5.044 6.381 689 H ASP 93 H ASP 93 7.848 5.101 6.781 690 HA ASP 93 HA ASP 93 10.436 5.263 7.580 691 HB2 ASP 93 2HB ASP 93 9.047 5.249 5.050 692 HB3 ASP 93 1HB ASP 93 10.483 6.278 4.953 693 H GLY 94 H GLY 94 9.182 7.882 5.517 694 HA2 GLY 94 2HA GLY 94 10.955 9.725 6.974 695 HA3 GLY 94 1HA GLY 94 10.324 9.980 5.344 696 H GLY 95 H GLY 95 9.345 11.930 5.627 697 HA2 GLY 95 2HA GLY 95 7.006 11.924 7.419 698 HA3 GLY 95 1HA GLY 95 8.142 13.277 7.464 699 H TYR 96 H TYR 96 6.412 11.402 4.962 700 HA TYR 96 HA TYR 96 5.862 13.934 3.581 701 HB2 TYR 96 2HB TYR 96 4.988 11.954 1.872 702 HB3 TYR 96 1HB TYR 96 6.566 12.747 1.805 703 HD1 TYR 96 2HD TYR 96 8.438 11.635 3.275 704 HD2 TYR 96 1HD TYR 96 4.886 9.661 2.027 705 HE1 TYR 96 2HE TYR 96 9.533 9.462 3.618 706 HE2 TYR 96 1HE TYR 96 5.970 7.477 2.359 707 HH TYR 96 HH TYR 96 8.312 6.845 4.117 708 H ILE 97 H ILE 97 3.639 13.346 2.121 709 HA ILE 97 HA ILE 97 1.599 12.321 3.896 710 HB ILE 97 HB ILE 97 0.266 14.517 3.522 711 HG12 ILE 97 2HG1 ILE 97 2.897 15.874 3.667 712 HG13 ILE 97 1HG1 ILE 97 2.430 15.236 2.086 713 HG21 ILE 97 1HG2 ILE 97 2.564 14.428 5.469 714 HG22 ILE 97 2HG2 ILE 97 0.987 13.672 5.701 715 HG23 ILE 97 3HG2 ILE 97 1.119 15.428 5.611 716 HD11 ILE 97 3HD1 ILE 97 0.167 16.508 2.777 717 HD12 ILE 97 1HD1 ILE 97 1.481 17.248 1.860 718 HD13 ILE 97 2HD1 ILE 97 1.361 17.509 3.603 719 HA PRO 98 HA PRO 98 1.451 10.039 2.940 720 HB2 PRO 98 2HB PRO 98 -1.171 9.408 1.529 721 HB3 PRO 98 1HB PRO 98 -0.446 8.571 2.931 722 HG2 PRO 98 2HG PRO 98 -1.977 10.979 2.906 723 HG3 PRO 98 1HG PRO 98 -1.236 10.146 4.300 724 HD2 PRO 98 2HD PRO 98 -0.257 12.445 3.671 725 HD3 PRO 98 1HD PRO 98 0.886 11.101 3.887 726 H ARG 99 H ARG 99 2.254 8.088 2.046 727 HA ARG 99 HA ARG 99 2.538 8.129 -0.893 728 HB2 ARG 99 2HB ARG 99 4.502 7.966 1.274 729 HB3 ARG 99 1HB ARG 99 4.732 6.753 0.016 730 HG2 ARG 99 2HG ARG 99 6.051 8.738 -0.410 731 HG3 ARG 99 1HG ARG 99 4.839 8.506 -1.668 732 HD2 ARG 99 2HD ARG 99 3.560 10.095 0.193 733 HD3 ARG 99 1HD ARG 99 5.210 10.708 0.198 734 HE ARG 99 HE ARG 99 4.325 10.390 -2.457 735 HH11 ARG 99 1HH1 ARG 99 3.823 12.425 0.333 736 HH12 ARG 99 2HH1 ARG 99 3.389 13.814 -0.604 737 HH21 ARG 99 1HH2 ARG 99 3.754 12.216 -3.690 738 HH22 ARG 99 2HH2 ARG 99 3.349 13.695 -2.887 739 H ILE 100 H ILE 100 3.810 5.744 -1.290 740 HA ILE 100 HA ILE 100 1.647 3.870 -0.853 741 HB ILE 100 HB ILE 100 3.045 2.282 -2.163 742 HG12 ILE 100 2HG1 ILE 100 4.894 4.493 -2.912 743 HG13 ILE 100 1HG1 ILE 100 5.186 3.672 -1.380 744 HG21 ILE 100 1HG2 ILE 100 2.124 3.110 -4.013 745 HG22 ILE 100 2HG2 ILE 100 3.130 4.556 -3.959 746 HG23 ILE 100 3HG2 ILE 100 1.630 4.491 -3.034 747 HD11 ILE 100 3HD1 ILE 100 4.731 1.700 -3.363 748 HD12 ILE 100 1HD1 ILE 100 6.205 2.038 -2.454 749 HD13 ILE 100 2HD1 ILE 100 5.906 2.858 -3.986 750 H LEU 101 H LEU 101 1.648 2.137 0.517 751 HA LEU 101 HA LEU 101 4.078 1.614 2.076 752 HB2 LEU 101 2HB LEU 101 1.462 2.611 3.024 753 HB3 LEU 101 1HB LEU 101 2.192 1.345 3.987 754 HG LEU 101 HG LEU 101 4.243 2.761 4.176 755 HD11 LEU 101 1HD1 LEU 101 4.412 4.423 2.694 756 HD12 LEU 101 2HD1 LEU 101 3.315 5.304 3.754 757 HD13 LEU 101 3HD1 LEU 101 2.680 4.428 2.363 758 HD21 LEU 101 3HD2 LEU 101 3.381 3.395 6.124 759 HD22 LEU 101 1HD2 LEU 101 1.799 2.896 5.529 760 HD23 LEU 101 2HD2 LEU 101 2.326 4.566 5.331 761 H PHE 102 H PHE 102 4.493 -0.513 2.355 762 HA PHE 102 HA PHE 102 2.363 -2.400 1.613 763 HB2 PHE 102 2HB PHE 102 5.339 -2.860 1.855 764 HB3 PHE 102 1HB PHE 102 4.162 -4.033 1.284 765 HD1 PHE 102 1HD PHE 102 5.326 -0.567 0.542 766 HD2 PHE 102 2HD PHE 102 3.888 -4.269 -0.980 767 HE1 PHE 102 1HE PHE 102 5.625 0.266 -1.754 768 HE2 PHE 102 2HE PHE 102 4.183 -3.446 -3.279 769 HZ PHE 102 HZ PHE 102 5.054 -1.175 -3.670 770 H LEU 103 H LEU 103 1.814 -4.143 2.979 771 HA LEU 103 HA LEU 103 3.133 -4.313 5.562 772 HB2 LEU 103 2HB LEU 103 1.224 -3.835 6.884 773 HB3 LEU 103 1HB LEU 103 1.492 -2.495 5.794 774 HG LEU 103 HG LEU 103 -0.611 -4.618 5.491 775 HD11 LEU 103 1HD1 LEU 103 -2.175 -2.824 5.941 776 HD12 LEU 103 2HD1 LEU 103 -0.836 -1.703 6.179 777 HD13 LEU 103 3HD1 LEU 103 -1.065 -3.046 7.289 778 HD21 LEU 103 3HD2 LEU 103 -0.052 -4.008 3.318 779 HD22 LEU 103 1HD2 LEU 103 0.243 -2.328 3.759 780 HD23 LEU 103 2HD2 LEU 103 -1.406 -2.954 3.710 781 H ASP 104 H ASP 104 1.726 -5.860 7.038 782 HA ASP 104 HA ASP 104 1.639 -8.346 5.584 783 HB2 ASP 104 2HB ASP 104 1.796 -7.504 8.386 784 HB3 ASP 104 1HB ASP 104 0.786 -8.937 8.136 785 HA PRO 105 HA PRO 105 -2.658 -8.676 4.640 786 HB2 PRO 105 2HB PRO 105 -2.418 -11.483 5.602 787 HB3 PRO 105 1HB PRO 105 -2.999 -10.864 4.044 788 HG2 PRO 105 2HG PRO 105 -0.596 -12.007 4.266 789 HG3 PRO 105 1HG PRO 105 -0.861 -10.609 3.200 790 HD2 PRO 105 2HD PRO 105 0.458 -10.736 5.876 791 HD3 PRO 105 1HD PRO 105 0.857 -9.737 4.465 792 H SER 106 H SER 106 -3.431 -7.362 6.328 793 HA SER 106 HA SER 106 -5.379 -8.278 7.950 794 HB2 SER 106 2HB SER 106 -2.746 -8.824 9.153 795 HB3 SER 106 1HB SER 106 -3.861 -7.954 10.220 796 HG SER 106 HG SER 106 -5.019 -9.699 10.403 797 H GLY 107 H GLY 107 -2.717 -6.080 7.568 798 HA2 GLY 107 2HA GLY 107 -3.307 -3.721 7.282 799 HA3 GLY 107 1HA GLY 107 -4.409 -3.916 8.651 800 H LYS 108 H LYS 108 -1.058 -5.059 8.287 801 HA LYS 108 HA LYS 108 -0.376 -3.357 10.605 802 HB2 LYS 108 2HB LYS 108 0.078 -6.200 10.068 803 HB3 LYS 108 1HB LYS 108 1.512 -5.348 10.623 804 HG2 LYS 108 2HG LYS 108 -0.806 -4.644 12.199 805 HG3 LYS 108 1HG LYS 108 -0.528 -6.395 12.187 806 HD2 LYS 108 2HD LYS 108 1.998 -5.462 12.550 807 HD3 LYS 108 1HD LYS 108 1.059 -4.229 13.393 808 HE2 LYS 108 2HE LYS 108 1.645 -5.934 14.969 809 HE3 LYS 108 1HE LYS 108 -0.085 -6.048 14.648 810 HZ1 LYS 108 3HZ LYS 108 1.075 -8.217 14.681 811 HZ2 LYS 108 1HZ LYS 108 1.965 -7.739 13.323 812 HZ3 LYS 108 2HZ LYS 108 0.286 -7.907 13.218 813 H VAL 109 H VAL 109 0.180 -1.695 8.940 814 HA VAL 109 HA VAL 109 2.191 -1.943 7.037 815 HB VAL 109 HB VAL 109 1.059 0.318 8.599 816 HG11 VAL 109 1HG1 VAL 109 3.713 0.372 7.248 817 HG12 VAL 109 2HG1 VAL 109 3.204 1.111 8.765 818 HG13 VAL 109 3HG1 VAL 109 2.685 1.804 7.230 819 HG21 VAL 109 3HG2 VAL 109 1.055 1.145 6.078 820 HG22 VAL 109 1HG2 VAL 109 -0.177 0.055 6.708 821 HG23 VAL 109 2HG2 VAL 109 1.177 -0.587 5.779 822 H HIS 110 H HIS 110 4.319 -1.930 7.017 823 HA HIS 110 HA HIS 110 5.742 -1.374 9.511 824 HB2 HIS 110 2HB HIS 110 7.053 -3.408 9.391 825 HB3 HIS 110 1HB HIS 110 5.345 -3.825 9.443 826 HD1 HIS 110 1HD HIS 110 7.409 -5.821 8.369 827 HD2 HIS 110 2HD HIS 110 5.291 -3.167 5.974 828 HE1 HIS 110 1HE HIS 110 7.412 -6.839 6.071 829 HE2 HIS 110 2HE HIS 110 6.061 -5.252 4.655 830 HA PRO 111 HA PRO 111 8.366 0.732 6.636 831 HB2 PRO 111 2HB PRO 111 10.525 1.121 8.228 832 HB3 PRO 111 1HB PRO 111 9.029 2.044 8.408 833 HG2 PRO 111 2HG PRO 111 9.995 -0.319 9.967 834 HG3 PRO 111 1HG PRO 111 9.215 1.161 10.550 835 HD2 PRO 111 2HD PRO 111 7.881 -1.181 10.228 836 HD3 PRO 111 1HD PRO 111 7.106 0.408 10.018 837 H GLU 112 H GLU 112 8.283 -2.148 6.471 838 HA GLU 112 HA GLU 112 11.123 -2.825 6.103 839 HB2 GLU 112 2HB GLU 112 9.073 -4.250 7.305 840 HB3 GLU 112 1HB GLU 112 9.215 -5.002 5.722 841 HG2 GLU 112 2HG GLU 112 11.832 -4.749 6.553 842 HG3 GLU 112 1HG GLU 112 10.963 -5.166 8.030 843 H ILE 113 H ILE 113 7.969 -3.251 4.501 844 HA ILE 113 HA ILE 113 9.358 -3.587 1.950 845 HB ILE 113 HB ILE 113 6.435 -3.979 2.601 846 HG12 ILE 113 2HG1 ILE 113 7.828 -5.616 3.740 847 HG13 ILE 113 1HG1 ILE 113 6.966 -6.389 2.401 848 HG21 ILE 113 1HG2 ILE 113 7.332 -3.421 0.164 849 HG22 ILE 113 2HG2 ILE 113 6.055 -4.605 0.440 850 HG23 ILE 113 3HG2 ILE 113 7.714 -5.142 0.187 851 HD11 ILE 113 3HD1 ILE 113 9.778 -6.237 2.910 852 HD12 ILE 113 1HD1 ILE 113 9.407 -5.515 1.345 853 HD13 ILE 113 2HD1 ILE 113 8.907 -7.170 1.694 854 H ILE 114 H ILE 114 9.904 -1.664 1.178 855 HA ILE 114 HA ILE 114 7.828 0.416 0.939 856 HB ILE 114 HB ILE 114 9.666 2.047 0.781 857 HG12 ILE 114 2HG1 ILE 114 11.327 0.192 0.052 858 HG13 ILE 114 1HG1 ILE 114 11.920 1.502 1.065 859 HG21 ILE 114 1HG2 ILE 114 10.506 1.366 3.293 860 HG22 ILE 114 2HG2 ILE 114 8.984 0.488 3.152 861 HG23 ILE 114 3HG2 ILE 114 9.018 2.234 2.911 862 HD11 ILE 114 3HD1 ILE 114 12.261 -1.183 1.514 863 HD12 ILE 114 1HD1 ILE 114 10.946 -0.756 2.612 864 HD13 ILE 114 2HD1 ILE 114 12.484 0.105 2.698 865 H ASN 115 H ASN 115 8.682 2.030 -0.918 866 HA ASN 115 HA ASN 115 8.218 0.741 -3.344 867 HB2 ASN 115 2HB ASN 115 7.832 3.128 -3.046 868 HB3 ASN 115 1HB ASN 115 9.564 3.397 -2.809 869 HD21 ASN 115 1HD2 ASN 115 9.712 4.821 -4.511 870 HD22 ASN 115 2HD2 ASN 115 9.614 4.306 -6.172 871 H GLU 116 H GLU 116 11.214 1.479 -1.679 872 HA GLU 116 HA GLU 116 13.327 0.677 -1.951 873 HB2 GLU 116 2HB GLU 116 11.702 -1.291 -3.171 874 HB3 GLU 116 1HB GLU 116 13.062 -1.008 -4.265 875 HG2 GLU 116 2HG GLU 116 13.236 -1.747 -1.349 876 HG3 GLU 116 1HG GLU 116 13.552 -2.807 -2.722 877 H ASN 117 H ASN 117 11.939 0.787 -5.240 878 HA ASN 117 HA ASN 117 14.168 1.668 -6.590 879 HB2 ASN 117 2HB ASN 117 11.836 0.974 -7.479 880 HB3 ASN 117 1HB ASN 117 11.431 2.688 -7.311 881 HD21 ASN 117 1HD2 ASN 117 12.313 4.169 -8.693 882 HD22 ASN 117 2HD2 ASN 117 13.210 3.719 -10.119 883 H GLY 118 H GLY 118 12.084 3.482 -4.485 884 HA2 GLY 118 2HA GLY 118 12.544 6.082 -5.381 885 HA3 GLY 118 1HA GLY 118 12.198 5.635 -3.707 886 H ASN 119 H ASN 119 13.654 7.597 -3.509 887 HA ASN 119 HA ASN 119 16.489 7.070 -3.858 888 HB2 ASN 119 2HB ASN 119 16.792 9.367 -3.041 889 HB3 ASN 119 1HB ASN 119 15.590 9.314 -4.339 890 HD21 ASN 119 1HD2 ASN 119 16.135 9.764 -0.933 891 HD22 ASN 119 2HD2 ASN 119 14.573 10.448 -0.571 892 HA PRO 120 HA PRO 120 17.262 5.777 0.297 893 HB2 PRO 120 2HB PRO 120 19.696 6.795 0.836 894 HB3 PRO 120 1HB PRO 120 19.457 5.516 -0.371 895 HG2 PRO 120 2HG PRO 120 19.808 8.465 -0.772 896 HG3 PRO 120 1HG PRO 120 20.521 7.114 -1.682 897 HD2 PRO 120 2HD PRO 120 18.344 8.534 -2.532 898 HD3 PRO 120 1HD PRO 120 18.647 6.838 -2.976 899 H SER 121 H SER 121 15.458 7.759 0.481 900 HA SER 121 HA SER 121 15.731 8.774 3.037 901 HB2 SER 121 2HB SER 121 16.838 10.542 0.907 902 HB3 SER 121 1HB SER 121 15.827 11.308 2.143 903 HG SER 121 HG SER 121 17.686 11.327 3.167 904 H TYR 122 H TYR 122 13.808 7.532 1.466 905 HA TYR 122 HA TYR 122 11.526 9.105 1.998 906 HB2 TYR 122 2HB TYR 122 12.802 9.528 -0.539 907 HB3 TYR 122 1HB TYR 122 11.218 8.795 -0.794 908 HD1 TYR 122 1HD TYR 122 9.268 9.922 0.624 909 HD2 TYR 122 2HD TYR 122 12.939 11.814 -0.394 910 HE1 TYR 122 1HE TYR 122 8.216 12.122 0.943 911 HE2 TYR 122 2HE TYR 122 11.899 14.018 -0.076 912 HH TYR 122 HH TYR 122 9.022 14.730 -0.198 913 H LYS 123 H LYS 123 12.902 6.500 0.057 914 HA LYS 123 HA LYS 123 12.163 4.412 -0.478 915 HB2 LYS 123 2HB LYS 123 11.073 4.744 2.312 916 HB3 LYS 123 1HB LYS 123 11.039 3.218 1.444 917 HG2 LYS 123 2HG LYS 123 13.473 4.782 2.272 918 HG3 LYS 123 1HG LYS 123 12.919 3.230 2.921 919 HD2 LYS 123 2HD LYS 123 14.242 2.244 1.422 920 HD3 LYS 123 1HD LYS 123 13.124 2.813 0.174 921 HE2 LYS 123 2HE LYS 123 14.426 4.752 -0.229 922 HE3 LYS 123 1HE LYS 123 15.404 4.481 1.213 923 HZ1 LYS 123 3HZ LYS 123 16.411 2.592 0.205 924 HZ2 LYS 123 1HZ LYS 123 16.510 3.867 -0.903 925 HZ3 LYS 123 2HZ LYS 123 15.359 2.646 -1.118 926 H TYR 124 H TYR 124 9.309 4.861 1.487 927 HA TYR 124 HA TYR 124 7.481 3.832 -0.209 928 HB2 TYR 124 2HB TYR 124 7.148 6.009 1.844 929 HB3 TYR 124 1HB TYR 124 5.778 5.258 1.012 930 HD1 TYR 124 1HD TYR 124 6.428 2.466 0.908 931 HD2 TYR 124 2HD TYR 124 7.184 5.247 4.035 932 HE1 TYR 124 1HE TYR 124 6.432 0.627 2.535 933 HE2 TYR 124 2HE TYR 124 7.194 3.411 5.670 934 HH TYR 124 HH TYR 124 6.056 0.307 4.953 935 H PHE 125 H PHE 125 9.001 6.898 -0.661 936 HA PHE 125 HA PHE 125 6.935 8.055 -2.273 937 HB2 PHE 125 2HB PHE 125 8.577 9.495 -1.192 938 HB3 PHE 125 1HB PHE 125 9.888 8.694 -2.068 939 HD1 PHE 125 2HD PHE 125 7.054 11.009 -2.353 940 HD2 PHE 125 1HD PHE 125 10.358 9.219 -4.349 941 HE1 PHE 125 2HE PHE 125 6.838 12.650 -4.174 942 HE2 PHE 125 1HE PHE 125 10.149 10.857 -6.173 943 HZ PHE 125 HZ PHE 125 8.387 12.575 -6.088 944 H TYR 126 H TYR 126 6.458 7.602 -4.338 945 HA TYR 126 HA TYR 126 8.474 6.164 -5.936 946 HB2 TYR 126 2HB TYR 126 6.707 4.897 -6.998 947 HB3 TYR 126 1HB TYR 126 6.570 4.721 -5.242 948 HD1 TYR 126 1HD TYR 126 4.934 6.450 -4.095 949 HD2 TYR 126 2HD TYR 126 4.805 5.374 -8.210 950 HE1 TYR 126 1HE TYR 126 2.592 7.185 -4.206 951 HE2 TYR 126 2HE TYR 126 2.459 6.105 -8.331 952 HH TYR 126 HH TYR 126 0.493 6.348 -6.189 953 H VAL 127 H VAL 127 7.837 6.249 -8.357 954 HA VAL 127 HA VAL 127 6.494 8.579 -9.298 955 HB VAL 127 HB VAL 127 8.615 9.484 -10.439 956 HG11 VAL 127 1HG1 VAL 127 8.650 9.960 -7.491 957 HG12 VAL 127 2HG1 VAL 127 7.245 10.433 -8.448 958 HG13 VAL 127 3HG1 VAL 127 8.831 11.111 -8.816 959 HG21 VAL 127 3HG2 VAL 127 9.937 7.440 -9.574 960 HG22 VAL 127 1HG2 VAL 127 10.034 8.342 -8.062 961 HG23 VAL 127 2HG2 VAL 127 10.709 9.024 -9.542 962 H SER 128 H SER 128 5.440 7.315 -10.733 963 HA SER 128 HA SER 128 5.228 6.694 -12.980 964 HB2 SER 128 2HB SER 128 6.996 6.155 -14.379 965 HB3 SER 128 1HB SER 128 7.777 7.246 -13.223 966 HG SER 128 HG SER 128 8.640 4.937 -13.802 967 H ALA 129 H ALA 129 4.319 4.841 -13.658 968 HA ALA 129 HA ALA 129 3.924 2.741 -11.819 969 HB1 ALA 129 1HB ALA 129 2.886 1.606 -13.877 970 HB2 ALA 129 2HB ALA 129 3.221 3.128 -14.703 971 HB3 ALA 129 3HB ALA 129 2.163 3.104 -13.291 972 H GLU 130 H GLU 130 6.461 3.312 -14.023 973 HA GLU 130 HA GLU 130 7.125 0.672 -14.741 974 HB2 GLU 130 2HB GLU 130 8.317 3.315 -14.956 975 HB3 GLU 130 1HB GLU 130 9.534 2.077 -14.622 976 HG2 GLU 130 2HG GLU 130 8.079 0.866 -16.564 977 HG3 GLU 130 1HG GLU 130 7.934 2.568 -17.034 978 H GLN 131 H GLN 131 8.554 2.760 -12.203 979 HA GLN 131 HA GLN 131 10.078 0.635 -11.137 980 HB2 GLN 131 2HB GLN 131 10.283 2.130 -9.124 981 HB3 GLN 131 1HB GLN 131 10.920 2.747 -10.643 982 HG2 GLN 131 2HG GLN 131 9.465 4.447 -10.710 983 HG3 GLN 131 1HG GLN 131 8.129 3.462 -10.113 984 HE21 GLN 131 1HE2 GLN 131 10.679 5.623 -9.296 985 HE22 GLN 131 2HE2 GLN 131 10.293 5.792 -7.620 986 H VAL 132 H VAL 132 6.903 1.958 -10.323 987 HA VAL 132 HA VAL 132 6.526 0.671 -7.896 988 HB VAL 132 HB VAL 132 4.276 1.152 -8.036 989 HG11 VAL 132 1HG1 VAL 132 4.661 3.167 -10.062 990 HG12 VAL 132 2HG1 VAL 132 6.040 3.070 -8.968 991 HG13 VAL 132 3HG1 VAL 132 4.422 3.341 -8.324 992 HG21 VAL 132 3HG2 VAL 132 4.536 0.466 -10.903 993 HG22 VAL 132 1HG2 VAL 132 3.266 1.599 -10.445 994 HG23 VAL 132 2HG2 VAL 132 3.311 -0.012 -9.732 995 H VAL 133 H VAL 133 6.501 -0.601 -11.131 996 HA VAL 133 HA VAL 133 5.176 -3.044 -10.391 997 HB VAL 133 HB VAL 133 5.146 -2.090 -12.741 998 HG11 VAL 133 1HG1 VAL 133 7.422 -3.471 -13.722 999 HG12 VAL 133 2HG1 VAL 133 7.954 -2.372 -12.455 1000 HG13 VAL 133 3HG1 VAL 133 7.047 -1.751 -13.831 1001 HG21 VAL 133 3HG2 VAL 133 4.851 -4.198 -13.690 1002 HG22 VAL 133 1HG2 VAL 133 4.588 -4.477 -11.968 1003 HG23 VAL 133 2HG2 VAL 133 6.127 -4.922 -12.708 1004 H GLN 134 H GLN 134 8.526 -1.912 -10.676 1005 HA GLN 134 HA GLN 134 9.568 -4.598 -10.379 1006 HB2 GLN 134 2HB GLN 134 11.728 -3.250 -9.746 1007 HB3 GLN 134 1HB GLN 134 11.170 -3.305 -11.411 1008 HG2 GLN 134 2HG GLN 134 10.112 -1.134 -11.130 1009 HG3 GLN 134 1HG GLN 134 10.669 -1.079 -9.459 1010 HE21 GLN 134 1HE2 GLN 134 11.309 -0.095 -12.533 1011 HE22 GLN 134 2HE2 GLN 134 13.010 0.253 -12.375 1012 H GLY 135 H GLY 135 8.643 -1.979 -8.309 1013 HA2 GLY 135 2HA GLY 135 9.807 -3.100 -5.925 1014 HA3 GLY 135 1HA GLY 135 8.649 -1.762 -6.004 1015 H MET 136 H MET 136 6.872 -3.459 -7.740 1016 HA MET 136 HA MET 136 5.390 -4.679 -5.576 1017 HB2 MET 136 2HB MET 136 4.834 -3.749 -8.260 1018 HB3 MET 136 1HB MET 136 4.178 -5.361 -8.016 1019 HG2 MET 136 2HG MET 136 2.493 -4.561 -6.833 1020 HG3 MET 136 1HG MET 136 3.595 -3.724 -5.740 1021 HE1 MET 136 3HE MET 136 1.628 -1.726 -5.453 1022 HE2 MET 136 1HE MET 136 0.699 -2.839 -6.459 1023 HE3 MET 136 2HE MET 136 0.787 -1.130 -6.883 1024 H LYS 137 H LYS 137 6.998 -5.724 -8.546 1025 HA LYS 137 HA LYS 137 6.479 -8.483 -8.183 1026 HB2 LYS 137 2HB LYS 137 7.976 -8.852 -10.010 1027 HB3 LYS 137 1HB LYS 137 7.052 -7.405 -10.361 1028 HG2 LYS 137 2HG LYS 137 9.130 -6.207 -9.305 1029 HG3 LYS 137 1HG LYS 137 9.940 -7.715 -9.738 1030 HD2 LYS 137 2HD LYS 137 8.534 -5.767 -11.552 1031 HD3 LYS 137 1HD LYS 137 10.227 -6.258 -11.584 1032 HE2 LYS 137 2HE LYS 137 7.899 -8.088 -12.160 1033 HE3 LYS 137 1HE LYS 137 8.850 -7.262 -13.392 1034 HZ1 LYS 137 3HZ LYS 137 10.360 -8.814 -11.455 1035 HZ2 LYS 137 1HZ LYS 137 10.572 -8.664 -13.126 1036 HZ3 LYS 137 2HZ LYS 137 9.392 -9.711 -12.514 1037 H GLU 138 H GLU 138 8.585 -6.348 -6.626 1038 HA GLU 138 HA GLU 138 10.670 -8.213 -5.985 1039 HB2 GLU 138 2HB GLU 138 10.596 -5.533 -5.946 1040 HB3 GLU 138 1HB GLU 138 10.177 -5.838 -4.262 1041 HG2 GLU 138 2HG GLU 138 12.248 -7.346 -4.222 1042 HG3 GLU 138 1HG GLU 138 12.694 -6.532 -5.731 1043 H ALA 139 H ALA 139 8.300 -6.529 -3.949 1044 HA ALA 139 HA ALA 139 8.529 -8.260 -1.744 1045 HB1 ALA 139 1HB ALA 139 7.145 -6.790 -0.794 1046 HB2 ALA 139 2HB ALA 139 5.876 -7.127 -1.972 1047 HB3 ALA 139 3HB ALA 139 7.119 -5.928 -2.332 1048 H GLN 140 H GLN 140 6.947 -8.575 -4.765 1049 HA GLN 140 HA GLN 140 4.938 -10.426 -4.066 1050 HB2 GLN 140 2HB GLN 140 6.209 -9.480 -6.573 1051 HB3 GLN 140 1HB GLN 140 5.347 -11.020 -6.640 1052 HG2 GLN 140 2HG GLN 140 3.328 -9.956 -5.857 1053 HG3 GLN 140 1HG GLN 140 4.172 -8.421 -5.673 1054 HE21 GLN 140 1HE2 GLN 140 3.154 -7.184 -7.128 1055 HE22 GLN 140 2HE2 GLN 140 3.066 -7.519 -8.820 1056 H GLU 141 H GLU 141 8.313 -10.734 -4.261 1057 HA GLU 141 HA GLU 141 8.181 -13.616 -4.755 1058 HB2 GLU 141 2HB GLU 141 9.840 -12.742 -6.114 1059 HB3 GLU 141 1HB GLU 141 10.351 -11.560 -4.904 1060 HG2 GLU 141 2HG GLU 141 11.519 -13.188 -3.669 1061 HG3 GLU 141 1HG GLU 141 10.770 -14.512 -4.558 1062 H ARG 142 H ARG 142 8.528 -11.383 -2.171 1063 HA ARG 142 HA ARG 142 9.307 -13.607 -0.407 1064 HB2 ARG 142 2HB ARG 142 10.476 -11.828 1.001 1065 HB3 ARG 142 1HB ARG 142 11.258 -12.304 -0.510 1066 HG2 ARG 142 2HG ARG 142 10.519 -10.311 -1.603 1067 HG3 ARG 142 1HG ARG 142 9.506 -9.870 -0.217 1068 HD2 ARG 142 2HD ARG 142 11.574 -8.574 -0.254 1069 HD3 ARG 142 1HD ARG 142 11.490 -9.620 1.171 1070 HE ARG 142 HE ARG 142 12.876 -11.115 -0.601 1071 HH11 ARG 142 1HH1 ARG 142 13.249 -7.837 0.539 1072 HH12 ARG 142 2HH1 ARG 142 14.968 -7.831 0.340 1073 HH21 ARG 142 1HH2 ARG 142 15.139 -11.108 -0.862 1074 HH22 ARG 142 2HH2 ARG 142 16.041 -9.687 -0.455 1075 H LEU 143 H LEU 143 7.738 -10.416 -0.538 1076 HA LEU 143 HA LEU 143 6.612 -10.563 2.045 1077 HB2 LEU 143 2HB LEU 143 6.955 -8.493 0.669 1078 HB3 LEU 143 1HB LEU 143 5.563 -8.983 -0.295 1079 HG LEU 143 HG LEU 143 4.128 -8.833 1.680 1080 HD11 LEU 143 1HD1 LEU 143 6.728 -8.336 3.037 1081 HD12 LEU 143 2HD1 LEU 143 5.349 -9.305 3.556 1082 HD13 LEU 143 3HD1 LEU 143 5.278 -7.546 3.655 1083 HD21 LEU 143 3HD2 LEU 143 4.743 -6.261 2.120 1084 HD22 LEU 143 1HD2 LEU 143 3.948 -6.826 0.651 1085 HD23 LEU 143 2HD2 LEU 143 5.688 -6.545 0.660 1086 H THR 144 H THR 144 5.762 -12.180 -0.831 1087 HA THR 144 HA THR 144 3.028 -12.346 -0.805 1088 HB THR 144 HB THR 144 3.450 -14.770 -1.572 1089 HG1 THR 144 1HG THR 144 5.524 -14.981 -0.676 1090 HG21 THR 144 3HG2 THR 144 2.995 -13.133 -3.215 1091 HG22 THR 144 1HG2 THR 144 4.432 -14.015 -3.735 1092 HG23 THR 144 2HG2 THR 144 4.592 -12.411 -3.021 1093 H GLY 145 H GLY 145 5.269 -13.738 1.468 1094 HA2 GLY 145 2HA GLY 145 3.798 -14.050 3.632 1095 HA3 GLY 145 1HA GLY 145 3.172 -15.382 2.673 1096 H ASP 146 H ASP 146 5.181 -14.730 5.103 1097 HA ASP 146 HA ASP 146 6.786 -15.906 6.187 1098 HB2 ASP 146 2HB ASP 146 5.875 -17.904 4.167 1099 HB3 ASP 146 1HB ASP 146 7.366 -18.229 5.043 1100 H ALA 147 H ALA 147 7.328 -16.426 2.686 1101 HA ALA 147 HA ALA 147 10.034 -16.606 2.603 1102 HB1 ALA 147 1HB ALA 147 8.134 -15.253 0.715 1103 HB2 ALA 147 2HB ALA 147 8.901 -16.836 0.569 1104 HB3 ALA 147 3HB ALA 147 9.861 -15.369 0.372 1105 H PHE 148 H PHE 148 8.174 -13.756 3.336 1106 HA PHE 148 HA PHE 148 9.893 -11.689 2.824 1107 HB2 PHE 148 2HB PHE 148 8.786 -10.456 4.570 1108 HB3 PHE 148 1HB PHE 148 7.593 -11.499 3.788 1109 HD1 PHE 148 2HD PHE 148 6.637 -13.380 4.959 1110 HD2 PHE 148 1HD PHE 148 9.492 -10.852 6.843 1111 HE1 PHE 148 2HE PHE 148 6.020 -14.322 7.147 1112 HE2 PHE 148 1HE PHE 148 8.881 -11.787 9.035 1113 HZ PHE 148 HZ PHE 148 7.142 -13.525 9.189 1114 H ARG 149 H ARG 149 10.192 -14.154 5.271 1115 HA ARG 149 HA ARG 149 12.112 -12.868 6.899 1116 HB2 ARG 149 2HB ARG 149 11.704 -15.831 6.466 1117 HB3 ARG 149 1HB ARG 149 12.499 -15.071 7.832 1118 HG2 ARG 149 2HG ARG 149 10.165 -13.862 8.067 1119 HG3 ARG 149 1HG ARG 149 9.615 -15.301 7.210 1120 HD2 ARG 149 2HD ARG 149 9.600 -16.371 9.155 1121 HD3 ARG 149 1HD ARG 149 11.357 -16.234 9.186 1122 HE ARG 149 HE ARG 149 10.103 -13.873 10.162 1123 HH11 ARG 149 1HH1 ARG 149 10.970 -17.136 11.047 1124 HH12 ARG 149 2HH1 ARG 149 11.060 -16.785 12.742 1125 HH21 ARG 149 1HH2 ARG 149 10.220 -13.411 12.390 1126 HH22 ARG 149 2HH2 ARG 149 10.634 -14.671 13.503 1127 H LYS 150 H LYS 150 14.240 -14.570 7.121 1128 HA LYS 150 HA LYS 150 15.667 -14.041 4.621 1129 HB2 LYS 150 2HB LYS 150 16.504 -13.188 6.872 1130 HB3 LYS 150 1HB LYS 150 16.891 -14.861 7.247 1131 HG2 LYS 150 2HG LYS 150 18.022 -14.418 4.745 1132 HG3 LYS 150 1HG LYS 150 18.345 -12.944 5.659 1133 HD2 LYS 150 2HD LYS 150 18.792 -15.408 7.178 1134 HD3 LYS 150 1HD LYS 150 19.839 -15.236 5.767 1135 HE2 LYS 150 2HE LYS 150 20.054 -12.763 6.755 1136 HE3 LYS 150 1HE LYS 150 19.710 -13.629 8.252 1137 HZ1 LYS 150 3HZ LYS 150 21.693 -14.663 8.211 1138 HZ2 LYS 150 1HZ LYS 150 22.152 -13.353 7.245 1139 HZ3 LYS 150 2HZ LYS 150 21.720 -14.822 6.526 1140 H LYS 151 H LYS 151 15.844 -16.551 7.125 1141 HA LYS 151 HA LYS 151 16.396 -18.518 5.017 1142 HB2 LYS 151 2HB LYS 151 17.174 -18.263 7.871 1143 HB3 LYS 151 1HB LYS 151 16.916 -19.891 7.263 1144 HG2 LYS 151 2HG LYS 151 18.484 -18.596 5.335 1145 HG3 LYS 151 1HG LYS 151 19.158 -18.141 6.900 1146 HD2 LYS 151 2HD LYS 151 20.091 -20.149 7.128 1147 HD3 LYS 151 1HD LYS 151 18.527 -20.937 6.911 1148 HE2 LYS 151 2HE LYS 151 19.625 -19.935 4.413 1149 HE3 LYS 151 1HE LYS 151 20.696 -21.089 5.204 1150 HZ1 LYS 151 3HZ LYS 151 18.081 -21.506 4.011 1151 HZ2 LYS 151 1HZ LYS 151 18.373 -22.344 5.450 1152 HZ3 LYS 151 2HZ LYS 151 19.400 -22.559 4.124 1153 H HIS 152 H HIS 152 15.691 -20.856 6.043 1154 HA HIS 152 HA HIS 152 13.094 -20.833 7.254 1155 HB2 HIS 152 2HB HIS 152 12.012 -22.002 5.268 1156 HB3 HIS 152 1HB HIS 152 12.286 -20.272 5.099 1157 HD1 HIS 152 1HD HIS 152 15.334 -22.239 4.685 1158 HD2 HIS 152 2HD HIS 152 12.240 -20.898 2.260 1159 HE1 HIS 152 1HE HIS 152 16.180 -22.464 2.334 1160 HE2 HIS 152 2HE HIS 152 14.255 -21.746 0.876 1161 H LEU 153 H LEU 153 12.124 -23.252 6.711 1162 HA LEU 153 HA LEU 153 12.326 -25.352 7.607 1163 HB2 LEU 153 2HB LEU 153 13.571 -26.830 6.194 1164 HB3 LEU 153 1HB LEU 153 12.818 -25.596 5.206 1165 HG LEU 153 HG LEU 153 15.470 -24.750 5.897 1166 HD11 LEU 153 1HD1 LEU 153 16.428 -26.789 6.087 1167 HD12 LEU 153 2HD1 LEU 153 16.422 -26.681 4.328 1168 HD13 LEU 153 3HD1 LEU 153 15.163 -27.594 5.160 1169 HD21 LEU 153 3HD2 LEU 153 13.932 -24.167 3.931 1170 HD22 LEU 153 1HD2 LEU 153 14.533 -25.653 3.200 1171 HD23 LEU 153 2HD2 LEU 153 15.655 -24.356 3.607 1172 H GLU 154 H GLU 154 13.087 -24.560 9.689 1173 HA GLU 154 HA GLU 154 14.529 -24.450 11.459 1174 HB2 GLU 154 2HB GLU 154 15.676 -26.525 11.927 1175 HB3 GLU 154 1HB GLU 154 14.106 -26.876 11.221 1176 HG2 GLU 154 2HG GLU 154 15.032 -27.559 9.196 1177 HG3 GLU 154 1HG GLU 154 16.575 -26.774 9.532 1178 H ASP 155 H ASP 155 15.455 -23.072 9.056 1179 HA ASP 155 HA ASP 155 17.299 -21.996 8.271 1180 HB2 ASP 155 2HB ASP 155 17.464 -21.903 10.981 1181 HB3 ASP 155 1HB ASP 155 18.993 -22.685 10.591 1182 H GLU 156 H GLU 156 20.007 -22.424 8.493 1183 HA GLU 156 HA GLU 156 20.322 -25.147 7.410 1184 HB2 GLU 156 2HB GLU 156 20.567 -22.947 5.919 1185 HB3 GLU 156 1HB GLU 156 22.202 -22.988 6.589 1186 HG2 GLU 156 2HG GLU 156 20.893 -25.279 5.137 1187 HG3 GLU 156 1HG GLU 156 21.976 -24.105 4.388 1188 H LEU 157 H LEU 157 22.208 -22.463 8.815 1189 HA LEU 157 HA LEU 157 23.433 -24.277 10.704 1190 HB2 LEU 157 2HB LEU 157 25.737 -23.682 10.048 1191 HB3 LEU 157 1HB LEU 157 24.897 -24.614 8.825 1192 HG LEU 157 HG LEU 157 24.369 -22.157 7.900 1193 HD11 LEU 157 1HD1 LEU 157 26.672 -21.875 9.733 1194 HD12 LEU 157 2HD1 LEU 157 25.467 -20.690 9.226 1195 HD13 LEU 157 3HD1 LEU 157 26.808 -21.098 8.156 1196 HD21 LEU 157 3HD2 LEU 157 27.053 -23.383 7.362 1197 HD22 LEU 157 1HD2 LEU 157 25.963 -22.562 6.243 1198 HD23 LEU 157 2HD2 LEU 157 25.559 -24.169 6.849 Start of MODEL 40 1 H1 MET 1 1HT MET 1 -16.726 -6.709 18.559 2 H2 MET 1 2HT MET 1 -15.389 -6.864 19.625 3 H3 MET 1 3HT MET 1 -15.605 -7.988 18.348 4 HA MET 1 HA MET 1 -15.229 -5.116 17.891 5 HB2 MET 1 2HB MET 1 -13.237 -7.319 18.357 6 HB3 MET 1 1HB MET 1 -12.831 -5.949 17.332 7 HG2 MET 1 2HG MET 1 -12.858 -4.455 19.080 8 HG3 MET 1 1HG MET 1 -13.909 -5.468 20.068 9 HE1 MET 1 2HE MET 1 -13.221 -7.887 20.437 10 HE2 MET 1 3HE MET 1 -12.537 -7.447 22.001 11 HE3 MET 1 1HE MET 1 -11.598 -8.425 20.871 12 H HIS 2 H HIS 2 -14.562 -8.414 16.696 13 HA HIS 2 HA HIS 2 -15.315 -7.482 14.004 14 HB2 HIS 2 2HB HIS 2 -13.194 -9.438 14.869 15 HB3 HIS 2 1HB HIS 2 -13.817 -9.413 13.223 16 HD1 HIS 2 1HD HIS 2 -13.452 -7.092 11.907 17 HD2 HIS 2 2HD HIS 2 -11.231 -7.611 15.380 18 HE1 HIS 2 1HE HIS 2 -11.604 -5.393 11.783 19 HE2 HIS 2 2HE HIS 2 -10.323 -5.668 13.935 20 H HIS 3 H HIS 3 -17.075 -8.393 13.189 21 HA HIS 3 HA HIS 3 -18.115 -10.827 14.441 22 HB2 HIS 3 2HB HIS 3 -19.306 -8.447 13.259 23 HB3 HIS 3 1HB HIS 3 -20.021 -9.923 12.622 24 HD1 HIS 3 1HD HIS 3 -20.843 -11.656 14.595 25 HD2 HIS 3 2HD HIS 3 -20.361 -7.660 15.624 26 HE1 HIS 3 1HE HIS 3 -22.145 -11.349 16.724 27 HE2 HIS 3 2HE HIS 3 -21.768 -8.944 17.374 28 H HIS 4 H HIS 4 -15.905 -11.121 12.727 29 HA HIS 4 HA HIS 4 -15.167 -12.447 11.035 30 HB2 HIS 4 2HB HIS 4 -17.913 -13.470 11.532 31 HB3 HIS 4 1HB HIS 4 -17.133 -13.965 10.034 32 HD1 HIS 4 1HD HIS 4 -17.637 -15.235 13.227 33 HD2 HIS 4 2HD HIS 4 -14.248 -14.841 10.856 34 HE1 HIS 4 1HE HIS 4 -15.987 -16.901 14.133 35 HE2 HIS 4 2HE HIS 4 -13.972 -16.701 12.633 36 H HIS 5 H HIS 5 -14.682 -11.924 9.005 37 HA HIS 5 HA HIS 5 -16.142 -9.904 7.639 38 HB2 HIS 5 2HB HIS 5 -14.505 -10.491 5.743 39 HB3 HIS 5 1HB HIS 5 -13.828 -9.873 7.245 40 HD1 HIS 5 1HD HIS 5 -14.895 -13.439 7.111 41 HD2 HIS 5 2HD HIS 5 -11.406 -11.216 6.723 42 HE1 HIS 5 1HE HIS 5 -13.018 -15.110 7.215 43 HE2 HIS 5 2HE HIS 5 -10.923 -13.752 6.882 44 H HIS 6 H HIS 6 -18.155 -10.447 6.987 45 HA HIS 6 HA HIS 6 -18.410 -12.201 4.734 46 HB2 HIS 6 2HB HIS 6 -18.846 -13.311 7.305 47 HB3 HIS 6 1HB HIS 6 -20.427 -13.126 6.554 48 HD1 HIS 6 1HD HIS 6 -20.865 -14.493 4.372 49 HD2 HIS 6 2HD HIS 6 -17.222 -15.278 6.209 50 HE1 HIS 6 1HE HIS 6 -20.022 -16.613 3.314 51 HE2 HIS 6 2HE HIS 6 -17.861 -17.116 4.504 52 H HIS 7 H HIS 7 -21.022 -12.502 4.433 53 HA HIS 7 HA HIS 7 -22.943 -11.449 3.826 54 HB2 HIS 7 2HB HIS 7 -22.443 -10.677 6.488 55 HB3 HIS 7 1HB HIS 7 -22.923 -9.209 5.642 56 HD1 HIS 7 1HD HIS 7 -25.363 -8.972 5.006 57 HD2 HIS 7 2HD HIS 7 -24.431 -12.729 6.519 58 HE1 HIS 7 1HE HIS 7 -27.572 -10.119 5.363 59 HE2 HIS 7 2HE HIS 7 -26.986 -12.358 6.360 60 H MET 8 H MET 8 -23.819 -9.462 2.859 61 HA MET 8 HA MET 8 -23.669 -7.710 1.417 62 HB2 MET 8 2HB MET 8 -21.998 -7.046 3.655 63 HB3 MET 8 1HB MET 8 -21.265 -6.413 2.176 64 HG2 MET 8 2HG MET 8 -22.730 -4.761 2.090 65 HG3 MET 8 1HG MET 8 -24.085 -5.885 2.184 66 HE1 MET 8 3HE MET 8 -21.159 -4.713 4.312 67 HE2 MET 8 1HE MET 8 -21.885 -4.110 5.803 68 HE3 MET 8 2HE MET 8 -22.005 -3.164 4.319 69 H SER 9 H SER 9 -23.262 -8.786 -0.476 70 HA SER 9 HA SER 9 -20.445 -9.210 -1.206 71 HB2 SER 9 2HB SER 9 -22.912 -10.357 -2.532 72 HB3 SER 9 1HB SER 9 -21.237 -10.790 -2.872 73 HG SER 9 HG SER 9 -22.587 -12.145 -1.345 74 H ASP 10 H ASP 10 -19.906 -8.824 -3.522 75 HA ASP 10 HA ASP 10 -21.538 -6.824 -4.866 76 HB2 ASP 10 2HB ASP 10 -19.538 -5.317 -5.139 77 HB3 ASP 10 1HB ASP 10 -20.187 -5.391 -3.503 78 H GLY 11 H GLY 11 -18.434 -8.566 -4.894 79 HA2 GLY 11 2HA GLY 11 -18.124 -10.206 -6.701 80 HA3 GLY 11 1HA GLY 11 -18.856 -9.030 -7.783 81 H HIS 12 H HIS 12 -17.665 -6.920 -7.972 82 HA HIS 12 HA HIS 12 -14.907 -6.802 -7.288 83 HB2 HIS 12 2HB HIS 12 -14.015 -6.908 -9.614 84 HB3 HIS 12 1HB HIS 12 -14.649 -8.455 -9.035 85 HD1 HIS 12 1HD HIS 12 -14.922 -6.069 -11.775 86 HD2 HIS 12 2HD HIS 12 -17.293 -9.058 -10.131 87 HE1 HIS 12 1HE HIS 12 -16.657 -6.587 -13.521 88 HE2 HIS 12 2HE HIS 12 -18.046 -8.439 -12.526 89 H ASN 13 H ASN 13 -15.323 -4.737 -6.602 90 HA ASN 13 HA ASN 13 -16.084 -2.800 -8.689 91 HB2 ASN 13 2HB ASN 13 -17.225 -3.257 -6.119 92 HB3 ASN 13 1HB ASN 13 -16.436 -1.684 -6.081 93 HD21 ASN 13 1HD2 ASN 13 -17.225 -0.026 -7.324 94 HD22 ASN 13 2HD2 ASN 13 -18.742 -0.106 -8.146 95 H GLY 14 H GLY 14 -14.672 -1.222 -9.152 96 HA2 GLY 14 2HA GLY 14 -12.241 -1.075 -7.502 97 HA3 GLY 14 1HA GLY 14 -12.370 -0.562 -9.189 98 H LEU 15 H LEU 15 -11.224 1.036 -7.185 99 HA LEU 15 HA LEU 15 -12.427 3.486 -7.630 100 HB2 LEU 15 2HB LEU 15 -13.831 1.988 -5.694 101 HB3 LEU 15 1HB LEU 15 -12.975 3.244 -4.821 102 HG LEU 15 HG LEU 15 -14.108 4.549 -7.011 103 HD11 LEU 15 1HD1 LEU 15 -15.691 3.023 -7.635 104 HD12 LEU 15 2HD1 LEU 15 -16.583 3.898 -6.390 105 HD13 LEU 15 3HD1 LEU 15 -15.836 2.345 -6.012 106 HD21 LEU 15 3HD2 LEU 15 -15.765 5.194 -5.001 107 HD22 LEU 15 1HD2 LEU 15 -14.121 5.816 -5.140 108 HD23 LEU 15 2HD2 LEU 15 -14.458 4.444 -4.085 109 H GLY 16 H GLY 16 -10.166 3.900 -7.894 110 HA2 GLY 16 2HA GLY 16 -8.467 3.768 -5.538 111 HA3 GLY 16 1HA GLY 16 -7.971 4.298 -7.142 112 H LYS 17 H LYS 17 -9.483 6.307 -7.793 113 HA LYS 17 HA LYS 17 -10.365 8.203 -6.041 114 HB2 LYS 17 2HB LYS 17 -8.166 8.192 -4.965 115 HB3 LYS 17 1HB LYS 17 -7.390 8.522 -6.508 116 HG2 LYS 17 2HG LYS 17 -7.430 10.587 -5.459 117 HG3 LYS 17 1HG LYS 17 -8.822 10.652 -6.537 118 HD2 LYS 17 2HD LYS 17 -9.158 9.702 -3.722 119 HD3 LYS 17 1HD LYS 17 -9.062 11.432 -4.063 120 HE2 LYS 17 2HE LYS 17 -11.241 11.370 -4.507 121 HE3 LYS 17 1HE LYS 17 -10.849 10.434 -5.949 122 HZ1 LYS 17 3HZ LYS 17 -12.230 8.963 -4.981 123 HZ2 LYS 17 1HZ LYS 17 -11.979 9.558 -3.419 124 HZ3 LYS 17 2HZ LYS 17 -10.846 8.516 -4.120 125 H GLY 18 H GLY 18 -8.440 7.559 -8.884 126 HA2 GLY 18 2HA GLY 18 -9.900 8.420 -10.885 127 HA3 GLY 18 1HA GLY 18 -9.425 9.981 -10.205 128 H PHE 19 H PHE 19 -7.526 6.998 -10.490 129 HA PHE 19 HA PHE 19 -5.831 8.281 -12.501 130 HB2 PHE 19 2HB PHE 19 -3.797 7.519 -11.238 131 HB3 PHE 19 1HB PHE 19 -4.704 8.813 -10.445 132 HD1 PHE 19 2HD PHE 19 -6.282 8.167 -8.566 133 HD2 PHE 19 1HD PHE 19 -3.350 5.527 -10.156 134 HE1 PHE 19 2HE PHE 19 -6.410 6.804 -6.521 135 HE2 PHE 19 1HE PHE 19 -3.468 4.162 -8.114 136 HZ PHE 19 HZ PHE 19 -5.001 4.796 -6.292 137 H GLY 20 H GLY 20 -6.281 5.310 -10.580 138 HA2 GLY 20 2HA GLY 20 -5.541 3.768 -12.988 139 HA3 GLY 20 1HA GLY 20 -5.383 3.184 -11.330 140 H ASP 21 H ASP 21 -6.743 1.535 -11.069 141 HA ASP 21 HA ASP 21 -9.559 1.932 -11.181 142 HB2 ASP 21 2HB ASP 21 -10.004 0.103 -12.865 143 HB3 ASP 21 1HB ASP 21 -9.355 1.603 -13.542 144 H HIS 22 H HIS 22 -10.426 0.701 -9.627 145 HA HIS 22 HA HIS 22 -10.429 -0.709 -7.813 146 HB2 HIS 22 2HB HIS 22 -9.932 -3.179 -9.123 147 HB3 HIS 22 1HB HIS 22 -11.478 -2.476 -8.693 148 HD1 HIS 22 1HD HIS 22 -12.971 -1.800 -10.580 149 HD2 HIS 22 2HD HIS 22 -9.062 -2.473 -11.816 150 HE1 HIS 22 1HE HIS 22 -13.028 -1.672 -13.091 151 HE2 HIS 22 2HE HIS 22 -10.635 -1.989 -13.811 152 H ILE 23 H ILE 23 -8.246 -2.863 -9.506 153 HA ILE 23 HA ILE 23 -6.432 -3.970 -8.584 154 HB ILE 23 HB ILE 23 -5.513 -1.134 -9.033 155 HG12 ILE 23 2HG1 ILE 23 -5.144 -3.285 -11.042 156 HG13 ILE 23 1HG1 ILE 23 -6.778 -2.667 -10.831 157 HG21 ILE 23 1HG2 ILE 23 -3.592 -3.135 -9.736 158 HG22 ILE 23 2HG2 ILE 23 -4.051 -3.296 -8.041 159 HG23 ILE 23 3HG2 ILE 23 -3.440 -1.757 -8.647 160 HD11 ILE 23 3HD1 ILE 23 -5.886 -1.383 -12.551 161 HD12 ILE 23 1HD1 ILE 23 -4.325 -1.223 -11.747 162 HD13 ILE 23 2HD1 ILE 23 -5.729 -0.353 -11.129 163 H HIS 24 H HIS 24 -4.776 -1.331 -7.228 164 HA HIS 24 HA HIS 24 -4.850 -2.563 -4.628 165 HB2 HIS 24 2HB HIS 24 -3.372 -0.021 -5.013 166 HB3 HIS 24 1HB HIS 24 -2.900 -1.491 -4.162 167 HD1 HIS 24 1HD HIS 24 -2.683 -3.590 -6.190 168 HD2 HIS 24 2HD HIS 24 -1.673 0.346 -7.058 169 HE1 HIS 24 1HE HIS 24 -1.103 -3.712 -8.145 170 HE2 HIS 24 2HE HIS 24 -0.413 -1.330 -8.568 171 H TRP 25 H TRP 25 -7.310 -1.247 -5.469 172 HA TRP 25 HA TRP 25 -7.666 0.389 -3.116 173 HB2 TRP 25 2HB TRP 25 -8.939 2.025 -4.883 174 HB3 TRP 25 1HB TRP 25 -7.335 2.311 -4.214 175 HD1 TRP 25 HD TRP 25 -9.124 1.433 -7.408 176 HE1 TRP 25 1HE TRP 25 -7.444 1.386 -9.329 177 HE3 TRP 25 3HE TRP 25 -4.784 1.867 -4.752 178 HZ2 TRP 25 2HZ TRP 25 -4.655 1.566 -9.713 179 HZ3 TRP 25 3HZ TRP 25 -2.661 1.938 -5.964 180 HH2 TRP 25 HH TRP 25 -2.593 1.789 -8.398 181 H ARG 26 H ARG 26 -8.876 -1.844 -5.321 182 HA ARG 26 HA ARG 26 -11.504 -1.338 -5.676 183 HB2 ARG 26 2HB ARG 26 -10.838 -3.995 -4.446 184 HB3 ARG 26 1HB ARG 26 -12.001 -3.623 -5.714 185 HG2 ARG 26 2HG ARG 26 -9.857 -2.977 -7.057 186 HG3 ARG 26 1HG ARG 26 -9.063 -4.035 -5.900 187 HD2 ARG 26 2HD ARG 26 -11.490 -5.232 -6.892 188 HD3 ARG 26 1HD ARG 26 -10.418 -4.781 -8.226 189 HE ARG 26 HE ARG 26 -8.724 -6.039 -6.597 190 HH11 ARG 26 1HH1 ARG 26 -11.918 -6.932 -7.691 191 HH12 ARG 26 2HH1 ARG 26 -11.608 -8.634 -7.596 192 HH21 ARG 26 1HH2 ARG 26 -8.318 -8.275 -6.475 193 HH22 ARG 26 2HH2 ARG 26 -9.568 -9.395 -6.907 194 H THR 27 H THR 27 -10.006 -2.105 -2.548 195 HA THR 27 HA THR 27 -11.766 -0.704 -0.985 196 HB THR 27 HB THR 27 -12.885 -3.013 -0.040 197 HG1 THR 27 1HG THR 27 -13.416 -3.274 -2.757 198 HG21 THR 27 3HG2 THR 27 -14.789 -1.929 -0.354 199 HG22 THR 27 1HG2 THR 27 -14.568 -1.876 -2.102 200 HG23 THR 27 2HG2 THR 27 -13.823 -0.646 -1.081 201 H LEU 28 H LEU 28 -10.761 -0.467 0.897 202 HA LEU 28 HA LEU 28 -8.472 -1.987 1.570 203 HB2 LEU 28 2HB LEU 28 -8.797 0.374 2.212 204 HB3 LEU 28 1HB LEU 28 -10.090 -0.116 3.306 205 HG LEU 28 HG LEU 28 -7.322 -1.231 3.628 206 HD11 LEU 28 1HD1 LEU 28 -8.342 1.427 4.602 207 HD12 LEU 28 2HD1 LEU 28 -6.918 1.113 3.610 208 HD13 LEU 28 3HD1 LEU 28 -6.949 0.599 5.297 209 HD21 LEU 28 3HD2 LEU 28 -8.756 -2.376 5.017 210 HD22 LEU 28 1HD2 LEU 28 -9.793 -0.973 5.280 211 HD23 LEU 28 2HD2 LEU 28 -8.220 -1.068 6.073 212 H GLU 29 H GLU 29 -11.755 -1.893 2.923 213 HA GLU 29 HA GLU 29 -11.280 -3.847 4.921 214 HB2 GLU 29 2HB GLU 29 -13.173 -2.160 4.854 215 HB3 GLU 29 1HB GLU 29 -13.947 -3.199 3.665 216 HG2 GLU 29 2HG GLU 29 -13.269 -4.884 5.780 217 HG3 GLU 29 1HG GLU 29 -13.887 -3.415 6.532 218 H ASP 30 H ASP 30 -13.217 -4.113 1.930 219 HA ASP 30 HA ASP 30 -13.564 -6.867 1.990 220 HB2 ASP 30 2HB ASP 30 -13.691 -4.775 -0.119 221 HB3 ASP 30 1HB ASP 30 -13.585 -6.455 -0.663 222 H GLY 31 H GLY 31 -10.765 -5.016 1.142 223 HA2 GLY 31 2HA GLY 31 -9.463 -7.046 -0.400 224 HA3 GLY 31 1HA GLY 31 -8.707 -5.606 0.291 225 H LYS 32 H LYS 32 -9.361 -6.078 3.003 226 HA LYS 32 HA LYS 32 -7.205 -7.678 3.795 227 HB2 LYS 32 2HB LYS 32 -8.262 -5.873 5.161 228 HB3 LYS 32 1HB LYS 32 -9.619 -6.949 5.460 229 HG2 LYS 32 2HG LYS 32 -7.953 -8.572 6.446 230 HG3 LYS 32 1HG LYS 32 -6.776 -7.260 6.373 231 HD2 LYS 32 2HD LYS 32 -7.529 -6.765 8.432 232 HD3 LYS 32 1HD LYS 32 -8.880 -6.022 7.572 233 HE2 LYS 32 2HE LYS 32 -9.005 -8.931 8.198 234 HE3 LYS 32 1HE LYS 32 -9.276 -7.775 9.501 235 HZ1 LYS 32 3HZ LYS 32 -11.014 -6.745 8.129 236 HZ2 LYS 32 1HZ LYS 32 -11.358 -8.364 8.489 237 HZ3 LYS 32 2HZ LYS 32 -10.791 -7.940 6.953 238 H LYS 33 H LYS 33 -10.700 -8.365 3.981 239 HA LYS 33 HA LYS 33 -10.481 -10.962 4.983 240 HB2 LYS 33 2HB LYS 33 -12.772 -11.293 4.095 241 HB3 LYS 33 1HB LYS 33 -12.598 -9.800 5.006 242 HG2 LYS 33 2HG LYS 33 -13.842 -9.140 3.179 243 HG3 LYS 33 1HG LYS 33 -12.191 -8.712 2.697 244 HD2 LYS 33 2HD LYS 33 -12.260 -10.104 0.954 245 HD3 LYS 33 1HD LYS 33 -12.835 -11.436 1.958 246 HE2 LYS 33 2HE LYS 33 -15.117 -10.632 1.762 247 HE3 LYS 33 1HE LYS 33 -14.566 -9.240 0.830 248 HZ1 LYS 33 3HZ LYS 33 -13.899 -10.660 -0.943 249 HZ2 LYS 33 1HZ LYS 33 -15.484 -11.083 -0.528 250 HZ3 LYS 33 2HZ LYS 33 -14.190 -12.055 -0.032 251 H GLU 34 H GLU 34 -10.231 -9.732 1.716 252 HA GLU 34 HA GLU 34 -10.394 -12.272 0.427 253 HB2 GLU 34 2HB GLU 34 -10.905 -10.187 -0.759 254 HB3 GLU 34 1HB GLU 34 -9.235 -9.656 -0.556 255 HG2 GLU 34 2HG GLU 34 -8.461 -10.995 -2.202 256 HG3 GLU 34 1HG GLU 34 -9.644 -12.272 -1.870 257 H ALA 35 H ALA 35 -7.729 -10.176 1.447 258 HA ALA 35 HA ALA 35 -5.615 -11.645 0.365 259 HB1 ALA 35 1HB ALA 35 -5.774 -9.856 2.778 260 HB2 ALA 35 2HB ALA 35 -5.148 -9.477 1.173 261 HB3 ALA 35 3HB ALA 35 -4.264 -10.582 2.226 262 H ALA 36 H ALA 36 -7.633 -12.289 3.098 263 HA ALA 36 HA ALA 36 -5.913 -13.999 4.544 264 HB1 ALA 36 1HB ALA 36 -7.776 -13.197 5.714 265 HB2 ALA 36 2HB ALA 36 -8.122 -14.908 5.454 266 HB3 ALA 36 3HB ALA 36 -8.897 -13.688 4.444 267 H ALA 37 H ALA 37 -8.224 -14.577 1.932 268 HA ALA 37 HA ALA 37 -8.249 -17.363 1.966 269 HB1 ALA 37 1HB ALA 37 -9.816 -16.105 0.631 270 HB2 ALA 37 2HB ALA 37 -8.912 -17.205 -0.409 271 HB3 ALA 37 3HB ALA 37 -8.510 -15.487 -0.381 272 H SER 38 H SER 38 -6.514 -15.496 -0.518 273 HA SER 38 HA SER 38 -4.753 -17.635 -1.119 274 HB2 SER 38 2HB SER 38 -3.471 -15.736 -2.342 275 HB3 SER 38 1HB SER 38 -5.103 -16.146 -2.897 276 HG SER 38 HG SER 38 -5.237 -14.013 -2.678 277 H GLY 39 H GLY 39 -4.599 -14.919 1.065 278 HA2 GLY 39 2HA GLY 39 -3.191 -14.652 2.894 279 HA3 GLY 39 1HA GLY 39 -2.282 -16.070 2.363 280 H LEU 40 H LEU 40 -2.999 -13.160 0.483 281 HA LEU 40 HA LEU 40 -0.109 -12.761 0.170 282 HB2 LEU 40 2HB LEU 40 -0.868 -11.217 -1.714 283 HB3 LEU 40 1HB LEU 40 -1.075 -12.940 -1.948 284 HG LEU 40 HG LEU 40 -3.447 -12.762 -1.483 285 HD11 LEU 40 1HD1 LEU 40 -2.736 -9.950 -0.767 286 HD12 LEU 40 2HD1 LEU 40 -3.723 -11.115 0.114 287 HD13 LEU 40 3HD1 LEU 40 -4.357 -10.343 -1.339 288 HD21 LEU 40 3HD2 LEU 40 -2.120 -11.325 -3.630 289 HD22 LEU 40 1HD2 LEU 40 -3.747 -10.724 -3.313 290 HD23 LEU 40 2HD2 LEU 40 -3.493 -12.428 -3.685 291 HA PRO 41 HA PRO 41 -0.066 -8.997 2.463 292 HB2 PRO 41 2HB PRO 41 1.584 -7.414 1.007 293 HB3 PRO 41 1HB PRO 41 2.171 -8.795 1.943 294 HG2 PRO 41 2HG PRO 41 1.546 -8.622 -0.985 295 HG3 PRO 41 1HG PRO 41 2.960 -9.338 -0.190 296 HD2 PRO 41 2HD PRO 41 0.917 -10.851 -1.061 297 HD3 PRO 41 1HD PRO 41 1.802 -11.251 0.424 298 H LEU 42 H LEU 42 -0.693 -6.718 2.445 299 HA LEU 42 HA LEU 42 -2.703 -6.257 0.404 300 HB2 LEU 42 2HB LEU 42 -2.195 -4.596 2.844 301 HB3 LEU 42 1HB LEU 42 -3.630 -4.655 1.868 302 HG LEU 42 HG LEU 42 -2.686 -6.591 3.937 303 HD11 LEU 42 1HD1 LEU 42 -5.015 -4.842 3.425 304 HD12 LEU 42 2HD1 LEU 42 -4.167 -5.192 4.933 305 HD13 LEU 42 3HD1 LEU 42 -5.310 -6.363 4.270 306 HD21 LEU 42 3HD2 LEU 42 -3.847 -8.368 3.124 307 HD22 LEU 42 1HD2 LEU 42 -3.410 -7.636 1.583 308 HD23 LEU 42 2HD2 LEU 42 -5.009 -7.360 2.268 309 H MET 43 H MET 43 -2.723 -4.549 -0.932 310 HA MET 43 HA MET 43 -0.168 -3.181 -1.271 311 HB2 MET 43 2HB MET 43 -1.289 -4.377 -3.189 312 HB3 MET 43 1HB MET 43 -2.559 -3.146 -3.130 313 HG2 MET 43 2HG MET 43 -0.853 -2.725 -4.859 314 HG3 MET 43 1HG MET 43 -0.972 -1.424 -3.678 315 HE1 MET 43 3HE MET 43 1.151 -0.302 -2.853 316 HE2 MET 43 1HE MET 43 2.357 -1.259 -1.991 317 HE3 MET 43 2HE MET 43 0.658 -1.354 -1.525 318 H VAL 44 H VAL 44 -0.437 -1.774 0.526 319 HA VAL 44 HA VAL 44 -2.641 0.077 0.511 320 HB VAL 44 HB VAL 44 -0.222 -0.150 2.293 321 HG11 VAL 44 1HG1 VAL 44 -1.301 1.570 3.711 322 HG12 VAL 44 2HG1 VAL 44 -2.475 1.851 2.426 323 HG13 VAL 44 3HG1 VAL 44 -0.768 2.200 2.152 324 HG21 VAL 44 3HG2 VAL 44 -1.491 -1.397 3.627 325 HG22 VAL 44 1HG2 VAL 44 -2.587 -1.558 2.257 326 HG23 VAL 44 2HG2 VAL 44 -2.870 -0.316 3.478 327 H ILE 45 H ILE 45 -2.562 2.238 0.167 328 HA ILE 45 HA ILE 45 -0.242 3.707 -0.451 329 HB ILE 45 HB ILE 45 -0.049 2.680 -2.537 330 HG12 ILE 45 2HG1 ILE 45 -1.845 5.064 -3.052 331 HG13 ILE 45 1HG1 ILE 45 -0.109 5.145 -2.721 332 HG21 ILE 45 1HG2 ILE 45 -1.672 1.396 -3.311 333 HG22 ILE 45 2HG2 ILE 45 -2.544 2.841 -3.827 334 HG23 ILE 45 3HG2 ILE 45 -2.837 2.156 -2.227 335 HD11 ILE 45 3HD1 ILE 45 0.051 3.557 -4.788 336 HD12 ILE 45 1HD1 ILE 45 -0.152 5.296 -5.005 337 HD13 ILE 45 2HD1 ILE 45 -1.540 4.218 -5.163 338 H ILE 46 H ILE 46 -0.704 5.747 -0.021 339 HA ILE 46 HA ILE 46 -3.529 6.569 -0.113 340 HB ILE 46 HB ILE 46 -1.466 7.657 1.782 341 HG12 ILE 46 2HG1 ILE 46 -3.522 5.884 2.892 342 HG13 ILE 46 1HG1 ILE 46 -2.363 5.062 1.855 343 HG21 ILE 46 1HG2 ILE 46 -4.478 7.748 1.810 344 HG22 ILE 46 2HG2 ILE 46 -3.408 9.076 1.363 345 HG23 ILE 46 3HG2 ILE 46 -3.409 8.464 3.017 346 HD11 ILE 46 3HD1 ILE 46 -0.539 5.906 3.216 347 HD12 ILE 46 1HD1 ILE 46 -1.697 5.002 4.192 348 HD13 ILE 46 2HD1 ILE 46 -1.691 6.766 4.239 349 H HIS 47 H HIS 47 -4.035 8.480 -1.044 350 HA HIS 47 HA HIS 47 -1.786 10.009 -2.204 351 HB2 HIS 47 2HB HIS 47 -4.572 9.918 -3.349 352 HB3 HIS 47 1HB HIS 47 -3.082 10.450 -4.135 353 HD1 HIS 47 1HD HIS 47 -2.691 8.842 -5.971 354 HD2 HIS 47 2HD HIS 47 -3.854 6.922 -2.471 355 HE1 HIS 47 1HE HIS 47 -2.567 6.385 -6.481 356 HE2 HIS 47 2HE HIS 47 -3.355 5.246 -4.377 357 H LYS 48 H LYS 48 -1.587 11.567 -0.581 358 HA LYS 48 HA LYS 48 -3.981 13.275 -0.234 359 HB2 LYS 48 2HB LYS 48 -2.187 12.112 1.701 360 HB3 LYS 48 1HB LYS 48 -2.222 13.861 1.861 361 HG2 LYS 48 2HG LYS 48 -3.888 13.067 3.303 362 HG3 LYS 48 1HG LYS 48 -4.746 13.669 1.883 363 HD2 LYS 48 2HD LYS 48 -5.670 11.675 1.552 364 HD3 LYS 48 1HD LYS 48 -4.079 10.916 1.484 365 HE2 LYS 48 2HE LYS 48 -5.688 10.054 3.252 366 HE3 LYS 48 1HE LYS 48 -4.067 10.486 3.795 367 HZ1 LYS 48 3HZ LYS 48 -4.836 12.202 5.009 368 HZ2 LYS 48 1HZ LYS 48 -6.279 11.322 4.995 369 HZ3 LYS 48 2HZ LYS 48 -6.058 12.600 3.910 370 H SER 49 H SER 49 -3.661 15.539 0.023 371 HA SER 49 HA SER 49 -2.908 17.544 -0.745 372 HB2 SER 49 2HB SER 49 -0.686 18.147 -0.089 373 HB3 SER 49 1HB SER 49 -1.300 17.030 1.128 374 HG SER 49 HG SER 49 0.376 15.858 0.699 375 H TRP 50 H TRP 50 -0.835 18.496 -2.101 376 HA TRP 50 HA TRP 50 -1.278 17.549 -4.740 377 HB2 TRP 50 2HB TRP 50 0.501 19.202 -5.369 378 HB3 TRP 50 1HB TRP 50 -0.821 19.888 -4.420 379 HD1 TRP 50 HD TRP 50 -0.247 20.417 -1.782 380 HE1 TRP 50 1HE TRP 50 1.978 21.108 -0.690 381 HE3 TRP 50 3HE TRP 50 2.967 18.949 -5.480 382 HZ2 TRP 50 2HZ TRP 50 4.729 21.044 -1.312 383 HZ3 TRP 50 3HZ TRP 50 5.379 19.302 -5.152 384 HH2 TRP 50 HH TRP 50 6.241 20.329 -3.111 385 H CYS 51 H CYS 51 -0.639 15.286 -4.023 386 HA CYS 51 HA CYS 51 2.177 14.735 -3.825 387 HB2 CYS 51 2HB CYS 51 1.408 12.337 -3.930 388 HB3 CYS 51 1HB CYS 51 0.703 13.281 -2.622 389 H GLY 52 H GLY 52 3.369 15.078 -5.654 390 HA2 GLY 52 2HA GLY 52 2.426 14.924 -8.290 391 HA3 GLY 52 1HA GLY 52 4.124 14.795 -7.822 392 H ALA 53 H ALA 53 3.598 12.440 -6.135 393 HA ALA 53 HA ALA 53 4.118 10.418 -8.009 394 HB1 ALA 53 1HB ALA 53 4.899 9.940 -5.881 395 HB2 ALA 53 2HB ALA 53 3.481 8.901 -6.002 396 HB3 ALA 53 3HB ALA 53 3.388 10.419 -5.111 397 H CYS 54 H CYS 54 1.202 11.889 -7.109 398 HA CYS 54 HA CYS 54 -0.357 9.611 -8.053 399 HB2 CYS 54 2HB CYS 54 -1.567 12.121 -6.929 400 HB3 CYS 54 1HB CYS 54 -2.203 10.471 -6.906 401 H LYS 55 H LYS 55 0.528 12.899 -8.782 402 HA LYS 55 HA LYS 55 -1.414 13.451 -10.746 403 HB2 LYS 55 2HB LYS 55 1.105 14.634 -9.830 404 HB3 LYS 55 1HB LYS 55 0.798 14.885 -11.543 405 HG2 LYS 55 2HG LYS 55 -1.446 15.783 -10.945 406 HG3 LYS 55 1HG LYS 55 -0.972 15.677 -9.240 407 HD2 LYS 55 2HD LYS 55 0.397 17.470 -9.380 408 HD3 LYS 55 1HD LYS 55 0.934 17.063 -11.011 409 HE2 LYS 55 2HE LYS 55 -1.311 17.826 -11.834 410 HE3 LYS 55 1HE LYS 55 -1.629 18.425 -10.206 411 HZ1 LYS 55 3HZ LYS 55 -0.769 20.292 -11.126 412 HZ2 LYS 55 1HZ LYS 55 0.186 19.458 -12.247 413 HZ3 LYS 55 2HZ LYS 55 0.687 19.587 -10.635 414 H ALA 56 H ALA 56 2.016 12.521 -11.184 415 HA ALA 56 HA ALA 56 1.708 11.986 -13.967 416 HB1 ALA 56 1HB ALA 56 3.843 12.392 -12.380 417 HB2 ALA 56 2HB ALA 56 3.938 11.639 -13.973 418 HB3 ALA 56 3HB ALA 56 3.895 10.634 -12.525 419 H LEU 57 H LEU 57 0.835 10.240 -11.200 420 HA LEU 57 HA LEU 57 1.136 7.606 -12.295 421 HB2 LEU 57 2HB LEU 57 1.284 7.918 -9.922 422 HB3 LEU 57 1HB LEU 57 -0.290 8.683 -9.869 423 HG LEU 57 HG LEU 57 -0.992 6.275 -10.858 424 HD11 LEU 57 1HD1 LEU 57 1.135 5.247 -10.842 425 HD12 LEU 57 2HD1 LEU 57 0.277 4.606 -9.442 426 HD13 LEU 57 3HD1 LEU 57 1.500 5.858 -9.229 427 HD21 LEU 57 3HD2 LEU 57 -1.656 5.697 -8.582 428 HD22 LEU 57 1HD2 LEU 57 -1.978 7.396 -8.929 429 HD23 LEU 57 2HD2 LEU 57 -0.585 6.945 -7.947 430 H LYS 58 H LYS 58 -1.338 10.043 -12.382 431 HA LYS 58 HA LYS 58 -3.586 8.427 -12.776 432 HB2 LYS 58 2HB LYS 58 -2.898 11.252 -13.394 433 HB3 LYS 58 1HB LYS 58 -4.340 10.572 -14.137 434 HG2 LYS 58 2HG LYS 58 -5.228 10.025 -11.941 435 HG3 LYS 58 1HG LYS 58 -3.765 10.652 -11.182 436 HD2 LYS 58 2HD LYS 58 -5.728 12.236 -12.840 437 HD3 LYS 58 1HD LYS 58 -5.573 12.288 -11.082 438 HE2 LYS 58 2HE LYS 58 -4.190 14.011 -11.436 439 HE3 LYS 58 1HE LYS 58 -3.011 12.786 -11.906 440 HZ1 LYS 58 3HZ LYS 58 -3.543 14.761 -13.481 441 HZ2 LYS 58 1HZ LYS 58 -4.879 13.820 -13.922 442 HZ3 LYS 58 2HZ LYS 58 -3.313 13.214 -14.121 443 HA PRO 59 HA PRO 59 -3.111 8.664 -17.528 444 HB2 PRO 59 2HB PRO 59 -1.075 10.037 -18.632 445 HB3 PRO 59 1HB PRO 59 -2.571 10.836 -18.106 446 HG2 PRO 59 2HG PRO 59 0.069 10.639 -16.697 447 HG3 PRO 59 1HG PRO 59 -0.987 12.048 -16.902 448 HD2 PRO 59 2HD PRO 59 -0.930 10.552 -14.620 449 HD3 PRO 59 1HD PRO 59 -2.384 11.412 -15.192 450 H LYS 60 H LYS 60 -0.348 8.253 -15.527 451 HA LYS 60 HA LYS 60 1.066 6.575 -17.425 452 HB2 LYS 60 2HB LYS 60 2.595 7.750 -16.137 453 HB3 LYS 60 1HB LYS 60 1.604 7.639 -14.692 454 HG2 LYS 60 2HG LYS 60 3.523 6.288 -14.362 455 HG3 LYS 60 1HG LYS 60 2.135 5.213 -14.568 456 HD2 LYS 60 2HD LYS 60 4.028 4.374 -15.829 457 HD3 LYS 60 1HD LYS 60 2.780 4.934 -16.945 458 HE2 LYS 60 2HE LYS 60 4.379 7.172 -16.469 459 HE3 LYS 60 1HE LYS 60 5.511 5.827 -16.633 460 HZ1 LYS 60 3HZ LYS 60 5.018 5.558 -18.798 461 HZ2 LYS 60 1HZ LYS 60 4.534 7.176 -18.699 462 HZ3 LYS 60 2HZ LYS 60 3.383 5.941 -18.605 463 H PHE 61 H PHE 61 -0.074 6.180 -14.084 464 HA PHE 61 HA PHE 61 0.139 3.437 -13.971 465 HB2 PHE 61 2HB PHE 61 -0.339 5.091 -12.094 466 HB3 PHE 61 1HB PHE 61 -2.034 4.949 -12.563 467 HD1 PHE 61 1HD PHE 61 -3.234 2.835 -12.242 468 HD2 PHE 61 2HD PHE 61 0.822 3.287 -11.036 469 HE1 PHE 61 1HE PHE 61 -3.399 0.769 -10.916 470 HE2 PHE 61 2HE PHE 61 0.662 1.227 -9.704 471 HZ PHE 61 HZ PHE 61 -1.449 -0.035 -9.644 472 H ALA 62 H ALA 62 -2.101 5.352 -15.735 473 HA ALA 62 HA ALA 62 -4.294 3.650 -15.910 474 HB1 ALA 62 1HB ALA 62 -3.546 5.991 -17.111 475 HB2 ALA 62 2HB ALA 62 -4.979 5.051 -17.532 476 HB3 ALA 62 3HB ALA 62 -3.491 4.853 -18.459 477 H GLU 63 H GLU 63 -1.059 3.297 -16.949 478 HA GLU 63 HA GLU 63 -1.415 1.281 -18.956 479 HB2 GLU 63 2HB GLU 63 0.586 2.962 -18.484 480 HB3 GLU 63 1HB GLU 63 1.142 1.650 -17.438 481 HG2 GLU 63 2HG GLU 63 2.215 1.284 -19.476 482 HG3 GLU 63 1HG GLU 63 0.874 0.140 -19.473 483 H SER 64 H SER 64 -1.526 1.350 -15.597 484 HA SER 64 HA SER 64 -0.434 -1.080 -14.833 485 HB2 SER 64 2HB SER 64 -2.696 0.550 -13.726 486 HB3 SER 64 1HB SER 64 -2.102 -0.892 -12.926 487 HG SER 64 HG SER 64 -0.583 1.419 -13.559 488 H THR 65 H THR 65 -2.699 -0.823 -17.158 489 HA THR 65 HA THR 65 -4.791 -2.494 -16.566 490 HB THR 65 HB THR 65 -3.430 -2.948 -19.175 491 HG1 THR 65 1HG THR 65 -4.064 -0.871 -19.883 492 HG21 THR 65 3HG2 THR 65 -5.557 -2.837 -20.096 493 HG22 THR 65 1HG2 THR 65 -6.213 -1.962 -18.714 494 HG23 THR 65 2HG2 THR 65 -5.794 -3.668 -18.559 495 H GLU 66 H GLU 66 -1.458 -3.272 -17.333 496 HA GLU 66 HA GLU 66 -1.905 -6.126 -17.156 497 HB2 GLU 66 2HB GLU 66 0.499 -6.346 -17.469 498 HB3 GLU 66 1HB GLU 66 -0.153 -5.213 -18.659 499 HG2 GLU 66 2HG GLU 66 0.696 -3.906 -16.221 500 HG3 GLU 66 1HG GLU 66 2.004 -4.796 -16.997 501 H ILE 67 H ILE 67 -0.916 -3.470 -15.122 502 HA ILE 67 HA ILE 67 0.114 -5.086 -13.017 503 HB ILE 67 HB ILE 67 -1.121 -2.336 -12.841 504 HG12 ILE 67 2HG1 ILE 67 1.796 -3.117 -13.032 505 HG13 ILE 67 1HG1 ILE 67 0.832 -2.515 -14.388 506 HG21 ILE 67 1HG2 ILE 67 0.141 -4.116 -10.866 507 HG22 ILE 67 2HG2 ILE 67 -1.041 -2.828 -10.641 508 HG23 ILE 67 3HG2 ILE 67 0.667 -2.433 -10.831 509 HD11 ILE 67 3HD1 ILE 67 2.343 -1.011 -12.638 510 HD12 ILE 67 1HD1 ILE 67 0.687 -0.765 -12.084 511 HD13 ILE 67 2HD1 ILE 67 1.121 -0.408 -13.757 512 H SER 68 H SER 68 -3.019 -4.475 -14.236 513 HA SER 68 HA SER 68 -4.559 -4.847 -11.895 514 HB2 SER 68 2HB SER 68 -5.156 -4.245 -14.491 515 HB3 SER 68 1HB SER 68 -5.664 -5.932 -14.417 516 HG SER 68 HG SER 68 -6.766 -3.706 -13.242 517 H GLU 69 H GLU 69 -3.034 -6.985 -14.201 518 HA GLU 69 HA GLU 69 -4.142 -9.388 -13.097 519 HB2 GLU 69 2HB GLU 69 -1.659 -9.177 -14.798 520 HB3 GLU 69 1HB GLU 69 -2.736 -10.557 -14.629 521 HG2 GLU 69 2HG GLU 69 -3.325 -7.954 -16.016 522 HG3 GLU 69 1HG GLU 69 -3.099 -9.537 -16.761 523 H LEU 70 H LEU 70 -1.201 -7.502 -12.817 524 HA LEU 70 HA LEU 70 0.217 -9.312 -11.145 525 HB2 LEU 70 2HB LEU 70 0.458 -6.383 -11.742 526 HB3 LEU 70 1HB LEU 70 1.414 -7.101 -10.446 527 HG LEU 70 HG LEU 70 2.380 -8.689 -12.099 528 HD11 LEU 70 1HD1 LEU 70 1.062 -6.956 -14.178 529 HD12 LEU 70 2HD1 LEU 70 0.458 -8.540 -13.681 530 HD13 LEU 70 3HD1 LEU 70 2.045 -8.400 -14.435 531 HD21 LEU 70 3HD2 LEU 70 3.669 -6.764 -11.548 532 HD22 LEU 70 1HD2 LEU 70 2.696 -5.736 -12.599 533 HD23 LEU 70 2HD2 LEU 70 3.752 -6.964 -13.298 534 H SER 71 H SER 71 -2.481 -7.333 -10.580 535 HA SER 71 HA SER 71 -2.117 -6.565 -7.912 536 HB2 SER 71 2HB SER 71 -4.106 -6.268 -9.787 537 HB3 SER 71 1HB SER 71 -4.840 -7.344 -8.597 538 HG SER 71 HG SER 71 -5.173 -5.584 -7.506 539 H HIS 72 H HIS 72 -2.811 -9.650 -9.310 540 HA HIS 72 HA HIS 72 -4.125 -10.913 -7.188 541 HB2 HIS 72 2HB HIS 72 -2.327 -11.923 -9.385 542 HB3 HIS 72 1HB HIS 72 -2.971 -13.021 -8.155 543 HD1 HIS 72 1HD HIS 72 -3.657 -12.197 -11.437 544 HD2 HIS 72 2HD HIS 72 -6.041 -12.326 -8.036 545 HE1 HIS 72 1HE HIS 72 -6.017 -12.418 -12.278 546 HE2 HIS 72 2HE HIS 72 -7.448 -12.392 -10.204 547 H ASN 73 H ASN 73 -0.992 -9.691 -7.423 548 HA ASN 73 HA ASN 73 0.324 -11.487 -5.642 549 HB2 ASN 73 2HB ASN 73 0.967 -8.765 -6.757 550 HB3 ASN 73 1HB ASN 73 2.031 -9.589 -5.614 551 HD21 ASN 73 1HD2 ASN 73 0.635 -9.668 -8.808 552 HD22 ASN 73 2HD2 ASN 73 1.733 -10.839 -9.472 553 H PHE 74 H PHE 74 -1.458 -8.489 -5.252 554 HA PHE 74 HA PHE 74 -1.443 -8.866 -2.366 555 HB2 PHE 74 2HB PHE 74 -1.303 -6.162 -2.447 556 HB3 PHE 74 1HB PHE 74 0.090 -7.220 -2.217 557 HD1 PHE 74 2HD PHE 74 -1.851 -6.277 -5.249 558 HD2 PHE 74 1HD PHE 74 1.906 -6.313 -3.256 559 HE1 PHE 74 2HE PHE 74 -0.781 -5.346 -7.258 560 HE2 PHE 74 1HE PHE 74 2.984 -5.380 -5.263 561 HZ PHE 74 HZ PHE 74 1.636 -4.897 -7.267 562 H VAL 75 H VAL 75 -2.956 -6.540 -1.701 563 HA VAL 75 HA VAL 75 -5.288 -6.806 -3.469 564 HB VAL 75 HB VAL 75 -5.440 -8.402 -1.528 565 HG11 VAL 75 1HG1 VAL 75 -6.080 -7.559 0.626 566 HG12 VAL 75 2HG1 VAL 75 -6.037 -5.897 0.038 567 HG13 VAL 75 3HG1 VAL 75 -4.544 -6.826 0.168 568 HG21 VAL 75 3HG2 VAL 75 -7.793 -8.087 -1.296 569 HG22 VAL 75 1HG2 VAL 75 -7.347 -7.587 -2.927 570 HG23 VAL 75 2HG2 VAL 75 -7.661 -6.373 -1.688 571 H MET 76 H MET 76 -6.604 -5.189 -3.717 572 HA MET 76 HA MET 76 -6.118 -2.625 -3.705 573 HB2 MET 76 2HB MET 76 -8.593 -2.332 -3.476 574 HB3 MET 76 1HB MET 76 -8.067 -3.484 -4.685 575 HG2 MET 76 2HG MET 76 -8.535 -4.611 -2.023 576 HG3 MET 76 1HG MET 76 -9.968 -3.964 -2.812 577 HE1 MET 76 3HE MET 76 -11.316 -6.656 -3.586 578 HE2 MET 76 1HE MET 76 -10.470 -6.332 -2.073 579 HE3 MET 76 2HE MET 76 -10.103 -7.790 -2.994 580 H VAL 77 H VAL 77 -5.149 -1.501 -1.985 581 HA VAL 77 HA VAL 77 -6.995 -0.842 0.169 582 HB VAL 77 HB VAL 77 -4.153 -1.691 0.738 583 HG11 VAL 77 1HG1 VAL 77 -5.198 -1.420 3.162 584 HG12 VAL 77 2HG1 VAL 77 -6.191 -0.223 2.332 585 HG13 VAL 77 3HG1 VAL 77 -4.435 -0.066 2.329 586 HG21 VAL 77 3HG2 VAL 77 -5.605 -3.242 2.302 587 HG22 VAL 77 1HG2 VAL 77 -5.252 -3.681 0.630 588 HG23 VAL 77 2HG2 VAL 77 -6.809 -2.963 1.044 589 H ASN 78 H ASN 78 -6.797 0.920 -1.684 590 HA ASN 78 HA ASN 78 -4.695 2.811 -0.897 591 HB2 ASN 78 2HB ASN 78 -4.395 2.895 -3.128 592 HB3 ASN 78 1HB ASN 78 -5.956 2.171 -3.453 593 HD21 ASN 78 1HD2 ASN 78 -4.899 5.198 -1.947 594 HD22 ASN 78 2HD2 ASN 78 -5.853 6.237 -2.956 595 H LEU 79 H LEU 79 -5.408 4.044 0.685 596 HA LEU 79 HA LEU 79 -8.180 5.013 0.588 597 HB2 LEU 79 2HB LEU 79 -7.876 5.642 2.935 598 HB3 LEU 79 1HB LEU 79 -7.579 3.938 2.658 599 HG LEU 79 HG LEU 79 -5.063 4.994 2.430 600 HD11 LEU 79 1HD1 LEU 79 -5.846 7.196 3.152 601 HD12 LEU 79 2HD1 LEU 79 -4.746 6.483 4.332 602 HD13 LEU 79 3HD1 LEU 79 -6.484 6.483 4.635 603 HD21 LEU 79 3HD2 LEU 79 -5.682 2.975 3.642 604 HD22 LEU 79 1HD2 LEU 79 -6.420 3.952 4.913 605 HD23 LEU 79 2HD2 LEU 79 -4.678 4.023 4.643 606 H GLU 80 H GLU 80 -8.528 7.267 1.430 607 HA GLU 80 HA GLU 80 -6.389 9.136 0.758 608 HB2 GLU 80 2HB GLU 80 -8.108 8.519 -1.204 609 HB3 GLU 80 1HB GLU 80 -9.060 9.767 -0.391 610 HG2 GLU 80 2HG GLU 80 -7.835 11.383 -1.276 611 HG3 GLU 80 1HG GLU 80 -6.331 10.622 -0.732 612 H ASP 81 H ASP 81 -7.747 11.490 0.866 613 HA ASP 81 HA ASP 81 -7.959 12.093 3.524 614 HB2 ASP 81 2HB ASP 81 -9.505 13.393 1.269 615 HB3 ASP 81 1HB ASP 81 -9.206 14.107 2.851 616 H GLU 82 H GLU 82 -10.419 10.732 1.437 617 HA GLU 82 HA GLU 82 -12.692 11.167 2.987 618 HB2 GLU 82 2HB GLU 82 -11.886 9.206 0.915 619 HB3 GLU 82 1HB GLU 82 -13.252 8.753 1.926 620 HG2 GLU 82 2HG GLU 82 -14.331 9.808 0.222 621 HG3 GLU 82 1HG GLU 82 -14.093 11.161 1.327 622 H GLU 83 H GLU 83 -10.096 8.868 3.346 623 HA GLU 83 HA GLU 83 -11.396 7.823 5.776 624 HB2 GLU 83 2HB GLU 83 -9.856 6.471 3.622 625 HB3 GLU 83 1HB GLU 83 -9.600 5.904 5.265 626 HG2 GLU 83 2HG GLU 83 -12.311 6.013 5.158 627 HG3 GLU 83 1HG GLU 83 -11.906 5.581 3.493 628 H GLU 84 H GLU 84 -10.513 8.938 7.411 629 HA GLU 84 HA GLU 84 -7.615 9.415 7.388 630 HB2 GLU 84 2HB GLU 84 -9.630 11.165 7.889 631 HB3 GLU 84 1HB GLU 84 -9.258 10.627 9.523 632 HG2 GLU 84 2HG GLU 84 -7.340 11.762 9.585 633 HG3 GLU 84 1HG GLU 84 -6.894 11.287 7.948 634 HA PRO 85 HA PRO 85 -7.881 5.945 10.377 635 HB2 PRO 85 2HB PRO 85 -5.343 5.078 9.964 636 HB3 PRO 85 1HB PRO 85 -6.699 4.622 8.913 637 HG2 PRO 85 2HG PRO 85 -4.610 6.739 8.513 638 HG3 PRO 85 1HG PRO 85 -5.252 5.558 7.345 639 HD2 PRO 85 2HD PRO 85 -6.081 8.138 7.416 640 HD3 PRO 85 1HD PRO 85 -7.157 6.799 6.950 641 H LYS 86 H LYS 86 -5.521 8.502 9.969 642 HA LYS 86 HA LYS 86 -4.309 9.727 11.448 643 HB2 LYS 86 2HB LYS 86 -6.735 9.326 12.660 644 HB3 LYS 86 1HB LYS 86 -5.615 8.717 13.884 645 HG2 LYS 86 2HG LYS 86 -5.383 10.820 14.549 646 HG3 LYS 86 1HG LYS 86 -4.478 11.104 13.062 647 HD2 LYS 86 2HD LYS 86 -6.689 11.589 11.948 648 HD3 LYS 86 1HD LYS 86 -7.413 11.565 13.557 649 HE2 LYS 86 2HE LYS 86 -5.808 13.340 14.239 650 HE3 LYS 86 1HE LYS 86 -5.247 13.416 12.569 651 HZ1 LYS 86 3HZ LYS 86 -7.379 14.778 13.691 652 HZ2 LYS 86 1HZ LYS 86 -8.066 13.627 12.657 653 HZ3 LYS 86 2HZ LYS 86 -6.935 14.734 12.060 654 H ASP 87 H ASP 87 -2.618 8.123 10.822 655 HA ASP 87 HA ASP 87 -1.326 7.139 13.190 656 HB2 ASP 87 2HB ASP 87 -3.020 5.333 12.108 657 HB3 ASP 87 1HB ASP 87 -1.563 4.992 11.160 658 H GLU 88 H GLU 88 0.874 6.501 12.817 659 HA GLU 88 HA GLU 88 2.231 8.082 10.963 660 HB2 GLU 88 2HB GLU 88 3.066 5.697 12.594 661 HB3 GLU 88 1HB GLU 88 4.189 6.509 11.515 662 HG2 GLU 88 2HG GLU 88 2.700 7.855 13.755 663 HG3 GLU 88 1HG GLU 88 4.351 7.247 13.867 664 H ASP 89 H ASP 89 0.655 5.091 10.500 665 HA ASP 89 HA ASP 89 2.077 3.709 8.644 666 HB2 ASP 89 2HB ASP 89 -0.361 3.403 9.610 667 HB3 ASP 89 1HB ASP 89 -0.830 4.179 8.092 668 H PHE 90 H PHE 90 -0.187 6.367 7.811 669 HA PHE 90 HA PHE 90 0.301 6.390 5.083 670 HB2 PHE 90 2HB PHE 90 -0.533 8.718 5.093 671 HB3 PHE 90 1HB PHE 90 -1.551 7.619 6.031 672 HD1 PHE 90 2HD PHE 90 1.355 9.914 6.544 673 HD2 PHE 90 1HD PHE 90 -2.301 8.356 8.059 674 HE1 PHE 90 2HE PHE 90 1.517 11.430 8.473 675 HE2 PHE 90 1HE PHE 90 -2.152 9.874 9.988 676 HZ PHE 90 HZ PHE 90 -0.240 11.413 10.198 677 H SER 91 H SER 91 2.265 7.701 7.646 678 HA SER 91 HA SER 91 4.457 8.086 5.841 679 HB2 SER 91 2HB SER 91 3.282 10.540 7.181 680 HB3 SER 91 1HB SER 91 4.788 10.490 6.255 681 HG SER 91 HG SER 91 3.382 9.676 4.488 682 HA PRO 92 HA PRO 92 5.711 7.290 10.186 683 HB2 PRO 92 2HB PRO 92 6.770 4.869 9.891 684 HB3 PRO 92 1HB PRO 92 5.009 5.092 9.926 685 HG2 PRO 92 2HG PRO 92 6.817 4.610 7.598 686 HG3 PRO 92 1HG PRO 92 5.175 4.011 7.890 687 HD2 PRO 92 2HD PRO 92 5.879 6.217 6.300 688 HD3 PRO 92 1HD PRO 92 4.250 5.821 6.880 689 H ASP 93 H ASP 93 7.483 7.139 7.167 690 HA ASP 93 HA ASP 93 10.037 7.289 8.579 691 HB2 ASP 93 2HB ASP 93 11.092 6.910 6.437 692 HB3 ASP 93 1HB ASP 93 9.797 5.727 6.658 693 H GLY 94 H GLY 94 8.240 9.131 6.104 694 HA2 GLY 94 2HA GLY 94 9.942 11.449 6.792 695 HA3 GLY 94 1HA GLY 94 9.238 11.180 5.194 696 H GLY 95 H GLY 95 8.781 13.572 6.079 697 HA2 GLY 95 2HA GLY 95 6.346 13.676 7.668 698 HA3 GLY 95 1HA GLY 95 7.259 15.056 7.055 699 H TYR 96 H TYR 96 7.022 13.189 4.419 700 HA TYR 96 HA TYR 96 5.294 14.783 3.008 701 HB2 TYR 96 2HB TYR 96 5.080 12.926 1.389 702 HB3 TYR 96 1HB TYR 96 6.750 13.205 1.894 703 HD1 TYR 96 1HD TYR 96 5.623 11.650 4.678 704 HD2 TYR 96 2HD TYR 96 6.226 10.770 0.558 705 HE1 TYR 96 1HE TYR 96 5.861 9.271 5.224 706 HE2 TYR 96 2HE TYR 96 6.448 8.389 1.093 707 HH TYR 96 HH TYR 96 5.446 7.000 3.772 708 H ILE 97 H ILE 97 3.145 14.041 1.982 709 HA ILE 97 HA ILE 97 1.467 12.550 3.830 710 HB ILE 97 HB ILE 97 -0.207 14.553 3.684 711 HG12 ILE 97 2HG1 ILE 97 2.170 16.283 3.799 712 HG13 ILE 97 1HG1 ILE 97 1.807 15.627 2.200 713 HG21 ILE 97 1HG2 ILE 97 0.664 13.753 5.772 714 HG22 ILE 97 2HG2 ILE 97 0.780 15.514 5.747 715 HG23 ILE 97 3HG2 ILE 97 2.218 14.530 5.467 716 HD11 ILE 97 3HD1 ILE 97 0.367 17.627 3.797 717 HD12 ILE 97 1HD1 ILE 97 -0.632 16.465 2.925 718 HD13 ILE 97 2HD1 ILE 97 0.532 17.458 2.046 719 HA PRO 98 HA PRO 98 1.182 10.318 2.977 720 HB2 PRO 98 2HB PRO 98 -1.541 9.633 1.792 721 HB3 PRO 98 1HB PRO 98 -0.692 8.810 3.131 722 HG2 PRO 98 2HG PRO 98 -2.261 11.187 3.233 723 HG3 PRO 98 1HG PRO 98 -1.373 10.385 4.557 724 HD2 PRO 98 2HD PRO 98 -0.520 12.698 3.805 725 HD3 PRO 98 1HD PRO 98 0.670 11.393 3.958 726 H ARG 99 H ARG 99 2.079 8.449 2.004 727 HA ARG 99 HA ARG 99 1.972 8.473 -0.952 728 HB2 ARG 99 2HB ARG 99 4.245 8.327 0.948 729 HB3 ARG 99 1HB ARG 99 4.382 7.407 -0.552 730 HG2 ARG 99 2HG ARG 99 5.393 9.590 -0.800 731 HG3 ARG 99 1HG ARG 99 3.970 9.455 -1.832 732 HD2 ARG 99 2HD ARG 99 2.682 10.829 -0.417 733 HD3 ARG 99 1HD ARG 99 3.833 10.684 0.906 734 HE ARG 99 HE ARG 99 5.356 11.910 -0.838 735 HH11 ARG 99 1HH1 ARG 99 1.985 12.514 -0.151 736 HH12 ARG 99 2HH1 ARG 99 2.074 14.191 -0.566 737 HH21 ARG 99 1HH2 ARG 99 5.469 14.116 -1.382 738 HH22 ARG 99 2HH2 ARG 99 4.049 15.100 -1.265 739 H ILE 100 H ILE 100 3.398 6.263 -1.576 740 HA ILE 100 HA ILE 100 1.507 4.173 -1.243 741 HB ILE 100 HB ILE 100 4.312 4.100 -2.364 742 HG12 ILE 100 2HG1 ILE 100 2.814 3.833 -4.515 743 HG13 ILE 100 1HG1 ILE 100 1.598 4.617 -3.513 744 HG21 ILE 100 1HG2 ILE 100 4.013 1.871 -2.015 745 HG22 ILE 100 2HG2 ILE 100 3.156 2.020 -3.548 746 HG23 ILE 100 3HG2 ILE 100 2.254 1.991 -2.033 747 HD11 ILE 100 3HD1 ILE 100 2.759 6.600 -3.425 748 HD12 ILE 100 1HD1 ILE 100 3.115 6.034 -5.057 749 HD13 ILE 100 2HD1 ILE 100 4.308 5.831 -3.773 750 H LEU 101 H LEU 101 1.679 2.204 -0.134 751 HA LEU 101 HA LEU 101 3.854 1.891 1.786 752 HB2 LEU 101 2HB LEU 101 1.195 2.802 2.328 753 HB3 LEU 101 1HB LEU 101 1.438 1.249 3.098 754 HG LEU 101 HG LEU 101 3.571 2.274 4.064 755 HD11 LEU 101 1HD1 LEU 101 3.825 4.253 2.807 756 HD12 LEU 101 2HD1 LEU 101 3.301 4.766 4.406 757 HD13 LEU 101 3HD1 LEU 101 2.149 4.726 3.071 758 HD21 LEU 101 3HD2 LEU 101 2.393 2.839 5.969 759 HD22 LEU 101 1HD2 LEU 101 1.248 1.817 5.101 760 HD23 LEU 101 2HD2 LEU 101 1.073 3.571 5.047 761 H PHE 102 H PHE 102 4.564 -0.214 1.765 762 HA PHE 102 HA PHE 102 2.666 -2.275 0.843 763 HB2 PHE 102 2HB PHE 102 5.103 -1.858 -0.130 764 HB3 PHE 102 1HB PHE 102 5.565 -2.844 1.247 765 HD1 PHE 102 2HD PHE 102 3.908 -4.994 1.512 766 HD2 PHE 102 1HD PHE 102 4.890 -2.980 -2.106 767 HE1 PHE 102 2HE PHE 102 3.368 -7.028 0.238 768 HE2 PHE 102 1HE PHE 102 4.350 -5.010 -3.387 769 HZ PHE 102 HZ PHE 102 3.589 -7.039 -2.215 770 H LEU 103 H LEU 103 1.973 -3.872 2.261 771 HA LEU 103 HA LEU 103 3.447 -4.175 4.770 772 HB2 LEU 103 2HB LEU 103 1.714 -3.558 6.186 773 HB3 LEU 103 1HB LEU 103 1.757 -2.308 4.962 774 HG LEU 103 HG LEU 103 -0.255 -4.515 5.265 775 HD11 LEU 103 1HD1 LEU 103 -1.821 -2.625 5.311 776 HD12 LEU 103 2HD1 LEU 103 -0.450 -1.517 5.269 777 HD13 LEU 103 3HD1 LEU 103 -0.669 -2.597 6.644 778 HD21 LEU 103 3HD2 LEU 103 0.450 -2.843 2.907 779 HD22 LEU 103 1HD2 LEU 103 -1.244 -3.212 3.212 780 HD23 LEU 103 2HD2 LEU 103 -0.088 -4.521 2.980 781 H ASP 104 H ASP 104 2.187 -5.698 6.294 782 HA ASP 104 HA ASP 104 1.859 -8.182 4.869 783 HB2 ASP 104 2HB ASP 104 2.546 -7.366 7.539 784 HB3 ASP 104 1HB ASP 104 1.226 -8.543 7.605 785 HA PRO 105 HA PRO 105 -2.503 -8.497 4.540 786 HB2 PRO 105 2HB PRO 105 -2.891 -11.107 5.347 787 HB3 PRO 105 1HB PRO 105 -2.355 -10.619 3.729 788 HG2 PRO 105 2HG PRO 105 -0.743 -11.591 6.056 789 HG3 PRO 105 1HG PRO 105 -0.565 -11.962 4.325 790 HD2 PRO 105 2HD PRO 105 1.050 -10.211 5.571 791 HD3 PRO 105 1HD PRO 105 0.540 -9.977 3.889 792 H SER 106 H SER 106 -3.238 -7.128 6.097 793 HA SER 106 HA SER 106 -4.981 -7.862 7.985 794 HB2 SER 106 2HB SER 106 -2.219 -8.193 9.046 795 HB3 SER 106 1HB SER 106 -3.392 -7.409 10.117 796 HG SER 106 HG SER 106 -4.168 -9.312 10.488 797 H GLY 107 H GLY 107 -2.460 -5.719 7.028 798 HA2 GLY 107 2HA GLY 107 -2.947 -3.402 6.652 799 HA3 GLY 107 1HA GLY 107 -4.047 -3.456 8.036 800 H LYS 108 H LYS 108 -0.728 -4.716 7.797 801 HA LYS 108 HA LYS 108 0.014 -2.748 9.885 802 HB2 LYS 108 2HB LYS 108 0.616 -5.678 9.674 803 HB3 LYS 108 1HB LYS 108 1.687 -4.612 10.574 804 HG2 LYS 108 2HG LYS 108 -0.668 -3.884 11.638 805 HG3 LYS 108 1HG LYS 108 -1.025 -5.569 11.220 806 HD2 LYS 108 2HD LYS 108 1.017 -6.256 12.442 807 HD3 LYS 108 1HD LYS 108 1.263 -4.576 12.922 808 HE2 LYS 108 2HE LYS 108 -0.306 -4.684 14.520 809 HE3 LYS 108 1HE LYS 108 -1.419 -5.586 13.494 810 HZ1 LYS 108 3HZ LYS 108 0.102 -7.554 13.936 811 HZ2 LYS 108 1HZ LYS 108 -0.877 -7.038 15.216 812 HZ3 LYS 108 2HZ LYS 108 0.764 -6.631 15.189 813 H VAL 109 H VAL 109 0.887 -1.303 8.315 814 HA VAL 109 HA VAL 109 2.753 -1.935 6.339 815 HB VAL 109 HB VAL 109 1.614 0.334 6.818 816 HG11 VAL 109 1HG1 VAL 109 4.159 0.712 8.391 817 HG12 VAL 109 2HG1 VAL 109 2.550 0.578 9.097 818 HG13 VAL 109 3HG1 VAL 109 2.940 1.939 8.047 819 HG21 VAL 109 3HG2 VAL 109 3.916 1.419 5.929 820 HG22 VAL 109 1HG2 VAL 109 2.826 0.467 4.919 821 HG23 VAL 109 2HG2 VAL 109 4.243 -0.290 5.646 822 H HIS 110 H HIS 110 4.790 -2.311 6.208 823 HA HIS 110 HA HIS 110 6.348 -2.295 8.708 824 HB2 HIS 110 2HB HIS 110 6.051 -4.340 6.587 825 HB3 HIS 110 1HB HIS 110 7.700 -4.054 7.134 826 HD1 HIS 110 1HD HIS 110 4.305 -4.863 8.649 827 HD2 HIS 110 2HD HIS 110 8.357 -5.446 9.364 828 HE1 HIS 110 1HE HIS 110 4.423 -6.359 10.667 829 HE2 HIS 110 2HE HIS 110 6.885 -6.619 11.138 830 HA PRO 111 HA PRO 111 8.646 0.722 6.365 831 HB2 PRO 111 2HB PRO 111 10.722 1.024 8.107 832 HB3 PRO 111 1HB PRO 111 9.140 1.771 8.353 833 HG2 PRO 111 2HG PRO 111 10.263 -0.727 9.557 834 HG3 PRO 111 1HG PRO 111 9.317 0.561 10.327 835 HD2 PRO 111 2HD PRO 111 8.222 -1.797 9.566 836 HD3 PRO 111 1HD PRO 111 7.313 -0.267 9.538 837 H GLU 112 H GLU 112 8.888 -2.071 5.700 838 HA GLU 112 HA GLU 112 11.785 -2.234 5.149 839 HB2 GLU 112 2HB GLU 112 9.774 -4.349 5.824 840 HB3 GLU 112 1HB GLU 112 11.167 -4.763 4.835 841 HG2 GLU 112 2HG GLU 112 11.718 -5.288 7.071 842 HG3 GLU 112 1HG GLU 112 12.619 -3.833 6.646 843 H ILE 113 H ILE 113 8.531 -2.781 3.892 844 HA ILE 113 HA ILE 113 9.658 -3.053 1.199 845 HB ILE 113 HB ILE 113 6.835 -3.629 2.084 846 HG12 ILE 113 2HG1 ILE 113 8.498 -5.112 3.169 847 HG13 ILE 113 1HG1 ILE 113 7.452 -5.980 2.036 848 HG21 ILE 113 1HG2 ILE 113 6.699 -4.829 -0.065 849 HG22 ILE 113 2HG2 ILE 113 8.325 -4.271 -0.458 850 HG23 ILE 113 3HG2 ILE 113 7.012 -3.108 -0.283 851 HD11 ILE 113 3HD1 ILE 113 9.967 -6.488 2.043 852 HD12 ILE 113 1HD1 ILE 113 10.129 -4.962 1.175 853 HD13 ILE 113 2HD1 ILE 113 9.156 -6.264 0.493 854 H ILE 114 H ILE 114 10.087 -0.982 0.715 855 HA ILE 114 HA ILE 114 7.808 0.868 0.479 856 HB ILE 114 HB ILE 114 9.583 2.668 0.518 857 HG12 ILE 114 2HG1 ILE 114 11.335 0.582 0.283 858 HG13 ILE 114 1HG1 ILE 114 11.777 2.194 0.827 859 HG21 ILE 114 1HG2 ILE 114 8.103 2.159 2.408 860 HG22 ILE 114 2HG2 ILE 114 9.683 2.738 2.931 861 HG23 ILE 114 3HG2 ILE 114 9.297 1.019 3.021 862 HD11 ILE 114 3HD1 ILE 114 10.879 0.153 2.810 863 HD12 ILE 114 1HD1 ILE 114 11.950 1.536 3.027 864 HD13 ILE 114 2HD1 ILE 114 12.522 0.106 2.169 865 H ASN 115 H ASN 115 10.666 2.005 -0.936 866 HA ASN 115 HA ASN 115 10.297 0.763 -3.509 867 HB2 ASN 115 2HB ASN 115 8.623 2.439 -3.736 868 HB3 ASN 115 1HB ASN 115 9.649 3.667 -2.980 869 HD21 ASN 115 1HD2 ASN 115 9.470 5.073 -4.703 870 HD22 ASN 115 2HD2 ASN 115 10.248 4.780 -6.233 871 H GLU 116 H GLU 116 12.459 0.161 -2.612 872 HA GLU 116 HA GLU 116 14.550 1.873 -2.117 873 HB2 GLU 116 2HB GLU 116 14.478 -0.859 -3.377 874 HB3 GLU 116 1HB GLU 116 16.004 -0.018 -3.074 875 HG2 GLU 116 2HG GLU 116 13.960 -0.537 -0.934 876 HG3 GLU 116 1HG GLU 116 15.260 -1.663 -1.315 877 H ASN 117 H ASN 117 13.065 1.120 -5.162 878 HA ASN 117 HA ASN 117 15.165 2.001 -6.849 879 HB2 ASN 117 2HB ASN 117 13.360 0.593 -7.705 880 HB3 ASN 117 1HB ASN 117 12.180 1.864 -7.354 881 HD21 ASN 117 1HD2 ASN 117 14.386 0.604 -9.596 882 HD22 ASN 117 2HD2 ASN 117 14.261 1.867 -10.792 883 H GLY 118 H GLY 118 12.788 3.645 -4.949 884 HA2 GLY 118 2HA GLY 118 12.720 6.087 -6.411 885 HA3 GLY 118 1HA GLY 118 12.240 5.868 -4.724 886 H ASN 119 H ASN 119 13.198 7.905 -4.240 887 HA ASN 119 HA ASN 119 16.096 8.093 -4.499 888 HB2 ASN 119 2HB ASN 119 15.727 10.400 -3.521 889 HB3 ASN 119 1HB ASN 119 14.979 10.103 -5.096 890 HD21 ASN 119 1HD2 ASN 119 14.414 11.898 -2.722 891 HD22 ASN 119 2HD2 ASN 119 12.710 11.675 -2.432 892 HA PRO 120 HA PRO 120 16.885 6.915 -0.322 893 HB2 PRO 120 2HB PRO 120 19.232 8.150 0.137 894 HB3 PRO 120 1HB PRO 120 19.087 6.799 -1.005 895 HG2 PRO 120 2HG PRO 120 19.183 9.747 -1.548 896 HG3 PRO 120 1HG PRO 120 20.011 8.420 -2.397 897 HD2 PRO 120 2HD PRO 120 17.718 9.594 -3.310 898 HD3 PRO 120 1HD PRO 120 18.159 7.903 -3.652 899 H SER 121 H SER 121 14.926 8.752 -0.195 900 HA SER 121 HA SER 121 15.185 9.915 2.307 901 HB2 SER 121 2HB SER 121 16.017 11.676 0.042 902 HB3 SER 121 1HB SER 121 15.036 12.396 1.329 903 HG SER 121 HG SER 121 17.473 12.342 1.516 904 H TYR 122 H TYR 122 13.324 8.433 0.844 905 HA TYR 122 HA TYR 122 10.940 9.824 1.415 906 HB2 TYR 122 2HB TYR 122 12.076 10.306 -1.164 907 HB3 TYR 122 1HB TYR 122 10.579 9.394 -1.366 908 HD1 TYR 122 1HD TYR 122 8.498 10.325 -0.109 909 HD2 TYR 122 2HD TYR 122 12.006 12.604 -0.880 910 HE1 TYR 122 1HE TYR 122 7.210 12.399 0.184 911 HE2 TYR 122 2HE TYR 122 10.730 14.683 -0.585 912 HH TYR 122 HH TYR 122 8.480 15.488 -0.641 913 H LYS 123 H LYS 123 12.397 7.307 -0.599 914 HA LYS 123 HA LYS 123 11.777 5.154 -1.060 915 HB2 LYS 123 2HB LYS 123 11.033 5.478 1.838 916 HB3 LYS 123 1HB LYS 123 10.892 3.934 1.016 917 HG2 LYS 123 2HG LYS 123 13.407 5.539 1.417 918 HG3 LYS 123 1HG LYS 123 12.968 4.022 2.220 919 HD2 LYS 123 2HD LYS 123 13.995 2.923 0.582 920 HD3 LYS 123 1HD LYS 123 12.766 3.526 -0.539 921 HE2 LYS 123 2HE LYS 123 14.119 5.184 -1.344 922 HE3 LYS 123 1HE LYS 123 15.029 5.324 0.160 923 HZ1 LYS 123 3HZ LYS 123 16.594 4.228 -0.978 924 HZ2 LYS 123 1HZ LYS 123 15.509 3.637 -2.135 925 HZ3 LYS 123 2HZ LYS 123 15.674 2.848 -0.649 926 H TYR 124 H TYR 124 9.135 5.428 1.202 927 HA TYR 124 HA TYR 124 7.168 4.213 -0.137 928 HB2 TYR 124 2HB TYR 124 6.838 6.697 1.541 929 HB3 TYR 124 1HB TYR 124 5.543 5.565 1.137 930 HD1 TYR 124 1HD TYR 124 8.584 6.091 3.130 931 HD2 TYR 124 2HD TYR 124 5.400 3.414 2.249 932 HE1 TYR 124 1HE TYR 124 9.126 4.787 5.140 933 HE2 TYR 124 2HE TYR 124 5.931 2.108 4.261 934 HH TYR 124 HH TYR 124 8.805 2.678 6.114 935 H PHE 125 H PHE 125 8.348 7.414 -0.912 936 HA PHE 125 HA PHE 125 6.091 8.144 -2.528 937 HB2 PHE 125 2HB PHE 125 7.352 9.929 -1.578 938 HB3 PHE 125 1HB PHE 125 8.869 9.287 -2.217 939 HD1 PHE 125 1HD PHE 125 5.623 10.770 -3.250 940 HD2 PHE 125 2HD PHE 125 9.688 10.023 -4.259 941 HE1 PHE 125 1HE PHE 125 5.397 12.226 -5.222 942 HE2 PHE 125 2HE PHE 125 9.470 11.476 -6.233 943 HZ PHE 125 HZ PHE 125 7.321 12.581 -6.714 944 H TYR 126 H TYR 126 5.650 7.431 -4.504 945 HA TYR 126 HA TYR 126 7.778 6.112 -6.043 946 HB2 TYR 126 2HB TYR 126 4.766 5.889 -6.132 947 HB3 TYR 126 1HB TYR 126 5.807 5.203 -7.386 948 HD1 TYR 126 1HD TYR 126 6.344 5.257 -3.697 949 HD2 TYR 126 2HD TYR 126 5.518 2.902 -7.132 950 HE1 TYR 126 1HE TYR 126 6.592 3.221 -2.348 951 HE2 TYR 126 2HE TYR 126 5.763 0.855 -5.799 952 HH TYR 126 HH TYR 126 6.783 0.098 -3.757 953 H VAL 127 H VAL 127 7.340 6.247 -8.508 954 HA VAL 127 HA VAL 127 6.154 8.593 -9.574 955 HB VAL 127 HB VAL 127 8.376 9.484 -10.510 956 HG11 VAL 127 1HG1 VAL 127 8.415 11.128 -8.906 957 HG12 VAL 127 2HG1 VAL 127 8.182 9.986 -7.581 958 HG13 VAL 127 3HG1 VAL 127 6.826 10.414 -8.624 959 HG21 VAL 127 3HG2 VAL 127 10.317 9.174 -9.013 960 HG22 VAL 127 1HG2 VAL 127 9.824 7.682 -9.815 961 HG23 VAL 127 2HG2 VAL 127 9.406 7.955 -8.123 962 H SER 128 H SER 128 5.255 7.416 -11.152 963 HA SER 128 HA SER 128 5.175 6.615 -13.315 964 HB2 SER 128 2HB SER 128 7.037 6.381 -14.656 965 HB3 SER 128 1HB SER 128 7.669 7.490 -13.427 966 HG SER 128 HG SER 128 8.424 5.525 -12.335 967 H ALA 129 H ALA 129 4.432 4.679 -13.888 968 HA ALA 129 HA ALA 129 4.236 2.578 -12.089 969 HB1 ALA 129 1HB ALA 129 3.162 1.357 -13.808 970 HB2 ALA 129 2HB ALA 129 3.971 2.288 -15.068 971 HB3 ALA 129 3HB ALA 129 2.747 3.053 -14.056 972 H GLU 130 H GLU 130 6.774 3.315 -14.319 973 HA GLU 130 HA GLU 130 7.876 0.862 -14.883 974 HB2 GLU 130 2HB GLU 130 8.832 3.613 -14.728 975 HB3 GLU 130 1HB GLU 130 10.098 2.439 -14.344 976 HG2 GLU 130 2HG GLU 130 9.344 1.248 -16.497 977 HG3 GLU 130 1HG GLU 130 8.538 2.779 -16.880 978 H GLN 131 H GLN 131 8.860 2.902 -12.114 979 HA GLN 131 HA GLN 131 10.305 0.791 -10.910 980 HB2 GLN 131 2HB GLN 131 10.095 2.286 -8.833 981 HB3 GLN 131 1HB GLN 131 11.074 2.830 -10.190 982 HG2 GLN 131 2HG GLN 131 9.760 4.593 -10.585 983 HG3 GLN 131 1HG GLN 131 8.280 3.671 -10.334 984 HE21 GLN 131 1HE2 GLN 131 10.370 5.980 -9.074 985 HE22 GLN 131 2HE2 GLN 131 9.685 6.109 -7.494 986 H VAL 132 H VAL 132 7.096 2.165 -10.267 987 HA VAL 132 HA VAL 132 6.445 0.751 -7.997 988 HB VAL 132 HB VAL 132 4.276 1.367 -8.277 989 HG11 VAL 132 1HG1 VAL 132 5.022 3.123 -10.529 990 HG12 VAL 132 2HG1 VAL 132 5.974 3.249 -9.054 991 HG13 VAL 132 3HG1 VAL 132 4.230 3.505 -9.005 992 HG21 VAL 132 3HG2 VAL 132 3.274 1.573 -10.688 993 HG22 VAL 132 1HG2 VAL 132 3.405 0.003 -9.897 994 HG23 VAL 132 2HG2 VAL 132 4.599 0.486 -11.100 995 H VAL 133 H VAL 133 6.700 -0.382 -11.268 996 HA VAL 133 HA VAL 133 5.302 -2.837 -10.781 997 HB VAL 133 HB VAL 133 5.590 -1.668 -13.058 998 HG11 VAL 133 1HG1 VAL 133 7.572 -1.651 -14.074 999 HG12 VAL 133 2HG1 VAL 133 7.827 -3.365 -13.748 1000 HG13 VAL 133 3HG1 VAL 133 8.274 -2.164 -12.542 1001 HG21 VAL 133 3HG2 VAL 133 5.316 -3.758 -14.206 1002 HG22 VAL 133 1HG2 VAL 133 4.535 -3.875 -12.628 1003 HG23 VAL 133 2HG2 VAL 133 6.109 -4.629 -12.891 1004 H GLN 134 H GLN 134 8.678 -1.770 -10.707 1005 HA GLN 134 HA GLN 134 9.640 -4.494 -10.512 1006 HB2 GLN 134 2HB GLN 134 11.793 -3.250 -9.724 1007 HB3 GLN 134 1HB GLN 134 11.288 -3.144 -11.404 1008 HG2 GLN 134 2HG GLN 134 10.315 -0.978 -11.015 1009 HG3 GLN 134 1HG GLN 134 10.694 -1.090 -9.299 1010 HE21 GLN 134 1HE2 GLN 134 11.681 0.126 -12.202 1011 HE22 GLN 134 2HE2 GLN 134 13.359 0.420 -11.832 1012 H GLY 135 H GLY 135 8.882 -1.885 -8.308 1013 HA2 GLY 135 2HA GLY 135 9.844 -3.240 -5.974 1014 HA3 GLY 135 1HA GLY 135 8.815 -1.802 -6.006 1015 H MET 136 H MET 136 6.935 -3.355 -7.866 1016 HA MET 136 HA MET 136 5.463 -4.615 -5.671 1017 HB2 MET 136 2HB MET 136 3.507 -4.445 -7.005 1018 HB3 MET 136 1HB MET 136 4.364 -2.923 -7.175 1019 HG2 MET 136 2HG MET 136 4.241 -3.148 -9.360 1020 HG3 MET 136 1HG MET 136 5.295 -4.556 -9.248 1021 HE1 MET 136 3HE MET 136 4.188 -7.101 -8.760 1022 HE2 MET 136 1HE MET 136 2.441 -7.336 -8.692 1023 HE3 MET 136 2HE MET 136 3.248 -6.368 -7.460 1024 H LYS 137 H LYS 137 7.035 -5.391 -8.683 1025 HA LYS 137 HA LYS 137 5.988 -8.059 -8.824 1026 HB2 LYS 137 2HB LYS 137 7.271 -8.332 -10.767 1027 HB3 LYS 137 1HB LYS 137 6.795 -6.643 -10.790 1028 HG2 LYS 137 2HG LYS 137 9.076 -6.194 -9.706 1029 HG3 LYS 137 1HG LYS 137 9.481 -7.834 -10.217 1030 HD2 LYS 137 2HD LYS 137 8.626 -5.539 -11.980 1031 HD3 LYS 137 1HD LYS 137 10.227 -6.277 -11.901 1032 HE2 LYS 137 2HE LYS 137 7.783 -7.860 -12.644 1033 HE3 LYS 137 1HE LYS 137 8.697 -6.947 -13.842 1034 HZ1 LYS 137 3HZ LYS 137 10.656 -8.291 -12.647 1035 HZ2 LYS 137 1HZ LYS 137 9.825 -8.870 -14.003 1036 HZ3 LYS 137 2HZ LYS 137 9.394 -9.400 -12.456 1037 H GLU 138 H GLU 138 8.397 -6.570 -6.989 1038 HA GLU 138 HA GLU 138 9.915 -9.045 -6.634 1039 HB2 GLU 138 2HB GLU 138 10.536 -6.215 -6.436 1040 HB3 GLU 138 1HB GLU 138 11.045 -7.095 -4.996 1041 HG2 GLU 138 2HG GLU 138 12.263 -8.682 -6.446 1042 HG3 GLU 138 1HG GLU 138 11.823 -7.687 -7.843 1043 H ALA 139 H ALA 139 8.645 -6.471 -4.538 1044 HA ALA 139 HA ALA 139 8.733 -7.852 -2.137 1045 HB1 ALA 139 1HB ALA 139 7.022 -5.610 -3.130 1046 HB2 ALA 139 2HB ALA 139 8.310 -5.587 -1.926 1047 HB3 ALA 139 3HB ALA 139 6.748 -6.303 -1.532 1048 H GLN 140 H GLN 140 6.469 -8.105 -4.757 1049 HA GLN 140 HA GLN 140 4.302 -9.256 -3.466 1050 HB2 GLN 140 2HB GLN 140 3.817 -10.282 -5.703 1051 HB3 GLN 140 1HB GLN 140 4.059 -8.536 -5.717 1052 HG2 GLN 140 2HG GLN 140 5.198 -9.391 -7.590 1053 HG3 GLN 140 1HG GLN 140 6.429 -8.995 -6.395 1054 HE21 GLN 140 1HE2 GLN 140 4.307 -11.796 -6.881 1055 HE22 GLN 140 2HE2 GLN 140 5.575 -12.967 -6.902 1056 H GLU 141 H GLU 141 7.425 -10.553 -4.042 1057 HA GLU 141 HA GLU 141 6.487 -13.302 -3.683 1058 HB2 GLU 141 2HB GLU 141 8.009 -13.080 -5.502 1059 HB3 GLU 141 1HB GLU 141 9.140 -12.139 -4.524 1060 HG2 GLU 141 2HG GLU 141 9.909 -14.001 -3.391 1061 HG3 GLU 141 1HG GLU 141 8.469 -14.950 -3.763 1062 H ARG 142 H ARG 142 8.813 -11.008 -2.263 1063 HA ARG 142 HA ARG 142 9.690 -12.672 -0.185 1064 HB2 ARG 142 2HB ARG 142 9.500 -9.654 -0.198 1065 HB3 ARG 142 1HB ARG 142 10.490 -10.628 0.895 1066 HG2 ARG 142 2HG ARG 142 12.145 -10.403 -0.558 1067 HG3 ARG 142 1HG ARG 142 11.236 -11.457 -1.653 1068 HD2 ARG 142 2HD ARG 142 10.011 -9.271 -2.327 1069 HD3 ARG 142 1HD ARG 142 11.408 -8.465 -1.597 1070 HE ARG 142 HE ARG 142 11.327 -9.871 -4.099 1071 HH11 ARG 142 1HH1 ARG 142 13.386 -8.871 -1.465 1072 HH12 ARG 142 2HH1 ARG 142 14.837 -8.943 -2.407 1073 HH21 ARG 142 1HH2 ARG 142 13.236 -9.973 -5.337 1074 HH22 ARG 142 2HH2 ARG 142 14.752 -9.567 -4.605 1075 H LEU 143 H LEU 143 6.935 -10.496 -0.396 1076 HA LEU 143 HA LEU 143 6.264 -10.757 2.382 1077 HB2 LEU 143 2HB LEU 143 4.937 -9.512 -0.002 1078 HB3 LEU 143 1HB LEU 143 4.062 -9.696 1.518 1079 HG LEU 143 HG LEU 143 4.952 -7.474 1.418 1080 HD11 LEU 143 1HD1 LEU 143 5.410 -9.215 3.493 1081 HD12 LEU 143 2HD1 LEU 143 5.554 -7.459 3.559 1082 HD13 LEU 143 3HD1 LEU 143 6.981 -8.449 3.254 1083 HD21 LEU 143 3HD2 LEU 143 6.815 -7.006 0.315 1084 HD22 LEU 143 1HD2 LEU 143 7.152 -8.722 0.123 1085 HD23 LEU 143 2HD2 LEU 143 7.754 -7.864 1.535 1086 H THR 144 H THR 144 5.084 -12.152 -0.652 1087 HA THR 144 HA THR 144 2.917 -13.565 0.485 1088 HB THR 144 HB THR 144 3.082 -14.920 -1.638 1089 HG1 THR 144 1HG THR 144 4.846 -14.783 -2.728 1090 HG21 THR 144 3HG2 THR 144 2.490 -13.094 -3.155 1091 HG22 THR 144 1HG2 THR 144 3.033 -11.933 -1.943 1092 HG23 THR 144 2HG2 THR 144 1.655 -12.980 -1.606 1093 H GLY 145 H GLY 145 3.002 -15.223 1.846 1094 HA2 GLY 145 2HA GLY 145 3.575 -17.444 2.421 1095 HA3 GLY 145 1HA GLY 145 5.029 -17.296 1.448 1096 H ASP 146 H ASP 146 4.315 -14.705 3.605 1097 HA ASP 146 HA ASP 146 5.405 -13.898 5.432 1098 HB2 ASP 146 2HB ASP 146 4.966 -16.771 5.993 1099 HB3 ASP 146 1HB ASP 146 6.149 -15.960 7.015 1100 H ALA 147 H ALA 147 6.980 -14.597 3.041 1101 HA ALA 147 HA ALA 147 9.485 -15.667 3.884 1102 HB1 ALA 147 1HB ALA 147 10.084 -14.294 1.616 1103 HB2 ALA 147 2HB ALA 147 8.352 -14.557 1.418 1104 HB3 ALA 147 3HB ALA 147 9.430 -15.931 1.656 1105 H PHE 148 H PHE 148 8.042 -12.531 3.981 1106 HA PHE 148 HA PHE 148 10.328 -10.910 4.002 1107 HB2 PHE 148 2HB PHE 148 8.915 -9.216 5.029 1108 HB3 PHE 148 1HB PHE 148 8.012 -10.062 3.766 1109 HD1 PHE 148 1HD PHE 148 6.227 -11.622 4.358 1110 HD2 PHE 148 2HD PHE 148 8.289 -9.380 7.328 1111 HE1 PHE 148 1HE PHE 148 4.443 -12.130 5.973 1112 HE2 PHE 148 2HE PHE 148 6.509 -9.884 8.951 1113 HZ PHE 148 HZ PHE 148 4.583 -11.261 8.274 1114 H ARG 149 H ARG 149 8.809 -12.833 6.500 1115 HA ARG 149 HA ARG 149 10.216 -11.699 8.691 1116 HB2 ARG 149 2HB ARG 149 8.744 -14.305 8.317 1117 HB3 ARG 149 1HB ARG 149 9.476 -13.833 9.840 1118 HG2 ARG 149 2HG ARG 149 8.058 -11.672 9.549 1119 HG3 ARG 149 1HG ARG 149 7.117 -12.673 8.441 1120 HD2 ARG 149 2HD ARG 149 6.486 -14.157 10.123 1121 HD3 ARG 149 1HD ARG 149 7.788 -13.643 11.194 1122 HE ARG 149 HE ARG 149 5.947 -11.532 10.648 1123 HH11 ARG 149 1HH1 ARG 149 6.443 -14.384 12.595 1124 HH12 ARG 149 2HH1 ARG 149 5.406 -13.846 13.872 1125 HH21 ARG 149 1HH2 ARG 149 4.585 -10.820 12.328 1126 HH22 ARG 149 2HH2 ARG 149 4.350 -11.823 13.721 1127 H LYS 150 H LYS 150 11.409 -13.567 10.110 1128 HA LYS 150 HA LYS 150 13.589 -14.536 8.383 1129 HB2 LYS 150 2HB LYS 150 13.671 -12.838 10.632 1130 HB3 LYS 150 1HB LYS 150 14.349 -14.372 11.156 1131 HG2 LYS 150 2HG LYS 150 15.637 -14.086 8.818 1132 HG3 LYS 150 1HG LYS 150 15.394 -12.390 9.244 1133 HD2 LYS 150 2HD LYS 150 16.380 -14.204 11.373 1134 HD3 LYS 150 1HD LYS 150 17.504 -13.789 10.077 1135 HE2 LYS 150 2HE LYS 150 16.050 -11.478 11.077 1136 HE3 LYS 150 1HE LYS 150 16.975 -12.289 12.339 1137 HZ1 LYS 150 3HZ LYS 150 18.963 -12.041 11.089 1138 HZ2 LYS 150 1HZ LYS 150 18.206 -10.528 11.118 1139 HZ3 LYS 150 2HZ LYS 150 18.127 -11.486 9.726 1140 H LYS 151 H LYS 151 11.490 -15.298 11.090 1141 HA LYS 151 HA LYS 151 12.618 -17.939 11.429 1142 HB2 LYS 151 2HB LYS 151 10.864 -18.226 13.134 1143 HB3 LYS 151 1HB LYS 151 11.794 -16.756 13.388 1144 HG2 LYS 151 2HG LYS 151 9.734 -15.845 11.857 1145 HG3 LYS 151 1HG LYS 151 8.951 -17.110 12.805 1146 HD2 LYS 151 2HD LYS 151 10.737 -15.158 14.183 1147 HD3 LYS 151 1HD LYS 151 9.111 -14.653 13.716 1148 HE2 LYS 151 2HE LYS 151 8.561 -15.496 15.734 1149 HE3 LYS 151 1HE LYS 151 8.557 -17.026 14.859 1150 HZ1 LYS 151 3HZ LYS 151 9.877 -16.834 17.044 1151 HZ2 LYS 151 1HZ LYS 151 11.039 -16.043 16.102 1152 HZ3 LYS 151 2HZ LYS 151 10.588 -17.630 15.732 1153 H HIS 152 H HIS 152 9.818 -16.470 9.911 1154 HA HIS 152 HA HIS 152 8.237 -17.280 8.491 1155 HB2 HIS 152 2HB HIS 152 10.229 -19.525 8.110 1156 HB3 HIS 152 1HB HIS 152 8.864 -19.177 7.055 1157 HD1 HIS 152 1HD HIS 152 12.272 -17.937 7.976 1158 HD2 HIS 152 2HD HIS 152 9.224 -17.035 5.302 1159 HE1 HIS 152 1HE HIS 152 13.273 -16.311 6.341 1160 HE2 HIS 152 2HE HIS 152 11.434 -15.840 4.685 1161 H LEU 153 H LEU 153 8.037 -17.946 11.272 1162 HA LEU 153 HA LEU 153 6.831 -19.252 12.692 1163 HB2 LEU 153 2HB LEU 153 5.465 -19.302 10.143 1164 HB3 LEU 153 1HB LEU 153 5.192 -20.791 11.027 1165 HG LEU 153 HG LEU 153 3.441 -19.107 11.439 1166 HD11 LEU 153 1HD1 LEU 153 4.099 -20.822 13.138 1167 HD12 LEU 153 2HD1 LEU 153 3.339 -19.376 13.803 1168 HD13 LEU 153 3HD1 LEU 153 5.086 -19.584 13.914 1169 HD21 LEU 153 3HD2 LEU 153 5.802 -17.487 12.276 1170 HD22 LEU 153 1HD2 LEU 153 4.245 -17.228 13.063 1171 HD23 LEU 153 2HD2 LEU 153 4.396 -17.018 11.319 1172 H GLU 154 H GLU 154 6.031 -21.672 12.995 1173 HA GLU 154 HA GLU 154 8.303 -23.377 12.216 1174 HB2 GLU 154 2HB GLU 154 7.802 -24.682 14.265 1175 HB3 GLU 154 1HB GLU 154 8.247 -23.015 14.602 1176 HG2 GLU 154 2HG GLU 154 5.458 -23.034 14.336 1177 HG3 GLU 154 1HG GLU 154 5.869 -24.445 15.309 1178 H ASP 155 H ASP 155 4.819 -23.147 12.445 1179 HA ASP 155 HA ASP 155 4.570 -25.795 11.188 1180 HB2 ASP 155 2HB ASP 155 2.933 -24.307 13.135 1181 HB3 ASP 155 1HB ASP 155 2.015 -25.104 11.860 1182 H GLU 156 H GLU 156 3.170 -26.060 9.395 1183 HA GLU 156 HA GLU 156 3.219 -23.847 7.572 1184 HB2 GLU 156 2HB GLU 156 2.583 -26.728 7.453 1185 HB3 GLU 156 1HB GLU 156 1.698 -25.716 6.307 1186 HG2 GLU 156 2HG GLU 156 3.699 -26.573 5.280 1187 HG3 GLU 156 1HG GLU 156 3.830 -24.825 5.477 1188 H LEU 157 H LEU 157 0.577 -25.832 8.917 1189 HA LEU 157 HA LEU 157 -1.280 -23.635 8.314 1190 HB2 LEU 157 2HB LEU 157 -1.489 -26.555 8.291 1191 HB3 LEU 157 1HB LEU 157 -2.831 -25.769 9.099 1192 HG LEU 157 HG LEU 157 -2.827 -24.282 6.901 1193 HD11 LEU 157 1HD1 LEU 157 -2.141 -26.819 5.565 1194 HD12 LEU 157 2HD1 LEU 157 -0.791 -25.897 6.225 1195 HD13 LEU 157 3HD1 LEU 157 -1.878 -25.152 5.052 1196 HD21 LEU 157 3HD2 LEU 157 -4.606 -25.823 7.863 1197 HD22 LEU 157 1HD2 LEU 157 -3.960 -27.063 6.788 1198 HD23 LEU 157 2HD2 LEU 157 -4.628 -25.576 6.117
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