NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
479795 | 2l2s | 17151 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 5.272 2.404 -8.054 2 HA2 GLY 1 1HA GLY 1 3.668 0.566 -7.976 3 HA3 GLY 1 2HA GLY 1 4.318 0.154 -6.396 4 HA PRO 2 HA PRO 2 1.343 2.634 -4.354 5 HB2 PRO 2 1HB PRO 2 2.769 3.968 -2.468 6 HB3 PRO 2 2HB PRO 2 2.443 2.233 -2.377 7 HG2 PRO 2 1HG PRO 2 4.909 3.650 -3.310 8 HG3 PRO 2 2HG PRO 2 4.766 2.214 -2.280 9 HD2 PRO 2 1HD PRO 2 5.362 2.061 -4.917 10 HD3 PRO 2 2HD PRO 2 4.433 0.805 -4.073 11 H GLY 3 H GLY 3 4.196 4.373 -5.477 12 HA2 GLY 3 1HA GLY 3 3.202 6.282 -7.001 13 HA3 GLY 3 2HA GLY 3 2.748 6.913 -5.425 14 H SER 4 H SER 4 4.354 8.392 -7.070 15 HA SER 4 HA SER 4 7.069 8.046 -6.001 16 HB2 SER 4 1HB SER 4 7.537 9.883 -7.804 17 HB3 SER 4 2HB SER 4 7.285 8.214 -8.314 18 HG SER 4 HG SER 4 6.054 9.720 -9.545 19 H MET 5 H MET 5 8.250 10.064 -5.449 20 HA MET 5 HA MET 5 6.706 12.384 -4.736 21 HB2 MET 5 1HB MET 5 6.430 10.564 -2.881 22 HB3 MET 5 2HB MET 5 8.065 11.032 -2.432 23 HG2 MET 5 1HG MET 5 7.428 13.128 -1.748 24 HG3 MET 5 2HG MET 5 5.992 13.141 -2.770 25 HE1 MET 5 3HE MET 5 4.956 13.630 0.913 26 HE2 MET 5 1HE MET 5 5.528 14.388 -0.574 27 HE3 MET 5 2HE MET 5 3.914 13.681 -0.510 28 H THR 6 H THR 6 8.033 13.885 -5.522 29 HA THR 6 HA THR 6 10.711 14.113 -4.431 30 HB THR 6 HB THR 6 11.179 12.747 -6.369 31 HG1 THR 6 HG1 THR 6 12.572 14.228 -7.461 32 HG21 THR 6 3HG2 THR 6 9.504 12.905 -7.915 33 HG22 THR 6 1HG2 THR 6 10.663 14.011 -8.651 34 HG23 THR 6 2HG2 THR 6 9.320 14.645 -7.700 35 H VAL 7 H VAL 7 11.635 16.197 -4.709 36 HA VAL 7 HA VAL 7 9.751 18.247 -5.679 37 HB VAL 7 HB VAL 7 11.570 18.513 -3.280 38 HG11 VAL 7 1HG1 VAL 7 9.528 20.464 -3.328 39 HG12 VAL 7 2HG1 VAL 7 11.269 20.701 -3.501 40 HG13 VAL 7 3HG1 VAL 7 10.267 20.442 -4.929 41 HG21 VAL 7 3HG2 VAL 7 8.702 17.760 -3.563 42 HG22 VAL 7 1HG2 VAL 7 9.921 17.163 -2.437 43 HG23 VAL 7 2HG2 VAL 7 9.188 18.747 -2.184 44 H VAL 8 H VAL 8 10.567 19.790 -6.981 45 HA VAL 8 HA VAL 8 13.459 20.171 -7.143 46 HB VAL 8 HB VAL 8 13.058 18.487 -8.833 47 HG11 VAL 8 1HG1 VAL 8 10.748 18.666 -9.277 48 HG12 VAL 8 2HG1 VAL 8 10.893 20.357 -9.762 49 HG13 VAL 8 3HG1 VAL 8 11.559 19.083 -10.786 50 HG21 VAL 8 3HG2 VAL 8 14.690 20.221 -9.349 51 HG22 VAL 8 1HG2 VAL 8 13.865 19.687 -10.813 52 HG23 VAL 8 2HG2 VAL 8 13.423 21.220 -10.062 53 H THR 9 H THR 9 14.082 22.194 -7.840 54 HA THR 9 HA THR 9 11.900 24.147 -8.116 55 HB THR 9 HB THR 9 14.755 24.841 -7.458 56 HG1 THR 9 HG1 THR 9 14.392 24.395 -5.379 57 HG21 THR 9 3HG2 THR 9 13.366 26.679 -6.204 58 HG22 THR 9 1HG2 THR 9 12.103 26.211 -7.342 59 HG23 THR 9 2HG2 THR 9 13.651 26.809 -7.940 60 H THR 10 H THR 10 12.161 25.907 -9.606 61 HA THR 10 HA THR 10 13.691 25.115 -11.985 62 HB THR 10 HB THR 10 12.192 26.954 -13.061 63 HG1 THR 10 HG1 THR 10 10.710 27.759 -11.793 64 HG21 THR 10 3HG2 THR 10 11.679 24.904 -13.900 65 HG22 THR 10 1HG2 THR 10 10.221 25.142 -12.938 66 HG23 THR 10 2HG2 THR 10 11.546 24.164 -12.305 67 H GLU 11 H GLU 11 14.327 27.107 -13.376 68 HA GLU 11 HA GLU 11 16.248 28.579 -11.899 69 HB2 GLU 11 1HB GLU 11 15.269 28.728 -14.741 70 HB3 GLU 11 2HB GLU 11 16.465 29.856 -14.118 71 HG2 GLU 11 1HG GLU 11 17.819 27.817 -13.448 72 HG3 GLU 11 2HG GLU 11 16.706 26.886 -14.449 73 H SER 12 H SER 12 12.986 29.223 -12.913 74 HA SER 12 HA SER 12 13.046 32.045 -12.631 75 HB2 SER 12 1HB SER 12 10.488 31.689 -12.366 76 HB3 SER 12 2HB SER 12 11.243 31.248 -13.898 77 HG SER 12 HG SER 12 10.535 29.311 -13.564 78 H GLY 13 H GLY 13 12.692 29.412 -10.392 79 HA2 GLY 13 1HA GLY 13 13.326 29.973 -8.069 80 HA3 GLY 13 2HA GLY 13 12.285 31.380 -8.224 81 H LEU 14 H LEU 14 10.136 30.046 -9.569 82 HA LEU 14 HA LEU 14 8.620 29.201 -7.383 83 HB2 LEU 14 1HB LEU 14 6.897 28.812 -8.876 84 HB3 LEU 14 2HB LEU 14 7.875 30.023 -9.701 85 HG LEU 14 HG LEU 14 8.937 27.797 -10.761 86 HD11 LEU 14 1HD1 LEU 14 6.707 26.818 -9.379 87 HD12 LEU 14 2HD1 LEU 14 7.699 25.968 -10.563 88 HD13 LEU 14 3HD1 LEU 14 6.254 26.833 -11.084 89 HD21 LEU 14 3HD2 LEU 14 6.875 29.718 -11.535 90 HD22 LEU 14 1HD2 LEU 14 6.813 28.201 -12.433 91 HD23 LEU 14 2HD2 LEU 14 8.295 29.157 -12.418 92 H LYS 15 H LYS 15 7.537 27.047 -7.180 93 HA LYS 15 HA LYS 15 9.273 24.817 -7.972 94 HB2 LYS 15 1HB LYS 15 8.385 25.526 -5.188 95 HB3 LYS 15 2HB LYS 15 8.791 23.870 -5.619 96 HG2 LYS 15 1HG LYS 15 11.034 24.540 -6.223 97 HG3 LYS 15 2HG LYS 15 10.639 26.231 -5.904 98 HD2 LYS 15 1HD LYS 15 10.376 24.103 -3.797 99 HD3 LYS 15 2HD LYS 15 11.894 24.958 -4.081 100 HE2 LYS 15 1HE LYS 15 9.402 26.548 -3.720 101 HE3 LYS 15 2HE LYS 15 10.145 25.811 -2.301 102 HZ1 LYS 15 3HZ LYS 15 10.909 28.101 -2.744 103 HZ2 LYS 15 1HZ LYS 15 11.580 27.578 -4.206 104 HZ3 LYS 15 2HZ LYS 15 12.171 26.974 -2.741 105 H TYR 16 H TYR 16 8.197 22.681 -7.627 106 HA TYR 16 HA TYR 16 5.311 22.695 -7.447 107 HB2 TYR 16 1HB TYR 16 5.093 21.509 -9.676 108 HB3 TYR 16 2HB TYR 16 5.453 23.229 -9.761 109 HD1 TYR 16 HD2 TYR 16 7.129 19.899 -9.822 110 HD2 TYR 16 HD1 TYR 16 7.231 23.967 -11.064 111 HE1 TYR 16 HE2 TYR 16 9.086 19.414 -11.230 112 HE2 TYR 16 HE1 TYR 16 9.188 23.493 -12.476 113 HH TYR 16 HH TYR 16 11.020 21.827 -12.584 114 H GLU 17 H GLU 17 4.408 20.599 -7.216 115 HA GLU 17 HA GLU 17 6.352 18.422 -6.866 116 HB2 GLU 17 1HB GLU 17 4.079 18.928 -4.948 117 HB3 GLU 17 2HB GLU 17 5.390 17.769 -4.778 118 HG2 GLU 17 1HG GLU 17 6.986 19.564 -4.503 119 HG3 GLU 17 2HG GLU 17 5.719 20.761 -4.769 120 H ASP 18 H ASP 18 5.545 16.322 -7.173 121 HA ASP 18 HA ASP 18 3.258 16.206 -8.949 122 HB2 ASP 18 1HB ASP 18 3.964 13.971 -9.457 123 HB3 ASP 18 2HB ASP 18 5.406 14.981 -9.400 124 H LEU 19 H LEU 19 1.273 15.585 -8.399 125 HA LEU 19 HA LEU 19 0.904 14.258 -5.794 126 HB2 LEU 19 1HB LEU 19 0.043 16.707 -6.299 127 HB3 LEU 19 2HB LEU 19 -1.291 15.829 -7.043 128 HG LEU 19 HG LEU 19 -1.704 14.699 -4.881 129 HD11 LEU 19 1HD1 LEU 19 0.213 14.664 -3.642 130 HD12 LEU 19 2HD1 LEU 19 -0.591 16.054 -2.914 131 HD13 LEU 19 3HD1 LEU 19 0.681 16.298 -4.110 132 HD21 LEU 19 3HD2 LEU 19 -3.186 16.399 -5.008 133 HD22 LEU 19 1HD2 LEU 19 -1.941 17.606 -5.333 134 HD23 LEU 19 2HD2 LEU 19 -2.217 17.048 -3.683 135 H THR 20 H THR 20 -0.125 14.468 -9.146 136 HA THR 20 HA THR 20 -0.895 11.701 -9.145 137 HB THR 20 HB THR 20 -3.090 13.620 -9.891 138 HG1 THR 20 HG1 THR 20 -3.961 12.889 -7.753 139 HG21 THR 20 3HG2 THR 20 -2.706 10.730 -9.840 140 HG22 THR 20 1HG2 THR 20 -3.914 11.694 -10.689 141 HG23 THR 20 2HG2 THR 20 -4.171 11.244 -9.003 142 H GLU 21 H GLU 21 -0.007 11.015 -10.973 143 HA GLU 21 HA GLU 21 0.741 12.666 -13.115 144 HB2 GLU 21 1HB GLU 21 1.665 10.374 -12.507 145 HB3 GLU 21 2HB GLU 21 0.259 9.697 -13.316 146 HG2 GLU 21 1HG GLU 21 0.988 10.296 -15.395 147 HG3 GLU 21 2HG GLU 21 1.929 11.660 -14.793 148 H GLY 22 H GLY 22 -0.209 13.204 -15.018 149 HA2 GLY 22 1HA GLY 22 -3.011 12.336 -15.361 150 HA3 GLY 22 2HA GLY 22 -2.395 13.907 -15.853 151 H SER 23 H SER 23 -3.358 10.989 -16.985 152 HA SER 23 HA SER 23 -1.459 10.927 -19.216 153 HB2 SER 23 1HB SER 23 -3.675 8.943 -18.715 154 HB3 SER 23 2HB SER 23 -2.206 8.722 -19.666 155 HG SER 23 HG SER 23 -2.492 8.848 -16.859 156 H GLY 24 H GLY 24 -2.691 13.105 -19.660 157 HA2 GLY 24 1HA GLY 24 -4.837 12.458 -21.583 158 HA3 GLY 24 2HA GLY 24 -4.943 13.859 -20.526 159 H ALA 25 H ALA 25 -3.271 15.526 -20.774 160 HA ALA 25 HA ALA 25 -1.484 15.622 -22.929 161 HB1 ALA 25 1HB ALA 25 -2.597 16.474 -24.690 162 HB2 ALA 25 2HB ALA 25 -3.995 15.721 -23.920 163 HB3 ALA 25 3HB ALA 25 -3.674 17.438 -23.679 164 H GLU 26 H GLU 26 -0.117 17.291 -22.642 165 HA GLU 26 HA GLU 26 -0.297 18.912 -20.360 166 HB2 GLU 26 1HB GLU 26 1.745 19.846 -21.015 167 HB3 GLU 26 2HB GLU 26 1.780 18.235 -21.719 168 HG2 GLU 26 1HG GLU 26 1.108 20.789 -23.161 169 HG3 GLU 26 2HG GLU 26 2.616 19.884 -23.283 170 H ALA 27 H ALA 27 -0.723 21.102 -20.084 171 HA ALA 27 HA ALA 27 -2.864 22.184 -21.493 172 HB1 ALA 27 1HB ALA 27 -2.781 23.885 -20.006 173 HB2 ALA 27 2HB ALA 27 -1.669 22.797 -19.174 174 HB3 ALA 27 3HB ALA 27 -1.039 24.101 -20.182 175 H ARG 28 H ARG 28 -3.067 23.660 -23.131 176 HA ARG 28 HA ARG 28 -0.670 24.077 -24.762 177 HB2 ARG 28 1HB ARG 28 -3.617 24.161 -25.365 178 HB3 ARG 28 2HB ARG 28 -2.431 24.823 -26.481 179 HG2 ARG 28 1HG ARG 28 -2.135 22.024 -25.488 180 HG3 ARG 28 2HG ARG 28 -3.278 22.391 -26.781 181 HD2 ARG 28 1HD ARG 28 -0.534 23.487 -27.029 182 HD3 ARG 28 2HD ARG 28 -0.735 21.749 -27.250 183 HE ARG 28 HE ARG 28 -2.618 23.270 -28.770 184 HH11 ARG 28 1HH1 ARG 28 0.656 22.087 -28.706 185 HH12 ARG 28 2HH1 ARG 28 0.832 22.098 -30.430 186 HH21 ARG 28 1HH2 ARG 28 -2.398 23.288 -31.041 187 HH22 ARG 28 2HH2 ARG 28 -0.906 22.782 -31.757 188 H ALA 29 H ALA 29 -0.264 26.146 -25.734 189 HA ALA 29 HA ALA 29 -0.913 28.337 -23.925 190 HB1 ALA 29 1HB ALA 29 1.177 28.950 -24.337 191 HB2 ALA 29 2HB ALA 29 1.346 27.631 -25.496 192 HB3 ALA 29 3HB ALA 29 0.768 29.208 -26.034 193 H GLY 30 H GLY 30 -1.942 30.223 -24.527 194 HA2 GLY 30 1HA GLY 30 -3.178 31.671 -25.842 195 HA3 GLY 30 2HA GLY 30 -2.728 30.718 -27.248 196 H GLN 31 H GLN 31 -3.911 28.601 -25.021 197 HA GLN 31 HA GLN 31 -6.637 28.803 -26.120 198 HB2 GLN 31 1HB GLN 31 -5.073 26.819 -26.785 199 HB3 GLN 31 2HB GLN 31 -5.463 26.209 -25.182 200 HG2 GLN 31 1HG GLN 31 -7.752 26.020 -25.698 201 HG3 GLN 31 2HG GLN 31 -7.578 26.982 -27.165 202 HE21 GLN 31 2HE2 GLN 31 -6.123 24.073 -25.735 203 HE22 GLN 31 1HE2 GLN 31 -6.189 23.125 -27.178 204 H THR 32 H THR 32 -8.372 28.127 -24.759 205 HA THR 32 HA THR 32 -7.957 28.855 -22.000 206 HB THR 32 HB THR 32 -10.561 27.768 -22.997 207 HG1 THR 32 HG1 THR 32 -10.201 29.168 -24.630 208 HG21 THR 32 3HG2 THR 32 -9.905 28.726 -20.615 209 HG22 THR 32 1HG2 THR 32 -11.492 29.025 -21.324 210 HG23 THR 32 2HG2 THR 32 -10.240 30.264 -21.409 211 H VAL 33 H VAL 33 -8.007 27.555 -20.234 212 HA VAL 33 HA VAL 33 -8.593 24.704 -20.609 213 HB VAL 33 HB VAL 33 -6.645 24.019 -19.358 214 HG11 VAL 33 1HG1 VAL 33 -5.288 24.054 -21.144 215 HG12 VAL 33 2HG1 VAL 33 -6.607 24.926 -21.927 216 HG13 VAL 33 3HG1 VAL 33 -5.261 25.815 -21.213 217 HG21 VAL 33 3HG2 VAL 33 -6.508 26.859 -18.722 218 HG22 VAL 33 1HG2 VAL 33 -5.852 25.470 -17.855 219 HG23 VAL 33 2HG2 VAL 33 -4.950 26.181 -19.193 220 H SER 34 H SER 34 -9.632 23.750 -18.934 221 HA SER 34 HA SER 34 -10.364 25.487 -16.690 222 HB2 SER 34 1HB SER 34 -11.724 22.896 -16.876 223 HB3 SER 34 2HB SER 34 -12.403 24.518 -16.736 224 HG SER 34 HG SER 34 -12.136 22.969 -18.924 225 H VAL 35 H VAL 35 -9.373 25.227 -14.813 226 HA VAL 35 HA VAL 35 -8.657 22.541 -13.912 227 HB VAL 35 HB VAL 35 -6.419 23.059 -13.356 228 HG11 VAL 35 1HG1 VAL 35 -7.042 22.679 -15.827 229 HG12 VAL 35 2HG1 VAL 35 -6.663 24.391 -16.030 230 HG13 VAL 35 3HG1 VAL 35 -5.426 23.275 -15.450 231 HG21 VAL 35 3HG2 VAL 35 -6.661 25.279 -12.493 232 HG22 VAL 35 1HG2 VAL 35 -5.449 25.321 -13.774 233 HG23 VAL 35 2HG2 VAL 35 -7.082 25.908 -14.086 234 H HIS 36 H HIS 36 -8.253 22.410 -11.617 235 HA HIS 36 HA HIS 36 -9.743 24.462 -10.147 236 HB2 HIS 36 1HB HIS 36 -9.274 21.553 -9.785 237 HB3 HIS 36 2HB HIS 36 -9.418 22.519 -8.319 238 HD1 HIS 36 HD1 HIS 36 -11.635 24.464 -9.226 239 HD2 HIS 36 HD2 HIS 36 -11.721 20.356 -9.843 240 HE1 HIS 36 HE1 HIS 36 -14.064 23.876 -9.501 241 H TYR 37 H TYR 37 -8.811 25.747 -8.674 242 HA TYR 37 HA TYR 37 -5.995 25.215 -7.984 243 HB2 TYR 37 1HB TYR 37 -5.631 27.606 -7.873 244 HB3 TYR 37 2HB TYR 37 -6.330 27.204 -9.438 245 HD1 TYR 37 HD1 TYR 37 -7.062 28.664 -6.121 246 HD2 TYR 37 HD2 TYR 37 -8.425 28.099 -10.112 247 HE1 TYR 37 HE1 TYR 37 -8.846 30.313 -5.739 248 HE2 TYR 37 HE2 TYR 37 -10.212 29.747 -9.741 249 HH TYR 37 HH TYR 37 -10.362 31.906 -7.848 250 H THR 38 H THR 38 -5.369 25.359 -5.878 251 HA THR 38 HA THR 38 -7.382 26.164 -3.894 252 HB THR 38 HB THR 38 -5.765 23.994 -2.884 253 HG1 THR 38 HG1 THR 38 -7.533 23.160 -4.920 254 HG21 THR 38 3HG2 THR 38 -8.565 24.870 -2.961 255 HG22 THR 38 1HG2 THR 38 -7.640 24.145 -1.646 256 HG23 THR 38 2HG2 THR 38 -8.349 23.121 -2.895 257 H GLY 39 H GLY 39 -6.561 27.750 -2.703 258 HA2 GLY 39 1HA GLY 39 -3.669 28.058 -2.490 259 HA3 GLY 39 2HA GLY 39 -4.882 29.231 -1.998 260 H TRP 40 H TRP 40 -2.506 27.466 -0.790 261 HA TRP 40 HA TRP 40 -3.869 27.125 1.796 262 HB2 TRP 40 1HB TRP 40 -2.018 25.222 0.385 263 HB3 TRP 40 2HB TRP 40 -2.164 25.203 2.140 264 HD1 TRP 40 HD1 TRP 40 -5.233 25.488 2.543 265 HE1 TRP 40 HE1 TRP 40 -6.844 23.628 1.789 266 HE3 TRP 40 HE3 TRP 40 -2.250 23.181 -0.909 267 HZ2 TRP 40 HZ2 TRP 40 -6.850 21.468 -0.029 268 HZ3 TRP 40 HZ3 TRP 40 -3.134 21.224 -2.111 269 HH2 TRP 40 HH2 TRP 40 -5.386 20.386 -1.678 270 H LEU 41 H LEU 41 -2.805 27.884 3.557 271 HA LEU 41 HA LEU 41 -0.582 29.632 3.124 272 HB2 LEU 41 1HB LEU 41 -2.332 28.896 5.396 273 HB3 LEU 41 2HB LEU 41 -0.744 29.552 5.789 274 HG LEU 41 HG LEU 41 -2.566 31.008 3.909 275 HD11 LEU 41 1HD1 LEU 41 -3.284 32.316 5.957 276 HD12 LEU 41 2HD1 LEU 41 -2.698 30.953 6.910 277 HD13 LEU 41 3HD1 LEU 41 -4.005 30.721 5.749 278 HD21 LEU 41 3HD2 LEU 41 -0.517 32.041 3.892 279 HD22 LEU 41 1HD2 LEU 41 -0.166 31.616 5.568 280 HD23 LEU 41 2HD2 LEU 41 -1.312 32.908 5.208 281 H THR 42 H THR 42 1.224 29.513 4.927 282 HA THR 42 HA THR 42 2.834 27.295 4.310 283 HB THR 42 HB THR 42 4.386 28.125 6.003 284 HG1 THR 42 HG1 THR 42 3.786 29.660 7.466 285 HG21 THR 42 3HG2 THR 42 4.573 29.312 3.986 286 HG22 THR 42 1HG2 THR 42 4.466 30.566 5.221 287 HG23 THR 42 2HG2 THR 42 3.052 30.166 4.245 288 H ASP 43 H ASP 43 0.523 27.849 6.843 289 HA ASP 43 HA ASP 43 1.425 25.538 8.370 290 HB2 ASP 43 1HB ASP 43 -0.533 27.748 8.822 291 HB3 ASP 43 2HB ASP 43 -0.754 26.239 9.704 292 H GLY 44 H GLY 44 -0.856 26.333 5.936 293 HA2 GLY 44 1HA GLY 44 -1.771 24.394 4.724 294 HA3 GLY 44 2HA GLY 44 -2.125 23.688 6.294 295 H GLN 45 H GLN 45 -2.718 26.955 6.444 296 HA GLN 45 HA GLN 45 -5.536 26.573 6.621 297 HB2 GLN 45 1HB GLN 45 -3.653 28.844 6.951 298 HB3 GLN 45 2HB GLN 45 -5.327 29.246 6.594 299 HG2 GLN 45 1HG GLN 45 -6.074 28.020 8.537 300 HG3 GLN 45 2HG GLN 45 -4.423 27.499 8.872 301 HE21 GLN 45 2HE2 GLN 45 -6.434 30.383 8.522 302 HE22 GLN 45 1HE2 GLN 45 -5.573 31.340 9.673 303 H LYS 46 H LYS 46 -6.933 26.507 5.003 304 HA LYS 46 HA LYS 46 -6.182 27.221 2.333 305 HB2 LYS 46 1HB LYS 46 -7.699 25.318 2.902 306 HB3 LYS 46 2HB LYS 46 -8.919 26.488 3.385 307 HG2 LYS 46 1HG LYS 46 -9.310 27.176 1.217 308 HG3 LYS 46 2HG LYS 46 -7.738 26.613 0.646 309 HD2 LYS 46 1HD LYS 46 -9.494 25.163 -0.188 310 HD3 LYS 46 2HD LYS 46 -8.482 24.286 0.963 311 HE2 LYS 46 1HE LYS 46 -10.125 24.268 2.590 312 HE3 LYS 46 2HE LYS 46 -10.955 25.668 1.913 313 HZ1 LYS 46 3HZ LYS 46 -11.114 23.806 -0.061 314 HZ2 LYS 46 1HZ LYS 46 -12.346 24.191 1.033 315 HZ3 LYS 46 2HZ LYS 46 -11.317 22.884 1.343 316 H PHE 47 H PHE 47 -6.465 29.095 1.313 317 HA PHE 47 HA PHE 47 -8.341 31.049 2.470 318 HB2 PHE 47 1HB PHE 47 -6.753 32.834 1.756 319 HB3 PHE 47 2HB PHE 47 -6.104 31.782 3.010 320 HD1 PHE 47 HD1 PHE 47 -6.043 32.454 -0.629 321 HD2 PHE 47 HD2 PHE 47 -4.111 30.599 2.679 322 HE1 PHE 47 HE1 PHE 47 -4.076 32.002 -2.036 323 HE2 PHE 47 HE2 PHE 47 -2.141 30.145 1.278 324 HZ PHE 47 HZ PHE 47 -2.120 30.848 -1.082 325 H ASP 48 H ASP 48 -8.339 29.061 0.137 326 HA ASP 48 HA ASP 48 -9.945 30.533 -1.612 327 HB2 ASP 48 1HB ASP 48 -7.317 31.198 -2.031 328 HB3 ASP 48 2HB ASP 48 -7.560 29.911 -3.209 329 H SER 49 H SER 49 -11.244 29.066 -2.478 330 HA SER 49 HA SER 49 -10.135 26.465 -3.274 331 HB2 SER 49 1HB SER 49 -11.138 25.616 -1.419 332 HB3 SER 49 2HB SER 49 -12.217 27.000 -1.246 333 HG SER 49 HG SER 49 -13.691 25.994 -2.375 334 H SER 50 H SER 50 -10.348 26.600 -5.427 335 HA SER 50 HA SER 50 -12.251 28.031 -6.854 336 HB2 SER 50 1HB SER 50 -10.164 27.084 -7.821 337 HB3 SER 50 2HB SER 50 -10.886 25.477 -7.742 338 HG SER 50 HG SER 50 -12.540 26.266 -9.142 339 H LYS 51 H LYS 51 -12.491 24.944 -5.303 340 HA LYS 51 HA LYS 51 -14.642 23.830 -6.706 341 HB2 LYS 51 1HB LYS 51 -14.006 23.548 -3.763 342 HB3 LYS 51 2HB LYS 51 -15.017 22.465 -4.710 343 HG2 LYS 51 1HG LYS 51 -12.108 22.958 -5.294 344 HG3 LYS 51 2HG LYS 51 -12.698 21.645 -4.272 345 HD2 LYS 51 1HD LYS 51 -13.941 21.918 -6.945 346 HD3 LYS 51 2HD LYS 51 -12.264 21.369 -6.900 347 HE2 LYS 51 1HE LYS 51 -12.791 19.409 -5.854 348 HE3 LYS 51 2HE LYS 51 -14.191 20.097 -5.033 349 HZ1 LYS 51 3HZ LYS 51 -14.452 20.000 -7.898 350 HZ2 LYS 51 1HZ LYS 51 -15.539 19.515 -6.695 351 HZ3 LYS 51 2HZ LYS 51 -14.298 18.474 -7.184 352 H ASP 52 H ASP 52 -14.512 26.500 -4.565 353 HA ASP 52 HA ASP 52 -17.049 26.516 -3.435 354 HB2 ASP 52 1HB ASP 52 -15.392 28.126 -2.745 355 HB3 ASP 52 2HB ASP 52 -15.328 28.822 -4.362 356 H ARG 53 H ARG 53 -15.991 27.686 -6.606 357 HA ARG 53 HA ARG 53 -18.548 28.696 -7.357 358 HB2 ARG 53 1HB ARG 53 -16.177 29.241 -8.309 359 HB3 ARG 53 2HB ARG 53 -16.472 27.854 -9.349 360 HG2 ARG 53 1HG ARG 53 -17.232 29.551 -10.674 361 HG3 ARG 53 2HG ARG 53 -18.723 29.093 -9.848 362 HD2 ARG 53 1HD ARG 53 -16.985 31.176 -8.619 363 HD3 ARG 53 2HD ARG 53 -17.967 31.612 -10.018 364 HE ARG 53 HE ARG 53 -19.588 30.286 -8.155 365 HH11 ARG 53 1HH1 ARG 53 -17.857 33.282 -8.533 366 HH12 ARG 53 2HH1 ARG 53 -18.934 34.184 -7.519 367 HH21 ARG 53 1HH2 ARG 53 -21.013 31.462 -6.817 368 HH22 ARG 53 2HH2 ARG 53 -20.729 33.147 -6.542 369 H ASN 54 H ASN 54 -17.387 25.583 -7.005 370 HA ASN 54 HA ASN 54 -18.224 23.532 -7.524 371 HB2 ASN 54 1HB ASN 54 -20.643 24.887 -8.704 372 HB3 ASN 54 2HB ASN 54 -20.541 23.306 -7.935 373 HD21 ASN 54 2HD2 ASN 54 -21.367 26.503 -7.524 374 HD22 ASN 54 1HD2 ASN 54 -21.462 26.535 -5.799 375 H ASP 55 H ASP 55 -16.768 25.272 -9.509 376 HA ASP 55 HA ASP 55 -17.056 23.474 -11.752 377 HB2 ASP 55 1HB ASP 55 -18.069 26.247 -11.819 378 HB3 ASP 55 2HB ASP 55 -17.063 25.780 -13.187 379 HA PRO 56 HA PRO 56 -12.739 24.172 -12.112 380 HB2 PRO 56 1HB PRO 56 -12.352 23.749 -14.765 381 HB3 PRO 56 2HB PRO 56 -12.706 22.445 -13.626 382 HG2 PRO 56 1HG PRO 56 -14.551 23.877 -15.499 383 HG3 PRO 56 2HG PRO 56 -14.444 22.144 -15.141 384 HD2 PRO 56 1HD PRO 56 -16.330 23.746 -14.041 385 HD3 PRO 56 2HD PRO 56 -15.651 22.345 -13.187 386 H PHE 57 H PHE 57 -11.290 25.785 -12.517 387 HA PHE 57 HA PHE 57 -12.330 28.295 -13.448 388 HB2 PHE 57 1HB PHE 57 -10.783 28.247 -11.566 389 HB3 PHE 57 2HB PHE 57 -9.547 27.500 -12.571 390 HD1 PHE 57 HD2 PHE 57 -11.820 30.404 -13.123 391 HD2 PHE 57 HD1 PHE 57 -7.817 28.981 -12.859 392 HE1 PHE 57 HE2 PHE 57 -10.990 32.633 -13.750 393 HE2 PHE 57 HE1 PHE 57 -6.981 31.209 -13.485 394 HZ PHE 57 HZ PHE 57 -8.568 33.038 -13.933 395 H ALA 58 H ALA 58 -12.631 28.523 -15.578 396 HA ALA 58 HA ALA 58 -10.721 27.392 -17.464 397 HB1 ALA 58 1HB ALA 58 -12.429 27.292 -18.890 398 HB2 ALA 58 2HB ALA 58 -13.460 27.749 -17.533 399 HB3 ALA 58 3HB ALA 58 -12.846 28.987 -18.630 400 H PHE 59 H PHE 59 -8.961 28.544 -17.901 401 HA PHE 59 HA PHE 59 -9.268 31.387 -18.530 402 HB2 PHE 59 1HB PHE 59 -7.420 32.064 -17.192 403 HB3 PHE 59 2HB PHE 59 -8.446 31.082 -16.150 404 HD1 PHE 59 HD2 PHE 59 -7.787 28.731 -15.649 405 HD2 PHE 59 HD1 PHE 59 -5.197 31.447 -17.657 406 HE1 PHE 59 HE2 PHE 59 -5.867 27.286 -15.120 407 HE2 PHE 59 HE1 PHE 59 -3.273 30.006 -17.132 408 HZ PHE 59 HZ PHE 59 -3.606 27.923 -15.860 409 H VAL 60 H VAL 60 -7.591 32.243 -19.882 410 HA VAL 60 HA VAL 60 -6.599 30.285 -21.757 411 HB VAL 60 HB VAL 60 -6.193 33.278 -21.759 412 HG11 VAL 60 1HG1 VAL 60 -4.977 31.301 -23.291 413 HG12 VAL 60 2HG1 VAL 60 -6.243 31.960 -24.329 414 HG13 VAL 60 3HG1 VAL 60 -5.023 33.029 -23.636 415 HG21 VAL 60 3HG2 VAL 60 -8.018 32.821 -23.692 416 HG22 VAL 60 1HG2 VAL 60 -8.479 31.584 -22.523 417 HG23 VAL 60 2HG2 VAL 60 -8.433 33.280 -22.040 418 H LEU 61 H LEU 61 -4.666 29.364 -21.676 419 HA LEU 61 HA LEU 61 -2.723 30.133 -19.726 420 HB2 LEU 61 1HB LEU 61 -2.802 27.847 -20.118 421 HB3 LEU 61 2HB LEU 61 -2.870 28.051 -21.867 422 HG LEU 61 HG LEU 61 -0.533 28.542 -21.970 423 HD11 LEU 61 1HD1 LEU 61 0.376 29.663 -20.278 424 HD12 LEU 61 2HD1 LEU 61 0.503 28.118 -19.438 425 HD13 LEU 61 3HD1 LEU 61 -0.894 29.158 -19.163 426 HD21 LEU 61 3HD2 LEU 61 -0.508 26.292 -22.050 427 HD22 LEU 61 1HD2 LEU 61 -1.473 26.124 -20.583 428 HD23 LEU 61 2HD2 LEU 61 0.259 26.439 -20.468 429 H GLY 62 H GLY 62 -1.061 31.491 -19.929 430 HA2 GLY 62 1HA GLY 62 0.637 32.714 -20.913 431 HA3 GLY 62 2HA GLY 62 0.282 31.910 -22.434 432 H GLY 63 H GLY 63 -2.122 33.648 -20.562 433 HA2 GLY 63 1HA GLY 63 -2.376 35.531 -22.809 434 HA3 GLY 63 2HA GLY 63 -3.644 35.141 -21.656 435 H GLY 64 H GLY 64 -2.107 35.419 -19.283 436 HA2 GLY 64 1HA GLY 64 -0.669 37.218 -18.341 437 HA3 GLY 64 2HA GLY 64 -1.593 38.330 -19.340 438 H MET 65 H MET 65 -3.421 35.800 -17.971 439 HA MET 65 HA MET 65 -4.514 37.682 -15.990 440 HB2 MET 65 1HB MET 65 -5.743 35.468 -17.597 441 HB3 MET 65 2HB MET 65 -6.487 35.977 -16.087 442 HG2 MET 65 1HG MET 65 -7.620 37.302 -17.537 443 HG3 MET 65 2HG MET 65 -6.260 38.362 -17.174 444 HE1 MET 65 3HE MET 65 -7.780 36.870 -20.990 445 HE2 MET 65 1HE MET 65 -8.492 37.162 -19.403 446 HE3 MET 65 2HE MET 65 -8.016 38.523 -20.418 447 H VAL 66 H VAL 66 -2.182 35.805 -15.722 448 HA VAL 66 HA VAL 66 -3.014 34.650 -13.180 449 HB VAL 66 HB VAL 66 -2.113 32.469 -13.608 450 HG11 VAL 66 1HG1 VAL 66 -4.463 33.066 -14.374 451 HG12 VAL 66 2HG1 VAL 66 -3.808 33.085 -16.012 452 HG13 VAL 66 3HG1 VAL 66 -3.753 31.604 -15.056 453 HG21 VAL 66 3HG2 VAL 66 -1.231 33.671 -16.212 454 HG22 VAL 66 1HG2 VAL 66 -0.276 32.803 -15.009 455 HG23 VAL 66 2HG2 VAL 66 -1.422 31.927 -16.025 456 H ILE 67 H ILE 67 -0.915 33.481 -12.227 457 HA ILE 67 HA ILE 67 1.163 35.536 -12.294 458 HB ILE 67 HB ILE 67 1.910 34.744 -10.202 459 HG12 ILE 67 1HG1 ILE 67 0.196 32.300 -10.691 460 HG13 ILE 67 2HG1 ILE 67 1.955 32.360 -10.672 461 HG21 ILE 67 1HG2 ILE 67 -0.848 34.173 -9.509 462 HG22 ILE 67 2HG2 ILE 67 0.173 35.535 -9.052 463 HG23 ILE 67 3HG2 ILE 67 -0.701 35.564 -10.583 464 HD11 ILE 67 3HD1 ILE 67 1.212 31.421 -8.617 465 HD12 ILE 67 1HD1 ILE 67 1.832 33.038 -8.282 466 HD13 ILE 67 2HD1 ILE 67 0.092 32.757 -8.348 467 H LYS 68 H LYS 68 3.450 34.786 -12.081 468 HA LYS 68 HA LYS 68 4.299 33.376 -14.279 469 HB2 LYS 68 1HB LYS 68 5.580 34.004 -11.647 470 HB3 LYS 68 2HB LYS 68 6.420 32.961 -12.787 471 HG2 LYS 68 1HG LYS 68 6.775 34.646 -14.286 472 HG3 LYS 68 2HG LYS 68 5.352 35.554 -13.770 473 HD2 LYS 68 1HD LYS 68 7.650 35.198 -11.891 474 HD3 LYS 68 2HD LYS 68 7.741 36.415 -13.167 475 HE2 LYS 68 1HE LYS 68 5.454 37.197 -12.307 476 HE3 LYS 68 2HE LYS 68 5.808 36.229 -10.878 477 HZ1 LYS 68 3HZ LYS 68 6.760 38.117 -10.173 478 HZ2 LYS 68 1HZ LYS 68 6.947 38.750 -11.730 479 HZ3 LYS 68 2HZ LYS 68 8.066 37.632 -11.133 480 H GLY 69 H GLY 69 4.136 32.115 -10.942 481 HA2 GLY 69 1HA GLY 69 4.888 29.498 -11.471 482 HA3 GLY 69 2HA GLY 69 3.825 29.980 -10.156 483 H TRP 70 H TRP 70 1.862 31.077 -12.130 484 HA TRP 70 HA TRP 70 0.322 28.689 -12.423 485 HB2 TRP 70 1HB TRP 70 -0.156 31.502 -12.489 486 HB3 TRP 70 2HB TRP 70 -0.800 30.802 -13.971 487 HD1 TRP 70 HD1 TRP 70 -3.178 29.878 -13.783 488 HE1 TRP 70 HE1 TRP 70 -4.729 29.154 -11.860 489 HE3 TRP 70 HE3 TRP 70 0.084 30.376 -9.878 490 HZ2 TRP 70 HZ2 TRP 70 -4.588 28.837 -9.059 491 HZ3 TRP 70 HZ3 TRP 70 -0.704 29.843 -7.608 492 HH2 TRP 70 HH2 TRP 70 -2.992 29.090 -7.209 493 H ASP 71 H ASP 71 1.534 31.038 -14.823 494 HA ASP 71 HA ASP 71 0.868 29.624 -17.109 495 HB2 ASP 71 1HB ASP 71 1.579 31.844 -17.424 496 HB3 ASP 71 2HB ASP 71 3.069 31.588 -16.520 497 H GLU 72 H GLU 72 3.879 29.494 -15.227 498 HA GLU 72 HA GLU 72 5.134 27.565 -16.888 499 HB2 GLU 72 1HB GLU 72 5.865 29.135 -14.684 500 HB3 GLU 72 2HB GLU 72 6.057 27.471 -14.150 501 HG2 GLU 72 1HG GLU 72 7.290 28.668 -16.621 502 HG3 GLU 72 2HG GLU 72 8.118 28.383 -15.092 503 H GLY 73 H GLY 73 3.212 27.353 -13.928 504 HA2 GLY 73 1HA GLY 73 3.591 24.611 -13.427 505 HA3 GLY 73 2HA GLY 73 2.222 25.568 -12.880 506 H VAL 74 H VAL 74 0.889 26.243 -15.085 507 HA VAL 74 HA VAL 74 -0.395 23.826 -15.832 508 HB VAL 74 HB VAL 74 -1.780 25.204 -17.300 509 HG11 VAL 74 1HG1 VAL 74 -1.775 27.092 -15.135 510 HG12 VAL 74 2HG1 VAL 74 -2.940 25.820 -15.508 511 HG13 VAL 74 3HG1 VAL 74 -1.523 25.459 -14.521 512 HG21 VAL 74 3HG2 VAL 74 0.424 27.155 -16.885 513 HG22 VAL 74 1HG2 VAL 74 -0.506 26.790 -18.338 514 HG23 VAL 74 2HG2 VAL 74 -1.216 27.778 -17.061 515 H GLN 75 H GLN 75 2.011 25.866 -17.358 516 HA GLN 75 HA GLN 75 1.891 25.019 -19.979 517 HB2 GLN 75 1HB GLN 75 3.965 26.148 -18.224 518 HB3 GLN 75 2HB GLN 75 4.588 25.236 -19.593 519 HG2 GLN 75 1HG GLN 75 3.367 26.635 -21.132 520 HG3 GLN 75 2HG GLN 75 2.615 27.500 -19.792 521 HE21 GLN 75 2HE2 GLN 75 4.168 28.624 -21.910 522 HE22 GLN 75 1HE2 GLN 75 5.550 29.370 -21.191 523 H GLY 76 H GLY 76 3.019 23.301 -17.175 524 HA2 GLY 76 1HA GLY 76 4.002 21.118 -18.897 525 HA3 GLY 76 2HA GLY 76 4.457 21.359 -17.216 526 H MET 77 H MET 77 1.765 21.871 -16.288 527 HA MET 77 HA MET 77 0.982 19.342 -15.514 528 HB2 MET 77 1HB MET 77 0.168 21.289 -14.357 529 HB3 MET 77 2HB MET 77 -0.666 21.857 -15.798 530 HG2 MET 77 1HG MET 77 -2.434 20.517 -15.467 531 HG3 MET 77 2HG MET 77 -1.445 19.182 -14.879 532 HE1 MET 77 3HE MET 77 -0.694 20.247 -11.237 533 HE2 MET 77 1HE MET 77 -1.149 18.741 -12.034 534 HE3 MET 77 2HE MET 77 0.085 19.779 -12.749 535 H LYS 78 H LYS 78 -0.606 17.891 -16.178 536 HA LYS 78 HA LYS 78 -1.516 18.233 -18.961 537 HB2 LYS 78 1HB LYS 78 -0.794 15.697 -17.483 538 HB3 LYS 78 2HB LYS 78 -1.503 15.743 -19.092 539 HG2 LYS 78 1HG LYS 78 0.578 17.313 -19.560 540 HG3 LYS 78 2HG LYS 78 1.249 16.399 -18.207 541 HD2 LYS 78 1HD LYS 78 0.365 14.333 -19.540 542 HD3 LYS 78 2HD LYS 78 0.398 15.446 -20.910 543 HE2 LYS 78 1HE LYS 78 2.766 15.906 -20.463 544 HE3 LYS 78 2HE LYS 78 2.725 14.777 -19.109 545 HZ1 LYS 78 3HZ LYS 78 1.762 13.310 -21.174 546 HZ2 LYS 78 1HZ LYS 78 3.355 13.270 -20.604 547 HZ3 LYS 78 2HZ LYS 78 2.953 14.251 -21.922 548 H VAL 79 H VAL 79 -3.559 17.222 -19.513 549 HA VAL 79 HA VAL 79 -5.653 17.914 -17.838 550 HB VAL 79 HB VAL 79 -5.665 15.806 -20.002 551 HG11 VAL 79 1HG1 VAL 79 -8.112 16.413 -20.120 552 HG12 VAL 79 2HG1 VAL 79 -7.618 15.496 -18.695 553 HG13 VAL 79 3HG1 VAL 79 -7.896 17.233 -18.574 554 HG21 VAL 79 3HG2 VAL 79 -5.787 17.436 -21.539 555 HG22 VAL 79 1HG2 VAL 79 -6.844 18.432 -20.538 556 HG23 VAL 79 2HG2 VAL 79 -5.100 18.462 -20.280 557 H GLY 80 H GLY 80 -6.465 17.057 -16.043 558 HA2 GLY 80 1HA GLY 80 -7.236 15.396 -14.602 559 HA3 GLY 80 2HA GLY 80 -6.520 14.186 -15.655 560 H GLY 81 H GLY 81 -4.181 16.441 -15.156 561 HA2 GLY 81 1HA GLY 81 -2.872 14.735 -13.183 562 HA3 GLY 81 2HA GLY 81 -2.108 15.995 -14.141 563 H VAL 82 H VAL 82 -2.020 15.443 -11.236 564 HA VAL 82 HA VAL 82 -2.925 18.092 -10.320 565 HB VAL 82 HB VAL 82 -2.847 15.669 -8.531 566 HG11 VAL 82 1HG1 VAL 82 -4.147 17.015 -7.027 567 HG12 VAL 82 2HG1 VAL 82 -2.721 17.935 -7.512 568 HG13 VAL 82 3HG1 VAL 82 -4.292 18.298 -8.229 569 HG21 VAL 82 3HG2 VAL 82 -4.660 14.906 -9.584 570 HG22 VAL 82 1HG2 VAL 82 -5.512 16.308 -8.936 571 HG23 VAL 82 2HG2 VAL 82 -4.806 16.373 -10.551 572 H ARG 83 H ARG 83 -1.313 19.326 -9.634 573 HA ARG 83 HA ARG 83 0.992 18.088 -8.318 574 HB2 ARG 83 1HB ARG 83 1.185 20.070 -10.594 575 HB3 ARG 83 2HB ARG 83 2.539 19.517 -9.617 576 HG2 ARG 83 1HG ARG 83 1.238 17.213 -10.587 577 HG3 ARG 83 2HG ARG 83 1.398 18.332 -11.943 578 HD2 ARG 83 1HD ARG 83 3.757 17.983 -10.184 579 HD3 ARG 83 2HD ARG 83 3.329 16.632 -11.232 580 HE ARG 83 HE ARG 83 3.305 18.791 -12.889 581 HH11 ARG 83 1HH1 ARG 83 5.640 17.416 -10.703 582 HH12 ARG 83 2HH1 ARG 83 7.008 17.949 -11.622 583 HH21 ARG 83 1HH2 ARG 83 5.099 19.498 -14.108 584 HH22 ARG 83 2HH2 ARG 83 6.699 19.134 -13.558 585 H ARG 84 H ARG 84 1.894 19.298 -6.706 586 HA ARG 84 HA ARG 84 0.369 21.612 -5.843 587 HB2 ARG 84 1HB ARG 84 1.407 19.574 -4.442 588 HB3 ARG 84 2HB ARG 84 2.750 20.702 -4.320 589 HG2 ARG 84 1HG ARG 84 1.527 22.236 -3.105 590 HG3 ARG 84 2HG ARG 84 -0.020 21.610 -3.679 591 HD2 ARG 84 1HD ARG 84 0.126 20.897 -1.450 592 HD3 ARG 84 2HD ARG 84 0.559 19.480 -2.406 593 HE ARG 84 HE ARG 84 2.938 20.719 -1.847 594 HH11 ARG 84 1HH1 ARG 84 0.299 19.431 0.021 595 HH12 ARG 84 2HH1 ARG 84 1.292 19.007 1.375 596 HH21 ARG 84 1HH2 ARG 84 4.257 20.166 -0.071 597 HH22 ARG 84 2HH2 ARG 84 3.544 19.427 1.323 598 H LEU 85 H LEU 85 0.903 23.434 -6.902 599 HA LEU 85 HA LEU 85 3.668 24.020 -7.556 600 HB2 LEU 85 1HB LEU 85 1.991 24.549 -9.199 601 HB3 LEU 85 2HB LEU 85 1.105 25.531 -8.034 602 HG LEU 85 HG LEU 85 3.334 26.924 -7.994 603 HD11 LEU 85 1HD1 LEU 85 3.458 25.477 -10.631 604 HD12 LEU 85 2HD1 LEU 85 4.688 25.530 -9.369 605 HD13 LEU 85 3HD1 LEU 85 4.314 26.982 -10.297 606 HD21 LEU 85 3HD2 LEU 85 1.034 27.610 -8.754 607 HD22 LEU 85 1HD2 LEU 85 1.510 27.121 -10.381 608 HD23 LEU 85 2HD2 LEU 85 2.375 28.422 -9.563 609 H THR 86 H THR 86 4.979 24.973 -6.161 610 HA THR 86 HA THR 86 3.847 26.537 -3.959 611 HB THR 86 HB THR 86 6.757 26.121 -3.985 612 HG1 THR 86 HG1 THR 86 6.731 24.018 -4.184 613 HG21 THR 86 3HG2 THR 86 4.816 25.238 -1.877 614 HG22 THR 86 1HG2 THR 86 5.177 26.949 -2.104 615 HG23 THR 86 2HG2 THR 86 6.470 25.822 -1.693 616 H ILE 87 H ILE 87 3.750 28.666 -4.177 617 HA ILE 87 HA ILE 87 5.759 30.004 -5.866 618 HB ILE 87 HB ILE 87 3.033 31.080 -5.152 619 HG12 ILE 87 1HG1 ILE 87 2.775 30.536 -7.752 620 HG13 ILE 87 2HG1 ILE 87 3.929 29.270 -7.344 621 HG21 ILE 87 1HG2 ILE 87 4.728 31.919 -7.470 622 HG22 ILE 87 2HG2 ILE 87 3.450 32.806 -6.642 623 HG23 ILE 87 3HG2 ILE 87 5.015 32.583 -5.862 624 HD11 ILE 87 3HD1 ILE 87 2.053 28.108 -6.928 625 HD12 ILE 87 1HD1 ILE 87 2.155 28.921 -5.367 626 HD13 ILE 87 2HD1 ILE 87 1.092 29.554 -6.624 627 HA PRO 88 HA PRO 88 7.222 31.930 -2.159 628 HB2 PRO 88 1HB PRO 88 8.794 33.798 -3.346 629 HB3 PRO 88 2HB PRO 88 9.245 32.092 -3.236 630 HG2 PRO 88 1HG PRO 88 8.049 33.591 -5.535 631 HG3 PRO 88 2HG PRO 88 9.356 32.393 -5.539 632 HD2 PRO 88 1HD PRO 88 6.813 31.776 -6.234 633 HD3 PRO 88 2HD PRO 88 7.896 30.612 -5.442 634 HA PRO 89 HA PRO 89 4.918 35.599 -1.408 635 HB2 PRO 89 1HB PRO 89 6.649 37.161 -0.017 636 HB3 PRO 89 2HB PRO 89 5.903 35.711 0.665 637 HG2 PRO 89 1HG PRO 89 8.635 36.063 -0.508 638 HG3 PRO 89 2HG PRO 89 8.150 35.186 0.955 639 HD2 PRO 89 1HD PRO 89 8.664 33.935 -1.391 640 HD3 PRO 89 2HD PRO 89 7.460 33.335 -0.232 641 H GLN 90 H GLN 90 7.612 35.682 -3.426 642 HA GLN 90 HA GLN 90 7.291 38.520 -4.071 643 HB2 GLN 90 1HB GLN 90 9.581 37.618 -3.728 644 HB3 GLN 90 2HB GLN 90 9.337 36.547 -5.101 645 HG2 GLN 90 1HG GLN 90 9.545 38.217 -6.625 646 HG3 GLN 90 2HG GLN 90 8.912 39.446 -5.532 647 HE21 GLN 90 2HE2 GLN 90 11.634 37.167 -5.451 648 HE22 GLN 90 1HE2 GLN 90 12.833 38.350 -5.066 649 H LEU 91 H LEU 91 7.023 35.306 -5.496 650 HA LEU 91 HA LEU 91 6.068 36.435 -8.010 651 HB2 LEU 91 1HB LEU 91 6.354 33.528 -7.291 652 HB3 LEU 91 2HB LEU 91 6.215 34.232 -8.900 653 HG LEU 91 HG LEU 91 8.571 34.719 -7.089 654 HD11 LEU 91 1HD1 LEU 91 9.009 32.953 -9.354 655 HD12 LEU 91 2HD1 LEU 91 7.900 32.274 -8.163 656 HD13 LEU 91 3HD1 LEU 91 9.514 32.788 -7.672 657 HD21 LEU 91 3HD2 LEU 91 8.916 36.293 -8.646 658 HD22 LEU 91 1HD2 LEU 91 7.748 35.584 -9.761 659 HD23 LEU 91 2HD2 LEU 91 9.390 34.945 -9.681 660 H GLY 92 H GLY 92 4.603 36.355 -5.307 661 HA2 GLY 92 1HA GLY 92 2.132 35.099 -6.335 662 HA3 GLY 92 2HA GLY 92 2.557 35.127 -4.630 663 H TYR 93 H TYR 93 1.480 36.572 -3.482 664 HA TYR 93 HA TYR 93 -0.237 38.485 -4.555 665 HB2 TYR 93 1HB TYR 93 0.992 38.190 -1.820 666 HB3 TYR 93 2HB TYR 93 -0.141 39.483 -2.195 667 HD1 TYR 93 HD2 TYR 93 -2.477 38.895 -2.893 668 HD2 TYR 93 HD1 TYR 93 0.238 35.986 -1.388 669 HE1 TYR 93 HE2 TYR 93 -4.361 37.382 -2.436 670 HE2 TYR 93 HE1 TYR 93 -1.638 34.464 -0.928 671 HH TYR 93 HH TYR 93 -4.840 35.450 -0.902 672 H GLY 94 H GLY 94 3.030 38.883 -3.207 673 HA2 GLY 94 1HA GLY 94 4.412 40.469 -4.612 674 HA3 GLY 94 2HA GLY 94 3.081 41.593 -4.380 675 H ALA 95 H ALA 95 5.173 42.762 -3.619 676 HA ALA 95 HA ALA 95 6.346 42.144 -1.151 677 HB1 ALA 95 1HB ALA 95 7.583 43.948 -1.569 678 HB2 ALA 95 2HB ALA 95 6.671 44.106 -3.070 679 HB3 ALA 95 3HB ALA 95 6.167 44.998 -1.635 680 H ARG 96 H ARG 96 3.315 43.638 -1.942 681 HA ARG 96 HA ARG 96 2.886 44.790 0.655 682 HB2 ARG 96 1HB ARG 96 1.857 45.701 -1.418 683 HB3 ARG 96 2HB ARG 96 0.885 44.241 -1.542 684 HG2 ARG 96 1HG ARG 96 -0.076 44.793 0.701 685 HG3 ARG 96 2HG ARG 96 0.768 46.340 0.608 686 HD2 ARG 96 1HD ARG 96 -0.418 46.737 -1.572 687 HD3 ARG 96 2HD ARG 96 -1.384 45.303 -1.226 688 HE ARG 96 HE ARG 96 -1.510 47.046 0.971 689 HH11 ARG 96 1HH1 ARG 96 -2.585 46.810 -2.332 690 HH12 ARG 96 2HH1 ARG 96 -3.996 47.784 -2.079 691 HH21 ARG 96 1HH2 ARG 96 -3.364 48.329 1.316 692 HH22 ARG 96 2HH2 ARG 96 -4.438 48.648 -0.004 693 H GLY 97 H GLY 97 1.355 42.091 -1.115 694 HA2 GLY 97 1HA GLY 97 0.538 40.082 -0.335 695 HA3 GLY 97 2HA GLY 97 1.309 40.428 1.207 696 H ALA 98 H ALA 98 -1.007 39.202 1.421 697 HA ALA 98 HA ALA 98 -3.251 40.988 1.512 698 HB1 ALA 98 1HB ALA 98 -2.763 38.134 2.085 699 HB2 ALA 98 2HB ALA 98 -4.095 38.893 2.958 700 HB3 ALA 98 3HB ALA 98 -4.074 38.907 1.195 701 H GLY 99 H GLY 99 -4.409 41.609 3.418 702 HA2 GLY 99 1HA GLY 99 -2.873 42.799 5.397 703 HA3 GLY 99 2HA GLY 99 -4.589 42.450 5.547 704 H GLY 100 H GLY 100 -5.165 40.219 6.230 705 HA2 GLY 100 1HA GLY 100 -3.156 39.227 8.155 706 HA3 GLY 100 2HA GLY 100 -4.892 39.174 8.426 707 H VAL 101 H VAL 101 -5.228 38.373 5.522 708 HA VAL 101 HA VAL 101 -5.518 35.634 5.879 709 HB VAL 101 HB VAL 101 -5.053 37.009 3.230 710 HG11 VAL 101 1HG1 VAL 101 -5.394 34.319 3.842 711 HG12 VAL 101 2HG1 VAL 101 -6.980 34.856 3.285 712 HG13 VAL 101 3HG1 VAL 101 -5.563 35.073 2.258 713 HG21 VAL 101 3HG2 VAL 101 -7.736 36.779 3.427 714 HG22 VAL 101 1HG2 VAL 101 -7.317 37.087 5.112 715 HG23 VAL 101 2HG2 VAL 101 -6.840 38.235 3.861 716 H ILE 102 H ILE 102 -2.982 37.294 3.993 717 HA ILE 102 HA ILE 102 -1.214 35.004 4.545 718 HB ILE 102 HB ILE 102 -1.795 36.353 1.952 719 HG12 ILE 102 1HG1 ILE 102 -0.918 33.725 1.587 720 HG13 ILE 102 2HG1 ILE 102 -1.833 33.684 3.091 721 HG21 ILE 102 1HG2 ILE 102 0.897 35.310 2.786 722 HG22 ILE 102 2HG2 ILE 102 0.403 35.421 1.098 723 HG23 ILE 102 3HG2 ILE 102 0.499 36.878 2.085 724 HD11 ILE 102 3HD1 ILE 102 -3.772 33.876 2.027 725 HD12 ILE 102 1HD1 ILE 102 -3.179 35.180 0.998 726 HD13 ILE 102 2HD1 ILE 102 -2.868 33.499 0.560 727 HA PRO 103 HA PRO 103 1.493 38.086 6.188 728 HB2 PRO 103 1HB PRO 103 3.736 36.563 6.321 729 HB3 PRO 103 2HB PRO 103 2.390 36.390 7.453 730 HG2 PRO 103 1HG PRO 103 3.051 34.757 5.032 731 HG3 PRO 103 2HG PRO 103 2.511 34.217 6.633 732 HD2 PRO 103 1HD PRO 103 0.833 34.402 4.516 733 HD3 PRO 103 2HD PRO 103 0.300 34.687 6.185 734 HA PRO 104 HA PRO 104 3.861 39.847 2.929 735 HB2 PRO 104 1HB PRO 104 6.047 40.802 4.225 736 HB3 PRO 104 2HB PRO 104 4.445 41.531 4.380 737 HG2 PRO 104 1HG PRO 104 5.849 39.635 6.222 738 HG3 PRO 104 2HG PRO 104 4.904 41.083 6.615 739 HD2 PRO 104 1HD PRO 104 3.891 38.581 6.827 740 HD3 PRO 104 2HD PRO 104 2.891 39.982 6.395 741 H ASN 105 H ASN 105 5.988 38.028 5.146 742 HA ASN 105 HA ASN 105 7.422 37.005 2.783 743 HB2 ASN 105 1HB ASN 105 8.656 38.464 4.533 744 HB3 ASN 105 2HB ASN 105 8.580 37.034 5.559 745 HD21 ASN 105 2HD2 ASN 105 9.724 38.262 2.472 746 HD22 ASN 105 1HD2 ASN 105 11.016 37.129 2.291 747 H ALA 106 H ALA 106 6.632 35.045 2.336 748 HA ALA 106 HA ALA 106 7.092 32.845 4.006 749 HB1 ALA 106 1HB ALA 106 4.943 34.166 4.957 750 HB2 ALA 106 2HB ALA 106 4.161 33.067 3.821 751 HB3 ALA 106 3HB ALA 106 5.175 32.425 5.113 752 H THR 107 H THR 107 6.409 30.829 3.060 753 HA THR 107 HA THR 107 6.221 31.012 0.174 754 HB THR 107 HB THR 107 6.497 28.603 1.981 755 HG1 THR 107 HG1 THR 107 8.397 29.890 0.288 756 HG21 THR 107 3HG2 THR 107 7.339 27.708 -0.384 757 HG22 THR 107 1HG2 THR 107 6.160 28.888 -0.955 758 HG23 THR 107 2HG2 THR 107 5.654 27.585 0.122 759 H LEU 108 H LEU 108 4.432 30.731 -0.993 760 HA LEU 108 HA LEU 108 1.974 29.964 0.398 761 HB2 LEU 108 1HB LEU 108 2.629 31.577 -1.996 762 HB3 LEU 108 2HB LEU 108 1.108 30.687 -2.028 763 HG LEU 108 HG LEU 108 0.745 32.970 -1.302 764 HD11 LEU 108 1HD1 LEU 108 -0.818 32.336 0.155 765 HD12 LEU 108 2HD1 LEU 108 0.373 31.717 1.298 766 HD13 LEU 108 3HD1 LEU 108 -0.171 30.707 -0.041 767 HD21 LEU 108 3HD2 LEU 108 2.751 32.304 0.846 768 HD22 LEU 108 1HD2 LEU 108 1.689 33.713 0.886 769 HD23 LEU 108 2HD2 LEU 108 2.883 33.545 -0.402 770 H VAL 109 H VAL 109 1.012 28.064 0.079 771 HA VAL 109 HA VAL 109 2.087 26.300 -2.006 772 HB VAL 109 HB VAL 109 0.465 25.643 0.456 773 HG11 VAL 109 1HG1 VAL 109 -0.101 23.774 -0.616 774 HG12 VAL 109 2HG1 VAL 109 0.985 24.131 -1.960 775 HG13 VAL 109 3HG1 VAL 109 1.598 23.310 -0.524 776 HG21 VAL 109 3HG2 VAL 109 3.112 24.462 0.171 777 HG22 VAL 109 1HG2 VAL 109 3.146 26.223 0.254 778 HG23 VAL 109 2HG2 VAL 109 2.386 25.293 1.546 779 H PHE 110 H PHE 110 0.962 26.298 -3.835 780 HA PHE 110 HA PHE 110 -1.978 26.432 -3.670 781 HB2 PHE 110 1HB PHE 110 -0.057 27.563 -5.688 782 HB3 PHE 110 2HB PHE 110 -1.735 27.247 -6.118 783 HD1 PHE 110 HD2 PHE 110 -3.551 28.482 -5.007 784 HD2 PHE 110 HD1 PHE 110 0.546 29.398 -4.304 785 HE1 PHE 110 HE2 PHE 110 -4.204 30.654 -4.052 786 HE2 PHE 110 HE1 PHE 110 -0.100 31.571 -3.347 787 HZ PHE 110 HZ PHE 110 -2.478 32.202 -3.221 788 H GLU 111 H GLU 111 -3.134 24.826 -4.564 789 HA GLU 111 HA GLU 111 -1.641 22.651 -5.844 790 HB2 GLU 111 1HB GLU 111 -3.147 22.309 -3.784 791 HB3 GLU 111 2HB GLU 111 -4.493 22.499 -4.899 792 HG2 GLU 111 1HG GLU 111 -3.494 20.631 -6.253 793 HG3 GLU 111 2HG GLU 111 -2.377 20.367 -4.915 794 H VAL 112 H VAL 112 -1.976 22.062 -7.906 795 HA VAL 112 HA VAL 112 -4.126 23.438 -9.383 796 HB VAL 112 HB VAL 112 -1.527 22.494 -10.585 797 HG11 VAL 112 1HG1 VAL 112 -2.200 23.474 -12.535 798 HG12 VAL 112 2HG1 VAL 112 -3.773 23.004 -11.886 799 HG13 VAL 112 3HG1 VAL 112 -3.209 24.667 -11.717 800 HG21 VAL 112 3HG2 VAL 112 -2.214 25.063 -9.233 801 HG22 VAL 112 1HG2 VAL 112 -0.715 24.135 -9.193 802 HG23 VAL 112 2HG2 VAL 112 -1.128 25.082 -10.622 803 H GLU 113 H GLU 113 -5.585 22.191 -10.355 804 HA GLU 113 HA GLU 113 -4.877 19.409 -10.987 805 HB2 GLU 113 1HB GLU 113 -6.133 19.067 -9.057 806 HB3 GLU 113 2HB GLU 113 -7.205 20.419 -9.395 807 HG2 GLU 113 1HG GLU 113 -8.381 18.333 -9.667 808 HG3 GLU 113 2HG GLU 113 -8.223 19.147 -11.222 809 H LEU 114 H LEU 114 -4.910 19.370 -13.144 810 HA LEU 114 HA LEU 114 -6.615 21.044 -14.712 811 HB2 LEU 114 1HB LEU 114 -4.274 19.791 -15.184 812 HB3 LEU 114 2HB LEU 114 -5.389 18.675 -15.970 813 HG LEU 114 HG LEU 114 -5.210 21.621 -16.596 814 HD11 LEU 114 1HD1 LEU 114 -3.255 19.845 -17.151 815 HD12 LEU 114 2HD1 LEU 114 -3.651 21.230 -18.168 816 HD13 LEU 114 3HD1 LEU 114 -4.293 19.635 -18.562 817 HD21 LEU 114 3HD2 LEU 114 -6.962 19.421 -17.430 818 HD22 LEU 114 1HD2 LEU 114 -6.289 20.371 -18.754 819 HD23 LEU 114 2HD2 LEU 114 -7.220 21.166 -17.485 820 H LEU 115 H LEU 115 -8.611 20.662 -15.421 821 HA LEU 115 HA LEU 115 -9.717 17.961 -15.051 822 HB2 LEU 115 1HB LEU 115 -11.105 20.634 -15.172 823 HB3 LEU 115 2HB LEU 115 -11.924 19.079 -15.032 824 HG LEU 115 HG LEU 115 -10.157 19.082 -12.902 825 HD11 LEU 115 1HD1 LEU 115 -11.430 21.544 -12.235 826 HD12 LEU 115 2HD1 LEU 115 -10.483 21.767 -13.705 827 HD13 LEU 115 3HD1 LEU 115 -9.711 21.149 -12.244 828 HD21 LEU 115 3HD2 LEU 115 -12.597 18.372 -13.119 829 HD22 LEU 115 1HD2 LEU 115 -12.997 20.044 -12.727 830 HD23 LEU 115 2HD2 LEU 115 -12.092 19.061 -11.576 831 H ASP 116 H ASP 116 -9.272 20.578 -17.320 832 HA ASP 116 HA ASP 116 -9.558 18.862 -19.558 833 HB2 ASP 116 1HB ASP 116 -11.974 19.260 -18.853 834 HB3 ASP 116 2HB ASP 116 -11.737 20.936 -19.337 835 H VAL 117 H VAL 117 -9.142 19.948 -21.581 836 HA VAL 117 HA VAL 117 -8.098 22.684 -21.288 837 HB VAL 117 HB VAL 117 -6.165 21.248 -21.212 838 HG11 VAL 117 1HG1 VAL 117 -7.026 20.076 -23.850 839 HG12 VAL 117 2HG1 VAL 117 -5.649 19.597 -22.856 840 HG13 VAL 117 3HG1 VAL 117 -7.292 19.292 -22.294 841 HG21 VAL 117 3HG2 VAL 117 -6.563 23.264 -23.079 842 HG22 VAL 117 1HG2 VAL 117 -5.013 22.623 -22.534 843 HG23 VAL 117 2HG2 VAL 117 -5.773 21.976 -23.988 844 H11 L2S 130 1H1 L2S 130 -4.819 31.560 -9.098 845 H21 L2S 130 2H1 L2S 130 -5.384 31.691 -10.833 846 H12 L2S 130 1H2 L2S 130 -4.868 34.031 -10.838 847 H22 L2S 130 2H2 L2S 130 -3.376 33.062 -10.411 848 H13 L2S 130 2H3 L2S 130 -3.731 33.594 -8.087 849 H23 L2S 130 1H3 L2S 130 -3.714 35.154 -9.034 850 H14 L2S 130 1H4 L2S 130 -6.264 32.790 -7.312 851 H24 L2S 130 2H4 L2S 130 -7.546 33.907 -7.976 852 H15 L2S 130 1H5 L2S 130 -7.277 31.746 -9.241 853 H25 L2S 130 2H5 L2S 130 -7.049 33.294 -10.190 854 H17 L2S 130 1H7 L2S 130 -7.741 36.481 -7.979 855 H27 L2S 130 2H7 L2S 130 -7.565 35.311 -6.565 856 H9 L2S 130 H9 L2S 130 -5.771 36.252 -3.904 857 H10 L2S 130 H10 L2S 130 -6.668 35.135 -1.860 858 H112 L2S 130 1H12 L2S 130 -10.649 36.688 -2.768 859 H113 L2S 130 1H13 L2S 130 -9.748 37.753 -4.828 860 H114 L2S 130 1H14 L2S 130 -10.217 34.833 -1.253 861 H214 L2S 130 2H14 L2S 130 -9.274 35.945 -0.232 862 H314 L2S 130 3H14 L2S 130 -8.525 34.416 -0.807 Start of MODEL 2 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 1HA GLY 1 2.420 -1.001 -1.447 3 HA3 GLY 1 2HA GLY 1 1.411 0.308 -2.045 4 HA PRO 2 HA PRO 2 5.917 1.637 -1.517 5 HB2 PRO 2 1HB PRO 2 6.474 1.990 -4.150 6 HB3 PRO 2 2HB PRO 2 6.731 0.456 -3.311 7 HG2 PRO 2 1HG PRO 2 4.456 1.298 -5.065 8 HG3 PRO 2 2HG PRO 2 5.322 -0.248 -5.022 9 HD2 PRO 2 1HD PRO 2 2.911 0.104 -3.842 10 HD3 PRO 2 2HD PRO 2 4.137 -1.005 -3.196 11 H GLY 3 H GLY 3 6.869 3.711 -2.518 12 HA2 GLY 3 1HA GLY 3 5.135 5.625 -3.693 13 HA3 GLY 3 2HA GLY 3 5.207 5.866 -1.954 14 H SER 4 H SER 4 6.398 7.038 -4.690 15 HA SER 4 HA SER 4 8.679 8.213 -3.389 16 HB2 SER 4 1HB SER 4 10.356 7.467 -4.989 17 HB3 SER 4 2HB SER 4 9.613 6.065 -4.219 18 HG SER 4 HG SER 4 9.844 5.950 -6.560 19 H MET 5 H MET 5 8.863 10.254 -4.047 20 HA MET 5 HA MET 5 7.839 10.967 -6.714 21 HB2 MET 5 1HB MET 5 6.932 13.037 -5.800 22 HB3 MET 5 2HB MET 5 6.222 11.645 -4.993 23 HG2 MET 5 1HG MET 5 8.608 12.911 -3.764 24 HG3 MET 5 2HG MET 5 7.064 13.752 -3.657 25 HE1 MET 5 3HE MET 5 9.400 12.026 -2.121 26 HE2 MET 5 1HE MET 5 8.543 12.102 -0.581 27 HE3 MET 5 2HE MET 5 8.832 10.543 -1.353 28 H THR 6 H THR 6 8.556 13.371 -7.182 29 HA THR 6 HA THR 6 11.310 13.798 -6.268 30 HB THR 6 HB THR 6 10.722 14.192 -9.173 31 HG1 THR 6 HG1 THR 6 10.528 12.115 -9.476 32 HG21 THR 6 3HG2 THR 6 13.081 13.922 -7.404 33 HG22 THR 6 1HG2 THR 6 12.835 14.952 -8.812 34 HG23 THR 6 2HG2 THR 6 13.225 13.246 -9.026 35 H VAL 7 H VAL 7 11.701 15.857 -5.767 36 HA VAL 7 HA VAL 7 9.877 17.917 -6.829 37 HB VAL 7 HB VAL 7 9.538 17.510 -4.417 38 HG11 VAL 7 1HG1 VAL 7 11.215 17.913 -2.799 39 HG12 VAL 7 2HG1 VAL 7 11.951 16.868 -4.015 40 HG13 VAL 7 3HG1 VAL 7 12.313 18.594 -3.999 41 HG21 VAL 7 3HG2 VAL 7 9.033 19.698 -5.257 42 HG22 VAL 7 1HG2 VAL 7 9.822 19.878 -3.690 43 HG23 VAL 7 2HG2 VAL 7 10.729 20.175 -5.173 44 H VAL 8 H VAL 8 10.746 19.763 -7.639 45 HA VAL 8 HA VAL 8 13.607 20.264 -7.298 46 HB VAL 8 HB VAL 8 13.521 18.962 -9.339 47 HG11 VAL 8 1HG1 VAL 8 11.590 21.025 -10.393 48 HG12 VAL 8 2HG1 VAL 8 12.215 19.623 -11.263 49 HG13 VAL 8 3HG1 VAL 8 11.150 19.399 -9.875 50 HG21 VAL 8 3HG2 VAL 8 14.709 20.424 -10.760 51 HG22 VAL 8 1HG2 VAL 8 13.835 21.836 -10.165 52 HG23 VAL 8 2HG2 VAL 8 15.000 21.017 -9.124 53 H THR 9 H THR 9 14.200 22.407 -7.481 54 HA THR 9 HA THR 9 11.963 24.308 -7.588 55 HB THR 9 HB THR 9 14.740 24.817 -6.511 56 HG1 THR 9 HG1 THR 9 13.209 23.161 -5.440 57 HG21 THR 9 3HG2 THR 9 12.212 26.370 -6.673 58 HG22 THR 9 1HG2 THR 9 13.884 26.918 -6.783 59 HG23 THR 9 2HG2 THR 9 13.182 26.538 -5.210 60 H THR 10 H THR 10 12.166 26.267 -8.750 61 HA THR 10 HA THR 10 13.683 25.990 -11.197 62 HB THR 10 HB THR 10 12.503 27.974 -11.963 63 HG1 THR 10 HG1 THR 10 11.397 29.257 -10.614 64 HG21 THR 10 3HG2 THR 10 10.733 26.007 -10.511 65 HG22 THR 10 1HG2 THR 10 11.293 25.902 -12.179 66 HG23 THR 10 2HG2 THR 10 10.158 27.167 -11.707 67 H GLU 11 H GLU 11 14.420 28.409 -11.983 68 HA GLU 11 HA GLU 11 16.699 28.970 -10.306 69 HB2 GLU 11 1HB GLU 11 15.798 29.804 -13.030 70 HB3 GLU 11 2HB GLU 11 17.010 30.775 -12.206 71 HG2 GLU 11 1HG GLU 11 18.246 28.538 -11.868 72 HG3 GLU 11 2HG GLU 11 17.184 27.943 -13.143 73 H SER 12 H SER 12 13.595 30.365 -10.943 74 HA SER 12 HA SER 12 14.277 32.930 -9.779 75 HB2 SER 12 1HB SER 12 11.490 31.981 -10.420 76 HB3 SER 12 2HB SER 12 12.105 33.633 -10.380 77 HG SER 12 HG SER 12 13.406 33.062 -12.214 78 H GLY 13 H GLY 13 12.808 29.923 -8.817 79 HA2 GLY 13 1HA GLY 13 13.108 29.650 -6.296 80 HA3 GLY 13 2HA GLY 13 12.116 31.097 -6.202 81 H LEU 14 H LEU 14 10.655 29.954 -8.669 82 HA LEU 14 HA LEU 14 8.426 28.948 -7.327 83 HB2 LEU 14 1HB LEU 14 8.040 29.820 -9.453 84 HB3 LEU 14 2HB LEU 14 9.325 28.859 -10.182 85 HG LEU 14 HG LEU 14 7.917 26.836 -9.868 86 HD11 LEU 14 1HD1 LEU 14 5.469 28.407 -9.512 87 HD12 LEU 14 2HD1 LEU 14 6.511 28.334 -8.092 88 HD13 LEU 14 3HD1 LEU 14 5.928 26.845 -8.835 89 HD21 LEU 14 3HD2 LEU 14 6.960 29.143 -11.530 90 HD22 LEU 14 1HD2 LEU 14 6.164 27.570 -11.592 91 HD23 LEU 14 2HD2 LEU 14 7.867 27.714 -12.030 92 H LYS 15 H LYS 15 7.664 26.918 -6.897 93 HA LYS 15 HA LYS 15 9.355 24.631 -7.623 94 HB2 LYS 15 1HB LYS 15 8.240 25.126 -4.856 95 HB3 LYS 15 2HB LYS 15 9.161 23.715 -5.363 96 HG2 LYS 15 1HG LYS 15 11.148 24.842 -5.377 97 HG3 LYS 15 2HG LYS 15 10.388 26.402 -5.698 98 HD2 LYS 15 1HD LYS 15 11.258 26.366 -3.440 99 HD3 LYS 15 2HD LYS 15 9.494 26.405 -3.397 100 HE2 LYS 15 1HE LYS 15 10.263 24.824 -1.765 101 HE3 LYS 15 2HE LYS 15 9.505 23.939 -3.088 102 HZ1 LYS 15 3HZ LYS 15 11.695 23.054 -2.219 103 HZ2 LYS 15 1HZ LYS 15 12.428 24.378 -2.976 104 HZ3 LYS 15 2HZ LYS 15 11.572 23.246 -3.895 105 H TYR 16 H TYR 16 8.231 22.531 -7.282 106 HA TYR 16 HA TYR 16 5.344 22.603 -7.118 107 HB2 TYR 16 1HB TYR 16 5.186 21.344 -9.353 108 HB3 TYR 16 2HB TYR 16 5.424 23.087 -9.417 109 HD1 TYR 16 HD1 TYR 16 7.244 19.851 -9.620 110 HD2 TYR 16 HD2 TYR 16 7.240 23.995 -10.584 111 HE1 TYR 16 HE1 TYR 16 9.236 19.520 -11.023 112 HE2 TYR 16 HE2 TYR 16 9.231 23.675 -11.991 113 HH TYR 16 HH TYR 16 10.691 22.222 -12.814 114 H GLU 17 H GLU 17 4.399 20.524 -6.884 115 HA GLU 17 HA GLU 17 6.277 18.294 -6.556 116 HB2 GLU 17 1HB GLU 17 5.676 19.530 -4.362 117 HB3 GLU 17 2HB GLU 17 4.100 18.774 -4.543 118 HG2 GLU 17 1HG GLU 17 6.521 17.060 -4.702 119 HG3 GLU 17 2HG GLU 17 6.005 17.656 -3.126 120 H ASP 18 H ASP 18 5.609 16.647 -7.745 121 HA ASP 18 HA ASP 18 3.155 16.505 -9.060 122 HB2 ASP 18 1HB ASP 18 5.219 14.404 -8.418 123 HB3 ASP 18 2HB ASP 18 3.774 14.038 -9.356 124 H LEU 19 H LEU 19 1.191 15.754 -8.538 125 HA LEU 19 HA LEU 19 0.889 14.424 -5.926 126 HB2 LEU 19 1HB LEU 19 -0.600 16.622 -7.222 127 HB3 LEU 19 2HB LEU 19 -1.565 15.428 -6.356 128 HG LEU 19 HG LEU 19 0.663 17.083 -5.171 129 HD11 LEU 19 1HD1 LEU 19 -1.375 17.957 -3.835 130 HD12 LEU 19 2HD1 LEU 19 -2.313 17.363 -5.205 131 HD13 LEU 19 3HD1 LEU 19 -1.069 18.588 -5.454 132 HD21 LEU 19 3HD2 LEU 19 -0.602 16.145 -3.051 133 HD22 LEU 19 1HD2 LEU 19 0.695 15.237 -3.828 134 HD23 LEU 19 2HD2 LEU 19 -0.988 14.827 -4.159 135 H THR 20 H THR 20 -0.141 14.552 -9.278 136 HA THR 20 HA THR 20 -0.815 11.762 -9.241 137 HB THR 20 HB THR 20 -3.074 13.589 -10.022 138 HG1 THR 20 HG1 THR 20 -3.947 13.181 -7.942 139 HG21 THR 20 3HG2 THR 20 -3.270 11.381 -10.905 140 HG22 THR 20 1HG2 THR 20 -4.381 11.493 -9.541 141 HG23 THR 20 2HG2 THR 20 -2.839 10.657 -9.356 142 H GLU 21 H GLU 21 0.103 11.082 -11.056 143 HA GLU 21 HA GLU 21 0.796 12.731 -13.220 144 HB2 GLU 21 1HB GLU 21 1.808 10.486 -12.576 145 HB3 GLU 21 2HB GLU 21 0.431 9.742 -13.376 146 HG2 GLU 21 1HG GLU 21 1.081 10.526 -15.480 147 HG3 GLU 21 2HG GLU 21 2.197 11.703 -14.792 148 H GLY 22 H GLY 22 0.003 12.762 -15.383 149 HA2 GLY 22 1HA GLY 22 -2.807 11.898 -15.654 150 HA3 GLY 22 2HA GLY 22 -2.300 13.510 -16.137 151 H SER 23 H SER 23 -3.280 10.826 -17.461 152 HA SER 23 HA SER 23 -1.227 10.724 -19.564 153 HB2 SER 23 1HB SER 23 -2.171 8.566 -20.191 154 HB3 SER 23 2HB SER 23 -1.799 8.572 -18.468 155 HG SER 23 HG SER 23 -4.152 8.152 -19.674 156 H GLY 24 H GLY 24 -2.802 12.956 -19.628 157 HA2 GLY 24 1HA GLY 24 -4.758 12.390 -21.766 158 HA3 GLY 24 2HA GLY 24 -4.841 13.772 -20.683 159 H ALA 25 H ALA 25 -3.273 15.471 -20.934 160 HA ALA 25 HA ALA 25 -1.380 15.561 -23.010 161 HB1 ALA 25 1HB ALA 25 -3.663 17.287 -23.799 162 HB2 ALA 25 2HB ALA 25 -2.420 16.525 -24.792 163 HB3 ALA 25 3HB ALA 25 -3.762 15.565 -24.170 164 H GLU 26 H GLU 26 -0.049 17.260 -22.703 165 HA GLU 26 HA GLU 26 -0.283 18.867 -20.428 166 HB2 GLU 26 1HB GLU 26 1.731 19.862 -21.070 167 HB3 GLU 26 2HB GLU 26 1.810 18.267 -21.805 168 HG2 GLU 26 1HG GLU 26 1.063 20.829 -23.195 169 HG3 GLU 26 2HG GLU 26 2.593 19.966 -23.340 170 H ALA 27 H ALA 27 -0.767 21.044 -20.132 171 HA ALA 27 HA ALA 27 -2.933 22.070 -21.573 172 HB1 ALA 27 1HB ALA 27 -1.704 22.682 -19.207 173 HB2 ALA 27 2HB ALA 27 -1.340 24.095 -20.198 174 HB3 ALA 27 3HB ALA 27 -3.014 23.603 -19.946 175 H ARG 28 H ARG 28 -3.114 23.325 -23.332 176 HA ARG 28 HA ARG 28 -0.678 23.992 -24.783 177 HB2 ARG 28 1HB ARG 28 -3.593 23.923 -25.530 178 HB3 ARG 28 2HB ARG 28 -2.388 24.655 -26.581 179 HG2 ARG 28 1HG ARG 28 -1.952 21.879 -25.595 180 HG3 ARG 28 2HG ARG 28 -3.108 22.165 -26.898 181 HD2 ARG 28 1HD ARG 28 -0.325 23.279 -27.000 182 HD3 ARG 28 2HD ARG 28 -0.672 21.631 -27.522 183 HE ARG 28 HE ARG 28 -1.216 24.017 -28.960 184 HH11 ARG 28 1HH1 ARG 28 -2.466 20.833 -28.311 185 HH12 ARG 28 2HH1 ARG 28 -3.320 20.720 -29.815 186 HH21 ARG 28 1HH2 ARG 28 -2.336 23.880 -30.942 187 HH22 ARG 28 2HH2 ARG 28 -3.244 22.453 -31.311 188 H ALA 29 H ALA 29 -0.457 26.105 -25.819 189 HA ALA 29 HA ALA 29 -1.286 28.233 -23.990 190 HB1 ALA 29 1HB ALA 29 0.862 28.774 -24.238 191 HB2 ALA 29 2HB ALA 29 1.045 27.732 -25.649 192 HB3 ALA 29 3HB ALA 29 0.419 29.370 -25.837 193 H GLY 30 H GLY 30 -2.272 30.145 -24.700 194 HA2 GLY 30 1HA GLY 30 -3.463 31.531 -26.128 195 HA3 GLY 30 2HA GLY 30 -3.037 30.469 -27.462 196 H GLN 31 H GLN 31 -4.218 28.489 -25.143 197 HA GLN 31 HA GLN 31 -6.966 28.698 -26.187 198 HB2 GLN 31 1HB GLN 31 -5.360 26.644 -26.724 199 HB3 GLN 31 2HB GLN 31 -5.936 26.101 -25.154 200 HG2 GLN 31 1HG GLN 31 -7.929 27.007 -27.163 201 HG3 GLN 31 2HG GLN 31 -7.166 25.432 -27.372 202 HE21 GLN 31 2HE2 GLN 31 -6.965 24.404 -24.951 203 HE22 GLN 31 1HE2 GLN 31 -8.507 24.251 -24.188 204 H THR 32 H THR 32 -8.680 28.109 -24.764 205 HA THR 32 HA THR 32 -8.128 28.838 -22.011 206 HB THR 32 HB THR 32 -10.822 28.124 -23.162 207 HG1 THR 32 HG1 THR 32 -10.535 29.835 -24.380 208 HG21 THR 32 3HG2 THR 32 -11.624 28.743 -21.175 209 HG22 THR 32 1HG2 THR 32 -10.733 30.264 -21.231 210 HG23 THR 32 2HG2 THR 32 -9.963 28.813 -20.589 211 H VAL 33 H VAL 33 -7.709 27.383 -20.496 212 HA VAL 33 HA VAL 33 -8.780 24.655 -20.824 213 HB VAL 33 HB VAL 33 -6.880 23.795 -19.614 214 HG11 VAL 33 1HG1 VAL 33 -5.450 25.595 -21.466 215 HG12 VAL 33 2HG1 VAL 33 -5.454 23.833 -21.369 216 HG13 VAL 33 3HG1 VAL 33 -6.792 24.677 -22.150 217 HG21 VAL 33 3HG2 VAL 33 -5.050 25.869 -19.419 218 HG22 VAL 33 1HG2 VAL 33 -6.564 26.572 -18.849 219 HG23 VAL 33 2HG2 VAL 33 -5.927 25.114 -18.088 220 H SER 34 H SER 34 -9.754 23.667 -19.096 221 HA SER 34 HA SER 34 -10.449 25.433 -16.864 222 HB2 SER 34 1HB SER 34 -11.849 22.887 -16.912 223 HB3 SER 34 2HB SER 34 -12.502 24.524 -16.957 224 HG SER 34 HG SER 34 -12.643 22.908 -18.887 225 H VAL 35 H VAL 35 -9.498 25.174 -14.965 226 HA VAL 35 HA VAL 35 -8.737 22.499 -14.071 227 HB VAL 35 HB VAL 35 -6.509 23.016 -13.548 228 HG11 VAL 35 1HG1 VAL 35 -6.977 24.392 -16.189 229 HG12 VAL 35 2HG1 VAL 35 -5.503 23.585 -15.652 230 HG13 VAL 35 3HG1 VAL 35 -6.961 22.643 -15.966 231 HG21 VAL 35 3HG2 VAL 35 -6.358 25.068 -12.580 232 HG22 VAL 35 1HG2 VAL 35 -5.753 25.492 -14.182 233 HG23 VAL 35 2HG2 VAL 35 -7.432 25.825 -13.757 234 H HIS 36 H HIS 36 -8.219 22.427 -11.757 235 HA HIS 36 HA HIS 36 -9.785 24.433 -10.291 236 HB2 HIS 36 1HB HIS 36 -9.241 21.532 -9.898 237 HB3 HIS 36 2HB HIS 36 -9.470 22.518 -8.457 238 HD1 HIS 36 HD1 HIS 36 -11.682 24.382 -9.830 239 HD2 HIS 36 HD2 HIS 36 -11.681 20.231 -9.662 240 HE1 HIS 36 HE1 HIS 36 -14.088 23.698 -10.087 241 H TYR 37 H TYR 37 -8.875 25.718 -8.802 242 HA TYR 37 HA TYR 37 -6.063 25.202 -8.082 243 HB2 TYR 37 1HB TYR 37 -5.652 27.577 -8.071 244 HB3 TYR 37 2HB TYR 37 -6.376 27.148 -9.617 245 HD1 TYR 37 HD2 TYR 37 -7.064 28.690 -6.324 246 HD2 TYR 37 HD1 TYR 37 -8.430 28.102 -10.310 247 HE1 TYR 37 HE2 TYR 37 -8.806 30.390 -5.972 248 HE2 TYR 37 HE1 TYR 37 -10.175 29.802 -9.970 249 HH TYR 37 HH TYR 37 -10.586 31.409 -6.831 250 H THR 38 H THR 38 -5.470 25.424 -5.971 251 HA THR 38 HA THR 38 -7.512 26.315 -4.055 252 HB THR 38 HB THR 38 -5.909 24.154 -2.970 253 HG1 THR 38 HG1 THR 38 -6.414 22.566 -4.335 254 HG21 THR 38 3HG2 THR 38 -8.704 25.073 -3.043 255 HG22 THR 38 1HG2 THR 38 -7.759 24.424 -1.704 256 HG23 THR 38 2HG2 THR 38 -8.495 23.331 -2.876 257 H GLY 39 H GLY 39 -6.744 27.775 -2.674 258 HA2 GLY 39 1HA GLY 39 -3.848 28.179 -2.533 259 HA3 GLY 39 2HA GLY 39 -5.080 29.319 -2.012 260 H TRP 40 H TRP 40 -2.643 27.722 -0.809 261 HA TRP 40 HA TRP 40 -3.986 27.256 1.764 262 HB2 TRP 40 1HB TRP 40 -2.085 25.432 0.318 263 HB3 TRP 40 2HB TRP 40 -2.210 25.390 2.074 264 HD1 TRP 40 HD1 TRP 40 -5.304 25.602 2.474 265 HE1 TRP 40 HE1 TRP 40 -6.853 23.684 1.735 266 HE3 TRP 40 HE3 TRP 40 -2.234 23.349 -0.937 267 HZ2 TRP 40 HZ2 TRP 40 -6.783 21.504 -0.057 268 HZ3 TRP 40 HZ3 TRP 40 -3.051 21.351 -2.120 269 HH2 TRP 40 HH2 TRP 40 -5.278 20.449 -1.687 270 H LEU 41 H LEU 41 -2.975 28.101 3.501 271 HA LEU 41 HA LEU 41 -0.753 29.859 3.063 272 HB2 LEU 41 1HB LEU 41 -2.656 29.283 5.218 273 HB3 LEU 41 2HB LEU 41 -1.051 29.754 5.771 274 HG LEU 41 HG LEU 41 -2.838 31.370 3.954 275 HD11 LEU 41 1HD1 LEU 41 -2.591 31.174 6.843 276 HD12 LEU 41 2HD1 LEU 41 -3.829 31.956 5.861 277 HD13 LEU 41 3HD1 LEU 41 -2.335 32.813 6.243 278 HD21 LEU 41 3HD2 LEU 41 -0.094 31.889 5.080 279 HD22 LEU 41 1HD2 LEU 41 -1.130 33.151 4.412 280 HD23 LEU 41 2HD2 LEU 41 -0.576 31.829 3.383 281 H THR 42 H THR 42 1.097 29.836 4.703 282 HA THR 42 HA THR 42 2.697 27.611 4.289 283 HB THR 42 HB THR 42 4.200 28.499 5.988 284 HG1 THR 42 HG1 THR 42 3.550 30.040 7.421 285 HG21 THR 42 3HG2 THR 42 4.447 29.676 3.990 286 HG22 THR 42 1HG2 THR 42 4.208 30.955 5.179 287 HG23 THR 42 2HG2 THR 42 2.873 30.455 4.141 288 H ASP 43 H ASP 43 0.445 28.300 6.885 289 HA ASP 43 HA ASP 43 1.278 25.976 8.412 290 HB2 ASP 43 1HB ASP 43 -1.028 27.877 8.888 291 HB3 ASP 43 2HB ASP 43 -0.424 26.672 10.022 292 H GLY 44 H GLY 44 -0.927 26.719 5.923 293 HA2 GLY 44 1HA GLY 44 -1.876 24.736 4.801 294 HA3 GLY 44 2HA GLY 44 -2.323 24.158 6.399 295 H GLN 45 H GLN 45 -2.937 27.212 6.853 296 HA GLN 45 HA GLN 45 -5.702 27.028 6.747 297 HB2 GLN 45 1HB GLN 45 -4.081 28.777 7.878 298 HB3 GLN 45 2HB GLN 45 -4.401 29.697 6.415 299 HG2 GLN 45 1HG GLN 45 -6.007 30.497 7.847 300 HG3 GLN 45 2HG GLN 45 -6.888 29.245 6.973 301 HE21 GLN 45 2HE2 GLN 45 -5.460 30.173 9.995 302 HE22 GLN 45 1HE2 GLN 45 -6.179 28.928 10.953 303 H LYS 46 H LYS 46 -6.919 26.716 5.010 304 HA LYS 46 HA LYS 46 -6.101 27.425 2.375 305 HB2 LYS 46 1HB LYS 46 -7.681 25.524 3.131 306 HB3 LYS 46 2HB LYS 46 -8.929 26.763 3.154 307 HG2 LYS 46 1HG LYS 46 -8.272 27.256 0.751 308 HG3 LYS 46 2HG LYS 46 -7.356 25.748 0.809 309 HD2 LYS 46 1HD LYS 46 -10.295 25.967 1.451 310 HD3 LYS 46 2HD LYS 46 -9.659 25.523 -0.135 311 HE2 LYS 46 1HE LYS 46 -8.844 23.493 0.618 312 HE3 LYS 46 2HE LYS 46 -8.773 24.028 2.296 313 HZ1 LYS 46 3HZ LYS 46 -10.816 22.612 1.028 314 HZ2 LYS 46 1HZ LYS 46 -11.438 24.132 1.434 315 HZ3 LYS 46 2HZ LYS 46 -10.760 23.149 2.631 316 H PHE 47 H PHE 47 -6.669 29.122 1.104 317 HA PHE 47 HA PHE 47 -8.576 31.082 2.163 318 HB2 PHE 47 1HB PHE 47 -7.036 32.923 1.513 319 HB3 PHE 47 2HB PHE 47 -6.402 31.925 2.817 320 HD1 PHE 47 HD2 PHE 47 -6.141 32.650 -0.790 321 HD2 PHE 47 HD1 PHE 47 -4.380 30.734 2.578 322 HE1 PHE 47 HE2 PHE 47 -4.081 32.278 -2.083 323 HE2 PHE 47 HE1 PHE 47 -2.317 30.359 1.291 324 HZ PHE 47 HZ PHE 47 -2.166 31.130 -1.043 325 H ASP 48 H ASP 48 -8.398 29.031 -0.076 326 HA ASP 48 HA ASP 48 -9.872 30.462 -1.997 327 HB2 ASP 48 1HB ASP 48 -6.965 30.409 -2.377 328 HB3 ASP 48 2HB ASP 48 -7.868 29.810 -3.766 329 H SER 49 H SER 49 -11.190 29.008 -2.858 330 HA SER 49 HA SER 49 -10.187 26.363 -3.570 331 HB2 SER 49 1HB SER 49 -11.774 25.146 -2.310 332 HB3 SER 49 2HB SER 49 -11.144 26.349 -1.186 333 HG SER 49 HG SER 49 -13.268 26.585 -0.946 334 H SER 50 H SER 50 -10.771 26.041 -5.601 335 HA SER 50 HA SER 50 -12.776 27.579 -6.899 336 HB2 SER 50 1HB SER 50 -11.111 25.209 -7.726 337 HB3 SER 50 2HB SER 50 -12.361 25.865 -8.783 338 HG SER 50 HG SER 50 -11.158 27.564 -9.163 339 H LYS 51 H LYS 51 -12.678 24.354 -5.519 340 HA LYS 51 HA LYS 51 -15.000 23.277 -6.609 341 HB2 LYS 51 1HB LYS 51 -13.794 22.865 -3.867 342 HB3 LYS 51 2HB LYS 51 -15.073 21.867 -4.547 343 HG2 LYS 51 1HG LYS 51 -12.381 22.222 -5.838 344 HG3 LYS 51 2HG LYS 51 -12.769 20.913 -4.719 345 HD2 LYS 51 1HD LYS 51 -14.524 21.395 -7.088 346 HD3 LYS 51 2HD LYS 51 -12.987 20.554 -7.302 347 HE2 LYS 51 1HE LYS 51 -14.424 18.796 -6.913 348 HE3 LYS 51 2HE LYS 51 -13.817 19.118 -5.290 349 HZ1 LYS 51 3HZ LYS 51 -16.457 19.091 -6.124 350 HZ2 LYS 51 1HZ LYS 51 -16.091 20.712 -5.805 351 HZ3 LYS 51 2HZ LYS 51 -15.864 19.543 -4.605 352 H ASP 52 H ASP 52 -14.595 25.752 -4.235 353 HA ASP 52 HA ASP 52 -16.986 25.619 -2.830 354 HB2 ASP 52 1HB ASP 52 -15.340 27.165 -2.093 355 HB3 ASP 52 2HB ASP 52 -15.290 27.971 -3.658 356 H ARG 53 H ARG 53 -16.294 27.268 -5.900 357 HA ARG 53 HA ARG 53 -19.010 28.144 -6.224 358 HB2 ARG 53 1HB ARG 53 -16.746 29.125 -7.186 359 HB3 ARG 53 2HB ARG 53 -17.102 28.030 -8.516 360 HG2 ARG 53 1HG ARG 53 -18.011 30.091 -9.149 361 HG3 ARG 53 2HG ARG 53 -19.388 29.127 -8.612 362 HD2 ARG 53 1HD ARG 53 -18.972 30.240 -6.318 363 HD3 ARG 53 2HD ARG 53 -18.028 31.414 -7.234 364 HE ARG 53 HE ARG 53 -19.979 32.307 -8.023 365 HH11 ARG 53 1HH1 ARG 53 -20.629 29.151 -6.706 366 HH12 ARG 53 2HH1 ARG 53 -22.349 29.301 -6.852 367 HH21 ARG 53 1HH2 ARG 53 -22.242 32.517 -8.220 368 HH22 ARG 53 2HH2 ARG 53 -23.265 31.215 -7.714 369 H ASN 54 H ASN 54 -17.379 25.236 -6.745 370 HA ASN 54 HA ASN 54 -17.991 23.253 -7.677 371 HB2 ASN 54 1HB ASN 54 -20.723 24.382 -8.232 372 HB3 ASN 54 2HB ASN 54 -20.276 22.726 -7.834 373 HD21 ASN 54 2HD2 ASN 54 -19.300 22.444 -5.636 374 HD22 ASN 54 1HD2 ASN 54 -20.009 23.343 -4.342 375 H ASP 55 H ASP 55 -16.598 24.837 -9.330 376 HA ASP 55 HA ASP 55 -17.389 23.918 -11.904 377 HB2 ASP 55 1HB ASP 55 -18.869 25.713 -12.097 378 HB3 ASP 55 2HB ASP 55 -17.814 26.805 -11.205 379 HA PRO 56 HA PRO 56 -13.015 24.198 -12.343 380 HB2 PRO 56 1HB PRO 56 -12.850 23.851 -15.030 381 HB3 PRO 56 2HB PRO 56 -13.223 22.533 -13.913 382 HG2 PRO 56 1HG PRO 56 -15.079 24.172 -15.596 383 HG3 PRO 56 2HG PRO 56 -15.082 22.422 -15.305 384 HD2 PRO 56 1HD PRO 56 -16.755 24.117 -14.016 385 HD3 PRO 56 2HD PRO 56 -16.128 22.637 -13.262 386 H PHE 57 H PHE 57 -11.479 25.713 -12.794 387 HA PHE 57 HA PHE 57 -12.410 28.311 -13.651 388 HB2 PHE 57 1HB PHE 57 -10.874 28.120 -11.745 389 HB3 PHE 57 2HB PHE 57 -9.658 27.393 -12.791 390 HD1 PHE 57 HD1 PHE 57 -11.876 30.328 -13.349 391 HD2 PHE 57 HD2 PHE 57 -7.899 28.886 -12.876 392 HE1 PHE 57 HE1 PHE 57 -11.005 32.566 -13.884 393 HE2 PHE 57 HE2 PHE 57 -7.022 31.122 -13.409 394 HZ PHE 57 HZ PHE 57 -8.575 32.966 -13.913 395 H ALA 58 H ALA 58 -12.719 28.484 -15.796 396 HA ALA 58 HA ALA 58 -10.796 27.330 -17.654 397 HB1 ALA 58 1HB ALA 58 -13.546 27.755 -17.745 398 HB2 ALA 58 2HB ALA 58 -12.869 28.905 -18.899 399 HB3 ALA 58 3HB ALA 58 -12.514 27.184 -19.057 400 H PHE 59 H PHE 59 -9.007 28.485 -17.990 401 HA PHE 59 HA PHE 59 -9.304 31.324 -18.666 402 HB2 PHE 59 1HB PHE 59 -7.445 31.981 -17.326 403 HB3 PHE 59 2HB PHE 59 -8.495 31.024 -16.287 404 HD1 PHE 59 HD1 PHE 59 -7.860 28.734 -15.656 405 HD2 PHE 59 HD2 PHE 59 -5.250 31.253 -17.883 406 HE1 PHE 59 HE1 PHE 59 -5.969 27.259 -15.103 407 HE2 PHE 59 HE2 PHE 59 -3.356 29.782 -17.335 408 HZ PHE 59 HZ PHE 59 -3.714 27.781 -15.945 409 H VAL 60 H VAL 60 -7.692 32.156 -20.069 410 HA VAL 60 HA VAL 60 -6.687 30.200 -21.924 411 HB VAL 60 HB VAL 60 -6.269 33.192 -21.915 412 HG11 VAL 60 1HG1 VAL 60 -4.647 32.118 -23.312 413 HG12 VAL 60 2HG1 VAL 60 -5.885 31.100 -24.051 414 HG13 VAL 60 3HG1 VAL 60 -5.876 32.839 -24.351 415 HG21 VAL 60 3HG2 VAL 60 -8.104 33.205 -23.591 416 HG22 VAL 60 1HG2 VAL 60 -8.393 31.503 -23.228 417 HG23 VAL 60 2HG2 VAL 60 -8.627 32.723 -21.977 418 H LEU 61 H LEU 61 -4.782 29.232 -21.791 419 HA LEU 61 HA LEU 61 -2.820 30.012 -19.866 420 HB2 LEU 61 1HB LEU 61 -2.931 27.721 -20.210 421 HB3 LEU 61 2HB LEU 61 -3.010 27.889 -21.963 422 HG LEU 61 HG LEU 61 -0.668 28.335 -22.098 423 HD11 LEU 61 1HD1 LEU 61 0.276 29.488 -20.449 424 HD12 LEU 61 2HD1 LEU 61 0.384 27.967 -19.564 425 HD13 LEU 61 3HD1 LEU 61 -0.993 29.038 -19.309 426 HD21 LEU 61 3HD2 LEU 61 -1.728 25.936 -21.233 427 HD22 LEU 61 1HD2 LEU 61 -0.356 26.200 -20.157 428 HD23 LEU 61 2HD2 LEU 61 -0.116 26.185 -21.904 429 H GLY 62 H GLY 62 -1.168 31.371 -20.097 430 HA2 GLY 62 1HA GLY 62 0.711 32.249 -21.261 431 HA3 GLY 62 2HA GLY 62 -0.089 31.870 -22.779 432 H GLY 63 H GLY 63 -1.423 33.604 -19.994 433 HA2 GLY 63 1HA GLY 63 -1.591 36.008 -21.705 434 HA3 GLY 63 2HA GLY 63 -2.929 35.485 -20.692 435 H GLY 64 H GLY 64 -2.797 37.664 -19.799 436 HA2 GLY 64 1HA GLY 64 -0.602 37.918 -17.836 437 HA3 GLY 64 2HA GLY 64 -1.396 39.290 -18.593 438 H MET 65 H MET 65 -3.241 36.533 -17.552 439 HA MET 65 HA MET 65 -4.501 38.220 -15.510 440 HB2 MET 65 1HB MET 65 -5.664 36.797 -17.495 441 HB3 MET 65 2HB MET 65 -5.705 35.608 -16.199 442 HG2 MET 65 1HG MET 65 -7.741 36.707 -16.023 443 HG3 MET 65 2HG MET 65 -6.744 37.457 -14.779 444 HE1 MET 65 3HE MET 65 -8.097 37.421 -18.151 445 HE2 MET 65 1HE MET 65 -9.128 38.839 -17.958 446 HE3 MET 65 2HE MET 65 -7.646 38.950 -18.909 447 H VAL 66 H VAL 66 -2.600 35.371 -15.939 448 HA VAL 66 HA VAL 66 -3.015 34.594 -13.134 449 HB VAL 66 HB VAL 66 -2.082 32.455 -13.663 450 HG11 VAL 66 1HG1 VAL 66 -4.444 33.366 -14.686 451 HG12 VAL 66 2HG1 VAL 66 -3.672 32.666 -16.110 452 HG13 VAL 66 3HG1 VAL 66 -3.927 31.680 -14.670 453 HG21 VAL 66 3HG2 VAL 66 -1.153 33.844 -16.119 454 HG22 VAL 66 1HG2 VAL 66 -0.318 32.679 -15.092 455 HG23 VAL 66 2HG2 VAL 66 -1.540 32.127 -16.237 456 H ILE 67 H ILE 67 -0.846 33.462 -12.300 457 HA ILE 67 HA ILE 67 1.188 35.567 -12.435 458 HB ILE 67 HB ILE 67 2.002 34.827 -10.346 459 HG12 ILE 67 1HG1 ILE 67 0.284 32.367 -10.731 460 HG13 ILE 67 2HG1 ILE 67 2.042 32.432 -10.756 461 HG21 ILE 67 1HG2 ILE 67 0.296 35.653 -9.178 462 HG22 ILE 67 2HG2 ILE 67 -0.628 35.621 -10.679 463 HG23 ILE 67 3HG2 ILE 67 -0.728 34.267 -9.554 464 HD11 ILE 67 3HD1 ILE 67 0.243 32.902 -8.395 465 HD12 ILE 67 1HD1 ILE 67 1.329 31.539 -8.661 466 HD13 ILE 67 2HD1 ILE 67 1.988 33.151 -8.384 467 H LYS 68 H LYS 68 3.488 34.841 -12.259 468 HA LYS 68 HA LYS 68 4.301 33.398 -14.446 469 HB2 LYS 68 1HB LYS 68 5.631 34.074 -11.850 470 HB3 LYS 68 2HB LYS 68 6.453 33.016 -12.989 471 HG2 LYS 68 1HG LYS 68 6.783 34.678 -14.514 472 HG3 LYS 68 2HG LYS 68 5.354 35.580 -14.006 473 HD2 LYS 68 1HD LYS 68 7.665 35.292 -12.134 474 HD3 LYS 68 2HD LYS 68 7.743 36.476 -13.441 475 HE2 LYS 68 1HE LYS 68 5.421 36.330 -11.537 476 HE3 LYS 68 2HE LYS 68 6.864 37.281 -11.188 477 HZ1 LYS 68 3HZ LYS 68 5.683 38.866 -12.240 478 HZ2 LYS 68 1HZ LYS 68 4.744 37.766 -13.117 479 HZ3 LYS 68 2HZ LYS 68 6.311 38.139 -13.633 480 H GLY 69 H GLY 69 4.218 32.187 -11.087 481 HA2 GLY 69 1HA GLY 69 4.971 29.567 -11.590 482 HA3 GLY 69 2HA GLY 69 3.932 30.063 -10.263 483 H TRP 70 H TRP 70 1.904 31.113 -12.171 484 HA TRP 70 HA TRP 70 0.376 28.719 -12.407 485 HB2 TRP 70 1HB TRP 70 -0.116 31.523 -12.508 486 HB3 TRP 70 2HB TRP 70 -0.775 30.806 -13.975 487 HD1 TRP 70 HD1 TRP 70 -3.129 29.820 -13.756 488 HE1 TRP 70 HE1 TRP 70 -4.663 29.134 -11.806 489 HE3 TRP 70 HE3 TRP 70 0.133 30.505 -9.879 490 HZ2 TRP 70 HZ2 TRP 70 -4.510 28.914 -8.996 491 HZ3 TRP 70 HZ3 TRP 70 -0.640 30.034 -7.591 492 HH2 TRP 70 HH2 TRP 70 -2.914 29.256 -7.160 493 H ASP 71 H ASP 71 1.526 31.024 -14.879 494 HA ASP 71 HA ASP 71 0.822 29.559 -17.122 495 HB2 ASP 71 1HB ASP 71 3.082 31.500 -16.652 496 HB3 ASP 71 2HB ASP 71 2.754 30.802 -18.235 497 H GLU 72 H GLU 72 3.868 29.478 -15.296 498 HA GLU 72 HA GLU 72 5.125 27.547 -16.940 499 HB2 GLU 72 1HB GLU 72 5.833 29.107 -14.717 500 HB3 GLU 72 2HB GLU 72 6.040 27.438 -14.203 501 HG2 GLU 72 1HG GLU 72 7.629 27.001 -15.858 502 HG3 GLU 72 2HG GLU 72 7.184 28.432 -16.786 503 H GLY 73 H GLY 73 3.143 27.320 -14.029 504 HA2 GLY 73 1HA GLY 73 3.545 24.578 -13.514 505 HA3 GLY 73 2HA GLY 73 2.161 25.525 -12.988 506 H VAL 74 H VAL 74 0.802 26.172 -15.148 507 HA VAL 74 HA VAL 74 -0.418 23.744 -15.943 508 HB VAL 74 HB VAL 74 -1.713 25.201 -17.538 509 HG11 VAL 74 1HG1 VAL 74 -1.945 26.632 -14.991 510 HG12 VAL 74 2HG1 VAL 74 -3.140 25.681 -15.874 511 HG13 VAL 74 3HG1 VAL 74 -1.954 24.875 -14.846 512 HG21 VAL 74 3HG2 VAL 74 0.436 26.922 -17.213 513 HG22 VAL 74 1HG2 VAL 74 -1.095 27.291 -18.008 514 HG23 VAL 74 2HG2 VAL 74 -0.869 27.685 -16.304 515 H GLN 75 H GLN 75 2.049 25.754 -17.353 516 HA GLN 75 HA GLN 75 1.925 24.958 -20.017 517 HB2 GLN 75 1HB GLN 75 3.957 26.132 -18.242 518 HB3 GLN 75 2HB GLN 75 4.610 25.247 -19.615 519 HG2 GLN 75 1HG GLN 75 3.361 26.624 -21.150 520 HG3 GLN 75 2HG GLN 75 2.578 27.458 -19.809 521 HE21 GLN 75 2HE2 GLN 75 5.925 26.561 -20.586 522 HE22 GLN 75 1HE2 GLN 75 6.580 28.144 -20.367 523 H GLY 76 H GLY 76 2.877 23.191 -17.224 524 HA2 GLY 76 1HA GLY 76 4.004 21.064 -18.937 525 HA3 GLY 76 2HA GLY 76 4.431 21.304 -17.249 526 H MET 77 H MET 77 1.731 21.754 -16.338 527 HA MET 77 HA MET 77 0.982 19.201 -15.608 528 HB2 MET 77 1HB MET 77 -0.551 21.780 -15.771 529 HB3 MET 77 2HB MET 77 -1.336 20.298 -15.243 530 HG2 MET 77 1HG MET 77 1.194 20.836 -13.892 531 HG3 MET 77 2HG MET 77 -0.037 22.069 -13.630 532 HE1 MET 77 3HE MET 77 1.186 18.554 -13.132 533 HE2 MET 77 1HE MET 77 -0.076 17.718 -12.226 534 HE3 MET 77 2HE MET 77 -0.274 18.002 -13.955 535 H LYS 78 H LYS 78 -0.629 17.762 -16.285 536 HA LYS 78 HA LYS 78 -1.521 18.135 -19.070 537 HB2 LYS 78 1HB LYS 78 -0.778 15.575 -17.642 538 HB3 LYS 78 2HB LYS 78 -1.469 15.654 -19.258 539 HG2 LYS 78 1HG LYS 78 0.608 17.268 -19.640 540 HG3 LYS 78 2HG LYS 78 1.267 16.289 -18.328 541 HD2 LYS 78 1HD LYS 78 0.393 14.292 -19.769 542 HD3 LYS 78 2HD LYS 78 0.442 15.471 -21.082 543 HE2 LYS 78 1HE LYS 78 2.799 15.888 -20.636 544 HE3 LYS 78 2HE LYS 78 2.758 14.760 -19.282 545 HZ1 LYS 78 3HZ LYS 78 2.765 12.976 -20.649 546 HZ2 LYS 78 1HZ LYS 78 3.543 14.054 -21.695 547 HZ3 LYS 78 2HZ LYS 78 1.890 13.746 -21.875 548 H VAL 79 H VAL 79 -3.560 17.158 -19.643 549 HA VAL 79 HA VAL 79 -5.660 17.778 -17.963 550 HB VAL 79 HB VAL 79 -5.644 15.696 -20.153 551 HG11 VAL 79 1HG1 VAL 79 -7.853 16.999 -18.605 552 HG12 VAL 79 2HG1 VAL 79 -8.119 16.411 -20.247 553 HG13 VAL 79 3HG1 VAL 79 -7.613 15.293 -18.979 554 HG21 VAL 79 3HG2 VAL 79 -6.171 17.382 -21.671 555 HG22 VAL 79 1HG2 VAL 79 -6.634 18.513 -20.400 556 HG23 VAL 79 2HG2 VAL 79 -4.934 18.122 -20.656 557 H GLY 80 H GLY 80 -6.477 16.884 -16.187 558 HA2 GLY 80 1HA GLY 80 -7.232 15.192 -14.773 559 HA3 GLY 80 2HA GLY 80 -6.482 14.007 -15.833 560 H GLY 81 H GLY 81 -4.192 16.301 -15.285 561 HA2 GLY 81 1HA GLY 81 -2.929 14.626 -13.238 562 HA3 GLY 81 2HA GLY 81 -2.110 15.783 -14.276 563 H VAL 82 H VAL 82 -2.286 15.346 -11.267 564 HA VAL 82 HA VAL 82 -3.020 18.115 -10.568 565 HB VAL 82 HB VAL 82 -3.110 15.715 -8.736 566 HG11 VAL 82 1HG1 VAL 82 -4.559 17.548 -7.471 567 HG12 VAL 82 2HG1 VAL 82 -2.811 17.422 -7.260 568 HG13 VAL 82 3HG1 VAL 82 -3.483 18.632 -8.353 569 HG21 VAL 82 3HG2 VAL 82 -5.002 15.279 -9.881 570 HG22 VAL 82 1HG2 VAL 82 -5.663 16.584 -8.897 571 HG23 VAL 82 2HG2 VAL 82 -5.106 16.912 -10.538 572 H ARG 83 H ARG 83 -1.513 19.345 -9.602 573 HA ARG 83 HA ARG 83 0.805 18.104 -8.347 574 HB2 ARG 83 1HB ARG 83 1.378 18.426 -10.758 575 HB3 ARG 83 2HB ARG 83 1.117 20.152 -10.546 576 HG2 ARG 83 1HG ARG 83 2.921 20.228 -8.903 577 HG3 ARG 83 2HG ARG 83 3.182 18.496 -9.112 578 HD2 ARG 83 1HD ARG 83 3.572 20.676 -11.153 579 HD3 ARG 83 2HD ARG 83 4.808 19.649 -10.428 580 HE ARG 83 HE ARG 83 3.031 17.950 -11.682 581 HH11 ARG 83 1HH1 ARG 83 5.152 20.554 -12.598 582 HH12 ARG 83 2HH1 ARG 83 5.435 19.936 -14.192 583 HH21 ARG 83 1HH2 ARG 83 3.395 17.127 -13.778 584 HH22 ARG 83 2HH2 ARG 83 4.435 17.987 -14.862 585 H ARG 84 H ARG 84 1.690 19.316 -6.728 586 HA ARG 84 HA ARG 84 0.168 21.644 -5.899 587 HB2 ARG 84 1HB ARG 84 1.107 19.634 -4.447 588 HB3 ARG 84 2HB ARG 84 2.534 20.658 -4.373 589 HG2 ARG 84 1HG ARG 84 1.287 22.433 -3.359 590 HG3 ARG 84 2HG ARG 84 -0.228 21.555 -3.587 591 HD2 ARG 84 1HD ARG 84 0.228 21.089 -1.383 592 HD3 ARG 84 2HD ARG 84 0.974 19.707 -2.185 593 HE ARG 84 HE ARG 84 2.898 21.718 -1.937 594 HH11 ARG 84 1HH1 ARG 84 1.033 19.580 0.080 595 HH12 ARG 84 2HH1 ARG 84 2.227 19.509 1.333 596 HH21 ARG 84 1HH2 ARG 84 4.478 21.633 -0.294 597 HH22 ARG 84 2HH2 ARG 84 4.186 20.677 1.120 598 H LEU 85 H LEU 85 0.722 23.458 -6.961 599 HA LEU 85 HA LEU 85 3.496 24.027 -7.588 600 HB2 LEU 85 1HB LEU 85 1.731 24.530 -9.210 601 HB3 LEU 85 2HB LEU 85 0.997 25.647 -8.062 602 HG LEU 85 HG LEU 85 3.400 26.777 -8.218 603 HD11 LEU 85 1HD1 LEU 85 3.955 26.693 -10.742 604 HD12 LEU 85 2HD1 LEU 85 3.118 25.141 -10.706 605 HD13 LEU 85 3HD1 LEU 85 4.537 25.401 -9.692 606 HD21 LEU 85 3HD2 LEU 85 1.059 27.648 -8.791 607 HD22 LEU 85 1HD2 LEU 85 1.452 27.220 -10.456 608 HD23 LEU 85 2HD2 LEU 85 2.438 28.402 -9.593 609 H THR 86 H THR 86 4.794 24.963 -6.169 610 HA THR 86 HA THR 86 3.641 26.576 -4.011 611 HB THR 86 HB THR 86 6.545 25.892 -4.088 612 HG1 THR 86 HG1 THR 86 5.637 23.898 -4.548 613 HG21 THR 86 3HG2 THR 86 6.427 26.609 -1.983 614 HG22 THR 86 1HG2 THR 86 5.200 25.398 -1.611 615 HG23 THR 86 2HG2 THR 86 4.721 26.980 -2.227 616 H ILE 87 H ILE 87 3.670 28.711 -4.182 617 HA ILE 87 HA ILE 87 5.758 29.963 -5.844 618 HB ILE 87 HB ILE 87 2.996 31.042 -5.275 619 HG12 ILE 87 1HG1 ILE 87 2.949 30.650 -7.904 620 HG13 ILE 87 2HG1 ILE 87 4.119 29.399 -7.499 621 HG21 ILE 87 1HG2 ILE 87 3.519 32.760 -6.872 622 HG22 ILE 87 2HG2 ILE 87 4.774 32.734 -5.634 623 HG23 ILE 87 3HG2 ILE 87 5.083 32.021 -7.217 624 HD11 ILE 87 3HD1 ILE 87 2.430 28.058 -7.030 625 HD12 ILE 87 1HD1 ILE 87 2.018 29.108 -5.674 626 HD13 ILE 87 2HD1 ILE 87 1.272 29.370 -7.251 627 HA PRO 88 HA PRO 88 7.133 31.906 -2.114 628 HB2 PRO 88 1HB PRO 88 8.777 33.735 -3.266 629 HB3 PRO 88 2HB PRO 88 9.192 32.022 -3.128 630 HG2 PRO 88 1HG PRO 88 8.097 33.523 -5.475 631 HG3 PRO 88 2HG PRO 88 9.382 32.302 -5.429 632 HD2 PRO 88 1HD PRO 88 6.851 31.725 -6.199 633 HD3 PRO 88 2HD PRO 88 7.887 30.549 -5.364 634 HA PRO 89 HA PRO 89 4.878 35.624 -1.465 635 HB2 PRO 89 1HB PRO 89 6.596 37.170 -0.040 636 HB3 PRO 89 2HB PRO 89 5.806 35.740 0.634 637 HG2 PRO 89 1HG PRO 89 8.576 36.033 -0.463 638 HG3 PRO 89 2HG PRO 89 8.034 35.179 0.994 639 HD2 PRO 89 1HD PRO 89 8.592 33.895 -1.325 640 HD3 PRO 89 2HD PRO 89 7.345 33.328 -0.195 641 H GLN 90 H GLN 90 7.609 35.629 -3.423 642 HA GLN 90 HA GLN 90 7.390 38.472 -4.086 643 HB2 GLN 90 1HB GLN 90 9.639 37.422 -3.715 644 HB3 GLN 90 2HB GLN 90 9.362 36.446 -5.152 645 HG2 GLN 90 1HG GLN 90 9.214 38.469 -6.505 646 HG3 GLN 90 2HG GLN 90 9.479 39.453 -5.066 647 HE21 GLN 90 2HE2 GLN 90 11.482 38.340 -3.776 648 HE22 GLN 90 1HE2 GLN 90 12.908 38.250 -4.746 649 H LEU 91 H LEU 91 7.164 35.271 -5.590 650 HA LEU 91 HA LEU 91 6.169 36.454 -8.060 651 HB2 LEU 91 1HB LEU 91 6.502 33.531 -7.438 652 HB3 LEU 91 2HB LEU 91 6.372 34.292 -9.022 653 HG LEU 91 HG LEU 91 8.712 34.447 -7.125 654 HD11 LEU 91 1HD1 LEU 91 8.311 32.343 -8.495 655 HD12 LEU 91 2HD1 LEU 91 9.880 33.128 -8.675 656 HD13 LEU 91 3HD1 LEU 91 8.642 33.336 -9.915 657 HD21 LEU 91 3HD2 LEU 91 9.491 35.487 -9.557 658 HD22 LEU 91 1HD2 LEU 91 9.151 36.408 -8.092 659 HD23 LEU 91 2HD2 LEU 91 7.891 36.186 -9.306 660 H GLY 92 H GLY 92 4.729 36.191 -5.325 661 HA2 GLY 92 1HA GLY 92 2.239 35.076 -6.460 662 HA3 GLY 92 2HA GLY 92 2.704 34.801 -4.788 663 H TYR 93 H TYR 93 2.078 36.228 -3.278 664 HA TYR 93 HA TYR 93 0.199 38.238 -3.948 665 HB2 TYR 93 1HB TYR 93 1.563 37.384 -1.420 666 HB3 TYR 93 2HB TYR 93 0.635 38.879 -1.444 667 HD1 TYR 93 HD2 TYR 93 0.365 35.239 -2.166 668 HD2 TYR 93 HD1 TYR 93 -1.684 38.830 -1.161 669 HE1 TYR 93 HE2 TYR 93 -1.702 33.953 -1.811 670 HE2 TYR 93 HE1 TYR 93 -3.757 37.554 -0.803 671 HH TYR 93 HH TYR 93 -4.226 34.953 -0.150 672 H GLY 94 H GLY 94 3.638 38.238 -3.551 673 HA2 GLY 94 1HA GLY 94 5.161 39.888 -4.100 674 HA3 GLY 94 2HA GLY 94 3.814 40.932 -4.527 675 H ALA 95 H ALA 95 5.439 42.451 -3.452 676 HA ALA 95 HA ALA 95 5.922 42.434 -0.706 677 HB1 ALA 95 1HB ALA 95 6.954 43.927 -2.488 678 HB2 ALA 95 2HB ALA 95 5.532 44.953 -2.294 679 HB3 ALA 95 3HB ALA 95 6.608 44.670 -0.926 680 H ARG 96 H ARG 96 3.117 43.473 -2.526 681 HA ARG 96 HA ARG 96 1.800 45.041 -0.669 682 HB2 ARG 96 1HB ARG 96 1.122 44.467 -3.071 683 HB3 ARG 96 2HB ARG 96 0.377 43.024 -2.395 684 HG2 ARG 96 1HG ARG 96 -1.418 44.418 -2.404 685 HG3 ARG 96 2HG ARG 96 -0.772 44.783 -0.803 686 HD2 ARG 96 1HD ARG 96 0.607 46.580 -2.164 687 HD3 ARG 96 2HD ARG 96 -0.740 46.414 -3.289 688 HE ARG 96 HE ARG 96 -1.804 46.767 -0.739 689 HH11 ARG 96 1HH1 ARG 96 0.084 48.546 -3.061 690 HH12 ARG 96 2HH1 ARG 96 -0.498 50.093 -2.544 691 HH21 ARG 96 1HH2 ARG 96 -2.577 48.799 -0.048 692 HH22 ARG 96 2HH2 ARG 96 -2.011 50.236 -0.829 693 H GLY 97 H GLY 97 1.113 41.575 -1.203 694 HA2 GLY 97 1HA GLY 97 0.540 39.911 0.277 695 HA3 GLY 97 2HA GLY 97 1.233 40.904 1.550 696 H ALA 98 H ALA 98 -1.291 39.255 1.314 697 HA ALA 98 HA ALA 98 -3.533 40.944 1.280 698 HB1 ALA 98 1HB ALA 98 -3.463 38.501 2.996 699 HB2 ALA 98 2HB ALA 98 -4.762 39.120 1.976 700 HB3 ALA 98 3HB ALA 98 -3.356 38.348 1.242 701 H GLY 99 H GLY 99 -4.778 41.830 2.968 702 HA2 GLY 99 1HA GLY 99 -3.423 43.221 4.935 703 HA3 GLY 99 2HA GLY 99 -5.146 42.876 4.980 704 H GLY 100 H GLY 100 -5.654 40.540 5.683 705 HA2 GLY 100 1HA GLY 100 -4.460 40.187 8.273 706 HA3 GLY 100 2HA GLY 100 -5.744 39.212 7.574 707 H VAL 101 H VAL 101 -5.258 37.304 6.575 708 HA VAL 101 HA VAL 101 -2.930 35.954 7.298 709 HB VAL 101 HB VAL 101 -3.584 34.257 5.597 710 HG11 VAL 101 1HG1 VAL 101 -6.012 35.138 7.127 711 HG12 VAL 101 2HG1 VAL 101 -5.461 33.499 6.776 712 HG13 VAL 101 3HG1 VAL 101 -4.586 34.495 7.940 713 HG21 VAL 101 3HG2 VAL 101 -4.667 36.294 4.211 714 HG22 VAL 101 1HG2 VAL 101 -5.133 34.608 3.990 715 HG23 VAL 101 2HG2 VAL 101 -6.109 35.666 5.008 716 H ILE 102 H ILE 102 -1.666 34.733 5.389 717 HA ILE 102 HA ILE 102 -0.044 34.872 3.798 718 HB ILE 102 HB ILE 102 -1.459 37.327 2.766 719 HG12 ILE 102 1HG1 ILE 102 -3.077 35.502 3.002 720 HG13 ILE 102 2HG1 ILE 102 -2.728 35.807 1.304 721 HG21 ILE 102 1HG2 ILE 102 0.853 35.885 1.944 722 HG22 ILE 102 2HG2 ILE 102 -0.403 35.681 0.724 723 HG23 ILE 102 3HG2 ILE 102 0.110 37.300 1.199 724 HD11 ILE 102 3HD1 ILE 102 -2.263 33.666 1.055 725 HD12 ILE 102 1HD1 ILE 102 -0.905 33.847 2.166 726 HD13 ILE 102 2HD1 ILE 102 -2.493 33.386 2.781 727 HA PRO 103 HA PRO 103 1.992 38.196 6.335 728 HB2 PRO 103 1HB PRO 103 3.975 36.596 7.270 729 HB3 PRO 103 2HB PRO 103 2.403 36.741 8.064 730 HG2 PRO 103 1HG PRO 103 3.400 34.613 6.210 731 HG3 PRO 103 2HG PRO 103 2.468 34.444 7.709 732 HD2 PRO 103 1HD PRO 103 1.325 34.298 5.258 733 HD3 PRO 103 2HD PRO 103 0.472 34.949 6.673 734 HA PRO 104 HA PRO 104 5.183 39.110 3.451 735 HB2 PRO 104 1HB PRO 104 7.109 40.200 5.024 736 HB3 PRO 104 2HB PRO 104 5.593 41.027 4.648 737 HG2 PRO 104 1HG PRO 104 6.354 39.490 7.101 738 HG3 PRO 104 2HG PRO 104 5.494 41.035 6.971 739 HD2 PRO 104 1HD PRO 104 4.216 38.689 7.412 740 HD3 PRO 104 2HD PRO 104 3.482 40.019 6.492 741 H ASN 105 H ASN 105 7.068 38.321 2.549 742 HA ASN 105 HA ASN 105 8.636 36.732 2.091 743 HB2 ASN 105 1HB ASN 105 9.232 37.215 5.017 744 HB3 ASN 105 2HB ASN 105 10.288 36.325 3.924 745 HD21 ASN 105 2HD2 ASN 105 10.417 37.705 1.705 746 HD22 ASN 105 1HD2 ASN 105 10.985 39.316 1.969 747 H ALA 106 H ALA 106 6.125 35.654 2.545 748 HA ALA 106 HA ALA 106 6.757 33.148 3.966 749 HB1 ALA 106 1HB ALA 106 4.870 34.683 4.842 750 HB2 ALA 106 2HB ALA 106 3.951 34.063 3.470 751 HB3 ALA 106 3HB ALA 106 4.564 32.952 4.695 752 H THR 107 H THR 107 6.286 31.208 2.978 753 HA THR 107 HA THR 107 6.056 31.308 0.091 754 HB THR 107 HB THR 107 6.442 28.961 1.959 755 HG1 THR 107 HG1 THR 107 8.566 29.157 1.442 756 HG21 THR 107 3HG2 THR 107 5.628 27.838 0.158 757 HG22 THR 107 1HG2 THR 107 7.281 28.050 -0.417 758 HG23 THR 107 2HG2 THR 107 6.010 29.142 -0.966 759 H LEU 108 H LEU 108 4.234 31.030 -1.011 760 HA LEU 108 HA LEU 108 1.843 30.143 0.422 761 HB2 LEU 108 1HB LEU 108 2.334 31.699 -2.081 762 HB3 LEU 108 2HB LEU 108 0.783 30.897 -1.839 763 HG LEU 108 HG LEU 108 0.666 33.245 -1.214 764 HD11 LEU 108 1HD1 LEU 108 -0.862 32.507 0.214 765 HD12 LEU 108 2HD1 LEU 108 0.385 32.487 1.460 766 HD13 LEU 108 3HD1 LEU 108 0.056 31.033 0.518 767 HD21 LEU 108 3HD2 LEU 108 1.961 34.181 0.563 768 HD22 LEU 108 1HD2 LEU 108 3.076 33.450 -0.591 769 HD23 LEU 108 2HD2 LEU 108 2.701 32.620 0.919 770 H VAL 109 H VAL 109 0.871 28.250 0.043 771 HA VAL 109 HA VAL 109 1.999 26.533 -2.057 772 HB VAL 109 HB VAL 109 0.393 25.807 0.397 773 HG11 VAL 109 1HG1 VAL 109 1.564 23.510 -0.615 774 HG12 VAL 109 2HG1 VAL 109 -0.143 23.947 -0.708 775 HG13 VAL 109 3HG1 VAL 109 0.943 24.340 -2.041 776 HG21 VAL 109 3HG2 VAL 109 3.271 25.976 -0.208 777 HG22 VAL 109 1HG2 VAL 109 2.422 26.105 1.333 778 HG23 VAL 109 2HG2 VAL 109 2.752 24.518 0.639 779 H PHE 110 H PHE 110 0.875 26.487 -3.882 780 HA PHE 110 HA PHE 110 -2.066 26.585 -3.723 781 HB2 PHE 110 1HB PHE 110 -0.169 27.714 -5.770 782 HB3 PHE 110 2HB PHE 110 -1.864 27.423 -6.149 783 HD1 PHE 110 HD1 PHE 110 -3.629 28.645 -4.903 784 HD2 PHE 110 HD2 PHE 110 0.503 29.577 -4.484 785 HE1 PHE 110 HE1 PHE 110 -4.223 30.824 -3.927 786 HE2 PHE 110 HE2 PHE 110 -0.085 31.757 -3.506 787 HZ PHE 110 HZ PHE 110 -2.450 32.383 -3.226 788 H GLU 111 H GLU 111 -3.194 24.956 -4.607 789 HA GLU 111 HA GLU 111 -1.668 22.823 -5.924 790 HB2 GLU 111 1HB GLU 111 -3.043 22.368 -3.831 791 HB3 GLU 111 2HB GLU 111 -4.469 22.620 -4.828 792 HG2 GLU 111 1HG GLU 111 -3.565 20.810 -6.345 793 HG3 GLU 111 2HG GLU 111 -2.399 20.462 -5.069 794 H VAL 112 H VAL 112 -1.852 22.562 -8.041 795 HA VAL 112 HA VAL 112 -4.256 23.615 -9.386 796 HB VAL 112 HB VAL 112 -1.475 23.369 -10.541 797 HG11 VAL 112 1HG1 VAL 112 -2.456 24.719 -12.397 798 HG12 VAL 112 2HG1 VAL 112 -3.113 23.086 -12.264 799 HG13 VAL 112 3HG1 VAL 112 -4.044 24.464 -11.674 800 HG21 VAL 112 3HG2 VAL 112 -1.022 25.398 -9.756 801 HG22 VAL 112 1HG2 VAL 112 -2.514 26.042 -10.442 802 HG23 VAL 112 2HG2 VAL 112 -2.521 25.332 -8.828 803 H GLU 113 H GLU 113 -5.492 22.162 -10.368 804 HA GLU 113 HA GLU 113 -4.266 19.648 -11.283 805 HB2 GLU 113 1HB GLU 113 -6.581 18.635 -10.670 806 HB3 GLU 113 2HB GLU 113 -5.388 18.884 -9.403 807 HG2 GLU 113 1HG GLU 113 -6.564 20.573 -8.428 808 HG3 GLU 113 2HG GLU 113 -7.324 21.066 -9.940 809 H LEU 114 H LEU 114 -4.454 19.516 -13.411 810 HA LEU 114 HA LEU 114 -6.219 21.125 -14.933 811 HB2 LEU 114 1HB LEU 114 -4.291 18.940 -15.497 812 HB3 LEU 114 2HB LEU 114 -5.496 19.306 -16.730 813 HG LEU 114 HG LEU 114 -3.198 20.411 -16.930 814 HD11 LEU 114 1HD1 LEU 114 -4.574 22.730 -17.272 815 HD12 LEU 114 2HD1 LEU 114 -5.877 21.542 -17.289 816 HD13 LEU 114 3HD1 LEU 114 -4.539 21.398 -18.429 817 HD21 LEU 114 3HD2 LEU 114 -4.371 22.200 -14.805 818 HD22 LEU 114 1HD2 LEU 114 -2.841 22.423 -15.654 819 HD23 LEU 114 2HD2 LEU 114 -3.046 21.064 -14.549 820 H LEU 115 H LEU 115 -8.250 20.788 -15.570 821 HA LEU 115 HA LEU 115 -9.450 18.162 -15.014 822 HB2 LEU 115 1HB LEU 115 -10.657 20.910 -15.231 823 HB3 LEU 115 2HB LEU 115 -11.618 19.436 -15.140 824 HG LEU 115 HG LEU 115 -9.632 19.900 -12.985 825 HD11 LEU 115 1HD1 LEU 115 -11.326 21.975 -13.685 826 HD12 LEU 115 2HD1 LEU 115 -10.524 21.748 -12.131 827 HD13 LEU 115 3HD1 LEU 115 -12.167 21.154 -12.371 828 HD21 LEU 115 3HD2 LEU 115 -11.113 18.659 -11.700 829 HD22 LEU 115 1HD2 LEU 115 -11.274 17.929 -13.297 830 HD23 LEU 115 2HD2 LEU 115 -12.495 19.063 -12.720 831 H ASP 116 H ASP 116 -9.136 20.682 -17.453 832 HA ASP 116 HA ASP 116 -9.397 18.818 -19.583 833 HB2 ASP 116 1HB ASP 116 -11.829 19.475 -18.658 834 HB3 ASP 116 2HB ASP 116 -11.578 20.828 -19.758 835 H VAL 117 H VAL 117 -9.052 19.787 -21.669 836 HA VAL 117 HA VAL 117 -8.095 22.570 -21.561 837 HB VAL 117 HB VAL 117 -6.123 21.188 -21.487 838 HG11 VAL 117 1HG1 VAL 117 -5.625 19.463 -23.047 839 HG12 VAL 117 2HG1 VAL 117 -7.254 19.157 -22.441 840 HG13 VAL 117 3HG1 VAL 117 -7.025 19.868 -24.039 841 HG21 VAL 117 3HG2 VAL 117 -5.807 21.770 -24.292 842 HG22 VAL 117 1HG2 VAL 117 -6.667 23.075 -23.474 843 HG23 VAL 117 2HG2 VAL 117 -5.082 22.563 -22.894 844 H11 L2S 130 1H1 L2S 130 -4.942 31.525 -9.534 845 H21 L2S 130 2H1 L2S 130 -4.987 32.275 -11.202 846 H12 L2S 130 1H2 L2S 130 -4.489 34.423 -10.264 847 H22 L2S 130 2H2 L2S 130 -3.182 33.224 -9.814 848 H13 L2S 130 2H3 L2S 130 -4.186 32.995 -7.634 849 H23 L2S 130 1H3 L2S 130 -3.898 34.770 -7.946 850 H14 L2S 130 1H4 L2S 130 -6.836 32.236 -7.892 851 H24 L2S 130 2H4 L2S 130 -7.873 33.630 -8.449 852 H15 L2S 130 1H5 L2S 130 -7.256 31.990 -10.258 853 H25 L2S 130 2H5 L2S 130 -6.765 33.734 -10.520 854 H17 L2S 130 1H7 L2S 130 -8.211 35.477 -7.786 855 H27 L2S 130 2H7 L2S 130 -8.163 34.687 -6.122 856 H9 L2S 130 H9 L2S 130 -8.828 38.782 -3.998 857 H10 L2S 130 H10 L2S 130 -8.465 38.713 -1.531 858 H112 L2S 130 1H12 L2S 130 -6.478 34.843 -1.938 859 H113 L2S 130 1H13 L2S 130 -6.805 34.952 -4.402 860 H114 L2S 130 1H14 L2S 130 -6.214 37.006 0.021 861 H214 L2S 130 2H14 L2S 130 -7.438 35.721 0.163 862 H314 L2S 130 3H14 L2S 130 -7.946 37.444 0.230 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -0.924 6.741 1.942 2 HA2 GLY 1 1HA GLY 1 1.481 6.608 2.507 3 HA3 GLY 1 2HA GLY 1 1.792 6.665 0.778 4 HA PRO 2 HA PRO 2 2.116 10.959 2.585 5 HB2 PRO 2 1HB PRO 2 4.597 11.468 1.607 6 HB3 PRO 2 2HB PRO 2 4.322 10.689 3.169 7 HG2 PRO 2 1HG PRO 2 5.006 9.452 0.530 8 HG3 PRO 2 2HG PRO 2 5.647 9.078 2.140 9 HD2 PRO 2 1HD PRO 2 3.740 7.572 0.945 10 HD3 PRO 2 2HD PRO 2 3.821 7.789 2.705 11 H GLY 3 H GLY 3 2.530 9.480 -0.529 12 HA2 GLY 3 1HA GLY 3 1.732 10.218 -2.578 13 HA3 GLY 3 2HA GLY 3 1.258 11.727 -1.813 14 H SER 4 H SER 4 3.339 12.990 -1.006 15 HA SER 4 HA SER 4 4.993 13.303 -3.402 16 HB2 SER 4 1HB SER 4 5.653 15.485 -2.224 17 HB3 SER 4 2HB SER 4 3.991 15.360 -2.800 18 HG SER 4 HG SER 4 4.385 16.137 -0.552 19 H MET 5 H MET 5 7.249 13.415 -3.309 20 HA MET 5 HA MET 5 8.463 12.431 -0.813 21 HB2 MET 5 1HB MET 5 8.815 11.464 -3.625 22 HB3 MET 5 2HB MET 5 10.151 11.330 -2.489 23 HG2 MET 5 1HG MET 5 7.465 10.307 -1.709 24 HG3 MET 5 2HG MET 5 8.468 9.365 -2.810 25 HE1 MET 5 3HE MET 5 11.464 8.440 -1.245 26 HE2 MET 5 1HE MET 5 10.181 7.248 -1.043 27 HE3 MET 5 2HE MET 5 10.235 8.247 -2.496 28 H THR 6 H THR 6 9.510 13.654 -4.000 29 HA THR 6 HA THR 6 11.259 15.556 -2.579 30 HB THR 6 HB THR 6 11.868 14.471 -5.321 31 HG1 THR 6 HG1 THR 6 12.562 12.685 -4.434 32 HG21 THR 6 3HG2 THR 6 14.231 15.020 -4.124 33 HG22 THR 6 1HG2 THR 6 13.193 16.213 -3.346 34 HG23 THR 6 2HG2 THR 6 13.334 16.179 -5.104 35 H VAL 7 H VAL 7 10.913 17.637 -2.995 36 HA VAL 7 HA VAL 7 9.113 18.343 -5.197 37 HB VAL 7 HB VAL 7 10.044 20.045 -2.880 38 HG11 VAL 7 1HG1 VAL 7 9.440 21.476 -4.664 39 HG12 VAL 7 2HG1 VAL 7 8.027 20.498 -5.066 40 HG13 VAL 7 3HG1 VAL 7 8.054 21.439 -3.574 41 HG21 VAL 7 3HG2 VAL 7 8.596 18.875 -1.657 42 HG22 VAL 7 1HG2 VAL 7 7.313 19.561 -2.653 43 HG23 VAL 7 2HG2 VAL 7 8.013 17.997 -3.070 44 H VAL 8 H VAL 8 10.152 18.756 -7.041 45 HA VAL 8 HA VAL 8 12.836 19.722 -7.154 46 HB VAL 8 HB VAL 8 12.009 18.308 -8.934 47 HG11 VAL 8 1HG1 VAL 8 10.325 19.198 -10.547 48 HG12 VAL 8 2HG1 VAL 8 9.679 18.852 -8.942 49 HG13 VAL 8 3HG1 VAL 8 10.018 20.517 -9.418 50 HG21 VAL 8 3HG2 VAL 8 12.442 21.080 -10.037 51 HG22 VAL 8 1HG2 VAL 8 13.731 20.045 -9.422 52 HG23 VAL 8 2HG2 VAL 8 12.794 19.545 -10.830 53 H THR 9 H THR 9 13.604 21.736 -7.720 54 HA THR 9 HA THR 9 11.639 23.912 -7.935 55 HB THR 9 HB THR 9 14.103 23.959 -6.181 56 HG1 THR 9 HG1 THR 9 12.592 24.077 -4.500 57 HG21 THR 9 3HG2 THR 9 13.906 26.139 -7.026 58 HG22 THR 9 1HG2 THR 9 13.055 26.196 -5.482 59 HG23 THR 9 2HG2 THR 9 12.143 26.090 -6.988 60 H THR 10 H THR 10 12.236 25.644 -9.214 61 HA THR 10 HA THR 10 14.577 25.168 -10.920 62 HB THR 10 HB THR 10 13.544 26.516 -12.593 63 HG1 THR 10 HG1 THR 10 11.949 27.378 -10.448 64 HG21 THR 10 3HG2 THR 10 11.592 25.278 -13.093 65 HG22 THR 10 1HG2 THR 10 11.252 24.978 -11.390 66 HG23 THR 10 2HG2 THR 10 12.622 24.186 -12.169 67 H GLU 11 H GLU 11 15.132 27.569 -11.953 68 HA GLU 11 HA GLU 11 16.439 28.905 -9.763 69 HB2 GLU 11 1HB GLU 11 16.460 29.221 -12.747 70 HB3 GLU 11 2HB GLU 11 17.169 30.459 -11.721 71 HG2 GLU 11 1HG GLU 11 17.949 27.571 -11.512 72 HG3 GLU 11 2HG GLU 11 18.724 28.681 -12.640 73 H SER 12 H SER 12 13.599 29.383 -11.685 74 HA SER 12 HA SER 12 13.238 32.146 -11.357 75 HB2 SER 12 1HB SER 12 11.348 29.859 -11.851 76 HB3 SER 12 2HB SER 12 10.739 31.497 -11.617 77 HG SER 12 HG SER 12 12.689 30.764 -13.545 78 H GLY 13 H GLY 13 12.791 29.490 -9.177 79 HA2 GLY 13 1HA GLY 13 12.829 30.040 -6.795 80 HA3 GLY 13 2HA GLY 13 11.764 31.390 -7.161 81 H LEU 14 H LEU 14 9.920 30.118 -8.822 82 HA LEU 14 HA LEU 14 8.110 29.072 -6.988 83 HB2 LEU 14 1HB LEU 14 6.673 28.755 -8.760 84 HB3 LEU 14 2HB LEU 14 7.758 30.001 -9.374 85 HG LEU 14 HG LEU 14 7.833 27.064 -10.063 86 HD11 LEU 14 1HD1 LEU 14 7.335 28.009 -12.359 87 HD12 LEU 14 2HD1 LEU 14 6.918 29.515 -11.543 88 HD13 LEU 14 3HD1 LEU 14 6.013 28.042 -11.192 89 HD21 LEU 14 3HD2 LEU 14 9.546 29.332 -11.074 90 HD22 LEU 14 1HD2 LEU 14 9.591 27.660 -11.632 91 HD23 LEU 14 2HD2 LEU 14 10.076 28.052 -9.982 92 H LYS 15 H LYS 15 7.087 26.873 -7.118 93 HA LYS 15 HA LYS 15 8.915 24.722 -7.842 94 HB2 LYS 15 1HB LYS 15 7.740 24.816 -5.067 95 HB3 LYS 15 2HB LYS 15 8.960 23.712 -5.690 96 HG2 LYS 15 1HG LYS 15 10.515 25.627 -5.907 97 HG3 LYS 15 2HG LYS 15 9.296 26.655 -5.151 98 HD2 LYS 15 1HD LYS 15 10.232 24.144 -3.808 99 HD3 LYS 15 2HD LYS 15 11.165 25.637 -3.680 100 HE2 LYS 15 1HE LYS 15 9.324 26.780 -2.672 101 HE3 LYS 15 2HE LYS 15 8.238 25.430 -2.995 102 HZ1 LYS 15 3HZ LYS 15 8.747 24.721 -0.969 103 HZ2 LYS 15 1HZ LYS 15 10.008 25.836 -0.799 104 HZ3 LYS 15 2HZ LYS 15 10.293 24.345 -1.546 105 H TYR 16 H TYR 16 7.857 22.554 -7.548 106 HA TYR 16 HA TYR 16 4.969 22.537 -7.417 107 HB2 TYR 16 1HB TYR 16 4.743 21.459 -9.666 108 HB3 TYR 16 2HB TYR 16 5.216 23.153 -9.728 109 HD1 TYR 16 HD1 TYR 16 7.612 23.735 -10.200 110 HD2 TYR 16 HD2 TYR 16 6.118 19.770 -10.594 111 HE1 TYR 16 HE1 TYR 16 9.557 23.146 -11.585 112 HE2 TYR 16 HE2 TYR 16 8.059 19.170 -11.979 113 HH TYR 16 HH TYR 16 9.710 20.402 -13.466 114 H GLU 17 H GLU 17 4.117 20.511 -7.010 115 HA GLU 17 HA GLU 17 6.063 18.313 -6.767 116 HB2 GLU 17 1HB GLU 17 5.568 19.212 -4.550 117 HB3 GLU 17 2HB GLU 17 3.844 19.019 -4.839 118 HG2 GLU 17 1HG GLU 17 4.987 17.266 -3.408 119 HG3 GLU 17 2HG GLU 17 3.963 16.691 -4.723 120 H ASP 18 H ASP 18 5.458 16.386 -7.572 121 HA ASP 18 HA ASP 18 3.062 16.244 -9.140 122 HB2 ASP 18 1HB ASP 18 5.302 14.312 -8.570 123 HB3 ASP 18 2HB ASP 18 3.882 13.832 -9.495 124 H LEU 19 H LEU 19 1.128 15.611 -8.472 125 HA LEU 19 HA LEU 19 0.950 13.994 -6.017 126 HB2 LEU 19 1HB LEU 19 -0.583 16.293 -7.033 127 HB3 LEU 19 2HB LEU 19 -1.542 15.003 -6.313 128 HG LEU 19 HG LEU 19 -0.005 15.230 -4.284 129 HD11 LEU 19 1HD1 LEU 19 0.533 17.955 -5.422 130 HD12 LEU 19 2HD1 LEU 19 1.665 16.616 -5.608 131 HD13 LEU 19 3HD1 LEU 19 1.242 17.196 -3.997 132 HD21 LEU 19 3HD2 LEU 19 -1.556 16.565 -3.308 133 HD22 LEU 19 1HD2 LEU 19 -2.409 16.259 -4.821 134 HD23 LEU 19 2HD2 LEU 19 -1.508 17.760 -4.605 135 H THR 20 H THR 20 -0.400 14.483 -9.246 136 HA THR 20 HA THR 20 -1.075 11.653 -9.363 137 HB THR 20 HB THR 20 -3.179 13.618 -10.222 138 HG1 THR 20 HG1 THR 20 -2.987 12.373 -7.662 139 HG21 THR 20 3HG2 THR 20 -2.978 10.678 -9.776 140 HG22 THR 20 1HG2 THR 20 -3.741 11.567 -11.093 141 HG23 THR 20 2HG2 THR 20 -4.534 11.467 -9.520 142 H GLU 21 H GLU 21 -0.188 10.931 -11.175 143 HA GLU 21 HA GLU 21 0.678 12.631 -13.271 144 HB2 GLU 21 1HB GLU 21 1.676 10.396 -12.616 145 HB3 GLU 21 2HB GLU 21 0.317 9.640 -13.435 146 HG2 GLU 21 1HG GLU 21 1.056 11.065 -15.462 147 HG3 GLU 21 2HG GLU 21 2.582 11.206 -14.590 148 H GLY 22 H GLY 22 -0.804 13.712 -14.434 149 HA2 GLY 22 1HA GLY 22 -3.410 12.881 -15.006 150 HA3 GLY 22 2HA GLY 22 -2.519 14.098 -15.908 151 H SER 23 H SER 23 -0.658 12.945 -17.277 152 HA SER 23 HA SER 23 -0.162 11.663 -19.090 153 HB2 SER 23 1HB SER 23 -0.626 9.827 -17.324 154 HB3 SER 23 2HB SER 23 -2.159 9.608 -18.168 155 HG SER 23 HG SER 23 -0.871 9.315 -20.103 156 H GLY 24 H GLY 24 -2.423 13.561 -19.071 157 HA2 GLY 24 1HA GLY 24 -4.201 12.350 -21.076 158 HA3 GLY 24 2HA GLY 24 -4.532 13.820 -20.171 159 H ALA 25 H ALA 25 -2.775 15.582 -20.584 160 HA ALA 25 HA ALA 25 -1.389 15.677 -23.016 161 HB1 ALA 25 1HB ALA 25 -4.197 16.007 -23.316 162 HB2 ALA 25 2HB ALA 25 -3.413 17.550 -23.659 163 HB3 ALA 25 3HB ALA 25 -2.937 16.101 -24.546 164 H GLU 26 H GLU 26 0.064 17.255 -22.820 165 HA GLU 26 HA GLU 26 0.130 18.975 -20.610 166 HB2 GLU 26 1HB GLU 26 2.158 18.319 -21.775 167 HB3 GLU 26 2HB GLU 26 1.619 19.136 -23.235 168 HG2 GLU 26 1HG GLU 26 1.694 21.283 -22.016 169 HG3 GLU 26 2HG GLU 26 2.343 20.430 -20.617 170 H ALA 27 H ALA 27 -0.699 20.931 -20.229 171 HA ALA 27 HA ALA 27 -2.713 22.060 -21.743 172 HB1 ALA 27 1HB ALA 27 -1.242 24.073 -20.260 173 HB2 ALA 27 2HB ALA 27 -2.882 23.466 -20.023 174 HB3 ALA 27 3HB ALA 27 -1.513 22.609 -19.314 175 H ARG 28 H ARG 28 -2.828 23.420 -23.435 176 HA ARG 28 HA ARG 28 -0.315 24.175 -24.724 177 HB2 ARG 28 1HB ARG 28 -3.163 24.026 -25.699 178 HB3 ARG 28 2HB ARG 28 -1.883 24.770 -26.647 179 HG2 ARG 28 1HG ARG 28 -1.478 22.008 -25.619 180 HG3 ARG 28 2HG ARG 28 -2.549 22.262 -26.998 181 HD2 ARG 28 1HD ARG 28 0.133 23.553 -27.015 182 HD3 ARG 28 2HD ARG 28 0.031 21.820 -27.321 183 HE ARG 28 HE ARG 28 -1.846 23.051 -28.954 184 HH11 ARG 28 1HH1 ARG 28 1.610 23.016 -28.543 185 HH12 ARG 28 2HH1 ARG 28 1.943 23.349 -30.210 186 HH21 ARG 28 1HH2 ARG 28 -1.421 23.489 -31.152 187 HH22 ARG 28 2HH2 ARG 28 0.218 23.619 -31.693 188 H ALA 29 H ALA 29 -0.136 26.319 -25.715 189 HA ALA 29 HA ALA 29 -1.161 28.363 -23.897 190 HB1 ALA 29 1HB ALA 29 0.874 29.218 -24.100 191 HB2 ALA 29 2HB ALA 29 1.296 27.966 -25.268 192 HB3 ALA 29 3HB ALA 29 0.591 29.485 -25.821 193 H GLY 30 H GLY 30 -2.168 30.274 -24.635 194 HA2 GLY 30 1HA GLY 30 -3.359 31.622 -26.101 195 HA3 GLY 30 2HA GLY 30 -2.887 30.556 -27.416 196 H GLN 31 H GLN 31 -4.055 28.562 -25.111 197 HA GLN 31 HA GLN 31 -6.793 28.705 -26.190 198 HB2 GLN 31 1HB GLN 31 -5.152 26.288 -25.426 199 HB3 GLN 31 2HB GLN 31 -6.872 26.226 -25.789 200 HG2 GLN 31 1HG GLN 31 -6.199 27.338 -28.021 201 HG3 GLN 31 2HG GLN 31 -4.576 26.781 -27.617 202 HE21 GLN 31 2HE2 GLN 31 -4.083 24.648 -27.790 203 HE22 GLN 31 1HE2 GLN 31 -5.164 23.460 -28.425 204 H THR 32 H THR 32 -8.513 28.087 -24.789 205 HA THR 32 HA THR 32 -8.015 28.839 -22.031 206 HB THR 32 HB THR 32 -10.692 28.038 -23.151 207 HG1 THR 32 HG1 THR 32 -9.325 29.822 -24.301 208 HG21 THR 32 3HG2 THR 32 -11.361 28.621 -21.107 209 HG22 THR 32 1HG2 THR 32 -10.823 30.268 -21.434 210 HG23 THR 32 2HG2 THR 32 -9.725 29.115 -20.674 211 H VAL 33 H VAL 33 -7.468 27.361 -20.578 212 HA VAL 33 HA VAL 33 -8.504 24.620 -20.890 213 HB VAL 33 HB VAL 33 -6.603 23.823 -19.636 214 HG11 VAL 33 1HG1 VAL 33 -5.146 23.896 -21.362 215 HG12 VAL 33 2HG1 VAL 33 -6.494 24.694 -22.175 216 HG13 VAL 33 3HG1 VAL 33 -5.193 25.655 -21.470 217 HG21 VAL 33 3HG2 VAL 33 -4.849 25.967 -19.426 218 HG22 VAL 33 1HG2 VAL 33 -6.396 26.604 -18.867 219 HG23 VAL 33 2HG2 VAL 33 -5.704 25.171 -18.105 220 H SER 34 H SER 34 -9.460 23.592 -19.169 221 HA SER 34 HA SER 34 -10.262 25.339 -16.956 222 HB2 SER 34 1HB SER 34 -11.709 23.573 -18.574 223 HB3 SER 34 2HB SER 34 -11.589 22.761 -17.013 224 HG SER 34 HG SER 34 -13.412 24.191 -17.205 225 H VAL 35 H VAL 35 -9.365 25.099 -15.028 226 HA VAL 35 HA VAL 35 -8.519 22.448 -14.134 227 HB VAL 35 HB VAL 35 -6.334 23.092 -13.497 228 HG11 VAL 35 1HG1 VAL 35 -6.745 22.618 -15.938 229 HG12 VAL 35 2HG1 VAL 35 -6.691 24.362 -16.202 230 HG13 VAL 35 3HG1 VAL 35 -5.274 23.520 -15.573 231 HG21 VAL 35 3HG2 VAL 35 -7.408 25.817 -13.787 232 HG22 VAL 35 1HG2 VAL 35 -6.218 25.178 -12.653 233 HG23 VAL 35 2HG2 VAL 35 -5.732 25.605 -14.293 234 H HIS 36 H HIS 36 -7.995 22.418 -11.797 235 HA HIS 36 HA HIS 36 -9.686 24.349 -10.359 236 HB2 HIS 36 1HB HIS 36 -9.210 21.448 -10.082 237 HB3 HIS 36 2HB HIS 36 -9.297 22.343 -8.568 238 HD1 HIS 36 HD1 HIS 36 -11.514 24.372 -9.449 239 HD2 HIS 36 HD2 HIS 36 -11.677 20.255 -9.979 240 HE1 HIS 36 HE1 HIS 36 -13.959 23.815 -9.639 241 H TYR 37 H TYR 37 -8.840 25.625 -8.826 242 HA TYR 37 HA TYR 37 -6.029 25.163 -8.067 243 HB2 TYR 37 1HB TYR 37 -5.754 27.569 -7.880 244 HB3 TYR 37 2HB TYR 37 -6.362 27.169 -9.483 245 HD1 TYR 37 HD2 TYR 37 -7.333 28.510 -6.172 246 HD2 TYR 37 HD1 TYR 37 -8.425 28.035 -10.257 247 HE1 TYR 37 HE2 TYR 37 -9.195 30.084 -5.851 248 HE2 TYR 37 HE1 TYR 37 -10.290 29.609 -9.948 249 HH TYR 37 HH TYR 37 -11.649 30.538 -8.228 250 H THR 38 H THR 38 -5.443 25.386 -5.936 251 HA THR 38 HA THR 38 -7.548 26.041 -3.998 252 HB THR 38 HB THR 38 -5.873 23.930 -2.967 253 HG1 THR 38 HG1 THR 38 -6.146 23.551 -5.440 254 HG21 THR 38 3HG2 THR 38 -8.746 24.599 -3.221 255 HG22 THR 38 1HG2 THR 38 -7.821 24.098 -1.806 256 HG23 THR 38 2HG2 THR 38 -8.347 22.897 -2.986 257 H GLY 39 H GLY 39 -6.799 27.722 -2.886 258 HA2 GLY 39 1HA GLY 39 -3.939 28.110 -2.541 259 HA3 GLY 39 2HA GLY 39 -5.208 29.237 -2.088 260 H TRP 40 H TRP 40 -2.806 27.579 -0.800 261 HA TRP 40 HA TRP 40 -4.236 27.182 1.741 262 HB2 TRP 40 1HB TRP 40 -2.276 25.347 0.388 263 HB3 TRP 40 2HB TRP 40 -2.469 25.325 2.139 264 HD1 TRP 40 HD1 TRP 40 -5.579 25.535 2.410 265 HE1 TRP 40 HE1 TRP 40 -7.091 23.601 1.637 266 HE3 TRP 40 HE3 TRP 40 -2.366 23.243 -0.839 267 HZ2 TRP 40 HZ2 TRP 40 -6.941 21.395 -0.119 268 HZ3 TRP 40 HZ3 TRP 40 -3.128 21.226 -2.025 269 HH2 TRP 40 HH2 TRP 40 -5.368 20.323 -1.671 270 H LEU 41 H LEU 41 -3.293 28.054 3.502 271 HA LEU 41 HA LEU 41 -1.096 29.843 3.136 272 HB2 LEU 41 1HB LEU 41 -3.014 29.185 5.249 273 HB3 LEU 41 2HB LEU 41 -1.426 29.667 5.841 274 HG LEU 41 HG LEU 41 -3.194 31.302 4.022 275 HD11 LEU 41 1HD1 LEU 41 -4.270 31.656 5.969 276 HD12 LEU 41 2HD1 LEU 41 -2.920 32.749 6.273 277 HD13 LEU 41 3HD1 LEU 41 -2.905 31.120 6.948 278 HD21 LEU 41 3HD2 LEU 41 -1.055 32.690 5.379 279 HD22 LEU 41 1HD2 LEU 41 -1.468 32.657 3.664 280 HD23 LEU 41 2HD2 LEU 41 -0.433 31.401 4.346 281 H THR 42 H THR 42 0.714 29.833 4.847 282 HA THR 42 HA THR 42 2.397 27.675 4.391 283 HB THR 42 HB THR 42 3.803 28.543 6.216 284 HG1 THR 42 HG1 THR 42 2.977 29.777 7.734 285 HG21 THR 42 3HG2 THR 42 2.588 30.474 4.267 286 HG22 THR 42 1HG2 THR 42 4.169 29.694 4.217 287 HG23 THR 42 2HG2 THR 42 3.858 30.985 5.378 288 H ASP 43 H ASP 43 -0.055 28.113 6.814 289 HA ASP 43 HA ASP 43 0.860 25.820 8.360 290 HB2 ASP 43 1HB ASP 43 -1.621 27.495 8.781 291 HB3 ASP 43 2HB ASP 43 -0.880 26.385 9.930 292 H GLY 44 H GLY 44 -1.332 26.558 5.827 293 HA2 GLY 44 1HA GLY 44 -2.127 24.619 4.547 294 HA3 GLY 44 2HA GLY 44 -2.497 23.855 6.085 295 H GLN 45 H GLN 45 -3.253 27.085 6.299 296 HA GLN 45 HA GLN 45 -6.044 26.582 6.414 297 HB2 GLN 45 1HB GLN 45 -4.262 28.909 6.788 298 HB3 GLN 45 2HB GLN 45 -5.913 29.284 6.313 299 HG2 GLN 45 1HG GLN 45 -5.298 27.464 8.614 300 HG3 GLN 45 2HG GLN 45 -5.389 29.215 8.798 301 HE21 GLN 45 2HE2 GLN 45 -7.057 27.061 9.911 302 HE22 GLN 45 1HE2 GLN 45 -8.676 27.436 9.438 303 H LYS 46 H LYS 46 -7.452 26.483 4.806 304 HA LYS 46 HA LYS 46 -6.700 27.146 2.122 305 HB2 LYS 46 1HB LYS 46 -8.212 25.235 2.806 306 HB3 LYS 46 2HB LYS 46 -9.459 26.435 3.119 307 HG2 LYS 46 1HG LYS 46 -9.735 26.930 0.887 308 HG3 LYS 46 2HG LYS 46 -8.120 26.362 0.454 309 HD2 LYS 46 1HD LYS 46 -9.782 24.809 -0.371 310 HD3 LYS 46 2HD LYS 46 -8.844 24.047 0.916 311 HE2 LYS 46 1HE LYS 46 -11.151 23.508 1.253 312 HE3 LYS 46 2HE LYS 46 -10.665 24.649 2.506 313 HZ1 LYS 46 3HZ LYS 46 -12.174 25.314 0.036 314 HZ2 LYS 46 1HZ LYS 46 -11.677 26.431 1.205 315 HZ3 LYS 46 2HZ LYS 46 -12.811 25.240 1.601 316 H PHE 47 H PHE 47 -6.996 28.999 1.071 317 HA PHE 47 HA PHE 47 -8.966 30.916 2.123 318 HB2 PHE 47 1HB PHE 47 -7.387 32.747 1.525 319 HB3 PHE 47 2HB PHE 47 -6.785 31.705 2.810 320 HD1 PHE 47 HD2 PHE 47 -6.546 32.340 -0.836 321 HD2 PHE 47 HD1 PHE 47 -4.716 30.651 2.617 322 HE1 PHE 47 HE2 PHE 47 -4.483 31.957 -2.120 323 HE2 PHE 47 HE1 PHE 47 -2.650 30.266 1.337 324 HZ PHE 47 HZ PHE 47 -2.532 30.918 -1.035 325 H ASP 48 H ASP 48 -8.682 28.929 -0.224 326 HA ASP 48 HA ASP 48 -10.237 30.342 -2.073 327 HB2 ASP 48 1HB ASP 48 -7.547 31.026 -2.302 328 HB3 ASP 48 2HB ASP 48 -7.802 29.842 -3.581 329 H SER 49 H SER 49 -11.405 28.830 -3.043 330 HA SER 49 HA SER 49 -10.176 26.410 -4.054 331 HB2 SER 49 1HB SER 49 -10.824 26.029 -1.592 332 HB3 SER 49 2HB SER 49 -12.494 26.091 -2.155 333 HG SER 49 HG SER 49 -10.733 24.429 -3.534 334 H SER 50 H SER 50 -10.873 26.605 -6.092 335 HA SER 50 HA SER 50 -13.207 27.834 -6.963 336 HB2 SER 50 1HB SER 50 -11.097 26.240 -8.136 337 HB3 SER 50 2HB SER 50 -12.656 25.828 -8.849 338 HG SER 50 HG SER 50 -12.869 28.265 -8.959 339 H LYS 51 H LYS 51 -12.705 24.663 -5.670 340 HA LYS 51 HA LYS 51 -14.899 23.287 -6.693 341 HB2 LYS 51 1HB LYS 51 -13.646 23.071 -3.949 342 HB3 LYS 51 2HB LYS 51 -14.745 21.891 -4.651 343 HG2 LYS 51 1HG LYS 51 -12.163 22.651 -5.977 344 HG3 LYS 51 2HG LYS 51 -12.262 21.377 -4.759 345 HD2 LYS 51 1HD LYS 51 -14.187 21.296 -7.023 346 HD3 LYS 51 2HD LYS 51 -12.507 20.866 -7.351 347 HE2 LYS 51 1HE LYS 51 -13.396 18.820 -6.788 348 HE3 LYS 51 2HE LYS 51 -12.779 19.368 -5.231 349 HZ1 LYS 51 3HZ LYS 51 -14.815 19.363 -4.383 350 HZ2 LYS 51 1HZ LYS 51 -15.342 18.572 -5.783 351 HZ3 LYS 51 2HZ LYS 51 -15.449 20.256 -5.673 352 H ASP 52 H ASP 52 -14.718 25.746 -4.236 353 HA ASP 52 HA ASP 52 -17.090 25.356 -2.861 354 HB2 ASP 52 1HB ASP 52 -15.201 27.153 -2.586 355 HB3 ASP 52 2HB ASP 52 -16.242 28.128 -3.619 356 H ARG 53 H ARG 53 -16.559 27.163 -5.874 357 HA ARG 53 HA ARG 53 -19.338 27.796 -6.184 358 HB2 ARG 53 1HB ARG 53 -17.292 29.081 -7.100 359 HB3 ARG 53 2HB ARG 53 -17.301 27.889 -8.393 360 HG2 ARG 53 1HG ARG 53 -19.338 28.625 -9.229 361 HG3 ARG 53 2HG ARG 53 -19.774 29.431 -7.721 362 HD2 ARG 53 1HD ARG 53 -17.468 30.298 -9.450 363 HD3 ARG 53 2HD ARG 53 -19.100 30.943 -9.625 364 HE ARG 53 HE ARG 53 -17.196 31.593 -7.586 365 HH11 ARG 53 1HH1 ARG 53 -20.588 31.389 -8.340 366 HH12 ARG 53 2HH1 ARG 53 -21.056 32.564 -7.157 367 HH21 ARG 53 1HH2 ARG 53 -17.799 33.142 -6.024 368 HH22 ARG 53 2HH2 ARG 53 -19.468 33.561 -5.840 369 H ASN 54 H ASN 54 -17.533 25.017 -6.682 370 HA ASN 54 HA ASN 54 -17.989 23.005 -7.639 371 HB2 ASN 54 1HB ASN 54 -20.769 24.069 -8.160 372 HB3 ASN 54 2HB ASN 54 -20.276 22.385 -8.009 373 HD21 ASN 54 2HD2 ASN 54 -19.395 21.737 -5.896 374 HD22 ASN 54 1HD2 ASN 54 -20.076 22.449 -4.476 375 H ASP 55 H ASP 55 -16.669 24.730 -9.243 376 HA ASP 55 HA ASP 55 -17.362 23.772 -11.852 377 HB2 ASP 55 1HB ASP 55 -18.894 25.607 -11.884 378 HB3 ASP 55 2HB ASP 55 -17.692 26.704 -11.211 379 HA PRO 56 HA PRO 56 -12.979 24.111 -12.160 380 HB2 PRO 56 1HB PRO 56 -12.737 23.751 -14.840 381 HB3 PRO 56 2HB PRO 56 -13.117 22.434 -13.724 382 HG2 PRO 56 1HG PRO 56 -14.955 24.031 -15.466 383 HG3 PRO 56 2HG PRO 56 -14.937 22.284 -15.164 384 HD2 PRO 56 1HD PRO 56 -16.672 23.958 -13.931 385 HD3 PRO 56 2HD PRO 56 -16.040 22.493 -13.151 386 H PHE 57 H PHE 57 -11.446 25.638 -12.606 387 HA PHE 57 HA PHE 57 -12.403 28.215 -13.512 388 HB2 PHE 57 1HB PHE 57 -10.985 28.244 -11.582 389 HB3 PHE 57 2HB PHE 57 -9.755 27.286 -12.398 390 HD1 PHE 57 HD1 PHE 57 -11.628 30.281 -13.561 391 HD2 PHE 57 HD2 PHE 57 -7.865 28.612 -12.481 392 HE1 PHE 57 HE1 PHE 57 -10.507 32.348 -14.287 393 HE2 PHE 57 HE2 PHE 57 -6.738 30.676 -13.204 394 HZ PHE 57 HZ PHE 57 -8.059 32.548 -14.107 395 H ALA 58 H ALA 58 -12.614 28.380 -15.667 396 HA ALA 58 HA ALA 58 -10.577 27.250 -17.423 397 HB1 ALA 58 1HB ALA 58 -13.044 28.717 -18.305 398 HB2 ALA 58 2HB ALA 58 -12.094 27.525 -19.192 399 HB3 ALA 58 3HB ALA 58 -13.083 27.022 -17.822 400 H PHE 59 H PHE 59 -8.957 28.420 -18.202 401 HA PHE 59 HA PHE 59 -9.313 31.251 -18.756 402 HB2 PHE 59 1HB PHE 59 -7.511 32.021 -17.414 403 HB3 PHE 59 2HB PHE 59 -8.498 31.012 -16.361 404 HD1 PHE 59 HD2 PHE 59 -7.737 28.707 -15.811 405 HD2 PHE 59 HD1 PHE 59 -5.263 31.488 -17.875 406 HE1 PHE 59 HE2 PHE 59 -5.759 27.355 -15.253 407 HE2 PHE 59 HE1 PHE 59 -3.280 30.139 -17.321 408 HZ PHE 59 HZ PHE 59 -3.526 28.071 -16.008 409 H VAL 60 H VAL 60 -7.603 32.146 -20.071 410 HA VAL 60 HA VAL 60 -6.574 30.201 -21.937 411 HB VAL 60 HB VAL 60 -6.218 33.202 -21.905 412 HG11 VAL 60 1HG1 VAL 60 -5.718 32.881 -24.322 413 HG12 VAL 60 2HG1 VAL 60 -4.513 32.173 -23.245 414 HG13 VAL 60 3HG1 VAL 60 -5.700 31.140 -24.042 415 HG21 VAL 60 3HG2 VAL 60 -7.979 33.128 -23.689 416 HG22 VAL 60 1HG2 VAL 60 -8.259 31.443 -23.251 417 HG23 VAL 60 2HG2 VAL 60 -8.548 32.721 -22.070 418 H LEU 61 H LEU 61 -4.643 29.280 -21.822 419 HA LEU 61 HA LEU 61 -2.731 30.041 -19.841 420 HB2 LEU 61 1HB LEU 61 -2.810 27.756 -20.267 421 HB3 LEU 61 2HB LEU 61 -2.821 27.985 -22.014 422 HG LEU 61 HG LEU 61 -0.481 28.494 -22.027 423 HD11 LEU 61 1HD1 LEU 61 0.369 29.565 -20.274 424 HD12 LEU 61 2HD1 LEU 61 0.466 27.997 -19.473 425 HD13 LEU 61 3HD1 LEU 61 -0.940 29.031 -19.220 426 HD21 LEU 61 3HD2 LEU 61 -1.537 26.033 -21.336 427 HD22 LEU 61 1HD2 LEU 61 -0.205 26.258 -20.202 428 HD23 LEU 61 2HD2 LEU 61 0.092 26.344 -21.938 429 H GLY 62 H GLY 62 -1.038 31.371 -20.006 430 HA2 GLY 62 1HA GLY 62 0.745 32.489 -21.012 431 HA3 GLY 62 2HA GLY 62 0.202 31.897 -22.575 432 H GLY 63 H GLY 63 -1.957 33.524 -20.361 433 HA2 GLY 63 1HA GLY 63 -2.209 35.693 -22.328 434 HA3 GLY 63 2HA GLY 63 -3.419 35.248 -21.135 435 H GLY 64 H GLY 64 -3.679 36.781 -19.663 436 HA2 GLY 64 1HA GLY 64 -1.353 37.871 -18.302 437 HA3 GLY 64 2HA GLY 64 -2.315 39.035 -19.202 438 H MET 65 H MET 65 -3.544 36.232 -17.448 439 HA MET 65 HA MET 65 -4.689 38.038 -15.433 440 HB2 MET 65 1HB MET 65 -6.187 36.956 -17.460 441 HB3 MET 65 2HB MET 65 -6.413 35.781 -16.171 442 HG2 MET 65 1HG MET 65 -7.259 37.468 -14.698 443 HG3 MET 65 2HG MET 65 -6.871 38.736 -15.858 444 HE1 MET 65 3HE MET 65 -9.934 39.622 -16.714 445 HE2 MET 65 1HE MET 65 -8.197 39.774 -16.976 446 HE3 MET 65 2HE MET 65 -9.222 39.093 -18.239 447 H VAL 66 H VAL 66 -2.400 36.202 -15.391 448 HA VAL 66 HA VAL 66 -3.188 34.691 -13.026 449 HB VAL 66 HB VAL 66 -2.200 32.623 -13.741 450 HG11 VAL 66 1HG1 VAL 66 -4.578 33.241 -14.421 451 HG12 VAL 66 2HG1 VAL 66 -3.928 33.474 -16.045 452 HG13 VAL 66 3HG1 VAL 66 -3.823 31.893 -15.270 453 HG21 VAL 66 3HG2 VAL 66 -1.032 34.299 -15.801 454 HG22 VAL 66 1HG2 VAL 66 -0.514 32.725 -15.196 455 HG23 VAL 66 2HG2 VAL 66 -1.737 32.824 -16.463 456 H ILE 67 H ILE 67 -1.050 33.485 -12.223 457 HA ILE 67 HA ILE 67 1.009 35.577 -12.129 458 HB ILE 67 HB ILE 67 1.695 34.741 -10.029 459 HG12 ILE 67 1HG1 ILE 67 -0.065 32.346 -10.592 460 HG13 ILE 67 2HG1 ILE 67 1.694 32.362 -10.522 461 HG21 ILE 67 1HG2 ILE 67 -1.082 34.230 -9.393 462 HG22 ILE 67 2HG2 ILE 67 -0.048 35.580 -8.928 463 HG23 ILE 67 3HG2 ILE 67 -0.898 35.612 -10.473 464 HD11 ILE 67 3HD1 ILE 67 -0.238 32.748 -8.255 465 HD12 ILE 67 1HD1 ILE 67 0.903 31.425 -8.497 466 HD13 ILE 67 2HD1 ILE 67 1.496 33.044 -8.124 467 H LYS 68 H LYS 68 3.280 34.786 -11.852 468 HA LYS 68 HA LYS 68 4.177 33.401 -14.046 469 HB2 LYS 68 1HB LYS 68 5.396 33.900 -11.348 470 HB3 LYS 68 2HB LYS 68 6.255 32.943 -12.548 471 HG2 LYS 68 1HG LYS 68 6.014 34.873 -14.126 472 HG3 LYS 68 2HG LYS 68 5.391 35.814 -12.770 473 HD2 LYS 68 1HD LYS 68 7.699 36.313 -12.910 474 HD3 LYS 68 2HD LYS 68 7.520 35.211 -11.542 475 HE2 LYS 68 1HE LYS 68 8.229 33.345 -12.937 476 HE3 LYS 68 2HE LYS 68 8.357 34.416 -14.331 477 HZ1 LYS 68 3HZ LYS 68 9.871 35.170 -11.959 478 HZ2 LYS 68 1HZ LYS 68 10.285 35.297 -13.595 479 HZ3 LYS 68 2HZ LYS 68 10.419 33.809 -12.801 480 H GLY 69 H GLY 69 3.881 32.081 -10.740 481 HA2 GLY 69 1HA GLY 69 4.601 29.460 -11.306 482 HA3 GLY 69 2HA GLY 69 3.521 29.937 -10.005 483 H TRP 70 H TRP 70 1.624 31.114 -11.997 484 HA TRP 70 HA TRP 70 0.032 28.774 -12.363 485 HB2 TRP 70 1HB TRP 70 -0.361 31.603 -12.428 486 HB3 TRP 70 2HB TRP 70 -0.997 30.920 -13.922 487 HD1 TRP 70 HD1 TRP 70 -3.419 30.122 -13.770 488 HE1 TRP 70 HE1 TRP 70 -5.018 29.420 -11.879 489 HE3 TRP 70 HE3 TRP 70 -0.180 30.392 -9.823 490 HZ2 TRP 70 HZ2 TRP 70 -4.920 29.033 -9.085 491 HZ3 TRP 70 HZ3 TRP 70 -1.012 29.840 -7.575 492 HH2 TRP 70 HH2 TRP 70 -3.334 29.175 -7.215 493 H ASP 71 H ASP 71 1.355 31.112 -14.715 494 HA ASP 71 HA ASP 71 0.720 29.714 -17.024 495 HB2 ASP 71 1HB ASP 71 1.475 31.967 -17.220 496 HB3 ASP 71 2HB ASP 71 3.000 31.597 -16.420 497 H GLU 72 H GLU 72 3.695 29.556 -15.085 498 HA GLU 72 HA GLU 72 4.999 27.651 -16.713 499 HB2 GLU 72 1HB GLU 72 5.613 29.128 -14.406 500 HB3 GLU 72 2HB GLU 72 5.771 27.441 -13.938 501 HG2 GLU 72 1HG GLU 72 7.393 27.033 -15.614 502 HG3 GLU 72 2HG GLU 72 7.084 28.589 -16.383 503 H GLY 73 H GLY 73 2.999 27.334 -13.802 504 HA2 GLY 73 1HA GLY 73 3.293 24.613 -13.337 505 HA3 GLY 73 2HA GLY 73 1.848 25.538 -12.954 506 H VAL 74 H VAL 74 0.648 26.142 -15.183 507 HA VAL 74 HA VAL 74 -0.358 23.665 -16.144 508 HB VAL 74 HB VAL 74 -1.653 25.105 -17.755 509 HG11 VAL 74 1HG1 VAL 74 -1.768 25.809 -14.824 510 HG12 VAL 74 2HG1 VAL 74 -3.046 26.132 -15.997 511 HG13 VAL 74 3HG1 VAL 74 -2.595 24.469 -15.618 512 HG21 VAL 74 3HG2 VAL 74 -1.228 27.285 -18.042 513 HG22 VAL 74 1HG2 VAL 74 -1.001 27.560 -16.314 514 HG23 VAL 74 2HG2 VAL 74 0.330 26.941 -17.291 515 H GLN 75 H GLN 75 2.081 25.867 -17.256 516 HA GLN 75 HA GLN 75 2.201 25.323 -19.961 517 HB2 GLN 75 1HB GLN 75 4.011 26.362 -17.936 518 HB3 GLN 75 2HB GLN 75 4.866 25.463 -19.182 519 HG2 GLN 75 1HG GLN 75 3.761 26.861 -20.893 520 HG3 GLN 75 2HG GLN 75 3.025 27.805 -19.600 521 HE21 GLN 75 2HE2 GLN 75 4.432 28.974 -18.173 522 HE22 GLN 75 1HE2 GLN 75 5.971 29.521 -18.737 523 H GLY 76 H GLY 76 3.105 23.312 -17.270 524 HA2 GLY 76 1HA GLY 76 4.095 21.280 -19.174 525 HA3 GLY 76 2HA GLY 76 4.682 21.433 -17.525 526 H MET 77 H MET 77 1.914 21.954 -16.545 527 HA MET 77 HA MET 77 1.240 19.429 -15.671 528 HB2 MET 77 1HB MET 77 0.365 21.787 -14.967 529 HB3 MET 77 2HB MET 77 -0.904 21.471 -16.142 530 HG2 MET 77 1HG MET 77 -1.770 19.700 -14.926 531 HG3 MET 77 2HG MET 77 -0.280 19.471 -14.014 532 HE1 MET 77 3HE MET 77 -2.272 23.410 -13.792 533 HE2 MET 77 1HE MET 77 -2.440 22.237 -15.099 534 HE3 MET 77 2HE MET 77 -3.628 22.282 -13.796 535 H LYS 78 H LYS 78 -0.375 17.928 -16.243 536 HA LYS 78 HA LYS 78 -1.200 18.065 -19.070 537 HB2 LYS 78 1HB LYS 78 -0.514 15.641 -17.399 538 HB3 LYS 78 2HB LYS 78 -1.166 15.575 -19.031 539 HG2 LYS 78 1HG LYS 78 0.809 16.064 -19.978 540 HG3 LYS 78 2HG LYS 78 1.241 17.228 -18.724 541 HD2 LYS 78 1HD LYS 78 1.198 14.613 -17.581 542 HD3 LYS 78 2HD LYS 78 2.173 14.577 -19.052 543 HE2 LYS 78 1HE LYS 78 3.811 15.297 -17.689 544 HE3 LYS 78 2HE LYS 78 3.053 16.871 -17.925 545 HZ1 LYS 78 3HZ LYS 78 1.669 16.281 -15.903 546 HZ2 LYS 78 1HZ LYS 78 3.298 16.646 -15.628 547 HZ3 LYS 78 2HZ LYS 78 2.779 15.036 -15.623 548 H VAL 79 H VAL 79 -3.245 17.152 -19.620 549 HA VAL 79 HA VAL 79 -5.358 17.873 -17.983 550 HB VAL 79 HB VAL 79 -5.396 15.747 -20.129 551 HG11 VAL 79 1HG1 VAL 79 -7.412 15.522 -18.977 552 HG12 VAL 79 2HG1 VAL 79 -7.557 17.259 -18.702 553 HG13 VAL 79 3HG1 VAL 79 -7.811 16.596 -20.317 554 HG21 VAL 79 3HG2 VAL 79 -4.788 18.460 -20.360 555 HG22 VAL 79 1HG2 VAL 79 -5.219 17.350 -21.661 556 HG23 VAL 79 2HG2 VAL 79 -6.468 18.318 -20.877 557 H GLY 80 H GLY 80 -6.233 17.018 -16.215 558 HA2 GLY 80 1HA GLY 80 -7.058 15.360 -14.800 559 HA3 GLY 80 2HA GLY 80 -6.324 14.146 -15.836 560 H GLY 81 H GLY 81 -3.974 16.369 -15.277 561 HA2 GLY 81 1HA GLY 81 -2.773 14.669 -13.222 562 HA3 GLY 81 2HA GLY 81 -1.929 15.845 -14.218 563 H VAL 82 H VAL 82 -2.390 15.277 -11.182 564 HA VAL 82 HA VAL 82 -3.050 18.054 -10.449 565 HB VAL 82 HB VAL 82 -3.178 15.612 -8.676 566 HG11 VAL 82 1HG1 VAL 82 -2.898 17.332 -7.189 567 HG12 VAL 82 2HG1 VAL 82 -3.653 18.521 -8.252 568 HG13 VAL 82 3HG1 VAL 82 -4.651 17.361 -7.374 569 HG21 VAL 82 3HG2 VAL 82 -5.737 16.527 -8.920 570 HG22 VAL 82 1HG2 VAL 82 -5.104 16.780 -10.547 571 HG23 VAL 82 2HG2 VAL 82 -5.057 15.173 -9.822 572 H ARG 83 H ARG 83 -1.541 19.268 -9.487 573 HA ARG 83 HA ARG 83 0.720 18.011 -8.145 574 HB2 ARG 83 1HB ARG 83 2.285 19.577 -9.414 575 HB3 ARG 83 2HB ARG 83 1.676 18.180 -10.292 576 HG2 ARG 83 1HG ARG 83 -0.033 19.620 -11.337 577 HG3 ARG 83 2HG ARG 83 0.677 21.010 -10.513 578 HD2 ARG 83 1HD ARG 83 2.494 19.298 -12.111 579 HD3 ARG 83 2HD ARG 83 1.350 20.307 -12.995 580 HE ARG 83 HE ARG 83 2.542 21.957 -11.136 581 HH11 ARG 83 1HH1 ARG 83 3.572 19.988 -13.816 582 HH12 ARG 83 2HH1 ARG 83 4.928 20.994 -14.204 583 HH21 ARG 83 1HH2 ARG 83 4.324 23.291 -11.637 584 HH22 ARG 83 2HH2 ARG 83 5.355 22.872 -12.963 585 H ARG 84 H ARG 84 1.585 19.239 -6.522 586 HA ARG 84 HA ARG 84 0.064 21.592 -5.762 587 HB2 ARG 84 1HB ARG 84 1.114 19.536 -4.313 588 HB3 ARG 84 2HB ARG 84 2.343 20.773 -4.083 589 HG2 ARG 84 1HG ARG 84 0.530 22.327 -3.352 590 HG3 ARG 84 2HG ARG 84 -0.581 20.957 -3.406 591 HD2 ARG 84 1HD ARG 84 1.192 19.808 -1.886 592 HD3 ARG 84 2HD ARG 84 1.724 21.459 -1.570 593 HE ARG 84 HE ARG 84 -1.033 21.379 -1.196 594 HH11 ARG 84 1HH1 ARG 84 1.840 20.016 0.223 595 HH12 ARG 84 2HH1 ARG 84 1.155 19.893 1.810 596 HH21 ARG 84 1HH2 ARG 84 -1.945 21.223 0.889 597 HH22 ARG 84 2HH2 ARG 84 -0.998 20.579 2.187 598 H LEU 85 H LEU 85 0.672 23.389 -6.821 599 HA LEU 85 HA LEU 85 3.473 23.915 -7.369 600 HB2 LEU 85 1HB LEU 85 1.824 24.422 -9.077 601 HB3 LEU 85 2HB LEU 85 0.985 25.507 -7.970 602 HG LEU 85 HG LEU 85 3.397 26.678 -7.983 603 HD11 LEU 85 1HD1 LEU 85 4.067 24.844 -9.691 604 HD12 LEU 85 2HD1 LEU 85 4.544 26.517 -9.979 605 HD13 LEU 85 3HD1 LEU 85 3.165 25.833 -10.840 606 HD21 LEU 85 3HD2 LEU 85 1.096 27.588 -8.540 607 HD22 LEU 85 1HD2 LEU 85 1.437 27.149 -10.214 608 HD23 LEU 85 2HD2 LEU 85 2.459 28.324 -9.385 609 H THR 86 H THR 86 4.748 24.939 -5.989 610 HA THR 86 HA THR 86 3.551 26.507 -3.825 611 HB THR 86 HB THR 86 6.484 25.932 -3.978 612 HG1 THR 86 HG1 THR 86 4.887 23.992 -4.290 613 HG21 THR 86 3HG2 THR 86 5.020 27.259 -2.165 614 HG22 THR 86 1HG2 THR 86 6.471 26.351 -1.745 615 HG23 THR 86 2HG2 THR 86 4.879 25.628 -1.509 616 H ILE 87 H ILE 87 3.469 28.640 -3.990 617 HA ILE 87 HA ILE 87 5.437 29.997 -5.714 618 HB ILE 87 HB ILE 87 2.661 30.944 -4.994 619 HG12 ILE 87 1HG1 ILE 87 2.507 30.611 -7.623 620 HG13 ILE 87 2HG1 ILE 87 3.762 29.416 -7.311 621 HG21 ILE 87 1HG2 ILE 87 4.293 32.746 -5.373 622 HG22 ILE 87 2HG2 ILE 87 4.651 32.067 -6.960 623 HG23 ILE 87 3HG2 ILE 87 3.042 32.702 -6.616 624 HD11 ILE 87 3HD1 ILE 87 0.949 29.194 -6.971 625 HD12 ILE 87 1HD1 ILE 87 2.195 27.966 -6.753 626 HD13 ILE 87 2HD1 ILE 87 1.732 29.001 -5.402 627 HA PRO 88 HA PRO 88 6.925 31.947 -2.031 628 HB2 PRO 88 1HB PRO 88 8.440 33.849 -3.238 629 HB3 PRO 88 2HB PRO 88 8.925 32.152 -3.143 630 HG2 PRO 88 1HG PRO 88 7.660 33.636 -5.415 631 HG3 PRO 88 2HG PRO 88 8.990 32.463 -5.447 632 HD2 PRO 88 1HD PRO 88 6.447 31.800 -6.099 633 HD3 PRO 88 2HD PRO 88 7.565 30.655 -5.331 634 HA PRO 89 HA PRO 89 4.559 35.565 -1.226 635 HB2 PRO 89 1HB PRO 89 6.278 37.147 0.157 636 HB3 PRO 89 2HB PRO 89 5.567 35.679 0.836 637 HG2 PRO 89 1HG PRO 89 8.277 36.089 -0.366 638 HG3 PRO 89 2HG PRO 89 7.826 35.192 1.096 639 HD2 PRO 89 1HD PRO 89 8.334 33.969 -1.266 640 HD3 PRO 89 2HD PRO 89 7.155 33.338 -0.098 641 H GLN 90 H GLN 90 7.237 35.716 -3.267 642 HA GLN 90 HA GLN 90 6.841 38.550 -3.894 643 HB2 GLN 90 1HB GLN 90 9.155 37.411 -3.568 644 HB3 GLN 90 2HB GLN 90 8.895 36.787 -5.192 645 HG2 GLN 90 1HG GLN 90 10.115 38.702 -5.576 646 HG3 GLN 90 2HG GLN 90 8.457 39.250 -5.819 647 HE21 GLN 90 2HE2 GLN 90 7.452 40.471 -4.154 648 HE22 GLN 90 1HE2 GLN 90 8.402 41.374 -3.028 649 H LEU 91 H LEU 91 6.736 35.343 -5.379 650 HA LEU 91 HA LEU 91 5.690 36.468 -7.857 651 HB2 LEU 91 1HB LEU 91 6.182 33.577 -7.178 652 HB3 LEU 91 2HB LEU 91 5.922 34.268 -8.778 653 HG LEU 91 HG LEU 91 8.348 34.591 -7.018 654 HD11 LEU 91 1HD1 LEU 91 7.683 33.032 -9.458 655 HD12 LEU 91 2HD1 LEU 91 8.679 32.595 -8.070 656 HD13 LEU 91 3HD1 LEU 91 9.312 33.689 -9.300 657 HD21 LEU 91 3HD2 LEU 91 8.602 36.585 -7.988 658 HD22 LEU 91 1HD2 LEU 91 7.312 36.280 -9.152 659 HD23 LEU 91 2HD2 LEU 91 8.944 35.689 -9.469 660 H GLY 92 H GLY 92 4.263 36.219 -5.131 661 HA2 GLY 92 1HA GLY 92 1.880 34.787 -6.132 662 HA3 GLY 92 2HA GLY 92 2.289 34.947 -4.430 663 H TYR 93 H TYR 93 1.374 36.548 -3.314 664 HA TYR 93 HA TYR 93 -0.594 38.193 -4.490 665 HB2 TYR 93 1HB TYR 93 0.674 38.034 -1.782 666 HB3 TYR 93 2HB TYR 93 -0.357 39.406 -2.173 667 HD1 TYR 93 HD2 TYR 93 -0.335 35.679 -2.168 668 HD2 TYR 93 HD1 TYR 93 -2.662 39.231 -1.906 669 HE1 TYR 93 HE2 TYR 93 -2.321 34.331 -1.629 670 HE2 TYR 93 HE1 TYR 93 -4.654 37.893 -1.364 671 HH TYR 93 HH TYR 93 -4.703 35.046 -0.230 672 H GLY 94 H GLY 94 2.773 38.731 -3.641 673 HA2 GLY 94 1HA GLY 94 3.826 40.397 -5.224 674 HA3 GLY 94 2HA GLY 94 2.545 41.479 -4.699 675 H ALA 95 H ALA 95 4.852 42.571 -4.370 676 HA ALA 95 HA ALA 95 6.420 41.922 -2.156 677 HB1 ALA 95 1HB ALA 95 7.178 43.508 -3.803 678 HB2 ALA 95 2HB ALA 95 5.875 44.620 -3.384 679 HB3 ALA 95 3HB ALA 95 7.154 44.282 -2.219 680 H ARG 96 H ARG 96 3.396 43.681 -2.384 681 HA ARG 96 HA ARG 96 3.475 44.632 0.327 682 HB2 ARG 96 1HB ARG 96 1.443 44.655 -1.875 683 HB3 ARG 96 2HB ARG 96 0.949 45.036 -0.231 684 HG2 ARG 96 1HG ARG 96 3.314 46.453 -1.325 685 HG3 ARG 96 2HG ARG 96 1.720 46.900 -1.937 686 HD2 ARG 96 1HD ARG 96 1.032 47.068 0.523 687 HD3 ARG 96 2HD ARG 96 2.759 47.041 0.876 688 HE ARG 96 HE ARG 96 2.158 49.006 -1.078 689 HH11 ARG 96 1HH1 ARG 96 1.934 48.351 2.334 690 HH12 ARG 96 2HH1 ARG 96 1.981 50.022 2.790 691 HH21 ARG 96 1HH2 ARG 96 2.221 51.209 -0.490 692 HH22 ARG 96 2HH2 ARG 96 2.143 51.647 1.183 693 H GLY 97 H GLY 97 1.219 42.403 -1.322 694 HA2 GLY 97 1HA GLY 97 0.197 40.482 -0.582 695 HA3 GLY 97 2HA GLY 97 1.447 40.378 0.649 696 H ALA 98 H ALA 98 -1.546 39.972 0.669 697 HA ALA 98 HA ALA 98 -2.903 41.950 2.033 698 HB1 ALA 98 1HB ALA 98 -4.420 40.265 2.772 699 HB2 ALA 98 2HB ALA 98 -3.860 39.809 1.162 700 HB3 ALA 98 3HB ALA 98 -3.200 39.004 2.586 701 H GLY 99 H GLY 99 -2.638 42.898 3.943 702 HA2 GLY 99 1HA GLY 99 -0.607 42.006 5.761 703 HA3 GLY 99 2HA GLY 99 -1.670 43.388 5.981 704 H GLY 100 H GLY 100 -1.304 39.936 6.452 705 HA2 GLY 100 1HA GLY 100 -2.340 39.591 8.872 706 HA3 GLY 100 2HA GLY 100 -3.813 39.776 7.931 707 H VAL 101 H VAL 101 -3.300 38.408 5.653 708 HA VAL 101 HA VAL 101 -3.007 35.659 6.652 709 HB VAL 101 HB VAL 101 -4.277 36.531 4.057 710 HG11 VAL 101 1HG1 VAL 101 -4.536 33.945 5.585 711 HG12 VAL 101 2HG1 VAL 101 -5.203 34.315 3.993 712 HG13 VAL 101 3HG1 VAL 101 -3.457 34.190 4.212 713 HG21 VAL 101 3HG2 VAL 101 -6.432 36.256 5.151 714 HG22 VAL 101 1HG2 VAL 101 -5.627 35.878 6.674 715 HG23 VAL 101 2HG2 VAL 101 -5.478 37.490 5.974 716 H ILE 102 H ILE 102 -1.838 37.931 4.262 717 HA ILE 102 HA ILE 102 0.083 35.905 3.318 718 HB ILE 102 HB ILE 102 -0.735 38.426 1.873 719 HG12 ILE 102 1HG1 ILE 102 -2.639 36.904 2.026 720 HG13 ILE 102 2HG1 ILE 102 -2.017 36.936 0.380 721 HG21 ILE 102 1HG2 ILE 102 1.306 37.913 0.978 722 HG22 ILE 102 2HG2 ILE 102 1.137 36.188 1.299 723 HG23 ILE 102 3HG2 ILE 102 0.265 36.924 -0.045 724 HD11 ILE 102 3HD1 ILE 102 -1.521 34.794 2.433 725 HD12 ILE 102 1HD1 ILE 102 -2.582 34.682 1.029 726 HD13 ILE 102 2HD1 ILE 102 -0.838 34.828 0.807 727 HA PRO 103 HA PRO 103 2.497 39.042 5.743 728 HB2 PRO 103 1HB PRO 103 4.043 37.208 7.015 729 HB3 PRO 103 2HB PRO 103 2.463 37.719 7.621 730 HG2 PRO 103 1HG PRO 103 3.193 35.267 6.066 731 HG3 PRO 103 2HG PRO 103 2.116 35.425 7.466 732 HD2 PRO 103 1HD PRO 103 1.190 35.244 4.927 733 HD3 PRO 103 2HD PRO 103 0.355 36.180 6.184 734 HA PRO 104 HA PRO 104 6.060 39.056 3.166 735 HB2 PRO 104 1HB PRO 104 8.018 39.890 4.852 736 HB3 PRO 104 2HB PRO 104 6.739 40.958 4.262 737 HG2 PRO 104 1HG PRO 104 6.953 39.530 6.884 738 HG3 PRO 104 2HG PRO 104 6.437 41.194 6.555 739 HD2 PRO 104 1HD PRO 104 4.679 39.189 7.023 740 HD3 PRO 104 2HD PRO 104 4.312 40.548 5.940 741 H ASN 105 H ASN 105 7.869 37.876 2.551 742 HA ASN 105 HA ASN 105 9.136 35.991 2.375 743 HB2 ASN 105 1HB ASN 105 9.458 36.606 5.316 744 HB3 ASN 105 2HB ASN 105 10.399 35.379 4.474 745 HD21 ASN 105 2HD2 ASN 105 11.925 37.111 5.565 746 HD22 ASN 105 1HD2 ASN 105 12.518 38.305 4.466 747 H ALA 106 H ALA 106 6.362 35.526 2.662 748 HA ALA 106 HA ALA 106 6.312 33.034 4.232 749 HB1 ALA 106 1HB ALA 106 4.651 35.054 4.612 750 HB2 ALA 106 2HB ALA 106 3.791 34.284 3.278 751 HB3 ALA 106 3HB ALA 106 4.119 33.379 4.756 752 H THR 107 H THR 107 6.051 31.152 3.203 753 HA THR 107 HA THR 107 5.879 31.159 0.310 754 HB THR 107 HB THR 107 6.226 28.877 2.264 755 HG1 THR 107 HG1 THR 107 8.160 29.797 2.236 756 HG21 THR 107 3HG2 THR 107 5.316 27.808 0.424 757 HG22 THR 107 1HG2 THR 107 7.038 27.755 0.052 758 HG23 THR 107 2HG2 THR 107 6.006 28.960 -0.719 759 H LEU 108 H LEU 108 4.060 30.901 -0.799 760 HA LEU 108 HA LEU 108 1.653 30.021 0.612 761 HB2 LEU 108 1HB LEU 108 2.162 31.552 -1.907 762 HB3 LEU 108 2HB LEU 108 0.603 30.775 -1.641 763 HG LEU 108 HG LEU 108 0.484 33.113 -1.042 764 HD11 LEU 108 1HD1 LEU 108 0.430 32.227 1.683 765 HD12 LEU 108 2HD1 LEU 108 -0.205 30.967 0.626 766 HD13 LEU 108 3HD1 LEU 108 -0.912 32.582 0.596 767 HD21 LEU 108 3HD2 LEU 108 2.465 32.688 1.160 768 HD22 LEU 108 1HD2 LEU 108 1.900 34.194 0.437 769 HD23 LEU 108 2HD2 LEU 108 3.006 33.149 -0.455 770 H VAL 109 H VAL 109 0.704 28.117 0.242 771 HA VAL 109 HA VAL 109 1.856 26.391 -1.833 772 HB VAL 109 HB VAL 109 0.180 25.684 0.579 773 HG11 VAL 109 1HG1 VAL 109 -0.328 23.827 -0.547 774 HG12 VAL 109 2HG1 VAL 109 0.825 24.197 -1.831 775 HG13 VAL 109 3HG1 VAL 109 1.368 23.376 -0.367 776 HG21 VAL 109 3HG2 VAL 109 3.076 25.846 0.061 777 HG22 VAL 109 1HG2 VAL 109 2.181 25.991 1.574 778 HG23 VAL 109 2HG2 VAL 109 2.529 24.397 0.904 779 H PHE 110 H PHE 110 0.778 26.363 -3.688 780 HA PHE 110 HA PHE 110 -2.166 26.468 -3.601 781 HB2 PHE 110 1HB PHE 110 -0.202 27.618 -5.563 782 HB3 PHE 110 2HB PHE 110 -1.858 27.274 -6.049 783 HD1 PHE 110 HD1 PHE 110 -3.720 28.523 -5.096 784 HD2 PHE 110 HD2 PHE 110 0.312 29.427 -4.077 785 HE1 PHE 110 HE1 PHE 110 -4.443 30.686 -4.172 786 HE2 PHE 110 HE2 PHE 110 -0.404 31.591 -3.151 787 HZ PHE 110 HZ PHE 110 -2.784 32.223 -3.196 788 H GLU 111 H GLU 111 -3.281 24.845 -4.512 789 HA GLU 111 HA GLU 111 -1.730 22.723 -5.829 790 HB2 GLU 111 1HB GLU 111 -2.910 22.037 -3.798 791 HB3 GLU 111 2HB GLU 111 -4.430 22.605 -4.474 792 HG2 GLU 111 1HG GLU 111 -3.957 20.936 -6.375 793 HG3 GLU 111 2HG GLU 111 -2.796 20.226 -5.254 794 H VAL 112 H VAL 112 -1.938 22.486 -7.946 795 HA VAL 112 HA VAL 112 -4.406 23.456 -9.237 796 HB VAL 112 HB VAL 112 -1.713 23.314 -10.582 797 HG11 VAL 112 1HG1 VAL 112 -4.139 24.947 -11.298 798 HG12 VAL 112 2HG1 VAL 112 -2.701 24.651 -12.279 799 HG13 VAL 112 3HG1 VAL 112 -3.829 23.336 -11.945 800 HG21 VAL 112 3HG2 VAL 112 -2.075 25.951 -10.266 801 HG22 VAL 112 1HG2 VAL 112 -2.832 25.373 -8.782 802 HG23 VAL 112 2HG2 VAL 112 -1.153 24.963 -9.133 803 H GLU 113 H GLU 113 -5.530 22.029 -10.402 804 HA GLU 113 HA GLU 113 -4.193 19.566 -11.291 805 HB2 GLU 113 1HB GLU 113 -6.419 18.406 -10.758 806 HB3 GLU 113 2HB GLU 113 -5.358 18.794 -9.411 807 HG2 GLU 113 1HG GLU 113 -6.815 20.235 -8.508 808 HG3 GLU 113 2HG GLU 113 -7.305 20.881 -10.073 809 H LEU 114 H LEU 114 -4.345 19.394 -13.418 810 HA LEU 114 HA LEU 114 -6.032 21.010 -15.004 811 HB2 LEU 114 1HB LEU 114 -3.793 19.652 -15.499 812 HB3 LEU 114 2HB LEU 114 -4.956 18.481 -16.119 813 HG LEU 114 HG LEU 114 -4.236 19.755 -17.972 814 HD11 LEU 114 1HD1 LEU 114 -6.709 19.371 -17.709 815 HD12 LEU 114 2HD1 LEU 114 -6.252 20.687 -18.789 816 HD13 LEU 114 3HD1 LEU 114 -6.830 21.044 -17.162 817 HD21 LEU 114 3HD2 LEU 114 -3.274 21.719 -17.533 818 HD22 LEU 114 1HD2 LEU 114 -4.178 21.921 -16.032 819 HD23 LEU 114 2HD2 LEU 114 -4.903 22.397 -17.568 820 H LEU 115 H LEU 115 -8.065 20.742 -15.660 821 HA LEU 115 HA LEU 115 -9.355 18.150 -15.136 822 HB2 LEU 115 1HB LEU 115 -10.464 20.944 -15.271 823 HB3 LEU 115 2HB LEU 115 -11.482 19.506 -15.239 824 HG LEU 115 HG LEU 115 -9.507 19.744 -13.056 825 HD11 LEU 115 1HD1 LEU 115 -10.797 22.047 -13.656 826 HD12 LEU 115 2HD1 LEU 115 -10.302 21.575 -12.031 827 HD13 LEU 115 3HD1 LEU 115 -11.957 21.285 -12.567 828 HD21 LEU 115 3HD2 LEU 115 -11.227 18.736 -11.783 829 HD22 LEU 115 1HD2 LEU 115 -11.239 17.932 -13.353 830 HD23 LEU 115 2HD2 LEU 115 -12.456 19.153 -12.978 831 H ASP 116 H ASP 116 -8.828 20.648 -17.534 832 HA ASP 116 HA ASP 116 -9.221 18.857 -19.691 833 HB2 ASP 116 1HB ASP 116 -11.615 19.439 -18.875 834 HB3 ASP 116 2HB ASP 116 -11.320 21.008 -19.619 835 H VAL 117 H VAL 117 -8.879 19.877 -21.780 836 HA VAL 117 HA VAL 117 -7.783 22.599 -21.635 837 HB VAL 117 HB VAL 117 -5.862 21.132 -21.468 838 HG11 VAL 117 1HG1 VAL 117 -5.358 19.398 -22.982 839 HG12 VAL 117 2HG1 VAL 117 -7.060 19.182 -22.569 840 HG13 VAL 117 3HG1 VAL 117 -6.611 19.912 -24.111 841 HG21 VAL 117 3HG2 VAL 117 -4.699 22.488 -22.796 842 HG22 VAL 117 1HG2 VAL 117 -5.407 21.773 -24.245 843 HG23 VAL 117 2HG2 VAL 117 -6.237 23.090 -23.416 844 H11 L2S 130 1H1 L2S 130 -5.207 31.621 -9.353 845 H21 L2S 130 2H1 L2S 130 -5.259 32.342 -11.033 846 H12 L2S 130 1H2 L2S 130 -4.807 34.515 -10.129 847 H22 L2S 130 2H2 L2S 130 -3.480 33.350 -9.653 848 H13 L2S 130 2H3 L2S 130 -4.488 33.136 -7.474 849 H23 L2S 130 1H3 L2S 130 -4.233 34.911 -7.814 850 H14 L2S 130 1H4 L2S 130 -7.122 32.322 -7.730 851 H24 L2S 130 2H4 L2S 130 -8.183 33.686 -8.315 852 H15 L2S 130 1H5 L2S 130 -7.526 32.029 -10.094 853 H25 L2S 130 2H5 L2S 130 -7.068 33.777 -10.383 854 H17 L2S 130 1H7 L2S 130 -8.560 35.537 -7.683 855 H27 L2S 130 2H7 L2S 130 -8.504 34.774 -6.006 856 H9 L2S 130 H9 L2S 130 -9.220 38.919 -3.959 857 H10 L2S 130 H10 L2S 130 -8.890 38.883 -1.486 858 H112 L2S 130 1H12 L2S 130 -6.956 34.979 -1.807 859 H113 L2S 130 1H13 L2S 130 -7.248 35.054 -4.276 860 H114 L2S 130 1H14 L2S 130 -6.672 37.109 0.119 861 H214 L2S 130 2H14 L2S 130 -7.989 35.921 0.275 862 H314 L2S 130 3H14 L2S 130 -8.369 37.678 0.295 Start of MODEL 4 1 H1 GLY 1 H GLY 1 13.856 5.214 -16.659 2 HA2 GLY 1 1HA GLY 1 12.059 5.140 -15.184 3 HA3 GLY 1 2HA GLY 1 13.076 5.870 -13.951 4 HA PRO 2 HA PRO 2 10.019 8.950 -15.895 5 HB2 PRO 2 1HB PRO 2 8.288 9.134 -13.812 6 HB3 PRO 2 2HB PRO 2 8.085 7.974 -15.130 7 HG2 PRO 2 1HG PRO 2 9.224 7.552 -12.394 8 HG3 PRO 2 2HG PRO 2 8.110 6.523 -13.313 9 HD2 PRO 2 1HD PRO 2 10.763 6.008 -13.140 10 HD3 PRO 2 2HD PRO 2 9.804 5.604 -14.579 11 H GLY 3 H GLY 3 10.104 11.127 -15.443 12 HA2 GLY 3 1HA GLY 3 11.938 11.895 -13.305 13 HA3 GLY 3 2HA GLY 3 11.415 12.910 -14.640 14 H SER 4 H SER 4 9.486 11.069 -12.298 15 HA SER 4 HA SER 4 8.441 13.614 -11.258 16 HB2 SER 4 1HB SER 4 6.196 12.907 -11.424 17 HB3 SER 4 2HB SER 4 6.914 12.444 -12.967 18 HG SER 4 HG SER 4 5.582 10.839 -11.693 19 H MET 5 H MET 5 10.434 11.817 -10.172 20 HA MET 5 HA MET 5 9.012 10.722 -7.840 21 HB2 MET 5 1HB MET 5 11.718 10.076 -9.011 22 HB3 MET 5 2HB MET 5 11.185 9.486 -7.443 23 HG2 MET 5 1HG MET 5 9.125 8.628 -8.818 24 HG3 MET 5 2HG MET 5 10.254 8.745 -10.167 25 HE1 MET 5 3HE MET 5 8.578 6.772 -8.126 26 HE2 MET 5 1HE MET 5 9.416 5.222 -8.193 27 HE3 MET 5 2HE MET 5 9.603 6.265 -6.783 28 H THR 6 H THR 6 11.383 13.028 -8.886 29 HA THR 6 HA THR 6 11.865 13.794 -6.081 30 HB THR 6 HB THR 6 13.660 14.666 -8.320 31 HG1 THR 6 HG1 THR 6 14.020 12.262 -6.838 32 HG21 THR 6 3HG2 THR 6 14.203 15.774 -6.348 33 HG22 THR 6 1HG2 THR 6 15.310 14.401 -6.338 34 HG23 THR 6 2HG2 THR 6 13.853 14.367 -5.344 35 H VAL 7 H VAL 7 12.235 16.132 -5.729 36 HA VAL 7 HA VAL 7 10.344 17.693 -7.340 37 HB VAL 7 HB VAL 7 9.846 17.632 -4.962 38 HG11 VAL 7 1HG1 VAL 7 12.627 17.746 -4.661 39 HG12 VAL 7 2HG1 VAL 7 12.006 19.242 -3.963 40 HG13 VAL 7 3HG1 VAL 7 11.411 17.685 -3.386 41 HG21 VAL 7 3HG2 VAL 7 9.361 19.681 -6.250 42 HG22 VAL 7 1HG2 VAL 7 9.676 20.011 -4.547 43 HG23 VAL 7 2HG2 VAL 7 10.920 20.339 -5.753 44 H VAL 8 H VAL 8 11.015 19.286 -8.624 45 HA VAL 8 HA VAL 8 13.809 20.191 -8.366 46 HB VAL 8 HB VAL 8 13.468 19.035 -10.460 47 HG11 VAL 8 1HG1 VAL 8 11.090 20.840 -10.691 48 HG12 VAL 8 2HG1 VAL 8 11.851 20.161 -12.131 49 HG13 VAL 8 3HG1 VAL 8 11.187 19.091 -10.895 50 HG21 VAL 8 3HG2 VAL 8 14.099 20.815 -12.034 51 HG22 VAL 8 1HG2 VAL 8 13.592 22.024 -10.854 52 HG23 VAL 8 2HG2 VAL 8 14.953 20.961 -10.498 53 H THR 9 H THR 9 14.275 22.369 -8.471 54 HA THR 9 HA THR 9 11.952 24.180 -8.336 55 HB THR 9 HB THR 9 14.602 24.429 -6.899 56 HG1 THR 9 HG1 THR 9 12.713 22.976 -6.171 57 HG21 THR 9 3HG2 THR 9 14.077 26.639 -7.233 58 HG22 THR 9 1HG2 THR 9 13.164 26.325 -5.758 59 HG23 THR 9 2HG2 THR 9 12.343 26.328 -7.320 60 H THR 10 H THR 10 12.050 26.131 -9.411 61 HA THR 10 HA THR 10 13.851 26.234 -11.653 62 HB THR 10 HB THR 10 12.618 28.258 -12.307 63 HG1 THR 10 HG1 THR 10 11.573 29.344 -10.832 64 HG21 THR 10 3HG2 THR 10 11.511 25.646 -11.953 65 HG22 THR 10 1HG2 THR 10 11.186 26.821 -13.226 66 HG23 THR 10 2HG2 THR 10 10.237 26.846 -11.740 67 H GLU 11 H GLU 11 14.568 28.688 -12.163 68 HA GLU 11 HA GLU 11 16.558 29.262 -10.155 69 HB2 GLU 11 1HB GLU 11 15.991 30.223 -12.929 70 HB3 GLU 11 2HB GLU 11 17.037 31.182 -11.892 71 HG2 GLU 11 1HG GLU 11 18.549 29.863 -13.003 72 HG3 GLU 11 2HG GLU 11 18.294 28.947 -11.519 73 H SER 12 H SER 12 13.582 30.686 -11.327 74 HA SER 12 HA SER 12 13.898 33.195 -10.016 75 HB2 SER 12 1HB SER 12 11.288 31.912 -10.836 76 HB3 SER 12 2HB SER 12 11.629 33.632 -10.646 77 HG SER 12 HG SER 12 11.794 33.296 -12.788 78 H GLY 13 H GLY 13 12.681 30.072 -9.071 79 HA2 GLY 13 1HA GLY 13 12.878 29.799 -6.561 80 HA3 GLY 13 2HA GLY 13 11.831 31.209 -6.481 81 H LEU 14 H LEU 14 10.349 30.191 -8.899 82 HA LEU 14 HA LEU 14 8.179 29.042 -7.642 83 HB2 LEU 14 1HB LEU 14 7.802 29.926 -9.766 84 HB3 LEU 14 2HB LEU 14 9.126 29.010 -10.482 85 HG LEU 14 HG LEU 14 7.771 26.944 -10.212 86 HD11 LEU 14 1HD1 LEU 14 6.231 28.542 -8.533 87 HD12 LEU 14 2HD1 LEU 14 5.874 26.899 -9.062 88 HD13 LEU 14 3HD1 LEU 14 5.226 28.273 -9.957 89 HD21 LEU 14 3HD2 LEU 14 5.971 27.744 -11.928 90 HD22 LEU 14 1HD2 LEU 14 7.678 27.736 -12.370 91 HD23 LEU 14 2HD2 LEU 14 6.897 29.246 -11.899 92 H LYS 15 H LYS 15 7.460 26.984 -7.262 93 HA LYS 15 HA LYS 15 9.212 24.750 -7.996 94 HB2 LYS 15 1HB LYS 15 8.042 24.984 -5.230 95 HB3 LYS 15 2HB LYS 15 9.268 23.858 -5.799 96 HG2 LYS 15 1HG LYS 15 10.751 25.875 -6.174 97 HG3 LYS 15 2HG LYS 15 9.554 26.799 -5.262 98 HD2 LYS 15 1HD LYS 15 9.992 24.580 -3.681 99 HD3 LYS 15 2HD LYS 15 11.594 24.944 -4.325 100 HE2 LYS 15 1HE LYS 15 10.828 27.418 -3.662 101 HE3 LYS 15 2HE LYS 15 9.874 26.509 -2.490 102 HZ1 LYS 15 3HZ LYS 15 11.760 25.672 -1.480 103 HZ2 LYS 15 1HZ LYS 15 12.235 27.251 -1.859 104 HZ3 LYS 15 2HZ LYS 15 12.751 25.959 -2.820 105 H TYR 16 H TYR 16 8.152 22.632 -7.746 106 HA TYR 16 HA TYR 16 5.271 22.603 -7.496 107 HB2 TYR 16 1HB TYR 16 5.068 21.453 -9.777 108 HB3 TYR 16 2HB TYR 16 5.283 23.200 -9.775 109 HD1 TYR 16 HD2 TYR 16 7.068 19.986 -10.254 110 HD2 TYR 16 HD1 TYR 16 7.116 24.195 -10.874 111 HE1 TYR 16 HE2 TYR 16 9.021 19.740 -11.728 112 HE2 TYR 16 HE1 TYR 16 9.069 23.961 -12.351 113 HH TYR 16 HH TYR 16 10.254 20.824 -13.346 114 H GLU 17 H GLU 17 4.478 20.612 -6.958 115 HA GLU 17 HA GLU 17 6.372 18.360 -6.979 116 HB2 GLU 17 1HB GLU 17 6.173 19.408 -4.711 117 HB3 GLU 17 2HB GLU 17 4.466 18.986 -4.720 118 HG2 GLU 17 1HG GLU 17 5.183 16.591 -5.038 119 HG3 GLU 17 2HG GLU 17 6.826 17.131 -4.696 120 H ASP 18 H ASP 18 5.587 16.732 -8.123 121 HA ASP 18 HA ASP 18 3.026 16.591 -9.190 122 HB2 ASP 18 1HB ASP 18 3.581 14.160 -9.610 123 HB3 ASP 18 2HB ASP 18 4.765 15.318 -10.210 124 H LEU 19 H LEU 19 1.122 15.729 -8.555 125 HA LEU 19 HA LEU 19 1.042 14.435 -5.909 126 HB2 LEU 19 1HB LEU 19 -0.436 16.719 -6.984 127 HB3 LEU 19 2HB LEU 19 -1.461 15.494 -6.239 128 HG LEU 19 HG LEU 19 -0.155 15.704 -4.157 129 HD11 LEU 19 1HD1 LEU 19 1.422 17.525 -3.883 130 HD12 LEU 19 2HD1 LEU 19 1.210 17.992 -5.570 131 HD13 LEU 19 3HD1 LEU 19 1.954 16.444 -5.171 132 HD21 LEU 19 3HD2 LEU 19 -1.829 17.762 -5.354 133 HD22 LEU 19 1HD2 LEU 19 -0.781 18.384 -4.079 134 HD23 LEU 19 2HD2 LEU 19 -1.885 17.051 -3.740 135 H THR 20 H THR 20 -0.343 14.632 -9.137 136 HA THR 20 HA THR 20 -1.144 11.843 -8.945 137 HB THR 20 HB THR 20 -3.194 13.784 -9.969 138 HG1 THR 20 HG1 THR 20 -2.709 12.992 -7.289 139 HG21 THR 20 3HG2 THR 20 -4.050 11.785 -10.549 140 HG22 THR 20 1HG2 THR 20 -4.487 11.661 -8.846 141 HG23 THR 20 2HG2 THR 20 -3.006 10.905 -9.434 142 H GLU 21 H GLU 21 -0.266 10.931 -10.675 143 HA GLU 21 HA GLU 21 0.732 12.268 -12.900 144 HB2 GLU 21 1HB GLU 21 1.253 9.902 -12.113 145 HB3 GLU 21 2HB GLU 21 -0.216 9.406 -12.941 146 HG2 GLU 21 1HG GLU 21 0.651 9.948 -15.047 147 HG3 GLU 21 2HG GLU 21 1.962 10.902 -14.355 148 H GLY 22 H GLY 22 -0.146 13.057 -14.707 149 HA2 GLY 22 1HA GLY 22 -2.961 12.355 -15.273 150 HA3 GLY 22 2HA GLY 22 -2.281 13.951 -15.554 151 H SER 23 H SER 23 -2.823 10.836 -16.842 152 HA SER 23 HA SER 23 -1.018 11.285 -19.098 153 HB2 SER 23 1HB SER 23 -2.717 8.897 -18.341 154 HB3 SER 23 2HB SER 23 -1.680 8.972 -19.765 155 HG SER 23 HG SER 23 -0.956 8.936 -17.042 156 H GLY 24 H GLY 24 -2.743 13.200 -19.321 157 HA2 GLY 24 1HA GLY 24 -4.825 12.244 -21.188 158 HA3 GLY 24 2HA GLY 24 -4.997 13.676 -20.184 159 H ALA 25 H ALA 25 -3.539 15.491 -20.629 160 HA ALA 25 HA ALA 25 -2.038 15.585 -23.048 161 HB1 ALA 25 1HB ALA 25 -4.756 15.850 -23.438 162 HB2 ALA 25 2HB ALA 25 -4.179 17.517 -23.400 163 HB3 ALA 25 3HB ALA 25 -3.487 16.370 -24.548 164 H GLU 26 H GLU 26 -0.538 17.121 -22.838 165 HA GLU 26 HA GLU 26 -0.392 18.741 -20.540 166 HB2 GLU 26 1HB GLU 26 1.589 17.984 -21.788 167 HB3 GLU 26 2HB GLU 26 1.123 19.002 -23.143 168 HG2 GLU 26 1HG GLU 26 1.355 20.983 -21.693 169 HG3 GLU 26 2HG GLU 26 1.915 19.932 -20.394 170 H ALA 27 H ALA 27 -1.049 20.763 -20.116 171 HA ALA 27 HA ALA 27 -3.034 22.027 -21.562 172 HB1 ALA 27 1HB ALA 27 -1.414 23.939 -20.109 173 HB2 ALA 27 2HB ALA 27 -3.071 23.410 -19.818 174 HB3 ALA 27 3HB ALA 27 -1.721 22.481 -19.166 175 H ARG 28 H ARG 28 -3.075 23.180 -23.376 176 HA ARG 28 HA ARG 28 -0.565 23.879 -24.668 177 HB2 ARG 28 1HB ARG 28 -3.436 23.869 -25.588 178 HB3 ARG 28 2HB ARG 28 -2.138 24.542 -26.565 179 HG2 ARG 28 1HG ARG 28 -1.869 21.766 -25.523 180 HG3 ARG 28 2HG ARG 28 -2.930 22.075 -26.899 181 HD2 ARG 28 1HD ARG 28 -0.817 23.413 -27.760 182 HD3 ARG 28 2HD ARG 28 0.026 22.303 -26.681 183 HE ARG 28 HE ARG 28 -1.786 20.927 -28.389 184 HH11 ARG 28 1HH1 ARG 28 1.351 22.436 -28.291 185 HH12 ARG 28 2HH1 ARG 28 2.003 21.462 -29.566 186 HH21 ARG 28 1HH2 ARG 28 -0.938 19.639 -30.070 187 HH22 ARG 28 2HH2 ARG 28 0.701 19.872 -30.578 188 H ALA 29 H ALA 29 -0.341 26.009 -25.723 189 HA ALA 29 HA ALA 29 -1.198 28.117 -23.886 190 HB1 ALA 29 1HB ALA 29 0.516 29.263 -25.733 191 HB2 ALA 29 2HB ALA 29 0.940 28.694 -24.118 192 HB3 ALA 29 3HB ALA 29 1.152 27.633 -25.511 193 H GLY 30 H GLY 30 -2.176 30.039 -24.592 194 HA2 GLY 30 1HA GLY 30 -3.362 31.431 -26.019 195 HA3 GLY 30 2HA GLY 30 -2.931 30.374 -27.356 196 H GLN 31 H GLN 31 -4.121 28.386 -25.048 197 HA GLN 31 HA GLN 31 -6.864 28.597 -26.104 198 HB2 GLN 31 1HB GLN 31 -5.311 26.558 -26.693 199 HB3 GLN 31 2HB GLN 31 -5.761 26.012 -25.083 200 HG2 GLN 31 1HG GLN 31 -8.187 26.471 -25.912 201 HG3 GLN 31 2HG GLN 31 -7.453 26.350 -27.510 202 HE21 GLN 31 2HE2 GLN 31 -5.773 24.390 -27.482 203 HE22 GLN 31 1HE2 GLN 31 -6.480 22.898 -26.970 204 H THR 32 H THR 32 -8.586 28.009 -24.690 205 HA THR 32 HA THR 32 -8.070 28.768 -21.945 206 HB THR 32 HB THR 32 -10.750 27.910 -23.003 207 HG1 THR 32 HG1 THR 32 -10.227 29.433 -24.483 208 HG21 THR 32 3HG2 THR 32 -11.135 28.388 -20.823 209 HG22 THR 32 1HG2 THR 32 -11.174 30.047 -21.416 210 HG23 THR 32 2HG2 THR 32 -9.703 29.407 -20.683 211 H VAL 33 H VAL 33 -7.561 27.340 -20.432 212 HA VAL 33 HA VAL 33 -8.534 24.572 -20.717 213 HB VAL 33 HB VAL 33 -6.619 23.823 -19.447 214 HG11 VAL 33 1HG1 VAL 33 -5.120 25.541 -21.262 215 HG12 VAL 33 2HG1 VAL 33 -5.305 23.786 -21.254 216 HG13 VAL 33 3HG1 VAL 33 -6.532 24.800 -22.015 217 HG21 VAL 33 3HG2 VAL 33 -5.752 25.232 -17.949 218 HG22 VAL 33 1HG2 VAL 33 -4.878 25.969 -19.292 219 HG23 VAL 33 2HG2 VAL 33 -6.424 26.639 -18.772 220 H SER 34 H SER 34 -9.559 23.601 -19.029 221 HA SER 34 HA SER 34 -10.314 25.353 -16.804 222 HB2 SER 34 1HB SER 34 -11.826 23.018 -16.614 223 HB3 SER 34 2HB SER 34 -12.354 24.554 -17.301 224 HG SER 34 HG SER 34 -12.320 23.673 -19.202 225 H VAL 35 H VAL 35 -9.352 25.108 -14.909 226 HA VAL 35 HA VAL 35 -8.620 22.432 -13.989 227 HB VAL 35 HB VAL 35 -6.393 22.961 -13.424 228 HG11 VAL 35 1HG1 VAL 35 -5.364 23.328 -15.519 229 HG12 VAL 35 2HG1 VAL 35 -6.908 22.547 -15.869 230 HG13 VAL 35 3HG1 VAL 35 -6.724 24.285 -16.104 231 HG21 VAL 35 3HG2 VAL 35 -7.352 25.719 -13.590 232 HG22 VAL 35 1HG2 VAL 35 -6.075 25.018 -12.596 233 HG23 VAL 35 2HG2 VAL 35 -5.741 25.481 -14.264 234 H HIS 36 H HIS 36 -8.252 22.310 -11.691 235 HA HIS 36 HA HIS 36 -9.776 24.353 -10.246 236 HB2 HIS 36 1HB HIS 36 -9.317 21.451 -9.902 237 HB3 HIS 36 2HB HIS 36 -9.406 22.392 -8.416 238 HD1 HIS 36 HD1 HIS 36 -11.616 24.398 -9.348 239 HD2 HIS 36 HD2 HIS 36 -11.788 20.270 -9.784 240 HE1 HIS 36 HE1 HIS 36 -14.062 23.842 -9.530 241 H TYR 37 H TYR 37 -8.877 25.653 -8.766 242 HA TYR 37 HA TYR 37 -6.067 25.151 -8.032 243 HB2 TYR 37 1HB TYR 37 -5.726 27.552 -7.935 244 HB3 TYR 37 2HB TYR 37 -6.372 27.116 -9.514 245 HD1 TYR 37 HD2 TYR 37 -7.254 28.585 -6.232 246 HD2 TYR 37 HD1 TYR 37 -8.420 28.018 -10.284 247 HE1 TYR 37 HE2 TYR 37 -9.067 30.220 -5.933 248 HE2 TYR 37 HE1 TYR 37 -10.236 29.652 -9.997 249 HH TYR 37 HH TYR 37 -11.445 30.583 -7.201 250 H THR 38 H THR 38 -5.460 25.387 -5.917 251 HA THR 38 HA THR 38 -7.529 26.161 -3.980 252 HB THR 38 HB THR 38 -5.913 24.103 -2.827 253 HG1 THR 38 HG1 THR 38 -6.419 22.389 -4.197 254 HG21 THR 38 3HG2 THR 38 -8.380 23.023 -3.019 255 HG22 THR 38 1HG2 THR 38 -8.763 24.724 -3.277 256 HG23 THR 38 2HG2 THR 38 -7.931 24.221 -1.806 257 H GLY 39 H GLY 39 -6.786 27.785 -2.791 258 HA2 GLY 39 1HA GLY 39 -3.919 28.239 -2.575 259 HA3 GLY 39 2HA GLY 39 -5.191 29.334 -2.056 260 H TRP 40 H TRP 40 -2.720 27.597 -0.924 261 HA TRP 40 HA TRP 40 -4.015 27.222 1.692 262 HB2 TRP 40 1HB TRP 40 -2.108 25.366 0.274 263 HB3 TRP 40 2HB TRP 40 -2.361 25.298 2.016 264 HD1 TRP 40 HD1 TRP 40 -5.490 25.616 2.147 265 HE1 TRP 40 HE1 TRP 40 -7.016 23.732 1.282 266 HE3 TRP 40 HE3 TRP 40 -2.186 23.255 -0.959 267 HZ2 TRP 40 HZ2 TRP 40 -6.842 21.535 -0.482 268 HZ3 TRP 40 HZ3 TRP 40 -2.945 21.270 -2.198 269 HH2 TRP 40 HH2 TRP 40 -5.225 20.429 -1.963 270 H LEU 41 H LEU 41 -2.918 27.983 3.431 271 HA LEU 41 HA LEU 41 -0.697 29.732 2.944 272 HB2 LEU 41 1HB LEU 41 -2.540 29.148 5.142 273 HB3 LEU 41 2HB LEU 41 -0.908 29.560 5.665 274 HG LEU 41 HG LEU 41 -2.618 31.284 3.875 275 HD11 LEU 41 1HD1 LEU 41 -2.374 31.086 6.821 276 HD12 LEU 41 2HD1 LEU 41 -3.751 31.551 5.824 277 HD13 LEU 41 3HD1 LEU 41 -2.445 32.700 6.115 278 HD21 LEU 41 3HD2 LEU 41 -0.197 32.142 5.414 279 HD22 LEU 41 1HD2 LEU 41 -0.953 32.895 4.010 280 HD23 LEU 41 2HD2 LEU 41 -0.038 31.399 3.822 281 H THR 42 H THR 42 1.144 29.643 4.678 282 HA THR 42 HA THR 42 2.737 27.420 4.113 283 HB THR 42 HB THR 42 4.295 28.255 5.777 284 HG1 THR 42 HG1 THR 42 3.670 29.935 7.184 285 HG21 THR 42 3HG2 THR 42 4.363 29.486 3.751 286 HG22 THR 42 1HG2 THR 42 4.390 30.681 5.047 287 HG23 THR 42 2HG2 THR 42 2.897 30.377 4.159 288 H ASP 43 H ASP 43 0.575 28.079 6.798 289 HA ASP 43 HA ASP 43 1.410 25.703 8.237 290 HB2 ASP 43 1HB ASP 43 -0.604 27.875 8.766 291 HB3 ASP 43 2HB ASP 43 -0.567 26.409 9.742 292 H GLY 44 H GLY 44 -0.839 26.526 5.818 293 HA2 GLY 44 1HA GLY 44 -1.841 24.579 4.678 294 HA3 GLY 44 2HA GLY 44 -2.263 23.977 6.274 295 H GLN 45 H GLN 45 -2.812 27.044 6.777 296 HA GLN 45 HA GLN 45 -5.587 26.897 6.725 297 HB2 GLN 45 1HB GLN 45 -3.917 28.591 7.871 298 HB3 GLN 45 2HB GLN 45 -4.254 29.554 6.439 299 HG2 GLN 45 1HG GLN 45 -5.816 30.333 7.935 300 HG3 GLN 45 2HG GLN 45 -6.734 29.128 7.032 301 HE21 GLN 45 2HE2 GLN 45 -4.509 29.127 9.802 302 HE22 GLN 45 1HE2 GLN 45 -5.518 28.169 10.827 303 H LYS 46 H LYS 46 -6.892 26.734 5.037 304 HA LYS 46 HA LYS 46 -6.083 27.487 2.395 305 HB2 LYS 46 1HB LYS 46 -7.505 25.551 2.703 306 HB3 LYS 46 2HB LYS 46 -8.734 26.532 3.490 307 HG2 LYS 46 1HG LYS 46 -8.951 27.806 1.337 308 HG3 LYS 46 2HG LYS 46 -7.912 26.585 0.599 309 HD2 LYS 46 1HD LYS 46 -10.418 25.857 2.089 310 HD3 LYS 46 2HD LYS 46 -10.436 26.269 0.373 311 HE2 LYS 46 1HE LYS 46 -8.721 24.486 0.013 312 HE3 LYS 46 2HE LYS 46 -8.935 24.016 1.699 313 HZ1 LYS 46 3HZ LYS 46 -11.330 23.683 1.173 314 HZ2 LYS 46 1HZ LYS 46 -10.291 22.614 0.372 315 HZ3 LYS 46 2HZ LYS 46 -10.965 23.922 -0.461 316 H PHE 47 H PHE 47 -6.665 29.230 1.195 317 HA PHE 47 HA PHE 47 -8.524 31.170 2.379 318 HB2 PHE 47 1HB PHE 47 -6.993 33.009 1.667 319 HB3 PHE 47 2HB PHE 47 -6.328 31.998 2.945 320 HD1 PHE 47 HD1 PHE 47 -6.244 32.582 -0.713 321 HD2 PHE 47 HD2 PHE 47 -4.270 30.931 2.677 322 HE1 PHE 47 HE1 PHE 47 -4.236 32.187 -2.079 323 HE2 PHE 47 HE2 PHE 47 -2.259 30.535 1.317 324 HZ PHE 47 HZ PHE 47 -2.239 31.164 -1.064 325 H ASP 48 H ASP 48 -8.401 29.165 0.058 326 HA ASP 48 HA ASP 48 -10.025 30.590 -1.729 327 HB2 ASP 48 1HB ASP 48 -7.501 31.396 -2.143 328 HB3 ASP 48 2HB ASP 48 -7.498 29.958 -3.160 329 H SER 49 H SER 49 -11.292 29.104 -2.615 330 HA SER 49 HA SER 49 -10.155 26.504 -3.358 331 HB2 SER 49 1HB SER 49 -11.112 25.705 -1.444 332 HB3 SER 49 2HB SER 49 -12.277 27.026 -1.350 333 HG SER 49 HG SER 49 -12.388 24.718 -2.989 334 H SER 50 H SER 50 -10.403 26.576 -5.507 335 HA SER 50 HA SER 50 -12.328 27.972 -6.939 336 HB2 SER 50 1HB SER 50 -11.757 26.413 -8.826 337 HB3 SER 50 2HB SER 50 -10.356 27.151 -8.051 338 HG SER 50 HG SER 50 -11.223 24.709 -7.040 339 H LYS 51 H LYS 51 -12.533 24.910 -5.332 340 HA LYS 51 HA LYS 51 -14.693 23.756 -6.681 341 HB2 LYS 51 1HB LYS 51 -13.948 23.555 -3.757 342 HB3 LYS 51 2HB LYS 51 -15.076 22.490 -4.586 343 HG2 LYS 51 1HG LYS 51 -12.201 22.809 -5.407 344 HG3 LYS 51 2HG LYS 51 -12.761 21.583 -4.267 345 HD2 LYS 51 1HD LYS 51 -14.087 21.832 -6.933 346 HD3 LYS 51 2HD LYS 51 -12.527 21.014 -6.810 347 HE2 LYS 51 1HE LYS 51 -14.817 20.300 -5.007 348 HE3 LYS 51 2HE LYS 51 -14.667 19.601 -6.618 349 HZ1 LYS 51 3HZ LYS 51 -12.198 19.251 -5.591 350 HZ2 LYS 51 1HZ LYS 51 -13.417 18.077 -5.600 351 HZ3 LYS 51 2HZ LYS 51 -13.171 19.032 -4.225 352 H ASP 52 H ASP 52 -14.559 26.467 -4.582 353 HA ASP 52 HA ASP 52 -17.092 26.498 -3.448 354 HB2 ASP 52 1HB ASP 52 -15.291 28.111 -2.909 355 HB3 ASP 52 2HB ASP 52 -15.535 28.880 -4.474 356 H ARG 53 H ARG 53 -16.048 27.657 -6.631 357 HA ARG 53 HA ARG 53 -18.621 28.621 -7.388 358 HB2 ARG 53 1HB ARG 53 -16.235 27.890 -9.097 359 HB3 ARG 53 2HB ARG 53 -17.650 28.775 -9.652 360 HG2 ARG 53 1HG ARG 53 -15.879 29.741 -7.424 361 HG3 ARG 53 2HG ARG 53 -15.626 30.163 -9.119 362 HD2 ARG 53 1HD ARG 53 -17.719 31.280 -9.239 363 HD3 ARG 53 2HD ARG 53 -18.224 30.639 -7.676 364 HE ARG 53 HE ARG 53 -17.120 32.363 -6.672 365 HH11 ARG 53 1HH1 ARG 53 -15.893 31.987 -9.909 366 HH12 ARG 53 2HH1 ARG 53 -14.892 33.399 -9.834 367 HH21 ARG 53 1HH2 ARG 53 -15.806 34.225 -6.561 368 HH22 ARG 53 2HH2 ARG 53 -14.843 34.671 -7.929 369 H ASN 54 H ASN 54 -17.400 25.526 -7.031 370 HA ASN 54 HA ASN 54 -18.199 23.460 -7.544 371 HB2 ASN 54 1HB ASN 54 -20.384 24.608 -6.929 372 HB3 ASN 54 2HB ASN 54 -20.652 24.824 -8.656 373 HD21 ASN 54 2HD2 ASN 54 -19.912 22.336 -6.251 374 HD22 ASN 54 1HD2 ASN 54 -20.825 21.083 -7.013 375 H ASP 55 H ASP 55 -16.785 25.209 -9.538 376 HA ASP 55 HA ASP 55 -17.088 23.418 -11.786 377 HB2 ASP 55 1HB ASP 55 -17.929 26.285 -11.890 378 HB3 ASP 55 2HB ASP 55 -17.167 25.573 -13.309 379 HA PRO 56 HA PRO 56 -12.772 24.108 -12.167 380 HB2 PRO 56 1HB PRO 56 -12.401 23.682 -14.823 381 HB3 PRO 56 2HB PRO 56 -12.750 22.379 -13.681 382 HG2 PRO 56 1HG PRO 56 -14.604 23.813 -15.543 383 HG3 PRO 56 2HG PRO 56 -14.498 22.079 -15.184 384 HD2 PRO 56 1HD PRO 56 -16.375 23.685 -14.074 385 HD3 PRO 56 2HD PRO 56 -15.692 22.284 -13.223 386 H PHE 57 H PHE 57 -11.266 25.663 -12.699 387 HA PHE 57 HA PHE 57 -12.330 28.191 -13.608 388 HB2 PHE 57 1HB PHE 57 -10.812 28.197 -11.716 389 HB3 PHE 57 2HB PHE 57 -9.568 27.393 -12.668 390 HD1 PHE 57 HD2 PHE 57 -11.764 30.370 -13.188 391 HD2 PHE 57 HD1 PHE 57 -7.816 28.780 -13.149 392 HE1 PHE 57 HE2 PHE 57 -10.878 32.561 -13.872 393 HE2 PHE 57 HE1 PHE 57 -6.924 30.969 -13.832 394 HZ PHE 57 HZ PHE 57 -8.455 32.862 -14.196 395 H ALA 58 H ALA 58 -12.608 28.392 -15.744 396 HA ALA 58 HA ALA 58 -10.672 27.245 -17.595 397 HB1 ALA 58 1HB ALA 58 -12.974 28.845 -18.568 398 HB2 ALA 58 2HB ALA 58 -12.283 27.350 -19.200 399 HB3 ALA 58 3HB ALA 58 -13.317 27.308 -17.772 400 H PHE 59 H PHE 59 -8.916 28.404 -18.028 401 HA PHE 59 HA PHE 59 -9.236 31.235 -18.701 402 HB2 PHE 59 1HB PHE 59 -7.400 31.941 -17.356 403 HB3 PHE 59 2HB PHE 59 -8.443 30.982 -16.311 404 HD1 PHE 59 HD1 PHE 59 -7.824 28.444 -16.144 405 HD2 PHE 59 HD2 PHE 59 -5.142 31.508 -17.384 406 HE1 PHE 59 HE1 PHE 59 -5.915 27.007 -15.556 407 HE2 PHE 59 HE2 PHE 59 -3.229 30.076 -16.799 408 HZ PHE 59 HZ PHE 59 -3.614 27.821 -15.885 409 H VAL 60 H VAL 60 -7.632 32.066 -20.110 410 HA VAL 60 HA VAL 60 -6.583 30.097 -21.924 411 HB VAL 60 HB VAL 60 -6.268 33.102 -21.937 412 HG11 VAL 60 1HG1 VAL 60 -5.802 32.659 -24.403 413 HG12 VAL 60 2HG1 VAL 60 -4.522 32.250 -23.259 414 HG13 VAL 60 3HG1 VAL 60 -5.542 30.979 -23.935 415 HG21 VAL 60 3HG2 VAL 60 -8.390 31.273 -22.863 416 HG22 VAL 60 1HG2 VAL 60 -8.483 32.961 -22.360 417 HG23 VAL 60 2HG2 VAL 60 -7.927 32.554 -23.984 418 H LEU 61 H LEU 61 -4.662 29.162 -21.776 419 HA LEU 61 HA LEU 61 -2.736 29.949 -19.830 420 HB2 LEU 61 1HB LEU 61 -2.798 27.664 -20.248 421 HB3 LEU 61 2HB LEU 61 -2.833 27.887 -21.996 422 HG LEU 61 HG LEU 61 -0.498 28.402 -22.046 423 HD11 LEU 61 1HD1 LEU 61 -0.918 28.963 -19.235 424 HD12 LEU 61 2HD1 LEU 61 0.362 29.508 -20.319 425 HD13 LEU 61 3HD1 LEU 61 0.498 27.948 -19.508 426 HD21 LEU 61 3HD2 LEU 61 -1.533 25.942 -21.272 427 HD22 LEU 61 1HD2 LEU 61 -0.149 26.198 -20.209 428 HD23 LEU 61 2HD2 LEU 61 0.062 26.251 -21.959 429 H GLY 62 H GLY 62 -1.081 31.319 -20.001 430 HA2 GLY 62 1HA GLY 62 0.676 31.719 -22.030 431 HA3 GLY 62 2HA GLY 62 -0.676 32.751 -22.474 432 H GLY 63 H GLY 63 -1.508 33.901 -20.235 433 HA2 GLY 63 1HA GLY 63 -0.221 34.783 -18.164 434 HA3 GLY 63 2HA GLY 63 0.856 35.434 -19.392 435 H GLY 64 H GLY 64 -0.636 36.915 -17.419 436 HA2 GLY 64 1HA GLY 64 -1.309 39.217 -18.310 437 HA3 GLY 64 2HA GLY 64 -2.593 38.327 -19.114 438 H MET 65 H MET 65 -3.590 36.660 -17.313 439 HA MET 65 HA MET 65 -4.507 38.449 -15.166 440 HB2 MET 65 1HB MET 65 -5.838 36.381 -16.825 441 HB3 MET 65 2HB MET 65 -6.348 36.489 -15.146 442 HG2 MET 65 1HG MET 65 -7.006 38.761 -15.411 443 HG3 MET 65 2HG MET 65 -6.280 38.841 -17.014 444 HE1 MET 65 3HE MET 65 -7.305 36.894 -19.024 445 HE2 MET 65 1HE MET 65 -8.854 37.662 -19.373 446 HE3 MET 65 2HE MET 65 -7.440 38.653 -19.015 447 H VAL 66 H VAL 66 -2.878 35.500 -15.835 448 HA VAL 66 HA VAL 66 -3.189 34.534 -13.092 449 HB VAL 66 HB VAL 66 -2.159 32.493 -13.808 450 HG11 VAL 66 1HG1 VAL 66 -4.098 31.853 -14.675 451 HG12 VAL 66 2HG1 VAL 66 -4.506 33.542 -14.984 452 HG13 VAL 66 3HG1 VAL 66 -3.674 32.595 -16.218 453 HG21 VAL 66 3HG2 VAL 66 -0.393 33.361 -15.200 454 HG22 VAL 66 1HG2 VAL 66 -1.343 32.202 -16.130 455 HG23 VAL 66 2HG2 VAL 66 -1.561 33.932 -16.391 456 H ILE 67 H ILE 67 -0.986 33.418 -12.335 457 HA ILE 67 HA ILE 67 1.003 35.581 -12.342 458 HB ILE 67 HB ILE 67 1.757 34.839 -10.231 459 HG12 ILE 67 1HG1 ILE 67 0.073 32.368 -10.684 460 HG13 ILE 67 2HG1 ILE 67 1.831 32.448 -10.638 461 HG21 ILE 67 1HG2 ILE 67 -0.886 35.590 -10.650 462 HG22 ILE 67 2HG2 ILE 67 -0.975 34.259 -9.498 463 HG23 ILE 67 3HG2 ILE 67 0.012 35.675 -9.135 464 HD11 ILE 67 3HD1 ILE 67 -0.055 32.925 -8.344 465 HD12 ILE 67 1HD1 ILE 67 1.007 31.536 -8.578 466 HD13 ILE 67 2HD1 ILE 67 1.695 33.132 -8.273 467 H LYS 68 H LYS 68 3.301 34.875 -12.105 468 HA LYS 68 HA LYS 68 4.197 33.451 -14.267 469 HB2 LYS 68 1HB LYS 68 5.451 34.037 -11.602 470 HB3 LYS 68 2HB LYS 68 6.313 33.085 -12.803 471 HG2 LYS 68 1HG LYS 68 5.740 35.085 -14.378 472 HG3 LYS 68 2HG LYS 68 5.544 35.963 -12.860 473 HD2 LYS 68 1HD LYS 68 7.773 35.718 -12.281 474 HD3 LYS 68 2HD LYS 68 7.994 34.312 -13.324 475 HE2 LYS 68 1HE LYS 68 7.346 36.973 -14.521 476 HE3 LYS 68 2HE LYS 68 8.995 36.620 -14.009 477 HZ1 LYS 68 3HZ LYS 68 8.418 34.427 -15.406 478 HZ2 LYS 68 1HZ LYS 68 9.152 35.796 -16.078 479 HZ3 LYS 68 2HZ LYS 68 7.485 35.561 -16.246 480 H GLY 69 H GLY 69 3.995 32.204 -10.925 481 HA2 GLY 69 1HA GLY 69 4.773 29.590 -11.436 482 HA3 GLY 69 2HA GLY 69 3.695 30.070 -10.133 483 H TRP 70 H TRP 70 1.704 31.133 -12.051 484 HA TRP 70 HA TRP 70 0.188 28.749 -12.363 485 HB2 TRP 70 1HB TRP 70 -0.291 31.556 -12.474 486 HB3 TRP 70 2HB TRP 70 -0.906 30.843 -13.963 487 HD1 TRP 70 HD1 TRP 70 -3.279 29.896 -13.818 488 HE1 TRP 70 HE1 TRP 70 -4.872 29.201 -11.920 489 HE3 TRP 70 HE3 TRP 70 -0.117 30.490 -9.845 490 HZ2 TRP 70 HZ2 TRP 70 -4.799 28.939 -9.110 491 HZ3 TRP 70 HZ3 TRP 70 -0.956 29.996 -7.585 492 HH2 TRP 70 HH2 TRP 70 -3.249 29.238 -7.227 493 H ASP 71 H ASP 71 1.426 31.053 -14.793 494 HA ASP 71 HA ASP 71 0.786 29.595 -17.059 495 HB2 ASP 71 1HB ASP 71 1.501 31.815 -17.396 496 HB3 ASP 71 2HB ASP 71 2.990 31.564 -16.488 497 H GLU 72 H GLU 72 3.778 29.505 -15.145 498 HA GLU 72 HA GLU 72 5.099 27.592 -16.744 499 HB2 GLU 72 1HB GLU 72 5.683 29.090 -14.435 500 HB3 GLU 72 2HB GLU 72 5.881 27.405 -13.975 501 HG2 GLU 72 1HG GLU 72 7.235 28.800 -16.272 502 HG3 GLU 72 2HG GLU 72 7.976 28.326 -14.744 503 H GLY 73 H GLY 73 2.999 27.301 -13.917 504 HA2 GLY 73 1HA GLY 73 3.355 24.555 -13.444 505 HA3 GLY 73 2HA GLY 73 1.938 25.490 -12.988 506 H VAL 74 H VAL 74 0.585 26.105 -15.075 507 HA VAL 74 HA VAL 74 -0.517 23.703 -16.031 508 HB VAL 74 HB VAL 74 -1.737 25.196 -17.671 509 HG11 VAL 74 1HG1 VAL 74 -3.279 25.539 -16.084 510 HG12 VAL 74 2HG1 VAL 74 -2.125 24.761 -14.998 511 HG13 VAL 74 3HG1 VAL 74 -2.189 26.521 -15.106 512 HG21 VAL 74 3HG2 VAL 74 0.342 26.928 -17.199 513 HG22 VAL 74 1HG2 VAL 74 -1.190 27.344 -17.968 514 HG23 VAL 74 2HG2 VAL 74 -0.968 27.620 -16.241 515 H GLN 75 H GLN 75 1.973 25.790 -17.289 516 HA GLN 75 HA GLN 75 2.012 25.128 -19.965 517 HB2 GLN 75 1HB GLN 75 3.954 26.121 -18.011 518 HB3 GLN 75 2HB GLN 75 4.690 25.227 -19.334 519 HG2 GLN 75 1HG GLN 75 2.705 27.406 -19.852 520 HG3 GLN 75 2HG GLN 75 4.409 27.761 -19.572 521 HE21 GLN 75 2HE2 GLN 75 5.963 26.709 -20.996 522 HE22 GLN 75 1HE2 GLN 75 5.516 26.395 -22.635 523 H GLY 76 H GLY 76 2.948 23.203 -17.217 524 HA2 GLY 76 1HA GLY 76 3.853 21.075 -19.056 525 HA3 GLY 76 2HA GLY 76 4.418 21.253 -17.401 526 H MET 77 H MET 77 1.617 21.906 -16.533 527 HA MET 77 HA MET 77 0.853 19.438 -15.570 528 HB2 MET 77 1HB MET 77 0.025 21.764 -14.892 529 HB3 MET 77 2HB MET 77 -1.136 21.610 -16.205 530 HG2 MET 77 1HG MET 77 -2.387 20.861 -14.457 531 HG3 MET 77 2HG MET 77 -1.699 19.342 -15.026 532 HE1 MET 77 3HE MET 77 -0.521 21.678 -11.263 533 HE2 MET 77 1HE MET 77 0.285 22.136 -12.764 534 HE3 MET 77 2HE MET 77 -1.469 22.259 -12.633 535 H LYS 78 H LYS 78 -0.650 17.884 -16.171 536 HA LYS 78 HA LYS 78 -1.485 17.977 -18.997 537 HB2 LYS 78 1HB LYS 78 -0.588 15.660 -17.290 538 HB3 LYS 78 2HB LYS 78 -1.457 15.431 -18.802 539 HG2 LYS 78 1HG LYS 78 0.318 16.024 -20.075 540 HG3 LYS 78 2HG LYS 78 0.929 17.176 -18.885 541 HD2 LYS 78 1HD LYS 78 0.990 14.340 -18.077 542 HD3 LYS 78 2HD LYS 78 2.075 14.785 -19.397 543 HE2 LYS 78 1HE LYS 78 1.998 16.549 -17.010 544 HE3 LYS 78 2HE LYS 78 2.785 14.981 -16.843 545 HZ1 LYS 78 3HZ LYS 78 4.081 17.102 -17.666 546 HZ2 LYS 78 1HZ LYS 78 3.485 16.604 -19.169 547 HZ3 LYS 78 2HZ LYS 78 4.448 15.558 -18.252 548 H VAL 79 H VAL 79 -3.515 17.067 -19.541 549 HA VAL 79 HA VAL 79 -5.635 17.718 -17.886 550 HB VAL 79 HB VAL 79 -5.616 15.639 -20.079 551 HG11 VAL 79 1HG1 VAL 79 -7.604 15.290 -18.897 552 HG12 VAL 79 2HG1 VAL 79 -7.837 17.015 -18.601 553 HG13 VAL 79 3HG1 VAL 79 -8.069 16.357 -20.222 554 HG21 VAL 79 3HG2 VAL 79 -5.620 17.289 -21.585 555 HG22 VAL 79 1HG2 VAL 79 -6.794 18.232 -20.668 556 HG23 VAL 79 2HG2 VAL 79 -5.078 18.338 -20.276 557 H GLY 80 H GLY 80 -6.475 16.827 -16.121 558 HA2 GLY 80 1HA GLY 80 -7.263 15.137 -14.723 559 HA3 GLY 80 2HA GLY 80 -6.518 13.948 -15.782 560 H GLY 81 H GLY 81 -4.203 16.206 -15.206 561 HA2 GLY 81 1HA GLY 81 -3.013 14.526 -13.110 562 HA3 GLY 81 2HA GLY 81 -2.134 15.601 -14.187 563 H VAL 82 H VAL 82 -2.416 15.276 -11.149 564 HA VAL 82 HA VAL 82 -3.069 18.088 -10.553 565 HB VAL 82 HB VAL 82 -3.053 15.773 -8.612 566 HG11 VAL 82 1HG1 VAL 82 -3.066 18.605 -8.258 567 HG12 VAL 82 2HG1 VAL 82 -4.611 17.948 -7.713 568 HG13 VAL 82 3HG1 VAL 82 -3.101 17.335 -7.036 569 HG21 VAL 82 3HG2 VAL 82 -5.122 16.797 -10.429 570 HG22 VAL 82 1HG2 VAL 82 -4.970 15.222 -9.651 571 HG23 VAL 82 2HG2 VAL 82 -5.638 16.587 -8.755 572 H ARG 83 H ARG 83 -1.573 19.361 -9.598 573 HA ARG 83 HA ARG 83 0.831 18.175 -8.455 574 HB2 ARG 83 1HB ARG 83 1.253 18.553 -10.907 575 HB3 ARG 83 2HB ARG 83 1.017 20.272 -10.620 576 HG2 ARG 83 1HG ARG 83 2.923 20.350 -9.164 577 HG3 ARG 83 2HG ARG 83 3.111 18.598 -9.254 578 HD2 ARG 83 1HD ARG 83 3.424 20.563 -11.520 579 HD3 ARG 83 2HD ARG 83 4.718 19.685 -10.705 580 HE ARG 83 HE ARG 83 2.958 17.784 -11.684 581 HH11 ARG 83 1HH1 ARG 83 5.023 20.281 -12.959 582 HH12 ARG 83 2HH1 ARG 83 5.308 19.461 -14.458 583 HH21 ARG 83 1HH2 ARG 83 3.325 16.695 -13.655 584 HH22 ARG 83 2HH2 ARG 83 4.340 17.422 -14.854 585 H ARG 84 H ARG 84 1.743 19.394 -6.859 586 HA ARG 84 HA ARG 84 0.205 21.690 -5.964 587 HB2 ARG 84 1HB ARG 84 1.075 19.739 -4.496 588 HB3 ARG 84 2HB ARG 84 2.619 20.577 -4.565 589 HG2 ARG 84 1HG ARG 84 1.772 22.454 -3.430 590 HG3 ARG 84 2HG ARG 84 0.101 21.935 -3.661 591 HD2 ARG 84 1HD ARG 84 0.394 21.278 -1.500 592 HD3 ARG 84 2HD ARG 84 0.959 19.822 -2.318 593 HE ARG 84 HE ARG 84 3.066 21.691 -1.832 594 HH11 ARG 84 1HH1 ARG 84 1.137 19.178 -0.390 595 HH12 ARG 84 2HH1 ARG 84 2.334 18.755 0.788 596 HH21 ARG 84 1HH2 ARG 84 4.651 21.143 -0.286 597 HH22 ARG 84 2HH2 ARG 84 4.332 19.874 0.847 598 H LEU 85 H LEU 85 0.709 23.522 -7.017 599 HA LEU 85 HA LEU 85 3.460 24.129 -7.713 600 HB2 LEU 85 1HB LEU 85 1.655 24.622 -9.289 601 HB3 LEU 85 2HB LEU 85 0.927 25.716 -8.114 602 HG LEU 85 HG LEU 85 3.354 26.845 -8.331 603 HD11 LEU 85 1HD1 LEU 85 4.001 26.857 -10.701 604 HD12 LEU 85 2HD1 LEU 85 2.806 25.601 -11.021 605 HD13 LEU 85 3HD1 LEU 85 4.179 25.263 -9.967 606 HD21 LEU 85 3HD2 LEU 85 1.319 27.437 -10.441 607 HD22 LEU 85 1HD2 LEU 85 2.298 28.549 -9.485 608 HD23 LEU 85 2HD2 LEU 85 0.941 27.705 -8.739 609 H THR 86 H THR 86 4.792 25.164 -6.398 610 HA THR 86 HA THR 86 3.667 26.726 -4.178 611 HB THR 86 HB THR 86 6.568 25.994 -4.358 612 HG1 THR 86 HG1 THR 86 4.427 24.291 -3.561 613 HG21 THR 86 3HG2 THR 86 5.291 25.701 -1.796 614 HG22 THR 86 1HG2 THR 86 4.932 27.286 -2.479 615 HG23 THR 86 2HG2 THR 86 6.607 26.775 -2.271 616 H ILE 87 H ILE 87 3.691 28.862 -4.336 617 HA ILE 87 HA ILE 87 5.680 30.123 -6.106 618 HB ILE 87 HB ILE 87 2.983 31.198 -5.274 619 HG12 ILE 87 1HG1 ILE 87 2.810 30.946 -7.941 620 HG13 ILE 87 2HG1 ILE 87 3.927 29.626 -7.612 621 HG21 ILE 87 1HG2 ILE 87 3.399 32.984 -6.853 622 HG22 ILE 87 2HG2 ILE 87 4.693 32.930 -5.657 623 HG23 ILE 87 3HG2 ILE 87 4.961 32.282 -7.275 624 HD11 ILE 87 3HD1 ILE 87 1.806 29.475 -5.737 625 HD12 ILE 87 1HD1 ILE 87 1.115 29.667 -7.348 626 HD13 ILE 87 2HD1 ILE 87 2.233 28.343 -7.019 627 HA PRO 88 HA PRO 88 7.424 31.955 -2.477 628 HB2 PRO 88 1HB PRO 88 8.982 33.791 -3.731 629 HB3 PRO 88 2HB PRO 88 9.381 32.070 -3.674 630 HG2 PRO 88 1HG PRO 88 8.097 33.645 -5.872 631 HG3 PRO 88 2HG PRO 88 9.362 32.406 -5.975 632 HD2 PRO 88 1HD PRO 88 6.762 31.882 -6.521 633 HD3 PRO 88 2HD PRO 88 7.852 30.672 -5.815 634 HA PRO 89 HA PRO 89 5.293 35.683 -1.530 635 HB2 PRO 89 1HB PRO 89 7.156 37.164 -0.225 636 HB3 PRO 89 2HB PRO 89 6.405 35.727 0.479 637 HG2 PRO 89 1HG PRO 89 9.071 36.011 -0.853 638 HG3 PRO 89 2HG PRO 89 8.647 35.125 0.623 639 HD2 PRO 89 1HD PRO 89 8.975 33.899 -1.769 640 HD3 PRO 89 2HD PRO 89 7.825 33.318 -0.548 641 H GLN 90 H GLN 90 7.859 35.712 -3.710 642 HA GLN 90 HA GLN 90 7.573 38.569 -4.299 643 HB2 GLN 90 1HB GLN 90 9.542 38.282 -5.733 644 HB3 GLN 90 2HB GLN 90 9.860 37.743 -4.090 645 HG2 GLN 90 1HG GLN 90 9.079 35.422 -5.186 646 HG3 GLN 90 2HG GLN 90 9.763 36.214 -6.605 647 HE21 GLN 90 2HE2 GLN 90 10.553 35.817 -3.164 648 HE22 GLN 90 1HE2 GLN 90 12.219 35.437 -3.416 649 H LEU 91 H LEU 91 7.219 35.376 -5.764 650 HA LEU 91 HA LEU 91 6.182 36.536 -8.224 651 HB2 LEU 91 1HB LEU 91 6.487 33.641 -7.445 652 HB3 LEU 91 2HB LEU 91 6.121 34.260 -9.054 653 HG LEU 91 HG LEU 91 8.716 34.531 -7.543 654 HD11 LEU 91 1HD1 LEU 91 9.158 32.592 -8.534 655 HD12 LEU 91 2HD1 LEU 91 9.141 33.463 -10.067 656 HD13 LEU 91 3HD1 LEU 91 7.678 32.663 -9.491 657 HD21 LEU 91 3HD2 LEU 91 9.384 35.510 -9.877 658 HD22 LEU 91 1HD2 LEU 91 8.666 36.547 -8.644 659 HD23 LEU 91 2HD2 LEU 91 7.672 35.928 -9.963 660 H GLY 92 H GLY 92 4.834 36.446 -5.430 661 HA2 GLY 92 1HA GLY 92 2.265 35.345 -6.392 662 HA3 GLY 92 2HA GLY 92 2.762 35.291 -4.708 663 H TYR 93 H TYR 93 1.412 36.576 -3.629 664 HA TYR 93 HA TYR 93 -0.041 38.710 -4.604 665 HB2 TYR 93 1HB TYR 93 0.949 38.110 -1.819 666 HB3 TYR 93 2HB TYR 93 -0.113 39.469 -2.168 667 HD1 TYR 93 HD2 TYR 93 -2.416 39.062 -2.980 668 HD2 TYR 93 HD1 TYR 93 0.118 35.868 -1.764 669 HE1 TYR 93 HE2 TYR 93 -4.373 37.582 -2.809 670 HE2 TYR 93 HE1 TYR 93 -1.832 34.379 -1.592 671 HH TYR 93 HH TYR 93 -4.331 34.468 -2.850 672 H GLY 94 H GLY 94 2.973 38.918 -2.698 673 HA2 GLY 94 1HA GLY 94 4.677 40.445 -3.783 674 HA3 GLY 94 2HA GLY 94 3.368 41.616 -3.829 675 H ALA 95 H ALA 95 5.046 42.882 -2.635 676 HA ALA 95 HA ALA 95 5.790 42.199 0.005 677 HB1 ALA 95 1HB ALA 95 5.572 45.024 -0.975 678 HB2 ALA 95 2HB ALA 95 6.736 44.326 0.152 679 HB3 ALA 95 3HB ALA 95 6.831 43.940 -1.566 680 H ARG 96 H ARG 96 2.956 43.693 -1.350 681 HA ARG 96 HA ARG 96 1.984 44.875 1.045 682 HB2 ARG 96 1HB ARG 96 0.834 44.232 -1.635 683 HB3 ARG 96 2HB ARG 96 -0.268 44.609 -0.318 684 HG2 ARG 96 1HG ARG 96 1.292 46.686 -0.008 685 HG3 ARG 96 2HG ARG 96 1.716 46.352 -1.688 686 HD2 ARG 96 1HD ARG 96 -0.057 47.854 -1.854 687 HD3 ARG 96 2HD ARG 96 -0.816 46.282 -2.102 688 HE ARG 96 HE ARG 96 -1.966 46.555 -0.132 689 HH11 ARG 96 1HH1 ARG 96 0.547 48.954 -0.360 690 HH12 ARG 96 2HH1 ARG 96 -0.015 49.860 1.006 691 HH21 ARG 96 1HH2 ARG 96 -2.715 47.739 1.667 692 HH22 ARG 96 2HH2 ARG 96 -1.870 49.168 2.159 693 H GLY 97 H GLY 97 1.229 41.823 -0.626 694 HA2 GLY 97 1HA GLY 97 0.353 39.853 0.162 695 HA3 GLY 97 2HA GLY 97 0.870 40.369 1.760 696 H ALA 98 H ALA 98 -1.438 38.914 1.444 697 HA ALA 98 HA ALA 98 -3.741 40.607 1.272 698 HB1 ALA 98 1HB ALA 98 -3.226 37.816 1.359 699 HB2 ALA 98 2HB ALA 98 -4.372 38.206 2.643 700 HB3 ALA 98 3HB ALA 98 -4.734 38.647 0.975 701 H GLY 99 H GLY 99 -5.002 41.442 2.897 702 HA2 GLY 99 1HA GLY 99 -3.707 42.062 5.352 703 HA3 GLY 99 2HA GLY 99 -5.371 42.443 4.935 704 H GLY 100 H GLY 100 -3.262 40.293 6.610 705 HA2 GLY 100 1HA GLY 100 -4.092 39.156 8.567 706 HA3 GLY 100 2HA GLY 100 -5.627 38.946 7.738 707 H VAL 101 H VAL 101 -3.995 38.225 5.254 708 HA VAL 101 HA VAL 101 -3.166 35.523 6.072 709 HB VAL 101 HB VAL 101 -4.658 35.987 3.506 710 HG11 VAL 101 1HG1 VAL 101 -5.030 33.612 3.589 711 HG12 VAL 101 2HG1 VAL 101 -3.308 33.926 3.814 712 HG13 VAL 101 3HG1 VAL 101 -4.320 33.516 5.200 713 HG21 VAL 101 3HG2 VAL 101 -6.602 34.918 4.883 714 HG22 VAL 101 1HG2 VAL 101 -5.757 35.629 6.258 715 HG23 VAL 101 2HG2 VAL 101 -6.329 36.660 4.946 716 H ILE 102 H ILE 102 -1.568 34.550 4.797 717 HA ILE 102 HA ILE 102 0.327 34.486 3.540 718 HB ILE 102 HB ILE 102 -1.205 36.453 1.838 719 HG12 ILE 102 1HG1 ILE 102 -1.013 34.068 0.477 720 HG13 ILE 102 2HG1 ILE 102 -1.212 33.537 2.143 721 HG21 ILE 102 1HG2 ILE 102 1.514 35.346 1.602 722 HG22 ILE 102 2HG2 ILE 102 0.534 35.293 0.138 723 HG23 ILE 102 3HG2 ILE 102 0.830 36.833 0.945 724 HD11 ILE 102 3HD1 ILE 102 -3.378 33.645 1.347 725 HD12 ILE 102 1HD1 ILE 102 -3.190 35.179 2.196 726 HD13 ILE 102 2HD1 ILE 102 -3.077 35.125 0.436 727 HA PRO 103 HA PRO 103 1.942 38.279 5.608 728 HB2 PRO 103 1HB PRO 103 3.995 36.993 6.835 729 HB3 PRO 103 2HB PRO 103 2.369 37.081 7.522 730 HG2 PRO 103 1HG PRO 103 3.663 34.854 5.996 731 HG3 PRO 103 2HG PRO 103 2.657 34.774 7.454 732 HD2 PRO 103 1HD PRO 103 1.688 34.236 4.983 733 HD3 PRO 103 2HD PRO 103 0.694 34.965 6.261 734 HA PRO 104 HA PRO 104 5.248 39.153 2.844 735 HB2 PRO 104 1HB PRO 104 7.016 40.499 4.402 736 HB3 PRO 104 2HB PRO 104 5.475 41.190 3.882 737 HG2 PRO 104 1HG PRO 104 6.197 39.924 6.497 738 HG3 PRO 104 2HG PRO 104 5.252 41.392 6.188 739 HD2 PRO 104 1HD PRO 104 4.099 39.014 6.775 740 HD3 PRO 104 2HD PRO 104 3.334 40.208 5.707 741 H ASN 105 H ASN 105 7.030 38.185 2.030 742 HA ASN 105 HA ASN 105 8.819 36.796 1.829 743 HB2 ASN 105 1HB ASN 105 9.283 36.976 4.795 744 HB3 ASN 105 2HB ASN 105 10.467 36.814 3.500 745 HD21 ASN 105 2HD2 ASN 105 9.573 38.847 5.754 746 HD22 ASN 105 1HD2 ASN 105 9.822 40.366 4.969 747 H ALA 106 H ALA 106 6.168 35.756 2.416 748 HA ALA 106 HA ALA 106 6.845 33.273 3.845 749 HB1 ALA 106 1HB ALA 106 4.768 33.207 4.699 750 HB2 ALA 106 2HB ALA 106 4.753 34.928 4.314 751 HB3 ALA 106 3HB ALA 106 4.023 33.769 3.203 752 H THR 107 H THR 107 5.862 31.276 2.994 753 HA THR 107 HA THR 107 6.055 31.235 0.071 754 HB THR 107 HB THR 107 6.118 28.944 2.046 755 HG1 THR 107 HG1 THR 107 8.250 29.942 0.454 756 HG21 THR 107 3HG2 THR 107 5.746 29.012 -0.812 757 HG22 THR 107 1HG2 THR 107 5.720 27.632 0.286 758 HG23 THR 107 2HG2 THR 107 7.247 28.184 -0.401 759 H LEU 108 H LEU 108 4.322 30.960 -1.172 760 HA LEU 108 HA LEU 108 1.770 30.316 0.104 761 HB2 LEU 108 1HB LEU 108 2.004 31.096 -2.761 762 HB3 LEU 108 2HB LEU 108 0.712 31.428 -1.608 763 HG LEU 108 HG LEU 108 3.387 32.812 -1.774 764 HD11 LEU 108 1HD1 LEU 108 2.186 34.717 -2.487 765 HD12 LEU 108 2HD1 LEU 108 0.632 33.966 -2.124 766 HD13 LEU 108 3HD1 LEU 108 1.604 33.373 -3.470 767 HD21 LEU 108 3HD2 LEU 108 2.498 34.256 0.022 768 HD22 LEU 108 1HD2 LEU 108 2.755 32.591 0.545 769 HD23 LEU 108 2HD2 LEU 108 1.124 33.162 0.189 770 H VAL 109 H VAL 109 0.880 28.375 -0.089 771 HA VAL 109 HA VAL 109 1.966 26.522 -2.091 772 HB VAL 109 HB VAL 109 0.350 25.950 0.397 773 HG11 VAL 109 1HG1 VAL 109 0.980 24.334 -1.934 774 HG12 VAL 109 2HG1 VAL 109 1.543 23.603 -0.430 775 HG13 VAL 109 3HG1 VAL 109 -0.157 24.031 -0.621 776 HG21 VAL 109 3HG2 VAL 109 2.271 25.595 1.517 777 HG22 VAL 109 1HG2 VAL 109 3.083 24.906 0.112 778 HG23 VAL 109 2HG2 VAL 109 2.962 26.656 0.290 779 H PHE 110 H PHE 110 0.828 26.532 -3.921 780 HA PHE 110 HA PHE 110 -2.112 26.549 -3.730 781 HB2 PHE 110 1HB PHE 110 -0.270 27.721 -5.805 782 HB3 PHE 110 2HB PHE 110 -1.966 27.399 -6.151 783 HD1 PHE 110 HD1 PHE 110 -3.724 28.674 -5.057 784 HD2 PHE 110 HD2 PHE 110 0.388 29.508 -4.344 785 HE1 PHE 110 HE1 PHE 110 -4.339 30.842 -4.068 786 HE2 PHE 110 HE2 PHE 110 -0.220 31.677 -3.353 787 HZ PHE 110 HZ PHE 110 -2.586 32.346 -3.214 788 H GLU 111 H GLU 111 -3.210 24.895 -4.608 789 HA GLU 111 HA GLU 111 -1.644 22.829 -5.993 790 HB2 GLU 111 1HB GLU 111 -2.625 21.944 -4.016 791 HB3 GLU 111 2HB GLU 111 -4.177 22.691 -4.367 792 HG2 GLU 111 1HG GLU 111 -3.143 20.768 -6.357 793 HG3 GLU 111 2HG GLU 111 -3.668 20.115 -4.807 794 H VAL 112 H VAL 112 -1.943 22.575 -8.098 795 HA VAL 112 HA VAL 112 -4.488 23.483 -9.279 796 HB VAL 112 HB VAL 112 -1.813 23.426 -10.676 797 HG11 VAL 112 1HG1 VAL 112 -3.510 25.217 -11.935 798 HG12 VAL 112 2HG1 VAL 112 -3.092 23.595 -12.493 799 HG13 VAL 112 3HG1 VAL 112 -4.549 23.850 -11.533 800 HG21 VAL 112 3HG2 VAL 112 -2.382 26.044 -10.490 801 HG22 VAL 112 1HG2 VAL 112 -3.086 25.477 -8.975 802 HG23 VAL 112 2HG2 VAL 112 -1.381 25.185 -9.319 803 H GLU 113 H GLU 113 -5.640 22.018 -10.361 804 HA GLU 113 HA GLU 113 -4.293 19.570 -11.285 805 HB2 GLU 113 1HB GLU 113 -6.396 18.332 -10.662 806 HB3 GLU 113 2HB GLU 113 -5.438 18.908 -9.305 807 HG2 GLU 113 1HG GLU 113 -6.981 20.908 -9.233 808 HG3 GLU 113 2HG GLU 113 -8.012 20.031 -10.362 809 H LEU 114 H LEU 114 -4.516 19.324 -13.398 810 HA LEU 114 HA LEU 114 -6.232 20.926 -14.973 811 HB2 LEU 114 1HB LEU 114 -4.008 19.554 -15.498 812 HB3 LEU 114 2HB LEU 114 -5.188 18.377 -16.071 813 HG LEU 114 HG LEU 114 -4.542 19.596 -17.970 814 HD11 LEU 114 1HD1 LEU 114 -6.993 19.298 -17.667 815 HD12 LEU 114 2HD1 LEU 114 -6.558 20.664 -18.693 816 HD13 LEU 114 3HD1 LEU 114 -7.068 20.940 -17.027 817 HD21 LEU 114 3HD2 LEU 114 -4.224 21.750 -16.082 818 HD22 LEU 114 1HD2 LEU 114 -5.135 22.281 -17.496 819 HD23 LEU 114 2HD2 LEU 114 -3.538 21.559 -17.697 820 H LEU 115 H LEU 115 -8.290 20.660 -15.537 821 HA LEU 115 HA LEU 115 -9.562 18.069 -14.965 822 HB2 LEU 115 1HB LEU 115 -10.617 20.879 -14.999 823 HB3 LEU 115 2HB LEU 115 -11.692 19.484 -15.066 824 HG LEU 115 HG LEU 115 -9.829 19.270 -12.863 825 HD11 LEU 115 1HD1 LEU 115 -10.411 21.878 -13.328 826 HD12 LEU 115 2HD1 LEU 115 -10.074 21.194 -11.738 827 HD13 LEU 115 3HD1 LEU 115 -11.742 21.412 -12.269 828 HD21 LEU 115 3HD2 LEU 115 -12.173 19.272 -11.691 829 HD22 LEU 115 1HD2 LEU 115 -11.672 17.912 -12.695 830 HD23 LEU 115 2HD2 LEU 115 -12.768 19.132 -13.346 831 H ASP 116 H ASP 116 -9.096 20.550 -17.388 832 HA ASP 116 HA ASP 116 -9.567 18.760 -19.526 833 HB2 ASP 116 1HB ASP 116 -11.933 19.508 -18.538 834 HB3 ASP 116 2HB ASP 116 -11.638 20.897 -19.581 835 H VAL 117 H VAL 117 -9.310 19.783 -21.629 836 HA VAL 117 HA VAL 117 -8.276 22.524 -21.557 837 HB VAL 117 HB VAL 117 -6.301 21.134 -21.313 838 HG11 VAL 117 1HG1 VAL 117 -5.705 19.385 -22.768 839 HG12 VAL 117 2HG1 VAL 117 -7.409 19.117 -22.398 840 HG13 VAL 117 3HG1 VAL 117 -6.942 19.830 -23.943 841 HG21 VAL 117 3HG2 VAL 117 -6.605 23.123 -23.108 842 HG22 VAL 117 1HG2 VAL 117 -5.068 22.322 -22.783 843 HG23 VAL 117 2HG2 VAL 117 -6.044 21.828 -24.167 844 H11 L2S 130 1H1 L2S 130 -5.226 31.550 -9.103 845 H21 L2S 130 2H1 L2S 130 -5.434 31.844 -10.896 846 H12 L2S 130 1H2 L2S 130 -4.932 34.167 -10.588 847 H22 L2S 130 2H2 L2S 130 -3.553 33.139 -9.964 848 H13 L2S 130 2H3 L2S 130 -4.363 33.468 -7.717 849 H23 L2S 130 1H3 L2S 130 -4.161 35.105 -8.497 850 H14 L2S 130 1H4 L2S 130 -6.999 32.640 -7.535 851 H24 L2S 130 2H4 L2S 130 -8.125 33.832 -8.336 852 H15 L2S 130 1H5 L2S 130 -7.606 31.788 -9.713 853 H25 L2S 130 2H5 L2S 130 -7.197 33.410 -10.454 854 H17 L2S 130 1H7 L2S 130 -7.950 37.028 -6.917 855 H27 L2S 130 2H7 L2S 130 -8.503 35.730 -8.104 856 H9 L2S 130 H9 L2S 130 -7.418 34.030 -3.382 857 H10 L2S 130 H10 L2S 130 -6.841 35.124 -1.215 858 H112 L2S 130 1H12 L2S 130 -7.767 39.026 -2.947 859 H113 L2S 130 1H13 L2S 130 -8.386 37.914 -5.084 860 H114 L2S 130 1H14 L2S 130 -6.306 38.621 -0.927 861 H214 L2S 130 2H14 L2S 130 -6.419 37.049 -0.100 862 H314 L2S 130 3H14 L2S 130 -7.891 38.063 -0.289 Start of MODEL 5 1 H1 GLY 1 H GLY 1 9.078 0.375 -5.535 2 HA2 GLY 1 1HA GLY 1 8.046 2.141 -7.334 3 HA3 GLY 1 2HA GLY 1 7.263 1.772 -5.804 4 HA PRO 2 HA PRO 2 9.919 5.766 -5.096 5 HB2 PRO 2 1HB PRO 2 10.867 6.974 -7.334 6 HB3 PRO 2 2HB PRO 2 11.785 5.759 -6.437 7 HG2 PRO 2 1HG PRO 2 10.154 5.444 -8.928 8 HG3 PRO 2 2HG PRO 2 11.747 4.767 -8.540 9 HD2 PRO 2 1HD PRO 2 9.465 3.321 -8.354 10 HD3 PRO 2 2HD PRO 2 10.853 3.057 -7.279 11 H GLY 3 H GLY 3 7.713 6.364 -4.670 12 HA2 GLY 3 1HA GLY 3 6.037 7.483 -6.687 13 HA3 GLY 3 2HA GLY 3 5.789 7.597 -4.951 14 H SER 4 H SER 4 5.823 9.585 -4.166 15 HA SER 4 HA SER 4 7.447 11.611 -5.563 16 HB2 SER 4 1HB SER 4 4.840 11.756 -5.637 17 HB3 SER 4 2HB SER 4 5.001 12.331 -3.977 18 HG SER 4 HG SER 4 5.049 14.101 -5.328 19 H MET 5 H MET 5 9.242 11.463 -4.251 20 HA MET 5 HA MET 5 8.862 12.457 -1.512 21 HB2 MET 5 1HB MET 5 10.534 10.113 -2.396 22 HB3 MET 5 2HB MET 5 10.847 10.962 -0.888 23 HG2 MET 5 1HG MET 5 8.915 10.215 0.097 24 HG3 MET 5 2HG MET 5 8.099 9.964 -1.444 25 HE1 MET 5 3HE MET 5 8.463 7.115 1.050 26 HE2 MET 5 1HE MET 5 7.357 8.212 0.222 27 HE3 MET 5 2HE MET 5 7.674 6.610 -0.445 28 H THR 6 H THR 6 9.659 13.705 -4.083 29 HA THR 6 HA THR 6 11.931 15.160 -3.074 30 HB THR 6 HB THR 6 12.320 13.947 -5.795 31 HG1 THR 6 HG1 THR 6 13.464 12.863 -3.435 32 HG21 THR 6 3HG2 THR 6 13.851 15.648 -5.534 33 HG22 THR 6 1HG2 THR 6 14.764 14.284 -4.889 34 HG23 THR 6 2HG2 THR 6 13.975 15.415 -3.790 35 H VAL 7 H VAL 7 11.799 17.231 -3.683 36 HA VAL 7 HA VAL 7 9.971 17.894 -5.898 37 HB VAL 7 HB VAL 7 9.276 18.688 -3.638 38 HG11 VAL 7 1HG1 VAL 7 11.394 20.775 -3.733 39 HG12 VAL 7 2HG1 VAL 7 10.514 20.118 -2.351 40 HG13 VAL 7 3HG1 VAL 7 11.809 19.183 -3.099 41 HG21 VAL 7 3HG2 VAL 7 8.791 21.001 -4.345 42 HG22 VAL 7 1HG2 VAL 7 9.942 20.816 -5.669 43 HG23 VAL 7 2HG2 VAL 7 8.483 19.826 -5.624 44 H VAL 8 H VAL 8 10.591 19.356 -7.451 45 HA VAL 8 HA VAL 8 13.438 20.119 -7.423 46 HB VAL 8 HB VAL 8 12.963 18.559 -9.214 47 HG11 VAL 8 1HG1 VAL 8 10.961 18.509 -10.170 48 HG12 VAL 8 2HG1 VAL 8 10.522 20.036 -9.401 49 HG13 VAL 8 3HG1 VAL 8 11.329 20.036 -10.970 50 HG21 VAL 8 3HG2 VAL 8 13.279 21.363 -10.284 51 HG22 VAL 8 1HG2 VAL 8 14.575 20.354 -9.641 52 HG23 VAL 8 2HG2 VAL 8 13.734 19.876 -11.116 53 H THR 9 H THR 9 14.031 22.190 -7.998 54 HA THR 9 HA THR 9 11.824 24.136 -8.187 55 HB THR 9 HB THR 9 14.585 24.573 -7.032 56 HG1 THR 9 HG1 THR 9 13.213 24.861 -5.075 57 HG21 THR 9 3HG2 THR 9 12.434 26.386 -7.837 58 HG22 THR 9 1HG2 THR 9 14.133 26.722 -7.511 59 HG23 THR 9 2HG2 THR 9 12.982 26.625 -6.178 60 H THR 10 H THR 10 11.965 25.806 -9.665 61 HA THR 10 HA THR 10 13.830 25.344 -11.864 62 HB THR 10 HB THR 10 12.390 27.095 -13.030 63 HG1 THR 10 HG1 THR 10 10.532 26.526 -10.963 64 HG21 THR 10 3HG2 THR 10 12.127 24.741 -13.516 65 HG22 THR 10 1HG2 THR 10 10.535 25.493 -13.423 66 HG23 THR 10 2HG2 THR 10 11.131 24.520 -12.078 67 H GLU 11 H GLU 11 14.296 27.606 -13.055 68 HA GLU 11 HA GLU 11 16.096 28.977 -11.311 69 HB2 GLU 11 1HB GLU 11 15.312 29.300 -14.194 70 HB3 GLU 11 2HB GLU 11 16.340 30.487 -13.402 71 HG2 GLU 11 1HG GLU 11 16.949 27.546 -13.581 72 HG3 GLU 11 2HG GLU 11 17.591 28.777 -14.667 73 H SER 12 H SER 12 12.963 29.705 -12.740 74 HA SER 12 HA SER 12 12.796 32.421 -12.177 75 HB2 SER 12 1HB SER 12 11.119 31.378 -13.550 76 HB3 SER 12 2HB SER 12 10.634 30.307 -12.236 77 HG SER 12 HG SER 12 9.731 32.747 -12.801 78 H GLY 13 H GLY 13 12.608 29.686 -10.058 79 HA2 GLY 13 1HA GLY 13 13.136 30.168 -7.703 80 HA3 GLY 13 2HA GLY 13 12.024 31.524 -7.819 81 H LEU 14 H LEU 14 9.888 30.329 -9.124 82 HA LEU 14 HA LEU 14 8.423 29.242 -7.052 83 HB2 LEU 14 1HB LEU 14 6.730 28.860 -8.580 84 HB3 LEU 14 2HB LEU 14 7.666 30.147 -9.337 85 HG LEU 14 HG LEU 14 8.818 27.979 -10.466 86 HD11 LEU 14 1HD1 LEU 14 6.138 27.167 -9.523 87 HD12 LEU 14 2HD1 LEU 14 7.574 26.195 -9.847 88 HD13 LEU 14 3HD1 LEU 14 6.559 26.740 -11.182 89 HD21 LEU 14 3HD2 LEU 14 8.223 29.331 -12.131 90 HD22 LEU 14 1HD2 LEU 14 6.871 29.990 -11.209 91 HD23 LEU 14 2HD2 LEU 14 6.666 28.503 -12.135 92 H LYS 15 H LYS 15 7.356 27.011 -7.127 93 HA LYS 15 HA LYS 15 9.181 24.900 -7.990 94 HB2 LYS 15 1HB LYS 15 8.175 25.118 -5.147 95 HB3 LYS 15 2HB LYS 15 9.160 23.817 -5.802 96 HG2 LYS 15 1HG LYS 15 11.000 25.357 -6.160 97 HG3 LYS 15 2HG LYS 15 10.012 26.697 -5.572 98 HD2 LYS 15 1HD LYS 15 10.567 24.264 -3.895 99 HD3 LYS 15 2HD LYS 15 11.662 25.648 -3.929 100 HE2 LYS 15 1HE LYS 15 10.095 27.067 -2.958 101 HE3 LYS 15 2HE LYS 15 8.740 26.029 -3.396 102 HZ1 LYS 15 3HZ LYS 15 10.550 24.653 -1.702 103 HZ2 LYS 15 1HZ LYS 15 8.904 24.971 -1.472 104 HZ3 LYS 15 2HZ LYS 15 10.060 26.102 -0.979 105 H TYR 16 H TYR 16 8.184 22.713 -7.712 106 HA TYR 16 HA TYR 16 5.302 22.633 -7.453 107 HB2 TYR 16 1HB TYR 16 5.103 21.492 -9.729 108 HB3 TYR 16 2HB TYR 16 5.325 23.238 -9.737 109 HD1 TYR 16 HD2 TYR 16 7.143 20.023 -10.138 110 HD2 TYR 16 HD1 TYR 16 7.117 24.209 -10.899 111 HE1 TYR 16 HE2 TYR 16 9.095 19.762 -11.611 112 HE2 TYR 16 HE1 TYR 16 9.068 23.959 -12.375 113 HH TYR 16 HH TYR 16 10.094 22.082 -13.767 114 H GLU 17 H GLU 17 4.499 20.573 -7.072 115 HA GLU 17 HA GLU 17 6.442 18.371 -7.047 116 HB2 GLU 17 1HB GLU 17 6.132 19.494 -4.765 117 HB3 GLU 17 2HB GLU 17 4.510 18.816 -4.780 118 HG2 GLU 17 1HG GLU 17 5.579 16.561 -5.108 119 HG3 GLU 17 2HG GLU 17 7.125 17.340 -4.777 120 H ASP 18 H ASP 18 5.672 16.742 -8.198 121 HA ASP 18 HA ASP 18 3.119 16.572 -9.267 122 HB2 ASP 18 1HB ASP 18 3.688 14.148 -9.681 123 HB3 ASP 18 2HB ASP 18 4.880 15.305 -10.266 124 H LEU 19 H LEU 19 1.218 15.684 -8.646 125 HA LEU 19 HA LEU 19 1.132 14.383 -6.004 126 HB2 LEU 19 1HB LEU 19 -0.268 16.728 -6.999 127 HB3 LEU 19 2HB LEU 19 -1.368 15.500 -6.377 128 HG LEU 19 HG LEU 19 -0.186 15.545 -4.225 129 HD11 LEU 19 1HD1 LEU 19 2.022 16.178 -4.986 130 HD12 LEU 19 2HD1 LEU 19 1.444 17.332 -3.785 131 HD13 LEU 19 3HD1 LEU 19 1.422 17.755 -5.497 132 HD21 LEU 19 3HD2 LEU 19 -0.649 18.292 -4.121 133 HD22 LEU 19 1HD2 LEU 19 -1.796 17.002 -3.757 134 HD23 LEU 19 2HD2 LEU 19 -1.729 17.690 -5.380 135 H THR 20 H THR 20 -0.252 14.634 -9.226 136 HA THR 20 HA THR 20 -1.135 11.862 -9.031 137 HB THR 20 HB THR 20 -3.042 13.972 -10.043 138 HG1 THR 20 HG1 THR 20 -3.213 12.607 -7.553 139 HG21 THR 20 3HG2 THR 20 -4.551 12.283 -10.370 140 HG22 THR 20 1HG2 THR 20 -3.863 11.272 -9.099 141 HG23 THR 20 2HG2 THR 20 -3.057 11.392 -10.663 142 H GLU 21 H GLU 21 -0.218 10.893 -10.709 143 HA GLU 21 HA GLU 21 0.846 12.203 -12.945 144 HB2 GLU 21 1HB GLU 21 1.526 9.945 -12.119 145 HB3 GLU 21 2HB GLU 21 0.025 9.301 -12.769 146 HG2 GLU 21 1HG GLU 21 0.891 10.415 -14.986 147 HG3 GLU 21 2HG GLU 21 2.454 10.254 -14.188 148 H GLY 22 H GLY 22 -0.109 13.057 -14.665 149 HA2 GLY 22 1HA GLY 22 -2.864 12.215 -15.291 150 HA3 GLY 22 2HA GLY 22 -2.172 13.781 -15.687 151 H SER 23 H SER 23 -3.304 11.183 -17.121 152 HA SER 23 HA SER 23 -1.197 11.058 -19.173 153 HB2 SER 23 1HB SER 23 -3.404 9.095 -18.513 154 HB3 SER 23 2HB SER 23 -2.307 8.932 -19.884 155 HG SER 23 HG SER 23 -1.870 8.470 -17.205 156 H GLY 24 H GLY 24 -2.921 13.268 -19.107 157 HA2 GLY 24 1HA GLY 24 -4.735 12.743 -21.376 158 HA3 GLY 24 2HA GLY 24 -4.941 14.046 -20.215 159 H ALA 25 H ALA 25 -4.956 15.714 -21.677 160 HA ALA 25 HA ALA 25 -2.666 16.008 -23.473 161 HB1 ALA 25 1HB ALA 25 -4.375 16.599 -24.802 162 HB2 ALA 25 2HB ALA 25 -5.431 16.989 -23.444 163 HB3 ALA 25 3HB ALA 25 -4.233 18.160 -23.993 164 H GLU 26 H GLU 26 -1.183 17.629 -23.315 165 HA GLU 26 HA GLU 26 -0.990 18.965 -20.762 166 HB2 GLU 26 1HB GLU 26 1.048 18.079 -21.614 167 HB3 GLU 26 2HB GLU 26 0.809 18.847 -23.177 168 HG2 GLU 26 1HG GLU 26 0.901 20.717 -20.933 169 HG3 GLU 26 2HG GLU 26 2.387 19.802 -21.177 170 H ALA 27 H ALA 27 -1.318 21.078 -20.336 171 HA ALA 27 HA ALA 27 -2.930 22.632 -22.023 172 HB1 ALA 27 1HB ALA 27 -2.102 22.766 -19.391 173 HB2 ALA 27 2HB ALA 27 -1.412 24.215 -20.122 174 HB3 ALA 27 3HB ALA 27 -3.148 23.920 -20.218 175 H ARG 28 H ARG 28 -2.408 23.649 -23.834 176 HA ARG 28 HA ARG 28 0.381 24.299 -24.381 177 HB2 ARG 28 1HB ARG 28 -2.080 23.952 -26.020 178 HB3 ARG 28 2HB ARG 28 -0.835 25.030 -26.639 179 HG2 ARG 28 1HG ARG 28 -0.387 22.160 -25.847 180 HG3 ARG 28 2HG ARG 28 -0.640 22.732 -27.497 181 HD2 ARG 28 1HD ARG 28 1.451 24.181 -26.066 182 HD3 ARG 28 2HD ARG 28 1.788 22.460 -26.248 183 HE ARG 28 HE ARG 28 0.942 23.445 -28.720 184 HH11 ARG 28 1HH1 ARG 28 3.615 23.789 -26.516 185 HH12 ARG 28 2HH1 ARG 28 4.763 24.158 -27.760 186 HH21 ARG 28 1HH2 ARG 28 2.444 23.930 -30.367 187 HH22 ARG 28 2HH2 ARG 28 4.096 24.239 -29.950 188 H ALA 29 H ALA 29 1.027 26.383 -25.141 189 HA ALA 29 HA ALA 29 -0.079 28.522 -23.628 190 HB1 ALA 29 1HB ALA 29 1.545 29.830 -25.279 191 HB2 ALA 29 2HB ALA 29 2.145 28.883 -23.917 192 HB3 ALA 29 3HB ALA 29 2.160 28.198 -25.542 193 H GLY 30 H GLY 30 -1.491 30.087 -24.176 194 HA2 GLY 30 1HA GLY 30 -2.758 31.474 -25.556 195 HA3 GLY 30 2HA GLY 30 -2.122 30.622 -26.956 196 H GLN 31 H GLN 31 -3.154 28.340 -24.800 197 HA GLN 31 HA GLN 31 -5.755 28.129 -26.162 198 HB2 GLN 31 1HB GLN 31 -3.880 26.313 -26.375 199 HB3 GLN 31 2HB GLN 31 -4.440 25.818 -24.783 200 HG2 GLN 31 1HG GLN 31 -6.558 25.238 -25.579 201 HG3 GLN 31 2HG GLN 31 -6.335 26.135 -27.080 202 HE21 GLN 31 2HE2 GLN 31 -6.400 23.132 -25.759 203 HE22 GLN 31 1HE2 GLN 31 -5.486 22.271 -26.946 204 H THR 32 H THR 32 -7.605 27.821 -24.997 205 HA THR 32 HA THR 32 -7.488 28.535 -22.198 206 HB THR 32 HB THR 32 -10.052 27.744 -23.506 207 HG1 THR 32 HG1 THR 32 -10.077 29.473 -24.799 208 HG21 THR 32 3HG2 THR 32 -10.967 29.477 -22.148 209 HG22 THR 32 1HG2 THR 32 -9.367 30.124 -21.786 210 HG23 THR 32 2HG2 THR 32 -9.856 28.560 -21.131 211 H VAL 33 H VAL 33 -7.769 27.221 -20.491 212 HA VAL 33 HA VAL 33 -8.799 24.513 -20.916 213 HB VAL 33 HB VAL 33 -7.012 23.465 -19.695 214 HG11 VAL 33 1HG1 VAL 33 -5.427 25.156 -21.547 215 HG12 VAL 33 2HG1 VAL 33 -5.499 23.399 -21.395 216 HG13 VAL 33 3HG1 VAL 33 -6.794 24.269 -22.219 217 HG21 VAL 33 3HG2 VAL 33 -4.942 25.142 -19.342 218 HG22 VAL 33 1HG2 VAL 33 -6.283 26.256 -19.075 219 HG23 VAL 33 2HG2 VAL 33 -6.138 24.799 -18.092 220 H SER 34 H SER 34 -9.559 23.481 -18.996 221 HA SER 34 HA SER 34 -10.229 25.400 -16.868 222 HB2 SER 34 1HB SER 34 -11.752 22.881 -16.983 223 HB3 SER 34 2HB SER 34 -12.323 24.538 -16.783 224 HG SER 34 HG SER 34 -11.706 23.156 -19.166 225 H VAL 35 H VAL 35 -9.429 25.087 -14.900 226 HA VAL 35 HA VAL 35 -8.714 22.392 -14.025 227 HB VAL 35 HB VAL 35 -6.510 22.928 -13.360 228 HG11 VAL 35 1HG1 VAL 35 -6.957 22.541 -15.832 229 HG12 VAL 35 2HG1 VAL 35 -6.731 24.279 -16.035 230 HG13 VAL 35 3HG1 VAL 35 -5.414 23.284 -15.411 231 HG21 VAL 35 3HG2 VAL 35 -5.872 25.472 -14.183 232 HG22 VAL 35 1HG2 VAL 35 -7.488 25.669 -13.504 233 HG23 VAL 35 2HG2 VAL 35 -6.197 24.978 -12.521 234 H HIS 36 H HIS 36 -8.009 22.453 -11.654 235 HA HIS 36 HA HIS 36 -9.724 24.375 -10.224 236 HB2 HIS 36 1HB HIS 36 -9.233 21.467 -9.882 237 HB3 HIS 36 2HB HIS 36 -9.419 22.415 -8.409 238 HD1 HIS 36 HD1 HIS 36 -11.619 24.368 -9.506 239 HD2 HIS 36 HD2 HIS 36 -11.682 20.228 -9.846 240 HE1 HIS 36 HE1 HIS 36 -14.039 23.755 -9.801 241 H TYR 37 H TYR 37 -8.843 25.653 -8.715 242 HA TYR 37 HA TYR 37 -6.030 25.161 -7.984 243 HB2 TYR 37 1HB TYR 37 -5.744 27.564 -7.779 244 HB3 TYR 37 2HB TYR 37 -6.376 27.181 -9.376 245 HD1 TYR 37 HD2 TYR 37 -7.268 28.529 -6.052 246 HD2 TYR 37 HD1 TYR 37 -8.475 28.026 -10.101 247 HE1 TYR 37 HE2 TYR 37 -9.119 30.107 -5.690 248 HE2 TYR 37 HE1 TYR 37 -10.329 29.604 -9.750 249 HH TYR 37 HH TYR 37 -11.237 31.096 -8.347 250 H THR 38 H THR 38 -5.432 25.269 -5.865 251 HA THR 38 HA THR 38 -7.501 25.939 -3.888 252 HB THR 38 HB THR 38 -5.896 23.862 -2.799 253 HG1 THR 38 HG1 THR 38 -6.700 22.200 -4.358 254 HG21 THR 38 3HG2 THR 38 -8.721 24.472 -3.298 255 HG22 THR 38 1HG2 THR 38 -7.944 23.798 -1.866 256 HG23 THR 38 2HG2 THR 38 -8.353 22.749 -3.224 257 H GLY 39 H GLY 39 -6.749 27.577 -2.718 258 HA2 GLY 39 1HA GLY 39 -3.888 28.002 -2.443 259 HA3 GLY 39 2HA GLY 39 -5.162 29.088 -1.908 260 H TRP 40 H TRP 40 -2.689 27.455 -0.750 261 HA TRP 40 HA TRP 40 -4.029 26.936 1.816 262 HB2 TRP 40 1HB TRP 40 -2.065 25.177 0.360 263 HB3 TRP 40 2HB TRP 40 -2.272 25.073 2.106 264 HD1 TRP 40 HD1 TRP 40 -5.398 25.262 2.337 265 HE1 TRP 40 HE1 TRP 40 -6.881 23.344 1.473 266 HE3 TRP 40 HE3 TRP 40 -2.110 23.104 -0.930 267 HZ2 TRP 40 HZ2 TRP 40 -6.683 21.200 -0.353 268 HZ3 TRP 40 HZ3 TRP 40 -2.835 21.123 -2.196 269 HH2 TRP 40 HH2 TRP 40 -5.075 20.192 -1.911 270 H LEU 41 H LEU 41 -3.017 27.724 3.585 271 HA LEU 41 HA LEU 41 -0.826 29.534 3.190 272 HB2 LEU 41 1HB LEU 41 -2.692 28.843 5.356 273 HB3 LEU 41 2HB LEU 41 -1.099 29.381 5.884 274 HG LEU 41 HG LEU 41 -2.992 30.936 4.120 275 HD11 LEU 41 1HD1 LEU 41 -2.621 32.413 6.357 276 HD12 LEU 41 2HD1 LEU 41 -2.593 30.781 7.025 277 HD13 LEU 41 3HD1 LEU 41 -3.987 31.328 6.093 278 HD21 LEU 41 3HD2 LEU 41 -0.849 32.424 5.344 279 HD22 LEU 41 1HD2 LEU 41 -1.318 32.318 3.647 280 HD23 LEU 41 2HD2 LEU 41 -0.217 31.124 4.333 281 H THR 42 H THR 42 0.995 29.485 4.903 282 HA THR 42 HA THR 42 2.617 27.263 4.405 283 HB THR 42 HB THR 42 4.160 28.167 6.049 284 HG1 THR 42 HG1 THR 42 3.275 30.208 7.124 285 HG21 THR 42 3HG2 THR 42 4.163 30.606 5.252 286 HG22 THR 42 1HG2 THR 42 2.753 30.160 4.293 287 HG23 THR 42 2HG2 THR 42 4.295 29.347 4.025 288 H ASP 43 H ASP 43 0.508 28.021 7.122 289 HA ASP 43 HA ASP 43 1.352 25.719 8.644 290 HB2 ASP 43 1HB ASP 43 -1.079 27.444 9.133 291 HB3 ASP 43 2HB ASP 43 -0.229 26.427 10.295 292 H GLY 44 H GLY 44 -0.957 26.396 6.201 293 HA2 GLY 44 1HA GLY 44 -1.860 24.394 5.080 294 HA3 GLY 44 2HA GLY 44 -2.207 23.761 6.683 295 H GLN 45 H GLN 45 -2.814 27.031 6.674 296 HA GLN 45 HA GLN 45 -5.642 26.623 6.828 297 HB2 GLN 45 1HB GLN 45 -3.960 28.448 7.912 298 HB3 GLN 45 2HB GLN 45 -4.619 29.383 6.576 299 HG2 GLN 45 1HG GLN 45 -6.801 29.239 7.398 300 HG3 GLN 45 2HG GLN 45 -6.397 27.912 8.486 301 HE21 GLN 45 2HE2 GLN 45 -7.707 30.359 9.164 302 HE22 GLN 45 1HE2 GLN 45 -6.705 31.174 10.312 303 H LYS 46 H LYS 46 -6.832 26.315 5.069 304 HA LYS 46 HA LYS 46 -6.061 27.133 2.466 305 HB2 LYS 46 1HB LYS 46 -7.611 25.200 3.141 306 HB3 LYS 46 2HB LYS 46 -8.871 26.418 3.281 307 HG2 LYS 46 1HG LYS 46 -8.097 27.041 0.852 308 HG3 LYS 46 2HG LYS 46 -7.492 25.383 0.858 309 HD2 LYS 46 1HD LYS 46 -10.317 26.112 1.610 310 HD3 LYS 46 2HD LYS 46 -9.832 25.695 -0.035 311 HE2 LYS 46 1HE LYS 46 -10.511 23.644 0.723 312 HE3 LYS 46 2HE LYS 46 -8.802 23.588 1.154 313 HZ1 LYS 46 3HZ LYS 46 -9.254 23.784 3.360 314 HZ2 LYS 46 1HZ LYS 46 -10.669 22.990 2.878 315 HZ3 LYS 46 2HZ LYS 46 -10.680 24.663 3.124 316 H PHE 47 H PHE 47 -6.588 28.889 1.278 317 HA PHE 47 HA PHE 47 -8.526 30.798 2.377 318 HB2 PHE 47 1HB PHE 47 -7.009 32.672 1.892 319 HB3 PHE 47 2HB PHE 47 -6.312 31.573 3.078 320 HD1 PHE 47 HD2 PHE 47 -6.083 32.861 -0.332 321 HD2 PHE 47 HD1 PHE 47 -4.390 30.214 2.539 322 HE1 PHE 47 HE2 PHE 47 -4.065 32.648 -1.723 323 HE2 PHE 47 HE1 PHE 47 -2.369 29.998 1.153 324 HZ PHE 47 HZ PHE 47 -2.205 31.215 -0.982 325 H ASP 48 H ASP 48 -8.449 28.847 0.113 326 HA ASP 48 HA ASP 48 -9.851 30.341 -1.785 327 HB2 ASP 48 1HB ASP 48 -7.151 30.831 -2.039 328 HB3 ASP 48 2HB ASP 48 -7.423 29.552 -3.220 329 H SER 49 H SER 49 -11.139 28.933 -2.767 330 HA SER 49 HA SER 49 -10.128 26.306 -3.532 331 HB2 SER 49 1HB SER 49 -12.568 25.597 -2.504 332 HB3 SER 49 2HB SER 49 -11.026 25.372 -1.679 333 HG SER 49 HG SER 49 -12.859 26.577 -0.589 334 H SER 50 H SER 50 -10.524 26.357 -5.649 335 HA SER 50 HA SER 50 -12.540 27.847 -6.908 336 HB2 SER 50 1HB SER 50 -10.519 27.061 -8.076 337 HB3 SER 50 2HB SER 50 -11.088 25.397 -7.940 338 HG SER 50 HG SER 50 -11.528 26.700 -9.965 339 H LYS 51 H LYS 51 -12.565 24.703 -5.458 340 HA LYS 51 HA LYS 51 -14.779 23.575 -6.764 341 HB2 LYS 51 1HB LYS 51 -13.688 23.167 -3.978 342 HB3 LYS 51 2HB LYS 51 -14.997 22.205 -4.650 343 HG2 LYS 51 1HG LYS 51 -12.450 22.420 -6.173 344 HG3 LYS 51 2HG LYS 51 -12.516 21.374 -4.753 345 HD2 LYS 51 1HD LYS 51 -14.739 20.538 -5.919 346 HD3 LYS 51 2HD LYS 51 -13.921 21.134 -7.366 347 HE2 LYS 51 1HE LYS 51 -12.924 19.056 -5.423 348 HE3 LYS 51 2HE LYS 51 -13.408 18.805 -7.100 349 HZ1 LYS 51 3HZ LYS 51 -10.889 19.604 -6.067 350 HZ2 LYS 51 1HZ LYS 51 -11.461 20.749 -7.172 351 HZ3 LYS 51 2HZ LYS 51 -11.298 19.132 -7.639 352 H ASP 52 H ASP 52 -14.547 26.060 -4.383 353 HA ASP 52 HA ASP 52 -17.010 25.921 -3.118 354 HB2 ASP 52 1HB ASP 52 -14.987 27.577 -2.833 355 HB3 ASP 52 2HB ASP 52 -15.917 28.584 -3.939 356 H ARG 53 H ARG 53 -16.177 27.517 -6.179 357 HA ARG 53 HA ARG 53 -18.841 28.419 -6.673 358 HB2 ARG 53 1HB ARG 53 -16.440 29.140 -7.658 359 HB3 ARG 53 2HB ARG 53 -16.977 28.076 -8.951 360 HG2 ARG 53 1HG ARG 53 -18.851 30.159 -7.957 361 HG3 ARG 53 2HG ARG 53 -17.503 30.647 -8.986 362 HD2 ARG 53 1HD ARG 53 -18.326 28.657 -10.479 363 HD3 ARG 53 2HD ARG 53 -19.842 28.904 -9.612 364 HE ARG 53 HE ARG 53 -18.787 31.338 -10.671 365 HH11 ARG 53 1HH1 ARG 53 -20.592 28.470 -11.469 366 HH12 ARG 53 2HH1 ARG 53 -21.434 29.210 -12.790 367 HH21 ARG 53 1HH2 ARG 53 -19.890 32.324 -12.407 368 HH22 ARG 53 2HH2 ARG 53 -21.034 31.402 -13.323 369 H ASN 54 H ASN 54 -17.440 25.397 -6.805 370 HA ASN 54 HA ASN 54 -18.073 23.387 -7.660 371 HB2 ASN 54 1HB ASN 54 -20.639 24.942 -7.745 372 HB3 ASN 54 2HB ASN 54 -20.571 23.314 -8.414 373 HD21 ASN 54 2HD2 ASN 54 -22.275 23.625 -6.449 374 HD22 ASN 54 1HD2 ASN 54 -21.693 22.952 -4.968 375 H ASP 55 H ASP 55 -16.667 25.027 -9.401 376 HA ASP 55 HA ASP 55 -17.393 23.861 -11.919 377 HB2 ASP 55 1HB ASP 55 -18.831 25.651 -12.293 378 HB3 ASP 55 2HB ASP 55 -17.810 26.785 -11.415 379 HA PRO 56 HA PRO 56 -13.020 24.052 -12.354 380 HB2 PRO 56 1HB PRO 56 -12.830 23.670 -15.035 381 HB3 PRO 56 2HB PRO 56 -13.251 22.375 -13.908 382 HG2 PRO 56 1HG PRO 56 -15.042 24.042 -15.633 383 HG3 PRO 56 2HG PRO 56 -15.095 22.297 -15.323 384 HD2 PRO 56 1HD PRO 56 -16.740 24.049 -14.075 385 HD3 PRO 56 2HD PRO 56 -16.161 22.562 -13.296 386 H PHE 57 H PHE 57 -11.594 25.670 -12.518 387 HA PHE 57 HA PHE 57 -12.399 28.223 -13.502 388 HB2 PHE 57 1HB PHE 57 -10.922 28.125 -11.601 389 HB3 PHE 57 2HB PHE 57 -9.737 27.192 -12.510 390 HD1 PHE 57 HD2 PHE 57 -11.612 30.367 -13.110 391 HD2 PHE 57 HD1 PHE 57 -7.844 28.393 -12.954 392 HE1 PHE 57 HE2 PHE 57 -10.495 32.453 -13.784 393 HE2 PHE 57 HE1 PHE 57 -6.721 30.476 -13.628 394 HZ PHE 57 HZ PHE 57 -8.047 32.510 -14.045 395 H ALA 58 H ALA 58 -12.691 28.376 -15.656 396 HA ALA 58 HA ALA 58 -10.720 27.232 -17.477 397 HB1 ALA 58 1HB ALA 58 -13.521 27.843 -17.619 398 HB2 ALA 58 2HB ALA 58 -12.660 28.617 -18.951 399 HB3 ALA 58 3HB ALA 58 -12.530 26.875 -18.711 400 H PHE 59 H PHE 59 -9.001 28.406 -17.991 401 HA PHE 59 HA PHE 59 -9.359 31.258 -18.568 402 HB2 PHE 59 1HB PHE 59 -7.503 31.935 -17.278 403 HB3 PHE 59 2HB PHE 59 -8.401 30.841 -16.230 404 HD1 PHE 59 HD1 PHE 59 -7.626 28.390 -16.169 405 HD2 PHE 59 HD2 PHE 59 -5.249 31.586 -17.670 406 HE1 PHE 59 HE1 PHE 59 -5.602 27.028 -15.855 407 HE2 PHE 59 HE2 PHE 59 -3.221 30.229 -17.359 408 HZ PHE 59 HZ PHE 59 -3.396 27.946 -16.451 409 H VAL 60 H VAL 60 -7.341 32.153 -19.675 410 HA VAL 60 HA VAL 60 -6.607 30.281 -21.788 411 HB VAL 60 HB VAL 60 -6.121 33.257 -21.584 412 HG11 VAL 60 1HG1 VAL 60 -4.517 32.622 -23.087 413 HG12 VAL 60 2HG1 VAL 60 -5.423 31.206 -23.625 414 HG13 VAL 60 3HG1 VAL 60 -5.893 32.816 -24.172 415 HG21 VAL 60 3HG2 VAL 60 -8.204 31.693 -23.105 416 HG22 VAL 60 1HG2 VAL 60 -8.486 32.759 -21.729 417 HG23 VAL 60 2HG2 VAL 60 -7.921 33.426 -23.261 418 H LEU 61 H LEU 61 -4.576 29.568 -22.179 419 HA LEU 61 HA LEU 61 -2.653 29.724 -20.083 420 HB2 LEU 61 1HB LEU 61 -3.154 27.912 -21.986 421 HB3 LEU 61 2HB LEU 61 -1.834 28.780 -22.767 422 HG LEU 61 HG LEU 61 -0.684 27.101 -21.721 423 HD11 LEU 61 1HD1 LEU 61 -0.855 29.100 -19.475 424 HD12 LEU 61 2HD1 LEU 61 0.107 29.326 -20.935 425 HD13 LEU 61 3HD1 LEU 61 0.476 28.000 -19.833 426 HD21 LEU 61 3HD2 LEU 61 -2.657 26.109 -20.645 427 HD22 LEU 61 1HD2 LEU 61 -2.547 27.309 -19.357 428 HD23 LEU 61 2HD2 LEU 61 -1.257 26.126 -19.572 429 H GLY 62 H GLY 62 -1.065 31.147 -19.786 430 HA2 GLY 62 1HA GLY 62 0.697 32.228 -21.524 431 HA3 GLY 62 2HA GLY 62 -0.697 33.283 -21.702 432 H GLY 63 H GLY 63 -1.288 34.657 -20.013 433 HA2 GLY 63 1HA GLY 63 -0.331 34.676 -17.421 434 HA3 GLY 63 2HA GLY 63 0.871 35.535 -18.373 435 H GLY 64 H GLY 64 -2.599 35.553 -18.981 436 HA2 GLY 64 1HA GLY 64 -2.578 38.456 -18.824 437 HA3 GLY 64 2HA GLY 64 -3.901 37.450 -19.396 438 H MET 65 H MET 65 -4.506 35.834 -17.364 439 HA MET 65 HA MET 65 -5.085 37.664 -15.127 440 HB2 MET 65 1HB MET 65 -6.829 35.677 -16.542 441 HB3 MET 65 2HB MET 65 -7.148 36.084 -14.861 442 HG2 MET 65 1HG MET 65 -6.884 38.198 -16.966 443 HG3 MET 65 2HG MET 65 -8.409 37.366 -16.669 444 HE1 MET 65 3HE MET 65 -10.165 38.708 -14.466 445 HE2 MET 65 1HE MET 65 -9.674 40.275 -15.110 446 HE3 MET 65 2HE MET 65 -9.799 38.882 -16.183 447 H VAL 66 H VAL 66 -2.803 35.972 -15.277 448 HA VAL 66 HA VAL 66 -3.296 34.340 -12.904 449 HB VAL 66 HB VAL 66 -2.145 32.407 -13.759 450 HG11 VAL 66 1HG1 VAL 66 -3.829 31.544 -15.090 451 HG12 VAL 66 2HG1 VAL 66 -4.637 32.899 -14.300 452 HG13 VAL 66 3HG1 VAL 66 -4.061 33.060 -15.960 453 HG21 VAL 66 3HG2 VAL 66 -0.548 33.516 -15.217 454 HG22 VAL 66 1HG2 VAL 66 -1.416 32.261 -16.102 455 HG23 VAL 66 2HG2 VAL 66 -1.842 33.957 -16.331 456 H ILE 67 H ILE 67 -1.007 33.319 -12.274 457 HA ILE 67 HA ILE 67 0.880 35.578 -12.295 458 HB ILE 67 HB ILE 67 1.703 34.877 -10.192 459 HG12 ILE 67 1HG1 ILE 67 0.074 32.360 -10.589 460 HG13 ILE 67 2HG1 ILE 67 1.830 32.485 -10.570 461 HG21 ILE 67 1HG2 ILE 67 -0.042 35.663 -9.054 462 HG22 ILE 67 2HG2 ILE 67 -0.949 35.582 -10.563 463 HG23 ILE 67 3HG2 ILE 67 -1.015 34.239 -9.423 464 HD11 ILE 67 3HD1 ILE 67 -0.028 32.954 -8.251 465 HD12 ILE 67 1HD1 ILE 67 1.045 31.575 -8.488 466 HD13 ILE 67 2HD1 ILE 67 1.721 33.181 -8.212 467 H LYS 68 H LYS 68 3.206 34.953 -12.087 468 HA LYS 68 HA LYS 68 4.122 33.550 -14.250 469 HB2 LYS 68 1HB LYS 68 5.388 34.165 -11.597 470 HB3 LYS 68 2HB LYS 68 6.265 33.251 -12.816 471 HG2 LYS 68 1HG LYS 68 5.773 35.174 -14.398 472 HG3 LYS 68 2HG LYS 68 5.272 36.078 -12.967 473 HD2 LYS 68 1HD LYS 68 7.470 35.771 -11.977 474 HD3 LYS 68 2HD LYS 68 7.976 34.794 -13.358 475 HE2 LYS 68 1HE LYS 68 7.179 36.994 -14.654 476 HE3 LYS 68 2HE LYS 68 7.635 37.726 -13.117 477 HZ1 LYS 68 3HZ LYS 68 9.799 36.489 -13.373 478 HZ2 LYS 68 1HZ LYS 68 9.548 37.769 -14.451 479 HZ3 LYS 68 2HZ LYS 68 9.342 36.172 -14.970 480 H GLY 69 H GLY 69 3.996 32.299 -10.907 481 HA2 GLY 69 1HA GLY 69 4.846 29.710 -11.420 482 HA3 GLY 69 2HA GLY 69 3.760 30.158 -10.112 483 H TRP 70 H TRP 70 1.696 31.141 -11.954 484 HA TRP 70 HA TRP 70 0.266 28.716 -12.278 485 HB2 TRP 70 1HB TRP 70 -0.297 31.510 -12.401 486 HB3 TRP 70 2HB TRP 70 -0.911 30.763 -13.874 487 HD1 TRP 70 HD1 TRP 70 -3.242 29.718 -13.686 488 HE1 TRP 70 HE1 TRP 70 -4.789 29.003 -11.756 489 HE3 TRP 70 HE3 TRP 70 -0.064 30.513 -9.761 490 HZ2 TRP 70 HZ2 TRP 70 -4.677 28.804 -8.943 491 HZ3 TRP 70 HZ3 TRP 70 -0.862 30.036 -7.483 492 HH2 TRP 70 HH2 TRP 70 -3.120 29.200 -7.084 493 H ASP 71 H ASP 71 1.396 31.056 -14.727 494 HA ASP 71 HA ASP 71 0.790 29.574 -16.984 495 HB2 ASP 71 1HB ASP 71 1.456 31.860 -17.223 496 HB3 ASP 71 2HB ASP 71 3.024 31.544 -16.484 497 H GLU 72 H GLU 72 3.787 29.563 -15.078 498 HA GLU 72 HA GLU 72 5.214 27.750 -16.671 499 HB2 GLU 72 1HB GLU 72 6.115 29.202 -14.799 500 HB3 GLU 72 2HB GLU 72 5.471 28.012 -13.676 501 HG2 GLU 72 1HG GLU 72 7.636 27.310 -13.861 502 HG3 GLU 72 2HG GLU 72 6.862 26.332 -15.107 503 H GLY 73 H GLY 73 3.039 27.227 -13.924 504 HA2 GLY 73 1HA GLY 73 3.447 24.443 -13.696 505 HA3 GLY 73 2HA GLY 73 2.043 25.324 -13.112 506 H VAL 74 H VAL 74 0.594 26.104 -15.050 507 HA VAL 74 HA VAL 74 -0.562 23.836 -16.186 508 HB VAL 74 HB VAL 74 -1.717 25.493 -17.738 509 HG11 VAL 74 1HG1 VAL 74 -2.154 26.573 -15.050 510 HG12 VAL 74 2HG1 VAL 74 -3.275 25.761 -16.145 511 HG13 VAL 74 3HG1 VAL 74 -2.177 24.812 -15.140 512 HG21 VAL 74 3HG2 VAL 74 -0.949 27.768 -16.104 513 HG22 VAL 74 1HG2 VAL 74 0.403 27.118 -17.031 514 HG23 VAL 74 2HG2 VAL 74 -1.070 27.626 -17.857 515 H GLN 75 H GLN 75 2.027 25.858 -17.314 516 HA GLN 75 HA GLN 75 2.005 25.381 -20.038 517 HB2 GLN 75 1HB GLN 75 3.995 26.178 -18.047 518 HB3 GLN 75 2HB GLN 75 4.690 25.328 -19.421 519 HG2 GLN 75 1HG GLN 75 2.861 27.701 -19.676 520 HG3 GLN 75 2HG GLN 75 4.620 27.812 -19.634 521 HE21 GLN 75 2HE2 GLN 75 5.822 26.900 -21.348 522 HE22 GLN 75 1HE2 GLN 75 5.104 26.638 -22.898 523 H GLY 76 H GLY 76 2.746 23.219 -17.440 524 HA2 GLY 76 1HA GLY 76 3.532 21.170 -19.422 525 HA3 GLY 76 2HA GLY 76 4.218 21.245 -17.806 526 H MET 77 H MET 77 1.435 22.016 -16.818 527 HA MET 77 HA MET 77 0.645 19.577 -15.811 528 HB2 MET 77 1HB MET 77 -0.152 22.070 -15.351 529 HB3 MET 77 2HB MET 77 -1.477 21.585 -16.400 530 HG2 MET 77 1HG MET 77 -2.447 20.429 -14.780 531 HG3 MET 77 2HG MET 77 -0.950 19.581 -14.398 532 HE1 MET 77 3HE MET 77 0.987 20.727 -13.229 533 HE2 MET 77 1HE MET 77 0.871 22.470 -13.474 534 HE3 MET 77 2HE MET 77 0.791 21.802 -11.844 535 H LYS 78 H LYS 78 -0.861 18.023 -16.370 536 HA LYS 78 HA LYS 78 -1.848 18.139 -19.145 537 HB2 LYS 78 1HB LYS 78 -0.928 15.707 -17.602 538 HB3 LYS 78 2HB LYS 78 -1.605 15.685 -19.225 539 HG2 LYS 78 1HG LYS 78 0.290 16.515 -20.180 540 HG3 LYS 78 2HG LYS 78 0.770 17.396 -18.728 541 HD2 LYS 78 1HD LYS 78 0.721 14.428 -18.596 542 HD3 LYS 78 2HD LYS 78 2.018 15.189 -19.521 543 HE2 LYS 78 1HE LYS 78 2.221 16.690 -17.371 544 HE3 LYS 78 2HE LYS 78 1.429 15.317 -16.601 545 HZ1 LYS 78 3HZ LYS 78 3.733 14.782 -18.324 546 HZ2 LYS 78 1HZ LYS 78 3.221 13.980 -16.925 547 HZ3 LYS 78 2HZ LYS 78 4.028 15.461 -16.803 548 H VAL 79 H VAL 79 -3.888 17.244 -19.572 549 HA VAL 79 HA VAL 79 -5.895 17.711 -17.739 550 HB VAL 79 HB VAL 79 -5.993 15.711 -20.001 551 HG11 VAL 79 1HG1 VAL 79 -8.447 16.396 -19.970 552 HG12 VAL 79 2HG1 VAL 79 -7.893 15.342 -18.668 553 HG13 VAL 79 3HG1 VAL 79 -8.122 17.065 -18.371 554 HG21 VAL 79 3HG2 VAL 79 -5.997 17.405 -21.444 555 HG22 VAL 79 1HG2 VAL 79 -7.242 18.253 -20.525 556 HG23 VAL 79 2HG2 VAL 79 -5.540 18.467 -20.112 557 H GLY 80 H GLY 80 -6.654 16.680 -16.005 558 HA2 GLY 80 1HA GLY 80 -7.275 14.883 -14.658 559 HA3 GLY 80 2HA GLY 80 -6.491 13.794 -15.792 560 H GLY 81 H GLY 81 -4.311 16.176 -15.199 561 HA2 GLY 81 1HA GLY 81 -2.950 14.507 -13.198 562 HA3 GLY 81 2HA GLY 81 -2.168 15.649 -14.282 563 H VAL 82 H VAL 82 -2.237 15.276 -11.267 564 HA VAL 82 HA VAL 82 -2.984 18.049 -10.597 565 HB VAL 82 HB VAL 82 -2.938 15.725 -8.671 566 HG11 VAL 82 1HG1 VAL 82 -2.740 17.522 -7.295 567 HG12 VAL 82 2HG1 VAL 82 -3.480 18.631 -8.451 568 HG13 VAL 82 3HG1 VAL 82 -4.491 17.541 -7.500 569 HG21 VAL 82 3HG2 VAL 82 -4.913 16.448 -10.625 570 HG22 VAL 82 1HG2 VAL 82 -4.907 15.099 -9.488 571 HG23 VAL 82 2HG2 VAL 82 -5.563 16.662 -9.000 572 H ARG 83 H ARG 83 -1.494 19.307 -9.609 573 HA ARG 83 HA ARG 83 0.915 18.107 -8.494 574 HB2 ARG 83 1HB ARG 83 1.344 18.535 -10.931 575 HB3 ARG 83 2HB ARG 83 1.084 20.246 -10.619 576 HG2 ARG 83 1HG ARG 83 2.981 20.308 -9.132 577 HG3 ARG 83 2HG ARG 83 3.206 18.566 -9.302 578 HD2 ARG 83 1HD ARG 83 3.505 20.661 -11.449 579 HD3 ARG 83 2HD ARG 83 4.791 19.708 -10.708 580 HE ARG 83 HE ARG 83 3.050 17.877 -11.788 581 HH11 ARG 83 1HH1 ARG 83 4.951 20.541 -12.974 582 HH12 ARG 83 2HH1 ARG 83 5.169 19.854 -14.549 583 HH21 ARG 83 1HH2 ARG 83 3.330 16.962 -13.858 584 HH22 ARG 83 2HH2 ARG 83 4.246 17.819 -15.051 585 H ARG 84 H ARG 84 1.826 19.295 -6.873 586 HA ARG 84 HA ARG 84 0.275 21.555 -5.918 587 HB2 ARG 84 1HB ARG 84 1.268 19.541 -4.543 588 HB3 ARG 84 2HB ARG 84 2.717 20.538 -4.524 589 HG2 ARG 84 1HG ARG 84 1.597 22.292 -3.379 590 HG3 ARG 84 2HG ARG 84 0.028 21.517 -3.606 591 HD2 ARG 84 1HD ARG 84 1.091 19.548 -2.299 592 HD3 ARG 84 2HD ARG 84 2.272 20.750 -1.780 593 HE ARG 84 HE ARG 84 -0.307 21.767 -1.352 594 HH11 ARG 84 1HH1 ARG 84 1.827 19.295 -0.148 595 HH12 ARG 84 2HH1 ARG 84 1.151 19.304 1.447 596 HH21 ARG 84 1HH2 ARG 84 -1.207 21.789 0.744 597 HH22 ARG 84 2HH2 ARG 84 -0.576 20.723 1.953 598 H LEU 85 H LEU 85 0.748 23.413 -6.941 599 HA LEU 85 HA LEU 85 3.496 24.071 -7.619 600 HB2 LEU 85 1HB LEU 85 1.678 24.536 -9.202 601 HB3 LEU 85 2HB LEU 85 0.949 25.632 -8.030 602 HG LEU 85 HG LEU 85 3.325 26.809 -8.231 603 HD11 LEU 85 1HD1 LEU 85 2.969 25.329 -10.826 604 HD12 LEU 85 2HD1 LEU 85 4.361 25.305 -9.744 605 HD13 LEU 85 3HD1 LEU 85 3.978 26.765 -10.656 606 HD21 LEU 85 3HD2 LEU 85 2.297 28.427 -9.555 607 HD22 LEU 85 1HD2 LEU 85 0.944 27.623 -8.758 608 HD23 LEU 85 2HD2 LEU 85 1.337 27.237 -10.434 609 H THR 86 H THR 86 4.788 25.066 -6.235 610 HA THR 86 HA THR 86 3.616 26.585 -4.019 611 HB THR 86 HB THR 86 6.524 25.846 -4.290 612 HG1 THR 86 HG1 THR 86 6.085 23.906 -3.365 613 HG21 THR 86 3HG2 THR 86 4.718 26.646 -2.020 614 HG22 THR 86 1HG2 THR 86 6.200 27.427 -2.570 615 HG23 THR 86 2HG2 THR 86 6.277 25.867 -1.750 616 H ILE 87 H ILE 87 3.586 28.726 -4.102 617 HA ILE 87 HA ILE 87 5.568 30.096 -5.801 618 HB ILE 87 HB ILE 87 2.762 31.022 -5.176 619 HG12 ILE 87 1HG1 ILE 87 2.712 30.710 -7.813 620 HG13 ILE 87 2HG1 ILE 87 3.957 29.517 -7.460 621 HG21 ILE 87 1HG2 ILE 87 4.802 32.173 -7.074 622 HG22 ILE 87 2HG2 ILE 87 3.187 32.802 -6.753 623 HG23 ILE 87 3HG2 ILE 87 4.412 32.832 -5.485 624 HD11 ILE 87 3HD1 ILE 87 1.122 29.309 -7.198 625 HD12 ILE 87 1HD1 ILE 87 2.356 28.064 -7.011 626 HD13 ILE 87 2HD1 ILE 87 1.885 29.054 -5.629 627 HA PRO 88 HA PRO 88 6.918 32.038 -2.062 628 HB2 PRO 88 1HB PRO 88 8.455 33.959 -3.208 629 HB3 PRO 88 2HB PRO 88 8.951 32.266 -3.108 630 HG2 PRO 88 1HG PRO 88 7.748 33.754 -5.410 631 HG3 PRO 88 2HG PRO 88 9.088 32.593 -5.406 632 HD2 PRO 88 1HD PRO 88 6.573 31.913 -6.144 633 HD3 PRO 88 2HD PRO 88 7.675 30.772 -5.348 634 HA PRO 89 HA PRO 89 4.500 35.633 -1.311 635 HB2 PRO 89 1HB PRO 89 6.163 37.223 0.129 636 HB3 PRO 89 2HB PRO 89 5.445 35.745 0.780 637 HG2 PRO 89 1HG PRO 89 8.186 36.185 -0.339 638 HG3 PRO 89 2HG PRO 89 7.700 35.277 1.104 639 HD2 PRO 89 1HD PRO 89 8.288 34.070 -1.246 640 HD3 PRO 89 2HD PRO 89 7.081 33.423 -0.117 641 H GLN 90 H GLN 90 7.232 35.815 -3.274 642 HA GLN 90 HA GLN 90 6.849 38.651 -3.890 643 HB2 GLN 90 1HB GLN 90 9.154 37.790 -3.525 644 HB3 GLN 90 2HB GLN 90 8.953 36.742 -4.922 645 HG2 GLN 90 1HG GLN 90 8.554 38.798 -6.293 646 HG3 GLN 90 2HG GLN 90 9.018 39.746 -4.880 647 HE21 GLN 90 2HE2 GLN 90 10.177 37.075 -6.900 648 HE22 GLN 90 1HE2 GLN 90 11.842 37.535 -6.855 649 H LEU 91 H LEU 91 6.806 35.465 -5.435 650 HA LEU 91 HA LEU 91 5.767 36.625 -7.899 651 HB2 LEU 91 1HB LEU 91 6.271 33.719 -7.302 652 HB3 LEU 91 2HB LEU 91 6.082 34.478 -8.882 653 HG LEU 91 HG LEU 91 8.423 34.747 -7.001 654 HD11 LEU 91 1HD1 LEU 91 7.860 32.787 -8.831 655 HD12 LEU 91 2HD1 LEU 91 9.468 33.222 -8.252 656 HD13 LEU 91 3HD1 LEU 91 8.859 33.907 -9.759 657 HD21 LEU 91 3HD2 LEU 91 7.675 36.262 -9.474 658 HD22 LEU 91 1HD2 LEU 91 9.367 36.016 -9.039 659 HD23 LEU 91 2HD2 LEU 91 8.288 36.869 -7.935 660 H GLY 92 H GLY 92 4.320 36.264 -5.186 661 HA2 GLY 92 1HA GLY 92 1.942 34.908 -6.302 662 HA3 GLY 92 2HA GLY 92 2.368 34.855 -4.598 663 H TYR 93 H TYR 93 2.587 37.111 -3.578 664 HA TYR 93 HA TYR 93 0.309 38.736 -4.500 665 HB2 TYR 93 1HB TYR 93 1.342 38.135 -1.736 666 HB3 TYR 93 2HB TYR 93 0.289 39.511 -2.047 667 HD1 TYR 93 HD1 TYR 93 0.495 35.813 -2.334 668 HD2 TYR 93 HD2 TYR 93 -2.039 39.228 -2.191 669 HE1 TYR 93 HE1 TYR 93 -1.467 34.342 -2.152 670 HE2 TYR 93 HE2 TYR 93 -4.008 37.767 -2.007 671 HH TYR 93 HH TYR 93 -3.993 34.564 -2.730 672 H GLY 94 H GLY 94 3.659 38.728 -3.617 673 HA2 GLY 94 1HA GLY 94 5.212 40.360 -4.290 674 HA3 GLY 94 2HA GLY 94 3.886 41.486 -4.542 675 H ALA 95 H ALA 95 5.818 42.685 -3.377 676 HA ALA 95 HA ALA 95 6.234 42.375 -0.633 677 HB1 ALA 95 1HB ALA 95 6.585 45.039 -0.956 678 HB2 ALA 95 2HB ALA 95 7.783 43.819 -1.390 679 HB3 ALA 95 3HB ALA 95 6.713 44.483 -2.625 680 H ARG 96 H ARG 96 3.585 43.768 -2.380 681 HA ARG 96 HA ARG 96 2.518 45.402 -0.343 682 HB2 ARG 96 1HB ARG 96 0.989 43.979 -2.526 683 HB3 ARG 96 2HB ARG 96 0.480 45.411 -1.643 684 HG2 ARG 96 1HG ARG 96 2.640 46.467 -2.614 685 HG3 ARG 96 2HG ARG 96 2.548 45.143 -3.776 686 HD2 ARG 96 1HD ARG 96 -0.042 46.229 -3.578 687 HD3 ARG 96 2HD ARG 96 1.068 47.593 -3.699 688 HE ARG 96 HE ARG 96 1.471 47.018 -5.874 689 HH11 ARG 96 1HH1 ARG 96 0.004 44.315 -4.242 690 HH12 ARG 96 2HH1 ARG 96 -0.183 43.377 -5.687 691 HH21 ARG 96 1HH2 ARG 96 1.230 45.792 -7.783 692 HH22 ARG 96 2HH2 ARG 96 0.516 44.218 -7.700 693 H GLY 97 H GLY 97 1.288 42.242 -1.471 694 HA2 GLY 97 1HA GLY 97 0.596 40.425 -0.189 695 HA3 GLY 97 2HA GLY 97 0.932 41.355 1.264 696 H ALA 98 H ALA 98 -1.413 39.713 0.483 697 HA ALA 98 HA ALA 98 -3.513 41.766 0.434 698 HB1 ALA 98 1HB ALA 98 -3.731 38.793 -0.026 699 HB2 ALA 98 2HB ALA 98 -5.041 39.966 -0.173 700 HB3 ALA 98 3HB ALA 98 -3.670 40.031 -1.281 701 H GLY 99 H GLY 99 -4.544 42.270 2.251 702 HA2 GLY 99 1HA GLY 99 -5.212 42.219 4.449 703 HA3 GLY 99 2HA GLY 99 -5.571 40.528 4.134 704 H GLY 100 H GLY 100 -4.889 39.586 5.988 705 HA2 GLY 100 1HA GLY 100 -2.093 40.094 6.792 706 HA3 GLY 100 2HA GLY 100 -3.366 39.606 7.901 707 H VAL 101 H VAL 101 -4.275 37.730 5.618 708 HA VAL 101 HA VAL 101 -3.070 35.393 6.638 709 HB VAL 101 HB VAL 101 -4.156 34.239 4.710 710 HG11 VAL 101 1HG1 VAL 101 -6.249 34.342 5.650 711 HG12 VAL 101 2HG1 VAL 101 -5.275 35.047 6.942 712 HG13 VAL 101 3HG1 VAL 101 -6.190 36.092 5.856 713 HG21 VAL 101 3HG2 VAL 101 -5.759 36.453 3.827 714 HG22 VAL 101 1HG2 VAL 101 -4.050 36.794 3.561 715 HG23 VAL 101 2HG2 VAL 101 -4.776 35.338 2.879 716 H ILE 102 H ILE 102 -2.073 37.615 4.233 717 HA ILE 102 HA ILE 102 -0.051 35.709 3.253 718 HB ILE 102 HB ILE 102 -0.920 38.245 1.871 719 HG12 ILE 102 1HG1 ILE 102 -2.823 36.729 1.975 720 HG13 ILE 102 2HG1 ILE 102 -2.184 36.770 0.335 721 HG21 ILE 102 1HG2 ILE 102 0.670 37.818 0.372 722 HG22 ILE 102 2HG2 ILE 102 1.307 36.637 1.515 723 HG23 ILE 102 3HG2 ILE 102 0.196 36.124 0.245 724 HD11 ILE 102 3HD1 ILE 102 -2.804 34.512 1.079 725 HD12 ILE 102 1HD1 ILE 102 -1.096 34.649 0.663 726 HD13 ILE 102 2HD1 ILE 102 -1.592 34.622 2.355 727 HA PRO 103 HA PRO 103 2.187 38.870 5.811 728 HB2 PRO 103 1HB PRO 103 3.795 37.067 7.049 729 HB3 PRO 103 2HB PRO 103 2.186 37.489 7.647 730 HG2 PRO 103 1HG PRO 103 3.045 35.121 6.029 731 HG3 PRO 103 2HG PRO 103 1.942 35.187 7.416 732 HD2 PRO 103 1HD PRO 103 1.061 35.046 4.860 733 HD3 PRO 103 2HD PRO 103 0.168 35.905 6.131 734 HA PRO 104 HA PRO 104 5.781 39.121 3.290 735 HB2 PRO 104 1HB PRO 104 7.677 39.986 5.030 736 HB3 PRO 104 2HB PRO 104 6.360 41.015 4.453 737 HG2 PRO 104 1HG PRO 104 6.602 39.516 7.033 738 HG3 PRO 104 2HG PRO 104 6.017 41.166 6.748 739 HD2 PRO 104 1HD PRO 104 4.343 39.073 7.128 740 HD3 PRO 104 2HD PRO 104 3.931 40.447 6.082 741 H ASN 105 H ASN 105 7.636 38.030 2.659 742 HA ASN 105 HA ASN 105 8.983 36.205 2.444 743 HB2 ASN 105 1HB ASN 105 9.344 36.225 5.426 744 HB3 ASN 105 2HB ASN 105 10.531 35.889 4.169 745 HD21 ASN 105 2HD2 ASN 105 9.326 38.177 6.288 746 HD22 ASN 105 1HD2 ASN 105 10.116 39.571 5.644 747 H ALA 106 H ALA 106 6.232 35.612 2.697 748 HA ALA 106 HA ALA 106 6.295 33.069 4.184 749 HB1 ALA 106 1HB ALA 106 4.562 35.013 4.663 750 HB2 ALA 106 2HB ALA 106 3.709 34.246 3.324 751 HB3 ALA 106 3HB ALA 106 4.106 33.312 4.766 752 H THR 107 H THR 107 6.074 31.219 3.087 753 HA THR 107 HA THR 107 5.865 31.336 0.199 754 HB THR 107 HB THR 107 6.291 28.979 2.045 755 HG1 THR 107 HG1 THR 107 8.326 29.530 1.921 756 HG21 THR 107 3HG2 THR 107 7.225 28.270 -0.438 757 HG22 THR 107 1HG2 THR 107 5.750 29.156 -0.823 758 HG23 THR 107 2HG2 THR 107 5.685 27.763 0.258 759 H LEU 108 H LEU 108 4.061 31.009 -0.922 760 HA LEU 108 HA LEU 108 1.684 30.048 0.486 761 HB2 LEU 108 1HB LEU 108 2.144 31.613 -2.021 762 HB3 LEU 108 2HB LEU 108 0.608 30.790 -1.759 763 HG LEU 108 HG LEU 108 0.429 33.122 -1.141 764 HD11 LEU 108 1HD1 LEU 108 -0.252 30.954 0.469 765 HD12 LEU 108 2HD1 LEU 108 -0.938 32.578 0.521 766 HD13 LEU 108 3HD1 LEU 108 0.412 32.157 1.575 767 HD21 LEU 108 3HD2 LEU 108 1.913 34.268 0.112 768 HD22 LEU 108 1HD2 LEU 108 3.018 32.996 -0.410 769 HD23 LEU 108 2HD2 LEU 108 2.243 32.896 1.171 770 H VAL 109 H VAL 109 0.727 28.151 0.053 771 HA VAL 109 HA VAL 109 1.927 26.477 -2.046 772 HB VAL 109 HB VAL 109 0.360 25.683 0.412 773 HG11 VAL 109 1HG1 VAL 109 1.562 23.419 -0.609 774 HG12 VAL 109 2HG1 VAL 109 -0.149 23.834 -0.730 775 HG13 VAL 109 3HG1 VAL 109 0.955 24.245 -2.043 776 HG21 VAL 109 3HG2 VAL 109 2.498 24.649 1.099 777 HG22 VAL 109 1HG2 VAL 109 3.270 25.365 -0.316 778 HG23 VAL 109 2HG2 VAL 109 2.605 26.402 0.946 779 H PHE 110 H PHE 110 0.797 26.424 -3.868 780 HA PHE 110 HA PHE 110 -2.145 26.421 -3.696 781 HB2 PHE 110 1HB PHE 110 -0.297 27.625 -5.747 782 HB3 PHE 110 2HB PHE 110 -1.989 27.297 -6.107 783 HD1 PHE 110 HD1 PHE 110 -3.767 28.470 -4.843 784 HD2 PHE 110 HD2 PHE 110 0.347 29.482 -4.432 785 HE1 PHE 110 HE1 PHE 110 -4.401 30.624 -3.836 786 HE2 PHE 110 HE2 PHE 110 -0.280 31.636 -3.423 787 HZ PHE 110 HZ PHE 110 -2.656 32.210 -3.123 788 H GLU 111 H GLU 111 -3.224 24.767 -4.593 789 HA GLU 111 HA GLU 111 -1.636 22.721 -5.982 790 HB2 GLU 111 1HB GLU 111 -2.645 21.816 -4.028 791 HB3 GLU 111 2HB GLU 111 -4.193 22.564 -4.395 792 HG2 GLU 111 1HG GLU 111 -3.142 20.674 -6.401 793 HG3 GLU 111 2HG GLU 111 -3.651 19.989 -4.859 794 H VAL 112 H VAL 112 -1.964 22.350 -8.072 795 HA VAL 112 HA VAL 112 -4.407 23.437 -9.314 796 HB VAL 112 HB VAL 112 -1.762 22.964 -10.690 797 HG11 VAL 112 1HG1 VAL 112 -4.137 24.595 -11.574 798 HG12 VAL 112 2HG1 VAL 112 -2.693 24.205 -12.511 799 HG13 VAL 112 3HG1 VAL 112 -3.837 22.933 -12.080 800 HG21 VAL 112 3HG2 VAL 112 -1.192 24.705 -9.300 801 HG22 VAL 112 1HG2 VAL 112 -1.847 25.585 -10.681 802 HG23 VAL 112 2HG2 VAL 112 -2.836 25.341 -9.241 803 H GLU 113 H GLU 113 -5.704 22.088 -10.402 804 HA GLU 113 HA GLU 113 -4.680 19.421 -11.103 805 HB2 GLU 113 1HB GLU 113 -5.956 19.025 -9.145 806 HB3 GLU 113 2HB GLU 113 -7.235 20.113 -9.667 807 HG2 GLU 113 1HG GLU 113 -8.014 18.589 -11.282 808 HG3 GLU 113 2HG GLU 113 -6.567 17.592 -11.150 809 H LEU 114 H LEU 114 -4.746 19.252 -13.238 810 HA LEU 114 HA LEU 114 -6.339 20.888 -14.910 811 HB2 LEU 114 1HB LEU 114 -4.126 19.445 -15.306 812 HB3 LEU 114 2HB LEU 114 -5.313 18.310 -15.947 813 HG LEU 114 HG LEU 114 -4.511 19.516 -17.800 814 HD11 LEU 114 1HD1 LEU 114 -7.095 19.395 -17.327 815 HD12 LEU 114 2HD1 LEU 114 -6.462 20.280 -18.714 816 HD13 LEU 114 3HD1 LEU 114 -6.937 21.151 -17.256 817 HD21 LEU 114 3HD2 LEU 114 -5.099 22.221 -17.284 818 HD22 LEU 114 1HD2 LEU 114 -3.517 21.478 -17.520 819 HD23 LEU 114 2HD2 LEU 114 -4.189 21.624 -15.895 820 H LEU 115 H LEU 115 -8.381 20.674 -15.540 821 HA LEU 115 HA LEU 115 -9.732 18.110 -15.036 822 HB2 LEU 115 1HB LEU 115 -10.828 20.909 -15.229 823 HB3 LEU 115 2HB LEU 115 -11.825 19.463 -15.083 824 HG LEU 115 HG LEU 115 -9.797 19.752 -12.982 825 HD11 LEU 115 1HD1 LEU 115 -10.427 21.688 -12.030 826 HD12 LEU 115 2HD1 LEU 115 -12.109 21.512 -12.529 827 HD13 LEU 115 3HD1 LEU 115 -10.909 22.115 -13.672 828 HD21 LEU 115 3HD2 LEU 115 -12.575 18.823 -13.340 829 HD22 LEU 115 1HD2 LEU 115 -12.171 19.479 -11.753 830 HD23 LEU 115 2HD2 LEU 115 -11.252 18.123 -12.407 831 H ASP 116 H ASP 116 -9.271 20.679 -17.401 832 HA ASP 116 HA ASP 116 -9.715 18.858 -19.568 833 HB2 ASP 116 1HB ASP 116 -12.043 19.707 -18.733 834 HB3 ASP 116 2HB ASP 116 -11.594 21.195 -19.562 835 H VAL 117 H VAL 117 -9.399 19.919 -21.691 836 HA VAL 117 HA VAL 117 -7.939 22.462 -21.506 837 HB VAL 117 HB VAL 117 -6.201 20.816 -21.527 838 HG11 VAL 117 1HG1 VAL 117 -6.025 19.054 -23.153 839 HG12 VAL 117 2HG1 VAL 117 -7.609 18.954 -22.380 840 HG13 VAL 117 3HG1 VAL 117 -7.458 19.635 -24.000 841 HG21 VAL 117 3HG2 VAL 117 -5.002 21.978 -23.002 842 HG22 VAL 117 1HG2 VAL 117 -5.934 21.341 -24.357 843 HG23 VAL 117 2HG2 VAL 117 -6.503 22.767 -23.488 844 H11 L2S 130 1H1 L2S 130 -5.421 31.427 -9.328 845 H21 L2S 130 2H1 L2S 130 -5.284 31.737 -11.125 846 H12 L2S 130 1H2 L2S 130 -4.869 34.060 -10.706 847 H22 L2S 130 2H2 L2S 130 -3.627 33.034 -9.838 848 H13 L2S 130 2H3 L2S 130 -4.855 33.336 -7.786 849 H23 L2S 130 1H3 L2S 130 -4.520 34.982 -8.499 850 H14 L2S 130 1H4 L2S 130 -7.471 32.490 -8.120 851 H24 L2S 130 2H4 L2S 130 -8.431 33.684 -9.112 852 H15 L2S 130 1H5 L2S 130 -7.643 31.656 -10.381 853 H25 L2S 130 2H5 L2S 130 -7.111 33.288 -11.017 854 H17 L2S 130 1H7 L2S 130 -8.556 36.867 -7.660 855 H27 L2S 130 2H7 L2S 130 -8.862 35.577 -8.940 856 H9 L2S 130 H9 L2S 130 -7.062 34.333 -5.081 857 H10 L2S 130 H10 L2S 130 -6.439 35.025 -2.767 858 H112 L2S 130 1H12 L2S 130 -9.928 37.651 -2.621 859 H113 L2S 130 1H13 L2S 130 -10.561 36.912 -4.909 860 H114 L2S 130 1H14 L2S 130 -8.661 36.656 -0.599 861 H214 L2S 130 2H14 L2S 130 -7.486 37.816 -1.264 862 H314 L2S 130 3H14 L2S 130 -6.982 36.119 -0.952 Start of MODEL 6 1 H1 GLY 1 H GLY 1 6.862 11.010 -15.951 2 HA2 GLY 1 1HA GLY 1 8.978 11.146 -17.993 3 HA3 GLY 1 2HA GLY 1 8.745 12.304 -16.692 4 HA PRO 2 HA PRO 2 12.061 9.125 -15.621 5 HB2 PRO 2 1HB PRO 2 14.143 10.862 -15.501 6 HB3 PRO 2 2HB PRO 2 13.676 10.023 -16.985 7 HG2 PRO 2 1HG PRO 2 13.047 12.816 -16.111 8 HG3 PRO 2 2HG PRO 2 13.544 12.229 -17.709 9 HD2 PRO 2 1HD PRO 2 10.966 12.787 -17.099 10 HD3 PRO 2 2HD PRO 2 11.421 11.508 -18.244 11 H GLY 3 H GLY 3 12.659 8.746 -13.535 12 HA2 GLY 3 1HA GLY 3 12.967 9.088 -11.278 13 HA3 GLY 3 2HA GLY 3 13.025 10.814 -11.603 14 H SER 4 H SER 4 11.451 8.633 -9.837 15 HA SER 4 HA SER 4 8.888 10.081 -10.004 16 HB2 SER 4 1HB SER 4 8.743 7.678 -10.667 17 HB3 SER 4 2HB SER 4 9.302 7.236 -9.054 18 HG SER 4 HG SER 4 7.190 7.218 -8.748 19 H MET 5 H MET 5 7.780 10.483 -8.025 20 HA MET 5 HA MET 5 7.658 11.238 -5.884 21 HB2 MET 5 1HB MET 5 9.450 8.842 -5.547 22 HB3 MET 5 2HB MET 5 8.956 9.827 -4.177 23 HG2 MET 5 1HG MET 5 6.560 9.407 -5.029 24 HG3 MET 5 2HG MET 5 7.290 8.092 -5.947 25 HE1 MET 5 3HE MET 5 5.747 5.964 -4.155 26 HE2 MET 5 1HE MET 5 5.210 6.937 -2.785 27 HE3 MET 5 2HE MET 5 5.091 7.579 -4.424 28 H THR 6 H THR 6 9.506 12.539 -7.590 29 HA THR 6 HA THR 6 11.539 13.394 -5.634 30 HB THR 6 HB THR 6 12.720 12.307 -7.409 31 HG1 THR 6 HG1 THR 6 13.955 14.014 -7.052 32 HG21 THR 6 3HG2 THR 6 11.067 14.022 -9.261 33 HG22 THR 6 1HG2 THR 6 11.062 12.263 -9.142 34 HG23 THR 6 2HG2 THR 6 12.481 13.100 -9.772 35 H VAL 7 H VAL 7 11.890 15.580 -5.391 36 HA VAL 7 HA VAL 7 9.956 17.338 -6.754 37 HB VAL 7 HB VAL 7 9.500 17.220 -4.379 38 HG11 VAL 7 1HG1 VAL 7 11.838 18.534 -3.344 39 HG12 VAL 7 2HG1 VAL 7 11.088 17.019 -2.836 40 HG13 VAL 7 3HG1 VAL 7 12.283 17.022 -4.134 41 HG21 VAL 7 3HG2 VAL 7 10.856 19.863 -4.662 42 HG22 VAL 7 1HG2 VAL 7 9.533 19.447 -5.751 43 HG23 VAL 7 2HG2 VAL 7 9.264 19.480 -4.008 44 H VAL 8 H VAL 8 10.658 19.182 -7.720 45 HA VAL 8 HA VAL 8 13.513 19.853 -7.490 46 HB VAL 8 HB VAL 8 13.294 18.639 -9.565 47 HG11 VAL 8 1HG1 VAL 8 11.098 18.668 -10.232 48 HG12 VAL 8 2HG1 VAL 8 10.917 20.398 -9.938 49 HG13 VAL 8 3HG1 VAL 8 11.796 19.831 -11.359 50 HG21 VAL 8 3HG2 VAL 8 14.061 20.350 -11.146 51 HG22 VAL 8 1HG2 VAL 8 13.477 21.610 -10.059 52 HG23 VAL 8 2HG2 VAL 8 14.799 20.556 -9.558 53 H THR 9 H THR 9 14.028 22.017 -7.628 54 HA THR 9 HA THR 9 11.737 23.871 -7.695 55 HB THR 9 HB THR 9 14.304 24.125 -6.116 56 HG1 THR 9 HG1 THR 9 12.781 22.700 -5.180 57 HG21 THR 9 3HG2 THR 9 12.150 26.054 -6.784 58 HG22 THR 9 1HG2 THR 9 13.864 26.333 -6.481 59 HG23 THR 9 2HG2 THR 9 12.762 26.067 -5.130 60 H THR 10 H THR 10 11.934 25.786 -8.822 61 HA THR 10 HA THR 10 13.880 25.785 -10.948 62 HB THR 10 HB THR 10 12.707 27.805 -11.747 63 HG1 THR 10 HG1 THR 10 11.175 28.765 -10.548 64 HG21 THR 10 3HG2 THR 10 11.412 25.222 -11.236 65 HG22 THR 10 1HG2 THR 10 11.565 26.136 -12.736 66 HG23 THR 10 2HG2 THR 10 10.294 26.541 -11.583 67 H GLU 11 H GLU 11 14.746 28.122 -11.521 68 HA GLU 11 HA GLU 11 16.510 28.826 -9.349 69 HB2 GLU 11 1HB GLU 11 16.270 29.736 -12.211 70 HB3 GLU 11 2HB GLU 11 17.392 30.487 -11.085 71 HG2 GLU 11 1HG GLU 11 18.634 28.500 -10.840 72 HG3 GLU 11 2HG GLU 11 17.386 27.536 -11.626 73 H SER 12 H SER 12 13.627 30.078 -10.803 74 HA SER 12 HA SER 12 13.892 32.743 -9.783 75 HB2 SER 12 1HB SER 12 11.270 31.491 -10.558 76 HB3 SER 12 2HB SER 12 11.792 33.166 -10.735 77 HG SER 12 HG SER 12 11.773 31.751 -12.684 78 H GLY 13 H GLY 13 12.600 29.733 -8.608 79 HA2 GLY 13 1HA GLY 13 12.603 29.730 -6.075 80 HA3 GLY 13 2HA GLY 13 11.554 31.132 -6.227 81 H LEU 14 H LEU 14 10.138 30.010 -8.544 82 HA LEU 14 HA LEU 14 7.961 28.869 -7.292 83 HB2 LEU 14 1HB LEU 14 7.623 29.714 -9.444 84 HB3 LEU 14 2HB LEU 14 8.944 28.764 -10.121 85 HG LEU 14 HG LEU 14 7.559 26.720 -9.790 86 HD11 LEU 14 1HD1 LEU 14 5.656 26.756 -8.652 87 HD12 LEU 14 2HD1 LEU 14 5.024 28.065 -9.650 88 HD13 LEU 14 3HD1 LEU 14 5.998 28.433 -8.227 89 HD21 LEU 14 3HD2 LEU 14 5.749 27.625 -11.540 90 HD22 LEU 14 1HD2 LEU 14 7.427 27.297 -11.974 91 HD23 LEU 14 2HD2 LEU 14 6.914 28.948 -11.623 92 H LYS 15 H LYS 15 7.213 26.792 -6.967 93 HA LYS 15 HA LYS 15 9.015 24.569 -7.591 94 HB2 LYS 15 1HB LYS 15 7.768 24.839 -4.862 95 HB3 LYS 15 2HB LYS 15 9.012 23.710 -5.379 96 HG2 LYS 15 1HG LYS 15 10.412 25.854 -5.811 97 HG3 LYS 15 2HG LYS 15 9.245 26.612 -4.725 98 HD2 LYS 15 1HD LYS 15 10.639 24.067 -3.967 99 HD3 LYS 15 2HD LYS 15 11.411 25.635 -3.722 100 HE2 LYS 15 1HE LYS 15 9.663 26.353 -2.272 101 HE3 LYS 15 2HE LYS 15 8.667 24.958 -2.682 102 HZ1 LYS 15 3HZ LYS 15 10.009 23.541 -1.454 103 HZ2 LYS 15 1HZ LYS 15 9.946 24.928 -0.487 104 HZ3 LYS 15 2HZ LYS 15 11.316 24.614 -1.427 105 H TYR 16 H TYR 16 7.951 22.434 -7.243 106 HA TYR 16 HA TYR 16 5.062 22.414 -7.139 107 HB2 TYR 16 1HB TYR 16 4.989 21.133 -9.368 108 HB3 TYR 16 2HB TYR 16 5.165 22.882 -9.439 109 HD1 TYR 16 HD2 TYR 16 7.268 23.895 -10.143 110 HD2 TYR 16 HD1 TYR 16 6.806 19.667 -10.021 111 HE1 TYR 16 HE2 TYR 16 9.297 23.639 -11.510 112 HE2 TYR 16 HE1 TYR 16 8.834 19.399 -11.387 113 HH TYR 16 HH TYR 16 10.196 21.789 -13.143 114 H GLU 17 H GLU 17 4.216 20.410 -6.641 115 HA GLU 17 HA GLU 17 6.154 18.215 -6.331 116 HB2 GLU 17 1HB GLU 17 5.506 19.416 -4.173 117 HB3 GLU 17 2HB GLU 17 3.900 18.738 -4.400 118 HG2 GLU 17 1HG GLU 17 4.695 16.526 -4.169 119 HG3 GLU 17 2HG GLU 17 6.376 17.044 -4.291 120 H ASP 18 H ASP 18 5.586 16.456 -7.409 121 HA ASP 18 HA ASP 18 3.151 16.215 -8.803 122 HB2 ASP 18 1HB ASP 18 3.911 13.837 -9.189 123 HB3 ASP 18 2HB ASP 18 5.065 15.080 -9.665 124 H LEU 19 H LEU 19 1.215 15.511 -8.189 125 HA LEU 19 HA LEU 19 1.019 13.998 -5.667 126 HB2 LEU 19 1HB LEU 19 -0.498 16.300 -6.722 127 HB3 LEU 19 2HB LEU 19 -1.445 15.047 -5.922 128 HG LEU 19 HG LEU 19 0.874 16.513 -4.666 129 HD11 LEU 19 1HD1 LEU 19 -0.554 18.022 -3.756 130 HD12 LEU 19 2HD1 LEU 19 -1.916 16.902 -3.753 131 HD13 LEU 19 3HD1 LEU 19 -1.436 17.701 -5.250 132 HD21 LEU 19 3HD2 LEU 19 -0.959 14.340 -3.784 133 HD22 LEU 19 1HD2 LEU 19 -0.432 15.537 -2.601 134 HD23 LEU 19 2HD2 LEU 19 0.761 14.568 -3.466 135 H THR 20 H THR 20 -0.044 14.318 -8.977 136 HA THR 20 HA THR 20 -0.845 11.556 -9.041 137 HB THR 20 HB THR 20 -2.989 13.518 -9.819 138 HG1 THR 20 HG1 THR 20 -3.048 12.111 -7.369 139 HG21 THR 20 3HG2 THR 20 -3.501 11.468 -10.755 140 HG22 THR 20 1HG2 THR 20 -4.332 11.358 -9.204 141 HG23 THR 20 2HG2 THR 20 -2.775 10.561 -9.429 142 H GLU 21 H GLU 21 -0.092 10.813 -10.905 143 HA GLU 21 HA GLU 21 0.889 12.431 -12.968 144 HB2 GLU 21 1HB GLU 21 1.586 10.080 -12.526 145 HB3 GLU 21 2HB GLU 21 0.043 9.536 -13.169 146 HG2 GLU 21 1HG GLU 21 0.575 10.232 -15.341 147 HG3 GLU 21 2HG GLU 21 1.923 11.222 -14.784 148 H GLY 22 H GLY 22 0.131 12.872 -15.055 149 HA2 GLY 22 1HA GLY 22 -2.752 12.396 -15.479 150 HA3 GLY 22 2HA GLY 22 -2.048 13.987 -15.731 151 H SER 23 H SER 23 -2.514 10.824 -17.027 152 HA SER 23 HA SER 23 -0.807 11.357 -19.330 153 HB2 SER 23 1HB SER 23 -1.411 9.046 -20.011 154 HB3 SER 23 2HB SER 23 -0.717 9.111 -18.391 155 HG SER 23 HG SER 23 -3.123 8.204 -19.160 156 H GLY 24 H GLY 24 -2.386 13.248 -19.704 157 HA2 GLY 24 1HA GLY 24 -4.556 12.281 -21.463 158 HA3 GLY 24 2HA GLY 24 -4.729 13.706 -20.450 159 H ALA 25 H ALA 25 -3.225 15.514 -20.887 160 HA ALA 25 HA ALA 25 -1.767 15.648 -23.315 161 HB1 ALA 25 1HB ALA 25 -4.143 17.414 -23.514 162 HB2 ALA 25 2HB ALA 25 -3.169 16.674 -24.786 163 HB3 ALA 25 3HB ALA 25 -4.352 15.707 -23.906 164 H GLU 26 H GLU 26 -0.393 17.344 -23.272 165 HA GLU 26 HA GLU 26 -0.241 18.933 -20.922 166 HB2 GLU 26 1HB GLU 26 1.771 18.260 -22.115 167 HB3 GLU 26 2HB GLU 26 1.250 19.145 -23.542 168 HG2 GLU 26 1HG GLU 26 1.308 21.227 -22.112 169 HG3 GLU 26 2HG GLU 26 2.135 20.253 -20.897 170 H ALA 27 H ALA 27 -0.893 20.970 -20.521 171 HA ALA 27 HA ALA 27 -2.947 22.157 -21.953 172 HB1 ALA 27 1HB ALA 27 -2.963 23.699 -20.316 173 HB2 ALA 27 2HB ALA 27 -1.793 22.622 -19.551 174 HB3 ALA 27 3HB ALA 27 -1.236 24.025 -20.463 175 H ARG 28 H ARG 28 -3.078 23.516 -23.644 176 HA ARG 28 HA ARG 28 -0.578 24.221 -24.997 177 HB2 ARG 28 1HB ARG 28 -3.437 24.022 -25.924 178 HB3 ARG 28 2HB ARG 28 -2.197 24.801 -26.898 179 HG2 ARG 28 1HG ARG 28 -1.680 22.057 -25.879 180 HG3 ARG 28 2HG ARG 28 -2.806 22.267 -27.221 181 HD2 ARG 28 1HD ARG 28 -0.830 23.801 -28.122 182 HD3 ARG 28 2HD ARG 28 0.123 22.728 -27.098 183 HE ARG 28 HE ARG 28 -0.251 21.021 -28.585 184 HH11 ARG 28 1HH1 ARG 28 -2.407 23.663 -29.284 185 HH12 ARG 28 2HH1 ARG 28 -2.963 22.985 -30.779 186 HH21 ARG 28 1HH2 ARG 28 -0.974 20.118 -30.551 187 HH22 ARG 28 2HH2 ARG 28 -2.147 20.969 -31.498 188 H ALA 29 H ALA 29 -0.376 26.347 -25.987 189 HA ALA 29 HA ALA 29 -1.366 28.419 -24.193 190 HB1 ALA 29 1HB ALA 29 0.308 29.500 -26.215 191 HB2 ALA 29 2HB ALA 29 0.649 29.291 -24.497 192 HB3 ALA 29 3HB ALA 29 1.039 28.003 -25.636 193 H GLY 30 H GLY 30 -2.467 30.272 -24.886 194 HA2 GLY 30 1HA GLY 30 -3.727 31.601 -26.312 195 HA3 GLY 30 2HA GLY 30 -3.259 30.559 -27.648 196 H GLN 31 H GLN 31 -4.316 28.513 -25.336 197 HA GLN 31 HA GLN 31 -7.082 28.590 -26.349 198 HB2 GLN 31 1HB GLN 31 -5.311 26.238 -25.697 199 HB3 GLN 31 2HB GLN 31 -7.052 26.088 -25.895 200 HG2 GLN 31 1HG GLN 31 -6.971 26.446 -28.148 201 HG3 GLN 31 2HG GLN 31 -5.492 27.401 -28.054 202 HE21 GLN 31 2HE2 GLN 31 -6.618 24.103 -27.379 203 HE22 GLN 31 1HE2 GLN 31 -5.230 23.312 -28.038 204 H THR 32 H THR 32 -8.752 27.923 -24.914 205 HA THR 32 HA THR 32 -8.297 28.772 -22.204 206 HB THR 32 HB THR 32 -10.832 27.549 -23.293 207 HG1 THR 32 HG1 THR 32 -11.343 29.906 -23.577 208 HG21 THR 32 3HG2 THR 32 -11.045 27.764 -20.977 209 HG22 THR 32 1HG2 THR 32 -11.770 29.249 -21.592 210 HG23 THR 32 2HG2 THR 32 -10.132 29.272 -20.937 211 H VAL 33 H VAL 33 -7.681 27.510 -20.586 212 HA VAL 33 HA VAL 33 -8.177 24.611 -20.791 213 HB VAL 33 HB VAL 33 -5.812 25.035 -20.827 214 HG11 VAL 33 1HG1 VAL 33 -6.502 27.112 -18.949 215 HG12 VAL 33 2HG1 VAL 33 -5.177 26.119 -18.338 216 HG13 VAL 33 3HG1 VAL 33 -5.038 26.908 -19.910 217 HG21 VAL 33 3HG2 VAL 33 -7.082 23.429 -18.959 218 HG22 VAL 33 1HG2 VAL 33 -5.394 23.324 -19.462 219 HG23 VAL 33 2HG2 VAL 33 -5.832 24.260 -18.033 220 H SER 34 H SER 34 -9.307 23.630 -19.225 221 HA SER 34 HA SER 34 -10.252 25.283 -16.997 222 HB2 SER 34 1HB SER 34 -11.299 22.657 -18.082 223 HB3 SER 34 2HB SER 34 -12.012 23.556 -16.743 224 HG SER 34 HG SER 34 -11.713 24.487 -19.410 225 H VAL 35 H VAL 35 -9.328 25.051 -15.083 226 HA VAL 35 HA VAL 35 -8.537 22.392 -14.169 227 HB VAL 35 HB VAL 35 -6.344 22.986 -13.527 228 HG11 VAL 35 1HG1 VAL 35 -6.705 22.511 -15.955 229 HG12 VAL 35 2HG1 VAL 35 -6.702 24.253 -16.238 230 HG13 VAL 35 3HG1 VAL 35 -5.260 23.460 -15.603 231 HG21 VAL 35 3HG2 VAL 35 -7.090 25.817 -14.243 232 HG22 VAL 35 1HG2 VAL 35 -6.694 25.180 -12.646 233 HG23 VAL 35 2HG2 VAL 35 -5.445 25.292 -13.887 234 H HIS 36 H HIS 36 -7.975 22.403 -11.818 235 HA HIS 36 HA HIS 36 -9.662 24.362 -10.411 236 HB2 HIS 36 1HB HIS 36 -9.240 21.458 -10.110 237 HB3 HIS 36 2HB HIS 36 -9.302 22.362 -8.600 238 HD1 HIS 36 HD1 HIS 36 -11.478 24.440 -9.569 239 HD2 HIS 36 HD2 HIS 36 -11.734 20.306 -9.901 240 HE1 HIS 36 HE1 HIS 36 -13.935 23.929 -9.723 241 H TYR 37 H TYR 37 -8.799 25.645 -8.894 242 HA TYR 37 HA TYR 37 -6.000 25.146 -8.115 243 HB2 TYR 37 1HB TYR 37 -5.672 27.539 -7.973 244 HB3 TYR 37 2HB TYR 37 -6.320 27.145 -9.561 245 HD1 TYR 37 HD2 TYR 37 -7.198 28.524 -6.240 246 HD2 TYR 37 HD1 TYR 37 -8.374 28.058 -10.302 247 HE1 TYR 37 HE2 TYR 37 -9.015 30.145 -5.893 248 HE2 TYR 37 HE1 TYR 37 -10.194 29.679 -9.967 249 HH TYR 37 HH TYR 37 -10.458 31.572 -7.072 250 H THR 38 H THR 38 -5.420 25.385 -5.984 251 HA THR 38 HA THR 38 -7.528 26.088 -4.064 252 HB THR 38 HB THR 38 -5.798 23.924 -3.120 253 HG1 THR 38 HG1 THR 38 -6.196 23.409 -5.424 254 HG21 THR 38 3HG2 THR 38 -8.528 24.894 -2.843 255 HG22 THR 38 1HG2 THR 38 -7.532 23.989 -1.705 256 HG23 THR 38 2HG2 THR 38 -8.441 23.136 -2.953 257 H GLY 39 H GLY 39 -6.786 27.745 -2.917 258 HA2 GLY 39 1HA GLY 39 -3.917 28.121 -2.576 259 HA3 GLY 39 2HA GLY 39 -5.177 29.272 -2.157 260 H TRP 40 H TRP 40 -2.810 27.614 -0.812 261 HA TRP 40 HA TRP 40 -4.273 27.274 1.718 262 HB2 TRP 40 1HB TRP 40 -2.315 25.397 0.422 263 HB3 TRP 40 2HB TRP 40 -2.532 25.406 2.170 264 HD1 TRP 40 HD1 TRP 40 -5.618 25.609 2.450 265 HE1 TRP 40 HE1 TRP 40 -7.149 23.694 1.666 266 HE3 TRP 40 HE3 TRP 40 -2.444 23.332 -0.848 267 HZ2 TRP 40 HZ2 TRP 40 -7.026 21.507 -0.114 268 HZ3 TRP 40 HZ3 TRP 40 -3.228 21.334 -2.051 269 HH2 TRP 40 HH2 TRP 40 -5.472 20.441 -1.689 270 H LEU 41 H LEU 41 -3.339 28.160 3.478 271 HA LEU 41 HA LEU 41 -1.155 29.952 3.122 272 HB2 LEU 41 1HB LEU 41 -3.030 29.232 5.258 273 HB3 LEU 41 2HB LEU 41 -1.442 29.743 5.826 274 HG LEU 41 HG LEU 41 -3.258 31.360 4.038 275 HD11 LEU 41 1HD1 LEU 41 -2.829 32.654 6.477 276 HD12 LEU 41 2HD1 LEU 41 -3.217 30.984 6.887 277 HD13 LEU 41 3HD1 LEU 41 -4.327 31.929 5.895 278 HD21 LEU 41 3HD2 LEU 41 -1.595 32.826 3.772 279 HD22 LEU 41 1HD2 LEU 41 -0.526 31.524 4.295 280 HD23 LEU 41 2HD2 LEU 41 -1.107 32.711 5.464 281 H THR 42 H THR 42 0.665 29.938 4.837 282 HA THR 42 HA THR 42 2.377 27.813 4.318 283 HB THR 42 HB THR 42 3.786 28.667 6.150 284 HG1 THR 42 HG1 THR 42 1.429 30.124 6.751 285 HG21 THR 42 3HG2 THR 42 2.534 30.627 4.250 286 HG22 THR 42 1HG2 THR 42 4.110 29.844 4.152 287 HG23 THR 42 2HG2 THR 42 3.829 31.111 5.345 288 H ASP 43 H ASP 43 -0.045 28.183 6.787 289 HA ASP 43 HA ASP 43 0.910 25.854 8.256 290 HB2 ASP 43 1HB ASP 43 -1.585 27.457 8.816 291 HB3 ASP 43 2HB ASP 43 -0.704 26.406 9.921 292 H GLY 44 H GLY 44 -1.353 26.669 5.810 293 HA2 GLY 44 1HA GLY 44 -2.178 24.740 4.514 294 HA3 GLY 44 2HA GLY 44 -2.550 23.977 6.053 295 H GLN 45 H GLN 45 -3.237 27.220 6.290 296 HA GLN 45 HA GLN 45 -6.036 26.777 6.429 297 HB2 GLN 45 1HB GLN 45 -4.447 28.609 7.530 298 HB3 GLN 45 2HB GLN 45 -4.968 29.540 6.131 299 HG2 GLN 45 1HG GLN 45 -7.228 29.447 6.781 300 HG3 GLN 45 2HG GLN 45 -6.910 28.191 7.977 301 HE21 GLN 45 2HE2 GLN 45 -7.280 31.477 7.450 302 HE22 GLN 45 1HE2 GLN 45 -6.706 32.051 8.974 303 H LYS 46 H LYS 46 -7.374 26.567 4.774 304 HA LYS 46 HA LYS 46 -6.660 27.271 2.109 305 HB2 LYS 46 1HB LYS 46 -8.180 25.375 2.778 306 HB3 LYS 46 2HB LYS 46 -9.413 26.576 3.139 307 HG2 LYS 46 1HG LYS 46 -9.733 27.113 0.922 308 HG3 LYS 46 2HG LYS 46 -8.134 26.539 0.444 309 HD2 LYS 46 1HD LYS 46 -9.779 24.994 -0.378 310 HD3 LYS 46 2HD LYS 46 -8.888 24.218 0.933 311 HE2 LYS 46 1HE LYS 46 -11.175 23.709 1.278 312 HE3 LYS 46 2HE LYS 46 -10.750 24.937 2.470 313 HZ1 LYS 46 3HZ LYS 46 -12.462 26.097 1.707 314 HZ2 LYS 46 1HZ LYS 46 -12.704 25.037 0.411 315 HZ3 LYS 46 2HZ LYS 46 -11.618 26.325 0.259 316 H PHE 47 H PHE 47 -6.948 29.122 1.050 317 HA PHE 47 HA PHE 47 -8.887 31.065 2.111 318 HB2 PHE 47 1HB PHE 47 -7.297 32.877 1.504 319 HB3 PHE 47 2HB PHE 47 -6.683 31.823 2.774 320 HD1 PHE 47 HD2 PHE 47 -6.487 32.499 -0.863 321 HD2 PHE 47 HD1 PHE 47 -4.638 30.726 2.536 322 HE1 PHE 47 HE2 PHE 47 -4.448 32.104 -2.183 323 HE2 PHE 47 HE1 PHE 47 -2.596 30.329 1.222 324 HZ PHE 47 HZ PHE 47 -2.499 31.017 -1.141 325 H ASP 48 H ASP 48 -8.630 29.065 -0.236 326 HA ASP 48 HA ASP 48 -10.197 30.476 -2.073 327 HB2 ASP 48 1HB ASP 48 -7.551 31.225 -2.320 328 HB3 ASP 48 2HB ASP 48 -7.723 29.978 -3.552 329 H SER 49 H SER 49 -11.355 28.972 -3.072 330 HA SER 49 HA SER 49 -10.122 26.546 -4.065 331 HB2 SER 49 1HB SER 49 -10.902 26.271 -1.567 332 HB3 SER 49 2HB SER 49 -12.503 26.136 -2.293 333 HG SER 49 HG SER 49 -11.588 24.452 -3.634 334 H SER 50 H SER 50 -10.804 26.672 -6.106 335 HA SER 50 HA SER 50 -13.100 27.937 -7.031 336 HB2 SER 50 1HB SER 50 -11.016 26.267 -8.144 337 HB3 SER 50 2HB SER 50 -12.577 25.879 -8.866 338 HG SER 50 HG SER 50 -12.709 27.856 -9.696 339 H LYS 51 H LYS 51 -12.692 24.802 -5.637 340 HA LYS 51 HA LYS 51 -14.894 23.437 -6.658 341 HB2 LYS 51 1HB LYS 51 -13.691 23.289 -3.887 342 HB3 LYS 51 2HB LYS 51 -14.811 22.112 -4.562 343 HG2 LYS 51 1HG LYS 51 -12.163 22.762 -5.827 344 HG3 LYS 51 2HG LYS 51 -12.377 21.486 -4.626 345 HD2 LYS 51 1HD LYS 51 -14.183 21.534 -6.994 346 HD3 LYS 51 2HD LYS 51 -12.523 20.975 -7.209 347 HE2 LYS 51 1HE LYS 51 -13.649 19.014 -6.717 348 HE3 LYS 51 2HE LYS 51 -13.016 19.492 -5.143 349 HZ1 LYS 51 3HZ LYS 51 -15.675 20.455 -5.871 350 HZ2 LYS 51 1HZ LYS 51 -15.070 19.988 -4.362 351 HZ3 LYS 51 2HZ LYS 51 -15.526 18.814 -5.491 352 H ASP 52 H ASP 52 -14.707 25.965 -4.269 353 HA ASP 52 HA ASP 52 -17.115 25.671 -2.936 354 HB2 ASP 52 1HB ASP 52 -15.479 27.337 -2.267 355 HB3 ASP 52 2HB ASP 52 -15.714 28.217 -3.774 356 H ARG 53 H ARG 53 -16.480 27.376 -5.989 357 HA ARG 53 HA ARG 53 -19.231 28.074 -6.378 358 HB2 ARG 53 1HB ARG 53 -16.955 29.093 -7.356 359 HB3 ARG 53 2HB ARG 53 -17.358 28.013 -8.683 360 HG2 ARG 53 1HG ARG 53 -18.345 29.996 -9.324 361 HG3 ARG 53 2HG ARG 53 -19.686 29.128 -8.574 362 HD2 ARG 53 1HD ARG 53 -19.291 30.355 -6.483 363 HD3 ARG 53 2HD ARG 53 -17.978 31.239 -7.261 364 HE ARG 53 HE ARG 53 -20.406 31.502 -8.714 365 HH11 ARG 53 1HH1 ARG 53 -18.727 32.635 -5.883 366 HH12 ARG 53 2HH1 ARG 53 -19.550 34.160 -5.846 367 HH21 ARG 53 1HH2 ARG 53 -21.497 33.505 -8.675 368 HH22 ARG 53 2HH2 ARG 53 -21.126 34.653 -7.434 369 H ASN 54 H ASN 54 -17.482 25.230 -6.769 370 HA ASN 54 HA ASN 54 -17.982 23.199 -7.662 371 HB2 ASN 54 1HB ASN 54 -20.739 24.307 -8.211 372 HB3 ASN 54 2HB ASN 54 -20.284 22.618 -8.015 373 HD21 ASN 54 2HD2 ASN 54 -19.015 22.313 -5.830 374 HD22 ASN 54 1HD2 ASN 54 -19.830 22.960 -4.451 375 H ASP 55 H ASP 55 -16.691 24.980 -9.319 376 HA ASP 55 HA ASP 55 -17.388 23.914 -11.901 377 HB2 ASP 55 1HB ASP 55 -18.874 25.766 -12.011 378 HB3 ASP 55 2HB ASP 55 -17.681 26.857 -11.309 379 HA PRO 56 HA PRO 56 -13.001 24.145 -12.238 380 HB2 PRO 56 1HB PRO 56 -12.781 23.723 -14.911 381 HB3 PRO 56 2HB PRO 56 -13.186 22.439 -13.767 382 HG2 PRO 56 1HG PRO 56 -14.995 24.042 -15.533 383 HG3 PRO 56 2HG PRO 56 -15.016 22.302 -15.195 384 HD2 PRO 56 1HD PRO 56 -16.705 24.041 -13.989 385 HD3 PRO 56 2HD PRO 56 -16.104 22.579 -13.182 386 H PHE 57 H PHE 57 -11.445 25.637 -12.700 387 HA PHE 57 HA PHE 57 -12.335 28.220 -13.629 388 HB2 PHE 57 1HB PHE 57 -10.832 28.129 -11.727 389 HB3 PHE 57 2HB PHE 57 -9.635 27.251 -12.673 390 HD1 PHE 57 HD2 PHE 57 -11.653 30.298 -13.408 391 HD2 PHE 57 HD1 PHE 57 -7.785 28.588 -12.933 392 HE1 PHE 57 HE2 PHE 57 -10.631 32.431 -14.084 393 HE2 PHE 57 HE1 PHE 57 -6.756 30.720 -13.607 394 HZ PHE 57 HZ PHE 57 -8.180 32.644 -14.185 395 H ALA 58 H ALA 58 -12.647 28.315 -15.784 396 HA ALA 58 HA ALA 58 -10.650 27.168 -17.583 397 HB1 ALA 58 1HB ALA 58 -13.435 27.418 -17.705 398 HB2 ALA 58 2HB ALA 58 -12.800 28.503 -18.942 399 HB3 ALA 58 3HB ALA 58 -12.356 26.797 -18.954 400 H PHE 59 H PHE 59 -8.962 28.428 -18.020 401 HA PHE 59 HA PHE 59 -9.469 31.214 -18.789 402 HB2 PHE 59 1HB PHE 59 -7.636 32.046 -17.510 403 HB3 PHE 59 2HB PHE 59 -8.605 31.062 -16.418 404 HD1 PHE 59 HD1 PHE 59 -7.853 28.603 -16.120 405 HD2 PHE 59 HD2 PHE 59 -5.362 31.687 -17.668 406 HE1 PHE 59 HE1 PHE 59 -5.861 27.278 -15.545 407 HE2 PHE 59 HE2 PHE 59 -3.366 30.367 -17.096 408 HZ PHE 59 HZ PHE 59 -3.614 28.159 -16.035 409 H VAL 60 H VAL 60 -7.952 32.102 -20.258 410 HA VAL 60 HA VAL 60 -6.889 30.190 -22.101 411 HB VAL 60 HB VAL 60 -6.538 33.191 -22.062 412 HG11 VAL 60 1HG1 VAL 60 -6.197 32.793 -24.551 413 HG12 VAL 60 2HG1 VAL 60 -4.879 32.310 -23.481 414 HG13 VAL 60 3HG1 VAL 60 -5.974 31.093 -24.139 415 HG21 VAL 60 3HG2 VAL 60 -8.860 31.658 -22.484 416 HG22 VAL 60 1HG2 VAL 60 -8.633 33.383 -22.773 417 HG23 VAL 60 2HG2 VAL 60 -8.338 32.226 -24.070 418 H LEU 61 H LEU 61 -4.987 29.220 -21.941 419 HA LEU 61 HA LEU 61 -3.016 29.999 -20.044 420 HB2 LEU 61 1HB LEU 61 -3.108 27.713 -20.462 421 HB3 LEU 61 2HB LEU 61 -3.163 27.939 -22.210 422 HG LEU 61 HG LEU 61 -0.822 28.448 -22.280 423 HD11 LEU 61 1HD1 LEU 61 -1.212 28.985 -19.466 424 HD12 LEU 61 2HD1 LEU 61 0.082 29.503 -20.545 425 HD13 LEU 61 3HD1 LEU 61 0.177 27.935 -19.745 426 HD21 LEU 61 3HD2 LEU 61 -1.863 25.988 -21.603 427 HD22 LEU 61 1HD2 LEU 61 -0.536 26.198 -20.460 428 HD23 LEU 61 2HD2 LEU 61 -0.229 26.299 -22.194 429 H GLY 62 H GLY 62 -1.312 31.311 -20.252 430 HA2 GLY 62 1HA GLY 62 0.458 31.737 -22.189 431 HA3 GLY 62 2HA GLY 62 -0.910 32.648 -22.811 432 H GLY 63 H GLY 63 -1.832 33.489 -20.180 433 HA2 GLY 63 1HA GLY 63 -0.594 34.707 -18.332 434 HA3 GLY 63 2HA GLY 63 0.266 35.497 -19.646 435 H GLY 64 H GLY 64 -1.244 36.812 -17.612 436 HA2 GLY 64 1HA GLY 64 -2.374 38.927 -18.522 437 HA3 GLY 64 2HA GLY 64 -3.581 37.795 -19.115 438 H MET 65 H MET 65 -4.457 36.285 -17.346 439 HA MET 65 HA MET 65 -5.020 37.934 -14.974 440 HB2 MET 65 1HB MET 65 -6.683 36.022 -16.563 441 HB3 MET 65 2HB MET 65 -7.046 36.263 -14.859 442 HG2 MET 65 1HG MET 65 -6.744 38.641 -16.621 443 HG3 MET 65 2HG MET 65 -8.223 37.688 -16.707 444 HE1 MET 65 3HE MET 65 -9.634 40.556 -14.739 445 HE2 MET 65 1HE MET 65 -9.249 39.910 -16.335 446 HE3 MET 65 2HE MET 65 -10.304 39.006 -15.249 447 H VAL 66 H VAL 66 -2.745 36.100 -15.340 448 HA VAL 66 HA VAL 66 -3.224 34.449 -12.966 449 HB VAL 66 HB VAL 66 -2.126 32.522 -13.904 450 HG11 VAL 66 1HG1 VAL 66 -3.931 31.733 -15.013 451 HG12 VAL 66 2HG1 VAL 66 -4.635 33.268 -14.501 452 HG13 VAL 66 3HG1 VAL 66 -3.978 33.096 -16.129 453 HG21 VAL 66 3HG2 VAL 66 -1.466 32.446 -16.281 454 HG22 VAL 66 1HG2 VAL 66 -1.831 34.166 -16.415 455 HG23 VAL 66 2HG2 VAL 66 -0.530 33.621 -15.356 456 H ILE 67 H ILE 67 -0.952 33.362 -12.402 457 HA ILE 67 HA ILE 67 0.983 35.578 -12.377 458 HB ILE 67 HB ILE 67 1.823 34.789 -10.315 459 HG12 ILE 67 1HG1 ILE 67 0.153 32.309 -10.770 460 HG13 ILE 67 2HG1 ILE 67 1.910 32.410 -10.800 461 HG21 ILE 67 1HG2 ILE 67 -0.893 34.150 -9.533 462 HG22 ILE 67 2HG2 ILE 67 0.105 35.541 -9.114 463 HG23 ILE 67 3HG2 ILE 67 -0.823 35.542 -10.613 464 HD11 ILE 67 3HD1 ILE 67 1.708 33.196 -8.373 465 HD12 ILE 67 1HD1 ILE 67 0.059 32.578 -8.457 466 HD13 ILE 67 2HD1 ILE 67 1.423 31.492 -8.725 467 H LYS 68 H LYS 68 3.302 34.887 -12.217 468 HA LYS 68 HA LYS 68 4.145 33.545 -14.454 469 HB2 LYS 68 1HB LYS 68 5.529 33.928 -11.801 470 HB3 LYS 68 2HB LYS 68 6.335 33.241 -13.205 471 HG2 LYS 68 1HG LYS 68 6.799 35.272 -13.939 472 HG3 LYS 68 2HG LYS 68 5.076 35.649 -14.015 473 HD2 LYS 68 1HD LYS 68 5.087 36.417 -11.738 474 HD3 LYS 68 2HD LYS 68 6.753 35.876 -11.518 475 HE2 LYS 68 1HE LYS 68 6.694 37.588 -13.774 476 HE3 LYS 68 2HE LYS 68 5.795 38.382 -12.482 477 HZ1 LYS 68 3HZ LYS 68 8.604 37.447 -12.430 478 HZ2 LYS 68 1HZ LYS 68 7.759 37.864 -11.025 479 HZ3 LYS 68 2HZ LYS 68 8.026 39.024 -12.226 480 H GLY 69 H GLY 69 4.062 32.200 -11.147 481 HA2 GLY 69 1HA GLY 69 4.857 29.611 -11.766 482 HA3 GLY 69 2HA GLY 69 3.828 30.040 -10.407 483 H TRP 70 H TRP 70 1.769 31.144 -12.255 484 HA TRP 70 HA TRP 70 0.259 28.748 -12.563 485 HB2 TRP 70 1HB TRP 70 -0.253 31.551 -12.571 486 HB3 TRP 70 2HB TRP 70 -0.919 30.875 -14.055 487 HD1 TRP 70 HD1 TRP 70 -3.275 29.898 -13.844 488 HE1 TRP 70 HE1 TRP 70 -4.784 29.128 -11.906 489 HE3 TRP 70 HE3 TRP 70 0.038 30.408 -9.984 490 HZ2 TRP 70 HZ2 TRP 70 -4.595 28.784 -9.111 491 HZ3 TRP 70 HZ3 TRP 70 -0.705 29.838 -7.709 492 HH2 TRP 70 HH2 TRP 70 -2.974 29.043 -7.283 493 H ASP 71 H ASP 71 1.360 31.143 -14.971 494 HA ASP 71 HA ASP 71 0.658 29.732 -17.250 495 HB2 ASP 71 1HB ASP 71 1.319 32.007 -17.483 496 HB3 ASP 71 2HB ASP 71 2.892 31.697 -16.751 497 H GLU 72 H GLU 72 3.728 29.663 -15.463 498 HA GLU 72 HA GLU 72 5.025 27.827 -17.169 499 HB2 GLU 72 1HB GLU 72 6.012 29.361 -15.332 500 HB3 GLU 72 2HB GLU 72 5.612 28.051 -14.230 501 HG2 GLU 72 1HG GLU 72 7.780 27.546 -14.733 502 HG3 GLU 72 2HG GLU 72 6.929 26.592 -15.947 503 H GLY 73 H GLY 73 3.087 27.405 -14.238 504 HA2 GLY 73 1HA GLY 73 3.515 24.673 -13.835 505 HA3 GLY 73 2HA GLY 73 2.074 25.551 -13.344 506 H VAL 74 H VAL 74 0.686 26.156 -15.427 507 HA VAL 74 HA VAL 74 -0.309 23.698 -16.409 508 HB VAL 74 HB VAL 74 -1.706 25.152 -17.925 509 HG11 VAL 74 1HG1 VAL 74 -2.039 26.321 -15.238 510 HG12 VAL 74 2HG1 VAL 74 -3.195 25.459 -16.255 511 HG13 VAL 74 3HG1 VAL 74 -2.003 24.560 -15.315 512 HG21 VAL 74 3HG2 VAL 74 0.256 27.003 -17.568 513 HG22 VAL 74 1HG2 VAL 74 -1.373 27.362 -18.142 514 HG23 VAL 74 2HG2 VAL 74 -0.971 27.571 -16.437 515 H GLN 75 H GLN 75 2.045 25.944 -17.604 516 HA GLN 75 HA GLN 75 2.032 25.495 -20.319 517 HB2 GLN 75 1HB GLN 75 3.949 26.436 -18.354 518 HB3 GLN 75 2HB GLN 75 4.739 25.549 -19.651 519 HG2 GLN 75 1HG GLN 75 3.618 27.007 -21.291 520 HG3 GLN 75 2HG GLN 75 2.922 27.927 -19.958 521 HE21 GLN 75 2HE2 GLN 75 4.293 29.176 -18.646 522 HE22 GLN 75 1HE2 GLN 75 5.855 29.671 -19.192 523 H GLY 76 H GLY 76 3.098 23.377 -17.759 524 HA2 GLY 76 1HA GLY 76 3.878 21.388 -19.802 525 HA3 GLY 76 2HA GLY 76 4.628 21.492 -18.216 526 H MET 77 H MET 77 1.944 22.035 -16.989 527 HA MET 77 HA MET 77 1.334 19.502 -16.086 528 HB2 MET 77 1HB MET 77 0.416 22.044 -15.570 529 HB3 MET 77 2HB MET 77 -1.006 21.258 -16.242 530 HG2 MET 77 1HG MET 77 -1.234 19.847 -14.485 531 HG3 MET 77 2HG MET 77 0.498 19.781 -14.170 532 HE1 MET 77 3HE MET 77 -1.191 19.905 -11.573 533 HE2 MET 77 1HE MET 77 0.564 19.990 -11.736 534 HE3 MET 77 2HE MET 77 -0.289 21.178 -10.749 535 H LYS 78 H LYS 78 -0.153 17.929 -16.621 536 HA LYS 78 HA LYS 78 -1.270 18.132 -19.338 537 HB2 LYS 78 1HB LYS 78 -0.442 15.707 -17.736 538 HB3 LYS 78 2HB LYS 78 -1.266 15.627 -19.287 539 HG2 LYS 78 1HG LYS 78 0.584 16.193 -20.456 540 HG3 LYS 78 2HG LYS 78 1.200 17.251 -19.185 541 HD2 LYS 78 1HD LYS 78 1.108 14.350 -18.592 542 HD3 LYS 78 2HD LYS 78 2.306 14.888 -19.771 543 HE2 LYS 78 1HE LYS 78 2.882 16.684 -17.995 544 HE3 LYS 78 2HE LYS 78 2.035 15.615 -16.878 545 HZ1 LYS 78 3HZ LYS 78 4.663 15.419 -17.738 546 HZ2 LYS 78 1HZ LYS 78 3.842 14.121 -18.448 547 HZ3 LYS 78 2HZ LYS 78 3.813 14.323 -16.769 548 H VAL 79 H VAL 79 -3.320 17.011 -19.721 549 HA VAL 79 HA VAL 79 -5.356 17.837 -18.037 550 HB VAL 79 HB VAL 79 -5.505 15.465 -19.900 551 HG11 VAL 79 1HG1 VAL 79 -7.459 15.540 -18.578 552 HG12 VAL 79 2HG1 VAL 79 -7.570 17.297 -18.705 553 HG13 VAL 79 3HG1 VAL 79 -7.891 16.287 -20.116 554 HG21 VAL 79 3HG2 VAL 79 -6.563 17.748 -21.139 555 HG22 VAL 79 1HG2 VAL 79 -5.009 18.237 -20.463 556 HG23 VAL 79 2HG2 VAL 79 -5.097 16.870 -21.574 557 H GLY 80 H GLY 80 -6.076 17.151 -16.132 558 HA2 GLY 80 1HA GLY 80 -6.761 15.629 -14.506 559 HA3 GLY 80 2HA GLY 80 -6.066 14.330 -15.465 560 H GLY 81 H GLY 81 -3.744 16.643 -15.295 561 HA2 GLY 81 1HA GLY 81 -2.205 15.118 -13.401 562 HA3 GLY 81 2HA GLY 81 -1.669 16.546 -14.273 563 H VAL 82 H VAL 82 -2.062 15.424 -11.287 564 HA VAL 82 HA VAL 82 -2.905 18.029 -10.194 565 HB VAL 82 HB VAL 82 -2.972 15.376 -8.755 566 HG11 VAL 82 1HG1 VAL 82 -4.764 17.240 -7.653 567 HG12 VAL 82 2HG1 VAL 82 -3.273 16.620 -6.940 568 HG13 VAL 82 3HG1 VAL 82 -3.244 18.097 -7.904 569 HG21 VAL 82 3HG2 VAL 82 -4.670 15.000 -10.223 570 HG22 VAL 82 1HG2 VAL 82 -5.554 15.957 -9.034 571 HG23 VAL 82 2HG2 VAL 82 -4.953 16.717 -10.508 572 H ARG 83 H ARG 83 -1.323 19.200 -9.352 573 HA ARG 83 HA ARG 83 0.790 17.905 -7.820 574 HB2 ARG 83 1HB ARG 83 1.513 19.902 -9.957 575 HB3 ARG 83 2HB ARG 83 2.592 18.883 -9.014 576 HG2 ARG 83 1HG ARG 83 1.551 16.901 -10.149 577 HG3 ARG 83 2HG ARG 83 0.724 18.041 -11.212 578 HD2 ARG 83 1HD ARG 83 2.617 18.572 -12.338 579 HD3 ARG 83 2HD ARG 83 3.638 18.410 -10.909 580 HE ARG 83 HE ARG 83 2.723 15.868 -11.671 581 HH11 ARG 83 1HH1 ARG 83 4.862 18.387 -12.768 582 HH12 ARG 83 2HH1 ARG 83 5.918 17.303 -13.611 583 HH21 ARG 83 1HH2 ARG 83 4.106 14.431 -12.778 584 HH22 ARG 83 2HH2 ARG 83 5.486 15.053 -13.617 585 H ARG 84 H ARG 84 1.627 19.168 -6.199 586 HA ARG 84 HA ARG 84 0.127 21.569 -5.577 587 HB2 ARG 84 1HB ARG 84 0.960 19.598 -3.990 588 HB3 ARG 84 2HB ARG 84 2.372 20.637 -3.858 589 HG2 ARG 84 1HG ARG 84 0.801 22.500 -3.222 590 HG3 ARG 84 2HG ARG 84 -0.465 21.276 -3.106 591 HD2 ARG 84 1HD ARG 84 1.517 20.136 -1.638 592 HD3 ARG 84 2HD ARG 84 1.788 21.848 -1.312 593 HE ARG 84 HE ARG 84 -0.168 21.902 -0.112 594 HH11 ARG 84 1HH1 ARG 84 -0.006 18.944 -1.940 595 HH12 ARG 84 2HH1 ARG 84 -1.378 18.233 -1.159 596 HH21 ARG 84 1HH2 ARG 84 -1.977 20.976 0.925 597 HH22 ARG 84 2HH2 ARG 84 -2.499 19.390 0.470 598 H LEU 85 H LEU 85 0.783 23.326 -6.672 599 HA LEU 85 HA LEU 85 3.602 23.806 -7.163 600 HB2 LEU 85 1HB LEU 85 1.901 24.270 -8.888 601 HB3 LEU 85 2HB LEU 85 1.198 25.497 -7.836 602 HG LEU 85 HG LEU 85 3.767 26.365 -8.010 603 HD11 LEU 85 1HD1 LEU 85 3.219 24.664 -10.355 604 HD12 LEU 85 2HD1 LEU 85 4.752 25.130 -9.619 605 HD13 LEU 85 3HD1 LEU 85 3.910 26.252 -10.688 606 HD21 LEU 85 3HD2 LEU 85 2.879 28.159 -9.130 607 HD22 LEU 85 1HD2 LEU 85 1.415 27.429 -8.471 608 HD23 LEU 85 2HD2 LEU 85 1.856 27.153 -10.157 609 H THR 86 H THR 86 4.856 24.841 -5.774 610 HA THR 86 HA THR 86 3.628 26.496 -3.693 611 HB THR 86 HB THR 86 6.552 25.915 -3.697 612 HG1 THR 86 HG1 THR 86 5.982 23.866 -2.634 613 HG21 THR 86 3HG2 THR 86 4.796 25.538 -1.340 614 HG22 THR 86 1HG2 THR 86 4.966 27.183 -1.951 615 HG23 THR 86 2HG2 THR 86 6.394 26.275 -1.456 616 H ILE 87 H ILE 87 3.555 28.616 -3.989 617 HA ILE 87 HA ILE 87 5.642 29.882 -5.640 618 HB ILE 87 HB ILE 87 2.873 30.961 -5.115 619 HG12 ILE 87 1HG1 ILE 87 2.775 30.356 -7.708 620 HG13 ILE 87 2HG1 ILE 87 3.929 29.123 -7.212 621 HG21 ILE 87 1HG2 ILE 87 4.988 31.768 -7.108 622 HG22 ILE 87 2HG2 ILE 87 3.388 32.490 -6.944 623 HG23 ILE 87 3HG2 ILE 87 4.563 32.647 -5.639 624 HD11 ILE 87 3HD1 ILE 87 1.873 29.007 -5.334 625 HD12 ILE 87 1HD1 ILE 87 1.079 29.193 -6.898 626 HD13 ILE 87 2HD1 ILE 87 2.208 27.864 -6.634 627 HA PRO 88 HA PRO 88 6.919 31.964 -1.948 628 HB2 PRO 88 1HB PRO 88 8.555 33.777 -3.132 629 HB3 PRO 88 2HB PRO 88 8.995 32.078 -2.926 630 HG2 PRO 88 1HG PRO 88 7.922 33.477 -5.345 631 HG3 PRO 88 2HG PRO 88 9.225 32.279 -5.231 632 HD2 PRO 88 1HD PRO 88 6.719 31.634 -6.028 633 HD3 PRO 88 2HD PRO 88 7.756 30.506 -5.133 634 HA PRO 89 HA PRO 89 4.586 35.661 -1.475 635 HB2 PRO 89 1HB PRO 89 6.244 37.277 -0.057 636 HB3 PRO 89 2HB PRO 89 5.458 35.857 0.642 637 HG2 PRO 89 1HG PRO 89 8.250 36.158 -0.394 638 HG3 PRO 89 2HG PRO 89 7.684 35.342 1.075 639 HD2 PRO 89 1HD PRO 89 8.320 33.995 -1.187 640 HD3 PRO 89 2HD PRO 89 7.053 33.444 -0.071 641 H GLN 90 H GLN 90 7.384 35.657 -3.347 642 HA GLN 90 HA GLN 90 7.160 38.472 -4.098 643 HB2 GLN 90 1HB GLN 90 9.391 37.281 -3.680 644 HB3 GLN 90 2HB GLN 90 9.119 36.481 -5.223 645 HG2 GLN 90 1HG GLN 90 9.452 38.386 -6.433 646 HG3 GLN 90 2HG GLN 90 8.933 39.443 -5.120 647 HE21 GLN 90 2HE2 GLN 90 11.413 36.923 -5.433 648 HE22 GLN 90 1HE2 GLN 90 12.723 37.904 -4.880 649 H LEU 91 H LEU 91 7.037 35.250 -5.590 650 HA LEU 91 HA LEU 91 5.969 36.405 -8.046 651 HB2 LEU 91 1HB LEU 91 6.403 33.484 -7.529 652 HB3 LEU 91 2HB LEU 91 6.373 34.337 -9.071 653 HG LEU 91 HG LEU 91 8.568 34.358 -7.005 654 HD11 LEU 91 1HD1 LEU 91 9.884 33.295 -8.669 655 HD12 LEU 91 2HD1 LEU 91 8.645 33.539 -9.900 656 HD13 LEU 91 3HD1 LEU 91 8.362 32.409 -8.576 657 HD21 LEU 91 3HD2 LEU 91 8.709 36.530 -7.718 658 HD22 LEU 91 1HD2 LEU 91 8.006 36.175 -9.297 659 HD23 LEU 91 2HD2 LEU 91 9.678 35.727 -8.955 660 H GLY 92 H GLY 92 4.529 36.113 -5.355 661 HA2 GLY 92 1HA GLY 92 2.157 34.714 -6.429 662 HA3 GLY 92 2HA GLY 92 2.600 34.665 -4.729 663 H TYR 93 H TYR 93 1.762 36.151 -3.402 664 HA TYR 93 HA TYR 93 -0.254 37.904 -4.309 665 HB2 TYR 93 1HB TYR 93 1.070 37.332 -1.713 666 HB3 TYR 93 2HB TYR 93 0.233 38.874 -1.854 667 HD1 TYR 93 HD2 TYR 93 -0.173 35.221 -1.867 668 HD2 TYR 93 HD1 TYR 93 -2.168 38.977 -1.996 669 HE1 TYR 93 HE2 TYR 93 -2.312 34.094 -1.415 670 HE2 TYR 93 HE1 TYR 93 -4.312 37.861 -1.543 671 HH TYR 93 HH TYR 93 -4.745 34.540 -1.798 672 H GLY 94 H GLY 94 3.152 38.352 -3.591 673 HA2 GLY 94 1HA GLY 94 4.269 40.117 -4.897 674 HA3 GLY 94 2HA GLY 94 2.895 41.146 -4.520 675 H ALA 95 H ALA 95 5.203 42.254 -3.973 676 HA ALA 95 HA ALA 95 6.469 41.678 -1.556 677 HB1 ALA 95 1HB ALA 95 6.098 44.416 -2.760 678 HB2 ALA 95 2HB ALA 95 7.367 43.904 -1.647 679 HB3 ALA 95 3HB ALA 95 7.311 43.248 -3.283 680 H ARG 96 H ARG 96 3.549 43.517 -2.232 681 HA ARG 96 HA ARG 96 3.283 44.531 0.437 682 HB2 ARG 96 1HB ARG 96 1.642 44.574 -2.049 683 HB3 ARG 96 2HB ARG 96 0.820 44.861 -0.521 684 HG2 ARG 96 1HG ARG 96 2.257 46.738 -0.049 685 HG3 ARG 96 2HG ARG 96 3.208 46.411 -1.499 686 HD2 ARG 96 1HD ARG 96 0.267 47.068 -1.512 687 HD3 ARG 96 2HD ARG 96 1.546 48.259 -1.744 688 HE ARG 96 HE ARG 96 2.094 46.395 -3.623 689 HH11 ARG 96 1HH1 ARG 96 -0.780 48.172 -2.787 690 HH12 ARG 96 2HH1 ARG 96 -1.405 48.176 -4.403 691 HH21 ARG 96 1HH2 ARG 96 1.283 46.394 -5.754 692 HH22 ARG 96 2HH2 ARG 96 -0.231 47.164 -6.090 693 H GLY 97 H GLY 97 1.129 42.352 -1.399 694 HA2 GLY 97 1HA GLY 97 -0.063 40.503 -0.739 695 HA3 GLY 97 2HA GLY 97 1.107 40.313 0.558 696 H ALA 98 H ALA 98 -1.714 39.822 0.712 697 HA ALA 98 HA ALA 98 -3.054 41.973 1.990 698 HB1 ALA 98 1HB ALA 98 -4.689 40.565 1.417 699 HB2 ALA 98 2HB ALA 98 -3.601 39.177 1.379 700 HB3 ALA 98 3HB ALA 98 -4.303 39.706 2.908 701 H GLY 99 H GLY 99 -2.816 42.741 3.983 702 HA2 GLY 99 1HA GLY 99 -0.982 41.534 5.821 703 HA3 GLY 99 2HA GLY 99 -1.944 42.977 6.106 704 H GLY 100 H GLY 100 -1.355 40.126 7.402 705 HA2 GLY 100 1HA GLY 100 -2.740 39.540 9.339 706 HA3 GLY 100 2HA GLY 100 -4.145 39.785 8.313 707 H VAL 101 H VAL 101 -3.208 38.428 6.015 708 HA VAL 101 HA VAL 101 -3.081 35.658 7.019 709 HB VAL 101 HB VAL 101 -4.442 36.536 4.473 710 HG11 VAL 101 1HG1 VAL 101 -3.578 34.195 4.616 711 HG12 VAL 101 2HG1 VAL 101 -4.664 33.938 5.983 712 HG13 VAL 101 3HG1 VAL 101 -5.323 34.317 4.391 713 HG21 VAL 101 3HG2 VAL 101 -5.606 37.472 6.413 714 HG22 VAL 101 1HG2 VAL 101 -6.559 36.203 5.642 715 HG23 VAL 101 2HG2 VAL 101 -5.689 35.867 7.139 716 H ILE 102 H ILE 102 -2.026 37.959 4.600 717 HA ILE 102 HA ILE 102 -0.106 35.967 3.587 718 HB ILE 102 HB ILE 102 -1.064 38.468 2.192 719 HG12 ILE 102 1HG1 ILE 102 -2.866 36.840 2.336 720 HG13 ILE 102 2HG1 ILE 102 -2.256 36.902 0.686 721 HG21 ILE 102 1HG2 ILE 102 1.201 36.814 1.776 722 HG22 ILE 102 2HG2 ILE 102 0.082 36.551 0.440 723 HG23 ILE 102 3HG2 ILE 102 0.646 38.181 0.810 724 HD11 ILE 102 3HD1 ILE 102 -2.036 34.740 2.712 725 HD12 ILE 102 1HD1 ILE 102 -2.450 34.650 1.001 726 HD13 ILE 102 2HD1 ILE 102 -0.775 34.902 1.491 727 HA PRO 103 HA PRO 103 2.345 39.124 5.944 728 HB2 PRO 103 1HB PRO 103 3.969 37.306 7.138 729 HB3 PRO 103 2HB PRO 103 2.404 37.782 7.808 730 HG2 PRO 103 1HG PRO 103 3.119 35.359 6.202 731 HG3 PRO 103 2HG PRO 103 2.092 35.484 7.643 732 HD2 PRO 103 1HD PRO 103 1.075 35.311 5.139 733 HD3 PRO 103 2HD PRO 103 0.272 36.220 6.435 734 HA PRO 104 HA PRO 104 5.807 39.227 3.236 735 HB2 PRO 104 1HB PRO 104 7.811 40.081 4.855 736 HB3 PRO 104 2HB PRO 104 6.492 41.131 4.323 737 HG2 PRO 104 1HG PRO 104 6.831 39.683 6.921 738 HG3 PRO 104 2HG PRO 104 6.273 41.341 6.629 739 HD2 PRO 104 1HD PRO 104 4.570 39.299 7.142 740 HD3 PRO 104 2HD PRO 104 4.138 40.661 6.087 741 H ASN 105 H ASN 105 7.649 38.113 2.561 742 HA ASN 105 HA ASN 105 8.950 36.258 2.319 743 HB2 ASN 105 1HB ASN 105 10.050 37.572 4.246 744 HB3 ASN 105 2HB ASN 105 9.365 36.339 5.300 745 HD21 ASN 105 2HD2 ASN 105 11.955 36.497 5.433 746 HD22 ASN 105 1HD2 ASN 105 12.745 35.231 4.562 747 H ALA 106 H ALA 106 6.175 35.751 2.684 748 HA ALA 106 HA ALA 106 6.202 33.225 4.196 749 HB1 ALA 106 1HB ALA 106 3.968 33.482 4.677 750 HB2 ALA 106 2HB ALA 106 4.514 35.159 4.677 751 HB3 ALA 106 3HB ALA 106 3.672 34.506 3.271 752 H THR 107 H THR 107 5.954 31.347 3.153 753 HA THR 107 HA THR 107 5.782 31.380 0.261 754 HB THR 107 HB THR 107 6.147 29.080 2.189 755 HG1 THR 107 HG1 THR 107 8.029 30.241 0.398 756 HG21 THR 107 3HG2 THR 107 5.290 27.994 0.348 757 HG22 THR 107 1HG2 THR 107 7.004 28.029 -0.063 758 HG23 THR 107 2HG2 THR 107 5.900 29.201 -0.783 759 H LEU 108 H LEU 108 3.983 31.068 -0.870 760 HA LEU 108 HA LEU 108 1.572 30.187 0.534 761 HB2 LEU 108 1HB LEU 108 2.093 31.696 -1.993 762 HB3 LEU 108 2HB LEU 108 0.541 30.897 -1.748 763 HG LEU 108 HG LEU 108 0.386 33.243 -1.172 764 HD11 LEU 108 1HD1 LEU 108 -1.077 32.629 0.372 765 HD12 LEU 108 2HD1 LEU 108 0.225 32.461 1.549 766 HD13 LEU 108 3HD1 LEU 108 -0.248 31.083 0.556 767 HD21 LEU 108 3HD2 LEU 108 2.394 32.778 1.015 768 HD22 LEU 108 1HD2 LEU 108 1.715 34.306 0.452 769 HD23 LEU 108 2HD2 LEU 108 2.847 33.416 -0.567 770 H VAL 109 H VAL 109 0.679 28.253 0.211 771 HA VAL 109 HA VAL 109 1.853 26.512 -1.836 772 HB VAL 109 HB VAL 109 0.157 25.835 0.570 773 HG11 VAL 109 1HG1 VAL 109 1.319 23.505 -0.291 774 HG12 VAL 109 2HG1 VAL 109 -0.355 23.984 -0.578 775 HG13 VAL 109 3HG1 VAL 109 0.876 24.297 -1.803 776 HG21 VAL 109 3HG2 VAL 109 2.837 26.465 0.449 777 HG22 VAL 109 1HG2 VAL 109 2.044 25.547 1.729 778 HG23 VAL 109 2HG2 VAL 109 2.832 24.702 0.397 779 H PHE 110 H PHE 110 0.800 26.460 -3.705 780 HA PHE 110 HA PHE 110 -2.146 26.531 -3.656 781 HB2 PHE 110 1HB PHE 110 -0.171 27.682 -5.608 782 HB3 PHE 110 2HB PHE 110 -1.819 27.316 -6.108 783 HD1 PHE 110 HD2 PHE 110 -3.715 28.517 -5.097 784 HD2 PHE 110 HD1 PHE 110 0.321 29.551 -4.223 785 HE1 PHE 110 HE2 PHE 110 -4.467 30.682 -4.203 786 HE2 PHE 110 HE1 PHE 110 -0.425 31.717 -3.327 787 HZ PHE 110 HZ PHE 110 -2.821 32.286 -3.317 788 H GLU 111 H GLU 111 -3.229 24.882 -4.558 789 HA GLU 111 HA GLU 111 -1.640 22.741 -5.784 790 HB2 GLU 111 1HB GLU 111 -3.175 22.384 -3.733 791 HB3 GLU 111 2HB GLU 111 -4.497 22.475 -4.888 792 HG2 GLU 111 1HG GLU 111 -3.336 20.635 -6.169 793 HG3 GLU 111 2HG GLU 111 -2.284 20.452 -4.766 794 H VAL 112 H VAL 112 -1.840 22.256 -7.873 795 HA VAL 112 HA VAL 112 -4.104 23.424 -9.359 796 HB VAL 112 HB VAL 112 -1.361 22.847 -10.479 797 HG11 VAL 112 1HG1 VAL 112 -3.461 24.632 -11.660 798 HG12 VAL 112 2HG1 VAL 112 -2.074 23.877 -12.447 799 HG13 VAL 112 3HG1 VAL 112 -3.458 22.896 -11.966 800 HG21 VAL 112 3HG2 VAL 112 -2.500 25.295 -9.207 801 HG22 VAL 112 1HG2 VAL 112 -0.882 24.606 -9.074 802 HG23 VAL 112 2HG2 VAL 112 -1.358 25.462 -10.540 803 H GLU 113 H GLU 113 -5.420 22.019 -10.307 804 HA GLU 113 HA GLU 113 -4.373 19.367 -11.036 805 HB2 GLU 113 1HB GLU 113 -6.779 18.575 -10.439 806 HB3 GLU 113 2HB GLU 113 -5.601 18.798 -9.154 807 HG2 GLU 113 1HG GLU 113 -7.163 21.191 -9.753 808 HG3 GLU 113 2HG GLU 113 -8.123 19.827 -9.185 809 H LEU 114 H LEU 114 -4.340 19.472 -13.200 810 HA LEU 114 HA LEU 114 -6.041 21.002 -14.811 811 HB2 LEU 114 1HB LEU 114 -4.155 18.755 -15.256 812 HB3 LEU 114 2HB LEU 114 -5.298 19.128 -16.545 813 HG LEU 114 HG LEU 114 -2.962 20.167 -16.666 814 HD11 LEU 114 1HD1 LEU 114 -5.591 21.339 -17.184 815 HD12 LEU 114 2HD1 LEU 114 -4.193 21.166 -18.244 816 HD13 LEU 114 3HD1 LEU 114 -4.276 22.513 -17.109 817 HD21 LEU 114 3HD2 LEU 114 -2.583 22.173 -15.411 818 HD22 LEU 114 1HD2 LEU 114 -2.937 20.869 -14.277 819 HD23 LEU 114 2HD2 LEU 114 -4.176 22.064 -14.662 820 H LEU 115 H LEU 115 -8.063 20.720 -15.494 821 HA LEU 115 HA LEU 115 -9.367 18.148 -14.936 822 HB2 LEU 115 1HB LEU 115 -10.393 20.952 -15.210 823 HB3 LEU 115 2HB LEU 115 -11.475 19.565 -15.328 824 HG LEU 115 HG LEU 115 -9.769 19.605 -12.933 825 HD11 LEU 115 1HD1 LEU 115 -12.019 21.329 -12.454 826 HD12 LEU 115 2HD1 LEU 115 -10.956 22.022 -13.678 827 HD13 LEU 115 3HD1 LEU 115 -10.311 21.586 -12.096 828 HD21 LEU 115 3HD2 LEU 115 -11.826 18.122 -13.666 829 HD22 LEU 115 1HD2 LEU 115 -12.737 19.439 -12.928 830 HD23 LEU 115 2HD2 LEU 115 -11.551 18.546 -11.976 831 H ASP 116 H ASP 116 -8.818 20.548 -17.450 832 HA ASP 116 HA ASP 116 -8.952 18.662 -19.534 833 HB2 ASP 116 1HB ASP 116 -11.432 18.980 -18.820 834 HB3 ASP 116 2HB ASP 116 -11.301 20.532 -19.642 835 H VAL 117 H VAL 117 -8.367 19.539 -21.541 836 HA VAL 117 HA VAL 117 -6.822 21.900 -21.427 837 HB VAL 117 HB VAL 117 -7.784 20.392 -23.862 838 HG11 VAL 117 1HG1 VAL 117 -5.877 22.651 -23.479 839 HG12 VAL 117 2HG1 VAL 117 -5.551 21.453 -24.733 840 HG13 VAL 117 3HG1 VAL 117 -7.054 22.375 -24.762 841 HG21 VAL 117 3HG2 VAL 117 -5.833 19.764 -21.835 842 HG22 VAL 117 1HG2 VAL 117 -6.407 18.782 -23.184 843 HG23 VAL 117 2HG2 VAL 117 -5.070 19.908 -23.418 844 H11 L2S 130 1H1 L2S 130 -4.902 31.390 -9.162 845 H21 L2S 130 2H1 L2S 130 -5.084 32.091 -10.842 846 H12 L2S 130 1H2 L2S 130 -4.291 34.212 -10.058 847 H22 L2S 130 2H2 L2S 130 -3.048 32.913 -9.717 848 H13 L2S 130 2H3 L2S 130 -3.794 32.841 -7.426 849 H23 L2S 130 1H3 L2S 130 -3.393 34.572 -7.842 850 H14 L2S 130 1H4 L2S 130 -6.512 32.320 -7.336 851 H24 L2S 130 2H4 L2S 130 -7.484 33.786 -7.823 852 H15 L2S 130 1H5 L2S 130 -7.237 32.043 -9.625 853 H25 L2S 130 2H5 L2S 130 -6.632 33.726 -10.013 854 H17 L2S 130 1H7 L2S 130 -7.576 35.674 -7.200 855 H27 L2S 130 2H7 L2S 130 -7.395 34.933 -5.522 856 H9 L2S 130 H9 L2S 130 -6.058 35.537 -3.608 857 H10 L2S 130 H10 L2S 130 -6.951 35.003 -1.341 858 H112 L2S 130 1H12 L2S 130 -9.862 38.237 -1.734 859 H113 L2S 130 1H13 L2S 130 -8.992 38.723 -4.013 860 H114 L2S 130 1H14 L2S 130 -10.006 36.606 -0.068 861 H214 L2S 130 2H14 L2S 130 -8.380 36.824 0.624 862 H314 L2S 130 3H14 L2S 130 -8.869 35.214 -0.009 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -2.929 6.618 -5.531 2 HA2 GLY 1 1HA GLY 1 -1.840 4.240 -6.755 3 HA3 GLY 1 2HA GLY 1 -0.970 5.724 -6.396 4 HA PRO 2 HA PRO 2 0.353 2.355 -3.443 5 HB2 PRO 2 1HB PRO 2 3.009 2.584 -3.955 6 HB3 PRO 2 2HB PRO 2 1.939 1.528 -4.885 7 HG2 PRO 2 1HG PRO 2 2.948 4.267 -5.553 8 HG3 PRO 2 2HG PRO 2 2.803 2.842 -6.599 9 HD2 PRO 2 1HD PRO 2 0.995 4.858 -6.624 10 HD3 PRO 2 2HD PRO 2 0.548 3.170 -6.946 11 H GLY 3 H GLY 3 2.112 5.377 -4.179 12 HA2 GLY 3 1HA GLY 3 1.821 7.093 -2.332 13 HA3 GLY 3 2HA GLY 3 2.381 5.809 -1.271 14 H SER 4 H SER 4 3.382 7.445 -4.277 15 HA SER 4 HA SER 4 6.091 7.640 -3.147 16 HB2 SER 4 1HB SER 4 5.435 6.920 -6.015 17 HB3 SER 4 2HB SER 4 7.053 7.141 -5.349 18 HG SER 4 HG SER 4 5.257 5.265 -4.247 19 H MET 5 H MET 5 6.248 9.764 -2.751 20 HA MET 5 HA MET 5 5.517 11.622 -4.919 21 HB2 MET 5 1HB MET 5 5.491 12.029 -1.927 22 HB3 MET 5 2HB MET 5 5.316 13.340 -3.086 23 HG2 MET 5 1HG MET 5 3.130 12.897 -2.626 24 HG3 MET 5 2HG MET 5 3.382 11.847 -4.019 25 HE1 MET 5 3HE MET 5 2.093 11.561 -0.101 26 HE2 MET 5 1HE MET 5 1.401 12.164 -1.608 27 HE3 MET 5 2HE MET 5 0.981 10.552 -1.028 28 H THR 6 H THR 6 6.770 13.817 -4.524 29 HA THR 6 HA THR 6 9.408 13.648 -3.477 30 HB THR 6 HB THR 6 9.710 12.241 -5.499 31 HG1 THR 6 HG1 THR 6 11.481 13.452 -4.750 32 HG21 THR 6 3HG2 THR 6 9.704 14.393 -7.423 33 HG22 THR 6 1HG2 THR 6 8.103 14.177 -6.718 34 HG23 THR 6 2HG2 THR 6 8.912 12.820 -7.501 35 H VAL 7 H VAL 7 10.712 15.598 -4.045 36 HA VAL 7 HA VAL 7 9.028 17.861 -4.881 37 HB VAL 7 HB VAL 7 10.972 17.974 -2.574 38 HG11 VAL 7 1HG1 VAL 7 9.106 20.051 -2.444 39 HG12 VAL 7 2HG1 VAL 7 10.813 20.172 -2.876 40 HG13 VAL 7 3HG1 VAL 7 9.596 19.964 -4.136 41 HG21 VAL 7 3HG2 VAL 7 7.966 17.737 -2.558 42 HG22 VAL 7 1HG2 VAL 7 9.129 16.576 -1.919 43 HG23 VAL 7 2HG2 VAL 7 8.944 18.152 -1.150 44 H VAL 8 H VAL 8 10.064 19.513 -5.973 45 HA VAL 8 HA VAL 8 12.934 19.518 -6.284 46 HB VAL 8 HB VAL 8 12.390 17.821 -7.920 47 HG11 VAL 8 1HG1 VAL 8 10.887 19.377 -9.809 48 HG12 VAL 8 2HG1 VAL 8 10.500 17.813 -9.089 49 HG13 VAL 8 3HG1 VAL 8 10.036 19.303 -8.266 50 HG21 VAL 8 3HG2 VAL 8 14.155 19.415 -8.484 51 HG22 VAL 8 1HG2 VAL 8 13.301 18.873 -9.929 52 HG23 VAL 8 2HG2 VAL 8 12.966 20.467 -9.253 53 H THR 9 H THR 9 13.618 21.545 -6.542 54 HA THR 9 HA THR 9 11.638 23.583 -7.303 55 HB THR 9 HB THR 9 14.258 24.193 -5.961 56 HG1 THR 9 HG1 THR 9 13.501 23.058 -4.330 57 HG21 THR 9 3HG2 THR 9 13.443 26.275 -5.746 58 HG22 THR 9 1HG2 THR 9 11.847 25.699 -5.270 59 HG23 THR 9 2HG2 THR 9 12.276 25.795 -6.978 60 H THR 10 H THR 10 12.127 25.149 -8.828 61 HA THR 10 HA THR 10 14.360 24.467 -10.610 62 HB THR 10 HB THR 10 13.182 25.695 -12.353 63 HG1 THR 10 HG1 THR 10 11.500 26.394 -10.198 64 HG21 THR 10 3HG2 THR 10 11.234 23.874 -10.942 65 HG22 THR 10 1HG2 THR 10 12.609 23.303 -11.886 66 HG23 THR 10 2HG2 THR 10 11.320 24.217 -12.669 67 H GLU 11 H GLU 11 15.479 26.268 -11.691 68 HA GLU 11 HA GLU 11 16.532 28.096 -9.836 69 HB2 GLU 11 1HB GLU 11 17.790 29.010 -11.667 70 HB3 GLU 11 2HB GLU 11 17.710 27.266 -11.871 71 HG2 GLU 11 1HG GLU 11 15.907 27.552 -13.509 72 HG3 GLU 11 2HG GLU 11 16.034 29.301 -13.323 73 H SER 12 H SER 12 13.831 28.284 -11.999 74 HA SER 12 HA SER 12 13.557 31.048 -12.268 75 HB2 SER 12 1HB SER 12 11.188 29.213 -11.979 76 HB3 SER 12 2HB SER 12 11.360 30.635 -13.007 77 HG SER 12 HG SER 12 11.649 28.255 -13.818 78 H GLY 13 H GLY 13 12.951 28.967 -9.565 79 HA2 GLY 13 1HA GLY 13 12.978 30.078 -7.373 80 HA3 GLY 13 2HA GLY 13 11.920 31.297 -8.068 81 H LEU 14 H LEU 14 10.078 29.720 -9.392 82 HA LEU 14 HA LEU 14 8.335 29.009 -7.296 83 HB2 LEU 14 1HB LEU 14 6.771 28.519 -8.932 84 HB3 LEU 14 2HB LEU 14 7.803 29.722 -9.704 85 HG LEU 14 HG LEU 14 9.001 27.463 -10.554 86 HD11 LEU 14 1HD1 LEU 14 7.750 25.678 -10.105 87 HD12 LEU 14 2HD1 LEU 14 6.605 26.303 -11.292 88 HD13 LEU 14 3HD1 LEU 14 6.387 26.667 -9.580 89 HD21 LEU 14 3HD2 LEU 14 7.195 27.768 -12.517 90 HD22 LEU 14 1HD2 LEU 14 8.540 28.878 -12.254 91 HD23 LEU 14 2HD2 LEU 14 6.937 29.275 -11.637 92 H LYS 15 H LYS 15 7.243 26.833 -7.161 93 HA LYS 15 HA LYS 15 9.057 24.598 -7.694 94 HB2 LYS 15 1HB LYS 15 9.055 25.700 -5.230 95 HB3 LYS 15 2HB LYS 15 7.727 24.561 -5.047 96 HG2 LYS 15 1HG LYS 15 9.512 22.924 -6.155 97 HG3 LYS 15 2HG LYS 15 10.622 24.067 -5.394 98 HD2 LYS 15 1HD LYS 15 8.389 22.592 -3.998 99 HD3 LYS 15 2HD LYS 15 10.102 22.174 -3.920 100 HE2 LYS 15 1HE LYS 15 10.370 24.647 -3.127 101 HE3 LYS 15 2HE LYS 15 8.657 24.505 -2.735 102 HZ1 LYS 15 3HZ LYS 15 10.895 22.887 -1.660 103 HZ2 LYS 15 1HZ LYS 15 9.270 22.469 -1.445 104 HZ3 LYS 15 2HZ LYS 15 9.861 23.919 -0.807 105 H TYR 16 H TYR 16 7.979 22.473 -7.345 106 HA TYR 16 HA TYR 16 5.088 22.462 -7.314 107 HB2 TYR 16 1HB TYR 16 4.998 21.202 -9.513 108 HB3 TYR 16 2HB TYR 16 5.338 22.925 -9.632 109 HD1 TYR 16 HD2 TYR 16 6.932 19.575 -9.691 110 HD2 TYR 16 HD1 TYR 16 7.298 23.697 -10.681 111 HE1 TYR 16 HE2 TYR 16 8.965 19.078 -10.984 112 HE2 TYR 16 HE1 TYR 16 9.331 23.212 -11.978 113 HH TYR 16 HH TYR 16 10.474 21.453 -13.020 114 H GLU 17 H GLU 17 4.248 20.516 -6.693 115 HA GLU 17 HA GLU 17 6.146 18.287 -6.373 116 HB2 GLU 17 1HB GLU 17 4.093 19.301 -4.408 117 HB3 GLU 17 2HB GLU 17 4.857 17.723 -4.269 118 HG2 GLU 17 1HG GLU 17 7.028 18.748 -4.042 119 HG3 GLU 17 2HG GLU 17 6.332 20.346 -4.302 120 H ASP 18 H ASP 18 5.531 16.576 -7.499 121 HA ASP 18 HA ASP 18 3.099 16.323 -8.838 122 HB2 ASP 18 1HB ASP 18 3.793 13.829 -8.951 123 HB3 ASP 18 2HB ASP 18 4.837 15.028 -9.708 124 H LEU 19 H LEU 19 1.148 15.532 -8.315 125 HA LEU 19 HA LEU 19 0.851 14.237 -5.686 126 HB2 LEU 19 1HB LEU 19 -0.431 16.593 -6.787 127 HB3 LEU 19 2HB LEU 19 -1.605 15.378 -6.288 128 HG LEU 19 HG LEU 19 -0.157 15.398 -4.075 129 HD11 LEU 19 1HD1 LEU 19 0.598 17.685 -3.566 130 HD12 LEU 19 2HD1 LEU 19 0.295 18.141 -5.242 131 HD13 LEU 19 3HD1 LEU 19 1.529 16.939 -4.865 132 HD21 LEU 19 3HD2 LEU 19 -2.462 15.853 -3.983 133 HD22 LEU 19 1HD2 LEU 19 -2.291 17.337 -4.921 134 HD23 LEU 19 2HD2 LEU 19 -1.684 17.265 -3.267 135 H THR 20 H THR 20 -0.254 14.455 -9.013 136 HA THR 20 HA THR 20 -1.039 11.679 -8.966 137 HB THR 20 HB THR 20 -3.153 13.682 -9.755 138 HG1 THR 20 HG1 THR 20 -4.136 13.061 -7.726 139 HG21 THR 20 3HG2 THR 20 -3.298 10.725 -9.157 140 HG22 THR 20 1HG2 THR 20 -3.287 11.439 -10.769 141 HG23 THR 20 2HG2 THR 20 -4.634 11.752 -9.675 142 H GLU 21 H GLU 21 -0.122 10.919 -10.750 143 HA GLU 21 HA GLU 21 0.786 12.447 -12.896 144 HB2 GLU 21 1HB GLU 21 1.522 10.121 -12.289 145 HB3 GLU 21 2HB GLU 21 0.036 9.524 -13.013 146 HG2 GLU 21 1HG GLU 21 0.702 10.068 -15.156 147 HG3 GLU 21 2HG GLU 21 1.882 11.252 -14.598 148 H GLY 22 H GLY 22 -0.084 13.131 -14.775 149 HA2 GLY 22 1HA GLY 22 -2.896 12.380 -15.292 150 HA3 GLY 22 2HA GLY 22 -2.262 13.994 -15.574 151 H SER 23 H SER 23 -2.831 10.932 -16.909 152 HA SER 23 HA SER 23 -1.024 11.398 -19.165 153 HB2 SER 23 1HB SER 23 -1.375 9.116 -17.904 154 HB3 SER 23 2HB SER 23 -2.789 8.987 -18.949 155 HG SER 23 HG SER 23 -0.190 9.538 -19.930 156 H GLY 24 H GLY 24 -2.538 13.302 -19.609 157 HA2 GLY 24 1HA GLY 24 -4.706 12.359 -21.381 158 HA3 GLY 24 2HA GLY 24 -4.883 13.785 -20.369 159 H ALA 25 H ALA 25 -3.480 15.620 -20.814 160 HA ALA 25 HA ALA 25 -1.971 15.717 -23.243 161 HB1 ALA 25 1HB ALA 25 -4.639 15.957 -23.669 162 HB2 ALA 25 2HB ALA 25 -4.173 17.645 -23.453 163 HB3 ALA 25 3HB ALA 25 -3.393 16.667 -24.697 164 H GLU 26 H GLU 26 -0.589 17.429 -23.267 165 HA GLU 26 HA GLU 26 -0.298 18.936 -20.867 166 HB2 GLU 26 1HB GLU 26 1.673 18.287 -22.085 167 HB3 GLU 26 2HB GLU 26 1.103 19.101 -23.536 168 HG2 GLU 26 1HG GLU 26 1.277 21.258 -22.362 169 HG3 GLU 26 2HG GLU 26 1.925 20.415 -20.956 170 H ALA 27 H ALA 27 -0.875 20.982 -20.393 171 HA ALA 27 HA ALA 27 -2.943 22.251 -21.764 172 HB1 ALA 27 1HB ALA 27 -2.988 23.552 -19.960 173 HB2 ALA 27 2HB ALA 27 -1.614 22.624 -19.359 174 HB3 ALA 27 3HB ALA 27 -1.344 24.124 -20.245 175 H ARG 28 H ARG 28 -2.958 23.313 -23.624 176 HA ARG 28 HA ARG 28 -0.456 24.201 -24.808 177 HB2 ARG 28 1HB ARG 28 -3.278 23.975 -25.841 178 HB3 ARG 28 2HB ARG 28 -2.005 24.762 -26.765 179 HG2 ARG 28 1HG ARG 28 -1.518 22.018 -25.731 180 HG3 ARG 28 2HG ARG 28 -2.587 22.228 -27.120 181 HD2 ARG 28 1HD ARG 28 0.112 23.527 -27.044 182 HD3 ARG 28 2HD ARG 28 -0.063 21.839 -27.525 183 HE ARG 28 HE ARG 28 -0.672 24.121 -29.096 184 HH11 ARG 28 1HH1 ARG 28 -1.734 20.877 -28.410 185 HH12 ARG 28 2HH1 ARG 28 -2.459 20.646 -29.966 186 HH21 ARG 28 1HH2 ARG 28 -1.623 23.829 -31.148 187 HH22 ARG 28 2HH2 ARG 28 -2.394 22.325 -31.524 188 H ALA 29 H ALA 29 -0.350 26.345 -25.861 189 HA ALA 29 HA ALA 29 -1.395 28.382 -24.047 190 HB1 ALA 29 1HB ALA 29 0.227 29.705 -25.809 191 HB2 ALA 29 2HB ALA 29 0.732 29.040 -24.255 192 HB3 ALA 29 3HB ALA 29 0.973 28.108 -25.733 193 H GLY 30 H GLY 30 -2.448 30.273 -24.794 194 HA2 GLY 30 1HA GLY 30 -3.676 31.578 -26.276 195 HA3 GLY 30 2HA GLY 30 -3.268 30.453 -27.563 196 H GLN 31 H GLN 31 -4.321 28.519 -25.184 197 HA GLN 31 HA GLN 31 -7.119 28.672 -26.095 198 HB2 GLN 31 1HB GLN 31 -5.305 26.334 -25.647 199 HB3 GLN 31 2HB GLN 31 -7.039 26.134 -25.430 200 HG2 GLN 31 1HG GLN 31 -7.397 26.933 -27.727 201 HG3 GLN 31 2HG GLN 31 -5.651 27.055 -27.936 202 HE21 GLN 31 2HE2 GLN 31 -4.421 25.178 -28.081 203 HE22 GLN 31 1HE2 GLN 31 -5.132 23.639 -28.415 204 H THR 32 H THR 32 -8.754 28.076 -24.586 205 HA THR 32 HA THR 32 -8.088 28.852 -21.872 206 HB THR 32 HB THR 32 -10.814 28.070 -22.903 207 HG1 THR 32 HG1 THR 32 -10.709 29.825 -24.071 208 HG21 THR 32 3HG2 THR 32 -11.160 28.301 -20.672 209 HG22 THR 32 1HG2 THR 32 -11.224 30.012 -21.092 210 HG23 THR 32 2HG2 THR 32 -9.737 29.318 -20.447 211 H VAL 33 H VAL 33 -7.467 27.396 -20.428 212 HA VAL 33 HA VAL 33 -8.449 24.632 -20.684 213 HB VAL 33 HB VAL 33 -6.526 23.917 -19.408 214 HG11 VAL 33 1HG1 VAL 33 -6.429 25.024 -21.966 215 HG12 VAL 33 2HG1 VAL 33 -4.974 25.607 -21.154 216 HG13 VAL 33 3HG1 VAL 33 -5.293 23.876 -21.259 217 HG21 VAL 33 3HG2 VAL 33 -4.811 26.056 -19.201 218 HG22 VAL 33 1HG2 VAL 33 -6.369 26.752 -18.754 219 HG23 VAL 33 2HG2 VAL 33 -5.746 25.352 -17.881 220 H SER 34 H SER 34 -9.455 23.628 -19.001 221 HA SER 34 HA SER 34 -10.264 25.355 -16.776 222 HB2 SER 34 1HB SER 34 -11.781 23.093 -16.521 223 HB3 SER 34 2HB SER 34 -12.265 24.523 -17.432 224 HG SER 34 HG SER 34 -10.847 22.326 -18.535 225 H VAL 35 H VAL 35 -9.289 25.133 -14.886 226 HA VAL 35 HA VAL 35 -8.513 22.473 -13.958 227 HB VAL 35 HB VAL 35 -6.294 23.042 -13.393 228 HG11 VAL 35 1HG1 VAL 35 -6.695 24.303 -16.098 229 HG12 VAL 35 2HG1 VAL 35 -5.269 23.453 -15.501 230 HG13 VAL 35 3HG1 VAL 35 -6.760 22.564 -15.813 231 HG21 VAL 35 3HG2 VAL 35 -6.449 25.209 -12.508 232 HG22 VAL 35 1HG2 VAL 35 -5.421 25.384 -13.930 233 HG23 VAL 35 2HG2 VAL 35 -7.115 25.866 -14.002 234 H HIS 36 H HIS 36 -8.153 22.359 -11.661 235 HA HIS 36 HA HIS 36 -9.689 24.398 -10.221 236 HB2 HIS 36 1HB HIS 36 -9.224 21.496 -9.872 237 HB3 HIS 36 2HB HIS 36 -9.327 22.440 -8.390 238 HD1 HIS 36 HD1 HIS 36 -11.537 24.437 -9.357 239 HD2 HIS 36 HD2 HIS 36 -11.691 20.304 -9.758 240 HE1 HIS 36 HE1 HIS 36 -13.980 23.871 -9.554 241 H TYR 37 H TYR 37 -8.798 25.694 -8.731 242 HA TYR 37 HA TYR 37 -5.994 25.185 -7.977 243 HB2 TYR 37 1HB TYR 37 -5.626 27.579 -7.914 244 HB3 TYR 37 2HB TYR 37 -6.275 27.135 -9.489 245 HD1 TYR 37 HD2 TYR 37 -7.127 28.668 -6.232 246 HD2 TYR 37 HD1 TYR 37 -8.325 28.037 -10.266 247 HE1 TYR 37 HE2 TYR 37 -8.920 30.329 -5.954 248 HE2 TYR 37 HE1 TYR 37 -10.120 29.697 -9.999 249 HH TYR 37 HH TYR 37 -10.345 31.725 -7.195 250 H THR 38 H THR 38 -5.408 25.438 -5.859 251 HA THR 38 HA THR 38 -7.488 26.264 -3.953 252 HB THR 38 HB THR 38 -5.954 24.219 -2.715 253 HG1 THR 38 HG1 THR 38 -7.005 23.524 -5.270 254 HG21 THR 38 3HG2 THR 38 -8.381 23.106 -3.027 255 HG22 THR 38 1HG2 THR 38 -8.779 24.786 -3.384 256 HG23 THR 38 2HG2 THR 38 -8.042 24.363 -1.838 257 H GLY 39 H GLY 39 -6.738 27.872 -2.747 258 HA2 GLY 39 1HA GLY 39 -3.863 28.286 -2.510 259 HA3 GLY 39 2HA GLY 39 -5.121 29.415 -2.031 260 H TRP 40 H TRP 40 -2.692 27.724 -0.807 261 HA TRP 40 HA TRP 40 -4.057 27.349 1.774 262 HB2 TRP 40 1HB TRP 40 -2.138 25.511 0.373 263 HB3 TRP 40 2HB TRP 40 -2.268 25.499 2.129 264 HD1 TRP 40 HD1 TRP 40 -5.377 25.721 2.492 265 HE1 TRP 40 HE1 TRP 40 -6.909 23.775 1.790 266 HE3 TRP 40 HE3 TRP 40 -2.256 23.381 -0.813 267 HZ2 TRP 40 HZ2 TRP 40 -6.808 21.544 0.065 268 HZ3 TRP 40 HZ3 TRP 40 -3.050 21.346 -1.946 269 HH2 TRP 40 HH2 TRP 40 -5.279 20.448 -1.515 270 H LEU 41 H LEU 41 -3.076 28.234 3.507 271 HA LEU 41 HA LEU 41 -0.919 30.046 3.097 272 HB2 LEU 41 1HB LEU 41 -2.763 29.343 5.240 273 HB3 LEU 41 2HB LEU 41 -1.149 29.741 5.827 274 HG LEU 41 HG LEU 41 -2.879 31.526 4.115 275 HD11 LEU 41 1HD1 LEU 41 -3.889 31.486 6.226 276 HD12 LEU 41 2HD1 LEU 41 -2.851 32.911 6.256 277 HD13 LEU 41 3HD1 LEU 41 -2.339 31.430 7.066 278 HD21 LEU 41 3HD2 LEU 41 -1.138 32.904 3.884 279 HD22 LEU 41 1HD2 LEU 41 -0.139 31.526 4.348 280 HD23 LEU 41 2HD2 LEU 41 -0.642 32.700 5.564 281 H THR 42 H THR 42 0.845 29.983 4.999 282 HA THR 42 HA THR 42 2.590 27.871 4.336 283 HB THR 42 HB THR 42 4.049 28.740 6.127 284 HG1 THR 42 HG1 THR 42 1.683 30.113 6.802 285 HG21 THR 42 3HG2 THR 42 2.763 30.704 4.248 286 HG22 THR 42 1HG2 THR 42 4.304 29.865 4.075 287 HG23 THR 42 2HG2 THR 42 4.128 31.148 5.272 288 H ASP 43 H ASP 43 0.199 28.237 6.817 289 HA ASP 43 HA ASP 43 1.209 25.951 8.321 290 HB2 ASP 43 1HB ASP 43 -0.325 26.531 10.018 291 HB3 ASP 43 2HB ASP 43 0.262 28.072 9.400 292 H GLY 44 H GLY 44 -1.088 26.692 5.885 293 HA2 GLY 44 1HA GLY 44 -1.898 24.732 4.627 294 HA3 GLY 44 2HA GLY 44 -2.241 23.986 6.181 295 H GLN 45 H GLN 45 -2.976 27.223 6.371 296 HA GLN 45 HA GLN 45 -5.773 26.726 6.525 297 HB2 GLN 45 1HB GLN 45 -3.985 29.066 6.870 298 HB3 GLN 45 2HB GLN 45 -5.664 29.413 6.479 299 HG2 GLN 45 1HG GLN 45 -5.091 27.481 8.662 300 HG3 GLN 45 2HG GLN 45 -4.841 29.200 8.965 301 HE21 GLN 45 2HE2 GLN 45 -7.154 26.701 8.353 302 HE22 GLN 45 1HE2 GLN 45 -8.566 27.633 8.701 303 H LYS 46 H LYS 46 -7.197 26.654 4.930 304 HA LYS 46 HA LYS 46 -6.463 27.350 2.247 305 HB2 LYS 46 1HB LYS 46 -7.955 25.424 2.888 306 HB3 LYS 46 2HB LYS 46 -9.202 26.602 3.277 307 HG2 LYS 46 1HG LYS 46 -9.555 27.160 1.076 308 HG3 LYS 46 2HG LYS 46 -7.941 26.648 0.576 309 HD2 LYS 46 1HD LYS 46 -9.544 25.073 -0.273 310 HD3 LYS 46 2HD LYS 46 -8.617 24.294 1.011 311 HE2 LYS 46 1HE LYS 46 -10.402 24.180 2.415 312 HE3 LYS 46 2HE LYS 46 -11.119 25.668 1.800 313 HZ1 LYS 46 3HZ LYS 46 -11.142 23.745 -0.242 314 HZ2 LYS 46 1HZ LYS 46 -12.459 24.470 0.535 315 HZ3 LYS 46 2HZ LYS 46 -11.795 23.042 1.151 316 H PHE 47 H PHE 47 -6.681 29.260 1.297 317 HA PHE 47 HA PHE 47 -8.640 31.163 2.404 318 HB2 PHE 47 1HB PHE 47 -7.068 32.973 1.682 319 HB3 PHE 47 2HB PHE 47 -6.439 31.953 2.972 320 HD1 PHE 47 HD2 PHE 47 -6.347 32.410 -0.713 321 HD2 PHE 47 HD1 PHE 47 -4.364 30.942 2.756 322 HE1 PHE 47 HE2 PHE 47 -4.336 31.959 -2.057 323 HE2 PHE 47 HE1 PHE 47 -2.350 30.490 1.417 324 HZ PHE 47 HZ PHE 47 -2.334 30.997 -0.993 325 H ASP 48 H ASP 48 -8.455 29.174 0.022 326 HA ASP 48 HA ASP 48 -10.124 30.592 -1.727 327 HB2 ASP 48 1HB ASP 48 -7.644 31.517 -2.110 328 HB3 ASP 48 2HB ASP 48 -7.558 30.099 -3.152 329 H SER 49 H SER 49 -11.341 29.080 -2.634 330 HA SER 49 HA SER 49 -10.110 26.571 -3.511 331 HB2 SER 49 1HB SER 49 -11.124 26.332 -1.184 332 HB3 SER 49 2HB SER 49 -12.693 26.585 -1.947 333 HG SER 49 HG SER 49 -11.030 24.670 -3.087 334 H SER 50 H SER 50 -10.478 26.645 -5.634 335 HA SER 50 HA SER 50 -12.519 28.019 -6.933 336 HB2 SER 50 1HB SER 50 -11.991 26.443 -8.871 337 HB3 SER 50 2HB SER 50 -10.635 27.365 -8.224 338 HG SER 50 HG SER 50 -9.931 25.550 -7.151 339 H LYS 51 H LYS 51 -12.550 24.944 -5.365 340 HA LYS 51 HA LYS 51 -14.694 23.701 -6.659 341 HB2 LYS 51 1HB LYS 51 -13.920 23.524 -3.741 342 HB3 LYS 51 2HB LYS 51 -14.947 22.384 -4.601 343 HG2 LYS 51 1HG LYS 51 -12.082 22.944 -5.330 344 HG3 LYS 51 2HG LYS 51 -12.600 21.627 -4.275 345 HD2 LYS 51 1HD LYS 51 -13.971 21.833 -6.885 346 HD3 LYS 51 2HD LYS 51 -12.271 21.361 -6.931 347 HE2 LYS 51 1HE LYS 51 -12.673 19.478 -5.537 348 HE3 LYS 51 2HE LYS 51 -14.302 20.031 -5.150 349 HZ1 LYS 51 3HZ LYS 51 -13.385 18.504 -7.389 350 HZ2 LYS 51 1HZ LYS 51 -14.295 19.848 -7.867 351 HZ3 LYS 51 2HZ LYS 51 -14.957 18.715 -6.800 352 H ASP 52 H ASP 52 -14.619 26.411 -4.553 353 HA ASP 52 HA ASP 52 -17.114 26.338 -3.348 354 HB2 ASP 52 1HB ASP 52 -15.117 28.096 -3.273 355 HB3 ASP 52 2HB ASP 52 -16.149 28.947 -4.419 356 H ARG 53 H ARG 53 -16.230 27.587 -6.552 357 HA ARG 53 HA ARG 53 -18.897 28.359 -7.220 358 HB2 ARG 53 1HB ARG 53 -16.456 28.971 -8.232 359 HB3 ARG 53 2HB ARG 53 -17.006 27.793 -9.417 360 HG2 ARG 53 1HG ARG 53 -17.578 30.012 -10.148 361 HG3 ARG 53 2HG ARG 53 -19.051 29.123 -9.752 362 HD2 ARG 53 1HD ARG 53 -19.271 30.271 -7.672 363 HD3 ARG 53 2HD ARG 53 -17.674 30.999 -7.841 364 HE ARG 53 HE ARG 53 -19.033 31.882 -10.025 365 HH11 ARG 53 1HH1 ARG 53 -19.625 31.952 -6.595 366 HH12 ARG 53 2HH1 ARG 53 -20.526 33.431 -6.648 367 HH21 ARG 53 1HH2 ARG 53 -20.217 33.830 -10.108 368 HH22 ARG 53 2HH2 ARG 53 -20.862 34.498 -8.647 369 H ASN 54 H ASN 54 -17.433 25.376 -6.950 370 HA ASN 54 HA ASN 54 -18.068 23.263 -7.503 371 HB2 ASN 54 1HB ASN 54 -20.619 24.460 -8.588 372 HB3 ASN 54 2HB ASN 54 -20.368 22.826 -7.980 373 HD21 ASN 54 2HD2 ASN 54 -19.434 22.866 -5.644 374 HD22 ASN 54 1HD2 ASN 54 -20.288 23.890 -4.545 375 H ASP 55 H ASP 55 -16.918 25.282 -9.504 376 HA ASP 55 HA ASP 55 -17.121 23.496 -11.803 377 HB2 ASP 55 1HB ASP 55 -17.711 25.147 -13.363 378 HB3 ASP 55 2HB ASP 55 -18.775 25.463 -11.996 379 HA PRO 56 HA PRO 56 -12.793 24.173 -12.087 380 HB2 PRO 56 1HB PRO 56 -12.391 23.776 -14.743 381 HB3 PRO 56 2HB PRO 56 -12.755 22.461 -13.619 382 HG2 PRO 56 1HG PRO 56 -14.586 23.916 -15.487 383 HG3 PRO 56 2HG PRO 56 -14.486 22.179 -15.146 384 HD2 PRO 56 1HD PRO 56 -16.374 23.774 -14.041 385 HD3 PRO 56 2HD PRO 56 -15.702 22.364 -13.197 386 H PHE 57 H PHE 57 -11.213 25.658 -12.757 387 HA PHE 57 HA PHE 57 -12.280 28.229 -13.581 388 HB2 PHE 57 1HB PHE 57 -10.741 28.168 -11.689 389 HB3 PHE 57 2HB PHE 57 -9.504 27.419 -12.693 390 HD1 PHE 57 HD2 PHE 57 -11.768 30.319 -13.287 391 HD2 PHE 57 HD1 PHE 57 -7.769 28.907 -12.931 392 HE1 PHE 57 HE2 PHE 57 -10.930 32.547 -13.908 393 HE2 PHE 57 HE1 PHE 57 -6.924 31.133 -13.551 394 HZ PHE 57 HZ PHE 57 -8.505 32.956 -14.042 395 H ALA 58 H ALA 58 -12.564 28.452 -15.714 396 HA ALA 58 HA ALA 58 -10.642 27.304 -17.581 397 HB1 ALA 58 1HB ALA 58 -12.948 28.912 -18.532 398 HB2 ALA 58 2HB ALA 58 -12.260 27.421 -19.179 399 HB3 ALA 58 3HB ALA 58 -13.287 27.369 -17.746 400 H PHE 59 H PHE 59 -8.884 28.464 -18.004 401 HA PHE 59 HA PHE 59 -9.207 31.310 -18.631 402 HB2 PHE 59 1HB PHE 59 -7.331 31.970 -17.325 403 HB3 PHE 59 2HB PHE 59 -8.336 30.979 -16.272 404 HD1 PHE 59 HD2 PHE 59 -7.640 28.705 -15.674 405 HD2 PHE 59 HD1 PHE 59 -5.148 31.272 -17.979 406 HE1 PHE 59 HE2 PHE 59 -5.712 27.253 -15.200 407 HE2 PHE 59 HE1 PHE 59 -3.215 29.823 -17.510 408 HZ PHE 59 HZ PHE 59 -3.496 27.811 -16.118 409 H VAL 60 H VAL 60 -7.624 32.165 -20.059 410 HA VAL 60 HA VAL 60 -6.645 30.220 -21.947 411 HB VAL 60 HB VAL 60 -6.353 33.228 -21.931 412 HG11 VAL 60 1HG1 VAL 60 -4.706 32.640 -23.395 413 HG12 VAL 60 2HG1 VAL 60 -5.474 31.109 -23.820 414 HG13 VAL 60 3HG1 VAL 60 -6.086 32.621 -24.492 415 HG21 VAL 60 3HG2 VAL 60 -8.689 32.393 -22.044 416 HG22 VAL 60 1HG2 VAL 60 -8.183 33.259 -23.495 417 HG23 VAL 60 2HG2 VAL 60 -8.261 31.497 -23.501 418 H LEU 61 H LEU 61 -4.712 29.300 -21.881 419 HA LEU 61 HA LEU 61 -2.723 30.098 -19.995 420 HB2 LEU 61 1HB LEU 61 -2.807 27.807 -20.387 421 HB3 LEU 61 2HB LEU 61 -2.893 28.013 -22.135 422 HG LEU 61 HG LEU 61 -0.556 28.544 -22.249 423 HD11 LEU 61 1HD1 LEU 61 0.362 29.618 -20.532 424 HD12 LEU 61 2HD1 LEU 61 0.492 28.051 -19.733 425 HD13 LEU 61 3HD1 LEU 61 -0.904 29.083 -19.426 426 HD21 LEU 61 3HD2 LEU 61 0.024 26.395 -22.185 427 HD22 LEU 61 1HD2 LEU 61 -1.574 26.079 -21.510 428 HD23 LEU 61 2HD2 LEU 61 -0.194 26.310 -20.437 429 H GLY 62 H GLY 62 -1.021 31.407 -20.249 430 HA2 GLY 62 1HA GLY 62 0.640 32.635 -21.287 431 HA3 GLY 62 2HA GLY 62 0.208 31.861 -22.805 432 H GLY 63 H GLY 63 -1.812 33.803 -20.625 433 HA2 GLY 63 1HA GLY 63 -1.958 35.871 -22.717 434 HA3 GLY 63 2HA GLY 63 -3.436 35.182 -22.063 435 H GLY 64 H GLY 64 -2.975 35.055 -19.399 436 HA2 GLY 64 1HA GLY 64 -1.739 36.945 -17.957 437 HA3 GLY 64 2HA GLY 64 -3.042 37.870 -18.688 438 H MET 65 H MET 65 -3.633 38.218 -16.405 439 HA MET 65 HA MET 65 -5.005 37.862 -14.627 440 HB2 MET 65 1HB MET 65 -6.169 36.152 -16.762 441 HB3 MET 65 2HB MET 65 -6.739 35.888 -15.120 442 HG2 MET 65 1HG MET 65 -7.167 38.392 -15.036 443 HG3 MET 65 2HG MET 65 -6.931 38.375 -16.782 444 HE1 MET 65 3HE MET 65 -9.867 37.807 -18.285 445 HE2 MET 65 1HE MET 65 -8.123 37.557 -18.368 446 HE3 MET 65 2HE MET 65 -9.207 36.172 -18.242 447 H VAL 66 H VAL 66 -2.496 36.235 -15.059 448 HA VAL 66 HA VAL 66 -2.976 34.376 -12.859 449 HB VAL 66 HB VAL 66 -1.843 32.528 -13.927 450 HG11 VAL 66 1HG1 VAL 66 -4.352 33.061 -14.313 451 HG12 VAL 66 2HG1 VAL 66 -3.848 33.390 -15.972 452 HG13 VAL 66 3HG1 VAL 66 -3.581 31.794 -15.267 453 HG21 VAL 66 3HG2 VAL 66 -1.320 32.664 -16.382 454 HG22 VAL 66 1HG2 VAL 66 -1.559 34.407 -16.262 455 HG23 VAL 66 2HG2 VAL 66 -0.275 33.628 -15.339 456 H ILE 67 H ILE 67 -0.761 33.335 -12.234 457 HA ILE 67 HA ILE 67 1.207 35.522 -12.175 458 HB ILE 67 HB ILE 67 1.996 34.715 -10.095 459 HG12 ILE 67 1HG1 ILE 67 0.266 32.281 -10.577 460 HG13 ILE 67 2HG1 ILE 67 2.025 32.332 -10.568 461 HG21 ILE 67 1HG2 ILE 67 -0.740 34.156 -9.346 462 HG22 ILE 67 2HG2 ILE 67 0.279 35.539 -8.947 463 HG23 ILE 67 3HG2 ILE 67 -0.634 35.523 -10.455 464 HD11 ILE 67 3HD1 ILE 67 1.966 32.946 -8.188 465 HD12 ILE 67 1HD1 ILE 67 0.209 32.802 -8.217 466 HD13 ILE 67 2HD1 ILE 67 1.214 31.383 -8.512 467 H LYS 68 H LYS 68 3.512 34.784 -11.941 468 HA LYS 68 HA LYS 68 4.395 33.437 -14.161 469 HB2 LYS 68 1HB LYS 68 5.624 34.045 -11.510 470 HB3 LYS 68 2HB LYS 68 6.481 32.961 -12.598 471 HG2 LYS 68 1HG LYS 68 6.824 34.611 -14.183 472 HG3 LYS 68 2HG LYS 68 5.501 35.610 -13.576 473 HD2 LYS 68 1HD LYS 68 7.826 35.058 -11.793 474 HD3 LYS 68 2HD LYS 68 8.012 36.238 -13.093 475 HE2 LYS 68 1HE LYS 68 5.861 36.294 -10.978 476 HE3 LYS 68 2HE LYS 68 7.327 37.271 -10.962 477 HZ1 LYS 68 3HZ LYS 68 6.152 37.673 -13.432 478 HZ2 LYS 68 1HZ LYS 68 6.230 38.768 -12.144 479 HZ3 LYS 68 2HZ LYS 68 4.888 37.751 -12.310 480 H GLY 69 H GLY 69 4.194 32.075 -10.865 481 HA2 GLY 69 1HA GLY 69 4.952 29.474 -11.479 482 HA3 GLY 69 2HA GLY 69 3.894 29.916 -10.147 483 H TRP 70 H TRP 70 1.909 31.072 -12.041 484 HA TRP 70 HA TRP 70 0.361 28.710 -12.408 485 HB2 TRP 70 1HB TRP 70 -0.094 31.523 -12.413 486 HB3 TRP 70 2HB TRP 70 -0.732 30.868 -13.918 487 HD1 TRP 70 HD1 TRP 70 -3.106 29.916 -13.780 488 HE1 TRP 70 HE1 TRP 70 -4.685 29.175 -11.887 489 HE3 TRP 70 HE3 TRP 70 0.094 30.392 -9.821 490 HZ2 TRP 70 HZ2 TRP 70 -4.587 28.838 -9.087 491 HZ3 TRP 70 HZ3 TRP 70 -0.728 29.840 -7.568 492 HH2 TRP 70 HH2 TRP 70 -3.020 29.080 -7.211 493 H ASP 71 H ASP 71 1.581 31.095 -14.768 494 HA ASP 71 HA ASP 71 0.913 29.715 -17.076 495 HB2 ASP 71 1HB ASP 71 3.115 31.673 -16.462 496 HB3 ASP 71 2HB ASP 71 2.929 30.981 -18.072 497 H GLU 72 H GLU 72 3.924 29.563 -15.197 498 HA GLU 72 HA GLU 72 5.241 27.720 -16.876 499 HB2 GLU 72 1HB GLU 72 5.870 29.150 -14.569 500 HB3 GLU 72 2HB GLU 72 5.983 27.465 -14.079 501 HG2 GLU 72 1HG GLU 72 7.353 28.551 -16.521 502 HG3 GLU 72 2HG GLU 72 8.102 28.521 -14.926 503 H GLY 73 H GLY 73 3.214 27.290 -14.003 504 HA2 GLY 73 1HA GLY 73 3.559 24.531 -13.677 505 HA3 GLY 73 2HA GLY 73 2.146 25.441 -13.162 506 H VAL 74 H VAL 74 0.828 26.185 -15.273 507 HA VAL 74 HA VAL 74 -0.287 23.802 -16.311 508 HB VAL 74 HB VAL 74 -1.575 25.351 -17.825 509 HG11 VAL 74 1HG1 VAL 74 -1.925 26.556 -15.175 510 HG12 VAL 74 2HG1 VAL 74 -3.067 25.656 -16.175 511 HG13 VAL 74 3HG1 VAL 74 -1.892 24.793 -15.180 512 HG21 VAL 74 3HG2 VAL 74 -1.036 27.505 -18.076 513 HG22 VAL 74 1HG2 VAL 74 -0.806 27.734 -16.343 514 HG23 VAL 74 2HG2 VAL 74 0.506 27.091 -17.330 515 H GLN 75 H GLN 75 2.210 25.931 -17.432 516 HA GLN 75 HA GLN 75 2.208 25.478 -20.159 517 HB2 GLN 75 1HB GLN 75 4.157 26.338 -18.160 518 HB3 GLN 75 2HB GLN 75 4.897 25.500 -19.518 519 HG2 GLN 75 1HG GLN 75 2.978 27.786 -19.855 520 HG3 GLN 75 2HG GLN 75 4.722 28.000 -19.717 521 HE21 GLN 75 2HE2 GLN 75 3.009 28.676 -21.934 522 HE22 GLN 75 1HE2 GLN 75 3.579 27.778 -23.295 523 H GLY 76 H GLY 76 3.099 23.337 -17.571 524 HA2 GLY 76 1HA GLY 76 3.900 21.321 -19.580 525 HA3 GLY 76 2HA GLY 76 4.623 21.418 -17.981 526 H MET 77 H MET 77 1.815 22.089 -16.953 527 HA MET 77 HA MET 77 1.147 19.625 -15.914 528 HB2 MET 77 1HB MET 77 0.275 21.784 -15.085 529 HB3 MET 77 2HB MET 77 -0.754 21.901 -16.506 530 HG2 MET 77 1HG MET 77 -2.020 21.137 -14.594 531 HG3 MET 77 2HG MET 77 -1.934 19.879 -15.824 532 HE1 MET 77 3HE MET 77 -2.445 20.060 -12.443 533 HE2 MET 77 1HE MET 77 -1.116 19.345 -11.529 534 HE3 MET 77 2HE MET 77 -0.952 20.967 -12.201 535 H LYS 78 H LYS 78 -0.562 18.143 -16.356 536 HA LYS 78 HA LYS 78 -1.445 18.122 -19.167 537 HB2 LYS 78 1HB LYS 78 -0.580 15.752 -17.500 538 HB3 LYS 78 2HB LYS 78 -1.252 15.657 -19.122 539 HG2 LYS 78 1HG LYS 78 0.669 17.016 -19.929 540 HG3 LYS 78 2HG LYS 78 1.362 16.907 -18.309 541 HD2 LYS 78 1HD LYS 78 0.976 14.327 -18.687 542 HD3 LYS 78 2HD LYS 78 1.034 14.797 -20.387 543 HE2 LYS 78 1HE LYS 78 3.183 16.120 -19.494 544 HE3 LYS 78 2HE LYS 78 3.168 14.790 -18.337 545 HZ1 LYS 78 3HZ LYS 78 2.741 13.685 -20.847 546 HZ2 LYS 78 1HZ LYS 78 4.118 13.539 -19.876 547 HZ3 LYS 78 2HZ LYS 78 4.020 14.778 -21.023 548 H VAL 79 H VAL 79 -3.485 17.200 -19.590 549 HA VAL 79 HA VAL 79 -5.522 17.800 -17.826 550 HB VAL 79 HB VAL 79 -5.587 15.694 -19.991 551 HG11 VAL 79 1HG1 VAL 79 -8.078 16.714 -19.913 552 HG12 VAL 79 2HG1 VAL 79 -7.583 15.273 -19.022 553 HG13 VAL 79 3HG1 VAL 79 -7.639 16.839 -18.210 554 HG21 VAL 79 3HG2 VAL 79 -5.374 18.565 -20.096 555 HG22 VAL 79 1HG2 VAL 79 -5.329 17.388 -21.409 556 HG23 VAL 79 2HG2 VAL 79 -6.875 18.022 -20.846 557 H GLY 80 H GLY 80 -6.317 16.879 -16.049 558 HA2 GLY 80 1HA GLY 80 -6.989 15.167 -14.617 559 HA3 GLY 80 2HA GLY 80 -6.203 14.006 -15.677 560 H GLY 81 H GLY 81 -3.999 16.389 -15.175 561 HA2 GLY 81 1HA GLY 81 -2.611 14.765 -13.180 562 HA3 GLY 81 2HA GLY 81 -1.896 16.027 -14.172 563 H VAL 82 H VAL 82 -2.160 15.382 -11.150 564 HA VAL 82 HA VAL 82 -2.948 18.110 -10.352 565 HB VAL 82 HB VAL 82 -3.135 15.629 -8.639 566 HG11 VAL 82 1HG1 VAL 82 -2.889 17.346 -7.129 567 HG12 VAL 82 2HG1 VAL 82 -3.672 18.528 -8.180 568 HG13 VAL 82 3HG1 VAL 82 -4.640 17.321 -7.332 569 HG21 VAL 82 3HG2 VAL 82 -5.677 16.753 -9.072 570 HG22 VAL 82 1HG2 VAL 82 -4.907 16.631 -10.654 571 HG23 VAL 82 2HG2 VAL 82 -5.072 15.197 -9.641 572 H ARG 83 H ARG 83 -1.418 19.302 -9.419 573 HA ARG 83 HA ARG 83 0.753 18.027 -7.954 574 HB2 ARG 83 1HB ARG 83 2.510 18.938 -9.212 575 HB3 ARG 83 2HB ARG 83 1.392 18.321 -10.421 576 HG2 ARG 83 1HG ARG 83 0.483 20.618 -10.672 577 HG3 ARG 83 2HG ARG 83 1.742 21.187 -9.574 578 HD2 ARG 83 1HD ARG 83 2.319 21.488 -11.962 579 HD3 ARG 83 2HD ARG 83 3.462 20.464 -11.094 580 HE ARG 83 HE ARG 83 1.500 18.849 -12.293 581 HH11 ARG 83 1HH1 ARG 83 4.201 20.875 -13.142 582 HH12 ARG 83 2HH1 ARG 83 4.571 19.999 -14.590 583 HH21 ARG 83 1HH2 ARG 83 1.977 17.687 -14.197 584 HH22 ARG 83 2HH2 ARG 83 3.305 18.186 -15.190 585 H ARG 84 H ARG 84 1.610 19.290 -6.348 586 HA ARG 84 HA ARG 84 0.113 21.689 -5.697 587 HB2 ARG 84 1HB ARG 84 0.687 19.856 -4.032 588 HB3 ARG 84 2HB ARG 84 2.344 20.442 -4.095 589 HG2 ARG 84 1HG ARG 84 1.827 22.420 -3.027 590 HG3 ARG 84 2HG ARG 84 0.121 22.334 -3.472 591 HD2 ARG 84 1HD ARG 84 0.150 21.833 -1.188 592 HD3 ARG 84 2HD ARG 84 0.026 20.261 -1.978 593 HE ARG 84 HE ARG 84 2.714 20.684 -1.622 594 HH11 ARG 84 1HH1 ARG 84 -0.092 20.529 0.434 595 HH12 ARG 84 2HH1 ARG 84 0.783 19.929 1.803 596 HH21 ARG 84 1HH2 ARG 84 3.877 19.894 0.175 597 HH22 ARG 84 2HH2 ARG 84 3.041 19.569 1.655 598 H LEU 85 H LEU 85 0.767 23.465 -6.754 599 HA LEU 85 HA LEU 85 3.576 23.924 -7.307 600 HB2 LEU 85 1HB LEU 85 1.866 24.460 -8.982 601 HB3 LEU 85 2HB LEU 85 1.157 25.634 -7.874 602 HG LEU 85 HG LEU 85 3.713 26.546 -8.044 603 HD11 LEU 85 1HD1 LEU 85 3.011 25.590 -10.811 604 HD12 LEU 85 2HD1 LEU 85 4.200 24.811 -9.767 605 HD13 LEU 85 3HD1 LEU 85 4.456 26.469 -10.311 606 HD21 LEU 85 3HD2 LEU 85 1.899 27.472 -10.179 607 HD22 LEU 85 1HD2 LEU 85 2.735 28.382 -8.920 608 HD23 LEU 85 2HD2 LEU 85 1.252 27.506 -8.538 609 H THR 86 H THR 86 4.900 25.011 -6.021 610 HA THR 86 HA THR 86 3.752 26.600 -3.835 611 HB THR 86 HB THR 86 6.663 26.052 -3.870 612 HG1 THR 86 HG1 THR 86 6.406 23.907 -3.308 613 HG21 THR 86 3HG2 THR 86 5.004 25.341 -1.553 614 HG22 THR 86 1HG2 THR 86 4.896 27.032 -2.042 615 HG23 THR 86 2HG2 THR 86 6.463 26.327 -1.642 616 H ILE 87 H ILE 87 3.720 28.728 -4.073 617 HA ILE 87 HA ILE 87 5.722 29.985 -5.828 618 HB ILE 87 HB ILE 87 3.090 31.184 -4.973 619 HG12 ILE 87 1HG1 ILE 87 2.819 30.603 -7.635 620 HG13 ILE 87 2HG1 ILE 87 3.719 29.205 -7.058 621 HG21 ILE 87 1HG2 ILE 87 3.500 32.879 -6.500 622 HG22 ILE 87 2HG2 ILE 87 5.095 32.587 -5.808 623 HG23 ILE 87 3HG2 ILE 87 4.687 31.927 -7.392 624 HD11 ILE 87 3HD1 ILE 87 1.010 30.162 -6.215 625 HD12 ILE 87 1HD1 ILE 87 1.473 28.599 -6.887 626 HD13 ILE 87 2HD1 ILE 87 1.946 29.027 -5.243 627 HA PRO 88 HA PRO 88 7.455 31.841 -2.201 628 HB2 PRO 88 1HB PRO 88 9.052 33.632 -3.472 629 HB3 PRO 88 2HB PRO 88 9.428 31.907 -3.378 630 HG2 PRO 88 1HG PRO 88 8.191 33.457 -5.620 631 HG3 PRO 88 2HG PRO 88 9.439 32.199 -5.685 632 HD2 PRO 88 1HD PRO 88 6.839 31.700 -6.251 633 HD3 PRO 88 2HD PRO 88 7.904 30.489 -5.509 634 HA PRO 89 HA PRO 89 5.360 35.613 -1.352 635 HB2 PRO 89 1HB PRO 89 7.224 37.090 -0.044 636 HB3 PRO 89 2HB PRO 89 6.443 35.676 0.673 637 HG2 PRO 89 1HG PRO 89 9.132 35.900 -0.623 638 HG3 PRO 89 2HG PRO 89 8.673 35.046 0.861 639 HD2 PRO 89 1HD PRO 89 9.019 33.774 -1.504 640 HD3 PRO 89 2HD PRO 89 7.843 33.230 -0.291 641 H GLN 90 H GLN 90 7.958 35.568 -3.493 642 HA GLN 90 HA GLN 90 7.720 38.418 -4.136 643 HB2 GLN 90 1HB GLN 90 9.702 36.326 -5.043 644 HB3 GLN 90 2HB GLN 90 9.686 37.987 -5.622 645 HG2 GLN 90 1HG GLN 90 9.964 37.264 -2.720 646 HG3 GLN 90 2HG GLN 90 11.339 37.465 -3.805 647 HE21 GLN 90 2HE2 GLN 90 11.019 39.002 -1.534 648 HE22 GLN 90 1HE2 GLN 90 10.707 40.637 -1.995 649 H LEU 91 H LEU 91 7.346 35.205 -5.550 650 HA LEU 91 HA LEU 91 6.327 36.354 -8.030 651 HB2 LEU 91 1HB LEU 91 6.602 33.444 -7.312 652 HB3 LEU 91 2HB LEU 91 6.393 34.139 -8.918 653 HG LEU 91 HG LEU 91 8.843 34.491 -7.191 654 HD11 LEU 91 1HD1 LEU 91 9.117 32.997 -9.671 655 HD12 LEU 91 2HD1 LEU 91 8.064 32.202 -8.502 656 HD13 LEU 91 3HD1 LEU 91 9.715 32.630 -8.053 657 HD21 LEU 91 3HD2 LEU 91 7.986 36.117 -9.183 658 HD22 LEU 91 1HD2 LEU 91 8.948 34.950 -10.090 659 HD23 LEU 91 2HD2 LEU 91 9.680 35.857 -8.766 660 H GLY 92 H GLY 92 4.951 36.285 -5.276 661 HA2 GLY 92 1HA GLY 92 2.424 35.086 -6.232 662 HA3 GLY 92 2HA GLY 92 2.906 35.085 -4.542 663 H TYR 93 H TYR 93 2.369 36.777 -3.278 664 HA TYR 93 HA TYR 93 0.616 38.776 -4.418 665 HB2 TYR 93 1HB TYR 93 1.415 38.037 -1.614 666 HB3 TYR 93 2HB TYR 93 0.516 39.514 -1.943 667 HD1 TYR 93 HD2 TYR 93 -1.783 39.399 -2.812 668 HD2 TYR 93 HD1 TYR 93 0.366 35.880 -1.764 669 HE1 TYR 93 HE2 TYR 93 -3.887 38.126 -2.798 670 HE2 TYR 93 HE1 TYR 93 -1.732 34.596 -1.749 671 HH TYR 93 HH TYR 93 -4.416 35.445 -3.167 672 H GLY 94 H GLY 94 3.852 38.579 -3.096 673 HA2 GLY 94 1HA GLY 94 5.561 40.109 -3.723 674 HA3 GLY 94 2HA GLY 94 4.326 41.324 -4.017 675 H ALA 95 H ALA 95 5.400 42.866 -2.760 676 HA ALA 95 HA ALA 95 6.051 42.341 -0.010 677 HB1 ALA 95 1HB ALA 95 7.447 43.897 -1.100 678 HB2 ALA 95 2HB ALA 95 6.073 44.834 -1.689 679 HB3 ALA 95 3HB ALA 95 6.471 44.838 0.029 680 H ARG 96 H ARG 96 3.330 43.608 -1.760 681 HA ARG 96 HA ARG 96 2.068 45.025 0.315 682 HB2 ARG 96 1HB ARG 96 1.217 43.836 -2.275 683 HB3 ARG 96 2HB ARG 96 -0.045 44.239 -1.119 684 HG2 ARG 96 1HG ARG 96 2.044 46.167 -2.108 685 HG3 ARG 96 2HG ARG 96 0.409 46.031 -2.756 686 HD2 ARG 96 1HD ARG 96 1.199 46.812 0.046 687 HD3 ARG 96 2HD ARG 96 0.483 47.851 -1.185 688 HE ARG 96 HE ARG 96 -0.884 45.984 0.520 689 HH11 ARG 96 1HH1 ARG 96 -0.991 47.717 -2.498 690 HH12 ARG 96 2HH1 ARG 96 -2.718 47.655 -2.622 691 HH21 ARG 96 1HH2 ARG 96 -3.159 45.897 0.368 692 HH22 ARG 96 2HH2 ARG 96 -3.950 46.621 -0.991 693 H GLY 97 H GLY 97 1.276 41.766 -0.922 694 HA2 GLY 97 1HA GLY 97 0.542 39.886 0.184 695 HA3 GLY 97 2HA GLY 97 1.053 40.644 1.685 696 H ALA 98 H ALA 98 -1.307 39.071 1.291 697 HA ALA 98 HA ALA 98 -3.571 40.818 1.099 698 HB1 ALA 98 1HB ALA 98 -4.326 38.429 2.390 699 HB2 ALA 98 2HB ALA 98 -4.565 38.875 0.700 700 HB3 ALA 98 3HB ALA 98 -3.112 38.001 1.185 701 H GLY 99 H GLY 99 -5.008 41.411 2.766 702 HA2 GLY 99 1HA GLY 99 -3.710 42.070 5.236 703 HA3 GLY 99 2HA GLY 99 -5.378 42.422 4.809 704 H GLY 100 H GLY 100 -3.281 40.408 6.589 705 HA2 GLY 100 1HA GLY 100 -4.035 39.132 8.440 706 HA3 GLY 100 2HA GLY 100 -5.604 38.980 7.663 707 H VAL 101 H VAL 101 -4.296 38.254 5.082 708 HA VAL 101 HA VAL 101 -3.523 35.497 5.788 709 HB VAL 101 HB VAL 101 -4.853 36.217 3.191 710 HG11 VAL 101 1HG1 VAL 101 -4.950 33.620 4.696 711 HG12 VAL 101 2HG1 VAL 101 -5.266 33.917 2.986 712 HG13 VAL 101 3HG1 VAL 101 -3.620 34.020 3.610 713 HG21 VAL 101 3HG2 VAL 101 -6.072 35.986 5.867 714 HG22 VAL 101 1HG2 VAL 101 -6.634 36.841 4.431 715 HG23 VAL 101 2HG2 VAL 101 -6.875 35.100 4.571 716 H ILE 102 H ILE 102 -1.866 34.535 4.641 717 HA ILE 102 HA ILE 102 0.095 34.418 3.492 718 HB ILE 102 HB ILE 102 -1.307 36.411 1.710 719 HG12 ILE 102 1HG1 ILE 102 -1.071 34.045 0.341 720 HG13 ILE 102 2HG1 ILE 102 -1.326 33.485 1.990 721 HG21 ILE 102 1HG2 ILE 102 0.765 36.780 0.914 722 HG22 ILE 102 2HG2 ILE 102 1.418 35.310 1.637 723 HG23 ILE 102 3HG2 ILE 102 0.528 35.225 0.117 724 HD11 ILE 102 3HD1 ILE 102 -3.278 35.258 1.908 725 HD12 ILE 102 1HD1 ILE 102 -3.153 34.949 0.176 726 HD13 ILE 102 2HD1 ILE 102 -3.479 33.619 1.288 727 HA PRO 103 HA PRO 103 1.713 38.157 5.645 728 HB2 PRO 103 1HB PRO 103 3.683 36.815 6.943 729 HB3 PRO 103 2HB PRO 103 2.032 36.933 7.563 730 HG2 PRO 103 1HG PRO 103 3.339 34.691 6.071 731 HG3 PRO 103 2HG PRO 103 2.271 34.621 7.485 732 HD2 PRO 103 1HD PRO 103 1.395 34.126 4.971 733 HD3 PRO 103 2HD PRO 103 0.364 34.866 6.214 734 HA PRO 104 HA PRO 104 5.134 38.977 3.007 735 HB2 PRO 104 1HB PRO 104 6.842 40.321 4.634 736 HB3 PRO 104 2HB PRO 104 5.331 41.020 4.039 737 HG2 PRO 104 1HG PRO 104 5.924 39.770 6.694 738 HG3 PRO 104 2HG PRO 104 5.007 41.243 6.331 739 HD2 PRO 104 1HD PRO 104 3.807 38.880 6.884 740 HD3 PRO 104 2HD PRO 104 3.102 40.071 5.773 741 H ASN 105 H ASN 105 7.127 38.209 2.363 742 HA ASN 105 HA ASN 105 8.845 36.722 2.226 743 HB2 ASN 105 1HB ASN 105 9.024 37.388 5.172 744 HB3 ASN 105 2HB ASN 105 10.257 36.501 4.279 745 HD21 ASN 105 2HD2 ASN 105 9.749 39.343 5.565 746 HD22 ASN 105 1HD2 ASN 105 10.535 40.384 4.432 747 H ALA 106 H ALA 106 6.234 35.627 2.604 748 HA ALA 106 HA ALA 106 6.872 33.171 4.106 749 HB1 ALA 106 1HB ALA 106 4.219 34.509 3.620 750 HB2 ALA 106 2HB ALA 106 4.381 32.870 4.253 751 HB3 ALA 106 3HB ALA 106 5.030 34.235 5.162 752 H THR 107 H THR 107 5.869 31.183 3.248 753 HA THR 107 HA THR 107 6.067 31.152 0.327 754 HB THR 107 HB THR 107 6.110 28.865 2.306 755 HG1 THR 107 HG1 THR 107 7.987 30.354 2.137 756 HG21 THR 107 3HG2 THR 107 7.169 27.943 -0.051 757 HG22 THR 107 1HG2 THR 107 5.834 28.953 -0.605 758 HG23 THR 107 2HG2 THR 107 5.531 27.630 0.521 759 H LEU 108 H LEU 108 4.340 30.890 -0.929 760 HA LEU 108 HA LEU 108 1.772 30.283 0.335 761 HB2 LEU 108 1HB LEU 108 1.993 31.038 -2.531 762 HB3 LEU 108 2HB LEU 108 0.745 31.437 -1.352 763 HG LEU 108 HG LEU 108 3.469 32.711 -1.596 764 HD11 LEU 108 1HD1 LEU 108 0.722 33.883 -1.992 765 HD12 LEU 108 2HD1 LEU 108 1.785 33.359 -3.297 766 HD13 LEU 108 3HD1 LEU 108 2.271 34.687 -2.244 767 HD21 LEU 108 3HD2 LEU 108 2.538 34.265 0.159 768 HD22 LEU 108 1HD2 LEU 108 2.969 32.648 0.717 769 HD23 LEU 108 2HD2 LEU 108 1.278 33.062 0.437 770 H VAL 109 H VAL 109 0.894 28.337 0.167 771 HA VAL 109 HA VAL 109 1.965 26.465 -1.820 772 HB VAL 109 HB VAL 109 0.256 25.923 0.612 773 HG11 VAL 109 1HG1 VAL 109 1.523 23.582 -0.180 774 HG12 VAL 109 2HG1 VAL 109 -0.186 23.976 -0.374 775 HG13 VAL 109 3HG1 VAL 109 0.949 24.305 -1.683 776 HG21 VAL 109 3HG2 VAL 109 2.933 24.799 0.572 777 HG22 VAL 109 1HG2 VAL 109 2.943 26.561 0.505 778 HG23 VAL 109 2HG2 VAL 109 2.119 25.733 1.826 779 H PHE 110 H PHE 110 0.875 26.490 -3.679 780 HA PHE 110 HA PHE 110 -2.068 26.566 -3.564 781 HB2 PHE 110 1HB PHE 110 -0.141 27.707 -5.572 782 HB3 PHE 110 2HB PHE 110 -1.816 27.378 -6.004 783 HD1 PHE 110 HD1 PHE 110 0.427 29.473 -4.024 784 HD2 PHE 110 HD2 PHE 110 -3.621 28.690 -5.079 785 HE1 PHE 110 HE1 PHE 110 -0.235 31.648 -3.082 786 HE2 PHE 110 HE2 PHE 110 -4.290 30.863 -4.139 787 HZ PHE 110 HZ PHE 110 -2.596 32.346 -3.140 788 H GLU 111 H GLU 111 -3.177 24.929 -4.459 789 HA GLU 111 HA GLU 111 -1.619 22.815 -5.779 790 HB2 GLU 111 1HB GLU 111 -3.146 22.524 -3.620 791 HB3 GLU 111 2HB GLU 111 -4.406 22.347 -4.833 792 HG2 GLU 111 1HG GLU 111 -2.959 20.578 -5.899 793 HG3 GLU 111 2HG GLU 111 -1.958 20.652 -4.450 794 H VAL 112 H VAL 112 -1.876 22.492 -7.882 795 HA VAL 112 HA VAL 112 -4.340 23.483 -9.166 796 HB VAL 112 HB VAL 112 -1.604 23.335 -10.437 797 HG11 VAL 112 1HG1 VAL 112 -3.498 23.086 -11.987 798 HG12 VAL 112 2HG1 VAL 112 -4.158 24.616 -11.405 799 HG13 VAL 112 3HG1 VAL 112 -2.612 24.587 -12.253 800 HG21 VAL 112 3HG2 VAL 112 -1.129 25.265 -9.442 801 HG22 VAL 112 1HG2 VAL 112 -2.503 25.997 -10.271 802 HG23 VAL 112 2HG2 VAL 112 -2.713 25.294 -8.667 803 H GLU 113 H GLU 113 -5.485 22.061 -10.323 804 HA GLU 113 HA GLU 113 -4.191 19.564 -11.174 805 HB2 GLU 113 1HB GLU 113 -6.310 18.362 -10.558 806 HB3 GLU 113 2HB GLU 113 -5.370 18.948 -9.193 807 HG2 GLU 113 1HG GLU 113 -6.900 20.974 -9.205 808 HG3 GLU 113 2HG GLU 113 -7.927 20.053 -10.302 809 H LEU 114 H LEU 114 -4.386 19.336 -13.293 810 HA LEU 114 HA LEU 114 -6.074 20.952 -14.883 811 HB2 LEU 114 1HB LEU 114 -3.855 19.551 -15.381 812 HB3 LEU 114 2HB LEU 114 -5.046 18.401 -15.984 813 HG LEU 114 HG LEU 114 -4.314 19.652 -17.849 814 HD11 LEU 114 1HD1 LEU 114 -6.787 21.185 -17.251 815 HD12 LEU 114 2HD1 LEU 114 -6.884 19.425 -17.290 816 HD13 LEU 114 3HD1 LEU 114 -6.320 20.308 -18.709 817 HD21 LEU 114 3HD2 LEU 114 -4.969 22.316 -17.382 818 HD22 LEU 114 1HD2 LEU 114 -3.351 21.624 -17.496 819 HD23 LEU 114 2HD2 LEU 114 -4.127 21.794 -15.922 820 H LEU 115 H LEU 115 -8.122 20.696 -15.490 821 HA LEU 115 HA LEU 115 -9.424 18.120 -14.918 822 HB2 LEU 115 1HB LEU 115 -10.444 20.940 -14.979 823 HB3 LEU 115 2HB LEU 115 -11.540 19.564 -15.083 824 HG LEU 115 HG LEU 115 -9.728 19.335 -12.830 825 HD11 LEU 115 1HD1 LEU 115 -10.021 21.254 -11.711 826 HD12 LEU 115 2HD1 LEU 115 -11.682 21.446 -12.272 827 HD13 LEU 115 3HD1 LEU 115 -10.340 21.940 -13.305 828 HD21 LEU 115 3HD2 LEU 115 -12.734 19.496 -13.019 829 HD22 LEU 115 1HD2 LEU 115 -11.798 18.902 -11.647 830 HD23 LEU 115 2HD2 LEU 115 -11.779 18.021 -13.175 831 H ASP 116 H ASP 116 -8.965 20.614 -17.344 832 HA ASP 116 HA ASP 116 -9.291 18.845 -19.501 833 HB2 ASP 116 1HB ASP 116 -11.734 19.419 -18.495 834 HB3 ASP 116 2HB ASP 116 -11.551 20.753 -19.631 835 H VAL 117 H VAL 117 -9.424 20.060 -21.630 836 HA VAL 117 HA VAL 117 -8.083 22.672 -21.354 837 HB VAL 117 HB VAL 117 -7.642 20.596 -23.506 838 HG11 VAL 117 1HG1 VAL 117 -7.284 22.616 -24.584 839 HG12 VAL 117 2HG1 VAL 117 -6.654 23.396 -23.132 840 HG13 VAL 117 3HG1 VAL 117 -5.674 22.208 -23.993 841 HG21 VAL 117 3HG2 VAL 117 -6.692 20.128 -21.204 842 HG22 VAL 117 1HG2 VAL 117 -5.533 20.165 -22.533 843 HG23 VAL 117 2HG2 VAL 117 -5.669 21.544 -21.442 844 H11 L2S 130 1H1 L2S 130 -5.215 31.728 -9.299 845 H21 L2S 130 2H1 L2S 130 -5.039 32.295 -11.029 846 H12 L2S 130 1H2 L2S 130 -4.633 34.531 -10.269 847 H22 L2S 130 2H2 L2S 130 -3.410 33.387 -9.532 848 H13 L2S 130 2H3 L2S 130 -4.683 33.392 -7.485 849 H23 L2S 130 1H3 L2S 130 -4.333 35.123 -7.945 850 H14 L2S 130 1H4 L2S 130 -7.291 32.612 -7.995 851 H24 L2S 130 2H4 L2S 130 -8.229 33.939 -8.824 852 H15 L2S 130 1H5 L2S 130 -7.412 32.114 -10.356 853 H25 L2S 130 2H5 L2S 130 -6.868 33.820 -10.737 854 H17 L2S 130 1H7 L2S 130 -8.387 36.879 -6.930 855 H27 L2S 130 2H7 L2S 130 -8.664 35.787 -8.390 856 H9 L2S 130 H9 L2S 130 -10.696 36.569 -4.673 857 H10 L2S 130 H10 L2S 130 -10.166 37.765 -2.549 858 H112 L2S 130 1H12 L2S 130 -6.453 35.489 -2.203 859 H113 L2S 130 1H13 L2S 130 -6.973 34.342 -4.348 860 H114 L2S 130 1H14 L2S 130 -8.473 38.337 -1.049 861 H214 L2S 130 2H14 L2S 130 -6.899 37.508 -0.980 862 H314 L2S 130 3H14 L2S 130 -8.345 36.731 -0.249 Start of MODEL 8 1 H1 GLY 1 H GLY 1 10.477 10.419 1.696 2 HA2 GLY 1 1HA GLY 1 12.426 11.067 3.016 3 HA3 GLY 1 2HA GLY 1 12.738 9.356 3.271 4 HA PRO 2 HA PRO 2 15.345 9.139 -0.241 5 HB2 PRO 2 1HB PRO 2 14.558 6.885 -1.533 6 HB3 PRO 2 2HB PRO 2 15.418 6.856 0.011 7 HG2 PRO 2 1HG PRO 2 12.488 6.571 -0.530 8 HG3 PRO 2 2HG PRO 2 13.514 5.651 0.585 9 HD2 PRO 2 1HD PRO 2 11.898 7.660 1.413 10 HD3 PRO 2 2HD PRO 2 13.446 7.294 2.201 11 H GLY 3 H GLY 3 11.997 8.365 -1.217 12 HA2 GLY 3 1HA GLY 3 12.050 10.446 -3.217 13 HA3 GLY 3 2HA GLY 3 12.051 8.822 -3.888 14 H SER 4 H SER 4 10.371 10.189 -1.068 15 HA SER 4 HA SER 4 7.918 8.903 -1.885 16 HB2 SER 4 1HB SER 4 8.786 10.486 0.513 17 HB3 SER 4 2HB SER 4 7.071 10.190 0.227 18 HG SER 4 HG SER 4 7.813 8.518 1.470 19 H MET 5 H MET 5 9.213 12.171 -1.731 20 HA MET 5 HA MET 5 6.759 13.152 -3.032 21 HB2 MET 5 1HB MET 5 8.690 14.457 -1.144 22 HB3 MET 5 2HB MET 5 7.731 15.439 -2.243 23 HG2 MET 5 1HG MET 5 6.430 15.436 -0.356 24 HG3 MET 5 2HG MET 5 5.728 14.109 -1.277 25 HE1 MET 5 3HE MET 5 8.466 14.575 1.931 26 HE2 MET 5 1HE MET 5 6.955 15.457 1.704 27 HE3 MET 5 2HE MET 5 7.040 14.139 2.874 28 H THR 6 H THR 6 10.236 13.944 -2.866 29 HA THR 6 HA THR 6 11.751 14.471 -4.485 30 HB THR 6 HB THR 6 9.886 13.644 -6.673 31 HG1 THR 6 HG1 THR 6 10.177 11.505 -6.186 32 HG21 THR 6 3HG2 THR 6 12.593 14.281 -6.497 33 HG22 THR 6 1HG2 THR 6 11.772 13.531 -7.865 34 HG23 THR 6 2HG2 THR 6 12.554 12.524 -6.647 35 H VAL 7 H VAL 7 11.354 16.698 -3.937 36 HA VAL 7 HA VAL 7 9.581 18.189 -5.714 37 HB VAL 7 HB VAL 7 9.628 18.659 -3.250 38 HG11 VAL 7 1HG1 VAL 7 11.444 19.582 -2.180 39 HG12 VAL 7 2HG1 VAL 7 12.236 18.464 -3.292 40 HG13 VAL 7 3HG1 VAL 7 12.157 20.184 -3.677 41 HG21 VAL 7 3HG2 VAL 7 9.185 20.911 -3.539 42 HG22 VAL 7 1HG2 VAL 7 10.486 21.122 -4.711 43 HG23 VAL 7 2HG2 VAL 7 9.004 20.290 -5.179 44 H VAL 8 H VAL 8 10.321 20.023 -6.907 45 HA VAL 8 HA VAL 8 13.193 20.289 -7.323 46 HB VAL 8 HB VAL 8 12.597 18.595 -8.957 47 HG11 VAL 8 1HG1 VAL 8 10.625 20.568 -10.097 48 HG12 VAL 8 2HG1 VAL 8 10.932 18.921 -10.649 49 HG13 VAL 8 3HG1 VAL 8 10.182 19.200 -9.077 50 HG21 VAL 8 3HG2 VAL 8 13.569 19.585 -10.845 51 HG22 VAL 8 1HG2 VAL 8 12.863 21.162 -10.490 52 HG23 VAL 8 2HG2 VAL 8 14.176 20.538 -9.491 53 H THR 9 H THR 9 13.734 22.360 -7.544 54 HA THR 9 HA THR 9 11.596 24.312 -8.015 55 HB THR 9 HB THR 9 14.385 24.980 -7.097 56 HG1 THR 9 HG1 THR 9 13.933 24.036 -5.268 57 HG21 THR 9 3HG2 THR 9 13.469 27.018 -7.384 58 HG22 THR 9 1HG2 THR 9 12.649 26.676 -5.861 59 HG23 THR 9 2HG2 THR 9 11.823 26.386 -7.392 60 H THR 10 H THR 10 12.062 26.195 -9.350 61 HA THR 10 HA THR 10 13.815 25.501 -11.613 62 HB THR 10 HB THR 10 12.370 27.133 -12.910 63 HG1 THR 10 HG1 THR 10 11.398 28.150 -11.086 64 HG21 THR 10 3HG2 THR 10 11.528 24.480 -11.879 65 HG22 THR 10 1HG2 THR 10 11.863 24.996 -13.531 66 HG23 THR 10 2HG2 THR 10 10.331 25.423 -12.767 67 H GLU 11 H GLU 11 14.322 27.666 -12.908 68 HA GLU 11 HA GLU 11 16.086 29.146 -11.257 69 HB2 GLU 11 1HB GLU 11 16.508 30.496 -13.277 70 HB3 GLU 11 2HB GLU 11 16.590 28.770 -13.602 71 HG2 GLU 11 1HG GLU 11 14.146 28.997 -14.345 72 HG3 GLU 11 2HG GLU 11 14.471 30.729 -14.392 73 H SER 12 H SER 12 12.919 29.838 -12.653 74 HA SER 12 HA SER 12 12.768 32.556 -12.007 75 HB2 SER 12 1HB SER 12 10.715 30.417 -12.479 76 HB3 SER 12 2HB SER 12 10.210 32.020 -11.943 77 HG SER 12 HG SER 12 10.718 31.290 -14.387 78 H GLY 13 H GLY 13 12.454 29.722 -10.039 79 HA2 GLY 13 1HA GLY 13 12.861 30.059 -7.642 80 HA3 GLY 13 2HA GLY 13 11.799 31.456 -7.738 81 H LEU 14 H LEU 14 9.778 30.229 -9.348 82 HA LEU 14 HA LEU 14 8.081 29.215 -7.419 83 HB2 LEU 14 1HB LEU 14 6.570 28.797 -9.113 84 HB3 LEU 14 2HB LEU 14 7.605 30.039 -9.815 85 HG LEU 14 HG LEU 14 8.846 27.823 -10.720 86 HD11 LEU 14 1HD1 LEU 14 7.517 26.088 -10.084 87 HD12 LEU 14 2HD1 LEU 14 6.730 26.504 -11.607 88 HD13 LEU 14 3HD1 LEU 14 6.048 27.066 -10.081 89 HD21 LEU 14 3HD2 LEU 14 6.827 28.288 -12.595 90 HD22 LEU 14 1HD2 LEU 14 8.422 29.037 -12.530 91 HD23 LEU 14 2HD2 LEU 14 7.048 29.820 -11.749 92 H LYS 15 H LYS 15 7.201 27.078 -7.110 93 HA LYS 15 HA LYS 15 8.987 24.882 -7.889 94 HB2 LYS 15 1HB LYS 15 7.932 25.358 -5.095 95 HB3 LYS 15 2HB LYS 15 8.836 23.942 -5.613 96 HG2 LYS 15 1HG LYS 15 10.823 25.084 -5.739 97 HG3 LYS 15 2HG LYS 15 10.035 26.644 -5.983 98 HD2 LYS 15 1HD LYS 15 11.014 26.563 -3.773 99 HD3 LYS 15 2HD LYS 15 9.254 26.578 -3.640 100 HE2 LYS 15 1HE LYS 15 10.217 24.970 -2.091 101 HE3 LYS 15 2HE LYS 15 9.264 24.148 -3.326 102 HZ1 LYS 15 3HZ LYS 15 11.913 24.357 -4.223 103 HZ2 LYS 15 1HZ LYS 15 11.032 22.958 -3.862 104 HZ3 LYS 15 2HZ LYS 15 11.938 23.723 -2.655 105 H TYR 16 H TYR 16 7.986 22.734 -7.593 106 HA TYR 16 HA TYR 16 5.108 22.636 -7.323 107 HB2 TYR 16 1HB TYR 16 4.906 21.461 -9.584 108 HB3 TYR 16 2HB TYR 16 5.103 23.210 -9.613 109 HD1 TYR 16 HD1 TYR 16 6.833 19.992 -10.156 110 HD2 TYR 16 HD2 TYR 16 7.004 24.216 -10.633 111 HE1 TYR 16 HE1 TYR 16 8.777 19.740 -11.642 112 HE2 TYR 16 HE2 TYR 16 8.947 23.976 -12.122 113 HH TYR 16 HH TYR 16 10.795 22.234 -12.468 114 H GLU 17 H GLU 17 4.342 20.598 -6.847 115 HA GLU 17 HA GLU 17 6.336 18.433 -6.754 116 HB2 GLU 17 1HB GLU 17 5.954 19.445 -4.507 117 HB3 GLU 17 2HB GLU 17 4.260 18.996 -4.631 118 HG2 GLU 17 1HG GLU 17 4.772 16.687 -4.577 119 HG3 GLU 17 2HG GLU 17 6.493 16.996 -4.797 120 H ASP 18 H ASP 18 5.713 16.762 -7.934 121 HA ASP 18 HA ASP 18 3.190 16.509 -9.123 122 HB2 ASP 18 1HB ASP 18 3.933 14.212 -9.727 123 HB3 ASP 18 2HB ASP 18 5.134 15.446 -10.098 124 H LEU 19 H LEU 19 1.310 15.764 -8.398 125 HA LEU 19 HA LEU 19 1.303 14.187 -5.909 126 HB2 LEU 19 1HB LEU 19 -0.831 16.045 -6.947 127 HB3 LEU 19 2HB LEU 19 -0.897 15.129 -5.443 128 HG LEU 19 HG LEU 19 1.120 17.294 -6.027 129 HD11 LEU 19 1HD1 LEU 19 -0.425 18.336 -4.109 130 HD12 LEU 19 2HD1 LEU 19 -1.637 17.389 -4.971 131 HD13 LEU 19 3HD1 LEU 19 -0.704 18.615 -5.829 132 HD21 LEU 19 3HD2 LEU 19 1.161 17.163 -3.425 133 HD22 LEU 19 1HD2 LEU 19 2.077 15.997 -4.380 134 HD23 LEU 19 2HD2 LEU 19 0.522 15.539 -3.685 135 H THR 20 H THR 20 0.033 14.523 -9.146 136 HA THR 20 HA THR 20 -0.666 11.736 -9.219 137 HB THR 20 HB THR 20 -2.887 13.757 -9.576 138 HG1 THR 20 HG1 THR 20 -3.690 12.928 -7.658 139 HG21 THR 20 3HG2 THR 20 -2.708 10.785 -9.958 140 HG22 THR 20 1HG2 THR 20 -3.364 12.005 -11.049 141 HG23 THR 20 2HG2 THR 20 -4.245 11.566 -9.586 142 H GLU 21 H GLU 21 -0.163 11.012 -11.179 143 HA GLU 21 HA GLU 21 0.548 12.807 -13.279 144 HB2 GLU 21 1HB GLU 21 1.642 10.591 -12.844 145 HB3 GLU 21 2HB GLU 21 0.186 9.813 -13.450 146 HG2 GLU 21 1HG GLU 21 0.568 10.483 -15.623 147 HG3 GLU 21 2HG GLU 21 1.606 11.822 -15.137 148 H GLY 22 H GLY 22 -0.605 13.499 -14.980 149 HA2 GLY 22 1HA GLY 22 -3.431 12.918 -15.056 150 HA3 GLY 22 2HA GLY 22 -2.567 14.046 -16.091 151 H SER 23 H SER 23 -0.863 12.732 -17.527 152 HA SER 23 HA SER 23 -0.567 11.339 -19.302 153 HB2 SER 23 1HB SER 23 -1.000 9.626 -17.392 154 HB3 SER 23 2HB SER 23 -2.579 9.423 -18.152 155 HG SER 23 HG SER 23 -0.214 9.262 -19.675 156 H GLY 24 H GLY 24 -2.722 13.348 -19.228 157 HA2 GLY 24 1HA GLY 24 -4.629 12.121 -21.117 158 HA3 GLY 24 2HA GLY 24 -4.960 13.548 -20.146 159 H ALA 25 H ALA 25 -4.008 15.548 -20.737 160 HA ALA 25 HA ALA 25 -2.594 15.681 -23.277 161 HB1 ALA 25 1HB ALA 25 -4.185 16.694 -24.514 162 HB2 ALA 25 2HB ALA 25 -5.274 15.849 -23.413 163 HB3 ALA 25 3HB ALA 25 -4.874 17.543 -23.130 164 H GLU 26 H GLU 26 -0.990 17.093 -23.079 165 HA GLU 26 HA GLU 26 -0.613 18.695 -20.807 166 HB2 GLU 26 1HB GLU 26 1.301 17.999 -22.050 167 HB3 GLU 26 2HB GLU 26 0.688 18.726 -23.528 168 HG2 GLU 26 1HG GLU 26 0.969 20.658 -21.384 169 HG3 GLU 26 2HG GLU 26 2.487 19.849 -21.769 170 H ALA 27 H ALA 27 -1.042 20.789 -20.348 171 HA ALA 27 HA ALA 27 -3.131 22.117 -21.654 172 HB1 ALA 27 1HB ALA 27 -1.472 23.969 -20.211 173 HB2 ALA 27 2HB ALA 27 -3.083 23.367 -19.820 174 HB3 ALA 27 3HB ALA 27 -1.657 22.468 -19.303 175 H ARG 28 H ARG 28 -3.168 23.205 -23.499 176 HA ARG 28 HA ARG 28 -0.658 24.012 -24.742 177 HB2 ARG 28 1HB ARG 28 -3.492 23.795 -25.742 178 HB3 ARG 28 2HB ARG 28 -2.225 24.564 -26.689 179 HG2 ARG 28 1HG ARG 28 -1.807 21.808 -25.628 180 HG3 ARG 28 2HG ARG 28 -2.800 22.059 -27.065 181 HD2 ARG 28 1HD ARG 28 -0.145 23.389 -26.943 182 HD3 ARG 28 2HD ARG 28 -0.189 21.648 -27.220 183 HE ARG 28 HE ARG 28 -1.985 22.983 -28.956 184 HH11 ARG 28 1HH1 ARG 28 1.404 22.370 -28.447 185 HH12 ARG 28 2HH1 ARG 28 1.816 22.521 -30.123 186 HH21 ARG 28 1HH2 ARG 28 -1.455 23.184 -31.165 187 HH22 ARG 28 2HH2 ARG 28 0.190 22.985 -31.668 188 H ALA 29 H ALA 29 -0.324 26.126 -25.590 189 HA ALA 29 HA ALA 29 -1.472 28.196 -23.898 190 HB1 ALA 29 1HB ALA 29 0.993 27.850 -25.420 191 HB2 ALA 29 2HB ALA 29 0.300 29.467 -25.558 192 HB3 ALA 29 3HB ALA 29 0.678 28.802 -23.969 193 H GLY 30 H GLY 30 -2.382 30.140 -24.726 194 HA2 GLY 30 1HA GLY 30 -3.437 31.481 -26.317 195 HA3 GLY 30 2HA GLY 30 -3.066 30.277 -27.542 196 H GLN 31 H GLN 31 -4.311 28.448 -25.220 197 HA GLN 31 HA GLN 31 -7.078 28.820 -26.162 198 HB2 GLN 31 1HB GLN 31 -5.962 26.761 -27.013 199 HB3 GLN 31 2HB GLN 31 -5.764 26.223 -25.350 200 HG2 GLN 31 1HG GLN 31 -8.089 25.976 -25.048 201 HG3 GLN 31 2HG GLN 31 -8.448 26.853 -26.534 202 HE21 GLN 31 2HE2 GLN 31 -6.349 24.126 -25.658 203 HE22 GLN 31 1HE2 GLN 31 -6.922 23.067 -26.897 204 H THR 32 H THR 32 -8.772 28.328 -24.683 205 HA THR 32 HA THR 32 -8.112 29.052 -21.963 206 HB THR 32 HB THR 32 -10.791 28.462 -23.238 207 HG1 THR 32 HG1 THR 32 -10.893 30.863 -22.895 208 HG21 THR 32 3HG2 THR 32 -11.330 29.996 -21.072 209 HG22 THR 32 1HG2 THR 32 -9.978 29.040 -20.464 210 HG23 THR 32 2HG2 THR 32 -11.422 28.235 -21.079 211 H VAL 33 H VAL 33 -7.221 27.418 -20.823 212 HA VAL 33 HA VAL 33 -8.384 24.742 -20.980 213 HB VAL 33 HB VAL 33 -5.979 24.806 -21.085 214 HG11 VAL 33 1HG1 VAL 33 -6.249 26.905 -19.211 215 HG12 VAL 33 2HG1 VAL 33 -5.272 25.644 -18.455 216 HG13 VAL 33 3HG1 VAL 33 -4.783 26.331 -20.005 217 HG21 VAL 33 3HG2 VAL 33 -6.999 22.928 -19.889 218 HG22 VAL 33 1HG2 VAL 33 -5.413 23.328 -19.229 219 HG23 VAL 33 2HG2 VAL 33 -6.875 23.824 -18.375 220 H SER 34 H SER 34 -9.398 23.728 -19.306 221 HA SER 34 HA SER 34 -10.195 25.442 -17.066 222 HB2 SER 34 1HB SER 34 -12.205 24.626 -17.697 223 HB3 SER 34 2HB SER 34 -11.482 23.294 -18.597 224 HG SER 34 HG SER 34 -12.261 22.168 -16.988 225 H VAL 35 H VAL 35 -9.299 25.173 -15.142 226 HA VAL 35 HA VAL 35 -8.483 22.504 -14.275 227 HB VAL 35 HB VAL 35 -6.294 23.116 -13.627 228 HG11 VAL 35 1HG1 VAL 35 -6.514 24.494 -16.279 229 HG12 VAL 35 2HG1 VAL 35 -5.238 23.432 -15.679 230 HG13 VAL 35 3HG1 VAL 35 -6.808 22.763 -16.125 231 HG21 VAL 35 3HG2 VAL 35 -7.279 25.895 -14.028 232 HG22 VAL 35 1HG2 VAL 35 -6.323 25.213 -12.712 233 HG23 VAL 35 2HG2 VAL 35 -5.561 25.571 -14.262 234 H HIS 36 H HIS 36 -7.896 22.490 -11.925 235 HA HIS 36 HA HIS 36 -9.617 24.386 -10.477 236 HB2 HIS 36 1HB HIS 36 -9.069 21.492 -10.184 237 HB3 HIS 36 2HB HIS 36 -9.216 22.402 -8.683 238 HD1 HIS 36 HD1 HIS 36 -11.478 24.344 -9.573 239 HD2 HIS 36 HD2 HIS 36 -11.497 20.234 -10.180 240 HE1 HIS 36 HE1 HIS 36 -13.899 23.713 -9.823 241 H TYR 37 H TYR 37 -8.777 25.678 -8.954 242 HA TYR 37 HA TYR 37 -5.968 25.233 -8.178 243 HB2 TYR 37 1HB TYR 37 -5.646 27.621 -8.092 244 HB3 TYR 37 2HB TYR 37 -6.320 27.208 -9.664 245 HD1 TYR 37 HD1 TYR 37 -7.067 28.719 -6.384 246 HD2 TYR 37 HD2 TYR 37 -8.465 28.016 -10.341 247 HE1 TYR 37 HE1 TYR 37 -8.878 30.344 -6.027 248 HE2 TYR 37 HE2 TYR 37 -10.280 29.639 -9.994 249 HH TYR 37 HH TYR 37 -11.386 30.601 -7.247 250 H THR 38 H THR 38 -5.448 25.329 -6.054 251 HA THR 38 HA THR 38 -7.545 26.127 -4.152 252 HB THR 38 HB THR 38 -6.027 24.050 -2.951 253 HG1 THR 38 HG1 THR 38 -7.169 23.290 -5.452 254 HG21 THR 38 3HG2 THR 38 -8.461 22.949 -3.381 255 HG22 THR 38 1HG2 THR 38 -8.833 24.655 -3.625 256 HG23 THR 38 2HG2 THR 38 -8.123 24.116 -2.103 257 H GLY 39 H GLY 39 -6.842 27.599 -2.754 258 HA2 GLY 39 1HA GLY 39 -3.960 28.043 -2.506 259 HA3 GLY 39 2HA GLY 39 -5.226 29.159 -2.016 260 H TRP 40 H TRP 40 -2.811 27.547 -0.758 261 HA TRP 40 HA TRP 40 -4.239 27.033 1.761 262 HB2 TRP 40 1HB TRP 40 -2.232 25.280 0.368 263 HB3 TRP 40 2HB TRP 40 -2.439 25.203 2.116 264 HD1 TRP 40 HD1 TRP 40 -5.524 25.287 2.428 265 HE1 TRP 40 HE1 TRP 40 -6.999 23.364 1.561 266 HE3 TRP 40 HE3 TRP 40 -2.310 23.282 -1.006 267 HZ2 TRP 40 HZ2 TRP 40 -6.824 21.274 -0.328 268 HZ3 TRP 40 HZ3 TRP 40 -3.041 21.321 -2.301 269 HH2 TRP 40 HH2 TRP 40 -5.251 20.339 -1.967 270 H LEU 41 H LEU 41 -3.310 27.862 3.554 271 HA LEU 41 HA LEU 41 -1.190 29.740 3.258 272 HB2 LEU 41 1HB LEU 41 -3.001 28.849 5.391 273 HB3 LEU 41 2HB LEU 41 -1.430 29.424 5.946 274 HG LEU 41 HG LEU 41 -3.371 31.000 4.255 275 HD11 LEU 41 1HD1 LEU 41 -4.424 31.408 6.167 276 HD12 LEU 41 2HD1 LEU 41 -2.976 32.261 6.700 277 HD13 LEU 41 3HD1 LEU 41 -3.195 30.558 7.103 278 HD21 LEU 41 3HD2 LEU 41 -1.783 32.540 3.976 279 HD22 LEU 41 1HD2 LEU 41 -0.636 31.298 4.479 280 HD23 LEU 41 2HD2 LEU 41 -1.276 32.439 5.663 281 H THR 42 H THR 42 0.693 29.724 4.846 282 HA THR 42 HA THR 42 2.426 27.642 4.252 283 HB THR 42 HB THR 42 3.904 28.515 5.986 284 HG1 THR 42 HG1 THR 42 3.021 30.333 7.259 285 HG21 THR 42 3HG2 THR 42 4.060 29.828 4.073 286 HG22 THR 42 1HG2 THR 42 3.723 31.019 5.329 287 HG23 THR 42 2HG2 THR 42 2.430 30.473 4.261 288 H ASP 43 H ASP 43 0.058 27.905 6.775 289 HA ASP 43 HA ASP 43 1.122 25.589 8.195 290 HB2 ASP 43 1HB ASP 43 0.221 27.621 9.402 291 HB3 ASP 43 2HB ASP 43 -1.380 27.154 8.837 292 H GLY 44 H GLY 44 -1.230 26.376 5.826 293 HA2 GLY 44 1HA GLY 44 -2.039 24.436 4.531 294 HA3 GLY 44 2HA GLY 44 -2.359 23.655 6.072 295 H GLN 45 H GLN 45 -3.107 26.883 6.343 296 HA GLN 45 HA GLN 45 -5.900 26.366 6.516 297 HB2 GLN 45 1HB GLN 45 -4.352 28.183 7.681 298 HB3 GLN 45 2HB GLN 45 -4.874 29.157 6.313 299 HG2 GLN 45 1HG GLN 45 -6.270 29.489 8.301 300 HG3 GLN 45 2HG GLN 45 -7.183 28.865 6.928 301 HE21 GLN 45 2HE2 GLN 45 -5.717 28.034 10.001 302 HE22 GLN 45 1HE2 GLN 45 -6.686 26.635 10.301 303 H LYS 46 H LYS 46 -7.219 26.149 4.845 304 HA LYS 46 HA LYS 46 -6.552 26.972 2.210 305 HB2 LYS 46 1HB LYS 46 -8.055 25.034 2.883 306 HB3 LYS 46 2HB LYS 46 -9.306 26.231 3.192 307 HG2 LYS 46 1HG LYS 46 -9.513 26.782 0.949 308 HG3 LYS 46 2HG LYS 46 -7.929 26.119 0.539 309 HD2 LYS 46 1HD LYS 46 -9.602 24.627 -0.304 310 HD3 LYS 46 2HD LYS 46 -8.822 23.850 1.076 311 HE2 LYS 46 1HE LYS 46 -11.157 23.481 1.302 312 HE3 LYS 46 2HE LYS 46 -10.714 24.703 2.493 313 HZ1 LYS 46 3HZ LYS 46 -12.481 25.756 1.614 314 HZ2 LYS 46 1HZ LYS 46 -12.397 24.935 0.137 315 HZ3 LYS 46 2HZ LYS 46 -11.371 26.246 0.435 316 H PHE 47 H PHE 47 -6.916 28.834 1.188 317 HA PHE 47 HA PHE 47 -8.845 30.723 2.359 318 HB2 PHE 47 1HB PHE 47 -7.306 32.570 1.723 319 HB3 PHE 47 2HB PHE 47 -6.630 31.503 2.950 320 HD1 PHE 47 HD2 PHE 47 -6.598 32.204 -0.693 321 HD2 PHE 47 HD1 PHE 47 -4.565 30.481 2.626 322 HE1 PHE 47 HE2 PHE 47 -4.607 31.861 -2.096 323 HE2 PHE 47 HE1 PHE 47 -2.569 30.136 1.228 324 HZ PHE 47 HZ PHE 47 -2.589 30.825 -1.136 325 H ASP 48 H ASP 48 -8.608 28.776 -0.054 326 HA ASP 48 HA ASP 48 -10.294 30.177 -1.792 327 HB2 ASP 48 1HB ASP 48 -7.800 31.156 -2.118 328 HB3 ASP 48 2HB ASP 48 -7.743 29.810 -3.252 329 H SER 49 H SER 49 -11.383 28.714 -2.944 330 HA SER 49 HA SER 49 -10.093 26.310 -3.920 331 HB2 SER 49 1HB SER 49 -11.752 24.804 -2.833 332 HB3 SER 49 2HB SER 49 -10.692 25.604 -1.673 333 HG SER 49 HG SER 49 -12.591 27.239 -1.756 334 H SER 50 H SER 50 -10.666 26.555 -5.993 335 HA SER 50 HA SER 50 -12.983 27.773 -6.954 336 HB2 SER 50 1HB SER 50 -11.137 27.493 -8.444 337 HB3 SER 50 2HB SER 50 -11.133 25.744 -8.216 338 HG SER 50 HG SER 50 -13.083 25.630 -9.324 339 H LYS 51 H LYS 51 -12.461 24.586 -5.735 340 HA LYS 51 HA LYS 51 -14.620 23.255 -6.968 341 HB2 LYS 51 1HB LYS 51 -13.036 22.778 -4.462 342 HB3 LYS 51 2HB LYS 51 -14.430 21.775 -4.841 343 HG2 LYS 51 1HG LYS 51 -12.815 20.514 -5.804 344 HG3 LYS 51 2HG LYS 51 -13.178 21.573 -7.169 345 HD2 LYS 51 1HD LYS 51 -11.238 22.791 -6.911 346 HD3 LYS 51 2HD LYS 51 -11.096 22.399 -5.196 347 HE2 LYS 51 1HE LYS 51 -10.673 20.455 -7.463 348 HE3 LYS 51 2HE LYS 51 -9.386 21.282 -6.586 349 HZ1 LYS 51 3HZ LYS 51 -11.292 19.270 -5.536 350 HZ2 LYS 51 1HZ LYS 51 -10.323 20.225 -4.530 351 HZ3 LYS 51 2HZ LYS 51 -9.606 19.156 -5.627 352 H ASP 52 H ASP 52 -14.432 25.453 -4.291 353 HA ASP 52 HA ASP 52 -16.737 24.856 -2.877 354 HB2 ASP 52 1HB ASP 52 -15.077 26.552 -2.185 355 HB3 ASP 52 2HB ASP 52 -15.638 27.611 -3.475 356 H ARG 53 H ARG 53 -16.377 26.944 -5.730 357 HA ARG 53 HA ARG 53 -19.176 27.526 -5.885 358 HB2 ARG 53 1HB ARG 53 -17.053 27.860 -8.012 359 HB3 ARG 53 2HB ARG 53 -18.635 28.628 -7.983 360 HG2 ARG 53 1HG ARG 53 -17.847 29.630 -5.735 361 HG3 ARG 53 2HG ARG 53 -16.233 29.193 -6.300 362 HD2 ARG 53 1HD ARG 53 -16.626 31.451 -6.945 363 HD3 ARG 53 2HD ARG 53 -16.723 30.462 -8.401 364 HE ARG 53 HE ARG 53 -19.295 30.768 -7.298 365 HH11 ARG 53 1HH1 ARG 53 -16.834 32.582 -8.964 366 HH12 ARG 53 2HH1 ARG 53 -17.956 33.680 -9.697 367 HH21 ARG 53 1HH2 ARG 53 -20.782 32.207 -8.258 368 HH22 ARG 53 2HH2 ARG 53 -20.201 33.466 -9.295 369 H ASN 54 H ASN 54 -17.387 24.808 -6.613 370 HA ASN 54 HA ASN 54 -17.859 22.861 -7.689 371 HB2 ASN 54 1HB ASN 54 -20.647 23.940 -8.117 372 HB3 ASN 54 2HB ASN 54 -20.145 22.254 -8.041 373 HD21 ASN 54 2HD2 ASN 54 -21.570 24.695 -6.368 374 HD22 ASN 54 1HD2 ASN 54 -21.336 24.115 -4.757 375 H ASP 55 H ASP 55 -16.760 25.028 -9.163 376 HA ASP 55 HA ASP 55 -17.484 24.157 -11.844 377 HB2 ASP 55 1HB ASP 55 -18.896 26.156 -11.387 378 HB3 ASP 55 2HB ASP 55 -17.429 27.093 -11.116 379 HA PRO 56 HA PRO 56 -13.091 24.288 -12.231 380 HB2 PRO 56 1HB PRO 56 -12.940 24.038 -14.930 381 HB3 PRO 56 2HB PRO 56 -13.348 22.690 -13.861 382 HG2 PRO 56 1HG PRO 56 -15.160 24.442 -15.476 383 HG3 PRO 56 2HG PRO 56 -15.212 22.683 -15.251 384 HD2 PRO 56 1HD PRO 56 -16.835 24.375 -13.895 385 HD3 PRO 56 2HD PRO 56 -16.248 22.851 -13.199 386 H PHE 57 H PHE 57 -11.423 25.654 -12.941 387 HA PHE 57 HA PHE 57 -12.321 28.343 -13.658 388 HB2 PHE 57 1HB PHE 57 -10.907 28.240 -11.708 389 HB3 PHE 57 2HB PHE 57 -9.691 27.313 -12.581 390 HD1 PHE 57 HD1 PHE 57 -11.552 30.378 -13.575 391 HD2 PHE 57 HD2 PHE 57 -7.791 28.626 -12.622 392 HE1 PHE 57 HE1 PHE 57 -10.421 32.469 -14.209 393 HE2 PHE 57 HE2 PHE 57 -6.654 30.715 -13.253 394 HZ PHE 57 HZ PHE 57 -7.969 32.640 -14.047 395 H ALA 58 H ALA 58 -12.537 28.499 -15.820 396 HA ALA 58 HA ALA 58 -10.507 27.350 -17.573 397 HB1 ALA 58 1HB ALA 58 -12.296 26.972 -18.835 398 HB2 ALA 58 2HB ALA 58 -13.304 28.002 -17.818 399 HB3 ALA 58 3HB ALA 58 -12.372 28.708 -19.139 400 H PHE 59 H PHE 59 -8.817 28.508 -18.194 401 HA PHE 59 HA PHE 59 -9.142 31.355 -18.756 402 HB2 PHE 59 1HB PHE 59 -7.279 32.039 -17.429 403 HB3 PHE 59 2HB PHE 59 -8.318 31.076 -16.384 404 HD1 PHE 59 HD1 PHE 59 -7.680 28.735 -15.840 405 HD2 PHE 59 HD2 PHE 59 -5.060 31.389 -17.892 406 HE1 PHE 59 HE1 PHE 59 -5.776 27.279 -15.285 407 HE2 PHE 59 HE2 PHE 59 -3.152 29.936 -17.341 408 HZ PHE 59 HZ PHE 59 -3.508 27.878 -16.036 409 H VAL 60 H VAL 60 -7.571 32.214 -20.180 410 HA VAL 60 HA VAL 60 -6.577 30.315 -22.075 411 HB VAL 60 HB VAL 60 -6.108 33.297 -21.931 412 HG11 VAL 60 1HG1 VAL 60 -6.024 32.365 -24.579 413 HG12 VAL 60 2HG1 VAL 60 -4.689 32.998 -23.614 414 HG13 VAL 60 3HG1 VAL 60 -5.019 31.265 -23.635 415 HG21 VAL 60 3HG2 VAL 60 -7.906 33.465 -23.573 416 HG22 VAL 60 1HG2 VAL 60 -8.151 31.720 -23.495 417 HG23 VAL 60 2HG2 VAL 60 -8.483 32.722 -22.082 418 H LEU 61 H LEU 61 -4.748 29.222 -21.858 419 HA LEU 61 HA LEU 61 -2.753 29.888 -19.948 420 HB2 LEU 61 1HB LEU 61 -2.995 27.608 -20.403 421 HB3 LEU 61 2HB LEU 61 -2.956 27.862 -22.147 422 HG LEU 61 HG LEU 61 -0.596 28.200 -22.122 423 HD11 LEU 61 1HD1 LEU 61 0.310 27.702 -19.567 424 HD12 LEU 61 2HD1 LEU 61 -1.060 28.783 -19.315 425 HD13 LEU 61 3HD1 LEU 61 0.266 29.272 -20.370 426 HD21 LEU 61 3HD2 LEU 61 -0.188 26.017 -22.014 427 HD22 LEU 61 1HD2 LEU 61 -1.815 25.819 -21.363 428 HD23 LEU 61 2HD2 LEU 61 -0.442 25.988 -20.269 429 H GLY 62 H GLY 62 -1.048 31.189 -20.124 430 HA2 GLY 62 1HA GLY 62 0.730 31.487 -22.155 431 HA3 GLY 62 2HA GLY 62 -0.566 32.587 -22.600 432 H GLY 63 H GLY 63 -1.335 33.785 -20.364 433 HA2 GLY 63 1HA GLY 63 -0.026 34.612 -18.295 434 HA3 GLY 63 2HA GLY 63 1.113 35.176 -19.509 435 H GLY 64 H GLY 64 -0.180 36.848 -17.632 436 HA2 GLY 64 1HA GLY 64 -0.725 39.153 -18.381 437 HA3 GLY 64 2HA GLY 64 -1.930 38.416 -19.426 438 H MET 65 H MET 65 -2.855 36.493 -17.492 439 HA MET 65 HA MET 65 -4.260 38.319 -15.655 440 HB2 MET 65 1HB MET 65 -5.177 35.927 -17.203 441 HB3 MET 65 2HB MET 65 -5.976 36.332 -15.690 442 HG2 MET 65 1HG MET 65 -5.617 38.505 -17.670 443 HG3 MET 65 2HG MET 65 -6.801 37.251 -18.034 444 HE1 MET 65 3HE MET 65 -9.238 39.294 -17.543 445 HE2 MET 65 1HE MET 65 -8.349 40.651 -16.849 446 HE3 MET 65 2HE MET 65 -7.667 39.751 -18.203 447 H VAL 66 H VAL 66 -2.415 35.403 -15.962 448 HA VAL 66 HA VAL 66 -2.802 34.810 -13.107 449 HB VAL 66 HB VAL 66 -1.956 32.598 -13.532 450 HG11 VAL 66 1HG1 VAL 66 -3.749 31.722 -14.741 451 HG12 VAL 66 2HG1 VAL 66 -4.360 33.268 -14.148 452 HG13 VAL 66 3HG1 VAL 66 -3.823 33.114 -15.821 453 HG21 VAL 66 3HG2 VAL 66 -0.344 32.482 -15.093 454 HG22 VAL 66 1HG2 VAL 66 -1.681 32.222 -16.213 455 HG23 VAL 66 2HG2 VAL 66 -0.999 33.836 -16.013 456 H ILE 67 H ILE 67 -0.671 33.627 -12.253 457 HA ILE 67 HA ILE 67 1.443 35.627 -12.532 458 HB ILE 67 HB ILE 67 2.310 34.890 -10.465 459 HG12 ILE 67 1HG1 ILE 67 0.507 32.478 -10.753 460 HG13 ILE 67 2HG1 ILE 67 2.265 32.491 -10.841 461 HG21 ILE 67 1HG2 ILE 67 -0.405 34.422 -9.566 462 HG22 ILE 67 2HG2 ILE 67 0.675 35.777 -9.240 463 HG23 ILE 67 3HG2 ILE 67 -0.304 35.762 -10.707 464 HD11 ILE 67 3HD1 ILE 67 0.553 32.256 -8.555 465 HD12 ILE 67 1HD1 ILE 67 2.298 32.033 -8.680 466 HD13 ILE 67 2HD1 ILE 67 1.633 33.639 -8.377 467 H LYS 68 H LYS 68 3.714 34.863 -12.498 468 HA LYS 68 HA LYS 68 4.367 33.322 -14.672 469 HB2 LYS 68 1HB LYS 68 6.626 33.055 -13.567 470 HB3 LYS 68 2HB LYS 68 6.044 34.707 -13.718 471 HG2 LYS 68 1HG LYS 68 5.225 34.513 -11.344 472 HG3 LYS 68 2HG LYS 68 6.122 32.996 -11.250 473 HD2 LYS 68 1HD LYS 68 7.764 34.368 -10.504 474 HD3 LYS 68 2HD LYS 68 8.045 34.583 -12.234 475 HE2 LYS 68 1HE LYS 68 6.375 36.526 -12.054 476 HE3 LYS 68 2HE LYS 68 6.630 36.404 -10.314 477 HZ1 LYS 68 3HZ LYS 68 8.260 37.641 -12.252 478 HZ2 LYS 68 1HZ LYS 68 9.138 36.404 -11.502 479 HZ3 LYS 68 2HZ LYS 68 8.439 37.629 -10.569 480 H GLY 69 H GLY 69 4.257 32.261 -11.273 481 HA2 GLY 69 1HA GLY 69 5.035 29.615 -11.658 482 HA3 GLY 69 2HA GLY 69 4.000 30.175 -10.353 483 H TRP 70 H TRP 70 1.929 31.137 -12.199 484 HA TRP 70 HA TRP 70 0.428 28.726 -12.382 485 HB2 TRP 70 1HB TRP 70 -0.091 31.527 -12.527 486 HB3 TRP 70 2HB TRP 70 -0.782 30.767 -13.959 487 HD1 TRP 70 HD1 TRP 70 -3.082 29.659 -13.659 488 HE1 TRP 70 HE1 TRP 70 -4.570 29.047 -11.650 489 HE3 TRP 70 HE3 TRP 70 0.187 30.720 -9.875 490 HZ2 TRP 70 HZ2 TRP 70 -4.383 29.018 -8.834 491 HZ3 TRP 70 HZ3 TRP 70 -0.546 30.373 -7.551 492 HH2 TRP 70 HH2 TRP 70 -2.784 29.540 -7.044 493 H ASP 71 H ASP 71 1.589 30.981 -14.891 494 HA ASP 71 HA ASP 71 0.823 29.518 -17.116 495 HB2 ASP 71 1HB ASP 71 1.575 31.714 -17.510 496 HB3 ASP 71 2HB ASP 71 3.089 31.443 -16.651 497 H GLU 72 H GLU 72 3.878 29.367 -15.311 498 HA GLU 72 HA GLU 72 5.097 27.415 -16.943 499 HB2 GLU 72 1HB GLU 72 5.747 28.866 -14.583 500 HB3 GLU 72 2HB GLU 72 6.027 27.162 -14.257 501 HG2 GLU 72 1HG GLU 72 7.090 28.445 -16.741 502 HG3 GLU 72 2HG GLU 72 7.947 28.579 -15.207 503 H GLY 73 H GLY 73 3.142 27.178 -13.999 504 HA2 GLY 73 1HA GLY 73 3.429 24.444 -13.514 505 HA3 GLY 73 2HA GLY 73 2.029 25.405 -13.060 506 H VAL 74 H VAL 74 0.690 26.014 -15.179 507 HA VAL 74 HA VAL 74 -0.426 23.578 -16.085 508 HB VAL 74 HB VAL 74 -1.731 25.052 -17.666 509 HG11 VAL 74 1HG1 VAL 74 -3.214 25.570 -16.022 510 HG12 VAL 74 2HG1 VAL 74 -2.143 24.522 -15.090 511 HG13 VAL 74 3HG1 VAL 74 -1.981 26.275 -14.977 512 HG21 VAL 74 3HG2 VAL 74 -1.278 27.235 -17.948 513 HG22 VAL 74 1HG2 VAL 74 -0.889 27.475 -16.244 514 HG23 VAL 74 2HG2 VAL 74 0.322 26.810 -17.341 515 H GLN 75 H GLN 75 2.032 25.677 -17.351 516 HA GLN 75 HA GLN 75 2.010 25.095 -20.046 517 HB2 GLN 75 1HB GLN 75 3.979 26.038 -18.109 518 HB3 GLN 75 2HB GLN 75 4.707 25.131 -19.428 519 HG2 GLN 75 1HG GLN 75 2.760 27.348 -19.942 520 HG3 GLN 75 2HG GLN 75 4.475 27.661 -19.684 521 HE21 GLN 75 2HE2 GLN 75 5.256 28.172 -21.612 522 HE22 GLN 75 1HE2 GLN 75 5.063 27.242 -23.055 523 H GLY 76 H GLY 76 2.988 23.081 -17.375 524 HA2 GLY 76 1HA GLY 76 3.845 21.002 -19.290 525 HA3 GLY 76 2HA GLY 76 4.413 21.115 -17.630 526 H MET 77 H MET 77 1.795 21.671 -16.512 527 HA MET 77 HA MET 77 0.962 19.129 -15.839 528 HB2 MET 77 1HB MET 77 0.346 21.423 -14.809 529 HB3 MET 77 2HB MET 77 -0.981 21.418 -15.963 530 HG2 MET 77 1HG MET 77 -2.037 19.636 -14.948 531 HG3 MET 77 2HG MET 77 -0.560 19.073 -14.170 532 HE1 MET 77 3HE MET 77 0.394 22.065 -12.481 533 HE2 MET 77 1HE MET 77 -0.065 21.036 -11.124 534 HE3 MET 77 2HE MET 77 0.703 20.330 -12.546 535 H LYS 78 H LYS 78 -0.802 17.826 -16.445 536 HA LYS 78 HA LYS 78 -1.899 18.386 -19.122 537 HB2 LYS 78 1HB LYS 78 -1.173 15.654 -18.053 538 HB3 LYS 78 2HB LYS 78 -1.759 16.033 -19.668 539 HG2 LYS 78 1HG LYS 78 0.296 16.431 -20.389 540 HG3 LYS 78 2HG LYS 78 0.597 17.568 -19.073 541 HD2 LYS 78 1HD LYS 78 1.781 16.066 -17.907 542 HD3 LYS 78 2HD LYS 78 0.608 14.782 -18.209 543 HE2 LYS 78 1HE LYS 78 1.618 14.167 -20.216 544 HE3 LYS 78 2HE LYS 78 2.462 15.707 -20.373 545 HZ1 LYS 78 3HZ LYS 78 4.069 14.132 -19.742 546 HZ2 LYS 78 1HZ LYS 78 3.087 13.473 -18.532 547 HZ3 LYS 78 2HZ LYS 78 3.745 15.019 -18.339 548 H VAL 79 H VAL 79 -3.900 17.053 -19.572 549 HA VAL 79 HA VAL 79 -5.919 17.666 -17.781 550 HB VAL 79 HB VAL 79 -5.916 15.445 -19.830 551 HG11 VAL 79 1HG1 VAL 79 -7.884 16.273 -17.902 552 HG12 VAL 79 2HG1 VAL 79 -8.481 16.525 -19.543 553 HG13 VAL 79 3HG1 VAL 79 -7.928 14.927 -19.041 554 HG21 VAL 79 3HG2 VAL 79 -7.346 17.907 -20.454 555 HG22 VAL 79 1HG2 VAL 79 -5.610 18.145 -20.253 556 HG23 VAL 79 2HG2 VAL 79 -6.210 16.978 -21.432 557 H GLY 80 H GLY 80 -6.537 16.842 -15.894 558 HA2 GLY 80 1HA GLY 80 -7.065 15.205 -14.323 559 HA3 GLY 80 2HA GLY 80 -6.323 14.001 -15.366 560 H GLY 81 H GLY 81 -4.150 16.454 -15.151 561 HA2 GLY 81 1HA GLY 81 -2.538 14.957 -13.249 562 HA3 GLY 81 2HA GLY 81 -1.996 16.294 -14.253 563 H VAL 82 H VAL 82 -2.021 15.551 -11.231 564 HA VAL 82 HA VAL 82 -2.855 18.230 -10.328 565 HB VAL 82 HB VAL 82 -3.006 15.729 -8.645 566 HG11 VAL 82 1HG1 VAL 82 -2.906 17.388 -7.092 567 HG12 VAL 82 2HG1 VAL 82 -3.540 18.611 -8.195 568 HG13 VAL 82 3HG1 VAL 82 -4.634 17.452 -7.438 569 HG21 VAL 82 3HG2 VAL 82 -5.583 16.737 -9.102 570 HG22 VAL 82 1HG2 VAL 82 -4.797 16.675 -10.680 571 HG23 VAL 82 2HG2 VAL 82 -4.902 15.220 -9.689 572 H ARG 83 H ARG 83 -1.306 19.388 -9.385 573 HA ARG 83 HA ARG 83 0.873 18.060 -7.979 574 HB2 ARG 83 1HB ARG 83 1.473 20.112 -10.108 575 HB3 ARG 83 2HB ARG 83 2.619 19.130 -9.204 576 HG2 ARG 83 1HG ARG 83 1.475 17.122 -10.312 577 HG3 ARG 83 2HG ARG 83 0.785 18.308 -11.422 578 HD2 ARG 83 1HD ARG 83 3.010 19.052 -12.047 579 HD3 ARG 83 2HD ARG 83 3.729 17.939 -10.884 580 HE ARG 83 HE ARG 83 2.218 16.357 -12.526 581 HH11 ARG 83 1HH1 ARG 83 4.815 18.632 -12.974 582 HH12 ARG 83 2HH1 ARG 83 5.448 17.832 -14.374 583 HH21 ARG 83 1HH2 ARG 83 3.043 15.295 -14.368 584 HH22 ARG 83 2HH2 ARG 83 4.439 15.935 -15.167 585 H ARG 84 H ARG 84 1.766 19.279 -6.355 586 HA ARG 84 HA ARG 84 0.272 21.639 -5.587 587 HB2 ARG 84 1HB ARG 84 1.297 19.609 -4.135 588 HB3 ARG 84 2HB ARG 84 2.604 20.775 -3.980 589 HG2 ARG 84 1HG ARG 84 1.435 22.080 -2.594 590 HG3 ARG 84 2HG ARG 84 -0.051 21.907 -3.529 591 HD2 ARG 84 1HD ARG 84 -0.795 20.196 -2.268 592 HD3 ARG 84 2HD ARG 84 0.811 19.487 -2.105 593 HE ARG 84 HE ARG 84 -0.481 21.275 -0.276 594 HH11 ARG 84 1HH1 ARG 84 2.595 20.155 -1.461 595 HH12 ARG 84 2HH1 ARG 84 3.451 20.570 -0.013 596 HH21 ARG 84 1HH2 ARG 84 0.635 21.826 1.636 597 HH22 ARG 84 2HH2 ARG 84 2.335 21.519 1.748 598 H LEU 85 H LEU 85 0.847 23.436 -6.666 599 HA LEU 85 HA LEU 85 3.639 23.981 -7.254 600 HB2 LEU 85 1HB LEU 85 1.812 24.423 -8.890 601 HB3 LEU 85 2HB LEU 85 1.213 25.680 -7.810 602 HG LEU 85 HG LEU 85 3.756 26.513 -8.137 603 HD11 LEU 85 1HD1 LEU 85 3.240 24.615 -10.277 604 HD12 LEU 85 2HD1 LEU 85 4.752 25.365 -9.766 605 HD13 LEU 85 3HD1 LEU 85 3.674 26.218 -10.871 606 HD21 LEU 85 3HD2 LEU 85 1.816 27.228 -10.278 607 HD22 LEU 85 1HD2 LEU 85 2.843 28.266 -9.289 608 HD23 LEU 85 2HD2 LEU 85 1.384 27.556 -8.599 609 H THR 86 H THR 86 4.895 24.943 -5.815 610 HA THR 86 HA THR 86 3.698 26.572 -3.703 611 HB THR 86 HB THR 86 6.628 26.086 -3.748 612 HG1 THR 86 HG1 THR 86 5.834 24.046 -4.356 613 HG21 THR 86 3HG2 THR 86 5.475 25.346 -1.311 614 HG22 THR 86 1HG2 THR 86 4.549 26.743 -1.856 615 HG23 THR 86 2HG2 THR 86 6.300 26.860 -1.681 616 H ILE 87 H ILE 87 3.586 28.695 -3.963 617 HA ILE 87 HA ILE 87 5.664 30.028 -5.575 618 HB ILE 87 HB ILE 87 2.851 31.040 -5.182 619 HG12 ILE 87 1HG1 ILE 87 2.839 30.336 -7.754 620 HG13 ILE 87 2HG1 ILE 87 3.992 29.139 -7.174 621 HG21 ILE 87 1HG2 ILE 87 4.742 31.793 -7.377 622 HG22 ILE 87 2HG2 ILE 87 3.356 32.681 -6.746 623 HG23 ILE 87 3HG2 ILE 87 4.837 32.568 -5.796 624 HD11 ILE 87 3HD1 ILE 87 2.190 27.903 -6.752 625 HD12 ILE 87 1HD1 ILE 87 1.990 28.935 -5.337 626 HD13 ILE 87 2HD1 ILE 87 1.105 29.291 -6.820 627 HA PRO 88 HA PRO 88 6.676 32.172 -1.836 628 HB2 PRO 88 1HB PRO 88 8.298 34.043 -2.950 629 HB3 PRO 88 2HB PRO 88 8.791 32.362 -2.712 630 HG2 PRO 88 1HG PRO 88 7.787 33.709 -5.190 631 HG3 PRO 88 2HG PRO 88 9.127 32.563 -5.004 632 HD2 PRO 88 1HD PRO 88 6.690 31.818 -5.919 633 HD3 PRO 88 2HD PRO 88 7.725 30.734 -4.967 634 HA PRO 89 HA PRO 89 4.189 35.783 -1.499 635 HB2 PRO 89 1HB PRO 89 5.720 37.475 -0.029 636 HB3 PRO 89 2HB PRO 89 4.961 36.031 0.651 637 HG2 PRO 89 1HG PRO 89 7.781 36.433 -0.268 638 HG3 PRO 89 2HG PRO 89 7.184 35.608 1.183 639 HD2 PRO 89 1HD PRO 89 7.969 34.268 -1.035 640 HD3 PRO 89 2HD PRO 89 6.678 33.677 0.031 641 H GLN 90 H GLN 90 7.047 35.863 -3.266 642 HA GLN 90 HA GLN 90 6.748 38.664 -4.051 643 HB2 GLN 90 1HB GLN 90 8.879 36.598 -4.572 644 HB3 GLN 90 2HB GLN 90 8.844 38.141 -5.416 645 HG2 GLN 90 1HG GLN 90 8.712 39.104 -2.978 646 HG3 GLN 90 2HG GLN 90 9.432 37.549 -2.564 647 HE21 GLN 90 2HE2 GLN 90 11.081 37.099 -4.679 648 HE22 GLN 90 1HE2 GLN 90 12.321 38.301 -4.730 649 H LEU 91 H LEU 91 6.899 35.439 -5.547 650 HA LEU 91 HA LEU 91 5.898 36.509 -8.058 651 HB2 LEU 91 1HB LEU 91 6.327 33.604 -7.471 652 HB3 LEU 91 2HB LEU 91 6.418 34.446 -9.016 653 HG LEU 91 HG LEU 91 8.428 34.694 -6.778 654 HD11 LEU 91 1HD1 LEU 91 9.317 33.538 -9.289 655 HD12 LEU 91 2HD1 LEU 91 8.078 32.567 -8.496 656 HD13 LEU 91 3HD1 LEU 91 9.561 32.979 -7.634 657 HD21 LEU 91 3HD2 LEU 91 9.127 35.514 -9.504 658 HD22 LEU 91 1HD2 LEU 91 9.469 36.292 -7.959 659 HD23 LEU 91 2HD2 LEU 91 7.898 36.515 -8.729 660 H GLY 92 H GLY 92 4.404 35.991 -5.318 661 HA2 GLY 92 1HA GLY 92 2.077 34.648 -6.551 662 HA3 GLY 92 2HA GLY 92 2.450 34.581 -4.834 663 H TYR 93 H TYR 93 2.089 36.430 -3.538 664 HA TYR 93 HA TYR 93 -0.146 38.011 -4.441 665 HB2 TYR 93 1HB TYR 93 1.273 37.607 -1.844 666 HB3 TYR 93 2HB TYR 93 0.282 39.047 -2.045 667 HD1 TYR 93 HD2 TYR 93 0.233 35.359 -1.978 668 HD2 TYR 93 HD1 TYR 93 -2.101 38.915 -2.041 669 HE1 TYR 93 HE2 TYR 93 -1.773 34.045 -1.433 670 HE2 TYR 93 HE1 TYR 93 -4.114 37.611 -1.495 671 HH TYR 93 HH TYR 93 -4.395 34.426 -1.854 672 H GLY 94 H GLY 94 3.233 38.583 -3.558 673 HA2 GLY 94 1HA GLY 94 4.399 40.271 -4.934 674 HA3 GLY 94 2HA GLY 94 2.975 41.282 -4.736 675 H ALA 95 H ALA 95 5.037 42.627 -4.095 676 HA ALA 95 HA ALA 95 6.246 42.256 -1.596 677 HB1 ALA 95 1HB ALA 95 7.437 43.929 -2.438 678 HB2 ALA 95 2HB ALA 95 6.182 44.292 -3.624 679 HB3 ALA 95 3HB ALA 95 6.115 45.019 -2.019 680 H ARG 96 H ARG 96 3.251 43.871 -2.514 681 HA ARG 96 HA ARG 96 2.740 45.043 0.020 682 HB2 ARG 96 1HB ARG 96 1.343 44.747 -2.533 683 HB3 ARG 96 2HB ARG 96 0.263 44.698 -1.146 684 HG2 ARG 96 1HG ARG 96 0.703 46.863 -0.548 685 HG3 ARG 96 2HG ARG 96 2.302 46.858 -1.293 686 HD2 ARG 96 1HD ARG 96 1.497 47.649 -3.213 687 HD3 ARG 96 2HD ARG 96 0.223 46.430 -3.254 688 HE ARG 96 HE ARG 96 -0.050 49.153 -2.488 689 HH11 ARG 96 1HH1 ARG 96 -1.219 45.947 -1.800 690 HH12 ARG 96 2HH1 ARG 96 -2.758 46.491 -1.220 691 HH21 ARG 96 1HH2 ARG 96 -2.073 49.882 -1.726 692 HH22 ARG 96 2HH2 ARG 96 -3.243 48.730 -1.179 693 H GLY 97 H GLY 97 0.964 42.376 -1.560 694 HA2 GLY 97 1HA GLY 97 -0.005 40.485 -0.689 695 HA3 GLY 97 2HA GLY 97 1.177 40.586 0.607 696 H ALA 98 H ALA 98 -1.464 39.705 0.973 697 HA ALA 98 HA ALA 98 -3.194 41.730 1.911 698 HB1 ALA 98 1HB ALA 98 -4.624 40.045 2.198 699 HB2 ALA 98 2HB ALA 98 -3.373 39.006 1.515 700 HB3 ALA 98 3HB ALA 98 -3.517 39.180 3.265 701 H GLY 99 H GLY 99 -3.833 42.126 4.141 702 HA2 GLY 99 1HA GLY 99 -1.478 42.230 5.880 703 HA3 GLY 99 2HA GLY 99 -2.943 43.183 6.065 704 H GLY 100 H GLY 100 -1.340 40.209 6.814 705 HA2 GLY 100 1HA GLY 100 -2.033 39.368 9.078 706 HA3 GLY 100 2HA GLY 100 -3.670 39.397 8.440 707 H VAL 101 H VAL 101 -4.184 37.944 6.670 708 HA VAL 101 HA VAL 101 -3.283 35.322 7.140 709 HB VAL 101 HB VAL 101 -4.751 36.403 4.730 710 HG11 VAL 101 1HG1 VAL 101 -3.866 33.703 5.501 711 HG12 VAL 101 2HG1 VAL 101 -5.541 33.832 4.962 712 HG13 VAL 101 3HG1 VAL 101 -4.231 34.369 3.910 713 HG21 VAL 101 3HG2 VAL 101 -5.844 36.765 6.954 714 HG22 VAL 101 1HG2 VAL 101 -6.770 35.764 5.835 715 HG23 VAL 101 2HG2 VAL 101 -5.875 35.013 7.157 716 H ILE 102 H ILE 102 -2.299 37.768 4.833 717 HA ILE 102 HA ILE 102 -0.308 35.890 3.742 718 HB ILE 102 HB ILE 102 -1.336 38.412 2.438 719 HG12 ILE 102 1HG1 ILE 102 -3.078 36.662 2.602 720 HG13 ILE 102 2HG1 ILE 102 -2.586 36.955 0.938 721 HG21 ILE 102 1HG2 ILE 102 -0.247 36.829 0.489 722 HG22 ILE 102 2HG2 ILE 102 0.557 38.191 1.268 723 HG23 ILE 102 3HG2 ILE 102 0.836 36.551 1.853 724 HD11 ILE 102 3HD1 ILE 102 -1.178 34.961 1.010 725 HD12 ILE 102 1HD1 ILE 102 -1.691 34.665 2.671 726 HD13 ILE 102 2HD1 ILE 102 -2.866 34.588 1.358 727 HA PRO 103 HA PRO 103 2.010 39.057 6.224 728 HB2 PRO 103 1HB PRO 103 3.686 37.261 7.379 729 HB3 PRO 103 2HB PRO 103 2.101 37.664 8.049 730 HG2 PRO 103 1HG PRO 103 2.910 35.314 6.380 731 HG3 PRO 103 2HG PRO 103 1.868 35.362 7.814 732 HD2 PRO 103 1HD PRO 103 0.878 35.228 5.297 733 HD3 PRO 103 2HD PRO 103 0.033 36.071 6.612 734 HA PRO 104 HA PRO 104 5.488 39.355 3.551 735 HB2 PRO 104 1HB PRO 104 7.450 40.228 5.213 736 HB3 PRO 104 2HB PRO 104 6.101 41.248 4.700 737 HG2 PRO 104 1HG PRO 104 6.467 39.736 7.258 738 HG3 PRO 104 2HG PRO 104 5.856 41.382 7.009 739 HD2 PRO 104 1HD PRO 104 4.218 39.271 7.447 740 HD3 PRO 104 2HD PRO 104 3.750 40.647 6.429 741 H ASN 105 H ASN 105 7.264 38.239 2.802 742 HA ASN 105 HA ASN 105 8.678 36.477 2.542 743 HB2 ASN 105 1HB ASN 105 8.995 36.547 5.545 744 HB3 ASN 105 2HB ASN 105 10.157 35.969 4.355 745 HD21 ASN 105 2HD2 ASN 105 10.032 38.189 6.471 746 HD22 ASN 105 1HD2 ASN 105 10.657 39.566 5.636 747 H ALA 106 H ALA 106 5.857 35.943 2.960 748 HA ALA 106 HA ALA 106 5.955 33.318 4.285 749 HB1 ALA 106 1HB ALA 106 3.812 33.583 4.946 750 HB2 ALA 106 2HB ALA 106 4.199 35.293 4.750 751 HB3 ALA 106 3HB ALA 106 3.346 34.430 3.470 752 H THR 107 H THR 107 5.827 31.522 3.105 753 HA THR 107 HA THR 107 5.547 31.734 0.230 754 HB THR 107 HB THR 107 6.109 29.342 1.991 755 HG1 THR 107 HG1 THR 107 8.182 29.763 1.579 756 HG21 THR 107 3HG2 THR 107 5.195 28.358 0.102 757 HG22 THR 107 1HG2 THR 107 6.905 28.434 -0.319 758 HG23 THR 107 2HG2 THR 107 5.783 29.628 -0.970 759 H LEU 108 H LEU 108 3.756 31.328 -0.893 760 HA LEU 108 HA LEU 108 1.423 30.286 0.531 761 HB2 LEU 108 1HB LEU 108 1.811 31.878 -1.970 762 HB3 LEU 108 2HB LEU 108 0.304 31.004 -1.701 763 HG LEU 108 HG LEU 108 0.057 33.327 -1.068 764 HD11 LEU 108 1HD1 LEU 108 -1.317 32.647 0.529 765 HD12 LEU 108 2HD1 LEU 108 0.037 32.446 1.641 766 HD13 LEU 108 3HD1 LEU 108 -0.457 31.109 0.602 767 HD21 LEU 108 3HD2 LEU 108 1.393 34.431 0.509 768 HD22 LEU 108 1HD2 LEU 108 2.539 33.572 -0.520 769 HD23 LEU 108 2HD2 LEU 108 2.128 32.928 1.070 770 H VAL 109 H VAL 109 0.583 28.334 0.144 771 HA VAL 109 HA VAL 109 1.827 26.696 -1.945 772 HB VAL 109 HB VAL 109 0.154 25.884 0.435 773 HG11 VAL 109 1HG1 VAL 109 -0.249 24.015 -0.712 774 HG12 VAL 109 2HG1 VAL 109 0.895 24.456 -1.981 775 HG13 VAL 109 3HG1 VAL 109 1.465 23.646 -0.521 776 HG21 VAL 109 3HG2 VAL 109 2.498 24.718 0.874 777 HG22 VAL 109 1HG2 VAL 109 3.069 26.087 -0.080 778 HG23 VAL 109 2HG2 VAL 109 2.160 26.365 1.406 779 H PHE 110 H PHE 110 0.777 26.646 -3.816 780 HA PHE 110 HA PHE 110 -2.169 26.605 -3.770 781 HB2 PHE 110 1HB PHE 110 -0.253 27.823 -5.751 782 HB3 PHE 110 2HB PHE 110 -1.931 27.492 -6.164 783 HD1 PHE 110 HD1 PHE 110 -3.740 28.557 -4.723 784 HD2 PHE 110 HD2 PHE 110 0.335 29.783 -4.647 785 HE1 PHE 110 HE1 PHE 110 -4.409 30.708 -3.733 786 HE2 PHE 110 HE2 PHE 110 -0.327 31.936 -3.657 787 HZ PHE 110 HZ PHE 110 -2.702 32.400 -3.198 788 H GLU 111 H GLU 111 -3.187 24.933 -4.703 789 HA GLU 111 HA GLU 111 -1.519 22.890 -5.991 790 HB2 GLU 111 1HB GLU 111 -3.037 22.440 -3.930 791 HB3 GLU 111 2HB GLU 111 -4.351 22.456 -5.097 792 HG2 GLU 111 1HG GLU 111 -3.041 20.705 -6.379 793 HG3 GLU 111 2HG GLU 111 -2.026 20.568 -4.945 794 H VAL 112 H VAL 112 -1.767 22.370 -8.075 795 HA VAL 112 HA VAL 112 -4.029 23.580 -9.529 796 HB VAL 112 HB VAL 112 -1.346 22.854 -10.704 797 HG11 VAL 112 1HG1 VAL 112 -2.075 23.738 -12.681 798 HG12 VAL 112 2HG1 VAL 112 -3.602 23.113 -12.055 799 HG13 VAL 112 3HG1 VAL 112 -3.220 24.828 -11.900 800 HG21 VAL 112 3HG2 VAL 112 -0.595 24.621 -9.531 801 HG22 VAL 112 1HG2 VAL 112 -1.431 25.564 -10.765 802 HG23 VAL 112 2HG2 VAL 112 -2.218 25.235 -9.221 803 H GLU 113 H GLU 113 -5.404 22.241 -10.499 804 HA GLU 113 HA GLU 113 -4.500 19.528 -11.183 805 HB2 GLU 113 1HB GLU 113 -5.720 19.183 -9.184 806 HB3 GLU 113 2HB GLU 113 -6.973 20.320 -9.659 807 HG2 GLU 113 1HG GLU 113 -7.821 18.817 -11.300 808 HG3 GLU 113 2HG GLU 113 -6.451 17.728 -11.089 809 H LEU 114 H LEU 114 -4.519 19.576 -13.346 810 HA LEU 114 HA LEU 114 -6.280 21.153 -14.904 811 HB2 LEU 114 1HB LEU 114 -3.996 19.594 -15.338 812 HB3 LEU 114 2HB LEU 114 -5.255 18.875 -16.341 813 HG LEU 114 HG LEU 114 -5.557 21.481 -16.983 814 HD11 LEU 114 1HD1 LEU 114 -2.630 21.398 -17.095 815 HD12 LEU 114 2HD1 LEU 114 -3.300 21.615 -15.479 816 HD13 LEU 114 3HD1 LEU 114 -3.719 22.745 -16.767 817 HD21 LEU 114 3HD2 LEU 114 -3.467 19.788 -18.318 818 HD22 LEU 114 1HD2 LEU 114 -4.593 20.932 -19.047 819 HD23 LEU 114 2HD2 LEU 114 -5.185 19.398 -18.410 820 H LEU 115 H LEU 115 -8.227 20.729 -15.773 821 HA LEU 115 HA LEU 115 -9.414 18.100 -15.192 822 HB2 LEU 115 1HB LEU 115 -10.665 20.812 -15.561 823 HB3 LEU 115 2HB LEU 115 -11.596 19.318 -15.483 824 HG LEU 115 HG LEU 115 -9.767 19.793 -13.221 825 HD11 LEU 115 1HD1 LEU 115 -12.124 21.229 -12.611 826 HD12 LEU 115 2HD1 LEU 115 -11.470 21.894 -14.107 827 HD13 LEU 115 3HD1 LEU 115 -10.463 21.820 -12.661 828 HD21 LEU 115 3HD2 LEU 115 -11.070 18.024 -12.719 829 HD22 LEU 115 1HD2 LEU 115 -12.366 18.534 -13.801 830 HD23 LEU 115 2HD2 LEU 115 -12.210 19.268 -12.204 831 H ASP 116 H ASP 116 -9.247 20.649 -17.653 832 HA ASP 116 HA ASP 116 -9.199 18.730 -19.770 833 HB2 ASP 116 1HB ASP 116 -11.652 18.854 -19.161 834 HB3 ASP 116 2HB ASP 116 -11.620 20.535 -19.689 835 H VAL 117 H VAL 117 -8.415 19.591 -21.657 836 HA VAL 117 HA VAL 117 -8.082 22.511 -21.774 837 HB VAL 117 HB VAL 117 -5.979 21.434 -20.970 838 HG11 VAL 117 1HG1 VAL 117 -6.193 19.327 -22.199 839 HG12 VAL 117 2HG1 VAL 117 -5.948 20.189 -23.719 840 HG13 VAL 117 3HG1 VAL 117 -4.649 20.113 -22.527 841 HG21 VAL 117 3HG2 VAL 117 -5.012 22.381 -23.514 842 HG22 VAL 117 1HG2 VAL 117 -6.340 23.388 -22.934 843 HG23 VAL 117 2HG2 VAL 117 -4.915 23.140 -21.925 844 H11 L2S 130 1H1 L2S 130 -5.094 31.443 -9.025 845 H21 L2S 130 2H1 L2S 130 -4.920 31.980 -10.765 846 H12 L2S 130 1H2 L2S 130 -4.275 34.170 -10.039 847 H22 L2S 130 2H2 L2S 130 -3.145 32.917 -9.330 848 H13 L2S 130 2H3 L2S 130 -4.345 33.059 -7.244 849 H23 L2S 130 1H3 L2S 130 -3.843 34.745 -7.730 850 H14 L2S 130 1H4 L2S 130 -7.031 32.533 -7.664 851 H24 L2S 130 2H4 L2S 130 -7.863 33.940 -8.475 852 H15 L2S 130 1H5 L2S 130 -7.277 32.035 -10.016 853 H25 L2S 130 2H5 L2S 130 -6.582 33.677 -10.429 854 H17 L2S 130 1H7 L2S 130 -7.673 36.890 -6.600 855 H27 L2S 130 2H7 L2S 130 -8.100 35.829 -8.045 856 H9 L2S 130 H9 L2S 130 -9.345 37.370 -4.767 857 H10 L2S 130 H10 L2S 130 -8.608 38.520 -2.679 858 H112 L2S 130 1H12 L2S 130 -6.466 34.912 -1.458 859 H113 L2S 130 1H13 L2S 130 -7.169 33.799 -3.568 860 H114 L2S 130 1H14 L2S 130 -6.757 36.680 -0.041 861 H214 L2S 130 2H14 L2S 130 -7.909 38.000 -0.358 862 H314 L2S 130 3H14 L2S 130 -6.253 38.077 -1.054 Start of MODEL 9 1 H1 GLY 1 H GLY 1 1.249 4.266 -11.125 2 HA2 GLY 1 1HA GLY 1 0.604 2.580 -9.369 3 HA3 GLY 1 2HA GLY 1 1.836 1.559 -10.095 4 HA PRO 2 HA PRO 2 4.933 3.237 -7.494 5 HB2 PRO 2 1HB PRO 2 7.062 3.531 -9.152 6 HB3 PRO 2 2HB PRO 2 6.473 1.953 -8.617 7 HG2 PRO 2 1HG PRO 2 5.977 3.384 -11.199 8 HG3 PRO 2 2HG PRO 2 6.347 1.672 -10.922 9 HD2 PRO 2 1HD PRO 2 3.832 2.562 -11.384 10 HD3 PRO 2 2HD PRO 2 4.175 1.166 -10.342 11 H GLY 3 H GLY 3 6.534 5.063 -7.225 12 HA2 GLY 3 1HA GLY 3 6.572 7.346 -8.822 13 HA3 GLY 3 2HA GLY 3 5.236 7.535 -7.696 14 H SER 4 H SER 4 6.883 9.433 -7.329 15 HA SER 4 HA SER 4 8.305 8.752 -4.877 16 HB2 SER 4 1HB SER 4 10.220 10.301 -5.765 17 HB3 SER 4 2HB SER 4 10.181 8.604 -6.245 18 HG SER 4 HG SER 4 9.794 10.881 -7.753 19 H MET 5 H MET 5 7.516 10.085 -3.400 20 HA MET 5 HA MET 5 6.322 12.606 -4.145 21 HB2 MET 5 1HB MET 5 6.517 10.998 -1.632 22 HB3 MET 5 2HB MET 5 6.111 12.706 -1.519 23 HG2 MET 5 1HG MET 5 4.216 12.331 -3.042 24 HG3 MET 5 2HG MET 5 4.607 10.613 -3.071 25 HE1 MET 5 3HE MET 5 3.794 9.056 -0.118 26 HE2 MET 5 1HE MET 5 2.365 9.263 -1.131 27 HE3 MET 5 2HE MET 5 3.953 9.076 -1.875 28 H THR 6 H THR 6 7.700 14.206 -4.623 29 HA THR 6 HA THR 6 9.397 15.255 -2.559 30 HB THR 6 HB THR 6 10.933 13.590 -3.447 31 HG1 THR 6 HG1 THR 6 12.468 15.035 -3.297 32 HG21 THR 6 3HG2 THR 6 11.619 13.521 -5.738 33 HG22 THR 6 1HG2 THR 6 10.684 14.966 -6.120 34 HG23 THR 6 2HG2 THR 6 9.857 13.463 -5.712 35 H VAL 7 H VAL 7 10.018 17.392 -2.933 36 HA VAL 7 HA VAL 7 8.667 18.658 -5.219 37 HB VAL 7 HB VAL 7 7.957 19.388 -2.954 38 HG11 VAL 7 1HG1 VAL 7 10.731 20.553 -2.743 39 HG12 VAL 7 2HG1 VAL 7 9.429 20.688 -1.559 40 HG13 VAL 7 3HG1 VAL 7 10.174 19.121 -1.877 41 HG21 VAL 7 3HG2 VAL 7 7.899 20.853 -5.012 42 HG22 VAL 7 1HG2 VAL 7 7.876 21.699 -3.465 43 HG23 VAL 7 2HG2 VAL 7 9.367 21.618 -4.403 44 H VAL 8 H VAL 8 9.777 19.817 -6.688 45 HA VAL 8 HA VAL 8 12.674 20.145 -6.246 46 HB VAL 8 HB VAL 8 12.135 18.530 -8.036 47 HG11 VAL 8 1HG1 VAL 8 11.220 20.621 -9.893 48 HG12 VAL 8 2HG1 VAL 8 10.722 18.935 -9.743 49 HG13 VAL 8 3HG1 VAL 8 10.061 20.151 -8.650 50 HG21 VAL 8 3HG2 VAL 8 13.594 19.487 -9.737 51 HG22 VAL 8 1HG2 VAL 8 13.367 21.093 -9.045 52 HG23 VAL 8 2HG2 VAL 8 14.203 19.845 -8.121 53 H THR 9 H THR 9 13.657 22.059 -6.898 54 HA THR 9 HA THR 9 11.798 24.286 -7.418 55 HB THR 9 HB THR 9 14.544 24.605 -6.223 56 HG1 THR 9 HG1 THR 9 13.638 23.454 -4.637 57 HG21 THR 9 3HG2 THR 9 13.662 26.661 -7.002 58 HG22 THR 9 1HG2 THR 9 13.396 26.653 -5.259 59 HG23 THR 9 2HG2 THR 9 12.060 26.303 -6.357 60 H THR 10 H THR 10 12.606 26.051 -8.733 61 HA THR 10 HA THR 10 14.628 25.172 -10.691 62 HB THR 10 HB THR 10 13.415 26.438 -12.413 63 HG1 THR 10 HG1 THR 10 12.368 27.915 -10.940 64 HG21 THR 10 3HG2 THR 10 12.905 23.983 -11.775 65 HG22 THR 10 1HG2 THR 10 11.780 24.831 -12.836 66 HG23 THR 10 2HG2 THR 10 11.398 24.630 -11.126 67 H GLU 11 H GLU 11 15.118 27.339 -12.117 68 HA GLU 11 HA GLU 11 16.659 28.967 -10.378 69 HB2 GLU 11 1HB GLU 11 16.006 29.132 -13.314 70 HB3 GLU 11 2HB GLU 11 16.995 30.344 -12.513 71 HG2 GLU 11 1HG GLU 11 18.740 28.885 -12.156 72 HG3 GLU 11 2HG GLU 11 17.707 27.460 -12.263 73 H SER 12 H SER 12 13.492 29.268 -11.792 74 HA SER 12 HA SER 12 13.160 32.056 -11.443 75 HB2 SER 12 1HB SER 12 11.324 29.739 -11.896 76 HB3 SER 12 2HB SER 12 10.631 31.278 -11.382 77 HG SER 12 HG SER 12 11.162 30.652 -13.797 78 H GLY 13 H GLY 13 12.935 29.349 -9.284 79 HA2 GLY 13 1HA GLY 13 13.207 29.831 -6.907 80 HA3 GLY 13 2HA GLY 13 12.139 31.208 -7.132 81 H LEU 14 H LEU 14 10.099 30.044 -8.609 82 HA LEU 14 HA LEU 14 8.432 29.015 -6.668 83 HB2 LEU 14 1HB LEU 14 6.879 28.621 -8.344 84 HB3 LEU 14 2HB LEU 14 7.887 29.906 -9.007 85 HG LEU 14 HG LEU 14 8.162 26.985 -9.711 86 HD11 LEU 14 1HD1 LEU 14 5.998 28.014 -10.421 87 HD12 LEU 14 2HD1 LEU 14 7.021 27.461 -11.747 88 HD13 LEU 14 3HD1 LEU 14 6.928 29.180 -11.363 89 HD21 LEU 14 3HD2 LEU 14 9.532 27.847 -11.556 90 HD22 LEU 14 1HD2 LEU 14 10.219 28.248 -9.982 91 HD23 LEU 14 2HD2 LEU 14 9.364 29.480 -10.909 92 H LYS 15 H LYS 15 7.359 26.820 -6.719 93 HA LYS 15 HA LYS 15 9.178 24.648 -7.437 94 HB2 LYS 15 1HB LYS 15 8.037 25.015 -4.660 95 HB3 LYS 15 2HB LYS 15 8.937 23.609 -5.214 96 HG2 LYS 15 1HG LYS 15 10.930 24.907 -5.477 97 HG3 LYS 15 2HG LYS 15 10.053 26.404 -5.151 98 HD2 LYS 15 1HD LYS 15 10.133 24.177 -3.141 99 HD3 LYS 15 2HD LYS 15 11.441 25.358 -3.250 100 HE2 LYS 15 1HE LYS 15 9.969 27.155 -2.751 101 HE3 LYS 15 2HE LYS 15 8.547 26.131 -2.944 102 HZ1 LYS 15 3HZ LYS 15 9.578 26.700 -0.588 103 HZ2 LYS 15 1HZ LYS 15 10.495 25.320 -0.932 104 HZ3 LYS 15 2HZ LYS 15 8.806 25.228 -0.902 105 H TYR 16 H TYR 16 8.130 22.505 -7.261 106 HA TYR 16 HA TYR 16 5.245 22.449 -7.093 107 HB2 TYR 16 1HB TYR 16 5.026 21.440 -9.392 108 HB3 TYR 16 2HB TYR 16 5.413 23.157 -9.371 109 HD1 TYR 16 HD2 TYR 16 6.794 19.782 -9.955 110 HD2 TYR 16 HD1 TYR 16 7.446 23.972 -10.306 111 HE1 TYR 16 HE2 TYR 16 8.744 19.353 -11.391 112 HE2 TYR 16 HE1 TYR 16 9.397 23.554 -11.744 113 HH TYR 16 HH TYR 16 10.760 20.428 -12.129 114 H GLU 17 H GLU 17 4.468 20.450 -6.593 115 HA GLU 17 HA GLU 17 6.377 18.209 -6.647 116 HB2 GLU 17 1HB GLU 17 5.285 17.450 -4.489 117 HB3 GLU 17 2HB GLU 17 6.325 18.863 -4.372 118 HG2 GLU 17 1HG GLU 17 4.312 20.298 -4.469 119 HG3 GLU 17 2HG GLU 17 3.318 18.842 -4.451 120 H ASP 18 H ASP 18 5.640 16.610 -7.860 121 HA ASP 18 HA ASP 18 3.157 16.464 -9.053 122 HB2 ASP 18 1HB ASP 18 3.720 13.940 -9.249 123 HB3 ASP 18 2HB ASP 18 4.796 15.106 -10.014 124 H LEU 19 H LEU 19 1.194 15.668 -8.529 125 HA LEU 19 HA LEU 19 0.906 14.430 -5.870 126 HB2 LEU 19 1HB LEU 19 -0.832 16.429 -7.286 127 HB3 LEU 19 2HB LEU 19 -1.431 15.447 -5.950 128 HG LEU 19 HG LEU 19 0.840 17.430 -5.805 129 HD11 LEU 19 1HD1 LEU 19 -1.108 18.250 -4.077 130 HD12 LEU 19 2HD1 LEU 19 -2.051 17.651 -5.441 131 HD13 LEU 19 3HD1 LEU 19 -0.836 18.905 -5.692 132 HD21 LEU 19 3HD2 LEU 19 0.370 17.004 -3.286 133 HD22 LEU 19 1HD2 LEU 19 1.373 15.867 -4.188 134 HD23 LEU 19 2HD2 LEU 19 -0.316 15.481 -3.854 135 H THR 20 H THR 20 -0.117 14.481 -9.218 136 HA THR 20 HA THR 20 -0.884 11.717 -9.088 137 HB THR 20 HB THR 20 -3.071 13.586 -9.967 138 HG1 THR 20 HG1 THR 20 -3.745 13.787 -7.951 139 HG21 THR 20 3HG2 THR 20 -3.134 11.227 -10.701 140 HG22 THR 20 1HG2 THR 20 -4.481 11.636 -9.638 141 HG23 THR 20 2HG2 THR 20 -3.109 10.720 -9.012 142 H GLU 21 H GLU 21 0.018 10.933 -10.868 143 HA GLU 21 HA GLU 21 0.931 12.377 -13.039 144 HB2 GLU 21 1HB GLU 21 1.534 10.012 -12.446 145 HB3 GLU 21 2HB GLU 21 0.002 9.505 -13.143 146 HG2 GLU 21 1HG GLU 21 0.663 10.267 -15.313 147 HG3 GLU 21 2HG GLU 21 2.130 10.994 -14.659 148 H GLY 22 H GLY 22 0.141 12.913 -15.044 149 HA2 GLY 22 1HA GLY 22 -2.717 12.352 -15.525 150 HA3 GLY 22 2HA GLY 22 -2.059 13.969 -15.731 151 H SER 23 H SER 23 -2.722 11.025 -17.231 152 HA SER 23 HA SER 23 -0.896 11.591 -19.461 153 HB2 SER 23 1HB SER 23 -2.315 9.116 -18.528 154 HB3 SER 23 2HB SER 23 -1.792 9.248 -20.207 155 HG SER 23 HG SER 23 -0.265 8.286 -18.639 156 H GLY 24 H GLY 24 -2.415 13.449 -19.900 157 HA2 GLY 24 1HA GLY 24 -4.602 12.500 -21.644 158 HA3 GLY 24 2HA GLY 24 -4.800 13.895 -20.595 159 H ALA 25 H ALA 25 -3.109 15.654 -20.941 160 HA ALA 25 HA ALA 25 -1.733 15.885 -23.383 161 HB1 ALA 25 1HB ALA 25 -4.510 16.239 -23.655 162 HB2 ALA 25 2HB ALA 25 -3.784 17.842 -23.771 163 HB3 ALA 25 3HB ALA 25 -3.253 16.554 -24.853 164 H GLU 26 H GLU 26 -0.258 17.445 -23.148 165 HA GLU 26 HA GLU 26 -0.236 19.056 -20.797 166 HB2 GLU 26 1HB GLU 26 1.862 18.287 -21.645 167 HB3 GLU 26 2HB GLU 26 1.542 18.972 -23.232 168 HG2 GLU 26 1HG GLU 26 1.664 21.222 -22.284 169 HG3 GLU 26 2HG GLU 26 1.998 20.531 -20.698 170 H ALA 27 H ALA 27 -0.839 21.117 -20.495 171 HA ALA 27 HA ALA 27 -2.619 22.416 -22.158 172 HB1 ALA 27 1HB ALA 27 -0.931 24.189 -20.524 173 HB2 ALA 27 2HB ALA 27 -2.685 24.010 -20.568 174 HB3 ALA 27 3HB ALA 27 -1.704 22.861 -19.659 175 H ARG 28 H ARG 28 -2.487 24.027 -23.690 176 HA ARG 28 HA ARG 28 0.185 24.435 -24.853 177 HB2 ARG 28 1HB ARG 28 -2.563 24.478 -26.098 178 HB3 ARG 28 2HB ARG 28 -1.127 25.053 -26.934 179 HG2 ARG 28 1HG ARG 28 -1.580 22.258 -25.909 180 HG3 ARG 28 2HG ARG 28 -1.669 22.782 -27.592 181 HD2 ARG 28 1HD ARG 28 0.741 23.577 -27.282 182 HD3 ARG 28 2HD ARG 28 0.739 22.615 -25.805 183 HE ARG 28 HE ARG 28 0.972 20.752 -27.093 184 HH11 ARG 28 1HH1 ARG 28 -0.338 23.303 -29.066 185 HH12 ARG 28 2HH1 ARG 28 -0.275 22.380 -30.531 186 HH21 ARG 28 1HH2 ARG 28 1.060 19.526 -29.015 187 HH22 ARG 28 2HH2 ARG 28 0.520 20.231 -30.501 188 H ALA 29 H ALA 29 0.852 26.493 -25.472 189 HA ALA 29 HA ALA 29 -0.153 28.637 -23.874 190 HB1 ALA 29 1HB ALA 29 1.839 29.550 -24.265 191 HB2 ALA 29 2HB ALA 29 2.244 28.071 -25.137 192 HB3 ALA 29 3HB ALA 29 1.617 29.466 -26.013 193 H GLY 30 H GLY 30 -1.707 30.047 -24.347 194 HA2 GLY 30 1HA GLY 30 -2.840 31.592 -25.725 195 HA3 GLY 30 2HA GLY 30 -2.235 30.740 -27.138 196 H GLN 31 H GLN 31 -3.337 28.460 -25.015 197 HA GLN 31 HA GLN 31 -5.991 28.421 -26.294 198 HB2 GLN 31 1HB GLN 31 -4.071 26.209 -25.640 199 HB3 GLN 31 2HB GLN 31 -5.793 25.879 -25.778 200 HG2 GLN 31 1HG GLN 31 -5.830 26.548 -28.049 201 HG3 GLN 31 2HG GLN 31 -4.206 27.223 -27.945 202 HE21 GLN 31 2HE2 GLN 31 -5.735 24.128 -27.107 203 HE22 GLN 31 1HE2 GLN 31 -4.574 23.141 -27.920 204 H THR 32 H THR 32 -7.772 27.774 -25.059 205 HA THR 32 HA THR 32 -7.684 28.546 -22.324 206 HB THR 32 HB THR 32 -10.005 26.960 -23.267 207 HG1 THR 32 HG1 THR 32 -10.701 28.683 -24.604 208 HG21 THR 32 3HG2 THR 32 -10.397 28.005 -21.237 209 HG22 THR 32 1HG2 THR 32 -11.096 29.154 -22.376 210 HG23 THR 32 2HG2 THR 32 -9.499 29.453 -21.690 211 H VAL 33 H VAL 33 -8.604 27.146 -20.564 212 HA VAL 33 HA VAL 33 -8.443 24.317 -20.751 213 HB VAL 33 HB VAL 33 -6.038 24.750 -20.844 214 HG11 VAL 33 1HG1 VAL 33 -4.963 26.242 -19.572 215 HG12 VAL 33 2HG1 VAL 33 -6.567 26.862 -19.174 216 HG13 VAL 33 3HG1 VAL 33 -5.774 25.707 -18.101 217 HG21 VAL 33 3HG2 VAL 33 -7.067 23.545 -18.284 218 HG22 VAL 33 1HG2 VAL 33 -6.656 22.716 -19.785 219 HG23 VAL 33 2HG2 VAL 33 -5.384 23.435 -18.798 220 H SER 34 H SER 34 -9.475 23.383 -19.067 221 HA SER 34 HA SER 34 -10.344 25.166 -16.900 222 HB2 SER 34 1HB SER 34 -11.840 23.563 -18.547 223 HB3 SER 34 2HB SER 34 -11.655 22.542 -17.121 224 HG SER 34 HG SER 34 -12.326 25.217 -16.715 225 H VAL 35 H VAL 35 -9.436 24.935 -14.977 226 HA VAL 35 HA VAL 35 -8.695 22.271 -14.031 227 HB VAL 35 HB VAL 35 -6.488 22.803 -13.441 228 HG11 VAL 35 1HG1 VAL 35 -5.416 23.333 -15.510 229 HG12 VAL 35 2HG1 VAL 35 -6.883 22.426 -15.881 230 HG13 VAL 35 3HG1 VAL 35 -6.848 24.176 -16.099 231 HG21 VAL 35 3HG2 VAL 35 -5.807 25.335 -14.151 232 HG22 VAL 35 1HG2 VAL 35 -7.458 25.570 -13.578 233 HG23 VAL 35 2HG2 VAL 35 -6.252 24.841 -12.518 234 H HIS 36 H HIS 36 -8.197 22.257 -11.692 235 HA HIS 36 HA HIS 36 -9.824 24.273 -10.300 236 HB2 HIS 36 1HB HIS 36 -9.454 21.367 -9.979 237 HB3 HIS 36 2HB HIS 36 -9.481 22.279 -8.472 238 HD1 HIS 36 HD1 HIS 36 -11.627 24.391 -9.356 239 HD2 HIS 36 HD2 HIS 36 -11.967 20.275 -9.808 240 HE1 HIS 36 HE1 HIS 36 -14.095 23.932 -9.498 241 H TYR 37 H TYR 37 -8.938 25.566 -8.806 242 HA TYR 37 HA TYR 37 -6.139 25.048 -8.042 243 HB2 TYR 37 1HB TYR 37 -5.835 27.454 -7.854 244 HB3 TYR 37 2HB TYR 37 -6.443 27.055 -9.457 245 HD1 TYR 37 HD2 TYR 37 -7.421 28.402 -6.148 246 HD2 TYR 37 HD1 TYR 37 -8.481 27.957 -10.244 247 HE1 TYR 37 HE2 TYR 37 -9.266 29.998 -5.838 248 HE2 TYR 37 HE1 TYR 37 -10.328 29.554 -9.946 249 HH TYR 37 HH TYR 37 -10.590 31.605 -7.394 250 H THR 38 H THR 38 -5.537 25.253 -5.916 251 HA THR 38 HA THR 38 -7.626 25.931 -3.965 252 HB THR 38 HB THR 38 -5.945 23.829 -2.930 253 HG1 THR 38 HG1 THR 38 -6.519 22.185 -4.326 254 HG21 THR 38 3HG2 THR 38 -7.869 23.864 -1.764 255 HG22 THR 38 1HG2 THR 38 -8.484 22.830 -3.053 256 HG23 THR 38 2HG2 THR 38 -8.779 24.568 -3.100 257 H GLY 39 H GLY 39 -6.872 27.614 -2.859 258 HA2 GLY 39 1HA GLY 39 -4.009 28.006 -2.537 259 HA3 GLY 39 2HA GLY 39 -5.276 29.136 -2.083 260 H TRP 40 H TRP 40 -2.872 27.447 -0.810 261 HA TRP 40 HA TRP 40 -4.282 27.086 1.747 262 HB2 TRP 40 1HB TRP 40 -2.302 25.236 0.430 263 HB3 TRP 40 2HB TRP 40 -2.594 25.198 2.167 264 HD1 TRP 40 HD1 TRP 40 -5.716 25.443 2.255 265 HE1 TRP 40 HE1 TRP 40 -7.198 23.530 1.379 266 HE3 TRP 40 HE3 TRP 40 -2.337 23.137 -0.811 267 HZ2 TRP 40 HZ2 TRP 40 -6.966 21.333 -0.378 268 HZ3 TRP 40 HZ3 TRP 40 -3.046 21.135 -2.053 269 HH2 TRP 40 HH2 TRP 40 -5.313 20.253 -1.840 270 H LEU 41 H LEU 41 -3.315 27.959 3.494 271 HA LEU 41 HA LEU 41 -1.096 29.716 3.097 272 HB2 LEU 41 1HB LEU 41 -2.964 29.059 5.281 273 HB3 LEU 41 2HB LEU 41 -1.382 29.657 5.778 274 HG LEU 41 HG LEU 41 -3.274 31.107 3.927 275 HD11 LEU 41 1HD1 LEU 41 -3.185 32.661 6.078 276 HD12 LEU 41 2HD1 LEU 41 -2.938 31.106 6.872 277 HD13 LEU 41 3HD1 LEU 41 -4.379 31.376 5.893 278 HD21 LEU 41 3HD2 LEU 41 -1.101 32.519 5.320 279 HD22 LEU 41 1HD2 LEU 41 -1.708 32.703 3.674 280 HD23 LEU 41 2HD2 LEU 41 -0.590 31.394 4.061 281 H THR 42 H THR 42 0.758 29.703 4.713 282 HA THR 42 HA THR 42 2.396 27.523 4.301 283 HB THR 42 HB THR 42 3.838 28.385 6.077 284 HG1 THR 42 HG1 THR 42 2.807 29.213 7.731 285 HG21 THR 42 3HG2 THR 42 2.544 30.375 4.237 286 HG22 THR 42 1HG2 THR 42 4.116 29.590 4.089 287 HG23 THR 42 2HG2 THR 42 3.867 30.841 5.306 288 H ASP 43 H ASP 43 0.332 28.215 7.099 289 HA ASP 43 HA ASP 43 1.106 25.825 8.489 290 HB2 ASP 43 1HB ASP 43 -1.364 27.452 9.064 291 HB3 ASP 43 2HB ASP 43 -0.397 26.496 10.184 292 H GLY 44 H GLY 44 -1.182 26.616 6.059 293 HA2 GLY 44 1HA GLY 44 -2.078 24.661 4.847 294 HA3 GLY 44 2HA GLY 44 -2.448 23.969 6.420 295 H GLN 45 H GLN 45 -3.041 27.231 6.557 296 HA GLN 45 HA GLN 45 -5.861 26.855 6.697 297 HB2 GLN 45 1HB GLN 45 -3.962 29.077 7.113 298 HB3 GLN 45 2HB GLN 45 -5.582 29.552 6.621 299 HG2 GLN 45 1HG GLN 45 -6.312 27.918 8.529 300 HG3 GLN 45 2HG GLN 45 -4.675 28.209 9.115 301 HE21 GLN 45 2HE2 GLN 45 -4.342 29.942 10.322 302 HE22 GLN 45 1HE2 GLN 45 -5.427 31.276 10.494 303 H LYS 46 H LYS 46 -7.076 26.551 4.955 304 HA LYS 46 HA LYS 46 -6.339 27.331 2.337 305 HB2 LYS 46 1HB LYS 46 -7.908 25.444 3.006 306 HB3 LYS 46 2HB LYS 46 -9.136 26.677 3.258 307 HG2 LYS 46 1HG LYS 46 -8.700 27.383 0.856 308 HG3 LYS 46 2HG LYS 46 -7.803 25.871 0.694 309 HD2 LYS 46 1HD LYS 46 -10.521 25.719 1.871 310 HD3 LYS 46 2HD LYS 46 -10.407 26.067 0.144 311 HE2 LYS 46 1HE LYS 46 -8.924 24.066 -0.076 312 HE3 LYS 46 2HE LYS 46 -9.275 23.690 1.610 313 HZ1 LYS 46 3HZ LYS 46 -10.673 22.657 -0.330 314 HZ2 LYS 46 1HZ LYS 46 -11.529 24.111 -0.211 315 HZ3 LYS 46 2HZ LYS 46 -11.404 23.091 1.132 316 H PHE 47 H PHE 47 -6.842 29.084 1.131 317 HA PHE 47 HA PHE 47 -8.720 31.053 2.215 318 HB2 PHE 47 1HB PHE 47 -7.154 32.889 1.766 319 HB3 PHE 47 2HB PHE 47 -6.491 31.766 2.949 320 HD1 PHE 47 HD1 PHE 47 -4.613 30.337 2.394 321 HD2 PHE 47 HD2 PHE 47 -6.188 33.107 -0.428 322 HE1 PHE 47 HE1 PHE 47 -2.585 30.087 1.022 323 HE2 PHE 47 HE2 PHE 47 -4.164 32.861 -1.805 324 HZ PHE 47 HZ PHE 47 -2.359 31.349 -1.081 325 H ASP 48 H ASP 48 -8.629 29.095 -0.055 326 HA ASP 48 HA ASP 48 -9.979 30.614 -1.972 327 HB2 ASP 48 1HB ASP 48 -7.294 31.110 -2.180 328 HB3 ASP 48 2HB ASP 48 -7.505 29.793 -3.331 329 H SER 49 H SER 49 -11.300 29.203 -2.895 330 HA SER 49 HA SER 49 -10.329 26.650 -3.853 331 HB2 SER 49 1HB SER 49 -12.391 25.576 -2.586 332 HB3 SER 49 2HB SER 49 -10.827 25.743 -1.789 333 HG SER 49 HG SER 49 -13.145 27.326 -1.483 334 H SER 50 H SER 50 -10.979 27.059 -5.900 335 HA SER 50 HA SER 50 -13.323 28.383 -6.666 336 HB2 SER 50 1HB SER 50 -12.825 26.754 -8.803 337 HB3 SER 50 2HB SER 50 -11.999 28.283 -8.501 338 HG SER 50 HG SER 50 -10.813 26.068 -8.789 339 H LYS 51 H LYS 51 -12.827 25.192 -5.523 340 HA LYS 51 HA LYS 51 -14.905 23.789 -6.739 341 HB2 LYS 51 1HB LYS 51 -13.605 23.546 -4.035 342 HB3 LYS 51 2HB LYS 51 -14.898 22.463 -4.532 343 HG2 LYS 51 1HG LYS 51 -12.495 22.829 -6.269 344 HG3 LYS 51 2HG LYS 51 -12.434 21.754 -4.870 345 HD2 LYS 51 1HD LYS 51 -14.556 20.690 -5.819 346 HD3 LYS 51 2HD LYS 51 -14.183 21.562 -7.308 347 HE2 LYS 51 1HE LYS 51 -13.187 19.497 -7.656 348 HE3 LYS 51 2HE LYS 51 -11.846 20.483 -7.076 349 HZ1 LYS 51 3HZ LYS 51 -12.816 18.103 -5.997 350 HZ2 LYS 51 1HZ LYS 51 -13.138 19.324 -4.871 351 HZ3 LYS 51 2HZ LYS 51 -11.557 19.071 -5.416 352 H ASP 52 H ASP 52 -14.986 26.272 -4.344 353 HA ASP 52 HA ASP 52 -17.375 25.776 -3.032 354 HB2 ASP 52 1HB ASP 52 -15.697 27.645 -2.602 355 HB3 ASP 52 2HB ASP 52 -16.497 28.529 -3.900 356 H ARG 53 H ARG 53 -16.852 27.498 -6.095 357 HA ARG 53 HA ARG 53 -19.633 27.986 -6.529 358 HB2 ARG 53 1HB ARG 53 -17.317 28.071 -8.472 359 HB3 ARG 53 2HB ARG 53 -18.928 28.705 -8.778 360 HG2 ARG 53 1HG ARG 53 -17.268 29.673 -6.477 361 HG3 ARG 53 2HG ARG 53 -17.109 30.354 -8.098 362 HD2 ARG 53 1HD ARG 53 -19.594 30.764 -8.044 363 HD3 ARG 53 2HD ARG 53 -19.551 30.325 -6.337 364 HE ARG 53 HE ARG 53 -17.646 32.345 -6.905 365 HH11 ARG 53 1HH1 ARG 53 -21.060 31.820 -6.475 366 HH12 ARG 53 2HH1 ARG 53 -21.374 33.437 -5.938 367 HH21 ARG 53 1HH2 ARG 53 -18.046 34.477 -6.200 368 HH22 ARG 53 2HH2 ARG 53 -19.658 34.948 -5.783 369 H ASN 54 H ASN 54 -17.779 25.220 -6.734 370 HA ASN 54 HA ASN 54 -18.169 23.128 -7.537 371 HB2 ASN 54 1HB ASN 54 -20.927 24.106 -8.291 372 HB3 ASN 54 2HB ASN 54 -20.428 22.448 -7.970 373 HD21 ASN 54 2HD2 ASN 54 -19.944 21.841 -5.821 374 HD22 ASN 54 1HD2 ASN 54 -20.593 22.721 -4.484 375 H ASP 55 H ASP 55 -16.985 25.077 -9.238 376 HA ASP 55 HA ASP 55 -17.483 23.794 -11.796 377 HB2 ASP 55 1HB ASP 55 -18.948 25.552 -12.207 378 HB3 ASP 55 2HB ASP 55 -18.002 26.696 -11.257 379 HA PRO 56 HA PRO 56 -13.093 24.094 -11.975 380 HB2 PRO 56 1HB PRO 56 -12.756 23.633 -14.629 381 HB3 PRO 56 2HB PRO 56 -13.191 22.362 -13.481 382 HG2 PRO 56 1HG PRO 56 -14.946 23.911 -15.348 383 HG3 PRO 56 2HG PRO 56 -14.958 22.176 -14.982 384 HD2 PRO 56 1HD PRO 56 -16.719 23.911 -13.876 385 HD3 PRO 56 2HD PRO 56 -16.133 22.470 -13.021 386 H PHE 57 H PHE 57 -11.514 25.574 -12.447 387 HA PHE 57 HA PHE 57 -12.398 28.150 -13.398 388 HB2 PHE 57 1HB PHE 57 -10.899 28.061 -11.489 389 HB3 PHE 57 2HB PHE 57 -9.698 27.187 -12.433 390 HD1 PHE 57 HD2 PHE 57 -11.706 30.299 -12.917 391 HD2 PHE 57 HD1 PHE 57 -7.870 28.456 -12.947 392 HE1 PHE 57 HE2 PHE 57 -10.689 32.435 -13.592 393 HE2 PHE 57 HE1 PHE 57 -6.846 30.590 -13.622 394 HZ PHE 57 HZ PHE 57 -8.256 32.583 -13.946 395 H ALA 58 H ALA 58 -12.696 28.251 -15.552 396 HA ALA 58 HA ALA 58 -10.719 27.073 -17.348 397 HB1 ALA 58 1HB ALA 58 -13.311 28.448 -18.040 398 HB2 ALA 58 2HB ALA 58 -12.303 27.476 -19.114 399 HB3 ALA 58 3HB ALA 58 -13.136 26.715 -17.759 400 H PHE 59 H PHE 59 -9.008 28.274 -17.836 401 HA PHE 59 HA PHE 59 -9.428 31.115 -18.463 402 HB2 PHE 59 1HB PHE 59 -7.479 31.782 -17.290 403 HB3 PHE 59 2HB PHE 59 -8.356 30.728 -16.186 404 HD1 PHE 59 HD1 PHE 59 -7.620 28.301 -16.022 405 HD2 PHE 59 HD2 PHE 59 -5.269 31.333 -17.866 406 HE1 PHE 59 HE1 PHE 59 -5.616 26.895 -15.772 407 HE2 PHE 59 HE2 PHE 59 -3.262 29.932 -17.619 408 HZ PHE 59 HZ PHE 59 -3.434 27.709 -16.571 409 H VAL 60 H VAL 60 -7.174 31.937 -19.458 410 HA VAL 60 HA VAL 60 -6.588 30.062 -21.649 411 HB VAL 60 HB VAL 60 -6.170 33.052 -21.639 412 HG11 VAL 60 1HG1 VAL 60 -5.912 32.802 -24.038 413 HG12 VAL 60 2HG1 VAL 60 -4.749 31.778 -23.193 414 HG13 VAL 60 3HG1 VAL 60 -6.196 31.067 -23.910 415 HG21 VAL 60 3HG2 VAL 60 -8.188 32.645 -23.389 416 HG22 VAL 60 1HG2 VAL 60 -8.556 31.415 -22.179 417 HG23 VAL 60 2HG2 VAL 60 -8.424 33.108 -21.704 418 H LEU 61 H LEU 61 -4.604 29.252 -21.846 419 HA LEU 61 HA LEU 61 -2.619 29.494 -19.949 420 HB2 LEU 61 1HB LEU 61 -2.981 27.966 -22.144 421 HB3 LEU 61 2HB LEU 61 -1.683 29.019 -22.703 422 HG LEU 61 HG LEU 61 -0.553 27.169 -21.883 423 HD11 LEU 61 1HD1 LEU 61 0.293 29.275 -20.929 424 HD12 LEU 61 2HD1 LEU 61 0.587 27.890 -19.878 425 HD13 LEU 61 3HD1 LEU 61 -0.717 29.017 -19.507 426 HD21 LEU 61 3HD2 LEU 61 -1.093 26.042 -19.776 427 HD22 LEU 61 1HD2 LEU 61 -2.464 26.039 -20.885 428 HD23 LEU 61 2HD2 LEU 61 -2.434 27.160 -19.523 429 H GLY 62 H GLY 62 -1.306 31.097 -19.395 430 HA2 GLY 62 1HA GLY 62 -0.172 33.095 -19.464 431 HA3 GLY 62 2HA GLY 62 0.339 32.557 -21.057 432 H GLY 63 H GLY 63 -2.819 33.591 -19.763 433 HA2 GLY 63 1HA GLY 63 -3.160 35.287 -22.117 434 HA3 GLY 63 2HA GLY 63 -4.406 34.860 -20.954 435 H GLY 64 H GLY 64 -2.887 35.570 -18.613 436 HA2 GLY 64 1HA GLY 64 -1.679 37.760 -18.072 437 HA3 GLY 64 2HA GLY 64 -3.046 38.501 -18.891 438 H MET 65 H MET 65 -4.531 36.036 -17.560 439 HA MET 65 HA MET 65 -5.196 37.545 -15.136 440 HB2 MET 65 1HB MET 65 -6.678 35.502 -16.768 441 HB3 MET 65 2HB MET 65 -7.177 35.884 -15.126 442 HG2 MET 65 1HG MET 65 -6.814 38.043 -17.163 443 HG3 MET 65 2HG MET 65 -8.303 37.103 -17.085 444 HE1 MET 65 3HE MET 65 -10.018 38.035 -16.445 445 HE2 MET 65 1HE MET 65 -10.272 37.798 -14.716 446 HE3 MET 65 2HE MET 65 -10.248 39.428 -15.387 447 H VAL 66 H VAL 66 -2.800 35.970 -15.244 448 HA VAL 66 HA VAL 66 -3.326 34.242 -12.958 449 HB VAL 66 HB VAL 66 -2.145 32.339 -13.837 450 HG11 VAL 66 1HG1 VAL 66 -4.590 32.632 -14.333 451 HG12 VAL 66 2HG1 VAL 66 -4.125 33.178 -15.945 452 HG13 VAL 66 3HG1 VAL 66 -3.730 31.541 -15.419 453 HG21 VAL 66 3HG2 VAL 66 -0.570 32.688 -15.375 454 HG22 VAL 66 1HG2 VAL 66 -1.866 32.768 -16.568 455 HG23 VAL 66 2HG2 VAL 66 -1.260 34.247 -15.824 456 H ILE 67 H ILE 67 -1.042 33.228 -12.307 457 HA ILE 67 HA ILE 67 0.823 35.503 -12.234 458 HB ILE 67 HB ILE 67 1.617 34.751 -10.140 459 HG12 ILE 67 1HG1 ILE 67 0.040 32.220 -10.644 460 HG13 ILE 67 2HG1 ILE 67 1.793 32.375 -10.589 461 HG21 ILE 67 1HG2 ILE 67 -1.040 35.423 -10.534 462 HG22 ILE 67 2HG2 ILE 67 -1.103 34.042 -9.441 463 HG23 ILE 67 3HG2 ILE 67 -0.161 35.468 -9.006 464 HD11 ILE 67 3HD1 ILE 67 1.011 31.389 -8.551 465 HD12 ILE 67 1HD1 ILE 67 1.617 33.009 -8.210 466 HD13 ILE 67 2HD1 ILE 67 -0.121 32.717 -8.295 467 H LYS 68 H LYS 68 3.152 34.901 -12.013 468 HA LYS 68 HA LYS 68 4.114 33.569 -14.202 469 HB2 LYS 68 1HB LYS 68 5.316 34.201 -11.532 470 HB3 LYS 68 2HB LYS 68 6.229 33.237 -12.686 471 HG2 LYS 68 1HG LYS 68 5.957 35.062 -14.345 472 HG3 LYS 68 2HG LYS 68 5.188 36.033 -13.087 473 HD2 LYS 68 1HD LYS 68 7.367 36.762 -12.944 474 HD3 LYS 68 2HD LYS 68 7.361 35.470 -11.741 475 HE2 LYS 68 1HE LYS 68 8.152 33.943 -13.621 476 HE3 LYS 68 2HE LYS 68 8.462 35.417 -14.538 477 HZ1 LYS 68 3HZ LYS 68 9.644 34.770 -11.890 478 HZ2 LYS 68 1HZ LYS 68 9.970 36.148 -12.816 479 HZ3 LYS 68 2HZ LYS 68 10.440 34.623 -13.376 480 H GLY 69 H GLY 69 3.963 32.232 -10.893 481 HA2 GLY 69 1HA GLY 69 4.857 29.669 -11.466 482 HA3 GLY 69 2HA GLY 69 3.756 30.068 -10.155 483 H TRP 70 H TRP 70 1.707 31.081 -12.018 484 HA TRP 70 HA TRP 70 0.302 28.646 -12.400 485 HB2 TRP 70 1HB TRP 70 -0.295 31.431 -12.454 486 HB3 TRP 70 2HB TRP 70 -0.872 30.727 -13.962 487 HD1 TRP 70 HD1 TRP 70 -3.196 29.654 -13.853 488 HE1 TRP 70 HE1 TRP 70 -4.771 28.860 -11.979 489 HE3 TRP 70 HE3 TRP 70 -0.101 30.348 -9.844 490 HZ2 TRP 70 HZ2 TRP 70 -4.709 28.567 -9.172 491 HZ3 TRP 70 HZ3 TRP 70 -0.935 29.788 -7.599 492 HH2 TRP 70 HH2 TRP 70 -3.193 28.916 -7.272 493 H ASP 71 H ASP 71 1.420 31.053 -14.788 494 HA ASP 71 HA ASP 71 0.859 29.600 -17.078 495 HB2 ASP 71 1HB ASP 71 2.913 31.703 -16.455 496 HB3 ASP 71 2HB ASP 71 2.861 30.947 -18.045 497 H GLU 72 H GLU 72 3.851 29.636 -15.163 498 HA GLU 72 HA GLU 72 5.321 27.878 -16.777 499 HB2 GLU 72 1HB GLU 72 6.248 29.308 -14.944 500 HB3 GLU 72 2HB GLU 72 5.546 28.192 -13.781 501 HG2 GLU 72 1HG GLU 72 7.964 27.839 -14.212 502 HG3 GLU 72 2HG GLU 72 6.960 26.421 -14.508 503 H GLY 73 H GLY 73 3.164 27.269 -14.035 504 HA2 GLY 73 1HA GLY 73 3.639 24.501 -13.818 505 HA3 GLY 73 2HA GLY 73 2.198 25.337 -13.259 506 H VAL 74 H VAL 74 0.750 26.067 -15.208 507 HA VAL 74 HA VAL 74 -0.299 23.764 -16.379 508 HB VAL 74 HB VAL 74 -1.499 25.388 -17.931 509 HG11 VAL 74 1HG1 VAL 74 -3.087 25.578 -16.358 510 HG12 VAL 74 2HG1 VAL 74 -1.966 24.667 -15.345 511 HG13 VAL 74 3HG1 VAL 74 -2.017 26.427 -15.242 512 HG21 VAL 74 3HG2 VAL 74 0.544 27.091 -17.187 513 HG22 VAL 74 1HG2 VAL 74 -0.942 27.547 -18.020 514 HG23 VAL 74 2HG2 VAL 74 -0.841 27.675 -16.264 515 H GLN 75 H GLN 75 2.215 25.907 -17.457 516 HA GLN 75 HA GLN 75 2.245 25.437 -20.186 517 HB2 GLN 75 1HB GLN 75 4.175 26.326 -18.169 518 HB3 GLN 75 2HB GLN 75 4.920 25.534 -19.551 519 HG2 GLN 75 1HG GLN 75 3.893 27.094 -21.064 520 HG3 GLN 75 2HG GLN 75 2.989 27.832 -19.743 521 HE21 GLN 75 2HE2 GLN 75 3.981 29.813 -20.489 522 HE22 GLN 75 1HE2 GLN 75 5.575 30.216 -19.958 523 H GLY 76 H GLY 76 3.026 23.303 -17.588 524 HA2 GLY 76 1HA GLY 76 3.973 21.310 -19.554 525 HA3 GLY 76 2HA GLY 76 4.612 21.411 -17.920 526 H MET 77 H MET 77 1.903 21.973 -16.829 527 HA MET 77 HA MET 77 1.187 19.440 -16.010 528 HB2 MET 77 1HB MET 77 0.262 22.034 -15.570 529 HB3 MET 77 2HB MET 77 -1.137 21.168 -16.191 530 HG2 MET 77 1HG MET 77 -1.117 21.059 -13.794 531 HG3 MET 77 2HG MET 77 -0.819 19.455 -14.460 532 HE1 MET 77 3HE MET 77 2.564 18.466 -13.629 533 HE2 MET 77 1HE MET 77 1.129 18.042 -12.695 534 HE3 MET 77 2HE MET 77 1.022 18.211 -14.448 535 H LYS 78 H LYS 78 -0.359 17.938 -16.624 536 HA LYS 78 HA LYS 78 -1.369 18.241 -19.376 537 HB2 LYS 78 1HB LYS 78 -0.556 15.750 -17.870 538 HB3 LYS 78 2HB LYS 78 -1.358 15.733 -19.435 539 HG2 LYS 78 1HG LYS 78 0.511 16.301 -20.549 540 HG3 LYS 78 2HG LYS 78 1.071 17.385 -19.274 541 HD2 LYS 78 1HD LYS 78 1.072 14.434 -18.809 542 HD3 LYS 78 2HD LYS 78 2.356 15.163 -19.776 543 HE2 LYS 78 1HE LYS 78 2.671 16.788 -17.846 544 HE3 LYS 78 2HE LYS 78 1.638 15.711 -16.907 545 HZ1 LYS 78 3HZ LYS 78 3.997 14.649 -18.318 546 HZ2 LYS 78 1HZ LYS 78 3.197 14.029 -16.962 547 HZ3 LYS 78 2HZ LYS 78 4.174 15.401 -16.814 548 H VAL 79 H VAL 79 -3.416 17.189 -19.857 549 HA VAL 79 HA VAL 79 -5.475 17.904 -18.151 550 HB VAL 79 HB VAL 79 -5.599 15.678 -20.189 551 HG11 VAL 79 1HG1 VAL 79 -7.603 15.577 -19.041 552 HG12 VAL 79 2HG1 VAL 79 -7.646 17.317 -18.752 553 HG13 VAL 79 3HG1 VAL 79 -7.990 16.680 -20.361 554 HG21 VAL 79 3HG2 VAL 79 -5.341 18.593 -20.480 555 HG22 VAL 79 1HG2 VAL 79 -4.954 17.298 -21.613 556 HG23 VAL 79 2HG2 VAL 79 -6.620 17.852 -21.442 557 H GLY 80 H GLY 80 -6.216 17.091 -16.306 558 HA2 GLY 80 1HA GLY 80 -6.938 15.462 -14.804 559 HA3 GLY 80 2HA GLY 80 -6.246 14.229 -15.847 560 H GLY 81 H GLY 81 -3.902 16.499 -15.480 561 HA2 GLY 81 1HA GLY 81 -2.509 14.845 -13.531 562 HA3 GLY 81 2HA GLY 81 -1.804 16.125 -14.507 563 H VAL 82 H VAL 82 -2.321 15.310 -11.449 564 HA VAL 82 HA VAL 82 -3.003 18.032 -10.561 565 HB VAL 82 HB VAL 82 -2.973 15.520 -8.887 566 HG11 VAL 82 1HG1 VAL 82 -3.369 18.353 -8.331 567 HG12 VAL 82 2HG1 VAL 82 -4.680 17.335 -7.732 568 HG13 VAL 82 3HG1 VAL 82 -3.018 17.021 -7.231 569 HG21 VAL 82 3HG2 VAL 82 -4.769 15.002 -10.168 570 HG22 VAL 82 1HG2 VAL 82 -5.576 16.122 -9.071 571 HG23 VAL 82 2HG2 VAL 82 -5.041 16.674 -10.658 572 H ARG 83 H ARG 83 -1.501 19.263 -9.625 573 HA ARG 83 HA ARG 83 0.811 18.041 -8.341 574 HB2 ARG 83 1HB ARG 83 1.398 18.416 -10.754 575 HB3 ARG 83 2HB ARG 83 1.152 20.137 -10.489 576 HG2 ARG 83 1HG ARG 83 2.970 20.232 -8.945 577 HG3 ARG 83 2HG ARG 83 3.133 18.475 -8.953 578 HD2 ARG 83 1HD ARG 83 3.490 20.198 -11.398 579 HD3 ARG 83 2HD ARG 83 4.818 19.716 -10.342 580 HE ARG 83 HE ARG 83 3.340 17.454 -11.197 581 HH11 ARG 83 1HH1 ARG 83 5.674 19.794 -12.290 582 HH12 ARG 83 2HH1 ARG 83 6.374 18.738 -13.471 583 HH21 ARG 83 1HH2 ARG 83 4.254 16.053 -12.748 584 HH22 ARG 83 2HH2 ARG 83 5.565 16.610 -13.731 585 H ARG 84 H ARG 84 1.642 19.243 -6.688 586 HA ARG 84 HA ARG 84 0.080 21.551 -5.874 587 HB2 ARG 84 1HB ARG 84 1.427 19.472 -4.527 588 HB3 ARG 84 2HB ARG 84 2.267 20.957 -4.102 589 HG2 ARG 84 1HG ARG 84 0.232 21.939 -3.287 590 HG3 ARG 84 2HG ARG 84 -0.704 20.553 -3.849 591 HD2 ARG 84 1HD ARG 84 -0.328 20.395 -1.460 592 HD3 ARG 84 2HD ARG 84 0.538 19.108 -2.298 593 HE ARG 84 HE ARG 84 2.409 21.036 -2.072 594 HH11 ARG 84 1HH1 ARG 84 0.251 19.549 0.219 595 HH12 ARG 84 2HH1 ARG 84 1.329 19.747 1.561 596 HH21 ARG 84 1HH2 ARG 84 3.837 21.303 -0.314 597 HH22 ARG 84 2HH2 ARG 84 3.368 20.746 1.257 598 H LEU 85 H LEU 85 0.659 23.383 -6.889 599 HA LEU 85 HA LEU 85 3.459 23.969 -7.399 600 HB2 LEU 85 1HB LEU 85 1.797 24.448 -9.121 601 HB3 LEU 85 2HB LEU 85 0.960 25.540 -8.019 602 HG LEU 85 HG LEU 85 3.419 26.664 -8.049 603 HD11 LEU 85 1HD1 LEU 85 3.003 25.702 -10.869 604 HD12 LEU 85 2HD1 LEU 85 4.141 24.960 -9.745 605 HD13 LEU 85 3HD1 LEU 85 4.352 26.642 -10.230 606 HD21 LEU 85 3HD2 LEU 85 2.448 28.385 -9.292 607 HD22 LEU 85 1HD2 LEU 85 1.075 27.594 -8.518 608 HD23 LEU 85 2HD2 LEU 85 1.435 27.275 -10.215 609 H THR 86 H THR 86 4.680 24.980 -5.963 610 HA THR 86 HA THR 86 3.395 26.572 -3.861 611 HB THR 86 HB THR 86 6.303 26.037 -3.707 612 HG1 THR 86 HG1 THR 86 4.445 23.954 -3.158 613 HG21 THR 86 3HG2 THR 86 4.444 27.010 -1.994 614 HG22 THR 86 1HG2 THR 86 5.953 26.254 -1.486 615 HG23 THR 86 2HG2 THR 86 4.463 25.310 -1.524 616 H ILE 87 H ILE 87 3.364 28.699 -4.109 617 HA ILE 87 HA ILE 87 5.500 29.968 -5.691 618 HB ILE 87 HB ILE 87 2.758 31.095 -5.127 619 HG12 ILE 87 1HG1 ILE 87 2.654 30.594 -7.742 620 HG13 ILE 87 2HG1 ILE 87 3.776 29.315 -7.290 621 HG21 ILE 87 1HG2 ILE 87 3.288 32.837 -6.564 622 HG22 ILE 87 2HG2 ILE 87 4.793 32.588 -5.680 623 HG23 ILE 87 3HG2 ILE 87 4.613 31.949 -7.314 624 HD11 ILE 87 3HD1 ILE 87 0.937 29.410 -7.021 625 HD12 ILE 87 1HD1 ILE 87 2.044 28.070 -6.721 626 HD13 ILE 87 2HD1 ILE 87 1.677 29.217 -5.432 627 HA PRO 88 HA PRO 88 6.835 31.892 -1.935 628 HB2 PRO 88 1HB PRO 88 8.509 33.709 -3.061 629 HB3 PRO 88 2HB PRO 88 8.910 31.993 -2.917 630 HG2 PRO 88 1HG PRO 88 7.862 33.501 -5.281 631 HG3 PRO 88 2HG PRO 88 9.137 32.271 -5.215 632 HD2 PRO 88 1HD PRO 88 6.614 31.712 -6.024 633 HD3 PRO 88 2HD PRO 88 7.628 30.529 -5.173 634 HA PRO 89 HA PRO 89 4.594 35.625 -1.321 635 HB2 PRO 89 1HB PRO 89 6.299 37.156 0.135 636 HB3 PRO 89 2HB PRO 89 5.486 35.731 0.794 637 HG2 PRO 89 1HG PRO 89 8.277 36.005 -0.255 638 HG3 PRO 89 2HG PRO 89 7.703 35.153 1.191 639 HD2 PRO 89 1HD PRO 89 8.292 33.868 -1.119 640 HD3 PRO 89 2HD PRO 89 7.022 33.309 -0.011 641 H GLN 90 H GLN 90 7.370 35.617 -3.221 642 HA GLN 90 HA GLN 90 7.175 38.459 -3.891 643 HB2 GLN 90 1HB GLN 90 9.413 37.437 -3.473 644 HB3 GLN 90 2HB GLN 90 9.166 36.412 -4.880 645 HG2 GLN 90 1HG GLN 90 9.439 38.134 -6.360 646 HG3 GLN 90 2HG GLN 90 8.922 39.357 -5.200 647 HE21 GLN 90 2HE2 GLN 90 10.498 39.081 -3.107 648 HE22 GLN 90 1HE2 GLN 90 12.163 39.281 -3.523 649 H LEU 91 H LEU 91 6.941 35.257 -5.382 650 HA LEU 91 HA LEU 91 6.015 36.442 -7.881 651 HB2 LEU 91 1HB LEU 91 6.290 33.513 -7.269 652 HB3 LEU 91 2HB LEU 91 6.254 34.298 -8.847 653 HG LEU 91 HG LEU 91 8.497 34.549 -6.844 654 HD11 LEU 91 1HD1 LEU 91 9.526 32.786 -7.767 655 HD12 LEU 91 2HD1 LEU 91 8.971 33.183 -9.392 656 HD13 LEU 91 3HD1 LEU 91 7.905 32.321 -8.283 657 HD21 LEU 91 3HD2 LEU 91 8.480 35.320 -9.751 658 HD22 LEU 91 1HD2 LEU 91 9.689 35.703 -8.525 659 HD23 LEU 91 2HD2 LEU 91 8.095 36.455 -8.457 660 H GLY 92 H GLY 92 4.497 36.265 -5.212 661 HA2 GLY 92 1HA GLY 92 2.090 34.925 -6.279 662 HA3 GLY 92 2HA GLY 92 2.456 35.066 -4.566 663 H TYR 93 H TYR 93 1.255 36.513 -3.552 664 HA TYR 93 HA TYR 93 -0.512 38.272 -4.737 665 HB2 TYR 93 1HB TYR 93 0.705 38.080 -2.017 666 HB3 TYR 93 2HB TYR 93 -0.214 39.526 -2.422 667 HD1 TYR 93 HD1 TYR 93 -0.470 35.808 -2.399 668 HD2 TYR 93 HD2 TYR 93 -2.534 39.524 -2.206 669 HE1 TYR 93 HE1 TYR 93 -2.558 34.615 -1.885 670 HE2 TYR 93 HE2 TYR 93 -4.627 38.341 -1.690 671 HH TYR 93 HH TYR 93 -4.733 34.794 -1.491 672 H GLY 94 H GLY 94 2.833 38.814 -3.745 673 HA2 GLY 94 1HA GLY 94 3.997 40.394 -5.335 674 HA3 GLY 94 2HA GLY 94 2.684 41.501 -4.964 675 H ALA 95 H ALA 95 4.965 42.614 -4.534 676 HA ALA 95 HA ALA 95 6.370 42.095 -2.181 677 HB1 ALA 95 1HB ALA 95 6.995 44.542 -2.311 678 HB2 ALA 95 2HB ALA 95 7.339 43.575 -3.745 679 HB3 ALA 95 3HB ALA 95 5.936 44.643 -3.717 680 H ARG 96 H ARG 96 3.340 43.749 -2.710 681 HA ARG 96 HA ARG 96 3.223 44.938 -0.103 682 HB2 ARG 96 1HB ARG 96 1.323 44.642 -2.397 683 HB3 ARG 96 2HB ARG 96 0.700 45.112 -0.821 684 HG2 ARG 96 1HG ARG 96 2.185 47.042 -0.795 685 HG3 ARG 96 2HG ARG 96 2.842 46.563 -2.361 686 HD2 ARG 96 1HD ARG 96 0.554 46.761 -3.313 687 HD3 ARG 96 2HD ARG 96 0.004 47.381 -1.757 688 HE ARG 96 HE ARG 96 2.078 49.012 -2.426 689 HH11 ARG 96 1HH1 ARG 96 -0.871 48.040 -3.999 690 HH12 ARG 96 2HH1 ARG 96 -1.048 49.526 -4.873 691 HH21 ARG 96 1HH2 ARG 96 1.856 50.972 -3.571 692 HH22 ARG 96 2HH2 ARG 96 0.504 51.192 -4.629 693 H GLY 97 H GLY 97 1.118 42.471 -1.604 694 HA2 GLY 97 1HA GLY 97 0.138 40.590 -0.720 695 HA3 GLY 97 2HA GLY 97 1.385 40.616 0.518 696 H ALA 98 H ALA 98 -1.485 40.002 0.725 697 HA ALA 98 HA ALA 98 -2.855 42.139 1.970 698 HB1 ALA 98 1HB ALA 98 -4.388 40.587 1.404 699 HB2 ALA 98 2HB ALA 98 -3.271 39.242 1.636 700 HB3 ALA 98 3HB ALA 98 -4.066 39.977 3.027 701 H GLY 99 H GLY 99 -2.719 42.954 3.964 702 HA2 GLY 99 1HA GLY 99 -0.685 42.095 5.755 703 HA3 GLY 99 2HA GLY 99 -1.903 43.318 6.083 704 H GLY 100 H GLY 100 -0.941 40.049 6.547 705 HA2 GLY 100 1HA GLY 100 -1.896 39.215 8.746 706 HA3 GLY 100 2HA GLY 100 -3.457 39.500 7.991 707 H VAL 101 H VAL 101 -3.950 38.260 6.029 708 HA VAL 101 HA VAL 101 -3.430 35.504 6.408 709 HB VAL 101 HB VAL 101 -4.603 36.888 3.991 710 HG11 VAL 101 1HG1 VAL 101 -5.688 34.617 3.675 711 HG12 VAL 101 2HG1 VAL 101 -3.964 34.720 3.314 712 HG13 VAL 101 3HG1 VAL 101 -4.508 34.002 4.831 713 HG21 VAL 101 3HG2 VAL 101 -6.032 37.446 5.738 714 HG22 VAL 101 1HG2 VAL 101 -6.756 35.974 5.090 715 HG23 VAL 101 2HG2 VAL 101 -5.787 35.906 6.562 716 H ILE 102 H ILE 102 -2.113 37.927 4.218 717 HA ILE 102 HA ILE 102 -0.223 35.907 3.202 718 HB ILE 102 HB ILE 102 -1.040 38.497 1.881 719 HG12 ILE 102 1HG1 ILE 102 -2.873 36.896 1.843 720 HG13 ILE 102 2HG1 ILE 102 -2.169 37.030 0.234 721 HG21 ILE 102 1HG2 ILE 102 0.805 38.253 0.671 722 HG22 ILE 102 2HG2 ILE 102 1.182 36.730 1.476 723 HG23 ILE 102 3HG2 ILE 102 0.147 36.740 0.048 724 HD11 ILE 102 3HD1 ILE 102 -0.905 34.958 0.656 725 HD12 ILE 102 1HD1 ILE 102 -1.716 34.813 2.215 726 HD13 ILE 102 2HD1 ILE 102 -2.652 34.730 0.722 727 HA PRO 103 HA PRO 103 2.212 38.872 5.817 728 HB2 PRO 103 1HB PRO 103 3.692 36.946 7.029 729 HB3 PRO 103 2HB PRO 103 2.113 37.464 7.630 730 HG2 PRO 103 1HG PRO 103 2.818 35.071 5.976 731 HG3 PRO 103 2HG PRO 103 1.718 35.188 7.362 732 HD2 PRO 103 1HD PRO 103 0.837 35.147 4.802 733 HD3 PRO 103 2HD PRO 103 -0.001 36.043 6.085 734 HA PRO 104 HA PRO 104 5.824 38.923 3.310 735 HB2 PRO 104 1HB PRO 104 7.768 39.628 5.069 736 HB3 PRO 104 2HB PRO 104 6.526 40.754 4.508 737 HG2 PRO 104 1HG PRO 104 6.657 39.197 7.062 738 HG3 PRO 104 2HG PRO 104 6.186 40.887 6.805 739 HD2 PRO 104 1HD PRO 104 4.373 38.905 7.143 740 HD3 PRO 104 2HD PRO 104 4.059 40.322 6.121 741 H ASN 105 H ASN 105 7.859 37.899 2.848 742 HA ASN 105 HA ASN 105 8.993 35.925 2.541 743 HB2 ASN 105 1HB ASN 105 10.332 35.294 4.512 744 HB3 ASN 105 2HB ASN 105 10.311 37.039 4.274 745 HD21 ASN 105 2HD2 ASN 105 9.514 34.439 6.346 746 HD22 ASN 105 1HD2 ASN 105 8.878 35.376 7.650 747 H ALA 106 H ALA 106 6.247 35.438 2.724 748 HA ALA 106 HA ALA 106 6.157 32.908 4.235 749 HB1 ALA 106 1HB ALA 106 3.828 34.636 3.406 750 HB2 ALA 106 2HB ALA 106 3.754 33.162 4.372 751 HB3 ALA 106 3HB ALA 106 4.547 34.599 5.016 752 H THR 107 H THR 107 5.916 31.075 3.124 753 HA THR 107 HA THR 107 5.714 31.202 0.236 754 HB THR 107 HB THR 107 6.094 28.841 2.087 755 HG1 THR 107 HG1 THR 107 8.165 29.248 1.858 756 HG21 THR 107 3HG2 THR 107 5.810 29.054 -0.876 757 HG22 THR 107 1HG2 THR 107 5.207 27.815 0.224 758 HG23 THR 107 2HG2 THR 107 6.917 27.856 -0.207 759 H LEU 108 H LEU 108 3.909 30.907 -0.893 760 HA LEU 108 HA LEU 108 1.504 30.015 0.512 761 HB2 LEU 108 1HB LEU 108 1.989 31.507 -2.042 762 HB3 LEU 108 2HB LEU 108 0.421 30.783 -1.692 763 HG LEU 108 HG LEU 108 1.792 32.915 -0.054 764 HD11 LEU 108 1HD1 LEU 108 0.579 34.473 -1.133 765 HD12 LEU 108 2HD1 LEU 108 -0.809 33.405 -1.340 766 HD13 LEU 108 3HD1 LEU 108 0.571 33.278 -2.430 767 HD21 LEU 108 3HD2 LEU 108 0.460 32.266 1.600 768 HD22 LEU 108 1HD2 LEU 108 -0.326 31.069 0.571 769 HD23 LEU 108 2HD2 LEU 108 -0.918 32.730 0.600 770 H VAL 109 H VAL 109 0.666 28.059 0.213 771 HA VAL 109 HA VAL 109 1.790 26.360 -1.891 772 HB VAL 109 HB VAL 109 0.144 25.650 0.540 773 HG11 VAL 109 1HG1 VAL 109 0.759 24.154 -1.877 774 HG12 VAL 109 2HG1 VAL 109 1.298 23.334 -0.410 775 HG13 VAL 109 3HG1 VAL 109 -0.394 23.801 -0.589 776 HG21 VAL 109 3HG2 VAL 109 2.809 24.510 0.284 777 HG22 VAL 109 1HG2 VAL 109 2.822 26.272 0.361 778 HG23 VAL 109 2HG2 VAL 109 2.060 25.338 1.648 779 H PHE 110 H PHE 110 0.704 26.333 -3.743 780 HA PHE 110 HA PHE 110 -2.240 26.395 -3.643 781 HB2 PHE 110 1HB PHE 110 -0.299 27.585 -5.601 782 HB3 PHE 110 2HB PHE 110 -1.945 27.204 -6.097 783 HD1 PHE 110 HD1 PHE 110 -3.844 28.392 -5.113 784 HD2 PHE 110 HD2 PHE 110 0.172 29.419 -4.146 785 HE1 PHE 110 HE1 PHE 110 -4.618 30.537 -4.189 786 HE2 PHE 110 HE2 PHE 110 -0.596 31.565 -3.220 787 HZ PHE 110 HZ PHE 110 -2.994 32.126 -3.240 788 H GLU 111 H GLU 111 -3.335 24.755 -4.548 789 HA GLU 111 HA GLU 111 -1.762 22.650 -5.861 790 HB2 GLU 111 1HB GLU 111 -2.961 21.960 -3.842 791 HB3 GLU 111 2HB GLU 111 -4.477 22.515 -4.538 792 HG2 GLU 111 1HG GLU 111 -3.959 20.847 -6.432 793 HG3 GLU 111 2HG GLU 111 -2.818 20.145 -5.286 794 H VAL 112 H VAL 112 -1.952 22.398 -7.979 795 HA VAL 112 HA VAL 112 -4.385 23.406 -9.304 796 HB VAL 112 HB VAL 112 -1.638 23.168 -10.536 797 HG11 VAL 112 1HG1 VAL 112 -4.186 23.413 -11.688 798 HG12 VAL 112 2HG1 VAL 112 -3.430 25.002 -11.822 799 HG13 VAL 112 3HG1 VAL 112 -2.621 23.580 -12.484 800 HG21 VAL 112 3HG2 VAL 112 -1.329 24.906 -9.047 801 HG22 VAL 112 1HG2 VAL 112 -1.901 25.760 -10.481 802 HG23 VAL 112 2HG2 VAL 112 -3.009 25.432 -9.148 803 H GLU 113 H GLU 113 -5.630 21.883 -10.151 804 HA GLU 113 HA GLU 113 -4.368 19.387 -11.079 805 HB2 GLU 113 1HB GLU 113 -6.503 18.243 -10.448 806 HB3 GLU 113 2HB GLU 113 -5.585 18.865 -9.084 807 HG2 GLU 113 1HG GLU 113 -7.101 20.925 -9.256 808 HG3 GLU 113 2HG GLU 113 -8.130 19.907 -10.263 809 H LEU 114 H LEU 114 -4.445 19.334 -13.222 810 HA LEU 114 HA LEU 114 -6.181 20.886 -14.808 811 HB2 LEU 114 1HB LEU 114 -4.262 18.670 -15.297 812 HB3 LEU 114 2HB LEU 114 -5.419 19.058 -16.569 813 HG LEU 114 HG LEU 114 -3.100 20.120 -16.700 814 HD11 LEU 114 1HD1 LEU 114 -5.742 21.288 -17.145 815 HD12 LEU 114 2HD1 LEU 114 -4.355 21.163 -18.228 816 HD13 LEU 114 3HD1 LEU 114 -4.438 22.472 -17.049 817 HD21 LEU 114 3HD2 LEU 114 -2.718 22.103 -15.400 818 HD22 LEU 114 1HD2 LEU 114 -3.020 20.756 -14.301 819 HD23 LEU 114 2HD2 LEU 114 -4.288 21.942 -14.612 820 H LEU 115 H LEU 115 -8.237 20.589 -15.336 821 HA LEU 115 HA LEU 115 -9.453 17.966 -14.838 822 HB2 LEU 115 1HB LEU 115 -10.575 20.743 -15.040 823 HB3 LEU 115 2HB LEU 115 -11.607 19.316 -15.102 824 HG LEU 115 HG LEU 115 -9.792 19.405 -12.796 825 HD11 LEU 115 1HD1 LEU 115 -12.091 21.134 -12.335 826 HD12 LEU 115 2HD1 LEU 115 -10.911 21.823 -13.449 827 HD13 LEU 115 3HD1 LEU 115 -10.410 21.321 -11.835 828 HD21 LEU 115 3HD2 LEU 115 -11.607 17.745 -13.175 829 HD22 LEU 115 1HD2 LEU 115 -12.779 19.052 -12.998 830 HD23 LEU 115 2HD2 LEU 115 -11.739 18.611 -11.643 831 H ASP 116 H ASP 116 -9.009 20.424 -17.310 832 HA ASP 116 HA ASP 116 -9.170 18.593 -19.433 833 HB2 ASP 116 1HB ASP 116 -11.652 18.922 -18.586 834 HB3 ASP 116 2HB ASP 116 -11.547 20.402 -19.536 835 H VAL 117 H VAL 117 -9.323 19.769 -21.598 836 HA VAL 117 HA VAL 117 -7.710 22.193 -21.388 837 HB VAL 117 HB VAL 117 -8.371 20.500 -23.803 838 HG11 VAL 117 1HG1 VAL 117 -6.819 23.017 -23.443 839 HG12 VAL 117 2HG1 VAL 117 -6.260 21.833 -24.626 840 HG13 VAL 117 3HG1 VAL 117 -7.878 22.523 -24.764 841 HG21 VAL 117 3HG2 VAL 117 -6.546 20.077 -21.682 842 HG22 VAL 117 1HG2 VAL 117 -6.728 19.148 -23.170 843 HG23 VAL 117 2HG2 VAL 117 -5.606 20.508 -23.111 844 H11 L2S 130 1H1 L2S 130 -5.210 31.135 -9.462 845 H21 L2S 130 2H1 L2S 130 -5.116 31.869 -11.134 846 H12 L2S 130 1H2 L2S 130 -4.468 33.974 -10.189 847 H22 L2S 130 2H2 L2S 130 -3.295 32.667 -9.675 848 H13 L2S 130 2H3 L2S 130 -4.407 32.550 -7.539 849 H23 L2S 130 1H3 L2S 130 -3.947 34.289 -7.849 850 H14 L2S 130 1H4 L2S 130 -7.101 32.029 -7.907 851 H24 L2S 130 2H4 L2S 130 -7.984 33.505 -8.517 852 H15 L2S 130 1H5 L2S 130 -7.440 31.798 -10.288 853 H25 L2S 130 2H5 L2S 130 -6.784 33.488 -10.539 854 H17 L2S 130 1H7 L2S 130 -8.182 35.381 -7.880 855 H27 L2S 130 2H7 L2S 130 -8.277 34.605 -6.211 856 H9 L2S 130 H9 L2S 130 -8.715 38.823 -4.217 857 H10 L2S 130 H10 L2S 130 -8.730 38.717 -1.724 858 H112 L2S 130 1H12 L2S 130 -7.410 34.556 -1.900 859 H113 L2S 130 1H13 L2S 130 -7.353 34.695 -4.383 860 H114 L2S 130 1H14 L2S 130 -8.290 35.544 0.052 861 H214 L2S 130 2H14 L2S 130 -8.850 37.232 0.123 862 H314 L2S 130 3H14 L2S 130 -7.088 36.881 0.060 Start of MODEL 10 1 H1 GLY 1 H GLY 1 10.875 0.751 -9.665 2 HA2 GLY 1 1HA GLY 1 10.065 1.349 -11.758 3 HA3 GLY 1 2HA GLY 1 8.750 0.202 -11.543 4 HA PRO 2 HA PRO 2 5.920 3.411 -10.617 5 HB2 PRO 2 1HB PRO 2 4.487 2.429 -8.531 6 HB3 PRO 2 2HB PRO 2 4.338 1.804 -10.178 7 HG2 PRO 2 1HG PRO 2 5.901 0.710 -7.871 8 HG3 PRO 2 2HG PRO 2 4.896 -0.152 -9.051 9 HD2 PRO 2 1HD PRO 2 7.597 -0.061 -9.228 10 HD3 PRO 2 2HD PRO 2 6.548 -0.135 -10.658 11 H GLY 3 H GLY 3 7.230 5.112 -9.916 12 HA2 GLY 3 1HA GLY 3 6.850 5.943 -7.227 13 HA3 GLY 3 2HA GLY 3 8.495 5.372 -7.460 14 H SER 4 H SER 4 9.963 6.707 -8.350 15 HA SER 4 HA SER 4 10.892 8.671 -9.035 16 HB2 SER 4 1HB SER 4 9.508 7.756 -11.102 17 HB3 SER 4 2HB SER 4 8.552 9.210 -10.814 18 HG SER 4 HG SER 4 10.471 9.330 -12.284 19 H MET 5 H MET 5 9.261 8.833 -6.715 20 HA MET 5 HA MET 5 7.773 11.322 -6.953 21 HB2 MET 5 1HB MET 5 8.063 9.207 -4.873 22 HB3 MET 5 2HB MET 5 7.609 10.822 -4.347 23 HG2 MET 5 1HG MET 5 5.683 10.781 -5.830 24 HG3 MET 5 2HG MET 5 6.146 9.179 -6.399 25 HE1 MET 5 3HE MET 5 4.141 7.324 -5.355 26 HE2 MET 5 1HE MET 5 5.897 7.183 -5.440 27 HE3 MET 5 2HE MET 5 5.048 6.744 -3.957 28 H THR 6 H THR 6 9.261 12.933 -7.268 29 HA THR 6 HA THR 6 10.931 13.578 -4.955 30 HB THR 6 HB THR 6 12.507 12.496 -6.418 31 HG1 THR 6 HG1 THR 6 13.139 14.518 -5.410 32 HG21 THR 6 3HG2 THR 6 11.825 12.425 -8.577 33 HG22 THR 6 1HG2 THR 6 12.810 13.881 -8.711 34 HG23 THR 6 2HG2 THR 6 11.064 14.014 -8.501 35 H VAL 7 H VAL 7 11.497 15.808 -4.796 36 HA VAL 7 HA VAL 7 9.687 17.554 -6.327 37 HB VAL 7 HB VAL 7 9.299 17.516 -3.888 38 HG11 VAL 7 1HG1 VAL 7 10.911 17.745 -2.354 39 HG12 VAL 7 2HG1 VAL 7 12.030 17.415 -3.679 40 HG13 VAL 7 3HG1 VAL 7 11.671 19.080 -3.220 41 HG21 VAL 7 3HG2 VAL 7 8.685 19.502 -5.087 42 HG22 VAL 7 1HG2 VAL 7 9.399 19.980 -3.548 43 HG23 VAL 7 2HG2 VAL 7 10.342 20.103 -5.033 44 H VAL 8 H VAL 8 10.481 19.188 -7.518 45 HA VAL 8 HA VAL 8 13.344 19.831 -7.260 46 HB VAL 8 HB VAL 8 13.021 18.421 -9.238 47 HG11 VAL 8 1HG1 VAL 8 11.145 18.576 -10.414 48 HG12 VAL 8 2HG1 VAL 8 10.694 20.061 -9.573 49 HG13 VAL 8 3HG1 VAL 8 11.696 20.137 -11.023 50 HG21 VAL 8 3HG2 VAL 8 14.705 20.266 -9.199 51 HG22 VAL 8 1HG2 VAL 8 14.166 19.810 -10.815 52 HG23 VAL 8 2HG2 VAL 8 13.541 21.275 -10.058 53 H THR 9 H THR 9 13.938 21.962 -7.659 54 HA THR 9 HA THR 9 11.694 23.869 -7.736 55 HB THR 9 HB THR 9 14.466 24.373 -6.641 56 HG1 THR 9 HG1 THR 9 13.627 23.035 -5.157 57 HG21 THR 9 3HG2 THR 9 13.729 26.493 -6.914 58 HG22 THR 9 1HG2 THR 9 12.819 26.154 -5.442 59 HG23 THR 9 2HG2 THR 9 12.038 26.004 -7.017 60 H THR 10 H THR 10 11.890 25.766 -8.979 61 HA THR 10 HA THR 10 13.393 25.410 -11.411 62 HB THR 10 HB THR 10 12.261 27.381 -12.227 63 HG1 THR 10 HG1 THR 10 11.293 28.803 -10.914 64 HG21 THR 10 3HG2 THR 10 10.485 26.083 -12.570 65 HG22 THR 10 1HG2 THR 10 9.871 26.517 -10.976 66 HG23 THR 10 2HG2 THR 10 10.909 25.104 -11.167 67 H GLU 11 H GLU 11 14.207 27.785 -12.258 68 HA GLU 11 HA GLU 11 16.532 28.291 -10.627 69 HB2 GLU 11 1HB GLU 11 15.626 29.050 -13.361 70 HB3 GLU 11 2HB GLU 11 16.824 30.075 -12.584 71 HG2 GLU 11 1HG GLU 11 18.256 28.096 -12.252 72 HG3 GLU 11 2HG GLU 11 17.071 27.125 -13.124 73 H SER 12 H SER 12 13.478 29.804 -11.264 74 HA SER 12 HA SER 12 14.275 32.355 -10.143 75 HB2 SER 12 1HB SER 12 12.545 31.989 -12.022 76 HB3 SER 12 2HB SER 12 11.441 31.518 -10.731 77 HG SER 12 HG SER 12 11.937 33.938 -11.534 78 H GLY 13 H GLY 13 12.702 29.424 -9.117 79 HA2 GLY 13 1HA GLY 13 13.024 29.199 -6.588 80 HA3 GLY 13 2HA GLY 13 12.062 30.668 -6.521 81 H LEU 14 H LEU 14 10.457 29.663 -8.869 82 HA LEU 14 HA LEU 14 8.259 28.684 -7.519 83 HB2 LEU 14 1HB LEU 14 7.884 29.521 -9.664 84 HB3 LEU 14 2HB LEU 14 9.125 28.495 -10.380 85 HG LEU 14 HG LEU 14 7.667 26.538 -10.055 86 HD11 LEU 14 1HD1 LEU 14 6.340 28.154 -8.247 87 HD12 LEU 14 2HD1 LEU 14 5.816 26.572 -8.822 88 HD13 LEU 14 3HD1 LEU 14 5.225 28.035 -9.609 89 HD21 LEU 14 3HD2 LEU 14 7.333 27.187 -12.189 90 HD22 LEU 14 1HD2 LEU 14 6.983 28.857 -11.742 91 HD23 LEU 14 2HD2 LEU 14 5.733 27.622 -11.586 92 H LYS 15 H LYS 15 7.424 26.679 -7.070 93 HA LYS 15 HA LYS 15 9.069 24.337 -7.727 94 HB2 LYS 15 1HB LYS 15 8.116 25.191 -5.003 95 HB3 LYS 15 2HB LYS 15 8.481 23.508 -5.359 96 HG2 LYS 15 1HG LYS 15 10.756 23.989 -5.774 97 HG3 LYS 15 2HG LYS 15 10.455 25.728 -5.806 98 HD2 LYS 15 1HD LYS 15 11.487 25.134 -3.707 99 HD3 LYS 15 2HD LYS 15 9.814 25.618 -3.416 100 HE2 LYS 15 1HE LYS 15 10.224 23.676 -2.105 101 HE3 LYS 15 2HE LYS 15 9.204 23.186 -3.457 102 HZ1 LYS 15 3HZ LYS 15 11.460 21.937 -2.727 103 HZ2 LYS 15 1HZ LYS 15 12.045 22.961 -3.940 104 HZ3 LYS 15 2HZ LYS 15 10.798 21.870 -4.282 105 H TYR 16 H TYR 16 7.895 22.276 -7.410 106 HA TYR 16 HA TYR 16 5.008 22.407 -7.273 107 HB2 TYR 16 1HB TYR 16 4.833 21.158 -9.505 108 HB3 TYR 16 2HB TYR 16 5.136 22.891 -9.575 109 HD1 TYR 16 HD2 TYR 16 6.696 19.562 -9.939 110 HD2 TYR 16 HD1 TYR 16 7.134 23.752 -10.536 111 HE1 TYR 16 HE2 TYR 16 8.689 19.152 -11.322 112 HE2 TYR 16 HE1 TYR 16 9.127 23.353 -11.921 113 HH TYR 16 HH TYR 16 9.953 20.309 -13.117 114 H GLU 17 H GLU 17 4.029 20.383 -6.950 115 HA GLU 17 HA GLU 17 5.892 18.141 -6.527 116 HB2 GLU 17 1HB GLU 17 5.175 19.245 -4.390 117 HB3 GLU 17 2HB GLU 17 3.521 18.788 -4.770 118 HG2 GLU 17 1HG GLU 17 4.233 16.415 -4.792 119 HG3 GLU 17 2HG GLU 17 5.835 16.932 -4.268 120 H ASP 18 H ASP 18 5.395 16.476 -7.772 121 HA ASP 18 HA ASP 18 2.943 16.308 -9.207 122 HB2 ASP 18 1HB ASP 18 3.836 14.082 -9.946 123 HB3 ASP 18 2HB ASP 18 4.931 15.432 -10.229 124 H LEU 19 H LEU 19 1.067 15.667 -8.401 125 HA LEU 19 HA LEU 19 1.062 13.749 -6.171 126 HB2 LEU 19 1HB LEU 19 -0.792 15.950 -6.981 127 HB3 LEU 19 2HB LEU 19 -1.386 14.612 -5.999 128 HG LEU 19 HG LEU 19 0.982 16.261 -5.161 129 HD11 LEU 19 1HD1 LEU 19 -0.330 17.843 -4.145 130 HD12 LEU 19 2HD1 LEU 19 -1.751 16.800 -4.105 131 HD13 LEU 19 3HD1 LEU 19 -1.250 17.548 -5.621 132 HD21 LEU 19 3HD2 LEU 19 0.897 14.359 -3.848 133 HD22 LEU 19 1HD2 LEU 19 -0.865 14.292 -3.875 134 HD23 LEU 19 2HD2 LEU 19 -0.045 15.509 -2.898 135 H THR 20 H THR 20 -0.059 14.346 -9.403 136 HA THR 20 HA THR 20 -0.792 11.581 -9.716 137 HB THR 20 HB THR 20 -2.989 13.509 -10.390 138 HG1 THR 20 HG1 THR 20 -2.786 12.116 -7.913 139 HG21 THR 20 3HG2 THR 20 -3.946 11.023 -9.501 140 HG22 THR 20 1HG2 THR 20 -2.550 10.669 -10.517 141 HG23 THR 20 2HG2 THR 20 -3.889 11.620 -11.159 142 H GLU 21 H GLU 21 0.151 11.093 -11.579 143 HA GLU 21 HA GLU 21 0.829 13.028 -13.543 144 HB2 GLU 21 1HB GLU 21 2.046 10.854 -13.063 145 HB3 GLU 21 2HB GLU 21 0.758 10.038 -13.939 146 HG2 GLU 21 1HG GLU 21 1.383 10.941 -15.970 147 HG3 GLU 21 2HG GLU 21 2.249 12.282 -15.223 148 H GLY 22 H GLY 22 -0.296 13.769 -15.226 149 HA2 GLY 22 1HA GLY 22 -2.907 12.540 -15.776 150 HA3 GLY 22 2HA GLY 22 -2.434 14.179 -16.201 151 H SER 23 H SER 23 -2.750 10.985 -17.281 152 HA SER 23 HA SER 23 -0.839 10.880 -19.334 153 HB2 SER 23 1HB SER 23 -2.098 9.044 -20.219 154 HB3 SER 23 2HB SER 23 -2.231 8.956 -18.462 155 HG SER 23 HG SER 23 -4.238 8.706 -19.709 156 H GLY 24 H GLY 24 -3.745 12.679 -19.041 157 HA2 GLY 24 1HA GLY 24 -4.562 12.965 -21.686 158 HA3 GLY 24 2HA GLY 24 -4.762 14.187 -20.439 159 H ALA 25 H ALA 25 -4.464 15.319 -22.710 160 HA ALA 25 HA ALA 25 -1.753 15.626 -23.589 161 HB1 ALA 25 1HB ALA 25 -3.518 15.886 -25.193 162 HB2 ALA 25 2HB ALA 25 -4.252 17.179 -24.242 163 HB3 ALA 25 3HB ALA 25 -2.687 17.432 -25.016 164 H GLU 26 H GLU 26 -0.440 17.475 -23.406 165 HA GLU 26 HA GLU 26 -0.530 18.740 -20.859 166 HB2 GLU 26 1HB GLU 26 1.529 19.722 -21.426 167 HB3 GLU 26 2HB GLU 26 1.539 18.166 -22.244 168 HG2 GLU 26 1HG GLU 26 0.654 19.461 -24.277 169 HG3 GLU 26 2HG GLU 26 1.194 20.898 -23.411 170 H ALA 27 H ALA 27 -0.779 20.952 -20.375 171 HA ALA 27 HA ALA 27 -2.928 22.234 -21.628 172 HB1 ALA 27 1HB ALA 27 -2.829 23.626 -19.883 173 HB2 ALA 27 2HB ALA 27 -1.537 22.581 -19.290 174 HB3 ALA 27 3HB ALA 27 -1.143 24.041 -20.196 175 H ARG 28 H ARG 28 -3.041 23.318 -23.473 176 HA ARG 28 HA ARG 28 -0.606 24.093 -24.849 177 HB2 ARG 28 1HB ARG 28 -3.499 23.903 -25.609 178 HB3 ARG 28 2HB ARG 28 -2.393 24.838 -26.606 179 HG2 ARG 28 1HG ARG 28 -1.588 22.080 -25.877 180 HG3 ARG 28 2HG ARG 28 -2.884 22.280 -27.059 181 HD2 ARG 28 1HD ARG 28 -1.485 23.515 -28.518 182 HD3 ARG 28 2HD ARG 28 -0.244 23.704 -27.280 183 HE ARG 28 HE ARG 28 -0.681 20.964 -27.829 184 HH11 ARG 28 1HH1 ARG 28 0.776 23.829 -29.166 185 HH12 ARG 28 2HH1 ARG 28 1.959 22.957 -30.084 186 HH21 ARG 28 1HH2 ARG 28 0.871 19.805 -29.034 187 HH22 ARG 28 2HH2 ARG 28 2.011 20.668 -30.009 188 H ALA 29 H ALA 29 -0.321 26.223 -25.768 189 HA ALA 29 HA ALA 29 -1.198 28.300 -23.916 190 HB1 ALA 29 1HB ALA 29 0.476 29.652 -25.416 191 HB2 ALA 29 2HB ALA 29 1.067 28.529 -24.191 192 HB3 ALA 29 3HB ALA 29 1.022 28.042 -25.885 193 H GLY 30 H GLY 30 -2.183 30.236 -24.580 194 HA2 GLY 30 1HA GLY 30 -3.374 31.652 -25.981 195 HA3 GLY 30 2HA GLY 30 -2.980 30.599 -27.332 196 H GLN 31 H GLN 31 -4.132 28.582 -25.049 197 HA GLN 31 HA GLN 31 -6.902 28.846 -26.019 198 HB2 GLN 31 1HB GLN 31 -5.131 26.471 -25.699 199 HB3 GLN 31 2HB GLN 31 -6.851 26.264 -25.393 200 HG2 GLN 31 1HG GLN 31 -7.085 27.470 -27.709 201 HG3 GLN 31 2HG GLN 31 -5.435 26.889 -27.931 202 HE21 GLN 31 2HE2 GLN 31 -5.114 24.542 -27.463 203 HE22 GLN 31 1HE2 GLN 31 -6.353 23.454 -27.979 204 H THR 32 H THR 32 -8.588 28.225 -24.573 205 HA THR 32 HA THR 32 -8.039 28.977 -21.848 206 HB THR 32 HB THR 32 -10.647 28.003 -23.029 207 HG1 THR 32 HG1 THR 32 -10.278 29.830 -24.135 208 HG21 THR 32 3HG2 THR 32 -11.365 28.126 -20.920 209 HG22 THR 32 1HG2 THR 32 -11.091 29.866 -20.996 210 HG23 THR 32 2HG2 THR 32 -9.829 28.801 -20.377 211 H VAL 33 H VAL 33 -7.520 27.638 -20.257 212 HA VAL 33 HA VAL 33 -8.193 24.782 -20.545 213 HB VAL 33 HB VAL 33 -5.799 25.082 -20.595 214 HG11 VAL 33 1HG1 VAL 33 -6.315 27.184 -18.792 215 HG12 VAL 33 2HG1 VAL 33 -5.280 26.030 -17.949 216 HG13 VAL 33 3HG1 VAL 33 -4.769 26.710 -19.494 217 HG21 VAL 33 3HG2 VAL 33 -6.624 23.122 -19.419 218 HG22 VAL 33 1HG2 VAL 33 -5.150 23.719 -18.655 219 HG23 VAL 33 2HG2 VAL 33 -6.719 24.040 -17.916 220 H SER 34 H SER 34 -9.307 23.795 -18.958 221 HA SER 34 HA SER 34 -10.180 25.457 -16.708 222 HB2 SER 34 1HB SER 34 -11.612 23.854 -18.435 223 HB3 SER 34 2HB SER 34 -11.460 22.838 -17.003 224 HG SER 34 HG SER 34 -13.191 24.715 -17.339 225 H VAL 35 H VAL 35 -9.255 25.181 -14.800 226 HA VAL 35 HA VAL 35 -8.514 22.494 -13.923 227 HB VAL 35 HB VAL 35 -6.310 23.058 -13.261 228 HG11 VAL 35 1HG1 VAL 35 -6.517 24.367 -15.954 229 HG12 VAL 35 2HG1 VAL 35 -5.232 23.336 -15.321 230 HG13 VAL 35 3HG1 VAL 35 -6.798 22.639 -15.738 231 HG21 VAL 35 3HG2 VAL 35 -6.994 25.892 -14.027 232 HG22 VAL 35 1HG2 VAL 35 -6.642 25.275 -12.413 233 HG23 VAL 35 2HG2 VAL 35 -5.368 25.337 -13.631 234 H HIS 36 H HIS 36 -7.948 22.461 -11.575 235 HA HIS 36 HA HIS 36 -9.648 24.378 -10.137 236 HB2 HIS 36 1HB HIS 36 -9.046 21.502 -9.806 237 HB3 HIS 36 2HB HIS 36 -9.170 22.429 -8.314 238 HD1 HIS 36 HD1 HIS 36 -11.478 24.336 -9.255 239 HD2 HIS 36 HD2 HIS 36 -11.457 20.199 -9.646 240 HE1 HIS 36 HE1 HIS 36 -13.896 23.663 -9.417 241 H TYR 37 H TYR 37 -8.818 25.722 -8.658 242 HA TYR 37 HA TYR 37 -5.990 25.357 -7.911 243 HB2 TYR 37 1HB TYR 37 -5.735 27.756 -7.856 244 HB3 TYR 37 2HB TYR 37 -6.415 27.302 -9.415 245 HD1 TYR 37 HD1 TYR 37 -7.160 28.842 -6.149 246 HD2 TYR 37 HD2 TYR 37 -8.595 28.033 -10.072 247 HE1 TYR 37 HE1 TYR 37 -9.013 30.419 -5.790 248 HE2 TYR 37 HE2 TYR 37 -10.451 29.609 -9.724 249 HH TYR 37 HH TYR 37 -10.827 31.357 -6.652 250 H THR 38 H THR 38 -5.447 25.469 -5.797 251 HA THR 38 HA THR 38 -7.515 26.276 -3.869 252 HB THR 38 HB THR 38 -5.896 24.128 -2.809 253 HG1 THR 38 HG1 THR 38 -6.917 22.493 -4.171 254 HG21 THR 38 3HG2 THR 38 -8.714 24.960 -2.966 255 HG22 THR 38 1HG2 THR 38 -7.798 24.309 -1.607 256 HG23 THR 38 2HG2 THR 38 -8.454 23.221 -2.831 257 H GLY 39 H GLY 39 -6.710 27.952 -2.788 258 HA2 GLY 39 1HA GLY 39 -3.847 28.296 -2.488 259 HA3 GLY 39 2HA GLY 39 -5.095 29.426 -1.984 260 H TRP 40 H TRP 40 -2.657 27.852 -0.751 261 HA TRP 40 HA TRP 40 -4.020 27.392 1.811 262 HB2 TRP 40 1HB TRP 40 -2.137 25.553 0.368 263 HB3 TRP 40 2HB TRP 40 -2.218 25.532 2.128 264 HD1 TRP 40 HD1 TRP 40 -5.330 25.794 2.546 265 HE1 TRP 40 HE1 TRP 40 -6.886 23.851 1.890 266 HE3 TRP 40 HE3 TRP 40 -2.278 23.397 -0.782 267 HZ2 TRP 40 HZ2 TRP 40 -6.828 21.601 0.188 268 HZ3 TRP 40 HZ3 TRP 40 -3.103 21.356 -1.880 269 HH2 TRP 40 HH2 TRP 40 -5.331 20.477 -1.404 270 H LEU 41 H LEU 41 -3.024 28.250 3.550 271 HA LEU 41 HA LEU 41 -0.802 30.006 3.123 272 HB2 LEU 41 1HB LEU 41 -2.668 29.381 5.319 273 HB3 LEU 41 2HB LEU 41 -1.079 29.969 5.805 274 HG LEU 41 HG LEU 41 -2.933 31.427 3.925 275 HD11 LEU 41 1HD1 LEU 41 -2.994 32.981 6.030 276 HD12 LEU 41 2HD1 LEU 41 -2.636 31.483 6.889 277 HD13 LEU 41 3HD1 LEU 41 -4.090 31.605 5.898 278 HD21 LEU 41 3HD2 LEU 41 -0.696 32.690 5.426 279 HD22 LEU 41 1HD2 LEU 41 -1.404 33.126 3.871 280 HD23 LEU 41 2HD2 LEU 41 -0.319 31.740 3.988 281 H THR 42 H THR 42 1.010 29.984 4.844 282 HA THR 42 HA THR 42 2.602 27.724 4.424 283 HB THR 42 HB THR 42 4.148 28.660 6.056 284 HG1 THR 42 HG1 THR 42 3.326 30.739 7.056 285 HG21 THR 42 3HG2 THR 42 2.807 30.573 4.173 286 HG22 THR 42 1HG2 THR 42 4.357 29.751 4.000 287 HG23 THR 42 2HG2 THR 42 4.184 31.075 5.152 288 H ASP 43 H ASP 43 0.458 28.583 7.074 289 HA ASP 43 HA ASP 43 1.273 26.314 8.675 290 HB2 ASP 43 1HB ASP 43 0.571 28.495 9.683 291 HB3 ASP 43 2HB ASP 43 -1.063 28.185 9.104 292 H GLY 44 H GLY 44 -1.002 26.972 6.207 293 HA2 GLY 44 1HA GLY 44 -1.965 24.951 5.167 294 HA3 GLY 44 2HA GLY 44 -2.358 24.411 6.793 295 H GLN 45 H GLN 45 -2.833 27.696 6.629 296 HA GLN 45 HA GLN 45 -5.668 27.426 6.793 297 HB2 GLN 45 1HB GLN 45 -3.694 29.605 7.048 298 HB3 GLN 45 2HB GLN 45 -5.291 30.099 6.502 299 HG2 GLN 45 1HG GLN 45 -6.317 29.400 8.465 300 HG3 GLN 45 2HG GLN 45 -4.965 28.363 8.915 301 HE21 GLN 45 2HE2 GLN 45 -6.385 30.606 10.296 302 HE22 GLN 45 1HE2 GLN 45 -5.128 31.686 10.782 303 H LYS 46 H LYS 46 -6.882 27.021 5.070 304 HA LYS 46 HA LYS 46 -6.093 27.633 2.406 305 HB2 LYS 46 1HB LYS 46 -7.513 25.723 2.843 306 HB3 LYS 46 2HB LYS 46 -8.748 26.755 3.552 307 HG2 LYS 46 1HG LYS 46 -8.984 27.863 1.325 308 HG3 LYS 46 2HG LYS 46 -7.905 26.630 0.668 309 HD2 LYS 46 1HD LYS 46 -10.361 25.864 2.207 310 HD3 LYS 46 2HD LYS 46 -10.458 26.273 0.493 311 HE2 LYS 46 1HE LYS 46 -8.510 24.566 0.254 312 HE3 LYS 46 2HE LYS 46 -9.063 23.986 1.824 313 HZ1 LYS 46 3HZ LYS 46 -10.078 23.295 -0.631 314 HZ2 LYS 46 1HZ LYS 46 -11.238 24.338 0.024 315 HZ3 LYS 46 2HZ LYS 46 -10.766 22.956 0.877 316 H PHE 47 H PHE 47 -6.663 29.282 1.076 317 HA PHE 47 HA PHE 47 -8.578 31.274 2.050 318 HB2 PHE 47 1HB PHE 47 -7.037 33.102 1.382 319 HB3 PHE 47 2HB PHE 47 -6.412 32.138 2.716 320 HD1 PHE 47 HD2 PHE 47 -6.069 32.895 -0.862 321 HD2 PHE 47 HD1 PHE 47 -4.427 30.840 2.483 322 HE1 PHE 47 HE2 PHE 47 -3.994 32.505 -2.125 323 HE2 PHE 47 HE1 PHE 47 -2.348 30.447 1.226 324 HZ PHE 47 HZ PHE 47 -2.130 31.279 -1.081 325 H ASP 48 H ASP 48 -8.461 29.168 -0.087 326 HA ASP 48 HA ASP 48 -9.873 30.528 -2.081 327 HB2 ASP 48 1HB ASP 48 -7.014 30.678 -2.372 328 HB3 ASP 48 2HB ASP 48 -7.696 29.741 -3.698 329 H SER 49 H SER 49 -11.168 29.042 -2.924 330 HA SER 49 HA SER 49 -10.164 26.431 -3.672 331 HB2 SER 49 1HB SER 49 -10.680 25.766 -1.495 332 HB3 SER 49 2HB SER 49 -12.066 26.852 -1.387 333 HG SER 49 HG SER 49 -11.995 24.665 -3.179 334 H SER 50 H SER 50 -10.765 26.792 -5.764 335 HA SER 50 HA SER 50 -13.113 27.994 -6.655 336 HB2 SER 50 1HB SER 50 -10.882 26.737 -7.833 337 HB3 SER 50 2HB SER 50 -12.300 25.909 -8.476 338 HG SER 50 HG SER 50 -13.126 27.979 -9.049 339 H LYS 51 H LYS 51 -12.566 24.833 -5.388 340 HA LYS 51 HA LYS 51 -14.692 23.414 -6.517 341 HB2 LYS 51 1HB LYS 51 -13.266 23.184 -3.876 342 HB3 LYS 51 2HB LYS 51 -14.582 22.100 -4.306 343 HG2 LYS 51 1HG LYS 51 -12.174 22.469 -6.059 344 HG3 LYS 51 2HG LYS 51 -12.225 21.285 -4.751 345 HD2 LYS 51 1HD LYS 51 -14.492 21.298 -6.663 346 HD3 LYS 51 2HD LYS 51 -12.941 20.694 -7.251 347 HE2 LYS 51 1HE LYS 51 -13.005 18.857 -5.931 348 HE3 LYS 51 2HE LYS 51 -13.807 19.703 -4.609 349 HZ1 LYS 51 3HZ LYS 51 -15.217 18.005 -5.649 350 HZ2 LYS 51 1HZ LYS 51 -15.140 18.841 -7.118 351 HZ3 LYS 51 2HZ LYS 51 -15.887 19.553 -5.778 352 H ASP 52 H ASP 52 -14.682 25.961 -4.217 353 HA ASP 52 HA ASP 52 -16.976 25.478 -2.737 354 HB2 ASP 52 1HB ASP 52 -15.243 27.436 -2.643 355 HB3 ASP 52 2HB ASP 52 -16.373 28.242 -3.728 356 H ARG 53 H ARG 53 -16.670 27.076 -5.895 357 HA ARG 53 HA ARG 53 -19.516 27.410 -6.160 358 HB2 ARG 53 1HB ARG 53 -18.926 28.166 -8.476 359 HB3 ARG 53 2HB ARG 53 -18.126 29.061 -7.192 360 HG2 ARG 53 1HG ARG 53 -16.062 28.017 -7.604 361 HG3 ARG 53 2HG ARG 53 -16.806 26.764 -8.599 362 HD2 ARG 53 1HD ARG 53 -15.931 28.131 -10.220 363 HD3 ARG 53 2HD ARG 53 -17.552 28.806 -10.062 364 HE ARG 53 HE ARG 53 -15.970 30.200 -8.287 365 HH11 ARG 53 1HH1 ARG 53 -16.052 29.642 -11.722 366 HH12 ARG 53 2HH1 ARG 53 -15.339 31.170 -12.119 367 HH21 ARG 53 1HH2 ARG 53 -15.029 32.215 -8.797 368 HH22 ARG 53 2HH2 ARG 53 -14.757 32.632 -10.455 369 H ASN 54 H ASN 54 -17.595 24.765 -6.351 370 HA ASN 54 HA ASN 54 -17.811 22.680 -7.233 371 HB2 ASN 54 1HB ASN 54 -20.612 23.736 -7.372 372 HB3 ASN 54 2HB ASN 54 -20.237 22.176 -8.098 373 HD21 ASN 54 2HD2 ASN 54 -18.954 20.695 -6.618 374 HD22 ASN 54 1HD2 ASN 54 -19.483 20.617 -4.975 375 H ASP 55 H ASP 55 -16.913 24.855 -8.937 376 HA ASP 55 HA ASP 55 -17.352 23.542 -11.508 377 HB2 ASP 55 1HB ASP 55 -18.592 25.990 -10.846 378 HB3 ASP 55 2HB ASP 55 -17.274 26.384 -11.946 379 HA PRO 56 HA PRO 56 -13.004 24.103 -11.866 380 HB2 PRO 56 1HB PRO 56 -12.750 23.891 -14.560 381 HB3 PRO 56 2HB PRO 56 -13.083 22.505 -13.515 382 HG2 PRO 56 1HG PRO 56 -14.976 24.124 -15.175 383 HG3 PRO 56 2HG PRO 56 -14.896 22.365 -14.964 384 HD2 PRO 56 1HD PRO 56 -16.689 23.911 -13.649 385 HD3 PRO 56 2HD PRO 56 -16.006 22.431 -12.945 386 H PHE 57 H PHE 57 -11.386 25.531 -12.734 387 HA PHE 57 HA PHE 57 -12.480 28.176 -13.378 388 HB2 PHE 57 1HB PHE 57 -11.108 28.223 -11.418 389 HB3 PHE 57 2HB PHE 57 -9.829 27.314 -12.218 390 HD1 PHE 57 HD1 PHE 57 -11.777 30.310 -13.275 391 HD2 PHE 57 HD2 PHE 57 -7.967 28.657 -12.344 392 HE1 PHE 57 HE1 PHE 57 -10.702 32.420 -13.943 393 HE2 PHE 57 HE2 PHE 57 -6.886 30.765 -13.010 394 HZ PHE 57 HZ PHE 57 -8.254 32.650 -13.810 395 H ALA 58 H ALA 58 -12.644 28.390 -15.530 396 HA ALA 58 HA ALA 58 -10.566 27.331 -17.276 397 HB1 ALA 58 1HB ALA 58 -13.275 28.524 -17.769 398 HB2 ALA 58 2HB ALA 58 -12.129 28.241 -19.080 399 HB3 ALA 58 3HB ALA 58 -12.708 26.888 -18.108 400 H PHE 59 H PHE 59 -8.925 28.514 -17.988 401 HA PHE 59 HA PHE 59 -9.253 31.375 -18.418 402 HB2 PHE 59 1HB PHE 59 -7.416 32.044 -17.060 403 HB3 PHE 59 2HB PHE 59 -8.426 31.016 -16.049 404 HD1 PHE 59 HD2 PHE 59 -7.721 28.685 -15.575 405 HD2 PHE 59 HD1 PHE 59 -5.189 31.456 -17.582 406 HE1 PHE 59 HE2 PHE 59 -5.777 27.258 -15.085 407 HE2 PHE 59 HE1 PHE 59 -3.241 30.033 -17.096 408 HZ PHE 59 HZ PHE 59 -3.534 27.932 -15.845 409 H VAL 60 H VAL 60 -7.716 32.277 -19.837 410 HA VAL 60 HA VAL 60 -6.682 30.431 -21.763 411 HB VAL 60 HB VAL 60 -6.173 33.403 -21.610 412 HG11 VAL 60 1HG1 VAL 60 -4.702 32.168 -23.133 413 HG12 VAL 60 2HG1 VAL 60 -6.116 31.492 -23.944 414 HG13 VAL 60 3HG1 VAL 60 -5.806 33.227 -24.010 415 HG21 VAL 60 3HG2 VAL 60 -8.429 33.503 -21.769 416 HG22 VAL 60 1HG2 VAL 60 -8.094 33.174 -23.469 417 HG23 VAL 60 2HG2 VAL 60 -8.567 31.860 -22.393 418 H LEU 61 H LEU 61 -4.791 29.431 -21.673 419 HA LEU 61 HA LEU 61 -2.804 30.146 -19.733 420 HB2 LEU 61 1HB LEU 61 -2.979 27.857 -20.070 421 HB3 LEU 61 2HB LEU 61 -3.067 28.023 -21.822 422 HG LEU 61 HG LEU 61 -0.717 28.402 -21.980 423 HD11 LEU 61 1HD1 LEU 61 0.359 28.034 -19.461 424 HD12 LEU 61 2HD1 LEU 61 -0.997 29.126 -19.187 425 HD13 LEU 61 3HD1 LEU 61 0.259 29.556 -20.347 426 HD21 LEU 61 3HD2 LEU 61 -1.719 26.077 -20.476 427 HD22 LEU 61 1HD2 LEU 61 0.026 26.327 -20.425 428 HD23 LEU 61 2HD2 LEU 61 -0.794 26.151 -21.976 429 H GLY 62 H GLY 62 -1.125 31.468 -19.985 430 HA2 GLY 62 1HA GLY 62 0.630 31.708 -22.038 431 HA3 GLY 62 2HA GLY 62 -0.690 32.759 -22.529 432 H GLY 63 H GLY 63 -1.395 33.665 -19.906 433 HA2 GLY 63 1HA GLY 63 0.151 34.653 -18.092 434 HA3 GLY 63 2HA GLY 63 0.884 35.473 -19.463 435 H GLY 64 H GLY 64 -0.414 36.634 -17.127 436 HA2 GLY 64 1HA GLY 64 -1.477 38.882 -17.670 437 HA3 GLY 64 2HA GLY 64 -2.748 37.914 -18.403 438 H MET 65 H MET 65 -4.380 37.191 -17.160 439 HA MET 65 HA MET 65 -4.810 38.261 -14.615 440 HB2 MET 65 1HB MET 65 -6.277 36.750 -16.476 441 HB3 MET 65 2HB MET 65 -6.300 35.817 -14.985 442 HG2 MET 65 1HG MET 65 -8.211 37.218 -14.986 443 HG3 MET 65 2HG MET 65 -7.078 37.866 -13.801 444 HE1 MET 65 3HE MET 65 -8.731 38.055 -17.122 445 HE2 MET 65 1HE MET 65 -9.626 39.293 -16.240 446 HE3 MET 65 2HE MET 65 -8.623 39.745 -17.618 447 H VAL 66 H VAL 66 -3.059 35.476 -15.603 448 HA VAL 66 HA VAL 66 -3.091 34.320 -12.917 449 HB VAL 66 HB VAL 66 -1.961 32.412 -13.853 450 HG11 VAL 66 1HG1 VAL 66 -3.706 32.455 -16.074 451 HG12 VAL 66 2HG1 VAL 66 -3.964 31.705 -14.498 452 HG13 VAL 66 3HG1 VAL 66 -4.484 33.366 -14.781 453 HG21 VAL 66 3HG2 VAL 66 -1.761 34.039 -16.385 454 HG22 VAL 66 1HG2 VAL 66 -0.429 33.512 -15.357 455 HG23 VAL 66 2HG2 VAL 66 -1.371 32.324 -16.257 456 H ILE 67 H ILE 67 -0.773 33.316 -12.394 457 HA ILE 67 HA ILE 67 1.097 35.587 -12.473 458 HB ILE 67 HB ILE 67 2.002 34.889 -10.407 459 HG12 ILE 67 1HG1 ILE 67 0.407 32.344 -10.762 460 HG13 ILE 67 2HG1 ILE 67 2.160 32.504 -10.808 461 HG21 ILE 67 1HG2 ILE 67 -0.677 34.192 -9.547 462 HG22 ILE 67 2HG2 ILE 67 0.288 35.623 -9.188 463 HG23 ILE 67 3HG2 ILE 67 -0.671 35.554 -10.666 464 HD11 ILE 67 3HD1 ILE 67 2.163 31.985 -8.659 465 HD12 ILE 67 1HD1 ILE 67 1.417 33.552 -8.346 466 HD13 ILE 67 2HD1 ILE 67 0.408 32.121 -8.561 467 H LYS 68 H LYS 68 3.431 34.983 -12.375 468 HA LYS 68 HA LYS 68 4.251 33.575 -14.580 469 HB2 LYS 68 1HB LYS 68 6.485 33.380 -13.359 470 HB3 LYS 68 2HB LYS 68 5.831 34.999 -13.568 471 HG2 LYS 68 1HG LYS 68 4.802 34.184 -11.137 472 HG3 LYS 68 2HG LYS 68 6.447 33.544 -11.142 473 HD2 LYS 68 1HD LYS 68 5.743 36.403 -11.792 474 HD3 LYS 68 2HD LYS 68 6.236 35.846 -10.192 475 HE2 LYS 68 1HE LYS 68 8.355 35.038 -11.160 476 HE3 LYS 68 2HE LYS 68 7.861 35.673 -12.728 477 HZ1 LYS 68 3HZ LYS 68 7.728 37.598 -10.588 478 HZ2 LYS 68 1HZ LYS 68 8.393 37.745 -12.137 479 HZ3 LYS 68 2HZ LYS 68 9.293 37.032 -10.896 480 H GLY 69 H GLY 69 4.183 32.371 -11.224 481 HA2 GLY 69 1HA GLY 69 5.102 29.787 -11.740 482 HA3 GLY 69 2HA GLY 69 4.071 30.237 -10.389 483 H TRP 70 H TRP 70 1.932 31.178 -12.200 484 HA TRP 70 HA TRP 70 0.519 28.721 -12.412 485 HB2 TRP 70 1HB TRP 70 -0.109 31.489 -12.487 486 HB3 TRP 70 2HB TRP 70 -0.739 30.771 -13.966 487 HD1 TRP 70 HD1 TRP 70 -3.009 29.580 -13.772 488 HE1 TRP 70 HE1 TRP 70 -4.521 28.829 -11.830 489 HE3 TRP 70 HE3 TRP 70 0.137 30.568 -9.865 490 HZ2 TRP 70 HZ2 TRP 70 -4.397 28.676 -9.014 491 HZ3 TRP 70 HZ3 TRP 70 -0.637 30.091 -7.579 492 HH2 TRP 70 HH2 TRP 70 -2.857 29.165 -7.164 493 H ASP 71 H ASP 71 1.495 31.061 -14.926 494 HA ASP 71 HA ASP 71 0.810 29.546 -17.141 495 HB2 ASP 71 1HB ASP 71 1.385 31.795 -17.541 496 HB3 ASP 71 2HB ASP 71 2.929 31.639 -16.708 497 H GLU 72 H GLU 72 3.909 29.639 -15.403 498 HA GLU 72 HA GLU 72 5.251 27.795 -17.054 499 HB2 GLU 72 1HB GLU 72 6.427 29.283 -15.503 500 HB3 GLU 72 2HB GLU 72 5.709 28.442 -14.137 501 HG2 GLU 72 1HG GLU 72 7.885 27.602 -14.313 502 HG3 GLU 72 2HG GLU 72 6.847 26.354 -14.999 503 H GLY 73 H GLY 73 3.300 27.380 -14.135 504 HA2 GLY 73 1HA GLY 73 3.821 24.640 -13.734 505 HA3 GLY 73 2HA GLY 73 2.408 25.508 -13.152 506 H VAL 74 H VAL 74 0.845 26.084 -15.072 507 HA VAL 74 HA VAL 74 -0.254 23.688 -15.990 508 HB VAL 74 HB VAL 74 -1.582 25.164 -17.567 509 HG11 VAL 74 1HG1 VAL 74 -1.603 24.998 -14.704 510 HG12 VAL 74 2HG1 VAL 74 -2.209 26.573 -15.221 511 HG13 VAL 74 3HG1 VAL 74 -2.960 25.096 -15.827 512 HG21 VAL 74 3HG2 VAL 74 -0.816 27.605 -16.193 513 HG22 VAL 74 1HG2 VAL 74 0.503 26.930 -17.151 514 HG23 VAL 74 2HG2 VAL 74 -1.043 27.302 -17.916 515 H GLN 75 H GLN 75 2.090 25.834 -17.443 516 HA GLN 75 HA GLN 75 1.973 25.112 -20.101 517 HB2 GLN 75 1HB GLN 75 4.022 26.199 -18.301 518 HB3 GLN 75 2HB GLN 75 4.674 25.333 -19.686 519 HG2 GLN 75 1HG GLN 75 2.558 27.413 -20.050 520 HG3 GLN 75 2HG GLN 75 4.252 27.868 -19.866 521 HE21 GLN 75 2HE2 GLN 75 5.671 27.494 -21.513 522 HE22 GLN 75 1HE2 GLN 75 5.191 26.937 -23.076 523 H GLY 76 H GLY 76 3.113 23.269 -17.386 524 HA2 GLY 76 1HA GLY 76 4.105 21.179 -19.216 525 HA3 GLY 76 2HA GLY 76 4.587 21.352 -17.535 526 H MET 77 H MET 77 1.959 21.763 -16.478 527 HA MET 77 HA MET 77 1.202 19.184 -15.861 528 HB2 MET 77 1HB MET 77 -0.436 21.720 -15.874 529 HB3 MET 77 2HB MET 77 -1.002 20.206 -15.183 530 HG2 MET 77 1HG MET 77 0.879 20.220 -13.620 531 HG3 MET 77 2HG MET 77 1.429 21.747 -14.306 532 HE1 MET 77 3HE MET 77 -2.313 20.793 -12.019 533 HE2 MET 77 1HE MET 77 -0.985 19.743 -12.516 534 HE3 MET 77 2HE MET 77 -0.857 20.682 -11.028 535 H LYS 78 H LYS 78 -0.594 17.883 -16.477 536 HA LYS 78 HA LYS 78 -1.581 18.411 -19.204 537 HB2 LYS 78 1HB LYS 78 -0.663 15.814 -17.974 538 HB3 LYS 78 2HB LYS 78 -1.640 15.877 -19.435 539 HG2 LYS 78 1HG LYS 78 0.137 16.294 -20.690 540 HG3 LYS 78 2HG LYS 78 0.633 17.632 -19.651 541 HD2 LYS 78 1HD LYS 78 2.037 16.324 -18.405 542 HD3 LYS 78 2HD LYS 78 1.090 14.859 -18.677 543 HE2 LYS 78 1HE LYS 78 2.258 14.312 -20.511 544 HE3 LYS 78 2HE LYS 78 2.266 15.969 -21.112 545 HZ1 LYS 78 3HZ LYS 78 4.380 14.591 -19.994 546 HZ2 LYS 78 1HZ LYS 78 3.928 15.734 -18.831 547 HZ3 LYS 78 2HZ LYS 78 4.331 16.234 -20.396 548 H VAL 79 H VAL 79 -3.644 17.363 -19.719 549 HA VAL 79 HA VAL 79 -5.663 17.967 -17.935 550 HB VAL 79 HB VAL 79 -5.736 15.901 -20.139 551 HG11 VAL 79 1HG1 VAL 79 -7.667 15.419 -19.008 552 HG12 VAL 79 2HG1 VAL 79 -7.835 17.057 -18.374 553 HG13 VAL 79 3HG1 VAL 79 -8.239 16.716 -20.057 554 HG21 VAL 79 3HG2 VAL 79 -5.383 17.718 -21.411 555 HG22 VAL 79 1HG2 VAL 79 -7.069 18.091 -21.053 556 HG23 VAL 79 2HG2 VAL 79 -5.781 18.833 -20.104 557 H GLY 80 H GLY 80 -6.428 17.047 -16.146 558 HA2 GLY 80 1HA GLY 80 -7.104 15.335 -14.716 559 HA3 GLY 80 2HA GLY 80 -6.357 14.170 -15.799 560 H GLY 81 H GLY 81 -4.106 16.513 -15.316 561 HA2 GLY 81 1HA GLY 81 -2.685 14.840 -13.395 562 HA3 GLY 81 2HA GLY 81 -1.998 16.151 -14.343 563 H VAL 82 H VAL 82 -2.401 15.308 -11.317 564 HA VAL 82 HA VAL 82 -3.141 18.010 -10.397 565 HB VAL 82 HB VAL 82 -3.260 15.441 -8.810 566 HG11 VAL 82 1HG1 VAL 82 -3.431 18.249 -8.097 567 HG12 VAL 82 2HG1 VAL 82 -4.864 17.345 -7.606 568 HG13 VAL 82 3HG1 VAL 82 -3.266 16.829 -7.065 569 HG21 VAL 82 3HG2 VAL 82 -5.012 15.193 -10.300 570 HG22 VAL 82 1HG2 VAL 82 -5.791 16.026 -8.954 571 HG23 VAL 82 2HG2 VAL 82 -5.316 16.928 -10.393 572 H ARG 83 H ARG 83 -1.585 19.197 -9.515 573 HA ARG 83 HA ARG 83 0.601 17.919 -8.075 574 HB2 ARG 83 1HB ARG 83 1.171 19.901 -10.279 575 HB3 ARG 83 2HB ARG 83 2.340 19.005 -9.319 576 HG2 ARG 83 1HG ARG 83 1.313 16.905 -10.327 577 HG3 ARG 83 2HG ARG 83 0.527 17.988 -11.478 578 HD2 ARG 83 1HD ARG 83 2.565 18.689 -12.386 579 HD3 ARG 83 2HD ARG 83 3.486 18.099 -11.003 580 HE ARG 83 HE ARG 83 3.526 16.010 -11.954 581 HH11 ARG 83 1HH1 ARG 83 1.207 18.003 -13.619 582 HH12 ARG 83 2HH1 ARG 83 0.956 16.866 -14.902 583 HH21 ARG 83 1HH2 ARG 83 3.204 14.505 -13.638 584 HH22 ARG 83 2HH2 ARG 83 2.091 14.876 -14.911 585 H ARG 84 H ARG 84 1.472 19.179 -6.473 586 HA ARG 84 HA ARG 84 -0.025 21.567 -5.793 587 HB2 ARG 84 1HB ARG 84 0.853 19.592 -4.240 588 HB3 ARG 84 2HB ARG 84 2.269 20.630 -4.142 589 HG2 ARG 84 1HG ARG 84 0.706 22.490 -3.461 590 HG3 ARG 84 2HG ARG 84 -0.544 21.255 -3.299 591 HD2 ARG 84 1HD ARG 84 1.347 20.076 -1.859 592 HD3 ARG 84 2HD ARG 84 1.879 21.744 -1.653 593 HE ARG 84 HE ARG 84 -0.777 21.834 -1.089 594 HH11 ARG 84 1HH1 ARG 84 1.892 19.929 0.081 595 HH12 ARG 84 2HH1 ARG 84 1.224 19.729 1.667 596 HH21 ARG 84 1HH2 ARG 84 -1.668 21.578 0.996 597 HH22 ARG 84 2HH2 ARG 84 -0.802 20.667 2.186 598 H LEU 85 H LEU 85 0.590 23.361 -6.839 599 HA LEU 85 HA LEU 85 3.382 23.845 -7.456 600 HB2 LEU 85 1HB LEU 85 1.618 24.372 -9.084 601 HB3 LEU 85 2HB LEU 85 0.946 25.549 -7.957 602 HG LEU 85 HG LEU 85 3.445 26.511 -8.174 603 HD11 LEU 85 1HD1 LEU 85 4.434 25.151 -9.733 604 HD12 LEU 85 2HD1 LEU 85 3.781 26.421 -10.769 605 HD13 LEU 85 3HD1 LEU 85 2.931 24.883 -10.617 606 HD21 LEU 85 3HD2 LEU 85 1.110 27.526 -8.630 607 HD22 LEU 85 1HD2 LEU 85 1.460 27.157 -10.319 608 HD23 LEU 85 2HD2 LEU 85 2.521 28.238 -9.415 609 H THR 86 H THR 86 4.708 24.810 -6.083 610 HA THR 86 HA THR 86 3.584 26.478 -3.946 611 HB THR 86 HB THR 86 6.462 25.686 -3.975 612 HG1 THR 86 HG1 THR 86 5.724 23.698 -2.875 613 HG21 THR 86 3HG2 THR 86 5.262 27.147 -2.227 614 HG22 THR 86 1HG2 THR 86 6.284 25.834 -1.645 615 HG23 THR 86 2HG2 THR 86 4.531 25.640 -1.674 616 H ILE 87 H ILE 87 3.720 28.609 -4.118 617 HA ILE 87 HA ILE 87 5.881 29.752 -5.766 618 HB ILE 87 HB ILE 87 3.169 30.996 -5.316 619 HG12 ILE 87 1HG1 ILE 87 3.103 30.391 -7.911 620 HG13 ILE 87 2HG1 ILE 87 4.159 29.087 -7.380 621 HG21 ILE 87 1HG2 ILE 87 4.934 32.592 -5.796 622 HG22 ILE 87 2HG2 ILE 87 5.411 31.665 -7.217 623 HG23 ILE 87 3HG2 ILE 87 3.838 32.461 -7.171 624 HD11 ILE 87 3HD1 ILE 87 2.061 29.098 -5.556 625 HD12 ILE 87 1HD1 ILE 87 1.309 29.360 -7.129 626 HD13 ILE 87 2HD1 ILE 87 2.334 27.949 -6.866 627 HA PRO 88 HA PRO 88 7.166 31.743 -2.027 628 HB2 PRO 88 1HB PRO 88 8.936 33.465 -3.153 629 HB3 PRO 88 2HB PRO 88 9.272 31.742 -2.944 630 HG2 PRO 88 1HG PRO 88 8.352 33.211 -5.386 631 HG3 PRO 88 2HG PRO 88 9.581 31.940 -5.241 632 HD2 PRO 88 1HD PRO 88 7.066 31.442 -6.114 633 HD3 PRO 88 2HD PRO 88 8.011 30.253 -5.195 634 HA PRO 89 HA PRO 89 5.037 35.567 -1.600 635 HB2 PRO 89 1HB PRO 89 6.745 37.082 -0.131 636 HB3 PRO 89 2HB PRO 89 5.860 35.706 0.540 637 HG2 PRO 89 1HG PRO 89 8.692 35.851 -0.419 638 HG3 PRO 89 2HG PRO 89 8.041 35.064 1.031 639 HD2 PRO 89 1HD PRO 89 8.661 33.691 -1.219 640 HD3 PRO 89 2HD PRO 89 7.335 33.209 -0.141 641 H GLN 90 H GLN 90 7.881 35.409 -3.395 642 HA GLN 90 HA GLN 90 7.869 38.235 -4.123 643 HB2 GLN 90 1HB GLN 90 10.026 37.086 -3.726 644 HB3 GLN 90 2HB GLN 90 9.677 36.004 -5.068 645 HG2 GLN 90 1HG GLN 90 9.982 37.654 -6.653 646 HG3 GLN 90 2HG GLN 90 9.706 38.956 -5.498 647 HE21 GLN 90 2HE2 GLN 90 11.371 38.790 -3.588 648 HE22 GLN 90 1HE2 GLN 90 13.018 38.667 -4.095 649 H LEU 91 H LEU 91 7.428 35.054 -5.630 650 HA LEU 91 HA LEU 91 6.504 36.324 -8.091 651 HB2 LEU 91 1HB LEU 91 6.655 33.371 -7.588 652 HB3 LEU 91 2HB LEU 91 6.706 34.229 -9.126 653 HG LEU 91 HG LEU 91 8.897 34.139 -7.053 654 HD11 LEU 91 1HD1 LEU 91 9.019 32.097 -8.107 655 HD12 LEU 91 2HD1 LEU 91 10.057 33.086 -9.133 656 HD13 LEU 91 3HD1 LEU 91 8.406 32.726 -9.636 657 HD21 LEU 91 3HD2 LEU 91 8.351 36.088 -9.031 658 HD22 LEU 91 1HD2 LEU 91 9.739 35.147 -9.578 659 HD23 LEU 91 2HD2 LEU 91 9.777 35.939 -8.002 660 H GLY 92 H GLY 92 4.998 36.272 -5.473 661 HA2 GLY 92 1HA GLY 92 2.523 35.057 -6.537 662 HA3 GLY 92 2HA GLY 92 2.940 34.997 -4.831 663 H TYR 93 H TYR 93 1.565 36.260 -3.769 664 HA TYR 93 HA TYR 93 0.069 38.348 -4.786 665 HB2 TYR 93 1HB TYR 93 0.994 37.734 -1.987 666 HB3 TYR 93 2HB TYR 93 -0.041 39.115 -2.335 667 HD1 TYR 93 HD1 TYR 93 -2.184 38.514 -3.795 668 HD2 TYR 93 HD2 TYR 93 -0.019 35.748 -1.394 669 HE1 TYR 93 HE1 TYR 93 -4.165 37.060 -3.693 670 HE2 TYR 93 HE2 TYR 93 -1.994 34.286 -1.287 671 HH TYR 93 HH TYR 93 -4.447 34.360 -3.282 672 H GLY 94 H GLY 94 3.366 38.338 -3.660 673 HA2 GLY 94 1HA GLY 94 4.971 39.949 -4.268 674 HA3 GLY 94 2HA GLY 94 3.671 41.073 -4.637 675 H ALA 95 H ALA 95 5.348 42.421 -3.401 676 HA ALA 95 HA ALA 95 5.726 42.158 -0.647 677 HB1 ALA 95 1HB ALA 95 7.094 43.831 -1.157 678 HB2 ALA 95 2HB ALA 95 6.232 44.151 -2.662 679 HB3 ALA 95 3HB ALA 95 5.693 44.902 -1.160 680 H ARG 96 H ARG 96 3.013 43.344 -2.468 681 HA ARG 96 HA ARG 96 1.741 44.854 -0.464 682 HB2 ARG 96 1HB ARG 96 0.663 43.363 -2.855 683 HB3 ARG 96 2HB ARG 96 -0.354 44.340 -1.805 684 HG2 ARG 96 1HG ARG 96 1.223 46.261 -2.305 685 HG3 ARG 96 2HG ARG 96 1.891 45.240 -3.580 686 HD2 ARG 96 1HD ARG 96 0.262 46.593 -4.621 687 HD3 ARG 96 2HD ARG 96 -0.474 45.001 -4.444 688 HE ARG 96 HE ARG 96 -1.162 46.510 -2.204 689 HH11 ARG 96 1HH1 ARG 96 -1.716 46.510 -5.641 690 HH12 ARG 96 2HH1 ARG 96 -3.268 47.270 -5.523 691 HH21 ARG 96 1HH2 ARG 96 -3.204 47.512 -2.036 692 HH22 ARG 96 2HH2 ARG 96 -4.113 47.841 -3.472 693 H GLY 97 H GLY 97 1.268 41.459 -1.448 694 HA2 GLY 97 1HA GLY 97 0.543 39.642 -0.241 695 HA3 GLY 97 2HA GLY 97 0.840 40.579 1.216 696 H ALA 98 H ALA 98 -1.379 38.758 0.502 697 HA ALA 98 HA ALA 98 -3.726 40.212 -0.046 698 HB1 ALA 98 1HB ALA 98 -3.393 37.698 -0.136 699 HB2 ALA 98 2HB ALA 98 -3.626 37.707 1.612 700 HB3 ALA 98 3HB ALA 98 -4.916 38.268 0.548 701 H GLY 99 H GLY 99 -5.294 41.098 1.280 702 HA2 GLY 99 1HA GLY 99 -4.505 42.472 3.548 703 HA3 GLY 99 2HA GLY 99 -6.176 42.113 3.142 704 H GLY 100 H GLY 100 -3.674 41.574 5.333 705 HA2 GLY 100 1HA GLY 100 -3.931 40.573 7.438 706 HA3 GLY 100 2HA GLY 100 -5.367 39.750 6.846 707 H VAL 101 H VAL 101 -5.132 37.826 5.627 708 HA VAL 101 HA VAL 101 -3.221 36.041 6.558 709 HB VAL 101 HB VAL 101 -3.869 34.633 4.542 710 HG11 VAL 101 1HG1 VAL 101 -6.417 35.418 5.777 711 HG12 VAL 101 2HG1 VAL 101 -5.612 33.848 5.729 712 HG13 VAL 101 3HG1 VAL 101 -5.115 35.059 6.911 713 HG21 VAL 101 3HG2 VAL 101 -6.086 36.558 4.064 714 HG22 VAL 101 1HG2 VAL 101 -4.520 36.877 3.317 715 HG23 VAL 101 2HG2 VAL 101 -5.368 35.368 2.978 716 H ILE 102 H ILE 102 -1.818 34.713 4.915 717 HA ILE 102 HA ILE 102 0.176 34.667 3.810 718 HB ILE 102 HB ILE 102 -1.319 36.689 2.147 719 HG12 ILE 102 1HG1 ILE 102 -1.261 34.620 0.569 720 HG13 ILE 102 2HG1 ILE 102 -0.885 33.718 2.034 721 HG21 ILE 102 1HG2 ILE 102 0.593 35.623 0.502 722 HG22 ILE 102 2HG2 ILE 102 0.663 37.215 1.257 723 HG23 ILE 102 3HG2 ILE 102 1.471 35.843 2.015 724 HD11 ILE 102 3HD1 ILE 102 -3.219 35.537 2.109 725 HD12 ILE 102 1HD1 ILE 102 -3.360 34.051 1.170 726 HD13 ILE 102 2HD1 ILE 102 -2.968 33.975 2.888 727 HA PRO 103 HA PRO 103 1.888 38.297 6.059 728 HB2 PRO 103 1HB PRO 103 3.927 36.902 7.182 729 HB3 PRO 103 2HB PRO 103 2.308 36.971 7.887 730 HG2 PRO 103 1HG PRO 103 3.553 34.827 6.210 731 HG3 PRO 103 2HG PRO 103 2.556 34.669 7.668 732 HD2 PRO 103 1HD PRO 103 1.560 34.309 5.176 733 HD3 PRO 103 2HD PRO 103 0.588 34.969 6.507 734 HA PRO 104 HA PRO 104 5.196 39.296 3.340 735 HB2 PRO 104 1HB PRO 104 7.014 40.477 4.975 736 HB3 PRO 104 2HB PRO 104 5.485 41.242 4.526 737 HG2 PRO 104 1HG PRO 104 6.200 39.765 7.030 738 HG3 PRO 104 2HG PRO 104 5.290 41.276 6.843 739 HD2 PRO 104 1HD PRO 104 4.082 38.890 7.264 740 HD3 PRO 104 2HD PRO 104 3.338 40.179 6.296 741 H ASN 105 H ASN 105 6.827 38.219 2.405 742 HA ASN 105 HA ASN 105 8.562 36.786 2.071 743 HB2 ASN 105 1HB ASN 105 9.240 36.869 4.993 744 HB3 ASN 105 2HB ASN 105 10.320 36.764 3.606 745 HD21 ASN 105 2HD2 ASN 105 10.350 38.697 2.179 746 HD22 ASN 105 1HD2 ASN 105 10.263 40.249 2.935 747 H ALA 106 H ALA 106 6.036 35.695 2.520 748 HA ALA 106 HA ALA 106 6.686 33.213 3.974 749 HB1 ALA 106 1HB ALA 106 3.848 33.703 3.493 750 HB2 ALA 106 2HB ALA 106 4.683 33.216 4.968 751 HB3 ALA 106 3HB ALA 106 4.616 34.919 4.515 752 H THR 107 H THR 107 6.171 31.248 3.025 753 HA THR 107 HA THR 107 6.002 31.302 0.132 754 HB THR 107 HB THR 107 6.301 28.975 2.040 755 HG1 THR 107 HG1 THR 107 8.471 29.048 1.332 756 HG21 THR 107 3HG2 THR 107 5.575 27.808 0.244 757 HG22 THR 107 1HG2 THR 107 7.216 28.078 -0.343 758 HG23 THR 107 2HG2 THR 107 5.903 29.128 -0.878 759 H LEU 108 H LEU 108 4.201 31.021 -1.005 760 HA LEU 108 HA LEU 108 1.765 30.210 0.397 761 HB2 LEU 108 1HB LEU 108 2.180 31.461 -2.314 762 HB3 LEU 108 2HB LEU 108 0.610 31.044 -1.629 763 HG LEU 108 HG LEU 108 0.810 33.348 -1.299 764 HD11 LEU 108 1HD1 LEU 108 0.989 33.629 1.117 765 HD12 LEU 108 2HD1 LEU 108 1.760 32.049 1.251 766 HD13 LEU 108 3HD1 LEU 108 0.085 32.170 0.710 767 HD21 LEU 108 3HD2 LEU 108 3.269 33.582 0.172 768 HD22 LEU 108 1HD2 LEU 108 2.752 34.423 -1.290 769 HD23 LEU 108 2HD2 LEU 108 3.563 32.862 -1.412 770 H VAL 109 H VAL 109 0.831 28.294 0.091 771 HA VAL 109 HA VAL 109 1.936 26.532 -1.981 772 HB VAL 109 HB VAL 109 0.339 25.859 0.494 773 HG11 VAL 109 1HG1 VAL 109 -0.194 23.981 -0.585 774 HG12 VAL 109 2HG1 VAL 109 0.918 24.333 -1.909 775 HG13 VAL 109 3HG1 VAL 109 1.507 23.540 -0.448 776 HG21 VAL 109 3HG2 VAL 109 3.039 24.773 0.167 777 HG22 VAL 109 1HG2 VAL 109 2.979 26.529 0.328 778 HG23 VAL 109 2HG2 VAL 109 2.272 25.504 1.577 779 H PHE 110 H PHE 110 0.800 26.440 -3.797 780 HA PHE 110 HA PHE 110 -2.139 26.555 -3.621 781 HB2 PHE 110 1HB PHE 110 -0.258 27.595 -5.733 782 HB3 PHE 110 2HB PHE 110 -1.969 27.335 -6.057 783 HD1 PHE 110 HD1 PHE 110 -3.666 28.691 -4.931 784 HD2 PHE 110 HD2 PHE 110 0.493 29.420 -4.389 785 HE1 PHE 110 HE1 PHE 110 -4.179 30.912 -4.003 786 HE2 PHE 110 HE2 PHE 110 -0.014 31.641 -3.459 787 HZ PHE 110 HZ PHE 110 -2.353 32.389 -3.265 788 H GLU 111 H GLU 111 -3.285 24.912 -4.458 789 HA GLU 111 HA GLU 111 -1.778 22.726 -5.710 790 HB2 GLU 111 1HB GLU 111 -3.051 22.196 -3.659 791 HB3 GLU 111 2HB GLU 111 -4.532 22.697 -4.463 792 HG2 GLU 111 1HG GLU 111 -2.826 20.547 -5.641 793 HG3 GLU 111 2HG GLU 111 -3.944 20.188 -4.327 794 H VAL 112 H VAL 112 -2.018 22.295 -7.799 795 HA VAL 112 HA VAL 112 -4.313 23.483 -9.215 796 HB VAL 112 HB VAL 112 -1.669 22.706 -10.444 797 HG11 VAL 112 1HG1 VAL 112 -2.491 24.288 -12.234 798 HG12 VAL 112 2HG1 VAL 112 -3.369 22.764 -12.091 799 HG13 VAL 112 3HG1 VAL 112 -4.059 24.246 -11.429 800 HG21 VAL 112 3HG2 VAL 112 -1.377 25.260 -10.530 801 HG22 VAL 112 1HG2 VAL 112 -2.583 25.297 -9.243 802 HG23 VAL 112 2HG2 VAL 112 -1.061 24.438 -9.002 803 H GLU 113 H GLU 113 -5.664 22.187 -10.305 804 HA GLU 113 HA GLU 113 -4.841 19.407 -10.801 805 HB2 GLU 113 1HB GLU 113 -6.246 19.230 -8.903 806 HB3 GLU 113 2HB GLU 113 -7.393 20.397 -9.546 807 HG2 GLU 113 1HG GLU 113 -8.456 18.867 -10.809 808 HG3 GLU 113 2HG GLU 113 -6.979 17.975 -11.167 809 H LEU 114 H LEU 114 -4.617 19.445 -12.966 810 HA LEU 114 HA LEU 114 -6.162 20.991 -14.741 811 HB2 LEU 114 1HB LEU 114 -4.245 18.740 -14.989 812 HB3 LEU 114 2HB LEU 114 -5.283 19.083 -16.372 813 HG LEU 114 HG LEU 114 -2.980 20.126 -16.401 814 HD11 LEU 114 1HD1 LEU 114 -5.567 21.471 -16.864 815 HD12 LEU 114 2HD1 LEU 114 -4.252 21.118 -17.983 816 HD13 LEU 114 3HD1 LEU 114 -4.130 22.494 -16.887 817 HD21 LEU 114 3HD2 LEU 114 -2.642 22.142 -15.097 818 HD22 LEU 114 1HD2 LEU 114 -2.922 20.767 -14.028 819 HD23 LEU 114 2HD2 LEU 114 -4.214 21.932 -14.323 820 H LEU 115 H LEU 115 -8.147 20.710 -15.510 821 HA LEU 115 HA LEU 115 -9.443 18.101 -15.106 822 HB2 LEU 115 1HB LEU 115 -10.585 20.874 -15.369 823 HB3 LEU 115 2HB LEU 115 -11.569 19.412 -15.367 824 HG LEU 115 HG LEU 115 -9.846 19.477 -13.057 825 HD11 LEU 115 1HD1 LEU 115 -11.136 21.993 -13.816 826 HD12 LEU 115 2HD1 LEU 115 -9.840 21.681 -12.662 827 HD13 LEU 115 3HD1 LEU 115 -11.520 21.436 -12.187 828 HD21 LEU 115 3HD2 LEU 115 -12.819 19.752 -13.006 829 HD22 LEU 115 1HD2 LEU 115 -11.758 18.806 -11.961 830 HD23 LEU 115 2HD2 LEU 115 -12.087 18.263 -13.607 831 H ASP 116 H ASP 116 -9.408 20.829 -17.401 832 HA ASP 116 HA ASP 116 -9.316 18.991 -19.630 833 HB2 ASP 116 1HB ASP 116 -11.792 19.380 -18.910 834 HB3 ASP 116 2HB ASP 116 -11.582 20.960 -19.659 835 H VAL 117 H VAL 117 -9.163 20.180 -21.730 836 HA VAL 117 HA VAL 117 -7.527 22.571 -21.341 837 HB VAL 117 HB VAL 117 -7.916 20.854 -23.797 838 HG11 VAL 117 1HG1 VAL 117 -7.300 22.852 -24.731 839 HG12 VAL 117 2HG1 VAL 117 -6.406 23.372 -23.301 840 HG13 VAL 117 3HG1 VAL 117 -5.713 22.165 -24.385 841 HG21 VAL 117 3HG2 VAL 117 -5.251 20.867 -22.780 842 HG22 VAL 117 1HG2 VAL 117 -6.360 20.449 -21.474 843 HG23 VAL 117 2HG2 VAL 117 -6.358 19.507 -22.965 844 H11 L2S 130 1H1 L2S 130 -5.028 31.070 -9.755 845 H21 L2S 130 2H1 L2S 130 -4.783 31.807 -11.411 846 H12 L2S 130 1H2 L2S 130 -4.135 33.884 -10.407 847 H22 L2S 130 2H2 L2S 130 -3.050 32.535 -9.814 848 H13 L2S 130 2H3 L2S 130 -4.323 32.449 -7.769 849 H23 L2S 130 1H3 L2S 130 -3.781 34.172 -8.033 850 H14 L2S 130 1H4 L2S 130 -6.999 32.025 -8.342 851 H24 L2S 130 2H4 L2S 130 -7.781 33.533 -9.007 852 H15 L2S 130 1H5 L2S 130 -7.165 31.814 -10.743 853 H25 L2S 130 2H5 L2S 130 -6.433 33.481 -10.933 854 H17 L2S 130 1H7 L2S 130 -7.962 35.412 -8.375 855 H27 L2S 130 2H7 L2S 130 -8.208 34.635 -6.722 856 H9 L2S 130 H9 L2S 130 -8.529 38.788 -4.622 857 H10 L2S 130 H10 L2S 130 -8.345 38.699 -2.135 858 H112 L2S 130 1H12 L2S 130 -6.776 34.630 -2.404 859 H113 L2S 130 1H13 L2S 130 -6.920 34.755 -4.884 860 H114 L2S 130 1H14 L2S 130 -6.847 35.740 -0.438 861 H214 L2S 130 2H14 L2S 130 -8.442 36.517 -0.291 862 H314 L2S 130 3H14 L2S 130 -6.966 37.534 -0.421 Start of MODEL 11 1 H1 GLY 1 H GLY 1 0.208 3.690 -4.039 2 HA2 GLY 1 1HA GLY 1 1.870 1.885 -5.638 3 HA3 GLY 1 2HA GLY 1 1.938 3.601 -6.011 4 HA PRO 2 HA PRO 2 5.145 2.570 -2.783 5 HB2 PRO 2 1HB PRO 2 7.230 3.674 -4.126 6 HB3 PRO 2 2HB PRO 2 6.723 1.996 -4.352 7 HG2 PRO 2 1HG PRO 2 6.117 4.399 -6.031 8 HG3 PRO 2 2HG PRO 2 6.570 2.763 -6.542 9 HD2 PRO 2 1HD PRO 2 4.009 3.641 -6.572 10 HD3 PRO 2 2HD PRO 2 4.434 1.946 -6.258 11 H GLY 3 H GLY 3 6.626 4.148 -1.684 12 HA2 GLY 3 1HA GLY 3 5.400 6.833 -1.737 13 HA3 GLY 3 2HA GLY 3 6.092 6.082 -0.307 14 H SER 4 H SER 4 6.880 7.442 -3.470 15 HA SER 4 HA SER 4 9.135 8.830 -2.480 16 HB2 SER 4 1HB SER 4 10.439 6.909 -2.441 17 HB3 SER 4 2HB SER 4 9.607 6.192 -3.820 18 HG SER 4 HG SER 4 11.085 7.025 -5.039 19 H MET 5 H MET 5 9.193 10.602 -3.678 20 HA MET 5 HA MET 5 8.700 10.384 -6.566 21 HB2 MET 5 1HB MET 5 7.490 12.423 -4.692 22 HB3 MET 5 2HB MET 5 7.437 12.541 -6.446 23 HG2 MET 5 1HG MET 5 6.359 10.149 -5.002 24 HG3 MET 5 2HG MET 5 5.395 11.604 -5.239 25 HE1 MET 5 3HE MET 5 3.686 10.948 -6.261 26 HE2 MET 5 1HE MET 5 3.657 11.277 -7.994 27 HE3 MET 5 2HE MET 5 3.550 9.616 -7.411 28 H THR 6 H THR 6 9.185 12.715 -7.550 29 HA THR 6 HA THR 6 11.804 13.526 -6.466 30 HB THR 6 HB THR 6 10.870 13.578 -9.343 31 HG1 THR 6 HG1 THR 6 12.500 11.957 -9.569 32 HG21 THR 6 3HG2 THR 6 13.111 14.860 -7.949 33 HG22 THR 6 1HG2 THR 6 12.391 15.228 -9.516 34 HG23 THR 6 2HG2 THR 6 13.578 13.931 -9.374 35 H VAL 7 H VAL 7 12.099 15.601 -5.934 36 HA VAL 7 HA VAL 7 10.050 17.547 -6.777 37 HB VAL 7 HB VAL 7 11.605 17.604 -4.189 38 HG11 VAL 7 1HG1 VAL 7 9.704 19.435 -5.515 39 HG12 VAL 7 2HG1 VAL 7 9.493 19.200 -3.779 40 HG13 VAL 7 3HG1 VAL 7 11.034 19.783 -4.411 41 HG21 VAL 7 3HG2 VAL 7 10.169 15.802 -3.888 42 HG22 VAL 7 1HG2 VAL 7 9.237 17.158 -3.253 43 HG23 VAL 7 2HG2 VAL 7 8.892 16.529 -4.864 44 H VAL 8 H VAL 8 10.838 19.005 -8.133 45 HA VAL 8 HA VAL 8 13.661 19.811 -7.855 46 HB VAL 8 HB VAL 8 13.329 18.675 -9.960 47 HG11 VAL 8 1HG1 VAL 8 11.755 19.869 -11.643 48 HG12 VAL 8 2HG1 VAL 8 11.068 18.765 -10.450 49 HG13 VAL 8 3HG1 VAL 8 10.977 20.509 -10.195 50 HG21 VAL 8 3HG2 VAL 8 14.312 20.246 -11.370 51 HG22 VAL 8 1HG2 VAL 8 13.378 21.580 -10.693 52 HG23 VAL 8 2HG2 VAL 8 14.689 20.859 -9.760 53 H THR 9 H THR 9 14.182 21.976 -7.935 54 HA THR 9 HA THR 9 11.910 23.854 -7.904 55 HB THR 9 HB THR 9 14.425 23.970 -6.230 56 HG1 THR 9 HG1 THR 9 11.711 23.371 -5.699 57 HG21 THR 9 3HG2 THR 9 14.048 26.206 -6.534 58 HG22 THR 9 1HG2 THR 9 12.937 25.911 -5.197 59 HG23 THR 9 2HG2 THR 9 12.327 25.986 -6.850 60 H THR 10 H THR 10 12.163 25.817 -8.928 61 HA THR 10 HA THR 10 14.186 25.904 -10.980 62 HB THR 10 HB THR 10 13.052 27.938 -11.753 63 HG1 THR 10 HG1 THR 10 11.853 29.037 -10.408 64 HG21 THR 10 3HG2 THR 10 10.761 26.923 -12.100 65 HG22 THR 10 1HG2 THR 10 11.287 25.592 -11.071 66 HG23 THR 10 2HG2 THR 10 12.124 25.917 -12.589 67 H GLU 11 H GLU 11 15.053 28.289 -11.400 68 HA GLU 11 HA GLU 11 16.762 28.859 -9.148 69 HB2 GLU 11 1HB GLU 11 16.603 29.823 -11.983 70 HB3 GLU 11 2HB GLU 11 17.583 30.694 -10.812 71 HG2 GLU 11 1HG GLU 11 17.880 27.767 -11.443 72 HG3 GLU 11 2HG GLU 11 18.851 29.053 -12.157 73 H SER 12 H SER 12 13.927 30.217 -10.616 74 HA SER 12 HA SER 12 14.155 32.802 -9.407 75 HB2 SER 12 1HB SER 12 11.575 31.583 -10.371 76 HB3 SER 12 2HB SER 12 12.058 33.279 -10.369 77 HG SER 12 HG SER 12 12.693 32.923 -12.331 78 H GLY 13 H GLY 13 12.811 29.725 -8.483 79 HA2 GLY 13 1HA GLY 13 12.734 29.537 -5.962 80 HA3 GLY 13 2HA GLY 13 11.712 30.965 -6.038 81 H LEU 14 H LEU 14 10.389 29.988 -8.506 82 HA LEU 14 HA LEU 14 8.130 28.840 -7.415 83 HB2 LEU 14 1HB LEU 14 7.924 29.786 -9.544 84 HB3 LEU 14 2HB LEU 14 9.253 28.830 -10.194 85 HG LEU 14 HG LEU 14 7.797 26.810 -10.004 86 HD11 LEU 14 1HD1 LEU 14 5.271 28.074 -10.003 87 HD12 LEU 14 2HD1 LEU 14 6.143 28.639 -8.579 88 HD13 LEU 14 3HD1 LEU 14 5.914 26.911 -8.843 89 HD21 LEU 14 3HD2 LEU 14 8.032 27.821 -12.145 90 HD22 LEU 14 1HD2 LEU 14 6.908 29.115 -11.727 91 HD23 LEU 14 2HD2 LEU 14 6.318 27.464 -11.923 92 H LYS 15 H LYS 15 7.434 26.815 -6.979 93 HA LYS 15 HA LYS 15 9.154 24.555 -7.726 94 HB2 LYS 15 1HB LYS 15 7.914 24.764 -4.989 95 HB3 LYS 15 2HB LYS 15 9.154 23.644 -5.541 96 HG2 LYS 15 1HG LYS 15 10.584 25.765 -5.894 97 HG3 LYS 15 2HG LYS 15 9.405 26.537 -4.830 98 HD2 LYS 15 1HD LYS 15 10.687 23.954 -4.030 99 HD3 LYS 15 2HD LYS 15 11.556 25.476 -3.818 100 HE2 LYS 15 1HE LYS 15 9.471 26.307 -2.614 101 HE3 LYS 15 2HE LYS 15 8.947 24.624 -2.588 102 HZ1 LYS 15 3HZ LYS 15 10.326 24.173 -0.923 103 HZ2 LYS 15 1HZ LYS 15 10.553 25.840 -0.748 104 HZ3 LYS 15 2HZ LYS 15 11.637 24.933 -1.676 105 H TYR 16 H TYR 16 8.045 22.441 -7.455 106 HA TYR 16 HA TYR 16 5.156 22.478 -7.327 107 HB2 TYR 16 1HB TYR 16 5.032 21.284 -9.597 108 HB3 TYR 16 2HB TYR 16 5.262 23.029 -9.611 109 HD1 TYR 16 HD2 TYR 16 7.423 23.993 -10.250 110 HD2 TYR 16 HD1 TYR 16 6.763 19.792 -10.364 111 HE1 TYR 16 HE2 TYR 16 9.433 23.721 -11.641 112 HE2 TYR 16 HE1 TYR 16 8.772 19.508 -11.754 113 HH TYR 16 HH TYR 16 10.215 21.876 -13.405 114 H GLU 17 H GLU 17 4.260 20.458 -6.944 115 HA GLU 17 HA GLU 17 6.164 18.227 -6.688 116 HB2 GLU 17 1HB GLU 17 5.456 19.382 -4.501 117 HB3 GLU 17 2HB GLU 17 3.880 18.653 -4.776 118 HG2 GLU 17 1HG GLU 17 4.676 16.501 -4.470 119 HG3 GLU 17 2HG GLU 17 6.346 16.967 -4.790 120 H ASP 18 H ASP 18 5.600 16.586 -7.937 121 HA ASP 18 HA ASP 18 3.118 16.423 -9.277 122 HB2 ASP 18 1HB ASP 18 5.624 15.136 -9.426 123 HB3 ASP 18 2HB ASP 18 4.432 13.864 -9.170 124 H LEU 19 H LEU 19 1.229 15.864 -8.443 125 HA LEU 19 HA LEU 19 1.164 14.132 -6.078 126 HB2 LEU 19 1HB LEU 19 -0.483 16.332 -7.092 127 HB3 LEU 19 2HB LEU 19 -1.407 14.971 -6.462 128 HG LEU 19 HG LEU 19 -0.111 15.188 -4.330 129 HD11 LEU 19 1HD1 LEU 19 1.837 16.323 -4.816 130 HD12 LEU 19 2HD1 LEU 19 0.853 17.587 -4.079 131 HD13 LEU 19 3HD1 LEU 19 1.018 17.509 -5.833 132 HD21 LEU 19 3HD2 LEU 19 -1.970 17.263 -5.386 133 HD22 LEU 19 1HD2 LEU 19 -1.247 17.491 -3.793 134 HD23 LEU 19 2HD2 LEU 19 -2.222 16.058 -4.122 135 H THR 20 H THR 20 -0.070 14.429 -9.359 136 HA THR 20 HA THR 20 -0.458 11.587 -9.531 137 HB THR 20 HB THR 20 -2.881 13.388 -9.717 138 HG1 THR 20 HG1 THR 20 -3.523 12.402 -7.871 139 HG21 THR 20 3HG2 THR 20 -3.937 10.972 -9.921 140 HG22 THR 20 1HG2 THR 20 -2.357 10.593 -10.605 141 HG23 THR 20 2HG2 THR 20 -3.360 11.842 -11.343 142 H GLU 21 H GLU 21 0.410 11.153 -11.443 143 HA GLU 21 HA GLU 21 0.903 12.983 -13.475 144 HB2 GLU 21 1HB GLU 21 1.884 10.627 -13.100 145 HB3 GLU 21 2HB GLU 21 0.496 10.052 -14.012 146 HG2 GLU 21 1HG GLU 21 1.167 11.299 -15.942 147 HG3 GLU 21 2HG GLU 21 2.460 12.085 -15.038 148 H GLY 22 H GLY 22 -0.003 13.174 -15.608 149 HA2 GLY 22 1HA GLY 22 -2.864 12.443 -15.730 150 HA3 GLY 22 2HA GLY 22 -2.293 14.036 -16.203 151 H SER 23 H SER 23 -3.013 10.923 -17.256 152 HA SER 23 HA SER 23 -1.312 11.034 -19.612 153 HB2 SER 23 1HB SER 23 -1.827 8.890 -18.342 154 HB3 SER 23 2HB SER 23 -3.455 8.991 -19.011 155 HG SER 23 HG SER 23 -2.080 7.696 -20.301 156 H GLY 24 H GLY 24 -2.605 13.188 -19.971 157 HA2 GLY 24 1HA GLY 24 -4.825 12.526 -21.805 158 HA3 GLY 24 2HA GLY 24 -4.899 13.917 -20.733 159 H ALA 25 H ALA 25 -3.285 15.618 -21.051 160 HA ALA 25 HA ALA 25 -1.627 15.734 -23.327 161 HB1 ALA 25 1HB ALA 25 -4.274 17.149 -23.626 162 HB2 ALA 25 2HB ALA 25 -2.896 17.296 -24.718 163 HB3 ALA 25 3HB ALA 25 -3.731 15.751 -24.555 164 H GLU 26 H GLU 26 -0.162 17.287 -22.993 165 HA GLU 26 HA GLU 26 -0.136 18.849 -20.687 166 HB2 GLU 26 1HB GLU 26 1.911 18.310 -21.855 167 HB3 GLU 26 2HB GLU 26 1.379 19.195 -23.278 168 HG2 GLU 26 1HG GLU 26 1.409 21.276 -21.943 169 HG3 GLU 26 2HG GLU 26 2.063 20.357 -20.588 170 H ALA 27 H ALA 27 -0.746 20.896 -20.197 171 HA ALA 27 HA ALA 27 -2.865 22.108 -21.487 172 HB1 ALA 27 1HB ALA 27 -1.055 23.953 -20.079 173 HB2 ALA 27 2HB ALA 27 -2.775 23.641 -19.840 174 HB3 ALA 27 3HB ALA 27 -1.576 22.543 -19.156 175 H ARG 28 H ARG 28 -3.079 23.285 -23.275 176 HA ARG 28 HA ARG 28 -0.702 24.031 -24.769 177 HB2 ARG 28 1HB ARG 28 -3.644 24.012 -25.419 178 HB3 ARG 28 2HB ARG 28 -2.454 24.727 -26.498 179 HG2 ARG 28 1HG ARG 28 -2.088 21.922 -25.551 180 HG3 ARG 28 2HG ARG 28 -3.231 22.273 -26.849 181 HD2 ARG 28 1HD ARG 28 -0.520 23.458 -27.050 182 HD3 ARG 28 2HD ARG 28 -0.667 21.720 -27.306 183 HE ARG 28 HE ARG 28 -2.625 22.972 -28.843 184 HH11 ARG 28 1HH1 ARG 28 0.847 22.783 -28.667 185 HH12 ARG 28 2HH1 ARG 28 1.078 23.046 -30.364 186 HH21 ARG 28 1HH2 ARG 28 -2.334 23.319 -31.078 187 HH22 ARG 28 2HH2 ARG 28 -0.733 23.352 -31.735 188 H ALA 29 H ALA 29 -0.463 26.164 -25.713 189 HA ALA 29 HA ALA 29 -1.273 28.245 -23.823 190 HB1 ALA 29 1HB ALA 29 0.433 29.444 -25.608 191 HB2 ALA 29 2HB ALA 29 0.892 28.740 -24.056 192 HB3 ALA 29 3HB ALA 29 1.041 27.790 -25.534 193 H GLY 30 H GLY 30 -2.219 30.202 -24.490 194 HA2 GLY 30 1HA GLY 30 -3.415 31.628 -25.869 195 HA3 GLY 30 2HA GLY 30 -2.990 30.608 -27.235 196 H GLN 31 H GLN 31 -4.200 28.591 -24.944 197 HA GLN 31 HA GLN 31 -6.932 28.819 -26.022 198 HB2 GLN 31 1HB GLN 31 -5.570 26.813 -26.763 199 HB3 GLN 31 2HB GLN 31 -5.624 26.265 -25.093 200 HG2 GLN 31 1HG GLN 31 -7.880 25.814 -25.170 201 HG3 GLN 31 2HG GLN 31 -8.162 26.920 -26.513 202 HE21 GLN 31 2HE2 GLN 31 -5.901 24.231 -26.030 203 HE22 GLN 31 1HE2 GLN 31 -6.382 23.348 -27.435 204 H THR 32 H THR 32 -8.668 28.227 -24.628 205 HA THR 32 HA THR 32 -8.131 28.901 -21.851 206 HB THR 32 HB THR 32 -10.844 28.298 -23.010 207 HG1 THR 32 HG1 THR 32 -10.940 30.331 -23.801 208 HG21 THR 32 3HG2 THR 32 -11.025 30.398 -21.234 209 HG22 THR 32 1HG2 THR 32 -9.790 29.368 -20.510 210 HG23 THR 32 2HG2 THR 32 -11.385 28.709 -20.874 211 H VAL 33 H VAL 33 -7.565 27.305 -20.526 212 HA VAL 33 HA VAL 33 -8.808 24.660 -20.881 213 HB VAL 33 HB VAL 33 -6.941 23.710 -19.677 214 HG11 VAL 33 1HG1 VAL 33 -6.802 24.835 -22.195 215 HG12 VAL 33 2HG1 VAL 33 -5.313 25.371 -21.415 216 HG13 VAL 33 3HG1 VAL 33 -5.685 23.650 -21.519 217 HG21 VAL 33 3HG2 VAL 33 -5.071 25.779 -19.477 218 HG22 VAL 33 1HG2 VAL 33 -6.569 26.428 -18.809 219 HG23 VAL 33 2HG2 VAL 33 -5.883 24.940 -18.155 220 H SER 34 H SER 34 -9.709 23.585 -19.130 221 HA SER 34 HA SER 34 -10.458 25.326 -16.894 222 HB2 SER 34 1HB SER 34 -11.935 23.557 -18.486 223 HB3 SER 34 2HB SER 34 -11.791 22.753 -16.923 224 HG SER 34 HG SER 34 -12.454 25.467 -16.956 225 H VAL 35 H VAL 35 -9.531 25.079 -14.980 226 HA VAL 35 HA VAL 35 -8.669 22.427 -14.109 227 HB VAL 35 HB VAL 35 -6.469 23.039 -13.546 228 HG11 VAL 35 1HG1 VAL 35 -6.974 24.364 -16.206 229 HG12 VAL 35 2HG1 VAL 35 -5.464 23.645 -15.645 230 HG13 VAL 35 3HG1 VAL 35 -6.865 22.621 -15.961 231 HG21 VAL 35 3HG2 VAL 35 -7.395 25.855 -13.998 232 HG22 VAL 35 1HG2 VAL 35 -6.648 25.148 -12.566 233 HG23 VAL 35 2HG2 VAL 35 -5.681 25.442 -14.011 234 H HIS 36 H HIS 36 -8.048 22.427 -11.776 235 HA HIS 36 HA HIS 36 -9.735 24.337 -10.305 236 HB2 HIS 36 1HB HIS 36 -9.210 21.445 -10.025 237 HB3 HIS 36 2HB HIS 36 -9.272 22.347 -8.514 238 HD1 HIS 36 HD1 HIS 36 -11.540 24.339 -9.346 239 HD2 HIS 36 HD2 HIS 36 -11.657 20.218 -9.854 240 HE1 HIS 36 HE1 HIS 36 -13.981 23.746 -9.470 241 H TYR 37 H TYR 37 -8.863 25.639 -8.810 242 HA TYR 37 HA TYR 37 -6.028 25.219 -8.122 243 HB2 TYR 37 1HB TYR 37 -5.783 27.629 -7.954 244 HB3 TYR 37 2HB TYR 37 -6.427 27.211 -9.538 245 HD1 TYR 37 HD1 TYR 37 -7.356 28.523 -6.199 246 HD2 TYR 37 HD2 TYR 37 -8.498 28.074 -10.273 247 HE1 TYR 37 HE1 TYR 37 -9.231 30.072 -5.837 248 HE2 TYR 37 HE2 TYR 37 -10.376 29.623 -9.923 249 HH TYR 37 HH TYR 37 -10.629 31.697 -7.528 250 H THR 38 H THR 38 -5.382 25.485 -6.008 251 HA THR 38 HA THR 38 -7.447 26.111 -4.018 252 HB THR 38 HB THR 38 -5.652 23.998 -3.111 253 HG1 THR 38 HG1 THR 38 -6.112 23.544 -5.469 254 HG21 THR 38 3HG2 THR 38 -8.204 24.989 -2.547 255 HG22 THR 38 1HG2 THR 38 -7.403 23.618 -1.782 256 HG23 THR 38 2HG2 THR 38 -8.467 23.359 -3.165 257 H GLY 39 H GLY 39 -6.698 27.806 -2.927 258 HA2 GLY 39 1HA GLY 39 -3.827 28.217 -2.646 259 HA3 GLY 39 2HA GLY 39 -5.091 29.361 -2.220 260 H TRP 40 H TRP 40 -2.759 27.387 -0.987 261 HA TRP 40 HA TRP 40 -4.150 27.182 1.604 262 HB2 TRP 40 1HB TRP 40 -2.190 25.327 0.277 263 HB3 TRP 40 2HB TRP 40 -2.391 25.327 2.027 264 HD1 TRP 40 HD1 TRP 40 -5.469 25.490 2.351 265 HE1 TRP 40 HE1 TRP 40 -6.992 23.568 1.568 266 HE3 TRP 40 HE3 TRP 40 -2.322 23.282 -1.020 267 HZ2 TRP 40 HZ2 TRP 40 -6.875 21.403 -0.240 268 HZ3 TRP 40 HZ3 TRP 40 -3.104 21.289 -2.233 269 HH2 TRP 40 HH2 TRP 40 -5.334 20.371 -1.850 270 H LEU 41 H LEU 41 -3.192 28.060 3.357 271 HA LEU 41 HA LEU 41 -1.006 29.855 2.962 272 HB2 LEU 41 1HB LEU 41 -2.808 29.115 5.192 273 HB3 LEU 41 2HB LEU 41 -1.256 29.831 5.623 274 HG LEU 41 HG LEU 41 -3.056 31.184 3.647 275 HD11 LEU 41 1HD1 LEU 41 -4.519 30.836 5.491 276 HD12 LEU 41 2HD1 LEU 41 -3.942 32.499 5.585 277 HD13 LEU 41 3HD1 LEU 41 -3.262 31.269 6.650 278 HD21 LEU 41 3HD2 LEU 41 -1.141 32.324 5.671 279 HD22 LEU 41 1HD2 LEU 41 -1.875 33.139 4.290 280 HD23 LEU 41 2HD2 LEU 41 -0.668 31.879 4.030 281 H THR 42 H THR 42 0.819 29.862 4.658 282 HA THR 42 HA THR 42 2.515 27.720 4.194 283 HB THR 42 HB THR 42 3.927 28.592 6.004 284 HG1 THR 42 HG1 THR 42 3.138 30.340 7.261 285 HG21 THR 42 3HG2 THR 42 2.663 30.511 4.081 286 HG22 THR 42 1HG2 THR 42 4.272 29.791 4.041 287 HG23 THR 42 2HG2 THR 42 3.903 31.062 5.207 288 H ASP 43 H ASP 43 0.223 28.239 6.804 289 HA ASP 43 HA ASP 43 1.111 25.893 8.253 290 HB2 ASP 43 1HB ASP 43 -0.902 28.048 8.706 291 HB3 ASP 43 2HB ASP 43 -1.124 26.516 9.546 292 H GLY 44 H GLY 44 -1.090 26.627 5.749 293 HA2 GLY 44 1HA GLY 44 -1.914 24.648 4.526 294 HA3 GLY 44 2HA GLY 44 -2.351 23.976 6.090 295 H GLN 45 H GLN 45 -3.186 26.881 6.780 296 HA GLN 45 HA GLN 45 -5.932 26.539 6.476 297 HB2 GLN 45 1HB GLN 45 -4.174 28.853 7.153 298 HB3 GLN 45 2HB GLN 45 -5.867 29.168 6.794 299 HG2 GLN 45 1HG GLN 45 -5.302 28.865 9.217 300 HG3 GLN 45 2HG GLN 45 -6.599 27.843 8.601 301 HE21 GLN 45 2HE2 GLN 45 -6.521 25.897 9.439 302 HE22 GLN 45 1HE2 GLN 45 -5.094 24.988 9.786 303 H LYS 46 H LYS 46 -7.048 26.457 4.650 304 HA LYS 46 HA LYS 46 -6.102 27.620 2.211 305 HB2 LYS 46 1HB LYS 46 -7.538 25.488 2.548 306 HB3 LYS 46 2HB LYS 46 -8.898 26.601 2.631 307 HG2 LYS 46 1HG LYS 46 -7.994 27.510 0.391 308 HG3 LYS 46 2HG LYS 46 -7.099 25.990 0.323 309 HD2 LYS 46 1HD LYS 46 -10.091 26.269 0.611 310 HD3 LYS 46 2HD LYS 46 -9.232 25.825 -0.865 311 HE2 LYS 46 1HE LYS 46 -8.385 23.815 0.220 312 HE3 LYS 46 2HE LYS 46 -9.191 24.269 1.720 313 HZ1 LYS 46 3HZ LYS 46 -10.259 22.652 -0.109 314 HZ2 LYS 46 1HZ LYS 46 -10.896 24.134 -0.620 315 HZ3 LYS 46 2HZ LYS 46 -11.176 23.592 0.957 316 H PHE 47 H PHE 47 -6.834 29.402 1.124 317 HA PHE 47 HA PHE 47 -8.710 31.139 2.590 318 HB2 PHE 47 1HB PHE 47 -7.419 32.977 1.218 319 HB3 PHE 47 2HB PHE 47 -6.747 32.350 2.720 320 HD1 PHE 47 HD2 PHE 47 -6.437 32.419 -0.918 321 HD2 PHE 47 HD1 PHE 47 -4.809 30.908 2.713 322 HE1 PHE 47 HE2 PHE 47 -4.385 31.773 -2.111 323 HE2 PHE 47 HE1 PHE 47 -2.753 30.261 1.525 324 HZ PHE 47 HZ PHE 47 -2.540 30.692 -0.890 325 H ASP 48 H ASP 48 -7.827 29.715 -0.441 326 HA ASP 48 HA ASP 48 -10.333 30.687 -1.596 327 HB2 ASP 48 1HB ASP 48 -9.355 31.421 -3.620 328 HB3 ASP 48 2HB ASP 48 -8.358 32.120 -2.347 329 H SER 49 H SER 49 -11.359 29.237 -2.904 330 HA SER 49 HA SER 49 -9.980 26.885 -3.878 331 HB2 SER 49 1HB SER 49 -10.790 25.344 -2.441 332 HB3 SER 49 2HB SER 49 -11.096 26.709 -1.367 333 HG SER 49 HG SER 49 -12.860 25.066 -2.487 334 H SER 50 H SER 50 -10.714 26.507 -5.852 335 HA SER 50 HA SER 50 -12.995 27.839 -6.899 336 HB2 SER 50 1HB SER 50 -11.354 27.462 -8.508 337 HB3 SER 50 2HB SER 50 -11.055 25.812 -7.963 338 HG SER 50 HG SER 50 -13.228 26.797 -9.481 339 H LYS 51 H LYS 51 -12.472 24.738 -5.453 340 HA LYS 51 HA LYS 51 -14.692 23.356 -6.503 341 HB2 LYS 51 1HB LYS 51 -13.360 23.008 -3.810 342 HB3 LYS 51 2HB LYS 51 -14.414 21.840 -4.596 343 HG2 LYS 51 1HG LYS 51 -11.988 22.763 -6.046 344 HG3 LYS 51 2HG LYS 51 -11.801 21.622 -4.712 345 HD2 LYS 51 1HD LYS 51 -13.746 21.174 -6.964 346 HD3 LYS 51 2HD LYS 51 -12.069 20.627 -7.036 347 HE2 LYS 51 1HE LYS 51 -14.113 19.849 -4.957 348 HE3 LYS 51 2HE LYS 51 -13.539 18.837 -6.282 349 HZ1 LYS 51 3HZ LYS 51 -11.240 19.262 -5.238 350 HZ2 LYS 51 1HZ LYS 51 -12.270 18.136 -4.508 351 HZ3 LYS 51 2HZ LYS 51 -12.110 19.686 -3.851 352 H ASP 52 H ASP 52 -14.385 25.747 -4.005 353 HA ASP 52 HA ASP 52 -16.668 25.296 -2.496 354 HB2 ASP 52 1HB ASP 52 -15.175 26.955 -1.721 355 HB3 ASP 52 2HB ASP 52 -15.226 27.831 -3.249 356 H ARG 53 H ARG 53 -16.320 27.194 -5.481 357 HA ARG 53 HA ARG 53 -19.112 27.828 -5.610 358 HB2 ARG 53 1HB ARG 53 -16.975 29.006 -6.677 359 HB3 ARG 53 2HB ARG 53 -17.389 27.969 -8.035 360 HG2 ARG 53 1HG ARG 53 -18.512 29.924 -8.523 361 HG3 ARG 53 2HG ARG 53 -19.763 28.945 -7.755 362 HD2 ARG 53 1HD ARG 53 -18.112 30.700 -6.020 363 HD3 ARG 53 2HD ARG 53 -19.312 31.467 -7.060 364 HE ARG 53 HE ARG 53 -20.523 29.332 -5.707 365 HH11 ARG 53 1HH1 ARG 53 -19.177 32.478 -5.067 366 HH12 ARG 53 2HH1 ARG 53 -20.195 32.779 -3.698 367 HH21 ARG 53 1HH2 ARG 53 -21.870 29.717 -3.906 368 HH22 ARG 53 2HH2 ARG 53 -21.725 31.208 -3.038 369 H ASN 54 H ASN 54 -17.352 25.057 -6.271 370 HA ASN 54 HA ASN 54 -17.873 23.067 -7.241 371 HB2 ASN 54 1HB ASN 54 -20.122 23.678 -6.094 372 HB3 ASN 54 2HB ASN 54 -20.675 24.042 -7.726 373 HD21 ASN 54 2HD2 ASN 54 -21.954 22.438 -8.308 374 HD22 ASN 54 1HD2 ASN 54 -21.584 20.755 -8.184 375 H ASP 55 H ASP 55 -16.627 24.816 -8.877 376 HA ASP 55 HA ASP 55 -17.494 23.931 -11.467 377 HB2 ASP 55 1HB ASP 55 -18.947 25.814 -11.397 378 HB3 ASP 55 2HB ASP 55 -17.693 26.846 -10.715 379 HA PRO 56 HA PRO 56 -13.128 24.107 -12.030 380 HB2 PRO 56 1HB PRO 56 -13.057 23.837 -14.731 381 HB3 PRO 56 2HB PRO 56 -13.429 22.496 -13.641 382 HG2 PRO 56 1HG PRO 56 -15.294 24.231 -15.214 383 HG3 PRO 56 2HG PRO 56 -15.334 22.475 -14.975 384 HD2 PRO 56 1HD PRO 56 -16.920 24.171 -13.583 385 HD3 PRO 56 2HD PRO 56 -16.309 22.654 -12.894 386 H PHE 57 H PHE 57 -11.584 25.614 -12.445 387 HA PHE 57 HA PHE 57 -12.487 28.236 -13.290 388 HB2 PHE 57 1HB PHE 57 -11.075 28.209 -11.359 389 HB3 PHE 57 2HB PHE 57 -9.868 27.224 -12.180 390 HD1 PHE 57 HD1 PHE 57 -11.655 30.312 -13.248 391 HD2 PHE 57 HD2 PHE 57 -7.935 28.469 -12.310 392 HE1 PHE 57 HE1 PHE 57 -10.472 32.353 -13.946 393 HE2 PHE 57 HE2 PHE 57 -6.746 30.507 -13.005 394 HZ PHE 57 HZ PHE 57 -8.014 32.453 -13.823 395 H ALA 58 H ALA 58 -12.701 28.420 -15.445 396 HA ALA 58 HA ALA 58 -10.687 27.276 -17.217 397 HB1 ALA 58 1HB ALA 58 -12.199 27.532 -18.954 398 HB2 ALA 58 2HB ALA 58 -13.247 27.194 -17.575 399 HB3 ALA 58 3HB ALA 58 -13.054 28.850 -18.152 400 H PHE 59 H PHE 59 -9.028 28.414 -17.959 401 HA PHE 59 HA PHE 59 -9.307 31.268 -18.456 402 HB2 PHE 59 1HB PHE 59 -7.466 31.946 -17.114 403 HB3 PHE 59 2HB PHE 59 -8.479 30.948 -16.077 404 HD1 PHE 59 HD1 PHE 59 -7.804 28.580 -15.630 405 HD2 PHE 59 HD2 PHE 59 -5.233 31.370 -17.558 406 HE1 PHE 59 HE1 PHE 59 -5.871 27.146 -15.118 407 HE2 PHE 59 HE2 PHE 59 -3.296 29.941 -17.051 408 HZ PHE 59 HZ PHE 59 -3.613 27.825 -15.830 409 H VAL 60 H VAL 60 -7.613 32.137 -19.790 410 HA VAL 60 HA VAL 60 -6.643 30.203 -21.696 411 HB VAL 60 HB VAL 60 -6.223 33.194 -21.621 412 HG11 VAL 60 1HG1 VAL 60 -5.297 31.075 -23.410 413 HG12 VAL 60 2HG1 VAL 60 -6.098 32.412 -24.237 414 HG13 VAL 60 3HG1 VAL 60 -4.705 32.723 -23.200 415 HG21 VAL 60 3HG2 VAL 60 -8.057 33.354 -23.175 416 HG22 VAL 60 1HG2 VAL 60 -8.235 31.600 -23.203 417 HG23 VAL 60 2HG2 VAL 60 -8.604 32.501 -21.732 418 H LEU 61 H LEU 61 -4.725 29.250 -21.637 419 HA LEU 61 HA LEU 61 -2.769 29.960 -19.669 420 HB2 LEU 61 1HB LEU 61 -2.897 27.678 -20.065 421 HB3 LEU 61 2HB LEU 61 -2.968 27.886 -21.813 422 HG LEU 61 HG LEU 61 -0.627 28.302 -21.939 423 HD11 LEU 61 1HD1 LEU 61 0.454 27.931 -19.434 424 HD12 LEU 61 2HD1 LEU 61 -0.944 28.961 -19.127 425 HD13 LEU 61 3HD1 LEU 61 0.290 29.470 -20.279 426 HD21 LEU 61 3HD2 LEU 61 -1.598 25.939 -20.475 427 HD22 LEU 61 1HD2 LEU 61 0.142 26.222 -20.401 428 HD23 LEU 61 2HD2 LEU 61 -0.658 26.049 -21.964 429 H GLY 62 H GLY 62 -1.150 31.359 -19.868 430 HA2 GLY 62 1HA GLY 62 0.635 31.671 -21.898 431 HA3 GLY 62 2HA GLY 62 -0.700 32.710 -22.371 432 H GLY 63 H GLY 63 -1.524 33.884 -20.116 433 HA2 GLY 63 1HA GLY 63 -0.165 34.787 -18.084 434 HA3 GLY 63 2HA GLY 63 0.831 35.467 -19.362 435 H GLY 64 H GLY 64 -0.531 36.963 -17.361 436 HA2 GLY 64 1HA GLY 64 -1.336 39.221 -18.160 437 HA3 GLY 64 2HA GLY 64 -2.605 38.316 -18.972 438 H MET 65 H MET 65 -3.565 36.597 -17.222 439 HA MET 65 HA MET 65 -4.494 38.303 -15.014 440 HB2 MET 65 1HB MET 65 -5.798 36.272 -16.731 441 HB3 MET 65 2HB MET 65 -6.284 36.285 -15.041 442 HG2 MET 65 1HG MET 65 -6.998 38.554 -15.188 443 HG3 MET 65 2HG MET 65 -6.312 38.720 -16.802 444 HE1 MET 65 3HE MET 65 -8.766 37.029 -19.130 445 HE2 MET 65 1HE MET 65 -7.635 38.368 -18.934 446 HE3 MET 65 2HE MET 65 -7.091 36.711 -18.677 447 H VAL 66 H VAL 66 -2.862 35.366 -15.787 448 HA VAL 66 HA VAL 66 -3.097 34.356 -13.053 449 HB VAL 66 HB VAL 66 -2.080 32.329 -13.831 450 HG11 VAL 66 1HG1 VAL 66 -3.671 32.450 -16.186 451 HG12 VAL 66 2HG1 VAL 66 -4.055 31.708 -14.631 452 HG13 VAL 66 3HG1 VAL 66 -4.463 33.398 -14.928 453 HG21 VAL 66 3HG2 VAL 66 -1.570 33.813 -16.407 454 HG22 VAL 66 1HG2 VAL 66 -0.363 33.220 -15.265 455 HG23 VAL 66 2HG2 VAL 66 -1.341 32.078 -16.186 456 H ILE 67 H ILE 67 -0.876 33.230 -12.371 457 HA ILE 67 HA ILE 67 1.116 35.391 -12.401 458 HB ILE 67 HB ILE 67 1.930 34.610 -10.321 459 HG12 ILE 67 1HG1 ILE 67 0.182 32.176 -10.738 460 HG13 ILE 67 2HG1 ILE 67 1.941 32.219 -10.769 461 HG21 ILE 67 1HG2 ILE 67 -0.796 34.070 -9.525 462 HG22 ILE 67 2HG2 ILE 67 0.230 35.457 -9.163 463 HG23 ILE 67 3HG2 ILE 67 -0.705 35.419 -10.657 464 HD11 ILE 67 3HD1 ILE 67 1.235 31.309 -8.684 465 HD12 ILE 67 1HD1 ILE 67 1.901 32.914 -8.387 466 HD13 ILE 67 2HD1 ILE 67 0.154 32.672 -8.396 467 H LYS 68 H LYS 68 3.421 34.652 -12.192 468 HA LYS 68 HA LYS 68 4.258 33.256 -14.405 469 HB2 LYS 68 1HB LYS 68 5.576 33.829 -11.770 470 HB3 LYS 68 2HB LYS 68 6.407 32.870 -12.988 471 HG2 LYS 68 1HG LYS 68 6.249 34.704 -14.572 472 HG3 LYS 68 2HG LYS 68 5.361 35.666 -13.387 473 HD2 LYS 68 1HD LYS 68 7.553 36.447 -13.207 474 HD3 LYS 68 2HD LYS 68 7.404 35.306 -11.868 475 HE2 LYS 68 1HE LYS 68 8.410 34.351 -14.512 476 HE3 LYS 68 2HE LYS 68 9.493 35.244 -13.445 477 HZ1 LYS 68 3HZ LYS 68 8.447 32.559 -13.187 478 HZ2 LYS 68 1HZ LYS 68 8.432 33.463 -11.757 479 HZ3 LYS 68 2HZ LYS 68 9.883 33.225 -12.591 480 H GLY 69 H GLY 69 4.149 31.982 -11.070 481 HA2 GLY 69 1HA GLY 69 4.898 29.368 -11.636 482 HA3 GLY 69 2HA GLY 69 3.876 29.841 -10.286 483 H TRP 70 H TRP 70 1.877 30.955 -12.245 484 HA TRP 70 HA TRP 70 0.307 28.578 -12.474 485 HB2 TRP 70 1HB TRP 70 -0.158 31.381 -12.527 486 HB3 TRP 70 2HB TRP 70 -0.803 30.710 -14.023 487 HD1 TRP 70 HD1 TRP 70 -3.170 29.741 -13.866 488 HE1 TRP 70 HE1 TRP 70 -4.743 29.027 -11.958 489 HE3 TRP 70 HE3 TRP 70 0.034 30.300 -9.922 490 HZ2 TRP 70 HZ2 TRP 70 -4.639 28.739 -9.152 491 HZ3 TRP 70 HZ3 TRP 70 -0.781 29.785 -7.658 492 HH2 TRP 70 HH2 TRP 70 -3.069 29.021 -7.283 493 H ASP 71 H ASP 71 1.465 30.895 -14.930 494 HA ASP 71 HA ASP 71 0.751 29.443 -17.179 495 HB2 ASP 71 1HB ASP 71 1.432 31.651 -17.571 496 HB3 ASP 71 2HB ASP 71 2.928 31.449 -16.663 497 H GLU 72 H GLU 72 3.813 29.369 -15.378 498 HA GLU 72 HA GLU 72 5.059 27.443 -17.037 499 HB2 GLU 72 1HB GLU 72 5.787 29.007 -14.823 500 HB3 GLU 72 2HB GLU 72 6.007 27.340 -14.310 501 HG2 GLU 72 1HG GLU 72 7.211 28.605 -16.761 502 HG3 GLU 72 2HG GLU 72 8.051 28.260 -15.250 503 H GLY 73 H GLY 73 3.266 27.190 -13.985 504 HA2 GLY 73 1HA GLY 73 3.637 24.470 -13.499 505 HA3 GLY 73 2HA GLY 73 2.239 25.401 -12.981 506 H VAL 74 H VAL 74 0.831 25.985 -15.103 507 HA VAL 74 HA VAL 74 -0.353 23.545 -15.873 508 HB VAL 74 HB VAL 74 -1.737 24.888 -17.399 509 HG11 VAL 74 1HG1 VAL 74 -1.503 26.507 -14.899 510 HG12 VAL 74 2HG1 VAL 74 -2.948 25.941 -15.741 511 HG13 VAL 74 3HG1 VAL 74 -1.971 24.809 -14.804 512 HG21 VAL 74 3HG2 VAL 74 -1.260 27.477 -17.081 513 HG22 VAL 74 1HG2 VAL 74 0.393 26.893 -16.885 514 HG23 VAL 74 2HG2 VAL 74 -0.496 26.541 -18.367 515 H GLN 75 H GLN 75 1.977 25.656 -17.439 516 HA GLN 75 HA GLN 75 1.889 24.697 -20.035 517 HB2 GLN 75 1HB GLN 75 3.882 26.063 -18.353 518 HB3 GLN 75 2HB GLN 75 4.555 25.155 -19.700 519 HG2 GLN 75 1HG GLN 75 3.054 26.379 -21.229 520 HG3 GLN 75 2HG GLN 75 2.489 27.336 -19.861 521 HE21 GLN 75 2HE2 GLN 75 4.319 28.371 -18.583 522 HE22 GLN 75 1HE2 GLN 75 5.568 29.118 -19.514 523 H GLY 76 H GLY 76 3.083 23.175 -17.165 524 HA2 GLY 76 1HA GLY 76 4.358 21.055 -18.762 525 HA3 GLY 76 2HA GLY 76 4.634 21.345 -17.051 526 H MET 77 H MET 77 1.885 21.601 -16.304 527 HA MET 77 HA MET 77 1.267 18.887 -15.843 528 HB2 MET 77 1HB MET 77 0.605 20.887 -14.423 529 HB3 MET 77 2HB MET 77 -0.665 21.190 -15.600 530 HG2 MET 77 1HG MET 77 -1.777 19.991 -13.989 531 HG3 MET 77 2HG MET 77 -1.336 18.735 -15.143 532 HE1 MET 77 3HE MET 77 1.538 17.440 -14.444 533 HE2 MET 77 1HE MET 77 0.687 16.316 -13.382 534 HE3 MET 77 2HE MET 77 -0.097 16.912 -14.846 535 H LYS 78 H LYS 78 -0.412 17.596 -16.634 536 HA LYS 78 HA LYS 78 -1.465 18.437 -19.254 537 HB2 LYS 78 1HB LYS 78 -0.925 15.630 -18.265 538 HB3 LYS 78 2HB LYS 78 -1.530 16.064 -19.859 539 HG2 LYS 78 1HG LYS 78 0.504 16.662 -20.617 540 HG3 LYS 78 2HG LYS 78 1.007 17.332 -19.063 541 HD2 LYS 78 1HD LYS 78 0.638 14.406 -19.148 542 HD3 LYS 78 2HD LYS 78 1.983 15.040 -20.098 543 HE2 LYS 78 1HE LYS 78 2.573 16.362 -17.965 544 HE3 LYS 78 2HE LYS 78 1.502 15.228 -17.144 545 HZ1 LYS 78 3HZ LYS 78 4.167 14.840 -18.087 546 HZ2 LYS 78 1HZ LYS 78 3.119 13.654 -18.685 547 HZ3 LYS 78 2HZ LYS 78 3.258 13.897 -17.017 548 H VAL 79 H VAL 79 -3.524 17.202 -19.851 549 HA VAL 79 HA VAL 79 -5.591 17.930 -18.159 550 HB VAL 79 HB VAL 79 -5.695 15.678 -20.169 551 HG11 VAL 79 1HG1 VAL 79 -7.798 17.404 -18.888 552 HG12 VAL 79 2HG1 VAL 79 -8.087 16.482 -20.364 553 HG13 VAL 79 3HG1 VAL 79 -7.667 15.646 -18.868 554 HG21 VAL 79 3HG2 VAL 79 -5.201 18.473 -20.548 555 HG22 VAL 79 1HG2 VAL 79 -5.306 17.187 -21.751 556 HG23 VAL 79 2HG2 VAL 79 -6.762 18.047 -21.249 557 H GLY 80 H GLY 80 -6.339 17.136 -16.308 558 HA2 GLY 80 1HA GLY 80 -7.056 15.521 -14.788 559 HA3 GLY 80 2HA GLY 80 -6.342 14.280 -15.808 560 H GLY 81 H GLY 81 -4.029 16.586 -15.454 561 HA2 GLY 81 1HA GLY 81 -2.608 14.968 -13.504 562 HA3 GLY 81 2HA GLY 81 -1.941 16.292 -14.448 563 H VAL 82 H VAL 82 -2.093 15.515 -11.463 564 HA VAL 82 HA VAL 82 -2.917 18.186 -10.525 565 HB VAL 82 HB VAL 82 -3.089 15.625 -8.933 566 HG11 VAL 82 1HG1 VAL 82 -2.951 17.137 -7.262 567 HG12 VAL 82 2HG1 VAL 82 -3.432 18.484 -8.295 568 HG13 VAL 82 3HG1 VAL 82 -4.654 17.391 -7.643 569 HG21 VAL 82 3HG2 VAL 82 -5.637 16.435 -9.146 570 HG22 VAL 82 1HG2 VAL 82 -5.017 17.003 -10.697 571 HG23 VAL 82 2HG2 VAL 82 -4.890 15.297 -10.267 572 H ARG 83 H ARG 83 -1.368 19.340 -9.581 573 HA ARG 83 HA ARG 83 0.801 18.010 -8.164 574 HB2 ARG 83 1HB ARG 83 2.560 19.048 -9.382 575 HB3 ARG 83 2HB ARG 83 1.500 18.304 -10.571 576 HG2 ARG 83 1HG ARG 83 0.557 20.410 -11.162 577 HG3 ARG 83 2HG ARG 83 1.371 21.212 -9.818 578 HD2 ARG 83 1HD ARG 83 2.461 21.601 -12.012 579 HD3 ARG 83 2HD ARG 83 3.519 20.839 -10.825 580 HE ARG 83 HE ARG 83 2.477 18.739 -12.186 581 HH11 ARG 83 1HH1 ARG 83 4.118 21.657 -13.140 582 HH12 ARG 83 2HH1 ARG 83 4.830 20.950 -14.553 583 HH21 ARG 83 1HH2 ARG 83 3.408 17.797 -14.043 584 HH22 ARG 83 2HH2 ARG 83 4.424 18.755 -15.066 585 H ARG 84 H ARG 84 1.685 19.229 -6.534 586 HA ARG 84 HA ARG 84 0.194 21.599 -5.788 587 HB2 ARG 84 1HB ARG 84 1.015 19.616 -4.266 588 HB3 ARG 84 2HB ARG 84 2.504 20.550 -4.204 589 HG2 ARG 84 1HG ARG 84 1.216 22.485 -3.372 590 HG3 ARG 84 2HG ARG 84 -0.231 21.474 -3.351 591 HD2 ARG 84 1HD ARG 84 0.597 21.450 -1.144 592 HD3 ARG 84 2HD ARG 84 1.060 19.900 -1.845 593 HE ARG 84 HE ARG 84 3.223 21.463 -2.300 594 HH11 ARG 84 1HH1 ARG 84 1.361 20.709 0.543 595 HH12 ARG 84 2HH1 ARG 84 2.702 20.881 1.626 596 HH21 ARG 84 1HH2 ARG 84 4.997 21.692 -0.884 597 HH22 ARG 84 2HH2 ARG 84 4.769 21.440 0.814 598 H LEU 85 H LEU 85 0.805 23.388 -6.861 599 HA LEU 85 HA LEU 85 3.605 23.903 -7.420 600 HB2 LEU 85 1HB LEU 85 1.876 24.401 -9.093 601 HB3 LEU 85 2HB LEU 85 1.157 25.570 -7.987 602 HG LEU 85 HG LEU 85 3.645 26.572 -8.144 603 HD11 LEU 85 1HD1 LEU 85 4.137 26.492 -10.671 604 HD12 LEU 85 2HD1 LEU 85 3.185 25.008 -10.655 605 HD13 LEU 85 3HD1 LEU 85 4.641 25.131 -9.668 606 HD21 LEU 85 3HD2 LEU 85 1.321 27.563 -8.649 607 HD22 LEU 85 1HD2 LEU 85 1.685 27.169 -10.330 608 HD23 LEU 85 2HD2 LEU 85 2.730 28.275 -9.437 609 H THR 86 H THR 86 4.875 24.836 -5.973 610 HA THR 86 HA THR 86 3.694 26.468 -3.852 611 HB THR 86 HB THR 86 6.612 25.836 -3.927 612 HG1 THR 86 HG1 THR 86 6.202 23.772 -3.101 613 HG21 THR 86 3HG2 THR 86 5.058 25.410 -1.486 614 HG22 THR 86 1HG2 THR 86 4.951 27.054 -2.114 615 HG23 THR 86 2HG2 THR 86 6.526 26.353 -1.743 616 H ILE 87 H ILE 87 3.593 28.586 -4.163 617 HA ILE 87 HA ILE 87 5.682 29.877 -5.791 618 HB ILE 87 HB ILE 87 2.921 30.944 -5.199 619 HG12 ILE 87 1HG1 ILE 87 2.807 30.441 -7.812 620 HG13 ILE 87 2HG1 ILE 87 3.971 29.195 -7.374 621 HG21 ILE 87 1HG2 ILE 87 4.841 31.837 -7.331 622 HG22 ILE 87 2HG2 ILE 87 3.387 32.650 -6.756 623 HG23 ILE 87 3HG2 ILE 87 4.810 32.552 -5.719 624 HD11 ILE 87 3HD1 ILE 87 1.126 29.231 -7.046 625 HD12 ILE 87 1HD1 ILE 87 2.265 27.903 -6.827 626 HD13 ILE 87 2HD1 ILE 87 1.922 29.001 -5.490 627 HA PRO 88 HA PRO 88 7.039 31.868 -2.078 628 HB2 PRO 88 1HB PRO 88 8.662 33.702 -3.250 629 HB3 PRO 88 2HB PRO 88 9.096 31.996 -3.093 630 HG2 PRO 88 1HG PRO 88 7.984 33.456 -5.458 631 HG3 PRO 88 2HG PRO 88 9.283 32.250 -5.397 632 HD2 PRO 88 1HD PRO 88 6.759 31.636 -6.160 633 HD3 PRO 88 2HD PRO 88 7.808 30.482 -5.312 634 HA PRO 89 HA PRO 89 4.742 35.568 -1.471 635 HB2 PRO 89 1HB PRO 89 6.443 37.149 -0.065 636 HB3 PRO 89 2HB PRO 89 5.668 35.719 0.626 637 HG2 PRO 89 1HG PRO 89 8.435 36.029 -0.475 638 HG3 PRO 89 2HG PRO 89 7.902 35.187 0.992 639 HD2 PRO 89 1HD PRO 89 8.475 33.882 -1.311 640 HD3 PRO 89 2HD PRO 89 7.235 33.314 -0.175 641 H GLN 90 H GLN 90 7.456 35.573 -3.444 642 HA GLN 90 HA GLN 90 7.207 38.407 -4.139 643 HB2 GLN 90 1HB GLN 90 9.452 37.101 -3.767 644 HB3 GLN 90 2HB GLN 90 9.184 36.559 -5.418 645 HG2 GLN 90 1HG GLN 90 10.542 38.419 -5.662 646 HG3 GLN 90 2HG GLN 90 8.925 39.040 -5.988 647 HE21 GLN 90 2HE2 GLN 90 11.289 38.657 -3.386 648 HE22 GLN 90 1HE2 GLN 90 10.883 40.120 -2.563 649 H LEU 91 H LEU 91 7.062 35.186 -5.614 650 HA LEU 91 HA LEU 91 6.033 36.324 -8.092 651 HB2 LEU 91 1HB LEU 91 6.437 33.413 -7.461 652 HB3 LEU 91 2HB LEU 91 6.311 34.172 -9.046 653 HG LEU 91 HG LEU 91 8.624 34.330 -7.120 654 HD11 LEU 91 1HD1 LEU 91 9.097 32.425 -8.217 655 HD12 LEU 91 2HD1 LEU 91 9.613 33.522 -9.498 656 HD13 LEU 91 3HD1 LEU 91 8.006 32.796 -9.553 657 HD21 LEU 91 3HD2 LEU 91 8.345 36.506 -8.116 658 HD22 LEU 91 1HD2 LEU 91 8.174 35.791 -9.719 659 HD23 LEU 91 2HD2 LEU 91 9.718 35.695 -8.872 660 H GLY 92 H GLY 92 4.595 36.056 -5.364 661 HA2 GLY 92 1HA GLY 92 2.181 34.722 -6.429 662 HA3 GLY 92 2HA GLY 92 2.610 34.728 -4.725 663 H TYR 93 H TYR 93 2.851 36.996 -3.772 664 HA TYR 93 HA TYR 93 0.651 38.667 -4.799 665 HB2 TYR 93 1HB TYR 93 1.453 37.892 -2.028 666 HB3 TYR 93 2HB TYR 93 0.718 39.472 -2.278 667 HD1 TYR 93 HD2 TYR 93 -1.479 39.371 -3.820 668 HD2 TYR 93 HD1 TYR 93 0.044 36.151 -1.493 669 HE1 TYR 93 HE2 TYR 93 -3.712 38.340 -3.795 670 HE2 TYR 93 HE1 TYR 93 -2.184 35.110 -1.463 671 HH TYR 93 HH TYR 93 -4.436 35.571 -1.808 672 H GLY 94 H GLY 94 3.940 38.579 -3.662 673 HA2 GLY 94 1HA GLY 94 5.618 40.121 -4.145 674 HA3 GLY 94 2HA GLY 94 4.393 41.227 -4.750 675 H ALA 95 H ALA 95 5.748 42.799 -3.556 676 HA ALA 95 HA ALA 95 6.026 42.798 -0.772 677 HB1 ALA 95 1HB ALA 95 7.098 44.326 -2.566 678 HB2 ALA 95 2HB ALA 95 5.679 45.342 -2.308 679 HB3 ALA 95 3HB ALA 95 6.764 44.985 -0.964 680 H ARG 96 H ARG 96 3.330 43.644 -2.811 681 HA ARG 96 HA ARG 96 1.831 45.221 -1.075 682 HB2 ARG 96 1HB ARG 96 1.247 44.885 -3.432 683 HB3 ARG 96 2HB ARG 96 0.844 43.206 -3.100 684 HG2 ARG 96 1HG ARG 96 -0.885 44.095 -1.471 685 HG3 ARG 96 2HG ARG 96 -0.598 45.677 -2.199 686 HD2 ARG 96 1HD ARG 96 -1.020 44.445 -4.439 687 HD3 ARG 96 2HD ARG 96 -1.768 43.211 -3.427 688 HE ARG 96 HE ARG 96 -3.567 44.589 -3.170 689 HH11 ARG 96 1HH1 ARG 96 -0.838 46.495 -4.192 690 HH12 ARG 96 2HH1 ARG 96 -1.758 47.953 -4.370 691 HH21 ARG 96 1HH2 ARG 96 -4.788 46.502 -3.401 692 HH22 ARG 96 2HH2 ARG 96 -4.004 47.956 -3.919 693 H GLY 97 H GLY 97 1.413 41.716 -1.638 694 HA2 GLY 97 1HA GLY 97 0.751 40.034 -0.221 695 HA3 GLY 97 2HA GLY 97 1.253 41.068 1.109 696 H ALA 98 H ALA 98 -1.018 39.331 1.082 697 HA ALA 98 HA ALA 98 -3.401 40.826 0.622 698 HB1 ALA 98 1HB ALA 98 -3.448 38.578 2.546 699 HB2 ALA 98 2HB ALA 98 -4.516 38.935 1.189 700 HB3 ALA 98 3HB ALA 98 -2.934 38.214 0.899 701 H GLY 99 H GLY 99 -4.955 41.438 2.298 702 HA2 GLY 99 1HA GLY 99 -3.940 43.234 4.142 703 HA3 GLY 99 2HA GLY 99 -5.551 42.538 4.224 704 H GLY 100 H GLY 100 -5.877 40.614 5.454 705 HA2 GLY 100 1HA GLY 100 -4.271 40.554 7.833 706 HA3 GLY 100 2HA GLY 100 -5.667 39.543 7.490 707 H VAL 101 H VAL 101 -5.376 37.602 6.295 708 HA VAL 101 HA VAL 101 -3.161 36.089 7.013 709 HB VAL 101 HB VAL 101 -3.903 34.516 5.164 710 HG11 VAL 101 1HG1 VAL 101 -4.756 34.691 7.617 711 HG12 VAL 101 2HG1 VAL 101 -6.242 35.271 6.863 712 HG13 VAL 101 3HG1 VAL 101 -5.614 33.672 6.462 713 HG21 VAL 101 3HG2 VAL 101 -6.391 36.102 4.895 714 HG22 VAL 101 1HG2 VAL 101 -4.981 36.651 3.988 715 HG23 VAL 101 2HG2 VAL 101 -5.606 35.020 3.745 716 H ILE 102 H ILE 102 -1.850 34.846 5.228 717 HA ILE 102 HA ILE 102 -0.170 34.892 3.694 718 HB ILE 102 HB ILE 102 -1.526 37.310 2.505 719 HG12 ILE 102 1HG1 ILE 102 -3.127 35.443 2.783 720 HG13 ILE 102 2HG1 ILE 102 -2.780 35.773 1.089 721 HG21 ILE 102 1HG2 ILE 102 0.303 37.221 1.215 722 HG22 ILE 102 2HG2 ILE 102 0.708 35.586 1.737 723 HG23 ILE 102 3HG2 ILE 102 -0.484 35.834 0.462 724 HD11 ILE 102 3HD1 ILE 102 -2.691 33.321 2.346 725 HD12 ILE 102 1HD1 ILE 102 -2.027 33.714 0.760 726 HD13 ILE 102 2HD1 ILE 102 -0.996 33.781 2.190 727 HA PRO 103 HA PRO 103 1.842 38.284 6.147 728 HB2 PRO 103 1HB PRO 103 3.798 36.702 7.168 729 HB3 PRO 103 2HB PRO 103 2.211 36.878 7.926 730 HG2 PRO 103 1HG PRO 103 3.231 34.691 6.155 731 HG3 PRO 103 2HG PRO 103 2.269 34.571 7.640 732 HD2 PRO 103 1HD PRO 103 1.173 34.360 5.173 733 HD3 PRO 103 2HD PRO 103 0.297 35.056 6.551 734 HA PRO 104 HA PRO 104 5.093 39.095 3.300 735 HB2 PRO 104 1HB PRO 104 6.994 40.222 4.876 736 HB3 PRO 104 2HB PRO 104 5.490 41.045 4.447 737 HG2 PRO 104 1HG PRO 104 6.196 39.578 6.959 738 HG3 PRO 104 2HG PRO 104 5.347 41.123 6.766 739 HD2 PRO 104 1HD PRO 104 4.047 38.798 7.251 740 HD3 PRO 104 2HD PRO 104 3.338 40.103 6.279 741 H ASN 105 H ASN 105 7.013 38.294 2.471 742 HA ASN 105 HA ASN 105 8.586 36.689 2.090 743 HB2 ASN 105 1HB ASN 105 9.179 36.911 5.043 744 HB3 ASN 105 2HB ASN 105 10.295 36.490 3.747 745 HD21 ASN 105 2HD2 ASN 105 8.725 39.024 5.457 746 HD22 ASN 105 1HD2 ASN 105 9.541 40.341 4.693 747 H ALA 106 H ALA 106 6.030 35.656 2.537 748 HA ALA 106 HA ALA 106 6.621 33.156 3.983 749 HB1 ALA 106 1HB ALA 106 3.809 33.949 3.446 750 HB2 ALA 106 2HB ALA 106 4.495 33.055 4.803 751 HB3 ALA 106 3HB ALA 106 4.688 34.806 4.712 752 H THR 107 H THR 107 6.175 31.215 3.000 753 HA THR 107 HA THR 107 5.943 31.295 0.112 754 HB THR 107 HB THR 107 6.373 28.982 2.010 755 HG1 THR 107 HG1 THR 107 8.127 30.289 0.178 756 HG21 THR 107 3HG2 THR 107 5.359 27.966 0.174 757 HG22 THR 107 1HG2 THR 107 7.076 27.851 -0.207 758 HG23 THR 107 2HG2 THR 107 6.084 29.091 -0.973 759 H LEU 108 H LEU 108 4.112 31.023 -0.975 760 HA LEU 108 HA LEU 108 1.737 30.105 0.465 761 HB2 LEU 108 1HB LEU 108 2.029 31.430 -2.227 762 HB3 LEU 108 2HB LEU 108 0.497 30.983 -1.478 763 HG LEU 108 HG LEU 108 1.399 32.549 0.456 764 HD11 LEU 108 1HD1 LEU 108 2.387 34.422 -1.421 765 HD12 LEU 108 2HD1 LEU 108 3.319 32.937 -1.602 766 HD13 LEU 108 3HD1 LEU 108 3.212 33.724 -0.027 767 HD21 LEU 108 3HD2 LEU 108 0.437 34.169 -1.785 768 HD22 LEU 108 1HD2 LEU 108 -0.264 33.906 -0.188 769 HD23 LEU 108 2HD2 LEU 108 -0.523 32.723 -1.470 770 H VAL 109 H VAL 109 0.858 28.168 0.133 771 HA VAL 109 HA VAL 109 1.981 26.476 -1.979 772 HB VAL 109 HB VAL 109 0.321 25.758 0.441 773 HG11 VAL 109 1HG1 VAL 109 0.898 24.287 -1.988 774 HG12 VAL 109 2HG1 VAL 109 1.490 23.450 -0.551 775 HG13 VAL 109 3HG1 VAL 109 -0.211 23.902 -0.672 776 HG21 VAL 109 3HG2 VAL 109 2.493 26.320 1.166 777 HG22 VAL 109 1HG2 VAL 109 2.476 24.560 1.059 778 HG23 VAL 109 2HG2 VAL 109 3.248 25.513 -0.208 779 H PHE 110 H PHE 110 0.901 26.480 -3.835 780 HA PHE 110 HA PHE 110 -2.043 26.559 -3.744 781 HB2 PHE 110 1HB PHE 110 -0.095 27.718 -5.722 782 HB3 PHE 110 2HB PHE 110 -1.769 27.405 -6.168 783 HD1 PHE 110 HD1 PHE 110 -3.582 28.685 -5.175 784 HD2 PHE 110 HD2 PHE 110 0.484 29.490 -4.208 785 HE1 PHE 110 HE1 PHE 110 -4.244 30.849 -4.209 786 HE2 PHE 110 HE2 PHE 110 -0.171 31.655 -3.240 787 HZ PHE 110 HZ PHE 110 -2.538 32.337 -3.239 788 H GLU 111 H GLU 111 -3.148 24.936 -4.666 789 HA GLU 111 HA GLU 111 -1.588 22.815 -5.964 790 HB2 GLU 111 1HB GLU 111 -3.028 22.364 -3.899 791 HB3 GLU 111 2HB GLU 111 -4.416 22.579 -4.955 792 HG2 GLU 111 1HG GLU 111 -3.408 20.776 -6.418 793 HG3 GLU 111 2HG GLU 111 -2.298 20.459 -5.086 794 H VAL 112 H VAL 112 -1.828 22.385 -8.060 795 HA VAL 112 HA VAL 112 -4.152 23.538 -9.462 796 HB VAL 112 HB VAL 112 -1.353 23.199 -10.549 797 HG11 VAL 112 1HG1 VAL 112 -2.458 24.708 -12.380 798 HG12 VAL 112 2HG1 VAL 112 -2.666 22.956 -12.423 799 HG13 VAL 112 3HG1 VAL 112 -3.952 23.982 -11.787 800 HG21 VAL 112 3HG2 VAL 112 -2.650 25.356 -9.109 801 HG22 VAL 112 1HG2 VAL 112 -0.954 25.148 -9.543 802 HG23 VAL 112 2HG2 VAL 112 -2.076 25.871 -10.695 803 H GLU 113 H GLU 113 -5.451 22.058 -10.305 804 HA GLU 113 HA GLU 113 -4.285 19.508 -11.207 805 HB2 GLU 113 1HB GLU 113 -6.673 18.617 -10.598 806 HB3 GLU 113 2HB GLU 113 -5.445 18.780 -9.351 807 HG2 GLU 113 1HG GLU 113 -6.478 20.567 -8.366 808 HG3 GLU 113 2HG GLU 113 -7.281 21.064 -9.855 809 H LEU 114 H LEU 114 -4.349 19.567 -13.359 810 HA LEU 114 HA LEU 114 -6.104 21.117 -14.905 811 HB2 LEU 114 1HB LEU 114 -4.060 19.087 -15.369 812 HB3 LEU 114 2HB LEU 114 -5.348 19.068 -16.573 813 HG LEU 114 HG LEU 114 -3.334 20.428 -17.180 814 HD11 LEU 114 1HD1 LEU 114 -5.013 22.573 -17.464 815 HD12 LEU 114 2HD1 LEU 114 -6.137 21.229 -17.264 816 HD13 LEU 114 3HD1 LEU 114 -4.929 21.184 -18.548 817 HD21 LEU 114 3HD2 LEU 114 -4.349 22.164 -14.933 818 HD22 LEU 114 1HD2 LEU 114 -3.175 22.676 -16.146 819 HD23 LEU 114 2HD2 LEU 114 -2.780 21.364 -15.036 820 H LEU 115 H LEU 115 -8.148 20.826 -15.503 821 HA LEU 115 HA LEU 115 -9.382 18.205 -15.004 822 HB2 LEU 115 1HB LEU 115 -10.633 20.936 -15.261 823 HB3 LEU 115 2HB LEU 115 -11.521 19.436 -14.996 824 HG LEU 115 HG LEU 115 -9.424 20.276 -13.039 825 HD11 LEU 115 1HD1 LEU 115 -12.155 21.127 -12.413 826 HD12 LEU 115 2HD1 LEU 115 -11.381 22.041 -13.707 827 HD13 LEU 115 3HD1 LEU 115 -10.615 21.935 -12.121 828 HD21 LEU 115 3HD2 LEU 115 -12.057 19.030 -12.403 829 HD22 LEU 115 1HD2 LEU 115 -10.499 18.852 -11.595 830 HD23 LEU 115 2HD2 LEU 115 -10.791 18.043 -13.135 831 H ASP 116 H ASP 116 -8.958 20.732 -17.406 832 HA ASP 116 HA ASP 116 -9.260 18.932 -19.567 833 HB2 ASP 116 1HB ASP 116 -11.687 19.457 -18.685 834 HB3 ASP 116 2HB ASP 116 -11.462 20.957 -19.581 835 H VAL 117 H VAL 117 -9.194 20.081 -21.694 836 HA VAL 117 HA VAL 117 -7.483 22.436 -21.438 837 HB VAL 117 HB VAL 117 -8.048 20.696 -23.843 838 HG11 VAL 117 1HG1 VAL 117 -7.479 22.849 -24.647 839 HG12 VAL 117 2HG1 VAL 117 -6.201 23.038 -23.445 840 HG13 VAL 117 3HG1 VAL 117 -6.013 21.876 -24.758 841 HG21 VAL 117 3HG2 VAL 117 -6.489 19.312 -23.077 842 HG22 VAL 117 1HG2 VAL 117 -5.336 20.640 -22.958 843 HG23 VAL 117 2HG2 VAL 117 -6.392 20.265 -21.596 844 H11 L2S 130 1H1 L2S 130 -4.320 31.597 -9.463 845 H21 L2S 130 2H1 L2S 130 -4.836 32.161 -11.124 846 H12 L2S 130 1H2 L2S 130 -5.166 34.381 -10.285 847 H22 L2S 130 2H2 L2S 130 -3.445 33.842 -9.973 848 H13 L2S 130 2H3 L2S 130 -4.040 33.362 -7.687 849 H23 L2S 130 1H3 L2S 130 -4.535 35.079 -8.058 850 H14 L2S 130 1H4 L2S 130 -6.162 31.584 -7.619 851 H24 L2S 130 2H4 L2S 130 -7.728 32.404 -8.071 852 H15 L2S 130 1H5 L2S 130 -6.683 31.044 -9.915 853 H25 L2S 130 2H5 L2S 130 -6.976 32.817 -10.259 854 H17 L2S 130 1H7 L2S 130 -8.720 33.994 -7.400 855 H27 L2S 130 2H7 L2S 130 -8.185 33.396 -5.741 856 H9 L2S 130 H9 L2S 130 -8.647 34.017 -3.524 857 H10 L2S 130 H10 L2S 130 -7.778 34.448 -1.225 858 H112 L2S 130 1H12 L2S 130 -6.551 38.459 -2.448 859 H113 L2S 130 1H13 L2S 130 -7.468 38.030 -4.720 860 H114 L2S 130 1H14 L2S 130 -5.585 37.056 -0.472 861 H214 L2S 130 2H14 L2S 130 -6.677 35.809 0.177 862 H314 L2S 130 3H14 L2S 130 -7.258 37.502 0.014 Start of MODEL 12 1 H1 GLY 1 H GLY 1 1.621 0.186 -5.469 2 HA2 GLY 1 1HA GLY 1 2.758 1.221 -7.253 3 HA3 GLY 1 2HA GLY 1 1.746 2.642 -7.045 4 HA PRO 2 HA PRO 2 6.037 3.147 -5.079 5 HB2 PRO 2 1HB PRO 2 7.053 4.918 -6.869 6 HB3 PRO 2 2HB PRO 2 7.241 3.168 -7.036 7 HG2 PRO 2 1HG PRO 2 5.286 5.000 -8.372 8 HG3 PRO 2 2HG PRO 2 6.221 3.663 -9.067 9 HD2 PRO 2 1HD PRO 2 3.615 3.413 -8.375 10 HD3 PRO 2 2HD PRO 2 4.764 2.064 -8.270 11 H GLY 3 H GLY 3 5.987 4.567 -3.459 12 HA2 GLY 3 1HA GLY 3 4.272 6.914 -3.656 13 HA3 GLY 3 2HA GLY 3 5.043 6.305 -2.199 14 H SER 4 H SER 4 7.632 6.146 -3.796 15 HA SER 4 HA SER 4 8.768 8.534 -2.902 16 HB2 SER 4 1HB SER 4 10.345 6.872 -3.244 17 HB3 SER 4 2HB SER 4 9.642 6.375 -4.783 18 HG SER 4 HG SER 4 10.723 7.916 -5.797 19 H MET 5 H MET 5 8.547 10.536 -3.624 20 HA MET 5 HA MET 5 7.683 10.958 -6.397 21 HB2 MET 5 1HB MET 5 7.645 12.898 -4.079 22 HB3 MET 5 2HB MET 5 6.949 13.165 -5.671 23 HG2 MET 5 1HG MET 5 5.417 11.257 -5.259 24 HG3 MET 5 2HG MET 5 6.055 11.157 -3.620 25 HE1 MET 5 3HE MET 5 5.321 12.087 -1.846 26 HE2 MET 5 1HE MET 5 5.646 13.821 -1.876 27 HE3 MET 5 2HE MET 5 3.999 13.238 -1.637 28 H THR 6 H THR 6 8.446 13.415 -7.004 29 HA THR 6 HA THR 6 11.337 13.593 -6.523 30 HB THR 6 HB THR 6 10.286 14.104 -9.282 31 HG1 THR 6 HG1 THR 6 9.809 12.045 -9.411 32 HG21 THR 6 3HG2 THR 6 12.442 14.488 -9.681 33 HG22 THR 6 1HG2 THR 6 12.840 12.849 -9.165 34 HG23 THR 6 2HG2 THR 6 12.812 14.163 -7.988 35 H VAL 7 H VAL 7 11.679 15.522 -5.648 36 HA VAL 7 HA VAL 7 9.972 17.777 -6.430 37 HB VAL 7 HB VAL 7 11.886 17.582 -4.101 38 HG11 VAL 7 1HG1 VAL 7 10.118 19.520 -3.459 39 HG12 VAL 7 2HG1 VAL 7 11.676 19.823 -4.231 40 HG13 VAL 7 3HG1 VAL 7 10.209 19.734 -5.207 41 HG21 VAL 7 3HG2 VAL 7 10.318 16.488 -2.969 42 HG22 VAL 7 1HG2 VAL 7 9.138 17.746 -3.336 43 HG23 VAL 7 2HG2 VAL 7 9.352 16.387 -4.441 44 H VAL 8 H VAL 8 10.758 19.549 -7.431 45 HA VAL 8 HA VAL 8 13.621 20.018 -7.582 46 HB VAL 8 HB VAL 8 13.309 18.528 -9.466 47 HG11 VAL 8 1HG1 VAL 8 10.794 19.756 -9.661 48 HG12 VAL 8 2HG1 VAL 8 11.650 20.152 -11.153 49 HG13 VAL 8 3HG1 VAL 8 11.445 18.467 -10.673 50 HG21 VAL 8 3HG2 VAL 8 14.082 19.996 -11.279 51 HG22 VAL 8 1HG2 VAL 8 13.583 21.403 -10.340 52 HG23 VAL 8 2HG2 VAL 8 14.880 20.363 -9.750 53 H THR 9 H THR 9 14.154 22.137 -8.021 54 HA THR 9 HA THR 9 11.880 24.003 -8.161 55 HB THR 9 HB THR 9 14.656 24.557 -7.097 56 HG1 THR 9 HG1 THR 9 13.923 23.947 -5.196 57 HG21 THR 9 3HG2 THR 9 14.063 26.702 -7.143 58 HG22 THR 9 1HG2 THR 9 12.682 26.339 -6.109 59 HG23 THR 9 2HG2 THR 9 12.512 26.271 -7.864 60 H THR 10 H THR 10 11.714 25.352 -9.840 61 HA THR 10 HA THR 10 13.550 25.124 -12.031 62 HB THR 10 HB THR 10 12.005 27.138 -12.849 63 HG1 THR 10 HG1 THR 10 10.903 27.390 -10.881 64 HG21 THR 10 3HG2 THR 10 10.368 25.409 -13.644 65 HG22 THR 10 1HG2 THR 10 11.223 24.232 -12.648 66 HG23 THR 10 2HG2 THR 10 12.057 25.032 -13.980 67 H GLU 11 H GLU 11 14.541 26.993 -13.098 68 HA GLU 11 HA GLU 11 16.195 28.448 -11.369 69 HB2 GLU 11 1HB GLU 11 15.510 28.906 -14.275 70 HB3 GLU 11 2HB GLU 11 16.768 29.784 -13.418 71 HG2 GLU 11 1HG GLU 11 17.847 27.579 -12.927 72 HG3 GLU 11 2HG GLU 11 16.671 26.840 -14.013 73 H SER 12 H SER 12 13.065 29.165 -12.711 74 HA SER 12 HA SER 12 13.042 31.952 -12.345 75 HB2 SER 12 1HB SER 12 11.359 30.502 -13.624 76 HB3 SER 12 2HB SER 12 10.610 30.190 -12.058 77 HG SER 12 HG SER 12 10.926 32.677 -13.377 78 H GLY 13 H GLY 13 12.663 29.309 -10.123 79 HA2 GLY 13 1HA GLY 13 13.214 29.916 -7.779 80 HA3 GLY 13 2HA GLY 13 12.096 31.258 -7.974 81 H LEU 14 H LEU 14 9.966 30.037 -9.216 82 HA LEU 14 HA LEU 14 8.519 28.987 -7.104 83 HB2 LEU 14 1HB LEU 14 6.798 28.607 -8.605 84 HB3 LEU 14 2HB LEU 14 7.728 29.891 -9.374 85 HG LEU 14 HG LEU 14 8.863 27.782 -10.564 86 HD11 LEU 14 1HD1 LEU 14 7.762 25.930 -9.891 87 HD12 LEU 14 2HD1 LEU 14 6.626 26.423 -11.146 88 HD13 LEU 14 3HD1 LEU 14 6.302 26.819 -9.458 89 HD21 LEU 14 3HD2 LEU 14 6.616 28.166 -12.126 90 HD22 LEU 14 1HD2 LEU 14 8.104 29.111 -12.182 91 HD23 LEU 14 2HD2 LEU 14 6.746 29.663 -11.201 92 H LYS 15 H LYS 15 7.452 26.774 -7.101 93 HA LYS 15 HA LYS 15 9.249 24.642 -7.988 94 HB2 LYS 15 1HB LYS 15 8.193 24.737 -5.163 95 HB3 LYS 15 2HB LYS 15 9.356 23.603 -5.838 96 HG2 LYS 15 1HG LYS 15 10.821 24.952 -4.786 97 HG3 LYS 15 2HG LYS 15 10.679 25.884 -6.278 98 HD2 LYS 15 1HD LYS 15 10.321 27.541 -4.741 99 HD3 LYS 15 2HD LYS 15 8.662 26.991 -4.983 100 HE2 LYS 15 1HE LYS 15 8.773 25.636 -2.994 101 HE3 LYS 15 2HE LYS 15 10.484 26.010 -2.790 102 HZ1 LYS 15 3HZ LYS 15 8.142 27.716 -2.310 103 HZ2 LYS 15 1HZ LYS 15 9.610 28.441 -2.738 104 HZ3 LYS 15 2HZ LYS 15 9.514 27.480 -1.349 105 H TYR 16 H TYR 16 8.229 22.453 -7.638 106 HA TYR 16 HA TYR 16 5.345 22.410 -7.421 107 HB2 TYR 16 1HB TYR 16 5.172 21.211 -9.676 108 HB3 TYR 16 2HB TYR 16 5.385 22.957 -9.714 109 HD1 TYR 16 HD1 TYR 16 7.196 19.738 -10.071 110 HD2 TYR 16 HD2 TYR 16 7.215 23.924 -10.833 111 HE1 TYR 16 HE1 TYR 16 9.166 19.459 -11.517 112 HE2 TYR 16 HE2 TYR 16 9.185 23.657 -12.282 113 HH TYR 16 HH TYR 16 10.117 21.344 -13.713 114 H GLU 17 H GLU 17 4.519 20.371 -6.994 115 HA GLU 17 HA GLU 17 6.442 18.153 -6.891 116 HB2 GLU 17 1HB GLU 17 6.378 18.989 -4.645 117 HB3 GLU 17 2HB GLU 17 4.622 19.074 -4.667 118 HG2 GLU 17 1HG GLU 17 4.420 16.712 -4.631 119 HG3 GLU 17 2HG GLU 17 6.145 16.498 -4.923 120 H ASP 18 H ASP 18 5.688 16.509 -8.031 121 HA ASP 18 HA ASP 18 3.188 16.319 -9.183 122 HB2 ASP 18 1HB ASP 18 3.709 13.946 -9.587 123 HB3 ASP 18 2HB ASP 18 5.093 14.981 -9.928 124 H LEU 19 H LEU 19 1.228 15.592 -8.581 125 HA LEU 19 HA LEU 19 0.981 14.417 -5.890 126 HB2 LEU 19 1HB LEU 19 0.091 16.842 -6.477 127 HB3 LEU 19 2HB LEU 19 -1.278 15.923 -7.100 128 HG LEU 19 HG LEU 19 -1.454 14.863 -4.816 129 HD11 LEU 19 1HD1 LEU 19 0.929 15.607 -4.227 130 HD12 LEU 19 2HD1 LEU 19 -0.313 15.737 -2.983 131 HD13 LEU 19 3HD1 LEU 19 0.203 17.173 -3.868 132 HD21 LEU 19 3HD2 LEU 19 -3.123 16.383 -5.126 133 HD22 LEU 19 1HD2 LEU 19 -2.008 17.703 -5.482 134 HD23 LEU 19 2HD2 LEU 19 -2.255 17.182 -3.815 135 H THR 20 H THR 20 -0.146 14.439 -9.208 136 HA THR 20 HA THR 20 -0.956 11.691 -9.012 137 HB THR 20 HB THR 20 -3.135 13.592 -9.844 138 HG1 THR 20 HG1 THR 20 -2.588 12.553 -7.249 139 HG21 THR 20 3HG2 THR 20 -2.846 10.869 -10.100 140 HG22 THR 20 1HG2 THR 20 -4.375 11.747 -10.142 141 HG23 THR 20 2HG2 THR 20 -3.815 11.023 -8.635 142 H GLU 21 H GLU 21 -0.119 10.868 -10.807 143 HA GLU 21 HA GLU 21 0.745 12.263 -13.028 144 HB2 GLU 21 1HB GLU 21 1.035 9.739 -12.253 145 HB3 GLU 21 2HB GLU 21 -0.251 9.482 -13.423 146 HG2 GLU 21 1HG GLU 21 1.515 9.207 -14.800 147 HG3 GLU 21 2HG GLU 21 1.355 10.957 -14.934 148 H GLY 22 H GLY 22 -0.092 12.737 -15.041 149 HA2 GLY 22 1HA GLY 22 -2.956 12.180 -15.454 150 HA3 GLY 22 2HA GLY 22 -2.345 13.820 -15.618 151 H SER 23 H SER 23 -2.492 10.650 -17.041 152 HA SER 23 HA SER 23 -0.837 11.376 -19.301 153 HB2 SER 23 1HB SER 23 -2.574 8.921 -18.973 154 HB3 SER 23 2HB SER 23 -1.230 9.134 -20.095 155 HG SER 23 HG SER 23 -1.193 8.346 -17.513 156 H GLY 24 H GLY 24 -2.485 13.292 -19.492 157 HA2 GLY 24 1HA GLY 24 -4.645 12.453 -21.326 158 HA3 GLY 24 2HA GLY 24 -4.727 13.879 -20.303 159 H ALA 25 H ALA 25 -3.095 15.589 -20.743 160 HA ALA 25 HA ALA 25 -1.605 15.698 -23.114 161 HB1 ALA 25 1HB ALA 25 -3.921 17.466 -23.560 162 HB2 ALA 25 2HB ALA 25 -2.951 16.548 -24.713 163 HB3 ALA 25 3HB ALA 25 -4.212 15.740 -23.782 164 H GLU 26 H GLU 26 -0.183 17.310 -22.902 165 HA GLU 26 HA GLU 26 -0.150 18.982 -20.660 166 HB2 GLU 26 1HB GLU 26 1.881 18.378 -21.870 167 HB3 GLU 26 2HB GLU 26 1.328 19.269 -23.281 168 HG2 GLU 26 1HG GLU 26 1.349 21.337 -21.874 169 HG3 GLU 26 2HG GLU 26 2.125 20.388 -20.607 170 H ALA 27 H ALA 27 -0.953 20.948 -20.240 171 HA ALA 27 HA ALA 27 -3.024 22.068 -21.683 172 HB1 ALA 27 1HB ALA 27 -1.624 24.140 -20.280 173 HB2 ALA 27 2HB ALA 27 -3.158 23.362 -19.885 174 HB3 ALA 27 3HB ALA 27 -1.642 22.664 -19.315 175 H ARG 28 H ARG 28 -3.172 23.272 -23.463 176 HA ARG 28 HA ARG 28 -0.725 24.090 -24.806 177 HB2 ARG 28 1HB ARG 28 -3.615 23.980 -25.659 178 HB3 ARG 28 2HB ARG 28 -2.363 24.704 -26.659 179 HG2 ARG 28 1HG ARG 28 -1.968 21.934 -25.647 180 HG3 ARG 28 2HG ARG 28 -3.080 22.210 -26.989 181 HD2 ARG 28 1HD ARG 28 -1.022 23.646 -27.875 182 HD3 ARG 28 2HD ARG 28 -0.131 22.511 -26.862 183 HE ARG 28 HE ARG 28 -1.900 21.051 -28.456 184 HH11 ARG 28 1HH1 ARG 28 0.935 23.043 -28.798 185 HH12 ARG 28 2HH1 ARG 28 1.494 22.230 -30.222 186 HH21 ARG 28 1HH2 ARG 28 -1.174 19.973 -30.331 187 HH22 ARG 28 2HH2 ARG 28 0.293 20.484 -31.093 188 H ALA 29 H ALA 29 -0.656 26.242 -25.872 189 HA ALA 29 HA ALA 29 -1.569 28.291 -23.987 190 HB1 ALA 29 1HB ALA 29 0.109 29.513 -25.829 191 HB2 ALA 29 2HB ALA 29 0.536 28.976 -24.204 192 HB3 ALA 29 3HB ALA 29 0.811 27.914 -25.585 193 H GLY 30 H GLY 30 -2.569 30.217 -24.704 194 HA2 GLY 30 1HA GLY 30 -3.759 31.582 -26.164 195 HA3 GLY 30 2HA GLY 30 -3.381 30.467 -27.469 196 H GLN 31 H GLN 31 -4.490 28.515 -25.137 197 HA GLN 31 HA GLN 31 -7.284 28.773 -26.036 198 HB2 GLN 31 1HB GLN 31 -5.638 26.307 -25.485 199 HB3 GLN 31 2HB GLN 31 -7.391 26.268 -25.611 200 HG2 GLN 31 1HG GLN 31 -7.295 27.038 -27.887 201 HG3 GLN 31 2HG GLN 31 -5.548 27.251 -27.777 202 HE21 GLN 31 2HE2 GLN 31 -4.212 25.442 -27.775 203 HE22 GLN 31 1HE2 GLN 31 -4.769 23.889 -28.286 204 H THR 32 H THR 32 -8.931 28.171 -24.538 205 HA THR 32 HA THR 32 -8.259 28.890 -21.817 206 HB THR 32 HB THR 32 -11.004 28.040 -22.681 207 HG1 THR 32 HG1 THR 32 -10.959 29.587 -24.122 208 HG21 THR 32 3HG2 THR 32 -10.038 28.906 -20.301 209 HG22 THR 32 1HG2 THR 32 -11.708 29.116 -20.824 210 HG23 THR 32 2HG2 THR 32 -10.549 30.431 -21.023 211 H VAL 33 H VAL 33 -7.669 27.440 -20.355 212 HA VAL 33 HA VAL 33 -8.625 24.668 -20.645 213 HB VAL 33 HB VAL 33 -6.680 23.940 -19.410 214 HG11 VAL 33 1HG1 VAL 33 -5.153 25.642 -21.162 215 HG12 VAL 33 2HG1 VAL 33 -5.487 23.914 -21.287 216 HG13 VAL 33 3HG1 VAL 33 -6.624 25.083 -21.957 217 HG21 VAL 33 3HG2 VAL 33 -4.974 26.103 -19.227 218 HG22 VAL 33 1HG2 VAL 33 -6.528 26.754 -18.704 219 HG23 VAL 33 2HG2 VAL 33 -5.842 25.346 -17.892 220 H SER 34 H SER 34 -9.603 23.649 -18.955 221 HA SER 34 HA SER 34 -10.370 25.355 -16.698 222 HB2 SER 34 1HB SER 34 -11.881 23.719 -18.328 223 HB3 SER 34 2HB SER 34 -11.666 22.734 -16.881 224 HG SER 34 HG SER 34 -13.455 24.496 -17.123 225 H VAL 35 H VAL 35 -9.382 25.104 -14.818 226 HA VAL 35 HA VAL 35 -8.584 22.434 -13.941 227 HB VAL 35 HB VAL 35 -6.359 22.979 -13.424 228 HG11 VAL 35 1HG1 VAL 35 -5.371 23.574 -15.536 229 HG12 VAL 35 2HG1 VAL 35 -6.804 22.588 -15.835 230 HG13 VAL 35 3HG1 VAL 35 -6.870 24.335 -16.068 231 HG21 VAL 35 3HG2 VAL 35 -7.355 25.739 -13.506 232 HG22 VAL 35 1HG2 VAL 35 -6.098 25.013 -12.505 233 HG23 VAL 35 2HG2 VAL 35 -5.728 25.522 -14.152 234 H HIS 36 H HIS 36 -8.212 22.278 -11.655 235 HA HIS 36 HA HIS 36 -9.730 24.292 -10.164 236 HB2 HIS 36 1HB HIS 36 -9.290 21.388 -9.897 237 HB3 HIS 36 2HB HIS 36 -9.303 22.281 -8.379 238 HD1 HIS 36 HD1 HIS 36 -11.516 24.353 -9.184 239 HD2 HIS 36 HD2 HIS 36 -11.772 20.236 -9.684 240 HE1 HIS 36 HE1 HIS 36 -13.976 23.838 -9.275 241 H TYR 37 H TYR 37 -8.822 25.574 -8.674 242 HA TYR 37 HA TYR 37 -5.999 25.080 -7.986 243 HB2 TYR 37 1HB TYR 37 -5.691 27.483 -7.822 244 HB3 TYR 37 2HB TYR 37 -6.349 27.082 -9.404 245 HD1 TYR 37 HD2 TYR 37 -7.218 28.441 -6.071 246 HD2 TYR 37 HD1 TYR 37 -8.414 27.980 -10.128 247 HE1 TYR 37 HE2 TYR 37 -9.051 30.039 -5.706 248 HE2 TYR 37 HE1 TYR 37 -10.250 29.578 -9.775 249 HH TYR 37 HH TYR 37 -11.425 30.721 -8.231 250 H THR 38 H THR 38 -5.353 25.300 -5.874 251 HA THR 38 HA THR 38 -7.399 25.986 -3.883 252 HB THR 38 HB THR 38 -5.700 23.872 -2.891 253 HG1 THR 38 HG1 THR 38 -6.617 22.218 -4.252 254 HG21 THR 38 3HG2 THR 38 -8.565 24.580 -3.027 255 HG22 THR 38 1HG2 THR 38 -7.597 24.033 -1.659 256 HG23 THR 38 2HG2 THR 38 -8.197 22.866 -2.838 257 H GLY 39 H GLY 39 -6.629 27.623 -2.726 258 HA2 GLY 39 1HA GLY 39 -3.750 28.010 -2.483 259 HA3 GLY 39 2HA GLY 39 -4.999 29.155 -2.016 260 H TRP 40 H TRP 40 -2.603 27.385 -0.789 261 HA TRP 40 HA TRP 40 -3.960 27.110 1.807 262 HB2 TRP 40 1HB TRP 40 -2.126 25.148 0.445 263 HB3 TRP 40 2HB TRP 40 -2.343 25.145 2.193 264 HD1 TRP 40 HD1 TRP 40 -5.411 25.492 2.485 265 HE1 TRP 40 HE1 TRP 40 -7.037 23.669 1.673 266 HE3 TRP 40 HE3 TRP 40 -2.363 23.119 -0.864 267 HZ2 TRP 40 HZ2 TRP 40 -7.028 21.511 -0.146 268 HZ3 TRP 40 HZ3 TRP 40 -3.248 21.184 -2.098 269 HH2 TRP 40 HH2 TRP 40 -5.533 20.397 -1.745 270 H LEU 41 H LEU 41 -2.898 27.937 3.523 271 HA LEU 41 HA LEU 41 -0.607 29.581 3.047 272 HB2 LEU 41 1HB LEU 41 -2.379 28.980 5.351 273 HB3 LEU 41 2HB LEU 41 -0.785 29.647 5.698 274 HG LEU 41 HG LEU 41 -2.620 31.007 3.758 275 HD11 LEU 41 1HD1 LEU 41 -2.685 31.173 6.761 276 HD12 LEU 41 2HD1 LEU 41 -4.013 30.798 5.663 277 HD13 LEU 41 3HD1 LEU 41 -3.338 32.427 5.705 278 HD21 LEU 41 3HD2 LEU 41 -0.090 31.566 5.121 279 HD22 LEU 41 1HD2 LEU 41 -1.253 32.891 5.177 280 HD23 LEU 41 2HD2 LEU 41 -0.747 32.229 3.623 281 H THR 42 H THR 42 1.219 29.479 4.781 282 HA THR 42 HA THR 42 2.778 27.235 4.286 283 HB THR 42 HB THR 42 4.282 28.022 6.027 284 HG1 THR 42 HG1 THR 42 2.201 29.839 6.738 285 HG21 THR 42 3HG2 THR 42 3.004 30.112 4.290 286 HG22 THR 42 1HG2 THR 42 4.539 29.275 4.064 287 HG23 THR 42 2HG2 THR 42 4.377 30.495 5.328 288 H ASP 43 H ASP 43 0.404 27.809 6.766 289 HA ASP 43 HA ASP 43 1.202 25.462 8.286 290 HB2 ASP 43 1HB ASP 43 -1.130 27.347 8.698 291 HB3 ASP 43 2HB ASP 43 -0.603 26.095 9.819 292 H GLY 44 H GLY 44 -0.969 26.309 5.769 293 HA2 GLY 44 1HA GLY 44 -1.880 24.437 4.482 294 HA3 GLY 44 2HA GLY 44 -2.241 23.654 6.013 295 H GLN 45 H GLN 45 -2.876 26.904 6.308 296 HA GLN 45 HA GLN 45 -5.677 26.500 6.490 297 HB2 GLN 45 1HB GLN 45 -3.805 28.761 6.836 298 HB3 GLN 45 2HB GLN 45 -5.456 29.197 6.415 299 HG2 GLN 45 1HG GLN 45 -6.280 27.931 8.335 300 HG3 GLN 45 2HG GLN 45 -4.623 27.500 8.757 301 HE21 GLN 45 2HE2 GLN 45 -3.707 28.713 10.239 302 HE22 GLN 45 1HE2 GLN 45 -4.126 30.344 10.627 303 H LYS 46 H LYS 46 -7.157 26.517 4.941 304 HA LYS 46 HA LYS 46 -6.454 27.158 2.235 305 HB2 LYS 46 1HB LYS 46 -8.020 25.310 2.918 306 HB3 LYS 46 2HB LYS 46 -9.197 26.546 3.341 307 HG2 LYS 46 1HG LYS 46 -9.577 27.130 1.147 308 HG3 LYS 46 2HG LYS 46 -8.013 26.518 0.604 309 HD2 LYS 46 1HD LYS 46 -9.743 25.045 -0.187 310 HD3 LYS 46 2HD LYS 46 -8.816 24.213 1.064 311 HE2 LYS 46 1HE LYS 46 -11.181 23.810 1.383 312 HE3 LYS 46 2HE LYS 46 -10.556 24.793 2.706 313 HZ1 LYS 46 3HZ LYS 46 -12.691 25.368 1.026 314 HZ2 LYS 46 1HZ LYS 46 -11.470 26.473 0.638 315 HZ3 LYS 46 2HZ LYS 46 -12.030 26.355 2.230 316 H PHE 47 H PHE 47 -6.677 29.039 1.221 317 HA PHE 47 HA PHE 47 -8.536 31.030 2.334 318 HB2 PHE 47 1HB PHE 47 -6.885 32.795 1.732 319 HB3 PHE 47 2HB PHE 47 -6.312 31.710 2.995 320 HD1 PHE 47 HD2 PHE 47 -6.100 32.378 -0.646 321 HD2 PHE 47 HD1 PHE 47 -4.297 30.566 2.757 322 HE1 PHE 47 HE2 PHE 47 -4.077 31.917 -1.968 323 HE2 PHE 47 HE1 PHE 47 -2.270 30.103 1.441 324 HZ PHE 47 HZ PHE 47 -2.159 30.778 -0.925 325 H ASP 48 H ASP 48 -8.386 29.065 -0.043 326 HA ASP 48 HA ASP 48 -9.910 30.565 -1.844 327 HB2 ASP 48 1HB ASP 48 -7.191 31.142 -2.108 328 HB3 ASP 48 2HB ASP 48 -7.533 30.011 -3.415 329 H SER 49 H SER 49 -11.133 29.125 -2.860 330 HA SER 49 HA SER 49 -10.004 26.670 -3.902 331 HB2 SER 49 1HB SER 49 -10.694 26.302 -1.437 332 HB3 SER 49 2HB SER 49 -12.351 26.404 -2.034 333 HG SER 49 HG SER 49 -10.596 24.712 -3.386 334 H SER 50 H SER 50 -10.713 26.792 -5.928 335 HA SER 50 HA SER 50 -13.010 28.163 -6.776 336 HB2 SER 50 1HB SER 50 -10.853 26.856 -8.003 337 HB3 SER 50 2HB SER 50 -12.293 26.032 -8.600 338 HG SER 50 HG SER 50 -12.223 28.838 -8.536 339 H LYS 51 H LYS 51 -12.638 25.077 -5.369 340 HA LYS 51 HA LYS 51 -14.739 23.632 -6.497 341 HB2 LYS 51 1HB LYS 51 -13.594 23.591 -3.704 342 HB3 LYS 51 2HB LYS 51 -14.790 22.433 -4.272 343 HG2 LYS 51 1HG LYS 51 -12.260 22.815 -5.806 344 HG3 LYS 51 2HG LYS 51 -12.262 21.838 -4.336 345 HD2 LYS 51 1HD LYS 51 -14.244 20.601 -5.376 346 HD3 LYS 51 2HD LYS 51 -13.789 21.394 -6.887 347 HE2 LYS 51 1HE LYS 51 -11.573 20.400 -6.760 348 HE3 LYS 51 2HE LYS 51 -11.977 19.655 -5.214 349 HZ1 LYS 51 3HZ LYS 51 -13.959 18.858 -6.939 350 HZ2 LYS 51 1HZ LYS 51 -12.669 17.917 -6.379 351 HZ3 LYS 51 2HZ LYS 51 -12.537 18.743 -7.849 352 H ASP 52 H ASP 52 -14.786 26.340 -4.373 353 HA ASP 52 HA ASP 52 -17.197 26.038 -3.041 354 HB2 ASP 52 1HB ASP 52 -15.471 27.905 -2.802 355 HB3 ASP 52 2HB ASP 52 -16.260 28.668 -4.179 356 H ARG 53 H ARG 53 -16.600 27.389 -6.270 357 HA ARG 53 HA ARG 53 -19.378 27.877 -6.776 358 HB2 ARG 53 1HB ARG 53 -16.867 28.020 -8.405 359 HB3 ARG 53 2HB ARG 53 -18.432 28.090 -9.205 360 HG2 ARG 53 1HG ARG 53 -17.735 30.320 -8.860 361 HG3 ARG 53 2HG ARG 53 -19.011 30.001 -7.683 362 HD2 ARG 53 1HD ARG 53 -17.363 29.652 -5.944 363 HD3 ARG 53 2HD ARG 53 -16.054 29.849 -7.110 364 HE ARG 53 HE ARG 53 -17.831 32.109 -6.933 365 HH11 ARG 53 1HH1 ARG 53 -14.967 30.589 -5.665 366 HH12 ARG 53 2HH1 ARG 53 -14.294 32.066 -5.059 367 HH21 ARG 53 1HH2 ARG 53 -16.954 34.060 -6.139 368 HH22 ARG 53 2HH2 ARG 53 -15.425 34.039 -5.328 369 H ASN 54 H ASN 54 -17.606 25.088 -6.629 370 HA ASN 54 HA ASN 54 -18.012 22.933 -7.235 371 HB2 ASN 54 1HB ASN 54 -20.674 23.871 -8.308 372 HB3 ASN 54 2HB ASN 54 -20.250 22.264 -7.728 373 HD21 ASN 54 2HD2 ASN 54 -19.598 22.146 -5.417 374 HD22 ASN 54 1HD2 ASN 54 -20.461 23.135 -4.294 375 H ASP 55 H ASP 55 -17.116 25.140 -9.191 376 HA ASP 55 HA ASP 55 -17.199 23.414 -11.559 377 HB2 ASP 55 1HB ASP 55 -17.862 25.098 -13.025 378 HB3 ASP 55 2HB ASP 55 -18.874 25.404 -11.616 379 HA PRO 56 HA PRO 56 -12.878 24.175 -11.744 380 HB2 PRO 56 1HB PRO 56 -12.436 23.844 -14.402 381 HB3 PRO 56 2HB PRO 56 -12.785 22.498 -13.311 382 HG2 PRO 56 1HG PRO 56 -14.624 23.955 -15.171 383 HG3 PRO 56 2HG PRO 56 -14.491 22.213 -14.866 384 HD2 PRO 56 1HD PRO 56 -16.426 23.745 -13.751 385 HD3 PRO 56 2HD PRO 56 -15.735 22.330 -12.929 386 H PHE 57 H PHE 57 -11.226 25.542 -12.818 387 HA PHE 57 HA PHE 57 -12.360 28.174 -13.437 388 HB2 PHE 57 1HB PHE 57 -10.810 28.150 -11.569 389 HB3 PHE 57 2HB PHE 57 -9.582 27.364 -12.557 390 HD1 PHE 57 HD2 PHE 57 -11.806 30.254 -13.304 391 HD2 PHE 57 HD1 PHE 57 -7.828 28.853 -12.730 392 HE1 PHE 57 HE2 PHE 57 -10.937 32.458 -13.968 393 HE2 PHE 57 HE1 PHE 57 -6.953 31.055 -13.393 394 HZ PHE 57 HZ PHE 57 -8.508 32.860 -14.014 395 H ALA 58 H ALA 58 -12.662 28.427 -15.561 396 HA ALA 58 HA ALA 58 -10.757 27.298 -17.459 397 HB1 ALA 58 1HB ALA 58 -12.427 28.188 -19.150 398 HB2 ALA 58 2HB ALA 58 -12.993 26.904 -18.082 399 HB3 ALA 58 3HB ALA 58 -13.459 28.576 -17.774 400 H PHE 59 H PHE 59 -9.042 28.459 -18.010 401 HA PHE 59 HA PHE 59 -9.377 31.301 -18.603 402 HB2 PHE 59 1HB PHE 59 -7.516 32.000 -17.291 403 HB3 PHE 59 2HB PHE 59 -8.529 31.023 -16.233 404 HD1 PHE 59 HD2 PHE 59 -7.852 28.697 -15.688 405 HD2 PHE 59 HD1 PHE 59 -5.298 31.370 -17.798 406 HE1 PHE 59 HE2 PHE 59 -5.922 27.264 -15.162 407 HE2 PHE 59 HE1 PHE 59 -3.365 29.941 -17.275 408 HZ PHE 59 HZ PHE 59 -3.675 27.886 -15.954 409 H VAL 60 H VAL 60 -7.804 32.155 -20.035 410 HA VAL 60 HA VAL 60 -6.784 30.207 -21.891 411 HB VAL 60 HB VAL 60 -6.446 33.209 -21.906 412 HG11 VAL 60 1HG1 VAL 60 -6.200 32.692 -24.425 413 HG12 VAL 60 2HG1 VAL 60 -4.824 32.399 -23.360 414 HG13 VAL 60 3HG1 VAL 60 -5.832 31.053 -23.892 415 HG21 VAL 60 3HG2 VAL 60 -8.697 33.094 -22.164 416 HG22 VAL 60 1HG2 VAL 60 -8.243 32.745 -23.832 417 HG23 VAL 60 2HG2 VAL 60 -8.657 31.426 -22.736 418 H LEU 61 H LEU 61 -4.823 29.338 -21.882 419 HA LEU 61 HA LEU 61 -2.864 30.129 -19.950 420 HB2 LEU 61 1HB LEU 61 -2.918 27.841 -20.348 421 HB3 LEU 61 2HB LEU 61 -3.007 28.050 -22.096 422 HG LEU 61 HG LEU 61 -0.683 28.559 -22.231 423 HD11 LEU 61 1HD1 LEU 61 0.219 29.732 -20.570 424 HD12 LEU 61 2HD1 LEU 61 0.405 28.201 -19.717 425 HD13 LEU 61 3HD1 LEU 61 -1.014 29.206 -19.424 426 HD21 LEU 61 3HD2 LEU 61 -1.561 26.149 -20.790 427 HD22 LEU 61 1HD2 LEU 61 0.166 26.497 -20.706 428 HD23 LEU 61 2HD2 LEU 61 -0.621 26.310 -22.274 429 H GLY 62 H GLY 62 -1.265 31.551 -20.177 430 HA2 GLY 62 1HA GLY 62 0.401 31.928 -22.326 431 HA3 GLY 62 2HA GLY 62 -0.952 33.011 -22.620 432 H GLY 63 H GLY 63 -1.552 33.930 -20.120 433 HA2 GLY 63 1HA GLY 63 -0.211 34.783 -18.169 434 HA3 GLY 63 2HA GLY 63 0.942 35.330 -19.378 435 H GLY 64 H GLY 64 -0.812 36.717 -17.311 436 HA2 GLY 64 1HA GLY 64 -1.100 39.178 -18.122 437 HA3 GLY 64 2HA GLY 64 -2.382 38.454 -19.081 438 H MET 65 H MET 65 -3.267 36.573 -17.128 439 HA MET 65 HA MET 65 -4.445 38.415 -15.152 440 HB2 MET 65 1HB MET 65 -5.740 36.877 -17.078 441 HB3 MET 65 2HB MET 65 -5.956 35.971 -15.587 442 HG2 MET 65 1HG MET 65 -7.136 37.686 -14.564 443 HG3 MET 65 2HG MET 65 -6.527 38.902 -15.684 444 HE1 MET 65 3HE MET 65 -7.916 39.369 -18.234 445 HE2 MET 65 1HE MET 65 -9.532 39.525 -17.545 446 HE3 MET 65 2HE MET 65 -8.126 40.052 -16.620 447 H VAL 66 H VAL 66 -2.786 35.433 -15.683 448 HA VAL 66 HA VAL 66 -3.155 34.611 -12.895 449 HB VAL 66 HB VAL 66 -2.221 32.488 -13.500 450 HG11 VAL 66 1HG1 VAL 66 -3.791 32.669 -15.923 451 HG12 VAL 66 2HG1 VAL 66 -4.131 31.808 -14.420 452 HG13 VAL 66 3HG1 VAL 66 -4.565 33.511 -14.581 453 HG21 VAL 66 3HG2 VAL 66 -0.430 33.035 -14.932 454 HG22 VAL 66 1HG2 VAL 66 -1.548 32.094 -15.920 455 HG23 VAL 66 2HG2 VAL 66 -1.491 33.850 -16.080 456 H ILE 67 H ILE 67 -0.998 33.435 -12.092 457 HA ILE 67 HA ILE 67 1.054 35.528 -12.150 458 HB ILE 67 HB ILE 67 1.846 34.724 -10.076 459 HG12 ILE 67 1HG1 ILE 67 0.103 32.294 -10.534 460 HG13 ILE 67 2HG1 ILE 67 1.862 32.339 -10.552 461 HG21 ILE 67 1HG2 ILE 67 0.141 35.548 -8.907 462 HG22 ILE 67 2HG2 ILE 67 -0.781 35.544 -10.410 463 HG23 ILE 67 3HG2 ILE 67 -0.888 34.173 -9.306 464 HD11 ILE 67 3HD1 ILE 67 0.068 32.790 -8.181 465 HD12 ILE 67 1HD1 ILE 67 1.107 31.397 -8.483 466 HD13 ILE 67 2HD1 ILE 67 1.821 32.979 -8.166 467 H LYS 68 H LYS 68 3.347 34.767 -11.968 468 HA LYS 68 HA LYS 68 4.163 33.377 -14.190 469 HB2 LYS 68 1HB LYS 68 5.515 33.839 -11.541 470 HB3 LYS 68 2HB LYS 68 6.324 32.985 -12.848 471 HG2 LYS 68 1HG LYS 68 5.803 35.028 -14.280 472 HG3 LYS 68 2HG LYS 68 5.418 35.842 -12.762 473 HD2 LYS 68 1HD LYS 68 7.643 35.467 -11.934 474 HD3 LYS 68 2HD LYS 68 8.041 34.465 -13.331 475 HE2 LYS 68 1HE LYS 68 7.968 36.328 -14.797 476 HE3 LYS 68 2HE LYS 68 7.228 37.353 -13.568 477 HZ1 LYS 68 3HZ LYS 68 9.210 37.570 -12.434 478 HZ2 LYS 68 1HZ LYS 68 9.734 37.575 -14.043 479 HZ3 LYS 68 2HZ LYS 68 9.889 36.174 -13.108 480 H GLY 69 H GLY 69 4.042 32.075 -10.866 481 HA2 GLY 69 1HA GLY 69 4.770 29.463 -11.433 482 HA3 GLY 69 2HA GLY 69 3.722 29.933 -10.103 483 H TRP 70 H TRP 70 1.730 31.058 -12.013 484 HA TRP 70 HA TRP 70 0.182 28.683 -12.330 485 HB2 TRP 70 1HB TRP 70 -0.285 31.495 -12.353 486 HB3 TRP 70 2HB TRP 70 -0.940 30.823 -13.844 487 HD1 TRP 70 HD1 TRP 70 -3.303 29.849 -13.667 488 HE1 TRP 70 HE1 TRP 70 -4.855 29.124 -11.745 489 HE3 TRP 70 HE3 TRP 70 -0.063 30.408 -9.751 490 HZ2 TRP 70 HZ2 TRP 70 -4.724 28.829 -8.941 491 HZ3 TRP 70 HZ3 TRP 70 -0.855 29.884 -7.481 492 HH2 TRP 70 HH2 TRP 70 -3.138 29.112 -7.087 493 H ASP 71 H ASP 71 1.374 31.053 -14.719 494 HA ASP 71 HA ASP 71 0.683 29.648 -17.009 495 HB2 ASP 71 1HB ASP 71 1.942 31.187 -18.180 496 HB3 ASP 71 2HB ASP 71 1.712 32.048 -16.661 497 H GLU 72 H GLU 72 3.557 29.380 -14.985 498 HA GLU 72 HA GLU 72 4.921 27.570 -16.724 499 HB2 GLU 72 1HB GLU 72 5.992 29.059 -14.977 500 HB3 GLU 72 2HB GLU 72 5.392 27.935 -13.766 501 HG2 GLU 72 1HG GLU 72 7.672 27.413 -14.224 502 HG3 GLU 72 2HG GLU 72 6.663 26.127 -14.884 503 H GLY 73 H GLY 73 2.824 27.227 -13.908 504 HA2 GLY 73 1HA GLY 73 3.205 24.461 -13.502 505 HA3 GLY 73 2HA GLY 73 1.811 25.391 -12.973 506 H VAL 74 H VAL 74 0.842 26.237 -15.457 507 HA VAL 74 HA VAL 74 -0.470 23.816 -16.314 508 HB VAL 74 HB VAL 74 -1.707 25.361 -17.868 509 HG11 VAL 74 1HG1 VAL 74 -2.059 26.655 -15.267 510 HG12 VAL 74 2HG1 VAL 74 -3.201 25.723 -16.236 511 HG13 VAL 74 3HG1 VAL 74 -2.040 24.893 -15.199 512 HG21 VAL 74 3HG2 VAL 74 0.411 27.055 -17.431 513 HG22 VAL 74 1HG2 VAL 74 -1.134 27.503 -18.156 514 HG23 VAL 74 2HG2 VAL 74 -0.862 27.755 -16.431 515 H GLN 75 H GLN 75 2.065 25.895 -17.468 516 HA GLN 75 HA GLN 75 2.050 25.239 -20.187 517 HB2 GLN 75 1HB GLN 75 3.971 26.398 -18.281 518 HB3 GLN 75 2HB GLN 75 4.704 25.599 -19.666 519 HG2 GLN 75 1HG GLN 75 3.458 27.003 -21.184 520 HG3 GLN 75 2HG GLN 75 2.611 27.755 -19.833 521 HE21 GLN 75 2HE2 GLN 75 3.675 29.542 -21.297 522 HE22 GLN 75 1HE2 GLN 75 5.179 30.141 -20.695 523 H GLY 76 H GLY 76 2.862 23.354 -17.451 524 HA2 GLY 76 1HA GLY 76 4.077 21.319 -19.218 525 HA3 GLY 76 2HA GLY 76 4.567 21.549 -17.546 526 H MET 77 H MET 77 1.886 21.921 -16.531 527 HA MET 77 HA MET 77 1.236 19.342 -15.795 528 HB2 MET 77 1HB MET 77 -0.170 21.952 -15.739 529 HB3 MET 77 2HB MET 77 -1.170 20.519 -15.539 530 HG2 MET 77 1HG MET 77 1.299 20.888 -13.898 531 HG3 MET 77 2HG MET 77 -0.205 21.694 -13.458 532 HE1 MET 77 3HE MET 77 1.063 17.484 -12.678 533 HE2 MET 77 1HE MET 77 0.993 17.810 -14.410 534 HE3 MET 77 2HE MET 77 1.970 18.835 -13.359 535 H LYS 78 H LYS 78 -0.342 17.857 -16.431 536 HA LYS 78 HA LYS 78 -1.263 18.177 -19.211 537 HB2 LYS 78 1HB LYS 78 -0.733 15.623 -17.681 538 HB3 LYS 78 2HB LYS 78 -1.256 15.729 -19.356 539 HG2 LYS 78 1HG LYS 78 0.821 16.776 -19.986 540 HG3 LYS 78 2HG LYS 78 1.342 16.824 -18.300 541 HD2 LYS 78 1HD LYS 78 0.987 14.254 -18.384 542 HD3 LYS 78 2HD LYS 78 1.069 14.472 -20.134 543 HE2 LYS 78 1HE LYS 78 3.224 15.897 -19.384 544 HE3 LYS 78 2HE LYS 78 3.182 14.708 -18.083 545 HZ1 LYS 78 3HZ LYS 78 3.610 12.997 -19.504 546 HZ2 LYS 78 1HZ LYS 78 4.444 14.231 -20.308 547 HZ3 LYS 78 2HZ LYS 78 2.909 13.760 -20.841 548 H VAL 79 H VAL 79 -3.326 17.199 -19.762 549 HA VAL 79 HA VAL 79 -5.418 17.994 -18.124 550 HB VAL 79 HB VAL 79 -5.552 15.796 -20.192 551 HG11 VAL 79 1HG1 VAL 79 -7.496 16.788 -18.456 552 HG12 VAL 79 2HG1 VAL 79 -7.834 17.550 -20.012 553 HG13 VAL 79 3HG1 VAL 79 -7.755 15.792 -19.888 554 HG21 VAL 79 3HG2 VAL 79 -4.851 17.384 -21.611 555 HG22 VAL 79 1HG2 VAL 79 -6.462 18.071 -21.405 556 HG23 VAL 79 2HG2 VAL 79 -5.115 18.678 -20.441 557 H GLY 80 H GLY 80 -6.223 17.203 -16.299 558 HA2 GLY 80 1HA GLY 80 -7.064 15.595 -14.835 559 HA3 GLY 80 2HA GLY 80 -6.410 14.340 -15.878 560 H GLY 81 H GLY 81 -3.965 16.485 -15.427 561 HA2 GLY 81 1HA GLY 81 -2.726 14.749 -13.435 562 HA3 GLY 81 2HA GLY 81 -1.908 15.954 -14.419 563 H VAL 82 H VAL 82 -2.298 15.287 -11.387 564 HA VAL 82 HA VAL 82 -2.935 18.037 -10.544 565 HB VAL 82 HB VAL 82 -3.002 15.511 -8.886 566 HG11 VAL 82 1HG1 VAL 82 -2.412 17.493 -7.583 567 HG12 VAL 82 2HG1 VAL 82 -3.840 18.328 -8.200 568 HG13 VAL 82 3HG1 VAL 82 -4.023 16.910 -7.166 569 HG21 VAL 82 3HG2 VAL 82 -5.541 16.618 -8.961 570 HG22 VAL 82 1HG2 VAL 82 -4.960 16.764 -10.619 571 HG23 VAL 82 2HG2 VAL 82 -4.995 15.186 -9.834 572 H ARG 83 H ARG 83 -1.401 19.237 -9.605 573 HA ARG 83 HA ARG 83 0.921 17.964 -8.390 574 HB2 ARG 83 1HB ARG 83 1.695 18.226 -10.643 575 HB3 ARG 83 2HB ARG 83 1.081 19.872 -10.723 576 HG2 ARG 83 1HG ARG 83 2.916 20.723 -9.784 577 HG3 ARG 83 2HG ARG 83 2.990 19.453 -8.560 578 HD2 ARG 83 1HD ARG 83 4.871 18.913 -9.709 579 HD3 ARG 83 2HD ARG 83 3.709 18.014 -10.684 580 HE ARG 83 HE ARG 83 4.017 20.656 -11.663 581 HH11 ARG 83 1HH1 ARG 83 5.597 17.557 -11.547 582 HH12 ARG 83 2HH1 ARG 83 6.474 17.802 -13.021 583 HH21 ARG 83 1HH2 ARG 83 5.165 20.992 -13.605 584 HH22 ARG 83 2HH2 ARG 83 6.228 19.757 -14.190 585 H ARG 84 H ARG 84 1.834 19.149 -6.763 586 HA ARG 84 HA ARG 84 0.322 21.459 -5.870 587 HB2 ARG 84 1HB ARG 84 1.207 19.457 -4.437 588 HB3 ARG 84 2HB ARG 84 2.712 20.367 -4.431 589 HG2 ARG 84 1HG ARG 84 1.833 22.078 -3.171 590 HG3 ARG 84 2HG ARG 84 0.174 21.727 -3.659 591 HD2 ARG 84 1HD ARG 84 0.156 20.922 -1.513 592 HD3 ARG 84 2HD ARG 84 0.622 19.469 -2.396 593 HE ARG 84 HE ARG 84 2.947 20.841 -1.663 594 HH11 ARG 84 1HH1 ARG 84 0.318 19.099 -0.188 595 HH12 ARG 84 2HH1 ARG 84 1.256 18.575 1.171 596 HH21 ARG 84 1HH2 ARG 84 4.192 20.158 0.121 597 HH22 ARG 84 2HH2 ARG 84 3.459 19.179 1.347 598 H LEU 85 H LEU 85 0.856 23.306 -6.876 599 HA LEU 85 HA LEU 85 3.621 23.888 -7.542 600 HB2 LEU 85 1HB LEU 85 1.904 24.435 -9.159 601 HB3 LEU 85 2HB LEU 85 1.078 25.447 -7.976 602 HG LEU 85 HG LEU 85 3.350 26.768 -7.993 603 HD11 LEU 85 1HD1 LEU 85 4.525 25.183 -9.435 604 HD12 LEU 85 2HD1 LEU 85 4.405 26.774 -10.187 605 HD13 LEU 85 3HD1 LEU 85 3.344 25.468 -10.714 606 HD21 LEU 85 3HD2 LEU 85 2.403 28.294 -9.537 607 HD22 LEU 85 1HD2 LEU 85 1.053 27.519 -8.707 608 HD23 LEU 85 2HD2 LEU 85 1.486 27.020 -10.343 609 H THR 86 H THR 86 4.951 24.933 -6.231 610 HA THR 86 HA THR 86 3.832 26.413 -3.959 611 HB THR 86 HB THR 86 6.758 25.954 -4.129 612 HG1 THR 86 HG1 THR 86 6.209 23.919 -4.719 613 HG21 THR 86 3HG2 THR 86 6.595 25.743 -1.788 614 HG22 THR 86 1HG2 THR 86 4.868 25.397 -1.855 615 HG23 THR 86 2HG2 THR 86 5.457 27.022 -2.210 616 H ILE 87 H ILE 87 3.726 28.547 -4.106 617 HA ILE 87 HA ILE 87 5.677 29.941 -5.820 618 HB ILE 87 HB ILE 87 2.923 30.922 -5.069 619 HG12 ILE 87 1HG1 ILE 87 2.688 30.489 -7.684 620 HG13 ILE 87 2HG1 ILE 87 3.904 29.263 -7.345 621 HG21 ILE 87 1HG2 ILE 87 4.764 32.579 -5.639 622 HG22 ILE 87 2HG2 ILE 87 4.707 31.917 -7.271 623 HG23 ILE 87 3HG2 ILE 87 3.278 32.688 -6.582 624 HD11 ILE 87 3HD1 ILE 87 2.081 28.820 -5.367 625 HD12 ILE 87 1HD1 ILE 87 1.060 29.312 -6.717 626 HD13 ILE 87 2HD1 ILE 87 2.164 27.948 -6.898 627 HA PRO 88 HA PRO 88 7.151 31.848 -2.108 628 HB2 PRO 88 1HB PRO 88 8.657 33.774 -3.289 629 HB3 PRO 88 2HB PRO 88 9.151 32.078 -3.216 630 HG2 PRO 88 1HG PRO 88 7.881 33.585 -5.469 631 HG3 PRO 88 2HG PRO 88 9.217 32.420 -5.515 632 HD2 PRO 88 1HD PRO 88 6.678 31.752 -6.178 633 HD3 PRO 88 2HD PRO 88 7.802 30.603 -5.424 634 HA PRO 89 HA PRO 89 4.771 35.446 -1.257 635 HB2 PRO 89 1HB PRO 89 6.486 37.027 0.132 636 HB3 PRO 89 2HB PRO 89 5.787 35.547 0.801 637 HG2 PRO 89 1HG PRO 89 8.490 35.986 -0.409 638 HG3 PRO 89 2HG PRO 89 8.050 35.073 1.046 639 HD2 PRO 89 1HD PRO 89 8.556 33.875 -1.329 640 HD3 PRO 89 2HD PRO 89 7.386 33.226 -0.162 641 H GLN 90 H GLN 90 7.399 35.616 -3.340 642 HA GLN 90 HA GLN 90 7.005 38.460 -3.925 643 HB2 GLN 90 1HB GLN 90 9.001 38.066 -5.471 644 HB3 GLN 90 2HB GLN 90 9.302 37.989 -3.740 645 HG2 GLN 90 1HG GLN 90 9.329 35.591 -3.794 646 HG3 GLN 90 2HG GLN 90 8.844 35.584 -5.488 647 HE21 GLN 90 2HE2 GLN 90 11.434 35.929 -3.260 648 HE22 GLN 90 1HE2 GLN 90 12.708 36.055 -4.419 649 H LEU 91 H LEU 91 6.916 35.272 -5.460 650 HA LEU 91 HA LEU 91 5.836 36.417 -7.910 651 HB2 LEU 91 1HB LEU 91 6.328 33.521 -7.250 652 HB3 LEU 91 2HB LEU 91 6.044 34.217 -8.844 653 HG LEU 91 HG LEU 91 8.498 34.512 -7.121 654 HD11 LEU 91 1HD1 LEU 91 9.474 33.009 -8.461 655 HD12 LEU 91 2HD1 LEU 91 8.711 33.658 -9.912 656 HD13 LEU 91 3HD1 LEU 91 7.825 32.540 -8.875 657 HD21 LEU 91 3HD2 LEU 91 7.424 36.283 -9.145 658 HD22 LEU 91 1HD2 LEU 91 9.009 35.654 -9.596 659 HD23 LEU 91 2HD2 LEU 91 8.802 36.505 -8.065 660 H GLY 92 H GLY 92 4.448 36.101 -5.148 661 HA2 GLY 92 1HA GLY 92 2.022 34.769 -6.184 662 HA3 GLY 92 2HA GLY 92 2.474 34.786 -4.486 663 H TYR 93 H TYR 93 2.584 36.962 -3.452 664 HA TYR 93 HA TYR 93 0.512 38.731 -4.577 665 HB2 TYR 93 1HB TYR 93 1.077 38.050 -1.687 666 HB3 TYR 93 2HB TYR 93 -0.023 39.324 -2.200 667 HD1 TYR 93 HD1 TYR 93 -1.488 38.139 -4.397 668 HD2 TYR 93 HD2 TYR 93 -0.197 36.357 -0.756 669 HE1 TYR 93 HE1 TYR 93 -3.316 36.501 -4.558 670 HE2 TYR 93 HE2 TYR 93 -2.021 34.713 -0.907 671 HH TYR 93 HH TYR 93 -3.694 33.928 -2.141 672 H GLY 94 H GLY 94 3.493 38.776 -4.825 673 HA2 GLY 94 1HA GLY 94 5.186 40.326 -4.804 674 HA3 GLY 94 2HA GLY 94 3.904 41.526 -4.731 675 H ALA 95 H ALA 95 5.971 42.402 -3.510 676 HA ALA 95 HA ALA 95 6.518 41.536 -0.899 677 HB1 ALA 95 1HB ALA 95 7.915 43.101 -2.262 678 HB2 ALA 95 2HB ALA 95 6.744 44.369 -1.896 679 HB3 ALA 95 3HB ALA 95 7.657 43.608 -0.593 680 H ARG 96 H ARG 96 3.901 43.386 -2.196 681 HA ARG 96 HA ARG 96 3.084 44.708 0.165 682 HB2 ARG 96 1HB ARG 96 2.354 45.110 -2.283 683 HB3 ARG 96 2HB ARG 96 1.185 43.829 -1.992 684 HG2 ARG 96 1HG ARG 96 1.344 46.128 -0.100 685 HG3 ARG 96 2HG ARG 96 0.522 46.321 -1.649 686 HD2 ARG 96 1HD ARG 96 -0.698 44.129 -0.981 687 HD3 ARG 96 2HD ARG 96 -0.161 44.532 0.649 688 HE ARG 96 HE ARG 96 -1.729 46.195 0.715 689 HH11 ARG 96 1HH1 ARG 96 -1.265 45.199 -2.589 690 HH12 ARG 96 2HH1 ARG 96 -2.582 46.147 -3.197 691 HH21 ARG 96 1HH2 ARG 96 -3.466 47.447 -0.074 692 HH22 ARG 96 2HH2 ARG 96 -3.833 47.425 -1.765 693 H GLY 97 H GLY 97 2.017 41.659 -1.335 694 HA2 GLY 97 1HA GLY 97 1.069 39.786 -0.400 695 HA3 GLY 97 2HA GLY 97 1.576 40.399 1.167 696 H ALA 98 H ALA 98 -0.854 39.040 0.688 697 HA ALA 98 HA ALA 98 -3.099 40.578 0.241 698 HB1 ALA 98 1HB ALA 98 -4.254 38.781 0.936 699 HB2 ALA 98 2HB ALA 98 -2.669 38.007 0.983 700 HB3 ALA 98 3HB ALA 98 -3.370 38.673 2.459 701 H GLY 99 H GLY 99 -4.675 41.456 1.778 702 HA2 GLY 99 1HA GLY 99 -3.664 43.475 3.367 703 HA3 GLY 99 2HA GLY 99 -5.283 42.812 3.530 704 H GLY 100 H GLY 100 -5.656 41.121 5.039 705 HA2 GLY 100 1HA GLY 100 -3.508 40.846 7.051 706 HA3 GLY 100 2HA GLY 100 -5.189 41.091 7.499 707 H VAL 101 H VAL 101 -4.151 39.030 4.857 708 HA VAL 101 HA VAL 101 -5.015 36.690 6.432 709 HB VAL 101 HB VAL 101 -5.332 37.130 3.459 710 HG11 VAL 101 1HG1 VAL 101 -4.871 34.796 3.987 711 HG12 VAL 101 2HG1 VAL 101 -6.166 34.801 5.186 712 HG13 VAL 101 3HG1 VAL 101 -6.546 35.004 3.475 713 HG21 VAL 101 3HG2 VAL 101 -7.471 36.878 5.568 714 HG22 VAL 101 1HG2 VAL 101 -6.880 38.418 4.944 715 HG23 VAL 101 2HG2 VAL 101 -7.683 37.279 3.863 716 H ILE 102 H ILE 102 -2.708 38.011 4.167 717 HA ILE 102 HA ILE 102 -1.070 35.583 4.496 718 HB ILE 102 HB ILE 102 -1.118 37.409 2.091 719 HG12 ILE 102 1HG1 ILE 102 -3.125 35.964 2.294 720 HG13 ILE 102 2HG1 ILE 102 -2.131 35.546 0.903 721 HG21 ILE 102 1HG2 ILE 102 0.414 35.834 1.080 722 HG22 ILE 102 2HG2 ILE 102 1.091 36.440 2.590 723 HG23 ILE 102 3HG2 ILE 102 0.378 34.828 2.528 724 HD11 ILE 102 3HD1 ILE 102 -3.031 33.608 2.182 725 HD12 ILE 102 1HD1 ILE 102 -1.277 33.619 1.998 726 HD13 ILE 102 2HD1 ILE 102 -2.007 34.097 3.532 727 HA PRO 103 HA PRO 103 1.850 38.315 6.390 728 HB2 PRO 103 1HB PRO 103 3.960 36.607 6.407 729 HB3 PRO 103 2HB PRO 103 2.598 36.463 7.525 730 HG2 PRO 103 1HG PRO 103 3.135 34.964 4.991 731 HG3 PRO 103 2HG PRO 103 2.545 34.354 6.548 732 HD2 PRO 103 1HD PRO 103 0.898 34.831 4.452 733 HD3 PRO 103 2HD PRO 103 0.382 35.036 6.139 734 HA PRO 104 HA PRO 104 4.374 40.109 3.269 735 HB2 PRO 104 1HB PRO 104 6.630 40.773 4.626 736 HB3 PRO 104 2HB PRO 104 5.094 41.622 4.841 737 HG2 PRO 104 1HG PRO 104 6.325 39.479 6.530 738 HG3 PRO 104 2HG PRO 104 5.506 40.969 7.034 739 HD2 PRO 104 1HD PRO 104 4.283 38.553 7.059 740 HD3 PRO 104 2HD PRO 104 3.407 40.063 6.738 741 H ASN 105 H ASN 105 6.226 37.854 5.316 742 HA ASN 105 HA ASN 105 7.550 36.872 2.874 743 HB2 ASN 105 1HB ASN 105 9.459 36.256 4.503 744 HB3 ASN 105 2HB ASN 105 9.288 37.943 4.028 745 HD21 ASN 105 2HD2 ASN 105 8.792 39.454 5.535 746 HD22 ASN 105 1HD2 ASN 105 8.654 39.117 7.224 747 H ALA 106 H ALA 106 6.686 34.953 2.423 748 HA ALA 106 HA ALA 106 7.017 32.725 4.100 749 HB1 ALA 106 1HB ALA 106 5.033 32.378 5.132 750 HB2 ALA 106 2HB ALA 106 4.955 34.138 5.050 751 HB3 ALA 106 3HB ALA 106 4.104 33.161 3.854 752 H THR 107 H THR 107 6.380 30.760 3.106 753 HA THR 107 HA THR 107 6.148 30.978 0.225 754 HB THR 107 HB THR 107 6.476 28.552 2.001 755 HG1 THR 107 HG1 THR 107 8.411 29.514 2.009 756 HG21 THR 107 3HG2 THR 107 7.250 27.630 -0.346 757 HG22 THR 107 1HG2 THR 107 6.140 28.862 -0.945 758 HG23 THR 107 2HG2 THR 107 5.552 27.593 0.129 759 H LEU 108 H LEU 108 4.340 30.704 -0.915 760 HA LEU 108 HA LEU 108 1.910 29.904 0.502 761 HB2 LEU 108 1HB LEU 108 2.233 31.114 -2.239 762 HB3 LEU 108 2HB LEU 108 0.711 30.843 -1.394 763 HG LEU 108 HG LEU 108 2.072 32.422 0.377 764 HD11 LEU 108 1HD1 LEU 108 2.511 34.131 -1.880 765 HD12 LEU 108 2HD1 LEU 108 3.476 32.664 -2.041 766 HD13 LEU 108 3HD1 LEU 108 3.628 33.664 -0.596 767 HD21 LEU 108 3HD2 LEU 108 -0.300 32.489 -0.774 768 HD22 LEU 108 1HD2 LEU 108 0.469 33.737 -1.755 769 HD23 LEU 108 2HD2 LEU 108 0.388 33.919 -0.003 770 H VAL 109 H VAL 109 1.022 27.968 0.228 771 HA VAL 109 HA VAL 109 2.075 26.223 -1.873 772 HB VAL 109 HB VAL 109 0.423 25.587 0.574 773 HG11 VAL 109 1HG1 VAL 109 -0.190 23.741 -0.516 774 HG12 VAL 109 2HG1 VAL 109 0.932 24.059 -1.841 775 HG13 VAL 109 3HG1 VAL 109 1.492 23.227 -0.390 776 HG21 VAL 109 3HG2 VAL 109 3.066 24.375 0.254 777 HG22 VAL 109 1HG2 VAL 109 3.096 26.131 0.411 778 HG23 VAL 109 2HG2 VAL 109 2.334 25.147 1.661 779 H PHE 110 H PHE 110 0.982 26.249 -3.723 780 HA PHE 110 HA PHE 110 -1.960 26.374 -3.608 781 HB2 PHE 110 1HB PHE 110 -0.015 27.521 -5.597 782 HB3 PHE 110 2HB PHE 110 -1.698 27.234 -6.028 783 HD1 PHE 110 HD2 PHE 110 -3.490 28.504 -4.952 784 HD2 PHE 110 HD1 PHE 110 0.610 29.302 -4.133 785 HE1 PHE 110 HE2 PHE 110 -4.112 30.670 -3.965 786 HE2 PHE 110 HE1 PHE 110 -0.006 31.469 -3.144 787 HZ PHE 110 HZ PHE 110 -2.369 32.156 -3.061 788 H GLU 111 H GLU 111 -3.090 24.767 -4.529 789 HA GLU 111 HA GLU 111 -1.565 22.642 -5.861 790 HB2 GLU 111 1HB GLU 111 -3.061 22.275 -3.759 791 HB3 GLU 111 2HB GLU 111 -4.392 22.341 -4.905 792 HG2 GLU 111 1HG GLU 111 -2.086 20.408 -4.967 793 HG3 GLU 111 2HG GLU 111 -3.739 20.051 -4.471 794 H VAL 112 H VAL 112 -1.782 22.330 -7.972 795 HA VAL 112 HA VAL 112 -4.145 23.467 -9.321 796 HB VAL 112 HB VAL 112 -1.366 23.141 -10.462 797 HG11 VAL 112 1HG1 VAL 112 -3.072 22.869 -12.161 798 HG12 VAL 112 2HG1 VAL 112 -3.865 24.357 -11.638 799 HG13 VAL 112 3HG1 VAL 112 -2.260 24.421 -12.368 800 HG21 VAL 112 3HG2 VAL 112 -1.455 25.666 -10.510 801 HG22 VAL 112 1HG2 VAL 112 -2.858 25.549 -9.447 802 HG23 VAL 112 2HG2 VAL 112 -1.294 24.933 -8.914 803 H GLU 113 H GLU 113 -5.457 21.987 -10.143 804 HA GLU 113 HA GLU 113 -4.300 19.442 -11.076 805 HB2 GLU 113 1HB GLU 113 -6.704 18.573 -10.514 806 HB3 GLU 113 2HB GLU 113 -5.502 18.727 -9.241 807 HG2 GLU 113 1HG GLU 113 -6.526 20.563 -8.305 808 HG3 GLU 113 2HG GLU 113 -7.350 20.997 -9.802 809 H LEU 114 H LEU 114 -4.333 19.490 -13.228 810 HA LEU 114 HA LEU 114 -6.054 21.073 -14.792 811 HB2 LEU 114 1HB LEU 114 -4.048 18.974 -15.262 812 HB3 LEU 114 2HB LEU 114 -5.275 19.131 -16.517 813 HG LEU 114 HG LEU 114 -3.117 20.400 -16.877 814 HD11 LEU 114 1HD1 LEU 114 -4.564 21.262 -18.346 815 HD12 LEU 114 2HD1 LEU 114 -4.671 22.618 -17.225 816 HD13 LEU 114 3HD1 LEU 114 -5.872 21.329 -17.164 817 HD21 LEU 114 3HD2 LEU 114 -2.905 22.549 -15.722 818 HD22 LEU 114 1HD2 LEU 114 -2.799 21.194 -14.598 819 HD23 LEU 114 2HD2 LEU 114 -4.286 22.137 -14.704 820 H LEU 115 H LEU 115 -8.086 20.782 -15.428 821 HA LEU 115 HA LEU 115 -9.302 18.133 -15.026 822 HB2 LEU 115 1HB LEU 115 -10.407 20.917 -14.919 823 HB3 LEU 115 2HB LEU 115 -11.465 19.528 -15.160 824 HG LEU 115 HG LEU 115 -9.676 19.244 -12.866 825 HD11 LEU 115 1HD1 LEU 115 -10.213 21.030 -11.624 826 HD12 LEU 115 2HD1 LEU 115 -11.863 21.092 -12.241 827 HD13 LEU 115 3HD1 LEU 115 -10.545 21.798 -13.176 828 HD21 LEU 115 3HD2 LEU 115 -11.775 17.911 -13.618 829 HD22 LEU 115 1HD2 LEU 115 -12.665 19.213 -12.828 830 HD23 LEU 115 2HD2 LEU 115 -11.522 18.240 -11.903 831 H ASP 116 H ASP 116 -8.888 20.774 -17.298 832 HA ASP 116 HA ASP 116 -9.224 19.071 -19.540 833 HB2 ASP 116 1HB ASP 116 -11.635 19.656 -18.616 834 HB3 ASP 116 2HB ASP 116 -11.359 21.160 -19.490 835 H VAL 117 H VAL 117 -9.143 20.322 -21.616 836 HA VAL 117 HA VAL 117 -7.410 22.658 -21.241 837 HB VAL 117 HB VAL 117 -7.833 20.932 -23.685 838 HG11 VAL 117 1HG1 VAL 117 -6.511 23.512 -23.281 839 HG12 VAL 117 2HG1 VAL 117 -5.505 22.299 -24.076 840 HG13 VAL 117 3HG1 VAL 117 -7.068 22.740 -24.766 841 HG21 VAL 117 3HG2 VAL 117 -6.286 19.568 -22.857 842 HG22 VAL 117 1HG2 VAL 117 -5.165 20.916 -22.667 843 HG23 VAL 117 2HG2 VAL 117 -6.281 20.507 -21.365 844 H11 L2S 130 1H1 L2S 130 -4.819 31.585 -9.347 845 H21 L2S 130 2H1 L2S 130 -5.087 32.259 -11.027 846 H12 L2S 130 1H2 L2S 130 -4.679 34.477 -10.217 847 H22 L2S 130 2H2 L2S 130 -3.241 33.404 -9.859 848 H13 L2S 130 2H3 L2S 130 -4.005 33.188 -7.583 849 H23 L2S 130 1H3 L2S 130 -3.895 34.966 -7.983 850 H14 L2S 130 1H4 L2S 130 -6.596 32.214 -7.548 851 H24 L2S 130 2H4 L2S 130 -7.794 33.498 -8.046 852 H15 L2S 130 1H5 L2S 130 -7.223 31.836 -9.851 853 H25 L2S 130 2H5 L2S 130 -6.905 33.601 -10.220 854 H17 L2S 130 1H7 L2S 130 -8.216 35.339 -7.415 855 H27 L2S 130 2H7 L2S 130 -7.942 34.624 -5.738 856 H9 L2S 130 H9 L2S 130 -6.029 38.682 -4.452 857 H10 L2S 130 H10 L2S 130 -4.904 38.438 -2.238 858 H112 L2S 130 1H12 L2S 130 -7.414 34.973 -1.354 859 H113 L2S 130 1H13 L2S 130 -8.489 35.201 -3.585 860 H114 L2S 130 1H14 L2S 130 -5.768 37.369 0.234 861 H214 L2S 130 2H14 L2S 130 -4.383 36.577 -0.555 862 H314 L2S 130 3H14 L2S 130 -5.787 35.589 -0.021 Start of MODEL 13 1 H1 GLY 1 H GLY 1 7.314 4.096 -16.554 2 HA2 GLY 1 1HA GLY 1 7.545 2.536 -14.197 3 HA3 GLY 1 2HA GLY 1 8.751 3.656 -14.815 4 HA PRO 2 HA PRO 2 5.794 6.261 -12.002 5 HB2 PRO 2 1HB PRO 2 4.017 4.862 -10.500 6 HB3 PRO 2 2HB PRO 2 3.640 5.468 -12.118 7 HG2 PRO 2 1HG PRO 2 4.468 2.719 -11.270 8 HG3 PRO 2 2HG PRO 2 3.211 3.203 -12.423 9 HD2 PRO 2 1HD PRO 2 5.656 2.347 -13.209 10 HD3 PRO 2 2HD PRO 2 4.728 3.552 -14.123 11 H GLY 3 H GLY 3 5.403 6.323 -9.477 12 HA2 GLY 3 1HA GLY 3 6.093 5.516 -7.330 13 HA3 GLY 3 2HA GLY 3 7.380 4.618 -8.121 14 H SER 4 H SER 4 8.456 6.627 -9.729 15 HA SER 4 HA SER 4 10.292 7.824 -8.043 16 HB2 SER 4 1HB SER 4 9.544 9.192 -10.602 17 HB3 SER 4 2HB SER 4 11.143 8.892 -9.921 18 HG SER 4 HG SER 4 10.543 6.570 -10.320 19 H MET 5 H MET 5 10.447 9.734 -6.972 20 HA MET 5 HA MET 5 8.392 11.765 -7.315 21 HB2 MET 5 1HB MET 5 8.672 10.039 -4.909 22 HB3 MET 5 2HB MET 5 8.341 11.746 -4.645 23 HG2 MET 5 1HG MET 5 6.296 11.634 -5.807 24 HG3 MET 5 2HG MET 5 6.680 10.051 -6.479 25 HE1 MET 5 3HE MET 5 3.879 8.764 -4.552 26 HE2 MET 5 1HE MET 5 3.666 10.515 -4.515 27 HE3 MET 5 2HE MET 5 4.325 9.737 -5.955 28 H THR 6 H THR 6 9.405 13.646 -7.442 29 HA THR 6 HA THR 6 11.524 14.308 -5.571 30 HB THR 6 HB THR 6 12.873 13.346 -7.297 31 HG1 THR 6 HG1 THR 6 14.151 15.019 -7.160 32 HG21 THR 6 3HG2 THR 6 11.508 13.217 -9.191 33 HG22 THR 6 1HG2 THR 6 12.731 14.404 -9.643 34 HG23 THR 6 2HG2 THR 6 11.124 14.937 -9.147 35 H VAL 7 H VAL 7 11.950 16.554 -5.430 36 HA VAL 7 HA VAL 7 9.951 18.250 -6.781 37 HB VAL 7 HB VAL 7 11.070 18.704 -4.013 38 HG11 VAL 7 1HG1 VAL 7 9.243 20.198 -5.806 39 HG12 VAL 7 2HG1 VAL 7 8.851 20.171 -4.086 40 HG13 VAL 7 3HG1 VAL 7 10.411 20.792 -4.627 41 HG21 VAL 7 3HG2 VAL 7 8.585 17.325 -4.951 42 HG22 VAL 7 1HG2 VAL 7 9.726 16.844 -3.695 43 HG23 VAL 7 2HG2 VAL 7 8.605 18.174 -3.405 44 H VAL 8 H VAL 8 11.053 19.304 -8.319 45 HA VAL 8 HA VAL 8 13.726 20.344 -7.714 46 HB VAL 8 HB VAL 8 13.572 19.082 -9.777 47 HG11 VAL 8 1HG1 VAL 8 11.076 20.432 -10.032 48 HG12 VAL 8 2HG1 VAL 8 12.058 20.781 -11.456 49 HG13 VAL 8 3HG1 VAL 8 11.722 19.109 -11.003 50 HG21 VAL 8 3HG2 VAL 8 15.004 21.170 -9.590 51 HG22 VAL 8 1HG2 VAL 8 14.645 20.606 -11.222 52 HG23 VAL 8 2HG2 VAL 8 13.769 21.981 -10.552 53 H THR 9 H THR 9 14.247 22.508 -7.886 54 HA THR 9 HA THR 9 11.950 24.343 -7.856 55 HB THR 9 HB THR 9 14.746 24.866 -6.833 56 HG1 THR 9 HG1 THR 9 13.595 23.222 -5.640 57 HG21 THR 9 3HG2 THR 9 13.157 26.570 -5.499 58 HG22 THR 9 1HG2 THR 9 12.253 26.451 -7.008 59 HG23 THR 9 2HG2 THR 9 13.935 26.979 -7.028 60 H THR 10 H THR 10 12.017 26.296 -9.011 61 HA THR 10 HA THR 10 13.433 26.132 -11.511 62 HB THR 10 HB THR 10 12.225 28.148 -12.141 63 HG1 THR 10 HG1 THR 10 11.807 28.296 -9.375 64 HG21 THR 10 3HG2 THR 10 9.965 26.930 -10.817 65 HG22 THR 10 1HG2 THR 10 11.057 25.704 -11.459 66 HG23 THR 10 2HG2 THR 10 10.389 26.938 -12.528 67 H GLU 11 H GLU 11 14.155 28.557 -12.264 68 HA GLU 11 HA GLU 11 16.522 29.056 -10.694 69 HB2 GLU 11 1HB GLU 11 15.482 29.994 -13.337 70 HB3 GLU 11 2HB GLU 11 16.764 30.906 -12.551 71 HG2 GLU 11 1HG GLU 11 18.141 28.880 -12.470 72 HG3 GLU 11 2HG GLU 11 16.861 27.991 -13.294 73 H SER 12 H SER 12 13.408 30.515 -11.161 74 HA SER 12 HA SER 12 14.174 33.028 -9.942 75 HB2 SER 12 1HB SER 12 12.371 32.657 -11.777 76 HB3 SER 12 2HB SER 12 11.334 32.170 -10.435 77 HG SER 12 HG SER 12 12.346 34.674 -11.092 78 H GLY 13 H GLY 13 12.715 30.009 -9.006 79 HA2 GLY 13 1HA GLY 13 13.136 29.680 -6.500 80 HA3 GLY 13 2HA GLY 13 12.127 31.110 -6.335 81 H LEU 14 H LEU 14 10.492 30.139 -8.686 82 HA LEU 14 HA LEU 14 8.365 29.037 -7.319 83 HB2 LEU 14 1HB LEU 14 7.896 29.930 -9.419 84 HB3 LEU 14 2HB LEU 14 9.163 28.989 -10.204 85 HG LEU 14 HG LEU 14 7.792 26.954 -9.896 86 HD11 LEU 14 1HD1 LEU 14 6.399 28.522 -8.071 87 HD12 LEU 14 2HD1 LEU 14 5.976 26.900 -8.619 88 HD13 LEU 14 3HD1 LEU 14 5.289 28.310 -9.425 89 HD21 LEU 14 3HD2 LEU 14 7.038 29.273 -11.543 90 HD22 LEU 14 1HD2 LEU 14 5.809 28.018 -11.390 91 HD23 LEU 14 2HD2 LEU 14 7.408 27.614 -12.014 92 H LYS 15 H LYS 15 7.618 26.993 -6.907 93 HA LYS 15 HA LYS 15 9.307 24.729 -7.704 94 HB2 LYS 15 1HB LYS 15 8.444 25.459 -4.914 95 HB3 LYS 15 2HB LYS 15 8.856 23.804 -5.345 96 HG2 LYS 15 1HG LYS 15 11.092 24.451 -5.927 97 HG3 LYS 15 2HG LYS 15 10.701 26.157 -5.695 98 HD2 LYS 15 1HD LYS 15 10.285 24.249 -3.439 99 HD3 LYS 15 2HD LYS 15 11.922 24.792 -3.814 100 HE2 LYS 15 1HE LYS 15 11.225 26.357 -2.260 101 HE3 LYS 15 2HE LYS 15 10.870 27.162 -3.787 102 HZ1 LYS 15 3HZ LYS 15 9.113 26.740 -1.744 103 HZ2 LYS 15 1HZ LYS 15 8.688 25.558 -2.877 104 HZ3 LYS 15 2HZ LYS 15 8.710 27.188 -3.325 105 H TYR 16 H TYR 16 8.213 22.623 -7.417 106 HA TYR 16 HA TYR 16 5.334 22.654 -7.144 107 HB2 TYR 16 1HB TYR 16 5.097 21.480 -9.414 108 HB3 TYR 16 2HB TYR 16 5.332 23.224 -9.427 109 HD1 TYR 16 HD1 TYR 16 7.249 20.034 -9.677 110 HD2 TYR 16 HD2 TYR 16 6.998 24.142 -10.759 111 HE1 TYR 16 HE1 TYR 16 9.189 19.755 -11.164 112 HE2 TYR 16 HE2 TYR 16 8.936 23.873 -12.250 113 HH TYR 16 HH TYR 16 9.971 21.662 -13.543 114 H GLU 17 H GLU 17 4.452 20.617 -6.769 115 HA GLU 17 HA GLU 17 6.326 18.356 -6.710 116 HB2 GLU 17 1HB GLU 17 6.244 19.259 -4.446 117 HB3 GLU 17 2HB GLU 17 4.488 19.185 -4.458 118 HG2 GLU 17 1HG GLU 17 4.493 16.822 -4.433 119 HG3 GLU 17 2HG GLU 17 6.220 16.753 -4.779 120 H ASP 18 H ASP 18 5.523 16.738 -7.853 121 HA ASP 18 HA ASP 18 2.980 16.638 -8.957 122 HB2 ASP 18 1HB ASP 18 3.481 14.192 -9.341 123 HB3 ASP 18 2HB ASP 18 4.711 15.310 -9.924 124 H LEU 19 H LEU 19 1.045 15.811 -8.356 125 HA LEU 19 HA LEU 19 0.883 14.563 -5.692 126 HB2 LEU 19 1HB LEU 19 -0.500 16.876 -6.812 127 HB3 LEU 19 2HB LEU 19 -1.592 15.681 -6.115 128 HG LEU 19 HG LEU 19 -0.368 15.844 -3.981 129 HD11 LEU 19 1HD1 LEU 19 1.256 17.607 -3.632 130 HD12 LEU 19 2HD1 LEU 19 1.128 18.091 -5.323 131 HD13 LEU 19 3HD1 LEU 19 1.805 16.516 -4.906 132 HD21 LEU 19 3HD2 LEU 19 -0.960 18.664 -4.416 133 HD22 LEU 19 1HD2 LEU 19 -1.726 17.496 -3.338 134 HD23 LEU 19 2HD2 LEU 19 -2.214 17.586 -5.031 135 H THR 20 H THR 20 -0.393 14.722 -8.960 136 HA THR 20 HA THR 20 -1.272 11.963 -8.742 137 HB THR 20 HB THR 20 -3.238 14.022 -9.740 138 HG1 THR 20 HG1 THR 20 -4.208 13.939 -7.744 139 HG21 THR 20 3HG2 THR 20 -3.832 11.966 -10.647 140 HG22 THR 20 1HG2 THR 20 -4.784 12.016 -9.164 141 HG23 THR 20 2HG2 THR 20 -3.296 11.071 -9.226 142 H GLU 21 H GLU 21 -0.369 11.012 -10.438 143 HA GLU 21 HA GLU 21 0.609 12.371 -12.699 144 HB2 GLU 21 1HB GLU 21 1.268 10.059 -11.745 145 HB3 GLU 21 2HB GLU 21 -0.068 9.443 -12.706 146 HG2 GLU 21 1HG GLU 21 0.951 10.053 -14.723 147 HG3 GLU 21 2HG GLU 21 2.107 11.111 -13.916 148 H GLY 22 H GLY 22 -0.326 12.992 -14.542 149 HA2 GLY 22 1HA GLY 22 -3.064 12.016 -15.078 150 HA3 GLY 22 2HA GLY 22 -2.507 13.638 -15.465 151 H SER 23 H SER 23 -3.580 11.233 -17.047 152 HA SER 23 HA SER 23 -1.481 11.292 -19.115 153 HB2 SER 23 1HB SER 23 -1.774 9.054 -17.952 154 HB3 SER 23 2HB SER 23 -3.382 8.984 -18.673 155 HG SER 23 HG SER 23 -2.309 8.096 -20.262 156 H GLY 24 H GLY 24 -2.621 13.165 -19.942 157 HA2 GLY 24 1HA GLY 24 -4.776 12.352 -21.747 158 HA3 GLY 24 2HA GLY 24 -5.106 13.679 -20.643 159 H ALA 25 H ALA 25 -4.222 15.686 -21.021 160 HA ALA 25 HA ALA 25 -2.413 16.001 -23.295 161 HB1 ALA 25 1HB ALA 25 -3.766 17.503 -24.480 162 HB2 ALA 25 2HB ALA 25 -4.848 16.182 -24.036 163 HB3 ALA 25 3HB ALA 25 -4.886 17.695 -23.131 164 H GLU 26 H GLU 26 -0.967 17.615 -23.033 165 HA GLU 26 HA GLU 26 -0.939 18.992 -20.492 166 HB2 GLU 26 1HB GLU 26 1.144 18.083 -21.304 167 HB3 GLU 26 2HB GLU 26 0.997 18.977 -22.811 168 HG2 GLU 26 1HG GLU 26 1.193 21.082 -21.556 169 HG3 GLU 26 2HG GLU 26 1.411 20.155 -20.073 170 H ALA 27 H ALA 27 -1.454 21.060 -20.119 171 HA ALA 27 HA ALA 27 -3.005 22.564 -21.839 172 HB1 ALA 27 1HB ALA 27 -1.387 24.167 -19.993 173 HB2 ALA 27 2HB ALA 27 -3.139 24.025 -20.141 174 HB3 ALA 27 3HB ALA 27 -2.229 22.809 -19.245 175 H ARG 28 H ARG 28 -2.539 23.495 -23.710 176 HA ARG 28 HA ARG 28 0.215 24.080 -24.414 177 HB2 ARG 28 1HB ARG 28 -2.382 24.044 -25.923 178 HB3 ARG 28 2HB ARG 28 -0.952 24.796 -26.617 179 HG2 ARG 28 1HG ARG 28 -1.156 21.931 -25.713 180 HG3 ARG 28 2HG ARG 28 -1.246 22.495 -27.383 181 HD2 ARG 28 1HD ARG 28 1.098 23.564 -26.137 182 HD3 ARG 28 2HD ARG 28 1.050 21.818 -25.893 183 HE ARG 28 HE ARG 28 0.463 22.293 -28.566 184 HH11 ARG 28 1HH1 ARG 28 3.124 22.744 -26.368 185 HH12 ARG 28 2HH1 ARG 28 4.336 22.591 -27.598 186 HH21 ARG 28 1HH2 ARG 28 2.048 22.090 -30.194 187 HH22 ARG 28 2HH2 ARG 28 3.722 22.220 -29.774 188 H ALA 29 H ALA 29 0.894 26.137 -25.240 189 HA ALA 29 HA ALA 29 -0.093 28.326 -23.672 190 HB1 ALA 29 1HB ALA 29 1.816 28.829 -25.879 191 HB2 ALA 29 2HB ALA 29 1.835 29.396 -24.208 192 HB3 ALA 29 3HB ALA 29 2.341 27.749 -24.587 193 H GLY 30 H GLY 30 -1.326 30.032 -24.284 194 HA2 GLY 30 1HA GLY 30 -2.485 31.469 -25.697 195 HA3 GLY 30 2HA GLY 30 -1.864 30.571 -27.074 196 H GLN 31 H GLN 31 -3.103 28.370 -24.944 197 HA GLN 31 HA GLN 31 -5.716 28.388 -26.306 198 HB2 GLN 31 1HB GLN 31 -4.008 26.495 -26.785 199 HB3 GLN 31 2HB GLN 31 -4.448 25.906 -25.187 200 HG2 GLN 31 1HG GLN 31 -6.668 25.503 -25.827 201 HG3 GLN 31 2HG GLN 31 -6.505 26.464 -27.296 202 HE21 GLN 31 2HE2 GLN 31 -5.598 23.468 -25.724 203 HE22 GLN 31 1HE2 GLN 31 -5.235 22.596 -27.170 204 H THR 32 H THR 32 -7.556 27.944 -25.116 205 HA THR 32 HA THR 32 -7.428 28.621 -22.337 206 HB THR 32 HB THR 32 -9.873 27.541 -23.723 207 HG1 THR 32 HG1 THR 32 -8.962 30.243 -23.773 208 HG21 THR 32 3HG2 THR 32 -9.395 29.468 -21.453 209 HG22 THR 32 1HG2 THR 32 -10.171 27.887 -21.378 210 HG23 THR 32 2HG2 THR 32 -10.970 29.222 -22.208 211 H VAL 33 H VAL 33 -8.255 27.337 -20.589 212 HA VAL 33 HA VAL 33 -8.729 24.531 -20.926 213 HB VAL 33 HB VAL 33 -6.321 24.441 -21.114 214 HG11 VAL 33 1HG1 VAL 33 -6.206 25.863 -18.456 215 HG12 VAL 33 2HG1 VAL 33 -4.833 25.292 -19.407 216 HG13 VAL 33 3HG1 VAL 33 -5.848 26.600 -20.017 217 HG21 VAL 33 3HG2 VAL 33 -5.916 22.780 -19.541 218 HG22 VAL 33 1HG2 VAL 33 -6.857 23.596 -18.292 219 HG23 VAL 33 2HG2 VAL 33 -7.677 22.804 -19.637 220 H SER 34 H SER 34 -9.700 23.626 -19.151 221 HA SER 34 HA SER 34 -10.320 25.485 -16.970 222 HB2 SER 34 1HB SER 34 -11.785 22.945 -17.025 223 HB3 SER 34 2HB SER 34 -12.396 24.596 -16.927 224 HG SER 34 HG SER 34 -11.662 23.129 -19.232 225 H VAL 35 H VAL 35 -9.366 25.242 -15.070 226 HA VAL 35 HA VAL 35 -8.641 22.558 -14.149 227 HB VAL 35 HB VAL 35 -6.428 23.113 -13.559 228 HG11 VAL 35 1HG1 VAL 35 -6.511 24.556 -16.159 229 HG12 VAL 35 2HG1 VAL 35 -5.442 23.260 -15.618 230 HG13 VAL 35 3HG1 VAL 35 -7.100 22.895 -16.100 231 HG21 VAL 35 3HG2 VAL 35 -6.153 25.166 -12.699 232 HG22 VAL 35 1HG2 VAL 35 -5.804 25.651 -14.358 233 HG23 VAL 35 2HG2 VAL 35 -7.427 25.860 -13.702 234 H HIS 36 H HIS 36 -8.172 22.480 -11.827 235 HA HIS 36 HA HIS 36 -9.786 24.463 -10.384 236 HB2 HIS 36 1HB HIS 36 -9.211 21.570 -9.995 237 HB3 HIS 36 2HB HIS 36 -9.461 22.546 -8.550 238 HD1 HIS 36 HD1 HIS 36 -11.680 24.395 -9.932 239 HD2 HIS 36 HD2 HIS 36 -11.641 20.244 -9.779 240 HE1 HIS 36 HE1 HIS 36 -14.078 23.689 -10.209 241 H TYR 37 H TYR 37 -8.914 25.773 -8.896 242 HA TYR 37 HA TYR 37 -6.094 25.323 -8.165 243 HB2 TYR 37 1HB TYR 37 -5.800 27.722 -8.048 244 HB3 TYR 37 2HB TYR 37 -6.471 27.305 -9.621 245 HD1 TYR 37 HD2 TYR 37 -7.295 28.714 -6.301 246 HD2 TYR 37 HD1 TYR 37 -8.565 28.164 -10.325 247 HE1 TYR 37 HE2 TYR 37 -9.130 30.310 -5.934 248 HE2 TYR 37 HE1 TYR 37 -10.403 29.760 -9.969 249 HH TYR 37 HH TYR 37 -11.036 31.546 -8.523 250 H THR 38 H THR 38 -5.496 25.510 -6.049 251 HA THR 38 HA THR 38 -7.575 26.220 -4.096 252 HB THR 38 HB THR 38 -5.862 24.140 -3.055 253 HG1 THR 38 HG1 THR 38 -6.483 22.474 -4.415 254 HG21 THR 38 3HG2 THR 38 -8.717 24.843 -3.205 255 HG22 THR 38 1HG2 THR 38 -7.769 24.236 -1.849 256 HG23 THR 38 2HG2 THR 38 -8.375 23.118 -3.071 257 H GLY 39 H GLY 39 -6.881 27.737 -2.743 258 HA2 GLY 39 1HA GLY 39 -4.014 28.278 -2.569 259 HA3 GLY 39 2HA GLY 39 -5.306 29.337 -2.023 260 H TRP 40 H TRP 40 -2.785 27.808 -0.869 261 HA TRP 40 HA TRP 40 -4.089 27.256 1.705 262 HB2 TRP 40 1HB TRP 40 -2.170 25.503 0.199 263 HB3 TRP 40 2HB TRP 40 -2.250 25.433 1.957 264 HD1 TRP 40 HD1 TRP 40 -5.337 25.559 2.437 265 HE1 TRP 40 HE1 TRP 40 -6.854 23.612 1.708 266 HE3 TRP 40 HE3 TRP 40 -2.299 23.436 -1.085 267 HZ2 TRP 40 HZ2 TRP 40 -6.774 21.461 -0.118 268 HZ3 TRP 40 HZ3 TRP 40 -3.094 21.436 -2.277 269 HH2 TRP 40 HH2 TRP 40 -5.285 20.470 -1.802 270 H LEU 41 H LEU 41 -3.067 28.070 3.456 271 HA LEU 41 HA LEU 41 -0.877 29.880 3.014 272 HB2 LEU 41 1HB LEU 41 -2.367 29.077 5.506 273 HB3 LEU 41 2HB LEU 41 -1.097 30.298 5.467 274 HG LEU 41 HG LEU 41 -3.794 30.434 4.126 275 HD11 LEU 41 1HD1 LEU 41 -3.253 30.936 6.693 276 HD12 LEU 41 2HD1 LEU 41 -4.437 31.854 5.764 277 HD13 LEU 41 3HD1 LEU 41 -2.812 32.497 6.000 278 HD21 LEU 41 3HD2 LEU 41 -2.111 31.413 2.670 279 HD22 LEU 41 1HD2 LEU 41 -1.488 32.376 4.010 280 HD23 LEU 41 2HD2 LEU 41 -3.113 32.674 3.391 281 H THR 42 H THR 42 0.913 29.871 4.781 282 HA THR 42 HA THR 42 2.544 27.641 4.351 283 HB THR 42 HB THR 42 4.059 28.574 5.997 284 HG1 THR 42 HG1 THR 42 3.320 30.445 7.214 285 HG21 THR 42 3HG2 THR 42 2.662 30.558 4.223 286 HG22 THR 42 1HG2 THR 42 4.199 29.735 3.957 287 HG23 THR 42 2HG2 THR 42 4.076 31.000 5.180 288 H ASP 43 H ASP 43 0.041 28.168 6.640 289 HA ASP 43 HA ASP 43 0.968 26.023 8.392 290 HB2 ASP 43 1HB ASP 43 0.001 28.160 9.315 291 HB3 ASP 43 2HB ASP 43 -1.553 27.671 8.644 292 H GLY 44 H GLY 44 -1.169 26.555 5.763 293 HA2 GLY 44 1HA GLY 44 -1.886 24.489 4.618 294 HA3 GLY 44 2HA GLY 44 -2.341 23.877 6.201 295 H GLN 45 H GLN 45 -3.287 26.802 6.695 296 HA GLN 45 HA GLN 45 -6.002 26.379 6.452 297 HB2 GLN 45 1HB GLN 45 -4.929 28.168 7.810 298 HB3 GLN 45 2HB GLN 45 -4.616 29.062 6.329 299 HG2 GLN 45 1HG GLN 45 -6.597 29.856 7.572 300 HG3 GLN 45 2HG GLN 45 -6.955 29.341 5.925 301 HE21 GLN 45 2HE2 GLN 45 -7.565 28.859 9.249 302 HE22 GLN 45 1HE2 GLN 45 -8.704 27.570 9.090 303 H LYS 46 H LYS 46 -7.467 26.519 4.866 304 HA LYS 46 HA LYS 46 -6.518 27.124 2.180 305 HB2 LYS 46 1HB LYS 46 -8.009 25.101 2.946 306 HB3 LYS 46 2HB LYS 46 -9.320 26.263 2.791 307 HG2 LYS 46 1HG LYS 46 -8.856 26.588 0.474 308 HG3 LYS 46 2HG LYS 46 -7.373 25.637 0.585 309 HD2 LYS 46 1HD LYS 46 -9.167 24.333 -0.427 310 HD3 LYS 46 2HD LYS 46 -8.694 23.646 1.129 311 HE2 LYS 46 1HE LYS 46 -10.911 25.627 1.082 312 HE3 LYS 46 2HE LYS 46 -11.234 24.006 0.469 313 HZ1 LYS 46 3HZ LYS 46 -9.834 23.843 2.914 314 HZ2 LYS 46 1HZ LYS 46 -11.373 23.254 2.531 315 HZ3 LYS 46 2HZ LYS 46 -11.193 24.832 3.113 316 H PHE 47 H PHE 47 -6.975 28.936 1.102 317 HA PHE 47 HA PHE 47 -9.102 30.683 2.149 318 HB2 PHE 47 1HB PHE 47 -7.690 32.625 1.472 319 HB3 PHE 47 2HB PHE 47 -6.983 31.664 2.768 320 HD1 PHE 47 HD2 PHE 47 -6.784 32.470 -0.818 321 HD2 PHE 47 HD1 PHE 47 -4.919 30.532 2.481 322 HE1 PHE 47 HE2 PHE 47 -4.721 32.222 -2.135 323 HE2 PHE 47 HE1 PHE 47 -2.852 30.281 1.170 324 HZ PHE 47 HZ PHE 47 -2.752 31.126 -1.142 325 H ASP 48 H ASP 48 -8.805 28.680 -0.142 326 HA ASP 48 HA ASP 48 -10.479 29.952 -1.980 327 HB2 ASP 48 1HB ASP 48 -7.785 30.714 -2.316 328 HB3 ASP 48 2HB ASP 48 -8.138 29.581 -3.617 329 H SER 49 H SER 49 -11.554 28.372 -2.960 330 HA SER 49 HA SER 49 -10.200 25.989 -3.894 331 HB2 SER 49 1HB SER 49 -11.513 24.413 -2.625 332 HB3 SER 49 2HB SER 49 -10.751 25.525 -1.488 333 HG SER 49 HG SER 49 -12.721 25.774 -0.792 334 H SER 50 H SER 50 -10.897 26.013 -5.932 335 HA SER 50 HA SER 50 -13.422 27.042 -6.734 336 HB2 SER 50 1HB SER 50 -11.221 25.545 -8.128 337 HB3 SER 50 2HB SER 50 -12.757 25.831 -8.945 338 HG SER 50 HG SER 50 -11.139 27.853 -7.782 339 H LYS 51 H LYS 51 -12.333 23.952 -5.675 340 HA LYS 51 HA LYS 51 -14.148 22.238 -6.908 341 HB2 LYS 51 1HB LYS 51 -12.558 22.185 -4.401 342 HB3 LYS 51 2HB LYS 51 -13.892 21.044 -4.516 343 HG2 LYS 51 1HG LYS 51 -11.792 20.050 -5.247 344 HG3 LYS 51 2HG LYS 51 -12.962 20.131 -6.567 345 HD2 LYS 51 1HD LYS 51 -10.853 20.804 -7.448 346 HD3 LYS 51 2HD LYS 51 -11.843 22.258 -7.297 347 HE2 LYS 51 1HE LYS 51 -9.519 22.591 -6.530 348 HE3 LYS 51 2HE LYS 51 -10.708 22.871 -5.259 349 HZ1 LYS 51 3HZ LYS 51 -10.169 20.864 -4.222 350 HZ2 LYS 51 1HZ LYS 51 -8.670 21.515 -4.660 351 HZ3 LYS 51 2HZ LYS 51 -9.348 20.263 -5.574 352 H ASP 52 H ASP 52 -14.633 24.589 -4.427 353 HA ASP 52 HA ASP 52 -17.086 23.495 -3.423 354 HB2 ASP 52 1HB ASP 52 -15.626 24.983 -2.075 355 HB3 ASP 52 2HB ASP 52 -16.007 26.310 -3.169 356 H ARG 53 H ARG 53 -16.185 25.898 -5.832 357 HA ARG 53 HA ARG 53 -18.811 26.875 -6.295 358 HB2 ARG 53 1HB ARG 53 -16.460 27.849 -6.958 359 HB3 ARG 53 2HB ARG 53 -16.711 26.911 -8.424 360 HG2 ARG 53 1HG ARG 53 -18.624 28.150 -9.013 361 HG3 ARG 53 2HG ARG 53 -18.739 28.877 -7.409 362 HD2 ARG 53 1HD ARG 53 -16.421 29.318 -9.282 363 HD3 ARG 53 2HD ARG 53 -17.829 30.377 -9.209 364 HE ARG 53 HE ARG 53 -16.815 30.114 -6.623 365 HH11 ARG 53 1HH1 ARG 53 -15.872 31.445 -9.699 366 HH12 ARG 53 2HH1 ARG 53 -14.879 32.684 -9.006 367 HH21 ARG 53 1HH2 ARG 53 -15.510 31.741 -5.699 368 HH22 ARG 53 2HH2 ARG 53 -14.673 32.851 -6.730 369 H ASN 54 H ASN 54 -17.344 23.940 -7.035 370 HA ASN 54 HA ASN 54 -17.952 22.146 -8.293 371 HB2 ASN 54 1HB ASN 54 -20.510 23.650 -7.977 372 HB3 ASN 54 2HB ASN 54 -20.467 22.322 -9.132 373 HD21 ASN 54 2HD2 ASN 54 -22.031 22.429 -6.776 374 HD22 ASN 54 1HD2 ASN 54 -21.510 21.147 -5.742 375 H ASP 55 H ASP 55 -16.848 24.609 -9.551 376 HA ASP 55 HA ASP 55 -17.396 23.837 -12.308 377 HB2 ASP 55 1HB ASP 55 -18.861 25.851 -11.523 378 HB3 ASP 55 2HB ASP 55 -17.363 26.767 -11.665 379 HA PRO 56 HA PRO 56 -12.986 24.215 -12.375 380 HB2 PRO 56 1HB PRO 56 -12.660 23.839 -15.043 381 HB3 PRO 56 2HB PRO 56 -13.028 22.520 -13.925 382 HG2 PRO 56 1HG PRO 56 -14.868 24.041 -15.731 383 HG3 PRO 56 2HG PRO 56 -14.802 22.298 -15.411 384 HD2 PRO 56 1HD PRO 56 -16.623 23.926 -14.242 385 HD3 PRO 56 2HD PRO 56 -15.965 22.490 -13.431 386 H PHE 57 H PHE 57 -11.427 25.720 -12.945 387 HA PHE 57 HA PHE 57 -12.455 28.290 -13.823 388 HB2 PHE 57 1HB PHE 57 -11.011 28.279 -11.876 389 HB3 PHE 57 2HB PHE 57 -9.742 27.458 -12.779 390 HD1 PHE 57 HD2 PHE 57 -11.861 30.502 -13.231 391 HD2 PHE 57 HD1 PHE 57 -7.969 28.783 -13.343 392 HE1 PHE 57 HE2 PHE 57 -10.921 32.681 -13.879 393 HE2 PHE 57 HE1 PHE 57 -7.022 30.959 -13.991 394 HZ PHE 57 HZ PHE 57 -8.498 32.912 -14.261 395 H ALA 58 H ALA 58 -12.686 28.418 -15.981 396 HA ALA 58 HA ALA 58 -10.662 27.297 -17.747 397 HB1 ALA 58 1HB ALA 58 -13.372 28.504 -18.199 398 HB2 ALA 58 2HB ALA 58 -12.265 28.182 -19.534 399 HB3 ALA 58 3HB ALA 58 -12.827 26.856 -18.516 400 H PHE 59 H PHE 59 -8.915 28.473 -18.163 401 HA PHE 59 HA PHE 59 -9.255 31.324 -18.769 402 HB2 PHE 59 1HB PHE 59 -7.441 31.996 -17.429 403 HB3 PHE 59 2HB PHE 59 -8.342 30.877 -16.410 404 HD1 PHE 59 HD2 PHE 59 -7.457 28.671 -15.899 405 HD2 PHE 59 HD1 PHE 59 -5.258 31.443 -18.265 406 HE1 PHE 59 HE2 PHE 59 -5.421 27.329 -15.573 407 HE2 PHE 59 HE1 PHE 59 -3.219 30.105 -17.944 408 HZ PHE 59 HZ PHE 59 -3.298 28.046 -16.595 409 H VAL 60 H VAL 60 -7.321 32.227 -19.919 410 HA VAL 60 HA VAL 60 -6.495 30.335 -21.972 411 HB VAL 60 HB VAL 60 -5.943 33.301 -21.863 412 HG11 VAL 60 1HG1 VAL 60 -4.781 31.489 -23.460 413 HG12 VAL 60 2HG1 VAL 60 -6.227 31.833 -24.411 414 HG13 VAL 60 3HG1 VAL 60 -5.130 33.141 -23.968 415 HG21 VAL 60 3HG2 VAL 60 -8.408 31.840 -22.427 416 HG22 VAL 60 1HG2 VAL 60 -8.157 33.551 -22.080 417 HG23 VAL 60 2HG2 VAL 60 -7.930 32.941 -23.719 418 H LEU 61 H LEU 61 -4.576 29.379 -21.977 419 HA LEU 61 HA LEU 61 -2.674 29.582 -19.994 420 HB2 LEU 61 1HB LEU 61 -3.011 27.954 -22.083 421 HB3 LEU 61 2HB LEU 61 -1.702 28.947 -22.720 422 HG LEU 61 HG LEU 61 -0.573 27.158 -21.793 423 HD11 LEU 61 1HD1 LEU 61 -0.752 29.099 -19.494 424 HD12 LEU 61 2HD1 LEU 61 0.261 29.310 -20.922 425 HD13 LEU 61 3HD1 LEU 61 0.559 27.964 -19.821 426 HD21 LEU 61 3HD2 LEU 61 -2.423 26.018 -20.771 427 HD22 LEU 61 1HD2 LEU 61 -2.543 27.249 -19.513 428 HD23 LEU 61 2HD2 LEU 61 -1.136 26.187 -19.576 429 H GLY 62 H GLY 62 -1.367 31.179 -19.415 430 HA2 GLY 62 1HA GLY 62 -0.118 33.106 -19.500 431 HA3 GLY 62 2HA GLY 62 0.476 32.461 -21.023 432 H GLY 63 H GLY 63 -2.170 34.339 -19.589 433 HA2 GLY 63 1HA GLY 63 -2.344 35.812 -22.144 434 HA3 GLY 63 2HA GLY 63 -3.779 35.368 -21.232 435 H GLY 64 H GLY 64 -1.083 36.231 -19.324 436 HA2 GLY 64 1HA GLY 64 -0.530 38.145 -18.161 437 HA3 GLY 64 2HA GLY 64 -1.525 39.058 -19.285 438 H MET 65 H MET 65 -2.967 36.379 -17.661 439 HA MET 65 HA MET 65 -4.451 38.263 -15.951 440 HB2 MET 65 1HB MET 65 -5.640 36.903 -17.815 441 HB3 MET 65 2HB MET 65 -5.464 35.541 -16.716 442 HG2 MET 65 1HG MET 65 -7.601 36.378 -16.301 443 HG3 MET 65 2HG MET 65 -6.611 36.989 -14.978 444 HE1 MET 65 3HE MET 65 -8.307 38.652 -14.295 445 HE2 MET 65 1HE MET 65 -8.873 40.036 -15.231 446 HE3 MET 65 2HE MET 65 -9.490 38.422 -15.583 447 H VAL 66 H VAL 66 -2.543 35.377 -16.049 448 HA VAL 66 HA VAL 66 -3.027 34.917 -13.182 449 HB VAL 66 HB VAL 66 -2.157 32.691 -13.467 450 HG11 VAL 66 1HG1 VAL 66 -4.002 31.809 -14.448 451 HG12 VAL 66 2HG1 VAL 66 -4.538 33.489 -14.382 452 HG13 VAL 66 3HG1 VAL 66 -3.869 32.834 -15.877 453 HG21 VAL 66 3HG2 VAL 66 -1.737 32.077 -16.027 454 HG22 VAL 66 1HG2 VAL 66 -1.242 33.769 -16.071 455 HG23 VAL 66 2HG2 VAL 66 -0.448 32.646 -14.967 456 H ILE 67 H ILE 67 -0.914 33.787 -12.212 457 HA ILE 67 HA ILE 67 1.181 35.801 -12.488 458 HB ILE 67 HB ILE 67 2.013 35.106 -10.394 459 HG12 ILE 67 1HG1 ILE 67 0.282 32.645 -10.703 460 HG13 ILE 67 2HG1 ILE 67 2.040 32.704 -10.745 461 HG21 ILE 67 1HG2 ILE 67 -0.716 34.576 -9.563 462 HG22 ILE 67 2HG2 ILE 67 0.328 35.950 -9.205 463 HG23 ILE 67 3HG2 ILE 67 -0.608 35.920 -10.699 464 HD11 ILE 67 3HD1 ILE 67 1.360 33.852 -8.313 465 HD12 ILE 67 1HD1 ILE 67 0.257 32.488 -8.495 466 HD13 ILE 67 2HD1 ILE 67 2.000 32.232 -8.584 467 H LYS 68 H LYS 68 3.461 35.090 -12.415 468 HA LYS 68 HA LYS 68 4.190 33.538 -14.553 469 HB2 LYS 68 1HB LYS 68 6.422 33.282 -13.313 470 HB3 LYS 68 2HB LYS 68 5.861 34.914 -13.652 471 HG2 LYS 68 1HG LYS 68 4.807 34.232 -11.142 472 HG3 LYS 68 2HG LYS 68 6.489 33.697 -11.141 473 HD2 LYS 68 1HD LYS 68 5.499 36.463 -11.835 474 HD3 LYS 68 2HD LYS 68 6.307 35.992 -10.338 475 HE2 LYS 68 1HE LYS 68 7.454 36.053 -13.120 476 HE3 LYS 68 2HE LYS 68 7.941 37.020 -11.729 477 HZ1 LYS 68 3HZ LYS 68 8.254 34.486 -10.843 478 HZ2 LYS 68 1HZ LYS 68 9.493 35.461 -11.456 479 HZ3 LYS 68 2HZ LYS 68 8.714 34.350 -12.465 480 H GLY 69 H GLY 69 4.019 32.508 -11.148 481 HA2 GLY 69 1HA GLY 69 4.862 29.875 -11.483 482 HA3 GLY 69 2HA GLY 69 3.777 30.426 -10.215 483 H TRP 70 H TRP 70 1.708 31.309 -12.055 484 HA TRP 70 HA TRP 70 0.282 28.868 -12.281 485 HB2 TRP 70 1HB TRP 70 -0.295 31.658 -12.478 486 HB3 TRP 70 2HB TRP 70 -0.944 30.856 -13.906 487 HD1 TRP 70 HD1 TRP 70 -3.226 29.708 -13.623 488 HE1 TRP 70 HE1 TRP 70 -4.732 29.095 -11.628 489 HE3 TRP 70 HE3 TRP 70 -0.039 30.897 -9.806 490 HZ2 TRP 70 HZ2 TRP 70 -4.588 29.113 -8.809 491 HZ3 TRP 70 HZ3 TRP 70 -0.801 30.570 -7.489 492 HH2 TRP 70 HH2 TRP 70 -3.029 29.697 -7.003 493 H ASP 71 H ASP 71 1.438 31.129 -14.787 494 HA ASP 71 HA ASP 71 0.765 29.631 -17.014 495 HB2 ASP 71 1HB ASP 71 2.932 31.640 -16.488 496 HB3 ASP 71 2HB ASP 71 2.840 30.822 -18.045 497 H GLU 72 H GLU 72 3.779 29.558 -15.136 498 HA GLU 72 HA GLU 72 5.109 27.649 -16.710 499 HB2 GLU 72 1HB GLU 72 5.652 29.109 -14.375 500 HB3 GLU 72 2HB GLU 72 5.810 27.419 -13.917 501 HG2 GLU 72 1HG GLU 72 7.174 28.586 -16.324 502 HG3 GLU 72 2HG GLU 72 7.904 28.568 -14.719 503 H GLY 73 H GLY 73 3.000 27.302 -13.885 504 HA2 GLY 73 1HA GLY 73 3.320 24.529 -13.532 505 HA3 GLY 73 2HA GLY 73 1.939 25.473 -12.995 506 H VAL 74 H VAL 74 0.503 26.183 -14.967 507 HA VAL 74 HA VAL 74 -0.702 23.885 -15.987 508 HB VAL 74 HB VAL 74 -1.833 25.483 -17.612 509 HG11 VAL 74 1HG1 VAL 74 -3.371 25.887 -16.026 510 HG12 VAL 74 2HG1 VAL 74 -2.298 24.947 -14.987 511 HG13 VAL 74 3HG1 VAL 74 -2.218 26.710 -14.976 512 HG21 VAL 74 3HG2 VAL 74 -1.133 27.587 -17.857 513 HG22 VAL 74 1HG2 VAL 74 -1.013 27.828 -16.114 514 HG23 VAL 74 2HG2 VAL 74 0.328 27.100 -16.998 515 H GLN 75 H GLN 75 1.867 25.867 -17.269 516 HA GLN 75 HA GLN 75 1.830 25.203 -19.949 517 HB2 GLN 75 1HB GLN 75 3.850 26.122 -18.030 518 HB3 GLN 75 2HB GLN 75 4.517 25.227 -19.389 519 HG2 GLN 75 1HG GLN 75 3.508 26.749 -20.952 520 HG3 GLN 75 2HG GLN 75 2.680 27.595 -19.646 521 HE21 GLN 75 2HE2 GLN 75 3.758 29.466 -20.604 522 HE22 GLN 75 1HE2 GLN 75 5.374 29.834 -20.114 523 H GLY 76 H GLY 76 2.667 23.235 -17.218 524 HA2 GLY 76 1HA GLY 76 3.512 21.084 -19.059 525 HA3 GLY 76 2HA GLY 76 4.095 21.243 -17.409 526 H MET 77 H MET 77 1.298 22.007 -16.559 527 HA MET 77 HA MET 77 0.462 19.579 -15.554 528 HB2 MET 77 1HB MET 77 -0.310 21.950 -14.943 529 HB3 MET 77 2HB MET 77 -1.475 21.777 -16.249 530 HG2 MET 77 1HG MET 77 -2.600 21.212 -14.258 531 HG3 MET 77 2HG MET 77 -2.296 19.701 -15.111 532 HE1 MET 77 3HE MET 77 0.692 21.462 -12.628 533 HE2 MET 77 1HE MET 77 -0.893 22.220 -12.792 534 HE3 MET 77 2HE MET 77 -0.487 21.336 -11.321 535 H LYS 78 H LYS 78 -0.993 18.011 -16.163 536 HA LYS 78 HA LYS 78 -1.866 18.100 -18.977 537 HB2 LYS 78 1HB LYS 78 -1.218 15.650 -17.329 538 HB3 LYS 78 2HB LYS 78 -1.667 15.674 -19.029 539 HG2 LYS 78 1HG LYS 78 0.374 16.818 -19.600 540 HG3 LYS 78 2HG LYS 78 0.809 16.959 -17.895 541 HD2 LYS 78 1HD LYS 78 0.514 14.325 -17.990 542 HD3 LYS 78 2HD LYS 78 0.886 14.593 -19.694 543 HE2 LYS 78 1HE LYS 78 2.811 16.088 -18.596 544 HE3 LYS 78 2HE LYS 78 2.591 14.920 -17.294 545 HZ1 LYS 78 3HZ LYS 78 4.224 14.011 -18.675 546 HZ2 LYS 78 1HZ LYS 78 3.391 14.405 -20.094 547 HZ3 LYS 78 2HZ LYS 78 2.815 13.172 -19.091 548 H VAL 79 H VAL 79 -3.844 16.900 -19.471 549 HA VAL 79 HA VAL 79 -6.002 17.660 -17.892 550 HB VAL 79 HB VAL 79 -5.934 15.356 -19.846 551 HG11 VAL 79 1HG1 VAL 79 -7.934 15.225 -18.583 552 HG12 VAL 79 2HG1 VAL 79 -8.185 16.970 -18.668 553 HG13 VAL 79 3HG1 VAL 79 -8.363 15.980 -20.118 554 HG21 VAL 79 3HG2 VAL 79 -5.483 18.099 -20.298 555 HG22 VAL 79 1HG2 VAL 79 -5.736 16.830 -21.496 556 HG23 VAL 79 2HG2 VAL 79 -7.109 17.751 -20.884 557 H GLY 80 H GLY 80 -6.690 16.951 -15.988 558 HA2 GLY 80 1HA GLY 80 -7.417 15.402 -14.408 559 HA3 GLY 80 2HA GLY 80 -6.751 14.114 -15.403 560 H GLY 81 H GLY 81 -4.370 16.359 -15.155 561 HA2 GLY 81 1HA GLY 81 -3.002 14.779 -13.122 562 HA3 GLY 81 2HA GLY 81 -2.267 15.969 -14.186 563 H VAL 82 H VAL 82 -2.361 15.482 -11.157 564 HA VAL 82 HA VAL 82 -3.084 18.245 -10.422 565 HB VAL 82 HB VAL 82 -3.150 15.834 -8.603 566 HG11 VAL 82 1HG1 VAL 82 -4.649 18.112 -7.709 567 HG12 VAL 82 2HG1 VAL 82 -3.329 17.258 -6.907 568 HG13 VAL 82 3HG1 VAL 82 -2.978 18.574 -8.028 569 HG21 VAL 82 3HG2 VAL 82 -5.139 16.965 -10.424 570 HG22 VAL 82 1HG2 VAL 82 -5.081 15.383 -9.645 571 HG23 VAL 82 2HG2 VAL 82 -5.714 16.775 -8.767 572 H ARG 83 H ARG 83 -1.547 19.465 -9.501 573 HA ARG 83 HA ARG 83 0.781 18.206 -8.277 574 HB2 ARG 83 1HB ARG 83 1.321 18.543 -10.692 575 HB3 ARG 83 2HB ARG 83 1.061 20.268 -10.469 576 HG2 ARG 83 1HG ARG 83 2.900 20.377 -8.901 577 HG3 ARG 83 2HG ARG 83 3.130 18.631 -9.018 578 HD2 ARG 83 1HD ARG 83 3.488 20.656 -11.222 579 HD3 ARG 83 2HD ARG 83 4.761 19.759 -10.397 580 HE ARG 83 HE ARG 83 2.981 17.921 -11.523 581 HH11 ARG 83 1HH1 ARG 83 5.296 20.321 -12.525 582 HH12 ARG 83 2HH1 ARG 83 5.683 19.516 -14.009 583 HH21 ARG 83 1HH2 ARG 83 3.483 16.852 -13.475 584 HH22 ARG 83 2HH2 ARG 83 4.651 17.543 -14.549 585 H ARG 84 H ARG 84 1.699 19.406 -6.666 586 HA ARG 84 HA ARG 84 0.193 21.723 -5.785 587 HB2 ARG 84 1HB ARG 84 0.955 19.826 -4.269 588 HB3 ARG 84 2HB ARG 84 2.579 20.483 -4.421 589 HG2 ARG 84 1HG ARG 84 2.085 22.359 -3.192 590 HG3 ARG 84 2HG ARG 84 0.360 22.271 -3.554 591 HD2 ARG 84 1HD ARG 84 1.755 20.198 -1.886 592 HD3 ARG 84 2HD ARG 84 1.093 21.674 -1.185 593 HE ARG 84 HE ARG 84 -0.926 20.513 -2.692 594 HH11 ARG 84 1HH1 ARG 84 0.990 19.732 0.107 595 HH12 ARG 84 2HH1 ARG 84 -0.241 18.756 0.839 596 HH21 ARG 84 1HH2 ARG 84 -2.555 19.231 -1.739 597 HH22 ARG 84 2HH2 ARG 84 -2.256 18.471 -0.212 598 H LEU 85 H LEU 85 0.714 23.546 -6.851 599 HA LEU 85 HA LEU 85 3.471 24.133 -7.534 600 HB2 LEU 85 1HB LEU 85 1.587 24.618 -9.078 601 HB3 LEU 85 2HB LEU 85 1.002 25.817 -7.927 602 HG LEU 85 HG LEU 85 3.436 26.805 -8.273 603 HD11 LEU 85 1HD1 LEU 85 4.441 25.320 -9.727 604 HD12 LEU 85 2HD1 LEU 85 3.847 26.566 -10.823 605 HD13 LEU 85 3HD1 LEU 85 2.960 25.052 -10.647 606 HD21 LEU 85 3HD2 LEU 85 2.476 28.429 -9.614 607 HD22 LEU 85 1HD2 LEU 85 1.071 27.719 -8.818 608 HD23 LEU 85 2HD2 LEU 85 1.466 27.269 -10.477 609 H THR 86 H THR 86 4.777 25.000 -6.076 610 HA THR 86 HA THR 86 3.658 26.637 -3.922 611 HB THR 86 HB THR 86 6.462 25.542 -4.209 612 HG1 THR 86 HG1 THR 86 5.788 23.876 -2.959 613 HG21 THR 86 3HG2 THR 86 5.028 26.946 -1.961 614 HG22 THR 86 1HG2 THR 86 6.514 27.438 -2.773 615 HG23 THR 86 2HG2 THR 86 6.509 26.017 -1.728 616 H ILE 87 H ILE 87 3.677 28.769 -4.130 617 HA ILE 87 HA ILE 87 5.819 30.008 -5.732 618 HB ILE 87 HB ILE 87 3.041 31.117 -5.324 619 HG12 ILE 87 1HG1 ILE 87 3.056 30.565 -7.924 620 HG13 ILE 87 2HG1 ILE 87 4.192 29.322 -7.412 621 HG21 ILE 87 1HG2 ILE 87 5.119 31.939 -7.339 622 HG22 ILE 87 2HG2 ILE 87 3.625 32.772 -6.912 623 HG23 ILE 87 3HG2 ILE 87 4.956 32.702 -5.757 624 HD11 ILE 87 3HD1 ILE 87 2.133 29.065 -5.613 625 HD12 ILE 87 1HD1 ILE 87 1.310 29.447 -7.125 626 HD13 ILE 87 2HD1 ILE 87 2.402 28.064 -7.040 627 HA PRO 88 HA PRO 88 6.962 32.034 -1.966 628 HB2 PRO 88 1HB PRO 88 8.672 33.838 -3.058 629 HB3 PRO 88 2HB PRO 88 9.079 32.130 -2.853 630 HG2 PRO 88 1HG PRO 88 8.131 33.571 -5.300 631 HG3 PRO 88 2HG PRO 88 9.411 32.354 -5.144 632 HD2 PRO 88 1HD PRO 88 6.933 31.753 -6.055 633 HD3 PRO 88 2HD PRO 88 7.916 30.600 -5.129 634 HA PRO 89 HA PRO 89 4.666 35.761 -1.549 635 HB2 PRO 89 1HB PRO 89 6.289 37.343 -0.055 636 HB3 PRO 89 2HB PRO 89 5.458 35.927 0.601 637 HG2 PRO 89 1HG PRO 89 8.292 36.200 -0.324 638 HG3 PRO 89 2HG PRO 89 7.659 35.379 1.115 639 HD2 PRO 89 1HD PRO 89 8.364 34.043 -1.133 640 HD3 PRO 89 2HD PRO 89 7.049 33.500 -0.072 641 H GLN 90 H GLN 90 7.523 35.730 -3.322 642 HA GLN 90 HA GLN 90 7.399 38.557 -4.037 643 HB2 GLN 90 1HB GLN 90 9.599 37.494 -3.615 644 HB3 GLN 90 2HB GLN 90 9.316 36.417 -4.976 645 HG2 GLN 90 1HG GLN 90 10.795 38.309 -5.519 646 HG3 GLN 90 2HG GLN 90 9.339 38.256 -6.512 647 HE21 GLN 90 2HE2 GLN 90 7.711 39.793 -6.167 648 HE22 GLN 90 1HE2 GLN 90 8.028 41.278 -5.344 649 H LEU 91 H LEU 91 7.092 35.362 -5.542 650 HA LEU 91 HA LEU 91 6.169 36.588 -8.024 651 HB2 LEU 91 1HB LEU 91 6.407 33.646 -7.483 652 HB3 LEU 91 2HB LEU 91 6.427 34.481 -9.035 653 HG LEU 91 HG LEU 91 8.620 34.527 -6.962 654 HD11 LEU 91 1HD1 LEU 91 9.348 33.521 -9.547 655 HD12 LEU 91 2HD1 LEU 91 7.986 32.607 -8.902 656 HD13 LEU 91 3HD1 LEU 91 9.475 32.746 -7.968 657 HD21 LEU 91 3HD2 LEU 91 8.060 36.187 -9.309 658 HD22 LEU 91 1HD2 LEU 91 9.678 35.485 -9.284 659 HD23 LEU 91 2HD2 LEU 91 9.129 36.481 -7.936 660 H GLY 92 H GLY 92 4.635 36.480 -5.408 661 HA2 GLY 92 1HA GLY 92 2.216 35.167 -6.488 662 HA3 GLY 92 2HA GLY 92 2.599 35.201 -4.774 663 H TYR 93 H TYR 93 1.666 36.734 -3.595 664 HA TYR 93 HA TYR 93 -0.133 38.585 -4.716 665 HB2 TYR 93 1HB TYR 93 0.997 38.133 -1.984 666 HB3 TYR 93 2HB TYR 93 0.099 39.613 -2.300 667 HD1 TYR 93 HD2 TYR 93 -0.135 35.924 -2.268 668 HD2 TYR 93 HD1 TYR 93 -2.270 39.598 -2.468 669 HE1 TYR 93 HE2 TYR 93 -2.245 34.710 -1.916 670 HE2 TYR 93 HE1 TYR 93 -4.386 38.395 -2.116 671 HH TYR 93 HH TYR 93 -4.683 35.522 -0.881 672 H GLY 94 H GLY 94 3.160 38.955 -3.458 673 HA2 GLY 94 1HA GLY 94 4.472 40.597 -4.874 674 HA3 GLY 94 2HA GLY 94 3.166 41.715 -4.507 675 H ALA 95 H ALA 95 5.379 42.779 -3.837 676 HA ALA 95 HA ALA 95 6.669 42.048 -1.474 677 HB1 ALA 95 1HB ALA 95 7.908 43.690 -2.346 678 HB2 ALA 95 2HB ALA 95 6.528 44.422 -3.165 679 HB3 ALA 95 3HB ALA 95 6.838 44.782 -1.466 680 H ARG 96 H ARG 96 3.741 43.933 -2.001 681 HA ARG 96 HA ARG 96 3.464 44.794 0.700 682 HB2 ARG 96 1HB ARG 96 1.710 44.771 -1.720 683 HB3 ARG 96 2HB ARG 96 0.978 45.058 -0.146 684 HG2 ARG 96 1HG ARG 96 2.149 47.045 0.173 685 HG3 ARG 96 2HG ARG 96 3.344 46.646 -1.064 686 HD2 ARG 96 1HD ARG 96 0.445 47.035 -1.738 687 HD3 ARG 96 2HD ARG 96 1.558 48.399 -1.631 688 HE ARG 96 HE ARG 96 2.596 46.363 -3.315 689 HH11 ARG 96 1HH1 ARG 96 0.254 48.937 -3.205 690 HH12 ARG 96 2HH1 ARG 96 0.279 49.209 -4.916 691 HH21 ARG 96 1HH2 ARG 96 2.638 46.712 -5.569 692 HH22 ARG 96 2HH2 ARG 96 1.634 47.942 -6.260 693 H GLY 97 H GLY 97 1.389 42.541 -1.138 694 HA2 GLY 97 1HA GLY 97 0.342 40.597 -0.498 695 HA3 GLY 97 2HA GLY 97 1.528 40.471 0.792 696 H ALA 98 H ALA 98 -1.351 39.893 0.813 697 HA ALA 98 HA ALA 98 -2.916 41.810 2.034 698 HB1 ALA 98 1HB ALA 98 -3.182 39.071 3.105 699 HB2 ALA 98 2HB ALA 98 -4.398 40.145 2.412 700 HB3 ALA 98 3HB ALA 98 -3.310 39.246 1.354 701 H GLY 99 H GLY 99 -3.558 42.052 4.291 702 HA2 GLY 99 1HA GLY 99 -1.201 41.977 6.032 703 HA3 GLY 99 2HA GLY 99 -2.641 42.953 6.282 704 H GLY 100 H GLY 100 -1.291 39.714 6.528 705 HA2 GLY 100 1HA GLY 100 -1.910 38.739 8.803 706 HA3 GLY 100 2HA GLY 100 -3.564 38.955 8.249 707 H VAL 101 H VAL 101 -4.022 37.891 6.065 708 HA VAL 101 HA VAL 101 -3.482 35.114 6.319 709 HB VAL 101 HB VAL 101 -4.622 36.503 3.894 710 HG11 VAL 101 1HG1 VAL 101 -5.909 34.244 3.881 711 HG12 VAL 101 2HG1 VAL 101 -4.252 34.305 3.277 712 HG13 VAL 101 3HG1 VAL 101 -4.580 33.687 4.897 713 HG21 VAL 101 3HG2 VAL 101 -6.838 36.054 4.931 714 HG22 VAL 101 1HG2 VAL 101 -6.004 35.604 6.419 715 HG23 VAL 101 2HG2 VAL 101 -5.880 37.252 5.802 716 H ILE 102 H ILE 102 -2.134 37.688 4.361 717 HA ILE 102 HA ILE 102 -0.187 35.760 3.275 718 HB ILE 102 HB ILE 102 -1.107 38.266 1.870 719 HG12 ILE 102 1HG1 ILE 102 -2.950 36.648 2.017 720 HG13 ILE 102 2HG1 ILE 102 -2.359 36.786 0.365 721 HG21 ILE 102 1HG2 ILE 102 1.162 37.496 1.329 722 HG22 ILE 102 2HG2 ILE 102 0.510 35.919 0.888 723 HG23 ILE 102 3HG2 ILE 102 0.067 37.348 -0.045 724 HD11 ILE 102 3HD1 ILE 102 -0.934 34.703 1.679 725 HD12 ILE 102 1HD1 ILE 102 -2.663 34.465 1.924 726 HD13 ILE 102 2HD1 ILE 102 -2.016 34.608 0.290 727 HA PRO 103 HA PRO 103 2.033 38.970 5.786 728 HB2 PRO 103 1HB PRO 103 3.672 37.196 7.027 729 HB3 PRO 103 2HB PRO 103 2.062 37.603 7.633 730 HG2 PRO 103 1HG PRO 103 2.939 35.233 6.027 731 HG3 PRO 103 2HG PRO 103 1.845 35.297 7.422 732 HD2 PRO 103 1HD PRO 103 0.947 35.125 4.873 733 HD3 PRO 103 2HD PRO 103 0.053 35.983 6.145 734 HA PRO 104 HA PRO 104 5.596 39.245 3.224 735 HB2 PRO 104 1HB PRO 104 7.486 40.181 4.933 736 HB3 PRO 104 2HB PRO 104 6.145 41.172 4.347 737 HG2 PRO 104 1HG PRO 104 6.434 39.728 6.953 738 HG3 PRO 104 2HG PRO 104 5.814 41.360 6.641 739 HD2 PRO 104 1HD PRO 104 4.185 39.241 7.072 740 HD3 PRO 104 2HD PRO 104 3.739 40.586 6.003 741 H ASN 105 H ASN 105 7.526 38.229 2.635 742 HA ASN 105 HA ASN 105 8.918 36.434 2.444 743 HB2 ASN 105 1HB ASN 105 9.123 36.843 5.437 744 HB3 ASN 105 2HB ASN 105 10.248 35.906 4.458 745 HD21 ASN 105 2HD2 ASN 105 11.293 37.105 2.659 746 HD22 ASN 105 1HD2 ASN 105 11.753 38.744 2.952 747 H ALA 106 H ALA 106 6.130 35.826 2.735 748 HA ALA 106 HA ALA 106 6.253 33.247 4.156 749 HB1 ALA 106 1HB ALA 106 3.981 33.384 4.619 750 HB2 ALA 106 2HB ALA 106 4.531 35.047 4.823 751 HB3 ALA 106 3HB ALA 106 3.691 34.571 3.347 752 H THR 107 H THR 107 5.985 31.405 3.043 753 HA THR 107 HA THR 107 5.806 31.561 0.156 754 HB THR 107 HB THR 107 6.171 29.177 1.980 755 HG1 THR 107 HG1 THR 107 8.114 30.233 0.226 756 HG21 THR 107 3HG2 THR 107 5.806 29.426 -0.947 757 HG22 THR 107 1HG2 THR 107 5.420 28.086 0.132 758 HG23 THR 107 2HG2 THR 107 7.082 28.339 -0.400 759 H LEU 108 H LEU 108 4.017 31.263 -0.998 760 HA LEU 108 HA LEU 108 1.600 30.349 0.373 761 HB2 LEU 108 1HB LEU 108 1.947 31.645 -2.327 762 HB3 LEU 108 2HB LEU 108 0.406 31.244 -1.572 763 HG LEU 108 HG LEU 108 1.457 32.831 0.333 764 HD11 LEU 108 1HD1 LEU 108 3.122 34.121 -0.353 765 HD12 LEU 108 2HD1 LEU 108 2.191 34.638 -1.758 766 HD13 LEU 108 3HD1 LEU 108 3.194 33.190 -1.849 767 HD21 LEU 108 3HD2 LEU 108 0.030 34.586 -0.543 768 HD22 LEU 108 1HD2 LEU 108 -0.755 33.017 -0.721 769 HD23 LEU 108 2HD2 LEU 108 -0.013 33.794 -2.119 770 H VAL 109 H VAL 109 0.755 28.401 0.035 771 HA VAL 109 HA VAL 109 1.902 26.734 -2.088 772 HB VAL 109 HB VAL 109 0.282 25.949 0.339 773 HG11 VAL 109 1HG1 VAL 109 -0.155 24.071 -0.774 774 HG12 VAL 109 2HG1 VAL 109 0.928 24.518 -2.094 775 HG13 VAL 109 3HG1 VAL 109 1.566 23.704 -0.664 776 HG21 VAL 109 3HG2 VAL 109 3.212 25.582 -0.282 777 HG22 VAL 109 1HG2 VAL 109 2.536 26.722 0.881 778 HG23 VAL 109 2HG2 VAL 109 2.377 24.987 1.152 779 H PHE 110 H PHE 110 0.790 26.700 -3.923 780 HA PHE 110 HA PHE 110 -2.153 26.718 -3.780 781 HB2 PHE 110 1HB PHE 110 -0.298 27.861 -5.869 782 HB3 PHE 110 2HB PHE 110 -2.021 27.631 -6.146 783 HD1 PHE 110 HD1 PHE 110 -3.658 28.854 -4.691 784 HD2 PHE 110 HD2 PHE 110 0.508 29.723 -4.695 785 HE1 PHE 110 HE1 PHE 110 -4.117 31.038 -3.656 786 HE2 PHE 110 HE2 PHE 110 0.057 31.909 -3.659 787 HZ PHE 110 HZ PHE 110 -2.258 32.568 -3.137 788 H GLU 111 H GLU 111 -3.234 25.069 -4.683 789 HA GLU 111 HA GLU 111 -1.649 22.984 -6.005 790 HB2 GLU 111 1HB GLU 111 -3.058 22.490 -3.939 791 HB3 GLU 111 2HB GLU 111 -4.466 22.714 -4.967 792 HG2 GLU 111 1HG GLU 111 -2.334 20.799 -5.788 793 HG3 GLU 111 2HG GLU 111 -3.502 20.335 -4.552 794 H VAL 112 H VAL 112 -1.830 22.661 -8.117 795 HA VAL 112 HA VAL 112 -4.195 23.750 -9.503 796 HB VAL 112 HB VAL 112 -1.428 23.399 -10.662 797 HG11 VAL 112 1HG1 VAL 112 -2.954 23.262 -12.431 798 HG12 VAL 112 2HG1 VAL 112 -4.006 24.498 -11.737 799 HG13 VAL 112 3HG1 VAL 112 -2.445 24.950 -12.422 800 HG21 VAL 112 3HG2 VAL 112 -0.890 25.290 -9.619 801 HG22 VAL 112 1HG2 VAL 112 -2.092 26.107 -10.618 802 HG23 VAL 112 2HG2 VAL 112 -2.536 25.499 -9.023 803 H GLU 113 H GLU 113 -5.463 22.299 -10.445 804 HA GLU 113 HA GLU 113 -4.282 19.781 -11.395 805 HB2 GLU 113 1HB GLU 113 -6.531 18.732 -10.659 806 HB3 GLU 113 2HB GLU 113 -5.296 19.025 -9.442 807 HG2 GLU 113 1HG GLU 113 -6.491 20.651 -8.414 808 HG3 GLU 113 2HG GLU 113 -7.266 21.181 -9.906 809 H LEU 114 H LEU 114 -4.661 19.516 -13.484 810 HA LEU 114 HA LEU 114 -6.527 21.159 -14.897 811 HB2 LEU 114 1HB LEU 114 -4.246 19.738 -15.544 812 HB3 LEU 114 2HB LEU 114 -5.533 18.850 -16.358 813 HG LEU 114 HG LEU 114 -6.064 21.474 -17.021 814 HD11 LEU 114 1HD1 LEU 114 -3.656 21.783 -15.993 815 HD12 LEU 114 2HD1 LEU 114 -4.152 22.642 -17.450 816 HD13 LEU 114 3HD1 LEU 114 -3.158 21.192 -17.578 817 HD21 LEU 114 3HD2 LEU 114 -4.457 19.416 -18.533 818 HD22 LEU 114 1HD2 LEU 114 -5.248 20.825 -19.240 819 HD23 LEU 114 2HD2 LEU 114 -6.216 19.549 -18.500 820 H LEU 115 H LEU 115 -8.528 20.695 -15.620 821 HA LEU 115 HA LEU 115 -9.622 18.053 -14.925 822 HB2 LEU 115 1HB LEU 115 -10.935 20.746 -15.207 823 HB3 LEU 115 2HB LEU 115 -11.842 19.241 -15.064 824 HG LEU 115 HG LEU 115 -9.982 19.386 -12.908 825 HD11 LEU 115 1HD1 LEU 115 -11.823 21.653 -12.574 826 HD12 LEU 115 2HD1 LEU 115 -10.475 21.927 -13.677 827 HD13 LEU 115 3HD1 LEU 115 -10.166 21.438 -12.011 828 HD21 LEU 115 3HD2 LEU 115 -12.919 19.844 -12.629 829 HD22 LEU 115 1HD2 LEU 115 -11.833 18.867 -11.641 830 HD23 LEU 115 2HD2 LEU 115 -12.331 18.294 -13.233 831 H ASP 116 H ASP 116 -9.938 20.629 -17.367 832 HA ASP 116 HA ASP 116 -10.000 18.647 -19.475 833 HB2 ASP 116 1HB ASP 116 -12.389 18.916 -18.642 834 HB3 ASP 116 2HB ASP 116 -12.319 20.565 -19.256 835 H VAL 117 H VAL 117 -9.312 19.439 -21.421 836 HA VAL 117 HA VAL 117 -7.931 21.925 -21.406 837 HB VAL 117 HB VAL 117 -8.552 20.075 -23.713 838 HG11 VAL 117 1HG1 VAL 117 -6.670 22.420 -23.505 839 HG12 VAL 117 2HG1 VAL 117 -6.635 21.233 -24.810 840 HG13 VAL 117 3HG1 VAL 117 -8.057 22.252 -24.582 841 HG21 VAL 117 3HG2 VAL 117 -6.917 19.647 -21.525 842 HG22 VAL 117 1HG2 VAL 117 -6.837 18.802 -23.071 843 HG23 VAL 117 2HG2 VAL 117 -5.806 20.202 -22.777 844 H11 L2S 130 1H1 L2S 130 -5.369 31.344 -9.717 845 H21 L2S 130 2H1 L2S 130 -5.273 32.291 -11.278 846 H12 L2S 130 1H2 L2S 130 -4.888 34.310 -10.046 847 H22 L2S 130 2H2 L2S 130 -3.612 33.066 -9.628 848 H13 L2S 130 2H3 L2S 130 -4.804 32.571 -7.591 849 H23 L2S 130 1H3 L2S 130 -4.510 34.372 -7.659 850 H14 L2S 130 1H4 L2S 130 -7.411 31.847 -8.177 851 H24 L2S 130 2H4 L2S 130 -8.411 33.298 -8.653 852 H15 L2S 130 1H5 L2S 130 -7.614 31.891 -10.585 853 H25 L2S 130 2H5 L2S 130 -7.123 33.654 -10.587 854 H17 L2S 130 1H7 L2S 130 -8.828 35.053 -7.803 855 H27 L2S 130 2H7 L2S 130 -8.921 34.060 -6.253 856 H9 L2S 130 H9 L2S 130 -10.277 34.752 -4.268 857 H10 L2S 130 H10 L2S 130 -10.318 34.381 -1.801 858 H112 L2S 130 1H12 L2S 130 -6.789 36.920 -1.368 859 H113 L2S 130 1H13 L2S 130 -6.793 37.319 -3.824 860 H114 L2S 130 1H14 L2S 130 -9.000 36.296 0.440 861 H214 L2S 130 2H14 L2S 130 -7.556 35.263 0.306 862 H314 L2S 130 3H14 L2S 130 -9.189 34.537 0.114 Start of MODEL 14 1 H1 GLY 1 H GLY 1 15.250 9.856 -17.355 2 HA2 GLY 1 1HA GLY 1 15.453 8.330 -15.554 3 HA3 GLY 1 2HA GLY 1 15.746 9.685 -14.473 4 HA PRO 2 HA PRO 2 11.343 8.174 -14.006 5 HB2 PRO 2 1HB PRO 2 11.487 7.741 -11.330 6 HB3 PRO 2 2HB PRO 2 11.914 6.512 -12.526 7 HG2 PRO 2 1HG PRO 2 13.701 8.336 -10.964 8 HG3 PRO 2 2HG PRO 2 13.900 6.611 -11.320 9 HD2 PRO 2 1HD PRO 2 15.209 8.541 -12.695 10 HD3 PRO 2 2HD PRO 2 14.705 7.012 -13.442 11 H GLY 3 H GLY 3 9.905 9.773 -13.868 12 HA2 GLY 3 1HA GLY 3 10.584 12.165 -12.314 13 HA3 GLY 3 2HA GLY 3 9.344 12.057 -13.554 14 H SER 4 H SER 4 10.080 10.448 -10.454 15 HA SER 4 HA SER 4 7.536 11.292 -9.370 16 HB2 SER 4 1HB SER 4 8.115 8.396 -9.995 17 HB3 SER 4 2HB SER 4 6.918 8.886 -8.797 18 HG SER 4 HG SER 4 6.913 9.290 -11.584 19 H MET 5 H MET 5 7.363 10.955 -7.103 20 HA MET 5 HA MET 5 8.176 10.958 -4.980 21 HB2 MET 5 1HB MET 5 10.042 8.816 -6.009 22 HB3 MET 5 2HB MET 5 9.614 9.111 -4.330 23 HG2 MET 5 1HG MET 5 7.674 8.273 -6.471 24 HG3 MET 5 2HG MET 5 8.447 7.180 -5.326 25 HE1 MET 5 3HE MET 5 7.185 6.907 -2.576 26 HE2 MET 5 1HE MET 5 5.581 6.718 -3.285 27 HE3 MET 5 2HE MET 5 7.004 6.152 -4.161 28 H THR 6 H THR 6 9.269 12.871 -6.740 29 HA THR 6 HA THR 6 11.692 13.510 -5.298 30 HB THR 6 HB THR 6 11.804 13.314 -8.313 31 HG1 THR 6 HG1 THR 6 13.021 11.675 -6.319 32 HG21 THR 6 3HG2 THR 6 13.329 14.960 -7.822 33 HG22 THR 6 1HG2 THR 6 14.342 13.530 -7.620 34 HG23 THR 6 2HG2 THR 6 13.653 14.330 -6.207 35 H VAL 7 H VAL 7 11.721 15.622 -4.885 36 HA VAL 7 HA VAL 7 9.933 17.365 -6.429 37 HB VAL 7 HB VAL 7 9.590 17.267 -3.977 38 HG11 VAL 7 1HG1 VAL 7 11.912 18.923 -3.346 39 HG12 VAL 7 2HG1 VAL 7 11.222 17.555 -2.472 40 HG13 VAL 7 3HG1 VAL 7 12.324 17.276 -3.821 41 HG21 VAL 7 3HG2 VAL 7 8.958 19.257 -5.270 42 HG22 VAL 7 1HG2 VAL 7 9.450 19.670 -3.627 43 HG23 VAL 7 2HG2 VAL 7 10.553 19.948 -4.974 44 H VAL 8 H VAL 8 10.628 19.348 -7.246 45 HA VAL 8 HA VAL 8 13.491 19.944 -7.126 46 HB VAL 8 HB VAL 8 13.284 18.630 -9.147 47 HG11 VAL 8 1HG1 VAL 8 11.061 18.686 -9.789 48 HG12 VAL 8 2HG1 VAL 8 10.967 20.445 -9.683 49 HG13 VAL 8 3HG1 VAL 8 11.833 19.685 -11.020 50 HG21 VAL 8 3HG2 VAL 8 14.751 20.651 -9.115 51 HG22 VAL 8 1HG2 VAL 8 14.213 20.172 -10.725 52 HG23 VAL 8 2HG2 VAL 8 13.454 21.541 -9.913 53 H THR 9 H THR 9 14.005 22.101 -7.365 54 HA THR 9 HA THR 9 11.706 23.941 -7.448 55 HB THR 9 HB THR 9 14.397 24.445 -6.166 56 HG1 THR 9 HG1 THR 9 13.588 23.240 -4.625 57 HG21 THR 9 3HG2 THR 9 11.984 26.069 -6.635 58 HG22 THR 9 1HG2 THR 9 13.657 26.569 -6.388 59 HG23 THR 9 2HG2 THR 9 12.647 26.153 -5.003 60 H THR 10 H THR 10 11.884 25.884 -8.602 61 HA THR 10 HA THR 10 13.553 25.713 -10.945 62 HB THR 10 HB THR 10 12.402 27.750 -11.686 63 HG1 THR 10 HG1 THR 10 11.630 29.019 -10.189 64 HG21 THR 10 3HG2 THR 10 11.311 25.620 -12.102 65 HG22 THR 10 1HG2 THR 10 10.102 26.850 -11.736 66 HG23 THR 10 2HG2 THR 10 10.556 25.668 -10.509 67 H GLU 11 H GLU 11 14.380 28.078 -11.664 68 HA GLU 11 HA GLU 11 16.505 28.668 -9.805 69 HB2 GLU 11 1HB GLU 11 15.836 29.529 -12.599 70 HB3 GLU 11 2HB GLU 11 17.051 30.402 -11.676 71 HG2 GLU 11 1HG GLU 11 17.117 27.452 -12.263 72 HG3 GLU 11 2HG GLU 11 18.014 28.687 -13.144 73 H SER 12 H SER 12 13.477 30.063 -10.750 74 HA SER 12 HA SER 12 14.050 32.659 -9.620 75 HB2 SER 12 1HB SER 12 12.472 32.196 -11.584 76 HB3 SER 12 2HB SER 12 11.323 31.614 -10.380 77 HG SER 12 HG SER 12 12.488 34.203 -10.479 78 H GLY 13 H GLY 13 12.576 29.669 -8.611 79 HA2 GLY 13 1HA GLY 13 12.754 29.491 -6.073 80 HA3 GLY 13 2HA GLY 13 11.753 30.935 -6.077 81 H LEU 14 H LEU 14 10.359 29.766 -8.533 82 HA LEU 14 HA LEU 14 8.107 28.753 -7.246 83 HB2 LEU 14 1HB LEU 14 7.769 29.599 -9.389 84 HB3 LEU 14 2HB LEU 14 9.083 28.645 -10.074 85 HG LEU 14 HG LEU 14 7.689 26.612 -9.788 86 HD11 LEU 14 1HD1 LEU 14 5.189 28.079 -9.532 87 HD12 LEU 14 2HD1 LEU 14 6.199 28.177 -8.090 88 HD13 LEU 14 3HD1 LEU 14 5.727 26.603 -8.730 89 HD21 LEU 14 3HD2 LEU 14 5.871 27.515 -11.499 90 HD22 LEU 14 1HD2 LEU 14 7.559 27.289 -11.956 91 HD23 LEU 14 2HD2 LEU 14 6.966 28.897 -11.538 92 H LYS 15 H LYS 15 7.318 26.712 -6.867 93 HA LYS 15 HA LYS 15 9.057 24.434 -7.496 94 HB2 LYS 15 1HB LYS 15 7.830 24.950 -4.781 95 HB3 LYS 15 2HB LYS 15 8.762 23.530 -5.238 96 HG2 LYS 15 1HG LYS 15 10.756 24.650 -5.194 97 HG3 LYS 15 2HG LYS 15 10.012 26.212 -5.542 98 HD2 LYS 15 1HD LYS 15 10.731 26.284 -3.279 99 HD3 LYS 15 2HD LYS 15 8.975 26.105 -3.248 100 HE2 LYS 15 1HE LYS 15 9.698 24.575 -1.653 101 HE3 LYS 15 2HE LYS 15 9.456 23.579 -3.088 102 HZ1 LYS 15 3HZ LYS 15 11.619 23.347 -1.710 103 HZ2 LYS 15 1HZ LYS 15 12.109 24.730 -2.554 104 HZ3 LYS 15 2HZ LYS 15 11.702 23.323 -3.400 105 H TYR 16 H TYR 16 7.929 22.327 -7.171 106 HA TYR 16 HA TYR 16 5.038 22.386 -7.137 107 HB2 TYR 16 1HB TYR 16 4.979 21.105 -9.363 108 HB3 TYR 16 2HB TYR 16 5.220 22.847 -9.436 109 HD1 TYR 16 HD2 TYR 16 6.785 19.571 -9.922 110 HD2 TYR 16 HD1 TYR 16 7.345 23.783 -10.136 111 HE1 TYR 16 HE2 TYR 16 8.837 19.225 -11.234 112 HE2 TYR 16 HE1 TYR 16 9.398 23.449 -11.450 113 HH TYR 16 HH TYR 16 10.169 20.702 -12.988 114 H GLU 17 H GLU 17 4.105 20.357 -6.784 115 HA GLU 17 HA GLU 17 5.992 18.141 -6.345 116 HB2 GLU 17 1HB GLU 17 3.971 19.305 -4.480 117 HB3 GLU 17 2HB GLU 17 4.269 17.574 -4.422 118 HG2 GLU 17 1HG GLU 17 6.670 18.039 -4.072 119 HG3 GLU 17 2HG GLU 17 6.296 19.760 -4.019 120 H ASP 18 H ASP 18 5.477 16.459 -7.561 121 HA ASP 18 HA ASP 18 3.062 16.255 -9.007 122 HB2 ASP 18 1HB ASP 18 5.035 14.038 -8.426 123 HB3 ASP 18 2HB ASP 18 3.882 14.106 -9.756 124 H LEU 19 H LEU 19 1.130 15.606 -8.352 125 HA LEU 19 HA LEU 19 0.956 13.907 -5.953 126 HB2 LEU 19 1HB LEU 19 -0.658 16.183 -6.949 127 HB3 LEU 19 2HB LEU 19 -1.522 14.880 -6.136 128 HG LEU 19 HG LEU 19 0.814 16.291 -4.871 129 HD11 LEU 19 1HD1 LEU 19 -1.242 17.368 -3.579 130 HD12 LEU 19 2HD1 LEU 19 -2.004 17.162 -5.156 131 HD13 LEU 19 3HD1 LEU 19 -0.528 18.117 -5.007 132 HD21 LEU 19 3HD2 LEU 19 0.462 14.428 -3.604 133 HD22 LEU 19 1HD2 LEU 19 -1.246 14.323 -4.028 134 HD23 LEU 19 2HD2 LEU 19 -0.703 15.516 -2.847 135 H THR 20 H THR 20 -0.024 14.314 -9.268 136 HA THR 20 HA THR 20 -0.784 11.547 -9.441 137 HB THR 20 HB THR 20 -2.917 13.577 -10.109 138 HG1 THR 20 HG1 THR 20 -3.166 13.588 -7.993 139 HG21 THR 20 3HG2 THR 20 -2.938 11.433 -11.360 140 HG22 THR 20 1HG2 THR 20 -4.357 11.649 -10.337 141 HG23 THR 20 2HG2 THR 20 -3.056 10.574 -9.825 142 H GLU 21 H GLU 21 0.205 10.942 -11.245 143 HA GLU 21 HA GLU 21 1.039 12.711 -13.274 144 HB2 GLU 21 1HB GLU 21 1.943 10.369 -12.648 145 HB3 GLU 21 2HB GLU 21 0.678 9.758 -13.705 146 HG2 GLU 21 1HG GLU 21 1.742 11.515 -15.376 147 HG3 GLU 21 2HG GLU 21 3.160 11.235 -14.366 148 H GLY 22 H GLY 22 0.114 13.381 -15.124 149 HA2 GLY 22 1HA GLY 22 -2.565 12.300 -15.745 150 HA3 GLY 22 2HA GLY 22 -2.099 13.975 -16.003 151 H SER 23 H SER 23 -2.537 11.029 -17.473 152 HA SER 23 HA SER 23 -0.568 11.499 -19.581 153 HB2 SER 23 1HB SER 23 -0.929 9.199 -18.605 154 HB3 SER 23 2HB SER 23 -2.526 9.204 -19.353 155 HG SER 23 HG SER 23 -0.053 9.494 -20.720 156 H GLY 24 H GLY 24 -2.683 13.382 -19.330 157 HA2 GLY 24 1HA GLY 24 -4.516 12.743 -21.523 158 HA3 GLY 24 2HA GLY 24 -4.645 14.115 -20.432 159 H ALA 25 H ALA 25 -4.008 16.043 -21.154 160 HA ALA 25 HA ALA 25 -2.078 16.174 -23.358 161 HB1 ALA 25 1HB ALA 25 -4.860 16.636 -23.646 162 HB2 ALA 25 2HB ALA 25 -4.033 18.186 -23.807 163 HB3 ALA 25 3HB ALA 25 -3.582 16.834 -24.846 164 H GLU 26 H GLU 26 -0.580 17.703 -23.068 165 HA GLU 26 HA GLU 26 -0.453 19.205 -20.690 166 HB2 GLU 26 1HB GLU 26 1.575 18.573 -21.821 167 HB3 GLU 26 2HB GLU 26 1.092 19.438 -23.274 168 HG2 GLU 26 1HG GLU 26 1.203 21.554 -21.996 169 HG3 GLU 26 2HG GLU 26 1.813 20.646 -20.614 170 H ALA 27 H ALA 27 -0.972 21.273 -20.199 171 HA ALA 27 HA ALA 27 -3.010 22.598 -21.507 172 HB1 ALA 27 1HB ALA 27 -1.660 22.966 -19.169 173 HB2 ALA 27 2HB ALA 27 -1.173 24.387 -20.095 174 HB3 ALA 27 3HB ALA 27 -2.883 24.061 -19.815 175 H ARG 28 H ARG 28 -3.077 23.520 -23.439 176 HA ARG 28 HA ARG 28 -0.655 24.267 -24.819 177 HB2 ARG 28 1HB ARG 28 -3.570 24.249 -25.568 178 HB3 ARG 28 2HB ARG 28 -2.357 24.976 -26.614 179 HG2 ARG 28 1HG ARG 28 -2.005 22.173 -25.649 180 HG3 ARG 28 2HG ARG 28 -3.090 22.520 -26.996 181 HD2 ARG 28 1HD ARG 28 -0.354 23.686 -27.047 182 HD3 ARG 28 2HD ARG 28 -0.533 21.963 -27.375 183 HE ARG 28 HE ARG 28 -1.272 24.132 -29.092 184 HH11 ARG 28 1HH1 ARG 28 -1.975 20.833 -28.229 185 HH12 ARG 28 2HH1 ARG 28 -2.652 20.436 -29.774 186 HH21 ARG 28 1HH2 ARG 28 -2.161 23.622 -31.129 187 HH22 ARG 28 2HH2 ARG 28 -2.757 22.023 -31.423 188 H ALA 29 H ALA 29 -0.407 26.381 -25.862 189 HA ALA 29 HA ALA 29 -1.105 28.512 -23.998 190 HB1 ALA 29 1HB ALA 29 0.919 29.276 -24.477 191 HB2 ALA 29 2HB ALA 29 1.150 27.935 -25.601 192 HB3 ALA 29 3HB ALA 29 0.471 29.459 -26.174 193 H GLY 30 H GLY 30 -2.168 30.410 -24.588 194 HA2 GLY 30 1HA GLY 30 -3.508 31.804 -25.856 195 HA3 GLY 30 2HA GLY 30 -3.103 30.842 -27.269 196 H GLN 31 H GLN 31 -4.134 28.752 -24.929 197 HA GLN 31 HA GLN 31 -6.906 28.851 -25.926 198 HB2 GLN 31 1HB GLN 31 -5.025 26.573 -25.518 199 HB3 GLN 31 2HB GLN 31 -6.739 26.294 -25.239 200 HG2 GLN 31 1HG GLN 31 -7.278 26.894 -27.481 201 HG3 GLN 31 2HG GLN 31 -5.632 27.446 -27.785 202 HE21 GLN 31 2HE2 GLN 31 -7.205 24.526 -26.512 203 HE22 GLN 31 1HE2 GLN 31 -6.297 23.413 -27.472 204 H THR 32 H THR 32 -8.572 28.197 -24.477 205 HA THR 32 HA THR 32 -7.979 28.909 -21.720 206 HB THR 32 HB THR 32 -10.707 28.184 -22.758 207 HG1 THR 32 HG1 THR 32 -10.429 29.797 -24.117 208 HG21 THR 32 3HG2 THR 32 -11.485 29.122 -20.861 209 HG22 THR 32 1HG2 THR 32 -10.304 30.430 -20.904 210 HG23 THR 32 2HG2 THR 32 -9.847 28.851 -20.266 211 H VAL 33 H VAL 33 -7.416 27.383 -20.323 212 HA VAL 33 HA VAL 33 -8.480 24.662 -20.688 213 HB VAL 33 HB VAL 33 -6.592 23.908 -19.277 214 HG11 VAL 33 1HG1 VAL 33 -6.581 24.475 -21.918 215 HG12 VAL 33 2HG1 VAL 33 -5.197 25.427 -21.377 216 HG13 VAL 33 3HG1 VAL 33 -5.248 23.690 -21.072 217 HG21 VAL 33 3HG2 VAL 33 -5.385 25.336 -18.076 218 HG22 VAL 33 1HG2 VAL 33 -4.904 26.199 -19.537 219 HG23 VAL 33 2HG2 VAL 33 -6.380 26.658 -18.688 220 H SER 34 H SER 34 -9.483 23.607 -19.019 221 HA SER 34 HA SER 34 -10.302 25.296 -16.769 222 HB2 SER 34 1HB SER 34 -11.510 22.610 -17.297 223 HB3 SER 34 2HB SER 34 -12.260 24.068 -16.647 224 HG SER 34 HG SER 34 -13.008 23.962 -18.683 225 H VAL 35 H VAL 35 -9.355 25.037 -14.869 226 HA VAL 35 HA VAL 35 -8.579 22.362 -13.987 227 HB VAL 35 HB VAL 35 -6.365 22.888 -13.436 228 HG11 VAL 35 1HG1 VAL 35 -6.865 24.289 -16.060 229 HG12 VAL 35 2HG1 VAL 35 -5.338 23.591 -15.517 230 HG13 VAL 35 3HG1 VAL 35 -6.719 22.545 -15.848 231 HG21 VAL 35 3HG2 VAL 35 -5.517 25.297 -13.843 232 HG22 VAL 35 1HG2 VAL 35 -7.223 25.739 -13.762 233 HG23 VAL 35 2HG2 VAL 35 -6.447 24.958 -12.383 234 H HIS 36 H HIS 36 -8.183 22.231 -11.679 235 HA HIS 36 HA HIS 36 -9.788 24.200 -10.219 236 HB2 HIS 36 1HB HIS 36 -9.281 21.316 -9.950 237 HB3 HIS 36 2HB HIS 36 -9.279 22.196 -8.425 238 HD1 HIS 36 HD1 HIS 36 -11.543 24.242 -9.225 239 HD2 HIS 36 HD2 HIS 36 -11.738 20.113 -9.644 240 HE1 HIS 36 HE1 HIS 36 -13.995 23.685 -9.258 241 H TYR 37 H TYR 37 -8.936 25.530 -8.740 242 HA TYR 37 HA TYR 37 -6.109 25.129 -8.007 243 HB2 TYR 37 1HB TYR 37 -5.864 27.538 -7.886 244 HB3 TYR 37 2HB TYR 37 -6.503 27.098 -9.465 245 HD1 TYR 37 HD2 TYR 37 -7.402 28.511 -6.167 246 HD2 TYR 37 HD1 TYR 37 -8.607 27.906 -10.203 247 HE1 TYR 37 HE2 TYR 37 -9.276 30.069 -5.835 248 HE2 TYR 37 HE1 TYR 37 -10.483 29.464 -9.882 249 HH TYR 37 HH TYR 37 -11.871 30.255 -7.725 250 H THR 38 H THR 38 -5.516 25.330 -5.891 251 HA THR 38 HA THR 38 -7.598 26.030 -3.939 252 HB THR 38 HB THR 38 -5.884 23.940 -2.909 253 HG1 THR 38 HG1 THR 38 -7.605 23.029 -4.955 254 HG21 THR 38 3HG2 THR 38 -8.726 24.680 -3.009 255 HG22 THR 38 1HG2 THR 38 -7.772 24.024 -1.679 256 HG23 THR 38 2HG2 THR 38 -8.419 22.946 -2.917 257 H GLY 39 H GLY 39 -6.831 27.767 -2.920 258 HA2 GLY 39 1HA GLY 39 -3.973 28.157 -2.592 259 HA3 GLY 39 2HA GLY 39 -5.240 29.296 -2.161 260 H TRP 40 H TRP 40 -2.846 27.550 -0.878 261 HA TRP 40 HA TRP 40 -4.247 27.277 1.698 262 HB2 TRP 40 1HB TRP 40 -2.322 25.381 0.377 263 HB3 TRP 40 2HB TRP 40 -2.518 25.399 2.127 264 HD1 TRP 40 HD1 TRP 40 -5.622 25.659 2.395 265 HE1 TRP 40 HE1 TRP 40 -7.164 23.735 1.657 266 HE3 TRP 40 HE3 TRP 40 -2.448 23.260 -0.815 267 HZ2 TRP 40 HZ2 TRP 40 -7.050 21.497 -0.059 268 HZ3 TRP 40 HZ3 TRP 40 -3.242 21.234 -1.964 269 HH2 TRP 40 HH2 TRP 40 -5.495 20.372 -1.592 270 H LEU 41 H LEU 41 -3.270 28.177 3.426 271 HA LEU 41 HA LEU 41 -1.108 29.970 3.020 272 HB2 LEU 41 1HB LEU 41 -2.915 29.230 5.190 273 HB3 LEU 41 2HB LEU 41 -1.300 29.668 5.743 274 HG LEU 41 HG LEU 41 -3.093 31.410 4.053 275 HD11 LEU 41 1HD1 LEU 41 -2.878 30.997 6.933 276 HD12 LEU 41 2HD1 LEU 41 -4.143 31.781 5.988 277 HD13 LEU 41 3HD1 LEU 41 -2.696 32.681 6.442 278 HD21 LEU 41 3HD2 LEU 41 -0.355 31.477 4.265 279 HD22 LEU 41 1HD2 LEU 41 -0.874 32.631 5.493 280 HD23 LEU 41 2HD2 LEU 41 -1.389 32.835 3.818 281 H THR 42 H THR 42 0.749 29.936 4.739 282 HA THR 42 HA THR 42 2.515 27.910 4.081 283 HB THR 42 HB THR 42 3.847 28.639 6.076 284 HG1 THR 42 HG1 THR 42 1.421 29.922 6.614 285 HG21 THR 42 3HG2 THR 42 4.254 29.799 4.047 286 HG22 THR 42 1HG2 THR 42 4.079 31.036 5.290 287 HG23 THR 42 2HG2 THR 42 2.748 30.706 4.180 288 H ASP 43 H ASP 43 0.090 28.008 6.573 289 HA ASP 43 HA ASP 43 1.112 25.569 7.813 290 HB2 ASP 43 1HB ASP 43 -0.479 25.953 9.565 291 HB3 ASP 43 2HB ASP 43 0.296 27.494 9.208 292 H GLY 44 H GLY 44 -1.226 26.603 5.530 293 HA2 GLY 44 1HA GLY 44 -2.097 24.795 4.093 294 HA3 GLY 44 2HA GLY 44 -2.431 23.904 5.571 295 H GLN 45 H GLN 45 -3.087 27.121 6.099 296 HA GLN 45 HA GLN 45 -5.867 26.703 6.343 297 HB2 GLN 45 1HB GLN 45 -4.247 28.481 7.434 298 HB3 GLN 45 2HB GLN 45 -4.751 29.459 6.062 299 HG2 GLN 45 1HG GLN 45 -6.926 29.602 6.784 300 HG3 GLN 45 2HG GLN 45 -6.819 28.122 7.735 301 HE21 GLN 45 2HE2 GLN 45 -7.549 28.979 9.629 302 HE22 GLN 45 1HE2 GLN 45 -6.675 30.156 10.543 303 H LYS 46 H LYS 46 -7.289 26.521 4.756 304 HA LYS 46 HA LYS 46 -6.742 27.270 2.074 305 HB2 LYS 46 1HB LYS 46 -8.296 25.419 2.886 306 HB3 LYS 46 2HB LYS 46 -9.472 26.686 3.215 307 HG2 LYS 46 1HG LYS 46 -9.851 27.104 0.999 308 HG3 LYS 46 2HG LYS 46 -8.249 26.550 0.507 309 HD2 LYS 46 1HD LYS 46 -9.847 24.946 -0.260 310 HD3 LYS 46 2HD LYS 46 -8.964 24.224 1.088 311 HE2 LYS 46 1HE LYS 46 -11.234 23.695 1.450 312 HE3 LYS 46 2HE LYS 46 -10.863 25.005 2.570 313 HZ1 LYS 46 3HZ LYS 46 -11.746 26.480 0.654 314 HZ2 LYS 46 1HZ LYS 46 -12.846 25.684 1.664 315 HZ3 LYS 46 2HZ LYS 46 -12.503 25.062 0.129 316 H PHE 47 H PHE 47 -6.952 29.180 1.121 317 HA PHE 47 HA PHE 47 -8.822 31.138 2.276 318 HB2 PHE 47 1HB PHE 47 -7.189 32.922 1.673 319 HB3 PHE 47 2HB PHE 47 -6.597 31.829 2.919 320 HD1 PHE 47 HD2 PHE 47 -6.465 32.434 -0.745 321 HD2 PHE 47 HD1 PHE 47 -4.537 30.800 2.680 322 HE1 PHE 47 HE2 PHE 47 -4.451 31.999 -2.091 323 HE2 PHE 47 HE1 PHE 47 -2.520 30.363 1.340 324 HZ PHE 47 HZ PHE 47 -2.476 30.961 -1.049 325 H ASP 48 H ASP 48 -8.580 29.207 -0.167 326 HA ASP 48 HA ASP 48 -10.180 30.706 -1.919 327 HB2 ASP 48 1HB ASP 48 -7.712 31.636 -2.207 328 HB3 ASP 48 2HB ASP 48 -7.548 30.217 -3.238 329 H SER 49 H SER 49 -11.394 29.241 -2.905 330 HA SER 49 HA SER 49 -10.225 26.848 -4.041 331 HB2 SER 49 1HB SER 49 -10.604 26.014 -1.827 332 HB3 SER 49 2HB SER 49 -12.213 26.733 -1.766 333 HG SER 49 HG SER 49 -11.643 24.315 -2.501 334 H SER 50 H SER 50 -11.015 26.951 -6.034 335 HA SER 50 HA SER 50 -13.422 28.257 -6.737 336 HB2 SER 50 1HB SER 50 -12.128 28.205 -8.601 337 HB3 SER 50 2HB SER 50 -11.336 26.702 -8.130 338 HG SER 50 HG SER 50 -13.062 25.556 -8.927 339 H LYS 51 H LYS 51 -12.825 25.192 -5.435 340 HA LYS 51 HA LYS 51 -14.772 23.588 -6.613 341 HB2 LYS 51 1HB LYS 51 -13.817 23.596 -3.744 342 HB3 LYS 51 2HB LYS 51 -14.728 22.296 -4.500 343 HG2 LYS 51 1HG LYS 51 -12.044 23.239 -5.477 344 HG3 LYS 51 2HG LYS 51 -12.270 21.906 -4.341 345 HD2 LYS 51 1HD LYS 51 -13.804 21.856 -6.888 346 HD3 LYS 51 2HD LYS 51 -12.077 21.497 -6.950 347 HE2 LYS 51 1HE LYS 51 -12.969 20.025 -4.792 348 HE3 LYS 51 2HE LYS 51 -14.287 19.887 -5.955 349 HZ1 LYS 51 3HZ LYS 51 -13.012 18.212 -6.717 350 HZ2 LYS 51 1HZ LYS 51 -11.574 18.852 -6.096 351 HZ3 LYS 51 2HZ LYS 51 -12.212 19.453 -7.542 352 H ASP 52 H ASP 52 -15.088 26.238 -4.422 353 HA ASP 52 HA ASP 52 -17.526 25.702 -3.203 354 HB2 ASP 52 1HB ASP 52 -15.853 27.715 -2.957 355 HB3 ASP 52 2HB ASP 52 -16.909 28.476 -4.145 356 H ARG 53 H ARG 53 -16.859 27.137 -6.370 357 HA ARG 53 HA ARG 53 -19.628 27.563 -6.979 358 HB2 ARG 53 1HB ARG 53 -17.436 28.703 -7.937 359 HB3 ARG 53 2HB ARG 53 -17.555 27.407 -9.119 360 HG2 ARG 53 1HG ARG 53 -18.693 29.143 -10.132 361 HG3 ARG 53 2HG ARG 53 -19.992 28.194 -9.407 362 HD2 ARG 53 1HD ARG 53 -19.799 29.750 -7.405 363 HD3 ARG 53 2HD ARG 53 -18.799 30.776 -8.432 364 HE ARG 53 HE ARG 53 -21.277 30.126 -9.677 365 HH11 ARG 53 1HH1 ARG 53 -19.802 32.198 -7.300 366 HH12 ARG 53 2HH1 ARG 53 -20.986 33.451 -7.467 367 HH21 ARG 53 1HH2 ARG 53 -22.842 31.769 -9.906 368 HH22 ARG 53 2HH2 ARG 53 -22.716 33.206 -8.949 369 H ASN 54 H ASN 54 -17.794 24.818 -6.783 370 HA ASN 54 HA ASN 54 -18.115 22.660 -7.428 371 HB2 ASN 54 1HB ASN 54 -20.526 23.325 -6.868 372 HB3 ASN 54 2HB ASN 54 -20.762 23.495 -8.605 373 HD21 ASN 54 2HD2 ASN 54 -21.842 21.815 -9.324 374 HD22 ASN 54 1HD2 ASN 54 -21.556 20.164 -8.906 375 H ASP 55 H ASP 55 -17.096 24.818 -9.292 376 HA ASP 55 HA ASP 55 -17.089 23.142 -11.686 377 HB2 ASP 55 1HB ASP 55 -18.500 25.627 -11.491 378 HB3 ASP 55 2HB ASP 55 -17.148 25.827 -12.603 379 HA PRO 56 HA PRO 56 -12.795 24.059 -11.713 380 HB2 PRO 56 1HB PRO 56 -12.246 23.763 -14.355 381 HB3 PRO 56 2HB PRO 56 -12.586 22.397 -13.286 382 HG2 PRO 56 1HG PRO 56 -14.407 23.803 -15.202 383 HG3 PRO 56 2HG PRO 56 -14.223 22.064 -14.904 384 HD2 PRO 56 1HD PRO 56 -16.250 23.518 -13.850 385 HD3 PRO 56 2HD PRO 56 -15.540 22.123 -13.012 386 H PHE 57 H PHE 57 -11.150 25.477 -12.761 387 HA PHE 57 HA PHE 57 -12.356 28.077 -13.392 388 HB2 PHE 57 1HB PHE 57 -10.893 28.150 -11.481 389 HB3 PHE 57 2HB PHE 57 -9.610 27.336 -12.370 390 HD1 PHE 57 HD1 PHE 57 -11.791 30.190 -13.343 391 HD2 PHE 57 HD2 PHE 57 -7.851 28.825 -12.489 392 HE1 PHE 57 HE1 PHE 57 -10.889 32.373 -14.031 393 HE2 PHE 57 HE2 PHE 57 -6.942 31.006 -13.175 394 HZ PHE 57 HZ PHE 57 -8.462 32.784 -13.947 395 H ALA 58 H ALA 58 -12.548 28.415 -15.509 396 HA ALA 58 HA ALA 58 -10.607 27.290 -17.367 397 HB1 ALA 58 1HB ALA 58 -12.229 28.452 -19.043 398 HB2 ALA 58 2HB ALA 58 -12.726 26.976 -18.216 399 HB3 ALA 58 3HB ALA 58 -13.303 28.542 -17.647 400 H PHE 59 H PHE 59 -8.806 28.406 -17.721 401 HA PHE 59 HA PHE 59 -9.024 31.301 -18.170 402 HB2 PHE 59 1HB PHE 59 -7.081 31.772 -16.885 403 HB3 PHE 59 2HB PHE 59 -8.091 30.741 -15.877 404 HD1 PHE 59 HD1 PHE 59 -5.017 30.934 -17.855 405 HD2 PHE 59 HD2 PHE 59 -7.414 28.505 -15.311 406 HE1 PHE 59 HE1 PHE 59 -3.135 29.373 -17.579 407 HE2 PHE 59 HE2 PHE 59 -5.536 26.941 -15.029 408 HZ PHE 59 HZ PHE 59 -3.393 27.374 -16.163 409 H VAL 60 H VAL 60 -7.455 32.190 -19.589 410 HA VAL 60 HA VAL 60 -6.585 30.318 -21.617 411 HB VAL 60 HB VAL 60 -6.302 33.325 -21.509 412 HG11 VAL 60 1HG1 VAL 60 -4.927 33.076 -23.239 413 HG12 VAL 60 2HG1 VAL 60 -5.224 31.338 -23.301 414 HG13 VAL 60 3HG1 VAL 60 -6.297 32.448 -24.155 415 HG21 VAL 60 3HG2 VAL 60 -8.645 32.449 -21.526 416 HG22 VAL 60 1HG2 VAL 60 -8.224 33.433 -22.928 417 HG23 VAL 60 2HG2 VAL 60 -8.285 31.676 -23.070 418 H LEU 61 H LEU 61 -4.695 29.320 -21.466 419 HA LEU 61 HA LEU 61 -2.623 30.133 -19.709 420 HB2 LEU 61 1HB LEU 61 -2.698 27.850 -20.094 421 HB3 LEU 61 2HB LEU 61 -2.897 28.049 -21.833 422 HG LEU 61 HG LEU 61 -0.572 28.590 -22.096 423 HD11 LEU 61 1HD1 LEU 61 -0.738 29.101 -19.246 424 HD12 LEU 61 2HD1 LEU 61 0.435 29.672 -20.432 425 HD13 LEU 61 3HD1 LEU 61 0.650 28.098 -19.668 426 HD21 LEU 61 3HD2 LEU 61 -0.064 26.429 -22.124 427 HD22 LEU 61 1HD2 LEU 61 -1.540 26.117 -21.210 428 HD23 LEU 61 2HD2 LEU 61 -0.014 26.367 -20.361 429 H GLY 62 H GLY 62 -0.969 31.484 -20.010 430 HA2 GLY 62 1HA GLY 62 0.700 31.896 -22.051 431 HA3 GLY 62 2HA GLY 62 -0.705 32.803 -22.590 432 H GLY 63 H GLY 63 -1.356 33.477 -19.736 433 HA2 GLY 63 1HA GLY 63 -0.129 34.759 -18.016 434 HA3 GLY 63 2HA GLY 63 0.763 35.499 -19.336 435 H GLY 64 H GLY 64 -1.087 36.529 -17.138 436 HA2 GLY 64 1HA GLY 64 -1.983 38.837 -17.988 437 HA3 GLY 64 2HA GLY 64 -3.160 37.798 -18.778 438 H MET 65 H MET 65 -4.173 36.137 -17.193 439 HA MET 65 HA MET 65 -5.138 37.684 -14.906 440 HB2 MET 65 1HB MET 65 -6.245 35.507 -16.595 441 HB3 MET 65 2HB MET 65 -6.749 35.541 -14.910 442 HG2 MET 65 1HG MET 65 -7.631 37.750 -15.150 443 HG3 MET 65 2HG MET 65 -6.968 37.886 -16.777 444 HE1 MET 65 3HE MET 65 -8.397 37.447 -18.860 445 HE2 MET 65 1HE MET 65 -10.139 37.383 -18.585 446 HE3 MET 65 2HE MET 65 -9.168 38.632 -17.805 447 H VAL 66 H VAL 66 -3.198 34.956 -15.682 448 HA VAL 66 HA VAL 66 -3.334 33.915 -12.948 449 HB VAL 66 HB VAL 66 -2.109 31.999 -13.739 450 HG11 VAL 66 1HG1 VAL 66 -4.040 31.175 -14.456 451 HG12 VAL 66 2HG1 VAL 66 -4.626 32.809 -14.773 452 HG13 VAL 66 3HG1 VAL 66 -3.776 31.915 -16.035 453 HG21 VAL 66 3HG2 VAL 66 -0.551 33.077 -15.238 454 HG22 VAL 66 1HG2 VAL 66 -1.416 31.809 -16.106 455 HG23 VAL 66 2HG2 VAL 66 -1.857 33.500 -16.345 456 H ILE 67 H ILE 67 -1.012 33.006 -12.282 457 HA ILE 67 HA ILE 67 0.770 35.343 -12.339 458 HB ILE 67 HB ILE 67 1.651 34.678 -10.254 459 HG12 ILE 67 1HG1 ILE 67 0.222 32.051 -10.697 460 HG13 ILE 67 2HG1 ILE 67 1.961 32.316 -10.636 461 HG21 ILE 67 1HG2 ILE 67 -0.130 35.293 -9.061 462 HG22 ILE 67 2HG2 ILE 67 -1.032 35.224 -10.575 463 HG23 ILE 67 3HG2 ILE 67 -1.022 33.833 -9.491 464 HD11 ILE 67 3HD1 ILE 67 1.867 31.769 -8.496 465 HD12 ILE 67 1HD1 ILE 67 1.014 33.286 -8.213 466 HD13 ILE 67 2HD1 ILE 67 0.104 31.802 -8.501 467 H LYS 68 H LYS 68 3.129 34.844 -12.175 468 HA LYS 68 HA LYS 68 4.079 33.506 -14.368 469 HB2 LYS 68 1HB LYS 68 5.427 34.048 -11.723 470 HB3 LYS 68 2HB LYS 68 6.283 33.407 -13.120 471 HG2 LYS 68 1HG LYS 68 6.169 35.379 -14.272 472 HG3 LYS 68 2HG LYS 68 4.701 35.905 -13.444 473 HD2 LYS 68 1HD LYS 68 7.188 35.597 -11.840 474 HD3 LYS 68 2HD LYS 68 7.059 36.988 -12.920 475 HE2 LYS 68 1HE LYS 68 4.919 36.262 -10.933 476 HE3 LYS 68 2HE LYS 68 6.267 37.325 -10.533 477 HZ1 LYS 68 3HZ LYS 68 5.093 38.981 -11.383 478 HZ2 LYS 68 1HZ LYS 68 3.879 37.931 -11.920 479 HZ3 LYS 68 2HZ LYS 68 5.209 38.264 -12.910 480 H GLY 69 H GLY 69 4.089 32.244 -11.027 481 HA2 GLY 69 1HA GLY 69 5.092 29.718 -11.544 482 HA3 GLY 69 2HA GLY 69 3.977 30.091 -10.237 483 H TRP 70 H TRP 70 1.869 30.949 -12.111 484 HA TRP 70 HA TRP 70 0.627 28.408 -12.459 485 HB2 TRP 70 1HB TRP 70 -0.191 31.125 -12.419 486 HB3 TRP 70 2HB TRP 70 -0.725 30.444 -13.953 487 HD1 TRP 70 HD1 TRP 70 -2.823 28.924 -13.907 488 HE1 TRP 70 HE1 TRP 70 -4.371 28.036 -12.052 489 HE3 TRP 70 HE3 TRP 70 -0.082 30.322 -9.825 490 HZ2 TRP 70 HZ2 TRP 70 -4.423 27.942 -9.231 491 HZ3 TRP 70 HZ3 TRP 70 -0.952 29.796 -7.584 492 HH2 TRP 70 HH2 TRP 70 -3.078 28.631 -7.295 493 H ASP 71 H ASP 71 1.653 30.906 -14.790 494 HA ASP 71 HA ASP 71 1.072 29.535 -17.126 495 HB2 ASP 71 1HB ASP 71 1.658 31.786 -17.397 496 HB3 ASP 71 2HB ASP 71 3.131 31.614 -16.446 497 H GLU 72 H GLU 72 4.074 29.500 -15.228 498 HA GLU 72 HA GLU 72 5.503 27.770 -16.929 499 HB2 GLU 72 1HB GLU 72 6.348 29.242 -14.975 500 HB3 GLU 72 2HB GLU 72 5.925 27.873 -13.956 501 HG2 GLU 72 1HG GLU 72 7.797 27.714 -16.304 502 HG3 GLU 72 2HG GLU 72 8.312 27.954 -14.635 503 H GLY 73 H GLY 73 3.675 27.110 -13.943 504 HA2 GLY 73 1HA GLY 73 4.089 24.334 -13.904 505 HA3 GLY 73 2HA GLY 73 2.752 25.173 -13.131 506 H VAL 74 H VAL 74 1.172 26.085 -14.985 507 HA VAL 74 HA VAL 74 -0.188 23.875 -15.991 508 HB VAL 74 HB VAL 74 -1.133 26.184 -15.641 509 HG11 VAL 74 1HG1 VAL 74 0.778 27.215 -17.033 510 HG12 VAL 74 2HG1 VAL 74 -0.218 26.792 -18.428 511 HG13 VAL 74 3HG1 VAL 74 -0.844 27.888 -17.196 512 HG21 VAL 74 3HG2 VAL 74 -2.013 25.607 -18.352 513 HG22 VAL 74 1HG2 VAL 74 -1.903 24.160 -17.350 514 HG23 VAL 74 2HG2 VAL 74 -2.902 25.518 -16.831 515 H GLN 75 H GLN 75 2.340 25.823 -17.419 516 HA GLN 75 HA GLN 75 2.056 25.125 -20.100 517 HB2 GLN 75 1HB GLN 75 4.201 26.186 -18.394 518 HB3 GLN 75 2HB GLN 75 4.769 25.312 -19.810 519 HG2 GLN 75 1HG GLN 75 3.500 26.761 -21.262 520 HG3 GLN 75 2HG GLN 75 2.806 27.591 -19.871 521 HE21 GLN 75 2HE2 GLN 75 4.317 28.728 -22.037 522 HE22 GLN 75 1HE2 GLN 75 5.719 29.459 -21.341 523 H GLY 76 H GLY 76 3.070 23.235 -17.415 524 HA2 GLY 76 1HA GLY 76 4.065 21.138 -19.240 525 HA3 GLY 76 2HA GLY 76 4.548 21.299 -17.558 526 H MET 77 H MET 77 1.907 21.788 -16.531 527 HA MET 77 HA MET 77 1.092 19.232 -15.891 528 HB2 MET 77 1HB MET 77 -0.094 21.928 -15.695 529 HB3 MET 77 2HB MET 77 -1.242 20.597 -15.634 530 HG2 MET 77 1HG MET 77 1.174 20.454 -13.915 531 HG3 MET 77 2HG MET 77 -0.120 21.560 -13.461 532 HE1 MET 77 3HE MET 77 0.281 17.179 -13.042 533 HE2 MET 77 1HE MET 77 -0.315 17.422 -14.684 534 HE3 MET 77 2HE MET 77 1.154 18.239 -14.150 535 H LYS 78 H LYS 78 -0.602 17.887 -16.568 536 HA LYS 78 HA LYS 78 -1.627 18.444 -19.274 537 HB2 LYS 78 1HB LYS 78 -0.690 15.825 -18.098 538 HB3 LYS 78 2HB LYS 78 -1.604 15.942 -19.596 539 HG2 LYS 78 1HG LYS 78 0.153 16.775 -20.768 540 HG3 LYS 78 2HG LYS 78 0.850 17.586 -19.364 541 HD2 LYS 78 1HD LYS 78 0.797 14.594 -19.545 542 HD3 LYS 78 2HD LYS 78 2.066 15.527 -20.342 543 HE2 LYS 78 1HE LYS 78 2.744 16.492 -18.246 544 HE3 LYS 78 2HE LYS 78 1.380 15.747 -17.414 545 HZ1 LYS 78 3HZ LYS 78 3.933 14.668 -17.930 546 HZ2 LYS 78 1HZ LYS 78 2.764 13.704 -18.682 547 HZ3 LYS 78 2HZ LYS 78 2.668 14.007 -17.021 548 H VAL 79 H VAL 79 -3.659 17.320 -19.799 549 HA VAL 79 HA VAL 79 -5.690 17.856 -18.006 550 HB VAL 79 HB VAL 79 -5.750 15.764 -20.185 551 HG11 VAL 79 1HG1 VAL 79 -7.760 15.341 -19.282 552 HG12 VAL 79 2HG1 VAL 79 -7.772 16.844 -18.358 553 HG13 VAL 79 3HG1 VAL 79 -8.242 16.850 -20.058 554 HG21 VAL 79 3HG2 VAL 79 -5.636 17.418 -21.662 555 HG22 VAL 79 1HG2 VAL 79 -7.034 18.194 -20.917 556 HG23 VAL 79 2HG2 VAL 79 -5.408 18.574 -20.350 557 H GLY 80 H GLY 80 -6.369 16.921 -16.194 558 HA2 GLY 80 1HA GLY 80 -7.016 15.166 -14.792 559 HA3 GLY 80 2HA GLY 80 -6.217 14.036 -15.875 560 H GLY 81 H GLY 81 -4.063 16.464 -15.372 561 HA2 GLY 81 1HA GLY 81 -2.576 14.838 -13.464 562 HA3 GLY 81 2HA GLY 81 -1.952 16.199 -14.384 563 H VAL 82 H VAL 82 -2.100 15.371 -11.411 564 HA VAL 82 HA VAL 82 -3.009 18.002 -10.441 565 HB VAL 82 HB VAL 82 -3.128 15.424 -8.874 566 HG11 VAL 82 1HG1 VAL 82 -4.793 17.132 -7.624 567 HG12 VAL 82 2HG1 VAL 82 -3.093 16.934 -7.196 568 HG13 VAL 82 3HG1 VAL 82 -3.591 18.265 -8.241 569 HG21 VAL 82 3HG2 VAL 82 -5.712 16.315 -9.208 570 HG22 VAL 82 1HG2 VAL 82 -4.981 16.594 -10.789 571 HG23 VAL 82 2HG2 VAL 82 -4.958 14.980 -10.079 572 H ARG 83 H ARG 83 -1.469 19.184 -9.526 573 HA ARG 83 HA ARG 83 0.687 17.897 -8.049 574 HB2 ARG 83 1HB ARG 83 2.457 18.921 -9.256 575 HB3 ARG 83 2HB ARG 83 1.415 18.167 -10.456 576 HG2 ARG 83 1HG ARG 83 0.426 20.310 -10.991 577 HG3 ARG 83 2HG ARG 83 1.383 21.088 -9.729 578 HD2 ARG 83 1HD ARG 83 2.265 21.332 -12.076 579 HD3 ARG 83 2HD ARG 83 3.406 20.695 -10.893 580 HE ARG 83 HE ARG 83 2.031 18.608 -12.253 581 HH11 ARG 83 1HH1 ARG 83 4.615 20.918 -12.579 582 HH12 ARG 83 2HH1 ARG 83 5.497 19.965 -13.726 583 HH21 ARG 83 1HH2 ARG 83 3.183 17.344 -13.763 584 HH22 ARG 83 2HH2 ARG 83 4.681 17.933 -14.399 585 H ARG 84 H ARG 84 1.516 19.141 -6.415 586 HA ARG 84 HA ARG 84 0.004 21.526 -5.753 587 HB2 ARG 84 1HB ARG 84 0.682 19.600 -4.148 588 HB3 ARG 84 2HB ARG 84 2.244 20.406 -4.099 589 HG2 ARG 84 1HG ARG 84 1.433 22.216 -2.958 590 HG3 ARG 84 2HG ARG 84 -0.206 22.009 -3.578 591 HD2 ARG 84 1HD ARG 84 0.058 21.471 -1.154 592 HD3 ARG 84 2HD ARG 84 -0.599 20.156 -2.127 593 HE ARG 84 HE ARG 84 2.174 19.842 -1.993 594 HH11 ARG 84 1HH1 ARG 84 -0.605 19.724 0.100 595 HH12 ARG 84 2HH1 ARG 84 0.101 18.577 1.189 596 HH21 ARG 84 1HH2 ARG 84 3.115 18.331 -0.566 597 HH22 ARG 84 2HH2 ARG 84 2.217 17.786 0.810 598 H LEU 85 H LEU 85 0.663 23.306 -6.808 599 HA LEU 85 HA LEU 85 3.482 23.792 -7.290 600 HB2 LEU 85 1HB LEU 85 1.770 24.290 -9.001 601 HB3 LEU 85 2HB LEU 85 1.087 25.508 -7.926 602 HG LEU 85 HG LEU 85 3.735 26.263 -8.149 603 HD11 LEU 85 1HD1 LEU 85 3.790 26.400 -10.764 604 HD12 LEU 85 2HD1 LEU 85 2.810 24.939 -10.652 605 HD13 LEU 85 3HD1 LEU 85 4.415 24.982 -9.923 606 HD21 LEU 85 3HD2 LEU 85 2.852 28.201 -8.948 607 HD22 LEU 85 1HD2 LEU 85 1.371 27.453 -8.350 608 HD23 LEU 85 2HD2 LEU 85 1.765 27.378 -10.068 609 H THR 86 H THR 86 4.746 24.847 -5.925 610 HA THR 86 HA THR 86 3.513 26.471 -3.814 611 HB THR 86 HB THR 86 6.418 25.914 -3.707 612 HG1 THR 86 HG1 THR 86 4.451 23.878 -3.361 613 HG21 THR 86 3HG2 THR 86 4.529 25.273 -1.512 614 HG22 THR 86 1HG2 THR 86 4.684 26.969 -1.969 615 HG23 THR 86 2HG2 THR 86 6.106 26.061 -1.455 616 H ILE 87 H ILE 87 3.499 28.596 -4.082 617 HA ILE 87 HA ILE 87 5.630 29.829 -5.701 618 HB ILE 87 HB ILE 87 2.910 31.012 -5.161 619 HG12 ILE 87 1HG1 ILE 87 3.055 30.299 -7.855 620 HG13 ILE 87 2HG1 ILE 87 3.700 28.904 -6.999 621 HG21 ILE 87 1HG2 ILE 87 3.491 32.439 -7.096 622 HG22 ILE 87 2HG2 ILE 87 4.585 32.647 -5.730 623 HG23 ILE 87 3HG2 ILE 87 5.090 31.696 -7.126 624 HD11 ILE 87 3HD1 ILE 87 1.664 28.263 -6.439 625 HD12 ILE 87 1HD1 ILE 87 1.337 29.822 -5.682 626 HD13 ILE 87 2HD1 ILE 87 1.016 29.592 -7.401 627 HA PRO 88 HA PRO 88 6.950 31.814 -1.970 628 HB2 PRO 88 1HB PRO 88 8.653 33.588 -3.120 629 HB3 PRO 88 2HB PRO 88 9.035 31.872 -2.933 630 HG2 PRO 88 1HG PRO 88 8.027 33.336 -5.341 631 HG3 PRO 88 2HG PRO 88 9.289 32.095 -5.233 632 HD2 PRO 88 1HD PRO 88 6.768 31.543 -6.056 633 HD3 PRO 88 2HD PRO 88 7.762 30.369 -5.168 634 HA PRO 89 HA PRO 89 4.729 35.576 -1.468 635 HB2 PRO 89 1HB PRO 89 6.421 37.111 -0.001 636 HB3 PRO 89 2HB PRO 89 5.577 35.707 0.664 637 HG2 PRO 89 1HG PRO 89 8.393 35.931 -0.330 638 HG3 PRO 89 2HG PRO 89 7.779 35.110 1.118 639 HD2 PRO 89 1HD PRO 89 8.401 33.781 -1.158 640 HD3 PRO 89 2HD PRO 89 7.101 33.254 -0.069 641 H GLN 90 H GLN 90 7.563 35.514 -3.292 642 HA GLN 90 HA GLN 90 7.444 38.345 -3.998 643 HB2 GLN 90 1HB GLN 90 9.348 36.246 -5.040 644 HB3 GLN 90 2HB GLN 90 9.513 37.992 -5.172 645 HG2 GLN 90 1HG GLN 90 9.444 37.862 -2.547 646 HG3 GLN 90 2HG GLN 90 9.982 36.210 -2.844 647 HE21 GLN 90 2HE2 GLN 90 11.948 35.900 -4.021 648 HE22 GLN 90 1HE2 GLN 90 13.180 37.111 -3.987 649 H LEU 91 H LEU 91 7.095 35.149 -5.483 650 HA LEU 91 HA LEU 91 6.179 36.372 -7.971 651 HB2 LEU 91 1HB LEU 91 6.432 33.436 -7.382 652 HB3 LEU 91 2HB LEU 91 6.369 34.226 -8.956 653 HG LEU 91 HG LEU 91 8.657 34.245 -6.993 654 HD11 LEU 91 1HD1 LEU 91 7.941 32.559 -9.175 655 HD12 LEU 91 2HD1 LEU 91 9.362 32.483 -8.134 656 HD13 LEU 91 3HD1 LEU 91 9.395 33.461 -9.601 657 HD21 LEU 91 3HD2 LEU 91 8.059 35.963 -9.346 658 HD22 LEU 91 1HD2 LEU 91 9.723 35.439 -9.088 659 HD23 LEU 91 2HD2 LEU 91 8.885 36.356 -7.836 660 H GLY 92 H GLY 92 4.628 36.388 -5.408 661 HA2 GLY 92 1HA GLY 92 2.223 34.984 -6.399 662 HA3 GLY 92 2HA GLY 92 2.586 35.188 -4.692 663 H TYR 93 H TYR 93 1.457 36.720 -3.720 664 HA TYR 93 HA TYR 93 -0.329 38.426 -4.952 665 HB2 TYR 93 1HB TYR 93 1.026 38.518 -2.270 666 HB3 TYR 93 2HB TYR 93 -0.089 39.789 -2.760 667 HD1 TYR 93 HD2 TYR 93 0.125 36.079 -2.433 668 HD2 TYR 93 HD1 TYR 93 -2.362 39.531 -2.357 669 HE1 TYR 93 HE2 TYR 93 -1.769 34.692 -1.698 670 HE2 TYR 93 HE1 TYR 93 -4.262 38.154 -1.621 671 HH TYR 93 HH TYR 93 -3.876 34.687 -0.976 672 H GLY 94 H GLY 94 2.726 39.490 -3.434 673 HA2 GLY 94 1HA GLY 94 4.138 40.780 -5.176 674 HA3 GLY 94 2HA GLY 94 2.713 41.807 -5.246 675 H ALA 95 H ALA 95 4.401 43.430 -4.639 676 HA ALA 95 HA ALA 95 5.691 43.462 -2.166 677 HB1 ALA 95 1HB ALA 95 5.474 45.180 -4.336 678 HB2 ALA 95 2HB ALA 95 4.845 46.107 -2.973 679 HB3 ALA 95 3HB ALA 95 6.465 45.415 -2.896 680 H ARG 96 H ARG 96 2.392 44.229 -3.030 681 HA ARG 96 HA ARG 96 1.745 45.531 -0.566 682 HB2 ARG 96 1HB ARG 96 0.165 44.497 -2.894 683 HB3 ARG 96 2HB ARG 96 -0.661 44.972 -1.417 684 HG2 ARG 96 1HG ARG 96 1.214 46.778 -2.921 685 HG3 ARG 96 2HG ARG 96 -0.530 46.734 -3.187 686 HD2 ARG 96 1HD ARG 96 -0.908 47.330 -0.851 687 HD3 ARG 96 2HD ARG 96 0.832 47.341 -0.565 688 HE ARG 96 HE ARG 96 0.220 49.108 -2.666 689 HH11 ARG 96 1HH1 ARG 96 -0.152 48.786 0.781 690 HH12 ARG 96 2HH1 ARG 96 -0.167 50.494 1.070 691 HH21 ARG 96 1HH2 ARG 96 0.202 51.359 -2.297 692 HH22 ARG 96 2HH2 ARG 96 0.034 51.957 -0.681 693 H GLY 97 H GLY 97 0.476 42.474 -1.907 694 HA2 GLY 97 1HA GLY 97 -0.054 40.485 -0.888 695 HA3 GLY 97 2HA GLY 97 1.094 40.920 0.370 696 H ALA 98 H ALA 98 -1.429 39.574 0.703 697 HA ALA 98 HA ALA 98 -3.546 41.141 1.523 698 HB1 ALA 98 1HB ALA 98 -2.632 38.595 2.856 699 HB2 ALA 98 2HB ALA 98 -4.259 39.277 2.877 700 HB3 ALA 98 3HB ALA 98 -3.576 38.673 1.368 701 H GLY 99 H GLY 99 -4.282 41.679 3.712 702 HA2 GLY 99 1HA GLY 99 -2.570 43.367 5.069 703 HA3 GLY 99 2HA GLY 99 -4.017 42.660 5.773 704 H GLY 100 H GLY 100 -3.707 40.291 6.471 705 HA2 GLY 100 1HA GLY 100 -1.042 40.026 7.722 706 HA3 GLY 100 2HA GLY 100 -2.528 39.671 8.590 707 H VAL 101 H VAL 101 -3.769 38.409 6.241 708 HA VAL 101 HA VAL 101 -3.128 35.753 6.735 709 HB VAL 101 HB VAL 101 -4.314 36.881 4.195 710 HG11 VAL 101 1HG1 VAL 101 -4.532 34.112 5.370 711 HG12 VAL 101 2HG1 VAL 101 -5.268 34.680 3.870 712 HG13 VAL 101 3HG1 VAL 101 -3.513 34.556 4.001 713 HG21 VAL 101 3HG2 VAL 101 -5.580 36.037 6.795 714 HG22 VAL 101 1HG2 VAL 101 -5.635 37.626 6.031 715 HG23 VAL 101 2HG2 VAL 101 -6.485 36.265 5.298 716 H ILE 102 H ILE 102 -1.724 38.023 4.480 717 HA ILE 102 HA ILE 102 0.107 35.909 3.547 718 HB ILE 102 HB ILE 102 -0.674 38.449 2.110 719 HG12 ILE 102 1HG1 ILE 102 -2.457 36.731 2.158 720 HG13 ILE 102 2HG1 ILE 102 -1.824 36.990 0.536 721 HG21 ILE 102 1HG2 ILE 102 1.261 38.182 1.040 722 HG22 ILE 102 2HG2 ILE 102 1.537 36.605 1.778 723 HG23 ILE 102 3HG2 ILE 102 0.555 36.735 0.319 724 HD11 ILE 102 3HD1 ILE 102 -0.430 34.975 0.799 725 HD12 ILE 102 1HD1 ILE 102 -1.173 34.700 2.374 726 HD13 ILE 102 2HD1 ILE 102 -2.158 34.643 0.912 727 HA PRO 103 HA PRO 103 2.623 38.868 6.061 728 HB2 PRO 103 1HB PRO 103 4.126 36.936 7.235 729 HB3 PRO 103 2HB PRO 103 2.560 37.455 7.871 730 HG2 PRO 103 1HG PRO 103 3.226 35.066 6.194 731 HG3 PRO 103 2HG PRO 103 2.156 35.181 7.604 732 HD2 PRO 103 1HD PRO 103 1.221 35.149 5.063 733 HD3 PRO 103 2HD PRO 103 0.412 36.042 6.367 734 HA PRO 104 HA PRO 104 6.180 38.921 3.476 735 HB2 PRO 104 1HB PRO 104 8.162 39.621 5.194 736 HB3 PRO 104 2HB PRO 104 6.909 40.749 4.662 737 HG2 PRO 104 1HG PRO 104 7.093 39.187 7.209 738 HG3 PRO 104 2HG PRO 104 6.619 40.878 6.966 739 HD2 PRO 104 1HD PRO 104 4.811 38.897 7.339 740 HD3 PRO 104 2HD PRO 104 4.477 40.316 6.327 741 H ASN 105 H ASN 105 7.918 37.702 2.775 742 HA ASN 105 HA ASN 105 9.145 35.803 2.507 743 HB2 ASN 105 1HB ASN 105 9.507 36.300 5.463 744 HB3 ASN 105 2HB ASN 105 10.384 35.048 4.589 745 HD21 ASN 105 2HD2 ASN 105 11.277 37.512 5.970 746 HD22 ASN 105 1HD2 ASN 105 12.203 38.378 4.795 747 H ALA 106 H ALA 106 6.370 35.390 2.774 748 HA ALA 106 HA ALA 106 6.251 32.840 4.244 749 HB1 ALA 106 1HB ALA 106 3.744 34.109 3.325 750 HB2 ALA 106 2HB ALA 106 4.102 33.251 4.825 751 HB3 ALA 106 3HB ALA 106 4.619 34.925 4.621 752 H THR 107 H THR 107 5.977 31.007 3.139 753 HA THR 107 HA THR 107 5.817 31.127 0.249 754 HB THR 107 HB THR 107 6.108 28.766 2.115 755 HG1 THR 107 HG1 THR 107 8.198 29.097 1.892 756 HG21 THR 107 3HG2 THR 107 6.906 27.700 -0.120 757 HG22 THR 107 1HG2 THR 107 5.935 28.967 -0.868 758 HG23 THR 107 2HG2 THR 107 5.178 27.802 0.219 759 H LEU 108 H LEU 108 4.031 30.845 -0.917 760 HA LEU 108 HA LEU 108 1.575 30.047 0.457 761 HB2 LEU 108 1HB LEU 108 1.790 31.083 -2.353 762 HB3 LEU 108 2HB LEU 108 0.380 31.076 -1.296 763 HG LEU 108 HG LEU 108 1.957 32.671 0.147 764 HD11 LEU 108 1HD1 LEU 108 3.040 32.742 -2.627 765 HD12 LEU 108 2HD1 LEU 108 3.883 32.859 -1.083 766 HD13 LEU 108 3HD1 LEU 108 2.965 34.236 -1.693 767 HD21 LEU 108 3HD2 LEU 108 -0.310 33.146 -0.725 768 HD22 LEU 108 1HD2 LEU 108 0.412 33.617 -2.264 769 HD23 LEU 108 2HD2 LEU 108 0.769 34.540 -0.803 770 H VAL 109 H VAL 109 0.719 28.096 0.199 771 HA VAL 109 HA VAL 109 1.814 26.341 -1.874 772 HB VAL 109 HB VAL 109 0.147 25.694 0.561 773 HG11 VAL 109 1HG1 VAL 109 -0.384 23.818 -0.521 774 HG12 VAL 109 2HG1 VAL 109 0.756 24.156 -1.825 775 HG13 VAL 109 3HG1 VAL 109 1.310 23.358 -0.352 776 HG21 VAL 109 3HG2 VAL 109 2.769 26.354 0.512 777 HG22 VAL 109 1HG2 VAL 109 2.050 25.246 1.681 778 HG23 VAL 109 2HG2 VAL 109 2.868 24.612 0.253 779 H PHE 110 H PHE 110 0.728 26.325 -3.727 780 HA PHE 110 HA PHE 110 -2.216 26.417 -3.625 781 HB2 PHE 110 1HB PHE 110 -0.268 27.566 -5.606 782 HB3 PHE 110 2HB PHE 110 -1.930 27.221 -6.074 783 HD1 PHE 110 HD2 PHE 110 0.239 29.311 -3.994 784 HD2 PHE 110 HD1 PHE 110 -3.757 28.540 -5.239 785 HE1 PHE 110 HE2 PHE 110 -0.465 31.478 -3.064 786 HE2 PHE 110 HE1 PHE 110 -4.468 30.705 -4.312 787 HZ PHE 110 HZ PHE 110 -2.822 32.177 -3.222 788 H GLU 111 H GLU 111 -3.327 24.785 -4.524 789 HA GLU 111 HA GLU 111 -1.775 22.646 -5.802 790 HB2 GLU 111 1HB GLU 111 -3.358 22.368 -3.708 791 HB3 GLU 111 2HB GLU 111 -4.613 22.287 -4.937 792 HG2 GLU 111 1HG GLU 111 -3.279 20.459 -6.027 793 HG3 GLU 111 2HG GLU 111 -2.256 20.458 -4.592 794 H VAL 112 H VAL 112 -1.970 22.285 -7.908 795 HA VAL 112 HA VAL 112 -4.321 23.386 -9.307 796 HB VAL 112 HB VAL 112 -1.534 23.039 -10.422 797 HG11 VAL 112 1HG1 VAL 112 -4.121 23.987 -11.601 798 HG12 VAL 112 2HG1 VAL 112 -2.571 24.521 -12.253 799 HG13 VAL 112 3HG1 VAL 112 -2.977 22.805 -12.236 800 HG21 VAL 112 3HG2 VAL 112 -1.693 25.596 -10.525 801 HG22 VAL 112 1HG2 VAL 112 -3.003 25.428 -9.355 802 HG23 VAL 112 2HG2 VAL 112 -1.383 24.856 -8.954 803 H GLU 113 H GLU 113 -5.604 21.914 -10.189 804 HA GLU 113 HA GLU 113 -4.432 19.350 -11.042 805 HB2 GLU 113 1HB GLU 113 -6.836 18.475 -10.477 806 HB3 GLU 113 2HB GLU 113 -5.635 18.647 -9.204 807 HG2 GLU 113 1HG GLU 113 -7.281 21.027 -9.677 808 HG3 GLU 113 2HG GLU 113 -8.157 19.616 -9.087 809 H LEU 114 H LEU 114 -4.424 19.447 -13.199 810 HA LEU 114 HA LEU 114 -6.177 20.966 -14.780 811 HB2 LEU 114 1HB LEU 114 -4.151 18.869 -15.243 812 HB3 LEU 114 2HB LEU 114 -5.352 19.081 -16.516 813 HG LEU 114 HG LEU 114 -3.147 20.334 -16.757 814 HD11 LEU 114 1HD1 LEU 114 -4.692 22.549 -17.166 815 HD12 LEU 114 2HD1 LEU 114 -5.887 21.253 -17.183 816 HD13 LEU 114 3HD1 LEU 114 -4.518 21.203 -18.293 817 HD21 LEU 114 3HD2 LEU 114 -4.435 22.063 -14.647 818 HD22 LEU 114 1HD2 LEU 114 -2.989 22.463 -15.574 819 HD23 LEU 114 2HD2 LEU 114 -2.966 21.106 -14.448 820 H LEU 115 H LEU 115 -8.175 20.610 -15.505 821 HA LEU 115 HA LEU 115 -9.388 17.989 -14.973 822 HB2 LEU 115 1HB LEU 115 -10.498 20.759 -15.223 823 HB3 LEU 115 2HB LEU 115 -11.539 19.350 -15.410 824 HG LEU 115 HG LEU 115 -10.181 18.911 -13.018 825 HD11 LEU 115 1HD1 LEU 115 -10.581 21.791 -13.520 826 HD12 LEU 115 2HD1 LEU 115 -9.437 20.967 -12.461 827 HD13 LEU 115 3HD1 LEU 115 -11.110 21.187 -11.949 828 HD21 LEU 115 3HD2 LEU 115 -12.425 19.398 -12.027 829 HD22 LEU 115 1HD2 LEU 115 -12.450 18.270 -13.382 830 HD23 LEU 115 2HD2 LEU 115 -12.946 19.945 -13.621 831 H ASP 116 H ASP 116 -9.488 20.583 -17.418 832 HA ASP 116 HA ASP 116 -9.373 18.628 -19.543 833 HB2 ASP 116 1HB ASP 116 -11.814 18.800 -18.903 834 HB3 ASP 116 2HB ASP 116 -11.757 20.479 -19.433 835 H VAL 117 H VAL 117 -9.234 19.669 -21.692 836 HA VAL 117 HA VAL 117 -8.533 22.502 -21.658 837 HB VAL 117 HB VAL 117 -6.392 22.190 -22.718 838 HG11 VAL 117 1HG1 VAL 117 -6.465 22.176 -20.262 839 HG12 VAL 117 2HG1 VAL 117 -6.586 20.415 -20.286 840 HG13 VAL 117 3HG1 VAL 117 -5.131 21.209 -20.890 841 HG21 VAL 117 3HG2 VAL 117 -6.291 20.349 -24.020 842 HG22 VAL 117 1HG2 VAL 117 -5.615 19.612 -22.567 843 HG23 VAL 117 2HG2 VAL 117 -7.324 19.403 -22.948 844 H11 L2S 130 1H1 L2S 130 -5.319 30.656 -9.644 845 H21 L2S 130 2H1 L2S 130 -5.494 30.925 -11.445 846 H12 L2S 130 1H2 L2S 130 -4.688 33.168 -11.203 847 H22 L2S 130 2H2 L2S 130 -3.455 31.985 -10.550 848 H13 L2S 130 2H3 L2S 130 -4.206 32.482 -8.313 849 H23 L2S 130 1H3 L2S 130 -3.793 34.056 -9.140 850 H14 L2S 130 1H4 L2S 130 -6.928 32.015 -8.108 851 H24 L2S 130 2H4 L2S 130 -7.889 33.322 -8.943 852 H15 L2S 130 1H5 L2S 130 -7.650 31.189 -10.261 853 H25 L2S 130 2H5 L2S 130 -7.033 32.722 -11.048 854 H17 L2S 130 1H7 L2S 130 -7.288 36.506 -7.617 855 H27 L2S 130 2H7 L2S 130 -8.012 35.260 -8.765 856 H9 L2S 130 H9 L2S 130 -6.964 33.850 -3.968 857 H10 L2S 130 H10 L2S 130 -6.505 35.090 -1.852 858 H112 L2S 130 1H12 L2S 130 -7.716 38.817 -3.784 859 H113 L2S 130 1H13 L2S 130 -8.215 37.557 -5.869 860 H114 L2S 130 1H14 L2S 130 -6.168 37.135 -0.871 861 H214 L2S 130 2H14 L2S 130 -7.763 37.917 -0.985 862 H314 L2S 130 3H14 L2S 130 -6.347 38.663 -1.802 Start of MODEL 15 1 H1 GLY 1 H GLY 1 4.195 1.737 -1.394 2 HA2 GLY 1 1HA GLY 1 4.147 0.933 -4.145 3 HA3 GLY 1 2HA GLY 1 3.486 2.545 -3.916 4 HA PRO 2 HA PRO 2 8.123 2.783 -4.456 5 HB2 PRO 2 1HB PRO 2 8.061 4.548 -6.517 6 HB3 PRO 2 2HB PRO 2 7.996 2.797 -6.750 7 HG2 PRO 2 1HG PRO 2 5.764 4.792 -6.745 8 HG3 PRO 2 2HG PRO 2 6.039 3.424 -7.839 9 HD2 PRO 2 1HD PRO 2 4.281 3.314 -5.782 10 HD3 PRO 2 2HD PRO 2 5.187 1.893 -6.342 11 H GLY 3 H GLY 3 9.449 4.842 -4.453 12 HA2 GLY 3 1HA GLY 3 8.102 6.800 -2.717 13 HA3 GLY 3 2HA GLY 3 9.835 6.512 -2.778 14 H SER 4 H SER 4 11.040 7.881 -3.923 15 HA SER 4 HA SER 4 11.639 9.605 -5.281 16 HB2 SER 4 1HB SER 4 10.653 7.956 -6.986 17 HB3 SER 4 2HB SER 4 9.223 8.988 -6.978 18 HG SER 4 HG SER 4 11.539 9.343 -8.272 19 H MET 5 H MET 5 9.795 10.053 -3.064 20 HA MET 5 HA MET 5 8.030 12.167 -3.997 21 HB2 MET 5 1HB MET 5 8.455 10.760 -1.390 22 HB3 MET 5 2HB MET 5 7.649 12.323 -1.404 23 HG2 MET 5 1HG MET 5 5.896 11.498 -2.778 24 HG3 MET 5 2HG MET 5 6.758 9.990 -3.074 25 HE1 MET 5 3HE MET 5 3.986 11.082 0.278 26 HE2 MET 5 1HE MET 5 4.582 12.092 -1.040 27 HE3 MET 5 2HE MET 5 3.525 10.723 -1.387 28 H THR 6 H THR 6 9.479 13.743 -4.709 29 HA THR 6 HA THR 6 10.738 15.266 -2.549 30 HB THR 6 HB THR 6 12.624 14.078 -3.366 31 HG1 THR 6 HG1 THR 6 13.351 16.104 -3.205 32 HG21 THR 6 3HG2 THR 6 11.559 14.729 -6.108 33 HG22 THR 6 1HG2 THR 6 11.838 13.139 -5.399 34 HG23 THR 6 2HG2 THR 6 13.207 14.165 -5.831 35 H VAL 7 H VAL 7 10.824 17.478 -2.888 36 HA VAL 7 HA VAL 7 9.179 18.441 -5.117 37 HB VAL 7 HB VAL 7 10.019 19.950 -2.640 38 HG11 VAL 7 1HG1 VAL 7 7.978 20.517 -4.784 39 HG12 VAL 7 2HG1 VAL 7 8.117 21.424 -3.276 40 HG13 VAL 7 3HG1 VAL 7 9.445 21.432 -4.438 41 HG21 VAL 7 3HG2 VAL 7 7.827 19.487 -1.742 42 HG22 VAL 7 1HG2 VAL 7 7.388 18.585 -3.192 43 HG23 VAL 7 2HG2 VAL 7 8.637 17.965 -2.113 44 H VAL 8 H VAL 8 10.438 18.849 -6.840 45 HA VAL 8 HA VAL 8 13.103 19.905 -6.582 46 HB VAL 8 HB VAL 8 12.640 18.375 -8.398 47 HG11 VAL 8 1HG1 VAL 8 10.732 18.418 -9.530 48 HG12 VAL 8 2HG1 VAL 8 10.253 19.869 -8.647 49 HG13 VAL 8 3HG1 VAL 8 11.127 20.011 -10.173 50 HG21 VAL 8 3HG2 VAL 8 13.816 19.477 -10.063 51 HG22 VAL 8 1HG2 VAL 8 12.998 21.011 -9.766 52 HG23 VAL 8 2HG2 VAL 8 14.215 20.426 -8.631 53 H THR 9 H THR 9 13.831 21.941 -7.125 54 HA THR 9 HA THR 9 11.741 24.002 -7.398 55 HB THR 9 HB THR 9 14.497 24.503 -6.289 56 HG1 THR 9 HG1 THR 9 13.879 23.667 -4.449 57 HG21 THR 9 3HG2 THR 9 13.697 26.595 -6.550 58 HG22 THR 9 1HG2 THR 9 12.778 26.236 -5.089 59 HG23 THR 9 2HG2 THR 9 12.025 26.049 -6.673 60 H THR 10 H THR 10 12.302 25.912 -8.629 61 HA THR 10 HA THR 10 14.049 25.247 -10.892 62 HB THR 10 HB THR 10 12.856 26.932 -12.161 63 HG1 THR 10 HG1 THR 10 12.283 28.512 -10.781 64 HG21 THR 10 3HG2 THR 10 10.675 25.472 -10.720 65 HG22 THR 10 1HG2 THR 10 11.866 24.576 -11.662 66 HG23 THR 10 2HG2 THR 10 10.856 25.791 -12.445 67 H GLU 11 H GLU 11 14.673 27.612 -11.962 68 HA GLU 11 HA GLU 11 16.718 28.582 -10.218 69 HB2 GLU 11 1HB GLU 11 17.262 30.111 -12.086 70 HB3 GLU 11 2HB GLU 11 17.141 28.433 -12.596 71 HG2 GLU 11 1HG GLU 11 14.880 28.864 -13.440 72 HG3 GLU 11 2HG GLU 11 15.038 30.554 -12.963 73 H SER 12 H SER 12 13.642 29.838 -11.403 74 HA SER 12 HA SER 12 13.945 32.431 -10.269 75 HB2 SER 12 1HB SER 12 12.393 31.881 -12.156 76 HB3 SER 12 2HB SER 12 11.370 31.021 -11.006 77 HG SER 12 HG SER 12 12.106 33.690 -10.514 78 H GLY 13 H GLY 13 12.873 29.363 -9.059 79 HA2 GLY 13 1HA GLY 13 13.065 29.208 -6.576 80 HA3 GLY 13 2HA GLY 13 12.096 30.673 -6.526 81 H LEU 14 H LEU 14 10.484 29.592 -8.848 82 HA LEU 14 HA LEU 14 8.295 28.645 -7.463 83 HB2 LEU 14 1HB LEU 14 7.871 29.390 -9.618 84 HB3 LEU 14 2HB LEU 14 9.162 28.412 -10.315 85 HG LEU 14 HG LEU 14 6.863 26.968 -9.120 86 HD11 LEU 14 1HD1 LEU 14 6.650 28.845 -11.397 87 HD12 LEU 14 2HD1 LEU 14 5.427 28.311 -10.245 88 HD13 LEU 14 3HD1 LEU 14 5.894 27.262 -11.584 89 HD21 LEU 14 3HD2 LEU 14 7.294 25.723 -11.369 90 HD22 LEU 14 1HD2 LEU 14 8.419 25.528 -10.025 91 HD23 LEU 14 2HD2 LEU 14 8.814 26.618 -11.355 92 H LYS 15 H LYS 15 7.444 26.638 -7.000 93 HA LYS 15 HA LYS 15 9.141 24.299 -7.530 94 HB2 LYS 15 1HB LYS 15 8.094 25.249 -4.879 95 HB3 LYS 15 2HB LYS 15 8.413 23.542 -5.155 96 HG2 LYS 15 1HG LYS 15 10.735 24.021 -5.643 97 HG3 LYS 15 2HG LYS 15 10.435 25.752 -5.469 98 HD2 LYS 15 1HD LYS 15 9.899 23.791 -3.251 99 HD3 LYS 15 2HD LYS 15 11.474 24.556 -3.476 100 HE2 LYS 15 1HE LYS 15 10.549 26.059 -2.038 101 HE3 LYS 15 2HE LYS 15 9.974 26.743 -3.557 102 HZ1 LYS 15 3HZ LYS 15 8.477 25.671 -1.396 103 HZ2 LYS 15 1HZ LYS 15 8.097 24.866 -2.835 104 HZ3 LYS 15 2HZ LYS 15 7.938 26.547 -2.739 105 H TYR 16 H TYR 16 7.996 22.238 -7.280 106 HA TYR 16 HA TYR 16 5.105 22.305 -7.216 107 HB2 TYR 16 1HB TYR 16 5.033 21.052 -9.464 108 HB3 TYR 16 2HB TYR 16 5.254 22.797 -9.507 109 HD1 TYR 16 HD1 TYR 16 6.845 19.548 -10.075 110 HD2 TYR 16 HD2 TYR 16 7.369 23.768 -10.200 111 HE1 TYR 16 HE1 TYR 16 8.887 19.248 -11.413 112 HE2 TYR 16 HE2 TYR 16 9.412 23.481 -11.539 113 HH TYR 16 HH TYR 16 10.464 21.874 -12.970 114 H GLU 17 H GLU 17 4.202 20.341 -6.708 115 HA GLU 17 HA GLU 17 6.051 18.064 -6.444 116 HB2 GLU 17 1HB GLU 17 5.610 19.155 -4.251 117 HB3 GLU 17 2HB GLU 17 3.896 18.825 -4.466 118 HG2 GLU 17 1HG GLU 17 5.138 17.226 -2.988 119 HG3 GLU 17 2HG GLU 17 4.221 16.495 -4.305 120 H ASP 18 H ASP 18 5.400 16.404 -7.624 121 HA ASP 18 HA ASP 18 2.903 16.270 -8.913 122 HB2 ASP 18 1HB ASP 18 4.984 14.133 -8.419 123 HB3 ASP 18 2HB ASP 18 3.585 13.921 -9.468 124 H LEU 19 H LEU 19 0.984 15.510 -8.293 125 HA LEU 19 HA LEU 19 0.856 13.933 -5.806 126 HB2 LEU 19 1HB LEU 19 -0.654 16.293 -6.720 127 HB3 LEU 19 2HB LEU 19 -1.610 15.020 -5.965 128 HG LEU 19 HG LEU 19 0.192 15.214 -4.070 129 HD11 LEU 19 1HD1 LEU 19 0.432 17.829 -5.533 130 HD12 LEU 19 2HD1 LEU 19 1.718 16.720 -5.056 131 HD13 LEU 19 3HD1 LEU 19 0.848 17.641 -3.829 132 HD21 LEU 19 3HD2 LEU 19 -1.220 17.212 -3.172 133 HD22 LEU 19 1HD2 LEU 19 -1.983 15.645 -3.442 134 HD23 LEU 19 2HD2 LEU 19 -2.182 16.939 -4.625 135 H THR 20 H THR 20 -0.353 14.395 -9.055 136 HA THR 20 HA THR 20 -1.298 11.645 -9.082 137 HB THR 20 HB THR 20 -3.162 13.805 -10.052 138 HG1 THR 20 HG1 THR 20 -4.270 13.566 -8.094 139 HG21 THR 20 3HG2 THR 20 -3.310 11.407 -10.886 140 HG22 THR 20 1HG2 THR 20 -4.778 12.085 -10.184 141 HG23 THR 20 2HG2 THR 20 -3.783 10.972 -9.244 142 H GLU 21 H GLU 21 -0.334 10.790 -10.796 143 HA GLU 21 HA GLU 21 0.810 12.257 -12.896 144 HB2 GLU 21 1HB GLU 21 1.153 9.765 -12.056 145 HB3 GLU 21 2HB GLU 21 -0.001 9.420 -13.337 146 HG2 GLU 21 1HG GLU 21 2.120 9.152 -14.297 147 HG3 GLU 21 2HG GLU 21 1.524 10.703 -14.885 148 H GLY 22 H GLY 22 -0.119 13.267 -14.542 149 HA2 GLY 22 1HA GLY 22 -2.829 12.434 -15.346 150 HA3 GLY 22 2HA GLY 22 -2.158 14.042 -15.571 151 H SER 23 H SER 23 -2.956 11.247 -17.122 152 HA SER 23 HA SER 23 -0.954 11.674 -19.241 153 HB2 SER 23 1HB SER 23 -1.375 9.371 -19.945 154 HB3 SER 23 2HB SER 23 -0.924 9.412 -18.241 155 HG SER 23 HG SER 23 -2.703 8.083 -18.466 156 H GLY 24 H GLY 24 -2.538 13.533 -19.684 157 HA2 GLY 24 1HA GLY 24 -4.623 12.539 -21.528 158 HA3 GLY 24 2HA GLY 24 -4.864 13.953 -20.513 159 H ALA 25 H ALA 25 -3.155 15.706 -20.828 160 HA ALA 25 HA ALA 25 -1.682 15.905 -23.207 161 HB1 ALA 25 1HB ALA 25 -4.360 16.063 -23.757 162 HB2 ALA 25 2HB ALA 25 -3.898 17.760 -23.618 163 HB3 ALA 25 3HB ALA 25 -3.067 16.711 -24.767 164 H GLU 26 H GLU 26 -0.251 17.505 -22.953 165 HA GLU 26 HA GLU 26 -0.204 19.086 -20.634 166 HB2 GLU 26 1HB GLU 26 1.835 18.498 -21.817 167 HB3 GLU 26 2HB GLU 26 1.311 19.404 -23.229 168 HG2 GLU 26 1HG GLU 26 1.366 21.470 -21.868 169 HG3 GLU 26 2HG GLU 26 2.020 20.527 -20.530 170 H ALA 27 H ALA 27 -0.847 21.125 -20.186 171 HA ALA 27 HA ALA 27 -2.947 22.312 -21.528 172 HB1 ALA 27 1HB ALA 27 -1.649 22.794 -19.189 173 HB2 ALA 27 2HB ALA 27 -1.202 24.213 -20.137 174 HB3 ALA 27 3HB ALA 27 -2.903 23.828 -19.875 175 H ARG 28 H ARG 28 -3.106 23.347 -23.399 176 HA ARG 28 HA ARG 28 -0.712 24.128 -24.831 177 HB2 ARG 28 1HB ARG 28 -3.636 24.054 -25.558 178 HB3 ARG 28 2HB ARG 28 -2.422 24.747 -26.625 179 HG2 ARG 28 1HG ARG 28 -2.040 21.981 -25.584 180 HG3 ARG 28 2HG ARG 28 -3.175 22.268 -26.905 181 HD2 ARG 28 1HD ARG 28 -1.202 23.583 -27.965 182 HD3 ARG 28 2HD ARG 28 -0.211 22.668 -26.830 183 HE ARG 28 HE ARG 28 -1.505 21.675 -29.197 184 HH11 ARG 28 1HH1 ARG 28 -0.214 20.839 -26.073 185 HH12 ARG 28 2HH1 ARG 28 0.069 19.181 -26.489 186 HH21 ARG 28 1HH2 ARG 28 -1.137 19.494 -29.756 187 HH22 ARG 28 2HH2 ARG 28 -0.455 18.417 -28.585 188 H ALA 29 H ALA 29 -0.566 26.248 -25.895 189 HA ALA 29 HA ALA 29 -1.362 28.360 -24.037 190 HB1 ALA 29 1HB ALA 29 0.885 28.613 -24.408 191 HB2 ALA 29 2HB ALA 29 0.783 28.072 -26.084 192 HB3 ALA 29 3HB ALA 29 0.233 29.689 -25.644 193 H GLY 30 H GLY 30 -2.424 30.247 -24.696 194 HA2 GLY 30 1HA GLY 30 -3.725 31.602 -26.050 195 HA3 GLY 30 2HA GLY 30 -3.298 30.585 -27.418 196 H GLN 31 H GLN 31 -4.347 28.546 -25.067 197 HA GLN 31 HA GLN 31 -7.119 28.641 -26.065 198 HB2 GLN 31 1HB GLN 31 -5.556 26.670 -26.725 199 HB3 GLN 31 2HB GLN 31 -5.820 26.123 -25.074 200 HG2 GLN 31 1HG GLN 31 -8.036 25.655 -25.435 201 HG3 GLN 31 2HG GLN 31 -8.172 26.799 -26.769 202 HE21 GLN 31 2HE2 GLN 31 -5.844 24.199 -26.205 203 HE22 GLN 31 1HE2 GLN 31 -6.213 23.317 -27.644 204 H THR 32 H THR 32 -8.785 27.996 -24.611 205 HA THR 32 HA THR 32 -8.215 28.760 -21.870 206 HB THR 32 HB THR 32 -10.912 27.921 -22.911 207 HG1 THR 32 HG1 THR 32 -10.796 29.577 -24.219 208 HG21 THR 32 3HG2 THR 32 -10.792 28.242 -20.527 209 HG22 THR 32 1HG2 THR 32 -11.665 29.602 -21.232 210 HG23 THR 32 2HG2 THR 32 -9.985 29.796 -20.733 211 H VAL 33 H VAL 33 -7.552 27.273 -20.472 212 HA VAL 33 HA VAL 33 -8.537 24.514 -20.759 213 HB VAL 33 HB VAL 33 -6.615 23.787 -19.485 214 HG11 VAL 33 1HG1 VAL 33 -6.509 24.952 -22.029 215 HG12 VAL 33 2HG1 VAL 33 -5.043 25.477 -21.198 216 HG13 VAL 33 3HG1 VAL 33 -5.405 23.757 -21.348 217 HG21 VAL 33 3HG2 VAL 33 -5.832 25.205 -17.944 218 HG22 VAL 33 1HG2 VAL 33 -4.909 25.934 -19.258 219 HG23 VAL 33 2HG2 VAL 33 -6.469 26.613 -18.793 220 H SER 34 H SER 34 -9.527 23.478 -19.081 221 HA SER 34 HA SER 34 -10.361 25.179 -16.845 222 HB2 SER 34 1HB SER 34 -11.757 22.736 -16.740 223 HB3 SER 34 2HB SER 34 -12.373 24.296 -17.287 224 HG SER 34 HG SER 34 -11.096 22.324 -18.882 225 H VAL 35 H VAL 35 -9.453 24.933 -14.924 226 HA VAL 35 HA VAL 35 -8.593 22.279 -14.051 227 HB VAL 35 HB VAL 35 -6.414 22.925 -13.410 228 HG11 VAL 35 1HG1 VAL 35 -6.884 22.541 -15.889 229 HG12 VAL 35 2HG1 VAL 35 -6.708 24.288 -16.071 230 HG13 VAL 35 3HG1 VAL 35 -5.360 23.323 -15.468 231 HG21 VAL 35 3HG2 VAL 35 -7.529 25.619 -13.544 232 HG22 VAL 35 1HG2 VAL 35 -6.210 24.984 -12.560 233 HG23 VAL 35 2HG2 VAL 35 -5.905 25.498 -14.219 234 H HIS 36 H HIS 36 -7.821 22.424 -11.681 235 HA HIS 36 HA HIS 36 -9.653 24.227 -10.241 236 HB2 HIS 36 1HB HIS 36 -8.888 21.374 -9.820 237 HB3 HIS 36 2HB HIS 36 -9.256 22.353 -8.403 238 HD1 HIS 36 HD1 HIS 36 -11.592 24.003 -9.703 239 HD2 HIS 36 HD2 HIS 36 -11.187 19.870 -9.838 240 HE1 HIS 36 HE1 HIS 36 -13.913 23.112 -10.086 241 H TYR 37 H TYR 37 -8.841 25.583 -8.762 242 HA TYR 37 HA TYR 37 -6.002 25.273 -8.034 243 HB2 TYR 37 1HB TYR 37 -5.797 27.675 -7.969 244 HB3 TYR 37 2HB TYR 37 -6.480 27.216 -9.525 245 HD1 TYR 37 HD1 TYR 37 -7.225 28.732 -6.250 246 HD2 TYR 37 HD2 TYR 37 -8.686 27.895 -10.157 247 HE1 TYR 37 HE1 TYR 37 -9.107 30.269 -5.868 248 HE2 TYR 37 HE2 TYR 37 -10.572 29.430 -9.787 249 HH TYR 37 HH TYR 37 -11.586 30.791 -8.361 250 H THR 38 H THR 38 -5.454 25.364 -5.924 251 HA THR 38 HA THR 38 -7.518 26.132 -3.977 252 HB THR 38 HB THR 38 -5.886 24.010 -2.914 253 HG1 THR 38 HG1 THR 38 -7.276 23.484 -5.344 254 HG21 THR 38 3HG2 THR 38 -8.717 24.774 -3.141 255 HG22 THR 38 1HG2 THR 38 -7.825 24.128 -1.765 256 HG23 THR 38 2HG2 THR 38 -8.423 23.040 -3.018 257 H GLY 39 H GLY 39 -6.727 27.810 -2.887 258 HA2 GLY 39 1HA GLY 39 -3.861 28.165 -2.588 259 HA3 GLY 39 2HA GLY 39 -5.112 29.302 -2.106 260 H TRP 40 H TRP 40 -2.687 27.711 -0.845 261 HA TRP 40 HA TRP 40 -4.081 27.252 1.704 262 HB2 TRP 40 1HB TRP 40 -2.123 25.472 0.293 263 HB3 TRP 40 2HB TRP 40 -2.209 25.460 2.052 264 HD1 TRP 40 HD1 TRP 40 -5.292 25.568 2.529 265 HE1 TRP 40 HE1 TRP 40 -6.794 23.589 1.856 266 HE3 TRP 40 HE3 TRP 40 -2.239 23.374 -0.936 267 HZ2 TRP 40 HZ2 TRP 40 -6.697 21.389 0.090 268 HZ3 TRP 40 HZ3 TRP 40 -3.018 21.335 -2.072 269 HH2 TRP 40 HH2 TRP 40 -5.201 20.364 -1.567 270 H LEU 41 H LEU 41 -3.148 28.143 3.461 271 HA LEU 41 HA LEU 41 -1.035 30.019 3.096 272 HB2 LEU 41 1HB LEU 41 -2.817 29.174 5.283 273 HB3 LEU 41 2HB LEU 41 -1.256 29.821 5.784 274 HG LEU 41 HG LEU 41 -3.000 31.344 3.883 275 HD11 LEU 41 1HD1 LEU 41 -3.364 30.970 6.812 276 HD12 LEU 41 2HD1 LEU 41 -4.567 31.182 5.540 277 HD13 LEU 41 3HD1 LEU 41 -3.642 32.567 6.118 278 HD21 LEU 41 3HD2 LEU 41 -0.771 32.168 4.097 279 HD22 LEU 41 1HD2 LEU 41 -0.840 32.063 5.856 280 HD23 LEU 41 2HD2 LEU 41 -1.830 33.249 5.004 281 H THR 42 H THR 42 0.796 30.039 4.816 282 HA THR 42 HA THR 42 2.538 27.918 4.249 283 HB THR 42 HB THR 42 4.022 28.875 5.963 284 HG1 THR 42 HG1 THR 42 3.297 30.580 7.241 285 HG21 THR 42 3HG2 THR 42 3.992 31.279 5.048 286 HG22 THR 42 1HG2 THR 42 2.647 30.735 4.047 287 HG23 THR 42 2HG2 THR 42 4.226 29.963 3.899 288 H ASP 43 H ASP 43 0.121 28.276 6.675 289 HA ASP 43 HA ASP 43 1.207 26.067 8.258 290 HB2 ASP 43 1HB ASP 43 0.222 28.275 9.232 291 HB3 ASP 43 2HB ASP 43 -1.337 27.522 8.908 292 H GLY 44 H GLY 44 -1.046 26.681 5.789 293 HA2 GLY 44 1HA GLY 44 -1.879 24.643 4.669 294 HA3 GLY 44 2HA GLY 44 -2.296 24.045 6.268 295 H GLN 45 H GLN 45 -3.126 26.981 6.827 296 HA GLN 45 HA GLN 45 -5.869 26.639 6.617 297 HB2 GLN 45 1HB GLN 45 -5.004 28.280 8.121 298 HB3 GLN 45 2HB GLN 45 -4.211 29.151 6.815 299 HG2 GLN 45 1HG GLN 45 -6.171 30.347 7.530 300 HG3 GLN 45 2HG GLN 45 -6.405 29.739 5.892 301 HE21 GLN 45 2HE2 GLN 45 -6.971 28.785 9.260 302 HE22 GLN 45 1HE2 GLN 45 -8.520 28.073 8.979 303 H LYS 46 H LYS 46 -7.119 26.495 4.888 304 HA LYS 46 HA LYS 46 -6.250 27.295 2.291 305 HB2 LYS 46 1HB LYS 46 -7.898 25.393 3.017 306 HB3 LYS 46 2HB LYS 46 -9.110 26.665 2.928 307 HG2 LYS 46 1HG LYS 46 -8.205 27.093 0.569 308 HG3 LYS 46 2HG LYS 46 -7.432 25.515 0.731 309 HD2 LYS 46 1HD LYS 46 -10.385 26.073 1.010 310 HD3 LYS 46 2HD LYS 46 -9.601 25.339 -0.391 311 HE2 LYS 46 1HE LYS 46 -10.269 23.447 0.687 312 HE3 LYS 46 2HE LYS 46 -8.699 23.669 1.457 313 HZ1 LYS 46 3HZ LYS 46 -10.977 23.342 2.799 314 HZ2 LYS 46 1HZ LYS 46 -10.920 25.032 2.730 315 HZ3 LYS 46 2HZ LYS 46 -9.638 24.170 3.420 316 H PHE 47 H PHE 47 -6.778 29.053 1.092 317 HA PHE 47 HA PHE 47 -8.636 31.008 2.263 318 HB2 PHE 47 1HB PHE 47 -7.097 32.824 1.523 319 HB3 PHE 47 2HB PHE 47 -6.417 31.808 2.789 320 HD1 PHE 47 HD2 PHE 47 -6.428 32.314 -0.888 321 HD2 PHE 47 HD1 PHE 47 -4.347 30.794 2.499 322 HE1 PHE 47 HE2 PHE 47 -4.452 31.898 -2.293 323 HE2 PHE 47 HE1 PHE 47 -2.367 30.376 1.100 324 HZ PHE 47 HZ PHE 47 -2.418 30.927 -1.300 325 H ASP 48 H ASP 48 -8.473 28.980 -0.080 326 HA ASP 48 HA ASP 48 -10.181 30.327 -1.832 327 HB2 ASP 48 1HB ASP 48 -7.579 31.165 -2.232 328 HB3 ASP 48 2HB ASP 48 -7.783 29.911 -3.453 329 H SER 49 H SER 49 -11.290 28.830 -2.920 330 HA SER 49 HA SER 49 -9.993 26.337 -3.709 331 HB2 SER 49 1HB SER 49 -11.420 24.906 -2.541 332 HB3 SER 49 2HB SER 49 -11.125 26.184 -1.363 333 HG SER 49 HG SER 49 -13.227 26.288 -1.323 334 H SER 50 H SER 50 -10.484 25.972 -5.758 335 HA SER 50 HA SER 50 -12.513 27.416 -7.125 336 HB2 SER 50 1HB SER 50 -10.396 26.636 -8.188 337 HB3 SER 50 2HB SER 50 -10.991 24.979 -8.080 338 HG SER 50 HG SER 50 -12.308 27.086 -9.453 339 H LYS 51 H LYS 51 -12.360 24.284 -5.620 340 HA LYS 51 HA LYS 51 -14.556 23.065 -6.890 341 HB2 LYS 51 1HB LYS 51 -13.383 22.657 -4.136 342 HB3 LYS 51 2HB LYS 51 -14.632 21.629 -4.828 343 HG2 LYS 51 1HG LYS 51 -12.093 22.064 -6.329 344 HG3 LYS 51 2HG LYS 51 -12.127 20.938 -4.970 345 HD2 LYS 51 1HD LYS 51 -14.192 19.931 -6.131 346 HD3 LYS 51 2HD LYS 51 -13.648 20.821 -7.555 347 HE2 LYS 51 1HE LYS 51 -12.716 18.672 -7.768 348 HE3 LYS 51 2HE LYS 51 -11.396 19.698 -7.209 349 HZ1 LYS 51 3HZ LYS 51 -13.051 18.091 -5.353 350 HZ2 LYS 51 1HZ LYS 51 -11.558 18.826 -5.049 351 HZ3 LYS 51 2HZ LYS 51 -11.647 17.482 -6.072 352 H ASP 52 H ASP 52 -14.362 25.540 -4.507 353 HA ASP 52 HA ASP 52 -16.744 25.272 -3.125 354 HB2 ASP 52 1HB ASP 52 -15.253 26.961 -2.405 355 HB3 ASP 52 2HB ASP 52 -15.207 27.711 -3.999 356 H ARG 53 H ARG 53 -16.172 26.899 -6.231 357 HA ARG 53 HA ARG 53 -18.921 27.600 -6.590 358 HB2 ARG 53 1HB ARG 53 -16.791 28.684 -7.621 359 HB3 ARG 53 2HB ARG 53 -16.938 27.421 -8.835 360 HG2 ARG 53 1HG ARG 53 -18.957 28.254 -9.636 361 HG3 ARG 53 2HG ARG 53 -19.254 29.197 -8.175 362 HD2 ARG 53 1HD ARG 53 -17.119 30.481 -8.838 363 HD3 ARG 53 2HD ARG 53 -17.354 29.751 -10.426 364 HE ARG 53 HE ARG 53 -19.761 30.936 -9.615 365 HH11 ARG 53 1HH1 ARG 53 -16.537 31.833 -10.576 366 HH12 ARG 53 2HH1 ARG 53 -17.016 33.366 -11.225 367 HH21 ARG 53 1HH2 ARG 53 -20.405 32.952 -10.466 368 HH22 ARG 53 2HH2 ARG 53 -19.216 34.002 -11.161 369 H ASN 54 H ASN 54 -17.235 24.715 -6.882 370 HA ASN 54 HA ASN 54 -17.787 22.655 -7.673 371 HB2 ASN 54 1HB ASN 54 -20.530 23.696 -8.349 372 HB3 ASN 54 2HB ASN 54 -20.064 22.073 -7.849 373 HD21 ASN 54 2HD2 ASN 54 -19.610 21.675 -5.668 374 HD22 ASN 54 1HD2 ASN 54 -20.161 22.738 -4.423 375 H ASP 55 H ASP 55 -16.774 24.780 -9.446 376 HA ASP 55 HA ASP 55 -17.395 23.456 -11.972 377 HB2 ASP 55 1HB ASP 55 -18.871 25.227 -12.271 378 HB3 ASP 55 2HB ASP 55 -17.855 26.357 -11.380 379 HA PRO 56 HA PRO 56 -13.036 23.740 -12.492 380 HB2 PRO 56 1HB PRO 56 -12.895 23.436 -15.186 381 HB3 PRO 56 2HB PRO 56 -13.270 22.103 -14.087 382 HG2 PRO 56 1HG PRO 56 -15.126 23.783 -15.728 383 HG3 PRO 56 2HG PRO 56 -15.141 22.030 -15.466 384 HD2 PRO 56 1HD PRO 56 -16.790 23.716 -14.136 385 HD3 PRO 56 2HD PRO 56 -16.169 22.220 -13.411 386 H PHE 57 H PHE 57 -11.649 25.393 -12.629 387 HA PHE 57 HA PHE 57 -12.528 27.948 -13.567 388 HB2 PHE 57 1HB PHE 57 -11.066 27.815 -11.634 389 HB3 PHE 57 2HB PHE 57 -9.827 27.003 -12.587 390 HD1 PHE 57 HD2 PHE 57 -11.892 29.983 -13.414 391 HD2 PHE 57 HD1 PHE 57 -8.013 28.439 -12.583 392 HE1 PHE 57 HE2 PHE 57 -10.905 32.164 -13.981 393 HE2 PHE 57 HE1 PHE 57 -7.021 30.618 -13.147 394 HZ PHE 57 HZ PHE 57 -8.467 32.484 -13.849 395 H ALA 58 H ALA 58 -12.793 28.119 -15.724 396 HA ALA 58 HA ALA 58 -10.766 27.058 -17.531 397 HB1 ALA 58 1HB ALA 58 -12.313 27.247 -19.238 398 HB2 ALA 58 2HB ALA 58 -13.337 26.903 -17.843 399 HB3 ALA 58 3HB ALA 58 -13.188 28.555 -18.441 400 H PHE 59 H PHE 59 -9.082 28.273 -18.057 401 HA PHE 59 HA PHE 59 -9.492 31.114 -18.619 402 HB2 PHE 59 1HB PHE 59 -7.707 31.857 -17.255 403 HB3 PHE 59 2HB PHE 59 -8.646 30.771 -16.236 404 HD1 PHE 59 HD1 PHE 59 -7.797 28.527 -15.705 405 HD2 PHE 59 HD2 PHE 59 -5.469 31.346 -17.884 406 HE1 PHE 59 HE1 PHE 59 -5.773 27.205 -15.247 407 HE2 PHE 59 HE2 PHE 59 -3.442 30.029 -17.430 408 HZ PHE 59 HZ PHE 59 -3.592 27.955 -16.111 409 H VAL 60 H VAL 60 -7.859 32.049 -19.967 410 HA VAL 60 HA VAL 60 -6.796 30.160 -21.870 411 HB VAL 60 HB VAL 60 -6.524 33.169 -21.806 412 HG11 VAL 60 1HG1 VAL 60 -6.363 32.423 -24.414 413 HG12 VAL 60 2HG1 VAL 60 -4.973 32.732 -23.372 414 HG13 VAL 60 3HG1 VAL 60 -5.542 31.080 -23.618 415 HG21 VAL 60 3HG2 VAL 60 -8.801 32.871 -22.028 416 HG22 VAL 60 1HG2 VAL 60 -8.280 32.858 -23.713 417 HG23 VAL 60 2HG2 VAL 60 -8.625 31.340 -22.885 418 H LEU 61 H LEU 61 -4.812 29.343 -21.872 419 HA LEU 61 HA LEU 61 -2.893 30.155 -19.894 420 HB2 LEU 61 1HB LEU 61 -2.893 27.868 -20.252 421 HB3 LEU 61 2HB LEU 61 -3.015 28.042 -22.002 422 HG LEU 61 HG LEU 61 -0.696 28.609 -22.174 423 HD11 LEU 61 1HD1 LEU 61 -1.000 29.230 -19.361 424 HD12 LEU 61 2HD1 LEU 61 0.218 29.773 -20.515 425 HD13 LEU 61 3HD1 LEU 61 0.424 28.236 -19.674 426 HD21 LEU 61 3HD2 LEU 61 -0.215 26.456 -20.305 427 HD22 LEU 61 1HD2 LEU 61 -0.085 26.473 -22.064 428 HD23 LEU 61 2HD2 LEU 61 -1.640 26.146 -21.299 429 H GLY 62 H GLY 62 -1.295 31.579 -20.120 430 HA2 GLY 62 1HA GLY 62 0.445 31.972 -22.157 431 HA3 GLY 62 2HA GLY 62 -0.942 32.933 -22.648 432 H GLY 63 H GLY 63 -1.799 33.962 -20.243 433 HA2 GLY 63 1HA GLY 63 -0.507 35.012 -18.290 434 HA3 GLY 63 2HA GLY 63 0.468 35.720 -19.570 435 H GLY 64 H GLY 64 -1.046 37.122 -17.558 436 HA2 GLY 64 1HA GLY 64 -1.920 39.354 -18.419 437 HA3 GLY 64 2HA GLY 64 -3.149 38.374 -19.205 438 H MET 65 H MET 65 -3.979 36.629 -17.387 439 HA MET 65 HA MET 65 -4.983 38.339 -15.213 440 HB2 MET 65 1HB MET 65 -6.226 36.305 -16.937 441 HB3 MET 65 2HB MET 65 -6.647 36.172 -15.234 442 HG2 MET 65 1HG MET 65 -8.305 37.529 -16.133 443 HG3 MET 65 2HG MET 65 -7.197 38.657 -15.353 444 HE1 MET 65 3HE MET 65 -8.296 38.273 -19.716 445 HE2 MET 65 1HE MET 65 -8.656 37.155 -18.400 446 HE3 MET 65 2HE MET 65 -9.397 38.754 -18.425 447 H VAL 66 H VAL 66 -3.203 35.489 -15.948 448 HA VAL 66 HA VAL 66 -3.387 34.497 -13.202 449 HB VAL 66 HB VAL 66 -2.260 32.517 -13.960 450 HG11 VAL 66 1HG1 VAL 66 -4.212 31.786 -14.718 451 HG12 VAL 66 2HG1 VAL 66 -4.707 33.445 -15.058 452 HG13 VAL 66 3HG1 VAL 66 -3.875 32.501 -16.294 453 HG21 VAL 66 3HG2 VAL 66 -0.594 33.076 -15.426 454 HG22 VAL 66 1HG2 VAL 66 -1.802 32.469 -16.558 455 HG23 VAL 66 2HG2 VAL 66 -1.609 34.206 -16.322 456 H ILE 67 H ILE 67 -1.110 33.493 -12.512 457 HA ILE 67 HA ILE 67 0.767 35.753 -12.570 458 HB ILE 67 HB ILE 67 1.612 35.057 -10.482 459 HG12 ILE 67 1HG1 ILE 67 0.058 32.493 -10.883 460 HG13 ILE 67 2HG1 ILE 67 1.809 32.672 -10.910 461 HG21 ILE 67 1HG2 ILE 67 -0.149 35.746 -9.302 462 HG22 ILE 67 2HG2 ILE 67 -1.053 35.695 -10.815 463 HG23 ILE 67 3HG2 ILE 67 -1.088 34.313 -9.720 464 HD11 ILE 67 3HD1 ILE 67 1.248 33.663 -8.466 465 HD12 ILE 67 1HD1 ILE 67 -0.038 32.470 -8.642 466 HD13 ILE 67 2HD1 ILE 67 1.649 31.977 -8.788 467 H LYS 68 H LYS 68 3.106 35.152 -12.384 468 HA LYS 68 HA LYS 68 3.997 33.760 -14.580 469 HB2 LYS 68 1HB LYS 68 6.198 33.584 -13.283 470 HB3 LYS 68 2HB LYS 68 5.543 35.195 -13.544 471 HG2 LYS 68 1HG LYS 68 4.445 34.370 -11.126 472 HG3 LYS 68 2HG LYS 68 6.121 33.818 -11.079 473 HD2 LYS 68 1HD LYS 68 6.028 36.033 -10.163 474 HD3 LYS 68 2HD LYS 68 6.827 36.117 -11.735 475 HE2 LYS 68 1HE LYS 68 5.349 37.922 -11.757 476 HE3 LYS 68 2HE LYS 68 4.503 36.671 -12.667 477 HZ1 LYS 68 3HZ LYS 68 2.857 36.678 -11.200 478 HZ2 LYS 68 1HZ LYS 68 3.549 38.050 -10.493 479 HZ3 LYS 68 2HZ LYS 68 3.912 36.512 -9.889 480 H GLY 69 H GLY 69 3.855 32.561 -11.224 481 HA2 GLY 69 1HA GLY 69 4.816 29.987 -11.710 482 HA3 GLY 69 2HA GLY 69 3.744 30.427 -10.389 483 H TRP 70 H TRP 70 1.677 31.355 -12.331 484 HA TRP 70 HA TRP 70 0.294 28.868 -12.564 485 HB2 TRP 70 1HB TRP 70 -0.374 31.633 -12.643 486 HB3 TRP 70 2HB TRP 70 -0.978 30.894 -14.123 487 HD1 TRP 70 HD1 TRP 70 -3.246 29.709 -13.938 488 HE1 TRP 70 HE1 TRP 70 -4.755 28.926 -12.006 489 HE3 TRP 70 HE3 TRP 70 -0.110 30.673 -10.018 490 HZ2 TRP 70 HZ2 TRP 70 -4.633 28.742 -9.192 491 HZ3 TRP 70 HZ3 TRP 70 -0.882 30.165 -7.737 492 HH2 TRP 70 HH2 TRP 70 -3.097 29.220 -7.335 493 H ASP 71 H ASP 71 1.314 31.250 -15.019 494 HA ASP 71 HA ASP 71 0.700 29.757 -17.272 495 HB2 ASP 71 1HB ASP 71 1.256 32.008 -17.646 496 HB3 ASP 71 2HB ASP 71 2.766 31.879 -16.749 497 H GLU 72 H GLU 72 3.741 29.853 -15.438 498 HA GLU 72 HA GLU 72 5.126 28.021 -17.088 499 HB2 GLU 72 1HB GLU 72 5.735 29.604 -14.871 500 HB3 GLU 72 2HB GLU 72 5.990 27.955 -14.320 501 HG2 GLU 72 1HG GLU 72 7.266 29.278 -16.701 502 HG3 GLU 72 2HG GLU 72 8.046 28.846 -15.181 503 H GLY 73 H GLY 73 3.283 27.617 -14.083 504 HA2 GLY 73 1HA GLY 73 3.801 24.881 -13.707 505 HA3 GLY 73 2HA GLY 73 2.409 25.749 -13.078 506 H VAL 74 H VAL 74 0.902 26.407 -15.123 507 HA VAL 74 HA VAL 74 -0.303 23.997 -15.926 508 HB VAL 74 HB VAL 74 -1.747 25.358 -17.348 509 HG11 VAL 74 1HG1 VAL 74 -2.852 25.866 -15.492 510 HG12 VAL 74 2HG1 VAL 74 -1.365 25.683 -14.559 511 HG13 VAL 74 3HG1 VAL 74 -1.799 27.255 -15.231 512 HG21 VAL 74 3HG2 VAL 74 -0.579 26.988 -18.417 513 HG22 VAL 74 1HG2 VAL 74 -1.187 27.950 -17.070 514 HG23 VAL 74 2HG2 VAL 74 0.456 27.313 -17.027 515 H GLN 75 H GLN 75 2.033 26.092 -17.487 516 HA GLN 75 HA GLN 75 1.872 25.262 -20.111 517 HB2 GLN 75 1HB GLN 75 3.950 26.431 -18.395 518 HB3 GLN 75 2HB GLN 75 4.577 25.523 -19.765 519 HG2 GLN 75 1HG GLN 75 2.440 27.581 -20.139 520 HG3 GLN 75 2HG GLN 75 4.138 28.041 -20.032 521 HE21 GLN 75 2HE2 GLN 75 4.597 28.626 -22.058 522 HE22 GLN 75 1HE2 GLN 75 4.412 27.616 -23.448 523 H GLY 76 H GLY 76 3.126 23.557 -17.346 524 HA2 GLY 76 1HA GLY 76 4.100 21.401 -19.104 525 HA3 GLY 76 2HA GLY 76 4.589 21.641 -17.433 526 H MET 77 H MET 77 1.834 22.130 -16.535 527 HA MET 77 HA MET 77 1.135 19.607 -15.672 528 HB2 MET 77 1HB MET 77 0.276 21.831 -14.822 529 HB3 MET 77 2HB MET 77 -0.856 21.820 -16.168 530 HG2 MET 77 1HG MET 77 -2.098 20.988 -14.401 531 HG3 MET 77 2HG MET 77 -1.599 19.540 -15.273 532 HE1 MET 77 3HE MET 77 0.744 21.457 -12.128 533 HE2 MET 77 1HE MET 77 -0.820 22.034 -12.706 534 HE3 MET 77 2HE MET 77 -0.724 21.081 -11.225 535 H LYS 78 H LYS 78 -0.394 18.073 -16.298 536 HA LYS 78 HA LYS 78 -1.239 18.251 -19.116 537 HB2 LYS 78 1HB LYS 78 -0.448 15.837 -17.481 538 HB3 LYS 78 2HB LYS 78 -1.185 15.738 -19.075 539 HG2 LYS 78 1HG LYS 78 0.707 16.364 -20.142 540 HG3 LYS 78 2HG LYS 78 1.225 17.431 -18.834 541 HD2 LYS 78 1HD LYS 78 1.182 14.524 -18.262 542 HD3 LYS 78 2HD LYS 78 2.426 15.102 -19.373 543 HE2 LYS 78 1HE LYS 78 2.689 16.943 -17.460 544 HE3 LYS 78 2HE LYS 78 2.062 15.621 -16.477 545 HZ1 LYS 78 3HZ LYS 78 4.086 14.684 -18.222 546 HZ2 LYS 78 1HZ LYS 78 4.028 14.631 -16.532 547 HZ3 LYS 78 2HZ LYS 78 4.667 15.988 -17.314 548 H VAL 79 H VAL 79 -3.278 17.386 -19.682 549 HA VAL 79 HA VAL 79 -5.390 18.000 -18.005 550 HB VAL 79 HB VAL 79 -5.424 15.960 -20.233 551 HG11 VAL 79 1HG1 VAL 79 -7.451 15.671 -19.163 552 HG12 VAL 79 2HG1 VAL 79 -7.562 17.367 -18.689 553 HG13 VAL 79 3HG1 VAL 79 -7.845 16.898 -20.366 554 HG21 VAL 79 3HG2 VAL 79 -4.969 18.778 -20.288 555 HG22 VAL 79 1HG2 VAL 79 -5.066 17.644 -21.635 556 HG23 VAL 79 2HG2 VAL 79 -6.527 18.432 -21.039 557 H GLY 80 H GLY 80 -6.293 17.046 -16.300 558 HA2 GLY 80 1HA GLY 80 -7.093 15.310 -14.966 559 HA3 GLY 80 2HA GLY 80 -6.303 14.160 -16.034 560 H GLY 81 H GLY 81 -4.037 16.434 -15.342 561 HA2 GLY 81 1HA GLY 81 -2.819 14.691 -13.333 562 HA3 GLY 81 2HA GLY 81 -1.995 15.933 -14.265 563 H VAL 82 H VAL 82 -2.199 15.328 -11.313 564 HA VAL 82 HA VAL 82 -3.030 18.029 -10.471 565 HB VAL 82 HB VAL 82 -3.253 15.479 -8.866 566 HG11 VAL 82 1HG1 VAL 82 -3.957 18.321 -8.143 567 HG12 VAL 82 2HG1 VAL 82 -4.340 16.897 -7.173 568 HG13 VAL 82 3HG1 VAL 82 -2.658 17.353 -7.447 569 HG21 VAL 82 3HG2 VAL 82 -5.094 15.349 -10.213 570 HG22 VAL 82 1HG2 VAL 82 -5.742 16.374 -8.933 571 HG23 VAL 82 2HG2 VAL 82 -5.187 17.095 -10.444 572 H ARG 83 H ARG 83 -1.494 19.217 -9.544 573 HA ARG 83 HA ARG 83 0.688 17.935 -8.102 574 HB2 ARG 83 1HB ARG 83 1.261 19.929 -10.295 575 HB3 ARG 83 2HB ARG 83 2.429 19.032 -9.335 576 HG2 ARG 83 1HG ARG 83 1.687 16.949 -10.366 577 HG3 ARG 83 2HG ARG 83 0.507 17.845 -11.325 578 HD2 ARG 83 1HD ARG 83 2.170 18.905 -12.587 579 HD3 ARG 83 2HD ARG 83 3.430 18.509 -11.419 580 HE ARG 83 HE ARG 83 2.391 16.119 -12.424 581 HH11 ARG 83 1HH1 ARG 83 4.217 18.874 -13.517 582 HH12 ARG 83 2HH1 ARG 83 5.063 17.991 -14.744 583 HH21 ARG 83 1HH2 ARG 83 3.498 14.945 -14.037 584 HH22 ARG 83 2HH2 ARG 83 4.653 15.756 -15.039 585 H ARG 84 H ARG 84 1.546 19.184 -6.487 586 HA ARG 84 HA ARG 84 0.048 21.573 -5.806 587 HB2 ARG 84 1HB ARG 84 0.737 19.668 -4.199 588 HB3 ARG 84 2HB ARG 84 2.320 20.434 -4.202 589 HG2 ARG 84 1HG ARG 84 1.486 22.399 -3.212 590 HG3 ARG 84 2HG ARG 84 -0.188 21.935 -3.522 591 HD2 ARG 84 1HD ARG 84 0.020 21.437 -1.283 592 HD3 ARG 84 2HD ARG 84 0.399 19.883 -2.027 593 HE ARG 84 HE ARG 84 2.785 21.301 -1.702 594 HH11 ARG 84 1HH1 ARG 84 0.312 19.805 0.239 595 HH12 ARG 84 2HH1 ARG 84 1.380 19.445 1.555 596 HH21 ARG 84 1HH2 ARG 84 4.201 20.833 0.023 597 HH22 ARG 84 2HH2 ARG 84 3.591 20.031 1.432 598 H LEU 85 H LEU 85 0.685 23.344 -6.890 599 HA LEU 85 HA LEU 85 3.494 23.830 -7.428 600 HB2 LEU 85 1HB LEU 85 1.753 24.320 -9.109 601 HB3 LEU 85 2HB LEU 85 1.082 25.537 -8.026 602 HG LEU 85 HG LEU 85 3.656 26.389 -8.251 603 HD11 LEU 85 1HD1 LEU 85 3.319 24.510 -10.336 604 HD12 LEU 85 2HD1 LEU 85 4.678 25.596 -10.048 605 HD13 LEU 85 3HD1 LEU 85 3.335 26.116 -11.065 606 HD21 LEU 85 3HD2 LEU 85 1.316 27.494 -8.615 607 HD22 LEU 85 1HD2 LEU 85 1.672 27.218 -10.320 608 HD23 LEU 85 2HD2 LEU 85 2.758 28.205 -9.341 609 H THR 86 H THR 86 4.772 24.823 -6.030 610 HA THR 86 HA THR 86 3.576 26.512 -3.950 611 HB THR 86 HB THR 86 6.465 25.805 -3.865 612 HG1 THR 86 HG1 THR 86 5.844 23.770 -4.225 613 HG21 THR 86 3HG2 THR 86 4.484 26.831 -2.107 614 HG22 THR 86 1HG2 THR 86 6.196 26.555 -1.786 615 HG23 THR 86 2HG2 THR 86 5.022 25.277 -1.469 616 H ILE 87 H ILE 87 3.658 28.638 -4.195 617 HA ILE 87 HA ILE 87 5.852 29.788 -5.794 618 HB ILE 87 HB ILE 87 3.143 31.049 -5.404 619 HG12 ILE 87 1HG1 ILE 87 3.068 30.319 -7.974 620 HG13 ILE 87 2HG1 ILE 87 4.083 29.016 -7.365 621 HG21 ILE 87 1HG2 ILE 87 3.838 32.379 -7.375 622 HG22 ILE 87 2HG2 ILE 87 4.876 32.618 -5.971 623 HG23 ILE 87 3HG2 ILE 87 5.418 31.598 -7.303 624 HD11 ILE 87 3HD1 ILE 87 1.238 29.400 -7.133 625 HD12 ILE 87 1HD1 ILE 87 2.214 27.964 -6.823 626 HD13 ILE 87 2HD1 ILE 87 1.990 29.168 -5.554 627 HA PRO 88 HA PRO 88 7.039 31.838 -2.054 628 HB2 PRO 88 1HB PRO 88 8.825 33.554 -3.165 629 HB3 PRO 88 2HB PRO 88 9.167 31.837 -2.922 630 HG2 PRO 88 1HG PRO 88 8.295 33.261 -5.407 631 HG3 PRO 88 2HG PRO 88 9.527 32.001 -5.214 632 HD2 PRO 88 1HD PRO 88 7.037 31.474 -6.136 633 HD3 PRO 88 2HD PRO 88 7.967 30.305 -5.178 634 HA PRO 89 HA PRO 89 4.876 35.652 -1.736 635 HB2 PRO 89 1HB PRO 89 6.537 37.199 -0.246 636 HB3 PRO 89 2HB PRO 89 5.643 35.827 0.422 637 HG2 PRO 89 1HG PRO 89 8.498 35.977 -0.467 638 HG3 PRO 89 2HG PRO 89 7.815 35.206 0.977 639 HD2 PRO 89 1HD PRO 89 8.500 33.805 -1.237 640 HD3 PRO 89 2HD PRO 89 7.150 33.330 -0.186 641 H GLN 90 H GLN 90 7.769 35.490 -3.452 642 HA GLN 90 HA GLN 90 7.782 38.304 -4.209 643 HB2 GLN 90 1HB GLN 90 9.601 35.983 -4.820 644 HB3 GLN 90 2HB GLN 90 9.744 37.521 -5.661 645 HG2 GLN 90 1HG GLN 90 10.275 38.666 -3.651 646 HG3 GLN 90 2HG GLN 90 9.860 37.262 -2.670 647 HE21 GLN 90 2HE2 GLN 90 11.757 36.831 -1.716 648 HE22 GLN 90 1HE2 GLN 90 13.219 36.453 -2.555 649 H LEU 91 H LEU 91 7.406 35.125 -5.755 650 HA LEU 91 HA LEU 91 6.434 36.419 -8.187 651 HB2 LEU 91 1HB LEU 91 6.660 33.461 -7.822 652 HB3 LEU 91 2HB LEU 91 6.799 34.415 -9.297 653 HG LEU 91 HG LEU 91 8.852 34.124 -7.109 654 HD11 LEU 91 1HD1 LEU 91 8.622 32.272 -8.758 655 HD12 LEU 91 2HD1 LEU 91 10.192 33.076 -8.790 656 HD13 LEU 91 3HD1 LEU 91 8.995 33.428 -10.037 657 HD21 LEU 91 3HD2 LEU 91 9.048 36.369 -7.749 658 HD22 LEU 91 1HD2 LEU 91 8.706 36.010 -9.441 659 HD23 LEU 91 2HD2 LEU 91 10.245 35.522 -8.731 660 H GLY 92 H GLY 92 4.908 36.307 -5.622 661 HA2 GLY 92 1HA GLY 92 2.457 35.144 -6.765 662 HA3 GLY 92 2HA GLY 92 2.914 34.752 -5.114 663 H TYR 93 H TYR 93 2.169 36.016 -3.537 664 HA TYR 93 HA TYR 93 0.339 38.085 -4.057 665 HB2 TYR 93 1HB TYR 93 1.544 36.837 -1.686 666 HB3 TYR 93 2HB TYR 93 1.096 38.524 -1.458 667 HD1 TYR 93 HD2 TYR 93 -0.637 36.047 -3.607 668 HD2 TYR 93 HD1 TYR 93 -0.744 38.306 -0.003 669 HE1 TYR 93 HE2 TYR 93 -2.978 35.375 -3.262 670 HE2 TYR 93 HE1 TYR 93 -3.085 37.639 0.353 671 HH TYR 93 HH TYR 93 -4.519 35.153 -1.036 672 H GLY 94 H GLY 94 3.784 38.081 -3.608 673 HA2 GLY 94 1HA GLY 94 5.161 39.855 -4.378 674 HA3 GLY 94 2HA GLY 94 3.811 40.960 -4.165 675 H ALA 95 H ALA 95 6.254 41.702 -3.253 676 HA ALA 95 HA ALA 95 6.893 40.996 -0.620 677 HB1 ALA 95 1HB ALA 95 7.347 43.708 -1.845 678 HB2 ALA 95 2HB ALA 95 8.284 42.921 -0.574 679 HB3 ALA 95 3HB ALA 95 8.329 42.292 -2.221 680 H ARG 96 H ARG 96 4.444 43.099 -1.899 681 HA ARG 96 HA ARG 96 3.943 44.697 0.348 682 HB2 ARG 96 1HB ARG 96 3.001 45.123 -1.897 683 HB3 ARG 96 2HB ARG 96 1.966 43.713 -1.717 684 HG2 ARG 96 1HG ARG 96 1.104 44.909 0.406 685 HG3 ARG 96 2HG ARG 96 1.821 46.349 -0.321 686 HD2 ARG 96 1HD ARG 96 0.400 46.254 -2.181 687 HD3 ARG 96 2HD ARG 96 -0.049 44.579 -1.861 688 HE ARG 96 HE ARG 96 -0.844 46.281 0.269 689 HH11 ARG 96 1HH1 ARG 96 -1.683 45.316 -2.969 690 HH12 ARG 96 2HH1 ARG 96 -3.368 45.669 -2.777 691 HH21 ARG 96 1HH2 ARG 96 -3.061 46.750 0.534 692 HH22 ARG 96 2HH2 ARG 96 -4.151 46.485 -0.784 693 H GLY 97 H GLY 97 2.162 41.784 -0.710 694 HA2 GLY 97 1HA GLY 97 1.461 40.015 0.670 695 HA3 GLY 97 2HA GLY 97 1.862 40.985 2.079 696 H ALA 98 H ALA 98 -0.448 39.636 2.166 697 HA ALA 98 HA ALA 98 -2.652 41.209 1.189 698 HB1 ALA 98 1HB ALA 98 -3.412 39.358 3.249 699 HB2 ALA 98 2HB ALA 98 -3.799 39.339 1.528 700 HB3 ALA 98 3HB ALA 98 -2.313 38.585 2.106 701 H GLY 99 H GLY 99 -4.318 42.106 2.614 702 HA2 GLY 99 1HA GLY 99 -3.221 43.896 4.505 703 HA3 GLY 99 2HA GLY 99 -4.934 43.612 4.234 704 H GLY 100 H GLY 100 -4.851 40.793 4.860 705 HA2 GLY 100 1HA GLY 100 -3.814 40.523 7.534 706 HA3 GLY 100 2HA GLY 100 -5.558 40.738 7.486 707 H VAL 101 H VAL 101 -3.458 38.971 5.241 708 HA VAL 101 HA VAL 101 -4.770 36.474 6.080 709 HB VAL 101 HB VAL 101 -4.174 37.167 3.203 710 HG11 VAL 101 1HG1 VAL 101 -4.274 34.734 4.081 711 HG12 VAL 101 2HG1 VAL 101 -6.014 35.013 4.171 712 HG13 VAL 101 3HG1 VAL 101 -5.175 35.157 2.626 713 HG21 VAL 101 3HG2 VAL 101 -6.752 37.203 3.089 714 HG22 VAL 101 1HG2 VAL 101 -6.672 37.489 4.827 715 HG23 VAL 101 2HG2 VAL 101 -5.916 38.626 3.711 716 H ILE 102 H ILE 102 -2.304 37.418 3.684 717 HA ILE 102 HA ILE 102 -0.567 35.308 4.752 718 HB ILE 102 HB ILE 102 -0.573 36.759 2.111 719 HG12 ILE 102 1HG1 ILE 102 -0.571 34.203 1.438 720 HG13 ILE 102 2HG1 ILE 102 -1.211 33.997 3.065 721 HG21 ILE 102 1HG2 ILE 102 1.624 35.407 3.498 722 HG22 ILE 102 2HG2 ILE 102 1.345 34.846 1.850 723 HG23 ILE 102 3HG2 ILE 102 1.660 36.553 2.159 724 HD11 ILE 102 3HD1 ILE 102 -2.513 34.938 0.663 725 HD12 ILE 102 1HD1 ILE 102 -3.208 34.359 2.176 726 HD13 ILE 102 2HD1 ILE 102 -2.728 36.049 2.015 727 HA PRO 103 HA PRO 103 1.918 38.449 6.667 728 HB2 PRO 103 1HB PRO 103 3.946 36.813 7.429 729 HB3 PRO 103 2HB PRO 103 2.391 36.870 8.267 730 HG2 PRO 103 1HG PRO 103 3.374 34.909 6.230 731 HG3 PRO 103 2HG PRO 103 2.480 34.609 7.732 732 HD2 PRO 103 1HD PRO 103 1.281 34.637 5.304 733 HD3 PRO 103 2HD PRO 103 0.453 35.161 6.784 734 HA PRO 104 HA PRO 104 5.044 39.635 3.811 735 HB2 PRO 104 1HB PRO 104 7.015 40.573 5.425 736 HB3 PRO 104 2HB PRO 104 5.490 41.431 5.172 737 HG2 PRO 104 1HG PRO 104 6.319 39.668 7.446 738 HG3 PRO 104 2HG PRO 104 5.457 41.218 7.488 739 HD2 PRO 104 1HD PRO 104 4.189 38.839 7.739 740 HD3 PRO 104 2HD PRO 104 3.431 40.249 6.972 741 H ASN 105 H ASN 105 6.457 38.511 2.632 742 HA ASN 105 HA ASN 105 8.072 37.035 2.009 743 HB2 ASN 105 1HB ASN 105 9.403 38.418 3.668 744 HB3 ASN 105 2HB ASN 105 9.075 37.158 4.855 745 HD21 ASN 105 2HD2 ASN 105 11.636 37.788 4.225 746 HD22 ASN 105 1HD2 ASN 105 12.362 36.502 3.328 747 H ALA 106 H ALA 106 5.780 35.817 2.362 748 HA ALA 106 HA ALA 106 6.425 33.382 3.893 749 HB1 ALA 106 1HB ALA 106 3.585 33.838 3.364 750 HB2 ALA 106 2HB ALA 106 4.400 33.341 4.848 751 HB3 ALA 106 3HB ALA 106 4.327 35.048 4.411 752 H THR 107 H THR 107 5.967 31.402 2.950 753 HA THR 107 HA THR 107 5.831 31.433 0.055 754 HB THR 107 HB THR 107 6.150 29.123 1.980 755 HG1 THR 107 HG1 THR 107 8.341 29.225 1.101 756 HG21 THR 107 3HG2 THR 107 5.371 28.026 0.125 757 HG22 THR 107 1HG2 THR 107 7.082 28.125 -0.287 758 HG23 THR 107 2HG2 THR 107 5.939 29.272 -0.986 759 H LEU 108 H LEU 108 4.047 31.117 -1.099 760 HA LEU 108 HA LEU 108 1.614 30.258 0.278 761 HB2 LEU 108 1HB LEU 108 2.218 31.854 -2.147 762 HB3 LEU 108 2HB LEU 108 0.721 30.923 -2.144 763 HG LEU 108 HG LEU 108 1.488 33.038 -0.131 764 HD11 LEU 108 1HD1 LEU 108 -0.892 33.488 -1.717 765 HD12 LEU 108 2HD1 LEU 108 0.555 33.362 -2.717 766 HD13 LEU 108 3HD1 LEU 108 0.484 34.549 -1.415 767 HD21 LEU 108 3HD2 LEU 108 0.074 31.803 1.133 768 HD22 LEU 108 1HD2 LEU 108 -0.685 31.038 -0.264 769 HD23 LEU 108 2HD2 LEU 108 -1.144 32.676 0.202 770 H VAL 109 H VAL 109 0.712 28.327 -0.044 771 HA VAL 109 HA VAL 109 1.882 26.583 -2.097 772 HB VAL 109 HB VAL 109 0.246 25.863 0.339 773 HG11 VAL 109 1HG1 VAL 109 1.575 23.608 -0.590 774 HG12 VAL 109 2HG1 VAL 109 -0.152 23.944 -0.718 775 HG13 VAL 109 3HG1 VAL 109 0.931 24.373 -2.042 776 HG21 VAL 109 3HG2 VAL 109 2.952 24.832 0.193 777 HG22 VAL 109 1HG2 VAL 109 2.912 26.595 0.182 778 HG23 VAL 109 2HG2 VAL 109 2.146 25.704 1.497 779 H PHE 110 H PHE 110 0.770 26.494 -3.930 780 HA PHE 110 HA PHE 110 -2.173 26.537 -3.790 781 HB2 PHE 110 1HB PHE 110 -0.277 27.661 -5.838 782 HB3 PHE 110 2HB PHE 110 -1.953 27.309 -6.245 783 HD1 PHE 110 HD1 PHE 110 -3.780 28.516 -5.086 784 HD2 PHE 110 HD2 PHE 110 0.312 29.566 -4.568 785 HE1 PHE 110 HE1 PHE 110 -4.459 30.699 -4.178 786 HE2 PHE 110 HE2 PHE 110 -0.361 31.751 -3.658 787 HZ PHE 110 HZ PHE 110 -2.749 32.320 -3.462 788 H GLU 111 H GLU 111 -3.268 24.868 -4.638 789 HA GLU 111 HA GLU 111 -1.698 22.735 -5.907 790 HB2 GLU 111 1HB GLU 111 -3.106 22.356 -3.781 791 HB3 GLU 111 2HB GLU 111 -4.499 22.441 -4.851 792 HG2 GLU 111 1HG GLU 111 -3.426 20.607 -6.202 793 HG3 GLU 111 2HG GLU 111 -2.266 20.434 -4.885 794 H VAL 112 H VAL 112 -1.958 22.285 -7.991 795 HA VAL 112 HA VAL 112 -4.293 23.427 -9.381 796 HB VAL 112 HB VAL 112 -1.583 22.764 -10.543 797 HG11 VAL 112 1HG1 VAL 112 -3.159 22.512 -12.268 798 HG12 VAL 112 2HG1 VAL 112 -4.096 23.908 -11.730 799 HG13 VAL 112 3HG1 VAL 112 -2.512 24.140 -12.472 800 HG21 VAL 112 3HG2 VAL 112 -1.776 25.403 -10.857 801 HG22 VAL 112 1HG2 VAL 112 -2.741 25.235 -9.390 802 HG23 VAL 112 2HG2 VAL 112 -1.070 24.671 -9.416 803 H GLU 113 H GLU 113 -5.635 22.101 -10.441 804 HA GLU 113 HA GLU 113 -4.754 19.352 -10.996 805 HB2 GLU 113 1HB GLU 113 -7.557 19.896 -10.080 806 HB3 GLU 113 2HB GLU 113 -6.658 18.385 -10.058 807 HG2 GLU 113 1HG GLU 113 -5.157 19.898 -8.390 808 HG3 GLU 113 2HG GLU 113 -6.767 20.548 -8.084 809 H LEU 114 H LEU 114 -4.648 19.421 -13.167 810 HA LEU 114 HA LEU 114 -6.397 20.925 -14.813 811 HB2 LEU 114 1HB LEU 114 -4.019 19.537 -15.143 812 HB3 LEU 114 2HB LEU 114 -5.174 18.653 -16.137 813 HG LEU 114 HG LEU 114 -4.786 21.626 -16.379 814 HD11 LEU 114 1HD1 LEU 114 -2.946 21.397 -17.619 815 HD12 LEU 114 2HD1 LEU 114 -3.576 19.977 -18.453 816 HD13 LEU 114 3HD1 LEU 114 -2.798 19.802 -16.880 817 HD21 LEU 114 3HD2 LEU 114 -5.494 20.441 -18.806 818 HD22 LEU 114 1HD2 LEU 114 -6.520 21.412 -17.750 819 HD23 LEU 114 2HD2 LEU 114 -6.502 19.656 -17.590 820 H LEU 115 H LEU 115 -8.363 20.466 -15.555 821 HA LEU 115 HA LEU 115 -9.383 17.732 -15.179 822 HB2 LEU 115 1HB LEU 115 -10.913 20.318 -15.429 823 HB3 LEU 115 2HB LEU 115 -11.612 18.724 -15.151 824 HG LEU 115 HG LEU 115 -9.638 19.482 -13.138 825 HD11 LEU 115 1HD1 LEU 115 -10.569 21.345 -12.241 826 HD12 LEU 115 2HD1 LEU 115 -12.181 20.970 -12.849 827 HD13 LEU 115 3HD1 LEU 115 -10.965 21.646 -13.933 828 HD21 LEU 115 3HD2 LEU 115 -12.527 18.850 -12.688 829 HD22 LEU 115 1HD2 LEU 115 -11.126 18.453 -11.693 830 HD23 LEU 115 2HD2 LEU 115 -11.406 17.590 -13.206 831 H ASP 116 H ASP 116 -9.028 20.363 -17.462 832 HA ASP 116 HA ASP 116 -9.089 18.659 -19.703 833 HB2 ASP 116 1HB ASP 116 -11.558 18.741 -19.020 834 HB3 ASP 116 2HB ASP 116 -11.531 20.418 -19.557 835 H VAL 117 H VAL 117 -9.141 19.941 -21.786 836 HA VAL 117 HA VAL 117 -7.649 22.420 -21.359 837 HB VAL 117 HB VAL 117 -8.003 20.777 -23.870 838 HG11 VAL 117 1HG1 VAL 117 -6.786 23.409 -23.340 839 HG12 VAL 117 2HG1 VAL 117 -5.830 22.301 -24.326 840 HG13 VAL 117 3HG1 VAL 117 -7.461 22.747 -24.829 841 HG21 VAL 117 3HG2 VAL 117 -6.404 19.467 -23.057 842 HG22 VAL 117 1HG2 VAL 117 -5.318 20.857 -23.018 843 HG23 VAL 117 2HG2 VAL 117 -6.291 20.457 -21.602 844 H11 L2S 130 1H1 L2S 130 -5.123 31.386 -9.578 845 H21 L2S 130 2H1 L2S 130 -4.984 32.223 -11.199 846 H12 L2S 130 1H2 L2S 130 -4.506 34.299 -10.102 847 H22 L2S 130 2H2 L2S 130 -3.289 33.029 -9.598 848 H13 L2S 130 2H3 L2S 130 -4.502 32.725 -7.537 849 H23 L2S 130 1H3 L2S 130 -4.126 34.502 -7.723 850 H14 L2S 130 1H4 L2S 130 -7.140 32.083 -8.083 851 H24 L2S 130 2H4 L2S 130 -8.072 33.543 -8.656 852 H15 L2S 130 1H5 L2S 130 -7.341 31.977 -10.488 853 H25 L2S 130 2H5 L2S 130 -6.769 33.711 -10.606 854 H17 L2S 130 1H7 L2S 130 -8.410 35.365 -7.926 855 H27 L2S 130 2H7 L2S 130 -8.547 34.487 -6.311 856 H9 L2S 130 H9 L2S 130 -6.841 38.239 -4.061 857 H10 L2S 130 H10 L2S 130 -6.444 37.667 -1.665 858 H112 L2S 130 1H12 L2S 130 -9.148 34.256 -2.040 859 H113 L2S 130 1H13 L2S 130 -9.492 34.812 -4.439 860 H114 L2S 130 1H14 L2S 130 -6.560 35.172 -0.252 861 H214 L2S 130 2H14 L2S 130 -8.303 34.882 -0.037 862 H314 L2S 130 3H14 L2S 130 -7.643 36.538 0.191 Start of MODEL 16 1 H1 GLY 1 H GLY 1 0.284 3.154 -0.605 2 HA2 GLY 1 1HA GLY 1 -0.611 2.638 -2.678 3 HA3 GLY 1 2HA GLY 1 -0.638 4.390 -2.818 4 HA PRO 2 HA PRO 2 2.188 2.335 -6.033 5 HB2 PRO 2 1HB PRO 2 0.628 2.752 -8.216 6 HB3 PRO 2 2HB PRO 2 0.535 1.284 -7.235 7 HG2 PRO 2 1HG PRO 2 -1.222 3.708 -7.188 8 HG3 PRO 2 2HG PRO 2 -1.676 1.995 -7.110 9 HD2 PRO 2 1HD PRO 2 -1.556 3.572 -4.912 10 HD3 PRO 2 2HD PRO 2 -1.182 1.837 -4.864 11 H GLY 3 H GLY 3 3.684 3.606 -6.962 12 HA2 GLY 3 1HA GLY 3 4.447 5.420 -8.267 13 HA3 GLY 3 2HA GLY 3 2.922 6.243 -7.971 14 H SER 4 H SER 4 5.656 7.246 -7.703 15 HA SER 4 HA SER 4 5.683 7.824 -4.814 16 HB2 SER 4 1HB SER 4 8.038 8.176 -6.665 17 HB3 SER 4 2HB SER 4 8.036 8.092 -4.904 18 HG SER 4 HG SER 4 8.611 6.092 -5.434 19 H MET 5 H MET 5 7.142 10.020 -4.605 20 HA MET 5 HA MET 5 5.976 12.007 -6.428 21 HB2 MET 5 1HB MET 5 6.092 12.277 -3.419 22 HB3 MET 5 2HB MET 5 5.488 13.486 -4.544 23 HG2 MET 5 1HG MET 5 3.810 11.695 -5.270 24 HG3 MET 5 2HG MET 5 4.279 10.853 -3.794 25 HE1 MET 5 3HE MET 5 1.907 11.975 -1.433 26 HE2 MET 5 1HE MET 5 3.125 10.848 -2.031 27 HE3 MET 5 2HE MET 5 3.615 12.255 -1.088 28 H THR 6 H THR 6 7.147 13.992 -6.581 29 HA THR 6 HA THR 6 9.774 14.111 -5.332 30 HB THR 6 HB THR 6 10.268 12.856 -7.344 31 HG1 THR 6 HG1 THR 6 11.883 14.177 -8.038 32 HG21 THR 6 3HG2 THR 6 9.050 15.142 -8.896 33 HG22 THR 6 1HG2 THR 6 8.268 13.583 -8.632 34 HG23 THR 6 2HG2 THR 6 9.766 13.673 -9.560 35 H VAL 7 H VAL 7 10.521 16.165 -5.057 36 HA VAL 7 HA VAL 7 8.902 18.336 -6.223 37 HB VAL 7 HB VAL 7 8.388 18.187 -3.869 38 HG11 VAL 7 1HG1 VAL 7 10.007 18.246 -2.132 39 HG12 VAL 7 2HG1 VAL 7 10.528 17.003 -3.271 40 HG13 VAL 7 3HG1 VAL 7 11.312 18.583 -3.269 41 HG21 VAL 7 3HG2 VAL 7 8.532 20.421 -4.822 42 HG22 VAL 7 1HG2 VAL 7 9.062 20.432 -3.139 43 HG23 VAL 7 2HG2 VAL 7 10.252 20.491 -4.439 44 H VAL 8 H VAL 8 10.022 19.638 -7.503 45 HA VAL 8 HA VAL 8 12.915 19.945 -7.020 46 HB VAL 8 HB VAL 8 12.382 18.669 -9.096 47 HG11 VAL 8 1HG1 VAL 8 10.360 20.455 -9.429 48 HG12 VAL 8 2HG1 VAL 8 11.565 21.078 -10.558 49 HG13 VAL 8 3HG1 VAL 8 10.998 19.413 -10.700 50 HG21 VAL 8 3HG2 VAL 8 13.600 21.318 -9.813 51 HG22 VAL 8 1HG2 VAL 8 14.414 20.182 -8.737 52 HG23 VAL 8 2HG2 VAL 8 14.033 19.710 -10.393 53 H THR 9 H THR 9 13.818 21.986 -7.299 54 HA THR 9 HA THR 9 11.870 24.194 -7.442 55 HB THR 9 HB THR 9 14.541 24.243 -6.027 56 HG1 THR 9 HG1 THR 9 12.963 22.827 -5.035 57 HG21 THR 9 3HG2 THR 9 14.081 26.459 -6.403 58 HG22 THR 9 1HG2 THR 9 13.195 26.218 -4.898 59 HG23 THR 9 2HG2 THR 9 12.336 26.204 -6.438 60 H THR 10 H THR 10 12.469 26.099 -8.539 61 HA THR 10 HA THR 10 14.427 25.641 -10.664 62 HB THR 10 HB THR 10 13.393 27.703 -11.688 63 HG1 THR 10 HG1 THR 10 11.781 28.686 -10.679 64 HG21 THR 10 3HG2 THR 10 12.731 25.287 -12.165 65 HG22 THR 10 1HG2 THR 10 11.560 26.532 -12.599 66 HG23 THR 10 2HG2 THR 10 11.334 25.582 -11.131 67 H GLU 11 H GLU 11 15.304 27.980 -11.443 68 HA GLU 11 HA GLU 11 17.059 28.800 -9.311 69 HB2 GLU 11 1HB GLU 11 16.857 29.336 -12.239 70 HB3 GLU 11 2HB GLU 11 17.770 30.464 -11.247 71 HG2 GLU 11 1HG GLU 11 18.340 27.568 -10.948 72 HG3 GLU 11 2HG GLU 11 18.903 28.385 -12.405 73 H SER 12 H SER 12 14.153 29.953 -10.773 74 HA SER 12 HA SER 12 14.451 32.664 -9.814 75 HB2 SER 12 1HB SER 12 12.083 31.238 -11.050 76 HB3 SER 12 2HB SER 12 12.142 32.961 -10.680 77 HG SER 12 HG SER 12 14.145 31.808 -12.277 78 H GLY 13 H GLY 13 12.991 29.687 -8.750 79 HA2 GLY 13 1HA GLY 13 12.810 29.685 -6.221 80 HA3 GLY 13 2HA GLY 13 11.807 31.110 -6.450 81 H LEU 14 H LEU 14 10.601 29.947 -8.905 82 HA LEU 14 HA LEU 14 8.274 28.911 -7.846 83 HB2 LEU 14 1HB LEU 14 8.080 29.616 -10.029 84 HB3 LEU 14 2HB LEU 14 9.550 28.787 -10.537 85 HG LEU 14 HG LEU 14 7.232 27.113 -9.730 86 HD11 LEU 14 1HD1 LEU 14 6.818 29.182 -11.519 87 HD12 LEU 14 2HD1 LEU 14 5.842 27.723 -11.355 88 HD13 LEU 14 3HD1 LEU 14 7.142 27.785 -12.545 89 HD21 LEU 14 3HD2 LEU 14 8.916 25.744 -10.391 90 HD22 LEU 14 1HD2 LEU 14 9.624 26.948 -11.468 91 HD23 LEU 14 2HD2 LEU 14 8.196 26.043 -11.973 92 H LYS 15 H LYS 15 7.575 26.961 -7.193 93 HA LYS 15 HA LYS 15 9.299 24.626 -7.671 94 HB2 LYS 15 1HB LYS 15 8.110 25.539 -5.055 95 HB3 LYS 15 2HB LYS 15 8.643 23.884 -5.318 96 HG2 LYS 15 1HG LYS 15 10.904 24.666 -5.761 97 HG3 LYS 15 2HG LYS 15 10.377 26.337 -5.544 98 HD2 LYS 15 1HD LYS 15 10.099 24.231 -3.409 99 HD3 LYS 15 2HD LYS 15 11.515 25.275 -3.556 100 HE2 LYS 15 1HE LYS 15 9.819 27.212 -3.518 101 HE3 LYS 15 2HE LYS 15 8.684 26.014 -2.895 102 HZ1 LYS 15 3HZ LYS 15 10.334 25.548 -1.117 103 HZ2 LYS 15 1HZ LYS 15 9.688 27.111 -1.058 104 HZ3 LYS 15 2HZ LYS 15 11.247 26.862 -1.665 105 H TYR 16 H TYR 16 8.231 22.600 -7.690 106 HA TYR 16 HA TYR 16 5.352 22.505 -7.459 107 HB2 TYR 16 1HB TYR 16 5.141 21.552 -9.813 108 HB3 TYR 16 2HB TYR 16 5.388 23.290 -9.692 109 HD1 TYR 16 HD1 TYR 16 7.015 20.082 -10.519 110 HD2 TYR 16 HD2 TYR 16 7.339 24.324 -10.594 111 HE1 TYR 16 HE1 TYR 16 8.962 19.901 -12.012 112 HE2 TYR 16 HE2 TYR 16 9.286 24.155 -12.087 113 HH TYR 16 HH TYR 16 10.303 21.081 -13.441 114 H GLU 17 H GLU 17 4.698 20.542 -6.815 115 HA GLU 17 HA GLU 17 6.566 18.287 -7.145 116 HB2 GLU 17 1HB GLU 17 5.568 17.483 -4.912 117 HB3 GLU 17 2HB GLU 17 6.757 18.777 -4.868 118 HG2 GLU 17 1HG GLU 17 4.947 20.420 -4.689 119 HG3 GLU 17 2HG GLU 17 3.771 19.108 -4.694 120 H ASP 18 H ASP 18 5.725 16.668 -8.262 121 HA ASP 18 HA ASP 18 3.153 16.571 -9.272 122 HB2 ASP 18 1HB ASP 18 3.682 14.465 -10.126 123 HB3 ASP 18 2HB ASP 18 5.265 15.211 -9.920 124 H LEU 19 H LEU 19 1.224 15.869 -8.565 125 HA LEU 19 HA LEU 19 1.133 14.586 -5.914 126 HB2 LEU 19 1HB LEU 19 0.223 16.999 -6.291 127 HB3 LEU 19 2HB LEU 19 -1.145 16.168 -7.028 128 HG LEU 19 HG LEU 19 -1.454 14.935 -4.874 129 HD11 LEU 19 1HD1 LEU 19 -0.347 16.376 -2.936 130 HD12 LEU 19 2HD1 LEU 19 0.899 16.590 -4.166 131 HD13 LEU 19 3HD1 LEU 19 0.449 14.968 -3.639 132 HD21 LEU 19 3HD2 LEU 19 -1.692 17.920 -5.044 133 HD22 LEU 19 1HD2 LEU 19 -2.260 17.031 -3.630 134 HD23 LEU 19 2HD2 LEU 19 -2.948 16.694 -5.219 135 H THR 20 H THR 20 -0.028 14.589 -9.194 136 HA THR 20 HA THR 20 -0.903 11.864 -8.951 137 HB THR 20 HB THR 20 -3.032 13.786 -9.855 138 HG1 THR 20 HG1 THR 20 -3.892 13.668 -7.752 139 HG21 THR 20 3HG2 THR 20 -2.882 10.887 -9.122 140 HG22 THR 20 1HG2 THR 20 -3.587 11.642 -10.551 141 HG23 THR 20 2HG2 THR 20 -4.412 11.755 -8.996 142 H GLU 21 H GLU 21 -0.066 10.988 -10.720 143 HA GLU 21 HA GLU 21 0.816 12.349 -12.972 144 HB2 GLU 21 1HB GLU 21 1.444 10.014 -12.279 145 HB3 GLU 21 2HB GLU 21 -0.097 9.471 -12.927 146 HG2 GLU 21 1HG GLU 21 0.712 10.648 -15.101 147 HG3 GLU 21 2HG GLU 21 2.306 10.492 -14.364 148 H GLY 22 H GLY 22 -0.078 12.983 -14.860 149 HA2 GLY 22 1HA GLY 22 -2.951 12.396 -15.229 150 HA3 GLY 22 2HA GLY 22 -2.215 13.937 -15.645 151 H SER 23 H SER 23 -3.557 11.437 -17.054 152 HA SER 23 HA SER 23 -1.635 11.379 -19.289 153 HB2 SER 23 1HB SER 23 -3.357 9.228 -18.112 154 HB3 SER 23 2HB SER 23 -2.947 9.165 -19.826 155 HG SER 23 HG SER 23 -1.225 9.080 -17.590 156 H GLY 24 H GLY 24 -2.736 13.349 -20.005 157 HA2 GLY 24 1HA GLY 24 -5.050 12.656 -21.667 158 HA3 GLY 24 2HA GLY 24 -5.199 14.022 -20.571 159 H ALA 25 H ALA 25 -4.108 15.935 -21.013 160 HA ALA 25 HA ALA 25 -2.427 16.095 -23.377 161 HB1 ALA 25 1HB ALA 25 -3.908 16.979 -24.773 162 HB2 ALA 25 2HB ALA 25 -5.168 16.607 -23.596 163 HB3 ALA 25 3HB ALA 25 -4.386 18.188 -23.581 164 H GLU 26 H GLU 26 -0.899 17.628 -23.176 165 HA GLU 26 HA GLU 26 -0.731 19.091 -20.714 166 HB2 GLU 26 1HB GLU 26 1.288 18.167 -21.675 167 HB3 GLU 26 2HB GLU 26 1.035 19.065 -23.165 168 HG2 GLU 26 1HG GLU 26 1.314 21.168 -21.910 169 HG3 GLU 26 2HG GLU 26 1.657 20.227 -20.459 170 H ALA 27 H ALA 27 -1.264 21.146 -20.323 171 HA ALA 27 HA ALA 27 -2.902 22.633 -21.985 172 HB1 ALA 27 1HB ALA 27 -3.003 24.081 -20.276 173 HB2 ALA 27 2HB ALA 27 -2.045 22.876 -19.415 174 HB3 ALA 27 3HB ALA 27 -1.250 24.249 -20.184 175 H ARG 28 H ARG 28 -2.592 23.940 -23.676 176 HA ARG 28 HA ARG 28 0.162 24.444 -24.535 177 HB2 ARG 28 1HB ARG 28 -2.482 24.359 -25.948 178 HB3 ARG 28 2HB ARG 28 -1.126 25.214 -26.671 179 HG2 ARG 28 1HG ARG 28 -1.143 22.309 -25.878 180 HG3 ARG 28 2HG ARG 28 -1.323 22.935 -27.518 181 HD2 ARG 28 1HD ARG 28 1.007 24.076 -26.314 182 HD3 ARG 28 2HD ARG 28 1.058 22.322 -26.135 183 HE ARG 28 HE ARG 28 1.409 23.805 -28.541 184 HH11 ARG 28 1HH1 ARG 28 0.180 20.810 -27.261 185 HH12 ARG 28 2HH1 ARG 28 0.414 19.932 -28.737 186 HH21 ARG 28 1HH2 ARG 28 1.723 22.660 -30.489 187 HH22 ARG 28 2HH2 ARG 28 1.293 20.985 -30.572 188 H ALA 29 H ALA 29 0.938 26.486 -24.985 189 HA ALA 29 HA ALA 29 -0.139 28.623 -23.459 190 HB1 ALA 29 1HB ALA 29 2.158 28.298 -25.324 191 HB2 ALA 29 2HB ALA 29 1.636 29.928 -24.896 192 HB3 ALA 29 3HB ALA 29 2.136 28.803 -23.634 193 H GLY 30 H GLY 30 -1.553 30.168 -23.990 194 HA2 GLY 30 1HA GLY 30 -2.604 31.729 -25.402 195 HA3 GLY 30 2HA GLY 30 -1.985 30.853 -26.794 196 H GLN 31 H GLN 31 -3.242 28.621 -24.705 197 HA GLN 31 HA GLN 31 -5.853 28.679 -26.069 198 HB2 GLN 31 1HB GLN 31 -3.993 26.429 -25.429 199 HB3 GLN 31 2HB GLN 31 -5.722 26.115 -25.478 200 HG2 GLN 31 1HG GLN 31 -5.835 26.879 -27.764 201 HG3 GLN 31 2HG GLN 31 -4.130 27.323 -27.727 202 HE21 GLN 31 2HE2 GLN 31 -5.800 24.446 -26.524 203 HE22 GLN 31 1HE2 GLN 31 -4.912 23.315 -27.481 204 H THR 32 H THR 32 -7.695 28.130 -24.892 205 HA THR 32 HA THR 32 -7.591 28.808 -22.111 206 HB THR 32 HB THR 32 -10.048 27.612 -23.312 207 HG1 THR 32 HG1 THR 32 -8.822 30.041 -24.099 208 HG21 THR 32 3HG2 THR 32 -11.076 29.526 -22.068 209 HG22 THR 32 1HG2 THR 32 -9.467 29.937 -21.477 210 HG23 THR 32 2HG2 THR 32 -10.196 28.390 -21.048 211 H VAL 33 H VAL 33 -8.296 27.504 -20.354 212 HA VAL 33 HA VAL 33 -8.722 24.684 -20.694 213 HB VAL 33 HB VAL 33 -6.261 24.806 -20.905 214 HG11 VAL 33 1HG1 VAL 33 -6.462 26.730 -18.917 215 HG12 VAL 33 2HG1 VAL 33 -5.709 25.350 -18.116 216 HG13 VAL 33 3HG1 VAL 33 -4.976 26.037 -19.566 217 HG21 VAL 33 3HG2 VAL 33 -7.344 23.484 -18.422 218 HG22 VAL 33 1HG2 VAL 33 -7.199 22.784 -20.034 219 HG23 VAL 33 2HG2 VAL 33 -5.750 23.157 -19.101 220 H SER 34 H SER 34 -9.660 23.756 -18.917 221 HA SER 34 HA SER 34 -10.246 25.583 -16.694 222 HB2 SER 34 1HB SER 34 -11.862 23.244 -16.557 223 HB3 SER 34 2HB SER 34 -12.362 24.892 -16.937 224 HG SER 34 HG SER 34 -11.796 24.441 -19.131 225 H VAL 35 H VAL 35 -9.405 25.220 -14.753 226 HA VAL 35 HA VAL 35 -8.702 22.500 -13.950 227 HB VAL 35 HB VAL 35 -6.479 22.998 -13.316 228 HG11 VAL 35 1HG1 VAL 35 -6.970 22.654 -15.782 229 HG12 VAL 35 2HG1 VAL 35 -6.745 24.395 -15.965 230 HG13 VAL 35 3HG1 VAL 35 -5.418 23.390 -15.383 231 HG21 VAL 35 3HG2 VAL 35 -6.752 25.186 -12.376 232 HG22 VAL 35 1HG2 VAL 35 -5.501 25.273 -13.616 233 HG23 VAL 35 2HG2 VAL 35 -7.124 25.873 -13.957 234 H HIS 36 H HIS 36 -8.049 22.436 -11.604 235 HA HIS 36 HA HIS 36 -9.717 24.335 -10.101 236 HB2 HIS 36 1HB HIS 36 -9.099 21.444 -9.790 237 HB3 HIS 36 2HB HIS 36 -9.309 22.379 -8.312 238 HD1 HIS 36 HD1 HIS 36 -11.596 24.242 -9.483 239 HD2 HIS 36 HD2 HIS 36 -11.500 20.091 -9.621 240 HE1 HIS 36 HE1 HIS 36 -13.994 23.521 -9.723 241 H TYR 37 H TYR 37 -8.841 25.632 -8.605 242 HA TYR 37 HA TYR 37 -5.999 25.223 -7.939 243 HB2 TYR 37 1HB TYR 37 -5.766 27.630 -7.752 244 HB3 TYR 37 2HB TYR 37 -6.431 27.229 -9.332 245 HD1 TYR 37 HD1 TYR 37 -7.264 28.566 -5.988 246 HD2 TYR 37 HD2 TYR 37 -8.571 28.018 -10.000 247 HE1 TYR 37 HE1 TYR 37 -9.141 30.102 -5.580 248 HE2 TYR 37 HE2 TYR 37 -10.451 29.553 -9.603 249 HH TYR 37 HH TYR 37 -10.622 31.644 -7.101 250 H THR 38 H THR 38 -5.358 25.374 -5.831 251 HA THR 38 HA THR 38 -7.401 26.004 -3.816 252 HB THR 38 HB THR 38 -5.701 23.927 -2.810 253 HG1 THR 38 HG1 THR 38 -7.134 23.264 -5.186 254 HG21 THR 38 3HG2 THR 38 -7.669 23.947 -1.699 255 HG22 THR 38 1HG2 THR 38 -8.169 22.825 -2.964 256 HG23 THR 38 2HG2 THR 38 -8.570 24.538 -3.095 257 H GLY 39 H GLY 39 -6.645 27.660 -2.674 258 HA2 GLY 39 1HA GLY 39 -3.784 28.117 -2.451 259 HA3 GLY 39 2HA GLY 39 -5.060 29.193 -1.900 260 H TRP 40 H TRP 40 -2.557 27.529 -0.798 261 HA TRP 40 HA TRP 40 -3.834 27.059 1.809 262 HB2 TRP 40 1HB TRP 40 -1.940 25.255 0.317 263 HB3 TRP 40 2HB TRP 40 -2.101 25.170 2.069 264 HD1 TRP 40 HD1 TRP 40 -5.222 25.424 2.368 265 HE1 TRP 40 HE1 TRP 40 -6.756 23.519 1.567 266 HE3 TRP 40 HE3 TRP 40 -2.044 23.155 -0.932 267 HZ2 TRP 40 HZ2 TRP 40 -6.635 21.342 -0.226 268 HZ3 TRP 40 HZ3 TRP 40 -2.830 21.167 -2.149 269 HH2 TRP 40 HH2 TRP 40 -5.078 20.280 -1.801 270 H LEU 41 H LEU 41 -2.775 27.873 3.533 271 HA LEU 41 HA LEU 41 -0.562 29.632 3.065 272 HB2 LEU 41 1HB LEU 41 -2.381 28.995 5.286 273 HB3 LEU 41 2HB LEU 41 -0.767 29.514 5.766 274 HG LEU 41 HG LEU 41 -2.502 31.114 3.899 275 HD11 LEU 41 1HD1 LEU 41 -2.444 31.026 6.886 276 HD12 LEU 41 2HD1 LEU 41 -3.825 31.127 5.795 277 HD13 LEU 41 3HD1 LEU 41 -2.793 32.535 6.043 278 HD21 LEU 41 3HD2 LEU 41 -0.346 31.906 3.680 279 HD22 LEU 41 1HD2 LEU 41 0.070 31.547 5.356 280 HD23 LEU 41 2HD2 LEU 41 -0.971 32.921 4.981 281 H THR 42 H THR 42 1.325 29.576 4.675 282 HA THR 42 HA THR 42 2.928 27.378 4.162 283 HB THR 42 HB THR 42 4.452 28.212 5.868 284 HG1 THR 42 HG1 THR 42 2.417 30.059 6.609 285 HG21 THR 42 3HG2 THR 42 3.076 30.245 4.141 286 HG22 THR 42 1HG2 THR 42 4.640 29.467 3.904 287 HG23 THR 42 2HG2 THR 42 4.445 30.690 5.159 288 H ASP 43 H ASP 43 0.794 28.000 6.893 289 HA ASP 43 HA ASP 43 1.631 25.594 8.272 290 HB2 ASP 43 1HB ASP 43 -0.302 27.809 8.855 291 HB3 ASP 43 2HB ASP 43 -0.411 26.299 9.754 292 H GLY 44 H GLY 44 -0.624 26.445 5.876 293 HA2 GLY 44 1HA GLY 44 -1.633 24.512 4.718 294 HA3 GLY 44 2HA GLY 44 -2.053 23.894 6.309 295 H GLN 45 H GLN 45 -2.620 26.917 6.906 296 HA GLN 45 HA GLN 45 -5.379 26.795 6.858 297 HB2 GLN 45 1HB GLN 45 -3.393 28.994 7.105 298 HB3 GLN 45 2HB GLN 45 -5.061 29.447 6.783 299 HG2 GLN 45 1HG GLN 45 -5.806 28.328 8.772 300 HG3 GLN 45 2HG GLN 45 -4.188 27.692 9.064 301 HE21 GLN 45 2HE2 GLN 45 -5.340 30.914 8.146 302 HE22 GLN 45 1HE2 GLN 45 -4.630 31.740 9.486 303 H LYS 46 H LYS 46 -6.651 26.530 5.152 304 HA LYS 46 HA LYS 46 -5.906 27.280 2.508 305 HB2 LYS 46 1HB LYS 46 -7.481 25.384 3.257 306 HB3 LYS 46 2HB LYS 46 -8.713 26.633 3.381 307 HG2 LYS 46 1HG LYS 46 -8.137 27.203 0.964 308 HG3 LYS 46 2HG LYS 46 -7.274 25.664 0.936 309 HD2 LYS 46 1HD LYS 46 -10.174 25.973 1.702 310 HD3 LYS 46 2HD LYS 46 -9.615 25.536 0.086 311 HE2 LYS 46 1HE LYS 46 -8.555 23.934 2.334 312 HE3 LYS 46 2HE LYS 46 -10.267 23.732 1.965 313 HZ1 LYS 46 3HZ LYS 46 -9.042 22.143 0.713 314 HZ2 LYS 46 1HZ LYS 46 -7.979 23.319 0.121 315 HZ3 LYS 46 2HZ LYS 46 -9.596 23.315 -0.374 316 H PHE 47 H PHE 47 -6.395 29.052 1.338 317 HA PHE 47 HA PHE 47 -8.259 31.011 2.486 318 HB2 PHE 47 1HB PHE 47 -6.703 32.829 1.786 319 HB3 PHE 47 2HB PHE 47 -6.051 31.807 3.063 320 HD1 PHE 47 HD1 PHE 47 -5.902 32.527 -0.554 321 HD2 PHE 47 HD2 PHE 47 -4.057 30.590 2.757 322 HE1 PHE 47 HE1 PHE 47 -3.896 32.113 -1.918 323 HE2 PHE 47 HE2 PHE 47 -2.048 30.175 1.399 324 HZ PHE 47 HZ PHE 47 -1.965 30.937 -0.941 325 H ASP 48 H ASP 48 -8.229 28.998 0.209 326 HA ASP 48 HA ASP 48 -9.788 30.438 -1.607 327 HB2 ASP 48 1HB ASP 48 -7.103 31.001 -1.998 328 HB3 ASP 48 2HB ASP 48 -7.439 29.756 -3.198 329 H SER 49 H SER 49 -11.023 29.011 -2.652 330 HA SER 49 HA SER 49 -9.951 26.393 -3.365 331 HB2 SER 49 1HB SER 49 -11.526 25.125 -2.176 332 HB3 SER 49 2HB SER 49 -11.056 26.370 -1.019 333 HG SER 49 HG SER 49 -13.133 26.702 -0.927 334 H SER 50 H SER 50 -10.448 26.070 -5.418 335 HA SER 50 HA SER 50 -12.387 27.621 -6.798 336 HB2 SER 50 1HB SER 50 -11.879 26.005 -8.697 337 HB3 SER 50 2HB SER 50 -10.497 26.889 -8.049 338 HG SER 50 HG SER 50 -11.177 24.345 -7.049 339 H LYS 51 H LYS 51 -12.425 24.499 -5.265 340 HA LYS 51 HA LYS 51 -14.670 23.379 -6.518 341 HB2 LYS 51 1HB LYS 51 -13.457 23.000 -3.788 342 HB3 LYS 51 2HB LYS 51 -14.887 22.110 -4.295 343 HG2 LYS 51 1HG LYS 51 -12.336 22.088 -5.878 344 HG3 LYS 51 2HG LYS 51 -12.655 20.947 -4.569 345 HD2 LYS 51 1HD LYS 51 -14.841 21.194 -6.504 346 HD3 LYS 51 2HD LYS 51 -13.338 20.571 -7.189 347 HE2 LYS 51 1HE LYS 51 -14.365 18.634 -6.475 348 HE3 LYS 51 2HE LYS 51 -13.344 19.027 -5.093 349 HZ1 LYS 51 3HZ LYS 51 -15.985 18.524 -4.963 350 HZ2 LYS 51 1HZ LYS 51 -15.967 20.216 -4.995 351 HZ3 LYS 51 2HZ LYS 51 -15.111 19.384 -3.797 352 H ASP 52 H ASP 52 -14.386 25.927 -4.226 353 HA ASP 52 HA ASP 52 -16.807 25.846 -2.888 354 HB2 ASP 52 1HB ASP 52 -15.100 27.462 -2.305 355 HB3 ASP 52 2HB ASP 52 -15.257 28.248 -3.873 356 H ARG 53 H ARG 53 -16.081 27.323 -6.037 357 HA ARG 53 HA ARG 53 -18.773 28.168 -6.486 358 HB2 ARG 53 1HB ARG 53 -16.541 29.048 -7.523 359 HB3 ARG 53 2HB ARG 53 -16.791 27.763 -8.697 360 HG2 ARG 53 1HG ARG 53 -18.556 28.800 -9.668 361 HG3 ARG 53 2HG ARG 53 -19.079 29.559 -8.163 362 HD2 ARG 53 1HD ARG 53 -18.304 31.340 -9.460 363 HD3 ARG 53 2HD ARG 53 -16.964 30.987 -8.371 364 HE ARG 53 HE ARG 53 -16.625 29.529 -10.747 365 HH11 ARG 53 1HH1 ARG 53 -16.538 32.805 -9.573 366 HH12 ARG 53 2HH1 ARG 53 -15.392 33.338 -10.759 367 HH21 ARG 53 1HH2 ARG 53 -15.116 30.218 -12.313 368 HH22 ARG 53 2HH2 ARG 53 -14.585 31.866 -12.317 369 H ASN 54 H ASN 54 -17.262 25.173 -6.627 370 HA ASN 54 HA ASN 54 -17.927 23.119 -7.341 371 HB2 ASN 54 1HB ASN 54 -20.124 23.938 -6.376 372 HB3 ASN 54 2HB ASN 54 -20.587 24.381 -8.016 373 HD21 ASN 54 2HD2 ASN 54 -22.349 22.865 -7.525 374 HD22 ASN 54 1HD2 ASN 54 -22.093 21.185 -7.839 375 H ASP 55 H ASP 55 -16.829 25.177 -9.194 376 HA ASP 55 HA ASP 55 -17.398 23.729 -11.657 377 HB2 ASP 55 1HB ASP 55 -18.505 26.288 -11.141 378 HB3 ASP 55 2HB ASP 55 -17.228 26.507 -12.334 379 HA PRO 56 HA PRO 56 -13.061 24.116 -12.231 380 HB2 PRO 56 1HB PRO 56 -12.910 23.905 -14.933 381 HB3 PRO 56 2HB PRO 56 -13.275 22.532 -13.881 382 HG2 PRO 56 1HG PRO 56 -15.142 24.250 -15.470 383 HG3 PRO 56 2HG PRO 56 -15.141 22.489 -15.267 384 HD2 PRO 56 1HD PRO 56 -16.810 24.113 -13.886 385 HD3 PRO 56 2HD PRO 56 -16.177 22.599 -13.211 386 H PHE 57 H PHE 57 -11.512 25.637 -12.659 387 HA PHE 57 HA PHE 57 -12.468 28.270 -13.423 388 HB2 PHE 57 1HB PHE 57 -11.054 28.177 -11.477 389 HB3 PHE 57 2HB PHE 57 -9.812 27.298 -12.360 390 HD1 PHE 57 HD2 PHE 57 -11.743 30.461 -12.835 391 HD2 PHE 57 HD1 PHE 57 -7.950 28.529 -12.843 392 HE1 PHE 57 HE2 PHE 57 -10.664 32.591 -13.427 393 HE2 PHE 57 HE1 PHE 57 -6.864 30.657 -13.435 394 HZ PHE 57 HZ PHE 57 -8.221 32.691 -13.728 395 H ALA 58 H ALA 58 -12.689 28.476 -15.579 396 HA ALA 58 HA ALA 58 -10.660 27.411 -17.374 397 HB1 ALA 58 1HB ALA 58 -12.379 28.696 -19.011 398 HB2 ALA 58 2HB ALA 58 -12.596 27.033 -18.461 399 HB3 ALA 58 3HB ALA 58 -13.437 28.349 -17.642 400 H PHE 59 H PHE 59 -8.941 28.571 -17.905 401 HA PHE 59 HA PHE 59 -9.234 31.463 -18.288 402 HB2 PHE 59 1HB PHE 59 -7.314 31.999 -17.004 403 HB3 PHE 59 2HB PHE 59 -8.267 30.913 -15.998 404 HD1 PHE 59 HD2 PHE 59 -7.609 28.464 -15.932 405 HD2 PHE 59 HD1 PHE 59 -5.100 31.506 -17.534 406 HE1 PHE 59 HE2 PHE 59 -5.660 26.982 -15.685 407 HE2 PHE 59 HE1 PHE 59 -3.147 30.029 -17.290 408 HZ PHE 59 HZ PHE 59 -3.426 27.765 -16.363 409 H VAL 60 H VAL 60 -7.139 32.359 -19.314 410 HA VAL 60 HA VAL 60 -6.524 30.640 -21.589 411 HB VAL 60 HB VAL 60 -5.708 33.518 -21.205 412 HG11 VAL 60 1HG1 VAL 60 -5.390 31.532 -23.311 413 HG12 VAL 60 2HG1 VAL 60 -6.111 33.038 -23.883 414 HG13 VAL 60 3HG1 VAL 60 -4.550 33.062 -23.061 415 HG21 VAL 60 3HG2 VAL 60 -7.753 33.721 -22.906 416 HG22 VAL 60 1HG2 VAL 60 -8.310 32.330 -21.975 417 HG23 VAL 60 2HG2 VAL 60 -7.955 33.854 -21.160 418 H LEU 61 H LEU 61 -4.573 29.773 -21.991 419 HA LEU 61 HA LEU 61 -2.612 29.729 -19.921 420 HB2 LEU 61 1HB LEU 61 -3.271 27.999 -21.839 421 HB3 LEU 61 2HB LEU 61 -1.929 28.799 -22.653 422 HG LEU 61 HG LEU 61 -0.857 27.023 -21.680 423 HD11 LEU 61 1HD1 LEU 61 0.417 27.813 -19.798 424 HD12 LEU 61 2HD1 LEU 61 -0.805 29.030 -19.432 425 HD13 LEU 61 3HD1 LEU 61 0.144 29.151 -20.913 426 HD21 LEU 61 3HD2 LEU 61 -1.396 26.103 -19.472 427 HD22 LEU 61 1HD2 LEU 61 -2.799 26.105 -20.541 428 HD23 LEU 61 2HD2 LEU 61 -2.654 27.324 -19.275 429 H GLY 62 H GLY 62 -0.959 31.064 -19.601 430 HA2 GLY 62 1HA GLY 62 0.965 32.033 -21.098 431 HA3 GLY 62 2HA GLY 62 -0.350 33.049 -21.668 432 H GLY 63 H GLY 63 -1.496 34.345 -20.017 433 HA2 GLY 63 1HA GLY 63 -0.367 34.751 -17.442 434 HA3 GLY 63 2HA GLY 63 0.238 35.955 -18.569 435 H GLY 64 H GLY 64 -2.975 34.590 -18.818 436 HA2 GLY 64 1HA GLY 64 -4.074 37.270 -18.385 437 HA3 GLY 64 2HA GLY 64 -4.906 35.920 -19.141 438 H MET 65 H MET 65 -4.557 37.731 -16.332 439 HA MET 65 HA MET 65 -5.535 37.626 -14.282 440 HB2 MET 65 1HB MET 65 -7.254 36.082 -16.022 441 HB3 MET 65 2HB MET 65 -7.275 35.432 -14.388 442 HG2 MET 65 1HG MET 65 -8.933 36.951 -14.176 443 HG3 MET 65 2HG MET 65 -7.568 37.992 -13.778 444 HE1 MET 65 3HE MET 65 -10.303 39.170 -14.546 445 HE2 MET 65 1HE MET 65 -8.921 40.250 -14.361 446 HE3 MET 65 2HE MET 65 -9.949 40.370 -15.789 447 H VAL 66 H VAL 66 -3.223 35.854 -15.103 448 HA VAL 66 HA VAL 66 -3.344 34.077 -12.761 449 HB VAL 66 HB VAL 66 -2.183 32.327 -13.910 450 HG11 VAL 66 1HG1 VAL 66 -4.768 33.018 -14.430 451 HG12 VAL 66 2HG1 VAL 66 -4.105 32.850 -16.057 452 HG13 VAL 66 3HG1 VAL 66 -4.008 31.504 -14.921 453 HG21 VAL 66 3HG2 VAL 66 -2.013 34.280 -16.193 454 HG22 VAL 66 1HG2 VAL 66 -0.691 33.502 -15.323 455 HG23 VAL 66 2HG2 VAL 66 -1.728 32.551 -16.386 456 H ILE 67 H ILE 67 -1.067 33.292 -12.179 457 HA ILE 67 HA ILE 67 0.738 35.611 -12.303 458 HB ILE 67 HB ILE 67 1.687 34.932 -10.238 459 HG12 ILE 67 1HG1 ILE 67 0.094 32.382 -10.562 460 HG13 ILE 67 2HG1 ILE 67 1.846 32.544 -10.605 461 HG21 ILE 67 1HG2 ILE 67 -1.007 35.564 -10.501 462 HG22 ILE 67 2HG2 ILE 67 -0.968 34.248 -9.328 463 HG23 ILE 67 3HG2 ILE 67 -0.022 35.709 -9.045 464 HD11 ILE 67 3HD1 ILE 67 -0.007 32.692 -8.270 465 HD12 ILE 67 1HD1 ILE 67 1.442 31.712 -8.490 466 HD13 ILE 67 2HD1 ILE 67 1.585 33.447 -8.204 467 H LYS 68 H LYS 68 3.099 35.062 -12.165 468 HA LYS 68 HA LYS 68 3.986 33.706 -14.370 469 HB2 LYS 68 1HB LYS 68 5.305 34.390 -11.766 470 HB3 LYS 68 2HB LYS 68 6.178 33.451 -12.969 471 HG2 LYS 68 1HG LYS 68 5.599 35.321 -14.602 472 HG3 LYS 68 2HG LYS 68 5.150 36.260 -13.176 473 HD2 LYS 68 1HD LYS 68 7.366 36.862 -13.506 474 HD3 LYS 68 2HD LYS 68 7.490 35.584 -12.295 475 HE2 LYS 68 1HE LYS 68 9.165 35.186 -13.948 476 HE3 LYS 68 2HE LYS 68 7.905 33.970 -14.157 477 HZ1 LYS 68 3HZ LYS 68 7.381 34.750 -16.174 478 HZ2 LYS 68 1HZ LYS 68 8.907 35.480 -16.135 479 HZ3 LYS 68 2HZ LYS 68 7.532 36.372 -15.718 480 H GLY 69 H GLY 69 4.030 32.430 -11.034 481 HA2 GLY 69 1HA GLY 69 4.937 29.871 -11.610 482 HA3 GLY 69 2HA GLY 69 3.905 30.277 -10.247 483 H TRP 70 H TRP 70 1.740 31.222 -12.016 484 HA TRP 70 HA TRP 70 0.341 28.771 -12.257 485 HB2 TRP 70 1HB TRP 70 -0.281 31.541 -12.369 486 HB3 TRP 70 2HB TRP 70 -0.903 30.801 -13.842 487 HD1 TRP 70 HD1 TRP 70 -3.205 29.694 -13.639 488 HE1 TRP 70 HE1 TRP 70 -4.718 28.941 -11.697 489 HE3 TRP 70 HE3 TRP 70 -0.010 30.550 -9.741 490 HZ2 TRP 70 HZ2 TRP 70 -4.576 28.738 -8.885 491 HZ3 TRP 70 HZ3 TRP 70 -0.775 30.051 -7.457 492 HH2 TRP 70 HH2 TRP 70 -3.011 29.164 -7.040 493 H ASP 71 H ASP 71 1.336 31.090 -14.783 494 HA ASP 71 HA ASP 71 0.682 29.543 -16.987 495 HB2 ASP 71 1HB ASP 71 1.275 31.874 -17.233 496 HB3 ASP 71 2HB ASP 71 2.910 31.560 -16.655 497 H GLU 72 H GLU 72 3.748 29.675 -15.201 498 HA GLU 72 HA GLU 72 5.185 27.892 -16.812 499 HB2 GLU 72 1HB GLU 72 5.963 29.419 -14.848 500 HB3 GLU 72 2HB GLU 72 5.595 28.025 -13.843 501 HG2 GLU 72 1HG GLU 72 7.505 28.030 -16.169 502 HG3 GLU 72 2HG GLU 72 7.962 28.145 -14.470 503 H GLY 73 H GLY 73 3.108 27.318 -14.001 504 HA2 GLY 73 1HA GLY 73 3.622 24.551 -13.766 505 HA3 GLY 73 2HA GLY 73 2.209 25.388 -13.141 506 H VAL 74 H VAL 74 0.665 26.100 -15.026 507 HA VAL 74 HA VAL 74 -0.447 23.787 -16.112 508 HB VAL 74 HB VAL 74 -1.707 25.398 -17.636 509 HG11 VAL 74 1HG1 VAL 74 -3.226 25.616 -15.998 510 HG12 VAL 74 2HG1 VAL 74 -2.070 24.698 -15.030 511 HG13 VAL 74 3HG1 VAL 74 -2.102 26.460 -14.933 512 HG21 VAL 74 3HG2 VAL 74 -0.981 27.701 -16.026 513 HG22 VAL 74 1HG2 VAL 74 0.373 27.100 -16.983 514 HG23 VAL 74 2HG2 VAL 74 -1.137 27.551 -17.776 515 H GLN 75 H GLN 75 2.048 25.869 -17.324 516 HA GLN 75 HA GLN 75 1.944 25.380 -20.049 517 HB2 GLN 75 1HB GLN 75 3.971 26.261 -18.131 518 HB3 GLN 75 2HB GLN 75 4.648 25.430 -19.525 519 HG2 GLN 75 1HG GLN 75 3.639 26.984 -21.030 520 HG3 GLN 75 2HG GLN 75 2.730 27.737 -19.720 521 HE21 GLN 75 2HE2 GLN 75 5.730 27.552 -21.375 522 HE22 GLN 75 1HE2 GLN 75 6.539 28.809 -20.509 523 H GLY 76 H GLY 76 2.786 23.250 -17.472 524 HA2 GLY 76 1HA GLY 76 3.649 21.234 -19.455 525 HA3 GLY 76 2HA GLY 76 4.308 21.320 -17.828 526 H MET 77 H MET 77 1.597 21.949 -16.738 527 HA MET 77 HA MET 77 0.844 19.441 -15.881 528 HB2 MET 77 1HB MET 77 0.012 21.995 -15.369 529 HB3 MET 77 2HB MET 77 -1.399 21.319 -16.171 530 HG2 MET 77 1HG MET 77 -1.720 19.710 -14.528 531 HG3 MET 77 2HG MET 77 -0.072 19.864 -13.922 532 HE1 MET 77 3HE MET 77 -3.466 21.016 -14.273 533 HE2 MET 77 1HE MET 77 -3.835 21.688 -12.685 534 HE3 MET 77 2HE MET 77 -3.339 22.754 -13.999 535 H LYS 78 H LYS 78 -0.707 17.942 -16.480 536 HA LYS 78 HA LYS 78 -1.740 18.228 -19.226 537 HB2 LYS 78 1HB LYS 78 -0.893 15.723 -17.761 538 HB3 LYS 78 2HB LYS 78 -1.653 15.743 -19.346 539 HG2 LYS 78 1HG LYS 78 0.224 16.481 -20.394 540 HG3 LYS 78 2HG LYS 78 0.802 17.364 -18.980 541 HD2 LYS 78 1HD LYS 78 0.685 14.375 -18.938 542 HD3 LYS 78 2HD LYS 78 2.027 15.196 -19.738 543 HE2 LYS 78 1HE LYS 78 2.356 16.486 -17.596 544 HE3 LYS 78 2HE LYS 78 1.199 15.386 -16.849 545 HZ1 LYS 78 3HZ LYS 78 2.630 13.550 -17.277 546 HZ2 LYS 78 1HZ LYS 78 3.560 14.752 -16.534 547 HZ3 LYS 78 2HZ LYS 78 3.685 14.496 -18.201 548 H VAL 79 H VAL 79 -3.796 17.271 -19.684 549 HA VAL 79 HA VAL 79 -5.810 17.866 -17.884 550 HB VAL 79 HB VAL 79 -5.916 15.826 -20.111 551 HG11 VAL 79 1HG1 VAL 79 -8.402 16.812 -19.985 552 HG12 VAL 79 2HG1 VAL 79 -7.890 15.377 -19.094 553 HG13 VAL 79 3HG1 VAL 79 -7.954 16.943 -18.284 554 HG21 VAL 79 3HG2 VAL 79 -5.936 18.770 -20.055 555 HG22 VAL 79 1HG2 VAL 79 -5.471 17.660 -21.344 556 HG23 VAL 79 2HG2 VAL 79 -7.174 18.020 -21.062 557 H GLY 80 H GLY 80 -6.569 16.920 -16.107 558 HA2 GLY 80 1HA GLY 80 -7.249 15.189 -14.703 559 HA3 GLY 80 2HA GLY 80 -6.525 14.037 -15.815 560 H GLY 81 H GLY 81 -4.240 16.340 -15.310 561 HA2 GLY 81 1HA GLY 81 -2.882 14.640 -13.348 562 HA3 GLY 81 2HA GLY 81 -2.117 15.833 -14.387 563 H VAL 82 H VAL 82 -2.271 15.290 -11.360 564 HA VAL 82 HA VAL 82 -3.011 18.032 -10.568 565 HB VAL 82 HB VAL 82 -2.861 15.639 -8.736 566 HG11 VAL 82 1HG1 VAL 82 -3.743 18.486 -8.428 567 HG12 VAL 82 2HG1 VAL 82 -4.369 17.222 -7.368 568 HG13 VAL 82 3HG1 VAL 82 -2.636 17.549 -7.425 569 HG21 VAL 82 3HG2 VAL 82 -5.527 16.452 -9.006 570 HG22 VAL 82 1HG2 VAL 82 -4.888 16.351 -10.647 571 HG23 VAL 82 2HG2 VAL 82 -4.801 14.950 -9.579 572 H ARG 83 H ARG 83 -1.505 19.297 -9.646 573 HA ARG 83 HA ARG 83 0.923 18.120 -8.546 574 HB2 ARG 83 1HB ARG 83 1.324 18.546 -10.992 575 HB3 ARG 83 2HB ARG 83 1.062 20.256 -10.677 576 HG2 ARG 83 1HG ARG 83 2.966 20.286 -9.163 577 HG3 ARG 83 2HG ARG 83 3.216 18.560 -9.432 578 HD2 ARG 83 1HD ARG 83 3.548 20.824 -11.382 579 HD3 ARG 83 2HD ARG 83 4.761 19.669 -10.831 580 HE ARG 83 HE ARG 83 2.808 19.281 -12.915 581 HH11 ARG 83 1HH1 ARG 83 4.951 17.741 -10.644 582 HH12 ARG 83 2HH1 ARG 83 5.058 16.266 -11.547 583 HH21 ARG 83 1HH2 ARG 83 2.941 17.345 -14.113 584 HH22 ARG 83 2HH2 ARG 83 3.915 16.042 -13.520 585 H ARG 84 H ARG 84 1.824 19.314 -6.928 586 HA ARG 84 HA ARG 84 0.270 21.579 -5.984 587 HB2 ARG 84 1HB ARG 84 1.571 19.500 -4.712 588 HB3 ARG 84 2HB ARG 84 2.641 20.867 -4.431 589 HG2 ARG 84 1HG ARG 84 0.971 22.079 -3.305 590 HG3 ARG 84 2HG ARG 84 -0.304 21.000 -3.875 591 HD2 ARG 84 1HD ARG 84 0.809 19.164 -2.572 592 HD3 ARG 84 2HD ARG 84 1.864 20.393 -1.874 593 HE ARG 84 HE ARG 84 -0.798 21.185 -1.511 594 HH11 ARG 84 1HH1 ARG 84 1.425 18.736 -0.424 595 HH12 ARG 84 2HH1 ARG 84 0.657 18.538 1.116 596 HH21 ARG 84 1HH2 ARG 84 -1.818 20.933 0.514 597 HH22 ARG 84 2HH2 ARG 84 -1.188 19.787 1.649 598 H LEU 85 H LEU 85 0.755 23.431 -7.016 599 HA LEU 85 HA LEU 85 3.506 24.078 -7.684 600 HB2 LEU 85 1HB LEU 85 1.708 24.548 -9.280 601 HB3 LEU 85 2HB LEU 85 0.959 25.634 -8.112 602 HG LEU 85 HG LEU 85 3.343 26.817 -8.290 603 HD11 LEU 85 1HD1 LEU 85 4.170 26.772 -10.566 604 HD12 LEU 85 2HD1 LEU 85 2.946 25.583 -11.012 605 HD13 LEU 85 3HD1 LEU 85 4.219 25.152 -9.870 606 HD21 LEU 85 3HD2 LEU 85 0.976 27.657 -8.784 607 HD22 LEU 85 1HD2 LEU 85 1.326 27.260 -10.467 608 HD23 LEU 85 2HD2 LEU 85 2.317 28.446 -9.616 609 H THR 86 H THR 86 4.786 24.994 -6.235 610 HA THR 86 HA THR 86 3.600 26.615 -4.095 611 HB THR 86 HB THR 86 6.488 26.005 -3.981 612 HG1 THR 86 HG1 THR 86 6.062 23.829 -3.342 613 HG21 THR 86 3HG2 THR 86 4.661 25.235 -1.806 614 HG22 THR 86 1HG2 THR 86 4.638 26.946 -2.231 615 HG23 THR 86 2HG2 THR 86 6.152 26.176 -1.756 616 H ILE 87 H ILE 87 3.690 28.749 -4.256 617 HA ILE 87 HA ILE 87 5.841 29.949 -5.876 618 HB ILE 87 HB ILE 87 3.103 31.109 -5.355 619 HG12 ILE 87 1HG1 ILE 87 3.084 30.694 -7.984 620 HG13 ILE 87 2HG1 ILE 87 4.195 29.402 -7.543 621 HG21 ILE 87 1HG2 ILE 87 3.695 32.806 -6.937 622 HG22 ILE 87 2HG2 ILE 87 4.960 32.728 -5.712 623 HG23 ILE 87 3HG2 ILE 87 5.224 32.004 -7.298 624 HD11 ILE 87 3HD1 ILE 87 2.447 28.136 -7.084 625 HD12 ILE 87 1HD1 ILE 87 2.050 29.223 -5.753 626 HD13 ILE 87 2HD1 ILE 87 1.346 29.489 -7.349 627 HA PRO 88 HA PRO 88 7.195 31.854 -2.119 628 HB2 PRO 88 1HB PRO 88 8.906 33.640 -3.238 629 HB3 PRO 88 2HB PRO 88 9.275 31.918 -3.093 630 HG2 PRO 88 1HG PRO 88 8.264 33.447 -5.460 631 HG3 PRO 88 2HG PRO 88 9.516 32.193 -5.390 632 HD2 PRO 88 1HD PRO 88 6.986 31.682 -6.209 633 HD3 PRO 88 2HD PRO 88 7.975 30.479 -5.355 634 HA PRO 89 HA PRO 89 5.024 35.630 -1.510 635 HB2 PRO 89 1HB PRO 89 6.755 37.130 -0.053 636 HB3 PRO 89 2HB PRO 89 5.915 35.721 0.606 637 HG2 PRO 89 1HG PRO 89 8.711 35.942 -0.438 638 HG3 PRO 89 2HG PRO 89 8.120 35.103 1.007 639 HD2 PRO 89 1HD PRO 89 8.688 33.806 -1.301 640 HD3 PRO 89 2HD PRO 89 7.406 33.270 -0.195 641 H GLN 90 H GLN 90 7.796 35.567 -3.412 642 HA GLN 90 HA GLN 90 7.681 38.414 -4.070 643 HB2 GLN 90 1HB GLN 90 9.628 36.213 -4.710 644 HB3 GLN 90 2HB GLN 90 9.655 37.737 -5.587 645 HG2 GLN 90 1HG GLN 90 10.009 37.384 -2.620 646 HG3 GLN 90 2HG GLN 90 11.274 37.750 -3.791 647 HE21 GLN 90 2HE2 GLN 90 9.584 39.096 -1.442 648 HE22 GLN 90 1HE2 GLN 90 9.454 40.722 -2.011 649 H LEU 91 H LEU 91 7.435 35.243 -5.654 650 HA LEU 91 HA LEU 91 6.421 36.502 -8.079 651 HB2 LEU 91 1HB LEU 91 6.721 33.553 -7.612 652 HB3 LEU 91 2HB LEU 91 6.707 34.427 -9.142 653 HG LEU 91 HG LEU 91 8.927 34.345 -7.105 654 HD11 LEU 91 1HD1 LEU 91 9.698 33.711 -9.769 655 HD12 LEU 91 2HD1 LEU 91 8.292 32.736 -9.341 656 HD13 LEU 91 3HD1 LEU 91 9.737 32.690 -8.332 657 HD21 LEU 91 3HD2 LEU 91 10.167 35.777 -8.680 658 HD22 LEU 91 1HD2 LEU 91 8.768 36.595 -7.984 659 HD23 LEU 91 2HD2 LEU 91 8.696 35.974 -9.634 660 H GLY 92 H GLY 92 4.988 36.143 -5.357 661 HA2 GLY 92 1HA GLY 92 2.573 34.818 -6.423 662 HA3 GLY 92 2HA GLY 92 2.979 34.910 -4.716 663 H TYR 93 H TYR 93 2.441 36.713 -3.548 664 HA TYR 93 HA TYR 93 0.653 38.592 -4.913 665 HB2 TYR 93 1HB TYR 93 1.008 37.986 -1.971 666 HB3 TYR 93 2HB TYR 93 -0.129 39.159 -2.624 667 HD1 TYR 93 HD2 TYR 93 -1.319 37.807 -4.885 668 HD2 TYR 93 HD1 TYR 93 -0.211 36.226 -1.094 669 HE1 TYR 93 HE2 TYR 93 -3.007 36.036 -5.137 670 HE2 TYR 93 HE1 TYR 93 -1.895 34.450 -1.336 671 HH TYR 93 HH TYR 93 -3.773 34.091 -4.308 672 H GLY 94 H GLY 94 3.679 38.394 -3.234 673 HA2 GLY 94 1HA GLY 94 5.282 40.180 -3.776 674 HA3 GLY 94 2HA GLY 94 3.970 41.321 -3.520 675 H ALA 95 H ALA 95 5.917 42.116 -2.143 676 HA ALA 95 HA ALA 95 6.425 40.808 0.331 677 HB1 ALA 95 1HB ALA 95 7.019 43.531 -0.758 678 HB2 ALA 95 2HB ALA 95 7.321 43.157 0.939 679 HB3 ALA 95 3HB ALA 95 8.131 42.232 -0.325 680 H ARG 96 H ARG 96 3.930 42.901 -0.792 681 HA ARG 96 HA ARG 96 3.108 43.751 1.847 682 HB2 ARG 96 1HB ARG 96 2.171 44.236 -0.945 683 HB3 ARG 96 2HB ARG 96 1.035 44.498 0.372 684 HG2 ARG 96 1HG ARG 96 2.962 45.916 1.393 685 HG3 ARG 96 2HG ARG 96 3.559 45.950 -0.267 686 HD2 ARG 96 1HD ARG 96 1.234 46.725 -0.929 687 HD3 ARG 96 2HD ARG 96 0.936 46.971 0.791 688 HE ARG 96 HE ARG 96 2.461 48.646 -0.941 689 HH11 ARG 96 1HH1 ARG 96 2.186 47.517 2.341 690 HH12 ARG 96 2HH1 ARG 96 2.946 48.916 3.024 691 HH21 ARG 96 1HH2 ARG 96 3.464 50.493 -0.053 692 HH22 ARG 96 2HH2 ARG 96 3.672 50.608 1.662 693 H GLY 97 H GLY 97 2.361 41.211 -0.403 694 HA2 GLY 97 1HA GLY 97 1.212 39.239 0.027 695 HA3 GLY 97 2HA GLY 97 0.748 39.885 1.594 696 H ALA 98 H ALA 98 -1.060 38.471 0.096 697 HA ALA 98 HA ALA 98 -2.723 40.281 -1.416 698 HB1 ALA 98 1HB ALA 98 -2.776 37.389 -0.753 699 HB2 ALA 98 2HB ALA 98 -4.301 38.165 -1.180 700 HB3 ALA 98 3HB ALA 98 -2.947 38.199 -2.310 701 H GLY 99 H GLY 99 -4.231 41.577 -0.599 702 HA2 GLY 99 1HA GLY 99 -5.630 42.584 0.920 703 HA3 GLY 99 2HA GLY 99 -6.142 40.944 1.292 704 H GLY 100 H GLY 100 -5.955 40.383 3.350 705 HA2 GLY 100 1HA GLY 100 -3.679 41.420 4.896 706 HA3 GLY 100 2HA GLY 100 -5.307 41.646 5.519 707 H VAL 101 H VAL 101 -4.749 38.754 3.766 708 HA VAL 101 HA VAL 101 -4.856 37.240 6.279 709 HB VAL 101 HB VAL 101 -5.491 36.346 3.463 710 HG11 VAL 101 1HG1 VAL 101 -5.288 34.267 4.214 711 HG12 VAL 101 2HG1 VAL 101 -4.898 34.851 5.833 712 HG13 VAL 101 3HG1 VAL 101 -6.580 34.591 5.369 713 HG21 VAL 101 3HG2 VAL 101 -7.252 37.738 4.069 714 HG22 VAL 101 1HG2 VAL 101 -7.822 36.142 4.559 715 HG23 VAL 101 2HG2 VAL 101 -7.179 37.257 5.764 716 H ILE 102 H ILE 102 -3.027 37.630 3.311 717 HA ILE 102 HA ILE 102 -1.176 35.506 4.079 718 HB ILE 102 HB ILE 102 -1.169 37.253 1.615 719 HG12 ILE 102 1HG1 ILE 102 -3.154 35.777 1.780 720 HG13 ILE 102 2HG1 ILE 102 -2.093 35.329 0.449 721 HG21 ILE 102 1HG2 ILE 102 0.358 34.719 2.194 722 HG22 ILE 102 2HG2 ILE 102 0.432 35.679 0.717 723 HG23 ILE 102 3HG2 ILE 102 1.038 36.346 2.233 724 HD11 ILE 102 3HD1 ILE 102 -1.764 33.297 1.276 725 HD12 ILE 102 1HD1 ILE 102 -1.448 33.917 2.896 726 HD13 ILE 102 2HD1 ILE 102 -3.108 33.642 2.365 727 HA PRO 103 HA PRO 103 1.597 38.372 5.994 728 HB2 PRO 103 1HB PRO 103 3.747 36.721 6.149 729 HB3 PRO 103 2HB PRO 103 2.346 36.577 7.217 730 HG2 PRO 103 1HG PRO 103 3.019 35.013 4.756 731 HG3 PRO 103 2HG PRO 103 2.384 34.437 6.308 732 HD2 PRO 103 1HD PRO 103 0.810 34.805 4.135 733 HD3 PRO 103 2HD PRO 103 0.222 35.049 5.793 734 HA PRO 104 HA PRO 104 4.196 40.133 2.916 735 HB2 PRO 104 1HB PRO 104 6.377 40.902 4.339 736 HB3 PRO 104 2HB PRO 104 4.812 41.715 4.463 737 HG2 PRO 104 1HG PRO 104 6.030 39.663 6.271 738 HG3 PRO 104 2HG PRO 104 5.152 41.145 6.692 739 HD2 PRO 104 1HD PRO 104 3.992 38.699 6.750 740 HD3 PRO 104 2HD PRO 104 3.091 40.173 6.343 741 H ASN 105 H ASN 105 6.113 38.088 5.127 742 HA ASN 105 HA ASN 105 7.553 37.056 2.771 743 HB2 ASN 105 1HB ASN 105 8.504 37.696 5.546 744 HB3 ASN 105 2HB ASN 105 9.346 36.490 4.578 745 HD21 ASN 105 2HD2 ASN 105 11.146 37.395 3.884 746 HD22 ASN 105 1HD2 ASN 105 11.274 38.944 3.129 747 H ALA 106 H ALA 106 6.676 35.139 2.298 748 HA ALA 106 HA ALA 106 7.018 32.905 3.951 749 HB1 ALA 106 1HB ALA 106 4.910 34.325 4.876 750 HB2 ALA 106 2HB ALA 106 4.105 33.241 3.741 751 HB3 ALA 106 3HB ALA 106 5.083 32.578 5.050 752 H THR 107 H THR 107 6.426 30.950 2.932 753 HA THR 107 HA THR 107 6.136 31.200 0.059 754 HB THR 107 HB THR 107 6.562 28.766 1.802 755 HG1 THR 107 HG1 THR 107 8.681 28.902 0.904 756 HG21 THR 107 3HG2 THR 107 7.278 27.842 -0.542 757 HG22 THR 107 1HG2 THR 107 6.184 29.087 -1.145 758 HG23 THR 107 2HG2 THR 107 5.580 27.829 -0.066 759 H LEU 108 H LEU 108 4.318 30.891 -1.056 760 HA LEU 108 HA LEU 108 1.931 30.020 0.393 761 HB2 LEU 108 1HB LEU 108 2.185 31.267 -2.340 762 HB3 LEU 108 2HB LEU 108 0.680 30.945 -1.479 763 HG LEU 108 HG LEU 108 2.784 32.830 -0.436 764 HD11 LEU 108 1HD1 LEU 108 0.388 33.456 -2.154 765 HD12 LEU 108 2HD1 LEU 108 2.081 33.646 -2.606 766 HD13 LEU 108 3HD1 LEU 108 1.393 34.646 -1.327 767 HD21 LEU 108 3HD2 LEU 108 1.446 33.002 1.325 768 HD22 LEU 108 1HD2 LEU 108 0.420 31.737 0.648 769 HD23 LEU 108 2HD2 LEU 108 0.086 33.430 0.285 770 H VAL 109 H VAL 109 1.032 28.090 0.081 771 HA VAL 109 HA VAL 109 2.098 26.390 -2.058 772 HB VAL 109 HB VAL 109 0.533 25.659 0.420 773 HG11 VAL 109 1HG1 VAL 109 1.075 24.189 -2.024 774 HG12 VAL 109 2HG1 VAL 109 1.689 23.362 -0.591 775 HG13 VAL 109 3HG1 VAL 109 -0.015 23.805 -0.692 776 HG21 VAL 109 3HG2 VAL 109 3.175 26.329 0.226 777 HG22 VAL 109 1HG2 VAL 109 2.479 25.290 1.469 778 HG23 VAL 109 2HG2 VAL 109 3.224 24.576 0.038 779 H PHE 110 H PHE 110 0.942 26.368 -3.866 780 HA PHE 110 HA PHE 110 -1.997 26.438 -3.653 781 HB2 PHE 110 1HB PHE 110 -0.158 27.580 -5.751 782 HB3 PHE 110 2HB PHE 110 -1.874 27.322 -6.051 783 HD1 PHE 110 HD1 PHE 110 -3.557 28.602 -4.798 784 HD2 PHE 110 HD2 PHE 110 0.609 29.375 -4.390 785 HE1 PHE 110 HE1 PHE 110 -4.065 30.780 -3.772 786 HE2 PHE 110 HE2 PHE 110 0.108 31.553 -3.363 787 HZ PHE 110 HZ PHE 110 -2.231 32.258 -3.052 788 H GLU 111 H GLU 111 -3.129 24.812 -4.538 789 HA GLU 111 HA GLU 111 -1.608 22.723 -5.937 790 HB2 GLU 111 1HB GLU 111 -2.637 21.856 -3.972 791 HB3 GLU 111 2HB GLU 111 -4.166 22.639 -4.345 792 HG2 GLU 111 1HG GLU 111 -3.161 20.716 -6.342 793 HG3 GLU 111 2HG GLU 111 -3.681 20.049 -4.796 794 H VAL 112 H VAL 112 -1.920 22.432 -8.038 795 HA VAL 112 HA VAL 112 -4.391 23.490 -9.250 796 HB VAL 112 HB VAL 112 -1.817 23.131 -10.762 797 HG11 VAL 112 1HG1 VAL 112 -4.300 23.601 -11.665 798 HG12 VAL 112 2HG1 VAL 112 -3.765 25.260 -11.388 799 HG13 VAL 112 3HG1 VAL 112 -2.848 24.205 -12.464 800 HG21 VAL 112 3HG2 VAL 112 -1.040 24.626 -9.187 801 HG22 VAL 112 1HG2 VAL 112 -1.696 25.715 -10.410 802 HG23 VAL 112 2HG2 VAL 112 -2.624 25.365 -8.951 803 H GLU 113 H GLU 113 -5.637 22.113 -10.354 804 HA GLU 113 HA GLU 113 -4.486 19.540 -11.195 805 HB2 GLU 113 1HB GLU 113 -5.685 18.950 -9.252 806 HB3 GLU 113 2HB GLU 113 -7.014 20.033 -9.642 807 HG2 GLU 113 1HG GLU 113 -7.759 18.605 -11.400 808 HG3 GLU 113 2HG GLU 113 -6.325 17.590 -11.253 809 H LEU 114 H LEU 114 -4.691 19.293 -13.310 810 HA LEU 114 HA LEU 114 -6.322 20.977 -14.909 811 HB2 LEU 114 1HB LEU 114 -4.127 19.515 -15.390 812 HB3 LEU 114 2HB LEU 114 -5.349 18.420 -16.033 813 HG LEU 114 HG LEU 114 -4.563 19.673 -17.866 814 HD11 LEU 114 1HD1 LEU 114 -7.086 21.063 -16.987 815 HD12 LEU 114 2HD1 LEU 114 -7.033 19.440 -17.672 816 HD13 LEU 114 3HD1 LEU 114 -6.514 20.822 -18.638 817 HD21 LEU 114 3HD2 LEU 114 -5.063 22.351 -17.395 818 HD22 LEU 114 1HD2 LEU 114 -3.482 21.570 -17.427 819 HD23 LEU 114 2HD2 LEU 114 -4.326 21.788 -15.894 820 H LEU 115 H LEU 115 -8.388 20.776 -15.460 821 HA LEU 115 HA LEU 115 -9.750 18.243 -14.873 822 HB2 LEU 115 1HB LEU 115 -10.686 21.082 -15.094 823 HB3 LEU 115 2HB LEU 115 -11.822 19.739 -15.190 824 HG LEU 115 HG LEU 115 -10.038 19.693 -12.851 825 HD11 LEU 115 1HD1 LEU 115 -12.146 21.448 -12.156 826 HD12 LEU 115 2HD1 LEU 115 -11.314 22.135 -13.551 827 HD13 LEU 115 3HD1 LEU 115 -10.408 21.739 -12.091 828 HD21 LEU 115 3HD2 LEU 115 -11.949 18.866 -11.767 829 HD22 LEU 115 1HD2 LEU 115 -12.011 18.176 -13.389 830 HD23 LEU 115 2HD2 LEU 115 -13.037 19.550 -12.976 831 H ASP 116 H ASP 116 -9.794 20.839 -17.318 832 HA ASP 116 HA ASP 116 -9.883 18.902 -19.450 833 HB2 ASP 116 1HB ASP 116 -12.278 20.594 -18.767 834 HB3 ASP 116 2HB ASP 116 -11.997 20.023 -20.410 835 H VAL 117 H VAL 117 -9.860 19.963 -21.603 836 HA VAL 117 HA VAL 117 -8.644 22.646 -21.440 837 HB VAL 117 HB VAL 117 -7.951 20.411 -23.352 838 HG11 VAL 117 1HG1 VAL 117 -7.665 22.339 -24.617 839 HG12 VAL 117 2HG1 VAL 117 -7.140 23.292 -23.228 840 HG13 VAL 117 3HG1 VAL 117 -6.065 22.079 -23.923 841 HG21 VAL 117 3HG2 VAL 117 -6.030 20.044 -22.154 842 HG22 VAL 117 1HG2 VAL 117 -6.009 21.674 -21.480 843 HG23 VAL 117 2HG2 VAL 117 -7.138 20.474 -20.851 844 H11 L2S 130 1H1 L2S 130 -4.675 31.533 -9.438 845 H21 L2S 130 2H1 L2S 130 -5.220 32.118 -11.083 846 H12 L2S 130 1H2 L2S 130 -4.971 34.393 -10.371 847 H22 L2S 130 2H2 L2S 130 -3.388 33.498 -10.175 848 H13 L2S 130 2H3 L2S 130 -3.841 33.272 -7.818 849 H23 L2S 130 1H3 L2S 130 -3.983 35.037 -8.261 850 H14 L2S 130 1H4 L2S 130 -6.281 32.018 -7.444 851 H24 L2S 130 2H4 L2S 130 -7.668 33.145 -7.812 852 H15 L2S 130 1H5 L2S 130 -7.135 31.500 -9.644 853 H25 L2S 130 2H5 L2S 130 -7.067 33.276 -10.081 854 H17 L2S 130 1H7 L2S 130 -8.218 34.948 -7.168 855 H27 L2S 130 2H7 L2S 130 -7.663 34.322 -5.526 856 H9 L2S 130 H9 L2S 130 -5.909 35.261 -4.292 857 H10 L2S 130 H10 L2S 130 -5.574 34.737 -1.876 858 H112 L2S 130 1H12 L2S 130 -8.870 37.414 -0.846 859 H113 L2S 130 1H13 L2S 130 -9.222 37.886 -3.262 860 H114 L2S 130 1H14 L2S 130 -7.168 34.688 0.308 861 H214 L2S 130 2H14 L2S 130 -7.732 36.321 0.736 862 H314 L2S 130 3H14 L2S 130 -5.993 36.047 0.377 Start of MODEL 17 1 H1 GLY 1 H GLY 1 12.590 6.617 -15.586 2 HA2 GLY 1 1HA GLY 1 11.912 5.381 -13.635 3 HA3 GLY 1 2HA GLY 1 12.608 6.886 -13.053 4 HA PRO 2 HA PRO 2 8.350 6.419 -11.255 5 HB2 PRO 2 1HB PRO 2 9.102 6.974 -8.707 6 HB3 PRO 2 2HB PRO 2 9.156 5.345 -9.391 7 HG2 PRO 2 1HG PRO 2 11.371 7.329 -9.045 8 HG3 PRO 2 2HG PRO 2 11.374 5.583 -8.735 9 HD2 PRO 2 1HD PRO 2 12.431 6.665 -10.980 10 HD3 PRO 2 2HD PRO 2 11.672 5.061 -10.960 11 H GLY 3 H GLY 3 7.013 8.122 -11.219 12 HA2 GLY 3 1HA GLY 3 8.195 10.802 -11.095 13 HA3 GLY 3 2HA GLY 3 6.601 10.405 -11.719 14 H SER 4 H SER 4 7.831 9.227 -8.656 15 HA SER 4 HA SER 4 6.179 11.163 -7.208 16 HB2 SER 4 1HB SER 4 5.002 9.499 -5.971 17 HB3 SER 4 2HB SER 4 4.869 9.033 -7.667 18 HG SER 4 HG SER 4 5.842 7.610 -5.662 19 H MET 5 H MET 5 6.534 10.948 -4.790 20 HA MET 5 HA MET 5 7.961 11.113 -3.028 21 HB2 MET 5 1HB MET 5 9.112 8.686 -4.402 22 HB3 MET 5 2HB MET 5 9.686 9.266 -2.844 23 HG2 MET 5 1HG MET 5 7.618 8.814 -1.804 24 HG3 MET 5 2HG MET 5 6.812 8.570 -3.352 25 HE1 MET 5 3HE MET 5 6.314 6.993 -1.169 26 HE2 MET 5 1HE MET 5 6.229 5.409 -1.939 27 HE3 MET 5 2HE MET 5 7.400 5.702 -0.653 28 H THR 6 H THR 6 8.526 12.653 -5.419 29 HA THR 6 HA THR 6 11.273 13.361 -4.793 30 HB THR 6 HB THR 6 10.483 12.787 -7.654 31 HG1 THR 6 HG1 THR 6 12.000 11.294 -5.770 32 HG21 THR 6 3HG2 THR 6 13.225 12.876 -7.490 33 HG22 THR 6 1HG2 THR 6 12.729 14.157 -6.385 34 HG23 THR 6 2HG2 THR 6 12.190 14.183 -8.065 35 H VAL 7 H VAL 7 11.536 15.508 -4.799 36 HA VAL 7 HA VAL 7 9.633 17.155 -6.326 37 HB VAL 7 HB VAL 7 8.978 17.127 -3.941 38 HG11 VAL 7 1HG1 VAL 7 10.412 17.409 -2.253 39 HG12 VAL 7 2HG1 VAL 7 11.686 17.164 -3.449 40 HG13 VAL 7 3HG1 VAL 7 11.177 18.798 -3.023 41 HG21 VAL 7 3HG2 VAL 7 8.398 19.068 -5.201 42 HG22 VAL 7 1HG2 VAL 7 8.990 19.616 -3.632 43 HG23 VAL 7 2HG2 VAL 7 10.029 19.723 -5.054 44 H VAL 8 H VAL 8 10.500 18.827 -7.418 45 HA VAL 8 HA VAL 8 13.337 19.458 -6.922 46 HB VAL 8 HB VAL 8 13.168 18.223 -8.999 47 HG11 VAL 8 1HG1 VAL 8 11.875 19.285 -10.909 48 HG12 VAL 8 2HG1 VAL 8 10.921 18.495 -9.653 49 HG13 VAL 8 3HG1 VAL 8 11.060 20.254 -9.682 50 HG21 VAL 8 3HG2 VAL 8 14.179 19.841 -10.518 51 HG22 VAL 8 1HG2 VAL 8 13.575 21.166 -9.524 52 HG23 VAL 8 2HG2 VAL 8 14.786 20.059 -8.877 53 H THR 9 H THR 9 13.964 21.594 -7.055 54 HA THR 9 HA THR 9 11.783 23.559 -7.336 55 HB THR 9 HB THR 9 14.158 23.689 -5.469 56 HG1 THR 9 HG1 THR 9 12.732 22.538 -4.357 57 HG21 THR 9 3HG2 THR 9 12.197 25.720 -6.380 58 HG22 THR 9 1HG2 THR 9 13.874 25.915 -5.873 59 HG23 THR 9 2HG2 THR 9 12.606 25.707 -4.665 60 H THR 10 H THR 10 12.207 25.454 -8.433 61 HA THR 10 HA THR 10 14.441 25.351 -10.270 62 HB THR 10 HB THR 10 13.418 27.285 -11.353 63 HG1 THR 10 HG1 THR 10 11.571 28.236 -10.474 64 HG21 THR 10 3HG2 THR 10 11.155 25.433 -10.673 65 HG22 THR 10 1HG2 THR 10 12.529 24.883 -11.630 66 HG23 THR 10 2HG2 THR 10 11.525 26.211 -12.211 67 H GLU 11 H GLU 11 15.302 27.754 -10.775 68 HA GLU 11 HA GLU 11 16.795 28.475 -8.416 69 HB2 GLU 11 1HB GLU 11 16.886 29.217 -11.309 70 HB3 GLU 11 2HB GLU 11 17.671 30.271 -10.142 71 HG2 GLU 11 1HG GLU 11 19.047 28.427 -9.369 72 HG3 GLU 11 2HG GLU 11 18.237 27.336 -10.491 73 H SER 12 H SER 12 14.240 29.868 -10.385 74 HA SER 12 HA SER 12 14.274 32.451 -9.234 75 HB2 SER 12 1HB SER 12 11.767 31.199 -10.316 76 HB3 SER 12 2HB SER 12 12.323 32.867 -10.450 77 HG SER 12 HG SER 12 12.520 31.436 -12.373 78 H GLY 13 H GLY 13 12.898 29.417 -8.238 79 HA2 GLY 13 1HA GLY 13 12.575 29.355 -5.744 80 HA3 GLY 13 2HA GLY 13 11.585 30.789 -5.974 81 H LEU 14 H LEU 14 10.526 29.625 -8.533 82 HA LEU 14 HA LEU 14 8.126 28.620 -7.614 83 HB2 LEU 14 1HB LEU 14 8.109 29.326 -9.816 84 HB3 LEU 14 2HB LEU 14 9.568 28.425 -10.222 85 HG LEU 14 HG LEU 14 7.144 26.860 -9.525 86 HD11 LEU 14 1HD1 LEU 14 7.069 28.899 -11.503 87 HD12 LEU 14 2HD1 LEU 14 5.842 27.696 -11.109 88 HD13 LEU 14 3HD1 LEU 14 7.076 27.334 -12.314 89 HD21 LEU 14 3HD2 LEU 14 8.082 25.563 -11.528 90 HD22 LEU 14 1HD2 LEU 14 9.016 25.560 -10.032 91 HD23 LEU 14 2HD2 LEU 14 9.497 26.605 -11.369 92 H LYS 15 H LYS 15 7.332 26.655 -7.080 93 HA LYS 15 HA LYS 15 9.051 24.303 -7.431 94 HB2 LYS 15 1HB LYS 15 7.580 24.815 -4.852 95 HB3 LYS 15 2HB LYS 15 8.810 23.601 -5.178 96 HG2 LYS 15 1HG LYS 15 10.351 25.639 -5.610 97 HG3 LYS 15 2HG LYS 15 9.126 26.533 -4.707 98 HD2 LYS 15 1HD LYS 15 10.381 24.010 -3.656 99 HD3 LYS 15 2HD LYS 15 11.086 25.604 -3.376 100 HE2 LYS 15 1HE LYS 15 8.242 24.909 -2.674 101 HE3 LYS 15 2HE LYS 15 9.585 24.721 -1.548 102 HZ1 LYS 15 3HZ LYS 15 8.257 27.130 -2.458 103 HZ2 LYS 15 1HZ LYS 15 9.943 27.235 -2.363 104 HZ3 LYS 15 2HZ LYS 15 9.044 26.813 -0.994 105 H TYR 16 H TYR 16 7.886 22.255 -7.179 106 HA TYR 16 HA TYR 16 4.997 22.332 -7.239 107 HB2 TYR 16 1HB TYR 16 5.008 21.031 -9.458 108 HB3 TYR 16 2HB TYR 16 5.243 22.774 -9.532 109 HD1 TYR 16 HD1 TYR 16 6.934 19.506 -9.791 110 HD2 TYR 16 HD2 TYR 16 7.290 23.711 -10.331 111 HE1 TYR 16 HE1 TYR 16 9.027 19.163 -11.037 112 HE2 TYR 16 HE2 TYR 16 9.383 23.380 -11.579 113 HH TYR 16 HH TYR 16 11.025 21.868 -12.052 114 H GLU 17 H GLU 17 4.053 20.351 -6.801 115 HA GLU 17 HA GLU 17 5.881 18.082 -6.400 116 HB2 GLU 17 1HB GLU 17 5.241 19.357 -4.265 117 HB3 GLU 17 2HB GLU 17 3.628 18.700 -4.502 118 HG2 GLU 17 1HG GLU 17 5.943 16.835 -4.508 119 HG3 GLU 17 2HG GLU 17 5.383 17.495 -2.973 120 H ASP 18 H ASP 18 5.248 16.406 -7.566 121 HA ASP 18 HA ASP 18 2.830 16.257 -8.965 122 HB2 ASP 18 1HB ASP 18 3.459 13.941 -9.469 123 HB3 ASP 18 2HB ASP 18 4.842 15.019 -9.633 124 H LEU 19 H LEU 19 0.842 15.703 -8.376 125 HA LEU 19 HA LEU 19 0.491 14.286 -5.817 126 HB2 LEU 19 1HB LEU 19 -0.955 16.533 -7.096 127 HB3 LEU 19 2HB LEU 19 -1.921 15.366 -6.194 128 HG LEU 19 HG LEU 19 0.404 16.912 -5.051 129 HD11 LEU 19 1HD1 LEU 19 -0.990 18.643 -4.970 130 HD12 LEU 19 2HD1 LEU 19 -1.934 17.717 -3.804 131 HD13 LEU 19 3HD1 LEU 19 -2.353 17.665 -5.516 132 HD21 LEU 19 3HD2 LEU 19 -1.539 14.921 -3.952 133 HD22 LEU 19 1HD2 LEU 19 -0.844 16.161 -2.907 134 HD23 LEU 19 2HD2 LEU 19 0.210 15.017 -3.738 135 H THR 20 H THR 20 -0.462 14.474 -9.180 136 HA THR 20 HA THR 20 -1.271 11.719 -9.167 137 HB THR 20 HB THR 20 -3.413 13.656 -10.012 138 HG1 THR 20 HG1 THR 20 -4.144 13.756 -8.003 139 HG21 THR 20 3HG2 THR 20 -3.454 10.737 -9.237 140 HG22 THR 20 1HG2 THR 20 -3.556 11.376 -10.877 141 HG23 THR 20 2HG2 THR 20 -4.855 11.688 -9.726 142 H GLU 21 H GLU 21 -0.524 10.917 -11.009 143 HA GLU 21 HA GLU 21 0.507 12.453 -13.100 144 HB2 GLU 21 1HB GLU 21 0.852 9.933 -12.454 145 HB3 GLU 21 2HB GLU 21 -0.463 9.664 -13.590 146 HG2 GLU 21 1HG GLU 21 0.975 11.097 -15.201 147 HG3 GLU 21 2HG GLU 21 2.290 10.697 -14.097 148 H GLY 22 H GLY 22 -0.239 12.984 -15.143 149 HA2 GLY 22 1HA GLY 22 -3.109 12.509 -15.642 150 HA3 GLY 22 2HA GLY 22 -2.415 14.114 -15.820 151 H SER 23 H SER 23 -2.733 10.952 -17.209 152 HA SER 23 HA SER 23 -1.008 11.598 -19.459 153 HB2 SER 23 1HB SER 23 -2.496 9.145 -18.577 154 HB3 SER 23 2HB SER 23 -1.910 9.273 -20.235 155 HG SER 23 HG SER 23 -0.043 8.713 -19.481 156 H GLY 24 H GLY 24 -2.754 13.485 -19.624 157 HA2 GLY 24 1HA GLY 24 -4.842 12.571 -21.504 158 HA3 GLY 24 2HA GLY 24 -4.995 13.990 -20.479 159 H ALA 25 H ALA 25 -3.395 15.752 -20.882 160 HA ALA 25 HA ALA 25 -1.967 15.879 -23.326 161 HB1 ALA 25 1HB ALA 25 -3.366 16.883 -24.781 162 HB2 ALA 25 2HB ALA 25 -4.608 16.096 -23.807 163 HB3 ALA 25 3HB ALA 25 -4.203 17.788 -23.519 164 H GLU 26 H GLU 26 -0.412 17.340 -23.048 165 HA GLU 26 HA GLU 26 -0.353 19.010 -20.749 166 HB2 GLU 26 1HB GLU 26 1.703 18.098 -21.639 167 HB3 GLU 26 2HB GLU 26 1.437 18.901 -23.180 168 HG2 GLU 26 1HG GLU 26 1.631 21.080 -22.039 169 HG3 GLU 26 2HG GLU 26 2.002 20.230 -20.541 170 H ALA 27 H ALA 27 -0.832 21.115 -20.494 171 HA ALA 27 HA ALA 27 -2.577 22.448 -22.166 172 HB1 ALA 27 1HB ALA 27 -2.541 24.094 -20.627 173 HB2 ALA 27 2HB ALA 27 -1.610 22.920 -19.695 174 HB3 ALA 27 3HB ALA 27 -0.779 24.182 -20.605 175 H ARG 28 H ARG 28 -2.395 24.025 -23.735 176 HA ARG 28 HA ARG 28 0.287 24.315 -24.919 177 HB2 ARG 28 1HB ARG 28 -2.452 24.241 -26.173 178 HB3 ARG 28 2HB ARG 28 -1.051 24.866 -27.033 179 HG2 ARG 28 1HG ARG 28 -1.332 22.082 -25.919 180 HG3 ARG 28 2HG ARG 28 -1.500 22.544 -27.614 181 HD2 ARG 28 1HD ARG 28 0.970 23.566 -26.635 182 HD3 ARG 28 2HD ARG 28 0.856 21.864 -26.191 183 HE ARG 28 HE ARG 28 0.119 22.209 -28.894 184 HH11 ARG 28 1HH1 ARG 28 2.904 22.241 -26.804 185 HH12 ARG 28 2HH1 ARG 28 4.008 21.764 -28.052 186 HH21 ARG 28 1HH2 ARG 28 1.563 21.582 -30.545 187 HH22 ARG 28 2HH2 ARG 28 3.244 21.390 -30.179 188 H ALA 29 H ALA 29 0.974 26.333 -25.627 189 HA ALA 29 HA ALA 29 0.104 28.555 -24.124 190 HB1 ALA 29 1HB ALA 29 2.384 28.024 -25.342 191 HB2 ALA 29 2HB ALA 29 1.646 28.977 -26.630 192 HB3 ALA 29 3HB ALA 29 1.871 29.682 -25.029 193 H GLY 30 H GLY 30 -1.445 30.016 -24.478 194 HA2 GLY 30 1HA GLY 30 -2.909 31.386 -25.648 195 HA3 GLY 30 2HA GLY 30 -2.300 30.703 -27.148 196 H GLN 31 H GLN 31 -3.070 28.182 -25.149 197 HA GLN 31 HA GLN 31 -5.614 27.786 -26.543 198 HB2 GLN 31 1HB GLN 31 -3.639 26.077 -26.462 199 HB3 GLN 31 2HB GLN 31 -4.273 25.692 -24.868 200 HG2 GLN 31 1HG GLN 31 -6.282 24.888 -25.726 201 HG3 GLN 31 2HG GLN 31 -6.044 25.687 -27.279 202 HE21 GLN 31 2HE2 GLN 31 -3.887 24.950 -28.347 203 HE22 GLN 31 1HE2 GLN 31 -3.660 23.238 -28.409 204 H THR 32 H THR 32 -7.533 27.614 -25.516 205 HA THR 32 HA THR 32 -7.682 28.520 -22.790 206 HB THR 32 HB THR 32 -9.917 27.575 -24.595 207 HG1 THR 32 HG1 THR 32 -10.158 30.022 -24.655 208 HG21 THR 32 3HG2 THR 32 -11.280 27.918 -22.868 209 HG22 THR 32 1HG2 THR 32 -10.682 29.568 -22.699 210 HG23 THR 32 2HG2 THR 32 -9.882 28.248 -21.845 211 H VAL 33 H VAL 33 -7.892 27.326 -21.005 212 HA VAL 33 HA VAL 33 -8.915 24.598 -21.180 213 HB VAL 33 HB VAL 33 -7.084 23.610 -19.982 214 HG11 VAL 33 1HG1 VAL 33 -5.726 25.228 -22.107 215 HG12 VAL 33 2HG1 VAL 33 -5.497 23.530 -21.682 216 HG13 VAL 33 3HG1 VAL 33 -6.963 24.041 -22.520 217 HG21 VAL 33 3HG2 VAL 33 -6.476 26.338 -19.326 218 HG22 VAL 33 1HG2 VAL 33 -5.866 24.852 -18.600 219 HG23 VAL 33 2HG2 VAL 33 -5.053 25.546 -20.003 220 H SER 34 H SER 34 -9.443 23.682 -19.076 221 HA SER 34 HA SER 34 -9.967 25.772 -17.064 222 HB2 SER 34 1HB SER 34 -11.630 23.301 -17.606 223 HB3 SER 34 2HB SER 34 -12.003 24.585 -16.456 224 HG SER 34 HG SER 34 -13.141 24.872 -18.404 225 H VAL 35 H VAL 35 -9.306 25.425 -15.025 226 HA VAL 35 HA VAL 35 -8.580 22.727 -14.172 227 HB VAL 35 HB VAL 35 -6.390 23.282 -13.456 228 HG11 VAL 35 1HG1 VAL 35 -6.592 24.601 -16.151 229 HG12 VAL 35 2HG1 VAL 35 -5.262 23.643 -15.496 230 HG13 VAL 35 3HG1 VAL 35 -6.785 22.862 -15.927 231 HG21 VAL 35 3HG2 VAL 35 -5.441 25.562 -13.768 232 HG22 VAL 35 1HG2 VAL 35 -7.054 26.125 -14.208 233 HG23 VAL 35 2HG2 VAL 35 -6.751 25.493 -12.589 234 H HIS 36 H HIS 36 -7.909 22.764 -11.791 235 HA HIS 36 HA HIS 36 -9.667 24.649 -10.365 236 HB2 HIS 36 1HB HIS 36 -9.168 21.751 -10.084 237 HB3 HIS 36 2HB HIS 36 -9.274 22.647 -8.572 238 HD1 HIS 36 HD1 HIS 36 -11.538 24.445 -8.789 239 HD2 HIS 36 HD2 HIS 36 -11.591 20.747 -10.682 240 HE1 HIS 36 HE1 HIS 36 -13.967 23.919 -9.169 241 H TYR 37 H TYR 37 -8.829 25.937 -8.839 242 HA TYR 37 HA TYR 37 -6.014 25.502 -8.084 243 HB2 TYR 37 1HB TYR 37 -5.777 27.908 -7.869 244 HB3 TYR 37 2HB TYR 37 -6.393 27.522 -9.472 245 HD1 TYR 37 HD2 TYR 37 -7.341 28.817 -6.139 246 HD2 TYR 37 HD1 TYR 37 -8.491 28.346 -10.208 247 HE1 TYR 37 HE2 TYR 37 -9.225 30.356 -5.779 248 HE2 TYR 37 HE1 TYR 37 -10.378 29.885 -9.859 249 HH TYR 37 HH TYR 37 -10.658 31.981 -7.664 250 H THR 38 H THR 38 -5.436 25.627 -5.958 251 HA THR 38 HA THR 38 -7.529 26.259 -3.997 252 HB THR 38 HB THR 38 -5.809 24.107 -3.074 253 HG1 THR 38 HG1 THR 38 -6.925 22.527 -4.460 254 HG21 THR 38 3HG2 THR 38 -7.648 24.206 -1.769 255 HG22 THR 38 1HG2 THR 38 -8.350 23.160 -3.002 256 HG23 THR 38 2HG2 THR 38 -8.645 24.898 -3.049 257 H GLY 39 H GLY 39 -6.742 27.989 -2.970 258 HA2 GLY 39 1HA GLY 39 -3.899 28.365 -2.605 259 HA3 GLY 39 2HA GLY 39 -5.173 29.463 -2.095 260 H TRP 40 H TRP 40 -2.723 27.840 -0.888 261 HA TRP 40 HA TRP 40 -4.097 27.348 1.664 262 HB2 TRP 40 1HB TRP 40 -2.190 25.546 0.204 263 HB3 TRP 40 2HB TRP 40 -2.292 25.492 1.962 264 HD1 TRP 40 HD1 TRP 40 -5.420 25.743 2.329 265 HE1 TRP 40 HE1 TRP 40 -6.953 23.799 1.626 266 HE3 TRP 40 HE3 TRP 40 -2.292 23.391 -0.961 267 HZ2 TRP 40 HZ2 TRP 40 -6.850 21.564 -0.096 268 HZ3 TRP 40 HZ3 TRP 40 -3.086 21.356 -2.093 269 HH2 TRP 40 HH2 TRP 40 -5.318 20.463 -1.668 270 H LEU 41 H LEU 41 -3.118 28.183 3.422 271 HA LEU 41 HA LEU 41 -0.869 29.927 3.026 272 HB2 LEU 41 1HB LEU 41 -2.839 29.395 5.139 273 HB3 LEU 41 2HB LEU 41 -1.249 29.893 5.714 274 HG LEU 41 HG LEU 41 -3.014 31.446 3.822 275 HD11 LEU 41 1HD1 LEU 41 -4.005 32.211 5.651 276 HD12 LEU 41 2HD1 LEU 41 -2.458 32.887 6.160 277 HD13 LEU 41 3HD1 LEU 41 -2.928 31.270 6.683 278 HD21 LEU 41 3HD2 LEU 41 -0.288 32.012 4.969 279 HD22 LEU 41 1HD2 LEU 41 -1.323 33.250 4.255 280 HD23 LEU 41 2HD2 LEU 41 -0.748 31.904 3.269 281 H THR 42 H THR 42 0.943 29.903 4.687 282 HA THR 42 HA THR 42 2.496 27.625 4.381 283 HB THR 42 HB THR 42 3.998 28.544 6.059 284 HG1 THR 42 HG1 THR 42 3.313 30.420 7.242 285 HG21 THR 42 3HG2 THR 42 2.724 30.488 4.157 286 HG22 THR 42 1HG2 THR 42 4.266 29.647 4.012 287 HG23 THR 42 2HG2 THR 42 4.085 30.961 5.173 288 H ASP 43 H ASP 43 0.435 28.587 7.095 289 HA ASP 43 HA ASP 43 1.124 26.296 8.680 290 HB2 ASP 43 1HB ASP 43 -0.949 28.466 8.927 291 HB3 ASP 43 2HB ASP 43 -0.923 27.092 10.029 292 H GLY 44 H GLY 44 -1.101 26.946 6.152 293 HA2 GLY 44 1HA GLY 44 -2.026 24.925 5.081 294 HA3 GLY 44 2HA GLY 44 -2.440 24.368 6.696 295 H GLN 45 H GLN 45 -2.960 27.634 6.601 296 HA GLN 45 HA GLN 45 -5.783 27.346 6.721 297 HB2 GLN 45 1HB GLN 45 -4.057 29.206 7.642 298 HB3 GLN 45 2HB GLN 45 -4.656 30.035 6.212 299 HG2 GLN 45 1HG GLN 45 -5.913 30.607 8.238 300 HG3 GLN 45 2HG GLN 45 -6.922 29.861 7.001 301 HE21 GLN 45 2HE2 GLN 45 -8.216 28.299 7.642 302 HE22 GLN 45 1HE2 GLN 45 -8.042 27.359 9.081 303 H LYS 46 H LYS 46 -7.013 26.941 5.012 304 HA LYS 46 HA LYS 46 -6.213 27.551 2.339 305 HB2 LYS 46 1HB LYS 46 -7.561 25.586 2.781 306 HB3 LYS 46 2HB LYS 46 -8.842 26.576 3.468 307 HG2 LYS 46 1HG LYS 46 -9.066 27.667 1.217 308 HG3 LYS 46 2HG LYS 46 -7.967 26.433 0.595 309 HD2 LYS 46 1HD LYS 46 -10.391 25.621 2.145 310 HD3 LYS 46 2HD LYS 46 -10.548 26.078 0.448 311 HE2 LYS 46 1HE LYS 46 -8.719 24.409 -0.041 312 HE3 LYS 46 2HE LYS 46 -8.895 23.852 1.622 313 HZ1 LYS 46 3HZ LYS 46 -11.185 23.965 -0.249 314 HZ2 LYS 46 1HZ LYS 46 -11.068 23.121 1.213 315 HZ3 LYS 46 2HZ LYS 46 -10.184 22.605 -0.134 316 H PHE 47 H PHE 47 -6.757 29.225 1.056 317 HA PHE 47 HA PHE 47 -8.760 31.140 2.031 318 HB2 PHE 47 1HB PHE 47 -7.272 32.997 1.262 319 HB3 PHE 47 2HB PHE 47 -6.634 32.101 2.637 320 HD1 PHE 47 HD2 PHE 47 -6.310 32.663 -0.987 321 HD2 PHE 47 HD1 PHE 47 -4.601 30.889 2.485 322 HE1 PHE 47 HE2 PHE 47 -4.220 32.264 -2.223 323 HE2 PHE 47 HE1 PHE 47 -2.509 30.488 1.254 324 HZ PHE 47 HZ PHE 47 -2.317 31.175 -1.103 325 H ASP 48 H ASP 48 -8.598 29.014 -0.105 326 HA ASP 48 HA ASP 48 -10.134 30.284 -2.060 327 HB2 ASP 48 1HB ASP 48 -7.271 30.541 -2.445 328 HB3 ASP 48 2HB ASP 48 -8.020 29.672 -3.782 329 H SER 49 H SER 49 -11.364 28.715 -2.844 330 HA SER 49 HA SER 49 -10.218 26.180 -3.651 331 HB2 SER 49 1HB SER 49 -10.615 25.347 -1.548 332 HB3 SER 49 2HB SER 49 -11.913 26.495 -1.222 333 HG SER 49 HG SER 49 -11.996 24.073 -2.653 334 H SER 50 H SER 50 -10.925 26.518 -5.715 335 HA SER 50 HA SER 50 -13.533 27.444 -6.364 336 HB2 SER 50 1HB SER 50 -12.582 26.073 -8.601 337 HB3 SER 50 2HB SER 50 -12.397 27.795 -8.270 338 HG SER 50 HG SER 50 -10.388 27.450 -7.508 339 H LYS 51 H LYS 51 -12.227 24.361 -5.580 340 HA LYS 51 HA LYS 51 -14.148 22.735 -6.894 341 HB2 LYS 51 1HB LYS 51 -12.462 22.149 -4.453 342 HB3 LYS 51 2HB LYS 51 -13.350 20.952 -5.385 343 HG2 LYS 51 1HG LYS 51 -11.525 22.598 -6.974 344 HG3 LYS 51 2HG LYS 51 -10.736 21.598 -5.752 345 HD2 LYS 51 1HD LYS 51 -12.755 20.532 -7.719 346 HD3 LYS 51 2HD LYS 51 -11.014 20.525 -8.012 347 HE2 LYS 51 1HE LYS 51 -12.283 19.275 -5.585 348 HE3 LYS 51 2HE LYS 51 -11.992 18.390 -7.082 349 HZ1 LYS 51 3HZ LYS 51 -9.731 19.848 -5.964 350 HZ2 LYS 51 1HZ LYS 51 -9.776 18.340 -6.731 351 HZ3 LYS 51 2HZ LYS 51 -10.241 18.479 -5.110 352 H ASP 52 H ASP 52 -13.878 23.915 -3.551 353 HA ASP 52 HA ASP 52 -16.209 22.714 -2.566 354 HB2 ASP 52 1HB ASP 52 -14.553 23.644 -1.061 355 HB3 ASP 52 2HB ASP 52 -14.821 25.260 -1.708 356 H ARG 53 H ARG 53 -15.782 25.368 -4.685 357 HA ARG 53 HA ARG 53 -18.538 26.284 -4.246 358 HB2 ARG 53 1HB ARG 53 -16.513 27.888 -4.287 359 HB3 ARG 53 2HB ARG 53 -16.530 27.637 -6.027 360 HG2 ARG 53 1HG ARG 53 -19.076 28.272 -5.738 361 HG3 ARG 53 2HG ARG 53 -18.459 29.078 -4.295 362 HD2 ARG 53 1HD ARG 53 -17.541 29.504 -7.135 363 HD3 ARG 53 2HD ARG 53 -18.485 30.624 -6.155 364 HE ARG 53 HE ARG 53 -15.642 30.183 -6.039 365 HH11 ARG 53 1HH1 ARG 53 -18.448 31.330 -4.326 366 HH12 ARG 53 2HH1 ARG 53 -17.541 32.349 -3.259 367 HH21 ARG 53 1HH2 ARG 53 -14.437 31.522 -4.640 368 HH22 ARG 53 2HH2 ARG 53 -15.259 32.458 -3.438 369 H ASN 54 H ASN 54 -17.075 24.019 -5.997 370 HA ASN 54 HA ASN 54 -17.446 22.962 -7.982 371 HB2 ASN 54 1HB ASN 54 -19.821 23.222 -6.741 372 HB3 ASN 54 2HB ASN 54 -20.176 24.100 -8.226 373 HD21 ASN 54 2HD2 ASN 54 -20.356 21.178 -6.808 374 HD22 ASN 54 1HD2 ASN 54 -20.349 20.161 -8.205 375 H ASP 55 H ASP 55 -16.389 25.683 -8.099 376 HA ASP 55 HA ASP 55 -17.304 26.403 -10.807 377 HB2 ASP 55 1HB ASP 55 -17.904 28.087 -9.047 378 HB3 ASP 55 2HB ASP 55 -16.182 28.317 -8.753 379 HA PRO 56 HA PRO 56 -12.964 25.167 -11.365 380 HB2 PRO 56 1HB PRO 56 -13.254 24.593 -14.003 381 HB3 PRO 56 2HB PRO 56 -13.695 23.461 -12.719 382 HG2 PRO 56 1HG PRO 56 -15.445 25.297 -14.309 383 HG3 PRO 56 2HG PRO 56 -15.725 23.609 -13.845 384 HD2 PRO 56 1HD PRO 56 -16.858 25.688 -12.532 385 HD3 PRO 56 2HD PRO 56 -16.409 24.176 -11.718 386 H PHE 57 H PHE 57 -11.270 26.348 -12.109 387 HA PHE 57 HA PHE 57 -11.809 29.002 -13.082 388 HB2 PHE 57 1HB PHE 57 -10.036 28.629 -11.437 389 HB3 PHE 57 2HB PHE 57 -9.187 27.581 -12.569 390 HD1 PHE 57 HD2 PHE 57 -10.841 30.845 -13.201 391 HD2 PHE 57 HD1 PHE 57 -7.184 28.680 -12.972 392 HE1 PHE 57 HE2 PHE 57 -9.635 32.795 -14.095 393 HE2 PHE 57 HE1 PHE 57 -5.972 30.626 -13.865 394 HZ PHE 57 HZ PHE 57 -7.198 32.687 -14.429 395 H ALA 58 H ALA 58 -12.375 29.202 -15.158 396 HA ALA 58 HA ALA 58 -10.985 27.601 -17.184 397 HB1 ALA 58 1HB ALA 58 -12.818 28.656 -18.677 398 HB2 ALA 58 2HB ALA 58 -13.262 27.381 -17.542 399 HB3 ALA 58 3HB ALA 58 -13.592 29.067 -17.146 400 H PHE 59 H PHE 59 -9.154 28.551 -17.835 401 HA PHE 59 HA PHE 59 -9.323 31.306 -18.820 402 HB2 PHE 59 1HB PHE 59 -7.311 31.989 -17.758 403 HB3 PHE 59 2HB PHE 59 -8.280 31.219 -16.505 404 HD1 PHE 59 HD1 PHE 59 -7.801 28.703 -16.081 405 HD2 PHE 59 HD2 PHE 59 -5.117 31.349 -18.059 406 HE1 PHE 59 HE1 PHE 59 -5.933 27.187 -15.567 407 HE2 PHE 59 HE2 PHE 59 -3.245 29.836 -17.548 408 HZ PHE 59 HZ PHE 59 -3.651 27.752 -16.301 409 H VAL 60 H VAL 60 -6.945 31.750 -19.854 410 HA VAL 60 HA VAL 60 -6.419 29.451 -21.624 411 HB VAL 60 HB VAL 60 -7.418 30.984 -23.058 412 HG11 VAL 60 1HG1 VAL 60 -6.328 33.462 -22.913 413 HG12 VAL 60 2HG1 VAL 60 -7.814 32.978 -22.094 414 HG13 VAL 60 3HG1 VAL 60 -6.283 32.974 -21.219 415 HG21 VAL 60 3HG2 VAL 60 -5.713 31.704 -24.551 416 HG22 VAL 60 1HG2 VAL 60 -4.528 31.807 -23.249 417 HG23 VAL 60 2HG2 VAL 60 -5.124 30.233 -23.776 418 H LEU 61 H LEU 61 -4.326 28.908 -22.035 419 HA LEU 61 HA LEU 61 -2.336 29.485 -20.209 420 HB2 LEU 61 1HB LEU 61 -2.603 27.816 -22.364 421 HB3 LEU 61 2HB LEU 61 -1.331 28.913 -22.895 422 HG LEU 61 HG LEU 61 -0.189 27.110 -21.954 423 HD11 LEU 61 1HD1 LEU 61 0.903 27.996 -20.000 424 HD12 LEU 61 2HD1 LEU 61 -0.447 29.089 -19.696 425 HD13 LEU 61 3HD1 LEU 61 0.564 29.313 -21.123 426 HD21 LEU 61 3HD2 LEU 61 -2.145 26.043 -20.916 427 HD22 LEU 61 1HD2 LEU 61 -2.071 27.214 -19.599 428 HD23 LEU 61 2HD2 LEU 61 -0.750 26.069 -19.836 429 H GLY 62 H GLY 62 -0.999 31.144 -19.881 430 HA2 GLY 62 1HA GLY 62 0.080 33.149 -20.170 431 HA3 GLY 62 2HA GLY 62 0.212 32.702 -21.864 432 H GLY 63 H GLY 63 -2.972 32.866 -20.605 433 HA2 GLY 63 1HA GLY 63 -3.483 35.215 -22.260 434 HA3 GLY 63 2HA GLY 63 -4.694 34.151 -21.561 435 H GLY 64 H GLY 64 -2.042 35.596 -19.761 436 HA2 GLY 64 1HA GLY 64 -2.024 37.096 -18.023 437 HA3 GLY 64 2HA GLY 64 -3.401 37.863 -18.799 438 H MET 65 H MET 65 -3.802 38.183 -16.377 439 HA MET 65 HA MET 65 -5.153 37.787 -14.592 440 HB2 MET 65 1HB MET 65 -6.365 36.302 -16.787 441 HB3 MET 65 2HB MET 65 -6.715 35.582 -15.221 442 HG2 MET 65 1HG MET 65 -8.454 37.029 -15.373 443 HG3 MET 65 2HG MET 65 -7.275 38.070 -14.580 444 HE1 MET 65 3HE MET 65 -9.501 37.267 -17.171 445 HE2 MET 65 1HE MET 65 -9.695 38.787 -18.045 446 HE3 MET 65 2HE MET 65 -8.613 37.542 -18.671 447 H VAL 66 H VAL 66 -2.644 36.107 -15.267 448 HA VAL 66 HA VAL 66 -2.991 34.251 -13.022 449 HB VAL 66 HB VAL 66 -1.863 32.457 -14.136 450 HG11 VAL 66 1HG1 VAL 66 -3.709 33.207 -16.320 451 HG12 VAL 66 2HG1 VAL 66 -3.626 31.729 -15.359 452 HG13 VAL 66 3HG1 VAL 66 -4.382 33.176 -14.691 453 HG21 VAL 66 3HG2 VAL 66 -1.526 34.390 -16.423 454 HG22 VAL 66 1HG2 VAL 66 -0.260 33.631 -15.458 455 HG23 VAL 66 2HG2 VAL 66 -1.239 32.655 -16.553 456 H ILE 67 H ILE 67 -0.789 33.352 -12.337 457 HA ILE 67 HA ILE 67 1.130 35.580 -12.343 458 HB ILE 67 HB ILE 67 1.947 34.827 -10.248 459 HG12 ILE 67 1HG1 ILE 67 0.259 32.355 -10.685 460 HG13 ILE 67 2HG1 ILE 67 2.017 32.438 -10.660 461 HG21 ILE 67 1HG2 ILE 67 -0.773 34.244 -9.471 462 HG22 ILE 67 2HG2 ILE 67 0.219 35.658 -9.122 463 HG23 ILE 67 3HG2 ILE 67 -0.704 35.578 -10.623 464 HD11 ILE 67 3HD1 ILE 67 0.115 32.782 -8.365 465 HD12 ILE 67 1HD1 ILE 67 1.351 31.544 -8.587 466 HD13 ILE 67 2HD1 ILE 67 1.822 33.215 -8.273 467 H LYS 68 H LYS 68 3.454 34.909 -12.094 468 HA LYS 68 HA LYS 68 4.377 33.548 -14.286 469 HB2 LYS 68 1HB LYS 68 5.654 33.996 -11.592 470 HB3 LYS 68 2HB LYS 68 6.518 33.238 -12.923 471 HG2 LYS 68 1HG LYS 68 5.946 35.306 -14.278 472 HG3 LYS 68 2HG LYS 68 5.460 36.041 -12.748 473 HD2 LYS 68 1HD LYS 68 7.642 36.713 -12.817 474 HD3 LYS 68 2HD LYS 68 7.839 35.167 -11.988 475 HE2 LYS 68 1HE LYS 68 9.484 35.162 -13.658 476 HE3 LYS 68 2HE LYS 68 8.185 34.161 -14.306 477 HZ1 LYS 68 3HZ LYS 68 8.104 37.004 -14.948 478 HZ2 LYS 68 1HZ LYS 68 7.696 35.666 -15.900 479 HZ3 LYS 68 2HZ LYS 68 9.319 36.093 -15.693 480 H GLY 69 H GLY 69 4.197 32.227 -10.972 481 HA2 GLY 69 1HA GLY 69 5.015 29.636 -11.547 482 HA3 GLY 69 2HA GLY 69 3.944 30.072 -10.224 483 H TRP 70 H TRP 70 1.921 31.149 -12.103 484 HA TRP 70 HA TRP 70 0.420 28.764 -12.436 485 HB2 TRP 70 1HB TRP 70 -0.070 31.566 -12.531 486 HB3 TRP 70 2HB TRP 70 -0.674 30.866 -14.031 487 HD1 TRP 70 HD1 TRP 70 -3.041 29.897 -13.910 488 HE1 TRP 70 HE1 TRP 70 -4.645 29.184 -12.028 489 HE3 TRP 70 HE3 TRP 70 0.085 30.495 -9.910 490 HZ2 TRP 70 HZ2 TRP 70 -4.592 28.911 -9.219 491 HZ3 TRP 70 HZ3 TRP 70 -0.769 29.987 -7.659 492 HH2 TRP 70 HH2 TRP 70 -3.060 29.212 -7.323 493 H ASP 71 H ASP 71 1.616 31.085 -14.872 494 HA ASP 71 HA ASP 71 0.994 29.603 -17.130 495 HB2 ASP 71 1HB ASP 71 1.661 31.879 -17.394 496 HB3 ASP 71 2HB ASP 71 3.216 31.582 -16.621 497 H GLU 72 H GLU 72 3.999 29.599 -15.234 498 HA GLU 72 HA GLU 72 5.408 27.766 -16.821 499 HB2 GLU 72 1HB GLU 72 5.862 29.181 -14.437 500 HB3 GLU 72 2HB GLU 72 6.071 27.485 -14.025 501 HG2 GLU 72 1HG GLU 72 7.481 27.579 -16.308 502 HG3 GLU 72 2HG GLU 72 7.699 29.235 -15.743 503 H GLY 73 H GLY 73 3.252 27.283 -14.054 504 HA2 GLY 73 1HA GLY 73 3.658 24.514 -13.756 505 HA3 GLY 73 2HA GLY 73 2.234 25.399 -13.229 506 H VAL 74 H VAL 74 0.798 26.092 -15.190 507 HA VAL 74 HA VAL 74 -0.290 23.780 -16.303 508 HB VAL 74 HB VAL 74 -1.445 25.394 -17.911 509 HG11 VAL 74 1HG1 VAL 74 -3.050 25.595 -16.363 510 HG12 VAL 74 2HG1 VAL 74 -1.938 24.730 -15.302 511 HG13 VAL 74 3HG1 VAL 74 -2.005 26.492 -15.262 512 HG21 VAL 74 3HG2 VAL 74 -0.763 27.689 -16.258 513 HG22 VAL 74 1HG2 VAL 74 0.612 27.074 -17.175 514 HG23 VAL 74 2HG2 VAL 74 -0.865 27.550 -18.013 515 H GLN 75 H GLN 75 2.272 25.835 -17.429 516 HA GLN 75 HA GLN 75 2.290 25.279 -20.147 517 HB2 GLN 75 1HB GLN 75 4.230 26.221 -18.162 518 HB3 GLN 75 2HB GLN 75 4.964 25.381 -19.521 519 HG2 GLN 75 1HG GLN 75 3.924 26.900 -21.077 520 HG3 GLN 75 2HG GLN 75 3.057 27.696 -19.764 521 HE21 GLN 75 2HE2 GLN 75 4.374 29.379 -21.193 522 HE22 GLN 75 1HE2 GLN 75 5.866 29.870 -20.473 523 H GLY 76 H GLY 76 3.016 23.224 -17.480 524 HA2 GLY 76 1HA GLY 76 4.012 21.172 -19.361 525 HA3 GLY 76 2HA GLY 76 4.570 21.301 -17.699 526 H MET 77 H MET 77 1.837 21.903 -16.729 527 HA MET 77 HA MET 77 1.050 19.360 -15.959 528 HB2 MET 77 1HB MET 77 -0.650 21.849 -16.194 529 HB3 MET 77 2HB MET 77 -1.094 20.406 -15.294 530 HG2 MET 77 1HG MET 77 1.506 21.606 -14.608 531 HG3 MET 77 2HG MET 77 0.078 22.554 -14.199 532 HE1 MET 77 3HE MET 77 -1.551 21.013 -11.387 533 HE2 MET 77 1HE MET 77 -1.655 22.036 -12.820 534 HE3 MET 77 2HE MET 77 -2.181 20.355 -12.898 535 H LYS 78 H LYS 78 -0.683 18.009 -16.570 536 HA LYS 78 HA LYS 78 -1.613 18.401 -19.340 537 HB2 LYS 78 1HB LYS 78 -0.851 15.840 -17.930 538 HB3 LYS 78 2HB LYS 78 -1.676 15.892 -19.482 539 HG2 LYS 78 1HG LYS 78 0.184 16.514 -20.608 540 HG3 LYS 78 2HG LYS 78 0.822 17.455 -19.257 541 HD2 LYS 78 1HD LYS 78 0.669 14.503 -18.948 542 HD3 LYS 78 2HD LYS 78 1.914 15.158 -20.014 543 HE2 LYS 78 1HE LYS 78 3.054 15.160 -18.034 544 HE3 LYS 78 2HE LYS 78 2.331 16.766 -17.966 545 HZ1 LYS 78 3HZ LYS 78 2.052 14.710 -16.129 546 HZ2 LYS 78 1HZ LYS 78 0.547 14.865 -16.885 547 HZ3 LYS 78 2HZ LYS 78 1.256 16.203 -16.131 548 H VAL 79 H VAL 79 -3.672 17.326 -19.851 549 HA VAL 79 HA VAL 79 -5.733 18.078 -18.162 550 HB VAL 79 HB VAL 79 -5.874 15.830 -20.174 551 HG11 VAL 79 1HG1 VAL 79 -7.905 17.522 -18.777 552 HG12 VAL 79 2HG1 VAL 79 -8.249 16.861 -20.376 553 HG13 VAL 79 3HG1 VAL 79 -7.885 15.778 -19.032 554 HG21 VAL 79 3HG2 VAL 79 -6.868 18.257 -21.235 555 HG22 VAL 79 1HG2 VAL 79 -5.268 18.586 -20.570 556 HG23 VAL 79 2HG2 VAL 79 -5.478 17.317 -21.777 557 H GLY 80 H GLY 80 -6.497 17.289 -16.316 558 HA2 GLY 80 1HA GLY 80 -7.244 15.681 -14.803 559 HA3 GLY 80 2HA GLY 80 -6.552 14.432 -15.828 560 H GLY 81 H GLY 81 -4.196 16.691 -15.463 561 HA2 GLY 81 1HA GLY 81 -2.807 15.038 -13.519 562 HA3 GLY 81 2HA GLY 81 -2.115 16.352 -14.458 563 H VAL 82 H VAL 82 -2.451 15.509 -11.447 564 HA VAL 82 HA VAL 82 -3.189 18.204 -10.505 565 HB VAL 82 HB VAL 82 -3.318 15.662 -8.882 566 HG11 VAL 82 1HG1 VAL 82 -3.254 18.308 -8.085 567 HG12 VAL 82 2HG1 VAL 82 -4.972 17.904 -8.065 568 HG13 VAL 82 3HG1 VAL 82 -3.828 16.942 -7.128 569 HG21 VAL 82 3HG2 VAL 82 -5.899 16.420 -9.191 570 HG22 VAL 82 1HG2 VAL 82 -5.235 16.857 -10.765 571 HG23 VAL 82 2HG2 VAL 82 -5.100 15.198 -10.181 572 H ARG 83 H ARG 83 -1.623 19.359 -9.596 573 HA ARG 83 HA ARG 83 0.544 18.032 -8.172 574 HB2 ARG 83 1HB ARG 83 1.133 20.037 -10.352 575 HB3 ARG 83 2HB ARG 83 2.297 19.132 -9.394 576 HG2 ARG 83 1HG ARG 83 1.298 17.040 -10.419 577 HG3 ARG 83 2HG ARG 83 0.475 18.117 -11.550 578 HD2 ARG 83 1HD ARG 83 2.582 18.979 -12.335 579 HD3 ARG 83 2HD ARG 83 3.456 18.060 -11.111 580 HE ARG 83 HE ARG 83 1.922 16.331 -12.743 581 HH11 ARG 83 1HH1 ARG 83 4.812 18.271 -12.758 582 HH12 ARG 83 2HH1 ARG 83 5.621 17.290 -13.935 583 HH21 ARG 83 1HH2 ARG 83 2.977 15.031 -14.292 584 HH22 ARG 83 2HH2 ARG 83 4.576 15.447 -14.807 585 H ARG 84 H ARG 84 1.415 19.249 -6.541 586 HA ARG 84 HA ARG 84 -0.046 21.654 -5.838 587 HB2 ARG 84 1HB ARG 84 0.958 19.581 -4.357 588 HB3 ARG 84 2HB ARG 84 2.172 20.827 -4.098 589 HG2 ARG 84 1HG ARG 84 0.279 22.371 -3.469 590 HG3 ARG 84 2HG ARG 84 -0.763 20.946 -3.470 591 HD2 ARG 84 1HD ARG 84 1.077 19.958 -1.904 592 HD3 ARG 84 2HD ARG 84 1.494 21.651 -1.643 593 HE ARG 84 HE ARG 84 -1.193 21.566 -1.236 594 HH11 ARG 84 1HH1 ARG 84 1.523 19.822 0.068 595 HH12 ARG 84 2HH1 ARG 84 0.780 19.558 1.610 596 HH21 ARG 84 1HH2 ARG 84 -2.183 21.226 0.790 597 HH22 ARG 84 2HH2 ARG 84 -1.329 20.356 2.020 598 H LEU 85 H LEU 85 0.628 23.426 -6.899 599 HA LEU 85 HA LEU 85 3.446 23.869 -7.420 600 HB2 LEU 85 1HB LEU 85 1.729 24.410 -9.105 601 HB3 LEU 85 2HB LEU 85 1.063 25.620 -8.009 602 HG LEU 85 HG LEU 85 3.658 26.432 -8.207 603 HD11 LEU 85 1HD1 LEU 85 4.661 25.723 -10.051 604 HD12 LEU 85 2HD1 LEU 85 3.275 26.189 -11.036 605 HD13 LEU 85 3HD1 LEU 85 3.333 24.589 -10.298 606 HD21 LEU 85 3HD2 LEU 85 2.759 28.301 -9.132 607 HD22 LEU 85 1HD2 LEU 85 1.263 27.521 -8.616 608 HD23 LEU 85 2HD2 LEU 85 1.789 27.397 -10.296 609 H THR 86 H THR 86 4.747 24.876 -6.053 610 HA THR 86 HA THR 86 3.574 26.522 -3.925 611 HB THR 86 HB THR 86 6.439 26.032 -3.709 612 HG1 THR 86 HG1 THR 86 6.147 23.763 -3.253 613 HG21 THR 86 3HG2 THR 86 4.574 26.732 -1.985 614 HG22 THR 86 1HG2 THR 86 5.950 25.753 -1.480 615 HG23 THR 86 2HG2 THR 86 4.395 24.987 -1.806 616 H ILE 87 H ILE 87 3.629 28.650 -4.162 617 HA ILE 87 HA ILE 87 5.759 29.830 -5.820 618 HB ILE 87 HB ILE 87 3.124 31.139 -5.176 619 HG12 ILE 87 1HG1 ILE 87 2.807 30.467 -7.746 620 HG13 ILE 87 2HG1 ILE 87 3.825 29.120 -7.248 621 HG21 ILE 87 1HG2 ILE 87 5.027 31.659 -7.449 622 HG22 ILE 87 2HG2 ILE 87 3.658 32.644 -6.935 623 HG23 ILE 87 3HG2 ILE 87 5.089 32.521 -5.912 624 HD11 ILE 87 3HD1 ILE 87 1.041 29.777 -6.503 625 HD12 ILE 87 1HD1 ILE 87 1.797 28.216 -6.823 626 HD13 ILE 87 2HD1 ILE 87 2.057 29.021 -5.275 627 HA PRO 88 HA PRO 88 7.259 31.715 -2.105 628 HB2 PRO 88 1HB PRO 88 8.990 33.444 -3.283 629 HB3 PRO 88 2HB PRO 88 9.316 31.714 -3.130 630 HG2 PRO 88 1HG PRO 88 8.289 33.246 -5.487 631 HG3 PRO 88 2HG PRO 88 9.508 31.960 -5.434 632 HD2 PRO 88 1HD PRO 88 6.947 31.509 -6.186 633 HD3 PRO 88 2HD PRO 88 7.924 30.289 -5.345 634 HA PRO 89 HA PRO 89 5.193 35.547 -1.486 635 HB2 PRO 89 1HB PRO 89 6.983 37.003 -0.057 636 HB3 PRO 89 2HB PRO 89 6.113 35.621 0.618 637 HG2 PRO 89 1HG PRO 89 8.901 35.760 -0.464 638 HG3 PRO 89 2HG PRO 89 8.305 34.942 0.993 639 HD2 PRO 89 1HD PRO 89 8.807 33.621 -1.317 640 HD3 PRO 89 2HD PRO 89 7.525 33.126 -0.193 641 H GLN 90 H GLN 90 7.942 35.401 -3.419 642 HA GLN 90 HA GLN 90 7.891 38.247 -4.090 643 HB2 GLN 90 1HB GLN 90 9.848 37.583 -5.581 644 HB3 GLN 90 2HB GLN 90 10.103 37.469 -3.844 645 HG2 GLN 90 1HG GLN 90 9.895 35.110 -3.879 646 HG3 GLN 90 2HG GLN 90 9.306 35.122 -5.541 647 HE21 GLN 90 2HE2 GLN 90 10.955 36.476 -6.982 648 HE22 GLN 90 1HE2 GLN 90 12.585 35.917 -6.863 649 H LEU 91 H LEU 91 7.349 35.071 -5.536 650 HA LEU 91 HA LEU 91 6.494 36.298 -8.040 651 HB2 LEU 91 1HB LEU 91 6.588 33.378 -7.308 652 HB3 LEU 91 2HB LEU 91 6.404 34.063 -8.922 653 HG LEU 91 HG LEU 91 8.870 34.089 -7.189 654 HD11 LEU 91 1HD1 LEU 91 8.001 32.634 -9.639 655 HD12 LEU 91 2HD1 LEU 91 8.872 32.043 -8.224 656 HD13 LEU 91 3HD1 LEU 91 9.708 33.025 -9.427 657 HD21 LEU 91 3HD2 LEU 91 8.947 36.189 -8.193 658 HD22 LEU 91 1HD2 LEU 91 8.197 35.612 -9.681 659 HD23 LEU 91 2HD2 LEU 91 9.861 35.167 -9.303 660 H GLY 92 H GLY 92 5.001 36.423 -5.400 661 HA2 GLY 92 1HA GLY 92 2.445 35.338 -6.414 662 HA3 GLY 92 2HA GLY 92 2.861 35.347 -4.706 663 H TYR 93 H TYR 93 2.259 37.042 -3.508 664 HA TYR 93 HA TYR 93 0.784 39.172 -4.800 665 HB2 TYR 93 1HB TYR 93 1.292 38.539 -1.888 666 HB3 TYR 93 2HB TYR 93 0.303 39.885 -2.445 667 HD1 TYR 93 HD2 TYR 93 -1.614 39.190 -4.146 668 HD2 TYR 93 HD1 TYR 93 0.235 36.554 -1.365 669 HE1 TYR 93 HE2 TYR 93 -3.574 37.710 -4.255 670 HE2 TYR 93 HE1 TYR 93 -1.720 35.066 -1.467 671 HH TYR 93 HH TYR 93 -4.100 35.189 -2.040 672 H GLY 94 H GLY 94 3.865 38.706 -3.235 673 HA2 GLY 94 1HA GLY 94 5.742 40.071 -3.417 674 HA3 GLY 94 2HA GLY 94 4.741 41.304 -4.167 675 H ALA 95 H ALA 95 5.821 42.860 -2.841 676 HA ALA 95 HA ALA 95 5.920 42.821 -0.054 677 HB1 ALA 95 1HB ALA 95 5.505 45.484 -1.160 678 HB2 ALA 95 2HB ALA 95 6.886 44.821 -0.286 679 HB3 ALA 95 3HB ALA 95 6.732 44.556 -2.022 680 H ARG 96 H ARG 96 3.289 43.494 -2.211 681 HA ARG 96 HA ARG 96 1.632 44.968 -0.481 682 HB2 ARG 96 1HB ARG 96 1.403 44.493 -3.024 683 HB3 ARG 96 2HB ARG 96 0.549 43.043 -2.514 684 HG2 ARG 96 1HG ARG 96 -1.139 44.597 -2.887 685 HG3 ARG 96 2HG ARG 96 -0.921 44.618 -1.136 686 HD2 ARG 96 1HD ARG 96 0.251 46.658 -1.202 687 HD3 ARG 96 2HD ARG 96 0.502 46.548 -2.944 688 HE ARG 96 HE ARG 96 -2.196 46.645 -2.697 689 HH11 ARG 96 1HH1 ARG 96 0.408 48.633 -1.517 690 HH12 ARG 96 2HH1 ARG 96 -0.529 50.090 -1.523 691 HH21 ARG 96 1HH2 ARG 96 -3.439 48.557 -2.709 692 HH22 ARG 96 2HH2 ARG 96 -2.717 50.046 -2.200 693 H GLY 97 H GLY 97 1.247 41.535 -1.395 694 HA2 GLY 97 1HA GLY 97 0.594 39.716 -0.148 695 HA3 GLY 97 2HA GLY 97 0.974 40.647 1.293 696 H ALA 98 H ALA 98 -1.302 38.845 0.642 697 HA ALA 98 HA ALA 98 -3.658 40.320 0.239 698 HB1 ALA 98 1HB ALA 98 -4.795 38.376 0.673 699 HB2 ALA 98 2HB ALA 98 -3.203 37.739 0.258 700 HB3 ALA 98 3HB ALA 98 -3.683 37.880 1.949 701 H GLY 99 H GLY 99 -5.339 40.830 1.790 702 HA2 GLY 99 1HA GLY 99 -4.306 42.238 4.050 703 HA3 GLY 99 2HA GLY 99 -6.000 42.068 3.617 704 H GLY 100 H GLY 100 -4.115 41.640 6.113 705 HA2 GLY 100 1HA GLY 100 -4.478 40.473 8.076 706 HA3 GLY 100 2HA GLY 100 -5.798 39.625 7.283 707 H VAL 101 H VAL 101 -4.970 38.068 5.489 708 HA VAL 101 HA VAL 101 -3.008 36.337 6.779 709 HB VAL 101 HB VAL 101 -3.743 34.631 5.154 710 HG11 VAL 101 1HG1 VAL 101 -4.912 35.156 7.383 711 HG12 VAL 101 2HG1 VAL 101 -6.200 35.833 6.383 712 HG13 VAL 101 3HG1 VAL 101 -5.755 34.134 6.220 713 HG21 VAL 101 3HG2 VAL 101 -4.492 36.684 3.570 714 HG22 VAL 101 1HG2 VAL 101 -5.090 35.035 3.390 715 HG23 VAL 101 2HG2 VAL 101 -6.051 36.231 4.259 716 H ILE 102 H ILE 102 -1.692 34.991 5.063 717 HA ILE 102 HA ILE 102 0.022 34.945 3.566 718 HB ILE 102 HB ILE 102 -1.248 37.349 2.262 719 HG12 ILE 102 1HG1 ILE 102 -2.906 35.541 2.573 720 HG13 ILE 102 2HG1 ILE 102 -2.513 35.792 0.876 721 HG21 ILE 102 1HG2 ILE 102 0.449 37.169 0.844 722 HG22 ILE 102 2HG2 ILE 102 1.045 35.737 1.682 723 HG23 ILE 102 3HG2 ILE 102 -0.144 35.571 0.390 724 HD11 ILE 102 3HD1 ILE 102 -0.764 33.821 1.977 725 HD12 ILE 102 1HD1 ILE 102 -2.439 33.400 2.334 726 HD13 ILE 102 2HD1 ILE 102 -1.934 33.672 0.666 727 HA PRO 103 HA PRO 103 2.060 38.376 5.942 728 HB2 PRO 103 1HB PRO 103 3.956 36.787 7.061 729 HB3 PRO 103 2HB PRO 103 2.358 37.027 7.778 730 HG2 PRO 103 1HG PRO 103 3.364 34.755 6.108 731 HG3 PRO 103 2HG PRO 103 2.368 34.710 7.574 732 HD2 PRO 103 1HD PRO 103 1.320 34.435 5.093 733 HD3 PRO 103 2HD PRO 103 0.431 35.201 6.426 734 HA PRO 104 HA PRO 104 5.400 39.011 3.154 735 HB2 PRO 104 1HB PRO 104 7.306 40.114 4.741 736 HB3 PRO 104 2HB PRO 104 5.839 40.975 4.262 737 HG2 PRO 104 1HG PRO 104 6.447 39.548 6.822 738 HG3 PRO 104 2HG PRO 104 5.654 41.114 6.575 739 HD2 PRO 104 1HD PRO 104 4.269 38.845 7.090 740 HD3 PRO 104 2HD PRO 104 3.622 40.148 6.072 741 H ASN 105 H ASN 105 7.339 38.157 2.399 742 HA ASN 105 HA ASN 105 8.874 36.501 2.089 743 HB2 ASN 105 1HB ASN 105 9.345 36.771 5.063 744 HB3 ASN 105 2HB ASN 105 10.493 36.225 3.845 745 HD21 ASN 105 2HD2 ASN 105 10.574 38.453 5.790 746 HD22 ASN 105 1HD2 ASN 105 10.900 39.865 4.849 747 H ALA 106 H ALA 106 6.215 35.609 2.561 748 HA ALA 106 HA ALA 106 6.686 33.084 4.006 749 HB1 ALA 106 1HB ALA 106 3.934 34.022 3.353 750 HB2 ALA 106 2HB ALA 106 4.503 33.045 4.707 751 HB3 ALA 106 3HB ALA 106 4.806 34.782 4.685 752 H THR 107 H THR 107 6.087 31.140 3.055 753 HA THR 107 HA THR 107 6.001 31.193 0.148 754 HB THR 107 HB THR 107 6.250 28.868 2.066 755 HG1 THR 107 HG1 THR 107 8.078 30.316 1.916 756 HG21 THR 107 3HG2 THR 107 7.171 27.955 -0.311 757 HG22 THR 107 1HG2 THR 107 5.868 29.013 -0.853 758 HG23 THR 107 2HG2 THR 107 5.527 27.698 0.273 759 H LEU 108 H LEU 108 4.204 30.952 -1.002 760 HA LEU 108 HA LEU 108 1.746 30.163 0.375 761 HB2 LEU 108 1HB LEU 108 2.075 31.306 -2.393 762 HB3 LEU 108 2HB LEU 108 0.569 31.121 -1.495 763 HG LEU 108 HG LEU 108 1.825 32.723 0.208 764 HD11 LEU 108 1HD1 LEU 108 3.731 33.560 -0.549 765 HD12 LEU 108 2HD1 LEU 108 2.837 34.329 -1.860 766 HD13 LEU 108 3HD1 LEU 108 3.533 32.725 -2.090 767 HD21 LEU 108 3HD2 LEU 108 0.314 33.411 -2.292 768 HD22 LEU 108 1HD2 LEU 108 0.818 34.651 -1.143 769 HD23 LEU 108 2HD2 LEU 108 -0.264 33.358 -0.625 770 H VAL 109 H VAL 109 0.799 28.256 0.053 771 HA VAL 109 HA VAL 109 1.897 26.498 -2.026 772 HB VAL 109 HB VAL 109 0.245 25.814 0.410 773 HG11 VAL 109 1HG1 VAL 109 1.459 23.510 -0.518 774 HG12 VAL 109 2HG1 VAL 109 -0.243 23.939 -0.695 775 HG13 VAL 109 3HG1 VAL 109 0.901 24.311 -1.986 776 HG21 VAL 109 3HG2 VAL 109 2.699 26.585 0.650 777 HG22 VAL 109 1HG2 VAL 109 2.196 25.096 1.451 778 HG23 VAL 109 2HG2 VAL 109 3.096 25.022 -0.064 779 H PHE 110 H PHE 110 0.781 26.475 -3.859 780 HA PHE 110 HA PHE 110 -2.160 26.603 -3.712 781 HB2 PHE 110 1HB PHE 110 -0.240 27.695 -5.757 782 HB3 PHE 110 2HB PHE 110 -1.934 27.416 -6.146 783 HD1 PHE 110 HD1 PHE 110 -3.677 28.776 -5.170 784 HD2 PHE 110 HD2 PHE 110 0.420 29.451 -4.236 785 HE1 PHE 110 HE1 PHE 110 -4.259 30.969 -4.217 786 HE2 PHE 110 HE2 PHE 110 -0.155 31.644 -3.280 787 HZ PHE 110 HZ PHE 110 -2.497 32.405 -3.269 788 H GLU 111 H GLU 111 -3.307 24.986 -4.596 789 HA GLU 111 HA GLU 111 -1.800 22.823 -5.890 790 HB2 GLU 111 1HB GLU 111 -3.025 22.175 -3.884 791 HB3 GLU 111 2HB GLU 111 -4.517 22.806 -4.566 792 HG2 GLU 111 1HG GLU 111 -4.183 21.126 -6.444 793 HG3 GLU 111 2HG GLU 111 -2.958 20.390 -5.412 794 H VAL 112 H VAL 112 -2.109 22.335 -7.967 795 HA VAL 112 HA VAL 112 -4.386 23.590 -9.359 796 HB VAL 112 HB VAL 112 -1.740 22.845 -10.605 797 HG11 VAL 112 1HG1 VAL 112 -3.955 24.620 -11.623 798 HG12 VAL 112 2HG1 VAL 112 -2.492 24.143 -12.487 799 HG13 VAL 112 3HG1 VAL 112 -3.720 22.938 -12.097 800 HG21 VAL 112 3HG2 VAL 112 -2.415 25.095 -8.947 801 HG22 VAL 112 1HG2 VAL 112 -0.866 24.662 -9.670 802 HG23 VAL 112 2HG2 VAL 112 -2.024 25.631 -10.581 803 H GLU 113 H GLU 113 -5.740 22.314 -10.468 804 HA GLU 113 HA GLU 113 -4.914 19.549 -11.035 805 HB2 GLU 113 1HB GLU 113 -6.280 19.320 -9.111 806 HB3 GLU 113 2HB GLU 113 -7.450 20.488 -9.709 807 HG2 GLU 113 1HG GLU 113 -8.431 18.987 -11.136 808 HG3 GLU 113 2HG GLU 113 -6.980 17.995 -11.263 809 H LEU 114 H LEU 114 -4.741 19.631 -13.201 810 HA LEU 114 HA LEU 114 -6.279 21.221 -14.924 811 HB2 LEU 114 1HB LEU 114 -4.375 19.000 -15.188 812 HB3 LEU 114 2HB LEU 114 -5.522 19.155 -16.517 813 HG LEU 114 HG LEU 114 -3.324 20.290 -16.878 814 HD11 LEU 114 1HD1 LEU 114 -5.992 21.412 -17.200 815 HD12 LEU 114 2HD1 LEU 114 -4.668 21.280 -18.357 816 HD13 LEU 114 3HD1 LEU 114 -4.716 22.629 -17.222 817 HD21 LEU 114 3HD2 LEU 114 -2.991 22.462 -15.743 818 HD22 LEU 114 1HD2 LEU 114 -2.891 21.086 -14.644 819 HD23 LEU 114 2HD2 LEU 114 -4.346 22.082 -14.678 820 H LEU 115 H LEU 115 -8.333 21.064 -15.506 821 HA LEU 115 HA LEU 115 -9.770 18.567 -15.018 822 HB2 LEU 115 1HB LEU 115 -10.713 21.356 -15.648 823 HB3 LEU 115 2HB LEU 115 -11.790 19.972 -15.483 824 HG LEU 115 HG LEU 115 -9.962 20.744 -13.239 825 HD11 LEU 115 1HD1 LEU 115 -11.176 22.511 -12.594 826 HD12 LEU 115 2HD1 LEU 115 -12.699 21.777 -13.096 827 HD13 LEU 115 3HD1 LEU 115 -11.674 22.581 -14.284 828 HD21 LEU 115 3HD2 LEU 115 -11.018 19.084 -12.215 829 HD22 LEU 115 1HD2 LEU 115 -11.932 18.763 -13.689 830 HD23 LEU 115 2HD2 LEU 115 -12.568 19.882 -12.484 831 H ASP 116 H ASP 116 -9.505 21.008 -17.604 832 HA ASP 116 HA ASP 116 -9.457 18.930 -19.610 833 HB2 ASP 116 1HB ASP 116 -11.921 19.460 -19.036 834 HB3 ASP 116 2HB ASP 116 -11.638 20.985 -19.871 835 H VAL 117 H VAL 117 -9.288 19.919 -21.847 836 HA VAL 117 HA VAL 117 -8.195 22.629 -21.843 837 HB VAL 117 HB VAL 117 -6.160 22.017 -22.965 838 HG11 VAL 117 1HG1 VAL 117 -6.599 20.309 -20.518 839 HG12 VAL 117 2HG1 VAL 117 -5.026 20.735 -21.195 840 HG13 VAL 117 3HG1 VAL 117 -6.077 21.993 -20.543 841 HG21 VAL 117 3HG2 VAL 117 -6.600 20.200 -24.317 842 HG22 VAL 117 1HG2 VAL 117 -5.646 19.460 -23.032 843 HG23 VAL 117 2HG2 VAL 117 -7.402 19.301 -23.029 844 H11 L2S 130 1H1 L2S 130 -4.875 31.489 -9.036 845 H21 L2S 130 2H1 L2S 130 -5.310 31.395 -10.810 846 H12 L2S 130 1H2 L2S 130 -5.000 33.762 -11.026 847 H22 L2S 130 2H2 L2S 130 -3.468 32.984 -10.397 848 H13 L2S 130 2H3 L2S 130 -4.050 33.706 -8.172 849 H23 L2S 130 1H3 L2S 130 -4.093 35.160 -9.275 850 H14 L2S 130 1H4 L2S 130 -6.558 32.748 -7.495 851 H24 L2S 130 2H4 L2S 130 -7.874 33.668 -8.360 852 H15 L2S 130 1H5 L2S 130 -7.320 31.428 -9.369 853 H25 L2S 130 2H5 L2S 130 -7.154 32.890 -10.458 854 H17 L2S 130 1H7 L2S 130 -8.292 36.198 -8.648 855 H27 L2S 130 2H7 L2S 130 -8.125 35.198 -7.108 856 H9 L2S 130 H9 L2S 130 -8.724 38.936 -4.450 857 H10 L2S 130 H10 L2S 130 -8.253 38.549 -2.030 858 H112 L2S 130 1H12 L2S 130 -6.162 34.847 -3.036 859 H113 L2S 130 1H13 L2S 130 -6.597 35.274 -5.447 860 H114 L2S 130 1H14 L2S 130 -6.620 37.392 -0.562 861 H214 L2S 130 2H14 L2S 130 -6.106 35.728 -0.932 862 H314 L2S 130 3H14 L2S 130 -7.839 36.071 -0.599 Start of MODEL 18 1 H1 GLY 1 H GLY 1 1.030 10.422 -5.145 2 HA2 GLY 1 1HA GLY 1 0.274 10.748 -2.663 3 HA3 GLY 1 2HA GLY 1 -1.160 9.924 -3.258 4 HA PRO 2 HA PRO 2 0.660 5.987 -2.656 5 HB2 PRO 2 1HB PRO 2 0.060 4.618 -4.922 6 HB3 PRO 2 2HB PRO 2 -1.152 5.045 -3.708 7 HG2 PRO 2 1HG PRO 2 -0.513 6.395 -6.303 8 HG3 PRO 2 2HG PRO 2 -2.096 6.035 -5.589 9 HD2 PRO 2 1HD PRO 2 -0.966 8.492 -5.463 10 HD3 PRO 2 2HD PRO 2 -2.014 7.857 -4.179 11 H GLY 3 H GLY 3 2.741 5.426 -2.649 12 HA2 GLY 3 1HA GLY 3 4.642 4.516 -3.813 13 HA3 GLY 3 2HA GLY 3 4.240 5.541 -5.182 14 H SER 4 H SER 4 6.677 5.868 -4.816 15 HA SER 4 HA SER 4 7.464 7.560 -2.650 16 HB2 SER 4 1HB SER 4 8.901 5.948 -4.148 17 HB3 SER 4 2HB SER 4 9.041 7.362 -5.192 18 HG SER 4 HG SER 4 9.545 7.620 -2.443 19 H MET 5 H MET 5 8.843 9.615 -3.463 20 HA MET 5 HA MET 5 7.787 11.149 -5.582 21 HB2 MET 5 1HB MET 5 6.518 12.816 -4.329 22 HB3 MET 5 2HB MET 5 5.793 11.223 -4.154 23 HG2 MET 5 1HG MET 5 7.739 12.102 -2.095 24 HG3 MET 5 2HG MET 5 6.140 12.842 -2.101 25 HE1 MET 5 3HE MET 5 6.745 10.380 0.734 26 HE2 MET 5 1HE MET 5 7.733 9.372 -0.325 27 HE3 MET 5 2HE MET 5 7.981 11.118 -0.286 28 H THR 6 H THR 6 8.407 13.559 -5.268 29 HA THR 6 HA THR 6 10.535 14.109 -3.425 30 HB THR 6 HB THR 6 11.720 12.734 -5.128 31 HG1 THR 6 HG1 THR 6 12.891 14.329 -4.018 32 HG21 THR 6 3HG2 THR 6 11.066 15.019 -6.991 33 HG22 THR 6 1HG2 THR 6 10.360 13.406 -7.076 34 HG23 THR 6 2HG2 THR 6 12.086 13.628 -7.358 35 H VAL 7 H VAL 7 11.606 16.277 -4.027 36 HA VAL 7 HA VAL 7 9.672 18.033 -5.382 37 HB VAL 7 HB VAL 7 11.087 18.746 -2.811 38 HG11 VAL 7 1HG1 VAL 7 9.249 20.562 -2.891 39 HG12 VAL 7 2HG1 VAL 7 10.673 20.746 -3.918 40 HG13 VAL 7 3HG1 VAL 7 9.157 20.166 -4.607 41 HG21 VAL 7 3HG2 VAL 7 9.420 16.993 -2.427 42 HG22 VAL 7 1HG2 VAL 7 8.915 18.529 -1.722 43 HG23 VAL 7 2HG2 VAL 7 8.199 17.976 -3.236 44 H VAL 8 H VAL 8 10.624 19.069 -6.994 45 HA VAL 8 HA VAL 8 13.498 19.692 -6.773 46 HB VAL 8 HB VAL 8 13.125 18.093 -8.546 47 HG11 VAL 8 1HG1 VAL 8 10.891 18.264 -9.153 48 HG12 VAL 8 2HG1 VAL 8 10.982 20.012 -9.377 49 HG13 VAL 8 3HG1 VAL 8 11.729 18.931 -10.554 50 HG21 VAL 8 3HG2 VAL 8 14.811 19.827 -8.917 51 HG22 VAL 8 1HG2 VAL 8 14.059 19.328 -10.432 52 HG23 VAL 8 2HG2 VAL 8 13.593 20.852 -9.677 53 H THR 9 H THR 9 14.215 21.719 -7.350 54 HA THR 9 HA THR 9 12.117 23.727 -7.863 55 HB THR 9 HB THR 9 14.667 24.080 -6.275 56 HG1 THR 9 HG1 THR 9 13.412 23.921 -4.536 57 HG21 THR 9 3HG2 THR 9 13.558 26.316 -5.731 58 HG22 THR 9 1HG2 THR 9 12.526 26.013 -7.128 59 HG23 THR 9 2HG2 THR 9 14.272 26.147 -7.335 60 H THR 10 H THR 10 12.537 25.352 -9.337 61 HA THR 10 HA THR 10 14.717 24.789 -11.199 62 HB THR 10 HB THR 10 13.556 26.102 -12.810 63 HG1 THR 10 HG1 THR 10 12.298 27.162 -10.549 64 HG21 THR 10 3HG2 THR 10 11.549 24.531 -11.190 65 HG22 THR 10 1HG2 THR 10 12.588 23.898 -12.466 66 HG23 THR 10 2HG2 THR 10 11.320 25.061 -12.856 67 H GLU 11 H GLU 11 15.231 27.132 -12.384 68 HA GLU 11 HA GLU 11 16.808 28.499 -10.399 69 HB2 GLU 11 1HB GLU 11 17.797 29.684 -12.235 70 HB3 GLU 11 2HB GLU 11 17.631 27.998 -12.705 71 HG2 GLU 11 1HG GLU 11 16.865 28.973 -14.597 72 HG3 GLU 11 2HG GLU 11 15.348 28.878 -13.704 73 H SER 12 H SER 12 13.806 29.012 -12.047 74 HA SER 12 HA SER 12 13.589 31.804 -11.766 75 HB2 SER 12 1HB SER 12 11.614 29.575 -12.132 76 HB3 SER 12 2HB SER 12 11.038 31.207 -11.791 77 HG SER 12 HG SER 12 12.493 30.265 -14.012 78 H GLY 13 H GLY 13 13.174 29.193 -9.519 79 HA2 GLY 13 1HA GLY 13 13.427 29.799 -7.153 80 HA3 GLY 13 2HA GLY 13 12.359 31.159 -7.470 81 H LEU 14 H LEU 14 10.372 29.897 -8.954 82 HA LEU 14 HA LEU 14 8.690 28.915 -6.970 83 HB2 LEU 14 1HB LEU 14 7.119 28.579 -8.626 84 HB3 LEU 14 2HB LEU 14 8.165 29.809 -9.332 85 HG LEU 14 HG LEU 14 8.195 26.863 -9.985 86 HD11 LEU 14 1HD1 LEU 14 6.236 28.069 -10.850 87 HD12 LEU 14 2HD1 LEU 14 7.317 27.538 -12.137 88 HD13 LEU 14 3HD1 LEU 14 7.311 29.228 -11.633 89 HD21 LEU 14 3HD2 LEU 14 9.792 27.467 -11.722 90 HD22 LEU 14 1HD2 LEU 14 10.420 27.870 -10.124 91 HD23 LEU 14 2HD2 LEU 14 9.781 29.141 -11.167 92 H LYS 15 H LYS 15 7.610 26.727 -7.014 93 HA LYS 15 HA LYS 15 9.393 24.544 -7.776 94 HB2 LYS 15 1HB LYS 15 8.260 24.692 -4.985 95 HB3 LYS 15 2HB LYS 15 9.443 23.550 -5.612 96 HG2 LYS 15 1HG LYS 15 11.075 25.352 -5.828 97 HG3 LYS 15 2HG LYS 15 9.888 26.503 -5.210 98 HD2 LYS 15 1HD LYS 15 10.586 24.070 -3.616 99 HD3 LYS 15 2HD LYS 15 11.655 25.474 -3.597 100 HE2 LYS 15 1HE LYS 15 10.050 26.838 -2.613 101 HE3 LYS 15 2HE LYS 15 8.719 25.790 -3.103 102 HZ1 LYS 15 3HZ LYS 15 10.580 25.496 -0.851 103 HZ2 LYS 15 1HZ LYS 15 9.909 24.106 -1.543 104 HZ3 LYS 15 2HZ LYS 15 8.901 25.297 -0.890 105 H TYR 16 H TYR 16 8.310 22.385 -7.399 106 HA TYR 16 HA TYR 16 5.421 22.419 -7.269 107 HB2 TYR 16 1HB TYR 16 5.298 21.157 -9.501 108 HB3 TYR 16 2HB TYR 16 5.529 22.900 -9.570 109 HD1 TYR 16 HD1 TYR 16 7.417 19.690 -9.666 110 HD2 TYR 16 HD2 TYR 16 7.304 23.793 -10.789 111 HE1 TYR 16 HE1 TYR 16 9.428 19.362 -11.044 112 HE2 TYR 16 HE2 TYR 16 9.313 23.476 -12.172 113 HH TYR 16 HH TYR 16 11.388 21.527 -11.980 114 H GLU 17 H GLU 17 4.499 20.325 -7.049 115 HA GLU 17 HA GLU 17 6.383 18.103 -6.737 116 HB2 GLU 17 1HB GLU 17 6.013 19.238 -4.519 117 HB3 GLU 17 2HB GLU 17 4.320 18.781 -4.639 118 HG2 GLU 17 1HG GLU 17 6.425 16.686 -4.879 119 HG3 GLU 17 2HG GLU 17 5.992 17.314 -3.290 120 H ASP 18 H ASP 18 5.661 16.456 -7.893 121 HA ASP 18 HA ASP 18 3.223 16.298 -9.179 122 HB2 ASP 18 1HB ASP 18 3.808 14.112 -9.804 123 HB3 ASP 18 2HB ASP 18 5.359 14.902 -9.534 124 H LEU 19 H LEU 19 1.228 15.551 -8.698 125 HA LEU 19 HA LEU 19 0.813 14.462 -5.991 126 HB2 LEU 19 1HB LEU 19 -0.049 16.860 -6.715 127 HB3 LEU 19 2HB LEU 19 -1.370 15.912 -7.393 128 HG LEU 19 HG LEU 19 -1.840 14.991 -5.166 129 HD11 LEU 19 1HD1 LEU 19 0.425 16.788 -4.325 130 HD12 LEU 19 2HD1 LEU 19 0.308 15.038 -4.139 131 HD13 LEU 19 3HD1 LEU 19 -0.750 16.096 -3.205 132 HD21 LEU 19 3HD2 LEU 19 -3.267 16.712 -5.307 133 HD22 LEU 19 1HD2 LEU 19 -2.024 17.825 -5.879 134 HD23 LEU 19 2HD2 LEU 19 -2.188 17.499 -4.153 135 H THR 20 H THR 20 -0.231 14.444 -9.356 136 HA THR 20 HA THR 20 -0.934 11.666 -9.186 137 HB THR 20 HB THR 20 -3.186 13.490 -9.999 138 HG1 THR 20 HG1 THR 20 -4.003 13.288 -7.915 139 HG21 THR 20 3HG2 THR 20 -3.124 10.614 -9.077 140 HG22 THR 20 1HG2 THR 20 -3.238 11.144 -10.754 141 HG23 THR 20 2HG2 THR 20 -4.545 11.504 -9.625 142 H GLU 21 H GLU 21 -0.624 10.704 -11.107 143 HA GLU 21 HA GLU 21 0.438 12.150 -13.281 144 HB2 GLU 21 1HB GLU 21 0.716 9.645 -12.610 145 HB3 GLU 21 2HB GLU 21 -0.720 9.401 -13.594 146 HG2 GLU 21 1HG GLU 21 0.358 9.990 -15.551 147 HG3 GLU 21 2HG GLU 21 1.625 10.877 -14.705 148 H GLY 22 H GLY 22 -0.429 12.847 -15.181 149 HA2 GLY 22 1HA GLY 22 -3.358 12.920 -15.293 150 HA3 GLY 22 2HA GLY 22 -2.265 13.976 -16.176 151 H SER 23 H SER 23 -0.855 12.797 -17.821 152 HA SER 23 HA SER 23 -0.689 11.579 -19.736 153 HB2 SER 23 1HB SER 23 -1.134 9.710 -17.925 154 HB3 SER 23 2HB SER 23 -2.681 9.571 -18.760 155 HG SER 23 HG SER 23 -1.412 8.224 -19.874 156 H GLY 24 H GLY 24 -2.695 13.644 -19.460 157 HA2 GLY 24 1HA GLY 24 -4.816 12.620 -21.237 158 HA3 GLY 24 2HA GLY 24 -4.969 14.034 -20.204 159 H ALA 25 H ALA 25 -3.208 15.759 -20.711 160 HA ALA 25 HA ALA 25 -2.101 15.973 -23.274 161 HB1 ALA 25 1HB ALA 25 -3.968 17.935 -23.755 162 HB2 ALA 25 2HB ALA 25 -3.912 16.348 -24.524 163 HB3 ALA 25 3HB ALA 25 -4.937 16.608 -23.113 164 H GLU 26 H GLU 26 -0.507 17.380 -23.001 165 HA GLU 26 HA GLU 26 -0.315 19.069 -20.749 166 HB2 GLU 26 1HB GLU 26 1.697 18.258 -21.757 167 HB3 GLU 26 2HB GLU 26 1.265 18.944 -23.317 168 HG2 GLU 26 1HG GLU 26 1.480 21.197 -22.367 169 HG3 GLU 26 2HG GLU 26 1.966 20.486 -20.829 170 H ALA 27 H ALA 27 -1.109 21.029 -20.393 171 HA ALA 27 HA ALA 27 -2.862 22.357 -22.063 172 HB1 ALA 27 1HB ALA 27 -1.553 24.300 -20.448 173 HB2 ALA 27 2HB ALA 27 -3.138 23.559 -20.222 174 HB3 ALA 27 3HB ALA 27 -1.706 22.807 -19.521 175 H ARG 28 H ARG 28 -2.701 23.796 -23.690 176 HA ARG 28 HA ARG 28 -0.015 24.378 -24.694 177 HB2 ARG 28 1HB ARG 28 -2.744 24.560 -25.974 178 HB3 ARG 28 2HB ARG 28 -1.269 25.111 -26.757 179 HG2 ARG 28 1HG ARG 28 -1.862 22.295 -25.872 180 HG3 ARG 28 2HG ARG 28 -1.884 22.899 -27.530 181 HD2 ARG 28 1HD ARG 28 0.565 23.610 -27.014 182 HD3 ARG 28 2HD ARG 28 0.442 22.428 -25.711 183 HE ARG 28 HE ARG 28 -0.414 21.063 -27.892 184 HH11 ARG 28 1HH1 ARG 28 2.443 22.918 -27.173 185 HH12 ARG 28 2HH1 ARG 28 3.468 21.987 -28.214 186 HH21 ARG 28 1HH2 ARG 28 0.925 19.830 -29.267 187 HH22 ARG 28 2HH2 ARG 28 2.603 20.231 -29.405 188 H ALA 29 H ALA 29 0.518 26.510 -25.461 189 HA ALA 29 HA ALA 29 -0.399 28.561 -23.653 190 HB1 ALA 29 1HB ALA 29 1.560 29.551 -24.072 191 HB2 ALA 29 2HB ALA 29 1.986 28.057 -24.906 192 HB3 ALA 29 3HB ALA 29 1.353 29.427 -25.819 193 H GLY 30 H GLY 30 -1.521 30.419 -24.157 194 HA2 GLY 30 1HA GLY 30 -2.805 31.884 -25.403 195 HA3 GLY 30 2HA GLY 30 -2.238 31.080 -26.859 196 H GLN 31 H GLN 31 -3.383 28.740 -24.823 197 HA GLN 31 HA GLN 31 -6.044 28.821 -26.086 198 HB2 GLN 31 1HB GLN 31 -4.121 26.591 -25.620 199 HB3 GLN 31 2HB GLN 31 -5.841 26.232 -25.541 200 HG2 GLN 31 1HG GLN 31 -5.927 27.467 -27.827 201 HG3 GLN 31 2HG GLN 31 -4.198 27.125 -27.862 202 HE21 GLN 31 2HE2 GLN 31 -3.512 24.937 -27.826 203 HE22 GLN 31 1HE2 GLN 31 -4.556 23.675 -28.374 204 H THR 32 H THR 32 -7.838 28.152 -24.869 205 HA THR 32 HA THR 32 -7.745 28.863 -22.121 206 HB THR 32 HB THR 32 -10.070 27.298 -23.087 207 HG1 THR 32 HG1 THR 32 -9.448 29.881 -24.127 208 HG21 THR 32 3HG2 THR 32 -11.225 29.348 -22.116 209 HG22 THR 32 1HG2 THR 32 -9.628 29.863 -21.574 210 HG23 THR 32 2HG2 THR 32 -10.313 28.348 -20.985 211 H VAL 33 H VAL 33 -8.624 27.445 -20.373 212 HA VAL 33 HA VAL 33 -8.507 24.619 -20.601 213 HB VAL 33 HB VAL 33 -6.096 25.032 -20.752 214 HG11 VAL 33 1HG1 VAL 33 -5.006 26.522 -19.504 215 HG12 VAL 33 2HG1 VAL 33 -6.587 27.076 -18.950 216 HG13 VAL 33 3HG1 VAL 33 -5.691 25.882 -18.011 217 HG21 VAL 33 3HG2 VAL 33 -7.094 23.759 -18.214 218 HG22 VAL 33 1HG2 VAL 33 -6.698 22.975 -19.743 219 HG23 VAL 33 2HG2 VAL 33 -5.415 23.658 -18.744 220 H SER 34 H SER 34 -9.462 23.657 -18.877 221 HA SER 34 HA SER 34 -10.259 25.427 -16.671 222 HB2 SER 34 1HB SER 34 -12.297 24.661 -17.271 223 HB3 SER 34 2HB SER 34 -11.619 23.313 -18.183 224 HG SER 34 HG SER 34 -12.624 22.362 -16.506 225 H VAL 35 H VAL 35 -9.337 25.141 -14.761 226 HA VAL 35 HA VAL 35 -8.585 22.453 -13.896 227 HB VAL 35 HB VAL 35 -6.367 23.003 -13.287 228 HG11 VAL 35 1HG1 VAL 35 -6.823 22.561 -15.722 229 HG12 VAL 35 2HG1 VAL 35 -6.718 24.304 -15.979 230 HG13 VAL 35 3HG1 VAL 35 -5.319 23.415 -15.377 231 HG21 VAL 35 3HG2 VAL 35 -5.429 25.287 -13.646 232 HG22 VAL 35 1HG2 VAL 35 -7.063 25.849 -13.996 233 HG23 VAL 35 2HG2 VAL 35 -6.673 25.209 -12.399 234 H HIS 36 H HIS 36 -7.998 22.407 -11.562 235 HA HIS 36 HA HIS 36 -9.629 24.364 -10.092 236 HB2 HIS 36 1HB HIS 36 -9.164 21.462 -9.813 237 HB3 HIS 36 2HB HIS 36 -9.206 22.363 -8.301 238 HD1 HIS 36 HD1 HIS 36 -11.434 24.390 -9.036 239 HD2 HIS 36 HD2 HIS 36 -11.633 20.300 -9.737 240 HE1 HIS 36 HE1 HIS 36 -13.886 23.852 -9.184 241 H TYR 37 H TYR 37 -8.733 25.652 -8.600 242 HA TYR 37 HA TYR 37 -5.911 25.172 -7.898 243 HB2 TYR 37 1HB TYR 37 -5.594 27.566 -7.763 244 HB3 TYR 37 2HB TYR 37 -6.285 27.170 -9.333 245 HD1 TYR 37 HD1 TYR 37 -7.010 28.617 -6.016 246 HD2 TYR 37 HD2 TYR 37 -8.431 27.991 -9.978 247 HE1 TYR 37 HE1 TYR 37 -8.825 30.227 -5.613 248 HE2 TYR 37 HE2 TYR 37 -10.249 29.600 -9.586 249 HH TYR 37 HH TYR 37 -10.594 31.634 -7.981 250 H THR 38 H THR 38 -5.316 25.249 -5.789 251 HA THR 38 HA THR 38 -7.343 26.023 -3.806 252 HB THR 38 HB THR 38 -5.775 23.873 -2.750 253 HG1 THR 38 HG1 THR 38 -7.334 22.931 -4.888 254 HG21 THR 38 3HG2 THR 38 -8.581 24.661 -3.062 255 HG22 THR 38 1HG2 THR 38 -7.757 23.928 -1.686 256 HG23 THR 38 2HG2 THR 38 -8.323 22.917 -3.016 257 H GLY 39 H GLY 39 -6.513 27.654 -2.679 258 HA2 GLY 39 1HA GLY 39 -3.636 27.960 -2.419 259 HA3 GLY 39 2HA GLY 39 -4.861 29.106 -1.893 260 H TRP 40 H TRP 40 -2.446 27.431 -0.710 261 HA TRP 40 HA TRP 40 -3.800 26.971 1.859 262 HB2 TRP 40 1HB TRP 40 -1.930 25.139 0.388 263 HB3 TRP 40 2HB TRP 40 -2.025 25.088 2.146 264 HD1 TRP 40 HD1 TRP 40 -5.108 25.327 2.603 265 HE1 TRP 40 HE1 TRP 40 -6.688 23.428 1.880 266 HE3 TRP 40 HE3 TRP 40 -2.123 23.067 -0.879 267 HZ2 TRP 40 HZ2 TRP 40 -6.672 21.260 0.073 268 HZ3 TRP 40 HZ3 TRP 40 -2.980 21.086 -2.059 269 HH2 TRP 40 HH2 TRP 40 -5.207 20.202 -1.591 270 H LEU 41 H LEU 41 -2.785 27.785 3.610 271 HA LEU 41 HA LEU 41 -0.529 29.511 3.190 272 HB2 LEU 41 1HB LEU 41 -2.357 28.878 5.445 273 HB3 LEU 41 2HB LEU 41 -0.796 29.604 5.823 274 HG LEU 41 HG LEU 41 -2.864 30.811 3.987 275 HD11 LEU 41 1HD1 LEU 41 -2.291 31.160 6.900 276 HD12 LEU 41 2HD1 LEU 41 -3.841 31.002 6.074 277 HD13 LEU 41 3HD1 LEU 41 -2.922 32.502 5.945 278 HD21 LEU 41 3HD2 LEU 41 -1.056 31.926 3.261 279 HD22 LEU 41 1HD2 LEU 41 -0.082 31.460 4.656 280 HD23 LEU 41 2HD2 LEU 41 -1.208 32.812 4.779 281 H THR 42 H THR 42 1.297 29.458 4.856 282 HA THR 42 HA THR 42 2.816 27.145 4.492 283 HB THR 42 HB THR 42 4.400 28.067 6.077 284 HG1 THR 42 HG1 THR 42 2.377 29.965 6.739 285 HG21 THR 42 3HG2 THR 42 4.512 30.457 5.178 286 HG22 THR 42 1HG2 THR 42 3.053 30.060 4.271 287 HG23 THR 42 2HG2 THR 42 4.539 29.152 3.992 288 H ASP 43 H ASP 43 0.575 28.030 7.017 289 HA ASP 43 HA ASP 43 1.377 25.833 8.732 290 HB2 ASP 43 1HB ASP 43 -0.749 27.960 8.932 291 HB3 ASP 43 2HB ASP 43 -0.652 26.628 10.080 292 H GLY 44 H GLY 44 -0.814 26.390 6.164 293 HA2 GLY 44 1HA GLY 44 -1.711 24.327 5.146 294 HA3 GLY 44 2HA GLY 44 -2.156 23.826 6.771 295 H GLN 45 H GLN 45 -2.890 26.814 7.171 296 HA GLN 45 HA GLN 45 -5.652 26.528 6.901 297 HB2 GLN 45 1HB GLN 45 -3.966 29.024 7.118 298 HB3 GLN 45 2HB GLN 45 -5.720 29.013 7.236 299 HG2 GLN 45 1HG GLN 45 -3.910 27.446 9.054 300 HG3 GLN 45 2HG GLN 45 -4.519 29.060 9.417 301 HE21 GLN 45 2HE2 GLN 45 -4.966 25.989 10.175 302 HE22 GLN 45 1HE2 GLN 45 -6.668 25.963 10.472 303 H LYS 46 H LYS 46 -6.808 26.380 5.107 304 HA LYS 46 HA LYS 46 -5.825 27.203 2.559 305 HB2 LYS 46 1HB LYS 46 -7.454 25.282 3.106 306 HB3 LYS 46 2HB LYS 46 -8.696 26.526 3.157 307 HG2 LYS 46 1HG LYS 46 -7.730 27.152 0.804 308 HG3 LYS 46 2HG LYS 46 -7.143 25.488 0.841 309 HD2 LYS 46 1HD LYS 46 -10.012 26.251 1.361 310 HD3 LYS 46 2HD LYS 46 -9.395 25.814 -0.234 311 HE2 LYS 46 1HE LYS 46 -9.306 23.624 0.268 312 HE3 LYS 46 2HE LYS 46 -8.710 23.922 1.900 313 HZ1 LYS 46 3HZ LYS 46 -10.730 23.475 2.647 314 HZ2 LYS 46 1HZ LYS 46 -11.325 23.289 1.074 315 HZ3 LYS 46 2HZ LYS 46 -11.342 24.812 1.809 316 H PHE 47 H PHE 47 -6.425 28.914 1.278 317 HA PHE 47 HA PHE 47 -8.300 30.874 2.386 318 HB2 PHE 47 1HB PHE 47 -6.751 32.718 1.880 319 HB3 PHE 47 2HB PHE 47 -6.073 31.618 3.075 320 HD1 PHE 47 HD2 PHE 47 -5.838 32.843 -0.362 321 HD2 PHE 47 HD1 PHE 47 -4.162 30.244 2.563 322 HE1 PHE 47 HE2 PHE 47 -3.825 32.580 -1.753 323 HE2 PHE 47 HE1 PHE 47 -2.147 29.978 1.177 324 HZ PHE 47 HZ PHE 47 -1.977 31.146 -0.985 325 H ASP 48 H ASP 48 -8.240 28.905 0.125 326 HA ASP 48 HA ASP 48 -9.642 30.399 -1.771 327 HB2 ASP 48 1HB ASP 48 -6.897 30.807 -2.032 328 HB3 ASP 48 2HB ASP 48 -7.280 29.620 -3.275 329 H SER 49 H SER 49 -10.957 28.974 -2.682 330 HA SER 49 HA SER 49 -9.973 26.418 -3.624 331 HB2 SER 49 1HB SER 49 -11.105 26.573 -1.055 332 HB3 SER 49 2HB SER 49 -12.363 25.891 -2.087 333 HG SER 49 HG SER 49 -11.280 24.103 -2.108 334 H SER 50 H SER 50 -10.645 26.715 -5.670 335 HA SER 50 HA SER 50 -12.980 28.055 -6.461 336 HB2 SER 50 1HB SER 50 -10.791 26.827 -7.739 337 HB3 SER 50 2HB SER 50 -12.231 26.040 -8.387 338 HG SER 50 HG SER 50 -13.036 28.270 -8.681 339 H LYS 51 H LYS 51 -12.472 24.857 -5.301 340 HA LYS 51 HA LYS 51 -14.668 23.540 -6.463 341 HB2 LYS 51 1HB LYS 51 -13.159 23.089 -3.893 342 HB3 LYS 51 2HB LYS 51 -14.474 22.040 -4.407 343 HG2 LYS 51 1HG LYS 51 -12.297 22.555 -6.350 344 HG3 LYS 51 2HG LYS 51 -11.938 21.520 -4.966 345 HD2 LYS 51 1HD LYS 51 -14.171 20.342 -5.633 346 HD3 LYS 51 2HD LYS 51 -13.880 21.102 -7.200 347 HE2 LYS 51 1HE LYS 51 -11.498 20.087 -6.945 348 HE3 LYS 51 2HE LYS 51 -12.270 19.027 -5.767 349 HZ1 LYS 51 3HZ LYS 51 -13.508 19.341 -8.408 350 HZ2 LYS 51 1HZ LYS 51 -13.524 18.010 -7.364 351 HZ3 LYS 51 2HZ LYS 51 -12.138 18.359 -8.268 352 H ASP 52 H ASP 52 -14.477 25.910 -3.986 353 HA ASP 52 HA ASP 52 -16.698 25.372 -2.422 354 HB2 ASP 52 1HB ASP 52 -15.125 27.173 -1.911 355 HB3 ASP 52 2HB ASP 52 -15.665 28.067 -3.330 356 H ARG 53 H ARG 53 -16.535 27.189 -5.472 357 HA ARG 53 HA ARG 53 -19.379 27.594 -5.558 358 HB2 ARG 53 1HB ARG 53 -18.902 28.472 -7.856 359 HB3 ARG 53 2HB ARG 53 -18.002 29.268 -6.572 360 HG2 ARG 53 1HG ARG 53 -16.002 28.129 -7.149 361 HG3 ARG 53 2HG ARG 53 -16.863 27.047 -8.246 362 HD2 ARG 53 1HD ARG 53 -16.442 30.013 -8.578 363 HD3 ARG 53 2HD ARG 53 -15.704 28.725 -9.529 364 HE ARG 53 HE ARG 53 -18.339 28.307 -9.906 365 HH11 ARG 53 1HH1 ARG 53 -16.327 31.134 -10.189 366 HH12 ARG 53 2HH1 ARG 53 -17.289 31.854 -11.437 367 HH21 ARG 53 1HH2 ARG 53 -19.614 29.244 -11.549 368 HH22 ARG 53 2HH2 ARG 53 -19.159 30.779 -12.209 369 H ASN 54 H ASN 54 -17.484 24.942 -6.089 370 HA ASN 54 HA ASN 54 -17.846 22.905 -7.033 371 HB2 ASN 54 1HB ASN 54 -20.114 23.245 -5.991 372 HB3 ASN 54 2HB ASN 54 -20.669 23.856 -7.546 373 HD21 ASN 54 2HD2 ASN 54 -22.202 22.090 -7.384 374 HD22 ASN 54 1HD2 ASN 54 -21.726 20.513 -7.905 375 H ASP 55 H ASP 55 -16.795 24.987 -8.643 376 HA ASP 55 HA ASP 55 -17.424 23.897 -11.263 377 HB2 ASP 55 1HB ASP 55 -18.683 26.216 -10.527 378 HB3 ASP 55 2HB ASP 55 -17.239 26.829 -11.328 379 HA PRO 56 HA PRO 56 -13.048 24.236 -11.643 380 HB2 PRO 56 1HB PRO 56 -12.851 23.953 -14.335 381 HB3 PRO 56 2HB PRO 56 -13.218 22.605 -13.252 382 HG2 PRO 56 1HG PRO 56 -15.077 24.259 -14.917 383 HG3 PRO 56 2HG PRO 56 -15.062 22.503 -14.666 384 HD2 PRO 56 1HD PRO 56 -16.770 24.147 -13.358 385 HD3 PRO 56 2HD PRO 56 -16.132 22.659 -12.630 386 H PHE 57 H PHE 57 -11.395 25.589 -12.546 387 HA PHE 57 HA PHE 57 -12.386 28.268 -13.192 388 HB2 PHE 57 1HB PHE 57 -10.871 28.157 -11.300 389 HB3 PHE 57 2HB PHE 57 -9.667 27.316 -12.271 390 HD1 PHE 57 HD2 PHE 57 -11.714 30.411 -12.699 391 HD2 PHE 57 HD1 PHE 57 -7.852 28.622 -12.744 392 HE1 PHE 57 HE2 PHE 57 -10.725 32.572 -13.334 393 HE2 PHE 57 HE1 PHE 57 -6.856 30.781 -13.379 394 HZ PHE 57 HZ PHE 57 -8.293 32.759 -13.676 395 H ALA 58 H ALA 58 -12.707 28.413 -15.342 396 HA ALA 58 HA ALA 58 -10.734 27.306 -17.185 397 HB1 ALA 58 1HB ALA 58 -13.231 27.027 -17.501 398 HB2 ALA 58 2HB ALA 58 -13.272 28.738 -17.927 399 HB3 ALA 58 3HB ALA 58 -12.327 27.610 -18.899 400 H PHE 59 H PHE 59 -9.037 28.530 -17.666 401 HA PHE 59 HA PHE 59 -9.480 31.386 -18.205 402 HB2 PHE 59 1HB PHE 59 -7.533 32.035 -17.027 403 HB3 PHE 59 2HB PHE 59 -8.375 30.925 -15.950 404 HD1 PHE 59 HD2 PHE 59 -7.570 28.559 -15.772 405 HD2 PHE 59 HD1 PHE 59 -5.352 31.594 -17.769 406 HE1 PHE 59 HE2 PHE 59 -5.539 27.180 -15.605 407 HE2 PHE 59 HE1 PHE 59 -3.318 30.220 -17.606 408 HZ PHE 59 HZ PHE 59 -3.409 28.010 -16.521 409 H VAL 60 H VAL 60 -7.272 32.261 -19.222 410 HA VAL 60 HA VAL 60 -6.719 30.470 -21.485 411 HB VAL 60 HB VAL 60 -6.187 33.437 -21.341 412 HG11 VAL 60 1HG1 VAL 60 -4.886 32.631 -23.070 413 HG12 VAL 60 2HG1 VAL 60 -6.038 31.361 -23.486 414 HG13 VAL 60 3HG1 VAL 60 -6.384 33.039 -23.905 415 HG21 VAL 60 3HG2 VAL 60 -8.502 33.360 -21.153 416 HG22 VAL 60 1HG2 VAL 60 -8.252 33.477 -22.895 417 HG23 VAL 60 2HG2 VAL 60 -8.636 31.920 -22.162 418 H LEU 61 H LEU 61 -4.767 29.602 -21.725 419 HA LEU 61 HA LEU 61 -2.754 29.726 -19.839 420 HB2 LEU 61 1HB LEU 61 -3.183 28.208 -21.986 421 HB3 LEU 61 2HB LEU 61 -1.954 29.276 -22.659 422 HG LEU 61 HG LEU 61 -0.686 27.505 -21.919 423 HD11 LEU 61 1HD1 LEU 61 0.520 28.214 -19.957 424 HD12 LEU 61 2HD1 LEU 61 -0.820 29.247 -19.463 425 HD13 LEU 61 3HD1 LEU 61 0.093 29.626 -20.923 426 HD21 LEU 61 3HD2 LEU 61 -2.511 26.265 -20.877 427 HD22 LEU 61 1HD2 LEU 61 -2.444 27.330 -19.473 428 HD23 LEU 61 2HD2 LEU 61 -1.080 26.274 -19.844 429 H GLY 62 H GLY 62 -1.411 31.292 -19.257 430 HA2 GLY 62 1HA GLY 62 -0.210 33.251 -19.299 431 HA3 GLY 62 2HA GLY 62 0.279 32.724 -20.903 432 H GLY 63 H GLY 63 -2.665 34.060 -19.381 433 HA2 GLY 63 1HA GLY 63 -3.017 35.738 -21.772 434 HA3 GLY 63 2HA GLY 63 -4.279 35.324 -20.622 435 H GLY 64 H GLY 64 -2.978 35.933 -18.227 436 HA2 GLY 64 1HA GLY 64 -1.595 38.106 -17.704 437 HA3 GLY 64 2HA GLY 64 -3.026 38.855 -18.394 438 H MET 65 H MET 65 -4.561 36.477 -17.161 439 HA MET 65 HA MET 65 -4.985 37.799 -14.590 440 HB2 MET 65 1HB MET 65 -6.747 36.841 -16.468 441 HB3 MET 65 2HB MET 65 -6.740 35.551 -15.272 442 HG2 MET 65 1HG MET 65 -8.455 36.910 -14.551 443 HG3 MET 65 2HG MET 65 -7.098 37.437 -13.559 444 HE1 MET 65 3HE MET 65 -9.886 38.304 -15.746 445 HE2 MET 65 1HE MET 65 -9.917 39.233 -14.247 446 HE3 MET 65 2HE MET 65 -9.794 40.065 -15.797 447 H VAL 66 H VAL 66 -2.631 36.227 -14.895 448 HA VAL 66 HA VAL 66 -3.066 34.347 -12.714 449 HB VAL 66 HB VAL 66 -1.920 32.508 -13.779 450 HG11 VAL 66 1HG1 VAL 66 -4.011 33.425 -15.734 451 HG12 VAL 66 2HG1 VAL 66 -3.622 31.778 -15.234 452 HG13 VAL 66 3HG1 VAL 66 -4.411 32.880 -14.106 453 HG21 VAL 66 3HG2 VAL 66 -1.633 32.814 -16.384 454 HG22 VAL 66 1HG2 VAL 66 -1.463 34.510 -15.931 455 HG23 VAL 66 2HG2 VAL 66 -0.366 33.303 -15.259 456 H ILE 67 H ILE 67 -0.778 33.291 -12.211 457 HA ILE 67 HA ILE 67 1.138 35.526 -12.143 458 HB ILE 67 HB ILE 67 1.979 34.724 -10.080 459 HG12 ILE 67 1HG1 ILE 67 0.269 32.272 -10.542 460 HG13 ILE 67 2HG1 ILE 67 2.027 32.344 -10.546 461 HG21 ILE 67 1HG2 ILE 67 -0.652 35.525 -10.387 462 HG22 ILE 67 2HG2 ILE 67 -0.751 34.138 -9.303 463 HG23 ILE 67 3HG2 ILE 67 0.272 35.513 -8.885 464 HD11 ILE 67 3HD1 ILE 67 1.991 32.936 -8.169 465 HD12 ILE 67 1HD1 ILE 67 0.232 32.809 -8.177 466 HD13 ILE 67 2HD1 ILE 67 1.221 31.381 -8.486 467 H LYS 68 H LYS 68 3.456 34.842 -11.974 468 HA LYS 68 HA LYS 68 4.322 33.509 -14.202 469 HB2 LYS 68 1HB LYS 68 5.683 33.830 -11.527 470 HB3 LYS 68 2HB LYS 68 6.497 33.195 -12.951 471 HG2 LYS 68 1HG LYS 68 5.714 35.390 -14.077 472 HG3 LYS 68 2HG LYS 68 5.503 35.961 -12.420 473 HD2 LYS 68 1HD LYS 68 7.668 36.597 -12.754 474 HD3 LYS 68 2HD LYS 68 7.946 34.958 -12.163 475 HE2 LYS 68 1HE LYS 68 8.261 34.130 -14.369 476 HE3 LYS 68 2HE LYS 68 7.683 35.633 -15.085 477 HZ1 LYS 68 3HZ LYS 68 9.814 36.207 -15.191 478 HZ2 LYS 68 1HZ LYS 68 10.306 34.946 -14.175 479 HZ3 LYS 68 2HZ LYS 68 9.768 36.406 -13.511 480 H GLY 69 H GLY 69 4.197 32.129 -10.910 481 HA2 GLY 69 1HA GLY 69 4.990 29.547 -11.530 482 HA3 GLY 69 2HA GLY 69 3.921 29.964 -10.199 483 H TRP 70 H TRP 70 1.868 31.061 -11.991 484 HA TRP 70 HA TRP 70 0.386 28.681 -12.398 485 HB2 TRP 70 1HB TRP 70 -0.119 31.488 -12.413 486 HB3 TRP 70 2HB TRP 70 -0.757 30.809 -13.908 487 HD1 TRP 70 HD1 TRP 70 -3.107 29.803 -13.744 488 HE1 TRP 70 HE1 TRP 70 -4.658 29.052 -11.832 489 HE3 TRP 70 HE3 TRP 70 0.106 30.397 -9.812 490 HZ2 TRP 70 HZ2 TRP 70 -4.535 28.751 -9.028 491 HZ3 TRP 70 HZ3 TRP 70 -0.689 29.856 -7.547 492 HH2 TRP 70 HH2 TRP 70 -2.962 29.051 -7.165 493 H ASP 71 H ASP 71 1.552 31.087 -14.764 494 HA ASP 71 HA ASP 71 0.906 29.694 -17.069 495 HB2 ASP 71 1HB ASP 71 3.020 31.727 -16.432 496 HB3 ASP 71 2HB ASP 71 2.961 30.985 -18.029 497 H GLU 72 H GLU 72 3.925 29.594 -15.199 498 HA GLU 72 HA GLU 72 5.309 27.813 -16.864 499 HB2 GLU 72 1HB GLU 72 6.154 29.228 -14.865 500 HB3 GLU 72 2HB GLU 72 5.667 27.855 -13.881 501 HG2 GLU 72 1HG GLU 72 8.047 27.805 -14.449 502 HG3 GLU 72 2HG GLU 72 7.177 26.406 -15.075 503 H GLY 73 H GLY 73 3.141 27.242 -14.127 504 HA2 GLY 73 1HA GLY 73 3.532 24.453 -13.949 505 HA3 GLY 73 2HA GLY 73 2.128 25.330 -13.360 506 H VAL 74 H VAL 74 0.694 26.150 -15.291 507 HA VAL 74 HA VAL 74 -0.465 23.910 -16.476 508 HB VAL 74 HB VAL 74 -1.581 25.616 -18.021 509 HG11 VAL 74 1HG1 VAL 74 -3.151 25.536 -16.454 510 HG12 VAL 74 2HG1 VAL 74 -1.941 25.007 -15.283 511 HG13 VAL 74 3HG1 VAL 74 -2.277 26.727 -15.490 512 HG21 VAL 74 3HG2 VAL 74 -0.947 27.759 -18.034 513 HG22 VAL 74 1HG2 VAL 74 -0.833 27.820 -16.275 514 HG23 VAL 74 2HG2 VAL 74 0.522 27.211 -17.226 515 H GLN 75 H GLN 75 2.158 25.916 -17.537 516 HA GLN 75 HA GLN 75 2.110 25.371 -20.287 517 HB2 GLN 75 1HB GLN 75 4.082 26.385 -18.344 518 HB3 GLN 75 2HB GLN 75 4.768 25.639 -19.781 519 HG2 GLN 75 1HG GLN 75 3.547 27.158 -21.203 520 HG3 GLN 75 2HG GLN 75 2.737 27.858 -19.803 521 HE21 GLN 75 2HE2 GLN 75 3.592 29.876 -20.613 522 HE22 GLN 75 1HE2 GLN 75 5.212 30.331 -20.221 523 H GLY 76 H GLY 76 2.796 23.344 -17.639 524 HA2 GLY 76 1HA GLY 76 3.938 21.332 -19.479 525 HA3 GLY 76 2HA GLY 76 4.491 21.506 -17.819 526 H MET 77 H MET 77 1.822 21.963 -16.748 527 HA MET 77 HA MET 77 1.119 19.398 -16.011 528 HB2 MET 77 1HB MET 77 -0.372 21.997 -16.033 529 HB3 MET 77 2HB MET 77 -1.204 20.518 -15.570 530 HG2 MET 77 1HG MET 77 1.372 21.325 -14.276 531 HG3 MET 77 2HG MET 77 -0.175 21.967 -13.730 532 HE1 MET 77 3HE MET 77 -1.826 19.347 -11.790 533 HE2 MET 77 1HE MET 77 -0.830 20.713 -11.287 534 HE3 MET 77 2HE MET 77 -1.916 20.875 -12.667 535 H LYS 78 H LYS 78 -0.549 17.978 -16.609 536 HA LYS 78 HA LYS 78 -1.541 18.357 -19.359 537 HB2 LYS 78 1HB LYS 78 -0.789 15.800 -17.933 538 HB3 LYS 78 2HB LYS 78 -1.565 15.865 -19.510 539 HG2 LYS 78 1HG LYS 78 0.328 16.520 -20.572 540 HG3 LYS 78 2HG LYS 78 0.939 17.407 -19.173 541 HD2 LYS 78 1HD LYS 78 0.734 14.472 -18.885 542 HD3 LYS 78 2HD LYS 78 1.965 15.067 -20.002 543 HE2 LYS 78 1HE LYS 78 2.723 16.601 -18.139 544 HE3 LYS 78 2HE LYS 78 1.663 15.683 -17.070 545 HZ1 LYS 78 3HZ LYS 78 3.710 14.334 -18.717 546 HZ2 LYS 78 1HZ LYS 78 2.940 13.774 -17.318 547 HZ3 LYS 78 2HZ LYS 78 4.100 15.000 -17.212 548 H VAL 79 H VAL 79 -3.620 17.421 -19.853 549 HA VAL 79 HA VAL 79 -5.639 18.095 -18.085 550 HB VAL 79 HB VAL 79 -5.811 16.014 -20.268 551 HG11 VAL 79 1HG1 VAL 79 -8.223 17.149 -20.247 552 HG12 VAL 79 2HG1 VAL 79 -7.825 15.747 -19.252 553 HG13 VAL 79 3HG1 VAL 79 -7.808 17.364 -18.547 554 HG21 VAL 79 3HG2 VAL 79 -6.830 18.131 -21.451 555 HG22 VAL 79 1HG2 VAL 79 -5.803 18.992 -20.305 556 HG23 VAL 79 2HG2 VAL 79 -5.089 17.848 -21.442 557 H GLY 80 H GLY 80 -6.423 17.194 -16.297 558 HA2 GLY 80 1HA GLY 80 -7.174 15.499 -14.885 559 HA3 GLY 80 2HA GLY 80 -6.489 14.313 -15.986 560 H GLY 81 H GLY 81 -4.123 16.534 -15.488 561 HA2 GLY 81 1HA GLY 81 -2.795 14.779 -13.568 562 HA3 GLY 81 2HA GLY 81 -2.029 16.029 -14.537 563 H VAL 82 H VAL 82 -2.291 15.297 -11.526 564 HA VAL 82 HA VAL 82 -2.996 18.008 -10.608 565 HB VAL 82 HB VAL 82 -2.952 15.494 -8.936 566 HG11 VAL 82 1HG1 VAL 82 -2.588 17.747 -7.834 567 HG12 VAL 82 2HG1 VAL 82 -4.245 18.134 -8.301 568 HG13 VAL 82 3HG1 VAL 82 -3.926 16.781 -7.215 569 HG21 VAL 82 3HG2 VAL 82 -5.043 16.670 -10.652 570 HG22 VAL 82 1HG2 VAL 82 -4.813 15.005 -10.118 571 HG23 VAL 82 2HG2 VAL 82 -5.554 16.184 -9.036 572 H ARG 83 H ARG 83 -1.457 19.216 -9.696 573 HA ARG 83 HA ARG 83 0.886 17.958 -8.506 574 HB2 ARG 83 1HB ARG 83 1.376 18.366 -10.945 575 HB3 ARG 83 2HB ARG 83 1.189 20.086 -10.626 576 HG2 ARG 83 1HG ARG 83 3.051 20.044 -9.090 577 HG3 ARG 83 2HG ARG 83 3.203 18.297 -9.281 578 HD2 ARG 83 1HD ARG 83 3.289 19.212 -11.872 579 HD3 ARG 83 2HD ARG 83 4.159 20.462 -10.985 580 HE ARG 83 HE ARG 83 5.853 18.962 -10.579 581 HH11 ARG 83 1HH1 ARG 83 3.072 17.282 -11.828 582 HH12 ARG 83 2HH1 ARG 83 3.916 15.786 -12.058 583 HH21 ARG 83 1HH2 ARG 83 6.975 16.999 -10.877 584 HH22 ARG 83 2HH2 ARG 83 6.136 15.626 -11.516 585 H ARG 84 H ARG 84 1.782 19.133 -6.868 586 HA ARG 84 HA ARG 84 0.270 21.443 -5.973 587 HB2 ARG 84 1HB ARG 84 0.804 19.713 -4.346 588 HB3 ARG 84 2HB ARG 84 2.521 19.899 -4.675 589 HG2 ARG 84 1HG ARG 84 2.326 22.261 -3.864 590 HG3 ARG 84 2HG ARG 84 0.684 21.873 -3.347 591 HD2 ARG 84 1HD ARG 84 1.403 20.765 -1.541 592 HD3 ARG 84 2HD ARG 84 2.656 19.924 -2.452 593 HE ARG 84 HE ARG 84 3.440 22.591 -2.091 594 HH11 ARG 84 1HH1 ARG 84 2.934 19.684 -0.243 595 HH12 ARG 84 2HH1 ARG 84 4.108 20.092 0.964 596 HH21 ARG 84 1HH2 ARG 84 4.988 23.138 -0.508 597 HH22 ARG 84 2HH2 ARG 84 5.275 22.057 0.813 598 H LEU 85 H LEU 85 0.818 23.285 -6.985 599 HA LEU 85 HA LEU 85 3.590 23.861 -7.624 600 HB2 LEU 85 1HB LEU 85 1.856 24.409 -9.240 601 HB3 LEU 85 2HB LEU 85 1.070 25.458 -8.062 602 HG LEU 85 HG LEU 85 3.438 26.666 -8.134 603 HD11 LEU 85 1HD1 LEU 85 3.218 25.197 -10.743 604 HD12 LEU 85 2HD1 LEU 85 4.594 25.296 -9.645 605 HD13 LEU 85 3HD1 LEU 85 4.116 26.707 -10.588 606 HD21 LEU 85 3HD2 LEU 85 1.480 27.115 -10.368 607 HD22 LEU 85 1HD2 LEU 85 2.458 28.302 -9.505 608 HD23 LEU 85 2HD2 LEU 85 1.104 27.516 -8.692 609 H THR 86 H THR 86 4.914 24.893 -6.297 610 HA THR 86 HA THR 86 3.778 26.392 -4.043 611 HB THR 86 HB THR 86 6.690 25.714 -4.274 612 HG1 THR 86 HG1 THR 86 5.690 23.731 -4.593 613 HG21 THR 86 3HG2 THR 86 6.383 27.001 -2.393 614 HG22 THR 86 1HG2 THR 86 6.144 25.390 -1.718 615 HG23 THR 86 2HG2 THR 86 4.750 26.397 -2.113 616 H ILE 87 H ILE 87 3.759 28.531 -4.141 617 HA ILE 87 HA ILE 87 5.765 29.881 -5.829 618 HB ILE 87 HB ILE 87 2.993 30.889 -5.182 619 HG12 ILE 87 1HG1 ILE 87 2.883 30.494 -7.815 620 HG13 ILE 87 2HG1 ILE 87 4.067 29.250 -7.429 621 HG21 ILE 87 1HG2 ILE 87 4.764 32.594 -5.607 622 HG22 ILE 87 2HG2 ILE 87 4.974 31.899 -7.213 623 HG23 ILE 87 3HG2 ILE 87 3.433 32.628 -6.763 624 HD11 ILE 87 3HD1 ILE 87 2.013 28.960 -5.553 625 HD12 ILE 87 1HD1 ILE 87 1.225 29.218 -7.109 626 HD13 ILE 87 2HD1 ILE 87 2.390 27.908 -6.916 627 HA PRO 88 HA PRO 88 7.146 31.785 -2.081 628 HB2 PRO 88 1HB PRO 88 8.716 33.684 -3.221 629 HB3 PRO 88 2HB PRO 88 9.183 31.982 -3.126 630 HG2 PRO 88 1HG PRO 88 8.006 33.498 -5.423 631 HG3 PRO 88 2HG PRO 88 9.326 32.314 -5.423 632 HD2 PRO 88 1HD PRO 88 6.801 31.679 -6.164 633 HD3 PRO 88 2HD PRO 88 7.884 30.517 -5.371 634 HA PRO 89 HA PRO 89 4.787 35.416 -1.320 635 HB2 PRO 89 1HB PRO 89 6.474 36.973 0.129 636 HB3 PRO 89 2HB PRO 89 5.730 35.505 0.773 637 HG2 PRO 89 1HG PRO 89 8.480 35.903 -0.340 638 HG3 PRO 89 2HG PRO 89 7.976 34.998 1.099 639 HD2 PRO 89 1HD PRO 89 8.548 33.789 -1.256 640 HD3 PRO 89 2HD PRO 89 7.328 33.159 -0.131 641 H GLN 90 H GLN 90 7.508 35.553 -3.292 642 HA GLN 90 HA GLN 90 7.175 38.399 -3.896 643 HB2 GLN 90 1HB GLN 90 9.213 37.963 -5.380 644 HB3 GLN 90 2HB GLN 90 9.455 37.892 -3.639 645 HG2 GLN 90 1HG GLN 90 9.437 35.493 -3.678 646 HG3 GLN 90 2HG GLN 90 9.017 35.486 -5.390 647 HE21 GLN 90 2HE2 GLN 90 10.761 34.499 -6.226 648 HE22 GLN 90 1HE2 GLN 90 12.377 35.098 -6.112 649 H LEU 91 H LEU 91 7.093 35.216 -5.444 650 HA LEU 91 HA LEU 91 6.090 36.390 -7.916 651 HB2 LEU 91 1HB LEU 91 6.546 33.481 -7.292 652 HB3 LEU 91 2HB LEU 91 6.348 34.218 -8.881 653 HG LEU 91 HG LEU 91 8.718 34.427 -7.034 654 HD11 LEU 91 1HD1 LEU 91 8.517 32.396 -8.428 655 HD12 LEU 91 2HD1 LEU 91 9.914 33.387 -8.847 656 HD13 LEU 91 3HD1 LEU 91 8.474 33.419 -9.864 657 HD21 LEU 91 3HD2 LEU 91 7.791 36.235 -9.144 658 HD22 LEU 91 1HD2 LEU 91 9.455 35.683 -9.336 659 HD23 LEU 91 2HD2 LEU 91 8.963 36.499 -7.852 660 H GLY 92 H GLY 92 4.617 36.072 -5.213 661 HA2 GLY 92 1HA GLY 92 2.232 34.721 -6.318 662 HA3 GLY 92 2HA GLY 92 2.629 34.751 -4.606 663 H TYR 93 H TYR 93 2.363 36.700 -3.431 664 HA TYR 93 HA TYR 93 0.414 38.513 -4.677 665 HB2 TYR 93 1HB TYR 93 0.942 37.821 -1.785 666 HB3 TYR 93 2HB TYR 93 -0.131 39.124 -2.285 667 HD1 TYR 93 HD2 TYR 93 -1.565 37.975 -4.543 668 HD2 TYR 93 HD1 TYR 93 -0.398 36.161 -0.875 669 HE1 TYR 93 HE2 TYR 93 -3.420 36.373 -4.752 670 HE2 TYR 93 HE1 TYR 93 -2.249 34.553 -1.075 671 HH TYR 93 HH TYR 93 -4.448 34.621 -3.866 672 H GLY 94 H GLY 94 3.569 38.336 -3.301 673 HA2 GLY 94 1HA GLY 94 5.084 40.158 -3.966 674 HA3 GLY 94 2HA GLY 94 3.796 41.274 -3.536 675 H ALA 95 H ALA 95 6.102 41.857 -2.433 676 HA ALA 95 HA ALA 95 6.867 40.568 -0.082 677 HB1 ALA 95 1HB ALA 95 8.453 42.090 -0.521 678 HB2 ALA 95 2HB ALA 95 7.320 43.193 -1.303 679 HB3 ALA 95 3HB ALA 95 7.457 43.170 0.455 680 H ARG 96 H ARG 96 4.271 42.828 -0.704 681 HA ARG 96 HA ARG 96 3.703 43.267 2.090 682 HB2 ARG 96 1HB ARG 96 2.439 44.117 -0.491 683 HB3 ARG 96 2HB ARG 96 1.551 44.292 1.017 684 HG2 ARG 96 1HG ARG 96 2.543 46.349 0.824 685 HG3 ARG 96 2HG ARG 96 3.714 45.493 1.829 686 HD2 ARG 96 1HD ARG 96 4.134 45.211 -1.061 687 HD3 ARG 96 2HD ARG 96 4.316 46.854 -0.449 688 HE ARG 96 HE ARG 96 6.103 44.672 -0.046 689 HH11 ARG 96 1HH1 ARG 96 4.847 47.566 1.425 690 HH12 ARG 96 2HH1 ARG 96 6.247 47.829 2.411 691 HH21 ARG 96 1HH2 ARG 96 7.951 45.006 1.247 692 HH22 ARG 96 2HH2 ARG 96 8.013 46.372 2.309 693 H GLY 97 H GLY 97 2.624 41.139 -0.455 694 HA2 GLY 97 1HA GLY 97 1.563 39.072 -0.092 695 HA3 GLY 97 2HA GLY 97 1.096 39.618 1.512 696 H ALA 98 H ALA 98 -0.917 38.486 0.571 697 HA ALA 98 HA ALA 98 -2.511 39.554 -1.408 698 HB1 ALA 98 1HB ALA 98 -4.303 38.792 0.580 699 HB2 ALA 98 2HB ALA 98 -3.675 37.787 -0.726 700 HB3 ALA 98 3HB ALA 98 -2.877 37.789 0.846 701 H GLY 99 H GLY 99 -4.474 40.872 -1.241 702 HA2 GLY 99 1HA GLY 99 -3.919 43.335 0.133 703 HA3 GLY 99 2HA GLY 99 -5.305 43.002 -0.895 704 H GLY 100 H GLY 100 -4.037 41.817 2.228 705 HA2 GLY 100 1HA GLY 100 -5.631 42.753 4.085 706 HA3 GLY 100 2HA GLY 100 -6.789 41.740 3.235 707 H VAL 101 H VAL 101 -5.188 39.551 2.622 708 HA VAL 101 HA VAL 101 -4.579 38.507 5.311 709 HB VAL 101 HB VAL 101 -5.140 36.256 4.378 710 HG11 VAL 101 1HG1 VAL 101 -7.638 36.695 4.317 711 HG12 VAL 101 2HG1 VAL 101 -6.776 37.262 5.749 712 HG13 VAL 101 3HG1 VAL 101 -7.241 38.404 4.488 713 HG21 VAL 101 3HG2 VAL 101 -6.646 37.540 2.166 714 HG22 VAL 101 1HG2 VAL 101 -4.909 37.314 1.955 715 HG23 VAL 101 2HG2 VAL 101 -5.948 35.924 2.273 716 H ILE 102 H ILE 102 -3.269 36.278 4.902 717 HA ILE 102 HA ILE 102 -1.273 35.331 4.351 718 HB ILE 102 HB ILE 102 -1.249 37.143 1.939 719 HG12 ILE 102 1HG1 ILE 102 -3.374 35.856 2.125 720 HG13 ILE 102 2HG1 ILE 102 -2.408 35.398 0.727 721 HG21 ILE 102 1HG2 ILE 102 0.869 36.063 2.360 722 HG22 ILE 102 2HG2 ILE 102 0.074 34.497 2.513 723 HG23 ILE 102 3HG2 ILE 102 0.100 35.324 0.956 724 HD11 ILE 102 3HD1 ILE 102 -2.481 33.889 3.328 725 HD12 ILE 102 1HD1 ILE 102 -3.419 33.480 1.892 726 HD13 ILE 102 2HD1 ILE 102 -1.657 33.407 1.846 727 HA PRO 103 HA PRO 103 1.506 38.206 6.251 728 HB2 PRO 103 1HB PRO 103 3.663 36.562 6.363 729 HB3 PRO 103 2HB PRO 103 2.281 36.409 7.455 730 HG2 PRO 103 1HG PRO 103 2.918 34.856 4.976 731 HG3 PRO 103 2HG PRO 103 2.311 34.273 6.536 732 HD2 PRO 103 1HD PRO 103 0.699 34.644 4.392 733 HD3 PRO 103 2HD PRO 103 0.139 34.880 6.060 734 HA PRO 104 HA PRO 104 4.050 39.987 3.138 735 HB2 PRO 104 1HB PRO 104 6.254 40.752 4.526 736 HB3 PRO 104 2HB PRO 104 4.691 41.562 4.682 737 HG2 PRO 104 1HG PRO 104 5.944 39.502 6.457 738 HG3 PRO 104 2HG PRO 104 5.071 40.981 6.902 739 HD2 PRO 104 1HD PRO 104 3.917 38.532 6.967 740 HD3 PRO 104 2HD PRO 104 3.006 40.007 6.584 741 H ASN 105 H ASN 105 6.006 37.930 5.303 742 HA ASN 105 HA ASN 105 7.406 36.914 2.917 743 HB2 ASN 105 1HB ASN 105 8.450 37.263 5.736 744 HB3 ASN 105 2HB ASN 105 9.328 36.450 4.444 745 HD21 ASN 105 2HD2 ASN 105 8.538 39.417 5.884 746 HD22 ASN 105 1HD2 ASN 105 9.340 40.451 4.757 747 H ALA 106 H ALA 106 6.568 34.985 2.444 748 HA ALA 106 HA ALA 106 6.911 32.759 4.117 749 HB1 ALA 106 1HB ALA 106 4.787 34.153 5.013 750 HB2 ALA 106 2HB ALA 106 3.997 33.095 3.843 751 HB3 ALA 106 3HB ALA 106 4.944 32.402 5.159 752 H THR 107 H THR 107 6.319 30.787 3.108 753 HA THR 107 HA THR 107 6.117 31.012 0.226 754 HB THR 107 HB THR 107 6.475 28.594 2.006 755 HG1 THR 107 HG1 THR 107 8.365 29.701 1.995 756 HG21 THR 107 3HG2 THR 107 7.304 27.828 -0.466 757 HG22 THR 107 1HG2 THR 107 5.930 28.855 -0.873 758 HG23 THR 107 2HG2 THR 107 5.712 27.475 0.203 759 H LEU 108 H LEU 108 4.322 30.737 -0.929 760 HA LEU 108 HA LEU 108 1.893 29.874 0.452 761 HB2 LEU 108 1HB LEU 108 2.341 31.264 -2.181 762 HB3 LEU 108 2HB LEU 108 0.759 30.735 -1.612 763 HG LEU 108 HG LEU 108 2.329 32.530 0.159 764 HD11 LEU 108 1HD1 LEU 108 0.795 33.601 -2.197 765 HD12 LEU 108 2HD1 LEU 108 2.551 33.449 -2.167 766 HD13 LEU 108 3HD1 LEU 108 1.738 34.506 -1.013 767 HD21 LEU 108 3HD2 LEU 108 0.363 32.675 1.179 768 HD22 LEU 108 1HD2 LEU 108 -0.279 31.497 0.034 769 HD23 LEU 108 2HD2 LEU 108 -0.414 33.222 -0.307 770 H VAL 109 H VAL 109 1.031 27.933 0.136 771 HA VAL 109 HA VAL 109 2.115 26.252 -2.009 772 HB VAL 109 HB VAL 109 0.539 25.504 0.457 773 HG11 VAL 109 1HG1 VAL 109 1.199 24.014 -1.982 774 HG12 VAL 109 2HG1 VAL 109 1.608 23.187 -0.477 775 HG13 VAL 109 3HG1 VAL 109 -0.048 23.718 -0.771 776 HG21 VAL 109 3HG2 VAL 109 2.547 24.683 1.361 777 HG22 VAL 109 1HG2 VAL 109 3.380 24.775 -0.191 778 HG23 VAL 109 2HG2 VAL 109 2.968 26.253 0.678 779 H PHE 110 H PHE 110 0.974 26.226 -3.825 780 HA PHE 110 HA PHE 110 -1.966 26.303 -3.637 781 HB2 PHE 110 1HB PHE 110 -0.087 27.464 -5.680 782 HB3 PHE 110 2HB PHE 110 -1.774 27.143 -6.073 783 HD1 PHE 110 HD1 PHE 110 -3.565 28.387 -4.964 784 HD2 PHE 110 HD2 PHE 110 0.537 29.273 -4.252 785 HE1 PHE 110 HE1 PHE 110 -4.206 30.550 -3.984 786 HE2 PHE 110 HE2 PHE 110 -0.098 31.437 -3.270 787 HZ PHE 110 HZ PHE 110 -2.472 32.079 -3.134 788 H GLU 111 H GLU 111 -3.099 24.678 -4.525 789 HA GLU 111 HA GLU 111 -1.576 22.566 -5.885 790 HB2 GLU 111 1HB GLU 111 -2.986 22.181 -3.729 791 HB3 GLU 111 2HB GLU 111 -4.361 22.221 -4.824 792 HG2 GLU 111 1HG GLU 111 -2.060 20.428 -5.428 793 HG3 GLU 111 2HG GLU 111 -3.232 19.961 -4.197 794 H VAL 112 H VAL 112 -1.887 22.187 -7.976 795 HA VAL 112 HA VAL 112 -4.231 23.409 -9.279 796 HB VAL 112 HB VAL 112 -1.550 22.714 -10.488 797 HG11 VAL 112 1HG1 VAL 112 -4.004 23.989 -11.689 798 HG12 VAL 112 2HG1 VAL 112 -2.420 23.946 -12.465 799 HG13 VAL 112 3HG1 VAL 112 -3.281 22.443 -12.132 800 HG21 VAL 112 3HG2 VAL 112 -2.792 25.360 -9.749 801 HG22 VAL 112 1HG2 VAL 112 -1.341 24.631 -9.060 802 HG23 VAL 112 2HG2 VAL 112 -1.341 25.184 -10.735 803 H GLU 113 H GLU 113 -5.673 22.121 -10.228 804 HA GLU 113 HA GLU 113 -4.891 19.341 -10.814 805 HB2 GLU 113 1HB GLU 113 -6.291 19.209 -8.902 806 HB3 GLU 113 2HB GLU 113 -7.421 20.387 -9.555 807 HG2 GLU 113 1HG GLU 113 -8.429 18.868 -10.933 808 HG3 GLU 113 2HG GLU 113 -6.994 17.852 -11.046 809 H LEU 114 H LEU 114 -4.683 19.370 -12.980 810 HA LEU 114 HA LEU 114 -6.222 20.955 -14.737 811 HB2 LEU 114 1HB LEU 114 -4.200 18.847 -14.952 812 HB3 LEU 114 2HB LEU 114 -5.341 18.891 -16.294 813 HG LEU 114 HG LEU 114 -3.227 20.158 -16.678 814 HD11 LEU 114 1HD1 LEU 114 -4.747 22.400 -17.076 815 HD12 LEU 114 2HD1 LEU 114 -5.960 21.121 -17.010 816 HD13 LEU 114 3HD1 LEU 114 -4.639 21.024 -18.175 817 HD21 LEU 114 3HD2 LEU 114 -4.354 21.916 -14.503 818 HD22 LEU 114 1HD2 LEU 114 -3.040 22.376 -15.586 819 HD23 LEU 114 2HD2 LEU 114 -2.831 21.026 -14.470 820 H LEU 115 H LEU 115 -8.237 20.702 -15.421 821 HA LEU 115 HA LEU 115 -9.540 18.100 -15.033 822 HB2 LEU 115 1HB LEU 115 -10.647 20.881 -15.348 823 HB3 LEU 115 2HB LEU 115 -11.652 19.433 -15.344 824 HG LEU 115 HG LEU 115 -9.945 19.526 -13.013 825 HD11 LEU 115 1HD1 LEU 115 -9.972 21.739 -12.661 826 HD12 LEU 115 2HD1 LEU 115 -11.646 21.469 -12.178 827 HD13 LEU 115 3HD1 LEU 115 -11.277 22.011 -13.815 828 HD21 LEU 115 3HD2 LEU 115 -11.841 18.802 -11.947 829 HD22 LEU 115 1HD2 LEU 115 -12.190 18.299 -13.601 830 HD23 LEU 115 2HD2 LEU 115 -12.914 19.773 -12.958 831 H ASP 116 H ASP 116 -9.288 20.744 -17.397 832 HA ASP 116 HA ASP 116 -9.158 18.929 -19.590 833 HB2 ASP 116 1HB ASP 116 -11.680 19.131 -18.866 834 HB3 ASP 116 2HB ASP 116 -11.591 20.667 -19.723 835 H VAL 117 H VAL 117 -9.270 20.177 -21.726 836 HA VAL 117 HA VAL 117 -7.872 22.730 -21.332 837 HB VAL 117 HB VAL 117 -7.915 20.909 -23.743 838 HG11 VAL 117 1HG1 VAL 117 -5.999 22.409 -24.465 839 HG12 VAL 117 2HG1 VAL 117 -7.620 23.100 -24.562 840 HG13 VAL 117 3HG1 VAL 117 -6.553 23.539 -23.229 841 HG21 VAL 117 3HG2 VAL 117 -6.179 19.833 -22.861 842 HG22 VAL 117 1HG2 VAL 117 -5.339 21.350 -22.538 843 HG23 VAL 117 2HG2 VAL 117 -6.474 20.701 -21.354 844 H11 L2S 130 1H1 L2S 130 -4.614 31.505 -9.496 845 H21 L2S 130 2H1 L2S 130 -4.879 32.197 -11.168 846 H12 L2S 130 1H2 L2S 130 -4.902 34.415 -10.262 847 H22 L2S 130 2H2 L2S 130 -3.331 33.579 -9.835 848 H13 L2S 130 2H3 L2S 130 -4.197 33.142 -7.628 849 H23 L2S 130 1H3 L2S 130 -4.360 34.929 -7.963 850 H14 L2S 130 1H4 L2S 130 -6.586 31.755 -7.811 851 H24 L2S 130 2H4 L2S 130 -7.945 32.845 -8.353 852 H15 L2S 130 1H5 L2S 130 -6.987 31.379 -10.164 853 H25 L2S 130 2H5 L2S 130 -6.945 33.186 -10.453 854 H17 L2S 130 1H7 L2S 130 -8.710 34.561 -7.697 855 H27 L2S 130 2H7 L2S 130 -8.431 33.832 -6.027 856 H9 L2S 130 H9 L2S 130 -6.784 37.755 -4.732 857 H10 L2S 130 H10 L2S 130 -5.724 37.550 -2.483 858 H112 L2S 130 1H12 L2S 130 -8.589 34.424 -1.428 859 H113 L2S 130 1H13 L2S 130 -9.601 34.608 -3.693 860 H114 L2S 130 1H14 L2S 130 -6.361 36.850 -0.129 861 H214 L2S 130 2H14 L2S 130 -5.538 35.360 -0.653 862 H314 L2S 130 3H14 L2S 130 -7.190 35.264 0.048 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -1.893 5.549 -4.439 2 HA2 GLY 1 1HA GLY 1 -1.487 6.060 -2.204 3 HA3 GLY 1 2HA GLY 1 -0.163 4.905 -2.207 4 HA PRO 2 HA PRO 2 1.546 9.051 -4.060 5 HB2 PRO 2 1HB PRO 2 -0.012 11.242 -3.681 6 HB3 PRO 2 2HB PRO 2 -0.121 10.223 -5.121 7 HG2 PRO 2 1HG PRO 2 -1.848 10.237 -2.676 8 HG3 PRO 2 2HG PRO 2 -2.322 10.114 -4.380 9 HD2 PRO 2 1HD PRO 2 -2.180 7.958 -2.749 10 HD3 PRO 2 2HD PRO 2 -1.828 7.865 -4.486 11 H GLY 3 H GLY 3 2.204 11.245 -2.989 12 HA2 GLY 3 1HA GLY 3 1.733 11.855 -0.334 13 HA3 GLY 3 2HA GLY 3 3.010 10.648 -0.324 14 H SER 4 H SER 4 2.740 13.703 0.181 15 HA SER 4 HA SER 4 4.620 14.801 -1.718 16 HB2 SER 4 1HB SER 4 4.480 16.814 -0.128 17 HB3 SER 4 2HB SER 4 3.002 16.355 -0.975 18 HG SER 4 HG SER 4 3.558 16.345 1.701 19 H MET 5 H MET 5 6.482 13.552 -1.432 20 HA MET 5 HA MET 5 7.823 13.829 1.173 21 HB2 MET 5 1HB MET 5 7.362 11.514 0.137 22 HB3 MET 5 2HB MET 5 8.648 11.912 -0.994 23 HG2 MET 5 1HG MET 5 10.237 12.103 0.790 24 HG3 MET 5 2HG MET 5 8.968 11.907 1.996 25 HE1 MET 5 3HE MET 5 10.571 10.382 3.042 26 HE2 MET 5 1HE MET 5 10.623 8.648 2.721 27 HE3 MET 5 2HE MET 5 11.732 9.733 1.882 28 H THR 6 H THR 6 8.882 13.423 -2.209 29 HA THR 6 HA THR 6 11.006 15.382 -1.704 30 HB THR 6 HB THR 6 10.750 13.571 -4.106 31 HG1 THR 6 HG1 THR 6 11.819 13.113 -1.536 32 HG21 THR 6 3HG2 THR 6 13.382 13.991 -3.760 33 HG22 THR 6 1HG2 THR 6 12.754 15.501 -3.102 34 HG23 THR 6 2HG2 THR 6 12.363 15.030 -4.756 35 H VAL 7 H VAL 7 10.459 17.402 -2.209 36 HA VAL 7 HA VAL 7 8.719 17.877 -4.526 37 HB VAL 7 HB VAL 7 9.505 19.798 -2.330 38 HG11 VAL 7 1HG1 VAL 7 7.793 20.023 -4.762 39 HG12 VAL 7 2HG1 VAL 7 7.369 20.943 -3.317 40 HG13 VAL 7 3HG1 VAL 7 8.941 21.176 -4.083 41 HG21 VAL 7 3HG2 VAL 7 7.569 17.682 -2.380 42 HG22 VAL 7 1HG2 VAL 7 7.979 18.788 -1.069 43 HG23 VAL 7 2HG2 VAL 7 6.752 19.240 -2.252 44 H VAL 8 H VAL 8 9.567 18.605 -6.356 45 HA VAL 8 HA VAL 8 12.352 19.327 -6.498 46 HB VAL 8 HB VAL 8 11.357 17.997 -8.286 47 HG11 VAL 8 1HG1 VAL 8 9.762 19.016 -9.860 48 HG12 VAL 8 2HG1 VAL 8 9.096 18.870 -8.233 49 HG13 VAL 8 3HG1 VAL 8 9.663 20.435 -8.817 50 HG21 VAL 8 3HG2 VAL 8 12.467 19.021 -10.042 51 HG22 VAL 8 1HG2 VAL 8 11.971 20.639 -9.545 52 HG23 VAL 8 2HG2 VAL 8 13.214 19.780 -8.637 53 H THR 9 H THR 9 13.217 21.306 -7.105 54 HA THR 9 HA THR 9 11.371 23.595 -7.157 55 HB THR 9 HB THR 9 13.942 23.448 -5.571 56 HG1 THR 9 HG1 THR 9 12.594 22.795 -4.081 57 HG21 THR 9 3HG2 THR 9 14.003 25.655 -6.066 58 HG22 THR 9 1HG2 THR 9 12.767 25.759 -4.813 59 HG23 THR 9 2HG2 THR 9 12.299 25.711 -6.513 60 H THR 10 H THR 10 11.971 25.309 -8.455 61 HA THR 10 HA THR 10 14.073 24.710 -10.394 62 HB THR 10 HB THR 10 13.087 26.456 -11.778 63 HG1 THR 10 HG1 THR 10 11.626 26.966 -9.423 64 HG21 THR 10 3HG2 THR 10 12.119 24.177 -11.836 65 HG22 THR 10 1HG2 THR 10 10.940 25.428 -12.230 66 HG23 THR 10 2HG2 THR 10 10.931 24.678 -10.633 67 H GLU 11 H GLU 11 15.015 26.944 -11.321 68 HA GLU 11 HA GLU 11 16.578 28.012 -9.145 69 HB2 GLU 11 1HB GLU 11 17.879 29.117 -10.854 70 HB3 GLU 11 2HB GLU 11 17.584 27.454 -11.342 71 HG2 GLU 11 1HG GLU 11 17.179 28.559 -13.297 72 HG3 GLU 11 2HG GLU 11 15.556 28.490 -12.614 73 H SER 12 H SER 12 14.031 29.121 -11.291 74 HA SER 12 HA SER 12 14.179 31.868 -10.716 75 HB2 SER 12 1HB SER 12 12.136 30.041 -11.868 76 HB3 SER 12 2HB SER 12 11.568 31.601 -11.273 77 HG SER 12 HG SER 12 13.123 32.591 -12.632 78 H GLY 13 H GLY 13 12.824 29.188 -8.961 79 HA2 GLY 13 1HA GLY 13 12.717 29.704 -6.497 80 HA3 GLY 13 2HA GLY 13 11.729 31.078 -6.971 81 H LEU 14 H LEU 14 10.130 29.873 -8.916 82 HA LEU 14 HA LEU 14 8.032 28.862 -7.436 83 HB2 LEU 14 1HB LEU 14 7.540 29.651 -9.582 84 HB3 LEU 14 2HB LEU 14 8.754 28.619 -10.335 85 HG LEU 14 HG LEU 14 7.315 26.652 -9.785 86 HD11 LEU 14 1HD1 LEU 14 6.000 28.426 -8.137 87 HD12 LEU 14 2HD1 LEU 14 5.439 26.818 -8.597 88 HD13 LEU 14 3HD1 LEU 14 4.895 28.233 -9.499 89 HD21 LEU 14 3HD2 LEU 14 6.996 27.090 -11.972 90 HD22 LEU 14 1HD2 LEU 14 6.685 28.804 -11.693 91 HD23 LEU 14 2HD2 LEU 14 5.405 27.621 -11.427 92 H LYS 15 H LYS 15 7.200 26.805 -7.052 93 HA LYS 15 HA LYS 15 8.953 24.527 -7.651 94 HB2 LYS 15 1HB LYS 15 7.656 24.854 -4.952 95 HB3 LYS 15 2HB LYS 15 8.909 23.714 -5.427 96 HG2 LYS 15 1HG LYS 15 10.432 25.679 -5.763 97 HG3 LYS 15 2HG LYS 15 9.182 26.681 -5.023 98 HD2 LYS 15 1HD LYS 15 10.187 24.228 -3.630 99 HD3 LYS 15 2HD LYS 15 11.092 25.741 -3.543 100 HE2 LYS 15 1HE LYS 15 8.824 26.778 -2.859 101 HE3 LYS 15 2HE LYS 15 8.346 25.116 -2.519 102 HZ1 LYS 15 3HZ LYS 15 9.579 25.069 -0.676 103 HZ2 LYS 15 1HZ LYS 15 9.620 26.757 -0.793 104 HZ3 LYS 15 2HZ LYS 15 10.899 25.835 -1.405 105 H TYR 16 H TYR 16 7.877 22.441 -7.471 106 HA TYR 16 HA TYR 16 4.991 22.410 -7.287 107 HB2 TYR 16 1HB TYR 16 4.860 21.260 -9.585 108 HB3 TYR 16 2HB TYR 16 5.030 23.012 -9.557 109 HD1 TYR 16 HD2 TYR 16 6.761 19.836 -10.234 110 HD2 TYR 16 HD1 TYR 16 7.009 24.080 -10.398 111 HE1 TYR 16 HE2 TYR 16 8.753 19.658 -11.666 112 HE2 TYR 16 HE1 TYR 16 9.001 23.914 -11.832 113 HH TYR 16 HH TYR 16 10.111 20.830 -13.084 114 H GLU 17 H GLU 17 4.184 20.410 -6.793 115 HA GLU 17 HA GLU 17 6.111 18.184 -6.718 116 HB2 GLU 17 1HB GLU 17 5.871 18.936 -4.461 117 HB3 GLU 17 2HB GLU 17 4.122 19.028 -4.613 118 HG2 GLU 17 1HG GLU 17 5.083 17.066 -3.322 119 HG3 GLU 17 2HG GLU 17 3.873 16.710 -4.553 120 H ASP 18 H ASP 18 5.467 16.435 -7.778 121 HA ASP 18 HA ASP 18 2.940 16.300 -9.056 122 HB2 ASP 18 1HB ASP 18 3.703 13.919 -9.595 123 HB3 ASP 18 2HB ASP 18 4.724 15.232 -10.175 124 H LEU 19 H LEU 19 1.061 15.520 -8.359 125 HA LEU 19 HA LEU 19 1.062 13.862 -5.922 126 HB2 LEU 19 1HB LEU 19 -0.602 16.156 -6.774 127 HB3 LEU 19 2HB LEU 19 -1.427 14.845 -5.934 128 HG LEU 19 HG LEU 19 1.024 16.072 -4.737 129 HD11 LEU 19 1HD1 LEU 19 -0.551 17.601 -3.495 130 HD12 LEU 19 2HD1 LEU 19 -1.755 17.222 -4.726 131 HD13 LEU 19 3HD1 LEU 19 -0.247 18.015 -5.183 132 HD21 LEU 19 3HD2 LEU 19 -0.981 14.161 -3.982 133 HD22 LEU 19 1HD2 LEU 19 -0.974 15.515 -2.852 134 HD23 LEU 19 2HD2 LEU 19 0.509 14.608 -3.150 135 H THR 20 H THR 20 -0.313 14.372 -9.108 136 HA THR 20 HA THR 20 -1.165 11.583 -9.154 137 HB THR 20 HB THR 20 -3.090 13.677 -10.130 138 HG1 THR 20 HG1 THR 20 -3.111 12.435 -7.563 139 HG21 THR 20 3HG2 THR 20 -3.706 11.626 -11.012 140 HG22 THR 20 1HG2 THR 20 -4.649 11.675 -9.523 141 HG23 THR 20 2HG2 THR 20 -3.158 10.734 -9.593 142 H GLU 21 H GLU 21 -0.273 10.734 -10.908 143 HA GLU 21 HA GLU 21 0.870 12.212 -12.996 144 HB2 GLU 21 1HB GLU 21 1.518 9.897 -12.400 145 HB3 GLU 21 2HB GLU 21 -0.014 9.321 -13.040 146 HG2 GLU 21 1HG GLU 21 0.749 10.490 -15.224 147 HG3 GLU 21 2HG GLU 21 2.352 10.410 -14.496 148 H GLY 22 H GLY 22 0.060 13.097 -14.788 149 HA2 GLY 22 1HA GLY 22 -2.742 12.468 -15.472 150 HA3 GLY 22 2HA GLY 22 -1.967 14.019 -15.765 151 H SER 23 H SER 23 -2.844 11.076 -17.112 152 HA SER 23 HA SER 23 -0.903 11.336 -19.304 153 HB2 SER 23 1HB SER 23 -2.729 9.029 -18.583 154 HB3 SER 23 2HB SER 23 -1.595 9.044 -19.934 155 HG SER 23 HG SER 23 -0.567 8.056 -18.245 156 H GLY 24 H GLY 24 -2.243 13.272 -19.921 157 HA2 GLY 24 1HA GLY 24 -4.380 12.384 -21.748 158 HA3 GLY 24 2HA GLY 24 -4.631 13.773 -20.701 159 H ALA 25 H ALA 25 -3.178 15.621 -20.987 160 HA ALA 25 HA ALA 25 -1.528 15.831 -23.297 161 HB1 ALA 25 1HB ALA 25 -3.749 17.702 -23.672 162 HB2 ALA 25 2HB ALA 25 -2.865 16.735 -24.853 163 HB3 ALA 25 3HB ALA 25 -4.175 16.009 -23.921 164 H GLU 26 H GLU 26 -0.107 17.440 -23.004 165 HA GLU 26 HA GLU 26 -0.079 18.935 -20.623 166 HB2 GLU 26 1HB GLU 26 1.979 18.392 -21.775 167 HB3 GLU 26 2HB GLU 26 1.472 19.304 -23.189 168 HG2 GLU 26 1HG GLU 26 1.568 21.370 -21.917 169 HG3 GLU 26 2HG GLU 26 2.024 20.472 -20.470 170 H ALA 27 H ALA 27 -0.812 20.910 -20.099 171 HA ALA 27 HA ALA 27 -2.846 22.160 -21.487 172 HB1 ALA 27 1HB ALA 27 -1.529 22.560 -19.072 173 HB2 ALA 27 2HB ALA 27 -1.331 24.080 -19.947 174 HB3 ALA 27 3HB ALA 27 -2.946 23.429 -19.663 175 H ARG 28 H ARG 28 -2.850 23.158 -23.382 176 HA ARG 28 HA ARG 28 -0.427 24.037 -24.637 177 HB2 ARG 28 1HB ARG 28 -3.333 24.150 -25.427 178 HB3 ARG 28 2HB ARG 28 -2.068 24.874 -26.412 179 HG2 ARG 28 1HG ARG 28 -1.831 22.019 -25.587 180 HG3 ARG 28 2HG ARG 28 -2.909 22.463 -26.911 181 HD2 ARG 28 1HD ARG 28 -1.029 23.570 -28.044 182 HD3 ARG 28 2HD ARG 28 0.038 23.078 -26.731 183 HE ARG 28 HE ARG 28 -1.295 20.844 -27.875 184 HH11 ARG 28 1HH1 ARG 28 1.320 23.082 -28.394 185 HH12 ARG 28 2HH1 ARG 28 2.238 21.985 -29.371 186 HH21 ARG 28 1HH2 ARG 28 -0.095 19.390 -29.160 187 HH22 ARG 28 2HH2 ARG 28 1.432 19.886 -29.807 188 H ALA 29 H ALA 29 -0.154 26.220 -25.534 189 HA ALA 29 HA ALA 29 -0.965 28.232 -23.563 190 HB1 ALA 29 1HB ALA 29 1.438 27.743 -25.091 191 HB2 ALA 29 2HB ALA 29 0.877 29.404 -25.281 192 HB3 ALA 29 3HB ALA 29 1.193 28.759 -23.671 193 H GLY 30 H GLY 30 -1.868 30.214 -24.168 194 HA2 GLY 30 1HA GLY 30 -2.987 31.728 -25.511 195 HA3 GLY 30 2HA GLY 30 -2.437 30.828 -26.916 196 H GLN 31 H GLN 31 -3.836 28.668 -24.837 197 HA GLN 31 HA GLN 31 -6.445 28.923 -26.183 198 HB2 GLN 31 1HB GLN 31 -4.724 26.550 -25.620 199 HB3 GLN 31 2HB GLN 31 -6.470 26.340 -25.613 200 HG2 GLN 31 1HG GLN 31 -6.579 27.233 -27.891 201 HG3 GLN 31 2HG GLN 31 -4.824 27.404 -27.896 202 HE21 GLN 31 2HE2 GLN 31 -3.534 25.568 -28.007 203 HE22 GLN 31 1HE2 GLN 31 -4.160 24.033 -28.490 204 H THR 32 H THR 32 -8.313 28.297 -25.000 205 HA THR 32 HA THR 32 -8.159 28.999 -22.213 206 HB THR 32 HB THR 32 -10.594 28.002 -23.694 207 HG1 THR 32 HG1 THR 32 -9.833 29.773 -24.836 208 HG21 THR 32 3HG2 THR 32 -10.778 28.112 -21.245 209 HG22 THR 32 1HG2 THR 32 -11.815 29.302 -22.029 210 HG23 THR 32 2HG2 THR 32 -10.295 29.807 -21.290 211 H VAL 33 H VAL 33 -7.638 27.585 -20.688 212 HA VAL 33 HA VAL 33 -8.456 24.774 -21.032 213 HB VAL 33 HB VAL 33 -6.573 24.098 -19.689 214 HG11 VAL 33 1HG1 VAL 33 -6.391 25.149 -22.229 215 HG12 VAL 33 2HG1 VAL 33 -5.048 25.912 -21.376 216 HG13 VAL 33 3HG1 VAL 33 -5.175 24.153 -21.429 217 HG21 VAL 33 3HG2 VAL 33 -6.599 26.852 -18.874 218 HG22 VAL 33 1HG2 VAL 33 -5.762 25.479 -18.149 219 HG23 VAL 33 2HG2 VAL 33 -4.991 26.400 -19.441 220 H SER 34 H SER 34 -9.329 23.673 -19.279 221 HA SER 34 HA SER 34 -10.284 25.405 -17.099 222 HB2 SER 34 1HB SER 34 -11.522 22.752 -17.762 223 HB3 SER 34 2HB SER 34 -12.257 24.164 -17.002 224 HG SER 34 HG SER 34 -11.697 23.690 -19.717 225 H VAL 35 H VAL 35 -9.372 25.105 -15.188 226 HA VAL 35 HA VAL 35 -8.698 22.402 -14.310 227 HB VAL 35 HB VAL 35 -6.475 22.837 -13.739 228 HG11 VAL 35 1HG1 VAL 35 -5.398 23.566 -15.793 229 HG12 VAL 35 2HG1 VAL 35 -6.795 22.551 -16.157 230 HG13 VAL 35 3HG1 VAL 35 -6.903 24.302 -16.341 231 HG21 VAL 35 3HG2 VAL 35 -6.242 24.824 -12.684 232 HG22 VAL 35 1HG2 VAL 35 -5.672 25.345 -14.270 233 HG23 VAL 35 2HG2 VAL 35 -7.338 25.660 -13.785 234 H HIS 36 H HIS 36 -8.247 22.293 -11.981 235 HA HIS 36 HA HIS 36 -9.826 24.305 -10.539 236 HB2 HIS 36 1HB HIS 36 -9.447 21.398 -10.273 237 HB3 HIS 36 2HB HIS 36 -9.438 22.277 -8.747 238 HD1 HIS 36 HD1 HIS 36 -11.602 24.392 -9.421 239 HD2 HIS 36 HD2 HIS 36 -11.955 20.323 -10.183 240 HE1 HIS 36 HE1 HIS 36 -14.074 23.943 -9.545 241 H TYR 37 H TYR 37 -8.933 25.587 -9.041 242 HA TYR 37 HA TYR 37 -6.145 25.040 -8.255 243 HB2 TYR 37 1HB TYR 37 -5.728 27.409 -8.197 244 HB3 TYR 37 2HB TYR 37 -6.438 27.018 -9.759 245 HD1 TYR 37 HD2 TYR 37 -7.130 28.516 -6.450 246 HD2 TYR 37 HD1 TYR 37 -8.505 27.970 -10.440 247 HE1 TYR 37 HE2 TYR 37 -8.868 30.215 -6.077 248 HE2 TYR 37 HE1 TYR 37 -10.246 29.669 -10.078 249 HH TYR 37 HH TYR 37 -11.406 30.583 -7.452 250 H THR 38 H THR 38 -5.536 25.466 -6.127 251 HA THR 38 HA THR 38 -7.675 26.165 -4.243 252 HB THR 38 HB THR 38 -5.862 24.111 -3.209 253 HG1 THR 38 HG1 THR 38 -7.733 23.397 -5.240 254 HG21 THR 38 3HG2 THR 38 -7.607 24.305 -1.792 255 HG22 THR 38 1HG2 THR 38 -8.396 23.184 -2.900 256 HG23 THR 38 2HG2 THR 38 -8.687 24.917 -3.044 257 H GLY 39 H GLY 39 -7.003 27.183 -2.354 258 HA2 GLY 39 1HA GLY 39 -4.172 28.026 -2.363 259 HA3 GLY 39 2HA GLY 39 -5.500 29.039 -1.815 260 H TRP 40 H TRP 40 -2.951 27.448 -0.701 261 HA TRP 40 HA TRP 40 -4.231 26.941 1.892 262 HB2 TRP 40 1HB TRP 40 -2.340 25.115 0.415 263 HB3 TRP 40 2HB TRP 40 -2.581 25.007 2.156 264 HD1 TRP 40 HD1 TRP 40 -5.688 25.288 2.364 265 HE1 TRP 40 HE1 TRP 40 -7.232 23.444 1.448 266 HE3 TRP 40 HE3 TRP 40 -2.458 23.087 -0.931 267 HZ2 TRP 40 HZ2 TRP 40 -7.098 21.334 -0.423 268 HZ3 TRP 40 HZ3 TRP 40 -3.244 21.161 -2.244 269 HH2 TRP 40 HH2 TRP 40 -5.516 20.304 -1.994 270 H LEU 41 H LEU 41 -3.153 27.734 3.613 271 HA LEU 41 HA LEU 41 -0.883 29.426 3.133 272 HB2 LEU 41 1HB LEU 41 -2.705 28.851 5.390 273 HB3 LEU 41 2HB LEU 41 -1.095 29.436 5.806 274 HG LEU 41 HG LEU 41 -3.073 30.865 4.030 275 HD11 LEU 41 1HD1 LEU 41 -2.515 30.945 6.934 276 HD12 LEU 41 2HD1 LEU 41 -4.012 31.254 6.055 277 HD13 LEU 41 3HD1 LEU 41 -2.756 32.490 6.118 278 HD21 LEU 41 3HD2 LEU 41 -0.262 31.126 4.292 279 HD22 LEU 41 1HD2 LEU 41 -1.011 32.531 5.050 280 HD23 LEU 41 2HD2 LEU 41 -1.379 32.134 3.371 281 H THR 42 H THR 42 0.916 29.325 4.915 282 HA THR 42 HA THR 42 2.475 27.065 4.419 283 HB THR 42 HB THR 42 4.005 27.881 6.112 284 HG1 THR 42 HG1 THR 42 2.866 28.538 7.828 285 HG21 THR 42 3HG2 THR 42 4.110 30.332 5.402 286 HG22 THR 42 1HG2 THR 42 2.677 29.994 4.432 287 HG23 THR 42 2HG2 THR 42 4.179 29.124 4.119 288 H ASP 43 H ASP 43 0.413 27.863 7.179 289 HA ASP 43 HA ASP 43 1.104 25.451 8.598 290 HB2 ASP 43 1HB ASP 43 -0.765 27.742 9.076 291 HB3 ASP 43 2HB ASP 43 -0.969 26.255 9.999 292 H GLY 44 H GLY 44 -1.060 26.285 6.118 293 HA2 GLY 44 1HA GLY 44 -2.092 24.344 4.995 294 HA3 GLY 44 2HA GLY 44 -2.575 23.791 6.592 295 H GLN 45 H GLN 45 -3.083 26.829 7.100 296 HA GLN 45 HA GLN 45 -5.840 26.781 6.952 297 HB2 GLN 45 1HB GLN 45 -4.623 28.394 8.315 298 HB3 GLN 45 2HB GLN 45 -4.008 29.183 6.869 299 HG2 GLN 45 1HG GLN 45 -5.764 30.532 7.643 300 HG3 GLN 45 2HG GLN 45 -6.405 29.656 6.254 301 HE21 GLN 45 2HE2 GLN 45 -8.503 29.472 6.693 302 HE22 GLN 45 1HE2 GLN 45 -9.164 28.769 8.126 303 H LYS 46 H LYS 46 -7.046 26.504 5.199 304 HA LYS 46 HA LYS 46 -6.180 27.225 2.577 305 HB2 LYS 46 1HB LYS 46 -7.725 25.307 3.176 306 HB3 LYS 46 2HB LYS 46 -8.988 26.506 3.417 307 HG2 LYS 46 1HG LYS 46 -8.225 27.220 0.971 308 HG3 LYS 46 2HG LYS 46 -7.757 25.519 0.916 309 HD2 LYS 46 1HD LYS 46 -10.459 26.244 1.951 310 HD3 LYS 46 2HD LYS 46 -10.172 26.278 0.209 311 HE2 LYS 46 1HE LYS 46 -9.668 23.989 0.138 312 HE3 LYS 46 2HE LYS 46 -9.427 23.899 1.882 313 HZ1 LYS 46 3HZ LYS 46 -11.668 23.145 0.637 314 HZ2 LYS 46 1HZ LYS 46 -12.070 24.737 1.048 315 HZ3 LYS 46 2HZ LYS 46 -11.610 23.642 2.253 316 H PHE 47 H PHE 47 -6.724 28.940 1.319 317 HA PHE 47 HA PHE 47 -8.649 30.889 2.353 318 HB2 PHE 47 1HB PHE 47 -7.096 32.748 1.871 319 HB3 PHE 47 2HB PHE 47 -6.475 31.679 3.125 320 HD1 PHE 47 HD2 PHE 47 -6.055 32.855 -0.307 321 HD2 PHE 47 HD1 PHE 47 -4.545 30.283 2.730 322 HE1 PHE 47 HE2 PHE 47 -3.971 32.576 -1.585 323 HE2 PHE 47 HE1 PHE 47 -2.458 30.001 1.458 324 HZ PHE 47 HZ PHE 47 -2.169 31.147 -0.703 325 H ASP 48 H ASP 48 -8.598 28.926 0.142 326 HA ASP 48 HA ASP 48 -9.850 30.464 -1.836 327 HB2 ASP 48 1HB ASP 48 -7.197 30.872 -2.055 328 HB3 ASP 48 2HB ASP 48 -7.350 29.423 -3.044 329 H SER 49 H SER 49 -11.188 29.141 -2.881 330 HA SER 49 HA SER 49 -10.382 26.409 -3.489 331 HB2 SER 49 1HB SER 49 -12.777 25.750 -2.565 332 HB3 SER 49 2HB SER 49 -11.374 25.802 -1.497 333 HG SER 49 HG SER 49 -13.035 28.055 -1.879 334 H SER 50 H SER 50 -10.533 26.818 -5.660 335 HA SER 50 HA SER 50 -12.527 28.264 -6.960 336 HB2 SER 50 1HB SER 50 -10.290 27.345 -7.877 337 HB3 SER 50 2HB SER 50 -11.200 25.874 -8.222 338 HG SER 50 HG SER 50 -11.986 28.448 -9.112 339 H LYS 51 H LYS 51 -12.573 25.072 -5.646 340 HA LYS 51 HA LYS 51 -14.733 24.034 -7.172 341 HB2 LYS 51 1HB LYS 51 -13.357 23.269 -4.633 342 HB3 LYS 51 2HB LYS 51 -14.911 22.534 -5.002 343 HG2 LYS 51 1HG LYS 51 -12.952 22.510 -7.195 344 HG3 LYS 51 2HG LYS 51 -12.538 21.532 -5.784 345 HD2 LYS 51 1HD LYS 51 -13.787 20.249 -7.470 346 HD3 LYS 51 2HD LYS 51 -14.661 20.363 -5.940 347 HE2 LYS 51 1HE LYS 51 -16.212 21.869 -6.799 348 HE3 LYS 51 2HE LYS 51 -15.162 22.339 -8.134 349 HZ1 LYS 51 3HZ LYS 51 -16.736 20.995 -9.133 350 HZ2 LYS 51 1HZ LYS 51 -16.799 19.904 -7.841 351 HZ3 LYS 51 2HZ LYS 51 -15.460 19.915 -8.875 352 H ASP 52 H ASP 52 -14.560 26.329 -4.668 353 HA ASP 52 HA ASP 52 -16.937 25.960 -3.280 354 HB2 ASP 52 1HB ASP 52 -15.127 27.644 -2.773 355 HB3 ASP 52 2HB ASP 52 -15.795 28.647 -4.058 356 H ARG 53 H ARG 53 -16.356 27.637 -6.343 357 HA ARG 53 HA ARG 53 -19.084 28.458 -6.645 358 HB2 ARG 53 1HB ARG 53 -16.946 29.507 -7.674 359 HB3 ARG 53 2HB ARG 53 -17.116 28.263 -8.905 360 HG2 ARG 53 1HG ARG 53 -19.333 29.095 -9.464 361 HG3 ARG 53 2HG ARG 53 -19.197 30.323 -8.204 362 HD2 ARG 53 1HD ARG 53 -17.277 30.081 -10.511 363 HD3 ARG 53 2HD ARG 53 -18.704 31.115 -10.538 364 HE ARG 53 HE ARG 53 -16.233 31.613 -9.171 365 HH11 ARG 53 1HH1 ARG 53 -19.652 32.265 -9.203 366 HH12 ARG 53 2HH1 ARG 53 -19.507 33.764 -8.346 367 HH21 ARG 53 1HH2 ARG 53 -16.028 33.585 -8.042 368 HH22 ARG 53 2HH2 ARG 53 -17.445 34.514 -7.687 369 H ASN 54 H ASN 54 -17.604 25.503 -6.896 370 HA ASN 54 HA ASN 54 -18.259 23.479 -7.700 371 HB2 ASN 54 1HB ASN 54 -20.522 24.465 -6.866 372 HB3 ASN 54 2HB ASN 54 -20.878 24.656 -8.580 373 HD21 ASN 54 2HD2 ASN 54 -22.566 23.171 -8.442 374 HD22 ASN 54 1HD2 ASN 54 -22.278 21.472 -8.320 375 H ASP 55 H ASP 55 -16.688 24.914 -9.376 376 HA ASP 55 HA ASP 55 -17.255 23.748 -11.896 377 HB2 ASP 55 1HB ASP 55 -18.732 25.425 -12.477 378 HB3 ASP 55 2HB ASP 55 -17.907 26.636 -11.500 379 HA PRO 56 HA PRO 56 -12.878 24.153 -12.082 380 HB2 PRO 56 1HB PRO 56 -12.510 23.674 -14.729 381 HB3 PRO 56 2HB PRO 56 -12.930 22.405 -13.572 382 HG2 PRO 56 1HG PRO 56 -14.699 23.902 -15.468 383 HG3 PRO 56 2HG PRO 56 -14.681 22.171 -15.085 384 HD2 PRO 56 1HD PRO 56 -16.484 23.881 -14.011 385 HD3 PRO 56 2HD PRO 56 -15.877 22.460 -13.136 386 H PHE 57 H PHE 57 -11.403 25.735 -12.413 387 HA PHE 57 HA PHE 57 -12.259 28.287 -13.285 388 HB2 PHE 57 1HB PHE 57 -10.483 27.928 -11.590 389 HB3 PHE 57 2HB PHE 57 -9.432 27.302 -12.855 390 HD1 PHE 57 HD1 PHE 57 -11.725 30.218 -12.976 391 HD2 PHE 57 HD2 PHE 57 -7.696 28.843 -12.951 392 HE1 PHE 57 HE1 PHE 57 -10.945 32.503 -13.453 393 HE2 PHE 57 HE2 PHE 57 -6.911 31.126 -13.427 394 HZ PHE 57 HZ PHE 57 -8.536 32.959 -13.678 395 H ALA 58 H ALA 58 -12.757 28.653 -15.353 396 HA ALA 58 HA ALA 58 -11.203 27.415 -17.484 397 HB1 ALA 58 1HB ALA 58 -13.689 29.119 -17.581 398 HB2 ALA 58 2HB ALA 58 -12.917 28.366 -18.978 399 HB3 ALA 58 3HB ALA 58 -13.610 27.361 -17.705 400 H PHE 59 H PHE 59 -9.274 28.456 -17.658 401 HA PHE 59 HA PHE 59 -9.393 31.273 -18.470 402 HB2 PHE 59 1HB PHE 59 -7.622 31.935 -17.070 403 HB3 PHE 59 2HB PHE 59 -8.646 30.948 -16.032 404 HD1 PHE 59 HD2 PHE 59 -7.965 28.628 -15.480 405 HD2 PHE 59 HD1 PHE 59 -5.398 31.308 -17.565 406 HE1 PHE 59 HE2 PHE 59 -6.038 27.199 -14.937 407 HE2 PHE 59 HE1 PHE 59 -3.467 29.882 -17.026 408 HZ PHE 59 HZ PHE 59 -3.785 27.825 -15.709 409 H VAL 60 H VAL 60 -7.618 31.960 -19.797 410 HA VAL 60 HA VAL 60 -6.612 29.798 -21.463 411 HB VAL 60 HB VAL 60 -7.549 31.626 -22.677 412 HG11 VAL 60 1HG1 VAL 60 -6.527 33.923 -22.491 413 HG12 VAL 60 2HG1 VAL 60 -7.481 33.398 -21.102 414 HG13 VAL 60 3HG1 VAL 60 -5.719 33.356 -21.029 415 HG21 VAL 60 3HG2 VAL 60 -5.533 30.605 -23.637 416 HG22 VAL 60 1HG2 VAL 60 -5.686 32.303 -24.087 417 HG23 VAL 60 2HG2 VAL 60 -4.542 31.822 -22.834 418 H LEU 61 H LEU 61 -4.545 29.142 -21.568 419 HA LEU 61 HA LEU 61 -2.714 29.956 -19.539 420 HB2 LEU 61 1HB LEU 61 -2.581 27.706 -20.148 421 HB3 LEU 61 2HB LEU 61 -2.574 28.079 -21.870 422 HG LEU 61 HG LEU 61 -0.296 28.801 -21.774 423 HD11 LEU 61 1HD1 LEU 61 0.631 28.215 -19.229 424 HD12 LEU 61 2HD1 LEU 61 -0.872 29.096 -18.954 425 HD13 LEU 61 3HD1 LEU 61 0.408 29.819 -19.928 426 HD21 LEU 61 3HD2 LEU 61 -0.109 26.565 -22.079 427 HD22 LEU 61 1HD2 LEU 61 -1.031 26.176 -20.627 428 HD23 LEU 61 2HD2 LEU 61 0.661 26.656 -20.495 429 H GLY 62 H GLY 62 -1.164 31.458 -19.594 430 HA2 GLY 62 1HA GLY 62 0.387 32.951 -20.428 431 HA3 GLY 62 2HA GLY 62 0.156 32.236 -22.016 432 H GLY 63 H GLY 63 -2.827 33.056 -20.805 433 HA2 GLY 63 1HA GLY 63 -2.966 35.361 -22.575 434 HA3 GLY 63 2HA GLY 63 -4.321 34.564 -21.790 435 H GLY 64 H GLY 64 -3.040 34.677 -19.140 436 HA2 GLY 64 1HA GLY 64 -2.184 36.700 -17.864 437 HA3 GLY 64 2HA GLY 64 -3.524 37.543 -18.626 438 H MET 65 H MET 65 -4.087 38.025 -16.362 439 HA MET 65 HA MET 65 -5.413 37.750 -14.536 440 HB2 MET 65 1HB MET 65 -6.568 35.865 -16.528 441 HB3 MET 65 2HB MET 65 -7.105 35.709 -14.860 442 HG2 MET 65 1HG MET 65 -7.158 38.323 -16.331 443 HG3 MET 65 2HG MET 65 -8.493 37.174 -16.382 444 HE1 MET 65 3HE MET 65 -8.236 40.478 -13.566 445 HE2 MET 65 1HE MET 65 -6.772 40.020 -14.438 446 HE3 MET 65 2HE MET 65 -8.269 40.316 -15.323 447 H VAL 66 H VAL 66 -2.865 36.184 -14.891 448 HA VAL 66 HA VAL 66 -3.248 34.464 -12.567 449 HB VAL 66 HB VAL 66 -2.110 32.566 -13.528 450 HG11 VAL 66 1HG1 VAL 66 -4.511 32.592 -13.780 451 HG12 VAL 66 2HG1 VAL 66 -4.376 33.524 -15.272 452 HG13 VAL 66 3HG1 VAL 66 -3.779 31.866 -15.210 453 HG21 VAL 66 3HG2 VAL 66 -1.321 34.469 -15.516 454 HG22 VAL 66 1HG2 VAL 66 -0.714 32.837 -15.234 455 HG23 VAL 66 2HG2 VAL 66 -2.100 33.092 -16.294 456 H ILE 67 H ILE 67 -0.932 33.444 -12.060 457 HA ILE 67 HA ILE 67 0.948 35.708 -12.124 458 HB ILE 67 HB ILE 67 1.861 34.977 -10.065 459 HG12 ILE 67 1HG1 ILE 67 0.195 32.476 -10.413 460 HG13 ILE 67 2HG1 ILE 67 1.951 32.587 -10.482 461 HG21 ILE 67 1HG2 ILE 67 -0.815 35.681 -10.323 462 HG22 ILE 67 2HG2 ILE 67 -0.813 34.348 -9.170 463 HG23 ILE 67 3HG2 ILE 67 0.169 35.780 -8.864 464 HD11 ILE 67 3HD1 ILE 67 1.856 33.386 -8.087 465 HD12 ILE 67 1HD1 ILE 67 0.165 32.887 -8.093 466 HD13 ILE 67 2HD1 ILE 67 1.436 31.697 -8.374 467 H LYS 68 H LYS 68 3.283 35.076 -12.009 468 HA LYS 68 HA LYS 68 4.095 33.679 -14.228 469 HB2 LYS 68 1HB LYS 68 6.327 33.467 -13.015 470 HB3 LYS 68 2HB LYS 68 5.678 35.092 -13.196 471 HG2 LYS 68 1HG LYS 68 4.650 34.259 -10.777 472 HG3 LYS 68 2HG LYS 68 6.280 33.583 -10.793 473 HD2 LYS 68 1HD LYS 68 5.577 36.472 -11.313 474 HD3 LYS 68 2HD LYS 68 6.219 35.831 -9.798 475 HE2 LYS 68 1HE LYS 68 8.249 35.123 -10.955 476 HE3 LYS 68 2HE LYS 68 7.604 35.734 -12.478 477 HZ1 LYS 68 3HZ LYS 68 7.410 37.874 -10.840 478 HZ2 LYS 68 1HZ LYS 68 8.671 37.600 -11.935 479 HZ3 LYS 68 2HZ LYS 68 8.850 37.159 -10.312 480 H GLY 69 H GLY 69 4.000 32.457 -10.880 481 HA2 GLY 69 1HA GLY 69 4.911 29.872 -11.395 482 HA3 GLY 69 2HA GLY 69 3.859 30.319 -10.060 483 H TRP 70 H TRP 70 1.753 31.276 -11.899 484 HA TRP 70 HA TRP 70 0.340 28.821 -12.153 485 HB2 TRP 70 1HB TRP 70 -0.269 31.611 -12.263 486 HB3 TRP 70 2HB TRP 70 -0.933 30.840 -13.701 487 HD1 TRP 70 HD1 TRP 70 -3.242 29.776 -13.402 488 HE1 TRP 70 HE1 TRP 70 -4.690 29.048 -11.402 489 HE3 TRP 70 HE3 TRP 70 0.102 30.620 -9.629 490 HZ2 TRP 70 HZ2 TRP 70 -4.446 28.857 -8.597 491 HZ3 TRP 70 HZ3 TRP 70 -0.584 30.140 -7.315 492 HH2 TRP 70 HH2 TRP 70 -2.812 29.277 -6.812 493 H ASP 71 H ASP 71 1.415 31.175 -14.613 494 HA ASP 71 HA ASP 71 0.739 29.700 -16.863 495 HB2 ASP 71 1HB ASP 71 2.835 31.787 -16.341 496 HB3 ASP 71 2HB ASP 71 2.730 31.005 -17.916 497 H GLU 72 H GLU 72 3.795 29.720 -15.052 498 HA GLU 72 HA GLU 72 5.155 27.888 -16.702 499 HB2 GLU 72 1HB GLU 72 5.764 29.390 -14.444 500 HB3 GLU 72 2HB GLU 72 5.923 27.726 -13.899 501 HG2 GLU 72 1HG GLU 72 7.318 28.954 -16.267 502 HG3 GLU 72 2HG GLU 72 8.042 28.599 -14.699 503 H GLY 73 H GLY 73 3.172 27.438 -13.801 504 HA2 GLY 73 1HA GLY 73 3.625 24.697 -13.434 505 HA3 GLY 73 2HA GLY 73 2.191 25.566 -12.908 506 H VAL 74 H VAL 74 0.717 26.165 -14.888 507 HA VAL 74 HA VAL 74 -0.336 23.775 -15.885 508 HB VAL 74 HB VAL 74 -1.610 25.273 -17.486 509 HG11 VAL 74 1HG1 VAL 74 -2.042 26.523 -14.876 510 HG12 VAL 74 2HG1 VAL 74 -3.137 25.560 -15.870 511 HG13 VAL 74 3HG1 VAL 74 -1.958 24.763 -14.826 512 HG21 VAL 74 3HG2 VAL 74 0.444 27.046 -16.951 513 HG22 VAL 74 1HG2 VAL 74 -1.072 27.419 -17.771 514 HG23 VAL 74 2HG2 VAL 74 -0.917 27.691 -16.035 515 H GLN 75 H GLN 75 2.070 25.940 -17.187 516 HA GLN 75 HA GLN 75 2.051 25.256 -19.869 517 HB2 GLN 75 1HB GLN 75 4.005 26.372 -17.984 518 HB3 GLN 75 2HB GLN 75 4.729 25.531 -19.348 519 HG2 GLN 75 1HG GLN 75 3.591 26.948 -20.907 520 HG3 GLN 75 2HG GLN 75 2.668 27.705 -19.609 521 HE21 GLN 75 2HE2 GLN 75 5.662 27.589 -21.298 522 HE22 GLN 75 1HE2 GLN 75 6.407 28.937 -20.515 523 H GLY 76 H GLY 76 3.087 23.401 -17.129 524 HA2 GLY 76 1HA GLY 76 4.170 21.339 -18.944 525 HA3 GLY 76 2HA GLY 76 4.646 21.530 -17.263 526 H MET 77 H MET 77 1.861 21.976 -16.397 527 HA MET 77 HA MET 77 1.181 19.426 -15.598 528 HB2 MET 77 1HB MET 77 -0.625 21.812 -16.018 529 HB3 MET 77 2HB MET 77 -1.091 20.356 -15.149 530 HG2 MET 77 1HG MET 77 1.277 21.109 -13.945 531 HG3 MET 77 2HG MET 77 0.457 22.636 -14.263 532 HE1 MET 77 3HE MET 77 -1.042 19.163 -11.695 533 HE2 MET 77 1HE MET 77 -1.662 19.200 -13.346 534 HE3 MET 77 2HE MET 77 0.075 19.092 -13.059 535 H LYS 78 H LYS 78 -0.327 17.891 -16.278 536 HA LYS 78 HA LYS 78 -1.101 18.104 -19.114 537 HB2 LYS 78 1HB LYS 78 -0.216 15.748 -17.466 538 HB3 LYS 78 2HB LYS 78 -1.131 15.529 -18.952 539 HG2 LYS 78 1HG LYS 78 0.592 16.230 -20.283 540 HG3 LYS 78 2HG LYS 78 1.308 17.231 -19.018 541 HD2 LYS 78 1HD LYS 78 1.229 14.289 -18.595 542 HD3 LYS 78 2HD LYS 78 2.390 14.928 -19.761 543 HE2 LYS 78 1HE LYS 78 2.915 16.611 -17.804 544 HE3 LYS 78 2HE LYS 78 2.237 15.321 -16.811 545 HZ1 LYS 78 3HZ LYS 78 4.314 14.700 -18.803 546 HZ2 LYS 78 1HZ LYS 78 3.922 13.880 -17.376 547 HZ3 LYS 78 2HZ LYS 78 4.755 15.350 -17.305 548 H VAL 79 H VAL 79 -3.103 17.109 -19.745 549 HA VAL 79 HA VAL 79 -5.288 17.788 -18.189 550 HB VAL 79 HB VAL 79 -5.165 15.663 -20.333 551 HG11 VAL 79 1HG1 VAL 79 -7.204 15.252 -19.355 552 HG12 VAL 79 2HG1 VAL 79 -7.423 16.930 -18.853 553 HG13 VAL 79 3HG1 VAL 79 -7.644 16.478 -20.544 554 HG21 VAL 79 3HG2 VAL 79 -4.761 18.431 -20.504 555 HG22 VAL 79 1HG2 VAL 79 -5.023 17.299 -21.831 556 HG23 VAL 79 2HG2 VAL 79 -6.392 18.143 -21.109 557 H GLY 80 H GLY 80 -6.154 16.946 -16.413 558 HA2 GLY 80 1HA GLY 80 -6.988 15.290 -15.000 559 HA3 GLY 80 2HA GLY 80 -6.222 14.075 -16.012 560 H GLY 81 H GLY 81 -3.912 16.337 -15.429 561 HA2 GLY 81 1HA GLY 81 -2.692 14.653 -13.381 562 HA3 GLY 81 2HA GLY 81 -1.885 15.899 -14.321 563 H VAL 82 H VAL 82 -2.160 15.280 -11.349 564 HA VAL 82 HA VAL 82 -2.994 17.989 -10.533 565 HB VAL 82 HB VAL 82 -3.136 15.518 -8.803 566 HG11 VAL 82 1HG1 VAL 82 -3.804 18.401 -8.421 567 HG12 VAL 82 2HG1 VAL 82 -4.738 17.173 -7.564 568 HG13 VAL 82 3HG1 VAL 82 -2.993 17.279 -7.329 569 HG21 VAL 82 3HG2 VAL 82 -5.678 16.015 -9.100 570 HG22 VAL 82 1HG2 VAL 82 -5.157 16.801 -10.591 571 HG23 VAL 82 2HG2 VAL 82 -4.816 15.090 -10.329 572 H ARG 83 H ARG 83 -1.491 19.191 -9.566 573 HA ARG 83 HA ARG 83 0.702 17.925 -8.124 574 HB2 ARG 83 1HB ARG 83 1.189 19.894 -10.366 575 HB3 ARG 83 2HB ARG 83 2.415 19.186 -9.322 576 HG2 ARG 83 1HG ARG 83 1.462 16.929 -10.240 577 HG3 ARG 83 2HG ARG 83 0.884 17.953 -11.556 578 HD2 ARG 83 1HD ARG 83 3.305 18.850 -11.611 579 HD3 ARG 83 2HD ARG 83 3.697 17.400 -10.687 580 HE ARG 83 HE ARG 83 2.198 16.668 -12.944 581 HH11 ARG 83 1HH1 ARG 83 5.339 17.911 -12.101 582 HH12 ARG 83 2HH1 ARG 83 6.128 17.214 -13.477 583 HH21 ARG 83 1HH2 ARG 83 3.226 15.746 -14.760 584 HH22 ARG 83 2HH2 ARG 83 4.925 15.984 -14.990 585 H ARG 84 H ARG 84 1.542 19.172 -6.495 586 HA ARG 84 HA ARG 84 -0.010 21.512 -5.773 587 HB2 ARG 84 1HB ARG 84 1.246 19.478 -4.340 588 HB3 ARG 84 2HB ARG 84 2.221 20.906 -4.015 589 HG2 ARG 84 1HG ARG 84 0.436 22.048 -3.037 590 HG3 ARG 84 2HG ARG 84 -0.761 20.959 -3.741 591 HD2 ARG 84 1HD ARG 84 -0.421 20.583 -1.324 592 HD3 ARG 84 2HD ARG 84 -0.040 19.165 -2.300 593 HE ARG 84 HE ARG 84 2.270 20.755 -1.803 594 HH11 ARG 84 1HH1 ARG 84 0.139 18.402 -0.372 595 HH12 ARG 84 2HH1 ARG 84 1.338 17.787 0.717 596 HH21 ARG 84 1HH2 ARG 84 3.856 19.953 -0.373 597 HH22 ARG 84 2HH2 ARG 84 3.451 18.670 0.717 598 H LEU 85 H LEU 85 0.555 23.351 -6.759 599 HA LEU 85 HA LEU 85 3.329 23.914 -7.393 600 HB2 LEU 85 1HB LEU 85 1.472 24.443 -8.955 601 HB3 LEU 85 2HB LEU 85 0.886 25.634 -7.796 602 HG LEU 85 HG LEU 85 3.369 26.560 -8.111 603 HD11 LEU 85 1HD1 LEU 85 2.856 24.802 -10.435 604 HD12 LEU 85 2HD1 LEU 85 4.377 25.259 -9.668 605 HD13 LEU 85 3HD1 LEU 85 3.568 26.383 -10.760 606 HD21 LEU 85 3HD2 LEU 85 1.394 27.192 -10.262 607 HD22 LEU 85 1HD2 LEU 85 2.434 28.276 -9.337 608 HD23 LEU 85 2HD2 LEU 85 1.012 27.559 -8.579 609 H THR 86 H THR 86 4.627 24.746 -5.908 610 HA THR 86 HA THR 86 3.497 26.386 -3.758 611 HB THR 86 HB THR 86 6.376 25.722 -3.688 612 HG1 THR 86 HG1 THR 86 5.939 23.697 -4.217 613 HG21 THR 86 3HG2 THR 86 4.559 24.972 -1.496 614 HG22 THR 86 1HG2 THR 86 4.575 26.687 -1.904 615 HG23 THR 86 2HG2 THR 86 6.074 25.874 -1.456 616 H ILE 87 H ILE 87 3.567 28.516 -3.970 617 HA ILE 87 HA ILE 87 5.777 29.706 -5.516 618 HB ILE 87 HB ILE 87 3.038 30.910 -5.121 619 HG12 ILE 87 1HG1 ILE 87 3.053 30.361 -7.727 620 HG13 ILE 87 2HG1 ILE 87 4.121 29.066 -7.199 621 HG21 ILE 87 1HG2 ILE 87 3.697 32.522 -6.749 622 HG22 ILE 87 2HG2 ILE 87 4.970 32.445 -5.532 623 HG23 ILE 87 3HG2 ILE 87 5.192 31.650 -7.091 624 HD11 ILE 87 3HD1 ILE 87 1.255 29.294 -6.997 625 HD12 ILE 87 1HD1 ILE 87 2.294 27.885 -6.791 626 HD13 ILE 87 2HD1 ILE 87 1.993 28.966 -5.430 627 HA PRO 88 HA PRO 88 6.940 31.649 -1.712 628 HB2 PRO 88 1HB PRO 88 8.726 33.404 -2.763 629 HB3 PRO 88 2HB PRO 88 9.071 31.681 -2.571 630 HG2 PRO 88 1HG PRO 88 8.206 33.178 -5.014 631 HG3 PRO 88 2HG PRO 88 9.441 31.916 -4.855 632 HD2 PRO 88 1HD PRO 88 6.956 31.411 -5.804 633 HD3 PRO 88 2HD PRO 88 7.886 30.215 -4.878 634 HA PRO 89 HA PRO 89 4.761 35.445 -1.288 635 HB2 PRO 89 1HB PRO 89 6.408 36.946 0.263 636 HB3 PRO 89 2HB PRO 89 5.514 35.552 0.880 637 HG2 PRO 89 1HG PRO 89 8.374 35.737 0.017 638 HG3 PRO 89 2HG PRO 89 7.683 34.919 1.430 639 HD2 PRO 89 1HD PRO 89 8.387 33.591 -0.823 640 HD3 PRO 89 2HD PRO 89 7.031 33.079 0.203 641 H GLN 90 H GLN 90 7.655 35.339 -3.000 642 HA GLN 90 HA GLN 90 7.644 38.179 -3.675 643 HB2 GLN 90 1HB GLN 90 9.721 36.535 -3.288 644 HB3 GLN 90 2HB GLN 90 9.503 36.287 -5.015 645 HG2 GLN 90 1HG GLN 90 10.141 38.836 -3.570 646 HG3 GLN 90 2HG GLN 90 11.096 37.998 -4.792 647 HE21 GLN 90 2HE2 GLN 90 8.521 40.193 -4.184 648 HE22 GLN 90 1HE2 GLN 90 8.213 40.630 -5.827 649 H LEU 91 H LEU 91 7.205 35.018 -5.207 650 HA LEU 91 HA LEU 91 6.416 36.302 -7.708 651 HB2 LEU 91 1HB LEU 91 6.456 33.349 -7.189 652 HB3 LEU 91 2HB LEU 91 6.597 34.199 -8.726 653 HG LEU 91 HG LEU 91 8.714 34.278 -6.583 654 HD11 LEU 91 1HD1 LEU 91 9.806 32.490 -7.533 655 HD12 LEU 91 2HD1 LEU 91 8.955 32.646 -9.069 656 HD13 LEU 91 3HD1 LEU 91 8.123 31.980 -7.664 657 HD21 LEU 91 3HD2 LEU 91 9.858 35.627 -7.946 658 HD22 LEU 91 1HD2 LEU 91 8.325 35.884 -8.780 659 HD23 LEU 91 2HD2 LEU 91 9.458 34.669 -9.373 660 H GLY 92 H GLY 92 4.795 36.372 -5.190 661 HA2 GLY 92 1HA GLY 92 2.382 34.986 -6.177 662 HA3 GLY 92 2HA GLY 92 2.679 35.386 -4.492 663 H TYR 93 H TYR 93 2.032 37.325 -3.712 664 HA TYR 93 HA TYR 93 0.270 38.885 -5.362 665 HB2 TYR 93 1HB TYR 93 1.084 38.958 -2.476 666 HB3 TYR 93 2HB TYR 93 0.207 40.312 -3.178 667 HD1 TYR 93 HD2 TYR 93 -2.036 39.802 -4.314 668 HD2 TYR 93 HD1 TYR 93 -0.065 37.069 -1.716 669 HE1 TYR 93 HE2 TYR 93 -4.161 38.615 -3.960 670 HE2 TYR 93 HE1 TYR 93 -2.184 35.873 -1.356 671 HH TYR 93 HH TYR 93 -4.508 35.718 -2.987 672 H GLY 94 H GLY 94 3.388 39.419 -3.753 673 HA2 GLY 94 1HA GLY 94 5.127 40.737 -4.660 674 HA3 GLY 94 2HA GLY 94 3.950 41.543 -5.686 675 H ALA 95 H ALA 95 4.491 43.626 -5.154 676 HA ALA 95 HA ALA 95 5.012 44.610 -2.595 677 HB1 ALA 95 1HB ALA 95 5.352 45.728 -4.883 678 HB2 ALA 95 2HB ALA 95 3.684 46.273 -4.706 679 HB3 ALA 95 3HB ALA 95 4.898 46.747 -3.517 680 H ARG 96 H ARG 96 2.013 43.833 -4.150 681 HA ARG 96 HA ARG 96 0.251 45.412 -2.646 682 HB2 ARG 96 1HB ARG 96 0.035 42.957 -4.292 683 HB3 ARG 96 2HB ARG 96 -1.265 43.243 -3.144 684 HG2 ARG 96 1HG ARG 96 -1.437 45.569 -4.151 685 HG3 ARG 96 2HG ARG 96 -0.402 44.962 -5.445 686 HD2 ARG 96 1HD ARG 96 -2.038 43.163 -5.866 687 HD3 ARG 96 2HD ARG 96 -3.081 43.849 -4.622 688 HE ARG 96 HE ARG 96 -2.427 45.790 -6.587 689 HH11 ARG 96 1HH1 ARG 96 -4.434 43.004 -6.013 690 HH12 ARG 96 2HH1 ARG 96 -5.658 43.491 -7.138 691 HH21 ARG 96 1HH2 ARG 96 -4.031 46.442 -8.071 692 HH22 ARG 96 2HH2 ARG 96 -5.428 45.447 -8.309 693 H GLY 97 H GLY 97 0.794 41.907 -2.224 694 HA2 GLY 97 1HA GLY 97 0.849 40.607 -0.331 695 HA3 GLY 97 2HA GLY 97 1.286 42.062 0.554 696 H ALA 98 H ALA 98 -0.342 40.084 1.643 697 HA ALA 98 HA ALA 98 -3.044 41.229 1.541 698 HB1 ALA 98 1HB ALA 98 -3.819 39.183 2.543 699 HB2 ALA 98 2HB ALA 98 -2.803 38.796 1.154 700 HB3 ALA 98 3HB ALA 98 -2.162 38.630 2.789 701 H GLY 99 H GLY 99 -4.218 41.466 3.588 702 HA2 GLY 99 1HA GLY 99 -2.956 43.121 5.401 703 HA3 GLY 99 2HA GLY 99 -4.431 42.230 5.744 704 H GLY 100 H GLY 100 -4.303 40.207 6.795 705 HA2 GLY 100 1HA GLY 100 -1.689 39.705 8.082 706 HA3 GLY 100 2HA GLY 100 -3.213 39.587 8.949 707 H VAL 101 H VAL 101 -2.801 38.452 5.665 708 HA VAL 101 HA VAL 101 -3.025 35.684 6.659 709 HB VAL 101 HB VAL 101 -4.166 36.834 4.109 710 HG11 VAL 101 1HG1 VAL 101 -5.168 34.624 3.790 711 HG12 VAL 101 2HG1 VAL 101 -3.405 34.536 3.807 712 HG13 VAL 101 3HG1 VAL 101 -4.328 34.036 5.225 713 HG21 VAL 101 3HG2 VAL 101 -6.345 36.274 5.155 714 HG22 VAL 101 1HG2 VAL 101 -5.488 35.881 6.646 715 HG23 VAL 101 2HG2 VAL 101 -5.458 37.529 6.020 716 H ILE 102 H ILE 102 -1.475 37.875 4.440 717 HA ILE 102 HA ILE 102 0.311 35.689 3.589 718 HB ILE 102 HB ILE 102 -0.348 38.167 1.995 719 HG12 ILE 102 1HG1 ILE 102 -2.279 36.629 2.182 720 HG13 ILE 102 2HG1 ILE 102 -1.652 36.714 0.540 721 HG21 ILE 102 1HG2 ILE 102 1.647 36.056 1.750 722 HG22 ILE 102 2HG2 ILE 102 0.685 36.281 0.290 723 HG23 ILE 102 3HG2 ILE 102 1.573 37.640 0.980 724 HD11 ILE 102 3HD1 ILE 102 -0.857 34.540 2.446 725 HD12 ILE 102 1HD1 ILE 102 -2.284 34.427 1.416 726 HD13 ILE 102 2HD1 ILE 102 -0.683 34.584 0.691 727 HA PRO 103 HA PRO 103 2.804 38.793 5.961 728 HB2 PRO 103 1HB PRO 103 4.247 36.934 7.314 729 HB3 PRO 103 2HB PRO 103 2.675 37.521 7.870 730 HG2 PRO 103 1HG PRO 103 3.342 35.003 6.395 731 HG3 PRO 103 2HG PRO 103 2.240 35.240 7.764 732 HD2 PRO 103 1HD PRO 103 1.365 35.029 5.210 733 HD3 PRO 103 2HD PRO 103 0.541 36.030 6.423 734 HA PRO 104 HA PRO 104 6.427 38.599 3.476 735 HB2 PRO 104 1HB PRO 104 8.380 39.379 5.192 736 HB3 PRO 104 2HB PRO 104 7.164 40.491 4.552 737 HG2 PRO 104 1HG PRO 104 7.255 39.106 7.204 738 HG3 PRO 104 2HG PRO 104 6.821 40.785 6.833 739 HD2 PRO 104 1HD PRO 104 4.965 38.868 7.296 740 HD3 PRO 104 2HD PRO 104 4.684 40.220 6.179 741 H ASN 105 H ASN 105 8.113 37.273 2.885 742 HA ASN 105 HA ASN 105 9.409 35.406 2.821 743 HB2 ASN 105 1HB ASN 105 9.426 35.586 5.839 744 HB3 ASN 105 2HB ASN 105 10.609 34.774 4.818 745 HD21 ASN 105 2HD2 ASN 105 12.350 35.868 4.237 746 HD22 ASN 105 1HD2 ASN 105 12.561 37.576 4.384 747 H ALA 106 H ALA 106 6.429 35.274 3.246 748 HA ALA 106 HA ALA 106 6.207 32.612 4.467 749 HB1 ALA 106 1HB ALA 106 3.765 34.020 3.593 750 HB2 ALA 106 2HB ALA 106 4.089 33.113 5.071 751 HB3 ALA 106 3HB ALA 106 4.670 34.770 4.909 752 H THR 107 H THR 107 6.006 30.870 3.229 753 HA THR 107 HA THR 107 5.763 31.168 0.358 754 HB THR 107 HB THR 107 6.152 28.705 2.067 755 HG1 THR 107 HG1 THR 107 7.940 30.166 0.391 756 HG21 THR 107 3HG2 THR 107 6.966 28.019 -0.435 757 HG22 THR 107 1HG2 THR 107 5.578 29.045 -0.796 758 HG23 THR 107 2HG2 THR 107 5.384 27.630 0.240 759 H LEU 108 H LEU 108 3.967 30.875 -0.798 760 HA LEU 108 HA LEU 108 1.550 29.993 0.595 761 HB2 LEU 108 1HB LEU 108 1.853 31.270 -2.119 762 HB3 LEU 108 2HB LEU 108 0.335 30.951 -1.281 763 HG LEU 108 HG LEU 108 2.454 32.957 -0.522 764 HD11 LEU 108 1HD1 LEU 108 -0.437 33.325 -1.287 765 HD12 LEU 108 2HD1 LEU 108 0.930 33.567 -2.374 766 HD13 LEU 108 3HD1 LEU 108 0.743 34.592 -0.951 767 HD21 LEU 108 3HD2 LEU 108 -0.085 32.223 0.934 768 HD22 LEU 108 1HD2 LEU 108 0.993 33.559 1.340 769 HD23 LEU 108 2HD2 LEU 108 1.559 31.895 1.485 770 H VAL 109 H VAL 109 0.670 28.061 0.253 771 HA VAL 109 HA VAL 109 1.771 26.385 -1.885 772 HB VAL 109 HB VAL 109 0.132 25.637 0.540 773 HG11 VAL 109 1HG1 VAL 109 0.735 24.191 -1.904 774 HG12 VAL 109 2HG1 VAL 109 1.301 23.344 -0.463 775 HG13 VAL 109 3HG1 VAL 109 -0.396 23.800 -0.609 776 HG21 VAL 109 3HG2 VAL 109 2.832 26.240 0.338 777 HG22 VAL 109 1HG2 VAL 109 2.045 25.358 1.647 778 HG23 VAL 109 2HG2 VAL 109 2.776 24.478 0.305 779 H PHE 110 H PHE 110 0.667 26.428 -3.727 780 HA PHE 110 HA PHE 110 -2.276 26.483 -3.594 781 HB2 PHE 110 1HB PHE 110 -0.393 27.671 -5.630 782 HB3 PHE 110 2HB PHE 110 -2.111 27.448 -5.946 783 HD1 PHE 110 HD2 PHE 110 -3.776 28.635 -4.497 784 HD2 PHE 110 HD1 PHE 110 0.390 29.497 -4.384 785 HE1 PHE 110 HE2 PHE 110 -4.256 30.791 -3.413 786 HE2 PHE 110 HE1 PHE 110 -0.083 31.654 -3.299 787 HZ PHE 110 HZ PHE 110 -2.408 32.304 -2.813 788 H GLU 111 H GLU 111 -3.377 24.879 -4.555 789 HA GLU 111 HA GLU 111 -1.820 22.764 -5.843 790 HB2 GLU 111 1HB GLU 111 -3.256 22.096 -3.985 791 HB3 GLU 111 2HB GLU 111 -4.657 22.776 -4.800 792 HG2 GLU 111 1HG GLU 111 -4.833 20.502 -5.205 793 HG3 GLU 111 2HG GLU 111 -4.119 21.134 -6.688 794 H VAL 112 H VAL 112 -2.108 22.131 -7.919 795 HA VAL 112 HA VAL 112 -4.205 23.480 -9.486 796 HB VAL 112 HB VAL 112 -1.404 22.977 -10.493 797 HG11 VAL 112 1HG1 VAL 112 -3.799 24.399 -11.635 798 HG12 VAL 112 2HG1 VAL 112 -2.166 24.584 -12.279 799 HG13 VAL 112 3HG1 VAL 112 -2.948 23.002 -12.295 800 HG21 VAL 112 3HG2 VAL 112 -2.506 25.183 -8.923 801 HG22 VAL 112 1HG2 VAL 112 -0.828 24.738 -9.234 802 HG23 VAL 112 2HG2 VAL 112 -1.720 25.695 -10.417 803 H GLU 113 H GLU 113 -5.490 22.068 -10.455 804 HA GLU 113 HA GLU 113 -4.365 19.483 -11.305 805 HB2 GLU 113 1HB GLU 113 -6.765 18.616 -10.813 806 HB3 GLU 113 2HB GLU 113 -5.632 18.809 -9.482 807 HG2 GLU 113 1HG GLU 113 -6.710 20.687 -8.664 808 HG3 GLU 113 2HG GLU 113 -7.511 21.018 -10.199 809 H LEU 114 H LEU 114 -4.407 19.408 -13.446 810 HA LEU 114 HA LEU 114 -6.050 21.074 -15.049 811 HB2 LEU 114 1HB LEU 114 -4.051 18.953 -15.492 812 HB3 LEU 114 2HB LEU 114 -5.227 19.180 -16.784 813 HG LEU 114 HG LEU 114 -3.013 20.409 -16.998 814 HD11 LEU 114 1HD1 LEU 114 -4.509 22.651 -17.406 815 HD12 LEU 114 2HD1 LEU 114 -5.737 21.386 -17.423 816 HD13 LEU 114 3HD1 LEU 114 -4.371 21.304 -18.535 817 HD21 LEU 114 3HD2 LEU 114 -2.794 22.501 -15.788 818 HD22 LEU 114 1HD2 LEU 114 -2.873 21.148 -14.659 819 HD23 LEU 114 2HD2 LEU 114 -4.287 22.172 -14.908 820 H LEU 115 H LEU 115 -8.063 20.785 -15.745 821 HA LEU 115 HA LEU 115 -9.285 18.131 -15.399 822 HB2 LEU 115 1HB LEU 115 -10.426 20.907 -15.334 823 HB3 LEU 115 2HB LEU 115 -11.449 19.487 -15.540 824 HG LEU 115 HG LEU 115 -9.662 19.302 -13.237 825 HD11 LEU 115 1HD1 LEU 115 -10.703 21.827 -13.653 826 HD12 LEU 115 2HD1 LEU 115 -10.144 21.163 -12.118 827 HD13 LEU 115 3HD1 LEU 115 -11.852 21.072 -12.548 828 HD21 LEU 115 3HD2 LEU 115 -12.655 19.090 -13.545 829 HD22 LEU 115 1HD2 LEU 115 -11.705 18.564 -12.154 830 HD23 LEU 115 2HD2 LEU 115 -11.511 17.757 -13.711 831 H ASP 116 H ASP 116 -8.741 20.757 -17.643 832 HA ASP 116 HA ASP 116 -9.092 19.067 -19.897 833 HB2 ASP 116 1HB ASP 116 -11.494 19.718 -19.082 834 HB3 ASP 116 2HB ASP 116 -11.128 21.267 -19.837 835 H VAL 117 H VAL 117 -8.753 20.228 -21.945 836 HA VAL 117 HA VAL 117 -7.719 22.941 -21.723 837 HB VAL 117 HB VAL 117 -5.573 22.440 -22.704 838 HG11 VAL 117 1HG1 VAL 117 -4.536 21.176 -20.866 839 HG12 VAL 117 2HG1 VAL 117 -5.696 22.371 -20.281 840 HG13 VAL 117 3HG1 VAL 117 -6.137 20.664 -20.332 841 HG21 VAL 117 3HG2 VAL 117 -6.039 20.593 -24.114 842 HG22 VAL 117 1HG2 VAL 117 -4.867 20.026 -22.925 843 HG23 VAL 117 2HG2 VAL 117 -6.570 19.600 -22.756 844 H11 L2S 130 1H1 L2S 130 -4.937 31.363 -9.221 845 H21 L2S 130 2H1 L2S 130 -5.010 31.900 -10.968 846 H12 L2S 130 1H2 L2S 130 -4.285 34.095 -10.339 847 H22 L2S 130 2H2 L2S 130 -3.060 32.850 -9.794 848 H13 L2S 130 2H3 L2S 130 -3.958 32.985 -7.561 849 H23 L2S 130 1H3 L2S 130 -3.540 34.674 -8.113 850 H14 L2S 130 1H4 L2S 130 -6.673 32.441 -7.603 851 H24 L2S 130 2H4 L2S 130 -7.618 33.842 -8.290 852 H15 L2S 130 1H5 L2S 130 -7.241 31.940 -9.898 853 H25 L2S 130 2H5 L2S 130 -6.621 33.587 -10.404 854 H17 L2S 130 1H7 L2S 130 -7.189 36.798 -6.464 855 H27 L2S 130 2H7 L2S 130 -7.807 35.725 -7.830 856 H9 L2S 130 H9 L2S 130 -7.370 33.568 -3.139 857 H10 L2S 130 H10 L2S 130 -7.071 34.516 -0.851 858 H112 L2S 130 1H12 L2S 130 -7.485 38.550 -2.476 859 H113 L2S 130 1H13 L2S 130 -7.832 37.585 -4.742 860 H114 L2S 130 1H14 L2S 130 -6.946 38.205 -0.317 861 H214 L2S 130 2H14 L2S 130 -6.217 36.674 0.225 862 H314 L2S 130 3H14 L2S 130 -8.000 36.888 0.307 Start of MODEL 20 1 H1 GLY 1 H GLY 1 2.713 3.610 -0.318 2 HA2 GLY 1 1HA GLY 1 4.826 4.300 -0.913 3 HA3 GLY 1 2HA GLY 1 4.078 5.346 -2.111 4 HA PRO 2 HA PRO 2 6.018 7.917 1.281 5 HB2 PRO 2 1HB PRO 2 7.577 9.407 -0.368 6 HB3 PRO 2 2HB PRO 2 8.106 7.868 0.322 7 HG2 PRO 2 1HG PRO 2 7.012 8.444 -2.404 8 HG3 PRO 2 2HG PRO 2 8.376 7.410 -1.941 9 HD2 PRO 2 1HD PRO 2 5.929 6.414 -2.531 10 HD3 PRO 2 2HD PRO 2 7.007 5.655 -1.342 11 H GLY 3 H GLY 3 4.912 8.813 -1.975 12 HA2 GLY 3 1HA GLY 3 2.771 10.272 -1.608 13 HA3 GLY 3 2HA GLY 3 3.957 11.384 -0.940 14 H SER 4 H SER 4 5.564 12.271 -2.336 15 HA SER 4 HA SER 4 4.558 12.682 -5.021 16 HB2 SER 4 1HB SER 4 6.843 13.914 -3.473 17 HB3 SER 4 2HB SER 4 6.487 14.321 -5.152 18 HG SER 4 HG SER 4 5.270 15.162 -2.881 19 H MET 5 H MET 5 6.241 12.786 -6.826 20 HA MET 5 HA MET 5 7.740 10.267 -6.781 21 HB2 MET 5 1HB MET 5 6.865 12.001 -9.097 22 HB3 MET 5 2HB MET 5 7.768 10.501 -9.252 23 HG2 MET 5 1HG MET 5 5.105 10.613 -7.882 24 HG3 MET 5 2HG MET 5 5.255 10.414 -9.627 25 HE1 MET 5 3HE MET 5 5.675 6.804 -10.112 26 HE2 MET 5 1HE MET 5 4.365 7.985 -10.117 27 HE3 MET 5 2HE MET 5 5.925 8.397 -10.828 28 H THR 6 H THR 6 8.209 13.362 -8.484 29 HA THR 6 HA THR 6 11.032 13.289 -7.633 30 HB THR 6 HB THR 6 10.160 14.596 -10.193 31 HG1 THR 6 HG1 THR 6 11.153 11.947 -10.107 32 HG21 THR 6 3HG2 THR 6 12.695 13.839 -8.876 33 HG22 THR 6 1HG2 THR 6 12.332 15.199 -9.937 34 HG23 THR 6 2HG2 THR 6 12.623 13.600 -10.622 35 H VAL 7 H VAL 7 11.887 15.114 -6.788 36 HA VAL 7 HA VAL 7 10.101 17.446 -6.577 37 HB VAL 7 HB VAL 7 12.418 16.765 -4.766 38 HG11 VAL 7 1HG1 VAL 7 10.404 18.943 -4.883 39 HG12 VAL 7 2HG1 VAL 7 10.884 18.349 -3.293 40 HG13 VAL 7 3HG1 VAL 7 12.099 18.992 -4.398 41 HG21 VAL 7 3HG2 VAL 7 10.413 16.295 -3.158 42 HG22 VAL 7 1HG2 VAL 7 9.535 15.999 -4.659 43 HG23 VAL 7 2HG2 VAL 7 10.966 15.044 -4.272 44 H VAL 8 H VAL 8 10.647 18.819 -8.170 45 HA VAL 8 HA VAL 8 13.493 19.551 -8.419 46 HB VAL 8 HB VAL 8 12.794 18.432 -10.445 47 HG11 VAL 8 1HG1 VAL 8 10.511 20.388 -10.386 48 HG12 VAL 8 2HG1 VAL 8 10.980 19.517 -11.848 49 HG13 VAL 8 3HG1 VAL 8 10.443 18.626 -10.423 50 HG21 VAL 8 3HG2 VAL 8 13.614 19.970 -11.958 51 HG22 VAL 8 1HG2 VAL 8 12.746 21.316 -11.219 52 HG23 VAL 8 2HG2 VAL 8 14.173 20.646 -10.428 53 H THR 9 H THR 9 14.009 21.714 -8.574 54 HA THR 9 HA THR 9 11.790 23.625 -8.253 55 HB THR 9 HB THR 9 14.417 23.652 -6.754 56 HG1 THR 9 HG1 THR 9 13.084 22.309 -5.663 57 HG21 THR 9 3HG2 THR 9 12.323 25.713 -7.185 58 HG22 THR 9 1HG2 THR 9 14.060 25.899 -6.946 59 HG23 THR 9 2HG2 THR 9 13.009 25.576 -5.567 60 H THR 10 H THR 10 12.024 25.612 -9.236 61 HA THR 10 HA THR 10 13.934 25.711 -11.402 62 HB THR 10 HB THR 10 12.748 27.664 -12.172 63 HG1 THR 10 HG1 THR 10 11.570 27.590 -9.588 64 HG21 THR 10 3HG2 THR 10 11.013 26.462 -12.918 65 HG22 THR 10 1HG2 THR 10 10.351 26.264 -11.295 66 HG23 THR 10 2HG2 THR 10 11.602 25.165 -11.878 67 H GLU 11 H GLU 11 14.685 28.185 -11.807 68 HA GLU 11 HA GLU 11 16.572 28.683 -9.683 69 HB2 GLU 11 1HB GLU 11 16.165 29.687 -12.462 70 HB3 GLU 11 2HB GLU 11 17.107 30.674 -11.353 71 HG2 GLU 11 1HG GLU 11 18.352 28.399 -10.915 72 HG3 GLU 11 2HG GLU 11 17.719 28.010 -12.514 73 H SER 12 H SER 12 13.730 30.248 -11.044 74 HA SER 12 HA SER 12 13.964 32.691 -9.645 75 HB2 SER 12 1HB SER 12 11.362 31.429 -10.513 76 HB3 SER 12 2HB SER 12 11.737 33.145 -10.355 77 HG SER 12 HG SER 12 12.299 31.388 -12.411 78 H GLY 13 H GLY 13 12.736 29.555 -8.760 79 HA2 GLY 13 1HA GLY 13 12.857 29.225 -6.265 80 HA3 GLY 13 2HA GLY 13 11.856 30.666 -6.168 81 H LEU 14 H LEU 14 10.352 29.782 -8.606 82 HA LEU 14 HA LEU 14 8.145 28.650 -7.395 83 HB2 LEU 14 1HB LEU 14 7.824 29.649 -9.487 84 HB3 LEU 14 2HB LEU 14 9.087 28.678 -10.241 85 HG LEU 14 HG LEU 14 7.599 26.685 -9.987 86 HD11 LEU 14 1HD1 LEU 14 5.901 26.894 -8.561 87 HD12 LEU 14 2HD1 LEU 14 5.088 27.805 -9.833 88 HD13 LEU 14 3HD1 LEU 14 5.991 28.655 -8.580 89 HD21 LEU 14 3HD2 LEU 14 7.520 27.388 -12.144 90 HD22 LEU 14 1HD2 LEU 14 7.053 29.032 -11.709 91 HD23 LEU 14 2HD2 LEU 14 5.850 27.742 -11.698 92 H LYS 15 H LYS 15 7.442 26.627 -6.958 93 HA LYS 15 HA LYS 15 9.066 24.355 -7.865 94 HB2 LYS 15 1HB LYS 15 8.022 24.524 -5.046 95 HB3 LYS 15 2HB LYS 15 9.202 23.399 -5.705 96 HG2 LYS 15 1HG LYS 15 10.632 25.516 -6.115 97 HG3 LYS 15 2HG LYS 15 9.549 26.266 -4.940 98 HD2 LYS 15 1HD LYS 15 10.922 23.660 -4.360 99 HD3 LYS 15 2HD LYS 15 11.727 25.206 -4.079 100 HE2 LYS 15 1HE LYS 15 10.035 25.880 -2.530 101 HE3 LYS 15 2HE LYS 15 9.031 24.490 -2.938 102 HZ1 LYS 15 3HZ LYS 15 10.103 24.013 -0.900 103 HZ2 LYS 15 1HZ LYS 15 11.617 24.483 -1.489 104 HZ3 LYS 15 2HZ LYS 15 10.882 23.077 -2.074 105 H TYR 16 H TYR 16 7.939 22.257 -7.569 106 HA TYR 16 HA TYR 16 5.070 22.334 -7.229 107 HB2 TYR 16 1HB TYR 16 4.738 21.228 -9.512 108 HB3 TYR 16 2HB TYR 16 5.036 22.963 -9.503 109 HD1 TYR 16 HD2 TYR 16 7.201 23.854 -10.255 110 HD2 TYR 16 HD1 TYR 16 6.325 19.696 -10.469 111 HE1 TYR 16 HE2 TYR 16 9.088 23.543 -11.801 112 HE2 TYR 16 HE1 TYR 16 8.211 19.373 -12.015 113 HH TYR 16 HH TYR 16 9.565 20.646 -13.558 114 H GLU 17 H GLU 17 4.186 20.334 -6.787 115 HA GLU 17 HA GLU 17 6.076 18.074 -6.721 116 HB2 GLU 17 1HB GLU 17 4.216 19.115 -4.629 117 HB3 GLU 17 2HB GLU 17 4.507 17.383 -4.707 118 HG2 GLU 17 1HG GLU 17 7.015 18.092 -4.722 119 HG3 GLU 17 2HG GLU 17 6.390 19.591 -4.038 120 H ASP 18 H ASP 18 5.462 16.471 -7.995 121 HA ASP 18 HA ASP 18 2.903 16.355 -9.212 122 HB2 ASP 18 1HB ASP 18 5.342 14.637 -9.208 123 HB3 ASP 18 2HB ASP 18 3.834 13.936 -9.789 124 H LEU 19 H LEU 19 1.077 15.661 -8.339 125 HA LEU 19 HA LEU 19 1.209 13.752 -6.107 126 HB2 LEU 19 1HB LEU 19 -0.766 15.869 -6.875 127 HB3 LEU 19 2HB LEU 19 -1.229 14.549 -5.804 128 HG LEU 19 HG LEU 19 1.067 16.411 -5.226 129 HD11 LEU 19 1HD1 LEU 19 -0.759 17.864 -5.244 130 HD12 LEU 19 2HD1 LEU 19 -0.610 17.382 -3.554 131 HD13 LEU 19 3HD1 LEU 19 -1.850 16.652 -4.574 132 HD21 LEU 19 3HD2 LEU 19 -0.230 14.136 -3.864 133 HD22 LEU 19 1HD2 LEU 19 0.177 15.523 -2.854 134 HD23 LEU 19 2HD2 LEU 19 1.436 14.711 -3.784 135 H THR 20 H THR 20 -0.107 14.311 -9.283 136 HA THR 20 HA THR 20 -0.796 11.514 -9.518 137 HB THR 20 HB THR 20 -2.978 13.529 -10.052 138 HG1 THR 20 HG1 THR 20 -3.907 12.647 -8.091 139 HG21 THR 20 3HG2 THR 20 -2.808 11.169 -11.163 140 HG22 THR 20 1HG2 THR 20 -4.349 11.724 -10.512 141 HG23 THR 20 2HG2 THR 20 -3.356 10.600 -9.586 142 H GLU 21 H GLU 21 0.109 10.971 -11.384 143 HA GLU 21 HA GLU 21 0.861 12.789 -13.389 144 HB2 GLU 21 1HB GLU 21 1.889 10.544 -13.005 145 HB3 GLU 21 2HB GLU 21 0.447 9.811 -13.693 146 HG2 GLU 21 1HG GLU 21 1.929 11.849 -15.277 147 HG3 GLU 21 2HG GLU 21 2.576 10.214 -15.151 148 H GLY 22 H GLY 22 0.048 13.145 -15.480 149 HA2 GLY 22 1HA GLY 22 -2.713 12.229 -15.951 150 HA3 GLY 22 2HA GLY 22 -2.317 13.937 -16.077 151 H SER 23 H SER 23 -2.046 10.805 -17.560 152 HA SER 23 HA SER 23 -0.426 11.730 -19.758 153 HB2 SER 23 1HB SER 23 -0.474 9.348 -18.822 154 HB3 SER 23 2HB SER 23 -2.005 9.160 -19.675 155 HG SER 23 HG SER 23 -0.987 9.276 -21.572 156 H GLY 24 H GLY 24 -2.283 13.514 -19.853 157 HA2 GLY 24 1HA GLY 24 -4.266 12.595 -21.842 158 HA3 GLY 24 2HA GLY 24 -4.530 13.935 -20.736 159 H ALA 25 H ALA 25 -2.998 15.799 -20.982 160 HA ALA 25 HA ALA 25 -1.519 16.177 -23.355 161 HB1 ALA 25 1HB ALA 25 -3.484 18.076 -23.907 162 HB2 ALA 25 2HB ALA 25 -3.118 16.620 -24.834 163 HB3 ALA 25 3HB ALA 25 -4.364 16.582 -23.587 164 H GLU 26 H GLU 26 -0.192 17.883 -23.107 165 HA GLU 26 HA GLU 26 -0.185 19.316 -20.664 166 HB2 GLU 26 1HB GLU 26 1.907 18.873 -21.732 167 HB3 GLU 26 2HB GLU 26 1.385 19.656 -23.217 168 HG2 GLU 26 1HG GLU 26 1.335 21.810 -22.060 169 HG3 GLU 26 2HG GLU 26 1.876 21.021 -20.580 170 H ALA 27 H ALA 27 -0.841 21.345 -20.155 171 HA ALA 27 HA ALA 27 -2.951 22.537 -21.495 172 HB1 ALA 27 1HB ALA 27 -3.000 23.905 -19.734 173 HB2 ALA 27 2HB ALA 27 -1.642 22.964 -19.115 174 HB3 ALA 27 3HB ALA 27 -1.347 24.456 -20.007 175 H ARG 28 H ARG 28 -3.043 23.548 -23.381 176 HA ARG 28 HA ARG 28 -0.643 24.465 -24.693 177 HB2 ARG 28 1HB ARG 28 -3.546 24.370 -25.494 178 HB3 ARG 28 2HB ARG 28 -2.325 25.140 -26.499 179 HG2 ARG 28 1HG ARG 28 -1.914 22.333 -25.579 180 HG3 ARG 28 2HG ARG 28 -3.007 22.667 -26.924 181 HD2 ARG 28 1HD ARG 28 -1.035 24.058 -27.861 182 HD3 ARG 28 2HD ARG 28 -0.057 23.134 -26.722 183 HE ARG 28 HE ARG 28 -1.579 21.310 -28.156 184 HH11 ARG 28 1HH1 ARG 28 0.916 23.659 -28.773 185 HH12 ARG 28 2HH1 ARG 28 1.572 22.799 -30.126 186 HH21 ARG 28 1HH2 ARG 28 -0.724 20.169 -29.936 187 HH22 ARG 28 2HH2 ARG 28 0.638 20.814 -30.787 188 H ALA 29 H ALA 29 -0.524 26.630 -25.687 189 HA ALA 29 HA ALA 29 -1.409 28.655 -23.766 190 HB1 ALA 29 1HB ALA 29 0.734 29.242 -23.984 191 HB2 ALA 29 2HB ALA 29 0.930 28.309 -25.469 192 HB3 ALA 29 3HB ALA 29 0.256 29.938 -25.533 193 H GLY 30 H GLY 30 -2.414 30.591 -24.425 194 HA2 GLY 30 1HA GLY 30 -3.636 31.990 -25.815 195 HA3 GLY 30 2HA GLY 30 -3.213 30.958 -27.173 196 H GLN 31 H GLN 31 -4.341 28.917 -24.884 197 HA GLN 31 HA GLN 31 -7.105 29.115 -25.886 198 HB2 GLN 31 1HB GLN 31 -5.510 27.102 -26.522 199 HB3 GLN 31 2HB GLN 31 -5.988 26.515 -24.935 200 HG2 GLN 31 1HG GLN 31 -8.201 26.260 -25.547 201 HG3 GLN 31 2HG GLN 31 -8.063 27.387 -26.895 202 HE21 GLN 31 2HE2 GLN 31 -7.273 24.169 -25.765 203 HE22 GLN 31 1HE2 GLN 31 -7.049 23.467 -27.327 204 H THR 32 H THR 32 -8.792 28.472 -24.455 205 HA THR 32 HA THR 32 -8.190 29.113 -21.683 206 HB THR 32 HB THR 32 -10.922 28.488 -22.788 207 HG1 THR 32 HG1 THR 32 -11.069 30.539 -23.526 208 HG21 THR 32 3HG2 THR 32 -10.978 30.582 -20.929 209 HG22 THR 32 1HG2 THR 32 -9.861 29.390 -20.265 210 HG23 THR 32 2HG2 THR 32 -11.509 28.918 -20.680 211 H VAL 33 H VAL 33 -7.521 27.488 -20.437 212 HA VAL 33 HA VAL 33 -8.716 24.827 -20.804 213 HB VAL 33 HB VAL 33 -6.822 23.923 -19.598 214 HG11 VAL 33 1HG1 VAL 33 -6.726 25.052 -22.112 215 HG12 VAL 33 2HG1 VAL 33 -5.257 25.649 -21.337 216 HG13 VAL 33 3HG1 VAL 33 -5.559 23.914 -21.438 217 HG21 VAL 33 3HG2 VAL 33 -5.803 25.182 -18.072 218 HG22 VAL 33 1HG2 VAL 33 -5.015 26.045 -19.392 219 HG23 VAL 33 2HG2 VAL 33 -6.529 26.652 -18.722 220 H SER 34 H SER 34 -9.649 23.727 -19.107 221 HA SER 34 HA SER 34 -10.405 25.393 -16.817 222 HB2 SER 34 1HB SER 34 -12.424 24.584 -17.435 223 HB3 SER 34 2HB SER 34 -11.713 23.259 -18.357 224 HG SER 34 HG SER 34 -12.415 22.096 -16.748 225 H VAL 35 H VAL 35 -9.416 25.106 -14.943 226 HA VAL 35 HA VAL 35 -8.613 22.420 -14.121 227 HB VAL 35 HB VAL 35 -6.388 22.960 -13.594 228 HG11 VAL 35 1HG1 VAL 35 -6.854 22.626 -16.017 229 HG12 VAL 35 2HG1 VAL 35 -6.885 24.380 -16.206 230 HG13 VAL 35 3HG1 VAL 35 -5.403 23.574 -15.691 231 HG21 VAL 35 3HG2 VAL 35 -7.296 25.792 -13.873 232 HG22 VAL 35 1HG2 VAL 35 -6.400 25.023 -12.564 233 HG23 VAL 35 2HG2 VAL 35 -5.591 25.396 -14.086 234 H HIS 36 H HIS 36 -8.190 22.241 -11.830 235 HA HIS 36 HA HIS 36 -9.749 24.193 -10.300 236 HB2 HIS 36 1HB HIS 36 -9.245 21.301 -10.089 237 HB3 HIS 36 2HB HIS 36 -9.226 22.159 -8.551 238 HD1 HIS 36 HD1 HIS 36 -11.494 24.196 -9.150 239 HD2 HIS 36 HD2 HIS 36 -11.703 20.118 -9.919 240 HE1 HIS 36 HE1 HIS 36 -13.947 23.646 -9.201 241 H TYR 37 H TYR 37 -8.862 25.484 -8.805 242 HA TYR 37 HA TYR 37 -6.040 25.022 -8.091 243 HB2 TYR 37 1HB TYR 37 -5.662 27.391 -8.079 244 HB3 TYR 37 2HB TYR 37 -6.425 26.982 -9.611 245 HD1 TYR 37 HD1 TYR 37 -6.965 28.543 -6.314 246 HD2 TYR 37 HD2 TYR 37 -8.578 27.843 -10.188 247 HE1 TYR 37 HE1 TYR 37 -8.712 30.220 -5.883 248 HE2 TYR 37 HE2 TYR 37 -10.328 29.519 -9.769 249 HH TYR 37 HH TYR 37 -10.939 30.801 -6.669 250 H THR 38 H THR 38 -5.413 25.409 -5.978 251 HA THR 38 HA THR 38 -7.513 26.135 -4.059 252 HB THR 38 HB THR 38 -5.769 24.108 -2.951 253 HG1 THR 38 HG1 THR 38 -6.835 22.394 -4.248 254 HG21 THR 38 3HG2 THR 38 -7.659 24.275 -1.719 255 HG22 THR 38 1HG2 THR 38 -8.263 23.073 -2.858 256 HG23 THR 38 2HG2 THR 38 -8.638 24.780 -3.096 257 H GLY 39 H GLY 39 -6.804 27.171 -2.202 258 HA2 GLY 39 1HA GLY 39 -3.953 27.946 -2.234 259 HA3 GLY 39 2HA GLY 39 -5.253 29.005 -1.707 260 H TRP 40 H TRP 40 -2.752 27.329 -0.574 261 HA TRP 40 HA TRP 40 -4.054 26.895 2.026 262 HB2 TRP 40 1HB TRP 40 -2.118 25.057 0.617 263 HB3 TRP 40 2HB TRP 40 -2.444 24.956 2.345 264 HD1 TRP 40 HD1 TRP 40 -5.554 25.233 2.408 265 HE1 TRP 40 HE1 TRP 40 -7.054 23.390 1.420 266 HE3 TRP 40 HE3 TRP 40 -2.176 23.037 -0.740 267 HZ2 TRP 40 HZ2 TRP 40 -6.835 21.283 -0.446 268 HZ3 TRP 40 HZ3 TRP 40 -2.902 21.112 -2.091 269 HH2 TRP 40 HH2 TRP 40 -5.183 20.255 -1.945 270 H LEU 41 H LEU 41 -2.983 27.689 3.755 271 HA LEU 41 HA LEU 41 -0.716 29.387 3.277 272 HB2 LEU 41 1HB LEU 41 -2.571 28.840 5.505 273 HB3 LEU 41 2HB LEU 41 -0.957 29.381 5.961 274 HG LEU 41 HG LEU 41 -2.863 30.873 4.158 275 HD11 LEU 41 1HD1 LEU 41 -3.825 31.315 6.151 276 HD12 LEU 41 2HD1 LEU 41 -2.497 32.467 6.284 277 HD13 LEU 41 3HD1 LEU 41 -2.380 30.892 7.069 278 HD21 LEU 41 3HD2 LEU 41 -1.071 31.999 3.487 279 HD22 LEU 41 1HD2 LEU 41 -0.030 31.088 4.581 280 HD23 LEU 41 2HD2 LEU 41 -0.845 32.545 5.150 281 H THR 42 H THR 42 1.104 29.307 5.003 282 HA THR 42 HA THR 42 2.694 27.095 4.542 283 HB THR 42 HB THR 42 4.134 27.867 6.349 284 HG1 THR 42 HG1 THR 42 3.403 29.578 7.702 285 HG21 THR 42 3HG2 THR 42 4.414 29.140 4.389 286 HG22 THR 42 1HG2 THR 42 4.257 30.332 5.680 287 HG23 THR 42 2HG2 THR 42 2.887 29.991 4.623 288 H ASP 43 H ASP 43 0.604 27.767 7.327 289 HA ASP 43 HA ASP 43 1.277 25.298 8.638 290 HB2 ASP 43 1HB ASP 43 -0.989 27.222 9.204 291 HB3 ASP 43 2HB ASP 43 -0.428 25.937 10.270 292 H GLY 44 H GLY 44 -0.887 26.232 6.177 293 HA2 GLY 44 1HA GLY 44 -1.869 24.340 4.934 294 HA3 GLY 44 2HA GLY 44 -2.344 23.680 6.493 295 H GLN 45 H GLN 45 -2.885 26.730 7.098 296 HA GLN 45 HA GLN 45 -5.641 26.635 7.027 297 HB2 GLN 45 1HB GLN 45 -3.959 28.339 8.127 298 HB3 GLN 45 2HB GLN 45 -4.275 29.270 6.669 299 HG2 GLN 45 1HG GLN 45 -6.680 29.202 7.173 300 HG3 GLN 45 2HG GLN 45 -6.323 28.331 8.663 301 HE21 GLN 45 2HE2 GLN 45 -4.576 29.483 10.018 302 HE22 GLN 45 1HE2 GLN 45 -4.812 31.181 10.236 303 H LYS 46 H LYS 46 -6.936 26.398 5.338 304 HA LYS 46 HA LYS 46 -6.155 27.105 2.679 305 HB2 LYS 46 1HB LYS 46 -7.682 25.182 3.372 306 HB3 LYS 46 2HB LYS 46 -8.942 26.391 3.585 307 HG2 LYS 46 1HG LYS 46 -8.282 27.051 1.133 308 HG3 LYS 46 2HG LYS 46 -7.666 25.397 1.089 309 HD2 LYS 46 1HD LYS 46 -10.393 25.822 2.185 310 HD3 LYS 46 2HD LYS 46 -10.176 25.998 0.442 311 HE2 LYS 46 1HE LYS 46 -9.072 23.752 0.442 312 HE3 LYS 46 2HE LYS 46 -9.535 23.588 2.135 313 HZ1 LYS 46 3HZ LYS 46 -11.513 22.880 1.485 314 HZ2 LYS 46 1HZ LYS 46 -11.069 23.043 -0.140 315 HZ3 LYS 46 2HZ LYS 46 -11.800 24.335 0.671 316 H PHE 47 H PHE 47 -6.657 28.863 1.495 317 HA PHE 47 HA PHE 47 -8.585 30.789 2.585 318 HB2 PHE 47 1HB PHE 47 -7.040 32.645 1.990 319 HB3 PHE 47 2HB PHE 47 -6.413 31.612 3.270 320 HD1 PHE 47 HD2 PHE 47 -6.098 32.522 -0.278 321 HD2 PHE 47 HD1 PHE 47 -4.429 30.334 2.970 322 HE1 PHE 47 HE2 PHE 47 -4.033 32.181 -1.572 323 HE2 PHE 47 HE1 PHE 47 -2.362 29.991 1.681 324 HZ PHE 47 HZ PHE 47 -2.162 30.914 -0.594 325 H ASP 48 H ASP 48 -8.497 28.804 0.328 326 HA ASP 48 HA ASP 48 -9.942 30.264 -1.563 327 HB2 ASP 48 1HB ASP 48 -7.100 30.499 -1.874 328 HB3 ASP 48 2HB ASP 48 -7.758 29.600 -3.238 329 H SER 49 H SER 49 -11.177 28.848 -2.617 330 HA SER 49 HA SER 49 -10.145 26.265 -3.424 331 HB2 SER 49 1HB SER 49 -10.815 25.362 -1.430 332 HB3 SER 49 2HB SER 49 -12.017 26.620 -1.142 333 HG SER 49 HG SER 49 -13.319 25.039 -1.695 334 H SER 50 H SER 50 -10.614 26.759 -5.529 335 HA SER 50 HA SER 50 -12.890 28.013 -6.507 336 HB2 SER 50 1HB SER 50 -10.611 27.006 -7.629 337 HB3 SER 50 2HB SER 50 -11.824 25.879 -8.237 338 HG SER 50 HG SER 50 -12.979 28.077 -8.636 339 H LYS 51 H LYS 51 -12.444 24.768 -5.390 340 HA LYS 51 HA LYS 51 -14.603 23.514 -6.686 341 HB2 LYS 51 1HB LYS 51 -13.112 22.961 -4.136 342 HB3 LYS 51 2HB LYS 51 -14.502 21.986 -4.594 343 HG2 LYS 51 1HG LYS 51 -12.807 20.741 -5.478 344 HG3 LYS 51 2HG LYS 51 -13.204 21.762 -6.861 345 HD2 LYS 51 1HD LYS 51 -11.273 22.961 -6.703 346 HD3 LYS 51 2HD LYS 51 -11.182 22.788 -4.949 347 HE2 LYS 51 1HE LYS 51 -10.738 20.471 -6.809 348 HE3 LYS 51 2HE LYS 51 -9.432 21.561 -6.347 349 HZ1 LYS 51 3HZ LYS 51 -10.982 19.720 -4.637 350 HZ2 LYS 51 1HZ LYS 51 -10.148 21.032 -3.971 351 HZ3 LYS 51 2HZ LYS 51 -9.304 19.837 -4.819 352 H ASP 52 H ASP 52 -14.512 25.835 -4.181 353 HA ASP 52 HA ASP 52 -16.775 25.252 -2.684 354 HB2 ASP 52 1HB ASP 52 -15.378 27.027 -1.950 355 HB3 ASP 52 2HB ASP 52 -15.538 27.884 -3.480 356 H ARG 53 H ARG 53 -16.513 27.028 -5.742 357 HA ARG 53 HA ARG 53 -19.335 27.521 -5.904 358 HB2 ARG 53 1HB ARG 53 -17.195 28.704 -7.045 359 HB3 ARG 53 2HB ARG 53 -17.691 27.651 -8.363 360 HG2 ARG 53 1HG ARG 53 -18.799 29.652 -8.781 361 HG3 ARG 53 2HG ARG 53 -20.027 28.634 -8.025 362 HD2 ARG 53 1HD ARG 53 -18.368 30.361 -6.266 363 HD3 ARG 53 2HD ARG 53 -19.602 31.137 -7.258 364 HE ARG 53 HE ARG 53 -20.880 29.040 -6.044 365 HH11 ARG 53 1HH1 ARG 53 -19.085 31.823 -4.970 366 HH12 ARG 53 2HH1 ARG 53 -19.964 31.979 -3.485 367 HH21 ARG 53 1HH2 ARG 53 -22.044 29.235 -4.092 368 HH22 ARG 53 2HH2 ARG 53 -21.646 30.506 -2.986 369 H ASN 54 H ASN 54 -17.539 24.779 -6.291 370 HA ASN 54 HA ASN 54 -17.972 22.718 -7.150 371 HB2 ASN 54 1HB ASN 54 -20.734 23.761 -7.795 372 HB3 ASN 54 2HB ASN 54 -20.252 22.082 -7.564 373 HD21 ASN 54 2HD2 ASN 54 -22.131 24.094 -6.196 374 HD22 ASN 54 1HD2 ASN 54 -21.794 23.866 -4.516 375 H ASP 55 H ASP 55 -16.808 24.710 -8.818 376 HA ASP 55 HA ASP 55 -17.307 23.483 -11.389 377 HB2 ASP 55 1HB ASP 55 -18.619 25.885 -10.781 378 HB3 ASP 55 2HB ASP 55 -17.258 26.347 -11.800 379 HA PRO 56 HA PRO 56 -12.965 24.086 -11.727 380 HB2 PRO 56 1HB PRO 56 -12.690 23.889 -14.421 381 HB3 PRO 56 2HB PRO 56 -13.020 22.496 -13.385 382 HG2 PRO 56 1HG PRO 56 -14.914 24.109 -15.050 383 HG3 PRO 56 2HG PRO 56 -14.823 22.350 -14.847 384 HD2 PRO 56 1HD PRO 56 -16.636 23.875 -13.537 385 HD3 PRO 56 2HD PRO 56 -15.947 22.397 -12.835 386 H PHE 57 H PHE 57 -11.337 25.485 -12.737 387 HA PHE 57 HA PHE 57 -12.442 28.151 -13.277 388 HB2 PHE 57 1HB PHE 57 -10.973 28.088 -11.354 389 HB3 PHE 57 2HB PHE 57 -9.712 27.299 -12.296 390 HD1 PHE 57 HD2 PHE 57 -11.857 30.226 -13.119 391 HD2 PHE 57 HD1 PHE 57 -7.932 28.769 -12.348 392 HE1 PHE 57 HE2 PHE 57 -10.928 32.426 -13.709 393 HE2 PHE 57 HE1 PHE 57 -6.997 30.967 -12.937 394 HZ PHE 57 HZ PHE 57 -8.495 32.799 -13.620 395 H ALA 58 H ALA 58 -12.680 28.418 -15.413 396 HA ALA 58 HA ALA 58 -10.684 27.359 -17.256 397 HB1 ALA 58 1HB ALA 58 -13.486 28.187 -17.441 398 HB2 ALA 58 2HB ALA 58 -12.494 28.668 -18.819 399 HB3 ALA 58 3HB ALA 58 -12.596 26.969 -18.357 400 H PHE 59 H PHE 59 -8.999 28.545 -17.838 401 HA PHE 59 HA PHE 59 -9.342 31.412 -18.285 402 HB2 PHE 59 1HB PHE 59 -7.469 32.050 -16.963 403 HB3 PHE 59 2HB PHE 59 -8.458 31.010 -15.943 404 HD1 PHE 59 HD2 PHE 59 -7.717 28.760 -15.373 405 HD2 PHE 59 HD1 PHE 59 -5.294 31.370 -17.704 406 HE1 PHE 59 HE2 PHE 59 -5.769 27.316 -14.958 407 HE2 PHE 59 HE1 PHE 59 -3.341 29.930 -17.292 408 HZ PHE 59 HZ PHE 59 -3.577 27.901 -15.917 409 H VAL 60 H VAL 60 -7.733 32.347 -19.654 410 HA VAL 60 HA VAL 60 -6.754 30.486 -21.630 411 HB VAL 60 HB VAL 60 -6.388 33.482 -21.526 412 HG11 VAL 60 1HG1 VAL 60 -6.253 33.081 -24.065 413 HG12 VAL 60 2HG1 VAL 60 -4.848 32.675 -23.078 414 HG13 VAL 60 3HG1 VAL 60 -5.933 31.401 -23.635 415 HG21 VAL 60 3HG2 VAL 60 -8.722 31.851 -22.099 416 HG22 VAL 60 1HG2 VAL 60 -8.592 33.593 -21.851 417 HG23 VAL 60 2HG2 VAL 60 -8.292 32.905 -23.447 418 H LEU 61 H LEU 61 -4.857 29.506 -21.463 419 HA LEU 61 HA LEU 61 -2.861 30.285 -19.598 420 HB2 LEU 61 1HB LEU 61 -2.940 28.004 -20.041 421 HB3 LEU 61 2HB LEU 61 -3.025 28.248 -21.784 422 HG LEU 61 HG LEU 61 -0.698 28.733 -21.910 423 HD11 LEU 61 1HD1 LEU 61 -1.021 29.334 -19.088 424 HD12 LEU 61 2HD1 LEU 61 0.200 29.889 -20.232 425 HD13 LEU 61 3HD1 LEU 61 0.400 28.341 -19.412 426 HD21 LEU 61 3HD2 LEU 61 -1.697 26.290 -21.091 427 HD22 LEU 61 1HD2 LEU 61 -0.321 26.562 -20.022 428 HD23 LEU 61 2HD2 LEU 61 -0.097 26.592 -21.771 429 H GLY 62 H GLY 62 -1.275 31.722 -19.805 430 HA2 GLY 62 1HA GLY 62 0.517 32.790 -20.893 431 HA3 GLY 62 2HA GLY 62 -0.140 32.271 -22.438 432 H GLY 63 H GLY 63 -2.268 33.741 -20.140 433 HA2 GLY 63 1HA GLY 63 -2.513 36.052 -21.933 434 HA3 GLY 63 2HA GLY 63 -3.714 35.525 -20.763 435 H GLY 64 H GLY 64 -3.935 36.847 -19.094 436 HA2 GLY 64 1HA GLY 64 -1.603 37.887 -17.726 437 HA3 GLY 64 2HA GLY 64 -2.591 39.107 -18.514 438 H MET 65 H MET 65 -3.727 36.160 -16.934 439 HA MET 65 HA MET 65 -4.950 37.830 -14.841 440 HB2 MET 65 1HB MET 65 -6.210 35.701 -16.543 441 HB3 MET 65 2HB MET 65 -6.848 36.066 -14.945 442 HG2 MET 65 1HG MET 65 -6.442 38.219 -16.985 443 HG3 MET 65 2HG MET 65 -7.894 37.220 -16.976 444 HE1 MET 65 3HE MET 65 -8.399 40.790 -16.028 445 HE2 MET 65 1HE MET 65 -8.778 39.464 -17.127 446 HE3 MET 65 2HE MET 65 -9.821 39.785 -15.742 447 H VAL 66 H VAL 66 -2.505 36.118 -14.950 448 HA VAL 66 HA VAL 66 -3.053 34.625 -12.509 449 HB VAL 66 HB VAL 66 -2.033 32.582 -13.257 450 HG11 VAL 66 1HG1 VAL 66 -4.046 33.426 -15.336 451 HG12 VAL 66 2HG1 VAL 66 -3.698 31.783 -14.793 452 HG13 VAL 66 3HG1 VAL 66 -4.456 32.935 -13.693 453 HG21 VAL 66 3HG2 VAL 66 -0.366 33.359 -14.766 454 HG22 VAL 66 1HG2 VAL 66 -1.438 32.301 -15.683 455 HG23 VAL 66 2HG2 VAL 66 -1.575 34.052 -15.846 456 H ILE 67 H ILE 67 -0.814 33.521 -11.847 457 HA ILE 67 HA ILE 67 1.151 35.699 -11.930 458 HB ILE 67 HB ILE 67 2.039 34.906 -9.892 459 HG12 ILE 67 1HG1 ILE 67 0.375 32.416 -10.321 460 HG13 ILE 67 2HG1 ILE 67 2.130 32.529 -10.395 461 HG21 ILE 67 1HG2 ILE 67 -0.615 35.646 -10.123 462 HG22 ILE 67 2HG2 ILE 67 -0.656 34.242 -9.057 463 HG23 ILE 67 3HG2 ILE 67 0.344 35.634 -8.643 464 HD11 ILE 67 3HD1 ILE 67 1.705 33.456 -7.910 465 HD12 ILE 67 1HD1 ILE 67 0.338 32.354 -8.073 466 HD13 ILE 67 2HD1 ILE 67 1.984 31.758 -8.294 467 H LYS 68 H LYS 68 3.469 35.035 -11.861 468 HA LYS 68 HA LYS 68 4.244 33.676 -14.117 469 HB2 LYS 68 1HB LYS 68 6.481 33.396 -12.902 470 HB3 LYS 68 2HB LYS 68 5.867 35.033 -13.095 471 HG2 LYS 68 1HG LYS 68 4.828 34.166 -10.664 472 HG3 LYS 68 2HG LYS 68 6.490 33.572 -10.691 473 HD2 LYS 68 1HD LYS 68 5.641 36.421 -11.213 474 HD3 LYS 68 2HD LYS 68 6.321 35.817 -9.700 475 HE2 LYS 68 1HE LYS 68 8.352 35.130 -10.964 476 HE3 LYS 68 2HE LYS 68 7.673 35.905 -12.394 477 HZ1 LYS 68 3HZ LYS 68 7.605 37.703 -10.225 478 HZ2 LYS 68 1HZ LYS 68 8.433 37.846 -11.693 479 HZ3 LYS 68 2HZ LYS 68 9.172 37.084 -10.377 480 H GLY 69 H GLY 69 4.165 32.385 -10.794 481 HA2 GLY 69 1HA GLY 69 5.044 29.804 -11.360 482 HA3 GLY 69 2HA GLY 69 3.995 30.233 -10.018 483 H TRP 70 H TRP 70 1.898 31.245 -11.835 484 HA TRP 70 HA TRP 70 0.480 28.795 -12.157 485 HB2 TRP 70 1HB TRP 70 -0.134 31.589 -12.156 486 HB3 TRP 70 2HB TRP 70 -0.818 30.864 -13.609 487 HD1 TRP 70 HD1 TRP 70 -3.113 29.764 -13.312 488 HE1 TRP 70 HE1 TRP 70 -4.530 28.974 -11.314 489 HE3 TRP 70 HE3 TRP 70 0.270 30.541 -9.559 490 HZ2 TRP 70 HZ2 TRP 70 -4.251 28.716 -8.517 491 HZ3 TRP 70 HZ3 TRP 70 -0.384 29.998 -7.250 492 HH2 TRP 70 HH2 TRP 70 -2.599 29.104 -6.742 493 H ASP 71 H ASP 71 1.530 31.247 -14.528 494 HA ASP 71 HA ASP 71 0.830 29.880 -16.834 495 HB2 ASP 71 1HB ASP 71 2.849 31.981 -16.190 496 HB3 ASP 71 2HB ASP 71 2.942 31.194 -17.763 497 H GLU 72 H GLU 72 3.901 29.783 -15.049 498 HA GLU 72 HA GLU 72 5.178 27.960 -16.799 499 HB2 GLU 72 1HB GLU 72 6.183 29.512 -14.968 500 HB3 GLU 72 2HB GLU 72 5.852 28.169 -13.883 501 HG2 GLU 72 1HG GLU 72 8.039 27.793 -14.489 502 HG3 GLU 72 2HG GLU 72 7.154 26.757 -15.608 503 H GLY 73 H GLY 73 3.240 27.554 -13.879 504 HA2 GLY 73 1HA GLY 73 3.715 24.801 -13.498 505 HA3 GLY 73 2HA GLY 73 2.322 25.691 -12.903 506 H VAL 74 H VAL 74 0.910 26.410 -15.007 507 HA VAL 74 HA VAL 74 -0.277 23.997 -15.893 508 HB VAL 74 HB VAL 74 -1.628 25.496 -17.396 509 HG11 VAL 74 1HG1 VAL 74 -1.820 26.811 -14.779 510 HG12 VAL 74 2HG1 VAL 74 -3.029 25.900 -15.686 511 HG13 VAL 74 3HG1 VAL 74 -1.821 25.048 -14.724 512 HG21 VAL 74 3HG2 VAL 74 0.500 27.246 -17.020 513 HG22 VAL 74 1HG2 VAL 74 -1.038 27.604 -17.805 514 HG23 VAL 74 2HG2 VAL 74 -0.822 27.948 -16.089 515 H GLN 75 H GLN 75 2.126 26.118 -17.253 516 HA GLN 75 HA GLN 75 1.976 25.452 -19.946 517 HB2 GLN 75 1HB GLN 75 4.018 26.558 -18.144 518 HB3 GLN 75 2HB GLN 75 4.668 25.738 -19.558 519 HG2 GLN 75 1HG GLN 75 2.512 27.799 -19.812 520 HG3 GLN 75 2HG GLN 75 4.212 28.253 -19.702 521 HE21 GLN 75 2HE2 GLN 75 4.618 28.957 -21.706 522 HE22 GLN 75 1HE2 GLN 75 4.426 28.016 -23.142 523 H GLY 76 H GLY 76 3.056 23.577 -17.255 524 HA2 GLY 76 1HA GLY 76 4.135 21.538 -19.098 525 HA3 GLY 76 2HA GLY 76 4.608 21.704 -17.414 526 H MET 77 H MET 77 1.915 22.090 -16.426 527 HA MET 77 HA MET 77 1.215 19.506 -15.768 528 HB2 MET 77 1HB MET 77 -0.437 22.024 -15.879 529 HB3 MET 77 2HB MET 77 -1.081 20.506 -15.267 530 HG2 MET 77 1HG MET 77 0.187 20.564 -13.377 531 HG3 MET 77 2HG MET 77 1.480 21.487 -14.139 532 HE1 MET 77 3HE MET 77 1.011 22.748 -11.302 533 HE2 MET 77 1HE MET 77 2.029 23.171 -12.680 534 HE3 MET 77 2HE MET 77 0.995 24.393 -11.940 535 H LYS 78 H LYS 78 -0.457 18.099 -16.434 536 HA LYS 78 HA LYS 78 -1.357 18.518 -19.210 537 HB2 LYS 78 1HB LYS 78 -0.650 15.904 -17.864 538 HB3 LYS 78 2HB LYS 78 -1.259 16.074 -19.505 539 HG2 LYS 78 1HG LYS 78 0.784 17.536 -19.932 540 HG3 LYS 78 2HG LYS 78 1.404 16.906 -18.404 541 HD2 LYS 78 1HD LYS 78 0.851 14.586 -19.435 542 HD3 LYS 78 2HD LYS 78 0.854 15.460 -20.969 543 HE2 LYS 78 1HE LYS 78 3.138 16.362 -20.208 544 HE3 LYS 78 2HE LYS 78 3.103 15.057 -19.024 545 HZ1 LYS 78 3HZ LYS 78 2.444 13.847 -21.377 546 HZ2 LYS 78 1HZ LYS 78 3.959 13.800 -20.625 547 HZ3 LYS 78 2HZ LYS 78 3.646 14.948 -21.827 548 H VAL 79 H VAL 79 -3.338 17.244 -19.767 549 HA VAL 79 HA VAL 79 -5.479 17.940 -18.141 550 HB VAL 79 HB VAL 79 -5.390 15.710 -20.179 551 HG11 VAL 79 1HG1 VAL 79 -7.919 16.838 -20.168 552 HG12 VAL 79 2HG1 VAL 79 -7.462 15.279 -19.478 553 HG13 VAL 79 3HG1 VAL 79 -7.496 16.720 -18.461 554 HG21 VAL 79 3HG2 VAL 79 -5.423 17.244 -21.798 555 HG22 VAL 79 1HG2 VAL 79 -6.669 18.185 -20.978 556 HG23 VAL 79 2HG2 VAL 79 -4.971 18.423 -20.566 557 H GLY 80 H GLY 80 -6.176 17.166 -16.266 558 HA2 GLY 80 1HA GLY 80 -6.876 15.557 -14.731 559 HA3 GLY 80 2HA GLY 80 -6.160 14.313 -15.745 560 H GLY 81 H GLY 81 -3.854 16.627 -15.425 561 HA2 GLY 81 1HA GLY 81 -2.390 15.024 -13.507 562 HA3 GLY 81 2HA GLY 81 -1.771 16.398 -14.412 563 H VAL 82 H VAL 82 -2.230 15.396 -11.403 564 HA VAL 82 HA VAL 82 -2.977 18.066 -10.400 565 HB VAL 82 HB VAL 82 -3.195 15.443 -8.918 566 HG11 VAL 82 1HG1 VAL 82 -3.549 18.272 -8.176 567 HG12 VAL 82 2HG1 VAL 82 -4.809 17.169 -7.619 568 HG13 VAL 82 3HG1 VAL 82 -3.125 16.880 -7.180 569 HG21 VAL 82 3HG2 VAL 82 -5.723 16.646 -9.342 570 HG22 VAL 82 1HG2 VAL 82 -4.900 16.568 -10.900 571 HG23 VAL 82 2HG2 VAL 82 -5.131 15.100 -9.950 572 H ARG 83 H ARG 83 -1.403 19.192 -9.478 573 HA ARG 83 HA ARG 83 0.675 17.830 -7.955 574 HB2 ARG 83 1HB ARG 83 2.503 18.713 -9.139 575 HB3 ARG 83 2HB ARG 83 1.416 18.120 -10.387 576 HG2 ARG 83 1HG ARG 83 0.530 20.530 -10.471 577 HG3 ARG 83 2HG ARG 83 2.006 20.944 -9.596 578 HD2 ARG 83 1HD ARG 83 1.705 19.787 -12.346 579 HD3 ARG 83 2HD ARG 83 2.564 21.243 -11.847 580 HE ARG 83 HE ARG 83 3.920 19.291 -10.578 581 HH11 ARG 83 1HH1 ARG 83 2.919 19.708 -13.886 582 HH12 ARG 83 2HH1 ARG 83 4.260 18.829 -14.540 583 HH21 ARG 83 1HH2 ARG 83 5.691 18.130 -11.427 584 HH22 ARG 83 2HH2 ARG 83 5.836 17.930 -13.141 585 H ARG 84 H ARG 84 1.544 19.060 -6.321 586 HA ARG 84 HA ARG 84 0.077 21.467 -5.654 587 HB2 ARG 84 1HB ARG 84 0.845 19.493 -4.084 588 HB3 ARG 84 2HB ARG 84 2.334 20.424 -3.994 589 HG2 ARG 84 1HG ARG 84 1.346 22.159 -2.864 590 HG3 ARG 84 2HG ARG 84 -0.261 21.796 -3.495 591 HD2 ARG 84 1HD ARG 84 -0.439 21.100 -1.301 592 HD3 ARG 84 2HD ARG 84 -0.013 19.601 -2.127 593 HE ARG 84 HE ARG 84 2.268 21.035 -1.150 594 HH11 ARG 84 1HH1 ARG 84 -0.255 18.792 -0.302 595 HH12 ARG 84 2HH1 ARG 84 0.638 18.078 1.000 596 HH21 ARG 84 1HH2 ARG 84 3.454 20.104 0.562 597 HH22 ARG 84 2HH2 ARG 84 2.747 18.826 1.491 598 H LEU 85 H LEU 85 0.729 23.283 -6.623 599 HA LEU 85 HA LEU 85 3.529 23.729 -7.232 600 HB2 LEU 85 1HB LEU 85 1.711 24.331 -8.813 601 HB3 LEU 85 2HB LEU 85 1.165 25.548 -7.662 602 HG LEU 85 HG LEU 85 3.742 26.300 -7.984 603 HD11 LEU 85 1HD1 LEU 85 3.739 26.241 -10.668 604 HD12 LEU 85 2HD1 LEU 85 2.996 24.678 -10.331 605 HD13 LEU 85 3HD1 LEU 85 4.585 25.060 -9.668 606 HD21 LEU 85 3HD2 LEU 85 1.420 27.478 -8.300 607 HD22 LEU 85 1HD2 LEU 85 1.761 27.221 -10.011 608 HD23 LEU 85 2HD2 LEU 85 2.880 28.157 -9.020 609 H THR 86 H THR 86 4.887 24.687 -5.885 610 HA THR 86 HA THR 86 3.810 26.237 -3.641 611 HB THR 86 HB THR 86 6.707 25.527 -3.856 612 HG1 THR 86 HG1 THR 86 4.703 23.724 -2.930 613 HG21 THR 86 3HG2 THR 86 5.106 25.214 -1.382 614 HG22 THR 86 1HG2 THR 86 5.335 26.857 -1.979 615 HG23 THR 86 2HG2 THR 86 6.735 25.852 -1.604 616 H ILE 87 H ILE 87 3.853 28.377 -3.734 617 HA ILE 87 HA ILE 87 5.920 29.673 -5.390 618 HB ILE 87 HB ILE 87 3.169 30.788 -4.855 619 HG12 ILE 87 1HG1 ILE 87 3.066 30.241 -7.462 620 HG13 ILE 87 2HG1 ILE 87 4.182 28.966 -6.985 621 HG21 ILE 87 1HG2 ILE 87 5.309 31.583 -6.825 622 HG22 ILE 87 2HG2 ILE 87 3.727 32.341 -6.651 623 HG23 ILE 87 3HG2 ILE 87 4.901 32.442 -5.339 624 HD11 ILE 87 3HD1 ILE 87 1.326 29.140 -6.649 625 HD12 ILE 87 1HD1 ILE 87 2.401 27.752 -6.484 626 HD13 ILE 87 2HD1 ILE 87 2.141 28.834 -5.115 627 HA PRO 88 HA PRO 88 7.172 31.599 -1.607 628 HB2 PRO 88 1HB PRO 88 8.832 33.448 -2.700 629 HB3 PRO 88 2HB PRO 88 9.258 31.739 -2.560 630 HG2 PRO 88 1HG PRO 88 8.218 33.243 -4.930 631 HG3 PRO 88 2HG PRO 88 9.512 32.033 -4.852 632 HD2 PRO 88 1HD PRO 88 7.010 31.438 -5.699 633 HD3 PRO 88 2HD PRO 88 8.031 30.267 -4.841 634 HA PRO 89 HA PRO 89 4.864 35.293 -1.004 635 HB2 PRO 89 1HB PRO 89 6.524 36.842 0.484 636 HB3 PRO 89 2HB PRO 89 5.724 35.401 1.124 637 HG2 PRO 89 1HG PRO 89 8.525 35.724 0.116 638 HG3 PRO 89 2HG PRO 89 7.945 34.856 1.549 639 HD2 PRO 89 1HD PRO 89 8.586 33.594 -0.759 640 HD3 PRO 89 2HD PRO 89 7.309 33.008 0.327 641 H GLN 90 H GLN 90 7.669 35.341 -2.862 642 HA GLN 90 HA GLN 90 7.515 38.186 -3.482 643 HB2 GLN 90 1HB GLN 90 9.409 36.008 -4.364 644 HB3 GLN 90 2HB GLN 90 9.472 37.652 -4.986 645 HG2 GLN 90 1HG GLN 90 9.628 38.321 -2.488 646 HG3 GLN 90 2HG GLN 90 10.104 36.641 -2.251 647 HE21 GLN 90 2HE2 GLN 90 11.734 35.978 -4.132 648 HE22 GLN 90 1HE2 GLN 90 13.093 37.036 -4.261 649 H LEU 91 H LEU 91 7.387 35.092 -5.245 650 HA LEU 91 HA LEU 91 6.380 36.350 -7.626 651 HB2 LEU 91 1HB LEU 91 6.389 33.410 -6.993 652 HB3 LEU 91 2HB LEU 91 6.354 34.173 -8.581 653 HG LEU 91 HG LEU 91 8.682 34.094 -6.665 654 HD11 LEU 91 1HD1 LEU 91 7.927 32.599 -9.121 655 HD12 LEU 91 2HD1 LEU 91 8.741 32.041 -7.660 656 HD13 LEU 91 3HD1 LEU 91 9.629 32.982 -8.858 657 HD21 LEU 91 3HD2 LEU 91 9.457 35.011 -9.212 658 HD22 LEU 91 1HD2 LEU 91 9.476 35.895 -7.687 659 HD23 LEU 91 2HD2 LEU 91 8.057 35.970 -8.731 660 H GLY 92 H GLY 92 4.996 35.373 -4.726 661 HA2 GLY 92 1HA GLY 92 2.351 35.034 -5.996 662 HA3 GLY 92 2HA GLY 92 2.793 34.363 -4.432 663 H TYR 93 H TYR 93 0.994 36.678 -5.833 664 HA TYR 93 HA TYR 93 -0.053 38.559 -5.103 665 HB2 TYR 93 1HB TYR 93 0.946 37.631 -2.402 666 HB3 TYR 93 2HB TYR 93 -0.285 38.862 -2.664 667 HD1 TYR 93 HD2 TYR 93 -1.790 37.536 -4.904 668 HD2 TYR 93 HD1 TYR 93 -0.275 35.990 -1.241 669 HE1 TYR 93 HE2 TYR 93 -3.528 35.796 -4.927 670 HE2 TYR 93 HE1 TYR 93 -2.008 34.245 -1.255 671 HH TYR 93 HH TYR 93 -4.161 33.814 -4.000 672 H GLY 94 H GLY 94 2.935 38.483 -5.695 673 HA2 GLY 94 1HA GLY 94 4.530 40.129 -5.944 674 HA3 GLY 94 2HA GLY 94 3.411 41.255 -5.189 675 H ALA 95 H ALA 95 6.062 41.473 -4.639 676 HA ALA 95 HA ALA 95 7.056 40.020 -2.477 677 HB1 ALA 95 1HB ALA 95 8.234 42.378 -2.051 678 HB2 ALA 95 2HB ALA 95 8.709 41.294 -3.360 679 HB3 ALA 95 3HB ALA 95 7.637 42.656 -3.688 680 H ARG 96 H ARG 96 4.586 42.413 -2.601 681 HA ARG 96 HA ARG 96 4.730 43.039 0.226 682 HB2 ARG 96 1HB ARG 96 4.076 44.758 -1.434 683 HB3 ARG 96 2HB ARG 96 2.646 43.812 -1.823 684 HG2 ARG 96 1HG ARG 96 2.184 44.021 0.746 685 HG3 ARG 96 2HG ARG 96 3.255 45.417 0.606 686 HD2 ARG 96 1HD ARG 96 1.829 46.475 -0.952 687 HD3 ARG 96 2HD ARG 96 0.896 45.002 -1.210 688 HE ARG 96 HE ARG 96 0.701 45.728 1.489 689 HH11 ARG 96 1HH1 ARG 96 -0.307 46.840 -1.652 690 HH12 ARG 96 2HH1 ARG 96 -1.735 47.623 -1.060 691 HH21 ARG 96 1HH2 ARG 96 -1.176 46.755 2.280 692 HH22 ARG 96 2HH2 ARG 96 -2.228 47.575 1.177 693 H GLY 97 H GLY 97 2.569 41.287 -1.979 694 HA2 GLY 97 1HA GLY 97 1.551 39.221 -1.273 695 HA3 GLY 97 2HA GLY 97 1.508 39.854 0.366 696 H ALA 98 H ALA 98 -0.771 38.913 -0.115 697 HA ALA 98 HA ALA 98 -2.526 40.590 -1.650 698 HB1 ALA 98 1HB ALA 98 -3.031 38.303 0.240 699 HB2 ALA 98 2HB ALA 98 -4.316 39.167 -0.605 700 HB3 ALA 98 3HB ALA 98 -3.093 38.288 -1.522 701 H GLY 99 H GLY 99 -4.102 42.007 -0.894 702 HA2 GLY 99 1HA GLY 99 -3.457 43.702 1.188 703 HA3 GLY 99 2HA GLY 99 -5.072 43.543 0.513 704 H GLY 100 H GLY 100 -3.183 43.164 3.260 705 HA2 GLY 100 1HA GLY 100 -3.820 42.586 5.404 706 HA3 GLY 100 2HA GLY 100 -5.422 42.214 4.782 707 H VAL 101 H VAL 101 -5.508 40.156 3.424 708 HA VAL 101 HA VAL 101 -4.786 37.977 5.017 709 HB VAL 101 HB VAL 101 -6.616 37.976 3.316 710 HG11 VAL 101 1HG1 VAL 101 -6.245 38.263 1.137 711 HG12 VAL 101 2HG1 VAL 101 -4.606 38.750 1.576 712 HG13 VAL 101 3HG1 VAL 101 -4.940 37.077 1.127 713 HG21 VAL 101 3HG2 VAL 101 -4.985 35.648 2.547 714 HG22 VAL 101 1HG2 VAL 101 -5.173 35.908 4.281 715 HG23 VAL 101 2HG2 VAL 101 -6.597 35.721 3.258 716 H ILE 102 H ILE 102 -3.297 36.263 4.644 717 HA ILE 102 HA ILE 102 -1.278 35.343 4.133 718 HB ILE 102 HB ILE 102 -1.093 37.272 1.825 719 HG12 ILE 102 1HG1 ILE 102 -3.264 36.175 1.706 720 HG13 ILE 102 2HG1 ILE 102 -2.197 35.520 0.469 721 HG21 ILE 102 1HG2 ILE 102 -0.081 34.458 1.890 722 HG22 ILE 102 2HG2 ILE 102 0.454 35.815 0.901 723 HG23 ILE 102 3HG2 ILE 102 0.855 35.763 2.617 724 HD11 ILE 102 3HD1 ILE 102 -3.644 34.137 2.453 725 HD12 ILE 102 1HD1 ILE 102 -2.552 33.481 1.234 726 HD13 ILE 102 2HD1 ILE 102 -1.930 33.944 2.818 727 HA PRO 103 HA PRO 103 1.371 38.147 6.315 728 HB2 PRO 103 1HB PRO 103 3.503 36.480 6.525 729 HB3 PRO 103 2HB PRO 103 2.050 36.312 7.518 730 HG2 PRO 103 1HG PRO 103 2.838 34.819 5.045 731 HG3 PRO 103 2HG PRO 103 2.124 34.200 6.546 732 HD2 PRO 103 1HD PRO 103 0.662 34.644 4.310 733 HD3 PRO 103 2HD PRO 103 -0.007 34.840 5.943 734 HA PRO 104 HA PRO 104 4.134 39.985 3.431 735 HB2 PRO 104 1HB PRO 104 6.252 40.680 4.980 736 HB3 PRO 104 2HB PRO 104 4.691 41.506 5.060 737 HG2 PRO 104 1HG PRO 104 5.803 39.379 6.849 738 HG3 PRO 104 2HG PRO 104 4.920 40.854 7.281 739 HD2 PRO 104 1HD PRO 104 3.737 38.420 7.198 740 HD3 PRO 104 2HD PRO 104 2.869 39.918 6.802 741 H ASN 105 H ASN 105 5.930 37.848 5.657 742 HA ASN 105 HA ASN 105 7.434 36.847 3.328 743 HB2 ASN 105 1HB ASN 105 8.369 37.286 6.168 744 HB3 ASN 105 2HB ASN 105 9.281 36.355 4.982 745 HD21 ASN 105 2HD2 ASN 105 10.957 37.541 4.415 746 HD22 ASN 105 1HD2 ASN 105 10.910 39.203 3.943 747 H ALA 106 H ALA 106 6.497 34.953 2.845 748 HA ALA 106 HA ALA 106 6.832 32.712 4.515 749 HB1 ALA 106 1HB ALA 106 3.921 33.301 4.211 750 HB2 ALA 106 2HB ALA 106 4.741 32.257 5.372 751 HB3 ALA 106 3HB ALA 106 4.823 34.009 5.551 752 H THR 107 H THR 107 6.257 30.750 3.492 753 HA THR 107 HA THR 107 6.078 30.981 0.610 754 HB THR 107 HB THR 107 6.390 28.546 2.375 755 HG1 THR 107 HG1 THR 107 8.448 29.009 2.269 756 HG21 THR 107 3HG2 THR 107 7.283 27.784 -0.060 757 HG22 THR 107 1HG2 THR 107 5.968 28.862 -0.527 758 HG23 THR 107 2HG2 THR 107 5.647 27.482 0.522 759 H LEU 108 H LEU 108 4.294 30.713 -0.564 760 HA LEU 108 HA LEU 108 1.847 29.860 0.793 761 HB2 LEU 108 1HB LEU 108 2.374 31.316 -1.782 762 HB3 LEU 108 2HB LEU 108 0.779 30.695 -1.361 763 HG LEU 108 HG LEU 108 2.156 32.507 0.563 764 HD11 LEU 108 1HD1 LEU 108 0.496 33.740 -1.567 765 HD12 LEU 108 2HD1 LEU 108 2.178 33.362 -1.937 766 HD13 LEU 108 3HD1 LEU 108 1.791 34.435 -0.592 767 HD21 LEU 108 3HD2 LEU 108 0.153 32.494 1.520 768 HD22 LEU 108 1HD2 LEU 108 -0.359 31.293 0.334 769 HD23 LEU 108 2HD2 LEU 108 -0.619 33.009 0.019 770 H VAL 109 H VAL 109 0.822 28.005 0.344 771 HA VAL 109 HA VAL 109 1.976 26.288 -1.745 772 HB VAL 109 HB VAL 109 0.340 25.551 0.685 773 HG11 VAL 109 1HG1 VAL 109 0.916 24.100 -1.766 774 HG12 VAL 109 2HG1 VAL 109 1.467 23.244 -0.324 775 HG13 VAL 109 3HG1 VAL 109 -0.223 23.728 -0.472 776 HG21 VAL 109 3HG2 VAL 109 3.223 25.694 0.106 777 HG22 VAL 109 1HG2 VAL 109 2.365 25.804 1.643 778 HG23 VAL 109 2HG2 VAL 109 2.683 24.226 0.921 779 H PHE 110 H PHE 110 0.871 26.338 -3.586 780 HA PHE 110 HA PHE 110 -2.072 26.417 -3.450 781 HB2 PHE 110 1HB PHE 110 -0.167 27.621 -5.451 782 HB3 PHE 110 2HB PHE 110 -1.867 27.359 -5.829 783 HD1 PHE 110 HD1 PHE 110 -3.612 28.526 -4.482 784 HD2 PHE 110 HD2 PHE 110 0.530 29.446 -4.139 785 HE1 PHE 110 HE1 PHE 110 -4.180 30.671 -3.417 786 HE2 PHE 110 HE2 PHE 110 -0.031 31.591 -3.073 787 HZ PHE 110 HZ PHE 110 -2.388 32.206 -2.710 788 H GLU 111 H GLU 111 -3.181 24.813 -4.398 789 HA GLU 111 HA GLU 111 -1.637 22.712 -5.733 790 HB2 GLU 111 1HB GLU 111 -2.918 21.874 -3.909 791 HB3 GLU 111 2HB GLU 111 -4.356 22.739 -4.431 792 HG2 GLU 111 1HG GLU 111 -3.298 20.856 -6.405 793 HG3 GLU 111 2HG GLU 111 -3.851 20.114 -4.905 794 H VAL 112 H VAL 112 -1.918 22.181 -7.821 795 HA VAL 112 HA VAL 112 -4.139 23.442 -9.287 796 HB VAL 112 HB VAL 112 -1.372 23.089 -10.434 797 HG11 VAL 112 1HG1 VAL 112 -3.188 23.169 -12.060 798 HG12 VAL 112 2HG1 VAL 112 -3.760 24.684 -11.359 799 HG13 VAL 112 3HG1 VAL 112 -2.189 24.619 -12.159 800 HG21 VAL 112 3HG2 VAL 112 -1.457 25.702 -10.216 801 HG22 VAL 112 1HG2 VAL 112 -2.557 25.343 -8.885 802 HG23 VAL 112 2HG2 VAL 112 -0.913 24.706 -8.866 803 H GLU 113 H GLU 113 -5.367 22.009 -10.304 804 HA GLU 113 HA GLU 113 -4.139 19.522 -11.279 805 HB2 GLU 113 1HB GLU 113 -6.200 18.303 -10.599 806 HB3 GLU 113 2HB GLU 113 -5.269 18.920 -9.241 807 HG2 GLU 113 1HG GLU 113 -6.890 20.954 -9.423 808 HG3 GLU 113 2HG GLU 113 -7.915 19.805 -10.283 809 H LEU 114 H LEU 114 -4.326 19.537 -13.414 810 HA LEU 114 HA LEU 114 -6.179 21.137 -14.834 811 HB2 LEU 114 1HB LEU 114 -3.938 19.478 -15.425 812 HB3 LEU 114 2HB LEU 114 -5.265 19.033 -16.496 813 HG LEU 114 HG LEU 114 -5.400 21.593 -16.954 814 HD11 LEU 114 1HD1 LEU 114 -2.481 21.598 -16.487 815 HD12 LEU 114 2HD1 LEU 114 -3.516 21.784 -15.071 816 HD13 LEU 114 3HD1 LEU 114 -3.648 22.919 -16.415 817 HD21 LEU 114 3HD2 LEU 114 -3.031 20.094 -18.046 818 HD22 LEU 114 1HD2 LEU 114 -4.010 21.323 -18.848 819 HD23 LEU 114 2HD2 LEU 114 -4.695 19.733 -18.509 820 H LEU 115 H LEU 115 -8.179 20.729 -15.554 821 HA LEU 115 HA LEU 115 -9.274 18.039 -15.081 822 HB2 LEU 115 1HB LEU 115 -10.580 20.748 -15.145 823 HB3 LEU 115 2HB LEU 115 -11.496 19.243 -15.158 824 HG LEU 115 HG LEU 115 -9.560 19.460 -12.965 825 HD11 LEU 115 1HD1 LEU 115 -10.780 21.811 -13.497 826 HD12 LEU 115 2HD1 LEU 115 -10.325 21.273 -11.880 827 HD13 LEU 115 3HD1 LEU 115 -11.979 21.049 -12.451 828 HD21 LEU 115 3HD2 LEU 115 -12.398 19.081 -12.392 829 HD22 LEU 115 1HD2 LEU 115 -11.010 18.074 -11.978 830 HD23 LEU 115 2HD2 LEU 115 -11.754 17.937 -13.571 831 H ASP 116 H ASP 116 -9.298 20.751 -17.365 832 HA ASP 116 HA ASP 116 -9.463 18.939 -19.592 833 HB2 ASP 116 1HB ASP 116 -11.815 20.617 -18.781 834 HB3 ASP 116 2HB ASP 116 -11.529 20.261 -20.482 835 H VAL 117 H VAL 117 -9.516 20.182 -21.699 836 HA VAL 117 HA VAL 117 -7.916 22.631 -21.382 837 HB VAL 117 HB VAL 117 -8.072 20.818 -23.793 838 HG11 VAL 117 1HG1 VAL 117 -6.903 22.356 -24.890 839 HG12 VAL 117 2HG1 VAL 117 -7.166 23.454 -23.533 840 HG13 VAL 117 3HG1 VAL 117 -5.716 22.452 -23.590 841 HG21 VAL 117 3HG2 VAL 117 -6.457 20.699 -21.343 842 HG22 VAL 117 1HG2 VAL 117 -6.851 19.435 -22.508 843 HG23 VAL 117 2HG2 VAL 117 -5.540 20.567 -22.843 844 H11 L2S 130 1H1 L2S 130 -4.923 31.431 -8.621 845 H21 L2S 130 2H1 L2S 130 -5.427 31.505 -10.377 846 H12 L2S 130 1H2 L2S 130 -4.908 33.844 -10.443 847 H22 L2S 130 2H2 L2S 130 -3.433 32.888 -9.934 848 H13 L2S 130 2H3 L2S 130 -3.866 33.497 -7.641 849 H23 L2S 130 1H3 L2S 130 -3.814 35.025 -8.639 850 H14 L2S 130 1H4 L2S 130 -6.426 32.721 -6.927 851 H24 L2S 130 2H4 L2S 130 -7.682 33.816 -7.672 852 H15 L2S 130 1H5 L2S 130 -7.374 31.614 -8.854 853 H25 L2S 130 2H5 L2S 130 -7.111 33.130 -9.846 854 H17 L2S 130 1H7 L2S 130 -7.873 36.388 -7.767 855 H27 L2S 130 2H7 L2S 130 -7.746 35.267 -6.309 856 H9 L2S 130 H9 L2S 130 -5.909 35.358 -4.729 857 H10 L2S 130 H10 L2S 130 -6.107 34.221 -2.517 858 H112 L2S 130 1H12 L2S 130 -8.781 37.388 -1.135 859 H113 L2S 130 1H13 L2S 130 -8.612 38.481 -3.363 860 H114 L2S 130 1H14 L2S 130 -6.674 34.507 -0.266 861 H214 L2S 130 2H14 L2S 130 -8.443 34.453 -0.452 862 H314 L2S 130 3H14 L2S 130 -7.671 35.896 0.290
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