NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
479094 | 2kx0 | 16895 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 1HA GLY 1 3.116 -0.165 -1.032 3 HA3 GLY 1 2HA GLY 1 1.710 -0.805 -1.869 4 H SER 2 H SER 2 3.316 0.731 -3.326 5 HA SER 2 HA SER 2 2.367 3.483 -3.247 6 HB2 SER 2 1HB SER 2 4.031 3.927 -4.951 7 HB3 SER 2 2HB SER 2 4.774 2.967 -3.672 8 HG SER 2 HG SER 2 5.209 1.527 -5.123 9 H LEU 3 H LEU 3 1.928 4.438 -5.539 10 HA LEU 3 HA LEU 3 -0.018 2.669 -6.866 11 HB2 LEU 3 1HB LEU 3 -1.018 4.580 -5.692 12 HB3 LEU 3 2HB LEU 3 -0.034 5.678 -6.658 13 HG LEU 3 HG LEU 3 -1.234 5.054 -8.662 14 HD11 LEU 3 1HD1 LEU 3 -1.687 2.750 -8.299 15 HD12 LEU 3 2HD1 LEU 3 -3.242 3.567 -8.454 16 HD13 LEU 3 3HD1 LEU 3 -2.647 3.099 -6.861 17 HD21 LEU 3 3HD2 LEU 3 -2.345 6.832 -7.752 18 HD22 LEU 3 1HD2 LEU 3 -2.741 5.969 -6.266 19 HD23 LEU 3 2HD2 LEU 3 -3.639 5.633 -7.747 20 H VAL 4 H VAL 4 0.187 2.296 -8.990 21 HA VAL 4 HA VAL 4 2.528 3.254 -10.354 22 HB VAL 4 HB VAL 4 0.253 1.566 -11.405 23 HG11 VAL 4 1HG1 VAL 4 1.753 0.952 -13.196 24 HG12 VAL 4 2HG1 VAL 4 1.574 2.707 -13.154 25 HG13 VAL 4 3HG1 VAL 4 3.033 1.952 -12.509 26 HG21 VAL 4 3HG2 VAL 4 2.425 -0.073 -11.132 27 HG22 VAL 4 1HG2 VAL 4 2.559 0.966 -9.713 28 HG23 VAL 4 2HG2 VAL 4 1.085 0.039 -9.991 29 HA PRO 5 HA PRO 5 0.648 6.800 -12.213 30 HB2 PRO 5 1HB PRO 5 2.572 7.283 -14.066 31 HB3 PRO 5 2HB PRO 5 2.777 7.653 -12.350 32 HG2 PRO 5 1HG PRO 5 3.762 5.295 -13.910 33 HG3 PRO 5 2HG PRO 5 4.608 6.260 -12.686 34 HD2 PRO 5 1HD PRO 5 3.496 3.854 -12.132 35 HD3 PRO 5 2HD PRO 5 3.589 5.161 -10.935 36 H ARG 6 H ARG 6 -1.106 6.501 -13.446 37 HA ARG 6 HA ARG 6 -0.732 5.369 -16.130 38 HB2 ARG 6 1HB ARG 6 -3.032 4.722 -14.276 39 HB3 ARG 6 2HB ARG 6 -2.880 4.187 -15.944 40 HG2 ARG 6 1HG ARG 6 -0.939 3.484 -13.754 41 HG3 ARG 6 2HG ARG 6 -2.282 2.462 -14.271 42 HD2 ARG 6 1HD ARG 6 -0.031 3.409 -16.041 43 HD3 ARG 6 2HD ARG 6 -0.137 1.813 -15.300 44 HE ARG 6 HE ARG 6 -1.462 2.686 -17.657 45 HH11 ARG 6 1HH1 ARG 6 -1.828 0.642 -14.863 46 HH12 ARG 6 2HH1 ARG 6 -2.932 -0.443 -15.640 47 HH21 ARG 6 1HH2 ARG 6 -2.915 1.264 -18.691 48 HH22 ARG 6 2HH2 ARG 6 -3.550 -0.089 -17.817 49 H GLY 7 H GLY 7 -2.921 5.746 -17.403 50 HA2 GLY 7 1HA GLY 7 -3.176 8.478 -17.834 51 HA3 GLY 7 2HA GLY 7 -4.345 7.274 -18.357 52 H SER 8 H SER 8 -4.743 10.012 -17.341 53 HA SER 8 HA SER 8 -6.884 9.403 -15.514 54 HB2 SER 8 1HB SER 8 -4.553 11.105 -14.601 55 HB3 SER 8 2HB SER 8 -6.103 11.006 -13.764 56 HG SER 8 HG SER 8 -4.989 9.469 -12.768 57 H MET 9 H MET 9 -8.547 10.659 -16.028 58 HA MET 9 HA MET 9 -7.998 13.286 -17.242 59 HB2 MET 9 1HB MET 9 -9.773 12.999 -18.780 60 HB3 MET 9 2HB MET 9 -8.854 11.501 -18.830 61 HG2 MET 9 1HG MET 9 -10.814 11.144 -16.859 62 HG3 MET 9 2HG MET 9 -11.618 11.921 -18.221 63 HE1 MET 9 3HE MET 9 -10.427 8.155 -17.067 64 HE2 MET 9 1HE MET 9 -11.773 9.223 -16.671 65 HE3 MET 9 2HE MET 9 -11.997 7.915 -17.833 66 H GLN 10 H GLN 10 -9.701 14.888 -16.960 67 HA GLN 10 HA GLN 10 -10.913 14.648 -14.314 68 HB2 GLN 10 1HB GLN 10 -9.482 16.650 -15.164 69 HB3 GLN 10 2HB GLN 10 -10.958 17.139 -15.985 70 HG2 GLN 10 1HG GLN 10 -11.988 17.746 -14.074 71 HG3 GLN 10 2HG GLN 10 -11.220 16.473 -13.126 72 HE21 GLN 10 2HE2 GLN 10 -9.247 16.852 -12.164 73 HE22 GLN 10 1HE2 GLN 10 -8.557 18.431 -12.035 74 H ILE 11 H ILE 11 -13.070 14.685 -13.934 75 HA ILE 11 HA ILE 11 -14.849 14.930 -16.271 76 HB ILE 11 HB ILE 11 -16.273 13.188 -15.408 77 HG12 ILE 11 1HG1 ILE 11 -14.280 12.958 -13.143 78 HG13 ILE 11 2HG1 ILE 11 -15.919 13.586 -13.012 79 HG21 ILE 11 1HG2 ILE 11 -14.884 11.282 -15.792 80 HG22 ILE 11 2HG2 ILE 11 -14.302 12.592 -16.817 81 HG23 ILE 11 3HG2 ILE 11 -13.436 12.180 -15.338 82 HD11 ILE 11 3HD1 ILE 11 -15.974 11.383 -12.190 83 HD12 ILE 11 1HD1 ILE 11 -16.715 11.328 -13.789 84 HD13 ILE 11 2HD1 ILE 11 -15.058 10.767 -13.565 85 H PHE 12 H PHE 12 -17.162 15.334 -15.610 86 HA PHE 12 HA PHE 12 -17.208 17.217 -13.346 87 HB2 PHE 12 1HB PHE 12 -18.866 17.214 -15.877 88 HB3 PHE 12 2HB PHE 12 -19.058 18.353 -14.549 89 HD1 PHE 12 HD2 PHE 12 -16.812 19.592 -13.866 90 HD2 PHE 12 HD1 PHE 12 -17.599 17.859 -17.673 91 HE1 PHE 12 HE2 PHE 12 -15.119 21.060 -14.880 92 HE2 PHE 12 HE1 PHE 12 -15.907 19.324 -18.694 93 HZ PHE 12 HZ PHE 12 -14.665 20.928 -17.297 94 H VAL 13 H VAL 13 -18.535 16.811 -11.700 95 HA VAL 13 HA VAL 13 -20.739 14.900 -12.110 96 HB VAL 13 HB VAL 13 -19.055 15.056 -9.609 97 HG11 VAL 13 1HG1 VAL 13 -21.358 13.358 -10.493 98 HG12 VAL 13 2HG1 VAL 13 -20.203 12.762 -9.298 99 HG13 VAL 13 3HG1 VAL 13 -21.131 14.228 -8.975 100 HG21 VAL 13 3HG2 VAL 13 -18.658 12.569 -10.745 101 HG22 VAL 13 1HG2 VAL 13 -18.589 13.673 -12.119 102 HG23 VAL 13 2HG2 VAL 13 -17.512 13.909 -10.742 103 H LYS 14 H LYS 14 -22.640 15.312 -11.034 104 HA LYS 14 HA LYS 14 -22.827 17.966 -9.786 105 HB2 LYS 14 1HB LYS 14 -24.763 16.266 -11.318 106 HB3 LYS 14 2HB LYS 14 -25.366 17.483 -10.200 107 HG2 LYS 14 1HG LYS 14 -25.325 18.699 -12.121 108 HG3 LYS 14 2HG LYS 14 -23.700 19.037 -11.519 109 HD2 LYS 14 1HD LYS 14 -22.997 16.982 -12.910 110 HD3 LYS 14 2HD LYS 14 -24.549 17.190 -13.724 111 HE2 LYS 14 1HE LYS 14 -22.584 19.443 -13.421 112 HE3 LYS 14 2HE LYS 14 -22.513 18.314 -14.774 113 HZ1 LYS 14 3HZ LYS 14 -23.764 20.317 -15.323 114 HZ2 LYS 14 1HZ LYS 14 -24.855 20.000 -14.069 115 HZ3 LYS 14 2HZ LYS 14 -24.753 18.946 -15.388 116 H THR 15 H THR 15 -23.807 18.254 -7.804 117 HA THR 15 HA THR 15 -24.092 15.815 -6.196 118 HB THR 15 HB THR 15 -23.832 17.250 -4.231 119 HG1 THR 15 HG1 THR 15 -23.305 19.420 -5.981 120 HG21 THR 15 3HG2 THR 15 -21.673 16.781 -4.548 121 HG22 THR 15 1HG2 THR 15 -21.520 18.350 -5.337 122 HG23 THR 15 2HG2 THR 15 -21.839 16.907 -6.299 123 H LEU 16 H LEU 16 -25.659 16.358 -4.202 124 HA LEU 16 HA LEU 16 -28.269 16.539 -5.363 125 HB2 LEU 16 1HB LEU 16 -29.068 16.188 -3.069 126 HB3 LEU 16 2HB LEU 16 -27.863 14.999 -3.557 127 HG LEU 16 HG LEU 16 -26.735 17.293 -2.137 128 HD11 LEU 16 1HD1 LEU 16 -27.558 16.275 0.080 129 HD12 LEU 16 2HD1 LEU 16 -28.881 15.623 -0.885 130 HD13 LEU 16 3HD1 LEU 16 -28.630 17.367 -0.797 131 HD21 LEU 16 3HD2 LEU 16 -25.940 15.175 -0.768 132 HD22 LEU 16 1HD2 LEU 16 -25.241 15.581 -2.335 133 HD23 LEU 16 2HD2 LEU 16 -26.483 14.333 -2.220 134 H THR 17 H THR 17 -26.094 18.764 -3.934 135 HA THR 17 HA THR 17 -28.200 20.702 -3.344 136 HB THR 17 HB THR 17 -26.383 20.447 -1.702 137 HG1 THR 17 HG1 THR 17 -26.332 22.966 -3.040 138 HG21 THR 17 3HG2 THR 17 -24.132 21.329 -2.270 139 HG22 THR 17 1HG2 THR 17 -24.632 21.430 -3.957 140 HG23 THR 17 2HG2 THR 17 -24.544 19.862 -3.156 141 H GLY 18 H GLY 18 -27.529 19.867 -6.104 142 HA2 GLY 18 1HA GLY 18 -27.225 20.818 -8.171 143 HA3 GLY 18 2HA GLY 18 -27.772 22.304 -7.410 144 H LYS 19 H LYS 19 -24.872 20.587 -6.450 145 HA LYS 19 HA LYS 19 -23.281 22.834 -7.501 146 HB2 LYS 19 1HB LYS 19 -23.256 22.838 -5.089 147 HB3 LYS 19 2HB LYS 19 -22.849 21.128 -5.046 148 HG2 LYS 19 1HG LYS 19 -20.983 22.897 -6.500 149 HG3 LYS 19 2HG LYS 19 -21.044 23.067 -4.744 150 HD2 LYS 19 1HD LYS 19 -20.869 20.462 -4.774 151 HD3 LYS 19 2HD LYS 19 -20.228 20.715 -6.399 152 HE2 LYS 19 1HE LYS 19 -18.288 20.783 -5.190 153 HE3 LYS 19 2HE LYS 19 -18.726 22.491 -5.162 154 HZ1 LYS 19 3HZ LYS 19 -19.318 22.399 -2.973 155 HZ2 LYS 19 1HZ LYS 19 -18.083 21.242 -2.980 156 HZ3 LYS 19 2HZ LYS 19 -19.702 20.752 -3.011 157 H THR 20 H THR 20 -21.725 22.392 -8.927 158 HA THR 20 HA THR 20 -21.260 19.616 -9.664 159 HB THR 20 HB THR 20 -19.910 21.910 -11.032 160 HG1 THR 20 HG1 THR 20 -21.808 22.750 -11.434 161 HG21 THR 20 3HG2 THR 20 -21.053 19.263 -11.919 162 HG22 THR 20 1HG2 THR 20 -19.352 19.713 -11.819 163 HG23 THR 20 2HG2 THR 20 -20.396 20.472 -13.021 164 H ILE 21 H ILE 21 -19.534 18.484 -9.064 165 HA ILE 21 HA ILE 21 -17.227 19.944 -7.953 166 HB ILE 21 HB ILE 21 -18.258 18.662 -6.213 167 HG12 ILE 21 1HG1 ILE 21 -15.645 18.499 -6.814 168 HG13 ILE 21 2HG1 ILE 21 -16.349 17.711 -5.406 169 HG21 ILE 21 1HG2 ILE 21 -18.157 16.372 -8.164 170 HG22 ILE 21 2HG2 ILE 21 -18.474 16.170 -6.442 171 HG23 ILE 21 3HG2 ILE 21 -19.582 17.113 -7.438 172 HD11 ILE 21 3HD1 ILE 21 -14.787 16.322 -6.810 173 HD12 ILE 21 1HD1 ILE 21 -16.365 15.613 -6.468 174 HD13 ILE 21 2HD1 ILE 21 -16.042 16.326 -8.049 175 H THR 22 H THR 22 -15.251 19.580 -8.779 176 HA THR 22 HA THR 22 -15.050 17.984 -11.180 177 HB THR 22 HB THR 22 -12.634 19.235 -9.970 178 HG1 THR 22 HG1 THR 22 -14.072 20.895 -9.637 179 HG21 THR 22 3HG2 THR 22 -13.580 19.602 -12.775 180 HG22 THR 22 1HG2 THR 22 -12.959 18.027 -12.285 181 HG23 THR 22 2HG2 THR 22 -11.937 19.458 -12.152 182 H LEU 23 H LEU 23 -14.172 16.016 -11.370 183 HA LEU 23 HA LEU 23 -12.564 14.966 -9.145 184 HB2 LEU 23 1HB LEU 23 -15.113 14.217 -9.438 185 HB3 LEU 23 2HB LEU 23 -14.362 13.086 -10.561 186 HG LEU 23 HG LEU 23 -12.866 12.377 -8.650 187 HD11 LEU 23 1HD1 LEU 23 -13.125 14.263 -7.187 188 HD12 LEU 23 2HD1 LEU 23 -13.762 12.829 -6.383 189 HD13 LEU 23 3HD1 LEU 23 -14.868 14.005 -7.093 190 HD21 LEU 23 3HD2 LEU 23 -15.826 11.925 -8.719 191 HD22 LEU 23 1HD2 LEU 23 -14.819 11.138 -7.504 192 HD23 LEU 23 2HD2 LEU 23 -14.519 10.849 -9.217 193 H GLU 24 H GLU 24 -11.145 13.213 -9.721 194 HA GLU 24 HA GLU 24 -10.573 13.066 -12.608 195 HB2 GLU 24 1HB GLU 24 -8.793 14.352 -11.866 196 HB3 GLU 24 2HB GLU 24 -8.735 13.555 -10.300 197 HG2 GLU 24 1HG GLU 24 -7.549 11.747 -11.115 198 HG3 GLU 24 2HG GLU 24 -8.048 12.041 -12.780 199 H VAL 25 H VAL 25 -10.501 11.079 -13.428 200 HA VAL 25 HA VAL 25 -9.781 8.817 -11.729 201 HB VAL 25 HB VAL 25 -12.199 8.899 -11.515 202 HG11 VAL 25 1HG1 VAL 25 -12.685 10.157 -13.560 203 HG12 VAL 25 2HG1 VAL 25 -12.279 8.738 -14.527 204 HG13 VAL 25 3HG1 VAL 25 -13.671 8.700 -13.444 205 HG21 VAL 25 3HG2 VAL 25 -12.501 6.668 -11.781 206 HG22 VAL 25 1HG2 VAL 25 -11.914 6.676 -13.444 207 HG23 VAL 25 2HG2 VAL 25 -10.768 6.714 -12.105 208 H GLU 26 H GLU 26 -8.936 7.064 -12.838 209 HA GLU 26 HA GLU 26 -7.792 7.630 -15.381 210 HB2 GLU 26 1HB GLU 26 -7.924 4.894 -14.137 211 HB3 GLU 26 2HB GLU 26 -6.680 5.559 -15.186 212 HG2 GLU 26 1HG GLU 26 -6.163 7.187 -13.327 213 HG3 GLU 26 2HG GLU 26 -7.207 6.203 -12.302 214 HA PRO 27 HA PRO 27 -10.808 6.077 -18.165 215 HB2 PRO 27 1HB PRO 27 -9.231 5.090 -20.142 216 HB3 PRO 27 2HB PRO 27 -9.448 6.822 -19.861 217 HG2 PRO 27 1HG PRO 27 -7.200 5.034 -19.020 218 HG3 PRO 27 2HG PRO 27 -7.134 6.672 -19.695 219 HD2 PRO 27 1HD PRO 27 -6.867 6.177 -17.047 220 HD3 PRO 27 2HD PRO 27 -7.613 7.662 -17.670 221 H SER 28 H SER 28 -8.401 3.964 -16.844 222 HA SER 28 HA SER 28 -9.876 1.594 -17.754 223 HB2 SER 28 1HB SER 28 -7.401 1.689 -18.130 224 HB3 SER 28 2HB SER 28 -7.181 1.706 -16.380 225 HG SER 28 HG SER 28 -8.602 -0.325 -17.753 226 H ASP 29 H ASP 29 -9.452 3.604 -15.064 227 HA ASP 29 HA ASP 29 -9.753 1.738 -12.960 228 HB2 ASP 29 1HB ASP 29 -10.088 4.696 -13.236 229 HB3 ASP 29 2HB ASP 29 -10.718 3.904 -11.795 230 H THR 30 H THR 30 -11.672 1.632 -11.518 231 HA THR 30 HA THR 30 -14.128 1.492 -13.134 232 HB THR 30 HB THR 30 -14.924 -0.238 -11.671 233 HG1 THR 30 HG1 THR 30 -13.869 -0.802 -9.807 234 HG21 THR 30 3HG2 THR 30 -13.590 -1.934 -12.419 235 HG22 THR 30 1HG2 THR 30 -12.099 -1.115 -11.956 236 HG23 THR 30 2HG2 THR 30 -12.956 -0.627 -13.418 237 H ILE 31 H ILE 31 -16.167 1.626 -11.696 238 HA ILE 31 HA ILE 31 -16.454 4.202 -10.740 239 HB ILE 31 HB ILE 31 -18.073 1.817 -9.838 240 HG12 ILE 31 1HG1 ILE 31 -18.010 1.873 -12.258 241 HG13 ILE 31 2HG1 ILE 31 -19.587 2.435 -11.715 242 HG21 ILE 31 1HG2 ILE 31 -19.158 3.309 -8.599 243 HG22 ILE 31 2HG2 ILE 31 -18.227 4.639 -9.285 244 HG23 ILE 31 3HG2 ILE 31 -19.688 4.076 -10.096 245 HD11 ILE 31 3HD1 ILE 31 -19.205 4.054 -13.221 246 HD12 ILE 31 1HD1 ILE 31 -18.298 4.781 -11.895 247 HD13 ILE 31 2HD1 ILE 31 -17.454 3.865 -13.144 248 H GLU 32 H GLU 32 -15.303 1.358 -9.094 249 HA GLU 32 HA GLU 32 -15.645 2.186 -6.435 250 HB2 GLU 32 1HB GLU 32 -13.432 0.456 -7.551 251 HB3 GLU 32 2HB GLU 32 -13.948 0.531 -5.873 252 HG2 GLU 32 1HG GLU 32 -15.581 -0.469 -8.195 253 HG3 GLU 32 2HG GLU 32 -14.814 -1.454 -6.950 254 H ASN 33 H ASN 33 -13.167 2.906 -8.809 255 HA ASN 33 HA ASN 33 -11.398 4.168 -6.934 256 HB2 ASN 33 1HB ASN 33 -11.154 3.214 -9.526 257 HB3 ASN 33 2HB ASN 33 -11.050 4.961 -9.720 258 HD21 ASN 33 2HD2 ASN 33 -9.399 2.155 -8.919 259 HD22 ASN 33 1HD2 ASN 33 -7.956 2.875 -8.300 260 H VAL 34 H VAL 34 -14.016 5.172 -9.009 261 HA VAL 34 HA VAL 34 -13.508 7.943 -9.041 262 HB VAL 34 HB VAL 34 -16.177 6.534 -9.198 263 HG11 VAL 34 1HG1 VAL 34 -16.355 8.933 -8.697 264 HG12 VAL 34 2HG1 VAL 34 -15.383 9.293 -10.125 265 HG13 VAL 34 3HG1 VAL 34 -16.970 8.544 -10.303 266 HG21 VAL 34 3HG2 VAL 34 -14.500 7.510 -11.495 267 HG22 VAL 34 1HG2 VAL 34 -14.386 5.866 -10.869 268 HG23 VAL 34 2HG2 VAL 34 -15.908 6.450 -11.540 269 H LYS 35 H LYS 35 -15.747 6.055 -7.003 270 HA LYS 35 HA LYS 35 -16.605 8.140 -5.373 271 HB2 LYS 35 1HB LYS 35 -17.442 6.489 -3.899 272 HB3 LYS 35 2HB LYS 35 -17.525 5.776 -5.505 273 HG2 LYS 35 1HG LYS 35 -16.572 4.016 -4.502 274 HG3 LYS 35 2HG LYS 35 -15.082 4.936 -4.719 275 HD2 LYS 35 1HD LYS 35 -14.993 5.571 -2.505 276 HD3 LYS 35 2HD LYS 35 -16.734 5.391 -2.275 277 HE2 LYS 35 1HE LYS 35 -15.882 3.577 -1.115 278 HE3 LYS 35 2HE LYS 35 -16.282 2.875 -2.682 279 HZ1 LYS 35 3HZ LYS 35 -13.827 3.494 -3.212 280 HZ2 LYS 35 1HZ LYS 35 -14.176 2.082 -2.348 281 HZ3 LYS 35 2HZ LYS 35 -13.646 3.464 -1.530 282 H ALA 36 H ALA 36 -13.632 6.346 -5.349 283 HA ALA 36 HA ALA 36 -12.743 6.751 -2.751 284 HB1 ALA 36 1HB ALA 36 -10.600 7.068 -4.670 285 HB2 ALA 36 2HB ALA 36 -10.894 5.772 -3.510 286 HB3 ALA 36 3HB ALA 36 -11.668 5.730 -5.095 287 H LYS 37 H LYS 37 -12.540 8.900 -5.557 288 HA LYS 37 HA LYS 37 -11.080 10.929 -4.153 289 HB2 LYS 37 1HB LYS 37 -12.464 10.812 -6.823 290 HB3 LYS 37 2HB LYS 37 -11.792 12.316 -6.207 291 HG2 LYS 37 1HG LYS 37 -10.001 11.610 -7.389 292 HG3 LYS 37 2HG LYS 37 -9.656 10.765 -5.878 293 HD2 LYS 37 1HD LYS 37 -10.968 8.814 -6.858 294 HD3 LYS 37 2HD LYS 37 -10.867 9.663 -8.402 295 HE2 LYS 37 1HE LYS 37 -8.553 8.745 -6.699 296 HE3 LYS 37 2HE LYS 37 -9.082 8.032 -8.222 297 HZ1 LYS 37 3HZ LYS 37 -7.462 9.372 -9.011 298 HZ2 LYS 37 1HZ LYS 37 -7.582 10.484 -7.741 299 HZ3 LYS 37 2HZ LYS 37 -8.704 10.520 -9.006 300 H ILE 38 H ILE 38 -14.438 10.194 -4.724 301 HA ILE 38 HA ILE 38 -15.537 12.717 -4.114 302 HB ILE 38 HB ILE 38 -16.751 9.975 -3.761 303 HG12 ILE 38 1HG1 ILE 38 -16.071 10.510 -6.077 304 HG13 ILE 38 2HG1 ILE 38 -17.820 10.398 -5.912 305 HG21 ILE 38 1HG2 ILE 38 -18.041 12.699 -3.772 306 HG22 ILE 38 2HG2 ILE 38 -18.912 11.167 -3.811 307 HG23 ILE 38 3HG2 ILE 38 -17.932 11.589 -2.407 308 HD11 ILE 38 3HD1 ILE 38 -17.942 12.849 -5.819 309 HD12 ILE 38 1HD1 ILE 38 -16.197 12.926 -6.058 310 HD13 ILE 38 2HD1 ILE 38 -17.231 12.260 -7.321 311 H GLN 39 H GLN 39 -14.392 10.094 -2.119 312 HA GLN 39 HA GLN 39 -15.640 10.648 0.292 313 HB2 GLN 39 1HB GLN 39 -12.882 9.585 -0.303 314 HB3 GLN 39 2HB GLN 39 -13.522 9.694 1.331 315 HG2 GLN 39 1HG GLN 39 -15.513 8.341 0.362 316 HG3 GLN 39 2HG GLN 39 -14.374 7.932 -0.920 317 HE21 GLN 39 2HE2 GLN 39 -14.492 8.104 2.623 318 HE22 GLN 39 1HE2 GLN 39 -13.634 6.630 2.894 319 H ASP 40 H ASP 40 -12.914 12.237 -1.238 320 HA ASP 40 HA ASP 40 -12.260 13.836 1.057 321 HB2 ASP 40 1HB ASP 40 -10.658 13.155 -0.804 322 HB3 ASP 40 2HB ASP 40 -11.443 14.382 -1.795 323 H LYS 41 H LYS 41 -14.462 14.061 -1.583 324 HA LYS 41 HA LYS 41 -14.809 16.918 -1.416 325 HB2 LYS 41 1HB LYS 41 -16.700 14.992 -2.749 326 HB3 LYS 41 2HB LYS 41 -16.409 16.682 -3.140 327 HG2 LYS 41 1HG LYS 41 -14.398 14.472 -3.508 328 HG3 LYS 41 2HG LYS 41 -15.445 15.107 -4.779 329 HD2 LYS 41 1HD LYS 41 -13.638 16.419 -5.175 330 HD3 LYS 41 2HD LYS 41 -14.381 17.405 -3.913 331 HE2 LYS 41 1HE LYS 41 -12.923 16.521 -2.255 332 HE3 LYS 41 2HE LYS 41 -12.334 15.270 -3.348 333 HZ1 LYS 41 3HZ LYS 41 -11.666 17.392 -4.743 334 HZ2 LYS 41 1HZ LYS 41 -10.654 16.757 -3.544 335 HZ3 LYS 41 2HZ LYS 41 -11.627 18.099 -3.207 336 H GLU 42 H GLU 42 -16.785 14.073 -0.585 337 HA GLU 42 HA GLU 42 -18.255 15.778 1.315 338 HB2 GLU 42 1HB GLU 42 -19.278 13.542 -0.432 339 HB3 GLU 42 2HB GLU 42 -20.178 14.162 0.945 340 HG2 GLU 42 1HG GLU 42 -19.319 15.758 -1.458 341 HG3 GLU 42 2HG GLU 42 -20.942 15.144 -1.148 342 H GLY 43 H GLY 43 -16.871 12.619 0.639 343 HA2 GLY 43 1HA GLY 43 -15.982 11.074 2.108 344 HA3 GLY 43 2HA GLY 43 -16.357 12.176 3.425 345 H ILE 44 H ILE 44 -18.074 10.112 1.078 346 HA ILE 44 HA ILE 44 -19.789 9.213 3.299 347 HB ILE 44 HB ILE 44 -21.583 8.871 1.544 348 HG12 ILE 44 1HG1 ILE 44 -19.792 10.732 -0.033 349 HG13 ILE 44 2HG1 ILE 44 -20.107 9.045 -0.424 350 HG21 ILE 44 1HG2 ILE 44 -22.497 10.917 2.006 351 HG22 ILE 44 2HG2 ILE 44 -21.213 10.871 3.214 352 HG23 ILE 44 3HG2 ILE 44 -20.986 11.780 1.720 353 HD11 ILE 44 3HD1 ILE 44 -22.401 9.517 -0.889 354 HD12 ILE 44 1HD1 ILE 44 -22.229 11.171 -0.303 355 HD13 ILE 44 2HD1 ILE 44 -21.402 10.667 -1.777 356 HA PRO 45 HA PRO 45 -18.683 5.091 2.261 357 HB2 PRO 45 1HB PRO 45 -20.938 3.765 2.985 358 HB3 PRO 45 2HB PRO 45 -19.807 4.447 4.159 359 HG2 PRO 45 1HG PRO 45 -22.399 5.560 3.159 360 HG3 PRO 45 2HG PRO 45 -21.765 5.516 4.814 361 HD2 PRO 45 1HD PRO 45 -21.648 7.736 3.267 362 HD3 PRO 45 2HD PRO 45 -20.407 7.348 4.476 363 HA PRO 46 HA PRO 46 -20.214 3.893 -1.682 364 HB2 PRO 46 1HB PRO 46 -20.170 1.182 -1.542 365 HB3 PRO 46 2HB PRO 46 -18.703 2.162 -1.646 366 HG2 PRO 46 1HG PRO 46 -19.985 0.920 0.757 367 HG3 PRO 46 2HG PRO 46 -18.269 0.990 0.315 368 HD2 PRO 46 1HD PRO 46 -19.373 2.663 2.136 369 HD3 PRO 46 2HD PRO 46 -18.029 3.150 1.082 370 H ASP 47 H ASP 47 -21.792 2.405 1.096 371 HA ASP 47 HA ASP 47 -24.043 1.389 -0.285 372 HB2 ASP 47 1HB ASP 47 -23.407 1.978 2.580 373 HB3 ASP 47 2HB ASP 47 -25.072 1.624 2.127 374 H GLN 48 H GLN 48 -23.175 4.548 0.794 375 HA GLN 48 HA GLN 48 -25.911 5.516 0.326 376 HB2 GLN 48 1HB GLN 48 -23.604 6.574 1.922 377 HB3 GLN 48 2HB GLN 48 -24.855 7.672 1.356 378 HG2 GLN 48 1HG GLN 48 -25.466 7.068 3.539 379 HG3 GLN 48 2HG GLN 48 -26.526 6.149 2.471 380 HE21 GLN 48 2HE2 GLN 48 -24.233 6.013 4.963 381 HE22 GLN 48 1HE2 GLN 48 -24.094 4.294 5.070 382 H GLN 49 H GLN 49 -22.669 5.601 -0.862 383 HA GLN 49 HA GLN 49 -23.259 7.822 -2.668 384 HB2 GLN 49 1HB GLN 49 -21.022 7.384 -1.330 385 HB3 GLN 49 2HB GLN 49 -20.658 6.354 -2.708 386 HG2 GLN 49 1HG GLN 49 -21.544 9.179 -3.115 387 HG3 GLN 49 2HG GLN 49 -19.867 8.806 -2.719 388 HE21 GLN 49 2HE2 GLN 49 -20.431 10.044 -5.057 389 HE22 GLN 49 1HE2 GLN 49 -20.180 8.966 -6.384 390 H ARG 50 H ARG 50 -24.085 7.428 -4.602 391 HA ARG 50 HA ARG 50 -23.278 4.990 -6.024 392 HB2 ARG 50 1HB ARG 50 -26.113 6.018 -5.794 393 HB3 ARG 50 2HB ARG 50 -25.596 4.686 -6.819 394 HG2 ARG 50 1HG ARG 50 -24.719 3.660 -4.602 395 HG3 ARG 50 2HG ARG 50 -25.830 4.805 -3.847 396 HD2 ARG 50 1HD ARG 50 -26.848 3.137 -6.085 397 HD3 ARG 50 2HD ARG 50 -26.581 2.356 -4.527 398 HE ARG 50 HE ARG 50 -28.056 4.755 -4.209 399 HH11 ARG 50 1HH1 ARG 50 -28.357 1.460 -5.293 400 HH12 ARG 50 2HH1 ARG 50 -30.049 1.359 -4.932 401 HH21 ARG 50 1HH2 ARG 50 -30.283 4.634 -3.730 402 HH22 ARG 50 2HH2 ARG 50 -31.143 3.165 -4.045 403 H LEU 51 H LEU 51 -22.842 5.271 -8.143 404 HA LEU 51 HA LEU 51 -23.040 7.991 -9.188 405 HB2 LEU 51 1HB LEU 51 -21.436 5.574 -9.918 406 HB3 LEU 51 2HB LEU 51 -21.635 6.891 -11.072 407 HG LEU 51 HG LEU 51 -19.525 7.110 -9.918 408 HD11 LEU 51 1HD1 LEU 51 -19.664 9.364 -9.397 409 HD12 LEU 51 2HD1 LEU 51 -21.272 9.207 -8.693 410 HD13 LEU 51 3HD1 LEU 51 -21.063 9.116 -10.442 411 HD21 LEU 51 3HD2 LEU 51 -21.124 7.258 -7.365 412 HD22 LEU 51 1HD2 LEU 51 -19.374 7.408 -7.526 413 HD23 LEU 51 2HD2 LEU 51 -20.163 5.871 -7.880 414 H ILE 52 H ILE 52 -24.173 8.546 -10.996 415 HA ILE 52 HA ILE 52 -25.824 6.430 -12.218 416 HB ILE 52 HB ILE 52 -26.640 9.320 -11.953 417 HG12 ILE 52 1HG1 ILE 52 -26.421 8.334 -9.717 418 HG13 ILE 52 2HG1 ILE 52 -28.113 8.602 -10.122 419 HG21 ILE 52 1HG2 ILE 52 -28.084 6.808 -12.767 420 HG22 ILE 52 2HG2 ILE 52 -28.906 8.320 -12.386 421 HG23 ILE 52 3HG2 ILE 52 -27.779 8.247 -13.740 422 HD11 ILE 52 3HD1 ILE 52 -26.720 5.953 -10.399 423 HD12 ILE 52 1HD1 ILE 52 -27.647 6.445 -8.983 424 HD13 ILE 52 2HD1 ILE 52 -28.446 6.280 -10.547 425 H PHE 53 H PHE 53 -26.037 6.405 -14.418 426 HA PHE 53 HA PHE 53 -24.805 8.553 -15.974 427 HB2 PHE 53 1HB PHE 53 -23.099 6.745 -15.565 428 HB3 PHE 53 2HB PHE 53 -24.140 5.647 -16.465 429 HD1 PHE 53 HD2 PHE 53 -22.140 8.744 -16.726 430 HD2 PHE 53 HD1 PHE 53 -24.134 5.616 -18.814 431 HE1 PHE 53 HE2 PHE 53 -21.099 9.487 -18.827 432 HE2 PHE 53 HE1 PHE 53 -23.095 6.355 -20.919 433 HZ PHE 53 HZ PHE 53 -21.576 8.293 -20.927 434 H ALA 54 H ALA 54 -26.245 9.188 -17.422 435 HA ALA 54 HA ALA 54 -27.976 9.202 -18.902 436 HB1 ALA 54 1HB ALA 54 -26.333 7.691 -20.070 437 HB2 ALA 54 2HB ALA 54 -27.274 6.330 -19.458 438 HB3 ALA 54 3HB ALA 54 -28.020 7.498 -20.547 439 H GLY 55 H GLY 55 -28.520 8.434 -16.143 440 HA2 GLY 55 1HA GLY 55 -30.560 8.019 -15.084 441 HA3 GLY 55 2HA GLY 55 -31.170 7.331 -16.581 442 H LYS 56 H LYS 56 -28.359 5.832 -16.348 443 HA LYS 56 HA LYS 56 -29.506 3.593 -14.823 444 HB2 LYS 56 1HB LYS 56 -28.987 3.225 -17.246 445 HB3 LYS 56 2HB LYS 56 -27.290 3.503 -16.877 446 HG2 LYS 56 1HG LYS 56 -27.329 1.235 -16.786 447 HG3 LYS 56 2HG LYS 56 -27.729 1.595 -15.104 448 HD2 LYS 56 1HD LYS 56 -29.289 -0.033 -15.769 449 HD3 LYS 56 2HD LYS 56 -30.169 1.496 -15.833 450 HE2 LYS 56 1HE LYS 56 -30.665 0.171 -17.798 451 HE3 LYS 56 2HE LYS 56 -29.753 1.608 -18.256 452 HZ1 LYS 56 3HZ LYS 56 -27.865 0.375 -18.688 453 HZ2 LYS 56 1HZ LYS 56 -29.088 -0.654 -19.242 454 HZ3 LYS 56 2HZ LYS 56 -28.360 -0.938 -17.743 455 H GLN 57 H GLN 57 -28.606 3.044 -12.953 456 HA GLN 57 HA GLN 57 -26.481 4.458 -11.800 457 HB2 GLN 57 1HB GLN 57 -26.495 2.589 -10.099 458 HB3 GLN 57 2HB GLN 57 -28.034 3.403 -10.348 459 HG2 GLN 57 1HG GLN 57 -27.576 1.031 -12.023 460 HG3 GLN 57 2HG GLN 57 -27.718 0.729 -10.292 461 HE21 GLN 57 2HE2 GLN 57 -29.561 2.376 -9.404 462 HE22 GLN 57 1HE2 GLN 57 -31.074 2.154 -10.209 463 H LEU 58 H LEU 58 -24.382 3.678 -11.139 464 HA LEU 58 HA LEU 58 -23.230 1.807 -13.100 465 HB2 LEU 58 1HB LEU 58 -21.730 3.913 -11.566 466 HB3 LEU 58 2HB LEU 58 -21.180 2.993 -12.964 467 HG LEU 58 HG LEU 58 -23.420 5.004 -13.077 468 HD11 LEU 58 1HD1 LEU 58 -20.868 5.681 -12.504 469 HD12 LEU 58 2HD1 LEU 58 -21.981 6.695 -13.421 470 HD13 LEU 58 3HD1 LEU 58 -20.818 5.675 -14.267 471 HD21 LEU 58 3HD2 LEU 58 -23.720 4.146 -15.103 472 HD22 LEU 58 1HD2 LEU 58 -22.325 3.083 -14.914 473 HD23 LEU 58 2HD2 LEU 58 -22.108 4.720 -15.533 474 H GLU 59 H GLU 59 -21.688 0.294 -12.409 475 HA GLU 59 HA GLU 59 -21.336 -0.015 -9.517 476 HB2 GLU 59 1HB GLU 59 -21.767 -2.472 -9.757 477 HB3 GLU 59 2HB GLU 59 -23.188 -1.459 -9.973 478 HG2 GLU 59 1HG GLU 59 -22.791 -1.629 -12.452 479 HG3 GLU 59 2HG GLU 59 -21.585 -2.862 -12.090 480 H ASP 60 H ASP 60 -19.718 -1.843 -9.073 481 HA ASP 60 HA ASP 60 -17.293 -1.213 -10.363 482 HB2 ASP 60 1HB ASP 60 -16.272 -2.723 -8.892 483 HB3 ASP 60 2HB ASP 60 -17.689 -2.176 -7.999 484 H GLY 61 H GLY 61 -15.928 -3.507 -10.846 485 HA2 GLY 61 1HA GLY 61 -15.747 -5.367 -12.249 486 HA3 GLY 61 2HA GLY 61 -17.428 -5.151 -12.714 487 H ARG 62 H ARG 62 -17.542 -2.654 -13.704 488 HA ARG 62 HA ARG 62 -15.887 -2.886 -16.103 489 HB2 ARG 62 1HB ARG 62 -18.495 -1.581 -15.460 490 HB3 ARG 62 2HB ARG 62 -17.537 -0.935 -16.786 491 HG2 ARG 62 1HG ARG 62 -19.107 -2.484 -17.684 492 HG3 ARG 62 2HG ARG 62 -17.503 -3.212 -17.786 493 HD2 ARG 62 1HD ARG 62 -17.940 -4.726 -16.087 494 HD3 ARG 62 2HD ARG 62 -19.245 -3.747 -15.417 495 HE ARG 62 HE ARG 62 -20.055 -4.522 -17.947 496 HH11 ARG 62 1HH1 ARG 62 -19.208 -6.053 -14.937 497 HH12 ARG 62 2HH1 ARG 62 -20.250 -7.415 -15.186 498 HH21 ARG 62 1HH2 ARG 62 -21.431 -6.310 -18.286 499 HH22 ARG 62 2HH2 ARG 62 -21.513 -7.560 -17.092 500 H THR 63 H THR 63 -15.213 -0.753 -17.114 501 HA THR 63 HA THR 63 -14.032 0.942 -15.016 502 HB THR 63 HB THR 63 -12.251 -0.018 -16.214 503 HG1 THR 63 HG1 THR 63 -11.836 1.986 -17.791 504 HG21 THR 63 3HG2 THR 63 -13.947 0.470 -18.642 505 HG22 THR 63 1HG2 THR 63 -13.222 -1.036 -18.080 506 HG23 THR 63 2HG2 THR 63 -12.206 0.223 -18.783 507 H LEU 64 H LEU 64 -13.688 3.233 -15.604 508 HA LEU 64 HA LEU 64 -16.036 4.541 -16.231 509 HB2 LEU 64 1HB LEU 64 -13.167 5.406 -16.314 510 HB3 LEU 64 2HB LEU 64 -14.465 6.513 -16.758 511 HG LEU 64 HG LEU 64 -13.827 6.935 -14.487 512 HD11 LEU 64 1HD1 LEU 64 -16.364 5.367 -14.227 513 HD12 LEU 64 2HD1 LEU 64 -16.298 6.830 -15.209 514 HD13 LEU 64 3HD1 LEU 64 -15.922 6.907 -13.488 515 HD21 LEU 64 3HD2 LEU 64 -12.823 4.709 -14.060 516 HD22 LEU 64 1HD2 LEU 64 -14.448 4.044 -13.897 517 HD23 LEU 64 2HD2 LEU 64 -13.876 5.262 -12.757 518 H SER 65 H SER 65 -13.375 3.624 -18.360 519 HA SER 65 HA SER 65 -14.292 4.987 -20.657 520 HB2 SER 65 1HB SER 65 -11.997 4.220 -20.527 521 HB3 SER 65 2HB SER 65 -12.526 2.543 -20.386 522 HG SER 65 HG SER 65 -11.883 3.627 -22.570 523 H GLU 66 H GLU 66 -15.098 1.906 -19.236 524 HA GLU 66 HA GLU 66 -16.436 0.862 -21.540 525 HB2 GLU 66 1HB GLU 66 -16.258 0.067 -18.655 526 HB3 GLU 66 2HB GLU 66 -17.450 -0.691 -19.702 527 HG2 GLU 66 1HG GLU 66 -14.571 -0.590 -20.496 528 HG3 GLU 66 2HG GLU 66 -15.159 -1.820 -19.379 529 H TYR 67 H TYR 67 -17.305 2.928 -18.901 530 HA TYR 67 HA TYR 67 -20.158 2.642 -19.414 531 HB2 TYR 67 1HB TYR 67 -18.520 4.045 -17.331 532 HB3 TYR 67 2HB TYR 67 -20.201 4.506 -17.579 533 HD1 TYR 67 HD1 TYR 67 -21.656 2.107 -17.967 534 HD2 TYR 67 HD2 TYR 67 -18.296 2.754 -15.438 535 HE1 TYR 67 HE1 TYR 67 -22.382 0.243 -16.536 536 HE2 TYR 67 HE2 TYR 67 -19.012 0.891 -14.001 537 HH TYR 67 HH TYR 67 -21.688 -1.193 -14.888 538 H ASN 68 H ASN 68 -17.952 4.019 -21.150 539 HA ASN 68 HA ASN 68 -17.860 5.740 -22.633 540 HB2 ASN 68 1HB ASN 68 -20.759 5.441 -22.073 541 HB3 ASN 68 2HB ASN 68 -20.260 6.937 -22.856 542 HD21 ASN 68 2HD2 ASN 68 -20.216 6.899 -24.976 543 HD22 ASN 68 1HD2 ASN 68 -20.039 5.496 -25.969 544 H ILE 69 H ILE 69 -17.572 6.167 -19.656 545 HA ILE 69 HA ILE 69 -18.398 8.919 -19.285 546 HB ILE 69 HB ILE 69 -16.738 7.127 -17.509 547 HG12 ILE 69 1HG1 ILE 69 -19.563 8.001 -16.987 548 HG13 ILE 69 2HG1 ILE 69 -19.241 6.605 -18.010 549 HG21 ILE 69 1HG2 ILE 69 -17.983 9.203 -16.058 550 HG22 ILE 69 2HG2 ILE 69 -16.260 8.935 -16.319 551 HG23 ILE 69 3HG2 ILE 69 -17.175 9.943 -17.440 552 HD11 ILE 69 3HD1 ILE 69 -18.625 6.971 -15.101 553 HD12 ILE 69 1HD1 ILE 69 -19.618 5.737 -15.875 554 HD13 ILE 69 2HD1 ILE 69 -17.865 5.709 -16.071 555 H GLN 70 H GLN 70 -17.267 10.257 -20.609 556 HA GLN 70 HA GLN 70 -14.373 10.003 -20.797 557 HB2 GLN 70 1HB GLN 70 -16.122 12.082 -22.107 558 HB3 GLN 70 2HB GLN 70 -14.487 11.617 -22.558 559 HG2 GLN 70 1HG GLN 70 -15.463 9.305 -23.022 560 HG3 GLN 70 2HG GLN 70 -17.038 10.094 -22.941 561 HE21 GLN 70 2HE2 GLN 70 -17.172 9.318 -25.172 562 HE22 GLN 70 1HE2 GLN 70 -16.506 10.296 -26.430 563 H LYS 71 H LYS 71 -13.544 12.578 -21.096 564 HA LYS 71 HA LYS 71 -13.404 13.461 -18.376 565 HB2 LYS 71 1HB LYS 71 -11.842 15.100 -19.160 566 HB3 LYS 71 2HB LYS 71 -11.510 13.596 -20.009 567 HG2 LYS 71 1HG LYS 71 -13.052 14.597 -21.844 568 HG3 LYS 71 2HG LYS 71 -12.699 16.130 -21.043 569 HD2 LYS 71 1HD LYS 71 -11.069 15.941 -22.722 570 HD3 LYS 71 2HD LYS 71 -10.240 15.466 -21.238 571 HE2 LYS 71 1HE LYS 71 -10.476 13.138 -21.793 572 HE3 LYS 71 2HE LYS 71 -11.476 13.530 -23.190 573 HZ1 LYS 71 3HZ LYS 71 -8.581 13.759 -22.854 574 HZ2 LYS 71 1HZ LYS 71 -9.348 14.912 -23.825 575 HZ3 LYS 71 2HZ LYS 71 -9.476 13.269 -24.203 576 H GLU 72 H GLU 72 -15.675 13.919 -20.750 577 HA GLU 72 HA GLU 72 -16.565 16.448 -19.526 578 HB2 GLU 72 1HB GLU 72 -17.701 16.866 -21.774 579 HB3 GLU 72 2HB GLU 72 -15.954 17.056 -21.716 580 HG2 GLU 72 1HG GLU 72 -15.676 14.838 -22.695 581 HG3 GLU 72 2HG GLU 72 -17.427 14.643 -22.748 582 H SER 73 H SER 73 -17.170 13.575 -18.945 583 HA SER 73 HA SER 73 -19.920 13.229 -19.767 584 HB2 SER 73 1HB SER 73 -19.640 11.072 -19.159 585 HB3 SER 73 2HB SER 73 -17.929 11.479 -19.041 586 HG SER 73 HG SER 73 -18.216 11.861 -16.837 587 H THR 74 H THR 74 -21.714 13.145 -18.356 588 HA THR 74 HA THR 74 -21.411 14.877 -16.003 589 HB THR 74 HB THR 74 -24.115 14.166 -17.012 590 HG1 THR 74 HG1 THR 74 -23.880 15.847 -18.629 591 HG21 THR 74 3HG2 THR 74 -24.316 16.711 -16.615 592 HG22 THR 74 1HG2 THR 74 -22.755 16.557 -15.812 593 HG23 THR 74 2HG2 THR 74 -24.147 15.654 -15.214 594 H LEU 75 H LEU 75 -21.255 13.838 -14.132 595 HA LEU 75 HA LEU 75 -22.664 11.280 -13.801 596 HB2 LEU 75 1HB LEU 75 -20.136 12.393 -12.781 597 HB3 LEU 75 2HB LEU 75 -21.077 11.463 -11.618 598 HG LEU 75 HG LEU 75 -19.383 10.085 -12.704 599 HD11 LEU 75 1HD1 LEU 75 -21.441 8.680 -13.982 600 HD12 LEU 75 2HD1 LEU 75 -22.201 9.548 -12.648 601 HD13 LEU 75 3HD1 LEU 75 -20.847 8.462 -12.336 602 HD21 LEU 75 3HD2 LEU 75 -20.796 10.927 -15.224 603 HD22 LEU 75 1HD2 LEU 75 -19.731 9.524 -15.136 604 HD23 LEU 75 2HD2 LEU 75 -19.095 11.137 -14.807 605 H HIS 76 H HIS 76 -23.804 10.859 -11.842 606 HA HIS 76 HA HIS 76 -24.537 13.231 -10.274 607 HB2 HIS 76 1HB HIS 76 -26.335 11.434 -11.834 608 HB3 HIS 76 2HB HIS 76 -26.915 12.047 -10.289 609 HD1 HIS 76 HD1 HIS 76 -28.157 14.167 -10.476 610 HD2 HIS 76 HD2 HIS 76 -25.362 13.752 -13.522 611 HE1 HIS 76 HE1 HIS 76 -28.441 16.198 -11.930 612 H LEU 77 H LEU 77 -24.681 12.894 -8.129 613 HA LEU 77 HA LEU 77 -24.320 10.134 -7.182 614 HB2 LEU 77 1HB LEU 77 -23.437 11.174 -5.119 615 HB3 LEU 77 2HB LEU 77 -22.495 11.547 -6.561 616 HG LEU 77 HG LEU 77 -24.215 13.682 -6.403 617 HD11 LEU 77 1HD1 LEU 77 -24.804 14.178 -4.311 618 HD12 LEU 77 2HD1 LEU 77 -23.230 13.719 -3.664 619 HD13 LEU 77 3HD1 LEU 77 -24.462 12.488 -3.941 620 HD21 LEU 77 3HD2 LEU 77 -21.620 13.831 -4.960 621 HD22 LEU 77 1HD2 LEU 77 -22.303 14.908 -6.179 622 HD23 LEU 77 2HD2 LEU 77 -21.605 13.361 -6.661 623 H VAL 78 H VAL 78 -26.075 9.209 -6.379 624 HA VAL 78 HA VAL 78 -28.098 10.907 -5.072 625 HB VAL 78 HB VAL 78 -29.657 8.953 -5.521 626 HG11 VAL 78 1HG1 VAL 78 -28.730 10.016 -8.137 627 HG12 VAL 78 2HG1 VAL 78 -30.359 9.921 -7.466 628 HG13 VAL 78 3HG1 VAL 78 -29.246 11.169 -6.906 629 HG21 VAL 78 3HG2 VAL 78 -27.970 8.111 -7.782 630 HG22 VAL 78 1HG2 VAL 78 -27.413 7.603 -6.187 631 HG23 VAL 78 2HG2 VAL 78 -29.028 7.161 -6.739 632 H LEU 79 H LEU 79 -28.546 10.574 -2.985 633 HA LEU 79 HA LEU 79 -27.281 8.275 -1.662 634 HB2 LEU 79 1HB LEU 79 -28.037 11.021 -0.741 635 HB3 LEU 79 2HB LEU 79 -27.822 9.716 0.424 636 HG LEU 79 HG LEU 79 -25.496 9.426 -0.463 637 HD11 LEU 79 1HD1 LEU 79 -26.294 11.867 -2.015 638 HD12 LEU 79 2HD1 LEU 79 -25.558 10.377 -2.602 639 HD13 LEU 79 3HD1 LEU 79 -24.609 11.507 -1.637 640 HD21 LEU 79 3HD2 LEU 79 -26.314 10.912 1.532 641 HD22 LEU 79 1HD2 LEU 79 -25.784 12.236 0.493 642 HD23 LEU 79 2HD2 LEU 79 -24.638 10.989 0.986 643 H ARG 80 H ARG 80 -28.447 6.852 -0.461 644 HA ARG 80 HA ARG 80 -31.370 7.215 -0.470 645 HB2 ARG 80 1HB ARG 80 -30.168 5.256 -1.754 646 HB3 ARG 80 2HB ARG 80 -30.093 4.530 -0.154 647 HG2 ARG 80 1HG ARG 80 -32.697 5.578 -1.153 648 HG3 ARG 80 2HG ARG 80 -32.094 4.031 -1.751 649 HD2 ARG 80 1HD ARG 80 -31.776 3.405 0.703 650 HD3 ARG 80 2HD ARG 80 -32.772 4.813 1.069 651 HE ARG 80 HE ARG 80 -33.954 3.008 -0.834 652 HH11 ARG 80 1HH1 ARG 80 -33.541 3.759 2.540 653 HH12 ARG 80 2HH1 ARG 80 -34.979 2.930 3.035 654 HH21 ARG 80 1HH2 ARG 80 -35.850 1.913 -0.194 655 HH22 ARG 80 2HH2 ARG 80 -36.292 1.879 1.479 656 H LEU 81 H LEU 81 -28.654 5.902 1.398 657 HA LEU 81 HA LEU 81 -30.315 6.109 3.821 658 HB2 LEU 81 1HB LEU 81 -27.884 4.402 3.310 659 HB3 LEU 81 2HB LEU 81 -28.771 4.485 4.831 660 HG LEU 81 HG LEU 81 -29.693 3.311 2.216 661 HD11 LEU 81 1HD1 LEU 81 -30.053 1.328 3.747 662 HD12 LEU 81 2HD1 LEU 81 -29.114 2.209 4.952 663 HD13 LEU 81 3HD1 LEU 81 -28.377 1.765 3.413 664 HD21 LEU 81 3HD2 LEU 81 -31.251 4.082 4.660 665 HD22 LEU 81 1HD2 LEU 81 -31.768 2.751 3.623 666 HD23 LEU 81 2HD2 LEU 81 -31.626 4.380 2.962 667 H ARG 82 H ARG 82 -28.549 6.158 5.802 668 HA ARG 82 HA ARG 82 -26.759 8.425 5.227 669 HB2 ARG 82 1HB ARG 82 -28.996 8.871 6.523 670 HB3 ARG 82 2HB ARG 82 -28.122 8.172 7.880 671 HG2 ARG 82 1HG ARG 82 -26.284 9.915 7.154 672 HG3 ARG 82 2HG ARG 82 -27.680 10.738 6.454 673 HD2 ARG 82 1HD ARG 82 -28.538 9.982 8.976 674 HD3 ARG 82 2HD ARG 82 -26.866 10.483 9.228 675 HE ARG 82 HE ARG 82 -27.539 12.636 8.927 676 HH11 ARG 82 1HH1 ARG 82 -29.872 10.533 7.425 677 HH12 ARG 82 2HH1 ARG 82 -30.953 11.819 7.001 678 HH21 ARG 82 1HH2 ARG 82 -28.953 14.338 8.374 679 HH22 ARG 82 2HH2 ARG 82 -30.428 13.984 7.540 680 H GLY 83 H GLY 83 -24.778 8.418 6.221 681 HA2 GLY 83 1HA GLY 83 -24.210 6.176 8.051 682 HA3 GLY 83 2HA GLY 83 -23.170 6.486 6.668 683 H TYR 84 H TYR 84 -21.616 8.033 6.799 684 HA TYR 84 HA TYR 84 -20.133 9.456 7.771 685 HB2 TYR 84 1HB TYR 84 -22.727 10.444 8.937 686 HB3 TYR 84 2HB TYR 84 -21.191 11.208 9.330 687 HD1 TYR 84 HD2 TYR 84 -19.710 11.535 7.009 688 HD2 TYR 84 HD1 TYR 84 -23.950 11.584 7.361 689 HE1 TYR 84 HE2 TYR 84 -19.858 12.892 4.963 690 HE2 TYR 84 HE1 TYR 84 -24.110 12.940 5.316 691 HH TYR 84 HH TYR 84 -21.309 14.325 3.805 692 H ALA 85 H ALA 85 -20.442 6.894 8.955 693 HA ALA 85 HA ALA 85 -19.943 7.484 11.799 694 HB1 ALA 85 1HB ALA 85 -21.733 6.010 11.794 695 HB2 ALA 85 2HB ALA 85 -21.099 5.086 10.431 696 HB3 ALA 85 3HB ALA 85 -20.349 4.940 12.020 697 H ASP 86 H ASP 86 -18.009 7.752 9.627 698 HA ASP 86 HA ASP 86 -15.944 6.020 10.745 699 HB2 ASP 86 1HB ASP 86 -16.160 6.310 7.755 700 HB3 ASP 86 2HB ASP 86 -15.189 5.167 8.679 701 H LEU 87 H LEU 87 -13.755 6.663 9.551 702 HA LEU 87 HA LEU 87 -13.687 9.578 9.199 703 HB2 LEU 87 1HB LEU 87 -11.683 8.044 10.841 704 HB3 LEU 87 2HB LEU 87 -11.766 9.790 10.615 705 HG LEU 87 HG LEU 87 -13.947 8.240 11.991 706 HD11 LEU 87 1HD1 LEU 87 -12.016 7.769 13.285 707 HD12 LEU 87 2HD1 LEU 87 -12.878 9.069 14.108 708 HD13 LEU 87 3HD1 LEU 87 -11.440 9.431 13.154 709 HD21 LEU 87 3HD2 LEU 87 -13.139 11.144 12.101 710 HD22 LEU 87 1HD2 LEU 87 -14.516 10.404 12.917 711 HD23 LEU 87 2HD2 LEU 87 -14.479 10.493 11.156 712 H ARG 88 H ARG 88 -11.451 10.272 8.386 713 HA ARG 88 HA ARG 88 -9.986 8.295 6.882 714 HB2 ARG 88 1HB ARG 88 -11.825 8.666 5.349 715 HB3 ARG 88 2HB ARG 88 -11.617 10.408 5.467 716 HG2 ARG 88 1HG ARG 88 -10.702 9.611 3.387 717 HG3 ARG 88 2HG ARG 88 -9.399 10.193 4.425 718 HD2 ARG 88 1HD ARG 88 -8.947 7.864 5.106 719 HD3 ARG 88 2HD ARG 88 -10.202 7.317 3.995 720 HE ARG 88 HE ARG 88 -8.493 8.798 2.453 721 HH11 ARG 88 1HH1 ARG 88 -8.192 6.020 4.530 722 HH12 ARG 88 2HH1 ARG 88 -6.878 5.331 3.636 723 HH21 ARG 88 1HH2 ARG 88 -6.763 7.900 1.267 724 HH22 ARG 88 2HH2 ARG 88 -6.065 6.401 1.780 725 H GLU 89 H GLU 89 -7.925 8.850 7.061 726 HA GLU 89 HA GLU 89 -7.026 11.528 6.551 727 HB2 GLU 89 1HB GLU 89 -5.835 11.668 8.804 728 HB3 GLU 89 2HB GLU 89 -7.565 11.984 8.796 729 HG2 GLU 89 1HG GLU 89 -8.027 9.794 9.657 730 HG3 GLU 89 2HG GLU 89 -6.330 9.339 9.522 731 H ASP 90 H ASP 90 -5.291 11.212 5.340 732 HA ASP 90 HA ASP 90 -3.083 9.639 6.237 733 HB2 ASP 90 1HB ASP 90 -4.437 7.809 5.384 734 HB3 ASP 90 2HB ASP 90 -4.664 8.652 3.854 735 HA PRO 91 HA PRO 91 -1.098 12.687 3.746 736 HB2 PRO 91 1HB PRO 91 1.392 11.604 3.712 737 HB3 PRO 91 2HB PRO 91 0.714 12.410 5.132 738 HG2 PRO 91 1HG PRO 91 0.899 9.485 4.521 739 HG3 PRO 91 2HG PRO 91 1.218 10.332 6.046 740 HD2 PRO 91 1HD PRO 91 -1.099 9.015 5.567 741 HD3 PRO 91 2HD PRO 91 -1.020 10.469 6.583 742 H ASP 92 H ASP 92 0.808 12.460 1.930 743 HA ASP 92 HA ASP 92 1.247 11.960 -0.245 744 HB2 ASP 92 1HB ASP 92 -0.001 9.254 0.132 745 HB3 ASP 92 2HB ASP 92 1.388 9.706 -0.852 746 H ARG 93 H ARG 93 -1.378 13.043 0.572 747 HA ARG 93 HA ARG 93 -3.040 12.072 -1.654 748 HB2 ARG 93 1HB ARG 93 -3.817 13.562 0.858 749 HB3 ARG 93 2HB ARG 93 -4.927 13.170 -0.448 750 HG2 ARG 93 1HG ARG 93 -3.378 11.100 1.087 751 HG3 ARG 93 2HG ARG 93 -5.003 11.633 1.525 752 HD2 ARG 93 1HD ARG 93 -4.257 10.488 -1.162 753 HD3 ARG 93 2HD ARG 93 -4.936 9.544 0.163 754 HE ARG 93 HE ARG 93 -6.664 11.658 -0.241 755 HH11 ARG 93 1HH1 ARG 93 -5.449 8.968 -2.087 756 HH12 ARG 93 2HH1 ARG 93 -6.877 8.820 -3.057 757 HH21 ARG 93 1HH2 ARG 93 -8.549 11.473 -1.511 758 HH22 ARG 93 2HH2 ARG 93 -8.640 10.246 -2.729 759 H GLN 94 H GLN 94 -4.462 13.813 -2.630 760 HA GLN 94 HA GLN 94 -4.607 15.684 -3.917 761 HB2 GLN 94 1HB GLN 94 -4.568 16.581 -1.447 762 HB3 GLN 94 2HB GLN 94 -2.993 17.209 -1.913 763 HG2 GLN 94 1HG GLN 94 -4.364 18.989 -2.368 764 HG3 GLN 94 2HG GLN 94 -4.273 18.197 -3.940 765 HE21 GLN 94 2HE2 GLN 94 -6.191 17.872 -0.966 766 HE22 GLN 94 1HE2 GLN 94 -7.723 17.795 -1.761 767 H ASP 95 H ASP 95 -2.642 14.044 -4.759 768 HA ASP 95 HA ASP 95 -0.557 15.932 -5.622 769 HB2 ASP 95 1HB ASP 95 1.124 14.191 -5.503 770 HB3 ASP 95 2HB ASP 95 0.350 14.354 -3.929 771 H HIS 96 H HIS 96 -0.434 16.127 -7.755 772 HA HIS 96 HA HIS 96 -1.980 14.367 -9.451 773 HB2 HIS 96 1HB HIS 96 -1.830 16.902 -9.700 774 HB3 HIS 96 2HB HIS 96 -0.216 16.641 -10.355 775 HD1 HIS 96 HD1 HIS 96 -3.790 16.518 -11.240 776 HD2 HIS 96 HD2 HIS 96 -0.183 15.252 -12.866 777 HE1 HIS 96 HE1 HIS 96 -4.289 15.979 -13.645 778 H HIS 97 H HIS 97 -1.225 12.733 -10.638 779 HA HIS 97 HA HIS 97 1.696 12.389 -10.804 780 HB2 HIS 97 1HB HIS 97 -0.547 10.478 -10.382 781 HB3 HIS 97 2HB HIS 97 0.833 9.915 -11.320 782 HD1 HIS 97 HD1 HIS 97 3.236 10.678 -9.930 783 HD2 HIS 97 HD2 HIS 97 -0.222 9.812 -7.796 784 HE1 HIS 97 HE1 HIS 97 4.005 10.112 -7.604 785 HA PRO 98 HA PRO 98 1.615 12.472 -15.188 786 HB2 PRO 98 1HB PRO 98 3.376 10.514 -15.847 787 HB3 PRO 98 2HB PRO 98 3.874 12.058 -15.145 788 HG2 PRO 98 1HG PRO 98 3.496 9.405 -13.811 789 HG3 PRO 98 2HG PRO 98 4.796 10.591 -13.594 790 HD2 PRO 98 1HD PRO 98 2.731 10.359 -11.858 791 HD3 PRO 98 2HD PRO 98 3.529 11.909 -12.190 792 H GLY 99 H GLY 99 1.650 10.790 -17.157 793 HA2 GLY 99 1HA GLY 99 -0.308 8.666 -16.554 794 HA3 GLY 99 2HA GLY 99 -0.560 9.776 -17.893 795 H SER 100 H SER 100 -0.620 7.223 -18.558 796 HA SER 100 HA SER 100 1.546 6.953 -20.382 797 HB2 SER 100 1HB SER 100 2.109 4.578 -19.368 798 HB3 SER 100 2HB SER 100 2.921 6.025 -18.772 799 HG SER 100 HG SER 100 1.230 4.329 -17.482 800 H GLY 101 H GLY 101 1.416 4.690 -21.478 801 HA2 GLY 101 1HA GLY 101 0.102 2.906 -22.274 802 HA3 GLY 101 2HA GLY 101 -1.279 3.569 -21.414 803 H ALA 102 H ALA 102 -1.756 2.715 -23.888 804 HA ALA 102 HA ALA 102 -1.839 5.168 -25.523 805 HB1 ALA 102 1HB ALA 102 -2.068 2.391 -26.642 806 HB2 ALA 102 2HB ALA 102 -1.689 3.894 -27.484 807 HB3 ALA 102 3HB ALA 102 -0.506 3.172 -26.393 808 H GLN 103 H GLN 103 -3.734 5.278 -27.014 809 HA GLN 103 HA GLN 103 -6.122 4.002 -25.866 810 HB2 GLN 103 1HB GLN 103 -7.333 6.172 -26.307 811 HB3 GLN 103 2HB GLN 103 -6.176 6.208 -24.983 812 HG2 GLN 103 1HG GLN 103 -4.553 7.322 -26.385 813 HG3 GLN 103 2HG GLN 103 -5.641 7.214 -27.768 814 HE21 GLN 103 2HE2 GLN 103 -4.418 9.426 -25.981 815 HE22 GLN 103 1HE2 GLN 103 -5.758 10.480 -25.703 Start of MODEL 2 1 H1 GLY 1 H GLY 1 4.712 10.876 -3.767 2 HA2 GLY 1 1HA GLY 1 4.879 13.479 -2.773 3 HA3 GLY 1 2HA GLY 1 5.268 13.004 -4.420 4 H SER 2 H SER 2 4.353 14.549 -5.636 5 HA SER 2 HA SER 2 1.540 15.235 -5.113 6 HB2 SER 2 1HB SER 2 3.422 16.794 -6.880 7 HB3 SER 2 2HB SER 2 1.914 17.336 -6.144 8 HG SER 2 HG SER 2 4.241 16.608 -4.691 9 H LEU 3 H LEU 3 3.783 14.804 -7.853 10 HA LEU 3 HA LEU 3 1.534 13.673 -9.384 11 HB2 LEU 3 1HB LEU 3 2.245 15.895 -10.197 12 HB3 LEU 3 2HB LEU 3 3.863 15.251 -10.468 13 HG LEU 3 HG LEU 3 2.622 13.559 -12.022 14 HD11 LEU 3 1HD1 LEU 3 0.365 14.150 -11.451 15 HD12 LEU 3 2HD1 LEU 3 0.669 14.612 -13.125 16 HD13 LEU 3 3HD1 LEU 3 0.659 15.840 -11.860 17 HD21 LEU 3 3HD2 LEU 3 3.668 14.715 -13.606 18 HD22 LEU 3 1HD2 LEU 3 3.980 15.964 -12.401 19 HD23 LEU 3 2HD2 LEU 3 2.555 16.073 -13.435 20 H VAL 4 H VAL 4 1.831 11.719 -10.281 21 HA VAL 4 HA VAL 4 4.543 10.566 -10.168 22 HB VAL 4 HB VAL 4 3.292 8.332 -10.061 23 HG11 VAL 4 1HG1 VAL 4 3.088 10.190 -7.694 24 HG12 VAL 4 2HG1 VAL 4 3.133 8.427 -7.645 25 HG13 VAL 4 3HG1 VAL 4 4.546 9.332 -8.191 26 HG21 VAL 4 3HG2 VAL 4 1.056 8.359 -9.163 27 HG22 VAL 4 1HG2 VAL 4 1.061 10.121 -9.103 28 HG23 VAL 4 2HG2 VAL 4 1.083 9.292 -10.659 29 HA PRO 5 HA PRO 5 4.375 9.744 -14.477 30 HB2 PRO 5 1HB PRO 5 5.725 7.394 -14.633 31 HB3 PRO 5 2HB PRO 5 6.518 8.936 -14.291 32 HG2 PRO 5 1HG PRO 5 5.679 6.777 -12.395 33 HG3 PRO 5 2HG PRO 5 7.182 7.717 -12.425 34 HD2 PRO 5 1HD PRO 5 5.148 8.277 -10.729 35 HD3 PRO 5 2HD PRO 5 6.215 9.534 -11.388 36 H ARG 6 H ARG 6 2.024 9.419 -14.436 37 HA ARG 6 HA ARG 6 1.317 6.872 -15.520 38 HB2 ARG 6 1HB ARG 6 1.268 6.553 -12.976 39 HB3 ARG 6 2HB ARG 6 -0.134 7.614 -12.988 40 HG2 ARG 6 1HG ARG 6 -1.131 5.993 -14.687 41 HG3 ARG 6 2HG ARG 6 0.159 4.890 -14.203 42 HD2 ARG 6 1HD ARG 6 -0.644 5.332 -11.803 43 HD3 ARG 6 2HD ARG 6 -2.096 5.988 -12.557 44 HE ARG 6 HE ARG 6 -2.763 3.854 -13.027 45 HH11 ARG 6 1HH1 ARG 6 0.644 3.839 -12.309 46 HH12 ARG 6 2HH1 ARG 6 0.772 2.111 -12.323 47 HH21 ARG 6 1HH2 ARG 6 -2.607 1.578 -13.049 48 HH22 ARG 6 2HH2 ARG 6 -1.077 0.826 -12.745 49 H GLY 7 H GLY 7 -0.718 6.883 -16.546 50 HA2 GLY 7 1HA GLY 7 -1.538 9.332 -17.608 51 HA3 GLY 7 2HA GLY 7 -2.466 7.842 -17.680 52 H SER 8 H SER 8 -4.010 9.913 -17.559 53 HA SER 8 HA SER 8 -5.479 9.637 -15.190 54 HB2 SER 8 1HB SER 8 -5.150 12.075 -14.402 55 HB3 SER 8 2HB SER 8 -3.908 10.898 -13.977 56 HG SER 8 HG SER 8 -2.749 12.517 -14.803 57 H MET 9 H MET 9 -7.415 10.917 -15.174 58 HA MET 9 HA MET 9 -7.917 12.619 -17.478 59 HB2 MET 9 1HB MET 9 -8.504 10.504 -18.419 60 HB3 MET 9 2HB MET 9 -9.385 10.033 -16.972 61 HG2 MET 9 1HG MET 9 -11.182 11.407 -17.459 62 HG3 MET 9 2HG MET 9 -10.238 12.421 -18.548 63 HE1 MET 9 3HE MET 9 -9.119 11.625 -20.480 64 HE2 MET 9 1HE MET 9 -9.108 9.936 -20.989 65 HE3 MET 9 2HE MET 9 -10.197 11.085 -21.768 66 H GLN 10 H GLN 10 -9.334 14.218 -17.037 67 HA GLN 10 HA GLN 10 -10.487 14.262 -14.350 68 HB2 GLN 10 1HB GLN 10 -9.191 16.201 -14.851 69 HB3 GLN 10 2HB GLN 10 -9.993 16.417 -16.401 70 HG2 GLN 10 1HG GLN 10 -12.087 16.931 -15.229 71 HG3 GLN 10 2HG GLN 10 -11.249 16.760 -13.688 72 HE21 GLN 10 2HE2 GLN 10 -9.076 18.094 -13.744 73 HE22 GLN 10 1HE2 GLN 10 -9.279 19.741 -14.223 74 H ILE 11 H ILE 11 -12.627 14.265 -13.951 75 HA ILE 11 HA ILE 11 -14.452 14.383 -16.261 76 HB ILE 11 HB ILE 11 -15.866 12.691 -15.236 77 HG12 ILE 11 1HG1 ILE 11 -13.702 12.456 -13.133 78 HG13 ILE 11 2HG1 ILE 11 -15.283 13.188 -12.880 79 HG21 ILE 11 1HG2 ILE 11 -12.983 11.877 -15.552 80 HG22 ILE 11 2HG2 ILE 11 -14.326 10.740 -15.449 81 HG23 ILE 11 3HG2 ILE 11 -14.239 11.882 -16.790 82 HD11 ILE 11 3HD1 ILE 11 -14.676 10.306 -13.474 83 HD12 ILE 11 1HD1 ILE 11 -15.334 10.988 -11.987 84 HD13 ILE 11 2HD1 ILE 11 -16.302 10.989 -13.462 85 H PHE 12 H PHE 12 -16.772 14.755 -15.534 86 HA PHE 12 HA PHE 12 -16.784 16.752 -13.368 87 HB2 PHE 12 1HB PHE 12 -18.407 16.639 -15.915 88 HB3 PHE 12 2HB PHE 12 -18.721 17.772 -14.605 89 HD1 PHE 12 HD2 PHE 12 -16.169 18.739 -13.796 90 HD2 PHE 12 HD1 PHE 12 -17.525 17.758 -17.709 91 HE1 PHE 12 HE2 PHE 12 -14.527 20.301 -14.753 92 HE2 PHE 12 HE1 PHE 12 -15.884 19.318 -18.673 93 HZ PHE 12 HZ PHE 12 -14.383 20.593 -17.194 94 H VAL 13 H VAL 13 -18.119 16.444 -11.702 95 HA VAL 13 HA VAL 13 -20.291 14.475 -11.991 96 HB VAL 13 HB VAL 13 -18.615 14.806 -9.502 97 HG11 VAL 13 1HG1 VAL 13 -20.035 13.409 -8.494 98 HG12 VAL 13 2HG1 VAL 13 -21.135 13.736 -9.834 99 HG13 VAL 13 3HG1 VAL 13 -20.080 12.323 -9.882 100 HG21 VAL 13 3HG2 VAL 13 -17.923 12.382 -10.267 101 HG22 VAL 13 1HG2 VAL 13 -18.297 13.024 -11.866 102 HG23 VAL 13 2HG2 VAL 13 -17.070 13.804 -10.868 103 H LYS 14 H LYS 14 -22.232 15.144 -11.325 104 HA LYS 14 HA LYS 14 -22.417 17.761 -10.029 105 HB2 LYS 14 1HB LYS 14 -24.201 16.138 -11.768 106 HB3 LYS 14 2HB LYS 14 -24.972 17.192 -10.590 107 HG2 LYS 14 1HG LYS 14 -24.856 18.563 -12.422 108 HG3 LYS 14 2HG LYS 14 -23.372 18.999 -11.572 109 HD2 LYS 14 1HD LYS 14 -22.024 17.949 -13.107 110 HD3 LYS 14 2HD LYS 14 -23.276 16.796 -13.576 111 HE2 LYS 14 1HE LYS 14 -23.275 19.735 -14.256 112 HE3 LYS 14 2HE LYS 14 -22.774 18.443 -15.346 113 HZ1 LYS 14 3HZ LYS 14 -25.412 19.333 -14.665 114 HZ2 LYS 14 1HZ LYS 14 -25.236 17.658 -14.510 115 HZ3 LYS 14 2HZ LYS 14 -24.891 18.411 -15.985 116 H THR 15 H THR 15 -23.357 18.087 -8.067 117 HA THR 15 HA THR 15 -23.849 15.693 -6.459 118 HB THR 15 HB THR 15 -23.720 17.191 -4.511 119 HG1 THR 15 HG1 THR 15 -24.500 19.091 -5.644 120 HG21 THR 15 3HG2 THR 15 -21.290 18.150 -5.313 121 HG22 THR 15 1HG2 THR 15 -21.560 16.841 -6.463 122 HG23 THR 15 2HG2 THR 15 -21.586 16.512 -4.730 123 H LEU 16 H LEU 16 -25.534 16.268 -4.586 124 HA LEU 16 HA LEU 16 -28.062 16.480 -5.915 125 HB2 LEU 16 1HB LEU 16 -29.029 16.064 -3.736 126 HB3 LEU 16 2HB LEU 16 -27.708 14.942 -4.051 127 HG LEU 16 HG LEU 16 -26.329 16.721 -2.668 128 HD11 LEU 16 1HD1 LEU 16 -29.176 17.324 -2.063 129 HD12 LEU 16 2HD1 LEU 16 -27.781 18.400 -2.138 130 HD13 LEU 16 3HD1 LEU 16 -28.011 17.351 -0.739 131 HD21 LEU 16 3HD2 LEU 16 -28.178 14.625 -1.544 132 HD22 LEU 16 1HD2 LEU 16 -26.906 15.417 -0.613 133 HD23 LEU 16 2HD2 LEU 16 -26.489 14.431 -2.016 134 H THR 17 H THR 17 -25.941 18.687 -4.412 135 HA THR 17 HA THR 17 -28.033 20.638 -3.848 136 HB THR 17 HB THR 17 -26.201 20.428 -2.232 137 HG1 THR 17 HG1 THR 17 -25.778 22.654 -2.096 138 HG21 THR 17 3HG2 THR 17 -24.504 21.140 -4.611 139 HG22 THR 17 1HG2 THR 17 -24.335 19.771 -3.513 140 HG23 THR 17 2HG2 THR 17 -23.953 21.401 -2.956 141 H GLY 18 H GLY 18 -27.051 19.678 -6.613 142 HA2 GLY 18 1HA GLY 18 -26.946 20.640 -8.698 143 HA3 GLY 18 2HA GLY 18 -27.426 22.152 -7.943 144 H LYS 19 H LYS 19 -24.669 20.807 -6.523 145 HA LYS 19 HA LYS 19 -23.005 22.841 -7.801 146 HB2 LYS 19 1HB LYS 19 -22.942 22.881 -5.406 147 HB3 LYS 19 2HB LYS 19 -22.628 21.153 -5.327 148 HG2 LYS 19 1HG LYS 19 -20.670 22.810 -6.801 149 HG3 LYS 19 2HG LYS 19 -20.718 22.979 -5.044 150 HD2 LYS 19 1HD LYS 19 -20.749 20.312 -5.211 151 HD3 LYS 19 2HD LYS 19 -19.900 20.672 -6.716 152 HE2 LYS 19 1HE LYS 19 -18.088 21.570 -5.638 153 HE3 LYS 19 2HE LYS 19 -19.031 22.059 -4.231 154 HZ1 LYS 19 3HZ LYS 19 -18.426 20.210 -3.205 155 HZ2 LYS 19 1HZ LYS 19 -17.467 19.776 -4.529 156 HZ3 LYS 19 2HZ LYS 19 -19.074 19.256 -4.442 157 H THR 20 H THR 20 -21.637 22.337 -9.371 158 HA THR 20 HA THR 20 -21.106 19.549 -9.986 159 HB THR 20 HB THR 20 -19.886 21.787 -11.546 160 HG1 THR 20 HG1 THR 20 -21.786 22.350 -12.429 161 HG21 THR 20 3HG2 THR 20 -20.631 18.971 -11.937 162 HG22 THR 20 1HG2 THR 20 -19.346 19.918 -12.686 163 HG23 THR 20 2HG2 THR 20 -20.996 20.030 -13.298 164 H ILE 21 H ILE 21 -19.401 18.519 -9.197 165 HA ILE 21 HA ILE 21 -17.033 20.092 -8.425 166 HB ILE 21 HB ILE 21 -17.961 18.986 -6.511 167 HG12 ILE 21 1HG1 ILE 21 -15.380 18.799 -7.217 168 HG13 ILE 21 2HG1 ILE 21 -16.000 18.138 -5.708 169 HG21 ILE 21 1HG2 ILE 21 -17.917 16.509 -8.220 170 HG22 ILE 21 2HG2 ILE 21 -18.144 16.481 -6.472 171 HG23 ILE 21 3HG2 ILE 21 -19.318 17.303 -7.500 172 HD11 ILE 21 3HD1 ILE 21 -15.897 16.466 -8.184 173 HD12 ILE 21 1HD1 ILE 21 -14.471 16.683 -7.169 174 HD13 ILE 21 2HD1 ILE 21 -15.932 15.960 -6.495 175 H THR 22 H THR 22 -15.102 19.657 -9.320 176 HA THR 22 HA THR 22 -15.019 17.777 -11.525 177 HB THR 22 HB THR 22 -12.918 19.700 -10.506 178 HG1 THR 22 HG1 THR 22 -13.556 20.854 -12.431 179 HG21 THR 22 3HG2 THR 22 -11.911 17.804 -11.681 180 HG22 THR 22 1HG2 THR 22 -11.779 19.281 -12.636 181 HG23 THR 22 2HG2 THR 22 -12.993 18.069 -13.048 182 H LEU 23 H LEU 23 -14.058 15.838 -11.521 183 HA LEU 23 HA LEU 23 -12.368 15.131 -9.213 184 HB2 LEU 23 1HB LEU 23 -14.812 14.128 -9.543 185 HB3 LEU 23 2HB LEU 23 -13.930 13.017 -10.589 186 HG LEU 23 HG LEU 23 -12.469 12.455 -8.650 187 HD11 LEU 23 1HD1 LEU 23 -13.749 13.058 -6.412 188 HD12 LEU 23 2HD1 LEU 23 -14.230 14.464 -7.361 189 HD13 LEU 23 3HD1 LEU 23 -12.521 14.119 -7.101 190 HD21 LEU 23 3HD2 LEU 23 -15.323 11.841 -8.930 191 HD22 LEU 23 1HD2 LEU 23 -14.644 11.487 -7.341 192 HD23 LEU 23 2HD2 LEU 23 -13.935 10.762 -8.785 193 H GLU 24 H GLU 24 -10.794 13.442 -9.611 194 HA GLU 24 HA GLU 24 -10.005 13.275 -12.446 195 HB2 GLU 24 1HB GLU 24 -8.346 13.722 -9.981 196 HB3 GLU 24 2HB GLU 24 -7.634 13.023 -11.428 197 HG2 GLU 24 1HG GLU 24 -7.193 15.158 -11.935 198 HG3 GLU 24 2HG GLU 24 -8.865 15.168 -12.492 199 H VAL 25 H VAL 25 -10.147 11.282 -13.208 200 HA VAL 25 HA VAL 25 -9.243 9.040 -11.571 201 HB VAL 25 HB VAL 25 -11.712 9.226 -11.240 202 HG11 VAL 25 1HG1 VAL 25 -13.244 8.992 -12.962 203 HG12 VAL 25 2HG1 VAL 25 -12.006 10.016 -13.691 204 HG13 VAL 25 3HG1 VAL 25 -12.057 8.292 -14.061 205 HG21 VAL 25 3HG2 VAL 25 -11.043 6.738 -12.787 206 HG22 VAL 25 1HG2 VAL 25 -10.357 7.068 -11.196 207 HG23 VAL 25 2HG2 VAL 25 -12.103 6.913 -11.388 208 H GLU 26 H GLU 26 -8.476 7.292 -12.745 209 HA GLU 26 HA GLU 26 -7.502 7.849 -15.341 210 HB2 GLU 26 1HB GLU 26 -7.687 5.097 -14.132 211 HB3 GLU 26 2HB GLU 26 -6.497 5.704 -15.275 212 HG2 GLU 26 1HG GLU 26 -5.724 7.273 -13.471 213 HG3 GLU 26 2HG GLU 26 -6.761 6.381 -12.360 214 HA PRO 27 HA PRO 27 -10.729 6.501 -17.994 215 HB2 PRO 27 1HB PRO 27 -9.308 5.485 -20.072 216 HB3 PRO 27 2HB PRO 27 -9.425 7.218 -19.744 217 HG2 PRO 27 1HG PRO 27 -7.226 5.304 -19.061 218 HG3 PRO 27 2HG PRO 27 -7.115 6.952 -19.706 219 HD2 PRO 27 1HD PRO 27 -6.733 6.384 -17.086 220 HD3 PRO 27 2HD PRO 27 -7.437 7.918 -17.639 221 H SER 28 H SER 28 -8.499 4.287 -16.647 222 HA SER 28 HA SER 28 -10.049 1.986 -17.623 223 HB2 SER 28 1HB SER 28 -7.561 1.984 -17.983 224 HB3 SER 28 2HB SER 28 -7.363 1.943 -16.231 225 HG SER 28 HG SER 28 -8.963 0.032 -17.544 226 H ASP 29 H ASP 29 -9.550 3.957 -14.922 227 HA ASP 29 HA ASP 29 -9.891 2.132 -12.808 228 HB2 ASP 29 1HB ASP 29 -10.040 5.053 -13.161 229 HB3 ASP 29 2HB ASP 29 -11.018 4.421 -11.840 230 H THR 30 H THR 30 -11.806 1.946 -11.409 231 HA THR 30 HA THR 30 -14.255 1.794 -13.034 232 HB THR 30 HB THR 30 -15.040 0.068 -11.515 233 HG1 THR 30 HG1 THR 30 -13.292 -0.688 -9.961 234 HG21 THR 30 3HG2 THR 30 -13.380 -0.415 -13.430 235 HG22 THR 30 1HG2 THR 30 -13.661 -1.677 -12.231 236 HG23 THR 30 2HG2 THR 30 -12.204 -0.687 -12.144 237 H ILE 31 H ILE 31 -16.300 1.865 -11.585 238 HA ILE 31 HA ILE 31 -16.647 4.429 -10.621 239 HB ILE 31 HB ILE 31 -18.198 1.998 -9.722 240 HG12 ILE 31 1HG1 ILE 31 -18.125 2.114 -12.158 241 HG13 ILE 31 2HG1 ILE 31 -19.730 2.550 -11.582 242 HG21 ILE 31 1HG2 ILE 31 -19.335 3.439 -8.473 243 HG22 ILE 31 2HG2 ILE 31 -18.410 4.796 -9.114 244 HG23 ILE 31 3HG2 ILE 31 -19.857 4.240 -9.955 245 HD11 ILE 31 3HD1 ILE 31 -19.615 4.445 -12.703 246 HD12 ILE 31 1HD1 ILE 31 -18.194 4.922 -11.774 247 HD13 ILE 31 2HD1 ILE 31 -18.003 4.012 -13.273 248 H GLU 32 H GLU 32 -15.436 1.604 -8.977 249 HA GLU 32 HA GLU 32 -15.766 2.482 -6.320 250 HB2 GLU 32 1HB GLU 32 -13.597 0.675 -7.398 251 HB3 GLU 32 2HB GLU 32 -14.140 0.781 -5.730 252 HG2 GLU 32 1HG GLU 32 -16.457 0.141 -6.764 253 HG3 GLU 32 2HG GLU 32 -15.460 -0.481 -8.078 254 H ASN 33 H ASN 33 -13.294 3.086 -8.731 255 HA ASN 33 HA ASN 33 -11.450 4.310 -6.912 256 HB2 ASN 33 1HB ASN 33 -11.614 3.882 -9.846 257 HB3 ASN 33 2HB ASN 33 -10.624 5.231 -9.299 258 HD21 ASN 33 2HD2 ASN 33 -8.857 4.800 -7.901 259 HD22 ASN 33 1HD2 ASN 33 -8.111 3.242 -7.882 260 H VAL 34 H VAL 34 -14.015 5.425 -9.033 261 HA VAL 34 HA VAL 34 -13.429 8.182 -8.940 262 HB VAL 34 HB VAL 34 -16.100 6.822 -9.325 263 HG11 VAL 34 1HG1 VAL 34 -16.416 9.133 -8.694 264 HG12 VAL 34 2HG1 VAL 34 -15.235 9.655 -9.897 265 HG13 VAL 34 3HG1 VAL 34 -16.762 8.938 -10.412 266 HG21 VAL 34 3HG2 VAL 34 -14.603 6.089 -11.022 267 HG22 VAL 34 1HG2 VAL 34 -15.629 7.329 -11.743 268 HG23 VAL 34 2HG2 VAL 34 -13.977 7.719 -11.265 269 H LYS 35 H LYS 35 -15.705 6.215 -7.036 270 HA LYS 35 HA LYS 35 -16.682 8.258 -5.404 271 HB2 LYS 35 1HB LYS 35 -17.275 6.434 -3.818 272 HB3 LYS 35 2HB LYS 35 -17.780 6.115 -5.472 273 HG2 LYS 35 1HG LYS 35 -16.199 4.456 -5.775 274 HG3 LYS 35 2HG LYS 35 -15.172 5.055 -4.471 275 HD2 LYS 35 1HD LYS 35 -17.920 4.030 -3.874 276 HD3 LYS 35 2HD LYS 35 -16.583 2.901 -4.108 277 HE2 LYS 35 1HE LYS 35 -15.457 4.681 -2.406 278 HE3 LYS 35 2HE LYS 35 -17.141 4.751 -1.888 279 HZ1 LYS 35 3HZ LYS 35 -15.221 2.751 -1.378 280 HZ2 LYS 35 1HZ LYS 35 -16.514 2.071 -2.232 281 HZ3 LYS 35 2HZ LYS 35 -16.796 2.885 -0.776 282 H ALA 36 H ALA 36 -13.689 6.496 -5.296 283 HA ALA 36 HA ALA 36 -12.915 6.869 -2.654 284 HB1 ALA 36 1HB ALA 36 -10.920 6.061 -3.307 285 HB2 ALA 36 2HB ALA 36 -11.762 5.747 -4.826 286 HB3 ALA 36 3HB ALA 36 -10.778 7.200 -4.646 287 H LYS 37 H LYS 37 -12.451 9.020 -5.444 288 HA LYS 37 HA LYS 37 -11.113 11.045 -3.951 289 HB2 LYS 37 1HB LYS 37 -12.516 11.191 -6.626 290 HB3 LYS 37 2HB LYS 37 -11.472 12.442 -5.963 291 HG2 LYS 37 1HG LYS 37 -10.631 9.634 -6.656 292 HG3 LYS 37 2HG LYS 37 -10.307 11.081 -7.613 293 HD2 LYS 37 1HD LYS 37 -9.342 10.583 -4.797 294 HD3 LYS 37 2HD LYS 37 -8.367 10.426 -6.260 295 HE2 LYS 37 1HE LYS 37 -9.654 12.945 -5.212 296 HE3 LYS 37 2HE LYS 37 -7.934 12.559 -5.195 297 HZ1 LYS 37 3HZ LYS 37 -7.892 13.666 -7.117 298 HZ2 LYS 37 1HZ LYS 37 -9.566 13.573 -7.338 299 HZ3 LYS 37 2HZ LYS 37 -8.579 12.280 -7.800 300 H ILE 38 H ILE 38 -14.446 10.329 -4.677 301 HA ILE 38 HA ILE 38 -15.558 12.851 -4.073 302 HB ILE 38 HB ILE 38 -16.819 10.119 -3.809 303 HG12 ILE 38 1HG1 ILE 38 -16.043 10.543 -6.078 304 HG13 ILE 38 2HG1 ILE 38 -17.800 10.638 -6.022 305 HG21 ILE 38 1HG2 ILE 38 -18.898 11.681 -4.285 306 HG22 ILE 38 2HG2 ILE 38 -18.306 11.400 -2.649 307 HG23 ILE 38 3HG2 ILE 38 -17.869 12.880 -3.503 308 HD11 ILE 38 3HD1 ILE 38 -17.405 13.177 -5.736 309 HD12 ILE 38 1HD1 ILE 38 -15.800 12.822 -6.374 310 HD13 ILE 38 2HD1 ILE 38 -17.233 12.445 -7.331 311 H GLN 39 H GLN 39 -14.531 10.176 -2.079 312 HA GLN 39 HA GLN 39 -15.887 10.692 0.280 313 HB2 GLN 39 1HB GLN 39 -13.162 9.557 -0.281 314 HB3 GLN 39 2HB GLN 39 -13.735 9.754 1.369 315 HG2 GLN 39 1HG GLN 39 -15.820 8.451 0.485 316 HG3 GLN 39 2HG GLN 39 -14.697 7.917 -0.765 317 HE21 GLN 39 2HE2 GLN 39 -14.726 5.793 -0.076 318 HE22 GLN 39 1HE2 GLN 39 -13.965 5.279 1.387 319 H ASP 40 H ASP 40 -13.061 12.276 -1.074 320 HA ASP 40 HA ASP 40 -12.525 13.832 1.281 321 HB2 ASP 40 1HB ASP 40 -10.833 13.154 -0.512 322 HB3 ASP 40 2HB ASP 40 -11.534 14.429 -1.504 323 H LYS 41 H LYS 41 -14.561 14.125 -1.483 324 HA LYS 41 HA LYS 41 -14.882 16.983 -1.299 325 HB2 LYS 41 1HB LYS 41 -16.701 15.074 -2.758 326 HB3 LYS 41 2HB LYS 41 -16.422 16.777 -3.096 327 HG2 LYS 41 1HG LYS 41 -14.352 14.614 -3.412 328 HG3 LYS 41 2HG LYS 41 -15.352 15.251 -4.719 329 HD2 LYS 41 1HD LYS 41 -14.185 17.187 -4.845 330 HD3 LYS 41 2HD LYS 41 -13.899 17.251 -3.104 331 HE2 LYS 41 1HE LYS 41 -11.820 16.566 -3.485 332 HE3 LYS 41 2HE LYS 41 -12.479 15.021 -4.023 333 HZ1 LYS 41 3HZ LYS 41 -11.020 16.004 -5.684 334 HZ2 LYS 41 1HZ LYS 41 -11.997 17.383 -5.758 335 HZ3 LYS 41 2HZ LYS 41 -12.603 15.889 -6.268 336 H GLU 42 H GLU 42 -16.942 14.159 -0.609 337 HA GLU 42 HA GLU 42 -18.484 15.866 1.233 338 HB2 GLU 42 1HB GLU 42 -19.453 13.668 -0.593 339 HB3 GLU 42 2HB GLU 42 -20.415 14.297 0.737 340 HG2 GLU 42 1HG GLU 42 -19.312 16.101 -1.384 341 HG3 GLU 42 2HG GLU 42 -20.829 15.231 -1.604 342 H GLY 43 H GLY 43 -17.116 12.694 0.587 343 HA2 GLY 43 1HA GLY 43 -16.344 11.105 2.073 344 HA3 GLY 43 2HA GLY 43 -16.749 12.202 3.385 345 H ILE 44 H ILE 44 -18.199 9.950 1.059 346 HA ILE 44 HA ILE 44 -20.211 9.293 3.109 347 HB ILE 44 HB ILE 44 -21.727 8.686 1.174 348 HG12 ILE 44 1HG1 ILE 44 -19.717 10.360 -0.347 349 HG13 ILE 44 2HG1 ILE 44 -20.016 8.641 -0.582 350 HG21 ILE 44 1HG2 ILE 44 -22.748 10.679 1.403 351 HG22 ILE 44 2HG2 ILE 44 -21.468 10.979 2.578 352 HG23 ILE 44 3HG2 ILE 44 -21.312 11.587 0.930 353 HD11 ILE 44 3HD1 ILE 44 -21.094 9.924 -2.312 354 HD12 ILE 44 1HD1 ILE 44 -22.309 9.161 -1.287 355 HD13 ILE 44 2HD1 ILE 44 -21.956 10.879 -1.106 356 HA PRO 45 HA PRO 45 -18.930 5.105 2.777 357 HB2 PRO 45 1HB PRO 45 -21.255 3.821 3.340 358 HB3 PRO 45 2HB PRO 45 -20.309 4.675 4.564 359 HG2 PRO 45 1HG PRO 45 -22.741 5.584 3.074 360 HG3 PRO 45 2HG PRO 45 -22.350 5.766 4.794 361 HD2 PRO 45 1HD PRO 45 -22.031 7.775 3.006 362 HD3 PRO 45 2HD PRO 45 -20.973 7.576 4.418 363 HA PRO 46 HA PRO 46 -19.872 3.376 -1.155 364 HB2 PRO 46 1HB PRO 46 -19.833 0.707 -0.660 365 HB3 PRO 46 2HB PRO 46 -18.372 1.701 -0.681 366 HG2 PRO 46 1HG PRO 46 -19.979 0.744 1.657 367 HG3 PRO 46 2HG PRO 46 -18.218 0.799 1.457 368 HD2 PRO 46 1HD PRO 46 -19.581 2.662 2.871 369 HD3 PRO 46 2HD PRO 46 -18.103 3.044 1.965 370 H ASP 47 H ASP 47 -21.775 2.030 1.515 371 HA ASP 47 HA ASP 47 -23.811 0.871 -0.041 372 HB2 ASP 47 1HB ASP 47 -24.065 2.006 2.752 373 HB3 ASP 47 2HB ASP 47 -25.115 0.804 2.006 374 H GLN 48 H GLN 48 -23.355 4.130 1.194 375 HA GLN 48 HA GLN 48 -25.956 4.973 0.195 376 HB2 GLN 48 1HB GLN 48 -23.773 6.502 1.621 377 HB3 GLN 48 2HB GLN 48 -25.324 7.182 1.150 378 HG2 GLN 48 1HG GLN 48 -26.497 5.879 2.693 379 HG3 GLN 48 2HG GLN 48 -25.144 4.772 2.918 380 HE21 GLN 48 2HE2 GLN 48 -25.667 5.248 5.201 381 HE22 GLN 48 1HE2 GLN 48 -24.912 6.616 5.937 382 H GLN 49 H GLN 49 -22.626 5.015 -0.728 383 HA GLN 49 HA GLN 49 -22.844 7.146 -2.629 384 HB2 GLN 49 1HB GLN 49 -20.691 6.607 -1.629 385 HB3 GLN 49 2HB GLN 49 -20.759 4.982 -2.300 386 HG2 GLN 49 1HG GLN 49 -19.746 5.692 -4.126 387 HG3 GLN 49 2HG GLN 49 -21.080 6.801 -4.440 388 HE21 GLN 49 2HE2 GLN 49 -19.781 8.404 -5.269 389 HE22 GLN 49 1HE2 GLN 49 -18.697 9.331 -4.294 390 H ARG 50 H ARG 50 -23.855 7.032 -4.511 391 HA ARG 50 HA ARG 50 -23.643 4.624 -6.133 392 HB2 ARG 50 1HB ARG 50 -26.225 5.722 -5.060 393 HB3 ARG 50 2HB ARG 50 -26.186 4.862 -6.593 394 HG2 ARG 50 1HG ARG 50 -24.794 3.193 -4.906 395 HG3 ARG 50 2HG ARG 50 -26.073 3.841 -3.878 396 HD2 ARG 50 1HD ARG 50 -27.044 3.105 -6.512 397 HD3 ARG 50 2HD ARG 50 -26.299 1.745 -5.673 398 HE ARG 50 HE ARG 50 -28.023 1.768 -4.147 399 HH11 ARG 50 1HH1 ARG 50 -28.158 4.624 -6.133 400 HH12 ARG 50 2HH1 ARG 50 -29.728 5.098 -5.574 401 HH21 ARG 50 1HH2 ARG 50 -30.091 2.381 -3.404 402 HH22 ARG 50 2HH2 ARG 50 -30.826 3.821 -4.021 403 H LEU 51 H LEU 51 -23.133 5.211 -8.129 404 HA LEU 51 HA LEU 51 -23.609 7.967 -8.970 405 HB2 LEU 51 1HB LEU 51 -21.691 5.846 -9.649 406 HB3 LEU 51 2HB LEU 51 -22.228 6.827 -11.011 407 HG LEU 51 HG LEU 51 -21.393 8.828 -9.966 408 HD11 LEU 51 1HD1 LEU 51 -21.901 8.349 -7.658 409 HD12 LEU 51 2HD1 LEU 51 -20.186 8.728 -7.818 410 HD13 LEU 51 3HD1 LEU 51 -20.705 7.053 -7.630 411 HD21 LEU 51 3HD2 LEU 51 -19.346 8.407 -10.722 412 HD22 LEU 51 1HD2 LEU 51 -19.815 6.712 -10.854 413 HD23 LEU 51 2HD2 LEU 51 -19.017 7.295 -9.393 414 H ILE 52 H ILE 52 -24.820 8.542 -10.728 415 HA ILE 52 HA ILE 52 -26.343 6.380 -12.032 416 HB ILE 52 HB ILE 52 -27.380 9.180 -11.651 417 HG12 ILE 52 1HG1 ILE 52 -26.986 8.288 -9.428 418 HG13 ILE 52 2HG1 ILE 52 -28.715 8.275 -9.761 419 HG21 ILE 52 1HG2 ILE 52 -29.567 7.998 -11.970 420 HG22 ILE 52 2HG2 ILE 52 -28.506 7.988 -13.378 421 HG23 ILE 52 3HG2 ILE 52 -28.650 6.547 -12.372 422 HD11 ILE 52 3HD1 ILE 52 -28.043 5.798 -10.579 423 HD12 ILE 52 1HD1 ILE 52 -26.859 6.051 -9.296 424 HD13 ILE 52 2HD1 ILE 52 -28.582 6.193 -8.947 425 H PHE 53 H PHE 53 -26.050 6.217 -14.148 426 HA PHE 53 HA PHE 53 -25.252 8.618 -15.654 427 HB2 PHE 53 1HB PHE 53 -23.377 6.944 -15.240 428 HB3 PHE 53 2HB PHE 53 -24.262 5.839 -16.286 429 HD1 PHE 53 HD2 PHE 53 -22.932 9.321 -16.262 430 HD2 PHE 53 HD1 PHE 53 -23.784 5.823 -18.534 431 HE1 PHE 53 HE2 PHE 53 -21.875 10.347 -18.233 432 HE2 PHE 53 HE1 PHE 53 -22.727 6.844 -20.508 433 HZ PHE 53 HZ PHE 53 -21.772 9.109 -20.359 434 H ALA 54 H ALA 54 -26.601 9.101 -17.247 435 HA ALA 54 HA ALA 54 -28.328 8.966 -18.729 436 HB1 ALA 54 1HB ALA 54 -26.445 7.531 -19.763 437 HB2 ALA 54 2HB ALA 54 -27.478 6.163 -19.346 438 HB3 ALA 54 3HB ALA 54 -28.072 7.416 -20.436 439 H GLY 55 H GLY 55 -29.190 8.491 -16.189 440 HA2 GLY 55 1HA GLY 55 -30.998 7.663 -15.043 441 HA3 GLY 55 2HA GLY 55 -31.628 7.148 -16.601 442 H LYS 56 H LYS 56 -28.537 5.939 -15.755 443 HA LYS 56 HA LYS 56 -29.730 3.403 -14.851 444 HB2 LYS 56 1HB LYS 56 -28.855 3.531 -17.304 445 HB3 LYS 56 2HB LYS 56 -27.264 3.455 -16.559 446 HG2 LYS 56 1HG LYS 56 -28.084 1.361 -15.379 447 HG3 LYS 56 2HG LYS 56 -29.450 1.400 -16.497 448 HD2 LYS 56 1HD LYS 56 -26.688 1.604 -17.597 449 HD3 LYS 56 2HD LYS 56 -27.273 0.029 -17.056 450 HE2 LYS 56 1HE LYS 56 -29.037 0.034 -18.611 451 HE3 LYS 56 2HE LYS 56 -28.862 1.760 -18.928 452 HZ1 LYS 56 3HZ LYS 56 -26.676 1.263 -19.924 453 HZ2 LYS 56 1HZ LYS 56 -27.957 0.532 -20.752 454 HZ3 LYS 56 2HZ LYS 56 -26.977 -0.390 -19.727 455 H GLN 57 H GLN 57 -28.938 2.698 -12.983 456 HA GLN 57 HA GLN 57 -26.982 4.095 -11.534 457 HB2 GLN 57 1HB GLN 57 -27.039 2.072 -10.016 458 HB3 GLN 57 2HB GLN 57 -28.588 2.853 -10.308 459 HG2 GLN 57 1HG GLN 57 -28.064 0.765 -12.237 460 HG3 GLN 57 2HG GLN 57 -28.002 0.163 -10.581 461 HE21 GLN 57 2HE2 GLN 57 -29.956 -0.189 -12.815 462 HE22 GLN 57 1HE2 GLN 57 -31.487 0.224 -12.129 463 H LEU 58 H LEU 58 -24.832 3.766 -11.184 464 HA LEU 58 HA LEU 58 -23.489 1.969 -13.061 465 HB2 LEU 58 1HB LEU 58 -22.301 4.118 -11.315 466 HB3 LEU 58 2HB LEU 58 -21.493 3.253 -12.621 467 HG LEU 58 HG LEU 58 -23.748 5.238 -12.906 468 HD11 LEU 58 1HD1 LEU 58 -22.218 6.792 -13.502 469 HD12 LEU 58 2HD1 LEU 58 -21.117 5.605 -14.200 470 HD13 LEU 58 3HD1 LEU 58 -21.180 5.828 -12.452 471 HD21 LEU 58 3HD2 LEU 58 -24.174 4.346 -14.890 472 HD22 LEU 58 1HD2 LEU 58 -22.949 3.107 -14.618 473 HD23 LEU 58 2HD2 LEU 58 -22.503 4.637 -15.374 474 H GLU 59 H GLU 59 -21.853 0.531 -12.401 475 HA GLU 59 HA GLU 59 -21.638 0.008 -9.526 476 HB2 GLU 59 1HB GLU 59 -21.966 -2.385 -9.851 477 HB3 GLU 59 2HB GLU 59 -23.383 -1.493 -10.387 478 HG2 GLU 59 1HG GLU 59 -22.959 -1.909 -12.626 479 HG3 GLU 59 2HG GLU 59 -21.260 -2.280 -12.337 480 H ASP 60 H ASP 60 -19.954 -1.879 -9.234 481 HA ASP 60 HA ASP 60 -17.512 -0.921 -10.384 482 HB2 ASP 60 1HB ASP 60 -16.405 -2.371 -8.889 483 HB3 ASP 60 2HB ASP 60 -17.849 -1.854 -8.021 484 H GLY 61 H GLY 61 -15.934 -3.062 -10.825 485 HA2 GLY 61 1HA GLY 61 -15.556 -4.924 -12.192 486 HA3 GLY 61 2HA GLY 61 -17.239 -4.867 -12.696 487 H ARG 62 H ARG 62 -17.542 -2.384 -13.707 488 HA ARG 62 HA ARG 62 -15.843 -2.507 -16.082 489 HB2 ARG 62 1HB ARG 62 -18.546 -1.396 -15.476 490 HB3 ARG 62 2HB ARG 62 -17.623 -0.674 -16.787 491 HG2 ARG 62 1HG ARG 62 -19.112 -2.369 -17.644 492 HG3 ARG 62 2HG ARG 62 -17.434 -2.874 -17.853 493 HD2 ARG 62 1HD ARG 62 -17.579 -4.359 -15.983 494 HD3 ARG 62 2HD ARG 62 -19.168 -3.733 -15.544 495 HE ARG 62 HE ARG 62 -18.607 -5.759 -17.455 496 HH11 ARG 62 1HH1 ARG 62 -20.752 -3.103 -16.776 497 HH12 ARG 62 2HH1 ARG 62 -22.067 -3.760 -17.693 498 HH21 ARG 62 1HH2 ARG 62 -20.331 -6.635 -18.665 499 HH22 ARG 62 2HH2 ARG 62 -21.827 -5.769 -18.767 500 H THR 63 H THR 63 -15.305 -0.340 -17.099 501 HA THR 63 HA THR 63 -14.275 1.449 -15.000 502 HB THR 63 HB THR 63 -12.424 0.584 -16.181 503 HG1 THR 63 HG1 THR 63 -11.956 2.580 -17.638 504 HG21 THR 63 3HG2 THR 63 -13.020 -0.438 -18.115 505 HG22 THR 63 1HG2 THR 63 -12.519 1.097 -18.822 506 HG23 THR 63 2HG2 THR 63 -14.227 0.784 -18.514 507 H LEU 64 H LEU 64 -14.164 3.746 -15.508 508 HA LEU 64 HA LEU 64 -16.584 4.844 -16.265 509 HB2 LEU 64 1HB LEU 64 -13.884 6.172 -16.449 510 HB3 LEU 64 2HB LEU 64 -15.444 6.986 -16.349 511 HG LEU 64 HG LEU 64 -14.839 7.191 -14.181 512 HD11 LEU 64 1HD1 LEU 64 -16.799 5.539 -14.403 513 HD12 LEU 64 2HD1 LEU 64 -16.001 5.692 -12.838 514 HD13 LEU 64 3HD1 LEU 64 -15.636 4.319 -13.882 515 HD21 LEU 64 3HD2 LEU 64 -12.780 6.455 -13.746 516 HD22 LEU 64 1HD2 LEU 64 -12.926 5.127 -14.898 517 HD23 LEU 64 2HD2 LEU 64 -13.536 4.938 -13.253 518 H SER 65 H SER 65 -13.743 4.154 -18.222 519 HA SER 65 HA SER 65 -14.581 5.531 -20.547 520 HB2 SER 65 1HB SER 65 -12.272 4.962 -20.378 521 HB3 SER 65 2HB SER 65 -12.640 3.258 -20.113 522 HG SER 65 HG SER 65 -13.060 2.999 -22.210 523 H GLU 66 H GLU 66 -15.148 2.284 -19.335 524 HA GLU 66 HA GLU 66 -16.351 1.315 -21.743 525 HB2 GLU 66 1HB GLU 66 -16.166 0.297 -18.925 526 HB3 GLU 66 2HB GLU 66 -17.216 -0.494 -20.092 527 HG2 GLU 66 1HG GLU 66 -14.336 0.004 -20.721 528 HG3 GLU 66 2HG GLU 66 -14.827 -1.384 -19.751 529 H TYR 67 H TYR 67 -17.419 3.207 -19.095 530 HA TYR 67 HA TYR 67 -20.233 2.603 -19.542 531 HB2 TYR 67 1HB TYR 67 -18.707 4.181 -17.505 532 HB3 TYR 67 2HB TYR 67 -20.423 4.498 -17.733 533 HD1 TYR 67 HD1 TYR 67 -21.803 2.120 -17.942 534 HD2 TYR 67 HD2 TYR 67 -18.228 2.797 -15.735 535 HE1 TYR 67 HE1 TYR 67 -22.352 0.220 -16.481 536 HE2 TYR 67 HE2 TYR 67 -18.767 0.897 -14.269 537 HH TYR 67 HH TYR 67 -21.844 -0.644 -14.314 538 H ASN 68 H ASN 68 -18.242 4.176 -21.356 539 HA ASN 68 HA ASN 68 -18.420 5.830 -22.908 540 HB2 ASN 68 1HB ASN 68 -20.847 4.849 -22.907 541 HB3 ASN 68 2HB ASN 68 -21.259 6.357 -22.095 542 HD21 ASN 68 2HD2 ASN 68 -22.534 6.990 -23.845 543 HD22 ASN 68 1HD2 ASN 68 -21.836 7.560 -25.319 544 H ILE 69 H ILE 69 -17.783 6.360 -20.050 545 HA ILE 69 HA ILE 69 -18.712 9.110 -19.712 546 HB ILE 69 HB ILE 69 -16.953 7.502 -17.860 547 HG12 ILE 69 1HG1 ILE 69 -19.943 7.940 -17.709 548 HG13 ILE 69 2HG1 ILE 69 -19.177 6.444 -18.230 549 HG21 ILE 69 1HG2 ILE 69 -18.664 9.878 -17.188 550 HG22 ILE 69 2HG2 ILE 69 -17.365 9.155 -16.240 551 HG23 ILE 69 3HG2 ILE 69 -16.990 10.040 -17.718 552 HD11 ILE 69 3HD1 ILE 69 -19.980 6.977 -15.702 553 HD12 ILE 69 1HD1 ILE 69 -18.737 5.803 -16.136 554 HD13 ILE 69 2HD1 ILE 69 -18.277 7.428 -15.626 555 H GLN 70 H GLN 70 -17.591 10.579 -20.820 556 HA GLN 70 HA GLN 70 -14.754 10.207 -21.324 557 HB2 GLN 70 1HB GLN 70 -16.505 12.520 -22.157 558 HB3 GLN 70 2HB GLN 70 -14.933 12.086 -22.813 559 HG2 GLN 70 1HG GLN 70 -17.556 10.683 -23.171 560 HG3 GLN 70 2HG GLN 70 -16.499 11.373 -24.400 561 HE21 GLN 70 2HE2 GLN 70 -14.277 10.364 -24.473 562 HE22 GLN 70 1HE2 GLN 70 -14.204 8.644 -24.335 563 H LYS 71 H LYS 71 -13.762 12.731 -21.362 564 HA LYS 71 HA LYS 71 -13.280 13.220 -18.589 565 HB2 LYS 71 1HB LYS 71 -11.789 14.994 -19.369 566 HB3 LYS 71 2HB LYS 71 -11.520 13.508 -20.270 567 HG2 LYS 71 1HG LYS 71 -13.474 15.262 -21.526 568 HG3 LYS 71 2HG LYS 71 -11.882 16.003 -21.346 569 HD2 LYS 71 1HD LYS 71 -11.115 13.621 -22.259 570 HD3 LYS 71 2HD LYS 71 -12.728 13.671 -22.975 571 HE2 LYS 71 1HE LYS 71 -12.233 15.686 -24.141 572 HE3 LYS 71 2HE LYS 71 -10.728 15.905 -23.249 573 HZ1 LYS 71 3HZ LYS 71 -9.783 14.909 -24.986 574 HZ2 LYS 71 1HZ LYS 71 -11.253 14.326 -25.587 575 HZ3 LYS 71 2HZ LYS 71 -10.429 13.465 -24.387 576 H GLU 72 H GLU 72 -15.538 14.401 -20.874 577 HA GLU 72 HA GLU 72 -16.246 16.619 -19.067 578 HB2 GLU 72 1HB GLU 72 -16.518 16.342 -22.053 579 HB3 GLU 72 2HB GLU 72 -17.444 17.527 -21.145 580 HG2 GLU 72 1HG GLU 72 -15.604 18.798 -20.651 581 HG3 GLU 72 2HG GLU 72 -14.492 17.438 -20.795 582 H SER 73 H SER 73 -17.051 13.739 -19.019 583 HA SER 73 HA SER 73 -19.754 13.546 -19.866 584 HB2 SER 73 1HB SER 73 -17.952 11.707 -19.137 585 HB3 SER 73 2HB SER 73 -18.799 11.868 -17.599 586 HG SER 73 HG SER 73 -19.914 10.341 -18.690 587 H THR 74 H THR 74 -21.311 12.689 -17.913 588 HA THR 74 HA THR 74 -21.275 14.742 -15.809 589 HB THR 74 HB THR 74 -23.936 13.970 -16.867 590 HG1 THR 74 HG1 THR 74 -22.051 15.536 -18.295 591 HG21 THR 74 3HG2 THR 74 -23.874 16.677 -16.611 592 HG22 THR 74 1HG2 THR 74 -22.659 16.193 -15.429 593 HG23 THR 74 2HG2 THR 74 -24.302 15.562 -15.314 594 H LEU 75 H LEU 75 -21.153 13.705 -13.934 595 HA LEU 75 HA LEU 75 -22.472 11.096 -13.658 596 HB2 LEU 75 1HB LEU 75 -20.037 12.310 -12.553 597 HB3 LEU 75 2HB LEU 75 -20.994 11.387 -11.396 598 HG LEU 75 HG LEU 75 -19.251 10.001 -12.337 599 HD11 LEU 75 1HD1 LEU 75 -20.543 8.159 -12.586 600 HD12 LEU 75 2HD1 LEU 75 -21.616 8.930 -13.754 601 HD13 LEU 75 3HD1 LEU 75 -21.799 9.268 -12.033 602 HD21 LEU 75 3HD2 LEU 75 -20.470 10.756 -14.987 603 HD22 LEU 75 1HD2 LEU 75 -19.335 9.425 -14.769 604 HD23 LEU 75 2HD2 LEU 75 -18.830 11.079 -14.424 605 H HIS 76 H HIS 76 -23.682 10.624 -11.753 606 HA HIS 76 HA HIS 76 -24.622 12.974 -10.259 607 HB2 HIS 76 1HB HIS 76 -26.305 10.865 -11.607 608 HB3 HIS 76 2HB HIS 76 -26.930 11.894 -10.323 609 HD1 HIS 76 HD1 HIS 76 -28.049 13.941 -11.125 610 HD2 HIS 76 HD2 HIS 76 -25.225 12.564 -13.844 611 HE1 HIS 76 HE1 HIS 76 -28.212 15.485 -13.104 612 H LEU 77 H LEU 77 -24.261 12.679 -8.170 613 HA LEU 77 HA LEU 77 -24.014 9.959 -7.124 614 HB2 LEU 77 1HB LEU 77 -23.110 11.123 -5.101 615 HB3 LEU 77 2HB LEU 77 -22.167 11.331 -6.576 616 HG LEU 77 HG LEU 77 -24.000 13.502 -6.366 617 HD11 LEU 77 1HD1 LEU 77 -23.876 12.758 -3.909 618 HD12 LEU 77 2HD1 LEU 77 -23.572 14.453 -4.288 619 HD13 LEU 77 3HD1 LEU 77 -22.222 13.368 -3.959 620 HD21 LEU 77 3HD2 LEU 77 -21.013 13.448 -5.966 621 HD22 LEU 77 1HD2 LEU 77 -21.998 14.818 -6.481 622 HD23 LEU 77 2HD2 LEU 77 -21.809 13.420 -7.540 623 H VAL 78 H VAL 78 -25.753 9.061 -6.257 624 HA VAL 78 HA VAL 78 -27.705 10.794 -4.888 625 HB VAL 78 HB VAL 78 -29.312 8.860 -5.288 626 HG11 VAL 78 1HG1 VAL 78 -28.262 10.314 -7.714 627 HG12 VAL 78 2HG1 VAL 78 -29.874 9.621 -7.520 628 HG13 VAL 78 3HG1 VAL 78 -29.374 10.989 -6.524 629 HG21 VAL 78 3HG2 VAL 78 -28.827 7.248 -6.941 630 HG22 VAL 78 1HG2 VAL 78 -27.364 8.094 -7.447 631 HG23 VAL 78 2HG2 VAL 78 -27.415 7.279 -5.884 632 H LEU 79 H LEU 79 -28.171 10.409 -2.803 633 HA LEU 79 HA LEU 79 -26.772 8.192 -1.495 634 HB2 LEU 79 1HB LEU 79 -28.040 10.680 -0.361 635 HB3 LEU 79 2HB LEU 79 -27.243 9.433 0.595 636 HG LEU 79 HG LEU 79 -25.919 11.208 -1.456 637 HD11 LEU 79 1HD1 LEU 79 -25.739 12.689 0.182 638 HD12 LEU 79 2HD1 LEU 79 -24.799 11.513 1.102 639 HD13 LEU 79 3HD1 LEU 79 -26.548 11.600 1.309 640 HD21 LEU 79 3HD2 LEU 79 -24.987 8.863 0.133 641 HD22 LEU 79 1HD2 LEU 79 -23.864 10.181 -0.201 642 HD23 LEU 79 2HD2 LEU 79 -24.625 9.312 -1.535 643 H ARG 80 H ARG 80 -27.810 6.625 -0.357 644 HA ARG 80 HA ARG 80 -30.709 6.483 -0.703 645 HB2 ARG 80 1HB ARG 80 -29.333 4.569 -1.440 646 HB3 ARG 80 2HB ARG 80 -28.757 4.362 0.208 647 HG2 ARG 80 1HG ARG 80 -30.869 3.668 0.972 648 HG3 ARG 80 2HG ARG 80 -31.671 4.235 -0.495 649 HD2 ARG 80 1HD ARG 80 -31.531 2.112 -1.183 650 HD3 ARG 80 2HD ARG 80 -29.828 2.463 -1.477 651 HE ARG 80 HE ARG 80 -30.073 1.700 1.186 652 HH11 ARG 80 1HH1 ARG 80 -30.526 0.315 -1.975 653 HH12 ARG 80 2HH1 ARG 80 -30.152 -1.298 -1.465 654 HH21 ARG 80 1HH2 ARG 80 -29.579 -0.419 1.870 655 HH22 ARG 80 2HH2 ARG 80 -29.614 -1.714 0.723 656 H LEU 81 H LEU 81 -28.252 6.158 1.840 657 HA LEU 81 HA LEU 81 -30.381 6.558 3.837 658 HB2 LEU 81 1HB LEU 81 -28.003 4.825 3.759 659 HB3 LEU 81 2HB LEU 81 -28.290 5.645 5.292 660 HG LEU 81 HG LEU 81 -29.232 3.379 5.248 661 HD11 LEU 81 1HD1 LEU 81 -31.299 5.571 5.333 662 HD12 LEU 81 2HD1 LEU 81 -30.256 5.071 6.663 663 HD13 LEU 81 3HD1 LEU 81 -31.473 3.962 6.032 664 HD21 LEU 81 3HD2 LEU 81 -30.880 2.683 3.762 665 HD22 LEU 81 1HD2 LEU 81 -29.753 3.565 2.732 666 HD23 LEU 81 2HD2 LEU 81 -31.255 4.330 3.252 667 H ARG 82 H ARG 82 -29.276 7.436 5.984 668 HA ARG 82 HA ARG 82 -28.277 10.046 5.287 669 HB2 ARG 82 1HB ARG 82 -29.945 9.539 7.139 670 HB3 ARG 82 2HB ARG 82 -28.587 8.910 8.063 671 HG2 ARG 82 1HG ARG 82 -28.888 11.111 8.807 672 HG3 ARG 82 2HG ARG 82 -27.495 11.172 7.725 673 HD2 ARG 82 1HD ARG 82 -29.024 13.044 7.337 674 HD3 ARG 82 2HD ARG 82 -28.908 11.994 5.925 675 HE ARG 82 HE ARG 82 -31.136 11.560 6.132 676 HH11 ARG 82 1HH1 ARG 82 -29.950 12.770 9.173 677 HH12 ARG 82 2HH1 ARG 82 -31.518 12.839 9.906 678 HH21 ARG 82 1HH2 ARG 82 -33.206 11.647 7.086 679 HH22 ARG 82 2HH2 ARG 82 -33.370 12.200 8.719 680 H GLY 83 H GLY 83 -26.223 10.711 5.290 681 HA2 GLY 83 1HA GLY 83 -24.158 8.794 6.059 682 HA3 GLY 83 2HA GLY 83 -23.918 10.259 5.118 683 H TYR 84 H TYR 84 -25.174 9.470 8.364 684 HA TYR 84 HA TYR 84 -23.692 11.766 9.418 685 HB2 TYR 84 1HB TYR 84 -26.221 11.238 9.862 686 HB3 TYR 84 2HB TYR 84 -25.581 10.117 11.059 687 HD1 TYR 84 HD2 TYR 84 -23.489 11.367 12.418 688 HD2 TYR 84 HD1 TYR 84 -26.960 13.208 10.786 689 HE1 TYR 84 HE2 TYR 84 -23.260 13.212 14.028 690 HE2 TYR 84 HE1 TYR 84 -26.740 15.059 12.391 691 HH TYR 84 HH TYR 84 -24.763 14.925 15.092 692 H ALA 85 H ALA 85 -21.671 10.522 9.135 693 HA ALA 85 HA ALA 85 -20.765 9.487 11.593 694 HB1 ALA 85 1HB ALA 85 -21.407 7.361 11.454 695 HB2 ALA 85 2HB ALA 85 -21.926 7.551 9.779 696 HB3 ALA 85 3HB ALA 85 -20.239 7.184 10.144 697 H ASP 86 H ASP 86 -18.659 9.913 11.684 698 HA ASP 86 HA ASP 86 -17.245 10.561 9.226 699 HB2 ASP 86 1HB ASP 86 -17.160 12.055 11.239 700 HB3 ASP 86 2HB ASP 86 -16.265 10.791 12.077 701 H LEU 87 H LEU 87 -14.989 9.814 8.944 702 HA LEU 87 HA LEU 87 -14.769 6.980 9.691 703 HB2 LEU 87 1HB LEU 87 -13.405 8.459 7.447 704 HB3 LEU 87 2HB LEU 87 -13.325 6.726 7.757 705 HG LEU 87 HG LEU 87 -15.857 8.193 7.029 706 HD11 LEU 87 1HD1 LEU 87 -14.971 8.336 4.984 707 HD12 LEU 87 2HD1 LEU 87 -15.210 6.591 4.906 708 HD13 LEU 87 3HD1 LEU 87 -13.643 7.245 5.381 709 HD21 LEU 87 3HD2 LEU 87 -15.755 5.883 8.289 710 HD22 LEU 87 1HD2 LEU 87 -15.411 5.273 6.670 711 HD23 LEU 87 2HD2 LEU 87 -16.904 6.160 6.980 712 H ARG 88 H ARG 88 -12.265 6.324 9.485 713 HA ARG 88 HA ARG 88 -10.431 8.241 10.570 714 HB2 ARG 88 1HB ARG 88 -11.869 7.533 12.543 715 HB3 ARG 88 2HB ARG 88 -11.162 5.933 12.368 716 HG2 ARG 88 1HG ARG 88 -9.802 6.835 13.967 717 HG3 ARG 88 2HG ARG 88 -8.904 7.245 12.504 718 HD2 ARG 88 1HD ARG 88 -9.495 9.475 12.608 719 HD3 ARG 88 2HD ARG 88 -10.933 9.154 13.576 720 HE ARG 88 HE ARG 88 -8.515 8.525 14.964 721 HH11 ARG 88 1HH1 ARG 88 -10.667 11.112 14.075 722 HH12 ARG 88 2HH1 ARG 88 -10.221 12.118 15.414 723 HH21 ARG 88 1HH2 ARG 88 -7.919 9.839 16.730 724 HH22 ARG 88 2HH2 ARG 88 -8.658 11.393 16.923 725 H GLU 89 H GLU 89 -8.300 7.546 10.478 726 HA GLU 89 HA GLU 89 -7.807 4.786 9.629 727 HB2 GLU 89 1HB GLU 89 -6.930 7.265 8.147 728 HB3 GLU 89 2HB GLU 89 -6.201 5.685 7.892 729 HG2 GLU 89 1HG GLU 89 -9.153 5.939 7.666 730 HG3 GLU 89 2HG GLU 89 -8.144 6.563 6.362 731 H ASP 90 H ASP 90 -5.232 4.632 9.307 732 HA ASP 90 HA ASP 90 -3.685 6.204 11.129 733 HB2 ASP 90 1HB ASP 90 -4.782 3.574 11.988 734 HB3 ASP 90 2HB ASP 90 -3.112 3.934 12.415 735 HA PRO 91 HA PRO 91 -1.454 3.993 7.685 736 HB2 PRO 91 1HB PRO 91 -0.346 6.235 6.628 737 HB3 PRO 91 2HB PRO 91 -1.946 5.644 6.165 738 HG2 PRO 91 1HG PRO 91 -1.214 7.816 8.090 739 HG3 PRO 91 2HG PRO 91 -2.495 7.793 6.863 740 HD2 PRO 91 1HD PRO 91 -2.983 7.341 9.488 741 HD3 PRO 91 2HD PRO 91 -3.921 6.566 8.195 742 H ASP 92 H ASP 92 0.221 3.019 8.663 743 HA ASP 92 HA ASP 92 2.344 4.730 9.780 744 HB2 ASP 92 1HB ASP 92 1.474 2.009 10.779 745 HB3 ASP 92 2HB ASP 92 2.830 2.941 11.406 746 H ARG 93 H ARG 93 1.685 1.474 8.490 747 HA ARG 93 HA ARG 93 4.293 0.716 7.944 748 HB2 ARG 93 1HB ARG 93 1.746 0.046 6.463 749 HB3 ARG 93 2HB ARG 93 3.284 -0.759 6.182 750 HG2 ARG 93 1HG ARG 93 1.927 -0.678 8.864 751 HG3 ARG 93 2HG ARG 93 1.688 -1.970 7.685 752 HD2 ARG 93 1HD ARG 93 4.370 -1.150 8.790 753 HD3 ARG 93 2HD ARG 93 3.397 -2.474 9.431 754 HE ARG 93 HE ARG 93 3.663 -3.003 6.752 755 HH11 ARG 93 1HH1 ARG 93 5.828 -2.507 9.433 756 HH12 ARG 93 2HH1 ARG 93 7.066 -3.537 8.793 757 HH21 ARG 93 1HH2 ARG 93 5.285 -4.362 5.899 758 HH22 ARG 93 2HH2 ARG 93 6.756 -4.591 6.783 759 H GLN 94 H GLN 94 5.727 1.072 6.323 760 HA GLN 94 HA GLN 94 4.905 2.592 3.976 761 HB2 GLN 94 1HB GLN 94 6.701 4.236 4.253 762 HB3 GLN 94 2HB GLN 94 5.557 4.311 5.586 763 HG2 GLN 94 1HG GLN 94 8.031 2.665 5.844 764 HG3 GLN 94 2HG GLN 94 8.107 4.414 6.049 765 HE21 GLN 94 2HE2 GLN 94 6.724 5.365 7.680 766 HE22 GLN 94 1HE2 GLN 94 6.327 4.451 9.092 767 H ASP 95 H ASP 95 6.560 2.634 2.293 768 HA ASP 95 HA ASP 95 8.328 0.286 2.478 769 HB2 ASP 95 1HB ASP 95 6.720 1.438 0.231 770 HB3 ASP 95 2HB ASP 95 8.191 0.542 -0.138 771 H HIS 96 H HIS 96 10.121 0.521 0.641 772 HA HIS 96 HA HIS 96 11.175 3.180 0.342 773 HB2 HIS 96 1HB HIS 96 13.244 2.817 1.581 774 HB3 HIS 96 2HB HIS 96 11.858 2.657 2.656 775 HD1 HIS 96 HD1 HIS 96 14.627 0.693 1.099 776 HD2 HIS 96 HD2 HIS 96 11.446 0.092 3.704 777 HE1 HIS 96 HE1 HIS 96 15.015 -1.571 2.123 778 H HIS 97 H HIS 97 13.112 3.233 -0.977 779 HA HIS 97 HA HIS 97 13.288 0.868 -2.711 780 HB2 HIS 97 1HB HIS 97 13.586 3.798 -3.169 781 HB3 HIS 97 2HB HIS 97 14.533 2.708 -4.177 782 HD1 HIS 97 HD1 HIS 97 13.392 2.001 -6.247 783 HD2 HIS 97 HD2 HIS 97 10.682 3.011 -3.264 784 HE1 HIS 97 HE1 HIS 97 11.120 1.779 -7.300 785 HA PRO 98 HA PRO 98 17.459 0.019 -1.655 786 HB2 PRO 98 1HB PRO 98 18.555 -0.625 -4.054 787 HB3 PRO 98 2HB PRO 98 17.410 -1.673 -3.208 788 HG2 PRO 98 1HG PRO 98 16.922 0.233 -5.464 789 HG3 PRO 98 2HG PRO 98 16.299 -1.411 -5.234 790 HD2 PRO 98 1HD PRO 98 14.823 0.795 -4.697 791 HD3 PRO 98 2HD PRO 98 14.648 -0.717 -3.783 792 H GLY 99 H GLY 99 19.823 0.408 -2.745 793 HA2 GLY 99 1HA GLY 99 19.977 3.229 -3.573 794 HA3 GLY 99 2HA GLY 99 20.911 2.676 -2.191 795 H SER 100 H SER 100 20.406 0.606 -4.940 796 HA SER 100 HA SER 100 23.258 0.901 -5.609 797 HB2 SER 100 1HB SER 100 22.862 -1.430 -6.676 798 HB3 SER 100 2HB SER 100 22.969 -1.321 -4.919 799 HG SER 100 HG SER 100 20.957 -1.918 -4.769 800 H GLY 101 H GLY 101 23.788 0.377 -7.927 801 HA2 GLY 101 1HA GLY 101 22.344 0.245 -10.129 802 HA3 GLY 101 2HA GLY 101 21.957 1.887 -9.634 803 H ALA 102 H ALA 102 24.988 0.016 -9.621 804 HA ALA 102 HA ALA 102 26.124 1.901 -11.548 805 HB1 ALA 102 1HB ALA 102 26.842 1.727 -8.718 806 HB2 ALA 102 2HB ALA 102 28.217 1.625 -9.818 807 HB3 ALA 102 3HB ALA 102 27.134 3.015 -9.888 808 H GLN 103 H GLN 103 28.193 1.157 -12.441 809 HA GLN 103 HA GLN 103 28.559 -1.754 -12.219 810 HB2 GLN 103 1HB GLN 103 28.753 -2.000 -14.571 811 HB3 GLN 103 2HB GLN 103 27.295 -1.055 -14.296 812 HG2 GLN 103 1HG GLN 103 28.208 0.154 -15.981 813 HG3 GLN 103 2HG GLN 103 28.965 0.962 -14.609 814 HE21 GLN 103 2HE2 GLN 103 29.469 -1.645 -16.942 815 HE22 GLN 103 1HE2 GLN 103 31.183 -1.458 -17.047 Start of MODEL 3 1 H1 GLY 1 H GLY 1 8.453 10.573 -1.927 2 HA2 GLY 1 1HA GLY 1 9.220 11.832 -3.777 3 HA3 GLY 1 2HA GLY 1 8.517 10.406 -4.526 4 H SER 2 H SER 2 8.174 11.737 -6.404 5 HA SER 2 HA SER 2 5.953 13.647 -6.118 6 HB2 SER 2 1HB SER 2 8.073 13.388 -8.260 7 HB3 SER 2 2HB SER 2 6.692 14.478 -8.376 8 HG SER 2 HG SER 2 9.010 14.827 -7.071 9 H LEU 3 H LEU 3 4.323 13.667 -7.808 10 HA LEU 3 HA LEU 3 3.961 11.036 -9.082 11 HB2 LEU 3 1HB LEU 3 2.109 12.662 -7.427 12 HB3 LEU 3 2HB LEU 3 1.427 11.777 -8.790 13 HG LEU 3 HG LEU 3 1.211 10.547 -6.681 14 HD11 LEU 3 1HD1 LEU 3 1.639 9.475 -8.990 15 HD12 LEU 3 2HD1 LEU 3 1.768 8.471 -7.546 16 HD13 LEU 3 3HD1 LEU 3 3.226 9.076 -8.332 17 HD21 LEU 3 3HD2 LEU 3 3.607 11.538 -5.996 18 HD22 LEU 3 1HD2 LEU 3 4.101 9.945 -6.569 19 HD23 LEU 3 2HD2 LEU 3 2.917 10.086 -5.270 20 H VAL 4 H VAL 4 3.373 11.022 -11.184 21 HA VAL 4 HA VAL 4 2.907 13.638 -12.460 22 HB VAL 4 HB VAL 4 3.727 12.430 -14.566 23 HG11 VAL 4 1HG1 VAL 4 5.029 14.155 -13.501 24 HG12 VAL 4 2HG1 VAL 4 5.617 13.015 -12.290 25 HG13 VAL 4 3HG1 VAL 4 6.099 12.836 -13.977 26 HG21 VAL 4 3HG2 VAL 4 3.573 10.164 -13.430 27 HG22 VAL 4 1HG2 VAL 4 5.049 10.489 -14.340 28 HG23 VAL 4 2HG2 VAL 4 5.054 10.602 -12.580 29 HA PRO 5 HA PRO 5 -0.993 12.290 -13.959 30 HB2 PRO 5 1HB PRO 5 -1.093 13.511 -16.381 31 HB3 PRO 5 2HB PRO 5 -1.246 14.390 -14.855 32 HG2 PRO 5 1HG PRO 5 1.148 14.068 -16.623 33 HG3 PRO 5 2HG PRO 5 0.557 15.520 -15.793 34 HD2 PRO 5 1HD PRO 5 2.610 14.033 -14.842 35 HD3 PRO 5 2HD PRO 5 1.484 14.898 -13.777 36 H ARG 6 H ARG 6 -1.021 10.124 -14.342 37 HA ARG 6 HA ARG 6 -0.256 9.257 -17.045 38 HB2 ARG 6 1HB ARG 6 1.300 8.574 -15.021 39 HB3 ARG 6 2HB ARG 6 0.053 7.362 -14.757 40 HG2 ARG 6 1HG ARG 6 1.450 6.184 -16.105 41 HG3 ARG 6 2HG ARG 6 0.422 6.927 -17.333 42 HD2 ARG 6 1HD ARG 6 2.528 7.366 -18.161 43 HD3 ARG 6 2HD ARG 6 2.186 8.841 -17.257 44 HE ARG 6 HE ARG 6 3.525 6.911 -15.650 45 HH11 ARG 6 1HH1 ARG 6 4.020 9.298 -18.135 46 HH12 ARG 6 2HH1 ARG 6 5.672 9.594 -17.704 47 HH21 ARG 6 1HH2 ARG 6 5.699 7.292 -15.072 48 HH22 ARG 6 2HH2 ARG 6 6.626 8.452 -15.962 49 H GLY 7 H GLY 7 -2.208 8.955 -17.954 50 HA2 GLY 7 1HA GLY 7 -4.263 8.022 -18.372 51 HA3 GLY 7 2HA GLY 7 -3.789 6.737 -17.271 52 H SER 8 H SER 8 -4.794 10.156 -17.116 53 HA SER 8 HA SER 8 -6.939 9.478 -15.305 54 HB2 SER 8 1HB SER 8 -4.737 11.328 -14.359 55 HB3 SER 8 2HB SER 8 -6.201 10.901 -13.473 56 HG SER 8 HG SER 8 -5.078 9.301 -12.725 57 H MET 9 H MET 9 -8.616 10.652 -15.929 58 HA MET 9 HA MET 9 -8.122 13.347 -17.012 59 HB2 MET 9 1HB MET 9 -10.010 13.037 -18.514 60 HB3 MET 9 2HB MET 9 -8.823 11.765 -18.765 61 HG2 MET 9 1HG MET 9 -10.953 11.147 -16.835 62 HG3 MET 9 2HG MET 9 -11.469 11.346 -18.508 63 HE1 MET 9 3HE MET 9 -11.996 8.124 -17.825 64 HE2 MET 9 1HE MET 9 -12.314 9.397 -19.004 65 HE3 MET 9 2HE MET 9 -11.429 7.950 -19.487 66 H GLN 10 H GLN 10 -9.841 14.900 -16.696 67 HA GLN 10 HA GLN 10 -11.165 14.499 -14.123 68 HB2 GLN 10 1HB GLN 10 -11.351 16.862 -13.979 69 HB3 GLN 10 2HB GLN 10 -9.737 16.531 -14.596 70 HG2 GLN 10 1HG GLN 10 -11.021 16.801 -16.917 71 HG3 GLN 10 2HG GLN 10 -12.047 17.820 -15.909 72 HE21 GLN 10 2HE2 GLN 10 -11.514 19.823 -16.472 73 HE22 GLN 10 1HE2 GLN 10 -9.914 20.474 -16.458 74 H ILE 11 H ILE 11 -13.354 14.634 -13.821 75 HA ILE 11 HA ILE 11 -15.010 14.896 -16.244 76 HB ILE 11 HB ILE 11 -16.537 13.205 -15.364 77 HG12 ILE 11 1HG1 ILE 11 -14.477 12.863 -13.173 78 HG13 ILE 11 2HG1 ILE 11 -16.095 13.526 -12.972 79 HG21 ILE 11 1HG2 ILE 11 -14.495 12.665 -16.807 80 HG22 ILE 11 2HG2 ILE 11 -13.790 12.001 -15.334 81 HG23 ILE 11 3HG2 ILE 11 -15.286 11.325 -15.977 82 HD11 ILE 11 3HD1 ILE 11 -15.255 10.708 -13.470 83 HD12 ILE 11 1HD1 ILE 11 -16.337 11.358 -12.238 84 HD13 ILE 11 2HD1 ILE 11 -16.874 11.247 -13.914 85 H PHE 12 H PHE 12 -17.381 15.257 -15.636 86 HA PHE 12 HA PHE 12 -17.483 17.224 -13.447 87 HB2 PHE 12 1HB PHE 12 -19.172 17.100 -15.955 88 HB3 PHE 12 2HB PHE 12 -19.283 18.329 -14.700 89 HD1 PHE 12 HD2 PHE 12 -16.948 19.507 -14.170 90 HD2 PHE 12 HD1 PHE 12 -17.982 17.616 -17.840 91 HE1 PHE 12 HE2 PHE 12 -15.250 20.852 -15.337 92 HE2 PHE 12 HE1 PHE 12 -16.285 18.957 -19.013 93 HZ PHE 12 HZ PHE 12 -14.917 20.578 -17.762 94 H VAL 13 H VAL 13 -18.823 16.861 -11.801 95 HA VAL 13 HA VAL 13 -20.997 14.906 -12.161 96 HB VAL 13 HB VAL 13 -19.352 15.174 -9.644 97 HG11 VAL 13 1HG1 VAL 13 -20.474 13.148 -8.954 98 HG12 VAL 13 2HG1 VAL 13 -21.673 14.372 -9.375 99 HG13 VAL 13 3HG1 VAL 13 -21.323 13.057 -10.497 100 HG21 VAL 13 3HG2 VAL 13 -18.905 12.656 -10.735 101 HG22 VAL 13 1HG2 VAL 13 -18.778 13.763 -12.101 102 HG23 VAL 13 2HG2 VAL 13 -17.765 14.000 -10.677 103 H LYS 14 H LYS 14 -22.918 15.348 -11.149 104 HA LYS 14 HA LYS 14 -23.140 18.029 -9.964 105 HB2 LYS 14 1HB LYS 14 -24.956 16.338 -11.610 106 HB3 LYS 14 2HB LYS 14 -25.694 17.408 -10.425 107 HG2 LYS 14 1HG LYS 14 -25.672 18.781 -12.239 108 HG3 LYS 14 2HG LYS 14 -24.104 19.187 -11.537 109 HD2 LYS 14 1HD LYS 14 -23.095 17.449 -13.051 110 HD3 LYS 14 2HD LYS 14 -24.666 17.337 -13.849 111 HE2 LYS 14 1HE LYS 14 -22.960 19.813 -13.610 112 HE3 LYS 14 2HE LYS 14 -23.173 18.835 -15.061 113 HZ1 LYS 14 3HZ LYS 14 -25.715 19.447 -14.299 114 HZ2 LYS 14 1HZ LYS 14 -24.840 20.207 -15.532 115 HZ3 LYS 14 2HZ LYS 14 -24.864 20.874 -13.979 116 H THR 15 H THR 15 -23.508 18.202 -7.860 117 HA THR 15 HA THR 15 -24.111 15.832 -6.300 118 HB THR 15 HB THR 15 -23.713 17.229 -4.338 119 HG1 THR 15 HG1 THR 15 -23.123 19.402 -6.059 120 HG21 THR 15 3HG2 THR 15 -21.388 18.238 -5.472 121 HG22 THR 15 1HG2 THR 15 -21.800 16.858 -6.489 122 HG23 THR 15 2HG2 THR 15 -21.595 16.643 -4.750 123 H LEU 16 H LEU 16 -25.618 16.366 -4.299 124 HA LEU 16 HA LEU 16 -28.229 16.771 -5.402 125 HB2 LEU 16 1HB LEU 16 -27.236 16.271 -2.607 126 HB3 LEU 16 2HB LEU 16 -28.943 16.476 -2.996 127 HG LEU 16 HG LEU 16 -28.380 14.506 -4.701 128 HD11 LEU 16 1HD1 LEU 16 -26.079 14.236 -4.241 129 HD12 LEU 16 2HD1 LEU 16 -26.898 12.885 -3.459 130 HD13 LEU 16 3HD1 LEU 16 -26.348 14.257 -2.498 131 HD21 LEU 16 3HD2 LEU 16 -29.014 14.288 -1.766 132 HD22 LEU 16 1HD2 LEU 16 -29.119 12.932 -2.888 133 HD23 LEU 16 2HD2 LEU 16 -30.145 14.347 -3.118 134 H THR 17 H THR 17 -25.896 18.769 -3.884 135 HA THR 17 HA THR 17 -27.866 20.801 -3.158 136 HB THR 17 HB THR 17 -26.054 20.339 -1.557 137 HG1 THR 17 HG1 THR 17 -26.867 22.428 -1.518 138 HG21 THR 17 3HG2 THR 17 -23.756 21.187 -2.149 139 HG22 THR 17 1HG2 THR 17 -24.291 21.251 -3.827 140 HG23 THR 17 2HG2 THR 17 -24.244 19.708 -2.975 141 H GLY 18 H GLY 18 -27.313 20.097 -5.966 142 HA2 GLY 18 1HA GLY 18 -26.933 21.129 -7.984 143 HA3 GLY 18 2HA GLY 18 -27.416 22.595 -7.143 144 H LYS 19 H LYS 19 -24.584 20.663 -6.361 145 HA LYS 19 HA LYS 19 -22.904 22.926 -7.223 146 HB2 LYS 19 1HB LYS 19 -22.875 22.656 -4.808 147 HB3 LYS 19 2HB LYS 19 -22.470 20.952 -4.974 148 HG2 LYS 19 1HG LYS 19 -20.636 22.898 -6.239 149 HG3 LYS 19 2HG LYS 19 -20.651 22.826 -4.475 150 HD2 LYS 19 1HD LYS 19 -20.545 20.210 -4.995 151 HD3 LYS 19 2HD LYS 19 -19.762 20.809 -6.459 152 HE2 LYS 19 1HE LYS 19 -17.956 21.624 -5.323 153 HE3 LYS 19 2HE LYS 19 -18.881 21.931 -3.854 154 HZ1 LYS 19 3HZ LYS 19 -17.242 19.757 -4.405 155 HZ2 LYS 19 1HZ LYS 19 -18.826 19.163 -4.364 156 HZ3 LYS 19 2HZ LYS 19 -18.204 20.005 -3.036 157 H THR 20 H THR 20 -21.624 22.527 -8.891 158 HA THR 20 HA THR 20 -21.169 19.790 -9.753 159 HB THR 20 HB THR 20 -19.987 22.151 -11.163 160 HG1 THR 20 HG1 THR 20 -22.102 22.821 -10.818 161 HG21 THR 20 3HG2 THR 20 -19.703 19.695 -11.836 162 HG22 THR 20 1HG2 THR 20 -20.214 20.825 -13.089 163 HG23 THR 20 2HG2 THR 20 -21.396 19.763 -12.324 164 H ILE 21 H ILE 21 -19.425 18.671 -9.208 165 HA ILE 21 HA ILE 21 -16.975 20.145 -8.488 166 HB ILE 21 HB ILE 21 -17.852 19.138 -6.492 167 HG12 ILE 21 1HG1 ILE 21 -15.325 18.814 -7.330 168 HG13 ILE 21 2HG1 ILE 21 -15.891 18.218 -5.773 169 HG21 ILE 21 1HG2 ILE 21 -18.151 16.650 -6.369 170 HG22 ILE 21 2HG2 ILE 21 -19.336 17.496 -7.362 171 HG23 ILE 21 3HG2 ILE 21 -18.014 16.616 -8.127 172 HD11 ILE 21 3HD1 ILE 21 -15.963 16.022 -6.502 173 HD12 ILE 21 1HD1 ILE 21 -16.000 16.483 -8.203 174 HD13 ILE 21 2HD1 ILE 21 -14.511 16.660 -7.274 175 H THR 22 H THR 22 -15.125 19.578 -9.478 176 HA THR 22 HA THR 22 -15.278 17.625 -11.618 177 HB THR 22 HB THR 22 -12.811 19.191 -10.918 178 HG1 THR 22 HG1 THR 22 -14.274 20.817 -11.064 179 HG21 THR 22 3HG2 THR 22 -13.330 17.345 -12.868 180 HG22 THR 22 1HG2 THR 22 -12.077 18.582 -12.955 181 HG23 THR 22 2HG2 THR 22 -13.648 18.863 -13.707 182 H LEU 23 H LEU 23 -14.670 15.583 -11.390 183 HA LEU 23 HA LEU 23 -12.785 14.908 -9.230 184 HB2 LEU 23 1HB LEU 23 -15.271 14.015 -9.381 185 HB3 LEU 23 2HB LEU 23 -14.530 12.847 -10.473 186 HG LEU 23 HG LEU 23 -12.923 12.310 -8.585 187 HD11 LEU 23 1HD1 LEU 23 -13.036 13.993 -7.037 188 HD12 LEU 23 2HD1 LEU 23 -14.139 12.821 -6.317 189 HD13 LEU 23 3HD1 LEU 23 -14.779 14.196 -7.217 190 HD21 LEU 23 3HD2 LEU 23 -14.739 11.011 -7.330 191 HD22 LEU 23 1HD2 LEU 23 -14.548 10.699 -9.055 192 HD23 LEU 23 2HD2 LEU 23 -15.865 11.725 -8.485 193 H GLU 24 H GLU 24 -11.094 13.496 -9.642 194 HA GLU 24 HA GLU 24 -10.473 13.130 -12.491 195 HB2 GLU 24 1HB GLU 24 -8.729 14.363 -11.556 196 HB3 GLU 24 2HB GLU 24 -8.776 13.470 -10.043 197 HG2 GLU 24 1HG GLU 24 -7.421 11.841 -10.800 198 HG3 GLU 24 2HG GLU 24 -8.078 11.903 -12.435 199 H VAL 25 H VAL 25 -10.433 11.155 -13.338 200 HA VAL 25 HA VAL 25 -9.896 8.842 -11.640 201 HB VAL 25 HB VAL 25 -12.313 8.993 -11.558 202 HG11 VAL 25 1HG1 VAL 25 -12.500 10.320 -13.690 203 HG12 VAL 25 2HG1 VAL 25 -12.353 8.793 -14.562 204 HG13 VAL 25 3HG1 VAL 25 -13.714 9.060 -13.472 205 HG21 VAL 25 3HG2 VAL 25 -12.664 6.783 -11.895 206 HG22 VAL 25 1HG2 VAL 25 -12.029 6.823 -13.540 207 HG23 VAL 25 2HG2 VAL 25 -10.922 6.776 -12.169 208 H GLU 26 H GLU 26 -9.045 7.080 -12.729 209 HA GLU 26 HA GLU 26 -7.755 7.650 -15.205 210 HB2 GLU 26 1HB GLU 26 -7.994 4.916 -13.967 211 HB3 GLU 26 2HB GLU 26 -6.699 5.546 -14.976 212 HG2 GLU 26 1HG GLU 26 -6.161 7.148 -13.132 213 HG3 GLU 26 2HG GLU 26 -7.322 6.280 -12.129 214 HA PRO 27 HA PRO 27 -10.658 6.161 -18.141 215 HB2 PRO 27 1HB PRO 27 -9.003 5.158 -20.045 216 HB3 PRO 27 2HB PRO 27 -9.205 6.891 -19.764 217 HG2 PRO 27 1HG PRO 27 -7.030 5.061 -18.826 218 HG3 PRO 27 2HG PRO 27 -6.904 6.702 -19.489 219 HD2 PRO 27 1HD PRO 27 -6.774 6.189 -16.833 220 HD3 PRO 27 2HD PRO 27 -7.464 7.690 -17.483 221 H SER 28 H SER 28 -8.344 3.999 -16.729 222 HA SER 28 HA SER 28 -9.835 1.664 -17.703 223 HB2 SER 28 1HB SER 28 -7.358 1.698 -18.027 224 HB3 SER 28 2HB SER 28 -7.167 1.724 -16.275 225 HG SER 28 HG SER 28 -7.124 -0.399 -17.449 226 H ASP 29 H ASP 29 -9.436 3.646 -14.990 227 HA ASP 29 HA ASP 29 -9.810 1.785 -12.900 228 HB2 ASP 29 1HB ASP 29 -10.080 4.738 -13.194 229 HB3 ASP 29 2HB ASP 29 -10.833 3.980 -11.794 230 H THR 30 H THR 30 -11.761 1.659 -11.516 231 HA THR 30 HA THR 30 -14.181 1.551 -13.189 232 HB THR 30 HB THR 30 -15.002 -0.225 -11.824 233 HG1 THR 30 HG1 THR 30 -13.407 -0.927 -10.060 234 HG21 THR 30 3HG2 THR 30 -12.080 -0.874 -12.102 235 HG22 THR 30 1HG2 THR 30 -13.129 -0.696 -13.508 236 HG23 THR 30 2HG2 THR 30 -13.469 -1.941 -12.305 237 H ILE 31 H ILE 31 -16.249 1.652 -11.785 238 HA ILE 31 HA ILE 31 -16.556 4.207 -10.781 239 HB ILE 31 HB ILE 31 -18.189 1.805 -9.954 240 HG12 ILE 31 1HG1 ILE 31 -18.081 1.899 -12.371 241 HG13 ILE 31 2HG1 ILE 31 -19.667 2.455 -11.850 242 HG21 ILE 31 1HG2 ILE 31 -18.679 3.697 -8.573 243 HG22 ILE 31 2HG2 ILE 31 -18.780 4.758 -9.977 244 HG23 ILE 31 3HG2 ILE 31 -19.997 3.507 -9.729 245 HD11 ILE 31 3HD1 ILE 31 -17.532 3.882 -13.255 246 HD12 ILE 31 1HD1 ILE 31 -19.278 4.124 -13.285 247 HD13 ILE 31 2HD1 ILE 31 -18.317 4.794 -11.967 248 H GLU 32 H GLU 32 -15.429 1.332 -9.174 249 HA GLU 32 HA GLU 32 -15.823 2.100 -6.505 250 HB2 GLU 32 1HB GLU 32 -13.570 0.412 -7.607 251 HB3 GLU 32 2HB GLU 32 -14.141 0.436 -5.945 252 HG2 GLU 32 1HG GLU 32 -16.428 -0.207 -7.127 253 HG3 GLU 32 2HG GLU 32 -15.318 -0.842 -8.340 254 H ASN 33 H ASN 33 -13.259 2.833 -8.797 255 HA ASN 33 HA ASN 33 -11.567 4.096 -6.856 256 HB2 ASN 33 1HB ASN 33 -11.279 3.194 -9.496 257 HB3 ASN 33 2HB ASN 33 -11.052 4.939 -9.576 258 HD21 ASN 33 2HD2 ASN 33 -9.786 1.936 -8.470 259 HD22 ASN 33 1HD2 ASN 33 -8.271 2.538 -7.898 260 H VAL 34 H VAL 34 -14.109 5.103 -9.021 261 HA VAL 34 HA VAL 34 -13.609 7.867 -9.061 262 HB VAL 34 HB VAL 34 -16.256 6.421 -9.250 263 HG11 VAL 34 1HG1 VAL 34 -17.061 8.457 -10.360 264 HG12 VAL 34 2HG1 VAL 34 -16.575 8.767 -8.692 265 HG13 VAL 34 3HG1 VAL 34 -15.518 9.242 -10.023 266 HG21 VAL 34 3HG2 VAL 34 -14.249 6.047 -10.929 267 HG22 VAL 34 1HG2 VAL 34 -15.914 6.174 -11.495 268 HG23 VAL 34 2HG2 VAL 34 -14.838 7.568 -11.599 269 H LYS 35 H LYS 35 -15.853 6.000 -7.010 270 HA LYS 35 HA LYS 35 -16.725 8.109 -5.414 271 HB2 LYS 35 1HB LYS 35 -17.189 6.291 -3.704 272 HB3 LYS 35 2HB LYS 35 -17.919 6.069 -5.288 273 HG2 LYS 35 1HG LYS 35 -16.382 4.391 -5.879 274 HG3 LYS 35 2HG LYS 35 -15.306 4.796 -4.539 275 HD2 LYS 35 1HD LYS 35 -18.114 3.837 -4.072 276 HD3 LYS 35 2HD LYS 35 -16.777 2.708 -4.307 277 HE2 LYS 35 1HE LYS 35 -16.482 4.903 -2.312 278 HE3 LYS 35 2HE LYS 35 -17.477 3.507 -1.900 279 HZ1 LYS 35 3HZ LYS 35 -15.360 2.247 -2.792 280 HZ2 LYS 35 1HZ LYS 35 -15.470 2.770 -1.186 281 HZ3 LYS 35 2HZ LYS 35 -14.589 3.674 -2.312 282 H ALA 36 H ALA 36 -13.759 6.300 -5.341 283 HA ALA 36 HA ALA 36 -12.890 6.746 -2.742 284 HB1 ALA 36 1HB ALA 36 -10.757 7.003 -4.708 285 HB2 ALA 36 2HB ALA 36 -11.002 5.789 -3.452 286 HB3 ALA 36 3HB ALA 36 -11.814 5.623 -5.009 287 H LYS 37 H LYS 37 -12.702 8.850 -5.575 288 HA LYS 37 HA LYS 37 -11.200 10.888 -4.230 289 HB2 LYS 37 1HB LYS 37 -12.698 10.827 -6.848 290 HB3 LYS 37 2HB LYS 37 -11.856 12.258 -6.267 291 HG2 LYS 37 1HG LYS 37 -10.268 11.331 -7.628 292 HG3 LYS 37 2HG LYS 37 -9.826 10.626 -6.071 293 HD2 LYS 37 1HD LYS 37 -11.006 8.582 -6.629 294 HD3 LYS 37 2HD LYS 37 -11.557 9.287 -8.150 295 HE2 LYS 37 1HE LYS 37 -9.041 9.613 -8.639 296 HE3 LYS 37 2HE LYS 37 -8.796 8.436 -7.349 297 HZ1 LYS 37 3HZ LYS 37 -8.858 7.306 -9.441 298 HZ2 LYS 37 1HZ LYS 37 -10.332 8.025 -9.855 299 HZ3 LYS 37 2HZ LYS 37 -10.263 6.908 -8.587 300 H ILE 38 H ILE 38 -14.581 10.190 -4.755 301 HA ILE 38 HA ILE 38 -15.634 12.727 -4.120 302 HB ILE 38 HB ILE 38 -16.892 10.005 -3.759 303 HG12 ILE 38 1HG1 ILE 38 -16.213 10.520 -6.080 304 HG13 ILE 38 2HG1 ILE 38 -17.963 10.437 -5.906 305 HG21 ILE 38 1HG2 ILE 38 -18.079 11.576 -2.409 306 HG22 ILE 38 2HG2 ILE 38 -18.083 12.770 -3.705 307 HG23 ILE 38 3HG2 ILE 38 -19.033 11.293 -3.864 308 HD11 ILE 38 3HD1 ILE 38 -17.394 12.281 -7.320 309 HD12 ILE 38 1HD1 ILE 38 -18.019 12.906 -5.794 310 HD13 ILE 38 2HD1 ILE 38 -16.284 12.923 -6.109 311 H GLN 39 H GLN 39 -14.522 10.068 -2.149 312 HA GLN 39 HA GLN 39 -15.732 10.632 0.276 313 HB2 GLN 39 1HB GLN 39 -13.109 9.405 -0.481 314 HB3 GLN 39 2HB GLN 39 -13.450 9.732 1.213 315 HG2 GLN 39 1HG GLN 39 -15.609 8.429 0.858 316 HG3 GLN 39 2HG GLN 39 -14.890 7.886 -0.657 317 HE21 GLN 39 2HE2 GLN 39 -14.715 5.760 -0.092 318 HE22 GLN 39 1HE2 GLN 39 -13.638 5.186 1.131 319 H ASP 40 H ASP 40 -12.965 12.161 -1.254 320 HA ASP 40 HA ASP 40 -12.292 13.752 1.043 321 HB2 ASP 40 1HB ASP 40 -10.704 13.018 -0.825 322 HB3 ASP 40 2HB ASP 40 -11.434 14.293 -1.796 323 H LYS 41 H LYS 41 -14.454 14.024 -1.629 324 HA LYS 41 HA LYS 41 -14.731 16.886 -1.494 325 HB2 LYS 41 1HB LYS 41 -16.662 14.968 -2.789 326 HB3 LYS 41 2HB LYS 41 -16.378 16.657 -3.190 327 HG2 LYS 41 1HG LYS 41 -14.367 14.449 -3.570 328 HG3 LYS 41 2HG LYS 41 -15.430 15.075 -4.832 329 HD2 LYS 41 1HD LYS 41 -14.287 17.047 -5.007 330 HD3 LYS 41 2HD LYS 41 -13.771 17.023 -3.319 331 HE2 LYS 41 1HE LYS 41 -12.037 15.507 -3.757 332 HE3 LYS 41 2HE LYS 41 -12.719 15.042 -5.314 333 HZ1 LYS 41 3HZ LYS 41 -12.181 17.819 -5.270 334 HZ2 LYS 41 1HZ LYS 41 -11.563 16.631 -6.305 335 HZ3 LYS 41 2HZ LYS 41 -10.788 16.961 -4.838 336 H GLU 42 H GLU 42 -16.796 14.119 -0.614 337 HA GLU 42 HA GLU 42 -18.188 15.896 1.281 338 HB2 GLU 42 1HB GLU 42 -19.311 13.704 -0.459 339 HB3 GLU 42 2HB GLU 42 -20.176 14.347 0.929 340 HG2 GLU 42 1HG GLU 42 -19.270 15.941 -1.457 341 HG3 GLU 42 2HG GLU 42 -20.909 15.361 -1.169 342 H GLY 43 H GLY 43 -16.933 12.682 0.614 343 HA2 GLY 43 1HA GLY 43 -16.113 11.100 2.081 344 HA3 GLY 43 2HA GLY 43 -16.412 12.229 3.394 345 H ILE 44 H ILE 44 -18.136 10.073 1.150 346 HA ILE 44 HA ILE 44 -19.966 9.415 3.365 347 HB ILE 44 HB ILE 44 -21.702 8.964 1.597 348 HG12 ILE 44 1HG1 ILE 44 -19.822 10.587 -0.132 349 HG13 ILE 44 2HG1 ILE 44 -20.118 8.861 -0.311 350 HG21 ILE 44 1HG2 ILE 44 -22.552 10.960 2.106 351 HG22 ILE 44 2HG2 ILE 44 -21.019 11.298 2.909 352 HG23 ILE 44 3HG2 ILE 44 -21.272 11.811 1.241 353 HD11 ILE 44 3HD1 ILE 44 -22.603 10.281 -0.316 354 HD12 ILE 44 1HD1 ILE 44 -21.502 10.974 -1.506 355 HD13 ILE 44 2HD1 ILE 44 -21.894 9.255 -1.563 356 HA PRO 45 HA PRO 45 -18.909 5.195 2.757 357 HB2 PRO 45 1HB PRO 45 -21.224 3.984 3.494 358 HB3 PRO 45 2HB PRO 45 -20.130 4.750 4.652 359 HG2 PRO 45 1HG PRO 45 -22.651 5.815 3.437 360 HG3 PRO 45 2HG PRO 45 -22.091 5.911 5.117 361 HD2 PRO 45 1HD PRO 45 -21.855 7.976 3.381 362 HD3 PRO 45 2HD PRO 45 -20.677 7.678 4.676 363 HA PRO 46 HA PRO 46 -20.295 3.663 -1.124 364 HB2 PRO 46 1HB PRO 46 -20.332 0.977 -0.731 365 HB3 PRO 46 2HB PRO 46 -18.835 1.909 -0.856 366 HG2 PRO 46 1HG PRO 46 -20.258 0.929 1.589 367 HG3 PRO 46 2HG PRO 46 -18.523 0.917 1.224 368 HD2 PRO 46 1HD PRO 46 -19.661 2.778 2.827 369 HD3 PRO 46 2HD PRO 46 -18.258 3.133 1.799 370 H ASP 47 H ASP 47 -22.043 2.508 1.705 371 HA ASP 47 HA ASP 47 -24.229 1.326 0.415 372 HB2 ASP 47 1HB ASP 47 -24.400 2.804 3.039 373 HB3 ASP 47 2HB ASP 47 -25.351 1.418 2.510 374 H GLN 48 H GLN 48 -23.449 4.663 1.040 375 HA GLN 48 HA GLN 48 -26.072 5.487 -0.001 376 HB2 GLN 48 1HB GLN 48 -24.007 7.010 1.592 377 HB3 GLN 48 2HB GLN 48 -25.450 7.743 0.905 378 HG2 GLN 48 1HG GLN 48 -26.847 6.744 2.406 379 HG3 GLN 48 2HG GLN 48 -25.776 5.366 2.653 380 HE21 GLN 48 2HE2 GLN 48 -26.103 5.654 4.910 381 HE22 GLN 48 1HE2 GLN 48 -25.233 6.870 5.775 382 H GLN 49 H GLN 49 -22.676 5.474 -0.638 383 HA GLN 49 HA GLN 49 -22.728 7.530 -2.638 384 HB2 GLN 49 1HB GLN 49 -20.686 6.976 -1.359 385 HB3 GLN 49 2HB GLN 49 -20.652 5.393 -2.123 386 HG2 GLN 49 1HG GLN 49 -19.075 6.828 -3.212 387 HG3 GLN 49 2HG GLN 49 -20.407 6.490 -4.316 388 HE21 GLN 49 2HE2 GLN 49 -21.655 8.135 -5.046 389 HE22 GLN 49 1HE2 GLN 49 -21.374 9.799 -4.675 390 H ARG 50 H ARG 50 -23.683 7.291 -4.539 391 HA ARG 50 HA ARG 50 -23.271 4.820 -6.041 392 HB2 ARG 50 1HB ARG 50 -25.994 6.043 -5.557 393 HB3 ARG 50 2HB ARG 50 -25.660 4.731 -6.679 394 HG2 ARG 50 1HG ARG 50 -24.624 3.687 -4.430 395 HG3 ARG 50 2HG ARG 50 -25.893 4.705 -3.745 396 HD2 ARG 50 1HD ARG 50 -26.862 3.265 -6.045 397 HD3 ARG 50 2HD ARG 50 -26.172 2.156 -4.860 398 HE ARG 50 HE ARG 50 -27.904 2.646 -3.432 399 HH11 ARG 50 1HH1 ARG 50 -27.874 4.929 -6.060 400 HH12 ARG 50 2HH1 ARG 50 -29.411 5.617 -5.651 401 HH21 ARG 50 1HH2 ARG 50 -29.927 3.544 -2.883 402 HH22 ARG 50 2HH2 ARG 50 -30.577 4.830 -3.843 403 H LEU 51 H LEU 51 -22.724 5.241 -8.079 404 HA LEU 51 HA LEU 51 -23.004 7.978 -9.061 405 HB2 LEU 51 1HB LEU 51 -21.297 5.640 -9.802 406 HB3 LEU 51 2HB LEU 51 -21.547 6.945 -10.960 407 HG LEU 51 HG LEU 51 -19.453 7.241 -9.775 408 HD11 LEU 51 1HD1 LEU 51 -21.230 9.162 -10.273 409 HD12 LEU 51 2HD1 LEU 51 -19.670 9.481 -9.516 410 HD13 LEU 51 3HD1 LEU 51 -21.119 9.341 -8.522 411 HD21 LEU 51 3HD2 LEU 51 -20.623 6.104 -7.646 412 HD22 LEU 51 1HD2 LEU 51 -20.759 7.802 -7.187 413 HD23 LEU 51 2HD2 LEU 51 -19.176 7.107 -7.535 414 H ILE 52 H ILE 52 -24.228 8.547 -10.777 415 HA ILE 52 HA ILE 52 -25.763 6.404 -12.096 416 HB ILE 52 HB ILE 52 -26.668 9.261 -11.765 417 HG12 ILE 52 1HG1 ILE 52 -26.469 8.266 -9.553 418 HG13 ILE 52 2HG1 ILE 52 -28.168 8.401 -9.990 419 HG21 ILE 52 1HG2 ILE 52 -28.906 8.167 -12.227 420 HG22 ILE 52 2HG2 ILE 52 -27.782 8.251 -13.582 421 HG23 ILE 52 3HG2 ILE 52 -27.997 6.735 -12.708 422 HD11 ILE 52 3HD1 ILE 52 -27.664 6.284 -8.889 423 HD12 ILE 52 1HD1 ILE 52 -28.232 6.042 -10.541 424 HD13 ILE 52 2HD1 ILE 52 -26.514 5.894 -10.168 425 H PHE 53 H PHE 53 -25.967 6.423 -14.298 426 HA PHE 53 HA PHE 53 -24.791 8.641 -15.799 427 HB2 PHE 53 1HB PHE 53 -23.046 6.849 -15.408 428 HB3 PHE 53 2HB PHE 53 -24.044 5.773 -16.381 429 HD1 PHE 53 HD2 PHE 53 -22.137 8.942 -16.458 430 HD2 PHE 53 HD1 PHE 53 -23.959 5.832 -18.722 431 HE1 PHE 53 HE2 PHE 53 -21.067 9.806 -18.498 432 HE2 PHE 53 HE1 PHE 53 -22.891 6.690 -20.766 433 HZ PHE 53 HZ PHE 53 -21.445 8.680 -20.656 434 H ALA 54 H ALA 54 -26.200 9.255 -17.287 435 HA ALA 54 HA ALA 54 -27.952 9.257 -18.743 436 HB1 ALA 54 1HB ALA 54 -26.251 7.890 -19.977 437 HB2 ALA 54 2HB ALA 54 -27.085 6.448 -19.397 438 HB3 ALA 54 3HB ALA 54 -27.926 7.592 -20.444 439 H GLY 55 H GLY 55 -28.650 8.591 -16.107 440 HA2 GLY 55 1HA GLY 55 -30.539 7.899 -14.989 441 HA3 GLY 55 2HA GLY 55 -31.211 7.421 -16.541 442 H LYS 56 H LYS 56 -28.148 6.110 -15.704 443 HA LYS 56 HA LYS 56 -29.415 3.606 -14.817 444 HB2 LYS 56 1HB LYS 56 -27.607 4.081 -17.114 445 HB3 LYS 56 2HB LYS 56 -27.264 2.656 -16.143 446 HG2 LYS 56 1HG LYS 56 -28.697 1.715 -17.612 447 HG3 LYS 56 2HG LYS 56 -29.886 2.310 -16.449 448 HD2 LYS 56 1HD LYS 56 -30.349 4.227 -17.788 449 HD3 LYS 56 2HD LYS 56 -28.983 3.887 -18.853 450 HE2 LYS 56 1HE LYS 56 -30.812 3.137 -20.076 451 HE3 LYS 56 2HE LYS 56 -30.193 1.663 -19.332 452 HZ1 LYS 56 3HZ LYS 56 -32.542 3.259 -18.477 453 HZ2 LYS 56 1HZ LYS 56 -31.876 2.012 -17.547 454 HZ3 LYS 56 2HZ LYS 56 -32.534 1.673 -19.068 455 H GLN 57 H GLN 57 -28.617 2.871 -12.964 456 HA GLN 57 HA GLN 57 -26.558 4.186 -11.569 457 HB2 GLN 57 1HB GLN 57 -26.801 2.462 -9.897 458 HB3 GLN 57 2HB GLN 57 -28.394 2.904 -10.496 459 HG2 GLN 57 1HG GLN 57 -28.421 0.923 -11.914 460 HG3 GLN 57 2HG GLN 57 -26.816 0.482 -11.334 461 HE21 GLN 57 2HE2 GLN 57 -27.284 -1.389 -10.323 462 HE22 GLN 57 1HE2 GLN 57 -28.348 -1.526 -8.969 463 H LEU 58 H LEU 58 -24.426 3.721 -11.242 464 HA LEU 58 HA LEU 58 -23.248 1.770 -13.089 465 HB2 LEU 58 1HB LEU 58 -21.789 3.904 -11.556 466 HB3 LEU 58 2HB LEU 58 -21.233 3.007 -12.967 467 HG LEU 58 HG LEU 58 -23.541 4.935 -13.073 468 HD11 LEU 58 1HD1 LEU 58 -20.989 5.687 -12.452 469 HD12 LEU 58 2HD1 LEU 58 -22.187 6.703 -13.253 470 HD13 LEU 58 3HD1 LEU 58 -21.001 5.817 -14.211 471 HD21 LEU 58 3HD2 LEU 58 -22.332 3.105 -14.913 472 HD22 LEU 58 1HD2 LEU 58 -22.117 4.758 -15.490 473 HD23 LEU 58 2HD2 LEU 58 -23.735 4.151 -15.139 474 H GLU 59 H GLU 59 -21.655 0.305 -12.395 475 HA GLU 59 HA GLU 59 -21.290 0.008 -9.505 476 HB2 GLU 59 1HB GLU 59 -22.237 -2.187 -11.354 477 HB3 GLU 59 2HB GLU 59 -21.695 -2.443 -9.702 478 HG2 GLU 59 1HG GLU 59 -23.512 -0.857 -8.981 479 HG3 GLU 59 2HG GLU 59 -24.120 -0.938 -10.633 480 H ASP 60 H ASP 60 -19.671 -1.875 -9.108 481 HA ASP 60 HA ASP 60 -17.249 -1.179 -10.388 482 HB2 ASP 60 1HB ASP 60 -16.205 -2.736 -8.959 483 HB3 ASP 60 2HB ASP 60 -17.582 -2.142 -8.036 484 H GLY 61 H GLY 61 -15.851 -3.430 -10.917 485 HA2 GLY 61 1HA GLY 61 -15.666 -5.289 -12.330 486 HA3 GLY 61 2HA GLY 61 -17.347 -5.073 -12.797 487 H ARG 62 H ARG 62 -17.549 -2.657 -13.834 488 HA ARG 62 HA ARG 62 -15.857 -2.824 -16.201 489 HB2 ARG 62 1HB ARG 62 -18.372 -1.274 -15.586 490 HB3 ARG 62 2HB ARG 62 -17.466 -1.078 -17.081 491 HG2 ARG 62 1HG ARG 62 -18.561 -3.719 -16.152 492 HG3 ARG 62 2HG ARG 62 -19.446 -2.611 -17.202 493 HD2 ARG 62 1HD ARG 62 -17.487 -2.692 -18.770 494 HD3 ARG 62 2HD ARG 62 -16.824 -3.981 -17.766 495 HE ARG 62 HE ARG 62 -18.907 -4.216 -19.695 496 HH11 ARG 62 1HH1 ARG 62 -17.760 -5.467 -16.655 497 HH12 ARG 62 2HH1 ARG 62 -18.519 -7.011 -16.855 498 HH21 ARG 62 1HH2 ARG 62 -19.911 -6.246 -19.970 499 HH22 ARG 62 2HH2 ARG 62 -19.741 -7.454 -18.742 500 H THR 63 H THR 63 -15.196 -0.681 -17.198 501 HA THR 63 HA THR 63 -14.049 1.023 -15.087 502 HB THR 63 HB THR 63 -12.228 0.100 -16.228 503 HG1 THR 63 HG1 THR 63 -12.097 2.398 -16.150 504 HG21 THR 63 3HG2 THR 63 -12.061 -0.050 -18.672 505 HG22 THR 63 1HG2 THR 63 -13.672 0.651 -18.824 506 HG23 THR 63 2HG2 THR 63 -13.466 -0.929 -18.068 507 H LEU 64 H LEU 64 -13.736 3.312 -15.647 508 HA LEU 64 HA LEU 64 -16.079 4.590 -16.353 509 HB2 LEU 64 1HB LEU 64 -13.223 5.508 -16.351 510 HB3 LEU 64 2HB LEU 64 -14.539 6.593 -16.793 511 HG LEU 64 HG LEU 64 -13.989 7.009 -14.516 512 HD11 LEU 64 1HD1 LEU 64 -16.448 5.273 -14.486 513 HD12 LEU 64 2HD1 LEU 64 -16.404 6.906 -15.148 514 HD13 LEU 64 3HD1 LEU 64 -16.081 6.641 -13.435 515 HD21 LEU 64 3HD2 LEU 64 -12.865 4.778 -14.185 516 HD22 LEU 64 1HD2 LEU 64 -14.469 4.106 -13.887 517 HD23 LEU 64 2HD2 LEU 64 -13.826 5.358 -12.824 518 H SER 65 H SER 65 -13.342 3.695 -18.387 519 HA SER 65 HA SER 65 -14.193 5.065 -20.711 520 HB2 SER 65 1HB SER 65 -11.898 4.368 -20.550 521 HB3 SER 65 2HB SER 65 -12.369 2.681 -20.341 522 HG SER 65 HG SER 65 -13.115 4.108 -22.652 523 H GLU 66 H GLU 66 -14.997 1.968 -19.328 524 HA GLU 66 HA GLU 66 -16.225 0.902 -21.683 525 HB2 GLU 66 1HB GLU 66 -16.156 0.112 -18.791 526 HB3 GLU 66 2HB GLU 66 -17.285 -0.669 -19.889 527 HG2 GLU 66 1HG GLU 66 -14.373 -0.514 -20.548 528 HG3 GLU 66 2HG GLU 66 -14.994 -1.759 -19.466 529 H TYR 67 H TYR 67 -17.241 2.936 -19.065 530 HA TYR 67 HA TYR 67 -20.063 2.608 -19.700 531 HB2 TYR 67 1HB TYR 67 -18.523 3.983 -17.536 532 HB3 TYR 67 2HB TYR 67 -20.170 4.506 -17.871 533 HD1 TYR 67 HD1 TYR 67 -21.715 2.197 -18.328 534 HD2 TYR 67 HD2 TYR 67 -18.421 2.640 -15.671 535 HE1 TYR 67 HE1 TYR 67 -22.584 0.352 -16.952 536 HE2 TYR 67 HE2 TYR 67 -19.280 0.796 -14.289 537 HH TYR 67 HH TYR 67 -22.392 -0.719 -14.975 538 H ASN 68 H ASN 68 -17.798 4.039 -21.328 539 HA ASN 68 HA ASN 68 -17.677 5.763 -22.805 540 HB2 ASN 68 1HB ASN 68 -20.610 6.260 -22.324 541 HB3 ASN 68 2HB ASN 68 -19.681 6.541 -23.794 542 HD21 ASN 68 2HD2 ASN 68 -18.801 4.608 -24.863 543 HD22 ASN 68 1HD2 ASN 68 -19.743 3.160 -24.837 544 H ILE 69 H ILE 69 -17.445 6.202 -19.860 545 HA ILE 69 HA ILE 69 -18.386 8.920 -19.485 546 HB ILE 69 HB ILE 69 -16.703 7.175 -17.684 547 HG12 ILE 69 1HG1 ILE 69 -19.559 7.953 -17.195 548 HG13 ILE 69 2HG1 ILE 69 -19.188 6.591 -18.245 549 HG21 ILE 69 1HG2 ILE 69 -17.306 8.829 -15.937 550 HG22 ILE 69 2HG2 ILE 69 -16.277 9.491 -17.206 551 HG23 ILE 69 3HG2 ILE 69 -18.004 9.849 -17.195 552 HD11 ILE 69 3HD1 ILE 69 -17.844 5.643 -16.342 553 HD12 ILE 69 1HD1 ILE 69 -18.549 6.904 -15.330 554 HD13 ILE 69 2HD1 ILE 69 -19.590 5.706 -16.101 555 H GLN 70 H GLN 70 -17.275 10.307 -20.772 556 HA GLN 70 HA GLN 70 -14.382 10.138 -20.960 557 HB2 GLN 70 1HB GLN 70 -16.193 12.235 -22.154 558 HB3 GLN 70 2HB GLN 70 -14.543 11.854 -22.628 559 HG2 GLN 70 1HG GLN 70 -15.279 9.656 -23.407 560 HG3 GLN 70 2HG GLN 70 -16.934 10.054 -22.948 561 HE21 GLN 70 2HE2 GLN 70 -17.818 12.055 -23.966 562 HE22 GLN 70 1HE2 GLN 70 -17.423 12.343 -25.623 563 H LYS 71 H LYS 71 -13.584 12.727 -21.129 564 HA LYS 71 HA LYS 71 -13.477 13.486 -18.364 565 HB2 LYS 71 1HB LYS 71 -11.911 15.176 -19.069 566 HB3 LYS 71 2HB LYS 71 -11.538 13.678 -19.911 567 HG2 LYS 71 1HG LYS 71 -12.781 14.549 -21.881 568 HG3 LYS 71 2HG LYS 71 -12.956 16.085 -21.030 569 HD2 LYS 71 1HD LYS 71 -10.477 16.205 -20.860 570 HD3 LYS 71 2HD LYS 71 -10.379 14.747 -21.851 571 HE2 LYS 71 1HE LYS 71 -11.826 16.075 -23.530 572 HE3 LYS 71 2HE LYS 71 -11.318 17.490 -22.610 573 HZ1 LYS 71 3HZ LYS 71 -9.663 15.636 -24.199 574 HZ2 LYS 71 1HZ LYS 71 -8.971 16.581 -22.978 575 HZ3 LYS 71 2HZ LYS 71 -9.746 17.323 -24.285 576 H GLU 72 H GLU 72 -15.714 14.036 -20.739 577 HA GLU 72 HA GLU 72 -16.527 16.608 -19.553 578 HB2 GLU 72 1HB GLU 72 -17.362 15.590 -22.266 579 HB3 GLU 72 2HB GLU 72 -17.549 17.214 -21.619 580 HG2 GLU 72 1HG GLU 72 -15.041 17.367 -21.570 581 HG3 GLU 72 2HG GLU 72 -15.011 15.856 -22.477 582 H SER 73 H SER 73 -17.258 13.352 -19.773 583 HA SER 73 HA SER 73 -20.026 13.248 -19.963 584 HB2 SER 73 1HB SER 73 -17.925 11.521 -18.784 585 HB3 SER 73 2HB SER 73 -19.569 11.246 -18.209 586 HG SER 73 HG SER 73 -19.969 11.362 -20.679 587 H THR 74 H THR 74 -21.697 13.246 -18.442 588 HA THR 74 HA THR 74 -21.101 14.793 -16.018 589 HB THR 74 HB THR 74 -23.885 14.323 -17.024 590 HG1 THR 74 HG1 THR 74 -23.660 15.856 -18.550 591 HG21 THR 74 3HG2 THR 74 -24.202 15.572 -15.181 592 HG22 THR 74 1HG2 THR 74 -23.663 16.917 -16.186 593 HG23 THR 74 2HG2 THR 74 -22.517 16.091 -15.130 594 H LEU 75 H LEU 75 -21.161 13.820 -14.107 595 HA LEU 75 HA LEU 75 -22.546 11.233 -13.892 596 HB2 LEU 75 1HB LEU 75 -20.027 12.296 -12.814 597 HB3 LEU 75 2HB LEU 75 -20.994 11.368 -11.670 598 HG LEU 75 HG LEU 75 -19.236 10.055 -12.853 599 HD11 LEU 75 1HD1 LEU 75 -21.238 8.432 -13.808 600 HD12 LEU 75 2HD1 LEU 75 -22.064 9.419 -12.603 601 HD13 LEU 75 3HD1 LEU 75 -20.644 8.478 -12.148 602 HD21 LEU 75 3HD2 LEU 75 -19.557 11.281 -15.036 603 HD22 LEU 75 1HD2 LEU 75 -21.007 10.305 -15.272 604 HD23 LEU 75 2HD2 LEU 75 -19.430 9.525 -15.151 605 H HIS 76 H HIS 76 -23.703 10.754 -11.947 606 HA HIS 76 HA HIS 76 -24.505 13.108 -10.377 607 HB2 HIS 76 1HB HIS 76 -26.230 11.208 -11.903 608 HB3 HIS 76 2HB HIS 76 -26.832 11.841 -10.374 609 HD1 HIS 76 HD1 HIS 76 -25.601 13.078 -13.737 610 HD2 HIS 76 HD2 HIS 76 -27.906 14.345 -10.521 611 HE1 HIS 76 HE1 HIS 76 -26.608 15.268 -14.453 612 H LEU 77 H LEU 77 -24.581 12.794 -8.232 613 HA LEU 77 HA LEU 77 -24.165 10.051 -7.254 614 HB2 LEU 77 1HB LEU 77 -23.245 11.139 -5.224 615 HB3 LEU 77 2HB LEU 77 -22.331 11.470 -6.694 616 HG LEU 77 HG LEU 77 -24.288 13.536 -6.223 617 HD11 LEU 77 1HD1 LEU 77 -22.724 14.347 -4.210 618 HD12 LEU 77 2HD1 LEU 77 -22.702 12.609 -3.910 619 HD13 LEU 77 3HD1 LEU 77 -24.238 13.475 -3.965 620 HD21 LEU 77 3HD2 LEU 77 -21.398 13.241 -6.781 621 HD22 LEU 77 1HD2 LEU 77 -21.917 14.751 -6.032 622 HD23 LEU 77 2HD2 LEU 77 -22.613 14.247 -7.572 623 H VAL 78 H VAL 78 -25.906 9.133 -6.413 624 HA VAL 78 HA VAL 78 -27.894 10.839 -5.063 625 HB VAL 78 HB VAL 78 -29.468 8.890 -5.466 626 HG11 VAL 78 1HG1 VAL 78 -28.360 10.344 -7.866 627 HG12 VAL 78 2HG1 VAL 78 -29.939 9.561 -7.775 628 HG13 VAL 78 3HG1 VAL 78 -29.584 10.955 -6.753 629 HG21 VAL 78 3HG2 VAL 78 -28.936 7.243 -7.072 630 HG22 VAL 78 1HG2 VAL 78 -27.462 8.082 -7.555 631 HG23 VAL 78 2HG2 VAL 78 -27.556 7.303 -5.976 632 H LEU 79 H LEU 79 -28.476 10.405 -3.001 633 HA LEU 79 HA LEU 79 -27.021 8.243 -1.647 634 HB2 LEU 79 1HB LEU 79 -28.085 10.892 -0.782 635 HB3 LEU 79 2HB LEU 79 -27.893 9.611 0.414 636 HG LEU 79 HG LEU 79 -25.504 9.500 -0.075 637 HD11 LEU 79 1HD1 LEU 79 -25.137 10.069 -2.260 638 HD12 LEU 79 2HD1 LEU 79 -24.677 11.572 -1.463 639 HD13 LEU 79 3HD1 LEU 79 -26.265 11.424 -2.215 640 HD21 LEU 79 3HD2 LEU 79 -25.441 12.301 0.339 641 HD22 LEU 79 1HD2 LEU 79 -25.299 11.011 1.533 642 HD23 LEU 79 2HD2 LEU 79 -26.885 11.673 1.135 643 H ARG 80 H ARG 80 -28.055 6.657 -0.546 644 HA ARG 80 HA ARG 80 -30.913 6.399 -0.996 645 HB2 ARG 80 1HB ARG 80 -29.120 4.547 -1.288 646 HB3 ARG 80 2HB ARG 80 -29.212 4.398 0.461 647 HG2 ARG 80 1HG ARG 80 -31.721 4.303 -1.145 648 HG3 ARG 80 2HG ARG 80 -30.672 2.885 -1.077 649 HD2 ARG 80 1HD ARG 80 -30.814 2.864 1.345 650 HD3 ARG 80 2HD ARG 80 -31.786 4.335 1.321 651 HE ARG 80 HE ARG 80 -32.911 2.151 -0.182 652 HH11 ARG 80 1HH1 ARG 80 -32.682 3.688 2.933 653 HH12 ARG 80 2HH1 ARG 80 -34.175 3.028 3.514 654 HH21 ARG 80 1HH2 ARG 80 -34.878 1.275 0.572 655 HH22 ARG 80 2HH2 ARG 80 -35.422 1.654 2.171 656 H LEU 81 H LEU 81 -28.854 5.753 1.846 657 HA LEU 81 HA LEU 81 -31.007 6.050 3.675 658 HB2 LEU 81 1HB LEU 81 -28.082 5.636 3.847 659 HB3 LEU 81 2HB LEU 81 -28.873 6.317 5.266 660 HG LEU 81 HG LEU 81 -28.588 3.865 5.380 661 HD11 LEU 81 1HD1 LEU 81 -31.146 3.425 5.723 662 HD12 LEU 81 2HD1 LEU 81 -31.267 5.165 5.459 663 HD13 LEU 81 3HD1 LEU 81 -30.276 4.540 6.777 664 HD21 LEU 81 3HD2 LEU 81 -30.684 3.664 3.240 665 HD22 LEU 81 1HD2 LEU 81 -29.688 2.385 3.934 666 HD23 LEU 81 2HD2 LEU 81 -28.960 3.589 2.870 667 H ARG 82 H ARG 82 -28.003 7.956 3.687 668 HA ARG 82 HA ARG 82 -29.041 10.118 5.095 669 HB2 ARG 82 1HB ARG 82 -26.604 9.586 4.624 670 HB3 ARG 82 2HB ARG 82 -26.839 10.323 3.044 671 HG2 ARG 82 1HG ARG 82 -26.018 12.107 4.190 672 HG3 ARG 82 2HG ARG 82 -27.743 12.329 4.492 673 HD2 ARG 82 1HD ARG 82 -26.564 12.603 6.562 674 HD3 ARG 82 2HD ARG 82 -27.471 11.093 6.628 675 HE ARG 82 HE ARG 82 -24.980 10.384 5.742 676 HH11 ARG 82 1HH1 ARG 82 -26.253 12.027 8.534 677 HH12 ARG 82 2HH1 ARG 82 -24.986 11.493 9.589 678 HH21 ARG 82 1HH2 ARG 82 -23.306 9.674 7.120 679 HH22 ARG 82 2HH2 ARG 82 -23.310 10.155 8.783 680 H GLY 83 H GLY 83 -29.974 12.049 4.534 681 HA2 GLY 83 1HA GLY 83 -30.934 12.222 1.748 682 HA3 GLY 83 2HA GLY 83 -31.800 12.850 3.141 683 H TYR 84 H TYR 84 -29.280 13.936 4.290 684 HA TYR 84 HA TYR 84 -29.153 16.340 2.606 685 HB2 TYR 84 1HB TYR 84 -28.339 17.472 4.676 686 HB3 TYR 84 2HB TYR 84 -29.959 16.802 4.831 687 HD1 TYR 84 HD1 TYR 84 -26.407 16.254 5.719 688 HD2 TYR 84 HD2 TYR 84 -30.451 15.167 6.470 689 HE1 TYR 84 HE1 TYR 84 -25.695 15.019 7.723 690 HE2 TYR 84 HE2 TYR 84 -29.751 13.929 8.477 691 HH TYR 84 HH TYR 84 -27.880 13.911 10.070 692 H ALA 85 H ALA 85 -26.921 17.563 3.317 693 HA ALA 85 HA ALA 85 -24.752 15.625 2.842 694 HB1 ALA 85 1HB ALA 85 -23.655 17.370 1.444 695 HB2 ALA 85 2HB ALA 85 -25.158 16.745 0.765 696 HB3 ALA 85 3HB ALA 85 -25.135 18.322 1.555 697 H ASP 86 H ASP 86 -22.544 16.768 3.227 698 HA ASP 86 HA ASP 86 -22.687 17.933 5.901 699 HB2 ASP 86 1HB ASP 86 -20.264 17.440 6.002 700 HB3 ASP 86 2HB ASP 86 -21.222 16.009 5.630 701 H LEU 87 H LEU 87 -20.478 19.386 6.177 702 HA LEU 87 HA LEU 87 -21.118 21.864 5.070 703 HB2 LEU 87 1HB LEU 87 -18.596 20.820 6.326 704 HB3 LEU 87 2HB LEU 87 -18.766 22.493 5.801 705 HG LEU 87 HG LEU 87 -20.588 21.201 7.823 706 HD11 LEU 87 1HD1 LEU 87 -18.774 21.185 9.146 707 HD12 LEU 87 2HD1 LEU 87 -19.063 22.921 9.248 708 HD13 LEU 87 3HD1 LEU 87 -17.875 22.291 8.107 709 HD21 LEU 87 3HD2 LEU 87 -21.472 23.292 8.175 710 HD22 LEU 87 1HD2 LEU 87 -21.155 23.349 6.441 711 HD23 LEU 87 2HD2 LEU 87 -20.039 24.122 7.567 712 H ARG 88 H ARG 88 -19.272 23.189 3.901 713 HA ARG 88 HA ARG 88 -18.586 21.663 1.479 714 HB2 ARG 88 1HB ARG 88 -20.128 23.430 0.972 715 HB3 ARG 88 2HB ARG 88 -19.172 24.597 1.876 716 HG2 ARG 88 1HG ARG 88 -17.473 24.623 0.245 717 HG3 ARG 88 2HG ARG 88 -18.111 23.182 -0.549 718 HD2 ARG 88 1HD ARG 88 -18.582 25.356 -1.719 719 HD3 ARG 88 2HD ARG 88 -19.996 24.362 -1.372 720 HE ARG 88 HE ARG 88 -19.450 26.311 0.661 721 HH11 ARG 88 1HH1 ARG 88 -20.990 25.750 -2.410 722 HH12 ARG 88 2HH1 ARG 88 -22.130 27.041 -2.221 723 HH21 ARG 88 1HH2 ARG 88 -20.946 28.013 0.922 724 HH22 ARG 88 2HH2 ARG 88 -22.104 28.328 -0.326 725 H GLU 89 H GLU 89 -16.513 21.147 1.328 726 HA GLU 89 HA GLU 89 -14.445 23.083 1.541 727 HB2 GLU 89 1HB GLU 89 -13.217 22.110 3.427 728 HB3 GLU 89 2HB GLU 89 -14.781 22.731 3.934 729 HG2 GLU 89 1HG GLU 89 -14.799 20.746 5.026 730 HG3 GLU 89 2HG GLU 89 -15.521 20.236 3.501 731 H ASP 90 H ASP 90 -12.781 22.477 0.295 732 HA ASP 90 HA ASP 90 -11.806 19.846 0.041 733 HB2 ASP 90 1HB ASP 90 -12.503 19.760 -2.510 734 HB3 ASP 90 2HB ASP 90 -13.559 19.114 -1.257 735 HA PRO 91 HA PRO 91 -8.406 21.970 -1.734 736 HB2 PRO 91 1HB PRO 91 -7.359 20.104 -3.406 737 HB3 PRO 91 2HB PRO 91 -7.245 19.989 -1.645 738 HG2 PRO 91 1HG PRO 91 -9.154 18.635 -3.512 739 HG3 PRO 91 2HG PRO 91 -8.288 17.965 -2.117 740 HD2 PRO 91 1HD PRO 91 -10.886 18.718 -1.995 741 HD3 PRO 91 2HD PRO 91 -9.790 18.843 -0.604 742 H ASP 92 H ASP 92 -7.248 22.066 -4.096 743 HA ASP 92 HA ASP 92 -9.388 22.805 -5.985 744 HB2 ASP 92 1HB ASP 92 -7.426 24.371 -6.851 745 HB3 ASP 92 2HB ASP 92 -8.489 24.869 -5.538 746 H ARG 93 H ARG 93 -5.860 22.294 -6.127 747 HA ARG 93 HA ARG 93 -6.010 19.988 -7.752 748 HB2 ARG 93 1HB ARG 93 -5.144 20.993 -9.862 749 HB3 ARG 93 2HB ARG 93 -6.796 21.461 -9.484 750 HG2 ARG 93 1HG ARG 93 -5.894 23.464 -10.133 751 HG3 ARG 93 2HG ARG 93 -5.659 23.533 -8.385 752 HD2 ARG 93 1HD ARG 93 -3.412 23.385 -8.551 753 HD3 ARG 93 2HD ARG 93 -3.483 22.271 -9.916 754 HE ARG 93 HE ARG 93 -3.167 25.094 -10.035 755 HH11 ARG 93 1HH1 ARG 93 -4.582 22.381 -11.695 756 HH12 ARG 93 2HH1 ARG 93 -4.526 23.138 -13.253 757 HH21 ARG 93 1HH2 ARG 93 -3.087 26.101 -12.080 758 HH22 ARG 93 2HH2 ARG 93 -3.674 25.253 -13.471 759 H GLN 94 H GLN 94 -3.811 19.496 -8.760 760 HA GLN 94 HA GLN 94 -1.736 20.409 -6.890 761 HB2 GLN 94 1HB GLN 94 -2.236 17.986 -6.889 762 HB3 GLN 94 2HB GLN 94 -1.802 17.911 -8.592 763 HG2 GLN 94 1HG GLN 94 0.027 17.108 -7.271 764 HG3 GLN 94 2HG GLN 94 0.478 18.643 -8.012 765 HE21 GLN 94 2HE2 GLN 94 -0.548 17.104 -5.033 766 HE22 GLN 94 1HE2 GLN 94 0.093 18.306 -3.970 767 H ASP 95 H ASP 95 -2.145 19.465 -10.300 768 HA ASP 95 HA ASP 95 -0.764 21.711 -11.299 769 HB2 ASP 95 1HB ASP 95 1.186 20.526 -10.333 770 HB3 ASP 95 2HB ASP 95 0.820 19.133 -11.347 771 H HIS 96 H HIS 96 -1.015 21.912 -13.491 772 HA HIS 96 HA HIS 96 -2.077 19.597 -14.955 773 HB2 HIS 96 1HB HIS 96 -3.908 21.166 -14.150 774 HB3 HIS 96 2HB HIS 96 -3.229 22.373 -15.239 775 HD1 HIS 96 HD1 HIS 96 -3.852 18.683 -15.903 776 HD2 HIS 96 HD2 HIS 96 -5.027 22.426 -17.270 777 HE1 HIS 96 HE1 HIS 96 -5.309 18.241 -17.904 778 H HIS 97 H HIS 97 -1.937 19.816 -17.300 779 HA HIS 97 HA HIS 97 -0.058 21.840 -18.260 780 HB2 HIS 97 1HB HIS 97 0.443 18.911 -18.125 781 HB3 HIS 97 2HB HIS 97 0.974 19.754 -19.578 782 HD1 HIS 97 HD1 HIS 97 1.971 22.375 -18.285 783 HD2 HIS 97 HD2 HIS 97 2.825 18.572 -16.846 784 HE1 HIS 97 HE1 HIS 97 4.083 22.623 -16.943 785 HA PRO 98 HA PRO 98 -2.515 21.890 -21.893 786 HB2 PRO 98 1HB PRO 98 -0.672 22.285 -23.846 787 HB3 PRO 98 2HB PRO 98 -1.134 23.543 -22.693 788 HG2 PRO 98 1HG PRO 98 1.255 21.738 -22.671 789 HG3 PRO 98 2HG PRO 98 1.160 23.474 -22.319 790 HD2 PRO 98 1HD PRO 98 1.279 21.596 -20.371 791 HD3 PRO 98 2HD PRO 98 0.398 23.124 -20.172 792 H GLY 99 H GLY 99 -3.334 19.784 -22.013 793 HA2 GLY 99 1HA GLY 99 -1.907 18.044 -23.922 794 HA3 GLY 99 2HA GLY 99 -2.630 17.384 -22.463 795 H SER 100 H SER 100 -3.103 18.043 -25.713 796 HA SER 100 HA SER 100 -6.012 17.668 -25.420 797 HB2 SER 100 1HB SER 100 -5.920 18.779 -27.843 798 HB3 SER 100 2HB SER 100 -6.003 19.756 -26.377 799 HG SER 100 HG SER 100 -4.327 20.593 -27.488 800 H GLY 101 H GLY 101 -6.986 16.124 -26.664 801 HA2 GLY 101 1HA GLY 101 -5.669 14.885 -28.892 802 HA3 GLY 101 2HA GLY 101 -5.641 13.875 -27.454 803 H ALA 102 H ALA 102 -7.168 14.128 -30.230 804 HA ALA 102 HA ALA 102 -9.410 12.610 -29.425 805 HB1 ALA 102 1HB ALA 102 -11.175 14.252 -30.101 806 HB2 ALA 102 2HB ALA 102 -10.341 14.641 -28.596 807 HB3 ALA 102 3HB ALA 102 -9.932 15.503 -30.079 808 H GLN 103 H GLN 103 -11.022 12.405 -31.322 809 HA GLN 103 HA GLN 103 -9.475 12.431 -33.829 810 HB2 GLN 103 1HB GLN 103 -9.916 10.168 -33.037 811 HB3 GLN 103 2HB GLN 103 -11.636 10.517 -32.933 812 HG2 GLN 103 1HG GLN 103 -11.844 10.660 -35.284 813 HG3 GLN 103 2HG GLN 103 -10.095 10.663 -35.505 814 HE21 GLN 103 2HE2 GLN 103 -12.373 8.634 -33.690 815 HE22 GLN 103 1HE2 GLN 103 -11.827 7.134 -34.350 Start of MODEL 4 1 H1 GLY 1 H GLY 1 7.780 21.638 -13.306 2 HA2 GLY 1 1HA GLY 1 9.044 21.558 -11.312 3 HA3 GLY 1 2HA GLY 1 7.442 22.008 -10.747 4 H SER 2 H SER 2 5.953 20.048 -10.381 5 HA SER 2 HA SER 2 7.486 17.818 -9.229 6 HB2 SER 2 1HB SER 2 5.264 19.384 -7.906 7 HB3 SER 2 2HB SER 2 5.830 17.819 -7.321 8 HG SER 2 HG SER 2 7.218 19.000 -6.267 9 H LEU 3 H LEU 3 6.268 17.769 -11.727 10 HA LEU 3 HA LEU 3 4.018 15.930 -11.242 11 HB2 LEU 3 1HB LEU 3 2.999 16.648 -13.304 12 HB3 LEU 3 2HB LEU 3 3.258 18.035 -12.248 13 HG LEU 3 HG LEU 3 5.466 18.253 -13.709 14 HD11 LEU 3 1HD1 LEU 3 3.795 17.515 -15.977 15 HD12 LEU 3 2HD1 LEU 3 4.272 16.137 -14.986 16 HD13 LEU 3 3HD1 LEU 3 5.503 17.197 -15.673 17 HD21 LEU 3 3HD2 LEU 3 3.956 20.055 -13.523 18 HD22 LEU 3 1HD2 LEU 3 2.683 19.179 -14.373 19 HD23 LEU 3 2HD2 LEU 3 4.107 19.737 -15.252 20 H VAL 4 H VAL 4 4.009 14.019 -12.353 21 HA VAL 4 HA VAL 4 6.379 13.475 -14.020 22 HB VAL 4 HB VAL 4 5.935 11.041 -13.352 23 HG11 VAL 4 1HG1 VAL 4 7.620 11.249 -11.884 24 HG12 VAL 4 2HG1 VAL 4 7.575 12.957 -12.329 25 HG13 VAL 4 3HG1 VAL 4 6.736 12.399 -10.881 26 HG21 VAL 4 3HG2 VAL 4 4.448 12.377 -11.095 27 HG22 VAL 4 1HG2 VAL 4 3.680 11.492 -12.413 28 HG23 VAL 4 2HG2 VAL 4 4.753 10.652 -11.294 29 HA PRO 5 HA PRO 5 3.804 12.366 -17.397 30 HB2 PRO 5 1HB PRO 5 5.226 10.343 -18.520 31 HB3 PRO 5 2HB PRO 5 5.729 12.036 -18.608 32 HG2 PRO 5 1HG PRO 5 6.673 9.873 -16.767 33 HG3 PRO 5 2HG PRO 5 7.618 11.102 -17.627 34 HD2 PRO 5 1HD PRO 5 6.969 11.331 -15.008 35 HD3 PRO 5 2HD PRO 5 7.134 12.739 -16.078 36 H ARG 6 H ARG 6 2.036 11.564 -16.099 37 HA ARG 6 HA ARG 6 1.807 8.634 -16.230 38 HB2 ARG 6 1HB ARG 6 0.481 8.713 -14.125 39 HB3 ARG 6 2HB ARG 6 2.166 9.169 -13.909 40 HG2 ARG 6 1HG ARG 6 1.536 11.524 -13.890 41 HG3 ARG 6 2HG ARG 6 -0.155 11.076 -14.128 42 HD2 ARG 6 1HD ARG 6 1.565 10.318 -11.769 43 HD3 ARG 6 2HD ARG 6 0.321 11.567 -11.781 44 HE ARG 6 HE ARG 6 -0.895 9.212 -12.593 45 HH11 ARG 6 1HH1 ARG 6 0.722 10.441 -9.765 46 HH12 ARG 6 2HH1 ARG 6 -0.179 9.454 -8.662 47 HH21 ARG 6 1HH2 ARG 6 -2.087 7.909 -11.150 48 HH22 ARG 6 2HH2 ARG 6 -1.776 8.014 -9.451 49 H GLY 7 H GLY 7 -0.612 8.006 -15.884 50 HA2 GLY 7 1HA GLY 7 -2.129 9.607 -17.812 51 HA3 GLY 7 2HA GLY 7 -2.481 7.952 -17.336 52 H SER 8 H SER 8 -4.143 10.449 -17.431 53 HA SER 8 HA SER 8 -5.711 9.955 -15.151 54 HB2 SER 8 1HB SER 8 -5.383 12.133 -13.974 55 HB3 SER 8 2HB SER 8 -3.970 11.081 -13.897 56 HG SER 8 HG SER 8 -4.362 13.436 -15.382 57 H MET 9 H MET 9 -7.679 11.074 -15.190 58 HA MET 9 HA MET 9 -8.066 13.094 -17.259 59 HB2 MET 9 1HB MET 9 -8.566 11.117 -18.495 60 HB3 MET 9 2HB MET 9 -9.506 10.446 -17.169 61 HG2 MET 9 1HG MET 9 -11.241 12.055 -17.495 62 HG3 MET 9 2HG MET 9 -10.271 12.932 -18.675 63 HE1 MET 9 3HE MET 9 -10.603 8.951 -18.444 64 HE2 MET 9 1HE MET 9 -12.106 9.640 -17.827 65 HE3 MET 9 2HE MET 9 -12.102 8.756 -19.354 66 H GLN 10 H GLN 10 -9.531 14.611 -16.704 67 HA GLN 10 HA GLN 10 -10.856 14.288 -14.114 68 HB2 GLN 10 1HB GLN 10 -11.116 16.715 -14.141 69 HB3 GLN 10 2HB GLN 10 -9.437 16.268 -14.415 70 HG2 GLN 10 1HG GLN 10 -10.962 16.560 -16.878 71 HG3 GLN 10 2HG GLN 10 -10.901 18.033 -15.912 72 HE21 GLN 10 2HE2 GLN 10 -8.981 19.105 -15.662 73 HE22 GLN 10 1HE2 GLN 10 -7.553 18.707 -16.549 74 H ILE 11 H ILE 11 -13.053 14.618 -13.820 75 HA ILE 11 HA ILE 11 -14.684 14.886 -16.251 76 HB ILE 11 HB ILE 11 -16.208 13.171 -15.520 77 HG12 ILE 11 1HG1 ILE 11 -14.361 12.827 -13.148 78 HG13 ILE 11 2HG1 ILE 11 -15.990 13.491 -13.099 79 HG21 ILE 11 1HG2 ILE 11 -13.381 12.135 -15.365 80 HG22 ILE 11 2HG2 ILE 11 -14.817 11.207 -15.794 81 HG23 ILE 11 3HG2 ILE 11 -14.252 12.498 -16.854 82 HD11 ILE 11 3HD1 ILE 11 -15.952 11.195 -12.325 83 HD12 ILE 11 1HD1 ILE 11 -16.887 11.339 -13.813 84 HD13 ILE 11 2HD1 ILE 11 -15.254 10.675 -13.858 85 H PHE 12 H PHE 12 -17.052 15.267 -15.644 86 HA PHE 12 HA PHE 12 -17.133 17.166 -13.395 87 HB2 PHE 12 1HB PHE 12 -18.780 17.141 -15.933 88 HB3 PHE 12 2HB PHE 12 -18.942 18.311 -14.628 89 HD1 PHE 12 HD2 PHE 12 -16.876 19.717 -14.054 90 HD2 PHE 12 HD1 PHE 12 -17.304 17.526 -17.677 91 HE1 PHE 12 HE2 PHE 12 -15.160 21.131 -15.107 92 HE2 PHE 12 HE1 PHE 12 -15.588 18.936 -18.737 93 HZ PHE 12 HZ PHE 12 -14.515 20.742 -17.452 94 H VAL 13 H VAL 13 -18.530 16.823 -11.784 95 HA VAL 13 HA VAL 13 -20.694 14.867 -12.199 96 HB VAL 13 HB VAL 13 -19.110 15.131 -9.643 97 HG11 VAL 13 1HG1 VAL 13 -20.394 12.631 -9.903 98 HG12 VAL 13 2HG1 VAL 13 -20.753 13.927 -8.760 99 HG13 VAL 13 3HG1 VAL 13 -21.580 13.869 -10.317 100 HG21 VAL 13 3HG2 VAL 13 -17.489 14.077 -10.794 101 HG22 VAL 13 1HG2 VAL 13 -18.517 12.659 -10.586 102 HG23 VAL 13 2HG2 VAL 13 -18.584 13.584 -12.086 103 H LYS 14 H LYS 14 -22.635 15.293 -11.209 104 HA LYS 14 HA LYS 14 -22.893 17.978 -10.041 105 HB2 LYS 14 1HB LYS 14 -24.721 16.239 -11.645 106 HB3 LYS 14 2HB LYS 14 -25.421 17.413 -10.539 107 HG2 LYS 14 1HG LYS 14 -25.305 18.417 -12.689 108 HG3 LYS 14 2HG LYS 14 -24.075 19.178 -11.678 109 HD2 LYS 14 1HD LYS 14 -22.331 17.985 -12.733 110 HD3 LYS 14 2HD LYS 14 -23.459 16.867 -13.504 111 HE2 LYS 14 1HE LYS 14 -24.147 18.447 -15.066 112 HE3 LYS 14 2HE LYS 14 -23.578 19.801 -14.091 113 HZ1 LYS 14 3HZ LYS 14 -21.556 19.678 -14.987 114 HZ2 LYS 14 1HZ LYS 14 -22.256 18.709 -16.185 115 HZ3 LYS 14 2HZ LYS 14 -21.484 17.992 -14.861 116 H THR 15 H THR 15 -23.632 18.264 -8.016 117 HA THR 15 HA THR 15 -24.070 15.876 -6.397 118 HB THR 15 HB THR 15 -23.891 17.379 -4.459 119 HG1 THR 15 HG1 THR 15 -23.125 19.514 -6.109 120 HG21 THR 15 3HG2 THR 15 -21.782 16.625 -4.885 121 HG22 THR 15 1HG2 THR 15 -21.511 18.339 -5.192 122 HG23 THR 15 2HG2 THR 15 -21.779 17.234 -6.540 123 H LEU 16 H LEU 16 -25.768 16.047 -4.651 124 HA LEU 16 HA LEU 16 -28.308 16.420 -5.858 125 HB2 LEU 16 1HB LEU 16 -29.228 15.754 -3.742 126 HB3 LEU 16 2HB LEU 16 -27.843 14.734 -4.127 127 HG LEU 16 HG LEU 16 -26.581 16.482 -2.595 128 HD11 LEU 16 1HD1 LEU 16 -28.679 16.590 -0.736 129 HD12 LEU 16 2HD1 LEU 16 -29.336 17.190 -2.259 130 HD13 LEU 16 3HD1 LEU 16 -27.897 17.937 -1.564 131 HD21 LEU 16 3HD2 LEU 16 -26.817 14.028 -2.264 132 HD22 LEU 16 1HD2 LEU 16 -28.338 14.331 -1.423 133 HD23 LEU 16 2HD2 LEU 16 -26.826 14.954 -0.762 134 H THR 17 H THR 17 -26.312 18.374 -3.758 135 HA THR 17 HA THR 17 -28.313 20.225 -2.973 136 HB THR 17 HB THR 17 -26.273 20.076 -1.690 137 HG1 THR 17 HG1 THR 17 -26.760 22.111 -1.351 138 HG21 THR 17 3HG2 THR 17 -24.160 21.084 -2.736 139 HG22 THR 17 1HG2 THR 17 -24.954 20.817 -4.287 140 HG23 THR 17 2HG2 THR 17 -24.610 19.451 -3.226 141 H GLY 18 H GLY 18 -26.425 19.837 -5.845 142 HA2 GLY 18 1HA GLY 18 -27.233 20.903 -7.869 143 HA3 GLY 18 2HA GLY 18 -27.622 22.318 -6.902 144 H LYS 19 H LYS 19 -24.640 20.732 -6.250 145 HA LYS 19 HA LYS 19 -23.213 22.957 -7.544 146 HB2 LYS 19 1HB LYS 19 -22.855 22.955 -5.173 147 HB3 LYS 19 2HB LYS 19 -22.490 21.234 -5.172 148 HG2 LYS 19 1HG LYS 19 -20.767 22.921 -6.867 149 HG3 LYS 19 2HG LYS 19 -20.620 23.152 -5.123 150 HD2 LYS 19 1HD LYS 19 -20.648 20.368 -6.163 151 HD3 LYS 19 2HD LYS 19 -19.193 21.333 -6.424 152 HE2 LYS 19 1HE LYS 19 -20.425 21.251 -3.708 153 HE3 LYS 19 2HE LYS 19 -19.473 19.874 -4.260 154 HZ1 LYS 19 3HZ LYS 19 -18.162 21.527 -3.021 155 HZ2 LYS 19 1HZ LYS 19 -18.499 22.679 -4.214 156 HZ3 LYS 19 2HZ LYS 19 -17.594 21.303 -4.598 157 H THR 20 H THR 20 -21.568 22.577 -8.955 158 HA THR 20 HA THR 20 -21.264 19.808 -9.866 159 HB THR 20 HB THR 20 -20.086 22.123 -11.347 160 HG1 THR 20 HG1 THR 20 -22.231 22.228 -12.416 161 HG21 THR 20 3HG2 THR 20 -20.942 19.350 -11.891 162 HG22 THR 20 1HG2 THR 20 -19.613 20.281 -12.578 163 HG23 THR 20 2HG2 THR 20 -21.256 20.521 -13.171 164 H ILE 21 H ILE 21 -19.561 18.709 -9.173 165 HA ILE 21 HA ILE 21 -17.079 20.184 -8.577 166 HB ILE 21 HB ILE 21 -17.947 19.244 -6.544 167 HG12 ILE 21 1HG1 ILE 21 -15.427 18.885 -7.392 168 HG13 ILE 21 2HG1 ILE 21 -15.982 18.341 -5.813 169 HG21 ILE 21 1HG2 ILE 21 -19.443 17.581 -7.356 170 HG22 ILE 21 2HG2 ILE 21 -18.126 16.672 -8.097 171 HG23 ILE 21 3HG2 ILE 21 -18.255 16.763 -6.341 172 HD11 ILE 21 3HD1 ILE 21 -16.071 16.122 -6.472 173 HD12 ILE 21 1HD1 ILE 21 -16.115 16.531 -8.187 174 HD13 ILE 21 2HD1 ILE 21 -14.621 16.729 -7.270 175 H THR 22 H THR 22 -15.242 19.576 -9.566 176 HA THR 22 HA THR 22 -15.428 17.529 -11.623 177 HB THR 22 HB THR 22 -13.082 19.331 -11.008 178 HG1 THR 22 HG1 THR 22 -14.776 20.669 -11.546 179 HG21 THR 22 3HG2 THR 22 -12.162 18.657 -13.004 180 HG22 THR 22 1HG2 THR 22 -13.722 18.222 -13.701 181 HG23 THR 22 2HG2 THR 22 -12.965 17.167 -12.508 182 H LEU 23 H LEU 23 -14.670 15.531 -11.406 183 HA LEU 23 HA LEU 23 -12.867 14.959 -9.152 184 HB2 LEU 23 1HB LEU 23 -15.237 13.889 -9.439 185 HB3 LEU 23 2HB LEU 23 -14.407 12.845 -10.591 186 HG LEU 23 HG LEU 23 -12.860 12.157 -8.775 187 HD11 LEU 23 1HD1 LEU 23 -12.763 13.658 -7.095 188 HD12 LEU 23 2HD1 LEU 23 -14.076 12.681 -6.440 189 HD13 LEU 23 3HD1 LEU 23 -14.437 14.172 -7.309 190 HD21 LEU 23 3HD2 LEU 23 -14.391 10.512 -8.961 191 HD22 LEU 23 1HD2 LEU 23 -15.757 11.622 -8.848 192 HD23 LEU 23 2HD2 LEU 23 -14.915 11.110 -7.385 193 H GLU 24 H GLU 24 -11.236 13.302 -9.469 194 HA GLU 24 HA GLU 24 -10.261 13.251 -12.248 195 HB2 GLU 24 1HB GLU 24 -8.860 13.486 -9.619 196 HB3 GLU 24 2HB GLU 24 -8.026 12.704 -10.954 197 HG2 GLU 24 1HG GLU 24 -8.307 14.701 -12.317 198 HG3 GLU 24 2HG GLU 24 -9.170 15.488 -10.996 199 H VAL 25 H VAL 25 -10.429 11.348 -13.211 200 HA VAL 25 HA VAL 25 -9.805 8.916 -11.719 201 HB VAL 25 HB VAL 25 -12.217 9.050 -11.529 202 HG11 VAL 25 1HG1 VAL 25 -13.554 9.854 -13.117 203 HG12 VAL 25 2HG1 VAL 25 -12.098 10.270 -14.023 204 HG13 VAL 25 3HG1 VAL 25 -12.913 8.734 -14.318 205 HG21 VAL 25 3HG2 VAL 25 -12.587 6.871 -12.028 206 HG22 VAL 25 1HG2 VAL 25 -11.995 7.036 -13.681 207 HG23 VAL 25 2HG2 VAL 25 -10.853 6.890 -12.345 208 H GLU 26 H GLU 26 -8.995 7.246 -12.972 209 HA GLU 26 HA GLU 26 -7.923 8.034 -15.525 210 HB2 GLU 26 1HB GLU 26 -7.737 5.279 -14.331 211 HB3 GLU 26 2HB GLU 26 -6.615 6.074 -15.425 212 HG2 GLU 26 1HG GLU 26 -5.977 7.625 -13.655 213 HG3 GLU 26 2HG GLU 26 -7.108 6.837 -12.556 214 HA PRO 27 HA PRO 27 -10.901 6.239 -18.204 215 HB2 PRO 27 1HB PRO 27 -9.329 5.410 -20.256 216 HB3 PRO 27 2HB PRO 27 -9.683 7.114 -19.945 217 HG2 PRO 27 1HG PRO 27 -7.255 5.521 -19.220 218 HG3 PRO 27 2HG PRO 27 -7.359 7.164 -19.878 219 HD2 PRO 27 1HD PRO 27 -6.938 6.672 -17.249 220 HD3 PRO 27 2HD PRO 27 -7.836 8.092 -17.823 221 H SER 28 H SER 28 -8.306 4.341 -16.947 222 HA SER 28 HA SER 28 -9.558 1.853 -17.872 223 HB2 SER 28 1HB SER 28 -7.345 0.963 -16.663 224 HB3 SER 28 2HB SER 28 -7.332 1.548 -18.327 225 HG SER 28 HG SER 28 -5.837 2.828 -17.565 226 H ASP 29 H ASP 29 -9.334 3.875 -15.169 227 HA ASP 29 HA ASP 29 -9.475 1.970 -13.080 228 HB2 ASP 29 1HB ASP 29 -10.008 4.891 -13.342 229 HB3 ASP 29 2HB ASP 29 -10.660 4.060 -11.933 230 H THR 30 H THR 30 -11.446 1.902 -11.583 231 HA THR 30 HA THR 30 -13.858 1.499 -13.230 232 HB THR 30 HB THR 30 -14.504 -0.140 -11.357 233 HG1 THR 30 HG1 THR 30 -11.684 -0.078 -10.942 234 HG21 THR 30 3HG2 THR 30 -13.241 -0.486 -13.766 235 HG22 THR 30 1HG2 THR 30 -13.893 -1.782 -12.763 236 HG23 THR 30 2HG2 THR 30 -12.184 -1.360 -12.657 237 H ILE 31 H ILE 31 -15.903 1.474 -11.800 238 HA ILE 31 HA ILE 31 -16.374 4.012 -10.814 239 HB ILE 31 HB ILE 31 -17.823 1.494 -9.987 240 HG12 ILE 31 1HG1 ILE 31 -17.762 1.685 -12.410 241 HG13 ILE 31 2HG1 ILE 31 -19.379 2.066 -11.831 242 HG21 ILE 31 1HG2 ILE 31 -19.575 3.674 -10.149 243 HG22 ILE 31 2HG2 ILE 31 -19.032 2.835 -8.697 244 HG23 ILE 31 3HG2 ILE 31 -18.158 4.254 -9.274 245 HD11 ILE 31 3HD1 ILE 31 -19.028 3.704 -13.398 246 HD12 ILE 31 1HD1 ILE 31 -18.537 4.520 -11.914 247 HD13 ILE 31 2HD1 ILE 31 -17.316 3.864 -13.005 248 H GLU 32 H GLU 32 -15.510 1.074 -9.026 249 HA GLU 32 HA GLU 32 -15.762 1.996 -6.435 250 HB2 GLU 32 1HB GLU 32 -13.967 0.347 -5.866 251 HB3 GLU 32 2HB GLU 32 -15.276 -0.313 -6.836 252 HG2 GLU 32 1HG GLU 32 -13.950 -0.341 -8.787 253 HG3 GLU 32 2HG GLU 32 -12.701 0.652 -8.038 254 H ASN 33 H ASN 33 -13.235 2.624 -8.776 255 HA ASN 33 HA ASN 33 -11.447 3.843 -6.890 256 HB2 ASN 33 1HB ASN 33 -11.405 3.119 -9.693 257 HB3 ASN 33 2HB ASN 33 -10.768 4.744 -9.456 258 HD21 ASN 33 2HD2 ASN 33 -8.801 5.008 -8.564 259 HD22 ASN 33 1HD2 ASN 33 -7.780 3.710 -8.056 260 H VAL 34 H VAL 34 -14.032 4.908 -8.970 261 HA VAL 34 HA VAL 34 -13.438 7.668 -9.002 262 HB VAL 34 HB VAL 34 -16.125 6.305 -9.235 263 HG11 VAL 34 1HG1 VAL 34 -16.329 8.677 -8.673 264 HG12 VAL 34 2HG1 VAL 34 -15.287 9.091 -10.036 265 HG13 VAL 34 3HG1 VAL 34 -16.866 8.358 -10.322 266 HG21 VAL 34 3HG2 VAL 34 -14.818 7.402 -11.624 267 HG22 VAL 34 1HG2 VAL 34 -14.003 6.013 -10.904 268 HG23 VAL 34 2HG2 VAL 34 -15.690 5.885 -11.401 269 H LYS 35 H LYS 35 -15.771 5.838 -7.018 270 HA LYS 35 HA LYS 35 -16.639 7.917 -5.406 271 HB2 LYS 35 1HB LYS 35 -17.513 6.286 -3.957 272 HB3 LYS 35 2HB LYS 35 -17.497 5.508 -5.534 273 HG2 LYS 35 1HG LYS 35 -15.111 4.707 -4.672 274 HG3 LYS 35 2HG LYS 35 -15.903 4.927 -3.110 275 HD2 LYS 35 1HD LYS 35 -17.730 3.462 -3.837 276 HD3 LYS 35 2HD LYS 35 -16.928 3.239 -5.394 277 HE2 LYS 35 1HE LYS 35 -14.957 2.329 -4.138 278 HE3 LYS 35 2HE LYS 35 -15.945 2.375 -2.679 279 HZ1 LYS 35 3HZ LYS 35 -17.233 0.656 -3.383 280 HZ2 LYS 35 1HZ LYS 35 -15.791 0.231 -4.160 281 HZ3 LYS 35 2HZ LYS 35 -17.024 1.000 -5.026 282 H ALA 36 H ALA 36 -13.649 6.152 -5.328 283 HA ALA 36 HA ALA 36 -12.792 6.596 -2.726 284 HB1 ALA 36 1HB ALA 36 -11.683 5.558 -5.044 285 HB2 ALA 36 2HB ALA 36 -10.633 6.913 -4.628 286 HB3 ALA 36 3HB ALA 36 -10.924 5.630 -3.454 287 H LYS 37 H LYS 37 -12.588 8.717 -5.552 288 HA LYS 37 HA LYS 37 -11.158 10.776 -4.161 289 HB2 LYS 37 1HB LYS 37 -12.682 10.910 -6.770 290 HB3 LYS 37 2HB LYS 37 -11.544 12.113 -6.178 291 HG2 LYS 37 1HG LYS 37 -10.804 9.256 -6.758 292 HG3 LYS 37 2HG LYS 37 -10.636 10.576 -7.917 293 HD2 LYS 37 1HD LYS 37 -9.443 10.923 -5.215 294 HD3 LYS 37 2HD LYS 37 -8.637 9.833 -6.346 295 HE2 LYS 37 1HE LYS 37 -9.452 12.588 -7.190 296 HE3 LYS 37 2HE LYS 37 -7.956 12.329 -6.295 297 HZ1 LYS 37 3HZ LYS 37 -7.450 12.285 -8.602 298 HZ2 LYS 37 1HZ LYS 37 -8.689 11.180 -8.929 299 HZ3 LYS 37 2HZ LYS 37 -7.335 10.693 -8.041 300 H ILE 38 H ILE 38 -14.505 10.000 -4.740 301 HA ILE 38 HA ILE 38 -15.651 12.506 -4.185 302 HB ILE 38 HB ILE 38 -16.800 9.750 -3.727 303 HG12 ILE 38 1HG1 ILE 38 -16.198 10.143 -6.058 304 HG13 ILE 38 2HG1 ILE 38 -17.949 10.156 -5.878 305 HG21 ILE 38 1HG2 ILE 38 -18.115 12.461 -3.760 306 HG22 ILE 38 2HG2 ILE 38 -18.992 10.934 -3.845 307 HG23 ILE 38 3HG2 ILE 38 -18.037 11.323 -2.415 308 HD11 ILE 38 3HD1 ILE 38 -17.672 12.715 -5.696 309 HD12 ILE 38 1HD1 ILE 38 -16.089 12.427 -6.419 310 HD13 ILE 38 2HD1 ILE 38 -17.553 11.945 -7.278 311 H GLN 39 H GLN 39 -14.419 9.987 -2.112 312 HA GLN 39 HA GLN 39 -15.661 10.593 0.291 313 HB2 GLN 39 1HB GLN 39 -12.901 9.552 -0.318 314 HB3 GLN 39 2HB GLN 39 -13.484 9.743 1.330 315 HG2 GLN 39 1HG GLN 39 -15.471 8.302 0.571 316 HG3 GLN 39 2HG GLN 39 -14.447 7.878 -0.800 317 HE21 GLN 39 2HE2 GLN 39 -12.105 7.338 -0.026 318 HE22 GLN 39 1HE2 GLN 39 -12.024 6.200 1.270 319 H ASP 40 H ASP 40 -13.022 12.213 -1.342 320 HA ASP 40 HA ASP 40 -12.348 13.889 0.891 321 HB2 ASP 40 1HB ASP 40 -10.765 13.227 -0.970 322 HB3 ASP 40 2HB ASP 40 -11.642 14.345 -2.010 323 H LYS 41 H LYS 41 -14.645 13.976 -1.673 324 HA LYS 41 HA LYS 41 -15.081 16.828 -1.543 325 HB2 LYS 41 1HB LYS 41 -16.919 14.818 -2.826 326 HB3 LYS 41 2HB LYS 41 -16.706 16.516 -3.233 327 HG2 LYS 41 1HG LYS 41 -14.621 14.380 -3.630 328 HG3 LYS 41 2HG LYS 41 -15.707 14.983 -4.884 329 HD2 LYS 41 1HD LYS 41 -14.727 17.128 -4.842 330 HD3 LYS 41 2HD LYS 41 -13.893 16.803 -3.320 331 HE2 LYS 41 1HE LYS 41 -12.550 15.075 -4.494 332 HE3 LYS 41 2HE LYS 41 -13.321 15.553 -6.005 333 HZ1 LYS 41 3HZ LYS 41 -11.982 17.301 -6.192 334 HZ2 LYS 41 1HZ LYS 41 -11.045 16.622 -4.958 335 HZ3 LYS 41 2HZ LYS 41 -12.220 17.780 -4.587 336 H GLU 42 H GLU 42 -16.923 13.918 -0.638 337 HA GLU 42 HA GLU 42 -18.438 15.592 1.257 338 HB2 GLU 42 1HB GLU 42 -19.385 13.256 -0.403 339 HB3 GLU 42 2HB GLU 42 -20.295 13.901 0.956 340 HG2 GLU 42 1HG GLU 42 -19.530 15.402 -1.538 341 HG3 GLU 42 2HG GLU 42 -21.129 14.770 -1.149 342 H GLY 43 H GLY 43 -16.919 12.485 0.623 343 HA2 GLY 43 1HA GLY 43 -15.927 11.022 2.111 344 HA3 GLY 43 2HA GLY 43 -16.337 12.132 3.410 345 H ILE 44 H ILE 44 -18.069 10.026 1.108 346 HA ILE 44 HA ILE 44 -19.629 9.008 3.391 347 HB ILE 44 HB ILE 44 -21.507 8.660 1.727 348 HG12 ILE 44 1HG1 ILE 44 -19.845 10.609 0.115 349 HG13 ILE 44 2HG1 ILE 44 -20.180 8.936 -0.319 350 HG21 ILE 44 1HG2 ILE 44 -20.768 10.896 3.256 351 HG22 ILE 44 2HG2 ILE 44 -21.403 11.523 1.736 352 HG23 ILE 44 3HG2 ILE 44 -22.386 10.440 2.721 353 HD11 ILE 44 3HD1 ILE 44 -22.522 9.431 -0.575 354 HD12 ILE 44 1HD1 ILE 44 -22.264 11.084 -0.016 355 HD13 ILE 44 2HD1 ILE 44 -21.566 10.551 -1.546 356 HA PRO 45 HA PRO 45 -18.445 4.960 2.162 357 HB2 PRO 45 1HB PRO 45 -20.602 3.535 2.991 358 HB3 PRO 45 2HB PRO 45 -19.419 4.225 4.109 359 HG2 PRO 45 1HG PRO 45 -22.108 5.272 3.314 360 HG3 PRO 45 2HG PRO 45 -21.364 5.206 4.922 361 HD2 PRO 45 1HD PRO 45 -21.425 7.469 3.438 362 HD3 PRO 45 2HD PRO 45 -20.094 7.093 4.551 363 HA PRO 46 HA PRO 46 -20.188 3.851 -1.720 364 HB2 PRO 46 1HB PRO 46 -19.969 1.145 -1.701 365 HB3 PRO 46 2HB PRO 46 -18.576 2.220 -1.869 366 HG2 PRO 46 1HG PRO 46 -19.596 0.806 0.565 367 HG3 PRO 46 2HG PRO 46 -17.926 1.002 0.003 368 HD2 PRO 46 1HD PRO 46 -18.988 2.529 1.970 369 HD3 PRO 46 2HD PRO 46 -17.760 3.142 0.844 370 H ASP 47 H ASP 47 -21.488 2.262 1.128 371 HA ASP 47 HA ASP 47 -23.747 1.086 -0.107 372 HB2 ASP 47 1HB ASP 47 -23.406 1.959 2.771 373 HB3 ASP 47 2HB ASP 47 -24.623 0.838 2.165 374 H GLN 48 H GLN 48 -23.173 4.231 1.377 375 HA GLN 48 HA GLN 48 -25.935 5.034 0.924 376 HB2 GLN 48 1HB GLN 48 -23.602 6.210 2.377 377 HB3 GLN 48 2HB GLN 48 -24.915 7.266 1.874 378 HG2 GLN 48 1HG GLN 48 -25.231 6.540 4.157 379 HG3 GLN 48 2HG GLN 48 -26.501 5.890 3.120 380 HE21 GLN 48 2HE2 GLN 48 -26.996 4.176 4.429 381 HE22 GLN 48 1HE2 GLN 48 -25.929 2.842 4.686 382 H GLN 49 H GLN 49 -22.807 5.368 -0.506 383 HA GLN 49 HA GLN 49 -23.629 7.590 -2.194 384 HB2 GLN 49 1HB GLN 49 -21.286 7.269 -1.172 385 HB3 GLN 49 2HB GLN 49 -21.047 6.068 -2.435 386 HG2 GLN 49 1HG GLN 49 -21.551 7.805 -4.121 387 HG3 GLN 49 2HG GLN 49 -21.650 8.990 -2.820 388 HE21 GLN 49 2HE2 GLN 49 -19.793 8.488 -5.185 389 HE22 GLN 49 1HE2 GLN 49 -18.213 8.614 -4.498 390 H ARG 50 H ARG 50 -23.886 7.484 -4.416 391 HA ARG 50 HA ARG 50 -23.566 4.984 -5.821 392 HB2 ARG 50 1HB ARG 50 -26.238 6.008 -4.985 393 HB3 ARG 50 2HB ARG 50 -26.092 5.298 -6.588 394 HG2 ARG 50 1HG ARG 50 -24.831 3.436 -5.063 395 HG3 ARG 50 2HG ARG 50 -26.069 4.027 -3.952 396 HD2 ARG 50 1HD ARG 50 -27.312 2.448 -4.999 397 HD3 ARG 50 2HD ARG 50 -27.566 3.762 -6.147 398 HE ARG 50 HE ARG 50 -26.435 2.538 -7.701 399 HH11 ARG 50 1HH1 ARG 50 -25.567 1.381 -4.534 400 HH12 ARG 50 2HH1 ARG 50 -24.610 0.067 -5.134 401 HH21 ARG 50 1HH2 ARG 50 -25.178 0.812 -8.503 402 HH22 ARG 50 2HH2 ARG 50 -24.388 -0.255 -7.392 403 H LEU 51 H LEU 51 -23.006 5.386 -7.865 404 HA LEU 51 HA LEU 51 -23.291 8.120 -8.863 405 HB2 LEU 51 1HB LEU 51 -21.613 5.797 -9.791 406 HB3 LEU 51 2HB LEU 51 -21.683 7.353 -10.616 407 HG LEU 51 HG LEU 51 -20.591 6.801 -7.860 408 HD11 LEU 51 1HD1 LEU 51 -19.068 6.150 -9.594 409 HD12 LEU 51 2HD1 LEU 51 -18.501 7.661 -8.884 410 HD13 LEU 51 3HD1 LEU 51 -19.317 7.674 -10.447 411 HD21 LEU 51 3HD2 LEU 51 -21.355 9.333 -9.224 412 HD22 LEU 51 1HD2 LEU 51 -19.895 9.314 -8.235 413 HD23 LEU 51 2HD2 LEU 51 -21.450 8.892 -7.518 414 H ILE 52 H ILE 52 -24.393 8.646 -10.694 415 HA ILE 52 HA ILE 52 -25.903 6.470 -11.990 416 HB ILE 52 HB ILE 52 -26.789 9.347 -11.811 417 HG12 ILE 52 1HG1 ILE 52 -26.674 8.426 -9.552 418 HG13 ILE 52 2HG1 ILE 52 -28.353 8.597 -10.053 419 HG21 ILE 52 1HG2 ILE 52 -29.018 7.850 -12.138 420 HG22 ILE 52 2HG2 ILE 52 -28.110 8.579 -13.461 421 HG23 ILE 52 3HG2 ILE 52 -27.840 6.890 -13.033 422 HD11 ILE 52 3HD1 ILE 52 -27.890 6.500 -8.845 423 HD12 ILE 52 1HD1 ILE 52 -28.518 6.240 -10.473 424 HD13 ILE 52 2HD1 ILE 52 -26.798 6.025 -10.146 425 H PHE 53 H PHE 53 -26.028 6.417 -14.200 426 HA PHE 53 HA PHE 53 -24.758 8.561 -15.730 427 HB2 PHE 53 1HB PHE 53 -23.020 6.834 -15.243 428 HB3 PHE 53 2HB PHE 53 -24.012 5.653 -16.091 429 HD1 PHE 53 HD2 PHE 53 -21.845 8.573 -16.445 430 HD2 PHE 53 HD1 PHE 53 -24.223 5.699 -18.495 431 HE1 PHE 53 HE2 PHE 53 -20.791 9.222 -18.571 432 HE2 PHE 53 HE1 PHE 53 -23.171 6.342 -20.624 433 HZ PHE 53 HZ PHE 53 -21.454 8.107 -20.664 434 H ALA 54 H ALA 54 -26.127 9.146 -17.266 435 HA ALA 54 HA ALA 54 -27.832 9.113 -18.778 436 HB1 ALA 54 1HB ALA 54 -27.345 6.311 -19.554 437 HB2 ALA 54 2HB ALA 54 -27.427 7.769 -20.545 438 HB3 ALA 54 3HB ALA 54 -25.955 7.394 -19.649 439 H GLY 55 H GLY 55 -28.589 8.440 -16.142 440 HA2 GLY 55 1HA GLY 55 -30.538 7.774 -15.102 441 HA3 GLY 55 2HA GLY 55 -31.128 7.231 -16.666 442 H LYS 56 H LYS 56 -28.080 6.022 -15.630 443 HA LYS 56 HA LYS 56 -29.340 3.506 -14.761 444 HB2 LYS 56 1HB LYS 56 -28.320 3.580 -17.155 445 HB3 LYS 56 2HB LYS 56 -26.774 3.527 -16.319 446 HG2 LYS 56 1HG LYS 56 -27.121 1.389 -15.529 447 HG3 LYS 56 2HG LYS 56 -28.876 1.505 -15.682 448 HD2 LYS 56 1HD LYS 56 -28.224 0.081 -17.427 449 HD3 LYS 56 2HD LYS 56 -28.467 1.648 -18.202 450 HE2 LYS 56 1HE LYS 56 -26.448 0.848 -19.087 451 HE3 LYS 56 2HE LYS 56 -25.967 2.016 -17.858 452 HZ1 LYS 56 3HZ LYS 56 -24.624 0.309 -17.275 453 HZ2 LYS 56 1HZ LYS 56 -25.655 -0.884 -17.888 454 HZ3 LYS 56 2HZ LYS 56 -25.985 -0.168 -16.391 455 H GLN 57 H GLN 57 -28.673 2.836 -12.833 456 HA GLN 57 HA GLN 57 -26.721 4.250 -11.348 457 HB2 GLN 57 1HB GLN 57 -27.070 2.498 -9.637 458 HB3 GLN 57 2HB GLN 57 -28.581 3.176 -10.229 459 HG2 GLN 57 1HG GLN 57 -28.544 1.154 -11.857 460 HG3 GLN 57 2HG GLN 57 -27.411 0.472 -10.691 461 HE21 GLN 57 2HE2 GLN 57 -30.540 2.148 -10.747 462 HE22 GLN 57 1HE2 GLN 57 -31.284 1.159 -9.542 463 H LEU 58 H LEU 58 -24.590 4.063 -11.404 464 HA LEU 58 HA LEU 58 -23.328 1.942 -12.881 465 HB2 LEU 58 1HB LEU 58 -22.034 4.087 -11.208 466 HB3 LEU 58 2HB LEU 58 -21.269 3.110 -12.460 467 HG LEU 58 HG LEU 58 -23.453 5.131 -12.962 468 HD11 LEU 58 1HD1 LEU 58 -21.759 6.556 -12.465 469 HD12 LEU 58 2HD1 LEU 58 -21.322 6.205 -14.137 470 HD13 LEU 58 3HD1 LEU 58 -20.504 5.368 -12.817 471 HD21 LEU 58 3HD2 LEU 58 -23.612 4.059 -14.908 472 HD22 LEU 58 1HD2 LEU 58 -22.186 3.077 -14.571 473 HD23 LEU 58 2HD2 LEU 58 -22.004 4.684 -15.277 474 H GLU 59 H GLU 59 -21.250 0.981 -11.832 475 HA GLU 59 HA GLU 59 -21.125 0.527 -9.066 476 HB2 GLU 59 1HB GLU 59 -21.845 -1.921 -9.143 477 HB3 GLU 59 2HB GLU 59 -23.123 -0.714 -9.144 478 HG2 GLU 59 1HG GLU 59 -23.322 -0.951 -11.581 479 HG3 GLU 59 2HG GLU 59 -22.081 -2.203 -11.543 480 H ASP 60 H ASP 60 -19.655 -1.341 -8.531 481 HA ASP 60 HA ASP 60 -17.313 -1.188 -10.059 482 HB2 ASP 60 1HB ASP 60 -16.427 -2.904 -8.600 483 HB3 ASP 60 2HB ASP 60 -17.399 -1.787 -7.647 484 H GLY 61 H GLY 61 -16.224 -2.794 -11.303 485 HA2 GLY 61 1HA GLY 61 -16.484 -5.144 -12.205 486 HA3 GLY 61 2HA GLY 61 -18.097 -4.623 -12.669 487 H ARG 62 H ARG 62 -17.679 -2.153 -13.721 488 HA ARG 62 HA ARG 62 -15.978 -2.758 -16.046 489 HB2 ARG 62 1HB ARG 62 -18.478 -1.094 -15.776 490 HB3 ARG 62 2HB ARG 62 -17.441 -1.021 -17.194 491 HG2 ARG 62 1HG ARG 62 -17.784 -3.472 -17.485 492 HG3 ARG 62 2HG ARG 62 -18.964 -3.405 -16.174 493 HD2 ARG 62 1HD ARG 62 -20.008 -1.489 -17.622 494 HD3 ARG 62 2HD ARG 62 -19.111 -2.264 -18.928 495 HE ARG 62 HE ARG 62 -20.644 -4.148 -17.444 496 HH11 ARG 62 1HH1 ARG 62 -20.862 -1.691 -19.901 497 HH12 ARG 62 2HH1 ARG 62 -22.262 -2.382 -20.653 498 HH21 ARG 62 1HH2 ARG 62 -22.486 -5.068 -18.425 499 HH22 ARG 62 2HH2 ARG 62 -23.185 -4.303 -19.812 500 H THR 63 H THR 63 -15.132 -0.758 -17.175 501 HA THR 63 HA THR 63 -13.949 1.001 -15.149 502 HB THR 63 HB THR 63 -12.243 -0.021 -16.420 503 HG1 THR 63 HG1 THR 63 -11.570 1.883 -17.825 504 HG21 THR 63 3HG2 THR 63 -14.140 0.334 -18.653 505 HG22 THR 63 1HG2 THR 63 -13.008 -0.977 -18.325 506 HG23 THR 63 2HG2 THR 63 -12.434 0.522 -19.057 507 H LEU 64 H LEU 64 -13.647 3.281 -15.673 508 HA LEU 64 HA LEU 64 -15.994 4.599 -16.302 509 HB2 LEU 64 1HB LEU 64 -13.127 5.474 -16.312 510 HB3 LEU 64 2HB LEU 64 -14.422 6.588 -16.746 511 HG LEU 64 HG LEU 64 -13.835 6.957 -14.458 512 HD11 LEU 64 1HD1 LEU 64 -16.383 5.356 -14.464 513 HD12 LEU 64 2HD1 LEU 64 -16.247 6.989 -15.113 514 HD13 LEU 64 3HD1 LEU 64 -15.952 6.694 -13.399 515 HD21 LEU 64 3HD2 LEU 64 -12.938 4.521 -14.262 516 HD22 LEU 64 1HD2 LEU 64 -14.571 4.163 -13.700 517 HD23 LEU 64 2HD2 LEU 64 -13.579 5.337 -12.835 518 H SER 65 H SER 65 -13.384 3.575 -18.407 519 HA SER 65 HA SER 65 -14.238 5.047 -20.692 520 HB2 SER 65 1HB SER 65 -11.943 4.313 -20.567 521 HB3 SER 65 2HB SER 65 -12.441 2.628 -20.416 522 HG SER 65 HG SER 65 -12.089 4.119 -22.645 523 H GLU 66 H GLU 66 -15.024 1.925 -19.346 524 HA GLU 66 HA GLU 66 -16.323 0.915 -21.685 525 HB2 GLU 66 1HB GLU 66 -16.113 0.062 -18.828 526 HB3 GLU 66 2HB GLU 66 -17.364 -0.652 -19.836 527 HG2 GLU 66 1HG GLU 66 -14.447 -0.639 -20.561 528 HG3 GLU 66 2HG GLU 66 -15.240 -1.954 -19.695 529 H TYR 67 H TYR 67 -17.242 2.944 -19.041 530 HA TYR 67 HA TYR 67 -20.088 2.626 -19.577 531 HB2 TYR 67 1HB TYR 67 -18.467 3.964 -17.454 532 HB3 TYR 67 2HB TYR 67 -20.108 4.530 -17.740 533 HD1 TYR 67 HD1 TYR 67 -21.693 2.224 -18.200 534 HD2 TYR 67 HD2 TYR 67 -18.378 2.647 -15.567 535 HE1 TYR 67 HE1 TYR 67 -22.570 0.393 -16.811 536 HE2 TYR 67 HE2 TYR 67 -19.244 0.816 -14.172 537 HH TYR 67 HH TYR 67 -22.372 -0.680 -14.840 538 H ASN 68 H ASN 68 -17.891 4.034 -21.294 539 HA ASN 68 HA ASN 68 -17.801 5.770 -22.760 540 HB2 ASN 68 1HB ASN 68 -20.718 6.265 -22.181 541 HB3 ASN 68 2HB ASN 68 -19.837 6.567 -23.675 542 HD21 ASN 68 2HD2 ASN 68 -18.817 4.535 -24.623 543 HD22 ASN 68 1HD2 ASN 68 -19.820 3.129 -24.653 544 H ILE 69 H ILE 69 -17.486 6.197 -19.816 545 HA ILE 69 HA ILE 69 -18.412 8.908 -19.390 546 HB ILE 69 HB ILE 69 -16.628 7.167 -17.684 547 HG12 ILE 69 1HG1 ILE 69 -19.464 7.921 -17.054 548 HG13 ILE 69 2HG1 ILE 69 -19.131 6.564 -18.124 549 HG21 ILE 69 1HG2 ILE 69 -17.752 9.913 -17.298 550 HG22 ILE 69 2HG2 ILE 69 -17.412 8.876 -15.913 551 HG23 ILE 69 3HG2 ILE 69 -16.112 9.329 -17.017 552 HD11 ILE 69 3HD1 ILE 69 -19.454 5.735 -15.914 553 HD12 ILE 69 1HD1 ILE 69 -17.747 5.566 -16.322 554 HD13 ILE 69 2HD1 ILE 69 -18.276 6.871 -15.260 555 H GLN 70 H GLN 70 -17.379 10.333 -20.693 556 HA GLN 70 HA GLN 70 -14.507 10.180 -21.068 557 HB2 GLN 70 1HB GLN 70 -16.377 12.332 -22.056 558 HB3 GLN 70 2HB GLN 70 -14.774 11.943 -22.665 559 HG2 GLN 70 1HG GLN 70 -15.553 9.866 -23.566 560 HG3 GLN 70 2HG GLN 70 -17.132 10.081 -22.812 561 HE21 GLN 70 2HE2 GLN 70 -16.947 9.593 -25.483 562 HE22 GLN 70 1HE2 GLN 70 -17.388 11.006 -26.374 563 H LYS 71 H LYS 71 -13.722 12.778 -21.198 564 HA LYS 71 HA LYS 71 -13.439 13.436 -18.416 565 HB2 LYS 71 1HB LYS 71 -11.841 15.048 -19.114 566 HB3 LYS 71 2HB LYS 71 -11.623 13.653 -20.163 567 HG2 LYS 71 1HG LYS 71 -12.902 14.775 -21.919 568 HG3 LYS 71 2HG LYS 71 -13.108 16.177 -20.867 569 HD2 LYS 71 1HD LYS 71 -10.899 16.804 -21.047 570 HD3 LYS 71 2HD LYS 71 -10.355 15.166 -21.417 571 HE2 LYS 71 1HE LYS 71 -12.076 16.748 -23.305 572 HE3 LYS 71 2HE LYS 71 -10.318 16.873 -23.313 573 HZ1 LYS 71 3HZ LYS 71 -12.019 14.733 -24.255 574 HZ2 LYS 71 1HZ LYS 71 -10.670 14.220 -23.371 575 HZ3 LYS 71 2HZ LYS 71 -10.464 15.179 -24.749 576 H GLU 72 H GLU 72 -15.618 14.283 -20.874 577 HA GLU 72 HA GLU 72 -16.420 16.725 -19.439 578 HB2 GLU 72 1HB GLU 72 -17.171 15.893 -22.245 579 HB3 GLU 72 2HB GLU 72 -17.525 17.433 -21.476 580 HG2 GLU 72 1HG GLU 72 -14.964 17.646 -21.250 581 HG3 GLU 72 2HG GLU 72 -14.914 16.384 -22.479 582 H SER 73 H SER 73 -17.168 13.533 -19.675 583 HA SER 73 HA SER 73 -19.899 13.341 -20.012 584 HB2 SER 73 1HB SER 73 -17.857 11.776 -18.536 585 HB3 SER 73 2HB SER 73 -19.537 11.493 -18.080 586 HG SER 73 HG SER 73 -19.721 11.413 -20.580 587 H THR 74 H THR 74 -21.569 12.956 -18.321 588 HA THR 74 HA THR 74 -21.243 14.855 -16.089 589 HB THR 74 HB THR 74 -23.944 14.206 -17.207 590 HG1 THR 74 HG1 THR 74 -21.990 15.916 -18.340 591 HG21 THR 74 3HG2 THR 74 -22.680 16.396 -15.612 592 HG22 THR 74 1HG2 THR 74 -24.166 15.498 -15.303 593 HG23 THR 74 2HG2 THR 74 -24.129 16.736 -16.559 594 H LEU 75 H LEU 75 -21.202 13.875 -14.184 595 HA LEU 75 HA LEU 75 -22.562 11.291 -13.878 596 HB2 LEU 75 1HB LEU 75 -20.131 12.498 -12.767 597 HB3 LEU 75 2HB LEU 75 -21.119 11.632 -11.592 598 HG LEU 75 HG LEU 75 -19.330 10.236 -12.533 599 HD11 LEU 75 1HD1 LEU 75 -22.137 9.621 -12.475 600 HD12 LEU 75 2HD1 LEU 75 -20.759 8.618 -12.025 601 HD13 LEU 75 3HD1 LEU 75 -21.315 8.653 -13.699 602 HD21 LEU 75 3HD2 LEU 75 -19.218 11.275 -14.750 603 HD22 LEU 75 1HD2 LEU 75 -20.794 10.590 -15.146 604 HD23 LEU 75 2HD2 LEU 75 -19.418 9.526 -14.858 605 H HIS 76 H HIS 76 -23.794 10.864 -11.970 606 HA HIS 76 HA HIS 76 -24.731 13.243 -10.524 607 HB2 HIS 76 1HB HIS 76 -26.363 11.281 -12.087 608 HB3 HIS 76 2HB HIS 76 -27.053 12.005 -10.637 609 HD1 HIS 76 HD1 HIS 76 -26.407 12.653 -14.180 610 HD2 HIS 76 HD2 HIS 76 -27.270 14.893 -10.789 611 HE1 HIS 76 HE1 HIS 76 -27.134 14.906 -15.030 612 H LEU 77 H LEU 77 -24.390 12.935 -8.434 613 HA LEU 77 HA LEU 77 -24.273 10.210 -7.378 614 HB2 LEU 77 1HB LEU 77 -23.220 11.201 -5.427 615 HB3 LEU 77 2HB LEU 77 -22.388 11.675 -6.907 616 HG LEU 77 HG LEU 77 -24.151 13.748 -6.506 617 HD11 LEU 77 1HD1 LEU 77 -22.924 13.566 -3.845 618 HD12 LEU 77 2HD1 LEU 77 -24.264 12.456 -4.132 619 HD13 LEU 77 3HD1 LEU 77 -24.499 14.192 -4.334 620 HD21 LEU 77 3HD2 LEU 77 -22.262 15.004 -6.426 621 HD22 LEU 77 1HD2 LEU 77 -21.539 13.485 -6.956 622 HD23 LEU 77 2HD2 LEU 77 -21.473 13.947 -5.255 623 H VAL 78 H VAL 78 -26.007 9.380 -6.437 624 HA VAL 78 HA VAL 78 -27.954 11.211 -5.196 625 HB VAL 78 HB VAL 78 -29.553 9.237 -5.464 626 HG11 VAL 78 1HG1 VAL 78 -30.356 10.486 -7.114 627 HG12 VAL 78 2HG1 VAL 78 -28.802 11.316 -7.213 628 HG13 VAL 78 3HG1 VAL 78 -29.108 9.893 -8.209 629 HG21 VAL 78 3HG2 VAL 78 -27.726 8.343 -7.656 630 HG22 VAL 78 1HG2 VAL 78 -27.523 7.713 -6.021 631 HG23 VAL 78 2HG2 VAL 78 -29.047 7.474 -6.875 632 H LEU 79 H LEU 79 -28.645 10.848 -3.132 633 HA LEU 79 HA LEU 79 -27.233 8.734 -1.649 634 HB2 LEU 79 1HB LEU 79 -27.585 11.522 -1.169 635 HB3 LEU 79 2HB LEU 79 -28.386 10.623 0.118 636 HG LEU 79 HG LEU 79 -26.029 11.306 0.605 637 HD11 LEU 79 1HD1 LEU 79 -26.575 8.341 0.563 638 HD12 LEU 79 2HD1 LEU 79 -27.127 9.474 1.796 639 HD13 LEU 79 3HD1 LEU 79 -25.403 9.171 1.587 640 HD21 LEU 79 3HD2 LEU 79 -25.548 10.304 -1.943 641 HD22 LEU 79 1HD2 LEU 79 -24.826 9.120 -0.853 642 HD23 LEU 79 2HD2 LEU 79 -24.343 10.814 -0.760 643 H ARG 80 H ARG 80 -28.372 7.169 -0.700 644 HA ARG 80 HA ARG 80 -31.288 7.315 -0.824 645 HB2 ARG 80 1HB ARG 80 -29.864 5.337 -1.689 646 HB3 ARG 80 2HB ARG 80 -29.704 4.899 0.006 647 HG2 ARG 80 1HG ARG 80 -31.512 3.639 -0.588 648 HG3 ARG 80 2HG ARG 80 -32.316 5.102 -0.015 649 HD2 ARG 80 1HD ARG 80 -33.388 4.680 -2.028 650 HD3 ARG 80 2HD ARG 80 -32.165 5.869 -2.477 651 HE ARG 80 HE ARG 80 -30.942 3.482 -2.911 652 HH11 ARG 80 1HH1 ARG 80 -33.945 4.898 -3.958 653 HH12 ARG 80 2HH1 ARG 80 -33.970 4.049 -5.468 654 HH21 ARG 80 1HH2 ARG 80 -30.964 2.357 -4.895 655 HH22 ARG 80 2HH2 ARG 80 -32.274 2.603 -5.999 656 H LEU 81 H LEU 81 -28.697 6.604 1.498 657 HA LEU 81 HA LEU 81 -30.626 7.095 3.671 658 HB2 LEU 81 1HB LEU 81 -28.386 5.160 3.384 659 HB3 LEU 81 2HB LEU 81 -28.730 5.807 4.986 660 HG LEU 81 HG LEU 81 -29.785 3.617 4.584 661 HD11 LEU 81 1HD1 LEU 81 -31.535 4.169 5.871 662 HD12 LEU 81 2HD1 LEU 81 -32.143 5.353 4.715 663 HD13 LEU 81 3HD1 LEU 81 -30.843 5.791 5.823 664 HD21 LEU 81 3HD2 LEU 81 -31.778 4.832 2.756 665 HD22 LEU 81 1HD2 LEU 81 -31.211 3.166 2.874 666 HD23 LEU 81 2HD2 LEU 81 -30.214 4.381 2.074 667 H ARG 82 H ARG 82 -30.336 9.211 4.127 668 HA ARG 82 HA ARG 82 -27.862 10.568 4.014 669 HB2 ARG 82 1HB ARG 82 -30.139 11.629 3.914 670 HB3 ARG 82 2HB ARG 82 -30.280 11.349 5.645 671 HG2 ARG 82 1HG ARG 82 -28.059 12.667 5.795 672 HG3 ARG 82 2HG ARG 82 -28.485 13.230 4.177 673 HD2 ARG 82 1HD ARG 82 -30.704 13.932 5.109 674 HD3 ARG 82 2HD ARG 82 -30.079 13.553 6.713 675 HE ARG 82 HE ARG 82 -28.383 15.348 5.275 676 HH11 ARG 82 1HH1 ARG 82 -31.267 15.136 7.213 677 HH12 ARG 82 2HH1 ARG 82 -31.172 16.774 7.768 678 HH21 ARG 82 1HH2 ARG 82 -28.247 17.507 5.998 679 HH22 ARG 82 2HH2 ARG 82 -29.454 18.123 7.075 680 H GLY 83 H GLY 83 -29.807 9.732 6.894 681 HA2 GLY 83 1HA GLY 83 -29.182 9.364 9.073 682 HA3 GLY 83 2HA GLY 83 -27.814 8.512 8.372 683 H TYR 84 H TYR 84 -28.956 11.693 9.405 684 HA TYR 84 HA TYR 84 -26.193 12.653 9.509 685 HB2 TYR 84 1HB TYR 84 -28.151 13.991 8.489 686 HB3 TYR 84 2HB TYR 84 -28.632 14.293 10.155 687 HD1 TYR 84 HD2 TYR 84 -26.786 15.290 11.708 688 HD2 TYR 84 HD1 TYR 84 -26.646 15.425 7.457 689 HE1 TYR 84 HE2 TYR 84 -25.209 17.174 11.825 690 HE2 TYR 84 HE1 TYR 84 -25.068 17.309 7.563 691 HH TYR 84 HH TYR 84 -24.612 19.220 9.519 692 H ALA 85 H ALA 85 -25.544 11.396 11.316 693 HA ALA 85 HA ALA 85 -25.794 12.707 13.797 694 HB1 ALA 85 1HB ALA 85 -27.587 10.371 13.334 695 HB2 ALA 85 2HB ALA 85 -26.875 10.606 14.931 696 HB3 ALA 85 3HB ALA 85 -27.886 11.865 14.223 697 H ASP 86 H ASP 86 -23.725 12.492 14.352 698 HA ASP 86 HA ASP 86 -22.528 9.800 14.249 699 HB2 ASP 86 1HB ASP 86 -21.554 11.529 12.671 700 HB3 ASP 86 2HB ASP 86 -21.000 12.400 14.098 701 H LEU 87 H LEU 87 -21.243 9.139 15.980 702 HA LEU 87 HA LEU 87 -21.112 10.893 18.319 703 HB2 LEU 87 1HB LEU 87 -22.077 8.049 18.507 704 HB3 LEU 87 2HB LEU 87 -21.995 9.243 19.800 705 HG LEU 87 HG LEU 87 -23.840 9.419 17.420 706 HD11 LEU 87 1HD1 LEU 87 -25.612 8.797 18.974 707 HD12 LEU 87 2HD1 LEU 87 -24.420 8.562 20.252 708 HD13 LEU 87 3HD1 LEU 87 -24.411 7.514 18.833 709 HD21 LEU 87 3HD2 LEU 87 -24.679 10.917 19.685 710 HD22 LEU 87 1HD2 LEU 87 -24.232 11.498 18.081 711 HD23 LEU 87 2HD2 LEU 87 -23.001 11.334 19.334 712 H ARG 88 H ARG 88 -19.894 9.553 20.146 713 HA ARG 88 HA ARG 88 -17.783 7.895 19.008 714 HB2 ARG 88 1HB ARG 88 -17.002 10.261 18.862 715 HB3 ARG 88 2HB ARG 88 -17.158 10.380 20.610 716 HG2 ARG 88 1HG ARG 88 -15.496 8.181 19.514 717 HG3 ARG 88 2HG ARG 88 -14.858 9.825 19.442 718 HD2 ARG 88 1HD ARG 88 -15.505 9.957 21.928 719 HD3 ARG 88 2HD ARG 88 -15.613 8.200 21.846 720 HE ARG 88 HE ARG 88 -13.220 9.793 21.840 721 HH11 ARG 88 1HH1 ARG 88 -14.633 6.739 20.947 722 HH12 ARG 88 2HH1 ARG 88 -13.122 5.891 20.953 723 HH21 ARG 88 1HH2 ARG 88 -11.225 8.687 21.851 724 HH22 ARG 88 2HH2 ARG 88 -11.185 6.999 21.468 725 H GLU 89 H GLU 89 -17.799 6.142 20.244 726 HA GLU 89 HA GLU 89 -17.352 6.305 23.060 727 HB2 GLU 89 1HB GLU 89 -19.440 4.931 23.607 728 HB3 GLU 89 2HB GLU 89 -19.659 6.652 23.323 729 HG2 GLU 89 1HG GLU 89 -21.414 5.464 22.226 730 HG3 GLU 89 2HG GLU 89 -20.341 6.139 21.002 731 H ASP 90 H ASP 90 -17.383 4.049 24.054 732 HA ASP 90 HA ASP 90 -17.190 1.802 22.298 733 HB2 ASP 90 1HB ASP 90 -14.999 3.124 21.985 734 HB3 ASP 90 2HB ASP 90 -14.595 2.579 23.611 735 HA PRO 91 HA PRO 91 -18.096 0.993 26.792 736 HB2 PRO 91 1HB PRO 91 -20.390 -0.385 26.332 737 HB3 PRO 91 2HB PRO 91 -20.344 1.373 26.504 738 HG2 PRO 91 1HG PRO 91 -20.438 -0.284 24.013 739 HG3 PRO 91 2HG PRO 91 -21.330 1.197 24.406 740 HD2 PRO 91 1HD PRO 91 -19.128 1.197 22.831 741 HD3 PRO 91 2HD PRO 91 -19.544 2.560 23.891 742 H ASP 92 H ASP 92 -19.014 -1.354 27.556 743 HA ASP 92 HA ASP 92 -18.353 -3.632 26.085 744 HB2 ASP 92 1HB ASP 92 -16.236 -4.105 27.663 745 HB3 ASP 92 2HB ASP 92 -16.089 -3.368 26.070 746 H ARG 93 H ARG 93 -20.038 -4.651 27.027 747 HA ARG 93 HA ARG 93 -20.819 -4.491 29.695 748 HB2 ARG 93 1HB ARG 93 -22.147 -6.486 29.274 749 HB3 ARG 93 2HB ARG 93 -22.240 -5.395 27.899 750 HG2 ARG 93 1HG ARG 93 -20.166 -7.508 27.823 751 HG3 ARG 93 2HG ARG 93 -21.849 -8.001 27.626 752 HD2 ARG 93 1HD ARG 93 -21.914 -6.023 25.915 753 HD3 ARG 93 2HD ARG 93 -20.165 -6.246 25.895 754 HE ARG 93 HE ARG 93 -22.114 -7.918 24.667 755 HH11 ARG 93 1HH1 ARG 93 -19.006 -7.945 26.235 756 HH12 ARG 93 2HH1 ARG 93 -18.464 -9.378 25.426 757 HH21 ARG 93 1HH2 ARG 93 -21.412 -9.805 23.595 758 HH22 ARG 93 2HH2 ARG 93 -19.834 -10.435 23.924 759 H GLN 94 H GLN 94 -20.798 -6.291 31.297 760 HA GLN 94 HA GLN 94 -18.259 -7.779 31.239 761 HB2 GLN 94 1HB GLN 94 -17.935 -5.911 32.726 762 HB3 GLN 94 2HB GLN 94 -19.449 -6.249 33.555 763 HG2 GLN 94 1HG GLN 94 -18.546 -8.320 34.424 764 HG3 GLN 94 2HG GLN 94 -17.044 -8.058 33.537 765 HE21 GLN 94 2HE2 GLN 94 -18.981 -7.099 36.249 766 HE22 GLN 94 1HE2 GLN 94 -17.766 -6.172 37.053 767 H ASP 95 H ASP 95 -19.290 -9.687 30.645 768 HA ASP 95 HA ASP 95 -21.231 -10.768 32.575 769 HB2 ASP 95 1HB ASP 95 -22.010 -10.628 30.230 770 HB3 ASP 95 2HB ASP 95 -20.678 -11.671 29.741 771 H HIS 96 H HIS 96 -20.580 -12.319 33.904 772 HA HIS 96 HA HIS 96 -18.398 -14.097 33.075 773 HB2 HIS 96 1HB HIS 96 -18.480 -12.321 35.472 774 HB3 HIS 96 2HB HIS 96 -17.732 -13.907 35.635 775 HD1 HIS 96 HD1 HIS 96 -15.878 -14.346 33.558 776 HD2 HIS 96 HD2 HIS 96 -16.699 -10.444 34.725 777 HE1 HIS 96 HE1 HIS 96 -13.930 -12.978 32.748 778 H HIS 97 H HIS 97 -19.282 -16.054 33.048 779 HA HIS 97 HA HIS 97 -20.957 -16.856 35.334 780 HB2 HIS 97 1HB HIS 97 -22.106 -18.402 33.622 781 HB3 HIS 97 2HB HIS 97 -22.525 -16.692 33.595 782 HD1 HIS 97 HD1 HIS 97 -22.898 -16.098 31.227 783 HD2 HIS 97 HD2 HIS 97 -19.575 -18.547 31.699 784 HE1 HIS 97 HE1 HIS 97 -21.882 -16.302 28.935 785 HA PRO 98 HA PRO 98 -18.324 -20.327 35.850 786 HB2 PRO 98 1HB PRO 98 -20.076 -22.241 36.650 787 HB3 PRO 98 2HB PRO 98 -19.597 -20.886 37.679 788 HG2 PRO 98 1HG PRO 98 -22.067 -21.226 36.021 789 HG3 PRO 98 2HG PRO 98 -21.904 -20.593 37.670 790 HD2 PRO 98 1HD PRO 98 -22.181 -18.981 35.511 791 HD3 PRO 98 2HD PRO 98 -21.237 -18.511 36.940 792 H GLY 99 H GLY 99 -18.473 -22.904 35.417 793 HA2 GLY 99 1HA GLY 99 -18.472 -23.140 32.564 794 HA3 GLY 99 2HA GLY 99 -18.136 -24.424 33.715 795 H SER 100 H SER 100 -19.358 -26.000 32.753 796 HA SER 100 HA SER 100 -22.266 -25.589 32.886 797 HB2 SER 100 1HB SER 100 -20.639 -26.619 30.591 798 HB3 SER 100 2HB SER 100 -22.271 -27.238 30.838 799 HG SER 100 HG SER 100 -21.421 -24.695 30.089 800 H GLY 101 H GLY 101 -23.339 -27.901 32.511 801 HA2 GLY 101 1HA GLY 101 -21.970 -30.200 33.393 802 HA3 GLY 101 2HA GLY 101 -22.731 -29.430 34.777 803 H ALA 102 H ALA 102 -25.078 -29.026 34.619 804 HA ALA 102 HA ALA 102 -27.203 -29.800 34.362 805 HB1 ALA 102 1HB ALA 102 -26.214 -30.546 31.612 806 HB2 ALA 102 2HB ALA 102 -27.903 -30.442 32.110 807 HB3 ALA 102 3HB ALA 102 -26.901 -28.991 32.082 808 H GLN 103 H GLN 103 -25.507 -31.515 35.713 809 HA GLN 103 HA GLN 103 -25.653 -34.178 34.684 810 HB2 GLN 103 1HB GLN 103 -24.794 -34.856 36.867 811 HB3 GLN 103 2HB GLN 103 -23.882 -33.490 36.237 812 HG2 GLN 103 1HG GLN 103 -25.104 -31.977 37.688 813 HG3 GLN 103 2HG GLN 103 -26.074 -33.319 38.292 814 HE21 GLN 103 2HE2 GLN 103 -25.145 -34.815 39.685 815 HE22 GLN 103 1HE2 GLN 103 -23.658 -34.506 40.508 Start of MODEL 5 1 H1 GLY 1 H GLY 1 1.100 6.694 -0.751 2 HA2 GLY 1 1HA GLY 1 2.405 5.207 -1.979 3 HA3 GLY 1 2HA GLY 1 2.249 4.036 -0.678 4 H SER 2 H SER 2 1.869 2.410 -2.265 5 HA SER 2 HA SER 2 0.626 1.131 -3.696 6 HB2 SER 2 1HB SER 2 -1.896 1.138 -2.976 7 HB3 SER 2 2HB SER 2 -0.673 0.503 -1.875 8 HG SER 2 HG SER 2 -2.192 2.826 -1.708 9 H LEU 3 H LEU 3 1.158 3.762 -4.666 10 HA LEU 3 HA LEU 3 -1.161 4.085 -6.444 11 HB2 LEU 3 1HB LEU 3 -1.150 5.871 -4.745 12 HB3 LEU 3 2HB LEU 3 0.468 6.334 -5.269 13 HG LEU 3 HG LEU 3 -0.778 6.599 -7.601 14 HD11 LEU 3 1HD1 LEU 3 -3.016 7.461 -7.334 15 HD12 LEU 3 2HD1 LEU 3 -2.946 7.192 -5.593 16 HD13 LEU 3 3HD1 LEU 3 -2.935 5.818 -6.698 17 HD21 LEU 3 3HD2 LEU 3 -0.040 8.340 -5.432 18 HD22 LEU 3 1HD2 LEU 3 -1.439 8.978 -6.295 19 HD23 LEU 3 2HD2 LEU 3 0.047 8.615 -7.172 20 H VAL 4 H VAL 4 -0.680 4.194 -8.557 21 HA VAL 4 HA VAL 4 2.165 4.424 -9.295 22 HB VAL 4 HB VAL 4 -0.006 2.911 -10.753 23 HG11 VAL 4 1HG1 VAL 4 1.750 2.123 -12.213 24 HG12 VAL 4 2HG1 VAL 4 1.724 3.888 -12.222 25 HG13 VAL 4 3HG1 VAL 4 2.957 3.028 -11.299 26 HG21 VAL 4 3HG2 VAL 4 2.377 1.806 -9.276 27 HG22 VAL 4 1HG2 VAL 4 0.754 1.905 -8.592 28 HG23 VAL 4 2HG2 VAL 4 1.054 0.901 -10.011 29 HA PRO 5 HA PRO 5 1.002 8.068 -11.515 30 HB2 PRO 5 1HB PRO 5 3.283 8.335 -12.964 31 HB3 PRO 5 2HB PRO 5 3.185 8.732 -11.244 32 HG2 PRO 5 1HG PRO 5 4.238 6.258 -12.562 33 HG3 PRO 5 2HG PRO 5 4.915 7.178 -11.205 34 HD2 PRO 5 1HD PRO 5 3.507 4.892 -10.857 35 HD3 PRO 5 2HD PRO 5 3.484 6.217 -9.675 36 H ARG 6 H ARG 6 -0.682 7.166 -12.786 37 HA ARG 6 HA ARG 6 0.168 6.406 -15.502 38 HB2 ARG 6 1HB ARG 6 -2.247 5.348 -14.021 39 HB3 ARG 6 2HB ARG 6 -1.766 4.921 -15.658 40 HG2 ARG 6 1HG ARG 6 0.414 4.098 -14.606 41 HG3 ARG 6 2HG ARG 6 -0.446 4.197 -13.068 42 HD2 ARG 6 1HD ARG 6 -0.808 2.001 -13.700 43 HD3 ARG 6 2HD ARG 6 -2.265 2.808 -14.279 44 HE ARG 6 HE ARG 6 -0.156 2.637 -16.232 45 HH11 ARG 6 1HH1 ARG 6 -2.928 1.056 -14.841 46 HH12 ARG 6 2HH1 ARG 6 -3.234 0.077 -16.237 47 HH21 ARG 6 1HH2 ARG 6 -0.548 1.353 -18.077 48 HH22 ARG 6 2HH2 ARG 6 -1.879 0.246 -18.077 49 H GLY 7 H GLY 7 -1.899 6.577 -17.011 50 HA2 GLY 7 1HA GLY 7 -2.468 9.268 -17.350 51 HA3 GLY 7 2HA GLY 7 -3.418 7.960 -18.039 52 H SER 8 H SER 8 -4.617 10.323 -17.322 53 HA SER 8 HA SER 8 -6.734 9.465 -15.705 54 HB2 SER 8 1HB SER 8 -6.293 11.161 -13.798 55 HB3 SER 8 2HB SER 8 -5.440 9.618 -13.753 56 HG SER 8 HG SER 8 -3.871 11.083 -13.434 57 H MET 9 H MET 9 -8.468 10.803 -15.916 58 HA MET 9 HA MET 9 -7.989 13.468 -17.070 59 HB2 MET 9 1HB MET 9 -9.871 13.163 -18.581 60 HB3 MET 9 2HB MET 9 -8.672 11.905 -18.846 61 HG2 MET 9 1HG MET 9 -10.769 11.210 -16.922 62 HG3 MET 9 2HG MET 9 -11.333 11.484 -18.569 63 HE1 MET 9 3HE MET 9 -10.325 10.669 -20.502 64 HE2 MET 9 1HE MET 9 -8.920 9.606 -20.590 65 HE3 MET 9 2HE MET 9 -10.545 8.923 -20.626 66 H GLN 10 H GLN 10 -9.719 15.003 -16.734 67 HA GLN 10 HA GLN 10 -11.054 14.550 -14.175 68 HB2 GLN 10 1HB GLN 10 -11.344 16.951 -14.080 69 HB3 GLN 10 2HB GLN 10 -9.668 16.580 -14.465 70 HG2 GLN 10 1HG GLN 10 -11.068 16.841 -16.908 71 HG3 GLN 10 2HG GLN 10 -11.507 18.209 -15.886 72 HE21 GLN 10 2HE2 GLN 10 -9.526 19.156 -14.703 73 HE22 GLN 10 1HE2 GLN 10 -8.139 19.435 -15.694 74 H ILE 11 H ILE 11 -13.251 14.720 -13.878 75 HA ILE 11 HA ILE 11 -14.887 14.993 -16.313 76 HB ILE 11 HB ILE 11 -16.409 13.292 -15.498 77 HG12 ILE 11 1HG1 ILE 11 -14.475 12.993 -13.190 78 HG13 ILE 11 2HG1 ILE 11 -16.106 13.647 -13.091 79 HG21 ILE 11 1HG2 ILE 11 -13.678 12.075 -15.286 80 HG22 ILE 11 2HG2 ILE 11 -15.133 11.414 -16.030 81 HG23 ILE 11 3HG2 ILE 11 -14.271 12.741 -16.807 82 HD11 ILE 11 3HD1 ILE 11 -16.895 11.396 -13.950 83 HD12 ILE 11 1HD1 ILE 11 -15.261 10.821 -13.621 84 HD13 ILE 11 2HD1 ILE 11 -16.257 11.448 -12.307 85 H PHE 12 H PHE 12 -17.262 15.362 -15.720 86 HA PHE 12 HA PHE 12 -17.370 17.323 -13.526 87 HB2 PHE 12 1HB PHE 12 -18.953 17.204 -16.100 88 HB3 PHE 12 2HB PHE 12 -19.238 18.367 -14.809 89 HD1 PHE 12 HD2 PHE 12 -17.019 19.656 -14.056 90 HD2 PHE 12 HD1 PHE 12 -17.684 17.894 -17.873 91 HE1 PHE 12 HE2 PHE 12 -15.338 21.159 -15.038 92 HE2 PHE 12 HE1 PHE 12 -16.002 19.394 -18.862 93 HZ PHE 12 HZ PHE 12 -14.828 21.030 -17.444 94 H VAL 13 H VAL 13 -18.717 16.959 -11.887 95 HA VAL 13 HA VAL 13 -20.894 15.009 -12.262 96 HB VAL 13 HB VAL 13 -19.205 15.273 -9.771 97 HG11 VAL 13 1HG1 VAL 13 -21.537 14.596 -9.377 98 HG12 VAL 13 2HG1 VAL 13 -21.324 13.253 -10.502 99 HG13 VAL 13 3HG1 VAL 13 -20.397 13.304 -9.002 100 HG21 VAL 13 3HG2 VAL 13 -18.810 13.746 -12.206 101 HG22 VAL 13 1HG2 VAL 13 -17.714 14.014 -10.850 102 HG23 VAL 13 2HG2 VAL 13 -18.902 12.712 -10.780 103 H LYS 14 H LYS 14 -22.833 15.502 -11.350 104 HA LYS 14 HA LYS 14 -23.049 18.162 -10.124 105 HB2 LYS 14 1HB LYS 14 -24.952 16.456 -11.698 106 HB3 LYS 14 2HB LYS 14 -25.561 17.734 -10.656 107 HG2 LYS 14 1HG LYS 14 -25.409 18.797 -12.689 108 HG3 LYS 14 2HG LYS 14 -23.875 19.233 -11.934 109 HD2 LYS 14 1HD LYS 14 -22.694 17.605 -13.206 110 HD3 LYS 14 2HD LYS 14 -24.194 16.875 -13.782 111 HE2 LYS 14 1HE LYS 14 -24.511 18.460 -15.367 112 HE3 LYS 14 2HE LYS 14 -23.835 19.746 -14.368 113 HZ1 LYS 14 3HZ LYS 14 -21.834 19.483 -15.278 114 HZ2 LYS 14 1HZ LYS 14 -22.606 18.584 -16.485 115 HZ3 LYS 14 2HZ LYS 14 -21.888 17.796 -15.172 116 H THR 15 H THR 15 -23.372 18.284 -8.011 117 HA THR 15 HA THR 15 -23.965 15.941 -6.456 118 HB THR 15 HB THR 15 -23.831 17.453 -4.505 119 HG1 THR 15 HG1 THR 15 -23.045 19.567 -6.178 120 HG21 THR 15 3HG2 THR 15 -21.688 16.834 -4.752 121 HG22 THR 15 1HG2 THR 15 -21.438 18.447 -5.417 122 HG23 THR 15 2HG2 THR 15 -21.725 17.082 -6.497 123 H LEU 16 H LEU 16 -25.625 16.232 -4.603 124 HA LEU 16 HA LEU 16 -28.194 16.519 -5.828 125 HB2 LEU 16 1HB LEU 16 -29.067 15.924 -3.609 126 HB3 LEU 16 2HB LEU 16 -27.839 14.799 -4.184 127 HG LEU 16 HG LEU 16 -26.757 16.923 -2.498 128 HD11 LEU 16 1HD1 LEU 16 -29.012 16.631 -1.486 129 HD12 LEU 16 2HD1 LEU 16 -27.680 16.184 -0.420 130 HD13 LEU 16 3HD1 LEU 16 -28.623 14.930 -1.226 131 HD21 LEU 16 3HD2 LEU 16 -25.925 14.769 -1.326 132 HD22 LEU 16 1HD2 LEU 16 -25.317 15.162 -2.934 133 HD23 LEU 16 2HD2 LEU 16 -26.580 13.946 -2.742 134 H THR 17 H THR 17 -26.180 18.484 -3.770 135 HA THR 17 HA THR 17 -28.185 20.294 -2.901 136 HB THR 17 HB THR 17 -26.071 20.142 -1.711 137 HG1 THR 17 HG1 THR 17 -25.927 22.287 -1.346 138 HG21 THR 17 3HG2 THR 17 -24.879 21.170 -4.284 139 HG22 THR 17 1HG2 THR 17 -24.530 19.644 -3.473 140 HG23 THR 17 2HG2 THR 17 -24.025 21.167 -2.741 141 H GLY 18 H GLY 18 -26.364 19.973 -5.831 142 HA2 GLY 18 1HA GLY 18 -27.274 21.036 -7.819 143 HA3 GLY 18 2HA GLY 18 -27.645 22.439 -6.828 144 H LYS 19 H LYS 19 -24.618 20.839 -6.365 145 HA LYS 19 HA LYS 19 -23.268 23.082 -7.718 146 HB2 LYS 19 1HB LYS 19 -22.849 23.200 -5.367 147 HB3 LYS 19 2HB LYS 19 -22.477 21.483 -5.284 148 HG2 LYS 19 1HG LYS 19 -20.801 23.137 -7.076 149 HG3 LYS 19 2HG LYS 19 -20.600 23.364 -5.337 150 HD2 LYS 19 1HD LYS 19 -20.678 20.577 -6.352 151 HD3 LYS 19 2HD LYS 19 -19.236 21.531 -6.708 152 HE2 LYS 19 1HE LYS 19 -18.761 20.451 -4.680 153 HE3 LYS 19 2HE LYS 19 -19.198 22.096 -4.224 154 HZ1 LYS 19 3HZ LYS 19 -20.230 19.960 -3.061 155 HZ2 LYS 19 1HZ LYS 19 -21.362 20.150 -4.304 156 HZ3 LYS 19 2HZ LYS 19 -21.081 21.413 -3.215 157 H THR 20 H THR 20 -21.446 22.672 -8.973 158 HA THR 20 HA THR 20 -21.232 19.903 -9.915 159 HB THR 20 HB THR 20 -19.860 22.149 -11.322 160 HG1 THR 20 HG1 THR 20 -21.949 22.441 -12.458 161 HG21 THR 20 3HG2 THR 20 -19.502 20.098 -12.366 162 HG22 THR 20 1HG2 THR 20 -20.854 20.770 -13.277 163 HG23 THR 20 2HG2 THR 20 -21.144 19.538 -12.048 164 H ILE 21 H ILE 21 -19.552 18.709 -9.326 165 HA ILE 21 HA ILE 21 -17.087 20.079 -8.467 166 HB ILE 21 HB ILE 21 -18.071 18.999 -6.564 167 HG12 ILE 21 1HG1 ILE 21 -15.522 18.634 -7.318 168 HG13 ILE 21 2HG1 ILE 21 -16.169 17.984 -5.815 169 HG21 ILE 21 1HG2 ILE 21 -18.447 16.517 -6.583 170 HG22 ILE 21 2HG2 ILE 21 -19.567 17.452 -7.572 171 HG23 ILE 21 3HG2 ILE 21 -18.244 16.571 -8.334 172 HD11 ILE 21 3HD1 ILE 21 -14.778 16.452 -7.328 173 HD12 ILE 21 1HD1 ILE 21 -16.284 15.827 -6.656 174 HD13 ILE 21 2HD1 ILE 21 -16.226 16.373 -8.332 175 H THR 22 H THR 22 -15.211 19.517 -9.407 176 HA THR 22 HA THR 22 -15.321 17.620 -11.613 177 HB THR 22 HB THR 22 -12.870 19.188 -10.876 178 HG1 THR 22 HG1 THR 22 -13.937 20.975 -11.221 179 HG21 THR 22 3HG2 THR 22 -13.979 18.617 -13.609 180 HG22 THR 22 1HG2 THR 22 -13.012 17.425 -12.742 181 HG23 THR 22 2HG2 THR 22 -12.320 18.996 -13.146 182 H LEU 23 H LEU 23 -14.645 15.593 -11.434 183 HA LEU 23 HA LEU 23 -12.777 14.923 -9.256 184 HB2 LEU 23 1HB LEU 23 -15.245 14.000 -9.397 185 HB3 LEU 23 2HB LEU 23 -14.510 12.860 -10.522 186 HG LEU 23 HG LEU 23 -12.863 12.326 -8.650 187 HD11 LEU 23 1HD1 LEU 23 -13.143 14.111 -7.151 188 HD12 LEU 23 2HD1 LEU 23 -13.900 12.725 -6.365 189 HD13 LEU 23 3HD1 LEU 23 -14.899 13.947 -7.151 190 HD21 LEU 23 3HD2 LEU 23 -14.759 11.010 -7.408 191 HD22 LEU 23 1HD2 LEU 23 -14.338 10.619 -9.076 192 HD23 LEU 23 2HD2 LEU 23 -15.756 11.610 -8.733 193 H GLU 24 H GLU 24 -11.100 13.470 -9.671 194 HA GLU 24 HA GLU 24 -10.445 13.177 -12.521 195 HB2 GLU 24 1HB GLU 24 -8.694 14.365 -11.560 196 HB3 GLU 24 2HB GLU 24 -8.784 13.473 -10.048 197 HG2 GLU 24 1HG GLU 24 -7.629 11.650 -10.908 198 HG3 GLU 24 2HG GLU 24 -7.941 12.120 -12.578 199 H VAL 25 H VAL 25 -10.448 11.224 -13.413 200 HA VAL 25 HA VAL 25 -9.913 8.866 -11.778 201 HB VAL 25 HB VAL 25 -12.347 9.085 -11.699 202 HG11 VAL 25 1HG1 VAL 25 -13.698 9.440 -13.491 203 HG12 VAL 25 2HG1 VAL 25 -12.239 10.215 -14.110 204 HG13 VAL 25 3HG1 VAL 25 -12.641 8.569 -14.602 205 HG21 VAL 25 3HG2 VAL 25 -11.294 6.848 -11.787 206 HG22 VAL 25 1HG2 VAL 25 -12.919 6.869 -12.473 207 HG23 VAL 25 2HG2 VAL 25 -11.512 6.841 -13.537 208 H GLU 26 H GLU 26 -9.113 7.109 -12.926 209 HA GLU 26 HA GLU 26 -7.918 7.755 -15.461 210 HB2 GLU 26 1HB GLU 26 -7.884 5.052 -14.135 211 HB3 GLU 26 2HB GLU 26 -6.702 5.736 -15.241 212 HG2 GLU 26 1HG GLU 26 -6.040 7.356 -13.542 213 HG3 GLU 26 2HG GLU 26 -7.230 6.677 -12.432 214 HA PRO 27 HA PRO 27 -10.858 5.973 -18.189 215 HB2 PRO 27 1HB PRO 27 -9.239 5.046 -20.162 216 HB3 PRO 27 2HB PRO 27 -9.558 6.766 -19.910 217 HG2 PRO 27 1HG PRO 27 -7.200 5.132 -19.056 218 HG3 PRO 27 2HG PRO 27 -7.238 6.758 -19.762 219 HD2 PRO 27 1HD PRO 27 -6.921 6.330 -17.107 220 HD3 PRO 27 2HD PRO 27 -7.760 7.756 -17.751 221 H SER 28 H SER 28 -8.298 4.029 -16.881 222 HA SER 28 HA SER 28 -9.616 1.557 -17.744 223 HB2 SER 28 1HB SER 28 -7.403 0.741 -16.366 224 HB3 SER 28 2HB SER 28 -7.439 1.046 -18.102 225 HG SER 28 HG SER 28 -6.453 2.668 -16.028 226 H ASP 29 H ASP 29 -9.396 3.638 -15.086 227 HA ASP 29 HA ASP 29 -9.647 1.767 -12.966 228 HB2 ASP 29 1HB ASP 29 -10.093 4.712 -13.260 229 HB3 ASP 29 2HB ASP 29 -10.689 3.895 -11.818 230 H THR 30 H THR 30 -11.602 1.660 -11.544 231 HA THR 30 HA THR 30 -14.017 1.415 -13.213 232 HB THR 30 HB THR 30 -14.806 -0.250 -11.557 233 HG1 THR 30 HG1 THR 30 -12.928 -1.062 -10.192 234 HG21 THR 30 3HG2 THR 30 -12.200 -1.401 -12.222 235 HG22 THR 30 1HG2 THR 30 -12.995 -0.610 -13.582 236 HG23 THR 30 2HG2 THR 30 -13.818 -1.904 -12.711 237 H ILE 31 H ILE 31 -16.087 1.504 -11.823 238 HA ILE 31 HA ILE 31 -16.460 4.075 -10.879 239 HB ILE 31 HB ILE 31 -18.039 1.645 -10.030 240 HG12 ILE 31 1HG1 ILE 31 -17.921 1.751 -12.453 241 HG13 ILE 31 2HG1 ILE 31 -19.528 2.242 -11.928 242 HG21 ILE 31 1HG2 ILE 31 -18.793 3.323 -8.646 243 HG22 ILE 31 2HG2 ILE 31 -18.495 4.587 -9.838 244 HG23 ILE 31 3HG2 ILE 31 -19.872 3.502 -10.029 245 HD11 ILE 31 3HD1 ILE 31 -18.682 4.629 -12.111 246 HD12 ILE 31 1HD1 ILE 31 -17.307 3.952 -12.983 247 HD13 ILE 31 2HD1 ILE 31 -18.941 3.745 -13.615 248 H GLU 32 H GLU 32 -15.272 1.265 -9.205 249 HA GLU 32 HA GLU 32 -15.699 2.103 -6.555 250 HB2 GLU 32 1HB GLU 32 -13.451 0.381 -7.612 251 HB3 GLU 32 2HB GLU 32 -13.996 0.469 -5.943 252 HG2 GLU 32 1HG GLU 32 -15.942 -0.300 -8.060 253 HG3 GLU 32 2HG GLU 32 -14.757 -1.481 -7.506 254 H ASN 33 H ASN 33 -13.187 2.841 -8.883 255 HA ASN 33 HA ASN 33 -11.451 4.112 -6.987 256 HB2 ASN 33 1HB ASN 33 -11.219 3.217 -9.624 257 HB3 ASN 33 2HB ASN 33 -11.052 4.967 -9.731 258 HD21 ASN 33 2HD2 ASN 33 -9.262 5.949 -8.908 259 HD22 ASN 33 1HD2 ASN 33 -7.899 5.084 -8.292 260 H VAL 34 H VAL 34 -14.082 5.102 -9.044 261 HA VAL 34 HA VAL 34 -13.597 7.883 -9.043 262 HB VAL 34 HB VAL 34 -16.231 6.422 -9.277 263 HG11 VAL 34 1HG1 VAL 34 -16.584 8.746 -8.702 264 HG12 VAL 34 2HG1 VAL 34 -15.484 9.257 -9.984 265 HG13 VAL 34 3HG1 VAL 34 -17.013 8.477 -10.392 266 HG21 VAL 34 3HG2 VAL 34 -14.090 6.267 -10.969 267 HG22 VAL 34 1HG2 VAL 34 -15.772 6.008 -11.431 268 HG23 VAL 34 2HG2 VAL 34 -15.024 7.586 -11.674 269 H LYS 35 H LYS 35 -15.729 5.883 -7.009 270 HA LYS 35 HA LYS 35 -16.694 7.936 -5.377 271 HB2 LYS 35 1HB LYS 35 -17.134 6.096 -3.720 272 HB3 LYS 35 2HB LYS 35 -17.783 5.813 -5.330 273 HG2 LYS 35 1HG LYS 35 -16.195 4.184 -5.818 274 HG3 LYS 35 2HG LYS 35 -15.113 4.719 -4.531 275 HD2 LYS 35 1HD LYS 35 -17.829 3.727 -3.806 276 HD3 LYS 35 2HD LYS 35 -16.589 2.555 -4.258 277 HE2 LYS 35 1HE LYS 35 -15.175 4.058 -2.547 278 HE3 LYS 35 2HE LYS 35 -16.787 4.298 -1.875 279 HZ1 LYS 35 3HZ LYS 35 -15.119 1.946 -1.858 280 HZ2 LYS 35 1HZ LYS 35 -16.728 1.640 -2.282 281 HZ3 LYS 35 2HZ LYS 35 -16.370 2.393 -0.811 282 H ALA 36 H ALA 36 -13.664 6.233 -5.352 283 HA ALA 36 HA ALA 36 -12.801 6.664 -2.747 284 HB1 ALA 36 1HB ALA 36 -10.984 5.653 -3.520 285 HB2 ALA 36 2HB ALA 36 -11.670 5.737 -5.144 286 HB3 ALA 36 3HB ALA 36 -10.615 7.026 -4.564 287 H LYS 37 H LYS 37 -12.589 8.798 -5.569 288 HA LYS 37 HA LYS 37 -11.217 10.872 -4.143 289 HB2 LYS 37 1HB LYS 37 -12.548 10.735 -6.842 290 HB3 LYS 37 2HB LYS 37 -11.862 12.230 -6.218 291 HG2 LYS 37 1HG LYS 37 -10.058 11.502 -7.360 292 HG3 LYS 37 2HG LYS 37 -9.760 10.629 -5.855 293 HD2 LYS 37 1HD LYS 37 -11.148 8.742 -6.921 294 HD3 LYS 37 2HD LYS 37 -10.883 9.600 -8.441 295 HE2 LYS 37 1HE LYS 37 -8.478 9.189 -6.802 296 HE3 LYS 37 2HE LYS 37 -9.218 7.714 -7.423 297 HZ1 LYS 37 3HZ LYS 37 -8.257 10.038 -8.996 298 HZ2 LYS 37 1HZ LYS 37 -9.169 8.775 -9.656 299 HZ3 LYS 37 2HZ LYS 37 -7.638 8.463 -9.008 300 H ILE 38 H ILE 38 -14.544 10.074 -4.832 301 HA ILE 38 HA ILE 38 -15.723 12.563 -4.278 302 HB ILE 38 HB ILE 38 -16.876 9.801 -3.872 303 HG12 ILE 38 1HG1 ILE 38 -16.143 10.256 -6.185 304 HG13 ILE 38 2HG1 ILE 38 -17.895 10.129 -6.068 305 HG21 ILE 38 1HG2 ILE 38 -19.060 10.925 -4.012 306 HG22 ILE 38 2HG2 ILE 38 -18.123 11.453 -2.615 307 HG23 ILE 38 3HG2 ILE 38 -18.239 12.485 -4.040 308 HD11 ILE 38 3HD1 ILE 38 -17.332 11.939 -7.524 309 HD12 ILE 38 1HD1 ILE 38 -18.020 12.599 -6.041 310 HD13 ILE 38 2HD1 ILE 38 -16.277 12.651 -6.305 311 H GLN 39 H GLN 39 -14.567 10.008 -2.197 312 HA GLN 39 HA GLN 39 -15.877 10.585 0.172 313 HB2 GLN 39 1HB GLN 39 -13.080 9.583 -0.340 314 HB3 GLN 39 2HB GLN 39 -13.756 9.714 1.278 315 HG2 GLN 39 1HG GLN 39 -15.381 8.077 0.849 316 HG3 GLN 39 2HG GLN 39 -15.115 8.153 -0.892 317 HE21 GLN 39 2HE2 GLN 39 -15.110 5.742 0.300 318 HE22 GLN 39 1HE2 GLN 39 -13.510 5.094 0.362 319 H ASP 40 H ASP 40 -13.116 12.184 -1.304 320 HA ASP 40 HA ASP 40 -12.601 13.870 0.964 321 HB2 ASP 40 1HB ASP 40 -10.910 13.148 -0.813 322 HB3 ASP 40 2HB ASP 40 -11.653 14.357 -1.856 323 H LYS 41 H LYS 41 -14.663 13.972 -1.798 324 HA LYS 41 HA LYS 41 -15.058 16.821 -1.773 325 HB2 LYS 41 1HB LYS 41 -16.872 14.786 -3.056 326 HB3 LYS 41 2HB LYS 41 -16.635 16.468 -3.512 327 HG2 LYS 41 1HG LYS 41 -14.533 14.324 -3.740 328 HG3 LYS 41 2HG LYS 41 -15.576 14.860 -5.060 329 HD2 LYS 41 1HD LYS 41 -13.809 16.223 -5.476 330 HD3 LYS 41 2HD LYS 41 -14.624 17.235 -4.281 331 HE2 LYS 41 1HE LYS 41 -13.141 16.637 -2.587 332 HE3 LYS 41 2HE LYS 41 -12.599 15.193 -3.440 333 HZ1 LYS 41 3HZ LYS 41 -10.860 16.700 -3.675 334 HZ2 LYS 41 1HZ LYS 41 -11.888 18.012 -3.965 335 HZ3 LYS 41 2HZ LYS 41 -11.682 16.822 -5.149 336 H GLU 42 H GLU 42 -17.052 14.010 -0.865 337 HA GLU 42 HA GLU 42 -18.567 15.796 0.924 338 HB2 GLU 42 1HB GLU 42 -19.553 13.519 -0.788 339 HB3 GLU 42 2HB GLU 42 -20.485 14.158 0.558 340 HG2 GLU 42 1HG GLU 42 -19.610 15.661 -1.897 341 HG3 GLU 42 2HG GLU 42 -21.245 15.133 -1.506 342 H GLY 43 H GLY 43 -17.181 12.609 0.403 343 HA2 GLY 43 1HA GLY 43 -16.359 11.102 1.946 344 HA3 GLY 43 2HA GLY 43 -16.738 12.261 3.211 345 H ILE 44 H ILE 44 -18.233 9.886 1.041 346 HA ILE 44 HA ILE 44 -20.184 9.321 3.176 347 HB ILE 44 HB ILE 44 -21.745 8.603 1.315 348 HG12 ILE 44 1HG1 ILE 44 -19.801 10.224 -0.344 349 HG13 ILE 44 2HG1 ILE 44 -20.067 8.489 -0.478 350 HG21 ILE 44 1HG2 ILE 44 -21.685 11.375 0.724 351 HG22 ILE 44 2HG2 ILE 44 -22.733 10.514 1.849 352 HG23 ILE 44 3HG2 ILE 44 -21.191 11.165 2.404 353 HD11 ILE 44 3HD1 ILE 44 -22.439 8.989 -1.075 354 HD12 ILE 44 1HD1 ILE 44 -21.995 10.694 -1.142 355 HD13 ILE 44 2HD1 ILE 44 -21.242 9.542 -2.246 356 HA PRO 45 HA PRO 45 -18.880 5.129 3.025 357 HB2 PRO 45 1HB PRO 45 -21.179 3.859 3.711 358 HB3 PRO 45 2HB PRO 45 -20.210 4.782 4.865 359 HG2 PRO 45 1HG PRO 45 -22.686 5.597 3.393 360 HG3 PRO 45 2HG PRO 45 -22.253 5.869 5.091 361 HD2 PRO 45 1HD PRO 45 -21.995 7.787 3.196 362 HD3 PRO 45 2HD PRO 45 -20.900 7.667 4.589 363 HA PRO 46 HA PRO 46 -19.906 3.194 -0.788 364 HB2 PRO 46 1HB PRO 46 -19.837 0.554 -0.158 365 HB3 PRO 46 2HB PRO 46 -18.384 1.554 -0.266 366 HG2 PRO 46 1HG PRO 46 -19.927 0.709 2.156 367 HG3 PRO 46 2HG PRO 46 -18.172 0.763 1.911 368 HD2 PRO 46 1HD PRO 46 -19.513 2.689 3.260 369 HD3 PRO 46 2HD PRO 46 -18.060 3.032 2.300 370 H ASP 47 H ASP 47 -21.877 2.518 1.990 371 HA ASP 47 HA ASP 47 -23.901 1.042 0.613 372 HB2 ASP 47 1HB ASP 47 -24.080 2.530 3.242 373 HB3 ASP 47 2HB ASP 47 -25.208 1.309 2.659 374 H GLN 48 H GLN 48 -23.417 4.425 1.468 375 HA GLN 48 HA GLN 48 -25.974 5.151 0.260 376 HB2 GLN 48 1HB GLN 48 -23.942 6.979 1.542 377 HB3 GLN 48 2HB GLN 48 -25.624 7.343 1.180 378 HG2 GLN 48 1HG GLN 48 -26.390 5.843 2.866 379 HG3 GLN 48 2HG GLN 48 -24.761 5.222 3.127 380 HE21 GLN 48 2HE2 GLN 48 -24.841 5.746 5.315 381 HE22 GLN 48 1HE2 GLN 48 -24.708 7.376 5.871 382 H GLN 49 H GLN 49 -22.586 5.161 -0.418 383 HA GLN 49 HA GLN 49 -22.544 7.173 -2.405 384 HB2 GLN 49 1HB GLN 49 -20.497 6.376 -1.353 385 HB3 GLN 49 2HB GLN 49 -20.752 4.769 -2.021 386 HG2 GLN 49 1HG GLN 49 -19.119 5.795 -3.366 387 HG3 GLN 49 2HG GLN 49 -20.612 5.814 -4.302 388 HE21 GLN 49 2HE2 GLN 49 -21.615 7.752 -4.740 389 HE22 GLN 49 1HE2 GLN 49 -20.859 9.280 -4.466 390 H ARG 50 H ARG 50 -23.525 7.167 -4.305 391 HA ARG 50 HA ARG 50 -23.570 4.746 -5.916 392 HB2 ARG 50 1HB ARG 50 -26.070 6.192 -5.037 393 HB3 ARG 50 2HB ARG 50 -26.026 5.084 -6.402 394 HG2 ARG 50 1HG ARG 50 -25.212 4.300 -3.616 395 HG3 ARG 50 2HG ARG 50 -26.852 4.117 -4.242 396 HD2 ARG 50 1HD ARG 50 -24.607 3.016 -5.848 397 HD3 ARG 50 2HD ARG 50 -25.071 2.161 -4.378 398 HE ARG 50 HE ARG 50 -27.287 2.788 -6.096 399 HH11 ARG 50 1HH1 ARG 50 -24.753 0.501 -5.410 400 HH12 ARG 50 2HH1 ARG 50 -25.574 -0.830 -6.155 401 HH21 ARG 50 1HH2 ARG 50 -28.378 1.043 -7.080 402 HH22 ARG 50 2HH2 ARG 50 -27.636 -0.521 -7.105 403 H LEU 51 H LEU 51 -22.840 5.325 -7.843 404 HA LEU 51 HA LEU 51 -23.153 8.093 -8.731 405 HB2 LEU 51 1HB LEU 51 -21.353 5.833 -9.502 406 HB3 LEU 51 2HB LEU 51 -21.588 7.191 -10.600 407 HG LEU 51 HG LEU 51 -19.555 7.484 -9.323 408 HD11 LEU 51 1HD1 LEU 51 -21.449 9.367 -9.709 409 HD12 LEU 51 2HD1 LEU 51 -19.859 9.692 -9.021 410 HD13 LEU 51 3HD1 LEU 51 -21.248 9.465 -7.959 411 HD21 LEU 51 3HD2 LEU 51 -19.510 7.630 -6.938 412 HD22 LEU 51 1HD2 LEU 51 -20.294 6.112 -7.373 413 HD23 LEU 51 2HD2 LEU 51 -21.265 7.485 -6.842 414 H ILE 52 H ILE 52 -24.207 8.682 -10.580 415 HA ILE 52 HA ILE 52 -25.717 6.553 -11.951 416 HB ILE 52 HB ILE 52 -26.575 9.434 -11.716 417 HG12 ILE 52 1HG1 ILE 52 -26.517 8.479 -9.479 418 HG13 ILE 52 2HG1 ILE 52 -28.188 8.639 -10.011 419 HG21 ILE 52 1HG2 ILE 52 -27.572 8.346 -13.589 420 HG22 ILE 52 2HG2 ILE 52 -27.959 6.920 -12.628 421 HG23 ILE 52 3HG2 ILE 52 -28.793 8.443 -12.321 422 HD11 ILE 52 3HD1 ILE 52 -27.757 6.531 -8.837 423 HD12 ILE 52 1HD1 ILE 52 -28.294 6.279 -10.498 424 HD13 ILE 52 2HD1 ILE 52 -26.589 6.092 -10.084 425 H PHE 53 H PHE 53 -25.914 6.632 -14.181 426 HA PHE 53 HA PHE 53 -24.490 8.749 -15.612 427 HB2 PHE 53 1HB PHE 53 -22.875 6.903 -15.256 428 HB3 PHE 53 2HB PHE 53 -23.977 5.805 -16.080 429 HD1 PHE 53 HD2 PHE 53 -21.811 8.756 -16.519 430 HD2 PHE 53 HD1 PHE 53 -24.084 5.711 -18.437 431 HE1 PHE 53 HE2 PHE 53 -20.791 9.357 -18.676 432 HE2 PHE 53 HE1 PHE 53 -23.067 6.307 -20.597 433 HZ PHE 53 HZ PHE 53 -21.418 8.133 -20.718 434 H ALA 54 H ALA 54 -25.915 9.549 -16.997 435 HA ALA 54 HA ALA 54 -27.605 9.729 -18.512 436 HB1 ALA 54 1HB ALA 54 -26.560 6.996 -19.219 437 HB2 ALA 54 2HB ALA 54 -27.784 7.844 -20.164 438 HB3 ALA 54 3HB ALA 54 -26.173 8.537 -19.985 439 H GLY 55 H GLY 55 -28.244 8.730 -15.850 440 HA2 GLY 55 1HA GLY 55 -30.350 8.291 -14.919 441 HA3 GLY 55 2HA GLY 55 -30.886 7.677 -16.477 442 H LYS 56 H LYS 56 -28.154 6.123 -16.310 443 HA LYS 56 HA LYS 56 -29.351 3.807 -14.972 444 HB2 LYS 56 1HB LYS 56 -28.700 3.366 -17.237 445 HB3 LYS 56 2HB LYS 56 -27.104 4.057 -16.973 446 HG2 LYS 56 1HG LYS 56 -26.516 2.232 -15.503 447 HG3 LYS 56 2HG LYS 56 -28.143 1.562 -15.644 448 HD2 LYS 56 1HD LYS 56 -27.800 1.190 -18.026 449 HD3 LYS 56 2HD LYS 56 -26.193 1.913 -17.923 450 HE2 LYS 56 1HE LYS 56 -25.726 0.103 -16.155 451 HE3 LYS 56 2HE LYS 56 -27.167 -0.689 -16.791 452 HZ1 LYS 56 3HZ LYS 56 -26.056 -0.485 -19.036 453 HZ2 LYS 56 1HZ LYS 56 -25.374 -1.601 -17.962 454 HZ3 LYS 56 2HZ LYS 56 -24.635 -0.099 -18.204 455 H GLN 57 H GLN 57 -28.633 3.142 -13.060 456 HA GLN 57 HA GLN 57 -26.602 4.500 -11.652 457 HB2 GLN 57 1HB GLN 57 -26.862 2.621 -9.992 458 HB3 GLN 57 2HB GLN 57 -28.345 3.477 -10.395 459 HG2 GLN 57 1HG GLN 57 -27.760 1.105 -12.032 460 HG3 GLN 57 2HG GLN 57 -28.115 0.800 -10.333 461 HE21 GLN 57 2HE2 GLN 57 -29.671 0.081 -12.659 462 HE22 GLN 57 1HE2 GLN 57 -31.212 0.841 -12.476 463 H LEU 58 H LEU 58 -24.495 4.009 -11.228 464 HA LEU 58 HA LEU 58 -23.284 1.980 -12.954 465 HB2 LEU 58 1HB LEU 58 -21.909 4.104 -11.321 466 HB3 LEU 58 2HB LEU 58 -21.205 3.120 -12.602 467 HG LEU 58 HG LEU 58 -23.382 5.159 -13.043 468 HD11 LEU 58 1HD1 LEU 58 -21.267 6.262 -14.216 469 HD12 LEU 58 2HD1 LEU 58 -20.433 5.411 -12.916 470 HD13 LEU 58 3HD1 LEU 58 -21.692 6.586 -12.535 471 HD21 LEU 58 3HD2 LEU 58 -22.121 3.133 -14.687 472 HD22 LEU 58 1HD2 LEU 58 -21.943 4.748 -15.371 473 HD23 LEU 58 2HD2 LEU 58 -23.549 4.119 -15.004 474 H GLU 59 H GLU 59 -21.504 0.672 -12.089 475 HA GLU 59 HA GLU 59 -21.294 0.321 -9.243 476 HB2 GLU 59 1HB GLU 59 -22.932 -1.526 -10.912 477 HB3 GLU 59 2HB GLU 59 -21.922 -2.231 -9.658 478 HG2 GLU 59 1HG GLU 59 -23.057 -0.379 -8.174 479 HG3 GLU 59 2HG GLU 59 -24.305 -0.477 -9.415 480 H ASP 60 H ASP 60 -19.795 -1.504 -8.704 481 HA ASP 60 HA ASP 60 -17.419 -1.292 -10.153 482 HB2 ASP 60 1HB ASP 60 -17.615 -1.992 -7.758 483 HB3 ASP 60 2HB ASP 60 -18.191 -3.562 -8.311 484 H GLY 61 H GLY 61 -16.204 -3.119 -11.157 485 HA2 GLY 61 1HA GLY 61 -16.360 -5.298 -12.261 486 HA3 GLY 61 2HA GLY 61 -18.014 -4.883 -12.686 487 H ARG 62 H ARG 62 -17.734 -2.328 -13.652 488 HA ARG 62 HA ARG 62 -16.156 -2.815 -16.082 489 HB2 ARG 62 1HB ARG 62 -18.640 -1.220 -15.530 490 HB3 ARG 62 2HB ARG 62 -17.651 -0.871 -16.942 491 HG2 ARG 62 1HG ARG 62 -18.823 -3.573 -16.324 492 HG3 ARG 62 2HG ARG 62 -19.567 -2.379 -17.390 493 HD2 ARG 62 1HD ARG 62 -17.539 -2.420 -18.796 494 HD3 ARG 62 2HD ARG 62 -16.867 -3.672 -17.753 495 HE ARG 62 HE ARG 62 -19.407 -4.450 -18.732 496 HH11 ARG 62 1HH1 ARG 62 -16.086 -4.072 -19.706 497 HH12 ARG 62 2HH1 ARG 62 -16.173 -5.286 -20.939 498 HH21 ARG 62 1HH2 ARG 62 -19.535 -6.050 -20.352 499 HH22 ARG 62 2HH2 ARG 62 -18.136 -6.410 -21.307 500 H THR 63 H THR 63 -15.336 -0.766 -17.153 501 HA THR 63 HA THR 63 -14.048 0.900 -15.099 502 HB THR 63 HB THR 63 -12.371 -0.210 -16.348 503 HG1 THR 63 HG1 THR 63 -11.618 1.699 -17.746 504 HG21 THR 63 3HG2 THR 63 -13.052 -1.091 -18.302 505 HG22 THR 63 1HG2 THR 63 -12.540 0.447 -18.996 506 HG23 THR 63 2HG2 THR 63 -14.234 0.188 -18.576 507 H LEU 64 H LEU 64 -13.645 3.164 -15.638 508 HA LEU 64 HA LEU 64 -15.929 4.569 -16.304 509 HB2 LEU 64 1HB LEU 64 -13.030 5.322 -16.277 510 HB3 LEU 64 2HB LEU 64 -14.262 6.486 -16.759 511 HG LEU 64 HG LEU 64 -13.684 6.850 -14.456 512 HD11 LEU 64 1HD1 LEU 64 -16.322 5.429 -14.365 513 HD12 LEU 64 2HD1 LEU 64 -16.112 6.931 -15.266 514 HD13 LEU 64 3HD1 LEU 64 -15.823 6.898 -13.526 515 HD21 LEU 64 3HD2 LEU 64 -14.481 3.986 -13.947 516 HD22 LEU 64 1HD2 LEU 64 -13.922 5.158 -12.752 517 HD23 LEU 64 2HD2 LEU 64 -12.820 4.580 -14.002 518 H SER 65 H SER 65 -13.346 3.417 -18.373 519 HA SER 65 HA SER 65 -14.111 4.904 -20.680 520 HB2 SER 65 1HB SER 65 -11.846 4.041 -20.477 521 HB3 SER 65 2HB SER 65 -12.451 2.386 -20.408 522 HG SER 65 HG SER 65 -11.775 2.838 -22.499 523 H GLU 66 H GLU 66 -15.014 1.803 -19.337 524 HA GLU 66 HA GLU 66 -16.360 0.863 -21.680 525 HB2 GLU 66 1HB GLU 66 -16.207 -0.024 -18.822 526 HB3 GLU 66 2HB GLU 66 -17.430 -0.712 -19.882 527 HG2 GLU 66 1HG GLU 66 -14.562 -0.679 -20.713 528 HG3 GLU 66 2HG GLU 66 -15.161 -1.912 -19.604 529 H TYR 67 H TYR 67 -17.191 2.900 -19.015 530 HA TYR 67 HA TYR 67 -20.050 2.680 -19.529 531 HB2 TYR 67 1HB TYR 67 -18.361 3.877 -17.392 532 HB3 TYR 67 2HB TYR 67 -19.935 4.610 -17.682 533 HD1 TYR 67 HD1 TYR 67 -21.788 2.560 -18.122 534 HD2 TYR 67 HD2 TYR 67 -18.373 2.454 -15.587 535 HE1 TYR 67 HE1 TYR 67 -22.857 0.809 -16.766 536 HE2 TYR 67 HE2 TYR 67 -19.432 0.702 -14.224 537 HH TYR 67 HH TYR 67 -22.289 -0.929 -15.224 538 H ASN 68 H ASN 68 -17.819 4.028 -21.252 539 HA ASN 68 HA ASN 68 -17.667 5.784 -22.689 540 HB2 ASN 68 1HB ASN 68 -20.158 4.951 -22.952 541 HB3 ASN 68 2HB ASN 68 -20.530 6.505 -22.211 542 HD21 ASN 68 2HD2 ASN 68 -18.555 5.103 -24.798 543 HD22 ASN 68 1HD2 ASN 68 -18.802 6.394 -25.919 544 H ILE 69 H ILE 69 -17.379 6.181 -19.737 545 HA ILE 69 HA ILE 69 -18.256 8.909 -19.305 546 HB ILE 69 HB ILE 69 -16.542 7.116 -17.581 547 HG12 ILE 69 1HG1 ILE 69 -19.374 7.925 -17.002 548 HG13 ILE 69 2HG1 ILE 69 -19.045 6.565 -18.069 549 HG21 ILE 69 1HG2 ILE 69 -16.091 8.906 -16.351 550 HG22 ILE 69 2HG2 ILE 69 -17.018 9.919 -17.456 551 HG23 ILE 69 3HG2 ILE 69 -17.817 9.149 -16.086 552 HD11 ILE 69 3HD1 ILE 69 -17.662 5.592 -16.207 553 HD12 ILE 69 1HD1 ILE 69 -18.324 6.856 -15.171 554 HD13 ILE 69 2HD1 ILE 69 -19.400 5.674 -15.918 555 H GLN 70 H GLN 70 -17.166 10.296 -20.611 556 HA GLN 70 HA GLN 70 -14.267 10.105 -20.826 557 HB2 GLN 70 1HB GLN 70 -16.125 12.109 -22.113 558 HB3 GLN 70 2HB GLN 70 -14.446 11.804 -22.536 559 HG2 GLN 70 1HG GLN 70 -16.597 9.719 -22.763 560 HG3 GLN 70 2HG GLN 70 -16.173 10.820 -24.074 561 HE21 GLN 70 2HE2 GLN 70 -15.681 7.816 -22.909 562 HE22 GLN 70 1HE2 GLN 70 -14.139 7.470 -23.606 563 H LYS 71 H LYS 71 -13.486 12.692 -21.092 564 HA LYS 71 HA LYS 71 -13.333 13.545 -18.370 565 HB2 LYS 71 1HB LYS 71 -11.876 15.290 -19.182 566 HB3 LYS 71 2HB LYS 71 -11.466 13.784 -19.992 567 HG2 LYS 71 1HG LYS 71 -13.201 14.771 -21.772 568 HG3 LYS 71 2HG LYS 71 -12.599 16.280 -21.084 569 HD2 LYS 71 1HD LYS 71 -10.268 15.377 -21.479 570 HD3 LYS 71 2HD LYS 71 -11.023 14.091 -22.423 571 HE2 LYS 71 1HE LYS 71 -10.256 15.916 -23.856 572 HE3 LYS 71 2HE LYS 71 -12.011 15.751 -23.912 573 HZ1 LYS 71 3HZ LYS 71 -10.634 17.698 -22.152 574 HZ2 LYS 71 1HZ LYS 71 -12.279 17.636 -22.544 575 HZ3 LYS 71 2HZ LYS 71 -11.146 18.078 -23.719 576 H GLU 72 H GLU 72 -15.597 14.053 -20.795 577 HA GLU 72 HA GLU 72 -16.580 16.487 -19.455 578 HB2 GLU 72 1HB GLU 72 -17.748 16.926 -21.689 579 HB3 GLU 72 2HB GLU 72 -16.011 17.190 -21.623 580 HG2 GLU 72 1HG GLU 72 -15.579 15.143 -22.760 581 HG3 GLU 72 2HG GLU 72 -17.269 14.658 -22.643 582 H SER 73 H SER 73 -17.103 13.621 -18.894 583 HA SER 73 HA SER 73 -19.815 13.146 -19.758 584 HB2 SER 73 1HB SER 73 -19.511 11.022 -19.009 585 HB3 SER 73 2HB SER 73 -17.807 11.478 -19.014 586 HG SER 73 HG SER 73 -19.143 10.636 -16.973 587 H THR 74 H THR 74 -21.642 13.023 -18.395 588 HA THR 74 HA THR 74 -21.477 14.822 -16.079 589 HB THR 74 HB THR 74 -24.136 13.999 -17.088 590 HG1 THR 74 HG1 THR 74 -23.734 14.593 -19.071 591 HG21 THR 74 3HG2 THR 74 -22.906 16.180 -15.641 592 HG22 THR 74 1HG2 THR 74 -24.606 15.722 -15.748 593 HG23 THR 74 2HG2 THR 74 -23.897 16.775 -16.973 594 H LEU 75 H LEU 75 -21.368 13.855 -14.168 595 HA LEU 75 HA LEU 75 -22.716 11.263 -13.812 596 HB2 LEU 75 1HB LEU 75 -20.172 12.371 -12.883 597 HB3 LEU 75 2HB LEU 75 -21.106 11.568 -11.622 598 HG LEU 75 HG LEU 75 -19.410 10.124 -12.747 599 HD11 LEU 75 1HD1 LEU 75 -21.793 8.691 -13.498 600 HD12 LEU 75 2HD1 LEU 75 -22.025 9.548 -11.974 601 HD13 LEU 75 3HD1 LEU 75 -20.689 8.411 -12.151 602 HD21 LEU 75 3HD2 LEU 75 -21.267 10.399 -15.108 603 HD22 LEU 75 1HD2 LEU 75 -19.907 9.283 -14.986 604 HD23 LEU 75 2HD2 LEU 75 -19.620 11.023 -15.005 605 H HIS 76 H HIS 76 -23.864 10.867 -11.857 606 HA HIS 76 HA HIS 76 -24.610 13.261 -10.326 607 HB2 HIS 76 1HB HIS 76 -26.391 11.417 -11.850 608 HB3 HIS 76 2HB HIS 76 -26.975 12.047 -10.313 609 HD1 HIS 76 HD1 HIS 76 -26.247 13.039 -13.819 610 HD2 HIS 76 HD2 HIS 76 -27.460 14.832 -10.272 611 HE1 HIS 76 HE1 HIS 76 -27.069 15.325 -14.468 612 H LEU 77 H LEU 77 -24.302 12.944 -8.231 613 HA LEU 77 HA LEU 77 -24.083 10.210 -7.219 614 HB2 LEU 77 1HB LEU 77 -23.116 11.283 -5.213 615 HB3 LEU 77 2HB LEU 77 -22.230 11.629 -6.696 616 HG LEU 77 HG LEU 77 -24.136 13.710 -6.253 617 HD11 LEU 77 1HD1 LEU 77 -22.219 13.537 -3.968 618 HD12 LEU 77 2HD1 LEU 77 -23.800 12.762 -3.861 619 HD13 LEU 77 3HD1 LEU 77 -23.687 14.501 -4.132 620 HD21 LEU 77 3HD2 LEU 77 -21.190 13.394 -6.521 621 HD22 LEU 77 1HD2 LEU 77 -21.820 14.926 -5.915 622 HD23 LEU 77 2HD2 LEU 77 -22.323 14.331 -7.497 623 H VAL 78 H VAL 78 -25.828 9.316 -6.359 624 HA VAL 78 HA VAL 78 -27.757 11.049 -4.957 625 HB VAL 78 HB VAL 78 -29.423 9.219 -5.409 626 HG11 VAL 78 1HG1 VAL 78 -29.958 10.000 -7.585 627 HG12 VAL 78 2HG1 VAL 78 -29.185 11.344 -6.742 628 HG13 VAL 78 3HG1 VAL 78 -28.276 10.405 -7.927 629 HG21 VAL 78 3HG2 VAL 78 -28.793 7.297 -6.327 630 HG22 VAL 78 1HG2 VAL 78 -28.127 8.145 -7.723 631 HG23 VAL 78 2HG2 VAL 78 -27.123 7.862 -6.301 632 H LEU 79 H LEU 79 -27.851 10.788 -2.833 633 HA LEU 79 HA LEU 79 -26.637 8.439 -1.613 634 HB2 LEU 79 1HB LEU 79 -27.467 11.138 -0.661 635 HB3 LEU 79 2HB LEU 79 -27.321 9.830 0.511 636 HG LEU 79 HG LEU 79 -24.968 9.542 -0.110 637 HD11 LEU 79 1HD1 LEU 79 -24.605 10.172 -2.263 638 HD12 LEU 79 2HD1 LEU 79 -24.096 11.654 -1.456 639 HD13 LEU 79 3HD1 LEU 79 -25.706 11.546 -2.167 640 HD21 LEU 79 3HD2 LEU 79 -25.192 10.921 1.738 641 HD22 LEU 79 1HD2 LEU 79 -25.957 12.212 0.811 642 HD23 LEU 79 2HD2 LEU 79 -24.228 11.908 0.639 643 H ARG 80 H ARG 80 -27.856 6.715 -1.250 644 HA ARG 80 HA ARG 80 -30.428 7.013 0.055 645 HB2 ARG 80 1HB ARG 80 -30.124 5.777 -2.679 646 HB3 ARG 80 2HB ARG 80 -31.485 5.417 -1.625 647 HG2 ARG 80 1HG ARG 80 -30.738 8.149 -2.648 648 HG3 ARG 80 2HG ARG 80 -32.037 7.129 -3.273 649 HD2 ARG 80 1HD ARG 80 -31.830 8.341 -0.521 650 HD3 ARG 80 2HD ARG 80 -32.979 8.767 -1.788 651 HE ARG 80 HE ARG 80 -33.126 6.522 0.011 652 HH11 ARG 80 1HH1 ARG 80 -34.171 7.851 -3.032 653 HH12 ARG 80 2HH1 ARG 80 -35.603 6.878 -3.113 654 HH21 ARG 80 1HH2 ARG 80 -35.008 5.236 -0.085 655 HH22 ARG 80 2HH2 ARG 80 -36.078 5.392 -1.436 656 H LEU 81 H LEU 81 -31.041 5.210 1.229 657 HA LEU 81 HA LEU 81 -29.277 2.866 1.101 658 HB2 LEU 81 1HB LEU 81 -29.114 4.757 3.087 659 HB3 LEU 81 2HB LEU 81 -30.174 3.539 3.796 660 HG LEU 81 HG LEU 81 -27.957 3.055 4.499 661 HD11 LEU 81 1HD1 LEU 81 -28.755 1.215 2.249 662 HD12 LEU 81 2HD1 LEU 81 -29.259 1.102 3.935 663 HD13 LEU 81 3HD1 LEU 81 -27.571 0.835 3.499 664 HD21 LEU 81 3HD2 LEU 81 -26.677 2.497 1.982 665 HD22 LEU 81 1HD2 LEU 81 -26.147 3.534 3.306 666 HD23 LEU 81 2HD2 LEU 81 -27.208 4.177 2.053 667 H ARG 82 H ARG 82 -30.645 1.342 0.400 668 HA ARG 82 HA ARG 82 -33.380 1.253 1.402 669 HB2 ARG 82 1HB ARG 82 -33.648 -0.593 -0.255 670 HB3 ARG 82 2HB ARG 82 -33.134 0.931 -0.966 671 HG2 ARG 82 1HG ARG 82 -30.902 0.152 -1.225 672 HG3 ARG 82 2HG ARG 82 -31.236 -1.293 -0.268 673 HD2 ARG 82 1HD ARG 82 -31.449 -2.210 -2.332 674 HD3 ARG 82 2HD ARG 82 -33.097 -1.611 -2.148 675 HE ARG 82 HE ARG 82 -31.493 0.386 -3.317 676 HH11 ARG 82 1HH1 ARG 82 -32.937 -2.696 -4.050 677 HH12 ARG 82 2HH1 ARG 82 -33.067 -2.378 -5.748 678 HH21 ARG 82 1HH2 ARG 82 -31.660 0.816 -5.551 679 HH22 ARG 82 2HH2 ARG 82 -32.340 -0.380 -6.601 680 H GLY 83 H GLY 83 -30.364 -0.520 1.624 681 HA2 GLY 83 1HA GLY 83 -29.928 -1.733 3.686 682 HA3 GLY 83 2HA GLY 83 -31.616 -2.223 3.684 683 H TYR 84 H TYR 84 -28.683 -3.446 3.352 684 HA TYR 84 HA TYR 84 -29.540 -5.833 2.124 685 HB2 TYR 84 1HB TYR 84 -29.301 -4.223 0.133 686 HB3 TYR 84 2HB TYR 84 -27.567 -4.335 0.411 687 HD1 TYR 84 HD1 TYR 84 -30.576 -6.421 -0.258 688 HD2 TYR 84 HD2 TYR 84 -26.341 -6.096 -0.511 689 HE1 TYR 84 HE1 TYR 84 -30.503 -8.486 -1.593 690 HE2 TYR 84 HE2 TYR 84 -26.257 -8.159 -1.848 691 HH TYR 84 HH TYR 84 -29.079 -9.624 -3.149 692 H ALA 85 H ALA 85 -28.348 -7.374 3.017 693 HA ALA 85 HA ALA 85 -25.529 -7.364 3.127 694 HB1 ALA 85 1HB ALA 85 -26.904 -6.121 5.371 695 HB2 ALA 85 2HB ALA 85 -25.843 -7.444 5.858 696 HB3 ALA 85 3HB ALA 85 -25.197 -6.091 4.930 697 H ASP 86 H ASP 86 -24.948 -9.431 3.095 698 HA ASP 86 HA ASP 86 -26.040 -11.400 4.831 699 HB2 ASP 86 1HB ASP 86 -27.919 -11.342 3.298 700 HB3 ASP 86 2HB ASP 86 -26.840 -11.519 1.917 701 H LEU 87 H LEU 87 -24.936 -13.408 4.701 702 HA LEU 87 HA LEU 87 -22.558 -13.375 2.962 703 HB2 LEU 87 1HB LEU 87 -22.552 -14.632 5.679 704 HB3 LEU 87 2HB LEU 87 -21.185 -14.126 4.688 705 HG LEU 87 HG LEU 87 -23.100 -12.200 5.996 706 HD11 LEU 87 1HD1 LEU 87 -22.061 -13.352 7.785 707 HD12 LEU 87 2HD1 LEU 87 -21.190 -11.831 7.592 708 HD13 LEU 87 3HD1 LEU 87 -20.491 -13.330 6.980 709 HD21 LEU 87 3HD2 LEU 87 -21.846 -11.383 4.030 710 HD22 LEU 87 1HD2 LEU 87 -20.340 -11.800 4.849 711 HD23 LEU 87 2HD2 LEU 87 -21.395 -10.558 5.524 712 H ARG 88 H ARG 88 -21.850 -15.349 2.148 713 HA ARG 88 HA ARG 88 -23.809 -17.534 2.370 714 HB2 ARG 88 1HB ARG 88 -23.549 -16.541 0.115 715 HB3 ARG 88 2HB ARG 88 -21.846 -16.979 0.139 716 HG2 ARG 88 1HG ARG 88 -22.884 -18.645 -1.128 717 HG3 ARG 88 2HG ARG 88 -22.629 -19.377 0.458 718 HD2 ARG 88 1HD ARG 88 -24.805 -19.979 0.067 719 HD3 ARG 88 2HD ARG 88 -25.042 -18.453 0.918 720 HE ARG 88 HE ARG 88 -24.928 -17.785 -1.740 721 HH11 ARG 88 1HH1 ARG 88 -26.888 -19.881 0.231 722 HH12 ARG 88 2HH1 ARG 88 -28.298 -19.711 -0.761 723 HH21 ARG 88 1HH2 ARG 88 -26.777 -17.554 -3.054 724 HH22 ARG 88 2HH2 ARG 88 -28.234 -18.388 -2.630 725 H GLU 89 H GLU 89 -23.185 -19.272 3.455 726 HA GLU 89 HA GLU 89 -20.705 -20.560 3.095 727 HB2 GLU 89 1HB GLU 89 -20.235 -18.447 4.611 728 HB3 GLU 89 2HB GLU 89 -20.877 -19.486 5.876 729 HG2 GLU 89 1HG GLU 89 -19.130 -20.981 5.725 730 HG3 GLU 89 2HG GLU 89 -18.722 -20.497 4.080 731 H ASP 90 H ASP 90 -20.446 -22.438 4.545 732 HA ASP 90 HA ASP 90 -22.809 -23.201 6.066 733 HB2 ASP 90 1HB ASP 90 -21.990 -24.437 3.479 734 HB3 ASP 90 2HB ASP 90 -22.586 -25.503 4.749 735 HA PRO 91 HA PRO 91 -19.952 -25.302 8.645 736 HB2 PRO 91 1HB PRO 91 -21.359 -27.489 9.423 737 HB3 PRO 91 2HB PRO 91 -21.724 -25.858 9.997 738 HG2 PRO 91 1HG PRO 91 -23.048 -27.445 7.831 739 HG3 PRO 91 2HG PRO 91 -23.786 -26.441 9.093 740 HD2 PRO 91 1HD PRO 91 -23.463 -25.577 6.548 741 HD3 PRO 91 2HD PRO 91 -23.388 -24.483 7.944 742 H ASP 92 H ASP 92 -19.321 -27.809 9.140 743 HA ASP 92 HA ASP 92 -18.367 -28.817 6.557 744 HB2 ASP 92 1HB ASP 92 -16.735 -28.261 8.405 745 HB3 ASP 92 2HB ASP 92 -17.407 -29.617 9.306 746 H ARG 93 H ARG 93 -19.905 -29.903 9.560 747 HA ARG 93 HA ARG 93 -20.536 -32.468 8.284 748 HB2 ARG 93 1HB ARG 93 -20.909 -31.682 11.177 749 HB3 ARG 93 2HB ARG 93 -21.023 -33.299 10.496 750 HG2 ARG 93 1HG ARG 93 -18.504 -31.656 10.476 751 HG3 ARG 93 2HG ARG 93 -18.912 -32.821 11.737 752 HD2 ARG 93 1HD ARG 93 -18.650 -33.453 8.800 753 HD3 ARG 93 2HD ARG 93 -17.413 -33.759 10.018 754 HE ARG 93 HE ARG 93 -19.661 -35.029 10.941 755 HH11 ARG 93 1HH1 ARG 93 -17.718 -35.169 8.056 756 HH12 ARG 93 2HH1 ARG 93 -18.046 -36.844 7.759 757 HH21 ARG 93 1HH2 ARG 93 -20.101 -37.235 10.561 758 HH22 ARG 93 2HH2 ARG 93 -19.403 -38.018 9.184 759 H GLN 94 H GLN 94 -22.619 -33.174 7.998 760 HA GLN 94 HA GLN 94 -24.673 -31.102 8.128 761 HB2 GLN 94 1HB GLN 94 -24.147 -32.569 6.057 762 HB3 GLN 94 2HB GLN 94 -25.041 -33.822 6.907 763 HG2 GLN 94 1HG GLN 94 -27.044 -32.690 6.750 764 HG3 GLN 94 2HG GLN 94 -26.260 -31.127 6.522 765 HE21 GLN 94 2HE2 GLN 94 -27.364 -30.606 4.674 766 HE22 GLN 94 1HE2 GLN 94 -27.130 -31.423 3.170 767 H ASP 95 H ASP 95 -25.617 -31.013 10.075 768 HA ASP 95 HA ASP 95 -26.812 -33.489 11.111 769 HB2 ASP 95 1HB ASP 95 -26.288 -32.769 13.417 770 HB3 ASP 95 2HB ASP 95 -24.834 -33.056 12.466 771 H HIS 96 H HIS 96 -28.820 -33.277 12.052 772 HA HIS 96 HA HIS 96 -30.017 -30.586 11.963 773 HB2 HIS 96 1HB HIS 96 -30.841 -31.956 10.101 774 HB3 HIS 96 2HB HIS 96 -31.338 -33.209 11.234 775 HD1 HIS 96 HD1 HIS 96 -33.394 -32.643 12.781 776 HD2 HIS 96 HD2 HIS 96 -32.617 -29.865 9.791 777 HE1 HIS 96 HE1 HIS 96 -35.465 -31.224 12.627 778 H HIS 97 H HIS 97 -30.918 -29.911 13.797 779 HA HIS 97 HA HIS 97 -31.959 -31.844 15.716 780 HB2 HIS 97 1HB HIS 97 -30.744 -30.516 17.560 781 HB3 HIS 97 2HB HIS 97 -29.802 -31.672 16.623 782 HD1 HIS 97 HD1 HIS 97 -30.687 -28.059 15.821 783 HD2 HIS 97 HD2 HIS 97 -27.374 -30.503 16.379 784 HE1 HIS 97 HE1 HIS 97 -28.692 -26.614 15.313 785 HA PRO 98 HA PRO 98 -35.078 -28.835 16.396 786 HB2 PRO 98 1HB PRO 98 -35.666 -29.225 19.017 787 HB3 PRO 98 2HB PRO 98 -36.116 -30.373 17.751 788 HG2 PRO 98 1HG PRO 98 -33.803 -30.457 19.649 789 HG3 PRO 98 2HG PRO 98 -34.884 -31.769 19.144 790 HD2 PRO 98 1HD PRO 98 -32.409 -31.437 18.099 791 HD3 PRO 98 2HD PRO 98 -33.761 -32.099 17.159 792 H GLY 99 H GLY 99 -32.537 -28.890 18.883 793 HA2 GLY 99 1HA GLY 99 -31.362 -26.599 18.880 794 HA3 GLY 99 2HA GLY 99 -32.960 -26.008 19.308 795 H SER 100 H SER 100 -30.457 -25.837 20.808 796 HA SER 100 HA SER 100 -31.188 -27.422 23.182 797 HB2 SER 100 1HB SER 100 -28.802 -27.008 23.900 798 HB3 SER 100 2HB SER 100 -28.979 -28.023 22.469 799 HG SER 100 HG SER 100 -28.299 -25.270 22.552 800 H GLY 101 H GLY 101 -32.667 -25.981 24.058 801 HA2 GLY 101 1HA GLY 101 -31.659 -23.291 24.712 802 HA3 GLY 101 2HA GLY 101 -33.354 -23.753 24.660 803 H ALA 102 H ALA 102 -30.523 -25.179 26.282 804 HA ALA 102 HA ALA 102 -31.345 -24.371 28.882 805 HB1 ALA 102 1HB ALA 102 -32.116 -27.101 27.934 806 HB2 ALA 102 2HB ALA 102 -31.734 -26.821 29.633 807 HB3 ALA 102 3HB ALA 102 -33.052 -25.934 28.868 808 H GLN 103 H GLN 103 -30.148 -25.937 30.565 809 HA GLN 103 HA GLN 103 -27.369 -25.925 29.700 810 HB2 GLN 103 1HB GLN 103 -28.663 -26.251 32.407 811 HB3 GLN 103 2HB GLN 103 -26.929 -26.377 32.145 812 HG2 GLN 103 1HG GLN 103 -28.454 -23.946 31.294 813 HG3 GLN 103 2HG GLN 103 -27.888 -24.144 32.952 814 HE21 GLN 103 2HE2 GLN 103 -27.134 -22.195 30.892 815 HE22 GLN 103 1HE2 GLN 103 -25.422 -22.340 30.713 Start of MODEL 6 1 H1 GLY 1 H GLY 1 5.641 18.443 -4.258 2 HA2 GLY 1 1HA GLY 1 3.367 18.129 -2.904 3 HA3 GLY 1 2HA GLY 1 2.745 18.339 -4.535 4 H SER 2 H SER 2 1.868 16.164 -4.147 5 HA SER 2 HA SER 2 3.693 13.950 -3.990 6 HB2 SER 2 1HB SER 2 0.715 14.148 -4.439 7 HB3 SER 2 2HB SER 2 1.574 12.608 -4.456 8 HG SER 2 HG SER 2 1.752 12.687 -2.357 9 H LEU 3 H LEU 3 3.049 12.088 -5.704 10 HA LEU 3 HA LEU 3 3.233 13.265 -8.393 11 HB2 LEU 3 1HB LEU 3 5.049 11.327 -7.053 12 HB3 LEU 3 2HB LEU 3 4.749 11.134 -8.779 13 HG LEU 3 HG LEU 3 5.791 13.677 -7.540 14 HD11 LEU 3 1HD1 LEU 3 7.910 12.949 -7.674 15 HD12 LEU 3 2HD1 LEU 3 7.606 12.006 -9.133 16 HD13 LEU 3 3HD1 LEU 3 7.176 11.349 -7.554 17 HD21 LEU 3 3HD2 LEU 3 5.494 14.536 -9.563 18 HD22 LEU 3 1HD2 LEU 3 4.791 13.014 -10.114 19 HD23 LEU 3 2HD2 LEU 3 6.529 13.285 -10.253 20 H VAL 4 H VAL 4 1.991 12.328 -9.910 21 HA VAL 4 HA VAL 4 0.649 9.799 -9.205 22 HB VAL 4 HB VAL 4 -1.223 10.669 -10.724 23 HG11 VAL 4 1HG1 VAL 4 -2.382 11.507 -8.898 24 HG12 VAL 4 2HG1 VAL 4 -1.115 10.538 -8.142 25 HG13 VAL 4 3HG1 VAL 4 -0.954 12.293 -8.224 26 HG21 VAL 4 3HG2 VAL 4 -1.304 12.842 -11.380 27 HG22 VAL 4 1HG2 VAL 4 -0.398 13.413 -9.979 28 HG23 VAL 4 2HG2 VAL 4 0.449 12.661 -11.331 29 HA PRO 5 HA PRO 5 2.057 8.061 -12.982 30 HB2 PRO 5 1HB PRO 5 -0.032 6.463 -13.655 31 HB3 PRO 5 2HB PRO 5 1.065 6.099 -12.317 32 HG2 PRO 5 1HG PRO 5 -1.656 7.344 -12.249 33 HG3 PRO 5 2HG PRO 5 -0.966 6.105 -11.185 34 HD2 PRO 5 1HD PRO 5 -1.119 8.713 -10.475 35 HD3 PRO 5 2HD PRO 5 0.193 7.650 -9.928 36 H ARG 6 H ARG 6 1.666 7.924 -15.286 37 HA ARG 6 HA ARG 6 0.264 10.245 -16.272 38 HB2 ARG 6 1HB ARG 6 2.081 8.190 -17.477 39 HB3 ARG 6 2HB ARG 6 1.119 9.224 -18.525 40 HG2 ARG 6 1HG ARG 6 2.127 11.169 -17.178 41 HG3 ARG 6 2HG ARG 6 3.313 9.979 -16.636 42 HD2 ARG 6 1HD ARG 6 4.233 9.743 -18.724 43 HD3 ARG 6 2HD ARG 6 2.743 10.200 -19.549 44 HE ARG 6 HE ARG 6 3.414 12.388 -19.474 45 HH11 ARG 6 1HH1 ARG 6 5.347 10.523 -17.260 46 HH12 ARG 6 2HH1 ARG 6 6.446 11.819 -16.922 47 HH21 ARG 6 1HH2 ARG 6 4.853 14.103 -19.038 48 HH22 ARG 6 2HH2 ARG 6 6.164 13.855 -17.933 49 H GLY 7 H GLY 7 -1.907 9.616 -15.744 50 HA2 GLY 7 1HA GLY 7 -3.428 8.695 -17.842 51 HA3 GLY 7 2HA GLY 7 -3.086 7.269 -16.875 52 H SER 8 H SER 8 -4.772 10.309 -17.019 53 HA SER 8 HA SER 8 -6.873 9.468 -15.378 54 HB2 SER 8 1HB SER 8 -4.593 10.702 -13.970 55 HB3 SER 8 2HB SER 8 -6.168 11.389 -13.577 56 HG SER 8 HG SER 8 -5.192 9.283 -12.520 57 H MET 9 H MET 9 -8.574 10.675 -15.912 58 HA MET 9 HA MET 9 -8.082 13.405 -16.908 59 HB2 MET 9 1HB MET 9 -9.775 13.134 -18.540 60 HB3 MET 9 2HB MET 9 -8.794 11.677 -18.624 61 HG2 MET 9 1HG MET 9 -10.816 11.128 -16.771 62 HG3 MET 9 2HG MET 9 -11.598 11.960 -18.112 63 HE1 MET 9 3HE MET 9 -12.305 8.180 -18.281 64 HE2 MET 9 1HE MET 9 -10.905 8.082 -17.214 65 HE3 MET 9 2HE MET 9 -12.125 9.329 -16.954 66 H GLN 10 H GLN 10 -9.853 14.926 -16.619 67 HA GLN 10 HA GLN 10 -11.180 14.493 -14.053 68 HB2 GLN 10 1HB GLN 10 -11.425 16.849 -13.911 69 HB3 GLN 10 2HB GLN 10 -9.802 16.560 -14.524 70 HG2 GLN 10 1HG GLN 10 -11.173 16.780 -16.839 71 HG3 GLN 10 2HG GLN 10 -12.105 17.857 -15.800 72 HE21 GLN 10 2HE2 GLN 10 -11.517 19.845 -16.321 73 HE22 GLN 10 1HE2 GLN 10 -9.892 20.420 -16.435 74 H ILE 11 H ILE 11 -13.377 14.602 -13.757 75 HA ILE 11 HA ILE 11 -15.023 14.787 -16.194 76 HB ILE 11 HB ILE 11 -16.543 13.105 -15.234 77 HG12 ILE 11 1HG1 ILE 11 -14.389 12.785 -13.133 78 HG13 ILE 11 2HG1 ILE 11 -15.996 13.449 -12.863 79 HG21 ILE 11 1HG2 ILE 11 -13.855 11.816 -15.247 80 HG22 ILE 11 2HG2 ILE 11 -15.357 11.295 -16.008 81 HG23 ILE 11 3HG2 ILE 11 -14.433 12.626 -16.703 82 HD11 ILE 11 3HD1 ILE 11 -16.579 11.033 -13.963 83 HD12 ILE 11 1HD1 ILE 11 -15.113 10.674 -13.051 84 HD13 ILE 11 2HD1 ILE 11 -16.511 11.373 -12.234 85 H PHE 12 H PHE 12 -17.410 15.107 -15.595 86 HA PHE 12 HA PHE 12 -17.554 17.137 -13.467 87 HB2 PHE 12 1HB PHE 12 -19.243 16.892 -15.965 88 HB3 PHE 12 2HB PHE 12 -19.385 18.157 -14.748 89 HD1 PHE 12 HD2 PHE 12 -16.889 19.208 -14.219 90 HD2 PHE 12 HD1 PHE 12 -18.262 17.584 -17.906 91 HE1 PHE 12 HE2 PHE 12 -15.227 20.559 -15.430 92 HE2 PHE 12 HE1 PHE 12 -16.602 18.932 -19.122 93 HZ PHE 12 HZ PHE 12 -15.082 20.423 -17.884 94 H VAL 13 H VAL 13 -18.877 16.793 -11.804 95 HA VAL 13 HA VAL 13 -21.008 14.780 -12.094 96 HB VAL 13 HB VAL 13 -19.355 15.156 -9.597 97 HG11 VAL 13 1HG1 VAL 13 -20.497 13.313 -8.715 98 HG12 VAL 13 2HG1 VAL 13 -21.755 14.275 -9.494 99 HG13 VAL 13 3HG1 VAL 13 -21.124 12.833 -10.292 100 HG21 VAL 13 3HG2 VAL 13 -17.750 14.027 -10.668 101 HG22 VAL 13 1HG2 VAL 13 -18.822 12.631 -10.557 102 HG23 VAL 13 2HG2 VAL 13 -18.815 13.624 -12.014 103 H LYS 14 H LYS 14 -22.957 15.299 -11.254 104 HA LYS 14 HA LYS 14 -23.238 17.990 -10.137 105 HB2 LYS 14 1HB LYS 14 -24.964 16.166 -11.695 106 HB3 LYS 14 2HB LYS 14 -25.787 17.125 -10.472 107 HG2 LYS 14 1HG LYS 14 -25.947 18.559 -12.218 108 HG3 LYS 14 2HG LYS 14 -24.380 19.073 -11.589 109 HD2 LYS 14 1HD LYS 14 -23.498 17.195 -13.219 110 HD3 LYS 14 2HD LYS 14 -25.031 17.505 -14.037 111 HE2 LYS 14 1HE LYS 14 -23.090 19.685 -13.302 112 HE3 LYS 14 2HE LYS 14 -23.040 18.839 -14.848 113 HZ1 LYS 14 3HZ LYS 14 -24.464 20.396 -15.520 114 HZ2 LYS 14 1HZ LYS 14 -24.833 20.893 -13.945 115 HZ3 LYS 14 2HZ LYS 14 -25.638 19.570 -14.625 116 H THR 15 H THR 15 -23.676 18.332 -8.060 117 HA THR 15 HA THR 15 -24.128 16.034 -6.324 118 HB THR 15 HB THR 15 -23.724 17.594 -4.466 119 HG1 THR 15 HG1 THR 15 -24.413 19.554 -5.159 120 HG21 THR 15 3HG2 THR 15 -21.393 18.444 -5.756 121 HG22 THR 15 1HG2 THR 15 -21.843 16.938 -6.554 122 HG23 THR 15 2HG2 THR 15 -21.608 16.974 -4.806 123 H LEU 16 H LEU 16 -25.584 16.666 -4.319 124 HA LEU 16 HA LEU 16 -28.230 16.985 -5.367 125 HB2 LEU 16 1HB LEU 16 -27.287 16.805 -2.509 126 HB3 LEU 16 2HB LEU 16 -28.956 16.658 -3.056 127 HG LEU 16 HG LEU 16 -26.862 14.754 -4.040 128 HD11 LEU 16 1HD1 LEU 16 -26.492 14.140 -1.917 129 HD12 LEU 16 2HD1 LEU 16 -28.078 13.380 -2.039 130 HD13 LEU 16 3HD1 LEU 16 -27.921 14.980 -1.316 131 HD21 LEU 16 3HD2 LEU 16 -28.862 14.517 -5.217 132 HD22 LEU 16 1HD2 LEU 16 -29.850 14.782 -3.780 133 HD23 LEU 16 2HD2 LEU 16 -28.958 13.273 -3.971 134 H THR 17 H THR 17 -25.881 19.075 -3.984 135 HA THR 17 HA THR 17 -27.854 21.130 -3.340 136 HB THR 17 HB THR 17 -25.993 20.745 -1.757 137 HG1 THR 17 HG1 THR 17 -26.707 22.786 -1.577 138 HG21 THR 17 3HG2 THR 17 -23.732 21.587 -2.405 139 HG22 THR 17 1HG2 THR 17 -24.295 21.674 -4.073 140 HG23 THR 17 2HG2 THR 17 -24.218 20.117 -3.248 141 H GLY 18 H GLY 18 -27.354 20.290 -6.115 142 HA2 GLY 18 1HA GLY 18 -27.018 21.220 -8.190 143 HA3 GLY 18 2HA GLY 18 -27.486 22.726 -7.414 144 H LYS 19 H LYS 19 -24.634 20.828 -6.613 145 HA LYS 19 HA LYS 19 -22.974 23.039 -7.636 146 HB2 LYS 19 1HB LYS 19 -22.932 22.912 -5.196 147 HB3 LYS 19 2HB LYS 19 -22.465 21.219 -5.275 148 HG2 LYS 19 1HG LYS 19 -20.739 23.202 -6.651 149 HG3 LYS 19 2HG LYS 19 -20.698 23.139 -4.888 150 HD2 LYS 19 1HD LYS 19 -20.520 20.519 -5.424 151 HD3 LYS 19 2HD LYS 19 -19.771 21.162 -6.887 152 HE2 LYS 19 1HE LYS 19 -17.938 20.994 -5.525 153 HE3 LYS 19 2HE LYS 19 -18.447 22.644 -5.167 154 HZ1 LYS 19 3HZ LYS 19 -19.850 21.062 -3.417 155 HZ2 LYS 19 1HZ LYS 19 -18.508 22.025 -3.052 156 HZ3 LYS 19 2HZ LYS 19 -18.297 20.392 -3.435 157 H THR 20 H THR 20 -21.606 22.547 -9.214 158 HA THR 20 HA THR 20 -21.238 19.768 -9.974 159 HB THR 20 HB THR 20 -19.844 21.944 -11.447 160 HG1 THR 20 HG1 THR 20 -21.626 23.003 -11.833 161 HG21 THR 20 3HG2 THR 20 -21.311 19.411 -12.127 162 HG22 THR 20 1HG2 THR 20 -19.618 19.814 -12.409 163 HG23 THR 20 2HG2 THR 20 -20.881 20.592 -13.364 164 H ILE 21 H ILE 21 -19.588 18.599 -9.269 165 HA ILE 21 HA ILE 21 -17.123 19.991 -8.449 166 HB ILE 21 HB ILE 21 -18.113 18.902 -6.554 167 HG12 ILE 21 1HG1 ILE 21 -15.553 18.568 -7.283 168 HG13 ILE 21 2HG1 ILE 21 -16.207 17.909 -5.787 169 HG21 ILE 21 1HG2 ILE 21 -19.581 17.336 -7.582 170 HG22 ILE 21 2HG2 ILE 21 -18.235 16.467 -8.319 171 HG23 ILE 21 3HG2 ILE 21 -18.465 16.418 -6.571 172 HD11 ILE 21 3HD1 ILE 21 -16.226 16.297 -8.304 173 HD12 ILE 21 1HD1 ILE 21 -14.783 16.398 -7.295 174 HD13 ILE 21 2HD1 ILE 21 -16.283 15.752 -6.627 175 H THR 22 H THR 22 -15.233 19.446 -9.372 176 HA THR 22 HA THR 22 -15.305 17.550 -11.580 177 HB THR 22 HB THR 22 -12.877 19.140 -10.816 178 HG1 THR 22 HG1 THR 22 -15.193 20.082 -12.184 179 HG21 THR 22 3HG2 THR 22 -13.234 17.346 -12.769 180 HG22 THR 22 1HG2 THR 22 -12.178 18.747 -12.946 181 HG23 THR 22 2HG2 THR 22 -13.813 18.787 -13.606 182 H LEU 23 H LEU 23 -14.650 15.521 -11.367 183 HA LEU 23 HA LEU 23 -12.799 14.862 -9.172 184 HB2 LEU 23 1HB LEU 23 -15.263 13.907 -9.411 185 HB3 LEU 23 2HB LEU 23 -14.449 12.766 -10.479 186 HG LEU 23 HG LEU 23 -12.890 12.282 -8.531 187 HD11 LEU 23 1HD1 LEU 23 -14.998 13.905 -7.134 188 HD12 LEU 23 2HD1 LEU 23 -13.247 14.115 -7.096 189 HD13 LEU 23 3HD1 LEU 23 -13.987 12.729 -6.294 190 HD21 LEU 23 3HD2 LEU 23 -14.812 10.976 -7.332 191 HD22 LEU 23 1HD2 LEU 23 -14.346 10.562 -8.982 192 HD23 LEU 23 2HD2 LEU 23 -15.778 11.550 -8.692 193 H GLU 24 H GLU 24 -11.133 13.361 -9.556 194 HA GLU 24 HA GLU 24 -10.422 13.084 -12.400 195 HB2 GLU 24 1HB GLU 24 -8.880 13.774 -9.995 196 HB3 GLU 24 2HB GLU 24 -8.104 12.586 -11.032 197 HG2 GLU 24 1HG GLU 24 -9.210 15.093 -12.212 198 HG3 GLU 24 2HG GLU 24 -7.653 15.115 -11.387 199 H VAL 25 H VAL 25 -10.423 11.111 -13.236 200 HA VAL 25 HA VAL 25 -9.768 8.812 -11.560 201 HB VAL 25 HB VAL 25 -12.181 8.901 -11.392 202 HG11 VAL 25 1HG1 VAL 25 -13.635 8.838 -13.319 203 HG12 VAL 25 2HG1 VAL 25 -12.571 10.241 -13.433 204 HG13 VAL 25 3HG1 VAL 25 -12.247 8.806 -14.406 205 HG21 VAL 25 3HG2 VAL 25 -11.907 6.746 -13.396 206 HG22 VAL 25 1HG2 VAL 25 -10.765 6.722 -12.051 207 HG23 VAL 25 2HG2 VAL 25 -12.500 6.685 -11.736 208 H GLU 26 H GLU 26 -8.911 7.072 -12.677 209 HA GLU 26 HA GLU 26 -7.695 7.665 -15.177 210 HB2 GLU 26 1HB GLU 26 -7.912 4.910 -13.983 211 HB3 GLU 26 2HB GLU 26 -6.635 5.560 -15.002 212 HG2 GLU 26 1HG GLU 26 -6.026 7.103 -13.155 213 HG3 GLU 26 2HG GLU 26 -7.215 6.286 -12.142 214 HA PRO 27 HA PRO 27 -10.654 6.222 -18.080 215 HB2 PRO 27 1HB PRO 27 -9.039 5.231 -20.024 216 HB3 PRO 27 2HB PRO 27 -9.226 6.963 -19.720 217 HG2 PRO 27 1HG PRO 27 -7.045 5.109 -18.842 218 HG3 PRO 27 2HG PRO 27 -6.921 6.756 -19.487 219 HD2 PRO 27 1HD PRO 27 -6.747 6.212 -16.841 220 HD3 PRO 27 2HD PRO 27 -7.440 7.724 -17.461 221 H SER 28 H SER 28 -8.303 4.023 -16.771 222 HA SER 28 HA SER 28 -9.834 1.711 -17.734 223 HB2 SER 28 1HB SER 28 -7.362 1.739 -18.101 224 HB3 SER 28 2HB SER 28 -7.140 1.739 -16.352 225 HG SER 28 HG SER 28 -7.480 -0.326 -16.356 226 H ASP 29 H ASP 29 -9.380 3.656 -15.003 227 HA ASP 29 HA ASP 29 -9.713 1.778 -12.925 228 HB2 ASP 29 1HB ASP 29 -10.004 4.730 -13.194 229 HB3 ASP 29 2HB ASP 29 -10.746 3.961 -11.794 230 H THR 30 H THR 30 -11.646 1.648 -11.503 231 HA THR 30 HA THR 30 -14.088 1.516 -13.142 232 HB THR 30 HB THR 30 -14.879 -0.258 -11.739 233 HG1 THR 30 HG1 THR 30 -13.203 -0.965 -10.047 234 HG21 THR 30 3HG2 THR 30 -11.984 -0.956 -12.093 235 HG22 THR 30 1HG2 THR 30 -13.023 -0.684 -13.491 236 HG23 THR 30 2HG2 THR 30 -13.410 -1.964 -12.341 237 H ILE 31 H ILE 31 -16.136 1.597 -11.707 238 HA ILE 31 HA ILE 31 -16.457 4.148 -10.704 239 HB ILE 31 HB ILE 31 -18.041 1.727 -9.838 240 HG12 ILE 31 1HG1 ILE 31 -17.981 1.824 -12.258 241 HG13 ILE 31 2HG1 ILE 31 -19.566 2.353 -11.704 242 HG21 ILE 31 1HG2 ILE 31 -18.581 4.682 -9.767 243 HG22 ILE 31 2HG2 ILE 31 -19.870 3.483 -9.675 244 HG23 ILE 31 3HG2 ILE 31 -18.617 3.526 -8.435 245 HD11 ILE 31 3HD1 ILE 31 -18.171 4.702 -11.848 246 HD12 ILE 31 1HD1 ILE 31 -17.535 3.785 -13.213 247 HD13 ILE 31 2HD1 ILE 31 -19.270 4.076 -13.077 248 H GLU 32 H GLU 32 -15.289 1.284 -9.096 249 HA GLU 32 HA GLU 32 -15.633 2.060 -6.428 250 HB2 GLU 32 1HB GLU 32 -13.389 0.397 -7.583 251 HB3 GLU 32 2HB GLU 32 -13.893 0.434 -5.900 252 HG2 GLU 32 1HG GLU 32 -15.458 -0.614 -8.243 253 HG3 GLU 32 2HG GLU 32 -14.755 -1.545 -6.923 254 H ASN 33 H ASN 33 -13.139 2.845 -8.773 255 HA ASN 33 HA ASN 33 -11.422 4.130 -6.868 256 HB2 ASN 33 1HB ASN 33 -11.129 3.199 -9.465 257 HB3 ASN 33 2HB ASN 33 -11.048 4.950 -9.642 258 HD21 ASN 33 2HD2 ASN 33 -9.566 6.065 -8.105 259 HD22 ASN 33 1HD2 ASN 33 -8.064 5.289 -7.747 260 H VAL 34 H VAL 34 -14.015 5.106 -8.993 261 HA VAL 34 HA VAL 34 -13.557 7.886 -8.975 262 HB VAL 34 HB VAL 34 -16.174 6.402 -9.253 263 HG11 VAL 34 1HG1 VAL 34 -16.517 8.743 -8.662 264 HG12 VAL 34 2HG1 VAL 34 -15.461 9.241 -9.985 265 HG13 VAL 34 3HG1 VAL 34 -16.993 8.438 -10.332 266 HG21 VAL 34 3HG2 VAL 34 -14.640 7.593 -11.521 267 HG22 VAL 34 1HG2 VAL 34 -14.179 6.012 -10.889 268 HG23 VAL 34 2HG2 VAL 34 -15.804 6.268 -11.526 269 H LYS 35 H LYS 35 -15.771 5.905 -7.005 270 HA LYS 35 HA LYS 35 -16.716 7.971 -5.375 271 HB2 LYS 35 1HB LYS 35 -17.291 6.138 -3.767 272 HB3 LYS 35 2HB LYS 35 -17.869 5.873 -5.407 273 HG2 LYS 35 1HG LYS 35 -16.081 4.316 -5.834 274 HG3 LYS 35 2HG LYS 35 -15.369 4.652 -4.255 275 HD2 LYS 35 1HD LYS 35 -17.749 3.929 -3.395 276 HD3 LYS 35 2HD LYS 35 -17.815 3.095 -4.949 277 HE2 LYS 35 1HE LYS 35 -16.940 1.500 -3.485 278 HE3 LYS 35 2HE LYS 35 -15.522 2.141 -4.314 279 HZ1 LYS 35 3HZ LYS 35 -15.908 1.997 -1.602 280 HZ2 LYS 35 1HZ LYS 35 -16.116 3.636 -1.968 281 HZ3 LYS 35 2HZ LYS 35 -14.684 2.848 -2.402 282 H ALA 36 H ALA 36 -13.749 6.164 -5.290 283 HA ALA 36 HA ALA 36 -12.947 6.520 -2.656 284 HB1 ALA 36 1HB ALA 36 -10.665 6.837 -4.308 285 HB2 ALA 36 2HB ALA 36 -11.203 5.398 -3.440 286 HB3 ALA 36 3HB ALA 36 -11.749 5.687 -5.092 287 H LYS 37 H LYS 37 -12.583 8.700 -5.428 288 HA LYS 37 HA LYS 37 -11.191 10.702 -3.920 289 HB2 LYS 37 1HB LYS 37 -12.163 10.376 -6.690 290 HB3 LYS 37 2HB LYS 37 -12.098 12.034 -6.107 291 HG2 LYS 37 1HG LYS 37 -10.042 11.562 -7.203 292 HG3 LYS 37 2HG LYS 37 -9.720 11.639 -5.469 293 HD2 LYS 37 1HD LYS 37 -8.568 9.734 -6.038 294 HD3 LYS 37 2HD LYS 37 -10.134 9.051 -5.595 295 HE2 LYS 37 1HE LYS 37 -9.996 8.029 -7.591 296 HE3 LYS 37 2HE LYS 37 -10.521 9.587 -8.227 297 HZ1 LYS 37 3HZ LYS 37 -8.041 10.120 -8.312 298 HZ2 LYS 37 1HZ LYS 37 -8.655 9.058 -9.477 299 HZ3 LYS 37 2HZ LYS 37 -7.796 8.454 -8.152 300 H ILE 38 H ILE 38 -14.516 10.005 -4.696 301 HA ILE 38 HA ILE 38 -15.670 12.503 -4.193 302 HB ILE 38 HB ILE 38 -16.844 9.764 -3.702 303 HG12 ILE 38 1HG1 ILE 38 -16.102 10.183 -6.032 304 HG13 ILE 38 2HG1 ILE 38 -17.850 10.013 -5.901 305 HG21 ILE 38 1HG2 ILE 38 -18.136 11.351 -2.486 306 HG22 ILE 38 2HG2 ILE 38 -18.123 12.485 -3.835 307 HG23 ILE 38 3HG2 ILE 38 -19.024 10.975 -3.962 308 HD11 ILE 38 3HD1 ILE 38 -18.064 12.460 -5.961 309 HD12 ILE 38 1HD1 ILE 38 -16.318 12.587 -6.171 310 HD13 ILE 38 2HD1 ILE 38 -17.300 11.805 -7.410 311 H GLN 39 H GLN 39 -14.529 10.015 -2.026 312 HA GLN 39 HA GLN 39 -15.838 10.681 0.321 313 HB2 GLN 39 1HB GLN 39 -12.981 9.752 -0.017 314 HB3 GLN 39 2HB GLN 39 -13.881 9.726 1.493 315 HG2 GLN 39 1HG GLN 39 -15.580 8.323 0.032 316 HG3 GLN 39 2HG GLN 39 -14.117 7.983 -0.892 317 HE21 GLN 39 2HE2 GLN 39 -12.367 6.948 0.167 318 HE22 GLN 39 1HE2 GLN 39 -12.634 5.975 1.570 319 H ASP 40 H ASP 40 -13.076 12.214 -1.216 320 HA ASP 40 HA ASP 40 -12.529 13.964 0.995 321 HB2 ASP 40 1HB ASP 40 -10.848 13.193 -0.754 322 HB3 ASP 40 2HB ASP 40 -11.613 14.334 -1.856 323 H LYS 41 H LYS 41 -14.630 13.993 -1.737 324 HA LYS 41 HA LYS 41 -15.014 16.848 -1.776 325 HB2 LYS 41 1HB LYS 41 -16.830 14.790 -3.020 326 HB3 LYS 41 2HB LYS 41 -16.592 16.463 -3.507 327 HG2 LYS 41 1HG LYS 41 -14.492 14.315 -3.697 328 HG3 LYS 41 2HG LYS 41 -15.535 14.826 -5.026 329 HD2 LYS 41 1HD LYS 41 -13.750 16.166 -5.461 330 HD3 LYS 41 2HD LYS 41 -14.590 17.214 -4.316 331 HE2 LYS 41 1HE LYS 41 -13.135 16.671 -2.574 332 HE3 LYS 41 2HE LYS 41 -12.563 15.213 -3.382 333 HZ1 LYS 41 3HZ LYS 41 -11.161 16.395 -4.724 334 HZ2 LYS 41 1HZ LYS 41 -11.110 17.357 -3.333 335 HZ3 LYS 41 2HZ LYS 41 -12.074 17.816 -4.644 336 H GLU 42 H GLU 42 -17.000 14.052 -0.808 337 HA GLU 42 HA GLU 42 -18.520 15.870 0.944 338 HB2 GLU 42 1HB GLU 42 -19.507 13.534 -0.690 339 HB3 GLU 42 2HB GLU 42 -20.442 14.250 0.615 340 HG2 GLU 42 1HG GLU 42 -19.424 15.872 -1.693 341 HG3 GLU 42 2HG GLU 42 -20.962 15.012 -1.748 342 H GLY 43 H GLY 43 -17.127 12.676 0.491 343 HA2 GLY 43 1HA GLY 43 -16.261 11.239 2.084 344 HA3 GLY 43 2HA GLY 43 -16.724 12.395 3.323 345 H ILE 44 H ILE 44 -18.149 10.039 1.071 346 HA ILE 44 HA ILE 44 -20.066 9.335 3.196 347 HB ILE 44 HB ILE 44 -21.663 8.709 1.363 348 HG12 ILE 44 1HG1 ILE 44 -19.817 10.373 -0.362 349 HG13 ILE 44 2HG1 ILE 44 -19.923 8.617 -0.432 350 HG21 ILE 44 1HG2 ILE 44 -21.850 11.355 0.731 351 HG22 ILE 44 2HG2 ILE 44 -22.470 10.620 2.209 352 HG23 ILE 44 3HG2 ILE 44 -20.889 11.401 2.209 353 HD11 ILE 44 3HD1 ILE 44 -21.364 9.062 -2.093 354 HD12 ILE 44 1HD1 ILE 44 -22.508 9.248 -0.764 355 HD13 ILE 44 2HD1 ILE 44 -21.747 10.670 -1.478 356 HA PRO 45 HA PRO 45 -18.689 5.180 2.826 357 HB2 PRO 45 1HB PRO 45 -20.958 3.836 3.469 358 HB3 PRO 45 2HB PRO 45 -19.995 4.719 4.659 359 HG2 PRO 45 1HG PRO 45 -22.499 5.559 3.250 360 HG3 PRO 45 2HG PRO 45 -22.055 5.756 4.956 361 HD2 PRO 45 1HD PRO 45 -21.850 7.768 3.156 362 HD3 PRO 45 2HD PRO 45 -20.740 7.600 4.531 363 HA PRO 46 HA PRO 46 -19.716 3.415 -1.067 364 HB2 PRO 46 1HB PRO 46 -19.594 0.749 -0.568 365 HB3 PRO 46 2HB PRO 46 -18.160 1.780 -0.640 366 HG2 PRO 46 1HG PRO 46 -19.664 0.790 1.752 367 HG3 PRO 46 2HG PRO 46 -17.913 0.888 1.494 368 HD2 PRO 46 1HD PRO 46 -19.276 2.721 2.948 369 HD3 PRO 46 2HD PRO 46 -17.838 3.137 1.993 370 H ASP 47 H ASP 47 -21.483 1.983 1.657 371 HA ASP 47 HA ASP 47 -23.536 0.768 0.195 372 HB2 ASP 47 1HB ASP 47 -22.959 0.569 2.705 373 HB3 ASP 47 2HB ASP 47 -23.977 1.992 2.907 374 H GLN 48 H GLN 48 -23.157 4.068 1.356 375 HA GLN 48 HA GLN 48 -25.799 4.811 0.390 376 HB2 GLN 48 1HB GLN 48 -23.626 6.385 1.775 377 HB3 GLN 48 2HB GLN 48 -25.149 7.085 1.245 378 HG2 GLN 48 1HG GLN 48 -26.390 5.744 2.759 379 HG3 GLN 48 2HG GLN 48 -24.975 4.766 3.146 380 HE21 GLN 48 2HE2 GLN 48 -24.640 5.144 5.235 381 HE22 GLN 48 1HE2 GLN 48 -24.432 6.704 5.947 382 H GLN 49 H GLN 49 -22.493 4.930 -0.611 383 HA GLN 49 HA GLN 49 -22.707 7.036 -2.496 384 HB2 GLN 49 1HB GLN 49 -20.541 6.306 -1.665 385 HB3 GLN 49 2HB GLN 49 -20.784 4.708 -2.358 386 HG2 GLN 49 1HG GLN 49 -19.748 5.411 -4.178 387 HG3 GLN 49 2HG GLN 49 -21.111 6.487 -4.481 388 HE21 GLN 49 2HE2 GLN 49 -19.906 8.110 -5.383 389 HE22 GLN 49 1HE2 GLN 49 -18.793 9.075 -4.481 390 H ARG 50 H ARG 50 -23.485 7.074 -4.511 391 HA ARG 50 HA ARG 50 -23.747 4.655 -6.072 392 HB2 ARG 50 1HB ARG 50 -26.050 5.956 -4.749 393 HB3 ARG 50 2HB ARG 50 -26.275 5.542 -6.443 394 HG2 ARG 50 1HG ARG 50 -25.428 3.621 -4.285 395 HG3 ARG 50 2HG ARG 50 -27.063 3.781 -4.931 396 HD2 ARG 50 1HD ARG 50 -26.057 3.294 -7.207 397 HD3 ARG 50 2HD ARG 50 -24.585 2.836 -6.351 398 HE ARG 50 HE ARG 50 -26.956 1.287 -6.612 399 HH11 ARG 50 1HH1 ARG 50 -24.327 2.008 -4.446 400 HH12 ARG 50 2HH1 ARG 50 -24.404 0.480 -3.635 401 HH21 ARG 50 1HH2 ARG 50 -27.067 -0.729 -5.551 402 HH22 ARG 50 2HH2 ARG 50 -25.963 -1.077 -4.265 403 H LEU 51 H LEU 51 -23.021 5.213 -8.007 404 HA LEU 51 HA LEU 51 -23.256 7.985 -8.897 405 HB2 LEU 51 1HB LEU 51 -21.584 5.648 -9.729 406 HB3 LEU 51 2HB LEU 51 -21.786 7.026 -10.808 407 HG LEU 51 HG LEU 51 -19.707 7.217 -9.592 408 HD11 LEU 51 1HD1 LEU 51 -19.938 9.432 -8.796 409 HD12 LEU 51 2HD1 LEU 51 -21.639 9.190 -8.401 410 HD13 LEU 51 3HD1 LEU 51 -21.125 9.242 -10.087 411 HD21 LEU 51 3HD2 LEU 51 -20.969 5.966 -7.543 412 HD22 LEU 51 1HD2 LEU 51 -20.948 7.632 -6.963 413 HD23 LEU 51 2HD2 LEU 51 -19.438 6.830 -7.395 414 H ILE 52 H ILE 52 -24.337 8.619 -10.716 415 HA ILE 52 HA ILE 52 -25.971 6.556 -12.044 416 HB ILE 52 HB ILE 52 -26.735 9.460 -11.818 417 HG12 ILE 52 1HG1 ILE 52 -26.565 8.583 -9.553 418 HG13 ILE 52 2HG1 ILE 52 -28.259 8.774 -9.991 419 HG21 ILE 52 1HG2 ILE 52 -29.015 8.477 -12.232 420 HG22 ILE 52 2HG2 ILE 52 -27.883 8.362 -13.579 421 HG23 ILE 52 3HG2 ILE 52 -28.207 6.948 -12.577 422 HD11 ILE 52 3HD1 ILE 52 -28.235 6.727 -8.943 423 HD12 ILE 52 1HD1 ILE 52 -28.113 6.276 -10.643 424 HD13 ILE 52 2HD1 ILE 52 -26.672 6.277 -9.625 425 H PHE 53 H PHE 53 -26.087 6.540 -14.246 426 HA PHE 53 HA PHE 53 -24.744 8.675 -15.734 427 HB2 PHE 53 1HB PHE 53 -23.042 6.957 -15.419 428 HB3 PHE 53 2HB PHE 53 -24.138 5.727 -16.042 429 HD1 PHE 53 HD2 PHE 53 -22.488 8.916 -17.019 430 HD2 PHE 53 HD1 PHE 53 -24.083 5.178 -18.284 431 HE1 PHE 53 HE2 PHE 53 -21.653 9.334 -19.295 432 HE2 PHE 53 HE1 PHE 53 -23.249 5.589 -20.562 433 HZ PHE 53 HZ PHE 53 -22.034 7.670 -21.070 434 H ALA 54 H ALA 54 -26.142 9.400 -17.182 435 HA ALA 54 HA ALA 54 -27.837 9.511 -18.699 436 HB1 ALA 54 1HB ALA 54 -27.974 7.713 -20.338 437 HB2 ALA 54 2HB ALA 54 -26.293 8.126 -19.997 438 HB3 ALA 54 3HB ALA 54 -27.004 6.674 -19.294 439 H GLY 55 H GLY 55 -28.471 8.659 -15.985 440 HA2 GLY 55 1HA GLY 55 -30.553 8.264 -15.001 441 HA3 GLY 55 2HA GLY 55 -31.131 7.628 -16.534 442 H LYS 56 H LYS 56 -28.375 6.055 -16.288 443 HA LYS 56 HA LYS 56 -29.603 3.805 -14.849 444 HB2 LYS 56 1HB LYS 56 -28.730 3.791 -17.375 445 HB3 LYS 56 2HB LYS 56 -27.212 3.408 -16.574 446 HG2 LYS 56 1HG LYS 56 -28.558 1.582 -15.361 447 HG3 LYS 56 2HG LYS 56 -29.758 1.839 -16.629 448 HD2 LYS 56 1HD LYS 56 -26.854 1.204 -17.141 449 HD3 LYS 56 2HD LYS 56 -28.145 0.000 -17.111 450 HE2 LYS 56 1HE LYS 56 -29.283 1.237 -18.925 451 HE3 LYS 56 2HE LYS 56 -27.919 2.352 -18.986 452 HZ1 LYS 56 3HZ LYS 56 -27.848 0.546 -20.668 453 HZ2 LYS 56 1HZ LYS 56 -27.673 -0.574 -19.412 454 HZ3 LYS 56 2HZ LYS 56 -26.484 0.601 -19.669 455 H GLN 57 H GLN 57 -28.766 3.178 -12.973 456 HA GLN 57 HA GLN 57 -26.669 4.517 -11.702 457 HB2 GLN 57 1HB GLN 57 -26.732 2.560 -10.095 458 HB3 GLN 57 2HB GLN 57 -28.255 3.404 -10.339 459 HG2 GLN 57 1HG GLN 57 -27.818 1.140 -12.143 460 HG3 GLN 57 2HG GLN 57 -27.932 0.714 -10.436 461 HE21 GLN 57 2HE2 GLN 57 -29.870 -0.409 -11.289 462 HE22 GLN 57 1HE2 GLN 57 -31.352 0.476 -11.351 463 H LEU 58 H LEU 58 -24.573 3.776 -11.076 464 HA LEU 58 HA LEU 58 -23.340 2.069 -13.122 465 HB2 LEU 58 1HB LEU 58 -22.037 3.999 -11.207 466 HB3 LEU 58 2HB LEU 58 -21.237 3.120 -12.509 467 HG LEU 58 HG LEU 58 -23.343 5.251 -12.872 468 HD11 LEU 58 1HD1 LEU 58 -21.710 6.787 -13.196 469 HD12 LEU 58 2HD1 LEU 58 -20.555 5.598 -13.798 470 HD13 LEU 58 3HD1 LEU 58 -20.851 5.741 -12.065 471 HD21 LEU 58 3HD2 LEU 58 -23.599 4.136 -14.817 472 HD22 LEU 58 1HD2 LEU 58 -22.033 3.335 -14.691 473 HD23 LEU 58 2HD2 LEU 58 -22.126 5.002 -15.258 474 H GLU 59 H GLU 59 -21.445 0.755 -12.368 475 HA GLU 59 HA GLU 59 -21.525 -0.103 -9.599 476 HB2 GLU 59 1HB GLU 59 -21.756 -2.531 -10.357 477 HB3 GLU 59 2HB GLU 59 -23.216 -1.553 -10.355 478 HG2 GLU 59 1HG GLU 59 -22.938 -1.189 -12.777 479 HG3 GLU 59 2HG GLU 59 -21.535 -2.255 -12.750 480 H ASP 60 H ASP 60 -19.933 -2.070 -9.370 481 HA ASP 60 HA ASP 60 -17.414 -1.153 -10.411 482 HB2 ASP 60 1HB ASP 60 -16.402 -2.666 -8.907 483 HB3 ASP 60 2HB ASP 60 -17.842 -2.092 -8.070 484 H GLY 61 H GLY 61 -15.915 -3.375 -10.811 485 HA2 GLY 61 1HA GLY 61 -15.545 -5.207 -12.206 486 HA3 GLY 61 2HA GLY 61 -17.221 -5.119 -12.726 487 H ARG 62 H ARG 62 -17.515 -2.682 -13.774 488 HA ARG 62 HA ARG 62 -15.830 -2.829 -16.141 489 HB2 ARG 62 1HB ARG 62 -18.230 -1.078 -15.577 490 HB3 ARG 62 2HB ARG 62 -17.434 -1.273 -17.133 491 HG2 ARG 62 1HG ARG 62 -18.035 -3.687 -17.065 492 HG3 ARG 62 2HG ARG 62 -18.969 -3.359 -15.604 493 HD2 ARG 62 1HD ARG 62 -20.470 -1.951 -16.767 494 HD3 ARG 62 2HD ARG 62 -19.419 -1.876 -18.180 495 HE ARG 62 HE ARG 62 -20.002 -4.503 -18.007 496 HH11 ARG 62 1HH1 ARG 62 -21.969 -1.631 -18.005 497 HH12 ARG 62 2HH1 ARG 62 -23.330 -2.405 -18.746 498 HH21 ARG 62 1HH2 ARG 62 -21.787 -5.534 -18.983 499 HH22 ARG 62 2HH2 ARG 62 -23.226 -4.626 -19.301 500 H THR 63 H THR 63 -15.178 -0.685 -17.144 501 HA THR 63 HA THR 63 -13.996 1.010 -15.045 502 HB THR 63 HB THR 63 -12.195 0.095 -16.219 503 HG1 THR 63 HG1 THR 63 -12.077 2.399 -16.144 504 HG21 THR 63 3HG2 THR 63 -12.072 -0.050 -18.668 505 HG22 THR 63 1HG2 THR 63 -13.689 0.642 -18.787 506 HG23 THR 63 2HG2 THR 63 -13.459 -0.937 -18.037 507 H LEU 64 H LEU 64 -13.698 3.301 -15.589 508 HA LEU 64 HA LEU 64 -16.049 4.584 -16.253 509 HB2 LEU 64 1HB LEU 64 -13.192 5.501 -16.288 510 HB3 LEU 64 2HB LEU 64 -14.514 6.590 -16.703 511 HG LEU 64 HG LEU 64 -13.930 6.991 -14.432 512 HD11 LEU 64 1HD1 LEU 64 -16.403 6.691 -15.149 513 HD12 LEU 64 2HD1 LEU 64 -16.007 6.827 -13.436 514 HD13 LEU 64 3HD1 LEU 64 -16.338 5.245 -14.140 515 HD21 LEU 64 3HD2 LEU 64 -14.407 4.086 -13.806 516 HD22 LEU 64 1HD2 LEU 64 -13.734 5.333 -12.756 517 HD23 LEU 64 2HD2 LEU 64 -12.806 4.750 -14.138 518 H SER 65 H SER 65 -13.324 3.741 -18.333 519 HA SER 65 HA SER 65 -14.228 5.112 -20.634 520 HB2 SER 65 1HB SER 65 -11.926 4.450 -20.526 521 HB3 SER 65 2HB SER 65 -12.363 2.757 -20.297 522 HG SER 65 HG SER 65 -12.061 4.148 -22.591 523 H GLU 66 H GLU 66 -14.976 1.996 -19.263 524 HA GLU 66 HA GLU 66 -16.225 0.933 -21.609 525 HB2 GLU 66 1HB GLU 66 -16.090 0.119 -18.728 526 HB3 GLU 66 2HB GLU 66 -17.242 -0.660 -19.802 527 HG2 GLU 66 1HG GLU 66 -14.370 -0.479 -20.585 528 HG3 GLU 66 2HG GLU 66 -14.898 -1.704 -19.433 529 H TYR 67 H TYR 67 -17.220 2.954 -18.979 530 HA TYR 67 HA TYR 67 -20.049 2.588 -19.564 531 HB2 TYR 67 1HB TYR 67 -18.486 3.936 -17.408 532 HB3 TYR 67 2HB TYR 67 -20.123 4.498 -17.726 533 HD1 TYR 67 HD1 TYR 67 -21.778 2.305 -18.127 534 HD2 TYR 67 HD2 TYR 67 -18.344 2.497 -15.623 535 HE1 TYR 67 HE1 TYR 67 -22.678 0.467 -16.762 536 HE2 TYR 67 HE2 TYR 67 -19.234 0.659 -14.252 537 HH TYR 67 HH TYR 67 -22.470 -0.569 -14.702 538 H ASN 68 H ASN 68 -17.847 4.038 -21.240 539 HA ASN 68 HA ASN 68 -17.780 5.762 -22.722 540 HB2 ASN 68 1HB ASN 68 -20.691 6.270 -22.124 541 HB3 ASN 68 2HB ASN 68 -19.818 6.555 -23.627 542 HD21 ASN 68 2HD2 ASN 68 -22.125 4.740 -22.445 543 HD22 ASN 68 1HD2 ASN 68 -21.856 3.251 -23.279 544 H ILE 69 H ILE 69 -17.512 6.174 -19.744 545 HA ILE 69 HA ILE 69 -18.373 8.920 -19.375 546 HB ILE 69 HB ILE 69 -16.757 7.116 -17.570 547 HG12 ILE 69 1HG1 ILE 69 -19.562 8.022 -17.039 548 HG13 ILE 69 2HG1 ILE 69 -19.286 6.676 -18.139 549 HG21 ILE 69 1HG2 ILE 69 -18.005 9.206 -16.140 550 HG22 ILE 69 2HG2 ILE 69 -16.281 8.914 -16.364 551 HG23 ILE 69 3HG2 ILE 69 -17.157 9.937 -17.503 552 HD11 ILE 69 3HD1 ILE 69 -17.877 5.694 -16.221 553 HD12 ILE 69 1HD1 ILE 69 -18.728 6.862 -15.212 554 HD13 ILE 69 2HD1 ILE 69 -19.635 5.641 -16.105 555 H GLN 70 H GLN 70 -17.218 10.264 -20.671 556 HA GLN 70 HA GLN 70 -14.327 10.013 -20.833 557 HB2 GLN 70 1HB GLN 70 -16.075 12.135 -22.080 558 HB3 GLN 70 2HB GLN 70 -14.429 11.709 -22.528 559 HG2 GLN 70 1HG GLN 70 -15.240 9.484 -23.234 560 HG3 GLN 70 2HG GLN 70 -16.886 10.009 -22.882 561 HE21 GLN 70 2HE2 GLN 70 -17.928 11.357 -24.281 562 HE22 GLN 70 1HE2 GLN 70 -17.291 11.809 -25.822 563 H LYS 71 H LYS 71 -13.489 12.600 -21.048 564 HA LYS 71 HA LYS 71 -13.441 13.409 -18.280 565 HB2 LYS 71 1HB LYS 71 -11.753 15.003 -18.966 566 HB3 LYS 71 2HB LYS 71 -11.406 13.438 -19.691 567 HG2 LYS 71 1HG LYS 71 -13.054 15.079 -21.414 568 HG3 LYS 71 2HG LYS 71 -11.535 15.874 -20.992 569 HD2 LYS 71 1HD LYS 71 -10.545 13.487 -21.554 570 HD3 LYS 71 2HD LYS 71 -12.014 13.368 -22.526 571 HE2 LYS 71 1HE LYS 71 -11.351 15.637 -23.488 572 HE3 LYS 71 2HE LYS 71 -9.774 15.360 -22.750 573 HZ1 LYS 71 3HZ LYS 71 -10.675 13.106 -24.257 574 HZ2 LYS 71 1HZ LYS 71 -9.216 13.956 -24.360 575 HZ3 LYS 71 2HZ LYS 71 -10.573 14.498 -25.211 576 H GLU 72 H GLU 72 -15.606 13.927 -20.663 577 HA GLU 72 HA GLU 72 -16.385 16.533 -19.540 578 HB2 GLU 72 1HB GLU 72 -17.346 17.010 -21.869 579 HB3 GLU 72 2HB GLU 72 -15.605 17.144 -21.665 580 HG2 GLU 72 1HG GLU 72 -15.295 14.954 -22.660 581 HG3 GLU 72 2HG GLU 72 -17.041 14.763 -22.817 582 H SER 73 H SER 73 -17.196 13.707 -19.018 583 HA SER 73 HA SER 73 -19.937 13.621 -19.993 584 HB2 SER 73 1HB SER 73 -19.973 11.395 -19.373 585 HB3 SER 73 2HB SER 73 -18.249 11.612 -19.671 586 HG SER 73 HG SER 73 -19.599 11.174 -17.303 587 H THR 74 H THR 74 -21.759 13.541 -18.621 588 HA THR 74 HA THR 74 -21.363 14.981 -16.092 589 HB THR 74 HB THR 74 -24.088 14.602 -17.235 590 HG1 THR 74 HG1 THR 74 -22.411 16.664 -18.216 591 HG21 THR 74 3HG2 THR 74 -24.079 17.106 -16.517 592 HG22 THR 74 1HG2 THR 74 -22.612 16.665 -15.645 593 HG23 THR 74 2HG2 THR 74 -24.132 15.850 -15.281 594 H LEU 75 H LEU 75 -21.418 13.808 -14.300 595 HA LEU 75 HA LEU 75 -23.057 11.362 -14.261 596 HB2 LEU 75 1HB LEU 75 -20.491 12.093 -12.899 597 HB3 LEU 75 2HB LEU 75 -21.525 10.821 -12.253 598 HG LEU 75 HG LEU 75 -20.139 10.858 -14.930 599 HD11 LEU 75 1HD1 LEU 75 -19.450 8.560 -13.659 600 HD12 LEU 75 2HD1 LEU 75 -19.580 9.681 -12.304 601 HD13 LEU 75 3HD1 LEU 75 -18.494 10.041 -13.646 602 HD21 LEU 75 3HD2 LEU 75 -22.270 9.856 -15.288 603 HD22 LEU 75 1HD2 LEU 75 -22.153 8.930 -13.792 604 HD23 LEU 75 2HD2 LEU 75 -21.091 8.551 -15.148 605 H HIS 76 H HIS 76 -24.178 10.841 -12.302 606 HA HIS 76 HA HIS 76 -24.798 13.208 -10.657 607 HB2 HIS 76 1HB HIS 76 -26.529 11.448 -12.165 608 HB3 HIS 76 2HB HIS 76 -26.960 11.432 -10.457 609 HD1 HIS 76 HD1 HIS 76 -28.085 13.500 -9.513 610 HD2 HIS 76 HD2 HIS 76 -26.801 13.985 -13.434 611 HE1 HIS 76 HE1 HIS 76 -29.105 15.663 -10.292 612 H LEU 77 H LEU 77 -25.004 12.947 -8.452 613 HA LEU 77 HA LEU 77 -24.210 10.312 -7.397 614 HB2 LEU 77 1HB LEU 77 -23.168 11.547 -5.518 615 HB3 LEU 77 2HB LEU 77 -22.409 11.845 -7.080 616 HG LEU 77 HG LEU 77 -24.243 13.900 -6.851 617 HD11 LEU 77 1HD1 LEU 77 -22.808 14.042 -4.275 618 HD12 LEU 77 2HD1 LEU 77 -24.198 12.959 -4.345 619 HD13 LEU 77 3HD1 LEU 77 -24.392 14.669 -4.733 620 HD21 LEU 77 3HD2 LEU 77 -21.363 13.518 -6.834 621 HD22 LEU 77 1HD2 LEU 77 -21.863 14.952 -5.937 622 HD23 LEU 77 2HD2 LEU 77 -22.336 14.758 -7.625 623 H VAL 78 H VAL 78 -25.831 9.364 -6.368 624 HA VAL 78 HA VAL 78 -27.665 11.043 -4.783 625 HB VAL 78 HB VAL 78 -29.364 9.188 -5.192 626 HG11 VAL 78 1HG1 VAL 78 -30.235 10.287 -7.045 627 HG12 VAL 78 2HG1 VAL 78 -29.182 11.505 -6.322 628 HG13 VAL 78 3HG1 VAL 78 -28.642 10.596 -7.735 629 HG21 VAL 78 3HG2 VAL 78 -27.778 8.565 -7.650 630 HG22 VAL 78 1HG2 VAL 78 -27.464 7.696 -6.147 631 HG23 VAL 78 2HG2 VAL 78 -29.066 7.635 -6.882 632 H LEU 79 H LEU 79 -28.049 10.447 -2.717 633 HA LEU 79 HA LEU 79 -26.698 8.011 -1.762 634 HB2 LEU 79 1HB LEU 79 -27.184 10.683 -0.500 635 HB3 LEU 79 2HB LEU 79 -26.886 9.260 0.495 636 HG LEU 79 HG LEU 79 -24.711 8.977 -0.719 637 HD11 LEU 79 1HD1 LEU 79 -24.478 10.125 -2.612 638 HD12 LEU 79 2HD1 LEU 79 -24.181 11.535 -1.597 639 HD13 LEU 79 3HD1 LEU 79 -25.803 11.217 -2.210 640 HD21 LEU 79 3HD2 LEU 79 -23.817 11.251 0.360 641 HD22 LEU 79 1HD2 LEU 79 -24.291 9.854 1.327 642 HD23 LEU 79 2HD2 LEU 79 -25.414 11.196 1.107 643 H ARG 80 H ARG 80 -27.814 6.511 -0.632 644 HA ARG 80 HA ARG 80 -30.664 6.570 -0.738 645 HB2 ARG 80 1HB ARG 80 -29.382 4.483 -0.971 646 HB3 ARG 80 2HB ARG 80 -28.817 4.646 0.686 647 HG2 ARG 80 1HG ARG 80 -30.548 3.109 0.840 648 HG3 ARG 80 2HG ARG 80 -31.302 4.630 1.323 649 HD2 ARG 80 1HD ARG 80 -31.900 4.819 -1.203 650 HD3 ARG 80 2HD ARG 80 -31.610 3.080 -1.214 651 HE ARG 80 HE ARG 80 -33.304 3.404 0.866 652 HH11 ARG 80 1HH1 ARG 80 -33.384 4.432 -2.459 653 HH12 ARG 80 2HH1 ARG 80 -35.113 4.387 -2.567 654 HH21 ARG 80 1HH2 ARG 80 -35.580 3.342 0.736 655 HH22 ARG 80 2HH2 ARG 80 -36.361 3.769 -0.749 656 H LEU 81 H LEU 81 -28.301 6.725 1.911 657 HA LEU 81 HA LEU 81 -30.453 7.402 3.776 658 HB2 LEU 81 1HB LEU 81 -27.576 6.620 4.163 659 HB3 LEU 81 2HB LEU 81 -28.583 7.221 5.479 660 HG LEU 81 HG LEU 81 -30.162 5.259 4.793 661 HD11 LEU 81 1HD1 LEU 81 -27.512 4.332 3.694 662 HD12 LEU 81 2HD1 LEU 81 -28.984 4.627 2.770 663 HD13 LEU 81 3HD1 LEU 81 -28.930 3.314 3.946 664 HD21 LEU 81 3HD2 LEU 81 -27.591 4.483 6.130 665 HD22 LEU 81 1HD2 LEU 81 -29.236 3.960 6.496 666 HD23 LEU 81 2HD2 LEU 81 -28.724 5.601 6.891 667 H ARG 82 H ARG 82 -29.475 9.001 5.583 668 HA ARG 82 HA ARG 82 -29.067 11.491 4.164 669 HB2 ARG 82 1HB ARG 82 -30.675 11.434 5.991 670 HB3 ARG 82 2HB ARG 82 -29.425 10.899 7.106 671 HG2 ARG 82 1HG ARG 82 -28.305 12.997 6.978 672 HG3 ARG 82 2HG ARG 82 -29.342 13.531 5.654 673 HD2 ARG 82 1HD ARG 82 -30.192 14.598 7.565 674 HD3 ARG 82 2HD ARG 82 -31.284 13.246 7.270 675 HE ARG 82 HE ARG 82 -29.157 12.640 9.107 676 HH11 ARG 82 1HH1 ARG 82 -32.363 13.952 8.765 677 HH12 ARG 82 2HH1 ARG 82 -32.810 13.633 10.408 678 HH21 ARG 82 1HH2 ARG 82 -29.733 12.216 11.272 679 HH22 ARG 82 2HH2 ARG 82 -31.313 12.647 11.834 680 H GLY 83 H GLY 83 -26.958 11.353 3.378 681 HA2 GLY 83 1HA GLY 83 -24.780 10.904 5.261 682 HA3 GLY 83 2HA GLY 83 -24.629 11.120 3.524 683 H TYR 84 H TYR 84 -23.847 12.478 6.367 684 HA TYR 84 HA TYR 84 -24.424 15.236 5.798 685 HB2 TYR 84 1HB TYR 84 -23.258 15.733 7.820 686 HB3 TYR 84 2HB TYR 84 -24.176 14.261 8.113 687 HD1 TYR 84 HD2 TYR 84 -22.991 12.064 8.156 688 HD2 TYR 84 HD1 TYR 84 -20.886 15.756 7.966 689 HE1 TYR 84 HE2 TYR 84 -20.937 10.923 8.882 690 HE2 TYR 84 HE1 TYR 84 -18.825 14.626 8.690 691 HH TYR 84 HH TYR 84 -18.592 12.012 10.193 692 H ALA 85 H ALA 85 -22.339 16.741 6.137 693 HA ALA 85 HA ALA 85 -20.366 15.862 4.131 694 HB1 ALA 85 1HB ALA 85 -20.823 17.673 2.938 695 HB2 ALA 85 2HB ALA 85 -22.076 18.113 4.099 696 HB3 ALA 85 3HB ALA 85 -20.428 18.702 4.315 697 H ASP 86 H ASP 86 -18.289 15.861 4.718 698 HA ASP 86 HA ASP 86 -17.571 17.197 7.245 699 HB2 ASP 86 1HB ASP 86 -17.485 14.622 7.081 700 HB3 ASP 86 2HB ASP 86 -16.059 14.873 6.077 701 H LEU 87 H LEU 87 -15.346 17.972 7.406 702 HA LEU 87 HA LEU 87 -14.525 19.228 4.910 703 HB2 LEU 87 1HB LEU 87 -13.547 19.627 7.734 704 HB3 LEU 87 2HB LEU 87 -13.046 20.576 6.335 705 HG LEU 87 HG LEU 87 -15.903 20.458 7.274 706 HD11 LEU 87 1HD1 LEU 87 -15.592 22.150 8.755 707 HD12 LEU 87 2HD1 LEU 87 -14.199 22.803 7.893 708 HD13 LEU 87 3HD1 LEU 87 -14.016 21.372 8.907 709 HD21 LEU 87 3HD2 LEU 87 -15.043 21.282 4.922 710 HD22 LEU 87 1HD2 LEU 87 -14.653 22.740 5.833 711 HD23 LEU 87 2HD2 LEU 87 -16.313 22.146 5.789 712 H ARG 88 H ARG 88 -12.406 19.131 4.089 713 HA ARG 88 HA ARG 88 -10.411 17.443 5.248 714 HB2 ARG 88 1HB ARG 88 -11.995 15.769 4.282 715 HB3 ARG 88 2HB ARG 88 -11.704 16.471 2.696 716 HG2 ARG 88 1HG ARG 88 -10.335 14.564 2.829 717 HG3 ARG 88 2HG ARG 88 -9.260 15.946 3.050 718 HD2 ARG 88 1HD ARG 88 -10.461 14.663 5.455 719 HD3 ARG 88 2HD ARG 88 -9.135 13.842 4.632 720 HE ARG 88 HE ARG 88 -8.389 16.502 5.031 721 HH11 ARG 88 1HH1 ARG 88 -9.085 13.651 6.903 722 HH12 ARG 88 2HH1 ARG 88 -8.030 14.089 8.205 723 HH21 ARG 88 1HH2 ARG 88 -6.996 17.090 6.739 724 HH22 ARG 88 2HH2 ARG 88 -6.842 16.046 8.111 725 H GLU 89 H GLU 89 -8.551 18.375 4.737 726 HA GLU 89 HA GLU 89 -8.418 20.123 2.406 727 HB2 GLU 89 1HB GLU 89 -6.476 19.703 4.685 728 HB3 GLU 89 2HB GLU 89 -6.265 20.869 3.386 729 HG2 GLU 89 1HG GLU 89 -8.403 20.856 5.498 730 HG3 GLU 89 2HG GLU 89 -7.092 22.017 5.301 731 H ASP 90 H ASP 90 -7.743 19.308 0.546 732 HA ASP 90 HA ASP 90 -5.417 17.539 0.522 733 HB2 ASP 90 1HB ASP 90 -6.996 15.846 0.364 734 HB3 ASP 90 2HB ASP 90 -8.143 16.857 -0.511 735 HA PRO 91 HA PRO 91 -4.213 20.118 -2.831 736 HB2 PRO 91 1HB PRO 91 -2.425 18.468 -4.038 737 HB3 PRO 91 2HB PRO 91 -2.092 19.293 -2.510 738 HG2 PRO 91 1HG PRO 91 -2.976 16.473 -2.987 739 HG3 PRO 91 2HG PRO 91 -1.749 17.086 -1.863 740 HD2 PRO 91 1HD PRO 91 -4.250 16.418 -1.068 741 HD3 PRO 91 2HD PRO 91 -3.319 17.719 -0.298 742 H ASP 92 H ASP 92 -6.212 20.157 -3.971 743 HA ASP 92 HA ASP 92 -7.054 18.086 -5.709 744 HB2 ASP 92 1HB ASP 92 -7.805 20.939 -5.271 745 HB3 ASP 92 2HB ASP 92 -8.323 20.168 -6.768 746 H ARG 93 H ARG 93 -6.002 21.348 -6.681 747 HA ARG 93 HA ARG 93 -5.064 20.259 -9.214 748 HB2 ARG 93 1HB ARG 93 -5.642 23.007 -8.177 749 HB3 ARG 93 2HB ARG 93 -4.594 22.816 -9.576 750 HG2 ARG 93 1HG ARG 93 -6.299 21.913 -10.884 751 HG3 ARG 93 2HG ARG 93 -7.300 21.538 -9.479 752 HD2 ARG 93 1HD ARG 93 -8.345 23.412 -10.340 753 HD3 ARG 93 2HD ARG 93 -7.293 24.104 -9.106 754 HE ARG 93 HE ARG 93 -6.020 24.018 -11.653 755 HH11 ARG 93 1HH1 ARG 93 -8.333 25.786 -9.743 756 HH12 ARG 93 2HH1 ARG 93 -8.076 27.282 -10.580 757 HH21 ARG 93 1HH2 ARG 93 -5.674 25.981 -12.762 758 HH22 ARG 93 2HH2 ARG 93 -6.565 27.391 -12.298 759 H GLN 94 H GLN 94 -2.957 20.478 -9.985 760 HA GLN 94 HA GLN 94 -0.895 21.676 -8.387 761 HB2 GLN 94 1HB GLN 94 0.386 19.622 -7.998 762 HB3 GLN 94 2HB GLN 94 -1.170 19.570 -7.180 763 HG2 GLN 94 1HG GLN 94 -0.972 18.383 -9.893 764 HG3 GLN 94 2HG GLN 94 -0.243 17.517 -8.543 765 HE21 GLN 94 2HE2 GLN 94 -2.249 16.334 -9.886 766 HE22 GLN 94 1HE2 GLN 94 -3.688 16.301 -8.932 767 H ASP 95 H ASP 95 1.155 21.720 -9.451 768 HA ASP 95 HA ASP 95 1.515 20.529 -12.024 769 HB2 ASP 95 1HB ASP 95 -0.069 22.580 -12.332 770 HB3 ASP 95 2HB ASP 95 1.400 23.526 -12.110 771 H HIS 96 H HIS 96 3.570 21.315 -13.062 772 HA HIS 96 HA HIS 96 5.548 21.782 -10.958 773 HB2 HIS 96 1HB HIS 96 5.901 20.865 -13.819 774 HB3 HIS 96 2HB HIS 96 7.196 21.023 -12.637 775 HD1 HIS 96 HD1 HIS 96 4.161 18.932 -13.408 776 HD2 HIS 96 HD2 HIS 96 7.462 18.905 -10.885 777 HE1 HIS 96 HE1 HIS 96 4.175 16.654 -12.344 778 H HIS 97 H HIS 97 4.604 23.012 -14.148 779 HA HIS 97 HA HIS 97 4.999 24.988 -15.205 780 HB2 HIS 97 1HB HIS 97 3.960 25.677 -12.891 781 HB3 HIS 97 2HB HIS 97 5.576 26.303 -12.578 782 HD1 HIS 97 HD1 HIS 97 5.678 27.039 -15.845 783 HD2 HIS 97 HD2 HIS 97 3.128 28.426 -12.873 784 HE1 HIS 97 HE1 HIS 97 4.803 29.242 -16.685 785 HA PRO 98 HA PRO 98 9.590 24.382 -14.732 786 HB2 PRO 98 1HB PRO 98 10.011 23.702 -17.326 787 HB3 PRO 98 2HB PRO 98 9.576 22.523 -16.082 788 HG2 PRO 98 1HG PRO 98 7.836 23.856 -18.121 789 HG3 PRO 98 2HG PRO 98 7.857 22.159 -17.605 790 HD2 PRO 98 1HD PRO 98 6.023 23.935 -16.701 791 HD3 PRO 98 2HD PRO 98 6.622 22.590 -15.707 792 H GLY 99 H GLY 99 9.770 26.651 -14.437 793 HA2 GLY 99 1HA GLY 99 10.334 28.089 -16.944 794 HA3 GLY 99 2HA GLY 99 9.325 28.838 -15.715 795 H SER 100 H SER 100 12.432 28.543 -16.885 796 HA SER 100 HA SER 100 14.483 29.208 -16.155 797 HB2 SER 100 1HB SER 100 14.552 31.250 -15.067 798 HB3 SER 100 2HB SER 100 12.891 31.253 -15.660 799 HG SER 100 HG SER 100 13.847 31.117 -13.083 800 H GLY 101 H GLY 101 13.146 26.884 -14.869 801 HA2 GLY 101 1HA GLY 101 14.578 26.917 -12.285 802 HA3 GLY 101 2HA GLY 101 13.147 25.948 -12.605 803 H ALA 102 H ALA 102 13.335 24.006 -13.687 804 HA ALA 102 HA ALA 102 15.765 23.165 -14.930 805 HB1 ALA 102 1HB ALA 102 15.133 22.137 -12.173 806 HB2 ALA 102 2HB ALA 102 16.207 21.301 -13.296 807 HB3 ALA 102 3HB ALA 102 16.612 22.921 -12.729 808 H GLN 103 H GLN 103 15.278 21.669 -16.407 809 HA GLN 103 HA GLN 103 12.710 20.821 -16.949 810 HB2 GLN 103 1HB GLN 103 13.637 19.365 -18.571 811 HB3 GLN 103 2HB GLN 103 14.733 20.736 -18.474 812 HG2 GLN 103 1HG GLN 103 15.147 18.087 -17.107 813 HG3 GLN 103 2HG GLN 103 15.905 18.586 -18.619 814 HE21 GLN 103 2HE2 GLN 103 16.899 20.917 -18.349 815 HE22 GLN 103 1HE2 GLN 103 17.945 21.079 -16.983 Start of MODEL 7 1 H1 GLY 1 H GLY 1 4.099 4.973 -8.296 2 HA2 GLY 1 1HA GLY 1 2.656 3.323 -7.554 3 HA3 GLY 1 2HA GLY 1 3.197 3.901 -5.984 4 H SER 2 H SER 2 2.009 6.134 -5.453 5 HA SER 2 HA SER 2 -0.815 5.436 -5.412 6 HB2 SER 2 1HB SER 2 0.892 7.390 -3.894 7 HB3 SER 2 2HB SER 2 -0.866 7.532 -3.871 8 HG SER 2 HG SER 2 -0.861 5.276 -3.187 9 H LEU 3 H LEU 3 1.300 7.997 -6.588 10 HA LEU 3 HA LEU 3 -0.942 9.005 -8.204 11 HB2 LEU 3 1HB LEU 3 -0.154 10.417 -6.145 12 HB3 LEU 3 2HB LEU 3 1.173 10.865 -7.215 13 HG LEU 3 HG LEU 3 -1.740 11.279 -7.875 14 HD11 LEU 3 1HD1 LEU 3 -0.837 13.753 -7.506 15 HD12 LEU 3 2HD1 LEU 3 0.191 12.919 -6.342 16 HD13 LEU 3 3HD1 LEU 3 -1.563 12.806 -6.207 17 HD21 LEU 3 3HD2 LEU 3 -0.205 13.064 -9.296 18 HD22 LEU 3 1HD2 LEU 3 -0.894 11.566 -9.920 19 HD23 LEU 3 2HD2 LEU 3 0.766 11.592 -9.325 20 H VAL 4 H VAL 4 -0.511 9.289 -10.312 21 HA VAL 4 HA VAL 4 2.304 9.127 -11.173 22 HB VAL 4 HB VAL 4 1.334 8.081 -13.303 23 HG11 VAL 4 1HG1 VAL 4 0.967 6.238 -10.992 24 HG12 VAL 4 2HG1 VAL 4 1.824 5.984 -12.513 25 HG13 VAL 4 3HG1 VAL 4 2.545 6.980 -11.248 26 HG21 VAL 4 3HG2 VAL 4 -0.895 7.095 -11.596 27 HG22 VAL 4 1HG2 VAL 4 -1.056 8.677 -12.358 28 HG23 VAL 4 2HG2 VAL 4 -0.796 7.242 -13.350 29 HA PRO 5 HA PRO 5 1.724 12.823 -13.470 30 HB2 PRO 5 1HB PRO 5 3.304 12.370 -15.631 31 HB3 PRO 5 2HB PRO 5 3.952 12.696 -14.019 32 HG2 PRO 5 1HG PRO 5 3.591 10.076 -15.422 33 HG3 PRO 5 2HG PRO 5 4.964 10.649 -14.458 34 HD2 PRO 5 1HD PRO 5 3.093 8.959 -13.469 35 HD3 PRO 5 2HD PRO 5 3.926 10.158 -12.459 36 H ARG 6 H ARG 6 1.540 9.879 -15.466 37 HA ARG 6 HA ARG 6 -0.549 11.191 -17.074 38 HB2 ARG 6 1HB ARG 6 1.387 8.985 -17.778 39 HB3 ARG 6 2HB ARG 6 0.013 9.418 -18.786 40 HG2 ARG 6 1HG ARG 6 2.166 11.360 -17.989 41 HG3 ARG 6 2HG ARG 6 2.200 10.411 -19.476 42 HD2 ARG 6 1HD ARG 6 -0.172 11.411 -19.850 43 HD3 ARG 6 2HD ARG 6 0.349 12.619 -18.677 44 HE ARG 6 HE ARG 6 2.370 12.513 -20.516 45 HH11 ARG 6 1HH1 ARG 6 -1.058 13.107 -20.633 46 HH12 ARG 6 2HH1 ARG 6 -0.961 14.158 -22.007 47 HH21 ARG 6 1HH2 ARG 6 2.511 13.896 -22.324 48 HH22 ARG 6 2HH2 ARG 6 1.070 14.606 -22.968 49 H GLY 7 H GLY 7 -2.183 9.625 -18.000 50 HA2 GLY 7 1HA GLY 7 -3.591 7.767 -17.793 51 HA3 GLY 7 2HA GLY 7 -2.682 7.263 -16.376 52 H SER 8 H SER 8 -4.366 10.303 -17.137 53 HA SER 8 HA SER 8 -6.457 9.771 -15.237 54 HB2 SER 8 1HB SER 8 -4.575 12.049 -14.600 55 HB3 SER 8 2HB SER 8 -5.932 11.472 -13.633 56 HG SER 8 HG SER 8 -3.936 10.702 -12.835 57 H MET 9 H MET 9 -8.065 11.474 -15.173 58 HA MET 9 HA MET 9 -7.825 13.642 -17.077 59 HB2 MET 9 1HB MET 9 -9.487 12.994 -18.575 60 HB3 MET 9 2HB MET 9 -8.605 11.498 -18.298 61 HG2 MET 9 1HG MET 9 -10.541 11.448 -16.348 62 HG3 MET 9 2HG MET 9 -11.370 12.172 -17.724 63 HE1 MET 9 3HE MET 9 -12.528 9.147 -16.806 64 HE2 MET 9 1HE MET 9 -11.222 7.965 -16.898 65 HE3 MET 9 2HE MET 9 -11.054 9.386 -15.867 66 H GLN 10 H GLN 10 -9.544 15.190 -16.909 67 HA GLN 10 HA GLN 10 -10.769 15.166 -14.257 68 HB2 GLN 10 1HB GLN 10 -9.405 17.125 -15.405 69 HB3 GLN 10 2HB GLN 10 -10.976 17.506 -16.097 70 HG2 GLN 10 1HG GLN 10 -11.865 18.132 -14.100 71 HG3 GLN 10 2HG GLN 10 -10.831 17.047 -13.172 72 HE21 GLN 10 2HE2 GLN 10 -10.535 19.871 -15.304 73 HE22 GLN 10 1HE2 GLN 10 -9.353 20.685 -14.343 74 H ILE 11 H ILE 11 -12.912 15.049 -13.905 75 HA ILE 11 HA ILE 11 -14.694 15.107 -16.251 76 HB ILE 11 HB ILE 11 -16.024 13.326 -15.328 77 HG12 ILE 11 1HG1 ILE 11 -14.048 13.307 -13.035 78 HG13 ILE 11 2HG1 ILE 11 -15.723 13.841 -12.949 79 HG21 ILE 11 1HG2 ILE 11 -13.594 11.860 -14.938 80 HG22 ILE 11 2HG2 ILE 11 -14.694 11.850 -16.316 81 HG23 ILE 11 3HG2 ILE 11 -13.385 13.029 -16.242 82 HD11 ILE 11 3HD1 ILE 11 -15.547 11.644 -12.022 83 HD12 ILE 11 1HD1 ILE 11 -16.432 11.548 -13.544 84 HD13 ILE 11 2HD1 ILE 11 -14.742 11.048 -13.474 85 H PHE 12 H PHE 12 -17.031 15.403 -15.599 86 HA PHE 12 HA PHE 12 -17.178 17.389 -13.429 87 HB2 PHE 12 1HB PHE 12 -18.876 17.151 -15.922 88 HB3 PHE 12 2HB PHE 12 -19.085 18.363 -14.662 89 HD1 PHE 12 HD2 PHE 12 -16.803 19.668 -14.103 90 HD2 PHE 12 HD1 PHE 12 -17.764 17.806 -17.808 91 HE1 PHE 12 HE2 PHE 12 -15.204 21.142 -15.255 92 HE2 PHE 12 HE1 PHE 12 -16.166 19.277 -18.966 93 HZ PHE 12 HZ PHE 12 -14.885 20.948 -17.689 94 H VAL 13 H VAL 13 -18.468 16.991 -11.751 95 HA VAL 13 HA VAL 13 -20.541 14.917 -12.034 96 HB VAL 13 HB VAL 13 -18.826 15.345 -9.584 97 HG11 VAL 13 1HG1 VAL 13 -20.234 14.023 -8.478 98 HG12 VAL 13 2HG1 VAL 13 -21.350 14.206 -9.833 99 HG13 VAL 13 3HG1 VAL 13 -20.242 12.833 -9.779 100 HG21 VAL 13 3HG2 VAL 13 -17.283 14.159 -10.680 101 HG22 VAL 13 1HG2 VAL 13 -18.377 12.785 -10.515 102 HG23 VAL 13 2HG2 VAL 13 -18.400 13.760 -11.984 103 H LYS 14 H LYS 14 -22.513 15.462 -11.336 104 HA LYS 14 HA LYS 14 -22.842 18.084 -10.078 105 HB2 LYS 14 1HB LYS 14 -24.639 16.276 -11.655 106 HB3 LYS 14 2HB LYS 14 -25.339 17.502 -10.606 107 HG2 LYS 14 1HG LYS 14 -25.204 18.406 -12.800 108 HG3 LYS 14 2HG LYS 14 -23.979 19.208 -11.814 109 HD2 LYS 14 1HD LYS 14 -22.255 17.778 -12.748 110 HD3 LYS 14 2HD LYS 14 -23.464 16.888 -13.676 111 HE2 LYS 14 1HE LYS 14 -22.204 18.592 -14.992 112 HE3 LYS 14 2HE LYS 14 -23.954 18.809 -15.010 113 HZ1 LYS 14 3HZ LYS 14 -22.694 20.233 -12.871 114 HZ2 LYS 14 1HZ LYS 14 -23.769 20.792 -14.053 115 HZ3 LYS 14 2HZ LYS 14 -22.112 20.714 -14.385 116 H THR 15 H THR 15 -23.672 18.370 -8.079 117 HA THR 15 HA THR 15 -24.059 15.972 -6.452 118 HB THR 15 HB THR 15 -23.884 17.447 -4.514 119 HG1 THR 15 HG1 THR 15 -23.421 19.590 -6.325 120 HG21 THR 15 3HG2 THR 15 -21.826 17.144 -6.529 121 HG22 THR 15 1HG2 THR 15 -21.705 17.025 -4.774 122 HG23 THR 15 2HG2 THR 15 -21.576 18.598 -5.562 123 H LEU 16 H LEU 16 -25.705 16.515 -4.530 124 HA LEU 16 HA LEU 16 -28.276 16.621 -5.781 125 HB2 LEU 16 1HB LEU 16 -29.163 16.221 -3.569 126 HB3 LEU 16 2HB LEU 16 -27.805 15.145 -3.888 127 HG LEU 16 HG LEU 16 -26.464 17.010 -2.588 128 HD11 LEU 16 1HD1 LEU 16 -27.624 18.490 -1.398 129 HD12 LEU 16 2HD1 LEU 16 -28.770 17.270 -0.843 130 HD13 LEU 16 3HD1 LEU 16 -29.008 18.058 -2.403 131 HD21 LEU 16 3HD2 LEU 16 -26.573 14.707 -1.895 132 HD22 LEU 16 1HD2 LEU 16 -28.223 14.921 -1.310 133 HD23 LEU 16 2HD2 LEU 16 -26.888 15.742 -0.501 134 H THR 17 H THR 17 -26.196 18.922 -4.331 135 HA THR 17 HA THR 17 -28.356 20.826 -3.843 136 HB THR 17 HB THR 17 -26.575 20.660 -2.156 137 HG1 THR 17 HG1 THR 17 -26.921 22.719 -1.855 138 HG21 THR 17 3HG2 THR 17 -24.660 20.066 -3.426 139 HG22 THR 17 1HG2 THR 17 -24.333 21.668 -2.766 140 HG23 THR 17 2HG2 THR 17 -24.812 21.490 -4.454 141 H GLY 18 H GLY 18 -27.420 19.891 -6.565 142 HA2 GLY 18 1HA GLY 18 -27.168 20.817 -8.650 143 HA3 GLY 18 2HA GLY 18 -27.748 22.315 -7.938 144 H LYS 19 H LYS 19 -24.900 20.813 -6.662 145 HA LYS 19 HA LYS 19 -23.304 23.026 -7.751 146 HB2 LYS 19 1HB LYS 19 -23.330 22.934 -5.331 147 HB3 LYS 19 2HB LYS 19 -22.849 21.243 -5.353 148 HG2 LYS 19 1HG LYS 19 -21.063 23.200 -6.684 149 HG3 LYS 19 2HG LYS 19 -21.120 23.195 -4.920 150 HD2 LYS 19 1HD LYS 19 -20.897 20.544 -6.179 151 HD3 LYS 19 2HD LYS 19 -19.502 21.603 -6.400 152 HE2 LYS 19 1HE LYS 19 -20.090 21.938 -3.744 153 HE3 LYS 19 2HE LYS 19 -20.470 20.236 -4.004 154 HZ1 LYS 19 3HZ LYS 19 -17.953 21.226 -5.101 155 HZ2 LYS 19 1HZ LYS 19 -18.318 19.722 -4.417 156 HZ3 LYS 19 2HZ LYS 19 -18.045 21.061 -3.420 157 H THR 20 H THR 20 -21.555 22.672 -9.008 158 HA THR 20 HA THR 20 -21.088 19.922 -9.884 159 HB THR 20 HB THR 20 -19.702 22.238 -11.157 160 HG1 THR 20 HG1 THR 20 -21.506 22.970 -12.092 161 HG21 THR 20 3HG2 THR 20 -20.855 19.610 -12.058 162 HG22 THR 20 1HG2 THR 20 -19.176 20.147 -12.107 163 HG23 THR 20 2HG2 THR 20 -20.362 20.858 -13.202 164 H ILE 21 H ILE 21 -19.402 18.798 -9.182 165 HA ILE 21 HA ILE 21 -17.120 20.265 -8.031 166 HB ILE 21 HB ILE 21 -18.194 18.994 -6.308 167 HG12 ILE 21 1HG1 ILE 21 -15.566 18.829 -6.842 168 HG13 ILE 21 2HG1 ILE 21 -16.305 18.050 -5.447 169 HG21 ILE 21 1HG2 ILE 21 -19.488 17.437 -7.549 170 HG22 ILE 21 2HG2 ILE 21 -18.048 16.695 -8.244 171 HG23 ILE 21 3HG2 ILE 21 -18.399 16.499 -6.528 172 HD11 ILE 21 3HD1 ILE 21 -16.333 15.945 -6.538 173 HD12 ILE 21 1HD1 ILE 21 -15.883 16.670 -8.081 174 HD13 ILE 21 2HD1 ILE 21 -14.722 16.629 -6.754 175 H THR 22 H THR 22 -15.120 19.885 -8.797 176 HA THR 22 HA THR 22 -14.859 18.296 -11.193 177 HB THR 22 HB THR 22 -12.449 19.478 -9.918 178 HG1 THR 22 HG1 THR 22 -14.562 21.035 -11.035 179 HG21 THR 22 3HG2 THR 22 -12.672 18.351 -12.232 180 HG22 THR 22 1HG2 THR 22 -11.776 19.865 -12.118 181 HG23 THR 22 2HG2 THR 22 -13.432 19.863 -12.726 182 H LEU 23 H LEU 23 -13.972 16.328 -11.380 183 HA LEU 23 HA LEU 23 -12.449 15.239 -9.118 184 HB2 LEU 23 1HB LEU 23 -14.994 14.537 -9.417 185 HB3 LEU 23 2HB LEU 23 -14.284 13.420 -10.581 186 HG LEU 23 HG LEU 23 -12.860 12.502 -8.785 187 HD11 LEU 23 1HD1 LEU 23 -13.872 13.140 -6.421 188 HD12 LEU 23 2HD1 LEU 23 -14.183 14.666 -7.247 189 HD13 LEU 23 3HD1 LEU 23 -12.537 14.040 -7.142 190 HD21 LEU 23 3HD2 LEU 23 -14.700 11.168 -9.093 191 HD22 LEU 23 1HD2 LEU 23 -15.836 12.443 -8.650 192 HD23 LEU 23 2HD2 LEU 23 -14.906 11.618 -7.399 193 H GLU 24 H GLU 24 -10.850 13.761 -9.648 194 HA GLU 24 HA GLU 24 -10.277 13.533 -12.529 195 HB2 GLU 24 1HB GLU 24 -8.510 14.776 -11.662 196 HB3 GLU 24 2HB GLU 24 -8.500 13.890 -10.144 197 HG2 GLU 24 1HG GLU 24 -7.233 12.192 -10.976 198 HG3 GLU 24 2HG GLU 24 -7.826 12.407 -12.622 199 H VAL 25 H VAL 25 -10.168 11.566 -13.404 200 HA VAL 25 HA VAL 25 -9.632 9.247 -11.705 201 HB VAL 25 HB VAL 25 -11.808 8.851 -13.668 202 HG11 VAL 25 1HG1 VAL 25 -11.343 6.933 -12.489 203 HG12 VAL 25 2HG1 VAL 25 -10.990 7.806 -10.996 204 HG13 VAL 25 3HG1 VAL 25 -12.660 7.606 -11.528 205 HG21 VAL 25 3HG2 VAL 25 -12.585 10.923 -12.779 206 HG22 VAL 25 1HG2 VAL 25 -13.504 9.636 -11.997 207 HG23 VAL 25 2HG2 VAL 25 -12.189 10.433 -11.132 208 H GLU 26 H GLU 26 -9.531 7.206 -13.159 209 HA GLU 26 HA GLU 26 -7.924 7.919 -15.512 210 HB2 GLU 26 1HB GLU 26 -7.974 5.193 -14.255 211 HB3 GLU 26 2HB GLU 26 -6.707 5.941 -15.217 212 HG2 GLU 26 1HG GLU 26 -6.198 7.463 -13.387 213 HG3 GLU 26 2HG GLU 26 -7.487 6.745 -12.423 214 HA PRO 27 HA PRO 27 -10.787 6.158 -18.333 215 HB2 PRO 27 1HB PRO 27 -9.124 5.095 -20.197 216 HB3 PRO 27 2HB PRO 27 -9.372 6.835 -20.013 217 HG2 PRO 27 1HG PRO 27 -7.136 5.123 -18.998 218 HG3 PRO 27 2HG PRO 27 -7.064 6.726 -19.754 219 HD2 PRO 27 1HD PRO 27 -6.892 6.369 -17.075 220 HD3 PRO 27 2HD PRO 27 -7.631 7.811 -17.801 221 H SER 28 H SER 28 -8.422 4.154 -16.796 222 HA SER 28 HA SER 28 -9.920 1.739 -17.567 223 HB2 SER 28 1HB SER 28 -7.416 1.901 -18.077 224 HB3 SER 28 2HB SER 28 -7.165 1.771 -16.336 225 HG SER 28 HG SER 28 -8.553 -0.106 -17.954 226 H ASP 29 H ASP 29 -9.939 3.909 -15.212 227 HA ASP 29 HA ASP 29 -9.780 2.232 -12.883 228 HB2 ASP 29 1HB ASP 29 -10.409 5.088 -13.434 229 HB3 ASP 29 2HB ASP 29 -11.033 4.398 -11.938 230 H THR 30 H THR 30 -11.493 1.585 -11.545 231 HA THR 30 HA THR 30 -13.991 1.133 -12.989 232 HB THR 30 HB THR 30 -14.519 -0.479 -11.208 233 HG1 THR 30 HG1 THR 30 -13.319 0.633 -9.532 234 HG21 THR 30 3HG2 THR 30 -12.269 -0.641 -13.012 235 HG22 THR 30 1HG2 THR 30 -13.455 -1.875 -12.587 236 HG23 THR 30 2HG2 THR 30 -12.015 -1.656 -11.592 237 H ILE 31 H ILE 31 -16.006 1.109 -11.516 238 HA ILE 31 HA ILE 31 -16.645 3.694 -10.778 239 HB ILE 31 HB ILE 31 -17.885 1.167 -9.681 240 HG12 ILE 31 1HG1 ILE 31 -17.907 1.150 -12.109 241 HG13 ILE 31 2HG1 ILE 31 -19.531 1.478 -11.515 242 HG21 ILE 31 1HG2 ILE 31 -18.710 2.872 -8.341 243 HG22 ILE 31 2HG2 ILE 31 -18.718 4.041 -9.660 244 HG23 ILE 31 3HG2 ILE 31 -19.923 2.753 -9.615 245 HD11 ILE 31 3HD1 ILE 31 -17.668 3.214 -13.013 246 HD12 ILE 31 1HD1 ILE 31 -19.419 3.051 -13.134 247 HD13 ILE 31 2HD1 ILE 31 -18.709 3.983 -11.816 248 H GLU 32 H GLU 32 -15.081 1.197 -8.922 249 HA GLU 32 HA GLU 32 -15.498 2.248 -6.342 250 HB2 GLU 32 1HB GLU 32 -13.078 0.691 -7.254 251 HB3 GLU 32 2HB GLU 32 -13.728 0.796 -5.624 252 HG2 GLU 32 1HG GLU 32 -15.827 -0.288 -6.563 253 HG3 GLU 32 2HG GLU 32 -14.861 -0.651 -7.992 254 H ASN 33 H ASN 33 -13.143 2.958 -8.840 255 HA ASN 33 HA ASN 33 -11.404 4.508 -7.208 256 HB2 ASN 33 1HB ASN 33 -11.722 3.976 -10.110 257 HB3 ASN 33 2HB ASN 33 -10.891 5.466 -9.671 258 HD21 ASN 33 2HD2 ASN 33 -9.295 5.035 -7.741 259 HD22 ASN 33 1HD2 ASN 33 -8.219 3.710 -8.003 260 H VAL 34 H VAL 34 -14.036 5.335 -9.440 261 HA VAL 34 HA VAL 34 -13.875 8.094 -9.357 262 HB VAL 34 HB VAL 34 -16.384 6.413 -9.469 263 HG11 VAL 34 1HG1 VAL 34 -15.878 9.330 -9.820 264 HG12 VAL 34 2HG1 VAL 34 -17.119 8.547 -10.802 265 HG13 VAL 34 3HG1 VAL 34 -17.229 8.506 -9.041 266 HG21 VAL 34 3HG2 VAL 34 -16.020 6.081 -11.669 267 HG22 VAL 34 1HG2 VAL 34 -15.309 7.678 -11.899 268 HG23 VAL 34 2HG2 VAL 34 -14.335 6.366 -11.235 269 H LYS 35 H LYS 35 -15.709 5.951 -7.187 270 HA LYS 35 HA LYS 35 -16.713 8.016 -5.539 271 HB2 LYS 35 1HB LYS 35 -17.810 5.894 -5.506 272 HB3 LYS 35 2HB LYS 35 -16.323 5.060 -5.077 273 HG2 LYS 35 1HG LYS 35 -16.339 6.213 -2.899 274 HG3 LYS 35 2HG LYS 35 -17.877 6.961 -3.334 275 HD2 LYS 35 1HD LYS 35 -18.434 5.090 -2.011 276 HD3 LYS 35 2HD LYS 35 -18.757 4.603 -3.677 277 HE2 LYS 35 1HE LYS 35 -17.598 2.770 -2.980 278 HE3 LYS 35 2HE LYS 35 -16.248 3.765 -3.524 279 HZ1 LYS 35 3HZ LYS 35 -16.868 4.374 -0.838 280 HZ2 LYS 35 1HZ LYS 35 -15.427 3.765 -1.483 281 HZ3 LYS 35 2HZ LYS 35 -16.650 2.704 -0.996 282 H ALA 36 H ALA 36 -13.695 6.294 -5.612 283 HA ALA 36 HA ALA 36 -12.768 6.674 -3.022 284 HB1 ALA 36 1HB ALA 36 -10.669 6.128 -3.810 285 HB2 ALA 36 2HB ALA 36 -11.715 5.426 -5.044 286 HB3 ALA 36 3HB ALA 36 -10.911 6.966 -5.344 287 H LYS 37 H LYS 37 -12.633 8.865 -5.802 288 HA LYS 37 HA LYS 37 -11.206 10.904 -4.379 289 HB2 LYS 37 1HB LYS 37 -12.754 11.078 -6.971 290 HB3 LYS 37 2HB LYS 37 -11.628 12.284 -6.363 291 HG2 LYS 37 1HG LYS 37 -10.857 9.450 -7.015 292 HG3 LYS 37 2HG LYS 37 -10.709 10.802 -8.140 293 HD2 LYS 37 1HD LYS 37 -9.074 11.856 -6.834 294 HD3 LYS 37 2HD LYS 37 -9.465 10.891 -5.408 295 HE2 LYS 37 1HE LYS 37 -8.693 8.878 -6.769 296 HE3 LYS 37 2HE LYS 37 -8.012 10.045 -7.900 297 HZ1 LYS 37 3HZ LYS 37 -7.359 10.224 -5.035 298 HZ2 LYS 37 1HZ LYS 37 -6.467 10.759 -6.370 299 HZ3 LYS 37 2HZ LYS 37 -6.548 9.107 -6.014 300 H ILE 38 H ILE 38 -14.553 10.117 -4.954 301 HA ILE 38 HA ILE 38 -15.690 12.613 -4.293 302 HB ILE 38 HB ILE 38 -16.851 9.838 -4.036 303 HG12 ILE 38 1HG1 ILE 38 -16.201 10.541 -6.330 304 HG13 ILE 38 2HG1 ILE 38 -17.938 10.314 -6.151 305 HG21 ILE 38 1HG2 ILE 38 -18.120 12.551 -3.764 306 HG22 ILE 38 2HG2 ILE 38 -19.045 11.089 -4.102 307 HG23 ILE 38 3HG2 ILE 38 -18.125 11.222 -2.604 308 HD11 ILE 38 3HD1 ILE 38 -17.458 12.283 -7.467 309 HD12 ILE 38 1HD1 ILE 38 -18.220 12.735 -5.942 310 HD13 ILE 38 2HD1 ILE 38 -16.482 12.946 -6.157 311 H GLN 39 H GLN 39 -14.507 9.963 -2.357 312 HA GLN 39 HA GLN 39 -15.768 10.444 0.064 313 HB2 GLN 39 1HB GLN 39 -12.953 9.488 -0.474 314 HB3 GLN 39 2HB GLN 39 -13.726 9.436 1.105 315 HG2 GLN 39 1HG GLN 39 -15.121 8.159 -1.183 316 HG3 GLN 39 2HG GLN 39 -13.708 7.353 -0.504 317 HE21 GLN 39 2HE2 GLN 39 -15.122 5.650 0.123 318 HE22 GLN 39 1HE2 GLN 39 -16.094 5.795 1.543 319 H ASP 40 H ASP 40 -13.086 12.120 -1.440 320 HA ASP 40 HA ASP 40 -12.435 13.665 0.895 321 HB2 ASP 40 1HB ASP 40 -10.833 13.067 -0.987 322 HB3 ASP 40 2HB ASP 40 -11.655 14.289 -1.953 323 H LYS 41 H LYS 41 -14.665 13.923 -1.719 324 HA LYS 41 HA LYS 41 -15.062 16.769 -1.460 325 HB2 LYS 41 1HB LYS 41 -16.934 14.869 -2.851 326 HB3 LYS 41 2HB LYS 41 -16.641 16.568 -3.198 327 HG2 LYS 41 1HG LYS 41 -14.658 14.345 -3.638 328 HG3 LYS 41 2HG LYS 41 -15.673 15.071 -4.886 329 HD2 LYS 41 1HD LYS 41 -14.558 17.132 -4.748 330 HD3 LYS 41 2HD LYS 41 -13.826 16.729 -3.193 331 HE2 LYS 41 1HE LYS 41 -12.788 14.758 -4.660 332 HE3 LYS 41 2HE LYS 41 -13.025 15.948 -5.939 333 HZ1 LYS 41 3HZ LYS 41 -10.833 16.154 -4.975 334 HZ2 LYS 41 1HZ LYS 41 -11.491 16.370 -3.432 335 HZ3 LYS 41 2HZ LYS 41 -11.743 17.537 -4.629 336 H GLU 42 H GLU 42 -16.970 13.855 -0.714 337 HA GLU 42 HA GLU 42 -18.482 15.470 1.234 338 HB2 GLU 42 1HB GLU 42 -19.446 13.245 -0.562 339 HB3 GLU 42 2HB GLU 42 -20.362 13.817 0.825 340 HG2 GLU 42 1HG GLU 42 -19.565 15.436 -1.583 341 HG3 GLU 42 2HG GLU 42 -21.179 14.836 -1.204 342 H GLY 43 H GLY 43 -17.010 12.369 0.477 343 HA2 GLY 43 1HA GLY 43 -16.098 10.794 1.894 344 HA3 GLY 43 2HA GLY 43 -16.448 11.871 3.237 345 H ILE 44 H ILE 44 -18.084 9.694 0.946 346 HA ILE 44 HA ILE 44 -19.838 8.862 3.163 347 HB ILE 44 HB ILE 44 -21.557 8.358 1.362 348 HG12 ILE 44 1HG1 ILE 44 -19.857 10.288 -0.230 349 HG13 ILE 44 2HG1 ILE 44 -19.948 8.557 -0.537 350 HG21 ILE 44 1HG2 ILE 44 -22.462 10.137 2.334 351 HG22 ILE 44 2HG2 ILE 44 -20.872 10.819 2.670 352 HG23 ILE 44 3HG2 ILE 44 -21.663 11.146 1.128 353 HD11 ILE 44 3HD1 ILE 44 -22.431 10.213 -0.522 354 HD12 ILE 44 1HD1 ILE 44 -21.382 10.179 -1.940 355 HD13 ILE 44 2HD1 ILE 44 -22.106 8.686 -1.341 356 HA PRO 45 HA PRO 45 -18.566 4.730 2.384 357 HB2 PRO 45 1HB PRO 45 -20.796 3.369 3.124 358 HB3 PRO 45 2HB PRO 45 -19.718 4.153 4.286 359 HG2 PRO 45 1HG PRO 45 -22.319 5.121 3.162 360 HG3 PRO 45 2HG PRO 45 -21.727 5.189 4.832 361 HD2 PRO 45 1HD PRO 45 -21.641 7.323 3.168 362 HD3 PRO 45 2HD PRO 45 -20.421 7.044 4.427 363 HA PRO 46 HA PRO 46 -19.954 3.262 -1.522 364 HB2 PRO 46 1HB PRO 46 -19.838 0.566 -1.225 365 HB3 PRO 46 2HB PRO 46 -18.397 1.582 -1.347 366 HG2 PRO 46 1HG PRO 46 -19.709 0.440 1.089 367 HG3 PRO 46 2HG PRO 46 -17.984 0.535 0.689 368 HD2 PRO 46 1HD PRO 46 -19.185 2.275 2.381 369 HD3 PRO 46 2HD PRO 46 -17.827 2.741 1.337 370 H ASP 47 H ASP 47 -21.653 2.224 1.327 371 HA ASP 47 HA ASP 47 -23.823 0.966 -0.072 372 HB2 ASP 47 1HB ASP 47 -24.853 0.720 2.081 373 HB3 ASP 47 2HB ASP 47 -23.133 0.393 2.274 374 H GLN 48 H GLN 48 -23.133 4.155 1.201 375 HA GLN 48 HA GLN 48 -25.831 5.079 0.588 376 HB2 GLN 48 1HB GLN 48 -24.135 5.740 2.604 377 HB3 GLN 48 2HB GLN 48 -23.801 7.034 1.462 378 HG2 GLN 48 1HG GLN 48 -26.388 7.263 1.375 379 HG3 GLN 48 2HG GLN 48 -26.329 6.389 2.905 380 HE21 GLN 48 2HE2 GLN 48 -27.329 8.952 2.719 381 HE22 GLN 48 1HE2 GLN 48 -26.276 10.036 3.556 382 H GLN 49 H GLN 49 -22.629 5.129 -0.709 383 HA GLN 49 HA GLN 49 -23.091 7.341 -2.493 384 HB2 GLN 49 1HB GLN 49 -20.835 6.820 -1.650 385 HB3 GLN 49 2HB GLN 49 -20.885 5.273 -2.485 386 HG2 GLN 49 1HG GLN 49 -19.757 6.425 -4.052 387 HG3 GLN 49 2HG GLN 49 -21.383 6.885 -4.553 388 HE21 GLN 49 2HE2 GLN 49 -21.746 8.967 -4.797 389 HE22 GLN 49 1HE2 GLN 49 -20.829 10.251 -4.093 390 H ARG 50 H ARG 50 -23.789 7.289 -4.552 391 HA ARG 50 HA ARG 50 -23.851 4.809 -6.047 392 HB2 ARG 50 1HB ARG 50 -26.273 6.058 -4.868 393 HB3 ARG 50 2HB ARG 50 -26.404 5.480 -6.524 394 HG2 ARG 50 1HG ARG 50 -25.512 3.818 -4.177 395 HG3 ARG 50 2HG ARG 50 -27.134 3.816 -4.873 396 HD2 ARG 50 1HD ARG 50 -25.985 3.227 -7.081 397 HD3 ARG 50 2HD ARG 50 -24.563 2.869 -6.101 398 HE ARG 50 HE ARG 50 -26.964 1.543 -5.224 399 HH11 ARG 50 1HH1 ARG 50 -24.188 1.384 -7.318 400 HH12 ARG 50 2HH1 ARG 50 -24.215 -0.344 -7.439 401 HH21 ARG 50 1HH2 ARG 50 -27.011 -0.732 -5.375 402 HH22 ARG 50 2HH2 ARG 50 -25.822 -1.547 -6.334 403 H LEU 51 H LEU 51 -23.172 5.313 -8.013 404 HA LEU 51 HA LEU 51 -23.472 8.051 -8.983 405 HB2 LEU 51 1HB LEU 51 -21.657 5.790 -9.537 406 HB3 LEU 51 2HB LEU 51 -22.044 6.827 -10.908 407 HG LEU 51 HG LEU 51 -21.069 8.721 -9.866 408 HD11 LEU 51 1HD1 LEU 51 -20.152 8.637 -7.580 409 HD12 LEU 51 2HD1 LEU 51 -20.850 7.031 -7.379 410 HD13 LEU 51 3HD1 LEU 51 -21.902 8.426 -7.619 411 HD21 LEU 51 3HD2 LEU 51 -18.897 7.152 -8.927 412 HD22 LEU 51 1HD2 LEU 51 -19.062 7.996 -10.467 413 HD23 LEU 51 2HD2 LEU 51 -19.611 6.327 -10.313 414 H ILE 52 H ILE 52 -24.626 8.618 -10.765 415 HA ILE 52 HA ILE 52 -26.145 6.473 -12.100 416 HB ILE 52 HB ILE 52 -27.147 9.294 -11.833 417 HG12 ILE 52 1HG1 ILE 52 -26.815 8.510 -9.563 418 HG13 ILE 52 2HG1 ILE 52 -28.535 8.488 -9.933 419 HG21 ILE 52 1HG2 ILE 52 -28.019 7.016 -13.224 420 HG22 ILE 52 2HG2 ILE 52 -29.138 7.235 -11.880 421 HG23 ILE 52 3HG2 ILE 52 -28.866 8.550 -13.024 422 HD11 ILE 52 3HD1 ILE 52 -26.744 6.312 -9.220 423 HD12 ILE 52 1HD1 ILE 52 -28.499 6.426 -9.101 424 HD13 ILE 52 2HD1 ILE 52 -27.747 5.963 -10.628 425 H PHE 53 H PHE 53 -25.860 6.303 -14.222 426 HA PHE 53 HA PHE 53 -24.908 8.654 -15.713 427 HB2 PHE 53 1HB PHE 53 -23.188 6.745 -15.178 428 HB3 PHE 53 2HB PHE 53 -24.014 5.901 -16.484 429 HD1 PHE 53 HD2 PHE 53 -22.523 9.246 -15.770 430 HD2 PHE 53 HD1 PHE 53 -23.181 6.141 -18.605 431 HE1 PHE 53 HE2 PHE 53 -21.155 10.462 -17.414 432 HE2 PHE 53 HE1 PHE 53 -21.813 7.351 -20.254 433 HZ PHE 53 HZ PHE 53 -20.799 9.515 -19.659 434 H ALA 54 H ALA 54 -26.216 9.178 -17.326 435 HA ALA 54 HA ALA 54 -27.898 9.090 -18.862 436 HB1 ALA 54 1HB ALA 54 -26.958 6.280 -19.387 437 HB2 ALA 54 2HB ALA 54 -27.735 7.395 -20.512 438 HB3 ALA 54 3HB ALA 54 -26.094 7.711 -19.948 439 H GLY 55 H GLY 55 -28.810 8.609 -16.318 440 HA2 GLY 55 1HA GLY 55 -30.685 7.850 -15.231 441 HA3 GLY 55 2HA GLY 55 -31.288 7.349 -16.805 442 H LYS 56 H LYS 56 -28.255 6.063 -15.850 443 HA LYS 56 HA LYS 56 -29.544 3.559 -14.992 444 HB2 LYS 56 1HB LYS 56 -28.804 3.336 -17.319 445 HB3 LYS 56 2HB LYS 56 -27.179 3.826 -16.858 446 HG2 LYS 56 1HG LYS 56 -27.164 1.470 -17.087 447 HG3 LYS 56 2HG LYS 56 -27.097 1.821 -15.359 448 HD2 LYS 56 1HD LYS 56 -28.675 0.113 -15.505 449 HD3 LYS 56 2HD LYS 56 -29.661 1.576 -15.429 450 HE2 LYS 56 1HE LYS 56 -30.615 0.294 -17.147 451 HE3 LYS 56 2HE LYS 56 -29.649 1.514 -17.977 452 HZ1 LYS 56 3HZ LYS 56 -28.406 -0.054 -18.905 453 HZ2 LYS 56 1HZ LYS 56 -29.508 -1.201 -18.329 454 HZ3 LYS 56 2HZ LYS 56 -28.126 -0.828 -17.427 455 H GLN 57 H GLN 57 -28.841 2.844 -13.093 456 HA GLN 57 HA GLN 57 -26.889 4.190 -11.587 457 HB2 GLN 57 1HB GLN 57 -27.136 2.360 -9.970 458 HB3 GLN 57 2HB GLN 57 -28.699 2.928 -10.543 459 HG2 GLN 57 1HG GLN 57 -28.694 1.017 -12.162 460 HG3 GLN 57 2HG GLN 57 -27.261 0.411 -11.333 461 HE21 GLN 57 2HE2 GLN 57 -27.454 -0.479 -9.306 462 HE22 GLN 57 1HE2 GLN 57 -28.978 -0.872 -8.594 463 H LEU 58 H LEU 58 -24.753 3.882 -11.286 464 HA LEU 58 HA LEU 58 -23.410 2.021 -13.077 465 HB2 LEU 58 1HB LEU 58 -22.242 4.097 -11.231 466 HB3 LEU 58 2HB LEU 58 -21.379 3.206 -12.482 467 HG LEU 58 HG LEU 58 -23.533 5.274 -12.911 468 HD11 LEU 58 1HD1 LEU 58 -20.805 5.544 -14.015 469 HD12 LEU 58 2HD1 LEU 58 -20.987 5.772 -12.276 470 HD13 LEU 58 3HD1 LEU 58 -21.910 6.772 -13.397 471 HD21 LEU 58 3HD2 LEU 58 -22.683 3.122 -14.579 472 HD22 LEU 58 1HD2 LEU 58 -22.153 4.646 -15.293 473 HD23 LEU 58 2HD2 LEU 58 -23.858 4.393 -14.920 474 H GLU 59 H GLU 59 -21.904 0.472 -12.400 475 HA GLU 59 HA GLU 59 -21.736 -0.094 -9.537 476 HB2 GLU 59 1HB GLU 59 -22.135 -2.558 -10.101 477 HB3 GLU 59 2HB GLU 59 -23.540 -1.503 -10.066 478 HG2 GLU 59 1HG GLU 59 -23.564 -1.374 -12.469 479 HG3 GLU 59 2HG GLU 59 -22.069 -2.303 -12.566 480 H ASP 60 H ASP 60 -20.007 -1.553 -8.976 481 HA ASP 60 HA ASP 60 -17.612 -1.025 -10.311 482 HB2 ASP 60 1HB ASP 60 -16.572 -2.377 -8.721 483 HB3 ASP 60 2HB ASP 60 -18.039 -1.867 -7.890 484 H GLY 61 H GLY 61 -16.127 -3.126 -10.805 485 HA2 GLY 61 1HA GLY 61 -15.984 -5.189 -11.993 486 HA3 GLY 61 2HA GLY 61 -17.615 -4.922 -12.591 487 H ARG 62 H ARG 62 -17.640 -2.583 -13.782 488 HA ARG 62 HA ARG 62 -15.707 -2.915 -15.953 489 HB2 ARG 62 1HB ARG 62 -18.416 -1.668 -15.725 490 HB3 ARG 62 2HB ARG 62 -17.331 -1.127 -16.998 491 HG2 ARG 62 1HG ARG 62 -18.670 -2.789 -17.968 492 HG3 ARG 62 2HG ARG 62 -17.113 -3.559 -17.660 493 HD2 ARG 62 1HD ARG 62 -17.939 -4.768 -15.839 494 HD3 ARG 62 2HD ARG 62 -19.347 -3.721 -15.668 495 HE ARG 62 HE ARG 62 -19.071 -5.987 -17.417 496 HH11 ARG 62 1HH1 ARG 62 -20.748 -2.990 -16.849 497 HH12 ARG 62 2HH1 ARG 62 -22.142 -3.444 -17.774 498 HH21 ARG 62 1HH2 ARG 62 -20.899 -6.596 -18.637 499 HH22 ARG 62 2HH2 ARG 62 -22.227 -5.495 -18.790 500 H THR 63 H THR 63 -14.994 -0.838 -17.039 501 HA THR 63 HA THR 63 -14.036 0.997 -14.959 502 HB THR 63 HB THR 63 -12.247 0.008 -16.227 503 HG1 THR 63 HG1 THR 63 -12.335 2.512 -17.459 504 HG21 THR 63 3HG2 THR 63 -14.055 0.474 -18.467 505 HG22 THR 63 1HG2 THR 63 -12.734 -0.682 -18.304 506 HG23 THR 63 2HG2 THR 63 -12.399 0.977 -18.803 507 H LEU 64 H LEU 64 -13.807 3.302 -15.574 508 HA LEU 64 HA LEU 64 -16.221 4.474 -16.215 509 HB2 LEU 64 1HB LEU 64 -13.404 5.495 -16.325 510 HB3 LEU 64 2HB LEU 64 -14.767 6.523 -16.764 511 HG LEU 64 HG LEU 64 -14.457 5.191 -14.076 512 HD11 LEU 64 1HD1 LEU 64 -12.654 6.708 -14.229 513 HD12 LEU 64 2HD1 LEU 64 -13.918 7.542 -13.327 514 HD13 LEU 64 3HD1 LEU 64 -13.648 7.927 -15.027 515 HD21 LEU 64 3HD2 LEU 64 -16.053 7.347 -13.732 516 HD22 LEU 64 1HD2 LEU 64 -16.644 5.713 -14.035 517 HD23 LEU 64 2HD2 LEU 64 -16.505 6.861 -15.367 518 H SER 65 H SER 65 -13.460 3.824 -18.340 519 HA SER 65 HA SER 65 -14.437 5.065 -20.646 520 HB2 SER 65 1HB SER 65 -12.133 4.361 -20.538 521 HB3 SER 65 2HB SER 65 -12.608 2.675 -20.333 522 HG SER 65 HG SER 65 -11.991 3.608 -22.548 523 H GLU 66 H GLU 66 -15.104 1.916 -19.264 524 HA GLU 66 HA GLU 66 -16.473 0.895 -21.559 525 HB2 GLU 66 1HB GLU 66 -16.089 0.013 -18.733 526 HB3 GLU 66 2HB GLU 66 -17.391 -0.712 -19.666 527 HG2 GLU 66 1HG GLU 66 -14.560 -0.624 -20.656 528 HG3 GLU 66 2HG GLU 66 -15.174 -1.931 -19.645 529 H TYR 67 H TYR 67 -17.333 2.868 -18.854 530 HA TYR 67 HA TYR 67 -20.189 2.471 -19.270 531 HB2 TYR 67 1HB TYR 67 -18.526 3.866 -17.209 532 HB3 TYR 67 2HB TYR 67 -20.214 4.325 -17.403 533 HD1 TYR 67 HD1 TYR 67 -21.657 1.913 -17.818 534 HD2 TYR 67 HD2 TYR 67 -18.260 2.551 -15.336 535 HE1 TYR 67 HE1 TYR 67 -22.337 0.015 -16.409 536 HE2 TYR 67 HE2 TYR 67 -18.931 0.655 -13.921 537 HH TYR 67 HH TYR 67 -21.033 -1.649 -14.807 538 H ASN 68 H ASN 68 -18.114 3.961 -21.063 539 HA ASN 68 HA ASN 68 -18.184 5.681 -22.550 540 HB2 ASN 68 1HB ASN 68 -21.031 6.150 -21.657 541 HB3 ASN 68 2HB ASN 68 -20.306 6.566 -23.207 542 HD21 ASN 68 2HD2 ASN 68 -19.294 4.571 -24.320 543 HD22 ASN 68 1HD2 ASN 68 -20.305 3.172 -24.372 544 H ILE 69 H ILE 69 -17.640 6.062 -19.603 545 HA ILE 69 HA ILE 69 -18.363 8.863 -19.225 546 HB ILE 69 HB ILE 69 -16.885 6.966 -17.397 547 HG12 ILE 69 1HG1 ILE 69 -19.601 8.078 -16.834 548 HG13 ILE 69 2HG1 ILE 69 -19.459 6.744 -17.973 549 HG21 ILE 69 1HG2 ILE 69 -17.969 9.153 -15.986 550 HG22 ILE 69 2HG2 ILE 69 -16.271 8.746 -16.226 551 HG23 ILE 69 3HG2 ILE 69 -17.091 9.812 -17.366 552 HD11 ILE 69 3HD1 ILE 69 -18.097 5.605 -16.098 553 HD12 ILE 69 1HD1 ILE 69 -18.858 6.803 -15.052 554 HD13 ILE 69 2HD1 ILE 69 -19.855 5.675 -15.971 555 H GLN 70 H GLN 70 -17.102 10.325 -20.165 556 HA GLN 70 HA GLN 70 -14.204 9.818 -20.284 557 HB2 GLN 70 1HB GLN 70 -15.767 11.764 -21.981 558 HB3 GLN 70 2HB GLN 70 -14.101 11.251 -22.206 559 HG2 GLN 70 1HG GLN 70 -14.798 9.045 -22.821 560 HG3 GLN 70 2HG GLN 70 -16.473 9.415 -22.417 561 HE21 GLN 70 2HE2 GLN 70 -17.595 10.954 -23.729 562 HE22 GLN 70 1HE2 GLN 70 -17.137 11.186 -25.378 563 H LYS 71 H LYS 71 -13.286 12.341 -20.791 564 HA LYS 71 HA LYS 71 -13.237 13.483 -18.196 565 HB2 LYS 71 1HB LYS 71 -11.766 15.137 -19.126 566 HB3 LYS 71 2HB LYS 71 -11.360 13.583 -19.842 567 HG2 LYS 71 1HG LYS 71 -13.018 14.391 -21.719 568 HG3 LYS 71 2HG LYS 71 -12.596 15.983 -21.083 569 HD2 LYS 71 1HD LYS 71 -10.452 13.998 -21.736 570 HD3 LYS 71 2HD LYS 71 -11.190 14.965 -23.015 571 HE2 LYS 71 1HE LYS 71 -10.649 16.997 -21.616 572 HE3 LYS 71 2HE LYS 71 -9.686 15.932 -20.592 573 HZ1 LYS 71 3HZ LYS 71 -8.530 17.184 -22.486 574 HZ2 LYS 71 1HZ LYS 71 -9.233 16.031 -23.505 575 HZ3 LYS 71 2HZ LYS 71 -8.173 15.543 -22.282 576 H GLU 72 H GLU 72 -15.461 13.743 -20.701 577 HA GLU 72 HA GLU 72 -16.503 16.267 -19.591 578 HB2 GLU 72 1HB GLU 72 -16.517 15.249 -22.426 579 HB3 GLU 72 2HB GLU 72 -17.616 16.509 -21.883 580 HG2 GLU 72 1HG GLU 72 -15.675 17.874 -21.218 581 HG3 GLU 72 2HG GLU 72 -14.610 16.627 -21.863 582 H SER 73 H SER 73 -17.029 13.521 -18.727 583 HA SER 73 HA SER 73 -19.747 12.994 -19.621 584 HB2 SER 73 1HB SER 73 -19.256 10.873 -19.096 585 HB3 SER 73 2HB SER 73 -17.640 11.399 -18.627 586 HG SER 73 HG SER 73 -18.252 11.490 -16.548 587 H THR 74 H THR 74 -21.534 12.860 -18.184 588 HA THR 74 HA THR 74 -21.311 14.724 -15.925 589 HB THR 74 HB THR 74 -23.990 13.825 -16.816 590 HG1 THR 74 HG1 THR 74 -23.938 14.952 -18.702 591 HG21 THR 74 3HG2 THR 74 -24.102 15.480 -15.206 592 HG22 THR 74 1HG2 THR 74 -24.221 16.428 -16.688 593 HG23 THR 74 2HG2 THR 74 -22.685 16.327 -15.827 594 H LEU 75 H LEU 75 -21.099 13.806 -13.997 595 HA LEU 75 HA LEU 75 -22.295 11.167 -13.529 596 HB2 LEU 75 1HB LEU 75 -19.909 12.569 -12.547 597 HB3 LEU 75 2HB LEU 75 -20.799 11.675 -11.316 598 HG LEU 75 HG LEU 75 -19.009 10.315 -12.194 599 HD11 LEU 75 1HD1 LEU 75 -20.387 8.616 -11.845 600 HD12 LEU 75 2HD1 LEU 75 -20.895 8.718 -13.530 601 HD13 LEU 75 3HD1 LEU 75 -21.779 9.604 -12.288 602 HD21 LEU 75 3HD2 LEU 75 -18.434 10.187 -14.350 603 HD22 LEU 75 1HD2 LEU 75 -19.485 11.585 -14.580 604 HD23 LEU 75 2HD2 LEU 75 -20.103 9.959 -14.874 605 H HIS 76 H HIS 76 -23.490 10.757 -11.618 606 HA HIS 76 HA HIS 76 -24.471 13.128 -10.191 607 HB2 HIS 76 1HB HIS 76 -26.136 10.991 -11.516 608 HB3 HIS 76 2HB HIS 76 -26.773 12.028 -10.244 609 HD1 HIS 76 HD1 HIS 76 -27.110 14.544 -10.826 610 HD2 HIS 76 HD2 HIS 76 -25.862 12.187 -14.012 611 HE1 HIS 76 HE1 HIS 76 -27.482 15.942 -12.883 612 H LEU 77 H LEU 77 -24.273 12.884 -8.071 613 HA LEU 77 HA LEU 77 -23.936 10.184 -6.984 614 HB2 LEU 77 1HB LEU 77 -23.117 11.408 -4.956 615 HB3 LEU 77 2HB LEU 77 -22.139 11.605 -6.409 616 HG LEU 77 HG LEU 77 -24.143 13.706 -6.036 617 HD11 LEU 77 1HD1 LEU 77 -22.156 14.562 -4.310 618 HD12 LEU 77 2HD1 LEU 77 -22.493 12.909 -3.795 619 HD13 LEU 77 3HD1 LEU 77 -23.799 14.092 -3.874 620 HD21 LEU 77 3HD2 LEU 77 -22.376 13.765 -7.733 621 HD22 LEU 77 1HD2 LEU 77 -21.156 13.741 -6.459 622 HD23 LEU 77 2HD2 LEU 77 -22.247 15.119 -6.610 623 H VAL 78 H VAL 78 -25.675 9.254 -6.148 624 HA VAL 78 HA VAL 78 -27.701 10.956 -4.849 625 HB VAL 78 HB VAL 78 -29.249 8.976 -5.260 626 HG11 VAL 78 1HG1 VAL 78 -29.151 9.619 -7.892 627 HG12 VAL 78 2HG1 VAL 78 -29.894 10.626 -6.647 628 HG13 VAL 78 3HG1 VAL 78 -28.246 10.957 -7.184 629 HG21 VAL 78 3HG2 VAL 78 -28.607 7.187 -6.461 630 HG22 VAL 78 1HG2 VAL 78 -27.632 8.156 -7.568 631 HG23 VAL 78 2HG2 VAL 78 -26.977 7.681 -6.001 632 H LEU 79 H LEU 79 -28.187 10.600 -2.767 633 HA LEU 79 HA LEU 79 -26.912 8.297 -1.450 634 HB2 LEU 79 1HB LEU 79 -27.558 11.067 -0.501 635 HB3 LEU 79 2HB LEU 79 -27.280 9.752 0.640 636 HG LEU 79 HG LEU 79 -25.021 9.447 -0.449 637 HD11 LEU 79 1HD1 LEU 79 -26.023 11.807 -1.939 638 HD12 LEU 79 2HD1 LEU 79 -24.981 10.488 -2.470 639 HD13 LEU 79 3HD1 LEU 79 -24.322 11.786 -1.475 640 HD21 LEU 79 3HD2 LEU 79 -25.917 11.672 1.264 641 HD22 LEU 79 1HD2 LEU 79 -24.305 11.836 0.566 642 HD23 LEU 79 2HD2 LEU 79 -24.698 10.430 1.555 643 H ARG 80 H ARG 80 -28.096 6.940 -0.188 644 HA ARG 80 HA ARG 80 -30.982 7.114 -0.453 645 HB2 ARG 80 1HB ARG 80 -29.054 4.991 0.405 646 HB3 ARG 80 2HB ARG 80 -30.747 4.853 0.859 647 HG2 ARG 80 1HG ARG 80 -29.866 5.259 -1.982 648 HG3 ARG 80 2HG ARG 80 -30.037 3.661 -1.251 649 HD2 ARG 80 1HD ARG 80 -32.397 4.300 -0.664 650 HD3 ARG 80 2HD ARG 80 -32.176 5.743 -1.653 651 HE ARG 80 HE ARG 80 -31.480 3.635 -3.270 652 HH11 ARG 80 1HH1 ARG 80 -34.308 4.606 -1.486 653 HH12 ARG 80 2HH1 ARG 80 -35.418 3.858 -2.586 654 HH21 ARG 80 1HH2 ARG 80 -32.932 2.646 -4.725 655 HH22 ARG 80 2HH2 ARG 80 -34.635 2.743 -4.427 656 H LEU 81 H LEU 81 -28.562 6.989 2.136 657 HA LEU 81 HA LEU 81 -30.600 7.415 4.162 658 HB2 LEU 81 1HB LEU 81 -27.619 7.036 4.277 659 HB3 LEU 81 2HB LEU 81 -28.586 7.422 5.699 660 HG LEU 81 HG LEU 81 -29.925 5.283 5.001 661 HD11 LEU 81 1HD1 LEU 81 -27.241 4.785 3.724 662 HD12 LEU 81 2HD1 LEU 81 -28.781 4.940 2.879 663 HD13 LEU 81 3HD1 LEU 81 -28.507 3.582 3.971 664 HD21 LEU 81 3HD2 LEU 81 -28.420 3.931 6.398 665 HD22 LEU 81 1HD2 LEU 81 -28.714 5.528 7.088 666 HD23 LEU 81 2HD2 LEU 81 -27.189 5.188 6.269 667 H ARG 82 H ARG 82 -29.628 9.047 5.977 668 HA ARG 82 HA ARG 82 -29.127 11.586 4.567 669 HB2 ARG 82 1HB ARG 82 -31.440 11.253 5.607 670 HB3 ARG 82 2HB ARG 82 -30.631 11.348 7.166 671 HG2 ARG 82 1HG ARG 82 -29.970 13.584 6.796 672 HG3 ARG 82 2HG ARG 82 -30.400 13.502 5.087 673 HD2 ARG 82 1HD ARG 82 -32.391 13.198 7.327 674 HD3 ARG 82 2HD ARG 82 -32.028 14.738 6.548 675 HE ARG 82 HE ARG 82 -32.694 12.844 4.583 676 HH11 ARG 82 1HH1 ARG 82 -34.157 14.666 7.164 677 HH12 ARG 82 2HH1 ARG 82 -35.724 14.702 6.426 678 HH21 ARG 82 1HH2 ARG 82 -34.753 12.884 3.601 679 HH22 ARG 82 2HH2 ARG 82 -36.062 13.687 4.400 680 H GLY 83 H GLY 83 -27.216 9.677 5.758 681 HA2 GLY 83 1HA GLY 83 -26.278 10.849 8.211 682 HA3 GLY 83 2HA GLY 83 -25.460 9.615 7.263 683 H TYR 84 H TYR 84 -25.260 12.729 8.329 684 HA TYR 84 HA TYR 84 -23.405 13.448 6.156 685 HB2 TYR 84 1HB TYR 84 -25.655 14.792 6.498 686 HB3 TYR 84 2HB TYR 84 -24.737 15.575 7.779 687 HD1 TYR 84 HD1 TYR 84 -24.208 14.569 4.211 688 HD2 TYR 84 HD2 TYR 84 -23.693 17.544 7.209 689 HE1 TYR 84 HE1 TYR 84 -23.170 16.055 2.549 690 HE2 TYR 84 HE2 TYR 84 -22.654 19.038 5.555 691 HH TYR 84 HH TYR 84 -22.727 18.386 2.186 692 H ALA 85 H ALA 85 -21.706 15.009 6.846 693 HA ALA 85 HA ALA 85 -19.912 15.527 8.148 694 HB1 ALA 85 1HB ALA 85 -21.406 15.160 10.677 695 HB2 ALA 85 2HB ALA 85 -20.378 16.492 10.147 696 HB3 ALA 85 3HB ALA 85 -22.029 16.357 9.541 697 H ASP 86 H ASP 86 -20.069 12.878 7.362 698 HA ASP 86 HA ASP 86 -18.872 11.511 9.680 699 HB2 ASP 86 1HB ASP 86 -19.756 9.371 8.743 700 HB3 ASP 86 2HB ASP 86 -21.016 10.476 9.286 701 H LEU 87 H LEU 87 -16.920 10.613 9.358 702 HA LEU 87 HA LEU 87 -15.932 10.412 6.591 703 HB2 LEU 87 1HB LEU 87 -14.178 11.168 8.904 704 HB3 LEU 87 2HB LEU 87 -13.846 11.315 7.180 705 HG LEU 87 HG LEU 87 -15.854 12.977 8.700 706 HD11 LEU 87 1HD1 LEU 87 -14.130 14.184 9.397 707 HD12 LEU 87 2HD1 LEU 87 -13.776 14.567 7.713 708 HD13 LEU 87 3HD1 LEU 87 -12.997 13.187 8.486 709 HD21 LEU 87 3HD2 LEU 87 -16.249 14.141 6.746 710 HD22 LEU 87 1HD2 LEU 87 -16.099 12.484 6.159 711 HD23 LEU 87 2HD2 LEU 87 -14.745 13.603 5.996 712 H ARG 88 H ARG 88 -14.814 8.600 6.076 713 HA ARG 88 HA ARG 88 -14.920 6.403 7.929 714 HB2 ARG 88 1HB ARG 88 -15.405 6.015 5.579 715 HB3 ARG 88 2HB ARG 88 -13.811 6.602 5.125 716 HG2 ARG 88 1HG ARG 88 -12.742 4.715 6.035 717 HG3 ARG 88 2HG ARG 88 -14.192 4.220 6.909 718 HD2 ARG 88 1HD ARG 88 -14.201 4.412 3.921 719 HD3 ARG 88 2HD ARG 88 -13.544 2.987 4.724 720 HE ARG 88 HE ARG 88 -16.160 3.688 5.656 721 HH11 ARG 88 1HH1 ARG 88 -14.386 2.019 3.168 722 HH12 ARG 88 2HH1 ARG 88 -15.688 0.944 2.780 723 HH21 ARG 88 1HH2 ARG 88 -17.881 2.278 5.154 724 HH22 ARG 88 2HH2 ARG 88 -17.675 1.092 3.909 725 H GLU 89 H GLU 89 -12.386 8.358 6.421 726 HA GLU 89 HA GLU 89 -10.439 7.118 8.253 727 HB2 GLU 89 1HB GLU 89 -8.727 8.001 6.580 728 HB3 GLU 89 2HB GLU 89 -9.707 6.635 6.068 729 HG2 GLU 89 1HG GLU 89 -10.566 9.412 5.397 730 HG3 GLU 89 2HG GLU 89 -9.301 8.625 4.454 731 H ASP 90 H ASP 90 -8.445 8.769 8.427 732 HA ASP 90 HA ASP 90 -9.599 11.358 9.237 733 HB2 ASP 90 1HB ASP 90 -7.510 11.270 10.859 734 HB3 ASP 90 2HB ASP 90 -9.026 10.482 11.285 735 HA PRO 91 HA PRO 91 -6.652 13.471 6.773 736 HB2 PRO 91 1HB PRO 91 -6.003 15.598 8.332 737 HB3 PRO 91 2HB PRO 91 -7.570 15.437 7.529 738 HG2 PRO 91 1HG PRO 91 -6.827 14.845 10.368 739 HG3 PRO 91 2HG PRO 91 -8.267 15.665 9.736 740 HD2 PRO 91 1HD PRO 91 -8.289 13.070 10.509 741 HD3 PRO 91 2HD PRO 91 -9.311 13.683 9.193 742 H ASP 92 H ASP 92 -4.430 14.796 7.166 743 HA ASP 92 HA ASP 92 -2.195 14.628 7.554 744 HB2 ASP 92 1HB ASP 92 -2.718 12.994 10.014 745 HB3 ASP 92 2HB ASP 92 -1.486 14.222 9.736 746 H ARG 93 H ARG 93 -1.769 13.306 5.782 747 HA ARG 93 HA ARG 93 -1.073 10.550 6.486 748 HB2 ARG 93 1HB ARG 93 -2.543 11.272 3.946 749 HB3 ARG 93 2HB ARG 93 -2.045 9.663 4.453 750 HG2 ARG 93 1HG ARG 93 -4.193 9.541 5.120 751 HG3 ARG 93 2HG ARG 93 -3.548 10.330 6.561 752 HD2 ARG 93 1HD ARG 93 -5.574 11.443 5.795 753 HD3 ARG 93 2HD ARG 93 -4.177 12.509 5.650 754 HE ARG 93 HE ARG 93 -4.785 11.053 3.246 755 HH11 ARG 93 1HH1 ARG 93 -5.454 13.914 5.114 756 HH12 ARG 93 2HH1 ARG 93 -5.989 14.838 3.749 757 HH21 ARG 93 1HH2 ARG 93 -5.487 12.260 1.441 758 HH22 ARG 93 2HH2 ARG 93 -6.008 13.896 1.661 759 H GLN 94 H GLN 94 0.783 9.818 5.565 760 HA GLN 94 HA GLN 94 2.385 11.779 4.142 761 HB2 GLN 94 1HB GLN 94 4.252 10.302 4.553 762 HB3 GLN 94 2HB GLN 94 3.333 10.495 6.040 763 HG2 GLN 94 1HG GLN 94 3.651 8.253 6.090 764 HG3 GLN 94 2HG GLN 94 2.144 8.306 5.176 765 HE21 GLN 94 2HE2 GLN 94 5.557 8.817 4.349 766 HE22 GLN 94 1HE2 GLN 94 5.588 7.683 3.046 767 H ASP 95 H ASP 95 3.618 11.185 2.226 768 HA ASP 95 HA ASP 95 2.840 8.910 0.670 769 HB2 ASP 95 1HB ASP 95 0.885 10.399 0.329 770 HB3 ASP 95 2HB ASP 95 1.966 11.637 -0.304 771 H HIS 96 H HIS 96 3.978 8.807 -1.393 772 HA HIS 96 HA HIS 96 6.547 10.194 -1.218 773 HB2 HIS 96 1HB HIS 96 5.632 7.743 -2.719 774 HB3 HIS 96 2HB HIS 96 7.196 8.497 -3.011 775 HD1 HIS 96 HD1 HIS 96 8.980 7.298 -1.814 776 HD2 HIS 96 HD2 HIS 96 5.424 7.292 0.335 777 HE1 HIS 96 HE1 HIS 96 9.477 6.040 0.306 778 H HIS 97 H HIS 97 7.086 11.793 -2.549 779 HA HIS 97 HA HIS 97 5.695 12.037 -5.124 780 HB2 HIS 97 1HB HIS 97 4.634 13.569 -3.488 781 HB3 HIS 97 2HB HIS 97 6.196 14.337 -3.223 782 HD1 HIS 97 HD1 HIS 97 4.618 16.452 -4.044 783 HD2 HIS 97 HD2 HIS 97 5.824 13.704 -6.918 784 HE1 HIS 97 HE1 HIS 97 4.336 17.621 -6.252 785 HA PRO 98 HA PRO 98 10.319 12.379 -5.519 786 HB2 PRO 98 1HB PRO 98 10.514 10.622 -7.579 787 HB3 PRO 98 2HB PRO 98 10.545 10.122 -5.883 788 HG2 PRO 98 1HG PRO 98 8.272 10.076 -7.831 789 HG3 PRO 98 2HG PRO 98 8.759 8.846 -6.650 790 HD2 PRO 98 1HD PRO 98 6.711 10.561 -6.207 791 HD3 PRO 98 2HD PRO 98 7.739 9.944 -4.898 792 H GLY 99 H GLY 99 11.561 13.000 -7.490 793 HA2 GLY 99 1HA GLY 99 9.938 14.815 -9.108 794 HA3 GLY 99 2HA GLY 99 11.689 14.842 -8.956 795 H SER 100 H SER 100 11.283 15.140 -11.376 796 HA SER 100 HA SER 100 11.257 12.483 -12.653 797 HB2 SER 100 1HB SER 100 9.288 14.076 -13.152 798 HB3 SER 100 2HB SER 100 10.458 15.011 -14.084 799 HG SER 100 HG SER 100 9.507 13.564 -15.471 800 H GLY 101 H GLY 101 12.219 12.871 -15.053 801 HA2 GLY 101 1HA GLY 101 14.541 14.623 -14.993 802 HA3 GLY 101 2HA GLY 101 14.888 12.900 -14.985 803 H ALA 102 H ALA 102 16.005 13.887 -17.018 804 HA ALA 102 HA ALA 102 14.507 12.950 -19.277 805 HB1 ALA 102 1HB ALA 102 14.113 15.597 -18.699 806 HB2 ALA 102 2HB ALA 102 15.416 15.655 -19.887 807 HB3 ALA 102 3HB ALA 102 13.897 14.851 -20.282 808 H GLN 103 H GLN 103 15.845 13.368 -21.361 809 HA GLN 103 HA GLN 103 18.654 13.776 -21.056 810 HB2 GLN 103 1HB GLN 103 18.219 11.430 -20.122 811 HB3 GLN 103 2HB GLN 103 17.859 10.963 -21.779 812 HG2 GLN 103 1HG GLN 103 20.032 11.188 -22.465 813 HG3 GLN 103 2HG GLN 103 20.423 12.356 -21.204 814 HE21 GLN 103 2HE2 GLN 103 22.265 11.212 -20.610 815 HE22 GLN 103 1HE2 GLN 103 22.180 9.728 -19.729 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -5.705 12.498 -4.207 2 HA2 GLY 1 1HA GLY 1 -5.950 13.737 -1.587 3 HA3 GLY 1 2HA GLY 1 -5.365 12.114 -1.925 4 H SER 2 H SER 2 -3.325 11.857 -1.347 5 HA SER 2 HA SER 2 -1.522 14.174 -1.451 6 HB2 SER 2 1HB SER 2 -1.256 11.570 0.072 7 HB3 SER 2 2HB SER 2 -0.101 12.901 0.122 8 HG SER 2 HG SER 2 -1.344 13.383 1.795 9 H LEU 3 H LEU 3 -1.947 10.880 -2.558 10 HA LEU 3 HA LEU 3 0.532 11.112 -4.131 11 HB2 LEU 3 1HB LEU 3 0.019 9.170 -2.421 12 HB3 LEU 3 2HB LEU 3 -0.887 8.518 -3.785 13 HG LEU 3 HG LEU 3 1.356 7.558 -3.639 14 HD11 LEU 3 1HD1 LEU 3 1.830 7.656 -5.904 15 HD12 LEU 3 2HD1 LEU 3 1.370 9.353 -6.032 16 HD13 LEU 3 3HD1 LEU 3 0.128 8.115 -5.844 17 HD21 LEU 3 3HD2 LEU 3 3.302 8.762 -3.608 18 HD22 LEU 3 1HD2 LEU 3 2.247 9.852 -2.708 19 HD23 LEU 3 2HD2 LEU 3 2.583 10.158 -4.412 20 H VAL 4 H VAL 4 0.414 11.169 -6.288 21 HA VAL 4 HA VAL 4 -2.164 10.498 -7.554 22 HB VAL 4 HB VAL 4 -1.862 12.911 -7.578 23 HG11 VAL 4 1HG1 VAL 4 0.833 12.330 -7.837 24 HG12 VAL 4 2HG1 VAL 4 0.392 13.030 -9.396 25 HG13 VAL 4 3HG1 VAL 4 0.093 13.928 -7.908 26 HG21 VAL 4 3HG2 VAL 4 -1.931 13.275 -10.041 27 HG22 VAL 4 1HG2 VAL 4 -1.443 11.594 -10.257 28 HG23 VAL 4 2HG2 VAL 4 -2.982 11.974 -9.483 29 HA PRO 5 HA PRO 5 0.235 7.644 -9.936 30 HB2 PRO 5 1HB PRO 5 -1.650 7.085 -11.808 31 HB3 PRO 5 2HB PRO 5 -1.714 6.448 -10.161 32 HG2 PRO 5 1HG PRO 5 -3.165 8.783 -11.346 33 HG3 PRO 5 2HG PRO 5 -3.775 7.520 -10.261 34 HD2 PRO 5 1HD PRO 5 -3.083 9.986 -9.383 35 HD3 PRO 5 2HD PRO 5 -2.894 8.529 -8.386 36 H ARG 6 H ARG 6 0.289 7.247 -12.541 37 HA ARG 6 HA ARG 6 1.564 9.609 -13.563 38 HB2 ARG 6 1HB ARG 6 1.021 6.961 -14.921 39 HB3 ARG 6 2HB ARG 6 2.103 8.218 -15.508 40 HG2 ARG 6 1HG ARG 6 2.441 6.699 -12.930 41 HG3 ARG 6 2HG ARG 6 3.304 6.372 -14.435 42 HD2 ARG 6 1HD ARG 6 4.361 8.527 -14.361 43 HD3 ARG 6 2HD ARG 6 3.383 9.007 -12.975 44 HE ARG 6 HE ARG 6 5.745 7.358 -12.949 45 HH11 ARG 6 1HH1 ARG 6 2.840 8.260 -11.255 46 HH12 ARG 6 2HH1 ARG 6 3.443 7.786 -9.702 47 HH21 ARG 6 1HH2 ARG 6 6.550 6.730 -10.909 48 HH22 ARG 6 2HH2 ARG 6 5.553 6.916 -9.506 49 H GLY 7 H GLY 7 -0.855 7.514 -15.141 50 HA2 GLY 7 1HA GLY 7 -1.846 9.824 -16.617 51 HA3 GLY 7 2HA GLY 7 -2.279 8.144 -16.896 52 H SER 8 H SER 8 -4.133 10.263 -16.811 53 HA SER 8 HA SER 8 -6.088 9.198 -15.106 54 HB2 SER 8 1HB SER 8 -6.230 11.465 -13.721 55 HB3 SER 8 2HB SER 8 -5.243 10.112 -13.171 56 HG SER 8 HG SER 8 -3.611 11.410 -13.300 57 H MET 9 H MET 9 -8.058 10.665 -14.988 58 HA MET 9 HA MET 9 -8.153 12.600 -17.183 59 HB2 MET 9 1HB MET 9 -8.896 10.595 -18.252 60 HB3 MET 9 2HB MET 9 -9.939 10.185 -16.896 61 HG2 MET 9 1HG MET 9 -11.440 11.955 -17.414 62 HG3 MET 9 2HG MET 9 -10.331 12.622 -18.610 63 HE1 MET 9 3HE MET 9 -12.789 8.764 -19.033 64 HE2 MET 9 1HE MET 9 -11.943 9.299 -17.580 65 HE3 MET 9 2HE MET 9 -13.384 10.155 -18.127 66 H GLN 10 H GLN 10 -9.517 14.293 -16.845 67 HA GLN 10 HA GLN 10 -10.763 14.434 -14.206 68 HB2 GLN 10 1HB GLN 10 -9.177 16.220 -15.299 69 HB3 GLN 10 2HB GLN 10 -10.651 16.746 -16.102 70 HG2 GLN 10 1HG GLN 10 -11.720 17.082 -13.939 71 HG3 GLN 10 2HG GLN 10 -10.253 16.538 -13.126 72 HE21 GLN 10 2HE2 GLN 10 -10.809 18.715 -15.868 73 HE22 GLN 10 1HE2 GLN 10 -9.981 20.068 -15.184 74 H ILE 11 H ILE 11 -12.899 14.419 -13.897 75 HA ILE 11 HA ILE 11 -14.648 14.754 -16.245 76 HB ILE 11 HB ILE 11 -16.176 13.078 -15.294 77 HG12 ILE 11 1HG1 ILE 11 -13.966 12.361 -13.370 78 HG13 ILE 11 2HG1 ILE 11 -15.297 13.423 -12.921 79 HG21 ILE 11 1HG2 ILE 11 -14.176 12.586 -16.880 80 HG22 ILE 11 2HG2 ILE 11 -13.512 11.740 -15.483 81 HG23 ILE 11 3HG2 ILE 11 -15.065 11.246 -16.156 82 HD11 ILE 11 3HD1 ILE 11 -16.671 11.340 -13.918 83 HD12 ILE 11 1HD1 ILE 11 -15.241 10.511 -13.303 84 HD13 ILE 11 2HD1 ILE 11 -16.220 11.502 -12.221 85 H PHE 12 H PHE 12 -16.986 15.140 -15.535 86 HA PHE 12 HA PHE 12 -17.009 16.942 -13.203 87 HB2 PHE 12 1HB PHE 12 -18.367 17.263 -15.882 88 HB3 PHE 12 2HB PHE 12 -18.772 18.237 -14.472 89 HD1 PHE 12 HD2 PHE 12 -17.005 19.699 -13.459 90 HD2 PHE 12 HD1 PHE 12 -16.508 17.769 -17.220 91 HE1 PHE 12 HE2 PHE 12 -15.189 21.262 -14.017 92 HE2 PHE 12 HE1 PHE 12 -14.691 19.328 -17.784 93 HZ PHE 12 HZ PHE 12 -14.030 21.079 -16.182 94 H VAL 13 H VAL 13 -18.515 16.568 -11.701 95 HA VAL 13 HA VAL 13 -20.793 14.837 -12.400 96 HB VAL 13 HB VAL 13 -20.642 13.674 -10.314 97 HG11 VAL 13 1HG1 VAL 13 -18.789 13.431 -12.336 98 HG12 VAL 13 2HG1 VAL 13 -17.794 13.466 -10.878 99 HG13 VAL 13 3HG1 VAL 13 -19.073 12.263 -11.046 100 HG21 VAL 13 3HG2 VAL 13 -18.266 14.354 -9.101 101 HG22 VAL 13 1HG2 VAL 13 -18.928 15.914 -9.590 102 HG23 VAL 13 2HG2 VAL 13 -19.876 14.836 -8.564 103 H LYS 14 H LYS 14 -22.745 15.314 -11.445 104 HA LYS 14 HA LYS 14 -22.903 17.948 -10.182 105 HB2 LYS 14 1HB LYS 14 -24.729 16.278 -11.810 106 HB3 LYS 14 2HB LYS 14 -25.484 17.252 -10.555 107 HG2 LYS 14 1HG LYS 14 -25.561 18.728 -12.278 108 HG3 LYS 14 2HG LYS 14 -23.982 19.148 -11.610 109 HD2 LYS 14 1HD LYS 14 -22.984 17.514 -13.252 110 HD3 LYS 14 2HD LYS 14 -24.578 17.418 -14.004 111 HE2 LYS 14 1HE LYS 14 -23.179 20.040 -13.568 112 HE3 LYS 14 2HE LYS 14 -22.890 19.059 -15.004 113 HZ1 LYS 14 3HZ LYS 14 -24.568 20.589 -15.564 114 HZ2 LYS 14 1HZ LYS 14 -25.435 20.302 -14.140 115 HZ3 LYS 14 2HZ LYS 14 -25.364 19.113 -15.341 116 H THR 15 H THR 15 -23.458 18.236 -8.111 117 HA THR 15 HA THR 15 -23.795 15.899 -6.433 118 HB THR 15 HB THR 15 -23.744 17.527 -4.551 119 HG1 THR 15 HG1 THR 15 -23.002 19.551 -6.353 120 HG21 THR 15 3HG2 THR 15 -21.435 17.925 -4.662 121 HG22 THR 15 1HG2 THR 15 -21.460 18.110 -6.415 122 HG23 THR 15 2HG2 THR 15 -21.679 16.516 -5.693 123 H LEU 16 H LEU 16 -25.462 15.998 -4.653 124 HA LEU 16 HA LEU 16 -28.049 16.144 -5.807 125 HB2 LEU 16 1HB LEU 16 -28.863 15.546 -3.595 126 HB3 LEU 16 2HB LEU 16 -27.496 14.538 -4.068 127 HG LEU 16 HG LEU 16 -26.784 16.893 -2.463 128 HD11 LEU 16 1HD1 LEU 16 -28.771 14.902 -1.517 129 HD12 LEU 16 2HD1 LEU 16 -28.584 16.605 -1.101 130 HD13 LEU 16 3HD1 LEU 16 -27.502 15.402 -0.399 131 HD21 LEU 16 3HD2 LEU 16 -24.998 15.516 -2.632 132 HD22 LEU 16 1HD2 LEU 16 -25.990 14.070 -2.822 133 HD23 LEU 16 2HD2 LEU 16 -25.738 14.761 -1.219 134 H THR 17 H THR 17 -26.106 18.369 -3.998 135 HA THR 17 HA THR 17 -28.242 20.080 -3.168 136 HB THR 17 HB THR 17 -26.130 20.087 -1.949 137 HG1 THR 17 HG1 THR 17 -26.990 22.033 -1.643 138 HG21 THR 17 3HG2 THR 17 -24.141 21.197 -2.990 139 HG22 THR 17 1HG2 THR 17 -24.977 21.118 -4.540 140 HG23 THR 17 2HG2 THR 17 -24.548 19.632 -3.693 141 H GLY 18 H GLY 18 -26.277 19.778 -6.025 142 HA2 GLY 18 1HA GLY 18 -27.220 20.678 -8.089 143 HA3 GLY 18 2HA GLY 18 -27.706 22.095 -7.170 144 H LYS 19 H LYS 19 -24.595 20.692 -6.592 145 HA LYS 19 HA LYS 19 -23.353 22.964 -7.999 146 HB2 LYS 19 1HB LYS 19 -22.999 23.215 -5.650 147 HB3 LYS 19 2HB LYS 19 -22.536 21.528 -5.475 148 HG2 LYS 19 1HG LYS 19 -20.902 23.181 -7.305 149 HG3 LYS 19 2HG LYS 19 -20.765 23.511 -5.576 150 HD2 LYS 19 1HD LYS 19 -20.685 20.666 -6.350 151 HD3 LYS 19 2HD LYS 19 -19.311 21.643 -6.873 152 HE2 LYS 19 1HE LYS 19 -18.508 21.161 -4.827 153 HE3 LYS 19 2HE LYS 19 -19.568 22.471 -4.312 154 HZ1 LYS 19 3HZ LYS 19 -19.835 20.466 -2.960 155 HZ2 LYS 19 1HZ LYS 19 -20.307 19.595 -4.331 156 HZ3 LYS 19 2HZ LYS 19 -21.266 20.869 -3.767 157 H THR 20 H THR 20 -21.457 22.618 -9.172 158 HA THR 20 HA THR 20 -21.053 19.830 -9.992 159 HB THR 20 HB THR 20 -19.840 22.157 -11.439 160 HG1 THR 20 HG1 THR 20 -21.929 21.970 -12.716 161 HG21 THR 20 3HG2 THR 20 -19.186 19.979 -12.201 162 HG22 THR 20 1HG2 THR 20 -20.299 20.656 -13.389 163 HG23 THR 20 2HG2 THR 20 -20.863 19.435 -12.247 164 H ILE 21 H ILE 21 -19.370 18.781 -9.185 165 HA ILE 21 HA ILE 21 -17.011 20.333 -8.343 166 HB ILE 21 HB ILE 21 -18.018 19.224 -6.456 167 HG12 ILE 21 1HG1 ILE 21 -15.411 19.091 -7.060 168 HG13 ILE 21 2HG1 ILE 21 -16.074 18.405 -5.581 169 HG21 ILE 21 1HG2 ILE 21 -18.180 16.729 -6.409 170 HG22 ILE 21 2HG2 ILE 21 -19.301 17.516 -7.519 171 HG23 ILE 21 3HG2 ILE 21 -17.848 16.734 -8.141 172 HD11 ILE 21 3HD1 ILE 21 -15.917 16.238 -6.368 173 HD12 ILE 21 1HD1 ILE 21 -15.853 16.747 -8.055 174 HD13 ILE 21 2HD1 ILE 21 -14.459 16.999 -7.004 175 H THR 22 H THR 22 -15.062 19.870 -9.189 176 HA THR 22 HA THR 22 -14.946 18.050 -11.427 177 HB THR 22 HB THR 22 -12.561 19.503 -10.324 178 HG1 THR 22 HG1 THR 22 -13.397 21.368 -10.869 179 HG21 THR 22 3HG2 THR 22 -12.339 17.897 -12.222 180 HG22 THR 22 1HG2 THR 22 -11.854 19.544 -12.622 181 HG23 THR 22 2HG2 THR 22 -13.417 18.929 -13.161 182 H LEU 23 H LEU 23 -14.357 15.992 -11.307 183 HA LEU 23 HA LEU 23 -12.748 15.124 -8.996 184 HB2 LEU 23 1HB LEU 23 -15.216 14.288 -9.507 185 HB3 LEU 23 2HB LEU 23 -14.350 13.178 -10.568 186 HG LEU 23 HG LEU 23 -13.022 12.443 -8.577 187 HD11 LEU 23 1HD1 LEU 23 -14.973 14.255 -7.187 188 HD12 LEU 23 2HD1 LEU 23 -13.214 14.240 -7.073 189 HD13 LEU 23 3HD1 LEU 23 -14.154 12.930 -6.359 190 HD21 LEU 23 3HD2 LEU 23 -15.120 11.321 -7.490 191 HD22 LEU 23 1HD2 LEU 23 -14.646 10.917 -9.140 192 HD23 LEU 23 2HD2 LEU 23 -15.967 12.051 -8.855 193 H GLU 24 H GLU 24 -11.262 13.345 -9.368 194 HA GLU 24 HA GLU 24 -10.266 13.285 -12.141 195 HB2 GLU 24 1HB GLU 24 -8.766 13.314 -9.528 196 HB3 GLU 24 2HB GLU 24 -8.014 12.798 -11.031 197 HG2 GLU 24 1HG GLU 24 -7.402 15.013 -10.893 198 HG3 GLU 24 2HG GLU 24 -8.814 15.072 -11.947 199 H VAL 25 H VAL 25 -10.509 11.374 -13.070 200 HA VAL 25 HA VAL 25 -9.988 8.946 -11.523 201 HB VAL 25 HB VAL 25 -12.391 9.156 -11.395 202 HG11 VAL 25 1HG1 VAL 25 -13.758 9.159 -13.481 203 HG12 VAL 25 2HG1 VAL 25 -12.840 10.643 -13.218 204 HG13 VAL 25 3HG1 VAL 25 -12.277 9.452 -14.392 205 HG21 VAL 25 3HG2 VAL 25 -11.114 6.942 -12.138 206 HG22 VAL 25 1HG2 VAL 25 -12.867 7.000 -11.945 207 HG23 VAL 25 2HG2 VAL 25 -12.151 7.134 -13.552 208 H GLU 26 H GLU 26 -9.203 7.227 -12.722 209 HA GLU 26 HA GLU 26 -8.045 7.928 -15.265 210 HB2 GLU 26 1HB GLU 26 -7.969 5.206 -13.977 211 HB3 GLU 26 2HB GLU 26 -6.813 5.912 -15.098 212 HG2 GLU 26 1HG GLU 26 -6.221 7.573 -13.348 213 HG3 GLU 26 2HG GLU 26 -7.272 6.702 -12.233 214 HA PRO 27 HA PRO 27 -11.021 6.164 -17.966 215 HB2 PRO 27 1HB PRO 27 -9.432 5.270 -19.977 216 HB3 PRO 27 2HB PRO 27 -9.754 6.985 -19.698 217 HG2 PRO 27 1HG PRO 27 -7.374 5.352 -18.905 218 HG3 PRO 27 2HG PRO 27 -7.431 6.987 -19.590 219 HD2 PRO 27 1HD PRO 27 -7.068 6.526 -16.946 220 HD3 PRO 27 2HD PRO 27 -7.924 7.956 -17.558 221 H SER 28 H SER 28 -8.508 4.233 -16.611 222 HA SER 28 HA SER 28 -9.784 1.756 -17.534 223 HB2 SER 28 1HB SER 28 -7.614 0.859 -16.230 224 HB3 SER 28 2HB SER 28 -7.563 1.371 -17.916 225 HG SER 28 HG SER 28 -5.985 2.280 -16.257 226 H ASP 29 H ASP 29 -9.594 3.818 -14.859 227 HA ASP 29 HA ASP 29 -9.859 1.923 -12.759 228 HB2 ASP 29 1HB ASP 29 -10.339 4.874 -13.008 229 HB3 ASP 29 2HB ASP 29 -10.861 4.016 -11.561 230 H THR 30 H THR 30 -11.836 1.865 -11.333 231 HA THR 30 HA THR 30 -14.243 1.657 -13.020 232 HB THR 30 HB THR 30 -15.040 -0.107 -11.569 233 HG1 THR 30 HG1 THR 30 -14.016 -0.664 -9.723 234 HG21 THR 30 3HG2 THR 30 -12.159 -0.758 -12.143 235 HG22 THR 30 1HG2 THR 30 -13.357 -0.588 -13.424 236 HG23 THR 30 2HG2 THR 30 -13.556 -1.833 -12.191 237 H ILE 31 H ILE 31 -16.311 1.709 -11.613 238 HA ILE 31 HA ILE 31 -16.672 4.253 -10.601 239 HB ILE 31 HB ILE 31 -18.245 1.805 -9.792 240 HG12 ILE 31 1HG1 ILE 31 -18.142 1.968 -12.215 241 HG13 ILE 31 2HG1 ILE 31 -19.747 2.433 -11.664 242 HG21 ILE 31 1HG2 ILE 31 -19.979 3.920 -9.927 243 HG22 ILE 31 2HG2 ILE 31 -19.260 3.279 -8.451 244 HG23 ILE 31 3HG2 ILE 31 -18.524 4.662 -9.261 245 HD11 ILE 31 3HD1 ILE 31 -18.574 4.841 -11.725 246 HD12 ILE 31 1HD1 ILE 31 -17.663 4.026 -12.995 247 HD13 ILE 31 2HD1 ILE 31 -19.421 4.130 -13.099 248 H GLU 32 H GLU 32 -15.479 1.399 -9.003 249 HA GLU 32 HA GLU 32 -15.874 2.188 -6.331 250 HB2 GLU 32 1HB GLU 32 -13.660 0.457 -7.445 251 HB3 GLU 32 2HB GLU 32 -14.186 0.520 -5.769 252 HG2 GLU 32 1HG GLU 32 -15.695 -0.549 -8.134 253 HG3 GLU 32 2HG GLU 32 -15.114 -1.434 -6.725 254 H ASN 33 H ASN 33 -13.368 2.929 -8.667 255 HA ASN 33 HA ASN 33 -11.608 4.152 -6.759 256 HB2 ASN 33 1HB ASN 33 -11.463 3.354 -9.478 257 HB3 ASN 33 2HB ASN 33 -11.105 5.077 -9.424 258 HD21 ASN 33 2HD2 ASN 33 -9.249 5.786 -8.454 259 HD22 ASN 33 1HD2 ASN 33 -7.994 4.723 -7.926 260 H VAL 34 H VAL 34 -14.223 5.201 -8.809 261 HA VAL 34 HA VAL 34 -13.706 7.968 -8.807 262 HB VAL 34 HB VAL 34 -16.382 6.573 -8.958 263 HG11 VAL 34 1HG1 VAL 34 -15.593 9.333 -9.885 264 HG12 VAL 34 2HG1 VAL 34 -17.191 8.595 -10.007 265 HG13 VAL 34 3HG1 VAL 34 -16.515 8.981 -8.424 266 HG21 VAL 34 3HG2 VAL 34 -14.270 6.330 -10.699 267 HG22 VAL 34 1HG2 VAL 34 -15.967 6.054 -11.093 268 HG23 VAL 34 2HG2 VAL 34 -15.228 7.621 -11.423 269 H LYS 35 H LYS 35 -15.879 6.035 -6.747 270 HA LYS 35 HA LYS 35 -16.763 8.090 -5.094 271 HB2 LYS 35 1HB LYS 35 -17.112 6.229 -3.394 272 HB3 LYS 35 2HB LYS 35 -17.895 6.021 -4.955 273 HG2 LYS 35 1HG LYS 35 -16.257 4.439 -5.652 274 HG3 LYS 35 2HG LYS 35 -15.249 4.779 -4.243 275 HD2 LYS 35 1HD LYS 35 -17.380 4.048 -2.913 276 HD3 LYS 35 2HD LYS 35 -17.809 3.247 -4.426 277 HE2 LYS 35 1HE LYS 35 -16.661 1.617 -3.194 278 HE3 LYS 35 2HE LYS 35 -15.474 2.224 -4.348 279 HZ1 LYS 35 3HZ LYS 35 -14.199 3.029 -2.719 280 HZ2 LYS 35 1HZ LYS 35 -15.082 2.018 -1.690 281 HZ3 LYS 35 2HZ LYS 35 -15.507 3.647 -1.844 282 H ALA 36 H ALA 36 -13.741 6.377 -5.130 283 HA ALA 36 HA ALA 36 -12.813 6.810 -2.549 284 HB1 ALA 36 1HB ALA 36 -10.896 5.958 -3.321 285 HB2 ALA 36 2HB ALA 36 -11.768 5.737 -4.839 286 HB3 ALA 36 3HB ALA 36 -10.764 7.167 -4.599 287 H LYS 37 H LYS 37 -12.623 8.938 -5.383 288 HA LYS 37 HA LYS 37 -11.246 11.015 -3.967 289 HB2 LYS 37 1HB LYS 37 -12.432 10.701 -6.688 290 HB3 LYS 37 2HB LYS 37 -12.111 12.327 -6.102 291 HG2 LYS 37 1HG LYS 37 -10.262 11.475 -7.435 292 HG3 LYS 37 2HG LYS 37 -9.769 11.762 -5.765 293 HD2 LYS 37 1HD LYS 37 -10.758 9.049 -6.389 294 HD3 LYS 37 2HD LYS 37 -9.212 9.501 -7.111 295 HE2 LYS 37 1HE LYS 37 -8.777 10.366 -4.625 296 HE3 LYS 37 2HE LYS 37 -9.944 9.094 -4.267 297 HZ1 LYS 37 3HZ LYS 37 -8.122 8.035 -6.073 298 HZ2 LYS 37 1HZ LYS 37 -8.301 7.642 -4.437 299 HZ3 LYS 37 2HZ LYS 37 -7.210 8.848 -4.902 300 H ILE 38 H ILE 38 -14.572 10.200 -4.613 301 HA ILE 38 HA ILE 38 -15.737 12.709 -4.059 302 HB ILE 38 HB ILE 38 -16.915 9.950 -3.709 303 HG12 ILE 38 1HG1 ILE 38 -16.153 10.467 -6.010 304 HG13 ILE 38 2HG1 ILE 38 -17.902 10.303 -5.905 305 HG21 ILE 38 1HG2 ILE 38 -19.092 11.159 -3.920 306 HG22 ILE 38 2HG2 ILE 38 -18.207 11.499 -2.433 307 HG23 ILE 38 3HG2 ILE 38 -18.203 12.672 -3.750 308 HD11 ILE 38 3HD1 ILE 38 -16.342 12.870 -6.059 309 HD12 ILE 38 1HD1 ILE 38 -17.342 12.156 -7.324 310 HD13 ILE 38 2HD1 ILE 38 -18.089 12.760 -5.845 311 H GLN 39 H GLN 39 -14.606 10.118 -2.012 312 HA GLN 39 HA GLN 39 -15.932 10.666 0.357 313 HB2 GLN 39 1HB GLN 39 -13.193 9.578 -0.227 314 HB3 GLN 39 2HB GLN 39 -13.734 9.814 1.430 315 HG2 GLN 39 1HG GLN 39 -15.687 8.364 0.938 316 HG3 GLN 39 2HG GLN 39 -14.996 8.047 -0.652 317 HE21 GLN 39 2HE2 GLN 39 -15.304 6.850 2.368 318 HE22 GLN 39 1HE2 GLN 39 -13.914 5.825 2.428 319 H ASP 40 H ASP 40 -13.156 12.269 -1.082 320 HA ASP 40 HA ASP 40 -12.622 13.906 1.216 321 HB2 ASP 40 1HB ASP 40 -10.944 13.219 -0.584 322 HB3 ASP 40 2HB ASP 40 -11.695 14.443 -1.603 323 H LYS 41 H LYS 41 -14.723 14.070 -1.507 324 HA LYS 41 HA LYS 41 -15.108 16.927 -1.387 325 HB2 LYS 41 1HB LYS 41 -16.881 14.933 -2.791 326 HB3 LYS 41 2HB LYS 41 -16.670 16.640 -3.159 327 HG2 LYS 41 1HG LYS 41 -14.508 14.567 -3.455 328 HG3 LYS 41 2HG LYS 41 -15.562 15.105 -4.764 329 HD2 LYS 41 1HD LYS 41 -13.853 16.550 -5.128 330 HD3 LYS 41 2HD LYS 41 -14.700 17.487 -3.896 331 HE2 LYS 41 1HE LYS 41 -12.945 15.590 -2.650 332 HE3 LYS 41 2HE LYS 41 -12.052 16.542 -3.835 333 HZ1 LYS 41 3HZ LYS 41 -12.804 17.304 -1.278 334 HZ2 LYS 41 1HZ LYS 41 -13.747 18.228 -2.337 335 HZ3 LYS 41 2HZ LYS 41 -12.060 18.259 -2.460 336 H GLU 42 H GLU 42 -17.084 14.063 -0.619 337 HA GLU 42 HA GLU 42 -18.655 15.765 1.203 338 HB2 GLU 42 1HB GLU 42 -19.593 13.469 -0.522 339 HB3 GLU 42 2HB GLU 42 -20.561 14.185 0.759 340 HG2 GLU 42 1HG GLU 42 -19.502 15.677 -1.630 341 HG3 GLU 42 2HG GLU 42 -21.132 15.021 -1.487 342 H GLY 43 H GLY 43 -17.212 12.614 0.608 343 HA2 GLY 43 1HA GLY 43 -16.329 11.129 2.152 344 HA3 GLY 43 2HA GLY 43 -16.870 12.197 3.438 345 H ILE 44 H ILE 44 -18.094 9.879 1.040 346 HA ILE 44 HA ILE 44 -20.096 9.040 3.034 347 HB ILE 44 HB ILE 44 -21.466 8.329 0.971 348 HG12 ILE 44 1HG1 ILE 44 -19.764 10.481 -0.303 349 HG13 ILE 44 2HG1 ILE 44 -19.601 8.760 -0.638 350 HG21 ILE 44 1HG2 ILE 44 -21.538 11.240 0.951 351 HG22 ILE 44 2HG2 ILE 44 -22.765 10.079 1.455 352 HG23 ILE 44 3HG2 ILE 44 -21.491 10.558 2.577 353 HD11 ILE 44 3HD1 ILE 44 -21.946 8.748 -1.431 354 HD12 ILE 44 1HD1 ILE 44 -21.986 10.498 -1.213 355 HD13 ILE 44 2HD1 ILE 44 -20.877 9.779 -2.382 356 HA PRO 45 HA PRO 45 -18.524 4.957 2.645 357 HB2 PRO 45 1HB PRO 45 -20.766 3.505 3.130 358 HB3 PRO 45 2HB PRO 45 -19.906 4.396 4.392 359 HG2 PRO 45 1HG PRO 45 -22.364 5.168 2.867 360 HG3 PRO 45 2HG PRO 45 -22.021 5.340 4.599 361 HD2 PRO 45 1HD PRO 45 -21.805 7.404 2.860 362 HD3 PRO 45 2HD PRO 45 -20.765 7.247 4.290 363 HA PRO 46 HA PRO 46 -19.249 3.319 -1.372 364 HB2 PRO 46 1HB PRO 46 -18.872 0.660 -0.971 365 HB3 PRO 46 2HB PRO 46 -17.548 1.831 -0.959 366 HG2 PRO 46 1HG PRO 46 -19.009 0.599 1.345 367 HG3 PRO 46 2HG PRO 46 -17.269 0.881 1.145 368 HD2 PRO 46 1HD PRO 46 -18.849 2.508 2.626 369 HD3 PRO 46 2HD PRO 46 -17.435 3.104 1.732 370 H ASP 47 H ASP 47 -21.059 1.913 1.291 371 HA ASP 47 HA ASP 47 -22.896 0.419 -0.250 372 HB2 ASP 47 1HB ASP 47 -23.065 1.576 2.534 373 HB3 ASP 47 2HB ASP 47 -24.330 0.568 1.835 374 H GLN 48 H GLN 48 -22.879 3.751 0.895 375 HA GLN 48 HA GLN 48 -25.510 4.245 -0.244 376 HB2 GLN 48 1HB GLN 48 -23.607 6.107 1.188 377 HB3 GLN 48 2HB GLN 48 -25.246 6.509 0.693 378 HG2 GLN 48 1HG GLN 48 -24.313 4.720 2.883 379 HG3 GLN 48 2HG GLN 48 -25.525 6.000 2.914 380 HE21 GLN 48 2HE2 GLN 48 -25.347 2.942 3.476 381 HE22 GLN 48 1HE2 GLN 48 -26.808 2.347 2.774 382 H GLN 49 H GLN 49 -22.173 4.663 -1.026 383 HA GLN 49 HA GLN 49 -22.386 6.769 -2.885 384 HB2 GLN 49 1HB GLN 49 -20.398 4.614 -2.341 385 HB3 GLN 49 2HB GLN 49 -20.278 5.490 -3.862 386 HG2 GLN 49 1HG GLN 49 -20.578 7.140 -1.440 387 HG3 GLN 49 2HG GLN 49 -19.063 6.253 -1.599 388 HE21 GLN 49 2HE2 GLN 49 -21.114 7.701 -4.084 389 HE22 GLN 49 1HE2 GLN 49 -19.918 8.791 -4.689 390 H ARG 50 H ARG 50 -23.867 6.670 -4.468 391 HA ARG 50 HA ARG 50 -23.743 4.359 -6.285 392 HB2 ARG 50 1HB ARG 50 -26.214 5.789 -5.298 393 HB3 ARG 50 2HB ARG 50 -26.209 4.676 -6.659 394 HG2 ARG 50 1HG ARG 50 -25.284 3.899 -3.908 395 HG3 ARG 50 2HG ARG 50 -26.952 3.722 -4.456 396 HD2 ARG 50 1HD ARG 50 -24.627 2.552 -5.958 397 HD3 ARG 50 2HD ARG 50 -25.444 1.683 -4.660 398 HE ARG 50 HE ARG 50 -27.203 2.670 -6.718 399 HH11 ARG 50 1HH1 ARG 50 -25.182 0.036 -5.670 400 HH12 ARG 50 2HH1 ARG 50 -26.012 -1.151 -6.622 401 HH21 ARG 50 1HH2 ARG 50 -28.303 1.118 -7.976 402 HH22 ARG 50 2HH2 ARG 50 -27.786 -0.534 -7.934 403 H LEU 51 H LEU 51 -23.089 4.987 -8.224 404 HA LEU 51 HA LEU 51 -23.421 7.776 -9.027 405 HB2 LEU 51 1HB LEU 51 -21.696 5.514 -9.948 406 HB3 LEU 51 2HB LEU 51 -21.969 6.902 -11.000 407 HG LEU 51 HG LEU 51 -19.868 7.138 -9.824 408 HD11 LEU 51 1HD1 LEU 51 -21.654 9.070 -10.137 409 HD12 LEU 51 2HD1 LEU 51 -20.112 9.342 -9.327 410 HD13 LEU 51 3HD1 LEU 51 -21.574 9.084 -8.375 411 HD21 LEU 51 3HD2 LEU 51 -21.203 7.390 -7.184 412 HD22 LEU 51 1HD2 LEU 51 -19.560 6.888 -7.581 413 HD23 LEU 51 2HD2 LEU 51 -20.902 5.767 -7.807 414 H ILE 52 H ILE 52 -24.560 8.430 -10.803 415 HA ILE 52 HA ILE 52 -26.131 6.355 -12.189 416 HB ILE 52 HB ILE 52 -27.074 9.186 -11.819 417 HG12 ILE 52 1HG1 ILE 52 -26.732 8.294 -9.582 418 HG13 ILE 52 2HG1 ILE 52 -28.455 8.358 -9.934 419 HG21 ILE 52 1HG2 ILE 52 -28.048 6.836 -13.150 420 HG22 ILE 52 2HG2 ILE 52 -29.191 7.355 -11.912 421 HG23 ILE 52 3HG2 ILE 52 -28.686 8.480 -13.173 422 HD11 ILE 52 3HD1 ILE 52 -28.422 6.281 -9.095 423 HD12 ILE 52 1HD1 ILE 52 -27.900 5.847 -10.723 424 HD13 ILE 52 2HD1 ILE 52 -26.708 6.052 -9.439 425 H PHE 53 H PHE 53 -26.219 6.410 -14.375 426 HA PHE 53 HA PHE 53 -25.159 8.740 -15.789 427 HB2 PHE 53 1HB PHE 53 -23.325 7.012 -15.381 428 HB3 PHE 53 2HB PHE 53 -24.214 5.960 -16.478 429 HD1 PHE 53 HD2 PHE 53 -22.859 9.432 -16.335 430 HD2 PHE 53 HD1 PHE 53 -23.643 5.981 -18.700 431 HE1 PHE 53 HE2 PHE 53 -21.743 10.496 -18.252 432 HE2 PHE 53 HE1 PHE 53 -22.527 7.039 -20.620 433 HZ PHE 53 HZ PHE 53 -21.577 9.300 -20.399 434 H ALA 54 H ALA 54 -26.644 9.306 -17.221 435 HA ALA 54 HA ALA 54 -28.324 9.226 -18.755 436 HB1 ALA 54 1HB ALA 54 -27.674 6.464 -19.592 437 HB2 ALA 54 2HB ALA 54 -27.920 7.918 -20.560 438 HB3 ALA 54 3HB ALA 54 -26.387 7.663 -19.727 439 H GLY 55 H GLY 55 -28.848 8.253 -16.056 440 HA2 GLY 55 1HA GLY 55 -30.842 7.564 -15.064 441 HA3 GLY 55 2HA GLY 55 -31.371 6.940 -16.619 442 H LYS 56 H LYS 56 -28.411 5.707 -16.389 443 HA LYS 56 HA LYS 56 -29.409 3.207 -15.229 444 HB2 LYS 56 1HB LYS 56 -28.535 3.076 -17.512 445 HB3 LYS 56 2HB LYS 56 -26.998 3.740 -16.975 446 HG2 LYS 56 1HG LYS 56 -26.678 1.764 -15.538 447 HG3 LYS 56 2HG LYS 56 -28.183 1.092 -16.169 448 HD2 LYS 56 1HD LYS 56 -27.148 1.326 -18.476 449 HD3 LYS 56 2HD LYS 56 -25.619 1.637 -17.649 450 HE2 LYS 56 1HE LYS 56 -27.321 -0.823 -17.259 451 HE3 LYS 56 2HE LYS 56 -25.919 -0.732 -18.324 452 HZ1 LYS 56 3HZ LYS 56 -25.736 -0.090 -15.442 453 HZ2 LYS 56 1HZ LYS 56 -24.483 -0.456 -16.518 454 HZ3 LYS 56 2HZ LYS 56 -25.550 -1.669 -16.019 455 H GLN 57 H GLN 57 -28.735 2.540 -13.302 456 HA GLN 57 HA GLN 57 -26.886 4.066 -11.769 457 HB2 GLN 57 1HB GLN 57 -27.213 2.307 -10.053 458 HB3 GLN 57 2HB GLN 57 -28.728 2.949 -10.673 459 HG2 GLN 57 1HG GLN 57 -28.455 0.878 -12.326 460 HG3 GLN 57 2HG GLN 57 -27.553 0.253 -10.947 461 HE21 GLN 57 2HE2 GLN 57 -30.561 2.053 -11.523 462 HE22 GLN 57 1HE2 GLN 57 -31.533 1.104 -10.456 463 H LEU 58 H LEU 58 -24.754 3.995 -11.946 464 HA LEU 58 HA LEU 58 -23.416 1.839 -13.287 465 HB2 LEU 58 1HB LEU 58 -22.098 4.047 -11.735 466 HB3 LEU 58 2HB LEU 58 -21.449 3.126 -13.091 467 HG LEU 58 HG LEU 58 -23.753 5.052 -13.340 468 HD11 LEU 58 1HD1 LEU 58 -22.217 6.640 -12.966 469 HD12 LEU 58 2HD1 LEU 58 -21.656 6.244 -14.590 470 HD13 LEU 58 3HD1 LEU 58 -20.865 5.529 -13.185 471 HD21 LEU 58 3HD2 LEU 58 -22.206 4.678 -15.702 472 HD22 LEU 58 1HD2 LEU 58 -23.903 4.294 -15.418 473 HD23 LEU 58 2HD2 LEU 58 -22.657 3.097 -15.063 474 H GLU 59 H GLU 59 -21.889 0.412 -12.421 475 HA GLU 59 HA GLU 59 -21.638 0.278 -9.515 476 HB2 GLU 59 1HB GLU 59 -23.000 -1.737 -11.236 477 HB3 GLU 59 2HB GLU 59 -22.003 -2.327 -9.913 478 HG2 GLU 59 1HG GLU 59 -24.075 -0.232 -9.425 479 HG3 GLU 59 2HG GLU 59 -24.524 -1.933 -9.529 480 H ASP 60 H ASP 60 -20.057 -1.506 -8.893 481 HA ASP 60 HA ASP 60 -17.601 -1.050 -10.143 482 HB2 ASP 60 1HB ASP 60 -16.679 -2.533 -8.595 483 HB3 ASP 60 2HB ASP 60 -18.131 -1.968 -7.774 484 H GLY 61 H GLY 61 -16.202 -3.140 -10.756 485 HA2 GLY 61 1HA GLY 61 -16.021 -5.085 -12.075 486 HA3 GLY 61 2HA GLY 61 -17.712 -4.913 -12.521 487 H ARG 62 H ARG 62 -17.789 -2.333 -13.466 488 HA ARG 62 HA ARG 62 -16.253 -2.622 -15.939 489 HB2 ARG 62 1HB ARG 62 -18.820 -1.341 -15.191 490 HB3 ARG 62 2HB ARG 62 -17.886 -0.544 -16.450 491 HG2 ARG 62 1HG ARG 62 -19.509 -2.073 -17.404 492 HG3 ARG 62 2HG ARG 62 -17.864 -2.610 -17.748 493 HD2 ARG 62 1HD ARG 62 -18.035 -4.163 -15.810 494 HD3 ARG 62 2HD ARG 62 -19.726 -3.694 -15.640 495 HE ARG 62 HE ARG 62 -19.126 -4.606 -18.275 496 HH11 ARG 62 1HH1 ARG 62 -19.827 -5.664 -15.033 497 HH12 ARG 62 2HH1 ARG 62 -20.473 -7.192 -15.532 498 HH21 ARG 62 1HH2 ARG 62 -19.975 -6.615 -18.944 499 HH22 ARG 62 2HH2 ARG 62 -20.556 -7.733 -17.757 500 H THR 63 H THR 63 -15.538 -0.514 -16.969 501 HA THR 63 HA THR 63 -14.235 1.145 -14.914 502 HB THR 63 HB THR 63 -12.527 0.088 -16.147 503 HG1 THR 63 HG1 THR 63 -11.812 1.966 -17.574 504 HG21 THR 63 3HG2 THR 63 -14.389 0.432 -18.408 505 HG22 THR 63 1HG2 THR 63 -13.267 -0.881 -18.053 506 HG23 THR 63 2HG2 THR 63 -12.677 0.606 -18.796 507 H LEU 64 H LEU 64 -13.886 3.415 -15.445 508 HA LEU 64 HA LEU 64 -16.197 4.770 -16.122 509 HB2 LEU 64 1HB LEU 64 -13.315 5.591 -16.084 510 HB3 LEU 64 2HB LEU 64 -14.577 6.727 -16.557 511 HG LEU 64 HG LEU 64 -14.024 7.102 -14.258 512 HD11 LEU 64 1HD1 LEU 64 -16.619 5.576 -14.327 513 HD12 LEU 64 2HD1 LEU 64 -16.414 7.209 -14.958 514 HD13 LEU 64 3HD1 LEU 64 -16.173 6.891 -13.240 515 HD21 LEU 64 3HD2 LEU 64 -13.970 5.462 -12.585 516 HD22 LEU 64 1HD2 LEU 64 -13.135 4.729 -13.954 517 HD23 LEU 64 2HD2 LEU 64 -14.802 4.278 -13.595 518 H SER 65 H SER 65 -13.576 3.680 -18.177 519 HA SER 65 HA SER 65 -14.357 5.154 -20.486 520 HB2 SER 65 1HB SER 65 -12.076 4.326 -20.256 521 HB3 SER 65 2HB SER 65 -12.658 2.662 -20.223 522 HG SER 65 HG SER 65 -11.855 3.554 -22.307 523 H GLU 66 H GLU 66 -15.205 2.032 -19.157 524 HA GLU 66 HA GLU 66 -16.520 1.073 -21.510 525 HB2 GLU 66 1HB GLU 66 -16.361 0.179 -18.655 526 HB3 GLU 66 2HB GLU 66 -17.568 -0.528 -19.721 527 HG2 GLU 66 1HG GLU 66 -14.672 -0.447 -20.478 528 HG3 GLU 66 2HG GLU 66 -15.328 -1.729 -19.463 529 H TYR 67 H TYR 67 -17.392 3.123 -18.882 530 HA TYR 67 HA TYR 67 -20.248 2.825 -19.368 531 HB2 TYR 67 1HB TYR 67 -18.600 4.268 -17.318 532 HB3 TYR 67 2HB TYR 67 -20.290 4.700 -17.553 533 HD1 TYR 67 HD1 TYR 67 -21.773 2.349 -17.828 534 HD2 TYR 67 HD2 TYR 67 -18.275 2.930 -15.478 535 HE1 TYR 67 HE1 TYR 67 -22.455 0.493 -16.365 536 HE2 TYR 67 HE2 TYR 67 -18.945 1.075 -14.009 537 HH TYR 67 HH TYR 67 -22.018 -0.630 -14.489 538 H ASN 68 H ASN 68 -18.065 4.181 -21.143 539 HA ASN 68 HA ASN 68 -17.988 5.885 -22.647 540 HB2 ASN 68 1HB ASN 68 -20.883 6.430 -22.001 541 HB3 ASN 68 2HB ASN 68 -20.036 6.710 -23.519 542 HD21 ASN 68 2HD2 ASN 68 -22.163 4.745 -21.993 543 HD22 ASN 68 1HD2 ASN 68 -21.981 3.317 -22.948 544 H ILE 69 H ILE 69 -17.568 6.361 -19.733 545 HA ILE 69 HA ILE 69 -18.418 9.118 -19.371 546 HB ILE 69 HB ILE 69 -16.750 7.342 -17.584 547 HG12 ILE 69 1HG1 ILE 69 -19.590 8.236 -17.125 548 HG13 ILE 69 2HG1 ILE 69 -19.220 6.765 -18.018 549 HG21 ILE 69 1HG2 ILE 69 -17.236 9.053 -15.855 550 HG22 ILE 69 2HG2 ILE 69 -16.220 9.648 -17.166 551 HG23 ILE 69 3HG2 ILE 69 -17.930 10.075 -17.114 552 HD11 ILE 69 3HD1 ILE 69 -18.397 7.352 -15.184 553 HD12 ILE 69 1HD1 ILE 69 -19.724 6.304 -15.683 554 HD13 ILE 69 2HD1 ILE 69 -18.061 5.870 -16.078 555 H GLN 70 H GLN 70 -17.291 10.418 -20.740 556 HA GLN 70 HA GLN 70 -14.424 10.126 -21.037 557 HB2 GLN 70 1HB GLN 70 -16.213 12.297 -22.136 558 HB3 GLN 70 2HB GLN 70 -14.585 11.897 -22.668 559 HG2 GLN 70 1HG GLN 70 -16.876 9.965 -22.849 560 HG3 GLN 70 2HG GLN 70 -16.474 11.103 -24.134 561 HE21 GLN 70 2HE2 GLN 70 -14.635 10.789 -25.350 562 HE22 GLN 70 1HE2 GLN 70 -13.728 9.319 -25.312 563 H LYS 71 H LYS 71 -13.507 12.675 -21.233 564 HA LYS 71 HA LYS 71 -13.285 13.422 -18.459 565 HB2 LYS 71 1HB LYS 71 -11.532 14.867 -19.141 566 HB3 LYS 71 2HB LYS 71 -11.378 13.418 -20.126 567 HG2 LYS 71 1HG LYS 71 -12.637 14.638 -21.928 568 HG3 LYS 71 2HG LYS 71 -12.467 16.096 -20.948 569 HD2 LYS 71 1HD LYS 71 -10.639 16.261 -22.345 570 HD3 LYS 71 2HD LYS 71 -9.937 15.454 -20.941 571 HE2 LYS 71 1HE LYS 71 -10.488 13.270 -22.160 572 HE3 LYS 71 2HE LYS 71 -10.722 14.275 -23.590 573 HZ1 LYS 71 3HZ LYS 71 -8.351 15.143 -22.715 574 HZ2 LYS 71 1HZ LYS 71 -8.540 13.915 -23.863 575 HZ3 LYS 71 2HZ LYS 71 -8.274 13.522 -22.240 576 H GLU 72 H GLU 72 -15.535 14.086 -20.749 577 HA GLU 72 HA GLU 72 -16.216 16.646 -19.472 578 HB2 GLU 72 1HB GLU 72 -17.171 17.339 -21.720 579 HB3 GLU 72 2HB GLU 72 -15.417 17.313 -21.596 580 HG2 GLU 72 1HG GLU 72 -15.279 15.278 -22.814 581 HG3 GLU 72 2HG GLU 72 -17.026 15.051 -22.746 582 H SER 73 H SER 73 -17.094 13.821 -19.098 583 HA SER 73 HA SER 73 -19.830 13.805 -20.063 584 HB2 SER 73 1HB SER 73 -18.111 11.785 -19.620 585 HB3 SER 73 2HB SER 73 -18.934 11.803 -18.060 586 HG SER 73 HG SER 73 -19.825 10.940 -20.476 587 H THR 74 H THR 74 -21.651 13.525 -18.607 588 HA THR 74 HA THR 74 -21.291 15.080 -16.135 589 HB THR 74 HB THR 74 -24.023 14.603 -17.194 590 HG1 THR 74 HG1 THR 74 -23.747 16.265 -18.748 591 HG21 THR 74 3HG2 THR 74 -23.942 15.957 -15.286 592 HG22 THR 74 1HG2 THR 74 -24.100 17.108 -16.612 593 HG23 THR 74 2HG2 THR 74 -22.527 16.840 -15.859 594 H LEU 75 H LEU 75 -21.220 13.884 -14.355 595 HA LEU 75 HA LEU 75 -22.703 11.353 -14.271 596 HB2 LEU 75 1HB LEU 75 -20.162 12.271 -13.212 597 HB3 LEU 75 2HB LEU 75 -21.163 11.514 -11.974 598 HG LEU 75 HG LEU 75 -19.597 9.932 -13.004 599 HD11 LEU 75 1HD1 LEU 75 -21.134 8.421 -12.498 600 HD12 LEU 75 2HD1 LEU 75 -21.871 8.647 -14.084 601 HD13 LEU 75 3HD1 LEU 75 -22.411 9.618 -12.715 602 HD21 LEU 75 3HD2 LEU 75 -21.057 9.758 -15.535 603 HD22 LEU 75 1HD2 LEU 75 -19.325 9.669 -15.212 604 HD23 LEU 75 2HD2 LEU 75 -20.118 11.239 -15.341 605 H HIS 76 H HIS 76 -23.925 10.799 -12.390 606 HA HIS 76 HA HIS 76 -24.821 13.124 -10.817 607 HB2 HIS 76 1HB HIS 76 -26.416 11.028 -12.240 608 HB3 HIS 76 2HB HIS 76 -27.060 11.744 -10.765 609 HD1 HIS 76 HD1 HIS 76 -27.036 14.532 -10.881 610 HD2 HIS 76 HD2 HIS 76 -27.103 12.411 -14.453 611 HE1 HIS 76 HE1 HIS 76 -27.862 16.158 -12.613 612 H LEU 77 H LEU 77 -24.326 12.874 -8.750 613 HA LEU 77 HA LEU 77 -23.986 10.176 -7.667 614 HB2 LEU 77 1HB LEU 77 -22.860 11.271 -5.800 615 HB3 LEU 77 2HB LEU 77 -22.138 11.709 -7.347 616 HG LEU 77 HG LEU 77 -23.926 13.747 -6.934 617 HD11 LEU 77 1HD1 LEU 77 -24.190 14.270 -4.765 618 HD12 LEU 77 2HD1 LEU 77 -22.585 13.693 -4.320 619 HD13 LEU 77 3HD1 LEU 77 -23.912 12.547 -4.511 620 HD21 LEU 77 3HD2 LEU 77 -21.325 13.531 -7.478 621 HD22 LEU 77 1HD2 LEU 77 -21.209 14.071 -5.802 622 HD23 LEU 77 2HD2 LEU 77 -22.072 15.052 -6.987 623 H VAL 78 H VAL 78 -25.563 9.282 -6.531 624 HA VAL 78 HA VAL 78 -27.533 11.040 -5.223 625 HB VAL 78 HB VAL 78 -28.983 8.914 -5.272 626 HG11 VAL 78 1HG1 VAL 78 -28.429 10.044 -7.992 627 HG12 VAL 78 2HG1 VAL 78 -29.973 9.585 -7.274 628 HG13 VAL 78 3HG1 VAL 78 -29.137 11.035 -6.717 629 HG21 VAL 78 3HG2 VAL 78 -28.475 7.201 -6.762 630 HG22 VAL 78 1HG2 VAL 78 -27.272 8.168 -7.614 631 HG23 VAL 78 2HG2 VAL 78 -26.921 7.544 -6.003 632 H LEU 79 H LEU 79 -27.509 11.066 -3.081 633 HA LEU 79 HA LEU 79 -26.237 8.827 -1.659 634 HB2 LEU 79 1HB LEU 79 -26.457 11.751 -1.110 635 HB3 LEU 79 2HB LEU 79 -26.280 10.633 0.241 636 HG LEU 79 HG LEU 79 -24.152 9.866 -0.635 637 HD11 LEU 79 1HD1 LEU 79 -24.087 9.937 -2.898 638 HD12 LEU 79 2HD1 LEU 79 -23.287 11.475 -2.578 639 HD13 LEU 79 3HD1 LEU 79 -25.001 11.442 -2.990 640 HD21 LEU 79 3HD2 LEU 79 -22.945 12.138 -0.586 641 HD22 LEU 79 1HD2 LEU 79 -23.864 11.646 0.837 642 HD23 LEU 79 2HD2 LEU 79 -24.547 12.817 -0.291 643 H ARG 80 H ARG 80 -27.299 7.748 -0.064 644 HA ARG 80 HA ARG 80 -30.168 8.271 0.156 645 HB2 ARG 80 1HB ARG 80 -29.012 5.959 -0.353 646 HB3 ARG 80 2HB ARG 80 -28.837 5.898 1.395 647 HG2 ARG 80 1HG ARG 80 -30.828 4.733 0.803 648 HG3 ARG 80 2HG ARG 80 -31.293 6.244 1.588 649 HD2 ARG 80 1HD ARG 80 -31.891 7.241 -0.469 650 HD3 ARG 80 2HD ARG 80 -31.103 5.967 -1.399 651 HE ARG 80 HE ARG 80 -33.136 4.841 0.184 652 HH11 ARG 80 1HH1 ARG 80 -32.712 6.889 -2.599 653 HH12 ARG 80 2HH1 ARG 80 -34.216 6.433 -3.327 654 HH21 ARG 80 1HH2 ARG 80 -35.119 4.232 -0.764 655 HH22 ARG 80 2HH2 ARG 80 -35.585 4.922 -2.282 656 H LEU 81 H LEU 81 -27.240 8.150 2.071 657 HA LEU 81 HA LEU 81 -28.785 8.854 4.472 658 HB2 LEU 81 1HB LEU 81 -26.152 7.520 4.040 659 HB3 LEU 81 2HB LEU 81 -26.441 8.392 5.543 660 HG LEU 81 HG LEU 81 -28.493 6.919 5.829 661 HD11 LEU 81 1HD1 LEU 81 -27.638 4.657 4.463 662 HD12 LEU 81 2HD1 LEU 81 -27.525 5.961 3.282 663 HD13 LEU 81 3HD1 LEU 81 -29.055 5.642 4.100 664 HD21 LEU 81 3HD2 LEU 81 -26.662 6.512 7.241 665 HD22 LEU 81 1HD2 LEU 81 -25.680 5.870 5.923 666 HD23 LEU 81 2HD2 LEU 81 -27.051 4.943 6.534 667 H ARG 82 H ARG 82 -27.313 10.249 6.027 668 HA ARG 82 HA ARG 82 -25.505 12.105 4.964 669 HB2 ARG 82 1HB ARG 82 -27.281 13.004 3.646 670 HB3 ARG 82 2HB ARG 82 -28.387 12.993 5.013 671 HG2 ARG 82 1HG ARG 82 -27.633 15.246 4.508 672 HG3 ARG 82 2HG ARG 82 -27.074 14.734 6.102 673 HD2 ARG 82 1HD ARG 82 -25.257 15.837 5.022 674 HD3 ARG 82 2HD ARG 82 -24.895 14.112 5.043 675 HE ARG 82 HE ARG 82 -26.180 15.028 2.632 676 HH11 ARG 82 1HH1 ARG 82 -23.154 14.513 4.273 677 HH12 ARG 82 2HH1 ARG 82 -22.229 14.412 2.812 678 HH21 ARG 82 1HH2 ARG 82 -24.974 14.897 0.701 679 HH22 ARG 82 2HH2 ARG 82 -23.265 14.631 0.780 680 H GLY 83 H GLY 83 -24.455 13.017 6.624 681 HA2 GLY 83 1HA GLY 83 -24.950 12.368 9.269 682 HA3 GLY 83 2HA GLY 83 -23.962 13.726 8.751 683 H TYR 84 H TYR 84 -25.469 15.597 7.840 684 HA TYR 84 HA TYR 84 -28.009 15.980 8.979 685 HB2 TYR 84 1HB TYR 84 -27.201 17.811 10.636 686 HB3 TYR 84 2HB TYR 84 -27.140 16.125 11.137 687 HD1 TYR 84 HD1 TYR 84 -25.120 18.995 10.006 688 HD2 TYR 84 HD2 TYR 84 -25.054 15.040 11.576 689 HE1 TYR 84 HE1 TYR 84 -22.722 19.235 10.495 690 HE2 TYR 84 HE2 TYR 84 -22.655 15.271 12.070 691 HH TYR 84 HH TYR 84 -20.771 17.862 10.864 692 H ALA 85 H ALA 85 -24.991 17.512 7.975 693 HA ALA 85 HA ALA 85 -26.159 18.949 5.875 694 HB1 ALA 85 1HB ALA 85 -27.146 20.616 6.993 695 HB2 ALA 85 2HB ALA 85 -26.267 20.264 8.482 696 HB3 ALA 85 3HB ALA 85 -25.511 21.239 7.221 697 H ASP 86 H ASP 86 -24.257 17.952 5.002 698 HA ASP 86 HA ASP 86 -21.646 18.334 5.821 699 HB2 ASP 86 1HB ASP 86 -22.725 16.970 3.811 700 HB3 ASP 86 2HB ASP 86 -22.212 18.383 2.893 701 H LEU 87 H LEU 87 -19.963 19.730 5.003 702 HA LEU 87 HA LEU 87 -20.822 22.477 4.898 703 HB2 LEU 87 1HB LEU 87 -18.230 21.044 5.131 704 HB3 LEU 87 2HB LEU 87 -18.204 22.701 4.531 705 HG LEU 87 HG LEU 87 -19.321 21.815 7.192 706 HD11 LEU 87 1HD1 LEU 87 -16.854 21.661 7.000 707 HD12 LEU 87 2HD1 LEU 87 -17.396 22.862 8.172 708 HD13 LEU 87 3HD1 LEU 87 -16.815 23.376 6.588 709 HD21 LEU 87 3HD2 LEU 87 -20.532 23.722 6.518 710 HD22 LEU 87 1HD2 LEU 87 -19.094 24.499 5.856 711 HD23 LEU 87 2HD2 LEU 87 -19.272 24.317 7.601 712 H ARG 88 H ARG 88 -20.476 20.104 2.609 713 HA ARG 88 HA ARG 88 -20.347 20.074 0.338 714 HB2 ARG 88 1HB ARG 88 -22.206 21.779 0.757 715 HB3 ARG 88 2HB ARG 88 -21.001 23.014 0.419 716 HG2 ARG 88 1HG ARG 88 -20.625 21.939 -1.799 717 HG3 ARG 88 2HG ARG 88 -21.988 20.873 -1.448 718 HD2 ARG 88 1HD ARG 88 -22.020 23.872 -1.732 719 HD3 ARG 88 2HD ARG 88 -22.793 22.685 -2.781 720 HE ARG 88 HE ARG 88 -23.960 22.202 -0.409 721 HH11 ARG 88 1HH1 ARG 88 -23.424 25.135 -2.207 722 HH12 ARG 88 2HH1 ARG 88 -24.842 25.922 -1.596 723 HH21 ARG 88 1HH2 ARG 88 -25.829 23.228 0.402 724 HH22 ARG 88 2HH2 ARG 88 -26.209 24.837 -0.112 725 H GLU 89 H GLU 89 -17.908 20.316 1.550 726 HA GLU 89 HA GLU 89 -16.299 22.456 0.772 727 HB2 GLU 89 1HB GLU 89 -15.764 20.506 2.359 728 HB3 GLU 89 2HB GLU 89 -15.303 19.620 0.913 729 HG2 GLU 89 1HG GLU 89 -13.403 20.675 2.091 730 HG3 GLU 89 2HG GLU 89 -13.576 21.190 0.414 731 H ASP 90 H ASP 90 -14.505 22.355 -0.844 732 HA ASP 90 HA ASP 90 -15.266 20.905 -3.283 733 HB2 ASP 90 1HB ASP 90 -14.406 23.122 -4.447 734 HB3 ASP 90 2HB ASP 90 -16.082 22.956 -3.930 735 HA PRO 91 HA PRO 91 -11.018 19.915 -3.735 736 HB2 PRO 91 1HB PRO 91 -10.672 20.037 -6.425 737 HB3 PRO 91 2HB PRO 91 -11.589 18.751 -5.631 738 HG2 PRO 91 1HG PRO 91 -12.585 21.218 -7.004 739 HG3 PRO 91 2HG PRO 91 -13.206 19.559 -7.094 740 HD2 PRO 91 1HD PRO 91 -14.353 21.463 -5.547 741 HD3 PRO 91 2HD PRO 91 -14.347 19.745 -5.100 742 H ASP 92 H ASP 92 -9.537 21.312 -2.994 743 HA ASP 92 HA ASP 92 -9.018 23.754 -4.560 744 HB2 ASP 92 1HB ASP 92 -8.578 23.239 -1.611 745 HB3 ASP 92 2HB ASP 92 -8.086 24.704 -2.457 746 H ARG 93 H ARG 93 -7.667 20.887 -3.145 747 HA ARG 93 HA ARG 93 -4.930 21.604 -3.358 748 HB2 ARG 93 1HB ARG 93 -6.458 19.097 -2.896 749 HB3 ARG 93 2HB ARG 93 -4.800 18.935 -3.458 750 HG2 ARG 93 1HG ARG 93 -4.412 18.926 -1.229 751 HG3 ARG 93 2HG ARG 93 -4.372 20.670 -1.496 752 HD2 ARG 93 1HD ARG 93 -5.791 20.513 0.311 753 HD3 ARG 93 2HD ARG 93 -6.931 20.518 -1.033 754 HE ARG 93 HE ARG 93 -6.212 17.866 -0.384 755 HH11 ARG 93 1HH1 ARG 93 -8.090 20.548 0.801 756 HH12 ARG 93 2HH1 ARG 93 -9.218 19.549 1.656 757 HH21 ARG 93 1HH2 ARG 93 -7.691 16.540 0.738 758 HH22 ARG 93 2HH2 ARG 93 -8.989 17.269 1.621 759 H GLN 94 H GLN 94 -3.498 19.977 -4.753 760 HA GLN 94 HA GLN 94 -4.596 19.619 -7.426 761 HB2 GLN 94 1HB GLN 94 -2.922 20.920 -8.535 762 HB3 GLN 94 2HB GLN 94 -3.671 21.945 -7.318 763 HG2 GLN 94 1HG GLN 94 -1.748 21.402 -5.809 764 HG3 GLN 94 2HG GLN 94 -0.983 20.609 -7.185 765 HE21 GLN 94 2HE2 GLN 94 0.699 21.938 -7.533 766 HE22 GLN 94 1HE2 GLN 94 0.560 23.612 -7.934 767 H ASP 95 H ASP 95 -2.689 18.758 -8.895 768 HA ASP 95 HA ASP 95 -0.966 16.965 -7.340 769 HB2 ASP 95 1HB ASP 95 -2.666 16.053 -9.671 770 HB3 ASP 95 2HB ASP 95 -1.559 15.057 -8.730 771 H HIS 96 H HIS 96 0.390 15.639 -9.138 772 HA HIS 96 HA HIS 96 1.223 17.445 -11.278 773 HB2 HIS 96 1HB HIS 96 3.629 17.105 -10.625 774 HB3 HIS 96 2HB HIS 96 2.700 18.107 -9.513 775 HD1 HIS 96 HD1 HIS 96 4.957 15.314 -9.561 776 HD2 HIS 96 HD2 HIS 96 1.773 16.504 -7.173 777 HE1 HIS 96 HE1 HIS 96 5.206 14.023 -7.417 778 H HIS 97 H HIS 97 3.318 16.211 -12.328 779 HA HIS 97 HA HIS 97 2.351 13.482 -12.873 780 HB2 HIS 97 1HB HIS 97 2.275 15.245 -14.737 781 HB3 HIS 97 2HB HIS 97 4.032 15.123 -14.760 782 HD1 HIS 97 HD1 HIS 97 5.041 13.166 -15.985 783 HD2 HIS 97 HD2 HIS 97 0.924 12.835 -15.533 784 HE1 HIS 97 HE1 HIS 97 4.364 11.204 -17.405 785 HA PRO 98 HA PRO 98 6.536 13.085 -10.911 786 HB2 PRO 98 1HB PRO 98 5.845 10.999 -9.317 787 HB3 PRO 98 2HB PRO 98 5.605 12.686 -8.849 788 HG2 PRO 98 1HG PRO 98 3.634 10.733 -9.971 789 HG3 PRO 98 2HG PRO 98 3.427 11.896 -8.649 790 HD2 PRO 98 1HD PRO 98 2.510 12.360 -11.153 791 HD3 PRO 98 2HD PRO 98 3.078 13.662 -10.088 792 H GLY 99 H GLY 99 7.866 11.017 -10.733 793 HA2 GLY 99 1HA GLY 99 7.162 8.682 -12.137 794 HA3 GLY 99 2HA GLY 99 8.000 9.766 -13.239 795 H SER 100 H SER 100 9.892 8.703 -13.508 796 HA SER 100 HA SER 100 11.956 7.861 -13.049 797 HB2 SER 100 1HB SER 100 13.281 9.127 -11.633 798 HB3 SER 100 2HB SER 100 11.943 10.241 -11.915 799 HG SER 100 HG SER 100 11.591 10.185 -9.857 800 H GLY 101 H GLY 101 9.586 6.437 -12.066 801 HA2 GLY 101 1HA GLY 101 10.412 5.259 -9.543 802 HA3 GLY 101 2HA GLY 101 8.966 4.860 -10.459 803 H ALA 102 H ALA 102 10.912 3.071 -9.222 804 HA ALA 102 HA ALA 102 11.395 1.394 -11.546 805 HB1 ALA 102 1HB ALA 102 13.660 1.275 -11.450 806 HB2 ALA 102 2HB ALA 102 13.458 2.926 -10.863 807 HB3 ALA 102 3HB ALA 102 13.717 1.609 -9.719 808 H GLN 103 H GLN 103 12.608 -0.715 -10.614 809 HA GLN 103 HA GLN 103 10.932 -1.586 -8.366 810 HB2 GLN 103 1HB GLN 103 11.051 -2.727 -10.750 811 HB3 GLN 103 2HB GLN 103 12.464 -3.511 -10.056 812 HG2 GLN 103 1HG GLN 103 11.235 -4.694 -8.529 813 HG3 GLN 103 2HG GLN 103 9.917 -3.523 -8.521 814 HE21 GLN 103 2HE2 GLN 103 9.461 -6.235 -8.706 815 HE22 GLN 103 1HE2 GLN 103 8.828 -6.602 -10.271 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -4.535 22.074 -7.654 2 HA2 GLY 1 1HA GLY 1 -4.778 19.832 -5.834 3 HA3 GLY 1 2HA GLY 1 -5.117 19.821 -7.558 4 H SER 2 H SER 2 -3.965 18.076 -8.199 5 HA SER 2 HA SER 2 -1.094 18.355 -8.288 6 HB2 SER 2 1HB SER 2 -2.271 15.913 -6.942 7 HB3 SER 2 2HB SER 2 -0.561 16.261 -7.196 8 HG SER 2 HG SER 2 -0.925 16.912 -5.157 9 H LEU 3 H LEU 3 -0.128 16.356 -9.436 10 HA LEU 3 HA LEU 3 -1.993 15.545 -11.567 11 HB2 LEU 3 1HB LEU 3 0.871 16.367 -11.606 12 HB3 LEU 3 2HB LEU 3 0.299 15.215 -12.811 13 HG LEU 3 HG LEU 3 -1.379 16.877 -13.548 14 HD11 LEU 3 1HD1 LEU 3 -0.719 19.289 -12.760 15 HD12 LEU 3 2HD1 LEU 3 -0.148 18.434 -11.328 16 HD13 LEU 3 3HD1 LEU 3 -1.838 18.305 -11.816 17 HD21 LEU 3 3HD2 LEU 3 0.556 18.609 -14.239 18 HD22 LEU 3 1HD2 LEU 3 0.346 17.031 -14.996 19 HD23 LEU 3 2HD2 LEU 3 1.544 17.242 -13.719 20 H VAL 4 H VAL 4 -2.250 13.431 -11.981 21 HA VAL 4 HA VAL 4 -0.730 11.538 -10.339 22 HB VAL 4 HB VAL 4 -3.263 11.094 -11.926 23 HG11 VAL 4 1HG1 VAL 4 -1.874 9.073 -11.629 24 HG12 VAL 4 2HG1 VAL 4 -1.935 9.317 -9.883 25 HG13 VAL 4 3HG1 VAL 4 -3.416 8.974 -10.779 26 HG21 VAL 4 3HG2 VAL 4 -2.738 12.045 -9.186 27 HG22 VAL 4 1HG2 VAL 4 -4.128 12.316 -10.237 28 HG23 VAL 4 2HG2 VAL 4 -3.980 10.802 -9.344 29 HA PRO 5 HA PRO 5 1.607 10.246 -13.865 30 HB2 PRO 5 1HB PRO 5 2.618 7.965 -12.796 31 HB3 PRO 5 2HB PRO 5 3.204 9.573 -12.356 32 HG2 PRO 5 1HG PRO 5 1.276 7.798 -10.909 33 HG3 PRO 5 2HG PRO 5 2.607 8.771 -10.257 34 HD2 PRO 5 1HD PRO 5 0.024 9.576 -10.145 35 HD3 PRO 5 2HD PRO 5 1.374 10.718 -10.303 36 H ARG 6 H ARG 6 1.989 8.031 -15.021 37 HA ARG 6 HA ARG 6 1.065 6.484 -16.415 38 HB2 ARG 6 1HB ARG 6 -0.688 5.730 -14.082 39 HB3 ARG 6 2HB ARG 6 -0.086 4.691 -15.367 40 HG2 ARG 6 1HG ARG 6 1.577 5.973 -13.209 41 HG3 ARG 6 2HG ARG 6 1.080 4.281 -13.274 42 HD2 ARG 6 1HD ARG 6 2.814 5.687 -15.303 43 HD3 ARG 6 2HD ARG 6 3.387 4.590 -14.048 44 HE ARG 6 HE ARG 6 2.249 3.869 -16.554 45 HH11 ARG 6 1HH1 ARG 6 2.490 2.891 -13.221 46 HH12 ARG 6 2HH1 ARG 6 2.249 1.209 -13.562 47 HH21 ARG 6 1HH2 ARG 6 1.932 1.658 -17.015 48 HH22 ARG 6 2HH2 ARG 6 1.933 0.509 -15.720 49 H GLY 7 H GLY 7 0.012 8.814 -17.042 50 HA2 GLY 7 1HA GLY 7 -1.756 9.715 -18.205 51 HA3 GLY 7 2HA GLY 7 -2.549 8.151 -18.084 52 H SER 8 H SER 8 -4.098 10.348 -17.939 53 HA SER 8 HA SER 8 -5.445 10.028 -15.493 54 HB2 SER 8 1HB SER 8 -5.096 12.349 -14.587 55 HB3 SER 8 2HB SER 8 -3.678 11.307 -14.474 56 HG SER 8 HG SER 8 -2.884 13.129 -15.330 57 H MET 9 H MET 9 -7.463 11.012 -15.498 58 HA MET 9 HA MET 9 -8.094 12.844 -17.685 59 HB2 MET 9 1HB MET 9 -8.613 10.732 -18.676 60 HB3 MET 9 2HB MET 9 -9.433 10.181 -17.222 61 HG2 MET 9 1HG MET 9 -11.292 11.518 -17.612 62 HG3 MET 9 2HG MET 9 -10.420 12.568 -18.726 63 HE1 MET 9 3HE MET 9 -9.320 10.044 -21.218 64 HE2 MET 9 1HE MET 9 -10.383 11.257 -21.932 65 HE3 MET 9 2HE MET 9 -9.255 11.716 -20.656 66 H GLN 10 H GLN 10 -9.638 14.322 -17.187 67 HA GLN 10 HA GLN 10 -10.701 14.221 -14.458 68 HB2 GLN 10 1HB GLN 10 -10.001 16.407 -16.349 69 HB3 GLN 10 2HB GLN 10 -11.316 16.703 -15.220 70 HG2 GLN 10 1HG GLN 10 -9.940 16.569 -13.372 71 HG3 GLN 10 2HG GLN 10 -8.707 15.646 -14.230 72 HE21 GLN 10 2HE2 GLN 10 -6.924 16.769 -14.464 73 HE22 GLN 10 1HE2 GLN 10 -6.815 18.459 -14.805 74 H ILE 11 H ILE 11 -12.860 14.322 -14.009 75 HA ILE 11 HA ILE 11 -14.699 14.325 -16.311 76 HB ILE 11 HB ILE 11 -16.081 12.661 -15.252 77 HG12 ILE 11 1HG1 ILE 11 -14.040 12.674 -13.018 78 HG13 ILE 11 2HG1 ILE 11 -15.682 13.298 -12.915 79 HG21 ILE 11 1HG2 ILE 11 -14.298 11.826 -16.658 80 HG22 ILE 11 2HG2 ILE 11 -13.183 11.831 -15.293 81 HG23 ILE 11 3HG2 ILE 11 -14.557 10.725 -15.306 82 HD11 ILE 11 3HD1 ILE 11 -14.724 10.642 -12.498 83 HD12 ILE 11 1HD1 ILE 11 -16.336 11.305 -12.228 84 HD13 ILE 11 2HD1 ILE 11 -15.904 10.651 -13.808 85 H PHE 12 H PHE 12 -16.978 14.822 -15.679 86 HA PHE 12 HA PHE 12 -17.000 16.880 -13.573 87 HB2 PHE 12 1HB PHE 12 -18.659 16.679 -16.094 88 HB3 PHE 12 2HB PHE 12 -18.866 17.913 -14.855 89 HD1 PHE 12 HD2 PHE 12 -16.129 18.647 -14.204 90 HD2 PHE 12 HD1 PHE 12 -17.890 17.764 -17.977 91 HE1 PHE 12 HE2 PHE 12 -14.438 20.046 -15.317 92 HE2 PHE 12 HE1 PHE 12 -16.201 19.160 -19.096 93 HZ PHE 12 HZ PHE 12 -14.473 20.305 -17.766 94 H VAL 13 H VAL 13 -18.307 16.606 -11.886 95 HA VAL 13 HA VAL 13 -20.540 14.700 -12.129 96 HB VAL 13 HB VAL 13 -18.821 14.999 -9.666 97 HG11 VAL 13 1HG1 VAL 13 -20.597 14.033 -8.717 98 HG12 VAL 13 2HG1 VAL 13 -21.325 13.641 -10.276 99 HG13 VAL 13 3HG1 VAL 13 -20.109 12.572 -9.574 100 HG21 VAL 13 3HG2 VAL 13 -18.272 12.518 -10.450 101 HG22 VAL 13 1HG2 VAL 13 -18.567 13.233 -12.035 102 HG23 VAL 13 2HG2 VAL 13 -17.320 13.904 -10.984 103 H LYS 14 H LYS 14 -22.416 15.213 -11.050 104 HA LYS 14 HA LYS 14 -22.544 17.949 -9.985 105 HB2 LYS 14 1HB LYS 14 -24.436 16.221 -11.490 106 HB3 LYS 14 2HB LYS 14 -25.130 17.314 -10.301 107 HG2 LYS 14 1HG LYS 14 -25.180 18.691 -12.092 108 HG3 LYS 14 2HG LYS 14 -23.540 19.046 -11.543 109 HD2 LYS 14 1HD LYS 14 -22.900 17.050 -13.106 110 HD3 LYS 14 2HD LYS 14 -24.455 17.401 -13.864 111 HE2 LYS 14 1HE LYS 14 -22.536 19.629 -13.351 112 HE3 LYS 14 2HE LYS 14 -22.260 18.551 -14.718 113 HZ1 LYS 14 3HZ LYS 14 -23.664 20.676 -15.040 114 HZ2 LYS 14 1HZ LYS 14 -24.908 19.776 -14.329 115 HZ3 LYS 14 2HZ LYS 14 -24.182 19.233 -15.756 116 H THR 15 H THR 15 -23.474 18.387 -8.010 117 HA THR 15 HA THR 15 -23.758 16.071 -6.229 118 HB THR 15 HB THR 15 -23.533 17.720 -4.381 119 HG1 THR 15 HG1 THR 15 -22.658 19.637 -6.245 120 HG21 THR 15 3HG2 THR 15 -21.575 16.514 -5.351 121 HG22 THR 15 1HG2 THR 15 -21.166 18.068 -4.625 122 HG23 THR 15 2HG2 THR 15 -21.279 17.916 -6.379 123 H LEU 16 H LEU 16 -25.398 16.294 -4.465 124 HA LEU 16 HA LEU 16 -27.972 16.628 -5.563 125 HB2 LEU 16 1HB LEU 16 -28.783 16.257 -3.284 126 HB3 LEU 16 2HB LEU 16 -27.556 15.082 -3.754 127 HG LEU 16 HG LEU 16 -25.958 16.758 -2.487 128 HD11 LEU 16 1HD1 LEU 16 -27.008 18.428 -1.471 129 HD12 LEU 16 2HD1 LEU 16 -27.758 17.235 -0.413 130 HD13 LEU 16 3HD1 LEU 16 -28.589 17.759 -1.877 131 HD21 LEU 16 3HD2 LEU 16 -27.786 14.714 -1.246 132 HD22 LEU 16 1HD2 LEU 16 -26.430 15.449 -0.391 133 HD23 LEU 16 2HD2 LEU 16 -26.140 14.484 -1.839 134 H THR 17 H THR 17 -25.876 18.758 -3.761 135 HA THR 17 HA THR 17 -27.859 20.684 -3.077 136 HB THR 17 HB THR 17 -25.738 20.556 -1.854 137 HG1 THR 17 HG1 THR 17 -25.722 23.066 -3.151 138 HG21 THR 17 3HG2 THR 17 -23.696 21.540 -2.939 139 HG22 THR 17 1HG2 THR 17 -24.546 21.438 -4.481 140 HG23 THR 17 2HG2 THR 17 -24.186 19.969 -3.573 141 H GLY 18 H GLY 18 -25.996 20.039 -5.924 142 HA2 GLY 18 1HA GLY 18 -26.804 20.925 -8.028 143 HA3 GLY 18 2HA GLY 18 -27.209 22.413 -7.186 144 H LYS 19 H LYS 19 -24.211 20.930 -6.393 145 HA LYS 19 HA LYS 19 -22.808 23.078 -7.824 146 HB2 LYS 19 1HB LYS 19 -22.384 23.175 -5.478 147 HB3 LYS 19 2HB LYS 19 -22.070 21.446 -5.396 148 HG2 LYS 19 1HG LYS 19 -20.330 23.055 -7.171 149 HG3 LYS 19 2HG LYS 19 -20.130 23.259 -5.429 150 HD2 LYS 19 1HD LYS 19 -20.239 20.560 -5.611 151 HD3 LYS 19 2HD LYS 19 -19.489 20.961 -7.158 152 HE2 LYS 19 1HE LYS 19 -17.568 21.625 -6.192 153 HE3 LYS 19 2HE LYS 19 -18.398 22.409 -4.849 154 HZ1 LYS 19 3HZ LYS 19 -17.799 20.699 -3.599 155 HZ2 LYS 19 1HZ LYS 19 -17.152 19.874 -4.927 156 HZ3 LYS 19 2HZ LYS 19 -18.785 19.688 -4.530 157 H THR 20 H THR 20 -21.218 22.655 -9.275 158 HA THR 20 HA THR 20 -20.980 19.892 -10.177 159 HB THR 20 HB THR 20 -19.617 22.187 -11.538 160 HG1 THR 20 HG1 THR 20 -21.466 23.047 -12.102 161 HG21 THR 20 3HG2 THR 20 -20.472 20.795 -13.535 162 HG22 THR 20 1HG2 THR 20 -20.774 19.535 -12.338 163 HG23 THR 20 2HG2 THR 20 -19.138 20.150 -12.578 164 H ILE 21 H ILE 21 -19.385 18.666 -9.441 165 HA ILE 21 HA ILE 21 -16.858 19.959 -8.653 166 HB ILE 21 HB ILE 21 -17.864 18.902 -6.750 167 HG12 ILE 21 1HG1 ILE 21 -15.330 18.466 -7.513 168 HG13 ILE 21 2HG1 ILE 21 -15.990 17.827 -6.012 169 HG21 ILE 21 1HG2 ILE 21 -19.409 17.403 -7.760 170 HG22 ILE 21 2HG2 ILE 21 -18.112 16.485 -8.525 171 HG23 ILE 21 3HG2 ILE 21 -18.315 16.433 -6.774 172 HD11 ILE 21 3HD1 ILE 21 -14.648 16.266 -7.542 173 HD12 ILE 21 1HD1 ILE 21 -16.165 15.680 -6.859 174 HD13 ILE 21 2HD1 ILE 21 -16.106 16.230 -8.534 175 H THR 22 H THR 22 -14.999 19.346 -9.595 176 HA THR 22 HA THR 22 -15.171 17.378 -11.752 177 HB THR 22 HB THR 22 -13.002 19.388 -11.115 178 HG1 THR 22 HG1 THR 22 -14.856 20.389 -11.925 179 HG21 THR 22 3HG2 THR 22 -13.053 17.080 -12.870 180 HG22 THR 22 1HG2 THR 22 -11.704 18.123 -12.423 181 HG23 THR 22 2HG2 THR 22 -12.761 18.574 -13.760 182 H LEU 23 H LEU 23 -14.422 15.387 -11.489 183 HA LEU 23 HA LEU 23 -12.502 14.881 -9.317 184 HB2 LEU 23 1HB LEU 23 -14.918 13.764 -9.614 185 HB3 LEU 23 2HB LEU 23 -13.964 12.639 -10.578 186 HG LEU 23 HG LEU 23 -12.500 12.294 -8.577 187 HD11 LEU 23 1HD1 LEU 23 -13.659 12.910 -6.384 188 HD12 LEU 23 2HD1 LEU 23 -14.579 14.069 -7.342 189 HD13 LEU 23 3HD1 LEU 23 -12.822 14.194 -7.256 190 HD21 LEU 23 3HD2 LEU 23 -13.929 10.530 -8.847 191 HD22 LEU 23 1HD2 LEU 23 -15.373 11.536 -8.726 192 HD23 LEU 23 2HD2 LEU 23 -14.466 11.117 -7.272 193 H GLU 24 H GLU 24 -10.656 13.697 -9.694 194 HA GLU 24 HA GLU 24 -9.940 13.372 -12.522 195 HB2 GLU 24 1HB GLU 24 -8.319 13.789 -10.026 196 HB3 GLU 24 2HB GLU 24 -7.578 13.160 -11.491 197 HG2 GLU 24 1HG GLU 24 -7.700 15.140 -12.574 198 HG3 GLU 24 2HG GLU 24 -9.199 15.612 -11.775 199 H VAL 25 H VAL 25 -10.040 11.393 -13.327 200 HA VAL 25 HA VAL 25 -9.089 9.137 -11.739 201 HB VAL 25 HB VAL 25 -11.562 9.263 -11.403 202 HG11 VAL 25 1HG1 VAL 25 -11.922 8.340 -14.218 203 HG12 VAL 25 2HG1 VAL 25 -13.088 9.078 -13.118 204 HG13 VAL 25 3HG1 VAL 25 -11.838 10.068 -13.873 205 HG21 VAL 25 3HG2 VAL 25 -10.953 6.807 -13.000 206 HG22 VAL 25 1HG2 VAL 25 -10.090 7.127 -11.495 207 HG23 VAL 25 2HG2 VAL 25 -11.847 6.965 -11.487 208 H GLU 26 H GLU 26 -8.319 7.408 -12.956 209 HA GLU 26 HA GLU 26 -7.413 8.065 -15.578 210 HB2 GLU 26 1HB GLU 26 -7.335 5.313 -14.359 211 HB3 GLU 26 2HB GLU 26 -6.226 6.020 -15.526 212 HG2 GLU 26 1HG GLU 26 -5.466 7.600 -13.784 213 HG3 GLU 26 2HG GLU 26 -6.506 6.773 -12.626 214 HA PRO 27 HA PRO 27 -10.601 6.434 -18.115 215 HB2 PRO 27 1HB PRO 27 -9.170 5.511 -20.229 216 HB3 PRO 27 2HB PRO 27 -9.413 7.233 -19.913 217 HG2 PRO 27 1HG PRO 27 -7.050 5.507 -19.284 218 HG3 PRO 27 2HG PRO 27 -7.090 7.151 -19.946 219 HD2 PRO 27 1HD PRO 27 -6.583 6.644 -17.335 220 HD3 PRO 27 2HD PRO 27 -7.423 8.111 -17.877 221 H SER 28 H SER 28 -8.252 4.439 -16.709 222 HA SER 28 HA SER 28 -9.590 2.001 -17.672 223 HB2 SER 28 1HB SER 28 -7.417 1.025 -16.424 224 HB3 SER 28 2HB SER 28 -7.400 1.523 -18.115 225 HG SER 28 HG SER 28 -5.790 2.705 -17.392 226 H ASP 29 H ASP 29 -9.249 4.049 -15.004 227 HA ASP 29 HA ASP 29 -9.415 2.274 -12.844 228 HB2 ASP 29 1HB ASP 29 -9.894 5.139 -13.296 229 HB3 ASP 29 2HB ASP 29 -10.840 4.449 -11.981 230 H THR 30 H THR 30 -11.444 2.301 -11.355 231 HA THR 30 HA THR 30 -13.821 1.723 -13.000 232 HB THR 30 HB THR 30 -14.380 0.003 -11.188 233 HG1 THR 30 HG1 THR 30 -11.587 -0.070 -10.761 234 HG21 THR 30 3HG2 THR 30 -13.073 -0.219 -13.589 235 HG22 THR 30 1HG2 THR 30 -13.673 -1.570 -12.628 236 HG23 THR 30 2HG2 THR 30 -11.988 -1.068 -12.489 237 H ILE 31 H ILE 31 -15.838 1.564 -11.526 238 HA ILE 31 HA ILE 31 -16.416 4.054 -10.486 239 HB ILE 31 HB ILE 31 -17.700 1.448 -9.658 240 HG12 ILE 31 1HG1 ILE 31 -17.697 1.727 -12.092 241 HG13 ILE 31 2HG1 ILE 31 -19.323 1.919 -11.447 242 HG21 ILE 31 1HG2 ILE 31 -19.658 3.330 -9.625 243 HG22 ILE 31 2HG2 ILE 31 -18.748 2.805 -8.210 244 HG23 ILE 31 3HG2 ILE 31 -18.268 4.265 -9.074 245 HD11 ILE 31 3HD1 ILE 31 -18.099 4.473 -11.516 246 HD12 ILE 31 1HD1 ILE 31 -17.845 3.693 -13.077 247 HD13 ILE 31 2HD1 ILE 31 -19.479 3.883 -12.440 248 H GLU 32 H GLU 32 -15.379 1.138 -8.747 249 HA GLU 32 HA GLU 32 -15.589 2.049 -6.145 250 HB2 GLU 32 1HB GLU 32 -13.741 0.444 -5.628 251 HB3 GLU 32 2HB GLU 32 -15.054 -0.248 -6.570 252 HG2 GLU 32 1HG GLU 32 -13.770 -0.219 -8.555 253 HG3 GLU 32 2HG GLU 32 -12.526 0.787 -7.816 254 H ASN 33 H ASN 33 -13.148 2.746 -8.556 255 HA ASN 33 HA ASN 33 -11.334 4.004 -6.723 256 HB2 ASN 33 1HB ASN 33 -11.442 3.465 -9.616 257 HB3 ASN 33 2HB ASN 33 -10.614 4.958 -9.181 258 HD21 ASN 33 2HD2 ASN 33 -9.306 4.440 -6.952 259 HD22 ASN 33 1HD2 ASN 33 -8.185 3.140 -7.153 260 H VAL 34 H VAL 34 -13.781 5.107 -9.024 261 HA VAL 34 HA VAL 34 -13.307 7.853 -8.872 262 HB VAL 34 HB VAL 34 -15.939 6.427 -9.281 263 HG11 VAL 34 1HG1 VAL 34 -16.306 8.736 -8.631 264 HG12 VAL 34 2HG1 VAL 34 -15.161 9.285 -9.856 265 HG13 VAL 34 3HG1 VAL 34 -16.674 8.520 -10.342 266 HG21 VAL 34 3HG2 VAL 34 -13.778 7.338 -11.160 267 HG22 VAL 34 1HG2 VAL 34 -14.487 5.732 -10.993 268 HG23 VAL 34 2HG2 VAL 34 -15.430 7.042 -11.702 269 H LYS 35 H LYS 35 -15.595 5.871 -6.994 270 HA LYS 35 HA LYS 35 -16.619 7.896 -5.381 271 HB2 LYS 35 1HB LYS 35 -17.202 6.082 -3.792 272 HB3 LYS 35 2HB LYS 35 -17.654 5.714 -5.452 273 HG2 LYS 35 1HG LYS 35 -15.965 4.129 -5.690 274 HG3 LYS 35 2HG LYS 35 -15.062 4.747 -4.304 275 HD2 LYS 35 1HD LYS 35 -17.794 3.792 -3.735 276 HD3 LYS 35 2HD LYS 35 -16.634 2.553 -4.223 277 HE2 LYS 35 1HE LYS 35 -16.230 4.542 -1.991 278 HE3 LYS 35 2HE LYS 35 -16.722 2.863 -1.779 279 HZ1 LYS 35 3HZ LYS 35 -14.593 2.305 -3.017 280 HZ2 LYS 35 1HZ LYS 35 -14.430 2.870 -1.431 281 HZ3 LYS 35 2HZ LYS 35 -14.126 3.906 -2.733 282 H ALA 36 H ALA 36 -13.583 6.216 -5.234 283 HA ALA 36 HA ALA 36 -12.838 6.613 -2.590 284 HB1 ALA 36 1HB ALA 36 -10.768 5.949 -3.226 285 HB2 ALA 36 2HB ALA 36 -11.636 5.484 -4.690 286 HB3 ALA 36 3HB ALA 36 -10.741 7.004 -4.640 287 H LYS 37 H LYS 37 -12.464 8.794 -5.367 288 HA LYS 37 HA LYS 37 -11.232 10.863 -3.813 289 HB2 LYS 37 1HB LYS 37 -11.001 10.437 -6.340 290 HB3 LYS 37 2HB LYS 37 -12.553 11.250 -6.490 291 HG2 LYS 37 1HG LYS 37 -11.036 12.949 -6.871 292 HG3 LYS 37 2HG LYS 37 -11.431 13.155 -5.163 293 HD2 LYS 37 1HD LYS 37 -9.130 13.304 -5.124 294 HD3 LYS 37 2HD LYS 37 -9.374 11.587 -4.796 295 HE2 LYS 37 1HE LYS 37 -9.024 11.103 -7.182 296 HE3 LYS 37 2HE LYS 37 -8.736 12.817 -7.476 297 HZ1 LYS 37 3HZ LYS 37 -7.033 10.854 -6.120 298 HZ2 LYS 37 1HZ LYS 37 -6.949 12.469 -5.624 299 HZ3 LYS 37 2HZ LYS 37 -6.613 12.059 -7.230 300 H ILE 38 H ILE 38 -14.485 10.019 -4.731 301 HA ILE 38 HA ILE 38 -15.759 12.475 -4.293 302 HB ILE 38 HB ILE 38 -16.846 9.689 -3.874 303 HG12 ILE 38 1HG1 ILE 38 -16.053 10.070 -6.155 304 HG13 ILE 38 2HG1 ILE 38 -17.812 9.995 -6.122 305 HG21 ILE 38 1HG2 ILE 38 -18.427 10.936 -2.794 306 HG22 ILE 38 2HG2 ILE 38 -18.094 12.383 -3.745 307 HG23 ILE 38 3HG2 ILE 38 -19.024 11.061 -4.449 308 HD11 ILE 38 3HD1 ILE 38 -16.044 12.382 -6.493 309 HD12 ILE 38 1HD1 ILE 38 -17.316 11.766 -7.549 310 HD13 ILE 38 2HD1 ILE 38 -17.736 12.542 -6.021 311 H GLN 39 H GLN 39 -14.620 10.034 -2.076 312 HA GLN 39 HA GLN 39 -16.076 10.636 0.203 313 HB2 GLN 39 1HB GLN 39 -13.284 9.621 -0.220 314 HB3 GLN 39 2HB GLN 39 -13.881 9.937 1.404 315 HG2 GLN 39 1HG GLN 39 -15.898 8.451 0.552 316 HG3 GLN 39 2HG GLN 39 -14.652 7.827 -0.528 317 HE21 GLN 39 2HE2 GLN 39 -16.170 7.011 2.100 318 HE22 GLN 39 1HE2 GLN 39 -14.914 6.267 3.024 319 H ASP 40 H ASP 40 -13.356 12.316 -1.228 320 HA ASP 40 HA ASP 40 -12.949 14.061 1.018 321 HB2 ASP 40 1HB ASP 40 -11.173 13.410 -0.665 322 HB3 ASP 40 2HB ASP 40 -11.980 14.476 -1.812 323 H LYS 41 H LYS 41 -14.987 14.016 -1.758 324 HA LYS 41 HA LYS 41 -15.518 16.853 -1.751 325 HB2 LYS 41 1HB LYS 41 -17.146 14.727 -3.134 326 HB3 LYS 41 2HB LYS 41 -17.007 16.429 -3.555 327 HG2 LYS 41 1HG LYS 41 -14.742 14.453 -3.718 328 HG3 LYS 41 2HG LYS 41 -15.779 14.902 -5.075 329 HD2 LYS 41 1HD LYS 41 -14.079 16.381 -5.415 330 HD3 LYS 41 2HD LYS 41 -15.068 17.345 -4.315 331 HE2 LYS 41 1HE LYS 41 -13.645 17.003 -2.529 332 HE3 LYS 41 2HE LYS 41 -12.982 15.517 -3.207 333 HZ1 LYS 41 3HZ LYS 41 -11.475 16.640 -4.430 334 HZ2 LYS 41 1HZ LYS 41 -11.685 17.822 -3.237 335 HZ3 LYS 41 2HZ LYS 41 -12.496 17.958 -4.714 336 H GLU 42 H GLU 42 -17.355 13.916 -0.926 337 HA GLU 42 HA GLU 42 -19.081 15.596 0.772 338 HB2 GLU 42 1HB GLU 42 -19.801 13.200 -0.913 339 HB3 GLU 42 2HB GLU 42 -20.846 13.818 0.360 340 HG2 GLU 42 1HG GLU 42 -19.963 15.279 -2.117 341 HG3 GLU 42 2HG GLU 42 -21.576 14.661 -1.766 342 H GLY 43 H GLY 43 -17.421 12.523 0.376 343 HA2 GLY 43 1HA GLY 43 -16.551 11.111 1.979 344 HA3 GLY 43 2HA GLY 43 -17.055 12.267 3.202 345 H ILE 44 H ILE 44 -18.410 9.847 0.973 346 HA ILE 44 HA ILE 44 -20.289 9.092 3.114 347 HB ILE 44 HB ILE 44 -21.811 8.346 1.189 348 HG12 ILE 44 1HG1 ILE 44 -20.271 10.439 -0.343 349 HG13 ILE 44 2HG1 ILE 44 -19.945 8.718 -0.517 350 HG21 ILE 44 1HG2 ILE 44 -21.574 11.315 1.243 351 HG22 ILE 44 2HG2 ILE 44 -23.007 10.296 1.368 352 HG23 ILE 44 3HG2 ILE 44 -21.916 10.455 2.744 353 HD11 ILE 44 3HD1 ILE 44 -22.344 8.422 -1.150 354 HD12 ILE 44 1HD1 ILE 44 -22.483 10.179 -1.180 355 HD13 ILE 44 2HD1 ILE 44 -21.379 9.363 -2.287 356 HA PRO 45 HA PRO 45 -18.777 4.984 2.749 357 HB2 PRO 45 1HB PRO 45 -20.992 3.571 3.432 358 HB3 PRO 45 2HB PRO 45 -20.041 4.492 4.603 359 HG2 PRO 45 1HG PRO 45 -22.591 5.242 3.226 360 HG3 PRO 45 2HG PRO 45 -22.129 5.463 4.924 361 HD2 PRO 45 1HD PRO 45 -22.015 7.470 3.110 362 HD3 PRO 45 2HD PRO 45 -20.881 7.347 4.470 363 HA PRO 46 HA PRO 46 -19.800 3.175 -1.127 364 HB2 PRO 46 1HB PRO 46 -19.554 0.519 -0.625 365 HB3 PRO 46 2HB PRO 46 -18.167 1.610 -0.726 366 HG2 PRO 46 1HG PRO 46 -19.581 0.563 1.696 367 HG3 PRO 46 2HG PRO 46 -17.840 0.735 1.404 368 HD2 PRO 46 1HD PRO 46 -19.252 2.512 2.881 369 HD3 PRO 46 2HD PRO 46 -17.853 2.987 1.897 370 H ASP 47 H ASP 47 -21.522 1.894 1.670 371 HA ASP 47 HA ASP 47 -23.529 0.500 0.257 372 HB2 ASP 47 1HB ASP 47 -23.796 1.775 2.985 373 HB3 ASP 47 2HB ASP 47 -24.727 0.423 2.347 374 H GLN 48 H GLN 48 -23.252 3.838 1.339 375 HA GLN 48 HA GLN 48 -25.923 4.464 0.363 376 HB2 GLN 48 1HB GLN 48 -23.831 6.009 1.870 377 HB3 GLN 48 2HB GLN 48 -25.206 6.824 1.137 378 HG2 GLN 48 1HG GLN 48 -25.617 6.367 3.479 379 HG3 GLN 48 2HG GLN 48 -26.731 5.459 2.457 380 HE21 GLN 48 2HE2 GLN 48 -26.551 3.232 2.333 381 HE22 GLN 48 1HE2 GLN 48 -25.615 2.314 3.459 382 H GLN 49 H GLN 49 -22.619 4.698 -0.622 383 HA GLN 49 HA GLN 49 -22.834 6.790 -2.495 384 HB2 GLN 49 1HB GLN 49 -20.926 4.565 -1.996 385 HB3 GLN 49 2HB GLN 49 -20.869 5.335 -3.576 386 HG2 GLN 49 1HG GLN 49 -20.353 7.440 -2.638 387 HG3 GLN 49 2HG GLN 49 -20.731 6.883 -1.008 388 HE21 GLN 49 2HE2 GLN 49 -18.315 8.116 -1.810 389 HE22 GLN 49 1HE2 GLN 49 -17.039 6.973 -1.586 390 H ARG 50 H ARG 50 -23.697 6.889 -4.468 391 HA ARG 50 HA ARG 50 -24.047 4.504 -6.073 392 HB2 ARG 50 1HB ARG 50 -26.264 5.803 -4.635 393 HB3 ARG 50 2HB ARG 50 -26.561 5.531 -6.347 394 HG2 ARG 50 1HG ARG 50 -25.728 3.415 -4.373 395 HG3 ARG 50 2HG ARG 50 -27.374 3.691 -4.947 396 HD2 ARG 50 1HD ARG 50 -26.408 3.371 -7.295 397 HD3 ARG 50 2HD ARG 50 -24.989 2.710 -6.485 398 HE ARG 50 HE ARG 50 -27.345 1.451 -5.550 399 HH11 ARG 50 1HH1 ARG 50 -25.200 1.576 -8.289 400 HH12 ARG 50 2HH1 ARG 50 -25.542 -0.045 -8.796 401 HH21 ARG 50 1HH2 ARG 50 -27.804 -0.685 -6.208 402 HH22 ARG 50 2HH2 ARG 50 -27.024 -1.329 -7.613 403 H LEU 51 H LEU 51 -23.264 5.108 -7.974 404 HA LEU 51 HA LEU 51 -23.514 7.888 -8.833 405 HB2 LEU 51 1HB LEU 51 -21.889 5.574 -9.864 406 HB3 LEU 51 2HB LEU 51 -21.957 7.144 -10.663 407 HG LEU 51 HG LEU 51 -19.948 7.107 -9.421 408 HD11 LEU 51 1HD1 LEU 51 -21.716 9.065 -9.119 409 HD12 LEU 51 2HD1 LEU 51 -20.154 9.071 -8.301 410 HD13 LEU 51 3HD1 LEU 51 -21.602 8.556 -7.434 411 HD21 LEU 51 3HD2 LEU 51 -21.267 5.320 -7.768 412 HD22 LEU 51 1HD2 LEU 51 -20.987 6.728 -6.743 413 HD23 LEU 51 2HD2 LEU 51 -19.630 5.942 -7.550 414 H ILE 52 H ILE 52 -24.583 8.534 -10.655 415 HA ILE 52 HA ILE 52 -26.179 6.471 -12.030 416 HB ILE 52 HB ILE 52 -26.983 9.360 -11.745 417 HG12 ILE 52 1HG1 ILE 52 -26.858 8.448 -9.504 418 HG13 ILE 52 2HG1 ILE 52 -28.549 8.575 -9.976 419 HG21 ILE 52 1HG2 ILE 52 -27.990 8.090 -13.588 420 HG22 ILE 52 2HG2 ILE 52 -28.570 6.891 -12.433 421 HG23 ILE 52 3HG2 ILE 52 -29.183 8.543 -12.371 422 HD11 ILE 52 3HD1 ILE 52 -27.118 6.303 -9.067 423 HD12 ILE 52 1HD1 ILE 52 -28.826 6.442 -9.484 424 HD13 ILE 52 2HD1 ILE 52 -27.649 6.004 -10.722 425 H PHE 53 H PHE 53 -26.346 6.544 -14.243 426 HA PHE 53 HA PHE 53 -24.997 8.706 -15.675 427 HB2 PHE 53 1HB PHE 53 -23.296 6.956 -15.350 428 HB3 PHE 53 2HB PHE 53 -24.366 5.778 -16.103 429 HD1 PHE 53 HD2 PHE 53 -22.563 8.956 -16.755 430 HD2 PHE 53 HD1 PHE 53 -24.331 5.453 -18.403 431 HE1 PHE 53 HE2 PHE 53 -21.635 9.530 -18.960 432 HE2 PHE 53 HE1 PHE 53 -23.405 6.020 -20.611 433 HZ PHE 53 HZ PHE 53 -22.056 8.061 -20.892 434 H ALA 54 H ALA 54 -26.504 9.460 -17.002 435 HA ALA 54 HA ALA 54 -28.217 9.576 -18.498 436 HB1 ALA 54 1HB ALA 54 -27.534 6.816 -19.432 437 HB2 ALA 54 2HB ALA 54 -28.062 8.215 -20.369 438 HB3 ALA 54 3HB ALA 54 -26.426 8.160 -19.712 439 H GLY 55 H GLY 55 -28.785 8.485 -15.867 440 HA2 GLY 55 1HA GLY 55 -30.850 7.883 -14.940 441 HA3 GLY 55 2HA GLY 55 -31.351 7.271 -16.509 442 H LYS 56 H LYS 56 -28.517 5.900 -16.377 443 HA LYS 56 HA LYS 56 -29.554 3.480 -15.087 444 HB2 LYS 56 1HB LYS 56 -28.864 3.228 -17.410 445 HB3 LYS 56 2HB LYS 56 -27.270 3.868 -17.031 446 HG2 LYS 56 1HG LYS 56 -27.005 1.542 -17.173 447 HG3 LYS 56 2HG LYS 56 -27.010 1.911 -15.446 448 HD2 LYS 56 1HD LYS 56 -28.436 0.106 -15.519 449 HD3 LYS 56 2HD LYS 56 -29.578 1.445 -15.661 450 HE2 LYS 56 1HE LYS 56 -29.857 1.108 -17.963 451 HE3 LYS 56 2HE LYS 56 -28.402 0.121 -18.084 452 HZ1 LYS 56 3HZ LYS 56 -30.720 -0.999 -18.084 453 HZ2 LYS 56 1HZ LYS 56 -30.636 -0.794 -16.407 454 HZ3 LYS 56 2HZ LYS 56 -29.457 -1.704 -17.207 455 H GLN 57 H GLN 57 -28.779 2.821 -13.196 456 HA GLN 57 HA GLN 57 -26.848 4.280 -11.757 457 HB2 GLN 57 1HB GLN 57 -27.793 1.458 -11.231 458 HB3 GLN 57 2HB GLN 57 -27.032 2.539 -10.071 459 HG2 GLN 57 1HG GLN 57 -28.915 3.950 -9.997 460 HG3 GLN 57 2HG GLN 57 -29.627 3.200 -11.425 461 HE21 GLN 57 2HE2 GLN 57 -30.559 3.574 -8.598 462 HE22 GLN 57 1HE2 GLN 57 -31.051 1.998 -8.092 463 H LEU 58 H LEU 58 -24.756 3.659 -11.050 464 HA LEU 58 HA LEU 58 -23.382 1.856 -12.930 465 HB2 LEU 58 1HB LEU 58 -22.110 4.045 -11.307 466 HB3 LEU 58 2HB LEU 58 -21.413 3.157 -12.659 467 HG LEU 58 HG LEU 58 -23.702 5.112 -12.868 468 HD11 LEU 58 1HD1 LEU 58 -21.407 6.034 -12.250 469 HD12 LEU 58 2HD1 LEU 58 -22.191 6.705 -13.680 470 HD13 LEU 58 3HD1 LEU 58 -20.898 5.518 -13.858 471 HD21 LEU 58 3HD2 LEU 58 -24.041 4.214 -14.868 472 HD22 LEU 58 1HD2 LEU 58 -22.693 3.099 -14.639 473 HD23 LEU 58 2HD2 LEU 58 -22.408 4.698 -15.328 474 H GLU 59 H GLU 59 -21.517 0.676 -12.075 475 HA GLU 59 HA GLU 59 -21.342 0.334 -9.208 476 HB2 GLU 59 1HB GLU 59 -21.730 -2.140 -9.366 477 HB3 GLU 59 2HB GLU 59 -23.167 -1.156 -9.606 478 HG2 GLU 59 1HG GLU 59 -22.929 -1.431 -12.034 479 HG3 GLU 59 2HG GLU 59 -21.526 -2.464 -11.764 480 H ASP 60 H ASP 60 -19.647 -1.316 -8.642 481 HA ASP 60 HA ASP 60 -17.262 -0.747 -10.019 482 HB2 ASP 60 1HB ASP 60 -17.629 -3.133 -8.216 483 HB3 ASP 60 2HB ASP 60 -16.182 -2.159 -8.461 484 H GLY 61 H GLY 61 -15.750 -2.685 -10.658 485 HA2 GLY 61 1HA GLY 61 -15.572 -4.794 -11.779 486 HA3 GLY 61 2HA GLY 61 -17.253 -4.635 -12.267 487 H ARG 62 H ARG 62 -17.478 -2.310 -13.490 488 HA ARG 62 HA ARG 62 -15.722 -2.616 -15.806 489 HB2 ARG 62 1HB ARG 62 -18.448 -1.514 -15.351 490 HB3 ARG 62 2HB ARG 62 -17.499 -0.812 -16.654 491 HG2 ARG 62 1HG ARG 62 -18.891 -2.556 -17.534 492 HG3 ARG 62 2HG ARG 62 -17.204 -3.069 -17.609 493 HD2 ARG 62 1HD ARG 62 -17.459 -4.556 -15.818 494 HD3 ARG 62 2HD ARG 62 -18.961 -3.798 -15.290 495 HE ARG 62 HE ARG 62 -19.382 -4.801 -17.852 496 HH11 ARG 62 1HH1 ARG 62 -18.676 -5.998 -14.660 497 HH12 ARG 62 2HH1 ARG 62 -19.480 -7.512 -14.908 498 HH21 ARG 62 1HH2 ARG 62 -20.444 -6.791 -18.191 499 HH22 ARG 62 2HH2 ARG 62 -20.485 -7.963 -16.917 500 H THR 63 H THR 63 -15.154 -0.536 -16.974 501 HA THR 63 HA THR 63 -14.081 1.357 -15.000 502 HB THR 63 HB THR 63 -12.311 0.455 -16.287 503 HG1 THR 63 HG1 THR 63 -11.880 2.583 -16.197 504 HG21 THR 63 3HG2 THR 63 -14.252 0.663 -18.509 505 HG22 THR 63 1HG2 THR 63 -13.045 -0.577 -18.171 506 HG23 THR 63 2HG2 THR 63 -12.560 0.946 -18.917 507 H LEU 64 H LEU 64 -14.026 3.640 -15.563 508 HA LEU 64 HA LEU 64 -16.519 4.665 -16.261 509 HB2 LEU 64 1HB LEU 64 -13.861 6.078 -16.424 510 HB3 LEU 64 2HB LEU 64 -15.446 6.843 -16.318 511 HG LEU 64 HG LEU 64 -14.850 7.040 -14.146 512 HD11 LEU 64 1HD1 LEU 64 -16.771 5.375 -14.358 513 HD12 LEU 64 2HD1 LEU 64 -15.932 5.454 -12.809 514 HD13 LEU 64 3HD1 LEU 64 -15.587 4.139 -13.933 515 HD21 LEU 64 3HD2 LEU 64 -12.782 6.356 -13.688 516 HD22 LEU 64 1HD2 LEU 64 -12.864 5.069 -14.891 517 HD23 LEU 64 2HD2 LEU 64 -13.484 4.794 -13.263 518 H SER 65 H SER 65 -13.651 4.106 -18.222 519 HA SER 65 HA SER 65 -14.492 5.490 -20.526 520 HB2 SER 65 1HB SER 65 -12.184 4.887 -20.344 521 HB3 SER 65 2HB SER 65 -12.580 3.180 -20.150 522 HG SER 65 HG SER 65 -12.007 3.406 -22.252 523 H GLU 66 H GLU 66 -15.042 2.202 -19.400 524 HA GLU 66 HA GLU 66 -16.284 1.314 -21.819 525 HB2 GLU 66 1HB GLU 66 -16.119 0.194 -19.030 526 HB3 GLU 66 2HB GLU 66 -17.091 -0.578 -20.276 527 HG2 GLU 66 1HG GLU 66 -14.232 0.049 -20.831 528 HG3 GLU 66 2HG GLU 66 -14.641 -1.347 -19.835 529 H TYR 67 H TYR 67 -17.312 3.122 -19.101 530 HA TYR 67 HA TYR 67 -20.130 2.512 -19.493 531 HB2 TYR 67 1HB TYR 67 -18.542 4.017 -17.465 532 HB3 TYR 67 2HB TYR 67 -20.237 4.444 -17.675 533 HD1 TYR 67 HD1 TYR 67 -21.715 2.094 -17.967 534 HD2 TYR 67 HD2 TYR 67 -18.188 2.649 -15.653 535 HE1 TYR 67 HE1 TYR 67 -22.371 0.212 -16.526 536 HE2 TYR 67 HE2 TYR 67 -18.834 0.768 -14.206 537 HH TYR 67 HH TYR 67 -20.218 -1.102 -14.125 538 H ASN 68 H ASN 68 -18.198 4.114 -21.345 539 HA ASN 68 HA ASN 68 -18.424 5.783 -22.874 540 HB2 ASN 68 1HB ASN 68 -20.846 4.769 -22.815 541 HB3 ASN 68 2HB ASN 68 -21.250 6.285 -22.013 542 HD21 ASN 68 2HD2 ASN 68 -21.439 8.103 -23.190 543 HD22 ASN 68 1HD2 ASN 68 -21.205 8.188 -24.900 544 H ILE 69 H ILE 69 -17.792 6.285 -19.987 545 HA ILE 69 HA ILE 69 -18.743 9.015 -19.606 546 HB ILE 69 HB ILE 69 -16.956 7.331 -17.846 547 HG12 ILE 69 1HG1 ILE 69 -19.850 8.060 -17.393 548 HG13 ILE 69 2HG1 ILE 69 -19.361 6.565 -18.182 549 HG21 ILE 69 1HG2 ILE 69 -16.587 9.715 -17.525 550 HG22 ILE 69 2HG2 ILE 69 -18.319 9.967 -17.311 551 HG23 ILE 69 3HG2 ILE 69 -17.413 9.020 -16.131 552 HD11 ILE 69 3HD1 ILE 69 -18.423 7.351 -15.441 553 HD12 ILE 69 1HD1 ILE 69 -19.878 6.399 -15.734 554 HD13 ILE 69 2HD1 ILE 69 -18.302 5.776 -16.224 555 H GLN 70 H GLN 70 -17.696 10.386 -20.944 556 HA GLN 70 HA GLN 70 -14.875 10.129 -21.478 557 HB2 GLN 70 1HB GLN 70 -16.669 12.447 -22.192 558 HB3 GLN 70 2HB GLN 70 -15.144 12.001 -22.946 559 HG2 GLN 70 1HG GLN 70 -16.127 10.017 -23.881 560 HG3 GLN 70 2HG GLN 70 -17.636 10.318 -23.020 561 HE21 GLN 70 2HE2 GLN 70 -19.174 11.322 -24.097 562 HE22 GLN 70 1HE2 GLN 70 -18.960 12.277 -25.521 563 H LYS 71 H LYS 71 -13.933 12.678 -21.523 564 HA LYS 71 HA LYS 71 -13.429 13.154 -18.728 565 HB2 LYS 71 1HB LYS 71 -11.821 14.812 -19.504 566 HB3 LYS 71 2HB LYS 71 -11.626 13.308 -20.394 567 HG2 LYS 71 1HG LYS 71 -13.454 15.162 -21.691 568 HG3 LYS 71 2HG LYS 71 -11.828 15.817 -21.484 569 HD2 LYS 71 1HD LYS 71 -11.140 13.427 -22.385 570 HD3 LYS 71 2HD LYS 71 -12.756 13.489 -23.090 571 HE2 LYS 71 1HE LYS 71 -11.534 14.441 -24.777 572 HE3 LYS 71 2HE LYS 71 -11.974 15.879 -23.857 573 HZ1 LYS 71 3HZ LYS 71 -9.522 14.606 -23.010 574 HZ2 LYS 71 1HZ LYS 71 -9.861 16.243 -23.266 575 HZ3 LYS 71 2HZ LYS 71 -9.471 15.246 -24.575 576 H GLU 72 H GLU 72 -15.836 14.107 -20.790 577 HA GLU 72 HA GLU 72 -16.377 16.504 -19.171 578 HB2 GLU 72 1HB GLU 72 -16.761 16.154 -22.145 579 HB3 GLU 72 2HB GLU 72 -17.492 17.461 -21.224 580 HG2 GLU 72 1HG GLU 72 -15.014 17.872 -20.459 581 HG3 GLU 72 2HG GLU 72 -14.646 17.011 -21.952 582 H SER 73 H SER 73 -17.267 13.628 -19.097 583 HA SER 73 HA SER 73 -20.018 13.605 -19.879 584 HB2 SER 73 1HB SER 73 -19.311 11.438 -19.796 585 HB3 SER 73 2HB SER 73 -18.155 11.754 -18.502 586 HG SER 73 HG SER 73 -20.127 10.447 -18.015 587 H THR 74 H THR 74 -21.819 13.323 -18.381 588 HA THR 74 HA THR 74 -21.486 15.026 -16.006 589 HB THR 74 HB THR 74 -24.210 14.367 -16.988 590 HG1 THR 74 HG1 THR 74 -24.028 15.966 -18.629 591 HG21 THR 74 3HG2 THR 74 -24.522 16.796 -16.466 592 HG22 THR 74 1HG2 THR 74 -22.839 16.844 -15.943 593 HG23 THR 74 2HG2 THR 74 -23.997 15.822 -15.093 594 H LEU 75 H LEU 75 -21.461 14.028 -14.111 595 HA LEU 75 HA LEU 75 -22.818 11.429 -13.861 596 HB2 LEU 75 1HB LEU 75 -20.286 12.504 -12.848 597 HB3 LEU 75 2HB LEU 75 -21.235 11.625 -11.651 598 HG LEU 75 HG LEU 75 -19.549 10.215 -12.760 599 HD11 LEU 75 1HD1 LEU 75 -22.445 9.675 -12.801 600 HD12 LEU 75 2HD1 LEU 75 -21.133 8.792 -12.024 601 HD13 LEU 75 3HD1 LEU 75 -21.440 8.577 -13.747 602 HD21 LEU 75 3HD2 LEU 75 -19.610 11.371 -14.948 603 HD22 LEU 75 1HD2 LEU 75 -21.186 10.641 -15.256 604 HD23 LEU 75 2HD2 LEU 75 -19.759 9.618 -15.084 605 H HIS 76 H HIS 76 -23.952 10.961 -11.900 606 HA HIS 76 HA HIS 76 -24.756 13.326 -10.347 607 HB2 HIS 76 1HB HIS 76 -26.485 11.376 -11.812 608 HB3 HIS 76 2HB HIS 76 -27.073 12.058 -10.298 609 HD1 HIS 76 HD1 HIS 76 -26.333 14.942 -10.481 610 HD2 HIS 76 HD2 HIS 76 -27.697 12.791 -13.764 611 HE1 HIS 76 HE1 HIS 76 -27.236 16.658 -12.081 612 H LEU 77 H LEU 77 -24.817 13.037 -8.196 613 HA LEU 77 HA LEU 77 -24.262 10.337 -7.187 614 HB2 LEU 77 1HB LEU 77 -24.046 12.800 -5.516 615 HB3 LEU 77 2HB LEU 77 -23.158 11.283 -5.392 616 HG LEU 77 HG LEU 77 -22.742 13.303 -7.592 617 HD11 LEU 77 1HD1 LEU 77 -20.492 13.380 -6.083 618 HD12 LEU 77 2HD1 LEU 77 -21.729 13.192 -4.841 619 HD13 LEU 77 3HD1 LEU 77 -21.813 14.544 -5.971 620 HD21 LEU 77 3HD2 LEU 77 -21.959 11.269 -8.386 621 HD22 LEU 77 1HD2 LEU 77 -21.424 10.737 -6.792 622 HD23 LEU 77 2HD2 LEU 77 -20.521 11.982 -7.654 623 H VAL 78 H VAL 78 -25.943 9.261 -6.412 624 HA VAL 78 HA VAL 78 -28.118 10.776 -5.122 625 HB VAL 78 HB VAL 78 -29.502 8.695 -5.609 626 HG11 VAL 78 1HG1 VAL 78 -28.949 9.620 -8.279 627 HG12 VAL 78 2HG1 VAL 78 -30.355 9.923 -7.255 628 HG13 VAL 78 3HG1 VAL 78 -28.936 10.965 -7.139 629 HG21 VAL 78 3HG2 VAL 78 -27.709 7.147 -6.089 630 HG22 VAL 78 1HG2 VAL 78 -28.727 7.329 -7.517 631 HG23 VAL 78 2HG2 VAL 78 -27.166 8.146 -7.437 632 H LEU 79 H LEU 79 -28.281 10.534 -3.000 633 HA LEU 79 HA LEU 79 -27.102 8.141 -1.758 634 HB2 LEU 79 1HB LEU 79 -27.477 10.956 -0.813 635 HB3 LEU 79 2HB LEU 79 -27.279 9.642 0.344 636 HG LEU 79 HG LEU 79 -25.169 10.757 0.000 637 HD11 LEU 79 1HD1 LEU 79 -25.627 7.995 -0.422 638 HD12 LEU 79 2HD1 LEU 79 -24.199 8.783 0.249 639 HD13 LEU 79 3HD1 LEU 79 -24.313 8.494 -1.487 640 HD21 LEU 79 3HD2 LEU 79 -25.920 11.398 -2.435 641 HD22 LEU 79 1HD2 LEU 79 -25.054 9.920 -2.856 642 HD23 LEU 79 2HD2 LEU 79 -24.212 11.230 -2.027 643 H ARG 80 H ARG 80 -28.292 6.859 -0.430 644 HA ARG 80 HA ARG 80 -31.176 7.346 -0.404 645 HB2 ARG 80 1HB ARG 80 -30.275 5.162 -1.222 646 HB3 ARG 80 2HB ARG 80 -29.670 4.853 0.400 647 HG2 ARG 80 1HG ARG 80 -31.746 4.446 1.250 648 HG3 ARG 80 2HG ARG 80 -32.550 5.497 0.082 649 HD2 ARG 80 1HD ARG 80 -32.475 3.880 -1.601 650 HD3 ARG 80 2HD ARG 80 -31.220 2.954 -0.780 651 HE ARG 80 HE ARG 80 -34.045 2.737 -0.401 652 HH11 ARG 80 1HH1 ARG 80 -30.953 2.377 1.159 653 HH12 ARG 80 2HH1 ARG 80 -31.525 1.221 2.315 654 HH21 ARG 80 1HH2 ARG 80 -34.809 1.215 1.117 655 HH22 ARG 80 2HH2 ARG 80 -33.718 0.560 2.290 656 H LEU 81 H LEU 81 -28.858 5.930 1.912 657 HA LEU 81 HA LEU 81 -30.409 7.151 4.085 658 HB2 LEU 81 1HB LEU 81 -28.402 4.903 4.133 659 HB3 LEU 81 2HB LEU 81 -29.244 5.538 5.545 660 HG LEU 81 HG LEU 81 -30.414 3.997 3.237 661 HD11 LEU 81 1HD1 LEU 81 -29.438 2.552 4.837 662 HD12 LEU 81 2HD1 LEU 81 -31.174 2.540 5.144 663 HD13 LEU 81 3HD1 LEU 81 -30.102 3.478 6.183 664 HD21 LEU 81 3HD2 LEU 81 -32.041 5.637 3.647 665 HD22 LEU 81 1HD2 LEU 81 -31.763 5.600 5.389 666 HD23 LEU 81 2HD2 LEU 81 -32.559 4.241 4.594 667 H ARG 82 H ARG 82 -28.753 7.362 6.119 668 HA ARG 82 HA ARG 82 -27.136 9.610 5.455 669 HB2 ARG 82 1HB ARG 82 -28.310 9.385 7.617 670 HB3 ARG 82 2HB ARG 82 -27.261 8.036 8.033 671 HG2 ARG 82 1HG ARG 82 -25.424 9.386 8.360 672 HG3 ARG 82 2HG ARG 82 -26.061 10.676 7.337 673 HD2 ARG 82 1HD ARG 82 -27.629 11.331 8.999 674 HD3 ARG 82 2HD ARG 82 -27.302 9.892 9.964 675 HE ARG 82 HE ARG 82 -24.899 11.097 9.888 676 HH11 ARG 82 1HH1 ARG 82 -28.089 12.262 10.650 677 HH12 ARG 82 2HH1 ARG 82 -27.526 13.465 11.762 678 HH21 ARG 82 1HH2 ARG 82 -24.145 12.676 11.350 679 HH22 ARG 82 2HH2 ARG 82 -25.282 13.701 12.159 680 H GLY 83 H GLY 83 -24.860 9.844 5.751 681 HA2 GLY 83 1HA GLY 83 -23.404 7.328 5.243 682 HA3 GLY 83 2HA GLY 83 -22.901 8.912 4.671 683 H TYR 84 H TYR 84 -21.475 6.879 6.285 684 HA TYR 84 HA TYR 84 -20.171 8.627 8.071 685 HB2 TYR 84 1HB TYR 84 -20.832 7.803 10.205 686 HB3 TYR 84 2HB TYR 84 -22.317 8.175 9.336 687 HD1 TYR 84 HD1 TYR 84 -20.177 5.475 10.616 688 HD2 TYR 84 HD2 TYR 84 -23.848 6.430 8.689 689 HE1 TYR 84 HE1 TYR 84 -20.981 3.188 11.028 690 HE2 TYR 84 HE2 TYR 84 -24.663 4.145 9.097 691 HH TYR 84 HH TYR 84 -24.035 2.272 10.959 692 H ALA 85 H ALA 85 -18.228 7.801 8.752 693 HA ALA 85 HA ALA 85 -17.630 5.025 8.846 694 HB1 ALA 85 1HB ALA 85 -16.414 4.662 6.911 695 HB2 ALA 85 2HB ALA 85 -17.779 5.616 6.329 696 HB3 ALA 85 3HB ALA 85 -16.213 6.385 6.590 697 H ASP 86 H ASP 86 -15.324 4.622 9.289 698 HA ASP 86 HA ASP 86 -13.891 7.009 10.232 699 HB2 ASP 86 1HB ASP 86 -13.878 4.457 11.823 700 HB3 ASP 86 2HB ASP 86 -13.431 6.081 12.339 701 H LEU 87 H LEU 87 -11.615 5.987 11.162 702 HA LEU 87 HA LEU 87 -10.334 5.018 8.767 703 HB2 LEU 87 1HB LEU 87 -9.167 5.567 11.491 704 HB3 LEU 87 2HB LEU 87 -8.260 5.302 10.004 705 HG LEU 87 HG LEU 87 -10.056 7.654 10.593 706 HD11 LEU 87 1HD1 LEU 87 -7.711 7.360 11.712 707 HD12 LEU 87 2HD1 LEU 87 -8.182 8.909 11.015 708 HD13 LEU 87 3HD1 LEU 87 -7.119 7.826 10.117 709 HD21 LEU 87 3HD2 LEU 87 -10.183 7.278 8.271 710 HD22 LEU 87 1HD2 LEU 87 -8.471 6.867 8.163 711 HD23 LEU 87 2HD2 LEU 87 -8.960 8.532 8.479 712 H ARG 88 H ARG 88 -8.426 3.355 9.331 713 HA ARG 88 HA ARG 88 -8.953 1.297 11.182 714 HB2 ARG 88 1HB ARG 88 -10.868 0.996 9.537 715 HB3 ARG 88 2HB ARG 88 -9.655 0.534 8.351 716 HG2 ARG 88 1HG ARG 88 -8.965 -1.327 9.765 717 HG3 ARG 88 2HG ARG 88 -10.162 -0.856 10.973 718 HD2 ARG 88 1HD ARG 88 -11.959 -1.286 9.420 719 HD3 ARG 88 2HD ARG 88 -10.806 -1.622 8.130 720 HE ARG 88 HE ARG 88 -10.247 -3.377 10.209 721 HH11 ARG 88 1HH1 ARG 88 -12.858 -2.706 8.006 722 HH12 ARG 88 2HH1 ARG 88 -13.436 -4.339 7.988 723 HH21 ARG 88 1HH2 ARG 88 -10.999 -5.530 10.195 724 HH22 ARG 88 2HH2 ARG 88 -12.379 -5.944 9.234 725 H GLU 89 H GLU 89 -7.140 0.142 11.456 726 HA GLU 89 HA GLU 89 -4.984 0.528 9.518 727 HB2 GLU 89 1HB GLU 89 -4.807 0.941 12.084 728 HB3 GLU 89 2HB GLU 89 -4.649 -0.807 12.183 729 HG2 GLU 89 1HG GLU 89 -2.462 0.052 12.153 730 HG3 GLU 89 2HG GLU 89 -2.748 -0.616 10.547 731 H ASP 90 H ASP 90 -3.755 -1.200 8.707 732 HA ASP 90 HA ASP 90 -4.788 -3.903 9.142 733 HB2 ASP 90 1HB ASP 90 -5.280 -4.348 6.927 734 HB3 ASP 90 2HB ASP 90 -5.789 -2.666 7.051 735 HA PRO 91 HA PRO 91 -0.567 -5.097 9.062 736 HB2 PRO 91 1HB PRO 91 -0.733 -7.602 8.030 737 HB3 PRO 91 2HB PRO 91 -1.270 -7.200 9.665 738 HG2 PRO 91 1HG PRO 91 -2.887 -7.519 7.166 739 HG3 PRO 91 2HG PRO 91 -3.233 -8.101 8.805 740 HD2 PRO 91 1HD PRO 91 -4.381 -5.874 7.777 741 HD3 PRO 91 2HD PRO 91 -4.013 -6.048 9.505 742 H ASP 92 H ASP 92 0.643 -3.946 7.647 743 HA ASP 92 HA ASP 92 0.314 -4.209 4.795 744 HB2 ASP 92 1HB ASP 92 2.071 -2.582 6.593 745 HB3 ASP 92 2HB ASP 92 2.494 -2.746 4.891 746 H ARG 93 H ARG 93 3.186 -4.603 6.876 747 HA ARG 93 HA ARG 93 3.811 -7.178 5.835 748 HB2 ARG 93 1HB ARG 93 5.936 -6.512 4.707 749 HB3 ARG 93 2HB ARG 93 4.487 -5.980 3.866 750 HG2 ARG 93 1HG ARG 93 4.807 -3.755 5.062 751 HG3 ARG 93 2HG ARG 93 6.420 -4.344 5.469 752 HD2 ARG 93 1HD ARG 93 6.603 -3.041 3.479 753 HD3 ARG 93 2HD ARG 93 6.807 -4.734 3.033 754 HE ARG 93 HE ARG 93 4.106 -4.054 2.742 755 HH11 ARG 93 1HH1 ARG 93 7.199 -3.346 1.309 756 HH12 ARG 93 2HH1 ARG 93 6.543 -3.021 -0.262 757 HH21 ARG 93 1HH2 ARG 93 3.230 -3.628 0.680 758 HH22 ARG 93 2HH2 ARG 93 4.285 -3.181 -0.618 759 H GLN 94 H GLN 94 5.647 -8.124 6.846 760 HA GLN 94 HA GLN 94 7.045 -6.562 8.863 761 HB2 GLN 94 1HB GLN 94 5.074 -8.722 9.463 762 HB3 GLN 94 2HB GLN 94 6.507 -8.588 10.474 763 HG2 GLN 94 1HG GLN 94 4.452 -6.442 9.993 764 HG3 GLN 94 2HG GLN 94 4.656 -7.394 11.463 765 HE21 GLN 94 2HE2 GLN 94 5.106 -4.451 10.322 766 HE22 GLN 94 1HE2 GLN 94 6.526 -3.970 11.180 767 H ASP 95 H ASP 95 8.856 -7.735 9.823 768 HA ASP 95 HA ASP 95 9.942 -9.700 7.928 769 HB2 ASP 95 1HB ASP 95 11.324 -7.874 9.903 770 HB3 ASP 95 2HB ASP 95 12.153 -9.082 8.925 771 H HIS 96 H HIS 96 10.705 -11.666 8.592 772 HA HIS 96 HA HIS 96 11.054 -12.370 11.332 773 HB2 HIS 96 1HB HIS 96 9.217 -14.126 11.315 774 HB3 HIS 96 2HB HIS 96 8.686 -12.455 11.482 775 HD1 HIS 96 HD1 HIS 96 7.593 -11.361 9.330 776 HD2 HIS 96 HD2 HIS 96 8.235 -15.460 9.119 777 HE1 HIS 96 HE1 HIS 96 6.200 -12.161 7.395 778 H HIS 97 H HIS 97 11.690 -14.626 11.601 779 HA HIS 97 HA HIS 97 12.044 -16.356 9.383 780 HB2 HIS 97 1HB HIS 97 13.752 -14.677 8.790 781 HB3 HIS 97 2HB HIS 97 14.528 -14.923 10.352 782 HD1 HIS 97 HD1 HIS 97 16.596 -16.216 10.001 783 HD2 HIS 97 HD2 HIS 97 13.512 -17.561 7.563 784 HE1 HIS 97 HE1 HIS 97 17.540 -18.179 8.744 785 HA PRO 98 HA PRO 98 12.350 -18.125 13.688 786 HB2 PRO 98 1HB PRO 98 10.309 -19.887 13.378 787 HB3 PRO 98 2HB PRO 98 10.067 -18.224 13.925 788 HG2 PRO 98 1HG PRO 98 9.702 -19.390 11.193 789 HG3 PRO 98 2HG PRO 98 8.668 -18.247 12.068 790 HD2 PRO 98 1HD PRO 98 10.402 -17.462 10.143 791 HD3 PRO 98 2HD PRO 98 10.000 -16.442 11.539 792 H GLY 99 H GLY 99 13.257 -20.101 14.245 793 HA2 GLY 99 1HA GLY 99 14.042 -21.791 11.956 794 HA3 GLY 99 2HA GLY 99 15.011 -21.566 13.405 795 H SER 100 H SER 100 14.888 -24.034 13.027 796 HA SER 100 HA SER 100 12.619 -25.068 14.600 797 HB2 SER 100 1HB SER 100 12.714 -25.734 12.119 798 HB3 SER 100 2HB SER 100 14.116 -26.709 12.560 799 HG SER 100 HG SER 100 11.725 -26.943 14.019 800 H GLY 101 H GLY 101 13.314 -27.468 15.331 801 HA2 GLY 101 1HA GLY 101 16.079 -27.697 16.106 802 HA3 GLY 101 2HA GLY 101 15.020 -27.265 17.440 803 H ALA 102 H ALA 102 15.322 -29.174 18.563 804 HA ALA 102 HA ALA 102 13.661 -31.360 17.729 805 HB1 ALA 102 1HB ALA 102 15.650 -31.919 16.461 806 HB2 ALA 102 2HB ALA 102 16.637 -31.809 17.919 807 HB3 ALA 102 3HB ALA 102 15.420 -33.077 17.771 808 H GLN 103 H GLN 103 13.561 -33.078 19.389 809 HA GLN 103 HA GLN 103 13.425 -31.939 21.990 810 HB2 GLN 103 1HB GLN 103 11.902 -33.725 21.102 811 HB3 GLN 103 2HB GLN 103 13.235 -34.862 21.253 812 HG2 GLN 103 1HG GLN 103 13.133 -34.901 23.533 813 HG3 GLN 103 2HG GLN 103 12.454 -33.277 23.640 814 HE21 GLN 103 2HE2 GLN 103 10.309 -33.037 23.799 815 HE22 GLN 103 1HE2 GLN 103 9.164 -34.329 23.731 Start of MODEL 10 1 H1 GLY 1 H GLY 1 5.542 15.590 -1.890 2 HA2 GLY 1 1HA GLY 1 4.328 13.208 -1.283 3 HA3 GLY 1 2HA GLY 1 3.235 13.976 -2.425 4 H SER 2 H SER 2 3.488 12.868 -4.265 5 HA SER 2 HA SER 2 5.980 13.078 -5.678 6 HB2 SER 2 1HB SER 2 4.967 10.329 -4.911 7 HB3 SER 2 2HB SER 2 6.299 10.657 -6.019 8 HG SER 2 HG SER 2 6.199 10.832 -3.249 9 H LEU 3 H LEU 3 5.702 11.494 -7.759 10 HA LEU 3 HA LEU 3 2.949 11.822 -8.739 11 HB2 LEU 3 1HB LEU 3 3.676 12.735 -10.791 12 HB3 LEU 3 2HB LEU 3 4.475 13.654 -9.518 13 HG LEU 3 HG LEU 3 6.410 11.887 -10.015 14 HD11 LEU 3 1HD1 LEU 3 6.285 10.794 -11.945 15 HD12 LEU 3 2HD1 LEU 3 5.806 12.249 -12.818 16 HD13 LEU 3 3HD1 LEU 3 4.586 11.264 -12.011 17 HD21 LEU 3 3HD2 LEU 3 6.136 14.136 -11.954 18 HD22 LEU 3 1HD2 LEU 3 7.540 13.615 -11.023 19 HD23 LEU 3 2HD2 LEU 3 6.230 14.489 -10.228 20 H VAL 4 H VAL 4 2.284 10.345 -10.331 21 HA VAL 4 HA VAL 4 4.064 8.018 -10.672 22 HB VAL 4 HB VAL 4 1.874 6.703 -10.892 23 HG11 VAL 4 1HG1 VAL 4 1.842 6.208 -8.579 24 HG12 VAL 4 2HG1 VAL 4 3.500 6.683 -8.955 25 HG13 VAL 4 3HG1 VAL 4 2.416 7.819 -8.151 26 HG21 VAL 4 3HG2 VAL 4 0.464 8.770 -11.050 27 HG22 VAL 4 1HG2 VAL 4 -0.084 7.591 -9.858 28 HG23 VAL 4 2HG2 VAL 4 0.777 9.039 -9.335 29 HA PRO 5 HA PRO 5 3.574 8.350 -15.022 30 HB2 PRO 5 1HB PRO 5 3.598 5.740 -15.770 31 HB3 PRO 5 2HB PRO 5 5.041 6.592 -15.207 32 HG2 PRO 5 1HG PRO 5 3.224 4.747 -13.705 33 HG3 PRO 5 2HG PRO 5 4.995 4.827 -13.693 34 HD2 PRO 5 1HD PRO 5 3.474 5.909 -11.731 35 HD3 PRO 5 2HD PRO 5 5.030 6.606 -12.227 36 H ARG 6 H ARG 6 1.256 6.619 -13.141 37 HA ARG 6 HA ARG 6 -0.550 5.710 -15.022 38 HB2 ARG 6 1HB ARG 6 -0.545 5.678 -12.371 39 HB3 ARG 6 2HB ARG 6 -1.610 7.062 -12.582 40 HG2 ARG 6 1HG ARG 6 -3.109 5.328 -12.456 41 HG3 ARG 6 2HG ARG 6 -2.896 5.487 -14.201 42 HD2 ARG 6 1HD ARG 6 -2.647 3.226 -13.976 43 HD3 ARG 6 2HD ARG 6 -0.971 3.739 -13.784 44 HE ARG 6 HE ARG 6 -2.013 3.724 -11.248 45 HH11 ARG 6 1HH1 ARG 6 -1.647 1.399 -13.814 46 HH12 ARG 6 2HH1 ARG 6 -1.508 0.044 -12.743 47 HH21 ARG 6 1HH2 ARG 6 -1.831 1.948 -9.828 48 HH22 ARG 6 2HH2 ARG 6 -1.613 0.358 -10.476 49 H GLY 7 H GLY 7 -2.163 6.593 -16.239 50 HA2 GLY 7 1HA GLY 7 -1.931 9.298 -17.019 51 HA3 GLY 7 2HA GLY 7 -3.233 8.208 -17.472 52 H SER 8 H SER 8 -4.715 9.952 -17.293 53 HA SER 8 HA SER 8 -6.092 10.079 -14.866 54 HB2 SER 8 1HB SER 8 -3.917 12.017 -15.144 55 HB3 SER 8 2HB SER 8 -5.478 12.772 -14.823 56 HG SER 8 HG SER 8 -3.937 11.111 -13.217 57 H MET 9 H MET 9 -7.968 11.453 -14.958 58 HA MET 9 HA MET 9 -8.494 12.950 -17.368 59 HB2 MET 9 1HB MET 9 -9.305 11.167 -18.485 60 HB3 MET 9 2HB MET 9 -9.447 10.197 -17.026 61 HG2 MET 9 1HG MET 9 -11.550 11.220 -16.485 62 HG3 MET 9 2HG MET 9 -11.389 12.348 -17.829 63 HE1 MET 9 3HE MET 9 -13.387 8.431 -17.728 64 HE2 MET 9 1HE MET 9 -11.689 8.163 -17.334 65 HE3 MET 9 2HE MET 9 -12.627 9.351 -16.429 66 H GLN 10 H GLN 10 -9.932 14.541 -16.999 67 HA GLN 10 HA GLN 10 -11.153 14.648 -14.346 68 HB2 GLN 10 1HB GLN 10 -11.452 17.020 -14.759 69 HB3 GLN 10 2HB GLN 10 -9.789 16.562 -15.103 70 HG2 GLN 10 1HG GLN 10 -11.667 16.510 -17.379 71 HG3 GLN 10 2HG GLN 10 -11.258 18.094 -16.721 72 HE21 GLN 10 2HE2 GLN 10 -10.299 15.587 -18.748 73 HE22 GLN 10 1HE2 GLN 10 -8.692 16.128 -19.077 74 H ILE 11 H ILE 11 -13.346 15.042 -14.012 75 HA ILE 11 HA ILE 11 -15.107 14.920 -16.351 76 HB ILE 11 HB ILE 11 -16.530 13.234 -15.329 77 HG12 ILE 11 1HG1 ILE 11 -14.418 13.142 -13.164 78 HG13 ILE 11 2HG1 ILE 11 -16.076 13.703 -12.978 79 HG21 ILE 11 1HG2 ILE 11 -15.109 11.303 -15.646 80 HG22 ILE 11 2HG2 ILE 11 -14.708 12.541 -16.835 81 HG23 ILE 11 3HG2 ILE 11 -13.667 12.295 -15.433 82 HD11 ILE 11 3HD1 ILE 11 -16.549 11.646 -12.305 83 HD12 ILE 11 1HD1 ILE 11 -16.361 11.153 -13.987 84 HD13 ILE 11 2HD1 ILE 11 -15.001 11.021 -12.872 85 H PHE 12 H PHE 12 -17.454 15.256 -15.647 86 HA PHE 12 HA PHE 12 -17.505 17.340 -13.567 87 HB2 PHE 12 1HB PHE 12 -19.249 17.023 -16.018 88 HB3 PHE 12 2HB PHE 12 -19.451 18.273 -14.795 89 HD1 PHE 12 HD2 PHE 12 -16.983 19.422 -14.269 90 HD2 PHE 12 HD1 PHE 12 -18.341 17.800 -17.963 91 HE1 PHE 12 HE2 PHE 12 -15.398 20.862 -15.480 92 HE2 PHE 12 HE1 PHE 12 -16.758 19.238 -19.180 93 HZ PHE 12 HZ PHE 12 -15.285 20.772 -17.939 94 H VAL 13 H VAL 13 -18.739 17.027 -11.833 95 HA VAL 13 HA VAL 13 -20.881 15.010 -11.973 96 HB VAL 13 HB VAL 13 -19.023 15.427 -9.627 97 HG11 VAL 13 1HG1 VAL 13 -21.582 14.068 -9.955 98 HG12 VAL 13 2HG1 VAL 13 -20.319 13.031 -9.287 99 HG13 VAL 13 3HG1 VAL 13 -20.732 14.547 -8.486 100 HG21 VAL 13 3HG2 VAL 13 -18.595 13.973 -11.992 101 HG22 VAL 13 1HG2 VAL 13 -17.647 13.921 -10.505 102 HG23 VAL 13 2HG2 VAL 13 -18.975 12.785 -10.745 103 H LYS 14 H LYS 14 -22.744 15.445 -10.838 104 HA LYS 14 HA LYS 14 -22.949 18.171 -9.749 105 HB2 LYS 14 1HB LYS 14 -24.832 16.423 -11.263 106 HB3 LYS 14 2HB LYS 14 -25.508 17.560 -10.105 107 HG2 LYS 14 1HG LYS 14 -25.541 18.846 -11.979 108 HG3 LYS 14 2HG LYS 14 -23.937 19.256 -11.368 109 HD2 LYS 14 1HD LYS 14 -22.915 17.666 -12.876 110 HD3 LYS 14 2HD LYS 14 -24.502 17.120 -13.424 111 HE2 LYS 14 1HE LYS 14 -23.662 19.989 -13.678 112 HE3 LYS 14 2HE LYS 14 -23.207 18.792 -14.890 113 HZ1 LYS 14 3HZ LYS 14 -25.937 18.504 -14.376 114 HZ2 LYS 14 1HZ LYS 14 -25.193 19.030 -15.802 115 HZ3 LYS 14 2HZ LYS 14 -25.642 20.152 -14.619 116 H THR 15 H THR 15 -23.158 18.355 -7.626 117 HA THR 15 HA THR 15 -23.610 16.056 -5.967 118 HB THR 15 HB THR 15 -23.369 17.595 -4.077 119 HG1 THR 15 HG1 THR 15 -22.870 19.745 -5.814 120 HG21 THR 15 3HG2 THR 15 -21.240 18.581 -5.878 121 HG22 THR 15 1HG2 THR 15 -21.411 16.831 -5.751 122 HG23 THR 15 2HG2 THR 15 -21.119 17.796 -4.304 123 H LEU 16 H LEU 16 -25.163 16.449 -4.001 124 HA LEU 16 HA LEU 16 -27.803 16.510 -5.069 125 HB2 LEU 16 1HB LEU 16 -28.526 16.128 -2.773 126 HB3 LEU 16 2HB LEU 16 -27.214 15.042 -3.230 127 HG LEU 16 HG LEU 16 -25.728 16.855 -2.039 128 HD11 LEU 16 1HD1 LEU 16 -26.832 18.486 -1.026 129 HD12 LEU 16 2HD1 LEU 16 -27.598 17.287 0.015 130 HD13 LEU 16 3HD1 LEU 16 -28.379 17.775 -1.489 131 HD21 LEU 16 3HD2 LEU 16 -25.834 14.567 -1.324 132 HD22 LEU 16 1HD2 LEU 16 -27.435 14.812 -0.626 133 HD23 LEU 16 2HD2 LEU 16 -26.031 15.605 0.089 134 H THR 17 H THR 17 -25.789 18.791 -3.349 135 HA THR 17 HA THR 17 -27.857 20.621 -2.664 136 HB THR 17 HB THR 17 -25.707 20.644 -1.492 137 HG1 THR 17 HG1 THR 17 -26.156 22.677 -1.168 138 HG21 THR 17 3HG2 THR 17 -24.647 21.401 -4.201 139 HG22 THR 17 1HG2 THR 17 -24.105 20.110 -3.130 140 HG23 THR 17 2HG2 THR 17 -23.778 21.794 -2.718 141 H GLY 18 H GLY 18 -26.103 19.975 -5.562 142 HA2 GLY 18 1HA GLY 18 -26.986 20.779 -7.655 143 HA3 GLY 18 2HA GLY 18 -27.459 22.260 -6.835 144 H LYS 19 H LYS 19 -24.356 20.976 -6.096 145 HA LYS 19 HA LYS 19 -23.124 23.158 -7.634 146 HB2 LYS 19 1HB LYS 19 -22.663 23.402 -5.310 147 HB3 LYS 19 2HB LYS 19 -22.251 21.701 -5.143 148 HG2 LYS 19 1HG LYS 19 -20.624 23.274 -7.041 149 HG3 LYS 19 2HG LYS 19 -20.426 23.639 -5.325 150 HD2 LYS 19 1HD LYS 19 -20.436 20.780 -6.108 151 HD3 LYS 19 2HD LYS 19 -19.026 21.735 -6.571 152 HE2 LYS 19 1HE LYS 19 -20.089 21.824 -3.772 153 HE3 LYS 19 2HE LYS 19 -19.026 20.516 -4.289 154 HZ1 LYS 19 3HZ LYS 19 -17.744 22.273 -3.295 155 HZ2 LYS 19 1HZ LYS 19 -18.400 23.418 -4.354 156 HZ3 LYS 19 2HZ LYS 19 -17.389 22.199 -4.948 157 H THR 20 H THR 20 -21.436 22.782 -9.018 158 HA THR 20 HA THR 20 -21.065 19.998 -9.827 159 HB THR 20 HB THR 20 -19.781 22.220 -11.336 160 HG1 THR 20 HG1 THR 20 -21.838 22.601 -12.381 161 HG21 THR 20 3HG2 THR 20 -19.873 19.649 -11.849 162 HG22 THR 20 1HG2 THR 20 -20.035 20.823 -13.154 163 HG23 THR 20 2HG2 THR 20 -21.469 20.042 -12.488 164 H ILE 21 H ILE 21 -19.214 18.901 -9.564 165 HA ILE 21 HA ILE 21 -16.806 20.383 -8.754 166 HB ILE 21 HB ILE 21 -17.665 19.486 -6.710 167 HG12 ILE 21 1HG1 ILE 21 -15.160 19.043 -7.566 168 HG13 ILE 21 2HG1 ILE 21 -15.721 18.547 -5.972 169 HG21 ILE 21 1HG2 ILE 21 -19.210 17.852 -7.479 170 HG22 ILE 21 2HG2 ILE 21 -17.928 16.901 -8.228 171 HG23 ILE 21 3HG2 ILE 21 -18.031 17.012 -6.471 172 HD11 ILE 21 3HD1 ILE 21 -15.903 16.699 -8.317 173 HD12 ILE 21 1HD1 ILE 21 -14.413 16.866 -7.390 174 HD13 ILE 21 2HD1 ILE 21 -15.889 16.317 -6.595 175 H THR 22 H THR 22 -14.965 19.761 -9.724 176 HA THR 22 HA THR 22 -15.132 17.739 -11.791 177 HB THR 22 HB THR 22 -12.587 19.171 -11.133 178 HG1 THR 22 HG1 THR 22 -13.848 20.934 -11.190 179 HG21 THR 22 3HG2 THR 22 -13.052 17.412 -13.023 180 HG22 THR 22 1HG2 THR 22 -12.065 18.834 -13.354 181 HG23 THR 22 2HG2 THR 22 -13.755 18.798 -13.856 182 H LEU 23 H LEU 23 -14.305 15.740 -11.711 183 HA LEU 23 HA LEU 23 -12.600 15.044 -9.410 184 HB2 LEU 23 1HB LEU 23 -15.059 14.156 -9.599 185 HB3 LEU 23 2HB LEU 23 -14.344 13.023 -10.744 186 HG LEU 23 HG LEU 23 -12.823 12.232 -8.974 187 HD11 LEU 23 1HD1 LEU 23 -13.774 12.950 -6.597 188 HD12 LEU 23 2HD1 LEU 23 -14.131 14.432 -7.483 189 HD13 LEU 23 3HD1 LEU 23 -12.475 13.831 -7.402 190 HD21 LEU 23 3HD2 LEU 23 -14.579 10.793 -9.075 191 HD22 LEU 23 1HD2 LEU 23 -15.776 12.054 -8.782 192 HD23 LEU 23 2HD2 LEU 23 -14.832 11.407 -7.440 193 H GLU 24 H GLU 24 -10.866 13.691 -9.761 194 HA GLU 24 HA GLU 24 -10.159 13.280 -12.584 195 HB2 GLU 24 1HB GLU 24 -8.543 13.719 -10.100 196 HB3 GLU 24 2HB GLU 24 -7.821 12.892 -11.473 197 HG2 GLU 24 1HG GLU 24 -7.206 15.024 -11.946 198 HG3 GLU 24 2HG GLU 24 -8.755 14.974 -12.786 199 H VAL 25 H VAL 25 -10.226 11.291 -13.373 200 HA VAL 25 HA VAL 25 -9.608 9.020 -11.634 201 HB VAL 25 HB VAL 25 -11.893 8.618 -13.482 202 HG11 VAL 25 1HG1 VAL 25 -11.395 7.689 -10.657 203 HG12 VAL 25 2HG1 VAL 25 -12.603 7.068 -11.784 204 HG13 VAL 25 3HG1 VAL 25 -10.886 6.817 -12.103 205 HG21 VAL 25 3HG2 VAL 25 -12.688 10.631 -12.564 206 HG22 VAL 25 1HG2 VAL 25 -13.441 9.362 -11.599 207 HG23 VAL 25 2HG2 VAL 25 -12.056 10.249 -10.963 208 H GLU 26 H GLU 26 -8.743 7.243 -12.689 209 HA GLU 26 HA GLU 26 -7.480 7.783 -15.193 210 HB2 GLU 26 1HB GLU 26 -7.581 5.363 -13.403 211 HB3 GLU 26 2HB GLU 26 -6.749 5.339 -14.951 212 HG2 GLU 26 1HG GLU 26 -5.199 5.758 -13.138 213 HG3 GLU 26 2HG GLU 26 -5.299 7.151 -14.213 214 HA PRO 27 HA PRO 27 -10.318 6.076 -18.070 215 HB2 PRO 27 1HB PRO 27 -8.651 4.922 -19.875 216 HB3 PRO 27 2HB PRO 27 -8.836 6.673 -19.721 217 HG2 PRO 27 1HG PRO 27 -6.695 4.891 -18.624 218 HG3 PRO 27 2HG PRO 27 -6.541 6.478 -19.400 219 HD2 PRO 27 1HD PRO 27 -6.452 6.154 -16.713 220 HD3 PRO 27 2HD PRO 27 -7.115 7.613 -17.477 221 H SER 28 H SER 28 -8.150 4.031 -16.355 222 HA SER 28 HA SER 28 -9.640 1.640 -17.207 223 HB2 SER 28 1HB SER 28 -7.583 0.554 -15.899 224 HB3 SER 28 2HB SER 28 -7.462 1.027 -17.593 225 HG SER 28 HG SER 28 -6.139 2.590 -17.067 226 H ASP 29 H ASP 29 -9.200 3.817 -14.659 227 HA ASP 29 HA ASP 29 -9.497 2.222 -12.390 228 HB2 ASP 29 1HB ASP 29 -9.909 5.061 -13.065 229 HB3 ASP 29 2HB ASP 29 -10.852 4.483 -11.694 230 H THR 30 H THR 30 -11.209 1.335 -11.338 231 HA THR 30 HA THR 30 -13.643 0.997 -12.873 232 HB THR 30 HB THR 30 -14.179 -0.376 -10.634 233 HG1 THR 30 HG1 THR 30 -12.155 -1.279 -9.907 234 HG21 THR 30 3HG2 THR 30 -12.411 -2.073 -11.996 235 HG22 THR 30 1HG2 THR 30 -13.043 -0.965 -13.213 236 HG23 THR 30 2HG2 THR 30 -14.152 -1.927 -12.235 237 H ILE 31 H ILE 31 -15.747 0.965 -11.525 238 HA ILE 31 HA ILE 31 -16.434 3.548 -10.826 239 HB ILE 31 HB ILE 31 -17.728 1.000 -9.848 240 HG12 ILE 31 1HG1 ILE 31 -17.633 1.090 -12.278 241 HG13 ILE 31 2HG1 ILE 31 -19.285 1.369 -11.739 242 HG21 ILE 31 1HG2 ILE 31 -18.667 2.596 -8.484 243 HG22 ILE 31 2HG2 ILE 31 -18.515 3.871 -9.691 244 HG23 ILE 31 3HG2 ILE 31 -19.763 2.639 -9.865 245 HD11 ILE 31 3HD1 ILE 31 -18.503 3.895 -11.893 246 HD12 ILE 31 1HD1 ILE 31 -17.382 3.204 -13.066 247 HD13 ILE 31 2HD1 ILE 31 -19.121 3.011 -13.288 248 H GLU 32 H GLU 32 -14.975 1.056 -8.883 249 HA GLU 32 HA GLU 32 -15.556 2.086 -6.329 250 HB2 GLU 32 1HB GLU 32 -13.513 0.783 -5.626 251 HB3 GLU 32 2HB GLU 32 -14.744 -0.143 -6.473 252 HG2 GLU 32 1HG GLU 32 -13.470 -0.269 -8.428 253 HG3 GLU 32 2HG GLU 32 -12.394 1.028 -7.914 254 H ASN 33 H ASN 33 -13.090 2.870 -8.688 255 HA ASN 33 HA ASN 33 -11.536 4.486 -6.898 256 HB2 ASN 33 1HB ASN 33 -11.479 3.843 -9.806 257 HB3 ASN 33 2HB ASN 33 -10.669 5.316 -9.281 258 HD21 ASN 33 2HD2 ASN 33 -10.721 1.847 -9.094 259 HD22 ASN 33 1HD2 ASN 33 -9.138 1.658 -8.428 260 H VAL 34 H VAL 34 -13.977 5.084 -9.383 261 HA VAL 34 HA VAL 34 -13.846 7.848 -9.538 262 HB VAL 34 HB VAL 34 -16.333 6.137 -9.677 263 HG11 VAL 34 1HG1 VAL 34 -16.652 8.277 -11.381 264 HG12 VAL 34 2HG1 VAL 34 -17.390 8.102 -9.787 265 HG13 VAL 34 3HG1 VAL 34 -15.880 8.997 -9.969 266 HG21 VAL 34 3HG2 VAL 34 -14.593 7.107 -11.937 267 HG22 VAL 34 1HG2 VAL 34 -14.471 5.500 -11.222 268 HG23 VAL 34 2HG2 VAL 34 -15.957 5.994 -12.032 269 H LYS 35 H LYS 35 -15.879 5.881 -7.372 270 HA LYS 35 HA LYS 35 -16.925 8.111 -5.957 271 HB2 LYS 35 1HB LYS 35 -17.795 6.459 -4.383 272 HB3 LYS 35 2HB LYS 35 -18.081 5.946 -6.040 273 HG2 LYS 35 1HG LYS 35 -17.331 3.987 -5.189 274 HG3 LYS 35 2HG LYS 35 -15.779 4.689 -5.649 275 HD2 LYS 35 1HD LYS 35 -15.157 5.072 -3.490 276 HD3 LYS 35 2HD LYS 35 -16.817 5.325 -2.943 277 HE2 LYS 35 1HE LYS 35 -16.120 3.298 -1.961 278 HE3 LYS 35 2HE LYS 35 -17.167 2.843 -3.304 279 HZ1 LYS 35 3HZ LYS 35 -14.360 3.057 -3.965 280 HZ2 LYS 35 1HZ LYS 35 -15.486 1.868 -4.390 281 HZ3 LYS 35 2HZ LYS 35 -14.733 1.818 -2.876 282 H ALA 36 H ALA 36 -14.049 6.190 -5.649 283 HA ALA 36 HA ALA 36 -13.358 6.617 -2.996 284 HB1 ALA 36 1HB ALA 36 -12.193 5.298 -4.986 285 HB2 ALA 36 2HB ALA 36 -11.189 6.748 -5.013 286 HB3 ALA 36 3HB ALA 36 -11.312 5.788 -3.539 287 H LYS 37 H LYS 37 -12.715 8.659 -5.828 288 HA LYS 37 HA LYS 37 -11.272 10.647 -4.413 289 HB2 LYS 37 1HB LYS 37 -12.795 10.888 -7.015 290 HB3 LYS 37 2HB LYS 37 -11.589 12.022 -6.420 291 HG2 LYS 37 1HG LYS 37 -11.022 9.131 -7.032 292 HG3 LYS 37 2HG LYS 37 -10.764 10.458 -8.168 293 HD2 LYS 37 1HD LYS 37 -9.141 11.464 -6.719 294 HD3 LYS 37 2HD LYS 37 -9.505 10.314 -5.431 295 HE2 LYS 37 1HE LYS 37 -8.517 9.408 -8.116 296 HE3 LYS 37 2HE LYS 37 -7.402 9.921 -6.851 297 HZ1 LYS 37 3HZ LYS 37 -8.555 8.240 -5.396 298 HZ2 LYS 37 1HZ LYS 37 -7.606 7.605 -6.644 299 HZ3 LYS 37 2HZ LYS 37 -9.290 7.641 -6.797 300 H ILE 38 H ILE 38 -14.662 10.079 -4.978 301 HA ILE 38 HA ILE 38 -15.627 12.661 -4.368 302 HB ILE 38 HB ILE 38 -16.992 9.988 -4.035 303 HG12 ILE 38 1HG1 ILE 38 -16.253 10.518 -6.346 304 HG13 ILE 38 2HG1 ILE 38 -18.005 10.451 -6.193 305 HG21 ILE 38 1HG2 ILE 38 -19.048 11.572 -4.345 306 HG22 ILE 38 2HG2 ILE 38 -18.313 11.367 -2.756 307 HG23 ILE 38 3HG2 ILE 38 -17.943 12.796 -3.719 308 HD11 ILE 38 3HD1 ILE 38 -16.313 12.935 -6.316 309 HD12 ILE 38 1HD1 ILE 38 -17.361 12.305 -7.587 310 HD13 ILE 38 2HD1 ILE 38 -18.061 12.905 -6.084 311 H GLN 39 H GLN 39 -14.618 9.978 -2.384 312 HA GLN 39 HA GLN 39 -15.854 10.600 0.026 313 HB2 GLN 39 1HB GLN 39 -13.118 9.414 -0.463 314 HB3 GLN 39 2HB GLN 39 -13.933 9.426 1.095 315 HG2 GLN 39 1HG GLN 39 -15.813 8.167 -0.023 316 HG3 GLN 39 2HG GLN 39 -14.732 7.963 -1.400 317 HE21 GLN 39 2HE2 GLN 39 -14.342 7.763 2.123 318 HE22 GLN 39 1HE2 GLN 39 -13.623 6.193 2.126 319 H ASP 40 H ASP 40 -13.159 12.110 -1.571 320 HA ASP 40 HA ASP 40 -12.255 13.568 0.731 321 HB2 ASP 40 1HB ASP 40 -10.796 12.958 -1.221 322 HB3 ASP 40 2HB ASP 40 -11.676 14.145 -2.179 323 H LYS 41 H LYS 41 -14.702 13.980 -1.642 324 HA LYS 41 HA LYS 41 -14.954 16.842 -1.129 325 HB2 LYS 41 1HB LYS 41 -16.756 15.172 -2.873 326 HB3 LYS 41 2HB LYS 41 -16.489 16.909 -2.935 327 HG2 LYS 41 1HG LYS 41 -14.397 14.846 -3.589 328 HG3 LYS 41 2HG LYS 41 -15.415 15.656 -4.782 329 HD2 LYS 41 1HD LYS 41 -14.276 17.605 -4.624 330 HD3 LYS 41 2HD LYS 41 -13.987 17.417 -2.893 331 HE2 LYS 41 1HE LYS 41 -12.261 15.733 -3.387 332 HE3 LYS 41 2HE LYS 41 -12.534 15.978 -5.112 333 HZ1 LYS 41 3HZ LYS 41 -12.091 18.486 -4.065 334 HZ2 LYS 41 1HZ LYS 41 -11.022 17.576 -5.008 335 HZ3 LYS 41 2HZ LYS 41 -10.940 17.495 -3.321 336 H GLU 42 H GLU 42 -16.895 13.878 -0.826 337 HA GLU 42 HA GLU 42 -18.622 15.307 1.086 338 HB2 GLU 42 1HB GLU 42 -19.363 12.766 -0.350 339 HB3 GLU 42 2HB GLU 42 -20.423 13.895 0.481 340 HG2 GLU 42 1HG GLU 42 -19.030 14.263 -2.151 341 HG3 GLU 42 2HG GLU 42 -20.762 14.213 -1.831 342 H GLY 43 H GLY 43 -16.799 12.360 0.473 343 HA2 GLY 43 1HA GLY 43 -15.908 10.819 1.926 344 HA3 GLY 43 2HA GLY 43 -16.250 11.955 3.223 345 H ILE 44 H ILE 44 -18.181 9.954 0.986 346 HA ILE 44 HA ILE 44 -19.630 8.926 3.337 347 HB ILE 44 HB ILE 44 -21.616 8.701 1.747 348 HG12 ILE 44 1HG1 ILE 44 -19.971 10.720 0.206 349 HG13 ILE 44 2HG1 ILE 44 -20.413 9.107 -0.343 350 HG21 ILE 44 1HG2 ILE 44 -20.831 10.698 3.478 351 HG22 ILE 44 2HG2 ILE 44 -21.304 11.576 2.025 352 HG23 ILE 44 3HG2 ILE 44 -22.446 10.482 2.804 353 HD11 ILE 44 3HD1 ILE 44 -21.889 10.547 -1.431 354 HD12 ILE 44 1HD1 ILE 44 -22.827 9.870 -0.101 355 HD13 ILE 44 2HD1 ILE 44 -22.171 11.502 0.024 356 HA PRO 45 HA PRO 45 -18.720 4.876 1.898 357 HB2 PRO 45 1HB PRO 45 -20.884 3.519 2.819 358 HB3 PRO 45 2HB PRO 45 -19.600 4.114 3.878 359 HG2 PRO 45 1HG PRO 45 -22.284 5.308 3.297 360 HG3 PRO 45 2HG PRO 45 -21.442 5.150 4.850 361 HD2 PRO 45 1HD PRO 45 -21.492 7.467 3.449 362 HD3 PRO 45 2HD PRO 45 -20.112 6.991 4.460 363 HA PRO 46 HA PRO 46 -20.766 3.945 -1.881 364 HB2 PRO 46 1HB PRO 46 -20.764 1.230 -1.914 365 HB3 PRO 46 2HB PRO 46 -19.301 2.195 -2.145 366 HG2 PRO 46 1HG PRO 46 -20.294 0.821 0.322 367 HG3 PRO 46 2HG PRO 46 -18.647 0.895 -0.331 368 HD2 PRO 46 1HD PRO 46 -19.475 2.463 1.715 369 HD3 PRO 46 2HD PRO 46 -18.265 2.998 0.531 370 H ASP 47 H ASP 47 -22.082 2.680 1.068 371 HA ASP 47 HA ASP 47 -24.516 1.701 -0.126 372 HB2 ASP 47 1HB ASP 47 -23.525 0.731 1.956 373 HB3 ASP 47 2HB ASP 47 -23.928 2.228 2.793 374 H GLN 48 H GLN 48 -23.348 4.693 1.129 375 HA GLN 48 HA GLN 48 -26.070 5.804 1.146 376 HB2 GLN 48 1HB GLN 48 -23.523 6.633 2.504 377 HB3 GLN 48 2HB GLN 48 -24.837 7.780 2.280 378 HG2 GLN 48 1HG GLN 48 -26.276 5.909 3.387 379 HG3 GLN 48 2HG GLN 48 -24.719 5.343 3.987 380 HE21 GLN 48 2HE2 GLN 48 -26.145 8.557 3.512 381 HE22 GLN 48 1HE2 GLN 48 -25.884 9.100 5.131 382 H GLN 49 H GLN 49 -23.721 5.382 -0.986 383 HA GLN 49 HA GLN 49 -24.406 7.819 -2.439 384 HB2 GLN 49 1HB GLN 49 -22.213 8.493 -2.867 385 HB3 GLN 49 2HB GLN 49 -22.175 8.050 -1.165 386 HG2 GLN 49 1HG GLN 49 -20.386 6.842 -1.693 387 HG3 GLN 49 2HG GLN 49 -21.528 5.695 -2.392 388 HE21 GLN 49 2HE2 GLN 49 -19.889 8.720 -3.269 389 HE22 GLN 49 1HE2 GLN 49 -19.492 8.237 -4.880 390 H ARG 50 H ARG 50 -24.261 7.636 -4.694 391 HA ARG 50 HA ARG 50 -23.322 5.186 -5.896 392 HB2 ARG 50 1HB ARG 50 -26.179 5.667 -5.362 393 HB3 ARG 50 2HB ARG 50 -25.808 5.185 -7.012 394 HG2 ARG 50 1HG ARG 50 -25.002 3.674 -4.534 395 HG3 ARG 50 2HG ARG 50 -26.363 3.276 -5.585 396 HD2 ARG 50 1HD ARG 50 -24.704 3.103 -7.474 397 HD3 ARG 50 2HD ARG 50 -23.430 3.224 -6.260 398 HE ARG 50 HE ARG 50 -23.859 1.059 -5.636 399 HH11 ARG 50 1HH1 ARG 50 -26.455 2.221 -7.643 400 HH12 ARG 50 2HH1 ARG 50 -27.203 0.667 -7.800 401 HH21 ARG 50 1HH2 ARG 50 -24.835 -0.993 -5.836 402 HH22 ARG 50 2HH2 ARG 50 -26.282 -1.161 -6.771 403 H LEU 51 H LEU 51 -22.767 5.466 -7.999 404 HA LEU 51 HA LEU 51 -23.098 8.157 -9.087 405 HB2 LEU 51 1HB LEU 51 -21.286 5.857 -9.749 406 HB3 LEU 51 2HB LEU 51 -21.446 7.249 -10.818 407 HG LEU 51 HG LEU 51 -19.477 7.538 -9.499 408 HD11 LEU 51 1HD1 LEU 51 -19.829 9.688 -8.764 409 HD12 LEU 51 2HD1 LEU 51 -21.411 9.313 -8.082 410 HD13 LEU 51 3HD1 LEU 51 -21.215 9.452 -9.829 411 HD21 LEU 51 3HD2 LEU 51 -20.808 6.102 -7.566 412 HD22 LEU 51 1HD2 LEU 51 -20.729 7.724 -6.878 413 HD23 LEU 51 2HD2 LEU 51 -19.248 6.903 -7.372 414 H ILE 52 H ILE 52 -24.326 8.622 -10.810 415 HA ILE 52 HA ILE 52 -25.626 6.373 -12.201 416 HB ILE 52 HB ILE 52 -26.721 9.174 -12.023 417 HG12 ILE 52 1HG1 ILE 52 -26.552 8.332 -9.752 418 HG13 ILE 52 2HG1 ILE 52 -28.237 8.301 -10.260 419 HG21 ILE 52 1HG2 ILE 52 -28.277 8.416 -13.410 420 HG22 ILE 52 2HG2 ILE 52 -27.436 6.869 -13.496 421 HG23 ILE 52 3HG2 ILE 52 -28.684 7.127 -12.277 422 HD11 ILE 52 3HD1 ILE 52 -28.057 6.266 -9.252 423 HD12 ILE 52 1HD1 ILE 52 -27.660 5.830 -10.914 424 HD13 ILE 52 2HD1 ILE 52 -26.373 6.054 -9.728 425 H PHE 53 H PHE 53 -25.789 6.400 -14.426 426 HA PHE 53 HA PHE 53 -24.581 8.632 -15.878 427 HB2 PHE 53 1HB PHE 53 -22.797 6.933 -15.441 428 HB3 PHE 53 2HB PHE 53 -23.750 5.763 -16.348 429 HD1 PHE 53 HD2 PHE 53 -21.959 8.989 -16.619 430 HD2 PHE 53 HD1 PHE 53 -23.647 5.674 -18.686 431 HE1 PHE 53 HE2 PHE 53 -20.908 9.759 -18.706 432 HE2 PHE 53 HE1 PHE 53 -22.598 6.438 -20.776 433 HZ PHE 53 HZ PHE 53 -21.227 8.484 -20.788 434 H ALA 54 H ALA 54 -25.801 9.183 -17.554 435 HA ALA 54 HA ALA 54 -27.451 9.155 -19.125 436 HB1 ALA 54 1HB ALA 54 -27.113 7.658 -20.784 437 HB2 ALA 54 2HB ALA 54 -25.676 7.271 -19.836 438 HB3 ALA 54 3HB ALA 54 -27.125 6.276 -19.688 439 H GLY 55 H GLY 55 -28.192 8.524 -16.380 440 HA2 GLY 55 1HA GLY 55 -30.227 8.102 -15.360 441 HA3 GLY 55 2HA GLY 55 -30.850 7.556 -16.909 442 H LYS 56 H LYS 56 -27.911 6.147 -15.810 443 HA LYS 56 HA LYS 56 -29.341 3.809 -14.755 444 HB2 LYS 56 1HB LYS 56 -28.744 3.480 -17.175 445 HB3 LYS 56 2HB LYS 56 -27.051 3.617 -16.717 446 HG2 LYS 56 1HG LYS 56 -27.549 1.693 -15.089 447 HG3 LYS 56 2HG LYS 56 -29.010 1.454 -16.051 448 HD2 LYS 56 1HD LYS 56 -26.237 1.551 -17.227 449 HD3 LYS 56 2HD LYS 56 -27.033 0.056 -16.732 450 HE2 LYS 56 1HE LYS 56 -28.327 1.976 -18.643 451 HE3 LYS 56 2HE LYS 56 -27.191 0.747 -19.197 452 HZ1 LYS 56 3HZ LYS 56 -29.915 0.456 -18.250 453 HZ2 LYS 56 1HZ LYS 56 -28.831 -0.716 -17.690 454 HZ3 LYS 56 2HZ LYS 56 -29.044 -0.487 -19.352 455 H GLN 57 H GLN 57 -28.540 3.169 -12.868 456 HA GLN 57 HA GLN 57 -26.397 4.435 -11.597 457 HB2 GLN 57 1HB GLN 57 -26.602 2.694 -9.885 458 HB3 GLN 57 2HB GLN 57 -28.180 3.303 -10.367 459 HG2 GLN 57 1HG GLN 57 -27.143 0.898 -11.757 460 HG3 GLN 57 2HG GLN 57 -27.688 0.723 -10.089 461 HE21 GLN 57 2HE2 GLN 57 -29.838 2.110 -9.784 462 HE22 GLN 57 1HE2 GLN 57 -31.072 1.714 -10.926 463 H LEU 58 H LEU 58 -24.341 3.597 -10.937 464 HA LEU 58 HA LEU 58 -23.219 1.681 -12.874 465 HB2 LEU 58 1HB LEU 58 -21.653 3.747 -11.358 466 HB3 LEU 58 2HB LEU 58 -21.154 2.820 -12.771 467 HG LEU 58 HG LEU 58 -23.309 4.928 -12.814 468 HD11 LEU 58 1HD1 LEU 58 -21.659 6.413 -12.651 469 HD12 LEU 58 2HD1 LEU 58 -21.148 5.868 -14.248 470 HD13 LEU 58 3HD1 LEU 58 -20.416 5.171 -12.803 471 HD21 LEU 58 3HD2 LEU 58 -21.923 4.341 -15.283 472 HD22 LEU 58 1HD2 LEU 58 -23.652 4.350 -14.934 473 HD23 LEU 58 2HD2 LEU 58 -22.695 2.903 -14.613 474 H GLU 59 H GLU 59 -21.519 0.278 -12.118 475 HA GLU 59 HA GLU 59 -21.197 -0.015 -9.245 476 HB2 GLU 59 1HB GLU 59 -21.859 -2.376 -9.245 477 HB3 GLU 59 2HB GLU 59 -23.202 -1.335 -9.693 478 HG2 GLU 59 1HG GLU 59 -22.564 -1.850 -12.110 479 HG3 GLU 59 2HG GLU 59 -21.581 -3.150 -11.439 480 H ASP 60 H ASP 60 -19.592 -1.739 -8.718 481 HA ASP 60 HA ASP 60 -17.223 -1.377 -10.136 482 HB2 ASP 60 1HB ASP 60 -16.254 -3.000 -8.698 483 HB3 ASP 60 2HB ASP 60 -17.500 -2.196 -7.747 484 H GLY 61 H GLY 61 -15.910 -3.468 -10.853 485 HA2 GLY 61 1HA GLY 61 -15.912 -5.476 -12.127 486 HA3 GLY 61 2HA GLY 61 -17.595 -5.179 -12.539 487 H ARG 62 H ARG 62 -17.302 -2.469 -13.354 488 HA ARG 62 HA ARG 62 -15.716 -2.835 -15.811 489 HB2 ARG 62 1HB ARG 62 -18.455 -1.782 -15.349 490 HB3 ARG 62 2HB ARG 62 -17.488 -0.975 -16.576 491 HG2 ARG 62 1HG ARG 62 -17.108 -3.229 -17.614 492 HG3 ARG 62 2HG ARG 62 -18.311 -3.863 -16.490 493 HD2 ARG 62 1HD ARG 62 -19.942 -2.228 -17.380 494 HD3 ARG 62 2HD ARG 62 -18.736 -1.710 -18.557 495 HE ARG 62 HE ARG 62 -18.981 -4.437 -18.873 496 HH11 ARG 62 1HH1 ARG 62 -21.067 -1.659 -19.096 497 HH12 ARG 62 2HH1 ARG 62 -22.097 -2.365 -20.297 498 HH21 ARG 62 1HH2 ARG 62 -20.329 -5.378 -20.454 499 HH22 ARG 62 2HH2 ARG 62 -21.677 -4.482 -21.068 500 H THR 63 H THR 63 -15.129 -0.696 -16.859 501 HA THR 63 HA THR 63 -14.239 1.178 -14.766 502 HB THR 63 HB THR 63 -12.348 0.092 -15.816 503 HG1 THR 63 HG1 THR 63 -12.318 2.591 -17.088 504 HG21 THR 63 3HG2 THR 63 -12.320 1.078 -18.437 505 HG22 THR 63 1HG2 THR 63 -13.935 0.411 -18.202 506 HG23 THR 63 2HG2 THR 63 -12.516 -0.600 -17.930 507 H LEU 64 H LEU 64 -13.944 3.442 -15.499 508 HA LEU 64 HA LEU 64 -16.287 4.556 -16.451 509 HB2 LEU 64 1HB LEU 64 -13.496 5.691 -16.541 510 HB3 LEU 64 2HB LEU 64 -14.969 6.625 -16.797 511 HG LEU 64 HG LEU 64 -14.844 5.138 -14.257 512 HD11 LEU 64 1HD1 LEU 64 -12.761 5.780 -13.757 513 HD12 LEU 64 2HD1 LEU 64 -13.462 7.386 -13.562 514 HD13 LEU 64 3HD1 LEU 64 -12.694 6.938 -15.085 515 HD21 LEU 64 3HD2 LEU 64 -16.628 6.517 -14.198 516 HD22 LEU 64 1HD2 LEU 64 -15.930 7.647 -15.359 517 HD23 LEU 64 2HD2 LEU 64 -15.431 7.700 -13.668 518 H SER 65 H SER 65 -13.310 3.818 -18.230 519 HA SER 65 HA SER 65 -13.972 4.929 -20.685 520 HB2 SER 65 1HB SER 65 -11.778 4.195 -20.599 521 HB3 SER 65 2HB SER 65 -12.209 2.664 -19.837 522 HG SER 65 HG SER 65 -11.685 3.002 -22.333 523 H GLU 66 H GLU 66 -14.792 1.758 -19.356 524 HA GLU 66 HA GLU 66 -16.103 0.854 -21.734 525 HB2 GLU 66 1HB GLU 66 -15.891 -0.155 -18.919 526 HB3 GLU 66 2HB GLU 66 -17.066 -0.865 -20.017 527 HG2 GLU 66 1HG GLU 66 -14.112 -0.684 -20.557 528 HG3 GLU 66 2HG GLU 66 -14.934 -2.103 -19.910 529 H TYR 67 H TYR 67 -16.993 2.826 -19.077 530 HA TYR 67 HA TYR 67 -19.847 2.399 -19.442 531 HB2 TYR 67 1HB TYR 67 -18.189 4.007 -17.522 532 HB3 TYR 67 2HB TYR 67 -19.916 4.307 -17.677 533 HD1 TYR 67 HD1 TYR 67 -21.338 1.989 -17.663 534 HD2 TYR 67 HD2 TYR 67 -17.564 2.617 -15.801 535 HE1 TYR 67 HE1 TYR 67 -21.802 0.138 -16.110 536 HE2 TYR 67 HE2 TYR 67 -18.018 0.768 -14.244 537 HH TYR 67 HH TYR 67 -19.455 -0.794 -13.609 538 H ASN 68 H ASN 68 -17.756 3.851 -21.302 539 HA ASN 68 HA ASN 68 -17.802 5.533 -22.831 540 HB2 ASN 68 1HB ASN 68 -20.700 5.120 -22.213 541 HB3 ASN 68 2HB ASN 68 -20.230 6.489 -23.217 542 HD21 ASN 68 2HD2 ASN 68 -21.619 5.236 -24.734 543 HD22 ASN 68 1HD2 ASN 68 -20.846 4.045 -25.719 544 H ILE 69 H ILE 69 -17.591 6.082 -19.858 545 HA ILE 69 HA ILE 69 -18.694 8.718 -19.515 546 HB ILE 69 HB ILE 69 -16.666 7.237 -17.835 547 HG12 ILE 69 1HG1 ILE 69 -19.633 7.623 -17.389 548 HG13 ILE 69 2HG1 ILE 69 -18.907 6.150 -18.023 549 HG21 ILE 69 1HG2 ILE 69 -16.427 9.535 -17.354 550 HG22 ILE 69 2HG2 ILE 69 -18.169 9.802 -17.393 551 HG23 ILE 69 3HG2 ILE 69 -17.447 8.880 -16.074 552 HD11 ILE 69 3HD1 ILE 69 -19.350 5.851 -15.699 553 HD12 ILE 69 1HD1 ILE 69 -17.604 5.963 -15.920 554 HD13 ILE 69 2HD1 ILE 69 -18.505 7.345 -15.295 555 H GLN 70 H GLN 70 -17.870 10.236 -20.842 556 HA GLN 70 HA GLN 70 -15.094 10.317 -21.563 557 HB2 GLN 70 1HB GLN 70 -17.146 12.497 -21.948 558 HB3 GLN 70 2HB GLN 70 -15.652 12.263 -22.846 559 HG2 GLN 70 1HG GLN 70 -16.764 9.952 -23.435 560 HG3 GLN 70 2HG GLN 70 -18.245 10.834 -23.066 561 HE21 GLN 70 2HE2 GLN 70 -15.245 11.162 -24.924 562 HE22 GLN 70 1HE2 GLN 70 -15.967 11.954 -26.279 563 H LYS 71 H LYS 71 -14.392 12.944 -21.479 564 HA LYS 71 HA LYS 71 -13.836 13.294 -18.648 565 HB2 LYS 71 1HB LYS 71 -12.291 15.090 -19.458 566 HB3 LYS 71 2HB LYS 71 -11.945 13.492 -20.107 567 HG2 LYS 71 1HG LYS 71 -12.967 14.067 -22.206 568 HG3 LYS 71 2HG LYS 71 -13.493 15.624 -21.564 569 HD2 LYS 71 1HD LYS 71 -10.591 14.903 -21.534 570 HD3 LYS 71 2HD LYS 71 -11.338 15.479 -23.026 571 HE2 LYS 71 1HE LYS 71 -11.787 17.009 -20.509 572 HE3 LYS 71 2HE LYS 71 -10.227 17.149 -21.319 573 HZ1 LYS 71 3HZ LYS 71 -11.106 18.391 -22.929 574 HZ2 LYS 71 1HZ LYS 71 -12.443 18.590 -21.912 575 HZ3 LYS 71 2HZ LYS 71 -12.461 17.394 -23.107 576 H GLU 72 H GLU 72 -16.083 14.411 -20.888 577 HA GLU 72 HA GLU 72 -16.647 16.785 -19.234 578 HB2 GLU 72 1HB GLU 72 -17.125 16.345 -22.184 579 HB3 GLU 72 2HB GLU 72 -17.785 17.701 -21.280 580 HG2 GLU 72 1HG GLU 72 -15.530 18.454 -20.744 581 HG3 GLU 72 2HG GLU 72 -14.859 17.086 -21.631 582 H SER 73 H SER 73 -17.575 13.801 -19.386 583 HA SER 73 HA SER 73 -20.317 13.800 -20.009 584 HB2 SER 73 1HB SER 73 -18.621 12.035 -18.249 585 HB3 SER 73 2HB SER 73 -20.350 11.756 -18.456 586 HG SER 73 HG SER 73 -19.593 11.984 -20.855 587 H THR 74 H THR 74 -21.821 12.957 -18.014 588 HA THR 74 HA THR 74 -21.590 14.961 -15.870 589 HB THR 74 HB THR 74 -24.303 14.221 -16.875 590 HG1 THR 74 HG1 THR 74 -22.647 16.226 -18.049 591 HG21 THR 74 3HG2 THR 74 -23.387 15.847 -14.876 592 HG22 THR 74 1HG2 THR 74 -24.975 15.969 -15.631 593 HG23 THR 74 2HG2 THR 74 -23.652 16.994 -16.188 594 H LEU 75 H LEU 75 -21.356 13.892 -14.023 595 HA LEU 75 HA LEU 75 -22.726 11.315 -13.684 596 HB2 LEU 75 1HB LEU 75 -20.207 12.477 -12.642 597 HB3 LEU 75 2HB LEU 75 -21.093 11.389 -11.576 598 HG LEU 75 HG LEU 75 -19.353 10.194 -12.771 599 HD11 LEU 75 1HD1 LEU 75 -20.747 8.476 -12.654 600 HD12 LEU 75 2HD1 LEU 75 -21.347 8.887 -14.261 601 HD13 LEU 75 3HD1 LEU 75 -22.139 9.546 -12.830 602 HD21 LEU 75 3HD2 LEU 75 -19.548 9.912 -15.239 603 HD22 LEU 75 1HD2 LEU 75 -19.107 11.543 -14.733 604 HD23 LEU 75 2HD2 LEU 75 -20.759 11.195 -15.242 605 H HIS 76 H HIS 76 -24.001 10.904 -11.891 606 HA HIS 76 HA HIS 76 -24.676 13.242 -10.230 607 HB2 HIS 76 1HB HIS 76 -26.426 11.372 -11.740 608 HB3 HIS 76 2HB HIS 76 -26.989 11.892 -10.154 609 HD1 HIS 76 HD1 HIS 76 -27.354 14.503 -9.849 610 HD2 HIS 76 HD2 HIS 76 -26.691 13.229 -13.748 611 HE1 HIS 76 HE1 HIS 76 -28.081 16.414 -11.314 612 H LEU 77 H LEU 77 -24.927 12.917 -8.064 613 HA LEU 77 HA LEU 77 -24.218 10.241 -7.077 614 HB2 LEU 77 1HB LEU 77 -24.189 12.635 -5.315 615 HB3 LEU 77 2HB LEU 77 -23.157 11.207 -5.292 616 HG LEU 77 HG LEU 77 -22.966 13.409 -7.344 617 HD11 LEU 77 1HD1 LEU 77 -22.120 14.586 -5.627 618 HD12 LEU 77 2HD1 LEU 77 -20.698 13.576 -5.882 619 HD13 LEU 77 3HD1 LEU 77 -21.866 13.153 -4.631 620 HD21 LEU 77 3HD2 LEU 77 -21.978 11.608 -8.359 621 HD22 LEU 77 1HD2 LEU 77 -21.502 10.867 -6.832 622 HD23 LEU 77 2HD2 LEU 77 -20.608 12.253 -7.455 623 H VAL 78 H VAL 78 -25.844 9.064 -6.335 624 HA VAL 78 HA VAL 78 -28.152 10.441 -5.127 625 HB VAL 78 HB VAL 78 -29.358 8.242 -5.608 626 HG11 VAL 78 1HG1 VAL 78 -28.427 9.855 -7.981 627 HG12 VAL 78 2HG1 VAL 78 -29.911 8.907 -7.864 628 HG13 VAL 78 3HG1 VAL 78 -29.699 10.344 -6.863 629 HG21 VAL 78 3HG2 VAL 78 -26.898 7.307 -6.236 630 HG22 VAL 78 1HG2 VAL 78 -28.404 6.602 -6.824 631 HG23 VAL 78 2HG2 VAL 78 -27.504 7.731 -7.837 632 H LEU 79 H LEU 79 -28.372 10.224 -3.007 633 HA LEU 79 HA LEU 79 -26.897 8.116 -1.622 634 HB2 LEU 79 1HB LEU 79 -28.468 10.244 -0.236 635 HB3 LEU 79 2HB LEU 79 -27.007 9.410 0.292 636 HG LEU 79 HG LEU 79 -27.169 11.554 -1.825 637 HD11 LEU 79 1HD1 LEU 79 -25.533 12.539 0.038 638 HD12 LEU 79 2HD1 LEU 79 -26.564 11.547 1.070 639 HD13 LEU 79 3HD1 LEU 79 -27.277 12.804 0.059 640 HD21 LEU 79 3HD2 LEU 79 -24.793 11.408 -1.987 641 HD22 LEU 79 1HD2 LEU 79 -25.444 9.786 -2.225 642 HD23 LEU 79 2HD2 LEU 79 -24.719 10.227 -0.678 643 H ARG 80 H ARG 80 -27.839 6.525 -0.433 644 HA ARG 80 HA ARG 80 -30.648 6.025 -0.924 645 HB2 ARG 80 1HB ARG 80 -28.835 4.260 -1.051 646 HB3 ARG 80 2HB ARG 80 -28.740 4.346 0.703 647 HG2 ARG 80 1HG ARG 80 -30.147 2.557 0.384 648 HG3 ARG 80 2HG ARG 80 -31.291 3.882 0.607 649 HD2 ARG 80 1HD ARG 80 -31.807 3.979 -1.665 650 HD3 ARG 80 2HD ARG 80 -30.345 3.110 -2.128 651 HE ARG 80 HE ARG 80 -31.862 1.378 -0.581 652 HH11 ARG 80 1HH1 ARG 80 -32.140 3.056 -3.618 653 HH12 ARG 80 2HH1 ARG 80 -33.159 1.854 -4.338 654 HH21 ARG 80 1HH2 ARG 80 -33.203 -0.212 -1.518 655 HH22 ARG 80 2HH2 ARG 80 -33.763 -0.004 -3.143 656 H LEU 81 H LEU 81 -28.556 6.840 1.781 657 HA LEU 81 HA LEU 81 -30.793 6.705 3.649 658 HB2 LEU 81 1HB LEU 81 -27.836 7.015 3.910 659 HB3 LEU 81 2HB LEU 81 -28.880 7.533 5.232 660 HG LEU 81 HG LEU 81 -29.833 5.179 5.209 661 HD11 LEU 81 1HD1 LEU 81 -27.531 3.881 4.210 662 HD12 LEU 81 2HD1 LEU 81 -28.097 4.991 2.962 663 HD13 LEU 81 3HD1 LEU 81 -29.190 3.775 3.622 664 HD21 LEU 81 3HD2 LEU 81 -26.957 5.695 5.944 665 HD22 LEU 81 1HD2 LEU 81 -27.861 4.265 6.443 666 HD23 LEU 81 2HD2 LEU 81 -28.380 5.865 6.974 667 H ARG 82 H ARG 82 -30.813 8.594 5.302 668 HA ARG 82 HA ARG 82 -31.436 10.967 3.828 669 HB2 ARG 82 1HB ARG 82 -31.986 11.901 6.079 670 HB3 ARG 82 2HB ARG 82 -32.822 10.400 5.703 671 HG2 ARG 82 1HG ARG 82 -31.741 9.229 7.313 672 HG3 ARG 82 2HG ARG 82 -30.260 10.178 7.164 673 HD2 ARG 82 1HD ARG 82 -30.854 11.411 8.912 674 HD3 ARG 82 2HD ARG 82 -32.340 11.885 8.091 675 HE ARG 82 HE ARG 82 -32.070 9.959 10.192 676 HH11 ARG 82 1HH1 ARG 82 -33.962 10.883 7.420 677 HH12 ARG 82 2HH1 ARG 82 -35.403 10.102 7.980 678 HH21 ARG 82 1HH2 ARG 82 -33.961 8.927 10.941 679 HH22 ARG 82 2HH2 ARG 82 -35.402 8.991 9.983 680 H GLY 83 H GLY 83 -28.720 9.830 5.667 681 HA2 GLY 83 1HA GLY 83 -26.589 10.950 5.061 682 HA3 GLY 83 2HA GLY 83 -27.435 12.469 5.314 683 H TYR 84 H TYR 84 -26.265 9.559 6.938 684 HA TYR 84 HA TYR 84 -26.028 11.147 9.407 685 HB2 TYR 84 1HB TYR 84 -27.863 9.398 9.459 686 HB3 TYR 84 2HB TYR 84 -26.595 8.182 9.344 687 HD1 TYR 84 HD2 TYR 84 -24.756 8.249 11.163 688 HD2 TYR 84 HD1 TYR 84 -28.516 10.203 11.544 689 HE1 TYR 84 HE2 TYR 84 -24.471 8.308 13.606 690 HE2 TYR 84 HE1 TYR 84 -28.242 10.269 13.987 691 HH TYR 84 HH TYR 84 -26.868 8.800 15.725 692 H ALA 85 H ALA 85 -24.963 7.965 8.194 693 HA ALA 85 HA ALA 85 -22.544 7.901 9.577 694 HB1 ALA 85 1HB ALA 85 -22.580 6.589 6.935 695 HB2 ALA 85 2HB ALA 85 -22.183 5.936 8.524 696 HB3 ALA 85 3HB ALA 85 -23.870 6.133 8.048 697 H ASP 86 H ASP 86 -20.642 8.877 9.309 698 HA ASP 86 HA ASP 86 -19.888 9.925 6.693 699 HB2 ASP 86 1HB ASP 86 -19.202 12.108 7.795 700 HB3 ASP 86 2HB ASP 86 -20.934 11.859 7.592 701 H LEU 87 H LEU 87 -17.685 10.065 6.366 702 HA LEU 87 HA LEU 87 -15.984 9.151 8.591 703 HB2 LEU 87 1HB LEU 87 -15.755 8.415 5.677 704 HB3 LEU 87 2HB LEU 87 -14.614 7.952 6.938 705 HG LEU 87 HG LEU 87 -17.509 7.107 6.875 706 HD11 LEU 87 1HD1 LEU 87 -16.227 6.216 4.959 707 HD12 LEU 87 2HD1 LEU 87 -16.744 4.964 6.088 708 HD13 LEU 87 3HD1 LEU 87 -15.070 5.518 6.093 709 HD21 LEU 87 3HD2 LEU 87 -15.201 6.009 8.471 710 HD22 LEU 87 1HD2 LEU 87 -16.906 5.582 8.609 711 HD23 LEU 87 2HD2 LEU 87 -16.358 7.187 9.093 712 H ARG 88 H ARG 88 -13.555 9.513 7.899 713 HA ARG 88 HA ARG 88 -12.945 11.721 6.240 714 HB2 ARG 88 1HB ARG 88 -14.150 12.761 8.278 715 HB3 ARG 88 2HB ARG 88 -12.675 12.384 9.158 716 HG2 ARG 88 1HG ARG 88 -11.413 13.904 7.958 717 HG3 ARG 88 2HG ARG 88 -12.546 13.928 6.605 718 HD2 ARG 88 1HD ARG 88 -14.043 15.311 7.720 719 HD3 ARG 88 2HD ARG 88 -13.386 14.905 9.305 720 HE ARG 88 HE ARG 88 -11.338 16.164 8.003 721 HH11 ARG 88 1HH1 ARG 88 -14.627 16.969 8.810 722 HH12 ARG 88 2HH1 ARG 88 -14.318 18.669 8.936 723 HH21 ARG 88 1HH2 ARG 88 -10.918 18.400 8.165 724 HH22 ARG 88 2HH2 ARG 88 -12.208 19.482 8.568 725 H GLU 89 H GLU 89 -10.734 12.024 6.009 726 HA GLU 89 HA GLU 89 -8.994 10.366 7.703 727 HB2 GLU 89 1HB GLU 89 -7.678 9.838 5.608 728 HB3 GLU 89 2HB GLU 89 -9.247 9.056 5.741 729 HG2 GLU 89 1HG GLU 89 -10.185 10.347 4.078 730 HG3 GLU 89 2HG GLU 89 -8.999 11.638 4.268 731 H ASP 90 H ASP 90 -9.570 13.244 7.665 732 HA ASP 90 HA ASP 90 -8.449 15.210 7.901 733 HB2 ASP 90 1HB ASP 90 -6.440 13.139 8.360 734 HB3 ASP 90 2HB ASP 90 -5.744 14.646 7.769 735 HA PRO 91 HA PRO 91 -7.404 16.724 3.921 736 HB2 PRO 91 1HB PRO 91 -5.707 18.767 4.484 737 HB3 PRO 91 2HB PRO 91 -7.442 18.841 4.814 738 HG2 PRO 91 1HG PRO 91 -5.183 18.235 6.683 739 HG3 PRO 91 2HG PRO 91 -6.607 19.260 6.943 740 HD2 PRO 91 1HD PRO 91 -6.435 16.734 7.903 741 HD3 PRO 91 2HD PRO 91 -7.974 17.461 7.400 742 H ASP 92 H ASP 92 -6.267 15.104 2.888 743 HA ASP 92 HA ASP 92 -3.336 15.166 3.190 744 HB2 ASP 92 1HB ASP 92 -5.096 12.884 2.265 745 HB3 ASP 92 2HB ASP 92 -3.337 12.842 2.357 746 H ARG 93 H ARG 93 -4.205 17.107 1.629 747 HA ARG 93 HA ARG 93 -3.793 16.109 -1.114 748 HB2 ARG 93 1HB ARG 93 -5.456 18.459 -0.193 749 HB3 ARG 93 2HB ARG 93 -5.092 18.100 -1.875 750 HG2 ARG 93 1HG ARG 93 -7.103 17.084 -1.758 751 HG3 ARG 93 2HG ARG 93 -6.119 15.744 -1.165 752 HD2 ARG 93 1HD ARG 93 -8.004 16.008 0.293 753 HD3 ARG 93 2HD ARG 93 -6.554 16.528 1.152 754 HE ARG 93 HE ARG 93 -7.501 18.833 0.115 755 HH11 ARG 93 1HH1 ARG 93 -8.963 16.294 1.995 756 HH12 ARG 93 2HH1 ARG 93 -10.100 17.346 2.772 757 HH21 ARG 93 1HH2 ARG 93 -8.994 20.228 1.130 758 HH22 ARG 93 2HH2 ARG 93 -10.117 19.583 2.278 759 H GLN 94 H GLN 94 -2.977 17.951 -2.583 760 HA GLN 94 HA GLN 94 -1.347 19.955 -1.318 761 HB2 GLN 94 1HB GLN 94 0.797 19.151 -2.012 762 HB3 GLN 94 2HB GLN 94 0.017 17.863 -1.104 763 HG2 GLN 94 1HG GLN 94 -0.700 16.910 -3.334 764 HG3 GLN 94 2HG GLN 94 0.411 18.063 -4.072 765 HE21 GLN 94 2HE2 GLN 94 2.649 18.032 -2.978 766 HE22 GLN 94 1HE2 GLN 94 3.327 16.463 -2.726 767 H ASP 95 H ASP 95 -0.010 21.142 -3.009 768 HA ASP 95 HA ASP 95 -1.601 21.319 -5.476 769 HB2 ASP 95 1HB ASP 95 0.274 23.464 -4.523 770 HB3 ASP 95 2HB ASP 95 -1.134 23.611 -5.570 771 H HIS 96 H HIS 96 1.734 21.483 -4.266 772 HA HIS 96 HA HIS 96 3.084 21.711 -6.668 773 HB2 HIS 96 1HB HIS 96 3.968 20.074 -4.283 774 HB3 HIS 96 2HB HIS 96 5.010 20.746 -5.534 775 HD1 HIS 96 HD1 HIS 96 4.712 23.542 -5.678 776 HD2 HIS 96 HD2 HIS 96 3.909 21.625 -2.081 777 HE1 HIS 96 HE1 HIS 96 4.865 25.329 -3.915 778 H HIS 97 H HIS 97 3.489 20.408 -8.347 779 HA HIS 97 HA HIS 97 3.639 17.596 -8.224 780 HB2 HIS 97 1HB HIS 97 1.164 17.899 -7.916 781 HB3 HIS 97 2HB HIS 97 1.108 18.620 -9.522 782 HD1 HIS 97 HD1 HIS 97 0.512 17.024 -11.303 783 HD2 HIS 97 HD2 HIS 97 2.364 15.131 -8.102 784 HE1 HIS 97 HE1 HIS 97 0.512 14.576 -11.879 785 HA PRO 98 HA PRO 98 5.403 19.774 -11.941 786 HB2 PRO 98 1HB PRO 98 7.925 18.829 -11.600 787 HB3 PRO 98 2HB PRO 98 7.341 20.306 -10.826 788 HG2 PRO 98 1HG PRO 98 7.600 17.548 -9.692 789 HG3 PRO 98 2HG PRO 98 8.014 19.106 -8.952 790 HD2 PRO 98 1HD PRO 98 5.724 17.782 -8.374 791 HD3 PRO 98 2HD PRO 98 5.829 19.554 -8.371 792 H GLY 99 H GLY 99 7.131 18.542 -13.506 793 HA2 GLY 99 1HA GLY 99 6.665 15.702 -13.697 794 HA3 GLY 99 2HA GLY 99 5.796 16.635 -14.907 795 H SER 100 H SER 100 7.260 15.109 -16.205 796 HA SER 100 HA SER 100 10.004 16.041 -16.445 797 HB2 SER 100 1HB SER 100 9.445 13.608 -16.558 798 HB3 SER 100 2HB SER 100 8.574 13.917 -18.059 799 HG SER 100 HG SER 100 11.320 14.494 -17.633 800 H GLY 101 H GLY 101 10.663 17.515 -17.866 801 HA2 GLY 101 1HA GLY 101 8.808 18.252 -20.044 802 HA3 GLY 101 2HA GLY 101 9.900 19.378 -19.252 803 H ALA 102 H ALA 102 12.239 18.975 -19.539 804 HA ALA 102 HA ALA 102 12.979 18.896 -22.196 805 HB1 ALA 102 1HB ALA 102 15.307 18.354 -21.253 806 HB2 ALA 102 2HB ALA 102 14.527 19.850 -20.739 807 HB3 ALA 102 3HB ALA 102 14.531 18.447 -19.672 808 H GLN 103 H GLN 103 13.027 17.320 -23.647 809 HA GLN 103 HA GLN 103 13.640 14.587 -22.759 810 HB2 GLN 103 1HB GLN 103 11.224 14.719 -23.051 811 HB3 GLN 103 2HB GLN 103 11.434 15.383 -24.666 812 HG2 GLN 103 1HG GLN 103 10.853 13.067 -24.836 813 HG3 GLN 103 2HG GLN 103 12.525 13.281 -25.353 814 HE21 GLN 103 2HE2 GLN 103 14.082 12.150 -24.370 815 HE22 GLN 103 1HE2 GLN 103 13.845 11.122 -23.002 Start of MODEL 11 1 H1 GLY 1 H GLY 1 6.916 12.943 -2.671 2 HA2 GLY 1 1HA GLY 1 5.336 10.580 -2.834 3 HA3 GLY 1 2HA GLY 1 4.912 11.701 -4.119 4 H SER 2 H SER 2 6.599 9.035 -3.617 5 HA SER 2 HA SER 2 9.110 9.695 -4.843 6 HB2 SER 2 1HB SER 2 8.799 7.794 -3.239 7 HB3 SER 2 2HB SER 2 7.869 6.959 -4.482 8 HG SER 2 HG SER 2 9.875 6.224 -4.806 9 H LEU 3 H LEU 3 6.168 8.000 -5.893 10 HA LEU 3 HA LEU 3 6.974 8.522 -8.677 11 HB2 LEU 3 1HB LEU 3 7.241 6.141 -8.081 12 HB3 LEU 3 2HB LEU 3 5.531 6.077 -7.661 13 HG LEU 3 HG LEU 3 5.122 6.777 -10.106 14 HD11 LEU 3 1HD1 LEU 3 7.986 5.859 -10.238 15 HD12 LEU 3 2HD1 LEU 3 7.331 7.417 -10.740 16 HD13 LEU 3 3HD1 LEU 3 6.914 5.955 -11.635 17 HD21 LEU 3 3HD2 LEU 3 4.835 4.563 -10.688 18 HD22 LEU 3 1HD2 LEU 3 4.883 4.469 -8.927 19 HD23 LEU 3 2HD2 LEU 3 6.312 4.046 -9.871 20 H VAL 4 H VAL 4 5.456 9.390 -9.981 21 HA VAL 4 HA VAL 4 2.768 9.778 -8.835 22 HB VAL 4 HB VAL 4 2.687 11.771 -10.445 23 HG11 VAL 4 1HG1 VAL 4 3.224 13.145 -8.720 24 HG12 VAL 4 2HG1 VAL 4 3.230 11.617 -7.837 25 HG13 VAL 4 3HG1 VAL 4 4.749 12.322 -8.393 26 HG21 VAL 4 3HG2 VAL 4 4.650 12.651 -11.324 27 HG22 VAL 4 1HG2 VAL 4 5.674 11.703 -10.245 28 HG23 VAL 4 2HG2 VAL 4 4.843 10.918 -11.588 29 HA PRO 5 HA PRO 5 0.943 7.732 -12.264 30 HB2 PRO 5 1HB PRO 5 -1.345 9.156 -12.588 31 HB3 PRO 5 2HB PRO 5 -1.084 8.054 -11.231 32 HG2 PRO 5 1HG PRO 5 -0.811 11.033 -11.331 33 HG3 PRO 5 2HG PRO 5 -1.543 10.018 -10.075 34 HD2 PRO 5 1HD PRO 5 0.953 11.043 -9.848 35 HD3 PRO 5 2HD PRO 5 0.496 9.478 -9.146 36 H ARG 6 H ARG 6 1.068 7.779 -14.440 37 HA ARG 6 HA ARG 6 1.982 10.224 -15.702 38 HB2 ARG 6 1HB ARG 6 1.756 7.360 -16.592 39 HB3 ARG 6 2HB ARG 6 2.093 8.646 -17.743 40 HG2 ARG 6 1HG ARG 6 4.211 7.959 -17.232 41 HG3 ARG 6 2HG ARG 6 3.994 9.250 -16.048 42 HD2 ARG 6 1HD ARG 6 3.780 7.786 -14.289 43 HD3 ARG 6 2HD ARG 6 3.201 6.474 -15.315 44 HE ARG 6 HE ARG 6 5.899 7.140 -15.912 45 HH11 ARG 6 1HH1 ARG 6 3.897 5.463 -13.610 46 HH12 ARG 6 2HH1 ARG 6 5.145 4.359 -13.132 47 HH21 ARG 6 1HH2 ARG 6 7.550 5.693 -15.292 48 HH22 ARG 6 2HH2 ARG 6 7.222 4.492 -14.089 49 H GLY 7 H GLY 7 -0.808 8.069 -15.810 50 HA2 GLY 7 1HA GLY 7 -2.081 9.823 -17.796 51 HA3 GLY 7 2HA GLY 7 -2.612 8.203 -17.370 52 H SER 8 H SER 8 -4.243 10.556 -17.504 53 HA SER 8 HA SER 8 -5.702 10.276 -15.118 54 HB2 SER 8 1HB SER 8 -5.369 12.533 -14.150 55 HB3 SER 8 2HB SER 8 -3.897 11.564 -14.097 56 HG SER 8 HG SER 8 -3.031 12.766 -15.696 57 H MET 9 H MET 9 -7.638 11.556 -15.092 58 HA MET 9 HA MET 9 -8.173 13.313 -17.326 59 HB2 MET 9 1HB MET 9 -8.623 11.252 -18.438 60 HB3 MET 9 2HB MET 9 -9.509 10.622 -17.056 61 HG2 MET 9 1HG MET 9 -11.329 12.088 -17.442 62 HG3 MET 9 2HG MET 9 -10.413 13.014 -18.629 63 HE1 MET 9 3HE MET 9 -12.733 9.181 -19.113 64 HE2 MET 9 1HE MET 9 -11.136 8.858 -18.437 65 HE3 MET 9 2HE MET 9 -12.227 9.979 -17.623 66 H GLN 10 H GLN 10 -9.685 14.804 -16.827 67 HA GLN 10 HA GLN 10 -10.949 14.579 -14.196 68 HB2 GLN 10 1HB GLN 10 -11.144 16.938 -14.197 69 HB3 GLN 10 2HB GLN 10 -9.545 16.591 -14.843 70 HG2 GLN 10 1HG GLN 10 -11.056 16.678 -17.109 71 HG3 GLN 10 2HG GLN 10 -11.843 17.888 -16.096 72 HE21 GLN 10 2HE2 GLN 10 -9.688 17.593 -18.445 73 HE22 GLN 10 1HE2 GLN 10 -8.619 18.899 -18.079 74 H ILE 11 H ILE 11 -13.131 14.667 -13.886 75 HA ILE 11 HA ILE 11 -14.817 14.783 -16.299 76 HB ILE 11 HB ILE 11 -16.267 13.076 -15.409 77 HG12 ILE 11 1HG1 ILE 11 -14.361 12.962 -13.060 78 HG13 ILE 11 2HG1 ILE 11 -16.003 13.598 -13.022 79 HG21 ILE 11 1HG2 ILE 11 -14.771 11.141 -15.505 80 HG22 ILE 11 2HG2 ILE 11 -14.370 12.332 -16.741 81 HG23 ILE 11 3HG2 ILE 11 -13.382 12.205 -15.286 82 HD11 ILE 11 3HD1 ILE 11 -15.107 10.930 -12.640 83 HD12 ILE 11 1HD1 ILE 11 -16.741 11.581 -12.515 84 HD13 ILE 11 2HD1 ILE 11 -16.146 10.982 -14.064 85 H PHE 12 H PHE 12 -17.194 15.111 -15.671 86 HA PHE 12 HA PHE 12 -17.309 17.187 -13.586 87 HB2 PHE 12 1HB PHE 12 -18.982 16.872 -16.087 88 HB3 PHE 12 2HB PHE 12 -19.221 18.119 -14.868 89 HD1 PHE 12 HD2 PHE 12 -17.002 19.493 -14.315 90 HD2 PHE 12 HD1 PHE 12 -17.789 17.433 -17.956 91 HE1 PHE 12 HE2 PHE 12 -15.386 20.938 -15.478 92 HE2 PHE 12 HE1 PHE 12 -16.173 18.874 -19.125 93 HZ PHE 12 HZ PHE 12 -14.970 20.630 -17.886 94 H VAL 13 H VAL 13 -18.599 16.876 -11.892 95 HA VAL 13 HA VAL 13 -20.725 14.846 -12.094 96 HB VAL 13 HB VAL 13 -19.037 15.294 -9.633 97 HG11 VAL 13 1HG1 VAL 13 -20.271 13.691 -8.603 98 HG12 VAL 13 2HG1 VAL 13 -21.503 14.278 -9.722 99 HG13 VAL 13 3HG1 VAL 13 -20.589 12.817 -10.101 100 HG21 VAL 13 3HG2 VAL 13 -17.455 14.269 -10.901 101 HG22 VAL 13 1HG2 VAL 13 -18.339 12.833 -10.386 102 HG23 VAL 13 2HG2 VAL 13 -18.638 13.528 -11.979 103 H LYS 14 H LYS 14 -22.671 15.436 -11.340 104 HA LYS 14 HA LYS 14 -22.908 18.105 -10.151 105 HB2 LYS 14 1HB LYS 14 -24.760 16.344 -11.714 106 HB3 LYS 14 2HB LYS 14 -25.427 17.591 -10.668 107 HG2 LYS 14 1HG LYS 14 -25.294 18.593 -12.768 108 HG3 LYS 14 2HG LYS 14 -23.887 19.208 -11.899 109 HD2 LYS 14 1HD LYS 14 -22.414 17.794 -13.073 110 HD3 LYS 14 2HD LYS 14 -23.734 16.789 -13.678 111 HE2 LYS 14 1HE LYS 14 -23.285 19.679 -14.418 112 HE3 LYS 14 2HE LYS 14 -22.777 18.301 -15.394 113 HZ1 LYS 14 3HZ LYS 14 -24.771 18.578 -16.347 114 HZ2 LYS 14 1HZ LYS 14 -25.410 19.445 -15.043 115 HZ3 LYS 14 2HZ LYS 14 -25.367 17.755 -14.994 116 H THR 15 H THR 15 -23.531 18.400 -8.106 117 HA THR 15 HA THR 15 -24.137 16.039 -6.496 118 HB THR 15 HB THR 15 -23.756 17.472 -4.549 119 HG1 THR 15 HG1 THR 15 -23.206 19.537 -6.439 120 HG21 THR 15 3HG2 THR 15 -21.859 16.492 -6.168 121 HG22 THR 15 1HG2 THR 15 -21.488 17.390 -4.698 122 HG23 THR 15 2HG2 THR 15 -21.452 18.205 -6.261 123 H LEU 16 H LEU 16 -25.736 16.462 -4.641 124 HA LEU 16 HA LEU 16 -28.277 16.992 -5.789 125 HB2 LEU 16 1HB LEU 16 -29.165 16.551 -3.577 126 HB3 LEU 16 2HB LEU 16 -27.954 15.348 -4.016 127 HG LEU 16 HG LEU 16 -26.837 17.566 -2.494 128 HD11 LEU 16 1HD1 LEU 16 -28.905 17.700 -1.363 129 HD12 LEU 16 2HD1 LEU 16 -27.849 16.728 -0.338 130 HD13 LEU 16 3HD1 LEU 16 -29.084 15.946 -1.326 131 HD21 LEU 16 3HD2 LEU 16 -26.739 14.602 -2.583 132 HD22 LEU 16 1HD2 LEU 16 -26.277 15.395 -1.076 133 HD23 LEU 16 2HD2 LEU 16 -25.427 15.781 -2.573 134 H THR 17 H THR 17 -25.940 18.968 -4.274 135 HA THR 17 HA THR 17 -27.867 21.038 -3.559 136 HB THR 17 HB THR 17 -26.027 20.609 -1.995 137 HG1 THR 17 HG1 THR 17 -25.729 22.720 -1.607 138 HG21 THR 17 3HG2 THR 17 -23.726 21.448 -2.719 139 HG22 THR 17 1HG2 THR 17 -24.324 21.316 -4.372 140 HG23 THR 17 2HG2 THR 17 -24.239 19.883 -3.348 141 H GLY 18 H GLY 18 -27.045 20.153 -6.388 142 HA2 GLY 18 1HA GLY 18 -26.836 21.184 -8.428 143 HA3 GLY 18 2HA GLY 18 -27.282 22.676 -7.614 144 H LYS 19 H LYS 19 -24.517 20.978 -6.456 145 HA LYS 19 HA LYS 19 -22.807 23.115 -7.510 146 HB2 LYS 19 1HB LYS 19 -22.737 22.893 -5.108 147 HB3 LYS 19 2HB LYS 19 -22.414 21.168 -5.233 148 HG2 LYS 19 1HG LYS 19 -20.493 22.983 -6.558 149 HG3 LYS 19 2HG LYS 19 -20.508 22.976 -4.793 150 HD2 LYS 19 1HD LYS 19 -20.519 20.346 -5.198 151 HD3 LYS 19 2HD LYS 19 -19.738 20.836 -6.703 152 HE2 LYS 19 1HE LYS 19 -18.047 20.386 -5.053 153 HE3 LYS 19 2HE LYS 19 -18.088 22.119 -5.373 154 HZ1 LYS 19 3HZ LYS 19 -18.376 20.812 -2.921 155 HZ2 LYS 19 1HZ LYS 19 -19.853 21.560 -3.271 156 HZ3 LYS 19 2HZ LYS 19 -18.431 22.474 -3.231 157 H THR 20 H THR 20 -21.477 22.710 -9.140 158 HA THR 20 HA THR 20 -21.077 19.975 -10.032 159 HB THR 20 HB THR 20 -19.758 22.272 -11.402 160 HG1 THR 20 HG1 THR 20 -22.560 21.741 -11.478 161 HG21 THR 20 3HG2 THR 20 -19.396 20.254 -12.504 162 HG22 THR 20 1HG2 THR 20 -20.771 20.931 -13.376 163 HG23 THR 20 2HG2 THR 20 -21.026 19.667 -12.172 164 H ILE 21 H ILE 21 -19.398 18.801 -9.409 165 HA ILE 21 HA ILE 21 -16.917 20.191 -8.635 166 HB ILE 21 HB ILE 21 -17.865 19.185 -6.674 167 HG12 ILE 21 1HG1 ILE 21 -15.333 18.784 -7.465 168 HG13 ILE 21 2HG1 ILE 21 -15.952 18.188 -5.929 169 HG21 ILE 21 1HG2 ILE 21 -18.079 16.694 -8.350 170 HG22 ILE 21 2HG2 ILE 21 -18.249 16.706 -6.595 171 HG23 ILE 21 3HG2 ILE 21 -19.386 17.608 -7.597 172 HD11 ILE 21 3HD1 ILE 21 -14.595 16.603 -7.423 173 HD12 ILE 21 1HD1 ILE 21 -16.083 16.005 -6.688 174 HD13 ILE 21 2HD1 ILE 21 -16.069 16.490 -8.384 175 H THR 22 H THR 22 -15.062 19.585 -9.590 176 HA THR 22 HA THR 22 -15.224 17.618 -11.729 177 HB THR 22 HB THR 22 -12.775 19.231 -11.062 178 HG1 THR 22 HG1 THR 22 -13.641 20.977 -11.992 179 HG21 THR 22 3HG2 THR 22 -13.756 18.597 -13.807 180 HG22 THR 22 1HG2 THR 22 -13.004 17.317 -12.856 181 HG23 THR 22 2HG2 THR 22 -12.105 18.790 -13.219 182 H LEU 23 H LEU 23 -14.547 15.595 -11.509 183 HA LEU 23 HA LEU 23 -12.745 14.952 -9.273 184 HB2 LEU 23 1HB LEU 23 -15.155 13.948 -9.585 185 HB3 LEU 23 2HB LEU 23 -14.327 12.876 -10.712 186 HG LEU 23 HG LEU 23 -12.806 12.211 -8.842 187 HD11 LEU 23 1HD1 LEU 23 -13.924 12.676 -6.538 188 HD12 LEU 23 2HD1 LEU 23 -14.611 14.074 -7.364 189 HD13 LEU 23 3HD1 LEU 23 -12.861 13.883 -7.260 190 HD21 LEU 23 3HD2 LEU 23 -14.304 10.545 -9.086 191 HD22 LEU 23 1HD2 LEU 23 -15.688 11.637 -9.046 192 HD23 LEU 23 2HD2 LEU 23 -14.913 11.142 -7.541 193 H GLU 24 H GLU 24 -11.076 13.403 -9.604 194 HA GLU 24 HA GLU 24 -10.170 13.277 -12.402 195 HB2 GLU 24 1HB GLU 24 -8.669 13.392 -9.798 196 HB3 GLU 24 2HB GLU 24 -7.897 12.828 -11.274 197 HG2 GLU 24 1HG GLU 24 -8.082 14.912 -12.308 198 HG3 GLU 24 2HG GLU 24 -9.288 15.477 -11.154 199 H VAL 25 H VAL 25 -10.355 11.363 -13.338 200 HA VAL 25 HA VAL 25 -9.717 8.947 -11.823 201 HB VAL 25 HB VAL 25 -12.121 9.075 -11.605 202 HG11 VAL 25 1HG1 VAL 25 -13.454 9.934 -13.162 203 HG12 VAL 25 2HG1 VAL 25 -12.019 10.266 -14.134 204 HG13 VAL 25 3HG1 VAL 25 -12.905 8.757 -14.354 205 HG21 VAL 25 3HG2 VAL 25 -10.789 6.910 -12.412 206 HG22 VAL 25 1HG2 VAL 25 -12.531 6.903 -12.133 207 HG23 VAL 25 2HG2 VAL 25 -11.901 7.065 -13.772 208 H GLU 26 H GLU 26 -8.921 7.262 -13.062 209 HA GLU 26 HA GLU 26 -7.871 8.015 -15.634 210 HB2 GLU 26 1HB GLU 26 -7.689 5.277 -14.395 211 HB3 GLU 26 2HB GLU 26 -6.581 6.036 -15.530 212 HG2 GLU 26 1HG GLU 26 -5.979 7.672 -13.767 213 HG3 GLU 26 2HG GLU 26 -6.990 6.768 -12.641 214 HA PRO 27 HA PRO 27 -10.881 6.206 -18.266 215 HB2 PRO 27 1HB PRO 27 -9.332 5.350 -20.325 216 HB3 PRO 27 2HB PRO 27 -9.676 7.058 -20.028 217 HG2 PRO 27 1HG PRO 27 -7.248 5.462 -19.309 218 HG3 PRO 27 2HG PRO 27 -7.352 7.099 -19.983 219 HD2 PRO 27 1HD PRO 27 -6.908 6.632 -17.353 220 HD3 PRO 27 2HD PRO 27 -7.805 8.050 -17.933 221 H SER 28 H SER 28 -8.340 4.321 -16.934 222 HA SER 28 HA SER 28 -9.582 1.823 -17.856 223 HB2 SER 28 1HB SER 28 -7.366 0.962 -16.600 224 HB3 SER 28 2HB SER 28 -7.367 1.467 -18.290 225 HG SER 28 HG SER 28 -6.314 3.248 -17.779 226 H ASP 29 H ASP 29 -9.356 3.880 -15.178 227 HA ASP 29 HA ASP 29 -9.507 2.012 -13.061 228 HB2 ASP 29 1HB ASP 29 -10.100 4.925 -13.366 229 HB3 ASP 29 2HB ASP 29 -10.676 4.092 -11.924 230 H THR 30 H THR 30 -11.478 1.939 -11.577 231 HA THR 30 HA THR 30 -13.881 1.501 -13.227 232 HB THR 30 HB THR 30 -14.538 -0.118 -11.361 233 HG1 THR 30 HG1 THR 30 -12.546 -0.988 -10.326 234 HG21 THR 30 3HG2 THR 30 -13.946 -1.662 -12.854 235 HG22 THR 30 1HG2 THR 30 -12.246 -1.474 -12.425 236 HG23 THR 30 2HG2 THR 30 -12.959 -0.450 -13.671 237 H ILE 31 H ILE 31 -15.937 1.503 -11.822 238 HA ILE 31 HA ILE 31 -16.418 4.055 -10.878 239 HB ILE 31 HB ILE 31 -17.879 1.552 -10.030 240 HG12 ILE 31 1HG1 ILE 31 -17.793 1.689 -12.451 241 HG13 ILE 31 2HG1 ILE 31 -19.414 2.104 -11.905 242 HG21 ILE 31 1HG2 ILE 31 -19.790 3.346 -10.009 243 HG22 ILE 31 2HG2 ILE 31 -18.717 3.158 -8.622 244 HG23 ILE 31 3HG2 ILE 31 -18.447 4.465 -9.775 245 HD11 ILE 31 3HD1 ILE 31 -18.774 4.508 -12.114 246 HD12 ILE 31 1HD1 ILE 31 -17.272 3.976 -12.869 247 HD13 ILE 31 2HD1 ILE 31 -18.821 3.614 -13.633 248 H GLU 32 H GLU 32 -15.613 1.136 -9.028 249 HA GLU 32 HA GLU 32 -15.880 2.115 -6.459 250 HB2 GLU 32 1HB GLU 32 -14.135 0.441 -5.829 251 HB3 GLU 32 2HB GLU 32 -15.432 -0.213 -6.818 252 HG2 GLU 32 1HG GLU 32 -14.058 -0.278 -8.742 253 HG3 GLU 32 2HG GLU 32 -12.804 0.683 -7.960 254 H ASN 33 H ASN 33 -13.313 2.648 -8.779 255 HA ASN 33 HA ASN 33 -11.507 3.849 -6.909 256 HB2 ASN 33 1HB ASN 33 -11.545 3.248 -9.777 257 HB3 ASN 33 2HB ASN 33 -10.726 4.759 -9.390 258 HD21 ASN 33 2HD2 ASN 33 -9.494 4.302 -7.080 259 HD22 ASN 33 1HD2 ASN 33 -8.356 3.010 -7.220 260 H VAL 34 H VAL 34 -14.065 4.974 -9.002 261 HA VAL 34 HA VAL 34 -13.420 7.726 -8.980 262 HB VAL 34 HB VAL 34 -16.146 6.457 -9.278 263 HG11 VAL 34 1HG1 VAL 34 -16.800 8.500 -10.369 264 HG12 VAL 34 2HG1 VAL 34 -16.151 8.886 -8.774 265 HG13 VAL 34 3HG1 VAL 34 -15.168 9.150 -10.216 266 HG21 VAL 34 3HG2 VAL 34 -13.917 6.158 -10.913 267 HG22 VAL 34 1HG2 VAL 34 -15.595 5.819 -11.339 268 HG23 VAL 34 2HG2 VAL 34 -14.891 7.393 -11.709 269 H LYS 35 H LYS 35 -15.527 5.749 -6.925 270 HA LYS 35 HA LYS 35 -16.574 7.817 -5.353 271 HB2 LYS 35 1HB LYS 35 -16.112 4.889 -4.811 272 HB3 LYS 35 2HB LYS 35 -16.854 5.950 -3.619 273 HG2 LYS 35 1HG LYS 35 -18.677 6.435 -5.115 274 HG3 LYS 35 2HG LYS 35 -17.907 5.508 -6.405 275 HD2 LYS 35 1HD LYS 35 -18.739 4.336 -3.754 276 HD3 LYS 35 2HD LYS 35 -19.744 4.303 -5.205 277 HE2 LYS 35 1HE LYS 35 -18.733 2.303 -5.502 278 HE3 LYS 35 2HE LYS 35 -17.471 3.304 -6.216 279 HZ1 LYS 35 3HZ LYS 35 -17.165 1.557 -4.140 280 HZ2 LYS 35 1HZ LYS 35 -17.183 3.071 -3.385 281 HZ3 LYS 35 2HZ LYS 35 -16.061 2.750 -4.609 282 H ALA 36 H ALA 36 -13.495 6.205 -5.282 283 HA ALA 36 HA ALA 36 -12.649 6.726 -2.688 284 HB1 ALA 36 1HB ALA 36 -11.492 5.399 -4.559 285 HB2 ALA 36 2HB ALA 36 -10.788 6.947 -5.027 286 HB3 ALA 36 3HB ALA 36 -10.481 6.289 -3.420 287 H LYS 37 H LYS 37 -12.497 8.796 -5.562 288 HA LYS 37 HA LYS 37 -11.189 10.945 -4.186 289 HB2 LYS 37 1HB LYS 37 -12.617 10.872 -6.851 290 HB3 LYS 37 2HB LYS 37 -11.672 12.231 -6.257 291 HG2 LYS 37 1HG LYS 37 -10.581 9.468 -6.741 292 HG3 LYS 37 2HG LYS 37 -10.452 10.820 -7.869 293 HD2 LYS 37 1HD LYS 37 -9.326 12.095 -5.985 294 HD3 LYS 37 2HD LYS 37 -9.224 10.552 -5.134 295 HE2 LYS 37 1HE LYS 37 -7.802 9.628 -6.760 296 HE3 LYS 37 2HE LYS 37 -8.182 10.891 -7.930 297 HZ1 LYS 37 3HZ LYS 37 -6.303 11.831 -7.230 298 HZ2 LYS 37 1HZ LYS 37 -6.210 10.866 -5.844 299 HZ3 LYS 37 2HZ LYS 37 -7.155 12.269 -5.835 300 H ILE 38 H ILE 38 -14.486 10.014 -4.828 301 HA ILE 38 HA ILE 38 -15.728 12.497 -4.325 302 HB ILE 38 HB ILE 38 -16.822 9.708 -3.939 303 HG12 ILE 38 1HG1 ILE 38 -16.090 10.186 -6.242 304 HG13 ILE 38 2HG1 ILE 38 -17.841 10.039 -6.140 305 HG21 ILE 38 1HG2 ILE 38 -18.122 12.411 -3.879 306 HG22 ILE 38 2HG2 ILE 38 -19.032 10.955 -4.277 307 HG23 ILE 38 3HG2 ILE 38 -18.243 11.099 -2.707 308 HD11 ILE 38 3HD1 ILE 38 -17.959 12.530 -6.056 309 HD12 ILE 38 1HD1 ILE 38 -16.228 12.561 -6.392 310 HD13 ILE 38 2HD1 ILE 38 -17.343 11.865 -7.569 311 H GLN 39 H GLN 39 -14.532 9.976 -2.228 312 HA GLN 39 HA GLN 39 -15.886 10.525 0.125 313 HB2 GLN 39 1HB GLN 39 -13.051 9.601 -0.330 314 HB3 GLN 39 2HB GLN 39 -13.788 9.681 1.265 315 HG2 GLN 39 1HG GLN 39 -15.648 8.223 0.149 316 HG3 GLN 39 2HG GLN 39 -14.369 7.844 -1.003 317 HE21 GLN 39 2HE2 GLN 39 -12.162 7.684 0.506 318 HE22 GLN 39 1HE2 GLN 39 -12.303 6.421 1.675 319 H ASP 40 H ASP 40 -13.201 12.217 -1.361 320 HA ASP 40 HA ASP 40 -12.696 13.894 0.919 321 HB2 ASP 40 1HB ASP 40 -11.001 13.253 -0.870 322 HB3 ASP 40 2HB ASP 40 -11.814 14.410 -1.920 323 H LYS 41 H LYS 41 -14.815 13.953 -1.799 324 HA LYS 41 HA LYS 41 -15.308 16.793 -1.705 325 HB2 LYS 41 1HB LYS 41 -17.024 14.725 -3.069 326 HB3 LYS 41 2HB LYS 41 -16.863 16.431 -3.464 327 HG2 LYS 41 1HG LYS 41 -14.654 14.407 -3.749 328 HG3 LYS 41 2HG LYS 41 -15.724 14.918 -5.057 329 HD2 LYS 41 1HD LYS 41 -14.007 16.367 -5.422 330 HD3 LYS 41 2HD LYS 41 -14.917 17.321 -4.248 331 HE2 LYS 41 1HE LYS 41 -13.450 16.796 -2.510 332 HE3 LYS 41 2HE LYS 41 -12.786 15.405 -3.366 333 HZ1 LYS 41 3HZ LYS 41 -11.478 16.734 -4.692 334 HZ2 LYS 41 1HZ LYS 41 -11.426 17.577 -3.226 335 HZ3 LYS 41 2HZ LYS 41 -12.437 18.110 -4.473 336 H GLU 42 H GLU 42 -17.164 13.867 -0.878 337 HA GLU 42 HA GLU 42 -18.794 15.535 0.923 338 HB2 GLU 42 1HB GLU 42 -19.623 13.196 -0.792 339 HB3 GLU 42 2HB GLU 42 -20.607 13.801 0.533 340 HG2 GLU 42 1HG GLU 42 -19.736 15.408 -1.858 341 HG3 GLU 42 2HG GLU 42 -21.320 14.663 -1.648 342 H GLY 43 H GLY 43 -17.199 12.450 0.392 343 HA2 GLY 43 1HA GLY 43 -16.316 10.966 1.917 344 HA3 GLY 43 2HA GLY 43 -16.717 12.113 3.186 345 H ILE 44 H ILE 44 -18.277 9.797 0.979 346 HA ILE 44 HA ILE 44 -20.058 9.048 3.204 347 HB ILE 44 HB ILE 44 -21.748 8.446 1.413 348 HG12 ILE 44 1HG1 ILE 44 -20.030 10.285 -0.265 349 HG13 ILE 44 2HG1 ILE 44 -20.123 8.540 -0.477 350 HG21 ILE 44 1HG2 ILE 44 -21.758 11.260 1.044 351 HG22 ILE 44 2HG2 ILE 44 -22.719 10.292 2.161 352 HG23 ILE 44 3HG2 ILE 44 -21.149 10.919 2.663 353 HD11 ILE 44 3HD1 ILE 44 -22.562 10.272 -0.619 354 HD12 ILE 44 1HD1 ILE 44 -21.522 10.005 -2.018 355 HD13 ILE 44 2HD1 ILE 44 -22.324 8.639 -1.241 356 HA PRO 45 HA PRO 45 -18.720 4.902 2.637 357 HB2 PRO 45 1HB PRO 45 -20.940 3.549 3.419 358 HB3 PRO 45 2HB PRO 45 -19.885 4.401 4.553 359 HG2 PRO 45 1HG PRO 45 -22.486 5.280 3.358 360 HG3 PRO 45 2HG PRO 45 -21.913 5.436 5.029 361 HD2 PRO 45 1HD PRO 45 -21.837 7.489 3.265 362 HD3 PRO 45 2HD PRO 45 -20.626 7.287 4.548 363 HA PRO 46 HA PRO 46 -20.029 3.330 -1.257 364 HB2 PRO 46 1HB PRO 46 -19.639 0.664 -0.927 365 HB3 PRO 46 2HB PRO 46 -18.309 1.815 -1.098 366 HG2 PRO 46 1HG PRO 46 -19.444 0.588 1.385 367 HG3 PRO 46 2HG PRO 46 -17.747 0.847 0.940 368 HD2 PRO 46 1HD PRO 46 -19.074 2.486 2.638 369 HD3 PRO 46 2HD PRO 46 -17.794 3.068 1.555 370 H ASP 47 H ASP 47 -21.562 2.207 1.646 371 HA ASP 47 HA ASP 47 -23.598 0.654 0.377 372 HB2 ASP 47 1HB ASP 47 -23.504 1.868 3.147 373 HB3 ASP 47 2HB ASP 47 -24.685 0.683 2.596 374 H GLN 48 H GLN 48 -23.314 3.988 1.472 375 HA GLN 48 HA GLN 48 -26.059 4.544 0.638 376 HB2 GLN 48 1HB GLN 48 -24.033 5.975 2.300 377 HB3 GLN 48 2HB GLN 48 -25.290 6.916 1.509 378 HG2 GLN 48 1HG GLN 48 -26.066 6.448 3.683 379 HG3 GLN 48 2HG GLN 48 -26.967 5.396 2.593 380 HE21 GLN 48 2HE2 GLN 48 -27.403 3.666 3.793 381 HE22 GLN 48 1HE2 GLN 48 -26.232 2.708 4.627 382 H GLN 49 H GLN 49 -22.789 4.972 -0.385 383 HA GLN 49 HA GLN 49 -23.239 7.133 -2.184 384 HB2 GLN 49 1HB GLN 49 -21.006 6.564 -1.292 385 HB3 GLN 49 2HB GLN 49 -21.040 5.058 -2.199 386 HG2 GLN 49 1HG GLN 49 -20.527 6.059 -4.141 387 HG3 GLN 49 2HG GLN 49 -21.500 7.485 -3.786 388 HE21 GLN 49 2HE2 GLN 49 -18.841 6.032 -1.967 389 HE22 GLN 49 1HE2 GLN 49 -17.809 7.416 -2.026 390 H ARG 50 H ARG 50 -23.657 7.133 -4.358 391 HA ARG 50 HA ARG 50 -23.743 4.716 -5.900 392 HB2 ARG 50 1HB ARG 50 -26.224 5.867 -4.740 393 HB3 ARG 50 2HB ARG 50 -26.297 5.338 -6.416 394 HG2 ARG 50 1HG ARG 50 -25.181 3.167 -5.417 395 HG3 ARG 50 2HG ARG 50 -25.944 3.748 -3.935 396 HD2 ARG 50 1HD ARG 50 -28.102 3.689 -4.921 397 HD3 ARG 50 2HD ARG 50 -27.431 3.445 -6.533 398 HE ARG 50 HE ARG 50 -27.873 1.441 -4.512 399 HH11 ARG 50 1HH1 ARG 50 -26.109 2.288 -7.391 400 HH12 ARG 50 2HH1 ARG 50 -25.795 0.645 -7.840 401 HH21 ARG 50 1HH2 ARG 50 -27.467 -0.727 -5.092 402 HH22 ARG 50 2HH2 ARG 50 -26.568 -1.070 -6.532 403 H LEU 51 H LEU 51 -22.947 5.356 -7.781 404 HA LEU 51 HA LEU 51 -23.371 8.103 -8.676 405 HB2 LEU 51 1HB LEU 51 -21.463 5.923 -9.433 406 HB3 LEU 51 2HB LEU 51 -21.712 7.307 -10.496 407 HG LEU 51 HG LEU 51 -19.735 7.650 -9.163 408 HD11 LEU 51 1HD1 LEU 51 -21.615 9.461 -7.773 409 HD12 LEU 51 2HD1 LEU 51 -21.643 9.475 -9.536 410 HD13 LEU 51 3HD1 LEU 51 -20.143 9.823 -8.675 411 HD21 LEU 51 3HD2 LEU 51 -21.513 7.368 -6.743 412 HD22 LEU 51 1HD2 LEU 51 -19.789 7.742 -6.745 413 HD23 LEU 51 2HD2 LEU 51 -20.350 6.163 -7.297 414 H ILE 52 H ILE 52 -24.397 8.655 -10.554 415 HA ILE 52 HA ILE 52 -25.744 6.466 -11.999 416 HB ILE 52 HB ILE 52 -26.831 9.263 -11.767 417 HG12 ILE 52 1HG1 ILE 52 -26.686 8.396 -9.506 418 HG13 ILE 52 2HG1 ILE 52 -28.366 8.365 -10.030 419 HG21 ILE 52 1HG2 ILE 52 -27.754 6.683 -12.895 420 HG22 ILE 52 2HG2 ILE 52 -28.963 7.719 -12.139 421 HG23 ILE 52 3HG2 ILE 52 -27.995 8.328 -13.482 422 HD11 ILE 52 3HD1 ILE 52 -27.491 5.881 -10.746 423 HD12 ILE 52 1HD1 ILE 52 -26.602 6.183 -9.254 424 HD13 ILE 52 2HD1 ILE 52 -28.364 6.275 -9.266 425 H PHE 53 H PHE 53 -25.920 6.614 -14.233 426 HA PHE 53 HA PHE 53 -24.619 8.868 -15.566 427 HB2 PHE 53 1HB PHE 53 -22.856 7.184 -15.259 428 HB3 PHE 53 2HB PHE 53 -23.865 5.977 -16.049 429 HD1 PHE 53 HD2 PHE 53 -21.863 9.012 -16.545 430 HD2 PHE 53 HD1 PHE 53 -24.103 5.920 -18.426 431 HE1 PHE 53 HE2 PHE 53 -20.924 9.662 -18.725 432 HE2 PHE 53 HE1 PHE 53 -23.167 6.564 -20.608 433 HZ PHE 53 HZ PHE 53 -21.577 8.438 -20.760 434 H ALA 54 H ALA 54 -26.059 9.602 -16.970 435 HA ALA 54 HA ALA 54 -27.714 9.705 -18.529 436 HB1 ALA 54 1HB ALA 54 -27.248 6.967 -19.522 437 HB2 ALA 54 2HB ALA 54 -27.321 8.498 -20.396 438 HB3 ALA 54 3HB ALA 54 -25.853 8.046 -19.531 439 H GLY 55 H GLY 55 -28.353 8.629 -15.897 440 HA2 GLY 55 1HA GLY 55 -30.441 8.045 -15.013 441 HA3 GLY 55 2HA GLY 55 -30.917 7.446 -16.595 442 H LYS 56 H LYS 56 -28.089 6.049 -16.384 443 HA LYS 56 HA LYS 56 -29.192 3.628 -15.154 444 HB2 LYS 56 1HB LYS 56 -28.281 3.646 -17.535 445 HB3 LYS 56 2HB LYS 56 -26.685 3.828 -16.819 446 HG2 LYS 56 1HG LYS 56 -26.723 1.574 -17.028 447 HG3 LYS 56 2HG LYS 56 -27.477 1.708 -15.437 448 HD2 LYS 56 1HD LYS 56 -29.599 1.270 -16.265 449 HD3 LYS 56 2HD LYS 56 -29.164 1.745 -17.909 450 HE2 LYS 56 1HE LYS 56 -29.430 -0.657 -17.787 451 HE3 LYS 56 2HE LYS 56 -27.739 -0.255 -18.083 452 HZ1 LYS 56 3HZ LYS 56 -28.482 -1.984 -16.243 453 HZ2 LYS 56 1HZ LYS 56 -28.554 -0.579 -15.302 454 HZ3 LYS 56 2HZ LYS 56 -27.108 -1.014 -16.063 455 H GLN 57 H GLN 57 -28.496 2.949 -13.240 456 HA GLN 57 HA GLN 57 -26.585 4.381 -11.734 457 HB2 GLN 57 1HB GLN 57 -26.857 2.603 -10.062 458 HB3 GLN 57 2HB GLN 57 -28.409 3.163 -10.670 459 HG2 GLN 57 1HG GLN 57 -27.185 0.828 -12.016 460 HG3 GLN 57 2HG GLN 57 -27.821 0.592 -10.388 461 HE21 GLN 57 2HE2 GLN 57 -29.169 -0.896 -11.813 462 HE22 GLN 57 1HE2 GLN 57 -30.653 -0.240 -12.405 463 H LEU 58 H LEU 58 -24.530 3.743 -10.981 464 HA LEU 58 HA LEU 58 -23.162 1.829 -12.753 465 HB2 LEU 58 1HB LEU 58 -21.819 4.022 -11.205 466 HB3 LEU 58 2HB LEU 58 -21.192 3.103 -12.572 467 HG LEU 58 HG LEU 58 -23.502 5.016 -12.825 468 HD11 LEU 58 1HD1 LEU 58 -20.915 5.743 -12.147 469 HD12 LEU 58 2HD1 LEU 58 -22.151 6.780 -12.859 470 HD13 LEU 58 3HD1 LEU 58 -20.985 5.958 -13.897 471 HD21 LEU 58 3HD2 LEU 58 -23.595 4.054 -14.834 472 HD22 LEU 58 1HD2 LEU 58 -22.056 3.226 -14.597 473 HD23 LEU 58 2HD2 LEU 58 -22.080 4.887 -15.188 474 H GLU 59 H GLU 59 -21.544 0.472 -11.857 475 HA GLU 59 HA GLU 59 -21.381 0.314 -8.949 476 HB2 GLU 59 1HB GLU 59 -21.842 -2.126 -8.987 477 HB3 GLU 59 2HB GLU 59 -23.237 -1.150 -9.428 478 HG2 GLU 59 1HG GLU 59 -22.919 -1.651 -11.755 479 HG3 GLU 59 2HG GLU 59 -21.416 -2.501 -11.404 480 H ASP 60 H ASP 60 -19.952 -1.879 -8.545 481 HA ASP 60 HA ASP 60 -17.420 -1.237 -9.771 482 HB2 ASP 60 1HB ASP 60 -17.860 -3.564 -7.924 483 HB3 ASP 60 2HB ASP 60 -16.430 -2.552 -8.109 484 H GLY 61 H GLY 61 -16.305 -2.403 -11.253 485 HA2 GLY 61 1HA GLY 61 -16.129 -4.910 -11.982 486 HA3 GLY 61 2HA GLY 61 -17.766 -4.596 -12.539 487 H ARG 62 H ARG 62 -17.837 -2.378 -13.829 488 HA ARG 62 HA ARG 62 -15.997 -2.767 -16.045 489 HB2 ARG 62 1HB ARG 62 -18.354 -0.891 -15.783 490 HB3 ARG 62 2HB ARG 62 -17.460 -1.225 -17.260 491 HG2 ARG 62 1HG ARG 62 -19.122 -3.188 -15.696 492 HG3 ARG 62 2HG ARG 62 -19.543 -2.446 -17.241 493 HD2 ARG 62 1HD ARG 62 -17.402 -3.491 -18.140 494 HD3 ARG 62 2HD ARG 62 -17.374 -4.442 -16.656 495 HE ARG 62 HE ARG 62 -19.893 -4.761 -17.760 496 HH11 ARG 62 1HH1 ARG 62 -16.593 -5.443 -18.634 497 HH12 ARG 62 2HH1 ARG 62 -16.998 -6.822 -19.602 498 HH21 ARG 62 1HH2 ARG 62 -20.438 -6.575 -19.031 499 HH22 ARG 62 2HH2 ARG 62 -19.185 -7.464 -19.827 500 H THR 63 H THR 63 -15.179 -0.742 -17.161 501 HA THR 63 HA THR 63 -13.957 0.988 -15.129 502 HB THR 63 HB THR 63 -12.259 -0.035 -16.405 503 HG1 THR 63 HG1 THR 63 -11.627 1.880 -17.852 504 HG21 THR 63 3HG2 THR 63 -12.477 0.518 -19.047 505 HG22 THR 63 1HG2 THR 63 -14.173 0.294 -18.621 506 HG23 THR 63 2HG2 THR 63 -13.008 -0.993 -18.309 507 H LEU 64 H LEU 64 -13.636 3.268 -15.655 508 HA LEU 64 HA LEU 64 -15.975 4.607 -16.261 509 HB2 LEU 64 1HB LEU 64 -13.100 5.458 -16.314 510 HB3 LEU 64 2HB LEU 64 -14.395 6.582 -16.723 511 HG LEU 64 HG LEU 64 -13.775 6.950 -14.448 512 HD11 LEU 64 1HD1 LEU 64 -15.862 6.795 -13.405 513 HD12 LEU 64 2HD1 LEU 64 -16.285 5.316 -14.266 514 HD13 LEU 64 3HD1 LEU 64 -16.236 6.854 -15.128 515 HD21 LEU 64 3HD2 LEU 64 -12.820 4.568 -14.237 516 HD22 LEU 64 1HD2 LEU 64 -14.450 4.118 -13.735 517 HD23 LEU 64 2HD2 LEU 64 -13.540 5.313 -12.810 518 H SER 65 H SER 65 -13.405 3.550 -18.397 519 HA SER 65 HA SER 65 -14.272 5.028 -20.673 520 HB2 SER 65 1HB SER 65 -11.984 4.276 -20.585 521 HB3 SER 65 2HB SER 65 -12.492 2.596 -20.408 522 HG SER 65 HG SER 65 -11.855 3.208 -22.571 523 H GLU 66 H GLU 66 -15.031 1.884 -19.340 524 HA GLU 66 HA GLU 66 -16.402 0.921 -21.659 525 HB2 GLU 66 1HB GLU 66 -16.142 0.009 -18.818 526 HB3 GLU 66 2HB GLU 66 -17.369 -0.710 -19.852 527 HG2 GLU 66 1HG GLU 66 -14.484 -0.582 -20.657 528 HG3 GLU 66 2HG GLU 66 -15.133 -1.900 -19.684 529 H TYR 67 H TYR 67 -17.234 2.907 -18.960 530 HA TYR 67 HA TYR 67 -20.096 2.583 -19.388 531 HB2 TYR 67 1HB TYR 67 -18.386 3.837 -17.303 532 HB3 TYR 67 2HB TYR 67 -19.989 4.523 -17.547 533 HD1 TYR 67 HD1 TYR 67 -21.756 2.361 -17.983 534 HD2 TYR 67 HD2 TYR 67 -18.341 2.475 -15.448 535 HE1 TYR 67 HE1 TYR 67 -22.734 0.580 -16.596 536 HE2 TYR 67 HE2 TYR 67 -19.308 0.694 -14.055 537 HH TYR 67 HH TYR 67 -22.267 -0.959 -14.978 538 H ASN 68 H ASN 68 -17.975 4.011 -21.182 539 HA ASN 68 HA ASN 68 -17.945 5.760 -22.634 540 HB2 ASN 68 1HB ASN 68 -20.863 6.117 -21.926 541 HB3 ASN 68 2HB ASN 68 -20.054 6.625 -23.406 542 HD21 ASN 68 2HD2 ASN 68 -19.223 4.947 -24.808 543 HD22 ASN 68 1HD2 ASN 68 -20.031 3.421 -24.869 544 H ILE 69 H ILE 69 -17.575 6.164 -19.677 545 HA ILE 69 HA ILE 69 -18.483 8.881 -19.236 546 HB ILE 69 HB ILE 69 -16.705 7.120 -17.544 547 HG12 ILE 69 1HG1 ILE 69 -19.529 7.898 -16.894 548 HG13 ILE 69 2HG1 ILE 69 -19.217 6.542 -17.971 549 HG21 ILE 69 1HG2 ILE 69 -17.370 8.802 -15.753 550 HG22 ILE 69 2HG2 ILE 69 -16.188 9.332 -16.949 551 HG23 ILE 69 3HG2 ILE 69 -17.869 9.849 -17.082 552 HD11 ILE 69 3HD1 ILE 69 -17.770 5.585 -16.147 553 HD12 ILE 69 1HD1 ILE 69 -18.426 6.837 -15.093 554 HD13 ILE 69 2HD1 ILE 69 -19.502 5.641 -15.816 555 H GLN 70 H GLN 70 -17.442 10.267 -20.588 556 HA GLN 70 HA GLN 70 -14.561 10.108 -20.916 557 HB2 GLN 70 1HB GLN 70 -16.453 12.181 -22.028 558 HB3 GLN 70 2HB GLN 70 -14.815 11.839 -22.568 559 HG2 GLN 70 1HG GLN 70 -15.539 9.614 -23.307 560 HG3 GLN 70 2HG GLN 70 -17.184 9.999 -22.806 561 HE21 GLN 70 2HE2 GLN 70 -17.731 12.381 -23.700 562 HE22 GLN 70 1HE2 GLN 70 -17.532 12.511 -25.411 563 H LYS 71 H LYS 71 -13.788 12.703 -21.130 564 HA LYS 71 HA LYS 71 -13.544 13.467 -18.376 565 HB2 LYS 71 1HB LYS 71 -12.038 15.181 -19.171 566 HB3 LYS 71 2HB LYS 71 -11.684 13.674 -20.006 567 HG2 LYS 71 1HG LYS 71 -13.601 15.163 -21.514 568 HG3 LYS 71 2HG LYS 71 -12.221 16.193 -21.126 569 HD2 LYS 71 1HD LYS 71 -11.481 13.495 -21.982 570 HD3 LYS 71 2HD LYS 71 -12.344 14.422 -23.212 571 HE2 LYS 71 1HE LYS 71 -10.660 16.311 -22.483 572 HE3 LYS 71 2HE LYS 71 -9.698 14.937 -21.942 573 HZ1 LYS 71 3HZ LYS 71 -9.666 15.920 -24.434 574 HZ2 LYS 71 1HZ LYS 71 -10.797 14.673 -24.602 575 HZ3 LYS 71 2HZ LYS 71 -9.241 14.332 -24.035 576 H GLU 72 H GLU 72 -15.696 14.226 -20.903 577 HA GLU 72 HA GLU 72 -16.622 16.621 -19.457 578 HB2 GLU 72 1HB GLU 72 -16.806 15.898 -22.379 579 HB3 GLU 72 2HB GLU 72 -17.748 17.195 -21.660 580 HG2 GLU 72 1HG GLU 72 -15.769 18.406 -21.086 581 HG3 GLU 72 2HG GLU 72 -14.746 17.058 -21.580 582 H SER 73 H SER 73 -17.260 13.725 -19.031 583 HA SER 73 HA SER 73 -19.959 13.342 -19.906 584 HB2 SER 73 1HB SER 73 -18.023 11.862 -18.202 585 HB3 SER 73 2HB SER 73 -19.735 11.531 -17.939 586 HG SER 73 HG SER 73 -19.905 11.031 -20.157 587 H THR 74 H THR 74 -21.594 12.676 -18.076 588 HA THR 74 HA THR 74 -21.564 14.774 -16.006 589 HB THR 74 HB THR 74 -24.192 13.866 -17.059 590 HG1 THR 74 HG1 THR 74 -24.051 15.270 -18.820 591 HG21 THR 74 3HG2 THR 74 -24.502 16.441 -16.802 592 HG22 THR 74 1HG2 THR 74 -23.002 16.348 -15.881 593 HG23 THR 74 2HG2 THR 74 -24.414 15.429 -15.361 594 H LEU 75 H LEU 75 -21.407 13.829 -14.085 595 HA LEU 75 HA LEU 75 -22.710 11.226 -13.671 596 HB2 LEU 75 1HB LEU 75 -20.250 12.489 -12.630 597 HB3 LEU 75 2HB LEU 75 -21.166 11.505 -11.490 598 HG LEU 75 HG LEU 75 -19.310 10.299 -12.623 599 HD11 LEU 75 1HD1 LEU 75 -22.120 9.477 -12.530 600 HD12 LEU 75 2HD1 LEU 75 -20.679 8.679 -11.901 601 HD13 LEU 75 3HD1 LEU 75 -21.108 8.511 -13.603 602 HD21 LEU 75 3HD2 LEU 75 -21.031 10.646 -15.076 603 HD22 LEU 75 1HD2 LEU 75 -19.585 9.643 -14.957 604 HD23 LEU 75 2HD2 LEU 75 -19.458 11.396 -14.801 605 H HIS 76 H HIS 76 -23.847 10.842 -11.700 606 HA HIS 76 HA HIS 76 -24.690 13.250 -10.246 607 HB2 HIS 76 1HB HIS 76 -26.393 11.326 -11.752 608 HB3 HIS 76 2HB HIS 76 -27.014 11.946 -10.225 609 HD1 HIS 76 HD1 HIS 76 -28.116 14.177 -10.304 610 HD2 HIS 76 HD2 HIS 76 -25.767 13.466 -13.657 611 HE1 HIS 76 HE1 HIS 76 -28.551 16.110 -11.852 612 H LEU 77 H LEU 77 -24.698 13.012 -8.099 613 HA LEU 77 HA LEU 77 -24.179 10.343 -7.015 614 HB2 LEU 77 1HB LEU 77 -24.045 12.970 -5.557 615 HB3 LEU 77 2HB LEU 77 -23.352 11.426 -5.065 616 HG LEU 77 HG LEU 77 -22.085 11.879 -7.443 617 HD11 LEU 77 1HD1 LEU 77 -22.898 14.480 -6.277 618 HD12 LEU 77 2HD1 LEU 77 -22.611 14.028 -7.957 619 HD13 LEU 77 3HD1 LEU 77 -21.247 14.332 -6.881 620 HD21 LEU 77 3HD2 LEU 77 -21.346 12.500 -4.601 621 HD22 LEU 77 1HD2 LEU 77 -20.203 12.714 -5.927 622 HD23 LEU 77 2HD2 LEU 77 -20.874 11.118 -5.591 623 H VAL 78 H VAL 78 -25.844 9.224 -6.268 624 HA VAL 78 HA VAL 78 -28.121 10.688 -5.102 625 HB VAL 78 HB VAL 78 -29.411 8.548 -5.595 626 HG11 VAL 78 1HG1 VAL 78 -30.096 9.353 -7.654 627 HG12 VAL 78 2HG1 VAL 78 -29.344 10.775 -6.929 628 HG13 VAL 78 3HG1 VAL 78 -28.464 9.826 -8.127 629 HG21 VAL 78 3HG2 VAL 78 -27.540 7.061 -5.974 630 HG22 VAL 78 1HG2 VAL 78 -28.517 7.170 -7.439 631 HG23 VAL 78 2HG2 VAL 78 -26.992 8.049 -7.328 632 H LEU 79 H LEU 79 -28.382 10.473 -2.987 633 HA LEU 79 HA LEU 79 -27.118 8.189 -1.634 634 HB2 LEU 79 1HB LEU 79 -27.742 10.989 -0.808 635 HB3 LEU 79 2HB LEU 79 -27.616 9.731 0.420 636 HG LEU 79 HG LEU 79 -25.534 10.984 0.199 637 HD11 LEU 79 1HD1 LEU 79 -24.530 9.102 0.791 638 HD12 LEU 79 2HD1 LEU 79 -24.419 8.617 -0.900 639 HD13 LEU 79 3HD1 LEU 79 -25.833 8.169 0.055 640 HD21 LEU 79 3HD2 LEU 79 -24.409 11.331 -1.747 641 HD22 LEU 79 1HD2 LEU 79 -26.048 11.242 -2.395 642 HD23 LEU 79 2HD2 LEU 79 -24.988 9.835 -2.481 643 H ARG 80 H ARG 80 -28.308 6.739 -0.547 644 HA ARG 80 HA ARG 80 -30.989 7.359 0.347 645 HB2 ARG 80 1HB ARG 80 -30.455 5.786 -2.081 646 HB3 ARG 80 2HB ARG 80 -31.538 5.007 -0.935 647 HG2 ARG 80 1HG ARG 80 -33.117 6.159 -2.031 648 HG3 ARG 80 2HG ARG 80 -32.595 7.488 -0.994 649 HD2 ARG 80 1HD ARG 80 -32.385 8.563 -2.971 650 HD3 ARG 80 2HD ARG 80 -30.821 7.751 -2.988 651 HE ARG 80 HE ARG 80 -32.499 5.975 -4.185 652 HH11 ARG 80 1HH1 ARG 80 -31.703 9.321 -4.725 653 HH12 ARG 80 2HH1 ARG 80 -31.983 9.248 -6.433 654 HH21 ARG 80 1HH2 ARG 80 -32.871 5.866 -6.432 655 HH22 ARG 80 2HH2 ARG 80 -32.649 7.282 -7.403 656 H LEU 81 H LEU 81 -31.880 5.718 1.734 657 HA LEU 81 HA LEU 81 -30.234 3.462 2.470 658 HB2 LEU 81 1HB LEU 81 -30.317 4.272 4.926 659 HB3 LEU 81 2HB LEU 81 -29.061 4.881 3.850 660 HG LEU 81 HG LEU 81 -30.180 6.552 5.411 661 HD11 LEU 81 1HD1 LEU 81 -30.600 7.686 2.764 662 HD12 LEU 81 2HD1 LEU 81 -29.078 6.806 2.906 663 HD13 LEU 81 3HD1 LEU 81 -29.440 8.127 4.018 664 HD21 LEU 81 3HD2 LEU 81 -32.365 6.571 3.356 665 HD22 LEU 81 1HD2 LEU 81 -32.316 7.362 4.932 666 HD23 LEU 81 2HD2 LEU 81 -32.493 5.610 4.830 667 H ARG 82 H ARG 82 -32.984 4.104 1.525 668 HA ARG 82 HA ARG 82 -34.697 3.400 3.750 669 HB2 ARG 82 1HB ARG 82 -35.355 4.977 1.882 670 HB3 ARG 82 2HB ARG 82 -35.449 3.569 0.833 671 HG2 ARG 82 1HG ARG 82 -37.635 3.798 1.471 672 HG3 ARG 82 2HG ARG 82 -37.048 2.656 2.682 673 HD2 ARG 82 1HD ARG 82 -38.390 4.416 3.708 674 HD3 ARG 82 2HD ARG 82 -36.716 4.489 4.258 675 HE ARG 82 HE ARG 82 -37.215 6.197 2.019 676 HH11 ARG 82 1HH1 ARG 82 -37.478 5.923 5.480 677 HH12 ARG 82 2HH1 ARG 82 -37.437 7.634 5.749 678 HH21 ARG 82 1HH2 ARG 82 -37.159 8.451 2.360 679 HH22 ARG 82 2HH2 ARG 82 -37.256 9.071 3.974 680 H GLY 83 H GLY 83 -33.833 1.931 0.615 681 HA2 GLY 83 1HA GLY 83 -33.690 -0.273 -0.019 682 HA3 GLY 83 2HA GLY 83 -33.612 -0.678 1.689 683 H TYR 84 H TYR 84 -36.306 1.102 0.388 684 HA TYR 84 HA TYR 84 -38.518 0.614 0.189 685 HB2 TYR 84 1HB TYR 84 -37.412 -1.123 -1.418 686 HB3 TYR 84 2HB TYR 84 -37.865 -2.291 -0.181 687 HD1 TYR 84 HD1 TYR 84 -39.267 0.351 -2.393 688 HD2 TYR 84 HD2 TYR 84 -40.036 -3.159 -0.115 689 HE1 TYR 84 HE1 TYR 84 -41.535 0.242 -3.338 690 HE2 TYR 84 HE2 TYR 84 -42.306 -3.278 -1.055 691 HH TYR 84 HH TYR 84 -43.575 -2.508 -2.908 692 H ALA 85 H ALA 85 -37.606 0.777 2.757 693 HA ALA 85 HA ALA 85 -39.006 -1.411 4.150 694 HB1 ALA 85 1HB ALA 85 -36.747 0.361 5.048 695 HB2 ALA 85 2HB ALA 85 -37.681 -0.643 6.158 696 HB3 ALA 85 3HB ALA 85 -36.751 -1.393 4.862 697 H ASP 86 H ASP 86 -41.072 -0.648 4.234 698 HA ASP 86 HA ASP 86 -41.651 2.082 4.949 699 HB2 ASP 86 1HB ASP 86 -43.981 1.450 4.741 700 HB3 ASP 86 2HB ASP 86 -43.080 0.784 3.383 701 H LEU 87 H LEU 87 -43.513 2.295 6.691 702 HA LEU 87 HA LEU 87 -42.357 1.265 9.163 703 HB2 LEU 87 1HB LEU 87 -44.576 3.273 8.827 704 HB3 LEU 87 2HB LEU 87 -43.644 2.946 10.287 705 HG LEU 87 HG LEU 87 -42.608 4.233 7.762 706 HD11 LEU 87 1HD1 LEU 87 -42.530 6.257 8.984 707 HD12 LEU 87 2HD1 LEU 87 -42.922 5.443 10.498 708 HD13 LEU 87 3HD1 LEU 87 -44.142 5.587 9.233 709 HD21 LEU 87 3HD2 LEU 87 -41.197 3.775 10.387 710 HD22 LEU 87 1HD2 LEU 87 -40.533 4.534 8.940 711 HD23 LEU 87 2HD2 LEU 87 -40.940 2.818 8.927 712 H ARG 88 H ARG 88 -44.415 1.236 10.899 713 HA ARG 88 HA ARG 88 -46.683 -0.210 9.922 714 HB2 ARG 88 1HB ARG 88 -44.985 -1.990 9.845 715 HB3 ARG 88 2HB ARG 88 -44.628 -1.719 11.545 716 HG2 ARG 88 1HG ARG 88 -47.070 -2.266 11.987 717 HG3 ARG 88 2HG ARG 88 -47.119 -2.857 10.325 718 HD2 ARG 88 1HD ARG 88 -46.673 -4.743 11.674 719 HD3 ARG 88 2HD ARG 88 -45.139 -4.310 10.920 720 HE ARG 88 HE ARG 88 -45.198 -3.008 13.354 721 HH11 ARG 88 1HH1 ARG 88 -45.300 -6.297 12.217 722 HH12 ARG 88 2HH1 ARG 88 -44.536 -6.947 13.630 723 HH21 ARG 88 1HH2 ARG 88 -44.191 -3.851 15.219 724 HH22 ARG 88 2HH2 ARG 88 -43.906 -5.554 15.337 725 H GLU 89 H GLU 89 -48.346 -0.144 11.352 726 HA GLU 89 HA GLU 89 -47.764 0.615 14.127 727 HB2 GLU 89 1HB GLU 89 -49.607 2.028 12.211 728 HB3 GLU 89 2HB GLU 89 -49.808 2.157 13.953 729 HG2 GLU 89 1HG GLU 89 -47.349 2.938 12.402 730 HG3 GLU 89 2HG GLU 89 -48.564 4.042 13.045 731 H ASP 90 H ASP 90 -48.625 -0.878 15.394 732 HA ASP 90 HA ASP 90 -51.381 -1.675 15.064 733 HB2 ASP 90 1HB ASP 90 -50.571 -4.168 15.283 734 HB3 ASP 90 2HB ASP 90 -50.669 -3.399 13.702 735 HA PRO 91 HA PRO 91 -51.260 -2.000 19.436 736 HB2 PRO 91 1HB PRO 91 -53.024 -4.007 19.916 737 HB3 PRO 91 2HB PRO 91 -53.521 -2.400 19.371 738 HG2 PRO 91 1HG PRO 91 -53.163 -4.913 17.783 739 HG3 PRO 91 2HG PRO 91 -54.460 -3.707 17.692 740 HD2 PRO 91 1HD PRO 91 -52.408 -3.777 15.926 741 HD3 PRO 91 2HD PRO 91 -53.199 -2.263 16.412 742 H ASP 92 H ASP 92 -50.488 -4.788 17.525 743 HA ASP 92 HA ASP 92 -48.565 -5.662 19.483 744 HB2 ASP 92 1HB ASP 92 -49.632 -8.094 19.171 745 HB3 ASP 92 2HB ASP 92 -50.103 -7.022 20.487 746 H ARG 93 H ARG 93 -50.262 -7.370 16.863 747 HA ARG 93 HA ARG 93 -48.263 -6.949 14.913 748 HB2 ARG 93 1HB ARG 93 -47.339 -9.257 14.844 749 HB3 ARG 93 2HB ARG 93 -46.875 -8.364 16.286 750 HG2 ARG 93 1HG ARG 93 -48.981 -9.557 17.308 751 HG3 ARG 93 2HG ARG 93 -48.681 -10.706 16.002 752 HD2 ARG 93 1HD ARG 93 -46.214 -10.044 17.303 753 HD3 ARG 93 2HD ARG 93 -47.401 -10.553 18.503 754 HE ARG 93 HE ARG 93 -47.345 -12.319 16.273 755 HH11 ARG 93 1HH1 ARG 93 -45.658 -11.471 19.198 756 HH12 ARG 93 2HH1 ARG 93 -44.976 -13.048 19.416 757 HH21 ARG 93 1HH2 ARG 93 -46.453 -14.400 16.550 758 HH22 ARG 93 2HH2 ARG 93 -45.427 -14.713 17.909 759 H GLN 94 H GLN 94 -50.815 -9.033 16.152 760 HA GLN 94 HA GLN 94 -51.540 -9.927 13.488 761 HB2 GLN 94 1HB GLN 94 -51.664 -11.285 15.711 762 HB3 GLN 94 2HB GLN 94 -53.184 -10.432 15.945 763 HG2 GLN 94 1HG GLN 94 -53.981 -11.305 13.790 764 HG3 GLN 94 2HG GLN 94 -52.474 -12.202 13.617 765 HE21 GLN 94 2HE2 GLN 94 -55.334 -13.032 13.878 766 HE22 GLN 94 1HE2 GLN 94 -55.343 -14.179 15.170 767 H ASP 95 H ASP 95 -53.721 -9.664 12.654 768 HA ASP 95 HA ASP 95 -55.258 -7.432 13.724 769 HB2 ASP 95 1HB ASP 95 -53.610 -6.459 12.115 770 HB3 ASP 95 2HB ASP 95 -54.322 -7.456 10.849 771 H HIS 96 H HIS 96 -56.957 -8.804 14.142 772 HA HIS 96 HA HIS 96 -57.956 -10.670 12.228 773 HB2 HIS 96 1HB HIS 96 -59.832 -10.949 13.801 774 HB3 HIS 96 2HB HIS 96 -58.276 -11.034 14.622 775 HD1 HIS 96 HD1 HIS 96 -61.043 -8.506 13.999 776 HD2 HIS 96 HD2 HIS 96 -58.067 -9.380 16.763 777 HE1 HIS 96 HE1 HIS 96 -61.385 -6.885 15.890 778 H HIS 97 H HIS 97 -60.263 -10.598 11.476 779 HA HIS 97 HA HIS 97 -60.696 -8.146 10.049 780 HB2 HIS 97 1HB HIS 97 -61.842 -10.874 10.037 781 HB3 HIS 97 2HB HIS 97 -62.928 -9.584 9.528 782 HD1 HIS 97 HD1 HIS 97 -62.707 -10.983 7.194 783 HD2 HIS 97 HD2 HIS 97 -59.391 -8.796 8.410 784 HE1 HIS 97 HE1 HIS 97 -61.278 -10.730 5.140 785 HA PRO 98 HA PRO 98 -63.619 -6.123 12.618 786 HB2 PRO 98 1HB PRO 98 -65.405 -5.147 10.820 787 HB3 PRO 98 2HB PRO 98 -63.772 -4.495 11.003 788 HG2 PRO 98 1HG PRO 98 -64.825 -6.425 8.971 789 HG3 PRO 98 2HG PRO 98 -63.740 -5.041 8.743 790 HD2 PRO 98 1HD PRO 98 -62.840 -7.592 8.871 791 HD3 PRO 98 2HD PRO 98 -61.889 -6.213 9.460 792 H GLY 99 H GLY 99 -64.960 -7.181 13.939 793 HA2 GLY 99 1HA GLY 99 -67.341 -8.456 12.774 794 HA3 GLY 99 2HA GLY 99 -66.339 -9.369 13.892 795 H SER 100 H SER 100 -68.870 -7.120 13.565 796 HA SER 100 HA SER 100 -69.094 -6.960 16.486 797 HB2 SER 100 1HB SER 100 -69.260 -4.651 14.548 798 HB3 SER 100 2HB SER 100 -69.934 -4.574 16.176 799 HG SER 100 HG SER 100 -67.732 -5.226 16.858 800 H GLY 101 H GLY 101 -71.109 -7.280 17.257 801 HA2 GLY 101 1HA GLY 101 -73.150 -8.087 15.376 802 HA3 GLY 101 2HA GLY 101 -73.248 -8.177 17.128 803 H ALA 102 H ALA 102 -75.332 -7.325 17.191 804 HA ALA 102 HA ALA 102 -75.426 -4.425 17.009 805 HB1 ALA 102 1HB ALA 102 -77.809 -4.886 15.866 806 HB2 ALA 102 2HB ALA 102 -76.337 -4.570 14.946 807 HB3 ALA 102 3HB ALA 102 -76.888 -6.228 15.185 808 H GLN 103 H GLN 103 -77.699 -3.664 17.770 809 HA GLN 103 HA GLN 103 -78.137 -4.869 20.341 810 HB2 GLN 103 1HB GLN 103 -78.227 -2.366 19.738 811 HB3 GLN 103 2HB GLN 103 -79.839 -2.707 19.125 812 HG2 GLN 103 1HG GLN 103 -80.698 -3.119 21.212 813 HG3 GLN 103 2HG GLN 103 -79.130 -3.553 21.889 814 HE21 GLN 103 2HE2 GLN 103 -81.176 -1.660 22.822 815 HE22 GLN 103 1HE2 GLN 103 -80.369 -0.140 22.976 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -6.568 -2.849 -4.184 2 HA2 GLY 1 1HA GLY 1 -4.163 -3.184 -4.648 3 HA3 GLY 1 2HA GLY 1 -4.989 -2.552 -6.065 4 H SER 2 H SER 2 -3.480 -1.306 -7.006 5 HA SER 2 HA SER 2 -2.261 0.810 -5.354 6 HB2 SER 2 1HB SER 2 -1.111 -0.775 -7.647 7 HB3 SER 2 2HB SER 2 -0.420 0.767 -7.142 8 HG SER 2 HG SER 2 0.264 -1.451 -6.166 9 H LEU 3 H LEU 3 -1.612 2.758 -6.658 10 HA LEU 3 HA LEU 3 -3.562 3.282 -8.802 11 HB2 LEU 3 1HB LEU 3 -2.716 5.088 -6.546 12 HB3 LEU 3 2HB LEU 3 -3.611 5.643 -7.960 13 HG LEU 3 HG LEU 3 -4.610 3.585 -5.992 14 HD11 LEU 3 1HD1 LEU 3 -5.646 5.203 -4.803 15 HD12 LEU 3 2HD1 LEU 3 -5.860 6.253 -6.204 16 HD13 LEU 3 3HD1 LEU 3 -4.297 6.175 -5.391 17 HD21 LEU 3 3HD2 LEU 3 -6.152 3.145 -7.524 18 HD22 LEU 3 1HD2 LEU 3 -5.453 4.342 -8.616 19 HD23 LEU 3 2HD2 LEU 3 -6.681 4.827 -7.446 20 H VAL 4 H VAL 4 -2.822 4.299 -10.593 21 HA VAL 4 HA VAL 4 0.051 4.932 -10.657 22 HB VAL 4 HB VAL 4 -1.791 4.283 -12.962 23 HG11 VAL 4 1HG1 VAL 4 1.207 4.603 -12.923 24 HG12 VAL 4 2HG1 VAL 4 0.202 4.235 -14.326 25 HG13 VAL 4 3HG1 VAL 4 0.070 5.805 -13.533 26 HG21 VAL 4 3HG2 VAL 4 -0.325 2.211 -13.072 27 HG22 VAL 4 1HG2 VAL 4 0.211 2.632 -11.445 28 HG23 VAL 4 2HG2 VAL 4 -1.490 2.283 -11.750 29 HA PRO 5 HA PRO 5 -1.011 9.201 -11.122 30 HB2 PRO 5 1HB PRO 5 1.432 10.082 -11.914 31 HB3 PRO 5 2HB PRO 5 1.065 9.643 -10.242 32 HG2 PRO 5 1HG PRO 5 2.449 8.043 -12.360 33 HG3 PRO 5 2HG PRO 5 2.866 8.229 -10.646 34 HD2 PRO 5 1HD PRO 5 1.570 6.052 -11.602 35 HD3 PRO 5 2HD PRO 5 1.295 6.686 -9.967 36 H ARG 6 H ARG 6 0.879 7.602 -13.678 37 HA ARG 6 HA ARG 6 0.174 9.493 -15.691 38 HB2 ARG 6 1HB ARG 6 2.213 8.019 -15.720 39 HB3 ARG 6 2HB ARG 6 1.154 6.666 -16.093 40 HG2 ARG 6 1HG ARG 6 2.130 7.443 -18.125 41 HG3 ARG 6 2HG ARG 6 0.420 7.880 -18.133 42 HD2 ARG 6 1HD ARG 6 2.377 9.850 -17.067 43 HD3 ARG 6 2HD ARG 6 2.304 9.608 -18.812 44 HE ARG 6 HE ARG 6 0.335 10.893 -17.153 45 HH11 ARG 6 1HH1 ARG 6 0.926 9.250 -20.164 46 HH12 ARG 6 2HH1 ARG 6 -0.432 9.962 -20.970 47 HH21 ARG 6 1HH2 ARG 6 -1.457 11.837 -18.202 48 HH22 ARG 6 2HH2 ARG 6 -1.787 11.434 -19.853 49 H GLY 7 H GLY 7 -1.611 9.616 -16.891 50 HA2 GLY 7 1HA GLY 7 -3.354 8.702 -18.218 51 HA3 GLY 7 2HA GLY 7 -3.243 7.213 -17.290 52 H SER 8 H SER 8 -4.424 10.521 -17.275 53 HA SER 8 HA SER 8 -6.654 9.733 -15.619 54 HB2 SER 8 1HB SER 8 -5.038 12.057 -14.605 55 HB3 SER 8 2HB SER 8 -6.260 11.104 -13.761 56 HG SER 8 HG SER 8 -3.570 10.658 -14.043 57 H MET 9 H MET 9 -8.324 11.356 -15.524 58 HA MET 9 HA MET 9 -8.003 13.666 -17.275 59 HB2 MET 9 1HB MET 9 -9.745 13.129 -18.747 60 HB3 MET 9 2HB MET 9 -8.844 11.627 -18.593 61 HG2 MET 9 1HG MET 9 -10.746 11.507 -16.576 62 HG3 MET 9 2HG MET 9 -11.596 12.206 -17.953 63 HE1 MET 9 3HE MET 9 -9.972 8.778 -16.549 64 HE2 MET 9 1HE MET 9 -11.560 9.444 -16.167 65 HE3 MET 9 2HE MET 9 -11.428 8.000 -17.171 66 H GLN 10 H GLN 10 -9.737 15.225 -17.067 67 HA GLN 10 HA GLN 10 -10.879 15.174 -14.379 68 HB2 GLN 10 1HB GLN 10 -9.545 17.142 -15.566 69 HB3 GLN 10 2HB GLN 10 -11.148 17.542 -16.167 70 HG2 GLN 10 1HG GLN 10 -11.977 17.967 -14.037 71 HG3 GLN 10 2HG GLN 10 -10.668 17.087 -13.250 72 HE21 GLN 10 2HE2 GLN 10 -8.744 18.102 -12.857 73 HE22 GLN 10 1HE2 GLN 10 -8.501 19.797 -13.087 74 H ILE 11 H ILE 11 -13.012 15.075 -13.961 75 HA ILE 11 HA ILE 11 -14.862 15.156 -16.254 76 HB ILE 11 HB ILE 11 -16.175 13.381 -15.306 77 HG12 ILE 11 1HG1 ILE 11 -14.157 13.355 -13.051 78 HG13 ILE 11 2HG1 ILE 11 -15.828 13.895 -12.934 79 HG21 ILE 11 1HG2 ILE 11 -13.264 12.595 -15.293 80 HG22 ILE 11 2HG2 ILE 11 -14.637 11.514 -15.525 81 HG23 ILE 11 3HG2 ILE 11 -14.277 12.752 -16.728 82 HD11 ILE 11 3HD1 ILE 11 -14.830 11.103 -13.413 83 HD12 ILE 11 1HD1 ILE 11 -15.708 11.717 -12.012 84 HD13 ILE 11 2HD1 ILE 11 -16.521 11.578 -13.571 85 H PHE 12 H PHE 12 -17.138 15.578 -15.620 86 HA PHE 12 HA PHE 12 -17.231 17.471 -13.366 87 HB2 PHE 12 1HB PHE 12 -18.879 17.427 -15.903 88 HB3 PHE 12 2HB PHE 12 -19.078 18.580 -14.588 89 HD1 PHE 12 HD2 PHE 12 -16.907 19.905 -13.939 90 HD2 PHE 12 HD1 PHE 12 -17.550 17.994 -17.688 91 HE1 PHE 12 HE2 PHE 12 -15.224 21.372 -14.971 92 HE2 PHE 12 HE1 PHE 12 -15.867 19.458 -18.726 93 HZ PHE 12 HZ PHE 12 -14.702 21.150 -17.368 94 H VAL 13 H VAL 13 -18.565 17.055 -11.728 95 HA VAL 13 HA VAL 13 -20.722 15.089 -12.139 96 HB VAL 13 HB VAL 13 -19.077 15.354 -9.620 97 HG11 VAL 13 1HG1 VAL 13 -20.186 13.168 -9.087 98 HG12 VAL 13 2HG1 VAL 13 -21.267 14.563 -9.117 99 HG13 VAL 13 3HG1 VAL 13 -21.238 13.439 -10.476 100 HG21 VAL 13 3HG2 VAL 13 -18.655 12.831 -10.692 101 HG22 VAL 13 1HG2 VAL 13 -18.556 13.915 -12.079 102 HG23 VAL 13 2HG2 VAL 13 -17.511 14.174 -10.682 103 H LYS 14 H LYS 14 -22.658 15.481 -11.124 104 HA LYS 14 HA LYS 14 -22.928 18.143 -9.901 105 HB2 LYS 14 1HB LYS 14 -24.780 16.435 -11.527 106 HB3 LYS 14 2HB LYS 14 -25.439 17.650 -10.439 107 HG2 LYS 14 1HG LYS 14 -25.286 18.609 -12.610 108 HG3 LYS 14 2HG LYS 14 -24.043 19.352 -11.602 109 HD2 LYS 14 1HD LYS 14 -22.349 17.922 -12.578 110 HD3 LYS 14 2HD LYS 14 -23.575 17.068 -13.519 111 HE2 LYS 14 1HE LYS 14 -22.293 18.778 -14.807 112 HE3 LYS 14 2HE LYS 14 -24.039 19.021 -14.815 113 HZ1 LYS 14 3HZ LYS 14 -22.222 20.915 -14.214 114 HZ2 LYS 14 1HZ LYS 14 -22.673 20.381 -12.673 115 HZ3 LYS 14 2HZ LYS 14 -23.847 20.957 -13.745 116 H THR 15 H THR 15 -23.498 18.319 -7.831 117 HA THR 15 HA THR 15 -24.024 15.896 -6.313 118 HB THR 15 HB THR 15 -23.789 17.305 -4.323 119 HG1 THR 15 HG1 THR 15 -23.217 19.481 -6.057 120 HG21 THR 15 3HG2 THR 15 -21.653 16.711 -4.677 121 HG22 THR 15 1HG2 THR 15 -21.431 18.365 -5.248 122 HG23 THR 15 2HG2 THR 15 -21.746 17.068 -6.402 123 H LEU 16 H LEU 16 -25.622 16.405 -4.344 124 HA LEU 16 HA LEU 16 -28.209 16.642 -5.545 125 HB2 LEU 16 1HB LEU 16 -27.392 16.391 -2.654 126 HB3 LEU 16 2HB LEU 16 -29.045 16.271 -3.254 127 HG LEU 16 HG LEU 16 -26.996 14.402 -4.343 128 HD11 LEU 16 1HD1 LEU 16 -26.464 13.638 -2.321 129 HD12 LEU 16 2HD1 LEU 16 -28.115 13.025 -2.233 130 HD13 LEU 16 3HD1 LEU 16 -27.720 14.597 -1.538 131 HD21 LEU 16 3HD2 LEU 16 -29.389 14.567 -5.135 132 HD22 LEU 16 1HD2 LEU 16 -29.862 13.932 -3.558 133 HD23 LEU 16 2HD2 LEU 16 -28.852 12.964 -4.632 134 H THR 17 H THR 17 -26.041 18.802 -3.995 135 HA THR 17 HA THR 17 -28.141 20.751 -3.420 136 HB THR 17 HB THR 17 -26.383 20.426 -1.727 137 HG1 THR 17 HG1 THR 17 -26.950 22.446 -1.417 138 HG21 THR 17 3HG2 THR 17 -24.106 21.370 -2.236 139 HG22 THR 17 1HG2 THR 17 -24.565 21.373 -3.938 140 HG23 THR 17 2HG2 THR 17 -24.482 19.852 -3.050 141 H GLY 18 H GLY 18 -27.430 19.998 -6.177 142 HA2 GLY 18 1HA GLY 18 -27.013 20.992 -8.207 143 HA3 GLY 18 2HA GLY 18 -27.595 22.456 -7.430 144 H LYS 19 H LYS 19 -24.719 20.686 -6.460 145 HA LYS 19 HA LYS 19 -23.103 22.992 -7.331 146 HB2 LYS 19 1HB LYS 19 -23.098 22.892 -4.943 147 HB3 LYS 19 2HB LYS 19 -22.791 21.160 -4.953 148 HG2 LYS 19 1HG LYS 19 -20.783 22.882 -6.274 149 HG3 LYS 19 2HG LYS 19 -20.887 22.967 -4.514 150 HD2 LYS 19 1HD LYS 19 -20.832 20.380 -4.629 151 HD3 LYS 19 2HD LYS 19 -20.205 20.628 -6.260 152 HE2 LYS 19 1HE LYS 19 -18.239 21.532 -5.513 153 HE3 LYS 19 2HE LYS 19 -18.959 22.144 -4.025 154 HZ1 LYS 19 3HZ LYS 19 -18.168 20.374 -2.987 155 HZ2 LYS 19 1HZ LYS 19 -17.549 19.746 -4.431 156 HZ3 LYS 19 2HZ LYS 19 -19.126 19.366 -3.952 157 H THR 20 H THR 20 -21.570 22.626 -8.793 158 HA THR 20 HA THR 20 -21.062 19.902 -9.661 159 HB THR 20 HB THR 20 -19.643 22.219 -10.889 160 HG1 THR 20 HG1 THR 20 -21.489 22.852 -11.982 161 HG21 THR 20 3HG2 THR 20 -20.368 20.915 -12.961 162 HG22 THR 20 1HG2 THR 20 -20.882 19.650 -11.846 163 HG23 THR 20 2HG2 THR 20 -19.189 20.141 -11.903 164 H ILE 21 H ILE 21 -19.348 18.740 -9.089 165 HA ILE 21 HA ILE 21 -17.047 20.142 -7.892 166 HB ILE 21 HB ILE 21 -18.109 18.845 -6.186 167 HG12 ILE 21 1HG1 ILE 21 -15.497 18.638 -6.771 168 HG13 ILE 21 2HG1 ILE 21 -16.228 17.834 -5.386 169 HG21 ILE 21 1HG2 ILE 21 -19.461 17.350 -7.440 170 HG22 ILE 21 2HG2 ILE 21 -18.052 16.600 -8.188 171 HG23 ILE 21 3HG2 ILE 21 -18.371 16.359 -6.471 172 HD11 ILE 21 3HD1 ILE 21 -14.685 16.444 -6.809 173 HD12 ILE 21 1HD1 ILE 21 -16.281 15.761 -6.497 174 HD13 ILE 21 2HD1 ILE 21 -15.929 16.503 -8.058 175 H THR 22 H THR 22 -15.064 19.757 -8.694 176 HA THR 22 HA THR 22 -14.855 18.224 -11.132 177 HB THR 22 HB THR 22 -12.420 19.357 -9.854 178 HG1 THR 22 HG1 THR 22 -13.159 21.338 -9.824 179 HG21 THR 22 3HG2 THR 22 -11.776 19.809 -12.065 180 HG22 THR 22 1HG2 THR 22 -13.435 19.746 -12.657 181 HG23 THR 22 2HG2 THR 22 -12.616 18.263 -12.166 182 H LEU 23 H LEU 23 -14.016 16.243 -11.370 183 HA LEU 23 HA LEU 23 -12.488 15.080 -9.144 184 HB2 LEU 23 1HB LEU 23 -15.034 14.402 -9.487 185 HB3 LEU 23 2HB LEU 23 -14.320 13.320 -10.681 186 HG LEU 23 HG LEU 23 -12.864 12.414 -8.847 187 HD11 LEU 23 1HD1 LEU 23 -13.862 12.797 -6.527 188 HD12 LEU 23 2HD1 LEU 23 -14.615 14.230 -7.225 189 HD13 LEU 23 3HD1 LEU 23 -12.858 14.078 -7.207 190 HD21 LEU 23 3HD2 LEU 23 -14.864 11.242 -7.707 191 HD22 LEU 23 1HD2 LEU 23 -14.626 11.025 -9.441 192 HD23 LEU 23 2HD2 LEU 23 -15.847 12.154 -8.853 193 H GLU 24 H GLU 24 -10.877 13.638 -9.711 194 HA GLU 24 HA GLU 24 -10.317 13.451 -12.598 195 HB2 GLU 24 1HB GLU 24 -8.573 14.739 -11.761 196 HB3 GLU 24 2HB GLU 24 -8.526 13.867 -10.235 197 HG2 GLU 24 1HG GLU 24 -7.227 12.191 -11.067 198 HG3 GLU 24 2HG GLU 24 -7.833 12.386 -12.710 199 H VAL 25 H VAL 25 -10.161 11.488 -13.474 200 HA VAL 25 HA VAL 25 -9.522 9.185 -11.792 201 HB VAL 25 HB VAL 25 -11.706 8.618 -13.663 202 HG11 VAL 25 1HG1 VAL 25 -11.138 6.864 -12.260 203 HG12 VAL 25 2HG1 VAL 25 -10.943 7.916 -10.856 204 HG13 VAL 25 3HG1 VAL 25 -12.557 7.545 -11.464 205 HG21 VAL 25 3HG2 VAL 25 -13.447 9.537 -12.129 206 HG22 VAL 25 1HG2 VAL 25 -12.171 10.429 -11.300 207 HG23 VAL 25 2HG2 VAL 25 -12.526 10.767 -12.994 208 H GLU 26 H GLU 26 -9.423 7.145 -13.253 209 HA GLU 26 HA GLU 26 -7.931 7.903 -15.670 210 HB2 GLU 26 1HB GLU 26 -7.810 5.203 -14.356 211 HB3 GLU 26 2HB GLU 26 -6.632 5.961 -15.418 212 HG2 GLU 26 1HG GLU 26 -6.162 7.614 -13.633 213 HG3 GLU 26 2HG GLU 26 -7.246 6.717 -12.572 214 HA PRO 27 HA PRO 27 -10.836 5.989 -18.344 215 HB2 PRO 27 1HB PRO 27 -9.210 4.993 -20.277 216 HB3 PRO 27 2HB PRO 27 -9.534 6.721 -20.091 217 HG2 PRO 27 1HG PRO 27 -7.173 5.127 -19.171 218 HG3 PRO 27 2HG PRO 27 -7.214 6.725 -19.938 219 HD2 PRO 27 1HD PRO 27 -6.902 6.398 -17.268 220 HD3 PRO 27 2HD PRO 27 -7.743 7.797 -17.967 221 H SER 28 H SER 28 -8.424 4.145 -16.760 222 HA SER 28 HA SER 28 -9.725 1.629 -17.562 223 HB2 SER 28 1HB SER 28 -7.438 0.892 -16.217 224 HB3 SER 28 2HB SER 28 -7.592 1.017 -17.969 225 HG SER 28 HG SER 28 -6.575 2.923 -17.943 226 H ASP 29 H ASP 29 -9.356 3.830 -15.021 227 HA ASP 29 HA ASP 29 -9.453 2.147 -12.773 228 HB2 ASP 29 1HB ASP 29 -10.188 5.002 -13.292 229 HB3 ASP 29 2HB ASP 29 -10.645 4.260 -11.761 230 H THR 30 H THR 30 -11.196 1.527 -11.444 231 HA THR 30 HA THR 30 -13.656 1.033 -12.935 232 HB THR 30 HB THR 30 -14.189 -0.366 -10.820 233 HG1 THR 30 HG1 THR 30 -12.079 -1.065 -9.875 234 HG21 THR 30 3HG2 THR 30 -11.836 -1.584 -12.093 235 HG22 THR 30 1HG2 THR 30 -13.056 -0.981 -13.214 236 HG23 THR 30 2HG2 THR 30 -13.496 -2.168 -11.986 237 H ILE 31 H ILE 31 -15.708 1.037 -11.506 238 HA ILE 31 HA ILE 31 -16.387 3.638 -10.875 239 HB ILE 31 HB ILE 31 -17.616 1.122 -9.741 240 HG12 ILE 31 1HG1 ILE 31 -17.614 1.114 -12.177 241 HG13 ILE 31 2HG1 ILE 31 -19.247 1.389 -11.582 242 HG21 ILE 31 1HG2 ILE 31 -19.652 2.840 -9.840 243 HG22 ILE 31 2HG2 ILE 31 -18.614 2.676 -8.424 244 HG23 ILE 31 3HG2 ILE 31 -18.340 3.987 -9.572 245 HD11 ILE 31 3HD1 ILE 31 -17.494 3.122 -13.163 246 HD12 ILE 31 1HD1 ILE 31 -19.254 3.028 -13.104 247 HD13 ILE 31 2HD1 ILE 31 -18.376 3.931 -11.868 248 H GLU 32 H GLU 32 -15.269 1.065 -8.709 249 HA GLU 32 HA GLU 32 -15.612 2.297 -6.264 250 HB2 GLU 32 1HB GLU 32 -13.651 0.930 -5.505 251 HB3 GLU 32 2HB GLU 32 -14.895 0.018 -6.348 252 HG2 GLU 32 1HG GLU 32 -13.587 -0.154 -8.302 253 HG3 GLU 32 2HG GLU 32 -12.441 1.056 -7.728 254 H ASN 33 H ASN 33 -13.155 2.857 -8.695 255 HA ASN 33 HA ASN 33 -11.436 4.424 -7.051 256 HB2 ASN 33 1HB ASN 33 -11.698 4.322 -10.065 257 HB3 ASN 33 2HB ASN 33 -10.382 5.096 -9.187 258 HD21 ASN 33 2HD2 ASN 33 -8.831 3.842 -8.188 259 HD22 ASN 33 1HD2 ASN 33 -8.658 2.152 -8.504 260 H VAL 34 H VAL 34 -13.934 5.226 -9.445 261 HA VAL 34 HA VAL 34 -13.706 7.980 -9.454 262 HB VAL 34 HB VAL 34 -16.245 6.352 -9.640 263 HG11 VAL 34 1HG1 VAL 34 -15.665 9.219 -10.365 264 HG12 VAL 34 2HG1 VAL 34 -17.093 8.335 -10.905 265 HG13 VAL 34 3HG1 VAL 34 -16.831 8.624 -9.184 266 HG21 VAL 34 3HG2 VAL 34 -15.826 6.023 -11.851 267 HG22 VAL 34 1HG2 VAL 34 -14.921 7.528 -12.017 268 HG23 VAL 34 2HG2 VAL 34 -14.159 6.117 -11.283 269 H LYS 35 H LYS 35 -15.542 5.924 -7.225 270 HA LYS 35 HA LYS 35 -16.605 8.107 -5.724 271 HB2 LYS 35 1HB LYS 35 -17.819 6.052 -5.695 272 HB3 LYS 35 2HB LYS 35 -16.402 5.147 -5.180 273 HG2 LYS 35 1HG LYS 35 -17.178 7.294 -3.352 274 HG3 LYS 35 2HG LYS 35 -18.387 6.022 -3.541 275 HD2 LYS 35 1HD LYS 35 -16.238 4.481 -3.257 276 HD3 LYS 35 2HD LYS 35 -15.653 5.901 -2.386 277 HE2 LYS 35 1HE LYS 35 -17.861 5.816 -1.112 278 HE3 LYS 35 2HE LYS 35 -18.065 4.205 -1.799 279 HZ1 LYS 35 3HZ LYS 35 -16.942 4.494 0.501 280 HZ2 LYS 35 1HZ LYS 35 -15.566 4.876 -0.405 281 HZ3 LYS 35 2HZ LYS 35 -16.314 3.372 -0.598 282 H ALA 36 H ALA 36 -13.680 6.238 -5.612 283 HA ALA 36 HA ALA 36 -12.861 6.620 -2.987 284 HB1 ALA 36 1HB ALA 36 -11.757 5.510 -5.238 285 HB2 ALA 36 2HB ALA 36 -10.690 6.877 -4.918 286 HB3 ALA 36 3HB ALA 36 -10.962 5.661 -3.671 287 H LYS 37 H LYS 37 -12.577 8.778 -5.771 288 HA LYS 37 HA LYS 37 -11.070 10.761 -4.354 289 HB2 LYS 37 1HB LYS 37 -11.139 10.344 -6.893 290 HB3 LYS 37 2HB LYS 37 -12.649 11.246 -6.871 291 HG2 LYS 37 1HG LYS 37 -11.125 12.883 -7.392 292 HG3 LYS 37 2HG LYS 37 -11.248 13.053 -5.639 293 HD2 LYS 37 1HD LYS 37 -8.952 13.095 -6.020 294 HD3 LYS 37 2HD LYS 37 -9.254 11.417 -5.564 295 HE2 LYS 37 1HE LYS 37 -9.167 10.707 -7.838 296 HE3 LYS 37 2HE LYS 37 -9.156 12.371 -8.419 297 HZ1 LYS 37 3HZ LYS 37 -6.979 12.688 -7.658 298 HZ2 LYS 37 1HZ LYS 37 -6.955 11.161 -8.386 299 HZ3 LYS 37 2HZ LYS 37 -7.002 11.293 -6.701 300 H ILE 38 H ILE 38 -14.445 10.107 -4.917 301 HA ILE 38 HA ILE 38 -15.474 12.655 -4.269 302 HB ILE 38 HB ILE 38 -16.764 9.937 -3.997 303 HG12 ILE 38 1HG1 ILE 38 -16.080 10.527 -6.293 304 HG13 ILE 38 2HG1 ILE 38 -17.831 10.474 -6.127 305 HG21 ILE 38 1HG2 ILE 38 -17.980 12.694 -3.901 306 HG22 ILE 38 2HG2 ILE 38 -18.894 11.190 -4.003 307 HG23 ILE 38 3HG2 ILE 38 -17.905 11.525 -2.583 308 HD11 ILE 38 3HD1 ILE 38 -17.810 12.950 -5.890 309 HD12 ILE 38 1HD1 ILE 38 -16.087 12.917 -6.265 310 HD13 ILE 38 2HD1 ILE 38 -17.261 12.360 -7.458 311 H GLN 39 H GLN 39 -14.409 9.959 -2.328 312 HA GLN 39 HA GLN 39 -15.655 10.493 0.089 313 HB2 GLN 39 1HB GLN 39 -13.142 9.149 -0.730 314 HB3 GLN 39 2HB GLN 39 -13.272 9.609 0.963 315 HG2 GLN 39 1HG GLN 39 -15.540 8.155 -0.289 316 HG3 GLN 39 2HG GLN 39 -14.075 7.259 0.109 317 HE21 GLN 39 2HE2 GLN 39 -16.215 6.436 1.368 318 HE22 GLN 39 1HE2 GLN 39 -16.252 6.962 3.014 319 H ASP 40 H ASP 40 -12.912 12.063 -1.416 320 HA ASP 40 HA ASP 40 -12.191 13.574 0.920 321 HB2 ASP 40 1HB ASP 40 -10.619 12.922 -0.966 322 HB3 ASP 40 2HB ASP 40 -11.402 14.170 -1.932 323 H LYS 41 H LYS 41 -14.424 13.926 -1.679 324 HA LYS 41 HA LYS 41 -14.710 16.785 -1.401 325 HB2 LYS 41 1HB LYS 41 -16.628 14.945 -2.817 326 HB3 LYS 41 2HB LYS 41 -16.323 16.649 -3.129 327 HG2 LYS 41 1HG LYS 41 -14.333 14.440 -3.605 328 HG3 LYS 41 2HG LYS 41 -15.375 15.147 -4.842 329 HD2 LYS 41 1HD LYS 41 -13.549 16.453 -5.175 330 HD3 LYS 41 2HD LYS 41 -14.290 17.390 -3.875 331 HE2 LYS 41 1HE LYS 41 -12.850 16.418 -2.248 332 HE3 LYS 41 2HE LYS 41 -12.260 15.218 -3.397 333 HZ1 LYS 41 3HZ LYS 41 -11.884 18.062 -4.010 334 HZ2 LYS 41 1HZ LYS 41 -10.930 16.733 -4.440 335 HZ3 LYS 41 2HZ LYS 41 -10.872 17.340 -2.863 336 H GLU 42 H GLU 42 -16.721 13.937 -0.676 337 HA GLU 42 HA GLU 42 -18.180 15.593 1.277 338 HB2 GLU 42 1HB GLU 42 -19.215 13.401 -0.521 339 HB3 GLU 42 2HB GLU 42 -20.114 14.009 0.862 340 HG2 GLU 42 1HG GLU 42 -19.231 15.629 -1.516 341 HG3 GLU 42 2HG GLU 42 -20.862 15.032 -1.214 342 H GLY 43 H GLY 43 -16.808 12.448 0.512 343 HA2 GLY 43 1HA GLY 43 -15.948 10.841 1.926 344 HA3 GLY 43 2HA GLY 43 -16.265 11.925 3.272 345 H ILE 44 H ILE 44 -18.062 9.920 0.934 346 HA ILE 44 HA ILE 44 -19.765 9.041 3.172 347 HB ILE 44 HB ILE 44 -21.582 8.741 1.421 348 HG12 ILE 44 1HG1 ILE 44 -19.791 10.631 -0.121 349 HG13 ILE 44 2HG1 ILE 44 -20.112 8.955 -0.551 350 HG21 ILE 44 1HG2 ILE 44 -22.455 10.839 1.858 351 HG22 ILE 44 2HG2 ILE 44 -21.272 10.644 3.151 352 HG23 ILE 44 3HG2 ILE 44 -20.883 11.630 1.742 353 HD11 ILE 44 3HD1 ILE 44 -21.408 10.626 -1.852 354 HD12 ILE 44 1HD1 ILE 44 -22.400 9.440 -1.004 355 HD13 ILE 44 2HD1 ILE 44 -22.234 11.074 -0.360 356 HA PRO 45 HA PRO 45 -18.751 4.907 2.085 357 HB2 PRO 45 1HB PRO 45 -21.018 3.618 2.841 358 HB3 PRO 45 2HB PRO 45 -19.852 4.270 3.999 359 HG2 PRO 45 1HG PRO 45 -22.441 5.439 3.055 360 HG3 PRO 45 2HG PRO 45 -21.777 5.371 4.698 361 HD2 PRO 45 1HD PRO 45 -21.647 7.600 3.165 362 HD3 PRO 45 2HD PRO 45 -20.391 7.179 4.348 363 HA PRO 46 HA PRO 46 -20.374 3.782 -1.844 364 HB2 PRO 46 1HB PRO 46 -20.344 1.069 -1.739 365 HB3 PRO 46 2HB PRO 46 -18.874 2.042 -1.863 366 HG2 PRO 46 1HG PRO 46 -20.109 0.777 0.552 367 HG3 PRO 46 2HG PRO 46 -18.403 0.842 0.072 368 HD2 PRO 46 1HD PRO 46 -19.456 2.498 1.938 369 HD3 PRO 46 2HD PRO 46 -18.133 2.991 0.862 370 H ASP 47 H ASP 47 -21.902 2.283 0.954 371 HA ASP 47 HA ASP 47 -24.204 1.337 -0.424 372 HB2 ASP 47 1HB ASP 47 -23.668 1.880 2.499 373 HB3 ASP 47 2HB ASP 47 -25.179 1.194 1.907 374 H GLN 48 H GLN 48 -23.260 4.403 0.853 375 HA GLN 48 HA GLN 48 -25.995 5.434 0.604 376 HB2 GLN 48 1HB GLN 48 -23.524 6.626 1.868 377 HB3 GLN 48 2HB GLN 48 -25.062 7.468 1.728 378 HG2 GLN 48 1HG GLN 48 -26.127 5.991 3.212 379 HG3 GLN 48 2HG GLN 48 -24.812 4.821 3.116 380 HE21 GLN 48 2HE2 GLN 48 -24.337 4.745 5.259 381 HE22 GLN 48 1HE2 GLN 48 -23.695 6.079 6.148 382 H GLN 49 H GLN 49 -22.886 5.489 -0.884 383 HA GLN 49 HA GLN 49 -23.659 7.743 -2.596 384 HB2 GLN 49 1HB GLN 49 -21.411 7.714 -1.423 385 HB3 GLN 49 2HB GLN 49 -20.968 6.385 -2.486 386 HG2 GLN 49 1HG GLN 49 -21.487 7.901 -4.421 387 HG3 GLN 49 2HG GLN 49 -21.623 9.214 -3.252 388 HE21 GLN 49 2HE2 GLN 49 -19.721 8.687 -5.479 389 HE22 GLN 49 1HE2 GLN 49 -18.153 8.800 -4.763 390 H ARG 50 H ARG 50 -24.160 7.470 -4.685 391 HA ARG 50 HA ARG 50 -23.431 4.982 -6.034 392 HB2 ARG 50 1HB ARG 50 -26.251 6.004 -5.705 393 HB3 ARG 50 2HB ARG 50 -25.793 4.839 -6.940 394 HG2 ARG 50 1HG ARG 50 -25.445 4.433 -3.977 395 HG3 ARG 50 2HG ARG 50 -26.778 3.795 -4.941 396 HD2 ARG 50 1HD ARG 50 -25.089 2.614 -6.351 397 HD3 ARG 50 2HD ARG 50 -23.850 3.137 -5.211 398 HE ARG 50 HE ARG 50 -24.514 1.465 -3.811 399 HH11 ARG 50 1HH1 ARG 50 -27.094 2.127 -6.053 400 HH12 ARG 50 2HH1 ARG 50 -28.083 0.815 -5.504 401 HH21 ARG 50 1HH2 ARG 50 -25.807 -0.265 -3.079 402 HH22 ARG 50 2HH2 ARG 50 -27.350 -0.545 -3.812 403 H LEU 51 H LEU 51 -22.947 5.249 -8.144 404 HA LEU 51 HA LEU 51 -23.096 7.967 -9.205 405 HB2 LEU 51 1HB LEU 51 -21.597 5.520 -10.122 406 HB3 LEU 51 2HB LEU 51 -21.577 7.065 -10.970 407 HG LEU 51 HG LEU 51 -20.465 6.474 -8.231 408 HD11 LEU 51 1HD1 LEU 51 -18.356 6.764 -9.167 409 HD12 LEU 51 2HD1 LEU 51 -18.995 7.562 -10.604 410 HD13 LEU 51 3HD1 LEU 51 -19.221 5.826 -10.385 411 HD21 LEU 51 3HD2 LEU 51 -20.968 8.611 -7.783 412 HD22 LEU 51 1HD2 LEU 51 -21.297 8.991 -9.474 413 HD23 LEU 51 2HD2 LEU 51 -19.637 8.991 -8.877 414 H ILE 52 H ILE 52 -24.270 8.542 -10.955 415 HA ILE 52 HA ILE 52 -25.879 6.432 -12.240 416 HB ILE 52 HB ILE 52 -26.698 9.321 -11.982 417 HG12 ILE 52 1HG1 ILE 52 -26.520 8.395 -9.739 418 HG13 ILE 52 2HG1 ILE 52 -28.216 8.563 -10.177 419 HG21 ILE 52 1HG2 ILE 52 -28.873 7.520 -12.200 420 HG22 ILE 52 2HG2 ILE 52 -28.340 8.741 -13.354 421 HG23 ILE 52 3HG2 ILE 52 -27.699 7.101 -13.447 422 HD11 ILE 52 3HD1 ILE 52 -28.102 6.107 -10.847 423 HD12 ILE 52 1HD1 ILE 52 -26.577 6.068 -9.963 424 HD13 ILE 52 2HD1 ILE 52 -28.071 6.491 -9.126 425 H PHE 53 H PHE 53 -26.035 6.402 -14.440 426 HA PHE 53 HA PHE 53 -24.805 8.568 -15.972 427 HB2 PHE 53 1HB PHE 53 -23.081 6.779 -15.523 428 HB3 PHE 53 2HB PHE 53 -24.083 5.675 -16.458 429 HD1 PHE 53 HD2 PHE 53 -21.924 8.631 -16.602 430 HD2 PHE 53 HD1 PHE 53 -24.214 5.833 -18.847 431 HE1 PHE 53 HE2 PHE 53 -20.838 9.406 -18.669 432 HE2 PHE 53 HE1 PHE 53 -23.132 6.603 -20.918 433 HZ PHE 53 HZ PHE 53 -21.442 8.393 -20.831 434 H ALA 54 H ALA 54 -26.273 9.188 -17.400 435 HA ALA 54 HA ALA 54 -27.995 9.173 -18.890 436 HB1 ALA 54 1HB ALA 54 -27.827 7.680 -20.649 437 HB2 ALA 54 2HB ALA 54 -26.194 7.657 -19.980 438 HB3 ALA 54 3HB ALA 54 -27.319 6.350 -19.608 439 H GLY 55 H GLY 55 -28.636 8.418 -16.218 440 HA2 GLY 55 1HA GLY 55 -30.570 7.763 -15.138 441 HA3 GLY 55 2HA GLY 55 -31.207 7.236 -16.689 442 H LYS 56 H LYS 56 -28.130 6.009 -15.792 443 HA LYS 56 HA LYS 56 -29.358 3.493 -14.882 444 HB2 LYS 56 1HB LYS 56 -28.576 3.420 -17.281 445 HB3 LYS 56 2HB LYS 56 -26.940 3.662 -16.683 446 HG2 LYS 56 1HG LYS 56 -27.440 1.578 -15.221 447 HG3 LYS 56 2HG LYS 56 -28.729 1.290 -16.392 448 HD2 LYS 56 1HD LYS 56 -25.996 1.891 -17.409 449 HD3 LYS 56 2HD LYS 56 -26.306 0.292 -16.730 450 HE2 LYS 56 1HE LYS 56 -26.822 -0.052 -18.945 451 HE3 LYS 56 2HE LYS 56 -28.403 0.358 -18.284 452 HZ1 LYS 56 3HZ LYS 56 -27.049 2.707 -19.074 453 HZ2 LYS 56 1HZ LYS 56 -28.522 2.091 -19.633 454 HZ3 LYS 56 2HZ LYS 56 -27.074 1.611 -20.363 455 H GLN 57 H GLN 57 -28.593 2.789 -13.002 456 HA GLN 57 HA GLN 57 -26.606 4.190 -11.569 457 HB2 GLN 57 1HB GLN 57 -27.531 1.389 -10.951 458 HB3 GLN 57 2HB GLN 57 -26.943 2.608 -9.828 459 HG2 GLN 57 1HG GLN 57 -29.005 3.965 -10.626 460 HG3 GLN 57 2HG GLN 57 -29.599 2.397 -11.169 461 HE21 GLN 57 2HE2 GLN 57 -28.969 4.437 -8.482 462 HE22 GLN 57 1HE2 GLN 57 -29.618 3.402 -7.261 463 H LEU 58 H LEU 58 -24.522 3.561 -10.935 464 HA LEU 58 HA LEU 58 -23.247 1.641 -12.766 465 HB2 LEU 58 1HB LEU 58 -21.846 3.798 -11.213 466 HB3 LEU 58 2HB LEU 58 -21.241 2.879 -12.589 467 HG LEU 58 HG LEU 58 -23.449 4.932 -12.711 468 HD11 LEU 58 1HD1 LEU 58 -21.134 5.636 -14.204 469 HD12 LEU 58 2HD1 LEU 58 -20.647 5.280 -12.547 470 HD13 LEU 58 3HD1 LEU 58 -21.887 6.494 -12.859 471 HD21 LEU 58 3HD2 LEU 58 -23.029 2.856 -14.414 472 HD22 LEU 58 1HD2 LEU 58 -22.030 4.114 -15.143 473 HD23 LEU 58 2HD2 LEU 58 -23.749 4.401 -14.870 474 H GLU 59 H GLU 59 -21.569 0.282 -11.944 475 HA GLU 59 HA GLU 59 -21.260 0.063 -9.068 476 HB2 GLU 59 1HB GLU 59 -22.553 -2.093 -10.735 477 HB3 GLU 59 2HB GLU 59 -21.827 -2.410 -9.166 478 HG2 GLU 59 1HG GLU 59 -24.098 -0.507 -9.693 479 HG3 GLU 59 2HG GLU 59 -24.245 -2.129 -9.017 480 H ASP 60 H ASP 60 -19.669 -1.673 -8.498 481 HA ASP 60 HA ASP 60 -17.293 -1.349 -9.909 482 HB2 ASP 60 1HB ASP 60 -17.803 -2.275 -7.490 483 HB3 ASP 60 2HB ASP 60 -17.724 -3.835 -8.305 484 H GLY 61 H GLY 61 -15.980 -3.398 -10.650 485 HA2 GLY 61 1HA GLY 61 -15.977 -5.429 -11.894 486 HA3 GLY 61 2HA GLY 61 -17.666 -5.153 -12.293 487 H ARG 62 H ARG 62 -17.675 -2.636 -13.306 488 HA ARG 62 HA ARG 62 -16.109 -2.991 -15.760 489 HB2 ARG 62 1HB ARG 62 -18.711 -1.695 -15.110 490 HB3 ARG 62 2HB ARG 62 -17.775 -1.033 -16.443 491 HG2 ARG 62 1HG ARG 62 -17.771 -3.198 -17.544 492 HG3 ARG 62 2HG ARG 62 -18.661 -3.899 -16.190 493 HD2 ARG 62 1HD ARG 62 -20.455 -2.175 -16.654 494 HD3 ARG 62 2HD ARG 62 -19.601 -1.825 -18.156 495 HE ARG 62 HE ARG 62 -20.509 -3.719 -19.039 496 HH11 ARG 62 1HH1 ARG 62 -20.590 -3.968 -15.568 497 HH12 ARG 62 2HH1 ARG 62 -21.471 -5.460 -15.566 498 HH21 ARG 62 1HH2 ARG 62 -21.668 -5.683 -19.049 499 HH22 ARG 62 2HH2 ARG 62 -22.083 -6.435 -17.546 500 H THR 63 H THR 63 -15.438 -0.900 -16.849 501 HA THR 63 HA THR 63 -14.225 0.865 -14.827 502 HB THR 63 HB THR 63 -12.539 -0.294 -16.109 503 HG1 THR 63 HG1 THR 63 -12.479 2.206 -17.362 504 HG21 THR 63 3HG2 THR 63 -12.691 0.679 -18.697 505 HG22 THR 63 1HG2 THR 63 -14.356 0.246 -18.313 506 HG23 THR 63 2HG2 THR 63 -13.077 -0.960 -18.176 507 H LEU 64 H LEU 64 -13.878 3.130 -15.502 508 HA LEU 64 HA LEU 64 -16.228 4.421 -16.162 509 HB2 LEU 64 1HB LEU 64 -13.359 5.280 -16.292 510 HB3 LEU 64 2HB LEU 64 -14.661 6.373 -16.756 511 HG LEU 64 HG LEU 64 -14.718 5.071 -14.066 512 HD11 LEU 64 1HD1 LEU 64 -12.669 5.928 -13.675 513 HD12 LEU 64 2HD1 LEU 64 -13.574 7.429 -13.484 514 HD13 LEU 64 3HD1 LEU 64 -12.771 7.073 -15.013 515 HD21 LEU 64 3HD2 LEU 64 -16.112 7.179 -15.486 516 HD22 LEU 64 1HD2 LEU 64 -15.498 7.722 -13.925 517 HD23 LEU 64 2HD2 LEU 64 -16.562 6.318 -14.014 518 H SER 65 H SER 65 -13.508 3.576 -18.272 519 HA SER 65 HA SER 65 -14.414 4.819 -20.604 520 HB2 SER 65 1HB SER 65 -12.191 4.058 -20.657 521 HB3 SER 65 2HB SER 65 -12.634 2.443 -20.105 522 HG SER 65 HG SER 65 -12.183 2.998 -22.511 523 H GLU 66 H GLU 66 -15.281 1.760 -19.140 524 HA GLU 66 HA GLU 66 -16.695 0.755 -21.416 525 HB2 GLU 66 1HB GLU 66 -16.422 -0.055 -18.550 526 HB3 GLU 66 2HB GLU 66 -17.718 -0.750 -19.513 527 HG2 GLU 66 1HG GLU 66 -14.826 -0.828 -20.325 528 HG3 GLU 66 2HG GLU 66 -15.617 -2.102 -19.398 529 H TYR 67 H TYR 67 -17.447 2.867 -18.786 530 HA TYR 67 HA TYR 67 -20.320 2.634 -19.209 531 HB2 TYR 67 1HB TYR 67 -18.637 4.174 -17.237 532 HB3 TYR 67 2HB TYR 67 -20.375 4.415 -17.377 533 HD1 TYR 67 HD1 TYR 67 -21.827 2.237 -17.198 534 HD2 TYR 67 HD2 TYR 67 -17.839 2.582 -15.757 535 HE1 TYR 67 HE1 TYR 67 -22.217 0.339 -15.682 536 HE2 TYR 67 HE2 TYR 67 -18.217 0.685 -14.238 537 HH TYR 67 HH TYR 67 -21.398 -0.830 -13.947 538 H ASN 68 H ASN 68 -18.142 3.931 -21.035 539 HA ASN 68 HA ASN 68 -18.053 5.631 -22.543 540 HB2 ASN 68 1HB ASN 68 -20.928 6.228 -21.849 541 HB3 ASN 68 2HB ASN 68 -20.100 6.501 -23.380 542 HD21 ASN 68 2HD2 ASN 68 -19.325 4.543 -24.507 543 HD22 ASN 68 1HD2 ASN 68 -20.309 3.125 -24.434 544 H ILE 69 H ILE 69 -17.607 6.104 -19.620 545 HA ILE 69 HA ILE 69 -18.383 8.880 -19.262 546 HB ILE 69 HB ILE 69 -16.650 7.173 -17.475 547 HG12 ILE 69 1HG1 ILE 69 -19.613 7.739 -17.246 548 HG13 ILE 69 2HG1 ILE 69 -18.932 6.228 -17.839 549 HG21 ILE 69 1HG2 ILE 69 -17.328 8.822 -15.749 550 HG22 ILE 69 2HG2 ILE 69 -16.355 9.518 -17.044 551 HG23 ILE 69 3HG2 ILE 69 -18.100 9.775 -17.016 552 HD11 ILE 69 3HD1 ILE 69 -19.619 6.041 -15.520 553 HD12 ILE 69 1HD1 ILE 69 -17.872 5.855 -15.678 554 HD13 ILE 69 2HD1 ILE 69 -18.549 7.373 -15.084 555 H GLN 70 H GLN 70 -17.230 10.427 -20.196 556 HA GLN 70 HA GLN 70 -14.333 10.028 -20.526 557 HB2 GLN 70 1HB GLN 70 -16.090 11.983 -22.012 558 HB3 GLN 70 2HB GLN 70 -14.415 11.580 -22.366 559 HG2 GLN 70 1HG GLN 70 -15.316 9.178 -22.689 560 HG3 GLN 70 2HG GLN 70 -16.884 9.969 -22.836 561 HE21 GLN 70 2HE2 GLN 70 -17.072 11.657 -24.473 562 HE22 GLN 70 1HE2 GLN 70 -16.163 11.505 -25.934 563 H LYS 71 H LYS 71 -13.515 12.593 -20.964 564 HA LYS 71 HA LYS 71 -13.437 13.634 -18.298 565 HB2 LYS 71 1HB LYS 71 -11.904 15.280 -19.176 566 HB3 LYS 71 2HB LYS 71 -11.499 13.707 -19.850 567 HG2 LYS 71 1HG LYS 71 -13.360 15.099 -21.550 568 HG3 LYS 71 2HG LYS 71 -11.926 16.081 -21.238 569 HD2 LYS 71 1HD LYS 71 -11.250 13.313 -21.776 570 HD3 LYS 71 2HD LYS 71 -12.163 14.037 -23.101 571 HE2 LYS 71 1HE LYS 71 -10.520 15.537 -23.593 572 HE3 LYS 71 2HE LYS 71 -9.958 15.635 -21.925 573 HZ1 LYS 71 3HZ LYS 71 -8.374 14.180 -22.389 574 HZ2 LYS 71 1HZ LYS 71 -8.866 14.151 -24.008 575 HZ3 LYS 71 2HZ LYS 71 -9.508 13.037 -22.909 576 H GLU 72 H GLU 72 -15.679 13.919 -20.717 577 HA GLU 72 HA GLU 72 -16.614 16.506 -19.663 578 HB2 GLU 72 1HB GLU 72 -17.720 16.767 -21.958 579 HB3 GLU 72 2HB GLU 72 -15.982 17.014 -21.865 580 HG2 GLU 72 1HG GLU 72 -15.584 14.799 -22.746 581 HG3 GLU 72 2HG GLU 72 -17.315 14.470 -22.761 582 H SER 73 H SER 73 -17.199 13.661 -18.936 583 HA SER 73 HA SER 73 -19.959 13.303 -19.759 584 HB2 SER 73 1HB SER 73 -17.983 11.682 -18.196 585 HB3 SER 73 2HB SER 73 -19.704 11.326 -18.044 586 HG SER 73 HG SER 73 -19.675 11.245 -20.424 587 H THR 74 H THR 74 -21.724 13.200 -18.303 588 HA THR 74 HA THR 74 -21.374 14.935 -15.960 589 HB THR 74 HB THR 74 -24.095 14.201 -16.908 590 HG1 THR 74 HG1 THR 74 -23.927 15.856 -18.535 591 HG21 THR 74 3HG2 THR 74 -24.170 15.686 -15.136 592 HG22 THR 74 1HG2 THR 74 -24.255 16.779 -16.517 593 HG23 THR 74 2HG2 THR 74 -22.727 16.552 -15.664 594 H LEU 75 H LEU 75 -21.177 13.910 -14.085 595 HA LEU 75 HA LEU 75 -22.505 11.317 -13.726 596 HB2 LEU 75 1HB LEU 75 -20.001 12.489 -12.812 597 HB3 LEU 75 2HB LEU 75 -20.919 11.737 -11.509 598 HG LEU 75 HG LEU 75 -19.263 10.213 -12.476 599 HD11 LEU 75 1HD1 LEU 75 -22.066 9.716 -12.169 600 HD12 LEU 75 2HD1 LEU 75 -20.699 8.662 -11.810 601 HD13 LEU 75 3HD1 LEU 75 -21.406 8.669 -13.426 602 HD21 LEU 75 3HD2 LEU 75 -19.294 11.144 -14.762 603 HD22 LEU 75 1HD2 LEU 75 -20.886 10.425 -15.009 604 HD23 LEU 75 2HD2 LEU 75 -19.483 9.390 -14.736 605 H HIS 76 H HIS 76 -23.768 10.889 -11.897 606 HA HIS 76 HA HIS 76 -24.575 13.231 -10.311 607 HB2 HIS 76 1HB HIS 76 -26.289 11.363 -11.894 608 HB3 HIS 76 2HB HIS 76 -26.921 12.017 -10.385 609 HD1 HIS 76 HD1 HIS 76 -28.332 13.985 -10.816 610 HD2 HIS 76 HD2 HIS 76 -25.159 13.763 -13.489 611 HE1 HIS 76 HE1 HIS 76 -28.569 15.995 -12.309 612 H LEU 77 H LEU 77 -24.711 12.890 -8.173 613 HA LEU 77 HA LEU 77 -24.359 10.128 -7.222 614 HB2 LEU 77 1HB LEU 77 -23.481 11.174 -5.153 615 HB3 LEU 77 2HB LEU 77 -22.525 11.519 -6.593 616 HG LEU 77 HG LEU 77 -24.228 13.676 -6.457 617 HD11 LEU 77 1HD1 LEU 77 -24.634 12.583 -4.052 618 HD12 LEU 77 2HD1 LEU 77 -24.641 14.324 -4.331 619 HD13 LEU 77 3HD1 LEU 77 -23.196 13.540 -3.692 620 HD21 LEU 77 3HD2 LEU 77 -22.301 14.895 -6.223 621 HD22 LEU 77 1HD2 LEU 77 -21.642 13.351 -6.765 622 HD23 LEU 77 2HD2 LEU 77 -21.601 13.775 -5.054 623 H VAL 78 H VAL 78 -26.121 9.217 -6.419 624 HA VAL 78 HA VAL 78 -28.137 10.932 -5.123 625 HB VAL 78 HB VAL 78 -29.705 8.983 -5.567 626 HG11 VAL 78 1HG1 VAL 78 -29.594 11.132 -6.869 627 HG12 VAL 78 2HG1 VAL 78 -28.598 10.280 -8.049 628 HG13 VAL 78 3HG1 VAL 78 -30.254 9.753 -7.747 629 HG21 VAL 78 3HG2 VAL 78 -27.855 8.159 -7.750 630 HG22 VAL 78 1HG2 VAL 78 -27.588 7.523 -6.126 631 HG23 VAL 78 2HG2 VAL 78 -29.126 7.242 -6.941 632 H LEU 79 H LEU 79 -28.878 10.430 -3.107 633 HA LEU 79 HA LEU 79 -27.362 8.384 -1.658 634 HB2 LEU 79 1HB LEU 79 -29.028 10.693 -0.671 635 HB3 LEU 79 2HB LEU 79 -28.198 9.538 0.370 636 HG LEU 79 HG LEU 79 -26.834 11.410 -1.564 637 HD11 LEU 79 1HD1 LEU 79 -26.395 11.785 1.295 638 HD12 LEU 79 2HD1 LEU 79 -28.052 12.108 0.787 639 HD13 LEU 79 3HD1 LEU 79 -26.714 12.970 0.029 640 HD21 LEU 79 3HD2 LEU 79 -25.869 9.345 0.378 641 HD22 LEU 79 1HD2 LEU 79 -24.865 10.736 -0.032 642 HD23 LEU 79 2HD2 LEU 79 -25.383 9.620 -1.296 643 H ARG 80 H ARG 80 -28.303 6.662 -0.696 644 HA ARG 80 HA ARG 80 -31.188 6.315 -1.144 645 HB2 ARG 80 1HB ARG 80 -28.864 4.508 -1.275 646 HB3 ARG 80 2HB ARG 80 -30.283 3.830 -0.489 647 HG2 ARG 80 1HG ARG 80 -31.434 3.679 -2.409 648 HG3 ARG 80 2HG ARG 80 -30.811 5.212 -3.024 649 HD2 ARG 80 1HD ARG 80 -29.702 3.864 -4.456 650 HD3 ARG 80 2HD ARG 80 -28.568 3.736 -3.111 651 HE ARG 80 HE ARG 80 -29.159 1.541 -2.879 652 HH11 ARG 80 1HH1 ARG 80 -31.587 3.170 -4.769 653 HH12 ARG 80 2HH1 ARG 80 -32.447 1.716 -5.157 654 HH21 ARG 80 1HH2 ARG 80 -30.282 -0.379 -3.382 655 HH22 ARG 80 2HH2 ARG 80 -31.704 -0.302 -4.367 656 H LEU 81 H LEU 81 -28.656 6.225 1.268 657 HA LEU 81 HA LEU 81 -30.720 5.880 3.341 658 HB2 LEU 81 1HB LEU 81 -28.018 4.657 3.068 659 HB3 LEU 81 2HB LEU 81 -28.629 5.012 4.683 660 HG LEU 81 HG LEU 81 -29.006 2.676 4.019 661 HD11 LEU 81 1HD1 LEU 81 -30.620 4.170 5.444 662 HD12 LEU 81 2HD1 LEU 81 -31.081 2.533 4.978 663 HD13 LEU 81 3HD1 LEU 81 -31.713 3.915 4.083 664 HD21 LEU 81 3HD2 LEU 81 -30.127 2.022 2.149 665 HD22 LEU 81 1HD2 LEU 81 -29.436 3.527 1.542 666 HD23 LEU 81 2HD2 LEU 81 -31.112 3.485 2.091 667 H ARG 82 H ARG 82 -30.242 6.915 5.399 668 HA ARG 82 HA ARG 82 -28.941 9.488 4.982 669 HB2 ARG 82 1HB ARG 82 -31.281 9.017 6.093 670 HB3 ARG 82 2HB ARG 82 -30.310 8.737 7.532 671 HG2 ARG 82 1HG ARG 82 -29.869 11.230 5.969 672 HG3 ARG 82 2HG ARG 82 -31.294 11.104 7.003 673 HD2 ARG 82 1HD ARG 82 -28.665 10.318 8.144 674 HD3 ARG 82 2HD ARG 82 -28.978 12.036 7.900 675 HE ARG 82 HE ARG 82 -30.104 10.361 9.911 676 HH11 ARG 82 1HH1 ARG 82 -30.746 13.119 7.886 677 HH12 ARG 82 2HH1 ARG 82 -31.900 13.814 8.975 678 HH21 ARG 82 1HH2 ARG 82 -31.623 11.266 11.353 679 HH22 ARG 82 2HH2 ARG 82 -32.398 12.759 10.947 680 H GLY 83 H GLY 83 -27.057 10.080 5.878 681 HA2 GLY 83 1HA GLY 83 -26.009 9.191 8.308 682 HA3 GLY 83 2HA GLY 83 -25.355 8.152 7.050 683 H TYR 84 H TYR 84 -25.836 11.611 7.755 684 HA TYR 84 HA TYR 84 -23.709 12.428 6.035 685 HB2 TYR 84 1HB TYR 84 -25.525 13.958 6.468 686 HB3 TYR 84 2HB TYR 84 -25.222 13.899 8.201 687 HD1 TYR 84 HD1 TYR 84 -24.085 15.250 4.991 688 HD2 TYR 84 HD2 TYR 84 -23.372 15.125 9.184 689 HE1 TYR 84 HE1 TYR 84 -22.579 17.184 4.787 690 HE2 TYR 84 HE2 TYR 84 -21.865 17.059 8.991 691 HH TYR 84 HH TYR 84 -20.421 18.022 6.482 692 H ALA 85 H ALA 85 -21.615 12.877 6.485 693 HA ALA 85 HA ALA 85 -20.561 13.293 9.071 694 HB1 ALA 85 1HB ALA 85 -21.053 10.601 8.524 695 HB2 ALA 85 2HB ALA 85 -19.315 10.811 8.308 696 HB3 ALA 85 3HB ALA 85 -20.075 11.264 9.834 697 H ASP 86 H ASP 86 -18.669 14.322 8.869 698 HA ASP 86 HA ASP 86 -17.236 14.072 6.305 699 HB2 ASP 86 1HB ASP 86 -16.464 16.418 6.712 700 HB3 ASP 86 2HB ASP 86 -18.202 16.270 6.463 701 H LEU 87 H LEU 87 -14.918 14.370 6.380 702 HA LEU 87 HA LEU 87 -13.752 13.703 9.002 703 HB2 LEU 87 1HB LEU 87 -12.883 12.669 6.307 704 HB3 LEU 87 2HB LEU 87 -12.115 12.304 7.850 705 HG LEU 87 HG LEU 87 -14.877 11.458 6.978 706 HD11 LEU 87 1HD1 LEU 87 -13.677 9.872 5.943 707 HD12 LEU 87 2HD1 LEU 87 -13.480 9.206 7.564 708 HD13 LEU 87 3HD1 LEU 87 -12.218 10.224 6.870 709 HD21 LEU 87 3HD2 LEU 87 -14.380 10.007 9.175 710 HD22 LEU 87 1HD2 LEU 87 -15.239 11.546 9.209 711 HD23 LEU 87 2HD2 LEU 87 -13.521 11.487 9.604 712 H ARG 88 H ARG 88 -11.142 13.860 8.570 713 HA ARG 88 HA ARG 88 -10.579 16.380 7.194 714 HB2 ARG 88 1HB ARG 88 -11.097 16.871 9.596 715 HB3 ARG 88 2HB ARG 88 -9.726 15.865 10.046 716 HG2 ARG 88 1HG ARG 88 -8.214 17.361 8.876 717 HG3 ARG 88 2HG ARG 88 -9.578 18.354 8.358 718 HD2 ARG 88 1HD ARG 88 -9.178 17.817 11.266 719 HD3 ARG 88 2HD ARG 88 -8.163 19.014 10.463 720 HE ARG 88 HE ARG 88 -10.916 19.293 11.171 721 HH11 ARG 88 1HH1 ARG 88 -8.482 20.275 8.883 722 HH12 ARG 88 2HH1 ARG 88 -9.272 21.765 8.485 723 HH21 ARG 88 1HH2 ARG 88 -11.966 21.252 10.654 724 HH22 ARG 88 2HH2 ARG 88 -11.253 22.320 9.493 725 H GLU 89 H GLU 89 -8.630 16.427 6.218 726 HA GLU 89 HA GLU 89 -6.570 14.518 7.014 727 HB2 GLU 89 1HB GLU 89 -7.900 14.603 4.319 728 HB3 GLU 89 2HB GLU 89 -6.257 14.008 4.503 729 HG2 GLU 89 1HG GLU 89 -8.747 12.891 5.762 730 HG3 GLU 89 2HG GLU 89 -7.752 12.148 4.511 731 H ASP 90 H ASP 90 -4.647 14.869 5.278 732 HA ASP 90 HA ASP 90 -4.341 17.733 4.752 733 HB2 ASP 90 1HB ASP 90 -3.364 17.204 7.004 734 HB3 ASP 90 2HB ASP 90 -2.235 16.118 6.200 735 HA PRO 91 HA PRO 91 -2.851 14.982 1.303 736 HB2 PRO 91 1HB PRO 91 -4.213 16.286 -0.651 737 HB3 PRO 91 2HB PRO 91 -4.916 14.968 0.295 738 HG2 PRO 91 1HG PRO 91 -5.244 17.925 0.629 739 HG3 PRO 91 2HG PRO 91 -6.469 16.646 0.719 740 HD2 PRO 91 1HD PRO 91 -5.376 17.774 2.924 741 HD3 PRO 91 2HD PRO 91 -5.899 16.078 2.879 742 H ASP 92 H ASP 92 -1.986 15.867 -0.915 743 HA ASP 92 HA ASP 92 -1.072 18.538 -1.063 744 HB2 ASP 92 1HB ASP 92 0.340 17.563 0.839 745 HB3 ASP 92 2HB ASP 92 1.130 16.590 -0.400 746 H ARG 93 H ARG 93 -1.824 18.286 -3.175 747 HA ARG 93 HA ARG 93 -0.014 16.764 -4.923 748 HB2 ARG 93 1HB ARG 93 -3.011 16.968 -5.268 749 HB3 ARG 93 2HB ARG 93 -1.899 16.134 -6.344 750 HG2 ARG 93 1HG ARG 93 -2.632 14.357 -5.148 751 HG3 ARG 93 2HG ARG 93 -1.295 14.847 -4.106 752 HD2 ARG 93 1HD ARG 93 -2.846 14.825 -2.483 753 HD3 ARG 93 2HD ARG 93 -3.307 16.393 -3.144 754 HE ARG 93 HE ARG 93 -5.255 15.462 -3.898 755 HH11 ARG 93 1HH1 ARG 93 -3.010 12.921 -3.107 756 HH12 ARG 93 2HH1 ARG 93 -4.171 11.652 -3.315 757 HH21 ARG 93 1HH2 ARG 93 -6.793 13.800 -4.174 758 HH22 ARG 93 2HH2 ARG 93 -6.322 12.153 -3.923 759 H GLN 94 H GLN 94 0.084 17.564 -7.131 760 HA GLN 94 HA GLN 94 -0.972 20.228 -7.615 761 HB2 GLN 94 1HB GLN 94 1.225 20.518 -6.430 762 HB3 GLN 94 2HB GLN 94 1.999 19.711 -7.788 763 HG2 GLN 94 1HG GLN 94 1.467 21.462 -9.266 764 HG3 GLN 94 2HG GLN 94 0.323 22.175 -8.130 765 HE21 GLN 94 2HE2 GLN 94 3.605 21.928 -9.102 766 HE22 GLN 94 1HE2 GLN 94 4.254 23.074 -7.984 767 H ASP 95 H ASP 95 -1.279 20.668 -9.750 768 HA ASP 95 HA ASP 95 0.070 19.318 -11.857 769 HB2 ASP 95 1HB ASP 95 -1.651 17.904 -12.694 770 HB3 ASP 95 2HB ASP 95 -1.498 17.529 -10.980 771 H HIS 96 H HIS 96 -0.019 20.551 -13.629 772 HA HIS 96 HA HIS 96 -2.347 22.074 -14.337 773 HB2 HIS 96 1HB HIS 96 -1.095 23.426 -12.532 774 HB3 HIS 96 2HB HIS 96 0.125 23.698 -13.773 775 HD1 HIS 96 HD1 HIS 96 -3.552 24.341 -13.131 776 HD2 HIS 96 HD2 HIS 96 -0.439 25.732 -15.504 777 HE1 HIS 96 HE1 HIS 96 -4.454 26.379 -14.296 778 H HIS 97 H HIS 97 -2.238 21.055 -16.312 779 HA HIS 97 HA HIS 97 0.186 21.473 -17.917 780 HB2 HIS 97 1HB HIS 97 -1.961 19.416 -17.902 781 HB3 HIS 97 2HB HIS 97 -1.254 19.826 -19.462 782 HD1 HIS 97 HD1 HIS 97 1.114 20.044 -16.670 783 HD2 HIS 97 HD2 HIS 97 -0.180 17.144 -19.350 784 HE1 HIS 97 HE1 HIS 97 2.823 18.203 -16.546 785 HA PRO 98 HA PRO 98 -1.711 24.350 -20.629 786 HB2 PRO 98 1HB PRO 98 -0.787 23.574 -23.061 787 HB3 PRO 98 2HB PRO 98 0.238 24.349 -21.847 788 HG2 PRO 98 1HG PRO 98 -0.032 21.446 -22.523 789 HG3 PRO 98 2HG PRO 98 1.435 22.386 -22.194 790 HD2 PRO 98 1HD PRO 98 0.286 20.782 -20.339 791 HD3 PRO 98 2HD PRO 98 1.144 22.276 -19.910 792 H GLY 99 H GLY 99 -2.933 24.467 -22.831 793 HA2 GLY 99 1HA GLY 99 -5.110 22.536 -22.645 794 HA3 GLY 99 2HA GLY 99 -5.126 24.040 -23.554 795 H SER 100 H SER 100 -5.796 23.252 -25.500 796 HA SER 100 HA SER 100 -3.832 22.020 -27.157 797 HB2 SER 100 1HB SER 100 -4.920 19.935 -27.639 798 HB3 SER 100 2HB SER 100 -4.755 20.046 -25.887 799 HG SER 100 HG SER 100 -6.864 20.208 -25.682 800 H GLY 101 H GLY 101 -4.582 21.769 -29.396 801 HA2 GLY 101 1HA GLY 101 -7.142 22.925 -30.097 802 HA3 GLY 101 2HA GLY 101 -5.759 23.938 -30.487 803 H ALA 102 H ALA 102 -7.199 23.316 -32.578 804 HA ALA 102 HA ALA 102 -5.441 21.879 -34.253 805 HB1 ALA 102 1HB ALA 102 -6.399 19.837 -34.555 806 HB2 ALA 102 2HB ALA 102 -6.823 20.096 -32.862 807 HB3 ALA 102 3HB ALA 102 -8.013 20.405 -34.126 808 H GLN 103 H GLN 103 -6.829 21.246 -36.396 809 HA GLN 103 HA GLN 103 -7.834 23.771 -37.317 810 HB2 GLN 103 1HB GLN 103 -6.475 22.419 -38.800 811 HB3 GLN 103 2HB GLN 103 -7.612 21.084 -38.680 812 HG2 GLN 103 1HG GLN 103 -7.808 22.321 -40.791 813 HG3 GLN 103 2HG GLN 103 -9.295 22.344 -39.845 814 HE21 GLN 103 2HE2 GLN 103 -6.298 24.247 -39.995 815 HE22 GLN 103 1HE2 GLN 103 -7.078 25.787 -40.034 Start of MODEL 13 1 H1 GLY 1 H GLY 1 1.918 4.091 1.576 2 HA2 GLY 1 1HA GLY 1 2.157 6.129 -0.388 3 HA3 GLY 1 2HA GLY 1 3.477 5.416 0.528 4 H SER 2 H SER 2 2.489 5.968 -2.495 5 HA SER 2 HA SER 2 4.335 4.195 -3.677 6 HB2 SER 2 1HB SER 2 2.425 3.015 -5.071 7 HB3 SER 2 2HB SER 2 2.935 2.364 -3.514 8 HG SER 2 HG SER 2 0.975 2.669 -2.859 9 H LEU 3 H LEU 3 4.486 4.461 -5.984 10 HA LEU 3 HA LEU 3 3.065 6.852 -6.959 11 HB2 LEU 3 1HB LEU 3 5.566 7.036 -6.450 12 HB3 LEU 3 2HB LEU 3 5.802 6.013 -7.866 13 HG LEU 3 HG LEU 3 4.206 8.511 -8.166 14 HD11 LEU 3 1HD1 LEU 3 6.447 9.626 -8.730 15 HD12 LEU 3 2HD1 LEU 3 7.167 8.366 -7.728 16 HD13 LEU 3 3HD1 LEU 3 5.994 9.482 -7.031 17 HD21 LEU 3 3HD2 LEU 3 4.263 7.534 -10.199 18 HD22 LEU 3 1HD2 LEU 3 5.730 6.623 -9.841 19 HD23 LEU 3 2HD2 LEU 3 5.838 8.323 -10.297 20 H VAL 4 H VAL 4 2.053 6.716 -8.876 21 HA VAL 4 HA VAL 4 2.475 4.273 -10.474 22 HB VAL 4 HB VAL 4 0.050 4.652 -11.215 23 HG11 VAL 4 1HG1 VAL 4 0.892 2.842 -9.698 24 HG12 VAL 4 2HG1 VAL 4 0.439 3.865 -8.334 25 HG13 VAL 4 3HG1 VAL 4 -0.796 3.289 -9.455 26 HG21 VAL 4 3HG2 VAL 4 -0.272 6.038 -8.583 27 HG22 VAL 4 1HG2 VAL 4 0.090 6.965 -10.039 28 HG23 VAL 4 2HG2 VAL 4 -1.372 5.982 -9.960 29 HA PRO 5 HA PRO 5 3.285 6.772 -13.990 30 HB2 PRO 5 1HB PRO 5 2.198 5.277 -15.979 31 HB3 PRO 5 2HB PRO 5 3.687 4.824 -15.140 32 HG2 PRO 5 1HG PRO 5 0.894 3.838 -14.707 33 HG3 PRO 5 2HG PRO 5 2.410 2.920 -14.756 34 HD2 PRO 5 1HD PRO 5 1.198 3.607 -12.434 35 HD3 PRO 5 2HD PRO 5 2.961 3.471 -12.587 36 H ARG 6 H ARG 6 2.210 7.769 -15.953 37 HA ARG 6 HA ARG 6 -0.052 9.239 -15.151 38 HB2 ARG 6 1HB ARG 6 1.513 8.960 -17.672 39 HB3 ARG 6 2HB ARG 6 -0.070 9.719 -17.765 40 HG2 ARG 6 1HG ARG 6 1.287 11.536 -17.447 41 HG3 ARG 6 2HG ARG 6 0.817 11.165 -15.787 42 HD2 ARG 6 1HD ARG 6 2.903 9.949 -15.456 43 HD3 ARG 6 2HD ARG 6 3.366 10.268 -17.127 44 HE ARG 6 HE ARG 6 2.955 12.743 -16.092 45 HH11 ARG 6 1HH1 ARG 6 4.887 10.010 -15.133 46 HH12 ARG 6 2HH1 ARG 6 6.115 10.976 -14.383 47 HH21 ARG 6 1HH2 ARG 6 4.564 14.025 -15.108 48 HH22 ARG 6 2HH2 ARG 6 5.930 13.259 -14.369 49 H GLY 7 H GLY 7 -2.122 9.366 -16.361 50 HA2 GLY 7 1HA GLY 7 -3.445 7.933 -18.042 51 HA3 GLY 7 2HA GLY 7 -3.098 6.641 -16.903 52 H SER 8 H SER 8 -4.313 9.994 -16.758 53 HA SER 8 HA SER 8 -6.764 9.088 -15.518 54 HB2 SER 8 1HB SER 8 -5.063 11.052 -13.982 55 HB3 SER 8 2HB SER 8 -6.529 10.232 -13.446 56 HG SER 8 HG SER 8 -3.914 9.272 -13.644 57 H MET 9 H MET 9 -8.429 10.563 -15.686 58 HA MET 9 HA MET 9 -7.782 13.160 -16.905 59 HB2 MET 9 1HB MET 9 -9.495 12.942 -18.531 60 HB3 MET 9 2HB MET 9 -8.578 11.443 -18.588 61 HG2 MET 9 1HG MET 9 -10.653 11.070 -16.718 62 HG3 MET 9 2HG MET 9 -11.362 11.834 -18.139 63 HE1 MET 9 3HE MET 9 -10.758 11.124 -20.495 64 HE2 MET 9 1HE MET 9 -9.182 10.333 -20.485 65 HE3 MET 9 2HE MET 9 -10.613 9.440 -20.999 66 H GLN 10 H GLN 10 -9.484 14.776 -16.673 67 HA GLN 10 HA GLN 10 -10.821 14.493 -14.092 68 HB2 GLN 10 1HB GLN 10 -9.346 16.524 -15.013 69 HB3 GLN 10 2HB GLN 10 -10.915 17.048 -15.610 70 HG2 GLN 10 1HG GLN 10 -11.813 17.189 -13.446 71 HG3 GLN 10 2HG GLN 10 -10.477 16.275 -12.747 72 HE21 GLN 10 2HE2 GLN 10 -11.015 19.222 -14.650 73 HE22 GLN 10 1HE2 GLN 10 -9.881 20.194 -13.782 74 H ILE 11 H ILE 11 -12.995 14.557 -13.810 75 HA ILE 11 HA ILE 11 -14.659 14.853 -16.223 76 HB ILE 11 HB ILE 11 -16.192 13.154 -15.316 77 HG12 ILE 11 1HG1 ILE 11 -14.047 12.393 -13.349 78 HG13 ILE 11 2HG1 ILE 11 -15.305 13.546 -12.915 79 HG21 ILE 11 1HG2 ILE 11 -14.073 12.716 -16.807 80 HG22 ILE 11 2HG2 ILE 11 -13.538 11.809 -15.393 81 HG23 ILE 11 3HG2 ILE 11 -15.046 11.377 -16.199 82 HD11 ILE 11 3HD1 ILE 11 -15.456 10.631 -13.317 83 HD12 ILE 11 1HD1 ILE 11 -16.320 11.673 -12.186 84 HD13 ILE 11 2HD1 ILE 11 -16.836 11.579 -13.870 85 H PHE 12 H PHE 12 -17.026 15.205 -15.610 86 HA PHE 12 HA PHE 12 -17.132 17.129 -13.384 87 HB2 PHE 12 1HB PHE 12 -18.805 17.048 -15.904 88 HB3 PHE 12 2HB PHE 12 -18.947 18.244 -14.620 89 HD1 PHE 12 HD2 PHE 12 -16.428 19.212 -14.000 90 HD2 PHE 12 HD1 PHE 12 -17.807 17.854 -17.792 91 HE1 PHE 12 HE2 PHE 12 -14.735 20.608 -15.112 92 HE2 PHE 12 HE1 PHE 12 -16.114 19.247 -18.910 93 HZ PHE 12 HZ PHE 12 -14.576 20.627 -17.570 94 H VAL 13 H VAL 13 -18.470 16.732 -11.745 95 HA VAL 13 HA VAL 13 -20.629 14.765 -12.138 96 HB VAL 13 HB VAL 13 -19.001 15.042 -9.611 97 HG11 VAL 13 1HG1 VAL 13 -20.093 12.734 -9.246 98 HG12 VAL 13 2HG1 VAL 13 -21.075 14.180 -9.004 99 HG13 VAL 13 3HG1 VAL 13 -21.231 13.245 -10.491 100 HG21 VAL 13 3HG2 VAL 13 -17.406 13.884 -10.654 101 HG22 VAL 13 1HG2 VAL 13 -18.533 12.528 -10.686 102 HG23 VAL 13 2HG2 VAL 13 -18.426 13.618 -12.068 103 H LYS 14 H LYS 14 -22.560 15.163 -11.112 104 HA LYS 14 HA LYS 14 -22.825 17.840 -9.922 105 HB2 LYS 14 1HB LYS 14 -24.676 16.108 -11.519 106 HB3 LYS 14 2HB LYS 14 -25.345 17.313 -10.426 107 HG2 LYS 14 1HG LYS 14 -25.221 18.274 -12.599 108 HG3 LYS 14 2HG LYS 14 -23.981 19.036 -11.600 109 HD2 LYS 14 1HD LYS 14 -22.259 17.726 -12.610 110 HD3 LYS 14 2HD LYS 14 -23.441 16.716 -13.447 111 HE2 LYS 14 1HE LYS 14 -22.372 18.394 -14.920 112 HE3 LYS 14 2HE LYS 14 -24.123 18.569 -14.823 113 HZ1 LYS 14 3HZ LYS 14 -23.872 20.634 -14.106 114 HZ2 LYS 14 1HZ LYS 14 -22.198 20.500 -14.313 115 HZ3 LYS 14 2HZ LYS 14 -22.898 20.130 -12.818 116 H THR 15 H THR 15 -23.871 18.135 -7.979 117 HA THR 15 HA THR 15 -24.202 15.708 -6.362 118 HB THR 15 HB THR 15 -24.064 17.204 -4.401 119 HG1 THR 15 HG1 THR 15 -23.322 19.286 -6.177 120 HG21 THR 15 3HG2 THR 15 -21.645 18.105 -5.061 121 HG22 THR 15 1HG2 THR 15 -21.899 17.019 -6.426 122 HG23 THR 15 2HG2 THR 15 -21.964 16.394 -4.778 123 H LEU 16 H LEU 16 -25.829 16.327 -4.406 124 HA LEU 16 HA LEU 16 -28.404 16.431 -5.653 125 HB2 LEU 16 1HB LEU 16 -27.330 15.918 -2.957 126 HB3 LEU 16 2HB LEU 16 -28.960 16.587 -3.015 127 HG LEU 16 HG LEU 16 -28.062 14.037 -4.357 128 HD11 LEU 16 1HD1 LEU 16 -28.743 12.875 -2.563 129 HD12 LEU 16 2HD1 LEU 16 -30.085 13.970 -2.231 130 HD13 LEU 16 3HD1 LEU 16 -28.456 14.386 -1.699 131 HD21 LEU 16 3HD2 LEU 16 -30.370 15.724 -4.716 132 HD22 LEU 16 1HD2 LEU 16 -30.842 14.131 -4.122 133 HD23 LEU 16 2HD2 LEU 16 -29.889 14.274 -5.600 134 H THR 17 H THR 17 -26.301 18.729 -4.211 135 HA THR 17 HA THR 17 -28.445 20.673 -3.806 136 HB THR 17 HB THR 17 -26.649 20.437 -2.089 137 HG1 THR 17 HG1 THR 17 -27.772 22.403 -2.237 138 HG21 THR 17 3HG2 THR 17 -24.965 20.618 -4.360 139 HG22 THR 17 1HG2 THR 17 -24.500 20.415 -2.671 140 HG23 THR 17 2HG2 THR 17 -24.653 22.033 -3.356 141 H GLY 18 H GLY 18 -27.691 19.762 -6.494 142 HA2 GLY 18 1HA GLY 18 -27.253 20.627 -8.577 143 HA3 GLY 18 2HA GLY 18 -27.861 22.132 -7.904 144 H LYS 19 H LYS 19 -25.020 20.572 -6.621 145 HA LYS 19 HA LYS 19 -23.409 22.812 -7.641 146 HB2 LYS 19 1HB LYS 19 -23.489 22.722 -5.221 147 HB3 LYS 19 2HB LYS 19 -23.009 21.031 -5.232 148 HG2 LYS 19 1HG LYS 19 -21.181 22.950 -6.544 149 HG3 LYS 19 2HG LYS 19 -21.298 23.019 -4.784 150 HD2 LYS 19 1HD LYS 19 -20.990 20.345 -6.036 151 HD3 LYS 19 2HD LYS 19 -19.584 21.413 -6.037 152 HE2 LYS 19 1HE LYS 19 -21.163 20.918 -3.536 153 HE3 LYS 19 2HE LYS 19 -19.905 19.798 -4.056 154 HZ1 LYS 19 3HZ LYS 19 -18.809 22.333 -4.213 155 HZ2 LYS 19 1HZ LYS 19 -18.446 21.127 -3.083 156 HZ3 LYS 19 2HZ LYS 19 -19.632 22.282 -2.736 157 H THR 20 H THR 20 -21.842 22.428 -9.064 158 HA THR 20 HA THR 20 -21.292 19.688 -9.854 159 HB THR 20 HB THR 20 -19.899 22.014 -11.109 160 HG1 THR 20 HG1 THR 20 -21.695 22.796 -11.951 161 HG21 THR 20 3HG2 THR 20 -21.057 19.404 -12.078 162 HG22 THR 20 1HG2 THR 20 -19.358 19.869 -11.996 163 HG23 THR 20 2HG2 THR 20 -20.430 20.647 -13.162 164 H ILE 21 H ILE 21 -19.607 18.558 -9.158 165 HA ILE 21 HA ILE 21 -17.334 20.014 -7.976 166 HB ILE 21 HB ILE 21 -18.414 18.737 -6.267 167 HG12 ILE 21 1HG1 ILE 21 -15.787 18.550 -6.796 168 HG13 ILE 21 2HG1 ILE 21 -16.536 17.769 -5.408 169 HG21 ILE 21 1HG2 ILE 21 -18.639 16.243 -6.506 170 HG22 ILE 21 2HG2 ILE 21 -19.721 17.200 -7.517 171 HG23 ILE 21 3HG2 ILE 21 -18.288 16.453 -8.222 172 HD11 ILE 21 3HD1 ILE 21 -14.956 16.356 -6.748 173 HD12 ILE 21 1HD1 ILE 21 -16.560 15.671 -6.491 174 HD13 ILE 21 2HD1 ILE 21 -16.148 16.392 -8.047 175 H THR 22 H THR 22 -15.332 19.646 -8.736 176 HA THR 22 HA THR 22 -15.055 18.051 -11.129 177 HB THR 22 HB THR 22 -12.803 19.465 -9.718 178 HG1 THR 22 HG1 THR 22 -13.864 21.257 -10.068 179 HG21 THR 22 3HG2 THR 22 -11.815 19.588 -11.879 180 HG22 THR 22 1HG2 THR 22 -13.308 19.075 -12.664 181 HG23 THR 22 2HG2 THR 22 -12.390 17.932 -11.683 182 H LEU 23 H LEU 23 -14.152 16.090 -11.300 183 HA LEU 23 HA LEU 23 -12.619 15.034 -9.028 184 HB2 LEU 23 1HB LEU 23 -15.159 14.296 -9.359 185 HB3 LEU 23 2HB LEU 23 -14.406 13.169 -10.485 186 HG LEU 23 HG LEU 23 -13.025 12.282 -8.661 187 HD11 LEU 23 1HD1 LEU 23 -14.467 14.376 -7.070 188 HD12 LEU 23 2HD1 LEU 23 -12.735 14.062 -7.177 189 HD13 LEU 23 3HD1 LEU 23 -13.782 12.938 -6.310 190 HD21 LEU 23 3HD2 LEU 23 -15.049 11.115 -9.090 191 HD22 LEU 23 1HD2 LEU 23 -16.005 12.323 -8.230 192 HD23 LEU 23 2HD2 LEU 23 -14.908 11.268 -7.338 193 H GLU 24 H GLU 24 -11.244 13.209 -9.576 194 HA GLU 24 HA GLU 24 -10.559 13.116 -12.440 195 HB2 GLU 24 1HB GLU 24 -8.204 12.930 -11.831 196 HB3 GLU 24 2HB GLU 24 -8.893 14.416 -11.192 197 HG2 GLU 24 1HG GLU 24 -9.200 13.186 -9.010 198 HG3 GLU 24 2HG GLU 24 -8.204 11.905 -9.699 199 H VAL 25 H VAL 25 -10.638 11.157 -13.308 200 HA VAL 25 HA VAL 25 -10.014 8.811 -11.685 201 HB VAL 25 HB VAL 25 -12.415 8.974 -11.442 202 HG11 VAL 25 1HG1 VAL 25 -12.530 9.011 -14.456 203 HG12 VAL 25 2HG1 VAL 25 -13.917 8.944 -13.368 204 HG13 VAL 25 3HG1 VAL 25 -12.881 10.371 -13.391 205 HG21 VAL 25 3HG2 VAL 25 -13.081 6.816 -12.419 206 HG22 VAL 25 1HG2 VAL 25 -11.631 6.839 -13.423 207 HG23 VAL 25 2HG2 VAL 25 -11.487 6.742 -11.668 208 H GLU 26 H GLU 26 -9.248 7.062 -12.851 209 HA GLU 26 HA GLU 26 -8.180 7.673 -15.440 210 HB2 GLU 26 1HB GLU 26 -8.155 4.965 -14.123 211 HB3 GLU 26 2HB GLU 26 -7.006 5.622 -15.281 212 HG2 GLU 26 1HG GLU 26 -6.373 7.313 -13.538 213 HG3 GLU 26 2HG GLU 26 -7.356 6.395 -12.399 214 HA PRO 27 HA PRO 27 -11.270 5.972 -18.052 215 HB2 PRO 27 1HB PRO 27 -9.757 5.012 -20.090 216 HB3 PRO 27 2HB PRO 27 -10.022 6.739 -19.822 217 HG2 PRO 27 1HG PRO 27 -7.672 5.044 -19.068 218 HG3 PRO 27 2HG PRO 27 -7.698 6.673 -19.768 219 HD2 PRO 27 1HD PRO 27 -7.285 6.228 -17.130 220 HD3 PRO 27 2HD PRO 27 -8.114 7.677 -17.735 221 H SER 28 H SER 28 -8.658 3.945 -16.944 222 HA SER 28 HA SER 28 -10.089 1.517 -17.728 223 HB2 SER 28 1HB SER 28 -7.888 0.546 -16.551 224 HB3 SER 28 2HB SER 28 -7.895 1.088 -18.229 225 HG SER 28 HG SER 28 -6.183 2.081 -17.255 226 H ASP 29 H ASP 29 -9.703 3.570 -15.068 227 HA ASP 29 HA ASP 29 -9.885 1.707 -12.944 228 HB2 ASP 29 1HB ASP 29 -10.305 4.649 -13.234 229 HB3 ASP 29 2HB ASP 29 -10.909 3.856 -11.782 230 H THR 30 H THR 30 -11.788 1.639 -11.430 231 HA THR 30 HA THR 30 -14.246 1.294 -13.009 232 HB THR 30 HB THR 30 -14.986 -0.219 -11.172 233 HG1 THR 30 HG1 THR 30 -13.798 -0.423 -9.426 234 HG21 THR 30 3HG2 THR 30 -12.601 -0.730 -12.868 235 HG22 THR 30 1HG2 THR 30 -14.185 -1.503 -12.884 236 HG23 THR 30 2HG2 THR 30 -13.007 -1.932 -11.644 237 H ILE 31 H ILE 31 -16.287 1.477 -11.578 238 HA ILE 31 HA ILE 31 -16.667 4.113 -10.846 239 HB ILE 31 HB ILE 31 -18.196 1.752 -9.748 240 HG12 ILE 31 1HG1 ILE 31 -18.130 1.643 -12.174 241 HG13 ILE 31 2HG1 ILE 31 -19.733 2.151 -11.654 242 HG21 ILE 31 1HG2 ILE 31 -19.992 3.753 -10.040 243 HG22 ILE 31 2HG2 ILE 31 -19.138 3.398 -8.539 244 HG23 ILE 31 3HG2 ILE 31 -18.546 4.667 -9.610 245 HD11 ILE 31 3HD1 ILE 31 -17.577 3.773 -12.946 246 HD12 ILE 31 1HD1 ILE 31 -19.244 3.524 -13.465 247 HD13 ILE 31 2HD1 ILE 31 -18.899 4.533 -12.059 248 H GLU 32 H GLU 32 -15.462 1.445 -8.946 249 HA GLU 32 HA GLU 32 -15.813 2.521 -6.378 250 HB2 GLU 32 1HB GLU 32 -13.584 0.712 -7.324 251 HB3 GLU 32 2HB GLU 32 -14.104 0.941 -5.661 252 HG2 GLU 32 1HG GLU 32 -16.377 0.086 -6.430 253 HG3 GLU 32 2HG GLU 32 -15.548 -0.440 -7.894 254 H ASN 33 H ASN 33 -13.045 2.706 -8.602 255 HA ASN 33 HA ASN 33 -11.322 4.168 -6.979 256 HB2 ASN 33 1HB ASN 33 -11.375 3.294 -9.666 257 HB3 ASN 33 2HB ASN 33 -11.056 5.026 -9.711 258 HD21 ASN 33 2HD2 ASN 33 -9.828 1.924 -8.965 259 HD22 ASN 33 1HD2 ASN 33 -8.243 2.418 -8.487 260 H VAL 34 H VAL 34 -14.090 5.187 -8.832 261 HA VAL 34 HA VAL 34 -13.535 7.970 -8.849 262 HB VAL 34 HB VAL 34 -16.240 6.632 -8.977 263 HG11 VAL 34 1HG1 VAL 34 -16.930 8.655 -10.156 264 HG12 VAL 34 2HG1 VAL 34 -16.332 9.036 -8.540 265 HG13 VAL 34 3HG1 VAL 34 -15.315 9.333 -9.951 266 HG21 VAL 34 3HG2 VAL 34 -15.747 5.888 -11.013 267 HG22 VAL 34 1HG2 VAL 34 -15.231 7.498 -11.515 268 HG23 VAL 34 2HG2 VAL 34 -14.078 6.398 -10.760 269 H LYS 35 H LYS 35 -15.509 5.918 -6.726 270 HA LYS 35 HA LYS 35 -16.482 7.951 -5.060 271 HB2 LYS 35 1HB LYS 35 -15.883 5.094 -4.277 272 HB3 LYS 35 2HB LYS 35 -17.000 6.190 -3.474 273 HG2 LYS 35 1HG LYS 35 -18.426 6.210 -5.440 274 HG3 LYS 35 2HG LYS 35 -17.292 5.157 -6.288 275 HD2 LYS 35 1HD LYS 35 -17.644 3.516 -4.363 276 HD3 LYS 35 2HD LYS 35 -19.028 4.518 -3.919 277 HE2 LYS 35 1HE LYS 35 -20.170 3.183 -5.314 278 HE3 LYS 35 2HE LYS 35 -19.445 4.167 -6.584 279 HZ1 LYS 35 3HZ LYS 35 -17.715 2.561 -6.860 280 HZ2 LYS 35 1HZ LYS 35 -19.199 1.751 -6.937 281 HZ3 LYS 35 2HZ LYS 35 -18.257 1.658 -5.536 282 H ALA 36 H ALA 36 -13.400 6.362 -5.189 283 HA ALA 36 HA ALA 36 -12.417 6.770 -2.632 284 HB1 ALA 36 1HB ALA 36 -10.594 5.889 -3.538 285 HB2 ALA 36 2HB ALA 36 -11.367 5.998 -5.120 286 HB3 ALA 36 3HB ALA 36 -10.353 7.320 -4.541 287 H LYS 37 H LYS 37 -12.380 8.999 -5.398 288 HA LYS 37 HA LYS 37 -11.112 11.101 -3.914 289 HB2 LYS 37 1HB LYS 37 -12.498 11.061 -6.597 290 HB3 LYS 37 2HB LYS 37 -11.714 12.486 -5.929 291 HG2 LYS 37 1HG LYS 37 -10.037 11.678 -7.242 292 HG3 LYS 37 2HG LYS 37 -9.660 10.859 -5.725 293 HD2 LYS 37 1HD LYS 37 -10.733 8.845 -6.484 294 HD3 LYS 37 2HD LYS 37 -11.316 9.655 -7.940 295 HE2 LYS 37 1HE LYS 37 -9.469 8.536 -8.742 296 HE3 LYS 37 2HE LYS 37 -8.786 10.116 -8.360 297 HZ1 LYS 37 3HZ LYS 37 -7.990 9.229 -6.262 298 HZ2 LYS 37 1HZ LYS 37 -7.385 8.320 -7.554 299 HZ3 LYS 37 2HZ LYS 37 -8.655 7.715 -6.616 300 H ILE 38 H ILE 38 -14.387 10.128 -4.591 301 HA ILE 38 HA ILE 38 -15.752 12.501 -4.066 302 HB ILE 38 HB ILE 38 -16.585 9.649 -3.544 303 HG12 ILE 38 1HG1 ILE 38 -16.164 10.200 -5.899 304 HG13 ILE 38 2HG1 ILE 38 -17.880 9.930 -5.612 305 HG21 ILE 38 1HG2 ILE 38 -18.117 12.218 -3.295 306 HG22 ILE 38 2HG2 ILE 38 -18.921 10.680 -3.604 307 HG23 ILE 38 3HG2 ILE 38 -17.975 10.900 -2.132 308 HD11 ILE 38 3HD1 ILE 38 -18.151 12.409 -5.465 309 HD12 ILE 38 1HD1 ILE 38 -16.476 12.558 -5.995 310 HD13 ILE 38 2HD1 ILE 38 -17.671 11.802 -7.049 311 H GLN 39 H GLN 39 -14.456 10.072 -1.872 312 HA GLN 39 HA GLN 39 -15.681 10.838 0.495 313 HB2 GLN 39 1HB GLN 39 -13.096 9.521 -0.186 314 HB3 GLN 39 2HB GLN 39 -13.325 10.082 1.465 315 HG2 GLN 39 1HG GLN 39 -14.024 7.875 1.529 316 HG3 GLN 39 2HG GLN 39 -15.529 8.784 1.399 317 HE21 GLN 39 2HE2 GLN 39 -13.209 6.830 -0.350 318 HE22 GLN 39 1HE2 GLN 39 -14.276 6.363 -1.626 319 H ASP 40 H ASP 40 -13.005 12.297 -1.224 320 HA ASP 40 HA ASP 40 -12.273 14.065 0.918 321 HB2 ASP 40 1HB ASP 40 -10.815 13.215 -1.065 322 HB3 ASP 40 2HB ASP 40 -11.561 14.535 -1.962 323 H LYS 41 H LYS 41 -14.594 14.080 -1.620 324 HA LYS 41 HA LYS 41 -14.952 16.952 -1.612 325 HB2 LYS 41 1HB LYS 41 -16.828 14.950 -2.849 326 HB3 LYS 41 2HB LYS 41 -16.551 16.623 -3.318 327 HG2 LYS 41 1HG LYS 41 -14.535 14.405 -3.600 328 HG3 LYS 41 2HG LYS 41 -15.583 14.994 -4.893 329 HD2 LYS 41 1HD LYS 41 -14.525 17.094 -4.938 330 HD3 LYS 41 2HD LYS 41 -13.747 16.828 -3.376 331 HE2 LYS 41 1HE LYS 41 -12.710 14.767 -4.728 332 HE3 LYS 41 2HE LYS 41 -12.984 15.873 -6.074 333 HZ1 LYS 41 3HZ LYS 41 -11.836 17.383 -4.071 334 HZ2 LYS 41 1HZ LYS 41 -11.103 16.865 -5.506 335 HZ3 LYS 41 2HZ LYS 41 -10.955 15.939 -4.098 336 H GLU 42 H GLU 42 -16.849 14.109 -0.616 337 HA GLU 42 HA GLU 42 -18.373 15.882 1.179 338 HB2 GLU 42 1HB GLU 42 -19.295 13.515 -0.439 339 HB3 GLU 42 2HB GLU 42 -20.205 14.108 0.943 340 HG2 GLU 42 1HG GLU 42 -19.504 15.703 -1.512 341 HG3 GLU 42 2HG GLU 42 -21.073 14.978 -1.163 342 H GLY 43 H GLY 43 -16.869 12.735 0.720 343 HA2 GLY 43 1HA GLY 43 -15.891 11.355 2.297 344 HA3 GLY 43 2HA GLY 43 -16.332 12.522 3.534 345 H ILE 44 H ILE 44 -17.966 10.258 1.312 346 HA ILE 44 HA ILE 44 -19.607 9.382 3.597 347 HB ILE 44 HB ILE 44 -21.403 8.880 1.873 348 HG12 ILE 44 1HG1 ILE 44 -20.125 10.991 0.181 349 HG13 ILE 44 2HG1 ILE 44 -19.601 9.321 -0.003 350 HG21 ILE 44 1HG2 ILE 44 -21.032 11.002 3.458 351 HG22 ILE 44 2HG2 ILE 44 -21.041 11.813 1.893 352 HG23 ILE 44 3HG2 ILE 44 -22.423 10.835 2.387 353 HD11 ILE 44 3HD1 ILE 44 -22.461 9.454 0.002 354 HD12 ILE 44 1HD1 ILE 44 -21.798 10.570 -1.192 355 HD13 ILE 44 2HD1 ILE 44 -21.367 8.860 -1.247 356 HA PRO 45 HA PRO 45 -18.331 5.272 2.714 357 HB2 PRO 45 1HB PRO 45 -20.512 3.880 3.536 358 HB3 PRO 45 2HB PRO 45 -19.392 4.662 4.658 359 HG2 PRO 45 1HG PRO 45 -22.049 5.615 3.662 360 HG3 PRO 45 2HG PRO 45 -21.385 5.671 5.305 361 HD2 PRO 45 1HD PRO 45 -21.395 7.824 3.664 362 HD3 PRO 45 2HD PRO 45 -20.117 7.544 4.864 363 HA PRO 46 HA PRO 46 -19.870 3.867 -1.158 364 HB2 PRO 46 1HB PRO 46 -19.636 1.172 -0.934 365 HB3 PRO 46 2HB PRO 46 -18.243 2.246 -1.109 366 HG2 PRO 46 1HG PRO 46 -19.375 1.000 1.367 367 HG3 PRO 46 2HG PRO 46 -17.680 1.172 0.875 368 HD2 PRO 46 1HD PRO 46 -18.850 2.825 2.672 369 HD3 PRO 46 2HD PRO 46 -17.570 3.367 1.567 370 H ASP 47 H ASP 47 -21.378 2.731 1.753 371 HA ASP 47 HA ASP 47 -23.501 1.261 0.609 372 HB2 ASP 47 1HB ASP 47 -23.020 2.554 3.266 373 HB3 ASP 47 2HB ASP 47 -24.633 1.963 2.877 374 H GLN 48 H GLN 48 -22.968 4.665 1.100 375 HA GLN 48 HA GLN 48 -25.711 5.241 0.214 376 HB2 GLN 48 1HB GLN 48 -23.696 7.084 1.511 377 HB3 GLN 48 2HB GLN 48 -25.347 7.507 1.077 378 HG2 GLN 48 1HG GLN 48 -26.254 6.115 2.735 379 HG3 GLN 48 2HG GLN 48 -24.722 5.279 2.983 380 HE21 GLN 48 2HE2 GLN 48 -26.739 7.291 4.432 381 HE22 GLN 48 1HE2 GLN 48 -25.643 8.254 5.357 382 H GLN 49 H GLN 49 -22.376 5.471 -0.654 383 HA GLN 49 HA GLN 49 -22.642 7.487 -2.647 384 HB2 GLN 49 1HB GLN 49 -20.513 6.498 -1.435 385 HB3 GLN 49 2HB GLN 49 -20.512 5.399 -2.807 386 HG2 GLN 49 1HG GLN 49 -20.250 8.389 -2.835 387 HG3 GLN 49 2HG GLN 49 -19.070 7.186 -3.352 388 HE21 GLN 49 2HE2 GLN 49 -20.993 9.450 -4.514 389 HE22 GLN 49 1HE2 GLN 49 -21.426 8.772 -6.043 390 H ARG 50 H ARG 50 -23.428 7.342 -4.642 391 HA ARG 50 HA ARG 50 -23.318 4.848 -6.114 392 HB2 ARG 50 1HB ARG 50 -25.851 6.015 -5.050 393 HB3 ARG 50 2HB ARG 50 -25.876 5.278 -6.647 394 HG2 ARG 50 1HG ARG 50 -24.877 3.223 -5.590 395 HG3 ARG 50 2HG ARG 50 -25.191 3.979 -4.027 396 HD2 ARG 50 1HD ARG 50 -27.606 4.272 -5.018 397 HD3 ARG 50 2HD ARG 50 -27.108 2.939 -6.059 398 HE ARG 50 HE ARG 50 -27.248 1.526 -4.262 399 HH11 ARG 50 1HH1 ARG 50 -27.272 4.820 -3.137 400 HH12 ARG 50 2HH1 ARG 50 -27.648 4.396 -1.500 401 HH21 ARG 50 1HH2 ARG 50 -27.744 0.954 -2.110 402 HH22 ARG 50 2HH2 ARG 50 -27.916 2.197 -0.916 403 H LEU 51 H LEU 51 -22.698 5.344 -8.103 404 HA LEU 51 HA LEU 51 -23.103 8.062 -9.093 405 HB2 LEU 51 1HB LEU 51 -21.383 5.787 -10.059 406 HB3 LEU 51 2HB LEU 51 -21.526 7.330 -10.898 407 HG LEU 51 HG LEU 51 -20.353 6.859 -8.159 408 HD11 LEU 51 1HD1 LEU 51 -18.876 8.131 -10.391 409 HD12 LEU 51 2HD1 LEU 51 -19.135 6.388 -10.470 410 HD13 LEU 51 3HD1 LEU 51 -18.295 7.093 -9.089 411 HD21 LEU 51 3HD2 LEU 51 -20.843 9.421 -9.670 412 HD22 LEU 51 1HD2 LEU 51 -19.797 9.281 -8.257 413 HD23 LEU 51 2HD2 LEU 51 -21.524 8.952 -8.112 414 H ILE 52 H ILE 52 -24.230 8.561 -10.926 415 HA ILE 52 HA ILE 52 -25.695 6.347 -12.209 416 HB ILE 52 HB ILE 52 -26.746 9.158 -11.942 417 HG12 ILE 52 1HG1 ILE 52 -26.446 8.199 -9.697 418 HG13 ILE 52 2HG1 ILE 52 -28.152 8.345 -10.105 419 HG21 ILE 52 1HG2 ILE 52 -28.217 8.389 -13.425 420 HG22 ILE 52 2HG2 ILE 52 -27.618 6.738 -13.266 421 HG23 ILE 52 3HG2 ILE 52 -28.836 7.347 -12.144 422 HD11 ILE 52 3HD1 ILE 52 -27.515 6.231 -8.951 423 HD12 ILE 52 1HD1 ILE 52 -28.335 6.010 -10.497 424 HD13 ILE 52 2HD1 ILE 52 -26.588 5.796 -10.387 425 H PHE 53 H PHE 53 -26.011 6.438 -14.429 426 HA PHE 53 HA PHE 53 -24.803 8.657 -15.900 427 HB2 PHE 53 1HB PHE 53 -23.057 6.895 -15.605 428 HB3 PHE 53 2HB PHE 53 -24.104 5.770 -16.464 429 HD1 PHE 53 HD2 PHE 53 -22.035 8.788 -16.779 430 HD2 PHE 53 HD1 PHE 53 -24.338 5.858 -18.836 431 HE1 PHE 53 HE2 PHE 53 -21.089 9.551 -18.918 432 HE2 PHE 53 HE1 PHE 53 -23.395 6.616 -20.978 433 HZ PHE 53 HZ PHE 53 -21.769 8.466 -21.021 434 H ALA 54 H ALA 54 -26.367 9.356 -17.188 435 HA ALA 54 HA ALA 54 -28.103 9.415 -18.658 436 HB1 ALA 54 1HB ALA 54 -26.775 6.831 -19.376 437 HB2 ALA 54 2HB ALA 54 -28.259 7.334 -20.186 438 HB3 ALA 54 3HB ALA 54 -26.821 8.351 -20.270 439 H GLY 55 H GLY 55 -28.783 8.714 -16.054 440 HA2 GLY 55 1HA GLY 55 -30.636 7.979 -14.906 441 HA3 GLY 55 2HA GLY 55 -31.349 7.563 -16.458 442 H LYS 56 H LYS 56 -28.277 6.207 -15.674 443 HA LYS 56 HA LYS 56 -29.532 3.699 -14.803 444 HB2 LYS 56 1HB LYS 56 -28.753 3.971 -17.363 445 HB3 LYS 56 2HB LYS 56 -27.224 3.469 -16.653 446 HG2 LYS 56 1HG LYS 56 -28.261 1.456 -15.783 447 HG3 LYS 56 2HG LYS 56 -29.824 1.966 -16.424 448 HD2 LYS 56 1HD LYS 56 -28.949 0.408 -17.977 449 HD3 LYS 56 2HD LYS 56 -28.735 2.002 -18.705 450 HE2 LYS 56 1HE LYS 56 -26.393 1.983 -17.777 451 HE3 LYS 56 2HE LYS 56 -26.655 0.291 -17.357 452 HZ1 LYS 56 3HZ LYS 56 -25.527 0.727 -19.544 453 HZ2 LYS 56 1HZ LYS 56 -27.006 1.321 -20.111 454 HZ3 LYS 56 2HZ LYS 56 -26.878 -0.290 -19.611 455 H GLN 57 H GLN 57 -28.580 2.878 -13.059 456 HA GLN 57 HA GLN 57 -26.444 4.128 -11.756 457 HB2 GLN 57 1HB GLN 57 -26.536 2.347 -10.173 458 HB3 GLN 57 2HB GLN 57 -28.185 2.646 -10.706 459 HG2 GLN 57 1HG GLN 57 -28.095 0.725 -12.172 460 HG3 GLN 57 2HG GLN 57 -26.408 0.449 -11.741 461 HE21 GLN 57 2HE2 GLN 57 -26.720 -1.572 -10.901 462 HE22 GLN 57 1HE2 GLN 57 -27.590 -1.866 -9.438 463 H LEU 58 H LEU 58 -24.328 3.247 -11.236 464 HA LEU 58 HA LEU 58 -23.153 1.878 -13.554 465 HB2 LEU 58 1HB LEU 58 -21.702 3.415 -11.413 466 HB3 LEU 58 2HB LEU 58 -21.070 2.878 -12.968 467 HG LEU 58 HG LEU 58 -23.148 5.025 -12.543 468 HD11 LEU 58 1HD1 LEU 58 -20.407 5.409 -13.680 469 HD12 LEU 58 2HD1 LEU 58 -20.676 5.445 -11.938 470 HD13 LEU 58 3HD1 LEU 58 -21.504 6.600 -12.982 471 HD21 LEU 58 3HD2 LEU 58 -22.466 3.446 -14.847 472 HD22 LEU 58 1HD2 LEU 58 -22.079 5.144 -15.124 473 HD23 LEU 58 2HD2 LEU 58 -23.715 4.678 -14.661 474 H GLU 59 H GLU 59 -21.311 0.414 -13.101 475 HA GLU 59 HA GLU 59 -21.626 -0.996 -10.536 476 HB2 GLU 59 1HB GLU 59 -21.256 -2.269 -13.253 477 HB3 GLU 59 2HB GLU 59 -21.311 -3.129 -11.722 478 HG2 GLU 59 1HG GLU 59 -23.634 -1.955 -11.489 479 HG3 GLU 59 2HG GLU 59 -23.509 -1.822 -13.242 480 H ASP 60 H ASP 60 -19.774 -1.975 -9.686 481 HA ASP 60 HA ASP 60 -17.335 -0.640 -10.234 482 HB2 ASP 60 1HB ASP 60 -17.469 -1.313 -8.027 483 HB3 ASP 60 2HB ASP 60 -18.177 -2.873 -8.435 484 H GLY 61 H GLY 61 -18.565 -3.859 -11.028 485 HA2 GLY 61 1HA GLY 61 -16.278 -5.056 -12.012 486 HA3 GLY 61 2HA GLY 61 -17.894 -5.365 -12.628 487 H ARG 62 H ARG 62 -18.145 -2.488 -13.425 488 HA ARG 62 HA ARG 62 -16.726 -2.758 -15.971 489 HB2 ARG 62 1HB ARG 62 -19.008 -0.947 -15.160 490 HB3 ARG 62 2HB ARG 62 -18.286 -1.000 -16.763 491 HG2 ARG 62 1HG ARG 62 -18.892 -3.557 -16.582 492 HG3 ARG 62 2HG ARG 62 -20.075 -2.952 -15.421 493 HD2 ARG 62 1HD ARG 62 -21.193 -1.697 -17.020 494 HD3 ARG 62 2HD ARG 62 -19.803 -1.662 -18.105 495 HE ARG 62 HE ARG 62 -20.550 -4.306 -17.923 496 HH11 ARG 62 1HH1 ARG 62 -22.026 -1.321 -18.938 497 HH12 ARG 62 2HH1 ARG 62 -23.062 -2.077 -20.102 498 HH21 ARG 62 1HH2 ARG 62 -21.909 -5.314 -19.454 499 HH22 ARG 62 2HH2 ARG 62 -22.995 -4.348 -20.395 500 H THR 63 H THR 63 -15.799 -0.812 -16.959 501 HA THR 63 HA THR 63 -14.454 0.829 -14.927 502 HB THR 63 HB THR 63 -12.836 -0.293 -16.239 503 HG1 THR 63 HG1 THR 63 -12.700 2.001 -17.752 504 HG21 THR 63 3HG2 THR 63 -14.750 0.183 -18.412 505 HG22 THR 63 1HG2 THR 63 -13.605 -1.136 -18.181 506 HG23 THR 63 2HG2 THR 63 -13.061 0.393 -18.870 507 H LEU 64 H LEU 64 -14.016 3.093 -15.461 508 HA LEU 64 HA LEU 64 -16.290 4.555 -16.023 509 HB2 LEU 64 1HB LEU 64 -13.375 5.235 -16.102 510 HB3 LEU 64 2HB LEU 64 -14.590 6.433 -16.544 511 HG LEU 64 HG LEU 64 -13.906 6.764 -14.255 512 HD11 LEU 64 1HD1 LEU 64 -16.041 6.788 -13.202 513 HD12 LEU 64 2HD1 LEU 64 -16.639 5.500 -14.247 514 HD13 LEU 64 3HD1 LEU 64 -16.296 7.093 -14.921 515 HD21 LEU 64 3HD2 LEU 64 -14.205 5.075 -12.549 516 HD22 LEU 64 1HD2 LEU 64 -13.148 4.460 -13.820 517 HD23 LEU 64 2HD2 LEU 64 -14.831 3.938 -13.744 518 H SER 65 H SER 65 -13.672 3.610 -18.208 519 HA SER 65 HA SER 65 -14.530 5.055 -20.458 520 HB2 SER 65 1HB SER 65 -12.295 4.073 -20.325 521 HB3 SER 65 2HB SER 65 -12.988 2.451 -20.324 522 HG SER 65 HG SER 65 -12.919 4.345 -22.417 523 H GLU 66 H GLU 66 -15.308 1.794 -19.332 524 HA GLU 66 HA GLU 66 -16.764 0.917 -21.543 525 HB2 GLU 66 1HB GLU 66 -16.729 0.217 -18.643 526 HB3 GLU 66 2HB GLU 66 -18.047 -0.399 -19.631 527 HG2 GLU 66 1HG GLU 66 -15.186 -0.760 -20.438 528 HG3 GLU 66 2HG GLU 66 -15.982 -1.868 -19.322 529 H TYR 67 H TYR 67 -17.622 3.104 -18.977 530 HA TYR 67 HA TYR 67 -20.438 3.088 -19.721 531 HB2 TYR 67 1HB TYR 67 -18.844 4.274 -17.487 532 HB3 TYR 67 2HB TYR 67 -20.403 4.986 -17.887 533 HD1 TYR 67 HD1 TYR 67 -22.289 3.045 -18.289 534 HD2 TYR 67 HD2 TYR 67 -18.877 2.754 -15.764 535 HE1 TYR 67 HE1 TYR 67 -23.425 1.313 -16.963 536 HE2 TYR 67 HE2 TYR 67 -20.003 1.020 -14.432 537 HH TYR 67 HH TYR 67 -23.147 -0.272 -15.378 538 H ASN 68 H ASN 68 -17.988 4.240 -21.275 539 HA ASN 68 HA ASN 68 -17.612 5.944 -22.733 540 HB2 ASN 68 1HB ASN 68 -20.137 5.345 -23.146 541 HB3 ASN 68 2HB ASN 68 -20.426 6.914 -22.399 542 HD21 ASN 68 2HD2 ASN 68 -20.386 8.628 -23.666 543 HD22 ASN 68 1HD2 ASN 68 -19.711 8.696 -25.254 544 H ILE 69 H ILE 69 -17.585 6.344 -19.715 545 HA ILE 69 HA ILE 69 -18.208 9.119 -19.323 546 HB ILE 69 HB ILE 69 -16.583 7.250 -17.593 547 HG12 ILE 69 1HG1 ILE 69 -19.460 8.115 -17.264 548 HG13 ILE 69 2HG1 ILE 69 -18.981 6.598 -18.016 549 HG21 ILE 69 1HG2 ILE 69 -17.087 8.891 -15.802 550 HG22 ILE 69 2HG2 ILE 69 -16.053 9.536 -17.077 551 HG23 ILE 69 3HG2 ILE 69 -17.763 9.964 -17.027 552 HD11 ILE 69 3HD1 ILE 69 -17.930 5.888 -15.946 553 HD12 ILE 69 1HD1 ILE 69 -18.364 7.421 -15.189 554 HD13 ILE 69 2HD1 ILE 69 -19.627 6.295 -15.689 555 H GLN 70 H GLN 70 -17.038 10.437 -20.639 556 HA GLN 70 HA GLN 70 -14.153 10.100 -20.831 557 HB2 GLN 70 1HB GLN 70 -15.861 12.235 -22.111 558 HB3 GLN 70 2HB GLN 70 -14.224 11.771 -22.554 559 HG2 GLN 70 1HG GLN 70 -16.653 10.012 -22.810 560 HG3 GLN 70 2HG GLN 70 -15.913 10.929 -24.122 561 HE21 GLN 70 2HE2 GLN 70 -16.246 8.205 -24.279 562 HE22 GLN 70 1HE2 GLN 70 -14.702 7.433 -24.234 563 H LYS 71 H LYS 71 -13.244 12.651 -21.088 564 HA LYS 71 HA LYS 71 -13.091 13.490 -18.352 565 HB2 LYS 71 1HB LYS 71 -11.513 15.161 -19.157 566 HB3 LYS 71 2HB LYS 71 -11.145 13.590 -19.856 567 HG2 LYS 71 1HG LYS 71 -12.932 14.992 -21.587 568 HG3 LYS 71 2HG LYS 71 -11.561 16.030 -21.188 569 HD2 LYS 71 1HD LYS 71 -10.820 13.265 -21.797 570 HD3 LYS 71 2HD LYS 71 -11.582 14.116 -23.144 571 HE2 LYS 71 1HE LYS 71 -9.913 16.025 -22.454 572 HE3 LYS 71 2HE LYS 71 -9.018 14.689 -21.732 573 HZ1 LYS 71 3HZ LYS 71 -8.352 13.990 -23.721 574 HZ2 LYS 71 1HZ LYS 71 -8.889 15.474 -24.333 575 HZ3 LYS 71 2HZ LYS 71 -9.897 14.118 -24.397 576 H GLU 72 H GLU 72 -15.332 14.050 -20.722 577 HA GLU 72 HA GLU 72 -16.184 16.551 -19.427 578 HB2 GLU 72 1HB GLU 72 -16.183 15.901 -22.373 579 HB3 GLU 72 2HB GLU 72 -17.129 17.213 -21.684 580 HG2 GLU 72 1HG GLU 72 -14.906 18.041 -20.713 581 HG3 GLU 72 2HG GLU 72 -14.155 16.940 -21.867 582 H SER 73 H SER 73 -16.972 13.851 -18.834 583 HA SER 73 HA SER 73 -19.668 13.628 -19.936 584 HB2 SER 73 1HB SER 73 -17.811 11.789 -18.504 585 HB3 SER 73 2HB SER 73 -19.542 11.516 -18.308 586 HG SER 73 HG SER 73 -19.734 11.273 -20.517 587 H THR 74 H THR 74 -21.493 13.266 -18.496 588 HA THR 74 HA THR 74 -21.270 14.919 -16.078 589 HB THR 74 HB THR 74 -23.938 14.117 -17.117 590 HG1 THR 74 HG1 THR 74 -23.851 15.543 -18.804 591 HG21 THR 74 3HG2 THR 74 -23.992 15.513 -15.228 592 HG22 THR 74 1HG2 THR 74 -24.312 16.593 -16.584 593 HG23 THR 74 2HG2 THR 74 -22.709 16.551 -15.850 594 H LEU 75 H LEU 75 -21.607 14.087 -14.108 595 HA LEU 75 HA LEU 75 -22.689 11.352 -13.931 596 HB2 LEU 75 1HB LEU 75 -20.244 12.550 -12.812 597 HB3 LEU 75 2HB LEU 75 -21.176 11.554 -11.697 598 HG LEU 75 HG LEU 75 -19.353 10.322 -12.815 599 HD11 LEU 75 1HD1 LEU 75 -21.278 8.709 -13.988 600 HD12 LEU 75 2HD1 LEU 75 -22.148 9.585 -12.729 601 HD13 LEU 75 3HD1 LEU 75 -20.718 8.640 -12.317 602 HD21 LEU 75 3HD2 LEU 75 -19.062 10.237 -15.041 603 HD22 LEU 75 1HD2 LEU 75 -20.028 11.712 -15.045 604 HD23 LEU 75 2HD2 LEU 75 -20.794 10.156 -15.368 605 H HIS 76 H HIS 76 -23.845 10.830 -11.997 606 HA HIS 76 HA HIS 76 -24.754 13.140 -10.426 607 HB2 HIS 76 1HB HIS 76 -26.412 11.207 -11.995 608 HB3 HIS 76 2HB HIS 76 -27.056 11.854 -10.488 609 HD1 HIS 76 HD1 HIS 76 -27.578 14.404 -10.423 610 HD2 HIS 76 HD2 HIS 76 -26.326 12.994 -14.125 611 HE1 HIS 76 HE1 HIS 76 -28.129 16.232 -12.060 612 H LEU 77 H LEU 77 -24.494 12.787 -8.329 613 HA LEU 77 HA LEU 77 -24.194 10.030 -7.382 614 HB2 LEU 77 1HB LEU 77 -23.182 11.023 -5.392 615 HB3 LEU 77 2HB LEU 77 -22.363 11.525 -6.870 616 HG LEU 77 HG LEU 77 -24.222 13.534 -6.407 617 HD11 LEU 77 1HD1 LEU 77 -24.258 12.301 -4.065 618 HD12 LEU 77 2HD1 LEU 77 -24.320 14.058 -4.195 619 HD13 LEU 77 3HD1 LEU 77 -22.795 13.256 -3.820 620 HD21 LEU 77 3HD2 LEU 77 -21.631 13.379 -7.024 621 HD22 LEU 77 1HD2 LEU 77 -21.482 13.859 -5.333 622 HD23 LEU 77 2HD2 LEU 77 -22.388 14.869 -6.459 623 H VAL 78 H VAL 78 -25.928 9.102 -6.535 624 HA VAL 78 HA VAL 78 -27.885 10.790 -5.118 625 HB VAL 78 HB VAL 78 -29.494 8.892 -5.552 626 HG11 VAL 78 1HG1 VAL 78 -28.445 10.129 -8.085 627 HG12 VAL 78 2HG1 VAL 78 -30.110 9.705 -7.681 628 HG13 VAL 78 3HG1 VAL 78 -29.319 11.054 -6.864 629 HG21 VAL 78 3HG2 VAL 78 -27.178 7.609 -6.446 630 HG22 VAL 78 1HG2 VAL 78 -28.837 7.021 -6.560 631 HG23 VAL 78 2HG2 VAL 78 -28.127 7.925 -7.897 632 H LEU 79 H LEU 79 -28.113 10.481 -3.004 633 HA LEU 79 HA LEU 79 -26.825 8.155 -1.779 634 HB2 LEU 79 1HB LEU 79 -27.900 10.661 -0.495 635 HB3 LEU 79 2HB LEU 79 -26.977 9.393 0.309 636 HG LEU 79 HG LEU 79 -25.406 11.064 -0.004 637 HD11 LEU 79 1HD1 LEU 79 -23.865 10.273 -1.691 638 HD12 LEU 79 2HD1 LEU 79 -25.160 9.390 -2.498 639 HD13 LEU 79 3HD1 LEU 79 -24.632 8.903 -0.888 640 HD21 LEU 79 3HD2 LEU 79 -27.006 12.351 -1.544 641 HD22 LEU 79 1HD2 LEU 79 -26.194 11.508 -2.863 642 HD23 LEU 79 2HD2 LEU 79 -25.271 12.560 -1.790 643 H ARG 80 H ARG 80 -27.988 6.497 -1.077 644 HA ARG 80 HA ARG 80 -30.676 6.925 -0.041 645 HB2 ARG 80 1HB ARG 80 -30.184 4.839 -2.166 646 HB3 ARG 80 2HB ARG 80 -31.723 5.301 -1.451 647 HG2 ARG 80 1HG ARG 80 -31.290 7.612 -2.451 648 HG3 ARG 80 2HG ARG 80 -30.038 6.819 -3.409 649 HD2 ARG 80 1HD ARG 80 -31.663 5.319 -4.371 650 HD3 ARG 80 2HD ARG 80 -32.927 5.961 -3.324 651 HE ARG 80 HE ARG 80 -31.918 8.101 -4.766 652 HH11 ARG 80 1HH1 ARG 80 -33.557 5.098 -5.413 653 HH12 ARG 80 2HH1 ARG 80 -34.342 5.684 -6.842 654 HH21 ARG 80 1HH2 ARG 80 -32.945 8.883 -6.646 655 HH22 ARG 80 2HH2 ARG 80 -33.993 7.837 -7.543 656 H LEU 81 H LEU 81 -31.231 5.511 1.550 657 HA LEU 81 HA LEU 81 -29.667 3.086 1.943 658 HB2 LEU 81 1HB LEU 81 -28.983 5.407 3.280 659 HB3 LEU 81 2HB LEU 81 -29.979 4.534 4.444 660 HG LEU 81 HG LEU 81 -27.717 3.974 4.890 661 HD11 LEU 81 1HD1 LEU 81 -28.286 1.541 3.364 662 HD12 LEU 81 2HD1 LEU 81 -29.619 2.099 4.373 663 HD13 LEU 81 3HD1 LEU 81 -28.045 1.769 5.097 664 HD21 LEU 81 3HD2 LEU 81 -26.997 2.705 2.388 665 HD22 LEU 81 1HD2 LEU 81 -26.108 3.882 3.355 666 HD23 LEU 81 2HD2 LEU 81 -27.310 4.430 2.187 667 H ARG 82 H ARG 82 -31.097 1.524 2.246 668 HA ARG 82 HA ARG 82 -33.528 2.123 3.802 669 HB2 ARG 82 1HB ARG 82 -34.589 0.271 2.403 670 HB3 ARG 82 2HB ARG 82 -34.294 1.806 1.597 671 HG2 ARG 82 1HG ARG 82 -32.173 -0.252 1.414 672 HG3 ARG 82 2HG ARG 82 -33.661 -0.528 0.507 673 HD2 ARG 82 1HD ARG 82 -33.373 1.827 -0.394 674 HD3 ARG 82 2HD ARG 82 -31.750 1.783 0.291 675 HE ARG 82 HE ARG 82 -31.888 -0.475 -1.218 676 HH11 ARG 82 1HH1 ARG 82 -32.439 2.906 -1.836 677 HH12 ARG 82 2HH1 ARG 82 -31.956 2.815 -3.497 678 HH21 ARG 82 1HH2 ARG 82 -31.249 -0.608 -3.403 679 HH22 ARG 82 2HH2 ARG 82 -31.280 0.816 -4.388 680 H GLY 83 H GLY 83 -34.558 0.034 4.656 681 HA2 GLY 83 1HA GLY 83 -32.634 -1.259 6.316 682 HA3 GLY 83 2HA GLY 83 -34.350 -1.630 6.233 683 H TYR 84 H TYR 84 -31.181 -2.463 5.138 684 HA TYR 84 HA TYR 84 -32.006 -5.084 4.404 685 HB2 TYR 84 1HB TYR 84 -32.657 -3.630 2.391 686 HB3 TYR 84 2HB TYR 84 -30.928 -3.464 2.104 687 HD1 TYR 84 HD2 TYR 84 -29.570 -5.506 1.605 688 HD2 TYR 84 HD1 TYR 84 -33.820 -5.605 1.782 689 HE1 TYR 84 HE2 TYR 84 -29.566 -7.637 0.377 690 HE2 TYR 84 HE1 TYR 84 -33.827 -7.737 0.555 691 HH TYR 84 HH TYR 84 -32.602 -9.305 -0.419 692 H ALA 85 H ALA 85 -30.343 -6.451 4.653 693 HA ALA 85 HA ALA 85 -27.647 -5.823 4.021 694 HB1 ALA 85 1HB ALA 85 -26.969 -6.148 6.552 695 HB2 ALA 85 2HB ALA 85 -27.339 -4.554 5.893 696 HB3 ALA 85 3HB ALA 85 -28.556 -5.428 6.823 697 H ASP 86 H ASP 86 -26.315 -7.623 4.089 698 HA ASP 86 HA ASP 86 -27.500 -10.108 5.124 699 HB2 ASP 86 1HB ASP 86 -27.789 -9.866 2.622 700 HB3 ASP 86 2HB ASP 86 -26.034 -9.936 2.489 701 H LEU 87 H LEU 87 -25.997 -11.749 5.694 702 HA LEU 87 HA LEU 87 -23.254 -10.749 6.095 703 HB2 LEU 87 1HB LEU 87 -24.887 -12.585 7.842 704 HB3 LEU 87 2HB LEU 87 -23.186 -12.204 8.100 705 HG LEU 87 HG LEU 87 -25.335 -10.098 8.099 706 HD11 LEU 87 1HD1 LEU 87 -26.017 -10.706 10.117 707 HD12 LEU 87 2HD1 LEU 87 -24.359 -10.717 10.715 708 HD13 LEU 87 3HD1 LEU 87 -25.039 -12.167 9.978 709 HD21 LEU 87 3HD2 LEU 87 -22.434 -10.190 8.542 710 HD22 LEU 87 1HD2 LEU 87 -23.343 -9.273 9.743 711 HD23 LEU 87 2HD2 LEU 87 -23.467 -8.853 8.035 712 H ARG 88 H ARG 88 -21.721 -12.689 6.582 713 HA ARG 88 HA ARG 88 -22.255 -14.780 4.573 714 HB2 ARG 88 1HB ARG 88 -20.479 -13.254 3.858 715 HB3 ARG 88 2HB ARG 88 -19.604 -13.553 5.354 716 HG2 ARG 88 1HG ARG 88 -18.981 -15.685 4.720 717 HG3 ARG 88 2HG ARG 88 -20.289 -15.827 3.544 718 HD2 ARG 88 1HD ARG 88 -18.128 -13.785 3.187 719 HD3 ARG 88 2HD ARG 88 -17.866 -15.461 2.705 720 HE ARG 88 HE ARG 88 -19.469 -13.512 1.359 721 HH11 ARG 88 1HH1 ARG 88 -19.087 -16.916 1.979 722 HH12 ARG 88 2HH1 ARG 88 -19.895 -17.405 0.527 723 HH21 ARG 88 1HH2 ARG 88 -20.535 -14.142 -0.556 724 HH22 ARG 88 2HH2 ARG 88 -20.718 -15.826 -0.915 725 H GLU 89 H GLU 89 -20.034 -14.223 7.314 726 HA GLU 89 HA GLU 89 -19.642 -16.903 7.954 727 HB2 GLU 89 1HB GLU 89 -18.775 -16.138 10.069 728 HB3 GLU 89 2HB GLU 89 -18.282 -15.009 8.815 729 HG2 GLU 89 1HG GLU 89 -18.928 -13.576 10.473 730 HG3 GLU 89 2HG GLU 89 -20.418 -13.706 9.540 731 H ASP 90 H ASP 90 -20.309 -17.879 10.127 732 HA ASP 90 HA ASP 90 -23.024 -17.207 10.937 733 HB2 ASP 90 1HB ASP 90 -23.483 -19.805 10.748 734 HB3 ASP 90 2HB ASP 90 -23.749 -18.734 9.375 735 HA PRO 91 HA PRO 91 -21.692 -18.489 14.914 736 HB2 PRO 91 1HB PRO 91 -23.944 -19.590 15.956 737 HB3 PRO 91 2HB PRO 91 -23.753 -17.851 15.704 738 HG2 PRO 91 1HG PRO 91 -25.174 -19.867 14.007 739 HG3 PRO 91 2HG PRO 91 -25.684 -18.231 14.464 740 HD2 PRO 91 1HD PRO 91 -24.605 -18.798 12.046 741 HD3 PRO 91 2HD PRO 91 -24.368 -17.235 12.855 742 H ASP 92 H ASP 92 -22.033 -20.492 16.510 743 HA ASP 92 HA ASP 92 -22.305 -23.066 15.366 744 HB2 ASP 92 1HB ASP 92 -19.666 -23.421 16.003 745 HB3 ASP 92 2HB ASP 92 -20.288 -23.212 14.369 746 H ARG 93 H ARG 93 -23.515 -23.499 17.180 747 HA ARG 93 HA ARG 93 -22.919 -22.902 19.813 748 HB2 ARG 93 1HB ARG 93 -24.308 -25.002 20.325 749 HB3 ARG 93 2HB ARG 93 -25.078 -23.714 19.408 750 HG2 ARG 93 1HG ARG 93 -25.649 -25.834 18.442 751 HG3 ARG 93 2HG ARG 93 -24.600 -24.953 17.329 752 HD2 ARG 93 1HD ARG 93 -24.083 -27.406 17.629 753 HD3 ARG 93 2HD ARG 93 -22.734 -26.297 17.874 754 HE ARG 93 HE ARG 93 -22.605 -27.023 20.030 755 HH11 ARG 93 1HH1 ARG 93 -25.773 -27.770 18.796 756 HH12 ARG 93 2HH1 ARG 93 -26.258 -28.651 20.207 757 HH21 ARG 93 1HH2 ARG 93 -23.231 -28.180 21.893 758 HH22 ARG 93 2HH2 ARG 93 -24.812 -28.883 21.968 759 H GLN 94 H GLN 94 -22.501 -24.698 21.521 760 HA GLN 94 HA GLN 94 -20.660 -26.765 20.770 761 HB2 GLN 94 1HB GLN 94 -19.288 -24.625 20.745 762 HB3 GLN 94 2HB GLN 94 -19.550 -24.545 22.482 763 HG2 GLN 94 1HG GLN 94 -18.564 -26.899 22.557 764 HG3 GLN 94 2HG GLN 94 -18.014 -26.582 20.913 765 HE21 GLN 94 2HE2 GLN 94 -16.050 -27.098 22.492 766 HE22 GLN 94 1HE2 GLN 94 -15.206 -25.687 23.019 767 H ASP 95 H ASP 95 -21.160 -28.387 22.072 768 HA ASP 95 HA ASP 95 -22.700 -28.083 24.420 769 HB2 ASP 95 1HB ASP 95 -22.209 -30.517 24.761 770 HB3 ASP 95 2HB ASP 95 -22.853 -30.130 23.168 771 H HIS 96 H HIS 96 -21.654 -26.707 25.849 772 HA HIS 96 HA HIS 96 -19.876 -27.917 27.683 773 HB2 HIS 96 1HB HIS 96 -18.364 -27.308 25.686 774 HB3 HIS 96 2HB HIS 96 -18.595 -25.637 26.192 775 HD1 HIS 96 HD1 HIS 96 -16.404 -25.031 27.198 776 HD2 HIS 96 HD2 HIS 96 -17.783 -28.710 28.549 777 HE1 HIS 96 HE1 HIS 96 -14.785 -25.741 28.987 778 H HIS 97 H HIS 97 -20.190 -26.988 29.605 779 HA HIS 97 HA HIS 97 -21.067 -24.182 29.689 780 HB2 HIS 97 1HB HIS 97 -22.919 -25.987 29.984 781 HB3 HIS 97 2HB HIS 97 -22.210 -26.215 31.580 782 HD1 HIS 97 HD1 HIS 97 -24.268 -23.853 29.578 783 HD2 HIS 97 HD2 HIS 97 -22.565 -24.052 33.362 784 HE1 HIS 97 HE1 HIS 97 -25.341 -22.000 30.897 785 HA PRO 98 HA PRO 98 -17.498 -25.013 32.564 786 HB2 PRO 98 1HB PRO 98 -16.025 -22.885 31.744 787 HB3 PRO 98 2HB PRO 98 -15.950 -24.465 30.957 788 HG2 PRO 98 1HG PRO 98 -17.466 -22.015 30.145 789 HG3 PRO 98 2HG PRO 98 -16.527 -23.134 29.140 790 HD2 PRO 98 1HD PRO 98 -19.228 -23.236 29.301 791 HD3 PRO 98 2HD PRO 98 -18.231 -24.684 29.053 792 H GLY 99 H GLY 99 -16.718 -23.646 34.308 793 HA2 GLY 99 1HA GLY 99 -18.799 -21.834 35.226 794 HA3 GLY 99 2HA GLY 99 -17.445 -22.435 36.172 795 H SER 100 H SER 100 -15.845 -21.063 36.592 796 HA SER 100 HA SER 100 -15.373 -18.818 34.767 797 HB2 SER 100 1HB SER 100 -15.053 -17.379 36.881 798 HB3 SER 100 2HB SER 100 -16.707 -17.742 36.386 799 HG SER 100 HG SER 100 -15.510 -18.303 38.697 800 H GLY 101 H GLY 101 -13.261 -18.042 34.728 801 HA2 GLY 101 1HA GLY 101 -11.296 -19.900 35.848 802 HA3 GLY 101 2HA GLY 101 -11.004 -18.728 34.572 803 H ALA 102 H ALA 102 -9.627 -19.319 37.179 804 HA ALA 102 HA ALA 102 -9.776 -16.604 38.319 805 HB1 ALA 102 1HB ALA 102 -10.275 -17.705 40.207 806 HB2 ALA 102 2HB ALA 102 -9.673 -19.243 39.586 807 HB3 ALA 102 3HB ALA 102 -8.548 -18.064 40.261 808 H GLN 103 H GLN 103 -7.415 -19.267 38.485 809 HA GLN 103 HA GLN 103 -5.317 -17.325 37.802 810 HB2 GLN 103 1HB GLN 103 -5.365 -18.786 39.998 811 HB3 GLN 103 2HB GLN 103 -4.702 -20.020 38.935 812 HG2 GLN 103 1HG GLN 103 -3.521 -17.315 39.515 813 HG3 GLN 103 2HG GLN 103 -2.918 -18.877 40.065 814 HE21 GLN 103 2HE2 GLN 103 -3.103 -16.636 37.457 815 HE22 GLN 103 1HE2 GLN 103 -2.033 -17.465 36.383 Start of MODEL 14 1 H1 GLY 1 H GLY 1 5.409 -0.740 -3.276 2 HA2 GLY 1 1HA GLY 1 7.721 0.368 -3.833 3 HA3 GLY 1 2HA GLY 1 6.660 -0.085 -5.158 4 H SER 2 H SER 2 7.403 1.538 -6.520 5 HA SER 2 HA SER 2 6.906 4.302 -5.655 6 HB2 SER 2 1HB SER 2 8.796 3.054 -7.593 7 HB3 SER 2 2HB SER 2 8.212 4.680 -7.947 8 HG SER 2 HG SER 2 9.523 3.826 -5.578 9 H LEU 3 H LEU 3 6.209 5.776 -7.520 10 HA LEU 3 HA LEU 3 4.168 4.414 -9.150 11 HB2 LEU 3 1HB LEU 3 3.973 6.943 -7.546 12 HB3 LEU 3 2HB LEU 3 2.885 6.619 -8.894 13 HG LEU 3 HG LEU 3 3.146 4.668 -6.634 14 HD11 LEU 3 1HD1 LEU 3 1.657 5.785 -5.291 15 HD12 LEU 3 2HD1 LEU 3 1.017 6.754 -6.617 16 HD13 LEU 3 3HD1 LEU 3 2.600 7.128 -5.937 17 HD21 LEU 3 3HD2 LEU 3 1.342 5.146 -8.925 18 HD22 LEU 3 1HD2 LEU 3 0.586 4.616 -7.422 19 HD23 LEU 3 2HD2 LEU 3 1.846 3.633 -8.169 20 H VAL 4 H VAL 4 4.074 4.950 -11.259 21 HA VAL 4 HA VAL 4 5.844 7.121 -12.180 22 HB VAL 4 HB VAL 4 5.876 5.789 -14.369 23 HG11 VAL 4 1HG1 VAL 4 7.231 4.701 -11.904 24 HG12 VAL 4 2HG1 VAL 4 7.708 4.343 -13.565 25 HG13 VAL 4 3HG1 VAL 4 7.823 5.992 -12.949 26 HG21 VAL 4 3HG2 VAL 4 5.135 3.506 -12.551 27 HG22 VAL 4 1HG2 VAL 4 3.989 4.291 -13.638 28 HG23 VAL 4 2HG2 VAL 4 5.401 3.462 -14.294 29 HA PRO 5 HA PRO 5 2.446 9.083 -14.148 30 HB2 PRO 5 1HB PRO 5 3.624 10.104 -16.370 31 HB3 PRO 5 2HB PRO 5 3.906 10.752 -14.750 32 HG2 PRO 5 1HG PRO 5 5.594 8.875 -16.359 33 HG3 PRO 5 2HG PRO 5 6.091 10.266 -15.378 34 HD2 PRO 5 1HD PRO 5 6.293 7.713 -14.497 35 HD3 PRO 5 2HD PRO 5 5.971 9.077 -13.407 36 H ARG 6 H ARG 6 0.842 7.914 -15.005 37 HA ARG 6 HA ARG 6 1.382 6.390 -17.469 38 HB2 ARG 6 1HB ARG 6 -0.706 5.902 -15.337 39 HB3 ARG 6 2HB ARG 6 -0.556 4.981 -16.828 40 HG2 ARG 6 1HG ARG 6 1.505 5.151 -14.639 41 HG3 ARG 6 2HG ARG 6 0.429 3.789 -14.956 42 HD2 ARG 6 1HD ARG 6 2.609 4.850 -16.746 43 HD3 ARG 6 2HD ARG 6 2.587 3.307 -15.894 44 HE ARG 6 HE ARG 6 1.364 3.894 -18.401 45 HH11 ARG 6 1HH1 ARG 6 1.056 1.966 -15.518 46 HH12 ARG 6 2HH1 ARG 6 0.151 0.711 -16.298 47 HH21 ARG 6 1HH2 ARG 6 0.173 2.248 -19.438 48 HH22 ARG 6 2HH2 ARG 6 -0.350 0.872 -18.527 49 H GLY 7 H GLY 7 -0.889 8.531 -15.820 50 HA2 GLY 7 1HA GLY 7 -1.636 10.156 -17.803 51 HA3 GLY 7 2HA GLY 7 -2.577 8.721 -18.182 52 H SER 8 H SER 8 -3.900 11.031 -17.702 53 HA SER 8 HA SER 8 -5.483 10.328 -15.404 54 HB2 SER 8 1HB SER 8 -4.303 13.105 -15.421 55 HB3 SER 8 2HB SER 8 -5.208 12.314 -14.131 56 HG SER 8 HG SER 8 -2.914 12.356 -13.783 57 H MET 9 H MET 9 -7.440 11.673 -15.231 58 HA MET 9 HA MET 9 -8.086 13.391 -17.462 59 HB2 MET 9 1HB MET 9 -8.580 11.348 -18.557 60 HB3 MET 9 2HB MET 9 -9.345 10.676 -17.124 61 HG2 MET 9 1HG MET 9 -11.185 12.244 -17.347 62 HG3 MET 9 2HG MET 9 -10.411 12.969 -18.754 63 HE1 MET 9 3HE MET 9 -9.501 11.609 -20.539 64 HE2 MET 9 1HE MET 9 -9.882 9.922 -20.884 65 HE3 MET 9 2HE MET 9 -10.878 11.208 -21.567 66 H GLN 10 H GLN 10 -9.588 14.875 -16.916 67 HA GLN 10 HA GLN 10 -10.737 14.672 -14.232 68 HB2 GLN 10 1HB GLN 10 -9.403 16.717 -15.308 69 HB3 GLN 10 2HB GLN 10 -11.016 17.146 -15.862 70 HG2 GLN 10 1HG GLN 10 -11.819 17.430 -13.701 71 HG3 GLN 10 2HG GLN 10 -10.503 16.500 -12.988 72 HE21 GLN 10 2HE2 GLN 10 -11.223 19.496 -14.706 73 HE22 GLN 10 1HE2 GLN 10 -9.957 20.424 -13.986 74 H ILE 11 H ILE 11 -12.896 14.679 -13.831 75 HA ILE 11 HA ILE 11 -14.697 14.782 -16.162 76 HB ILE 11 HB ILE 11 -16.076 13.042 -15.189 77 HG12 ILE 11 1HG1 ILE 11 -13.973 12.846 -13.023 78 HG13 ILE 11 2HG1 ILE 11 -15.572 13.551 -12.814 79 HG21 ILE 11 1HG2 ILE 11 -13.210 12.113 -15.226 80 HG22 ILE 11 2HG2 ILE 11 -14.650 11.158 -15.575 81 HG23 ILE 11 3HG2 ILE 11 -14.163 12.450 -16.671 82 HD11 ILE 11 3HD1 ILE 11 -16.631 11.467 -13.076 83 HD12 ILE 11 1HD1 ILE 11 -15.161 10.712 -13.690 84 HD13 ILE 11 2HD1 ILE 11 -15.265 11.189 -11.995 85 H PHE 12 H PHE 12 -16.972 15.253 -15.584 86 HA PHE 12 HA PHE 12 -17.087 17.131 -13.319 87 HB2 PHE 12 1HB PHE 12 -18.733 17.144 -15.858 88 HB3 PHE 12 2HB PHE 12 -18.817 18.336 -14.565 89 HD1 PHE 12 HD2 PHE 12 -16.349 19.297 -13.952 90 HD2 PHE 12 HD1 PHE 12 -17.607 17.799 -17.732 91 HE1 PHE 12 HE2 PHE 12 -14.593 20.620 -15.057 92 HE2 PHE 12 HE1 PHE 12 -15.853 19.119 -18.843 93 HZ PHE 12 HZ PHE 12 -14.344 20.533 -17.506 94 H VAL 13 H VAL 13 -18.472 16.731 -11.721 95 HA VAL 13 HA VAL 13 -20.676 14.838 -12.209 96 HB VAL 13 HB VAL 13 -19.067 14.972 -9.658 97 HG11 VAL 13 1HG1 VAL 13 -20.262 12.671 -9.424 98 HG12 VAL 13 2HG1 VAL 13 -21.139 14.156 -9.046 99 HG13 VAL 13 3HG1 VAL 13 -21.394 13.349 -10.594 100 HG21 VAL 13 3HG2 VAL 13 -18.568 13.561 -12.155 101 HG22 VAL 13 1HG2 VAL 13 -17.510 13.816 -10.767 102 HG23 VAL 13 2HG2 VAL 13 -18.662 12.481 -10.764 103 H LYS 14 H LYS 14 -22.610 15.269 -11.208 104 HA LYS 14 HA LYS 14 -22.828 17.930 -9.987 105 HB2 LYS 14 1HB LYS 14 -24.634 16.235 -11.629 106 HB3 LYS 14 2HB LYS 14 -25.388 17.255 -10.410 107 HG2 LYS 14 1HG LYS 14 -25.421 18.690 -12.166 108 HG3 LYS 14 2HG LYS 14 -23.835 19.093 -11.505 109 HD2 LYS 14 1HD LYS 14 -22.778 17.583 -13.108 110 HD3 LYS 14 2HD LYS 14 -24.362 17.153 -13.757 111 HE2 LYS 14 1HE LYS 14 -23.258 19.957 -13.727 112 HE3 LYS 14 2HE LYS 14 -23.101 18.854 -15.094 113 HZ1 LYS 14 3HZ LYS 14 -24.977 20.310 -15.409 114 HZ2 LYS 14 1HZ LYS 14 -25.645 19.845 -13.926 115 HZ3 LYS 14 2HZ LYS 14 -25.531 18.726 -15.189 116 H THR 15 H THR 15 -23.785 18.249 -8.011 117 HA THR 15 HA THR 15 -24.109 15.838 -6.367 118 HB THR 15 HB THR 15 -23.820 17.283 -4.424 119 HG1 THR 15 HG1 THR 15 -23.259 19.461 -6.140 120 HG21 THR 15 3HG2 THR 15 -21.521 18.384 -5.569 121 HG22 THR 15 1HG2 THR 15 -21.843 16.921 -6.499 122 HG23 THR 15 2HG2 THR 15 -21.659 16.830 -4.747 123 H LEU 16 H LEU 16 -25.661 16.499 -4.364 124 HA LEU 16 HA LEU 16 -28.272 16.621 -5.516 125 HB2 LEU 16 1HB LEU 16 -27.388 16.660 -2.635 126 HB3 LEU 16 2HB LEU 16 -29.053 16.471 -3.181 127 HG LEU 16 HG LEU 16 -26.867 14.528 -3.894 128 HD11 LEU 16 1HD1 LEU 16 -26.853 14.076 -1.685 129 HD12 LEU 16 2HD1 LEU 16 -28.333 13.202 -2.078 130 HD13 LEU 16 3HD1 LEU 16 -28.423 14.830 -1.408 131 HD21 LEU 16 3HD2 LEU 16 -29.854 14.578 -4.137 132 HD22 LEU 16 1HD2 LEU 16 -28.965 13.055 -4.099 133 HD23 LEU 16 2HD2 LEU 16 -28.643 14.233 -5.372 134 H THR 17 H THR 17 -26.105 18.920 -4.130 135 HA THR 17 HA THR 17 -28.217 20.911 -3.791 136 HB THR 17 HB THR 17 -26.518 20.734 -2.019 137 HG1 THR 17 HG1 THR 17 -26.832 22.807 -1.795 138 HG21 THR 17 3HG2 THR 17 -24.296 22.022 -3.087 139 HG22 THR 17 1HG2 THR 17 -24.719 20.804 -4.289 140 HG23 THR 17 2HG2 THR 17 -24.406 20.325 -2.621 141 H GLY 18 H GLY 18 -27.449 19.935 -6.449 142 HA2 GLY 18 1HA GLY 18 -26.969 20.751 -8.543 143 HA3 GLY 18 2HA GLY 18 -27.547 22.283 -7.905 144 H LYS 19 H LYS 19 -24.761 20.682 -6.556 145 HA LYS 19 HA LYS 19 -23.084 22.865 -7.593 146 HB2 LYS 19 1HB LYS 19 -23.124 22.870 -5.203 147 HB3 LYS 19 2HB LYS 19 -22.837 21.137 -5.131 148 HG2 LYS 19 1HG LYS 19 -20.786 22.788 -6.481 149 HG3 LYS 19 2HG LYS 19 -20.920 22.930 -4.727 150 HD2 LYS 19 1HD LYS 19 -20.880 20.350 -4.740 151 HD3 LYS 19 2HD LYS 19 -20.253 20.519 -6.382 152 HE2 LYS 19 1HE LYS 19 -18.271 21.418 -5.678 153 HE3 LYS 19 2HE LYS 19 -18.981 22.122 -4.226 154 HZ1 LYS 19 3HZ LYS 19 -17.439 19.958 -4.206 155 HZ2 LYS 19 1HZ LYS 19 -18.957 19.222 -4.342 156 HZ3 LYS 19 2HZ LYS 19 -18.633 20.257 -3.044 157 H THR 20 H THR 20 -21.535 22.421 -9.014 158 HA THR 20 HA THR 20 -21.030 19.656 -9.744 159 HB THR 20 HB THR 20 -19.608 21.939 -11.049 160 HG1 THR 20 HG1 THR 20 -22.348 21.266 -11.471 161 HG21 THR 20 3HG2 THR 20 -19.552 19.334 -11.566 162 HG22 THR 20 1HG2 THR 20 -19.454 20.538 -12.850 163 HG23 THR 20 2HG2 THR 20 -20.989 19.743 -12.501 164 H ILE 21 H ILE 21 -19.333 18.515 -9.085 165 HA ILE 21 HA ILE 21 -17.063 19.958 -7.881 166 HB ILE 21 HB ILE 21 -18.147 18.657 -6.191 167 HG12 ILE 21 1HG1 ILE 21 -15.517 18.475 -6.721 168 HG13 ILE 21 2HG1 ILE 21 -16.270 17.683 -5.341 169 HG21 ILE 21 1HG2 ILE 21 -19.450 17.138 -7.470 170 HG22 ILE 21 2HG2 ILE 21 -18.014 16.399 -8.176 171 HG23 ILE 21 3HG2 ILE 21 -18.374 16.168 -6.465 172 HD11 ILE 21 3HD1 ILE 21 -16.321 15.596 -6.469 173 HD12 ILE 21 1HD1 ILE 21 -15.851 16.341 -7.996 174 HD13 ILE 21 2HD1 ILE 21 -14.700 16.263 -6.661 175 H THR 22 H THR 22 -15.062 19.609 -8.647 176 HA THR 22 HA THR 22 -14.777 18.029 -11.052 177 HB THR 22 HB THR 22 -12.488 19.403 -9.682 178 HG1 THR 22 HG1 THR 22 -14.532 20.634 -11.243 179 HG21 THR 22 3HG2 THR 22 -11.830 18.207 -11.607 180 HG22 THR 22 1HG2 THR 22 -11.950 19.888 -12.125 181 HG23 THR 22 2HG2 THR 22 -13.237 18.748 -12.522 182 H LEU 23 H LEU 23 -13.921 16.053 -11.203 183 HA LEU 23 HA LEU 23 -12.372 15.010 -8.930 184 HB2 LEU 23 1HB LEU 23 -14.883 14.233 -9.308 185 HB3 LEU 23 2HB LEU 23 -14.109 13.152 -10.465 186 HG LEU 23 HG LEU 23 -12.732 12.221 -8.663 187 HD11 LEU 23 1HD1 LEU 23 -14.066 14.369 -7.102 188 HD12 LEU 23 2HD1 LEU 23 -12.403 13.787 -7.035 189 HD13 LEU 23 3HD1 LEU 23 -13.697 12.846 -6.293 190 HD21 LEU 23 3HD2 LEU 23 -14.768 11.333 -7.278 191 HD22 LEU 23 1HD2 LEU 23 -14.588 10.905 -8.979 192 HD23 LEU 23 2HD2 LEU 23 -15.710 12.181 -8.506 193 H GLU 24 H GLU 24 -10.629 13.753 -9.430 194 HA GLU 24 HA GLU 24 -9.932 13.612 -12.276 195 HB2 GLU 24 1HB GLU 24 -8.318 13.668 -9.749 196 HB3 GLU 24 2HB GLU 24 -7.616 13.035 -11.231 197 HG2 GLU 24 1HG GLU 24 -7.827 15.111 -12.333 198 HG3 GLU 24 2HG GLU 24 -8.865 15.759 -11.065 199 H VAL 25 H VAL 25 -10.277 11.740 -13.256 200 HA VAL 25 HA VAL 25 -9.513 9.258 -11.932 201 HB VAL 25 HB VAL 25 -11.824 9.313 -11.349 202 HG11 VAL 25 1HG1 VAL 25 -12.482 9.807 -14.249 203 HG12 VAL 25 2HG1 VAL 25 -13.614 9.719 -12.898 204 HG13 VAL 25 3HG1 VAL 25 -12.466 11.055 -13.002 205 HG21 VAL 25 3HG2 VAL 25 -11.003 7.157 -12.133 206 HG22 VAL 25 1HG2 VAL 25 -12.703 7.368 -12.553 207 HG23 VAL 25 2HG2 VAL 25 -11.459 7.571 -13.786 208 H GLU 26 H GLU 26 -8.916 7.623 -13.335 209 HA GLU 26 HA GLU 26 -8.305 8.479 -16.029 210 HB2 GLU 26 1HB GLU 26 -7.773 5.706 -15.045 211 HB3 GLU 26 2HB GLU 26 -6.815 6.709 -16.125 212 HG2 GLU 26 1HG GLU 26 -6.285 8.161 -14.155 213 HG3 GLU 26 2HG GLU 26 -7.060 6.946 -13.140 214 HA PRO 27 HA PRO 27 -11.572 6.488 -18.176 215 HB2 PRO 27 1HB PRO 27 -10.310 5.603 -20.411 216 HB3 PRO 27 2HB PRO 27 -10.654 7.312 -20.115 217 HG2 PRO 27 1HG PRO 27 -8.106 5.794 -19.708 218 HG3 PRO 27 2HG PRO 27 -8.349 7.407 -20.405 219 HD2 PRO 27 1HD PRO 27 -7.522 7.032 -17.854 220 HD3 PRO 27 2HD PRO 27 -8.530 8.411 -18.339 221 H SER 28 H SER 28 -8.880 4.718 -17.066 222 HA SER 28 HA SER 28 -10.187 2.163 -17.726 223 HB2 SER 28 1HB SER 28 -7.409 2.170 -16.680 224 HB3 SER 28 2HB SER 28 -8.139 1.170 -17.936 225 HG SER 28 HG SER 28 -7.320 3.878 -18.174 226 H ASP 29 H ASP 29 -10.220 4.285 -15.346 227 HA ASP 29 HA ASP 29 -9.654 2.566 -13.093 228 HB2 ASP 29 1HB ASP 29 -10.542 5.398 -13.448 229 HB3 ASP 29 2HB ASP 29 -10.828 4.611 -11.898 230 H THR 30 H THR 30 -11.128 1.628 -11.719 231 HA THR 30 HA THR 30 -13.723 1.070 -12.860 232 HB THR 30 HB THR 30 -13.961 -0.335 -10.715 233 HG1 THR 30 HG1 THR 30 -11.827 -0.824 -9.817 234 HG21 THR 30 3HG2 THR 30 -11.891 -1.811 -11.734 235 HG22 THR 30 1HG2 THR 30 -12.300 -0.760 -13.089 236 HG23 THR 30 2HG2 THR 30 -13.536 -1.793 -12.371 237 H ILE 31 H ILE 31 -15.661 1.059 -11.366 238 HA ILE 31 HA ILE 31 -16.351 3.630 -10.623 239 HB ILE 31 HB ILE 31 -17.492 1.056 -9.529 240 HG12 ILE 31 1HG1 ILE 31 -17.608 1.132 -11.957 241 HG13 ILE 31 2HG1 ILE 31 -19.215 1.379 -11.282 242 HG21 ILE 31 1HG2 ILE 31 -19.471 3.020 -9.649 243 HG22 ILE 31 2HG2 ILE 31 -18.716 2.352 -8.203 244 HG23 ILE 31 3HG2 ILE 31 -18.066 3.816 -8.941 245 HD11 ILE 31 3HD1 ILE 31 -19.058 2.931 -13.005 246 HD12 ILE 31 1HD1 ILE 31 -18.737 3.874 -11.550 247 HD13 ILE 31 2HD1 ILE 31 -17.402 3.369 -12.587 248 H GLU 32 H GLU 32 -15.033 1.023 -8.629 249 HA GLU 32 HA GLU 32 -15.303 2.187 -6.120 250 HB2 GLU 32 1HB GLU 32 -13.359 0.773 -5.463 251 HB3 GLU 32 2HB GLU 32 -14.611 -0.106 -6.329 252 HG2 GLU 32 1HG GLU 32 -13.321 -0.158 -8.318 253 HG3 GLU 32 2HG GLU 32 -12.146 0.979 -7.659 254 H ASN 33 H ASN 33 -12.951 2.779 -8.646 255 HA ASN 33 HA ASN 33 -11.202 4.349 -7.003 256 HB2 ASN 33 1HB ASN 33 -11.402 3.758 -9.936 257 HB3 ASN 33 2HB ASN 33 -10.366 5.070 -9.381 258 HD21 ASN 33 2HD2 ASN 33 -8.521 3.998 -10.087 259 HD22 ASN 33 1HD2 ASN 33 -7.874 2.637 -9.243 260 H VAL 34 H VAL 34 -13.847 5.002 -9.233 261 HA VAL 34 HA VAL 34 -13.531 7.801 -9.379 262 HB VAL 34 HB VAL 34 -16.058 6.170 -9.674 263 HG11 VAL 34 1HG1 VAL 34 -16.872 8.308 -9.461 264 HG12 VAL 34 2HG1 VAL 34 -15.419 9.046 -10.140 265 HG13 VAL 34 3HG1 VAL 34 -16.576 8.237 -11.198 266 HG21 VAL 34 3HG2 VAL 34 -15.439 5.645 -11.766 267 HG22 VAL 34 1HG2 VAL 34 -14.754 7.242 -12.065 268 HG23 VAL 34 2HG2 VAL 34 -13.807 6.022 -11.214 269 H LYS 35 H LYS 35 -15.493 5.748 -7.253 270 HA LYS 35 HA LYS 35 -16.629 7.938 -5.816 271 HB2 LYS 35 1HB LYS 35 -17.423 6.201 -4.249 272 HB3 LYS 35 2HB LYS 35 -17.795 5.813 -5.923 273 HG2 LYS 35 1HG LYS 35 -17.029 3.791 -5.251 274 HG3 LYS 35 2HG LYS 35 -15.494 4.512 -5.742 275 HD2 LYS 35 1HD LYS 35 -14.740 4.683 -3.610 276 HD3 LYS 35 2HD LYS 35 -16.347 5.004 -2.954 277 HE2 LYS 35 1HE LYS 35 -16.085 2.912 -2.127 278 HE3 LYS 35 2HE LYS 35 -16.696 2.466 -3.720 279 HZ1 LYS 35 3HZ LYS 35 -14.164 1.925 -2.560 280 HZ2 LYS 35 1HZ LYS 35 -13.973 2.762 -4.018 281 HZ3 LYS 35 2HZ LYS 35 -14.840 1.310 -3.984 282 H ALA 36 H ALA 36 -13.727 6.050 -5.532 283 HA ALA 36 HA ALA 36 -13.061 6.426 -2.865 284 HB1 ALA 36 1HB ALA 36 -11.677 5.686 -5.299 285 HB2 ALA 36 2HB ALA 36 -10.646 6.615 -4.210 286 HB3 ALA 36 3HB ALA 36 -11.421 5.136 -3.642 287 H LYS 37 H LYS 37 -12.672 8.600 -5.613 288 HA LYS 37 HA LYS 37 -11.193 10.565 -4.143 289 HB2 LYS 37 1HB LYS 37 -12.680 10.863 -6.758 290 HB3 LYS 37 2HB LYS 37 -11.464 11.963 -6.122 291 HG2 LYS 37 1HG LYS 37 -10.967 9.091 -6.879 292 HG3 LYS 37 2HG LYS 37 -10.596 10.490 -7.889 293 HD2 LYS 37 1HD LYS 37 -9.179 11.327 -5.957 294 HD3 LYS 37 2HD LYS 37 -9.372 9.722 -5.249 295 HE2 LYS 37 1HE LYS 37 -8.370 10.091 -8.053 296 HE3 LYS 37 2HE LYS 37 -7.282 10.179 -6.669 297 HZ1 LYS 37 3HZ LYS 37 -7.140 7.982 -6.851 298 HZ2 LYS 37 1HZ LYS 37 -8.450 7.887 -7.917 299 HZ3 LYS 37 2HZ LYS 37 -8.718 7.900 -6.247 300 H ILE 38 H ILE 38 -14.556 9.927 -4.792 301 HA ILE 38 HA ILE 38 -15.611 12.462 -4.167 302 HB ILE 38 HB ILE 38 -16.873 9.734 -3.875 303 HG12 ILE 38 1HG1 ILE 38 -16.173 10.350 -6.174 304 HG13 ILE 38 2HG1 ILE 38 -17.922 10.219 -6.015 305 HG21 ILE 38 1HG2 ILE 38 -19.019 10.961 -3.897 306 HG22 ILE 38 2HG2 ILE 38 -18.040 11.311 -2.474 307 HG23 ILE 38 3HG2 ILE 38 -18.122 12.476 -3.795 308 HD11 ILE 38 3HD1 ILE 38 -18.065 12.663 -5.845 309 HD12 ILE 38 1HD1 ILE 38 -16.320 12.764 -6.073 310 HD13 ILE 38 2HD1 ILE 38 -17.343 12.129 -7.363 311 H GLN 39 H GLN 39 -14.532 9.809 -2.178 312 HA GLN 39 HA GLN 39 -15.806 10.367 0.221 313 HB2 GLN 39 1HB GLN 39 -12.960 9.404 -0.113 314 HB3 GLN 39 2HB GLN 39 -13.970 9.200 1.312 315 HG2 GLN 39 1HG GLN 39 -15.555 8.015 -0.453 316 HG3 GLN 39 2HG GLN 39 -14.016 7.760 -1.274 317 HE21 GLN 39 2HE2 GLN 39 -15.207 5.550 -0.596 318 HE22 GLN 39 1HE2 GLN 39 -14.512 4.822 0.808 319 H ASP 40 H ASP 40 -13.081 11.950 -1.295 320 HA ASP 40 HA ASP 40 -12.374 13.493 1.023 321 HB2 ASP 40 1HB ASP 40 -10.786 12.853 -0.838 322 HB3 ASP 40 2HB ASP 40 -11.603 14.046 -1.844 323 H LYS 41 H LYS 41 -14.627 13.787 -1.563 324 HA LYS 41 HA LYS 41 -14.952 16.648 -1.299 325 HB2 LYS 41 1HB LYS 41 -16.847 14.794 -2.722 326 HB3 LYS 41 2HB LYS 41 -16.529 16.493 -3.046 327 HG2 LYS 41 1HG LYS 41 -14.558 14.261 -3.490 328 HG3 LYS 41 2HG LYS 41 -15.573 14.982 -4.741 329 HD2 LYS 41 1HD LYS 41 -14.389 16.946 -4.760 330 HD3 LYS 41 2HD LYS 41 -13.874 16.777 -3.080 331 HE2 LYS 41 1HE LYS 41 -12.487 14.787 -3.917 332 HE3 LYS 41 2HE LYS 41 -12.775 15.436 -5.531 333 HZ1 LYS 41 3HZ LYS 41 -11.820 17.333 -3.549 334 HZ2 LYS 41 1HZ LYS 41 -11.398 17.162 -5.178 335 HZ3 LYS 41 2HZ LYS 41 -10.713 16.142 -4.016 336 H GLU 42 H GLU 42 -16.914 13.765 -0.580 337 HA GLU 42 HA GLU 42 -18.423 15.399 1.353 338 HB2 GLU 42 1HB GLU 42 -19.394 13.160 -0.422 339 HB3 GLU 42 2HB GLU 42 -20.319 13.780 0.938 340 HG2 GLU 42 1HG GLU 42 -19.408 15.426 -1.410 341 HG3 GLU 42 2HG GLU 42 -21.013 14.720 -1.231 342 H GLY 43 H GLY 43 -16.974 12.280 0.623 343 HA2 GLY 43 1HA GLY 43 -16.073 10.716 2.062 344 HA3 GLY 43 2HA GLY 43 -16.451 11.794 3.398 345 H ILE 44 H ILE 44 -18.156 9.742 1.031 346 HA ILE 44 HA ILE 44 -19.854 8.798 3.247 347 HB ILE 44 HB ILE 44 -21.631 8.443 1.447 348 HG12 ILE 44 1HG1 ILE 44 -19.868 10.437 0.007 349 HG13 ILE 44 2HG1 ILE 44 -20.172 8.779 -0.498 350 HG21 ILE 44 1HG2 ILE 44 -21.011 10.627 3.091 351 HG22 ILE 44 2HG2 ILE 44 -21.527 11.307 1.549 352 HG23 ILE 44 3HG2 ILE 44 -22.583 10.196 2.420 353 HD11 ILE 44 3HD1 ILE 44 -22.490 9.284 -0.897 354 HD12 ILE 44 1HD1 ILE 44 -22.275 10.917 -0.269 355 HD13 ILE 44 2HD1 ILE 44 -21.474 10.434 -1.764 356 HA PRO 45 HA PRO 45 -18.705 4.703 2.146 357 HB2 PRO 45 1HB PRO 45 -20.938 3.342 2.875 358 HB3 PRO 45 2HB PRO 45 -19.802 4.022 4.047 359 HG2 PRO 45 1HG PRO 45 -22.418 5.118 3.087 360 HG3 PRO 45 2HG PRO 45 -21.766 5.061 4.735 361 HD2 PRO 45 1HD PRO 45 -21.690 7.301 3.216 362 HD3 PRO 45 2HD PRO 45 -20.432 6.912 4.407 363 HA PRO 46 HA PRO 46 -20.264 3.533 -1.795 364 HB2 PRO 46 1HB PRO 46 -20.201 0.821 -1.684 365 HB3 PRO 46 2HB PRO 46 -18.741 1.812 -1.791 366 HG2 PRO 46 1HG PRO 46 -19.993 0.536 0.610 367 HG3 PRO 46 2HG PRO 46 -18.282 0.622 0.153 368 HD2 PRO 46 1HD PRO 46 -19.380 2.267 2.002 369 HD3 PRO 46 2HD PRO 46 -18.050 2.775 0.942 370 H ASP 47 H ASP 47 -21.865 2.251 1.029 371 HA ASP 47 HA ASP 47 -24.111 1.152 -0.357 372 HB2 ASP 47 1HB ASP 47 -23.417 1.689 2.499 373 HB3 ASP 47 2HB ASP 47 -25.104 1.400 2.083 374 H GLN 48 H GLN 48 -23.359 4.245 1.132 375 HA GLN 48 HA GLN 48 -26.048 5.243 0.626 376 HB2 GLN 48 1HB GLN 48 -24.246 5.768 2.612 377 HB3 GLN 48 2HB GLN 48 -24.001 7.144 1.545 378 HG2 GLN 48 1HG GLN 48 -26.561 7.378 1.611 379 HG3 GLN 48 2HG GLN 48 -26.469 6.325 3.021 380 HE21 GLN 48 2HE2 GLN 48 -24.197 7.185 4.239 381 HE22 GLN 48 1HE2 GLN 48 -24.387 8.820 4.763 382 H GLN 49 H GLN 49 -22.880 5.332 -0.753 383 HA GLN 49 HA GLN 49 -23.557 7.564 -2.507 384 HB2 GLN 49 1HB GLN 49 -21.277 7.270 -1.388 385 HB3 GLN 49 2HB GLN 49 -21.001 5.970 -2.539 386 HG2 GLN 49 1HG GLN 49 -21.600 7.748 -4.319 387 HG3 GLN 49 2HG GLN 49 -21.263 8.902 -3.031 388 HE21 GLN 49 2HE2 GLN 49 -19.178 7.652 -1.748 389 HE22 GLN 49 1HE2 GLN 49 -17.809 7.594 -2.798 390 H ARG 50 H ARG 50 -23.856 7.395 -4.691 391 HA ARG 50 HA ARG 50 -23.480 4.858 -6.037 392 HB2 ARG 50 1HB ARG 50 -26.152 5.922 -5.283 393 HB3 ARG 50 2HB ARG 50 -25.987 5.234 -6.893 394 HG2 ARG 50 1HG ARG 50 -25.300 3.819 -4.325 395 HG3 ARG 50 2HG ARG 50 -26.792 3.606 -5.243 396 HD2 ARG 50 1HD ARG 50 -25.334 2.961 -7.207 397 HD3 ARG 50 2HD ARG 50 -23.985 2.906 -6.072 398 HE ARG 50 HE ARG 50 -24.811 0.937 -5.225 399 HH11 ARG 50 1HH1 ARG 50 -27.214 2.437 -7.249 400 HH12 ARG 50 2HH1 ARG 50 -28.266 1.060 -7.244 401 HH21 ARG 50 1HH2 ARG 50 -26.187 -0.882 -5.211 402 HH22 ARG 50 2HH2 ARG 50 -27.681 -0.827 -6.084 403 H LEU 51 H LEU 51 -22.944 5.155 -8.116 404 HA LEU 51 HA LEU 51 -23.025 7.881 -9.161 405 HB2 LEU 51 1HB LEU 51 -21.491 5.410 -9.864 406 HB3 LEU 51 2HB LEU 51 -21.611 6.743 -11.011 407 HG LEU 51 HG LEU 51 -19.525 6.877 -9.805 408 HD11 LEU 51 1HD1 LEU 51 -19.587 9.121 -9.380 409 HD12 LEU 51 2HD1 LEU 51 -21.126 9.032 -8.524 410 HD13 LEU 51 3HD1 LEU 51 -21.090 8.936 -10.284 411 HD21 LEU 51 3HD2 LEU 51 -20.548 5.663 -7.766 412 HD22 LEU 51 1HD2 LEU 51 -21.001 7.282 -7.231 413 HD23 LEU 51 2HD2 LEU 51 -19.303 6.883 -7.495 414 H ILE 52 H ILE 52 -24.203 8.500 -10.888 415 HA ILE 52 HA ILE 52 -25.845 6.435 -12.203 416 HB ILE 52 HB ILE 52 -26.612 9.335 -11.915 417 HG12 ILE 52 1HG1 ILE 52 -26.436 8.370 -9.680 418 HG13 ILE 52 2HG1 ILE 52 -28.128 8.605 -10.106 419 HG21 ILE 52 1HG2 ILE 52 -28.841 7.635 -12.139 420 HG22 ILE 52 2HG2 ILE 52 -28.224 8.778 -13.332 421 HG23 ILE 52 3HG2 ILE 52 -27.677 7.102 -13.352 422 HD11 ILE 52 3HD1 ILE 52 -26.639 5.995 -10.248 423 HD12 ILE 52 1HD1 ILE 52 -27.747 6.482 -8.966 424 HD13 ILE 52 2HD1 ILE 52 -28.348 6.244 -10.607 425 H PHE 53 H PHE 53 -26.043 6.465 -14.409 426 HA PHE 53 HA PHE 53 -24.739 8.610 -15.906 427 HB2 PHE 53 1HB PHE 53 -23.042 6.827 -15.548 428 HB3 PHE 53 2HB PHE 53 -24.109 5.687 -16.361 429 HD1 PHE 53 HD2 PHE 53 -22.053 8.712 -16.817 430 HD2 PHE 53 HD1 PHE 53 -24.250 5.602 -18.720 431 HE1 PHE 53 HE2 PHE 53 -21.080 9.355 -18.983 432 HE2 PHE 53 HE1 PHE 53 -23.279 6.240 -20.889 433 HZ PHE 53 HZ PHE 53 -21.693 8.120 -21.023 434 H ALA 54 H ALA 54 -26.271 9.326 -17.225 435 HA ALA 54 HA ALA 54 -28.012 9.401 -18.691 436 HB1 ALA 54 1HB ALA 54 -28.008 7.818 -20.478 437 HB2 ALA 54 2HB ALA 54 -26.331 8.126 -20.029 438 HB3 ALA 54 3HB ALA 54 -27.125 6.640 -19.506 439 H GLY 55 H GLY 55 -28.525 8.370 -16.025 440 HA2 GLY 55 1HA GLY 55 -30.568 7.780 -15.042 441 HA3 GLY 55 2HA GLY 55 -31.100 7.135 -16.588 442 H LYS 56 H LYS 56 -28.244 5.785 -16.461 443 HA LYS 56 HA LYS 56 -29.258 3.377 -15.135 444 HB2 LYS 56 1HB LYS 56 -28.544 3.138 -17.469 445 HB3 LYS 56 2HB LYS 56 -26.945 3.737 -17.050 446 HG2 LYS 56 1HG LYS 56 -26.655 1.441 -17.143 447 HG3 LYS 56 2HG LYS 56 -26.856 1.754 -15.417 448 HD2 LYS 56 1HD LYS 56 -28.267 -0.042 -15.719 449 HD3 LYS 56 2HD LYS 56 -29.382 1.310 -15.930 450 HE2 LYS 56 1HE LYS 56 -29.909 0.000 -17.747 451 HE3 LYS 56 2HE LYS 56 -28.715 1.094 -18.444 452 HZ1 LYS 56 3HZ LYS 56 -27.343 -1.085 -17.377 453 HZ2 LYS 56 1HZ LYS 56 -27.516 -0.662 -19.006 454 HZ3 LYS 56 2HZ LYS 56 -28.630 -1.708 -18.280 455 H GLN 57 H GLN 57 -28.484 2.753 -13.232 456 HA GLN 57 HA GLN 57 -26.532 4.250 -11.839 457 HB2 GLN 57 1HB GLN 57 -27.564 1.485 -11.192 458 HB3 GLN 57 2HB GLN 57 -26.768 2.589 -10.079 459 HG2 GLN 57 1HG GLN 57 -28.900 3.023 -9.492 460 HG3 GLN 57 2HG GLN 57 -28.775 4.162 -10.832 461 HE21 GLN 57 2HE2 GLN 57 -29.918 0.986 -9.882 462 HE22 GLN 57 1HE2 GLN 57 -31.107 0.833 -11.125 463 H LEU 58 H LEU 58 -24.469 3.570 -11.070 464 HA LEU 58 HA LEU 58 -23.148 1.641 -12.862 465 HB2 LEU 58 1HB LEU 58 -21.743 3.831 -11.370 466 HB3 LEU 58 2HB LEU 58 -21.175 2.909 -12.761 467 HG LEU 58 HG LEU 58 -23.397 4.950 -12.836 468 HD11 LEU 58 1HD1 LEU 58 -20.781 5.528 -12.478 469 HD12 LEU 58 2HD1 LEU 58 -21.917 6.560 -13.347 470 HD13 LEU 58 3HD1 LEU 58 -20.866 5.460 -14.239 471 HD21 LEU 58 3HD2 LEU 58 -22.063 4.268 -15.320 472 HD22 LEU 58 1HD2 LEU 58 -23.784 4.323 -14.938 473 HD23 LEU 58 2HD2 LEU 58 -22.847 2.873 -14.578 474 H GLU 59 H GLU 59 -21.572 0.245 -11.994 475 HA GLU 59 HA GLU 59 -21.315 0.138 -9.087 476 HB2 GLU 59 1HB GLU 59 -21.771 -2.337 -9.144 477 HB3 GLU 59 2HB GLU 59 -23.176 -1.313 -9.406 478 HG2 GLU 59 1HG GLU 59 -23.163 -1.756 -11.742 479 HG3 GLU 59 2HG GLU 59 -21.600 -2.563 -11.639 480 H ASP 60 H ASP 60 -19.578 -1.261 -8.367 481 HA ASP 60 HA ASP 60 -17.202 -0.913 -9.731 482 HB2 ASP 60 1HB ASP 60 -16.188 -2.300 -8.117 483 HB3 ASP 60 2HB ASP 60 -17.576 -1.599 -7.289 484 H GLY 61 H GLY 61 -15.715 -2.755 -10.447 485 HA2 GLY 61 1HA GLY 61 -15.395 -4.783 -11.611 486 HA3 GLY 61 2HA GLY 61 -17.134 -4.907 -11.827 487 H ARG 62 H ARG 62 -17.026 -1.955 -12.678 488 HA ARG 62 HA ARG 62 -16.057 -2.446 -15.418 489 HB2 ARG 62 1HB ARG 62 -18.557 -1.054 -14.471 490 HB3 ARG 62 2HB ARG 62 -17.904 -0.806 -16.085 491 HG2 ARG 62 1HG ARG 62 -18.701 -3.479 -14.953 492 HG3 ARG 62 2HG ARG 62 -19.713 -2.482 -16.000 493 HD2 ARG 62 1HD ARG 62 -17.641 -2.544 -17.583 494 HD3 ARG 62 2HD ARG 62 -17.198 -3.965 -16.638 495 HE ARG 62 HE ARG 62 -19.897 -4.071 -17.573 496 HH11 ARG 62 1HH1 ARG 62 -16.578 -4.608 -18.474 497 HH12 ARG 62 2HH1 ARG 62 -16.962 -5.772 -19.699 498 HH21 ARG 62 1HH2 ARG 62 -20.416 -5.601 -19.183 499 HH22 ARG 62 2HH2 ARG 62 -19.146 -6.335 -20.102 500 H THR 63 H THR 63 -15.143 -0.696 -16.532 501 HA THR 63 HA THR 63 -14.077 1.387 -14.772 502 HB THR 63 HB THR 63 -12.379 0.186 -15.983 503 HG1 THR 63 HG1 THR 63 -12.478 2.519 -17.519 504 HG21 THR 63 3HG2 THR 63 -12.667 0.846 -18.658 505 HG22 THR 63 1HG2 THR 63 -14.294 0.381 -18.161 506 HG23 THR 63 2HG2 THR 63 -12.949 -0.739 -17.939 507 H LEU 64 H LEU 64 -13.830 3.586 -15.682 508 HA LEU 64 HA LEU 64 -16.246 4.730 -16.371 509 HB2 LEU 64 1HB LEU 64 -13.438 5.705 -16.843 510 HB3 LEU 64 2HB LEU 64 -14.869 6.697 -17.120 511 HG LEU 64 HG LEU 64 -13.717 5.731 -14.527 512 HD11 LEU 64 1HD1 LEU 64 -12.891 7.837 -15.111 513 HD12 LEU 64 2HD1 LEU 64 -14.214 8.182 -13.998 514 HD13 LEU 64 3HD1 LEU 64 -14.450 8.377 -15.735 515 HD21 LEU 64 3HD2 LEU 64 -16.558 6.295 -15.179 516 HD22 LEU 64 1HD2 LEU 64 -15.920 6.917 -13.656 517 HD23 LEU 64 2HD2 LEU 64 -15.864 5.187 -13.994 518 H SER 65 H SER 65 -13.573 3.786 -18.502 519 HA SER 65 HA SER 65 -14.665 4.739 -20.901 520 HB2 SER 65 1HB SER 65 -12.340 4.104 -20.803 521 HB3 SER 65 2HB SER 65 -12.763 2.445 -20.382 522 HG SER 65 HG SER 65 -12.265 2.644 -22.598 523 H GLU 66 H GLU 66 -15.241 1.809 -19.089 524 HA GLU 66 HA GLU 66 -16.636 0.448 -21.184 525 HB2 GLU 66 1HB GLU 66 -16.252 -0.008 -18.248 526 HB3 GLU 66 2HB GLU 66 -17.473 -0.926 -19.118 527 HG2 GLU 66 1HG GLU 66 -14.631 -0.805 -20.057 528 HG3 GLU 66 2HG GLU 66 -15.163 -1.967 -18.844 529 H TYR 67 H TYR 67 -17.454 2.866 -18.897 530 HA TYR 67 HA TYR 67 -20.325 2.369 -19.222 531 HB2 TYR 67 1HB TYR 67 -18.671 3.843 -17.230 532 HB3 TYR 67 2HB TYR 67 -20.307 4.420 -17.525 533 HD1 TYR 67 HD1 TYR 67 -21.986 2.188 -17.759 534 HD2 TYR 67 HD2 TYR 67 -18.527 2.581 -15.313 535 HE1 TYR 67 HE1 TYR 67 -22.871 0.467 -16.240 536 HE2 TYR 67 HE2 TYR 67 -19.402 0.861 -13.788 537 HH TYR 67 HH TYR 67 -21.532 -1.271 -14.449 538 H ASN 68 H ASN 68 -18.212 3.704 -21.095 539 HA ASN 68 HA ASN 68 -18.193 5.349 -22.665 540 HB2 ASN 68 1HB ASN 68 -20.583 4.364 -22.896 541 HB3 ASN 68 2HB ASN 68 -21.105 5.851 -22.111 542 HD21 ASN 68 2HD2 ASN 68 -21.349 7.623 -23.304 543 HD22 ASN 68 1HD2 ASN 68 -20.880 7.780 -24.960 544 H ILE 69 H ILE 69 -17.583 6.050 -19.946 545 HA ILE 69 HA ILE 69 -18.658 8.761 -19.678 546 HB ILE 69 HB ILE 69 -16.954 7.148 -17.777 547 HG12 ILE 69 1HG1 ILE 69 -19.770 8.019 -17.248 548 HG13 ILE 69 2HG1 ILE 69 -19.483 6.602 -18.252 549 HG21 ILE 69 1HG2 ILE 69 -16.506 9.523 -17.546 550 HG22 ILE 69 2HG2 ILE 69 -18.233 9.855 -17.425 551 HG23 ILE 69 3HG2 ILE 69 -17.422 8.935 -16.158 552 HD11 ILE 69 3HD1 ILE 69 -18.595 7.005 -15.407 553 HD12 ILE 69 1HD1 ILE 69 -19.861 5.921 -15.985 554 HD13 ILE 69 2HD1 ILE 69 -18.176 5.614 -16.407 555 H GLN 70 H GLN 70 -17.565 10.391 -20.531 556 HA GLN 70 HA GLN 70 -14.704 10.069 -21.071 557 HB2 GLN 70 1HB GLN 70 -16.520 12.274 -22.043 558 HB3 GLN 70 2HB GLN 70 -14.922 11.860 -22.649 559 HG2 GLN 70 1HG GLN 70 -15.758 9.770 -23.528 560 HG3 GLN 70 2HG GLN 70 -17.351 10.093 -22.845 561 HE21 GLN 70 2HE2 GLN 70 -17.993 9.745 -25.105 562 HE22 GLN 70 1HE2 GLN 70 -17.957 11.091 -26.186 563 H LYS 71 H LYS 71 -13.847 12.646 -21.182 564 HA LYS 71 HA LYS 71 -13.532 13.272 -18.398 565 HB2 LYS 71 1HB LYS 71 -11.902 14.848 -19.089 566 HB3 LYS 71 2HB LYS 71 -11.735 13.473 -20.173 567 HG2 LYS 71 1HG LYS 71 -13.408 14.907 -21.645 568 HG3 LYS 71 2HG LYS 71 -12.679 16.226 -20.726 569 HD2 LYS 71 1HD LYS 71 -10.942 14.162 -22.017 570 HD3 LYS 71 2HD LYS 71 -11.615 15.478 -22.982 571 HE2 LYS 71 1HE LYS 71 -10.582 17.113 -21.523 572 HE3 LYS 71 2HE LYS 71 -9.985 15.833 -20.468 573 HZ1 LYS 71 3HZ LYS 71 -9.182 16.312 -23.287 574 HZ2 LYS 71 1HZ LYS 71 -8.666 15.002 -22.349 575 HZ3 LYS 71 2HZ LYS 71 -8.234 16.577 -21.910 576 H GLU 72 H GLU 72 -15.692 14.217 -20.850 577 HA GLU 72 HA GLU 72 -16.457 16.630 -19.347 578 HB2 GLU 72 1HB GLU 72 -17.229 15.929 -22.180 579 HB3 GLU 72 2HB GLU 72 -17.477 17.464 -21.360 580 HG2 GLU 72 1HG GLU 72 -14.922 17.537 -21.154 581 HG3 GLU 72 2HG GLU 72 -14.930 16.272 -22.382 582 H SER 73 H SER 73 -17.243 13.487 -19.571 583 HA SER 73 HA SER 73 -20.004 13.399 -19.976 584 HB2 SER 73 1HB SER 73 -17.999 11.664 -18.644 585 HB3 SER 73 2HB SER 73 -19.683 11.405 -18.188 586 HG SER 73 HG SER 73 -20.163 11.118 -20.398 587 H THR 74 H THR 74 -21.761 13.361 -18.529 588 HA THR 74 HA THR 74 -21.316 14.973 -16.115 589 HB THR 74 HB THR 74 -24.073 14.444 -17.100 590 HG1 THR 74 HG1 THR 74 -22.404 16.385 -18.343 591 HG21 THR 74 3HG2 THR 74 -24.016 15.836 -15.232 592 HG22 THR 74 1HG2 THR 74 -24.134 16.977 -16.571 593 HG23 THR 74 2HG2 THR 74 -22.578 16.691 -15.791 594 H LEU 75 H LEU 75 -21.235 13.896 -14.264 595 HA LEU 75 HA LEU 75 -22.673 11.347 -14.030 596 HB2 LEU 75 1HB LEU 75 -20.182 12.437 -12.913 597 HB3 LEU 75 2HB LEU 75 -21.164 11.509 -11.781 598 HG LEU 75 HG LEU 75 -19.375 10.200 -12.920 599 HD11 LEU 75 1HD1 LEU 75 -20.777 8.606 -12.248 600 HD12 LEU 75 2HD1 LEU 75 -21.363 8.569 -13.910 601 HD13 LEU 75 3HD1 LEU 75 -22.197 9.548 -12.703 602 HD21 LEU 75 3HD2 LEU 75 -19.457 9.701 -15.206 603 HD22 LEU 75 1HD2 LEU 75 -19.732 11.441 -15.124 604 HD23 LEU 75 2HD2 LEU 75 -21.090 10.346 -15.380 605 H HIS 76 H HIS 76 -23.865 10.875 -12.106 606 HA HIS 76 HA HIS 76 -24.703 13.230 -10.558 607 HB2 HIS 76 1HB HIS 76 -26.410 11.311 -12.094 608 HB3 HIS 76 2HB HIS 76 -27.038 12.011 -10.605 609 HD1 HIS 76 HD1 HIS 76 -26.631 12.692 -14.154 610 HD2 HIS 76 HD2 HIS 76 -27.128 14.937 -10.694 611 HE1 HIS 76 HE1 HIS 76 -27.344 14.975 -14.931 612 H LEU 77 H LEU 77 -24.558 12.912 -8.440 613 HA LEU 77 HA LEU 77 -24.311 10.157 -7.454 614 HB2 LEU 77 1HB LEU 77 -23.234 11.118 -5.501 615 HB3 LEU 77 2HB LEU 77 -22.428 11.625 -6.984 616 HG LEU 77 HG LEU 77 -24.200 13.678 -6.515 617 HD11 LEU 77 1HD1 LEU 77 -24.476 14.103 -4.320 618 HD12 LEU 77 2HD1 LEU 77 -22.913 13.417 -3.878 619 HD13 LEU 77 3HD1 LEU 77 -24.290 12.355 -4.172 620 HD21 LEU 77 3HD2 LEU 77 -21.493 13.863 -5.319 621 HD22 LEU 77 1HD2 LEU 77 -22.319 14.951 -6.435 622 HD23 LEU 77 2HD2 LEU 77 -21.603 13.454 -7.031 623 H VAL 78 H VAL 78 -26.023 9.299 -6.500 624 HA VAL 78 HA VAL 78 -27.964 11.093 -5.197 625 HB VAL 78 HB VAL 78 -29.549 9.105 -5.472 626 HG11 VAL 78 1HG1 VAL 78 -30.274 9.858 -7.586 627 HG12 VAL 78 2HG1 VAL 78 -29.499 11.250 -6.826 628 HG13 VAL 78 3HG1 VAL 78 -28.644 10.330 -8.064 629 HG21 VAL 78 3HG2 VAL 78 -29.015 7.323 -6.782 630 HG22 VAL 78 1HG2 VAL 78 -27.901 8.254 -7.784 631 HG23 VAL 78 2HG2 VAL 78 -27.399 7.703 -6.185 632 H LEU 79 H LEU 79 -28.241 10.917 -3.071 633 HA LEU 79 HA LEU 79 -26.944 8.689 -1.679 634 HB2 LEU 79 1HB LEU 79 -27.675 11.479 -0.948 635 HB3 LEU 79 2HB LEU 79 -27.585 10.272 0.333 636 HG LEU 79 HG LEU 79 -25.520 11.648 0.030 637 HD11 LEU 79 1HD1 LEU 79 -24.411 9.948 0.934 638 HD12 LEU 79 2HD1 LEU 79 -24.463 9.025 -0.567 639 HD13 LEU 79 3HD1 LEU 79 -25.811 8.940 0.567 640 HD21 LEU 79 3HD2 LEU 79 -24.065 11.185 -1.847 641 HD22 LEU 79 1HD2 LEU 79 -25.617 11.787 -2.428 642 HD23 LEU 79 2HD2 LEU 79 -25.248 10.065 -2.524 643 H ARG 80 H ARG 80 -28.032 7.295 -0.373 644 HA ARG 80 HA ARG 80 -30.917 7.228 -0.665 645 HB2 ARG 80 1HB ARG 80 -28.798 5.316 0.080 646 HB3 ARG 80 2HB ARG 80 -30.328 5.097 0.919 647 HG2 ARG 80 1HG ARG 80 -31.112 5.425 -1.690 648 HG3 ARG 80 2HG ARG 80 -29.606 4.518 -1.838 649 HD2 ARG 80 1HD ARG 80 -30.867 2.711 -1.452 650 HD3 ARG 80 2HD ARG 80 -30.855 3.237 0.231 651 HE ARG 80 HE ARG 80 -32.953 4.580 -0.842 652 HH11 ARG 80 1HH1 ARG 80 -32.023 1.226 -0.753 653 HH12 ARG 80 2HH1 ARG 80 -33.653 0.639 -0.786 654 HH21 ARG 80 1HH2 ARG 80 -35.103 3.819 -0.885 655 HH22 ARG 80 2HH2 ARG 80 -35.404 2.114 -0.862 656 H LEU 81 H LEU 81 -28.583 7.191 2.027 657 HA LEU 81 HA LEU 81 -30.727 7.822 3.902 658 HB2 LEU 81 1HB LEU 81 -27.825 7.115 4.258 659 HB3 LEU 81 2HB LEU 81 -28.857 7.621 5.594 660 HG LEU 81 HG LEU 81 -30.361 5.634 4.809 661 HD11 LEU 81 1HD1 LEU 81 -29.144 5.128 2.775 662 HD12 LEU 81 2HD1 LEU 81 -29.046 3.773 3.898 663 HD13 LEU 81 3HD1 LEU 81 -27.667 4.855 3.701 664 HD21 LEU 81 3HD2 LEU 81 -29.164 5.839 6.967 665 HD22 LEU 81 1HD2 LEU 81 -27.742 5.118 6.212 666 HD23 LEU 81 2HD2 LEU 81 -29.230 4.183 6.364 667 H ARG 82 H ARG 82 -29.743 9.373 5.766 668 HA ARG 82 HA ARG 82 -29.794 11.955 4.686 669 HB2 ARG 82 1HB ARG 82 -30.419 11.362 7.022 670 HB3 ARG 82 2HB ARG 82 -28.715 11.127 7.385 671 HG2 ARG 82 1HG ARG 82 -29.235 13.268 8.178 672 HG3 ARG 82 2HG ARG 82 -28.376 13.531 6.658 673 HD2 ARG 82 1HD ARG 82 -30.270 15.001 6.730 674 HD3 ARG 82 2HD ARG 82 -30.572 13.753 5.521 675 HE ARG 82 HE ARG 82 -31.646 13.058 8.071 676 HH11 ARG 82 1HH1 ARG 82 -32.213 14.967 5.215 677 HH12 ARG 82 2HH1 ARG 82 -33.936 14.970 5.401 678 HH21 ARG 82 1HH2 ARG 82 -33.912 13.055 8.326 679 HH22 ARG 82 2HH2 ARG 82 -34.901 13.883 7.171 680 H GLY 83 H GLY 83 -27.048 10.502 6.449 681 HA2 GLY 83 1HA GLY 83 -25.118 11.013 4.473 682 HA3 GLY 83 2HA GLY 83 -25.163 12.389 5.567 683 H TYR 84 H TYR 84 -25.666 11.083 7.977 684 HA TYR 84 HA TYR 84 -23.117 10.414 8.833 685 HB2 TYR 84 1HB TYR 84 -24.908 11.078 10.365 686 HB3 TYR 84 2HB TYR 84 -25.764 9.576 10.036 687 HD1 TYR 84 HD1 TYR 84 -22.617 10.935 11.469 688 HD2 TYR 84 HD2 TYR 84 -25.304 7.641 11.281 689 HE1 TYR 84 HE1 TYR 84 -21.405 9.848 13.313 690 HE2 TYR 84 HE2 TYR 84 -24.100 6.546 13.125 691 HH TYR 84 HH TYR 84 -21.495 6.782 14.017 692 H ALA 85 H ALA 85 -22.150 8.434 9.445 693 HA ALA 85 HA ALA 85 -23.358 5.944 8.592 694 HB1 ALA 85 1HB ALA 85 -21.404 7.336 6.954 695 HB2 ALA 85 2HB ALA 85 -20.888 5.704 7.385 696 HB3 ALA 85 3HB ALA 85 -22.430 5.954 6.565 697 H ASP 86 H ASP 86 -22.150 4.069 9.285 698 HA ASP 86 HA ASP 86 -20.218 4.674 11.427 699 HB2 ASP 86 1HB ASP 86 -22.649 3.753 11.964 700 HB3 ASP 86 2HB ASP 86 -21.897 2.211 11.562 701 H LEU 87 H LEU 87 -19.108 2.440 12.072 702 HA LEU 87 HA LEU 87 -18.392 0.957 9.650 703 HB2 LEU 87 1HB LEU 87 -16.263 1.887 11.542 704 HB3 LEU 87 2HB LEU 87 -16.089 1.262 9.903 705 HG LEU 87 HG LEU 87 -17.345 3.927 10.534 706 HD11 LEU 87 1HD1 LEU 87 -14.973 4.557 9.437 707 HD12 LEU 87 2HD1 LEU 87 -14.516 3.123 10.354 708 HD13 LEU 87 3HD1 LEU 87 -15.261 4.494 11.176 709 HD21 LEU 87 3HD2 LEU 87 -17.145 2.344 8.183 710 HD22 LEU 87 1HD2 LEU 87 -16.123 3.767 7.981 711 HD23 LEU 87 2HD2 LEU 87 -17.833 3.958 8.372 712 H ARG 88 H ARG 88 -16.859 -0.918 10.280 713 HA ARG 88 HA ARG 88 -16.916 -1.932 12.919 714 HB2 ARG 88 1HB ARG 88 -19.319 -2.211 12.346 715 HB3 ARG 88 2HB ARG 88 -18.850 -3.242 11.001 716 HG2 ARG 88 1HG ARG 88 -17.858 -4.835 12.563 717 HG3 ARG 88 2HG ARG 88 -18.327 -3.800 13.913 718 HD2 ARG 88 1HD ARG 88 -19.899 -5.657 13.583 719 HD3 ARG 88 2HD ARG 88 -20.669 -4.087 13.354 720 HE ARG 88 HE ARG 88 -19.742 -5.145 10.887 721 HH11 ARG 88 1HH1 ARG 88 -22.281 -5.445 13.251 722 HH12 ARG 88 2HH1 ARG 88 -23.446 -6.041 12.116 723 HH21 ARG 88 1HH2 ARG 88 -21.267 -5.929 9.383 724 HH22 ARG 88 2HH2 ARG 88 -22.868 -6.317 9.916 725 H GLU 89 H GLU 89 -15.681 -3.799 13.145 726 HA GLU 89 HA GLU 89 -14.244 -4.602 10.709 727 HB2 GLU 89 1HB GLU 89 -12.407 -5.247 12.141 728 HB3 GLU 89 2HB GLU 89 -12.891 -3.602 12.530 729 HG2 GLU 89 1HG GLU 89 -14.225 -4.537 14.428 730 HG3 GLU 89 2HG GLU 89 -13.486 -6.101 14.090 731 H ASP 90 H ASP 90 -13.537 -6.868 10.583 732 HA ASP 90 HA ASP 90 -15.305 -8.736 12.000 733 HB2 ASP 90 1HB ASP 90 -15.064 -8.315 9.062 734 HB3 ASP 90 2HB ASP 90 -15.233 -9.972 9.635 735 HA PRO 91 HA PRO 91 -11.776 -11.281 12.544 736 HB2 PRO 91 1HB PRO 91 -12.803 -13.779 12.266 737 HB3 PRO 91 2HB PRO 91 -13.130 -12.757 13.671 738 HG2 PRO 91 1HG PRO 91 -14.824 -13.252 11.253 739 HG3 PRO 91 2HG PRO 91 -15.304 -13.174 12.959 740 HD2 PRO 91 1HD PRO 91 -15.661 -11.105 11.249 741 HD3 PRO 91 2HD PRO 91 -15.328 -10.870 12.977 742 H ASP 92 H ASP 92 -10.258 -11.125 10.987 743 HA ASP 92 HA ASP 92 -10.678 -11.861 8.273 744 HB2 ASP 92 1HB ASP 92 -8.971 -10.188 9.237 745 HB3 ASP 92 2HB ASP 92 -7.972 -11.601 9.566 746 H ARG 93 H ARG 93 -9.234 -13.468 11.054 747 HA ARG 93 HA ARG 93 -8.980 -15.911 9.424 748 HB2 ARG 93 1HB ARG 93 -7.240 -16.578 11.174 749 HB3 ARG 93 2HB ARG 93 -6.779 -15.332 10.021 750 HG2 ARG 93 1HG ARG 93 -7.956 -14.471 12.606 751 HG3 ARG 93 2HG ARG 93 -6.303 -15.089 12.602 752 HD2 ARG 93 1HD ARG 93 -5.998 -13.447 10.598 753 HD3 ARG 93 2HD ARG 93 -7.429 -12.664 11.269 754 HE ARG 93 HE ARG 93 -5.675 -13.005 13.374 755 HH11 ARG 93 1HH1 ARG 93 -5.701 -11.340 10.316 756 HH12 ARG 93 2HH1 ARG 93 -4.641 -10.077 10.847 757 HH21 ARG 93 1HH2 ARG 93 -4.279 -11.347 14.085 758 HH22 ARG 93 2HH2 ARG 93 -3.832 -10.082 12.991 759 H GLN 94 H GLN 94 -10.797 -17.021 9.874 760 HA GLN 94 HA GLN 94 -11.828 -17.125 12.589 761 HB2 GLN 94 1HB GLN 94 -12.863 -18.471 10.088 762 HB3 GLN 94 2HB GLN 94 -13.707 -18.340 11.625 763 HG2 GLN 94 1HG GLN 94 -14.082 -16.057 11.365 764 HG3 GLN 94 2HG GLN 94 -12.839 -15.901 10.125 765 HE21 GLN 94 2HE2 GLN 94 -16.055 -15.900 10.611 766 HE22 GLN 94 1HE2 GLN 94 -16.600 -16.404 9.051 767 H ASP 95 H ASP 95 -12.798 -19.531 13.006 768 HA ASP 95 HA ASP 95 -10.821 -21.573 12.413 769 HB2 ASP 95 1HB ASP 95 -10.163 -20.207 14.539 770 HB3 ASP 95 2HB ASP 95 -11.459 -21.119 15.309 771 H HIS 96 H HIS 96 -12.042 -23.200 11.737 772 HA HIS 96 HA HIS 96 -14.360 -23.984 13.361 773 HB2 HIS 96 1HB HIS 96 -15.554 -24.564 11.218 774 HB3 HIS 96 2HB HIS 96 -15.346 -22.839 11.509 775 HD1 HIS 96 HD1 HIS 96 -14.582 -25.504 9.099 776 HD2 HIS 96 HD2 HIS 96 -13.320 -21.619 9.859 777 HE1 HIS 96 HE1 HIS 96 -13.365 -24.774 7.023 778 H HIS 97 H HIS 97 -14.401 -26.086 13.849 779 HA HIS 97 HA HIS 97 -13.156 -28.044 12.104 780 HB2 HIS 97 1HB HIS 97 -11.423 -27.094 13.785 781 HB3 HIS 97 2HB HIS 97 -12.305 -28.031 14.987 782 HD1 HIS 97 HD1 HIS 97 -10.290 -29.598 15.369 783 HD2 HIS 97 HD2 HIS 97 -11.725 -29.603 11.470 784 HE1 HIS 97 HE1 HIS 97 -9.208 -31.577 14.257 785 HA PRO 98 HA PRO 98 -17.027 -29.403 14.318 786 HB2 PRO 98 1HB PRO 98 -18.336 -30.184 12.071 787 HB3 PRO 98 2HB PRO 98 -18.392 -28.529 12.689 788 HG2 PRO 98 1HG PRO 98 -16.716 -29.674 10.488 789 HG3 PRO 98 2HG PRO 98 -17.593 -28.133 10.541 790 HD2 PRO 98 1HD PRO 98 -14.926 -28.307 10.974 791 HD3 PRO 98 2HD PRO 98 -15.946 -27.094 11.774 792 H GLY 99 H GLY 99 -15.339 -30.885 11.557 793 HA2 GLY 99 1HA GLY 99 -16.149 -33.526 11.965 794 HA3 GLY 99 2HA GLY 99 -14.653 -33.042 11.182 795 H SER 100 H SER 100 -15.523 -35.154 13.263 796 HA SER 100 HA SER 100 -13.152 -34.801 14.944 797 HB2 SER 100 1HB SER 100 -14.587 -35.750 16.879 798 HB3 SER 100 2HB SER 100 -14.766 -34.043 16.472 799 HG SER 100 HG SER 100 -16.781 -34.444 16.094 800 H GLY 101 H GLY 101 -11.921 -36.528 14.639 801 HA2 GLY 101 1HA GLY 101 -12.950 -38.957 13.522 802 HA3 GLY 101 2HA GLY 101 -11.295 -38.665 14.034 803 H ALA 102 H ALA 102 -13.263 -40.931 14.445 804 HA ALA 102 HA ALA 102 -12.425 -41.656 17.038 805 HB1 ALA 102 1HB ALA 102 -15.128 -40.425 16.793 806 HB2 ALA 102 2HB ALA 102 -14.891 -41.760 17.922 807 HB3 ALA 102 3HB ALA 102 -13.937 -40.286 18.087 808 H GLN 103 H GLN 103 -13.991 -43.577 17.836 809 HA GLN 103 HA GLN 103 -13.879 -45.504 15.708 810 HB2 GLN 103 1HB GLN 103 -14.558 -47.120 17.415 811 HB3 GLN 103 2HB GLN 103 -13.233 -46.116 17.988 812 HG2 GLN 103 1HG GLN 103 -14.930 -44.706 19.168 813 HG3 GLN 103 2HG GLN 103 -16.137 -45.915 18.734 814 HE21 GLN 103 2HE2 GLN 103 -16.508 -47.415 20.191 815 HE22 GLN 103 1HE2 GLN 103 -15.420 -47.924 21.433 Start of MODEL 15 1 H1 GLY 1 H GLY 1 3.285 14.194 -0.804 2 HA2 GLY 1 1HA GLY 1 2.716 12.689 -3.137 3 HA3 GLY 1 2HA GLY 1 3.766 14.095 -3.048 4 H SER 2 H SER 2 3.688 10.622 -2.307 5 HA SER 2 HA SER 2 6.593 10.497 -2.486 6 HB2 SER 2 1HB SER 2 4.487 8.472 -1.725 7 HB3 SER 2 2HB SER 2 6.188 8.048 -1.913 8 HG SER 2 HG SER 2 5.674 8.563 0.254 9 H LEU 3 H LEU 3 3.741 9.182 -4.126 10 HA LEU 3 HA LEU 3 5.452 8.601 -6.450 11 HB2 LEU 3 1HB LEU 3 4.665 6.574 -5.109 12 HB3 LEU 3 2HB LEU 3 3.053 6.949 -5.716 13 HG LEU 3 HG LEU 3 4.051 6.749 -8.048 14 HD11 LEU 3 1HD1 LEU 3 6.299 5.601 -6.412 15 HD12 LEU 3 2HD1 LEU 3 6.373 6.895 -7.607 16 HD13 LEU 3 3HD1 LEU 3 6.061 5.238 -8.121 17 HD21 LEU 3 3HD2 LEU 3 4.294 4.085 -7.500 18 HD22 LEU 3 1HD2 LEU 3 2.770 4.934 -7.761 19 HD23 LEU 3 2HD2 LEU 3 3.357 4.660 -6.120 20 H VAL 4 H VAL 4 4.617 9.088 -8.448 21 HA VAL 4 HA VAL 4 1.968 10.382 -8.480 22 HB VAL 4 HB VAL 4 4.395 11.203 -10.082 23 HG11 VAL 4 1HG1 VAL 4 2.242 11.507 -11.256 24 HG12 VAL 4 2HG1 VAL 4 1.675 12.496 -9.909 25 HG13 VAL 4 3HG1 VAL 4 3.041 13.035 -10.887 26 HG21 VAL 4 3HG2 VAL 4 3.414 11.982 -7.458 27 HG22 VAL 4 1HG2 VAL 4 4.965 12.311 -8.231 28 HG23 VAL 4 2HG2 VAL 4 3.579 13.353 -8.555 29 HA PRO 5 HA PRO 5 1.019 7.398 -11.604 30 HB2 PRO 5 1HB PRO 5 -1.283 8.536 -12.485 31 HB3 PRO 5 2HB PRO 5 -1.170 7.657 -10.955 32 HG2 PRO 5 1HG PRO 5 -1.105 10.608 -11.453 33 HG3 PRO 5 2HG PRO 5 -1.959 9.705 -10.188 34 HD2 PRO 5 1HD PRO 5 0.381 10.989 -9.734 35 HD3 PRO 5 2HD PRO 5 -0.069 9.496 -8.886 36 H ARG 6 H ARG 6 0.289 7.456 -13.974 37 HA ARG 6 HA ARG 6 1.949 9.432 -15.360 38 HB2 ARG 6 1HB ARG 6 0.783 6.811 -16.316 39 HB3 ARG 6 2HB ARG 6 1.785 7.880 -17.289 40 HG2 ARG 6 1HG ARG 6 3.633 7.569 -15.706 41 HG3 ARG 6 2HG ARG 6 2.625 6.467 -14.766 42 HD2 ARG 6 1HD ARG 6 3.390 6.073 -17.656 43 HD3 ARG 6 2HD ARG 6 4.191 5.302 -16.287 44 HE ARG 6 HE ARG 6 1.356 4.841 -16.374 45 HH11 ARG 6 1HH1 ARG 6 4.467 3.761 -17.505 46 HH12 ARG 6 2HH1 ARG 6 3.940 2.138 -17.805 47 HH21 ARG 6 1HH2 ARG 6 0.650 2.707 -16.764 48 HH22 ARG 6 2HH2 ARG 6 1.769 1.540 -17.384 49 H GLY 7 H GLY 7 -1.006 7.676 -16.306 50 HA2 GLY 7 1HA GLY 7 -1.921 9.952 -17.824 51 HA3 GLY 7 2HA GLY 7 -2.745 8.409 -17.653 52 H SER 8 H SER 8 -4.434 10.348 -17.609 53 HA SER 8 HA SER 8 -5.677 10.258 -15.108 54 HB2 SER 8 1HB SER 8 -5.448 12.737 -14.535 55 HB3 SER 8 2HB SER 8 -4.040 11.726 -14.210 56 HG SER 8 HG SER 8 -2.947 12.806 -15.647 57 H MET 9 H MET 9 -7.633 11.599 -15.011 58 HA MET 9 HA MET 9 -8.440 12.956 -17.436 59 HB2 MET 9 1HB MET 9 -9.135 10.913 -18.253 60 HB3 MET 9 2HB MET 9 -9.481 10.271 -16.653 61 HG2 MET 9 1HG MET 9 -11.550 11.302 -16.542 62 HG3 MET 9 2HG MET 9 -11.136 12.485 -17.781 63 HE1 MET 9 3HE MET 9 -11.610 8.141 -18.040 64 HE2 MET 9 1HE MET 9 -12.096 9.190 -16.708 65 HE3 MET 9 2HE MET 9 -13.275 8.714 -17.930 66 H GLN 10 H GLN 10 -9.893 14.530 -17.030 67 HA GLN 10 HA GLN 10 -10.920 14.711 -14.285 68 HB2 GLN 10 1HB GLN 10 -10.109 16.715 -16.334 69 HB3 GLN 10 2HB GLN 10 -11.387 17.163 -15.212 70 HG2 GLN 10 1HG GLN 10 -9.983 17.004 -13.360 71 HG3 GLN 10 2HG GLN 10 -8.785 16.053 -14.236 72 HE21 GLN 10 2HE2 GLN 10 -7.057 17.093 -14.912 73 HE22 GLN 10 1HE2 GLN 10 -6.922 18.799 -15.149 74 H ILE 11 H ILE 11 -13.034 14.587 -13.879 75 HA ILE 11 HA ILE 11 -14.905 14.841 -16.141 76 HB ILE 11 HB ILE 11 -16.270 13.070 -15.263 77 HG12 ILE 11 1HG1 ILE 11 -14.233 12.871 -13.033 78 HG13 ILE 11 2HG1 ILE 11 -15.886 13.456 -12.874 79 HG21 ILE 11 1HG2 ILE 11 -14.815 11.166 -15.607 80 HG22 ILE 11 2HG2 ILE 11 -14.390 12.457 -16.730 81 HG23 ILE 11 3HG2 ILE 11 -13.394 12.165 -15.304 82 HD11 ILE 11 3HD1 ILE 11 -16.037 11.298 -12.095 83 HD12 ILE 11 1HD1 ILE 11 -16.532 11.120 -13.778 84 HD13 ILE 11 2HD1 ILE 11 -14.897 10.674 -13.287 85 H PHE 12 H PHE 12 -17.172 15.276 -15.431 86 HA PHE 12 HA PHE 12 -17.161 17.090 -13.111 87 HB2 PHE 12 1HB PHE 12 -18.807 17.172 -15.645 88 HB3 PHE 12 2HB PHE 12 -19.073 18.231 -14.264 89 HD1 PHE 12 HD2 PHE 12 -16.860 19.475 -13.447 90 HD2 PHE 12 HD1 PHE 12 -17.546 17.983 -17.374 91 HE1 PHE 12 HE2 PHE 12 -15.192 21.051 -14.334 92 HE2 PHE 12 HE1 PHE 12 -15.878 19.556 -18.267 93 HZ PHE 12 HZ PHE 12 -14.699 21.094 -16.746 94 H VAL 13 H VAL 13 -18.573 16.771 -11.495 95 HA VAL 13 HA VAL 13 -20.713 14.786 -11.892 96 HB VAL 13 HB VAL 13 -19.114 15.069 -9.349 97 HG11 VAL 13 1HG1 VAL 13 -21.578 13.801 -9.981 98 HG12 VAL 13 2HG1 VAL 13 -20.382 12.550 -9.634 99 HG13 VAL 13 3HG1 VAL 13 -20.707 13.816 -8.448 100 HG21 VAL 13 3HG2 VAL 13 -17.485 14.027 -10.494 101 HG22 VAL 13 1HG2 VAL 13 -18.506 12.600 -10.315 102 HG23 VAL 13 2HG2 VAL 13 -18.570 13.550 -11.800 103 H LYS 14 H LYS 14 -22.665 15.236 -10.978 104 HA LYS 14 HA LYS 14 -22.967 17.919 -9.844 105 HB2 LYS 14 1HB LYS 14 -24.741 16.054 -11.335 106 HB3 LYS 14 2HB LYS 14 -25.501 17.140 -10.179 107 HG2 LYS 14 1HG LYS 14 -25.607 18.306 -12.179 108 HG3 LYS 14 2HG LYS 14 -24.197 19.000 -11.375 109 HD2 LYS 14 1HD LYS 14 -22.701 17.766 -12.740 110 HD3 LYS 14 2HD LYS 14 -24.001 16.746 -13.361 111 HE2 LYS 14 1HE LYS 14 -23.217 18.497 -14.955 112 HE3 LYS 14 2HE LYS 14 -24.939 18.570 -14.587 113 HZ1 LYS 14 3HZ LYS 14 -23.517 20.721 -14.566 114 HZ2 LYS 14 1HZ LYS 14 -23.062 20.201 -13.021 115 HZ3 LYS 14 2HZ LYS 14 -24.692 20.483 -13.373 116 H THR 15 H THR 15 -23.330 18.214 -7.749 117 HA THR 15 HA THR 15 -23.710 15.916 -6.024 118 HB THR 15 HB THR 15 -23.425 17.500 -4.167 119 HG1 THR 15 HG1 THR 15 -23.100 19.489 -6.183 120 HG21 THR 15 3HG2 THR 15 -21.496 16.589 -5.777 121 HG22 THR 15 1HG2 THR 15 -21.164 17.637 -4.399 122 HG23 THR 15 2HG2 THR 15 -21.262 18.320 -6.022 123 H LEU 16 H LEU 16 -25.191 16.606 -3.983 124 HA LEU 16 HA LEU 16 -27.857 16.573 -5.007 125 HB2 LEU 16 1HB LEU 16 -26.654 16.558 -2.265 126 HB3 LEU 16 2HB LEU 16 -28.392 16.747 -2.483 127 HG LEU 16 HG LEU 16 -28.068 14.541 -3.926 128 HD11 LEU 16 1HD1 LEU 16 -26.106 13.894 -1.807 129 HD12 LEU 16 2HD1 LEU 16 -25.519 14.800 -3.201 130 HD13 LEU 16 3HD1 LEU 16 -26.288 13.229 -3.430 131 HD21 LEU 16 3HD2 LEU 16 -29.498 13.961 -2.328 132 HD22 LEU 16 1HD2 LEU 16 -28.828 15.158 -1.220 133 HD23 LEU 16 2HD2 LEU 16 -28.116 13.547 -1.313 134 H THR 17 H THR 17 -25.713 19.029 -3.936 135 HA THR 17 HA THR 17 -27.874 20.949 -3.507 136 HB THR 17 HB THR 17 -25.964 20.916 -1.920 137 HG1 THR 17 HG1 THR 17 -26.142 23.316 -3.452 138 HG21 THR 17 3HG2 THR 17 -24.164 20.343 -3.438 139 HG22 THR 17 1HG2 THR 17 -23.812 21.888 -2.664 140 HG23 THR 17 2HG2 THR 17 -24.396 21.847 -4.328 141 H GLY 18 H GLY 18 -27.263 19.824 -6.170 142 HA2 GLY 18 1HA GLY 18 -27.014 20.528 -8.344 143 HA3 GLY 18 2HA GLY 18 -27.649 22.057 -7.754 144 H LYS 19 H LYS 19 -24.611 20.581 -6.759 145 HA LYS 19 HA LYS 19 -23.200 22.852 -7.998 146 HB2 LYS 19 1HB LYS 19 -23.097 22.934 -5.570 147 HB3 LYS 19 2HB LYS 19 -22.509 21.277 -5.511 148 HG2 LYS 19 1HG LYS 19 -20.937 23.236 -7.086 149 HG3 LYS 19 2HG LYS 19 -20.889 23.362 -5.326 150 HD2 LYS 19 1HD LYS 19 -20.497 20.744 -5.532 151 HD3 LYS 19 2HD LYS 19 -19.871 21.217 -7.113 152 HE2 LYS 19 1HE LYS 19 -17.959 21.418 -5.895 153 HE3 LYS 19 2HE LYS 19 -18.614 23.036 -5.649 154 HZ1 LYS 19 3HZ LYS 19 -19.711 21.989 -3.594 155 HZ2 LYS 19 1HZ LYS 19 -18.061 22.355 -3.527 156 HZ3 LYS 19 2HZ LYS 19 -18.563 20.760 -3.777 157 H THR 20 H THR 20 -21.713 22.421 -9.493 158 HA THR 20 HA THR 20 -21.129 19.649 -10.135 159 HB THR 20 HB THR 20 -19.890 21.902 -11.649 160 HG1 THR 20 HG1 THR 20 -21.780 22.477 -12.573 161 HG21 THR 20 3HG2 THR 20 -20.371 20.440 -13.550 162 HG22 THR 20 1HG2 THR 20 -21.216 19.318 -12.484 163 HG23 THR 20 2HG2 THR 20 -19.480 19.572 -12.300 164 H ILE 21 H ILE 21 -19.352 18.617 -9.513 165 HA ILE 21 HA ILE 21 -17.018 20.217 -8.686 166 HB ILE 21 HB ILE 21 -17.957 19.229 -6.714 167 HG12 ILE 21 1HG1 ILE 21 -15.380 18.965 -7.409 168 HG13 ILE 21 2HG1 ILE 21 -16.009 18.393 -5.868 169 HG21 ILE 21 1HG2 ILE 21 -17.955 16.663 -8.287 170 HG22 ILE 21 2HG2 ILE 21 -18.179 16.734 -6.540 171 HG23 ILE 21 3HG2 ILE 21 -19.341 17.517 -7.611 172 HD11 ILE 21 3HD1 ILE 21 -14.503 16.842 -7.249 173 HD12 ILE 21 1HD1 ILE 21 -15.972 16.177 -6.536 174 HD13 ILE 21 2HD1 ILE 21 -15.933 16.592 -8.250 175 H THR 22 H THR 22 -15.093 19.711 -9.555 176 HA THR 22 HA THR 22 -15.032 17.707 -11.650 177 HB THR 22 HB THR 22 -12.716 19.438 -10.798 178 HG1 THR 22 HG1 THR 22 -13.602 21.106 -11.806 179 HG21 THR 22 3HG2 THR 22 -13.265 17.582 -12.961 180 HG22 THR 22 1HG2 THR 22 -11.736 18.296 -12.452 181 HG23 THR 22 2HG2 THR 22 -12.793 19.172 -13.560 182 H LEU 23 H LEU 23 -14.084 15.764 -11.535 183 HA LEU 23 HA LEU 23 -12.441 15.168 -9.162 184 HB2 LEU 23 1HB LEU 23 -14.842 14.127 -9.498 185 HB3 LEU 23 2HB LEU 23 -13.963 13.021 -10.552 186 HG LEU 23 HG LEU 23 -12.513 12.415 -8.639 187 HD11 LEU 23 1HD1 LEU 23 -13.693 13.066 -6.369 188 HD12 LEU 23 2HD1 LEU 23 -14.189 14.474 -7.307 189 HD13 LEU 23 3HD1 LEU 23 -12.476 14.105 -7.111 190 HD21 LEU 23 3HD2 LEU 23 -14.386 11.266 -7.322 191 HD22 LEU 23 1HD2 LEU 23 -14.247 10.901 -9.042 192 HD23 LEU 23 2HD2 LEU 23 -15.484 12.024 -8.476 193 H GLU 24 H GLU 24 -10.831 13.489 -9.443 194 HA GLU 24 HA GLU 24 -9.844 13.375 -12.216 195 HB2 GLU 24 1HB GLU 24 -8.468 13.661 -9.587 196 HB3 GLU 24 2HB GLU 24 -7.635 12.785 -10.863 197 HG2 GLU 24 1HG GLU 24 -7.507 14.653 -12.236 198 HG3 GLU 24 2HG GLU 24 -8.790 15.496 -11.370 199 H VAL 25 H VAL 25 -10.009 11.462 -13.158 200 HA VAL 25 HA VAL 25 -9.515 9.039 -11.590 201 HB VAL 25 HB VAL 25 -11.714 8.821 -13.557 202 HG11 VAL 25 1HG1 VAL 25 -10.589 7.257 -11.547 203 HG12 VAL 25 2HG1 VAL 25 -12.165 7.740 -10.919 204 HG13 VAL 25 3HG1 VAL 25 -12.050 6.909 -12.470 205 HG21 VAL 25 3HG2 VAL 25 -13.345 9.531 -11.729 206 HG22 VAL 25 1HG2 VAL 25 -11.971 10.345 -10.981 207 HG23 VAL 25 2HG2 VAL 25 -12.503 10.816 -12.595 208 H GLU 26 H GLU 26 -9.492 7.075 -13.153 209 HA GLU 26 HA GLU 26 -7.961 7.877 -15.536 210 HB2 GLU 26 1HB GLU 26 -7.821 5.168 -14.236 211 HB3 GLU 26 2HB GLU 26 -6.664 5.919 -15.326 212 HG2 GLU 26 1HG GLU 26 -6.049 7.517 -13.600 213 HG3 GLU 26 2HG GLU 26 -7.234 6.804 -12.506 214 HA PRO 27 HA PRO 27 -10.897 5.999 -18.203 215 HB2 PRO 27 1HB PRO 27 -9.290 5.090 -20.194 216 HB3 PRO 27 2HB PRO 27 -9.643 6.805 -19.952 217 HG2 PRO 27 1HG PRO 27 -7.235 5.233 -19.122 218 HG3 PRO 27 2HG PRO 27 -7.321 6.851 -19.842 219 HD2 PRO 27 1HD PRO 27 -6.952 6.454 -17.189 220 HD3 PRO 27 2HD PRO 27 -7.833 7.855 -17.831 221 H SER 28 H SER 28 -8.424 4.159 -16.714 222 HA SER 28 HA SER 28 -9.628 1.633 -17.616 223 HB2 SER 28 1HB SER 28 -7.440 0.832 -16.248 224 HB3 SER 28 2HB SER 28 -7.412 1.233 -17.965 225 HG SER 28 HG SER 28 -6.165 2.454 -15.913 226 H ASP 29 H ASP 29 -9.485 3.765 -14.994 227 HA ASP 29 HA ASP 29 -9.725 1.929 -12.844 228 HB2 ASP 29 1HB ASP 29 -10.373 4.853 -13.155 229 HB3 ASP 29 2HB ASP 29 -10.721 3.986 -11.661 230 H THR 30 H THR 30 -11.697 1.815 -11.442 231 HA THR 30 HA THR 30 -14.080 1.470 -13.138 232 HB THR 30 HB THR 30 -14.856 -0.199 -11.543 233 HG1 THR 30 HG1 THR 30 -12.465 0.475 -10.151 234 HG21 THR 30 3HG2 THR 30 -13.503 -1.913 -12.261 235 HG22 THR 30 1HG2 THR 30 -12.019 -0.999 -11.995 236 HG23 THR 30 2HG2 THR 30 -13.033 -0.645 -13.394 237 H ILE 31 H ILE 31 -16.174 1.554 -11.777 238 HA ILE 31 HA ILE 31 -16.626 4.147 -10.939 239 HB ILE 31 HB ILE 31 -18.150 1.715 -10.001 240 HG12 ILE 31 1HG1 ILE 31 -17.997 1.712 -12.426 241 HG13 ILE 31 2HG1 ILE 31 -19.626 2.173 -11.944 242 HG21 ILE 31 1HG2 ILE 31 -18.436 4.488 -9.439 243 HG22 ILE 31 2HG2 ILE 31 -19.800 3.976 -10.431 244 HG23 ILE 31 3HG2 ILE 31 -19.452 3.145 -8.915 245 HD11 ILE 31 3HD1 ILE 31 -17.498 3.784 -13.237 246 HD12 ILE 31 1HD1 ILE 31 -19.227 3.708 -13.574 247 HD13 ILE 31 2HD1 ILE 31 -18.640 4.599 -12.169 248 H GLU 32 H GLU 32 -15.393 1.436 -9.137 249 HA GLU 32 HA GLU 32 -15.859 2.419 -6.532 250 HB2 GLU 32 1HB GLU 32 -13.564 0.648 -7.370 251 HB3 GLU 32 2HB GLU 32 -14.315 0.750 -5.784 252 HG2 GLU 32 1HG GLU 32 -16.383 -0.179 -6.714 253 HG3 GLU 32 2HG GLU 32 -15.605 -0.307 -8.290 254 H ASN 33 H ASN 33 -13.045 2.658 -8.685 255 HA ASN 33 HA ASN 33 -11.330 4.016 -6.963 256 HB2 ASN 33 1HB ASN 33 -11.526 3.582 -9.865 257 HB3 ASN 33 2HB ASN 33 -10.674 5.055 -9.412 258 HD21 ASN 33 2HD2 ASN 33 -8.644 4.921 -8.682 259 HD22 ASN 33 1HD2 ASN 33 -7.795 3.443 -8.398 260 H VAL 34 H VAL 34 -13.840 5.251 -9.119 261 HA VAL 34 HA VAL 34 -13.302 7.981 -8.893 262 HB VAL 34 HB VAL 34 -16.044 6.742 -9.149 263 HG11 VAL 34 1HG1 VAL 34 -16.741 8.778 -10.093 264 HG12 VAL 34 2HG1 VAL 34 -15.794 9.233 -8.675 265 HG13 VAL 34 3HG1 VAL 34 -15.085 9.352 -10.286 266 HG21 VAL 34 3HG2 VAL 34 -15.417 5.916 -11.113 267 HG22 VAL 34 1HG2 VAL 34 -15.047 7.551 -11.660 268 HG23 VAL 34 2HG2 VAL 34 -13.793 6.570 -10.902 269 H LYS 35 H LYS 35 -15.507 5.954 -6.968 270 HA LYS 35 HA LYS 35 -16.472 7.917 -5.256 271 HB2 LYS 35 1HB LYS 35 -16.135 4.959 -5.065 272 HB3 LYS 35 2HB LYS 35 -16.542 5.844 -3.601 273 HG2 LYS 35 1HG LYS 35 -18.652 5.503 -4.265 274 HG3 LYS 35 2HG LYS 35 -18.348 6.876 -5.333 275 HD2 LYS 35 1HD LYS 35 -18.302 5.587 -7.189 276 HD3 LYS 35 2HD LYS 35 -17.505 4.245 -6.364 277 HE2 LYS 35 1HE LYS 35 -19.667 3.482 -6.954 278 HE3 LYS 35 2HE LYS 35 -19.705 3.795 -5.220 279 HZ1 LYS 35 3HZ LYS 35 -21.593 4.860 -5.819 280 HZ2 LYS 35 1HZ LYS 35 -21.063 5.191 -7.391 281 HZ3 LYS 35 2HZ LYS 35 -20.521 6.137 -6.098 282 H ALA 36 H ALA 36 -13.396 6.299 -5.298 283 HA ALA 36 HA ALA 36 -12.524 6.685 -2.690 284 HB1 ALA 36 1HB ALA 36 -11.417 5.641 -4.923 285 HB2 ALA 36 2HB ALA 36 -10.498 7.140 -4.774 286 HB3 ALA 36 3HB ALA 36 -10.522 5.984 -3.442 287 H LYS 37 H LYS 37 -12.326 8.890 -5.466 288 HA LYS 37 HA LYS 37 -11.047 10.967 -3.961 289 HB2 LYS 37 1HB LYS 37 -12.350 10.925 -6.684 290 HB3 LYS 37 2HB LYS 37 -11.584 12.355 -6.005 291 HG2 LYS 37 1HG LYS 37 -9.871 11.523 -7.258 292 HG3 LYS 37 2HG LYS 37 -9.541 10.735 -5.714 293 HD2 LYS 37 1HD LYS 37 -10.605 8.707 -6.469 294 HD3 LYS 37 2HD LYS 37 -11.115 9.490 -7.967 295 HE2 LYS 37 1HE LYS 37 -8.571 9.922 -8.291 296 HE3 LYS 37 2HE LYS 37 -8.381 8.627 -7.109 297 HZ1 LYS 37 3HZ LYS 37 -10.249 7.832 -9.054 298 HZ2 LYS 37 1HZ LYS 37 -8.743 7.149 -8.696 299 HZ3 LYS 37 2HZ LYS 37 -8.858 8.388 -9.841 300 H ILE 38 H ILE 38 -14.329 10.081 -4.726 301 HA ILE 38 HA ILE 38 -15.610 12.518 -4.201 302 HB ILE 38 HB ILE 38 -16.651 9.717 -3.763 303 HG12 ILE 38 1HG1 ILE 38 -15.916 10.192 -6.079 304 HG13 ILE 38 2HG1 ILE 38 -17.657 9.958 -5.969 305 HG21 ILE 38 1HG2 ILE 38 -18.882 10.929 -4.136 306 HG22 ILE 38 2HG2 ILE 38 -18.104 11.089 -2.562 307 HG23 ILE 38 3HG2 ILE 38 -17.991 12.398 -3.739 308 HD11 ILE 38 3HD1 ILE 38 -16.198 12.575 -6.219 309 HD12 ILE 38 1HD1 ILE 38 -17.190 11.785 -7.444 310 HD13 ILE 38 2HD1 ILE 38 -17.937 12.413 -5.975 311 H GLN 39 H GLN 39 -14.352 10.055 -2.073 312 HA GLN 39 HA GLN 39 -15.710 10.619 0.278 313 HB2 GLN 39 1HB GLN 39 -12.914 9.646 -0.253 314 HB3 GLN 39 2HB GLN 39 -13.503 9.879 1.387 315 HG2 GLN 39 1HG GLN 39 -15.253 8.268 1.043 316 HG3 GLN 39 2HG GLN 39 -14.817 8.107 -0.658 317 HE21 GLN 39 2HE2 GLN 39 -13.735 6.336 -1.085 318 HE22 GLN 39 1HE2 GLN 39 -12.628 5.531 -0.032 319 H ASP 40 H ASP 40 -13.060 12.325 -1.252 320 HA ASP 40 HA ASP 40 -12.552 14.037 1.000 321 HB2 ASP 40 1HB ASP 40 -10.845 13.422 -0.752 322 HB3 ASP 40 2HB ASP 40 -11.712 14.472 -1.870 323 H LYS 41 H LYS 41 -14.730 14.020 -1.662 324 HA LYS 41 HA LYS 41 -15.269 16.863 -1.555 325 HB2 LYS 41 1HB LYS 41 -16.898 14.778 -2.998 326 HB3 LYS 41 2HB LYS 41 -16.784 16.498 -3.349 327 HG2 LYS 41 1HG LYS 41 -14.499 14.560 -3.635 328 HG3 LYS 41 2HG LYS 41 -15.569 15.046 -4.952 329 HD2 LYS 41 1HD LYS 41 -13.946 16.594 -5.285 330 HD3 LYS 41 2HD LYS 41 -14.859 17.467 -4.052 331 HE2 LYS 41 1HE LYS 41 -13.007 15.663 -2.808 332 HE3 LYS 41 2HE LYS 41 -12.160 16.680 -3.973 333 HZ1 LYS 41 3HZ LYS 41 -12.856 17.381 -1.430 334 HZ2 LYS 41 1HZ LYS 41 -14.013 18.166 -2.383 335 HZ3 LYS 41 2HZ LYS 41 -12.366 18.441 -2.655 336 H GLU 42 H GLU 42 -17.024 13.863 -0.791 337 HA GLU 42 HA GLU 42 -18.776 15.454 0.966 338 HB2 GLU 42 1HB GLU 42 -19.533 12.888 -0.436 339 HB3 GLU 42 2HB GLU 42 -20.589 13.937 0.499 340 HG2 GLU 42 1HG GLU 42 -20.375 15.685 -1.157 341 HG3 GLU 42 2HG GLU 42 -19.234 14.705 -2.076 342 H GLY 43 H GLY 43 -17.009 12.448 0.508 343 HA2 GLY 43 1HA GLY 43 -16.062 11.048 2.077 344 HA3 GLY 43 2HA GLY 43 -16.570 12.181 3.321 345 H ILE 44 H ILE 44 -18.202 10.027 0.990 346 HA ILE 44 HA ILE 44 -19.752 8.943 3.250 347 HB ILE 44 HB ILE 44 -21.606 8.578 1.538 348 HG12 ILE 44 1HG1 ILE 44 -20.009 10.681 0.059 349 HG13 ILE 44 2HG1 ILE 44 -20.245 9.018 -0.466 350 HG21 ILE 44 1HG2 ILE 44 -21.317 10.442 3.362 351 HG22 ILE 44 2HG2 ILE 44 -21.184 11.497 1.956 352 HG23 ILE 44 3HG2 ILE 44 -22.634 10.522 2.192 353 HD11 ILE 44 3HD1 ILE 44 -21.724 10.422 -1.696 354 HD12 ILE 44 1HD1 ILE 44 -22.685 9.467 -0.568 355 HD13 ILE 44 2HD1 ILE 44 -22.337 11.160 -0.217 356 HA PRO 45 HA PRO 45 -18.491 4.941 1.949 357 HB2 PRO 45 1HB PRO 45 -20.623 3.461 2.748 358 HB3 PRO 45 2HB PRO 45 -19.454 4.152 3.880 359 HG2 PRO 45 1HG PRO 45 -22.161 5.164 3.099 360 HG3 PRO 45 2HG PRO 45 -21.419 5.082 4.708 361 HD2 PRO 45 1HD PRO 45 -21.518 7.371 3.265 362 HD3 PRO 45 2HD PRO 45 -20.183 6.998 4.374 363 HA PRO 46 HA PRO 46 -20.212 3.832 -1.942 364 HB2 PRO 46 1HB PRO 46 -20.030 1.124 -1.929 365 HB3 PRO 46 2HB PRO 46 -18.621 2.181 -2.078 366 HG2 PRO 46 1HG PRO 46 -19.686 0.774 0.340 367 HG3 PRO 46 2HG PRO 46 -18.007 0.949 -0.204 368 HD2 PRO 46 1HD PRO 46 -19.071 2.484 1.756 369 HD3 PRO 46 2HD PRO 46 -17.822 3.084 0.646 370 H ASP 47 H ASP 47 -21.601 2.390 0.916 371 HA ASP 47 HA ASP 47 -23.910 1.332 -0.447 372 HB2 ASP 47 1HB ASP 47 -24.742 0.990 1.934 373 HB3 ASP 47 2HB ASP 47 -23.262 0.140 1.497 374 H GLN 48 H GLN 48 -22.958 4.368 0.726 375 HA GLN 48 HA GLN 48 -25.743 5.295 0.888 376 HB2 GLN 48 1HB GLN 48 -23.176 6.441 1.976 377 HB3 GLN 48 2HB GLN 48 -24.674 7.360 1.923 378 HG2 GLN 48 1HG GLN 48 -25.750 5.836 3.404 379 HG3 GLN 48 2HG GLN 48 -24.394 4.713 3.318 380 HE21 GLN 48 2HE2 GLN 48 -24.008 4.723 5.505 381 HE22 GLN 48 1HE2 GLN 48 -23.361 6.090 6.339 382 H GLN 49 H GLN 49 -22.794 5.556 -0.896 383 HA GLN 49 HA GLN 49 -23.868 7.797 -2.459 384 HB2 GLN 49 1HB GLN 49 -21.686 8.298 -3.139 385 HB3 GLN 49 2HB GLN 49 -21.500 7.823 -1.456 386 HG2 GLN 49 1HG GLN 49 -21.124 5.445 -2.612 387 HG3 GLN 49 2HG GLN 49 -20.573 6.490 -3.921 388 HE21 GLN 49 2HE2 GLN 49 -19.413 8.543 -2.562 389 HE22 GLN 49 1HE2 GLN 49 -18.041 7.970 -1.682 390 H ARG 50 H ARG 50 -24.332 7.612 -4.598 391 HA ARG 50 HA ARG 50 -23.639 5.162 -6.016 392 HB2 ARG 50 1HB ARG 50 -26.417 5.997 -5.290 393 HB3 ARG 50 2HB ARG 50 -26.143 5.192 -6.829 394 HG2 ARG 50 1HG ARG 50 -25.266 4.061 -4.185 395 HG3 ARG 50 2HG ARG 50 -26.816 3.695 -4.945 396 HD2 ARG 50 1HD ARG 50 -24.330 3.353 -6.545 397 HD3 ARG 50 2HD ARG 50 -24.700 2.156 -5.304 398 HE ARG 50 HE ARG 50 -26.889 2.728 -7.088 399 HH11 ARG 50 1HH1 ARG 50 -24.060 0.777 -6.528 400 HH12 ARG 50 2HH1 ARG 50 -24.589 -0.516 -7.553 401 HH21 ARG 50 1HH2 ARG 50 -27.595 1.033 -8.441 402 HH22 ARG 50 2HH2 ARG 50 -26.599 -0.368 -8.642 403 H LEU 51 H LEU 51 -23.092 5.577 -8.062 404 HA LEU 51 HA LEU 51 -23.537 8.272 -9.091 405 HB2 LEU 51 1HB LEU 51 -21.569 6.132 -9.536 406 HB3 LEU 51 2HB LEU 51 -22.020 7.047 -10.972 407 HG LEU 51 HG LEU 51 -21.232 9.086 -10.007 408 HD11 LEU 51 1HD1 LEU 51 -21.890 8.963 -7.756 409 HD12 LEU 51 2HD1 LEU 51 -20.127 8.992 -7.720 410 HD13 LEU 51 3HD1 LEU 51 -20.989 7.471 -7.486 411 HD21 LEU 51 3HD2 LEU 51 -18.953 8.680 -10.046 412 HD22 LEU 51 1HD2 LEU 51 -19.603 7.287 -10.911 413 HD23 LEU 51 2HD2 LEU 51 -19.110 7.127 -9.225 414 H ILE 52 H ILE 52 -24.649 8.732 -10.942 415 HA ILE 52 HA ILE 52 -26.045 6.478 -12.234 416 HB ILE 52 HB ILE 52 -27.186 9.255 -12.022 417 HG12 ILE 52 1HG1 ILE 52 -26.888 8.459 -9.746 418 HG13 ILE 52 2HG1 ILE 52 -28.595 8.387 -10.172 419 HG21 ILE 52 1HG2 ILE 52 -28.827 8.445 -13.277 420 HG22 ILE 52 2HG2 ILE 52 -27.909 6.950 -13.453 421 HG23 ILE 52 3HG2 ILE 52 -29.084 7.114 -12.148 422 HD11 ILE 52 3HD1 ILE 52 -26.933 6.327 -9.190 423 HD12 ILE 52 1HD1 ILE 52 -28.642 6.252 -9.618 424 HD13 ILE 52 2HD1 ILE 52 -27.411 5.896 -10.831 425 H PHE 53 H PHE 53 -25.901 6.333 -14.388 426 HA PHE 53 HA PHE 53 -24.902 8.661 -15.885 427 HB2 PHE 53 1HB PHE 53 -23.094 6.976 -15.475 428 HB3 PHE 53 2HB PHE 53 -24.047 5.803 -16.378 429 HD1 PHE 53 HD2 PHE 53 -22.112 8.919 -16.611 430 HD2 PHE 53 HD1 PHE 53 -24.151 5.860 -18.756 431 HE1 PHE 53 HE2 PHE 53 -21.094 9.714 -18.705 432 HE2 PHE 53 HE1 PHE 53 -23.136 6.649 -20.854 433 HZ PHE 53 HZ PHE 53 -21.606 8.579 -20.830 434 H ALA 54 H ALA 54 -26.369 9.252 -17.326 435 HA ALA 54 HA ALA 54 -28.065 9.200 -18.844 436 HB1 ALA 54 1HB ALA 54 -27.138 6.424 -19.531 437 HB2 ALA 54 2HB ALA 54 -27.912 7.611 -20.582 438 HB3 ALA 54 3HB ALA 54 -26.260 7.873 -20.022 439 H GLY 55 H GLY 55 -28.607 8.244 -16.143 440 HA2 GLY 55 1HA GLY 55 -30.648 7.622 -15.182 441 HA3 GLY 55 2HA GLY 55 -31.135 6.926 -16.720 442 H LYS 56 H LYS 56 -28.250 5.651 -16.509 443 HA LYS 56 HA LYS 56 -29.229 3.252 -15.139 444 HB2 LYS 56 1HB LYS 56 -28.464 2.993 -17.463 445 HB3 LYS 56 2HB LYS 56 -26.879 3.608 -17.011 446 HG2 LYS 56 1HG LYS 56 -26.830 1.199 -17.190 447 HG3 LYS 56 2HG LYS 56 -26.571 1.691 -15.515 448 HD2 LYS 56 1HD LYS 56 -28.791 1.094 -14.909 449 HD3 LYS 56 2HD LYS 56 -29.266 0.893 -16.597 450 HE2 LYS 56 1HE LYS 56 -27.602 -0.971 -16.750 451 HE3 LYS 56 2HE LYS 56 -27.368 -0.827 -15.008 452 HZ1 LYS 56 3HZ LYS 56 -29.436 -2.149 -16.431 453 HZ2 LYS 56 1HZ LYS 56 -30.091 -0.992 -15.385 454 HZ3 LYS 56 2HZ LYS 56 -29.074 -2.201 -14.780 455 H GLN 57 H GLN 57 -28.472 2.698 -13.208 456 HA GLN 57 HA GLN 57 -26.609 4.275 -11.801 457 HB2 GLN 57 1HB GLN 57 -27.364 1.443 -11.095 458 HB3 GLN 57 2HB GLN 57 -26.867 2.732 -10.007 459 HG2 GLN 57 1HG GLN 57 -28.976 3.950 -10.787 460 HG3 GLN 57 2HG GLN 57 -29.475 2.388 -11.436 461 HE21 GLN 57 2HE2 GLN 57 -31.081 1.824 -10.107 462 HE22 GLN 57 1HE2 GLN 57 -30.938 1.658 -8.394 463 H LEU 58 H LEU 58 -24.469 4.007 -11.337 464 HA LEU 58 HA LEU 58 -23.006 2.185 -13.078 465 HB2 LEU 58 1HB LEU 58 -21.937 4.306 -11.225 466 HB3 LEU 58 2HB LEU 58 -21.047 3.461 -12.489 467 HG LEU 58 HG LEU 58 -23.238 5.500 -12.849 468 HD11 LEU 58 1HD1 LEU 58 -20.446 5.617 -13.926 469 HD12 LEU 58 2HD1 LEU 58 -20.813 6.157 -12.288 470 HD13 LEU 58 3HD1 LEU 58 -21.598 6.928 -13.666 471 HD21 LEU 58 3HD2 LEU 58 -22.135 4.980 -15.323 472 HD22 LEU 58 1HD2 LEU 58 -23.716 4.445 -14.754 473 HD23 LEU 58 2HD2 LEU 58 -22.320 3.378 -14.609 474 H GLU 59 H GLU 59 -21.860 0.460 -12.401 475 HA GLU 59 HA GLU 59 -21.628 0.015 -9.501 476 HB2 GLU 59 1HB GLU 59 -22.686 -1.813 -11.622 477 HB3 GLU 59 2HB GLU 59 -21.865 -2.498 -10.226 478 HG2 GLU 59 1HG GLU 59 -23.469 -1.639 -8.732 479 HG3 GLU 59 2HG GLU 59 -24.159 -0.582 -9.962 480 H ASP 60 H ASP 60 -20.104 -2.021 -9.185 481 HA ASP 60 HA ASP 60 -17.566 -1.235 -10.271 482 HB2 ASP 60 1HB ASP 60 -17.966 -3.757 -8.701 483 HB3 ASP 60 2HB ASP 60 -16.604 -2.640 -8.685 484 H GLY 61 H GLY 61 -16.049 -3.197 -10.898 485 HA2 GLY 61 1HA GLY 61 -15.780 -5.184 -12.169 486 HA3 GLY 61 2HA GLY 61 -17.457 -5.053 -12.678 487 H ARG 62 H ARG 62 -17.658 -2.576 -13.710 488 HA ARG 62 HA ARG 62 -16.003 -2.799 -16.099 489 HB2 ARG 62 1HB ARG 62 -18.585 -1.472 -15.419 490 HB3 ARG 62 2HB ARG 62 -17.631 -0.796 -16.733 491 HG2 ARG 62 1HG ARG 62 -17.583 -3.153 -17.694 492 HG3 ARG 62 2HG ARG 62 -18.854 -3.526 -16.528 493 HD2 ARG 62 1HD ARG 62 -20.234 -1.734 -17.464 494 HD3 ARG 62 2HD ARG 62 -18.962 -1.363 -18.628 495 HE ARG 62 HE ARG 62 -19.769 -4.089 -18.783 496 HH11 ARG 62 1HH1 ARG 62 -20.672 -0.855 -19.702 497 HH12 ARG 62 2HH1 ARG 62 -21.582 -1.362 -21.086 498 HH21 ARG 62 1HH2 ARG 62 -20.964 -4.770 -20.602 499 HH22 ARG 62 2HH2 ARG 62 -21.749 -3.589 -21.597 500 H THR 63 H THR 63 -15.298 -0.681 -17.117 501 HA THR 63 HA THR 63 -14.045 0.982 -15.037 502 HB THR 63 HB THR 63 -12.325 -0.026 -16.300 503 HG1 THR 63 HG1 THR 63 -11.650 1.906 -17.683 504 HG21 THR 63 3HG2 THR 63 -12.973 -0.938 -18.250 505 HG22 THR 63 1HG2 THR 63 -12.545 0.624 -18.947 506 HG23 THR 63 2HG2 THR 63 -14.220 0.280 -18.515 507 H LEU 64 H LEU 64 -13.714 3.269 -15.560 508 HA LEU 64 HA LEU 64 -16.060 4.597 -16.187 509 HB2 LEU 64 1HB LEU 64 -13.192 5.477 -16.190 510 HB3 LEU 64 2HB LEU 64 -14.498 6.592 -16.587 511 HG LEU 64 HG LEU 64 -13.911 6.931 -14.303 512 HD11 LEU 64 1HD1 LEU 64 -16.411 5.251 -14.323 513 HD12 LEU 64 2HD1 LEU 64 -16.328 6.915 -14.901 514 HD13 LEU 64 3HD1 LEU 64 -16.001 6.554 -13.206 515 HD21 LEU 64 3HD2 LEU 64 -14.436 4.014 -13.772 516 HD22 LEU 64 1HD2 LEU 64 -13.787 5.220 -12.660 517 HD23 LEU 64 2HD2 LEU 64 -12.824 4.681 -14.036 518 H SER 65 H SER 65 -13.486 3.510 -18.283 519 HA SER 65 HA SER 65 -14.253 5.034 -20.563 520 HB2 SER 65 1HB SER 65 -11.997 4.173 -20.416 521 HB3 SER 65 2HB SER 65 -12.593 2.517 -20.307 522 HG SER 65 HG SER 65 -12.800 2.469 -22.398 523 H GLU 66 H GLU 66 -15.055 1.827 -19.353 524 HA GLU 66 HA GLU 66 -16.506 1.039 -21.691 525 HB2 GLU 66 1HB GLU 66 -16.259 -0.069 -18.907 526 HB3 GLU 66 2HB GLU 66 -17.408 -0.743 -20.053 527 HG2 GLU 66 1HG GLU 66 -14.538 -0.440 -20.814 528 HG3 GLU 66 2HG GLU 66 -15.058 -1.797 -19.816 529 H TYR 67 H TYR 67 -17.208 2.947 -18.935 530 HA TYR 67 HA TYR 67 -20.090 2.616 -19.194 531 HB2 TYR 67 1HB TYR 67 -18.271 3.921 -17.222 532 HB3 TYR 67 2HB TYR 67 -19.921 4.519 -17.349 533 HD1 TYR 67 HD1 TYR 67 -21.696 2.434 -17.505 534 HD2 TYR 67 HD2 TYR 67 -17.922 2.394 -15.541 535 HE1 TYR 67 HE1 TYR 67 -22.475 0.604 -16.059 536 HE2 TYR 67 HE2 TYR 67 -18.690 0.562 -14.090 537 HH TYR 67 HH TYR 67 -20.994 -1.384 -14.648 538 H ASN 68 H ASN 68 -18.078 4.058 -21.102 539 HA ASN 68 HA ASN 68 -18.134 5.816 -22.543 540 HB2 ASN 68 1HB ASN 68 -20.996 6.268 -21.716 541 HB3 ASN 68 2HB ASN 68 -20.249 6.575 -23.282 542 HD21 ASN 68 2HD2 ASN 68 -18.982 4.306 -23.879 543 HD22 ASN 68 1HD2 ASN 68 -20.090 2.985 -23.988 544 H ILE 69 H ILE 69 -17.668 6.201 -19.576 545 HA ILE 69 HA ILE 69 -18.532 8.935 -19.129 546 HB ILE 69 HB ILE 69 -16.770 7.149 -17.446 547 HG12 ILE 69 1HG1 ILE 69 -19.590 7.972 -16.810 548 HG13 ILE 69 2HG1 ILE 69 -19.275 6.580 -17.839 549 HG21 ILE 69 1HG2 ILE 69 -16.199 9.317 -16.815 550 HG22 ILE 69 2HG2 ILE 69 -17.843 9.915 -17.029 551 HG23 ILE 69 3HG2 ILE 69 -17.457 8.869 -15.663 552 HD11 ILE 69 3HD1 ILE 69 -17.796 5.739 -15.938 553 HD12 ILE 69 1HD1 ILE 69 -18.589 6.969 -14.953 554 HD13 ILE 69 2HD1 ILE 69 -19.544 5.691 -15.706 555 H GLN 70 H GLN 70 -17.477 10.293 -20.498 556 HA GLN 70 HA GLN 70 -14.595 10.082 -20.825 557 HB2 GLN 70 1HB GLN 70 -16.456 12.149 -21.998 558 HB3 GLN 70 2HB GLN 70 -14.821 11.770 -22.523 559 HG2 GLN 70 1HG GLN 70 -15.769 9.406 -22.964 560 HG3 GLN 70 2HG GLN 70 -17.337 10.211 -22.912 561 HE21 GLN 70 2HE2 GLN 70 -15.506 8.956 -25.051 562 HE22 GLN 70 1HE2 GLN 70 -15.555 10.112 -26.334 563 H LYS 71 H LYS 71 -13.787 12.658 -21.098 564 HA LYS 71 HA LYS 71 -13.531 13.485 -18.368 565 HB2 LYS 71 1HB LYS 71 -12.072 15.235 -19.246 566 HB3 LYS 71 2HB LYS 71 -11.663 13.675 -19.948 567 HG2 LYS 71 1HG LYS 71 -12.730 14.245 -22.008 568 HG3 LYS 71 2HG LYS 71 -13.387 15.728 -21.314 569 HD2 LYS 71 1HD LYS 71 -11.493 16.323 -22.643 570 HD3 LYS 71 2HD LYS 71 -11.034 16.499 -20.948 571 HE2 LYS 71 1HE LYS 71 -9.229 15.426 -22.078 572 HE3 LYS 71 2HE LYS 71 -10.022 14.216 -21.071 573 HZ1 LYS 71 3HZ LYS 71 -11.054 13.261 -22.943 574 HZ2 LYS 71 1HZ LYS 71 -9.442 13.507 -23.394 575 HZ3 LYS 71 2HZ LYS 71 -10.644 14.560 -23.947 576 H GLU 72 H GLU 72 -15.889 14.000 -20.650 577 HA GLU 72 HA GLU 72 -16.676 16.558 -19.416 578 HB2 GLU 72 1HB GLU 72 -17.509 15.554 -22.140 579 HB3 GLU 72 2HB GLU 72 -17.816 17.144 -21.455 580 HG2 GLU 72 1HG GLU 72 -15.291 17.423 -21.374 581 HG3 GLU 72 2HG GLU 72 -15.216 15.999 -22.411 582 H SER 73 H SER 73 -17.354 13.322 -19.531 583 HA SER 73 HA SER 73 -20.098 13.089 -19.742 584 HB2 SER 73 1HB SER 73 -19.240 11.002 -19.488 585 HB3 SER 73 2HB SER 73 -17.949 11.554 -18.421 586 HG SER 73 HG SER 73 -19.354 11.507 -16.709 587 H THR 74 H THR 74 -21.751 12.881 -18.101 588 HA THR 74 HA THR 74 -21.310 14.734 -15.852 589 HB THR 74 HB THR 74 -24.072 14.097 -16.771 590 HG1 THR 74 HG1 THR 74 -23.859 15.787 -18.361 591 HG21 THR 74 3HG2 THR 74 -22.626 16.350 -15.452 592 HG22 THR 74 1HG2 THR 74 -24.129 15.554 -14.988 593 HG23 THR 74 2HG2 THR 74 -24.113 16.690 -16.336 594 H LEU 75 H LEU 75 -21.272 13.827 -13.912 595 HA LEU 75 HA LEU 75 -22.549 11.210 -13.542 596 HB2 LEU 75 1HB LEU 75 -20.169 12.536 -12.440 597 HB3 LEU 75 2HB LEU 75 -21.124 11.629 -11.268 598 HG LEU 75 HG LEU 75 -19.319 10.264 -12.126 599 HD11 LEU 75 1HD1 LEU 75 -21.870 9.478 -11.855 600 HD12 LEU 75 2HD1 LEU 75 -20.556 8.383 -12.281 601 HD13 LEU 75 3HD1 LEU 75 -21.599 9.040 -13.542 602 HD21 LEU 75 3HD2 LEU 75 -20.555 10.615 -14.853 603 HD22 LEU 75 1HD2 LEU 75 -19.116 9.680 -14.449 604 HD23 LEU 75 2HD2 LEU 75 -19.095 11.437 -14.301 605 H HIS 76 H HIS 76 -23.769 10.788 -11.625 606 HA HIS 76 HA HIS 76 -24.783 13.168 -10.234 607 HB2 HIS 76 1HB HIS 76 -26.388 11.057 -11.655 608 HB3 HIS 76 2HB HIS 76 -27.077 11.980 -10.322 609 HD1 HIS 76 HD1 HIS 76 -27.282 14.602 -10.712 610 HD2 HIS 76 HD2 HIS 76 -26.336 12.353 -14.075 611 HE1 HIS 76 HE1 HIS 76 -27.729 16.108 -12.675 612 H LEU 77 H LEU 77 -24.626 12.937 -8.110 613 HA LEU 77 HA LEU 77 -24.253 10.261 -6.994 614 HB2 LEU 77 1HB LEU 77 -24.047 12.762 -5.382 615 HB3 LEU 77 2HB LEU 77 -23.176 11.240 -5.206 616 HG LEU 77 HG LEU 77 -22.691 13.222 -7.427 617 HD11 LEU 77 1HD1 LEU 77 -20.468 13.322 -5.918 618 HD12 LEU 77 2HD1 LEU 77 -21.682 13.080 -4.662 619 HD13 LEU 77 3HD1 LEU 77 -21.811 14.455 -5.759 620 HD21 LEU 77 3HD2 LEU 77 -21.978 11.099 -8.138 621 HD22 LEU 77 1HD2 LEU 77 -21.345 10.685 -6.544 622 HD23 LEU 77 2HD2 LEU 77 -20.523 11.893 -7.533 623 H VAL 78 H VAL 78 -25.976 9.237 -6.243 624 HA VAL 78 HA VAL 78 -28.171 10.825 -5.083 625 HB VAL 78 HB VAL 78 -29.538 8.703 -5.506 626 HG11 VAL 78 1HG1 VAL 78 -28.532 10.584 -7.598 627 HG12 VAL 78 2HG1 VAL 78 -29.649 9.291 -8.041 628 HG13 VAL 78 3HG1 VAL 78 -30.122 10.493 -6.841 629 HG21 VAL 78 3HG2 VAL 78 -27.827 7.985 -7.760 630 HG22 VAL 78 1HG2 VAL 78 -27.103 7.646 -6.187 631 HG23 VAL 78 2HG2 VAL 78 -28.672 6.955 -6.604 632 H LEU 79 H LEU 79 -28.608 10.580 -2.989 633 HA LEU 79 HA LEU 79 -27.117 8.608 -1.462 634 HB2 LEU 79 1HB LEU 79 -28.585 11.109 -0.870 635 HB3 LEU 79 2HB LEU 79 -28.533 9.896 0.408 636 HG LEU 79 HG LEU 79 -26.127 9.988 0.465 637 HD11 LEU 79 1HD1 LEU 79 -25.202 12.018 -1.012 638 HD12 LEU 79 2HD1 LEU 79 -26.496 11.457 -2.070 639 HD13 LEU 79 3HD1 LEU 79 -25.220 10.346 -1.573 640 HD21 LEU 79 3HD2 LEU 79 -27.731 11.878 1.440 641 HD22 LEU 79 1HD2 LEU 79 -26.762 12.878 0.358 642 HD23 LEU 79 2HD2 LEU 79 -25.977 11.934 1.624 643 H ARG 80 H ARG 80 -27.978 6.916 -0.354 644 HA ARG 80 HA ARG 80 -30.806 6.322 -0.891 645 HB2 ARG 80 1HB ARG 80 -28.379 4.622 -0.487 646 HB3 ARG 80 2HB ARG 80 -29.959 3.963 -0.086 647 HG2 ARG 80 1HG ARG 80 -30.589 4.788 -2.481 648 HG3 ARG 80 2HG ARG 80 -28.844 4.735 -2.737 649 HD2 ARG 80 1HD ARG 80 -28.856 2.382 -1.942 650 HD3 ARG 80 2HD ARG 80 -30.615 2.462 -1.852 651 HE ARG 80 HE ARG 80 -29.042 2.072 -4.191 652 HH11 ARG 80 1HH1 ARG 80 -31.987 3.516 -3.024 653 HH12 ARG 80 2HH1 ARG 80 -32.798 3.410 -4.551 654 HH21 ARG 80 1HH2 ARG 80 -30.099 1.926 -6.207 655 HH22 ARG 80 2HH2 ARG 80 -31.723 2.504 -6.361 656 H LEU 81 H LEU 81 -28.548 7.009 1.605 657 HA LEU 81 HA LEU 81 -30.346 6.024 3.691 658 HB2 LEU 81 1HB LEU 81 -27.488 6.779 3.547 659 HB3 LEU 81 2HB LEU 81 -28.314 7.087 5.073 660 HG LEU 81 HG LEU 81 -28.990 4.639 5.034 661 HD11 LEU 81 1HD1 LEU 81 -26.683 3.974 3.368 662 HD12 LEU 81 2HD1 LEU 81 -28.025 4.699 2.482 663 HD13 LEU 81 3HD1 LEU 81 -28.286 3.241 3.439 664 HD21 LEU 81 3HD2 LEU 81 -26.068 4.590 5.169 665 HD22 LEU 81 1HD2 LEU 81 -27.271 4.253 6.415 666 HD23 LEU 81 2HD2 LEU 81 -26.808 5.918 6.065 667 H ARG 82 H ARG 82 -30.274 7.605 5.715 668 HA ARG 82 HA ARG 82 -31.295 10.170 4.721 669 HB2 ARG 82 1HB ARG 82 -32.764 8.661 6.119 670 HB3 ARG 82 2HB ARG 82 -31.683 8.982 7.468 671 HG2 ARG 82 1HG ARG 82 -33.478 10.458 7.746 672 HG3 ARG 82 2HG ARG 82 -32.171 11.442 7.082 673 HD2 ARG 82 1HD ARG 82 -34.101 12.066 5.885 674 HD3 ARG 82 2HD ARG 82 -33.197 11.007 4.804 675 HE ARG 82 HE ARG 82 -34.972 9.393 6.177 676 HH11 ARG 82 1HH1 ARG 82 -35.133 12.101 3.994 677 HH12 ARG 82 2HH1 ARG 82 -36.659 11.635 3.320 678 HH21 ARG 82 1HH2 ARG 82 -36.982 8.769 5.298 679 HH22 ARG 82 2HH2 ARG 82 -37.711 9.740 4.063 680 H GLY 83 H GLY 83 -28.685 10.302 4.608 681 HA2 GLY 83 1HA GLY 83 -27.677 11.366 7.151 682 HA3 GLY 83 2HA GLY 83 -26.700 10.945 5.752 683 H TYR 84 H TYR 84 -28.369 13.426 7.397 684 HA TYR 84 HA TYR 84 -28.483 15.266 5.191 685 HB2 TYR 84 1HB TYR 84 -30.059 15.333 7.134 686 HB3 TYR 84 2HB TYR 84 -28.719 15.858 8.147 687 HD1 TYR 84 HD2 TYR 84 -27.591 18.058 7.612 688 HD2 TYR 84 HD1 TYR 84 -31.265 16.874 5.823 689 HE1 TYR 84 HE2 TYR 84 -28.037 20.396 6.995 690 HE2 TYR 84 HE1 TYR 84 -31.721 19.210 5.199 691 HH TYR 84 HH TYR 84 -30.396 21.295 4.783 692 H ALA 85 H ALA 85 -26.814 16.345 4.403 693 HA ALA 85 HA ALA 85 -24.393 16.629 6.027 694 HB1 ALA 85 1HB ALA 85 -23.211 16.432 4.137 695 HB2 ALA 85 2HB ALA 85 -24.717 15.844 3.430 696 HB3 ALA 85 3HB ALA 85 -24.262 17.538 3.252 697 H ASP 86 H ASP 86 -23.121 18.732 5.406 698 HA ASP 86 HA ASP 86 -24.710 20.921 6.341 699 HB2 ASP 86 1HB ASP 86 -21.849 20.857 5.357 700 HB3 ASP 86 2HB ASP 86 -22.612 22.216 6.179 701 H LEU 87 H LEU 87 -23.932 23.142 5.080 702 HA LEU 87 HA LEU 87 -25.099 22.817 2.406 703 HB2 LEU 87 1HB LEU 87 -24.733 25.443 3.794 704 HB3 LEU 87 2HB LEU 87 -25.898 24.998 2.548 705 HG LEU 87 HG LEU 87 -25.988 24.007 5.395 706 HD11 LEU 87 1HD1 LEU 87 -26.846 25.970 5.959 707 HD12 LEU 87 2HD1 LEU 87 -28.167 25.683 4.827 708 HD13 LEU 87 3HD1 LEU 87 -26.724 26.546 4.296 709 HD21 LEU 87 3HD2 LEU 87 -28.263 23.321 4.793 710 HD22 LEU 87 1HD2 LEU 87 -27.052 22.512 3.798 711 HD23 LEU 87 2HD2 LEU 87 -27.982 23.857 3.136 712 H ARG 88 H ARG 88 -24.324 24.538 0.798 713 HA ARG 88 HA ARG 88 -21.383 24.594 0.884 714 HB2 ARG 88 1HB ARG 88 -22.176 23.289 -0.968 715 HB3 ARG 88 2HB ARG 88 -23.301 24.553 -1.446 716 HG2 ARG 88 1HG ARG 88 -21.402 24.516 -2.934 717 HG3 ARG 88 2HG ARG 88 -21.408 26.012 -1.998 718 HD2 ARG 88 1HD ARG 88 -19.719 25.133 -0.510 719 HD3 ARG 88 2HD ARG 88 -19.772 23.571 -1.326 720 HE ARG 88 HE ARG 88 -19.151 25.397 -3.282 721 HH11 ARG 88 1HH1 ARG 88 -17.767 24.396 -0.248 722 HH12 ARG 88 2HH1 ARG 88 -16.138 24.742 -0.727 723 HH21 ARG 88 1HH2 ARG 88 -17.011 25.857 -3.924 724 HH22 ARG 88 2HH2 ARG 88 -15.710 25.574 -2.818 725 H GLU 89 H GLU 89 -24.265 26.504 0.225 726 HA GLU 89 HA GLU 89 -24.625 28.747 0.121 727 HB2 GLU 89 1HB GLU 89 -21.914 29.067 1.405 728 HB3 GLU 89 2HB GLU 89 -23.266 30.189 1.462 729 HG2 GLU 89 1HG GLU 89 -24.541 28.364 2.674 730 HG3 GLU 89 2HG GLU 89 -22.993 27.538 2.839 731 H ASP 90 H ASP 90 -23.770 27.692 -2.208 732 HA ASP 90 HA ASP 90 -22.501 29.953 -3.459 733 HB2 ASP 90 1HB ASP 90 -20.595 28.494 -2.638 734 HB3 ASP 90 2HB ASP 90 -21.154 27.270 -3.774 735 HA PRO 91 HA PRO 91 -25.676 27.617 -5.944 736 HB2 PRO 91 1HB PRO 91 -27.229 29.784 -6.456 737 HB3 PRO 91 2HB PRO 91 -27.417 28.787 -5.008 738 HG2 PRO 91 1HG PRO 91 -26.005 31.407 -5.334 739 HG3 PRO 91 2HG PRO 91 -27.074 30.868 -4.027 740 HD2 PRO 91 1HD PRO 91 -24.376 30.859 -3.799 741 HD3 PRO 91 2HD PRO 91 -25.406 29.660 -2.991 742 H ASP 92 H ASP 92 -24.433 27.257 -7.734 743 HA ASP 92 HA ASP 92 -23.831 29.563 -9.460 744 HB2 ASP 92 1HB ASP 92 -22.268 27.826 -10.585 745 HB3 ASP 92 2HB ASP 92 -21.790 28.511 -9.034 746 H ARG 93 H ARG 93 -25.135 26.277 -9.448 747 HA ARG 93 HA ARG 93 -26.544 26.915 -11.949 748 HB2 ARG 93 1HB ARG 93 -24.891 24.508 -11.293 749 HB3 ARG 93 2HB ARG 93 -26.283 24.330 -12.353 750 HG2 ARG 93 1HG ARG 93 -25.335 25.555 -14.037 751 HG3 ARG 93 2HG ARG 93 -24.313 26.480 -12.935 752 HD2 ARG 93 1HD ARG 93 -22.904 24.530 -12.578 753 HD3 ARG 93 2HD ARG 93 -23.948 23.566 -13.622 754 HE ARG 93 HE ARG 93 -21.891 25.366 -14.443 755 HH11 ARG 93 1HH1 ARG 93 -24.966 24.010 -15.352 756 HH12 ARG 93 2HH1 ARG 93 -24.704 24.220 -17.052 757 HH21 ARG 93 1HH2 ARG 93 -21.534 25.649 -16.678 758 HH22 ARG 93 2HH2 ARG 93 -22.751 25.152 -17.805 759 H GLN 94 H GLN 94 -28.665 26.800 -11.680 760 HA GLN 94 HA GLN 94 -29.763 24.780 -9.854 761 HB2 GLN 94 1HB GLN 94 -30.487 27.709 -9.943 762 HB3 GLN 94 2HB GLN 94 -31.477 26.491 -9.149 763 HG2 GLN 94 1HG GLN 94 -29.344 25.920 -7.834 764 HG3 GLN 94 2HG GLN 94 -28.757 27.482 -8.402 765 HE21 GLN 94 2HE2 GLN 94 -29.783 29.369 -7.702 766 HE22 GLN 94 1HE2 GLN 94 -30.795 29.388 -6.302 767 H ASP 95 H ASP 95 -29.546 24.655 -12.676 768 HA ASP 95 HA ASP 95 -32.102 25.351 -13.816 769 HB2 ASP 95 1HB ASP 95 -29.864 25.282 -15.056 770 HB3 ASP 95 2HB ASP 95 -30.041 23.530 -15.051 771 H HIS 96 H HIS 96 -30.657 22.595 -12.295 772 HA HIS 96 HA HIS 96 -33.145 21.090 -12.745 773 HB2 HIS 96 1HB HIS 96 -31.883 19.017 -12.916 774 HB3 HIS 96 2HB HIS 96 -31.325 20.155 -14.139 775 HD1 HIS 96 HD1 HIS 96 -28.975 21.290 -13.689 776 HD2 HIS 96 HD2 HIS 96 -29.964 18.163 -11.139 777 HE1 HIS 96 HE1 HIS 96 -26.822 20.628 -12.571 778 H HIS 97 H HIS 97 -33.811 19.732 -11.046 779 HA HIS 97 HA HIS 97 -32.349 19.364 -8.655 780 HB2 HIS 97 1HB HIS 97 -33.903 20.782 -7.207 781 HB3 HIS 97 2HB HIS 97 -32.684 21.647 -8.139 782 HD1 HIS 97 HD1 HIS 97 -34.122 23.804 -8.085 783 HD2 HIS 97 HD2 HIS 97 -35.942 20.582 -9.975 784 HE1 HIS 97 HE1 HIS 97 -36.091 24.770 -9.316 785 HA PRO 98 HA PRO 98 -36.076 16.678 -9.462 786 HB2 PRO 98 1HB PRO 98 -34.704 14.336 -9.440 787 HB3 PRO 98 2HB PRO 98 -34.915 15.311 -10.898 788 HG2 PRO 98 1HG PRO 98 -32.564 15.148 -9.052 789 HG3 PRO 98 2HG PRO 98 -32.594 15.189 -10.825 790 HD2 PRO 98 1HD PRO 98 -32.039 17.375 -9.327 791 HD3 PRO 98 2HD PRO 98 -32.869 17.477 -10.893 792 H GLY 99 H GLY 99 -36.842 14.836 -8.093 793 HA2 GLY 99 1HA GLY 99 -36.249 15.422 -5.310 794 HA3 GLY 99 2HA GLY 99 -37.547 14.401 -5.909 795 H SER 100 H SER 100 -36.705 13.128 -3.995 796 HA SER 100 HA SER 100 -34.611 11.284 -4.939 797 HB2 SER 100 1HB SER 100 -33.586 12.515 -3.174 798 HB3 SER 100 2HB SER 100 -35.025 12.396 -2.162 799 HG SER 100 HG SER 100 -33.550 10.885 -1.450 800 H GLY 101 H GLY 101 -35.168 9.196 -4.982 801 HA2 GLY 101 1HA GLY 101 -36.589 7.697 -3.227 802 HA3 GLY 101 2HA GLY 101 -37.845 8.450 -4.199 803 H ALA 102 H ALA 102 -36.247 5.681 -3.859 804 HA ALA 102 HA ALA 102 -36.804 4.865 -6.582 805 HB1 ALA 102 1HB ALA 102 -34.559 3.874 -6.914 806 HB2 ALA 102 2HB ALA 102 -34.540 5.637 -6.845 807 HB3 ALA 102 3HB ALA 102 -34.015 4.695 -5.450 808 H GLN 103 H GLN 103 -36.551 2.489 -6.854 809 HA GLN 103 HA GLN 103 -36.704 1.023 -4.315 810 HB2 GLN 103 1HB GLN 103 -38.568 -0.344 -5.391 811 HB3 GLN 103 2HB GLN 103 -38.986 1.274 -4.845 812 HG2 GLN 103 1HG GLN 103 -38.131 0.901 -7.667 813 HG3 GLN 103 2HG GLN 103 -39.746 0.379 -7.191 814 HE21 GLN 103 2HE2 GLN 103 -40.160 2.107 -8.873 815 HE22 GLN 103 1HE2 GLN 103 -40.380 3.717 -8.285 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -5.364 4.297 -2.181 2 HA2 GLY 1 1HA GLY 1 -2.818 4.601 -2.131 3 HA3 GLY 1 2HA GLY 1 -3.641 5.254 -3.540 4 H SER 2 H SER 2 -1.154 6.035 -1.995 5 HA SER 2 HA SER 2 -1.845 8.700 -1.051 6 HB2 SER 2 1HB SER 2 -0.243 7.771 0.357 7 HB3 SER 2 2HB SER 2 0.627 7.003 -0.971 8 HG SER 2 HG SER 2 0.930 9.493 0.104 9 H LEU 3 H LEU 3 -0.283 7.135 -3.761 10 HA LEU 3 HA LEU 3 -0.084 9.756 -5.084 11 HB2 LEU 3 1HB LEU 3 1.969 9.123 -6.136 12 HB3 LEU 3 2HB LEU 3 2.140 8.926 -4.393 13 HG LEU 3 HG LEU 3 1.466 6.581 -6.133 14 HD11 LEU 3 1HD1 LEU 3 4.280 7.407 -5.481 15 HD12 LEU 3 2HD1 LEU 3 3.500 7.810 -7.010 16 HD13 LEU 3 3HD1 LEU 3 3.736 6.121 -6.558 17 HD21 LEU 3 3HD2 LEU 3 2.497 7.062 -3.383 18 HD22 LEU 3 1HD2 LEU 3 2.997 5.598 -4.230 19 HD23 LEU 3 2HD2 LEU 3 1.284 5.914 -3.952 20 H VAL 4 H VAL 4 -0.604 9.822 -7.257 21 HA VAL 4 HA VAL 4 -2.117 7.516 -8.225 22 HB VAL 4 HB VAL 4 -3.271 9.655 -8.281 23 HG11 VAL 4 1HG1 VAL 4 -2.299 11.567 -8.867 24 HG12 VAL 4 2HG1 VAL 4 -0.784 10.677 -9.022 25 HG13 VAL 4 3HG1 VAL 4 -1.818 10.911 -10.431 26 HG21 VAL 4 3HG2 VAL 4 -2.534 8.586 -11.002 27 HG22 VAL 4 1HG2 VAL 4 -3.889 8.089 -9.989 28 HG23 VAL 4 2HG2 VAL 4 -3.866 9.702 -10.701 29 HA PRO 5 HA PRO 5 1.138 6.346 -10.983 30 HB2 PRO 5 1HB PRO 5 -0.311 4.652 -12.532 31 HB3 PRO 5 2HB PRO 5 0.228 4.238 -10.901 32 HG2 PRO 5 1HG PRO 5 -2.448 5.214 -11.820 33 HG3 PRO 5 2HG PRO 5 -2.064 3.929 -10.661 34 HD2 PRO 5 1HD PRO 5 -2.811 6.414 -9.887 35 HD3 PRO 5 2HD PRO 5 -1.682 5.419 -8.944 36 H ARG 6 H ARG 6 1.126 5.871 -13.546 37 HA ARG 6 HA ARG 6 0.811 8.393 -14.772 38 HB2 ARG 6 1HB ARG 6 2.441 6.560 -15.420 39 HB3 ARG 6 2HB ARG 6 1.092 5.757 -16.213 40 HG2 ARG 6 1HG ARG 6 0.915 7.387 -17.850 41 HG3 ARG 6 2HG ARG 6 1.778 8.588 -16.886 42 HD2 ARG 6 1HD ARG 6 3.796 7.026 -17.093 43 HD3 ARG 6 2HD ARG 6 2.884 6.225 -18.372 44 HE ARG 6 HE ARG 6 2.824 8.850 -19.074 45 HH11 ARG 6 1HH1 ARG 6 5.364 6.599 -18.297 46 HH12 ARG 6 2HH1 ARG 6 6.532 7.360 -19.325 47 HH21 ARG 6 1HH2 ARG 6 4.353 9.861 -20.431 48 HH22 ARG 6 2HH2 ARG 6 5.956 9.217 -20.538 49 H GLY 7 H GLY 7 -0.717 9.205 -16.149 50 HA2 GLY 7 1HA GLY 7 -2.597 9.014 -17.607 51 HA3 GLY 7 2HA GLY 7 -3.015 7.500 -16.818 52 H SER 8 H SER 8 -4.422 10.179 -17.332 53 HA SER 8 HA SER 8 -5.875 10.195 -14.856 54 HB2 SER 8 1HB SER 8 -4.598 12.815 -15.624 55 HB3 SER 8 2HB SER 8 -5.416 12.394 -14.119 56 HG SER 8 HG SER 8 -3.657 11.416 -13.416 57 H MET 9 H MET 9 -7.751 11.659 -14.938 58 HA MET 9 HA MET 9 -8.449 12.821 -17.485 59 HB2 MET 9 1HB MET 9 -9.148 10.707 -18.148 60 HB3 MET 9 2HB MET 9 -9.654 10.253 -16.527 61 HG2 MET 9 1HG MET 9 -11.670 11.350 -16.700 62 HG3 MET 9 2HG MET 9 -11.089 12.436 -17.960 63 HE1 MET 9 3HE MET 9 -11.911 8.377 -17.511 64 HE2 MET 9 1HE MET 9 -13.030 9.623 -16.958 65 HE3 MET 9 2HE MET 9 -13.411 8.670 -18.392 66 H GLN 10 H GLN 10 -9.856 14.466 -17.238 67 HA GLN 10 HA GLN 10 -10.914 14.915 -14.543 68 HB2 GLN 10 1HB GLN 10 -9.536 16.589 -16.207 69 HB3 GLN 10 2HB GLN 10 -11.198 17.064 -16.531 70 HG2 GLN 10 1HG GLN 10 -11.179 18.300 -14.704 71 HG3 GLN 10 2HG GLN 10 -10.951 16.843 -13.738 72 HE21 GLN 10 2HE2 GLN 10 -8.863 16.255 -13.101 73 HE22 GLN 10 1HE2 GLN 10 -7.559 17.388 -13.106 74 H ILE 11 H ILE 11 -13.024 14.815 -14.113 75 HA ILE 11 HA ILE 11 -14.917 14.856 -16.368 76 HB ILE 11 HB ILE 11 -16.283 13.170 -15.247 77 HG12 ILE 11 1HG1 ILE 11 -13.995 12.908 -13.286 78 HG13 ILE 11 2HG1 ILE 11 -15.521 13.711 -12.932 79 HG21 ILE 11 1HG2 ILE 11 -14.866 11.239 -15.664 80 HG22 ILE 11 2HG2 ILE 11 -14.610 12.472 -16.897 81 HG23 ILE 11 3HG2 ILE 11 -13.430 12.261 -15.604 82 HD11 ILE 11 3HD1 ILE 11 -16.338 11.769 -12.277 83 HD12 ILE 11 1HD1 ILE 11 -16.169 11.166 -13.925 84 HD13 ILE 11 2HD1 ILE 11 -14.858 10.945 -12.766 85 H PHE 12 H PHE 12 -17.176 15.328 -15.679 86 HA PHE 12 HA PHE 12 -17.168 17.293 -13.486 87 HB2 PHE 12 1HB PHE 12 -18.795 17.192 -16.030 88 HB3 PHE 12 2HB PHE 12 -19.124 18.311 -14.712 89 HD1 PHE 12 HD2 PHE 12 -16.530 19.232 -13.886 90 HD2 PHE 12 HD1 PHE 12 -17.964 18.391 -17.804 91 HE1 PHE 12 HE2 PHE 12 -14.894 20.814 -14.821 92 HE2 PHE 12 HE1 PHE 12 -16.329 19.971 -18.745 93 HZ PHE 12 HZ PHE 12 -14.792 21.186 -17.253 94 H VAL 13 H VAL 13 -18.451 16.949 -11.792 95 HA VAL 13 HA VAL 13 -20.672 15.035 -12.074 96 HB VAL 13 HB VAL 13 -18.921 15.265 -9.626 97 HG11 VAL 13 1HG1 VAL 13 -21.340 13.709 -10.347 98 HG12 VAL 13 2HG1 VAL 13 -20.107 12.899 -9.378 99 HG13 VAL 13 3HG1 VAL 13 -20.850 14.390 -8.796 100 HG21 VAL 13 3HG2 VAL 13 -17.416 14.020 -10.693 101 HG22 VAL 13 1HG2 VAL 13 -18.616 12.730 -10.762 102 HG23 VAL 13 2HG2 VAL 13 -18.464 13.866 -12.103 103 H LYS 14 H LYS 14 -22.540 15.494 -10.959 104 HA LYS 14 HA LYS 14 -22.641 18.150 -9.690 105 HB2 LYS 14 1HB LYS 14 -24.631 16.621 -11.339 106 HB3 LYS 14 2HB LYS 14 -25.171 17.873 -10.228 107 HG2 LYS 14 1HG LYS 14 -24.980 18.959 -12.278 108 HG3 LYS 14 2HG LYS 14 -23.503 19.399 -11.417 109 HD2 LYS 14 1HD LYS 14 -22.202 17.880 -12.680 110 HD3 LYS 14 2HD LYS 14 -23.634 17.076 -13.325 111 HE2 LYS 14 1HE LYS 14 -22.869 19.938 -13.889 112 HE3 LYS 14 2HE LYS 14 -22.513 18.578 -14.954 113 HZ1 LYS 14 3HZ LYS 14 -25.196 18.384 -14.439 114 HZ2 LYS 14 1HZ LYS 14 -24.486 18.956 -15.864 115 HZ3 LYS 14 2HZ LYS 14 -24.938 20.042 -14.649 116 H THR 15 H THR 15 -22.992 18.194 -7.578 117 HA THR 15 HA THR 15 -23.647 15.799 -6.133 118 HB THR 15 HB THR 15 -23.445 17.170 -4.118 119 HG1 THR 15 HG1 THR 15 -23.149 19.344 -5.942 120 HG21 THR 15 3HG2 THR 15 -21.216 17.052 -4.243 121 HG22 THR 15 1HG2 THR 15 -21.150 18.298 -5.489 122 HG23 THR 15 2HG2 THR 15 -21.422 16.614 -5.938 123 H LEU 16 H LEU 16 -25.257 16.330 -4.141 124 HA LEU 16 HA LEU 16 -27.843 16.480 -5.357 125 HB2 LEU 16 1HB LEU 16 -28.711 15.992 -3.181 126 HB3 LEU 16 2HB LEU 16 -27.300 14.978 -3.472 127 HG LEU 16 HG LEU 16 -26.084 16.917 -2.139 128 HD11 LEU 16 1HD1 LEU 16 -28.785 17.674 -1.921 129 HD12 LEU 16 2HD1 LEU 16 -27.391 18.369 -1.096 130 HD13 LEU 16 3HD1 LEU 16 -28.299 17.060 -0.340 131 HD21 LEU 16 3HD2 LEU 16 -26.554 14.383 -1.635 132 HD22 LEU 16 1HD2 LEU 16 -27.695 15.050 -0.468 133 HD23 LEU 16 2HD2 LEU 16 -25.984 15.468 -0.366 134 H THR 17 H THR 17 -25.717 18.746 -3.946 135 HA THR 17 HA THR 17 -27.851 20.655 -3.362 136 HB THR 17 HB THR 17 -26.018 20.448 -1.730 137 HG1 THR 17 HG1 THR 17 -26.169 22.537 -1.365 138 HG21 THR 17 3HG2 THR 17 -24.156 19.877 -3.112 139 HG22 THR 17 1HG2 THR 17 -23.792 21.431 -2.364 140 HG23 THR 17 2HG2 THR 17 -24.318 21.364 -4.046 141 H GLY 18 H GLY 18 -27.205 19.809 -6.117 142 HA2 GLY 18 1HA GLY 18 -26.892 20.734 -8.197 143 HA3 GLY 18 2HA GLY 18 -27.511 22.205 -7.460 144 H LYS 19 H LYS 19 -24.531 20.584 -6.534 145 HA LYS 19 HA LYS 19 -23.049 22.943 -7.490 146 HB2 LYS 19 1HB LYS 19 -22.995 22.717 -5.065 147 HB3 LYS 19 2HB LYS 19 -22.422 21.060 -5.208 148 HG2 LYS 19 1HG LYS 19 -20.795 23.147 -6.524 149 HG3 LYS 19 2HG LYS 19 -20.802 23.128 -4.759 150 HD2 LYS 19 1HD LYS 19 -20.363 20.582 -5.048 151 HD3 LYS 19 2HD LYS 19 -19.851 21.035 -6.675 152 HE2 LYS 19 1HE LYS 19 -18.739 22.110 -4.085 153 HE3 LYS 19 2HE LYS 19 -17.948 20.960 -5.161 154 HZ1 LYS 19 3HZ LYS 19 -18.085 23.812 -5.335 155 HZ2 LYS 19 1HZ LYS 19 -18.560 23.066 -6.777 156 HZ3 LYS 19 2HZ LYS 19 -17.040 22.734 -6.115 157 H THR 20 H THR 20 -21.554 22.662 -9.013 158 HA THR 20 HA THR 20 -21.003 19.973 -9.965 159 HB THR 20 HB THR 20 -19.708 22.353 -11.206 160 HG1 THR 20 HG1 THR 20 -22.479 21.889 -11.049 161 HG21 THR 20 3HG2 THR 20 -20.638 21.026 -13.252 162 HG22 THR 20 1HG2 THR 20 -20.825 19.720 -12.084 163 HG23 THR 20 2HG2 THR 20 -19.232 20.416 -12.381 164 H ILE 21 H ILE 21 -19.223 18.858 -9.510 165 HA ILE 21 HA ILE 21 -16.853 20.317 -8.547 166 HB ILE 21 HB ILE 21 -17.817 19.305 -6.604 167 HG12 ILE 21 1HG1 ILE 21 -15.263 18.932 -7.337 168 HG13 ILE 21 2HG1 ILE 21 -15.908 18.339 -5.810 169 HG21 ILE 21 1HG2 ILE 21 -17.965 16.803 -8.271 170 HG22 ILE 21 2HG2 ILE 21 -18.165 16.817 -6.519 171 HG23 ILE 21 3HG2 ILE 21 -19.297 17.701 -7.543 172 HD11 ILE 21 3HD1 ILE 21 -15.953 16.621 -8.254 173 HD12 ILE 21 1HD1 ILE 21 -14.499 16.762 -7.267 174 HD13 ILE 21 2HD1 ILE 21 -15.992 16.149 -6.555 175 H THR 22 H THR 22 -14.957 19.760 -9.448 176 HA THR 22 HA THR 22 -14.990 17.866 -11.634 177 HB THR 22 HB THR 22 -12.469 19.199 -10.749 178 HG1 THR 22 HG1 THR 22 -14.421 20.591 -12.269 179 HG21 THR 22 3HG2 THR 22 -12.743 17.651 -12.767 180 HG22 THR 22 1HG2 THR 22 -11.950 19.201 -13.045 181 HG23 THR 22 2HG2 THR 22 -13.636 18.976 -13.512 182 H LEU 23 H LEU 23 -14.203 15.853 -11.614 183 HA LEU 23 HA LEU 23 -12.609 15.011 -9.283 184 HB2 LEU 23 1HB LEU 23 -15.091 14.183 -9.654 185 HB3 LEU 23 2HB LEU 23 -14.301 13.055 -10.753 186 HG LEU 23 HG LEU 23 -12.932 12.220 -8.895 187 HD11 LEU 23 1HD1 LEU 23 -14.356 14.386 -7.423 188 HD12 LEU 23 2HD1 LEU 23 -12.661 13.904 -7.358 189 HD13 LEU 23 3HD1 LEU 23 -13.889 12.917 -6.566 190 HD21 LEU 23 3HD2 LEU 23 -14.974 11.361 -7.505 191 HD22 LEU 23 1HD2 LEU 23 -14.771 10.872 -9.188 192 HD23 LEU 23 2HD2 LEU 23 -15.912 12.151 -8.774 193 H GLU 24 H GLU 24 -10.862 13.693 -9.642 194 HA GLU 24 HA GLU 24 -10.104 13.338 -12.460 195 HB2 GLU 24 1HB GLU 24 -8.426 14.624 -11.498 196 HB3 GLU 24 2HB GLU 24 -8.535 13.793 -9.952 197 HG2 GLU 24 1HG GLU 24 -7.154 12.113 -10.594 198 HG3 GLU 24 2HG GLU 24 -7.645 12.204 -12.284 199 H VAL 25 H VAL 25 -10.013 11.356 -13.280 200 HA VAL 25 HA VAL 25 -9.464 9.079 -11.531 201 HB VAL 25 HB VAL 25 -11.600 8.560 -13.492 202 HG11 VAL 25 1HG1 VAL 25 -10.680 7.613 -10.867 203 HG12 VAL 25 2HG1 VAL 25 -12.429 7.585 -11.104 204 HG13 VAL 25 3HG1 VAL 25 -11.372 6.719 -12.220 205 HG21 VAL 25 3HG2 VAL 25 -12.050 10.341 -11.107 206 HG22 VAL 25 1HG2 VAL 25 -12.456 10.658 -12.794 207 HG23 VAL 25 2HG2 VAL 25 -13.343 9.432 -11.888 208 H GLU 26 H GLU 26 -9.331 7.010 -12.947 209 HA GLU 26 HA GLU 26 -7.711 7.699 -15.299 210 HB2 GLU 26 1HB GLU 26 -7.755 5.019 -13.931 211 HB3 GLU 26 2HB GLU 26 -6.515 5.689 -14.981 212 HG2 GLU 26 1HG GLU 26 -5.890 7.288 -13.278 213 HG3 GLU 26 2HG GLU 26 -7.186 6.712 -12.232 214 HA PRO 27 HA PRO 27 -10.550 5.873 -18.104 215 HB2 PRO 27 1HB PRO 27 -8.863 4.846 -19.967 216 HB3 PRO 27 2HB PRO 27 -9.155 6.580 -19.788 217 HG2 PRO 27 1HG PRO 27 -6.875 4.928 -18.771 218 HG3 PRO 27 2HG PRO 27 -6.845 6.529 -19.532 219 HD2 PRO 27 1HD PRO 27 -6.660 6.186 -16.852 220 HD3 PRO 27 2HD PRO 27 -7.436 7.606 -17.582 221 H SER 28 H SER 28 -8.241 3.964 -16.437 222 HA SER 28 HA SER 28 -9.571 1.484 -17.300 223 HB2 SER 28 1HB SER 28 -7.413 0.575 -15.963 224 HB3 SER 28 2HB SER 28 -7.385 0.958 -17.684 225 HG SER 28 HG SER 28 -5.703 2.069 -16.868 226 H ASP 29 H ASP 29 -9.320 3.677 -14.760 227 HA ASP 29 HA ASP 29 -9.505 2.009 -12.505 228 HB2 ASP 29 1HB ASP 29 -10.202 4.856 -13.087 229 HB3 ASP 29 2HB ASP 29 -10.785 4.133 -11.590 230 H THR 30 H THR 30 -11.346 1.514 -11.192 231 HA THR 30 HA THR 30 -13.735 0.986 -12.808 232 HB THR 30 HB THR 30 -14.329 -0.474 -10.749 233 HG1 THR 30 HG1 THR 30 -12.302 0.586 -9.697 234 HG21 THR 30 3HG2 THR 30 -13.442 -1.165 -13.079 235 HG22 THR 30 1HG2 THR 30 -13.349 -2.331 -11.760 236 HG23 THR 30 2HG2 THR 30 -11.912 -1.431 -12.244 237 H ILE 31 H ILE 31 -15.827 0.955 -11.442 238 HA ILE 31 HA ILE 31 -16.514 3.538 -10.746 239 HB ILE 31 HB ILE 31 -17.784 0.978 -9.768 240 HG12 ILE 31 1HG1 ILE 31 -17.739 1.125 -12.199 241 HG13 ILE 31 2HG1 ILE 31 -19.381 1.376 -11.617 242 HG21 ILE 31 1HG2 ILE 31 -18.821 2.432 -8.379 243 HG22 ILE 31 2HG2 ILE 31 -18.475 3.826 -9.401 244 HG23 ILE 31 3HG2 ILE 31 -19.802 2.739 -9.812 245 HD11 ILE 31 3HD1 ILE 31 -17.546 3.230 -12.988 246 HD12 ILE 31 1HD1 ILE 31 -19.299 3.074 -13.094 247 HD13 ILE 31 2HD1 ILE 31 -18.570 3.917 -11.727 248 H GLU 32 H GLU 32 -15.375 0.914 -8.672 249 HA GLU 32 HA GLU 32 -15.813 2.093 -6.187 250 HB2 GLU 32 1HB GLU 32 -13.945 0.631 -5.394 251 HB3 GLU 32 2HB GLU 32 -15.182 -0.215 -6.312 252 HG2 GLU 32 1HG GLU 32 -13.797 -0.373 -8.218 253 HG3 GLU 32 2HG GLU 32 -12.631 0.767 -7.551 254 H ASN 33 H ASN 33 -13.265 2.601 -8.533 255 HA ASN 33 HA ASN 33 -11.544 4.075 -6.802 256 HB2 ASN 33 1HB ASN 33 -11.569 3.237 -9.583 257 HB3 ASN 33 2HB ASN 33 -10.990 4.892 -9.415 258 HD21 ASN 33 2HD2 ASN 33 -9.557 2.473 -10.180 259 HD22 ASN 33 1HD2 ASN 33 -8.257 2.311 -9.054 260 H VAL 34 H VAL 34 -13.937 4.990 -9.258 261 HA VAL 34 HA VAL 34 -13.598 7.734 -9.250 262 HB VAL 34 HB VAL 34 -16.208 6.231 -9.494 263 HG11 VAL 34 1HG1 VAL 34 -15.434 9.053 -10.195 264 HG12 VAL 34 2HG1 VAL 34 -16.863 8.252 -10.852 265 HG13 VAL 34 3HG1 VAL 34 -16.719 8.515 -9.113 266 HG21 VAL 34 3HG2 VAL 34 -14.345 5.582 -11.069 267 HG22 VAL 34 1HG2 VAL 34 -15.827 6.157 -11.833 268 HG23 VAL 34 2HG2 VAL 34 -14.428 7.223 -11.710 269 H LYS 35 H LYS 35 -15.384 5.705 -6.989 270 HA LYS 35 HA LYS 35 -16.546 7.878 -5.546 271 HB2 LYS 35 1HB LYS 35 -16.259 4.931 -5.059 272 HB3 LYS 35 2HB LYS 35 -16.833 5.986 -3.774 273 HG2 LYS 35 1HG LYS 35 -18.857 5.588 -4.622 274 HG3 LYS 35 2HG LYS 35 -18.402 6.756 -5.866 275 HD2 LYS 35 1HD LYS 35 -18.202 5.171 -7.456 276 HD3 LYS 35 2HD LYS 35 -17.479 4.005 -6.345 277 HE2 LYS 35 1HE LYS 35 -20.282 4.570 -5.766 278 HE3 LYS 35 2HE LYS 35 -20.028 3.893 -7.374 279 HZ1 LYS 35 3HZ LYS 35 -19.123 1.962 -6.506 280 HZ2 LYS 35 1HZ LYS 35 -20.374 2.300 -5.417 281 HZ3 LYS 35 2HZ LYS 35 -18.773 2.660 -5.005 282 H ALA 36 H ALA 36 -13.527 6.166 -5.407 283 HA ALA 36 HA ALA 36 -12.705 6.671 -2.804 284 HB1 ALA 36 1HB ALA 36 -10.683 6.928 -4.958 285 HB2 ALA 36 2HB ALA 36 -10.640 5.985 -3.468 286 HB3 ALA 36 3HB ALA 36 -11.575 5.410 -4.848 287 H LYS 37 H LYS 37 -12.545 8.750 -5.659 288 HA LYS 37 HA LYS 37 -11.139 10.854 -4.311 289 HB2 LYS 37 1HB LYS 37 -12.620 10.767 -6.943 290 HB3 LYS 37 2HB LYS 37 -11.742 12.177 -6.365 291 HG2 LYS 37 1HG LYS 37 -10.124 11.258 -7.655 292 HG3 LYS 37 2HG LYS 37 -9.785 10.401 -6.149 293 HD2 LYS 37 1HD LYS 37 -11.078 8.494 -6.915 294 HD3 LYS 37 2HD LYS 37 -11.512 9.356 -8.394 295 HE2 LYS 37 1HE LYS 37 -9.757 8.108 -9.161 296 HE3 LYS 37 2HE LYS 37 -8.896 9.554 -8.639 297 HZ1 LYS 37 3HZ LYS 37 -8.777 6.874 -7.599 298 HZ2 LYS 37 1HZ LYS 37 -8.955 8.052 -6.397 299 HZ3 LYS 37 2HZ LYS 37 -7.654 8.133 -7.475 300 H ILE 38 H ILE 38 -14.477 10.011 -4.846 301 HA ILE 38 HA ILE 38 -15.650 12.512 -4.298 302 HB ILE 38 HB ILE 38 -16.762 9.737 -3.868 303 HG12 ILE 38 1HG1 ILE 38 -16.139 10.301 -6.206 304 HG13 ILE 38 2HG1 ILE 38 -17.872 10.069 -6.002 305 HG21 ILE 38 1HG2 ILE 38 -17.829 12.371 -3.240 306 HG22 ILE 38 2HG2 ILE 38 -18.886 11.432 -4.293 307 HG23 ILE 38 3HG2 ILE 38 -18.383 10.775 -2.736 308 HD11 ILE 38 3HD1 ILE 38 -17.392 11.960 -7.445 309 HD12 ILE 38 1HD1 ILE 38 -18.193 12.483 -5.964 310 HD13 ILE 38 2HD1 ILE 38 -16.456 12.719 -6.157 311 H GLN 39 H GLN 39 -14.414 9.984 -2.231 312 HA GLN 39 HA GLN 39 -15.655 10.577 0.172 313 HB2 GLN 39 1HB GLN 39 -12.986 9.438 -0.549 314 HB3 GLN 39 2HB GLN 39 -13.319 9.832 1.133 315 HG2 GLN 39 1HG GLN 39 -15.254 8.360 1.110 316 HG3 GLN 39 2HG GLN 39 -14.960 7.985 -0.587 317 HE21 GLN 39 2HE2 GLN 39 -13.639 6.357 -1.071 318 HE22 GLN 39 1HE2 GLN 39 -12.660 5.495 0.062 319 H ASP 40 H ASP 40 -12.961 12.181 -1.412 320 HA ASP 40 HA ASP 40 -12.370 13.885 0.824 321 HB2 ASP 40 1HB ASP 40 -10.742 13.164 -1.010 322 HB3 ASP 40 2HB ASP 40 -11.537 14.356 -2.036 323 H LYS 41 H LYS 41 -14.552 13.949 -1.840 324 HA LYS 41 HA LYS 41 -14.969 16.802 -1.791 325 HB2 LYS 41 1HB LYS 41 -16.789 14.771 -3.067 326 HB3 LYS 41 2HB LYS 41 -16.556 16.456 -3.513 327 HG2 LYS 41 1HG LYS 41 -14.471 14.301 -3.796 328 HG3 LYS 41 2HG LYS 41 -15.522 14.873 -5.095 329 HD2 LYS 41 1HD LYS 41 -13.744 16.223 -5.505 330 HD3 LYS 41 2HD LYS 41 -14.533 17.222 -4.282 331 HE2 LYS 41 1HE LYS 41 -13.074 16.434 -2.580 332 HE3 LYS 41 2HE LYS 41 -12.436 15.165 -3.624 333 HZ1 LYS 41 3HZ LYS 41 -11.252 17.531 -3.235 334 HZ2 LYS 41 1HZ LYS 41 -12.131 17.854 -4.644 335 HZ3 LYS 41 2HZ LYS 41 -11.024 16.576 -4.612 336 H GLU 42 H GLU 42 -16.882 13.944 -0.866 337 HA GLU 42 HA GLU 42 -18.416 15.686 0.950 338 HB2 GLU 42 1HB GLU 42 -19.392 13.288 -0.609 339 HB3 GLU 42 2HB GLU 42 -20.329 14.126 0.619 340 HG2 GLU 42 1HG GLU 42 -19.342 15.288 -1.975 341 HG3 GLU 42 2HG GLU 42 -21.001 14.833 -1.590 342 H GLY 43 H GLY 43 -16.939 12.541 0.419 343 HA2 GLY 43 1HA GLY 43 -16.029 11.080 1.958 344 HA3 GLY 43 2HA GLY 43 -16.440 12.227 3.224 345 H ILE 44 H ILE 44 -18.171 10.115 0.927 346 HA ILE 44 HA ILE 44 -19.811 9.189 3.193 347 HB ILE 44 HB ILE 44 -21.653 8.847 1.480 348 HG12 ILE 44 1HG1 ILE 44 -19.902 10.739 -0.106 349 HG13 ILE 44 2HG1 ILE 44 -20.271 9.071 -0.533 350 HG21 ILE 44 1HG2 ILE 44 -21.125 10.904 3.141 351 HG22 ILE 44 2HG2 ILE 44 -21.217 11.756 1.600 352 HG23 ILE 44 3HG2 ILE 44 -22.582 10.787 2.154 353 HD11 ILE 44 3HD1 ILE 44 -21.589 10.658 -1.828 354 HD12 ILE 44 1HD1 ILE 44 -22.612 9.645 -0.810 355 HD13 ILE 44 2HD1 ILE 44 -22.271 11.310 -0.338 356 HA PRO 45 HA PRO 45 -18.705 5.085 2.080 357 HB2 PRO 45 1HB PRO 45 -20.919 3.735 2.883 358 HB3 PRO 45 2HB PRO 45 -19.747 4.418 4.016 359 HG2 PRO 45 1HG PRO 45 -22.387 5.517 3.129 360 HG3 PRO 45 2HG PRO 45 -21.686 5.466 4.757 361 HD2 PRO 45 1HD PRO 45 -21.649 7.698 3.224 362 HD3 PRO 45 2HD PRO 45 -20.357 7.311 4.380 363 HA PRO 46 HA PRO 46 -20.383 3.906 -1.809 364 HB2 PRO 46 1HB PRO 46 -20.308 1.195 -1.694 365 HB3 PRO 46 2HB PRO 46 -18.855 2.190 -1.849 366 HG2 PRO 46 1HG PRO 46 -20.027 0.916 0.594 367 HG3 PRO 46 2HG PRO 46 -18.331 1.006 0.083 368 HD2 PRO 46 1HD PRO 46 -19.376 2.653 1.961 369 HD3 PRO 46 2HD PRO 46 -18.081 3.162 0.859 370 H ASP 47 H ASP 47 -21.879 2.579 1.060 371 HA ASP 47 HA ASP 47 -24.168 1.491 -0.254 372 HB2 ASP 47 1HB ASP 47 -23.549 2.155 2.621 373 HB3 ASP 47 2HB ASP 47 -25.121 1.535 2.124 374 H GLN 48 H GLN 48 -23.314 4.613 1.043 375 HA GLN 48 HA GLN 48 -26.038 5.591 0.538 376 HB2 GLN 48 1HB GLN 48 -23.779 6.633 2.229 377 HB3 GLN 48 2HB GLN 48 -25.134 7.658 1.776 378 HG2 GLN 48 1HG GLN 48 -25.887 6.907 3.776 379 HG3 GLN 48 2HG GLN 48 -26.530 5.638 2.735 380 HE21 GLN 48 2HE2 GLN 48 -24.315 6.431 5.237 381 HE22 GLN 48 1HE2 GLN 48 -23.746 4.830 5.544 382 H GLN 49 H GLN 49 -23.243 5.266 -1.078 383 HA GLN 49 HA GLN 49 -23.661 7.756 -2.595 384 HB2 GLN 49 1HB GLN 49 -21.467 7.492 -1.237 385 HB3 GLN 49 2HB GLN 49 -21.010 6.349 -2.493 386 HG2 GLN 49 1HG GLN 49 -21.991 9.006 -3.357 387 HG3 GLN 49 2HG GLN 49 -20.396 8.924 -2.611 388 HE21 GLN 49 2HE2 GLN 49 -19.559 9.602 -4.653 389 HE22 GLN 49 1HE2 GLN 49 -19.341 8.457 -5.928 390 H ARG 50 H ARG 50 -24.292 7.450 -4.620 391 HA ARG 50 HA ARG 50 -23.394 5.071 -6.068 392 HB2 ARG 50 1HB ARG 50 -26.156 5.681 -5.262 393 HB3 ARG 50 2HB ARG 50 -25.966 5.286 -6.965 394 HG2 ARG 50 1HG ARG 50 -24.952 3.566 -4.714 395 HG3 ARG 50 2HG ARG 50 -26.511 3.346 -5.511 396 HD2 ARG 50 1HD ARG 50 -25.506 2.781 -7.558 397 HD3 ARG 50 2HD ARG 50 -23.938 3.410 -7.056 398 HE ARG 50 HE ARG 50 -23.487 1.386 -6.105 399 HH11 ARG 50 1HH1 ARG 50 -26.926 1.663 -6.569 400 HH12 ARG 50 2HH1 ARG 50 -27.254 0.032 -6.084 401 HH21 ARG 50 1HH2 ARG 50 -23.906 -0.763 -5.465 402 HH22 ARG 50 2HH2 ARG 50 -25.536 -1.346 -5.455 403 H LEU 51 H LEU 51 -22.901 5.455 -8.154 404 HA LEU 51 HA LEU 51 -23.238 8.189 -9.124 405 HB2 LEU 51 1HB LEU 51 -21.485 5.893 -9.925 406 HB3 LEU 51 2HB LEU 51 -21.695 7.293 -10.976 407 HG LEU 51 HG LEU 51 -19.652 7.539 -9.745 408 HD11 LEU 51 1HD1 LEU 51 -21.217 9.513 -10.092 409 HD12 LEU 51 2HD1 LEU 51 -19.959 9.694 -8.870 410 HD13 LEU 51 3HD1 LEU 51 -21.619 9.352 -8.382 411 HD21 LEU 51 3HD2 LEU 51 -20.910 6.142 -7.750 412 HD22 LEU 51 1HD2 LEU 51 -20.824 7.773 -7.083 413 HD23 LEU 51 2HD2 LEU 51 -19.351 6.957 -7.608 414 H ILE 52 H ILE 52 -24.362 8.732 -10.936 415 HA ILE 52 HA ILE 52 -25.847 6.560 -12.266 416 HB ILE 52 HB ILE 52 -26.815 9.401 -11.982 417 HG12 ILE 52 1HG1 ILE 52 -26.648 8.451 -9.752 418 HG13 ILE 52 2HG1 ILE 52 -28.340 8.526 -10.230 419 HG21 ILE 52 1HG2 ILE 52 -27.734 7.041 -13.385 420 HG22 ILE 52 2HG2 ILE 52 -28.959 7.672 -12.286 421 HG23 ILE 52 3HG2 ILE 52 -28.266 8.716 -13.527 422 HD11 ILE 52 3HD1 ILE 52 -28.449 6.411 -9.564 423 HD12 ILE 52 1HD1 ILE 52 -27.581 6.020 -11.048 424 HD13 ILE 52 2HD1 ILE 52 -26.695 6.239 -9.539 425 H PHE 53 H PHE 53 -25.869 6.496 -14.453 426 HA PHE 53 HA PHE 53 -24.800 8.765 -15.956 427 HB2 PHE 53 1HB PHE 53 -22.925 7.168 -15.445 428 HB3 PHE 53 2HB PHE 53 -23.787 5.950 -16.378 429 HD1 PHE 53 HD1 PHE 53 -23.971 6.127 -18.790 430 HD2 PHE 53 HD2 PHE 53 -21.829 9.021 -16.520 431 HE1 PHE 53 HE1 PHE 53 -22.917 6.959 -20.852 432 HE2 PHE 53 HE2 PHE 53 -20.772 9.858 -18.579 433 HZ PHE 53 HZ PHE 53 -21.316 8.828 -20.748 434 H ALA 54 H ALA 54 -26.224 9.232 -17.483 435 HA ALA 54 HA ALA 54 -27.824 9.046 -19.091 436 HB1 ALA 54 1HB ALA 54 -27.176 6.199 -19.619 437 HB2 ALA 54 2HB ALA 54 -27.427 7.534 -20.745 438 HB3 ALA 54 3HB ALA 54 -25.902 7.393 -19.871 439 H GLY 55 H GLY 55 -28.595 8.497 -16.412 440 HA2 GLY 55 1HA GLY 55 -30.519 7.828 -15.337 441 HA3 GLY 55 2HA GLY 55 -31.124 7.269 -16.889 442 H LYS 56 H LYS 56 -28.076 6.057 -15.853 443 HA LYS 56 HA LYS 56 -29.340 3.568 -14.922 444 HB2 LYS 56 1HB LYS 56 -28.566 3.343 -17.273 445 HB3 LYS 56 2HB LYS 56 -26.935 3.737 -16.748 446 HG2 LYS 56 1HG LYS 56 -26.852 1.448 -16.829 447 HG3 LYS 56 2HG LYS 56 -27.263 1.720 -15.134 448 HD2 LYS 56 1HD LYS 56 -29.721 1.559 -16.004 449 HD3 LYS 56 2HD LYS 56 -28.979 0.724 -17.370 450 HE2 LYS 56 1HE LYS 56 -29.412 -1.050 -15.988 451 HE3 LYS 56 2HE LYS 56 -27.779 -0.636 -15.468 452 HZ1 LYS 56 3HZ LYS 56 -28.511 0.171 -13.492 453 HZ2 LYS 56 1HZ LYS 56 -29.733 -0.969 -13.760 454 HZ3 LYS 56 2HZ LYS 56 -30.011 0.665 -14.100 455 H GLN 57 H GLN 57 -28.616 2.911 -13.009 456 HA GLN 57 HA GLN 57 -26.629 4.333 -11.589 457 HB2 GLN 57 1HB GLN 57 -27.644 1.580 -10.896 458 HB3 GLN 57 2HB GLN 57 -27.018 2.806 -9.801 459 HG2 GLN 57 1HG GLN 57 -28.972 4.229 -10.378 460 HG3 GLN 57 2HG GLN 57 -29.616 2.881 -11.313 461 HE21 GLN 57 2HE2 GLN 57 -29.412 0.735 -9.911 462 HE22 GLN 57 1HE2 GLN 57 -30.140 0.865 -8.350 463 H LEU 58 H LEU 58 -24.517 3.892 -11.156 464 HA LEU 58 HA LEU 58 -23.247 1.893 -12.864 465 HB2 LEU 58 1HB LEU 58 -21.898 3.952 -11.135 466 HB3 LEU 58 2HB LEU 58 -21.204 3.050 -12.481 467 HG LEU 58 HG LEU 58 -23.259 5.252 -12.643 468 HD11 LEU 58 1HD1 LEU 58 -20.663 5.342 -14.058 469 HD12 LEU 58 2HD1 LEU 58 -20.632 5.565 -12.309 470 HD13 LEU 58 3HD1 LEU 58 -21.601 6.639 -13.317 471 HD21 LEU 58 3HD2 LEU 58 -23.894 4.404 -14.593 472 HD22 LEU 58 1HD2 LEU 58 -22.738 3.081 -14.436 473 HD23 LEU 58 2HD2 LEU 58 -22.244 4.600 -15.185 474 H GLU 59 H GLU 59 -21.699 0.404 -12.058 475 HA GLU 59 HA GLU 59 -21.555 0.018 -9.176 476 HB2 GLU 59 1HB GLU 59 -22.256 -2.311 -9.280 477 HB3 GLU 59 2HB GLU 59 -23.541 -1.262 -9.862 478 HG2 GLU 59 1HG GLU 59 -23.217 -1.898 -12.083 479 HG3 GLU 59 2HG GLU 59 -21.625 -2.576 -11.751 480 H ASP 60 H ASP 60 -19.883 -1.462 -8.529 481 HA ASP 60 HA ASP 60 -17.489 -1.168 -9.897 482 HB2 ASP 60 1HB ASP 60 -18.224 -3.372 -7.957 483 HB3 ASP 60 2HB ASP 60 -16.589 -2.884 -8.394 484 H GLY 61 H GLY 61 -16.085 -3.061 -10.644 485 HA2 GLY 61 1HA GLY 61 -15.934 -5.162 -11.768 486 HA3 GLY 61 2HA GLY 61 -17.650 -5.056 -12.128 487 H ARG 62 H ARG 62 -17.236 -2.169 -12.923 488 HA ARG 62 HA ARG 62 -15.983 -2.677 -15.541 489 HB2 ARG 62 1HB ARG 62 -18.579 -1.371 -14.841 490 HB3 ARG 62 2HB ARG 62 -17.698 -0.805 -16.254 491 HG2 ARG 62 1HG ARG 62 -17.697 -3.125 -17.124 492 HG3 ARG 62 2HG ARG 62 -18.700 -3.598 -15.751 493 HD2 ARG 62 1HD ARG 62 -20.462 -2.126 -16.464 494 HD3 ARG 62 2HD ARG 62 -19.446 -1.464 -17.744 495 HE ARG 62 HE ARG 62 -19.589 -4.176 -18.215 496 HH11 ARG 62 1HH1 ARG 62 -21.824 -1.516 -17.986 497 HH12 ARG 62 2HH1 ARG 62 -22.961 -2.206 -19.096 498 HH21 ARG 62 1HH2 ARG 62 -21.079 -5.095 -19.678 499 HH22 ARG 62 2HH2 ARG 62 -22.537 -4.242 -20.057 500 H THR 63 H THR 63 -15.388 -0.590 -16.680 501 HA THR 63 HA THR 63 -14.196 1.256 -14.718 502 HB THR 63 HB THR 63 -12.433 0.175 -15.886 503 HG1 THR 63 HG1 THR 63 -11.691 2.027 -17.278 504 HG21 THR 63 3HG2 THR 63 -13.250 -0.855 -17.764 505 HG22 THR 63 1HG2 THR 63 -12.454 0.531 -18.508 506 HG23 THR 63 2HG2 THR 63 -14.199 0.548 -18.255 507 H LEU 64 H LEU 64 -13.962 3.503 -15.391 508 HA LEU 64 HA LEU 64 -16.331 4.686 -16.176 509 HB2 LEU 64 1HB LEU 64 -13.518 5.747 -16.363 510 HB3 LEU 64 2HB LEU 64 -14.963 6.732 -16.584 511 HG LEU 64 HG LEU 64 -14.838 5.234 -14.051 512 HD11 LEU 64 1HD1 LEU 64 -12.638 6.946 -14.921 513 HD12 LEU 64 2HD1 LEU 64 -12.728 5.802 -13.583 514 HD13 LEU 64 3HD1 LEU 64 -13.361 7.436 -13.389 515 HD21 LEU 64 3HD2 LEU 64 -15.849 7.791 -15.120 516 HD22 LEU 64 1HD2 LEU 64 -15.325 7.805 -13.436 517 HD23 LEU 64 2HD2 LEU 64 -16.573 6.675 -13.961 518 H SER 65 H SER 65 -13.520 3.835 -18.143 519 HA SER 65 HA SER 65 -14.334 5.049 -20.534 520 HB2 SER 65 1HB SER 65 -12.103 4.350 -20.512 521 HB3 SER 65 2HB SER 65 -12.509 2.750 -19.892 522 HG SER 65 HG SER 65 -12.619 3.737 -22.500 523 H GLU 66 H GLU 66 -15.212 2.004 -19.056 524 HA GLU 66 HA GLU 66 -16.486 0.919 -21.377 525 HB2 GLU 66 1HB GLU 66 -16.279 0.173 -18.500 526 HB3 GLU 66 2HB GLU 66 -17.598 -0.520 -19.433 527 HG2 GLU 66 1HG GLU 66 -14.692 -0.702 -20.189 528 HG3 GLU 66 2HG GLU 66 -15.591 -1.953 -19.332 529 H TYR 67 H TYR 67 -17.410 3.091 -18.858 530 HA TYR 67 HA TYR 67 -20.254 2.782 -19.399 531 HB2 TYR 67 1HB TYR 67 -18.698 4.457 -17.432 532 HB3 TYR 67 2HB TYR 67 -20.436 4.626 -17.649 533 HD1 TYR 67 HD1 TYR 67 -21.871 2.518 -17.307 534 HD2 TYR 67 HD2 TYR 67 -17.844 2.849 -15.972 535 HE1 TYR 67 HE1 TYR 67 -22.251 0.675 -15.723 536 HE2 TYR 67 HE2 TYR 67 -18.213 1.006 -14.385 537 HH TYR 67 HH TYR 67 -21.319 -0.702 -14.241 538 H ASN 68 H ASN 68 -18.010 4.063 -21.170 539 HA ASN 68 HA ASN 68 -17.890 5.697 -22.746 540 HB2 ASN 68 1HB ASN 68 -20.817 6.209 -22.210 541 HB3 ASN 68 2HB ASN 68 -19.926 6.504 -23.700 542 HD21 ASN 68 2HD2 ASN 68 -19.180 4.669 -24.903 543 HD22 ASN 68 1HD2 ASN 68 -20.037 3.172 -24.809 544 H ILE 69 H ILE 69 -17.743 6.289 -19.762 545 HA ILE 69 HA ILE 69 -18.644 8.981 -19.443 546 HB ILE 69 HB ILE 69 -16.622 7.424 -17.827 547 HG12 ILE 69 1HG1 ILE 69 -19.542 7.970 -17.256 548 HG13 ILE 69 2HG1 ILE 69 -18.929 6.458 -17.917 549 HG21 ILE 69 1HG2 ILE 69 -17.389 10.184 -17.758 550 HG22 ILE 69 2HG2 ILE 69 -17.883 9.386 -16.265 551 HG23 ILE 69 3HG2 ILE 69 -16.196 9.333 -16.777 552 HD11 ILE 69 3HD1 ILE 69 -18.418 7.631 -15.202 553 HD12 ILE 69 1HD1 ILE 69 -19.238 6.122 -15.604 554 HD13 ILE 69 2HD1 ILE 69 -17.499 6.277 -15.856 555 H GLN 70 H GLN 70 -17.804 10.538 -20.683 556 HA GLN 70 HA GLN 70 -14.998 10.479 -21.436 557 HB2 GLN 70 1HB GLN 70 -17.028 12.603 -22.117 558 HB3 GLN 70 2HB GLN 70 -15.512 12.262 -22.939 559 HG2 GLN 70 1HG GLN 70 -16.439 10.049 -23.592 560 HG3 GLN 70 2HG GLN 70 -17.983 10.549 -22.904 561 HE21 GLN 70 2HE2 GLN 70 -16.829 9.982 -25.707 562 HE22 GLN 70 1HE2 GLN 70 -17.433 11.297 -26.650 563 H LYS 71 H LYS 71 -14.314 13.105 -21.577 564 HA LYS 71 HA LYS 71 -13.673 13.687 -18.846 565 HB2 LYS 71 1HB LYS 71 -11.912 14.337 -20.136 566 HB3 LYS 71 2HB LYS 71 -12.931 14.751 -21.508 567 HG2 LYS 71 1HG LYS 71 -13.564 16.834 -20.450 568 HG3 LYS 71 2HG LYS 71 -12.626 16.413 -19.015 569 HD2 LYS 71 1HD LYS 71 -10.595 16.699 -20.103 570 HD3 LYS 71 2HD LYS 71 -11.313 16.503 -21.704 571 HE2 LYS 71 1HE LYS 71 -11.882 18.838 -19.887 572 HE3 LYS 71 2HE LYS 71 -10.622 18.845 -21.119 573 HZ1 LYS 71 3HZ LYS 71 -12.906 17.985 -22.394 574 HZ2 LYS 71 1HZ LYS 71 -12.172 19.503 -22.538 575 HZ3 LYS 71 2HZ LYS 71 -13.412 19.267 -21.413 576 H GLU 72 H GLU 72 -16.108 14.694 -21.073 577 HA GLU 72 HA GLU 72 -16.911 16.867 -19.257 578 HB2 GLU 72 1HB GLU 72 -17.627 16.414 -22.159 579 HB3 GLU 72 2HB GLU 72 -18.237 17.730 -21.165 580 HG2 GLU 72 1HG GLU 72 -15.742 18.296 -20.804 581 HG3 GLU 72 2HG GLU 72 -15.481 17.289 -22.227 582 H SER 73 H SER 73 -17.437 13.919 -19.047 583 HA SER 73 HA SER 73 -20.195 13.493 -19.619 584 HB2 SER 73 1HB SER 73 -18.020 12.008 -18.277 585 HB3 SER 73 2HB SER 73 -19.649 11.635 -17.712 586 HG SER 73 HG SER 73 -20.087 11.493 -20.117 587 H THR 74 H THR 74 -21.943 13.370 -18.174 588 HA THR 74 HA THR 74 -21.646 15.106 -15.824 589 HB THR 74 HB THR 74 -24.353 14.312 -16.744 590 HG1 THR 74 HG1 THR 74 -24.238 15.329 -18.620 591 HG21 THR 74 3HG2 THR 74 -23.008 16.745 -15.625 592 HG22 THR 74 1HG2 THR 74 -24.385 15.844 -14.993 593 HG23 THR 74 2HG2 THR 74 -24.581 16.876 -16.409 594 H LEU 75 H LEU 75 -21.408 14.067 -13.961 595 HA LEU 75 HA LEU 75 -22.711 11.458 -13.607 596 HB2 LEU 75 1HB LEU 75 -20.209 12.665 -12.649 597 HB3 LEU 75 2HB LEU 75 -21.093 11.730 -11.445 598 HG LEU 75 HG LEU 75 -19.379 10.388 -12.547 599 HD11 LEU 75 1HD1 LEU 75 -22.231 9.763 -12.584 600 HD12 LEU 75 2HD1 LEU 75 -20.869 8.826 -11.971 601 HD13 LEU 75 3HD1 LEU 75 -21.270 8.778 -13.688 602 HD21 LEU 75 3HD2 LEU 75 -19.621 9.798 -14.922 603 HD22 LEU 75 1HD2 LEU 75 -19.296 11.516 -14.690 604 HD23 LEU 75 2HD2 LEU 75 -20.931 10.972 -15.067 605 H HIS 76 H HIS 76 -23.864 10.997 -11.690 606 HA HIS 76 HA HIS 76 -24.624 13.318 -10.058 607 HB2 HIS 76 1HB HIS 76 -26.400 11.548 -11.671 608 HB3 HIS 76 2HB HIS 76 -26.988 12.102 -10.106 609 HD1 HIS 76 HD1 HIS 76 -26.891 13.061 -13.559 610 HD2 HIS 76 HD2 HIS 76 -26.835 15.084 -9.931 611 HE1 HIS 76 HE1 HIS 76 -27.552 15.427 -14.098 612 H LEU 77 H LEU 77 -24.618 12.923 -7.934 613 HA LEU 77 HA LEU 77 -24.160 10.173 -7.052 614 HB2 LEU 77 1HB LEU 77 -24.062 12.461 -5.165 615 HB3 LEU 77 2HB LEU 77 -23.061 11.013 -5.236 616 HG LEU 77 HG LEU 77 -22.826 13.348 -7.132 617 HD11 LEU 77 1HD1 LEU 77 -20.531 13.233 -5.623 618 HD12 LEU 77 2HD1 LEU 77 -21.804 12.933 -4.440 619 HD13 LEU 77 3HD1 LEU 77 -21.843 14.394 -5.427 620 HD21 LEU 77 3HD2 LEU 77 -20.531 12.177 -7.432 621 HD22 LEU 77 1HD2 LEU 77 -21.947 11.533 -8.264 622 HD23 LEU 77 2HD2 LEU 77 -21.364 10.761 -6.789 623 H VAL 78 H VAL 78 -25.856 9.035 -6.410 624 HA VAL 78 HA VAL 78 -28.107 10.447 -5.134 625 HB VAL 78 HB VAL 78 -29.429 8.370 -5.770 626 HG11 VAL 78 1HG1 VAL 78 -29.381 9.139 -8.299 627 HG12 VAL 78 2HG1 VAL 78 -30.045 10.172 -7.032 628 HG13 VAL 78 3HG1 VAL 78 -28.409 10.451 -7.632 629 HG21 VAL 78 3HG2 VAL 78 -27.293 7.061 -6.247 630 HG22 VAL 78 1HG2 VAL 78 -28.612 6.895 -7.406 631 HG23 VAL 78 2HG2 VAL 78 -27.236 7.934 -7.778 632 H LEU 79 H LEU 79 -28.776 9.841 -3.147 633 HA LEU 79 HA LEU 79 -27.122 7.918 -1.717 634 HB2 LEU 79 1HB LEU 79 -29.005 10.092 -0.949 635 HB3 LEU 79 2HB LEU 79 -28.705 8.791 0.202 636 HG LEU 79 HG LEU 79 -26.364 9.342 0.292 637 HD11 LEU 79 1HD1 LEU 79 -26.971 11.451 -1.775 638 HD12 LEU 79 2HD1 LEU 79 -26.047 9.974 -2.042 639 HD13 LEU 79 3HD1 LEU 79 -25.427 11.217 -0.956 640 HD21 LEU 79 3HD2 LEU 79 -26.526 11.709 1.120 641 HD22 LEU 79 1HD2 LEU 79 -27.692 10.586 1.820 642 HD23 LEU 79 2HD2 LEU 79 -28.200 11.714 0.563 643 H ARG 80 H ARG 80 -27.790 5.978 -0.994 644 HA ARG 80 HA ARG 80 -30.530 5.168 -1.681 645 HB2 ARG 80 1HB ARG 80 -28.712 3.889 -2.749 646 HB3 ARG 80 2HB ARG 80 -28.095 3.454 -1.161 647 HG2 ARG 80 1HG ARG 80 -29.308 1.590 -1.930 648 HG3 ARG 80 2HG ARG 80 -30.331 2.372 -0.723 649 HD2 ARG 80 1HD ARG 80 -31.742 1.820 -2.542 650 HD3 ARG 80 2HD ARG 80 -31.471 3.560 -2.631 651 HE ARG 80 HE ARG 80 -30.371 3.259 -4.621 652 HH11 ARG 80 1HH1 ARG 80 -30.768 0.183 -3.040 653 HH12 ARG 80 2HH1 ARG 80 -30.229 -0.736 -4.407 654 HH21 ARG 80 1HH2 ARG 80 -29.660 2.061 -6.427 655 HH22 ARG 80 2HH2 ARG 80 -29.598 0.333 -6.332 656 H LEU 81 H LEU 81 -28.304 5.570 0.934 657 HA LEU 81 HA LEU 81 -30.376 4.629 2.798 658 HB2 LEU 81 1HB LEU 81 -27.510 3.895 2.641 659 HB3 LEU 81 2HB LEU 81 -28.188 4.145 4.248 660 HG LEU 81 HG LEU 81 -28.191 1.783 3.600 661 HD11 LEU 81 1HD1 LEU 81 -29.908 2.648 5.124 662 HD12 LEU 81 2HD1 LEU 81 -30.504 1.304 4.149 663 HD13 LEU 81 3HD1 LEU 81 -30.964 2.958 3.745 664 HD21 LEU 81 3HD2 LEU 81 -28.768 2.634 1.097 665 HD22 LEU 81 1HD2 LEU 81 -30.361 2.112 1.644 666 HD23 LEU 81 2HD2 LEU 81 -29.008 0.981 1.664 667 H ARG 82 H ARG 82 -29.669 5.396 5.138 668 HA ARG 82 HA ARG 82 -29.318 8.290 4.913 669 HB2 ARG 82 1HB ARG 82 -31.268 7.640 6.140 670 HB3 ARG 82 2HB ARG 82 -30.342 6.525 7.136 671 HG2 ARG 82 1HG ARG 82 -30.917 8.540 8.367 672 HG3 ARG 82 2HG ARG 82 -29.169 8.398 8.162 673 HD2 ARG 82 1HD ARG 82 -29.330 9.943 6.223 674 HD3 ARG 82 2HD ARG 82 -31.044 10.151 6.580 675 HE ARG 82 HE ARG 82 -29.578 10.726 8.894 676 HH11 ARG 82 1HH1 ARG 82 -30.112 12.005 5.700 677 HH12 ARG 82 2HH1 ARG 82 -29.819 13.647 6.167 678 HH21 ARG 82 1HH2 ARG 82 -29.191 12.884 9.521 679 HH22 ARG 82 2HH2 ARG 82 -29.295 14.146 8.341 680 H GLY 83 H GLY 83 -27.222 8.857 4.935 681 HA2 GLY 83 1HA GLY 83 -25.313 7.421 6.589 682 HA3 GLY 83 2HA GLY 83 -24.952 8.725 5.468 683 H TYR 84 H TYR 84 -24.156 8.250 8.302 684 HA TYR 84 HA TYR 84 -24.799 10.930 9.259 685 HB2 TYR 84 1HB TYR 84 -25.489 10.229 11.430 686 HB3 TYR 84 2HB TYR 84 -26.434 9.292 10.278 687 HD1 TYR 84 HD2 TYR 84 -25.999 6.899 9.967 688 HD2 TYR 84 HD1 TYR 84 -23.866 9.171 12.863 689 HE1 TYR 84 HE2 TYR 84 -25.259 4.817 11.047 690 HE2 TYR 84 HE1 TYR 84 -23.118 7.095 13.950 691 HH TYR 84 HH TYR 84 -23.174 4.171 12.561 692 H ALA 85 H ALA 85 -23.506 11.282 11.421 693 HA ALA 85 HA ALA 85 -21.428 11.648 12.286 694 HB1 ALA 85 1HB ALA 85 -21.662 9.509 13.252 695 HB2 ALA 85 2HB ALA 85 -21.330 8.697 11.721 696 HB3 ALA 85 3HB ALA 85 -20.038 9.551 12.565 697 H ASP 86 H ASP 86 -21.615 12.477 9.667 698 HA ASP 86 HA ASP 86 -19.510 11.454 8.039 699 HB2 ASP 86 1HB ASP 86 -21.564 12.719 7.239 700 HB3 ASP 86 2HB ASP 86 -20.774 14.186 7.813 701 H LEU 87 H LEU 87 -17.654 12.774 7.309 702 HA LEU 87 HA LEU 87 -16.561 14.404 9.507 703 HB2 LEU 87 1HB LEU 87 -14.965 12.643 7.659 704 HB3 LEU 87 2HB LEU 87 -14.382 13.514 9.076 705 HG LEU 87 HG LEU 87 -16.455 11.366 9.347 706 HD11 LEU 87 1HD1 LEU 87 -14.781 9.698 9.597 707 HD12 LEU 87 2HD1 LEU 87 -13.486 10.884 9.444 708 HD13 LEU 87 3HD1 LEU 87 -14.494 10.496 8.050 709 HD21 LEU 87 3HD2 LEU 87 -14.599 12.871 11.110 710 HD22 LEU 87 1HD2 LEU 87 -14.958 11.195 11.527 711 HD23 LEU 87 2HD2 LEU 87 -16.268 12.368 11.385 712 H ARG 88 H ARG 88 -14.500 15.622 8.600 713 HA ARG 88 HA ARG 88 -14.830 16.554 5.878 714 HB2 ARG 88 1HB ARG 88 -16.445 17.923 7.164 715 HB3 ARG 88 2HB ARG 88 -15.131 18.471 8.196 716 HG2 ARG 88 1HG ARG 88 -14.243 19.830 6.584 717 HG3 ARG 88 2HG ARG 88 -14.897 18.866 5.258 718 HD2 ARG 88 1HD ARG 88 -16.019 21.043 5.471 719 HD3 ARG 88 2HD ARG 88 -17.126 19.692 5.714 720 HE ARG 88 HE ARG 88 -16.135 20.508 8.206 721 HH11 ARG 88 1HH1 ARG 88 -18.213 21.646 5.656 722 HH12 ARG 88 2HH1 ARG 88 -19.192 22.614 6.708 723 HH21 ARG 88 1HH2 ARG 88 -17.416 21.779 9.602 724 HH22 ARG 88 2HH2 ARG 88 -18.737 22.689 8.952 725 H GLU 89 H GLU 89 -12.922 17.109 5.014 726 HA GLU 89 HA GLU 89 -10.744 18.006 6.731 727 HB2 GLU 89 1HB GLU 89 -9.176 16.350 5.793 728 HB3 GLU 89 2HB GLU 89 -10.460 15.595 6.727 729 HG2 GLU 89 1HG GLU 89 -11.649 15.147 4.576 730 HG3 GLU 89 2HG GLU 89 -10.209 15.718 3.734 731 H ASP 90 H ASP 90 -9.782 19.679 5.803 732 HA ASP 90 HA ASP 90 -9.018 21.154 4.248 733 HB2 ASP 90 1HB ASP 90 -8.620 18.541 3.073 734 HB3 ASP 90 2HB ASP 90 -8.959 19.739 1.828 735 HA PRO 91 HA PRO 91 -12.472 22.837 2.135 736 HB2 PRO 91 1HB PRO 91 -11.307 24.208 0.101 737 HB3 PRO 91 2HB PRO 91 -11.218 24.731 1.787 738 HG2 PRO 91 1HG PRO 91 -9.194 23.249 0.154 739 HG3 PRO 91 2HG PRO 91 -8.952 24.594 1.284 740 HD2 PRO 91 1HD PRO 91 -8.460 22.017 1.958 741 HD3 PRO 91 2HD PRO 91 -9.033 23.219 3.133 742 H ASP 92 H ASP 92 -13.295 23.220 -0.254 743 HA ASP 92 HA ASP 92 -12.991 20.652 -1.663 744 HB2 ASP 92 1HB ASP 92 -15.337 22.518 -1.375 745 HB3 ASP 92 2HB ASP 92 -15.274 21.306 -2.651 746 H ARG 93 H ARG 93 -11.337 23.089 -1.966 747 HA ARG 93 HA ARG 93 -12.032 23.915 -4.693 748 HB2 ARG 93 1HB ARG 93 -10.177 25.067 -2.616 749 HB3 ARG 93 2HB ARG 93 -10.148 25.596 -4.293 750 HG2 ARG 93 1HG ARG 93 -11.554 27.155 -3.433 751 HG3 ARG 93 2HG ARG 93 -12.734 25.916 -3.865 752 HD2 ARG 93 1HD ARG 93 -13.339 26.483 -1.696 753 HD3 ARG 93 2HD ARG 93 -12.353 25.039 -1.471 754 HE ARG 93 HE ARG 93 -10.786 26.313 -0.382 755 HH11 ARG 93 1HH1 ARG 93 -13.032 28.399 -2.032 756 HH12 ARG 93 2HH1 ARG 93 -12.432 29.847 -1.294 757 HH21 ARG 93 1HH2 ARG 93 -9.987 28.212 0.597 758 HH22 ARG 93 2HH2 ARG 93 -10.699 29.739 0.201 759 H GLN 94 H GLN 94 -10.938 23.184 -6.398 760 HA GLN 94 HA GLN 94 -8.405 21.760 -5.912 761 HB2 GLN 94 1HB GLN 94 -10.541 20.501 -6.752 762 HB3 GLN 94 2HB GLN 94 -10.126 21.218 -8.303 763 HG2 GLN 94 1HG GLN 94 -9.220 18.998 -8.167 764 HG3 GLN 94 2HG GLN 94 -7.906 20.174 -8.169 765 HE21 GLN 94 2HE2 GLN 94 -9.711 17.891 -6.254 766 HE22 GLN 94 1HE2 GLN 94 -8.573 17.773 -4.960 767 H ASP 95 H ASP 95 -6.712 22.849 -6.636 768 HA ASP 95 HA ASP 95 -7.025 24.859 -8.708 769 HB2 ASP 95 1HB ASP 95 -5.663 25.615 -6.952 770 HB3 ASP 95 2HB ASP 95 -4.791 24.088 -6.849 771 H HIS 96 H HIS 96 -6.511 24.598 -10.783 772 HA HIS 96 HA HIS 96 -4.473 22.782 -11.657 773 HB2 HIS 96 1HB HIS 96 -6.583 21.360 -11.244 774 HB3 HIS 96 2HB HIS 96 -7.243 22.166 -12.664 775 HD1 HIS 96 HD1 HIS 96 -3.936 20.423 -11.899 776 HD2 HIS 96 HD2 HIS 96 -6.877 20.609 -14.828 777 HE1 HIS 96 HE1 HIS 96 -3.191 18.835 -13.702 778 H HIS 97 H HIS 97 -4.024 22.964 -13.927 779 HA HIS 97 HA HIS 97 -5.230 25.354 -15.159 780 HB2 HIS 97 1HB HIS 97 -2.840 25.609 -14.372 781 HB3 HIS 97 2HB HIS 97 -2.392 24.410 -15.581 782 HD1 HIS 97 HD1 HIS 97 -4.878 27.194 -16.152 783 HD2 HIS 97 HD2 HIS 97 -1.039 26.083 -17.287 784 HE1 HIS 97 HE1 HIS 97 -4.221 28.805 -17.968 785 HA PRO 98 HA PRO 98 -5.884 21.635 -17.899 786 HB2 PRO 98 1HB PRO 98 -8.534 22.077 -18.292 787 HB3 PRO 98 2HB PRO 98 -7.908 21.139 -16.930 788 HG2 PRO 98 1HG PRO 98 -8.796 23.997 -17.013 789 HG3 PRO 98 2HG PRO 98 -9.118 22.760 -15.783 790 HD2 PRO 98 1HD PRO 98 -7.214 24.660 -15.475 791 HD3 PRO 98 2HD PRO 98 -7.055 23.029 -14.792 792 H GLY 99 H GLY 99 -5.921 21.699 -20.110 793 HA2 GLY 99 1HA GLY 99 -5.328 24.047 -21.462 794 HA3 GLY 99 2HA GLY 99 -5.909 22.577 -22.231 795 H SER 100 H SER 100 -6.476 25.340 -22.937 796 HA SER 100 HA SER 100 -9.401 25.301 -22.583 797 HB2 SER 100 1HB SER 100 -8.426 27.176 -21.340 798 HB3 SER 100 2HB SER 100 -7.606 27.731 -22.799 799 HG SER 100 HG SER 100 -10.065 28.299 -21.988 800 H GLY 101 H GLY 101 -10.530 26.599 -24.347 801 HA2 GLY 101 1HA GLY 101 -9.118 26.363 -26.920 802 HA3 GLY 101 2HA GLY 101 -10.684 25.592 -26.714 803 H ALA 102 H ALA 102 -9.518 27.950 -28.347 804 HA ALA 102 HA ALA 102 -11.070 30.208 -27.477 805 HB1 ALA 102 1HB ALA 102 -9.686 29.784 -30.121 806 HB2 ALA 102 2HB ALA 102 -10.241 31.317 -29.447 807 HB3 ALA 102 3HB ALA 102 -8.918 30.441 -28.676 808 H GLN 103 H GLN 103 -13.124 28.972 -27.406 809 HA GLN 103 HA GLN 103 -14.334 28.498 -30.027 810 HB2 GLN 103 1HB GLN 103 -14.465 26.863 -28.025 811 HB3 GLN 103 2HB GLN 103 -15.670 27.975 -27.388 812 HG2 GLN 103 1HG GLN 103 -17.180 27.516 -29.079 813 HG3 GLN 103 2HG GLN 103 -15.933 26.895 -30.160 814 HE21 GLN 103 2HE2 GLN 103 -18.233 25.493 -29.777 815 HE22 GLN 103 1HE2 GLN 103 -17.906 24.054 -28.878 Start of MODEL 17 1 H1 GLY 1 H GLY 1 9.684 1.960 -3.435 2 HA2 GLY 1 1HA GLY 1 9.181 3.199 -1.390 3 HA3 GLY 1 2HA GLY 1 9.586 4.670 -2.263 4 H SER 2 H SER 2 8.166 5.282 -4.063 5 HA SER 2 HA SER 2 5.391 4.436 -3.540 6 HB2 SER 2 1HB SER 2 6.402 7.113 -4.533 7 HB3 SER 2 2HB SER 2 4.707 6.684 -4.302 8 HG SER 2 HG SER 2 6.530 7.512 -2.484 9 H LEU 3 H LEU 3 3.921 4.501 -5.378 10 HA LEU 3 HA LEU 3 5.287 4.080 -7.953 11 HB2 LEU 3 1HB LEU 3 3.281 2.407 -6.534 12 HB3 LEU 3 2HB LEU 3 3.190 2.499 -8.292 13 HG LEU 3 HG LEU 3 5.749 1.867 -8.109 14 HD11 LEU 3 1HD1 LEU 3 5.787 0.077 -6.203 15 HD12 LEU 3 2HD1 LEU 3 4.590 1.138 -5.462 16 HD13 LEU 3 3HD1 LEU 3 6.191 1.759 -5.860 17 HD21 LEU 3 3HD2 LEU 3 5.137 -0.179 -8.869 18 HD22 LEU 3 1HD2 LEU 3 3.555 0.598 -8.947 19 HD23 LEU 3 2HD2 LEU 3 3.964 -0.433 -7.575 20 H VAL 4 H VAL 4 4.413 5.048 -9.705 21 HA VAL 4 HA VAL 4 1.845 6.450 -9.339 22 HB VAL 4 HB VAL 4 3.652 8.076 -9.327 23 HG11 VAL 4 1HG1 VAL 4 5.145 8.360 -11.223 24 HG12 VAL 4 2HG1 VAL 4 5.310 6.737 -10.550 25 HG13 VAL 4 3HG1 VAL 4 4.398 6.987 -12.040 26 HG21 VAL 4 3HG2 VAL 4 2.039 8.055 -11.874 27 HG22 VAL 4 1HG2 VAL 4 1.601 8.800 -10.336 28 HG23 VAL 4 2HG2 VAL 4 2.941 9.449 -11.281 29 HA PRO 5 HA PRO 5 0.566 4.143 -12.890 30 HB2 PRO 5 1HB PRO 5 -1.710 5.530 -13.405 31 HB3 PRO 5 2HB PRO 5 -1.567 4.379 -12.071 32 HG2 PRO 5 1HG PRO 5 -1.360 7.365 -12.026 33 HG3 PRO 5 2HG PRO 5 -2.198 6.284 -10.896 34 HD2 PRO 5 1HD PRO 5 0.233 7.351 -10.361 35 HD3 PRO 5 2HD PRO 5 -0.257 5.749 -9.773 36 H ARG 6 H ARG 6 -0.530 4.861 -15.118 37 HA ARG 6 HA ARG 6 1.015 7.135 -16.175 38 HB2 ARG 6 1HB ARG 6 0.736 4.347 -17.236 39 HB3 ARG 6 2HB ARG 6 0.993 5.681 -18.351 40 HG2 ARG 6 1HG ARG 6 2.809 5.384 -16.010 41 HG3 ARG 6 2HG ARG 6 3.010 4.320 -17.404 42 HD2 ARG 6 1HD ARG 6 4.401 6.063 -17.967 43 HD3 ARG 6 2HD ARG 6 2.902 6.551 -18.756 44 HE ARG 6 HE ARG 6 3.172 7.585 -16.094 45 HH11 ARG 6 1HH1 ARG 6 3.990 8.082 -19.441 46 HH12 ARG 6 2HH1 ARG 6 4.196 9.794 -19.272 47 HH21 ARG 6 1HH2 ARG 6 3.441 9.838 -15.858 48 HH22 ARG 6 2HH2 ARG 6 3.884 10.792 -17.233 49 H GLY 7 H GLY 7 -0.676 8.577 -16.230 50 HA2 GLY 7 1HA GLY 7 -2.175 9.304 -18.140 51 HA3 GLY 7 2HA GLY 7 -3.018 7.791 -17.846 52 H SER 8 H SER 8 -4.406 10.140 -17.789 53 HA SER 8 HA SER 8 -5.680 10.038 -15.289 54 HB2 SER 8 1HB SER 8 -5.102 12.305 -14.439 55 HB3 SER 8 2HB SER 8 -3.727 11.200 -14.429 56 HG SER 8 HG SER 8 -4.280 13.164 -16.404 57 H MET 9 H MET 9 -7.692 10.837 -15.488 58 HA MET 9 HA MET 9 -8.226 12.846 -17.553 59 HB2 MET 9 1HB MET 9 -8.737 10.824 -18.698 60 HB3 MET 9 2HB MET 9 -9.567 10.158 -17.298 61 HG2 MET 9 1HG MET 9 -11.427 11.538 -17.598 62 HG3 MET 9 2HG MET 9 -10.555 12.627 -18.674 63 HE1 MET 9 3HE MET 9 -9.786 12.185 -20.854 64 HE2 MET 9 1HE MET 9 -9.278 10.509 -21.066 65 HE3 MET 9 2HE MET 9 -10.603 11.157 -22.033 66 H GLN 10 H GLN 10 -9.706 14.342 -16.980 67 HA GLN 10 HA GLN 10 -10.856 14.110 -14.304 68 HB2 GLN 10 1HB GLN 10 -11.255 16.513 -14.466 69 HB3 GLN 10 2HB GLN 10 -9.576 16.136 -14.828 70 HG2 GLN 10 1HG GLN 10 -11.227 16.161 -17.209 71 HG3 GLN 10 2HG GLN 10 -11.280 17.693 -16.338 72 HE21 GLN 10 2HE2 GLN 10 -10.203 18.585 -18.186 73 HE22 GLN 10 1HE2 GLN 10 -8.492 18.420 -18.352 74 H ILE 11 H ILE 11 -13.038 14.303 -13.872 75 HA ILE 11 HA ILE 11 -14.841 14.297 -16.200 76 HB ILE 11 HB ILE 11 -16.260 12.638 -15.102 77 HG12 ILE 11 1HG1 ILE 11 -14.047 12.461 -13.045 78 HG13 ILE 11 2HG1 ILE 11 -15.635 13.169 -12.771 79 HG21 ILE 11 1HG2 ILE 11 -14.729 10.683 -15.320 80 HG22 ILE 11 2HG2 ILE 11 -14.668 11.803 -16.680 81 HG23 ILE 11 3HG2 ILE 11 -13.386 11.816 -15.469 82 HD11 ILE 11 3HD1 ILE 11 -16.403 11.188 -12.181 83 HD12 ILE 11 1HD1 ILE 11 -16.023 10.558 -13.784 84 HD13 ILE 11 2HD1 ILE 11 -14.822 10.472 -12.495 85 H PHE 12 H PHE 12 -17.133 14.767 -15.583 86 HA PHE 12 HA PHE 12 -17.191 16.783 -13.438 87 HB2 PHE 12 1HB PHE 12 -18.773 16.624 -16.009 88 HB3 PHE 12 2HB PHE 12 -19.083 17.798 -14.735 89 HD1 PHE 12 HD2 PHE 12 -16.452 18.662 -13.927 90 HD2 PHE 12 HD1 PHE 12 -17.922 17.760 -17.819 91 HE1 PHE 12 HE2 PHE 12 -14.772 20.169 -14.908 92 HE2 PHE 12 HE1 PHE 12 -16.244 19.265 -18.805 93 HZ PHE 12 HZ PHE 12 -14.667 20.473 -17.349 94 H VAL 13 H VAL 13 -18.531 16.482 -11.779 95 HA VAL 13 HA VAL 13 -20.736 14.552 -12.085 96 HB VAL 13 HB VAL 13 -19.016 14.853 -9.619 97 HG11 VAL 13 1HG1 VAL 13 -20.222 12.788 -8.909 98 HG12 VAL 13 2HG1 VAL 13 -21.250 14.218 -9.031 99 HG13 VAL 13 3HG1 VAL 13 -21.287 12.992 -10.299 100 HG21 VAL 13 3HG2 VAL 13 -17.560 13.524 -10.657 101 HG22 VAL 13 1HG2 VAL 13 -18.786 12.258 -10.589 102 HG23 VAL 13 2HG2 VAL 13 -18.653 13.281 -12.020 103 H LYS 14 H LYS 14 -22.662 15.110 -11.197 104 HA LYS 14 HA LYS 14 -22.850 17.814 -10.084 105 HB2 LYS 14 1HB LYS 14 -24.709 16.020 -11.567 106 HB3 LYS 14 2HB LYS 14 -25.410 17.173 -10.440 107 HG2 LYS 14 1HG LYS 14 -25.431 18.270 -12.496 108 HG3 LYS 14 2HG LYS 14 -24.032 18.941 -11.654 109 HD2 LYS 14 1HD LYS 14 -22.532 17.561 -12.913 110 HD3 LYS 14 2HD LYS 14 -23.876 16.666 -13.628 111 HE2 LYS 14 1HE LYS 14 -22.856 18.369 -15.139 112 HE3 LYS 14 2HE LYS 14 -24.584 18.585 -14.865 113 HZ1 LYS 14 3HZ LYS 14 -22.731 20.520 -14.607 114 HZ2 LYS 14 1HZ LYS 14 -22.907 20.010 -13.003 115 HZ3 LYS 14 2HZ LYS 14 -24.255 20.545 -13.873 116 H THR 15 H THR 15 -23.606 18.233 -8.074 117 HA THR 15 HA THR 15 -23.968 15.931 -6.304 118 HB THR 15 HB THR 15 -23.690 17.533 -4.456 119 HG1 THR 15 HG1 THR 15 -22.944 19.550 -6.261 120 HG21 THR 15 3HG2 THR 15 -21.689 17.045 -6.536 121 HG22 THR 15 1HG2 THR 15 -21.578 16.840 -4.789 122 HG23 THR 15 2HG2 THR 15 -21.326 18.430 -5.508 123 H LEU 16 H LEU 16 -25.609 16.159 -4.544 124 HA LEU 16 HA LEU 16 -28.179 16.537 -5.656 125 HB2 LEU 16 1HB LEU 16 -29.033 15.941 -3.521 126 HB3 LEU 16 2HB LEU 16 -27.602 14.956 -3.819 127 HG LEU 16 HG LEU 16 -26.449 16.899 -2.415 128 HD11 LEU 16 1HD1 LEU 16 -28.439 17.044 -0.517 129 HD12 LEU 16 2HD1 LEU 16 -29.301 17.305 -2.033 130 HD13 LEU 16 3HD1 LEU 16 -27.940 18.341 -1.603 131 HD21 LEU 16 3HD2 LEU 16 -28.042 14.693 -1.117 132 HD22 LEU 16 1HD2 LEU 16 -26.588 15.472 -0.491 133 HD23 LEU 16 2HD2 LEU 16 -26.495 14.462 -1.934 134 H THR 17 H THR 17 -26.078 18.570 -3.742 135 HA THR 17 HA THR 17 -28.028 20.496 -2.997 136 HB THR 17 HB THR 17 -25.936 20.359 -1.776 137 HG1 THR 17 HG1 THR 17 -26.041 22.823 -3.206 138 HG21 THR 17 3HG2 THR 17 -23.843 21.242 -2.869 139 HG22 THR 17 1HG2 THR 17 -24.683 21.112 -4.413 140 HG23 THR 17 2HG2 THR 17 -24.385 19.667 -3.447 141 H GLY 18 H GLY 18 -26.229 19.919 -5.894 142 HA2 GLY 18 1HA GLY 18 -27.061 20.885 -7.953 143 HA3 GLY 18 2HA GLY 18 -27.426 22.352 -7.056 144 H LYS 19 H LYS 19 -24.438 20.807 -6.359 145 HA LYS 19 HA LYS 19 -23.030 22.952 -7.796 146 HB2 LYS 19 1HB LYS 19 -22.606 23.072 -5.447 147 HB3 LYS 19 2HB LYS 19 -22.284 21.345 -5.353 148 HG2 LYS 19 1HG LYS 19 -20.552 22.892 -7.171 149 HG3 LYS 19 2HG LYS 19 -20.365 23.211 -5.445 150 HD2 LYS 19 1HD LYS 19 -20.450 20.389 -6.423 151 HD3 LYS 19 2HD LYS 19 -18.965 21.327 -6.599 152 HE2 LYS 19 1HE LYS 19 -19.553 21.874 -4.034 153 HE3 LYS 19 2HE LYS 19 -20.276 20.272 -4.170 154 HZ1 LYS 19 3HZ LYS 19 -18.258 19.290 -4.542 155 HZ2 LYS 19 1HZ LYS 19 -17.792 20.541 -3.501 156 HZ3 LYS 19 2HZ LYS 19 -17.547 20.692 -5.168 157 H THR 20 H THR 20 -21.338 22.502 -9.157 158 HA THR 20 HA THR 20 -21.099 19.696 -9.981 159 HB THR 20 HB THR 20 -19.941 21.980 -11.542 160 HG1 THR 20 HG1 THR 20 -21.895 22.472 -12.376 161 HG21 THR 20 3HG2 THR 20 -20.480 20.504 -13.437 162 HG22 THR 20 1HG2 THR 20 -21.152 19.322 -12.314 163 HG23 THR 20 2HG2 THR 20 -19.432 19.709 -12.263 164 H ILE 21 H ILE 21 -19.393 18.596 -9.299 165 HA ILE 21 HA ILE 21 -16.895 20.064 -8.754 166 HB ILE 21 HB ILE 21 -17.747 19.190 -6.689 167 HG12 ILE 21 1HG1 ILE 21 -15.245 18.763 -7.555 168 HG13 ILE 21 2HG1 ILE 21 -15.790 18.272 -5.955 169 HG21 ILE 21 1HG2 ILE 21 -18.093 16.720 -6.416 170 HG22 ILE 21 2HG2 ILE 21 -19.282 17.534 -7.432 171 HG23 ILE 21 3HG2 ILE 21 -17.994 16.582 -8.171 172 HD11 ILE 21 3HD1 ILE 21 -15.989 16.399 -8.274 173 HD12 ILE 21 1HD1 ILE 21 -14.475 16.599 -7.393 174 HD13 ILE 21 2HD1 ILE 21 -15.919 16.039 -6.550 175 H THR 22 H THR 22 -15.074 19.415 -9.745 176 HA THR 22 HA THR 22 -15.295 17.280 -11.715 177 HB THR 22 HB THR 22 -12.908 19.072 -11.287 178 HG1 THR 22 HG1 THR 22 -15.081 20.134 -11.700 179 HG21 THR 22 3HG2 THR 22 -12.869 16.959 -12.766 180 HG22 THR 22 1HG2 THR 22 -12.266 18.468 -13.451 181 HG23 THR 22 2HG2 THR 22 -13.880 17.892 -13.869 182 H LEU 23 H LEU 23 -14.317 15.351 -11.569 183 HA LEU 23 HA LEU 23 -12.456 14.924 -9.324 184 HB2 LEU 23 1HB LEU 23 -14.863 13.815 -9.454 185 HB3 LEU 23 2HB LEU 23 -14.000 12.657 -10.464 186 HG LEU 23 HG LEU 23 -12.416 12.297 -8.563 187 HD11 LEU 23 1HD1 LEU 23 -14.172 14.347 -7.364 188 HD12 LEU 23 2HD1 LEU 23 -12.465 14.003 -7.083 189 HD13 LEU 23 3HD1 LEU 23 -13.703 13.001 -6.325 190 HD21 LEU 23 3HD2 LEU 23 -13.890 10.564 -8.674 191 HD22 LEU 23 1HD2 LEU 23 -15.304 11.609 -8.529 192 HD23 LEU 23 2HD2 LEU 23 -14.346 11.219 -7.100 193 H GLU 24 H GLU 24 -10.594 13.793 -9.696 194 HA GLU 24 HA GLU 24 -9.932 13.330 -12.511 195 HB2 GLU 24 1HB GLU 24 -8.299 13.813 -10.040 196 HB3 GLU 24 2HB GLU 24 -7.565 13.073 -11.456 197 HG2 GLU 24 1HG GLU 24 -7.087 15.320 -11.715 198 HG3 GLU 24 2HG GLU 24 -8.499 15.085 -12.743 199 H VAL 25 H VAL 25 -10.064 11.336 -13.274 200 HA VAL 25 HA VAL 25 -9.158 9.098 -11.633 201 HB VAL 25 HB VAL 25 -11.631 9.280 -11.314 202 HG11 VAL 25 1HG1 VAL 25 -11.795 9.964 -13.884 203 HG12 VAL 25 2HG1 VAL 25 -12.093 8.232 -14.046 204 HG13 VAL 25 3HG1 VAL 25 -13.134 9.214 -13.015 205 HG21 VAL 25 3HG2 VAL 25 -10.228 7.121 -11.301 206 HG22 VAL 25 1HG2 VAL 25 -11.983 6.978 -11.391 207 HG23 VAL 25 2HG2 VAL 25 -11.006 6.780 -12.846 208 H GLU 26 H GLU 26 -8.375 7.356 -12.803 209 HA GLU 26 HA GLU 26 -7.416 7.920 -15.408 210 HB2 GLU 26 1HB GLU 26 -7.530 5.176 -14.172 211 HB3 GLU 26 2HB GLU 26 -6.362 5.800 -15.328 212 HG2 GLU 26 1HG GLU 26 -5.566 7.374 -13.572 213 HG3 GLU 26 2HG GLU 26 -6.634 6.559 -12.431 214 HA PRO 27 HA PRO 27 -10.623 6.470 -18.030 215 HB2 PRO 27 1HB PRO 27 -9.191 5.453 -20.101 216 HB3 PRO 27 2HB PRO 27 -9.340 7.188 -19.796 217 HG2 PRO 27 1HG PRO 27 -7.102 5.327 -19.097 218 HG3 PRO 27 2HG PRO 27 -7.026 6.968 -19.765 219 HD2 PRO 27 1HD PRO 27 -6.622 6.443 -17.139 220 HD3 PRO 27 2HD PRO 27 -7.358 7.955 -17.709 221 H SER 28 H SER 28 -8.369 4.325 -16.633 222 HA SER 28 HA SER 28 -9.890 1.984 -17.564 223 HB2 SER 28 1HB SER 28 -7.404 2.030 -17.988 224 HB3 SER 28 2HB SER 28 -7.170 1.978 -16.241 225 HG SER 28 HG SER 28 -7.961 -0.044 -16.178 226 H ASP 29 H ASP 29 -9.538 4.040 -14.968 227 HA ASP 29 HA ASP 29 -9.696 2.255 -12.780 228 HB2 ASP 29 1HB ASP 29 -9.933 5.139 -13.217 229 HB3 ASP 29 2HB ASP 29 -10.972 4.546 -11.924 230 H THR 30 H THR 30 -11.555 1.927 -11.373 231 HA THR 30 HA THR 30 -14.036 1.663 -12.935 232 HB THR 30 HB THR 30 -14.651 -0.022 -11.111 233 HG1 THR 30 HG1 THR 30 -11.837 -0.048 -10.693 234 HG21 THR 30 3HG2 THR 30 -13.985 -1.659 -12.509 235 HG22 THR 30 1HG2 THR 30 -12.295 -1.159 -12.451 236 HG23 THR 30 2HG2 THR 30 -13.425 -0.329 -13.522 237 H ILE 31 H ILE 31 -16.036 1.581 -11.415 238 HA ILE 31 HA ILE 31 -16.514 4.102 -10.403 239 HB ILE 31 HB ILE 31 -17.862 1.576 -9.445 240 HG12 ILE 31 1HG1 ILE 31 -17.909 1.613 -11.863 241 HG13 ILE 31 2HG1 ILE 31 -19.506 2.046 -11.261 242 HG21 ILE 31 1HG2 ILE 31 -18.185 4.246 -8.675 243 HG22 ILE 31 2HG2 ILE 31 -19.551 3.883 -9.729 244 HG23 ILE 31 3HG2 ILE 31 -19.247 2.887 -8.306 245 HD11 ILE 31 3HD1 ILE 31 -19.392 3.761 -12.665 246 HD12 ILE 31 1HD1 ILE 31 -18.260 4.479 -11.519 247 HD13 ILE 31 2HD1 ILE 31 -17.656 3.562 -12.900 248 H GLU 32 H GLU 32 -15.537 1.185 -8.631 249 HA GLU 32 HA GLU 32 -15.654 2.144 -6.044 250 HB2 GLU 32 1HB GLU 32 -13.832 0.501 -5.545 251 HB3 GLU 32 2HB GLU 32 -15.192 -0.171 -6.433 252 HG2 GLU 32 1HG GLU 32 -13.975 -0.254 -8.443 253 HG3 GLU 32 2HG GLU 32 -12.699 0.780 -7.803 254 H ASN 33 H ASN 33 -13.258 2.744 -8.522 255 HA ASN 33 HA ASN 33 -11.354 3.963 -6.763 256 HB2 ASN 33 1HB ASN 33 -11.612 4.064 -9.777 257 HB3 ASN 33 2HB ASN 33 -10.236 4.675 -8.863 258 HD21 ASN 33 2HD2 ASN 33 -9.489 2.912 -7.171 259 HD22 ASN 33 1HD2 ASN 33 -9.196 1.360 -7.871 260 H VAL 34 H VAL 34 -13.857 5.133 -8.970 261 HA VAL 34 HA VAL 34 -13.306 7.866 -8.833 262 HB VAL 34 HB VAL 34 -15.982 6.502 -9.155 263 HG11 VAL 34 1HG1 VAL 34 -16.298 8.803 -8.478 264 HG12 VAL 34 2HG1 VAL 34 -15.164 9.351 -9.713 265 HG13 VAL 34 3HG1 VAL 34 -16.700 8.624 -10.185 266 HG21 VAL 34 3HG2 VAL 34 -13.908 7.435 -11.126 267 HG22 VAL 34 1HG2 VAL 34 -14.545 5.805 -10.906 268 HG23 VAL 34 2HG2 VAL 34 -15.572 7.070 -11.580 269 H LYS 35 H LYS 35 -15.611 5.958 -6.896 270 HA LYS 35 HA LYS 35 -16.520 7.994 -5.243 271 HB2 LYS 35 1HB LYS 35 -17.138 6.224 -3.659 272 HB3 LYS 35 2HB LYS 35 -17.553 5.781 -5.310 273 HG2 LYS 35 1HG LYS 35 -15.664 4.310 -5.452 274 HG3 LYS 35 2HG LYS 35 -15.074 4.849 -3.879 275 HD2 LYS 35 1HD LYS 35 -17.264 4.007 -2.922 276 HD3 LYS 35 2HD LYS 35 -17.543 3.236 -4.486 277 HE2 LYS 35 1HE LYS 35 -15.070 2.346 -4.013 278 HE3 LYS 35 2HE LYS 35 -15.602 2.569 -2.347 279 HZ1 LYS 35 3HZ LYS 35 -16.363 0.483 -2.673 280 HZ2 LYS 35 1HZ LYS 35 -16.515 0.660 -4.349 281 HZ3 LYS 35 2HZ LYS 35 -17.698 1.295 -3.321 282 H ALA 36 H ALA 36 -13.513 6.251 -5.191 283 HA ALA 36 HA ALA 36 -12.673 6.660 -2.576 284 HB1 ALA 36 1HB ALA 36 -10.696 5.850 -3.273 285 HB2 ALA 36 2HB ALA 36 -11.568 5.529 -4.773 286 HB3 ALA 36 3HB ALA 36 -10.586 6.986 -4.618 287 H LYS 37 H LYS 37 -12.379 8.800 -5.388 288 HA LYS 37 HA LYS 37 -11.013 10.852 -3.926 289 HB2 LYS 37 1HB LYS 37 -12.295 10.757 -6.652 290 HB3 LYS 37 2HB LYS 37 -11.571 12.224 -6.006 291 HG2 LYS 37 1HG LYS 37 -9.980 9.702 -6.078 292 HG3 LYS 37 2HG LYS 37 -10.192 10.652 -7.550 293 HD2 LYS 37 1HD LYS 37 -9.231 12.595 -6.481 294 HD3 LYS 37 2HD LYS 37 -9.128 11.736 -4.942 295 HE2 LYS 37 1HE LYS 37 -7.460 10.274 -5.766 296 HE3 LYS 37 2HE LYS 37 -7.736 10.781 -7.432 297 HZ1 LYS 37 3HZ LYS 37 -6.566 12.438 -5.263 298 HZ2 LYS 37 1HZ LYS 37 -6.903 12.991 -6.826 299 HZ3 LYS 37 2HZ LYS 37 -5.739 11.788 -6.587 300 H ILE 38 H ILE 38 -14.331 10.083 -4.664 301 HA ILE 38 HA ILE 38 -15.496 12.590 -4.149 302 HB ILE 38 HB ILE 38 -16.676 9.836 -3.761 303 HG12 ILE 38 1HG1 ILE 38 -15.947 10.241 -6.058 304 HG13 ILE 38 2HG1 ILE 38 -17.704 10.239 -5.967 305 HG21 ILE 38 1HG2 ILE 38 -18.854 11.003 -3.957 306 HG22 ILE 38 2HG2 ILE 38 -17.952 11.446 -2.509 307 HG23 ILE 38 3HG2 ILE 38 -17.996 12.543 -3.889 308 HD11 ILE 38 3HD1 ILE 38 -17.534 12.771 -5.820 309 HD12 ILE 38 1HD1 ILE 38 -15.855 12.569 -6.321 310 HD13 ILE 38 2HD1 ILE 38 -17.162 12.022 -7.373 311 H GLN 39 H GLN 39 -14.382 10.046 -2.036 312 HA GLN 39 HA GLN 39 -15.734 10.643 0.308 313 HB2 GLN 39 1HB GLN 39 -12.904 9.667 -0.088 314 HB3 GLN 39 2HB GLN 39 -13.714 9.712 1.473 315 HG2 GLN 39 1HG GLN 39 -15.538 8.320 0.181 316 HG3 GLN 39 2HG GLN 39 -14.166 7.924 -0.853 317 HE21 GLN 39 2HE2 GLN 39 -15.053 8.089 2.575 318 HE22 GLN 39 1HE2 GLN 39 -14.184 6.672 3.046 319 H ASP 40 H ASP 40 -12.980 12.241 -1.161 320 HA ASP 40 HA ASP 40 -12.442 13.914 1.111 321 HB2 ASP 40 1HB ASP 40 -10.753 13.221 -0.657 322 HB3 ASP 40 2HB ASP 40 -11.532 14.382 -1.728 323 H LYS 41 H LYS 41 -14.548 14.025 -1.614 324 HA LYS 41 HA LYS 41 -14.955 16.878 -1.537 325 HB2 LYS 41 1HB LYS 41 -16.717 14.841 -2.894 326 HB3 LYS 41 2HB LYS 41 -16.537 16.546 -3.287 327 HG2 LYS 41 1HG LYS 41 -14.359 14.490 -3.584 328 HG3 LYS 41 2HG LYS 41 -15.419 15.030 -4.888 329 HD2 LYS 41 1HD LYS 41 -14.462 17.126 -4.978 330 HD3 LYS 41 2HD LYS 41 -13.902 17.056 -3.305 331 HE2 LYS 41 1HE LYS 41 -12.250 15.336 -3.984 332 HE3 LYS 41 2HE LYS 41 -12.768 15.544 -5.656 333 HZ1 LYS 41 3HZ LYS 41 -11.615 17.433 -5.855 334 HZ2 LYS 41 1HZ LYS 41 -10.769 16.911 -4.486 335 HZ3 LYS 41 2HZ LYS 41 -12.053 17.999 -4.322 336 H GLU 42 H GLU 42 -16.908 14.018 -0.702 337 HA GLU 42 HA GLU 42 -18.476 15.745 1.100 338 HB2 GLU 42 1HB GLU 42 -19.398 13.444 -0.621 339 HB3 GLU 42 2HB GLU 42 -20.359 14.093 0.701 340 HG2 GLU 42 1HG GLU 42 -19.449 15.591 -1.745 341 HG3 GLU 42 2HG GLU 42 -21.082 15.016 -1.412 342 H GLY 43 H GLY 43 -17.017 12.593 0.553 343 HA2 GLY 43 1HA GLY 43 -16.148 11.109 2.097 344 HA3 GLY 43 2HA GLY 43 -16.606 12.230 3.371 345 H ILE 44 H ILE 44 -18.115 10.012 1.026 346 HA ILE 44 HA ILE 44 -19.949 9.171 3.174 347 HB ILE 44 HB ILE 44 -21.606 8.671 1.327 348 HG12 ILE 44 1HG1 ILE 44 -19.832 10.554 -0.242 349 HG13 ILE 44 2HG1 ILE 44 -19.940 8.820 -0.524 350 HG21 ILE 44 1HG2 ILE 44 -21.695 11.449 1.036 351 HG22 ILE 44 2HG2 ILE 44 -22.519 10.472 2.251 352 HG23 ILE 44 3HG2 ILE 44 -20.933 11.161 2.600 353 HD11 ILE 44 3HD1 ILE 44 -22.375 10.552 -0.631 354 HD12 ILE 44 1HD1 ILE 44 -21.296 10.400 -2.017 355 HD13 ILE 44 2HD1 ILE 44 -22.098 8.972 -1.362 356 HA PRO 45 HA PRO 45 -18.636 5.043 2.443 357 HB2 PRO 45 1HB PRO 45 -20.890 3.675 3.092 358 HB3 PRO 45 2HB PRO 45 -19.863 4.461 4.297 359 HG2 PRO 45 1HG PRO 45 -22.418 5.422 3.070 360 HG3 PRO 45 2HG PRO 45 -21.895 5.491 4.763 361 HD2 PRO 45 1HD PRO 45 -21.749 7.627 3.105 362 HD3 PRO 45 2HD PRO 45 -20.579 7.351 4.412 363 HA PRO 46 HA PRO 46 -19.861 3.576 -1.517 364 HB2 PRO 46 1HB PRO 46 -19.745 0.880 -1.219 365 HB3 PRO 46 2HB PRO 46 -18.304 1.902 -1.282 366 HG2 PRO 46 1HG PRO 46 -19.708 0.752 1.099 367 HG3 PRO 46 2HG PRO 46 -17.969 0.855 0.767 368 HD2 PRO 46 1HD PRO 46 -19.243 2.587 2.412 369 HD3 PRO 46 2HD PRO 46 -17.847 3.061 1.424 370 H ASP 47 H ASP 47 -21.674 2.549 1.260 371 HA ASP 47 HA ASP 47 -23.776 1.265 -0.215 372 HB2 ASP 47 1HB ASP 47 -23.541 2.169 2.656 373 HB3 ASP 47 2HB ASP 47 -24.982 1.386 2.012 374 H GLN 48 H GLN 48 -23.140 4.477 1.016 375 HA GLN 48 HA GLN 48 -25.815 5.377 0.263 376 HB2 GLN 48 1HB GLN 48 -24.170 6.070 2.354 377 HB3 GLN 48 2HB GLN 48 -23.926 7.399 1.228 378 HG2 GLN 48 1HG GLN 48 -26.330 7.797 1.165 379 HG3 GLN 48 2HG GLN 48 -26.583 6.457 2.282 380 HE21 GLN 48 2HE2 GLN 48 -27.675 8.305 3.418 381 HE22 GLN 48 1HE2 GLN 48 -26.714 9.225 4.520 382 H GLN 49 H GLN 49 -22.538 5.448 -0.829 383 HA GLN 49 HA GLN 49 -22.922 7.647 -2.656 384 HB2 GLN 49 1HB GLN 49 -20.721 6.929 -1.528 385 HB3 GLN 49 2HB GLN 49 -20.656 5.672 -2.756 386 HG2 GLN 49 1HG GLN 49 -20.831 8.619 -3.335 387 HG3 GLN 49 2HG GLN 49 -19.338 7.683 -3.317 388 HE21 GLN 49 2HE2 GLN 49 -22.000 8.682 -5.141 389 HE22 GLN 49 1HE2 GLN 49 -21.702 7.732 -6.553 390 H ARG 50 H ARG 50 -24.094 7.420 -4.436 391 HA ARG 50 HA ARG 50 -23.841 4.919 -5.969 392 HB2 ARG 50 1HB ARG 50 -26.367 6.556 -5.695 393 HB3 ARG 50 2HB ARG 50 -26.185 5.041 -6.569 394 HG2 ARG 50 1HG ARG 50 -25.930 5.411 -3.591 395 HG3 ARG 50 2HG ARG 50 -27.297 4.691 -4.443 396 HD2 ARG 50 1HD ARG 50 -25.193 3.233 -5.399 397 HD3 ARG 50 2HD ARG 50 -24.698 3.545 -3.736 398 HE ARG 50 HE ARG 50 -26.300 2.079 -3.039 399 HH11 ARG 50 1HH1 ARG 50 -27.059 3.105 -6.278 400 HH12 ARG 50 2HH1 ARG 50 -28.387 2.007 -6.455 401 HH21 ARG 50 1HH2 ARG 50 -28.046 0.628 -3.259 402 HH22 ARG 50 2HH2 ARG 50 -28.948 0.599 -4.737 403 H LEU 51 H LEU 51 -22.960 5.285 -7.885 404 HA LEU 51 HA LEU 51 -23.058 7.971 -9.028 405 HB2 LEU 51 1HB LEU 51 -21.414 5.529 -9.637 406 HB3 LEU 51 2HB LEU 51 -21.410 6.955 -10.673 407 HG LEU 51 HG LEU 51 -20.507 6.825 -7.796 408 HD11 LEU 51 1HD1 LEU 51 -19.154 6.001 -10.004 409 HD12 LEU 51 2HD1 LEU 51 -18.401 6.615 -8.533 410 HD13 LEU 51 3HD1 LEU 51 -18.665 7.692 -9.904 411 HD21 LEU 51 3HD2 LEU 51 -20.825 9.019 -7.713 412 HD22 LEU 51 1HD2 LEU 51 -21.406 9.035 -9.379 413 HD23 LEU 51 2HD2 LEU 51 -19.683 9.207 -9.045 414 H ILE 52 H ILE 52 -24.511 8.466 -10.519 415 HA ILE 52 HA ILE 52 -25.614 6.299 -12.185 416 HB ILE 52 HB ILE 52 -26.950 8.783 -11.126 417 HG12 ILE 52 1HG1 ILE 52 -28.629 7.060 -10.357 418 HG13 ILE 52 2HG1 ILE 52 -27.490 5.821 -10.871 419 HG21 ILE 52 1HG2 ILE 52 -28.935 8.029 -12.458 420 HG22 ILE 52 2HG2 ILE 52 -27.599 8.671 -13.413 421 HG23 ILE 52 3HG2 ILE 52 -27.857 6.929 -13.317 422 HD11 ILE 52 3HD1 ILE 52 -27.601 6.688 -8.382 423 HD12 ILE 52 1HD1 ILE 52 -26.082 6.202 -9.135 424 HD13 ILE 52 2HD1 ILE 52 -26.503 7.911 -9.022 425 H PHE 53 H PHE 53 -25.755 6.594 -14.369 426 HA PHE 53 HA PHE 53 -25.002 9.184 -15.495 427 HB2 PHE 53 1HB PHE 53 -22.888 8.026 -15.380 428 HB3 PHE 53 2HB PHE 53 -23.590 6.580 -16.098 429 HD1 PHE 53 HD2 PHE 53 -23.934 10.140 -17.112 430 HD2 PHE 53 HD1 PHE 53 -22.448 6.272 -18.087 431 HE1 PHE 53 HE2 PHE 53 -23.304 10.949 -19.348 432 HE2 PHE 53 HE1 PHE 53 -21.815 7.076 -20.325 433 HZ PHE 53 HZ PHE 53 -22.244 9.417 -20.958 434 H ALA 54 H ALA 54 -26.152 9.696 -17.256 435 HA ALA 54 HA ALA 54 -27.726 9.576 -18.897 436 HB1 ALA 54 1HB ALA 54 -27.177 8.192 -20.579 437 HB2 ALA 54 2HB ALA 54 -25.796 7.793 -19.557 438 HB3 ALA 54 3HB ALA 54 -27.223 6.758 -19.553 439 H GLY 55 H GLY 55 -28.482 8.815 -16.184 440 HA2 GLY 55 1HA GLY 55 -30.517 8.228 -15.241 441 HA3 GLY 55 2HA GLY 55 -31.043 7.652 -16.816 442 H LYS 56 H LYS 56 -28.146 6.232 -16.358 443 HA LYS 56 HA LYS 56 -29.379 3.843 -15.153 444 HB2 LYS 56 1HB LYS 56 -28.441 3.936 -17.628 445 HB3 LYS 56 2HB LYS 56 -26.904 3.669 -16.816 446 HG2 LYS 56 1HG LYS 56 -27.894 1.658 -15.738 447 HG3 LYS 56 2HG LYS 56 -29.335 1.898 -16.729 448 HD2 LYS 56 1HD LYS 56 -26.584 1.641 -17.918 449 HD3 LYS 56 2HD LYS 56 -27.609 0.241 -17.594 450 HE2 LYS 56 1HE LYS 56 -29.394 1.511 -18.948 451 HE3 LYS 56 2HE LYS 56 -28.050 2.499 -19.518 452 HZ1 LYS 56 3HZ LYS 56 -28.050 0.890 -21.101 453 HZ2 LYS 56 1HZ LYS 56 -28.662 -0.305 -20.073 454 HZ3 LYS 56 2HZ LYS 56 -27.031 0.133 -19.982 455 H GLN 57 H GLN 57 -28.606 3.177 -13.264 456 HA GLN 57 HA GLN 57 -26.489 4.535 -11.953 457 HB2 GLN 57 1HB GLN 57 -26.959 3.188 -10.090 458 HB3 GLN 57 2HB GLN 57 -28.509 3.362 -10.902 459 HG2 GLN 57 1HG GLN 57 -27.439 1.094 -12.045 460 HG3 GLN 57 2HG GLN 57 -26.949 0.981 -10.355 461 HE21 GLN 57 2HE2 GLN 57 -29.008 -0.396 -12.134 462 HE22 GLN 57 1HE2 GLN 57 -30.452 -0.363 -11.187 463 H LEU 58 H LEU 58 -24.461 3.735 -11.280 464 HA LEU 58 HA LEU 58 -23.349 1.725 -13.107 465 HB2 LEU 58 1HB LEU 58 -21.760 3.569 -11.354 466 HB3 LEU 58 2HB LEU 58 -21.244 2.722 -12.811 467 HG LEU 58 HG LEU 58 -23.284 4.935 -12.853 468 HD11 LEU 58 1HD1 LEU 58 -21.711 6.500 -12.716 469 HD12 LEU 58 2HD1 LEU 58 -20.659 5.643 -13.842 470 HD13 LEU 58 3HD1 LEU 58 -20.626 5.241 -12.125 471 HD21 LEU 58 3HD2 LEU 58 -21.472 4.166 -15.093 472 HD22 LEU 58 1HD2 LEU 58 -23.082 4.885 -15.140 473 HD23 LEU 58 2HD2 LEU 58 -22.891 3.175 -14.751 474 H GLU 59 H GLU 59 -21.599 0.333 -12.206 475 HA GLU 59 HA GLU 59 -21.741 -0.199 -9.356 476 HB2 GLU 59 1HB GLU 59 -22.690 -2.155 -11.443 477 HB3 GLU 59 2HB GLU 59 -22.168 -2.667 -9.845 478 HG2 GLU 59 1HG GLU 59 -23.895 -0.976 -8.970 479 HG3 GLU 59 2HG GLU 59 -24.546 -1.023 -10.607 480 H ASP 60 H ASP 60 -20.025 -1.477 -8.579 481 HA ASP 60 HA ASP 60 -17.562 -1.118 -9.780 482 HB2 ASP 60 1HB ASP 60 -17.783 -1.655 -7.416 483 HB3 ASP 60 2HB ASP 60 -18.394 -3.259 -7.812 484 H GLY 61 H GLY 61 -16.206 -2.360 -11.042 485 HA2 GLY 61 1HA GLY 61 -15.923 -4.780 -11.851 486 HA3 GLY 61 2HA GLY 61 -17.544 -4.551 -12.489 487 H ARG 62 H ARG 62 -17.706 -2.404 -13.826 488 HA ARG 62 HA ARG 62 -15.666 -2.630 -15.890 489 HB2 ARG 62 1HB ARG 62 -18.440 -1.555 -15.748 490 HB3 ARG 62 2HB ARG 62 -17.358 -0.869 -16.952 491 HG2 ARG 62 1HG ARG 62 -16.990 -3.063 -17.913 492 HG3 ARG 62 2HG ARG 62 -18.006 -3.795 -16.670 493 HD2 ARG 62 1HD ARG 62 -19.911 -2.459 -17.480 494 HD3 ARG 62 2HD ARG 62 -18.885 -1.797 -18.752 495 HE ARG 62 HE ARG 62 -18.994 -4.667 -18.741 496 HH11 ARG 62 1HH1 ARG 62 -20.544 -1.752 -19.846 497 HH12 ARG 62 2HH1 ARG 62 -21.317 -2.519 -21.193 498 HH21 ARG 62 1HH2 ARG 62 -20.007 -5.688 -20.511 499 HH22 ARG 62 2HH2 ARG 62 -21.012 -4.758 -21.570 500 H THR 63 H THR 63 -15.005 -0.542 -16.995 501 HA THR 63 HA THR 63 -14.138 1.343 -14.924 502 HB THR 63 HB THR 63 -12.265 0.537 -16.108 503 HG1 THR 63 HG1 THR 63 -12.060 2.741 -15.937 504 HG21 THR 63 3HG2 THR 63 -12.334 0.981 -18.733 505 HG22 THR 63 1HG2 THR 63 -14.059 0.732 -18.467 506 HG23 THR 63 2HG2 THR 63 -12.907 -0.527 -18.022 507 H LEU 64 H LEU 64 -14.099 3.641 -15.424 508 HA LEU 64 HA LEU 64 -16.550 4.669 -16.179 509 HB2 LEU 64 1HB LEU 64 -13.892 6.078 -16.362 510 HB3 LEU 64 2HB LEU 64 -15.476 6.843 -16.254 511 HG LEU 64 HG LEU 64 -14.878 7.057 -14.087 512 HD11 LEU 64 1HD1 LEU 64 -16.779 5.350 -14.296 513 HD12 LEU 64 2HD1 LEU 64 -15.962 5.493 -12.741 514 HD13 LEU 64 3HD1 LEU 64 -15.574 4.153 -13.821 515 HD21 LEU 64 3HD2 LEU 64 -12.793 6.398 -13.659 516 HD22 LEU 64 1HD2 LEU 64 -12.889 5.075 -14.821 517 HD23 LEU 64 2HD2 LEU 64 -13.487 4.849 -13.177 518 H SER 65 H SER 65 -13.650 4.177 -18.132 519 HA SER 65 HA SER 65 -14.550 5.498 -20.451 520 HB2 SER 65 1HB SER 65 -12.195 4.922 -20.118 521 HB3 SER 65 2HB SER 65 -12.589 3.205 -20.183 522 HG SER 65 HG SER 65 -12.701 5.120 -22.258 523 H GLU 66 H GLU 66 -15.010 2.232 -19.252 524 HA GLU 66 HA GLU 66 -16.158 1.222 -21.671 525 HB2 GLU 66 1HB GLU 66 -15.950 0.213 -18.853 526 HB3 GLU 66 2HB GLU 66 -16.982 -0.609 -20.014 527 HG2 GLU 66 1HG GLU 66 -14.110 -0.038 -20.631 528 HG3 GLU 66 2HG GLU 66 -14.583 -1.451 -19.689 529 H TYR 67 H TYR 67 -17.313 3.079 -19.036 530 HA TYR 67 HA TYR 67 -20.100 2.376 -19.498 531 HB2 TYR 67 1HB TYR 67 -18.627 3.984 -17.457 532 HB3 TYR 67 2HB TYR 67 -20.334 4.321 -17.718 533 HD1 TYR 67 HD1 TYR 67 -21.703 1.915 -17.980 534 HD2 TYR 67 HD2 TYR 67 -18.236 2.651 -15.626 535 HE1 TYR 67 HE1 TYR 67 -22.303 0.031 -16.517 536 HE2 TYR 67 HE2 TYR 67 -18.826 0.769 -14.157 537 HH TYR 67 HH TYR 67 -21.820 -1.070 -14.640 538 H ASN 68 H ASN 68 -18.155 4.001 -21.318 539 HA ASN 68 HA ASN 68 -18.384 5.630 -22.889 540 HB2 ASN 68 1HB ASN 68 -21.258 5.963 -22.054 541 HB3 ASN 68 2HB ASN 68 -20.543 6.213 -23.644 542 HD21 ASN 68 2HD2 ASN 68 -19.433 4.156 -24.503 543 HD22 ASN 68 1HD2 ASN 68 -20.364 2.707 -24.369 544 H ILE 69 H ILE 69 -17.847 6.199 -19.991 545 HA ILE 69 HA ILE 69 -18.878 8.904 -19.672 546 HB ILE 69 HB ILE 69 -17.053 7.301 -17.876 547 HG12 ILE 69 1HG1 ILE 69 -19.970 7.967 -17.470 548 HG13 ILE 69 2HG1 ILE 69 -19.424 6.458 -18.194 549 HG21 ILE 69 1HG2 ILE 69 -16.674 9.190 -16.779 550 HG22 ILE 69 2HG2 ILE 69 -17.688 10.079 -17.914 551 HG23 ILE 69 3HG2 ILE 69 -18.404 9.348 -16.478 552 HD11 ILE 69 3HD1 ILE 69 -18.382 7.294 -15.528 553 HD12 ILE 69 1HD1 ILE 69 -19.976 6.553 -15.669 554 HD13 ILE 69 2HD1 ILE 69 -18.545 5.678 -16.215 555 H GLN 70 H GLN 70 -17.875 10.405 -20.856 556 HA GLN 70 HA GLN 70 -15.063 10.204 -21.487 557 HB2 GLN 70 1HB GLN 70 -16.976 12.470 -22.070 558 HB3 GLN 70 2HB GLN 70 -15.406 12.201 -22.816 559 HG2 GLN 70 1HG GLN 70 -16.825 11.411 -24.430 560 HG3 GLN 70 2HG GLN 70 -16.440 9.933 -23.548 561 HE21 GLN 70 2HE2 GLN 70 -18.456 9.247 -24.633 562 HE22 GLN 70 1HE2 GLN 70 -19.954 9.557 -23.831 563 H LYS 71 H LYS 71 -14.143 12.751 -21.436 564 HA LYS 71 HA LYS 71 -13.591 13.119 -18.637 565 HB2 LYS 71 1HB LYS 71 -12.057 14.884 -19.401 566 HB3 LYS 71 2HB LYS 71 -11.803 13.377 -20.272 567 HG2 LYS 71 1HG LYS 71 -13.697 15.169 -21.579 568 HG3 LYS 71 2HG LYS 71 -12.077 15.848 -21.406 569 HD2 LYS 71 1HD LYS 71 -11.389 13.433 -22.270 570 HD3 LYS 71 2HD LYS 71 -13.005 13.504 -22.979 571 HE2 LYS 71 1HE LYS 71 -12.461 15.501 -24.178 572 HE3 LYS 71 2HE LYS 71 -10.924 15.656 -23.328 573 HZ1 LYS 71 3HZ LYS 71 -10.336 13.448 -24.359 574 HZ2 LYS 71 1HZ LYS 71 -10.422 14.761 -25.423 575 HZ3 LYS 71 2HZ LYS 71 -11.687 13.641 -25.358 576 H GLU 72 H GLU 72 -15.910 14.297 -20.796 577 HA GLU 72 HA GLU 72 -16.512 16.542 -18.984 578 HB2 GLU 72 1HB GLU 72 -16.868 16.352 -21.975 579 HB3 GLU 72 2HB GLU 72 -17.631 17.596 -20.995 580 HG2 GLU 72 1HG GLU 72 -15.192 18.034 -20.174 581 HG3 GLU 72 2HG GLU 72 -14.758 17.215 -21.673 582 H SER 73 H SER 73 -17.399 13.642 -19.140 583 HA SER 73 HA SER 73 -20.093 13.552 -19.966 584 HB2 SER 73 1HB SER 73 -20.056 11.390 -19.243 585 HB3 SER 73 2HB SER 73 -18.316 11.675 -19.182 586 HG SER 73 HG SER 73 -18.515 12.126 -16.978 587 H THR 74 H THR 74 -21.662 12.662 -18.002 588 HA THR 74 HA THR 74 -21.636 14.724 -15.906 589 HB THR 74 HB THR 74 -24.293 13.934 -16.960 590 HG1 THR 74 HG1 THR 74 -24.079 14.933 -18.836 591 HG21 THR 74 3HG2 THR 74 -24.488 15.486 -15.272 592 HG22 THR 74 1HG2 THR 74 -24.451 16.547 -16.680 593 HG23 THR 74 2HG2 THR 74 -22.995 16.313 -15.713 594 H LEU 75 H LEU 75 -21.491 13.683 -14.034 595 HA LEU 75 HA LEU 75 -22.803 11.072 -13.745 596 HB2 LEU 75 1HB LEU 75 -20.391 12.323 -12.604 597 HB3 LEU 75 2HB LEU 75 -21.335 11.333 -11.493 598 HG LEU 75 HG LEU 75 -19.539 10.034 -12.466 599 HD11 LEU 75 1HD1 LEU 75 -22.325 9.387 -12.686 600 HD12 LEU 75 2HD1 LEU 75 -20.963 8.346 -12.274 601 HD13 LEU 75 3HD1 LEU 75 -21.410 8.585 -13.963 602 HD21 LEU 75 3HD2 LEU 75 -20.691 11.029 -15.045 603 HD22 LEU 75 1HD2 LEU 75 -19.788 9.516 -14.983 604 HD23 LEU 75 2HD2 LEU 75 -19.014 11.024 -14.499 605 H HIS 76 H HIS 76 -24.151 10.627 -11.993 606 HA HIS 76 HA HIS 76 -25.101 12.986 -10.504 607 HB2 HIS 76 1HB HIS 76 -26.705 10.704 -11.665 608 HB3 HIS 76 2HB HIS 76 -27.357 11.861 -10.507 609 HD1 HIS 76 HD1 HIS 76 -26.735 14.514 -11.478 610 HD2 HIS 76 HD2 HIS 76 -27.457 11.414 -14.148 611 HE1 HIS 76 HE1 HIS 76 -27.386 15.625 -13.638 612 H LEU 77 H LEU 77 -24.673 12.812 -8.414 613 HA LEU 77 HA LEU 77 -24.360 10.151 -7.231 614 HB2 LEU 77 1HB LEU 77 -23.314 11.357 -5.348 615 HB3 LEU 77 2HB LEU 77 -22.494 11.613 -6.887 616 HG LEU 77 HG LEU 77 -24.204 13.754 -6.767 617 HD11 LEU 77 1HD1 LEU 77 -22.999 13.842 -4.076 618 HD12 LEU 77 2HD1 LEU 77 -24.420 12.816 -4.264 619 HD13 LEU 77 3HD1 LEU 77 -24.510 14.530 -4.671 620 HD21 LEU 77 3HD2 LEU 77 -21.533 14.064 -5.524 621 HD22 LEU 77 1HD2 LEU 77 -22.290 14.973 -6.833 622 HD23 LEU 77 2HD2 LEU 77 -21.595 13.383 -7.151 623 H VAL 78 H VAL 78 -26.070 9.318 -6.249 624 HA VAL 78 HA VAL 78 -27.827 11.118 -4.714 625 HB VAL 78 HB VAL 78 -29.681 9.449 -5.264 626 HG11 VAL 78 1HG1 VAL 78 -30.426 10.871 -6.853 627 HG12 VAL 78 2HG1 VAL 78 -29.004 11.802 -6.378 628 HG13 VAL 78 3HG1 VAL 78 -28.944 10.761 -7.801 629 HG21 VAL 78 3HG2 VAL 78 -27.606 8.081 -6.484 630 HG22 VAL 78 1HG2 VAL 78 -29.329 7.752 -6.667 631 HG23 VAL 78 2HG2 VAL 78 -28.500 8.787 -7.830 632 H LEU 79 H LEU 79 -28.492 10.414 -2.728 633 HA LEU 79 HA LEU 79 -27.221 7.953 -1.752 634 HB2 LEU 79 1HB LEU 79 -28.129 10.467 -0.389 635 HB3 LEU 79 2HB LEU 79 -27.784 8.996 0.518 636 HG LEU 79 HG LEU 79 -25.465 9.071 -0.495 637 HD11 LEU 79 1HD1 LEU 79 -25.301 10.491 -2.227 638 HD12 LEU 79 2HD1 LEU 79 -25.046 11.703 -0.972 639 HD13 LEU 79 3HD1 LEU 79 -26.648 11.487 -1.675 640 HD21 LEU 79 3HD2 LEU 79 -25.566 11.542 1.026 641 HD22 LEU 79 1HD2 LEU 79 -24.818 9.996 1.426 642 HD23 LEU 79 2HD2 LEU 79 -26.530 10.260 1.759 643 H ARG 80 H ARG 80 -28.393 6.291 -0.984 644 HA ARG 80 HA ARG 80 -31.316 6.643 -0.855 645 HB2 ARG 80 1HB ARG 80 -29.819 4.093 -1.481 646 HB3 ARG 80 2HB ARG 80 -31.560 4.337 -1.543 647 HG2 ARG 80 1HG ARG 80 -29.548 5.712 -3.312 648 HG3 ARG 80 2HG ARG 80 -30.535 4.322 -3.767 649 HD2 ARG 80 1HD ARG 80 -31.700 6.931 -2.824 650 HD3 ARG 80 2HD ARG 80 -31.381 6.579 -4.522 651 HE ARG 80 HE ARG 80 -33.544 5.586 -2.932 652 HH11 ARG 80 1HH1 ARG 80 -31.485 4.904 -5.655 653 HH12 ARG 80 2HH1 ARG 80 -32.629 3.855 -6.424 654 HH21 ARG 80 1HH2 ARG 80 -35.060 4.207 -3.935 655 HH22 ARG 80 2HH2 ARG 80 -34.663 3.461 -5.446 656 H LEU 81 H LEU 81 -28.466 5.429 0.723 657 HA LEU 81 HA LEU 81 -29.924 4.063 2.807 658 HB2 LEU 81 1HB LEU 81 -27.075 4.525 2.125 659 HB3 LEU 81 2HB LEU 81 -27.463 4.195 3.813 660 HG LEU 81 HG LEU 81 -26.757 2.199 2.495 661 HD11 LEU 81 1HD1 LEU 81 -27.833 1.338 4.255 662 HD12 LEU 81 2HD1 LEU 81 -29.146 1.033 3.119 663 HD13 LEU 81 3HD1 LEU 81 -29.167 2.483 4.122 664 HD21 LEU 81 3HD2 LEU 81 -29.452 2.201 1.213 665 HD22 LEU 81 1HD2 LEU 81 -27.981 1.349 0.742 666 HD23 LEU 81 2HD2 LEU 81 -28.126 3.083 0.453 667 H ARG 82 H ARG 82 -29.047 4.634 5.150 668 HA ARG 82 HA ARG 82 -29.815 7.416 5.580 669 HB2 ARG 82 1HB ARG 82 -30.029 6.753 7.952 670 HB3 ARG 82 2HB ARG 82 -31.002 5.751 6.883 671 HG2 ARG 82 1HG ARG 82 -29.746 3.886 7.256 672 HG3 ARG 82 2HG ARG 82 -28.276 4.806 7.580 673 HD2 ARG 82 1HD ARG 82 -28.764 4.113 9.698 674 HD3 ARG 82 2HD ARG 82 -29.674 5.623 9.667 675 HE ARG 82 HE ARG 82 -31.317 3.522 8.773 676 HH11 ARG 82 1HH1 ARG 82 -29.809 4.719 11.673 677 HH12 ARG 82 2HH1 ARG 82 -31.018 4.065 12.728 678 HH21 ARG 82 1HH2 ARG 82 -32.915 2.656 10.151 679 HH22 ARG 82 2HH2 ARG 82 -32.784 2.891 11.861 680 H GLY 83 H GLY 83 -28.655 8.141 7.869 681 HA2 GLY 83 1HA GLY 83 -25.779 8.129 7.199 682 HA3 GLY 83 2HA GLY 83 -26.616 9.476 7.957 683 H TYR 84 H TYR 84 -24.491 7.084 8.548 684 HA TYR 84 HA TYR 84 -25.366 6.743 11.340 685 HB2 TYR 84 1HB TYR 84 -24.953 4.721 9.704 686 HB3 TYR 84 2HB TYR 84 -23.263 5.011 10.101 687 HD1 TYR 84 HD1 TYR 84 -26.578 4.411 11.695 688 HD2 TYR 84 HD2 TYR 84 -22.349 4.074 12.027 689 HE1 TYR 84 HE1 TYR 84 -26.850 3.112 13.766 690 HE2 TYR 84 HE2 TYR 84 -22.609 2.772 14.098 691 HH TYR 84 HH TYR 84 -25.788 2.246 15.549 692 H ALA 85 H ALA 85 -23.442 6.385 12.862 693 HA ALA 85 HA ALA 85 -21.945 8.719 13.035 694 HB1 ALA 85 1HB ALA 85 -20.590 7.499 14.727 695 HB2 ALA 85 2HB ALA 85 -22.332 7.374 14.980 696 HB3 ALA 85 3HB ALA 85 -21.443 6.022 14.280 697 H ASP 86 H ASP 86 -20.398 5.543 12.634 698 HA ASP 86 HA ASP 86 -19.014 6.190 10.259 699 HB2 ASP 86 1HB ASP 86 -17.746 7.751 11.558 700 HB3 ASP 86 2HB ASP 86 -17.509 6.576 12.849 701 H LEU 87 H LEU 87 -17.732 4.474 9.499 702 HA LEU 87 HA LEU 87 -17.521 2.101 11.195 703 HB2 LEU 87 1HB LEU 87 -18.569 1.852 8.398 704 HB3 LEU 87 2HB LEU 87 -18.596 0.661 9.697 705 HG LEU 87 HG LEU 87 -20.229 3.192 9.747 706 HD11 LEU 87 1HD1 LEU 87 -22.128 1.622 9.170 707 HD12 LEU 87 2HD1 LEU 87 -20.894 0.473 8.652 708 HD13 LEU 87 3HD1 LEU 87 -21.030 2.040 7.854 709 HD21 LEU 87 3HD2 LEU 87 -21.000 2.492 11.724 710 HD22 LEU 87 1HD2 LEU 87 -19.597 1.423 11.748 711 HD23 LEU 87 2HD2 LEU 87 -21.153 0.822 11.174 712 H ARG 88 H ARG 88 -15.718 0.915 10.838 713 HA ARG 88 HA ARG 88 -14.291 0.853 8.394 714 HB2 ARG 88 1HB ARG 88 -13.744 3.171 9.136 715 HB3 ARG 88 2HB ARG 88 -13.008 2.495 10.583 716 HG2 ARG 88 1HG ARG 88 -11.208 2.885 9.170 717 HG3 ARG 88 2HG ARG 88 -11.527 1.160 8.973 718 HD2 ARG 88 1HD ARG 88 -12.847 3.112 7.143 719 HD3 ARG 88 2HD ARG 88 -11.152 2.700 6.885 720 HE ARG 88 HE ARG 88 -12.593 0.324 7.170 721 HH11 ARG 88 1HH1 ARG 88 -12.319 3.001 4.960 722 HH12 ARG 88 2HH1 ARG 88 -12.768 2.068 3.571 723 HH21 ARG 88 1HH2 ARG 88 -13.185 -0.914 5.348 724 HH22 ARG 88 2HH2 ARG 88 -13.261 -0.158 3.792 725 H GLU 89 H GLU 89 -13.634 -1.188 8.452 726 HA GLU 89 HA GLU 89 -12.153 -2.129 10.796 727 HB2 GLU 89 1HB GLU 89 -14.420 -3.639 9.485 728 HB3 GLU 89 2HB GLU 89 -13.336 -4.306 10.698 729 HG2 GLU 89 1HG GLU 89 -15.004 -1.868 11.214 730 HG3 GLU 89 2HG GLU 89 -15.608 -3.501 11.484 731 H ASP 90 H ASP 90 -10.203 -2.556 10.004 732 HA ASP 90 HA ASP 90 -9.898 -4.506 7.907 733 HB2 ASP 90 1HB ASP 90 -8.330 -2.951 6.606 734 HB3 ASP 90 2HB ASP 90 -10.061 -2.683 6.422 735 HA PRO 91 HA PRO 91 -6.654 -4.422 11.251 736 HB2 PRO 91 1HB PRO 91 -6.933 -7.036 11.928 737 HB3 PRO 91 2HB PRO 91 -7.911 -5.749 12.643 738 HG2 PRO 91 1HG PRO 91 -8.599 -7.644 10.430 739 HG3 PRO 91 2HG PRO 91 -9.593 -7.116 11.800 740 HD2 PRO 91 1HD PRO 91 -9.866 -6.076 9.315 741 HD3 PRO 91 2HD PRO 91 -10.156 -5.125 10.786 742 H ASP 92 H ASP 92 -5.270 -4.140 9.349 743 HA ASP 92 HA ASP 92 -4.525 -6.101 7.552 744 HB2 ASP 92 1HB ASP 92 -2.243 -4.861 7.606 745 HB3 ASP 92 2HB ASP 92 -3.677 -3.979 7.087 746 H ARG 93 H ARG 93 -2.839 -5.293 10.593 747 HA ARG 93 HA ARG 93 -2.214 -8.102 10.991 748 HB2 ARG 93 1HB ARG 93 0.228 -7.479 11.412 749 HB3 ARG 93 2HB ARG 93 -0.295 -7.572 9.736 750 HG2 ARG 93 1HG ARG 93 -0.363 -5.213 9.532 751 HG3 ARG 93 2HG ARG 93 -0.172 -4.993 11.273 752 HD2 ARG 93 1HD ARG 93 1.876 -6.160 9.391 753 HD3 ARG 93 2HD ARG 93 1.915 -4.542 10.090 754 HE ARG 93 HE ARG 93 1.794 -6.197 12.248 755 HH11 ARG 93 1HH1 ARG 93 3.897 -5.929 9.487 756 HH12 ARG 93 2HH1 ARG 93 5.289 -6.532 10.324 757 HH21 ARG 93 1HH2 ARG 93 3.619 -6.993 13.361 758 HH22 ARG 93 2HH2 ARG 93 5.129 -7.138 12.528 759 H GLN 94 H GLN 94 -1.003 -8.393 13.117 760 HA GLN 94 HA GLN 94 -1.944 -6.386 15.058 761 HB2 GLN 94 1HB GLN 94 -2.109 -8.333 16.665 762 HB3 GLN 94 2HB GLN 94 -3.297 -8.309 15.368 763 HG2 GLN 94 1HG GLN 94 -0.787 -9.832 14.938 764 HG3 GLN 94 2HG GLN 94 -1.997 -10.502 16.030 765 HE21 GLN 94 2HE2 GLN 94 -4.279 -10.429 15.099 766 HE22 GLN 94 1HE2 GLN 94 -4.442 -10.934 13.455 767 H ASP 95 H ASP 95 0.362 -5.657 14.344 768 HA ASP 95 HA ASP 95 2.651 -6.990 15.219 769 HB2 ASP 95 1HB ASP 95 3.757 -4.792 15.133 770 HB3 ASP 95 2HB ASP 95 2.745 -5.064 13.716 771 H HIS 96 H HIS 96 4.130 -5.792 16.951 772 HA HIS 96 HA HIS 96 2.555 -5.727 19.438 773 HB2 HIS 96 1HB HIS 96 5.488 -6.398 19.161 774 HB3 HIS 96 2HB HIS 96 4.488 -6.577 20.599 775 HD1 HIS 96 HD1 HIS 96 3.022 -8.662 20.767 776 HD2 HIS 96 HD2 HIS 96 5.096 -8.378 17.178 777 HE1 HIS 96 HE1 HIS 96 2.759 -10.904 19.659 778 H HIS 97 H HIS 97 4.925 -4.080 17.499 779 HA HIS 97 HA HIS 97 5.942 -2.048 17.672 780 HB2 HIS 97 1HB HIS 97 3.477 -1.438 17.694 781 HB3 HIS 97 2HB HIS 97 3.617 -1.290 19.443 782 HD1 HIS 97 HD1 HIS 97 3.472 1.165 19.815 783 HD2 HIS 97 HD2 HIS 97 6.122 0.196 16.766 784 HE1 HIS 97 HE1 HIS 97 4.577 3.330 19.171 785 HA PRO 98 HA PRO 98 7.650 -3.104 21.865 786 HB2 PRO 98 1HB PRO 98 10.203 -3.430 21.004 787 HB3 PRO 98 2HB PRO 98 9.011 -4.735 20.990 788 HG2 PRO 98 1HG PRO 98 9.910 -2.966 18.749 789 HG3 PRO 98 2HG PRO 98 9.616 -4.715 18.745 790 HD2 PRO 98 1HD PRO 98 7.822 -2.935 17.774 791 HD3 PRO 98 2HD PRO 98 7.335 -4.458 18.543 792 H GLY 99 H GLY 99 9.573 -2.028 22.955 793 HA2 GLY 99 1HA GLY 99 9.735 0.769 22.024 794 HA3 GLY 99 2HA GLY 99 9.789 0.280 23.711 795 H SER 100 H SER 100 11.712 1.950 22.739 796 HA SER 100 HA SER 100 14.091 0.387 23.197 797 HB2 SER 100 1HB SER 100 15.248 1.033 21.153 798 HB3 SER 100 2HB SER 100 13.771 0.160 20.744 799 HG SER 100 HG SER 100 12.811 2.059 20.164 800 H GLY 101 H GLY 101 16.014 1.747 23.472 801 HA2 GLY 101 1HA GLY 101 15.426 4.595 23.889 802 HA3 GLY 101 2HA GLY 101 16.037 3.652 25.240 803 H ALA 102 H ALA 102 18.183 3.347 25.441 804 HA ALA 102 HA ALA 102 20.419 3.544 25.062 805 HB1 ALA 102 1HB ALA 102 19.804 3.533 22.118 806 HB2 ALA 102 2HB ALA 102 21.275 2.995 22.931 807 HB3 ALA 102 3HB ALA 102 19.783 2.071 23.106 808 H GLN 103 H GLN 103 18.613 5.914 25.150 809 HA GLN 103 HA GLN 103 19.403 7.920 23.389 810 HB2 GLN 103 1HB GLN 103 17.525 8.010 25.078 811 HB3 GLN 103 2HB GLN 103 18.742 8.344 26.303 812 HG2 GLN 103 1HG GLN 103 17.559 10.349 25.401 813 HG3 GLN 103 2HG GLN 103 19.318 10.408 25.299 814 HE21 GLN 103 2HE2 GLN 103 16.676 9.089 23.323 815 HE22 GLN 103 1HE2 GLN 103 17.219 9.778 21.835 Start of MODEL 18 1 H1 GLY 1 H GLY 1 0.058 13.668 -1.143 2 HA2 GLY 1 1HA GLY 1 1.592 12.207 -2.033 3 HA3 GLY 1 2HA GLY 1 1.622 11.409 -0.468 4 H SER 2 H SER 2 1.740 9.357 -1.419 5 HA SER 2 HA SER 2 0.945 7.406 -2.279 6 HB2 SER 2 1HB SER 2 -0.864 8.138 -0.500 7 HB3 SER 2 2HB SER 2 -1.876 8.344 -1.930 8 HG SER 2 HG SER 2 -0.734 6.010 -0.872 9 H LEU 3 H LEU 3 1.554 9.360 -4.167 10 HA LEU 3 HA LEU 3 -0.487 8.862 -6.234 11 HB2 LEU 3 1HB LEU 3 0.069 11.285 -5.365 12 HB3 LEU 3 2HB LEU 3 1.438 11.124 -6.463 13 HG LEU 3 HG LEU 3 -1.390 10.699 -7.386 14 HD11 LEU 3 1HD1 LEU 3 0.006 13.296 -7.799 15 HD12 LEU 3 2HD1 LEU 3 -0.832 13.008 -6.275 16 HD13 LEU 3 3HD1 LEU 3 -1.719 12.928 -7.797 17 HD21 LEU 3 3HD2 LEU 3 1.252 10.679 -8.580 18 HD22 LEU 3 1HD2 LEU 3 0.161 11.801 -9.393 19 HD23 LEU 3 2HD2 LEU 3 -0.286 10.103 -9.225 20 H VAL 4 H VAL 4 0.147 7.854 -8.044 21 HA VAL 4 HA VAL 4 3.038 7.424 -8.429 22 HB VAL 4 HB VAL 4 2.277 5.325 -9.688 23 HG11 VAL 4 1HG1 VAL 4 2.591 5.825 -6.841 24 HG12 VAL 4 2HG1 VAL 4 1.656 4.366 -7.179 25 HG13 VAL 4 3HG1 VAL 4 3.277 4.551 -7.849 26 HG21 VAL 4 3HG2 VAL 4 -0.184 5.622 -7.984 27 HG22 VAL 4 1HG2 VAL 4 -0.141 6.089 -9.684 28 HG23 VAL 4 2HG2 VAL 4 0.149 4.412 -9.223 29 HA PRO 5 HA PRO 5 2.773 9.174 -12.446 30 HB2 PRO 5 1HB PRO 5 4.561 7.658 -13.816 31 HB3 PRO 5 2HB PRO 5 5.043 8.857 -12.609 32 HG2 PRO 5 1HG PRO 5 4.781 5.888 -12.330 33 HG3 PRO 5 2HG PRO 5 6.056 6.961 -11.723 34 HD2 PRO 5 1HD PRO 5 4.060 6.035 -10.146 35 HD3 PRO 5 2HD PRO 5 4.806 7.628 -9.906 36 H ARG 6 H ARG 6 0.639 8.629 -13.033 37 HA ARG 6 HA ARG 6 0.475 6.668 -15.156 38 HB2 ARG 6 1HB ARG 6 -0.066 5.498 -12.941 39 HB3 ARG 6 2HB ARG 6 -1.527 6.476 -12.914 40 HG2 ARG 6 1HG ARG 6 -2.409 5.425 -14.802 41 HG3 ARG 6 2HG ARG 6 -0.843 4.761 -15.272 42 HD2 ARG 6 1HD ARG 6 -0.875 3.292 -13.322 43 HD3 ARG 6 2HD ARG 6 -2.427 3.970 -12.830 44 HE ARG 6 HE ARG 6 -2.727 3.009 -15.421 45 HH11 ARG 6 1HH1 ARG 6 -2.038 1.762 -12.244 46 HH12 ARG 6 2HH1 ARG 6 -2.756 0.216 -12.552 47 HH21 ARG 6 1HH2 ARG 6 -3.676 0.977 -15.839 48 HH22 ARG 6 2HH2 ARG 6 -3.687 -0.230 -14.598 49 H GLY 7 H GLY 7 -1.399 6.923 -16.486 50 HA2 GLY 7 1HA GLY 7 -2.142 9.549 -16.990 51 HA3 GLY 7 2HA GLY 7 -3.026 8.139 -17.557 52 H SER 8 H SER 8 -4.234 10.584 -16.857 53 HA SER 8 HA SER 8 -6.282 9.672 -15.137 54 HB2 SER 8 1HB SER 8 -5.765 11.706 -13.474 55 HB3 SER 8 2HB SER 8 -5.141 10.080 -13.193 56 HG SER 8 HG SER 8 -3.293 11.102 -13.162 57 H MET 9 H MET 9 -8.106 10.824 -15.469 58 HA MET 9 HA MET 9 -7.845 13.438 -16.802 59 HB2 MET 9 1HB MET 9 -9.459 12.911 -18.390 60 HB3 MET 9 2HB MET 9 -8.553 11.410 -18.257 61 HG2 MET 9 1HG MET 9 -10.523 11.132 -16.354 62 HG3 MET 9 2HG MET 9 -11.339 11.968 -17.674 63 HE1 MET 9 3HE MET 9 -11.620 9.321 -16.190 64 HE2 MET 9 1HE MET 9 -12.570 8.638 -17.510 65 HE3 MET 9 2HE MET 9 -11.080 7.848 -16.996 66 H GLN 10 H GLN 10 -9.619 14.902 -16.487 67 HA GLN 10 HA GLN 10 -10.864 14.545 -13.868 68 HB2 GLN 10 1HB GLN 10 -10.190 16.888 -15.583 69 HB3 GLN 10 2HB GLN 10 -11.534 17.046 -14.459 70 HG2 GLN 10 1HG GLN 10 -10.178 16.807 -12.599 71 HG3 GLN 10 2HG GLN 10 -8.888 16.029 -13.516 72 HE21 GLN 10 2HE2 GLN 10 -7.176 17.245 -13.798 73 HE22 GLN 10 1HE2 GLN 10 -7.150 18.968 -13.920 74 H ILE 11 H ILE 11 -13.048 14.560 -13.521 75 HA ILE 11 HA ILE 11 -14.767 14.625 -15.914 76 HB ILE 11 HB ILE 11 -16.136 12.867 -15.028 77 HG12 ILE 11 1HG1 ILE 11 -14.276 12.877 -12.641 78 HG13 ILE 11 2HG1 ILE 11 -15.950 13.419 -12.647 79 HG21 ILE 11 1HG2 ILE 11 -14.547 10.988 -15.038 80 HG22 ILE 11 2HG2 ILE 11 -14.217 12.153 -16.319 81 HG23 ILE 11 3HG2 ILE 11 -13.217 12.132 -14.867 82 HD11 ILE 11 3HD1 ILE 11 -15.814 11.235 -11.671 83 HD12 ILE 11 1HD1 ILE 11 -16.647 11.124 -13.221 84 HD13 ILE 11 2HD1 ILE 11 -14.965 10.613 -13.086 85 H PHE 12 H PHE 12 -17.051 15.114 -15.446 86 HA PHE 12 HA PHE 12 -17.275 16.994 -13.191 87 HB2 PHE 12 1HB PHE 12 -18.581 17.016 -15.914 88 HB3 PHE 12 2HB PHE 12 -19.093 18.064 -14.595 89 HD1 PHE 12 HD2 PHE 12 -17.168 19.473 -13.494 90 HD2 PHE 12 HD1 PHE 12 -17.014 17.793 -17.402 91 HE1 PHE 12 HE2 PHE 12 -15.446 21.112 -14.127 92 HE2 PHE 12 HE1 PHE 12 -15.290 19.429 -18.040 93 HZ PHE 12 HZ PHE 12 -14.505 21.093 -16.402 94 H VAL 13 H VAL 13 -18.729 16.578 -11.661 95 HA VAL 13 HA VAL 13 -20.938 14.732 -12.277 96 HB VAL 13 HB VAL 13 -20.710 13.607 -10.194 97 HG11 VAL 13 1HG1 VAL 13 -17.835 13.650 -10.772 98 HG12 VAL 13 2HG1 VAL 13 -18.980 12.307 -10.796 99 HG13 VAL 13 3HG1 VAL 13 -18.864 13.394 -12.180 100 HG21 VAL 13 3HG2 VAL 13 -18.478 14.396 -8.877 101 HG22 VAL 13 1HG2 VAL 13 -19.060 15.939 -9.503 102 HG23 VAL 13 2HG2 VAL 13 -20.107 14.947 -8.488 103 H LYS 14 H LYS 14 -22.903 15.211 -11.390 104 HA LYS 14 HA LYS 14 -23.128 17.845 -10.137 105 HB2 LYS 14 1HB LYS 14 -25.017 16.070 -11.639 106 HB3 LYS 14 2HB LYS 14 -25.656 17.311 -10.568 107 HG2 LYS 14 1HG LYS 14 -25.609 18.425 -12.567 108 HG3 LYS 14 2HG LYS 14 -24.042 18.878 -11.892 109 HD2 LYS 14 1HD LYS 14 -23.011 17.023 -13.182 110 HD3 LYS 14 2HD LYS 14 -24.581 16.716 -13.927 111 HE2 LYS 14 1HE LYS 14 -23.411 19.461 -14.031 112 HE3 LYS 14 2HE LYS 14 -22.808 18.221 -15.129 113 HZ1 LYS 14 3HZ LYS 14 -25.132 19.756 -15.369 114 HZ2 LYS 14 1HZ LYS 14 -25.607 18.145 -15.161 115 HZ3 LYS 14 2HZ LYS 14 -24.556 18.561 -16.419 116 H THR 15 H THR 15 -23.586 18.089 -8.050 117 HA THR 15 HA THR 15 -24.099 15.724 -6.435 118 HB THR 15 HB THR 15 -23.608 17.067 -4.518 119 HG1 THR 15 HG1 THR 15 -23.295 19.408 -6.047 120 HG21 THR 15 3HG2 THR 15 -21.565 18.401 -6.037 121 HG22 THR 15 1HG2 THR 15 -21.818 16.774 -6.666 122 HG23 THR 15 2HG2 THR 15 -21.424 17.010 -4.963 123 H LEU 16 H LEU 16 -25.567 16.421 -4.383 124 HA LEU 16 HA LEU 16 -28.210 16.617 -5.451 125 HB2 LEU 16 1HB LEU 16 -27.240 16.619 -2.597 126 HB3 LEU 16 2HB LEU 16 -28.923 16.466 -3.098 127 HG LEU 16 HG LEU 16 -26.843 14.482 -3.966 128 HD11 LEU 16 1HD1 LEU 16 -28.350 13.382 -1.870 129 HD12 LEU 16 2HD1 LEU 16 -27.761 14.939 -1.291 130 HD13 LEU 16 3HD1 LEU 16 -26.622 13.735 -1.892 131 HD21 LEU 16 3HD2 LEU 16 -28.817 14.251 -5.207 132 HD22 LEU 16 1HD2 LEU 16 -29.841 14.549 -3.802 133 HD23 LEU 16 2HD2 LEU 16 -28.947 13.034 -3.936 134 H THR 17 H THR 17 -25.925 18.862 -4.221 135 HA THR 17 HA THR 17 -27.958 20.899 -3.715 136 HB THR 17 HB THR 17 -26.116 20.695 -2.096 137 HG1 THR 17 HG1 THR 17 -26.166 22.806 -1.849 138 HG21 THR 17 3HG2 THR 17 -23.854 21.552 -2.827 139 HG22 THR 17 1HG2 THR 17 -24.411 21.366 -4.490 140 HG23 THR 17 2HG2 THR 17 -24.294 19.956 -3.436 141 H GLY 18 H GLY 18 -27.310 19.847 -6.431 142 HA2 GLY 18 1HA GLY 18 -26.968 20.642 -8.560 143 HA3 GLY 18 2HA GLY 18 -27.582 22.159 -7.919 144 H LYS 19 H LYS 19 -24.617 20.545 -6.911 145 HA LYS 19 HA LYS 19 -23.102 22.817 -8.023 146 HB2 LYS 19 1HB LYS 19 -23.031 22.938 -5.634 147 HB3 LYS 19 2HB LYS 19 -22.661 21.224 -5.498 148 HG2 LYS 19 1HG LYS 19 -20.756 22.889 -7.031 149 HG3 LYS 19 2HG LYS 19 -20.812 23.124 -5.282 150 HD2 LYS 19 1HD LYS 19 -20.744 20.466 -5.315 151 HD3 LYS 19 2HD LYS 19 -19.948 20.762 -6.862 152 HE2 LYS 19 1HE LYS 19 -18.273 20.599 -5.147 153 HE3 LYS 19 2HE LYS 19 -18.360 22.271 -5.699 154 HZ1 LYS 19 3HZ LYS 19 -18.479 21.448 -3.115 155 HZ2 LYS 19 1HZ LYS 19 -20.104 21.731 -3.489 156 HZ3 LYS 19 2HZ LYS 19 -18.964 22.964 -3.687 157 H THR 20 H THR 20 -21.655 22.343 -9.534 158 HA THR 20 HA THR 20 -21.048 19.561 -10.112 159 HB THR 20 HB THR 20 -19.818 21.778 -11.680 160 HG1 THR 20 HG1 THR 20 -21.683 22.492 -12.421 161 HG21 THR 20 3HG2 THR 20 -20.127 20.291 -13.513 162 HG22 THR 20 1HG2 THR 20 -21.236 19.279 -12.590 163 HG23 THR 20 2HG2 THR 20 -19.524 19.320 -12.170 164 H ILE 21 H ILE 21 -19.268 18.562 -9.450 165 HA ILE 21 HA ILE 21 -16.946 20.201 -8.666 166 HB ILE 21 HB ILE 21 -17.918 19.244 -6.678 167 HG12 ILE 21 1HG1 ILE 21 -15.320 19.077 -7.314 168 HG13 ILE 21 2HG1 ILE 21 -15.953 18.514 -5.772 169 HG21 ILE 21 1HG2 ILE 21 -19.204 17.447 -7.583 170 HG22 ILE 21 2HG2 ILE 21 -17.753 16.626 -8.156 171 HG23 ILE 21 3HG2 ILE 21 -18.063 16.762 -6.425 172 HD11 ILE 21 3HD1 ILE 21 -15.751 16.661 -8.107 173 HD12 ILE 21 1HD1 ILE 21 -14.352 17.000 -7.088 174 HD13 ILE 21 2HD1 ILE 21 -15.804 16.287 -6.385 175 H THR 22 H THR 22 -15.010 19.677 -9.504 176 HA THR 22 HA THR 22 -14.924 17.678 -11.588 177 HB THR 22 HB THR 22 -12.508 19.198 -10.671 178 HG1 THR 22 HG1 THR 22 -14.749 20.219 -12.091 179 HG21 THR 22 3HG2 THR 22 -12.428 17.472 -12.497 180 HG22 THR 22 1HG2 THR 22 -11.876 19.078 -12.971 181 HG23 THR 22 2HG2 THR 22 -13.482 18.522 -13.444 182 H LEU 23 H LEU 23 -14.187 15.667 -11.394 183 HA LEU 23 HA LEU 23 -12.585 14.992 -9.014 184 HB2 LEU 23 1HB LEU 23 -15.019 14.085 -9.342 185 HB3 LEU 23 2HB LEU 23 -14.235 12.962 -10.451 186 HG LEU 23 HG LEU 23 -12.767 12.241 -8.562 187 HD11 LEU 23 1HD1 LEU 23 -12.758 13.949 -7.008 188 HD12 LEU 23 2HD1 LEU 23 -13.853 12.781 -6.269 189 HD13 LEU 23 3HD1 LEU 23 -14.502 14.191 -7.107 190 HD21 LEU 23 3HD2 LEU 23 -14.738 11.118 -7.305 191 HD22 LEU 23 1HD2 LEU 23 -14.475 10.747 -9.009 192 HD23 LEU 23 2HD2 LEU 23 -15.737 11.887 -8.540 193 H GLU 24 H GLU 24 -10.815 13.666 -9.263 194 HA GLU 24 HA GLU 24 -9.843 13.396 -12.005 195 HB2 GLU 24 1HB GLU 24 -8.613 13.732 -9.368 196 HB3 GLU 24 2HB GLU 24 -7.810 12.527 -10.365 197 HG2 GLU 24 1HG GLU 24 -8.464 15.133 -11.615 198 HG3 GLU 24 2HG GLU 24 -7.156 15.088 -10.434 199 H VAL 25 H VAL 25 -10.054 11.537 -13.042 200 HA VAL 25 HA VAL 25 -9.761 9.024 -11.575 201 HB VAL 25 HB VAL 25 -11.895 8.972 -13.608 202 HG11 VAL 25 1HG1 VAL 25 -12.862 7.373 -12.153 203 HG12 VAL 25 2HG1 VAL 25 -11.124 7.066 -12.143 204 HG13 VAL 25 3HG1 VAL 25 -11.879 7.913 -10.792 205 HG21 VAL 25 3HG2 VAL 25 -13.572 9.792 -11.899 206 HG22 VAL 25 1HG2 VAL 25 -12.203 10.474 -11.020 207 HG23 VAL 25 2HG2 VAL 25 -12.568 11.030 -12.653 208 H GLU 26 H GLU 26 -9.048 7.281 -12.829 209 HA GLU 26 HA GLU 26 -7.667 8.065 -15.256 210 HB2 GLU 26 1HB GLU 26 -7.657 5.306 -14.060 211 HB3 GLU 26 2HB GLU 26 -6.420 6.081 -15.039 212 HG2 GLU 26 1HG GLU 26 -5.878 7.582 -13.214 213 HG3 GLU 26 2HG GLU 26 -7.157 6.871 -12.231 214 HA PRO 27 HA PRO 27 -10.456 6.329 -18.165 215 HB2 PRO 27 1HB PRO 27 -8.748 5.384 -20.052 216 HB3 PRO 27 2HB PRO 27 -9.048 7.108 -19.806 217 HG2 PRO 27 1HG PRO 27 -6.771 5.424 -18.835 218 HG3 PRO 27 2HG PRO 27 -6.740 7.055 -19.531 219 HD2 PRO 27 1HD PRO 27 -6.578 6.605 -16.866 220 HD3 PRO 27 2HD PRO 27 -7.354 8.051 -17.544 221 H SER 28 H SER 28 -8.229 4.378 -16.479 222 HA SER 28 HA SER 28 -9.478 1.918 -17.507 223 HB2 SER 28 1HB SER 28 -7.340 1.097 -15.971 224 HB3 SER 28 2HB SER 28 -7.325 1.280 -17.725 225 HG SER 28 HG SER 28 -6.517 3.374 -17.449 226 H ASP 29 H ASP 29 -9.347 4.012 -14.859 227 HA ASP 29 HA ASP 29 -9.725 2.193 -12.726 228 HB2 ASP 29 1HB ASP 29 -10.335 5.121 -13.077 229 HB3 ASP 29 2HB ASP 29 -10.752 4.263 -11.596 230 H THR 30 H THR 30 -11.703 1.899 -11.477 231 HA THR 30 HA THR 30 -14.056 1.736 -13.240 232 HB THR 30 HB THR 30 -14.828 0.049 -11.415 233 HG1 THR 30 HG1 THR 30 -12.903 -1.033 -10.531 234 HG21 THR 30 3HG2 THR 30 -13.295 -0.210 -13.811 235 HG22 THR 30 1HG2 THR 30 -14.484 -1.322 -13.135 236 HG23 THR 30 2HG2 THR 30 -12.788 -1.456 -12.671 237 H ILE 31 H ILE 31 -16.171 1.673 -11.889 238 HA ILE 31 HA ILE 31 -16.663 4.175 -10.842 239 HB ILE 31 HB ILE 31 -18.135 1.638 -10.119 240 HG12 ILE 31 1HG1 ILE 31 -17.979 1.949 -12.547 241 HG13 ILE 31 2HG1 ILE 31 -19.626 2.212 -11.987 242 HG21 ILE 31 1HG2 ILE 31 -19.096 3.092 -8.675 243 HG22 ILE 31 2HG2 ILE 31 -18.623 4.507 -9.614 244 HG23 ILE 31 3HG2 ILE 31 -20.014 3.544 -10.111 245 HD11 ILE 31 3HD1 ILE 31 -17.984 3.931 -13.510 246 HD12 ILE 31 1HD1 ILE 31 -19.635 4.197 -12.950 247 HD13 ILE 31 2HD1 ILE 31 -18.272 4.703 -11.951 248 H GLU 32 H GLU 32 -15.758 1.214 -9.131 249 HA GLU 32 HA GLU 32 -16.108 2.055 -6.513 250 HB2 GLU 32 1HB GLU 32 -14.291 0.416 -5.955 251 HB3 GLU 32 2HB GLU 32 -15.587 -0.235 -6.948 252 HG2 GLU 32 1HG GLU 32 -14.254 -0.262 -8.872 253 HG3 GLU 32 2HG GLU 32 -13.046 0.801 -8.152 254 H ASN 33 H ASN 33 -13.548 2.790 -8.781 255 HA ASN 33 HA ASN 33 -11.807 3.966 -6.826 256 HB2 ASN 33 1HB ASN 33 -11.771 3.482 -9.722 257 HB3 ASN 33 2HB ASN 33 -10.982 4.981 -9.241 258 HD21 ASN 33 2HD2 ASN 33 -8.967 4.876 -8.532 259 HD22 ASN 33 1HD2 ASN 33 -8.133 3.431 -8.083 260 H VAL 34 H VAL 34 -14.312 5.097 -8.995 261 HA VAL 34 HA VAL 34 -13.800 7.837 -8.959 262 HB VAL 34 HB VAL 34 -16.477 6.440 -9.068 263 HG11 VAL 34 1HG1 VAL 34 -16.822 8.737 -8.476 264 HG12 VAL 34 2HG1 VAL 34 -15.696 9.277 -9.723 265 HG13 VAL 34 3HG1 VAL 34 -17.231 8.538 -10.179 266 HG21 VAL 34 3HG2 VAL 34 -16.268 6.753 -11.498 267 HG22 VAL 34 1HG2 VAL 34 -14.651 7.417 -11.262 268 HG23 VAL 34 2HG2 VAL 34 -14.982 5.734 -10.850 269 H LYS 35 H LYS 35 -16.008 5.985 -6.857 270 HA LYS 35 HA LYS 35 -16.759 8.089 -5.191 271 HB2 LYS 35 1HB LYS 35 -17.632 6.461 -3.725 272 HB3 LYS 35 2HB LYS 35 -17.749 5.743 -5.327 273 HG2 LYS 35 1HG LYS 35 -16.841 3.963 -4.310 274 HG3 LYS 35 2HG LYS 35 -15.328 4.833 -4.573 275 HD2 LYS 35 1HD LYS 35 -15.226 5.569 -2.363 276 HD3 LYS 35 2HD LYS 35 -16.947 5.284 -2.090 277 HE2 LYS 35 1HE LYS 35 -16.653 3.069 -1.678 278 HE3 LYS 35 2HE LYS 35 -15.293 2.931 -2.792 279 HZ1 LYS 35 3HZ LYS 35 -14.601 2.651 -0.491 280 HZ2 LYS 35 1HZ LYS 35 -15.192 4.188 -0.103 281 HZ3 LYS 35 2HZ LYS 35 -13.889 4.028 -1.169 282 H ALA 36 H ALA 36 -13.848 6.202 -5.275 283 HA ALA 36 HA ALA 36 -12.869 6.529 -2.701 284 HB1 ALA 36 1HB ALA 36 -11.914 5.350 -4.900 285 HB2 ALA 36 2HB ALA 36 -10.919 6.807 -4.907 286 HB3 ALA 36 3HB ALA 36 -10.906 5.736 -3.506 287 H LYS 37 H LYS 37 -12.577 8.710 -5.488 288 HA LYS 37 HA LYS 37 -11.095 10.680 -4.026 289 HB2 LYS 37 1HB LYS 37 -11.081 10.269 -6.562 290 HB3 LYS 37 2HB LYS 37 -12.593 11.167 -6.593 291 HG2 LYS 37 1HG LYS 37 -11.041 12.798 -7.072 292 HG3 LYS 37 2HG LYS 37 -11.251 12.987 -5.329 293 HD2 LYS 37 1HD LYS 37 -9.248 11.557 -4.988 294 HD3 LYS 37 2HD LYS 37 -9.015 11.530 -6.738 295 HE2 LYS 37 1HE LYS 37 -8.726 13.931 -6.770 296 HE3 LYS 37 2HE LYS 37 -9.080 14.026 -5.046 297 HZ1 LYS 37 3HZ LYS 37 -6.957 12.202 -5.598 298 HZ2 LYS 37 1HZ LYS 37 -6.989 13.527 -4.548 299 HZ3 LYS 37 2HZ LYS 37 -6.608 13.751 -6.180 300 H ILE 38 H ILE 38 -14.457 10.054 -4.689 301 HA ILE 38 HA ILE 38 -15.519 12.591 -4.123 302 HB ILE 38 HB ILE 38 -16.769 9.872 -3.714 303 HG12 ILE 38 1HG1 ILE 38 -16.084 10.366 -6.038 304 HG13 ILE 38 2HG1 ILE 38 -17.833 10.270 -5.871 305 HG21 ILE 38 1HG2 ILE 38 -17.925 12.643 -3.604 306 HG22 ILE 38 2HG2 ILE 38 -18.916 11.220 -3.925 307 HG23 ILE 38 3HG2 ILE 38 -18.036 11.357 -2.403 308 HD11 ILE 38 3HD1 ILE 38 -17.292 12.102 -7.300 309 HD12 ILE 38 1HD1 ILE 38 -17.899 12.746 -5.775 310 HD13 ILE 38 2HD1 ILE 38 -16.167 12.761 -6.112 311 H GLN 39 H GLN 39 -14.401 10.021 -2.051 312 HA GLN 39 HA GLN 39 -15.660 10.651 0.337 313 HB2 GLN 39 1HB GLN 39 -13.050 9.384 -0.364 314 HB3 GLN 39 2HB GLN 39 -13.351 9.814 1.314 315 HG2 GLN 39 1HG GLN 39 -15.382 8.453 1.296 316 HG3 GLN 39 2HG GLN 39 -15.065 8.013 -0.381 317 HE21 GLN 39 2HE2 GLN 39 -15.005 6.758 2.523 318 HE22 GLN 39 1HE2 GLN 39 -13.632 5.715 2.424 319 H ASP 40 H ASP 40 -12.978 12.214 -1.266 320 HA ASP 40 HA ASP 40 -12.250 13.836 0.991 321 HB2 ASP 40 1HB ASP 40 -10.672 13.168 -0.854 322 HB3 ASP 40 2HB ASP 40 -11.536 14.280 -1.912 323 H LYS 41 H LYS 41 -14.566 14.015 -1.544 324 HA LYS 41 HA LYS 41 -14.926 16.884 -1.329 325 HB2 LYS 41 1HB LYS 41 -16.786 15.003 -2.758 326 HB3 LYS 41 2HB LYS 41 -16.460 16.697 -3.102 327 HG2 LYS 41 1HG LYS 41 -14.498 14.446 -3.496 328 HG3 LYS 41 2HG LYS 41 -15.483 15.174 -4.766 329 HD2 LYS 41 1HD LYS 41 -14.241 17.082 -4.825 330 HD3 LYS 41 2HD LYS 41 -13.843 17.004 -3.107 331 HE2 LYS 41 1HE LYS 41 -11.831 16.270 -3.717 332 HE3 LYS 41 2HE LYS 41 -12.617 14.767 -4.198 333 HZ1 LYS 41 3HZ LYS 41 -12.971 15.795 -6.414 334 HZ2 LYS 41 1HZ LYS 41 -11.342 15.557 -6.025 335 HZ3 LYS 41 2HZ LYS 41 -12.018 17.104 -5.924 336 H GLU 42 H GLU 42 -16.808 13.957 -0.586 337 HA GLU 42 HA GLU 42 -18.406 15.580 1.284 338 HB2 GLU 42 1HB GLU 42 -19.331 13.103 -0.178 339 HB3 GLU 42 2HB GLU 42 -20.302 14.135 0.862 340 HG2 GLU 42 1HG GLU 42 -19.028 15.056 -1.701 341 HG3 GLU 42 2HG GLU 42 -20.682 14.459 -1.574 342 H GLY 43 H GLY 43 -16.820 12.499 0.675 343 HA2 GLY 43 1HA GLY 43 -15.860 11.032 2.178 344 HA3 GLY 43 2HA GLY 43 -16.302 12.137 3.472 345 H ILE 44 H ILE 44 -17.983 10.035 1.128 346 HA ILE 44 HA ILE 44 -19.577 8.996 3.377 347 HB ILE 44 HB ILE 44 -21.431 8.659 1.688 348 HG12 ILE 44 1HG1 ILE 44 -19.753 10.617 0.103 349 HG13 ILE 44 2HG1 ILE 44 -20.068 8.943 -0.338 350 HG21 ILE 44 1HG2 ILE 44 -20.921 10.703 3.369 351 HG22 ILE 44 2HG2 ILE 44 -21.049 11.575 1.842 352 HG23 ILE 44 3HG2 ILE 44 -22.388 10.572 2.400 353 HD11 ILE 44 3HD1 ILE 44 -21.464 10.448 -1.614 354 HD12 ILE 44 1HD1 ILE 44 -22.450 9.456 -0.540 355 HD13 ILE 44 2HD1 ILE 44 -22.114 11.138 -0.127 356 HA PRO 45 HA PRO 45 -18.356 4.964 2.132 357 HB2 PRO 45 1HB PRO 45 -20.515 3.523 2.930 358 HB3 PRO 45 2HB PRO 45 -19.346 4.210 4.064 359 HG2 PRO 45 1HG PRO 45 -22.032 5.251 3.249 360 HG3 PRO 45 2HG PRO 45 -21.304 5.176 4.864 361 HD2 PRO 45 1HD PRO 45 -21.360 7.450 3.396 362 HD3 PRO 45 2HD PRO 45 -20.039 7.071 4.520 363 HA PRO 46 HA PRO 46 -20.059 3.844 -1.764 364 HB2 PRO 46 1HB PRO 46 -19.896 1.134 -1.728 365 HB3 PRO 46 2HB PRO 46 -18.479 2.180 -1.877 366 HG2 PRO 46 1HG PRO 46 -19.569 0.799 0.546 367 HG3 PRO 46 2HG PRO 46 -17.885 0.959 0.011 368 HD2 PRO 46 1HD PRO 46 -18.951 2.517 1.952 369 HD3 PRO 46 2HD PRO 46 -17.691 3.099 0.845 370 H ASP 47 H ASP 47 -21.509 2.556 1.113 371 HA ASP 47 HA ASP 47 -23.787 1.406 -0.224 372 HB2 ASP 47 1HB ASP 47 -23.216 1.963 2.692 373 HB3 ASP 47 2HB ASP 47 -24.678 1.170 2.113 374 H GLN 48 H GLN 48 -22.924 4.477 1.139 375 HA GLN 48 HA GLN 48 -25.684 5.425 1.048 376 HB2 GLN 48 1HB GLN 48 -23.127 6.505 2.174 377 HB3 GLN 48 2HB GLN 48 -24.468 7.598 1.853 378 HG2 GLN 48 1HG GLN 48 -24.314 6.723 4.195 379 HG3 GLN 48 2HG GLN 48 -25.868 6.489 3.395 380 HE21 GLN 48 2HE2 GLN 48 -23.346 5.018 5.061 381 HE22 GLN 48 1HE2 GLN 48 -23.806 3.371 4.816 382 H GLN 49 H GLN 49 -22.729 5.576 -0.741 383 HA GLN 49 HA GLN 49 -23.752 7.745 -2.423 384 HB2 GLN 49 1HB GLN 49 -21.559 8.029 -3.240 385 HB3 GLN 49 2HB GLN 49 -21.371 7.733 -1.517 386 HG2 GLN 49 1HG GLN 49 -19.882 6.190 -2.070 387 HG3 GLN 49 2HG GLN 49 -21.240 5.211 -2.622 388 HE21 GLN 49 2HE2 GLN 49 -20.500 4.242 -4.392 389 HE22 GLN 49 1HE2 GLN 49 -19.815 5.045 -5.759 390 H ARG 50 H ARG 50 -24.025 7.518 -4.648 391 HA ARG 50 HA ARG 50 -23.638 4.929 -5.888 392 HB2 ARG 50 1HB ARG 50 -26.230 5.808 -4.901 393 HB3 ARG 50 2HB ARG 50 -26.258 5.486 -6.629 394 HG2 ARG 50 1HG ARG 50 -25.941 3.260 -6.362 395 HG3 ARG 50 2HG ARG 50 -24.953 3.462 -4.914 396 HD2 ARG 50 1HD ARG 50 -26.711 3.059 -3.620 397 HD3 ARG 50 2HD ARG 50 -27.601 4.382 -4.374 398 HE ARG 50 HE ARG 50 -27.927 1.581 -4.869 399 HH11 ARG 50 1HH1 ARG 50 -28.236 4.758 -6.257 400 HH12 ARG 50 2HH1 ARG 50 -29.447 4.283 -7.401 401 HH21 ARG 50 1HH2 ARG 50 -29.520 0.943 -6.371 402 HH22 ARG 50 2HH2 ARG 50 -30.178 2.113 -7.465 403 H LEU 51 H LEU 51 -23.196 5.126 -8.006 404 HA LEU 51 HA LEU 51 -23.319 7.805 -9.162 405 HB2 LEU 51 1HB LEU 51 -21.805 5.307 -9.802 406 HB3 LEU 51 2HB LEU 51 -21.984 6.569 -11.019 407 HG LEU 51 HG LEU 51 -19.848 6.776 -9.905 408 HD11 LEU 51 1HD1 LEU 51 -20.044 8.969 -10.136 409 HD12 LEU 51 2HD1 LEU 51 -20.894 9.077 -8.595 410 HD13 LEU 51 3HD1 LEU 51 -21.800 8.809 -10.084 411 HD21 LEU 51 3HD2 LEU 51 -19.527 6.885 -7.625 412 HD22 LEU 51 1HD2 LEU 51 -20.846 5.720 -7.742 413 HD23 LEU 51 2HD2 LEU 51 -21.186 7.395 -7.308 414 H ILE 52 H ILE 52 -24.548 8.347 -10.884 415 HA ILE 52 HA ILE 52 -26.219 6.225 -12.066 416 HB ILE 52 HB ILE 52 -27.058 9.107 -11.840 417 HG12 ILE 52 1HG1 ILE 52 -26.716 8.289 -9.573 418 HG13 ILE 52 2HG1 ILE 52 -28.440 8.417 -9.904 419 HG21 ILE 52 1HG2 ILE 52 -28.846 8.463 -12.986 420 HG22 ILE 52 2HG2 ILE 52 -28.087 6.888 -13.209 421 HG23 ILE 52 3HG2 ILE 52 -29.164 7.161 -11.840 422 HD11 ILE 52 3HD1 ILE 52 -28.180 5.891 -10.547 423 HD12 ILE 52 1HD1 ILE 52 -26.755 6.002 -9.513 424 HD13 ILE 52 2HD1 ILE 52 -28.348 6.390 -8.864 425 H PHE 53 H PHE 53 -26.494 6.200 -14.260 426 HA PHE 53 HA PHE 53 -25.314 8.351 -15.850 427 HB2 PHE 53 1HB PHE 53 -23.630 6.463 -15.435 428 HB3 PHE 53 2HB PHE 53 -24.662 5.474 -16.463 429 HD1 PHE 53 HD2 PHE 53 -23.133 8.881 -16.534 430 HD2 PHE 53 HD1 PHE 53 -24.027 5.298 -18.652 431 HE1 PHE 53 HE2 PHE 53 -22.002 9.780 -18.526 432 HE2 PHE 53 HE1 PHE 53 -22.896 6.191 -20.646 433 HZ PHE 53 HZ PHE 53 -21.883 8.435 -20.585 434 H ALA 54 H ALA 54 -26.840 8.983 -17.211 435 HA ALA 54 HA ALA 54 -28.648 8.983 -18.598 436 HB1 ALA 54 1HB ALA 54 -28.190 6.208 -19.493 437 HB2 ALA 54 2HB ALA 54 -28.387 7.689 -20.432 438 HB3 ALA 54 3HB ALA 54 -26.836 7.323 -19.677 439 H GLY 55 H GLY 55 -29.112 8.115 -15.899 440 HA2 GLY 55 1HA GLY 55 -31.018 7.451 -14.760 441 HA3 GLY 55 2HA GLY 55 -31.699 6.908 -16.286 442 H LYS 56 H LYS 56 -28.566 5.741 -15.574 443 HA LYS 56 HA LYS 56 -29.696 3.195 -14.613 444 HB2 LYS 56 1HB LYS 56 -29.008 3.098 -17.010 445 HB3 LYS 56 2HB LYS 56 -27.368 3.495 -16.518 446 HG2 LYS 56 1HG LYS 56 -27.378 1.174 -16.794 447 HG3 LYS 56 2HG LYS 56 -27.469 1.425 -15.049 448 HD2 LYS 56 1HD LYS 56 -30.076 1.342 -15.566 449 HD3 LYS 56 2HD LYS 56 -29.512 0.380 -16.934 450 HE2 LYS 56 1HE LYS 56 -28.628 -0.180 -14.119 451 HE3 LYS 56 2HE LYS 56 -30.112 -0.861 -14.782 452 HZ1 LYS 56 3HZ LYS 56 -28.085 -1.307 -16.638 453 HZ2 LYS 56 1HZ LYS 56 -28.903 -2.452 -15.698 454 HZ3 LYS 56 2HZ LYS 56 -27.471 -1.755 -15.127 455 H GLN 57 H GLN 57 -28.880 2.526 -12.744 456 HA GLN 57 HA GLN 57 -26.861 3.965 -11.383 457 HB2 GLN 57 1HB GLN 57 -27.030 2.161 -9.688 458 HB3 GLN 57 2HB GLN 57 -28.593 2.828 -10.141 459 HG2 GLN 57 1HG GLN 57 -28.900 0.901 -11.679 460 HG3 GLN 57 2HG GLN 57 -27.407 0.215 -11.040 461 HE21 GLN 57 2HE2 GLN 57 -27.372 0.067 -8.592 462 HE22 GLN 57 1HE2 GLN 57 -28.813 -0.516 -7.839 463 H LEU 58 H LEU 58 -24.735 3.844 -11.601 464 HA LEU 58 HA LEU 58 -23.529 1.772 -13.194 465 HB2 LEU 58 1HB LEU 58 -22.196 3.970 -11.622 466 HB3 LEU 58 2HB LEU 58 -21.472 3.001 -12.904 467 HG LEU 58 HG LEU 58 -23.739 4.956 -13.285 468 HD11 LEU 58 1HD1 LEU 58 -22.254 6.568 -13.876 469 HD12 LEU 58 2HD1 LEU 58 -21.038 5.411 -14.416 470 HD13 LEU 58 3HD1 LEU 58 -21.262 5.715 -12.693 471 HD21 LEU 58 3HD2 LEU 58 -22.329 4.368 -15.667 472 HD22 LEU 58 1HD2 LEU 58 -24.009 4.005 -15.270 473 HD23 LEU 58 2HD2 LEU 58 -22.742 2.834 -14.901 474 H GLU 59 H GLU 59 -21.732 0.457 -12.484 475 HA GLU 59 HA GLU 59 -21.396 0.074 -9.625 476 HB2 GLU 59 1HB GLU 59 -21.829 -2.403 -9.862 477 HB3 GLU 59 2HB GLU 59 -23.252 -1.373 -9.936 478 HG2 GLU 59 1HG GLU 59 -23.436 -1.633 -12.276 479 HG3 GLU 59 2HG GLU 59 -21.838 -2.367 -12.391 480 H ASP 60 H ASP 60 -19.695 -1.575 -9.161 481 HA ASP 60 HA ASP 60 -17.359 -1.032 -10.590 482 HB2 ASP 60 1HB ASP 60 -16.305 -2.744 -9.237 483 HB3 ASP 60 2HB ASP 60 -17.431 -1.830 -8.238 484 H GLY 61 H GLY 61 -15.940 -3.104 -11.282 485 HA2 GLY 61 1HA GLY 61 -15.828 -5.066 -12.600 486 HA3 GLY 61 2HA GLY 61 -17.530 -4.869 -12.994 487 H ARG 62 H ARG 62 -17.504 -2.201 -13.845 488 HA ARG 62 HA ARG 62 -15.932 -2.451 -16.322 489 HB2 ARG 62 1HB ARG 62 -18.687 -1.554 -15.753 490 HB3 ARG 62 2HB ARG 62 -17.804 -0.580 -16.921 491 HG2 ARG 62 1HG ARG 62 -17.287 -2.743 -18.129 492 HG3 ARG 62 2HG ARG 62 -18.484 -3.499 -17.076 493 HD2 ARG 62 1HD ARG 62 -20.151 -1.843 -17.863 494 HD3 ARG 62 2HD ARG 62 -18.947 -1.214 -18.987 495 HE ARG 62 HE ARG 62 -19.372 -4.029 -19.277 496 HH11 ARG 62 1HH1 ARG 62 -20.578 -0.879 -20.138 497 HH12 ARG 62 2HH1 ARG 62 -21.352 -1.428 -21.588 498 HH21 ARG 62 1HH2 ARG 62 -20.386 -4.764 -21.183 499 HH22 ARG 62 2HH2 ARG 62 -21.242 -3.638 -22.181 500 H THR 63 H THR 63 -15.002 -0.550 -17.229 501 HA THR 63 HA THR 63 -14.173 1.366 -15.184 502 HB THR 63 HB THR 63 -12.330 0.417 -16.363 503 HG1 THR 63 HG1 THR 63 -11.878 2.538 -16.081 504 HG21 THR 63 3HG2 THR 63 -12.788 -0.438 -18.389 505 HG22 THR 63 1HG2 THR 63 -12.437 1.179 -18.997 506 HG23 THR 63 2HG2 THR 63 -14.103 0.701 -18.673 507 H LEU 64 H LEU 64 -14.047 3.655 -15.708 508 HA LEU 64 HA LEU 64 -16.450 4.746 -16.546 509 HB2 LEU 64 1HB LEU 64 -13.747 6.078 -16.624 510 HB3 LEU 64 2HB LEU 64 -15.310 6.891 -16.591 511 HG LEU 64 HG LEU 64 -14.808 7.100 -14.399 512 HD11 LEU 64 1HD1 LEU 64 -15.588 4.219 -14.140 513 HD12 LEU 64 2HD1 LEU 64 -16.740 5.433 -14.693 514 HD13 LEU 64 3HD1 LEU 64 -16.000 5.582 -13.100 515 HD21 LEU 64 3HD2 LEU 64 -12.857 5.029 -15.023 516 HD22 LEU 64 1HD2 LEU 64 -13.516 4.892 -13.392 517 HD23 LEU 64 2HD2 LEU 64 -12.748 6.394 -13.909 518 H SER 65 H SER 65 -13.495 4.163 -18.386 519 HA SER 65 HA SER 65 -14.218 5.515 -20.735 520 HB2 SER 65 1HB SER 65 -11.933 4.806 -20.392 521 HB3 SER 65 2HB SER 65 -12.422 3.112 -20.329 522 HG SER 65 HG SER 65 -12.536 3.060 -22.441 523 H GLU 66 H GLU 66 -14.856 2.220 -19.644 524 HA GLU 66 HA GLU 66 -16.076 1.395 -22.098 525 HB2 GLU 66 1HB GLU 66 -15.965 0.215 -19.330 526 HB3 GLU 66 2HB GLU 66 -16.920 -0.520 -20.610 527 HG2 GLU 66 1HG GLU 66 -14.047 0.093 -21.102 528 HG3 GLU 66 2HG GLU 66 -14.484 -1.318 -20.140 529 H TYR 67 H TYR 67 -17.125 3.104 -19.308 530 HA TYR 67 HA TYR 67 -19.944 2.577 -19.819 531 HB2 TYR 67 1HB TYR 67 -18.374 3.791 -17.615 532 HB3 TYR 67 2HB TYR 67 -19.997 4.426 -17.863 533 HD1 TYR 67 HD1 TYR 67 -21.661 2.230 -18.487 534 HD2 TYR 67 HD2 TYR 67 -18.321 2.311 -15.853 535 HE1 TYR 67 HE1 TYR 67 -22.601 0.325 -17.247 536 HE2 TYR 67 HE2 TYR 67 -19.251 0.406 -14.606 537 HH TYR 67 HH TYR 67 -22.062 -0.490 -14.445 538 H ASN 68 H ASN 68 -17.927 4.267 -21.487 539 HA ASN 68 HA ASN 68 -18.072 6.051 -22.891 540 HB2 ASN 68 1HB ASN 68 -20.932 6.403 -22.002 541 HB3 ASN 68 2HB ASN 68 -20.212 6.843 -23.548 542 HD21 ASN 68 2HD2 ASN 68 -18.889 4.641 -24.303 543 HD22 ASN 68 1HD2 ASN 68 -19.974 3.311 -24.508 544 H ILE 69 H ILE 69 -17.633 6.283 -19.879 545 HA ILE 69 HA ILE 69 -18.413 9.061 -19.425 546 HB ILE 69 HB ILE 69 -17.028 7.104 -17.588 547 HG12 ILE 69 1HG1 ILE 69 -19.825 8.171 -17.293 548 HG13 ILE 69 2HG1 ILE 69 -19.498 6.749 -18.279 549 HG21 ILE 69 1HG2 ILE 69 -17.248 9.938 -17.460 550 HG22 ILE 69 2HG2 ILE 69 -18.239 9.238 -16.181 551 HG23 ILE 69 3HG2 ILE 69 -16.527 8.832 -16.291 552 HD11 ILE 69 3HD1 ILE 69 -18.451 5.696 -16.285 553 HD12 ILE 69 1HD1 ILE 69 -18.993 7.080 -15.335 554 HD13 ILE 69 2HD1 ILE 69 -20.175 6.028 -16.115 555 H GLN 70 H GLN 70 -17.090 10.341 -20.627 556 HA GLN 70 HA GLN 70 -14.210 9.896 -20.563 557 HB2 GLN 70 1HB GLN 70 -15.675 12.097 -22.012 558 HB3 GLN 70 2HB GLN 70 -14.055 11.488 -22.328 559 HG2 GLN 70 1HG GLN 70 -15.266 9.251 -22.821 560 HG3 GLN 70 2HG GLN 70 -16.696 10.268 -22.992 561 HE21 GLN 70 2HE2 GLN 70 -17.105 10.650 -25.039 562 HE22 GLN 70 1HE2 GLN 70 -15.940 10.982 -26.270 563 H LYS 71 H LYS 71 -13.221 12.435 -20.784 564 HA LYS 71 HA LYS 71 -13.215 13.286 -18.060 565 HB2 LYS 71 1HB LYS 71 -11.567 14.886 -18.730 566 HB3 LYS 71 2HB LYS 71 -11.244 13.397 -19.608 567 HG2 LYS 71 1HG LYS 71 -12.569 14.429 -21.521 568 HG3 LYS 71 2HG LYS 71 -12.429 15.952 -20.639 569 HD2 LYS 71 1HD LYS 71 -10.123 14.223 -21.537 570 HD3 LYS 71 2HD LYS 71 -10.664 15.705 -22.328 571 HE2 LYS 71 1HE LYS 71 -10.290 16.824 -20.054 572 HE3 LYS 71 2HE LYS 71 -9.387 15.370 -19.631 573 HZ1 LYS 71 3HZ LYS 71 -7.763 16.767 -20.447 574 HZ2 LYS 71 1HZ LYS 71 -8.756 17.417 -21.653 575 HZ3 LYS 71 2HZ LYS 71 -8.141 15.850 -21.817 576 H GLU 72 H GLU 72 -15.330 13.870 -20.562 577 HA GLU 72 HA GLU 72 -16.232 16.381 -19.312 578 HB2 GLU 72 1HB GLU 72 -16.669 15.683 -22.211 579 HB3 GLU 72 2HB GLU 72 -16.916 17.235 -21.423 580 HG2 GLU 72 1HG GLU 72 -14.364 17.093 -20.946 581 HG3 GLU 72 2HG GLU 72 -14.375 15.925 -22.266 582 H SER 73 H SER 73 -16.946 13.503 -18.879 583 HA SER 73 HA SER 73 -19.610 13.194 -19.913 584 HB2 SER 73 1HB SER 73 -19.377 11.053 -19.257 585 HB3 SER 73 2HB SER 73 -17.710 11.471 -18.860 586 HG SER 73 HG SER 73 -19.957 11.420 -17.139 587 H THR 74 H THR 74 -21.338 12.527 -18.173 588 HA THR 74 HA THR 74 -21.339 14.566 -16.045 589 HB THR 74 HB THR 74 -23.949 13.770 -17.217 590 HG1 THR 74 HG1 THR 74 -23.582 15.517 -18.819 591 HG21 THR 74 3HG2 THR 74 -24.300 16.269 -16.885 592 HG22 THR 74 1HG2 THR 74 -22.727 16.280 -16.090 593 HG23 THR 74 2HG2 THR 74 -24.043 15.311 -15.428 594 H LEU 75 H LEU 75 -21.289 13.562 -14.148 595 HA LEU 75 HA LEU 75 -22.684 10.990 -13.864 596 HB2 LEU 75 1HB LEU 75 -20.156 12.021 -12.904 597 HB3 LEU 75 2HB LEU 75 -21.148 11.406 -11.583 598 HG LEU 75 HG LEU 75 -19.661 9.675 -12.339 599 HD11 LEU 75 1HD1 LEU 75 -22.064 8.611 -13.608 600 HD12 LEU 75 2HD1 LEU 75 -22.369 9.400 -12.061 601 HD13 LEU 75 3HD1 LEU 75 -21.209 8.075 -12.162 602 HD21 LEU 75 3HD2 LEU 75 -19.225 10.490 -14.587 603 HD22 LEU 75 1HD2 LEU 75 -20.877 10.100 -15.067 604 HD23 LEU 75 2HD2 LEU 75 -19.757 8.808 -14.632 605 H HIS 76 H HIS 76 -23.916 10.586 -11.956 606 HA HIS 76 HA HIS 76 -24.777 12.996 -10.505 607 HB2 HIS 76 1HB HIS 76 -26.450 11.005 -11.983 608 HB3 HIS 76 2HB HIS 76 -27.101 11.752 -10.527 609 HD1 HIS 76 HD1 HIS 76 -25.681 12.771 -13.895 610 HD2 HIS 76 HD2 HIS 76 -28.204 14.207 -10.923 611 HE1 HIS 76 HE1 HIS 76 -26.657 14.899 -14.812 612 H LEU 77 H LEU 77 -24.401 12.739 -8.414 613 HA LEU 77 HA LEU 77 -24.245 10.039 -7.301 614 HB2 LEU 77 1HB LEU 77 -23.272 11.220 -5.318 615 HB3 LEU 77 2HB LEU 77 -22.337 11.342 -6.807 616 HG LEU 77 HG LEU 77 -24.201 13.567 -6.303 617 HD11 LEU 77 1HD1 LEU 77 -22.808 12.696 -4.110 618 HD12 LEU 77 2HD1 LEU 77 -23.387 14.340 -4.375 619 HD13 LEU 77 3HD1 LEU 77 -21.729 13.910 -4.797 620 HD21 LEU 77 3HD2 LEU 77 -21.273 13.773 -6.850 621 HD22 LEU 77 1HD2 LEU 77 -22.595 14.808 -7.391 622 HD23 LEU 77 2HD2 LEU 77 -22.363 13.220 -8.123 623 H VAL 78 H VAL 78 -25.959 9.226 -6.311 624 HA VAL 78 HA VAL 78 -27.881 11.077 -5.061 625 HB VAL 78 HB VAL 78 -29.482 9.099 -5.251 626 HG11 VAL 78 1HG1 VAL 78 -30.314 9.967 -7.179 627 HG12 VAL 78 2HG1 VAL 78 -29.116 11.214 -6.827 628 HG13 VAL 78 3HG1 VAL 78 -28.752 9.944 -7.995 629 HG21 VAL 78 3HG2 VAL 78 -28.984 7.268 -6.530 630 HG22 VAL 78 1HG2 VAL 78 -27.793 8.134 -7.501 631 HG23 VAL 78 2HG2 VAL 78 -27.387 7.612 -5.866 632 H LEU 79 H LEU 79 -28.256 10.927 -2.936 633 HA LEU 79 HA LEU 79 -26.881 8.805 -1.454 634 HB2 LEU 79 1HB LEU 79 -27.755 11.578 -0.820 635 HB3 LEU 79 2HB LEU 79 -27.633 10.414 0.498 636 HG LEU 79 HG LEU 79 -25.630 11.880 0.186 637 HD11 LEU 79 1HD1 LEU 79 -24.433 9.298 -0.302 638 HD12 LEU 79 2HD1 LEU 79 -25.803 9.177 0.801 639 HD13 LEU 79 3HD1 LEU 79 -24.467 10.266 1.172 640 HD21 LEU 79 3HD2 LEU 79 -25.004 10.188 -2.211 641 HD22 LEU 79 1HD2 LEU 79 -24.211 11.662 -1.657 642 HD23 LEU 79 2HD2 LEU 79 -25.824 11.742 -2.365 643 H ARG 80 H ARG 80 -27.928 7.402 -0.125 644 HA ARG 80 HA ARG 80 -30.871 7.553 -0.112 645 HB2 ARG 80 1HB ARG 80 -29.469 5.592 -1.271 646 HB3 ARG 80 2HB ARG 80 -29.504 4.958 0.369 647 HG2 ARG 80 1HG ARG 80 -32.061 5.890 -0.812 648 HG3 ARG 80 2HG ARG 80 -31.374 4.374 -1.398 649 HD2 ARG 80 1HD ARG 80 -31.320 3.490 0.856 650 HD3 ARG 80 2HD ARG 80 -31.899 5.027 1.498 651 HE ARG 80 HE ARG 80 -33.474 2.952 0.331 652 HH11 ARG 80 1HH1 ARG 80 -33.264 6.393 0.810 653 HH12 ARG 80 2HH1 ARG 80 -34.974 6.646 0.688 654 HH21 ARG 80 1HH2 ARG 80 -35.727 3.271 0.169 655 HH22 ARG 80 2HH2 ARG 80 -36.374 4.870 0.324 656 H LEU 81 H LEU 81 -27.988 6.795 1.762 657 HA LEU 81 HA LEU 81 -29.622 6.963 4.210 658 HB2 LEU 81 1HB LEU 81 -27.435 5.104 3.436 659 HB3 LEU 81 2HB LEU 81 -27.544 5.600 5.124 660 HG LEU 81 HG LEU 81 -28.639 3.432 4.660 661 HD11 LEU 81 1HD1 LEU 81 -29.706 5.681 6.051 662 HD12 LEU 81 2HD1 LEU 81 -29.836 3.967 6.444 663 HD13 LEU 81 3HD1 LEU 81 -31.035 4.724 5.395 664 HD21 LEU 81 3HD2 LEU 81 -30.820 4.905 3.243 665 HD22 LEU 81 1HD2 LEU 81 -30.443 3.182 3.242 666 HD23 LEU 81 2HD2 LEU 81 -29.427 4.307 2.340 667 H ARG 82 H ARG 82 -28.005 7.367 6.164 668 HA ARG 82 HA ARG 82 -26.149 9.514 5.380 669 HB2 ARG 82 1HB ARG 82 -28.214 10.512 6.235 670 HB3 ARG 82 2HB ARG 82 -28.084 9.553 7.703 671 HG2 ARG 82 1HG ARG 82 -25.806 10.723 7.999 672 HG3 ARG 82 2HG ARG 82 -26.427 11.879 6.819 673 HD2 ARG 82 1HD ARG 82 -27.666 11.155 9.471 674 HD3 ARG 82 2HD ARG 82 -26.879 12.677 9.054 675 HE ARG 82 HE ARG 82 -28.908 12.385 7.230 676 HH11 ARG 82 1HH1 ARG 82 -28.660 12.533 10.699 677 HH12 ARG 82 2HH1 ARG 82 -30.227 13.240 10.912 678 HH21 ARG 82 1HH2 ARG 82 -30.974 13.316 7.496 679 HH22 ARG 82 2HH2 ARG 82 -31.543 13.684 9.089 680 H GLY 83 H GLY 83 -24.395 8.079 5.618 681 HA2 GLY 83 1HA GLY 83 -23.753 7.483 8.436 682 HA3 GLY 83 2HA GLY 83 -23.480 6.288 7.177 683 H TYR 84 H TYR 84 -21.727 7.944 9.092 684 HA TYR 84 HA TYR 84 -19.755 8.696 7.043 685 HB2 TYR 84 1HB TYR 84 -20.756 10.738 7.999 686 HB3 TYR 84 2HB TYR 84 -20.294 10.204 9.611 687 HD1 TYR 84 HD2 TYR 84 -17.846 10.002 10.168 688 HD2 TYR 84 HD1 TYR 84 -19.224 11.872 6.603 689 HE1 TYR 84 HE2 TYR 84 -15.666 11.111 9.914 690 HE2 TYR 84 HE1 TYR 84 -17.047 12.985 6.339 691 HH TYR 84 HH TYR 84 -15.131 13.595 7.555 692 H ALA 85 H ALA 85 -18.324 7.077 7.212 693 HA ALA 85 HA ALA 85 -16.779 6.850 9.632 694 HB1 ALA 85 1HB ALA 85 -18.760 4.787 8.883 695 HB2 ALA 85 2HB ALA 85 -17.175 4.215 9.407 696 HB3 ALA 85 3HB ALA 85 -18.136 5.243 10.469 697 H ASP 86 H ASP 86 -14.746 6.006 9.281 698 HA ASP 86 HA ASP 86 -14.050 5.579 6.466 699 HB2 ASP 86 1HB ASP 86 -12.367 6.277 8.877 700 HB3 ASP 86 2HB ASP 86 -11.693 5.923 7.288 701 H LEU 87 H LEU 87 -12.240 3.992 6.070 702 HA LEU 87 HA LEU 87 -12.488 1.640 7.821 703 HB2 LEU 87 1HB LEU 87 -12.416 1.602 4.808 704 HB3 LEU 87 2HB LEU 87 -12.504 0.196 5.866 705 HG LEU 87 HG LEU 87 -14.671 2.230 6.036 706 HD11 LEU 87 1HD1 LEU 87 -14.743 2.071 3.734 707 HD12 LEU 87 2HD1 LEU 87 -15.822 0.767 4.229 708 HD13 LEU 87 3HD1 LEU 87 -14.172 0.402 3.725 709 HD21 LEU 87 3HD2 LEU 87 -14.973 0.537 7.576 710 HD22 LEU 87 1HD2 LEU 87 -14.325 -0.702 6.500 711 HD23 LEU 87 2HD2 LEU 87 -15.933 -0.037 6.212 712 H ARG 88 H ARG 88 -10.755 -0.074 6.903 713 HA ARG 88 HA ARG 88 -8.272 1.185 6.111 714 HB2 ARG 88 1HB ARG 88 -8.351 1.523 8.570 715 HB3 ARG 88 2HB ARG 88 -8.470 -0.219 8.781 716 HG2 ARG 88 1HG ARG 88 -6.186 0.867 7.218 717 HG3 ARG 88 2HG ARG 88 -6.170 1.031 8.975 718 HD2 ARG 88 1HD ARG 88 -6.750 -1.491 8.973 719 HD3 ARG 88 2HD ARG 88 -6.175 -1.455 7.306 720 HE ARG 88 HE ARG 88 -4.192 -0.255 8.763 721 HH11 ARG 88 1HH1 ARG 88 -5.810 -3.337 8.831 722 HH12 ARG 88 2HH1 ARG 88 -4.436 -4.191 9.452 723 HH21 ARG 88 1HH2 ARG 88 -2.377 -1.368 9.581 724 HH22 ARG 88 2HH2 ARG 88 -2.484 -3.070 9.879 725 H GLU 89 H GLU 89 -7.519 -0.129 4.596 726 HA GLU 89 HA GLU 89 -7.231 -2.960 5.134 727 HB2 GLU 89 1HB GLU 89 -8.392 -3.703 3.138 728 HB3 GLU 89 2HB GLU 89 -9.495 -2.797 4.163 729 HG2 GLU 89 1HG GLU 89 -8.826 -0.787 2.668 730 HG3 GLU 89 2HG GLU 89 -8.294 -2.033 1.541 731 H ASP 90 H ASP 90 -5.773 -4.014 3.700 732 HA ASP 90 HA ASP 90 -4.503 -2.596 1.564 733 HB2 ASP 90 1HB ASP 90 -3.475 -1.529 3.587 734 HB3 ASP 90 2HB ASP 90 -2.835 -3.108 4.033 735 HA PRO 91 HA PRO 91 -4.312 -7.255 1.542 736 HB2 PRO 91 1HB PRO 91 -5.496 -7.540 -0.885 737 HB3 PRO 91 2HB PRO 91 -6.411 -7.443 0.625 738 HG2 PRO 91 1HG PRO 91 -5.861 -5.306 -1.398 739 HG3 PRO 91 2HG PRO 91 -7.371 -5.678 -0.546 740 HD2 PRO 91 1HD PRO 91 -5.737 -3.653 0.203 741 HD3 PRO 91 2HD PRO 91 -6.711 -4.574 1.367 742 H ASP 92 H ASP 92 -2.237 -7.728 1.130 743 HA ASP 92 HA ASP 92 -1.236 -7.272 -1.586 744 HB2 ASP 92 1HB ASP 92 1.050 -6.919 -0.161 745 HB3 ASP 92 2HB ASP 92 0.048 -5.600 -0.761 746 H ARG 93 H ARG 93 0.050 -8.580 1.473 747 HA ARG 93 HA ARG 93 0.554 -11.115 0.055 748 HB2 ARG 93 1HB ARG 93 2.147 -10.197 2.432 749 HB3 ARG 93 2HB ARG 93 2.570 -11.403 1.224 750 HG2 ARG 93 1HG ARG 93 2.908 -9.690 -0.435 751 HG3 ARG 93 2HG ARG 93 2.351 -8.449 0.689 752 HD2 ARG 93 1HD ARG 93 4.312 -9.583 2.153 753 HD3 ARG 93 2HD ARG 93 4.944 -9.843 0.528 754 HE ARG 93 HE ARG 93 5.454 -7.628 0.458 755 HH11 ARG 93 1HH1 ARG 93 2.894 -8.089 2.772 756 HH12 ARG 93 2HH1 ARG 93 2.861 -6.428 3.263 757 HH21 ARG 93 1HH2 ARG 93 5.421 -5.438 1.095 758 HH22 ARG 93 2HH2 ARG 93 4.298 -4.921 2.307 759 H GLN 94 H GLN 94 -1.835 -10.326 1.546 760 HA GLN 94 HA GLN 94 -1.678 -12.071 3.899 761 HB2 GLN 94 1HB GLN 94 -3.883 -11.083 4.495 762 HB3 GLN 94 2HB GLN 94 -2.592 -9.895 4.376 763 HG2 GLN 94 1HG GLN 94 -3.378 -9.178 2.223 764 HG3 GLN 94 2HG GLN 94 -4.590 -10.457 2.199 765 HE21 GLN 94 2HE2 GLN 94 -6.487 -9.479 2.323 766 HE22 GLN 94 1HE2 GLN 94 -6.934 -8.288 3.491 767 H ASP 95 H ASP 95 -1.618 -13.321 1.403 768 HA ASP 95 HA ASP 95 -4.212 -14.711 1.435 769 HB2 ASP 95 1HB ASP 95 -3.674 -15.093 -1.102 770 HB3 ASP 95 2HB ASP 95 -4.426 -13.588 -0.579 771 H HIS 96 H HIS 96 -0.879 -14.963 0.189 772 HA HIS 96 HA HIS 96 -0.479 -17.480 1.501 773 HB2 HIS 96 1HB HIS 96 0.008 -18.709 -0.661 774 HB3 HIS 96 2HB HIS 96 -1.694 -18.404 -0.325 775 HD1 HIS 96 HD1 HIS 96 -2.955 -17.522 -2.252 776 HD2 HIS 96 HD2 HIS 96 1.082 -16.570 -2.490 777 HE1 HIS 96 HE1 HIS 96 -2.675 -16.325 -4.446 778 H HIS 97 H HIS 97 1.704 -18.283 1.251 779 HA HIS 97 HA HIS 97 3.575 -16.283 0.171 780 HB2 HIS 97 1HB HIS 97 5.095 -17.027 2.115 781 HB3 HIS 97 2HB HIS 97 3.762 -15.936 2.483 782 HD1 HIS 97 HD1 HIS 97 4.823 -19.524 2.885 783 HD2 HIS 97 HD2 HIS 97 1.857 -16.938 4.219 784 HE1 HIS 97 HE1 HIS 97 3.634 -20.758 4.725 785 HA PRO 98 HA PRO 98 5.615 -19.554 -1.922 786 HB2 PRO 98 1HB PRO 98 8.210 -18.764 -1.796 787 HB3 PRO 98 2HB PRO 98 7.011 -17.965 -2.820 788 HG2 PRO 98 1HG PRO 98 8.041 -17.159 -0.128 789 HG3 PRO 98 2HG PRO 98 7.737 -16.153 -1.556 790 HD2 PRO 98 1HD PRO 98 6.009 -16.289 0.524 791 HD3 PRO 98 2HD PRO 98 5.471 -16.039 -1.149 792 H GLY 99 H GLY 99 7.567 -21.085 -1.716 793 HA2 GLY 99 1HA GLY 99 8.340 -21.645 1.039 794 HA3 GLY 99 2HA GLY 99 7.359 -22.868 0.244 795 H SER 100 H SER 100 9.931 -23.369 1.222 796 HA SER 100 HA SER 100 11.848 -23.218 -0.905 797 HB2 SER 100 1HB SER 100 12.420 -23.278 1.553 798 HB3 SER 100 2HB SER 100 11.967 -24.982 1.549 799 HG SER 100 HG SER 100 14.115 -24.980 1.165 800 H GLY 101 H GLY 101 12.899 -25.158 -1.825 801 HA2 GLY 101 1HA GLY 101 11.670 -27.698 -1.803 802 HA3 GLY 101 2HA GLY 101 11.070 -26.782 -3.178 803 H ALA 102 H ALA 102 12.787 -29.217 -2.983 804 HA ALA 102 HA ALA 102 14.930 -28.244 -4.741 805 HB1 ALA 102 1HB ALA 102 15.325 -29.303 -2.156 806 HB2 ALA 102 2HB ALA 102 15.872 -30.523 -3.306 807 HB3 ALA 102 3HB ALA 102 16.542 -28.893 -3.364 808 H GLN 103 H GLN 103 14.917 -29.253 -6.635 809 HA GLN 103 HA GLN 103 13.585 -31.873 -6.814 810 HB2 GLN 103 1HB GLN 103 13.950 -29.792 -8.976 811 HB3 GLN 103 2HB GLN 103 13.113 -31.328 -9.157 812 HG2 GLN 103 1HG GLN 103 11.682 -30.399 -7.153 813 HG3 GLN 103 2HG GLN 103 12.256 -28.849 -7.765 814 HE21 GLN 103 2HE2 GLN 103 11.946 -28.499 -10.123 815 HE22 GLN 103 1HE2 GLN 103 10.480 -29.078 -10.832 Start of MODEL 19 1 H1 GLY 1 H GLY 1 5.934 0.135 -1.614 2 HA2 GLY 1 1HA GLY 1 7.549 -1.360 -2.556 3 HA3 GLY 1 2HA GLY 1 6.628 -2.708 -1.906 4 H SER 2 H SER 2 4.066 -1.646 -2.832 5 HA SER 2 HA SER 2 3.922 -2.926 -5.315 6 HB2 SER 2 1HB SER 2 2.003 -0.836 -4.266 7 HB3 SER 2 2HB SER 2 1.654 -2.097 -5.448 8 HG SER 2 HG SER 2 0.932 -2.677 -3.363 9 H LEU 3 H LEU 3 2.743 -1.598 -7.207 10 HA LEU 3 HA LEU 3 4.325 0.824 -7.733 11 HB2 LEU 3 1HB LEU 3 4.729 0.124 -9.997 12 HB3 LEU 3 2HB LEU 3 5.330 -1.102 -8.884 13 HG LEU 3 HG LEU 3 2.624 -1.412 -10.119 14 HD11 LEU 3 1HD1 LEU 3 4.253 -0.890 -11.935 15 HD12 LEU 3 2HD1 LEU 3 3.539 -2.499 -12.036 16 HD13 LEU 3 3HD1 LEU 3 5.184 -2.301 -11.432 17 HD21 LEU 3 3HD2 LEU 3 4.656 -3.112 -8.777 18 HD22 LEU 3 1HD2 LEU 3 3.651 -3.850 -10.023 19 HD23 LEU 3 2HD2 LEU 3 2.899 -3.102 -8.614 20 H VAL 4 H VAL 4 3.313 2.428 -8.896 21 HA VAL 4 HA VAL 4 0.464 1.971 -9.503 22 HB VAL 4 HB VAL 4 0.701 3.472 -7.605 23 HG11 VAL 4 1HG1 VAL 4 2.972 4.276 -8.117 24 HG12 VAL 4 2HG1 VAL 4 2.314 5.245 -9.437 25 HG13 VAL 4 3HG1 VAL 4 1.856 5.596 -7.770 26 HG21 VAL 4 3HG2 VAL 4 -0.139 4.844 -10.155 27 HG22 VAL 4 1HG2 VAL 4 -1.156 3.907 -9.059 28 HG23 VAL 4 2HG2 VAL 4 -0.487 5.453 -8.537 29 HA PRO 5 HA PRO 5 1.530 3.005 -13.670 30 HB2 PRO 5 1HB PRO 5 -0.998 3.338 -14.603 31 HB3 PRO 5 2HB PRO 5 -0.296 1.749 -14.275 32 HG2 PRO 5 1HG PRO 5 -2.147 3.387 -12.586 33 HG3 PRO 5 2HG PRO 5 -2.183 1.646 -12.921 34 HD2 PRO 5 1HD PRO 5 -1.186 2.667 -10.619 35 HD3 PRO 5 2HD PRO 5 -0.550 1.184 -11.361 36 H ARG 6 H ARG 6 0.466 4.707 -15.337 37 HA ARG 6 HA ARG 6 0.348 7.291 -13.924 38 HB2 ARG 6 1HB ARG 6 1.577 8.307 -15.748 39 HB3 ARG 6 2HB ARG 6 2.496 6.954 -15.102 40 HG2 ARG 6 1HG ARG 6 1.826 5.563 -16.959 41 HG3 ARG 6 2HG ARG 6 0.797 6.853 -17.585 42 HD2 ARG 6 1HD ARG 6 2.755 6.982 -18.864 43 HD3 ARG 6 2HD ARG 6 2.915 8.269 -17.670 44 HE ARG 6 HE ARG 6 4.712 7.167 -16.770 45 HH11 ARG 6 1HH1 ARG 6 2.980 5.010 -18.883 46 HH12 ARG 6 2HH1 ARG 6 4.185 3.767 -18.817 47 HH21 ARG 6 1HH2 ARG 6 6.306 5.539 -16.675 48 HH22 ARG 6 2HH2 ARG 6 6.077 4.069 -17.560 49 H GLY 7 H GLY 7 -0.912 8.953 -14.908 50 HA2 GLY 7 1HA GLY 7 -2.292 9.298 -17.079 51 HA3 GLY 7 2HA GLY 7 -3.122 7.858 -16.507 52 H SER 8 H SER 8 -4.634 10.023 -16.916 53 HA SER 8 HA SER 8 -5.913 10.437 -14.468 54 HB2 SER 8 1HB SER 8 -5.424 12.918 -14.221 55 HB3 SER 8 2HB SER 8 -4.111 11.833 -13.764 56 HG SER 8 HG SER 8 -4.296 13.611 -15.884 57 H MET 9 H MET 9 -7.790 11.782 -14.645 58 HA MET 9 HA MET 9 -8.391 13.050 -17.164 59 HB2 MET 9 1HB MET 9 -9.037 10.978 -17.973 60 HB3 MET 9 2HB MET 9 -9.568 10.411 -16.395 61 HG2 MET 9 1HG MET 9 -11.610 11.459 -16.553 62 HG3 MET 9 2HG MET 9 -11.031 12.639 -17.727 63 HE1 MET 9 3HE MET 9 -10.052 10.487 -20.538 64 HE2 MET 9 1HE MET 9 -11.418 11.529 -20.939 65 HE3 MET 9 2HE MET 9 -10.160 12.106 -19.845 66 H GLN 10 H GLN 10 -9.825 14.666 -16.900 67 HA GLN 10 HA GLN 10 -11.027 14.960 -14.244 68 HB2 GLN 10 1HB GLN 10 -10.130 16.854 -16.357 69 HB3 GLN 10 2HB GLN 10 -11.476 17.350 -15.339 70 HG2 GLN 10 1HG GLN 10 -10.191 17.492 -13.462 71 HG3 GLN 10 2HG GLN 10 -9.042 16.278 -14.021 72 HE21 GLN 10 2HE2 GLN 10 -9.467 19.485 -13.431 73 HE22 GLN 10 1HE2 GLN 10 -8.204 20.130 -14.417 74 H ILE 11 H ILE 11 -13.156 14.827 -13.933 75 HA ILE 11 HA ILE 11 -14.930 14.989 -16.277 76 HB ILE 11 HB ILE 11 -16.296 13.191 -15.434 77 HG12 ILE 11 1HG1 ILE 11 -14.301 13.012 -13.165 78 HG13 ILE 11 2HG1 ILE 11 -15.963 13.576 -13.033 79 HG21 ILE 11 1HG2 ILE 11 -14.364 12.634 -16.863 80 HG22 ILE 11 2HG2 ILE 11 -13.404 12.341 -15.414 81 HG23 ILE 11 3HG2 ILE 11 -14.799 11.323 -15.768 82 HD11 ILE 11 3HD1 ILE 11 -16.608 11.262 -13.916 83 HD12 ILE 11 1HD1 ILE 11 -14.954 10.803 -13.515 84 HD13 ILE 11 2HD1 ILE 11 -16.036 11.393 -12.253 85 H PHE 12 H PHE 12 -17.252 15.323 -15.631 86 HA PHE 12 HA PHE 12 -17.370 17.176 -13.346 87 HB2 PHE 12 1HB PHE 12 -18.910 17.150 -15.944 88 HB3 PHE 12 2HB PHE 12 -19.336 18.178 -14.580 89 HD1 PHE 12 HD2 PHE 12 -17.313 19.610 -13.639 90 HD2 PHE 12 HD1 PHE 12 -17.573 18.031 -17.583 91 HE1 PHE 12 HE2 PHE 12 -15.717 21.311 -14.421 92 HE2 PHE 12 HE1 PHE 12 -15.976 19.729 -18.372 93 HZ PHE 12 HZ PHE 12 -15.047 21.372 -16.791 94 H VAL 13 H VAL 13 -18.682 16.702 -11.707 95 HA VAL 13 HA VAL 13 -20.831 14.736 -12.146 96 HB VAL 13 HB VAL 13 -19.104 14.893 -9.673 97 HG11 VAL 13 1HG1 VAL 13 -20.331 12.489 -9.587 98 HG12 VAL 13 2HG1 VAL 13 -20.952 13.941 -8.800 99 HG13 VAL 13 3HG1 VAL 13 -21.575 13.457 -10.378 100 HG21 VAL 13 3HG2 VAL 13 -17.631 13.572 -10.682 101 HG22 VAL 13 1HG2 VAL 13 -18.901 12.392 -11.011 102 HG23 VAL 13 2HG2 VAL 13 -18.564 13.673 -12.176 103 H LYS 14 H LYS 14 -22.761 15.149 -11.178 104 HA LYS 14 HA LYS 14 -23.016 17.755 -9.860 105 HB2 LYS 14 1HB LYS 14 -24.864 16.016 -11.436 106 HB3 LYS 14 2HB LYS 14 -25.554 17.116 -10.250 107 HG2 LYS 14 1HG LYS 14 -25.604 18.457 -12.080 108 HG3 LYS 14 2HG LYS 14 -23.993 18.857 -11.478 109 HD2 LYS 14 1HD LYS 14 -23.124 17.025 -13.002 110 HD3 LYS 14 2HD LYS 14 -24.730 17.004 -13.734 111 HE2 LYS 14 1HE LYS 14 -23.255 19.588 -13.458 112 HE3 LYS 14 2HE LYS 14 -22.836 18.478 -14.761 113 HZ1 LYS 14 3HZ LYS 14 -24.822 18.791 -15.795 114 HZ2 LYS 14 1HZ LYS 14 -24.667 20.310 -15.066 115 HZ3 LYS 14 2HZ LYS 14 -25.661 19.133 -14.367 116 H THR 15 H THR 15 -23.255 17.850 -7.735 117 HA THR 15 HA THR 15 -23.632 15.470 -6.172 118 HB THR 15 HB THR 15 -23.569 17.040 -4.220 119 HG1 THR 15 HG1 THR 15 -22.883 19.058 -6.087 120 HG21 THR 15 3HG2 THR 15 -21.217 17.902 -5.730 121 HG22 THR 15 1HG2 THR 15 -21.522 16.168 -5.825 122 HG23 THR 15 2HG2 THR 15 -21.326 16.944 -4.254 123 H LEU 16 H LEU 16 -25.256 15.419 -4.379 124 HA LEU 16 HA LEU 16 -27.860 15.502 -5.397 125 HB2 LEU 16 1HB LEU 16 -28.582 15.076 -3.090 126 HB3 LEU 16 2HB LEU 16 -27.258 14.026 -3.592 127 HG LEU 16 HG LEU 16 -26.389 16.446 -2.190 128 HD11 LEU 16 1HD1 LEU 16 -27.031 15.310 0.035 129 HD12 LEU 16 2HD1 LEU 16 -28.288 14.516 -0.914 130 HD13 LEU 16 3HD1 LEU 16 -28.243 16.276 -0.807 131 HD21 LEU 16 3HD2 LEU 16 -25.746 13.798 -1.128 132 HD22 LEU 16 1HD2 LEU 16 -24.681 15.115 -1.620 133 HD23 LEU 16 2HD2 LEU 16 -25.334 14.010 -2.830 134 H THR 17 H THR 17 -25.983 17.882 -3.679 135 HA THR 17 HA THR 17 -28.183 19.575 -2.995 136 HB THR 17 HB THR 17 -26.090 19.680 -1.730 137 HG1 THR 17 HG1 THR 17 -27.103 21.587 -1.543 138 HG21 THR 17 3HG2 THR 17 -24.410 19.252 -3.334 139 HG22 THR 17 1HG2 THR 17 -24.158 20.922 -2.829 140 HG23 THR 17 2HG2 THR 17 -24.948 20.577 -4.367 141 H GLY 18 H GLY 18 -26.224 19.118 -5.810 142 HA2 GLY 18 1HA GLY 18 -27.054 19.909 -7.933 143 HA3 GLY 18 2HA GLY 18 -27.672 21.333 -7.109 144 H LYS 19 H LYS 19 -24.523 20.213 -6.261 145 HA LYS 19 HA LYS 19 -23.368 22.541 -7.634 146 HB2 LYS 19 1HB LYS 19 -23.017 22.660 -5.274 147 HB3 LYS 19 2HB LYS 19 -22.482 20.986 -5.205 148 HG2 LYS 19 1HG LYS 19 -20.929 22.832 -6.921 149 HG3 LYS 19 2HG LYS 19 -20.794 23.035 -5.173 150 HD2 LYS 19 1HD LYS 19 -20.590 20.271 -6.210 151 HD3 LYS 19 2HD LYS 19 -19.247 21.357 -6.579 152 HE2 LYS 19 1HE LYS 19 -20.339 21.057 -3.796 153 HE3 LYS 19 2HE LYS 19 -19.099 19.977 -4.433 154 HZ1 LYS 19 3HZ LYS 19 -17.641 21.495 -3.771 155 HZ2 LYS 19 1HZ LYS 19 -18.843 22.643 -3.458 156 HZ3 LYS 19 2HZ LYS 19 -18.199 22.496 -5.015 157 H THR 20 H THR 20 -21.861 22.300 -9.172 158 HA THR 20 HA THR 20 -21.188 19.600 -10.012 159 HB THR 20 HB THR 20 -20.222 22.079 -11.402 160 HG1 THR 20 HG1 THR 20 -22.188 22.343 -12.348 161 HG21 THR 20 3HG2 THR 20 -20.517 20.653 -13.394 162 HG22 THR 20 1HG2 THR 20 -21.063 19.338 -12.354 163 HG23 THR 20 2HG2 THR 20 -19.410 19.939 -12.221 164 H ILE 21 H ILE 21 -19.401 18.627 -9.343 165 HA ILE 21 HA ILE 21 -17.053 20.287 -8.691 166 HB ILE 21 HB ILE 21 -17.894 19.379 -6.636 167 HG12 ILE 21 1HG1 ILE 21 -15.345 19.125 -7.435 168 HG13 ILE 21 2HG1 ILE 21 -15.895 18.620 -5.840 169 HG21 ILE 21 1HG2 ILE 21 -18.062 16.891 -6.339 170 HG22 ILE 21 2HG2 ILE 21 -19.283 17.605 -7.391 171 HG23 ILE 21 3HG2 ILE 21 -17.912 16.743 -8.089 172 HD11 ILE 21 3HD1 ILE 21 -15.886 16.707 -8.137 173 HD12 ILE 21 1HD1 ILE 21 -14.424 17.024 -7.205 174 HD13 ILE 21 2HD1 ILE 21 -15.855 16.373 -6.406 175 H THR 22 H THR 22 -15.160 19.756 -9.617 176 HA THR 22 HA THR 22 -15.168 17.723 -11.668 177 HB THR 22 HB THR 22 -12.701 19.235 -10.899 178 HG1 THR 22 HG1 THR 22 -14.901 20.302 -12.371 179 HG21 THR 22 3HG2 THR 22 -12.496 17.637 -12.689 180 HG22 THR 22 1HG2 THR 22 -12.423 19.259 -13.375 181 HG23 THR 22 2HG2 THR 22 -13.904 18.311 -13.509 182 H LEU 23 H LEU 23 -14.392 15.722 -11.499 183 HA LEU 23 HA LEU 23 -12.712 15.074 -9.165 184 HB2 LEU 23 1HB LEU 23 -15.143 14.133 -9.433 185 HB3 LEU 23 2HB LEU 23 -14.367 13.017 -10.555 186 HG LEU 23 HG LEU 23 -12.905 12.230 -8.751 187 HD11 LEU 23 1HD1 LEU 23 -14.303 14.384 -7.237 188 HD12 LEU 23 2HD1 LEU 23 -12.597 13.941 -7.250 189 HD13 LEU 23 3HD1 LEU 23 -13.761 12.936 -6.388 190 HD21 LEU 23 3HD2 LEU 23 -15.874 12.103 -8.494 191 HD22 LEU 23 1HD2 LEU 23 -14.866 11.354 -7.255 192 HD23 LEU 23 2HD2 LEU 23 -14.725 10.839 -8.936 193 H GLU 24 H GLU 24 -10.944 13.746 -9.454 194 HA GLU 24 HA GLU 24 -10.100 13.402 -12.244 195 HB2 GLU 24 1HB GLU 24 -8.432 14.612 -11.183 196 HB3 GLU 24 2HB GLU 24 -8.636 13.757 -9.661 197 HG2 GLU 24 1HG GLU 24 -7.263 12.060 -10.264 198 HG3 GLU 24 2HG GLU 24 -7.681 12.179 -11.973 199 H VAL 25 H VAL 25 -10.027 11.444 -13.120 200 HA VAL 25 HA VAL 25 -9.610 9.103 -11.417 201 HB VAL 25 HB VAL 25 -11.675 8.763 -13.511 202 HG11 VAL 25 1HG1 VAL 25 -10.929 7.601 -10.888 203 HG12 VAL 25 2HG1 VAL 25 -12.627 7.522 -11.359 204 HG13 VAL 25 3HG1 VAL 25 -11.390 6.804 -12.392 205 HG21 VAL 25 3HG2 VAL 25 -12.546 10.779 -12.654 206 HG22 VAL 25 1HG2 VAL 25 -13.434 9.497 -11.831 207 HG23 VAL 25 2HG2 VAL 25 -12.134 10.346 -10.995 208 H GLU 26 H GLU 26 -9.398 7.080 -12.855 209 HA GLU 26 HA GLU 26 -7.693 7.805 -15.135 210 HB2 GLU 26 1HB GLU 26 -7.720 5.460 -13.259 211 HB3 GLU 26 2HB GLU 26 -6.926 5.347 -14.823 212 HG2 GLU 26 1HG GLU 26 -6.061 7.744 -13.598 213 HG3 GLU 26 2HG GLU 26 -5.946 6.455 -12.402 214 HA PRO 27 HA PRO 27 -10.346 5.924 -18.079 215 HB2 PRO 27 1HB PRO 27 -8.575 4.767 -19.781 216 HB3 PRO 27 2HB PRO 27 -8.813 6.516 -19.685 217 HG2 PRO 27 1HG PRO 27 -6.672 4.825 -18.453 218 HG3 PRO 27 2HG PRO 27 -6.529 6.394 -19.267 219 HD2 PRO 27 1HD PRO 27 -6.541 6.148 -16.570 220 HD3 PRO 27 2HD PRO 27 -7.212 7.565 -17.403 221 H SER 28 H SER 28 -8.178 3.983 -16.238 222 HA SER 28 HA SER 28 -9.585 1.533 -17.066 223 HB2 SER 28 1HB SER 28 -7.258 1.096 -15.380 224 HB3 SER 28 2HB SER 28 -7.619 0.448 -16.980 225 HG SER 28 HG SER 28 -6.113 1.748 -17.637 226 H ASP 29 H ASP 29 -9.338 3.801 -14.596 227 HA ASP 29 HA ASP 29 -9.666 2.218 -12.295 228 HB2 ASP 29 1HB ASP 29 -10.014 5.059 -13.007 229 HB3 ASP 29 2HB ASP 29 -10.991 4.506 -11.649 230 H THR 30 H THR 30 -11.411 1.328 -11.321 231 HA THR 30 HA THR 30 -13.811 1.045 -12.913 232 HB THR 30 HB THR 30 -14.477 -0.356 -10.778 233 HG1 THR 30 HG1 THR 30 -12.399 -1.244 -9.938 234 HG21 THR 30 3HG2 THR 30 -14.019 -2.131 -12.074 235 HG22 THR 30 1HG2 THR 30 -12.298 -1.752 -12.139 236 HG23 THR 30 2HG2 THR 30 -13.420 -0.952 -13.241 237 H ILE 31 H ILE 31 -15.954 1.058 -11.632 238 HA ILE 31 HA ILE 31 -16.611 3.653 -10.952 239 HB ILE 31 HB ILE 31 -17.983 1.130 -10.017 240 HG12 ILE 31 1HG1 ILE 31 -17.811 1.224 -12.443 241 HG13 ILE 31 2HG1 ILE 31 -19.473 1.529 -11.954 242 HG21 ILE 31 1HG2 ILE 31 -18.700 4.016 -9.854 243 HG22 ILE 31 2HG2 ILE 31 -19.980 2.833 -10.117 244 HG23 ILE 31 3HG2 ILE 31 -18.957 2.721 -8.685 245 HD11 ILE 31 3HD1 ILE 31 -17.495 3.343 -13.203 246 HD12 ILE 31 1HD1 ILE 31 -19.222 3.161 -13.508 247 HD13 ILE 31 2HD1 ILE 31 -18.665 4.039 -12.083 248 H GLU 32 H GLU 32 -15.430 1.056 -8.909 249 HA GLU 32 HA GLU 32 -16.010 2.172 -6.405 250 HB2 GLU 32 1HB GLU 32 -14.117 0.735 -5.590 251 HB3 GLU 32 2HB GLU 32 -15.342 -0.116 -6.519 252 HG2 GLU 32 1HG GLU 32 -13.947 -0.276 -8.408 253 HG3 GLU 32 2HG GLU 32 -12.805 0.898 -7.757 254 H ASN 33 H ASN 33 -13.399 2.754 -8.664 255 HA ASN 33 HA ASN 33 -11.788 4.260 -6.842 256 HB2 ASN 33 1HB ASN 33 -11.754 4.056 -9.859 257 HB3 ASN 33 2HB ASN 33 -10.556 4.938 -8.917 258 HD21 ASN 33 2HD2 ASN 33 -9.607 3.570 -7.077 259 HD22 ASN 33 1HD2 ASN 33 -9.126 1.969 -7.514 260 H VAL 34 H VAL 34 -14.045 5.090 -9.450 261 HA VAL 34 HA VAL 34 -13.746 7.837 -9.484 262 HB VAL 34 HB VAL 34 -16.316 6.288 -9.837 263 HG11 VAL 34 1HG1 VAL 34 -16.766 8.639 -9.479 264 HG12 VAL 34 2HG1 VAL 34 -15.566 9.081 -10.695 265 HG13 VAL 34 3HG1 VAL 34 -17.035 8.230 -11.174 266 HG21 VAL 34 3HG2 VAL 34 -14.285 5.707 -11.289 267 HG22 VAL 34 1HG2 VAL 34 -15.799 6.086 -12.110 268 HG23 VAL 34 2HG2 VAL 34 -14.518 7.295 -12.020 269 H LYS 35 H LYS 35 -15.841 5.875 -7.399 270 HA LYS 35 HA LYS 35 -16.934 8.118 -6.011 271 HB2 LYS 35 1HB LYS 35 -17.851 6.432 -4.465 272 HB3 LYS 35 2HB LYS 35 -18.170 6.028 -6.146 273 HG2 LYS 35 1HG LYS 35 -16.567 4.310 -6.150 274 HG3 LYS 35 2HG LYS 35 -15.842 4.875 -4.643 275 HD2 LYS 35 1HD LYS 35 -18.228 4.413 -3.671 276 HD3 LYS 35 2HD LYS 35 -18.382 3.366 -5.083 277 HE2 LYS 35 1HE LYS 35 -17.534 1.885 -3.553 278 HE3 LYS 35 2HE LYS 35 -16.044 2.480 -4.283 279 HZ1 LYS 35 3HZ LYS 35 -17.119 3.853 -1.920 280 HZ2 LYS 35 1HZ LYS 35 -15.515 3.695 -2.435 281 HZ3 LYS 35 2HZ LYS 35 -16.303 2.386 -1.711 282 H ALA 36 H ALA 36 -14.121 6.115 -5.625 283 HA ALA 36 HA ALA 36 -13.522 6.500 -2.940 284 HB1 ALA 36 1HB ALA 36 -12.333 5.012 -4.609 285 HB2 ALA 36 2HB ALA 36 -11.443 6.450 -5.112 286 HB3 ALA 36 3HB ALA 36 -11.309 5.865 -3.453 287 H LYS 37 H LYS 37 -12.960 8.609 -5.708 288 HA LYS 37 HA LYS 37 -11.390 10.517 -4.282 289 HB2 LYS 37 1HB LYS 37 -12.919 10.752 -6.879 290 HB3 LYS 37 2HB LYS 37 -11.808 11.968 -6.263 291 HG2 LYS 37 1HG LYS 37 -10.981 9.131 -6.808 292 HG3 LYS 37 2HG LYS 37 -10.894 10.412 -8.019 293 HD2 LYS 37 1HD LYS 37 -9.647 10.822 -5.333 294 HD3 LYS 37 2HD LYS 37 -8.809 9.853 -6.548 295 HE2 LYS 37 1HE LYS 37 -8.570 11.651 -7.997 296 HE3 LYS 37 2HE LYS 37 -9.886 12.555 -7.249 297 HZ1 LYS 37 3HZ LYS 37 -7.108 12.231 -6.332 298 HZ2 LYS 37 1HZ LYS 37 -8.329 12.565 -5.209 299 HZ3 LYS 37 2HZ LYS 37 -8.028 13.643 -6.477 300 H ILE 38 H ILE 38 -14.802 10.041 -4.818 301 HA ILE 38 HA ILE 38 -15.739 12.605 -4.183 302 HB ILE 38 HB ILE 38 -17.075 9.939 -3.709 303 HG12 ILE 38 1HG1 ILE 38 -16.498 10.326 -6.057 304 HG13 ILE 38 2HG1 ILE 38 -18.240 10.418 -5.823 305 HG21 ILE 38 1HG2 ILE 38 -18.124 12.753 -3.603 306 HG22 ILE 38 2HG2 ILE 38 -19.173 11.356 -3.834 307 HG23 ILE 38 3HG2 ILE 38 -18.213 11.504 -2.362 308 HD11 ILE 38 3HD1 ILE 38 -17.942 12.928 -5.692 309 HD12 ILE 38 1HD1 ILE 38 -16.305 12.660 -6.289 310 HD13 ILE 38 2HD1 ILE 38 -17.691 12.178 -7.268 311 H GLN 39 H GLN 39 -14.639 9.976 -2.172 312 HA GLN 39 HA GLN 39 -15.755 10.647 0.274 313 HB2 GLN 39 1HB GLN 39 -12.943 9.621 -0.124 314 HB3 GLN 39 2HB GLN 39 -13.956 9.417 1.299 315 HG2 GLN 39 1HG GLN 39 -15.558 8.156 -0.223 316 HG3 GLN 39 2HG GLN 39 -14.238 8.127 -1.391 317 HE21 GLN 39 2HE2 GLN 39 -14.840 5.754 -0.909 318 HE22 GLN 39 1HE2 GLN 39 -13.873 4.979 0.295 319 H ASP 40 H ASP 40 -13.027 12.064 -1.411 320 HA ASP 40 HA ASP 40 -12.184 13.673 0.813 321 HB2 ASP 40 1HB ASP 40 -10.696 12.893 -1.085 322 HB3 ASP 40 2HB ASP 40 -11.495 14.093 -2.097 323 H LYS 41 H LYS 41 -14.511 13.954 -1.710 324 HA LYS 41 HA LYS 41 -14.715 16.830 -1.572 325 HB2 LYS 41 1HB LYS 41 -16.726 14.956 -2.808 326 HB3 LYS 41 2HB LYS 41 -16.424 16.641 -3.209 327 HG2 LYS 41 1HG LYS 41 -14.500 14.375 -3.692 328 HG3 LYS 41 2HG LYS 41 -15.562 15.092 -4.906 329 HD2 LYS 41 1HD LYS 41 -14.422 17.161 -4.819 330 HD3 LYS 41 2HD LYS 41 -13.566 16.712 -3.342 331 HE2 LYS 41 1HE LYS 41 -12.658 14.763 -4.860 332 HE3 LYS 41 2HE LYS 41 -13.072 15.879 -6.161 333 HZ1 LYS 41 3HZ LYS 41 -11.211 16.981 -5.762 334 HZ2 LYS 41 1HZ LYS 41 -10.810 15.903 -4.521 335 HZ3 LYS 41 2HZ LYS 41 -11.700 17.299 -4.174 336 H GLU 42 H GLU 42 -16.775 14.084 -0.621 337 HA GLU 42 HA GLU 42 -18.087 15.874 1.318 338 HB2 GLU 42 1HB GLU 42 -19.284 13.652 -0.337 339 HB3 GLU 42 2HB GLU 42 -20.097 14.358 1.052 340 HG2 GLU 42 1HG GLU 42 -19.200 15.923 -1.354 341 HG3 GLU 42 2HG GLU 42 -20.823 15.271 -1.139 342 H GLY 43 H GLY 43 -16.872 12.648 0.625 343 HA2 GLY 43 1HA GLY 43 -15.952 11.112 2.093 344 HA3 GLY 43 2HA GLY 43 -16.298 12.220 3.413 345 H ILE 44 H ILE 44 -17.910 9.994 1.159 346 HA ILE 44 HA ILE 44 -19.742 9.275 3.352 347 HB ILE 44 HB ILE 44 -21.401 8.704 1.502 348 HG12 ILE 44 1HG1 ILE 44 -19.606 10.568 -0.067 349 HG13 ILE 44 2HG1 ILE 44 -19.761 8.839 -0.354 350 HG21 ILE 44 1HG2 ILE 44 -21.273 10.794 3.067 351 HG22 ILE 44 2HG2 ILE 44 -20.906 11.644 1.567 352 HG23 ILE 44 3HG2 ILE 44 -22.419 10.754 1.728 353 HD11 ILE 44 3HD1 ILE 44 -21.063 10.352 -1.886 354 HD12 ILE 44 1HD1 ILE 44 -21.981 9.066 -1.102 355 HD13 ILE 44 2HD1 ILE 44 -22.092 10.722 -0.502 356 HA PRO 45 HA PRO 45 -18.502 5.099 2.789 357 HB2 PRO 45 1HB PRO 45 -20.774 3.797 3.506 358 HB3 PRO 45 2HB PRO 45 -19.727 4.616 4.672 359 HG2 PRO 45 1HG PRO 45 -22.274 5.566 3.418 360 HG3 PRO 45 2HG PRO 45 -21.740 5.697 5.104 361 HD2 PRO 45 1HD PRO 45 -21.569 7.759 3.357 362 HD3 PRO 45 2HD PRO 45 -20.396 7.519 4.668 363 HA PRO 46 HA PRO 46 -19.771 3.494 -1.103 364 HB2 PRO 46 1HB PRO 46 -19.677 0.811 -0.699 365 HB3 PRO 46 2HB PRO 46 -18.228 1.817 -0.814 366 HG2 PRO 46 1HG PRO 46 -19.622 0.775 1.621 367 HG3 PRO 46 2HG PRO 46 -17.885 0.848 1.272 368 HD2 PRO 46 1HD PRO 46 -19.130 2.656 2.857 369 HD3 PRO 46 2HD PRO 46 -17.737 3.077 1.840 370 H ASP 47 H ASP 47 -21.425 2.032 1.672 371 HA ASP 47 HA ASP 47 -23.573 0.885 0.294 372 HB2 ASP 47 1HB ASP 47 -23.561 2.027 3.096 373 HB3 ASP 47 2HB ASP 47 -24.738 0.887 2.450 374 H GLN 48 H GLN 48 -22.900 4.174 1.128 375 HA GLN 48 HA GLN 48 -25.629 4.989 0.432 376 HB2 GLN 48 1HB GLN 48 -23.373 6.319 1.890 377 HB3 GLN 48 2HB GLN 48 -24.644 7.295 1.166 378 HG2 GLN 48 1HG GLN 48 -25.007 6.801 3.558 379 HG3 GLN 48 2HG GLN 48 -26.312 6.241 2.514 380 HE21 GLN 48 2HE2 GLN 48 -23.864 5.357 4.738 381 HE22 GLN 48 1HE2 GLN 48 -24.202 3.664 4.784 382 H GLN 49 H GLN 49 -22.373 5.005 -0.723 383 HA GLN 49 HA GLN 49 -22.601 7.121 -2.593 384 HB2 GLN 49 1HB GLN 49 -20.732 4.794 -2.281 385 HB3 GLN 49 2HB GLN 49 -20.650 5.815 -3.711 386 HG2 GLN 49 1HG GLN 49 -20.687 7.262 -1.160 387 HG3 GLN 49 2HG GLN 49 -19.271 6.246 -1.425 388 HE21 GLN 49 2HE2 GLN 49 -21.234 8.087 -3.718 389 HE22 GLN 49 1HE2 GLN 49 -19.946 9.086 -4.291 390 H ARG 50 H ARG 50 -23.432 7.194 -4.591 391 HA ARG 50 HA ARG 50 -23.885 4.791 -6.129 392 HB2 ARG 50 1HB ARG 50 -26.119 6.327 -4.859 393 HB3 ARG 50 2HB ARG 50 -26.368 5.586 -6.434 394 HG2 ARG 50 1HG ARG 50 -25.319 3.499 -5.111 395 HG3 ARG 50 2HG ARG 50 -26.100 4.348 -3.776 396 HD2 ARG 50 1HD ARG 50 -28.195 4.398 -5.112 397 HD3 ARG 50 2HD ARG 50 -27.392 3.413 -6.334 398 HE ARG 50 HE ARG 50 -27.737 1.584 -5.015 399 HH11 ARG 50 1HH1 ARG 50 -28.044 4.447 -3.059 400 HH12 ARG 50 2HH1 ARG 50 -28.572 3.587 -1.651 401 HH21 ARG 50 1HH2 ARG 50 -28.431 0.440 -3.168 402 HH22 ARG 50 2HH2 ARG 50 -28.790 1.307 -1.713 403 H LEU 51 H LEU 51 -23.023 5.403 -8.002 404 HA LEU 51 HA LEU 51 -23.359 8.152 -8.931 405 HB2 LEU 51 1HB LEU 51 -21.547 5.890 -9.665 406 HB3 LEU 51 2HB LEU 51 -21.789 7.227 -10.788 407 HG LEU 51 HG LEU 51 -19.759 7.554 -9.513 408 HD11 LEU 51 1HD1 LEU 51 -21.793 9.477 -8.424 409 HD12 LEU 51 2HD1 LEU 51 -21.299 9.480 -10.117 410 HD13 LEU 51 3HD1 LEU 51 -20.109 9.781 -8.851 411 HD21 LEU 51 3HD2 LEU 51 -20.393 6.231 -7.541 412 HD22 LEU 51 1HD2 LEU 51 -21.515 7.505 -7.061 413 HD23 LEU 51 2HD2 LEU 51 -19.781 7.827 -7.103 414 H ILE 52 H ILE 52 -24.523 8.721 -10.691 415 HA ILE 52 HA ILE 52 -25.994 6.569 -12.063 416 HB ILE 52 HB ILE 52 -26.847 9.455 -11.908 417 HG12 ILE 52 1HG1 ILE 52 -26.746 8.596 -9.633 418 HG13 ILE 52 2HG1 ILE 52 -28.426 8.734 -10.139 419 HG21 ILE 52 1HG2 ILE 52 -29.103 8.268 -12.319 420 HG22 ILE 52 2HG2 ILE 52 -27.983 8.455 -13.667 421 HG23 ILE 52 3HG2 ILE 52 -28.111 6.905 -12.836 422 HD11 ILE 52 3HD1 ILE 52 -28.761 6.606 -9.662 423 HD12 ILE 52 1HD1 ILE 52 -27.486 6.126 -10.782 424 HD13 ILE 52 2HD1 ILE 52 -27.094 6.486 -9.100 425 H PHE 53 H PHE 53 -26.094 6.526 -14.274 426 HA PHE 53 HA PHE 53 -24.778 8.658 -15.781 427 HB2 PHE 53 1HB PHE 53 -23.049 6.945 -15.306 428 HB3 PHE 53 2HB PHE 53 -24.057 5.736 -16.096 429 HD1 PHE 53 HD2 PHE 53 -22.019 8.751 -16.619 430 HD2 PHE 53 HD1 PHE 53 -24.173 5.579 -18.465 431 HE1 PHE 53 HE2 PHE 53 -20.994 9.320 -18.782 432 HE2 PHE 53 HE1 PHE 53 -23.152 6.142 -20.632 433 HZ PHE 53 HZ PHE 53 -21.561 8.015 -20.793 434 H ALA 54 H ALA 54 -26.127 9.268 -17.325 435 HA ALA 54 HA ALA 54 -27.817 9.264 -18.855 436 HB1 ALA 54 1HB ALA 54 -26.760 6.493 -19.404 437 HB2 ALA 54 2HB ALA 54 -27.788 7.441 -20.480 438 HB3 ALA 54 3HB ALA 54 -26.154 7.992 -20.108 439 H GLY 55 H GLY 55 -28.676 8.665 -16.277 440 HA2 GLY 55 1HA GLY 55 -30.610 7.972 -15.241 441 HA3 GLY 55 2HA GLY 55 -31.199 7.468 -16.818 442 H LYS 56 H LYS 56 -28.182 6.179 -15.794 443 HA LYS 56 HA LYS 56 -29.492 3.685 -14.943 444 HB2 LYS 56 1HB LYS 56 -27.595 4.137 -17.160 445 HB3 LYS 56 2HB LYS 56 -27.231 2.757 -16.132 446 HG2 LYS 56 1HG LYS 56 -29.270 1.705 -16.638 447 HG3 LYS 56 2HG LYS 56 -29.950 3.180 -17.330 448 HD2 LYS 56 1HD LYS 56 -28.647 3.012 -19.264 449 HD3 LYS 56 2HD LYS 56 -27.511 1.890 -18.510 450 HE2 LYS 56 1HE LYS 56 -29.154 0.136 -18.528 451 HE3 LYS 56 2HE LYS 56 -30.399 1.248 -19.094 452 HZ1 LYS 56 3HZ LYS 56 -29.676 1.114 -21.198 453 HZ2 LYS 56 1HZ LYS 56 -28.956 -0.332 -20.695 454 HZ3 LYS 56 2HZ LYS 56 -28.041 1.089 -20.765 455 H GLN 57 H GLN 57 -28.801 2.979 -13.036 456 HA GLN 57 HA GLN 57 -26.829 4.323 -11.544 457 HB2 GLN 57 1HB GLN 57 -27.131 2.555 -9.885 458 HB3 GLN 57 2HB GLN 57 -28.684 3.103 -10.503 459 HG2 GLN 57 1HG GLN 57 -28.654 1.141 -12.057 460 HG3 GLN 57 2HG GLN 57 -27.231 0.564 -11.191 461 HE21 GLN 57 2HE2 GLN 57 -29.849 -0.667 -11.466 462 HE22 GLN 57 1HE2 GLN 57 -30.454 -0.883 -9.862 463 H LEU 58 H LEU 58 -24.719 3.865 -11.084 464 HA LEU 58 HA LEU 58 -23.403 1.982 -12.889 465 HB2 LEU 58 1HB LEU 58 -22.183 4.043 -11.060 466 HB3 LEU 58 2HB LEU 58 -21.349 3.122 -12.309 467 HG LEU 58 HG LEU 58 -23.489 5.194 -12.792 468 HD11 LEU 58 1HD1 LEU 58 -20.942 5.693 -12.033 469 HD12 LEU 58 2HD1 LEU 58 -21.893 6.747 -13.079 470 HD13 LEU 58 3HD1 LEU 58 -20.754 5.600 -13.784 471 HD21 LEU 58 3HD2 LEU 58 -22.030 4.703 -15.116 472 HD22 LEU 58 1HD2 LEU 58 -23.697 4.233 -14.784 473 HD23 LEU 58 2HD2 LEU 58 -22.381 3.109 -14.446 474 H GLU 59 H GLU 59 -21.740 0.550 -12.106 475 HA GLU 59 HA GLU 59 -21.663 -0.007 -9.259 476 HB2 GLU 59 1HB GLU 59 -22.622 -2.079 -11.242 477 HB3 GLU 59 2HB GLU 59 -22.267 -2.380 -9.547 478 HG2 GLU 59 1HG GLU 59 -24.055 -0.852 -8.896 479 HG3 GLU 59 2HG GLU 59 -24.410 -0.544 -10.595 480 H ASP 60 H ASP 60 -20.035 -1.651 -8.716 481 HA ASP 60 HA ASP 60 -17.598 -1.188 -9.992 482 HB2 ASP 60 1HB ASP 60 -18.471 -3.401 -8.130 483 HB3 ASP 60 2HB ASP 60 -16.807 -3.202 -8.672 484 H GLY 61 H GLY 61 -16.166 -3.061 -10.810 485 HA2 GLY 61 1HA GLY 61 -16.071 -5.125 -12.056 486 HA3 GLY 61 2HA GLY 61 -17.721 -4.829 -12.583 487 H ARG 62 H ARG 62 -17.877 -2.546 -13.737 488 HA ARG 62 HA ARG 62 -16.010 -2.723 -15.964 489 HB2 ARG 62 1HB ARG 62 -18.710 -1.556 -15.536 490 HB3 ARG 62 2HB ARG 62 -17.685 -0.784 -16.739 491 HG2 ARG 62 1HG ARG 62 -17.511 -2.809 -17.992 492 HG3 ARG 62 2HG ARG 62 -18.321 -3.724 -16.719 493 HD2 ARG 62 1HD ARG 62 -20.319 -2.227 -17.081 494 HD3 ARG 62 2HD ARG 62 -19.497 -1.613 -18.514 495 HE ARG 62 HE ARG 62 -19.506 -4.345 -18.792 496 HH11 ARG 62 1HH1 ARG 62 -21.904 -1.850 -18.409 497 HH12 ARG 62 2HH1 ARG 62 -23.119 -2.699 -19.306 498 HH21 ARG 62 1HH2 ARG 62 -21.098 -5.473 -19.975 499 HH22 ARG 62 2HH2 ARG 62 -22.660 -4.760 -20.195 500 H THR 63 H THR 63 -15.301 -0.604 -16.964 501 HA THR 63 HA THR 63 -14.373 1.198 -14.826 502 HB THR 63 HB THR 63 -12.540 0.007 -15.925 503 HG1 THR 63 HG1 THR 63 -11.568 2.103 -16.873 504 HG21 THR 63 3HG2 THR 63 -12.074 0.161 -18.238 505 HG22 THR 63 1HG2 THR 63 -13.278 1.427 -18.476 506 HG23 THR 63 2HG2 THR 63 -13.791 -0.224 -18.127 507 H LEU 64 H LEU 64 -13.917 3.460 -15.573 508 HA LEU 64 HA LEU 64 -16.207 4.713 -16.478 509 HB2 LEU 64 1HB LEU 64 -13.345 5.647 -16.561 510 HB3 LEU 64 2HB LEU 64 -14.726 6.688 -16.901 511 HG LEU 64 HG LEU 64 -14.599 5.251 -14.288 512 HD11 LEU 64 1HD1 LEU 64 -12.606 6.170 -13.850 513 HD12 LEU 64 2HD1 LEU 64 -13.509 7.677 -13.702 514 HD13 LEU 64 3HD1 LEU 64 -12.705 7.277 -15.219 515 HD21 LEU 64 3HD2 LEU 64 -15.968 7.587 -15.479 516 HD22 LEU 64 1HD2 LEU 64 -15.520 7.707 -13.777 517 HD23 LEU 64 2HD2 LEU 64 -16.557 6.389 -14.325 518 H SER 65 H SER 65 -13.319 3.793 -18.315 519 HA SER 65 HA SER 65 -13.989 4.944 -20.759 520 HB2 SER 65 1HB SER 65 -11.804 4.126 -20.642 521 HB3 SER 65 2HB SER 65 -12.317 2.571 -19.988 522 HG SER 65 HG SER 65 -12.180 1.929 -21.982 523 H GLU 66 H GLU 66 -14.968 1.875 -19.339 524 HA GLU 66 HA GLU 66 -16.296 0.930 -21.691 525 HB2 GLU 66 1HB GLU 66 -16.225 0.054 -18.819 526 HB3 GLU 66 2HB GLU 66 -17.365 -0.668 -19.947 527 HG2 GLU 66 1HG GLU 66 -14.501 -0.549 -20.721 528 HG3 GLU 66 2HG GLU 66 -14.997 -1.724 -19.505 529 H TYR 67 H TYR 67 -17.136 2.994 -19.058 530 HA TYR 67 HA TYR 67 -19.995 2.760 -19.552 531 HB2 TYR 67 1HB TYR 67 -18.342 4.272 -17.541 532 HB3 TYR 67 2HB TYR 67 -20.062 4.590 -17.741 533 HD1 TYR 67 HD1 TYR 67 -21.590 2.428 -17.661 534 HD2 TYR 67 HD2 TYR 67 -17.693 2.703 -15.976 535 HE1 TYR 67 HE1 TYR 67 -22.116 0.556 -16.155 536 HE2 TYR 67 HE2 TYR 67 -18.207 0.830 -14.467 537 HH TYR 67 HH TYR 67 -19.681 -0.755 -13.934 538 H ASN 68 H ASN 68 -17.744 4.088 -21.301 539 HA ASN 68 HA ASN 68 -17.593 5.811 -22.777 540 HB2 ASN 68 1HB ASN 68 -20.557 6.174 -22.311 541 HB3 ASN 68 2HB ASN 68 -19.636 6.632 -23.741 542 HD21 ASN 68 2HD2 ASN 68 -19.502 5.233 -25.359 543 HD22 ASN 68 1HD2 ASN 68 -19.989 3.577 -25.294 544 H ILE 69 H ILE 69 -17.449 6.303 -19.817 545 HA ILE 69 HA ILE 69 -18.441 8.990 -19.468 546 HB ILE 69 HB ILE 69 -16.604 7.358 -17.711 547 HG12 ILE 69 1HG1 ILE 69 -19.545 7.943 -17.344 548 HG13 ILE 69 2HG1 ILE 69 -18.938 6.465 -18.084 549 HG21 ILE 69 1HG2 ILE 69 -18.009 9.980 -17.250 550 HG22 ILE 69 2HG2 ILE 69 -17.311 9.003 -15.959 551 HG23 ILE 69 3HG2 ILE 69 -16.274 9.666 -17.222 552 HD11 ILE 69 3HD1 ILE 69 -17.824 5.852 -16.043 553 HD12 ILE 69 1HD1 ILE 69 -18.282 7.382 -15.296 554 HD13 ILE 69 2HD1 ILE 69 -19.521 6.197 -15.711 555 H GLN 70 H GLN 70 -17.445 10.402 -20.825 556 HA GLN 70 HA GLN 70 -14.583 10.359 -21.202 557 HB2 GLN 70 1HB GLN 70 -16.560 12.454 -22.109 558 HB3 GLN 70 2HB GLN 70 -14.930 12.202 -22.720 559 HG2 GLN 70 1HG GLN 70 -15.582 10.055 -23.640 560 HG3 GLN 70 2HG GLN 70 -17.206 10.250 -22.982 561 HE21 GLN 70 2HE2 GLN 70 -18.606 10.748 -24.494 562 HE22 GLN 70 1HE2 GLN 70 -18.328 11.784 -25.848 563 H LYS 71 H LYS 71 -13.850 12.972 -21.281 564 HA LYS 71 HA LYS 71 -13.620 13.590 -18.467 565 HB2 LYS 71 1HB LYS 71 -12.037 15.317 -19.198 566 HB3 LYS 71 2HB LYS 71 -11.650 13.751 -19.901 567 HG2 LYS 71 1HG LYS 71 -13.146 14.695 -21.877 568 HG3 LYS 71 2HG LYS 71 -12.610 16.234 -21.200 569 HD2 LYS 71 1HD LYS 71 -10.748 13.984 -21.949 570 HD3 LYS 71 2HD LYS 71 -11.149 15.328 -23.020 571 HE2 LYS 71 1HE LYS 71 -9.960 15.656 -20.270 572 HE3 LYS 71 2HE LYS 71 -9.009 15.600 -21.753 573 HZ1 LYS 71 3HZ LYS 71 -10.744 17.712 -20.738 574 HZ2 LYS 71 1HZ LYS 71 -10.729 17.479 -22.414 575 HZ3 LYS 71 2HZ LYS 71 -9.290 17.824 -21.596 576 H GLU 72 H GLU 72 -15.806 14.347 -20.856 577 HA GLU 72 HA GLU 72 -16.541 16.869 -19.520 578 HB2 GLU 72 1HB GLU 72 -17.137 16.075 -22.375 579 HB3 GLU 72 2HB GLU 72 -17.543 17.606 -21.613 580 HG2 GLU 72 1HG GLU 72 -15.018 17.849 -21.225 581 HG3 GLU 72 2HG GLU 72 -14.858 16.566 -22.423 582 H SER 73 H SER 73 -17.351 13.710 -19.775 583 HA SER 73 HA SER 73 -20.102 13.663 -20.238 584 HB2 SER 73 1HB SER 73 -18.171 11.897 -18.818 585 HB3 SER 73 2HB SER 73 -19.886 11.642 -18.500 586 HG SER 73 HG SER 73 -20.149 11.510 -20.816 587 H THR 74 H THR 74 -21.874 13.492 -18.754 588 HA THR 74 HA THR 74 -21.499 15.195 -16.391 589 HB THR 74 HB THR 74 -24.179 14.453 -17.533 590 HG1 THR 74 HG1 THR 74 -22.668 16.729 -18.330 591 HG21 THR 74 3HG2 THR 74 -24.870 16.549 -16.540 592 HG22 THR 74 1HG2 THR 74 -23.205 16.927 -16.099 593 HG23 THR 74 2HG2 THR 74 -24.037 15.576 -15.327 594 H LEU 75 H LEU 75 -21.432 14.237 -14.477 595 HA LEU 75 HA LEU 75 -22.637 11.578 -14.172 596 HB2 LEU 75 1HB LEU 75 -20.263 12.897 -13.110 597 HB3 LEU 75 2HB LEU 75 -21.209 12.071 -11.874 598 HG LEU 75 HG LEU 75 -19.374 10.694 -12.796 599 HD11 LEU 75 1HD1 LEU 75 -22.189 9.968 -12.672 600 HD12 LEU 75 2HD1 LEU 75 -20.774 9.143 -12.019 601 HD13 LEU 75 3HD1 LEU 75 -21.241 8.893 -13.701 602 HD21 LEU 75 3HD2 LEU 75 -19.518 9.828 -15.052 603 HD22 LEU 75 1HD2 LEU 75 -19.439 11.589 -15.090 604 HD23 LEU 75 2HD2 LEU 75 -20.980 10.770 -15.349 605 H HIS 76 H HIS 76 -23.837 11.078 -12.256 606 HA HIS 76 HA HIS 76 -24.965 13.415 -10.871 607 HB2 HIS 76 1HB HIS 76 -26.368 11.320 -12.430 608 HB3 HIS 76 2HB HIS 76 -27.108 11.780 -10.899 609 HD1 HIS 76 HD1 HIS 76 -27.316 14.572 -10.684 610 HD2 HIS 76 HD2 HIS 76 -27.209 12.866 -14.471 611 HE1 HIS 76 HE1 HIS 76 -28.289 16.302 -12.229 612 H LEU 77 H LEU 77 -24.554 13.247 -8.776 613 HA LEU 77 HA LEU 77 -24.146 10.603 -7.594 614 HB2 LEU 77 1HB LEU 77 -22.391 12.185 -7.183 615 HB3 LEU 77 2HB LEU 77 -23.546 13.383 -6.602 616 HG LEU 77 HG LEU 77 -23.962 12.086 -4.612 617 HD11 LEU 77 1HD1 LEU 77 -21.971 10.102 -4.678 618 HD12 LEU 77 2HD1 LEU 77 -22.879 9.956 -6.183 619 HD13 LEU 77 3HD1 LEU 77 -23.721 9.884 -4.635 620 HD21 LEU 77 3HD2 LEU 77 -22.229 13.390 -4.000 621 HD22 LEU 77 1HD2 LEU 77 -21.234 12.897 -5.370 622 HD23 LEU 77 2HD2 LEU 77 -21.357 11.857 -3.951 623 H VAL 78 H VAL 78 -25.802 9.653 -6.628 624 HA VAL 78 HA VAL 78 -27.824 11.344 -5.307 625 HB VAL 78 HB VAL 78 -29.376 9.360 -5.666 626 HG11 VAL 78 1HG1 VAL 78 -29.581 11.430 -6.929 627 HG12 VAL 78 2HG1 VAL 78 -28.372 10.863 -8.082 628 HG13 VAL 78 3HG1 VAL 78 -29.927 10.039 -7.957 629 HG21 VAL 78 3HG2 VAL 78 -27.183 8.597 -7.591 630 HG22 VAL 78 1HG2 VAL 78 -27.742 7.670 -6.199 631 HG23 VAL 78 2HG2 VAL 78 -28.804 7.903 -7.587 632 H LEU 79 H LEU 79 -27.893 11.147 -3.175 633 HA LEU 79 HA LEU 79 -26.761 8.731 -1.941 634 HB2 LEU 79 1HB LEU 79 -26.972 11.580 -1.083 635 HB3 LEU 79 2HB LEU 79 -26.885 10.316 0.142 636 HG LEU 79 HG LEU 79 -24.700 11.340 -0.313 637 HD11 LEU 79 1HD1 LEU 79 -25.338 8.571 -0.302 638 HD12 LEU 79 2HD1 LEU 79 -23.890 9.374 0.305 639 HD13 LEU 79 3HD1 LEU 79 -23.955 8.821 -1.368 640 HD21 LEU 79 3HD2 LEU 79 -25.019 11.916 -2.652 641 HD22 LEU 79 1HD2 LEU 79 -25.074 10.206 -3.083 642 HD23 LEU 79 2HD2 LEU 79 -23.584 10.909 -2.455 643 H ARG 80 H ARG 80 -27.949 7.473 -0.605 644 HA ARG 80 HA ARG 80 -30.811 7.905 -0.576 645 HB2 ARG 80 1HB ARG 80 -29.889 5.666 -1.028 646 HB3 ARG 80 2HB ARG 80 -29.162 5.647 0.573 647 HG2 ARG 80 1HG ARG 80 -31.161 5.308 1.632 648 HG3 ARG 80 2HG ARG 80 -32.095 6.076 0.346 649 HD2 ARG 80 1HD ARG 80 -32.022 4.183 -1.005 650 HD3 ARG 80 2HD ARG 80 -30.633 3.511 -0.152 651 HE ARG 80 HE ARG 80 -32.801 3.680 1.623 652 HH11 ARG 80 1HH1 ARG 80 -31.777 1.912 -1.196 653 HH12 ARG 80 2HH1 ARG 80 -32.680 0.489 -0.792 654 HH21 ARG 80 1HH2 ARG 80 -33.993 1.813 2.166 655 HH22 ARG 80 2HH2 ARG 80 -33.941 0.435 1.120 656 H LEU 81 H LEU 81 -28.179 7.645 1.784 657 HA LEU 81 HA LEU 81 -30.019 8.516 3.898 658 HB2 LEU 81 1HB LEU 81 -27.291 7.252 3.966 659 HB3 LEU 81 2HB LEU 81 -28.061 7.934 5.398 660 HG LEU 81 HG LEU 81 -29.985 6.307 4.892 661 HD11 LEU 81 1HD1 LEU 81 -29.820 5.028 3.091 662 HD12 LEU 81 2HD1 LEU 81 -28.365 4.292 3.761 663 HD13 LEU 81 3HD1 LEU 81 -28.236 5.711 2.722 664 HD21 LEU 81 3HD2 LEU 81 -28.544 6.038 6.801 665 HD22 LEU 81 1HD2 LEU 81 -27.277 5.336 5.795 666 HD23 LEU 81 2HD2 LEU 81 -28.791 4.465 6.041 667 H ARG 82 H ARG 82 -28.558 9.801 5.663 668 HA ARG 82 HA ARG 82 -27.824 12.252 4.273 669 HB2 ARG 82 1HB ARG 82 -29.350 12.022 6.385 670 HB3 ARG 82 2HB ARG 82 -27.822 11.948 7.254 671 HG2 ARG 82 1HG ARG 82 -27.237 14.123 6.657 672 HG3 ARG 82 2HG ARG 82 -28.405 14.171 5.335 673 HD2 ARG 82 1HD ARG 82 -30.213 13.992 7.084 674 HD3 ARG 82 2HD ARG 82 -28.956 14.249 8.294 675 HE ARG 82 HE ARG 82 -29.014 16.469 7.788 676 HH11 ARG 82 1HH1 ARG 82 -30.336 14.689 5.104 677 HH12 ARG 82 2HH1 ARG 82 -30.791 16.108 4.219 678 HH21 ARG 82 1HH2 ARG 82 -29.607 18.344 6.632 679 HH22 ARG 82 2HH2 ARG 82 -30.375 18.186 5.089 680 H GLY 83 H GLY 83 -25.868 13.396 4.711 681 HA2 GLY 83 1HA GLY 83 -23.565 11.749 4.707 682 HA3 GLY 83 2HA GLY 83 -23.576 13.503 4.813 683 H TYR 84 H TYR 84 -23.948 14.457 6.949 684 HA TYR 84 HA TYR 84 -23.390 14.708 9.139 685 HB2 TYR 84 1HB TYR 84 -25.186 12.806 9.192 686 HB3 TYR 84 2HB TYR 84 -23.818 11.776 9.598 687 HD1 TYR 84 HD1 TYR 84 -25.316 15.038 10.647 688 HD2 TYR 84 HD2 TYR 84 -23.340 11.462 11.832 689 HE1 TYR 84 HE1 TYR 84 -25.511 15.719 13.002 690 HE2 TYR 84 HE2 TYR 84 -23.530 12.132 14.191 691 HH TYR 84 HH TYR 84 -25.436 14.867 15.177 692 H ALA 85 H ALA 85 -21.378 13.812 7.130 693 HA ALA 85 HA ALA 85 -19.511 12.193 8.636 694 HB1 ALA 85 1HB ALA 85 -18.134 12.231 6.712 695 HB2 ALA 85 2HB ALA 85 -19.794 12.083 6.131 696 HB3 ALA 85 3HB ALA 85 -18.969 13.640 6.055 697 H ASP 86 H ASP 86 -19.920 14.187 10.270 698 HA ASP 86 HA ASP 86 -17.740 16.119 9.838 699 HB2 ASP 86 1HB ASP 86 -18.870 17.571 11.440 700 HB3 ASP 86 2HB ASP 86 -19.977 17.119 10.146 701 H LEU 87 H LEU 87 -18.811 13.491 11.754 702 HA LEU 87 HA LEU 87 -16.469 13.822 13.495 703 HB2 LEU 87 1HB LEU 87 -19.111 12.761 14.466 704 HB3 LEU 87 2HB LEU 87 -17.679 13.132 15.425 705 HG LEU 87 HG LEU 87 -19.076 15.316 13.935 706 HD11 LEU 87 1HD1 LEU 87 -19.926 14.138 16.573 707 HD12 LEU 87 2HD1 LEU 87 -20.884 14.261 15.098 708 HD13 LEU 87 3HD1 LEU 87 -20.431 15.720 15.978 709 HD21 LEU 87 3HD2 LEU 87 -17.356 15.103 16.391 710 HD22 LEU 87 1HD2 LEU 87 -18.276 16.556 16.000 711 HD23 LEU 87 2HD2 LEU 87 -17.030 15.978 14.894 712 H ARG 88 H ARG 88 -15.285 12.015 13.820 713 HA ARG 88 HA ARG 88 -14.487 9.912 13.480 714 HB2 ARG 88 1HB ARG 88 -16.287 9.351 15.060 715 HB3 ARG 88 2HB ARG 88 -17.410 9.177 13.718 716 HG2 ARG 88 1HG ARG 88 -16.877 7.028 13.673 717 HG3 ARG 88 2HG ARG 88 -15.285 7.504 13.077 718 HD2 ARG 88 1HD ARG 88 -14.472 7.660 15.378 719 HD3 ARG 88 2HD ARG 88 -16.064 7.193 15.974 720 HE ARG 88 HE ARG 88 -15.304 5.181 14.266 721 HH11 ARG 88 1HH1 ARG 88 -14.028 6.636 17.160 722 HH12 ARG 88 2HH1 ARG 88 -13.252 5.186 17.704 723 HH21 ARG 88 1HH2 ARG 88 -14.286 3.265 14.971 724 HH22 ARG 88 2HH2 ARG 88 -13.398 3.269 16.457 725 H GLU 89 H GLU 89 -14.113 10.854 11.243 726 HA GLU 89 HA GLU 89 -15.025 8.915 9.305 727 HB2 GLU 89 1HB GLU 89 -16.007 11.704 9.337 728 HB3 GLU 89 2HB GLU 89 -15.466 11.104 7.776 729 HG2 GLU 89 1HG GLU 89 -17.550 9.819 9.527 730 HG3 GLU 89 2HG GLU 89 -17.861 10.788 8.088 731 H ASP 90 H ASP 90 -12.815 8.368 9.278 732 HA ASP 90 HA ASP 90 -11.098 10.338 7.913 733 HB2 ASP 90 1HB ASP 90 -10.550 8.481 10.170 734 HB3 ASP 90 2HB ASP 90 -9.265 8.710 8.989 735 HA PRO 91 HA PRO 91 -10.480 7.527 4.605 736 HB2 PRO 91 1HB PRO 91 -7.850 7.869 4.025 737 HB3 PRO 91 2HB PRO 91 -9.079 9.086 3.664 738 HG2 PRO 91 1HG PRO 91 -7.167 8.948 5.963 739 HG3 PRO 91 2HG PRO 91 -7.633 10.347 4.978 740 HD2 PRO 91 1HD PRO 91 -8.676 9.882 7.433 741 HD3 PRO 91 2HD PRO 91 -9.600 10.666 6.136 742 H ASP 92 H ASP 92 -8.621 5.887 3.799 743 HA ASP 92 HA ASP 92 -7.933 4.196 6.113 744 HB2 ASP 92 1HB ASP 92 -9.024 3.404 3.414 745 HB3 ASP 92 2HB ASP 92 -8.240 2.253 4.493 746 H ARG 93 H ARG 93 -6.294 6.195 4.768 747 HA ARG 93 HA ARG 93 -4.322 4.573 3.340 748 HB2 ARG 93 1HB ARG 93 -4.340 7.561 3.796 749 HB3 ARG 93 2HB ARG 93 -3.294 6.671 2.698 750 HG2 ARG 93 1HG ARG 93 -6.290 6.803 2.446 751 HG3 ARG 93 2HG ARG 93 -5.166 7.855 1.584 752 HD2 ARG 93 1HD ARG 93 -5.291 4.847 1.394 753 HD3 ARG 93 2HD ARG 93 -5.875 5.988 0.183 754 HE ARG 93 HE ARG 93 -3.220 6.604 0.579 755 HH11 ARG 93 1HH1 ARG 93 -5.050 3.829 -0.455 756 HH12 ARG 93 2HH1 ARG 93 -3.791 3.215 -1.474 757 HH21 ARG 93 1HH2 ARG 93 -1.554 5.806 -0.760 758 HH22 ARG 93 2HH2 ARG 93 -1.803 4.339 -1.646 759 H GLN 94 H GLN 94 -2.210 4.327 4.028 760 HA GLN 94 HA GLN 94 -1.199 5.610 6.374 761 HB2 GLN 94 1HB GLN 94 -0.940 3.522 7.709 762 HB3 GLN 94 2HB GLN 94 -2.611 4.039 7.525 763 HG2 GLN 94 1HG GLN 94 -1.516 2.074 5.585 764 HG3 GLN 94 2HG GLN 94 -1.901 1.529 7.217 765 HE21 GLN 94 2HE2 GLN 94 -4.123 2.704 7.914 766 HE22 GLN 94 1HE2 GLN 94 -5.414 2.386 6.811 767 H ASP 95 H ASP 95 0.991 4.842 6.931 768 HA ASP 95 HA ASP 95 2.325 3.696 4.567 769 HB2 ASP 95 1HB ASP 95 2.755 6.164 5.446 770 HB3 ASP 95 2HB ASP 95 3.838 5.327 6.555 771 H HIS 96 H HIS 96 4.537 2.727 5.171 772 HA HIS 96 HA HIS 96 4.173 1.044 7.562 773 HB2 HIS 96 1HB HIS 96 5.229 0.449 4.826 774 HB3 HIS 96 2HB HIS 96 5.835 -0.476 6.197 775 HD1 HIS 96 HD1 HIS 96 4.726 -2.659 5.458 776 HD2 HIS 96 HD2 HIS 96 2.046 0.470 5.995 777 HE1 HIS 96 HE1 HIS 96 2.443 -3.712 5.405 778 H HIS 97 H HIS 97 6.318 0.129 8.378 779 HA HIS 97 HA HIS 97 8.504 2.066 8.125 780 HB2 HIS 97 1HB HIS 97 7.284 1.137 10.731 781 HB3 HIS 97 2HB HIS 97 8.817 1.996 10.608 782 HD1 HIS 97 HD1 HIS 97 8.718 4.499 10.479 783 HD2 HIS 97 HD2 HIS 97 5.001 2.725 9.934 784 HE1 HIS 97 HE1 HIS 97 7.063 6.392 10.479 785 HA PRO 98 HA PRO 98 9.908 -2.363 7.910 786 HB2 PRO 98 1HB PRO 98 11.432 -2.021 5.689 787 HB3 PRO 98 2HB PRO 98 9.707 -2.405 5.621 788 HG2 PRO 98 1HG PRO 98 11.073 0.243 5.322 789 HG3 PRO 98 2HG PRO 98 9.735 -0.439 4.379 790 HD2 PRO 98 1HD PRO 98 9.351 1.384 6.344 791 HD3 PRO 98 2HD PRO 98 8.163 0.119 5.969 792 H GLY 99 H GLY 99 12.001 -3.186 8.327 793 HA2 GLY 99 1HA GLY 99 13.891 -1.129 9.272 794 HA3 GLY 99 2HA GLY 99 13.764 -2.755 9.926 795 H SER 100 H SER 100 14.933 -0.810 7.262 796 HA SER 100 HA SER 100 16.269 -3.094 6.048 797 HB2 SER 100 1HB SER 100 16.631 -1.752 4.178 798 HB3 SER 100 2HB SER 100 15.114 -1.106 4.802 799 HG SER 100 HG SER 100 17.321 0.218 4.358 800 H GLY 101 H GLY 101 18.449 -3.443 6.039 801 HA2 GLY 101 1HA GLY 101 20.555 -1.822 6.485 802 HA3 GLY 101 2HA GLY 101 19.963 -2.106 8.115 803 H ALA 102 H ALA 102 20.201 -4.268 5.302 804 HA ALA 102 HA ALA 102 22.392 -5.741 6.415 805 HB1 ALA 102 1HB ALA 102 19.739 -6.491 7.183 806 HB2 ALA 102 2HB ALA 102 20.459 -7.772 6.208 807 HB3 ALA 102 3HB ALA 102 21.281 -7.202 7.660 808 H GLN 103 H GLN 103 23.485 -6.690 4.810 809 HA GLN 103 HA GLN 103 22.805 -6.364 2.133 810 HB2 GLN 103 1HB GLN 103 24.818 -7.997 3.601 811 HB3 GLN 103 2HB GLN 103 24.539 -8.369 1.905 812 HG2 GLN 103 1HG GLN 103 25.378 -5.709 3.036 813 HG3 GLN 103 2HG GLN 103 26.394 -6.842 2.146 814 HE21 GLN 103 2HE2 GLN 103 25.468 -7.445 -0.055 815 HE22 GLN 103 1HE2 GLN 103 24.850 -6.139 -1.002 Start of MODEL 20 1 H1 GLY 1 H GLY 1 4.001 -3.320 -1.702 2 HA2 GLY 1 1HA GLY 1 4.719 -1.289 -2.930 3 HA3 GLY 1 2HA GLY 1 4.270 -2.576 -4.039 4 H SER 2 H SER 2 3.966 0.606 -3.574 5 HA SER 2 HA SER 2 1.209 1.091 -3.989 6 HB2 SER 2 1HB SER 2 2.074 3.362 -4.818 7 HB3 SER 2 2HB SER 2 2.468 2.912 -3.159 8 HG SER 2 HG SER 2 4.200 3.738 -4.704 9 H LEU 3 H LEU 3 0.756 2.609 -6.082 10 HA LEU 3 HA LEU 3 1.610 1.070 -8.442 11 HB2 LEU 3 1HB LEU 3 -0.670 1.375 -9.357 12 HB3 LEU 3 2HB LEU 3 -0.609 0.350 -7.924 13 HG LEU 3 HG LEU 3 -1.274 3.243 -7.611 14 HD11 LEU 3 1HD1 LEU 3 -3.637 1.620 -7.885 15 HD12 LEU 3 2HD1 LEU 3 -2.696 1.620 -9.376 16 HD13 LEU 3 3HD1 LEU 3 -3.224 3.146 -8.666 17 HD21 LEU 3 3HD2 LEU 3 -2.862 1.981 -5.929 18 HD22 LEU 3 1HD2 LEU 3 -1.166 2.273 -5.544 19 HD23 LEU 3 2HD2 LEU 3 -1.676 0.692 -6.134 20 H VAL 4 H VAL 4 2.152 2.228 -10.214 21 HA VAL 4 HA VAL 4 2.418 5.086 -9.914 22 HB VAL 4 HB VAL 4 4.241 3.841 -10.933 23 HG11 VAL 4 1HG1 VAL 4 3.884 2.179 -12.359 24 HG12 VAL 4 2HG1 VAL 4 2.154 2.523 -12.313 25 HG13 VAL 4 3HG1 VAL 4 3.178 3.301 -13.521 26 HG21 VAL 4 3HG2 VAL 4 2.823 5.710 -12.827 27 HG22 VAL 4 1HG2 VAL 4 4.030 6.131 -11.612 28 HG23 VAL 4 2HG2 VAL 4 4.493 5.177 -13.021 29 HA PRO 5 HA PRO 5 -1.371 6.111 -11.954 30 HB2 PRO 5 1HB PRO 5 -0.837 8.739 -12.378 31 HB3 PRO 5 2HB PRO 5 -1.270 8.091 -10.792 32 HG2 PRO 5 1HG PRO 5 1.434 8.752 -11.894 33 HG3 PRO 5 2HG PRO 5 0.772 9.080 -10.282 34 HD2 PRO 5 1HD PRO 5 2.450 7.013 -10.775 35 HD3 PRO 5 2HD PRO 5 1.175 6.934 -9.543 36 H ARG 6 H ARG 6 -1.338 5.057 -13.914 37 HA ARG 6 HA ARG 6 0.379 6.015 -16.052 38 HB2 ARG 6 1HB ARG 6 -0.273 3.546 -15.527 39 HB3 ARG 6 2HB ARG 6 -1.752 3.933 -16.396 40 HG2 ARG 6 1HG ARG 6 -0.373 2.992 -18.012 41 HG3 ARG 6 2HG ARG 6 -0.214 4.729 -18.280 42 HD2 ARG 6 1HD ARG 6 1.814 4.528 -16.672 43 HD3 ARG 6 2HD ARG 6 1.735 2.811 -17.066 44 HE ARG 6 HE ARG 6 1.712 4.069 -19.487 45 HH11 ARG 6 1HH1 ARG 6 3.820 4.100 -16.717 46 HH12 ARG 6 2HH1 ARG 6 5.247 4.429 -17.644 47 HH21 ARG 6 1HH2 ARG 6 3.583 4.503 -20.718 48 HH22 ARG 6 2HH2 ARG 6 5.110 4.659 -19.919 49 H GLY 7 H GLY 7 -0.732 8.170 -15.934 50 HA2 GLY 7 1HA GLY 7 -1.888 9.593 -17.414 51 HA3 GLY 7 2HA GLY 7 -2.845 8.220 -17.950 52 H SER 8 H SER 8 -4.463 10.093 -17.667 53 HA SER 8 HA SER 8 -6.172 9.477 -15.546 54 HB2 SER 8 1HB SER 8 -4.091 11.228 -14.760 55 HB3 SER 8 2HB SER 8 -5.558 12.200 -14.867 56 HG SER 8 HG SER 8 -6.185 11.301 -13.088 57 H MET 9 H MET 9 -7.945 11.221 -15.313 58 HA MET 9 HA MET 9 -8.255 12.982 -17.576 59 HB2 MET 9 1HB MET 9 -8.991 11.037 -18.702 60 HB3 MET 9 2HB MET 9 -9.883 10.465 -17.299 61 HG2 MET 9 1HG MET 9 -11.493 12.264 -17.567 62 HG3 MET 9 2HG MET 9 -10.586 12.883 -18.945 63 HE1 MET 9 3HE MET 9 -11.122 11.018 -21.779 64 HE2 MET 9 1HE MET 9 -9.782 11.368 -20.687 65 HE3 MET 9 2HE MET 9 -10.314 9.704 -20.925 66 H GLN 10 H GLN 10 -9.716 14.599 -17.197 67 HA GLN 10 HA GLN 10 -10.831 14.688 -14.498 68 HB2 GLN 10 1HB GLN 10 -9.759 16.634 -16.352 69 HB3 GLN 10 2HB GLN 10 -11.347 17.123 -15.779 70 HG2 GLN 10 1HG GLN 10 -8.908 16.523 -14.130 71 HG3 GLN 10 2HG GLN 10 -9.719 18.074 -14.335 72 HE21 GLN 10 2HE2 GLN 10 -9.147 16.851 -11.859 73 HE22 GLN 10 1HE2 GLN 10 -10.648 16.496 -11.081 74 H ILE 11 H ILE 11 -12.977 14.852 -14.051 75 HA ILE 11 HA ILE 11 -14.842 14.909 -16.326 76 HB ILE 11 HB ILE 11 -16.276 13.267 -15.149 77 HG12 ILE 11 1HG1 ILE 11 -13.905 12.588 -13.430 78 HG13 ILE 11 2HG1 ILE 11 -15.087 13.779 -12.899 79 HG21 ILE 11 1HG2 ILE 11 -15.155 11.379 -15.949 80 HG22 ILE 11 2HG2 ILE 11 -14.509 12.705 -16.914 81 HG23 ILE 11 3HG2 ILE 11 -13.568 12.050 -15.575 82 HD11 ILE 11 3HD1 ILE 11 -16.420 12.171 -12.189 83 HD12 ILE 11 1HD1 ILE 11 -16.458 11.450 -13.797 84 HD13 ILE 11 2HD1 ILE 11 -15.201 10.984 -12.651 85 H PHE 12 H PHE 12 -17.154 15.272 -15.521 86 HA PHE 12 HA PHE 12 -17.143 17.156 -13.257 87 HB2 PHE 12 1HB PHE 12 -18.665 17.464 -15.854 88 HB3 PHE 12 2HB PHE 12 -18.747 18.561 -14.479 89 HD1 PHE 12 HD2 PHE 12 -16.635 19.778 -13.792 90 HD2 PHE 12 HD1 PHE 12 -17.027 17.715 -17.494 91 HE1 PHE 12 HE2 PHE 12 -14.745 21.062 -14.703 92 HE2 PHE 12 HE1 PHE 12 -15.136 18.996 -18.411 93 HZ PHE 12 HZ PHE 12 -13.994 20.673 -17.016 94 H VAL 13 H VAL 13 -18.628 16.781 -11.742 95 HA VAL 13 HA VAL 13 -20.943 15.093 -12.428 96 HB VAL 13 HB VAL 13 -20.767 13.836 -10.449 97 HG11 VAL 13 1HG1 VAL 13 -18.938 12.585 -10.925 98 HG12 VAL 13 2HG1 VAL 13 -18.882 13.641 -12.337 99 HG13 VAL 13 3HG1 VAL 13 -17.854 13.976 -10.943 100 HG21 VAL 13 3HG2 VAL 13 -20.283 15.132 -8.656 101 HG22 VAL 13 1HG2 VAL 13 -18.659 14.499 -8.927 102 HG23 VAL 13 2HG2 VAL 13 -19.096 16.096 -9.535 103 H LYS 14 H LYS 14 -22.878 15.611 -11.471 104 HA LYS 14 HA LYS 14 -22.963 18.222 -10.144 105 HB2 LYS 14 1HB LYS 14 -24.867 16.649 -11.807 106 HB3 LYS 14 2HB LYS 14 -25.545 17.724 -10.591 107 HG2 LYS 14 1HG LYS 14 -25.478 18.993 -12.549 108 HG3 LYS 14 2HG LYS 14 -24.086 19.541 -11.612 109 HD2 LYS 14 1HD LYS 14 -22.572 18.545 -13.028 110 HD3 LYS 14 2HD LYS 14 -23.722 17.320 -13.569 111 HE2 LYS 14 1HE LYS 14 -23.857 20.249 -14.277 112 HE3 LYS 14 2HE LYS 14 -23.174 18.995 -15.311 113 HZ1 LYS 14 3HZ LYS 14 -25.990 19.384 -14.511 114 HZ2 LYS 14 1HZ LYS 14 -25.440 17.888 -15.079 115 HZ3 LYS 14 2HZ LYS 14 -25.342 19.257 -16.068 116 H THR 15 H THR 15 -23.363 18.391 -8.042 117 HA THR 15 HA THR 15 -23.973 16.014 -6.504 118 HB THR 15 HB THR 15 -23.633 17.428 -4.529 119 HG1 THR 15 HG1 THR 15 -22.970 19.580 -6.244 120 HG21 THR 15 3HG2 THR 15 -21.443 18.073 -6.486 121 HG22 THR 15 1HG2 THR 15 -21.706 16.436 -5.888 122 HG23 THR 15 2HG2 THR 15 -21.311 17.734 -4.761 123 H LEU 16 H LEU 16 -25.469 16.666 -4.458 124 HA LEU 16 HA LEU 16 -28.095 16.923 -5.573 125 HB2 LEU 16 1HB LEU 16 -26.924 16.312 -2.931 126 HB3 LEU 16 2HB LEU 16 -28.540 17.015 -2.924 127 HG LEU 16 HG LEU 16 -27.824 14.535 -4.479 128 HD11 LEU 16 1HD1 LEU 16 -28.754 14.865 -1.648 129 HD12 LEU 16 2HD1 LEU 16 -27.442 13.869 -2.276 130 HD13 LEU 16 3HD1 LEU 16 -29.118 13.410 -2.577 131 HD21 LEU 16 3HD2 LEU 16 -30.504 14.533 -3.767 132 HD22 LEU 16 1HD2 LEU 16 -29.836 14.900 -5.357 133 HD23 LEU 16 2HD2 LEU 16 -30.175 16.206 -4.221 134 H THR 17 H THR 17 -25.820 19.068 -4.137 135 HA THR 17 HA THR 17 -27.847 21.104 -3.608 136 HB THR 17 HB THR 17 -26.017 20.722 -1.954 137 HG1 THR 17 HG1 THR 17 -26.264 22.767 -1.473 138 HG21 THR 17 3HG2 THR 17 -23.890 20.609 -2.601 139 HG22 THR 17 1HG2 THR 17 -23.977 22.253 -3.233 140 HG23 THR 17 2HG2 THR 17 -24.391 20.886 -4.268 141 H GLY 18 H GLY 18 -27.236 20.250 -6.344 142 HA2 GLY 18 1HA GLY 18 -26.817 21.159 -8.412 143 HA3 GLY 18 2HA GLY 18 -27.313 22.673 -7.670 144 H LYS 19 H LYS 19 -24.530 20.922 -6.521 145 HA LYS 19 HA LYS 19 -22.825 23.099 -7.522 146 HB2 LYS 19 1HB LYS 19 -22.802 22.936 -5.118 147 HB3 LYS 19 2HB LYS 19 -22.478 21.209 -5.191 148 HG2 LYS 19 1HG LYS 19 -20.532 23.018 -6.500 149 HG3 LYS 19 2HG LYS 19 -20.576 22.997 -4.736 150 HD2 LYS 19 1HD LYS 19 -20.587 20.364 -6.078 151 HD3 LYS 19 2HD LYS 19 -19.095 21.300 -6.204 152 HE2 LYS 19 1HE LYS 19 -18.904 19.927 -4.271 153 HE3 LYS 19 2HE LYS 19 -19.171 21.577 -3.713 154 HZ1 LYS 19 3HZ LYS 19 -21.200 21.071 -2.892 155 HZ2 LYS 19 1HZ LYS 19 -20.527 19.523 -2.776 156 HZ3 LYS 19 2HZ LYS 19 -21.534 19.911 -4.078 157 H THR 20 H THR 20 -21.256 22.694 -8.949 158 HA THR 20 HA THR 20 -20.879 19.934 -9.832 159 HB THR 20 HB THR 20 -19.559 22.248 -11.191 160 HG1 THR 20 HG1 THR 20 -21.439 22.862 -12.145 161 HG21 THR 20 3HG2 THR 20 -19.334 19.781 -11.840 162 HG22 THR 20 1HG2 THR 20 -19.749 20.919 -13.121 163 HG23 THR 20 2HG2 THR 20 -21.000 19.904 -12.404 164 H ILE 21 H ILE 21 -19.250 18.801 -9.023 165 HA ILE 21 HA ILE 21 -16.842 20.231 -8.116 166 HB ILE 21 HB ILE 21 -17.883 19.017 -6.313 167 HG12 ILE 21 1HG1 ILE 21 -15.274 18.856 -6.932 168 HG13 ILE 21 2HG1 ILE 21 -15.958 18.111 -5.492 169 HG21 ILE 21 1HG2 ILE 21 -19.200 17.418 -7.500 170 HG22 ILE 21 2HG2 ILE 21 -17.761 16.646 -8.165 171 HG23 ILE 21 3HG2 ILE 21 -18.105 16.531 -6.440 172 HD11 ILE 21 3HD1 ILE 21 -15.703 16.623 -8.080 173 HD12 ILE 21 1HD1 ILE 21 -14.390 16.706 -6.906 174 HD13 ILE 21 2HD1 ILE 21 -15.933 15.979 -6.455 175 H THR 22 H THR 22 -14.899 19.778 -8.981 176 HA THR 22 HA THR 22 -14.816 18.118 -11.343 177 HB THR 22 HB THR 22 -12.320 19.298 -10.235 178 HG1 THR 22 HG1 THR 22 -12.926 21.359 -10.720 179 HG21 THR 22 3HG2 THR 22 -13.277 18.306 -12.723 180 HG22 THR 22 1HG2 THR 22 -11.663 18.891 -12.323 181 HG23 THR 22 2HG2 THR 22 -12.883 20.013 -12.926 182 H LEU 23 H LEU 23 -14.033 16.110 -11.499 183 HA LEU 23 HA LEU 23 -12.364 15.062 -9.323 184 HB2 LEU 23 1HB LEU 23 -14.956 14.434 -9.415 185 HB3 LEU 23 2HB LEU 23 -14.345 13.227 -10.545 186 HG LEU 23 HG LEU 23 -12.866 12.348 -8.803 187 HD11 LEU 23 1HD1 LEU 23 -12.312 14.051 -7.367 188 HD12 LEU 23 2HD1 LEU 23 -13.522 13.189 -6.416 189 HD13 LEU 23 3HD1 LEU 23 -13.964 14.663 -7.278 190 HD21 LEU 23 3HD2 LEU 23 -14.881 11.791 -7.150 191 HD22 LEU 23 1HD2 LEU 23 -14.748 11.081 -8.760 192 HD23 LEU 23 2HD2 LEU 23 -15.809 12.464 -8.491 193 H GLU 24 H GLU 24 -10.726 13.747 -9.952 194 HA GLU 24 HA GLU 24 -10.458 13.287 -12.844 195 HB2 GLU 24 1HB GLU 24 -8.106 13.338 -12.574 196 HB3 GLU 24 2HB GLU 24 -8.726 14.678 -11.620 197 HG2 GLU 24 1HG GLU 24 -8.684 12.749 -9.747 198 HG3 GLU 24 2HG GLU 24 -7.348 12.222 -10.770 199 H VAL 25 H VAL 25 -10.309 11.277 -13.643 200 HA VAL 25 HA VAL 25 -9.694 9.043 -11.868 201 HB VAL 25 HB VAL 25 -12.103 9.144 -11.725 202 HG11 VAL 25 1HG1 VAL 25 -12.111 9.024 -14.739 203 HG12 VAL 25 2HG1 VAL 25 -13.533 8.989 -13.694 204 HG13 VAL 25 3HG1 VAL 25 -12.522 10.433 -13.762 205 HG21 VAL 25 3HG2 VAL 25 -12.436 6.923 -12.009 206 HG22 VAL 25 1HG2 VAL 25 -11.838 6.935 -13.668 207 HG23 VAL 25 2HG2 VAL 25 -10.701 6.935 -12.321 208 H GLU 26 H GLU 26 -8.829 7.258 -12.902 209 HA GLU 26 HA GLU 26 -7.625 7.747 -15.441 210 HB2 GLU 26 1HB GLU 26 -7.745 5.082 -14.041 211 HB3 GLU 26 2HB GLU 26 -6.516 5.670 -15.152 212 HG2 GLU 26 1HG GLU 26 -5.804 7.317 -13.494 213 HG3 GLU 26 2HG GLU 26 -7.033 6.721 -12.379 214 HA PRO 27 HA PRO 27 -10.574 6.035 -18.205 215 HB2 PRO 27 1HB PRO 27 -8.949 4.999 -20.118 216 HB3 PRO 27 2HB PRO 27 -9.200 6.736 -19.908 217 HG2 PRO 27 1HG PRO 27 -6.935 5.023 -18.963 218 HG3 PRO 27 2HG PRO 27 -6.886 6.634 -19.703 219 HD2 PRO 27 1HD PRO 27 -6.652 6.249 -17.033 220 HD3 PRO 27 2HD PRO 27 -7.414 7.695 -17.726 221 H SER 28 H SER 28 -8.137 4.014 -16.787 222 HA SER 28 HA SER 28 -9.546 1.584 -17.628 223 HB2 SER 28 1HB SER 28 -7.499 0.486 -16.473 224 HB3 SER 28 2HB SER 28 -7.254 1.293 -18.022 225 HG SER 28 HG SER 28 -6.331 1.962 -15.509 226 H ASP 29 H ASP 29 -9.273 3.710 -15.014 227 HA ASP 29 HA ASP 29 -9.600 1.924 -12.844 228 HB2 ASP 29 1HB ASP 29 -9.950 4.855 -13.264 229 HB3 ASP 29 2HB ASP 29 -10.689 4.133 -11.838 230 H THR 30 H THR 30 -11.574 1.859 -11.458 231 HA THR 30 HA THR 30 -13.981 1.644 -13.146 232 HB THR 30 HB THR 30 -14.748 0.020 -11.298 233 HG1 THR 30 HG1 THR 30 -12.677 -1.046 -10.470 234 HG21 THR 30 3HG2 THR 30 -12.699 -1.555 -12.437 235 HG22 THR 30 1HG2 THR 30 -13.145 -0.346 -13.640 236 HG23 THR 30 2HG2 THR 30 -14.376 -1.412 -12.962 237 H ILE 31 H ILE 31 -16.046 1.687 -11.722 238 HA ILE 31 HA ILE 31 -16.428 4.233 -10.738 239 HB ILE 31 HB ILE 31 -17.951 1.773 -9.874 240 HG12 ILE 31 1HG1 ILE 31 -17.887 1.927 -12.302 241 HG13 ILE 31 2HG1 ILE 31 -19.493 2.355 -11.723 242 HG21 ILE 31 1HG2 ILE 31 -18.725 3.395 -8.451 243 HG22 ILE 31 2HG2 ILE 31 -18.414 4.700 -9.594 244 HG23 ILE 31 3HG2 ILE 31 -19.802 3.638 -9.827 245 HD11 ILE 31 3HD1 ILE 31 -17.495 3.974 -13.131 246 HD12 ILE 31 1HD1 ILE 31 -19.255 4.072 -13.140 247 HD13 ILE 31 2HD1 ILE 31 -18.338 4.789 -11.814 248 H GLU 32 H GLU 32 -15.629 1.285 -8.940 249 HA GLU 32 HA GLU 32 -15.844 2.213 -6.351 250 HB2 GLU 32 1HB GLU 32 -14.240 0.492 -5.728 251 HB3 GLU 32 2HB GLU 32 -15.357 -0.126 -6.937 252 HG2 GLU 32 1HG GLU 32 -13.345 0.787 -8.506 253 HG3 GLU 32 2HG GLU 32 -12.458 0.273 -7.072 254 H ASN 33 H ASN 33 -13.316 2.796 -8.705 255 HA ASN 33 HA ASN 33 -11.508 3.999 -6.827 256 HB2 ASN 33 1HB ASN 33 -11.528 3.377 -9.694 257 HB3 ASN 33 2HB ASN 33 -10.702 4.883 -9.305 258 HD21 ASN 33 2HD2 ASN 33 -8.612 4.593 -9.126 259 HD22 ASN 33 1HD2 ASN 33 -7.824 3.227 -8.421 260 H VAL 34 H VAL 34 -14.033 5.102 -8.980 261 HA VAL 34 HA VAL 34 -13.402 7.850 -8.984 262 HB VAL 34 HB VAL 34 -16.101 6.526 -9.291 263 HG11 VAL 34 1HG1 VAL 34 -16.326 8.882 -8.734 264 HG12 VAL 34 2HG1 VAL 34 -15.196 9.311 -10.020 265 HG13 VAL 34 3HG1 VAL 34 -16.761 8.603 -10.420 266 HG21 VAL 34 3HG2 VAL 34 -15.616 6.111 -11.448 267 HG22 VAL 34 1HG2 VAL 34 -14.715 7.615 -11.639 268 HG23 VAL 34 2HG2 VAL 34 -13.941 6.210 -10.906 269 H LYS 35 H LYS 35 -15.810 6.053 -7.062 270 HA LYS 35 HA LYS 35 -16.689 8.144 -5.471 271 HB2 LYS 35 1HB LYS 35 -17.594 6.515 -4.017 272 HB3 LYS 35 2HB LYS 35 -17.610 5.777 -5.613 273 HG2 LYS 35 1HG LYS 35 -16.707 4.031 -4.539 274 HG3 LYS 35 2HG LYS 35 -15.206 4.944 -4.713 275 HD2 LYS 35 1HD LYS 35 -16.063 6.040 -2.449 276 HD3 LYS 35 2HD LYS 35 -16.894 4.488 -2.311 277 HE2 LYS 35 1HE LYS 35 -14.872 3.286 -2.348 278 HE3 LYS 35 2HE LYS 35 -13.961 4.676 -2.936 279 HZ1 LYS 35 3HZ LYS 35 -15.218 5.278 -0.468 280 HZ2 LYS 35 1HZ LYS 35 -13.574 5.318 -0.866 281 HZ3 LYS 35 2HZ LYS 35 -14.275 3.881 -0.314 282 H ALA 36 H ALA 36 -13.725 6.343 -5.326 283 HA ALA 36 HA ALA 36 -12.926 6.759 -2.702 284 HB1 ALA 36 1HB ALA 36 -10.986 5.867 -3.370 285 HB2 ALA 36 2HB ALA 36 -11.786 5.657 -4.929 286 HB3 ALA 36 3HB ALA 36 -10.765 7.066 -4.645 287 H LYS 37 H LYS 37 -12.654 8.907 -5.500 288 HA LYS 37 HA LYS 37 -11.231 10.939 -4.063 289 HB2 LYS 37 1HB LYS 37 -12.722 11.158 -6.684 290 HB3 LYS 37 2HB LYS 37 -11.524 12.289 -6.067 291 HG2 LYS 37 1HG LYS 37 -10.855 9.412 -6.578 292 HG3 LYS 37 2HG LYS 37 -10.786 10.628 -7.855 293 HD2 LYS 37 1HD LYS 37 -9.012 11.733 -6.892 294 HD3 LYS 37 2HD LYS 37 -9.406 11.169 -5.266 295 HE2 LYS 37 1HE LYS 37 -8.499 9.037 -5.674 296 HE3 LYS 37 2HE LYS 37 -8.470 9.293 -7.418 297 HZ1 LYS 37 3HZ LYS 37 -6.405 10.025 -7.225 298 HZ2 LYS 37 1HZ LYS 37 -6.450 9.823 -5.546 299 HZ3 LYS 37 2HZ LYS 37 -6.926 11.293 -6.234 300 H ILE 38 H ILE 38 -14.573 10.195 -4.705 301 HA ILE 38 HA ILE 38 -15.683 12.721 -4.105 302 HB ILE 38 HB ILE 38 -16.889 9.962 -3.881 303 HG12 ILE 38 1HG1 ILE 38 -16.202 10.680 -6.155 304 HG13 ILE 38 2HG1 ILE 38 -17.946 10.489 -6.004 305 HG21 ILE 38 1HG2 ILE 38 -18.148 11.374 -2.440 306 HG22 ILE 38 2HG2 ILE 38 -18.154 12.681 -3.623 307 HG23 ILE 38 3HG2 ILE 38 -19.070 11.206 -3.934 308 HD11 ILE 38 3HD1 ILE 38 -17.461 12.458 -7.280 309 HD12 ILE 38 1HD1 ILE 38 -18.146 12.932 -5.726 310 HD13 ILE 38 2HD1 ILE 38 -16.410 13.074 -6.005 311 H GLN 39 H GLN 39 -14.595 10.072 -2.115 312 HA GLN 39 HA GLN 39 -15.918 10.619 0.267 313 HB2 GLN 39 1HB GLN 39 -13.343 9.307 -0.448 314 HB3 GLN 39 2HB GLN 39 -13.606 9.724 1.241 315 HG2 GLN 39 1HG GLN 39 -15.877 8.510 0.912 316 HG3 GLN 39 2HG GLN 39 -15.076 7.782 -0.479 317 HE21 GLN 39 2HE2 GLN 39 -16.027 6.612 2.053 318 HE22 GLN 39 1HE2 GLN 39 -14.655 5.816 2.738 319 H ASP 40 H ASP 40 -13.244 12.251 -1.247 320 HA ASP 40 HA ASP 40 -12.475 13.736 1.089 321 HB2 ASP 40 1HB ASP 40 -10.955 13.173 -0.859 322 HB3 ASP 40 2HB ASP 40 -11.820 14.398 -1.783 323 H LYS 41 H LYS 41 -14.856 14.054 -1.363 324 HA LYS 41 HA LYS 41 -15.237 16.903 -0.866 325 HB2 LYS 41 1HB LYS 41 -16.933 15.169 -2.650 326 HB3 LYS 41 2HB LYS 41 -16.707 16.911 -2.720 327 HG2 LYS 41 1HG LYS 41 -14.570 14.876 -3.317 328 HG3 LYS 41 2HG LYS 41 -15.548 15.706 -4.529 329 HD2 LYS 41 1HD LYS 41 -14.418 17.653 -4.298 330 HD3 LYS 41 2HD LYS 41 -14.182 17.433 -2.563 331 HE2 LYS 41 1HE LYS 41 -12.535 15.579 -3.231 332 HE3 LYS 41 2HE LYS 41 -12.589 16.299 -4.839 333 HZ1 LYS 41 3HZ LYS 41 -12.183 18.271 -2.827 334 HZ2 LYS 41 1HZ LYS 41 -11.246 17.923 -4.193 335 HZ3 LYS 41 2HZ LYS 41 -10.989 17.075 -2.752 336 H GLU 42 H GLU 42 -17.071 13.867 -0.610 337 HA GLU 42 HA GLU 42 -18.899 15.230 1.255 338 HB2 GLU 42 1HB GLU 42 -19.338 12.989 -0.697 339 HB3 GLU 42 2HB GLU 42 -20.411 13.207 0.679 340 HG2 GLU 42 1HG GLU 42 -19.867 15.224 -1.488 341 HG3 GLU 42 2HG GLU 42 -21.326 14.251 -1.304 342 H GLY 43 H GLY 43 -16.964 12.348 0.679 343 HA2 GLY 43 1HA GLY 43 -16.048 10.844 2.157 344 HA3 GLY 43 2HA GLY 43 -16.496 11.947 3.449 345 H ILE 44 H ILE 44 -18.199 9.844 1.123 346 HA ILE 44 HA ILE 44 -19.728 8.760 3.397 347 HB ILE 44 HB ILE 44 -21.612 8.418 1.737 348 HG12 ILE 44 1HG1 ILE 44 -19.984 10.422 0.158 349 HG13 ILE 44 2HG1 ILE 44 -20.309 8.758 -0.313 350 HG21 ILE 44 1HG2 ILE 44 -22.485 10.652 2.046 351 HG22 ILE 44 2HG2 ILE 44 -21.611 10.148 3.492 352 HG23 ILE 44 3HG2 ILE 44 -20.863 11.272 2.357 353 HD11 ILE 44 3HD1 ILE 44 -22.394 10.897 0.045 354 HD12 ILE 44 1HD1 ILE 44 -21.721 10.369 -1.497 355 HD13 ILE 44 2HD1 ILE 44 -22.666 9.248 -0.518 356 HA PRO 45 HA PRO 45 -18.503 4.752 2.081 357 HB2 PRO 45 1HB PRO 45 -20.638 3.284 2.891 358 HB3 PRO 45 2HB PRO 45 -19.458 3.965 4.017 359 HG2 PRO 45 1HG PRO 45 -22.164 4.995 3.255 360 HG3 PRO 45 2HG PRO 45 -21.412 4.905 4.858 361 HD2 PRO 45 1HD PRO 45 -21.507 7.198 3.420 362 HD3 PRO 45 2HD PRO 45 -20.166 6.815 4.519 363 HA PRO 46 HA PRO 46 -20.245 3.740 -1.829 364 HB2 PRO 46 1HB PRO 46 -19.905 1.048 -1.912 365 HB3 PRO 46 2HB PRO 46 -18.564 2.191 -2.059 366 HG2 PRO 46 1HG PRO 46 -19.482 0.646 0.335 367 HG3 PRO 46 2HG PRO 46 -17.831 0.938 -0.243 368 HD2 PRO 46 1HD PRO 46 -18.932 2.343 1.793 369 HD3 PRO 46 2HD PRO 46 -17.749 3.051 0.674 370 H ASP 47 H ASP 47 -21.373 1.817 0.913 371 HA ASP 47 HA ASP 47 -23.626 0.682 -0.344 372 HB2 ASP 47 1HB ASP 47 -24.465 0.441 2.055 373 HB3 ASP 47 2HB ASP 47 -22.922 -0.321 1.679 374 H GLN 48 H GLN 48 -23.003 3.841 0.865 375 HA GLN 48 HA GLN 48 -25.862 4.516 0.741 376 HB2 GLN 48 1HB GLN 48 -23.529 5.869 2.088 377 HB3 GLN 48 2HB GLN 48 -25.087 6.659 1.880 378 HG2 GLN 48 1HG GLN 48 -26.128 5.331 3.413 379 HG3 GLN 48 2HG GLN 48 -25.035 3.974 3.144 380 HE21 GLN 48 2HE2 GLN 48 -24.190 3.553 5.068 381 HE22 GLN 48 1HE2 GLN 48 -23.411 4.701 6.097 382 H GLN 49 H GLN 49 -22.779 5.062 -0.730 383 HA GLN 49 HA GLN 49 -23.766 7.318 -2.293 384 HB2 GLN 49 1HB GLN 49 -21.357 6.975 -1.255 385 HB3 GLN 49 2HB GLN 49 -21.083 6.091 -2.750 386 HG2 GLN 49 1HG GLN 49 -22.321 8.757 -3.007 387 HG3 GLN 49 2HG GLN 49 -20.639 8.710 -2.484 388 HE21 GLN 49 2HE2 GLN 49 -19.084 7.763 -3.863 389 HE22 GLN 49 1HE2 GLN 49 -19.366 7.627 -5.562 390 H ARG 50 H ARG 50 -23.957 7.304 -4.535 391 HA ARG 50 HA ARG 50 -23.438 4.916 -6.055 392 HB2 ARG 50 1HB ARG 50 -26.192 5.634 -5.171 393 HB3 ARG 50 2HB ARG 50 -25.986 5.029 -6.809 394 HG2 ARG 50 1HG ARG 50 -24.614 3.147 -5.569 395 HG3 ARG 50 2HG ARG 50 -25.629 3.640 -4.212 396 HD2 ARG 50 1HD ARG 50 -26.583 2.739 -6.928 397 HD3 ARG 50 2HD ARG 50 -26.657 1.806 -5.434 398 HE ARG 50 HE ARG 50 -28.021 4.096 -4.866 399 HH11 ARG 50 1HH1 ARG 50 -28.262 1.641 -7.323 400 HH12 ARG 50 2HH1 ARG 50 -29.975 1.817 -7.515 401 HH21 ARG 50 1HH2 ARG 50 -30.276 4.337 -5.110 402 HH22 ARG 50 2HH2 ARG 50 -31.119 3.352 -6.257 403 H LEU 51 H LEU 51 -22.888 5.494 -8.055 404 HA LEU 51 HA LEU 51 -23.438 8.230 -8.916 405 HB2 LEU 51 1HB LEU 51 -21.596 6.126 -10.042 406 HB3 LEU 51 2HB LEU 51 -21.760 7.765 -10.668 407 HG LEU 51 HG LEU 51 -19.799 7.813 -9.402 408 HD11 LEU 51 1HD1 LEU 51 -21.334 9.664 -8.892 409 HD12 LEU 51 2HD1 LEU 51 -20.284 9.270 -7.531 410 HD13 LEU 51 3HD1 LEU 51 -21.968 8.746 -7.526 411 HD21 LEU 51 3HD2 LEU 51 -19.429 6.755 -7.344 412 HD22 LEU 51 1HD2 LEU 51 -20.352 5.584 -8.286 413 HD23 LEU 51 2HD2 LEU 51 -21.154 6.543 -7.041 414 H ILE 52 H ILE 52 -24.550 8.754 -10.753 415 HA ILE 52 HA ILE 52 -25.922 6.529 -12.116 416 HB ILE 52 HB ILE 52 -26.973 9.346 -11.936 417 HG12 ILE 52 1HG1 ILE 52 -26.788 8.533 -9.659 418 HG13 ILE 52 2HG1 ILE 52 -28.480 8.501 -10.145 419 HG21 ILE 52 1HG2 ILE 52 -29.068 8.361 -12.588 420 HG22 ILE 52 2HG2 ILE 52 -27.822 7.861 -13.730 421 HG23 ILE 52 3HG2 ILE 52 -28.382 6.740 -12.490 422 HD11 ILE 52 3HD1 ILE 52 -28.502 6.421 -9.375 423 HD12 ILE 52 1HD1 ILE 52 -27.583 5.990 -10.818 424 HD13 ILE 52 2HD1 ILE 52 -26.741 6.340 -9.308 425 H PHE 53 H PHE 53 -25.822 6.402 -14.287 426 HA PHE 53 HA PHE 53 -24.842 8.692 -15.818 427 HB2 PHE 53 1HB PHE 53 -22.940 7.088 -15.126 428 HB3 PHE 53 2HB PHE 53 -23.650 5.969 -16.284 429 HD1 PHE 53 HD2 PHE 53 -22.716 9.583 -16.162 430 HD2 PHE 53 HD1 PHE 53 -22.680 5.935 -18.353 431 HE1 PHE 53 HE2 PHE 53 -21.484 10.692 -17.980 432 HE2 PHE 53 HE1 PHE 53 -21.447 7.037 -20.175 433 HZ PHE 53 HZ PHE 53 -20.848 9.419 -19.990 434 H ALA 54 H ALA 54 -26.066 8.993 -17.551 435 HA ALA 54 HA ALA 54 -27.521 8.645 -19.267 436 HB1 ALA 54 1HB ALA 54 -26.993 5.732 -19.377 437 HB2 ALA 54 2HB ALA 54 -27.058 6.924 -20.675 438 HB3 ALA 54 3HB ALA 54 -25.627 6.815 -19.650 439 H GLY 55 H GLY 55 -28.414 8.356 -16.513 440 HA2 GLY 55 1HA GLY 55 -30.468 7.948 -15.535 441 HA3 GLY 55 2HA GLY 55 -30.999 7.232 -17.050 442 H LYS 56 H LYS 56 -28.085 5.957 -15.837 443 HA LYS 56 HA LYS 56 -29.530 3.658 -14.691 444 HB2 LYS 56 1HB LYS 56 -28.497 3.235 -16.950 445 HB3 LYS 56 2HB LYS 56 -26.925 3.515 -16.213 446 HG2 LYS 56 1HG LYS 56 -27.063 1.586 -14.904 447 HG3 LYS 56 2HG LYS 56 -28.806 1.443 -15.142 448 HD2 LYS 56 1HD LYS 56 -28.174 1.181 -17.652 449 HD3 LYS 56 2HD LYS 56 -26.573 0.782 -17.023 450 HE2 LYS 56 1HE LYS 56 -27.830 -0.878 -15.503 451 HE3 LYS 56 2HE LYS 56 -29.173 -0.659 -16.624 452 HZ1 LYS 56 3HZ LYS 56 -28.033 -2.486 -17.452 453 HZ2 LYS 56 1HZ LYS 56 -26.509 -1.817 -17.148 454 HZ3 LYS 56 2HZ LYS 56 -27.459 -1.218 -18.412 455 H GLN 57 H GLN 57 -28.479 2.520 -12.996 456 HA GLN 57 HA GLN 57 -26.788 4.242 -11.375 457 HB2 GLN 57 1HB GLN 57 -27.184 2.545 -9.605 458 HB3 GLN 57 2HB GLN 57 -28.668 3.222 -10.262 459 HG2 GLN 57 1HG GLN 57 -28.174 0.989 -11.831 460 HG3 GLN 57 2HG GLN 57 -27.756 0.486 -10.194 461 HE21 GLN 57 2HE2 GLN 57 -30.285 2.286 -11.914 462 HE22 GLN 57 1HE2 GLN 57 -31.605 1.621 -11.020 463 H LEU 58 H LEU 58 -24.655 4.101 -11.462 464 HA LEU 58 HA LEU 58 -23.338 1.892 -12.733 465 HB2 LEU 58 1HB LEU 58 -22.014 4.081 -11.159 466 HB3 LEU 58 2HB LEU 58 -21.338 3.121 -12.473 467 HG LEU 58 HG LEU 58 -23.596 5.070 -12.877 468 HD11 LEU 58 1HD1 LEU 58 -21.476 6.318 -13.955 469 HD12 LEU 58 2HD1 LEU 58 -20.702 5.545 -12.572 470 HD13 LEU 58 3HD1 LEU 58 -22.068 6.633 -12.324 471 HD21 LEU 58 3HD2 LEU 58 -21.778 4.596 -15.073 472 HD22 LEU 58 1HD2 LEU 58 -23.532 4.431 -15.006 473 HD23 LEU 58 2HD2 LEU 58 -22.501 3.093 -14.497 474 H GLU 59 H GLU 59 -21.424 0.834 -11.667 475 HA GLU 59 HA GLU 59 -21.494 0.580 -8.798 476 HB2 GLU 59 1HB GLU 59 -21.821 -1.951 -8.971 477 HB3 GLU 59 2HB GLU 59 -23.251 -0.942 -9.145 478 HG2 GLU 59 1HG GLU 59 -23.426 -1.349 -11.413 479 HG3 GLU 59 2HG GLU 59 -21.735 -1.823 -11.561 480 H ASP 60 H ASP 60 -20.010 -1.486 -8.247 481 HA ASP 60 HA ASP 60 -17.477 -0.880 -9.498 482 HB2 ASP 60 1HB ASP 60 -16.561 -2.458 -7.793 483 HB3 ASP 60 2HB ASP 60 -17.497 -1.136 -7.100 484 H GLY 61 H GLY 61 -17.249 -1.749 -11.486 485 HA2 GLY 61 1HA GLY 61 -16.788 -4.535 -11.742 486 HA3 GLY 61 2HA GLY 61 -18.350 -4.120 -12.432 487 H ARG 62 H ARG 62 -18.161 -2.004 -13.851 488 HA ARG 62 HA ARG 62 -16.141 -2.632 -15.857 489 HB2 ARG 62 1HB ARG 62 -18.769 -1.260 -15.845 490 HB3 ARG 62 2HB ARG 62 -17.584 -0.668 -17.001 491 HG2 ARG 62 1HG ARG 62 -19.004 -2.325 -18.031 492 HG3 ARG 62 2HG ARG 62 -17.353 -2.936 -17.907 493 HD2 ARG 62 1HD ARG 62 -17.970 -4.208 -15.914 494 HD3 ARG 62 2HD ARG 62 -19.616 -3.586 -16.022 495 HE ARG 62 HE ARG 62 -19.263 -4.752 -18.426 496 HH11 ARG 62 1HH1 ARG 62 -18.745 -5.850 -15.163 497 HH12 ARG 62 2HH1 ARG 62 -19.075 -7.511 -15.531 498 HH21 ARG 62 1HH2 ARG 62 -19.699 -6.935 -18.923 499 HH22 ARG 62 2HH2 ARG 62 -19.616 -8.127 -17.670 500 H THR 63 H THR 63 -15.181 -0.712 -17.047 501 HA THR 63 HA THR 63 -14.055 1.106 -15.051 502 HB THR 63 HB THR 63 -12.343 0.038 -16.276 503 HG1 THR 63 HG1 THR 63 -11.874 2.216 -16.123 504 HG21 THR 63 3HG2 THR 63 -12.606 0.667 -18.955 505 HG22 THR 63 1HG2 THR 63 -14.244 0.228 -18.473 506 HG23 THR 63 2HG2 THR 63 -12.917 -0.907 -18.223 507 H LEU 64 H LEU 64 -13.692 3.372 -15.645 508 HA LEU 64 HA LEU 64 -16.023 4.703 -16.332 509 HB2 LEU 64 1HB LEU 64 -13.148 5.566 -16.331 510 HB3 LEU 64 2HB LEU 64 -14.451 6.677 -16.748 511 HG LEU 64 HG LEU 64 -13.884 7.062 -14.474 512 HD11 LEU 64 1HD1 LEU 64 -16.357 5.343 -14.470 513 HD12 LEU 64 2HD1 LEU 64 -16.298 7.006 -15.053 514 HD13 LEU 64 3HD1 LEU 64 -15.965 6.653 -13.357 515 HD21 LEU 64 3HD2 LEU 64 -14.435 4.205 -13.757 516 HD22 LEU 64 1HD2 LEU 64 -13.578 5.440 -12.835 517 HD23 LEU 64 2HD2 LEU 64 -12.826 4.723 -14.260 518 H SER 65 H SER 65 -13.414 3.561 -18.360 519 HA SER 65 HA SER 65 -14.157 5.023 -20.690 520 HB2 SER 65 1HB SER 65 -11.907 4.225 -20.561 521 HB3 SER 65 2HB SER 65 -12.441 2.569 -20.280 522 HG SER 65 HG SER 65 -12.679 4.090 -22.660 523 H GLU 66 H GLU 66 -14.841 1.762 -19.500 524 HA GLU 66 HA GLU 66 -16.316 0.975 -21.817 525 HB2 GLU 66 1HB GLU 66 -16.115 -0.182 -19.038 526 HB3 GLU 66 2HB GLU 66 -17.081 -0.911 -20.313 527 HG2 GLU 66 1HG GLU 66 -14.247 -0.320 -20.927 528 HG3 GLU 66 2HG GLU 66 -14.581 -1.642 -19.810 529 H TYR 67 H TYR 67 -17.035 2.805 -19.011 530 HA TYR 67 HA TYR 67 -19.899 2.359 -19.169 531 HB2 TYR 67 1HB TYR 67 -18.046 3.706 -17.294 532 HB3 TYR 67 2HB TYR 67 -19.653 4.411 -17.425 533 HD1 TYR 67 HD1 TYR 67 -21.488 2.277 -17.627 534 HD2 TYR 67 HD2 TYR 67 -17.857 2.395 -15.412 535 HE1 TYR 67 HE1 TYR 67 -22.370 0.560 -16.102 536 HE2 TYR 67 HE2 TYR 67 -18.728 0.678 -13.882 537 HH TYR 67 HH TYR 67 -20.623 -1.270 -14.187 538 H ASN 68 H ASN 68 -17.920 3.944 -21.102 539 HA ASN 68 HA ASN 68 -18.150 5.622 -22.620 540 HB2 ASN 68 1HB ASN 68 -20.464 4.573 -22.793 541 HB3 ASN 68 2HB ASN 68 -21.025 5.862 -21.732 542 HD21 ASN 68 2HD2 ASN 68 -21.916 7.480 -22.764 543 HD22 ASN 68 1HD2 ASN 68 -21.497 8.044 -24.342 544 H ILE 69 H ILE 69 -17.539 6.141 -19.749 545 HA ILE 69 HA ILE 69 -18.594 8.826 -19.339 546 HB ILE 69 HB ILE 69 -16.754 7.157 -17.622 547 HG12 ILE 69 1HG1 ILE 69 -19.560 7.955 -16.924 548 HG13 ILE 69 2HG1 ILE 69 -19.279 6.567 -17.969 549 HG21 ILE 69 1HG2 ILE 69 -16.248 9.029 -16.544 550 HG22 ILE 69 2HG2 ILE 69 -17.324 9.964 -17.581 551 HG23 ILE 69 3HG2 ILE 69 -17.950 9.204 -16.119 552 HD11 ILE 69 3HD1 ILE 69 -17.859 5.584 -16.201 553 HD12 ILE 69 1HD1 ILE 69 -18.292 6.935 -15.153 554 HD13 ILE 69 2HD1 ILE 69 -19.537 5.818 -15.712 555 H GLN 70 H GLN 70 -17.622 10.225 -20.715 556 HA GLN 70 HA GLN 70 -14.770 10.111 -21.190 557 HB2 GLN 70 1HB GLN 70 -16.661 12.275 -22.096 558 HB3 GLN 70 2HB GLN 70 -15.115 11.825 -22.802 559 HG2 GLN 70 1HG GLN 70 -17.649 10.203 -22.840 560 HG3 GLN 70 2HG GLN 70 -16.914 11.052 -24.199 561 HE21 GLN 70 2HE2 GLN 70 -17.409 8.108 -23.069 562 HE22 GLN 70 1HE2 GLN 70 -15.986 7.296 -23.616 563 H LYS 71 H LYS 71 -14.022 12.723 -21.368 564 HA LYS 71 HA LYS 71 -13.653 13.399 -18.590 565 HB2 LYS 71 1HB LYS 71 -12.055 14.997 -19.351 566 HB3 LYS 71 2HB LYS 71 -11.851 13.557 -20.340 567 HG2 LYS 71 1HG LYS 71 -13.476 14.802 -21.964 568 HG3 LYS 71 2HG LYS 71 -12.931 16.231 -21.083 569 HD2 LYS 71 1HD LYS 71 -10.568 15.455 -21.549 570 HD3 LYS 71 2HD LYS 71 -11.269 14.274 -22.658 571 HE2 LYS 71 1HE LYS 71 -11.658 17.261 -22.823 572 HE3 LYS 71 2HE LYS 71 -10.516 16.334 -23.794 573 HZ1 LYS 71 3HZ LYS 71 -12.277 16.400 -25.207 574 HZ2 LYS 71 1HZ LYS 71 -13.433 16.464 -23.973 575 HZ3 LYS 71 2HZ LYS 71 -12.689 14.995 -24.359 576 H GLU 72 H GLU 72 -16.033 14.053 -20.796 577 HA GLU 72 HA GLU 72 -16.719 16.590 -19.462 578 HB2 GLU 72 1HB GLU 72 -17.198 15.703 -22.303 579 HB3 GLU 72 2HB GLU 72 -18.073 17.043 -21.575 580 HG2 GLU 72 1HG GLU 72 -15.720 17.966 -21.030 581 HG3 GLU 72 2HG GLU 72 -15.176 16.835 -22.267 582 H SER 73 H SER 73 -17.470 13.412 -19.599 583 HA SER 73 HA SER 73 -20.242 13.288 -19.870 584 HB2 SER 73 1HB SER 73 -19.983 11.115 -19.303 585 HB3 SER 73 2HB SER 73 -18.257 11.473 -19.331 586 HG SER 73 HG SER 73 -19.403 10.504 -17.334 587 H THR 74 H THR 74 -21.945 13.377 -18.408 588 HA THR 74 HA THR 74 -21.385 14.947 -15.990 589 HB THR 74 HB THR 74 -24.190 14.567 -16.861 590 HG1 THR 74 HG1 THR 74 -24.007 15.844 -18.635 591 HG21 THR 74 3HG2 THR 74 -23.986 16.044 -15.088 592 HG22 THR 74 1HG2 THR 74 -24.025 17.139 -16.469 593 HG23 THR 74 2HG2 THR 74 -22.487 16.739 -15.705 594 H LEU 75 H LEU 75 -21.258 13.799 -14.180 595 HA LEU 75 HA LEU 75 -22.865 11.355 -13.922 596 HB2 LEU 75 1HB LEU 75 -20.248 12.237 -12.911 597 HB3 LEU 75 2HB LEU 75 -21.236 11.348 -11.754 598 HG LEU 75 HG LEU 75 -19.620 9.932 -12.988 599 HD11 LEU 75 1HD1 LEU 75 -21.093 8.366 -12.448 600 HD12 LEU 75 2HD1 LEU 75 -21.853 8.596 -14.023 601 HD13 LEU 75 3HD1 LEU 75 -22.433 9.500 -12.624 602 HD21 LEU 75 3HD2 LEU 75 -21.297 10.741 -15.358 603 HD22 LEU 75 1HD2 LEU 75 -20.174 9.381 -15.352 604 HD23 LEU 75 2HD2 LEU 75 -19.571 11.022 -15.119 605 H HIS 76 H HIS 76 -23.981 10.925 -11.941 606 HA HIS 76 HA HIS 76 -24.599 13.318 -10.344 607 HB2 HIS 76 1HB HIS 76 -26.456 11.486 -11.788 608 HB3 HIS 76 2HB HIS 76 -26.969 12.114 -10.225 609 HD1 HIS 76 HD1 HIS 76 -27.535 14.615 -10.080 610 HD2 HIS 76 HD2 HIS 76 -26.286 13.393 -13.849 611 HE1 HIS 76 HE1 HIS 76 -28.082 16.525 -11.622 612 H LEU 77 H LEU 77 -24.549 13.030 -8.199 613 HA LEU 77 HA LEU 77 -24.018 10.334 -7.202 614 HB2 LEU 77 1HB LEU 77 -23.727 13.033 -5.894 615 HB3 LEU 77 2HB LEU 77 -23.333 11.497 -5.126 616 HG LEU 77 HG LEU 77 -21.738 11.249 -7.212 617 HD11 LEU 77 1HD1 LEU 77 -21.045 14.005 -7.081 618 HD12 LEU 77 2HD1 LEU 77 -22.738 13.871 -7.556 619 HD13 LEU 77 3HD1 LEU 77 -21.492 13.041 -8.489 620 HD21 LEU 77 3HD2 LEU 77 -20.522 11.176 -5.326 621 HD22 LEU 77 1HD2 LEU 77 -21.436 12.478 -4.564 622 HD23 LEU 77 2HD2 LEU 77 -20.150 12.858 -5.709 623 H VAL 78 H VAL 78 -25.670 9.196 -6.454 624 HA VAL 78 HA VAL 78 -27.917 10.626 -5.193 625 HB VAL 78 HB VAL 78 -29.198 8.475 -5.675 626 HG11 VAL 78 1HG1 VAL 78 -28.592 9.474 -8.335 627 HG12 VAL 78 2HG1 VAL 78 -30.085 9.579 -7.400 628 HG13 VAL 78 3HG1 VAL 78 -28.806 10.770 -7.159 629 HG21 VAL 78 3HG2 VAL 78 -27.073 8.012 -7.745 630 HG22 VAL 78 1HG2 VAL 78 -27.027 7.222 -6.169 631 HG23 VAL 78 2HG2 VAL 78 -28.388 6.944 -7.256 632 H LEU 79 H LEU 79 -28.637 10.008 -3.199 633 HA LEU 79 HA LEU 79 -26.964 8.049 -1.778 634 HB2 LEU 79 1HB LEU 79 -28.385 10.535 -0.925 635 HB3 LEU 79 2HB LEU 79 -28.051 9.271 0.257 636 HG LEU 79 HG LEU 79 -26.367 11.036 0.326 637 HD11 LEU 79 1HD1 LEU 79 -25.887 8.490 0.609 638 HD12 LEU 79 2HD1 LEU 79 -24.553 9.640 0.544 639 HD13 LEU 79 3HD1 LEU 79 -24.971 8.694 -0.884 640 HD21 LEU 79 3HD2 LEU 79 -25.275 10.251 -2.319 641 HD22 LEU 79 1HD2 LEU 79 -25.178 11.789 -1.462 642 HD23 LEU 79 2HD2 LEU 79 -26.667 11.335 -2.293 643 H ARG 80 H ARG 80 -27.869 6.362 -0.697 644 HA ARG 80 HA ARG 80 -30.794 6.071 -0.916 645 HB2 ARG 80 1HB ARG 80 -29.456 4.526 -2.362 646 HB3 ARG 80 2HB ARG 80 -28.752 3.844 -0.902 647 HG2 ARG 80 1HG ARG 80 -30.513 2.412 -1.650 648 HG3 ARG 80 2HG ARG 80 -31.030 3.207 -0.162 649 HD2 ARG 80 1HD ARG 80 -32.280 4.851 -1.504 650 HD3 ARG 80 2HD ARG 80 -31.800 3.995 -2.969 651 HE ARG 80 HE ARG 80 -33.862 3.240 -1.121 652 HH11 ARG 80 1HH1 ARG 80 -31.605 2.084 -3.506 653 HH12 ARG 80 2HH1 ARG 80 -32.530 0.669 -3.885 654 HH21 ARG 80 1HH2 ARG 80 -35.089 1.381 -1.611 655 HH22 ARG 80 2HH2 ARG 80 -34.512 0.271 -2.807 656 H LEU 81 H LEU 81 -28.199 4.405 0.872 657 HA LEU 81 HA LEU 81 -29.839 4.033 3.170 658 HB2 LEU 81 1HB LEU 81 -27.013 3.490 2.439 659 HB3 LEU 81 2HB LEU 81 -27.420 3.536 4.153 660 HG LEU 81 HG LEU 81 -29.191 1.798 3.644 661 HD11 LEU 81 1HD1 LEU 81 -29.080 0.565 1.629 662 HD12 LEU 81 2HD1 LEU 81 -27.609 1.393 1.118 663 HD13 LEU 81 3HD1 LEU 81 -29.140 2.267 1.167 664 HD21 LEU 81 3HD2 LEU 81 -27.647 -0.010 3.812 665 HD22 LEU 81 1HD2 LEU 81 -26.956 1.359 4.684 666 HD23 LEU 81 2HD2 LEU 81 -26.358 0.944 3.077 667 H ARG 82 H ARG 82 -28.803 4.665 5.399 668 HA ARG 82 HA ARG 82 -27.584 7.285 5.437 669 HB2 ARG 82 1HB ARG 82 -29.915 7.899 5.134 670 HB3 ARG 82 2HB ARG 82 -30.392 6.860 6.470 671 HG2 ARG 82 1HG ARG 82 -29.735 8.345 8.044 672 HG3 ARG 82 2HG ARG 82 -28.398 8.956 7.068 673 HD2 ARG 82 1HD ARG 82 -29.642 10.719 6.546 674 HD3 ARG 82 2HD ARG 82 -30.751 9.643 5.697 675 HE ARG 82 HE ARG 82 -31.150 10.875 8.269 676 HH11 ARG 82 1HH1 ARG 82 -32.067 8.270 6.150 677 HH12 ARG 82 2HH1 ARG 82 -33.610 8.029 6.900 678 HH21 ARG 82 1HH2 ARG 82 -33.179 10.568 9.265 679 HH22 ARG 82 2HH2 ARG 82 -34.242 9.337 8.671 680 H GLY 83 H GLY 83 -26.068 7.092 6.942 681 HA2 GLY 83 1HA GLY 83 -26.586 6.552 9.640 682 HA3 GLY 83 2HA GLY 83 -26.020 5.063 8.897 683 H TYR 84 H TYR 84 -25.160 8.516 9.075 684 HA TYR 84 HA TYR 84 -22.465 8.201 8.377 685 HB2 TYR 84 1HB TYR 84 -23.681 10.370 8.413 686 HB3 TYR 84 2HB TYR 84 -23.655 10.326 10.173 687 HD1 TYR 84 HD2 TYR 84 -21.419 10.380 11.350 688 HD2 TYR 84 HD1 TYR 84 -21.837 11.184 7.193 689 HE1 TYR 84 HE2 TYR 84 -19.223 11.488 11.349 690 HE2 TYR 84 HE1 TYR 84 -19.641 12.293 7.180 691 HH TYR 84 HH TYR 84 -18.137 13.422 9.709 692 H ALA 85 H ALA 85 -20.759 7.440 9.441 693 HA ALA 85 HA ALA 85 -20.315 7.719 12.209 694 HB1 ALA 85 1HB ALA 85 -21.309 5.014 11.328 695 HB2 ALA 85 2HB ALA 85 -20.504 5.329 12.866 696 HB3 ALA 85 3HB ALA 85 -22.052 6.093 12.509 697 H ASP 86 H ASP 86 -18.337 6.659 12.920 698 HA ASP 86 HA ASP 86 -16.712 5.171 11.130 699 HB2 ASP 86 1HB ASP 86 -15.049 6.799 10.552 700 HB3 ASP 86 2HB ASP 86 -16.614 7.452 10.078 701 H LEU 87 H LEU 87 -14.266 5.405 11.982 702 HA LEU 87 HA LEU 87 -14.463 5.055 14.893 703 HB2 LEU 87 1HB LEU 87 -12.267 4.091 13.073 704 HB3 LEU 87 2HB LEU 87 -12.552 3.628 14.750 705 HG LEU 87 HG LEU 87 -14.295 2.914 12.392 706 HD11 LEU 87 1HD1 LEU 87 -12.125 1.508 13.862 707 HD12 LEU 87 2HD1 LEU 87 -12.515 1.501 12.143 708 HD13 LEU 87 3HD1 LEU 87 -13.498 0.571 13.273 709 HD21 LEU 87 3HD2 LEU 87 -14.793 2.935 15.238 710 HD22 LEU 87 1HD2 LEU 87 -14.913 1.305 14.574 711 HD23 LEU 87 2HD2 LEU 87 -15.898 2.605 13.902 712 H ARG 88 H ARG 88 -12.237 5.459 16.000 713 HA ARG 88 HA ARG 88 -10.531 7.461 14.952 714 HB2 ARG 88 1HB ARG 88 -12.651 8.772 15.392 715 HB3 ARG 88 2HB ARG 88 -12.406 8.443 17.102 716 HG2 ARG 88 1HG ARG 88 -10.162 9.650 15.581 717 HG3 ARG 88 2HG ARG 88 -11.551 10.666 15.972 718 HD2 ARG 88 1HD ARG 88 -11.246 9.706 18.367 719 HD3 ARG 88 2HD ARG 88 -9.623 9.302 17.807 720 HE ARG 88 HE ARG 88 -9.838 11.900 17.144 721 HH11 ARG 88 1HH1 ARG 88 -10.464 10.166 20.097 722 HH12 ARG 88 2HH1 ARG 88 -10.067 11.505 21.121 723 HH21 ARG 88 1HH2 ARG 88 -9.312 13.671 18.482 724 HH22 ARG 88 2HH2 ARG 88 -9.412 13.499 20.202 725 H GLU 89 H GLU 89 -8.677 6.859 15.841 726 HA GLU 89 HA GLU 89 -8.682 5.855 18.602 727 HB2 GLU 89 1HB GLU 89 -7.775 4.305 16.953 728 HB3 GLU 89 2HB GLU 89 -6.639 5.527 16.398 729 HG2 GLU 89 1HG GLU 89 -6.580 4.774 19.267 730 HG3 GLU 89 2HG GLU 89 -5.941 3.627 18.090 731 H ASP 90 H ASP 90 -7.261 6.657 20.138 732 HA ASP 90 HA ASP 90 -5.891 9.165 19.418 733 HB2 ASP 90 1HB ASP 90 -6.330 9.632 21.986 734 HB3 ASP 90 2HB ASP 90 -7.554 9.995 20.773 735 HA PRO 91 HA PRO 91 -2.169 7.583 21.114 736 HB2 PRO 91 1HB PRO 91 -1.111 9.764 22.338 737 HB3 PRO 91 2HB PRO 91 -1.185 9.590 20.581 738 HG2 PRO 91 1HG PRO 91 -2.998 11.115 22.411 739 HG3 PRO 91 2HG PRO 91 -2.334 11.595 20.838 740 HD2 PRO 91 1HD PRO 91 -4.862 10.673 21.132 741 HD3 PRO 91 2HD PRO 91 -3.906 10.386 19.664 742 H ASP 92 H ASP 92 -0.780 7.841 23.286 743 HA ASP 92 HA ASP 92 -2.139 8.201 25.726 744 HB2 ASP 92 1HB ASP 92 -3.140 6.004 24.656 745 HB3 ASP 92 2HB ASP 92 -1.659 5.284 25.281 746 H ARG 93 H ARG 93 -0.242 9.228 26.300 747 HA ARG 93 HA ARG 93 2.082 7.461 26.701 748 HB2 ARG 93 1HB ARG 93 2.198 10.442 26.226 749 HB3 ARG 93 2HB ARG 93 3.553 9.325 26.317 750 HG2 ARG 93 1HG ARG 93 1.431 9.324 24.180 751 HG3 ARG 93 2HG ARG 93 3.057 9.991 24.018 752 HD2 ARG 93 1HD ARG 93 3.739 7.560 24.804 753 HD3 ARG 93 2HD ARG 93 2.159 7.158 24.134 754 HE ARG 93 HE ARG 93 3.500 8.696 22.244 755 HH11 ARG 93 1HH1 ARG 93 3.828 5.597 23.794 756 HH12 ARG 93 2HH1 ARG 93 4.634 4.863 22.448 757 HH21 ARG 93 1HH2 ARG 93 4.560 7.741 20.465 758 HH22 ARG 93 2HH2 ARG 93 5.051 6.083 20.555 759 H GLN 94 H GLN 94 0.745 7.123 28.749 760 HA GLN 94 HA GLN 94 1.174 9.270 30.699 761 HB2 GLN 94 1HB GLN 94 -1.103 8.196 30.420 762 HB3 GLN 94 2HB GLN 94 -0.406 6.731 31.098 763 HG2 GLN 94 1HG GLN 94 0.099 7.891 33.162 764 HG3 GLN 94 2HG GLN 94 -0.511 9.399 32.485 765 HE21 GLN 94 2HE2 GLN 94 -1.733 9.048 34.619 766 HE22 GLN 94 1HE2 GLN 94 -3.272 8.276 34.476 767 H ASP 95 H ASP 95 2.923 9.171 31.925 768 HA ASP 95 HA ASP 95 3.772 6.628 33.050 769 HB2 ASP 95 1HB ASP 95 5.019 6.864 30.899 770 HB3 ASP 95 2HB ASP 95 5.719 8.359 31.514 771 H HIS 96 H HIS 96 5.181 6.854 34.865 772 HA HIS 96 HA HIS 96 5.549 9.577 35.879 773 HB2 HIS 96 1HB HIS 96 3.413 8.634 36.798 774 HB3 HIS 96 2HB HIS 96 4.363 7.361 37.559 775 HD1 HIS 96 HD1 HIS 96 4.796 11.149 37.471 776 HD2 HIS 96 HD2 HIS 96 4.575 7.997 40.169 777 HE1 HIS 96 HE1 HIS 96 5.139 12.180 39.739 778 H HIS 97 H HIS 97 7.187 9.785 37.474 779 HA HIS 97 HA HIS 97 9.056 7.508 37.528 780 HB2 HIS 97 1HB HIS 97 9.470 10.445 37.238 781 HB3 HIS 97 2HB HIS 97 10.693 9.526 38.110 782 HD1 HIS 97 HD1 HIS 97 12.426 8.427 36.714 783 HD2 HIS 97 HD2 HIS 97 9.034 9.392 34.518 784 HE1 HIS 97 HE1 HIS 97 12.993 7.879 34.325 785 HA PRO 98 HA PRO 98 8.951 7.364 41.910 786 HB2 PRO 98 1HB PRO 98 11.550 6.905 42.547 787 HB3 PRO 98 2HB PRO 98 10.514 5.683 41.800 788 HG2 PRO 98 1HG PRO 98 12.546 7.478 40.530 789 HG3 PRO 98 2HG PRO 98 12.244 5.754 40.247 790 HD2 PRO 98 1HD PRO 98 11.327 7.686 38.586 791 HD3 PRO 98 2HD PRO 98 10.449 6.167 38.861 792 H GLY 99 H GLY 99 10.307 8.181 43.922 793 HA2 GLY 99 1HA GLY 99 11.325 10.891 43.450 794 HA3 GLY 99 2HA GLY 99 9.947 10.699 44.524 795 H SER 100 H SER 100 13.366 10.252 44.126 796 HA SER 100 HA SER 100 13.867 10.397 46.899 797 HB2 SER 100 1HB SER 100 13.022 8.084 46.880 798 HB3 SER 100 2HB SER 100 14.232 7.652 45.672 799 HG SER 100 HG SER 100 14.620 7.339 48.108 800 H GLY 101 H GLY 101 15.725 11.460 46.964 801 HA2 GLY 101 1HA GLY 101 17.843 10.696 45.055 802 HA3 GLY 101 2HA GLY 101 17.445 12.384 45.337 803 H ALA 102 H ALA 102 18.852 9.492 46.728 804 HA ALA 102 HA ALA 102 20.774 10.948 48.195 805 HB1 ALA 102 1HB ALA 102 19.673 9.790 50.423 806 HB2 ALA 102 2HB ALA 102 19.560 11.496 49.989 807 HB3 ALA 102 3HB ALA 102 18.257 10.389 49.558 808 H GLN 103 H GLN 103 22.300 9.592 49.255 809 HA GLN 103 HA GLN 103 22.096 6.776 48.431 810 HB2 GLN 103 1HB GLN 103 23.977 8.322 47.559 811 HB3 GLN 103 2HB GLN 103 24.662 8.155 49.170 812 HG2 GLN 103 1HG GLN 103 25.744 6.533 47.900 813 HG3 GLN 103 2HG GLN 103 24.514 5.643 48.796 814 HE21 GLN 103 2HE2 GLN 103 24.351 3.966 47.368 815 HE22 GLN 103 1HE2 GLN 103 23.696 4.131 45.778
Contact the webmaster for help, if required. Tuesday, May 21, 2024 12:54:37 PM GMT (wattos1)