NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
10124 | 1p94 | 5563 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1H MET 1 -35.377 51.303 -13.133 2 2H MET 1 2H MET 1 -35.905 50.934 -11.570 3 3H MET 1 3H MET 1 -36.173 52.477 -12.210 4 HA MET 1 HA MET 1 -38.225 51.338 -12.322 5 1HB MET 1 1HB MET 1 -37.369 52.681 -14.310 6 2HB MET 1 2HB MET 1 -36.981 51.143 -15.068 7 1HG MET 1 1HG MET 1 -39.736 51.528 -14.041 8 2HG MET 1 2HG MET 1 -39.265 52.392 -15.503 9 1HE MET 1 1HE MET 1 -40.863 51.375 -17.097 10 2HE MET 1 2HE MET 1 -41.684 50.432 -15.853 11 3HE MET 1 3HE MET 1 -41.151 49.652 -17.342 12 H SER 2 H SER 2 -39.459 49.547 -13.379 13 HA SER 2 HA SER 2 -38.808 47.071 -12.479 14 1HB SER 2 1HB SER 2 -40.659 46.360 -13.589 15 2HB SER 2 2HB SER 2 -40.877 48.077 -13.932 16 HG SER 2 HG SER 2 -40.080 47.789 -15.939 17 H LEU 3 H LEU 3 -37.800 48.565 -15.497 18 HA LEU 3 HA LEU 3 -36.602 46.313 -16.675 19 1HB LEU 3 1HB LEU 3 -35.159 48.102 -17.831 20 2HB LEU 3 2HB LEU 3 -36.887 48.113 -18.126 21 HG LEU 3 HG LEU 3 -36.727 49.818 -16.018 22 1HD1 LEU 3 1HD1 LEU 3 -34.081 49.493 -16.714 23 2HD1 LEU 3 2HD1 LEU 3 -34.762 50.842 -15.804 24 3HD1 LEU 3 3HD1 LEU 3 -34.547 50.975 -17.550 25 1HD2 LEU 3 1HD2 LEU 3 -37.554 49.912 -18.589 26 2HD2 LEU 3 2HD2 LEU 3 -36.225 51.070 -18.629 27 3HD2 LEU 3 3HD2 LEU 3 -37.557 51.296 -17.496 28 H GLU 4 H GLU 4 -35.236 48.958 -14.731 29 HA GLU 4 HA GLU 4 -32.636 48.009 -14.548 30 1HB GLU 4 1HB GLU 4 -32.969 50.173 -13.705 31 2HB GLU 4 2HB GLU 4 -34.339 49.679 -12.721 32 1HG GLU 4 1HG GLU 4 -32.246 50.233 -11.466 33 2HG GLU 4 2HG GLU 4 -32.943 48.651 -11.119 34 H LYS 5 H LYS 5 -35.492 47.307 -12.620 35 HA LYS 5 HA LYS 5 -34.350 45.636 -10.714 36 1HB LYS 5 1HB LYS 5 -37.039 45.090 -11.942 37 2HB LYS 5 2HB LYS 5 -36.524 44.847 -10.278 38 1HG LYS 5 1HG LYS 5 -36.661 47.583 -11.479 39 2HG LYS 5 2HG LYS 5 -38.085 46.803 -10.787 40 1HD LYS 5 1HD LYS 5 -37.310 47.919 -8.948 41 2HD LYS 5 2HD LYS 5 -36.447 46.391 -8.762 42 1HE LYS 5 1HE LYS 5 -35.148 48.622 -8.526 43 2HE LYS 5 2HE LYS 5 -34.431 47.297 -9.443 44 1HZ LYS 5 1HZ LYS 5 -36.080 49.200 -10.914 45 2HZ LYS 5 2HZ LYS 5 -34.676 48.389 -11.391 46 3HZ LYS 5 3HZ LYS 5 -34.567 49.742 -10.384 47 H ALA 6 H ALA 6 -35.563 44.990 -13.959 48 HA ALA 6 HA ALA 6 -35.275 42.236 -14.035 49 1HB ALA 6 1HB ALA 6 -35.896 42.538 -16.156 50 2HB ALA 6 2HB ALA 6 -34.397 43.395 -16.518 51 3HB ALA 6 3HB ALA 6 -35.790 44.278 -15.891 52 H HIS 7 H HIS 7 -32.948 44.783 -14.825 53 HA HIS 7 HA HIS 7 -30.811 42.790 -14.625 54 1HB HIS 7 1HB HIS 7 -29.373 44.491 -15.722 55 2HB HIS 7 2HB HIS 7 -30.745 44.012 -16.713 56 HD1 HIS 7 HD1 HIS 7 -29.299 46.916 -14.887 57 HD2 HIS 7 HD2 HIS 7 -32.645 46.013 -17.171 58 HE1 HIS 7 HE1 HIS 7 -30.334 49.132 -15.465 59 HE2 HIS 7 HE2 HIS 7 -32.318 48.562 -16.910 60 H THR 8 H THR 8 -31.989 43.463 -12.282 61 HA THR 8 HA THR 8 -30.971 45.659 -10.899 62 HB THR 8 HB THR 8 -32.741 44.089 -10.042 63 HG1 THR 8 HG1 THR 8 -30.530 44.580 -8.309 64 1HG2 THR 8 1HG2 THR 8 -32.240 42.015 -9.139 65 2HG2 THR 8 2HG2 THR 8 -30.525 42.390 -8.966 66 3HG2 THR 8 3HG2 THR 8 -31.198 42.057 -10.561 67 H SER 9 H SER 9 -29.597 42.716 -11.928 68 HA SER 9 HA SER 9 -27.211 42.867 -10.307 69 1HB SER 9 1HB SER 9 -26.484 41.022 -11.932 70 2HB SER 9 2HB SER 9 -27.888 40.663 -10.923 71 HG SER 9 HG SER 9 -28.503 40.116 -12.944 72 H VAL 10 H VAL 10 -28.099 45.068 -12.023 73 HA VAL 10 HA VAL 10 -26.944 45.496 -14.395 74 HB VAL 10 HB VAL 10 -28.170 47.280 -13.572 75 1HG1 VAL 10 1HG1 VAL 10 -26.709 48.227 -11.302 76 2HG1 VAL 10 2HG1 VAL 10 -27.117 46.525 -11.079 77 3HG1 VAL 10 3HG1 VAL 10 -28.390 47.700 -11.409 78 1HG2 VAL 10 1HG2 VAL 10 -26.860 48.867 -14.396 79 2HG2 VAL 10 2HG2 VAL 10 -25.494 47.756 -14.277 80 3HG2 VAL 10 3HG2 VAL 10 -25.860 48.853 -12.943 81 H LYS 11 H LYS 11 -25.230 46.697 -11.522 82 HA LYS 11 HA LYS 11 -22.763 47.041 -12.637 83 1HB LYS 11 1HB LYS 11 -22.219 45.967 -10.096 84 2HB LYS 11 2HB LYS 11 -22.373 47.664 -10.523 85 1HG LYS 11 1HG LYS 11 -23.836 47.406 -8.744 86 2HG LYS 11 2HG LYS 11 -24.890 47.324 -10.156 87 1HD LYS 11 1HD LYS 11 -24.483 44.766 -9.983 88 2HD LYS 11 2HD LYS 11 -24.000 45.134 -8.326 89 1HE LYS 11 1HE LYS 11 -26.155 46.179 -7.911 90 2HE LYS 11 2HE LYS 11 -26.637 45.883 -9.582 91 1HZ LYS 11 1HZ LYS 11 -26.005 43.783 -7.581 92 2HZ LYS 11 2HZ LYS 11 -26.501 43.514 -9.175 93 3HZ LYS 11 3HZ LYS 11 -27.560 44.235 -8.071 94 H LYS 12 H LYS 12 -24.178 44.163 -11.301 95 HA LYS 12 HA LYS 12 -23.588 42.153 -12.808 96 1HB LYS 12 1HB LYS 12 -21.409 41.334 -12.687 97 2HB LYS 12 2HB LYS 12 -21.142 43.062 -12.823 98 1HG LYS 12 1HG LYS 12 -21.071 41.460 -10.274 99 2HG LYS 12 2HG LYS 12 -19.672 42.047 -11.171 100 1HD LYS 12 1HD LYS 12 -21.661 44.089 -10.431 101 2HD LYS 12 2HD LYS 12 -20.791 43.345 -9.088 102 1HE LYS 12 1HE LYS 12 -18.815 44.260 -9.682 103 2HE LYS 12 2HE LYS 12 -19.163 44.161 -11.408 104 1HZ LYS 12 1HZ LYS 12 -20.139 46.182 -11.419 105 2HZ LYS 12 2HZ LYS 12 -19.126 46.439 -10.089 106 3HZ LYS 12 3HZ LYS 12 -20.749 46.038 -9.848 107 H MET 13 H MET 13 -24.396 43.427 -10.062 108 HA MET 13 HA MET 13 -25.111 42.749 -8.027 109 1HB MET 13 1HB MET 13 -26.427 40.862 -7.994 110 2HB MET 13 2HB MET 13 -26.303 41.127 -9.723 111 1HG MET 13 1HG MET 13 -24.172 39.439 -8.720 112 2HG MET 13 2HG MET 13 -25.774 38.787 -8.372 113 1HE MET 13 1HE MET 13 -26.445 36.810 -11.126 114 2HE MET 13 2HE MET 13 -25.990 36.979 -9.430 115 3HE MET 13 3HE MET 13 -24.769 36.568 -10.634 116 H THR 14 H THR 14 -22.242 42.376 -8.979 117 HA THR 14 HA THR 14 -20.263 41.519 -8.261 118 HB THR 14 HB THR 14 -20.368 41.307 -5.571 119 HG1 THR 14 HG1 THR 14 -22.237 43.362 -6.072 120 1HG2 THR 14 1HG2 THR 14 -20.367 44.101 -6.300 121 2HG2 THR 14 2HG2 THR 14 -19.459 43.141 -7.467 122 3HG2 THR 14 3HG2 THR 14 -19.033 43.084 -5.757 123 H PHE 15 H PHE 15 -22.396 39.663 -8.920 124 HA PHE 15 HA PHE 15 -22.941 37.461 -7.552 125 1HB PHE 15 1HB PHE 15 -22.614 36.158 -9.612 126 2HB PHE 15 2HB PHE 15 -23.309 37.732 -9.991 127 HD1 PHE 15 HD1 PHE 15 -20.693 35.449 -10.709 128 HD2 PHE 15 HD2 PHE 15 -21.650 39.588 -10.681 129 HE1 PHE 15 HE1 PHE 15 -18.820 35.894 -12.238 130 HE2 PHE 15 HE2 PHE 15 -19.791 40.040 -12.215 131 HZ PHE 15 HZ PHE 15 -18.368 38.191 -12.993 132 H GLY 16 H GLY 16 -19.846 38.257 -8.885 133 1HA GLY 16 1HA GLY 16 -18.214 37.221 -6.931 134 2HA GLY 16 2HA GLY 16 -18.445 35.934 -8.119 135 H GLU 17 H GLU 17 -18.680 39.242 -9.026 136 HA GLU 17 HA GLU 17 -16.870 39.063 -11.123 137 1HB GLU 17 1HB GLU 17 -18.664 40.912 -10.410 138 2HB GLU 17 2HB GLU 17 -17.217 41.701 -9.792 139 1HG GLU 17 1HG GLU 17 -18.063 41.192 -12.570 140 2HG GLU 17 2HG GLU 17 -17.188 42.559 -11.875 141 H ASN 18 H ASN 18 -16.477 40.454 -7.901 142 HA ASN 18 HA ASN 18 -13.711 41.018 -8.200 143 1HB ASN 18 1HB ASN 18 -13.743 41.558 -5.902 144 2HB ASN 18 2HB ASN 18 -15.372 41.952 -6.455 145 1HD2 ASN 18 1HD2 ASN 18 -16.714 39.723 -6.504 146 2HD2 ASN 18 2HD2 ASN 18 -16.746 38.939 -4.965 147 H ARG 19 H ARG 19 -15.569 38.229 -7.719 148 HA ARG 19 HA ARG 19 -13.413 36.691 -6.524 149 1HB ARG 19 1HB ARG 19 -16.103 35.684 -7.440 150 2HB ARG 19 2HB ARG 19 -14.983 34.892 -6.340 151 1HG ARG 19 1HG ARG 19 -16.193 37.548 -5.687 152 2HG ARG 19 2HG ARG 19 -17.038 36.037 -5.353 153 1HD ARG 19 1HD ARG 19 -15.889 36.625 -3.369 154 2HD ARG 19 2HD ARG 19 -14.987 35.298 -4.100 155 HE ARG 19 HE ARG 19 -14.159 38.100 -3.956 156 1HH1 ARG 19 1HH1 ARG 19 -13.484 34.824 -4.923 157 2HH1 ARG 19 2HH1 ARG 19 -11.783 35.092 -5.101 158 1HH2 ARG 19 1HH2 ARG 19 -11.932 38.467 -4.207 159 2HH2 ARG 19 2HH2 ARG 19 -10.901 37.164 -4.692 160 H ASP 20 H ASP 20 -14.447 37.605 -9.558 161 HA ASP 20 HA ASP 20 -14.100 35.339 -11.112 162 1HB ASP 20 1HB ASP 20 -14.871 37.065 -12.401 163 2HB ASP 20 2HB ASP 20 -13.849 38.259 -11.603 164 H LEU 21 H LEU 21 -11.753 37.474 -9.633 165 HA LEU 21 HA LEU 21 -9.431 36.923 -10.966 166 1HB LEU 21 1HB LEU 21 -8.440 36.844 -8.508 167 2HB LEU 21 2HB LEU 21 -9.025 38.335 -9.220 168 HG LEU 21 HG LEU 21 -11.211 37.952 -8.064 169 1HD1 LEU 21 1HD1 LEU 21 -10.646 36.355 -5.959 170 2HD1 LEU 21 2HD1 LEU 21 -9.800 35.509 -7.254 171 3HD1 LEU 21 3HD1 LEU 21 -11.528 35.835 -7.394 172 1HD2 LEU 21 1HD2 LEU 21 -9.565 38.022 -5.742 173 2HD2 LEU 21 2HD2 LEU 21 -10.389 39.350 -6.560 174 3HD2 LEU 21 3HD2 LEU 21 -8.757 38.892 -7.044 175 H GLU 22 H GLU 22 -11.383 34.887 -9.060 176 HA GLU 22 HA GLU 22 -11.351 32.711 -8.522 177 1HB GLU 22 1HB GLU 22 -10.043 32.865 -11.183 178 2HB GLU 22 2HB GLU 22 -9.967 31.331 -10.323 179 1HG GLU 22 1HG GLU 22 -12.329 32.785 -11.401 180 2HG GLU 22 2HG GLU 22 -11.881 31.086 -11.565 181 H ARG 23 H ARG 23 -10.058 33.368 -6.653 182 HA ARG 23 HA ARG 23 -7.261 33.005 -6.587 183 1HB ARG 23 1HB ARG 23 -8.436 32.234 -4.082 184 2HB ARG 23 2HB ARG 23 -7.500 33.672 -4.463 185 1HG ARG 23 1HG ARG 23 -9.436 34.629 -3.754 186 2HG ARG 23 2HG ARG 23 -9.783 34.483 -5.478 187 1HD ARG 23 1HD ARG 23 -10.508 32.262 -3.621 188 2HD ARG 23 2HD ARG 23 -11.535 33.692 -3.721 189 HE ARG 23 HE ARG 23 -11.835 33.194 -6.082 190 1HH1 ARG 23 1HH1 ARG 23 -10.528 30.675 -4.065 191 2HH1 ARG 23 2HH1 ARG 23 -10.988 29.398 -5.142 192 1HH2 ARG 23 1HH2 ARG 23 -12.440 31.530 -7.504 193 2HH2 ARG 23 2HH2 ARG 23 -12.085 29.885 -7.096 194 H VAL 24 H VAL 24 -9.747 30.934 -7.211 195 HA VAL 24 HA VAL 24 -9.108 28.543 -5.952 196 HB VAL 24 HB VAL 24 -10.970 29.313 -7.819 197 1HG1 VAL 24 1HG1 VAL 24 -9.404 27.147 -9.183 198 2HG1 VAL 24 2HG1 VAL 24 -9.169 28.851 -9.569 199 3HG1 VAL 24 3HG1 VAL 24 -10.748 28.101 -9.811 200 1HG2 VAL 24 1HG2 VAL 24 -10.714 26.419 -7.591 201 2HG2 VAL 24 2HG2 VAL 24 -12.011 27.494 -7.063 202 3HG2 VAL 24 3HG2 VAL 24 -10.584 27.267 -6.049 203 H VAL 25 H VAL 25 -7.413 30.400 -8.182 204 HA VAL 25 HA VAL 25 -5.971 28.683 -9.761 205 HB VAL 25 HB VAL 25 -4.025 30.309 -9.356 206 1HG1 VAL 25 1HG1 VAL 25 -6.581 30.689 -10.654 207 2HG1 VAL 25 2HG1 VAL 25 -4.959 31.082 -11.222 208 3HG1 VAL 25 3HG1 VAL 25 -5.840 32.226 -10.209 209 1HG2 VAL 25 1HG2 VAL 25 -5.872 32.246 -8.165 210 2HG2 VAL 25 2HG2 VAL 25 -4.171 31.941 -7.818 211 3HG2 VAL 25 3HG2 VAL 25 -5.415 30.927 -7.088 212 H THR 26 H THR 26 -6.020 29.123 -6.384 213 HA THR 26 HA THR 26 -3.571 27.950 -5.641 214 HB THR 26 HB THR 26 -6.186 27.869 -4.117 215 HG1 THR 26 HG1 THR 26 -4.979 29.794 -3.096 216 1HG2 THR 26 1HG2 THR 26 -4.115 26.465 -3.429 217 2HG2 THR 26 2HG2 THR 26 -4.946 27.423 -2.204 218 3HG2 THR 26 3HG2 THR 26 -3.445 28.014 -2.917 219 H ALA 27 H ALA 27 -3.526 26.215 -7.235 220 HA ALA 27 HA ALA 27 -5.336 24.189 -7.547 221 1HB ALA 27 1HB ALA 27 -3.481 22.765 -8.213 222 2HB ALA 27 2HB ALA 27 -2.335 23.854 -7.432 223 3HB ALA 27 3HB ALA 27 -3.243 24.395 -8.843 224 HA PRO 28 HA PRO 28 -5.930 21.900 -3.849 225 1HB PRO 28 1HB PRO 28 -4.621 19.491 -4.723 226 2HB PRO 28 2HB PRO 28 -6.350 19.797 -4.558 227 1HG PRO 28 1HG PRO 28 -4.653 19.879 -6.960 228 2HG PRO 28 2HG PRO 28 -6.410 19.686 -6.828 229 1HD PRO 28 1HD PRO 28 -5.263 21.950 -7.760 230 2HD PRO 28 2HD PRO 28 -6.783 21.967 -6.837 231 H VAL 29 H VAL 29 -2.815 21.894 -5.432 232 HA VAL 29 HA VAL 29 -0.700 22.182 -4.640 233 HB VAL 29 HB VAL 29 -2.010 22.375 -1.919 234 1HG1 VAL 29 1HG1 VAL 29 0.409 23.575 -1.669 235 2HG1 VAL 29 2HG1 VAL 29 0.799 22.248 -2.760 236 3HG1 VAL 29 3HG1 VAL 29 0.066 21.913 -1.192 237 1HG2 VAL 29 1HG2 VAL 29 -1.084 24.814 -2.314 238 2HG2 VAL 29 2HG2 VAL 29 -2.659 24.319 -2.935 239 3HG2 VAL 29 3HG2 VAL 29 -1.259 24.357 -4.008 240 H SER 30 H SER 30 -2.618 20.211 -2.404 241 HA SER 30 HA SER 30 -0.620 18.274 -1.927 242 1HB SER 30 1HB SER 30 -2.531 16.899 -1.098 243 2HB SER 30 2HB SER 30 -2.532 18.526 -0.416 244 HG SER 30 HG SER 30 -4.001 18.997 -2.286 245 H SER 31 H SER 31 -2.293 19.166 -4.586 246 HA SER 31 HA SER 31 -3.179 16.978 -5.937 247 1HB SER 31 1HB SER 31 -2.087 18.337 -7.965 248 2HB SER 31 2HB SER 31 -3.527 18.908 -7.122 249 HG SER 31 HG SER 31 -2.414 20.584 -6.546 250 H GLY 32 H GLY 32 -2.312 15.201 -6.744 251 1HA GLY 32 1HA GLY 32 -0.777 13.607 -7.316 252 2HA GLY 32 2HA GLY 32 0.113 14.935 -8.038 253 H LYS 33 H LYS 33 -0.202 15.518 -4.750 254 HA LYS 33 HA LYS 33 2.550 15.206 -4.267 255 1HB LYS 33 1HB LYS 33 0.194 15.576 -2.430 256 2HB LYS 33 2HB LYS 33 1.836 15.419 -1.816 257 1HG LYS 33 1HG LYS 33 0.997 17.493 -3.824 258 2HG LYS 33 2HG LYS 33 1.026 17.763 -2.081 259 1HD LYS 33 1HD LYS 33 3.432 17.191 -2.070 260 2HD LYS 33 2HD LYS 33 3.373 17.037 -3.828 261 1HE LYS 33 1HE LYS 33 2.698 19.531 -2.277 262 2HE LYS 33 2HE LYS 33 4.233 19.227 -3.089 263 1HZ LYS 33 1HZ LYS 33 3.369 19.800 -5.038 264 2HZ LYS 33 2HZ LYS 33 2.041 20.414 -4.190 265 3HZ LYS 33 3HZ LYS 33 1.989 18.845 -4.818 266 H ILE 34 H ILE 34 0.113 12.934 -4.472 267 HA ILE 34 HA ILE 34 1.760 10.943 -3.065 268 HB ILE 34 HB ILE 34 -1.253 11.131 -3.153 269 1HG1 ILE 34 1HG1 ILE 34 -0.295 10.701 -0.549 270 2HG1 ILE 34 2HG1 ILE 34 0.784 11.901 -1.254 271 1HG2 ILE 34 1HG2 ILE 34 -1.402 8.935 -2.891 272 2HG2 ILE 34 2HG2 ILE 34 -0.341 9.013 -1.485 273 3HG2 ILE 34 3HG2 ILE 34 0.345 8.800 -3.096 274 1HD1 ILE 34 1HD1 ILE 34 -0.786 13.298 -0.442 275 2HD1 ILE 34 2HD1 ILE 34 -2.073 12.097 -0.547 276 3HD1 ILE 34 3HD1 ILE 34 -1.545 12.954 -1.996 277 H LYS 35 H LYS 35 2.665 9.694 -4.559 278 HA LYS 35 HA LYS 35 1.074 8.948 -6.924 279 1HB LYS 35 1HB LYS 35 4.005 8.668 -7.087 280 2HB LYS 35 2HB LYS 35 2.863 9.264 -8.282 281 1HG LYS 35 1HG LYS 35 2.791 11.267 -6.459 282 2HG LYS 35 2HG LYS 35 4.463 10.722 -6.305 283 1HD LYS 35 1HD LYS 35 4.592 12.328 -7.979 284 2HD LYS 35 2HD LYS 35 4.485 10.819 -8.889 285 1HE LYS 35 1HE LYS 35 2.110 11.167 -9.235 286 2HE LYS 35 2HE LYS 35 2.156 12.626 -8.247 287 1HZ LYS 35 1HZ LYS 35 3.209 13.807 -9.875 288 2HZ LYS 35 2HZ LYS 35 2.284 12.765 -10.832 289 3HZ LYS 35 3HZ LYS 35 3.925 12.446 -10.580 290 H ARG 36 H ARG 36 0.787 6.841 -7.364 291 HA ARG 36 HA ARG 36 1.732 4.890 -5.446 292 1HB ARG 36 1HB ARG 36 -0.037 4.653 -7.886 293 2HB ARG 36 2HB ARG 36 0.379 3.296 -6.848 294 1HG ARG 36 1HG ARG 36 -1.579 3.844 -5.877 295 2HG ARG 36 2HG ARG 36 -0.550 4.973 -4.991 296 1HD ARG 36 1HD ARG 36 -2.590 6.042 -5.859 297 2HD ARG 36 2HD ARG 36 -1.120 6.750 -6.527 298 HE ARG 36 HE ARG 36 -2.027 4.735 -8.255 299 1HH1 ARG 36 1HH1 ARG 36 -2.921 7.909 -7.139 300 2HH1 ARG 36 2HH1 ARG 36 -3.758 8.327 -8.596 301 1HH2 ARG 36 1HH2 ARG 36 -3.125 5.274 -10.177 302 2HH2 ARG 36 2HH2 ARG 36 -3.872 6.829 -10.325 303 H VAL 37 H VAL 37 2.581 2.722 -6.409 304 HA VAL 37 HA VAL 37 4.196 3.158 -8.788 305 HB VAL 37 HB VAL 37 5.440 3.845 -6.596 306 1HG1 VAL 37 1HG1 VAL 37 6.814 1.912 -5.749 307 2HG1 VAL 37 2HG1 VAL 37 5.655 0.846 -6.540 308 3HG1 VAL 37 3HG1 VAL 37 5.122 1.925 -5.252 309 1HG2 VAL 37 1HG2 VAL 37 6.290 3.540 -9.000 310 2HG2 VAL 37 2HG2 VAL 37 6.937 2.004 -8.425 311 3HG2 VAL 37 3HG2 VAL 37 7.469 3.515 -7.688 312 H ASN 38 H ASN 38 3.126 0.883 -6.286 313 HA ASN 38 HA ASN 38 2.757 -1.370 -6.338 314 1HB ASN 38 1HB ASN 38 1.213 -0.807 -8.141 315 2HB ASN 38 2HB ASN 38 2.529 -0.845 -9.310 316 1HD2 ASN 38 1HD2 ASN 38 0.352 -2.708 -7.385 317 2HD2 ASN 38 2HD2 ASN 38 0.715 -4.245 -8.085 318 H VAL 39 H VAL 39 4.560 -2.412 -5.678 319 HA VAL 39 HA VAL 39 6.654 -2.916 -7.690 320 HB VAL 39 HB VAL 39 7.270 -3.306 -4.816 321 1HG1 VAL 39 1HG1 VAL 39 9.413 -2.235 -5.614 322 2HG1 VAL 39 2HG1 VAL 39 8.731 -2.286 -7.239 323 3HG1 VAL 39 3HG1 VAL 39 9.004 -3.784 -6.349 324 1HG2 VAL 39 1HG2 VAL 39 7.565 -1.030 -4.305 325 2HG2 VAL 39 2HG2 VAL 39 5.960 -1.133 -5.029 326 3HG2 VAL 39 3HG2 VAL 39 7.319 -0.536 -5.981 327 H ASN 40 H ASN 40 7.987 -4.903 -7.156 328 HA ASN 40 HA ASN 40 6.191 -7.147 -6.506 329 1HB ASN 40 1HB ASN 40 7.806 -6.639 -8.810 330 2HB ASN 40 2HB ASN 40 8.466 -8.040 -7.972 331 1HD2 ASN 40 1HD2 ASN 40 6.679 -7.377 -10.455 332 2HD2 ASN 40 2HD2 ASN 40 5.485 -8.624 -10.387 333 H PHE 41 H PHE 41 6.711 -8.234 -4.708 334 HA PHE 41 HA PHE 41 9.489 -8.065 -3.745 335 1HB PHE 41 1HB PHE 41 6.928 -8.373 -2.168 336 2HB PHE 41 2HB PHE 41 8.542 -8.457 -1.471 337 HD1 PHE 41 HD1 PHE 41 9.798 -6.231 -3.099 338 HD2 PHE 41 HD2 PHE 41 6.089 -6.506 -1.032 339 HE1 PHE 41 HE1 PHE 41 9.789 -3.791 -2.799 340 HE2 PHE 41 HE2 PHE 41 6.074 -4.065 -0.730 341 HZ PHE 41 HZ PHE 41 7.924 -2.703 -1.615 342 H ASP 42 H ASP 42 10.601 -9.875 -3.378 343 HA ASP 42 HA ASP 42 9.720 -12.347 -4.387 344 1HB ASP 42 1HB ASP 42 12.071 -11.864 -4.333 345 2HB ASP 42 2HB ASP 42 12.037 -11.613 -2.591 346 H GLU 43 H GLU 43 9.410 -14.360 -3.210 347 HA GLU 43 HA GLU 43 7.478 -14.238 -1.228 348 1HB GLU 43 1HB GLU 43 8.880 -16.274 -2.631 349 2HB GLU 43 2HB GLU 43 8.950 -16.673 -0.921 350 1HG GLU 43 1HG GLU 43 6.387 -15.977 -2.316 351 2HG GLU 43 2HG GLU 43 7.013 -17.622 -2.229 352 H GLU 44 H GLU 44 10.971 -14.592 -0.944 353 HA GLU 44 HA GLU 44 11.034 -14.987 1.861 354 1HB GLU 44 1HB GLU 44 12.903 -15.642 0.460 355 2HB GLU 44 2HB GLU 44 13.139 -13.980 -0.059 356 1HG GLU 44 1HG GLU 44 14.682 -13.894 1.539 357 2HG GLU 44 2HG GLU 44 13.322 -13.755 2.653 358 H LYS 45 H LYS 45 11.159 -12.136 -0.198 359 HA LYS 45 HA LYS 45 11.814 -10.308 1.885 360 1HB LYS 45 1HB LYS 45 10.660 -9.921 -0.876 361 2HB LYS 45 2HB LYS 45 11.040 -8.583 0.200 362 1HG LYS 45 1HG LYS 45 13.235 -10.482 -0.158 363 2HG LYS 45 2HG LYS 45 12.737 -9.656 -1.637 364 1HD LYS 45 1HD LYS 45 12.785 -7.662 0.303 365 2HD LYS 45 2HD LYS 45 14.211 -8.644 0.639 366 1HE LYS 45 1HE LYS 45 13.487 -7.410 -2.017 367 2HE LYS 45 2HE LYS 45 14.729 -6.830 -0.910 368 1HZ LYS 45 1HZ LYS 45 15.823 -8.088 -2.553 369 2HZ LYS 45 2HZ LYS 45 14.712 -9.359 -2.453 370 3HZ LYS 45 3HZ LYS 45 15.789 -9.076 -1.180 371 H HIS 46 H HIS 46 8.834 -11.636 0.654 372 HA HIS 46 HA HIS 46 7.172 -9.674 1.958 373 1HB HIS 46 1HB HIS 46 6.695 -11.152 -0.184 374 2HB HIS 46 2HB HIS 46 6.075 -12.284 1.014 375 HD1 HIS 46 HD1 HIS 46 3.690 -11.973 1.587 376 HD2 HIS 46 HD2 HIS 46 5.404 -8.473 0.149 377 HE1 HIS 46 HE1 HIS 46 1.818 -10.297 1.495 378 HE2 HIS 46 HE2 HIS 46 2.901 -8.159 0.719 379 H THR 47 H THR 47 8.179 -13.007 2.566 380 HA THR 47 HA THR 47 6.489 -13.514 4.752 381 HB THR 47 HB THR 47 9.275 -14.635 4.419 382 HG1 THR 47 HG1 THR 47 7.267 -16.205 3.480 383 1HG2 THR 47 1HG2 THR 47 8.743 -15.833 6.219 384 2HG2 THR 47 2HG2 THR 47 7.401 -16.542 5.323 385 3HG2 THR 47 3HG2 THR 47 7.148 -15.084 6.282 386 H ARG 48 H ARG 48 9.740 -12.125 4.573 387 HA ARG 48 HA ARG 48 9.929 -11.787 7.424 388 1HB ARG 48 1HB ARG 48 11.807 -12.008 5.531 389 2HB ARG 48 2HB ARG 48 11.702 -10.253 5.595 390 1HG ARG 48 1HG ARG 48 11.952 -10.573 8.149 391 2HG ARG 48 2HG ARG 48 12.559 -12.173 7.717 392 1HD ARG 48 1HD ARG 48 13.660 -9.765 6.343 393 2HD ARG 48 2HD ARG 48 14.199 -10.149 7.978 394 HE ARG 48 HE ARG 48 14.847 -11.560 5.558 395 1HH1 ARG 48 1HH1 ARG 48 14.588 -11.778 9.027 396 2HH1 ARG 48 2HH1 ARG 48 15.718 -13.084 9.156 397 1HH2 ARG 48 1HH2 ARG 48 16.333 -13.280 5.722 398 2HH2 ARG 48 2HH2 ARG 48 16.708 -13.937 7.281 399 H PHE 49 H PHE 49 8.489 -10.099 4.866 400 HA PHE 49 HA PHE 49 8.735 -7.442 5.861 401 1HB PHE 49 1HB PHE 49 7.795 -8.596 3.529 402 2HB PHE 49 2HB PHE 49 6.330 -7.984 4.287 403 HD1 PHE 49 HD1 PHE 49 9.818 -6.660 4.092 404 HD2 PHE 49 HD2 PHE 49 5.692 -6.043 3.254 405 HE1 PHE 49 HE1 PHE 49 10.332 -4.409 3.243 406 HE2 PHE 49 HE2 PHE 49 6.198 -3.791 2.405 407 HZ PHE 49 HZ PHE 49 8.521 -2.970 2.398 408 H LYS 50 H LYS 50 6.182 -9.902 6.042 409 HA LYS 50 HA LYS 50 4.463 -8.306 7.671 410 1HB LYS 50 1HB LYS 50 4.445 -11.301 7.266 411 2HB LYS 50 2HB LYS 50 3.127 -10.330 7.908 412 1HG LYS 50 1HG LYS 50 3.598 -9.121 5.508 413 2HG LYS 50 2HG LYS 50 3.931 -10.816 5.144 414 1HD LYS 50 1HD LYS 50 1.468 -10.085 6.669 415 2HD LYS 50 2HD LYS 50 1.504 -9.879 4.917 416 1HE LYS 50 1HE LYS 50 0.925 -12.026 4.776 417 2HE LYS 50 2HE LYS 50 2.564 -12.401 5.305 418 1HZ LYS 50 1HZ LYS 50 0.384 -13.231 6.577 419 2HZ LYS 50 2HZ LYS 50 0.665 -11.789 7.414 420 3HZ LYS 50 3HZ LYS 50 1.867 -12.976 7.349 421 H ALA 51 H ALA 51 6.907 -10.755 8.282 422 HA ALA 51 HA ALA 51 6.333 -11.153 11.022 423 1HB ALA 51 1HB ALA 51 7.637 -12.845 10.232 424 2HB ALA 51 2HB ALA 51 8.889 -11.835 10.955 425 3HB ALA 51 3HB ALA 51 8.605 -11.776 9.216 426 H ALA 52 H ALA 52 8.811 -9.165 9.409 427 HA ALA 52 HA ALA 52 9.841 -8.020 11.767 428 1HB ALA 52 1HB ALA 52 11.212 -6.799 10.413 429 2HB ALA 52 2HB ALA 52 9.949 -6.493 9.220 430 3HB ALA 52 3HB ALA 52 10.737 -8.070 9.285 431 H CYS 53 H CYS 53 7.378 -6.881 9.476 432 HA CYS 53 HA CYS 53 6.967 -4.366 10.664 433 1HB CYS 53 1HB CYS 53 5.289 -4.086 9.139 434 2HB CYS 53 2HB CYS 53 6.108 -5.449 8.387 435 HG CYS 53 HG CYS 53 4.318 -7.360 9.301 436 H ALA 54 H ALA 54 5.588 -7.533 11.323 437 HA ALA 54 HA ALA 54 3.552 -6.645 13.087 438 1HB ALA 54 1HB ALA 54 4.632 -9.185 12.186 439 2HB ALA 54 2HB ALA 54 2.989 -8.761 12.664 440 3HB ALA 54 3HB ALA 54 4.174 -9.215 13.888 441 H ARG 55 H ARG 55 6.948 -7.151 13.429 442 HA ARG 55 HA ARG 55 6.925 -7.361 16.301 443 1HB ARG 55 1HB ARG 55 9.084 -7.100 14.228 444 2HB ARG 55 2HB ARG 55 9.452 -6.967 15.942 445 1HG ARG 55 1HG ARG 55 8.715 -9.192 16.351 446 2HG ARG 55 2HG ARG 55 8.060 -9.334 14.719 447 1HD ARG 55 1HD ARG 55 10.221 -10.489 14.974 448 2HD ARG 55 2HD ARG 55 10.279 -9.198 13.775 449 HE ARG 55 HE ARG 55 11.170 -7.912 15.914 450 1HH1 ARG 55 1HH1 ARG 55 11.967 -11.084 14.715 451 2HH1 ARG 55 2HH1 ARG 55 13.580 -11.058 15.348 452 1HH2 ARG 55 1HH2 ARG 55 13.290 -7.870 16.749 453 2HH2 ARG 55 2HH2 ARG 55 14.330 -9.233 16.504 454 H LYS 56 H LYS 56 7.680 -4.854 13.917 455 HA LYS 56 HA LYS 56 8.268 -2.914 15.988 456 1HB LYS 56 1HB LYS 56 8.038 -2.514 13.001 457 2HB LYS 56 2HB LYS 56 8.732 -1.385 14.156 458 1HG LYS 56 1HG LYS 56 10.643 -2.635 14.438 459 2HG LYS 56 2HG LYS 56 9.865 -4.134 13.926 460 1HD LYS 56 1HD LYS 56 10.839 -3.799 11.944 461 2HD LYS 56 2HD LYS 56 9.660 -2.508 11.704 462 1HE LYS 56 1HE LYS 56 12.028 -1.827 11.309 463 2HE LYS 56 2HE LYS 56 11.188 -0.866 12.525 464 1HZ LYS 56 1HZ LYS 56 12.826 -3.188 13.315 465 2HZ LYS 56 2HZ LYS 56 12.379 -1.841 14.235 466 3HZ LYS 56 3HZ LYS 56 13.549 -1.685 13.023 467 H GLY 57 H GLY 57 5.475 -4.149 14.772 468 1HA GLY 57 1HA GLY 57 3.284 -3.464 14.862 469 2HA GLY 57 2HA GLY 57 3.828 -2.194 15.948 470 H THR 58 H THR 58 4.540 -2.844 12.532 471 HA THR 58 HA THR 58 3.439 -0.190 11.877 472 HB THR 58 HB THR 58 5.775 -1.459 10.451 473 HG1 THR 58 HG1 THR 58 6.444 0.677 11.962 474 1HG2 THR 58 1HG2 THR 58 4.576 0.228 9.174 475 2HG2 THR 58 2HG2 THR 58 6.153 0.846 9.666 476 3HG2 THR 58 3HG2 THR 58 4.698 1.362 10.520 477 H SER 59 H SER 59 2.245 -0.005 10.020 478 HA SER 59 HA SER 59 0.982 -2.333 9.022 479 1HB SER 59 1HB SER 59 0.865 0.122 7.365 480 2HB SER 59 2HB SER 59 -0.444 -0.892 7.976 481 HG SER 59 HG SER 59 0.400 0.117 10.115 482 H ILE 60 H ILE 60 1.206 -3.409 7.073 483 HA ILE 60 HA ILE 60 3.737 -3.756 6.027 484 HB ILE 60 HB ILE 60 1.819 -5.320 5.732 485 1HG1 ILE 60 1HG1 ILE 60 2.724 -4.954 2.961 486 2HG1 ILE 60 2HG1 ILE 60 4.024 -4.939 4.147 487 1HG2 ILE 60 1HG2 ILE 60 0.171 -5.007 4.091 488 2HG2 ILE 60 2HG2 ILE 60 1.025 -3.641 3.374 489 3HG2 ILE 60 3HG2 ILE 60 0.259 -3.471 4.953 490 1HD1 ILE 60 1HD1 ILE 60 3.624 -7.168 3.234 491 2HD1 ILE 60 2HD1 ILE 60 1.971 -7.117 3.847 492 3HD1 ILE 60 3HD1 ILE 60 3.329 -7.106 4.973 493 H THR 61 H THR 61 1.268 -1.458 5.078 494 HA THR 61 HA THR 61 2.560 -0.663 2.647 495 HB THR 61 HB THR 61 0.693 1.192 4.040 496 HG1 THR 61 HG1 THR 61 -0.879 -0.449 2.798 497 1HG2 THR 61 1HG2 THR 61 1.724 1.413 1.675 498 2HG2 THR 61 2HG2 THR 61 0.005 1.742 1.885 499 3HG2 THR 61 3HG2 THR 61 0.533 0.197 1.217 500 H ASP 62 H ASP 62 2.447 0.555 5.961 501 HA ASP 62 HA ASP 62 3.919 2.926 5.462 502 1HB ASP 62 1HB ASP 62 2.448 2.409 7.486 503 2HB ASP 62 2HB ASP 62 3.806 1.471 8.103 504 H VAL 63 H VAL 63 4.807 -0.380 6.079 505 HA VAL 63 HA VAL 63 7.473 0.004 6.892 506 HB VAL 63 HB VAL 63 6.269 -2.314 5.369 507 1HG1 VAL 63 1HG1 VAL 63 8.963 -1.770 5.813 508 2HG1 VAL 63 2HG1 VAL 63 8.255 -3.317 5.348 509 3HG1 VAL 63 3HG1 VAL 63 8.528 -2.949 7.051 510 1HG2 VAL 63 1HG2 VAL 63 6.069 -1.445 8.112 511 2HG2 VAL 63 2HG2 VAL 63 6.799 -3.048 8.003 512 3HG2 VAL 63 3HG2 VAL 63 5.219 -2.748 7.279 513 H VAL 64 H VAL 64 6.038 -0.491 3.684 514 HA VAL 64 HA VAL 64 8.421 -0.476 2.208 515 HB VAL 64 HB VAL 64 5.892 0.696 1.097 516 1HG1 VAL 64 1HG1 VAL 64 6.981 0.465 -0.821 517 2HG1 VAL 64 2HG1 VAL 64 7.133 -1.270 -0.541 518 3HG1 VAL 64 3HG1 VAL 64 8.377 -0.169 0.050 519 1HG2 VAL 64 1HG2 VAL 64 4.691 -1.134 1.478 520 2HG2 VAL 64 2HG2 VAL 64 6.014 -1.785 2.444 521 3HG2 VAL 64 3HG2 VAL 64 5.930 -2.132 0.717 522 H ASN 65 H ASN 65 6.200 2.164 3.041 523 HA ASN 65 HA ASN 65 7.563 4.221 1.709 524 1HB ASN 65 1HB ASN 65 5.256 4.021 3.217 525 2HB ASN 65 2HB ASN 65 6.286 5.047 4.209 526 1HD2 ASN 65 1HD2 ASN 65 3.901 5.235 2.128 527 2HD2 ASN 65 2HD2 ASN 65 4.287 6.699 1.295 528 H GLN 66 H GLN 66 8.225 2.573 4.674 529 HA GLN 66 HA GLN 66 9.905 4.576 5.827 530 1HB GLN 66 1HB GLN 66 9.053 1.850 6.473 531 2HB GLN 66 2HB GLN 66 10.709 2.198 6.952 532 1HG GLN 66 1HG GLN 66 9.736 4.320 8.019 533 2HG GLN 66 2HG GLN 66 8.177 3.513 7.848 534 1HE2 GLN 66 1HE2 GLN 66 7.809 3.271 10.012 535 2HE2 GLN 66 2HE2 GLN 66 8.736 2.220 11.022 536 H LEU 67 H LEU 67 10.589 1.464 4.222 537 HA LEU 67 HA LEU 67 13.385 1.762 4.218 538 1HB LEU 67 1HB LEU 67 12.951 0.206 2.026 539 2HB LEU 67 2HB LEU 67 13.048 -0.382 3.674 540 HG LEU 67 HG LEU 67 10.366 0.400 3.259 541 1HD1 LEU 67 1HD1 LEU 67 11.645 -0.686 0.854 542 2HD1 LEU 67 2HD1 LEU 67 10.146 0.223 1.036 543 3HD1 LEU 67 3HD1 LEU 67 10.170 -1.511 1.353 544 1HD2 LEU 67 1HD2 LEU 67 10.224 -1.434 4.499 545 2HD2 LEU 67 2HD2 LEU 67 11.900 -1.846 4.135 546 3HD2 LEU 67 3HD2 LEU 67 10.604 -2.401 3.074 547 H VAL 68 H VAL 68 10.901 2.887 2.015 548 HA VAL 68 HA VAL 68 12.612 3.632 -0.117 549 HB VAL 68 HB VAL 68 9.906 4.718 0.690 550 1HG1 VAL 68 1HG1 VAL 68 10.569 6.452 -0.622 551 2HG1 VAL 68 2HG1 VAL 68 10.038 5.351 -1.893 552 3HG1 VAL 68 3HG1 VAL 68 11.752 5.481 -1.499 553 1HG2 VAL 68 1HG2 VAL 68 9.122 3.389 -1.249 554 2HG2 VAL 68 2HG2 VAL 68 9.807 2.402 0.043 555 3HG2 VAL 68 3HG2 VAL 68 10.749 2.729 -1.413 556 H ASP 69 H ASP 69 11.321 5.370 2.679 557 HA ASP 69 HA ASP 69 12.471 7.877 2.103 558 1HB ASP 69 1HB ASP 69 10.630 7.209 3.821 559 2HB ASP 69 2HB ASP 69 11.984 6.914 4.906 560 H ASN 70 H ASN 70 13.632 5.079 3.901 561 HA ASN 70 HA ASN 70 15.938 6.271 5.001 562 1HB ASN 70 1HB ASN 70 14.790 3.612 4.805 563 2HB ASN 70 2HB ASN 70 16.539 3.569 4.617 564 1HD2 ASN 70 1HD2 ASN 70 14.015 3.627 6.786 565 2HD2 ASN 70 2HD2 ASN 70 14.902 4.014 8.217 566 H TRP 71 H TRP 71 15.590 4.145 2.170 567 HA TRP 71 HA TRP 71 18.266 4.342 1.333 568 1HB TRP 71 1HB TRP 71 16.597 2.578 0.668 569 2HB TRP 71 2HB TRP 71 15.878 3.761 -0.419 570 HD1 TRP 71 HD1 TRP 71 19.140 1.769 0.068 571 HE1 TRP 71 HE1 TRP 71 20.331 1.610 -2.208 572 HE3 TRP 71 HE3 TRP 71 16.070 4.805 -2.666 573 HZ2 TRP 71 HZ2 TRP 71 20.010 2.639 -4.818 574 HZ3 TRP 71 HZ3 TRP 71 16.581 5.167 -5.045 575 HH2 TRP 71 HH2 TRP 71 18.511 4.105 -6.097 576 H LEU 72 H LEU 72 15.486 6.376 0.735 577 HA LEU 72 HA LEU 72 16.763 7.795 -1.433 578 1HB LEU 72 1HB LEU 72 14.120 7.535 -0.412 579 2HB LEU 72 2HB LEU 72 14.534 9.238 -0.427 580 HG LEU 72 HG LEU 72 15.207 8.938 -2.849 581 1HD1 LEU 72 1HD1 LEU 72 14.838 6.241 -2.231 582 2HD1 LEU 72 2HD1 LEU 72 15.147 6.944 -3.819 583 3HD1 LEU 72 3HD1 LEU 72 13.488 6.673 -3.282 584 1HD2 LEU 72 1HD2 LEU 72 13.245 10.035 -2.849 585 2HD2 LEU 72 2HD2 LEU 72 12.507 8.927 -1.692 586 3HD2 LEU 72 3HD2 LEU 72 12.593 8.492 -3.398 587 H LYS 73 H LYS 73 16.925 7.964 1.934 588 HA LYS 73 HA LYS 73 17.769 10.785 1.805 589 1HB LYS 73 1HB LYS 73 16.544 9.170 4.020 590 2HB LYS 73 2HB LYS 73 17.470 10.624 4.370 591 1HG LYS 73 1HG LYS 73 15.911 12.014 3.425 592 2HG LYS 73 2HG LYS 73 15.281 10.759 2.357 593 1HD LYS 73 1HD LYS 73 13.616 10.488 3.809 594 2HD LYS 73 2HD LYS 73 14.798 9.812 4.930 595 1HE LYS 73 1HE LYS 73 14.599 11.562 6.286 596 2HE LYS 73 2HE LYS 73 14.914 12.684 4.964 597 1HZ LYS 73 1HZ LYS 73 12.717 12.952 6.088 598 2HZ LYS 73 2HZ LYS 73 12.262 11.454 5.450 599 3HZ LYS 73 3HZ LYS 73 12.628 12.737 4.412 600 H GLU 74 H GLU 74 18.836 7.604 2.223 601 HA GLU 74 HA GLU 74 21.244 8.423 3.676 602 1HB GLU 74 1HB GLU 74 19.680 6.153 3.849 603 2HB GLU 74 2HB GLU 74 21.057 5.611 2.898 604 1HG GLU 74 1HG GLU 74 21.366 5.226 5.292 605 2HG GLU 74 2HG GLU 74 22.581 6.319 4.630 606 H ASN 75 H ASN 75 20.183 7.071 0.604 607 HA ASN 75 HA ASN 75 22.905 6.914 -0.391 608 1HB ASN 75 1HB ASN 75 22.010 5.288 -1.636 609 2HB ASN 75 2HB ASN 75 20.401 5.698 -1.055 610 1HD2 ASN 75 1HD2 ASN 75 19.014 6.737 -2.374 611 2HD2 ASN 75 2HD2 ASN 75 19.370 7.184 -4.004 612 H GLU 76 H GLU 76 20.171 9.046 -0.553 613 HA GLU 76 HA GLU 76 21.295 10.570 -2.761 614 1HB GLU 76 1HB GLU 76 18.700 10.372 -1.435 615 2HB GLU 76 2HB GLU 76 19.169 12.030 -1.782 616 1HG GLU 76 1HG GLU 76 19.320 9.909 -3.886 617 2HG GLU 76 2HG GLU 76 17.807 10.741 -3.529 618 1H MET 1 1H MET 1 -9.986 -59.734 -33.773 619 2H MET 1 2H MET 1 -9.217 -60.103 -35.233 620 3H MET 1 3H MET 1 -10.895 -60.260 -35.099 621 HA MET 1 HA MET 1 -9.740 -57.644 -34.545 622 1HB MET 1 1HB MET 1 -8.871 -58.917 -36.764 623 2HB MET 1 2HB MET 1 -10.357 -58.208 -37.382 624 1HG MET 1 1HG MET 1 -8.046 -56.753 -36.122 625 2HG MET 1 2HG MET 1 -8.513 -56.738 -37.821 626 1HE MET 1 1HE MET 1 -11.241 -54.681 -38.369 627 2HE MET 1 2HE MET 1 -12.134 -55.799 -37.336 628 3HE MET 1 3HE MET 1 -10.886 -56.407 -38.426 629 H SER 2 H SER 2 -12.230 -59.822 -35.559 630 HA SER 2 HA SER 2 -14.233 -58.163 -36.465 631 1HB SER 2 1HB SER 2 -15.708 -59.849 -34.996 632 2HB SER 2 2HB SER 2 -14.920 -60.356 -36.490 633 HG SER 2 HG SER 2 -14.515 -61.241 -33.994 634 H LEU 3 H LEU 3 -12.919 -58.561 -33.307 635 HA LEU 3 HA LEU 3 -14.942 -56.948 -31.995 636 1HB LEU 3 1HB LEU 3 -12.511 -57.362 -30.483 637 2HB LEU 3 2HB LEU 3 -14.147 -57.876 -30.116 638 HG LEU 3 HG LEU 3 -12.390 -59.388 -32.035 639 1HD1 LEU 3 1HD1 LEU 3 -11.867 -60.906 -30.195 640 2HD1 LEU 3 2HD1 LEU 3 -12.683 -59.821 -29.069 641 3HD1 LEU 3 3HD1 LEU 3 -11.226 -59.288 -29.908 642 1HD2 LEU 3 1HD2 LEU 3 -15.095 -59.634 -31.056 643 2HD2 LEU 3 2HD2 LEU 3 -14.146 -61.079 -30.701 644 3HD2 LEU 3 3HD2 LEU 3 -14.285 -60.501 -32.362 645 H GLU 4 H GLU 4 -13.604 -55.863 -34.192 646 HA GLU 4 HA GLU 4 -12.650 -54.005 -34.985 647 1HB GLU 4 1HB GLU 4 -12.286 -52.398 -32.645 648 2HB GLU 4 2HB GLU 4 -13.378 -52.159 -33.994 649 1HG GLU 4 1HG GLU 4 -15.033 -52.411 -32.557 650 2HG GLU 4 2HG GLU 4 -14.598 -54.118 -32.463 651 H LYS 5 H LYS 5 -11.163 -55.490 -32.232 652 HA LYS 5 HA LYS 5 -9.021 -55.773 -31.612 653 1HB LYS 5 1HB LYS 5 -8.818 -55.249 -34.470 654 2HB LYS 5 2HB LYS 5 -7.400 -54.699 -33.594 655 1HG LYS 5 1HG LYS 5 -8.323 -57.421 -34.182 656 2HG LYS 5 2HG LYS 5 -6.694 -56.801 -33.943 657 1HD LYS 5 1HD LYS 5 -6.747 -57.961 -32.027 658 2HD LYS 5 2HD LYS 5 -7.737 -56.635 -31.421 659 1HE LYS 5 1HE LYS 5 -8.856 -59.091 -32.765 660 2HE LYS 5 2HE LYS 5 -8.677 -58.925 -31.019 661 1HZ LYS 5 1HZ LYS 5 -10.909 -58.366 -31.699 662 2HZ LYS 5 2HZ LYS 5 -10.335 -57.199 -32.779 663 3HZ LYS 5 3HZ LYS 5 -10.135 -56.980 -31.114 664 H ALA 6 H ALA 6 -10.387 -52.869 -32.443 665 HA ALA 6 HA ALA 6 -8.313 -51.205 -31.294 666 1HB ALA 6 1HB ALA 6 -11.009 -50.202 -32.111 667 2HB ALA 6 2HB ALA 6 -9.848 -50.648 -33.361 668 3HB ALA 6 3HB ALA 6 -9.444 -49.394 -32.189 669 H HIS 7 H HIS 7 -10.523 -53.293 -30.302 670 HA HIS 7 HA HIS 7 -12.045 -51.961 -28.351 671 1HB HIS 7 1HB HIS 7 -12.230 -54.225 -27.302 672 2HB HIS 7 2HB HIS 7 -12.609 -54.229 -29.022 673 HD1 HIS 7 HD1 HIS 7 -9.258 -54.112 -29.447 674 HD2 HIS 7 HD2 HIS 7 -11.670 -57.023 -27.729 675 HE1 HIS 7 HE1 HIS 7 -7.928 -56.240 -29.560 676 HE2 HIS 7 HE2 HIS 7 -9.420 -57.996 -28.547 677 H THR 8 H THR 8 -8.817 -53.156 -28.544 678 HA THR 8 HA THR 8 -8.163 -52.924 -25.779 679 HB THR 8 HB THR 8 -5.766 -52.752 -26.843 680 HG1 THR 8 HG1 THR 8 -5.731 -52.872 -28.949 681 1HG2 THR 8 1HG2 THR 8 -7.578 -55.143 -26.842 682 2HG2 THR 8 2HG2 THR 8 -6.300 -54.720 -25.703 683 3HG2 THR 8 3HG2 THR 8 -5.887 -55.271 -27.327 684 H SER 9 H SER 9 -8.532 -50.812 -28.438 685 HA SER 9 HA SER 9 -8.061 -48.603 -28.795 686 1HB SER 9 1HB SER 9 -8.126 -47.578 -26.152 687 2HB SER 9 2HB SER 9 -9.435 -47.572 -27.334 688 HG SER 9 HG SER 9 -10.328 -49.257 -26.382 689 H VAL 10 H VAL 10 -5.882 -50.172 -28.693 690 HA VAL 10 HA VAL 10 -3.609 -49.970 -28.676 691 HB VAL 10 HB VAL 10 -3.911 -47.457 -27.022 692 1HG1 VAL 10 1HG1 VAL 10 -1.696 -48.056 -26.842 693 2HG1 VAL 10 2HG1 VAL 10 -1.660 -47.049 -28.289 694 3HG1 VAL 10 3HG1 VAL 10 -1.660 -48.806 -28.438 695 1HG2 VAL 10 1HG2 VAL 10 -4.595 -46.338 -28.815 696 2HG2 VAL 10 2HG2 VAL 10 -4.718 -47.862 -29.693 697 3HG2 VAL 10 3HG2 VAL 10 -3.220 -46.932 -29.746 698 H LYS 11 H LYS 11 -4.631 -51.755 -27.175 699 HA LYS 11 HA LYS 11 -4.493 -52.999 -25.272 700 1HB LYS 11 1HB LYS 11 -2.039 -52.641 -25.926 701 2HB LYS 11 2HB LYS 11 -1.999 -51.427 -24.652 702 1HG LYS 11 1HG LYS 11 -2.881 -54.247 -24.141 703 2HG LYS 11 2HG LYS 11 -1.187 -53.759 -24.067 704 1HD LYS 11 1HD LYS 11 -3.430 -52.571 -22.432 705 2HD LYS 11 2HD LYS 11 -2.247 -53.744 -21.851 706 1HE LYS 11 1HE LYS 11 -0.679 -52.179 -21.558 707 2HE LYS 11 2HE LYS 11 -1.028 -51.417 -23.110 708 1HZ LYS 11 1HZ LYS 11 -3.158 -50.904 -21.361 709 2HZ LYS 11 2HZ LYS 11 -2.075 -49.803 -22.048 710 3HZ LYS 11 3HZ LYS 11 -1.717 -50.521 -20.558 711 H LYS 12 H LYS 12 -6.317 -52.089 -24.273 712 HA LYS 12 HA LYS 12 -7.501 -50.712 -22.868 713 1HB LYS 12 1HB LYS 12 -5.893 -52.384 -21.462 714 2HB LYS 12 2HB LYS 12 -5.372 -50.827 -20.829 715 1HG LYS 12 1HG LYS 12 -8.225 -51.773 -20.912 716 2HG LYS 12 2HG LYS 12 -7.169 -51.863 -19.502 717 1HD LYS 12 1HD LYS 12 -8.140 -49.873 -19.016 718 2HD LYS 12 2HD LYS 12 -6.895 -49.259 -20.106 719 1HE LYS 12 1HE LYS 12 -9.158 -50.113 -21.635 720 2HE LYS 12 2HE LYS 12 -9.698 -49.033 -20.350 721 1HZ LYS 12 1HZ LYS 12 -8.161 -48.449 -22.715 722 2HZ LYS 12 2HZ LYS 12 -7.519 -47.763 -21.306 723 3HZ LYS 12 3HZ LYS 12 -9.111 -47.424 -21.761 724 H MET 13 H MET 13 -5.844 -49.333 -24.664 725 HA MET 13 HA MET 13 -4.859 -47.333 -25.054 726 1HB MET 13 1HB MET 13 -7.225 -46.969 -23.619 727 2HB MET 13 2HB MET 13 -6.061 -45.884 -22.871 728 1HG MET 13 1HG MET 13 -5.548 -45.312 -25.405 729 2HG MET 13 2HG MET 13 -7.216 -45.854 -25.591 730 1HE MET 13 1HE MET 13 -7.812 -44.390 -22.120 731 2HE MET 13 2HE MET 13 -8.673 -45.323 -23.346 732 3HE MET 13 3HE MET 13 -9.089 -43.631 -23.071 733 H THR 14 H THR 14 -2.749 -47.838 -24.504 734 HA THR 14 HA THR 14 -1.873 -47.448 -21.777 735 HB THR 14 HB THR 14 0.206 -47.601 -23.849 736 HG1 THR 14 HG1 THR 14 -0.371 -49.486 -24.700 737 1HG2 THR 14 1HG2 THR 14 -0.309 -48.485 -21.129 738 2HG2 THR 14 2HG2 THR 14 1.226 -48.196 -21.948 739 3HG2 THR 14 3HG2 THR 14 0.417 -49.753 -22.115 740 H PHE 15 H PHE 15 -3.007 -45.439 -23.815 741 HA PHE 15 HA PHE 15 -1.484 -43.457 -24.716 742 1HB PHE 15 1HB PHE 15 -3.244 -41.904 -24.185 743 2HB PHE 15 2HB PHE 15 -4.002 -43.463 -24.510 744 HD1 PHE 15 HD1 PHE 15 -3.502 -40.835 -22.091 745 HD2 PHE 15 HD2 PHE 15 -4.748 -44.870 -22.579 746 HE1 PHE 15 HE1 PHE 15 -4.581 -40.768 -19.880 747 HE2 PHE 15 HE2 PHE 15 -5.832 -44.808 -20.375 748 HZ PHE 15 HZ PHE 15 -5.748 -42.757 -19.019 749 H GLY 16 H GLY 16 -2.191 -44.062 -21.355 750 1HA GLY 16 1HA GLY 16 0.123 -43.323 -20.189 751 2HA GLY 16 2HA GLY 16 -0.715 -41.791 -20.420 752 H GLU 17 H GLU 17 -2.295 -44.859 -19.821 753 HA GLU 17 HA GLU 17 -3.915 -43.860 -17.773 754 1HB GLU 17 1HB GLU 17 -4.659 -46.069 -17.443 755 2HB GLU 17 2HB GLU 17 -4.199 -46.024 -19.138 756 1HG GLU 17 1HG GLU 17 -2.642 -47.209 -16.858 757 2HG GLU 17 2HG GLU 17 -3.425 -48.066 -18.185 758 H ASN 18 H ASN 18 -0.719 -45.061 -17.893 759 HA ASN 18 HA ASN 18 -0.384 -45.298 -15.023 760 1HB ASN 18 1HB ASN 18 2.108 -45.420 -15.823 761 2HB ASN 18 2HB ASN 18 1.038 -46.782 -16.151 762 1HD2 ASN 18 1HD2 ASN 18 2.340 -47.413 -17.879 763 2HD2 ASN 18 2HD2 ASN 18 2.313 -46.578 -19.391 764 H ARG 19 H ARG 19 0.174 -43.161 -17.683 765 HA ARG 19 HA ARG 19 1.688 -41.213 -16.261 766 1HB ARG 19 1HB ARG 19 0.654 -41.580 -18.957 767 2HB ARG 19 2HB ARG 19 0.475 -39.921 -18.404 768 1HG ARG 19 1HG ARG 19 2.548 -39.971 -19.466 769 2HG ARG 19 2HG ARG 19 2.932 -40.054 -17.745 770 1HD ARG 19 1HD ARG 19 2.814 -42.386 -19.657 771 2HD ARG 19 2HD ARG 19 4.279 -41.635 -19.027 772 HE ARG 19 HE ARG 19 2.754 -43.627 -17.759 773 1HH1 ARG 19 1HH1 ARG 19 4.439 -40.663 -17.039 774 2HH1 ARG 19 2HH1 ARG 19 4.745 -41.092 -15.390 775 1HH2 ARG 19 1HH2 ARG 19 3.147 -44.190 -15.591 776 2HH2 ARG 19 2HH2 ARG 19 4.015 -43.094 -14.569 777 H ASP 20 H ASP 20 -1.423 -42.253 -16.050 778 HA ASP 20 HA ASP 20 -3.034 -40.009 -15.855 779 1HB ASP 20 1HB ASP 20 -4.484 -41.308 -14.542 780 2HB ASP 20 2HB ASP 20 -3.592 -42.536 -15.439 781 H LEU 21 H LEU 21 -0.617 -41.372 -13.783 782 HA LEU 21 HA LEU 21 -0.960 -40.007 -11.442 783 1HB LEU 21 1HB LEU 21 1.153 -40.674 -10.911 784 2HB LEU 21 2HB LEU 21 0.901 -41.703 -12.305 785 HG LEU 21 HG LEU 21 2.213 -39.032 -12.646 786 1HD1 LEU 21 1HD1 LEU 21 4.075 -41.232 -12.379 787 2HD1 LEU 21 2HD1 LEU 21 3.201 -40.911 -10.881 788 3HD1 LEU 21 3HD1 LEU 21 4.115 -39.621 -11.662 789 1HD2 LEU 21 1HD2 LEU 21 1.474 -41.048 -14.374 790 2HD2 LEU 21 2HD2 LEU 21 3.200 -41.321 -14.128 791 3HD2 LEU 21 3HD2 LEU 21 2.628 -39.757 -14.708 792 H GLU 22 H GLU 22 0.772 -38.991 -14.363 793 HA GLU 22 HA GLU 22 1.705 -36.935 -14.878 794 1HB GLU 22 1HB GLU 22 -1.145 -37.049 -15.028 795 2HB GLU 22 2HB GLU 22 -0.679 -35.418 -14.565 796 1HG GLU 22 1HG GLU 22 -0.905 -36.019 -17.065 797 2HG GLU 22 2HG GLU 22 0.452 -35.033 -16.525 798 H ARG 23 H ARG 23 2.094 -37.534 -12.200 799 HA ARG 23 HA ARG 23 1.281 -35.330 -10.612 800 1HB ARG 23 1HB ARG 23 2.912 -37.764 -10.167 801 2HB ARG 23 2HB ARG 23 3.102 -36.423 -9.044 802 1HG ARG 23 1HG ARG 23 0.690 -38.101 -9.586 803 2HG ARG 23 2HG ARG 23 1.458 -37.714 -8.048 804 1HD ARG 23 1HD ARG 23 -0.359 -36.337 -7.903 805 2HD ARG 23 2HD ARG 23 0.749 -35.249 -8.741 806 HE ARG 23 HE ARG 23 -1.323 -36.842 -10.114 807 1HH1 ARG 23 1HH1 ARG 23 0.500 -33.893 -9.722 808 2HH1 ARG 23 2HH1 ARG 23 -0.254 -33.101 -11.065 809 1HH2 ARG 23 1HH2 ARG 23 -2.298 -35.811 -11.891 810 2HH2 ARG 23 2HH2 ARG 23 -1.842 -34.189 -12.296 811 H VAL 24 H VAL 24 2.624 -34.522 -12.909 812 HA VAL 24 HA VAL 24 5.285 -33.752 -12.391 813 HB VAL 24 HB VAL 24 4.893 -32.004 -14.094 814 1HG1 VAL 24 1HG1 VAL 24 4.488 -34.832 -14.453 815 2HG1 VAL 24 2HG1 VAL 24 5.345 -33.681 -15.480 816 3HG1 VAL 24 3HG1 VAL 24 3.608 -33.914 -15.676 817 1HG2 VAL 24 1HG2 VAL 24 2.066 -32.965 -14.368 818 2HG2 VAL 24 2HG2 VAL 24 2.803 -31.486 -14.981 819 3HG2 VAL 24 3HG2 VAL 24 2.474 -31.657 -13.257 820 H VAL 25 H VAL 25 2.278 -32.994 -11.130 821 HA VAL 25 HA VAL 25 1.400 -31.161 -10.017 822 HB VAL 25 HB VAL 25 2.684 -30.912 -7.819 823 1HG1 VAL 25 1HG1 VAL 25 1.905 -33.729 -8.506 824 2HG1 VAL 25 2HG1 VAL 25 0.725 -32.431 -8.324 825 3HG1 VAL 25 3HG1 VAL 25 1.745 -32.891 -6.962 826 1HG2 VAL 25 1HG2 VAL 25 4.778 -31.921 -9.126 827 2HG2 VAL 25 2HG2 VAL 25 4.103 -33.420 -8.487 828 3HG2 VAL 25 3HG2 VAL 25 4.555 -32.117 -7.388 829 H THR 26 H THR 26 2.436 -29.964 -12.011 830 HA THR 26 HA THR 26 4.600 -28.377 -11.988 831 HB THR 26 HB THR 26 2.608 -26.586 -12.765 832 HG1 THR 26 HG1 THR 26 0.906 -27.891 -12.823 833 1HG2 THR 26 1HG2 THR 26 3.999 -28.706 -14.408 834 2HG2 THR 26 2HG2 THR 26 4.670 -27.131 -13.984 835 3HG2 THR 26 3HG2 THR 26 3.254 -27.232 -15.031 836 H ALA 27 H ALA 27 1.743 -28.082 -10.032 837 HA ALA 27 HA ALA 27 1.112 -26.210 -8.673 838 1HB ALA 27 1HB ALA 27 3.040 -28.157 -7.539 839 2HB ALA 27 2HB ALA 27 1.358 -27.843 -7.109 840 3HB ALA 27 3HB ALA 27 2.628 -26.749 -6.559 841 HA PRO 28 HA PRO 28 4.416 -23.331 -10.403 842 1HB PRO 28 1HB PRO 28 2.114 -21.738 -9.333 843 2HB PRO 28 2HB PRO 28 3.119 -21.438 -10.755 844 1HG PRO 28 1HG PRO 28 0.672 -22.633 -10.877 845 2HG PRO 28 2HG PRO 28 1.967 -22.928 -12.048 846 1HD PRO 28 1HD PRO 28 0.838 -24.750 -10.107 847 2HD PRO 28 2HD PRO 28 2.046 -25.081 -11.362 848 H VAL 29 H VAL 29 5.718 -24.084 -8.569 849 HA VAL 29 HA VAL 29 5.349 -22.882 -5.995 850 HB VAL 29 HB VAL 29 7.771 -23.694 -5.678 851 1HG1 VAL 29 1HG1 VAL 29 6.510 -25.205 -4.622 852 2HG1 VAL 29 2HG1 VAL 29 6.691 -26.197 -6.069 853 3HG1 VAL 29 3HG1 VAL 29 5.271 -25.169 -5.876 854 1HG2 VAL 29 1HG2 VAL 29 8.604 -23.918 -7.845 855 2HG2 VAL 29 2HG2 VAL 29 7.150 -24.733 -8.422 856 3HG2 VAL 29 3HG2 VAL 29 8.273 -25.580 -7.358 857 H SER 30 H SER 30 6.631 -22.007 -8.981 858 HA SER 30 HA SER 30 8.486 -20.014 -8.036 859 1HB SER 30 1HB SER 30 8.631 -19.424 -10.454 860 2HB SER 30 2HB SER 30 8.929 -21.137 -10.151 861 HG SER 30 HG SER 30 7.249 -21.597 -11.317 862 H SER 31 H SER 31 5.162 -20.238 -8.998 863 HA SER 31 HA SER 31 4.584 -17.618 -9.660 864 1HB SER 31 1HB SER 31 2.295 -18.122 -9.171 865 2HB SER 31 2HB SER 31 3.029 -19.599 -9.796 866 HG SER 31 HG SER 31 1.986 -19.066 -7.320 867 H GLY 32 H GLY 32 4.164 -19.112 -6.451 868 1HA GLY 32 1HA GLY 32 3.501 -16.812 -5.057 869 2HA GLY 32 2HA GLY 32 4.269 -18.221 -4.345 870 H LYS 33 H LYS 33 6.637 -17.854 -6.145 871 HA LYS 33 HA LYS 33 8.372 -16.631 -4.433 872 1HB LYS 33 1HB LYS 33 8.569 -16.720 -7.441 873 2HB LYS 33 2HB LYS 33 9.901 -16.351 -6.358 874 1HG LYS 33 1HG LYS 33 8.363 -18.934 -6.311 875 2HG LYS 33 2HG LYS 33 9.869 -18.687 -7.197 876 1HD LYS 33 1HD LYS 33 10.995 -19.186 -5.350 877 2HD LYS 33 2HD LYS 33 10.312 -17.753 -4.578 878 1HE LYS 33 1HE LYS 33 9.368 -20.593 -4.469 879 2HE LYS 33 2HE LYS 33 9.722 -19.488 -3.141 880 1HZ LYS 33 1HZ LYS 33 7.332 -19.860 -3.470 881 2HZ LYS 33 2HZ LYS 33 7.441 -19.193 -5.019 882 3HZ LYS 33 3HZ LYS 33 7.758 -18.234 -3.663 883 H ILE 34 H ILE 34 6.155 -15.007 -6.555 884 HA ILE 34 HA ILE 34 7.435 -12.463 -5.798 885 HB ILE 34 HB ILE 34 6.198 -11.614 -7.950 886 1HG1 ILE 34 1HG1 ILE 34 6.931 -14.042 -9.327 887 2HG1 ILE 34 2HG1 ILE 34 5.701 -14.377 -8.113 888 1HG2 ILE 34 1HG2 ILE 34 8.252 -11.918 -9.209 889 2HG2 ILE 34 2HG2 ILE 34 8.763 -13.189 -8.099 890 3HG2 ILE 34 3HG2 ILE 34 8.612 -11.528 -7.527 891 1HD1 ILE 34 1HD1 ILE 34 4.340 -13.846 -9.830 892 2HD1 ILE 34 2HD1 ILE 34 5.535 -12.804 -10.602 893 3HD1 ILE 34 3HD1 ILE 34 4.611 -12.214 -9.219 894 H LYS 35 H LYS 35 6.183 -10.800 -5.136 895 HA LYS 35 HA LYS 35 3.281 -11.233 -4.936 896 1HB LYS 35 1HB LYS 35 5.242 -10.848 -2.782 897 2HB LYS 35 2HB LYS 35 3.872 -9.751 -2.697 898 1HG LYS 35 1HG LYS 35 3.216 -11.565 -1.408 899 2HG LYS 35 2HG LYS 35 2.422 -11.846 -2.959 900 1HD LYS 35 1HD LYS 35 3.985 -13.506 -3.570 901 2HD LYS 35 2HD LYS 35 5.096 -13.043 -2.279 902 1HE LYS 35 1HE LYS 35 4.183 -14.735 -1.132 903 2HE LYS 35 2HE LYS 35 2.816 -13.648 -0.895 904 1HZ LYS 35 1HZ LYS 35 1.547 -15.024 -2.047 905 2HZ LYS 35 2HZ LYS 35 2.846 -16.093 -2.226 906 3HZ LYS 35 3HZ LYS 35 2.563 -14.904 -3.396 907 H ARG 36 H ARG 36 2.082 -9.177 -4.586 908 HA ARG 36 HA ARG 36 3.529 -6.902 -5.778 909 1HB ARG 36 1HB ARG 36 1.212 -6.253 -6.673 910 2HB ARG 36 2HB ARG 36 2.052 -7.584 -7.461 911 1HG ARG 36 1HG ARG 36 0.393 -8.507 -5.281 912 2HG ARG 36 2HG ARG 36 -0.532 -7.603 -6.481 913 1HD ARG 36 1HD ARG 36 1.419 -9.649 -7.414 914 2HD ARG 36 2HD ARG 36 -0.118 -10.190 -6.740 915 HE ARG 36 HE ARG 36 -1.239 -9.172 -8.533 916 1HH1 ARG 36 1HH1 ARG 36 2.220 -8.802 -8.744 917 2HH1 ARG 36 2HH1 ARG 36 2.197 -8.356 -10.418 918 1HH2 ARG 36 1HH2 ARG 36 -1.277 -8.588 -10.730 919 2HH2 ARG 36 2HH2 ARG 36 0.210 -8.234 -11.546 920 H VAL 37 H VAL 37 3.407 -4.994 -4.782 921 HA VAL 37 HA VAL 37 1.392 -4.608 -2.683 922 HB VAL 37 HB VAL 37 4.347 -4.057 -2.353 923 1HG1 VAL 37 1HG1 VAL 37 3.878 -2.683 -0.666 924 2HG1 VAL 37 2HG1 VAL 37 2.737 -3.831 0.035 925 3HG1 VAL 37 3HG1 VAL 37 2.200 -2.703 -1.210 926 1HG2 VAL 37 1HG2 VAL 37 4.176 -5.707 -0.513 927 2HG2 VAL 37 2HG2 VAL 37 3.862 -6.406 -2.101 928 3HG2 VAL 37 3HG2 VAL 37 2.521 -6.050 -1.012 929 H ASN 38 H ASN 38 0.279 -2.858 -3.216 930 HA ASN 38 HA ASN 38 1.450 -0.814 -4.904 931 1HB ASN 38 1HB ASN 38 -0.812 -1.490 -5.415 932 2HB ASN 38 2HB ASN 38 -1.332 -1.153 -3.767 933 1HD2 ASN 38 1HD2 ASN 38 0.114 0.405 -6.596 934 2HD2 ASN 38 2HD2 ASN 38 -0.661 1.932 -6.366 935 H VAL 39 H VAL 39 2.645 0.721 -4.001 936 HA VAL 39 HA VAL 39 1.781 1.818 -1.404 937 HB VAL 39 HB VAL 39 4.602 2.228 -2.142 938 1HG1 VAL 39 1HG1 VAL 39 3.230 1.304 0.379 939 2HG1 VAL 39 2HG1 VAL 39 3.666 2.967 -0.016 940 3HG1 VAL 39 3HG1 VAL 39 4.927 1.760 0.235 941 1HG2 VAL 39 1HG2 VAL 39 5.398 0.069 -1.810 942 2HG2 VAL 39 2HG2 VAL 39 3.982 -0.185 -2.831 943 3HG2 VAL 39 3HG2 VAL 39 3.884 -0.486 -1.096 944 H ASN 40 H ASN 40 1.794 4.028 -1.142 945 HA ASN 40 HA ASN 40 2.286 5.584 -3.592 946 1HB ASN 40 1HB ASN 40 0.581 7.192 -2.657 947 2HB ASN 40 2HB ASN 40 -0.055 5.631 -3.164 948 1HD2 ASN 40 1HD2 ASN 40 -0.564 4.080 -1.542 949 2HD2 ASN 40 2HD2 ASN 40 -0.973 4.592 0.056 950 H PHE 41 H PHE 41 3.981 6.860 -3.460 951 HA PHE 41 HA PHE 41 4.930 7.720 -0.827 952 1HB PHE 41 1HB PHE 41 6.428 8.019 -3.421 953 2HB PHE 41 2HB PHE 41 7.072 7.991 -1.785 954 HD1 PHE 41 HD1 PHE 41 6.247 5.689 -0.508 955 HD2 PHE 41 HD2 PHE 41 6.983 6.191 -4.668 956 HE1 PHE 41 HE1 PHE 41 6.676 3.275 -0.718 957 HE2 PHE 41 HE2 PHE 41 7.413 3.778 -4.887 958 HZ PHE 41 HZ PHE 41 7.259 2.317 -2.910 959 H ASP 42 H ASP 42 6.167 9.912 -1.000 960 HA ASP 42 HA ASP 42 4.187 11.893 -1.659 961 1HB ASP 42 1HB ASP 42 5.420 12.152 0.396 962 2HB ASP 42 2HB ASP 42 6.956 12.073 -0.457 963 H GLU 43 H GLU 43 4.646 13.799 -2.966 964 HA GLU 43 HA GLU 43 5.486 13.241 -5.544 965 1HB GLU 43 1HB GLU 43 4.554 15.523 -4.106 966 2HB GLU 43 2HB GLU 43 5.953 16.009 -5.054 967 1HG GLU 43 1HG GLU 43 3.645 14.498 -6.234 968 2HG GLU 43 2HG GLU 43 3.690 16.257 -6.148 969 H GLU 44 H GLU 44 7.276 14.688 -2.868 970 HA GLU 44 HA GLU 44 9.647 15.242 -4.294 971 1HB GLU 44 1HB GLU 44 8.947 16.132 -2.013 972 2HB GLU 44 2HB GLU 44 9.479 14.591 -1.355 973 1HG GLU 44 1HG GLU 44 11.606 15.213 -1.386 974 2HG GLU 44 2HG GLU 44 11.494 15.771 -3.055 975 H LYS 45 H LYS 45 8.470 12.418 -2.575 976 HA LYS 45 HA LYS 45 10.867 10.935 -2.576 977 1HB LYS 45 1HB LYS 45 8.421 10.567 -1.479 978 2HB LYS 45 2HB LYS 45 8.323 9.446 -2.830 979 1HG LYS 45 1HG LYS 45 9.951 8.075 -1.996 980 2HG LYS 45 2HG LYS 45 10.736 9.375 -1.096 981 1HD LYS 45 1HD LYS 45 8.078 9.006 -0.107 982 2HD LYS 45 2HD LYS 45 8.912 7.451 -0.135 983 1HE LYS 45 1HE LYS 45 9.973 8.027 1.728 984 2HE LYS 45 2HE LYS 45 10.761 9.331 0.840 985 1HZ LYS 45 1HZ LYS 45 9.693 10.708 2.190 986 2HZ LYS 45 2HZ LYS 45 8.722 9.476 2.823 987 3HZ LYS 45 3HZ LYS 45 8.254 10.278 1.409 988 H HIS 46 H HIS 46 8.365 11.442 -4.957 989 HA HIS 46 HA HIS 46 9.186 9.339 -6.710 990 1HB HIS 46 1HB HIS 46 6.899 10.595 -6.579 991 2HB HIS 46 2HB HIS 46 7.680 11.762 -7.641 992 HD1 HIS 46 HD1 HIS 46 7.114 11.331 -9.996 993 HD2 HIS 46 HD2 HIS 46 7.374 7.806 -7.812 994 HE1 HIS 46 HE1 HIS 46 6.625 9.487 -11.635 995 HE2 HIS 46 HE2 HIS 46 6.727 7.367 -10.278 996 H THR 47 H THR 47 9.693 12.851 -6.617 997 HA THR 47 HA THR 47 11.197 13.050 -8.984 998 HB THR 47 HB THR 47 11.751 14.839 -6.642 999 HG1 THR 47 HG1 THR 47 9.692 15.823 -7.980 1000 1HG2 THR 47 1HG2 THR 47 12.968 15.503 -8.513 1001 2HG2 THR 47 2HG2 THR 47 11.529 16.520 -8.599 1002 3HG2 THR 47 3HG2 THR 47 11.664 15.094 -9.627 1003 H ARG 48 H ARG 48 12.144 12.510 -5.622 1004 HA ARG 48 HA ARG 48 14.942 12.507 -6.108 1005 1HB ARG 48 1HB ARG 48 13.234 12.329 -3.862 1006 2HB ARG 48 2HB ARG 48 14.243 10.889 -3.840 1007 1HG ARG 48 1HG ARG 48 16.243 12.246 -3.900 1008 2HG ARG 48 2HG ARG 48 15.268 13.713 -4.030 1009 1HD ARG 48 1HD ARG 48 14.357 12.224 -1.786 1010 2HD ARG 48 2HD ARG 48 16.114 12.348 -1.692 1011 HE ARG 48 HE ARG 48 14.217 14.587 -1.707 1012 1HH1 ARG 48 1HH1 ARG 48 17.460 13.370 -1.338 1013 2HH1 ARG 48 2HH1 ARG 48 18.067 14.832 -0.636 1014 1HH2 ARG 48 1HH2 ARG 48 15.008 16.515 -0.780 1015 2HH2 ARG 48 2HH2 ARG 48 16.674 16.617 -0.317 1016 H PHE 49 H PHE 49 12.420 10.105 -6.247 1017 HA PHE 49 HA PHE 49 14.070 7.803 -6.275 1018 1HB PHE 49 1HB PHE 49 11.345 8.277 -6.255 1019 2HB PHE 49 2HB PHE 49 11.610 7.600 -7.853 1020 HD1 PHE 49 HD1 PHE 49 14.116 6.202 -5.934 1021 HD2 PHE 49 HD2 PHE 49 9.894 6.045 -6.450 1022 HE1 PHE 49 HE1 PHE 49 14.086 3.938 -4.971 1023 HE2 PHE 49 HE2 PHE 49 9.859 3.782 -5.488 1024 HZ PHE 49 HZ PHE 49 11.956 2.727 -4.746 1025 H LYS 50 H LYS 50 12.803 9.927 -8.783 1026 HA LYS 50 HA LYS 50 13.650 8.437 -11.013 1027 1HB LYS 50 1HB LYS 50 13.006 11.339 -10.575 1028 2HB LYS 50 2HB LYS 50 13.615 10.779 -12.127 1029 1HG LYS 50 1HG LYS 50 11.209 9.555 -10.815 1030 2HG LYS 50 2HG LYS 50 11.104 10.963 -11.875 1031 1HD LYS 50 1HD LYS 50 12.716 8.955 -13.120 1032 2HD LYS 50 2HD LYS 50 11.188 8.240 -12.604 1033 1HE LYS 50 1HE LYS 50 10.305 9.089 -14.465 1034 2HE LYS 50 2HE LYS 50 10.445 10.669 -13.695 1035 1HZ LYS 50 1HZ LYS 50 11.933 11.261 -15.204 1036 2HZ LYS 50 2HZ LYS 50 11.721 9.782 -15.997 1037 3HZ LYS 50 3HZ LYS 50 12.925 9.946 -14.821 1038 H ALA 51 H ALA 51 15.215 10.999 -9.145 1039 HA ALA 51 HA ALA 51 17.539 11.177 -10.752 1040 1HB ALA 51 1HB ALA 51 16.956 12.993 -9.293 1041 2HB ALA 51 2HB ALA 51 18.518 12.347 -8.789 1042 3HB ALA 51 3HB ALA 51 17.062 11.946 -7.877 1043 H ALA 52 H ALA 52 16.670 9.233 -7.949 1044 HA ALA 52 HA ALA 52 19.280 8.147 -7.546 1045 1HB ALA 52 1HB ALA 52 16.784 6.765 -6.648 1046 2HB ALA 52 2HB ALA 52 17.277 8.284 -5.900 1047 3HB ALA 52 3HB ALA 52 18.349 6.884 -5.843 1048 H CYS 53 H CYS 53 16.515 7.315 -9.491 1049 HA CYS 53 HA CYS 53 17.262 4.645 -10.101 1050 1HB CYS 53 1HB CYS 53 15.397 6.639 -11.360 1051 2HB CYS 53 2HB CYS 53 15.718 5.094 -12.139 1052 HG CYS 53 HG CYS 53 13.849 3.884 -10.882 1053 H ALA 54 H ALA 54 17.710 7.742 -11.760 1054 HA ALA 54 HA ALA 54 19.128 6.632 -13.969 1055 1HB ALA 54 1HB ALA 54 18.960 8.685 -14.837 1056 2HB ALA 54 2HB ALA 54 19.661 9.444 -13.408 1057 3HB ALA 54 3HB ALA 54 17.942 9.049 -13.443 1058 H ARG 55 H ARG 55 20.030 7.934 -10.849 1059 HA ARG 55 HA ARG 55 22.802 8.218 -11.367 1060 1HB ARG 55 1HB ARG 55 21.149 8.933 -9.319 1061 2HB ARG 55 2HB ARG 55 22.016 7.581 -8.602 1062 1HG ARG 55 1HG ARG 55 24.076 8.928 -9.674 1063 2HG ARG 55 2HG ARG 55 22.969 10.263 -9.347 1064 1HD ARG 55 1HD ARG 55 22.750 8.938 -7.032 1065 2HD ARG 55 2HD ARG 55 24.390 8.466 -7.477 1066 HE ARG 55 HE ARG 55 25.071 10.571 -6.940 1067 1HH1 ARG 55 1HH1 ARG 55 21.646 10.653 -7.577 1068 2HH1 ARG 55 2HH1 ARG 55 21.476 12.319 -7.139 1069 1HH2 ARG 55 1HH2 ARG 55 24.855 12.762 -6.362 1070 2HH2 ARG 55 2HH2 ARG 55 23.299 13.518 -6.448 1071 H LYS 56 H LYS 56 20.827 5.599 -10.071 1072 HA LYS 56 HA LYS 56 23.158 3.891 -9.736 1073 1HB LYS 56 1HB LYS 56 20.661 4.055 -8.485 1074 2HB LYS 56 2HB LYS 56 20.603 2.561 -9.411 1075 1HG LYS 56 1HG LYS 56 21.773 1.547 -7.836 1076 2HG LYS 56 2HG LYS 56 23.114 2.658 -8.116 1077 1HD LYS 56 1HD LYS 56 22.240 4.210 -6.505 1078 2HD LYS 56 2HD LYS 56 20.768 3.255 -6.322 1079 1HE LYS 56 1HE LYS 56 21.936 2.540 -4.492 1080 2HE LYS 56 2HE LYS 56 22.479 1.360 -5.683 1081 1HZ LYS 56 1HZ LYS 56 23.947 3.846 -4.997 1082 2HZ LYS 56 2HZ LYS 56 24.480 2.609 -6.020 1083 3HZ LYS 56 3HZ LYS 56 24.301 2.318 -4.363 1084 H GLY 57 H GLY 57 20.964 4.688 -12.159 1085 1HA GLY 57 1HA GLY 57 20.576 3.834 -14.253 1086 2HA GLY 57 2HA GLY 57 22.059 2.917 -14.041 1087 H THR 58 H THR 58 18.764 2.869 -12.678 1088 HA THR 58 HA THR 58 18.453 0.117 -13.566 1089 HB THR 58 HB THR 58 19.495 0.023 -11.282 1090 HG1 THR 58 HG1 THR 58 18.136 -1.665 -12.108 1091 1HG2 THR 58 1HG2 THR 58 17.347 1.857 -10.706 1092 2HG2 THR 58 2HG2 THR 58 18.723 1.395 -9.704 1093 3HG2 THR 58 3HG2 THR 58 17.245 0.435 -9.668 1094 H SER 59 H SER 59 16.203 -0.695 -13.066 1095 HA SER 59 HA SER 59 14.310 1.196 -14.005 1096 1HB SER 59 1HB SER 59 13.126 -1.178 -12.802 1097 2HB SER 59 2HB SER 59 13.090 -0.630 -14.478 1098 HG SER 59 HG SER 59 14.445 -2.644 -13.507 1099 H ILE 60 H ILE 60 12.253 1.708 -12.963 1100 HA ILE 60 HA ILE 60 12.641 2.844 -10.397 1101 HB ILE 60 HB ILE 60 11.114 3.801 -12.086 1102 1HG1 ILE 60 1HG1 ILE 60 9.060 3.850 -10.329 1103 2HG1 ILE 60 2HG1 ILE 60 10.334 3.224 -9.287 1104 1HG2 ILE 60 1HG2 ILE 60 8.832 2.123 -11.474 1105 2HG2 ILE 60 2HG2 ILE 60 10.122 1.224 -12.273 1106 3HG2 ILE 60 3HG2 ILE 60 9.450 2.667 -13.034 1107 1HD1 ILE 60 1HD1 ILE 60 10.254 5.599 -9.070 1108 2HD1 ILE 60 2HD1 ILE 60 10.349 5.811 -10.819 1109 3HD1 ILE 60 3HD1 ILE 60 11.731 5.168 -9.931 1110 H THR 61 H THR 61 11.451 -0.217 -11.470 1111 HA THR 61 HA THR 61 10.116 -0.830 -8.973 1112 HB THR 61 HB THR 61 10.732 -3.054 -10.808 1113 HG1 THR 61 HG1 THR 61 8.677 -1.496 -11.779 1114 1HG2 THR 61 1HG2 THR 61 8.076 -3.048 -10.546 1115 2HG2 THR 61 2HG2 THR 61 8.486 -2.063 -9.142 1116 3HG2 THR 61 3HG2 THR 61 9.147 -3.690 -9.300 1117 H ASP 62 H ASP 62 13.230 -1.270 -10.428 1118 HA ASP 62 HA ASP 62 14.086 -3.403 -8.730 1119 1HB ASP 62 1HB ASP 62 15.023 -2.537 -11.052 1120 2HB ASP 62 2HB ASP 62 16.052 -1.559 -10.010 1121 H VAL 63 H VAL 63 14.535 0.119 -8.726 1122 HA VAL 63 HA VAL 63 16.300 0.325 -6.587 1123 HB VAL 63 HB VAL 63 14.915 2.557 -6.159 1124 1HG1 VAL 63 1HG1 VAL 63 16.620 3.554 -7.214 1125 2HG1 VAL 63 2HG1 VAL 63 16.305 2.711 -8.731 1126 3HG1 VAL 63 3HG1 VAL 63 17.218 1.912 -7.453 1127 1HG2 VAL 63 1HG2 VAL 63 13.047 1.892 -7.600 1128 2HG2 VAL 63 2HG2 VAL 63 14.148 1.809 -8.977 1129 3HG2 VAL 63 3HG2 VAL 63 13.838 3.355 -8.185 1130 H VAL 64 H VAL 64 12.764 0.101 -6.589 1131 HA VAL 64 HA VAL 64 12.407 0.469 -3.816 1132 HB VAL 64 HB VAL 64 10.611 -1.300 -5.455 1133 1HG1 VAL 64 1HG1 VAL 64 9.946 -1.202 -3.202 1134 2HG1 VAL 64 2HG1 VAL 64 8.895 -0.061 -4.041 1135 3HG1 VAL 64 3HG1 VAL 64 10.263 0.529 -3.097 1136 1HG2 VAL 64 1HG2 VAL 64 11.299 0.905 -6.625 1137 2HG2 VAL 64 2HG2 VAL 64 10.281 1.674 -5.407 1138 3HG2 VAL 64 3HG2 VAL 64 9.588 0.491 -6.517 1139 H ASN 65 H ASN 65 13.069 -2.366 -5.793 1140 HA ASN 65 HA ASN 65 12.747 -4.275 -3.711 1141 1HB ASN 65 1HB ASN 65 12.681 -4.840 -6.133 1142 2HB ASN 65 2HB ASN 65 14.404 -4.493 -6.236 1143 1HD2 ASN 65 1HD2 ASN 65 15.037 -6.521 -6.799 1144 2HD2 ASN 65 2HD2 ASN 65 14.924 -7.884 -5.743 1145 H GLN 66 H GLN 66 15.177 -2.011 -4.488 1146 HA GLN 66 HA GLN 66 17.331 -3.427 -3.189 1147 1HB GLN 66 1HB GLN 66 17.025 -0.874 -4.657 1148 2HB GLN 66 2HB GLN 66 18.283 -0.916 -3.427 1149 1HG GLN 66 1HG GLN 66 18.835 -3.213 -4.655 1150 2HG GLN 66 2HG GLN 66 18.092 -2.352 -6.002 1151 1HE2 GLN 66 1HE2 GLN 66 19.764 -1.836 -7.245 1152 2HE2 GLN 66 2HE2 GLN 66 21.147 -0.936 -6.735 1153 H LEU 67 H LEU 67 15.305 -0.582 -2.464 1154 HA LEU 67 HA LEU 67 16.488 0.004 0.019 1155 1HB LEU 67 1HB LEU 67 13.916 0.789 0.418 1156 2HB LEU 67 2HB LEU 67 15.140 1.751 -0.386 1157 HG LEU 67 HG LEU 67 13.971 0.093 -2.359 1158 1HD1 LEU 67 1HD1 LEU 67 11.937 1.518 -0.650 1159 2HD1 LEU 67 2HD1 LEU 67 12.088 -0.227 -0.853 1160 3HD1 LEU 67 3HD1 LEU 67 11.630 0.782 -2.223 1161 1HD2 LEU 67 1HD2 LEU 67 12.975 2.563 -2.832 1162 2HD2 LEU 67 2HD2 LEU 67 14.618 2.064 -3.235 1163 3HD2 LEU 67 3HD2 LEU 67 14.308 2.950 -1.742 1164 H VAL 68 H VAL 68 14.014 -2.267 -0.955 1165 HA VAL 68 HA VAL 68 13.207 -3.018 1.677 1166 HB VAL 68 HB VAL 68 12.997 -4.614 -0.889 1167 1HG1 VAL 68 1HG1 VAL 68 12.731 -5.974 1.127 1168 2HG1 VAL 68 2HG1 VAL 68 11.210 -5.823 0.247 1169 3HG1 VAL 68 3HG1 VAL 68 11.483 -4.872 1.707 1170 1HG2 VAL 68 1HG2 VAL 68 11.858 -2.209 -0.496 1171 2HG2 VAL 68 2HG2 VAL 68 10.632 -3.253 0.223 1172 3HG2 VAL 68 3HG2 VAL 68 11.123 -3.495 -1.454 1173 H ASP 69 H ASP 69 15.737 -3.918 -0.521 1174 HA ASP 69 HA ASP 69 16.517 -6.320 0.828 1175 1HB ASP 69 1HB ASP 69 17.047 -5.243 -1.632 1176 2HB ASP 69 2HB ASP 69 18.551 -4.919 -0.778 1177 H ASN 70 H ASN 70 17.277 -2.936 1.073 1178 HA ASN 70 HA ASN 70 19.576 -3.365 2.781 1179 1HB ASN 70 1HB ASN 70 18.981 -1.386 1.064 1180 2HB ASN 70 2HB ASN 70 18.344 -0.674 2.543 1181 1HD2 ASN 70 1HD2 ASN 70 20.551 0.241 0.978 1182 2HD2 ASN 70 2HD2 ASN 70 21.946 0.199 1.995 1183 H TRP 71 H TRP 71 16.240 -3.263 3.180 1184 HA TRP 71 HA TRP 71 16.452 -2.357 5.969 1185 1HB TRP 71 1HB TRP 71 14.800 -1.144 4.662 1186 2HB TRP 71 2HB TRP 71 14.041 -2.651 4.162 1187 HD1 TRP 71 HD1 TRP 71 14.223 -0.212 7.072 1188 HE1 TRP 71 HE1 TRP 71 12.404 -0.820 8.789 1189 HE3 TRP 71 HE3 TRP 71 12.694 -4.670 5.092 1190 HZ2 TRP 71 HZ2 TRP 71 10.564 -2.912 9.242 1191 HZ3 TRP 71 HZ3 TRP 71 10.898 -5.911 6.227 1192 HH2 TRP 71 HH2 TRP 71 9.856 -5.048 8.260 1193 H LEU 72 H LEU 72 15.415 -5.016 3.931 1194 HA LEU 72 HA LEU 72 14.274 -6.583 6.011 1195 1HB LEU 72 1HB LEU 72 14.138 -6.662 3.335 1196 2HB LEU 72 2HB LEU 72 15.345 -7.908 3.590 1197 HG LEU 72 HG LEU 72 13.429 -8.641 5.392 1198 1HD1 LEU 72 1HD1 LEU 72 11.824 -7.014 4.720 1199 2HD1 LEU 72 2HD1 LEU 72 11.296 -8.574 4.090 1200 3HD1 LEU 72 3HD1 LEU 72 12.057 -7.402 3.015 1201 1HD2 LEU 72 1HD2 LEU 72 12.733 -10.262 3.547 1202 2HD2 LEU 72 2HD2 LEU 72 14.434 -10.244 4.009 1203 3HD2 LEU 72 3HD2 LEU 72 13.912 -9.428 2.535 1204 H LYS 73 H LYS 73 17.474 -6.481 4.508 1205 HA LYS 73 HA LYS 73 18.369 -8.707 6.162 1206 1HB LYS 73 1HB LYS 73 20.196 -7.194 4.346 1207 2HB LYS 73 2HB LYS 73 20.194 -8.903 4.756 1208 1HG LYS 73 1HG LYS 73 17.758 -8.395 3.446 1209 2HG LYS 73 2HG LYS 73 19.018 -7.583 2.514 1210 1HD LYS 73 1HD LYS 73 19.580 -10.341 3.443 1211 2HD LYS 73 2HD LYS 73 18.389 -10.149 2.155 1212 1HE LYS 73 1HE LYS 73 21.150 -8.947 2.082 1213 2HE LYS 73 2HE LYS 73 20.743 -10.511 1.375 1214 1HZ LYS 73 1HZ LYS 73 19.600 -7.880 0.611 1215 2HZ LYS 73 2HZ LYS 73 19.095 -9.367 -0.018 1216 3HZ LYS 73 3HZ LYS 73 20.669 -8.819 -0.304 1217 H GLU 74 H GLU 74 18.078 -5.453 6.626 1218 HA GLU 74 HA GLU 74 20.504 -5.334 8.293 1219 1HB GLU 74 1HB GLU 74 18.969 -3.236 6.815 1220 2HB GLU 74 2HB GLU 74 19.895 -2.786 8.241 1221 1HG GLU 74 1HG GLU 74 21.211 -4.379 6.099 1222 2HG GLU 74 2HG GLU 74 20.952 -2.651 5.860 1223 H ASN 75 H ASN 75 17.164 -4.079 8.266 1224 HA ASN 75 HA ASN 75 17.089 -3.449 10.999 1225 1HB ASN 75 1HB ASN 75 15.109 -2.580 10.429 1226 2HB ASN 75 2HB ASN 75 15.365 -3.209 8.806 1227 1HD2 ASN 75 1HD2 ASN 75 14.687 -5.507 8.488 1228 2HD2 ASN 75 2HD2 ASN 75 13.224 -6.012 9.254 1229 H GLU 76 H GLU 76 16.674 -6.463 9.334 1230 HA GLU 76 HA GLU 76 15.546 -7.744 11.704 1231 1HB GLU 76 1HB GLU 76 15.507 -8.268 8.862 1232 2HB GLU 76 2HB GLU 76 16.030 -9.693 9.750 1233 1HG GLU 76 1HG GLU 76 13.557 -8.152 10.470 1234 2HG GLU 76 2HG GLU 76 13.555 -9.480 9.311 Start of MODEL 2 1 1H MET 1 1H MET 1 -68.634 2.150 -2.361 2 2H MET 1 2H MET 1 -67.342 1.512 -1.471 3 3H MET 1 3H MET 1 -68.927 0.998 -1.153 4 HA MET 1 HA MET 1 -67.337 -0.467 -2.561 5 1HB MET 1 1HB MET 1 -70.000 -0.407 -2.119 6 2HB MET 1 2HB MET 1 -69.986 -0.145 -3.859 7 1HG MET 1 1HG MET 1 -68.711 -2.190 -4.174 8 2HG MET 1 2HG MET 1 -68.669 -2.444 -2.429 9 1HE MET 1 1HE MET 1 -69.198 -4.636 -3.687 10 2HE MET 1 2HE MET 1 -70.810 -5.149 -4.183 11 3HE MET 1 3HE MET 1 -70.388 -5.098 -2.471 12 H SER 2 H SER 2 -66.232 -0.567 -4.399 13 HA SER 2 HA SER 2 -65.393 -0.082 -6.449 14 1HB SER 2 1HB SER 2 -67.877 1.568 -6.949 15 2HB SER 2 2HB SER 2 -66.761 0.939 -8.161 16 HG SER 2 HG SER 2 -68.801 -0.328 -6.778 17 H LEU 3 H LEU 3 -67.113 2.987 -5.812 18 HA LEU 3 HA LEU 3 -64.508 4.347 -5.844 19 1HB LEU 3 1HB LEU 3 -67.026 5.042 -6.890 20 2HB LEU 3 2HB LEU 3 -66.760 6.118 -5.532 21 HG LEU 3 HG LEU 3 -64.675 5.757 -7.669 22 1HD1 LEU 3 1HD1 LEU 3 -66.455 6.473 -8.980 23 2HD1 LEU 3 2HD1 LEU 3 -65.661 7.979 -8.519 24 3HD1 LEU 3 3HD1 LEU 3 -67.131 7.468 -7.690 25 1HD2 LEU 3 1HD2 LEU 3 -63.948 6.806 -5.603 26 2HD2 LEU 3 2HD2 LEU 3 -65.279 7.960 -5.700 27 3HD2 LEU 3 3HD2 LEU 3 -63.996 7.992 -6.909 28 H GLU 4 H GLU 4 -63.586 4.722 -3.964 29 HA GLU 4 HA GLU 4 -65.105 4.477 -1.505 30 1HB GLU 4 1HB GLU 4 -62.390 4.110 -2.301 31 2HB GLU 4 2HB GLU 4 -62.422 5.324 -1.031 32 1HG GLU 4 1HG GLU 4 -63.304 2.468 -0.928 33 2HG GLU 4 2HG GLU 4 -62.143 3.312 0.095 34 H LYS 5 H LYS 5 -64.876 6.101 0.209 35 HA LYS 5 HA LYS 5 -65.266 8.795 -0.793 36 1HB LYS 5 1HB LYS 5 -65.493 7.435 1.854 37 2HB LYS 5 2HB LYS 5 -65.231 9.173 1.839 38 1HG LYS 5 1HG LYS 5 -67.226 9.237 0.208 39 2HG LYS 5 2HG LYS 5 -67.565 7.614 0.811 40 1HD LYS 5 1HD LYS 5 -67.023 9.669 2.858 41 2HD LYS 5 2HD LYS 5 -68.522 9.863 1.949 42 1HE LYS 5 1HE LYS 5 -69.225 8.541 3.691 43 2HE LYS 5 2HE LYS 5 -68.834 7.326 2.474 44 1HZ LYS 5 1HZ LYS 5 -67.940 7.215 4.958 45 2HZ LYS 5 2HZ LYS 5 -66.676 8.110 4.269 46 3HZ LYS 5 3HZ LYS 5 -67.070 6.586 3.643 47 H ALA 6 H ALA 6 -62.919 6.938 1.020 48 HA ALA 6 HA ALA 6 -60.995 9.148 0.874 49 1HB ALA 6 1HB ALA 6 -61.389 6.917 2.703 50 2HB ALA 6 2HB ALA 6 -60.500 8.425 2.931 51 3HB ALA 6 3HB ALA 6 -59.722 7.052 2.137 52 H HIS 7 H HIS 7 -60.120 9.183 -1.088 53 HA HIS 7 HA HIS 7 -58.791 6.776 -2.055 54 1HB HIS 7 1HB HIS 7 -59.647 7.104 -4.365 55 2HB HIS 7 2HB HIS 7 -60.909 6.658 -3.226 56 HD1 HIS 7 HD1 HIS 7 -60.557 8.689 -6.016 57 HD2 HIS 7 HD2 HIS 7 -62.093 9.382 -2.208 58 HE1 HIS 7 HE1 HIS 7 -62.071 10.688 -6.240 59 HE2 HIS 7 HE2 HIS 7 -62.974 11.106 -3.923 60 H THR 8 H THR 8 -56.776 7.350 -2.239 61 HA THR 8 HA THR 8 -56.089 10.134 -2.678 62 HB THR 8 HB THR 8 -53.899 8.201 -2.347 63 HG1 THR 8 HG1 THR 8 -55.961 8.495 -0.391 64 1HG2 THR 8 1HG2 THR 8 -53.042 9.821 -0.890 65 2HG2 THR 8 2HG2 THR 8 -54.637 10.493 -0.553 66 3HG2 THR 8 3HG2 THR 8 -53.881 10.763 -2.124 67 H SER 9 H SER 9 -56.002 7.100 -4.346 68 HA SER 9 HA SER 9 -55.306 6.464 -6.408 69 1HB SER 9 1HB SER 9 -55.259 9.293 -7.374 70 2HB SER 9 2HB SER 9 -55.934 7.854 -8.137 71 HG SER 9 HG SER 9 -57.058 9.592 -6.268 72 H VAL 10 H VAL 10 -53.727 8.291 -8.231 73 HA VAL 10 HA VAL 10 -51.122 7.785 -7.006 74 HB VAL 10 HB VAL 10 -50.400 8.676 -9.406 75 1HG1 VAL 10 1HG1 VAL 10 -50.239 6.349 -8.224 76 2HG1 VAL 10 2HG1 VAL 10 -49.962 6.490 -9.957 77 3HG1 VAL 10 3HG1 VAL 10 -51.517 5.913 -9.358 78 1HG2 VAL 10 1HG2 VAL 10 -53.160 7.561 -9.896 79 2HG2 VAL 10 2HG2 VAL 10 -51.972 7.968 -11.137 80 3HG2 VAL 10 3HG2 VAL 10 -52.664 9.238 -10.127 81 H LYS 11 H LYS 11 -50.078 9.358 -6.017 82 HA LYS 11 HA LYS 11 -50.596 12.137 -6.852 83 1HB LYS 11 1HB LYS 11 -50.337 11.059 -4.041 84 2HB LYS 11 2HB LYS 11 -50.284 12.770 -4.436 85 1HG LYS 11 1HG LYS 11 -52.606 10.966 -5.071 86 2HG LYS 11 2HG LYS 11 -52.486 11.960 -3.619 87 1HD LYS 11 1HD LYS 11 -52.839 13.905 -4.755 88 2HD LYS 11 2HD LYS 11 -52.082 13.305 -6.233 89 1HE LYS 11 1HE LYS 11 -54.237 13.269 -6.939 90 2HE LYS 11 2HE LYS 11 -54.197 11.684 -6.170 91 1HZ LYS 11 1HZ LYS 11 -55.601 14.092 -5.376 92 2HZ LYS 11 2HZ LYS 11 -54.869 13.237 -4.108 93 3HZ LYS 11 3HZ LYS 11 -55.998 12.467 -5.111 94 H LYS 12 H LYS 12 -48.855 13.565 -6.674 95 HA LYS 12 HA LYS 12 -46.238 12.255 -6.698 96 1HB LYS 12 1HB LYS 12 -47.435 14.475 -8.083 97 2HB LYS 12 2HB LYS 12 -45.975 15.008 -7.262 98 1HG LYS 12 1HG LYS 12 -44.637 13.450 -8.428 99 2HG LYS 12 2HG LYS 12 -46.051 12.591 -9.040 100 1HD LYS 12 1HD LYS 12 -45.851 15.466 -9.709 101 2HD LYS 12 2HD LYS 12 -44.689 14.389 -10.486 102 1HE LYS 12 1HE LYS 12 -46.328 13.209 -11.605 103 2HE LYS 12 2HE LYS 12 -47.586 13.660 -10.455 104 1HZ LYS 12 1HZ LYS 12 -48.120 14.981 -12.220 105 2HZ LYS 12 2HZ LYS 12 -46.512 15.170 -12.729 106 3HZ LYS 12 3HZ LYS 12 -47.086 16.037 -11.388 107 H MET 13 H MET 13 -44.483 13.051 -5.465 108 HA MET 13 HA MET 13 -45.240 14.781 -3.204 109 1HB MET 13 1HB MET 13 -44.793 12.145 -2.880 110 2HB MET 13 2HB MET 13 -43.141 12.734 -2.747 111 1HG MET 13 1HG MET 13 -43.701 12.904 -0.574 112 2HG MET 13 2HG MET 13 -44.340 14.459 -1.102 113 1HE MET 13 1HE MET 13 -47.907 14.251 -1.344 114 2HE MET 13 2HE MET 13 -46.381 15.129 -1.423 115 3HE MET 13 3HE MET 13 -47.177 14.882 0.129 116 H THR 14 H THR 14 -44.299 16.065 -5.216 117 HA THR 14 HA THR 14 -41.454 16.113 -5.432 118 HB THR 14 HB THR 14 -42.969 18.467 -6.350 119 HG1 THR 14 HG1 THR 14 -44.211 17.377 -7.799 120 1HG2 THR 14 1HG2 THR 14 -41.512 18.406 -8.115 121 2HG2 THR 14 2HG2 THR 14 -41.453 16.643 -8.143 122 3HG2 THR 14 3HG2 THR 14 -40.544 17.536 -6.922 123 H PHE 15 H PHE 15 -40.009 17.335 -4.373 124 HA PHE 15 HA PHE 15 -40.810 18.676 -1.986 125 1HB PHE 15 1HB PHE 15 -38.720 17.581 -1.896 126 2HB PHE 15 2HB PHE 15 -38.183 18.293 -3.409 127 HD1 PHE 15 HD1 PHE 15 -36.746 20.082 -3.369 128 HD2 PHE 15 HD2 PHE 15 -39.117 19.254 0.066 129 HE1 PHE 15 HE1 PHE 15 -35.542 21.823 -2.123 130 HE2 PHE 15 HE2 PHE 15 -37.921 21.001 1.317 131 HZ PHE 15 HZ PHE 15 -36.129 22.291 0.222 132 H GLY 16 H GLY 16 -39.803 19.673 -5.185 133 1HA GLY 16 1HA GLY 16 -41.118 21.860 -5.699 134 2HA GLY 16 2HA GLY 16 -40.096 22.496 -4.416 135 H GLU 17 H GLU 17 -37.699 21.324 -4.927 136 HA GLU 17 HA GLU 17 -37.007 21.584 -7.704 137 1HB GLU 17 1HB GLU 17 -36.815 23.879 -6.023 138 2HB GLU 17 2HB GLU 17 -35.182 23.332 -6.378 139 1HG GLU 17 1HG GLU 17 -36.251 23.206 -8.839 140 2HG GLU 17 2HG GLU 17 -37.222 24.507 -8.152 141 H ASN 18 H ASN 18 -34.988 20.726 -8.179 142 HA ASN 18 HA ASN 18 -33.844 18.945 -6.212 143 1HB ASN 18 1HB ASN 18 -33.895 18.218 -8.529 144 2HB ASN 18 2HB ASN 18 -33.039 19.664 -9.045 145 1HD2 ASN 18 1HD2 ASN 18 -31.430 18.456 -10.018 146 2HD2 ASN 18 2HD2 ASN 18 -30.223 17.606 -9.103 147 H ARG 19 H ARG 19 -33.116 21.958 -7.819 148 HA ARG 19 HA ARG 19 -31.664 23.651 -7.407 149 1HB ARG 19 1HB ARG 19 -33.098 23.253 -5.194 150 2HB ARG 19 2HB ARG 19 -31.503 22.923 -4.531 151 1HG ARG 19 1HG ARG 19 -30.724 25.098 -5.176 152 2HG ARG 19 2HG ARG 19 -32.239 25.431 -6.018 153 1HD ARG 19 1HD ARG 19 -33.242 26.083 -4.136 154 2HD ARG 19 2HD ARG 19 -32.684 24.656 -3.262 155 HE ARG 19 HE ARG 19 -31.074 25.940 -2.304 156 1HH1 ARG 19 1HH1 ARG 19 -32.210 27.584 -5.179 157 2HH1 ARG 19 2HH1 ARG 19 -31.102 28.917 -5.024 158 1HH2 ARG 19 1HH2 ARG 19 -29.619 27.693 -2.069 159 2HH2 ARG 19 2HH2 ARG 19 -29.614 28.979 -3.247 160 H ASP 20 H ASP 20 -30.177 21.980 -8.551 161 HA ASP 20 HA ASP 20 -27.990 21.010 -6.913 162 1HB ASP 20 1HB ASP 20 -28.980 20.078 -9.210 163 2HB ASP 20 2HB ASP 20 -27.763 21.161 -9.884 164 H LEU 21 H LEU 21 -27.952 23.421 -6.198 165 HA LEU 21 HA LEU 21 -26.126 24.939 -7.941 166 1HB LEU 21 1HB LEU 21 -28.589 25.673 -7.053 167 2HB LEU 21 2HB LEU 21 -27.572 26.353 -5.799 168 HG LEU 21 HG LEU 21 -26.352 27.117 -8.196 169 1HD1 LEU 21 1HD1 LEU 21 -28.015 28.038 -9.576 170 2HD1 LEU 21 2HD1 LEU 21 -29.280 27.761 -8.380 171 3HD1 LEU 21 3HD1 LEU 21 -28.560 26.397 -9.232 172 1HD2 LEU 21 1HD2 LEU 21 -26.291 28.983 -6.997 173 2HD2 LEU 21 2HD2 LEU 21 -27.404 28.259 -5.834 174 3HD2 LEU 21 3HD2 LEU 21 -28.031 29.192 -7.193 175 H GLU 22 H GLU 22 -25.859 22.976 -5.477 176 HA GLU 22 HA GLU 22 -24.296 24.704 -3.728 177 1HB GLU 22 1HB GLU 22 -25.835 22.317 -3.377 178 2HB GLU 22 2HB GLU 22 -24.183 22.014 -2.854 179 1HG GLU 22 1HG GLU 22 -25.769 24.394 -1.940 180 2HG GLU 22 2HG GLU 22 -25.777 22.846 -1.093 181 H ARG 23 H ARG 23 -22.125 24.311 -3.216 182 HA ARG 23 HA ARG 23 -20.670 22.388 -4.862 183 1HB ARG 23 1HB ARG 23 -20.678 25.264 -5.299 184 2HB ARG 23 2HB ARG 23 -19.061 24.663 -4.964 185 1HG ARG 23 1HG ARG 23 -18.974 24.230 -7.147 186 2HG ARG 23 2HG ARG 23 -19.981 22.833 -6.767 187 1HD ARG 23 1HD ARG 23 -20.946 24.059 -8.610 188 2HD ARG 23 2HD ARG 23 -21.988 24.192 -7.194 189 HE ARG 23 HE ARG 23 -20.098 26.362 -7.531 190 1HH1 ARG 23 1HH1 ARG 23 -23.306 25.172 -8.316 191 2HH1 ARG 23 2HH1 ARG 23 -23.974 26.765 -8.513 192 1HH2 ARG 23 1HH2 ARG 23 -20.989 28.449 -7.816 193 2HH2 ARG 23 2HH2 ARG 23 -22.672 28.619 -8.225 194 H VAL 24 H VAL 24 -18.652 21.800 -4.001 195 HA VAL 24 HA VAL 24 -18.425 22.252 -1.148 196 HB VAL 24 HB VAL 24 -16.532 20.661 -2.881 197 1HG1 VAL 24 1HG1 VAL 24 -15.720 21.161 -0.641 198 2HG1 VAL 24 2HG1 VAL 24 -16.088 19.444 -0.801 199 3HG1 VAL 24 3HG1 VAL 24 -17.202 20.506 0.057 200 1HG2 VAL 24 1HG2 VAL 24 -18.023 19.031 -3.132 201 2HG2 VAL 24 2HG2 VAL 24 -19.251 20.155 -2.551 202 3HG2 VAL 24 3HG2 VAL 24 -18.443 19.071 -1.420 203 H VAL 25 H VAL 25 -17.949 24.513 -1.234 204 HA VAL 25 HA VAL 25 -15.423 25.337 -2.400 205 HB VAL 25 HB VAL 25 -17.464 26.884 -0.786 206 1HG1 VAL 25 1HG1 VAL 25 -14.758 27.551 -1.570 207 2HG1 VAL 25 2HG1 VAL 25 -15.865 28.405 -0.494 208 3HG1 VAL 25 3HG1 VAL 25 -15.933 28.687 -2.235 209 1HG2 VAL 25 1HG2 VAL 25 -18.066 26.036 -3.121 210 2HG2 VAL 25 2HG2 VAL 25 -16.869 27.186 -3.714 211 3HG2 VAL 25 3HG2 VAL 25 -18.269 27.759 -2.809 212 H THR 26 H THR 26 -16.837 24.692 0.736 213 HA THR 26 HA THR 26 -14.501 25.527 2.206 214 HB THR 26 HB THR 26 -16.247 23.870 3.764 215 HG1 THR 26 HG1 THR 26 -17.801 25.987 2.886 216 1HG2 THR 26 1HG2 THR 26 -16.500 25.848 5.088 217 2HG2 THR 26 2HG2 THR 26 -16.010 26.879 3.746 218 3HG2 THR 26 3HG2 THR 26 -14.834 25.809 4.509 219 H ALA 27 H ALA 27 -13.354 23.917 0.590 220 HA ALA 27 HA ALA 27 -13.221 21.261 1.850 221 1HB ALA 27 1HB ALA 27 -13.802 20.953 -0.406 222 2HB ALA 27 2HB ALA 27 -12.073 20.617 -0.332 223 3HB ALA 27 3HB ALA 27 -12.644 22.164 -0.955 224 HA PRO 28 HA PRO 28 -9.299 22.887 3.317 225 1HB PRO 28 1HB PRO 28 -8.758 20.823 4.989 226 2HB PRO 28 2HB PRO 28 -9.898 22.111 5.395 227 1HG PRO 28 1HG PRO 28 -10.449 19.353 4.369 228 2HG PRO 28 2HG PRO 28 -11.286 20.268 5.639 229 1HD PRO 28 1HD PRO 28 -12.246 20.045 3.111 230 2HD PRO 28 2HD PRO 28 -12.534 21.468 4.130 231 H VAL 29 H VAL 29 -7.250 22.572 2.636 232 HA VAL 29 HA VAL 29 -6.713 20.645 0.624 233 HB VAL 29 HB VAL 29 -5.593 22.790 0.575 234 1HG1 VAL 29 1HG1 VAL 29 -5.488 22.849 3.171 235 2HG1 VAL 29 2HG1 VAL 29 -4.251 23.677 2.227 236 3HG1 VAL 29 3HG1 VAL 29 -3.908 22.103 2.944 237 1HG2 VAL 29 1HG2 VAL 29 -4.441 20.539 -0.120 238 2HG2 VAL 29 2HG2 VAL 29 -3.332 20.957 1.188 239 3HG2 VAL 29 3HG2 VAL 29 -3.555 22.065 -0.168 240 H SER 30 H SER 30 -5.884 18.654 0.757 241 HA SER 30 HA SER 30 -5.130 17.698 3.438 242 1HB SER 30 1HB SER 30 -5.965 15.760 1.350 243 2HB SER 30 2HB SER 30 -6.325 15.780 3.077 244 HG SER 30 HG SER 30 -7.633 17.054 0.948 245 H SER 31 H SER 31 -3.446 18.873 1.257 246 HA SER 31 HA SER 31 -1.403 18.592 0.311 247 1HB SER 31 1HB SER 31 -1.024 16.231 2.151 248 2HB SER 31 2HB SER 31 0.202 17.332 1.526 249 HG SER 31 HG SER 31 -1.701 18.693 2.891 250 H GLY 32 H GLY 32 -2.684 17.899 -1.595 251 1HA GLY 32 1HA GLY 32 -2.819 15.061 -2.164 252 2HA GLY 32 2HA GLY 32 -3.314 16.370 -3.229 253 H LYS 33 H LYS 33 -0.253 15.440 -1.701 254 HA LYS 33 HA LYS 33 0.994 15.527 -4.367 255 1HB LYS 33 1HB LYS 33 3.114 15.798 -2.690 256 2HB LYS 33 2HB LYS 33 2.265 17.147 -3.428 257 1HG LYS 33 1HG LYS 33 1.028 17.568 -1.453 258 2HG LYS 33 2HG LYS 33 1.538 16.042 -0.731 259 1HD LYS 33 1HD LYS 33 3.891 16.897 -0.803 260 2HD LYS 33 2HD LYS 33 3.238 18.460 -1.293 261 1HE LYS 33 1HE LYS 33 3.180 18.886 0.912 262 2HE LYS 33 2HE LYS 33 1.717 17.902 0.890 263 1HZ LYS 33 1HZ LYS 33 3.666 16.053 1.127 264 2HZ LYS 33 2HZ LYS 33 2.779 16.693 2.420 265 3HZ LYS 33 3HZ LYS 33 4.300 17.337 2.035 266 H ILE 34 H ILE 34 -0.080 13.258 -4.054 267 HA ILE 34 HA ILE 34 1.863 11.439 -2.795 268 HB ILE 34 HB ILE 34 -0.962 10.649 -3.390 269 1HG1 ILE 34 1HG1 ILE 34 -0.663 11.497 -0.646 270 2HG1 ILE 34 2HG1 ILE 34 -0.342 12.837 -1.742 271 1HG2 ILE 34 1HG2 ILE 34 1.028 9.850 -1.268 272 2HG2 ILE 34 2HG2 ILE 34 0.576 8.918 -2.696 273 3HG2 ILE 34 3HG2 ILE 34 -0.608 9.203 -1.420 274 1HD1 ILE 34 1HD1 ILE 34 -2.715 12.585 -0.962 275 2HD1 ILE 34 2HD1 ILE 34 -2.797 11.121 -1.938 276 3HD1 ILE 34 3HD1 ILE 34 -2.490 12.677 -2.707 277 H LYS 35 H LYS 35 2.545 9.671 -3.909 278 HA LYS 35 HA LYS 35 1.683 9.412 -6.716 279 1HB LYS 35 1HB LYS 35 4.472 8.798 -5.745 280 2HB LYS 35 2HB LYS 35 3.918 9.029 -7.400 281 1HG LYS 35 1HG LYS 35 3.500 11.356 -5.689 282 2HG LYS 35 2HG LYS 35 5.195 10.897 -5.881 283 1HD LYS 35 1HD LYS 35 4.831 12.355 -7.655 284 2HD LYS 35 2HD LYS 35 4.643 10.764 -8.394 285 1HE LYS 35 1HE LYS 35 2.362 10.987 -8.608 286 2HE LYS 35 2HE LYS 35 2.244 12.150 -7.287 287 1HZ LYS 35 1HZ LYS 35 1.889 13.238 -9.398 288 2HZ LYS 35 2HZ LYS 35 3.374 12.671 -9.986 289 3HZ LYS 35 3HZ LYS 35 3.338 13.794 -8.712 290 H ARG 36 H ARG 36 1.862 7.228 -7.583 291 HA ARG 36 HA ARG 36 1.648 5.207 -5.443 292 1HB ARG 36 1HB ARG 36 0.169 5.422 -8.067 293 2HB ARG 36 2HB ARG 36 0.126 3.994 -7.039 294 1HG ARG 36 1HG ARG 36 -0.922 5.217 -5.274 295 2HG ARG 36 2HG ARG 36 -0.722 6.737 -6.148 296 1HD ARG 36 1HD ARG 36 -2.842 6.332 -6.792 297 2HD ARG 36 2HD ARG 36 -2.060 5.303 -7.992 298 HE ARG 36 HE ARG 36 -3.154 4.311 -5.431 299 1HH1 ARG 36 1HH1 ARG 36 -2.527 3.941 -8.859 300 2HH1 ARG 36 2HH1 ARG 36 -3.274 2.375 -8.956 301 1HH2 ARG 36 1HH2 ARG 36 -4.111 2.230 -5.557 302 2HH2 ARG 36 2HH2 ARG 36 -4.163 1.402 -7.093 303 H VAL 37 H VAL 37 2.850 3.416 -5.568 304 HA VAL 37 HA VAL 37 4.160 2.734 -8.099 305 HB VAL 37 HB VAL 37 5.496 3.752 -5.709 306 1HG1 VAL 37 1HG1 VAL 37 5.851 1.284 -5.402 307 2HG1 VAL 37 2HG1 VAL 37 7.322 2.245 -5.565 308 3HG1 VAL 37 3HG1 VAL 37 6.732 1.294 -6.931 309 1HG2 VAL 37 1HG2 VAL 37 6.933 3.134 -8.228 310 2HG2 VAL 37 2HG2 VAL 37 6.979 4.579 -7.218 311 3HG2 VAL 37 3HG2 VAL 37 5.613 4.303 -8.300 312 H ASN 38 H ASN 38 4.062 0.614 -8.515 313 HA ASN 38 HA ASN 38 3.214 -1.161 -6.322 314 1HB ASN 38 1HB ASN 38 1.621 -0.952 -8.222 315 2HB ASN 38 2HB ASN 38 2.866 -1.565 -9.305 316 1HD2 ASN 38 1HD2 ASN 38 0.335 -2.368 -7.233 317 2HD2 ASN 38 2HD2 ASN 38 0.584 -4.085 -7.172 318 H VAL 39 H VAL 39 4.497 -2.790 -5.725 319 HA VAL 39 HA VAL 39 6.868 -3.324 -7.402 320 HB VAL 39 HB VAL 39 7.196 -3.884 -4.550 321 1HG1 VAL 39 1HG1 VAL 39 8.876 -2.140 -6.328 322 2HG1 VAL 39 2HG1 VAL 39 8.925 -3.900 -6.415 323 3HG1 VAL 39 3HG1 VAL 39 9.371 -3.078 -4.920 324 1HG2 VAL 39 1HG2 VAL 39 7.023 -0.995 -5.393 325 2HG2 VAL 39 2HG2 VAL 39 7.395 -1.622 -3.787 326 3HG2 VAL 39 3HG2 VAL 39 5.781 -1.833 -4.468 327 H ASN 40 H ASN 40 7.755 -5.410 -7.345 328 HA ASN 40 HA ASN 40 5.952 -7.523 -6.359 329 1HB ASN 40 1HB ASN 40 6.276 -7.197 -8.920 330 2HB ASN 40 2HB ASN 40 7.868 -7.895 -8.650 331 1HD2 ASN 40 1HD2 ASN 40 7.208 -9.578 -10.064 332 2HD2 ASN 40 2HD2 ASN 40 6.216 -10.874 -9.476 333 H PHE 41 H PHE 41 6.839 -8.374 -4.588 334 HA PHE 41 HA PHE 41 9.771 -8.419 -4.348 335 1HB PHE 41 1HB PHE 41 7.672 -8.793 -2.205 336 2HB PHE 41 2HB PHE 41 9.404 -8.660 -1.945 337 HD1 PHE 41 HD1 PHE 41 10.465 -6.436 -2.973 338 HD2 PHE 41 HD2 PHE 41 6.395 -6.950 -1.838 339 HE1 PHE 41 HE1 PHE 41 10.226 -3.999 -2.725 340 HE2 PHE 41 HE2 PHE 41 6.152 -4.516 -1.586 341 HZ PHE 41 HZ PHE 41 8.068 -3.037 -2.028 342 H ASP 42 H ASP 42 10.855 -10.218 -3.548 343 HA ASP 42 HA ASP 42 10.082 -12.793 -4.388 344 1HB ASP 42 1HB ASP 42 12.420 -11.989 -3.822 345 2HB ASP 42 2HB ASP 42 11.980 -12.113 -2.128 346 H GLU 43 H GLU 43 9.309 -14.566 -3.190 347 HA GLU 43 HA GLU 43 7.296 -14.081 -1.292 348 1HB GLU 43 1HB GLU 43 8.551 -16.394 -2.534 349 2HB GLU 43 2HB GLU 43 8.151 -16.697 -0.848 350 1HG GLU 43 1HG GLU 43 6.066 -15.426 -2.507 351 2HG GLU 43 2HG GLU 43 6.446 -17.113 -2.848 352 H GLU 44 H GLU 44 10.681 -14.894 -1.004 353 HA GLU 44 HA GLU 44 10.925 -15.326 1.732 354 1HB GLU 44 1HB GLU 44 12.642 -15.348 -0.299 355 2HB GLU 44 2HB GLU 44 12.994 -13.734 0.305 356 1HG GLU 44 1HG GLU 44 14.439 -15.628 1.166 357 2HG GLU 44 2HG GLU 44 13.738 -14.555 2.373 358 H LYS 45 H LYS 45 11.393 -12.285 -0.060 359 HA LYS 45 HA LYS 45 11.765 -10.644 2.168 360 1HB LYS 45 1HB LYS 45 10.754 -10.029 -0.605 361 2HB LYS 45 2HB LYS 45 11.039 -8.785 0.602 362 1HG LYS 45 1HG LYS 45 13.393 -9.457 0.722 363 2HG LYS 45 2HG LYS 45 13.096 -10.659 -0.538 364 1HD LYS 45 1HD LYS 45 13.069 -9.119 -2.171 365 2HD LYS 45 2HD LYS 45 12.164 -7.963 -1.192 366 1HE LYS 45 1HE LYS 45 14.007 -6.831 -0.724 367 2HE LYS 45 2HE LYS 45 14.807 -8.289 -0.132 368 1HZ LYS 45 1HZ LYS 45 16.132 -7.584 -1.895 369 2HZ LYS 45 2HZ LYS 45 14.802 -7.173 -2.869 370 3HZ LYS 45 3HZ LYS 45 15.180 -8.801 -2.595 371 H HIS 46 H HIS 46 8.820 -11.623 0.478 372 HA HIS 46 HA HIS 46 7.190 -9.734 1.850 373 1HB HIS 46 1HB HIS 46 6.721 -11.041 -0.370 374 2HB HIS 46 2HB HIS 46 6.005 -12.229 0.717 375 HD1 HIS 46 HD1 HIS 46 3.727 -11.690 1.699 376 HD2 HIS 46 HD2 HIS 46 5.426 -8.489 -0.341 377 HE1 HIS 46 HE1 HIS 46 1.932 -9.935 1.576 378 HE2 HIS 46 HE2 HIS 46 2.896 -8.137 0.100 379 H THR 47 H THR 47 8.014 -13.103 2.443 380 HA THR 47 HA THR 47 6.192 -13.495 4.583 381 HB THR 47 HB THR 47 8.843 -14.875 4.107 382 HG1 THR 47 HG1 THR 47 7.829 -16.088 2.662 383 1HG2 THR 47 1HG2 THR 47 7.681 -15.116 6.375 384 2HG2 THR 47 2HG2 THR 47 8.090 -16.600 5.514 385 3HG2 THR 47 3HG2 THR 47 6.431 -16.002 5.502 386 H ARG 48 H ARG 48 9.560 -12.411 4.402 387 HA ARG 48 HA ARG 48 9.868 -12.046 7.220 388 1HB ARG 48 1HB ARG 48 11.519 -11.850 4.931 389 2HB ARG 48 2HB ARG 48 11.570 -10.283 5.731 390 1HG ARG 48 1HG ARG 48 11.907 -11.798 7.871 391 2HG ARG 48 2HG ARG 48 12.530 -12.927 6.668 392 1HD ARG 48 1HD ARG 48 13.602 -10.361 6.113 393 2HD ARG 48 2HD ARG 48 13.814 -10.679 7.835 394 HE ARG 48 HE ARG 48 14.863 -12.356 5.634 395 1HH1 ARG 48 1HH1 ARG 48 14.840 -11.399 9.004 396 2HH1 ARG 48 2HH1 ARG 48 16.339 -12.208 9.374 397 1HH2 ARG 48 1HH2 ARG 48 16.804 -13.471 6.137 398 2HH2 ARG 48 2HH2 ARG 48 17.447 -13.388 7.750 399 H PHE 49 H PHE 49 8.657 -10.097 4.589 400 HA PHE 49 HA PHE 49 8.661 -7.558 5.752 401 1HB PHE 49 1HB PHE 49 7.437 -8.846 3.499 402 2HB PHE 49 2HB PHE 49 6.231 -7.860 4.314 403 HD1 PHE 49 HD1 PHE 49 9.357 -6.435 4.920 404 HD2 PHE 49 HD2 PHE 49 6.421 -6.875 1.877 405 HE1 PHE 49 HE1 PHE 49 10.235 -4.436 3.790 406 HE2 PHE 49 HE2 PHE 49 7.287 -4.874 0.740 407 HZ PHE 49 HZ PHE 49 9.199 -3.651 1.696 408 H LYS 50 H LYS 50 6.134 -10.033 5.746 409 HA LYS 50 HA LYS 50 4.309 -8.702 7.402 410 1HB LYS 50 1HB LYS 50 4.706 -11.682 7.069 411 2HB LYS 50 2HB LYS 50 3.262 -10.895 7.691 412 1HG LYS 50 1HG LYS 50 4.307 -10.327 4.937 413 2HG LYS 50 2HG LYS 50 3.229 -11.684 5.269 414 1HD LYS 50 1HD LYS 50 2.471 -8.979 6.259 415 2HD LYS 50 2HD LYS 50 2.287 -9.333 4.540 416 1HE LYS 50 1HE LYS 50 0.243 -10.021 5.274 417 2HE LYS 50 2HE LYS 50 1.144 -11.521 5.486 418 1HZ LYS 50 1HZ LYS 50 1.163 -9.683 7.745 419 2HZ LYS 50 2HZ LYS 50 1.047 -11.375 7.719 420 3HZ LYS 50 3HZ LYS 50 -0.323 -10.428 7.397 421 H ALA 51 H ALA 51 6.882 -11.009 8.145 422 HA ALA 51 HA ALA 51 6.342 -11.229 10.905 423 1HB ALA 51 1HB ALA 51 7.682 -12.929 10.180 424 2HB ALA 51 2HB ALA 51 8.897 -11.865 10.885 425 3HB ALA 51 3HB ALA 51 8.646 -11.880 9.139 426 H ALA 52 H ALA 52 8.698 -9.220 9.135 427 HA ALA 52 HA ALA 52 9.759 -7.991 11.432 428 1HB ALA 52 1HB ALA 52 10.922 -8.064 9.281 429 2HB ALA 52 2HB ALA 52 10.804 -6.421 9.911 430 3HB ALA 52 3HB ALA 52 9.734 -6.945 8.610 431 H CYS 53 H CYS 53 7.276 -6.850 9.121 432 HA CYS 53 HA CYS 53 6.906 -4.343 10.275 433 1HB CYS 53 1HB CYS 53 5.001 -4.121 8.920 434 2HB CYS 53 2HB CYS 53 6.048 -5.211 8.024 435 HG CYS 53 HG CYS 53 3.025 -5.772 9.394 436 H ALA 54 H ALA 54 5.386 -7.450 11.009 437 HA ALA 54 HA ALA 54 3.487 -6.447 12.862 438 1HB ALA 54 1HB ALA 54 2.907 -8.553 12.193 439 2HB ALA 54 2HB ALA 54 3.722 -8.944 13.708 440 3HB ALA 54 3HB ALA 54 4.577 -9.125 12.176 441 H ARG 55 H ARG 55 6.809 -7.575 13.159 442 HA ARG 55 HA ARG 55 6.915 -7.593 15.985 443 1HB ARG 55 1HB ARG 55 8.535 -8.752 14.490 444 2HB ARG 55 2HB ARG 55 9.192 -7.184 14.040 445 1HG ARG 55 1HG ARG 55 9.606 -6.856 16.546 446 2HG ARG 55 2HG ARG 55 9.340 -8.595 16.678 447 1HD ARG 55 1HD ARG 55 11.245 -9.110 15.511 448 2HD ARG 55 2HD ARG 55 11.238 -7.593 14.617 449 HE ARG 55 HE ARG 55 11.959 -6.526 16.752 450 1HH1 ARG 55 1HH1 ARG 55 12.559 -9.932 16.165 451 2HH1 ARG 55 2HH1 ARG 55 13.956 -9.993 17.208 452 1HH2 ARG 55 1HH2 ARG 55 13.745 -6.627 18.182 453 2HH2 ARG 55 2HH2 ARG 55 14.597 -8.136 18.391 454 H LYS 56 H LYS 56 7.302 -5.079 13.600 455 HA LYS 56 HA LYS 56 8.349 -3.194 15.547 456 1HB LYS 56 1HB LYS 56 7.679 -2.931 12.614 457 2HB LYS 56 2HB LYS 56 8.306 -1.613 13.594 458 1HG LYS 56 1HG LYS 56 10.394 -2.594 13.805 459 2HG LYS 56 2HG LYS 56 9.784 -4.204 13.422 460 1HD LYS 56 1HD LYS 56 10.209 -3.909 11.257 461 2HD LYS 56 2HD LYS 56 9.286 -2.408 11.234 462 1HE LYS 56 1HE LYS 56 11.822 -2.392 10.628 463 2HE LYS 56 2HE LYS 56 11.140 -1.100 11.616 464 1HZ LYS 56 1HZ LYS 56 12.089 -1.958 13.536 465 2HZ LYS 56 2HZ LYS 56 13.308 -2.178 12.381 466 3HZ LYS 56 3HZ LYS 56 12.348 -3.493 12.863 467 H GLY 57 H GLY 57 5.318 -4.185 14.346 468 1HA GLY 57 1HA GLY 57 3.182 -3.440 14.883 469 2HA GLY 57 2HA GLY 57 3.907 -2.169 15.865 470 H THR 58 H THR 58 4.007 -3.107 12.452 471 HA THR 58 HA THR 58 3.215 -0.385 11.681 472 HB THR 58 HB THR 58 5.638 -1.839 10.597 473 HG1 THR 58 HG1 THR 58 5.340 -0.349 12.818 474 1HG2 THR 58 1HG2 THR 58 5.592 -0.378 8.930 475 2HG2 THR 58 2HG2 THR 58 5.678 0.950 10.088 476 3HG2 THR 58 3HG2 THR 58 4.110 0.326 9.575 477 H SER 59 H SER 59 1.971 -0.304 9.844 478 HA SER 59 HA SER 59 0.934 -2.695 8.716 479 1HB SER 59 1HB SER 59 0.675 -0.366 6.996 480 2HB SER 59 2HB SER 59 -0.579 -1.288 7.824 481 HG SER 59 HG SER 59 -0.042 1.089 8.392 482 H ILE 60 H ILE 60 1.468 -3.768 6.852 483 HA ILE 60 HA ILE 60 4.112 -3.784 6.044 484 HB ILE 60 HB ILE 60 2.618 -5.673 5.667 485 1HG1 ILE 60 1HG1 ILE 60 3.444 -4.954 2.896 486 2HG1 ILE 60 2HG1 ILE 60 4.692 -5.004 4.137 487 1HG2 ILE 60 1HG2 ILE 60 1.016 -3.721 4.307 488 2HG2 ILE 60 2HG2 ILE 60 0.599 -5.361 4.807 489 3HG2 ILE 60 3HG2 ILE 60 1.354 -5.079 3.237 490 1HD1 ILE 60 1HD1 ILE 60 4.196 -7.300 4.613 491 2HD1 ILE 60 2HD1 ILE 60 4.457 -7.109 2.880 492 3HD1 ILE 60 3HD1 ILE 60 2.818 -7.270 3.512 493 H THR 61 H THR 61 1.424 -1.936 4.744 494 HA THR 61 HA THR 61 2.705 -1.021 2.407 495 HB THR 61 HB THR 61 0.826 0.885 3.476 496 HG1 THR 61 HG1 THR 61 -0.933 -0.533 3.730 497 1HG2 THR 61 1HG2 THR 61 -0.495 -0.154 1.461 498 2HG2 THR 61 2HG2 THR 61 1.048 -0.931 1.116 499 3HG2 THR 61 3HG2 THR 61 0.940 0.827 1.170 500 H ASP 62 H ASP 62 2.442 0.284 5.689 501 HA ASP 62 HA ASP 62 3.836 2.712 5.111 502 1HB ASP 62 1HB ASP 62 2.225 2.057 7.123 503 2HB ASP 62 2HB ASP 62 3.751 1.623 7.886 504 H VAL 63 H VAL 63 4.732 -0.500 6.058 505 HA VAL 63 HA VAL 63 7.354 0.006 6.975 506 HB VAL 63 HB VAL 63 5.751 -2.322 6.310 507 1HG1 VAL 63 1HG1 VAL 63 8.606 -3.013 6.029 508 2HG1 VAL 63 2HG1 VAL 63 7.836 -2.277 4.623 509 3HG1 VAL 63 3HG1 VAL 63 7.178 -3.761 5.313 510 1HG2 VAL 63 1HG2 VAL 63 6.242 -2.194 8.520 511 2HG2 VAL 63 2HG2 VAL 63 7.841 -1.504 8.242 512 3HG2 VAL 63 3HG2 VAL 63 7.573 -3.232 8.006 513 H VAL 64 H VAL 64 6.027 -0.597 3.740 514 HA VAL 64 HA VAL 64 8.556 -0.573 2.429 515 HB VAL 64 HB VAL 64 6.002 0.258 1.082 516 1HG1 VAL 64 1HG1 VAL 64 7.575 0.386 -0.537 517 2HG1 VAL 64 2HG1 VAL 64 7.282 -1.350 -0.640 518 3HG1 VAL 64 3HG1 VAL 64 8.661 -0.742 0.277 519 1HG2 VAL 64 1HG2 VAL 64 6.496 -2.560 0.817 520 2HG2 VAL 64 2HG2 VAL 64 5.035 -1.728 1.350 521 3HG2 VAL 64 3HG2 VAL 64 6.293 -2.135 2.517 522 H ASN 65 H ASN 65 6.091 1.870 3.104 523 HA ASN 65 HA ASN 65 7.279 4.042 1.789 524 1HB ASN 65 1HB ASN 65 5.032 3.662 3.331 525 2HB ASN 65 2HB ASN 65 6.012 4.720 4.340 526 1HD2 ASN 65 1HD2 ASN 65 3.510 5.223 2.951 527 2HD2 ASN 65 2HD2 ASN 65 3.805 6.559 1.888 528 H GLN 66 H GLN 66 7.956 2.548 4.869 529 HA GLN 66 HA GLN 66 9.607 4.604 5.917 530 1HB GLN 66 1HB GLN 66 8.541 2.903 7.325 531 2HB GLN 66 2HB GLN 66 9.520 1.654 6.567 532 1HG GLN 66 1HG GLN 66 11.544 2.836 7.423 533 2HG GLN 66 2HG GLN 66 10.466 3.901 8.322 534 1HE2 GLN 66 1HE2 GLN 66 8.885 2.773 9.743 535 2HE2 GLN 66 2HE2 GLN 66 9.442 1.381 10.620 536 H LEU 67 H LEU 67 10.340 1.552 4.206 537 HA LEU 67 HA LEU 67 13.150 1.962 4.326 538 1HB LEU 67 1HB LEU 67 13.164 0.225 2.432 539 2HB LEU 67 2HB LEU 67 12.628 -0.262 4.027 540 HG LEU 67 HG LEU 67 10.269 0.457 2.855 541 1HD1 LEU 67 1HD1 LEU 67 11.534 0.757 0.702 542 2HD1 LEU 67 2HD1 LEU 67 10.177 -0.368 0.642 543 3HD1 LEU 67 3HD1 LEU 67 11.829 -0.984 0.728 544 1HD2 LEU 67 1HD2 LEU 67 9.946 -1.542 3.759 545 2HD2 LEU 67 2HD2 LEU 67 11.656 -1.950 3.627 546 3HD2 LEU 67 3HD2 LEU 67 10.573 -2.240 2.265 547 H VAL 68 H VAL 68 10.672 2.814 1.983 548 HA VAL 68 HA VAL 68 12.331 3.569 -0.162 549 HB VAL 68 HB VAL 68 9.687 4.786 0.677 550 1HG1 VAL 68 1HG1 VAL 68 11.545 5.557 -1.349 551 2HG1 VAL 68 2HG1 VAL 68 9.974 6.258 -0.957 552 3HG1 VAL 68 3HG1 VAL 68 10.082 4.932 -2.115 553 1HG2 VAL 68 1HG2 VAL 68 8.869 2.794 0.090 554 2HG2 VAL 68 2HG2 VAL 68 10.394 2.283 -0.633 555 3HG2 VAL 68 3HG2 VAL 68 9.256 3.256 -1.566 556 H ASP 69 H ASP 69 10.934 5.486 2.462 557 HA ASP 69 HA ASP 69 12.229 7.909 1.867 558 1HB ASP 69 1HB ASP 69 10.280 7.802 3.314 559 2HB ASP 69 2HB ASP 69 11.163 6.827 4.483 560 H ASN 70 H ASN 70 13.150 5.164 3.883 561 HA ASN 70 HA ASN 70 15.382 6.277 5.142 562 1HB ASN 70 1HB ASN 70 14.248 3.629 4.766 563 2HB ASN 70 2HB ASN 70 16.008 3.590 4.781 564 1HD2 ASN 70 1HD2 ASN 70 13.151 4.104 6.594 565 2HD2 ASN 70 2HD2 ASN 70 13.902 4.272 8.151 566 H TRP 71 H TRP 71 15.465 3.989 2.402 567 HA TRP 71 HA TRP 71 18.193 4.288 1.869 568 1HB TRP 71 1HB TRP 71 16.683 2.449 1.045 569 2HB TRP 71 2HB TRP 71 16.060 3.573 -0.153 570 HD1 TRP 71 HD1 TRP 71 19.210 1.560 0.712 571 HE1 TRP 71 HE1 TRP 71 20.699 1.414 -1.388 572 HE3 TRP 71 HE3 TRP 71 16.608 4.712 -2.371 573 HZ2 TRP 71 HZ2 TRP 71 20.743 2.456 -3.997 574 HZ3 TRP 71 HZ3 TRP 71 17.436 5.060 -4.660 575 HH2 TRP 71 HH2 TRP 71 19.458 3.959 -5.451 576 H LEU 72 H LEU 72 15.402 5.992 0.552 577 HA LEU 72 HA LEU 72 16.853 7.411 -1.421 578 1HB LEU 72 1HB LEU 72 14.212 7.000 -0.832 579 2HB LEU 72 2HB LEU 72 14.420 8.698 -0.437 580 HG LEU 72 HG LEU 72 15.256 9.134 -2.699 581 1HD1 LEU 72 1HD1 LEU 72 15.470 6.270 -2.757 582 2HD1 LEU 72 2HD1 LEU 72 16.123 7.466 -3.878 583 3HD1 LEU 72 3HD1 LEU 72 14.489 6.845 -4.107 584 1HD2 LEU 72 1HD2 LEU 72 13.148 9.525 -3.254 585 2HD2 LEU 72 2HD2 LEU 72 12.626 8.450 -1.957 586 3HD2 LEU 72 3HD2 LEU 72 12.889 7.810 -3.579 587 H LYS 73 H LYS 73 16.357 7.996 1.978 588 HA LYS 73 HA LYS 73 17.251 10.757 1.666 589 1HB LYS 73 1HB LYS 73 16.108 9.209 3.968 590 2HB LYS 73 2HB LYS 73 16.921 10.747 4.230 591 1HG LYS 73 1HG LYS 73 15.186 11.306 2.172 592 2HG LYS 73 2HG LYS 73 14.268 10.185 3.181 593 1HD LYS 73 1HD LYS 73 15.664 12.658 4.203 594 2HD LYS 73 2HD LYS 73 13.952 12.582 3.780 595 1HE LYS 73 1HE LYS 73 14.878 10.482 5.613 596 2HE LYS 73 2HE LYS 73 14.951 12.119 6.261 597 1HZ LYS 73 1HZ LYS 73 12.840 11.274 6.800 598 2HZ LYS 73 2HZ LYS 73 12.577 10.674 5.235 599 3HZ LYS 73 3HZ LYS 73 12.576 12.347 5.513 600 H GLU 74 H GLU 74 18.407 7.668 2.808 601 HA GLU 74 HA GLU 74 20.716 8.866 4.078 602 1HB GLU 74 1HB GLU 74 19.598 6.107 3.883 603 2HB GLU 74 2HB GLU 74 21.287 6.310 4.325 604 1HG GLU 74 1HG GLU 74 20.113 8.099 5.976 605 2HG GLU 74 2HG GLU 74 18.852 6.872 5.855 606 H ASN 75 H ASN 75 20.068 6.900 1.198 607 HA ASN 75 HA ASN 75 22.889 6.794 0.535 608 1HB ASN 75 1HB ASN 75 21.961 4.839 -0.196 609 2HB ASN 75 2HB ASN 75 20.395 5.573 -0.522 610 1HD2 ASN 75 1HD2 ASN 75 19.898 6.097 -2.551 611 2HD2 ASN 75 2HD2 ASN 75 20.978 6.003 -3.899 612 H GLU 76 H GLU 76 20.022 8.541 -0.487 613 HA GLU 76 HA GLU 76 21.462 9.836 -2.648 614 1HB GLU 76 1HB GLU 76 18.637 9.649 -1.786 615 2HB GLU 76 2HB GLU 76 19.108 11.157 -2.558 616 1HG GLU 76 1HG GLU 76 19.313 8.383 -3.706 617 2HG GLU 76 2HG GLU 76 18.222 9.673 -4.212 618 1H MET 1 1H MET 1 -29.384 -15.771 -64.936 619 2H MET 1 2H MET 1 -30.385 -14.977 -66.049 620 3H MET 1 3H MET 1 -28.745 -14.566 -65.941 621 HA MET 1 HA MET 1 -29.338 -15.982 -67.886 622 1HB MET 1 1HB MET 1 -27.137 -16.010 -66.153 623 2HB MET 1 2HB MET 1 -27.497 -17.705 -66.443 624 1HG MET 1 1HG MET 1 -27.178 -15.706 -68.658 625 2HG MET 1 2HG MET 1 -25.836 -16.639 -68.001 626 1HE MET 1 1HE MET 1 -27.463 -16.078 -70.650 627 2HE MET 1 2HE MET 1 -28.490 -17.384 -71.238 628 3HE MET 1 3HE MET 1 -26.749 -17.447 -71.499 629 H SER 2 H SER 2 -29.703 -18.188 -68.579 630 HA SER 2 HA SER 2 -31.768 -19.508 -67.153 631 1HB SER 2 1HB SER 2 -30.579 -21.302 -68.997 632 2HB SER 2 2HB SER 2 -32.037 -20.333 -69.226 633 HG SER 2 HG SER 2 -29.868 -20.101 -70.593 634 H LEU 3 H LEU 3 -28.316 -19.935 -67.462 635 HA LEU 3 HA LEU 3 -28.295 -21.493 -65.025 636 1HB LEU 3 1HB LEU 3 -26.494 -22.996 -66.187 637 2HB LEU 3 2HB LEU 3 -28.196 -23.390 -66.316 638 HG LEU 3 HG LEU 3 -27.657 -21.718 -68.502 639 1HD1 LEU 3 1HD1 LEU 3 -25.731 -22.440 -69.525 640 2HD1 LEU 3 2HD1 LEU 3 -25.668 -23.934 -68.592 641 3HD1 LEU 3 3HD1 LEU 3 -25.226 -22.402 -67.837 642 1HD2 LEU 3 1HD2 LEU 3 -29.172 -23.750 -68.211 643 2HD2 LEU 3 2HD2 LEU 3 -27.744 -24.714 -68.599 644 3HD2 LEU 3 3HD2 LEU 3 -28.367 -23.551 -69.772 645 H GLU 4 H GLU 4 -26.924 -20.455 -63.763 646 HA GLU 4 HA GLU 4 -25.117 -18.522 -64.848 647 1HB GLU 4 1HB GLU 4 -26.439 -18.590 -62.554 648 2HB GLU 4 2HB GLU 4 -24.974 -19.380 -61.993 649 1HG GLU 4 1HG GLU 4 -24.679 -17.113 -61.507 650 2HG GLU 4 2HG GLU 4 -23.708 -17.411 -62.949 651 H LYS 5 H LYS 5 -23.020 -18.689 -65.265 652 HA LYS 5 HA LYS 5 -21.736 -21.244 -65.177 653 1HB LYS 5 1HB LYS 5 -21.399 -19.099 -66.754 654 2HB LYS 5 2HB LYS 5 -20.131 -18.774 -65.580 655 1HG LYS 5 1HG LYS 5 -18.936 -20.664 -66.149 656 2HG LYS 5 2HG LYS 5 -20.338 -21.460 -66.863 657 1HD LYS 5 1HD LYS 5 -20.056 -20.447 -68.860 658 2HD LYS 5 2HD LYS 5 -19.546 -18.923 -68.126 659 1HE LYS 5 1HE LYS 5 -17.437 -19.412 -68.599 660 2HE LYS 5 2HE LYS 5 -17.547 -20.838 -67.566 661 1HZ LYS 5 1HZ LYS 5 -18.642 -21.884 -69.654 662 2HZ LYS 5 2HZ LYS 5 -16.953 -21.740 -69.570 663 3HZ LYS 5 3HZ LYS 5 -17.855 -20.628 -70.483 664 H ALA 6 H ALA 6 -20.101 -21.942 -63.874 665 HA ALA 6 HA ALA 6 -18.794 -22.167 -62.025 666 1HB ALA 6 1HB ALA 6 -19.027 -19.380 -61.089 667 2HB ALA 6 2HB ALA 6 -18.285 -19.609 -62.676 668 3HB ALA 6 3HB ALA 6 -17.607 -20.411 -61.256 669 H HIS 7 H HIS 7 -18.980 -21.188 -59.472 670 HA HIS 7 HA HIS 7 -21.650 -20.897 -58.547 671 1HB HIS 7 1HB HIS 7 -21.996 -23.071 -57.519 672 2HB HIS 7 2HB HIS 7 -21.769 -23.273 -59.252 673 HD1 HIS 7 HD1 HIS 7 -20.550 -24.445 -56.028 674 HD2 HIS 7 HD2 HIS 7 -19.087 -24.256 -59.922 675 HE1 HIS 7 HE1 HIS 7 -18.581 -26.010 -56.094 676 HE2 HIS 7 HE2 HIS 7 -17.763 -25.952 -58.477 677 H THR 8 H THR 8 -21.724 -20.378 -56.390 678 HA THR 8 HA THR 8 -19.152 -19.891 -55.136 679 HB THR 8 HB THR 8 -21.297 -19.172 -53.416 680 HG1 THR 8 HG1 THR 8 -22.024 -17.643 -55.434 681 1HG2 THR 8 1HG2 THR 8 -20.566 -16.829 -54.166 682 2HG2 THR 8 2HG2 THR 8 -19.377 -17.658 -55.169 683 3HG2 THR 8 3HG2 THR 8 -19.346 -17.860 -53.418 684 H SER 9 H SER 9 -22.254 -21.269 -54.112 685 HA SER 9 HA SER 9 -22.851 -22.955 -52.746 686 1HB SER 9 1HB SER 9 -20.098 -24.081 -53.293 687 2HB SER 9 2HB SER 9 -21.530 -24.973 -52.780 688 HG SER 9 HG SER 9 -22.509 -24.152 -54.800 689 H VAL 10 H VAL 10 -23.146 -22.635 -50.675 690 HA VAL 10 HA VAL 10 -21.000 -21.666 -48.976 691 HB VAL 10 HB VAL 10 -23.625 -22.447 -47.809 692 1HG1 VAL 10 1HG1 VAL 10 -23.265 -20.548 -46.415 693 2HG1 VAL 10 2HG1 VAL 10 -21.982 -19.946 -47.463 694 3HG1 VAL 10 3HG1 VAL 10 -21.736 -21.419 -46.525 695 1HG2 VAL 10 1HG2 VAL 10 -24.738 -21.385 -49.463 696 2HG2 VAL 10 2HG2 VAL 10 -23.319 -20.481 -49.989 697 3HG2 VAL 10 3HG2 VAL 10 -24.236 -19.941 -48.582 698 H LYS 11 H LYS 11 -19.811 -23.704 -49.444 699 HA LYS 11 HA LYS 11 -20.728 -26.106 -48.145 700 1HB LYS 11 1HB LYS 11 -18.349 -26.882 -48.670 701 2HB LYS 11 2HB LYS 11 -19.388 -26.511 -50.037 702 1HG LYS 11 1HG LYS 11 -17.883 -24.185 -49.202 703 2HG LYS 11 2HG LYS 11 -16.827 -25.549 -49.572 704 1HD LYS 11 1HD LYS 11 -18.236 -25.790 -51.710 705 2HD LYS 11 2HD LYS 11 -18.800 -24.156 -51.351 706 1HE LYS 11 1HE LYS 11 -15.922 -24.365 -51.133 707 2HE LYS 11 2HE LYS 11 -16.485 -24.865 -52.727 708 1HZ LYS 11 1HZ LYS 11 -16.921 -22.253 -51.383 709 2HZ LYS 11 2HZ LYS 11 -17.777 -22.724 -52.768 710 3HZ LYS 11 3HZ LYS 11 -16.091 -22.555 -52.829 711 H LYS 12 H LYS 12 -20.583 -26.492 -46.058 712 HA LYS 12 HA LYS 12 -19.286 -24.724 -44.261 713 1HB LYS 12 1HB LYS 12 -21.310 -26.165 -43.772 714 2HB LYS 12 2HB LYS 12 -20.218 -27.539 -43.672 715 1HG LYS 12 1HG LYS 12 -19.086 -26.581 -41.790 716 2HG LYS 12 2HG LYS 12 -20.008 -25.085 -41.943 717 1HD LYS 12 1HD LYS 12 -20.855 -26.536 -40.142 718 2HD LYS 12 2HD LYS 12 -22.057 -26.254 -41.405 719 1HE LYS 12 1HE LYS 12 -21.899 -28.414 -42.219 720 2HE LYS 12 2HE LYS 12 -20.286 -28.659 -41.548 721 1HZ LYS 12 1HZ LYS 12 -21.321 -28.633 -39.317 722 2HZ LYS 12 2HZ LYS 12 -21.842 -29.922 -40.282 723 3HZ LYS 12 3HZ LYS 12 -22.849 -28.578 -40.052 724 H MET 13 H MET 13 -17.426 -25.020 -43.004 725 HA MET 13 HA MET 13 -15.627 -27.154 -43.956 726 1HB MET 13 1HB MET 13 -15.097 -24.704 -44.606 727 2HB MET 13 2HB MET 13 -14.643 -24.513 -42.917 728 1HG MET 13 1HG MET 13 -12.758 -25.729 -43.138 729 2HG MET 13 2HG MET 13 -13.469 -26.819 -44.326 730 1HE MET 13 1HE MET 13 -11.671 -22.687 -45.063 731 2HE MET 13 2HE MET 13 -12.472 -23.277 -43.609 732 3HE MET 13 3HE MET 13 -13.432 -22.722 -44.979 733 H THR 14 H THR 14 -15.794 -28.614 -42.370 734 HA THR 14 HA THR 14 -16.005 -27.869 -39.603 735 HB THR 14 HB THR 14 -15.630 -30.436 -39.358 736 HG1 THR 14 HG1 THR 14 -15.692 -31.580 -41.184 737 1HG2 THR 14 1HG2 THR 14 -17.761 -29.221 -39.020 738 2HG2 THR 14 2HG2 THR 14 -17.992 -30.819 -39.729 739 3HG2 THR 14 3HG2 THR 14 -18.093 -29.381 -40.745 740 H PHE 15 H PHE 15 -14.423 -27.765 -38.096 741 HA PHE 15 HA PHE 15 -11.706 -27.715 -38.947 742 1HB PHE 15 1HB PHE 15 -12.943 -26.442 -36.994 743 2HB PHE 15 2HB PHE 15 -12.459 -27.849 -36.054 744 HD1 PHE 15 HD1 PHE 15 -10.559 -27.568 -34.828 745 HD2 PHE 15 HD2 PHE 15 -10.886 -25.609 -38.591 746 HE1 PHE 15 HE1 PHE 15 -8.329 -26.588 -34.510 747 HE2 PHE 15 HE2 PHE 15 -8.655 -24.632 -38.283 748 HZ PHE 15 HZ PHE 15 -7.368 -25.115 -36.237 749 H GLY 16 H GLY 16 -13.255 -29.657 -36.398 750 1HA GLY 16 1HA GLY 16 -13.078 -31.911 -35.940 751 2HA GLY 16 2HA GLY 16 -12.148 -32.105 -37.419 752 H GLU 17 H GLU 17 -9.936 -30.786 -37.163 753 HA GLU 17 HA GLU 17 -8.528 -32.175 -35.070 754 1HB GLU 17 1HB GLU 17 -7.211 -30.139 -36.822 755 2HB GLU 17 2HB GLU 17 -6.580 -31.663 -36.216 756 1HG GLU 17 1HG GLU 17 -8.610 -31.316 -38.413 757 2HG GLU 17 2HG GLU 17 -6.917 -31.766 -38.608 758 H ASN 18 H ASN 18 -9.968 -30.832 -33.541 759 HA ASN 18 HA ASN 18 -9.157 -28.124 -33.031 760 1HB ASN 18 1HB ASN 18 -11.320 -29.722 -32.311 761 2HB ASN 18 2HB ASN 18 -10.448 -29.497 -30.798 762 1HD2 ASN 18 1HD2 ASN 18 -13.047 -28.488 -31.782 763 2HD2 ASN 18 2HD2 ASN 18 -12.974 -26.761 -31.586 764 H ARG 19 H ARG 19 -8.374 -31.304 -31.830 765 HA ARG 19 HA ARG 19 -6.799 -32.110 -30.420 766 1HB ARG 19 1HB ARG 19 -5.542 -30.057 -31.960 767 2HB ARG 19 2HB ARG 19 -4.882 -30.015 -30.329 768 1HG ARG 19 1HG ARG 19 -4.865 -32.295 -32.279 769 2HG ARG 19 2HG ARG 19 -3.492 -31.456 -31.558 770 1HD ARG 19 1HD ARG 19 -4.805 -32.360 -29.346 771 2HD ARG 19 2HD ARG 19 -5.137 -33.648 -30.504 772 HE ARG 19 HE ARG 19 -2.400 -32.733 -29.863 773 1HH1 ARG 19 1HH1 ARG 19 -4.754 -35.286 -30.347 774 2HH1 ARG 19 2HH1 ARG 19 -3.581 -36.565 -30.221 775 1HH2 ARG 19 1HH2 ARG 19 -0.839 -34.415 -29.775 776 2HH2 ARG 19 2HH2 ARG 19 -1.351 -36.069 -29.962 777 H ASP 20 H ASP 20 -8.915 -30.737 -29.212 778 HA ASP 20 HA ASP 20 -7.861 -29.060 -27.103 779 1HB ASP 20 1HB ASP 20 -10.141 -28.686 -27.926 780 2HB ASP 20 2HB ASP 20 -10.590 -30.323 -27.458 781 H LEU 21 H LEU 21 -8.582 -32.391 -27.665 782 HA LEU 21 HA LEU 21 -8.409 -33.198 -24.908 783 1HB LEU 21 1HB LEU 21 -8.879 -34.493 -27.508 784 2HB LEU 21 2HB LEU 21 -8.019 -35.479 -26.342 785 HG LEU 21 HG LEU 21 -9.919 -34.922 -24.716 786 1HD1 LEU 21 1HD1 LEU 21 -10.762 -33.403 -26.976 787 2HD1 LEU 21 2HD1 LEU 21 -11.513 -33.540 -25.385 788 3HD1 LEU 21 3HD1 LEU 21 -11.945 -34.676 -26.665 789 1HD2 LEU 21 1HD2 LEU 21 -10.646 -36.977 -25.174 790 2HD2 LEU 21 2HD2 LEU 21 -9.541 -36.964 -26.551 791 3HD2 LEU 21 3HD2 LEU 21 -11.228 -36.496 -26.769 792 H GLU 22 H GLU 22 -6.309 -31.803 -24.992 793 HA GLU 22 HA GLU 22 -4.088 -33.685 -24.974 794 1HB GLU 22 1HB GLU 22 -4.244 -32.276 -27.200 795 2HB GLU 22 2HB GLU 22 -3.601 -30.988 -26.192 796 1HG GLU 22 1HG GLU 22 -1.788 -32.718 -25.562 797 2HG GLU 22 2HG GLU 22 -2.331 -33.561 -27.014 798 H ARG 23 H ARG 23 -3.058 -33.455 -23.088 799 HA ARG 23 HA ARG 23 -3.371 -30.885 -21.676 800 1HB ARG 23 1HB ARG 23 -4.753 -32.788 -20.779 801 2HB ARG 23 2HB ARG 23 -3.250 -33.608 -20.379 802 1HG ARG 23 1HG ARG 23 -3.000 -32.431 -18.514 803 2HG ARG 23 2HG ARG 23 -3.300 -30.906 -19.347 804 1HD ARG 23 1HD ARG 23 -5.709 -31.301 -19.201 805 2HD ARG 23 2HD ARG 23 -5.409 -32.833 -18.378 806 HE ARG 23 HE ARG 23 -4.483 -31.541 -16.520 807 1HH1 ARG 23 1HH1 ARG 23 -6.333 -29.772 -18.908 808 2HH1 ARG 23 2HH1 ARG 23 -6.803 -28.511 -17.802 809 1HH2 ARG 23 1HH2 ARG 23 -5.086 -29.863 -15.057 810 2HH2 ARG 23 2HH2 ARG 23 -6.120 -28.574 -15.620 811 H VAL 24 H VAL 24 -1.418 -29.974 -21.988 812 HA VAL 24 HA VAL 24 0.869 -31.415 -20.828 813 HB VAL 24 HB VAL 24 2.056 -29.575 -22.502 814 1HG1 VAL 24 1HG1 VAL 24 1.541 -32.502 -23.000 815 2HG1 VAL 24 2HG1 VAL 24 2.852 -31.817 -22.038 816 3HG1 VAL 24 3HG1 VAL 24 2.793 -31.531 -23.779 817 1HG2 VAL 24 1HG2 VAL 24 -0.410 -29.620 -23.540 818 2HG2 VAL 24 2HG2 VAL 24 0.285 -30.998 -24.393 819 3HG2 VAL 24 3HG2 VAL 24 1.042 -29.411 -24.517 820 H VAL 25 H VAL 25 1.886 -30.342 -19.259 821 HA VAL 25 HA VAL 25 0.774 -27.806 -18.434 822 HB VAL 25 HB VAL 25 2.970 -29.426 -17.132 823 1HG1 VAL 25 1HG1 VAL 25 1.212 -27.605 -15.589 824 2HG1 VAL 25 2HG1 VAL 25 2.438 -26.860 -16.614 825 3HG1 VAL 25 3HG1 VAL 25 2.915 -28.002 -15.360 826 1HG2 VAL 25 1HG2 VAL 25 0.676 -30.529 -17.453 827 2HG2 VAL 25 2HG2 VAL 25 0.095 -29.356 -16.271 828 3HG2 VAL 25 3HG2 VAL 25 1.355 -30.506 -15.827 829 H THR 26 H THR 26 1.476 -26.376 -20.000 830 HA THR 26 HA THR 26 4.344 -25.960 -20.350 831 HB THR 26 HB THR 26 2.464 -24.014 -21.534 832 HG1 THR 26 HG1 THR 26 2.512 -26.729 -22.429 833 1HG2 THR 26 1HG2 THR 26 4.529 -25.727 -22.895 834 2HG2 THR 26 2HG2 THR 26 4.956 -24.272 -21.995 835 3HG2 THR 26 3HG2 THR 26 3.899 -24.159 -23.401 836 H ALA 27 H ALA 27 4.729 -25.352 -18.143 837 HA ALA 27 HA ALA 27 3.809 -22.628 -17.516 838 1HB ALA 27 1HB ALA 27 4.518 -24.097 -15.154 839 2HB ALA 27 2HB ALA 27 3.297 -24.975 -16.074 840 3HB ALA 27 3HB ALA 27 2.993 -23.314 -15.567 841 HA PRO 28 HA PRO 28 8.166 -21.783 -17.419 842 1HB PRO 28 1HB PRO 28 7.485 -19.168 -16.347 843 2HB PRO 28 2HB PRO 28 8.099 -19.581 -17.949 844 1HG PRO 28 1HG PRO 28 5.576 -18.668 -17.521 845 2HG PRO 28 2HG PRO 28 6.001 -19.758 -18.855 846 1HD PRO 28 1HD PRO 28 4.724 -20.391 -16.215 847 2HD PRO 28 2HD PRO 28 4.343 -21.019 -17.834 848 H VAL 29 H VAL 29 9.484 -20.206 -15.707 849 HA VAL 29 HA VAL 29 9.168 -21.627 -13.174 850 HB VAL 29 HB VAL 29 11.376 -21.503 -14.437 851 1HG1 VAL 29 1HG1 VAL 29 11.447 -18.727 -13.271 852 2HG1 VAL 29 2HG1 VAL 29 11.317 -19.120 -14.985 853 3HG1 VAL 29 3HG1 VAL 29 12.774 -19.549 -14.088 854 1HG2 VAL 29 1HG2 VAL 29 11.011 -20.921 -11.538 855 2HG2 VAL 29 2HG2 VAL 29 12.641 -20.971 -12.213 856 3HG2 VAL 29 3HG2 VAL 29 11.594 -22.385 -12.334 857 H SER 30 H SER 30 7.503 -19.307 -14.121 858 HA SER 30 HA SER 30 8.131 -17.074 -12.471 859 1HB SER 30 1HB SER 30 5.350 -17.138 -13.100 860 2HB SER 30 2HB SER 30 6.612 -16.155 -13.847 861 HG SER 30 HG SER 30 5.787 -17.361 -15.480 862 H SER 31 H SER 31 5.654 -19.622 -12.282 863 HA SER 31 HA SER 31 4.367 -20.409 -10.594 864 1HB SER 31 1HB SER 31 6.440 -19.815 -8.550 865 2HB SER 31 2HB SER 31 5.590 -21.322 -8.896 866 HG SER 31 HG SER 31 7.021 -21.812 -10.442 867 H GLY 32 H GLY 32 4.956 -19.369 -7.712 868 1HA GLY 32 1HA GLY 32 3.623 -16.750 -7.977 869 2HA GLY 32 2HA GLY 32 2.961 -17.973 -6.900 870 H LYS 33 H LYS 33 6.371 -17.521 -7.406 871 HA LYS 33 HA LYS 33 6.768 -17.168 -4.575 872 1HB LYS 33 1HB LYS 33 9.237 -17.114 -5.342 873 2HB LYS 33 2HB LYS 33 8.337 -18.616 -5.492 874 1HG LYS 33 1HG LYS 33 8.514 -18.636 -7.720 875 2HG LYS 33 2HG LYS 33 8.183 -16.909 -7.857 876 1HD LYS 33 1HD LYS 33 10.462 -17.590 -8.631 877 2HD LYS 33 2HD LYS 33 10.454 -16.357 -7.371 878 1HE LYS 33 1HE LYS 33 12.170 -18.021 -6.934 879 2HE LYS 33 2HE LYS 33 10.923 -18.069 -5.692 880 1HZ LYS 33 1HZ LYS 33 11.851 -20.211 -7.034 881 2HZ LYS 33 2HZ LYS 33 10.437 -19.852 -7.901 882 3HZ LYS 33 3HZ LYS 33 10.358 -20.141 -6.231 883 H ILE 34 H ILE 34 5.599 -14.966 -6.279 884 HA ILE 34 HA ILE 34 7.311 -12.857 -5.210 885 HB ILE 34 HB ILE 34 6.362 -11.728 -7.557 886 1HG1 ILE 34 1HG1 ILE 34 7.693 -13.504 -9.108 887 2HG1 ILE 34 2HG1 ILE 34 6.951 -14.602 -7.952 888 1HG2 ILE 34 1HG2 ILE 34 9.010 -12.675 -6.577 889 2HG2 ILE 34 2HG2 ILE 34 8.427 -11.031 -6.842 890 3HG2 ILE 34 3HG2 ILE 34 8.871 -12.043 -8.217 891 1HD1 ILE 34 1HD1 ILE 34 5.049 -14.484 -9.052 892 2HD1 ILE 34 2HD1 ILE 34 5.796 -13.394 -10.221 893 3HD1 ILE 34 3HD1 ILE 34 4.988 -12.740 -8.795 894 H LYS 35 H LYS 35 6.177 -11.331 -4.203 895 HA LYS 35 HA LYS 35 3.247 -11.350 -4.552 896 1HB LYS 35 1HB LYS 35 4.703 -10.513 -2.049 897 2HB LYS 35 2HB LYS 35 2.997 -10.900 -2.231 898 1HG LYS 35 1HG LYS 35 5.013 -13.009 -2.814 899 2HG LYS 35 2HG LYS 35 4.664 -12.596 -1.133 900 1HD LYS 35 1HD LYS 35 2.930 -13.985 -1.271 901 2HD LYS 35 2HD LYS 35 2.168 -12.791 -2.325 902 1HE LYS 35 1HE LYS 35 2.244 -14.233 -4.011 903 2HE LYS 35 2HE LYS 35 4.002 -14.291 -3.883 904 1HZ LYS 35 1HZ LYS 35 3.693 -15.992 -2.112 905 2HZ LYS 35 2HZ LYS 35 3.179 -16.490 -3.652 906 3HZ LYS 35 3HZ LYS 35 2.040 -16.019 -2.489 907 H ARG 36 H ARG 36 2.195 -9.428 -4.812 908 HA ARG 36 HA ARG 36 3.947 -7.108 -5.239 909 1HB ARG 36 1HB ARG 36 1.545 -8.173 -6.601 910 2HB ARG 36 2HB ARG 36 1.673 -6.422 -6.504 911 1HG ARG 36 1HG ARG 36 3.756 -6.441 -7.665 912 2HG ARG 36 2HG ARG 36 3.837 -8.204 -7.592 913 1HD ARG 36 1HD ARG 36 3.125 -7.526 -9.793 914 2HD ARG 36 2HD ARG 36 1.788 -8.321 -8.960 915 HE ARG 36 HE ARG 36 2.019 -5.384 -9.147 916 1HH1 ARG 36 1HH1 ARG 36 0.155 -8.346 -9.389 917 2HH1 ARG 36 2HH1 ARG 36 -1.331 -7.523 -9.747 918 1HH2 ARG 36 1HH2 ARG 36 0.046 -4.313 -9.589 919 2HH2 ARG 36 2HH2 ARG 36 -1.404 -5.242 -9.839 920 H VAL 37 H VAL 37 3.332 -5.050 -4.609 921 HA VAL 37 HA VAL 37 0.922 -4.652 -3.061 922 HB VAL 37 HB VAL 37 2.809 -5.466 -1.469 923 1HG1 VAL 37 1HG1 VAL 37 4.031 -3.105 -2.545 924 2HG1 VAL 37 2HG1 VAL 37 4.700 -4.306 -1.441 925 3HG1 VAL 37 3HG1 VAL 37 3.804 -2.928 -0.804 926 1HG2 VAL 37 1HG2 VAL 37 0.892 -3.239 -1.145 927 2HG2 VAL 37 2HG2 VAL 37 2.096 -3.445 0.131 928 3HG2 VAL 37 3HG2 VAL 37 1.013 -4.774 -0.282 929 H ASN 38 H ASN 38 0.373 -2.427 -2.864 930 HA ASN 38 HA ASN 38 1.923 -0.682 -4.662 931 1HB ASN 38 1HB ASN 38 -0.354 -1.005 -5.435 932 2HB ASN 38 2HB ASN 38 -0.988 -0.567 -3.851 933 1HD2 ASN 38 1HD2 ASN 38 -1.492 1.496 -3.495 934 2HD2 ASN 38 2HD2 ASN 38 -1.051 2.821 -4.519 935 H VAL 39 H VAL 39 2.978 0.968 -3.805 936 HA VAL 39 HA VAL 39 2.290 1.770 -1.053 937 HB VAL 39 HB VAL 39 4.899 2.590 -2.188 938 1HG1 VAL 39 1HG1 VAL 39 5.653 2.184 0.082 939 2HG1 VAL 39 2HG1 VAL 39 4.102 1.452 0.490 940 3HG1 VAL 39 3HG1 VAL 39 4.188 3.167 0.092 941 1HG2 VAL 39 1HG2 VAL 39 5.468 0.530 -2.851 942 2HG2 VAL 39 2HG2 VAL 39 4.081 -0.209 -2.050 943 3HG2 VAL 39 3HG2 VAL 39 5.545 0.143 -1.133 944 H ASN 40 H ASN 40 2.365 3.985 -0.519 945 HA ASN 40 HA ASN 40 1.873 5.749 -2.817 946 1HB ASN 40 1HB ASN 40 1.101 6.164 0.083 947 2HB ASN 40 2HB ASN 40 0.660 7.201 -1.268 948 1HD2 ASN 40 1HD2 ASN 40 0.135 4.135 0.290 949 2HD2 ASN 40 2HD2 ASN 40 -1.356 3.758 -0.513 950 H PHE 41 H PHE 41 3.447 7.091 -3.320 951 HA PHE 41 HA PHE 41 5.509 7.694 -1.310 952 1HB PHE 41 1HB PHE 41 5.500 7.858 -4.331 953 2HB PHE 41 2HB PHE 41 6.807 8.494 -3.344 954 HD1 PHE 41 HD1 PHE 41 5.571 5.597 -1.790 955 HD2 PHE 41 HD2 PHE 41 7.978 6.890 -5.051 956 HE1 PHE 41 HE1 PHE 41 6.670 3.399 -1.847 957 HE2 PHE 41 HE2 PHE 41 9.078 4.692 -5.118 958 HZ PHE 41 HZ PHE 41 8.426 2.944 -3.512 959 H ASP 42 H ASP 42 6.443 9.932 -1.460 960 HA ASP 42 HA ASP 42 4.281 11.880 -1.778 961 1HB ASP 42 1HB ASP 42 5.204 13.052 -0.080 962 2HB ASP 42 2HB ASP 42 6.112 11.583 0.243 963 H GLU 43 H GLU 43 4.991 14.039 -2.712 964 HA GLU 43 HA GLU 43 5.650 13.732 -5.372 965 1HB GLU 43 1HB GLU 43 5.238 15.953 -3.540 966 2HB GLU 43 2HB GLU 43 6.425 16.337 -4.780 967 1HG GLU 43 1HG GLU 43 3.576 15.466 -5.181 968 2HG GLU 43 2HG GLU 43 4.290 17.034 -5.551 969 H GLU 44 H GLU 44 7.756 14.837 -2.734 970 HA GLU 44 HA GLU 44 10.092 15.201 -4.285 971 1HB GLU 44 1HB GLU 44 9.333 15.275 -1.508 972 2HB GLU 44 2HB GLU 44 10.852 14.407 -1.695 973 1HG GLU 44 1HG GLU 44 10.530 17.009 -3.090 974 2HG GLU 44 2HG GLU 44 10.781 17.012 -1.344 975 H LYS 45 H LYS 45 8.821 12.471 -2.456 976 HA LYS 45 HA LYS 45 10.990 10.746 -2.660 977 1HB LYS 45 1HB LYS 45 8.471 10.638 -1.563 978 2HB LYS 45 2HB LYS 45 8.384 9.422 -2.832 979 1HG LYS 45 1HG LYS 45 9.248 8.052 -1.302 980 2HG LYS 45 2HG LYS 45 10.780 8.845 -1.672 981 1HD LYS 45 1HD LYS 45 8.945 10.018 0.378 982 2HD LYS 45 2HD LYS 45 9.980 8.653 0.801 983 1HE LYS 45 1HE LYS 45 11.622 10.099 1.173 984 2HE LYS 45 2HE LYS 45 11.642 10.438 -0.558 985 1HZ LYS 45 1HZ LYS 45 10.423 11.971 1.626 986 2HZ LYS 45 2HZ LYS 45 9.688 12.037 0.097 987 3HZ LYS 45 3HZ LYS 45 11.307 12.517 0.285 988 H HIS 46 H HIS 46 8.563 11.576 -5.033 989 HA HIS 46 HA HIS 46 9.222 9.328 -6.732 990 1HB HIS 46 1HB HIS 46 6.965 10.646 -6.612 991 2HB HIS 46 2HB HIS 46 7.760 11.733 -7.748 992 HD1 HIS 46 HD1 HIS 46 6.590 11.172 -9.893 993 HD2 HIS 46 HD2 HIS 46 7.961 7.791 -7.891 994 HE1 HIS 46 HE1 HIS 46 6.183 9.243 -11.456 995 HE2 HIS 46 HE2 HIS 46 6.822 7.192 -10.142 996 H THR 47 H THR 47 9.950 12.802 -6.646 997 HA THR 47 HA THR 47 11.412 12.839 -9.076 998 HB THR 47 HB THR 47 12.397 14.758 -7.140 999 HG1 THR 47 HG1 THR 47 10.538 15.585 -6.426 1000 1HG2 THR 47 1HG2 THR 47 12.421 14.968 -9.626 1001 2HG2 THR 47 2HG2 THR 47 11.685 16.346 -8.806 1002 3HG2 THR 47 3HG2 THR 47 10.666 15.134 -9.585 1003 H ARG 48 H ARG 48 12.377 12.468 -5.681 1004 HA ARG 48 HA ARG 48 15.157 12.220 -6.177 1005 1HB ARG 48 1HB ARG 48 13.593 12.371 -3.926 1006 2HB ARG 48 2HB ARG 48 14.130 10.696 -3.898 1007 1HG ARG 48 1HG ARG 48 16.366 11.278 -3.708 1008 2HG ARG 48 2HG ARG 48 16.090 12.914 -4.315 1009 1HD ARG 48 1HD ARG 48 14.759 12.057 -1.790 1010 2HD ARG 48 2HD ARG 48 16.475 12.456 -1.756 1011 HE ARG 48 HE ARG 48 14.308 14.310 -2.532 1012 1HH1 ARG 48 1HH1 ARG 48 17.528 13.707 -1.278 1013 2HH1 ARG 48 2HH1 ARG 48 17.886 15.393 -1.058 1014 1HH2 ARG 48 1HH2 ARG 48 14.756 16.516 -2.203 1015 2HH2 ARG 48 2HH2 ARG 48 16.318 16.995 -1.585 1016 H PHE 49 H PHE 49 12.486 9.944 -6.157 1017 HA PHE 49 HA PHE 49 14.041 7.580 -6.306 1018 1HB PHE 49 1HB PHE 49 11.371 8.095 -6.041 1019 2HB PHE 49 2HB PHE 49 11.454 7.548 -7.713 1020 HD1 PHE 49 HD1 PHE 49 12.061 6.604 -4.215 1021 HD2 PHE 49 HD2 PHE 49 11.928 5.295 -8.257 1022 HE1 PHE 49 HE1 PHE 49 12.159 4.268 -3.456 1023 HE2 PHE 49 HE2 PHE 49 12.012 2.960 -7.508 1024 HZ PHE 49 HZ PHE 49 12.136 2.444 -5.109 1025 H LYS 50 H LYS 50 12.625 9.708 -8.746 1026 HA LYS 50 HA LYS 50 13.420 8.224 -11.011 1027 1HB LYS 50 1HB LYS 50 12.664 11.088 -10.533 1028 2HB LYS 50 2HB LYS 50 13.309 10.604 -12.096 1029 1HG LYS 50 1HG LYS 50 10.804 9.619 -10.758 1030 2HG LYS 50 2HG LYS 50 10.944 10.562 -12.245 1031 1HD LYS 50 1HD LYS 50 12.472 8.102 -12.382 1032 2HD LYS 50 2HD LYS 50 10.766 7.798 -12.042 1033 1HE LYS 50 1HE LYS 50 10.190 8.282 -14.133 1034 2HE LYS 50 2HE LYS 50 11.055 9.818 -14.072 1035 1HZ LYS 50 1HZ LYS 50 11.762 7.988 -15.746 1036 2HZ LYS 50 2HZ LYS 50 12.574 7.322 -14.418 1037 3HZ LYS 50 3HZ LYS 50 12.948 8.890 -14.941 1038 H ALA 51 H ALA 51 15.004 10.694 -9.079 1039 HA ALA 51 HA ALA 51 17.320 10.982 -10.694 1040 1HB ALA 51 1HB ALA 51 17.051 11.415 -7.722 1041 2HB ALA 51 2HB ALA 51 16.622 12.602 -8.957 1042 3HB ALA 51 3HB ALA 51 18.298 12.078 -8.780 1043 H ALA 52 H ALA 52 16.539 8.966 -7.879 1044 HA ALA 52 HA ALA 52 19.033 7.702 -7.617 1045 1HB ALA 52 1HB ALA 52 17.551 5.832 -6.580 1046 2HB ALA 52 2HB ALA 52 16.251 7.006 -6.782 1047 3HB ALA 52 3HB ALA 52 17.654 7.405 -5.788 1048 H CYS 53 H CYS 53 16.186 6.878 -9.555 1049 HA CYS 53 HA CYS 53 17.036 4.385 -10.514 1050 1HB CYS 53 1HB CYS 53 15.348 6.469 -11.918 1051 2HB CYS 53 2HB CYS 53 15.485 4.783 -12.400 1052 HG CYS 53 HG CYS 53 14.239 5.778 -9.376 1053 H ALA 54 H ALA 54 17.624 7.656 -11.711 1054 HA ALA 54 HA ALA 54 19.101 6.788 -14.005 1055 1HB ALA 54 1HB ALA 54 17.960 8.887 -14.106 1056 2HB ALA 54 2HB ALA 54 19.694 9.198 -14.202 1057 3HB ALA 54 3HB ALA 54 18.828 9.484 -12.691 1058 H ARG 55 H ARG 55 19.944 8.009 -10.791 1059 HA ARG 55 HA ARG 55 22.722 8.194 -11.242 1060 1HB ARG 55 1HB ARG 55 21.007 8.049 -8.790 1061 2HB ARG 55 2HB ARG 55 22.757 7.955 -8.639 1062 1HG ARG 55 1HG ARG 55 22.936 10.108 -9.847 1063 2HG ARG 55 2HG ARG 55 21.175 10.206 -9.860 1064 1HD ARG 55 1HD ARG 55 21.252 11.165 -7.860 1065 2HD ARG 55 2HD ARG 55 21.925 9.672 -7.203 1066 HE ARG 55 HE ARG 55 23.818 11.493 -8.451 1067 1HH1 ARG 55 1HH1 ARG 55 22.285 10.457 -5.477 1068 2HH1 ARG 55 2HH1 ARG 55 23.592 11.007 -4.461 1069 1HH2 ARG 55 1HH2 ARG 55 25.540 12.204 -7.140 1070 2HH2 ARG 55 2HH2 ARG 55 25.437 12.032 -5.409 1071 H LYS 56 H LYS 56 20.748 5.613 -9.816 1072 HA LYS 56 HA LYS 56 22.970 3.840 -9.433 1073 1HB LYS 56 1HB LYS 56 19.984 3.564 -9.283 1074 2HB LYS 56 2HB LYS 56 21.000 2.129 -9.262 1075 1HG LYS 56 1HG LYS 56 21.249 4.421 -7.325 1076 2HG LYS 56 2HG LYS 56 20.362 2.927 -7.012 1077 1HD LYS 56 1HD LYS 56 22.398 1.633 -7.265 1078 2HD LYS 56 2HD LYS 56 23.302 3.093 -7.674 1079 1HE LYS 56 1HE LYS 56 21.963 3.540 -5.210 1080 2HE LYS 56 2HE LYS 56 22.780 1.980 -5.112 1081 1HZ LYS 56 1HZ LYS 56 23.958 4.641 -5.627 1082 2HZ LYS 56 2HZ LYS 56 24.789 3.216 -6.025 1083 3HZ LYS 56 3HZ LYS 56 24.359 3.526 -4.414 1084 H GLY 57 H GLY 57 20.508 4.320 -11.908 1085 1HA GLY 57 1HA GLY 57 20.737 3.829 -14.186 1086 2HA GLY 57 2HA GLY 57 22.165 2.871 -13.814 1087 H THR 58 H THR 58 18.662 2.876 -13.197 1088 HA THR 58 HA THR 58 18.352 0.215 -14.204 1089 HB THR 58 HB THR 58 19.403 -0.139 -11.936 1090 HG1 THR 58 HG1 THR 58 17.738 -1.736 -11.326 1091 1HG2 THR 58 1HG2 THR 58 18.366 0.424 -9.965 1092 2HG2 THR 58 2HG2 THR 58 16.761 0.460 -10.694 1093 3HG2 THR 58 3HG2 THR 58 17.887 1.787 -10.975 1094 H SER 59 H SER 59 16.023 -0.584 -13.200 1095 HA SER 59 HA SER 59 14.192 1.461 -14.129 1096 1HB SER 59 1HB SER 59 12.766 -0.844 -13.372 1097 2HB SER 59 2HB SER 59 13.220 -0.358 -15.006 1098 HG SER 59 HG SER 59 14.139 -2.405 -13.529 1099 H ILE 60 H ILE 60 12.277 2.040 -12.970 1100 HA ILE 60 HA ILE 60 12.761 2.956 -10.424 1101 HB ILE 60 HB ILE 60 11.056 3.978 -11.743 1102 1HG1 ILE 60 1HG1 ILE 60 9.197 2.924 -9.739 1103 2HG1 ILE 60 2HG1 ILE 60 10.752 3.407 -9.068 1104 1HG2 ILE 60 1HG2 ILE 60 8.901 2.881 -12.224 1105 2HG2 ILE 60 2HG2 ILE 60 9.546 1.377 -11.571 1106 3HG2 ILE 60 3HG2 ILE 60 10.263 2.091 -13.014 1107 1HD1 ILE 60 1HD1 ILE 60 9.740 5.388 -10.906 1108 2HD1 ILE 60 2HD1 ILE 60 10.232 5.552 -9.221 1109 3HD1 ILE 60 3HD1 ILE 60 8.589 5.045 -9.612 1110 H THR 61 H THR 61 10.940 0.033 -11.318 1111 HA THR 61 HA THR 61 10.119 -0.620 -8.726 1112 HB THR 61 HB THR 61 10.594 -2.802 -10.694 1113 HG1 THR 61 HG1 THR 61 8.523 -0.858 -11.030 1114 1HG2 THR 61 1HG2 THR 61 9.096 -2.491 -8.378 1115 2HG2 THR 61 2HG2 THR 61 8.933 -3.791 -9.557 1116 3HG2 THR 61 3HG2 THR 61 7.905 -2.364 -9.672 1117 H ASP 62 H ASP 62 13.105 -1.284 -10.427 1118 HA ASP 62 HA ASP 62 14.059 -3.298 -8.653 1119 1HB ASP 62 1HB ASP 62 14.929 -2.976 -10.957 1120 2HB ASP 62 2HB ASP 62 15.649 -1.453 -10.448 1121 H VAL 63 H VAL 63 14.217 0.202 -8.727 1122 HA VAL 63 HA VAL 63 16.125 0.517 -6.641 1123 HB VAL 63 HB VAL 63 13.921 2.488 -7.196 1124 1HG1 VAL 63 1HG1 VAL 63 15.222 4.025 -6.149 1125 2HG1 VAL 63 2HG1 VAL 63 16.726 3.276 -6.684 1126 3HG1 VAL 63 3HG1 VAL 63 15.828 2.581 -5.335 1127 1HG2 VAL 63 1HG2 VAL 63 15.944 1.559 -9.035 1128 2HG2 VAL 63 2HG2 VAL 63 16.125 3.278 -8.695 1129 3HG2 VAL 63 3HG2 VAL 63 14.594 2.656 -9.313 1130 H VAL 64 H VAL 64 12.603 0.190 -6.718 1131 HA VAL 64 HA VAL 64 12.163 0.749 -3.989 1132 HB VAL 64 HB VAL 64 10.445 -1.259 -5.394 1133 1HG1 VAL 64 1HG1 VAL 64 10.251 -0.093 -2.979 1134 2HG1 VAL 64 2HG1 VAL 64 8.854 -0.617 -3.920 1135 3HG1 VAL 64 3HG1 VAL 64 9.355 1.072 -3.953 1136 1HG2 VAL 64 1HG2 VAL 64 9.178 0.797 -6.291 1137 2HG2 VAL 64 2HG2 VAL 64 10.599 0.236 -7.172 1138 3HG2 VAL 64 3HG2 VAL 64 10.716 1.636 -6.107 1139 H ASN 65 H ASN 65 12.946 -2.193 -5.733 1140 HA ASN 65 HA ASN 65 12.763 -3.944 -3.500 1141 1HB ASN 65 1HB ASN 65 13.037 -4.325 -6.175 1142 2HB ASN 65 2HB ASN 65 14.681 -4.643 -5.632 1143 1HD2 ASN 65 1HD2 ASN 65 12.123 -6.220 -6.534 1144 2HD2 ASN 65 2HD2 ASN 65 12.131 -7.566 -5.441 1145 H GLN 66 H GLN 66 15.208 -1.777 -4.688 1146 HA GLN 66 HA GLN 66 17.419 -2.857 -3.257 1147 1HB GLN 66 1HB GLN 66 16.831 -0.284 -4.647 1148 2HB GLN 66 2HB GLN 66 18.194 -0.341 -3.537 1149 1HG GLN 66 1HG GLN 66 17.881 -2.383 -5.697 1150 2HG GLN 66 2HG GLN 66 18.605 -0.808 -6.024 1151 1HE2 GLN 66 1HE2 GLN 66 19.688 -3.582 -6.007 1152 2HE2 GLN 66 2HE2 GLN 66 21.089 -3.498 -4.983 1153 H LEU 67 H LEU 67 15.050 -0.305 -2.517 1154 HA LEU 67 HA LEU 67 16.192 0.461 -0.043 1155 1HB LEU 67 1HB LEU 67 13.281 0.592 -0.099 1156 2HB LEU 67 2HB LEU 67 14.455 1.863 0.161 1157 HG LEU 67 HG LEU 67 14.231 0.950 -2.631 1158 1HD1 LEU 67 1HD1 LEU 67 11.869 1.530 -1.103 1159 2HD1 LEU 67 2HD1 LEU 67 12.024 1.044 -2.791 1160 3HD1 LEU 67 3HD1 LEU 67 12.118 2.749 -2.351 1161 1HD2 LEU 67 1HD2 LEU 67 14.356 3.312 -3.070 1162 2HD2 LEU 67 2HD2 LEU 67 15.577 2.889 -1.870 1163 3HD2 LEU 67 3HD2 LEU 67 14.084 3.681 -1.369 1164 H VAL 68 H VAL 68 13.784 -1.959 -0.959 1165 HA VAL 68 HA VAL 68 13.177 -2.851 1.657 1166 HB VAL 68 HB VAL 68 13.052 -4.488 -0.881 1167 1HG1 VAL 68 1HG1 VAL 68 11.034 -5.399 0.587 1168 2HG1 VAL 68 2HG1 VAL 68 12.074 -4.852 1.902 1169 3HG1 VAL 68 3HG1 VAL 68 12.668 -6.045 0.744 1170 1HG2 VAL 68 1HG2 VAL 68 11.830 -2.217 -0.815 1171 2HG2 VAL 68 2HG2 VAL 68 10.747 -3.013 0.327 1172 3HG2 VAL 68 3HG2 VAL 68 10.930 -3.650 -1.307 1173 H ASP 69 H ASP 69 15.670 -3.727 -0.664 1174 HA ASP 69 HA ASP 69 16.653 -6.062 0.484 1175 1HB ASP 69 1HB ASP 69 17.743 -3.961 -1.284 1176 2HB ASP 69 2HB ASP 69 18.949 -4.836 -0.347 1177 H ASN 70 H ASN 70 17.810 -2.764 0.966 1178 HA ASN 70 HA ASN 70 19.584 -3.382 3.053 1179 1HB ASN 70 1HB ASN 70 18.293 -0.803 2.167 1180 2HB ASN 70 2HB ASN 70 19.438 -0.870 3.505 1181 1HD2 ASN 70 1HD2 ASN 70 19.034 -1.518 0.066 1182 2HD2 ASN 70 2HD2 ASN 70 20.710 -1.402 -0.340 1183 H TRP 71 H TRP 71 16.209 -2.337 3.072 1184 HA TRP 71 HA TRP 71 15.959 -1.960 5.855 1185 1HB TRP 71 1HB TRP 71 14.311 -1.201 4.136 1186 2HB TRP 71 2HB TRP 71 13.810 -2.875 3.935 1187 HD1 TRP 71 HD1 TRP 71 13.594 0.036 6.383 1188 HE1 TRP 71 HE1 TRP 71 11.752 -0.442 8.111 1189 HE3 TRP 71 HE3 TRP 71 12.513 -4.785 5.070 1190 HZ2 TRP 71 HZ2 TRP 71 10.066 -2.584 8.820 1191 HZ3 TRP 71 HZ3 TRP 71 10.749 -5.968 6.310 1192 HH2 TRP 71 HH2 TRP 71 9.543 -4.886 8.150 1193 H LEU 72 H LEU 72 14.851 -4.695 3.884 1194 HA LEU 72 HA LEU 72 13.942 -6.257 5.957 1195 1HB LEU 72 1HB LEU 72 13.883 -6.446 3.299 1196 2HB LEU 72 2HB LEU 72 15.125 -7.641 3.620 1197 HG LEU 72 HG LEU 72 13.086 -8.259 5.418 1198 1HD1 LEU 72 1HD1 LEU 72 11.957 -6.743 3.343 1199 2HD1 LEU 72 2HD1 LEU 72 11.119 -7.707 4.561 1200 3HD1 LEU 72 3HD1 LEU 72 11.551 -8.426 3.009 1201 1HD2 LEU 72 1HD2 LEU 72 13.276 -10.295 4.476 1202 2HD2 LEU 72 2HD2 LEU 72 14.662 -9.564 3.667 1203 3HD2 LEU 72 3HD2 LEU 72 13.112 -9.672 2.837 1204 H LYS 73 H LYS 73 17.168 -6.281 4.494 1205 HA LYS 73 HA LYS 73 17.920 -8.543 6.096 1206 1HB LYS 73 1HB LYS 73 19.639 -6.860 4.269 1207 2HB LYS 73 2HB LYS 73 20.012 -8.471 4.878 1208 1HG LYS 73 1HG LYS 73 18.520 -9.502 3.461 1209 2HG LYS 73 2HG LYS 73 17.497 -8.070 3.334 1210 1HD LYS 73 1HD LYS 73 18.679 -7.212 1.619 1211 2HD LYS 73 2HD LYS 73 20.225 -7.763 2.269 1212 1HE LYS 73 1HE LYS 73 19.978 -9.899 1.352 1213 2HE LYS 73 2HE LYS 73 18.246 -9.689 1.107 1214 1HZ LYS 73 1HZ LYS 73 20.267 -8.076 -0.345 1215 2HZ LYS 73 2HZ LYS 73 18.616 -8.251 -0.705 1216 3HZ LYS 73 3HZ LYS 73 19.681 -9.554 -0.937 1217 H GLU 74 H GLU 74 18.281 -5.082 6.381 1218 HA GLU 74 HA GLU 74 20.357 -5.413 8.405 1219 1HB GLU 74 1HB GLU 74 19.194 -3.067 6.972 1220 2HB GLU 74 2HB GLU 74 20.020 -2.810 8.503 1221 1HG GLU 74 1HG GLU 74 21.271 -4.280 6.200 1222 2HG GLU 74 2HG GLU 74 21.406 -2.534 6.415 1223 H ASN 75 H ASN 75 16.977 -4.379 8.189 1224 HA ASN 75 HA ASN 75 16.776 -3.517 10.873 1225 1HB ASN 75 1HB ASN 75 14.691 -2.892 10.309 1226 2HB ASN 75 2HB ASN 75 15.154 -3.349 8.675 1227 1HD2 ASN 75 1HD2 ASN 75 14.480 -5.400 7.880 1228 2HD2 ASN 75 2HD2 ASN 75 13.114 -6.204 8.568 1229 H GLU 76 H GLU 76 16.688 -6.648 9.450 1230 HA GLU 76 HA GLU 76 15.665 -7.795 11.949 1231 1HB GLU 76 1HB GLU 76 15.505 -8.585 9.107 1232 2HB GLU 76 2HB GLU 76 15.753 -9.901 10.246 1233 1HG GLU 76 1HG GLU 76 13.713 -8.209 11.272 1234 2HG GLU 76 2HG GLU 76 13.348 -8.565 9.583 Start of MODEL 3 1 1H MET 1 1H MET 1 -14.416 50.972 -76.070 2 2H MET 1 2H MET 1 -15.908 51.775 -76.089 3 3H MET 1 3H MET 1 -15.015 51.613 -77.522 4 HA MET 1 HA MET 1 -17.031 50.044 -76.958 5 1HB MET 1 1HB MET 1 -15.223 50.165 -78.889 6 2HB MET 1 2HB MET 1 -14.593 48.730 -78.091 7 1HG MET 1 1HG MET 1 -17.326 48.279 -78.313 8 2HG MET 1 2HG MET 1 -16.859 49.020 -79.843 9 1HE MET 1 1HE MET 1 -15.321 46.394 -81.811 10 2HE MET 1 2HE MET 1 -14.419 47.797 -81.242 11 3HE MET 1 3HE MET 1 -16.127 47.954 -81.651 12 H SER 2 H SER 2 -16.741 49.934 -74.496 13 HA SER 2 HA SER 2 -15.627 47.293 -73.842 14 1HB SER 2 1HB SER 2 -15.420 48.889 -71.516 15 2HB SER 2 2HB SER 2 -14.108 48.214 -72.479 16 HG SER 2 HG SER 2 -15.335 50.759 -72.707 17 H LEU 3 H LEU 3 -17.072 45.996 -72.927 18 HA LEU 3 HA LEU 3 -19.716 46.876 -72.380 19 1HB LEU 3 1HB LEU 3 -18.708 44.300 -71.268 20 2HB LEU 3 2HB LEU 3 -20.256 44.665 -72.007 21 HG LEU 3 HG LEU 3 -17.843 44.734 -73.747 22 1HD1 LEU 3 1HD1 LEU 3 -17.783 42.657 -72.236 23 2HD1 LEU 3 2HD1 LEU 3 -17.670 42.422 -73.981 24 3HD1 LEU 3 3HD1 LEU 3 -19.196 42.129 -73.147 25 1HD2 LEU 3 1HD2 LEU 3 -19.603 43.557 -75.222 26 2HD2 LEU 3 2HD2 LEU 3 -19.781 45.281 -74.890 27 3HD2 LEU 3 3HD2 LEU 3 -20.754 44.107 -74.005 28 H GLU 4 H GLU 4 -16.930 46.156 -70.383 29 HA GLU 4 HA GLU 4 -16.452 46.460 -68.194 30 1HB GLU 4 1HB GLU 4 -18.530 48.624 -68.539 31 2HB GLU 4 2HB GLU 4 -17.574 48.427 -67.076 32 1HG GLU 4 1HG GLU 4 -16.353 48.814 -69.793 33 2HG GLU 4 2HG GLU 4 -16.750 50.148 -68.710 34 H LYS 5 H LYS 5 -18.017 44.314 -68.600 35 HA LYS 5 HA LYS 5 -20.355 44.358 -66.930 36 1HB LYS 5 1HB LYS 5 -18.853 42.233 -68.422 37 2HB LYS 5 2HB LYS 5 -20.071 41.779 -67.237 38 1HG LYS 5 1HG LYS 5 -21.797 42.530 -68.509 39 2HG LYS 5 2HG LYS 5 -20.827 43.793 -69.273 40 1HD LYS 5 1HD LYS 5 -20.326 42.478 -71.002 41 2HD LYS 5 2HD LYS 5 -19.854 41.149 -69.941 42 1HE LYS 5 1HE LYS 5 -21.636 40.229 -71.073 43 2HE LYS 5 2HE LYS 5 -22.420 40.855 -69.622 44 1HZ LYS 5 1HZ LYS 5 -22.537 41.860 -72.379 45 2HZ LYS 5 2HZ LYS 5 -22.737 42.954 -71.098 46 3HZ LYS 5 3HZ LYS 5 -23.789 41.635 -71.257 47 H ALA 6 H ALA 6 -17.089 43.005 -66.659 48 HA ALA 6 HA ALA 6 -17.571 42.373 -63.847 49 1HB ALA 6 1HB ALA 6 -14.892 41.945 -65.018 50 2HB ALA 6 2HB ALA 6 -16.207 40.974 -65.686 51 3HB ALA 6 3HB ALA 6 -15.850 40.909 -63.960 52 H HIS 7 H HIS 7 -17.178 43.867 -62.367 53 HA HIS 7 HA HIS 7 -14.933 45.714 -62.760 54 1HB HIS 7 1HB HIS 7 -17.653 46.440 -63.084 55 2HB HIS 7 2HB HIS 7 -17.102 47.156 -61.571 56 HD1 HIS 7 HD1 HIS 7 -16.426 49.490 -61.992 57 HD2 HIS 7 HD2 HIS 7 -15.358 46.969 -65.122 58 HE1 HIS 7 HE1 HIS 7 -15.199 50.940 -63.642 59 HE2 HIS 7 HE2 HIS 7 -14.771 49.440 -65.628 60 H THR 8 H THR 8 -14.658 43.660 -61.129 61 HA THR 8 HA THR 8 -15.444 44.437 -58.436 62 HB THR 8 HB THR 8 -13.616 42.139 -59.043 63 HG1 THR 8 HG1 THR 8 -16.430 42.283 -59.481 64 1HG2 THR 8 1HG2 THR 8 -14.488 43.014 -56.698 65 2HG2 THR 8 2HG2 THR 8 -14.314 41.293 -57.032 66 3HG2 THR 8 3HG2 THR 8 -15.902 42.052 -57.136 67 H SER 9 H SER 9 -14.146 46.473 -58.868 68 HA SER 9 HA SER 9 -11.292 46.269 -58.841 69 1HB SER 9 1HB SER 9 -12.443 48.835 -58.010 70 2HB SER 9 2HB SER 9 -11.375 48.464 -59.366 71 HG SER 9 HG SER 9 -13.213 47.673 -60.492 72 H VAL 10 H VAL 10 -13.612 45.872 -56.489 73 HA VAL 10 HA VAL 10 -12.219 47.009 -54.254 74 HB VAL 10 HB VAL 10 -13.799 45.336 -52.981 75 1HG1 VAL 10 1HG1 VAL 10 -14.724 47.770 -54.495 76 2HG1 VAL 10 2HG1 VAL 10 -14.111 47.694 -52.843 77 3HG1 VAL 10 3HG1 VAL 10 -15.675 46.981 -53.236 78 1HG2 VAL 10 1HG2 VAL 10 -14.660 43.920 -54.582 79 2HG2 VAL 10 2HG2 VAL 10 -14.764 45.191 -55.803 80 3HG2 VAL 10 3HG2 VAL 10 -15.935 45.138 -54.483 81 H LYS 11 H LYS 11 -10.172 46.236 -54.100 82 HA LYS 11 HA LYS 11 -9.867 43.320 -53.816 83 1HB LYS 11 1HB LYS 11 -8.802 44.235 -55.856 84 2HB LYS 11 2HB LYS 11 -7.830 45.301 -54.853 85 1HG LYS 11 1HG LYS 11 -7.356 42.798 -53.790 86 2HG LYS 11 2HG LYS 11 -7.437 42.513 -55.531 87 1HD LYS 11 1HD LYS 11 -5.358 43.287 -55.707 88 2HD LYS 11 2HD LYS 11 -5.940 44.868 -55.180 89 1HE LYS 11 1HE LYS 11 -5.620 44.145 -52.830 90 2HE LYS 11 2HE LYS 11 -4.924 42.638 -53.420 91 1HZ LYS 11 1HZ LYS 11 -3.105 43.780 -54.347 92 2HZ LYS 11 2HZ LYS 11 -3.301 44.429 -52.792 93 3HZ LYS 11 3HZ LYS 11 -3.833 45.297 -54.146 94 H LYS 12 H LYS 12 -9.786 42.958 -51.693 95 HA LYS 12 HA LYS 12 -8.033 44.686 -50.080 96 1HB LYS 12 1HB LYS 12 -10.624 44.257 -49.596 97 2HB LYS 12 2HB LYS 12 -9.974 42.841 -48.779 98 1HG LYS 12 1HG LYS 12 -8.871 44.091 -47.194 99 2HG LYS 12 2HG LYS 12 -8.816 45.530 -48.216 100 1HD LYS 12 1HD LYS 12 -10.868 46.220 -47.580 101 2HD LYS 12 2HD LYS 12 -11.512 44.578 -47.511 102 1HE LYS 12 1HE LYS 12 -9.573 44.835 -45.457 103 2HE LYS 12 2HE LYS 12 -10.633 46.242 -45.374 104 1HZ LYS 12 1HZ LYS 12 -12.538 44.800 -45.253 105 2HZ LYS 12 2HZ LYS 12 -11.439 44.366 -44.038 106 3HZ LYS 12 3HZ LYS 12 -11.567 43.421 -45.444 107 H MET 13 H MET 13 -6.121 43.815 -49.759 108 HA MET 13 HA MET 13 -5.875 40.895 -49.606 109 1HB MET 13 1HB MET 13 -4.415 42.650 -51.060 110 2HB MET 13 2HB MET 13 -3.443 42.584 -49.595 111 1HG MET 13 1HG MET 13 -3.998 39.935 -50.134 112 2HG MET 13 2HG MET 13 -3.732 40.644 -51.726 113 1HE MET 13 1HE MET 13 -2.436 38.654 -49.374 114 2HE MET 13 2HE MET 13 -1.762 39.781 -48.195 115 3HE MET 13 3HE MET 13 -0.691 38.888 -49.274 116 H THR 14 H THR 14 -7.030 41.578 -47.424 117 HA THR 14 HA THR 14 -5.042 42.250 -45.387 118 HB THR 14 HB THR 14 -7.167 42.302 -43.929 119 HG1 THR 14 HG1 THR 14 -8.800 41.553 -45.129 120 1HG2 THR 14 1HG2 THR 14 -6.086 44.245 -45.828 121 2HG2 THR 14 2HG2 THR 14 -6.491 44.433 -44.122 122 3HG2 THR 14 3HG2 THR 14 -7.751 44.575 -45.346 123 H PHE 15 H PHE 15 -4.393 40.859 -43.853 124 HA PHE 15 HA PHE 15 -5.297 38.100 -44.065 125 1HB PHE 15 1HB PHE 15 -3.398 37.479 -42.785 126 2HB PHE 15 2HB PHE 15 -2.840 38.716 -43.902 127 HD1 PHE 15 HD1 PHE 15 -3.217 37.753 -40.460 128 HD2 PHE 15 HD2 PHE 15 -2.464 41.041 -43.050 129 HE1 PHE 15 HE1 PHE 15 -2.319 39.034 -38.564 130 HE2 PHE 15 HE2 PHE 15 -1.560 42.331 -41.162 131 HZ PHE 15 HZ PHE 15 -1.439 41.308 -38.922 132 H GLY 16 H GLY 16 -5.608 40.869 -42.019 133 1HA GLY 16 1HA GLY 16 -7.268 41.229 -40.439 134 2HA GLY 16 2HA GLY 16 -7.701 39.529 -40.536 135 H GLU 17 H GLU 17 -6.150 41.919 -38.724 136 HA GLU 17 HA GLU 17 -4.379 40.236 -37.229 137 1HB GLU 17 1HB GLU 17 -4.354 42.822 -37.530 138 2HB GLU 17 2HB GLU 17 -5.517 42.821 -36.211 139 1HG GLU 17 1HG GLU 17 -3.429 41.174 -35.365 140 2HG GLU 17 2HG GLU 17 -2.664 42.567 -36.130 141 H ASN 18 H ASN 18 -7.556 41.662 -36.661 142 HA ASN 18 HA ASN 18 -9.266 41.157 -35.260 143 1HB ASN 18 1HB ASN 18 -8.527 38.853 -36.612 144 2HB ASN 18 2HB ASN 18 -8.661 38.325 -34.938 145 1HD2 ASN 18 1HD2 ASN 18 -10.548 37.339 -34.752 146 2HD2 ASN 18 2HD2 ASN 18 -12.073 37.963 -35.298 147 H ARG 19 H ARG 19 -7.370 42.260 -33.800 148 HA ARG 19 HA ARG 19 -6.444 42.478 -31.730 149 1HB ARG 19 1HB ARG 19 -8.933 42.429 -31.283 150 2HB ARG 19 2HB ARG 19 -8.749 40.738 -30.840 151 1HG ARG 19 1HG ARG 19 -8.410 41.463 -28.769 152 2HG ARG 19 2HG ARG 19 -6.822 41.992 -29.329 153 1HD ARG 19 1HD ARG 19 -8.850 43.921 -30.015 154 2HD ARG 19 2HD ARG 19 -8.871 43.580 -28.286 155 HE ARG 19 HE ARG 19 -6.715 44.454 -28.092 156 1HH1 ARG 19 1HH1 ARG 19 -7.900 44.582 -31.389 157 2HH1 ARG 19 2HH1 ARG 19 -6.585 45.573 -31.960 158 1HH2 ARG 19 1HH2 ARG 19 -5.024 45.827 -28.825 159 2HH2 ARG 19 2HH2 ARG 19 -4.982 46.319 -30.498 160 H ASP 20 H ASP 20 -4.817 40.905 -32.810 161 HA ASP 20 HA ASP 20 -4.785 38.269 -31.582 162 1HB ASP 20 1HB ASP 20 -4.051 38.953 -34.022 163 2HB ASP 20 2HB ASP 20 -2.509 39.276 -33.230 164 H LEU 21 H LEU 21 -4.662 39.379 -29.447 165 HA LEU 21 HA LEU 21 -1.893 39.380 -28.583 166 1HB LEU 21 1HB LEU 21 -3.114 41.795 -29.092 167 2HB LEU 21 2HB LEU 21 -3.404 41.580 -27.376 168 HG LEU 21 HG LEU 21 -0.793 41.035 -27.394 169 1HD1 LEU 21 1HD1 LEU 21 0.416 41.850 -29.101 170 2HD1 LEU 21 2HD1 LEU 21 -0.661 43.228 -29.344 171 3HD1 LEU 21 3HD1 LEU 21 -1.083 41.648 -30.010 172 1HD2 LEU 21 1HD2 LEU 21 -2.193 42.883 -26.241 173 2HD2 LEU 21 2HD2 LEU 21 -1.602 43.911 -27.546 174 3HD2 LEU 21 3HD2 LEU 21 -0.460 43.127 -26.455 175 H GLU 22 H GLU 22 -4.005 37.550 -28.264 176 HA GLU 22 HA GLU 22 -4.931 37.902 -25.513 177 1HB GLU 22 1HB GLU 22 -5.457 35.453 -27.164 178 2HB GLU 22 2HB GLU 22 -6.430 36.146 -25.876 179 1HG GLU 22 1HG GLU 22 -7.531 37.513 -27.264 180 2HG GLU 22 2HG GLU 22 -6.100 37.863 -28.232 181 H ARG 23 H ARG 23 -3.431 37.435 -24.037 182 HA ARG 23 HA ARG 23 -1.578 35.228 -24.547 183 1HB ARG 23 1HB ARG 23 -1.536 37.644 -22.790 184 2HB ARG 23 2HB ARG 23 -0.575 36.246 -22.325 185 1HG ARG 23 1HG ARG 23 -0.215 36.923 -25.117 186 2HG ARG 23 2HG ARG 23 0.177 38.271 -24.046 187 1HD ARG 23 1HD ARG 23 1.406 36.326 -22.711 188 2HD ARG 23 2HD ARG 23 1.470 35.619 -24.325 189 HE ARG 23 HE ARG 23 2.431 37.983 -24.893 190 1HH1 ARG 23 1HH1 ARG 23 3.088 36.057 -22.032 191 2HH1 ARG 23 2HH1 ARG 23 4.691 36.702 -21.816 192 1HH2 ARG 23 1HH2 ARG 23 4.521 38.817 -24.621 193 2HH2 ARG 23 2HH2 ARG 23 5.525 38.258 -23.310 194 H VAL 24 H VAL 24 -2.397 33.341 -23.943 195 HA VAL 24 HA VAL 24 -4.190 33.020 -21.720 196 HB VAL 24 HB VAL 24 -2.664 30.829 -23.132 197 1HG1 VAL 24 1HG1 VAL 24 -5.451 30.603 -22.096 198 2HG1 VAL 24 2HG1 VAL 24 -4.097 30.518 -20.971 199 3HG1 VAL 24 3HG1 VAL 24 -4.222 29.357 -22.291 200 1HG2 VAL 24 1HG2 VAL 24 -4.120 32.587 -24.533 201 2HG2 VAL 24 2HG2 VAL 24 -5.406 31.493 -24.025 202 3HG2 VAL 24 3HG2 VAL 24 -4.035 30.872 -24.942 203 H VAL 25 H VAL 25 -3.671 32.650 -19.646 204 HA VAL 25 HA VAL 25 -0.930 31.768 -19.033 205 HB VAL 25 HB VAL 25 -1.439 33.358 -16.896 206 1HG1 VAL 25 1HG1 VAL 25 0.533 33.152 -18.601 207 2HG1 VAL 25 2HG1 VAL 25 0.356 34.593 -17.601 208 3HG1 VAL 25 3HG1 VAL 25 -0.177 34.615 -19.282 209 1HG2 VAL 25 1HG2 VAL 25 -3.427 34.163 -18.570 210 2HG2 VAL 25 2HG2 VAL 25 -2.145 35.303 -18.978 211 3HG2 VAL 25 3HG2 VAL 25 -2.706 35.168 -17.313 212 H THR 26 H THR 26 -0.961 30.005 -17.851 213 HA THR 26 HA THR 26 -2.835 29.766 -15.640 214 HB THR 26 HB THR 26 -2.691 27.190 -16.950 215 HG1 THR 26 HG1 THR 26 -3.508 29.413 -18.487 216 1HG2 THR 26 1HG2 THR 26 -4.992 27.117 -16.495 217 2HG2 THR 26 2HG2 THR 26 -5.147 28.873 -16.533 218 3HG2 THR 26 3HG2 THR 26 -4.317 28.090 -15.189 219 H ALA 27 H ALA 27 -1.625 29.225 -13.925 220 HA ALA 27 HA ALA 27 1.043 28.186 -14.292 221 1HB ALA 27 1HB ALA 27 0.618 29.854 -12.574 222 2HB ALA 27 2HB ALA 27 1.209 28.358 -11.849 223 3HB ALA 27 3HB ALA 27 -0.506 28.759 -11.767 224 HA PRO 28 HA PRO 28 -0.090 23.893 -14.289 225 1HB PRO 28 1HB PRO 28 2.384 22.987 -13.393 226 2HB PRO 28 2HB PRO 28 1.951 23.287 -15.078 227 1HG PRO 28 1HG PRO 28 3.452 25.021 -13.168 228 2HG PRO 28 2HG PRO 28 3.710 24.773 -14.905 229 1HD PRO 28 1HD PRO 28 2.523 26.990 -13.966 230 2HD PRO 28 2HD PRO 28 2.011 26.242 -15.493 231 H VAL 29 H VAL 29 -1.206 22.866 -12.774 232 HA VAL 29 HA VAL 29 -0.549 23.420 -9.968 233 HB VAL 29 HB VAL 29 -2.948 22.452 -9.631 234 1HG1 VAL 29 1HG1 VAL 29 -3.103 24.600 -9.052 235 2HG1 VAL 29 2HG1 VAL 29 -3.637 24.921 -10.702 236 3HG1 VAL 29 3HG1 VAL 29 -1.934 25.086 -10.277 237 1HG2 VAL 29 1HG2 VAL 29 -3.067 23.282 -12.531 238 2HG2 VAL 29 2HG2 VAL 29 -4.448 22.868 -11.517 239 3HG2 VAL 29 3HG2 VAL 29 -3.248 21.638 -11.914 240 H SER 30 H SER 30 0.778 21.905 -9.238 241 HA SER 30 HA SER 30 0.359 19.109 -9.945 242 1HB SER 30 1HB SER 30 2.507 20.170 -8.122 243 2HB SER 30 2HB SER 30 2.532 18.721 -9.125 244 HG SER 30 HG SER 30 3.729 20.661 -9.900 245 H SER 31 H SER 31 -1.745 19.303 -8.769 246 HA SER 31 HA SER 31 -1.733 19.529 -5.928 247 1HB SER 31 1HB SER 31 -4.065 18.266 -7.231 248 2HB SER 31 2HB SER 31 -3.991 19.661 -6.152 249 HG SER 31 HG SER 31 -3.334 20.934 -7.884 250 H GLY 32 H GLY 32 -1.240 16.964 -8.130 251 1HA GLY 32 1HA GLY 32 -1.965 14.841 -6.312 252 2HA GLY 32 2HA GLY 32 -1.155 14.660 -7.863 253 H LYS 33 H LYS 33 -0.647 15.734 -4.541 254 HA LYS 33 HA LYS 33 2.200 15.698 -4.779 255 1HB LYS 33 1HB LYS 33 2.183 16.189 -2.358 256 2HB LYS 33 2HB LYS 33 1.151 17.274 -3.277 257 1HG LYS 33 1HG LYS 33 -0.772 16.439 -2.372 258 2HG LYS 33 2HG LYS 33 -0.069 14.850 -2.069 259 1HD LYS 33 1HD LYS 33 1.386 16.006 -0.326 260 2HD LYS 33 2HD LYS 33 0.299 17.384 -0.496 261 1HE LYS 33 1HE LYS 33 -1.273 15.033 -0.196 262 2HE LYS 33 2HE LYS 33 -0.043 15.044 1.067 263 1HZ LYS 33 1HZ LYS 33 -1.892 16.200 1.917 264 2HZ LYS 33 2HZ LYS 33 -2.086 17.115 0.505 265 3HZ LYS 33 3HZ LYS 33 -0.755 17.396 1.519 266 H ILE 34 H ILE 34 0.197 13.183 -4.759 267 HA ILE 34 HA ILE 34 2.149 11.484 -3.360 268 HB ILE 34 HB ILE 34 -0.856 11.153 -3.347 269 1HG1 ILE 34 1HG1 ILE 34 0.784 11.188 -0.868 270 2HG1 ILE 34 2HG1 ILE 34 0.580 12.720 -1.711 271 1HG2 ILE 34 1HG2 ILE 34 0.428 9.305 -1.619 272 2HG2 ILE 34 2HG2 ILE 34 1.163 9.157 -3.217 273 3HG2 ILE 34 3HG2 ILE 34 -0.583 8.975 -3.026 274 1HD1 ILE 34 1HD1 ILE 34 -1.526 12.933 -1.021 275 2HD1 ILE 34 2HD1 ILE 34 -1.127 11.675 0.147 276 3HD1 ILE 34 3HD1 ILE 34 -1.911 11.251 -1.374 277 H LYS 35 H LYS 35 2.909 9.851 -4.518 278 HA LYS 35 HA LYS 35 1.648 9.242 -7.115 279 1HB LYS 35 1HB LYS 35 4.550 9.401 -6.292 280 2HB LYS 35 2HB LYS 35 4.041 8.532 -7.739 281 1HG LYS 35 1HG LYS 35 3.108 11.331 -7.403 282 2HG LYS 35 2HG LYS 35 4.804 11.060 -7.810 283 1HD LYS 35 1HD LYS 35 4.324 10.365 -9.901 284 2HD LYS 35 2HD LYS 35 2.877 9.494 -9.385 285 1HE LYS 35 1HE LYS 35 1.521 11.256 -9.759 286 2HE LYS 35 2HE LYS 35 2.720 12.429 -9.220 287 1HZ LYS 35 1HZ LYS 35 2.932 12.916 -11.370 288 2HZ LYS 35 2HZ LYS 35 2.117 11.521 -11.874 289 3HZ LYS 35 3HZ LYS 35 3.776 11.456 -11.530 290 H ARG 36 H ARG 36 2.181 6.928 -7.858 291 HA ARG 36 HA ARG 36 2.415 5.123 -5.551 292 1HB ARG 36 1HB ARG 36 0.442 3.922 -6.075 293 2HB ARG 36 2HB ARG 36 0.004 5.624 -6.059 294 1HG ARG 36 1HG ARG 36 0.802 4.689 -8.694 295 2HG ARG 36 2HG ARG 36 -0.589 3.820 -8.039 296 1HD ARG 36 1HD ARG 36 -1.866 5.531 -8.664 297 2HD ARG 36 2HD ARG 36 -1.045 6.516 -7.456 298 HE ARG 36 HE ARG 36 0.266 6.291 -10.044 299 1HH1 ARG 36 1HH1 ARG 36 -1.817 8.166 -7.933 300 2HH1 ARG 36 2HH1 ARG 36 -1.570 9.650 -8.805 301 1HH2 ARG 36 1HH2 ARG 36 0.585 8.241 -11.190 302 2HH2 ARG 36 2HH2 ARG 36 -0.241 9.687 -10.680 303 H VAL 37 H VAL 37 3.099 3.037 -5.975 304 HA VAL 37 HA VAL 37 3.847 2.363 -8.729 305 HB VAL 37 HB VAL 37 6.023 1.439 -7.945 306 1HG1 VAL 37 1HG1 VAL 37 6.398 4.239 -7.236 307 2HG1 VAL 37 2HG1 VAL 37 5.416 4.012 -8.686 308 3HG1 VAL 37 3HG1 VAL 37 7.036 3.315 -8.601 309 1HG2 VAL 37 1HG2 VAL 37 5.289 2.883 -5.409 310 2HG2 VAL 37 2HG2 VAL 37 6.938 2.396 -5.807 311 3HG2 VAL 37 3HG2 VAL 37 5.678 1.176 -5.612 312 H ASN 38 H ASN 38 3.924 0.127 -9.131 313 HA ASN 38 HA ASN 38 2.813 -1.549 -6.968 314 1HB ASN 38 1HB ASN 38 1.425 -1.319 -9.088 315 2HB ASN 38 2HB ASN 38 2.711 -2.178 -9.923 316 1HD2 ASN 38 1HD2 ASN 38 -0.149 -2.494 -8.277 317 2HD2 ASN 38 2HD2 ASN 38 -0.082 -4.186 -7.923 318 H VAL 39 H VAL 39 4.392 -2.652 -6.031 319 HA VAL 39 HA VAL 39 6.776 -3.295 -7.615 320 HB VAL 39 HB VAL 39 6.684 -3.627 -4.644 321 1HG1 VAL 39 1HG1 VAL 39 8.642 -3.771 -6.647 322 2HG1 VAL 39 2HG1 VAL 39 8.873 -3.868 -4.901 323 3HG1 VAL 39 3HG1 VAL 39 8.990 -2.310 -5.721 324 1HG2 VAL 39 1HG2 VAL 39 6.723 -1.014 -6.121 325 2HG2 VAL 39 2HG2 VAL 39 7.462 -1.192 -4.530 326 3HG2 VAL 39 3HG2 VAL 39 5.737 -1.487 -4.738 327 H ASN 40 H ASN 40 7.741 -5.308 -7.569 328 HA ASN 40 HA ASN 40 5.955 -7.523 -6.825 329 1HB ASN 40 1HB ASN 40 6.525 -7.626 -9.152 330 2HB ASN 40 2HB ASN 40 8.227 -7.329 -8.814 331 1HD2 ASN 40 1HD2 ASN 40 9.387 -9.059 -9.167 332 2HD2 ASN 40 2HD2 ASN 40 8.940 -10.690 -8.793 333 H PHE 41 H PHE 41 6.423 -8.351 -4.911 334 HA PHE 41 HA PHE 41 9.195 -8.258 -3.952 335 1HB PHE 41 1HB PHE 41 6.553 -8.496 -2.512 336 2HB PHE 41 2HB PHE 41 8.100 -8.750 -1.712 337 HD1 PHE 41 HD1 PHE 41 9.820 -6.814 -1.940 338 HD2 PHE 41 HD2 PHE 41 5.631 -6.385 -2.556 339 HE1 PHE 41 HE1 PHE 41 10.018 -4.393 -1.560 340 HE2 PHE 41 HE2 PHE 41 5.820 -3.967 -2.172 341 HZ PHE 41 HZ PHE 41 7.982 -2.975 -1.588 342 H ASP 42 H ASP 42 10.310 -10.054 -3.612 343 HA ASP 42 HA ASP 42 9.195 -12.602 -4.343 344 1HB ASP 42 1HB ASP 42 11.341 -13.168 -4.681 345 2HB ASP 42 2HB ASP 42 11.756 -11.507 -4.288 346 H GLU 43 H GLU 43 9.380 -14.497 -2.886 347 HA GLU 43 HA GLU 43 7.786 -14.131 -0.658 348 1HB GLU 43 1HB GLU 43 9.299 -16.368 -1.820 349 2HB GLU 43 2HB GLU 43 8.978 -16.520 -0.098 350 1HG GLU 43 1HG GLU 43 6.879 -15.975 -2.179 351 2HG GLU 43 2HG GLU 43 7.267 -17.571 -1.541 352 H GLU 44 H GLU 44 11.304 -14.277 -0.852 353 HA GLU 44 HA GLU 44 11.859 -14.439 1.916 354 1HB GLU 44 1HB GLU 44 13.318 -13.699 -0.527 355 2HB GLU 44 2HB GLU 44 13.895 -12.897 0.927 356 1HG GLU 44 1HG GLU 44 13.607 -15.870 0.564 357 2HG GLU 44 2HG GLU 44 15.114 -14.963 0.453 358 H LYS 45 H LYS 45 11.535 -11.673 -0.261 359 HA LYS 45 HA LYS 45 11.878 -9.636 1.631 360 1HB LYS 45 1HB LYS 45 10.121 -9.576 -0.835 361 2HB LYS 45 2HB LYS 45 10.748 -8.180 0.029 362 1HG LYS 45 1HG LYS 45 12.986 -9.692 -0.609 363 2HG LYS 45 2HG LYS 45 11.958 -9.757 -2.043 364 1HD LYS 45 1HD LYS 45 12.509 -7.669 -2.570 365 2HD LYS 45 2HD LYS 45 11.968 -7.096 -0.990 366 1HE LYS 45 1HE LYS 45 14.186 -6.482 -0.983 367 2HE LYS 45 2HE LYS 45 14.240 -8.044 -0.166 368 1HZ LYS 45 1HZ LYS 45 15.976 -7.813 -1.860 369 2HZ LYS 45 2HZ LYS 45 14.787 -7.622 -3.058 370 3HZ LYS 45 3HZ LYS 45 14.912 -9.087 -2.214 371 H HIS 46 H HIS 46 8.899 -11.036 0.311 372 HA HIS 46 HA HIS 46 7.164 -9.440 1.802 373 1HB HIS 46 1HB HIS 46 6.776 -11.019 -0.277 374 2HB HIS 46 2HB HIS 46 6.273 -12.159 0.968 375 HD1 HIS 46 HD1 HIS 46 3.843 -12.140 1.262 376 HD2 HIS 46 HD2 HIS 46 5.292 -8.361 0.284 377 HE1 HIS 46 HE1 HIS 46 1.827 -10.633 1.181 378 HE2 HIS 46 HE2 HIS 46 2.707 -8.380 0.485 379 H THR 47 H THR 47 8.414 -12.684 2.539 380 HA THR 47 HA THR 47 6.756 -13.110 4.781 381 HB THR 47 HB THR 47 9.525 -14.256 4.388 382 HG1 THR 47 HG1 THR 47 8.467 -14.856 2.578 383 1HG2 THR 47 1HG2 THR 47 8.739 -16.087 5.746 384 2HG2 THR 47 2HG2 THR 47 7.123 -15.390 5.824 385 3HG2 THR 47 3HG2 THR 47 8.470 -14.580 6.624 386 H ARG 48 H ARG 48 10.077 -11.839 4.536 387 HA ARG 48 HA ARG 48 10.353 -11.338 7.323 388 1HB ARG 48 1HB ARG 48 12.210 -11.477 5.587 389 2HB ARG 48 2HB ARG 48 11.766 -9.840 5.127 390 1HG ARG 48 1HG ARG 48 13.554 -9.577 6.598 391 2HG ARG 48 2HG ARG 48 12.126 -9.235 7.576 392 1HD ARG 48 1HD ARG 48 13.555 -10.634 8.867 393 2HD ARG 48 2HD ARG 48 12.186 -11.612 8.341 394 HE ARG 48 HE ARG 48 14.300 -11.873 6.494 395 1HH1 ARG 48 1HH1 ARG 48 13.314 -12.882 9.696 396 2HH1 ARG 48 2HH1 ARG 48 14.353 -14.279 9.717 397 1HH2 ARG 48 1HH2 ARG 48 15.660 -13.712 6.503 398 2HH2 ARG 48 2HH2 ARG 48 15.675 -14.760 7.893 399 H PHE 49 H PHE 49 9.220 -9.444 4.594 400 HA PHE 49 HA PHE 49 8.956 -6.926 5.723 401 1HB PHE 49 1HB PHE 49 8.096 -8.231 3.387 402 2HB PHE 49 2HB PHE 49 6.633 -7.600 4.132 403 HD1 PHE 49 HD1 PHE 49 9.986 -6.050 4.284 404 HD2 PHE 49 HD2 PHE 49 6.089 -5.933 2.585 405 HE1 PHE 49 HE1 PHE 49 10.469 -3.834 3.336 406 HE2 PHE 49 HE2 PHE 49 6.565 -3.713 1.638 407 HZ PHE 49 HZ PHE 49 8.759 -2.661 2.013 408 H LYS 50 H LYS 50 6.528 -9.495 5.584 409 HA LYS 50 HA LYS 50 4.644 -8.168 7.210 410 1HB LYS 50 1HB LYS 50 4.948 -11.090 6.504 411 2HB LYS 50 2HB LYS 50 3.549 -10.410 7.324 412 1HG LYS 50 1HG LYS 50 4.323 -9.123 4.788 413 2HG LYS 50 2HG LYS 50 3.687 -10.765 4.674 414 1HD LYS 50 1HD LYS 50 2.175 -8.991 6.452 415 2HD LYS 50 2HD LYS 50 2.170 -8.500 4.757 416 1HE LYS 50 1HE LYS 50 1.139 -10.458 4.061 417 2HE LYS 50 2HE LYS 50 1.616 -11.340 5.512 418 1HZ LYS 50 1HZ LYS 50 -0.118 -10.529 6.690 419 2HZ LYS 50 2HZ LYS 50 -0.821 -10.425 5.149 420 3HZ LYS 50 3HZ LYS 50 -0.147 -9.042 5.866 421 H ALA 51 H ALA 51 7.013 -10.721 7.911 422 HA ALA 51 HA ALA 51 6.281 -11.191 10.565 423 1HB ALA 51 1HB ALA 51 9.139 -11.470 10.116 424 2HB ALA 51 2HB ALA 51 8.175 -12.203 8.836 425 3HB ALA 51 3HB ALA 51 7.929 -12.691 10.510 426 H ALA 52 H ALA 52 8.818 -9.037 9.292 427 HA ALA 52 HA ALA 52 9.661 -8.090 11.812 428 1HB ALA 52 1HB ALA 52 10.295 -7.595 9.075 429 2HB ALA 52 2HB ALA 52 11.251 -7.265 10.517 430 3HB ALA 52 3HB ALA 52 10.115 -6.056 9.919 431 H CYS 53 H CYS 53 7.423 -6.658 9.422 432 HA CYS 53 HA CYS 53 6.852 -4.330 10.818 433 1HB CYS 53 1HB CYS 53 5.155 -3.961 9.273 434 2HB CYS 53 2HB CYS 53 6.224 -5.056 8.412 435 HG CYS 53 HG CYS 53 4.556 -7.323 9.190 436 H ALA 54 H ALA 54 5.272 -7.486 11.003 437 HA ALA 54 HA ALA 54 3.223 -6.714 12.790 438 1HB ALA 54 1HB ALA 54 4.191 -9.492 12.954 439 2HB ALA 54 2HB ALA 54 3.691 -8.937 11.355 440 3HB ALA 54 3HB ALA 54 2.559 -8.868 12.708 441 H ARG 55 H ARG 55 6.522 -7.802 13.277 442 HA ARG 55 HA ARG 55 6.247 -8.162 16.103 443 1HB ARG 55 1HB ARG 55 8.396 -8.368 14.109 444 2HB ARG 55 2HB ARG 55 8.928 -7.860 15.707 445 1HG ARG 55 1HG ARG 55 8.535 -9.868 16.624 446 2HG ARG 55 2HG ARG 55 7.076 -10.136 15.669 447 1HD ARG 55 1HD ARG 55 8.360 -10.805 13.766 448 2HD ARG 55 2HD ARG 55 9.866 -10.320 14.546 449 HE ARG 55 HE ARG 55 8.388 -12.764 14.966 450 1HH1 ARG 55 1HH1 ARG 55 10.873 -10.609 16.147 451 2HH1 ARG 55 2HH1 ARG 55 11.507 -11.755 17.296 452 1HH2 ARG 55 1HH2 ARG 55 9.195 -14.269 16.474 453 2HH2 ARG 55 2HH2 ARG 55 10.530 -13.839 17.499 454 H LYS 56 H LYS 56 7.419 -5.585 14.006 455 HA LYS 56 HA LYS 56 8.318 -3.949 16.187 456 1HB LYS 56 1HB LYS 56 7.927 -3.391 13.244 457 2HB LYS 56 2HB LYS 56 8.572 -2.210 14.376 458 1HG LYS 56 1HG LYS 56 10.572 -3.305 14.595 459 2HG LYS 56 2HG LYS 56 9.874 -4.882 14.212 460 1HD LYS 56 1HD LYS 56 10.306 -4.648 12.034 461 2HD LYS 56 2HD LYS 56 9.648 -3.010 12.003 462 1HE LYS 56 1HE LYS 56 12.344 -3.574 13.187 463 2HE LYS 56 2HE LYS 56 12.143 -3.361 11.448 464 1HZ LYS 56 1HZ LYS 56 12.647 -1.246 12.206 465 2HZ LYS 56 2HZ LYS 56 11.710 -1.402 13.610 466 3HZ LYS 56 3HZ LYS 56 10.952 -1.202 12.107 467 H GLY 57 H GLY 57 5.348 -4.409 14.505 468 1HA GLY 57 1HA GLY 57 3.253 -3.593 15.205 469 2HA GLY 57 2HA GLY 57 4.075 -2.378 16.176 470 H THR 58 H THR 58 5.036 -2.923 12.918 471 HA THR 58 HA THR 58 4.169 -0.225 12.207 472 HB THR 58 HB THR 58 5.857 -1.898 10.404 473 HG1 THR 58 HG1 THR 58 6.638 -0.878 12.943 474 1HG2 THR 58 1HG2 THR 58 6.631 0.087 9.620 475 2HG2 THR 58 2HG2 THR 58 6.520 0.874 11.196 476 3HG2 THR 58 3HG2 THR 58 5.066 0.635 10.227 477 H SER 59 H SER 59 2.940 0.220 10.399 478 HA SER 59 HA SER 59 1.299 -1.926 9.341 479 1HB SER 59 1HB SER 59 1.290 0.851 8.215 480 2HB SER 59 2HB SER 59 -0.057 -0.263 8.448 481 HG SER 59 HG SER 59 1.329 1.210 10.449 482 H ILE 60 H ILE 60 1.549 -2.863 7.369 483 HA ILE 60 HA ILE 60 4.033 -3.055 6.243 484 HB ILE 60 HB ILE 60 2.353 -4.724 5.834 485 1HG1 ILE 60 1HG1 ILE 60 2.570 -4.102 3.035 486 2HG1 ILE 60 2HG1 ILE 60 4.068 -3.674 3.857 487 1HG2 ILE 60 1HG2 ILE 60 0.306 -4.382 5.009 488 2HG2 ILE 60 2HG2 ILE 60 0.888 -3.313 3.736 489 3HG2 ILE 60 3HG2 ILE 60 0.620 -2.682 5.360 490 1HD1 ILE 60 1HD1 ILE 60 4.407 -5.881 4.598 491 2HD1 ILE 60 2HD1 ILE 60 3.926 -6.003 2.904 492 3HD1 ILE 60 3HD1 ILE 60 2.759 -6.355 4.180 493 H THR 61 H THR 61 1.415 -0.922 5.178 494 HA THR 61 HA THR 61 2.684 0.075 2.884 495 HB THR 61 HB THR 61 0.913 1.918 4.358 496 HG1 THR 61 HG1 THR 61 -0.731 0.559 4.570 497 1HG2 THR 61 1HG2 THR 61 1.603 1.295 1.659 498 2HG2 THR 61 2HG2 THR 61 0.605 2.617 2.264 499 3HG2 THR 61 3HG2 THR 61 -0.132 1.069 1.866 500 H ASP 62 H ASP 62 2.770 1.097 6.258 501 HA ASP 62 HA ASP 62 4.291 3.471 5.817 502 1HB ASP 62 1HB ASP 62 2.858 2.708 7.898 503 2HB ASP 62 2HB ASP 62 4.380 1.990 8.415 504 H VAL 63 H VAL 63 5.027 0.107 6.383 505 HA VAL 63 HA VAL 63 7.772 0.304 6.966 506 HB VAL 63 HB VAL 63 6.212 -1.886 5.589 507 1HG1 VAL 63 1HG1 VAL 63 8.299 -2.464 4.869 508 2HG1 VAL 63 2HG1 VAL 63 8.310 -3.226 6.461 509 3HG1 VAL 63 3HG1 VAL 63 9.106 -1.669 6.223 510 1HG2 VAL 63 1HG2 VAL 63 6.836 -2.960 7.902 511 2HG2 VAL 63 2HG2 VAL 63 5.445 -1.887 7.745 512 3HG2 VAL 63 3HG2 VAL 63 6.961 -1.274 8.401 513 H VAL 64 H VAL 64 6.127 -0.271 3.845 514 HA VAL 64 HA VAL 64 8.416 -0.214 2.239 515 HB VAL 64 HB VAL 64 5.821 0.896 1.220 516 1HG1 VAL 64 1HG1 VAL 64 8.114 0.479 -0.054 517 2HG1 VAL 64 2HG1 VAL 64 6.554 0.230 -0.833 518 3HG1 VAL 64 3HG1 VAL 64 7.449 -1.149 -0.193 519 1HG2 VAL 64 1HG2 VAL 64 6.082 -2.016 1.065 520 2HG2 VAL 64 2HG2 VAL 64 4.673 -1.019 1.425 521 3HG2 VAL 64 3HG2 VAL 64 5.831 -1.403 2.699 522 H ASN 65 H ASN 65 6.293 2.403 3.290 523 HA ASN 65 HA ASN 65 7.483 4.466 1.788 524 1HB ASN 65 1HB ASN 65 5.490 4.236 3.846 525 2HB ASN 65 2HB ASN 65 6.569 5.580 4.223 526 1HD2 ASN 65 1HD2 ASN 65 3.851 4.676 2.598 527 2HD2 ASN 65 2HD2 ASN 65 3.744 5.976 1.460 528 H GLN 66 H GLN 66 8.332 2.977 4.828 529 HA GLN 66 HA GLN 66 10.181 4.955 5.686 530 1HB GLN 66 1HB GLN 66 9.178 2.454 6.651 531 2HB GLN 66 2HB GLN 66 10.934 2.438 6.742 532 1HG GLN 66 1HG GLN 66 10.256 4.925 7.714 533 2HG GLN 66 2HG GLN 66 9.001 3.866 8.354 534 1HE2 GLN 66 1HE2 GLN 66 9.440 2.852 10.175 535 2HE2 GLN 66 2HE2 GLN 66 11.028 2.595 10.836 536 H LEU 67 H LEU 67 10.683 1.735 4.200 537 HA LEU 67 HA LEU 67 13.460 1.931 4.052 538 1HB LEU 67 1HB LEU 67 12.741 0.426 1.815 539 2HB LEU 67 2HB LEU 67 13.193 -0.165 3.400 540 HG LEU 67 HG LEU 67 10.424 0.565 3.421 541 1HD1 LEU 67 1HD1 LEU 67 9.781 -1.349 1.838 542 2HD1 LEU 67 2HD1 LEU 67 11.370 -1.090 1.118 543 3HD1 LEU 67 3HD1 LEU 67 10.187 0.217 1.141 544 1HD2 LEU 67 1HD2 LEU 67 10.414 -1.196 4.765 545 2HD2 LEU 67 2HD2 LEU 67 12.140 -1.377 4.449 546 3HD2 LEU 67 3HD2 LEU 67 10.966 -2.256 3.467 547 H VAL 68 H VAL 68 11.012 2.906 1.675 548 HA VAL 68 HA VAL 68 12.776 3.652 -0.383 549 HB VAL 68 HB VAL 68 10.097 4.891 0.291 550 1HG1 VAL 68 1HG1 VAL 68 11.870 5.096 -2.125 551 2HG1 VAL 68 2HG1 VAL 68 11.165 6.396 -1.166 552 3HG1 VAL 68 3HG1 VAL 68 10.137 5.411 -2.204 553 1HG2 VAL 68 1HG2 VAL 68 10.724 2.760 -1.739 554 2HG2 VAL 68 2HG2 VAL 68 9.137 3.379 -1.287 555 3HG2 VAL 68 3HG2 VAL 68 10.076 2.435 -0.130 556 H ASP 69 H ASP 69 11.432 5.511 2.313 557 HA ASP 69 HA ASP 69 12.663 7.973 1.719 558 1HB ASP 69 1HB ASP 69 10.835 7.752 3.353 559 2HB ASP 69 2HB ASP 69 11.898 6.833 4.419 560 H ASN 70 H ASN 70 13.644 5.368 3.921 561 HA ASN 70 HA ASN 70 15.982 6.573 4.842 562 1HB ASN 70 1HB ASN 70 15.010 3.745 4.732 563 2HB ASN 70 2HB ASN 70 16.670 4.068 5.231 564 1HD2 ASN 70 1HD2 ASN 70 13.308 4.815 5.912 565 2HD2 ASN 70 2HD2 ASN 70 13.527 5.178 7.589 566 H TRP 71 H TRP 71 15.549 4.275 2.154 567 HA TRP 71 HA TRP 71 18.261 4.124 1.410 568 1HB TRP 71 1HB TRP 71 16.485 2.584 0.594 569 2HB TRP 71 2HB TRP 71 15.839 3.891 -0.390 570 HD1 TRP 71 HD1 TRP 71 18.819 1.486 -0.186 571 HE1 TRP 71 HE1 TRP 71 20.048 1.501 -2.446 572 HE3 TRP 71 HE3 TRP 71 16.195 5.202 -2.529 573 HZ2 TRP 71 HZ2 TRP 71 19.912 2.873 -4.892 574 HZ3 TRP 71 HZ3 TRP 71 16.795 5.785 -4.841 575 HH2 TRP 71 HH2 TRP 71 18.614 4.636 -6.002 576 H LEU 72 H LEU 72 15.660 6.295 0.368 577 HA LEU 72 HA LEU 72 17.107 7.624 -1.627 578 1HB LEU 72 1HB LEU 72 14.661 8.252 -0.041 579 2HB LEU 72 2HB LEU 72 15.367 9.505 -1.044 580 HG LEU 72 HG LEU 72 14.444 6.806 -2.031 581 1HD1 LEU 72 1HD1 LEU 72 13.145 9.474 -1.853 582 2HD1 LEU 72 2HD1 LEU 72 12.461 7.867 -1.626 583 3HD1 LEU 72 3HD1 LEU 72 12.810 8.456 -3.252 584 1HD2 LEU 72 1HD2 LEU 72 16.368 8.241 -3.168 585 2HD2 LEU 72 2HD2 LEU 72 14.976 9.095 -3.832 586 3HD2 LEU 72 3HD2 LEU 72 15.162 7.365 -4.110 587 H LYS 73 H LYS 73 16.872 8.241 1.839 588 HA LYS 73 HA LYS 73 18.286 10.750 1.573 589 1HB LYS 73 1HB LYS 73 17.561 9.282 4.112 590 2HB LYS 73 2HB LYS 73 18.005 10.976 3.957 591 1HG LYS 73 1HG LYS 73 15.782 10.420 2.250 592 2HG LYS 73 2HG LYS 73 15.439 9.838 3.877 593 1HD LYS 73 1HD LYS 73 16.681 12.465 3.874 594 2HD LYS 73 2HD LYS 73 15.164 12.433 2.970 595 1HE LYS 73 1HE LYS 73 15.197 11.067 5.598 596 2HE LYS 73 2HE LYS 73 15.271 12.828 5.613 597 1HZ LYS 73 1HZ LYS 73 13.273 12.780 4.126 598 2HZ LYS 73 2HZ LYS 73 13.003 12.219 5.704 599 3HZ LYS 73 3HZ LYS 73 13.159 11.113 4.427 600 H GLU 74 H GLU 74 18.987 7.472 2.621 601 HA GLU 74 HA GLU 74 21.536 8.122 3.720 602 1HB GLU 74 1HB GLU 74 20.023 5.613 3.172 603 2HB GLU 74 2HB GLU 74 21.750 5.496 3.484 604 1HG GLU 74 1HG GLU 74 19.647 6.653 5.294 605 2HG GLU 74 2HG GLU 74 20.554 5.159 5.528 606 H ASN 75 H ASN 75 20.477 6.768 0.617 607 HA ASN 75 HA ASN 75 23.231 6.395 -0.197 608 1HB ASN 75 1HB ASN 75 22.426 4.873 -1.625 609 2HB ASN 75 2HB ASN 75 20.877 5.097 -0.817 610 1HD2 ASN 75 1HD2 ASN 75 19.285 6.328 -1.810 611 2HD2 ASN 75 2HD2 ASN 75 19.340 6.670 -3.502 612 H GLU 76 H GLU 76 21.143 8.973 -0.174 613 HA GLU 76 HA GLU 76 21.757 10.217 -2.661 614 1HB GLU 76 1HB GLU 76 20.228 10.847 -0.330 615 2HB GLU 76 2HB GLU 76 21.310 12.193 -0.663 616 1HG GLU 76 1HG GLU 76 20.400 11.806 -3.128 617 2HG GLU 76 2HG GLU 76 19.029 11.148 -2.237 618 1H MET 1 1H MET 1 -57.786 -61.728 8.482 619 2H MET 1 2H MET 1 -57.551 -62.311 10.054 620 3H MET 1 3H MET 1 -56.301 -61.483 9.262 621 HA MET 1 HA MET 1 -58.837 -60.403 10.319 622 1HB MET 1 1HB MET 1 -56.861 -60.636 11.811 623 2HB MET 1 2HB MET 1 -55.949 -59.601 10.720 624 1HG MET 1 1HG MET 1 -56.812 -58.429 12.712 625 2HG MET 1 2HG MET 1 -57.377 -57.742 11.191 626 1HE MET 1 1HE MET 1 -60.928 -57.277 11.931 627 2HE MET 1 2HE MET 1 -59.934 -57.580 10.509 628 3HE MET 1 3HE MET 1 -59.356 -56.495 11.770 629 H SER 2 H SER 2 -55.928 -59.445 8.463 630 HA SER 2 HA SER 2 -57.436 -57.196 7.362 631 1HB SER 2 1HB SER 2 -54.805 -57.320 6.283 632 2HB SER 2 2HB SER 2 -55.440 -56.177 7.465 633 HG SER 2 HG SER 2 -54.608 -57.333 9.077 634 H LEU 3 H LEU 3 -57.085 -56.756 4.966 635 HA LEU 3 HA LEU 3 -57.900 -59.090 3.476 636 1HB LEU 3 1HB LEU 3 -58.766 -56.722 3.158 637 2HB LEU 3 2HB LEU 3 -57.230 -56.353 2.399 638 HG LEU 3 HG LEU 3 -57.727 -58.148 0.712 639 1HD1 LEU 3 1HD1 LEU 3 -60.124 -58.360 2.404 640 2HD1 LEU 3 2HD1 LEU 3 -59.326 -59.574 1.404 641 3HD1 LEU 3 3HD1 LEU 3 -60.406 -58.391 0.665 642 1HD2 LEU 3 1HD2 LEU 3 -58.103 -55.703 0.359 643 2HD2 LEU 3 2HD2 LEU 3 -59.787 -55.957 0.816 644 3HD2 LEU 3 3HD2 LEU 3 -59.133 -56.755 -0.613 645 H GLU 4 H GLU 4 -54.992 -57.758 4.382 646 HA GLU 4 HA GLU 4 -52.824 -58.124 3.883 647 1HB GLU 4 1HB GLU 4 -53.643 -60.410 2.106 648 2HB GLU 4 2HB GLU 4 -52.171 -60.228 3.050 649 1HG GLU 4 1HG GLU 4 -54.908 -60.565 4.254 650 2HG GLU 4 2HG GLU 4 -53.800 -61.896 3.934 651 H LYS 5 H LYS 5 -54.387 -56.360 2.269 652 HA LYS 5 HA LYS 5 -53.177 -56.563 -0.387 653 1HB LYS 5 1HB LYS 5 -55.568 -55.864 -0.138 654 2HB LYS 5 2HB LYS 5 -55.015 -54.430 0.712 655 1HG LYS 5 1HG LYS 5 -54.085 -53.493 -1.196 656 2HG LYS 5 2HG LYS 5 -54.016 -55.041 -2.041 657 1HD LYS 5 1HD LYS 5 -56.690 -54.039 -1.234 658 2HD LYS 5 2HD LYS 5 -55.876 -53.206 -2.562 659 1HE LYS 5 1HE LYS 5 -56.023 -56.188 -2.562 660 2HE LYS 5 2HE LYS 5 -57.444 -55.252 -3.027 661 1HZ LYS 5 1HZ LYS 5 -54.795 -54.774 -4.256 662 2HZ LYS 5 2HZ LYS 5 -56.323 -54.317 -4.834 663 3HZ LYS 5 3HZ LYS 5 -55.857 -55.949 -4.861 664 H ALA 6 H ALA 6 -53.078 -54.708 2.574 665 HA ALA 6 HA ALA 6 -50.958 -52.976 1.562 666 1HB ALA 6 1HB ALA 6 -52.960 -52.515 3.349 667 2HB ALA 6 2HB ALA 6 -51.482 -51.562 3.228 668 3HB ALA 6 3HB ALA 6 -51.601 -52.855 4.421 669 H HIS 7 H HIS 7 -49.619 -54.919 1.176 670 HA HIS 7 HA HIS 7 -48.382 -55.936 3.644 671 1HB HIS 7 1HB HIS 7 -48.990 -57.138 1.034 672 2HB HIS 7 2HB HIS 7 -47.365 -57.485 1.622 673 HD1 HIS 7 HD1 HIS 7 -47.771 -59.921 2.207 674 HD2 HIS 7 HD2 HIS 7 -50.442 -57.319 4.045 675 HE1 HIS 7 HE1 HIS 7 -49.035 -61.312 3.881 676 HE2 HIS 7 HE2 HIS 7 -50.754 -59.751 4.864 677 H THR 8 H THR 8 -47.918 -53.366 2.247 678 HA THR 8 HA THR 8 -45.470 -53.364 0.880 679 HB THR 8 HB THR 8 -45.744 -50.923 2.319 680 HG1 THR 8 HG1 THR 8 -47.850 -51.390 2.863 681 1HG2 THR 8 1HG2 THR 8 -46.791 -51.407 -0.456 682 2HG2 THR 8 2HG2 THR 8 -45.062 -51.437 -0.117 683 3HG2 THR 8 3HG2 THR 8 -45.996 -49.974 0.189 684 H SER 9 H SER 9 -43.701 -54.273 1.747 685 HA SER 9 HA SER 9 -42.931 -53.421 4.461 686 1HB SER 9 1HB SER 9 -41.678 -55.900 3.594 687 2HB SER 9 2HB SER 9 -42.545 -55.544 5.087 688 HG SER 9 HG SER 9 -44.347 -55.653 3.151 689 H VAL 10 H VAL 10 -41.508 -51.835 4.039 690 HA VAL 10 HA VAL 10 -39.313 -52.461 2.172 691 HB VAL 10 HB VAL 10 -39.190 -49.797 2.176 692 1HG1 VAL 10 1HG1 VAL 10 -41.285 -50.768 0.361 693 2HG1 VAL 10 2HG1 VAL 10 -39.793 -51.711 0.363 694 3HG1 VAL 10 3HG1 VAL 10 -39.747 -49.985 0.006 695 1HG2 VAL 10 1HG2 VAL 10 -41.423 -48.811 2.083 696 2HG2 VAL 10 2HG2 VAL 10 -41.099 -49.498 3.674 697 3HG2 VAL 10 3HG2 VAL 10 -42.131 -50.361 2.536 698 H LYS 11 H LYS 11 -37.542 -52.860 3.253 699 HA LYS 11 HA LYS 11 -36.743 -51.048 5.419 700 1HB LYS 11 1HB LYS 11 -37.661 -53.465 6.092 701 2HB LYS 11 2HB LYS 11 -36.014 -53.925 5.683 702 1HG LYS 11 1HG LYS 11 -35.972 -51.595 7.344 703 2HG LYS 11 2HG LYS 11 -36.963 -52.847 8.094 704 1HD LYS 11 1HD LYS 11 -34.365 -53.680 6.930 705 2HD LYS 11 2HD LYS 11 -34.318 -52.726 8.413 706 1HE LYS 11 1HE LYS 11 -36.319 -54.770 8.624 707 2HE LYS 11 2HE LYS 11 -34.776 -55.484 8.150 708 1HZ LYS 11 1HZ LYS 11 -35.237 -53.720 10.498 709 2HZ LYS 11 2HZ LYS 11 -33.738 -54.367 10.039 710 3HZ LYS 11 3HZ LYS 11 -34.989 -55.399 10.546 711 H LYS 12 H LYS 12 -35.732 -50.294 3.336 712 HA LYS 12 HA LYS 12 -33.577 -51.890 2.291 713 1HB LYS 12 1HB LYS 12 -34.133 -48.988 1.699 714 2HB LYS 12 2HB LYS 12 -33.284 -50.151 0.691 715 1HG LYS 12 1HG LYS 12 -35.410 -51.403 0.434 716 2HG LYS 12 2HG LYS 12 -36.225 -50.116 1.322 717 1HD LYS 12 1HD LYS 12 -36.490 -49.040 -0.605 718 2HD LYS 12 2HD LYS 12 -34.739 -48.834 -0.675 719 1HE LYS 12 1HE LYS 12 -35.631 -51.480 -1.524 720 2HE LYS 12 2HE LYS 12 -36.280 -50.175 -2.517 721 1HZ LYS 12 1HZ LYS 12 -33.984 -51.234 -3.072 722 2HZ LYS 12 2HZ LYS 12 -33.411 -50.189 -1.864 723 3HZ LYS 12 3HZ LYS 12 -34.205 -49.556 -3.222 724 H MET 13 H MET 13 -32.295 -52.133 4.181 725 HA MET 13 HA MET 13 -30.927 -49.725 5.148 726 1HB MET 13 1HB MET 13 -31.717 -52.179 6.354 727 2HB MET 13 2HB MET 13 -29.960 -52.112 6.388 728 1HG MET 13 1HG MET 13 -30.195 -50.913 8.240 729 2HG MET 13 2HG MET 13 -30.681 -49.588 7.183 730 1HE MET 13 1HE MET 13 -33.193 -48.339 7.735 731 2HE MET 13 2HE MET 13 -34.439 -49.511 7.299 732 3HE MET 13 3HE MET 13 -32.999 -49.347 6.299 733 H THR 14 H THR 14 -30.502 -50.530 2.516 734 HA THR 14 HA THR 14 -28.192 -52.151 2.241 735 HB THR 14 HB THR 14 -28.626 -50.387 0.004 736 HG1 THR 14 HG1 THR 14 -30.922 -51.904 0.717 737 1HG2 THR 14 1HG2 THR 14 -27.631 -52.552 -0.278 738 2HG2 THR 14 2HG2 THR 14 -29.190 -52.568 -1.103 739 3HG2 THR 14 3HG2 THR 14 -29.018 -53.345 0.472 740 H PHE 15 H PHE 15 -26.093 -51.615 2.015 741 HA PHE 15 HA PHE 15 -25.351 -48.882 2.719 742 1HB PHE 15 1HB PHE 15 -24.070 -51.544 2.903 743 2HB PHE 15 2HB PHE 15 -22.989 -50.196 2.565 744 HD1 PHE 15 HD1 PHE 15 -21.991 -49.236 4.378 745 HD2 PHE 15 HD2 PHE 15 -25.867 -50.928 4.823 746 HE1 PHE 15 HE1 PHE 15 -21.959 -48.659 6.769 747 HE2 PHE 15 HE2 PHE 15 -25.850 -50.355 7.215 748 HZ PHE 15 HZ PHE 15 -23.892 -49.221 8.193 749 H GLY 16 H GLY 16 -23.670 -47.768 1.551 750 1HA GLY 16 1HA GLY 16 -23.274 -48.659 -1.223 751 2HA GLY 16 2HA GLY 16 -23.965 -47.067 -0.937 752 H GLU 17 H GLU 17 -21.395 -48.811 0.755 753 HA GLU 17 HA GLU 17 -19.780 -46.580 1.168 754 1HB GLU 17 1HB GLU 17 -19.698 -48.845 2.315 755 2HB GLU 17 2HB GLU 17 -18.767 -49.407 0.936 756 1HG GLU 17 1HG GLU 17 -17.444 -47.119 1.675 757 2HG GLU 17 2HG GLU 17 -17.951 -47.808 3.217 758 H ASN 18 H ASN 18 -19.635 -49.050 -1.351 759 HA ASN 18 HA ASN 18 -18.605 -49.150 -3.376 760 1HB ASN 18 1HB ASN 18 -20.088 -46.953 -3.411 761 2HB ASN 18 2HB ASN 18 -18.518 -46.171 -3.547 762 1HD2 ASN 18 1HD2 ASN 18 -20.262 -45.850 -5.547 763 2HD2 ASN 18 2HD2 ASN 18 -19.786 -46.768 -6.941 764 H ARG 19 H ARG 19 -16.838 -49.336 -1.291 765 HA ARG 19 HA ARG 19 -14.653 -49.216 -0.716 766 1HB ARG 19 1HB ARG 19 -14.577 -48.889 -3.690 767 2HB ARG 19 2HB ARG 19 -13.089 -48.732 -2.766 768 1HG ARG 19 1HG ARG 19 -14.866 -51.119 -2.439 769 2HG ARG 19 2HG ARG 19 -13.683 -51.026 -3.746 770 1HD ARG 19 1HD ARG 19 -11.874 -50.869 -2.215 771 2HD ARG 19 2HD ARG 19 -12.962 -50.602 -0.855 772 HE ARG 19 HE ARG 19 -12.819 -53.156 -2.331 773 1HH1 ARG 19 1HH1 ARG 19 -13.030 -51.333 0.667 774 2HH1 ARG 19 2HH1 ARG 19 -13.099 -52.755 1.668 775 1HH2 ARG 19 1HH2 ARG 19 -12.902 -55.017 -1.021 776 2HH2 ARG 19 2HH2 ARG 19 -13.008 -54.852 0.711 777 H ASP 20 H ASP 20 -15.072 -47.361 0.603 778 HA ASP 20 HA ASP 20 -14.553 -44.723 -0.455 779 1HB ASP 20 1HB ASP 20 -16.144 -45.101 1.419 780 2HB ASP 20 2HB ASP 20 -14.794 -45.602 2.435 781 H LEU 21 H LEU 21 -12.452 -45.283 -1.344 782 HA LEU 21 HA LEU 21 -10.319 -45.302 0.683 783 1HB LEU 21 1HB LEU 21 -10.356 -46.321 -2.156 784 2HB LEU 21 2HB LEU 21 -8.891 -46.178 -1.206 785 HG LEU 21 HG LEU 21 -11.217 -47.837 -0.267 786 1HD1 LEU 21 1HD1 LEU 21 -10.220 -48.418 -2.613 787 2HD1 LEU 21 2HD1 LEU 21 -10.509 -49.686 -1.424 788 3HD1 LEU 21 3HD1 LEU 21 -8.880 -49.054 -1.658 789 1HD2 LEU 21 1HD2 LEU 21 -9.642 -48.858 1.163 790 2HD2 LEU 21 2HD2 LEU 21 -9.340 -47.126 1.279 791 3HD2 LEU 21 3HD2 LEU 21 -8.280 -48.140 0.303 792 H GLU 22 H GLU 22 -11.862 -43.051 -0.625 793 HA GLU 22 HA GLU 22 -9.946 -41.691 -2.268 794 1HB GLU 22 1HB GLU 22 -12.697 -41.260 -1.392 795 2HB GLU 22 2HB GLU 22 -11.753 -39.777 -1.431 796 1HG GLU 22 1HG GLU 22 -13.050 -40.476 -3.534 797 2HG GLU 22 2HG GLU 22 -11.390 -39.906 -3.709 798 H ARG 23 H ARG 23 -8.097 -41.310 -1.233 799 HA ARG 23 HA ARG 23 -8.211 -39.541 1.110 800 1HB ARG 23 1HB ARG 23 -7.679 -42.117 1.467 801 2HB ARG 23 2HB ARG 23 -6.074 -41.617 0.959 802 1HG ARG 23 1HG ARG 23 -6.125 -41.567 3.327 803 2HG ARG 23 2HG ARG 23 -6.123 -39.896 2.765 804 1HD ARG 23 1HD ARG 23 -7.728 -40.534 4.664 805 2HD ARG 23 2HD ARG 23 -8.360 -39.574 3.330 806 HE ARG 23 HE ARG 23 -9.631 -41.389 2.636 807 1HH1 ARG 23 1HH1 ARG 23 -7.621 -42.236 5.381 808 2HH1 ARG 23 2HH1 ARG 23 -8.434 -43.752 5.660 809 1HH2 ARG 23 1HH2 ARG 23 -10.733 -43.347 3.048 810 2HH2 ARG 23 2HH2 ARG 23 -10.196 -44.376 4.346 811 H VAL 24 H VAL 24 -7.386 -39.679 -1.962 812 HA VAL 24 HA VAL 24 -4.698 -38.617 -1.803 813 HB VAL 24 HB VAL 24 -6.568 -38.793 -4.176 814 1HG1 VAL 24 1HG1 VAL 24 -3.743 -38.673 -4.774 815 2HG1 VAL 24 2HG1 VAL 24 -4.272 -37.247 -3.882 816 3HG1 VAL 24 3HG1 VAL 24 -5.066 -37.685 -5.395 817 1HG2 VAL 24 1HG2 VAL 24 -5.567 -40.916 -2.952 818 2HG2 VAL 24 2HG2 VAL 24 -4.142 -40.488 -3.900 819 3HG2 VAL 24 3HG2 VAL 24 -5.672 -40.823 -4.710 820 H VAL 25 H VAL 25 -4.437 -36.637 -1.055 821 HA VAL 25 HA VAL 25 -6.461 -34.603 -1.698 822 HB VAL 25 HB VAL 25 -6.329 -34.791 0.657 823 1HG1 VAL 25 1HG1 VAL 25 -3.392 -35.028 0.208 824 2HG1 VAL 25 2HG1 VAL 25 -4.468 -36.009 1.207 825 3HG1 VAL 25 3HG1 VAL 25 -3.982 -34.398 1.748 826 1HG2 VAL 25 1HG2 VAL 25 -6.470 -32.531 0.345 827 2HG2 VAL 25 2HG2 VAL 25 -4.917 -32.435 -0.485 828 3HG2 VAL 25 3HG2 VAL 25 -4.970 -32.617 1.268 829 H THR 26 H THR 26 -5.881 -32.802 -2.796 830 HA THR 26 HA THR 26 -3.336 -32.871 -4.130 831 HB THR 26 HB THR 26 -4.902 -30.441 -4.539 832 HG1 THR 26 HG1 THR 26 -6.132 -33.003 -4.777 833 1HG2 THR 26 1HG2 THR 26 -4.739 -31.137 -6.878 834 2HG2 THR 26 2HG2 THR 26 -4.122 -32.711 -6.377 835 3HG2 THR 26 3HG2 THR 26 -3.171 -31.257 -6.080 836 H ALA 27 H ALA 27 -1.550 -31.919 -3.488 837 HA ALA 27 HA ALA 27 -1.438 -30.385 -1.103 838 1HB ALA 27 1HB ALA 27 0.716 -30.767 -3.180 839 2HB ALA 27 2HB ALA 27 0.359 -31.903 -1.877 840 3HB ALA 27 3HB ALA 27 0.942 -30.281 -1.498 841 HA PRO 28 HA PRO 28 -2.076 -26.255 -2.474 842 1HB PRO 28 1HB PRO 28 0.170 -25.464 -0.712 843 2HB PRO 28 2HB PRO 28 -1.516 -24.935 -0.691 844 1HG PRO 28 1HG PRO 28 -0.566 -26.600 1.173 845 2HG PRO 28 2HG PRO 28 -2.214 -26.768 0.538 846 1HD PRO 28 1HD PRO 28 0.235 -28.361 -0.094 847 2HD PRO 28 2HD PRO 28 -1.445 -28.903 0.099 848 H VAL 29 H VAL 29 -1.444 -25.508 -4.376 849 HA VAL 29 HA VAL 29 1.283 -25.848 -5.300 850 HB VAL 29 HB VAL 29 -0.895 -24.368 -6.767 851 1HG1 VAL 29 1HG1 VAL 29 1.753 -24.788 -7.359 852 2HG1 VAL 29 2HG1 VAL 29 0.490 -24.380 -8.520 853 3HG1 VAL 29 3HG1 VAL 29 0.941 -26.067 -8.262 854 1HG2 VAL 29 1HG2 VAL 29 -0.824 -27.172 -6.060 855 2HG2 VAL 29 2HG2 VAL 29 -0.815 -26.941 -7.810 856 3HG2 VAL 29 3HG2 VAL 29 -2.104 -26.237 -6.832 857 H SER 30 H SER 30 2.005 -24.454 -3.465 858 HA SER 30 HA SER 30 1.435 -21.634 -3.678 859 1HB SER 30 1HB SER 30 3.536 -22.609 -1.821 860 2HB SER 30 2HB SER 30 2.206 -21.485 -1.532 861 HG SER 30 HG SER 30 2.345 -24.144 -1.040 862 H SER 31 H SER 31 2.551 -22.107 -6.000 863 HA SER 31 HA SER 31 5.416 -21.759 -5.916 864 1HB SER 31 1HB SER 31 4.366 -21.266 -8.516 865 2HB SER 31 2HB SER 31 5.236 -22.693 -7.941 866 HG SER 31 HG SER 31 3.116 -23.160 -8.763 867 H GLY 32 H GLY 32 3.119 -19.754 -5.113 868 1HA GLY 32 1HA GLY 32 3.711 -17.429 -6.709 869 2HA GLY 32 2HA GLY 32 2.694 -17.486 -5.278 870 H LYS 33 H LYS 33 6.095 -17.829 -6.203 871 HA LYS 33 HA LYS 33 6.988 -16.867 -3.629 872 1HB LYS 33 1HB LYS 33 9.232 -17.224 -4.483 873 2HB LYS 33 2HB LYS 33 8.230 -18.625 -4.833 874 1HG LYS 33 1HG LYS 33 7.868 -17.417 -7.125 875 2HG LYS 33 2HG LYS 33 9.370 -16.598 -6.692 876 1HD LYS 33 1HD LYS 33 10.383 -18.370 -7.615 877 2HD LYS 33 2HD LYS 33 9.945 -19.213 -6.128 878 1HE LYS 33 1HE LYS 33 9.175 -20.623 -7.820 879 2HE LYS 33 2HE LYS 33 7.734 -19.744 -7.307 880 1HZ LYS 33 1HZ LYS 33 7.957 -19.896 -9.736 881 2HZ LYS 33 2HZ LYS 33 9.405 -19.015 -9.654 882 3HZ LYS 33 3HZ LYS 33 7.944 -18.293 -9.192 883 H ILE 34 H ILE 34 5.569 -15.306 -5.966 884 HA ILE 34 HA ILE 34 7.082 -12.855 -5.472 885 HB ILE 34 HB ILE 34 6.448 -12.122 -7.839 886 1HG1 ILE 34 1HG1 ILE 34 6.707 -14.664 -9.068 887 2HG1 ILE 34 2HG1 ILE 34 5.427 -14.803 -7.867 888 1HG2 ILE 34 1HG2 ILE 34 8.647 -13.849 -6.954 889 2HG2 ILE 34 2HG2 ILE 34 8.684 -12.280 -7.760 890 3HG2 ILE 34 3HG2 ILE 34 8.437 -13.749 -8.703 891 1HD1 ILE 34 1HD1 ILE 34 4.073 -13.294 -8.938 892 2HD1 ILE 34 2HD1 ILE 34 4.872 -14.079 -10.300 893 3HD1 ILE 34 3HD1 ILE 34 5.420 -12.496 -9.749 894 H LYS 35 H LYS 35 5.809 -11.236 -4.841 895 HA LYS 35 HA LYS 35 2.912 -11.481 -5.309 896 1HB LYS 35 1HB LYS 35 3.247 -10.132 -2.859 897 2HB LYS 35 2HB LYS 35 2.551 -11.722 -3.123 898 1HG LYS 35 1HG LYS 35 5.512 -11.430 -2.887 899 2HG LYS 35 2HG LYS 35 4.505 -11.397 -1.439 900 1HD LYS 35 1HD LYS 35 4.641 -13.615 -3.485 901 2HD LYS 35 2HD LYS 35 5.308 -13.652 -1.853 902 1HE LYS 35 1HE LYS 35 2.768 -13.065 -1.264 903 2HE LYS 35 2HE LYS 35 2.510 -13.936 -2.774 904 1HZ LYS 35 1HZ LYS 35 4.303 -15.156 -0.817 905 2HZ LYS 35 2HZ LYS 35 3.200 -15.888 -1.879 906 3HZ LYS 35 3HZ LYS 35 2.648 -15.161 -0.453 907 H ARG 36 H ARG 36 1.784 -9.554 -5.582 908 HA ARG 36 HA ARG 36 3.536 -7.282 -6.209 909 1HB ARG 36 1HB ARG 36 1.367 -6.526 -7.475 910 2HB ARG 36 2HB ARG 36 2.455 -7.709 -8.190 911 1HG ARG 36 1HG ARG 36 0.470 -8.989 -6.544 912 2HG ARG 36 2HG ARG 36 -0.281 -7.966 -7.772 913 1HD ARG 36 1HD ARG 36 0.566 -9.200 -9.513 914 2HD ARG 36 2HD ARG 36 1.954 -9.760 -8.582 915 HE ARG 36 HE ARG 36 -0.780 -10.841 -8.419 916 1HH1 ARG 36 1HH1 ARG 36 2.668 -11.149 -7.850 917 2HH1 ARG 36 2HH1 ARG 36 2.546 -12.779 -7.251 918 1HH2 ARG 36 1HH2 ARG 36 -0.933 -12.991 -7.646 919 2HH2 ARG 36 2HH2 ARG 36 0.513 -13.826 -7.146 920 H VAL 37 H VAL 37 3.456 -5.515 -5.039 921 HA VAL 37 HA VAL 37 1.087 -5.041 -3.345 922 HB VAL 37 HB VAL 37 3.952 -4.379 -2.636 923 1HG1 VAL 37 1HG1 VAL 37 1.774 -3.066 -1.770 924 2HG1 VAL 37 2HG1 VAL 37 3.226 -3.297 -0.796 925 3HG1 VAL 37 3HG1 VAL 37 1.839 -4.367 -0.580 926 1HG2 VAL 37 1HG2 VAL 37 2.566 -6.221 -0.875 927 2HG2 VAL 37 2HG2 VAL 37 4.168 -6.338 -1.609 928 3HG2 VAL 37 3HG2 VAL 37 2.743 -6.857 -2.512 929 H ASN 38 H ASN 38 0.225 -3.040 -3.420 930 HA ASN 38 HA ASN 38 1.557 -1.083 -5.167 931 1HB ASN 38 1HB ASN 38 -0.492 -1.159 -6.147 932 2HB ASN 38 2HB ASN 38 -1.257 -1.836 -4.714 933 1HD2 ASN 38 1HD2 ASN 38 -0.415 1.071 -6.423 934 2HD2 ASN 38 2HD2 ASN 38 -1.366 2.156 -5.454 935 H VAL 39 H VAL 39 2.386 0.688 -4.293 936 HA VAL 39 HA VAL 39 1.472 1.479 -1.607 937 HB VAL 39 HB VAL 39 4.213 2.214 -1.921 938 1HG1 VAL 39 1HG1 VAL 39 3.993 0.206 0.013 939 2HG1 VAL 39 2HG1 VAL 39 2.437 1.040 0.005 940 3HG1 VAL 39 3HG1 VAL 39 3.924 1.953 0.261 941 1HG2 VAL 39 1HG2 VAL 39 3.562 -0.530 -2.810 942 2HG2 VAL 39 2HG2 VAL 39 4.907 -0.363 -1.684 943 3HG2 VAL 39 3HG2 VAL 39 4.931 0.502 -3.221 944 H ASN 40 H ASN 40 1.662 3.681 -1.098 945 HA ASN 40 HA ASN 40 1.986 5.421 -3.443 946 1HB ASN 40 1HB ASN 40 0.445 7.010 -2.269 947 2HB ASN 40 2HB ASN 40 -0.309 5.501 -2.760 948 1HD2 ASN 40 1HD2 ASN 40 -0.985 4.040 -1.215 949 2HD2 ASN 40 2HD2 ASN 40 -1.123 4.467 0.467 950 H PHE 41 H PHE 41 3.417 7.014 -3.347 951 HA PHE 41 HA PHE 41 4.666 7.620 -0.748 952 1HB PHE 41 1HB PHE 41 6.114 7.463 -3.400 953 2HB PHE 41 2HB PHE 41 6.835 7.784 -1.831 954 HD1 PHE 41 HD1 PHE 41 6.077 5.835 -0.041 955 HD2 PHE 41 HD2 PHE 41 6.580 5.396 -4.240 956 HE1 PHE 41 HE1 PHE 41 6.489 3.431 0.263 957 HE2 PHE 41 HE2 PHE 41 6.995 2.989 -3.943 958 HZ PHE 41 HZ PHE 41 6.956 2.006 -1.695 959 H ASP 42 H ASP 42 5.698 9.753 -0.692 960 HA ASP 42 HA ASP 42 4.040 11.798 -1.682 961 1HB ASP 42 1HB ASP 42 6.898 12.267 -0.892 962 2HB ASP 42 2HB ASP 42 5.496 13.296 -0.612 963 H GLU 43 H GLU 43 4.356 13.325 -3.302 964 HA GLU 43 HA GLU 43 5.490 12.424 -5.700 965 1HB GLU 43 1HB GLU 43 3.719 14.314 -5.162 966 2HB GLU 43 2HB GLU 43 5.138 15.349 -5.222 967 1HG GLU 43 1HG GLU 43 5.133 13.595 -7.482 968 2HG GLU 43 2HG GLU 43 3.580 14.423 -7.363 969 H GLU 44 H GLU 44 6.715 14.628 -3.229 970 HA GLU 44 HA GLU 44 9.124 15.401 -4.457 971 1HB GLU 44 1HB GLU 44 7.980 16.119 -2.200 972 2HB GLU 44 2HB GLU 44 8.964 14.821 -1.530 973 1HG GLU 44 1HG GLU 44 10.598 16.467 -3.193 974 2HG GLU 44 2HG GLU 44 9.710 17.486 -2.063 975 H LYS 45 H LYS 45 8.374 12.730 -2.282 976 HA LYS 45 HA LYS 45 10.924 11.522 -2.256 977 1HB LYS 45 1HB LYS 45 9.279 11.050 -0.548 978 2HB LYS 45 2HB LYS 45 8.143 10.443 -1.741 979 1HG LYS 45 1HG LYS 45 9.820 8.616 -2.216 980 2HG LYS 45 2HG LYS 45 10.683 9.165 -0.777 981 1HD LYS 45 1HD LYS 45 7.783 8.730 -0.452 982 2HD LYS 45 2HD LYS 45 8.750 7.283 -0.742 983 1HE LYS 45 1HE LYS 45 9.015 7.328 1.493 984 2HE LYS 45 2HE LYS 45 10.268 8.507 1.114 985 1HZ LYS 45 1HZ LYS 45 9.132 10.108 2.132 986 2HZ LYS 45 2HZ LYS 45 8.122 8.903 2.764 987 3HZ LYS 45 3HZ LYS 45 7.680 9.718 1.344 988 H HIS 46 H HIS 46 8.333 11.516 -4.532 989 HA HIS 46 HA HIS 46 9.284 9.191 -5.986 990 1HB HIS 46 1HB HIS 46 6.860 9.912 -5.909 991 2HB HIS 46 2HB HIS 46 7.307 11.259 -6.949 992 HD1 HIS 46 HD1 HIS 46 7.150 10.831 -9.390 993 HD2 HIS 46 HD2 HIS 46 7.459 7.302 -7.195 994 HE1 HIS 46 HE1 HIS 46 6.852 8.963 -11.050 995 HE2 HIS 46 HE2 HIS 46 7.112 6.835 -9.724 996 H THR 47 H THR 47 9.644 12.661 -6.093 997 HA THR 47 HA THR 47 10.946 12.759 -8.652 998 HB THR 47 HB THR 47 11.458 14.811 -6.526 999 HG1 THR 47 HG1 THR 47 9.053 14.055 -6.896 1000 1HG2 THR 47 1HG2 THR 47 12.532 15.347 -8.522 1001 2HG2 THR 47 2HG2 THR 47 11.031 16.268 -8.618 1002 3HG2 THR 47 3HG2 THR 47 11.197 14.758 -9.512 1003 H ARG 48 H ARG 48 11.926 12.541 -5.286 1004 HA ARG 48 HA ARG 48 14.727 12.578 -5.677 1005 1HB ARG 48 1HB ARG 48 13.079 12.494 -3.499 1006 2HB ARG 48 2HB ARG 48 13.703 10.850 -3.529 1007 1HG ARG 48 1HG ARG 48 15.129 12.109 -2.128 1008 2HG ARG 48 2HG ARG 48 16.006 11.823 -3.633 1009 1HD ARG 48 1HD ARG 48 16.411 14.057 -3.334 1010 2HD ARG 48 2HD ARG 48 14.949 14.123 -4.317 1011 HE ARG 48 HE ARG 48 13.714 14.747 -2.404 1012 1HH1 ARG 48 1HH1 ARG 48 17.135 14.365 -1.760 1013 2HH1 ARG 48 2HH1 ARG 48 17.084 15.271 -0.277 1014 1HH2 ARG 48 1HH2 ARG 48 13.636 15.942 -0.475 1015 2HH2 ARG 48 2HH2 ARG 48 15.096 16.190 0.445 1016 H PHE 49 H PHE 49 12.319 10.003 -5.581 1017 HA PHE 49 HA PHE 49 14.050 7.820 -5.864 1018 1HB PHE 49 1HB PHE 49 11.370 8.104 -5.521 1019 2HB PHE 49 2HB PHE 49 11.430 7.612 -7.212 1020 HD1 PHE 49 HD1 PHE 49 14.154 6.395 -5.252 1021 HD2 PHE 49 HD2 PHE 49 10.115 5.623 -6.344 1022 HE1 PHE 49 HE1 PHE 49 14.421 4.053 -4.564 1023 HE2 PHE 49 HE2 PHE 49 10.377 3.276 -5.662 1024 HZ PHE 49 HZ PHE 49 12.537 2.489 -4.771 1025 H LYS 50 H LYS 50 12.460 9.863 -8.262 1026 HA LYS 50 HA LYS 50 13.266 8.441 -10.555 1027 1HB LYS 50 1HB LYS 50 12.186 11.126 -9.966 1028 2HB LYS 50 2HB LYS 50 13.103 10.992 -11.459 1029 1HG LYS 50 1HG LYS 50 10.871 9.107 -10.775 1030 2HG LYS 50 2HG LYS 50 10.600 10.638 -11.608 1031 1HD LYS 50 1HD LYS 50 12.413 8.419 -12.557 1032 2HD LYS 50 2HD LYS 50 10.798 8.757 -13.180 1033 1HE LYS 50 1HE LYS 50 12.473 11.117 -13.195 1034 2HE LYS 50 2HE LYS 50 13.199 9.799 -14.112 1035 1HZ LYS 50 1HZ LYS 50 10.378 10.592 -14.505 1036 2HZ LYS 50 2HZ LYS 50 11.373 9.693 -15.540 1037 3HZ LYS 50 3HZ LYS 50 11.637 11.359 -15.341 1038 H ALA 51 H ALA 51 14.748 11.140 -8.800 1039 HA ALA 51 HA ALA 51 16.964 11.478 -10.523 1040 1HB ALA 51 1HB ALA 51 16.083 12.489 -7.948 1041 2HB ALA 51 2HB ALA 51 17.011 13.289 -9.220 1042 3HB ALA 51 3HB ALA 51 17.832 12.279 -8.027 1043 H ALA 52 H ALA 52 16.570 9.670 -7.486 1044 HA ALA 52 HA ALA 52 19.213 8.740 -7.336 1045 1HB ALA 52 1HB ALA 52 17.211 6.950 -6.190 1046 2HB ALA 52 2HB ALA 52 17.031 8.637 -5.709 1047 3HB ALA 52 3HB ALA 52 18.554 7.797 -5.424 1048 H CYS 53 H CYS 53 16.294 7.134 -8.654 1049 HA CYS 53 HA CYS 53 17.663 4.751 -9.345 1050 1HB CYS 53 1HB CYS 53 15.691 4.130 -10.573 1051 2HB CYS 53 2HB CYS 53 15.193 4.930 -9.088 1052 HG CYS 53 HG CYS 53 14.218 7.152 -10.171 1053 H ALA 54 H ALA 54 17.376 7.830 -10.887 1054 HA ALA 54 HA ALA 54 18.212 6.996 -13.497 1055 1HB ALA 54 1HB ALA 54 18.891 9.738 -12.729 1056 2HB ALA 54 2HB ALA 54 17.194 9.323 -12.479 1057 3HB ALA 54 3HB ALA 54 17.920 9.142 -14.078 1058 H ARG 55 H ARG 55 19.814 8.333 -10.641 1059 HA ARG 55 HA ARG 55 22.435 8.378 -11.713 1060 1HB ARG 55 1HB ARG 55 21.180 8.762 -9.104 1061 2HB ARG 55 2HB ARG 55 22.750 7.979 -8.990 1062 1HG ARG 55 1HG ARG 55 22.410 10.443 -10.641 1063 2HG ARG 55 2HG ARG 55 22.601 10.553 -8.891 1064 1HD ARG 55 1HD ARG 55 24.796 10.298 -9.092 1065 2HD ARG 55 2HD ARG 55 24.559 8.756 -9.913 1066 HE ARG 55 HE ARG 55 25.049 9.769 -11.893 1067 1HH1 ARG 55 1HH1 ARG 55 24.296 12.263 -9.534 1068 2HH1 ARG 55 2HH1 ARG 55 24.659 13.574 -10.624 1069 1HH2 ARG 55 1HH2 ARG 55 25.512 11.507 -13.320 1070 2HH2 ARG 55 2HH2 ARG 55 25.348 13.145 -12.758 1071 H LYS 56 H LYS 56 20.593 5.970 -9.921 1072 HA LYS 56 HA LYS 56 22.756 4.111 -9.739 1073 1HB LYS 56 1HB LYS 56 19.789 3.894 -9.237 1074 2HB LYS 56 2HB LYS 56 20.876 2.525 -9.046 1075 1HG LYS 56 1HG LYS 56 21.323 5.120 -7.608 1076 2HG LYS 56 2HG LYS 56 20.275 3.854 -6.964 1077 1HD LYS 56 1HD LYS 56 22.127 2.281 -6.978 1078 2HD LYS 56 2HD LYS 56 23.179 3.497 -7.704 1079 1HE LYS 56 1HE LYS 56 23.214 4.797 -5.759 1080 2HE LYS 56 2HE LYS 56 21.798 3.991 -5.091 1081 1HZ LYS 56 1HZ LYS 56 24.581 3.236 -4.969 1082 2HZ LYS 56 2HZ LYS 56 23.531 1.956 -5.339 1083 3HZ LYS 56 3HZ LYS 56 23.304 2.853 -3.919 1084 H GLY 57 H GLY 57 20.482 4.910 -12.160 1085 1HA GLY 57 1HA GLY 57 20.121 4.076 -14.268 1086 2HA GLY 57 2HA GLY 57 21.592 3.132 -14.063 1087 H THR 58 H THR 58 18.400 3.144 -12.490 1088 HA THR 58 HA THR 58 18.041 0.347 -13.253 1089 HB THR 58 HB THR 58 19.239 0.908 -10.902 1090 HG1 THR 58 HG1 THR 58 17.375 -1.227 -10.971 1091 1HG2 THR 58 1HG2 THR 58 16.605 0.262 -9.777 1092 2HG2 THR 58 2HG2 THR 58 16.779 1.916 -10.367 1093 3HG2 THR 58 3HG2 THR 58 17.892 1.293 -9.150 1094 H SER 59 H SER 59 15.858 -0.469 -12.693 1095 HA SER 59 HA SER 59 13.853 1.349 -13.533 1096 1HB SER 59 1HB SER 59 12.629 -0.940 -12.385 1097 2HB SER 59 2HB SER 59 12.914 -0.612 -14.094 1098 HG SER 59 HG SER 59 14.829 -1.772 -12.335 1099 H ILE 60 H ILE 60 12.288 2.406 -12.430 1100 HA ILE 60 HA ILE 60 12.762 3.260 -9.847 1101 HB ILE 60 HB ILE 60 11.327 4.381 -11.580 1102 1HG1 ILE 60 1HG1 ILE 60 9.533 4.607 -9.350 1103 2HG1 ILE 60 2HG1 ILE 60 11.184 4.450 -8.758 1104 1HG2 ILE 60 1HG2 ILE 60 9.743 2.960 -12.371 1105 2HG2 ILE 60 2HG2 ILE 60 8.793 3.763 -11.118 1106 3HG2 ILE 60 3HG2 ILE 60 9.504 2.177 -10.808 1107 1HD1 ILE 60 1HD1 ILE 60 10.790 6.342 -10.976 1108 2HD1 ILE 60 2HD1 ILE 60 11.790 6.471 -9.530 1109 3HD1 ILE 60 3HD1 ILE 60 10.056 6.781 -9.432 1110 H THR 61 H THR 61 10.987 0.439 -10.868 1111 HA THR 61 HA THR 61 9.744 0.060 -8.304 1112 HB THR 61 HB THR 61 9.698 -2.348 -9.792 1113 HG1 THR 61 HG1 THR 61 9.386 -1.738 -11.828 1114 1HG2 THR 61 1HG2 THR 61 7.514 -2.174 -9.317 1115 2HG2 THR 61 2HG2 THR 61 7.385 -0.594 -10.091 1116 3HG2 THR 61 3HG2 THR 61 7.953 -0.716 -8.425 1117 H ASP 62 H ASP 62 12.585 -1.150 -10.003 1118 HA ASP 62 HA ASP 62 13.056 -3.205 -8.058 1119 1HB ASP 62 1HB ASP 62 14.515 -4.091 -9.518 1120 2HB ASP 62 2HB ASP 62 13.768 -2.982 -10.656 1121 H VAL 63 H VAL 63 13.754 0.123 -8.202 1122 HA VAL 63 HA VAL 63 16.010 0.014 -6.386 1123 HB VAL 63 HB VAL 63 14.702 2.424 -5.865 1124 1HG1 VAL 63 1HG1 VAL 63 17.005 2.398 -5.869 1125 2HG1 VAL 63 2HG1 VAL 63 16.626 3.309 -7.333 1126 3HG1 VAL 63 3HG1 VAL 63 17.101 1.612 -7.446 1127 1HG2 VAL 63 1HG2 VAL 63 14.298 3.450 -7.981 1128 2HG2 VAL 63 2HG2 VAL 63 13.329 1.979 -7.892 1129 3HG2 VAL 63 3HG2 VAL 63 14.815 2.000 -8.842 1130 H VAL 64 H VAL 64 12.538 -0.059 -6.221 1131 HA VAL 64 HA VAL 64 12.271 0.306 -3.407 1132 HB VAL 64 HB VAL 64 10.484 -1.415 -5.133 1133 1HG1 VAL 64 1HG1 VAL 64 9.005 -1.409 -3.431 1134 2HG1 VAL 64 2HG1 VAL 64 9.422 0.226 -2.926 1135 3HG1 VAL 64 3HG1 VAL 64 10.449 -1.128 -2.462 1136 1HG2 VAL 64 1HG2 VAL 64 10.870 0.920 -6.053 1137 2HG2 VAL 64 2HG2 VAL 64 10.060 1.517 -4.603 1138 3HG2 VAL 64 3HG2 VAL 64 9.197 0.469 -5.732 1139 H ASN 65 H ASN 65 12.665 -2.500 -5.532 1140 HA ASN 65 HA ASN 65 12.780 -4.504 -3.559 1141 1HB ASN 65 1HB ASN 65 12.655 -5.119 -5.881 1142 2HB ASN 65 2HB ASN 65 14.162 -4.284 -6.241 1143 1HD2 ASN 65 1HD2 ASN 65 15.803 -5.598 -6.536 1144 2HD2 ASN 65 2HD2 ASN 65 16.034 -7.133 -5.761 1145 H GLN 66 H GLN 66 15.219 -2.228 -4.683 1146 HA GLN 66 HA GLN 66 17.416 -3.447 -3.335 1147 1HB GLN 66 1HB GLN 66 16.938 -1.061 -4.958 1148 2HB GLN 66 2HB GLN 66 18.144 -0.821 -3.701 1149 1HG GLN 66 1HG GLN 66 18.697 -3.301 -4.916 1150 2HG GLN 66 2HG GLN 66 18.396 -2.139 -6.211 1151 1HE2 GLN 66 1HE2 GLN 66 20.013 -0.897 -6.811 1152 2HE2 GLN 66 2HE2 GLN 66 21.469 -0.608 -5.908 1153 H LEU 67 H LEU 67 15.274 -0.696 -2.515 1154 HA LEU 67 HA LEU 67 16.718 -0.092 -0.141 1155 1HB LEU 67 1HB LEU 67 14.373 0.961 0.500 1156 2HB LEU 67 2HB LEU 67 15.490 1.735 -0.600 1157 HG LEU 67 HG LEU 67 13.954 0.196 -2.285 1158 1HD1 LEU 67 1HD1 LEU 67 11.914 1.581 -0.669 1159 2HD1 LEU 67 2HD1 LEU 67 12.533 0.062 -0.020 1160 3HD1 LEU 67 3HD1 LEU 67 11.801 0.102 -1.622 1161 1HD2 LEU 67 1HD2 LEU 67 13.979 2.191 -3.247 1162 2HD2 LEU 67 2HD2 LEU 67 14.519 2.931 -1.741 1163 3HD2 LEU 67 3HD2 LEU 67 12.795 2.770 -2.078 1164 H VAL 68 H VAL 68 14.022 -2.193 -0.887 1165 HA VAL 68 HA VAL 68 13.410 -2.922 1.799 1166 HB VAL 68 HB VAL 68 13.034 -4.587 -0.701 1167 1HG1 VAL 68 1HG1 VAL 68 12.084 -4.842 2.126 1168 2HG1 VAL 68 2HG1 VAL 68 12.779 -6.068 1.061 1169 3HG1 VAL 68 3HG1 VAL 68 11.129 -5.502 0.797 1170 1HG2 VAL 68 1HG2 VAL 68 10.711 -3.262 0.503 1171 2HG2 VAL 68 2HG2 VAL 68 11.153 -3.461 -1.191 1172 3HG2 VAL 68 3HG2 VAL 68 11.882 -2.171 -0.237 1173 H ASP 69 H ASP 69 15.754 -3.954 -0.583 1174 HA ASP 69 HA ASP 69 16.676 -6.317 0.619 1175 1HB ASP 69 1HB ASP 69 17.653 -4.411 -1.378 1176 2HB ASP 69 2HB ASP 69 18.943 -5.149 -0.433 1177 H ASN 70 H ASN 70 17.871 -2.993 0.906 1178 HA ASN 70 HA ASN 70 19.839 -3.486 2.825 1179 1HB ASN 70 1HB ASN 70 19.673 -1.402 1.516 1180 2HB ASN 70 2HB ASN 70 18.221 -0.963 2.409 1181 1HD2 ASN 70 1HD2 ASN 70 21.597 -1.909 2.969 1182 2HD2 ASN 70 2HD2 ASN 70 21.853 -0.814 4.293 1183 H TRP 71 H TRP 71 16.495 -2.360 3.252 1184 HA TRP 71 HA TRP 71 16.503 -2.255 6.052 1185 1HB TRP 71 1HB TRP 71 14.761 -1.241 4.635 1186 2HB TRP 71 2HB TRP 71 14.190 -2.845 4.188 1187 HD1 TRP 71 HD1 TRP 71 14.334 -0.462 7.186 1188 HE1 TRP 71 HE1 TRP 71 12.534 -1.150 8.891 1189 HE3 TRP 71 HE3 TRP 71 12.733 -4.763 4.951 1190 HZ2 TRP 71 HZ2 TRP 71 10.677 -3.248 9.235 1191 HZ3 TRP 71 HZ3 TRP 71 10.937 -6.051 6.029 1192 HH2 TRP 71 HH2 TRP 71 9.926 -5.307 8.124 1193 H LEU 72 H LEU 72 15.180 -4.798 3.958 1194 HA LEU 72 HA LEU 72 14.267 -6.536 5.850 1195 1HB LEU 72 1HB LEU 72 14.348 -6.535 3.181 1196 2HB LEU 72 2HB LEU 72 15.601 -7.722 3.486 1197 HG LEU 72 HG LEU 72 13.638 -8.675 5.082 1198 1HD1 LEU 72 1HD1 LEU 72 11.638 -8.583 3.391 1199 2HD1 LEU 72 2HD1 LEU 72 12.372 -7.043 2.939 1200 3HD1 LEU 72 3HD1 LEU 72 11.856 -7.322 4.605 1201 1HD2 LEU 72 1HD2 LEU 72 13.237 -10.305 3.320 1202 2HD2 LEU 72 2HD2 LEU 72 14.954 -9.916 3.427 1203 3HD2 LEU 72 3HD2 LEU 72 13.972 -9.225 2.136 1204 H LYS 73 H LYS 73 17.460 -6.664 4.331 1205 HA LYS 73 HA LYS 73 18.185 -8.947 5.852 1206 1HB LYS 73 1HB LYS 73 20.009 -7.239 4.177 1207 2HB LYS 73 2HB LYS 73 20.191 -8.944 4.574 1208 1HG LYS 73 1HG LYS 73 18.271 -9.517 3.238 1209 2HG LYS 73 2HG LYS 73 17.925 -7.815 2.948 1210 1HD LYS 73 1HD LYS 73 19.460 -7.639 1.320 1211 2HD LYS 73 2HD LYS 73 20.638 -8.627 2.190 1212 1HE LYS 73 1HE LYS 73 20.034 -10.497 1.110 1213 2HE LYS 73 2HE LYS 73 18.317 -10.122 1.230 1214 1HZ LYS 73 1HZ LYS 73 18.461 -8.714 -0.669 1215 2HZ LYS 73 2HZ LYS 73 19.194 -10.189 -1.075 1216 3HZ LYS 73 3HZ LYS 73 20.153 -8.837 -0.719 1217 H GLU 74 H GLU 74 18.638 -5.530 6.306 1218 HA GLU 74 HA GLU 74 20.769 -5.983 8.239 1219 1HB GLU 74 1HB GLU 74 19.575 -3.499 7.040 1220 2HB GLU 74 2HB GLU 74 20.701 -3.432 8.390 1221 1HG GLU 74 1HG GLU 74 21.547 -5.043 6.073 1222 2HG GLU 74 2HG GLU 74 21.447 -3.302 5.821 1223 H ASN 75 H ASN 75 17.401 -4.900 8.197 1224 HA ASN 75 HA ASN 75 17.365 -4.033 10.893 1225 1HB ASN 75 1HB ASN 75 15.231 -3.387 10.503 1226 2HB ASN 75 2HB ASN 75 15.645 -3.719 8.823 1227 1HD2 ASN 75 1HD2 ASN 75 14.832 -5.552 7.829 1228 2HD2 ASN 75 2HD2 ASN 75 13.521 -6.466 8.497 1229 H GLU 76 H GLU 76 16.881 -7.162 9.435 1230 HA GLU 76 HA GLU 76 15.716 -8.339 11.790 1231 1HB GLU 76 1HB GLU 76 15.277 -9.208 9.500 1232 2HB GLU 76 2HB GLU 76 16.964 -9.693 9.387 1233 1HG GLU 76 1HG GLU 76 15.689 -11.617 9.929 1234 2HG GLU 76 2HG GLU 76 16.607 -11.160 11.363 Start of MODEL 4 1 1H MET 1 1H MET 1 -4.438 29.601 30.665 2 2H MET 1 2H MET 1 -3.509 30.747 31.502 3 3H MET 1 3H MET 1 -5.125 31.088 31.101 4 HA MET 1 HA MET 1 -4.196 28.998 32.988 5 1HB MET 1 1HB MET 1 -4.432 31.718 33.378 6 2HB MET 1 2HB MET 1 -5.992 31.119 33.924 7 1HG MET 1 1HG MET 1 -5.035 30.672 35.868 8 2HG MET 1 2HG MET 1 -4.156 29.379 35.054 9 1HE MET 1 1HE MET 1 -3.956 33.332 35.760 10 2HE MET 1 2HE MET 1 -2.511 33.226 36.762 11 3HE MET 1 3HE MET 1 -3.957 32.319 37.204 12 H SER 2 H SER 2 -6.175 28.334 34.367 13 HA SER 2 HA SER 2 -8.037 27.138 32.595 14 1HB SER 2 1HB SER 2 -8.745 26.988 35.410 15 2HB SER 2 2HB SER 2 -8.258 25.700 34.306 16 HG SER 2 HG SER 2 -6.335 25.755 35.143 17 H LEU 3 H LEU 3 -8.448 29.793 32.199 18 HA LEU 3 HA LEU 3 -11.228 30.046 32.914 19 1HB LEU 3 1HB LEU 3 -10.380 32.623 33.488 20 2HB LEU 3 2HB LEU 3 -10.961 31.434 34.638 21 HG LEU 3 HG LEU 3 -8.188 30.950 34.182 22 1HD1 LEU 3 1HD1 LEU 3 -7.142 32.922 34.267 23 2HD1 LEU 3 2HD1 LEU 3 -8.316 33.605 35.389 24 3HD1 LEU 3 3HD1 LEU 3 -8.662 33.578 33.660 25 1HD2 LEU 3 1HD2 LEU 3 -8.124 31.608 36.639 26 2HD2 LEU 3 2HD2 LEU 3 -9.181 30.266 36.195 27 3HD2 LEU 3 3HD2 LEU 3 -9.864 31.865 36.497 28 H GLU 4 H GLU 4 -9.012 32.644 32.046 29 HA GLU 4 HA GLU 4 -8.817 33.967 30.224 30 1HB GLU 4 1HB GLU 4 -9.024 31.255 29.176 31 2HB GLU 4 2HB GLU 4 -9.561 32.468 28.021 32 1HG GLU 4 1HG GLU 4 -7.357 32.419 27.499 33 2HG GLU 4 2HG GLU 4 -7.316 33.648 28.762 34 H LYS 5 H LYS 5 -11.319 33.897 31.619 35 HA LYS 5 HA LYS 5 -13.107 34.800 29.460 36 1HB LYS 5 1HB LYS 5 -15.005 34.124 30.933 37 2HB LYS 5 2HB LYS 5 -14.019 32.771 30.414 38 1HG LYS 5 1HG LYS 5 -13.575 32.188 32.500 39 2HG LYS 5 2HG LYS 5 -13.066 33.824 32.921 40 1HD LYS 5 1HD LYS 5 -15.590 34.350 32.989 41 2HD LYS 5 2HD LYS 5 -15.798 32.598 33.066 42 1HE LYS 5 1HE LYS 5 -13.778 33.466 34.926 43 2HE LYS 5 2HE LYS 5 -15.282 34.348 35.187 44 1HZ LYS 5 1HZ LYS 5 -16.445 32.393 35.604 45 2HZ LYS 5 2HZ LYS 5 -14.969 32.151 36.401 46 3HZ LYS 5 3HZ LYS 5 -15.256 31.407 34.907 47 H ALA 6 H ALA 6 -15.020 35.922 31.379 48 HA ALA 6 HA ALA 6 -14.019 38.490 31.727 49 1HB ALA 6 1HB ALA 6 -16.448 37.393 32.011 50 2HB ALA 6 2HB ALA 6 -16.025 38.988 32.638 51 3HB ALA 6 3HB ALA 6 -16.009 37.585 33.710 52 H HIS 7 H HIS 7 -13.008 39.575 33.343 53 HA HIS 7 HA HIS 7 -11.615 39.936 35.092 54 1HB HIS 7 1HB HIS 7 -13.592 38.110 36.183 55 2HB HIS 7 2HB HIS 7 -12.015 37.864 36.926 56 HD1 HIS 7 HD1 HIS 7 -10.881 40.437 37.528 57 HD2 HIS 7 HD2 HIS 7 -15.007 39.903 37.587 58 HE1 HIS 7 HE1 HIS 7 -11.789 42.304 38.951 59 HE2 HIS 7 HE2 HIS 7 -14.298 42.079 38.792 60 H THR 8 H THR 8 -10.329 39.019 33.155 61 HA THR 8 HA THR 8 -9.126 36.436 33.560 62 HB THR 8 HB THR 8 -7.840 38.252 31.648 63 HG1 THR 8 HG1 THR 8 -10.565 37.507 31.230 64 1HG2 THR 8 1HG2 THR 8 -8.224 36.360 30.127 65 2HG2 THR 8 2HG2 THR 8 -9.199 35.567 31.366 66 3HG2 THR 8 3HG2 THR 8 -7.475 35.833 31.636 67 H SER 9 H SER 9 -6.705 36.249 33.434 68 HA SER 9 HA SER 9 -5.488 37.913 35.472 69 1HB SER 9 1HB SER 9 -3.853 35.887 34.069 70 2HB SER 9 2HB SER 9 -4.075 36.156 35.798 71 HG SER 9 HG SER 9 -5.527 34.552 34.030 72 H VAL 10 H VAL 10 -2.794 37.798 34.510 73 HA VAL 10 HA VAL 10 -2.826 40.079 32.776 74 HB VAL 10 HB VAL 10 -0.223 39.362 32.726 75 1HG1 VAL 10 1HG1 VAL 10 0.111 40.930 34.536 76 2HG1 VAL 10 2HG1 VAL 10 -1.573 40.758 35.030 77 3HG1 VAL 10 3HG1 VAL 10 -1.180 41.495 33.476 78 1HG2 VAL 10 1HG2 VAL 10 -1.206 38.341 35.386 79 2HG2 VAL 10 2HG2 VAL 10 0.458 38.398 34.815 80 3HG2 VAL 10 3HG2 VAL 10 -0.700 37.312 34.049 81 H LYS 11 H LYS 11 -3.689 39.545 30.830 82 HA LYS 11 HA LYS 11 -2.153 37.640 29.190 83 1HB LYS 11 1HB LYS 11 -5.134 38.166 29.086 84 2HB LYS 11 2HB LYS 11 -4.249 37.095 28.010 85 1HG LYS 11 1HG LYS 11 -4.303 36.700 30.987 86 2HG LYS 11 2HG LYS 11 -5.520 36.012 29.912 87 1HD LYS 11 1HD LYS 11 -2.561 35.556 29.576 88 2HD LYS 11 2HD LYS 11 -3.611 34.482 30.500 89 1HE LYS 11 1HE LYS 11 -4.769 33.781 28.621 90 2HE LYS 11 2HE LYS 11 -4.314 35.207 27.690 91 1HZ LYS 11 1HZ LYS 11 -2.956 33.647 26.769 92 2HZ LYS 11 2HZ LYS 11 -2.791 32.757 28.203 93 3HZ LYS 11 3HZ LYS 11 -1.932 34.208 28.000 94 H LYS 12 H LYS 12 -3.470 38.189 26.779 95 HA LYS 12 HA LYS 12 -3.083 41.063 26.353 96 1HB LYS 12 1HB LYS 12 -1.455 38.881 25.237 97 2HB LYS 12 2HB LYS 12 -2.083 39.990 24.023 98 1HG LYS 12 1HG LYS 12 -0.633 40.953 26.469 99 2HG LYS 12 2HG LYS 12 0.208 40.499 24.985 100 1HD LYS 12 1HD LYS 12 -0.626 42.281 23.806 101 2HD LYS 12 2HD LYS 12 -2.079 42.399 24.801 102 1HE LYS 12 1HE LYS 12 -0.024 42.925 26.572 103 2HE LYS 12 2HE LYS 12 0.488 43.726 25.087 104 1HZ LYS 12 1HZ LYS 12 -1.091 44.884 26.843 105 2HZ LYS 12 2HZ LYS 12 -2.284 44.108 25.922 106 3HZ LYS 12 3HZ LYS 12 -1.212 45.196 25.182 107 H MET 13 H MET 13 -5.496 40.435 26.585 108 HA MET 13 HA MET 13 -6.815 39.027 24.548 109 1HB MET 13 1HB MET 13 -7.567 40.785 26.777 110 2HB MET 13 2HB MET 13 -8.708 40.778 25.441 111 1HG MET 13 1HG MET 13 -9.575 39.053 26.595 112 2HG MET 13 2HG MET 13 -8.359 38.151 25.694 113 1HE MET 13 1HE MET 13 -7.658 40.708 28.417 114 2HE MET 13 2HE MET 13 -7.312 39.762 29.865 115 3HE MET 13 3HE MET 13 -8.977 39.945 29.307 116 H THR 14 H THR 14 -6.131 42.470 24.944 117 HA THR 14 HA THR 14 -7.448 43.172 22.485 118 HB THR 14 HB THR 14 -5.929 45.335 23.134 119 HG1 THR 14 HG1 THR 14 -6.163 45.472 25.469 120 1HG2 THR 14 1HG2 THR 14 -8.055 46.019 24.461 121 2HG2 THR 14 2HG2 THR 14 -8.685 44.469 23.907 122 3HG2 THR 14 3HG2 THR 14 -8.188 45.687 22.735 123 H PHE 15 H PHE 15 -6.553 43.446 20.523 124 HA PHE 15 HA PHE 15 -3.779 42.656 20.176 125 1HB PHE 15 1HB PHE 15 -4.277 42.259 17.951 126 2HB PHE 15 2HB PHE 15 -5.847 41.988 18.695 127 HD1 PHE 15 HD1 PHE 15 -3.930 43.999 16.388 128 HD2 PHE 15 HD2 PHE 15 -7.611 43.728 18.505 129 HE1 PHE 15 HE1 PHE 15 -4.922 45.655 14.870 130 HE2 PHE 15 HE2 PHE 15 -8.611 45.385 16.986 131 HZ PHE 15 HZ PHE 15 -7.264 46.356 15.167 132 H GLY 16 H GLY 16 -5.625 45.490 20.453 133 1HA GLY 16 1HA GLY 16 -5.066 47.705 20.431 134 2HA GLY 16 2HA GLY 16 -3.388 47.186 20.492 135 H GLU 17 H GLU 17 -2.174 47.700 18.857 136 HA GLU 17 HA GLU 17 -3.412 48.068 16.216 137 1HB GLU 17 1HB GLU 17 -1.339 49.861 17.500 138 2HB GLU 17 2HB GLU 17 -1.890 49.987 15.835 139 1HG GLU 17 1HG GLU 17 -3.257 51.544 16.704 140 2HG GLU 17 2HG GLU 17 -4.251 50.141 17.093 141 H ASN 18 H ASN 18 -1.707 46.030 17.762 142 HA ASN 18 HA ASN 18 0.795 46.043 16.342 143 1HB ASN 18 1HB ASN 18 0.956 45.266 18.558 144 2HB ASN 18 2HB ASN 18 -0.444 44.215 18.381 145 1HD2 ASN 18 1HD2 ASN 18 2.783 44.714 16.987 146 2HD2 ASN 18 2HD2 ASN 18 3.155 43.029 16.828 147 H ARG 19 H ARG 19 -1.859 43.656 16.560 148 HA ARG 19 HA ARG 19 -0.859 42.219 14.291 149 1HB ARG 19 1HB ARG 19 -2.735 41.737 16.373 150 2HB ARG 19 2HB ARG 19 -3.575 41.519 14.844 151 1HG ARG 19 1HG ARG 19 -1.134 40.212 14.525 152 2HG ARG 19 2HG ARG 19 -1.674 39.806 16.154 153 1HD ARG 19 1HD ARG 19 -3.303 38.484 15.390 154 2HD ARG 19 2HD ARG 19 -3.827 39.684 14.208 155 HE ARG 19 HE ARG 19 -1.950 38.840 12.784 156 1HH1 ARG 19 1HH1 ARG 19 -3.414 36.791 15.233 157 2HH1 ARG 19 2HH1 ARG 19 -2.945 35.315 14.442 158 1HH2 ARG 19 1HH2 ARG 19 -1.368 36.875 11.742 159 2HH2 ARG 19 2HH2 ARG 19 -1.787 35.357 12.488 160 H ASP 20 H ASP 20 -1.740 42.064 12.235 161 HA ASP 20 HA ASP 20 -3.616 44.222 11.530 162 1HB ASP 20 1HB ASP 20 -2.492 44.593 9.532 163 2HB ASP 20 2HB ASP 20 -1.167 44.220 10.624 164 H LEU 21 H LEU 21 -3.708 41.208 12.238 165 HA LEU 21 HA LEU 21 -5.118 39.490 11.883 166 1HB LEU 21 1HB LEU 21 -6.696 41.539 11.538 167 2HB LEU 21 2HB LEU 21 -6.653 41.060 9.852 168 HG LEU 21 HG LEU 21 -7.302 38.699 10.832 169 1HD1 LEU 21 1HD1 LEU 21 -8.274 38.614 12.879 170 2HD1 LEU 21 2HD1 LEU 21 -8.809 40.293 12.821 171 3HD1 LEU 21 3HD1 LEU 21 -7.126 39.917 13.188 172 1HD2 LEU 21 1HD2 LEU 21 -9.636 39.230 10.457 173 2HD2 LEU 21 2HD2 LEU 21 -8.629 40.050 9.262 174 3HD2 LEU 21 3HD2 LEU 21 -9.295 40.953 10.623 175 H GLU 22 H GLU 22 -2.771 39.941 10.173 176 HA GLU 22 HA GLU 22 -3.550 38.488 7.750 177 1HB GLU 22 1HB GLU 22 -1.884 40.464 7.760 178 2HB GLU 22 2HB GLU 22 -0.751 39.322 8.471 179 1HG GLU 22 1HG GLU 22 -2.116 38.404 6.038 180 2HG GLU 22 2HG GLU 22 -1.004 39.758 5.835 181 H ARG 23 H ARG 23 -3.554 36.363 7.834 182 HA ARG 23 HA ARG 23 -1.729 35.016 9.709 183 1HB ARG 23 1HB ARG 23 -4.069 33.439 9.422 184 2HB ARG 23 2HB ARG 23 -3.457 34.220 10.872 185 1HG ARG 23 1HG ARG 23 -4.655 36.316 10.045 186 2HG ARG 23 2HG ARG 23 -5.483 35.245 8.914 187 1HD ARG 23 1HD ARG 23 -5.562 35.215 11.914 188 2HD ARG 23 2HD ARG 23 -6.903 35.427 10.789 189 HE ARG 23 HE ARG 23 -6.344 33.026 10.110 190 1HH1 ARG 23 1HH1 ARG 23 -6.016 34.309 13.363 191 2HH1 ARG 23 2HH1 ARG 23 -6.107 32.737 14.115 192 1HH2 ARG 23 1HH2 ARG 23 -6.482 30.994 11.085 193 2HH2 ARG 23 2HH2 ARG 23 -6.350 30.838 12.810 194 H VAL 24 H VAL 24 -0.528 33.500 8.809 195 HA VAL 24 HA VAL 24 -0.919 32.837 6.024 196 HB VAL 24 HB VAL 24 1.189 31.811 7.930 197 1HG1 VAL 24 1HG1 VAL 24 0.605 30.660 5.632 198 2HG1 VAL 24 2HG1 VAL 24 2.277 30.873 6.153 199 3HG1 VAL 24 3HG1 VAL 24 1.567 31.990 4.986 200 1HG2 VAL 24 1HG2 VAL 24 1.522 34.123 7.885 201 2HG2 VAL 24 2HG2 VAL 24 1.078 34.246 6.181 202 3HG2 VAL 24 3HG2 VAL 24 2.613 33.509 6.643 203 H VAL 25 H VAL 25 -2.075 31.201 5.320 204 HA VAL 25 HA VAL 25 -2.958 29.132 7.156 205 HB VAL 25 HB VAL 25 -4.324 28.309 5.288 206 1HG1 VAL 25 1HG1 VAL 25 -5.246 30.921 4.895 207 2HG1 VAL 25 2HG1 VAL 25 -4.510 30.907 6.500 208 3HG1 VAL 25 3HG1 VAL 25 -5.792 29.759 6.107 209 1HG2 VAL 25 1HG2 VAL 25 -3.389 30.636 3.641 210 2HG2 VAL 25 2HG2 VAL 25 -4.309 29.220 3.136 211 3HG2 VAL 25 3HG2 VAL 25 -2.603 29.061 3.545 212 H THR 26 H THR 26 -2.609 26.912 6.859 213 HA THR 26 HA THR 26 -0.038 26.336 5.602 214 HB THR 26 HB THR 26 -1.211 24.102 7.026 215 HG1 THR 26 HG1 THR 26 -1.995 25.095 8.720 216 1HG2 THR 26 1HG2 THR 26 1.214 24.549 6.514 217 2HG2 THR 26 2HG2 THR 26 0.871 24.106 8.185 218 3HG2 THR 26 3HG2 THR 26 1.175 25.793 7.765 219 H ALA 27 H ALA 27 -0.021 25.539 3.622 220 HA ALA 27 HA ALA 27 -2.317 24.562 2.298 221 1HB ALA 27 1HB ALA 27 0.598 24.481 1.541 222 2HB ALA 27 2HB ALA 27 -0.612 25.659 1.031 223 3HB ALA 27 3HB ALA 27 -0.716 23.990 0.473 224 HA PRO 28 HA PRO 28 -1.998 20.364 3.768 225 1HB PRO 28 1HB PRO 28 -4.364 19.770 2.232 226 2HB PRO 28 2HB PRO 28 -4.207 19.969 3.978 227 1HG PRO 28 1HG PRO 28 -5.573 21.708 2.355 228 2HG PRO 28 2HG PRO 28 -4.860 22.155 3.914 229 1HD PRO 28 1HD PRO 28 -3.810 22.604 1.148 230 2HD PRO 28 2HD PRO 28 -3.771 23.683 2.560 231 H VAL 29 H VAL 29 -2.374 18.135 2.672 232 HA VAL 29 HA VAL 29 -0.598 17.945 0.439 233 HB VAL 29 HB VAL 29 -2.395 15.794 1.575 234 1HG1 VAL 29 1HG1 VAL 29 -0.652 14.275 0.645 235 2HG1 VAL 29 2HG1 VAL 29 0.079 15.674 -0.142 236 3HG1 VAL 29 3HG1 VAL 29 -1.551 15.170 -0.581 237 1HG2 VAL 29 1HG2 VAL 29 -0.446 15.108 2.899 238 2HG2 VAL 29 2HG2 VAL 29 -0.991 16.729 3.329 239 3HG2 VAL 29 3HG2 VAL 29 0.438 16.517 2.315 240 H SER 30 H SER 30 -1.221 18.596 -1.522 241 HA SER 30 HA SER 30 -3.626 17.472 -2.706 242 1HB SER 30 1HB SER 30 -3.562 20.318 -3.295 243 2HB SER 30 2HB SER 30 -4.902 19.331 -2.711 244 HG SER 30 HG SER 30 -2.838 20.122 -0.958 245 H SER 31 H SER 31 -3.801 18.583 -5.046 246 HA SER 31 HA SER 31 -2.923 18.816 -7.117 247 1HB SER 31 1HB SER 31 -0.298 19.631 -5.879 248 2HB SER 31 2HB SER 31 -0.993 20.138 -7.421 249 HG SER 31 HG SER 31 -2.761 21.011 -5.968 250 H GLY 32 H GLY 32 -2.864 16.275 -5.967 251 1HA GLY 32 1HA GLY 32 -2.047 14.182 -6.423 252 2HA GLY 32 2HA GLY 32 -1.224 14.923 -7.788 253 H LYS 33 H LYS 33 -0.863 15.218 -4.259 254 HA LYS 33 HA LYS 33 2.023 15.116 -4.558 255 1HB LYS 33 1HB LYS 33 0.324 16.408 -2.808 256 2HB LYS 33 2HB LYS 33 0.979 15.100 -1.827 257 1HG LYS 33 1HG LYS 33 3.267 15.886 -2.714 258 2HG LYS 33 2HG LYS 33 2.411 17.367 -3.150 259 1HD LYS 33 1HD LYS 33 2.783 18.053 -1.063 260 2HD LYS 33 2HD LYS 33 1.593 16.853 -0.555 261 1HE LYS 33 1HE LYS 33 3.224 15.296 0.012 262 2HE LYS 33 2HE LYS 33 4.460 16.092 -0.960 263 1HZ LYS 33 1HZ LYS 33 5.121 17.065 0.905 264 2HZ LYS 33 2HZ LYS 33 3.766 16.513 1.764 265 3HZ LYS 33 3HZ LYS 33 3.682 17.966 0.892 266 H ILE 34 H ILE 34 -0.205 12.829 -4.589 267 HA ILE 34 HA ILE 34 1.471 10.899 -3.123 268 HB ILE 34 HB ILE 34 -1.359 10.247 -3.843 269 1HG1 ILE 34 1HG1 ILE 34 -0.653 11.700 -1.291 270 2HG1 ILE 34 2HG1 ILE 34 -1.344 12.505 -2.695 271 1HG2 ILE 34 1HG2 ILE 34 -1.152 8.960 -1.690 272 2HG2 ILE 34 2HG2 ILE 34 0.545 9.436 -1.658 273 3HG2 ILE 34 3HG2 ILE 34 -0.070 8.453 -2.984 274 1HD1 ILE 34 1HD1 ILE 34 -3.399 11.631 -2.354 275 2HD1 ILE 34 2HD1 ILE 34 -2.820 11.586 -0.687 276 3HD1 ILE 34 3HD1 ILE 34 -2.773 10.129 -1.679 277 H LYS 35 H LYS 35 2.424 9.438 -4.314 278 HA LYS 35 HA LYS 35 1.610 9.126 -7.126 279 1HB LYS 35 1HB LYS 35 4.320 8.840 -5.812 280 2HB LYS 35 2HB LYS 35 3.991 8.542 -7.518 281 1HG LYS 35 1HG LYS 35 3.294 11.184 -6.322 282 2HG LYS 35 2HG LYS 35 4.971 10.828 -6.735 283 1HD LYS 35 1HD LYS 35 4.380 11.654 -8.746 284 2HD LYS 35 2HD LYS 35 3.728 10.033 -9.003 285 1HE LYS 35 1HE LYS 35 1.833 11.151 -9.492 286 2HE LYS 35 2HE LYS 35 1.648 11.216 -7.740 287 1HZ LYS 35 1HZ LYS 35 2.216 13.339 -9.618 288 2HZ LYS 35 2HZ LYS 35 3.197 13.364 -8.233 289 3HZ LYS 35 3HZ LYS 35 1.507 13.412 -8.076 290 H ARG 36 H ARG 36 2.174 6.950 -8.065 291 HA ARG 36 HA ARG 36 1.739 4.848 -6.043 292 1HB ARG 36 1HB ARG 36 -0.012 5.685 -8.113 293 2HB ARG 36 2HB ARG 36 0.595 4.096 -8.554 294 1HG ARG 36 1HG ARG 36 -1.499 3.974 -7.303 295 2HG ARG 36 2HG ARG 36 -0.173 3.182 -6.453 296 1HD ARG 36 1HD ARG 36 -1.453 4.448 -4.867 297 2HD ARG 36 2HD ARG 36 0.106 5.236 -5.085 298 HE ARG 36 HE ARG 36 -1.250 6.696 -6.736 299 1HH1 ARG 36 1HH1 ARG 36 -2.455 5.331 -3.748 300 2HH1 ARG 36 2HH1 ARG 36 -3.503 6.677 -3.402 301 1HH2 ARG 36 1HH2 ARG 36 -2.652 8.459 -6.297 302 2HH2 ARG 36 2HH2 ARG 36 -3.636 8.435 -4.861 303 H VAL 37 H VAL 37 2.864 3.016 -6.220 304 HA VAL 37 HA VAL 37 4.354 2.462 -8.687 305 HB VAL 37 HB VAL 37 5.597 2.510 -5.927 306 1HG1 VAL 37 1HG1 VAL 37 7.053 1.782 -8.441 307 2HG1 VAL 37 2HG1 VAL 37 6.209 0.559 -7.490 308 3HG1 VAL 37 3HG1 VAL 37 7.514 1.499 -6.763 309 1HG2 VAL 37 1HG2 VAL 37 6.733 4.378 -6.516 310 2HG2 VAL 37 2HG2 VAL 37 5.340 4.609 -7.574 311 3HG2 VAL 37 3HG2 VAL 37 6.828 3.917 -8.217 312 H ASN 38 H ASN 38 4.160 0.380 -9.264 313 HA ASN 38 HA ASN 38 3.086 -1.515 -7.283 314 1HB ASN 38 1HB ASN 38 1.698 -1.250 -9.293 315 2HB ASN 38 2HB ASN 38 3.083 -1.646 -10.306 316 1HD2 ASN 38 1HD2 ASN 38 0.981 -2.931 -7.780 317 2HD2 ASN 38 2HD2 ASN 38 1.126 -4.584 -8.256 318 H VAL 39 H VAL 39 4.581 -2.714 -6.380 319 HA VAL 39 HA VAL 39 7.105 -3.104 -7.794 320 HB VAL 39 HB VAL 39 6.787 -3.807 -4.923 321 1HG1 VAL 39 1HG1 VAL 39 9.076 -2.687 -4.918 322 2HG1 VAL 39 2HG1 VAL 39 8.942 -2.670 -6.675 323 3HG1 VAL 39 3HG1 VAL 39 8.927 -4.204 -5.806 324 1HG2 VAL 39 1HG2 VAL 39 7.547 -1.117 -4.947 325 2HG2 VAL 39 2HG2 VAL 39 6.039 -1.794 -4.332 326 3HG2 VAL 39 3HG2 VAL 39 6.132 -1.214 -5.995 327 H ASN 40 H ASN 40 8.236 -5.045 -7.672 328 HA ASN 40 HA ASN 40 6.583 -7.464 -7.438 329 1HB ASN 40 1HB ASN 40 8.322 -6.616 -9.469 330 2HB ASN 40 2HB ASN 40 9.228 -7.842 -8.592 331 1HD2 ASN 40 1HD2 ASN 40 8.953 -8.743 -10.851 332 2HD2 ASN 40 2HD2 ASN 40 7.598 -9.807 -11.082 333 H PHE 41 H PHE 41 6.812 -8.315 -5.461 334 HA PHE 41 HA PHE 41 9.343 -7.908 -4.031 335 1HB PHE 41 1HB PHE 41 6.500 -8.285 -3.232 336 2HB PHE 41 2HB PHE 41 7.733 -8.883 -2.131 337 HD1 PHE 41 HD1 PHE 41 8.366 -7.472 -0.457 338 HD2 PHE 41 HD2 PHE 41 7.063 -5.817 -4.155 339 HE1 PHE 41 HE1 PHE 41 8.621 -5.206 0.470 340 HE2 PHE 41 HE2 PHE 41 7.315 -3.551 -3.229 341 HZ PHE 41 HZ PHE 41 8.097 -3.242 -0.923 342 H ASP 42 H ASP 42 10.258 -9.617 -2.789 343 HA ASP 42 HA ASP 42 9.946 -12.244 -4.015 344 1HB ASP 42 1HB ASP 42 12.196 -11.043 -3.239 345 2HB ASP 42 2HB ASP 42 11.771 -11.767 -1.696 346 H GLU 43 H GLU 43 9.530 -14.123 -2.719 347 HA GLU 43 HA GLU 43 7.432 -13.830 -0.852 348 1HB GLU 43 1HB GLU 43 8.319 -15.897 -2.315 349 2HB GLU 43 2HB GLU 43 9.082 -16.299 -0.783 350 1HG GLU 43 1HG GLU 43 6.286 -15.563 -0.489 351 2HG GLU 43 2HG GLU 43 6.528 -16.954 -1.545 352 H GLU 44 H GLU 44 10.879 -14.386 -0.530 353 HA GLU 44 HA GLU 44 11.084 -14.702 2.245 354 1HB GLU 44 1HB GLU 44 12.828 -14.660 0.160 355 2HB GLU 44 2HB GLU 44 13.179 -13.109 0.916 356 1HG GLU 44 1HG GLU 44 13.056 -14.913 3.025 357 2HG GLU 44 2HG GLU 44 13.905 -15.772 1.741 358 H LYS 45 H LYS 45 11.172 -11.820 0.216 359 HA LYS 45 HA LYS 45 11.639 -9.977 2.282 360 1HB LYS 45 1HB LYS 45 10.350 -9.551 -0.422 361 2HB LYS 45 2HB LYS 45 10.928 -8.271 0.643 362 1HG LYS 45 1HG LYS 45 13.083 -10.032 0.335 363 2HG LYS 45 2HG LYS 45 12.373 -9.848 -1.271 364 1HD LYS 45 1HD LYS 45 13.133 -7.758 -1.466 365 2HD LYS 45 2HD LYS 45 12.568 -7.322 0.148 366 1HE LYS 45 1HE LYS 45 14.954 -7.064 0.065 367 2HE LYS 45 2HE LYS 45 14.565 -8.442 1.095 368 1HZ LYS 45 1HZ LYS 45 16.369 -8.485 -0.893 369 2HZ LYS 45 2HZ LYS 45 14.998 -9.095 -1.691 370 3HZ LYS 45 3HZ LYS 45 15.572 -9.860 -0.288 371 H HIS 46 H HIS 46 8.670 -11.273 0.891 372 HA HIS 46 HA HIS 46 7.020 -9.368 2.234 373 1HB HIS 46 1HB HIS 46 6.522 -10.855 0.100 374 2HB HIS 46 2HB HIS 46 5.841 -11.937 1.316 375 HD1 HIS 46 HD1 HIS 46 3.561 -11.381 2.177 376 HD2 HIS 46 HD2 HIS 46 5.316 -8.200 0.150 377 HE1 HIS 46 HE1 HIS 46 1.809 -9.573 2.096 378 HE2 HIS 46 HE2 HIS 46 2.954 -7.601 1.013 379 H THR 47 H THR 47 8.068 -12.650 2.974 380 HA THR 47 HA THR 47 6.325 -13.032 5.184 381 HB THR 47 HB THR 47 9.048 -14.276 4.751 382 HG1 THR 47 HG1 THR 47 7.939 -15.860 3.603 383 1HG2 THR 47 1HG2 THR 47 7.802 -16.201 5.975 384 2HG2 THR 47 2HG2 THR 47 6.718 -14.924 6.528 385 3HG2 THR 47 3HG2 THR 47 8.434 -14.855 6.925 386 H ARG 48 H ARG 48 9.588 -11.694 4.867 387 HA ARG 48 HA ARG 48 9.865 -11.196 7.690 388 1HB ARG 48 1HB ARG 48 11.544 -11.032 5.385 389 2HB ARG 48 2HB ARG 48 11.586 -9.485 6.225 390 1HG ARG 48 1HG ARG 48 11.854 -11.172 8.305 391 2HG ARG 48 2HG ARG 48 12.637 -12.107 7.028 392 1HD ARG 48 1HD ARG 48 13.449 -9.369 6.856 393 2HD ARG 48 2HD ARG 48 13.699 -9.953 8.501 394 HE ARG 48 HE ARG 48 14.888 -11.115 6.070 395 1HH1 ARG 48 1HH1 ARG 48 14.786 -10.769 9.550 396 2HH1 ARG 48 2HH1 ARG 48 16.357 -11.472 9.795 397 1HH2 ARG 48 1HH2 ARG 48 16.949 -12.042 6.370 398 2HH2 ARG 48 2HH2 ARG 48 17.593 -12.191 7.981 399 H PHE 49 H PHE 49 8.439 -9.599 5.008 400 HA PHE 49 HA PHE 49 8.461 -6.941 5.959 401 1HB PHE 49 1HB PHE 49 7.423 -8.315 3.728 402 2HB PHE 49 2HB PHE 49 6.043 -7.549 4.503 403 HD1 PHE 49 HD1 PHE 49 9.499 -6.261 4.445 404 HD2 PHE 49 HD2 PHE 49 5.550 -5.904 2.911 405 HE1 PHE 49 HE1 PHE 49 10.110 -4.133 3.388 406 HE2 PHE 49 HE2 PHE 49 6.154 -3.772 1.843 407 HZ PHE 49 HZ PHE 49 8.435 -2.881 2.081 408 H LYS 50 H LYS 50 5.948 -9.453 6.080 409 HA LYS 50 HA LYS 50 4.205 -8.050 7.801 410 1HB LYS 50 1HB LYS 50 4.060 -10.381 6.379 411 2HB LYS 50 2HB LYS 50 4.182 -10.985 8.028 412 1HG LYS 50 1HG LYS 50 2.286 -8.812 7.825 413 2HG LYS 50 2HG LYS 50 1.887 -10.139 6.731 414 1HD LYS 50 1HD LYS 50 2.689 -10.992 9.418 415 2HD LYS 50 2HD LYS 50 1.215 -10.023 9.378 416 1HE LYS 50 1HE LYS 50 0.061 -11.775 8.659 417 2HE LYS 50 2HE LYS 50 1.108 -11.900 7.245 418 1HZ LYS 50 1HZ LYS 50 1.232 -13.364 9.785 419 2HZ LYS 50 2HZ LYS 50 2.685 -13.057 8.960 420 3HZ LYS 50 3HZ LYS 50 1.446 -13.927 8.200 421 H ALA 51 H ALA 51 6.922 -10.196 8.362 422 HA ALA 51 HA ALA 51 6.564 -10.573 11.135 423 1HB ALA 51 1HB ALA 51 8.076 -11.962 9.791 424 2HB ALA 51 2HB ALA 51 8.901 -11.250 11.178 425 3HB ALA 51 3HB ALA 51 9.142 -10.574 9.566 426 H ALA 52 H ALA 52 8.847 -8.415 9.437 427 HA ALA 52 HA ALA 52 9.629 -7.068 11.778 428 1HB ALA 52 1HB ALA 52 10.207 -6.916 8.951 429 2HB ALA 52 2HB ALA 52 11.245 -6.588 10.339 430 3HB ALA 52 3HB ALA 52 10.185 -5.325 9.711 431 H CYS 53 H CYS 53 7.025 -6.400 9.491 432 HA CYS 53 HA CYS 53 6.559 -3.744 10.374 433 1HB CYS 53 1HB CYS 53 4.642 -3.752 9.051 434 2HB CYS 53 2HB CYS 53 5.677 -4.921 8.244 435 HG CYS 53 HG CYS 53 2.906 -5.541 10.141 436 H ALA 54 H ALA 54 5.437 -6.894 11.447 437 HA ALA 54 HA ALA 54 3.609 -5.873 13.406 438 1HB ALA 54 1HB ALA 54 2.946 -7.993 13.294 439 2HB ALA 54 2HB ALA 54 4.404 -8.449 14.176 440 3HB ALA 54 3HB ALA 54 4.405 -8.448 12.413 441 H ARG 55 H ARG 55 7.003 -6.588 13.275 442 HA ARG 55 HA ARG 55 7.475 -6.633 16.088 443 1HB ARG 55 1HB ARG 55 9.350 -6.125 13.766 444 2HB ARG 55 2HB ARG 55 9.870 -6.307 15.437 445 1HG ARG 55 1HG ARG 55 8.411 -8.557 15.116 446 2HG ARG 55 2HG ARG 55 9.040 -8.327 13.484 447 1HD ARG 55 1HD ARG 55 11.184 -7.827 15.206 448 2HD ARG 55 2HD ARG 55 10.379 -9.257 15.851 449 HE ARG 55 HE ARG 55 11.868 -9.049 13.385 450 1HH1 ARG 55 1HH1 ARG 55 9.375 -10.849 15.089 451 2HH1 ARG 55 2HH1 ARG 55 9.688 -12.331 14.233 452 1HH2 ARG 55 1HH2 ARG 55 12.241 -10.969 12.232 453 2HH2 ARG 55 2HH2 ARG 55 11.297 -12.392 12.585 454 H LYS 56 H LYS 56 7.850 -4.158 13.568 455 HA LYS 56 HA LYS 56 8.668 -2.145 15.438 456 1HB LYS 56 1HB LYS 56 8.490 -2.430 12.584 457 2HB LYS 56 2HB LYS 56 7.754 -0.911 13.074 458 1HG LYS 56 1HG LYS 56 9.732 -0.070 13.924 459 2HG LYS 56 2HG LYS 56 10.440 -1.673 14.136 460 1HD LYS 56 1HD LYS 56 9.892 -1.366 11.380 461 2HD LYS 56 2HD LYS 56 10.666 0.123 11.921 462 1HE LYS 56 1HE LYS 56 11.720 -2.671 11.904 463 2HE LYS 56 2HE LYS 56 12.477 -1.183 11.340 464 1HZ LYS 56 1HZ LYS 56 13.624 -1.563 13.262 465 2HZ LYS 56 2HZ LYS 56 12.306 -2.264 14.061 466 3HZ LYS 56 3HZ LYS 56 12.380 -0.583 13.868 467 H GLY 57 H GLY 57 5.657 -3.282 14.200 468 1HA GLY 57 1HA GLY 57 3.516 -2.791 14.918 469 2HA GLY 57 2HA GLY 57 4.197 -1.604 16.022 470 H THR 58 H THR 58 4.092 -2.023 12.492 471 HA THR 58 HA THR 58 2.708 0.520 12.251 472 HB THR 58 HB THR 58 5.269 0.887 12.241 473 HG1 THR 58 HG1 THR 58 4.794 2.246 10.112 474 1HG2 THR 58 1HG2 THR 58 5.060 0.136 9.345 475 2HG2 THR 58 2HG2 THR 58 5.559 -1.050 10.552 476 3HG2 THR 58 3HG2 THR 58 6.500 0.422 10.324 477 H SER 59 H SER 59 1.908 0.898 10.070 478 HA SER 59 HA SER 59 0.724 -1.396 8.972 479 1HB SER 59 1HB SER 59 0.960 1.103 7.354 480 2HB SER 59 2HB SER 59 -0.441 0.065 7.617 481 HG SER 59 HG SER 59 0.568 2.151 9.183 482 H ILE 60 H ILE 60 1.129 -2.581 7.146 483 HA ILE 60 HA ILE 60 3.802 -2.934 6.389 484 HB ILE 60 HB ILE 60 2.034 -4.675 6.205 485 1HG1 ILE 60 1HG1 ILE 60 3.022 -4.651 3.452 486 2HG1 ILE 60 2HG1 ILE 60 4.273 -4.300 4.639 487 1HG2 ILE 60 1HG2 ILE 60 0.930 -4.494 3.757 488 2HG2 ILE 60 2HG2 ILE 60 0.980 -2.786 4.205 489 3HG2 ILE 60 3HG2 ILE 60 0.139 -3.947 5.236 490 1HD1 ILE 60 1HD1 ILE 60 2.462 -6.634 5.043 491 2HD1 ILE 60 2HD1 ILE 60 4.112 -6.378 5.614 492 3HD1 ILE 60 3HD1 ILE 60 3.814 -6.745 3.913 493 H THR 61 H THR 61 1.299 -0.907 5.081 494 HA THR 61 HA THR 61 2.537 -0.293 2.612 495 HB THR 61 HB THR 61 0.914 1.859 3.651 496 HG1 THR 61 HG1 THR 61 -0.939 0.029 3.544 497 1HG2 THR 61 1HG2 THR 61 -0.270 0.061 1.667 498 2HG2 THR 61 2HG2 THR 61 1.349 0.615 1.242 499 3HG2 THR 61 3HG2 THR 61 0.074 1.789 1.564 500 H ASP 62 H ASP 62 2.668 1.066 5.849 501 HA ASP 62 HA ASP 62 4.231 3.364 5.199 502 1HB ASP 62 1HB ASP 62 2.909 3.329 7.235 503 2HB ASP 62 2HB ASP 62 3.784 1.919 7.821 504 H VAL 63 H VAL 63 4.923 0.044 6.012 505 HA VAL 63 HA VAL 63 7.661 0.247 6.618 506 HB VAL 63 HB VAL 63 6.173 -2.020 5.274 507 1HG1 VAL 63 1HG1 VAL 63 8.210 -3.203 6.571 508 2HG1 VAL 63 2HG1 VAL 63 8.982 -1.688 6.098 509 3HG1 VAL 63 3HG1 VAL 63 8.270 -2.740 4.870 510 1HG2 VAL 63 1HG2 VAL 63 6.992 -2.363 8.039 511 2HG2 VAL 63 2HG2 VAL 63 5.421 -2.632 7.283 512 3HG2 VAL 63 3HG2 VAL 63 5.876 -1.016 7.822 513 H VAL 64 H VAL 64 5.996 -0.247 3.510 514 HA VAL 64 HA VAL 64 8.334 -0.345 1.925 515 HB VAL 64 HB VAL 64 5.773 0.782 0.852 516 1HG1 VAL 64 1HG1 VAL 64 8.078 0.273 -0.374 517 2HG1 VAL 64 2HG1 VAL 64 6.520 0.062 -1.171 518 3HG1 VAL 64 3HG1 VAL 64 7.358 -1.334 -0.494 519 1HG2 VAL 64 1HG2 VAL 64 5.603 -1.977 0.506 520 2HG2 VAL 64 2HG2 VAL 64 4.593 -0.970 1.542 521 3HG2 VAL 64 3HG2 VAL 64 6.024 -1.757 2.203 522 H ASN 65 H ASN 65 6.170 2.293 2.848 523 HA ASN 65 HA ASN 65 7.395 4.370 1.419 524 1HB ASN 65 1HB ASN 65 5.219 4.230 2.976 525 2HB ASN 65 2HB ASN 65 6.331 4.939 4.139 526 1HD2 ASN 65 1HD2 ASN 65 4.466 5.445 1.300 527 2HD2 ASN 65 2HD2 ASN 65 4.777 7.140 1.143 528 H GLN 66 H GLN 66 8.146 2.916 4.529 529 HA GLN 66 HA GLN 66 10.058 4.802 5.377 530 1HB GLN 66 1HB GLN 66 8.857 2.999 6.738 531 2HB GLN 66 2HB GLN 66 10.091 1.897 6.143 532 1HG GLN 66 1HG GLN 66 11.710 3.767 7.041 533 2HG GLN 66 2HG GLN 66 10.319 4.161 8.052 534 1HE2 GLN 66 1HE2 GLN 66 9.368 2.323 9.257 535 2HE2 GLN 66 2HE2 GLN 66 10.462 1.150 9.912 536 H LEU 67 H LEU 67 10.475 1.661 3.685 537 HA LEU 67 HA LEU 67 13.302 1.879 3.653 538 1HB LEU 67 1HB LEU 67 12.959 0.269 1.561 539 2HB LEU 67 2HB LEU 67 12.867 -0.276 3.221 540 HG LEU 67 HG LEU 67 10.263 0.501 2.574 541 1HD1 LEU 67 1HD1 LEU 67 9.733 -0.288 0.502 542 2HD1 LEU 67 2HD1 LEU 67 11.099 -1.402 0.453 543 3HD1 LEU 67 3HD1 LEU 67 11.357 0.322 0.177 544 1HD2 LEU 67 1HD2 LEU 67 9.943 -1.440 3.601 545 2HD2 LEU 67 2HD2 LEU 67 11.686 -1.704 3.575 546 3HD2 LEU 67 3HD2 LEU 67 10.680 -2.314 2.259 547 H VAL 68 H VAL 68 10.800 2.986 1.441 548 HA VAL 68 HA VAL 68 12.519 3.741 -0.687 549 HB VAL 68 HB VAL 68 9.920 5.072 0.117 550 1HG1 VAL 68 1HG1 VAL 68 11.348 4.996 -2.539 551 2HG1 VAL 68 2HG1 VAL 68 11.280 6.378 -1.446 552 3HG1 VAL 68 3HG1 VAL 68 9.806 5.782 -2.206 553 1HG2 VAL 68 1HG2 VAL 68 8.857 3.613 -1.534 554 2HG2 VAL 68 2HG2 VAL 68 9.577 2.691 -0.214 555 3HG2 VAL 68 3HG2 VAL 68 10.389 2.776 -1.779 556 H ASP 69 H ASP 69 11.231 5.468 2.107 557 HA ASP 69 HA ASP 69 12.527 7.937 1.729 558 1HB ASP 69 1HB ASP 69 10.663 7.434 3.353 559 2HB ASP 69 2HB ASP 69 11.850 6.629 4.371 560 H ASN 70 H ASN 70 13.465 5.040 3.512 561 HA ASN 70 HA ASN 70 15.840 6.035 4.598 562 1HB ASN 70 1HB ASN 70 14.505 3.899 5.175 563 2HB ASN 70 2HB ASN 70 15.468 3.138 3.911 564 1HD2 ASN 70 1HD2 ASN 70 16.988 1.969 4.820 565 2HD2 ASN 70 2HD2 ASN 70 18.012 2.472 6.132 566 H TRP 71 H TRP 71 15.507 3.784 1.819 567 HA TRP 71 HA TRP 71 18.226 3.823 1.134 568 1HB TRP 71 1HB TRP 71 16.510 2.160 0.316 569 2HB TRP 71 2HB TRP 71 15.951 3.390 -0.812 570 HD1 TRP 71 HD1 TRP 71 19.148 1.341 -0.041 571 HE1 TRP 71 HE1 TRP 71 20.528 1.158 -2.203 572 HE3 TRP 71 HE3 TRP 71 16.244 4.210 -3.133 573 HZ2 TRP 71 HZ2 TRP 71 20.394 2.063 -4.855 574 HZ3 TRP 71 HZ3 TRP 71 16.929 4.457 -5.487 575 HH2 TRP 71 HH2 TRP 71 18.959 3.411 -6.328 576 H LEU 72 H LEU 72 15.599 5.967 0.265 577 HA LEU 72 HA LEU 72 16.880 7.335 -1.835 578 1HB LEU 72 1HB LEU 72 14.499 7.660 -0.204 579 2HB LEU 72 2HB LEU 72 15.246 9.201 -0.580 580 HG LEU 72 HG LEU 72 14.860 8.990 -2.856 581 1HD1 LEU 72 1HD1 LEU 72 14.667 7.032 -4.080 582 2HD1 LEU 72 2HD1 LEU 72 14.113 6.098 -2.690 583 3HD1 LEU 72 3HD1 LEU 72 15.806 6.576 -2.815 584 1HD2 LEU 72 1HD2 LEU 72 12.530 7.411 -1.826 585 2HD2 LEU 72 2HD2 LEU 72 12.558 8.667 -3.064 586 3HD2 LEU 72 3HD2 LEU 72 12.778 9.095 -1.369 587 H LYS 73 H LYS 73 16.543 8.218 1.604 588 HA LYS 73 HA LYS 73 18.183 10.522 1.303 589 1HB LYS 73 1HB LYS 73 17.247 9.053 3.768 590 2HB LYS 73 2HB LYS 73 18.087 10.599 3.794 591 1HG LYS 73 1HG LYS 73 16.295 11.728 2.816 592 2HG LYS 73 2HG LYS 73 15.555 10.234 2.232 593 1HD LYS 73 1HD LYS 73 14.496 9.862 4.172 594 2HD LYS 73 2HD LYS 73 15.894 10.345 5.136 595 1HE LYS 73 1HE LYS 73 14.743 12.183 5.648 596 2HE LYS 73 2HE LYS 73 15.039 12.708 3.991 597 1HZ LYS 73 1HZ LYS 73 12.606 12.378 5.101 598 2HZ LYS 73 2HZ LYS 73 12.798 10.913 4.268 599 3HZ LYS 73 3HZ LYS 73 12.916 12.384 3.433 600 H GLU 74 H GLU 74 18.819 7.192 2.096 601 HA GLU 74 HA GLU 74 21.397 7.703 3.233 602 1HB GLU 74 1HB GLU 74 19.823 5.264 2.535 603 2HB GLU 74 2HB GLU 74 21.552 5.103 2.819 604 1HG GLU 74 1HG GLU 74 19.477 6.138 4.734 605 2HG GLU 74 2HG GLU 74 20.410 4.648 4.861 606 H ASN 75 H ASN 75 20.271 6.462 0.093 607 HA ASN 75 HA ASN 75 23.035 6.311 -0.802 608 1HB ASN 75 1HB ASN 75 22.364 4.575 -2.016 609 2HB ASN 75 2HB ASN 75 20.778 4.751 -1.277 610 1HD2 ASN 75 1HD2 ASN 75 19.136 5.738 -2.413 611 2HD2 ASN 75 2HD2 ASN 75 19.216 5.939 -4.126 612 H GLU 76 H GLU 76 20.350 8.421 -1.127 613 HA GLU 76 HA GLU 76 21.762 9.854 -3.279 614 1HB GLU 76 1HB GLU 76 19.149 9.012 -3.313 615 2HB GLU 76 2HB GLU 76 18.984 10.660 -2.725 616 1HG GLU 76 1HG GLU 76 20.735 10.324 -5.057 617 2HG GLU 76 2HG GLU 76 19.032 9.961 -5.327 618 1H MET 1 1H MET 1 36.550 -27.700 -28.807 619 2H MET 1 2H MET 1 37.392 -26.250 -28.538 620 3H MET 1 3H MET 1 37.665 -27.586 -27.530 621 HA MET 1 HA MET 1 39.471 -27.298 -29.098 622 1HB MET 1 1HB MET 1 37.664 -29.680 -29.164 623 2HB MET 1 2HB MET 1 39.051 -29.648 -30.246 624 1HG MET 1 1HG MET 1 40.412 -29.094 -28.141 625 2HG MET 1 2HG MET 1 38.997 -29.663 -27.257 626 1HE MET 1 1HE MET 1 41.719 -32.272 -26.866 627 2HE MET 1 2HE MET 1 41.676 -30.506 -26.879 628 3HE MET 1 3HE MET 1 42.468 -31.380 -28.191 629 H SER 2 H SER 2 39.844 -28.316 -31.529 630 HA SER 2 HA SER 2 38.516 -26.380 -33.217 631 1HB SER 2 1HB SER 2 40.235 -28.180 -34.667 632 2HB SER 2 2HB SER 2 40.458 -26.460 -34.332 633 HG SER 2 HG SER 2 42.030 -28.151 -33.455 634 H LEU 3 H LEU 3 38.603 -29.869 -32.790 635 HA LEU 3 HA LEU 3 37.090 -30.492 -35.117 636 1HB LEU 3 1HB LEU 3 38.038 -31.944 -32.716 637 2HB LEU 3 2HB LEU 3 36.651 -32.625 -33.544 638 HG LEU 3 HG LEU 3 38.949 -31.912 -35.262 639 1HD1 LEU 3 1HD1 LEU 3 39.999 -32.862 -33.209 640 2HD1 LEU 3 2HD1 LEU 3 40.263 -33.811 -34.671 641 3HD1 LEU 3 3HD1 LEU 3 39.070 -34.336 -33.482 642 1HD2 LEU 3 1HD2 LEU 3 38.011 -33.410 -36.633 643 2HD2 LEU 3 2HD2 LEU 3 36.616 -33.309 -35.559 644 3HD2 LEU 3 3HD2 LEU 3 37.802 -34.595 -35.345 645 H GLU 4 H GLU 4 36.112 -30.973 -31.722 646 HA GLU 4 HA GLU 4 34.090 -30.939 -30.693 647 1HB GLU 4 1HB GLU 4 34.383 -28.464 -32.029 648 2HB GLU 4 2HB GLU 4 32.713 -28.965 -32.258 649 1HG GLU 4 1HG GLU 4 32.505 -27.841 -30.296 650 2HG GLU 4 2HG GLU 4 32.864 -29.449 -29.674 651 H LYS 5 H LYS 5 34.376 -32.853 -32.641 652 HA LYS 5 HA LYS 5 31.647 -33.480 -33.255 653 1HB LYS 5 1HB LYS 5 32.001 -33.775 -35.684 654 2HB LYS 5 2HB LYS 5 32.175 -32.095 -35.206 655 1HG LYS 5 1HG LYS 5 34.519 -32.169 -35.430 656 2HG LYS 5 2HG LYS 5 34.527 -33.930 -35.538 657 1HD LYS 5 1HD LYS 5 32.852 -33.162 -37.595 658 2HD LYS 5 2HD LYS 5 34.123 -31.938 -37.617 659 1HE LYS 5 1HE LYS 5 35.537 -33.366 -38.559 660 2HE LYS 5 2HE LYS 5 35.300 -34.517 -37.247 661 1HZ LYS 5 1HZ LYS 5 33.887 -34.341 -39.831 662 2HZ LYS 5 2HZ LYS 5 33.162 -35.119 -38.509 663 3HZ LYS 5 3HZ LYS 5 34.644 -35.681 -39.114 664 H ALA 6 H ALA 6 31.808 -35.661 -34.731 665 HA ALA 6 HA ALA 6 33.076 -37.570 -33.092 666 1HB ALA 6 1HB ALA 6 31.777 -37.683 -35.786 667 2HB ALA 6 2HB ALA 6 31.221 -38.353 -34.252 668 3HB ALA 6 3HB ALA 6 32.573 -39.100 -35.102 669 H HIS 7 H HIS 7 34.768 -39.032 -33.617 670 HA HIS 7 HA HIS 7 36.844 -39.635 -34.338 671 1HB HIS 7 1HB HIS 7 35.781 -38.978 -36.662 672 2HB HIS 7 2HB HIS 7 36.869 -37.601 -36.531 673 HD1 HIS 7 HD1 HIS 7 36.789 -41.235 -37.224 674 HD2 HIS 7 HD2 HIS 7 39.628 -38.249 -36.667 675 HE1 HIS 7 HE1 HIS 7 38.959 -42.199 -38.054 676 HE2 HIS 7 HE2 HIS 7 40.599 -40.281 -37.937 677 H THR 8 H THR 8 36.443 -37.760 -32.348 678 HA THR 8 HA THR 8 38.264 -35.548 -32.705 679 HB THR 8 HB THR 8 37.580 -36.074 -29.952 680 HG1 THR 8 HG1 THR 8 35.354 -35.860 -31.735 681 1HG2 THR 8 1HG2 THR 8 36.746 -33.915 -31.895 682 2HG2 THR 8 2HG2 THR 8 38.140 -33.873 -30.817 683 3HG2 THR 8 3HG2 THR 8 36.510 -33.859 -30.149 684 H SER 9 H SER 9 40.160 -35.224 -31.378 685 HA SER 9 HA SER 9 41.605 -37.711 -30.905 686 1HB SER 9 1HB SER 9 43.146 -35.336 -30.344 687 2HB SER 9 2HB SER 9 43.391 -36.540 -31.611 688 HG SER 9 HG SER 9 41.930 -34.129 -31.681 689 H VAL 10 H VAL 10 42.472 -38.275 -28.943 690 HA VAL 10 HA VAL 10 42.526 -38.561 -26.695 691 HB VAL 10 HB VAL 10 42.281 -35.578 -26.400 692 1HG1 VAL 10 1HG1 VAL 10 42.352 -36.710 -24.306 693 2HG1 VAL 10 2HG1 VAL 10 43.954 -36.019 -24.568 694 3HG1 VAL 10 3HG1 VAL 10 43.679 -37.741 -24.839 695 1HG2 VAL 10 1HG2 VAL 10 44.526 -35.237 -26.964 696 2HG2 VAL 10 2HG2 VAL 10 43.917 -36.298 -28.232 697 3HG2 VAL 10 3HG2 VAL 10 44.890 -36.961 -26.921 698 H LYS 11 H LYS 11 40.013 -38.743 -27.939 699 HA LYS 11 HA LYS 11 38.255 -37.926 -25.721 700 1HB LYS 11 1HB LYS 11 38.042 -36.967 -28.287 701 2HB LYS 11 2HB LYS 11 36.935 -38.333 -28.313 702 1HG LYS 11 1HG LYS 11 35.401 -37.187 -27.209 703 2HG LYS 11 2HG LYS 11 36.543 -36.799 -25.923 704 1HD LYS 11 1HD LYS 11 37.133 -34.787 -26.868 705 2HD LYS 11 2HD LYS 11 36.715 -35.311 -28.500 706 1HE LYS 11 1HE LYS 11 34.823 -34.162 -28.258 707 2HE LYS 11 2HE LYS 11 34.316 -35.413 -27.123 708 1HZ LYS 11 1HZ LYS 11 34.147 -33.720 -25.702 709 2HZ LYS 11 2HZ LYS 11 35.133 -32.690 -26.622 710 3HZ LYS 11 3HZ LYS 11 35.837 -33.825 -25.572 711 H LYS 12 H LYS 12 37.806 -39.707 -24.629 712 HA LYS 12 HA LYS 12 38.147 -42.302 -25.610 713 1HB LYS 12 1HB LYS 12 37.074 -41.076 -23.149 714 2HB LYS 12 2HB LYS 12 36.480 -42.693 -23.497 715 1HG LYS 12 1HG LYS 12 39.254 -42.795 -23.900 716 2HG LYS 12 2HG LYS 12 39.002 -41.872 -22.416 717 1HD LYS 12 1HD LYS 12 37.970 -43.632 -21.337 718 2HD LYS 12 2HD LYS 12 37.500 -44.414 -22.851 719 1HE LYS 12 1HE LYS 12 39.812 -45.019 -23.278 720 2HE LYS 12 2HE LYS 12 40.321 -44.185 -21.811 721 1HZ LYS 12 1HZ LYS 12 40.137 -46.605 -21.536 722 2HZ LYS 12 2HZ LYS 12 38.477 -46.513 -21.873 723 3HZ LYS 12 3HZ LYS 12 39.103 -45.755 -20.490 724 H MET 13 H MET 13 36.863 -43.741 -26.555 725 HA MET 13 HA MET 13 34.348 -42.845 -27.652 726 1HB MET 13 1HB MET 13 36.159 -44.295 -28.795 727 2HB MET 13 2HB MET 13 35.463 -45.630 -27.888 728 1HG MET 13 1HG MET 13 33.235 -44.937 -28.927 729 2HG MET 13 2HG MET 13 34.202 -43.975 -30.044 730 1HE MET 13 1HE MET 13 33.538 -47.301 -28.464 731 2HE MET 13 2HE MET 13 35.215 -47.795 -28.702 732 3HE MET 13 3HE MET 13 33.936 -48.511 -29.684 733 H THR 14 H THR 14 33.866 -42.739 -25.109 734 HA THR 14 HA THR 14 32.075 -44.993 -24.587 735 HB THR 14 HB THR 14 33.029 -44.225 -22.074 736 HG1 THR 14 HG1 THR 14 35.257 -44.978 -23.670 737 1HG2 THR 14 1HG2 THR 14 33.811 -46.520 -21.916 738 2HG2 THR 14 2HG2 THR 14 33.720 -46.688 -23.669 739 3HG2 THR 14 3HG2 THR 14 32.247 -46.463 -22.727 740 H PHE 15 H PHE 15 30.274 -44.443 -23.282 741 HA PHE 15 HA PHE 15 29.407 -41.748 -23.470 742 1HB PHE 15 1HB PHE 15 27.963 -43.854 -23.457 743 2HB PHE 15 2HB PHE 15 28.207 -43.891 -21.713 744 HD1 PHE 15 HD1 PHE 15 26.736 -42.792 -20.350 745 HD2 PHE 15 HD2 PHE 15 27.074 -41.609 -24.419 746 HE1 PHE 15 HE1 PHE 15 24.861 -41.244 -20.048 747 HE2 PHE 15 HE2 PHE 15 25.197 -40.054 -24.129 748 HZ PHE 15 HZ PHE 15 24.108 -39.831 -21.947 749 H GLY 16 H GLY 16 30.574 -43.810 -20.857 750 1HA GLY 16 1HA GLY 16 32.077 -42.803 -19.227 751 2HA GLY 16 2HA GLY 16 31.066 -41.364 -19.279 752 H GLU 17 H GLU 17 31.363 -44.632 -18.098 753 HA GLU 17 HA GLU 17 28.849 -44.800 -16.813 754 1HB GLU 17 1HB GLU 17 31.433 -46.274 -16.617 755 2HB GLU 17 2HB GLU 17 30.239 -46.506 -15.348 756 1HG GLU 17 1HG GLU 17 28.588 -47.091 -17.125 757 2HG GLU 17 2HG GLU 17 29.913 -47.040 -18.287 758 H ASN 18 H ASN 18 31.659 -43.038 -16.088 759 HA ASN 18 HA ASN 18 31.212 -42.799 -13.250 760 1HB ASN 18 1HB ASN 18 33.150 -41.592 -13.183 761 2HB ASN 18 2HB ASN 18 33.410 -42.417 -14.712 762 1HD2 ASN 18 1HD2 ASN 18 33.675 -39.541 -13.243 763 2HD2 ASN 18 2HD2 ASN 18 33.500 -38.476 -14.608 764 H ARG 19 H ARG 19 29.590 -41.692 -15.886 765 HA ARG 19 HA ARG 19 28.691 -39.253 -14.507 766 1HB ARG 19 1HB ARG 19 29.445 -39.686 -17.209 767 2HB ARG 19 2HB ARG 19 27.711 -39.399 -17.192 768 1HG ARG 19 1HG ARG 19 29.219 -37.379 -17.476 769 2HG ARG 19 2HG ARG 19 27.953 -37.270 -16.251 770 1HD ARG 19 1HD ARG 19 30.408 -38.373 -15.175 771 2HD ARG 19 2HD ARG 19 30.666 -36.783 -15.896 772 HE ARG 19 HE ARG 19 28.874 -37.408 -13.648 773 1HH1 ARG 19 1HH1 ARG 19 30.521 -35.069 -15.672 774 2HH1 ARG 19 2HH1 ARG 19 30.095 -33.711 -14.667 775 1HH2 ARG 19 1HH2 ARG 19 28.336 -35.640 -12.308 776 2HH2 ARG 19 2HH2 ARG 19 28.870 -34.040 -12.743 777 H ASP 20 H ASP 20 26.719 -39.251 -13.699 778 HA ASP 20 HA ASP 20 25.035 -41.578 -14.139 779 1HB ASP 20 1HB ASP 20 25.406 -39.612 -12.026 780 2HB ASP 20 2HB ASP 20 23.701 -39.884 -12.379 781 H LEU 21 H LEU 21 25.321 -38.458 -15.334 782 HA LEU 21 HA LEU 21 24.055 -37.092 -16.624 783 1HB LEU 21 1HB LEU 21 23.395 -39.774 -17.417 784 2HB LEU 21 2HB LEU 21 21.978 -38.754 -17.558 785 HG LEU 21 HG LEU 21 23.250 -38.888 -19.662 786 1HD1 LEU 21 1HD1 LEU 21 22.822 -36.743 -20.222 787 2HD1 LEU 21 2HD1 LEU 21 23.703 -36.087 -18.839 788 3HD1 LEU 21 3HD1 LEU 21 22.070 -36.723 -18.626 789 1HD2 LEU 21 1HD2 LEU 21 25.480 -39.185 -18.945 790 2HD2 LEU 21 2HD2 LEU 21 25.447 -37.711 -17.975 791 3HD2 LEU 21 3HD2 LEU 21 25.431 -37.611 -19.737 792 H GLU 22 H GLU 22 23.476 -37.171 -13.918 793 HA GLU 22 HA GLU 22 20.626 -37.279 -13.515 794 1HB GLU 22 1HB GLU 22 23.017 -36.970 -11.863 795 2HB GLU 22 2HB GLU 22 21.706 -35.915 -11.354 796 1HG GLU 22 1HG GLU 22 21.781 -38.901 -11.470 797 2HG GLU 22 2HG GLU 22 21.416 -37.850 -10.101 798 H ARG 23 H ARG 23 19.271 -35.519 -13.067 799 HA ARG 23 HA ARG 23 20.344 -32.875 -13.762 800 1HB ARG 23 1HB ARG 23 18.125 -34.357 -15.039 801 2HB ARG 23 2HB ARG 23 17.809 -32.664 -14.688 802 1HG ARG 23 1HG ARG 23 19.712 -31.985 -15.996 803 2HG ARG 23 2HG ARG 23 20.178 -33.669 -16.251 804 1HD ARG 23 1HD ARG 23 17.796 -32.198 -17.340 805 2HD ARG 23 2HD ARG 23 19.085 -33.009 -18.229 806 HE ARG 23 HE ARG 23 18.113 -35.114 -17.132 807 1HH1 ARG 23 1HH1 ARG 23 16.230 -32.319 -18.070 808 2HH1 ARG 23 2HH1 ARG 23 14.780 -33.225 -18.371 809 1HH2 ARG 23 1HH2 ARG 23 16.215 -36.318 -17.512 810 2HH2 ARG 23 2HH2 ARG 23 14.758 -35.505 -18.012 811 H VAL 24 H VAL 24 19.396 -31.145 -12.720 812 HA VAL 24 HA VAL 24 17.321 -31.704 -10.738 813 HB VAL 24 HB VAL 24 18.910 -29.881 -9.405 814 1HG1 VAL 24 1HG1 VAL 24 19.563 -32.290 -8.251 815 2HG1 VAL 24 2HG1 VAL 24 18.054 -32.643 -9.094 816 3HG1 VAL 24 3HG1 VAL 24 18.118 -31.335 -7.911 817 1HG2 VAL 24 1HG2 VAL 24 20.903 -31.973 -9.736 818 2HG2 VAL 24 2HG2 VAL 24 21.096 -30.220 -9.723 819 3HG2 VAL 24 3HG2 VAL 24 20.643 -31.047 -11.213 820 H VAL 25 H VAL 25 15.827 -30.538 -11.818 821 HA VAL 25 HA VAL 25 16.377 -28.077 -13.110 822 HB VAL 25 HB VAL 25 13.666 -29.057 -12.214 823 1HG1 VAL 25 1HG1 VAL 25 13.392 -26.864 -12.944 824 2HG1 VAL 25 2HG1 VAL 25 13.038 -27.818 -14.384 825 3HG1 VAL 25 3HG1 VAL 25 14.608 -27.030 -14.211 826 1HG2 VAL 25 1HG2 VAL 25 14.233 -30.853 -13.467 827 2HG2 VAL 25 2HG2 VAL 25 15.461 -29.973 -14.376 828 3HG2 VAL 25 3HG2 VAL 25 13.754 -29.779 -14.781 829 H THR 26 H THR 26 16.841 -26.242 -12.151 830 HA THR 26 HA THR 26 16.422 -25.732 -9.411 831 HB THR 26 HB THR 26 16.798 -23.269 -10.769 832 HG1 THR 26 HG1 THR 26 17.767 -23.830 -12.561 833 1HG2 THR 26 1HG2 THR 26 19.040 -23.387 -9.814 834 2HG2 THR 26 2HG2 THR 26 18.832 -25.111 -9.500 835 3HG2 THR 26 3HG2 THR 26 17.841 -23.932 -8.639 836 H ALA 27 H ALA 27 15.039 -24.214 -8.408 837 HA ALA 27 HA ALA 27 12.431 -24.085 -9.667 838 1HB ALA 27 1HB ALA 27 12.385 -24.781 -7.416 839 2HB ALA 27 2HB ALA 27 11.762 -23.130 -7.415 840 3HB ALA 27 3HB ALA 27 13.421 -23.449 -6.899 841 HA PRO 28 HA PRO 28 13.289 -19.900 -10.988 842 1HB PRO 28 1HB PRO 28 11.100 -19.594 -12.515 843 2HB PRO 28 2HB PRO 28 12.450 -20.617 -13.022 844 1HG PRO 28 1HG PRO 28 9.830 -21.399 -11.808 845 2HG PRO 28 2HG PRO 28 10.716 -22.160 -13.141 846 1HD PRO 28 1HD PRO 28 10.751 -23.083 -10.562 847 2HD PRO 28 2HD PRO 28 12.064 -23.349 -11.727 848 H VAL 29 H VAL 29 11.781 -17.856 -11.173 849 HA VAL 29 HA VAL 29 10.047 -17.785 -8.786 850 HB VAL 29 HB VAL 29 11.326 -15.266 -9.710 851 1HG1 VAL 29 1HG1 VAL 29 10.706 -16.429 -6.999 852 2HG1 VAL 29 2HG1 VAL 29 9.731 -15.254 -7.881 853 3HG1 VAL 29 3HG1 VAL 29 11.334 -14.809 -7.300 854 1HG2 VAL 29 1HG2 VAL 29 13.262 -16.671 -9.757 855 2HG2 VAL 29 2HG2 VAL 29 12.819 -17.424 -8.225 856 3HG2 VAL 29 3HG2 VAL 29 13.316 -15.733 -8.265 857 H SER 30 H SER 30 8.346 -18.350 -10.304 858 HA SER 30 HA SER 30 7.566 -16.170 -12.107 859 1HB SER 30 1HB SER 30 5.997 -18.659 -12.184 860 2HB SER 30 2HB SER 30 6.726 -17.742 -13.506 861 HG SER 30 HG SER 30 8.782 -18.656 -12.788 862 H SER 31 H SER 31 6.189 -18.377 -9.676 863 HA SER 31 HA SER 31 4.418 -16.224 -8.813 864 1HB SER 31 1HB SER 31 2.859 -18.606 -8.738 865 2HB SER 31 2HB SER 31 2.552 -17.132 -9.654 866 HG SER 31 HG SER 31 4.036 -19.419 -10.474 867 H GLY 32 H GLY 32 3.519 -16.563 -6.686 868 1HA GLY 32 1HA GLY 32 3.452 -17.505 -4.557 869 2HA GLY 32 2HA GLY 32 4.472 -18.817 -5.128 870 H LYS 33 H LYS 33 6.750 -17.982 -5.787 871 HA LYS 33 HA LYS 33 7.924 -16.872 -3.415 872 1HB LYS 33 1HB LYS 33 9.131 -17.695 -6.060 873 2HB LYS 33 2HB LYS 33 10.069 -17.156 -4.674 874 1HG LYS 33 1HG LYS 33 8.206 -19.293 -4.020 875 2HG LYS 33 2HG LYS 33 9.384 -19.748 -5.251 876 1HD LYS 33 1HD LYS 33 10.903 -20.034 -3.655 877 2HD LYS 33 2HD LYS 33 10.779 -18.320 -3.254 878 1HE LYS 33 1HE LYS 33 8.533 -19.466 -2.092 879 2HE LYS 33 2HE LYS 33 9.817 -20.642 -1.807 880 1HZ LYS 33 1HZ LYS 33 9.347 -18.418 -0.320 881 2HZ LYS 33 2HZ LYS 33 10.640 -17.936 -1.309 882 3HZ LYS 33 3HZ LYS 33 10.791 -19.312 -0.328 883 H ILE 34 H ILE 34 6.353 -15.408 -5.800 884 HA ILE 34 HA ILE 34 7.805 -12.914 -5.372 885 HB ILE 34 HB ILE 34 8.370 -13.843 -7.661 886 1HG1 ILE 34 1HG1 ILE 34 7.038 -11.395 -8.431 887 2HG1 ILE 34 2HG1 ILE 34 7.772 -11.236 -6.838 888 1HG2 ILE 34 1HG2 ILE 34 5.492 -13.963 -7.828 889 2HG2 ILE 34 2HG2 ILE 34 6.715 -14.674 -8.882 890 3HG2 ILE 34 3HG2 ILE 34 6.175 -13.017 -9.151 891 1HD1 ILE 34 1HD1 ILE 34 9.920 -11.875 -7.728 892 2HD1 ILE 34 2HD1 ILE 34 9.261 -10.527 -8.653 893 3HD1 ILE 34 3HD1 ILE 34 9.207 -12.160 -9.316 894 H LYS 35 H LYS 35 6.459 -11.134 -5.186 895 HA LYS 35 HA LYS 35 3.570 -11.641 -5.341 896 1HB LYS 35 1HB LYS 35 4.010 -9.943 -3.121 897 2HB LYS 35 2HB LYS 35 3.340 -11.565 -3.124 898 1HG LYS 35 1HG LYS 35 6.299 -11.249 -3.158 899 2HG LYS 35 2HG LYS 35 5.426 -10.938 -1.659 900 1HD LYS 35 1HD LYS 35 5.466 -13.493 -3.264 901 2HD LYS 35 2HD LYS 35 6.132 -13.228 -1.652 902 1HE LYS 35 1HE LYS 35 4.176 -13.680 -0.692 903 2HE LYS 35 2HE LYS 35 3.331 -12.538 -1.738 904 1HZ LYS 35 1HZ LYS 35 2.833 -15.109 -1.801 905 2HZ LYS 35 2HZ LYS 35 4.129 -15.105 -2.891 906 3HZ LYS 35 3HZ LYS 35 2.757 -14.157 -3.206 907 H ARG 36 H ARG 36 2.257 -9.743 -5.453 908 HA ARG 36 HA ARG 36 3.703 -7.481 -6.662 909 1HB ARG 36 1HB ARG 36 0.899 -8.525 -7.007 910 2HB ARG 36 2HB ARG 36 1.367 -6.920 -7.554 911 1HG ARG 36 1HG ARG 36 2.811 -7.758 -9.175 912 2HG ARG 36 2HG ARG 36 2.883 -9.349 -8.417 913 1HD ARG 36 1HD ARG 36 1.493 -9.139 -10.542 914 2HD ARG 36 2HD ARG 36 0.735 -9.924 -9.156 915 HE ARG 36 HE ARG 36 -0.766 -8.189 -9.002 916 1HH1 ARG 36 1HH1 ARG 36 1.759 -7.380 -11.301 917 2HH1 ARG 36 2HH1 ARG 36 0.983 -5.916 -11.833 918 1HH2 ARG 36 1HH2 ARG 36 -1.803 -6.282 -9.715 919 2HH2 ARG 36 2HH2 ARG 36 -1.053 -5.298 -10.946 920 H VAL 37 H VAL 37 3.843 -5.668 -5.516 921 HA VAL 37 HA VAL 37 1.799 -5.180 -3.443 922 HB VAL 37 HB VAL 37 4.743 -4.489 -3.328 923 1HG1 VAL 37 1HG1 VAL 37 2.431 -3.461 -1.859 924 2HG1 VAL 37 2HG1 VAL 37 4.047 -2.785 -2.050 925 3HG1 VAL 37 3HG1 VAL 37 3.750 -4.025 -0.833 926 1HG2 VAL 37 1HG2 VAL 37 5.059 -6.232 -1.916 927 2HG2 VAL 37 2HG2 VAL 37 3.695 -6.891 -2.817 928 3HG2 VAL 37 3HG2 VAL 37 3.431 -6.130 -1.249 929 H ASN 38 H ASN 38 0.634 -3.410 -3.771 930 HA ASN 38 HA ASN 38 1.734 -1.322 -5.534 931 1HB ASN 38 1HB ASN 38 -0.367 -2.177 -6.369 932 2HB ASN 38 2HB ASN 38 -1.130 -1.964 -4.796 933 1HD2 ASN 38 1HD2 ASN 38 -2.437 -0.293 -4.729 934 2HD2 ASN 38 2HD2 ASN 38 -2.234 1.201 -5.582 935 H VAL 39 H VAL 39 2.534 0.377 -4.519 936 HA VAL 39 HA VAL 39 1.374 1.106 -1.914 937 HB VAL 39 HB VAL 39 4.076 2.064 -2.225 938 1HG1 VAL 39 1HG1 VAL 39 3.257 0.032 -0.211 939 2HG1 VAL 39 2HG1 VAL 39 2.497 1.627 -0.175 940 3HG1 VAL 39 3HG1 VAL 39 4.250 1.478 -0.020 941 1HG2 VAL 39 1HG2 VAL 39 5.109 -0.250 -1.901 942 2HG2 VAL 39 2HG2 VAL 39 4.639 0.204 -3.540 943 3HG2 VAL 39 3HG2 VAL 39 3.617 -0.883 -2.598 944 H ASN 40 H ASN 40 1.614 3.346 -1.307 945 HA ASN 40 HA ASN 40 1.734 5.157 -3.619 946 1HB ASN 40 1HB ASN 40 0.289 6.697 -2.166 947 2HB ASN 40 2HB ASN 40 -0.504 5.304 -2.894 948 1HD2 ASN 40 1HD2 ASN 40 -1.513 3.896 -1.624 949 2HD2 ASN 40 2HD2 ASN 40 -1.491 3.921 0.109 950 H PHE 41 H PHE 41 3.100 6.835 -3.499 951 HA PHE 41 HA PHE 41 4.522 7.264 -0.952 952 1HB PHE 41 1HB PHE 41 5.781 7.327 -3.709 953 2HB PHE 41 2HB PHE 41 6.609 7.553 -2.169 954 HD1 PHE 41 HD1 PHE 41 6.063 5.499 -0.469 955 HD2 PHE 41 HD2 PHE 41 6.116 5.311 -4.721 956 HE1 PHE 41 HE1 PHE 41 6.511 3.086 -0.352 957 HE2 PHE 41 HE2 PHE 41 6.560 2.892 -4.610 958 HZ PHE 41 HZ PHE 41 6.737 1.771 -2.449 959 H ASP 42 H ASP 42 5.562 9.423 -0.829 960 HA ASP 42 HA ASP 42 3.703 11.405 -1.772 961 1HB ASP 42 1HB ASP 42 4.327 12.466 0.086 962 2HB ASP 42 2HB ASP 42 5.421 11.135 0.426 963 H GLU 43 H GLU 43 4.326 13.333 -2.920 964 HA GLU 43 HA GLU 43 5.532 12.769 -5.337 965 1HB GLU 43 1HB GLU 43 3.948 14.601 -5.038 966 2HB GLU 43 2HB GLU 43 5.114 15.475 -4.054 967 1HG GLU 43 1HG GLU 43 5.627 16.522 -5.951 968 2HG GLU 43 2HG GLU 43 6.534 15.059 -6.335 969 H GLU 44 H GLU 44 6.943 14.260 -2.466 970 HA GLU 44 HA GLU 44 9.446 14.958 -3.628 971 1HB GLU 44 1HB GLU 44 8.469 15.705 -1.374 972 2HB GLU 44 2HB GLU 44 9.012 14.148 -0.763 973 1HG GLU 44 1HG GLU 44 11.211 15.242 -2.094 974 2HG GLU 44 2HG GLU 44 10.497 16.567 -1.173 975 H LYS 45 H LYS 45 8.279 12.159 -1.822 976 HA LYS 45 HA LYS 45 10.596 10.603 -1.862 977 1HB LYS 45 1HB LYS 45 8.001 10.307 -0.942 978 2HB LYS 45 2HB LYS 45 8.121 9.075 -2.190 979 1HG LYS 45 1HG LYS 45 8.826 7.900 -0.362 980 2HG LYS 45 2HG LYS 45 10.372 8.492 -0.977 981 1HD LYS 45 1HD LYS 45 10.744 9.427 1.005 982 2HD LYS 45 2HD LYS 45 9.377 10.502 0.710 983 1HE LYS 45 1HE LYS 45 7.901 8.655 1.608 984 2HE LYS 45 2HE LYS 45 9.381 7.852 2.133 985 1HZ LYS 45 1HZ LYS 45 9.908 9.967 3.355 986 2HZ LYS 45 2HZ LYS 45 8.603 9.073 3.967 987 3HZ LYS 45 3HZ LYS 45 8.312 10.465 3.041 988 H HIS 46 H HIS 46 8.205 11.226 -4.312 989 HA HIS 46 HA HIS 46 8.999 9.061 -6.018 990 1HB HIS 46 1HB HIS 46 6.742 10.336 -5.934 991 2HB HIS 46 2HB HIS 46 7.547 11.498 -6.983 992 HD1 HIS 46 HD1 HIS 46 6.589 11.099 -9.217 993 HD2 HIS 46 HD2 HIS 46 7.630 7.542 -7.326 994 HE1 HIS 46 HE1 HIS 46 6.063 9.270 -10.860 995 HE2 HIS 46 HE2 HIS 46 6.487 7.127 -9.616 996 H THR 47 H THR 47 9.561 12.585 -6.054 997 HA THR 47 HA THR 47 11.202 12.542 -8.376 998 HB THR 47 HB THR 47 11.582 14.650 -6.294 999 HG1 THR 47 HG1 THR 47 9.208 14.226 -7.815 1000 1HG2 THR 47 1HG2 THR 47 12.548 14.478 -8.740 1001 2HG2 THR 47 2HG2 THR 47 12.026 16.027 -8.081 1002 3HG2 THR 47 3HG2 THR 47 10.969 15.128 -9.170 1003 H ARG 48 H ARG 48 11.848 12.376 -4.917 1004 HA ARG 48 HA ARG 48 14.670 12.388 -4.988 1005 1HB ARG 48 1HB ARG 48 12.617 12.000 -3.067 1006 2HB ARG 48 2HB ARG 48 13.692 10.614 -2.963 1007 1HG ARG 48 1HG ARG 48 15.549 12.481 -2.942 1008 2HG ARG 48 2HG ARG 48 14.210 13.471 -2.347 1009 1HD ARG 48 1HD ARG 48 13.783 11.808 -0.591 1010 2HD ARG 48 2HD ARG 48 15.146 10.856 -1.171 1011 HE ARG 48 HE ARG 48 15.234 13.192 0.485 1012 1HH1 ARG 48 1HH1 ARG 48 17.047 11.433 -1.936 1013 2HH1 ARG 48 2HH1 ARG 48 18.597 11.854 -1.275 1014 1HH2 ARG 48 1HH2 ARG 48 17.250 13.728 1.380 1015 2HH2 ARG 48 2HH2 ARG 48 18.714 13.157 0.623 1016 H PHE 49 H PHE 49 12.268 9.819 -5.227 1017 HA PHE 49 HA PHE 49 14.048 7.640 -5.330 1018 1HB PHE 49 1HB PHE 49 11.582 7.496 -4.912 1019 2HB PHE 49 2HB PHE 49 11.318 7.832 -6.619 1020 HD1 PHE 49 HD1 PHE 49 13.792 5.628 -4.912 1021 HD2 PHE 49 HD2 PHE 49 10.478 5.915 -7.566 1022 HE1 PHE 49 HE1 PHE 49 13.988 3.228 -5.410 1023 HE2 PHE 49 HE2 PHE 49 10.673 3.518 -8.072 1024 HZ PHE 49 HZ PHE 49 12.430 2.172 -6.993 1025 H LYS 50 H LYS 50 12.494 9.544 -7.887 1026 HA LYS 50 HA LYS 50 13.520 8.166 -10.085 1027 1HB LYS 50 1HB LYS 50 12.510 10.939 -9.632 1028 2HB LYS 50 2HB LYS 50 13.302 10.568 -11.158 1029 1HG LYS 50 1HG LYS 50 11.692 8.788 -11.572 1030 2HG LYS 50 2HG LYS 50 10.914 9.126 -10.025 1031 1HD LYS 50 1HD LYS 50 9.619 10.611 -11.052 1032 2HD LYS 50 2HD LYS 50 11.056 11.578 -11.390 1033 1HE LYS 50 1HE LYS 50 10.049 9.333 -13.136 1034 2HE LYS 50 2HE LYS 50 9.711 11.041 -13.410 1035 1HZ LYS 50 1HZ LYS 50 12.290 9.614 -13.613 1036 2HZ LYS 50 2HZ LYS 50 12.242 11.296 -13.392 1037 3HZ LYS 50 3HZ LYS 50 11.527 10.600 -14.761 1038 H ALA 51 H ALA 51 14.868 10.828 -8.207 1039 HA ALA 51 HA ALA 51 17.191 11.239 -9.777 1040 1HB ALA 51 1HB ALA 51 17.200 12.987 -8.397 1041 2HB ALA 51 2HB ALA 51 17.885 11.911 -7.179 1042 3HB ALA 51 3HB ALA 51 16.142 12.174 -7.244 1043 H ALA 52 H ALA 52 16.511 9.227 -6.945 1044 HA ALA 52 HA ALA 52 19.114 8.201 -6.611 1045 1HB ALA 52 1HB ALA 52 17.496 6.205 -5.689 1046 2HB ALA 52 2HB ALA 52 16.437 7.613 -5.600 1047 3HB ALA 52 3HB ALA 52 17.993 7.626 -4.767 1048 H CYS 53 H CYS 53 16.374 7.105 -8.568 1049 HA CYS 53 HA CYS 53 17.453 4.644 -9.401 1050 1HB CYS 53 1HB CYS 53 15.618 6.461 -10.980 1051 2HB CYS 53 2HB CYS 53 15.853 4.738 -11.241 1052 HG CYS 53 HG CYS 53 14.549 6.007 -8.346 1053 H ALA 54 H ALA 54 17.665 7.889 -10.797 1054 HA ALA 54 HA ALA 54 19.112 7.167 -13.105 1055 1HB ALA 54 1HB ALA 54 18.482 9.264 -13.512 1056 2HB ALA 54 2HB ALA 54 19.868 9.767 -12.546 1057 3HB ALA 54 3HB ALA 54 18.277 9.616 -11.797 1058 H ARG 55 H ARG 55 20.091 7.930 -9.839 1059 HA ARG 55 HA ARG 55 22.858 8.250 -10.422 1060 1HB ARG 55 1HB ARG 55 21.171 8.607 -8.194 1061 2HB ARG 55 2HB ARG 55 22.399 7.453 -7.695 1062 1HG ARG 55 1HG ARG 55 24.042 9.173 -8.769 1063 2HG ARG 55 2HG ARG 55 22.698 10.295 -8.542 1064 1HD ARG 55 1HD ARG 55 23.232 8.645 -6.196 1065 2HD ARG 55 2HD ARG 55 24.604 9.649 -6.665 1066 HE ARG 55 HE ARG 55 21.949 10.863 -6.354 1067 1HH1 ARG 55 1HH1 ARG 55 25.274 10.544 -5.283 1068 2HH1 ARG 55 2HH1 ARG 55 25.209 11.956 -4.269 1069 1HH2 ARG 55 1HH2 ARG 55 21.857 12.702 -5.035 1070 2HH2 ARG 55 2HH2 ARG 55 23.274 13.203 -4.148 1071 H LYS 56 H LYS 56 20.866 5.494 -10.082 1072 HA LYS 56 HA LYS 56 23.233 3.799 -9.625 1073 1HB LYS 56 1HB LYS 56 20.337 3.089 -9.119 1074 2HB LYS 56 2HB LYS 56 21.742 2.112 -8.718 1075 1HG LYS 56 1HG LYS 56 21.621 4.841 -7.579 1076 2HG LYS 56 2HG LYS 56 20.504 3.635 -6.936 1077 1HD LYS 56 1HD LYS 56 22.176 2.960 -5.622 1078 2HD LYS 56 2HD LYS 56 22.930 2.301 -7.076 1079 1HE LYS 56 1HE LYS 56 24.495 3.909 -7.140 1080 2HE LYS 56 2HE LYS 56 23.355 5.172 -6.679 1081 1HZ LYS 56 1HZ LYS 56 25.267 3.874 -5.085 1082 2HZ LYS 56 2HZ LYS 56 23.732 3.517 -4.462 1083 3HZ LYS 56 3HZ LYS 56 24.214 5.131 -4.655 1084 H GLY 57 H GLY 57 20.735 4.598 -11.828 1085 1HA GLY 57 1HA GLY 57 20.407 3.926 -14.008 1086 2HA GLY 57 2HA GLY 57 21.820 2.889 -13.858 1087 H THR 58 H THR 58 18.752 2.979 -12.079 1088 HA THR 58 HA THR 58 18.420 0.121 -12.717 1089 HB THR 58 HB THR 58 17.059 1.205 -10.342 1090 HG1 THR 58 HG1 THR 58 19.886 0.833 -10.287 1091 1HG2 THR 58 1HG2 THR 58 17.649 -0.875 -9.380 1092 2HG2 THR 58 2HG2 THR 58 18.903 -1.162 -10.587 1093 3HG2 THR 58 3HG2 THR 58 17.203 -1.219 -11.051 1094 H SER 59 H SER 59 16.381 -0.682 -13.155 1095 HA SER 59 HA SER 59 14.440 1.045 -14.303 1096 1HB SER 59 1HB SER 59 13.279 -1.457 -13.662 1097 2HB SER 59 2HB SER 59 13.906 -0.931 -15.226 1098 HG SER 59 HG SER 59 14.885 -2.882 -14.362 1099 H ILE 60 H ILE 60 12.744 2.027 -13.376 1100 HA ILE 60 HA ILE 60 12.662 2.771 -10.833 1101 HB ILE 60 HB ILE 60 11.210 3.875 -12.313 1102 1HG1 ILE 60 1HG1 ILE 60 8.962 2.781 -10.814 1103 2HG1 ILE 60 2HG1 ILE 60 10.365 3.075 -9.791 1104 1HG2 ILE 60 1HG2 ILE 60 9.473 1.432 -12.540 1105 2HG2 ILE 60 2HG2 ILE 60 10.727 1.846 -13.707 1106 3HG2 ILE 60 3HG2 ILE 60 9.360 2.932 -13.458 1107 1HD1 ILE 60 1HD1 ILE 60 10.436 5.395 -10.709 1108 2HD1 ILE 60 2HD1 ILE 60 9.004 5.020 -9.747 1109 3HD1 ILE 60 3HD1 ILE 60 8.903 5.058 -11.509 1110 H THR 61 H THR 61 10.856 -0.124 -11.920 1111 HA THR 61 HA THR 61 9.778 -0.692 -9.366 1112 HB THR 61 HB THR 61 10.335 -2.831 -11.390 1113 HG1 THR 61 HG1 THR 61 9.156 -1.821 -12.822 1114 1HG2 THR 61 1HG2 THR 61 9.058 -2.975 -9.054 1115 2HG2 THR 61 2HG2 THR 61 8.562 -3.920 -10.458 1116 3HG2 THR 61 3HG2 THR 61 7.714 -2.427 -10.056 1117 H ASP 62 H ASP 62 12.727 -1.738 -11.001 1118 HA ASP 62 HA ASP 62 13.464 -3.726 -9.133 1119 1HB ASP 62 1HB ASP 62 14.339 -3.277 -11.549 1120 2HB ASP 62 2HB ASP 62 15.501 -2.224 -10.741 1121 H VAL 63 H VAL 63 14.029 -0.247 -9.229 1122 HA VAL 63 HA VAL 63 16.001 -0.307 -7.149 1123 HB VAL 63 HB VAL 63 14.732 2.231 -7.105 1124 1HG1 VAL 63 1HG1 VAL 63 17.070 1.792 -6.638 1125 2HG1 VAL 63 2HG1 VAL 63 16.910 2.980 -7.933 1126 3HG1 VAL 63 3HG1 VAL 63 17.333 1.311 -8.315 1127 1HG2 VAL 63 1HG2 VAL 63 13.722 1.836 -9.224 1128 2HG2 VAL 63 2HG2 VAL 63 15.216 1.166 -9.876 1129 3HG2 VAL 63 3HG2 VAL 63 15.116 2.881 -9.488 1130 H VAL 64 H VAL 64 12.530 -0.291 -7.224 1131 HA VAL 64 HA VAL 64 12.162 0.490 -4.497 1132 HB VAL 64 HB VAL 64 10.278 -1.379 -5.905 1133 1HG1 VAL 64 1HG1 VAL 64 8.957 -0.925 -4.175 1134 2HG1 VAL 64 2HG1 VAL 64 9.100 0.809 -4.470 1135 3HG1 VAL 64 3HG1 VAL 64 10.282 -0.012 -3.454 1136 1HG2 VAL 64 1HG2 VAL 64 9.205 1.028 -6.479 1137 2HG2 VAL 64 2HG2 VAL 64 10.199 0.103 -7.605 1138 3HG2 VAL 64 3HG2 VAL 64 10.921 1.398 -6.650 1139 H ASN 65 H ASN 65 12.609 -2.548 -6.220 1140 HA ASN 65 HA ASN 65 12.482 -4.289 -3.989 1141 1HB ASN 65 1HB ASN 65 12.431 -5.193 -6.234 1142 2HB ASN 65 2HB ASN 65 14.012 -4.504 -6.593 1143 1HD2 ASN 65 1HD2 ASN 65 15.651 -5.861 -6.476 1144 2HD2 ASN 65 2HD2 ASN 65 15.700 -7.321 -5.553 1145 H GLN 66 H GLN 66 14.984 -2.207 -5.265 1146 HA GLN 66 HA GLN 66 17.180 -3.246 -3.829 1147 1HB GLN 66 1HB GLN 66 17.088 -1.557 -5.816 1148 2HB GLN 66 2HB GLN 66 16.966 -0.344 -4.550 1149 1HG GLN 66 1HG GLN 66 19.280 -0.927 -5.511 1150 2HG GLN 66 2HG GLN 66 19.094 -0.757 -3.765 1151 1HE2 GLN 66 1HE2 GLN 66 18.955 -3.219 -6.318 1152 2HE2 GLN 66 2HE2 GLN 66 19.702 -4.472 -5.378 1153 H LEU 67 H LEU 67 14.873 -0.623 -3.040 1154 HA LEU 67 HA LEU 67 16.165 0.114 -0.633 1155 1HB LEU 67 1HB LEU 67 13.331 0.460 -0.372 1156 2HB LEU 67 2HB LEU 67 14.591 1.667 -0.479 1157 HG LEU 67 HG LEU 67 13.943 0.535 -3.081 1158 1HD1 LEU 67 1HD1 LEU 67 11.771 2.276 -2.126 1159 2HD1 LEU 67 2HD1 LEU 67 11.757 0.626 -1.504 1160 3HD1 LEU 67 3HD1 LEU 67 11.731 0.913 -3.244 1161 1HD2 LEU 67 1HD2 LEU 67 14.064 2.763 -3.758 1162 2HD2 LEU 67 2HD2 LEU 67 15.208 2.676 -2.420 1163 3HD2 LEU 67 3HD2 LEU 67 13.609 3.373 -2.166 1164 H VAL 68 H VAL 68 13.580 -2.206 -1.347 1165 HA VAL 68 HA VAL 68 13.086 -2.971 1.332 1166 HB VAL 68 HB VAL 68 12.827 -4.945 -0.914 1167 1HG1 VAL 68 1HG1 VAL 68 11.172 -4.330 1.529 1168 2HG1 VAL 68 2HG1 VAL 68 12.294 -5.678 1.336 1169 3HG1 VAL 68 3HG1 VAL 68 10.831 -5.601 0.354 1170 1HG2 VAL 68 1HG2 VAL 68 11.271 -2.425 -0.533 1171 2HG2 VAL 68 2HG2 VAL 68 10.454 -3.871 -1.124 1172 3HG2 VAL 68 3HG2 VAL 68 11.812 -3.195 -2.025 1173 H ASP 69 H ASP 69 15.405 -4.067 -1.075 1174 HA ASP 69 HA ASP 69 16.342 -6.356 0.229 1175 1HB ASP 69 1HB ASP 69 16.909 -5.376 -2.135 1176 2HB ASP 69 2HB ASP 69 18.234 -4.580 -1.277 1177 H ASN 70 H ASN 70 17.527 -3.032 0.342 1178 HA ASN 70 HA ASN 70 19.571 -3.466 2.245 1179 1HB ASN 70 1HB ASN 70 18.066 -1.031 1.314 1180 2HB ASN 70 2HB ASN 70 19.227 -0.922 2.633 1181 1HD2 ASN 70 1HD2 ASN 70 18.836 -1.771 -0.756 1182 2HD2 ASN 70 2HD2 ASN 70 20.484 -1.495 -1.196 1183 H TRP 71 H TRP 71 16.257 -2.238 2.562 1184 HA TRP 71 HA TRP 71 16.244 -1.794 5.307 1185 1HB TRP 71 1HB TRP 71 14.499 -1.054 3.689 1186 2HB TRP 71 2HB TRP 71 13.922 -2.714 3.598 1187 HD1 TRP 71 HD1 TRP 71 13.913 0.340 5.860 1188 HE1 TRP 71 HE1 TRP 71 12.207 -0.009 7.747 1189 HE3 TRP 71 HE3 TRP 71 12.732 -4.557 4.974 1190 HZ2 TRP 71 HZ2 TRP 71 10.571 -2.085 8.729 1191 HZ3 TRP 71 HZ3 TRP 71 11.074 -5.646 6.426 1192 HH2 TRP 71 HH2 TRP 71 10.013 -4.430 8.267 1193 H LEU 72 H LEU 72 15.032 -4.639 3.561 1194 HA LEU 72 HA LEU 72 14.166 -6.011 5.797 1195 1HB LEU 72 1HB LEU 72 13.978 -6.388 3.145 1196 2HB LEU 72 2HB LEU 72 15.132 -7.649 3.544 1197 HG LEU 72 HG LEU 72 13.184 -7.985 5.458 1198 1HD1 LEU 72 1HD1 LEU 72 11.644 -6.470 4.486 1199 2HD1 LEU 72 2HD1 LEU 72 11.089 -8.093 4.082 1200 3HD1 LEU 72 3HD1 LEU 72 11.921 -7.121 2.870 1201 1HD2 LEU 72 1HD2 LEU 72 13.075 -9.379 2.810 1202 2HD2 LEU 72 2HD2 LEU 72 12.815 -10.033 4.428 1203 3HD2 LEU 72 3HD2 LEU 72 14.442 -9.602 3.900 1204 H LYS 73 H LYS 73 17.229 -6.525 4.030 1205 HA LYS 73 HA LYS 73 17.914 -8.610 5.874 1206 1HB LYS 73 1HB LYS 73 19.691 -7.414 3.760 1207 2HB LYS 73 2HB LYS 73 19.813 -9.011 4.486 1208 1HG LYS 73 1HG LYS 73 18.064 -9.857 3.251 1209 2HG LYS 73 2HG LYS 73 17.316 -8.272 3.038 1210 1HD LYS 73 1HD LYS 73 18.268 -8.129 1.042 1211 2HD LYS 73 2HD LYS 73 19.847 -8.123 1.827 1212 1HE LYS 73 1HE LYS 73 20.236 -10.319 1.378 1213 2HE LYS 73 2HE LYS 73 18.526 -10.747 1.461 1214 1HZ LYS 73 1HZ LYS 73 18.494 -10.712 -0.741 1215 2HZ LYS 73 2HZ LYS 73 20.089 -10.148 -0.815 1216 3HZ LYS 73 3HZ LYS 73 18.802 -9.046 -0.707 1217 H GLU 74 H GLU 74 18.635 -5.229 5.701 1218 HA GLU 74 HA GLU 74 20.955 -5.521 7.435 1219 1HB GLU 74 1HB GLU 74 20.134 -3.626 5.521 1220 2HB GLU 74 2HB GLU 74 20.143 -2.789 7.068 1221 1HG GLU 74 1HG GLU 74 22.501 -4.409 6.764 1222 2HG GLU 74 2HG GLU 74 22.315 -3.295 5.410 1223 H ASN 75 H ASN 75 17.672 -4.211 7.587 1224 HA ASN 75 HA ASN 75 18.055 -3.179 10.234 1225 1HB ASN 75 1HB ASN 75 16.347 -1.884 9.634 1226 2HB ASN 75 2HB ASN 75 16.208 -2.777 8.132 1227 1HD2 ASN 75 1HD2 ASN 75 14.652 -4.412 7.951 1228 2HD2 ASN 75 2HD2 ASN 75 13.330 -4.518 9.059 1229 H GLU 76 H GLU 76 16.740 -6.121 8.896 1230 HA GLU 76 HA GLU 76 15.566 -6.868 11.453 1231 1HB GLU 76 1HB GLU 76 15.144 -7.616 8.714 1232 2HB GLU 76 2HB GLU 76 15.494 -9.054 9.665 1233 1HG GLU 76 1HG GLU 76 13.517 -7.106 10.722 1234 2HG GLU 76 2HG GLU 76 13.045 -8.147 9.380 Start of MODEL 5 1 1H MET 1 1H MET 1 -46.663 52.395 1.355 2 2H MET 1 2H MET 1 -46.770 51.531 -0.105 3 3H MET 1 3H MET 1 -45.262 51.754 0.639 4 HA MET 1 HA MET 1 -46.299 50.534 2.620 5 1HB MET 1 1HB MET 1 -48.578 50.670 1.542 6 2HB MET 1 2HB MET 1 -48.019 49.494 0.360 7 1HG MET 1 1HG MET 1 -47.451 48.059 2.441 8 2HG MET 1 2HG MET 1 -48.573 49.137 3.268 9 1HE MET 1 1HE MET 1 -51.418 49.364 1.879 10 2HE MET 1 2HE MET 1 -50.730 48.959 3.450 11 3HE MET 1 3HE MET 1 -51.854 47.847 2.666 12 H SER 2 H SER 2 -45.987 49.594 -0.800 13 HA SER 2 HA SER 2 -43.731 47.879 -0.081 14 1HB SER 2 1HB SER 2 -45.276 46.418 -1.967 15 2HB SER 2 2HB SER 2 -44.889 45.974 -0.305 16 HG SER 2 HG SER 2 -46.925 46.226 0.088 17 H LEU 3 H LEU 3 -43.845 50.381 -1.438 18 HA LEU 3 HA LEU 3 -42.818 49.552 -4.056 19 1HB LEU 3 1HB LEU 3 -45.050 51.453 -3.514 20 2HB LEU 3 2HB LEU 3 -43.957 51.811 -4.838 21 HG LEU 3 HG LEU 3 -45.536 49.253 -4.553 22 1HD1 LEU 3 1HD1 LEU 3 -46.472 51.756 -5.271 23 2HD1 LEU 3 2HD1 LEU 3 -47.235 50.205 -5.619 24 3HD1 LEU 3 3HD1 LEU 3 -46.167 50.950 -6.808 25 1HD2 LEU 3 1HD2 LEU 3 -44.639 49.798 -7.196 26 2HD2 LEU 3 2HD2 LEU 3 -44.253 48.428 -6.157 27 3HD2 LEU 3 3HD2 LEU 3 -43.258 49.881 -6.103 28 H GLU 4 H GLU 4 -41.564 50.405 -1.536 29 HA GLU 4 HA GLU 4 -40.554 53.059 -1.965 30 1HB GLU 4 1HB GLU 4 -38.874 52.403 -0.206 31 2HB GLU 4 2HB GLU 4 -40.554 52.290 0.293 32 1HG GLU 4 1HG GLU 4 -39.524 49.809 -0.826 33 2HG GLU 4 2HG GLU 4 -38.646 50.353 0.604 34 H LYS 5 H LYS 5 -38.578 53.662 -2.768 35 HA LYS 5 HA LYS 5 -36.750 53.619 -4.107 36 1HB LYS 5 1HB LYS 5 -36.737 50.711 -3.318 37 2HB LYS 5 2HB LYS 5 -35.559 51.378 -4.440 38 1HG LYS 5 1HG LYS 5 -34.505 52.609 -2.820 39 2HG LYS 5 2HG LYS 5 -35.948 52.715 -1.809 40 1HD LYS 5 1HD LYS 5 -35.695 50.231 -1.417 41 2HD LYS 5 2HD LYS 5 -34.106 50.364 -2.172 42 1HE LYS 5 1HE LYS 5 -34.621 52.356 -0.086 43 2HE LYS 5 2HE LYS 5 -34.620 50.689 0.489 44 1HZ LYS 5 1HZ LYS 5 -32.429 52.320 -0.206 45 2HZ LYS 5 2HZ LYS 5 -32.438 50.949 -1.203 46 3HZ LYS 5 3HZ LYS 5 -32.427 50.770 0.480 47 H ALA 6 H ALA 6 -37.702 54.256 -5.951 48 HA ALA 6 HA ALA 6 -39.388 52.619 -7.537 49 1HB ALA 6 1HB ALA 6 -38.492 55.331 -7.524 50 2HB ALA 6 2HB ALA 6 -39.902 54.628 -8.315 51 3HB ALA 6 3HB ALA 6 -38.351 54.674 -9.154 52 H HIS 7 H HIS 7 -35.994 52.885 -7.283 53 HA HIS 7 HA HIS 7 -34.272 51.799 -8.285 54 1HB HIS 7 1HB HIS 7 -36.054 49.899 -8.197 55 2HB HIS 7 2HB HIS 7 -36.186 50.170 -9.931 56 HD1 HIS 7 HD1 HIS 7 -34.837 48.541 -11.185 57 HD2 HIS 7 HD2 HIS 7 -33.045 49.564 -7.571 58 HE1 HIS 7 HE1 HIS 7 -32.689 47.229 -11.097 59 HE2 HIS 7 HE2 HIS 7 -31.668 47.782 -8.856 60 H THR 8 H THR 8 -35.354 54.192 -9.415 61 HA THR 8 HA THR 8 -35.255 53.964 -12.279 62 HB THR 8 HB THR 8 -34.875 56.652 -11.216 63 HG1 THR 8 HG1 THR 8 -37.409 56.017 -10.535 64 1HG2 THR 8 1HG2 THR 8 -37.179 55.420 -12.730 65 2HG2 THR 8 2HG2 THR 8 -35.720 56.071 -13.476 66 3HG2 THR 8 3HG2 THR 8 -36.803 57.138 -12.584 67 H SER 9 H SER 9 -33.494 54.048 -13.521 68 HA SER 9 HA SER 9 -30.900 54.392 -12.321 69 1HB SER 9 1HB SER 9 -31.382 54.191 -15.282 70 2HB SER 9 2HB SER 9 -30.020 53.586 -14.338 71 HG SER 9 HG SER 9 -31.257 51.835 -14.821 72 H VAL 10 H VAL 10 -31.582 56.661 -11.674 73 HA VAL 10 HA VAL 10 -31.564 58.691 -13.711 74 HB VAL 10 HB VAL 10 -31.096 59.174 -10.773 75 1HG1 VAL 10 1HG1 VAL 10 -30.918 61.232 -11.694 76 2HG1 VAL 10 2HG1 VAL 10 -32.677 61.169 -11.609 77 3HG1 VAL 10 3HG1 VAL 10 -31.854 60.796 -13.122 78 1HG2 VAL 10 1HG2 VAL 10 -33.498 59.297 -10.442 79 2HG2 VAL 10 2HG2 VAL 10 -33.043 57.689 -11.009 80 3HG2 VAL 10 3HG2 VAL 10 -33.772 58.844 -12.124 81 H LYS 11 H LYS 11 -29.927 59.939 -14.373 82 HA LYS 11 HA LYS 11 -27.834 60.745 -14.724 83 1HB LYS 11 1HB LYS 11 -27.223 59.477 -12.049 84 2HB LYS 11 2HB LYS 11 -26.024 60.341 -13.001 85 1HG LYS 11 1HG LYS 11 -26.694 62.255 -12.128 86 2HG LYS 11 2HG LYS 11 -28.320 61.993 -12.764 87 1HD LYS 11 1HD LYS 11 -29.091 61.664 -10.708 88 2HD LYS 11 2HD LYS 11 -27.964 60.326 -10.486 89 1HE LYS 11 1HE LYS 11 -27.622 61.960 -8.741 90 2HE LYS 11 2HE LYS 11 -26.225 61.946 -9.816 91 1HZ LYS 11 1HZ LYS 11 -26.589 64.044 -10.445 92 2HZ LYS 11 2HZ LYS 11 -27.557 64.159 -9.057 93 3HZ LYS 11 3HZ LYS 11 -28.268 63.843 -10.564 94 H LYS 12 H LYS 12 -27.060 57.694 -13.076 95 HA LYS 12 HA LYS 12 -26.664 56.265 -15.516 96 1HB LYS 12 1HB LYS 12 -24.421 57.695 -14.346 97 2HB LYS 12 2HB LYS 12 -24.120 55.967 -14.410 98 1HG LYS 12 1HG LYS 12 -24.546 55.958 -16.802 99 2HG LYS 12 2HG LYS 12 -24.914 57.684 -16.755 100 1HD LYS 12 1HD LYS 12 -22.738 58.266 -16.682 101 2HD LYS 12 2HD LYS 12 -22.326 56.949 -15.579 102 1HE LYS 12 1HE LYS 12 -22.909 56.507 -18.495 103 2HE LYS 12 2HE LYS 12 -21.290 56.851 -17.891 104 1HZ LYS 12 1HZ LYS 12 -22.991 54.493 -17.360 105 2HZ LYS 12 2HZ LYS 12 -21.694 54.890 -16.342 106 3HZ LYS 12 3HZ LYS 12 -21.410 54.540 -17.974 107 H MET 13 H MET 13 -26.454 54.045 -15.152 108 HA MET 13 HA MET 13 -26.600 53.231 -12.318 109 1HB MET 13 1HB MET 13 -28.537 52.794 -14.109 110 2HB MET 13 2HB MET 13 -27.521 51.410 -14.484 111 1HG MET 13 1HG MET 13 -27.930 51.718 -11.634 112 2HG MET 13 2HG MET 13 -29.447 51.554 -12.517 113 1HE MET 13 1HE MET 13 -29.767 49.431 -10.960 114 2HE MET 13 2HE MET 13 -29.565 47.900 -11.814 115 3HE MET 13 3HE MET 13 -30.465 49.219 -12.564 116 H THR 14 H THR 14 -24.978 52.006 -11.584 117 HA THR 14 HA THR 14 -22.782 51.441 -13.320 118 HB THR 14 HB THR 14 -21.865 50.301 -11.218 119 HG1 THR 14 HG1 THR 14 -23.566 49.989 -9.901 120 1HG2 THR 14 1HG2 THR 14 -21.354 52.478 -10.178 121 2HG2 THR 14 2HG2 THR 14 -22.590 53.231 -11.184 122 3HG2 THR 14 3HG2 THR 14 -21.163 52.514 -11.930 123 H PHE 15 H PHE 15 -21.820 49.422 -13.729 124 HA PHE 15 HA PHE 15 -23.612 47.110 -13.416 125 1HB PHE 15 1HB PHE 15 -22.960 46.310 -15.626 126 2HB PHE 15 2HB PHE 15 -23.669 47.914 -15.749 127 HD1 PHE 15 HD1 PHE 15 -20.725 45.889 -16.293 128 HD2 PHE 15 HD2 PHE 15 -22.211 49.873 -16.155 129 HE1 PHE 15 HE1 PHE 15 -18.739 46.669 -17.517 130 HE2 PHE 15 HE2 PHE 15 -20.233 50.661 -17.382 131 HZ PHE 15 HZ PHE 15 -18.480 49.031 -18.065 132 H GLY 16 H GLY 16 -20.499 48.461 -13.138 133 1HA GLY 16 1HA GLY 16 -19.174 47.087 -11.442 134 2HA GLY 16 2HA GLY 16 -19.312 45.812 -12.647 135 H GLU 17 H GLU 17 -16.947 45.862 -12.512 136 HA GLU 17 HA GLU 17 -14.889 46.355 -13.328 137 1HB GLU 17 1HB GLU 17 -16.773 47.039 -15.519 138 2HB GLU 17 2HB GLU 17 -15.113 47.589 -15.698 139 1HG GLU 17 1HG GLU 17 -15.215 45.511 -16.774 140 2HG GLU 17 2HG GLU 17 -14.411 45.210 -15.234 141 H ASN 18 H ASN 18 -14.735 47.900 -11.494 142 HA ASN 18 HA ASN 18 -15.080 50.691 -11.948 143 1HB ASN 18 1HB ASN 18 -15.063 49.951 -9.669 144 2HB ASN 18 2HB ASN 18 -13.501 49.160 -9.876 145 1HD2 ASN 18 1HD2 ASN 18 -11.888 50.215 -8.984 146 2HD2 ASN 18 2HD2 ASN 18 -11.752 51.941 -8.831 147 H ARG 19 H ARG 19 -12.202 48.626 -11.786 148 HA ARG 19 HA ARG 19 -10.884 50.472 -13.656 149 1HB ARG 19 1HB ARG 19 -10.136 50.405 -11.083 150 2HB ARG 19 2HB ARG 19 -9.201 49.038 -11.672 151 1HG ARG 19 1HG ARG 19 -7.654 50.535 -12.210 152 2HG ARG 19 2HG ARG 19 -8.710 50.962 -13.560 153 1HD ARG 19 1HD ARG 19 -9.194 52.218 -10.903 154 2HD ARG 19 2HD ARG 19 -7.835 52.786 -11.872 155 HE ARG 19 HE ARG 19 -10.672 53.093 -12.458 156 1HH1 ARG 19 1HH1 ARG 19 -7.348 53.520 -13.512 157 2HH1 ARG 19 2HH1 ARG 19 -7.779 54.544 -14.854 158 1HH2 ARG 19 1HH2 ARG 19 -11.232 54.411 -14.221 159 2HH2 ARG 19 2HH2 ARG 19 -9.986 55.059 -15.249 160 H ASP 20 H ASP 20 -10.423 49.443 -15.458 161 HA ASP 20 HA ASP 20 -10.327 46.534 -15.490 162 1HB ASP 20 1HB ASP 20 -11.640 47.708 -17.211 163 2HB ASP 20 2HB ASP 20 -10.184 48.526 -17.768 164 H LEU 21 H LEU 21 -8.327 46.692 -14.155 165 HA LEU 21 HA LEU 21 -5.979 46.518 -15.861 166 1HB LEU 21 1HB LEU 21 -6.413 48.642 -13.816 167 2HB LEU 21 2HB LEU 21 -4.817 47.928 -13.919 168 HG LEU 21 HG LEU 21 -5.638 48.596 -16.558 169 1HD1 LEU 21 1HD1 LEU 21 -6.471 50.681 -16.503 170 2HD1 LEU 21 2HD1 LEU 21 -5.555 51.125 -15.064 171 3HD1 LEU 21 3HD1 LEU 21 -7.043 50.196 -14.909 172 1HD2 LEU 21 1HD2 LEU 21 -3.606 49.739 -16.617 173 2HD2 LEU 21 2HD2 LEU 21 -3.341 48.454 -15.440 174 3HD2 LEU 21 3HD2 LEU 21 -3.654 50.101 -14.892 175 H GLU 22 H GLU 22 -7.637 44.702 -14.254 176 HA GLU 22 HA GLU 22 -5.946 44.042 -11.978 177 1HB GLU 22 1HB GLU 22 -8.564 42.944 -12.993 178 2HB GLU 22 2HB GLU 22 -7.677 42.199 -11.668 179 1HG GLU 22 1HG GLU 22 -8.381 45.102 -11.585 180 2HG GLU 22 2HG GLU 22 -9.564 43.874 -11.142 181 H ARG 23 H ARG 23 -5.058 41.911 -11.680 182 HA ARG 23 HA ARG 23 -4.724 40.303 -14.095 183 1HB ARG 23 1HB ARG 23 -2.823 42.167 -13.495 184 2HB ARG 23 2HB ARG 23 -2.206 40.764 -12.635 185 1HG ARG 23 1HG ARG 23 -1.193 40.673 -14.734 186 2HG ARG 23 2HG ARG 23 -2.503 39.493 -14.818 187 1HD ARG 23 1HD ARG 23 -3.602 41.949 -15.617 188 2HD ARG 23 2HD ARG 23 -2.044 41.826 -16.431 189 HE ARG 23 HE ARG 23 -3.936 39.576 -16.565 190 1HH1 ARG 23 1HH1 ARG 23 -2.153 42.151 -18.149 191 2HH1 ARG 23 2HH1 ARG 23 -2.522 41.584 -19.752 192 1HH2 ARG 23 1HH2 ARG 23 -4.404 38.820 -18.671 193 2HH2 ARG 23 2HH2 ARG 23 -3.787 39.681 -20.050 194 H VAL 24 H VAL 24 -5.860 38.669 -13.087 195 HA VAL 24 HA VAL 24 -4.886 37.612 -10.551 196 HB VAL 24 HB VAL 24 -7.053 36.417 -12.284 197 1HG1 VAL 24 1HG1 VAL 24 -5.927 35.846 -9.655 198 2HG1 VAL 24 2HG1 VAL 24 -6.907 34.831 -10.714 199 3HG1 VAL 24 3HG1 VAL 24 -7.684 35.998 -9.642 200 1HG2 VAL 24 1HG2 VAL 24 -7.082 38.910 -10.822 201 2HG2 VAL 24 2HG2 VAL 24 -8.283 37.782 -10.193 202 3HG2 VAL 24 3HG2 VAL 24 -8.296 38.222 -11.901 203 H VAL 25 H VAL 25 -2.789 37.033 -11.280 204 HA VAL 25 HA VAL 25 -2.534 35.052 -13.386 205 HB VAL 25 HB VAL 25 -0.306 36.000 -11.597 206 1HG1 VAL 25 1HG1 VAL 25 1.069 35.550 -13.574 207 2HG1 VAL 25 2HG1 VAL 25 -0.371 35.039 -14.455 208 3HG1 VAL 25 3HG1 VAL 25 0.180 34.116 -13.057 209 1HG2 VAL 25 1HG2 VAL 25 -1.865 37.759 -12.998 210 2HG2 VAL 25 2HG2 VAL 25 -0.573 37.404 -14.145 211 3HG2 VAL 25 3HG2 VAL 25 -0.183 38.026 -12.543 212 H THR 26 H THR 26 -3.679 33.322 -12.410 213 HA THR 26 HA THR 26 -2.844 32.261 -9.885 214 HB THR 26 HB THR 26 -4.313 30.288 -11.240 215 HG1 THR 26 HG1 THR 26 -4.989 31.622 -12.864 216 1HG2 THR 26 1HG2 THR 26 -6.125 30.979 -9.726 217 2HG2 THR 26 2HG2 THR 26 -5.240 32.459 -9.356 218 3HG2 THR 26 3HG2 THR 26 -4.573 30.893 -8.893 219 H ALA 27 H ALA 27 -1.323 30.798 -9.492 220 HA ALA 27 HA ALA 27 0.367 29.875 -11.620 221 1HB ALA 27 1HB ALA 27 0.395 29.793 -8.659 222 2HB ALA 27 2HB ALA 27 1.662 30.256 -9.792 223 3HB ALA 27 3HB ALA 27 1.317 28.554 -9.504 224 HA PRO 28 HA PRO 28 -1.541 25.937 -12.310 225 1HB PRO 28 1HB PRO 28 1.030 24.817 -13.089 226 2HB PRO 28 2HB PRO 28 -0.349 25.234 -14.107 227 1HG PRO 28 1HG PRO 28 2.000 26.594 -14.171 228 2HG PRO 28 2HG PRO 28 0.434 27.347 -14.527 229 1HD PRO 28 1HD PRO 28 2.049 27.432 -12.001 230 2HD PRO 28 2HD PRO 28 1.162 28.740 -12.816 231 H VAL 29 H VAL 29 -1.508 25.955 -9.786 232 HA VAL 29 HA VAL 29 0.456 24.220 -8.585 233 HB VAL 29 HB VAL 29 -2.040 25.216 -7.228 234 1HG1 VAL 29 1HG1 VAL 29 0.692 24.372 -6.288 235 2HG1 VAL 29 2HG1 VAL 29 -0.866 23.643 -5.904 236 3HG1 VAL 29 3HG1 VAL 29 -0.452 25.232 -5.259 237 1HG2 VAL 29 1HG2 VAL 29 0.396 26.816 -6.875 238 2HG2 VAL 29 2HG2 VAL 29 -1.285 27.325 -7.056 239 3HG2 VAL 29 3HG2 VAL 29 -0.328 26.919 -8.483 240 H SER 30 H SER 30 -0.067 22.356 -9.934 241 HA SER 30 HA SER 30 -2.552 20.996 -9.690 242 1HB SER 30 1HB SER 30 -0.237 19.286 -10.217 243 2HB SER 30 2HB SER 30 -1.646 19.609 -11.227 244 HG SER 30 HG SER 30 0.819 20.958 -11.100 245 H SER 31 H SER 31 -3.283 20.302 -7.782 246 HA SER 31 HA SER 31 -1.476 19.748 -5.622 247 1HB SER 31 1HB SER 31 -4.407 19.152 -5.494 248 2HB SER 31 2HB SER 31 -3.346 19.797 -4.244 249 HG SER 31 HG SER 31 -3.291 21.550 -6.191 250 H GLY 32 H GLY 32 -0.652 17.975 -7.297 251 1HA GLY 32 1HA GLY 32 -1.865 15.417 -6.436 252 2HA GLY 32 2HA GLY 32 -1.047 15.632 -7.979 253 H LYS 33 H LYS 33 -0.394 16.210 -4.537 254 HA LYS 33 HA LYS 33 2.420 15.716 -4.970 255 1HB LYS 33 1HB LYS 33 2.594 16.309 -2.531 256 2HB LYS 33 2HB LYS 33 1.913 17.561 -3.559 257 1HG LYS 33 1HG LYS 33 -0.276 17.157 -2.762 258 2HG LYS 33 2HG LYS 33 0.216 15.659 -1.967 259 1HD LYS 33 1HD LYS 33 0.248 17.020 -0.146 260 2HD LYS 33 2HD LYS 33 1.877 17.358 -0.735 261 1HE LYS 33 1HE LYS 33 1.354 19.502 -0.979 262 2HE LYS 33 2HE LYS 33 0.065 19.069 -2.100 263 1HZ LYS 33 1HZ LYS 33 -0.114 19.412 0.838 264 2HZ LYS 33 2HZ LYS 33 -1.327 18.641 -0.062 265 3HZ LYS 33 3HZ LYS 33 -0.949 20.262 -0.369 266 H ILE 34 H ILE 34 0.027 13.624 -4.703 267 HA ILE 34 HA ILE 34 1.584 11.776 -3.015 268 HB ILE 34 HB ILE 34 -1.355 12.210 -3.242 269 1HG1 ILE 34 1HG1 ILE 34 -0.671 11.031 -0.805 270 2HG1 ILE 34 2HG1 ILE 34 0.715 12.040 -1.211 271 1HG2 ILE 34 1HG2 ILE 34 -1.001 9.634 -2.103 272 2HG2 ILE 34 2HG2 ILE 34 -0.257 9.632 -3.704 273 3HG2 ILE 34 3HG2 ILE 34 -1.949 10.092 -3.520 274 1HD1 ILE 34 1HD1 ILE 34 -0.741 13.355 0.098 275 2HD1 ILE 34 2HD1 ILE 34 -2.143 12.887 -0.864 276 3HD1 ILE 34 3HD1 ILE 34 -0.904 13.928 -1.562 277 H LYS 35 H LYS 35 2.323 10.010 -3.936 278 HA LYS 35 HA LYS 35 1.514 9.446 -6.715 279 1HB LYS 35 1HB LYS 35 4.250 8.764 -5.709 280 2HB LYS 35 2HB LYS 35 3.736 9.239 -7.326 281 1HG LYS 35 1HG LYS 35 3.388 11.345 -5.337 282 2HG LYS 35 2HG LYS 35 5.062 10.818 -5.520 283 1HD LYS 35 1HD LYS 35 4.773 12.579 -7.060 284 2HD LYS 35 2HD LYS 35 4.733 11.099 -8.014 285 1HE LYS 35 1HE LYS 35 2.570 11.374 -8.593 286 2HE LYS 35 2HE LYS 35 2.125 12.040 -7.022 287 1HZ LYS 35 1HZ LYS 35 2.158 14.049 -7.917 288 2HZ LYS 35 2HZ LYS 35 2.616 13.411 -9.419 289 3HZ LYS 35 3HZ LYS 35 3.802 13.879 -8.301 290 H ARG 36 H ARG 36 1.401 7.258 -7.365 291 HA ARG 36 HA ARG 36 1.314 5.359 -5.103 292 1HB ARG 36 1HB ARG 36 -0.317 5.273 -7.645 293 2HB ARG 36 2HB ARG 36 -0.460 4.179 -6.280 294 1HG ARG 36 1HG ARG 36 -1.788 5.578 -5.165 295 2HG ARG 36 2HG ARG 36 -0.758 6.967 -5.516 296 1HD ARG 36 1HD ARG 36 -2.819 5.755 -7.353 297 2HD ARG 36 2HD ARG 36 -2.964 7.279 -6.479 298 HE ARG 36 HE ARG 36 -1.411 6.760 -8.886 299 1HH1 ARG 36 1HH1 ARG 36 -2.148 8.966 -6.257 300 2HH1 ARG 36 2HH1 ARG 36 -1.479 10.353 -7.068 301 1HH2 ARG 36 1HH2 ARG 36 -0.558 8.600 -9.961 302 2HH2 ARG 36 2HH2 ARG 36 -0.570 10.146 -9.163 303 H VAL 37 H VAL 37 2.963 4.011 -5.158 304 HA VAL 37 HA VAL 37 3.926 3.055 -7.780 305 HB VAL 37 HB VAL 37 5.516 3.455 -5.235 306 1HG1 VAL 37 1HG1 VAL 37 6.774 2.787 -7.851 307 2HG1 VAL 37 2HG1 VAL 37 6.061 1.487 -6.894 308 3HG1 VAL 37 3HG1 VAL 37 7.347 2.482 -6.211 309 1HG2 VAL 37 1HG2 VAL 37 6.152 4.811 -7.806 310 2HG2 VAL 37 2HG2 VAL 37 6.423 5.347 -6.149 311 3HG2 VAL 37 3HG2 VAL 37 4.805 5.421 -6.845 312 H ASN 38 H ASN 38 3.553 0.976 -8.137 313 HA ASN 38 HA ASN 38 3.246 -0.818 -5.812 314 1HB ASN 38 1HB ASN 38 1.172 -1.072 -6.699 315 2HB ASN 38 2HB ASN 38 1.662 -0.458 -8.273 316 1HD2 ASN 38 1HD2 ASN 38 1.105 -3.241 -6.339 317 2HD2 ASN 38 2HD2 ASN 38 1.386 -4.421 -7.574 318 H VAL 39 H VAL 39 4.657 -2.448 -5.636 319 HA VAL 39 HA VAL 39 6.178 -3.268 -8.023 320 HB VAL 39 HB VAL 39 7.635 -3.149 -5.424 321 1HG1 VAL 39 1HG1 VAL 39 8.253 -3.303 -8.289 322 2HG1 VAL 39 2HG1 VAL 39 9.124 -3.945 -6.900 323 3HG1 VAL 39 3HG1 VAL 39 9.319 -2.256 -7.354 324 1HG2 VAL 39 1HG2 VAL 39 6.506 -0.808 -6.680 325 2HG2 VAL 39 2HG2 VAL 39 8.267 -0.739 -6.666 326 3HG2 VAL 39 3HG2 VAL 39 7.381 -0.960 -5.157 327 H ASN 40 H ASN 40 7.284 -5.358 -7.756 328 HA ASN 40 HA ASN 40 5.704 -7.166 -6.061 329 1HB ASN 40 1HB ASN 40 6.822 -7.374 -8.772 330 2HB ASN 40 2HB ASN 40 7.113 -8.790 -7.774 331 1HD2 ASN 40 1HD2 ASN 40 4.882 -7.092 -9.658 332 2HD2 ASN 40 2HD2 ASN 40 3.505 -8.113 -9.373 333 H PHE 41 H PHE 41 6.634 -8.341 -4.523 334 HA PHE 41 HA PHE 41 9.578 -8.382 -4.365 335 1HB PHE 41 1HB PHE 41 7.685 -8.528 -2.012 336 2HB PHE 41 2HB PHE 41 9.440 -8.384 -1.964 337 HD1 PHE 41 HD1 PHE 41 10.254 -6.257 -3.501 338 HD2 PHE 41 HD2 PHE 41 6.569 -6.635 -1.408 339 HE1 PHE 41 HE1 PHE 41 10.052 -3.806 -3.426 340 HE2 PHE 41 HE2 PHE 41 6.361 -4.185 -1.321 341 HZ PHE 41 HZ PHE 41 8.106 -2.767 -2.325 342 H ASP 42 H ASP 42 10.519 -10.376 -3.885 343 HA ASP 42 HA ASP 42 8.981 -12.643 -4.629 344 1HB ASP 42 1HB ASP 42 11.015 -13.950 -4.180 345 2HB ASP 42 2HB ASP 42 11.339 -12.546 -5.183 346 H GLU 43 H GLU 43 9.003 -14.664 -3.331 347 HA GLU 43 HA GLU 43 7.367 -14.379 -1.147 348 1HB GLU 43 1HB GLU 43 8.795 -16.581 -2.434 349 2HB GLU 43 2HB GLU 43 8.495 -16.852 -0.723 350 1HG GLU 43 1HG GLU 43 6.420 -16.181 -2.795 351 2HG GLU 43 2HG GLU 43 6.711 -17.772 -2.092 352 H GLU 44 H GLU 44 10.875 -14.827 -1.150 353 HA GLU 44 HA GLU 44 11.254 -15.204 1.607 354 1HB GLU 44 1HB GLU 44 12.909 -15.221 -0.494 355 2HB GLU 44 2HB GLU 44 13.223 -13.584 0.079 356 1HG GLU 44 1HG GLU 44 14.729 -15.484 0.899 357 2HG GLU 44 2HG GLU 44 14.127 -14.323 2.078 358 H LYS 45 H LYS 45 11.506 -12.256 -0.344 359 HA LYS 45 HA LYS 45 11.922 -10.466 1.770 360 1HB LYS 45 1HB LYS 45 10.588 -9.923 -0.889 361 2HB LYS 45 2HB LYS 45 11.262 -8.710 0.196 362 1HG LYS 45 1HG LYS 45 13.413 -10.284 -0.128 363 2HG LYS 45 2HG LYS 45 12.610 -10.535 -1.679 364 1HD LYS 45 1HD LYS 45 13.278 -8.545 -2.396 365 2HD LYS 45 2HD LYS 45 12.554 -7.754 -0.992 366 1HE LYS 45 1HE LYS 45 14.632 -7.242 -0.379 367 2HE LYS 45 2HE LYS 45 14.809 -8.941 0.043 368 1HZ LYS 45 1HZ LYS 45 16.602 -8.148 -1.402 369 2HZ LYS 45 2HZ LYS 45 15.464 -7.782 -2.610 370 3HZ LYS 45 3HZ LYS 45 15.701 -9.389 -2.131 371 H HIS 46 H HIS 46 8.960 -11.638 0.273 372 HA HIS 46 HA HIS 46 7.321 -9.758 1.660 373 1HB HIS 46 1HB HIS 46 6.798 -10.982 -0.546 374 2HB HIS 46 2HB HIS 46 6.238 -12.293 0.491 375 HD1 HIS 46 HD1 HIS 46 3.902 -12.124 1.323 376 HD2 HIS 46 HD2 HIS 46 5.364 -8.467 -0.024 377 HE1 HIS 46 HE1 HIS 46 1.993 -10.496 1.558 378 HE2 HIS 46 HE2 HIS 46 2.832 -8.352 0.534 379 H THR 47 H THR 47 8.266 -13.089 2.291 380 HA THR 47 HA THR 47 6.429 -13.528 4.408 381 HB THR 47 HB THR 47 9.141 -14.821 4.017 382 HG1 THR 47 HG1 THR 47 7.957 -15.239 2.188 383 1HG2 THR 47 1HG2 THR 47 7.082 -15.124 6.015 384 2HG2 THR 47 2HG2 THR 47 8.673 -15.882 5.924 385 3HG2 THR 47 3HG2 THR 47 7.295 -16.625 5.110 386 H ARG 48 H ARG 48 9.763 -12.320 4.294 387 HA ARG 48 HA ARG 48 9.968 -11.928 7.116 388 1HB ARG 48 1HB ARG 48 11.741 -11.885 4.996 389 2HB ARG 48 2HB ARG 48 11.655 -10.197 5.478 390 1HG ARG 48 1HG ARG 48 11.855 -11.634 7.861 391 2HG ARG 48 2HG ARG 48 13.002 -12.394 6.750 392 1HD ARG 48 1HD ARG 48 12.948 -9.437 6.829 393 2HD ARG 48 2HD ARG 48 13.610 -10.260 8.241 394 HE ARG 48 HE ARG 48 14.626 -10.648 5.489 395 1HH1 ARG 48 1HH1 ARG 48 15.120 -10.533 8.960 396 2HH1 ARG 48 2HH1 ARG 48 16.860 -10.519 8.843 397 1HH2 ARG 48 1HH2 ARG 48 16.912 -10.656 5.325 398 2HH2 ARG 48 2HH2 ARG 48 17.880 -10.616 6.776 399 H PHE 49 H PHE 49 8.810 -10.064 4.416 400 HA PHE 49 HA PHE 49 8.703 -7.501 5.526 401 1HB PHE 49 1HB PHE 49 7.699 -8.823 3.223 402 2HB PHE 49 2HB PHE 49 6.341 -7.999 3.978 403 HD1 PHE 49 HD1 PHE 49 9.752 -6.730 4.237 404 HD2 PHE 49 HD2 PHE 49 6.059 -6.456 2.144 405 HE1 PHE 49 HE1 PHE 49 10.489 -4.613 3.231 406 HE2 PHE 49 HE2 PHE 49 6.792 -4.338 1.129 407 HZ PHE 49 HZ PHE 49 8.960 -3.431 1.608 408 H LYS 50 H LYS 50 6.168 -9.986 5.400 409 HA LYS 50 HA LYS 50 4.323 -8.661 7.042 410 1HB LYS 50 1HB LYS 50 4.678 -11.617 6.506 411 2HB LYS 50 2HB LYS 50 3.277 -10.908 7.300 412 1HG LYS 50 1HG LYS 50 2.472 -9.988 5.367 413 2HG LYS 50 2HG LYS 50 4.068 -9.881 4.622 414 1HD LYS 50 1HD LYS 50 3.314 -11.649 3.434 415 2HD LYS 50 2HD LYS 50 3.854 -12.547 4.856 416 1HE LYS 50 1HE LYS 50 1.478 -12.153 5.753 417 2HE LYS 50 2HE LYS 50 1.069 -11.731 4.090 418 1HZ LYS 50 1HZ LYS 50 2.467 -14.257 4.673 419 2HZ LYS 50 2HZ LYS 50 1.474 -13.861 3.358 420 3HZ LYS 50 3HZ LYS 50 0.787 -14.154 4.881 421 H ALA 51 H ALA 51 6.953 -10.869 7.783 422 HA ALA 51 HA ALA 51 6.353 -11.323 10.496 423 1HB ALA 51 1HB ALA 51 7.902 -12.797 9.609 424 2HB ALA 51 2HB ALA 51 8.907 -11.746 10.604 425 3HB ALA 51 3HB ALA 51 8.848 -11.515 8.856 426 H ALA 52 H ALA 52 8.617 -9.025 8.979 427 HA ALA 52 HA ALA 52 9.365 -7.709 11.345 428 1HB ALA 52 1HB ALA 52 9.498 -5.829 9.266 429 2HB ALA 52 2HB ALA 52 9.821 -7.400 8.538 430 3HB ALA 52 3HB ALA 52 10.795 -6.841 9.896 431 H CYS 53 H CYS 53 6.629 -7.237 9.185 432 HA CYS 53 HA CYS 53 5.710 -4.777 10.191 433 1HB CYS 53 1HB CYS 53 4.201 -7.096 8.974 434 2HB CYS 53 2HB CYS 53 3.469 -5.539 9.345 435 HG CYS 53 HG CYS 53 5.941 -6.136 7.056 436 H ALA 54 H ALA 54 5.207 -8.107 11.261 437 HA ALA 54 HA ALA 54 3.359 -7.379 13.336 438 1HB ALA 54 1HB ALA 54 3.602 -9.690 14.085 439 2HB ALA 54 2HB ALA 54 4.944 -9.917 12.965 440 3HB ALA 54 3HB ALA 54 3.320 -9.612 12.346 441 H ARG 55 H ARG 55 6.813 -7.906 13.077 442 HA ARG 55 HA ARG 55 7.427 -8.045 15.808 443 1HB ARG 55 1HB ARG 55 8.888 -7.760 13.295 444 2HB ARG 55 2HB ARG 55 9.675 -6.938 14.637 445 1HG ARG 55 1HG ARG 55 9.514 -9.075 15.928 446 2HG ARG 55 2HG ARG 55 8.949 -9.851 14.448 447 1HD ARG 55 1HD ARG 55 11.133 -10.263 14.110 448 2HD ARG 55 2HD ARG 55 11.172 -8.592 13.549 449 HE ARG 55 HE ARG 55 11.570 -8.777 16.369 450 1HH1 ARG 55 1HH1 ARG 55 13.205 -9.263 13.313 451 2HH1 ARG 55 2HH1 ARG 55 14.770 -8.808 13.932 452 1HH2 ARG 55 1HH2 ARG 55 13.612 -8.181 17.192 453 2HH2 ARG 55 2HH2 ARG 55 15.009 -8.224 16.155 454 H LYS 56 H LYS 56 7.335 -5.257 13.609 455 HA LYS 56 HA LYS 56 8.005 -3.515 15.866 456 1HB LYS 56 1HB LYS 56 7.680 -2.478 13.087 457 2HB LYS 56 2HB LYS 56 8.788 -1.962 14.351 458 1HG LYS 56 1HG LYS 56 10.139 -3.957 14.000 459 2HG LYS 56 2HG LYS 56 9.012 -4.508 12.759 460 1HD LYS 56 1HD LYS 56 10.247 -3.403 11.272 461 2HD LYS 56 2HD LYS 56 9.687 -1.906 12.020 462 1HE LYS 56 1HE LYS 56 11.896 -3.258 13.410 463 2HE LYS 56 2HE LYS 56 12.287 -2.635 11.807 464 1HZ LYS 56 1HZ LYS 56 12.077 -1.216 14.202 465 2HZ LYS 56 2HZ LYS 56 10.824 -0.686 13.191 466 3HZ LYS 56 3HZ LYS 56 12.426 -0.617 12.656 467 H GLY 57 H GLY 57 5.251 -4.693 14.593 468 1HA GLY 57 1HA GLY 57 3.041 -4.057 14.762 469 2HA GLY 57 2HA GLY 57 3.572 -2.709 15.762 470 H THR 58 H THR 58 4.514 -3.491 12.486 471 HA THR 58 HA THR 58 3.786 -0.783 11.675 472 HB THR 58 HB THR 58 5.257 -2.060 9.650 473 HG1 THR 58 HG1 THR 58 6.864 -3.130 10.685 474 1HG2 THR 58 1HG2 THR 58 7.138 -0.599 10.639 475 2HG2 THR 58 2HG2 THR 58 5.909 -0.055 11.781 476 3HG2 THR 58 3HG2 THR 58 5.680 0.198 10.049 477 H SER 59 H SER 59 2.688 -0.361 9.765 478 HA SER 59 HA SER 59 0.954 -2.467 8.743 479 1HB SER 59 1HB SER 59 0.999 0.190 7.436 480 2HB SER 59 2HB SER 59 -0.376 -0.781 7.962 481 HG SER 59 HG SER 59 0.462 -0.177 10.188 482 H ILE 60 H ILE 60 1.179 -3.398 6.734 483 HA ILE 60 HA ILE 60 3.725 -3.679 5.730 484 HB ILE 60 HB ILE 60 2.084 -5.362 5.268 485 1HG1 ILE 60 1HG1 ILE 60 2.317 -4.893 2.488 486 2HG1 ILE 60 2HG1 ILE 60 3.753 -4.206 3.241 487 1HG2 ILE 60 1HG2 ILE 60 0.415 -3.229 4.566 488 2HG2 ILE 60 2HG2 ILE 60 0.020 -4.946 4.588 489 3HG2 ILE 60 3HG2 ILE 60 0.612 -4.197 3.107 490 1HD1 ILE 60 1HD1 ILE 60 4.199 -6.348 4.329 491 2HD1 ILE 60 2HD1 ILE 60 4.139 -6.499 2.572 492 3HD1 ILE 60 3HD1 ILE 60 2.770 -7.033 3.550 493 H THR 61 H THR 61 1.189 -1.491 4.570 494 HA THR 61 HA THR 61 2.615 -0.541 2.306 495 HB THR 61 HB THR 61 0.597 1.043 3.897 496 HG1 THR 61 HG1 THR 61 -0.429 -0.876 3.508 497 1HG2 THR 61 1HG2 THR 61 0.911 1.014 0.913 498 2HG2 THR 61 2HG2 THR 61 1.960 2.019 1.913 499 3HG2 THR 61 3HG2 THR 61 0.213 2.260 1.948 500 H ASP 62 H ASP 62 2.331 0.610 5.641 501 HA ASP 62 HA ASP 62 3.957 2.904 5.347 502 1HB ASP 62 1HB ASP 62 2.444 2.704 7.222 503 2HB ASP 62 2HB ASP 62 3.263 1.251 7.782 504 H VAL 63 H VAL 63 4.642 -0.453 5.999 505 HA VAL 63 HA VAL 63 7.298 -0.229 6.873 506 HB VAL 63 HB VAL 63 5.542 -2.371 5.955 507 1HG1 VAL 63 1HG1 VAL 63 8.497 -2.798 5.523 508 2HG1 VAL 63 2HG1 VAL 63 7.321 -2.575 4.225 509 3HG1 VAL 63 3HG1 VAL 63 7.202 -3.974 5.294 510 1HG2 VAL 63 1HG2 VAL 63 6.860 -1.652 8.243 511 2HG2 VAL 63 2HG2 VAL 63 7.784 -3.044 7.681 512 3HG2 VAL 63 3HG2 VAL 63 6.050 -3.193 7.958 513 H VAL 64 H VAL 64 5.961 -0.662 3.595 514 HA VAL 64 HA VAL 64 8.464 -0.683 2.279 515 HB VAL 64 HB VAL 64 6.033 0.457 0.944 516 1HG1 VAL 64 1HG1 VAL 64 7.796 -1.621 -0.238 517 2HG1 VAL 64 2HG1 VAL 64 8.460 -0.002 -0.023 518 3HG1 VAL 64 3HG1 VAL 64 7.009 -0.239 -0.997 519 1HG2 VAL 64 1HG2 VAL 64 6.439 -2.399 1.783 520 2HG2 VAL 64 2HG2 VAL 64 5.431 -1.962 0.402 521 3HG2 VAL 64 3HG2 VAL 64 5.022 -1.376 2.016 522 H ASN 65 H ASN 65 6.223 1.910 3.133 523 HA ASN 65 HA ASN 65 7.565 3.998 1.826 524 1HB ASN 65 1HB ASN 65 5.326 3.762 3.485 525 2HB ASN 65 2HB ASN 65 6.410 4.869 4.329 526 1HD2 ASN 65 1HD2 ASN 65 3.825 5.182 2.807 527 2HD2 ASN 65 2HD2 ASN 65 4.152 6.465 1.682 528 H GLN 66 H GLN 66 8.022 2.535 4.992 529 HA GLN 66 HA GLN 66 9.853 4.390 6.031 530 1HB GLN 66 1HB GLN 66 8.610 2.424 7.187 531 2HB GLN 66 2HB GLN 66 9.985 1.459 6.674 532 1HG GLN 66 1HG GLN 66 11.428 3.205 7.833 533 2HG GLN 66 2HG GLN 66 9.934 3.776 8.574 534 1HE2 GLN 66 1HE2 GLN 66 8.769 2.317 9.942 535 2HE2 GLN 66 2HE2 GLN 66 9.606 1.036 10.754 536 H LEU 67 H LEU 67 10.423 1.340 4.250 537 HA LEU 67 HA LEU 67 13.248 1.606 4.350 538 1HB LEU 67 1HB LEU 67 13.078 -0.019 2.299 539 2HB LEU 67 2HB LEU 67 12.738 -0.564 3.929 540 HG LEU 67 HG LEU 67 10.272 0.279 2.994 541 1HD1 LEU 67 1HD1 LEU 67 11.548 0.274 0.732 542 2HD1 LEU 67 2HD1 LEU 67 9.958 -0.481 0.838 543 3HD1 LEU 67 3HD1 LEU 67 11.410 -1.479 0.864 544 1HD2 LEU 67 1HD2 LEU 67 10.425 -1.624 4.341 545 2HD2 LEU 67 2HD2 LEU 67 11.607 -2.391 3.281 546 3HD2 LEU 67 3HD2 LEU 67 9.926 -2.249 2.770 547 H VAL 68 H VAL 68 10.816 2.649 2.014 548 HA VAL 68 HA VAL 68 12.648 3.461 -0.003 549 HB VAL 68 HB VAL 68 9.938 4.693 0.543 550 1HG1 VAL 68 1HG1 VAL 68 10.859 6.116 -0.987 551 2HG1 VAL 68 2HG1 VAL 68 10.237 4.888 -2.091 552 3HG1 VAL 68 3HG1 VAL 68 11.943 4.887 -1.641 553 1HG2 VAL 68 1HG2 VAL 68 9.666 3.010 -1.619 554 2HG2 VAL 68 2HG2 VAL 68 9.098 2.692 0.022 555 3HG2 VAL 68 3HG2 VAL 68 10.668 2.079 -0.504 556 H ASP 69 H ASP 69 11.083 5.167 2.678 557 HA ASP 69 HA ASP 69 12.149 7.721 2.243 558 1HB ASP 69 1HB ASP 69 10.442 6.662 4.056 559 2HB ASP 69 2HB ASP 69 11.881 6.832 5.055 560 H ASN 70 H ASN 70 13.381 4.983 4.093 561 HA ASN 70 HA ASN 70 15.711 6.217 5.092 562 1HB ASN 70 1HB ASN 70 15.039 4.211 6.138 563 2HB ASN 70 2HB ASN 70 14.911 3.352 4.610 564 1HD2 ASN 70 1HD2 ASN 70 16.335 1.772 4.673 565 2HD2 ASN 70 2HD2 ASN 70 18.003 1.912 5.125 566 H TRP 71 H TRP 71 15.342 3.981 2.327 567 HA TRP 71 HA TRP 71 17.956 4.122 1.380 568 1HB TRP 71 1HB TRP 71 16.221 2.504 0.625 569 2HB TRP 71 2HB TRP 71 15.444 3.800 -0.272 570 HD1 TRP 71 HD1 TRP 71 18.449 1.471 -0.366 571 HE1 TRP 71 HE1 TRP 71 19.545 1.591 -2.692 572 HE3 TRP 71 HE3 TRP 71 15.763 5.372 -2.344 573 HZ2 TRP 71 HZ2 TRP 71 19.292 3.095 -5.054 574 HZ3 TRP 71 HZ3 TRP 71 16.249 6.056 -4.671 575 HH2 TRP 71 HH2 TRP 71 17.980 4.948 -5.990 576 H LEU 72 H LEU 72 15.128 5.924 0.254 577 HA LEU 72 HA LEU 72 16.322 7.365 -1.749 578 1HB LEU 72 1HB LEU 72 13.827 7.204 -0.722 579 2HB LEU 72 2HB LEU 72 14.281 8.808 -0.180 580 HG LEU 72 HG LEU 72 14.997 8.750 -2.878 581 1HD1 LEU 72 1HD1 LEU 72 12.960 8.049 -4.010 582 2HD1 LEU 72 2HD1 LEU 72 12.280 7.510 -2.471 583 3HD1 LEU 72 3HD1 LEU 72 13.695 6.699 -3.143 584 1HD2 LEU 72 1HD2 LEU 72 13.699 10.607 -2.960 585 2HD2 LEU 72 2HD2 LEU 72 13.742 10.423 -1.206 586 3HD2 LEU 72 3HD2 LEU 72 12.352 9.836 -2.123 587 H LYS 73 H LYS 73 15.677 8.571 1.533 588 HA LYS 73 HA LYS 73 17.102 10.965 0.941 589 1HB LYS 73 1HB LYS 73 15.926 10.034 3.552 590 2HB LYS 73 2HB LYS 73 16.393 11.683 3.142 591 1HG LYS 73 1HG LYS 73 14.582 12.015 1.805 592 2HG LYS 73 2HG LYS 73 14.493 10.311 1.328 593 1HD LYS 73 1HD LYS 73 12.584 10.772 2.674 594 2HD LYS 73 2HD LYS 73 13.695 9.814 3.657 595 1HE LYS 73 1HE LYS 73 14.517 12.280 4.319 596 2HE LYS 73 2HE LYS 73 12.826 12.622 3.951 597 1HZ LYS 73 1HZ LYS 73 13.963 10.913 6.057 598 2HZ LYS 73 2HZ LYS 73 12.415 10.564 5.454 599 3HZ LYS 73 3HZ LYS 73 12.730 12.075 6.163 600 H GLU 74 H GLU 74 18.181 7.969 2.018 601 HA GLU 74 HA GLU 74 20.400 9.072 3.548 602 1HB GLU 74 1HB GLU 74 19.273 6.413 3.101 603 2HB GLU 74 2HB GLU 74 21.031 6.432 3.023 604 1HG GLU 74 1HG GLU 74 19.273 7.266 5.310 605 2HG GLU 74 2HG GLU 74 20.438 5.945 5.261 606 H ASN 75 H ASN 75 19.673 8.151 0.291 607 HA ASN 75 HA ASN 75 22.529 8.354 -0.382 608 1HB ASN 75 1HB ASN 75 22.345 6.631 -1.838 609 2HB ASN 75 2HB ASN 75 20.966 6.217 -0.830 610 1HD2 ASN 75 1HD2 ASN 75 18.926 6.404 -1.627 611 2HD2 ASN 75 2HD2 ASN 75 18.594 6.720 -3.297 612 H GLU 76 H GLU 76 19.459 9.814 -0.930 613 HA GLU 76 HA GLU 76 20.388 11.192 -3.330 614 1HB GLU 76 1HB GLU 76 17.786 10.785 -2.015 615 2HB GLU 76 2HB GLU 76 18.023 12.404 -2.656 616 1HG GLU 76 1HG GLU 76 18.526 9.963 -4.321 617 2HG GLU 76 2HG GLU 76 16.918 10.667 -4.161 618 1H MET 1 1H MET 1 -7.408 -57.266 -51.338 619 2H MET 1 2H MET 1 -7.253 -57.506 -49.670 620 3H MET 1 3H MET 1 -6.025 -58.027 -50.714 621 HA MET 1 HA MET 1 -5.185 -56.088 -49.803 622 1HB MET 1 1HB MET 1 -5.285 -56.328 -52.373 623 2HB MET 1 2HB MET 1 -6.503 -55.061 -52.305 624 1HG MET 1 1HG MET 1 -4.906 -53.568 -51.233 625 2HG MET 1 2HG MET 1 -3.686 -54.838 -51.268 626 1HE MET 1 1HE MET 1 -3.359 -51.818 -52.511 627 2HE MET 1 2HE MET 1 -5.076 -51.824 -52.904 628 3HE MET 1 3HE MET 1 -3.881 -51.655 -54.188 629 H SER 2 H SER 2 -8.577 -55.654 -50.737 630 HA SER 2 HA SER 2 -8.886 -53.042 -49.744 631 1HB SER 2 1HB SER 2 -11.176 -54.949 -49.618 632 2HB SER 2 2HB SER 2 -11.122 -53.299 -50.237 633 HG SER 2 HG SER 2 -9.819 -54.185 -52.001 634 H LEU 3 H LEU 3 -9.219 -56.194 -48.207 635 HA LEU 3 HA LEU 3 -9.703 -54.883 -45.622 636 1HB LEU 3 1HB LEU 3 -10.495 -57.421 -46.791 637 2HB LEU 3 2HB LEU 3 -9.712 -57.646 -45.239 638 HG LEU 3 HG LEU 3 -11.824 -55.570 -45.370 639 1HD1 LEU 3 1HD1 LEU 3 -13.135 -57.064 -46.503 640 2HD1 LEU 3 2HD1 LEU 3 -13.423 -57.586 -44.844 641 3HD1 LEU 3 3HD1 LEU 3 -12.285 -58.468 -45.860 642 1HD2 LEU 3 1HD2 LEU 3 -12.224 -57.256 -43.221 643 2HD2 LEU 3 2HD2 LEU 3 -11.350 -55.725 -43.194 644 3HD2 LEU 3 3HD2 LEU 3 -10.474 -57.238 -43.415 645 H GLU 4 H GLU 4 -7.589 -54.103 -45.370 646 HA GLU 4 HA GLU 4 -5.356 -55.918 -45.495 647 1HB GLU 4 1HB GLU 4 -5.759 -53.037 -45.181 648 2HB GLU 4 2HB GLU 4 -4.451 -53.665 -44.187 649 1HG GLU 4 1HG GLU 4 -4.599 -54.398 -47.074 650 2HG GLU 4 2HG GLU 4 -3.978 -52.819 -46.594 651 H LYS 5 H LYS 5 -5.589 -57.492 -43.999 652 HA LYS 5 HA LYS 5 -5.410 -58.548 -42.002 653 1HB LYS 5 1HB LYS 5 -4.306 -55.876 -41.385 654 2HB LYS 5 2HB LYS 5 -4.877 -56.795 -39.998 655 1HG LYS 5 1HG LYS 5 -3.143 -58.187 -40.070 656 2HG LYS 5 2HG LYS 5 -3.244 -58.373 -41.823 657 1HD LYS 5 1HD LYS 5 -2.158 -56.147 -42.053 658 2HD LYS 5 2HD LYS 5 -1.938 -56.120 -40.302 659 1HE LYS 5 1HE LYS 5 0.072 -56.998 -40.878 660 2HE LYS 5 2HE LYS 5 -0.854 -58.497 -40.805 661 1HZ LYS 5 1HZ LYS 5 -0.008 -56.972 -43.189 662 2HZ LYS 5 2HZ LYS 5 -1.281 -58.085 -43.268 663 3HZ LYS 5 3HZ LYS 5 0.269 -58.605 -42.821 664 H ALA 6 H ALA 6 -7.540 -59.153 -41.861 665 HA ALA 6 HA ALA 6 -9.578 -57.399 -40.845 666 1HB ALA 6 1HB ALA 6 -9.424 -60.239 -41.691 667 2HB ALA 6 2HB ALA 6 -10.572 -58.979 -42.148 668 3HB ALA 6 3HB ALA 6 -10.721 -59.785 -40.586 669 H HIS 7 H HIS 7 -9.085 -56.665 -38.848 670 HA HIS 7 HA HIS 7 -8.389 -58.644 -36.785 671 1HB HIS 7 1HB HIS 7 -6.800 -56.738 -37.253 672 2HB HIS 7 2HB HIS 7 -8.037 -55.646 -36.639 673 HD1 HIS 7 HD1 HIS 7 -8.363 -55.520 -34.112 674 HD2 HIS 7 HD2 HIS 7 -5.564 -58.371 -35.284 675 HE1 HIS 7 HE1 HIS 7 -7.178 -56.222 -32.003 676 HE2 HIS 7 HE2 HIS 7 -5.452 -57.905 -32.737 677 H THR 8 H THR 8 -9.782 -59.097 -35.257 678 HA THR 8 HA THR 8 -12.009 -57.228 -34.752 679 HB THR 8 HB THR 8 -12.276 -60.033 -33.840 680 HG1 THR 8 HG1 THR 8 -12.075 -60.914 -35.748 681 1HG2 THR 8 1HG2 THR 8 -14.426 -59.453 -33.751 682 2HG2 THR 8 2HG2 THR 8 -14.426 -58.990 -35.454 683 3HG2 THR 8 3HG2 THR 8 -13.947 -57.823 -34.222 684 H SER 9 H SER 9 -12.612 -56.976 -32.506 685 HA SER 9 HA SER 9 -10.321 -57.125 -30.759 686 1HB SER 9 1HB SER 9 -13.090 -56.233 -29.969 687 2HB SER 9 2HB SER 9 -11.543 -55.745 -29.275 688 HG SER 9 HG SER 9 -11.111 -54.522 -31.054 689 H VAL 10 H VAL 10 -10.427 -59.549 -31.071 690 HA VAL 10 HA VAL 10 -12.408 -61.036 -29.646 691 HB VAL 10 HB VAL 10 -10.856 -62.964 -29.956 692 1HG1 VAL 10 1HG1 VAL 10 -12.228 -63.017 -31.736 693 2HG1 VAL 10 2HG1 VAL 10 -10.793 -62.504 -32.625 694 3HG1 VAL 10 3HG1 VAL 10 -11.982 -61.309 -32.105 695 1HG2 VAL 10 1HG2 VAL 10 -9.125 -61.134 -31.587 696 2HG2 VAL 10 2HG2 VAL 10 -8.796 -62.782 -31.052 697 3HG2 VAL 10 3HG2 VAL 10 -8.788 -61.460 -29.887 698 H LYS 11 H LYS 11 -11.837 -62.511 -27.854 699 HA LYS 11 HA LYS 11 -11.224 -62.876 -25.709 700 1HB LYS 11 1HB LYS 11 -8.876 -62.645 -26.889 701 2HB LYS 11 2HB LYS 11 -8.789 -61.159 -25.953 702 1HG LYS 11 1HG LYS 11 -8.779 -62.285 -23.927 703 2HG LYS 11 2HG LYS 11 -9.477 -63.747 -24.629 704 1HD LYS 11 1HD LYS 11 -7.466 -64.432 -25.537 705 2HD LYS 11 2HD LYS 11 -6.796 -62.798 -25.548 706 1HE LYS 11 1HE LYS 11 -7.379 -63.488 -22.861 707 2HE LYS 11 2HE LYS 11 -6.503 -64.835 -23.583 708 1HZ LYS 11 1HZ LYS 11 -5.449 -62.180 -24.132 709 2HZ LYS 11 2HZ LYS 11 -4.630 -63.623 -23.788 710 3HZ LYS 11 3HZ LYS 11 -5.309 -62.717 -22.529 711 H LYS 12 H LYS 12 -9.589 -59.786 -25.751 712 HA LYS 12 HA LYS 12 -11.710 -58.163 -25.033 713 1HB LYS 12 1HB LYS 12 -10.801 -59.738 -22.859 714 2HB LYS 12 2HB LYS 12 -10.225 -58.102 -22.576 715 1HG LYS 12 1HG LYS 12 -13.039 -58.298 -23.402 716 2HG LYS 12 2HG LYS 12 -12.654 -59.022 -21.840 717 1HD LYS 12 1HD LYS 12 -11.350 -56.474 -22.112 718 2HD LYS 12 2HD LYS 12 -13.081 -56.312 -22.406 719 1HE LYS 12 1HE LYS 12 -12.295 -57.968 -20.094 720 2HE LYS 12 2HE LYS 12 -11.976 -56.241 -19.954 721 1HZ LYS 12 1HZ LYS 12 -14.416 -56.041 -20.767 722 2HZ LYS 12 2HZ LYS 12 -14.103 -56.409 -19.142 723 3HZ LYS 12 3HZ LYS 12 -14.551 -57.641 -20.213 724 H MET 13 H MET 13 -10.911 -56.510 -26.164 725 HA MET 13 HA MET 13 -8.144 -55.879 -26.326 726 1HB MET 13 1HB MET 13 -8.917 -54.749 -28.095 727 2HB MET 13 2HB MET 13 -10.569 -55.035 -27.567 728 1HG MET 13 1HG MET 13 -10.804 -52.958 -26.699 729 2HG MET 13 2HG MET 13 -9.110 -52.834 -26.232 730 1HE MET 13 1HE MET 13 -9.215 -49.938 -27.574 731 2HE MET 13 2HE MET 13 -10.751 -50.668 -27.106 732 3HE MET 13 3HE MET 13 -10.540 -50.017 -28.731 733 H THR 14 H THR 14 -6.971 -54.198 -25.363 734 HA THR 14 HA THR 14 -7.835 -53.507 -22.705 735 HB THR 14 HB THR 14 -5.557 -52.015 -23.423 736 HG1 THR 14 HG1 THR 14 -4.633 -54.511 -23.887 737 1HG2 THR 14 1HG2 THR 14 -4.449 -53.373 -21.764 738 2HG2 THR 14 2HG2 THR 14 -5.710 -54.602 -21.879 739 3HG2 THR 14 3HG2 THR 14 -6.087 -53.011 -21.215 740 H PHE 15 H PHE 15 -9.463 -52.080 -22.725 741 HA PHE 15 HA PHE 15 -9.456 -49.797 -24.496 742 1HB PHE 15 1HB PHE 15 -11.624 -49.281 -23.144 743 2HB PHE 15 2HB PHE 15 -11.614 -50.631 -24.270 744 HD1 PHE 15 HD1 PHE 15 -11.749 -49.636 -20.762 745 HD2 PHE 15 HD2 PHE 15 -11.625 -52.923 -23.463 746 HE1 PHE 15 HE1 PHE 15 -12.446 -51.149 -18.951 747 HE2 PHE 15 HE2 PHE 15 -12.337 -54.437 -21.661 748 HZ PHE 15 HZ PHE 15 -12.767 -53.536 -19.394 749 H GLY 16 H GLY 16 -8.411 -50.526 -21.343 750 1HA GLY 16 1HA GLY 16 -6.914 -48.869 -20.328 751 2HA GLY 16 2HA GLY 16 -8.082 -47.641 -20.796 752 H GLU 17 H GLU 17 -7.094 -48.033 -18.179 753 HA GLU 17 HA GLU 17 -7.752 -48.242 -16.017 754 1HB GLU 17 1HB GLU 17 -9.750 -46.888 -17.166 755 2HB GLU 17 2HB GLU 17 -10.642 -48.343 -16.747 756 1HG GLU 17 1HG GLU 17 -10.889 -46.683 -15.022 757 2HG GLU 17 2HG GLU 17 -9.987 -48.066 -14.405 758 H ASN 18 H ASN 18 -7.161 -50.543 -17.467 759 HA ASN 18 HA ASN 18 -9.105 -52.582 -17.132 760 1HB ASN 18 1HB ASN 18 -6.245 -52.438 -17.952 761 2HB ASN 18 2HB ASN 18 -6.857 -53.999 -17.417 762 1HD2 ASN 18 1HD2 ASN 18 -7.779 -55.228 -18.872 763 2HD2 ASN 18 2HD2 ASN 18 -8.363 -54.710 -20.421 764 H ARG 19 H ARG 19 -6.292 -51.518 -15.335 765 HA ARG 19 HA ARG 19 -7.055 -53.329 -13.142 766 1HB ARG 19 1HB ARG 19 -4.549 -52.851 -14.272 767 2HB ARG 19 2HB ARG 19 -4.539 -51.939 -12.767 768 1HG ARG 19 1HG ARG 19 -5.662 -54.461 -12.200 769 2HG ARG 19 2HG ARG 19 -4.207 -54.731 -13.163 770 1HD ARG 19 1HD ARG 19 -2.830 -53.914 -11.564 771 2HD ARG 19 2HD ARG 19 -4.006 -52.723 -11.009 772 HE ARG 19 HE ARG 19 -5.108 -54.512 -9.782 773 1HH1 ARG 19 1HH1 ARG 19 -1.888 -55.168 -10.999 774 2HH1 ARG 19 2HH1 ARG 19 -1.541 -56.369 -9.793 775 1HH2 ARG 19 1HH2 ARG 19 -4.649 -56.101 -8.187 776 2HH2 ARG 19 2HH2 ARG 19 -3.082 -56.865 -8.175 777 H ASP 20 H ASP 20 -7.949 -52.465 -11.415 778 HA ASP 20 HA ASP 20 -8.469 -49.648 -11.410 779 1HB ASP 20 1HB ASP 20 -10.279 -50.176 -10.152 780 2HB ASP 20 2HB ASP 20 -9.919 -51.809 -10.693 781 H LEU 21 H LEU 21 -6.104 -51.591 -9.948 782 HA LEU 21 HA LEU 21 -5.750 -49.948 -7.607 783 1HB LEU 21 1HB LEU 21 -4.551 -52.403 -8.704 784 2HB LEU 21 2HB LEU 21 -3.449 -51.388 -7.796 785 HG LEU 21 HG LEU 21 -6.093 -52.338 -6.698 786 1HD1 LEU 21 1HD1 LEU 21 -5.125 -54.210 -5.820 787 2HD1 LEU 21 2HD1 LEU 21 -3.502 -53.520 -5.846 788 3HD1 LEU 21 3HD1 LEU 21 -4.239 -54.093 -7.342 789 1HD2 LEU 21 1HD2 LEU 21 -5.593 -51.183 -4.858 790 2HD2 LEU 21 2HD2 LEU 21 -4.387 -50.352 -5.837 791 3HD2 LEU 21 3HD2 LEU 21 -3.924 -51.745 -4.860 792 H GLU 22 H GLU 22 -5.638 -47.971 -8.984 793 HA GLU 22 HA GLU 22 -2.847 -47.450 -9.784 794 1HB GLU 22 1HB GLU 22 -5.279 -47.145 -11.294 795 2HB GLU 22 2HB GLU 22 -4.541 -45.569 -11.045 796 1HG GLU 22 1HG GLU 22 -3.060 -47.946 -12.129 797 2HG GLU 22 2HG GLU 22 -3.874 -46.751 -13.139 798 H ARG 23 H ARG 23 -1.887 -45.913 -8.578 799 HA ARG 23 HA ARG 23 -3.547 -43.832 -7.358 800 1HB ARG 23 1HB ARG 23 -2.848 -46.059 -5.930 801 2HB ARG 23 2HB ARG 23 -1.554 -44.941 -5.516 802 1HG ARG 23 1HG ARG 23 -3.344 -44.780 -3.908 803 2HG ARG 23 2HG ARG 23 -3.228 -43.281 -4.831 804 1HD ARG 23 1HD ARG 23 -5.080 -45.398 -5.798 805 2HD ARG 23 2HD ARG 23 -5.555 -44.461 -4.383 806 HE ARG 23 HE ARG 23 -5.343 -43.527 -7.121 807 1HH1 ARG 23 1HH1 ARG 23 -5.574 -42.640 -3.738 808 2HH1 ARG 23 2HH1 ARG 23 -6.212 -41.055 -4.067 809 1HH2 ARG 23 1HH2 ARG 23 -6.157 -41.448 -7.560 810 2HH2 ARG 23 2HH2 ARG 23 -6.530 -40.367 -6.245 811 H VAL 24 H VAL 24 -2.198 -42.906 -9.269 812 HA VAL 24 HA VAL 24 0.296 -41.833 -8.113 813 HB VAL 24 HB VAL 24 -0.385 -41.772 -11.055 814 1HG1 VAL 24 1HG1 VAL 24 2.262 -41.674 -10.986 815 2HG1 VAL 24 2HG1 VAL 24 1.948 -41.026 -9.375 816 3HG1 VAL 24 3HG1 VAL 24 1.272 -40.226 -10.794 817 1HG2 VAL 24 1HG2 VAL 24 0.145 -43.918 -11.278 818 2HG2 VAL 24 2HG2 VAL 24 0.329 -44.061 -9.530 819 3HG2 VAL 24 3HG2 VAL 24 1.715 -43.617 -10.528 820 H VAL 25 H VAL 25 -0.180 -39.927 -7.205 821 HA VAL 25 HA VAL 25 -1.906 -38.081 -8.725 822 HB VAL 25 HB VAL 25 -2.523 -37.129 -6.413 823 1HG1 VAL 25 1HG1 VAL 25 -4.123 -38.218 -7.867 824 2HG1 VAL 25 2HG1 VAL 25 -4.401 -38.697 -6.191 825 3HG1 VAL 25 3HG1 VAL 25 -3.592 -39.802 -7.304 826 1HG2 VAL 25 1HG2 VAL 25 -0.973 -38.314 -5.027 827 2HG2 VAL 25 2HG2 VAL 25 -1.542 -39.870 -5.629 828 3HG2 VAL 25 3HG2 VAL 25 -2.596 -38.873 -4.626 829 H THR 26 H THR 26 -1.249 -36.001 -8.889 830 HA THR 26 HA THR 26 1.469 -35.432 -7.965 831 HB THR 26 HB THR 26 0.009 -33.484 -9.667 832 HG1 THR 26 HG1 THR 26 0.836 -36.065 -10.589 833 1HG2 THR 26 1HG2 THR 26 2.713 -34.708 -10.132 834 2HG2 THR 26 2HG2 THR 26 2.476 -33.431 -8.938 835 3HG2 THR 26 3HG2 THR 26 2.113 -33.130 -10.638 836 H ALA 27 H ALA 27 1.969 -33.756 -6.598 837 HA ALA 27 HA ALA 27 -0.195 -32.719 -4.992 838 1HB ALA 27 1HB ALA 27 2.283 -33.464 -4.339 839 2HB ALA 27 2HB ALA 27 1.365 -32.276 -3.410 840 3HB ALA 27 3HB ALA 27 2.569 -31.741 -4.585 841 HA PRO 28 HA PRO 28 -0.426 -29.061 -7.596 842 1HB PRO 28 1HB PRO 28 -2.590 -28.251 -5.808 843 2HB PRO 28 2HB PRO 28 -2.656 -28.655 -7.524 844 1HG PRO 28 1HG PRO 28 -3.742 -30.234 -5.613 845 2HG PRO 28 2HG PRO 28 -3.074 -30.878 -7.123 846 1HD PRO 28 1HD PRO 28 -1.850 -30.801 -4.391 847 2HD PRO 28 2HD PRO 28 -1.820 -32.100 -5.604 848 H VAL 29 H VAL 29 1.385 -27.920 -7.018 849 HA VAL 29 HA VAL 29 1.635 -26.768 -4.384 850 HB VAL 29 HB VAL 29 3.678 -25.618 -5.650 851 1HG1 VAL 29 1HG1 VAL 29 3.556 -28.508 -4.803 852 2HG1 VAL 29 2HG1 VAL 29 3.904 -27.116 -3.776 853 3HG1 VAL 29 3HG1 VAL 29 5.040 -27.585 -5.041 854 1HG2 VAL 29 1HG2 VAL 29 3.514 -28.154 -7.227 855 2HG2 VAL 29 2HG2 VAL 29 4.480 -26.708 -7.524 856 3HG2 VAL 29 3HG2 VAL 29 2.745 -26.687 -7.831 857 H SER 30 H SER 30 2.019 -24.472 -4.040 858 HA SER 30 HA SER 30 0.107 -22.890 -5.557 859 1HB SER 30 1HB SER 30 1.567 -21.591 -3.349 860 2HB SER 30 2HB SER 30 -0.170 -21.692 -3.646 861 HG SER 30 HG SER 30 0.015 -23.944 -2.921 862 H SER 31 H SER 31 0.809 -21.880 -7.307 863 HA SER 31 HA SER 31 3.611 -21.204 -7.586 864 1HB SER 31 1HB SER 31 1.644 -20.507 -9.702 865 2HB SER 31 2HB SER 31 3.245 -21.239 -9.839 866 HG SER 31 HG SER 31 2.282 -23.166 -8.906 867 H GLY 32 H GLY 32 3.384 -19.573 -5.817 868 1HA GLY 32 1HA GLY 32 2.795 -16.962 -7.039 869 2HA GLY 32 2HA GLY 32 2.141 -17.330 -5.447 870 H LYS 33 H LYS 33 5.184 -17.219 -7.254 871 HA LYS 33 HA LYS 33 6.719 -17.112 -4.810 872 1HB LYS 33 1HB LYS 33 8.669 -17.189 -6.249 873 2HB LYS 33 2HB LYS 33 7.501 -18.400 -6.757 874 1HG LYS 33 1HG LYS 33 6.721 -16.656 -8.464 875 2HG LYS 33 2HG LYS 33 8.235 -15.826 -8.099 876 1HD LYS 33 1HD LYS 33 8.940 -18.501 -8.483 877 2HD LYS 33 2HD LYS 33 7.761 -18.148 -9.746 878 1HE LYS 33 1HE LYS 33 9.693 -16.008 -9.401 879 2HE LYS 33 2HE LYS 33 10.457 -17.545 -9.803 880 1HZ LYS 33 1HZ LYS 33 8.902 -17.721 -11.694 881 2HZ LYS 33 2HZ LYS 33 9.939 -16.381 -11.810 882 3HZ LYS 33 3HZ LYS 33 8.323 -16.165 -11.342 883 H ILE 34 H ILE 34 5.122 -14.811 -6.577 884 HA ILE 34 HA ILE 34 6.872 -12.709 -5.496 885 HB ILE 34 HB ILE 34 5.620 -11.414 -7.559 886 1HG1 ILE 34 1HG1 ILE 34 6.745 -13.755 -8.993 887 2HG1 ILE 34 2HG1 ILE 34 5.153 -13.968 -8.271 888 1HG2 ILE 34 1HG2 ILE 34 8.194 -11.903 -6.698 889 2HG2 ILE 34 2HG2 ILE 34 7.717 -10.810 -8.001 890 3HG2 ILE 34 3HG2 ILE 34 8.203 -12.468 -8.370 891 1HD1 ILE 34 1HD1 ILE 34 4.182 -12.768 -9.861 892 2HD1 ILE 34 2HD1 ILE 34 5.711 -12.870 -10.735 893 3HD1 ILE 34 3HD1 ILE 34 5.369 -11.470 -9.715 894 H LYS 35 H LYS 35 5.891 -11.118 -4.423 895 HA LYS 35 HA LYS 35 2.945 -11.055 -4.389 896 1HB LYS 35 1HB LYS 35 4.755 -10.664 -1.995 897 2HB LYS 35 2HB LYS 35 2.995 -10.698 -1.992 898 1HG LYS 35 1HG LYS 35 4.402 -13.089 -3.031 899 2HG LYS 35 2HG LYS 35 4.477 -12.786 -1.295 900 1HD LYS 35 1HD LYS 35 2.355 -13.399 -0.995 901 2HD LYS 35 2HD LYS 35 1.796 -12.455 -2.378 902 1HE LYS 35 1HE LYS 35 1.300 -14.654 -2.965 903 2HE LYS 35 2HE LYS 35 2.812 -14.328 -3.808 904 1HZ LYS 35 1HZ LYS 35 2.288 -16.095 -1.535 905 2HZ LYS 35 2HZ LYS 35 3.796 -15.319 -1.588 906 3HZ LYS 35 3HZ LYS 35 3.311 -16.316 -2.870 907 H ARG 36 H ARG 36 2.123 -9.056 -4.708 908 HA ARG 36 HA ARG 36 4.085 -6.895 -4.981 909 1HB ARG 36 1HB ARG 36 2.445 -5.835 -6.460 910 2HB ARG 36 2HB ARG 36 2.827 -7.469 -6.984 911 1HG ARG 36 1HG ARG 36 0.545 -7.433 -5.212 912 2HG ARG 36 2HG ARG 36 0.312 -6.377 -6.606 913 1HD ARG 36 1HD ARG 36 0.677 -8.145 -8.129 914 2HD ARG 36 2HD ARG 36 1.304 -9.200 -6.864 915 HE ARG 36 HE ARG 36 -1.387 -8.415 -6.333 916 1HH1 ARG 36 1HH1 ARG 36 0.615 -10.670 -8.114 917 2HH1 ARG 36 2HH1 ARG 36 -0.683 -11.801 -8.394 918 1HH2 ARG 36 1HH2 ARG 36 -3.085 -9.935 -6.647 919 2HH2 ARG 36 2HH2 ARG 36 -2.771 -11.391 -7.535 920 H VAL 37 H VAL 37 3.826 -4.883 -4.153 921 HA VAL 37 HA VAL 37 1.547 -4.370 -2.367 922 HB VAL 37 HB VAL 37 4.334 -3.529 -1.580 923 1HG1 VAL 37 1HG1 VAL 37 3.410 -3.018 0.509 924 2HG1 VAL 37 2HG1 VAL 37 1.969 -3.988 0.210 925 3HG1 VAL 37 3HG1 VAL 37 2.198 -2.464 -0.645 926 1HG2 VAL 37 1HG2 VAL 37 3.197 -5.746 -0.052 927 2HG2 VAL 37 2HG2 VAL 37 4.847 -5.487 -0.620 928 3HG2 VAL 37 3HG2 VAL 37 3.636 -6.168 -1.706 929 H ASN 38 H ASN 38 0.858 -2.253 -2.370 930 HA ASN 38 HA ASN 38 2.254 -0.451 -4.250 931 1HB ASN 38 1HB ASN 38 0.074 -0.835 -5.115 932 2HB ASN 38 2HB ASN 38 -0.667 -0.687 -3.527 933 1HD2 ASN 38 1HD2 ASN 38 -1.355 1.253 -2.857 934 2HD2 ASN 38 2HD2 ASN 38 -1.140 2.736 -3.727 935 H VAL 39 H VAL 39 3.039 1.418 -3.495 936 HA VAL 39 HA VAL 39 2.470 2.063 -0.679 937 HB VAL 39 HB VAL 39 4.826 3.356 -1.811 938 1HG1 VAL 39 1HG1 VAL 39 4.124 3.175 0.603 939 2HG1 VAL 39 2HG1 VAL 39 5.801 2.758 0.261 940 3HG1 VAL 39 3HG1 VAL 39 4.612 1.485 0.532 941 1HG2 VAL 39 1HG2 VAL 39 6.196 1.229 -1.701 942 2HG2 VAL 39 2HG2 VAL 39 5.166 1.419 -3.120 943 3HG2 VAL 39 3HG2 VAL 39 4.667 0.352 -1.807 944 H ASN 40 H ASN 40 2.562 4.311 -0.065 945 HA ASN 40 HA ASN 40 1.498 6.101 -2.144 946 1HB ASN 40 1HB ASN 40 0.104 5.609 -0.078 947 2HB ASN 40 2HB ASN 40 1.329 6.459 0.857 948 1HD2 ASN 40 1HD2 ASN 40 -1.503 6.741 -0.903 949 2HD2 ASN 40 2HD2 ASN 40 -1.549 8.469 -1.037 950 H PHE 41 H PHE 41 3.062 7.316 -2.971 951 HA PHE 41 HA PHE 41 5.360 8.015 -1.289 952 1HB PHE 41 1HB PHE 41 4.921 7.735 -4.242 953 2HB PHE 41 2HB PHE 41 6.241 8.737 -3.659 954 HD1 PHE 41 HD1 PHE 41 5.464 5.917 -1.564 955 HD2 PHE 41 HD2 PHE 41 7.663 7.168 -4.982 956 HE1 PHE 41 HE1 PHE 41 6.877 3.916 -1.382 957 HE2 PHE 41 HE2 PHE 41 9.081 5.168 -4.808 958 HZ PHE 41 HZ PHE 41 8.684 3.534 -3.012 959 H ASP 42 H ASP 42 6.284 10.116 -1.434 960 HA ASP 42 HA ASP 42 4.343 12.262 -1.647 961 1HB ASP 42 1HB ASP 42 6.114 12.130 0.170 962 2HB ASP 42 2HB ASP 42 7.304 12.479 -1.080 963 H GLU 43 H GLU 43 5.094 14.261 -2.854 964 HA GLU 43 HA GLU 43 5.547 13.708 -5.591 965 1HB GLU 43 1HB GLU 43 4.854 15.951 -4.015 966 2HB GLU 43 2HB GLU 43 6.312 16.389 -4.893 967 1HG GLU 43 1HG GLU 43 3.775 15.337 -6.123 968 2HG GLU 43 2HG GLU 43 4.293 17.023 -6.102 969 H GLU 44 H GLU 44 7.591 14.818 -2.948 970 HA GLU 44 HA GLU 44 10.003 15.181 -4.351 971 1HB GLU 44 1HB GLU 44 9.384 15.744 -1.900 972 2HB GLU 44 2HB GLU 44 9.852 14.083 -1.557 973 1HG GLU 44 1HG GLU 44 11.710 15.504 -1.094 974 2HG GLU 44 2HG GLU 44 12.078 14.561 -2.538 975 H LYS 45 H LYS 45 8.605 12.367 -2.754 976 HA LYS 45 HA LYS 45 10.731 10.614 -2.961 977 1HB LYS 45 1HB LYS 45 7.780 10.287 -2.723 978 2HB LYS 45 2HB LYS 45 8.752 8.865 -3.084 979 1HG LYS 45 1HG LYS 45 10.168 9.577 -1.057 980 2HG LYS 45 2HG LYS 45 8.792 10.601 -0.646 981 1HD LYS 45 1HD LYS 45 7.416 8.812 -0.209 982 2HD LYS 45 2HD LYS 45 8.300 7.732 -1.290 983 1HE LYS 45 1HE LYS 45 9.257 6.886 0.527 984 2HE LYS 45 2HE LYS 45 10.161 8.395 0.643 985 1HZ LYS 45 1HZ LYS 45 9.212 8.549 2.650 986 2HZ LYS 45 2HZ LYS 45 8.007 7.408 2.287 987 3HZ LYS 45 3HZ LYS 45 7.808 9.023 1.817 988 H HIS 46 H HIS 46 8.213 11.333 -5.320 989 HA HIS 46 HA HIS 46 9.049 9.244 -7.099 990 1HB HIS 46 1HB HIS 46 6.753 10.652 -6.885 991 2HB HIS 46 2HB HIS 46 7.512 11.497 -8.230 992 HD1 HIS 46 HD1 HIS 46 5.891 10.618 -9.996 993 HD2 HIS 46 HD2 HIS 46 7.836 7.608 -7.875 994 HE1 HIS 46 HE1 HIS 46 5.394 8.480 -11.234 995 HE2 HIS 46 HE2 HIS 46 6.589 6.670 -9.947 996 H THR 47 H THR 47 9.540 12.755 -6.983 997 HA THR 47 HA THR 47 10.918 12.922 -9.441 998 HB THR 47 HB THR 47 11.513 14.840 -7.226 999 HG1 THR 47 HG1 THR 47 9.459 15.262 -6.967 1000 1HG2 THR 47 1HG2 THR 47 12.437 15.098 -9.535 1001 2HG2 THR 47 2HG2 THR 47 11.457 16.464 -8.996 1002 3HG2 THR 47 3HG2 THR 47 10.784 15.281 -10.122 1003 H ARG 48 H ARG 48 12.099 12.660 -6.075 1004 HA ARG 48 HA ARG 48 14.850 12.677 -6.799 1005 1HB ARG 48 1HB ARG 48 13.638 11.431 -4.336 1006 2HB ARG 48 2HB ARG 48 15.307 11.927 -4.553 1007 1HG ARG 48 1HG ARG 48 13.067 13.903 -4.743 1008 2HG ARG 48 2HG ARG 48 13.770 13.444 -3.190 1009 1HD ARG 48 1HD ARG 48 15.996 13.954 -4.679 1010 2HD ARG 48 2HD ARG 48 14.852 15.132 -5.329 1011 HE ARG 48 HE ARG 48 14.570 15.969 -3.059 1012 1HH1 ARG 48 1HH1 ARG 48 17.389 14.004 -3.759 1013 2HH1 ARG 48 2HH1 ARG 48 18.281 14.557 -2.368 1014 1HH2 ARG 48 1HH2 ARG 48 15.728 16.690 -1.219 1015 2HH2 ARG 48 2HH2 ARG 48 17.342 16.092 -0.931 1016 H PHE 49 H PHE 49 12.423 10.149 -6.524 1017 HA PHE 49 HA PHE 49 14.174 7.949 -6.562 1018 1HB PHE 49 1HB PHE 49 11.477 8.194 -6.363 1019 2HB PHE 49 2HB PHE 49 11.625 7.615 -8.018 1020 HD1 PHE 49 HD1 PHE 49 14.344 6.461 -6.102 1021 HD2 PHE 49 HD2 PHE 49 10.224 5.732 -6.881 1022 HE1 PHE 49 HE1 PHE 49 14.597 4.158 -5.269 1023 HE2 PHE 49 HE2 PHE 49 10.471 3.432 -6.047 1024 HZ PHE 49 HZ PHE 49 12.686 2.639 -5.259 1025 H LYS 50 H LYS 50 12.654 9.794 -9.167 1026 HA LYS 50 HA LYS 50 13.626 8.241 -11.311 1027 1HB LYS 50 1HB LYS 50 12.152 10.653 -10.978 1028 2HB LYS 50 2HB LYS 50 13.475 10.980 -12.091 1029 1HG LYS 50 1HG LYS 50 11.653 10.318 -13.420 1030 2HG LYS 50 2HG LYS 50 12.737 8.927 -13.365 1031 1HD LYS 50 1HD LYS 50 10.839 7.809 -12.866 1032 2HD LYS 50 2HD LYS 50 11.179 8.394 -11.236 1033 1HE LYS 50 1HE LYS 50 8.855 8.802 -11.825 1034 2HE LYS 50 2HE LYS 50 9.722 10.324 -11.626 1035 1HZ LYS 50 1HZ LYS 50 9.527 10.828 -13.807 1036 2HZ LYS 50 2HZ LYS 50 8.167 9.821 -13.696 1037 3HZ LYS 50 3HZ LYS 50 9.623 9.212 -14.322 1038 H ALA 51 H ALA 51 14.949 11.038 -9.603 1039 HA ALA 51 HA ALA 51 17.277 11.319 -11.201 1040 1HB ALA 51 1HB ALA 51 16.470 13.132 -9.800 1041 2HB ALA 51 2HB ALA 51 18.121 12.698 -9.354 1042 3HB ALA 51 3HB ALA 51 16.770 12.171 -8.352 1043 H ALA 52 H ALA 52 16.742 9.813 -8.015 1044 HA ALA 52 HA ALA 52 19.337 8.887 -7.611 1045 1HB ALA 52 1HB ALA 52 16.714 7.790 -6.614 1046 2HB ALA 52 2HB ALA 52 17.785 8.928 -5.794 1047 3HB ALA 52 3HB ALA 52 18.291 7.256 -6.039 1048 H CYS 53 H CYS 53 16.623 7.323 -9.277 1049 HA CYS 53 HA CYS 53 17.909 4.834 -9.657 1050 1HB CYS 53 1HB CYS 53 15.702 6.167 -11.241 1051 2HB CYS 53 2HB CYS 53 16.228 4.506 -11.494 1052 HG CYS 53 HG CYS 53 14.593 5.812 -8.813 1053 H ALA 54 H ALA 54 17.721 7.770 -11.634 1054 HA ALA 54 HA ALA 54 19.122 6.757 -13.870 1055 1HB ALA 54 1HB ALA 54 18.576 8.733 -14.718 1056 2HB ALA 54 2HB ALA 54 19.587 9.564 -13.536 1057 3HB ALA 54 3HB ALA 54 17.909 9.185 -13.150 1058 H ARG 55 H ARG 55 20.150 8.406 -10.932 1059 HA ARG 55 HA ARG 55 22.892 8.647 -11.620 1060 1HB ARG 55 1HB ARG 55 21.476 9.756 -9.700 1061 2HB ARG 55 2HB ARG 55 21.981 8.345 -8.783 1062 1HG ARG 55 1HG ARG 55 24.359 9.090 -9.730 1063 2HG ARG 55 2HG ARG 55 23.555 10.660 -9.727 1064 1HD ARG 55 1HD ARG 55 24.149 8.837 -7.427 1065 2HD ARG 55 2HD ARG 55 24.536 10.546 -7.620 1066 HE ARG 55 HE ARG 55 21.902 10.692 -7.567 1067 1HH1 ARG 55 1HH1 ARG 55 24.065 8.803 -5.544 1068 2HH1 ARG 55 2HH1 ARG 55 22.973 8.779 -4.194 1069 1HH2 ARG 55 1HH2 ARG 55 20.468 10.658 -5.783 1070 2HH2 ARG 55 2HH2 ARG 55 20.940 9.824 -4.329 1071 H LYS 56 H LYS 56 21.085 6.254 -9.713 1072 HA LYS 56 HA LYS 56 23.334 4.640 -9.111 1073 1HB LYS 56 1HB LYS 56 20.978 4.734 -8.007 1074 2HB LYS 56 2HB LYS 56 20.532 3.564 -9.240 1075 1HG LYS 56 1HG LYS 56 22.197 2.019 -8.439 1076 2HG LYS 56 2HG LYS 56 22.789 3.213 -7.282 1077 1HD LYS 56 1HD LYS 56 21.270 2.587 -5.792 1078 2HD LYS 56 2HD LYS 56 19.967 2.868 -6.949 1079 1HE LYS 56 1HE LYS 56 20.062 0.540 -6.066 1080 2HE LYS 56 2HE LYS 56 20.172 0.648 -7.823 1081 1HZ LYS 56 1HZ LYS 56 22.547 0.408 -6.050 1082 2HZ LYS 56 2HZ LYS 56 22.495 0.251 -7.742 1083 3HZ LYS 56 3HZ LYS 56 21.768 -0.923 -6.759 1084 H GLY 57 H GLY 57 21.067 4.713 -11.774 1085 1HA GLY 57 1HA GLY 57 21.271 3.756 -13.874 1086 2HA GLY 57 2HA GLY 57 22.789 3.027 -13.361 1087 H THR 58 H THR 58 19.295 2.800 -12.733 1088 HA THR 58 HA THR 58 19.307 -0.037 -13.135 1089 HB THR 58 HB THR 58 20.295 0.314 -10.808 1090 HG1 THR 58 HG1 THR 58 18.838 -1.397 -9.947 1091 1HG2 THR 58 1HG2 THR 58 17.837 1.775 -10.494 1092 2HG2 THR 58 2HG2 THR 58 19.196 1.625 -9.380 1093 3HG2 THR 58 3HG2 THR 58 17.896 0.435 -9.345 1094 H SER 59 H SER 59 17.161 -0.987 -12.768 1095 HA SER 59 HA SER 59 15.108 0.720 -13.782 1096 1HB SER 59 1HB SER 59 13.932 -1.688 -13.021 1097 2HB SER 59 2HB SER 59 14.596 -1.309 -14.615 1098 HG SER 59 HG SER 59 15.617 -3.154 -13.919 1099 H ILE 60 H ILE 60 13.009 1.046 -12.806 1100 HA ILE 60 HA ILE 60 13.150 1.908 -10.127 1101 HB ILE 60 HB ILE 60 11.525 2.620 -12.050 1102 1HG1 ILE 60 1HG1 ILE 60 9.859 2.766 -9.734 1103 2HG1 ILE 60 2HG1 ILE 60 11.539 2.907 -9.224 1104 1HG2 ILE 60 1HG2 ILE 60 9.942 1.165 -12.586 1105 2HG2 ILE 60 2HG2 ILE 60 9.245 1.408 -10.985 1106 3HG2 ILE 60 3HG2 ILE 60 10.397 0.102 -11.255 1107 1HD1 ILE 60 1HD1 ILE 60 10.377 5.063 -9.726 1108 2HD1 ILE 60 2HD1 ILE 60 10.339 4.567 -11.420 1109 3HD1 ILE 60 3HD1 ILE 60 11.887 4.798 -10.603 1110 H THR 61 H THR 61 12.550 -1.186 -11.443 1111 HA THR 61 HA THR 61 11.046 -2.227 -9.247 1112 HB THR 61 HB THR 61 12.442 -4.290 -10.651 1113 HG1 THR 61 HG1 THR 61 12.296 -3.692 -12.703 1114 1HG2 THR 61 1HG2 THR 61 10.012 -3.992 -9.609 1115 2HG2 THR 61 2HG2 THR 61 10.349 -5.164 -10.885 1116 3HG2 THR 61 3HG2 THR 61 9.625 -3.607 -11.287 1117 H ASP 62 H ASP 62 14.453 -2.276 -10.235 1118 HA ASP 62 HA ASP 62 15.307 -4.005 -8.171 1119 1HB ASP 62 1HB ASP 62 16.678 -3.832 -10.111 1120 2HB ASP 62 2HB ASP 62 16.815 -2.085 -9.937 1121 H VAL 63 H VAL 63 15.230 -0.468 -8.437 1122 HA VAL 63 HA VAL 63 16.692 0.081 -6.115 1123 HB VAL 63 HB VAL 63 15.017 2.169 -6.049 1124 1HG1 VAL 63 1HG1 VAL 63 17.094 1.942 -8.206 1125 2HG1 VAL 63 2HG1 VAL 63 17.494 2.076 -6.496 1126 3HG1 VAL 63 3HG1 VAL 63 16.612 3.373 -7.297 1127 1HG2 VAL 63 1HG2 VAL 63 15.005 1.670 -8.978 1128 2HG2 VAL 63 2HG2 VAL 63 13.927 2.660 -7.991 1129 3HG2 VAL 63 3HG2 VAL 63 13.762 0.903 -7.987 1130 H VAL 64 H VAL 64 13.185 -0.351 -6.537 1131 HA VAL 64 HA VAL 64 12.521 0.054 -3.831 1132 HB VAL 64 HB VAL 64 11.046 -1.652 -5.845 1133 1HG1 VAL 64 1HG1 VAL 64 10.413 -2.041 -3.485 1134 2HG1 VAL 64 2HG1 VAL 64 9.110 -1.327 -4.439 1135 3HG1 VAL 64 3HG1 VAL 64 10.044 -0.321 -3.328 1136 1HG2 VAL 64 1HG2 VAL 64 9.598 0.483 -5.926 1137 2HG2 VAL 64 2HG2 VAL 64 11.116 0.461 -6.824 1138 3HG2 VAL 64 3HG2 VAL 64 11.023 1.292 -5.269 1139 H ASN 65 H ASN 65 13.463 -2.807 -5.646 1140 HA ASN 65 HA ASN 65 13.074 -4.684 -3.558 1141 1HB ASN 65 1HB ASN 65 13.593 -4.978 -6.145 1142 2HB ASN 65 2HB ASN 65 15.255 -5.055 -5.565 1143 1HD2 ASN 65 1HD2 ASN 65 12.628 -6.842 -6.328 1144 2HD2 ASN 65 2HD2 ASN 65 12.988 -8.279 -5.431 1145 H GLN 66 H GLN 66 15.583 -2.400 -4.322 1146 HA GLN 66 HA GLN 66 17.571 -3.566 -2.624 1147 1HB GLN 66 1HB GLN 66 17.870 -1.995 -4.684 1148 2HB GLN 66 2HB GLN 66 17.636 -0.706 -3.509 1149 1HG GLN 66 1HG GLN 66 19.705 -0.911 -2.746 1150 2HG GLN 66 2HG GLN 66 19.546 -2.655 -2.568 1151 1HE2 GLN 66 1HE2 GLN 66 19.096 -3.365 -5.216 1152 2HE2 GLN 66 2HE2 GLN 66 20.526 -3.032 -6.135 1153 H LEU 67 H LEU 67 15.275 -0.850 -2.295 1154 HA LEU 67 HA LEU 67 16.252 -0.043 0.244 1155 1HB LEU 67 1HB LEU 67 13.548 0.556 0.310 1156 2HB LEU 67 2HB LEU 67 14.851 1.624 -0.160 1157 HG LEU 67 HG LEU 67 14.087 0.050 -2.424 1158 1HD1 LEU 67 1HD1 LEU 67 11.920 0.765 -0.660 1159 2HD1 LEU 67 2HD1 LEU 67 11.899 -0.192 -2.142 1160 3HD1 LEU 67 3HD1 LEU 67 11.770 1.566 -2.226 1161 1HD2 LEU 67 1HD2 LEU 67 13.229 2.678 -2.763 1162 2HD2 LEU 67 2HD2 LEU 67 14.787 2.000 -3.239 1163 3HD2 LEU 67 3HD2 LEU 67 14.609 2.789 -1.671 1164 H VAL 68 H VAL 68 13.813 -2.347 -0.809 1165 HA VAL 68 HA VAL 68 12.900 -3.149 1.753 1166 HB VAL 68 HB VAL 68 13.001 -4.670 -0.861 1167 1HG1 VAL 68 1HG1 VAL 68 11.974 -5.436 1.836 1168 2HG1 VAL 68 2HG1 VAL 68 12.837 -6.410 0.642 1169 3HG1 VAL 68 3HG1 VAL 68 11.137 -6.011 0.390 1170 1HG2 VAL 68 1HG2 VAL 68 11.484 -2.971 -1.209 1171 2HG2 VAL 68 2HG2 VAL 68 10.973 -2.941 0.481 1172 3HG2 VAL 68 3HG2 VAL 68 10.445 -4.251 -0.575 1173 H ASP 69 H ASP 69 15.447 -4.307 -0.392 1174 HA ASP 69 HA ASP 69 16.368 -6.516 0.998 1175 1HB ASP 69 1HB ASP 69 17.083 -5.410 -1.284 1176 2HB ASP 69 2HB ASP 69 18.307 -4.623 -0.290 1177 H ASN 70 H ASN 70 17.685 -3.237 1.140 1178 HA ASN 70 HA ASN 70 19.482 -3.650 3.231 1179 1HB ASN 70 1HB ASN 70 18.103 -1.221 2.138 1180 2HB ASN 70 2HB ASN 70 19.124 -1.090 3.566 1181 1HD2 ASN 70 1HD2 ASN 70 19.104 -2.179 0.210 1182 2HD2 ASN 70 2HD2 ASN 70 20.789 -1.887 -0.084 1183 H TRP 71 H TRP 71 16.178 -2.367 3.304 1184 HA TRP 71 HA TRP 71 15.957 -1.917 6.044 1185 1HB TRP 71 1HB TRP 71 14.318 -1.167 4.346 1186 2HB TRP 71 2HB TRP 71 13.792 -2.834 4.140 1187 HD1 TRP 71 HD1 TRP 71 13.766 -0.027 6.768 1188 HE1 TRP 71 HE1 TRP 71 11.800 -0.442 8.376 1189 HE3 TRP 71 HE3 TRP 71 12.245 -4.564 4.994 1190 HZ2 TRP 71 HZ2 TRP 71 9.865 -2.448 8.829 1191 HZ3 TRP 71 HZ3 TRP 71 10.328 -5.666 6.059 1192 HH2 TRP 71 HH2 TRP 71 9.160 -4.629 7.947 1193 H LEU 72 H LEU 72 15.179 -4.829 4.176 1194 HA LEU 72 HA LEU 72 14.086 -6.412 6.132 1195 1HB LEU 72 1HB LEU 72 15.150 -6.764 3.527 1196 2HB LEU 72 2HB LEU 72 15.828 -8.027 4.537 1197 HG LEU 72 HG LEU 72 13.723 -8.963 4.994 1198 1HD1 LEU 72 1HD1 LEU 72 12.105 -7.518 5.529 1199 2HD1 LEU 72 2HD1 LEU 72 11.734 -7.516 3.806 1200 3HD1 LEU 72 3HD1 LEU 72 12.758 -6.252 4.490 1201 1HD2 LEU 72 1HD2 LEU 72 14.506 -8.431 2.313 1202 2HD2 LEU 72 2HD2 LEU 72 12.746 -8.420 2.398 1203 3HD2 LEU 72 3HD2 LEU 72 13.646 -9.827 2.959 1204 H LYS 73 H LYS 73 17.538 -6.169 5.295 1205 HA LYS 73 HA LYS 73 18.279 -7.927 7.449 1206 1HB LYS 73 1HB LYS 73 20.118 -6.149 5.857 1207 2HB LYS 73 2HB LYS 73 20.532 -7.622 6.724 1208 1HG LYS 73 1HG LYS 73 20.021 -8.899 4.980 1209 2HG LYS 73 2HG LYS 73 18.471 -8.084 4.734 1210 1HD LYS 73 1HD LYS 73 19.347 -6.577 3.258 1211 2HD LYS 73 2HD LYS 73 20.957 -6.639 3.978 1212 1HE LYS 73 1HE LYS 73 21.202 -8.936 3.043 1213 2HE LYS 73 2HE LYS 73 19.675 -8.697 2.194 1214 1HZ LYS 73 1HZ LYS 73 20.594 -7.220 0.756 1215 2HZ LYS 73 2HZ LYS 73 21.979 -8.139 1.085 1216 3HZ LYS 73 3HZ LYS 73 21.741 -6.657 1.870 1217 H GLU 74 H GLU 74 18.175 -4.447 7.000 1218 HA GLU 74 HA GLU 74 19.799 -3.920 9.301 1219 1HB GLU 74 1HB GLU 74 18.131 -2.125 7.548 1220 2HB GLU 74 2HB GLU 74 19.096 -1.535 8.892 1221 1HG GLU 74 1HG GLU 74 20.001 -2.711 6.298 1222 2HG GLU 74 2HG GLU 74 20.448 -1.179 7.046 1223 H ASN 75 H ASN 75 16.339 -3.979 8.668 1224 HA ASN 75 HA ASN 75 15.684 -2.704 11.152 1225 1HB ASN 75 1HB ASN 75 13.599 -2.501 10.303 1226 2HB ASN 75 2HB ASN 75 14.383 -2.941 8.788 1227 1HD2 ASN 75 1HD2 ASN 75 14.191 -5.113 8.047 1228 2HD2 ASN 75 2HD2 ASN 75 12.879 -6.111 8.573 1229 H GLU 76 H GLU 76 15.984 -6.010 10.087 1230 HA GLU 76 HA GLU 76 14.482 -7.033 12.320 1231 1HB GLU 76 1HB GLU 76 15.639 -8.100 9.846 1232 2HB GLU 76 2HB GLU 76 15.728 -9.205 11.210 1233 1HG GLU 76 1HG GLU 76 13.132 -8.109 11.206 1234 2HG GLU 76 2HG GLU 76 13.502 -8.578 9.549 Start of MODEL 6 1 1H MET 1 1H MET 1 -76.379 42.196 -37.821 2 2H MET 1 2H MET 1 -77.984 42.037 -38.342 3 3H MET 1 3H MET 1 -76.721 42.032 -39.473 4 HA MET 1 HA MET 1 -76.389 40.022 -37.469 5 1HB MET 1 1HB MET 1 -78.880 40.148 -37.593 6 2HB MET 1 2HB MET 1 -78.778 39.849 -39.323 7 1HG MET 1 1HG MET 1 -77.767 37.667 -38.886 8 2HG MET 1 2HG MET 1 -77.882 37.968 -37.152 9 1HE MET 1 1HE MET 1 -80.273 36.057 -39.992 10 2HE MET 1 2HE MET 1 -79.405 37.537 -40.414 11 3HE MET 1 3HE MET 1 -81.155 37.572 -40.196 12 H SER 2 H SER 2 -74.426 39.697 -38.466 13 HA SER 2 HA SER 2 -74.409 39.200 -41.350 14 1HB SER 2 1HB SER 2 -71.794 39.074 -40.558 15 2HB SER 2 2HB SER 2 -72.610 40.551 -41.077 16 HG SER 2 HG SER 2 -71.913 39.685 -38.502 17 H LEU 3 H LEU 3 -72.803 37.437 -42.045 18 HA LEU 3 HA LEU 3 -73.612 34.973 -40.765 19 1HB LEU 3 1HB LEU 3 -72.508 35.785 -43.334 20 2HB LEU 3 2HB LEU 3 -71.726 34.348 -42.707 21 HG LEU 3 HG LEU 3 -73.775 34.089 -44.262 22 1HD1 LEU 3 1HD1 LEU 3 -72.858 32.161 -43.298 23 2HD1 LEU 3 2HD1 LEU 3 -74.565 32.120 -42.853 24 3HD1 LEU 3 3HD1 LEU 3 -73.358 32.632 -41.674 25 1HD2 LEU 3 1HD2 LEU 3 -74.994 35.164 -41.780 26 2HD2 LEU 3 2HD2 LEU 3 -75.832 33.848 -42.599 27 3HD2 LEU 3 3HD2 LEU 3 -75.493 35.349 -43.462 28 H GLU 4 H GLU 4 -72.568 35.409 -38.740 29 HA GLU 4 HA GLU 4 -69.857 35.907 -38.418 30 1HB GLU 4 1HB GLU 4 -71.759 34.468 -36.559 31 2HB GLU 4 2HB GLU 4 -70.178 35.082 -36.097 32 1HG GLU 4 1HG GLU 4 -72.553 36.692 -37.000 33 2HG GLU 4 2HG GLU 4 -71.855 36.629 -35.383 34 H LYS 5 H LYS 5 -68.220 34.744 -39.083 35 HA LYS 5 HA LYS 5 -68.457 31.820 -39.182 36 1HB LYS 5 1HB LYS 5 -66.448 33.679 -40.465 37 2HB LYS 5 2HB LYS 5 -66.440 31.928 -40.627 38 1HG LYS 5 1HG LYS 5 -68.897 32.328 -41.476 39 2HG LYS 5 2HG LYS 5 -68.269 33.938 -41.828 40 1HD LYS 5 1HD LYS 5 -66.284 32.406 -42.832 41 2HD LYS 5 2HD LYS 5 -67.670 31.348 -43.097 42 1HE LYS 5 1HE LYS 5 -68.169 32.535 -44.910 43 2HE LYS 5 2HE LYS 5 -68.499 33.916 -43.864 44 1HZ LYS 5 1HZ LYS 5 -65.735 33.741 -44.174 45 2HZ LYS 5 2HZ LYS 5 -66.775 34.942 -44.764 46 3HZ LYS 5 3HZ LYS 5 -66.414 33.588 -45.721 47 H ALA 6 H ALA 6 -66.121 34.338 -38.272 48 HA ALA 6 HA ALA 6 -64.544 34.480 -36.656 49 1HB ALA 6 1HB ALA 6 -65.368 34.008 -34.657 50 2HB ALA 6 2HB ALA 6 -65.175 32.277 -34.948 51 3HB ALA 6 3HB ALA 6 -66.662 33.093 -35.435 52 H HIS 7 H HIS 7 -63.016 32.767 -35.255 53 HA HIS 7 HA HIS 7 -62.213 30.583 -37.009 54 1HB HIS 7 1HB HIS 7 -60.868 33.107 -37.001 55 2HB HIS 7 2HB HIS 7 -59.803 31.908 -36.273 56 HD1 HIS 7 HD1 HIS 7 -58.418 32.500 -38.586 57 HD2 HIS 7 HD2 HIS 7 -61.897 30.240 -38.947 58 HE1 HIS 7 HE1 HIS 7 -58.279 31.384 -40.838 59 HE2 HIS 7 HE2 HIS 7 -60.407 30.051 -41.059 60 H THR 8 H THR 8 -63.342 29.916 -34.861 61 HA THR 8 HA THR 8 -61.746 29.999 -32.492 62 HB THR 8 HB THR 8 -63.654 28.024 -32.108 63 HG1 THR 8 HG1 THR 8 -65.076 28.288 -33.652 64 1HG2 THR 8 1HG2 THR 8 -63.236 29.805 -30.544 65 2HG2 THR 8 2HG2 THR 8 -64.941 29.855 -30.995 66 3HG2 THR 8 3HG2 THR 8 -63.809 31.013 -31.694 67 H SER 9 H SER 9 -59.937 29.026 -33.993 68 HA SER 9 HA SER 9 -59.634 26.279 -33.105 69 1HB SER 9 1HB SER 9 -58.583 26.277 -35.735 70 2HB SER 9 2HB SER 9 -59.947 25.340 -35.121 71 HG SER 9 HG SER 9 -61.348 26.921 -35.790 72 H VAL 10 H VAL 10 -57.949 26.721 -31.813 73 HA VAL 10 HA VAL 10 -55.494 27.734 -33.054 74 HB VAL 10 HB VAL 10 -55.163 28.930 -30.708 75 1HG1 VAL 10 1HG1 VAL 10 -56.395 29.866 -33.235 76 2HG1 VAL 10 2HG1 VAL 10 -54.876 30.333 -32.473 77 3HG1 VAL 10 3HG1 VAL 10 -56.401 30.970 -31.861 78 1HG2 VAL 10 1HG2 VAL 10 -57.727 28.092 -30.345 79 2HG2 VAL 10 2HG2 VAL 10 -57.970 29.735 -30.941 80 3HG2 VAL 10 3HG2 VAL 10 -56.983 29.454 -29.506 81 H LYS 11 H LYS 11 -54.034 27.811 -30.581 82 HA LYS 11 HA LYS 11 -54.181 24.989 -29.756 83 1HB LYS 11 1HB LYS 11 -51.906 26.513 -30.881 84 2HB LYS 11 2HB LYS 11 -51.538 25.485 -29.502 85 1HG LYS 11 1HG LYS 11 -51.298 23.848 -30.987 86 2HG LYS 11 2HG LYS 11 -53.061 23.847 -31.088 87 1HD LYS 11 1HD LYS 11 -51.940 25.914 -32.758 88 2HD LYS 11 2HD LYS 11 -51.241 24.343 -33.153 89 1HE LYS 11 1HE LYS 11 -54.101 25.225 -33.276 90 2HE LYS 11 2HE LYS 11 -53.113 24.463 -34.522 91 1HZ LYS 11 1HZ LYS 11 -54.286 23.190 -32.115 92 2HZ LYS 11 2HZ LYS 11 -53.099 22.442 -33.065 93 3HZ LYS 11 3HZ LYS 11 -54.603 22.830 -33.742 94 H LYS 12 H LYS 12 -55.495 26.239 -28.091 95 HA LYS 12 HA LYS 12 -53.993 27.781 -26.176 96 1HB LYS 12 1HB LYS 12 -56.694 27.494 -26.820 97 2HB LYS 12 2HB LYS 12 -56.544 26.798 -25.211 98 1HG LYS 12 1HG LYS 12 -56.926 28.944 -24.620 99 2HG LYS 12 2HG LYS 12 -55.174 29.037 -24.794 100 1HD LYS 12 1HD LYS 12 -56.949 29.588 -27.144 101 2HD LYS 12 2HD LYS 12 -56.679 30.835 -25.924 102 1HE LYS 12 1HE LYS 12 -54.307 29.430 -27.033 103 2HE LYS 12 2HE LYS 12 -55.134 30.594 -28.065 104 1HZ LYS 12 1HZ LYS 12 -53.969 31.116 -25.384 105 2HZ LYS 12 2HZ LYS 12 -54.886 32.239 -26.264 106 3HZ LYS 12 3HZ LYS 12 -53.400 31.696 -26.871 107 H MET 13 H MET 13 -53.724 27.200 -23.958 108 HA MET 13 HA MET 13 -52.993 25.871 -22.286 109 1HB MET 13 1HB MET 13 -55.341 24.806 -22.740 110 2HB MET 13 2HB MET 13 -54.406 23.485 -23.420 111 1HG MET 13 1HG MET 13 -55.126 23.773 -20.790 112 2HG MET 13 2HG MET 13 -53.876 22.698 -21.411 113 1HE MET 13 1HE MET 13 -52.149 22.651 -19.276 114 2HE MET 13 2HE MET 13 -50.830 23.740 -19.708 115 3HE MET 13 3HE MET 13 -51.596 22.750 -20.949 116 H THR 14 H THR 14 -51.276 26.269 -24.325 117 HA THR 14 HA THR 14 -50.128 23.731 -25.137 118 HB THR 14 HB THR 14 -48.341 25.809 -25.735 119 HG1 THR 14 HG1 THR 14 -50.898 26.563 -26.676 120 1HG2 THR 14 1HG2 THR 14 -48.968 25.339 -28.047 121 2HG2 THR 14 2HG2 THR 14 -50.413 24.494 -27.489 122 3HG2 THR 14 3HG2 THR 14 -48.817 23.843 -27.126 123 H PHE 15 H PHE 15 -48.243 22.861 -24.381 124 HA PHE 15 HA PHE 15 -47.524 23.438 -21.711 125 1HB PHE 15 1HB PHE 15 -47.310 21.191 -22.529 126 2HB PHE 15 2HB PHE 15 -46.246 21.704 -23.833 127 HD1 PHE 15 HD1 PHE 15 -44.101 20.984 -23.569 128 HD2 PHE 15 HD2 PHE 15 -46.306 22.138 -20.118 129 HE1 PHE 15 HE1 PHE 15 -42.146 20.487 -22.162 130 HE2 PHE 15 HE2 PHE 15 -44.359 21.641 -18.702 131 HZ PHE 15 HZ PHE 15 -42.275 20.816 -19.724 132 H GLY 16 H GLY 16 -45.598 23.734 -24.713 133 1HA GLY 16 1HA GLY 16 -44.156 25.530 -25.250 134 2HA GLY 16 2HA GLY 16 -44.283 26.104 -23.591 135 H GLU 17 H GLU 17 -42.409 24.416 -25.811 136 HA GLU 17 HA GLU 17 -41.016 22.724 -23.954 137 1HB GLU 17 1HB GLU 17 -41.192 23.024 -26.785 138 2HB GLU 17 2HB GLU 17 -39.496 23.109 -26.326 139 1HG GLU 17 1HG GLU 17 -40.717 20.976 -24.900 140 2HG GLU 17 2HG GLU 17 -41.127 20.831 -26.609 141 H ASN 18 H ASN 18 -40.742 24.794 -22.594 142 HA ASN 18 HA ASN 18 -38.729 26.668 -23.234 143 1HB ASN 18 1HB ASN 18 -40.236 27.262 -21.506 144 2HB ASN 18 2HB ASN 18 -39.971 25.750 -20.648 145 1HD2 ASN 18 1HD2 ASN 18 -39.078 26.209 -18.772 146 2HD2 ASN 18 2HD2 ASN 18 -37.749 27.289 -18.516 147 H ARG 19 H ARG 19 -38.700 23.666 -21.396 148 HA ARG 19 HA ARG 19 -37.066 22.225 -20.788 149 1HB ARG 19 1HB ARG 19 -36.676 22.819 -23.445 150 2HB ARG 19 2HB ARG 19 -35.084 23.102 -22.756 151 1HG ARG 19 1HG ARG 19 -35.214 20.824 -21.728 152 2HG ARG 19 2HG ARG 19 -36.687 20.558 -22.664 153 1HD ARG 19 1HD ARG 19 -34.126 21.422 -23.962 154 2HD ARG 19 2HD ARG 19 -34.464 19.724 -23.635 155 HE ARG 19 HE ARG 19 -36.685 20.532 -24.960 156 1HH1 ARG 19 1HH1 ARG 19 -33.253 20.790 -25.654 157 2HH1 ARG 19 2HH1 ARG 19 -33.473 20.745 -27.383 158 1HH2 ARG 19 1HH2 ARG 19 -36.975 20.449 -27.212 159 2HH2 ARG 19 2HH2 ARG 19 -35.585 20.500 -28.268 160 H ASP 20 H ASP 20 -36.732 23.334 -18.819 161 HA ASP 20 HA ASP 20 -34.123 24.711 -18.693 162 1HB ASP 20 1HB ASP 20 -36.233 25.983 -17.928 163 2HB ASP 20 2HB ASP 20 -36.241 24.881 -16.555 164 H LEU 21 H LEU 21 -33.319 22.464 -18.771 165 HA LEU 21 HA LEU 21 -33.211 21.332 -16.066 166 1HB LEU 21 1HB LEU 21 -34.456 20.147 -18.346 167 2HB LEU 21 2HB LEU 21 -33.027 19.212 -17.955 168 HG LEU 21 HG LEU 21 -34.060 19.362 -15.503 169 1HD1 LEU 21 1HD1 LEU 21 -36.000 20.707 -16.718 170 2HD1 LEU 21 2HD1 LEU 21 -36.304 19.644 -15.347 171 3HD1 LEU 21 3HD1 LEU 21 -36.606 19.075 -16.988 172 1HD2 LEU 21 1HD2 LEU 21 -34.526 17.155 -15.744 173 2HD2 LEU 21 2HD2 LEU 21 -33.631 17.403 -17.244 174 3HD2 LEU 21 3HD2 LEU 21 -35.395 17.385 -17.259 175 H GLU 22 H GLU 22 -31.174 22.539 -16.100 176 HA GLU 22 HA GLU 22 -29.050 20.968 -17.397 177 1HB GLU 22 1HB GLU 22 -29.571 23.882 -17.570 178 2HB GLU 22 2HB GLU 22 -27.895 23.402 -17.339 179 1HG GLU 22 1HG GLU 22 -28.299 21.813 -19.316 180 2HG GLU 22 2HG GLU 22 -29.726 22.802 -19.625 181 H ARG 23 H ARG 23 -27.172 20.714 -16.204 182 HA ARG 23 HA ARG 23 -27.053 21.971 -13.562 183 1HB ARG 23 1HB ARG 23 -27.907 19.321 -13.948 184 2HB ARG 23 2HB ARG 23 -26.252 19.205 -13.367 185 1HG ARG 23 1HG ARG 23 -27.876 21.123 -11.884 186 2HG ARG 23 2HG ARG 23 -28.475 19.465 -11.801 187 1HD ARG 23 1HD ARG 23 -25.564 19.963 -11.393 188 2HD ARG 23 2HD ARG 23 -26.682 20.359 -10.089 189 HE ARG 23 HE ARG 23 -26.003 17.716 -11.091 190 1HH1 ARG 23 1HH1 ARG 23 -28.049 19.665 -9.010 191 2HH1 ARG 23 2HH1 ARG 23 -28.606 18.298 -8.085 192 1HH2 ARG 23 1HH2 ARG 23 -26.690 15.945 -9.833 193 2HH2 ARG 23 2HH2 ARG 23 -27.817 16.203 -8.531 194 H VAL 24 H VAL 24 -25.169 22.967 -13.542 195 HA VAL 24 HA VAL 24 -22.930 22.132 -15.135 196 HB VAL 24 HB VAL 24 -22.933 24.177 -12.908 197 1HG1 VAL 24 1HG1 VAL 24 -20.763 24.311 -13.365 198 2HG1 VAL 24 2HG1 VAL 24 -21.193 24.913 -14.966 199 3HG1 VAL 24 3HG1 VAL 24 -20.924 23.189 -14.714 200 1HG2 VAL 24 1HG2 VAL 24 -24.554 25.056 -14.283 201 2HG2 VAL 24 2HG2 VAL 24 -23.856 24.344 -15.739 202 3HG2 VAL 24 3HG2 VAL 24 -23.095 25.748 -14.990 203 H VAL 25 H VAL 25 -21.524 20.611 -14.616 204 HA VAL 25 HA VAL 25 -21.423 19.558 -11.920 205 HB VAL 25 HB VAL 25 -19.629 18.699 -14.181 206 1HG1 VAL 25 1HG1 VAL 25 -19.414 17.948 -11.701 207 2HG1 VAL 25 2HG1 VAL 25 -19.315 16.743 -12.985 208 3HG1 VAL 25 3HG1 VAL 25 -20.809 16.936 -12.072 209 1HG2 VAL 25 1HG2 VAL 25 -21.779 18.574 -15.166 210 2HG2 VAL 25 2HG2 VAL 25 -22.497 17.930 -13.690 211 3HG2 VAL 25 3HG2 VAL 25 -21.385 16.942 -14.632 212 H THR 26 H THR 26 -20.365 20.837 -10.530 213 HA THR 26 HA THR 26 -17.852 22.093 -11.335 214 HB THR 26 HB THR 26 -18.619 22.662 -8.618 215 HG1 THR 26 HG1 THR 26 -20.604 23.731 -10.210 216 1HG2 THR 26 1HG2 THR 26 -18.523 24.938 -9.368 217 2HG2 THR 26 2HG2 THR 26 -18.702 24.446 -11.054 218 3HG2 THR 26 3HG2 THR 26 -17.227 24.053 -10.169 219 H ALA 27 H ALA 27 -17.410 19.478 -11.209 220 HA ALA 27 HA ALA 27 -16.687 18.503 -8.627 221 1HB ALA 27 1HB ALA 27 -15.290 17.221 -10.816 222 2HB ALA 27 2HB ALA 27 -17.013 17.395 -11.148 223 3HB ALA 27 3HB ALA 27 -16.477 16.558 -9.692 224 HA PRO 28 HA PRO 28 -12.844 20.756 -8.440 225 1HB PRO 28 1HB PRO 28 -11.978 19.760 -6.076 226 2HB PRO 28 2HB PRO 28 -13.256 20.975 -6.186 227 1HG PRO 28 1HG PRO 28 -13.477 18.020 -5.785 228 2HG PRO 28 2HG PRO 28 -14.389 19.330 -5.010 229 1HD PRO 28 1HD PRO 28 -15.367 17.839 -7.072 230 2HD PRO 28 2HD PRO 28 -15.851 19.517 -6.769 231 H VAL 29 H VAL 29 -10.726 20.357 -8.924 232 HA VAL 29 HA VAL 29 -10.093 17.650 -9.784 233 HB VAL 29 HB VAL 29 -8.425 20.160 -10.045 234 1HG1 VAL 29 1HG1 VAL 29 -6.924 18.972 -11.244 235 2HG1 VAL 29 2HG1 VAL 29 -8.162 17.952 -11.981 236 3HG1 VAL 29 3HG1 VAL 29 -7.592 17.608 -10.348 237 1HG2 VAL 29 1HG2 VAL 29 -9.469 20.685 -12.002 238 2HG2 VAL 29 2HG2 VAL 29 -10.822 19.928 -11.164 239 3HG2 VAL 29 3HG2 VAL 29 -9.898 19.012 -12.352 240 H SER 30 H SER 30 -9.234 16.291 -8.372 241 HA SER 30 HA SER 30 -7.940 17.161 -5.978 242 1HB SER 30 1HB SER 30 -7.531 14.357 -6.728 243 2HB SER 30 2HB SER 30 -8.294 15.035 -5.291 244 HG SER 30 HG SER 30 -9.426 14.083 -7.594 245 H SER 31 H SER 31 -5.855 17.579 -5.657 246 HA SER 31 HA SER 31 -4.023 17.600 -7.806 247 1HB SER 31 1HB SER 31 -2.591 17.765 -5.366 248 2HB SER 31 2HB SER 31 -3.084 19.087 -6.423 249 HG SER 31 HG SER 31 -4.335 18.070 -4.116 250 H GLY 32 H GLY 32 -2.151 16.378 -8.149 251 1HA GLY 32 1HA GLY 32 -2.197 13.729 -6.841 252 2HA GLY 32 2HA GLY 32 -1.725 13.988 -8.514 253 H LYS 33 H LYS 33 -0.850 15.114 -5.243 254 HA LYS 33 HA LYS 33 1.878 15.566 -6.113 255 1HB LYS 33 1HB LYS 33 0.263 16.202 -3.713 256 2HB LYS 33 2HB LYS 33 1.988 15.974 -3.451 257 1HG LYS 33 1HG LYS 33 0.714 17.926 -5.356 258 2HG LYS 33 2HG LYS 33 1.494 18.309 -3.819 259 1HD LYS 33 1HD LYS 33 3.621 17.468 -4.692 260 2HD LYS 33 2HD LYS 33 2.839 17.080 -6.225 261 1HE LYS 33 1HE LYS 33 3.792 19.125 -6.692 262 2HE LYS 33 2HE LYS 33 2.163 19.593 -6.201 263 1HZ LYS 33 1HZ LYS 33 3.605 21.027 -5.070 264 2HZ LYS 33 2HZ LYS 33 4.667 19.776 -4.634 265 3HZ LYS 33 3HZ LYS 33 3.140 19.883 -3.906 266 H ILE 34 H ILE 34 0.219 12.894 -5.314 267 HA ILE 34 HA ILE 34 2.632 11.603 -4.253 268 HB ILE 34 HB ILE 34 0.363 11.708 -2.828 269 1HG1 ILE 34 1HG1 ILE 34 1.353 9.100 -2.350 270 2HG1 ILE 34 2HG1 ILE 34 2.718 10.075 -2.888 271 1HG2 ILE 34 1HG2 ILE 34 -1.281 10.425 -3.570 272 2HG2 ILE 34 2HG2 ILE 34 -0.231 9.018 -3.435 273 3HG2 ILE 34 3HG2 ILE 34 -0.301 9.923 -4.945 274 1HD1 ILE 34 1HD1 ILE 34 2.752 11.287 -1.006 275 2HD1 ILE 34 2HD1 ILE 34 1.877 9.911 -0.338 276 3HD1 ILE 34 3HD1 ILE 34 0.994 11.339 -0.877 277 H LYS 35 H LYS 35 3.059 9.501 -5.049 278 HA LYS 35 HA LYS 35 1.762 8.922 -7.631 279 1HB LYS 35 1HB LYS 35 4.651 8.362 -6.936 280 2HB LYS 35 2HB LYS 35 3.888 8.258 -8.518 281 1HG LYS 35 1HG LYS 35 3.690 10.902 -7.301 282 2HG LYS 35 2HG LYS 35 5.348 10.371 -7.594 283 1HD LYS 35 1HD LYS 35 4.800 11.396 -9.601 284 2HD LYS 35 2HD LYS 35 4.444 9.700 -9.933 285 1HE LYS 35 1HE LYS 35 2.647 11.099 -10.755 286 2HE LYS 35 2HE LYS 35 2.082 10.102 -9.414 287 1HZ LYS 35 1HZ LYS 35 3.095 12.744 -8.714 288 2HZ LYS 35 2HZ LYS 35 1.762 11.890 -8.101 289 3HZ LYS 35 3HZ LYS 35 1.632 12.711 -9.577 290 H ARG 36 H ARG 36 1.113 6.857 -7.980 291 HA ARG 36 HA ARG 36 1.529 4.975 -5.748 292 1HB ARG 36 1HB ARG 36 -0.541 4.439 -7.812 293 2HB ARG 36 2HB ARG 36 -0.574 4.123 -6.084 294 1HG ARG 36 1HG ARG 36 -1.852 5.902 -5.813 295 2HG ARG 36 2HG ARG 36 -0.533 6.920 -6.395 296 1HD ARG 36 1HD ARG 36 -2.960 6.774 -7.572 297 2HD ARG 36 2HD ARG 36 -1.478 7.204 -8.423 298 HE ARG 36 HE ARG 36 -2.156 4.373 -8.344 299 1HH1 ARG 36 1HH1 ARG 36 -2.312 7.387 -10.118 300 2HH1 ARG 36 2HH1 ARG 36 -2.515 6.619 -11.670 301 1HH2 ARG 36 1HH2 ARG 36 -2.400 3.349 -10.381 302 2HH2 ARG 36 2HH2 ARG 36 -2.553 4.320 -11.816 303 H VAL 37 H VAL 37 3.027 3.505 -6.118 304 HA VAL 37 HA VAL 37 3.319 2.467 -8.860 305 HB VAL 37 HB VAL 37 5.496 2.642 -6.768 306 1HG1 VAL 37 1HG1 VAL 37 5.545 0.817 -8.591 307 2HG1 VAL 37 2HG1 VAL 37 6.985 1.801 -8.341 308 3HG1 VAL 37 3HG1 VAL 37 5.905 2.147 -9.693 309 1HG2 VAL 37 1HG2 VAL 37 5.586 4.235 -9.269 310 2HG2 VAL 37 2HG2 VAL 37 6.252 4.589 -7.674 311 3HG2 VAL 37 3HG2 VAL 37 4.525 4.792 -7.977 312 H ASN 38 H ASN 38 3.473 0.289 -9.153 313 HA ASN 38 HA ASN 38 2.841 -1.367 -6.806 314 1HB ASN 38 1HB ASN 38 1.120 -1.926 -8.190 315 2HB ASN 38 2HB ASN 38 1.978 -1.414 -9.636 316 1HD2 ASN 38 1HD2 ASN 38 1.287 -4.048 -7.492 317 2HD2 ASN 38 2HD2 ASN 38 1.974 -5.295 -8.476 318 H VAL 39 H VAL 39 4.342 -2.699 -6.084 319 HA VAL 39 HA VAL 39 6.695 -3.185 -7.783 320 HB VAL 39 HB VAL 39 6.955 -3.747 -4.911 321 1HG1 VAL 39 1HG1 VAL 39 9.109 -3.378 -5.351 322 2HG1 VAL 39 2HG1 VAL 39 8.775 -1.848 -6.159 323 3HG1 VAL 39 3HG1 VAL 39 8.630 -3.363 -7.047 324 1HG2 VAL 39 1HG2 VAL 39 6.462 -0.937 -5.883 325 2HG2 VAL 39 2HG2 VAL 39 7.245 -1.327 -4.349 326 3HG2 VAL 39 3HG2 VAL 39 5.577 -1.820 -4.637 327 H ASN 40 H ASN 40 7.846 -5.228 -7.365 328 HA ASN 40 HA ASN 40 6.008 -7.411 -6.654 329 1HB ASN 40 1HB ASN 40 7.596 -8.796 -8.205 330 2HB ASN 40 2HB ASN 40 6.324 -7.817 -8.927 331 1HD2 ASN 40 1HD2 ASN 40 6.881 -5.913 -10.016 332 2HD2 ASN 40 2HD2 ASN 40 8.502 -5.619 -10.564 333 H PHE 41 H PHE 41 6.573 -8.239 -4.794 334 HA PHE 41 HA PHE 41 9.379 -8.071 -3.926 335 1HB PHE 41 1HB PHE 41 6.748 -8.142 -2.502 336 2HB PHE 41 2HB PHE 41 8.161 -8.779 -1.676 337 HD1 PHE 41 HD1 PHE 41 9.048 -6.148 -3.894 338 HD2 PHE 41 HD2 PHE 41 7.425 -6.962 -0.046 339 HE1 PHE 41 HE1 PHE 41 9.636 -3.869 -3.168 340 HE2 PHE 41 HE2 PHE 41 8.000 -4.688 0.686 341 HZ PHE 41 HZ PHE 41 9.098 -3.138 -0.875 342 H ASP 42 H ASP 42 10.564 -9.866 -3.601 343 HA ASP 42 HA ASP 42 9.649 -12.424 -4.395 344 1HB ASP 42 1HB ASP 42 12.036 -11.736 -4.377 345 2HB ASP 42 2HB ASP 42 12.004 -11.750 -2.620 346 H GLU 43 H GLU 43 9.214 -14.277 -3.118 347 HA GLU 43 HA GLU 43 7.444 -13.850 -1.038 348 1HB GLU 43 1HB GLU 43 8.559 -16.114 -2.417 349 2HB GLU 43 2HB GLU 43 8.415 -16.464 -0.699 350 1HG GLU 43 1HG GLU 43 6.108 -15.217 -2.101 351 2HG GLU 43 2HG GLU 43 6.440 -16.930 -2.359 352 H GLU 44 H GLU 44 10.905 -14.442 -0.915 353 HA GLU 44 HA GLU 44 11.156 -14.967 1.850 354 1HB GLU 44 1HB GLU 44 12.919 -14.970 -0.137 355 2HB GLU 44 2HB GLU 44 13.206 -13.324 0.431 356 1HG GLU 44 1HG GLU 44 14.243 -14.012 2.298 357 2HG GLU 44 2HG GLU 44 13.155 -15.381 2.527 358 H LYS 45 H LYS 45 11.310 -11.982 -0.005 359 HA LYS 45 HA LYS 45 11.781 -10.239 2.135 360 1HB LYS 45 1HB LYS 45 10.371 -9.636 -0.471 361 2HB LYS 45 2HB LYS 45 11.170 -8.472 0.585 362 1HG LYS 45 1HG LYS 45 13.241 -10.040 0.174 363 2HG LYS 45 2HG LYS 45 12.337 -10.458 -1.278 364 1HD LYS 45 1HD LYS 45 12.866 -8.534 -2.263 365 2HD LYS 45 2HD LYS 45 12.377 -7.603 -0.846 366 1HE LYS 45 1HE LYS 45 14.503 -7.223 -0.342 367 2HE LYS 45 2HE LYS 45 14.802 -8.956 -0.242 368 1HZ LYS 45 1HZ LYS 45 14.750 -7.622 -2.871 369 2HZ LYS 45 2HZ LYS 45 15.541 -9.049 -2.409 370 3HZ LYS 45 3HZ LYS 45 16.147 -7.548 -1.909 371 H HIS 46 H HIS 46 8.844 -11.640 0.875 372 HA HIS 46 HA HIS 46 7.212 -9.800 2.399 373 1HB HIS 46 1HB HIS 46 6.712 -11.152 0.097 374 2HB HIS 46 2HB HIS 46 5.841 -12.130 1.279 375 HD1 HIS 46 HD1 HIS 46 3.594 -11.297 1.969 376 HD2 HIS 46 HD2 HIS 46 5.929 -8.302 0.244 377 HE1 HIS 46 HE1 HIS 46 2.123 -9.255 1.857 378 HE2 HIS 46 HE2 HIS 46 3.582 -7.432 0.910 379 H THR 47 H THR 47 8.323 -13.112 2.684 380 HA THR 47 HA THR 47 6.651 -13.833 4.874 381 HB THR 47 HB THR 47 9.418 -14.908 4.299 382 HG1 THR 47 HG1 THR 47 8.320 -15.237 2.411 383 1HG2 THR 47 1HG2 THR 47 7.029 -16.251 5.561 384 2HG2 THR 47 2HG2 THR 47 8.354 -15.523 6.471 385 3HG2 THR 47 3HG2 THR 47 8.661 -16.901 5.413 386 H ARG 48 H ARG 48 9.884 -12.445 4.587 387 HA ARG 48 HA ARG 48 10.420 -12.162 7.357 388 1HB ARG 48 1HB ARG 48 11.986 -11.863 5.287 389 2HB ARG 48 2HB ARG 48 11.379 -10.212 5.296 390 1HG ARG 48 1HG ARG 48 13.206 -9.921 6.586 391 2HG ARG 48 2HG ARG 48 12.054 -10.367 7.848 392 1HD ARG 48 1HD ARG 48 13.373 -12.059 8.402 393 2HD ARG 48 2HD ARG 48 13.078 -12.767 6.814 394 HE ARG 48 HE ARG 48 15.146 -12.027 6.104 395 1HH1 ARG 48 1HH1 ARG 48 14.389 -10.787 9.289 396 2HH1 ARG 48 2HH1 ARG 48 15.967 -10.093 9.541 397 1HH2 ARG 48 1HH2 ARG 48 17.244 -11.161 6.451 398 2HH2 ARG 48 2HH2 ARG 48 17.582 -10.305 7.924 399 H PHE 49 H PHE 49 8.882 -10.116 4.932 400 HA PHE 49 HA PHE 49 8.545 -7.774 6.335 401 1HB PHE 49 1HB PHE 49 7.436 -8.972 4.000 402 2HB PHE 49 2HB PHE 49 6.121 -8.268 4.929 403 HD1 PHE 49 HD1 PHE 49 9.574 -6.986 4.828 404 HD2 PHE 49 HD2 PHE 49 5.566 -6.497 3.487 405 HE1 PHE 49 HE1 PHE 49 10.144 -4.761 3.950 406 HE2 PHE 49 HE2 PHE 49 6.130 -4.281 2.590 407 HZ PHE 49 HZ PHE 49 8.425 -3.403 2.832 408 H LYS 50 H LYS 50 6.248 -10.495 6.202 409 HA LYS 50 HA LYS 50 4.391 -9.488 8.002 410 1HB LYS 50 1HB LYS 50 5.150 -12.394 7.666 411 2HB LYS 50 2HB LYS 50 3.627 -11.776 8.291 412 1HG LYS 50 1HG LYS 50 4.277 -10.750 5.644 413 2HG LYS 50 2HG LYS 50 4.123 -12.506 5.694 414 1HD LYS 50 1HD LYS 50 2.049 -10.901 7.088 415 2HD LYS 50 2HD LYS 50 2.033 -10.902 5.322 416 1HE LYS 50 1HE LYS 50 0.865 -12.798 5.478 417 2HE LYS 50 2HE LYS 50 2.381 -13.561 5.951 418 1HZ LYS 50 1HZ LYS 50 1.825 -13.489 8.180 419 2HZ LYS 50 2HZ LYS 50 0.337 -13.853 7.451 420 3HZ LYS 50 3HZ LYS 50 0.660 -12.271 7.971 421 H ALA 51 H ALA 51 7.222 -11.554 8.671 422 HA ALA 51 HA ALA 51 6.756 -11.727 11.456 423 1HB ALA 51 1HB ALA 51 8.250 -13.162 9.890 424 2HB ALA 51 2HB ALA 51 8.715 -12.928 11.575 425 3HB ALA 51 3HB ALA 51 9.496 -11.983 10.308 426 H ALA 52 H ALA 52 9.255 -9.857 9.721 427 HA ALA 52 HA ALA 52 10.345 -8.578 11.947 428 1HB ALA 52 1HB ALA 52 10.756 -8.574 9.189 429 2HB ALA 52 2HB ALA 52 11.758 -7.823 10.430 430 3HB ALA 52 3HB ALA 52 10.490 -6.890 9.636 431 H CYS 53 H CYS 53 7.898 -7.318 9.659 432 HA CYS 53 HA CYS 53 7.615 -4.853 10.979 433 1HB CYS 53 1HB CYS 53 5.500 -6.140 9.271 434 2HB CYS 53 2HB CYS 53 5.807 -4.421 9.511 435 HG CYS 53 HG CYS 53 7.382 -6.624 7.508 436 H ALA 54 H ALA 54 5.988 -7.953 11.455 437 HA ALA 54 HA ALA 54 3.857 -6.995 13.040 438 1HB ALA 54 1HB ALA 54 3.344 -9.159 13.398 439 2HB ALA 54 2HB ALA 54 5.005 -9.599 13.791 440 3HB ALA 54 3HB ALA 54 4.515 -9.427 12.107 441 H ARG 55 H ARG 55 7.153 -7.975 13.843 442 HA ARG 55 HA ARG 55 6.923 -7.684 16.651 443 1HB ARG 55 1HB ARG 55 8.747 -8.938 15.654 444 2HB ARG 55 2HB ARG 55 9.329 -7.498 14.829 445 1HG ARG 55 1HG ARG 55 9.475 -6.563 17.288 446 2HG ARG 55 2HG ARG 55 9.564 -8.282 17.684 447 1HD ARG 55 1HD ARG 55 11.753 -8.092 17.291 448 2HD ARG 55 2HD ARG 55 11.311 -8.060 15.584 449 HE ARG 55 HE ARG 55 11.606 -5.586 17.176 450 1HH1 ARG 55 1HH1 ARG 55 12.254 -7.502 14.314 451 2HH1 ARG 55 2HH1 ARG 55 13.191 -6.259 13.527 452 1HH2 ARG 55 1HH2 ARG 55 12.832 -3.935 16.145 453 2HH2 ARG 55 2HH2 ARG 55 13.530 -4.235 14.577 454 H LYS 56 H LYS 56 7.916 -5.466 14.081 455 HA LYS 56 HA LYS 56 8.580 -3.352 15.889 456 1HB LYS 56 1HB LYS 56 8.297 -3.550 12.904 457 2HB LYS 56 2HB LYS 56 8.584 -2.003 13.689 458 1HG LYS 56 1HG LYS 56 10.724 -2.516 14.231 459 2HG LYS 56 2HG LYS 56 10.383 -4.241 14.401 460 1HD LYS 56 1HD LYS 56 11.641 -4.193 12.466 461 2HD LYS 56 2HD LYS 56 9.996 -4.143 11.830 462 1HE LYS 56 1HE LYS 56 10.825 -2.411 10.641 463 2HE LYS 56 2HE LYS 56 10.442 -1.518 12.113 464 1HZ LYS 56 1HZ LYS 56 13.089 -2.744 11.599 465 2HZ LYS 56 2HZ LYS 56 12.679 -1.637 12.820 466 3HZ LYS 56 3HZ LYS 56 12.712 -1.135 11.199 467 H GLY 57 H GLY 57 5.672 -4.426 14.420 468 1HA GLY 57 1HA GLY 57 3.504 -3.663 14.808 469 2HA GLY 57 2HA GLY 57 4.170 -2.280 15.671 470 H THR 58 H THR 58 4.671 -3.513 12.384 471 HA THR 58 HA THR 58 3.954 -0.834 11.381 472 HB THR 58 HB THR 58 5.791 -2.693 9.913 473 HG1 THR 58 HG1 THR 58 6.281 -1.382 12.301 474 1HG2 THR 58 1HG2 THR 58 5.495 0.305 10.056 475 2HG2 THR 58 2HG2 THR 58 5.039 -0.743 8.714 476 3HG2 THR 58 3HG2 THR 58 6.738 -0.535 9.131 477 H SER 59 H SER 59 2.393 -0.689 9.907 478 HA SER 59 HA SER 59 0.972 -3.004 8.985 479 1HB SER 59 1HB SER 59 0.548 -0.442 7.579 480 2HB SER 59 2HB SER 59 -0.625 -1.520 8.336 481 HG SER 59 HG SER 59 0.273 -0.702 10.393 482 H ILE 60 H ILE 60 0.982 -3.928 6.974 483 HA ILE 60 HA ILE 60 3.361 -4.243 5.716 484 HB ILE 60 HB ILE 60 0.850 -5.319 5.418 485 1HG1 ILE 60 1HG1 ILE 60 2.076 -6.848 3.752 486 2HG1 ILE 60 2HG1 ILE 60 3.471 -5.809 4.027 487 1HG2 ILE 60 1HG2 ILE 60 0.046 -5.160 3.283 488 2HG2 ILE 60 2HG2 ILE 60 1.605 -4.679 2.611 489 3HG2 ILE 60 3HG2 ILE 60 0.641 -3.517 3.527 490 1HD1 ILE 60 1HD1 ILE 60 3.957 -7.181 5.707 491 2HD1 ILE 60 2HD1 ILE 60 2.349 -7.907 5.687 492 3HD1 ILE 60 3HD1 ILE 60 2.629 -6.409 6.574 493 H THR 61 H THR 61 0.988 -1.754 4.916 494 HA THR 61 HA THR 61 2.406 -0.937 2.536 495 HB THR 61 HB THR 61 0.211 0.479 4.071 496 HG1 THR 61 HG1 THR 61 -0.666 -0.361 1.744 497 1HG2 THR 61 1HG2 THR 61 1.387 1.018 1.345 498 2HG2 THR 61 2HG2 THR 61 1.436 2.081 2.749 499 3HG2 THR 61 3HG2 THR 61 -0.099 1.745 1.951 500 H ASP 62 H ASP 62 2.162 0.097 5.880 501 HA ASP 62 HA ASP 62 3.586 2.510 5.697 502 1HB ASP 62 1HB ASP 62 2.177 1.686 7.640 503 2HB ASP 62 2HB ASP 62 3.558 0.699 8.107 504 H VAL 63 H VAL 63 4.684 -0.818 6.003 505 HA VAL 63 HA VAL 63 7.335 -0.323 6.774 506 HB VAL 63 HB VAL 63 6.811 -2.505 4.810 507 1HG1 VAL 63 1HG1 VAL 63 8.572 -3.527 5.822 508 2HG1 VAL 63 2HG1 VAL 63 8.194 -2.855 7.408 509 3HG1 VAL 63 3HG1 VAL 63 8.979 -1.850 6.191 510 1HG2 VAL 63 1HG2 VAL 63 5.049 -2.118 6.898 511 2HG2 VAL 63 2HG2 VAL 63 6.205 -3.290 7.533 512 3HG2 VAL 63 3HG2 VAL 63 5.335 -3.630 6.034 513 H VAL 64 H VAL 64 6.029 -0.837 3.500 514 HA VAL 64 HA VAL 64 8.404 -0.373 2.122 515 HB VAL 64 HB VAL 64 5.837 0.507 0.888 516 1HG1 VAL 64 1HG1 VAL 64 7.185 0.427 -0.881 517 2HG1 VAL 64 2HG1 VAL 64 7.171 -1.329 -0.723 518 3HG1 VAL 64 3HG1 VAL 64 8.449 -0.386 0.043 519 1HG2 VAL 64 1HG2 VAL 64 5.388 -1.548 2.306 520 2HG2 VAL 64 2HG2 VAL 64 6.480 -2.412 1.223 521 3HG2 VAL 64 3HG2 VAL 64 5.006 -1.680 0.588 522 H ASN 65 H ASN 65 5.937 1.837 3.284 523 HA ASN 65 HA ASN 65 6.925 4.190 2.061 524 1HB ASN 65 1HB ASN 65 4.663 3.787 3.240 525 2HB ASN 65 2HB ASN 65 5.532 4.137 4.732 526 1HD2 ASN 65 1HD2 ASN 65 4.857 5.450 1.517 527 2HD2 ASN 65 2HD2 ASN 65 4.852 7.110 2.004 528 H GLN 66 H GLN 66 7.666 2.543 5.087 529 HA GLN 66 HA GLN 66 9.341 4.542 6.184 530 1HB GLN 66 1HB GLN 66 8.412 1.978 6.926 531 2HB GLN 66 2HB GLN 66 10.169 1.920 6.993 532 1HG GLN 66 1HG GLN 66 10.203 3.080 8.878 533 2HG GLN 66 2HG GLN 66 9.175 4.334 8.198 534 1HE2 GLN 66 1HE2 GLN 66 6.867 3.928 8.190 535 2HE2 GLN 66 2HE2 GLN 66 6.167 2.996 9.471 536 H LEU 67 H LEU 67 10.175 1.472 4.537 537 HA LEU 67 HA LEU 67 12.935 1.972 4.588 538 1HB LEU 67 1HB LEU 67 12.871 0.275 2.553 539 2HB LEU 67 2HB LEU 67 12.655 -0.232 4.214 540 HG LEU 67 HG LEU 67 10.076 0.344 3.319 541 1HD1 LEU 67 1HD1 LEU 67 10.382 -1.517 1.343 542 2HD1 LEU 67 2HD1 LEU 67 11.796 -0.490 1.110 543 3HD1 LEU 67 3HD1 LEU 67 10.180 0.216 1.089 544 1HD2 LEU 67 1HD2 LEU 67 10.137 -1.456 4.681 545 2HD2 LEU 67 2HD2 LEU 67 11.689 -2.012 4.057 546 3HD2 LEU 67 3HD2 LEU 67 10.209 -2.336 3.156 547 H VAL 68 H VAL 68 10.503 2.801 2.151 548 HA VAL 68 HA VAL 68 12.372 3.589 0.168 549 HB VAL 68 HB VAL 68 9.916 3.204 -0.238 550 1HG1 VAL 68 1HG1 VAL 68 8.472 4.352 0.976 551 2HG1 VAL 68 2HG1 VAL 68 8.839 5.713 -0.083 552 3HG1 VAL 68 3HG1 VAL 68 9.690 5.533 1.453 553 1HG2 VAL 68 1HG2 VAL 68 9.780 4.847 -2.029 554 2HG2 VAL 68 2HG2 VAL 68 11.392 4.137 -1.925 555 3HG2 VAL 68 3HG2 VAL 68 11.098 5.755 -1.289 556 H ASP 69 H ASP 69 10.877 5.239 2.873 557 HA ASP 69 HA ASP 69 11.920 7.825 2.315 558 1HB ASP 69 1HB ASP 69 10.130 6.921 4.097 559 2HB ASP 69 2HB ASP 69 11.545 6.979 5.144 560 H ASN 70 H ASN 70 13.045 5.103 4.245 561 HA ASN 70 HA ASN 70 15.338 6.276 5.326 562 1HB ASN 70 1HB ASN 70 14.125 3.949 5.743 563 2HB ASN 70 2HB ASN 70 15.365 3.375 4.636 564 1HD2 ASN 70 1HD2 ASN 70 14.880 2.932 7.530 565 2HD2 ASN 70 2HD2 ASN 70 16.384 3.336 8.297 566 H TRP 71 H TRP 71 15.168 4.003 2.577 567 HA TRP 71 HA TRP 71 17.863 4.193 1.901 568 1HB TRP 71 1HB TRP 71 16.340 2.392 1.117 569 2HB TRP 71 2HB TRP 71 15.577 3.545 0.027 570 HD1 TRP 71 HD1 TRP 71 18.968 1.789 0.580 571 HE1 TRP 71 HE1 TRP 71 20.225 1.749 -1.667 572 HE3 TRP 71 HE3 TRP 71 15.690 4.510 -2.256 573 HZ2 TRP 71 HZ2 TRP 71 19.876 2.715 -4.275 574 HZ3 TRP 71 HZ3 TRP 71 16.220 4.885 -4.627 575 HH2 TRP 71 HH2 TRP 71 18.271 3.999 -5.619 576 H LEU 72 H LEU 72 15.094 5.999 0.598 577 HA LEU 72 HA LEU 72 16.536 7.294 -1.432 578 1HB LEU 72 1HB LEU 72 13.898 7.222 -0.580 579 2HB LEU 72 2HB LEU 72 14.363 8.898 -0.378 580 HG LEU 72 HG LEU 72 14.266 9.299 -2.579 581 1HD1 LEU 72 1HD1 LEU 72 16.179 7.150 -2.626 582 2HD1 LEU 72 2HD1 LEU 72 16.016 8.534 -3.705 583 3HD1 LEU 72 3HD1 LEU 72 15.107 7.059 -4.020 584 1HD2 LEU 72 1HD2 LEU 72 13.209 6.955 -3.687 585 2HD2 LEU 72 2HD2 LEU 72 12.326 8.367 -3.102 586 3HD2 LEU 72 3HD2 LEU 72 12.636 7.008 -2.018 587 H LYS 73 H LYS 73 15.969 8.191 1.930 588 HA LYS 73 HA LYS 73 17.132 10.798 1.527 589 1HB LYS 73 1HB LYS 73 16.113 9.367 3.973 590 2HB LYS 73 2HB LYS 73 16.845 10.966 4.042 591 1HG LYS 73 1HG LYS 73 15.119 11.795 2.477 592 2HG LYS 73 2HG LYS 73 14.366 10.197 2.504 593 1HD LYS 73 1HD LYS 73 13.613 10.445 4.664 594 2HD LYS 73 2HD LYS 73 14.882 11.595 5.089 595 1HE LYS 73 1HE LYS 73 13.430 13.242 4.754 596 2HE LYS 73 2HE LYS 73 13.388 12.806 3.048 597 1HZ LYS 73 1HZ LYS 73 11.664 11.074 3.812 598 2HZ LYS 73 2HZ LYS 73 11.187 12.696 3.674 599 3HZ LYS 73 3HZ LYS 73 11.524 12.043 5.198 600 H GLU 74 H GLU 74 18.339 7.692 2.313 601 HA GLU 74 HA GLU 74 20.739 8.801 3.559 602 1HB GLU 74 1HB GLU 74 19.767 5.981 3.149 603 2HB GLU 74 2HB GLU 74 21.383 6.344 3.736 604 1HG GLU 74 1HG GLU 74 18.753 6.703 5.075 605 2HG GLU 74 2HG GLU 74 20.246 6.003 5.693 606 H ASN 75 H ASN 75 19.924 6.664 0.833 607 HA ASN 75 HA ASN 75 22.557 6.647 -0.221 608 1HB ASN 75 1HB ASN 75 21.770 4.961 -1.440 609 2HB ASN 75 2HB ASN 75 20.213 5.209 -0.660 610 1HD2 ASN 75 1HD2 ASN 75 18.592 6.259 -1.749 611 2HD2 ASN 75 2HD2 ASN 75 18.642 6.500 -3.456 612 H GLU 76 H GLU 76 19.824 8.744 -0.701 613 HA GLU 76 HA GLU 76 21.339 10.171 -2.777 614 1HB GLU 76 1HB GLU 76 18.615 9.268 -2.726 615 2HB GLU 76 2HB GLU 76 18.639 11.025 -2.803 616 1HG GLU 76 1HG GLU 76 20.411 9.518 -4.650 617 2HG GLU 76 2HG GLU 76 18.677 9.530 -4.971 618 1H MET 1 1H MET 1 -49.161 -55.991 -52.979 619 2H MET 1 2H MET 1 -47.832 -56.725 -53.736 620 3H MET 1 3H MET 1 -49.201 -57.646 -53.349 621 HA MET 1 HA MET 1 -48.858 -55.633 -55.470 622 1HB MET 1 1HB MET 1 -48.399 -58.090 -55.797 623 2HB MET 1 2HB MET 1 -50.103 -58.386 -55.481 624 1HG MET 1 1HG MET 1 -50.193 -56.471 -57.432 625 2HG MET 1 2HG MET 1 -48.780 -57.422 -57.889 626 1HE MET 1 1HE MET 1 -53.111 -58.183 -58.003 627 2HE MET 1 2HE MET 1 -52.336 -57.670 -59.504 628 3HE MET 1 3HE MET 1 -52.116 -56.728 -58.029 629 H SER 2 H SER 2 -51.233 -57.138 -53.334 630 HA SER 2 HA SER 2 -53.486 -56.092 -54.727 631 1HB SER 2 1HB SER 2 -53.938 -56.755 -51.916 632 2HB SER 2 2HB SER 2 -54.661 -57.446 -53.368 633 HG SER 2 HG SER 2 -53.234 -58.844 -51.996 634 H LEU 3 H LEU 3 -52.491 -55.386 -51.363 635 HA LEU 3 HA LEU 3 -53.232 -52.578 -51.864 636 1HB LEU 3 1HB LEU 3 -54.537 -54.357 -50.158 637 2HB LEU 3 2HB LEU 3 -53.539 -53.379 -49.097 638 HG LEU 3 HG LEU 3 -54.568 -51.335 -50.121 639 1HD1 LEU 3 1HD1 LEU 3 -56.402 -51.459 -51.559 640 2HD1 LEU 3 2HD1 LEU 3 -56.642 -53.179 -51.252 641 3HD1 LEU 3 3HD1 LEU 3 -55.261 -52.639 -52.210 642 1HD2 LEU 3 1HD2 LEU 3 -55.347 -52.399 -47.990 643 2HD2 LEU 3 2HD2 LEU 3 -56.600 -53.211 -48.929 644 3HD2 LEU 3 3HD2 LEU 3 -56.570 -51.451 -48.834 645 H GLU 4 H GLU 4 -51.370 -51.506 -51.903 646 HA GLU 4 HA GLU 4 -49.369 -52.127 -49.832 647 1HB GLU 4 1HB GLU 4 -49.003 -52.012 -52.548 648 2HB GLU 4 2HB GLU 4 -48.516 -50.398 -52.045 649 1HG GLU 4 1HG GLU 4 -46.585 -51.792 -52.081 650 2HG GLU 4 2HG GLU 4 -46.981 -51.437 -50.400 651 H LYS 5 H LYS 5 -48.674 -50.576 -48.478 652 HA LYS 5 HA LYS 5 -50.330 -48.288 -48.121 653 1HB LYS 5 1HB LYS 5 -48.002 -49.502 -46.738 654 2HB LYS 5 2HB LYS 5 -48.282 -47.789 -46.455 655 1HG LYS 5 1HG LYS 5 -49.940 -48.225 -45.055 656 2HG LYS 5 2HG LYS 5 -50.742 -49.260 -46.236 657 1HD LYS 5 1HD LYS 5 -49.933 -51.155 -45.312 658 2HD LYS 5 2HD LYS 5 -48.362 -50.429 -44.957 659 1HE LYS 5 1HE LYS 5 -48.969 -49.843 -42.869 660 2HE LYS 5 2HE LYS 5 -50.587 -49.358 -43.376 661 1HZ LYS 5 1HZ LYS 5 -49.944 -51.607 -41.958 662 2HZ LYS 5 2HZ LYS 5 -50.228 -52.191 -43.525 663 3HZ LYS 5 3HZ LYS 5 -51.424 -51.296 -42.724 664 H ALA 6 H ALA 6 -46.950 -48.732 -49.116 665 HA ALA 6 HA ALA 6 -45.458 -47.389 -50.172 666 1HB ALA 6 1HB ALA 6 -48.032 -46.850 -51.458 667 2HB ALA 6 2HB ALA 6 -46.461 -47.228 -52.168 668 3HB ALA 6 3HB ALA 6 -46.830 -45.576 -51.675 669 H HIS 7 H HIS 7 -45.698 -46.687 -47.654 670 HA HIS 7 HA HIS 7 -46.215 -43.813 -47.535 671 1HB HIS 7 1HB HIS 7 -46.200 -46.018 -45.563 672 2HB HIS 7 2HB HIS 7 -45.606 -44.465 -44.986 673 HD1 HIS 7 HD1 HIS 7 -48.242 -45.691 -43.909 674 HD2 HIS 7 HD2 HIS 7 -48.012 -42.950 -47.035 675 HE1 HIS 7 HE1 HIS 7 -50.500 -44.584 -44.015 676 HE2 HIS 7 HE2 HIS 7 -50.289 -42.833 -45.817 677 H THR 8 H THR 8 -44.640 -42.410 -47.593 678 HA THR 8 HA THR 8 -41.930 -43.240 -46.806 679 HB THR 8 HB THR 8 -42.087 -41.243 -48.980 680 HG1 THR 8 HG1 THR 8 -43.589 -42.603 -49.883 681 1HG2 THR 8 1HG2 THR 8 -40.451 -43.767 -48.787 682 2HG2 THR 8 2HG2 THR 8 -39.998 -42.264 -47.982 683 3HG2 THR 8 3HG2 THR 8 -40.115 -42.323 -49.741 684 H SER 9 H SER 9 -44.038 -41.849 -45.404 685 HA SER 9 HA SER 9 -43.382 -39.048 -45.379 686 1HB SER 9 1HB SER 9 -44.962 -40.075 -43.140 687 2HB SER 9 2HB SER 9 -45.372 -38.844 -44.333 688 HG SER 9 HG SER 9 -46.135 -41.427 -44.218 689 H VAL 10 H VAL 10 -41.050 -39.909 -44.938 690 HA VAL 10 HA VAL 10 -40.625 -40.044 -42.030 691 HB VAL 10 HB VAL 10 -38.200 -40.687 -42.879 692 1HG1 VAL 10 1HG1 VAL 10 -40.251 -42.850 -43.086 693 2HG1 VAL 10 2HG1 VAL 10 -40.007 -42.003 -41.556 694 3HG1 VAL 10 3HG1 VAL 10 -38.669 -42.872 -42.307 695 1HG2 VAL 10 1HG2 VAL 10 -38.632 -40.431 -45.245 696 2HG2 VAL 10 2HG2 VAL 10 -39.969 -41.576 -45.157 697 3HG2 VAL 10 3HG2 VAL 10 -38.316 -42.128 -44.883 698 H LYS 11 H LYS 11 -39.641 -38.393 -41.048 699 HA LYS 11 HA LYS 11 -39.127 -35.992 -42.477 700 1HB LYS 11 1HB LYS 11 -39.181 -36.865 -39.700 701 2HB LYS 11 2HB LYS 11 -37.899 -35.702 -40.008 702 1HG LYS 11 1HG LYS 11 -39.711 -34.389 -39.383 703 2HG LYS 11 2HG LYS 11 -39.706 -34.291 -41.145 704 1HD LYS 11 1HD LYS 11 -41.388 -36.153 -41.155 705 2HD LYS 11 2HD LYS 11 -41.494 -35.979 -39.403 706 1HE LYS 11 1HE LYS 11 -42.268 -33.716 -39.617 707 2HE LYS 11 2HE LYS 11 -41.995 -33.739 -41.359 708 1HZ LYS 11 1HZ LYS 11 -44.307 -34.042 -40.941 709 2HZ LYS 11 2HZ LYS 11 -44.016 -35.305 -39.846 710 3HZ LYS 11 3HZ LYS 11 -43.690 -35.521 -41.496 711 H LYS 12 H LYS 12 -37.055 -38.383 -40.911 712 HA LYS 12 HA LYS 12 -34.812 -38.765 -40.960 713 1HB LYS 12 1HB LYS 12 -35.620 -38.261 -43.793 714 2HB LYS 12 2HB LYS 12 -33.945 -38.639 -43.413 715 1HG LYS 12 1HG LYS 12 -35.637 -40.510 -42.087 716 2HG LYS 12 2HG LYS 12 -36.111 -40.408 -43.783 717 1HD LYS 12 1HD LYS 12 -34.096 -41.198 -44.535 718 2HD LYS 12 2HD LYS 12 -33.213 -40.604 -43.128 719 1HE LYS 12 1HE LYS 12 -34.218 -42.354 -41.756 720 2HE LYS 12 2HE LYS 12 -35.119 -42.940 -43.152 721 1HZ LYS 12 1HZ LYS 12 -32.189 -42.750 -43.316 722 2HZ LYS 12 2HZ LYS 12 -33.248 -43.810 -44.115 723 3HZ LYS 12 3HZ LYS 12 -32.887 -44.047 -42.473 724 H MET 13 H MET 13 -35.146 -36.336 -39.916 725 HA MET 13 HA MET 13 -33.011 -34.727 -41.168 726 1HB MET 13 1HB MET 13 -35.539 -33.863 -40.986 727 2HB MET 13 2HB MET 13 -34.992 -33.413 -39.377 728 1HG MET 13 1HG MET 13 -34.803 -31.605 -41.072 729 2HG MET 13 2HG MET 13 -33.291 -32.005 -40.259 730 1HE MET 13 1HE MET 13 -34.459 -32.819 -44.595 731 2HE MET 13 2HE MET 13 -35.527 -32.520 -43.219 732 3HE MET 13 3HE MET 13 -34.846 -34.128 -43.479 733 H THR 14 H THR 14 -32.474 -36.787 -39.453 734 HA THR 14 HA THR 14 -32.267 -35.962 -36.735 735 HB THR 14 HB THR 14 -30.425 -37.990 -37.125 736 HG1 THR 14 HG1 THR 14 -31.020 -39.074 -38.850 737 1HG2 THR 14 1HG2 THR 14 -33.353 -38.084 -36.417 738 2HG2 THR 14 2HG2 THR 14 -31.988 -37.959 -35.306 739 3HG2 THR 14 3HG2 THR 14 -32.251 -39.444 -36.221 740 H PHE 15 H PHE 15 -30.619 -35.041 -35.673 741 HA PHE 15 HA PHE 15 -28.047 -34.701 -37.025 742 1HB PHE 15 1HB PHE 15 -27.944 -32.320 -36.262 743 2HB PHE 15 2HB PHE 15 -29.153 -32.615 -37.503 744 HD1 PHE 15 HD1 PHE 15 -28.544 -31.497 -34.124 745 HD2 PHE 15 HD2 PHE 15 -31.552 -32.691 -36.886 746 HE1 PHE 15 HE1 PHE 15 -30.261 -30.471 -32.693 747 HE2 PHE 15 HE2 PHE 15 -33.273 -31.657 -35.468 748 HZ PHE 15 HZ PHE 15 -32.609 -30.506 -33.368 749 H GLY 16 H GLY 16 -29.967 -34.725 -34.108 750 1HA GLY 16 1HA GLY 16 -29.374 -35.653 -32.071 751 2HA GLY 16 2HA GLY 16 -27.726 -35.813 -32.655 752 H GLU 17 H GLU 17 -28.973 -34.720 -30.122 753 HA GLU 17 HA GLU 17 -27.838 -32.007 -30.205 754 1HB GLU 17 1HB GLU 17 -30.115 -33.136 -28.899 755 2HB GLU 17 2HB GLU 17 -28.991 -32.583 -27.666 756 1HG GLU 17 1HG GLU 17 -29.789 -30.829 -29.961 757 2HG GLU 17 2HG GLU 17 -30.770 -30.952 -28.501 758 H ASN 18 H ASN 18 -25.946 -33.825 -30.396 759 HA ASN 18 HA ASN 18 -24.991 -34.884 -27.944 760 1HB ASN 18 1HB ASN 18 -24.384 -35.326 -30.564 761 2HB ASN 18 2HB ASN 18 -22.993 -34.374 -30.052 762 1HD2 ASN 18 1HD2 ASN 18 -24.589 -37.383 -29.913 763 2HD2 ASN 18 2HD2 ASN 18 -23.434 -38.215 -28.916 764 H ARG 19 H ARG 19 -24.115 -32.044 -29.870 765 HA ARG 19 HA ARG 19 -22.883 -30.184 -29.410 766 1HB ARG 19 1HB ARG 19 -24.779 -30.352 -27.494 767 2HB ARG 19 2HB ARG 19 -23.337 -30.372 -26.491 768 1HG ARG 19 1HG ARG 19 -23.790 -28.132 -26.582 769 2HG ARG 19 2HG ARG 19 -22.652 -28.304 -27.921 770 1HD ARG 19 1HD ARG 19 -24.419 -26.985 -28.757 771 2HD ARG 19 2HD ARG 19 -24.675 -28.599 -29.419 772 HE ARG 19 HE ARG 19 -26.599 -28.807 -28.162 773 1HH1 ARG 19 1HH1 ARG 19 -24.864 -25.900 -27.216 774 2HH1 ARG 19 2HH1 ARG 19 -26.173 -25.292 -26.238 775 1HH2 ARG 19 1HH2 ARG 19 -28.305 -28.017 -26.891 776 2HH2 ARG 19 2HH2 ARG 19 -28.129 -26.496 -26.053 777 H ASP 20 H ASP 20 -21.324 -32.327 -29.708 778 HA ASP 20 HA ASP 20 -19.627 -32.834 -27.463 779 1HB ASP 20 1HB ASP 20 -20.070 -34.531 -29.200 780 2HB ASP 20 2HB ASP 20 -19.246 -33.526 -30.385 781 H LEU 21 H LEU 21 -19.275 -30.415 -27.213 782 HA LEU 21 HA LEU 21 -16.748 -29.754 -28.554 783 1HB LEU 21 1HB LEU 21 -19.042 -28.485 -29.218 784 2HB LEU 21 2HB LEU 21 -18.512 -27.482 -27.882 785 HG LEU 21 HG LEU 21 -16.220 -27.759 -29.408 786 1HD1 LEU 21 1HD1 LEU 21 -16.987 -27.060 -31.674 787 2HD1 LEU 21 2HD1 LEU 21 -18.627 -27.502 -31.199 788 3HD1 LEU 21 3HD1 LEU 21 -17.365 -28.733 -31.264 789 1HD2 LEU 21 1HD2 LEU 21 -18.196 -25.514 -29.696 790 2HD2 LEU 21 2HD2 LEU 21 -16.437 -25.444 -29.781 791 3HD2 LEU 21 3HD2 LEU 21 -17.232 -25.756 -28.239 792 H GLU 22 H GLU 22 -16.206 -30.824 -26.398 793 HA GLU 22 HA GLU 22 -16.509 -29.174 -24.045 794 1HB GLU 22 1HB GLU 22 -14.822 -31.633 -24.539 795 2HB GLU 22 2HB GLU 22 -15.031 -30.852 -22.978 796 1HG GLU 22 1HG GLU 22 -17.263 -31.507 -22.818 797 2HG GLU 22 2HG GLU 22 -17.373 -31.878 -24.538 798 H ARG 23 H ARG 23 -15.533 -27.332 -25.354 799 HA ARG 23 HA ARG 23 -12.660 -27.413 -25.677 800 1HB ARG 23 1HB ARG 23 -14.659 -25.996 -26.915 801 2HB ARG 23 2HB ARG 23 -13.965 -24.788 -25.842 802 1HG ARG 23 1HG ARG 23 -11.992 -26.358 -27.335 803 2HG ARG 23 2HG ARG 23 -13.059 -25.370 -28.333 804 1HD ARG 23 1HD ARG 23 -11.795 -23.606 -27.853 805 2HD ARG 23 2HD ARG 23 -12.306 -23.745 -26.173 806 HE ARG 23 HE ARG 23 -10.314 -25.469 -26.163 807 1HH1 ARG 23 1HH1 ARG 23 -10.480 -22.294 -27.642 808 2HH1 ARG 23 2HH1 ARG 23 -8.769 -22.013 -27.522 809 1HH2 ARG 23 1HH2 ARG 23 -8.060 -25.098 -26.010 810 2HH2 ARG 23 2HH2 ARG 23 -7.394 -23.600 -26.602 811 H VAL 24 H VAL 24 -12.768 -27.989 -23.221 812 HA VAL 24 HA VAL 24 -12.929 -25.727 -21.447 813 HB VAL 24 HB VAL 24 -13.518 -27.901 -20.558 814 1HG1 VAL 24 1HG1 VAL 24 -12.402 -29.560 -21.655 815 2HG1 VAL 24 2HG1 VAL 24 -11.449 -29.489 -20.173 816 3HG1 VAL 24 3HG1 VAL 24 -10.866 -28.694 -21.634 817 1HG2 VAL 24 1HG2 VAL 24 -11.024 -27.645 -19.073 818 2HG2 VAL 24 2HG2 VAL 24 -12.691 -27.443 -18.536 819 3HG2 VAL 24 3HG2 VAL 24 -11.852 -26.111 -19.326 820 H VAL 25 H VAL 25 -11.339 -24.383 -20.916 821 HA VAL 25 HA VAL 25 -8.645 -25.000 -21.952 822 HB VAL 25 HB VAL 25 -9.456 -22.181 -21.390 823 1HG1 VAL 25 1HG1 VAL 25 -7.586 -21.707 -22.507 824 2HG1 VAL 25 2HG1 VAL 25 -8.027 -22.766 -23.846 825 3HG1 VAL 25 3HG1 VAL 25 -7.217 -23.428 -22.428 826 1HG2 VAL 25 1HG2 VAL 25 -11.312 -23.253 -22.733 827 2HG2 VAL 25 2HG2 VAL 25 -10.125 -23.500 -24.012 828 3HG2 VAL 25 3HG2 VAL 25 -10.521 -21.866 -23.483 829 H THR 26 H THR 26 -7.749 -25.893 -20.146 830 HA THR 26 HA THR 26 -8.073 -24.788 -17.541 831 HB THR 26 HB THR 26 -5.709 -26.386 -17.673 832 HG1 THR 26 HG1 THR 26 -7.678 -28.039 -18.653 833 1HG2 THR 26 1HG2 THR 26 -7.156 -26.348 -15.752 834 2HG2 THR 26 2HG2 THR 26 -7.137 -27.989 -16.396 835 3HG2 THR 26 3HG2 THR 26 -8.517 -26.939 -16.708 836 H ALA 27 H ALA 27 -7.188 -22.946 -16.895 837 HA ALA 27 HA ALA 27 -4.909 -21.780 -18.221 838 1HB ALA 27 1HB ALA 27 -6.943 -20.611 -17.056 839 2HB ALA 27 2HB ALA 27 -5.340 -19.871 -17.008 840 3HB ALA 27 3HB ALA 27 -5.943 -20.765 -15.611 841 HA PRO 28 HA PRO 28 -1.677 -23.617 -15.840 842 1HB PRO 28 1HB PRO 28 -0.370 -20.956 -15.830 843 2HB PRO 28 2HB PRO 28 0.225 -22.498 -16.453 844 1HG PRO 28 1HG PRO 28 -0.571 -20.559 -18.109 845 2HG PRO 28 2HG PRO 28 -0.882 -22.268 -18.470 846 1HD PRO 28 1HD PRO 28 -2.750 -20.181 -17.417 847 2HD PRO 28 2HD PRO 28 -3.052 -21.474 -18.595 848 H VAL 29 H VAL 29 -1.461 -23.980 -13.723 849 HA VAL 29 HA VAL 29 -2.726 -22.218 -11.832 850 HB VAL 29 HB VAL 29 -1.008 -24.589 -11.121 851 1HG1 VAL 29 1HG1 VAL 29 -1.607 -23.848 -9.091 852 2HG1 VAL 29 2HG1 VAL 29 -3.167 -24.582 -9.462 853 3HG1 VAL 29 3HG1 VAL 29 -2.917 -22.857 -9.734 854 1HG2 VAL 29 1HG2 VAL 29 -3.706 -25.383 -11.184 855 2HG2 VAL 29 2HG2 VAL 29 -2.383 -25.963 -12.193 856 3HG2 VAL 29 3HG2 VAL 29 -3.372 -24.606 -12.730 857 H SER 30 H SER 30 -1.365 -20.357 -12.280 858 HA SER 30 HA SER 30 1.398 -20.324 -11.866 859 1HB SER 30 1HB SER 30 0.312 -17.759 -11.251 860 2HB SER 30 2HB SER 30 1.085 -18.286 -12.747 861 HG SER 30 HG SER 30 -1.660 -18.316 -12.051 862 H SER 31 H SER 31 2.602 -20.310 -10.110 863 HA SER 31 HA SER 31 1.380 -20.327 -7.502 864 1HB SER 31 1HB SER 31 4.317 -20.238 -7.656 865 2HB SER 31 2HB SER 31 3.265 -21.419 -6.873 866 HG SER 31 HG SER 31 3.300 -22.633 -8.611 867 H GLY 32 H GLY 32 2.431 -18.991 -5.729 868 1HA GLY 32 1HA GLY 32 2.798 -16.234 -6.729 869 2HA GLY 32 2HA GLY 32 2.103 -16.652 -5.169 870 H LYS 33 H LYS 33 5.091 -17.064 -7.044 871 HA LYS 33 HA LYS 33 6.667 -17.291 -4.619 872 1HB LYS 33 1HB LYS 33 7.021 -18.384 -7.030 873 2HB LYS 33 2HB LYS 33 7.947 -16.910 -7.281 874 1HG LYS 33 1HG LYS 33 9.362 -18.758 -6.547 875 2HG LYS 33 2HG LYS 33 9.355 -17.438 -5.375 876 1HD LYS 33 1HD LYS 33 7.245 -19.186 -4.679 877 2HD LYS 33 2HD LYS 33 8.666 -20.184 -4.989 878 1HE LYS 33 1HE LYS 33 9.879 -18.387 -3.523 879 2HE LYS 33 2HE LYS 33 8.252 -18.059 -2.931 880 1HZ LYS 33 1HZ LYS 33 8.382 -20.746 -2.788 881 2HZ LYS 33 2HZ LYS 33 8.694 -19.695 -1.496 882 3HZ LYS 33 3HZ LYS 33 9.980 -20.310 -2.414 883 H ILE 34 H ILE 34 5.485 -14.856 -6.628 884 HA ILE 34 HA ILE 34 7.217 -12.896 -5.282 885 HB ILE 34 HB ILE 34 6.283 -11.567 -7.530 886 1HG1 ILE 34 1HG1 ILE 34 7.587 -14.041 -8.613 887 2HG1 ILE 34 2HG1 ILE 34 5.846 -14.030 -8.349 888 1HG2 ILE 34 1HG2 ILE 34 8.945 -12.526 -7.980 889 2HG2 ILE 34 2HG2 ILE 34 8.718 -12.158 -6.273 890 3HG2 ILE 34 3HG2 ILE 34 8.405 -10.920 -7.488 891 1HD1 ILE 34 1HD1 ILE 34 6.697 -13.431 -10.665 892 2HD1 ILE 34 2HD1 ILE 34 7.210 -11.898 -9.953 893 3HD1 ILE 34 3HD1 ILE 34 5.504 -12.353 -9.937 894 H LYS 35 H LYS 35 6.166 -11.066 -4.548 895 HA LYS 35 HA LYS 35 3.237 -11.317 -4.431 896 1HB LYS 35 1HB LYS 35 5.333 -10.695 -2.468 897 2HB LYS 35 2HB LYS 35 3.944 -9.617 -2.396 898 1HG LYS 35 1HG LYS 35 3.426 -11.314 -0.894 899 2HG LYS 35 2HG LYS 35 2.526 -11.742 -2.349 900 1HD LYS 35 1HD LYS 35 5.039 -12.946 -2.627 901 2HD LYS 35 2HD LYS 35 4.549 -13.232 -0.955 902 1HE LYS 35 1HE LYS 35 2.355 -13.627 -2.805 903 2HE LYS 35 2HE LYS 35 3.732 -14.657 -3.196 904 1HZ LYS 35 1HZ LYS 35 2.540 -15.915 -1.689 905 2HZ LYS 35 2HZ LYS 35 2.121 -14.585 -0.726 906 3HZ LYS 35 3HZ LYS 35 3.706 -15.188 -0.697 907 H ARG 36 H ARG 36 1.959 -9.406 -4.515 908 HA ARG 36 HA ARG 36 3.270 -7.262 -6.052 909 1HB ARG 36 1HB ARG 36 0.915 -6.653 -6.706 910 2HB ARG 36 2HB ARG 36 1.468 -8.221 -7.278 911 1HG ARG 36 1HG ARG 36 -0.001 -9.368 -5.990 912 2HG ARG 36 2HG ARG 36 0.023 -8.170 -4.696 913 1HD ARG 36 1HD ARG 36 -1.259 -7.669 -7.371 914 2HD ARG 36 2HD ARG 36 -2.132 -8.375 -6.014 915 HE ARG 36 HE ARG 36 -1.727 -6.306 -4.792 916 1HH1 ARG 36 1HH1 ARG 36 -1.130 -6.221 -8.249 917 2HH1 ARG 36 2HH1 ARG 36 -1.467 -4.513 -8.394 918 1HH2 ARG 36 1HH2 ARG 36 -2.146 -4.059 -4.982 919 2HH2 ARG 36 2HH2 ARG 36 -2.046 -3.298 -6.543 920 H VAL 37 H VAL 37 3.569 -5.344 -5.173 921 HA VAL 37 HA VAL 37 2.066 -4.686 -2.719 922 HB VAL 37 HB VAL 37 4.833 -3.665 -3.320 923 1HG1 VAL 37 1HG1 VAL 37 4.886 -2.936 -1.143 924 2HG1 VAL 37 2HG1 VAL 37 3.711 -4.130 -0.598 925 3HG1 VAL 37 3HG1 VAL 37 3.178 -2.730 -1.525 926 1HG2 VAL 37 1HG2 VAL 37 4.774 -5.792 -1.351 927 2HG2 VAL 37 2HG2 VAL 37 5.841 -5.566 -2.736 928 3HG2 VAL 37 3HG2 VAL 37 4.278 -6.355 -2.945 929 H ASN 38 H ASN 38 0.860 -2.904 -2.844 930 HA ASN 38 HA ASN 38 1.548 -0.890 -4.878 931 1HB ASN 38 1HB ASN 38 -0.656 -1.278 -5.375 932 2HB ASN 38 2HB ASN 38 -1.031 -1.835 -3.749 933 1HD2 ASN 38 1HD2 ASN 38 -0.752 0.935 -5.839 934 2HD2 ASN 38 2HD2 ASN 38 -1.533 2.060 -4.779 935 H VAL 39 H VAL 39 2.395 0.964 -4.178 936 HA VAL 39 HA VAL 39 1.830 1.831 -1.434 937 HB VAL 39 HB VAL 39 4.539 2.502 -1.978 938 1HG1 VAL 39 1HG1 VAL 39 4.447 0.555 0.025 939 2HG1 VAL 39 2HG1 VAL 39 2.898 1.396 0.103 940 3HG1 VAL 39 3HG1 VAL 39 4.406 2.307 0.225 941 1HG2 VAL 39 1HG2 VAL 39 5.055 0.736 -3.338 942 2HG2 VAL 39 2HG2 VAL 39 3.812 -0.308 -2.643 943 3HG2 VAL 39 3HG2 VAL 39 5.311 -0.007 -1.759 944 H ASN 40 H ASN 40 2.502 4.063 -1.022 945 HA ASN 40 HA ASN 40 2.221 5.700 -3.445 946 1HB ASN 40 1HB ASN 40 1.169 7.401 -2.032 947 2HB ASN 40 2HB ASN 40 0.311 5.874 -1.911 948 1HD2 ASN 40 1HD2 ASN 40 0.441 4.669 -0.004 949 2HD2 ASN 40 2HD2 ASN 40 0.974 5.378 1.492 950 H PHE 41 H PHE 41 3.704 7.177 -3.904 951 HA PHE 41 HA PHE 41 5.752 7.825 -1.886 952 1HB PHE 41 1HB PHE 41 6.339 7.548 -4.836 953 2HB PHE 41 2HB PHE 41 7.489 7.674 -3.510 954 HD1 PHE 41 HD1 PHE 41 7.815 5.749 -1.980 955 HD2 PHE 41 HD2 PHE 41 5.442 5.462 -5.500 956 HE1 PHE 41 HE1 PHE 41 7.975 3.296 -1.883 957 HE2 PHE 41 HE2 PHE 41 5.594 3.011 -5.404 958 HZ PHE 41 HZ PHE 41 6.867 1.924 -3.602 959 H ASP 42 H ASP 42 5.961 9.957 -1.566 960 HA ASP 42 HA ASP 42 4.244 11.756 -2.921 961 1HB ASP 42 1HB ASP 42 4.618 13.007 -1.105 962 2HB ASP 42 2HB ASP 42 5.693 11.737 -0.540 963 H GLU 43 H GLU 43 4.852 13.711 -4.058 964 HA GLU 43 HA GLU 43 6.372 13.154 -6.304 965 1HB GLU 43 1HB GLU 43 4.529 14.944 -5.862 966 2HB GLU 43 2HB GLU 43 5.890 15.986 -5.466 967 1HG GLU 43 1HG GLU 43 5.149 16.233 -7.786 968 2HG GLU 43 2HG GLU 43 6.816 15.679 -7.669 969 H GLU 44 H GLU 44 7.367 14.709 -3.317 970 HA GLU 44 HA GLU 44 9.881 15.708 -4.255 971 1HB GLU 44 1HB GLU 44 8.632 15.164 -1.608 972 2HB GLU 44 2HB GLU 44 10.382 15.278 -1.670 973 1HG GLU 44 1HG GLU 44 10.350 17.511 -2.255 974 2HG GLU 44 2HG GLU 44 8.705 17.430 -2.885 975 H LYS 45 H LYS 45 8.844 12.804 -2.560 976 HA LYS 45 HA LYS 45 11.321 11.462 -2.530 977 1HB LYS 45 1HB LYS 45 9.648 10.656 -1.080 978 2HB LYS 45 2HB LYS 45 8.443 10.607 -2.357 979 1HG LYS 45 1HG LYS 45 9.257 8.622 -3.225 980 2HG LYS 45 2HG LYS 45 10.834 8.820 -2.455 981 1HD LYS 45 1HD LYS 45 8.362 8.547 -0.795 982 2HD LYS 45 2HD LYS 45 9.136 7.116 -1.480 983 1HE LYS 45 1HE LYS 45 10.467 7.118 0.301 984 2HE LYS 45 2HE LYS 45 11.238 8.551 -0.399 985 1HZ LYS 45 1HZ LYS 45 9.410 9.846 0.796 986 2HZ LYS 45 2HZ LYS 45 10.647 9.199 1.756 987 3HZ LYS 45 3HZ LYS 45 9.139 8.428 1.681 988 H HIS 46 H HIS 46 8.876 11.906 -4.955 989 HA HIS 46 HA HIS 46 9.732 9.815 -6.703 990 1HB HIS 46 1HB HIS 46 7.456 10.789 -6.785 991 2HB HIS 46 2HB HIS 46 8.143 12.308 -7.350 992 HD1 HIS 46 HD1 HIS 46 6.999 12.306 -9.607 993 HD2 HIS 46 HD2 HIS 46 9.251 8.877 -8.911 994 HE1 HIS 46 HE1 HIS 46 7.118 11.105 -11.815 995 HE2 HIS 46 HE2 HIS 46 8.656 9.148 -11.411 996 H THR 47 H THR 47 10.552 13.251 -6.376 997 HA THR 47 HA THR 47 12.144 13.353 -8.747 998 HB THR 47 HB THR 47 13.196 15.203 -6.883 999 HG1 THR 47 HG1 THR 47 11.584 15.530 -5.564 1000 1HG2 THR 47 1HG2 THR 47 13.057 15.977 -9.038 1001 2HG2 THR 47 2HG2 THR 47 11.640 16.757 -8.336 1002 3HG2 THR 47 3HG2 THR 47 11.453 15.292 -9.295 1003 H ARG 48 H ARG 48 12.717 12.538 -5.392 1004 HA ARG 48 HA ARG 48 15.549 12.218 -5.593 1005 1HB ARG 48 1HB ARG 48 13.479 11.806 -3.596 1006 2HB ARG 48 2HB ARG 48 14.640 10.485 -3.605 1007 1HG ARG 48 1HG ARG 48 16.464 12.041 -3.283 1008 2HG ARG 48 2HG ARG 48 15.342 13.402 -3.359 1009 1HD ARG 48 1HD ARG 48 14.629 13.091 -1.246 1010 2HD ARG 48 2HD ARG 48 14.644 11.333 -1.394 1011 HE ARG 48 HE ARG 48 17.124 11.525 -1.095 1012 1HH1 ARG 48 1HH1 ARG 48 14.924 13.908 0.241 1013 2HH1 ARG 48 2HH1 ARG 48 16.059 14.456 1.443 1014 1HH2 ARG 48 1HH2 ARG 48 18.614 12.253 0.468 1015 2HH2 ARG 48 2HH2 ARG 48 18.151 13.528 1.562 1016 H PHE 49 H PHE 49 12.746 10.108 -5.934 1017 HA PHE 49 HA PHE 49 14.100 7.673 -6.306 1018 1HB PHE 49 1HB PHE 49 11.420 8.590 -6.392 1019 2HB PHE 49 2HB PHE 49 11.720 7.758 -7.913 1020 HD1 PHE 49 HD1 PHE 49 13.936 6.102 -6.100 1021 HD2 PHE 49 HD2 PHE 49 9.720 6.686 -6.153 1022 HE1 PHE 49 HE1 PHE 49 13.623 3.932 -4.980 1023 HE2 PHE 49 HE2 PHE 49 9.403 4.521 -5.029 1024 HZ PHE 49 HZ PHE 49 11.326 3.148 -4.444 1025 H LYS 50 H LYS 50 13.007 10.115 -8.620 1026 HA LYS 50 HA LYS 50 13.742 8.813 -10.974 1027 1HB LYS 50 1HB LYS 50 12.837 11.403 -10.209 1028 2HB LYS 50 2HB LYS 50 14.225 11.612 -11.268 1029 1HG LYS 50 1HG LYS 50 11.967 9.790 -12.011 1030 2HG LYS 50 2HG LYS 50 11.892 11.529 -12.312 1031 1HD LYS 50 1HD LYS 50 13.918 11.413 -13.645 1032 2HD LYS 50 2HD LYS 50 14.075 9.692 -13.287 1033 1HE LYS 50 1HE LYS 50 13.028 9.476 -15.279 1034 2HE LYS 50 2HE LYS 50 11.587 9.718 -14.292 1035 1HZ LYS 50 1HZ LYS 50 11.557 12.023 -14.869 1036 2HZ LYS 50 2HZ LYS 50 11.665 11.127 -16.305 1037 3HZ LYS 50 3HZ LYS 50 13.041 11.904 -15.685 1038 H ALA 51 H ALA 51 15.586 10.987 -8.894 1039 HA ALA 51 HA ALA 51 17.968 10.973 -10.428 1040 1HB ALA 51 1HB ALA 51 18.604 12.492 -8.941 1041 2HB ALA 51 2HB ALA 51 18.467 11.333 -7.618 1042 3HB ALA 51 3HB ALA 51 17.056 12.258 -8.129 1043 H ALA 52 H ALA 52 16.823 9.030 -7.704 1044 HA ALA 52 HA ALA 52 19.156 7.528 -7.285 1045 1HB ALA 52 1HB ALA 52 16.546 7.595 -6.246 1046 2HB ALA 52 2HB ALA 52 17.933 6.699 -5.628 1047 3HB ALA 52 3HB ALA 52 16.831 5.935 -6.772 1048 H CYS 53 H CYS 53 16.374 6.961 -9.415 1049 HA CYS 53 HA CYS 53 17.185 4.433 -10.380 1050 1HB CYS 53 1HB CYS 53 15.558 6.543 -11.815 1051 2HB CYS 53 2HB CYS 53 15.633 4.834 -12.229 1052 HG CYS 53 HG CYS 53 14.337 6.086 -9.321 1053 H ALA 54 H ALA 54 17.936 7.718 -11.385 1054 HA ALA 54 HA ALA 54 19.323 6.996 -13.762 1055 1HB ALA 54 1HB ALA 54 19.371 9.198 -14.096 1056 2HB ALA 54 2HB ALA 54 20.238 9.478 -12.585 1057 3HB ALA 54 3HB ALA 54 18.477 9.365 -12.588 1058 H ARG 55 H ARG 55 20.377 7.816 -10.477 1059 HA ARG 55 HA ARG 55 23.140 7.592 -10.970 1060 1HB ARG 55 1HB ARG 55 21.496 7.430 -8.449 1061 2HB ARG 55 2HB ARG 55 23.248 7.285 -8.430 1062 1HG ARG 55 1HG ARG 55 23.474 9.500 -9.378 1063 2HG ARG 55 2HG ARG 55 21.720 9.650 -9.502 1064 1HD ARG 55 1HD ARG 55 22.081 10.758 -7.532 1065 2HD ARG 55 2HD ARG 55 21.823 9.121 -6.928 1066 HE ARG 55 HE ARG 55 24.516 9.258 -7.322 1067 1HH1 ARG 55 1HH1 ARG 55 22.218 11.229 -5.550 1068 2HH1 ARG 55 2HH1 ARG 55 23.372 11.700 -4.337 1069 1HH2 ARG 55 1HH2 ARG 55 26.027 9.857 -5.694 1070 2HH2 ARG 55 2HH2 ARG 55 25.522 10.915 -4.407 1071 H LYS 56 H LYS 56 20.883 5.302 -9.445 1072 HA LYS 56 HA LYS 56 22.796 3.234 -9.161 1073 1HB LYS 56 1HB LYS 56 19.774 3.154 -9.172 1074 2HB LYS 56 2HB LYS 56 20.791 1.781 -8.759 1075 1HG LYS 56 1HG LYS 56 21.134 4.357 -7.297 1076 2HG LYS 56 2HG LYS 56 19.795 3.282 -6.887 1077 1HD LYS 56 1HD LYS 56 21.169 1.668 -6.046 1078 2HD LYS 56 2HD LYS 56 22.503 2.089 -7.120 1079 1HE LYS 56 1HE LYS 56 22.836 4.166 -5.789 1080 2HE LYS 56 2HE LYS 56 21.600 3.595 -4.669 1081 1HZ LYS 56 1HZ LYS 56 23.029 1.554 -4.412 1082 2HZ LYS 56 2HZ LYS 56 23.641 2.981 -3.734 1083 3HZ LYS 56 3HZ LYS 56 24.260 2.410 -5.210 1084 H GLY 57 H GLY 57 20.522 4.082 -11.694 1085 1HA GLY 57 1HA GLY 57 20.610 3.475 -13.936 1086 2HA GLY 57 2HA GLY 57 21.933 2.378 -13.560 1087 H THR 58 H THR 58 18.485 2.736 -12.745 1088 HA THR 58 HA THR 58 17.876 0.097 -13.706 1089 HB THR 58 HB THR 58 19.037 -0.128 -11.397 1090 HG1 THR 58 HG1 THR 58 17.410 -1.798 -10.835 1091 1HG2 THR 58 1HG2 THR 58 16.271 0.625 -10.468 1092 2HG2 THR 58 2HG2 THR 58 17.699 1.643 -10.291 1093 3HG2 THR 58 3HG2 THR 58 17.617 0.087 -9.464 1094 H SER 59 H SER 59 15.545 -0.502 -12.892 1095 HA SER 59 HA SER 59 13.851 1.662 -13.711 1096 1HB SER 59 1HB SER 59 12.347 -0.563 -12.726 1097 2HB SER 59 2HB SER 59 12.593 -0.056 -14.399 1098 HG SER 59 HG SER 59 14.452 -1.314 -14.491 1099 H ILE 60 H ILE 60 11.995 2.434 -12.530 1100 HA ILE 60 HA ILE 60 12.611 3.236 -9.920 1101 HB ILE 60 HB ILE 60 11.033 4.385 -11.541 1102 1HG1 ILE 60 1HG1 ILE 60 10.000 4.005 -8.722 1103 2HG1 ILE 60 2HG1 ILE 60 11.377 5.020 -9.146 1104 1HG2 ILE 60 1HG2 ILE 60 8.737 2.982 -10.345 1105 2HG2 ILE 60 2HG2 ILE 60 9.650 2.068 -11.548 1106 3HG2 ILE 60 3HG2 ILE 60 8.951 3.632 -11.970 1107 1HD1 ILE 60 1HD1 ILE 60 9.811 6.627 -9.155 1108 2HD1 ILE 60 2HD1 ILE 60 8.495 5.500 -9.481 1109 3HD1 ILE 60 3HD1 ILE 60 9.536 6.046 -10.797 1110 H THR 61 H THR 61 10.987 0.396 -11.076 1111 HA THR 61 HA THR 61 9.773 -0.288 -8.578 1112 HB THR 61 HB THR 61 10.202 -2.609 -10.162 1113 HG1 THR 61 HG1 THR 61 8.895 -1.264 -11.989 1114 1HG2 THR 61 1HG2 THR 61 8.228 -2.293 -8.843 1115 2HG2 THR 61 2HG2 THR 61 7.737 -2.380 -10.536 1116 3HG2 THR 61 3HG2 THR 61 7.818 -0.817 -9.719 1117 H ASP 62 H ASP 62 12.766 -1.031 -10.238 1118 HA ASP 62 HA ASP 62 13.632 -3.092 -8.517 1119 1HB ASP 62 1HB ASP 62 14.514 -2.648 -10.827 1120 2HB ASP 62 2HB ASP 62 15.391 -1.271 -10.163 1121 H VAL 63 H VAL 63 14.104 0.416 -8.472 1122 HA VAL 63 HA VAL 63 15.960 0.365 -6.309 1123 HB VAL 63 HB VAL 63 15.049 2.825 -5.995 1124 1HG1 VAL 63 1HG1 VAL 63 16.557 3.472 -7.978 1125 2HG1 VAL 63 2HG1 VAL 63 16.821 1.736 -8.151 1126 3HG1 VAL 63 3HG1 VAL 63 17.263 2.549 -6.650 1127 1HG2 VAL 63 1HG2 VAL 63 14.006 3.798 -7.827 1128 2HG2 VAL 63 2HG2 VAL 63 13.156 2.265 -7.640 1129 3HG2 VAL 63 3HG2 VAL 63 14.389 2.443 -8.890 1130 H VAL 64 H VAL 64 12.532 0.046 -6.483 1131 HA VAL 64 HA VAL 64 12.019 0.692 -3.721 1132 HB VAL 64 HB VAL 64 10.380 -1.102 -5.525 1133 1HG1 VAL 64 1HG1 VAL 64 9.028 0.451 -3.458 1134 2HG1 VAL 64 2HG1 VAL 64 10.192 -0.705 -2.809 1135 3HG1 VAL 64 3HG1 VAL 64 8.890 -1.262 -3.862 1136 1HG2 VAL 64 1HG2 VAL 64 10.069 1.855 -5.010 1137 2HG2 VAL 64 2HG2 VAL 64 8.989 0.846 -5.972 1138 3HG2 VAL 64 3HG2 VAL 64 10.646 1.129 -6.510 1139 H ASN 65 H ASN 65 12.817 -2.169 -5.618 1140 HA ASN 65 HA ASN 65 12.695 -4.030 -3.462 1141 1HB ASN 65 1HB ASN 65 12.702 -4.748 -5.832 1142 2HB ASN 65 2HB ASN 65 14.354 -4.162 -5.997 1143 1HD2 ASN 65 1HD2 ASN 65 15.609 -5.870 -6.183 1144 2HD2 ASN 65 2HD2 ASN 65 15.585 -7.257 -5.148 1145 H GLN 66 H GLN 66 14.999 -1.663 -4.507 1146 HA GLN 66 HA GLN 66 17.269 -2.676 -3.136 1147 1HB GLN 66 1HB GLN 66 16.589 -0.307 -4.669 1148 2HB GLN 66 2HB GLN 66 17.582 0.089 -3.275 1149 1HG GLN 66 1HG GLN 66 19.326 -0.447 -4.520 1150 2HG GLN 66 2HG GLN 66 18.821 -2.127 -4.336 1151 1HE2 GLN 66 1HE2 GLN 66 17.806 -3.157 -6.030 1152 2HE2 GLN 66 2HE2 GLN 66 17.751 -2.504 -7.636 1153 H LEU 67 H LEU 67 14.789 -0.266 -2.256 1154 HA LEU 67 HA LEU 67 15.960 0.382 0.234 1155 1HB LEU 67 1HB LEU 67 13.186 0.685 0.544 1156 2HB LEU 67 2HB LEU 67 14.379 1.924 0.225 1157 HG LEU 67 HG LEU 67 13.592 0.583 -2.216 1158 1HD1 LEU 67 1HD1 LEU 67 11.508 1.080 -0.299 1159 2HD1 LEU 67 2HD1 LEU 67 11.404 0.366 -1.911 1160 3HD1 LEU 67 3HD1 LEU 67 11.313 2.115 -1.713 1161 1HD2 LEU 67 1HD2 LEU 67 14.580 2.998 -1.493 1162 2HD2 LEU 67 2HD2 LEU 67 12.879 3.391 -1.733 1163 3HD2 LEU 67 3HD2 LEU 67 13.809 2.663 -3.043 1164 H VAL 68 H VAL 68 13.468 -1.980 -0.670 1165 HA VAL 68 HA VAL 68 13.037 -2.900 1.977 1166 HB VAL 68 HB VAL 68 11.507 -3.270 -0.019 1167 1HG1 VAL 68 1HG1 VAL 68 11.835 -5.455 -1.181 1168 2HG1 VAL 68 2HG1 VAL 68 13.481 -5.471 -0.540 1169 3HG1 VAL 68 3HG1 VAL 68 12.970 -4.185 -1.638 1170 1HG2 VAL 68 1HG2 VAL 68 10.413 -4.700 1.286 1171 2HG2 VAL 68 2HG2 VAL 68 11.821 -4.637 2.351 1172 3HG2 VAL 68 3HG2 VAL 68 11.684 -5.916 1.144 1173 H ASP 69 H ASP 69 15.372 -3.636 -0.474 1174 HA ASP 69 HA ASP 69 16.410 -6.039 0.606 1175 1HB ASP 69 1HB ASP 69 16.862 -4.787 -1.689 1176 2HB ASP 69 2HB ASP 69 18.205 -4.088 -0.782 1177 H ASN 70 H ASN 70 17.198 -2.640 1.065 1178 HA ASN 70 HA ASN 70 19.381 -3.058 2.833 1179 1HB ASN 70 1HB ASN 70 17.681 -0.718 2.057 1180 2HB ASN 70 2HB ASN 70 18.707 -0.582 3.480 1181 1HD2 ASN 70 1HD2 ASN 70 18.875 -1.684 0.112 1182 2HD2 ASN 70 2HD2 ASN 70 20.443 -1.020 -0.206 1183 H TRP 71 H TRP 71 15.958 -2.361 3.281 1184 HA TRP 71 HA TRP 71 15.961 -2.171 6.082 1185 1HB TRP 71 1HB TRP 71 14.125 -1.452 4.548 1186 2HB TRP 71 2HB TRP 71 13.723 -3.145 4.297 1187 HD1 TRP 71 HD1 TRP 71 13.499 -0.366 6.914 1188 HE1 TRP 71 HE1 TRP 71 11.819 -1.077 8.730 1189 HE3 TRP 71 HE3 TRP 71 12.718 -5.212 5.434 1190 HZ2 TRP 71 HZ2 TRP 71 10.352 -3.386 9.436 1191 HZ3 TRP 71 HZ3 TRP 71 11.153 -6.603 6.737 1192 HH2 TRP 71 HH2 TRP 71 9.995 -5.700 8.699 1193 H LEU 72 H LEU 72 15.191 -4.916 3.963 1194 HA LEU 72 HA LEU 72 14.589 -6.705 6.020 1195 1HB LEU 72 1HB LEU 72 14.497 -6.711 3.265 1196 2HB LEU 72 2HB LEU 72 15.684 -7.952 3.621 1197 HG LEU 72 HG LEU 72 13.643 -8.566 5.361 1198 1HD1 LEU 72 1HD1 LEU 72 12.369 -6.782 3.935 1199 2HD1 LEU 72 2HD1 LEU 72 11.582 -8.295 4.382 1200 3HD1 LEU 72 3HD1 LEU 72 12.258 -8.097 2.762 1201 1HD2 LEU 72 1HD2 LEU 72 13.436 -10.514 4.101 1202 2HD2 LEU 72 2HD2 LEU 72 15.072 -9.961 3.733 1203 3HD2 LEU 72 3HD2 LEU 72 13.766 -9.679 2.582 1204 H LYS 73 H LYS 73 17.567 -6.470 4.082 1205 HA LYS 73 HA LYS 73 18.726 -8.558 5.703 1206 1HB LYS 73 1HB LYS 73 20.058 -7.120 3.424 1207 2HB LYS 73 2HB LYS 73 20.383 -8.740 4.027 1208 1HG LYS 73 1HG LYS 73 18.201 -9.490 3.224 1209 2HG LYS 73 2HG LYS 73 17.853 -7.857 2.648 1210 1HD LYS 73 1HD LYS 73 19.372 -8.006 0.914 1211 2HD LYS 73 2HD LYS 73 20.331 -9.245 1.724 1212 1HE LYS 73 1HE LYS 73 19.014 -10.943 0.991 1213 2HE LYS 73 2HE LYS 73 17.549 -9.962 1.021 1214 1HZ LYS 73 1HZ LYS 73 18.516 -8.783 -0.973 1215 2HZ LYS 73 2HZ LYS 73 18.007 -10.377 -1.229 1216 3HZ LYS 73 3HZ LYS 73 19.657 -10.037 -1.059 1217 H GLU 74 H GLU 74 19.340 -5.117 5.160 1218 HA GLU 74 HA GLU 74 21.737 -5.280 6.805 1219 1HB GLU 74 1HB GLU 74 20.737 -2.722 5.628 1220 2HB GLU 74 2HB GLU 74 22.389 -3.249 5.907 1221 1HG GLU 74 1HG GLU 74 21.459 -5.084 4.091 1222 2HG GLU 74 2HG GLU 74 20.684 -3.585 3.579 1223 H ASN 75 H ASN 75 18.515 -4.816 7.395 1224 HA ASN 75 HA ASN 75 19.122 -3.229 9.795 1225 1HB ASN 75 1HB ASN 75 17.893 -1.639 8.732 1226 2HB ASN 75 2HB ASN 75 17.052 -2.807 7.722 1227 1HD2 ASN 75 1HD2 ASN 75 15.101 -3.533 8.320 1228 2HD2 ASN 75 2HD2 ASN 75 14.257 -3.030 9.744 1229 H GLU 76 H GLU 76 16.832 -5.556 8.375 1230 HA GLU 76 HA GLU 76 15.990 -6.384 11.037 1231 1HB GLU 76 1HB GLU 76 15.069 -7.036 8.256 1232 2HB GLU 76 2HB GLU 76 14.567 -8.011 9.628 1233 1HG GLU 76 1HG GLU 76 13.867 -5.210 8.931 1234 2HG GLU 76 2HG GLU 76 12.830 -6.534 9.446 Start of MODEL 7 1 1H MET 1 1H MET 1 -22.334 53.184 -36.406 2 2H MET 1 2H MET 1 -23.213 54.583 -36.021 3 3H MET 1 3H MET 1 -22.701 53.540 -34.787 4 HA MET 1 HA MET 1 -21.207 55.286 -34.670 5 1HB MET 1 1HB MET 1 -20.423 52.716 -35.455 6 2HB MET 1 2HB MET 1 -19.445 53.799 -36.436 7 1HG MET 1 1HG MET 1 -18.451 54.782 -34.564 8 2HG MET 1 2HG MET 1 -19.676 54.146 -33.471 9 1HE MET 1 1HE MET 1 -17.574 53.705 -32.023 10 2HE MET 1 2HE MET 1 -16.250 53.822 -33.178 11 3HE MET 1 3HE MET 1 -16.470 52.348 -32.240 12 H SER 2 H SER 2 -20.226 57.067 -35.577 13 HA SER 2 HA SER 2 -21.174 57.921 -38.107 14 1HB SER 2 1HB SER 2 -18.844 59.316 -36.910 15 2HB SER 2 2HB SER 2 -20.369 59.970 -37.509 16 HG SER 2 HG SER 2 -20.834 60.118 -35.464 17 H LEU 3 H LEU 3 -17.760 57.604 -37.071 18 HA LEU 3 HA LEU 3 -17.149 56.674 -39.804 19 1HB LEU 3 1HB LEU 3 -16.256 59.036 -38.458 20 2HB LEU 3 2HB LEU 3 -14.880 57.985 -38.729 21 HG LEU 3 HG LEU 3 -15.010 59.483 -40.576 22 1HD1 LEU 3 1HD1 LEU 3 -16.070 57.563 -42.288 23 2HD1 LEU 3 2HD1 LEU 3 -15.435 56.655 -40.916 24 3HD1 LEU 3 3HD1 LEU 3 -14.381 57.752 -41.811 25 1HD2 LEU 3 1HD2 LEU 3 -17.285 60.239 -40.364 26 2HD2 LEU 3 2HD2 LEU 3 -17.897 58.649 -40.821 27 3HD2 LEU 3 3HD2 LEU 3 -17.029 59.632 -42.000 28 H GLU 4 H GLU 4 -17.309 55.658 -36.778 29 HA GLU 4 HA GLU 4 -16.511 53.837 -35.685 30 1HB GLU 4 1HB GLU 4 -15.897 53.197 -38.269 31 2HB GLU 4 2HB GLU 4 -14.308 53.181 -37.519 32 1HG GLU 4 1HG GLU 4 -15.784 51.779 -35.710 33 2HG GLU 4 2HG GLU 4 -16.547 51.329 -37.233 34 H LYS 5 H LYS 5 -13.688 55.276 -37.319 35 HA LYS 5 HA LYS 5 -11.740 56.139 -36.542 36 1HB LYS 5 1HB LYS 5 -13.749 57.306 -35.028 37 2HB LYS 5 2HB LYS 5 -12.606 56.740 -33.820 38 1HG LYS 5 1HG LYS 5 -11.076 57.965 -35.825 39 2HG LYS 5 2HG LYS 5 -12.453 59.027 -35.526 40 1HD LYS 5 1HD LYS 5 -11.944 59.151 -33.196 41 2HD LYS 5 2HD LYS 5 -10.717 57.890 -33.342 42 1HE LYS 5 1HE LYS 5 -9.229 59.527 -33.604 43 2HE LYS 5 2HE LYS 5 -9.945 59.803 -35.191 44 1HZ LYS 5 1HZ LYS 5 -9.954 61.864 -34.108 45 2HZ LYS 5 2HZ LYS 5 -10.537 61.212 -32.654 46 3HZ LYS 5 3HZ LYS 5 -11.553 61.314 -34.006 47 H ALA 6 H ALA 6 -11.830 53.461 -36.450 48 HA ALA 6 HA ALA 6 -11.097 52.446 -33.851 49 1HB ALA 6 1HB ALA 6 -11.824 50.598 -34.867 50 2HB ALA 6 2HB ALA 6 -10.292 50.580 -35.739 51 3HB ALA 6 3HB ALA 6 -11.708 51.344 -36.460 52 H HIS 7 H HIS 7 -9.268 53.287 -33.067 53 HA HIS 7 HA HIS 7 -6.799 52.820 -34.557 54 1HB HIS 7 1HB HIS 7 -8.001 55.407 -34.258 55 2HB HIS 7 2HB HIS 7 -6.506 55.362 -33.331 56 HD1 HIS 7 HD1 HIS 7 -5.679 57.140 -35.159 57 HD2 HIS 7 HD2 HIS 7 -6.319 53.259 -36.524 58 HE1 HIS 7 HE1 HIS 7 -4.481 56.988 -37.371 59 HE2 HIS 7 HE2 HIS 7 -4.887 54.630 -38.186 60 H THR 8 H THR 8 -5.033 52.458 -33.273 61 HA THR 8 HA THR 8 -5.508 51.794 -30.532 62 HB THR 8 HB THR 8 -2.737 52.069 -31.608 63 HG1 THR 8 HG1 THR 8 -4.585 50.038 -32.435 64 1HG2 THR 8 1HG2 THR 8 -3.538 51.086 -29.318 65 2HG2 THR 8 2HG2 THR 8 -2.254 50.281 -30.218 66 3HG2 THR 8 3HG2 THR 8 -3.901 49.654 -30.279 67 H SER 9 H SER 9 -4.715 52.837 -28.691 68 HA SER 9 HA SER 9 -4.652 55.642 -28.747 69 1HB SER 9 1HB SER 9 -3.344 54.597 -26.407 70 2HB SER 9 2HB SER 9 -4.950 55.316 -26.547 71 HG SER 9 HG SER 9 -5.697 53.381 -26.240 72 H VAL 10 H VAL 10 -2.934 57.104 -28.455 73 HA VAL 10 HA VAL 10 -0.561 56.412 -29.846 74 HB VAL 10 HB VAL 10 -0.878 58.867 -28.129 75 1HG1 VAL 10 1HG1 VAL 10 1.304 58.751 -28.958 76 2HG1 VAL 10 2HG1 VAL 10 0.471 59.812 -30.091 77 3HG1 VAL 10 3HG1 VAL 10 0.776 58.131 -30.521 78 1HG2 VAL 10 1HG2 VAL 10 -2.791 59.153 -29.329 79 2HG2 VAL 10 2HG2 VAL 10 -2.241 58.136 -30.658 80 3HG2 VAL 10 3HG2 VAL 10 -1.640 59.784 -30.506 81 H LYS 11 H LYS 11 0.690 54.927 -28.938 82 HA LYS 11 HA LYS 11 1.389 55.152 -26.110 83 1HB LYS 11 1HB LYS 11 1.716 52.984 -28.173 84 2HB LYS 11 2HB LYS 11 2.579 52.928 -26.642 85 1HG LYS 11 1HG LYS 11 -0.247 53.459 -26.278 86 2HG LYS 11 2HG LYS 11 0.048 51.948 -27.140 87 1HD LYS 11 1HD LYS 11 1.224 51.021 -25.369 88 2HD LYS 11 2HD LYS 11 1.606 52.595 -24.669 89 1HE LYS 11 1HE LYS 11 -0.341 52.706 -23.533 90 2HE LYS 11 2HE LYS 11 -1.259 51.947 -24.833 91 1HZ LYS 11 1HZ LYS 11 0.486 50.541 -22.882 92 2HZ LYS 11 2HZ LYS 11 -0.361 49.800 -24.151 93 3HZ LYS 11 3HZ LYS 11 -1.209 50.542 -22.886 94 H LYS 12 H LYS 12 2.567 57.169 -26.716 95 HA LYS 12 HA LYS 12 5.151 56.707 -28.010 96 1HB LYS 12 1HB LYS 12 3.470 59.092 -27.436 97 2HB LYS 12 2HB LYS 12 5.211 59.331 -27.431 98 1HG LYS 12 1HG LYS 12 4.530 57.821 -29.739 99 2HG LYS 12 2HG LYS 12 3.453 59.214 -29.640 100 1HD LYS 12 1HD LYS 12 5.126 60.698 -29.985 101 2HD LYS 12 2HD LYS 12 6.303 59.739 -29.083 102 1HE LYS 12 1HE LYS 12 7.156 59.399 -31.150 103 2HE LYS 12 2HE LYS 12 5.941 58.122 -31.186 104 1HZ LYS 12 1HZ LYS 12 4.442 59.975 -32.141 105 2HZ LYS 12 2HZ LYS 12 5.571 59.230 -33.160 106 3HZ LYS 12 3HZ LYS 12 5.903 60.759 -32.505 107 H MET 13 H MET 13 4.297 55.810 -25.269 108 HA MET 13 HA MET 13 6.444 57.096 -23.724 109 1HB MET 13 1HB MET 13 5.229 56.727 -21.731 110 2HB MET 13 2HB MET 13 4.046 57.341 -22.877 111 1HG MET 13 1HG MET 13 4.447 54.420 -22.277 112 2HG MET 13 2HG MET 13 3.261 55.441 -21.465 113 1HE MET 13 1HE MET 13 1.247 56.474 -22.494 114 2HE MET 13 2HE MET 13 0.803 54.793 -22.195 115 3HE MET 13 3HE MET 13 0.331 55.578 -23.703 116 H THR 14 H THR 14 7.440 55.596 -22.087 117 HA THR 14 HA THR 14 8.323 53.207 -23.397 118 HB THR 14 HB THR 14 9.377 52.881 -21.003 119 HG1 THR 14 HG1 THR 14 8.449 54.451 -19.815 120 1HG2 THR 14 1HG2 THR 14 11.270 54.216 -21.682 121 2HG2 THR 14 2HG2 THR 14 10.263 55.134 -22.803 122 3HG2 THR 14 3HG2 THR 14 10.584 53.426 -23.100 123 H PHE 15 H PHE 15 7.749 51.116 -23.014 124 HA PHE 15 HA PHE 15 5.518 50.729 -21.133 125 1HB PHE 15 1HB PHE 15 4.925 48.757 -22.595 126 2HB PHE 15 2HB PHE 15 4.719 50.335 -23.339 127 HD1 PHE 15 HD1 PHE 15 6.535 47.188 -23.413 128 HD2 PHE 15 HD2 PHE 15 6.243 51.081 -25.106 129 HE1 PHE 15 HE1 PHE 15 7.908 46.456 -25.318 130 HE2 PHE 15 HE2 PHE 15 7.619 50.359 -27.011 131 HZ PHE 15 HZ PHE 15 8.453 48.044 -27.123 132 H GLY 16 H GLY 16 8.633 49.587 -22.151 133 1HA GLY 16 1HA GLY 16 8.960 48.143 -19.686 134 2HA GLY 16 2HA GLY 16 8.851 47.084 -21.086 135 H GLU 17 H GLU 17 10.481 50.101 -20.170 136 HA GLU 17 HA GLU 17 12.836 49.218 -21.680 137 1HB GLU 17 1HB GLU 17 11.520 51.721 -21.347 138 2HB GLU 17 2HB GLU 17 13.135 51.865 -20.669 139 1HG GLU 17 1HG GLU 17 12.662 50.728 -23.398 140 2HG GLU 17 2HG GLU 17 12.811 52.462 -23.119 141 H ASN 18 H ASN 18 11.705 49.080 -18.613 142 HA ASN 18 HA ASN 18 14.271 49.675 -17.339 143 1HB ASN 18 1HB ASN 18 12.345 50.661 -16.262 144 2HB ASN 18 2HB ASN 18 11.539 49.098 -16.179 145 1HD2 ASN 18 1HD2 ASN 18 14.760 50.342 -15.320 146 2HD2 ASN 18 2HD2 ASN 18 14.762 49.694 -13.713 147 H ARG 19 H ARG 19 11.887 47.043 -17.570 148 HA ARG 19 HA ARG 19 14.080 45.153 -17.043 149 1HB ARG 19 1HB ARG 19 11.672 45.589 -15.456 150 2HB ARG 19 2HB ARG 19 11.829 43.920 -15.987 151 1HG ARG 19 1HG ARG 19 12.905 43.943 -13.936 152 2HG ARG 19 2HG ARG 19 14.234 44.080 -15.090 153 1HD ARG 19 1HD ARG 19 14.093 46.574 -14.786 154 2HD ARG 19 2HD ARG 19 12.967 46.273 -13.463 155 HE ARG 19 HE ARG 19 14.721 45.292 -12.217 156 1HH1 ARG 19 1HH1 ARG 19 15.782 46.688 -15.259 157 2HH1 ARG 19 2HH1 ARG 19 17.453 46.757 -14.789 158 1HH2 ARG 19 1HH2 ARG 19 16.918 45.406 -11.588 159 2HH2 ARG 19 2HH2 ARG 19 18.104 46.047 -12.697 160 H ASP 20 H ASP 20 13.554 42.937 -17.736 161 HA ASP 20 HA ASP 20 11.551 42.780 -19.876 162 1HB ASP 20 1HB ASP 20 13.071 42.115 -21.533 163 2HB ASP 20 2HB ASP 20 13.906 43.436 -20.726 164 H LEU 21 H LEU 21 12.481 41.587 -17.099 165 HA LEU 21 HA LEU 21 12.834 38.812 -17.586 166 1HB LEU 21 1HB LEU 21 13.461 40.245 -15.516 167 2HB LEU 21 2HB LEU 21 11.814 39.933 -15.005 168 HG LEU 21 HG LEU 21 12.762 37.416 -15.650 169 1HD1 LEU 21 1HD1 LEU 21 14.896 37.134 -14.752 170 2HD1 LEU 21 2HD1 LEU 21 14.882 38.720 -13.983 171 3HD1 LEU 21 3HD1 LEU 21 15.039 38.592 -15.733 172 1HD2 LEU 21 1HD2 LEU 21 11.481 37.459 -13.777 173 2HD2 LEU 21 2HD2 LEU 21 12.194 38.963 -13.193 174 3HD2 LEU 21 3HD2 LEU 21 13.064 37.443 -13.000 175 H GLU 22 H GLU 22 11.388 37.301 -18.008 176 HA GLU 22 HA GLU 22 8.541 37.929 -17.763 177 1HB GLU 22 1HB GLU 22 9.701 35.435 -18.987 178 2HB GLU 22 2HB GLU 22 8.114 36.140 -19.252 179 1HG GLU 22 1HG GLU 22 8.855 37.353 -20.945 180 2HG GLU 22 2HG GLU 22 10.183 37.997 -19.977 181 H ARG 23 H ARG 23 7.296 35.666 -17.312 182 HA ARG 23 HA ARG 23 8.533 34.346 -15.005 183 1HB ARG 23 1HB ARG 23 7.112 36.249 -14.201 184 2HB ARG 23 2HB ARG 23 5.724 35.468 -14.944 185 1HG ARG 23 1HG ARG 23 5.610 34.878 -12.688 186 2HG ARG 23 2HG ARG 23 6.284 33.455 -13.485 187 1HD ARG 23 1HD ARG 23 7.450 34.011 -11.385 188 2HD ARG 23 2HD ARG 23 8.513 34.075 -12.790 189 HE ARG 23 HE ARG 23 7.364 36.623 -12.126 190 1HH1 ARG 23 1HH1 ARG 23 9.959 34.382 -11.397 191 2HH1 ARG 23 2HH1 ARG 23 11.040 35.622 -10.817 192 1HH2 ARG 23 1HH2 ARG 23 8.770 38.257 -11.357 193 2HH2 ARG 23 2HH2 ARG 23 10.339 37.822 -10.738 194 H VAL 24 H VAL 24 8.729 32.670 -16.655 195 HA VAL 24 HA VAL 24 6.186 31.225 -17.059 196 HB VAL 24 HB VAL 24 8.588 30.708 -18.779 197 1HG1 VAL 24 1HG1 VAL 24 6.873 29.106 -19.031 198 2HG1 VAL 24 2HG1 VAL 24 6.722 30.185 -20.419 199 3HG1 VAL 24 3HG1 VAL 24 5.615 30.343 -19.055 200 1HG2 VAL 24 1HG2 VAL 24 7.319 32.298 -20.436 201 2HG2 VAL 24 2HG2 VAL 24 8.474 32.952 -19.272 202 3HG2 VAL 24 3HG2 VAL 24 6.743 33.045 -18.943 203 H VAL 25 H VAL 25 6.509 30.272 -14.966 204 HA VAL 25 HA VAL 25 8.808 28.480 -14.702 205 HB VAL 25 HB VAL 25 6.908 28.458 -12.485 206 1HG1 VAL 25 1HG1 VAL 25 9.832 29.179 -12.631 207 2HG1 VAL 25 2HG1 VAL 25 9.191 27.551 -12.413 208 3HG1 VAL 25 3HG1 VAL 25 8.921 28.779 -11.176 209 1HG2 VAL 25 1HG2 VAL 25 7.607 31.032 -13.640 210 2HG2 VAL 25 2HG2 VAL 25 8.119 30.881 -11.959 211 3HG2 VAL 25 3HG2 VAL 25 6.427 30.635 -12.391 212 H THR 26 H THR 26 8.131 26.910 -16.225 213 HA THR 26 HA THR 26 5.610 25.570 -15.889 214 HB THR 26 HB THR 26 7.705 24.266 -17.518 215 HG1 THR 26 HG1 THR 26 6.811 26.236 -19.043 216 1HG2 THR 26 1HG2 THR 26 5.011 25.221 -18.425 217 2HG2 THR 26 2HG2 THR 26 5.162 23.800 -17.392 218 3HG2 THR 26 3HG2 THR 26 5.943 23.830 -18.974 219 H ALA 27 H ALA 27 5.355 24.332 -14.143 220 HA ALA 27 HA ALA 27 7.534 22.473 -13.431 221 1HB ALA 27 1HB ALA 27 5.652 24.053 -11.720 222 2HB ALA 27 2HB ALA 27 7.402 23.888 -11.598 223 3HB ALA 27 3HB ALA 27 6.356 22.550 -11.124 224 HA PRO 28 HA PRO 28 4.387 19.456 -14.377 225 1HB PRO 28 1HB PRO 28 6.262 17.357 -13.964 226 2HB PRO 28 2HB PRO 28 5.804 18.094 -15.499 227 1HG PRO 28 1HG PRO 28 8.311 18.272 -14.298 228 2HG PRO 28 2HG PRO 28 7.707 19.322 -15.589 229 1HD PRO 28 1HD PRO 28 7.862 19.821 -12.652 230 2HD PRO 28 2HD PRO 28 8.068 20.953 -14.008 231 H VAL 29 H VAL 29 5.104 20.388 -11.519 232 HA VAL 29 HA VAL 29 4.440 17.931 -10.055 233 HB VAL 29 HB VAL 29 5.051 20.444 -8.584 234 1HG1 VAL 29 1HG1 VAL 29 6.459 18.620 -7.332 235 2HG1 VAL 29 2HG1 VAL 29 5.409 17.511 -8.215 236 3HG1 VAL 29 3HG1 VAL 29 4.711 18.709 -7.127 237 1HG2 VAL 29 1HG2 VAL 29 7.098 20.777 -9.380 238 2HG2 VAL 29 2HG2 VAL 29 6.778 19.579 -10.632 239 3HG2 VAL 29 3HG2 VAL 29 7.518 19.086 -9.107 240 H SER 30 H SER 30 2.446 19.118 -11.602 241 HA SER 30 HA SER 30 0.716 20.472 -9.657 242 1HB SER 30 1HB SER 30 -0.540 20.445 -12.171 243 2HB SER 30 2HB SER 30 0.301 21.807 -11.425 244 HG SER 30 HG SER 30 1.617 21.621 -13.055 245 H SER 31 H SER 31 1.361 17.543 -9.904 246 HA SER 31 HA SER 31 -1.048 16.287 -10.804 247 1HB SER 31 1HB SER 31 0.740 14.681 -9.133 248 2HB SER 31 2HB SER 31 0.219 14.421 -10.800 249 HG SER 31 HG SER 31 1.865 15.658 -11.536 250 H GLY 32 H GLY 32 -1.008 14.257 -8.628 251 1HA GLY 32 1HA GLY 32 -2.838 15.676 -6.856 252 2HA GLY 32 2HA GLY 32 -2.634 13.935 -6.967 253 H LYS 33 H LYS 33 0.346 15.380 -6.833 254 HA LYS 33 HA LYS 33 1.966 15.635 -5.283 255 1HB LYS 33 1HB LYS 33 -0.316 15.956 -3.332 256 2HB LYS 33 2HB LYS 33 1.367 16.345 -3.005 257 1HG LYS 33 1HG LYS 33 0.401 17.663 -5.396 258 2HG LYS 33 2HG LYS 33 -0.575 18.058 -3.981 259 1HD LYS 33 1HD LYS 33 1.000 19.602 -3.579 260 2HD LYS 33 2HD LYS 33 1.954 18.244 -2.981 261 1HE LYS 33 1HE LYS 33 3.473 19.000 -4.461 262 2HE LYS 33 2HE LYS 33 2.502 18.084 -5.611 263 1HZ LYS 33 1HZ LYS 33 1.889 20.915 -5.041 264 2HZ LYS 33 2HZ LYS 33 1.496 19.991 -6.408 265 3HZ LYS 33 3HZ LYS 33 3.094 20.499 -6.159 266 H ILE 34 H ILE 34 0.343 13.023 -5.710 267 HA ILE 34 HA ILE 34 1.951 11.486 -3.823 268 HB ILE 34 HB ILE 34 -1.042 11.284 -4.086 269 1HG1 ILE 34 1HG1 ILE 34 0.859 11.238 -1.734 270 2HG1 ILE 34 2HG1 ILE 34 -0.155 12.590 -2.225 271 1HG2 ILE 34 1HG2 ILE 34 0.595 9.086 -2.860 272 2HG2 ILE 34 2HG2 ILE 34 0.131 9.057 -4.562 273 3HG2 ILE 34 3HG2 ILE 34 -1.112 9.078 -3.310 274 1HD1 ILE 34 1HD1 ILE 34 -1.192 9.921 -1.303 275 2HD1 ILE 34 2HD1 ILE 34 -2.140 11.364 -1.657 276 3HD1 ILE 34 3HD1 ILE 34 -1.033 11.354 -0.286 277 H LYS 35 H LYS 35 2.877 9.799 -4.785 278 HA LYS 35 HA LYS 35 2.098 9.211 -7.562 279 1HB LYS 35 1HB LYS 35 4.789 8.449 -6.561 280 2HB LYS 35 2HB LYS 35 4.313 9.089 -8.128 281 1HG LYS 35 1HG LYS 35 3.992 11.009 -5.961 282 2HG LYS 35 2HG LYS 35 5.656 10.457 -6.168 283 1HD LYS 35 1HD LYS 35 5.304 12.420 -7.515 284 2HD LYS 35 2HD LYS 35 5.491 11.025 -8.578 285 1HE LYS 35 1HE LYS 35 3.232 11.002 -9.146 286 2HE LYS 35 2HE LYS 35 2.767 11.933 -7.722 287 1HZ LYS 35 1HZ LYS 35 3.343 13.898 -8.694 288 2HZ LYS 35 2HZ LYS 35 2.894 13.035 -10.087 289 3HZ LYS 35 3HZ LYS 35 4.530 13.200 -9.688 290 H ARG 36 H ARG 36 1.889 7.098 -8.220 291 HA ARG 36 HA ARG 36 1.570 5.180 -6.019 292 1HB ARG 36 1HB ARG 36 -0.179 5.935 -7.955 293 2HB ARG 36 2HB ARG 36 0.534 4.513 -8.703 294 1HG ARG 36 1HG ARG 36 -0.370 3.087 -7.181 295 2HG ARG 36 2HG ARG 36 -0.372 4.292 -5.890 296 1HD ARG 36 1HD ARG 36 -2.645 3.742 -6.634 297 2HD ARG 36 2HD ARG 36 -2.243 5.434 -6.926 298 HE ARG 36 HE ARG 36 -1.714 3.775 -9.199 299 1HH1 ARG 36 1HH1 ARG 36 -4.215 5.542 -7.494 300 2HH1 ARG 36 2HH1 ARG 36 -5.247 5.678 -8.887 301 1HH2 ARG 36 1HH2 ARG 36 -3.041 3.977 -11.035 302 2HH2 ARG 36 2HH2 ARG 36 -4.576 4.781 -10.910 303 H VAL 37 H VAL 37 2.829 3.450 -5.834 304 HA VAL 37 HA VAL 37 4.301 2.503 -8.198 305 HB VAL 37 HB VAL 37 5.486 2.975 -5.455 306 1HG1 VAL 37 1HG1 VAL 37 7.023 1.853 -7.767 307 2HG1 VAL 37 2HG1 VAL 37 6.133 0.792 -6.677 308 3HG1 VAL 37 3HG1 VAL 37 7.413 1.826 -6.048 309 1HG2 VAL 37 1HG2 VAL 37 6.622 4.723 -6.318 310 2HG2 VAL 37 2HG2 VAL 37 5.275 4.758 -7.454 311 3HG2 VAL 37 3HG2 VAL 37 6.790 3.975 -7.905 312 H ASN 38 H ASN 38 4.066 0.406 -8.522 313 HA ASN 38 HA ASN 38 3.138 -1.300 -6.301 314 1HB ASN 38 1HB ASN 38 1.470 -1.593 -7.854 315 2HB ASN 38 2HB ASN 38 2.517 -1.205 -9.210 316 1HD2 ASN 38 1HD2 ASN 38 1.247 -3.691 -7.195 317 2HD2 ASN 38 2HD2 ASN 38 1.905 -5.033 -8.076 318 H VAL 39 H VAL 39 4.515 -2.812 -5.579 319 HA VAL 39 HA VAL 39 6.900 -3.373 -7.230 320 HB VAL 39 HB VAL 39 7.156 -3.845 -4.340 321 1HG1 VAL 39 1HG1 VAL 39 8.816 -2.539 -6.479 322 2HG1 VAL 39 2HG1 VAL 39 9.082 -4.087 -5.678 323 3HG1 VAL 39 3HG1 VAL 39 9.301 -2.581 -4.784 324 1HG2 VAL 39 1HG2 VAL 39 7.445 -0.987 -4.995 325 2HG2 VAL 39 2HG2 VAL 39 6.909 -1.764 -3.506 326 3HG2 VAL 39 3HG2 VAL 39 5.789 -1.578 -4.856 327 H ASN 40 H ASN 40 7.889 -5.438 -7.044 328 HA ASN 40 HA ASN 40 6.075 -7.560 -6.097 329 1HB ASN 40 1HB ASN 40 6.212 -7.731 -8.490 330 2HB ASN 40 2HB ASN 40 7.961 -7.537 -8.463 331 1HD2 ASN 40 1HD2 ASN 40 9.232 -9.285 -8.213 332 2HD2 ASN 40 2HD2 ASN 40 8.638 -10.900 -8.007 333 H PHE 41 H PHE 41 6.841 -8.728 -4.480 334 HA PHE 41 HA PHE 41 9.708 -8.548 -3.846 335 1HB PHE 41 1HB PHE 41 7.404 -9.232 -2.008 336 2HB PHE 41 2HB PHE 41 9.091 -9.067 -1.534 337 HD1 PHE 41 HD1 PHE 41 9.918 -6.629 -2.882 338 HD2 PHE 41 HD2 PHE 41 6.249 -7.578 -0.949 339 HE1 PHE 41 HE1 PHE 41 9.537 -4.241 -2.437 340 HE2 PHE 41 HE2 PHE 41 5.859 -5.193 -0.506 341 HZ PHE 41 HZ PHE 41 7.502 -3.523 -1.252 342 H ASP 42 H ASP 42 10.684 -10.443 -2.881 343 HA ASP 42 HA ASP 42 9.937 -12.898 -4.208 344 1HB ASP 42 1HB ASP 42 12.323 -12.150 -3.781 345 2HB ASP 42 2HB ASP 42 12.048 -12.473 -2.078 346 H GLU 43 H GLU 43 9.740 -14.926 -2.849 347 HA GLU 43 HA GLU 43 7.661 -14.697 -0.941 348 1HB GLU 43 1HB GLU 43 8.536 -16.741 -2.408 349 2HB GLU 43 2HB GLU 43 9.435 -17.089 -0.935 350 1HG GLU 43 1HG GLU 43 7.577 -18.265 -0.452 351 2HG GLU 43 2HG GLU 43 7.035 -16.698 0.140 352 H GLU 44 H GLU 44 11.144 -14.837 -0.743 353 HA GLU 44 HA GLU 44 11.405 -15.180 2.068 354 1HB GLU 44 1HB GLU 44 13.139 -15.088 -0.032 355 2HB GLU 44 2HB GLU 44 13.409 -13.517 0.716 356 1HG GLU 44 1HG GLU 44 14.899 -14.664 1.941 357 2HG GLU 44 2HG GLU 44 13.474 -15.081 2.894 358 H LYS 45 H LYS 45 11.449 -12.330 -0.029 359 HA LYS 45 HA LYS 45 11.853 -10.419 1.958 360 1HB LYS 45 1HB LYS 45 10.589 -10.280 -0.767 361 2HB LYS 45 2HB LYS 45 10.675 -8.864 0.269 362 1HG LYS 45 1HG LYS 45 13.209 -9.471 0.392 363 2HG LYS 45 2HG LYS 45 12.858 -10.343 -1.103 364 1HD LYS 45 1HD LYS 45 12.616 -8.453 -2.290 365 2HD LYS 45 2HD LYS 45 11.733 -7.643 -0.995 366 1HE LYS 45 1HE LYS 45 13.557 -6.412 -0.677 367 2HE LYS 45 2HE LYS 45 14.315 -7.861 -0.017 368 1HZ LYS 45 1HZ LYS 45 14.973 -8.397 -2.361 369 2HZ LYS 45 2HZ LYS 45 15.749 -7.052 -1.684 370 3HZ LYS 45 3HZ LYS 45 14.480 -6.829 -2.789 371 H HIS 46 H HIS 46 8.957 -12.052 0.907 372 HA HIS 46 HA HIS 46 7.219 -10.162 2.204 373 1HB HIS 46 1HB HIS 46 6.723 -11.811 0.191 374 2HB HIS 46 2HB HIS 46 6.209 -12.871 1.505 375 HD1 HIS 46 HD1 HIS 46 3.887 -12.535 2.317 376 HD2 HIS 46 HD2 HIS 46 5.354 -9.186 0.317 377 HE1 HIS 46 HE1 HIS 46 1.962 -10.912 2.198 378 HE2 HIS 46 HE2 HIS 46 2.823 -8.963 0.844 379 H THR 47 H THR 47 8.519 -13.355 3.008 380 HA THR 47 HA THR 47 6.993 -13.623 5.404 381 HB THR 47 HB THR 47 9.193 -15.102 5.946 382 HG1 THR 47 HG1 THR 47 8.978 -15.251 3.112 383 1HG2 THR 47 1HG2 THR 47 6.987 -16.019 5.910 384 2HG2 THR 47 2HG2 THR 47 7.975 -16.984 4.813 385 3HG2 THR 47 3HG2 THR 47 6.859 -15.782 4.166 386 H ARG 48 H ARG 48 10.104 -12.255 4.549 387 HA ARG 48 HA ARG 48 10.952 -11.530 7.160 388 1HB ARG 48 1HB ARG 48 12.264 -11.536 4.903 389 2HB ARG 48 2HB ARG 48 11.599 -9.919 4.710 390 1HG ARG 48 1HG ARG 48 13.699 -9.585 5.666 391 2HG ARG 48 2HG ARG 48 12.568 -9.420 7.012 392 1HD ARG 48 1HD ARG 48 14.319 -10.761 7.828 393 2HD ARG 48 2HD ARG 48 12.994 -11.870 7.480 394 HE ARG 48 HE ARG 48 15.049 -11.501 5.429 395 1HH1 ARG 48 1HH1 ARG 48 13.658 -13.496 7.954 396 2HH1 ARG 48 2HH1 ARG 48 14.423 -14.954 7.393 397 1HH2 ARG 48 1HH2 ARG 48 16.044 -13.398 4.694 398 2HH2 ARG 48 2HH2 ARG 48 15.769 -14.909 5.521 399 H PHE 49 H PHE 49 9.177 -9.821 4.618 400 HA PHE 49 HA PHE 49 8.808 -7.367 5.849 401 1HB PHE 49 1HB PHE 49 7.779 -8.726 3.582 402 2HB PHE 49 2HB PHE 49 6.395 -8.129 4.487 403 HD1 PHE 49 HD1 PHE 49 9.656 -6.456 4.415 404 HD2 PHE 49 HD2 PHE 49 5.695 -6.523 2.870 405 HE1 PHE 49 HE1 PHE 49 10.001 -4.217 3.459 406 HE2 PHE 49 HE2 PHE 49 6.030 -4.287 1.901 407 HZ PHE 49 HZ PHE 49 8.152 -3.155 2.132 408 H LYS 50 H LYS 50 6.612 -10.156 5.886 409 HA LYS 50 HA LYS 50 4.709 -9.092 7.611 410 1HB LYS 50 1HB LYS 50 5.501 -11.965 7.127 411 2HB LYS 50 2HB LYS 50 4.075 -11.483 8.037 412 1HG LYS 50 1HG LYS 50 4.458 -10.448 5.266 413 2HG LYS 50 2HG LYS 50 3.888 -12.100 5.514 414 1HD LYS 50 1HD LYS 50 2.600 -9.734 6.851 415 2HD LYS 50 2HD LYS 50 2.115 -10.287 5.246 416 1HE LYS 50 1HE LYS 50 0.976 -12.024 6.079 417 2HE LYS 50 2HE LYS 50 2.276 -12.448 7.191 418 1HZ LYS 50 1HZ LYS 50 0.373 -11.867 8.465 419 2HZ LYS 50 2HZ LYS 50 0.151 -10.420 7.609 420 3HZ LYS 50 3HZ LYS 50 1.488 -10.601 8.632 421 H ALA 51 H ALA 51 7.469 -11.205 8.407 422 HA ALA 51 HA ALA 51 6.905 -11.300 11.172 423 1HB ALA 51 1HB ALA 51 8.800 -12.432 9.393 424 2HB ALA 51 2HB ALA 51 8.411 -12.918 11.045 425 3HB ALA 51 3HB ALA 51 9.679 -11.727 10.751 426 H ALA 52 H ALA 52 9.332 -9.404 9.364 427 HA ALA 52 HA ALA 52 10.402 -8.161 11.647 428 1HB ALA 52 1HB ALA 52 11.899 -7.305 10.235 429 2HB ALA 52 2HB ALA 52 10.657 -6.607 9.194 430 3HB ALA 52 3HB ALA 52 11.108 -8.301 9.016 431 H CYS 53 H CYS 53 7.810 -7.149 9.436 432 HA CYS 53 HA CYS 53 7.550 -4.552 10.548 433 1HB CYS 53 1HB CYS 53 5.583 -4.314 9.269 434 2HB CYS 53 2HB CYS 53 6.647 -5.327 8.304 435 HG CYS 53 HG CYS 53 5.284 -7.621 8.561 436 H ALA 54 H ALA 54 6.124 -7.692 11.276 437 HA ALA 54 HA ALA 54 4.203 -6.823 13.147 438 1HB ALA 54 1HB ALA 54 4.946 -9.243 12.074 439 2HB ALA 54 2HB ALA 54 3.741 -9.001 13.338 440 3HB ALA 54 3HB ALA 54 5.403 -9.403 13.770 441 H ARG 55 H ARG 55 7.612 -7.635 13.414 442 HA ARG 55 HA ARG 55 7.922 -7.632 16.186 443 1HB ARG 55 1HB ARG 55 9.771 -6.908 13.922 444 2HB ARG 55 2HB ARG 55 10.297 -6.813 15.597 445 1HG ARG 55 1HG ARG 55 9.796 -9.199 15.873 446 2HG ARG 55 2HG ARG 55 9.321 -9.278 14.175 447 1HD ARG 55 1HD ARG 55 11.681 -8.259 13.754 448 2HD ARG 55 2HD ARG 55 12.031 -8.873 15.368 449 HE ARG 55 HE ARG 55 11.200 -11.092 14.383 450 1HH1 ARG 55 1HH1 ARG 55 12.873 -8.618 12.535 451 2HH1 ARG 55 2HH1 ARG 55 13.590 -9.768 11.436 452 1HH2 ARG 55 1HH2 ARG 55 12.164 -12.577 12.948 453 2HH2 ARG 55 2HH2 ARG 55 13.212 -11.996 11.684 454 H LYS 56 H LYS 56 8.203 -4.947 13.872 455 HA LYS 56 HA LYS 56 8.545 -3.075 16.069 456 1HB LYS 56 1HB LYS 56 9.490 -3.191 13.443 457 2HB LYS 56 2HB LYS 56 8.345 -1.857 13.450 458 1HG LYS 56 1HG LYS 56 9.598 -1.052 15.537 459 2HG LYS 56 2HG LYS 56 10.857 -2.184 15.046 460 1HD LYS 56 1HD LYS 56 11.644 -0.498 13.800 461 2HD LYS 56 2HD LYS 56 10.304 -0.860 12.710 462 1HE LYS 56 1HE LYS 56 9.540 1.195 13.054 463 2HE LYS 56 2HE LYS 56 9.227 0.750 14.731 464 1HZ LYS 56 1HZ LYS 56 10.686 2.778 14.278 465 2HZ LYS 56 2HZ LYS 56 11.902 1.672 13.869 466 3HZ LYS 56 3HZ LYS 56 11.232 1.658 15.429 467 H GLY 57 H GLY 57 5.912 -4.482 15.073 468 1HA GLY 57 1HA GLY 57 3.674 -3.955 14.999 469 2HA GLY 57 2HA GLY 57 4.107 -2.581 16.005 470 H THR 58 H THR 58 5.002 -3.335 12.675 471 HA THR 58 HA THR 58 4.031 -0.676 11.895 472 HB THR 58 HB THR 58 5.996 -2.400 10.392 473 HG1 THR 58 HG1 THR 58 6.314 -1.167 12.778 474 1HG2 THR 58 1HG2 THR 58 4.836 -0.369 9.335 475 2HG2 THR 58 2HG2 THR 58 6.595 -0.456 9.237 476 3HG2 THR 58 3HG2 THR 58 5.828 0.600 10.428 477 H SER 59 H SER 59 2.623 -0.391 10.254 478 HA SER 59 HA SER 59 1.142 -2.654 9.275 479 1HB SER 59 1HB SER 59 0.856 0.064 8.075 480 2HB SER 59 2HB SER 59 -0.392 -1.105 8.520 481 HG SER 59 HG SER 59 0.699 -0.510 10.779 482 H ILE 60 H ILE 60 1.198 -3.552 7.263 483 HA ILE 60 HA ILE 60 3.598 -3.802 6.010 484 HB ILE 60 HB ILE 60 1.958 -5.442 5.588 485 1HG1 ILE 60 1HG1 ILE 60 1.770 -4.635 2.841 486 2HG1 ILE 60 2HG1 ILE 60 3.352 -4.182 3.467 487 1HG2 ILE 60 1HG2 ILE 60 0.204 -3.906 3.818 488 2HG2 ILE 60 2HG2 ILE 60 0.137 -3.436 5.519 489 3HG2 ILE 60 3HG2 ILE 60 -0.187 -5.107 5.052 490 1HD1 ILE 60 1HD1 ILE 60 2.990 -6.754 4.403 491 2HD1 ILE 60 2HD1 ILE 60 3.970 -6.266 3.023 492 3HD1 ILE 60 3HD1 ILE 60 2.305 -6.788 2.779 493 H THR 61 H THR 61 1.004 -1.561 5.017 494 HA THR 61 HA THR 61 2.338 -0.597 2.726 495 HB THR 61 HB THR 61 0.526 1.213 4.249 496 HG1 THR 61 HG1 THR 61 -0.359 -1.133 2.861 497 1HG2 THR 61 1HG2 THR 61 -0.170 1.921 2.139 498 2HG2 THR 61 2HG2 THR 61 0.329 0.416 1.362 499 3HG2 THR 61 3HG2 THR 61 1.544 1.583 1.893 500 H ASP 62 H ASP 62 2.345 0.392 6.085 501 HA ASP 62 HA ASP 62 3.804 2.791 5.789 502 1HB ASP 62 1HB ASP 62 2.446 1.855 7.818 503 2HB ASP 62 2HB ASP 62 3.973 1.098 8.259 504 H VAL 63 H VAL 63 4.733 -0.564 6.280 505 HA VAL 63 HA VAL 63 7.444 -0.256 6.826 506 HB VAL 63 HB VAL 63 6.204 -2.454 5.161 507 1HG1 VAL 63 1HG1 VAL 63 8.236 -3.533 6.667 508 2HG1 VAL 63 2HG1 VAL 63 8.887 -1.969 6.174 509 3HG1 VAL 63 3HG1 VAL 63 8.321 -3.114 4.957 510 1HG2 VAL 63 1HG2 VAL 63 6.039 -1.840 8.017 511 2HG2 VAL 63 2HG2 VAL 63 6.535 -3.491 7.649 512 3HG2 VAL 63 3HG2 VAL 63 5.016 -2.864 7.008 513 H VAL 64 H VAL 64 5.875 -0.755 3.669 514 HA VAL 64 HA VAL 64 8.196 -0.606 2.131 515 HB VAL 64 HB VAL 64 5.731 0.505 0.910 516 1HG1 VAL 64 1HG1 VAL 64 7.223 -1.847 -0.122 517 2HG1 VAL 64 2HG1 VAL 64 8.040 -0.286 -0.123 518 3HG1 VAL 64 3HG1 VAL 64 6.519 -0.483 -0.989 519 1HG2 VAL 64 1HG2 VAL 64 4.995 -1.286 2.551 520 2HG2 VAL 64 2HG2 VAL 64 5.884 -2.429 1.543 521 3HG2 VAL 64 3HG2 VAL 64 4.533 -1.520 0.867 522 H ASN 65 H ASN 65 5.947 1.978 3.103 523 HA ASN 65 HA ASN 65 7.254 4.039 1.669 524 1HB ASN 65 1HB ASN 65 4.982 3.889 3.213 525 2HB ASN 65 2HB ASN 65 6.047 4.887 4.201 526 1HD2 ASN 65 1HD2 ASN 65 3.694 5.066 2.008 527 2HD2 ASN 65 2HD2 ASN 65 4.099 6.556 1.222 528 H GLN 66 H GLN 66 7.818 2.595 4.808 529 HA GLN 66 HA GLN 66 9.584 4.527 5.845 530 1HB GLN 66 1HB GLN 66 8.547 2.028 6.651 531 2HB GLN 66 2HB GLN 66 10.299 1.892 6.736 532 1HG GLN 66 1HG GLN 66 10.302 2.996 8.647 533 2HG GLN 66 2HG GLN 66 9.551 4.389 7.860 534 1HE2 GLN 66 1HE2 GLN 66 7.248 4.459 7.769 535 2HE2 GLN 66 2HE2 GLN 66 6.293 3.667 8.979 536 H LEU 67 H LEU 67 10.266 1.466 4.110 537 HA LEU 67 HA LEU 67 13.069 1.827 4.199 538 1HB LEU 67 1HB LEU 67 12.888 0.193 2.116 539 2HB LEU 67 2HB LEU 67 12.678 -0.350 3.768 540 HG LEU 67 HG LEU 67 10.124 0.381 2.986 541 1HD1 LEU 67 1HD1 LEU 67 11.319 0.350 0.639 542 2HD1 LEU 67 2HD1 LEU 67 9.705 -0.326 0.854 543 3HD1 LEU 67 3HD1 LEU 67 11.110 -1.394 0.813 544 1HD2 LEU 67 1HD2 LEU 67 10.774 -1.514 4.382 545 2HD2 LEU 67 2HD2 LEU 67 11.437 -2.335 2.964 546 3HD2 LEU 67 3HD2 LEU 67 9.702 -2.019 3.071 547 H VAL 68 H VAL 68 10.624 2.838 1.911 548 HA VAL 68 HA VAL 68 12.341 3.621 -0.195 549 HB VAL 68 HB VAL 68 9.659 4.752 0.635 550 1HG1 VAL 68 1HG1 VAL 68 9.632 5.517 -1.807 551 2HG1 VAL 68 2HG1 VAL 68 11.383 5.300 -1.763 552 3HG1 VAL 68 3HG1 VAL 68 10.608 6.447 -0.671 553 1HG2 VAL 68 1HG2 VAL 68 10.469 2.358 -0.755 554 2HG2 VAL 68 2HG2 VAL 68 9.439 3.367 -1.770 555 3HG2 VAL 68 3HG2 VAL 68 8.874 2.843 -0.184 556 H ASP 69 H ASP 69 11.060 5.308 2.619 557 HA ASP 69 HA ASP 69 12.338 7.795 2.207 558 1HB ASP 69 1HB ASP 69 10.526 7.612 3.791 559 2HB ASP 69 2HB ASP 69 11.403 6.406 4.727 560 H ASN 70 H ASN 70 13.232 4.933 4.074 561 HA ASN 70 HA ASN 70 15.552 5.766 5.276 562 1HB ASN 70 1HB ASN 70 14.447 3.162 4.426 563 2HB ASN 70 2HB ASN 70 16.188 3.186 4.672 564 1HD2 ASN 70 1HD2 ASN 70 13.075 3.526 6.163 565 2HD2 ASN 70 2HD2 ASN 70 13.617 3.361 7.801 566 H TRP 71 H TRP 71 15.527 3.816 2.302 567 HA TRP 71 HA TRP 71 18.252 4.153 1.776 568 1HB TRP 71 1HB TRP 71 16.727 2.351 0.879 569 2HB TRP 71 2HB TRP 71 16.137 3.530 -0.287 570 HD1 TRP 71 HD1 TRP 71 19.386 1.679 0.665 571 HE1 TRP 71 HE1 TRP 71 20.862 1.524 -1.439 572 HE3 TRP 71 HE3 TRP 71 16.551 4.481 -2.539 573 HZ2 TRP 71 HZ2 TRP 71 20.824 2.450 -4.102 574 HZ3 TRP 71 HZ3 TRP 71 17.338 4.792 -4.846 575 HH2 TRP 71 HH2 TRP 71 19.431 3.794 -5.616 576 H LEU 72 H LEU 72 15.450 5.944 0.568 577 HA LEU 72 HA LEU 72 16.789 7.441 -1.378 578 1HB LEU 72 1HB LEU 72 14.210 7.427 -0.148 579 2HB LEU 72 2HB LEU 72 14.789 9.079 -0.233 580 HG LEU 72 HG LEU 72 14.821 9.093 -2.559 581 1HD1 LEU 72 1HD1 LEU 72 14.234 6.504 -3.454 582 2HD1 LEU 72 2HD1 LEU 72 15.530 6.327 -2.270 583 3HD1 LEU 72 3HD1 LEU 72 15.742 7.401 -3.656 584 1HD2 LEU 72 1HD2 LEU 72 12.578 7.174 -2.377 585 2HD2 LEU 72 2HD2 LEU 72 12.632 8.797 -3.062 586 3HD2 LEU 72 3HD2 LEU 72 12.521 8.582 -1.315 587 H LYS 73 H LYS 73 16.056 8.299 1.999 588 HA LYS 73 HA LYS 73 17.396 10.788 1.909 589 1HB LYS 73 1HB LYS 73 16.547 9.001 4.174 590 2HB LYS 73 2HB LYS 73 17.368 10.533 4.451 591 1HG LYS 73 1HG LYS 73 15.283 11.120 2.681 592 2HG LYS 73 2HG LYS 73 14.598 10.019 3.880 593 1HD LYS 73 1HD LYS 73 15.879 11.599 5.559 594 2HD LYS 73 2HD LYS 73 15.734 12.751 4.230 595 1HE LYS 73 1HE LYS 73 13.814 13.150 5.472 596 2HE LYS 73 2HE LYS 73 13.245 12.061 4.208 597 1HZ LYS 73 1HZ LYS 73 14.163 10.964 6.784 598 2HZ LYS 73 2HZ LYS 73 13.058 10.313 5.668 599 3HZ LYS 73 3HZ LYS 73 12.600 11.615 6.651 600 H GLU 74 H GLU 74 18.513 7.543 2.406 601 HA GLU 74 HA GLU 74 20.981 8.256 3.654 602 1HB GLU 74 1HB GLU 74 19.937 5.740 2.379 603 2HB GLU 74 2HB GLU 74 21.607 5.859 2.920 604 1HG GLU 74 1HG GLU 74 19.657 6.720 4.916 605 2HG GLU 74 2HG GLU 74 19.494 5.032 4.431 606 H ASN 75 H ASN 75 20.102 7.300 0.336 607 HA ASN 75 HA ASN 75 22.808 7.653 -0.570 608 1HB ASN 75 1HB ASN 75 22.156 6.692 -2.574 609 2HB ASN 75 2HB ASN 75 21.043 5.957 -1.431 610 1HD2 ASN 75 1HD2 ASN 75 18.894 6.416 -1.548 611 2HD2 ASN 75 2HD2 ASN 75 18.181 7.290 -2.861 612 H GLU 76 H GLU 76 20.009 9.667 -0.396 613 HA GLU 76 HA GLU 76 20.847 11.458 -2.479 614 1HB GLU 76 1HB GLU 76 18.620 11.326 -0.543 615 2HB GLU 76 2HB GLU 76 19.105 12.941 -1.042 616 1HG GLU 76 1HG GLU 76 18.527 10.768 -3.024 617 2HG GLU 76 2HG GLU 76 17.262 11.810 -2.370 618 1H MET 1 1H MET 1 -24.635 -58.527 -10.432 619 2H MET 1 2H MET 1 -23.892 -58.664 -11.954 620 3H MET 1 3H MET 1 -23.501 -57.369 -10.932 621 HA MET 1 HA MET 1 -21.824 -59.205 -11.043 622 1HB MET 1 1HB MET 1 -22.476 -57.464 -9.101 623 2HB MET 1 2HB MET 1 -22.762 -58.968 -8.233 624 1HG MET 1 1HG MET 1 -20.442 -59.671 -8.872 625 2HG MET 1 2HG MET 1 -20.191 -58.040 -9.492 626 1HE MET 1 1HE MET 1 -18.525 -57.279 -8.499 627 2HE MET 1 2HE MET 1 -17.928 -57.855 -6.942 628 3HE MET 1 3HE MET 1 -18.723 -56.285 -7.055 629 H SER 2 H SER 2 -24.489 -60.482 -11.542 630 HA SER 2 HA SER 2 -25.453 -62.514 -11.441 631 1HB SER 2 1HB SER 2 -22.815 -63.437 -10.281 632 2HB SER 2 2HB SER 2 -24.049 -64.457 -11.024 633 HG SER 2 HG SER 2 -22.373 -62.521 -12.240 634 H LEU 3 H LEU 3 -23.617 -63.614 -8.698 635 HA LEU 3 HA LEU 3 -26.074 -63.540 -7.113 636 1HB LEU 3 1HB LEU 3 -23.441 -64.932 -6.649 637 2HB LEU 3 2HB LEU 3 -24.815 -65.024 -5.565 638 HG LEU 3 HG LEU 3 -25.277 -65.792 -8.394 639 1HD1 LEU 3 1HD1 LEU 3 -24.538 -68.173 -7.471 640 2HD1 LEU 3 2HD1 LEU 3 -23.412 -67.174 -6.554 641 3HD1 LEU 3 3HD1 LEU 3 -23.422 -67.098 -8.313 642 1HD2 LEU 3 1HD2 LEU 3 -26.180 -66.901 -5.739 643 2HD2 LEU 3 2HD2 LEU 3 -26.730 -67.446 -7.326 644 3HD2 LEU 3 3HD2 LEU 3 -27.098 -65.810 -6.779 645 H GLU 4 H GLU 4 -23.605 -61.521 -7.622 646 HA GLU 4 HA GLU 4 -22.663 -59.773 -6.552 647 1HB GLU 4 1HB GLU 4 -24.658 -60.000 -4.326 648 2HB GLU 4 2HB GLU 4 -23.914 -58.560 -5.003 649 1HG GLU 4 1HG GLU 4 -25.577 -58.282 -6.439 650 2HG GLU 4 2HG GLU 4 -25.481 -59.958 -6.983 651 H LYS 5 H LYS 5 -23.730 -60.741 -3.424 652 HA LYS 5 HA LYS 5 -22.625 -61.402 -1.562 653 1HB LYS 5 1HB LYS 5 -22.536 -63.459 -3.290 654 2HB LYS 5 2HB LYS 5 -20.810 -63.187 -3.089 655 1HG LYS 5 1HG LYS 5 -21.081 -64.626 -1.380 656 2HG LYS 5 2HG LYS 5 -21.565 -63.163 -0.517 657 1HD LYS 5 1HD LYS 5 -23.696 -63.833 -0.339 658 2HD LYS 5 2HD LYS 5 -23.740 -64.432 -2.000 659 1HE LYS 5 1HE LYS 5 -22.331 -65.893 0.222 660 2HE LYS 5 2HE LYS 5 -24.032 -66.155 -0.158 661 1HZ LYS 5 1HZ LYS 5 -21.778 -66.522 -2.059 662 2HZ LYS 5 2HZ LYS 5 -23.414 -66.817 -2.386 663 3HZ LYS 5 3HZ LYS 5 -22.591 -67.770 -1.249 664 H ALA 6 H ALA 6 -21.667 -59.052 -2.475 665 HA ALA 6 HA ALA 6 -18.870 -58.999 -2.906 666 1HB ALA 6 1HB ALA 6 -20.782 -57.148 -3.141 667 2HB ALA 6 2HB ALA 6 -19.075 -56.741 -2.970 668 3HB ALA 6 3HB ALA 6 -20.140 -56.686 -1.566 669 H HIS 7 H HIS 7 -17.399 -59.677 -1.518 670 HA HIS 7 HA HIS 7 -17.958 -60.166 1.210 671 1HB HIS 7 1HB HIS 7 -15.723 -60.542 -0.626 672 2HB HIS 7 2HB HIS 7 -15.189 -60.124 0.998 673 HD1 HIS 7 HD1 HIS 7 -14.363 -62.798 0.266 674 HD2 HIS 7 HD2 HIS 7 -18.201 -62.090 1.703 675 HE1 HIS 7 HE1 HIS 7 -15.173 -65.011 1.149 676 HE2 HIS 7 HE2 HIS 7 -17.571 -64.601 1.824 677 H THR 8 H THR 8 -17.820 -58.909 2.936 678 HA THR 8 HA THR 8 -17.167 -56.148 2.730 679 HB THR 8 HB THR 8 -17.283 -57.586 5.364 680 HG1 THR 8 HG1 THR 8 -19.047 -58.459 4.330 681 1HG2 THR 8 1HG2 THR 8 -16.899 -55.227 5.504 682 2HG2 THR 8 2HG2 THR 8 -18.581 -55.514 5.958 683 3HG2 THR 8 3HG2 THR 8 -18.194 -54.891 4.351 684 H SER 9 H SER 9 -15.345 -55.052 3.393 685 HA SER 9 HA SER 9 -12.896 -56.333 3.124 686 1HB SER 9 1HB SER 9 -12.531 -53.934 4.621 687 2HB SER 9 2HB SER 9 -12.279 -54.193 2.895 688 HG SER 9 HG SER 9 -13.970 -52.581 3.806 689 H VAL 10 H VAL 10 -12.071 -57.795 4.441 690 HA VAL 10 HA VAL 10 -12.693 -57.816 7.270 691 HB VAL 10 HB VAL 10 -10.661 -59.629 6.002 692 1HG1 VAL 10 1HG1 VAL 10 -10.979 -60.957 7.808 693 2HG1 VAL 10 2HG1 VAL 10 -12.696 -60.571 7.927 694 3HG1 VAL 10 3HG1 VAL 10 -11.494 -59.438 8.540 695 1HG2 VAL 10 1HG2 VAL 10 -12.150 -60.415 4.544 696 2HG2 VAL 10 2HG2 VAL 10 -13.434 -59.413 5.223 697 3HG2 VAL 10 3HG2 VAL 10 -13.089 -60.995 5.920 698 H LYS 11 H LYS 11 -11.688 -56.185 8.316 699 HA LYS 11 HA LYS 11 -8.854 -55.689 7.795 700 1HB LYS 11 1HB LYS 11 -11.060 -54.065 8.629 701 2HB LYS 11 2HB LYS 11 -9.818 -54.009 9.874 702 1HG LYS 11 1HG LYS 11 -9.530 -53.288 6.968 703 2HG LYS 11 2HG LYS 11 -9.434 -52.210 8.361 704 1HD LYS 11 1HD LYS 11 -7.383 -53.195 9.079 705 2HD LYS 11 2HD LYS 11 -7.533 -54.503 7.903 706 1HE LYS 11 1HE LYS 11 -7.402 -51.644 7.021 707 2HE LYS 11 2HE LYS 11 -5.932 -52.543 7.390 708 1HZ LYS 11 1HZ LYS 11 -7.342 -52.548 5.015 709 2HZ LYS 11 2HZ LYS 11 -7.634 -54.068 5.708 710 3HZ LYS 11 3HZ LYS 11 -6.039 -53.551 5.436 711 H LYS 12 H LYS 12 -9.268 -58.126 8.868 712 HA LYS 12 HA LYS 12 -8.885 -58.004 11.746 713 1HB LYS 12 1HB LYS 12 -9.840 -59.942 9.922 714 2HB LYS 12 2HB LYS 12 -8.367 -60.599 10.623 715 1HG LYS 12 1HG LYS 12 -10.048 -61.359 12.035 716 2HG LYS 12 2HG LYS 12 -9.390 -59.960 12.885 717 1HD LYS 12 1HD LYS 12 -11.258 -58.648 11.652 718 2HD LYS 12 2HD LYS 12 -11.986 -60.240 11.423 719 1HE LYS 12 1HE LYS 12 -12.547 -60.437 13.594 720 2HE LYS 12 2HE LYS 12 -11.059 -59.672 14.152 721 1HZ LYS 12 1HZ LYS 12 -11.964 -57.546 13.831 722 2HZ LYS 12 2HZ LYS 12 -13.193 -58.434 14.584 723 3HZ LYS 12 3HZ LYS 12 -13.267 -58.128 12.917 724 H MET 13 H MET 13 -6.952 -56.563 10.707 725 HA MET 13 HA MET 13 -4.545 -57.944 11.389 726 1HB MET 13 1HB MET 13 -3.482 -58.102 9.336 727 2HB MET 13 2HB MET 13 -5.128 -58.544 8.913 728 1HG MET 13 1HG MET 13 -4.359 -55.686 8.689 729 2HG MET 13 2HG MET 13 -3.726 -56.815 7.493 730 1HE MET 13 1HE MET 13 -6.718 -58.058 5.567 731 2HE MET 13 2HE MET 13 -5.269 -58.607 6.413 732 3HE MET 13 3HE MET 13 -5.160 -57.295 5.236 733 H THR 14 H THR 14 -2.612 -56.436 10.962 734 HA THR 14 HA THR 14 -3.322 -53.774 11.853 735 HB THR 14 HB THR 14 -0.637 -53.689 11.444 736 HG1 THR 14 HG1 THR 14 -0.915 -56.279 12.487 737 1HG2 THR 14 1HG2 THR 14 -2.272 -54.608 13.786 738 2HG2 THR 14 2HG2 THR 14 -1.456 -53.063 13.537 739 3HG2 THR 14 3HG2 THR 14 -0.515 -54.510 13.891 740 H PHE 15 H PHE 15 -3.014 -51.887 10.685 741 HA PHE 15 HA PHE 15 -2.591 -52.281 7.794 742 1HB PHE 15 1HB PHE 15 -4.238 -50.776 7.357 743 2HB PHE 15 2HB PHE 15 -4.771 -51.188 8.979 744 HD1 PHE 15 HD1 PHE 15 -3.982 -49.700 10.896 745 HD2 PHE 15 HD2 PHE 15 -3.696 -48.579 6.800 746 HE1 PHE 15 HE1 PHE 15 -3.786 -47.341 11.560 747 HE2 PHE 15 HE2 PHE 15 -3.499 -46.218 7.457 748 HZ PHE 15 HZ PHE 15 -3.556 -45.590 9.827 749 H GLY 16 H GLY 16 -1.288 -50.984 10.600 750 1HA GLY 16 1HA GLY 16 1.124 -50.286 10.213 751 2HA GLY 16 2HA GLY 16 0.440 -49.136 9.071 752 H GLU 17 H GLU 17 -0.775 -50.089 12.253 753 HA GLU 17 HA GLU 17 -1.260 -47.395 13.009 754 1HB GLU 17 1HB GLU 17 -1.260 -49.915 14.687 755 2HB GLU 17 2HB GLU 17 -1.961 -48.370 15.157 756 1HG GLU 17 1HG GLU 17 -3.848 -49.327 14.403 757 2HG GLU 17 2HG GLU 17 -3.254 -48.744 12.848 758 H ASN 18 H ASN 18 1.190 -49.783 13.852 759 HA ASN 18 HA ASN 18 2.518 -48.209 15.808 760 1HB ASN 18 1HB ASN 18 4.350 -49.817 15.614 761 2HB ASN 18 2HB ASN 18 2.806 -50.658 15.676 762 1HD2 ASN 18 1HD2 ASN 18 2.055 -51.729 13.857 763 2HD2 ASN 18 2HD2 ASN 18 3.086 -52.078 12.499 764 H ARG 19 H ARG 19 2.487 -48.186 12.392 765 HA ARG 19 HA ARG 19 4.972 -46.744 12.063 766 1HB ARG 19 1HB ARG 19 3.968 -48.269 10.313 767 2HB ARG 19 2HB ARG 19 2.711 -47.063 10.078 768 1HG ARG 19 1HG ARG 19 4.004 -45.981 8.651 769 2HG ARG 19 2HG ARG 19 5.226 -45.757 9.906 770 1HD ARG 19 1HD ARG 19 4.950 -48.176 8.123 771 2HD ARG 19 2HD ARG 19 6.136 -46.887 7.926 772 HE ARG 19 HE ARG 19 6.134 -48.990 9.950 773 1HH1 ARG 19 1HH1 ARG 19 7.584 -46.063 8.685 774 2HH1 ARG 19 2HH1 ARG 19 9.052 -46.239 9.599 775 1HH2 ARG 19 1HH2 ARG 19 8.076 -49.241 11.139 776 2HH2 ARG 19 2HH2 ARG 19 9.335 -48.048 10.994 777 H ASP 20 H ASP 20 4.974 -44.798 13.030 778 HA ASP 20 HA ASP 20 2.603 -43.123 12.998 779 1HB ASP 20 1HB ASP 20 3.936 -43.168 15.039 780 2HB ASP 20 2HB ASP 20 5.363 -42.646 14.148 781 H LEU 21 H LEU 21 2.178 -41.994 11.225 782 HA LEU 21 HA LEU 21 4.270 -40.369 10.030 783 1HB LEU 21 1HB LEU 21 4.078 -42.751 8.939 784 2HB LEU 21 2HB LEU 21 2.674 -42.057 8.154 785 HG LEU 21 HG LEU 21 4.280 -40.164 7.420 786 1HD1 LEU 21 1HD1 LEU 21 6.373 -42.277 7.688 787 2HD1 LEU 21 2HD1 LEU 21 6.070 -41.155 9.015 788 3HD1 LEU 21 3HD1 LEU 21 6.554 -40.541 7.432 789 1HD2 LEU 21 1HD2 LEU 21 4.879 -42.813 6.167 790 2HD2 LEU 21 2HD2 LEU 21 4.625 -41.245 5.399 791 3HD2 LEU 21 3HD2 LEU 21 3.258 -42.128 6.084 792 H GLU 22 H GLU 22 2.505 -39.127 11.342 793 HA GLU 22 HA GLU 22 0.292 -38.407 9.549 794 1HB GLU 22 1HB GLU 22 0.692 -37.732 12.471 795 2HB GLU 22 2HB GLU 22 -0.707 -37.293 11.500 796 1HG GLU 22 1HG GLU 22 0.123 -40.140 11.937 797 2HG GLU 22 2HG GLU 22 -0.958 -39.283 13.035 798 H ARG 23 H ARG 23 1.107 -36.941 8.147 799 HA ARG 23 HA ARG 23 2.691 -34.725 9.263 800 1HB ARG 23 1HB ARG 23 2.599 -35.389 6.339 801 2HB ARG 23 2HB ARG 23 3.854 -34.558 7.244 802 1HG ARG 23 1HG ARG 23 4.938 -36.454 7.671 803 2HG ARG 23 2HG ARG 23 3.460 -37.278 8.169 804 1HD ARG 23 1HD ARG 23 4.872 -37.321 5.600 805 2HD ARG 23 2HD ARG 23 3.793 -38.514 6.321 806 HE ARG 23 HE ARG 23 1.924 -37.257 5.451 807 1HH1 ARG 23 1HH1 ARG 23 5.080 -36.323 4.239 808 2HH1 ARG 23 2HH1 ARG 23 4.450 -35.621 2.778 809 1HH2 ARG 23 1HH2 ARG 23 1.088 -36.293 3.533 810 2HH2 ARG 23 2HH2 ARG 23 2.196 -35.610 2.376 811 H VAL 24 H VAL 24 1.275 -33.156 9.730 812 HA VAL 24 HA VAL 24 -0.741 -32.457 7.701 813 HB VAL 24 HB VAL 24 -1.536 -30.944 9.737 814 1HG1 VAL 24 1HG1 VAL 24 -3.086 -32.738 10.363 815 2HG1 VAL 24 2HG1 VAL 24 -2.078 -33.901 9.506 816 3HG1 VAL 24 3HG1 VAL 24 -2.892 -32.615 8.616 817 1HG2 VAL 24 1HG2 VAL 24 -1.138 -31.825 11.874 818 2HG2 VAL 24 2HG2 VAL 24 0.447 -31.790 11.102 819 3HG2 VAL 24 3HG2 VAL 24 -0.439 -33.310 11.229 820 H VAL 25 H VAL 25 1.015 -31.461 6.467 821 HA VAL 25 HA VAL 25 1.464 -28.701 7.358 822 HB VAL 25 HB VAL 25 3.607 -29.622 7.663 823 1HG1 VAL 25 1HG1 VAL 25 3.322 -31.774 6.663 824 2HG1 VAL 25 2HG1 VAL 25 4.750 -31.017 5.957 825 3HG1 VAL 25 3HG1 VAL 25 3.239 -31.067 5.050 826 1HG2 VAL 25 1HG2 VAL 25 4.251 -27.743 6.623 827 2HG2 VAL 25 2HG2 VAL 25 3.213 -28.034 5.225 828 3HG2 VAL 25 3HG2 VAL 25 4.773 -28.848 5.351 829 H THR 26 H THR 26 0.454 -27.383 6.017 830 HA THR 26 HA THR 26 0.416 -28.016 3.148 831 HB THR 26 HB THR 26 -1.989 -26.659 3.746 832 HG1 THR 26 HG1 THR 26 -2.260 -27.317 5.768 833 1HG2 THR 26 1HG2 THR 26 -1.539 -28.313 1.926 834 2HG2 THR 26 2HG2 THR 26 -3.040 -28.611 2.802 835 3HG2 THR 26 3HG2 THR 26 -1.616 -29.595 3.134 836 H ALA 27 H ALA 27 1.599 -26.451 2.272 837 HA ALA 27 HA ALA 27 1.369 -23.715 3.309 838 1HB ALA 27 1HB ALA 27 3.329 -23.780 1.309 839 2HB ALA 27 2HB ALA 27 3.525 -25.277 2.220 840 3HB ALA 27 3HB ALA 27 3.577 -23.725 3.055 841 HA PRO 28 HA PRO 28 -1.291 -23.081 -0.252 842 1HB PRO 28 1HB PRO 28 -1.800 -20.447 0.883 843 2HB PRO 28 2HB PRO 28 -2.901 -21.818 0.725 844 1HG PRO 28 1HG PRO 28 -1.973 -20.941 3.120 845 2HG PRO 28 2HG PRO 28 -2.391 -22.634 2.809 846 1HD PRO 28 1HD PRO 28 0.304 -21.324 2.850 847 2HD PRO 28 2HD PRO 28 -0.197 -22.896 3.513 848 H VAL 29 H VAL 29 0.759 -22.947 -1.507 849 HA VAL 29 HA VAL 29 1.835 -20.285 -1.910 850 HB VAL 29 HB VAL 29 2.565 -22.794 -3.424 851 1HG1 VAL 29 1HG1 VAL 29 3.532 -21.077 -4.602 852 2HG1 VAL 29 2HG1 VAL 29 4.803 -21.430 -3.433 853 3HG1 VAL 29 3HG1 VAL 29 3.725 -20.060 -3.175 854 1HG2 VAL 29 1HG2 VAL 29 2.760 -22.911 -0.868 855 2HG2 VAL 29 2HG2 VAL 29 4.070 -21.745 -1.051 856 3HG2 VAL 29 3HG2 VAL 29 4.182 -23.326 -1.826 857 H SER 30 H SER 30 0.000 -19.249 -2.759 858 HA SER 30 HA SER 30 -1.162 -20.161 -5.243 859 1HB SER 30 1HB SER 30 -1.637 -17.400 -4.233 860 2HB SER 30 2HB SER 30 -2.789 -18.585 -4.850 861 HG SER 30 HG SER 30 -2.156 -18.031 -2.303 862 H SER 31 H SER 31 1.164 -17.813 -4.129 863 HA SER 31 HA SER 31 1.769 -17.129 -6.928 864 1HB SER 31 1HB SER 31 2.990 -15.303 -5.089 865 2HB SER 31 2HB SER 31 1.774 -14.969 -6.323 866 HG SER 31 HG SER 31 0.169 -15.353 -4.855 867 H GLY 32 H GLY 32 3.480 -18.228 -7.594 868 1HA GLY 32 1HA GLY 32 5.202 -19.569 -5.780 869 2HA GLY 32 2HA GLY 32 5.376 -19.519 -7.526 870 H LYS 33 H LYS 33 6.346 -18.182 -4.499 871 HA LYS 33 HA LYS 33 8.165 -17.021 -3.840 872 1HB LYS 33 1HB LYS 33 9.053 -18.697 -5.726 873 2HB LYS 33 2HB LYS 33 9.478 -17.174 -6.497 874 1HG LYS 33 1HG LYS 33 10.762 -16.538 -4.507 875 2HG LYS 33 2HG LYS 33 10.351 -18.081 -3.759 876 1HD LYS 33 1HD LYS 33 11.425 -19.200 -5.748 877 2HD LYS 33 2HD LYS 33 12.018 -17.606 -6.223 878 1HE LYS 33 1HE LYS 33 13.703 -18.880 -4.975 879 2HE LYS 33 2HE LYS 33 13.230 -17.404 -4.133 880 1HZ LYS 33 1HZ LYS 33 13.277 -19.918 -3.076 881 2HZ LYS 33 2HZ LYS 33 11.630 -19.646 -3.369 882 3HZ LYS 33 3HZ LYS 33 12.510 -18.567 -2.404 883 H ILE 34 H ILE 34 5.965 -15.685 -5.552 884 HA ILE 34 HA ILE 34 7.416 -13.152 -5.761 885 HB ILE 34 HB ILE 34 5.866 -12.580 -7.732 886 1HG1 ILE 34 1HG1 ILE 34 5.917 -15.235 -8.814 887 2HG1 ILE 34 2HG1 ILE 34 5.069 -15.266 -7.271 888 1HG2 ILE 34 1HG2 ILE 34 7.651 -12.852 -9.072 889 2HG2 ILE 34 2HG2 ILE 34 7.814 -14.565 -8.690 890 3HG2 ILE 34 3HG2 ILE 34 8.447 -13.351 -7.578 891 1HD1 ILE 34 1HD1 ILE 34 3.436 -13.771 -8.013 892 2HD1 ILE 34 2HD1 ILE 34 3.696 -14.862 -9.375 893 3HD1 ILE 34 3HD1 ILE 34 4.413 -13.250 -9.387 894 H LYS 35 H LYS 35 6.449 -11.516 -4.818 895 HA LYS 35 HA LYS 35 3.589 -11.713 -4.136 896 1HB LYS 35 1HB LYS 35 5.756 -10.690 -2.285 897 2HB LYS 35 2HB LYS 35 4.051 -10.904 -1.901 898 1HG LYS 35 1HG LYS 35 5.443 -13.325 -2.824 899 2HG LYS 35 2HG LYS 35 5.994 -12.674 -1.279 900 1HD LYS 35 1HD LYS 35 4.302 -14.119 -0.639 901 2HD LYS 35 2HD LYS 35 3.468 -12.565 -0.708 902 1HE LYS 35 1HE LYS 35 2.012 -13.469 -2.116 903 2HE LYS 35 2HE LYS 35 3.316 -13.641 -3.291 904 1HZ LYS 35 1HZ LYS 35 2.386 -15.643 -1.315 905 2HZ LYS 35 2HZ LYS 35 3.838 -15.810 -2.181 906 3HZ LYS 35 3HZ LYS 35 2.353 -15.756 -3.005 907 H ARG 36 H ARG 36 2.711 -9.476 -3.518 908 HA ARG 36 HA ARG 36 4.255 -7.332 -4.780 909 1HB ARG 36 1HB ARG 36 2.222 -6.640 -6.088 910 2HB ARG 36 2HB ARG 36 3.004 -8.113 -6.637 911 1HG ARG 36 1HG ARG 36 1.307 -9.458 -5.564 912 2HG ARG 36 2HG ARG 36 0.547 -8.010 -4.901 913 1HD ARG 36 1HD ARG 36 0.929 -7.862 -7.779 914 2HD ARG 36 2HD ARG 36 -0.071 -9.232 -7.298 915 HE ARG 36 HE ARG 36 -1.333 -7.422 -5.964 916 1HH1 ARG 36 1HH1 ARG 36 0.213 -6.911 -9.066 917 2HH1 ARG 36 2HH1 ARG 36 -0.927 -5.696 -9.580 918 1HH2 ARG 36 1HH2 ARG 36 -2.830 -5.824 -6.626 919 2HH2 ARG 36 2HH2 ARG 36 -2.695 -5.122 -8.217 920 H VAL 37 H VAL 37 3.511 -5.215 -4.346 921 HA VAL 37 HA VAL 37 1.455 -4.903 -2.304 922 HB VAL 37 HB VAL 37 3.865 -5.177 -1.297 923 1HG1 VAL 37 1HG1 VAL 37 3.897 -2.271 -2.100 924 2HG1 VAL 37 2HG1 VAL 37 4.953 -3.532 -2.728 925 3HG1 VAL 37 3HG1 VAL 37 5.057 -3.061 -1.032 926 1HG2 VAL 37 1HG2 VAL 37 1.947 -4.665 0.052 927 2HG2 VAL 37 2HG2 VAL 37 1.960 -2.986 -0.494 928 3HG2 VAL 37 3HG2 VAL 37 3.270 -3.594 0.518 929 H ASN 38 H ASN 38 0.685 -2.737 -2.129 930 HA ASN 38 HA ASN 38 1.400 -1.025 -4.423 931 1HB ASN 38 1HB ASN 38 -0.899 -2.030 -4.502 932 2HB ASN 38 2HB ASN 38 -1.275 -1.164 -3.015 933 1HD2 ASN 38 1HD2 ASN 38 -0.486 -0.832 -6.397 934 2HD2 ASN 38 2HD2 ASN 38 -1.110 0.771 -6.580 935 H VAL 39 H VAL 39 2.313 0.852 -3.871 936 HA VAL 39 HA VAL 39 1.653 1.987 -1.234 937 HB VAL 39 HB VAL 39 4.287 2.796 -1.928 938 1HG1 VAL 39 1HG1 VAL 39 2.820 1.957 0.309 939 2HG1 VAL 39 2HG1 VAL 39 4.442 2.650 0.276 940 3HG1 VAL 39 3HG1 VAL 39 4.228 0.899 0.221 941 1HG2 VAL 39 1HG2 VAL 39 3.933 -0.201 -1.972 942 2HG2 VAL 39 2HG2 VAL 39 5.478 0.641 -1.836 943 3HG2 VAL 39 3HG2 VAL 39 4.506 0.812 -3.297 944 H ASN 40 H ASN 40 1.865 4.243 -1.033 945 HA ASN 40 HA ASN 40 1.974 5.732 -3.572 946 1HB ASN 40 1HB ASN 40 0.006 5.959 -1.305 947 2HB ASN 40 2HB ASN 40 0.362 7.351 -2.314 948 1HD2 ASN 40 1HD2 ASN 40 -1.298 4.372 -2.069 949 2HD2 ASN 40 2HD2 ASN 40 -2.061 4.417 -3.627 950 H PHE 41 H PHE 41 3.497 7.227 -3.593 951 HA PHE 41 HA PHE 41 4.648 8.105 -1.019 952 1HB PHE 41 1HB PHE 41 6.093 7.963 -3.675 953 2HB PHE 41 2HB PHE 41 6.801 8.254 -2.088 954 HD1 PHE 41 HD1 PHE 41 6.079 6.289 -0.339 955 HD2 PHE 41 HD2 PHE 41 6.513 5.901 -4.554 956 HE1 PHE 41 HE1 PHE 41 6.478 3.878 -0.076 957 HE2 PHE 41 HE2 PHE 41 6.908 3.487 -4.297 958 HZ PHE 41 HZ PHE 41 6.887 2.475 -2.053 959 H ASP 42 H ASP 42 5.791 10.256 -1.182 960 HA ASP 42 HA ASP 42 3.970 12.136 -2.430 961 1HB ASP 42 1HB ASP 42 4.611 13.611 -0.842 962 2HB ASP 42 2HB ASP 42 5.250 12.181 -0.042 963 H GLU 43 H GLU 43 5.052 14.169 -3.401 964 HA GLU 43 HA GLU 43 6.246 13.390 -5.808 965 1HB GLU 43 1HB GLU 43 6.141 16.141 -4.569 966 2HB GLU 43 2HB GLU 43 6.465 15.787 -6.262 967 1HG GLU 43 1HG GLU 43 3.959 14.751 -5.053 968 2HG GLU 43 2HG GLU 43 4.067 16.472 -5.424 969 H GLU 44 H GLU 44 7.668 14.777 -2.874 970 HA GLU 44 HA GLU 44 10.260 15.230 -3.891 971 1HB GLU 44 1HB GLU 44 9.016 15.015 -1.222 972 2HB GLU 44 2HB GLU 44 10.736 14.653 -1.290 973 1HG GLU 44 1HG GLU 44 9.714 17.126 -2.597 974 2HG GLU 44 2HG GLU 44 9.894 17.086 -0.844 975 H LYS 45 H LYS 45 8.760 12.451 -2.345 976 HA LYS 45 HA LYS 45 10.990 10.758 -2.205 977 1HB LYS 45 1HB LYS 45 8.129 10.556 -1.886 978 2HB LYS 45 2HB LYS 45 8.732 9.161 -2.771 979 1HG LYS 45 1HG LYS 45 9.359 8.252 -0.860 980 2HG LYS 45 2HG LYS 45 10.501 9.577 -0.618 981 1HD LYS 45 1HD LYS 45 7.808 10.400 0.019 982 2HD LYS 45 2HD LYS 45 8.263 8.963 0.939 983 1HE LYS 45 1HE LYS 45 8.944 10.772 2.271 984 2HE LYS 45 2HE LYS 45 10.419 10.200 1.492 985 1HZ LYS 45 1HZ LYS 45 10.626 12.078 0.294 986 2HZ LYS 45 2HZ LYS 45 9.692 12.750 1.536 987 3HZ LYS 45 3HZ LYS 45 8.952 12.284 0.084 988 H HIS 46 H HIS 46 8.903 11.649 -4.839 989 HA HIS 46 HA HIS 46 9.860 9.526 -6.552 990 1HB HIS 46 1HB HIS 46 7.521 10.694 -6.580 991 2HB HIS 46 2HB HIS 46 8.341 11.882 -7.589 992 HD1 HIS 46 HD1 HIS 46 8.460 11.355 -10.017 993 HD2 HIS 46 HD2 HIS 46 7.762 7.968 -7.700 994 HE1 HIS 46 HE1 HIS 46 8.089 9.469 -11.648 995 HE2 HIS 46 HE2 HIS 46 7.519 7.470 -10.226 996 H THR 47 H THR 47 10.484 12.953 -6.073 997 HA THR 47 HA THR 47 12.116 13.276 -8.392 998 HB THR 47 HB THR 47 12.438 14.898 -5.877 999 HG1 THR 47 HG1 THR 47 10.144 14.523 -7.219 1000 1HG2 THR 47 1HG2 THR 47 12.739 15.444 -8.826 1001 2HG2 THR 47 2HG2 THR 47 13.980 15.517 -7.575 1002 3HG2 THR 47 3HG2 THR 47 12.696 16.725 -7.616 1003 H ARG 48 H ARG 48 12.703 12.427 -5.025 1004 HA ARG 48 HA ARG 48 15.540 12.210 -5.204 1005 1HB ARG 48 1HB ARG 48 13.428 11.246 -3.314 1006 2HB ARG 48 2HB ARG 48 15.039 10.552 -3.208 1007 1HG ARG 48 1HG ARG 48 14.163 12.789 -1.899 1008 2HG ARG 48 2HG ARG 48 15.847 12.342 -2.156 1009 1HD ARG 48 1HD ARG 48 16.189 13.983 -3.653 1010 2HD ARG 48 2HD ARG 48 14.596 13.793 -4.383 1011 HE ARG 48 HE ARG 48 13.693 15.253 -2.749 1012 1HH1 ARG 48 1HH1 ARG 48 17.187 14.921 -2.540 1013 2HH1 ARG 48 2HH1 ARG 48 17.376 16.339 -1.546 1014 1HH2 ARG 48 1HH2 ARG 48 13.948 17.091 -1.436 1015 2HH2 ARG 48 2HH2 ARG 48 15.544 17.552 -0.896 1016 H PHE 49 H PHE 49 12.829 10.058 -5.753 1017 HA PHE 49 HA PHE 49 14.254 7.654 -6.110 1018 1HB PHE 49 1HB PHE 49 11.605 8.358 -6.046 1019 2HB PHE 49 2HB PHE 49 11.836 7.982 -7.751 1020 HD1 PHE 49 HD1 PHE 49 13.923 6.275 -5.348 1021 HD2 PHE 49 HD2 PHE 49 10.249 6.130 -7.481 1022 HE1 PHE 49 HE1 PHE 49 13.725 3.880 -4.831 1023 HE2 PHE 49 HE2 PHE 49 10.042 3.736 -6.967 1024 HZ PHE 49 HZ PHE 49 11.810 2.595 -5.694 1025 H LYS 50 H LYS 50 13.146 10.106 -8.432 1026 HA LYS 50 HA LYS 50 14.026 8.823 -10.761 1027 1HB LYS 50 1HB LYS 50 12.810 11.257 -10.108 1028 2HB LYS 50 2HB LYS 50 14.299 11.707 -10.925 1029 1HG LYS 50 1HG LYS 50 12.754 9.578 -12.234 1030 2HG LYS 50 2HG LYS 50 11.972 11.159 -12.178 1031 1HD LYS 50 1HD LYS 50 14.811 10.816 -13.097 1032 2HD LYS 50 2HD LYS 50 13.446 10.651 -14.202 1033 1HE LYS 50 1HE LYS 50 12.877 12.881 -14.041 1034 2HE LYS 50 2HE LYS 50 13.650 13.072 -12.468 1035 1HZ LYS 50 1HZ LYS 50 15.814 12.719 -13.709 1036 2HZ LYS 50 2HZ LYS 50 15.018 14.191 -13.978 1037 3HZ LYS 50 3HZ LYS 50 14.928 12.957 -15.135 1038 H ALA 51 H ALA 51 15.702 10.922 -8.493 1039 HA ALA 51 HA ALA 51 18.099 11.182 -9.996 1040 1HB ALA 51 1HB ALA 51 17.131 11.954 -7.374 1041 2HB ALA 51 2HB ALA 51 18.319 12.738 -8.413 1042 3HB ALA 51 3HB ALA 51 18.816 11.436 -7.332 1043 H ALA 52 H ALA 52 17.071 9.011 -7.393 1044 HA ALA 52 HA ALA 52 19.474 7.553 -7.190 1045 1HB ALA 52 1HB ALA 52 17.871 5.770 -6.216 1046 2HB ALA 52 2HB ALA 52 16.644 7.028 -6.381 1047 3HB ALA 52 3HB ALA 52 18.066 7.309 -5.374 1048 H CYS 53 H CYS 53 16.545 7.006 -9.110 1049 HA CYS 53 HA CYS 53 17.184 4.502 -10.188 1050 1HB CYS 53 1HB CYS 53 15.045 6.070 -10.375 1051 2HB CYS 53 2HB CYS 53 15.807 6.546 -11.885 1052 HG CYS 53 HG CYS 53 16.022 3.538 -12.383 1053 H ALA 54 H ALA 54 17.854 7.765 -11.442 1054 HA ALA 54 HA ALA 54 19.283 6.871 -13.727 1055 1HB ALA 54 1HB ALA 54 18.672 9.441 -12.443 1056 2HB ALA 54 2HB ALA 54 18.654 8.989 -14.147 1057 3HB ALA 54 3HB ALA 54 20.177 9.404 -13.361 1058 H ARG 55 H ARG 55 20.169 7.500 -10.422 1059 HA ARG 55 HA ARG 55 22.976 7.700 -10.851 1060 1HB ARG 55 1HB ARG 55 21.374 8.223 -8.742 1061 2HB ARG 55 2HB ARG 55 22.006 6.656 -8.258 1062 1HG ARG 55 1HG ARG 55 23.893 7.583 -7.594 1063 2HG ARG 55 2HG ARG 55 24.162 8.261 -9.202 1064 1HD ARG 55 1HD ARG 55 24.139 10.066 -7.631 1065 2HD ARG 55 2HD ARG 55 22.657 10.148 -8.581 1066 HE ARG 55 HE ARG 55 22.563 8.800 -5.986 1067 1HH1 ARG 55 1HH1 ARG 55 21.776 11.602 -7.945 1068 2HH1 ARG 55 2HH1 ARG 55 20.597 12.204 -6.821 1069 1HH2 ARG 55 1HH2 ARG 55 20.966 9.580 -4.534 1070 2HH2 ARG 55 2HH2 ARG 55 20.127 11.067 -4.902 1071 H LYS 56 H LYS 56 20.831 5.071 -9.854 1072 HA LYS 56 HA LYS 56 22.951 3.154 -9.687 1073 1HB LYS 56 1HB LYS 56 19.948 2.805 -9.748 1074 2HB LYS 56 2HB LYS 56 21.098 1.515 -9.421 1075 1HG LYS 56 1HG LYS 56 21.482 3.844 -7.719 1076 2HG LYS 56 2HG LYS 56 19.886 3.108 -7.546 1077 1HD LYS 56 1HD LYS 56 20.721 1.344 -6.465 1078 2HD LYS 56 2HD LYS 56 22.003 1.128 -7.660 1079 1HE LYS 56 1HE LYS 56 22.766 3.409 -6.305 1080 2HE LYS 56 2HE LYS 56 22.088 2.387 -5.036 1081 1HZ LYS 56 1HZ LYS 56 23.553 0.586 -5.865 1082 2HZ LYS 56 2HZ LYS 56 24.396 1.915 -5.234 1083 3HZ LYS 56 3HZ LYS 56 24.279 1.703 -6.913 1084 H GLY 57 H GLY 57 20.587 4.076 -12.122 1085 1HA GLY 57 1HA GLY 57 20.601 3.625 -14.402 1086 2HA GLY 57 2HA GLY 57 22.070 2.681 -14.180 1087 H THR 58 H THR 58 18.776 2.471 -12.872 1088 HA THR 58 HA THR 58 18.513 -0.217 -13.976 1089 HB THR 58 HB THR 58 19.598 -0.297 -11.678 1090 HG1 THR 58 HG1 THR 58 18.537 -2.121 -12.525 1091 1HG2 THR 58 1HG2 THR 58 16.890 0.129 -10.513 1092 2HG2 THR 58 2HG2 THR 58 17.897 1.538 -10.859 1093 3HG2 THR 58 3HG2 THR 58 18.476 0.282 -9.762 1094 H SER 59 H SER 59 16.285 -1.103 -13.521 1095 HA SER 59 HA SER 59 14.328 0.740 -14.384 1096 1HB SER 59 1HB SER 59 13.396 -1.769 -13.149 1097 2HB SER 59 2HB SER 59 13.089 -1.120 -14.761 1098 HG SER 59 HG SER 59 14.504 -3.108 -14.459 1099 H ILE 60 H ILE 60 12.616 1.688 -13.328 1100 HA ILE 60 HA ILE 60 13.076 2.696 -10.820 1101 HB ILE 60 HB ILE 60 11.535 3.811 -12.259 1102 1HG1 ILE 60 1HG1 ILE 60 9.459 3.158 -10.340 1103 2HG1 ILE 60 2HG1 ILE 60 11.026 3.327 -9.558 1104 1HG2 ILE 60 1HG2 ILE 60 9.812 2.894 -13.354 1105 2HG2 ILE 60 2HG2 ILE 60 9.264 1.994 -11.939 1106 3HG2 ILE 60 3HG2 ILE 60 10.578 1.361 -12.930 1107 1HD1 ILE 60 1HD1 ILE 60 9.502 5.390 -9.816 1108 2HD1 ILE 60 2HD1 ILE 60 10.080 5.399 -11.482 1109 3HD1 ILE 60 3HD1 ILE 60 11.226 5.547 -10.150 1110 H THR 61 H THR 61 11.106 -0.131 -11.652 1111 HA THR 61 HA THR 61 10.104 -0.617 -9.088 1112 HB THR 61 HB THR 61 10.569 -3.025 -10.666 1113 HG1 THR 61 HG1 THR 61 9.286 -2.324 -12.430 1114 1HG2 THR 61 1HG2 THR 61 8.854 -2.521 -8.808 1115 2HG2 THR 61 2HG2 THR 61 8.310 -3.419 -10.224 1116 3HG2 THR 61 3HG2 THR 61 7.943 -1.699 -10.076 1117 H ASP 62 H ASP 62 13.175 -1.394 -10.535 1118 HA ASP 62 HA ASP 62 13.920 -3.298 -8.506 1119 1HB ASP 62 1HB ASP 62 14.856 -2.757 -11.038 1120 2HB ASP 62 2HB ASP 62 16.114 -2.073 -10.010 1121 H VAL 63 H VAL 63 14.001 0.122 -8.888 1122 HA VAL 63 HA VAL 63 16.008 0.594 -6.871 1123 HB VAL 63 HB VAL 63 13.934 2.649 -7.534 1124 1HG1 VAL 63 1HG1 VAL 63 15.812 4.172 -7.242 1125 2HG1 VAL 63 2HG1 VAL 63 16.905 2.803 -7.029 1126 3HG1 VAL 63 3HG1 VAL 63 15.639 3.115 -5.840 1127 1HG2 VAL 63 1HG2 VAL 63 14.726 1.558 -9.679 1128 2HG2 VAL 63 2HG2 VAL 63 16.327 2.189 -9.291 1129 3HG2 VAL 63 3HG2 VAL 63 14.979 3.299 -9.544 1130 H VAL 64 H VAL 64 12.500 0.329 -7.040 1131 HA VAL 64 HA VAL 64 11.973 1.081 -4.354 1132 HB VAL 64 HB VAL 64 10.231 -1.006 -5.547 1133 1HG1 VAL 64 1HG1 VAL 64 9.051 1.517 -4.715 1134 2HG1 VAL 64 2HG1 VAL 64 10.076 0.803 -3.470 1135 3HG1 VAL 64 3HG1 VAL 64 8.738 -0.123 -4.145 1136 1HG2 VAL 64 1HG2 VAL 64 10.696 0.202 -7.555 1137 2HG2 VAL 64 2HG2 VAL 64 10.504 1.750 -6.732 1138 3HG2 VAL 64 3HG2 VAL 64 9.103 0.706 -6.981 1139 H ASN 65 H ASN 65 12.662 -1.992 -5.930 1140 HA ASN 65 HA ASN 65 12.457 -3.592 -3.601 1141 1HB ASN 65 1HB ASN 65 12.657 -4.173 -6.214 1142 2HB ASN 65 2HB ASN 65 14.341 -4.401 -5.748 1143 1HD2 ASN 65 1HD2 ASN 65 12.317 -6.328 -6.617 1144 2HD2 ASN 65 2HD2 ASN 65 12.206 -7.505 -5.345 1145 H GLN 66 H GLN 66 14.946 -1.550 -4.897 1146 HA GLN 66 HA GLN 66 17.119 -2.604 -3.389 1147 1HB GLN 66 1HB GLN 66 16.964 -0.859 -5.430 1148 2HB GLN 66 2HB GLN 66 17.122 0.273 -4.096 1149 1HG GLN 66 1HG GLN 66 19.302 -0.040 -4.131 1150 2HG GLN 66 2HG GLN 66 19.049 -1.722 -3.670 1151 1HE2 GLN 66 1HE2 GLN 66 17.520 -1.805 -6.408 1152 2HE2 GLN 66 2HE2 GLN 66 18.804 -2.109 -7.533 1153 H LEU 67 H LEU 67 14.654 -0.166 -2.799 1154 HA LEU 67 HA LEU 67 15.728 0.802 -0.345 1155 1HB LEU 67 1HB LEU 67 12.790 0.688 -0.960 1156 2HB LEU 67 2HB LEU 67 13.653 1.859 0.015 1157 HG LEU 67 HG LEU 67 14.416 1.781 -2.837 1158 1HD1 LEU 67 1HD1 LEU 67 12.184 3.437 -2.796 1159 2HD1 LEU 67 2HD1 LEU 67 11.656 1.938 -2.038 1160 3HD1 LEU 67 3HD1 LEU 67 12.359 1.909 -3.651 1161 1HD2 LEU 67 1HD2 LEU 67 13.677 4.016 -0.957 1162 2HD2 LEU 67 2HD2 LEU 67 14.420 4.183 -2.549 1163 3HD2 LEU 67 3HD2 LEU 67 15.311 3.414 -1.239 1164 H VAL 68 H VAL 68 13.381 -1.708 -1.191 1165 HA VAL 68 HA VAL 68 12.829 -2.554 1.451 1166 HB VAL 68 HB VAL 68 12.793 -4.501 -0.825 1167 1HG1 VAL 68 1HG1 VAL 68 11.660 -5.688 0.661 1168 2HG1 VAL 68 2HG1 VAL 68 10.411 -4.444 0.696 1169 3HG1 VAL 68 3HG1 VAL 68 11.767 -4.364 1.824 1170 1HG2 VAL 68 1HG2 VAL 68 11.875 -2.214 -1.544 1171 2HG2 VAL 68 2HG2 VAL 68 10.549 -2.552 -0.429 1172 3HG2 VAL 68 3HG2 VAL 68 10.856 -3.633 -1.790 1173 H ASP 69 H ASP 69 15.284 -3.424 -0.901 1174 HA ASP 69 HA ASP 69 16.389 -5.675 0.305 1175 1HB ASP 69 1HB ASP 69 17.126 -3.795 -1.743 1176 2HB ASP 69 2HB ASP 69 18.530 -4.130 -0.738 1177 H ASN 70 H ASN 70 17.223 -2.270 0.719 1178 HA ASN 70 HA ASN 70 19.229 -2.508 2.633 1179 1HB ASN 70 1HB ASN 70 18.341 -0.420 1.351 1180 2HB ASN 70 2HB ASN 70 17.217 -0.270 2.698 1181 1HD2 ASN 70 1HD2 ASN 70 18.040 0.152 4.785 1182 2HD2 ASN 70 2HD2 ASN 70 19.605 0.874 4.994 1183 H TRP 71 H TRP 71 15.816 -1.707 3.197 1184 HA TRP 71 HA TRP 71 15.775 -1.878 5.957 1185 1HB TRP 71 1HB TRP 71 13.946 -1.010 4.508 1186 2HB TRP 71 2HB TRP 71 13.548 -2.666 4.068 1187 HD1 TRP 71 HD1 TRP 71 13.310 -0.191 6.945 1188 HE1 TRP 71 HE1 TRP 71 11.622 -1.066 8.680 1189 HE3 TRP 71 HE3 TRP 71 12.491 -4.848 4.981 1190 HZ2 TRP 71 HZ2 TRP 71 10.128 -3.409 9.138 1191 HZ3 TRP 71 HZ3 TRP 71 10.893 -6.331 6.120 1192 HH2 TRP 71 HH2 TRP 71 9.742 -5.625 8.162 1193 H LEU 72 H LEU 72 14.636 -4.370 3.721 1194 HA LEU 72 HA LEU 72 13.865 -6.273 5.448 1195 1HB LEU 72 1HB LEU 72 14.057 -6.148 2.793 1196 2HB LEU 72 2HB LEU 72 15.377 -7.260 3.101 1197 HG LEU 72 HG LEU 72 13.285 -8.272 4.613 1198 1HD1 LEU 72 1HD1 LEU 72 11.322 -7.927 3.625 1199 2HD1 LEU 72 2HD1 LEU 72 12.002 -8.127 2.012 1200 3HD1 LEU 72 3HD1 LEU 72 12.097 -6.563 2.820 1201 1HD2 LEU 72 1HD2 LEU 72 13.635 -10.154 3.364 1202 2HD2 LEU 72 2HD2 LEU 72 15.096 -9.254 2.955 1203 3HD2 LEU 72 3HD2 LEU 72 13.726 -9.262 1.846 1204 H LYS 73 H LYS 73 17.166 -6.048 4.146 1205 HA LYS 73 HA LYS 73 17.887 -8.287 5.834 1206 1HB LYS 73 1HB LYS 73 19.438 -6.857 3.679 1207 2HB LYS 73 2HB LYS 73 19.946 -8.337 4.490 1208 1HG LYS 73 1HG LYS 73 18.640 -9.611 3.201 1209 2HG LYS 73 2HG LYS 73 17.253 -8.537 3.421 1210 1HD LYS 73 1HD LYS 73 17.577 -7.554 1.442 1211 2HD LYS 73 2HD LYS 73 19.311 -7.383 1.716 1212 1HE LYS 73 1HE LYS 73 19.564 -9.791 1.138 1213 2HE LYS 73 2HE LYS 73 17.857 -9.814 0.698 1214 1HZ LYS 73 1HZ LYS 73 19.141 -9.488 -1.263 1215 2HZ LYS 73 2HZ LYS 73 20.006 -8.207 -0.566 1216 3HZ LYS 73 3HZ LYS 73 18.357 -8.022 -0.918 1217 H GLU 74 H GLU 74 18.139 -4.901 6.039 1218 HA GLU 74 HA GLU 74 20.481 -5.057 7.789 1219 1HB GLU 74 1HB GLU 74 19.429 -3.050 6.077 1220 2HB GLU 74 2HB GLU 74 19.346 -2.428 7.720 1221 1HG GLU 74 1HG GLU 74 21.449 -1.929 6.399 1222 2HG GLU 74 2HG GLU 74 21.660 -2.587 8.021 1223 H ASN 75 H ASN 75 17.022 -4.558 7.907 1224 HA ASN 75 HA ASN 75 17.015 -3.629 10.620 1225 1HB ASN 75 1HB ASN 75 14.834 -3.134 10.284 1226 2HB ASN 75 2HB ASN 75 15.236 -3.399 8.590 1227 1HD2 ASN 75 1HD2 ASN 75 14.740 -5.463 7.671 1228 2HD2 ASN 75 2HD2 ASN 75 13.441 -6.408 8.314 1229 H GLU 76 H GLU 76 17.330 -6.680 9.266 1230 HA GLU 76 HA GLU 76 15.900 -8.224 11.187 1231 1HB GLU 76 1HB GLU 76 17.785 -8.750 8.989 1232 2HB GLU 76 2HB GLU 76 17.865 -9.903 10.314 1233 1HG GLU 76 1HG GLU 76 15.254 -9.160 9.059 1234 2HG GLU 76 2HG GLU 76 16.293 -10.397 8.356 Start of MODEL 8 1 1H MET 1 1H MET 1 -49.414 62.462 46.028 2 2H MET 1 2H MET 1 -49.778 61.410 44.748 3 3H MET 1 3H MET 1 -50.521 61.200 46.256 4 HA MET 1 HA MET 1 -51.315 63.653 45.808 5 1HB MET 1 1HB MET 1 -50.530 62.452 43.186 6 2HB MET 1 2HB MET 1 -51.993 63.425 43.236 7 1HG MET 1 1HG MET 1 -50.762 65.333 43.999 8 2HG MET 1 2HG MET 1 -49.292 64.372 44.167 9 1HE MET 1 1HE MET 1 -49.891 67.037 42.883 10 2HE MET 1 2HE MET 1 -50.905 66.920 41.445 11 3HE MET 1 3HE MET 1 -49.158 67.096 41.279 12 H SER 2 H SER 2 -53.641 63.759 45.239 13 HA SER 2 HA SER 2 -55.026 61.420 46.107 14 1HB SER 2 1HB SER 2 -56.586 63.488 44.691 15 2HB SER 2 2HB SER 2 -56.826 62.789 46.291 16 HG SER 2 HG SER 2 -54.875 64.091 46.872 17 H LEU 3 H LEU 3 -54.598 63.040 43.006 18 HA LEU 3 HA LEU 3 -55.688 60.668 41.653 19 1HB LEU 3 1HB LEU 3 -54.919 62.900 39.935 20 2HB LEU 3 2HB LEU 3 -56.416 61.987 39.987 21 HG LEU 3 HG LEU 3 -55.988 63.939 42.177 22 1HD1 LEU 3 1HD1 LEU 3 -57.101 65.588 40.389 23 2HD1 LEU 3 2HD1 LEU 3 -56.047 64.667 39.314 24 3HD1 LEU 3 3HD1 LEU 3 -55.365 65.527 40.694 25 1HD2 LEU 3 1HD2 LEU 3 -58.107 62.439 41.040 26 2HD2 LEU 3 2HD2 LEU 3 -58.473 64.150 40.814 27 3HD2 LEU 3 3HD2 LEU 3 -58.153 63.523 42.432 28 H GLU 4 H GLU 4 -53.767 59.506 42.237 29 HA GLU 4 HA GLU 4 -51.171 60.368 41.528 30 1HB GLU 4 1HB GLU 4 -52.417 57.895 42.553 31 2HB GLU 4 2HB GLU 4 -50.915 57.666 41.666 32 1HG GLU 4 1HG GLU 4 -51.303 59.460 44.050 33 2HG GLU 4 2HG GLU 4 -50.522 57.879 44.058 34 H LYS 5 H LYS 5 -50.115 60.296 39.656 35 HA LYS 5 HA LYS 5 -51.099 58.534 37.519 36 1HB LYS 5 1HB LYS 5 -51.771 61.131 37.493 37 2HB LYS 5 2HB LYS 5 -50.187 61.253 36.741 38 1HG LYS 5 1HG LYS 5 -51.609 61.032 34.933 39 2HG LYS 5 2HG LYS 5 -51.029 59.384 35.178 40 1HD LYS 5 1HD LYS 5 -53.093 58.643 35.564 41 2HD LYS 5 2HD LYS 5 -53.378 59.896 36.775 42 1HE LYS 5 1HE LYS 5 -54.023 61.468 35.064 43 2HE LYS 5 2HE LYS 5 -53.602 60.318 33.796 44 1HZ LYS 5 1HZ LYS 5 -55.869 60.227 35.692 45 2HZ LYS 5 2HZ LYS 5 -55.343 58.828 34.884 46 3HZ LYS 5 3HZ LYS 5 -55.903 60.157 33.997 47 H ALA 6 H ALA 6 -48.985 57.863 39.024 48 HA ALA 6 HA ALA 6 -46.548 58.764 37.683 49 1HB ALA 6 1HB ALA 6 -46.387 56.642 39.724 50 2HB ALA 6 2HB ALA 6 -46.981 58.207 40.282 51 3HB ALA 6 3HB ALA 6 -45.400 58.088 39.508 52 H HIS 7 H HIS 7 -45.370 57.524 36.314 53 HA HIS 7 HA HIS 7 -46.211 54.748 35.925 54 1HB HIS 7 1HB HIS 7 -45.941 54.998 33.457 55 2HB HIS 7 2HB HIS 7 -47.290 55.914 34.112 56 HD1 HIS 7 HD1 HIS 7 -44.222 56.252 32.127 57 HD2 HIS 7 HD2 HIS 7 -46.812 58.772 34.193 58 HE1 HIS 7 HE1 HIS 7 -43.722 58.573 31.298 59 HE2 HIS 7 HE2 HIS 7 -45.231 60.094 32.621 60 H THR 8 H THR 8 -44.583 53.441 36.180 61 HA THR 8 HA THR 8 -41.854 54.414 35.628 62 HB THR 8 HB THR 8 -42.315 52.324 37.704 63 HG1 THR 8 HG1 THR 8 -42.729 55.117 38.189 64 1HG2 THR 8 1HG2 THR 8 -40.441 54.684 37.486 65 2HG2 THR 8 2HG2 THR 8 -40.048 53.000 37.139 66 3HG2 THR 8 3HG2 THR 8 -40.436 53.493 38.786 67 H SER 9 H SER 9 -41.894 53.437 33.546 68 HA SER 9 HA SER 9 -41.749 50.494 33.630 69 1HB SER 9 1HB SER 9 -42.415 51.273 30.996 70 2HB SER 9 2HB SER 9 -43.424 50.397 32.145 71 HG SER 9 HG SER 9 -44.366 52.269 32.782 72 H VAL 10 H VAL 10 -39.756 49.822 33.208 73 HA VAL 10 HA VAL 10 -37.932 51.593 31.756 74 HB VAL 10 HB VAL 10 -37.121 48.964 32.963 75 1HG1 VAL 10 1HG1 VAL 10 -35.731 51.580 32.432 76 2HG1 VAL 10 2HG1 VAL 10 -35.434 50.024 31.656 77 3HG1 VAL 10 3HG1 VAL 10 -35.011 50.259 33.352 78 1HG2 VAL 10 1HG2 VAL 10 -36.495 50.756 34.913 79 2HG2 VAL 10 2HG2 VAL 10 -37.889 49.675 34.946 80 3HG2 VAL 10 3HG2 VAL 10 -38.075 51.339 34.389 81 H LYS 11 H LYS 11 -37.705 51.331 29.640 82 HA LYS 11 HA LYS 11 -38.346 48.731 28.444 83 1HB LYS 11 1HB LYS 11 -38.424 51.547 27.507 84 2HB LYS 11 2HB LYS 11 -38.011 50.328 26.309 85 1HG LYS 11 1HG LYS 11 -40.286 49.482 27.846 86 2HG LYS 11 2HG LYS 11 -40.559 51.086 27.161 87 1HD LYS 11 1HD LYS 11 -39.542 48.757 25.544 88 2HD LYS 11 2HD LYS 11 -41.257 49.139 25.712 89 1HE LYS 11 1HE LYS 11 -41.128 50.909 24.328 90 2HE LYS 11 2HE LYS 11 -39.557 51.408 24.950 91 1HZ LYS 11 1HZ LYS 11 -40.181 49.486 22.811 92 2HZ LYS 11 2HZ LYS 11 -38.725 49.342 23.669 93 3HZ LYS 11 3HZ LYS 11 -39.066 50.765 22.814 94 H LYS 12 H LYS 12 -36.705 47.420 28.070 95 HA LYS 12 HA LYS 12 -34.112 48.604 27.298 96 1HB LYS 12 1HB LYS 12 -34.166 45.956 28.657 97 2HB LYS 12 2HB LYS 12 -32.936 47.211 28.695 98 1HG LYS 12 1HG LYS 12 -33.678 47.865 30.670 99 2HG LYS 12 2HG LYS 12 -35.242 48.255 29.953 100 1HD LYS 12 1HD LYS 12 -35.741 46.731 31.673 101 2HD LYS 12 2HD LYS 12 -35.778 45.767 30.196 102 1HE LYS 12 1HE LYS 12 -33.192 45.485 30.855 103 2HE LYS 12 2HE LYS 12 -33.886 45.695 32.462 104 1HZ LYS 12 1HZ LYS 12 -35.184 43.806 30.639 105 2HZ LYS 12 2HZ LYS 12 -35.033 43.753 32.327 106 3HZ LYS 12 3HZ LYS 12 -33.711 43.345 31.342 107 H MET 13 H MET 13 -32.915 47.507 25.733 108 HA MET 13 HA MET 13 -34.467 45.511 24.224 109 1HB MET 13 1HB MET 13 -33.466 47.890 23.316 110 2HB MET 13 2HB MET 13 -32.183 46.775 22.867 111 1HG MET 13 1HG MET 13 -33.494 46.721 20.999 112 2HG MET 13 2HG MET 13 -34.140 45.352 21.903 113 1HE MET 13 1HE MET 13 -36.319 45.622 20.159 114 2HE MET 13 2HE MET 13 -37.681 46.093 21.174 115 3HE MET 13 3HE MET 13 -36.490 44.942 21.777 116 H THR 14 H THR 14 -32.574 45.172 26.525 117 HA THR 14 HA THR 14 -30.281 43.807 25.455 118 HB THR 14 HB THR 14 -30.569 43.005 28.080 119 HG1 THR 14 HG1 THR 14 -30.979 45.688 28.432 120 1HG2 THR 14 1HG2 THR 14 -28.486 43.743 27.191 121 2HG2 THR 14 2HG2 THR 14 -28.883 44.821 28.528 122 3HG2 THR 14 3HG2 THR 14 -29.127 45.353 26.865 123 H PHE 15 H PHE 15 -31.129 42.177 24.122 124 HA PHE 15 HA PHE 15 -32.869 40.208 25.426 125 1HB PHE 15 1HB PHE 15 -32.397 40.967 22.557 126 2HB PHE 15 2HB PHE 15 -33.125 39.416 22.966 127 HD1 PHE 15 HD1 PHE 15 -33.666 42.936 22.563 128 HD2 PHE 15 HD2 PHE 15 -35.250 39.395 24.312 129 HE1 PHE 15 HE1 PHE 15 -35.866 44.016 22.752 130 HE2 PHE 15 HE2 PHE 15 -37.452 40.472 24.505 131 HZ PHE 15 HZ PHE 15 -37.752 42.801 23.770 132 H GLY 16 H GLY 16 -29.717 40.599 25.160 133 1HA GLY 16 1HA GLY 16 -28.064 39.023 25.616 134 2HA GLY 16 2HA GLY 16 -29.229 37.745 25.296 135 H GLU 17 H GLU 17 -28.808 40.311 23.004 136 HA GLU 17 HA GLU 17 -27.491 38.393 21.200 137 1HB GLU 17 1HB GLU 17 -28.986 40.876 20.366 138 2HB GLU 17 2HB GLU 17 -28.508 39.514 19.362 139 1HG GLU 17 1HG GLU 17 -30.248 38.821 21.614 140 2HG GLU 17 2HG GLU 17 -30.979 39.882 20.414 141 H ASN 18 H ASN 18 -26.068 39.889 23.143 142 HA ASN 18 HA ASN 18 -24.728 42.059 21.740 143 1HB ASN 18 1HB ASN 18 -25.214 41.862 24.311 144 2HB ASN 18 2HB ASN 18 -23.763 40.865 24.322 145 1HD2 ASN 18 1HD2 ASN 18 -24.840 43.950 22.920 146 2HD2 ASN 18 2HD2 ASN 18 -23.399 44.824 23.330 147 H ARG 19 H ARG 19 -24.479 38.698 22.195 148 HA ARG 19 HA ARG 19 -21.672 38.501 21.492 149 1HB ARG 19 1HB ARG 19 -22.821 36.890 23.036 150 2HB ARG 19 2HB ARG 19 -23.762 36.318 21.667 151 1HG ARG 19 1HG ARG 19 -21.303 36.008 20.663 152 2HG ARG 19 2HG ARG 19 -20.944 35.813 22.382 153 1HD ARG 19 1HD ARG 19 -23.022 34.279 20.819 154 2HD ARG 19 2HD ARG 19 -21.447 33.665 21.320 155 HE ARG 19 HE ARG 19 -22.227 33.902 23.643 156 1HH1 ARG 19 1HH1 ARG 19 -24.658 33.863 21.097 157 2HH1 ARG 19 2HH1 ARG 19 -25.909 33.251 22.145 158 1HH2 ARG 19 1HH2 ARG 19 -23.878 33.148 25.004 159 2HH2 ARG 19 2HH2 ARG 19 -25.470 32.862 24.368 160 H ASP 20 H ASP 20 -22.307 39.900 19.537 161 HA ASP 20 HA ASP 20 -23.170 38.160 17.316 162 1HB ASP 20 1HB ASP 20 -24.761 39.976 17.776 163 2HB ASP 20 2HB ASP 20 -23.475 41.163 17.572 164 H LEU 21 H LEU 21 -21.026 37.460 16.962 165 HA LEU 21 HA LEU 21 -19.605 39.029 15.070 166 1HB LEU 21 1HB LEU 21 -18.935 39.746 17.598 167 2HB LEU 21 2HB LEU 21 -17.792 38.445 17.329 168 HG LEU 21 HG LEU 21 -17.962 40.424 15.151 169 1HD1 LEU 21 1HD1 LEU 21 -18.057 42.119 16.687 170 2HD1 LEU 21 2HD1 LEU 21 -16.314 41.862 16.589 171 3HD1 LEU 21 3HD1 LEU 21 -17.232 41.183 17.936 172 1HD2 LEU 21 1HD2 LEU 21 -15.369 40.212 15.762 173 2HD2 LEU 21 2HD2 LEU 21 -16.217 39.026 14.772 174 3HD2 LEU 21 3HD2 LEU 21 -15.947 38.711 16.485 175 H GLU 22 H GLU 22 -19.282 37.449 13.671 176 HA GLU 22 HA GLU 22 -18.422 34.826 14.676 177 1HB GLU 22 1HB GLU 22 -19.869 35.681 12.178 178 2HB GLU 22 2HB GLU 22 -19.119 34.096 12.317 179 1HG GLU 22 1HG GLU 22 -20.895 34.865 14.533 180 2HG GLU 22 2HG GLU 22 -21.674 34.617 12.970 181 H ARG 23 H ARG 23 -16.667 33.776 13.772 182 HA ARG 23 HA ARG 23 -15.047 35.227 11.813 183 1HB ARG 23 1HB ARG 23 -14.277 34.622 14.627 184 2HB ARG 23 2HB ARG 23 -13.050 34.406 13.387 185 1HG ARG 23 1HG ARG 23 -13.012 36.659 12.847 186 2HG ARG 23 2HG ARG 23 -14.598 36.957 13.560 187 1HD ARG 23 1HD ARG 23 -11.932 36.801 14.840 188 2HD ARG 23 2HD ARG 23 -13.305 37.844 15.208 189 HE ARG 23 HE ARG 23 -13.338 34.988 15.922 190 1HH1 ARG 23 1HH1 ARG 23 -13.475 38.357 16.860 191 2HH1 ARG 23 2HH1 ARG 23 -14.002 38.014 18.483 192 1HH2 ARG 23 1HH2 ARG 23 -14.040 34.532 18.032 193 2HH2 ARG 23 2HH2 ARG 23 -14.340 35.836 19.149 194 H VAL 24 H VAL 24 -15.598 33.616 10.349 195 HA VAL 24 HA VAL 24 -14.480 30.951 10.939 196 HB VAL 24 HB VAL 24 -16.751 31.303 9.011 197 1HG1 VAL 24 1HG1 VAL 24 -15.387 29.187 9.237 198 2HG1 VAL 24 2HG1 VAL 24 -17.133 29.005 9.403 199 3HG1 VAL 24 3HG1 VAL 24 -16.106 29.003 10.836 200 1HG2 VAL 24 1HG2 VAL 24 -18.068 30.457 11.198 201 2HG2 VAL 24 2HG2 VAL 24 -17.979 32.148 10.707 202 3HG2 VAL 24 3HG2 VAL 24 -16.887 31.532 11.948 203 H VAL 25 H VAL 25 -12.505 31.667 9.959 204 HA VAL 25 HA VAL 25 -12.666 32.041 7.045 205 HB VAL 25 HB VAL 25 -11.405 33.814 7.964 206 1HG1 VAL 25 1HG1 VAL 25 -9.782 31.793 9.502 207 2HG1 VAL 25 2HG1 VAL 25 -10.992 32.884 10.177 208 3HG1 VAL 25 3HG1 VAL 25 -9.511 33.536 9.476 209 1HG2 VAL 25 1HG2 VAL 25 -10.304 33.200 6.024 210 2HG2 VAL 25 2HG2 VAL 25 -9.714 31.688 6.715 211 3HG2 VAL 25 3HG2 VAL 25 -9.000 33.222 7.212 212 H THR 26 H THR 26 -12.589 30.173 6.007 213 HA THR 26 HA THR 26 -10.893 28.028 7.077 214 HB THR 26 HB THR 26 -12.889 27.549 4.910 215 HG1 THR 26 HG1 THR 26 -13.563 27.827 7.678 216 1HG2 THR 26 1HG2 THR 26 -12.133 25.936 7.349 217 2HG2 THR 26 2HG2 THR 26 -11.403 25.751 5.753 218 3HG2 THR 26 3HG2 THR 26 -13.115 25.400 5.986 219 H ALA 27 H ALA 27 -9.106 27.479 6.047 220 HA ALA 27 HA ALA 27 -8.922 27.816 3.151 221 1HB ALA 27 1HB ALA 27 -6.743 28.919 3.290 222 2HB ALA 27 2HB ALA 27 -6.874 28.964 5.048 223 3HB ALA 27 3HB ALA 27 -7.998 29.893 4.058 224 HA PRO 28 HA PRO 28 -7.243 23.821 4.635 225 1HB PRO 28 1HB PRO 28 -8.436 22.699 2.229 226 2HB PRO 28 2HB PRO 28 -8.810 22.351 3.917 227 1HG PRO 28 1HG PRO 28 -10.523 23.662 2.269 228 2HG PRO 28 2HG PRO 28 -10.461 23.943 4.020 229 1HD PRO 28 1HD PRO 28 -9.272 25.559 1.791 230 2HD PRO 28 2HD PRO 28 -10.107 26.108 3.261 231 H VAL 29 H VAL 29 -5.384 25.398 3.649 232 HA VAL 29 HA VAL 29 -4.408 24.400 1.095 233 HB VAL 29 HB VAL 29 -2.628 26.126 2.703 234 1HG1 VAL 29 1HG1 VAL 29 -2.181 25.455 0.370 235 2HG1 VAL 29 2HG1 VAL 29 -2.271 27.205 0.570 236 3HG1 VAL 29 3HG1 VAL 29 -3.630 26.325 -0.134 237 1HG2 VAL 29 1HG2 VAL 29 -4.844 27.046 3.281 238 2HG2 VAL 29 2HG2 VAL 29 -5.186 27.250 1.563 239 3HG2 VAL 29 3HG2 VAL 29 -3.876 28.160 2.316 240 H SER 30 H SER 30 -4.565 22.318 2.712 241 HA SER 30 HA SER 30 -2.047 21.889 4.087 242 1HB SER 30 1HB SER 30 -4.029 19.691 3.794 243 2HB SER 30 2HB SER 30 -3.141 20.228 5.222 244 HG SER 30 HG SER 30 -4.542 22.063 5.285 245 H SER 31 H SER 31 -0.387 20.741 3.297 246 HA SER 31 HA SER 31 -0.348 20.043 0.543 247 1HB SER 31 1HB SER 31 1.847 18.883 2.007 248 2HB SER 31 2HB SER 31 1.866 20.229 0.866 249 HG SER 31 HG SER 31 1.613 21.654 2.493 250 H GLY 32 H GLY 32 0.223 17.928 -0.321 251 1HA GLY 32 1HA GLY 32 0.174 15.516 1.048 252 2HA GLY 32 2HA GLY 32 -1.504 15.898 0.677 253 H LYS 33 H LYS 33 1.584 16.206 -1.059 254 HA LYS 33 HA LYS 33 0.287 15.189 -3.468 255 1HB LYS 33 1HB LYS 33 2.802 16.676 -2.877 256 2HB LYS 33 2HB LYS 33 2.751 15.680 -4.326 257 1HG LYS 33 1HG LYS 33 0.417 17.028 -4.554 258 2HG LYS 33 2HG LYS 33 1.418 18.225 -3.733 259 1HD LYS 33 1HD LYS 33 2.915 16.965 -5.831 260 2HD LYS 33 2HD LYS 33 1.390 17.586 -6.468 261 1HE LYS 33 1HE LYS 33 2.264 19.626 -6.489 262 2HE LYS 33 2HE LYS 33 2.413 19.557 -4.733 263 1HZ LYS 33 1HZ LYS 33 4.473 18.275 -6.392 264 2HZ LYS 33 2HZ LYS 33 4.604 18.963 -4.847 265 3HZ LYS 33 3HZ LYS 33 4.494 19.962 -6.211 266 H ILE 34 H ILE 34 0.198 13.076 -3.669 267 HA ILE 34 HA ILE 34 2.478 11.447 -2.735 268 HB ILE 34 HB ILE 34 -0.281 10.328 -2.993 269 1HG1 ILE 34 1HG1 ILE 34 0.236 11.240 -0.292 270 2HG1 ILE 34 2HG1 ILE 34 0.199 12.594 -1.421 271 1HG2 ILE 34 1HG2 ILE 34 1.435 9.706 -0.688 272 2HG2 ILE 34 2HG2 ILE 34 2.082 9.243 -2.263 273 3HG2 ILE 34 3HG2 ILE 34 0.511 8.636 -1.740 274 1HD1 ILE 34 1HD1 ILE 34 -2.007 12.394 -1.784 275 2HD1 ILE 34 2HD1 ILE 34 -1.973 11.578 -0.221 276 3HD1 ILE 34 3HD1 ILE 34 -1.972 10.633 -1.712 277 H LYS 35 H LYS 35 2.878 9.496 -3.884 278 HA LYS 35 HA LYS 35 1.876 9.407 -6.655 279 1HB LYS 35 1HB LYS 35 4.716 8.856 -5.749 280 2HB LYS 35 2HB LYS 35 4.119 8.774 -7.405 281 1HG LYS 35 1HG LYS 35 3.621 11.358 -6.191 282 2HG LYS 35 2HG LYS 35 5.333 10.929 -6.182 283 1HD LYS 35 1HD LYS 35 5.083 12.002 -8.228 284 2HD LYS 35 2HD LYS 35 4.940 10.296 -8.661 285 1HE LYS 35 1HE LYS 35 2.638 10.438 -8.954 286 2HE LYS 35 2HE LYS 35 2.510 11.917 -8.001 287 1HZ LYS 35 1HZ LYS 35 4.073 11.988 -10.487 288 2HZ LYS 35 2HZ LYS 35 3.155 13.209 -9.750 289 3HZ LYS 35 3HZ LYS 35 2.381 11.967 -10.601 290 H ARG 36 H ARG 36 1.768 7.252 -7.550 291 HA ARG 36 HA ARG 36 1.738 5.182 -5.447 292 1HB ARG 36 1HB ARG 36 0.303 4.297 -7.740 293 2HB ARG 36 2HB ARG 36 -0.307 4.614 -6.122 294 1HG ARG 36 1HG ARG 36 0.093 6.998 -7.789 295 2HG ARG 36 2HG ARG 36 -1.147 5.876 -8.352 296 1HD ARG 36 1HD ARG 36 -2.392 6.083 -6.385 297 2HD ARG 36 2HD ARG 36 -1.039 6.775 -5.492 298 HE ARG 36 HE ARG 36 -2.160 8.290 -7.735 299 1HH1 ARG 36 1HH1 ARG 36 -1.721 7.905 -4.269 300 2HH1 ARG 36 2HH1 ARG 36 -2.252 9.520 -3.902 301 1HH2 ARG 36 1HH2 ARG 36 -2.803 10.431 -7.248 302 2HH2 ARG 36 2HH2 ARG 36 -2.865 10.958 -5.589 303 H VAL 37 H VAL 37 2.446 3.091 -5.935 304 HA VAL 37 HA VAL 37 4.001 2.721 -8.400 305 HB VAL 37 HB VAL 37 5.660 1.523 -6.618 306 1HG1 VAL 37 1HG1 VAL 37 5.701 4.244 -7.860 307 2HG1 VAL 37 2HG1 VAL 37 6.618 2.801 -8.295 308 3HG1 VAL 37 3HG1 VAL 37 7.034 3.703 -6.838 309 1HG2 VAL 37 1HG2 VAL 37 5.836 3.840 -5.084 310 2HG2 VAL 37 2HG2 VAL 37 5.302 2.247 -4.548 311 3HG2 VAL 37 3HG2 VAL 37 4.121 3.432 -5.102 312 H ASN 38 H ASN 38 4.173 0.614 -9.062 313 HA ASN 38 HA ASN 38 2.707 -1.396 -7.478 314 1HB ASN 38 1HB ASN 38 1.621 -1.344 -9.563 315 2HB ASN 38 2HB ASN 38 3.121 -1.076 -10.445 316 1HD2 ASN 38 1HD2 ASN 38 1.390 -3.490 -8.505 317 2HD2 ASN 38 2HD2 ASN 38 2.037 -4.859 -9.344 318 H VAL 39 H VAL 39 4.079 -2.549 -6.315 319 HA VAL 39 HA VAL 39 6.797 -2.959 -7.360 320 HB VAL 39 HB VAL 39 5.874 -2.982 -4.480 321 1HG1 VAL 39 1HG1 VAL 39 8.003 -4.259 -5.214 322 2HG1 VAL 39 2HG1 VAL 39 8.098 -3.160 -3.837 323 3HG1 VAL 39 3HG1 VAL 39 8.701 -2.650 -5.415 324 1HG2 VAL 39 1HG2 VAL 39 6.694 -0.809 -6.291 325 2HG2 VAL 39 2HG2 VAL 39 7.441 -0.801 -4.695 326 3HG2 VAL 39 3HG2 VAL 39 5.686 -0.763 -4.845 327 H ASN 40 H ASN 40 7.833 -4.940 -7.092 328 HA ASN 40 HA ASN 40 6.025 -7.237 -6.765 329 1HB ASN 40 1HB ASN 40 7.280 -6.848 -8.965 330 2HB ASN 40 2HB ASN 40 8.744 -7.261 -8.081 331 1HD2 ASN 40 1HD2 ASN 40 8.924 -8.958 -9.649 332 2HD2 ASN 40 2HD2 ASN 40 8.053 -10.436 -9.408 333 H PHE 41 H PHE 41 6.353 -8.589 -5.106 334 HA PHE 41 HA PHE 41 8.814 -8.238 -3.521 335 1HB PHE 41 1HB PHE 41 5.949 -8.358 -2.748 336 2HB PHE 41 2HB PHE 41 7.103 -9.132 -1.667 337 HD1 PHE 41 HD1 PHE 41 9.406 -7.202 -2.216 338 HD2 PHE 41 HD2 PHE 41 5.290 -6.599 -1.323 339 HE1 PHE 41 HE1 PHE 41 9.948 -5.022 -1.209 340 HE2 PHE 41 HE2 PHE 41 5.823 -4.425 -0.316 341 HZ PHE 41 HZ PHE 41 8.185 -3.598 -0.348 342 H ASP 42 H ASP 42 10.053 -9.940 -3.387 343 HA ASP 42 HA ASP 42 9.291 -12.521 -4.314 344 1HB ASP 42 1HB ASP 42 11.517 -12.644 -4.498 345 2HB ASP 42 2HB ASP 42 11.697 -11.162 -3.571 346 H GLU 43 H GLU 43 9.267 -14.471 -3.079 347 HA GLU 43 HA GLU 43 7.444 -14.553 -1.070 348 1HB GLU 43 1HB GLU 43 8.195 -16.503 -2.377 349 2HB GLU 43 2HB GLU 43 9.698 -16.526 -1.465 350 1HG GLU 43 1HG GLU 43 8.467 -18.150 -0.406 351 2HG GLU 43 2HG GLU 43 8.150 -16.738 0.597 352 H GLU 44 H GLU 44 10.977 -14.607 -0.599 353 HA GLU 44 HA GLU 44 10.953 -14.797 2.210 354 1HB GLU 44 1HB GLU 44 12.910 -14.842 0.371 355 2HB GLU 44 2HB GLU 44 13.084 -13.183 0.936 356 1HG GLU 44 1HG GLU 44 12.832 -15.073 3.124 357 2HG GLU 44 2HG GLU 44 14.196 -15.439 2.073 358 H LYS 45 H LYS 45 11.416 -11.961 0.132 359 HA LYS 45 HA LYS 45 11.527 -10.028 2.100 360 1HB LYS 45 1HB LYS 45 10.944 -10.077 -0.790 361 2HB LYS 45 2HB LYS 45 10.323 -8.671 0.070 362 1HG LYS 45 1HG LYS 45 12.519 -8.105 0.856 363 2HG LYS 45 2HG LYS 45 13.185 -9.596 0.193 364 1HD LYS 45 1HD LYS 45 11.766 -7.906 -1.748 365 2HD LYS 45 2HD LYS 45 13.229 -7.192 -1.065 366 1HE LYS 45 1HE LYS 45 14.040 -9.743 -1.604 367 2HE LYS 45 2HE LYS 45 12.915 -9.431 -2.927 368 1HZ LYS 45 1HZ LYS 45 14.169 -7.341 -3.346 369 2HZ LYS 45 2HZ LYS 45 15.072 -8.750 -3.615 370 3HZ LYS 45 3HZ LYS 45 15.323 -7.841 -2.203 371 H HIS 46 H HIS 46 8.701 -11.481 0.590 372 HA HIS 46 HA HIS 46 6.870 -9.635 1.815 373 1HB HIS 46 1HB HIS 46 6.451 -10.919 -0.333 374 2HB HIS 46 2HB HIS 46 6.156 -12.333 0.675 375 HD1 HIS 46 HD1 HIS 46 3.728 -12.697 0.901 376 HD2 HIS 46 HD2 HIS 46 4.688 -8.649 0.885 377 HE1 HIS 46 HE1 HIS 46 1.553 -11.483 1.266 378 HE2 HIS 46 HE2 HIS 46 2.128 -9.037 1.029 379 H THR 47 H THR 47 7.942 -12.930 2.534 380 HA THR 47 HA THR 47 6.134 -13.403 4.643 381 HB THR 47 HB THR 47 8.894 -14.600 4.331 382 HG1 THR 47 HG1 THR 47 7.645 -14.909 2.431 383 1HG2 THR 47 1HG2 THR 47 6.418 -15.713 5.658 384 2HG2 THR 47 2HG2 THR 47 7.773 -14.980 6.515 385 3HG2 THR 47 3HG2 THR 47 8.012 -16.465 5.595 386 H ARG 48 H ARG 48 9.500 -12.222 4.648 387 HA ARG 48 HA ARG 48 9.560 -11.846 7.473 388 1HB ARG 48 1HB ARG 48 11.600 -12.092 6.023 389 2HB ARG 48 2HB ARG 48 11.309 -10.456 5.443 390 1HG ARG 48 1HG ARG 48 11.382 -9.724 7.855 391 2HG ARG 48 2HG ARG 48 11.987 -11.333 8.234 392 1HD ARG 48 1HD ARG 48 13.255 -9.245 6.480 393 2HD ARG 48 2HD ARG 48 13.851 -9.865 8.016 394 HE ARG 48 HE ARG 48 13.605 -11.714 5.749 395 1HH1 ARG 48 1HH1 ARG 48 15.622 -9.910 7.971 396 2HH1 ARG 48 2HH1 ARG 48 17.084 -10.733 7.525 397 1HH2 ARG 48 1HH2 ARG 48 15.519 -12.766 5.118 398 2HH2 ARG 48 2HH2 ARG 48 17.026 -12.358 5.897 399 H PHE 49 H PHE 49 8.492 -9.914 4.770 400 HA PHE 49 HA PHE 49 8.475 -7.388 5.976 401 1HB PHE 49 1HB PHE 49 7.677 -8.385 3.543 402 2HB PHE 49 2HB PHE 49 6.145 -7.927 4.282 403 HD1 PHE 49 HD1 PHE 49 9.496 -6.359 4.574 404 HD2 PHE 49 HD2 PHE 49 5.490 -5.992 3.199 405 HE1 PHE 49 HE1 PHE 49 9.922 -4.018 3.964 406 HE2 PHE 49 HE2 PHE 49 5.910 -3.650 2.580 407 HZ PHE 49 HZ PHE 49 8.103 -2.643 3.017 408 H LYS 50 H LYS 50 6.012 -9.926 5.936 409 HA LYS 50 HA LYS 50 4.100 -8.567 7.496 410 1HB LYS 50 1HB LYS 50 4.621 -11.483 6.966 411 2HB LYS 50 2HB LYS 50 3.298 -10.951 7.996 412 1HG LYS 50 1HG LYS 50 2.106 -10.076 6.244 413 2HG LYS 50 2HG LYS 50 3.548 -9.788 5.267 414 1HD LYS 50 1HD LYS 50 2.856 -11.615 4.141 415 2HD LYS 50 2HD LYS 50 3.604 -12.490 5.482 416 1HE LYS 50 1HE LYS 50 0.981 -11.739 6.266 417 2HE LYS 50 2HE LYS 50 0.884 -12.474 4.667 418 1HZ LYS 50 1HZ LYS 50 2.149 -13.685 7.071 419 2HZ LYS 50 2HZ LYS 50 2.100 -14.390 5.527 420 3HZ LYS 50 3HZ LYS 50 0.662 -14.136 6.386 421 H ALA 51 H ALA 51 6.647 -10.878 8.367 422 HA ALA 51 HA ALA 51 6.148 -10.947 11.135 423 1HB ALA 51 1HB ALA 51 7.628 -12.485 9.763 424 2HB ALA 51 2HB ALA 51 8.228 -12.016 11.354 425 3HB ALA 51 3HB ALA 51 8.875 -11.243 9.904 426 H ALA 52 H ALA 52 8.462 -8.971 9.281 427 HA ALA 52 HA ALA 52 9.480 -7.507 11.436 428 1HB ALA 52 1HB ALA 52 10.659 -6.359 9.887 429 2HB ALA 52 2HB ALA 52 9.271 -6.151 8.820 430 3HB ALA 52 3HB ALA 52 10.131 -7.693 8.859 431 H CYS 53 H CYS 53 6.650 -6.916 9.382 432 HA CYS 53 HA CYS 53 6.118 -4.297 10.241 433 1HB CYS 53 1HB CYS 53 4.217 -4.432 8.990 434 2HB CYS 53 2HB CYS 53 5.030 -5.853 8.355 435 HG CYS 53 HG CYS 53 3.583 -7.685 9.834 436 H ALA 54 H ALA 54 5.207 -7.417 11.596 437 HA ALA 54 HA ALA 54 3.576 -6.323 13.688 438 1HB ALA 54 1HB ALA 54 4.770 -8.913 14.266 439 2HB ALA 54 2HB ALA 54 4.003 -8.850 12.679 440 3HB ALA 54 3HB ALA 54 3.073 -8.454 14.124 441 H ARG 55 H ARG 55 6.948 -7.205 13.311 442 HA ARG 55 HA ARG 55 7.726 -6.964 16.024 443 1HB ARG 55 1HB ARG 55 8.968 -7.498 13.504 444 2HB ARG 55 2HB ARG 55 9.897 -6.253 14.328 445 1HG ARG 55 1HG ARG 55 9.780 -7.842 16.359 446 2HG ARG 55 2HG ARG 55 9.342 -9.069 15.168 447 1HD ARG 55 1HD ARG 55 11.514 -9.343 14.772 448 2HD ARG 55 2HD ARG 55 11.526 -7.729 14.062 449 HE ARG 55 HE ARG 55 12.279 -6.856 16.157 450 1HH1 ARG 55 1HH1 ARG 55 12.365 -10.350 15.854 451 2HH1 ARG 55 2HH1 ARG 55 13.398 -10.566 17.238 452 1HH2 ARG 55 1HH2 ARG 55 13.647 -7.136 17.957 453 2HH2 ARG 55 2HH2 ARG 55 14.136 -8.737 18.429 454 H LYS 56 H LYS 56 7.472 -4.669 13.374 455 HA LYS 56 HA LYS 56 8.673 -2.537 14.925 456 1HB LYS 56 1HB LYS 56 7.431 -2.620 12.173 457 2HB LYS 56 2HB LYS 56 8.085 -1.155 12.892 458 1HG LYS 56 1HG LYS 56 9.623 -3.675 12.294 459 2HG LYS 56 2HG LYS 56 9.679 -2.173 11.369 460 1HD LYS 56 1HD LYS 56 10.462 -1.032 13.465 461 2HD LYS 56 2HD LYS 56 10.611 -2.630 14.196 462 1HE LYS 56 1HE LYS 56 12.479 -3.122 13.048 463 2HE LYS 56 2HE LYS 56 11.896 -2.348 11.575 464 1HZ LYS 56 1HZ LYS 56 12.326 -0.183 12.898 465 2HZ LYS 56 2HZ LYS 56 13.631 -0.998 12.189 466 3HZ LYS 56 3HZ LYS 56 13.335 -1.158 13.850 467 H GLY 57 H GLY 57 5.524 -3.758 14.253 468 1HA GLY 57 1HA GLY 57 3.505 -3.193 15.218 469 2HA GLY 57 2HA GLY 57 4.333 -1.932 16.121 470 H THR 58 H THR 58 4.030 -2.479 12.627 471 HA THR 58 HA THR 58 2.386 -0.088 12.386 472 HB THR 58 HB THR 58 4.887 0.524 12.254 473 HG1 THR 58 HG1 THR 58 4.374 1.902 10.323 474 1HG2 THR 58 1HG2 THR 58 4.866 -0.114 9.387 475 2HG2 THR 58 2HG2 THR 58 5.046 -1.507 10.454 476 3HG2 THR 58 3HG2 THR 58 6.186 -0.168 10.552 477 H SER 59 H SER 59 1.616 0.187 10.089 478 HA SER 59 HA SER 59 0.534 -2.245 9.148 479 1HB SER 59 1HB SER 59 0.206 -0.446 7.081 480 2HB SER 59 2HB SER 59 -0.889 -0.633 8.452 481 HG SER 59 HG SER 59 0.527 1.504 7.791 482 H ILE 60 H ILE 60 0.940 -3.392 7.223 483 HA ILE 60 HA ILE 60 3.633 -3.762 6.574 484 HB ILE 60 HB ILE 60 1.759 -5.406 6.200 485 1HG1 ILE 60 1HG1 ILE 60 3.587 -4.943 3.836 486 2HG1 ILE 60 2HG1 ILE 60 4.079 -5.694 5.353 487 1HG2 ILE 60 1HG2 ILE 60 0.886 -3.385 4.379 488 2HG2 ILE 60 2HG2 ILE 60 0.073 -4.873 4.871 489 3HG2 ILE 60 3HG2 ILE 60 1.182 -4.886 3.499 490 1HD1 ILE 60 1HD1 ILE 60 3.225 -7.669 4.776 491 2HD1 ILE 60 2HD1 ILE 60 3.191 -7.018 3.138 492 3HD1 ILE 60 3HD1 ILE 60 1.743 -6.952 4.145 493 H THR 61 H THR 61 1.232 -1.647 5.186 494 HA THR 61 HA THR 61 2.663 -0.931 2.847 495 HB THR 61 HB THR 61 0.925 1.156 3.797 496 HG1 THR 61 HG1 THR 61 -0.984 -0.180 3.955 497 1HG2 THR 61 1HG2 THR 61 0.284 -0.867 1.673 498 2HG2 THR 61 2HG2 THR 61 1.509 0.375 1.418 499 3HG2 THR 61 3HG2 THR 61 -0.161 0.839 1.744 500 H ASP 62 H ASP 62 2.621 0.199 6.155 501 HA ASP 62 HA ASP 62 4.035 2.636 5.666 502 1HB ASP 62 1HB ASP 62 2.533 1.981 7.696 503 2HB ASP 62 2HB ASP 62 4.012 1.261 8.328 504 H VAL 63 H VAL 63 4.910 -0.669 6.449 505 HA VAL 63 HA VAL 63 7.615 -0.238 7.114 506 HB VAL 63 HB VAL 63 6.790 -2.644 5.520 507 1HG1 VAL 63 1HG1 VAL 63 9.084 -1.870 6.941 508 2HG1 VAL 63 2HG1 VAL 63 8.749 -3.432 6.197 509 3HG1 VAL 63 3HG1 VAL 63 8.326 -3.150 7.883 510 1HG2 VAL 63 1HG2 VAL 63 5.011 -2.221 7.190 511 2HG2 VAL 63 2HG2 VAL 63 6.236 -2.288 8.458 512 3HG2 VAL 63 3HG2 VAL 63 5.902 -3.715 7.477 513 H VAL 64 H VAL 64 5.984 -0.708 4.009 514 HA VAL 64 HA VAL 64 8.257 -0.697 2.363 515 HB VAL 64 HB VAL 64 5.751 0.631 1.426 516 1HG1 VAL 64 1HG1 VAL 64 7.640 -1.341 0.145 517 2HG1 VAL 64 2HG1 VAL 64 7.667 0.410 -0.076 518 3HG1 VAL 64 3HG1 VAL 64 6.288 -0.533 -0.647 519 1HG2 VAL 64 1HG2 VAL 64 6.019 -2.233 2.230 520 2HG2 VAL 64 2HG2 VAL 64 5.000 -1.794 0.859 521 3HG2 VAL 64 3HG2 VAL 64 4.667 -1.125 2.457 522 H ASN 65 H ASN 65 6.145 1.943 3.453 523 HA ASN 65 HA ASN 65 7.439 4.053 2.166 524 1HB ASN 65 1HB ASN 65 5.329 3.783 3.952 525 2HB ASN 65 2HB ASN 65 6.495 4.773 4.825 526 1HD2 ASN 65 1HD2 ASN 65 3.959 4.841 2.710 527 2HD2 ASN 65 2HD2 ASN 65 4.205 6.416 2.040 528 H GLN 66 H GLN 66 8.156 2.503 5.261 529 HA GLN 66 HA GLN 66 10.058 4.324 6.202 530 1HB GLN 66 1HB GLN 66 9.149 1.658 6.885 531 2HB GLN 66 2HB GLN 66 10.882 1.833 7.138 532 1HG GLN 66 1HG GLN 66 10.360 2.701 9.110 533 2HG GLN 66 2HG GLN 66 9.860 4.139 8.225 534 1HE2 GLN 66 1HE2 GLN 66 7.776 4.723 8.253 535 2HE2 GLN 66 2HE2 GLN 66 6.490 3.792 8.959 536 H LEU 67 H LEU 67 10.525 1.367 4.262 537 HA LEU 67 HA LEU 67 13.348 1.582 4.236 538 1HB LEU 67 1HB LEU 67 12.456 0.266 1.857 539 2HB LEU 67 2HB LEU 67 13.272 -0.402 3.255 540 HG LEU 67 HG LEU 67 10.475 0.016 3.824 541 1HD1 LEU 67 1HD1 LEU 67 11.185 -1.173 1.224 542 2HD1 LEU 67 2HD1 LEU 67 9.693 -0.401 1.753 543 3HD1 LEU 67 3HD1 LEU 67 10.027 -2.072 2.203 544 1HD2 LEU 67 1HD2 LEU 67 10.704 -1.957 4.891 545 2HD2 LEU 67 2HD2 LEU 67 12.424 -1.608 4.697 546 3HD2 LEU 67 3HD2 LEU 67 11.612 -2.691 3.569 547 H VAL 68 H VAL 68 10.844 2.771 2.054 548 HA VAL 68 HA VAL 68 12.576 3.743 0.025 549 HB VAL 68 HB VAL 68 9.951 5.029 0.773 550 1HG1 VAL 68 1HG1 VAL 68 9.856 5.414 -1.697 551 2HG1 VAL 68 2HG1 VAL 68 11.506 4.792 -1.799 552 3HG1 VAL 68 3HG1 VAL 68 11.173 6.257 -0.878 553 1HG2 VAL 68 1HG2 VAL 68 9.089 2.962 0.518 554 2HG2 VAL 68 2HG2 VAL 68 10.489 2.372 -0.375 555 3HG2 VAL 68 3HG2 VAL 68 9.262 3.335 -1.197 556 H ASP 69 H ASP 69 11.287 5.133 2.984 557 HA ASP 69 HA ASP 69 12.260 7.748 2.706 558 1HB ASP 69 1HB ASP 69 10.673 6.760 4.494 559 2HB ASP 69 2HB ASP 69 12.146 6.314 5.352 560 H ASN 70 H ASN 70 13.725 4.855 4.113 561 HA ASN 70 HA ASN 70 16.111 6.148 4.952 562 1HB ASN 70 1HB ASN 70 15.214 3.308 4.686 563 2HB ASN 70 2HB ASN 70 16.930 3.638 4.902 564 1HD2 ASN 70 1HD2 ASN 70 13.743 4.208 6.284 565 2HD2 ASN 70 2HD2 ASN 70 14.279 4.390 7.920 566 H TRP 71 H TRP 71 15.230 4.350 2.033 567 HA TRP 71 HA TRP 71 17.814 4.254 0.899 568 1HB TRP 71 1HB TRP 71 15.766 2.926 0.189 569 2HB TRP 71 2HB TRP 71 15.219 4.373 -0.646 570 HD1 TRP 71 HD1 TRP 71 18.015 1.717 -0.801 571 HE1 TRP 71 HE1 TRP 71 19.037 1.751 -3.167 572 HE3 TRP 71 HE3 TRP 71 15.448 5.703 -2.743 573 HZ2 TRP 71 HZ2 TRP 71 18.765 3.240 -5.547 574 HZ3 TRP 71 HZ3 TRP 71 15.865 6.334 -5.088 575 HH2 TRP 71 HH2 TRP 71 17.500 5.138 -6.466 576 H LEU 72 H LEU 72 15.197 6.618 0.649 577 HA LEU 72 HA LEU 72 16.611 8.228 -1.254 578 1HB LEU 72 1HB LEU 72 13.987 8.250 0.043 579 2HB LEU 72 2HB LEU 72 14.645 9.851 -0.226 580 HG LEU 72 HG LEU 72 13.711 9.711 -2.256 581 1HD1 LEU 72 1HD1 LEU 72 14.980 8.318 -3.950 582 2HD1 LEU 72 2HD1 LEU 72 16.005 7.804 -2.607 583 3HD1 LEU 72 3HD1 LEU 72 15.913 9.509 -3.045 584 1HD2 LEU 72 1HD2 LEU 72 12.709 7.758 -3.165 585 2HD2 LEU 72 2HD2 LEU 72 12.418 7.742 -1.426 586 3HD2 LEU 72 3HD2 LEU 72 13.668 6.708 -2.120 587 H LYS 73 H LYS 73 16.218 8.261 2.239 588 HA LYS 73 HA LYS 73 17.284 10.875 2.621 589 1HB LYS 73 1HB LYS 73 16.742 8.528 4.391 590 2HB LYS 73 2HB LYS 73 17.768 9.823 4.994 591 1HG LYS 73 1HG LYS 73 16.018 11.428 4.734 592 2HG LYS 73 2HG LYS 73 14.997 10.260 3.886 593 1HD LYS 73 1HD LYS 73 14.481 9.115 5.815 594 2HD LYS 73 2HD LYS 73 15.956 9.622 6.643 595 1HE LYS 73 1HE LYS 73 15.023 11.520 7.413 596 2HE LYS 73 2HE LYS 73 14.140 11.812 5.916 597 1HZ LYS 73 1HZ LYS 73 12.405 11.339 7.255 598 2HZ LYS 73 2HZ LYS 73 13.310 10.375 8.309 599 3HZ LYS 73 3HZ LYS 73 12.780 9.740 6.826 600 H GLU 74 H GLU 74 18.651 7.722 2.186 601 HA GLU 74 HA GLU 74 21.334 8.555 2.911 602 1HB GLU 74 1HB GLU 74 20.073 6.027 1.929 603 2HB GLU 74 2HB GLU 74 21.807 6.240 1.734 604 1HG GLU 74 1HG GLU 74 20.249 6.253 4.305 605 2HG GLU 74 2HG GLU 74 21.408 5.042 3.756 606 H ASN 75 H ASN 75 19.336 9.116 0.380 607 HA ASN 75 HA ASN 75 21.397 9.003 -1.696 608 1HB ASN 75 1HB ASN 75 18.580 8.628 -1.664 609 2HB ASN 75 2HB ASN 75 18.902 10.069 -2.626 610 1HD2 ASN 75 1HD2 ASN 75 18.453 6.878 -2.809 611 2HD2 ASN 75 2HD2 ASN 75 19.328 6.538 -4.258 612 H GLU 76 H GLU 76 18.896 11.277 -0.577 613 HA GLU 76 HA GLU 76 20.707 13.497 -1.272 614 1HB GLU 76 1HB GLU 76 17.697 13.658 -1.291 615 2HB GLU 76 2HB GLU 76 18.847 14.795 -1.981 616 1HG GLU 76 1HG GLU 76 19.157 12.162 -3.118 617 2HG GLU 76 2HG GLU 76 17.507 12.755 -3.295 618 1H MET 1 1H MET 1 29.970 -61.404 -75.903 619 2H MET 1 2H MET 1 30.997 -61.518 -74.560 620 3H MET 1 3H MET 1 29.388 -61.008 -74.362 621 HA MET 1 HA MET 1 30.289 -63.703 -75.210 622 1HB MET 1 1HB MET 1 29.959 -62.481 -72.665 623 2HB MET 1 2HB MET 1 28.639 -63.626 -72.867 624 1HG MET 1 1HG MET 1 30.117 -65.437 -73.130 625 2HG MET 1 2HG MET 1 31.504 -64.372 -73.350 626 1HE MET 1 1HE MET 1 28.673 -65.397 -70.995 627 2HE MET 1 2HE MET 1 29.475 -65.574 -69.433 628 3HE MET 1 3HE MET 1 29.847 -66.689 -70.748 629 H SER 2 H SER 2 28.640 -65.168 -75.723 630 HA SER 2 HA SER 2 26.394 -64.043 -77.019 631 1HB SER 2 1HB SER 2 26.237 -66.910 -76.381 632 2HB SER 2 2HB SER 2 26.183 -66.098 -77.946 633 HG SER 2 HG SER 2 28.250 -66.425 -78.187 634 H LEU 3 H LEU 3 26.793 -65.742 -73.942 635 HA LEU 3 HA LEU 3 24.059 -64.890 -73.237 636 1HB LEU 3 1HB LEU 3 24.273 -67.357 -73.525 637 2HB LEU 3 2HB LEU 3 25.473 -67.367 -72.246 638 HG LEU 3 HG LEU 3 23.275 -66.073 -71.121 639 1HD1 LEU 3 1HD1 LEU 3 21.397 -67.506 -71.506 640 2HD1 LEU 3 2HD1 LEU 3 22.343 -68.536 -72.583 641 3HD1 LEU 3 3HD1 LEU 3 21.954 -66.882 -73.060 642 1HD2 LEU 3 1HD2 LEU 3 23.063 -68.264 -69.873 643 2HD2 LEU 3 2HD2 LEU 3 24.651 -67.498 -69.845 644 3HD2 LEU 3 3HD2 LEU 3 24.353 -68.871 -70.912 645 H GLU 4 H GLU 4 24.499 -63.079 -72.105 646 HA GLU 4 HA GLU 4 26.334 -63.334 -69.809 647 1HB GLU 4 1HB GLU 4 25.403 -60.676 -70.831 648 2HB GLU 4 2HB GLU 4 26.880 -61.082 -69.971 649 1HG GLU 4 1HG GLU 4 27.669 -62.252 -72.021 650 2HG GLU 4 2HG GLU 4 26.245 -61.638 -72.857 651 H LYS 5 H LYS 5 24.348 -64.452 -68.931 652 HA LYS 5 HA LYS 5 22.148 -62.703 -68.228 653 1HB LYS 5 1HB LYS 5 22.448 -65.473 -68.597 654 2HB LYS 5 2HB LYS 5 22.097 -65.262 -66.887 655 1HG LYS 5 1HG LYS 5 20.034 -65.585 -68.047 656 2HG LYS 5 2HG LYS 5 20.115 -63.901 -67.519 657 1HD LYS 5 1HD LYS 5 21.003 -63.358 -69.828 658 2HD LYS 5 2HD LYS 5 20.550 -65.001 -70.292 659 1HE LYS 5 1HE LYS 5 18.399 -63.644 -68.915 660 2HE LYS 5 2HE LYS 5 18.935 -62.740 -70.331 661 1HZ LYS 5 1HZ LYS 5 17.130 -64.538 -70.593 662 2HZ LYS 5 2HZ LYS 5 18.423 -65.637 -70.536 663 3HZ LYS 5 3HZ LYS 5 18.373 -64.449 -71.746 664 H ALA 6 H ALA 6 24.051 -61.437 -67.134 665 HA ALA 6 HA ALA 6 24.453 -62.354 -64.385 666 1HB ALA 6 1HB ALA 6 26.384 -61.468 -65.694 667 2HB ALA 6 2HB ALA 6 26.090 -60.616 -64.178 668 3HB ALA 6 3HB ALA 6 25.588 -59.894 -65.709 669 H HIS 7 H HIS 7 23.753 -61.133 -62.610 670 HA HIS 7 HA HIS 7 22.090 -58.805 -63.120 671 1HB HIS 7 1HB HIS 7 20.177 -59.673 -61.842 672 2HB HIS 7 2HB HIS 7 20.474 -60.616 -63.291 673 HD1 HIS 7 HD1 HIS 7 19.463 -61.120 -60.006 674 HD2 HIS 7 HD2 HIS 7 22.278 -62.999 -62.427 675 HE1 HIS 7 HE1 HIS 7 19.813 -63.400 -59.001 676 HE2 HIS 7 HE2 HIS 7 21.356 -64.590 -60.608 677 H THR 8 H THR 8 24.380 -58.483 -62.095 678 HA THR 8 HA THR 8 24.372 -58.697 -59.198 679 HB THR 8 HB THR 8 26.462 -57.108 -60.562 680 HG1 THR 8 HG1 THR 8 27.446 -59.151 -61.292 681 1HG2 THR 8 1HG2 THR 8 26.663 -59.459 -58.676 682 2HG2 THR 8 2HG2 THR 8 26.496 -57.786 -58.146 683 3HG2 THR 8 3HG2 THR 8 27.920 -58.283 -59.059 684 H SER 9 H SER 9 22.354 -57.331 -59.255 685 HA SER 9 HA SER 9 22.507 -54.592 -59.968 686 1HB SER 9 1HB SER 9 20.455 -55.109 -58.016 687 2HB SER 9 2HB SER 9 20.282 -54.772 -59.743 688 HG SER 9 HG SER 9 20.120 -57.149 -58.393 689 H VAL 10 H VAL 10 22.745 -52.784 -58.709 690 HA VAL 10 HA VAL 10 23.799 -53.242 -55.997 691 HB VAL 10 HB VAL 10 24.280 -50.702 -57.527 692 1HG1 VAL 10 1HG1 VAL 10 26.068 -50.387 -56.031 693 2HG1 VAL 10 2HG1 VAL 10 26.048 -52.074 -55.523 694 3HG1 VAL 10 3HG1 VAL 10 24.741 -50.994 -55.043 695 1HG2 VAL 10 1HG2 VAL 10 26.224 -51.524 -58.562 696 2HG2 VAL 10 2HG2 VAL 10 25.000 -52.758 -58.869 697 3HG2 VAL 10 3HG2 VAL 10 26.207 -53.011 -57.608 698 H LYS 11 H LYS 11 21.954 -53.117 -54.829 699 HA LYS 11 HA LYS 11 20.148 -50.869 -55.281 700 1HB LYS 11 1HB LYS 11 19.942 -53.477 -53.817 701 2HB LYS 11 2HB LYS 11 18.845 -52.163 -53.410 702 1HG LYS 11 1HG LYS 11 17.543 -52.837 -55.065 703 2HG LYS 11 2HG LYS 11 18.797 -52.323 -56.194 704 1HD LYS 11 1HD LYS 11 19.761 -54.498 -56.240 705 2HD LYS 11 2HD LYS 11 18.760 -55.037 -54.889 706 1HE LYS 11 1HE LYS 11 16.912 -54.168 -56.738 707 2HE LYS 11 2HE LYS 11 18.156 -54.915 -57.738 708 1HZ LYS 11 1HZ LYS 11 17.639 -56.571 -55.526 709 2HZ LYS 11 2HZ LYS 11 17.394 -56.898 -57.173 710 3HZ LYS 11 3HZ LYS 11 16.162 -56.175 -56.258 711 H LYS 12 H LYS 12 20.514 -49.062 -54.224 712 HA LYS 12 HA LYS 12 22.040 -49.021 -51.762 713 1HB LYS 12 1HB LYS 12 21.955 -47.264 -53.744 714 2HB LYS 12 2HB LYS 12 20.621 -46.609 -52.805 715 1HG LYS 12 1HG LYS 12 21.981 -46.023 -51.031 716 2HG LYS 12 2HG LYS 12 23.244 -47.168 -51.489 717 1HD LYS 12 1HD LYS 12 24.231 -45.699 -52.868 718 2HD LYS 12 2HD LYS 12 22.691 -45.136 -53.520 719 1HE LYS 12 1HE LYS 12 23.673 -43.283 -52.427 720 2HE LYS 12 2HE LYS 12 22.378 -43.857 -51.376 721 1HZ LYS 12 1HZ LYS 12 23.816 -44.311 -49.760 722 2HZ LYS 12 2HZ LYS 12 24.963 -43.416 -50.636 723 3HZ LYS 12 3HZ LYS 12 24.893 -45.103 -50.805 724 H MET 13 H MET 13 20.248 -50.501 -50.913 725 HA MET 13 HA MET 13 17.805 -49.132 -50.153 726 1HB MET 13 1HB MET 13 18.732 -51.909 -50.333 727 2HB MET 13 2HB MET 13 17.716 -51.590 -48.934 728 1HG MET 13 1HG MET 13 15.870 -51.153 -50.194 729 2HG MET 13 2HG MET 13 16.809 -50.609 -51.584 730 1HE MET 13 1HE MET 13 14.333 -53.747 -51.885 731 2HE MET 13 2HE MET 13 14.424 -52.540 -50.601 732 3HE MET 13 3HE MET 13 14.952 -54.195 -50.296 733 H THR 14 H THR 14 20.859 -49.451 -48.861 734 HA THR 14 HA THR 14 19.892 -49.299 -46.095 735 HB THR 14 HB THR 14 22.731 -49.270 -46.235 736 HG1 THR 14 HG1 THR 14 21.453 -51.345 -47.744 737 1HG2 THR 14 1HG2 THR 14 21.121 -50.126 -44.444 738 2HG2 THR 14 2HG2 THR 14 22.570 -51.084 -44.753 739 3HG2 THR 14 3HG2 THR 14 21.017 -51.595 -45.416 740 H PHE 15 H PHE 15 19.553 -47.336 -45.365 741 HA PHE 15 HA PHE 15 21.526 -45.241 -45.785 742 1HB PHE 15 1HB PHE 15 19.923 -43.619 -46.645 743 2HB PHE 15 2HB PHE 15 19.995 -45.015 -47.713 744 HD1 PHE 15 HD1 PHE 15 17.898 -42.931 -45.687 745 HD2 PHE 15 HD2 PHE 15 18.166 -46.740 -47.563 746 HE1 PHE 15 HE1 PHE 15 15.456 -43.169 -45.543 747 HE2 PHE 15 HE2 PHE 15 15.724 -46.983 -47.428 748 HZ PHE 15 HZ PHE 15 14.372 -45.201 -46.353 749 H GLY 16 H GLY 16 18.777 -46.557 -44.139 750 1HA GLY 16 1HA GLY 16 18.348 -46.389 -41.862 751 2HA GLY 16 2HA GLY 16 19.489 -45.056 -41.759 752 H GLU 17 H GLU 17 16.332 -45.877 -41.493 753 HA GLU 17 HA GLU 17 15.376 -43.200 -42.270 754 1HB GLU 17 1HB GLU 17 14.239 -45.854 -42.481 755 2HB GLU 17 2HB GLU 17 13.166 -44.775 -41.601 756 1HG GLU 17 1HG GLU 17 14.167 -43.407 -43.881 757 2HG GLU 17 2HG GLU 17 13.558 -44.983 -44.382 758 H ASN 18 H ASN 18 16.098 -45.219 -39.632 759 HA ASN 18 HA ASN 18 14.252 -44.173 -37.738 760 1HB ASN 18 1HB ASN 18 16.227 -46.200 -37.805 761 2HB ASN 18 2HB ASN 18 16.636 -45.129 -36.469 762 1HD2 ASN 18 1HD2 ASN 18 14.805 -47.728 -37.424 763 2HD2 ASN 18 2HD2 ASN 18 13.667 -47.756 -36.122 764 H ARG 19 H ARG 19 14.446 -42.556 -36.274 765 HA ARG 19 HA ARG 19 16.948 -41.092 -36.039 766 1HB ARG 19 1HB ARG 19 15.221 -40.252 -37.960 767 2HB ARG 19 2HB ARG 19 14.640 -39.333 -36.577 768 1HG ARG 19 1HG ARG 19 16.197 -37.845 -37.142 769 2HG ARG 19 2HG ARG 19 17.344 -38.972 -36.414 770 1HD ARG 19 1HD ARG 19 18.327 -38.726 -38.454 771 2HD ARG 19 2HD ARG 19 17.235 -40.059 -38.827 772 HE ARG 19 HE ARG 19 16.350 -37.305 -39.333 773 1HH1 ARG 19 1HH1 ARG 19 17.404 -40.410 -40.580 774 2HH1 ARG 19 2HH1 ARG 19 16.755 -40.133 -42.170 775 1HH2 ARG 19 1HH2 ARG 19 15.533 -36.923 -41.440 776 2HH2 ARG 19 2HH2 ARG 19 15.674 -38.163 -42.654 777 H ASP 20 H ASP 20 17.064 -41.435 -33.879 778 HA ASP 20 HA ASP 20 14.770 -40.657 -32.214 779 1HB ASP 20 1HB ASP 20 15.924 -42.867 -31.804 780 2HB ASP 20 2HB ASP 20 17.351 -41.956 -31.311 781 H LEU 21 H LEU 21 15.191 -38.414 -32.873 782 HA LEU 21 HA LEU 21 17.505 -37.232 -31.489 783 1HB LEU 21 1HB LEU 21 16.271 -36.821 -34.102 784 2HB LEU 21 2HB LEU 21 16.514 -35.321 -33.229 785 HG LEU 21 HG LEU 21 18.926 -35.938 -32.966 786 1HD1 LEU 21 1HD1 LEU 21 19.209 -37.739 -35.106 787 2HD1 LEU 21 2HD1 LEU 21 17.977 -38.417 -34.040 788 3HD1 LEU 21 3HD1 LEU 21 19.573 -38.014 -33.402 789 1HD2 LEU 21 1HD2 LEU 21 17.842 -35.721 -35.774 790 2HD2 LEU 21 2HD2 LEU 21 19.518 -35.431 -35.306 791 3HD2 LEU 21 3HD2 LEU 21 18.236 -34.386 -34.689 792 H GLU 22 H GLU 22 14.291 -37.673 -31.076 793 HA GLU 22 HA GLU 22 13.270 -35.140 -30.512 794 1HB GLU 22 1HB GLU 22 12.066 -37.437 -30.658 795 2HB GLU 22 2HB GLU 22 12.428 -37.556 -28.940 796 1HG GLU 22 1HG GLU 22 10.208 -36.698 -29.228 797 2HG GLU 22 2HG GLU 22 11.239 -35.429 -28.570 798 H ARG 23 H ARG 23 13.804 -33.708 -29.051 799 HA ARG 23 HA ARG 23 14.810 -34.609 -26.443 800 1HB ARG 23 1HB ARG 23 16.412 -33.512 -28.419 801 2HB ARG 23 2HB ARG 23 16.036 -32.133 -27.396 802 1HG ARG 23 1HG ARG 23 18.087 -33.123 -26.669 803 2HG ARG 23 2HG ARG 23 16.851 -33.402 -25.443 804 1HD ARG 23 1HD ARG 23 18.088 -35.418 -25.702 805 2HD ARG 23 2HD ARG 23 16.506 -35.673 -26.427 806 HE ARG 23 HE ARG 23 18.413 -34.820 -28.364 807 1HH1 ARG 23 1HH1 ARG 23 17.335 -37.589 -26.509 808 2HH1 ARG 23 2HH1 ARG 23 17.940 -38.759 -27.649 809 1HH2 ARG 23 1HH2 ARG 23 19.171 -36.344 -29.899 810 2HH2 ARG 23 2HH2 ARG 23 18.991 -38.047 -29.580 811 H VAL 24 H VAL 24 12.637 -34.162 -25.773 812 HA VAL 24 HA VAL 24 12.162 -31.278 -25.373 813 HB VAL 24 HB VAL 24 9.651 -32.302 -25.164 814 1HG1 VAL 24 1HG1 VAL 24 10.726 -31.406 -27.817 815 2HG1 VAL 24 2HG1 VAL 24 10.599 -30.305 -26.445 816 3HG1 VAL 24 3HG1 VAL 24 9.152 -31.080 -27.091 817 1HG2 VAL 24 1HG2 VAL 24 10.742 -34.479 -26.116 818 2HG2 VAL 24 2HG2 VAL 24 10.622 -33.628 -27.656 819 3HG2 VAL 24 3HG2 VAL 24 9.168 -33.943 -26.708 820 H VAL 25 H VAL 25 11.023 -30.726 -23.442 821 HA VAL 25 HA VAL 25 10.675 -32.763 -21.411 822 HB VAL 25 HB VAL 25 13.082 -32.085 -21.222 823 1HG1 VAL 25 1HG1 VAL 25 13.506 -29.926 -21.587 824 2HG1 VAL 25 2HG1 VAL 25 13.057 -29.701 -19.895 825 3HG1 VAL 25 3HG1 VAL 25 11.866 -29.431 -21.169 826 1HG2 VAL 25 1HG2 VAL 25 12.228 -33.002 -19.267 827 2HG2 VAL 25 2HG2 VAL 25 11.142 -31.642 -18.985 828 3HG2 VAL 25 3HG2 VAL 25 12.875 -31.454 -18.723 829 H THR 26 H THR 26 9.296 -32.096 -19.738 830 HA THR 26 HA THR 26 7.902 -29.562 -20.308 831 HB THR 26 HB THR 26 6.240 -31.425 -18.895 832 HG1 THR 26 HG1 THR 26 7.589 -33.022 -19.874 833 1HG2 THR 26 1HG2 THR 26 5.602 -29.504 -20.406 834 2HG2 THR 26 2HG2 THR 26 4.723 -31.009 -20.674 835 3HG2 THR 26 3HG2 THR 26 6.028 -30.542 -21.767 836 H ALA 27 H ALA 27 9.336 -28.527 -18.748 837 HA ALA 27 HA ALA 27 8.265 -28.846 -16.033 838 1HB ALA 27 1HB ALA 27 10.405 -28.694 -15.004 839 2HB ALA 27 2HB ALA 27 11.196 -28.376 -16.548 840 3HB ALA 27 3HB ALA 27 10.508 -29.968 -16.220 841 HA PRO 28 HA PRO 28 8.252 -24.481 -17.481 842 1HB PRO 28 1HB PRO 28 5.661 -23.935 -17.070 843 2HB PRO 28 2HB PRO 28 6.202 -24.829 -18.497 844 1HG PRO 28 1HG PRO 28 4.980 -25.853 -15.967 845 2HG PRO 28 2HG PRO 28 4.672 -26.353 -17.638 846 1HD PRO 28 1HD PRO 28 6.318 -27.702 -15.892 847 2HD PRO 28 2HD PRO 28 6.451 -27.787 -17.659 848 H VAL 29 H VAL 29 8.045 -22.538 -16.331 849 HA VAL 29 HA VAL 29 8.216 -21.161 -14.539 850 HB VAL 29 HB VAL 29 6.368 -23.062 -13.097 851 1HG1 VAL 29 1HG1 VAL 29 6.795 -20.089 -12.817 852 2HG1 VAL 29 2HG1 VAL 29 7.383 -21.324 -11.703 853 3HG1 VAL 29 3HG1 VAL 29 5.649 -21.066 -11.897 854 1HG2 VAL 29 1HG2 VAL 29 4.746 -21.107 -14.049 855 2HG2 VAL 29 2HG2 VAL 29 4.971 -22.677 -14.823 856 3HG2 VAL 29 3HG2 VAL 29 5.887 -21.279 -15.382 857 H SER 30 H SER 30 10.364 -21.463 -14.066 858 HA SER 30 HA SER 30 11.179 -23.592 -12.273 859 1HB SER 30 1HB SER 30 12.841 -21.252 -13.222 860 2HB SER 30 2HB SER 30 13.412 -22.811 -12.620 861 HG SER 30 HG SER 30 12.094 -23.653 -14.510 862 H SER 31 H SER 31 10.407 -20.201 -12.161 863 HA SER 31 HA SER 31 10.416 -20.335 -9.252 864 1HB SER 31 1HB SER 31 11.440 -17.776 -10.341 865 2HB SER 31 2HB SER 31 11.888 -18.635 -8.866 866 HG SER 31 HG SER 31 12.864 -18.926 -11.484 867 H GLY 32 H GLY 32 8.540 -19.602 -8.514 868 1HA GLY 32 1HA GLY 32 7.185 -17.390 -9.844 869 2HA GLY 32 2HA GLY 32 6.345 -18.936 -9.843 870 H LYS 33 H LYS 33 8.156 -16.948 -7.503 871 HA LYS 33 HA LYS 33 5.893 -17.284 -5.641 872 1HB LYS 33 1HB LYS 33 8.843 -17.545 -5.027 873 2HB LYS 33 2HB LYS 33 7.599 -17.405 -3.793 874 1HG LYS 33 1HG LYS 33 6.561 -19.461 -5.017 875 2HG LYS 33 2HG LYS 33 8.201 -19.670 -5.632 876 1HD LYS 33 1HD LYS 33 8.964 -20.387 -3.652 877 2HD LYS 33 2HD LYS 33 8.090 -19.141 -2.761 878 1HE LYS 33 1HE LYS 33 6.097 -20.822 -3.669 879 2HE LYS 33 2HE LYS 33 7.405 -21.922 -3.240 880 1HZ LYS 33 1HZ LYS 33 5.759 -21.302 -1.430 881 2HZ LYS 33 2HZ LYS 33 6.517 -19.785 -1.398 882 3HZ LYS 33 3HZ LYS 33 7.406 -21.188 -1.040 883 H ILE 34 H ILE 34 6.175 -15.082 -7.278 884 HA ILE 34 HA ILE 34 7.183 -12.997 -5.451 885 HB ILE 34 HB ILE 34 6.803 -11.675 -7.791 886 1HG1 ILE 34 1HG1 ILE 34 7.936 -14.362 -8.600 887 2HG1 ILE 34 2HG1 ILE 34 6.268 -13.885 -8.900 888 1HG2 ILE 34 1HG2 ILE 34 8.758 -11.447 -6.453 889 2HG2 ILE 34 2HG2 ILE 34 9.280 -11.902 -8.076 890 3HG2 ILE 34 3HG2 ILE 34 9.253 -13.106 -6.785 891 1HD1 ILE 34 1HD1 ILE 34 8.777 -12.843 -10.127 892 2HD1 ILE 34 2HD1 ILE 34 7.326 -11.840 -10.078 893 3HD1 ILE 34 3HD1 ILE 34 7.293 -13.400 -10.899 894 H LYS 35 H LYS 35 5.847 -11.463 -4.741 895 HA LYS 35 HA LYS 35 3.013 -11.642 -5.543 896 1HB LYS 35 1HB LYS 35 3.622 -10.269 -3.017 897 2HB LYS 35 2HB LYS 35 2.410 -11.494 -3.365 898 1HG LYS 35 1HG LYS 35 5.127 -12.544 -3.362 899 2HG LYS 35 2HG LYS 35 4.649 -11.834 -1.820 900 1HD LYS 35 1HD LYS 35 3.334 -13.569 -1.353 901 2HD LYS 35 2HD LYS 35 2.525 -13.444 -2.918 902 1HE LYS 35 1HE LYS 35 4.448 -14.657 -3.932 903 2HE LYS 35 2HE LYS 35 5.100 -14.893 -2.310 904 1HZ LYS 35 1HZ LYS 35 3.209 -16.196 -1.717 905 2HZ LYS 35 2HZ LYS 35 3.808 -16.803 -3.182 906 3HZ LYS 35 3HZ LYS 35 2.415 -15.838 -3.171 907 H ARG 36 H ARG 36 1.793 -9.640 -5.620 908 HA ARG 36 HA ARG 36 3.519 -7.369 -6.353 909 1HB ARG 36 1HB ARG 36 0.597 -7.686 -7.029 910 2HB ARG 36 2HB ARG 36 1.754 -6.574 -7.746 911 1HG ARG 36 1HG ARG 36 1.874 -9.570 -8.012 912 2HG ARG 36 2HG ARG 36 1.167 -8.480 -9.206 913 1HD ARG 36 1HD ARG 36 3.232 -7.551 -9.758 914 2HD ARG 36 2HD ARG 36 3.984 -8.099 -8.261 915 HE ARG 36 HE ARG 36 3.386 -10.422 -9.469 916 1HH1 ARG 36 1HH1 ARG 36 4.988 -7.532 -10.626 917 2HH1 ARG 36 2HH1 ARG 36 5.990 -8.392 -11.761 918 1HH2 ARG 36 1HH2 ARG 36 4.703 -11.553 -10.933 919 2HH2 ARG 36 2HH2 ARG 36 5.832 -10.685 -11.938 920 H VAL 37 H VAL 37 3.287 -5.395 -5.414 921 HA VAL 37 HA VAL 37 1.188 -5.091 -3.388 922 HB VAL 37 HB VAL 37 3.851 -5.555 -2.738 923 1HG1 VAL 37 1HG1 VAL 37 4.185 -3.111 -3.477 924 2HG1 VAL 37 2HG1 VAL 37 4.839 -3.613 -1.919 925 3HG1 VAL 37 3HG1 VAL 37 3.330 -2.701 -1.991 926 1HG2 VAL 37 1HG2 VAL 37 2.870 -4.451 -0.477 927 2HG2 VAL 37 2HG2 VAL 37 2.488 -6.079 -1.034 928 3HG2 VAL 37 3HG2 VAL 37 1.381 -4.749 -1.371 929 H ASN 38 H ASN 38 0.426 -3.026 -3.083 930 HA ASN 38 HA ASN 38 1.349 -1.031 -5.046 931 1HB ASN 38 1HB ASN 38 -0.915 -1.877 -5.514 932 2HB ASN 38 2HB ASN 38 -1.424 -1.420 -3.892 933 1HD2 ASN 38 1HD2 ASN 38 -0.240 -0.166 -6.950 934 2HD2 ASN 38 2HD2 ASN 38 -0.977 1.392 -6.805 935 H VAL 39 H VAL 39 2.391 0.607 -4.112 936 HA VAL 39 HA VAL 39 1.501 1.448 -1.433 937 HB VAL 39 HB VAL 39 4.161 2.250 -1.636 938 1HG1 VAL 39 1HG1 VAL 39 4.439 1.019 0.320 939 2HG1 VAL 39 2HG1 VAL 39 3.277 -0.213 -0.174 940 3HG1 VAL 39 3HG1 VAL 39 2.714 1.391 0.298 941 1HG2 VAL 39 1HG2 VAL 39 4.890 -0.406 -1.809 942 2HG2 VAL 39 2HG2 VAL 39 5.176 0.834 -3.029 943 3HG2 VAL 39 3HG2 VAL 39 3.754 -0.202 -3.141 944 H ASN 40 H ASN 40 2.183 3.675 -0.874 945 HA ASN 40 HA ASN 40 2.184 5.427 -3.238 946 1HB ASN 40 1HB ASN 40 0.444 5.462 -0.801 947 2HB ASN 40 2HB ASN 40 0.870 6.991 -1.561 948 1HD2 ASN 40 1HD2 ASN 40 -0.475 3.801 -2.265 949 2HD2 ASN 40 2HD2 ASN 40 -1.546 4.334 -3.523 950 H PHE 41 H PHE 41 4.002 6.529 -3.291 951 HA PHE 41 HA PHE 41 5.338 7.230 -0.760 952 1HB PHE 41 1HB PHE 41 6.548 7.288 -3.534 953 2HB PHE 41 2HB PHE 41 7.396 7.466 -2.006 954 HD1 PHE 41 HD1 PHE 41 5.687 5.140 -0.735 955 HD2 PHE 41 HD2 PHE 41 8.069 5.510 -4.243 956 HE1 PHE 41 HE1 PHE 41 6.116 2.719 -0.695 957 HE2 PHE 41 HE2 PHE 41 8.521 3.093 -4.195 958 HZ PHE 41 HZ PHE 41 7.572 1.695 -2.499 959 H ASP 42 H ASP 42 6.402 9.372 -0.749 960 HA ASP 42 HA ASP 42 4.577 11.421 -1.367 961 1HB ASP 42 1HB ASP 42 6.625 11.259 0.313 962 2HB ASP 42 2HB ASP 42 7.461 12.072 -1.000 963 H GLU 43 H GLU 43 4.892 13.272 -2.746 964 HA GLU 43 HA GLU 43 5.561 12.624 -5.418 965 1HB GLU 43 1HB GLU 43 4.232 14.709 -4.124 966 2HB GLU 43 2HB GLU 43 5.633 15.469 -4.867 967 1HG GLU 43 1HG GLU 43 4.430 13.678 -6.738 968 2HG GLU 43 2HG GLU 43 3.201 14.754 -6.074 969 H GLU 44 H GLU 44 7.228 14.319 -2.834 970 HA GLU 44 HA GLU 44 9.472 15.187 -4.298 971 1HB GLU 44 1HB GLU 44 8.682 14.958 -1.498 972 2HB GLU 44 2HB GLU 44 10.403 14.704 -1.751 973 1HG GLU 44 1HG GLU 44 10.311 16.968 -1.403 974 2HG GLU 44 2HG GLU 44 10.254 16.874 -3.163 975 H LYS 45 H LYS 45 8.692 12.154 -2.725 976 HA LYS 45 HA LYS 45 11.302 11.043 -2.846 977 1HB LYS 45 1HB LYS 45 8.582 9.754 -2.599 978 2HB LYS 45 2HB LYS 45 10.101 8.862 -2.515 979 1HG LYS 45 1HG LYS 45 10.557 10.779 -0.665 980 2HG LYS 45 2HG LYS 45 8.807 10.599 -0.531 981 1HD LYS 45 1HD LYS 45 8.988 8.604 0.465 982 2HD LYS 45 2HD LYS 45 10.208 8.052 -0.686 983 1HE LYS 45 1HE LYS 45 11.452 8.086 1.233 984 2HE LYS 45 2HE LYS 45 11.743 9.720 0.643 985 1HZ LYS 45 1HZ LYS 45 9.587 9.077 2.578 986 2HZ LYS 45 2HZ LYS 45 10.195 10.609 2.163 987 3HZ LYS 45 3HZ LYS 45 11.149 9.529 3.061 988 H HIS 46 H HIS 46 8.755 11.426 -5.134 989 HA HIS 46 HA HIS 46 9.719 9.378 -6.930 990 1HB HIS 46 1HB HIS 46 7.315 10.644 -6.708 991 2HB HIS 46 2HB HIS 46 8.029 11.500 -8.072 992 HD1 HIS 46 HD1 HIS 46 8.053 10.311 -10.300 993 HD2 HIS 46 HD2 HIS 46 7.021 7.807 -7.136 994 HE1 HIS 46 HE1 HIS 46 7.291 8.161 -11.355 995 HE2 HIS 46 HE2 HIS 46 6.470 6.744 -9.436 996 H THR 47 H THR 47 10.089 12.844 -6.507 997 HA THR 47 HA THR 47 11.459 13.404 -8.913 998 HB THR 47 HB THR 47 12.308 14.932 -6.544 999 HG1 THR 47 HG1 THR 47 10.291 15.740 -6.071 1000 1HG2 THR 47 1HG2 THR 47 12.656 15.665 -8.874 1001 2HG2 THR 47 2HG2 THR 47 11.687 16.815 -7.951 1002 3HG2 THR 47 3HG2 THR 47 10.907 15.726 -9.097 1003 H ARG 48 H ARG 48 12.567 12.521 -5.664 1004 HA ARG 48 HA ARG 48 15.337 12.446 -6.323 1005 1HB ARG 48 1HB ARG 48 14.071 10.792 -4.156 1006 2HB ARG 48 2HB ARG 48 15.700 11.451 -4.212 1007 1HG ARG 48 1HG ARG 48 13.232 13.161 -4.032 1008 2HG ARG 48 2HG ARG 48 14.109 12.566 -2.622 1009 1HD ARG 48 1HD ARG 48 16.163 13.658 -3.564 1010 2HD ARG 48 2HD ARG 48 15.126 14.405 -4.779 1011 HE ARG 48 HE ARG 48 13.972 14.994 -2.349 1012 1HH1 ARG 48 1HH1 ARG 48 17.076 15.603 -3.889 1013 2HH1 ARG 48 2HH1 ARG 48 17.350 17.086 -3.012 1014 1HH2 ARG 48 1HH2 ARG 48 14.336 16.946 -1.230 1015 2HH2 ARG 48 2HH2 ARG 48 15.805 17.836 -1.496 1016 H PHE 49 H PHE 49 12.731 10.086 -6.320 1017 HA PHE 49 HA PHE 49 14.181 7.755 -6.748 1018 1HB PHE 49 1HB PHE 49 11.441 8.578 -6.902 1019 2HB PHE 49 2HB PHE 49 11.815 7.590 -8.306 1020 HD1 PHE 49 HD1 PHE 49 13.909 6.749 -5.591 1021 HD2 PHE 49 HD2 PHE 49 9.994 6.157 -7.149 1022 HE1 PHE 49 HE1 PHE 49 13.673 4.718 -4.224 1023 HE2 PHE 49 HE2 PHE 49 9.751 4.130 -5.781 1024 HZ PHE 49 HZ PHE 49 11.585 3.404 -4.326 1025 H LYS 50 H LYS 50 12.845 10.031 -9.121 1026 HA LYS 50 HA LYS 50 13.689 8.686 -11.430 1027 1HB LYS 50 1HB LYS 50 12.698 11.359 -10.751 1028 2HB LYS 50 2HB LYS 50 13.781 11.343 -12.137 1029 1HG LYS 50 1HG LYS 50 11.214 9.814 -11.802 1030 2HG LYS 50 2HG LYS 50 11.549 11.125 -12.934 1031 1HD LYS 50 1HD LYS 50 13.304 9.649 -13.962 1032 2HD LYS 50 2HD LYS 50 12.699 8.340 -12.945 1033 1HE LYS 50 1HE LYS 50 10.485 9.558 -14.238 1034 2HE LYS 50 2HE LYS 50 11.721 9.235 -15.452 1035 1HZ LYS 50 1HZ LYS 50 11.576 6.990 -13.823 1036 2HZ LYS 50 2HZ LYS 50 11.082 7.133 -15.437 1037 3HZ LYS 50 3HZ LYS 50 9.974 7.422 -14.184 1038 H ALA 51 H ALA 51 15.243 11.354 -9.656 1039 HA ALA 51 HA ALA 51 17.530 11.478 -11.293 1040 1HB ALA 51 1HB ALA 51 16.518 12.938 -9.190 1041 2HB ALA 51 2HB ALA 51 18.041 13.231 -10.028 1042 3HB ALA 51 3HB ALA 51 18.020 12.274 -8.547 1043 H ALA 52 H ALA 52 16.944 9.788 -8.220 1044 HA ALA 52 HA ALA 52 19.577 8.795 -7.963 1045 1HB ALA 52 1HB ALA 52 17.799 7.035 -6.654 1046 2HB ALA 52 2HB ALA 52 17.151 8.665 -6.492 1047 3HB ALA 52 3HB ALA 52 18.791 8.313 -5.954 1048 H CYS 53 H CYS 53 16.662 7.447 -9.462 1049 HA CYS 53 HA CYS 53 17.755 4.877 -9.890 1050 1HB CYS 53 1HB CYS 53 15.843 4.392 -11.141 1051 2HB CYS 53 2HB CYS 53 15.284 5.626 -10.022 1052 HG CYS 53 HG CYS 53 15.682 7.678 -12.061 1053 H ALA 54 H ALA 54 17.953 7.888 -11.651 1054 HA ALA 54 HA ALA 54 19.154 6.727 -14.000 1055 1HB ALA 54 1HB ALA 54 18.606 8.709 -14.837 1056 2HB ALA 54 2HB ALA 54 19.819 9.470 -13.807 1057 3HB ALA 54 3HB ALA 54 18.163 9.285 -13.232 1058 H ARG 55 H ARG 55 20.206 7.957 -10.937 1059 HA ARG 55 HA ARG 55 22.983 8.203 -11.632 1060 1HB ARG 55 1HB ARG 55 21.307 8.862 -9.404 1061 2HB ARG 55 2HB ARG 55 22.660 7.897 -8.830 1062 1HG ARG 55 1HG ARG 55 23.757 9.769 -10.604 1063 2HG ARG 55 2HG ARG 55 22.606 10.650 -9.595 1064 1HD ARG 55 1HD ARG 55 24.511 10.766 -8.308 1065 2HD ARG 55 2HD ARG 55 23.729 9.330 -7.650 1066 HE ARG 55 HE ARG 55 25.841 9.124 -9.697 1067 1HH1 ARG 55 1HH1 ARG 55 24.493 8.223 -6.590 1068 2HH1 ARG 55 2HH1 ARG 55 25.771 7.098 -6.223 1069 1HH2 ARG 55 1HH2 ARG 55 27.491 7.633 -9.246 1070 2HH2 ARG 55 2HH2 ARG 55 27.464 6.733 -7.755 1071 H LYS 56 H LYS 56 20.916 5.798 -10.179 1072 HA LYS 56 HA LYS 56 23.190 4.111 -9.525 1073 1HB LYS 56 1HB LYS 56 20.553 4.534 -8.488 1074 2HB LYS 56 2HB LYS 56 20.752 2.832 -8.880 1075 1HG LYS 56 1HG LYS 56 23.023 3.984 -7.458 1076 2HG LYS 56 2HG LYS 56 21.509 4.020 -6.551 1077 1HD LYS 56 1HD LYS 56 21.865 1.892 -6.028 1078 2HD LYS 56 2HD LYS 56 21.593 1.494 -7.726 1079 1HE LYS 56 1HE LYS 56 23.698 0.555 -6.979 1080 2HE LYS 56 2HE LYS 56 23.989 1.828 -8.165 1081 1HZ LYS 56 1HZ LYS 56 24.002 2.525 -5.316 1082 2HZ LYS 56 2HZ LYS 56 24.860 3.221 -6.603 1083 3HZ LYS 56 3HZ LYS 56 25.354 1.730 -5.961 1084 H GLY 57 H GLY 57 20.895 4.432 -12.015 1085 1HA GLY 57 1HA GLY 57 20.560 3.170 -13.926 1086 2HA GLY 57 2HA GLY 57 21.827 2.076 -13.380 1087 H THR 58 H THR 58 18.644 3.110 -12.234 1088 HA THR 58 HA THR 58 17.949 0.285 -11.777 1089 HB THR 58 HB THR 58 17.024 2.410 -9.892 1090 HG1 THR 58 HG1 THR 58 19.598 1.171 -9.763 1091 1HG2 THR 58 1HG2 THR 58 18.018 -0.334 -9.215 1092 2HG2 THR 58 2HG2 THR 58 16.389 -0.088 -9.851 1093 3HG2 THR 58 3HG2 THR 58 16.876 0.686 -8.340 1094 H SER 59 H SER 59 15.739 -0.246 -11.907 1095 HA SER 59 HA SER 59 14.126 1.531 -13.539 1096 1HB SER 59 1HB SER 59 12.700 -0.818 -12.760 1097 2HB SER 59 2HB SER 59 13.377 -0.433 -14.343 1098 HG SER 59 HG SER 59 15.328 -1.377 -13.703 1099 H ILE 60 H ILE 60 11.794 1.857 -12.951 1100 HA ILE 60 HA ILE 60 11.628 3.118 -10.453 1101 HB ILE 60 HB ILE 60 10.274 3.681 -12.497 1102 1HG1 ILE 60 1HG1 ILE 60 8.121 4.062 -11.009 1103 2HG1 ILE 60 2HG1 ILE 60 9.184 3.503 -9.719 1104 1HG2 ILE 60 1HG2 ILE 60 9.172 1.922 -13.361 1105 2HG2 ILE 60 2HG2 ILE 60 7.919 2.402 -12.216 1106 3HG2 ILE 60 3HG2 ILE 60 9.042 1.103 -11.806 1107 1HD1 ILE 60 1HD1 ILE 60 10.303 5.431 -9.664 1108 2HD1 ILE 60 2HD1 ILE 60 8.937 6.081 -10.568 1109 3HD1 ILE 60 3HD1 ILE 60 10.383 5.544 -11.422 1110 H THR 61 H THR 61 10.834 -0.119 -11.417 1111 HA THR 61 HA THR 61 9.442 -0.722 -8.952 1112 HB THR 61 HB THR 61 10.415 -2.968 -10.575 1113 HG1 THR 61 HG1 THR 61 8.371 -1.494 -11.816 1114 1HG2 THR 61 1HG2 THR 61 7.554 -2.243 -10.054 1115 2HG2 THR 61 2HG2 THR 61 8.573 -2.858 -8.754 1116 3HG2 THR 61 3HG2 THR 61 8.294 -3.838 -10.193 1117 H ASP 62 H ASP 62 12.584 -1.184 -10.437 1118 HA ASP 62 HA ASP 62 13.610 -3.036 -8.588 1119 1HB ASP 62 1HB ASP 62 14.498 -1.785 -10.960 1120 2HB ASP 62 2HB ASP 62 15.723 -1.472 -9.733 1121 H VAL 63 H VAL 63 13.676 0.502 -8.655 1122 HA VAL 63 HA VAL 63 15.616 0.887 -6.669 1123 HB VAL 63 HB VAL 63 14.187 3.022 -6.131 1124 1HG1 VAL 63 1HG1 VAL 63 16.280 2.483 -7.788 1125 2HG1 VAL 63 2HG1 VAL 63 15.654 4.089 -7.419 1126 3HG1 VAL 63 3HG1 VAL 63 15.131 3.253 -8.880 1127 1HG2 VAL 63 1HG2 VAL 63 13.034 2.237 -8.801 1128 2HG2 VAL 63 2HG2 VAL 63 12.746 3.741 -7.925 1129 3HG2 VAL 63 3HG2 VAL 63 12.162 2.212 -7.268 1130 H VAL 64 H VAL 64 12.150 0.313 -6.445 1131 HA VAL 64 HA VAL 64 11.961 0.612 -3.630 1132 HB VAL 64 HB VAL 64 10.141 -1.219 -5.150 1133 1HG1 VAL 64 1HG1 VAL 64 9.653 0.797 -2.961 1134 2HG1 VAL 64 2HG1 VAL 64 9.865 -0.937 -2.724 1135 3HG1 VAL 64 3HG1 VAL 64 8.475 -0.333 -3.625 1136 1HG2 VAL 64 1HG2 VAL 64 9.053 1.378 -5.252 1137 2HG2 VAL 64 2HG2 VAL 64 9.544 0.353 -6.599 1138 3HG2 VAL 64 3HG2 VAL 64 10.694 1.486 -5.888 1139 H ASN 65 H ASN 65 12.431 -2.170 -5.772 1140 HA ASN 65 HA ASN 65 12.485 -4.188 -3.820 1141 1HB ASN 65 1HB ASN 65 12.589 -4.281 -6.457 1142 2HB ASN 65 2HB ASN 65 14.326 -4.299 -6.183 1143 1HD2 ASN 65 1HD2 ASN 65 13.726 -6.412 -7.387 1144 2HD2 ASN 65 2HD2 ASN 65 13.508 -7.795 -6.363 1145 H GLN 66 H GLN 66 14.903 -1.870 -4.834 1146 HA GLN 66 HA GLN 66 17.117 -3.106 -3.543 1147 1HB GLN 66 1HB GLN 66 16.725 -0.974 -5.303 1148 2HB GLN 66 2HB GLN 66 17.426 -0.254 -3.859 1149 1HG GLN 66 1HG GLN 66 19.407 -1.335 -4.115 1150 2HG GLN 66 2HG GLN 66 18.672 -2.726 -4.911 1151 1HE2 GLN 66 1HE2 GLN 66 19.432 0.690 -5.392 1152 2HE2 GLN 66 2HE2 GLN 66 19.706 0.567 -7.096 1153 H LEU 67 H LEU 67 14.885 -0.491 -2.587 1154 HA LEU 67 HA LEU 67 16.328 0.100 -0.208 1155 1HB LEU 67 1HB LEU 67 14.032 1.133 0.484 1156 2HB LEU 67 2HB LEU 67 15.025 1.890 -0.742 1157 HG LEU 67 HG LEU 67 13.418 0.254 -2.242 1158 1HD1 LEU 67 1HD1 LEU 67 11.761 1.394 0.003 1159 2HD1 LEU 67 2HD1 LEU 67 12.081 -0.321 -0.274 1160 3HD1 LEU 67 3HD1 LEU 67 11.148 0.606 -1.450 1161 1HD2 LEU 67 1HD2 LEU 67 12.148 2.400 -2.667 1162 2HD2 LEU 67 2HD2 LEU 67 13.895 2.477 -2.887 1163 3HD2 LEU 67 3HD2 LEU 67 13.159 3.136 -1.426 1164 H VAL 68 H VAL 68 13.614 -2.003 -0.969 1165 HA VAL 68 HA VAL 68 13.020 -2.801 1.686 1166 HB VAL 68 HB VAL 68 12.746 -4.567 -0.750 1167 1HG1 VAL 68 1HG1 VAL 68 12.126 -5.943 0.927 1168 2HG1 VAL 68 2HG1 VAL 68 10.602 -5.066 0.793 1169 3HG1 VAL 68 3HG1 VAL 68 11.770 -4.615 2.032 1170 1HG2 VAL 68 1HG2 VAL 68 11.750 -2.315 -1.135 1171 2HG2 VAL 68 2HG2 VAL 68 10.704 -2.599 0.257 1172 3HG2 VAL 68 3HG2 VAL 68 10.585 -3.640 -1.163 1173 H ASP 69 H ASP 69 15.279 -3.927 -0.754 1174 HA ASP 69 HA ASP 69 16.218 -6.256 0.423 1175 1HB ASP 69 1HB ASP 69 17.163 -4.360 -1.592 1176 2HB ASP 69 2HB ASP 69 18.477 -5.128 -0.698 1177 H ASN 70 H ASN 70 17.677 -3.023 0.657 1178 HA ASN 70 HA ASN 70 19.670 -3.689 2.462 1179 1HB ASN 70 1HB ASN 70 19.363 -1.509 1.150 1180 2HB ASN 70 2HB ASN 70 18.324 -0.995 2.478 1181 1HD2 ASN 70 1HD2 ASN 70 19.342 0.265 3.846 1182 2HD2 ASN 70 2HD2 ASN 70 21.009 0.130 4.317 1183 H TRP 71 H TRP 71 16.510 -2.212 3.202 1184 HA TRP 71 HA TRP 71 16.860 -2.197 5.978 1185 1HB TRP 71 1HB TRP 71 15.119 -0.904 4.766 1186 2HB TRP 71 2HB TRP 71 14.238 -2.402 4.480 1187 HD1 TRP 71 HD1 TRP 71 14.931 0.202 7.133 1188 HE1 TRP 71 HE1 TRP 71 13.458 -0.255 9.200 1189 HE3 TRP 71 HE3 TRP 71 13.077 -4.389 5.805 1190 HZ2 TRP 71 HZ2 TRP 71 11.743 -2.293 10.127 1191 HZ3 TRP 71 HZ3 TRP 71 11.517 -5.509 7.335 1192 HH2 TRP 71 HH2 TRP 71 10.866 -4.486 9.451 1193 H LEU 72 H LEU 72 14.998 -4.484 3.997 1194 HA LEU 72 HA LEU 72 14.016 -6.066 5.987 1195 1HB LEU 72 1HB LEU 72 13.665 -6.093 3.406 1196 2HB LEU 72 2HB LEU 72 14.923 -7.315 3.421 1197 HG LEU 72 HG LEU 72 13.051 -8.060 5.395 1198 1HD1 LEU 72 1HD1 LEU 72 11.797 -6.515 3.386 1199 2HD1 LEU 72 2HD1 LEU 72 11.047 -7.445 4.683 1200 3HD1 LEU 72 3HD1 LEU 72 11.355 -8.201 3.120 1201 1HD2 LEU 72 1HD2 LEU 72 14.471 -9.547 4.055 1202 2HD2 LEU 72 2HD2 LEU 72 13.537 -9.140 2.617 1203 3HD2 LEU 72 3HD2 LEU 72 12.773 -10.010 3.946 1204 H LYS 73 H LYS 73 17.106 -6.516 4.301 1205 HA LYS 73 HA LYS 73 17.648 -8.865 5.890 1206 1HB LYS 73 1HB LYS 73 19.398 -7.528 3.826 1207 2HB LYS 73 2HB LYS 73 19.575 -9.160 4.455 1208 1HG LYS 73 1HG LYS 73 17.904 -9.990 3.155 1209 2HG LYS 73 2HG LYS 73 16.976 -8.489 3.216 1210 1HD LYS 73 1HD LYS 73 17.817 -7.807 1.273 1211 2HD LYS 73 2HD LYS 73 19.468 -8.092 1.824 1212 1HE LYS 73 1HE LYS 73 19.541 -9.718 0.297 1213 2HE LYS 73 2HE LYS 73 18.504 -10.633 1.391 1214 1HZ LYS 73 1HZ LYS 73 17.798 -10.318 -1.053 1215 2HZ LYS 73 2HZ LYS 73 17.305 -8.770 -0.558 1216 3HZ LYS 73 3HZ LYS 73 16.632 -10.153 0.167 1217 H GLU 74 H GLU 74 18.476 -5.506 6.052 1218 HA GLU 74 HA GLU 74 20.787 -6.078 7.744 1219 1HB GLU 74 1HB GLU 74 19.920 -3.820 6.119 1220 2HB GLU 74 2HB GLU 74 20.531 -3.340 7.696 1221 1HG GLU 74 1HG GLU 74 22.016 -5.140 5.803 1222 2HG GLU 74 2HG GLU 74 22.226 -3.391 5.875 1223 H ASN 75 H ASN 75 17.560 -4.659 8.000 1224 HA ASN 75 HA ASN 75 18.055 -3.649 10.650 1225 1HB ASN 75 1HB ASN 75 16.367 -2.838 8.757 1226 2HB ASN 75 2HB ASN 75 15.271 -3.913 9.627 1227 1HD2 ASN 75 1HD2 ASN 75 17.332 -1.102 9.899 1228 2HD2 ASN 75 2HD2 ASN 75 16.554 -0.433 11.305 1229 H GLU 76 H GLU 76 16.785 -6.561 9.318 1230 HA GLU 76 HA GLU 76 15.512 -7.375 11.790 1231 1HB GLU 76 1HB GLU 76 15.392 -8.159 9.050 1232 2HB GLU 76 2HB GLU 76 15.835 -9.567 10.010 1233 1HG GLU 76 1HG GLU 76 13.678 -8.034 11.209 1234 2HG GLU 76 2HG GLU 76 13.288 -8.615 9.591 Start of MODEL 9 1 1H MET 1 1H MET 1 -28.779 54.081 -56.250 2 2H MET 1 2H MET 1 -28.909 54.616 -57.854 3 3H MET 1 3H MET 1 -29.174 52.984 -57.483 4 HA MET 1 HA MET 1 -31.173 54.516 -57.888 5 1HB MET 1 1HB MET 1 -31.077 52.135 -57.004 6 2HB MET 1 2HB MET 1 -31.136 52.826 -55.390 7 1HG MET 1 1HG MET 1 -33.341 52.209 -55.918 8 2HG MET 1 2HG MET 1 -33.276 53.963 -56.074 9 1HE MET 1 1HE MET 1 -35.551 54.040 -58.804 10 2HE MET 1 2HE MET 1 -34.171 55.133 -58.705 11 3HE MET 1 3HE MET 1 -34.954 54.569 -57.230 12 H SER 2 H SER 2 -30.940 54.162 -54.380 13 HA SER 2 HA SER 2 -31.237 57.088 -54.164 14 1HB SER 2 1HB SER 2 -32.389 55.509 -51.973 15 2HB SER 2 2HB SER 2 -33.084 56.856 -52.877 16 HG SER 2 HG SER 2 -33.895 55.487 -54.353 17 H LEU 3 H LEU 3 -28.937 57.195 -53.881 18 HA LEU 3 HA LEU 3 -27.027 57.363 -52.666 19 1HB LEU 3 1HB LEU 3 -29.208 57.829 -50.810 20 2HB LEU 3 2HB LEU 3 -27.811 57.152 -49.998 21 HG LEU 3 HG LEU 3 -27.878 59.636 -49.978 22 1HD1 LEU 3 1HD1 LEU 3 -25.634 59.760 -49.990 23 2HD1 LEU 3 2HD1 LEU 3 -25.496 59.065 -51.606 24 3HD1 LEU 3 3HD1 LEU 3 -25.744 58.015 -50.210 25 1HD2 LEU 3 1HD2 LEU 3 -28.878 59.847 -52.259 26 2HD2 LEU 3 2HD2 LEU 3 -27.296 59.436 -52.924 27 3HD2 LEU 3 3HD2 LEU 3 -27.494 60.901 -51.960 28 H GLU 4 H GLU 4 -27.207 54.962 -53.633 29 HA GLU 4 HA GLU 4 -26.232 52.924 -53.495 30 1HB GLU 4 1HB GLU 4 -25.373 54.147 -50.964 31 2HB GLU 4 2HB GLU 4 -25.384 52.390 -50.967 32 1HG GLU 4 1HG GLU 4 -23.882 54.204 -52.836 33 2HG GLU 4 2HG GLU 4 -23.210 53.143 -51.596 34 H LYS 5 H LYS 5 -29.009 53.763 -52.128 35 HA LYS 5 HA LYS 5 -29.555 51.084 -51.046 36 1HB LYS 5 1HB LYS 5 -30.079 53.103 -49.619 37 2HB LYS 5 2HB LYS 5 -31.303 53.535 -50.805 38 1HG LYS 5 1HG LYS 5 -32.760 52.190 -49.830 39 2HG LYS 5 2HG LYS 5 -31.675 50.813 -50.055 40 1HD LYS 5 1HD LYS 5 -30.492 51.441 -47.984 41 2HD LYS 5 2HD LYS 5 -31.644 52.760 -47.749 42 1HE LYS 5 1HE LYS 5 -33.472 51.100 -47.688 43 2HE LYS 5 2HE LYS 5 -32.276 49.811 -47.833 44 1HZ LYS 5 1HZ LYS 5 -31.770 51.684 -45.688 45 2HZ LYS 5 2HZ LYS 5 -31.713 49.990 -45.691 46 3HZ LYS 5 3HZ LYS 5 -33.197 50.784 -45.508 47 H ALA 6 H ALA 6 -30.691 49.708 -52.245 48 HA ALA 6 HA ALA 6 -32.530 50.775 -54.274 49 1HB ALA 6 1HB ALA 6 -30.524 48.598 -54.844 50 2HB ALA 6 2HB ALA 6 -30.388 50.268 -55.393 51 3HB ALA 6 3HB ALA 6 -31.714 49.255 -55.965 52 H HIS 7 H HIS 7 -31.328 47.541 -53.370 53 HA HIS 7 HA HIS 7 -33.977 46.874 -52.324 54 1HB HIS 7 1HB HIS 7 -33.201 46.097 -54.889 55 2HB HIS 7 2HB HIS 7 -32.893 44.677 -53.896 56 HD1 HIS 7 HD1 HIS 7 -34.995 44.148 -55.824 57 HD2 HIS 7 HD2 HIS 7 -35.841 46.098 -52.246 58 HE1 HIS 7 HE1 HIS 7 -37.466 43.838 -55.447 59 HE2 HIS 7 HE2 HIS 7 -37.983 45.170 -53.364 60 H THR 8 H THR 8 -32.841 46.977 -50.325 61 HA THR 8 HA THR 8 -30.654 45.141 -49.851 62 HB THR 8 HB THR 8 -31.789 46.329 -47.464 63 HG1 THR 8 HG1 THR 8 -32.506 47.973 -48.841 64 1HG2 THR 8 1HG2 THR 8 -29.516 47.204 -47.221 65 2HG2 THR 8 2HG2 THR 8 -29.143 46.706 -48.873 66 3HG2 THR 8 3HG2 THR 8 -29.499 45.491 -47.643 67 H SER 9 H SER 9 -31.984 43.252 -50.419 68 HA SER 9 HA SER 9 -33.791 42.426 -48.251 69 1HB SER 9 1HB SER 9 -33.723 40.851 -50.753 70 2HB SER 9 2HB SER 9 -35.103 41.405 -49.800 71 HG SER 9 HG SER 9 -34.563 43.568 -50.672 72 H VAL 10 H VAL 10 -30.677 42.056 -49.215 73 HA VAL 10 HA VAL 10 -30.473 39.218 -48.534 74 HB VAL 10 HB VAL 10 -28.358 41.175 -49.459 75 1HG1 VAL 10 1HG1 VAL 10 -26.861 39.259 -49.637 76 2HG1 VAL 10 2HG1 VAL 10 -28.113 38.206 -48.974 77 3HG1 VAL 10 3HG1 VAL 10 -27.405 39.473 -47.974 78 1HG2 VAL 10 1HG2 VAL 10 -29.312 38.768 -50.957 79 2HG2 VAL 10 2HG2 VAL 10 -28.503 40.213 -51.566 80 3HG2 VAL 10 3HG2 VAL 10 -30.189 40.294 -51.052 81 H LYS 11 H LYS 11 -29.808 38.505 -46.614 82 HA LYS 11 HA LYS 11 -28.231 40.177 -44.854 83 1HB LYS 11 1HB LYS 11 -30.891 40.413 -44.517 84 2HB LYS 11 2HB LYS 11 -30.608 38.979 -43.540 85 1HG LYS 11 1HG LYS 11 -28.648 40.527 -42.597 86 2HG LYS 11 2HG LYS 11 -29.794 41.777 -43.085 87 1HD LYS 11 1HD LYS 11 -31.548 40.607 -41.771 88 2HD LYS 11 2HD LYS 11 -30.319 39.470 -41.211 89 1HE LYS 11 1HE LYS 11 -29.125 41.817 -40.614 90 2HE LYS 11 2HE LYS 11 -30.819 42.267 -40.432 91 1HZ LYS 11 1HZ LYS 11 -29.544 39.943 -39.094 92 2HZ LYS 11 2HZ LYS 11 -31.128 40.500 -38.860 93 3HZ LYS 11 3HZ LYS 11 -29.814 41.445 -38.362 94 H LYS 12 H LYS 12 -26.982 38.964 -43.463 95 HA LYS 12 HA LYS 12 -26.691 36.206 -44.124 96 1HB LYS 12 1HB LYS 12 -25.198 38.197 -42.665 97 2HB LYS 12 2HB LYS 12 -25.261 36.695 -41.753 98 1HG LYS 12 1HG LYS 12 -24.334 36.968 -44.604 99 2HG LYS 12 2HG LYS 12 -23.289 36.813 -43.191 100 1HD LYS 12 1HD LYS 12 -23.879 34.599 -42.841 101 2HD LYS 12 2HD LYS 12 -25.390 34.756 -43.739 102 1HE LYS 12 1HE LYS 12 -23.016 35.285 -45.353 103 2HE LYS 12 2HE LYS 12 -23.058 33.652 -44.689 104 1HZ LYS 12 1HZ LYS 12 -24.228 33.340 -46.597 105 2HZ LYS 12 2HZ LYS 12 -24.847 34.918 -46.633 106 3HZ LYS 12 3HZ LYS 12 -25.515 33.772 -45.579 107 H MET 13 H MET 13 -28.026 34.698 -43.462 108 HA MET 13 HA MET 13 -29.643 35.069 -41.104 109 1HB MET 13 1HB MET 13 -30.224 33.932 -43.422 110 2HB MET 13 2HB MET 13 -29.602 32.494 -42.620 111 1HG MET 13 1HG MET 13 -31.499 34.025 -41.013 112 2HG MET 13 2HG MET 13 -32.176 33.390 -42.512 113 1HE MET 13 1HE MET 13 -32.847 31.635 -39.013 114 2HE MET 13 2HE MET 13 -32.038 33.184 -39.262 115 3HE MET 13 3HE MET 13 -31.125 31.793 -38.677 116 H THR 14 H THR 14 -28.275 34.964 -39.358 117 HA THR 14 HA THR 14 -26.453 32.792 -38.961 118 HB THR 14 HB THR 14 -26.770 33.966 -36.511 119 HG1 THR 14 HG1 THR 14 -26.672 36.313 -37.786 120 1HG2 THR 14 1HG2 THR 14 -24.639 33.600 -37.634 121 2HG2 THR 14 2HG2 THR 14 -24.758 35.269 -37.079 122 3HG2 THR 14 3HG2 THR 14 -25.008 34.887 -38.783 123 H PHE 15 H PHE 15 -27.097 30.826 -38.404 124 HA PHE 15 HA PHE 15 -29.708 30.325 -37.311 125 1HB PHE 15 1HB PHE 15 -28.945 27.939 -37.257 126 2HB PHE 15 2HB PHE 15 -28.853 28.692 -38.843 127 HD1 PHE 15 HD1 PHE 15 -26.674 29.274 -39.813 128 HD2 PHE 15 HD2 PHE 15 -26.984 27.206 -36.109 129 HE1 PHE 15 HE1 PHE 15 -24.314 28.612 -39.991 130 HE2 PHE 15 HE2 PHE 15 -24.625 26.540 -36.277 131 HZ PHE 15 HZ PHE 15 -23.283 27.240 -38.215 132 H GLY 16 H GLY 16 -26.483 30.669 -36.114 133 1HA GLY 16 1HA GLY 16 -25.671 30.881 -33.986 134 2HA GLY 16 2HA GLY 16 -27.333 31.184 -33.504 135 H GLU 17 H GLU 17 -25.088 28.576 -34.284 136 HA GLU 17 HA GLU 17 -26.512 26.770 -32.466 137 1HB GLU 17 1HB GLU 17 -24.881 26.382 -34.783 138 2HB GLU 17 2HB GLU 17 -24.075 25.627 -33.414 139 1HG GLU 17 1HG GLU 17 -26.925 25.048 -33.527 140 2HG GLU 17 2HG GLU 17 -26.045 24.505 -34.952 141 H ASN 18 H ASN 18 -23.601 28.623 -32.893 142 HA ASN 18 HA ASN 18 -21.857 29.163 -31.552 143 1HB ASN 18 1HB ASN 18 -23.773 30.282 -30.400 144 2HB ASN 18 2HB ASN 18 -23.882 28.890 -29.328 145 1HD2 ASN 18 1HD2 ASN 18 -23.341 29.866 -27.456 146 2HD2 ASN 18 2HD2 ASN 18 -21.784 30.553 -27.137 147 H ARG 19 H ARG 19 -21.240 26.854 -32.204 148 HA ARG 19 HA ARG 19 -21.161 24.965 -30.005 149 1HB ARG 19 1HB ARG 19 -21.227 24.682 -32.721 150 2HB ARG 19 2HB ARG 19 -19.519 24.426 -32.392 151 1HG ARG 19 1HG ARG 19 -20.818 22.913 -30.469 152 2HG ARG 19 2HG ARG 19 -21.773 22.684 -31.934 153 1HD ARG 19 1HD ARG 19 -20.216 21.366 -32.817 154 2HD ARG 19 2HD ARG 19 -18.967 22.581 -32.544 155 HE ARG 19 HE ARG 19 -19.800 20.889 -30.296 156 1HH1 ARG 19 1HH1 ARG 19 -17.381 21.816 -32.655 157 2HH1 ARG 19 2HH1 ARG 19 -16.105 20.905 -31.898 158 1HH2 ARG 19 1HH2 ARG 19 -18.112 19.704 -29.284 159 2HH2 ARG 19 2HH2 ARG 19 -16.523 19.688 -30.002 160 H ASP 20 H ASP 20 -19.926 27.162 -29.133 161 HA ASP 20 HA ASP 20 -17.049 26.894 -29.516 162 1HB ASP 20 1HB ASP 20 -17.948 29.162 -29.429 163 2HB ASP 20 2HB ASP 20 -18.684 28.837 -27.864 164 H LEU 21 H LEU 21 -15.675 26.038 -28.025 165 HA LEU 21 HA LEU 21 -16.903 24.959 -25.570 166 1HB LEU 21 1HB LEU 21 -15.386 23.660 -27.713 167 2HB LEU 21 2HB LEU 21 -14.787 23.291 -26.108 168 HG LEU 21 HG LEU 21 -17.236 22.688 -25.552 169 1HD1 LEU 21 1HD1 LEU 21 -18.000 23.727 -27.771 170 2HD1 LEU 21 2HD1 LEU 21 -18.700 22.182 -27.290 171 3HD1 LEU 21 3HD1 LEU 21 -17.425 22.229 -28.506 172 1HD2 LEU 21 1HD2 LEU 21 -16.358 20.672 -27.460 173 2HD2 LEU 21 2HD2 LEU 21 -16.558 20.567 -25.711 174 3HD2 LEU 21 3HD2 LEU 21 -15.068 21.220 -26.392 175 H GLU 22 H GLU 22 -15.573 24.779 -23.727 176 HA GLU 22 HA GLU 22 -13.494 26.808 -23.595 177 1HB GLU 22 1HB GLU 22 -15.448 25.930 -21.830 178 2HB GLU 22 2HB GLU 22 -13.966 25.254 -21.170 179 1HG GLU 22 1HG GLU 22 -13.439 27.941 -21.874 180 2HG GLU 22 2HG GLU 22 -14.958 27.903 -20.979 181 H ARG 23 H ARG 23 -12.069 25.507 -25.011 182 HA ARG 23 HA ARG 23 -10.974 23.080 -23.871 183 1HB ARG 23 1HB ARG 23 -11.433 23.794 -26.425 184 2HB ARG 23 2HB ARG 23 -9.748 24.280 -26.287 185 1HG ARG 23 1HG ARG 23 -9.842 22.052 -27.147 186 2HG ARG 23 2HG ARG 23 -9.205 21.992 -25.502 187 1HD ARG 23 1HD ARG 23 -11.270 21.201 -24.639 188 2HD ARG 23 2HD ARG 23 -12.111 21.552 -26.148 189 HE ARG 23 HE ARG 23 -11.032 19.680 -27.146 190 1HH1 ARG 23 1HH1 ARG 23 -10.486 19.993 -23.698 191 2HH1 ARG 23 2HH1 ARG 23 -10.012 18.334 -23.490 192 1HH2 ARG 23 1HH2 ARG 23 -10.421 17.486 -26.877 193 2HH2 ARG 23 2HH2 ARG 23 -10.032 16.895 -25.286 194 H VAL 24 H VAL 24 -10.249 24.459 -21.993 195 HA VAL 24 HA VAL 24 -7.647 25.699 -22.530 196 HB VAL 24 HB VAL 24 -9.048 27.143 -21.264 197 1HG1 VAL 24 1HG1 VAL 24 -9.551 25.939 -18.819 198 2HG1 VAL 24 2HG1 VAL 24 -9.930 24.697 -20.011 199 3HG1 VAL 24 3HG1 VAL 24 -10.718 26.274 -20.097 200 1HG2 VAL 24 1HG2 VAL 24 -7.370 26.026 -19.071 201 2HG2 VAL 24 2HG2 VAL 24 -7.622 27.700 -19.559 202 3HG2 VAL 24 3HG2 VAL 24 -6.585 26.650 -20.523 203 H VAL 25 H VAL 25 -5.845 24.602 -22.098 204 HA VAL 25 HA VAL 25 -6.108 22.158 -20.485 205 HB VAL 25 HB VAL 25 -3.810 21.768 -21.914 206 1HG1 VAL 25 1HG1 VAL 25 -5.368 20.036 -21.673 207 2HG1 VAL 25 2HG1 VAL 25 -5.297 20.346 -23.408 208 3HG1 VAL 25 3HG1 VAL 25 -6.649 20.961 -22.457 209 1HG2 VAL 25 1HG2 VAL 25 -5.713 23.336 -23.642 210 2HG2 VAL 25 2HG2 VAL 25 -4.477 22.263 -24.297 211 3HG2 VAL 25 3HG2 VAL 25 -4.008 23.661 -23.328 212 H THR 26 H THR 26 -5.720 23.775 -18.724 213 HA THR 26 HA THR 26 -2.931 24.496 -18.321 214 HB THR 26 HB THR 26 -5.150 24.704 -16.288 215 HG1 THR 26 HG1 THR 26 -4.383 26.646 -18.242 216 1HG2 THR 26 1HG2 THR 26 -3.699 25.879 -15.039 217 2HG2 THR 26 2HG2 THR 26 -3.086 26.771 -16.431 218 3HG2 THR 26 3HG2 THR 26 -2.455 25.166 -16.066 219 H ALA 27 H ALA 27 -1.533 23.056 -17.552 220 HA ALA 27 HA ALA 27 -2.405 20.513 -16.586 221 1HB ALA 27 1HB ALA 27 0.240 20.508 -16.053 222 2HB ALA 27 2HB ALA 27 0.165 21.788 -17.263 223 3HB ALA 27 3HB ALA 27 -0.442 20.177 -17.645 224 HA PRO 28 HA PRO 28 -2.635 21.799 -12.320 225 1HB PRO 28 1HB PRO 28 -3.365 19.068 -11.698 226 2HB PRO 28 2HB PRO 28 -4.386 20.506 -11.694 227 1HG PRO 28 1HG PRO 28 -4.659 18.473 -13.495 228 2HG PRO 28 2HG PRO 28 -5.112 20.152 -13.840 229 1HD PRO 28 1HD PRO 28 -2.638 18.658 -14.621 230 2HD PRO 28 2HD PRO 28 -3.618 19.794 -15.575 231 H VAL 29 H VAL 29 -0.191 21.845 -12.568 232 HA VAL 29 HA VAL 29 1.260 19.508 -11.734 233 HB VAL 29 HB VAL 29 3.174 21.293 -11.574 234 1HG1 VAL 29 1HG1 VAL 29 1.875 20.438 -14.155 235 2HG1 VAL 29 2HG1 VAL 29 3.123 19.580 -13.251 236 3HG1 VAL 29 3HG1 VAL 29 3.496 21.119 -14.028 237 1HG2 VAL 29 1HG2 VAL 29 1.623 23.230 -11.664 238 2HG2 VAL 29 2HG2 VAL 29 1.192 22.767 -13.310 239 3HG2 VAL 29 3HG2 VAL 29 2.846 23.255 -12.937 240 H SER 30 H SER 30 -0.371 19.673 -9.748 241 HA SER 30 HA SER 30 0.279 21.447 -7.652 242 1HB SER 30 1HB SER 30 -0.880 18.848 -6.892 243 2HB SER 30 2HB SER 30 -1.488 20.480 -6.605 244 HG SER 30 HG SER 30 -2.196 20.521 -8.791 245 H SER 31 H SER 31 1.696 21.319 -6.020 246 HA SER 31 HA SER 31 3.807 19.366 -6.175 247 1HB SER 31 1HB SER 31 3.823 21.029 -3.792 248 2HB SER 31 2HB SER 31 4.988 20.960 -5.115 249 HG SER 31 HG SER 31 3.709 22.399 -6.281 250 H GLY 32 H GLY 32 1.046 20.054 -4.137 251 1HA GLY 32 1HA GLY 32 1.706 17.970 -2.225 252 2HA GLY 32 2HA GLY 32 0.260 18.971 -2.232 253 H LYS 33 H LYS 33 1.800 16.560 -4.341 254 HA LYS 33 HA LYS 33 -0.804 15.208 -4.544 255 1HB LYS 33 1HB LYS 33 1.202 15.836 -6.688 256 2HB LYS 33 2HB LYS 33 0.138 14.445 -6.848 257 1HG LYS 33 1HG LYS 33 -1.482 16.635 -6.117 258 2HG LYS 33 2HG LYS 33 -0.399 17.191 -7.396 259 1HD LYS 33 1HD LYS 33 -1.212 15.649 -8.928 260 2HD LYS 33 2HD LYS 33 -1.837 14.581 -7.671 261 1HE LYS 33 1HE LYS 33 -3.812 15.492 -8.306 262 2HE LYS 33 2HE LYS 33 -3.326 16.752 -7.173 263 1HZ LYS 33 1HZ LYS 33 -2.618 18.132 -8.918 264 2HZ LYS 33 2HZ LYS 33 -4.104 17.502 -9.438 265 3HZ LYS 33 3HZ LYS 33 -2.660 16.874 -10.059 266 H ILE 34 H ILE 34 -0.773 12.984 -4.482 267 HA ILE 34 HA ILE 34 1.763 11.814 -3.548 268 HB ILE 34 HB ILE 34 -1.088 10.870 -3.146 269 1HG1 ILE 34 1HG1 ILE 34 -0.417 12.907 -1.866 270 2HG1 ILE 34 2HG1 ILE 34 -0.797 11.528 -0.838 271 1HG2 ILE 34 1HG2 ILE 34 0.374 9.494 -1.342 272 2HG2 ILE 34 2HG2 ILE 34 1.510 9.576 -2.690 273 3HG2 ILE 34 3HG2 ILE 34 -0.089 8.869 -2.926 274 1HD1 ILE 34 1HD1 ILE 34 1.102 12.254 0.172 275 2HD1 ILE 34 2HD1 ILE 34 1.790 12.884 -1.324 276 3HD1 ILE 34 3HD1 ILE 34 1.812 11.150 -1.005 277 H LYS 35 H LYS 35 2.603 10.038 -4.494 278 HA LYS 35 HA LYS 35 1.439 9.287 -7.094 279 1HB LYS 35 1HB LYS 35 4.294 8.741 -6.445 280 2HB LYS 35 2HB LYS 35 3.559 9.199 -7.977 281 1HG LYS 35 1HG LYS 35 3.251 11.352 -6.148 282 2HG LYS 35 2HG LYS 35 4.935 10.829 -6.126 283 1HD LYS 35 1HD LYS 35 4.959 12.351 -7.846 284 2HD LYS 35 2HD LYS 35 4.665 10.852 -8.725 285 1HE LYS 35 1HE LYS 35 2.410 11.352 -9.057 286 2HE LYS 35 2HE LYS 35 2.391 12.550 -7.763 287 1HZ LYS 35 1HZ LYS 35 4.119 13.731 -9.289 288 2HZ LYS 35 2HZ LYS 35 2.459 13.887 -9.605 289 3HZ LYS 35 3HZ LYS 35 3.397 12.798 -10.511 290 H ARG 36 H ARG 36 1.687 7.064 -7.774 291 HA ARG 36 HA ARG 36 1.794 5.225 -5.468 292 1HB ARG 36 1HB ARG 36 0.383 3.806 -7.299 293 2HB ARG 36 2HB ARG 36 -0.345 4.799 -6.045 294 1HG ARG 36 1HG ARG 36 -1.441 5.812 -7.682 295 2HG ARG 36 2HG ARG 36 0.090 6.587 -8.088 296 1HD ARG 36 1HD ARG 36 -0.254 5.674 -10.110 297 2HD ARG 36 2HD ARG 36 0.373 4.211 -9.353 298 HE ARG 36 HE ARG 36 -1.698 3.270 -9.540 299 1HH1 ARG 36 1HH1 ARG 36 -1.987 6.733 -9.961 300 2HH1 ARG 36 2HH1 ARG 36 -3.704 6.693 -10.251 301 1HH2 ARG 36 1HH2 ARG 36 -3.940 3.192 -10.021 302 2HH2 ARG 36 2HH2 ARG 36 -4.809 4.674 -10.309 303 H VAL 37 H VAL 37 3.136 3.553 -5.526 304 HA VAL 37 HA VAL 37 4.438 2.904 -8.089 305 HB VAL 37 HB VAL 37 5.726 3.120 -5.366 306 1HG1 VAL 37 1HG1 VAL 37 7.260 2.208 -7.750 307 2HG1 VAL 37 2HG1 VAL 37 6.309 1.032 -6.843 308 3HG1 VAL 37 3HG1 VAL 37 7.580 1.948 -6.034 309 1HG2 VAL 37 1HG2 VAL 37 7.291 4.326 -7.345 310 2HG2 VAL 37 2HG2 VAL 37 6.311 5.129 -6.118 311 3HG2 VAL 37 3HG2 VAL 37 5.628 4.791 -7.708 312 H ASN 38 H ASN 38 4.372 0.837 -8.642 313 HA ASN 38 HA ASN 38 3.218 -1.066 -6.731 314 1HB ASN 38 1HB ASN 38 2.297 -0.517 -9.158 315 2HB ASN 38 2HB ASN 38 3.520 -1.690 -9.639 316 1HD2 ASN 38 1HD2 ASN 38 2.646 -3.593 -9.956 317 2HD2 ASN 38 2HD2 ASN 38 1.395 -4.320 -8.993 318 H VAL 39 H VAL 39 4.687 -2.216 -5.700 319 HA VAL 39 HA VAL 39 7.215 -2.828 -7.047 320 HB VAL 39 HB VAL 39 6.700 -3.225 -4.114 321 1HG1 VAL 39 1HG1 VAL 39 8.854 -3.765 -4.063 322 2HG1 VAL 39 2HG1 VAL 39 9.295 -2.242 -4.840 323 3HG1 VAL 39 3HG1 VAL 39 8.886 -3.648 -5.824 324 1HG2 VAL 39 1HG2 VAL 39 6.068 -0.884 -4.881 325 2HG2 VAL 39 2HG2 VAL 39 7.774 -0.663 -5.264 326 3HG2 VAL 39 3HG2 VAL 39 7.279 -0.999 -3.606 327 H ASN 40 H ASN 40 8.065 -4.875 -7.096 328 HA ASN 40 HA ASN 40 6.202 -7.070 -6.522 329 1HB ASN 40 1HB ASN 40 7.974 -6.527 -8.754 330 2HB ASN 40 2HB ASN 40 8.364 -8.078 -8.011 331 1HD2 ASN 40 1HD2 ASN 40 6.600 -6.671 -10.353 332 2HD2 ASN 40 2HD2 ASN 40 5.293 -7.812 -10.484 333 H PHE 41 H PHE 41 6.612 -7.866 -4.580 334 HA PHE 41 HA PHE 41 9.375 -7.863 -3.586 335 1HB PHE 41 1HB PHE 41 6.676 -7.891 -2.273 336 2HB PHE 41 2HB PHE 41 8.071 -8.505 -1.393 337 HD1 PHE 41 HD1 PHE 41 10.059 -6.520 -2.641 338 HD2 PHE 41 HD2 PHE 41 6.239 -6.043 -0.826 339 HE1 PHE 41 HE1 PHE 41 10.662 -4.225 -1.994 340 HE2 PHE 41 HE2 PHE 41 6.834 -3.742 -0.176 341 HZ PHE 41 HZ PHE 41 9.018 -2.840 -0.719 342 H ASP 42 H ASP 42 10.461 -9.687 -3.273 343 HA ASP 42 HA ASP 42 9.505 -12.161 -4.250 344 1HB ASP 42 1HB ASP 42 11.754 -12.259 -4.378 345 2HB ASP 42 2HB ASP 42 11.962 -11.092 -3.078 346 H GLU 43 H GLU 43 8.919 -14.037 -3.159 347 HA GLU 43 HA GLU 43 7.154 -13.719 -1.076 348 1HB GLU 43 1HB GLU 43 8.282 -15.953 -2.546 349 2HB GLU 43 2HB GLU 43 7.910 -16.380 -0.880 350 1HG GLU 43 1HG GLU 43 5.928 -14.997 -2.651 351 2HG GLU 43 2HG GLU 43 6.098 -16.751 -2.613 352 H GLU 44 H GLU 44 10.544 -14.680 -0.885 353 HA GLU 44 HA GLU 44 10.606 -15.339 1.865 354 1HB GLU 44 1HB GLU 44 12.420 -15.362 -0.199 355 2HB GLU 44 2HB GLU 44 13.007 -14.031 0.792 356 1HG GLU 44 1HG GLU 44 13.803 -16.522 1.156 357 2HG GLU 44 2HG GLU 44 13.625 -15.390 2.494 358 H LYS 45 H LYS 45 11.532 -12.388 0.144 359 HA LYS 45 HA LYS 45 12.017 -10.761 2.348 360 1HB LYS 45 1HB LYS 45 11.109 -10.169 -0.461 361 2HB LYS 45 2HB LYS 45 11.354 -8.885 0.717 362 1HG LYS 45 1HG LYS 45 13.698 -9.772 1.012 363 2HG LYS 45 2HG LYS 45 13.395 -10.769 -0.414 364 1HD LYS 45 1HD LYS 45 13.367 -8.977 -1.834 365 2HD LYS 45 2HD LYS 45 12.775 -7.868 -0.592 366 1HE LYS 45 1HE LYS 45 14.853 -7.338 0.108 367 2HE LYS 45 2HE LYS 45 15.459 -8.976 -0.121 368 1HZ LYS 45 1HZ LYS 45 16.469 -7.329 -1.636 369 2HZ LYS 45 2HZ LYS 45 14.946 -7.072 -2.344 370 3HZ LYS 45 3HZ LYS 45 15.685 -8.592 -2.455 371 H HIS 46 H HIS 46 9.012 -11.367 0.588 372 HA HIS 46 HA HIS 46 7.523 -9.395 1.978 373 1HB HIS 46 1HB HIS 46 6.988 -10.486 -0.279 374 2HB HIS 46 2HB HIS 46 6.292 -11.801 0.662 375 HD1 HIS 46 HD1 HIS 46 3.897 -11.560 1.188 376 HD2 HIS 46 HD2 HIS 46 5.694 -7.879 0.432 377 HE1 HIS 46 HE1 HIS 46 2.037 -9.861 1.278 378 HE2 HIS 46 HE2 HIS 46 3.137 -7.639 0.839 379 H THR 47 H THR 47 8.105 -12.807 2.614 380 HA THR 47 HA THR 47 6.120 -13.027 4.660 381 HB THR 47 HB THR 47 8.606 -14.719 4.347 382 HG1 THR 47 HG1 THR 47 7.436 -14.825 2.425 383 1HG2 THR 47 1HG2 THR 47 7.691 -15.241 6.431 384 2HG2 THR 47 2HG2 THR 47 6.941 -16.425 5.359 385 3HG2 THR 47 3HG2 THR 47 6.036 -14.998 5.869 386 H ARG 48 H ARG 48 9.565 -12.237 4.593 387 HA ARG 48 HA ARG 48 9.857 -11.935 7.417 388 1HB ARG 48 1HB ARG 48 11.860 -12.176 6.135 389 2HB ARG 48 2HB ARG 48 11.421 -10.844 5.075 390 1HG ARG 48 1HG ARG 48 12.698 -9.556 6.347 391 2HG ARG 48 2HG ARG 48 11.459 -9.704 7.595 392 1HD ARG 48 1HD ARG 48 13.331 -10.379 8.739 393 2HD ARG 48 2HD ARG 48 12.702 -11.919 8.163 394 HE ARG 48 HE ARG 48 14.879 -10.468 6.799 395 1HH1 ARG 48 1HH1 ARG 48 13.415 -13.417 7.990 396 2HH1 ARG 48 2HH1 ARG 48 14.723 -14.433 7.464 397 1HH2 ARG 48 1HH2 ARG 48 16.619 -11.814 6.122 398 2HH2 ARG 48 2HH2 ARG 48 16.554 -13.525 6.437 399 H PHE 49 H PHE 49 8.979 -9.840 4.745 400 HA PHE 49 HA PHE 49 8.961 -7.360 5.938 401 1HB PHE 49 1HB PHE 49 8.195 -8.339 3.516 402 2HB PHE 49 2HB PHE 49 6.631 -7.934 4.214 403 HD1 PHE 49 HD1 PHE 49 9.931 -6.231 4.489 404 HD2 PHE 49 HD2 PHE 49 5.900 -6.041 3.152 405 HE1 PHE 49 HE1 PHE 49 10.263 -3.882 3.840 406 HE2 PHE 49 HE2 PHE 49 6.222 -3.693 2.495 407 HZ PHE 49 HZ PHE 49 8.405 -2.609 2.841 408 H LYS 50 H LYS 50 6.214 -9.624 5.756 409 HA LYS 50 HA LYS 50 4.455 -8.126 7.346 410 1HB LYS 50 1HB LYS 50 4.575 -11.124 6.972 411 2HB LYS 50 2HB LYS 50 3.209 -10.237 7.630 412 1HG LYS 50 1HG LYS 50 2.558 -9.455 5.594 413 2HG LYS 50 2HG LYS 50 4.203 -9.452 4.950 414 1HD LYS 50 1HD LYS 50 3.094 -11.185 3.810 415 2HD LYS 50 2HD LYS 50 4.082 -11.987 5.031 416 1HE LYS 50 1HE LYS 50 1.625 -11.456 6.268 417 2HE LYS 50 2HE LYS 50 1.228 -12.041 4.653 418 1HZ LYS 50 1HZ LYS 50 1.747 -13.627 6.742 419 2HZ LYS 50 2HZ LYS 50 3.283 -13.546 6.030 420 3HZ LYS 50 3HZ LYS 50 1.954 -14.091 5.124 421 H ALA 51 H ALA 51 6.623 -10.798 8.228 422 HA ALA 51 HA ALA 51 5.895 -10.917 10.929 423 1HB ALA 51 1HB ALA 51 7.112 -12.757 10.680 424 2HB ALA 51 2HB ALA 51 8.555 -11.749 10.788 425 3HB ALA 51 3HB ALA 51 7.863 -12.128 9.213 426 H ALA 52 H ALA 52 8.779 -9.417 9.462 427 HA ALA 52 HA ALA 52 9.859 -8.411 11.819 428 1HB ALA 52 1HB ALA 52 10.342 -8.125 8.984 429 2HB ALA 52 2HB ALA 52 11.477 -8.135 10.336 430 3HB ALA 52 3HB ALA 52 10.676 -6.635 9.867 431 H CYS 53 H CYS 53 7.788 -6.688 9.445 432 HA CYS 53 HA CYS 53 7.848 -4.248 10.824 433 1HB CYS 53 1HB CYS 53 6.009 -3.554 9.432 434 2HB CYS 53 2HB CYS 53 7.139 -4.491 8.465 435 HG CYS 53 HG CYS 53 5.595 -6.596 8.022 436 H ALA 54 H ALA 54 5.730 -7.049 11.165 437 HA ALA 54 HA ALA 54 3.844 -5.807 12.895 438 1HB ALA 54 1HB ALA 54 2.908 -7.901 13.164 439 2HB ALA 54 2HB ALA 54 4.465 -8.726 13.052 440 3HB ALA 54 3HB ALA 54 3.711 -8.063 11.602 441 H ARG 55 H ARG 55 6.958 -7.299 13.354 442 HA ARG 55 HA ARG 55 6.818 -7.550 16.186 443 1HB ARG 55 1HB ARG 55 8.983 -7.671 14.136 444 2HB ARG 55 2HB ARG 55 9.444 -7.450 15.817 445 1HG ARG 55 1HG ARG 55 8.990 -9.572 16.345 446 2HG ARG 55 2HG ARG 55 7.501 -9.589 15.397 447 1HD ARG 55 1HD ARG 55 8.814 -11.111 14.265 448 2HD ARG 55 2HD ARG 55 9.099 -9.630 13.357 449 HE ARG 55 HE ARG 55 11.265 -9.501 14.264 450 1HH1 ARG 55 1HH1 ARG 55 9.510 -12.351 15.304 451 2HH1 ARG 55 2HH1 ARG 55 10.932 -13.173 15.880 452 1HH2 ARG 55 1HH2 ARG 55 13.142 -10.579 15.016 453 2HH2 ARG 55 2HH2 ARG 55 13.003 -12.165 15.718 454 H LYS 56 H LYS 56 8.093 -5.057 14.004 455 HA LYS 56 HA LYS 56 9.025 -3.418 16.170 456 1HB LYS 56 1HB LYS 56 8.607 -2.361 13.400 457 2HB LYS 56 2HB LYS 56 9.866 -1.962 14.559 458 1HG LYS 56 1HG LYS 56 9.680 -4.671 13.290 459 2HG LYS 56 2HG LYS 56 10.520 -3.327 12.514 460 1HD LYS 56 1HD LYS 56 12.308 -3.624 13.800 461 2HD LYS 56 2HD LYS 56 11.328 -3.576 15.267 462 1HE LYS 56 1HE LYS 56 11.785 -5.738 15.533 463 2HE LYS 56 2HE LYS 56 10.777 -6.054 14.122 464 1HZ LYS 56 1HZ LYS 56 12.908 -5.571 12.802 465 2HZ LYS 56 2HZ LYS 56 12.781 -7.064 13.598 466 3HZ LYS 56 3HZ LYS 56 13.714 -5.819 14.271 467 H GLY 57 H GLY 57 6.215 -3.409 14.020 468 1HA GLY 57 1HA GLY 57 4.104 -2.585 14.968 469 2HA GLY 57 2HA GLY 57 5.036 -1.301 15.727 470 H THR 58 H THR 58 5.699 -2.329 12.483 471 HA THR 58 HA THR 58 4.766 0.274 11.494 472 HB THR 58 HB THR 58 6.701 -1.613 10.141 473 HG1 THR 58 HG1 THR 58 7.203 0.562 11.930 474 1HG2 THR 58 1HG2 THR 58 6.796 -0.111 8.505 475 2HG2 THR 58 2HG2 THR 58 7.047 1.210 9.648 476 3HG2 THR 58 3HG2 THR 58 5.410 0.691 9.245 477 H SER 59 H SER 59 3.249 0.388 9.893 478 HA SER 59 HA SER 59 1.750 -1.964 9.226 479 1HB SER 59 1HB SER 59 1.318 0.444 7.588 480 2HB SER 59 2HB SER 59 0.163 -0.498 8.533 481 HG SER 59 HG SER 59 0.653 1.735 9.255 482 H ILE 60 H ILE 60 1.750 -3.144 7.384 483 HA ILE 60 HA ILE 60 4.069 -3.659 6.138 484 HB ILE 60 HB ILE 60 2.159 -5.146 6.026 485 1HG1 ILE 60 1HG1 ILE 60 2.402 -5.256 3.246 486 2HG1 ILE 60 2HG1 ILE 60 3.905 -4.525 3.800 487 1HG2 ILE 60 1HG2 ILE 60 0.978 -3.731 3.703 488 2HG2 ILE 60 2HG2 ILE 60 0.626 -3.120 5.319 489 3HG2 ILE 60 3HG2 ILE 60 0.218 -4.784 4.898 490 1HD1 ILE 60 1HD1 ILE 60 4.096 -6.450 5.415 491 2HD1 ILE 60 2HD1 ILE 60 4.282 -6.843 3.706 492 3HD1 ILE 60 3HD1 ILE 60 2.767 -7.203 4.534 493 H THR 61 H THR 61 1.625 -1.459 4.762 494 HA THR 61 HA THR 61 3.170 -0.952 2.429 495 HB THR 61 HB THR 61 1.205 1.099 3.188 496 HG1 THR 61 HG1 THR 61 -0.442 -0.709 2.549 497 1HG2 THR 61 1HG2 THR 61 2.288 -0.047 0.852 498 2HG2 THR 61 2HG2 THR 61 1.092 1.245 0.964 499 3HG2 THR 61 3HG2 THR 61 0.569 -0.435 0.851 500 H ASP 62 H ASP 62 2.845 0.542 5.566 501 HA ASP 62 HA ASP 62 4.235 2.948 4.987 502 1HB ASP 62 1HB ASP 62 2.724 2.425 6.993 503 2HB ASP 62 2HB ASP 62 4.135 1.637 7.693 504 H VAL 63 H VAL 63 5.263 -0.298 5.811 505 HA VAL 63 HA VAL 63 7.927 0.285 6.565 506 HB VAL 63 HB VAL 63 7.324 -2.179 4.978 507 1HG1 VAL 63 1HG1 VAL 63 9.584 -1.409 6.066 508 2HG1 VAL 63 2HG1 VAL 63 9.090 -3.100 6.104 509 3HG1 VAL 63 3HG1 VAL 63 8.856 -2.082 7.524 510 1HG2 VAL 63 1HG2 VAL 63 6.876 -2.720 7.723 511 2HG2 VAL 63 2HG2 VAL 63 5.769 -2.921 6.367 512 3HG2 VAL 63 3HG2 VAL 63 5.817 -1.393 7.245 513 H VAL 64 H VAL 64 6.429 -0.406 3.429 514 HA VAL 64 HA VAL 64 8.749 -0.291 1.861 515 HB VAL 64 HB VAL 64 6.186 0.816 0.787 516 1HG1 VAL 64 1HG1 VAL 64 8.651 -0.193 -0.246 517 2HG1 VAL 64 2HG1 VAL 64 7.301 0.546 -1.112 518 3HG1 VAL 64 3HG1 VAL 64 7.322 -1.195 -0.830 519 1HG2 VAL 64 1HG2 VAL 64 5.611 -1.153 2.237 520 2HG2 VAL 64 2HG2 VAL 64 6.630 -2.139 1.187 521 3HG2 VAL 64 3HG2 VAL 64 5.199 -1.342 0.531 522 H ASN 65 H ASN 65 6.502 2.223 2.911 523 HA ASN 65 HA ASN 65 7.750 4.378 1.572 524 1HB ASN 65 1HB ASN 65 5.509 4.070 3.174 525 2HB ASN 65 2HB ASN 65 6.564 5.102 4.133 526 1HD2 ASN 65 1HD2 ASN 65 4.107 5.212 2.072 527 2HD2 ASN 65 2HD2 ASN 65 4.403 6.729 1.297 528 H GLN 66 H GLN 66 8.403 2.765 4.611 529 HA GLN 66 HA GLN 66 10.194 4.718 5.656 530 1HB GLN 66 1HB GLN 66 8.979 2.459 6.637 531 2HB GLN 66 2HB GLN 66 10.660 1.955 6.506 532 1HG GLN 66 1HG GLN 66 10.707 2.817 8.596 533 2HG GLN 66 2HG GLN 66 11.059 4.289 7.689 534 1HE2 GLN 66 1HE2 GLN 66 8.955 2.758 9.853 535 2HE2 GLN 66 2HE2 GLN 66 7.746 4.001 9.939 536 H LEU 67 H LEU 67 10.714 1.671 3.847 537 HA LEU 67 HA LEU 67 13.553 1.887 3.934 538 1HB LEU 67 1HB LEU 67 12.850 0.506 1.565 539 2HB LEU 67 2HB LEU 67 13.470 -0.154 3.063 540 HG LEU 67 HG LEU 67 10.597 0.370 3.141 541 1HD1 LEU 67 1HD1 LEU 67 11.785 -1.362 1.010 542 2HD1 LEU 67 2HD1 LEU 67 10.426 -0.243 0.912 543 3HD1 LEU 67 3HD1 LEU 67 10.239 -1.783 1.748 544 1HD2 LEU 67 1HD2 LEU 67 12.161 -2.169 3.564 545 2HD2 LEU 67 2HD2 LEU 67 10.551 -1.780 4.171 546 3HD2 LEU 67 3HD2 LEU 67 11.960 -0.923 4.797 547 H VAL 68 H VAL 68 11.082 2.916 1.650 548 HA VAL 68 HA VAL 68 12.773 3.954 -0.353 549 HB VAL 68 HB VAL 68 9.966 4.675 0.488 550 1HG1 VAL 68 1HG1 VAL 68 10.890 6.703 -0.416 551 2HG1 VAL 68 2HG1 VAL 68 9.804 5.986 -1.607 552 3HG1 VAL 68 3HG1 VAL 68 11.552 5.832 -1.802 553 1HG2 VAL 68 1HG2 VAL 68 9.786 3.787 -2.037 554 2HG2 VAL 68 2HG2 VAL 68 9.693 2.733 -0.627 555 3HG2 VAL 68 3HG2 VAL 68 11.212 2.896 -1.507 556 H ASP 69 H ASP 69 11.390 5.358 2.568 557 HA ASP 69 HA ASP 69 12.363 7.974 2.311 558 1HB ASP 69 1HB ASP 69 11.073 6.392 4.316 559 2HB ASP 69 2HB ASP 69 12.443 7.212 5.056 560 H ASN 70 H ASN 70 13.728 5.185 4.021 561 HA ASN 70 HA ASN 70 16.039 6.449 4.948 562 1HB ASN 70 1HB ASN 70 15.192 3.621 4.554 563 2HB ASN 70 2HB ASN 70 16.902 3.929 4.835 564 1HD2 ASN 70 1HD2 ASN 70 13.701 4.074 6.182 565 2HD2 ASN 70 2HD2 ASN 70 14.186 4.308 7.832 566 H TRP 71 H TRP 71 15.686 4.300 2.136 567 HA TRP 71 HA TRP 71 18.309 4.488 1.177 568 1HB TRP 71 1HB TRP 71 16.321 2.947 0.507 569 2HB TRP 71 2HB TRP 71 15.933 4.219 -0.638 570 HD1 TRP 71 HD1 TRP 71 18.739 1.653 0.110 571 HE1 TRP 71 HE1 TRP 71 20.013 1.229 -2.086 572 HE3 TRP 71 HE3 TRP 71 16.411 5.105 -2.854 573 HZ2 TRP 71 HZ2 TRP 71 20.008 2.215 -4.735 574 HZ3 TRP 71 HZ3 TRP 71 17.087 5.288 -5.208 575 HH2 TRP 71 HH2 TRP 71 18.848 3.866 -6.131 576 H LEU 72 H LEU 72 15.474 6.503 0.501 577 HA LEU 72 HA LEU 72 16.757 8.031 -1.522 578 1HB LEU 72 1HB LEU 72 14.161 7.924 -0.249 579 2HB LEU 72 2HB LEU 72 14.677 9.583 -0.494 580 HG LEU 72 HG LEU 72 14.807 9.301 -2.848 581 1HD1 LEU 72 1HD1 LEU 72 13.941 6.668 -3.338 582 2HD1 LEU 72 2HD1 LEU 72 15.275 6.559 -2.187 583 3HD1 LEU 72 3HD1 LEU 72 15.503 7.388 -3.729 584 1HD2 LEU 72 1HD2 LEU 72 12.555 8.699 -3.427 585 2HD2 LEU 72 2HD2 LEU 72 12.542 9.538 -1.876 586 3HD2 LEU 72 3HD2 LEU 72 12.374 7.782 -1.930 587 H LYS 73 H LYS 73 15.935 8.793 1.873 588 HA LYS 73 HA LYS 73 17.043 11.388 1.734 589 1HB LYS 73 1HB LYS 73 16.412 9.672 4.139 590 2HB LYS 73 2HB LYS 73 16.832 11.378 4.217 591 1HG LYS 73 1HG LYS 73 14.842 11.940 2.920 592 2HG LYS 73 2HG LYS 73 14.434 10.226 2.800 593 1HD LYS 73 1HD LYS 73 14.579 11.876 5.325 594 2HD LYS 73 2HD LYS 73 13.120 11.255 4.550 595 1HE LYS 73 1HE LYS 73 13.344 9.257 5.508 596 2HE LYS 73 2HE LYS 73 15.052 9.160 5.081 597 1HZ LYS 73 1HZ LYS 73 14.586 9.139 7.500 598 2HZ LYS 73 2HZ LYS 73 14.011 10.730 7.375 599 3HZ LYS 73 3HZ LYS 73 15.633 10.380 7.018 600 H GLU 74 H GLU 74 18.445 8.292 2.539 601 HA GLU 74 HA GLU 74 20.793 9.543 3.687 602 1HB GLU 74 1HB GLU 74 19.991 6.668 3.290 603 2HB GLU 74 2HB GLU 74 21.577 7.130 3.892 604 1HG GLU 74 1HG GLU 74 18.939 7.788 5.181 605 2HG GLU 74 2HG GLU 74 20.077 6.549 5.706 606 H ASN 75 H ASN 75 20.201 7.325 0.947 607 HA ASN 75 HA ASN 75 22.915 7.775 0.041 608 1HB ASN 75 1HB ASN 75 22.692 5.649 -0.582 609 2HB ASN 75 2HB ASN 75 20.984 5.679 -0.191 610 1HD2 ASN 75 1HD2 ASN 75 19.485 6.055 -1.814 611 2HD2 ASN 75 2HD2 ASN 75 19.894 5.948 -3.490 612 H GLU 76 H GLU 76 19.680 8.669 -0.936 613 HA GLU 76 HA GLU 76 20.751 9.865 -3.390 614 1HB GLU 76 1HB GLU 76 18.485 8.321 -2.926 615 2HB GLU 76 2HB GLU 76 17.853 9.954 -3.064 616 1HG GLU 76 1HG GLU 76 17.924 8.627 -5.190 617 2HG GLU 76 2HG GLU 76 18.697 10.209 -5.247 618 1H MET 1 1H MET 1 -41.339 -69.554 -15.265 619 2H MET 1 2H MET 1 -39.719 -69.419 -15.755 620 3H MET 1 3H MET 1 -40.106 -69.478 -14.102 621 HA MET 1 HA MET 1 -41.239 -71.741 -15.119 622 1HB MET 1 1HB MET 1 -39.148 -70.846 -16.847 623 2HB MET 1 2HB MET 1 -38.584 -72.288 -16.011 624 1HG MET 1 1HG MET 1 -41.128 -72.056 -17.605 625 2HG MET 1 2HG MET 1 -39.638 -72.840 -18.129 626 1HE MET 1 1HE MET 1 -39.509 -74.969 -18.337 627 2HE MET 1 2HE MET 1 -40.224 -76.282 -17.397 628 3HE MET 1 3HE MET 1 -38.812 -75.424 -16.784 629 H SER 2 H SER 2 -39.739 -73.724 -14.418 630 HA SER 2 HA SER 2 -39.338 -73.469 -11.668 631 1HB SER 2 1HB SER 2 -37.824 -75.625 -12.944 632 2HB SER 2 2HB SER 2 -39.134 -75.711 -11.765 633 HG SER 2 HG SER 2 -40.571 -75.870 -13.328 634 H LEU 3 H LEU 3 -37.506 -73.439 -10.390 635 HA LEU 3 HA LEU 3 -35.464 -72.778 -9.689 636 1HB LEU 3 1HB LEU 3 -34.920 -74.140 -12.215 637 2HB LEU 3 2HB LEU 3 -33.716 -72.931 -11.819 638 HG LEU 3 HG LEU 3 -32.837 -74.874 -10.890 639 1HD1 LEU 3 1HD1 LEU 3 -34.317 -74.112 -8.443 640 2HD1 LEU 3 2HD1 LEU 3 -33.366 -72.863 -9.246 641 3HD1 LEU 3 3HD1 LEU 3 -32.590 -74.349 -8.698 642 1HD2 LEU 3 1HD2 LEU 3 -35.632 -75.632 -10.642 643 2HD2 LEU 3 2HD2 LEU 3 -34.668 -76.088 -9.236 644 3HD2 LEU 3 3HD2 LEU 3 -34.197 -76.639 -10.845 645 H GLU 4 H GLU 4 -37.344 -70.952 -10.888 646 HA GLU 4 HA GLU 4 -37.554 -68.791 -11.561 647 1HB GLU 4 1HB GLU 4 -35.309 -68.946 -9.745 648 2HB GLU 4 2HB GLU 4 -35.104 -67.620 -10.880 649 1HG GLU 4 1HG GLU 4 -37.279 -68.057 -8.874 650 2HG GLU 4 2HG GLU 4 -36.200 -66.676 -9.056 651 H LYS 5 H LYS 5 -36.956 -70.270 -13.701 652 HA LYS 5 HA LYS 5 -34.819 -68.848 -15.125 653 1HB LYS 5 1HB LYS 5 -35.903 -71.558 -15.242 654 2HB LYS 5 2HB LYS 5 -35.751 -70.812 -16.827 655 1HG LYS 5 1HG LYS 5 -33.626 -71.430 -16.801 656 2HG LYS 5 2HG LYS 5 -33.365 -70.208 -15.554 657 1HD LYS 5 1HD LYS 5 -32.642 -71.943 -14.321 658 2HD LYS 5 2HD LYS 5 -34.361 -72.266 -14.086 659 1HE LYS 5 1HE LYS 5 -33.661 -74.318 -14.797 660 2HE LYS 5 2HE LYS 5 -34.079 -73.583 -16.343 661 1HZ LYS 5 1HZ LYS 5 -31.716 -74.732 -15.774 662 2HZ LYS 5 2HZ LYS 5 -31.364 -73.097 -15.500 663 3HZ LYS 5 3HZ LYS 5 -31.959 -73.596 -17.007 664 H ALA 6 H ALA 6 -35.244 -67.534 -16.807 665 HA ALA 6 HA ALA 6 -37.754 -67.580 -18.214 666 1HB ALA 6 1HB ALA 6 -37.762 -64.927 -17.398 667 2HB ALA 6 2HB ALA 6 -37.439 -65.838 -15.921 668 3HB ALA 6 3HB ALA 6 -38.874 -66.193 -16.882 669 H HIS 7 H HIS 7 -36.441 -64.446 -17.920 670 HA HIS 7 HA HIS 7 -34.400 -64.850 -19.927 671 1HB HIS 7 1HB HIS 7 -35.278 -63.238 -21.532 672 2HB HIS 7 2HB HIS 7 -36.408 -64.567 -21.322 673 HD1 HIS 7 HD1 HIS 7 -36.180 -60.938 -21.289 674 HD2 HIS 7 HD2 HIS 7 -38.720 -63.814 -19.678 675 HE1 HIS 7 HE1 HIS 7 -38.286 -59.710 -20.659 676 HE2 HIS 7 HE2 HIS 7 -39.871 -61.501 -19.858 677 H THR 8 H THR 8 -32.723 -63.850 -19.100 678 HA THR 8 HA THR 8 -32.870 -61.964 -17.040 679 HB THR 8 HB THR 8 -30.383 -61.557 -18.209 680 HG1 THR 8 HG1 THR 8 -30.255 -64.219 -18.341 681 1HG2 THR 8 1HG2 THR 8 -30.559 -61.936 -15.887 682 2HG2 THR 8 2HG2 THR 8 -29.654 -63.317 -16.509 683 3HG2 THR 8 3HG2 THR 8 -31.367 -63.487 -16.120 684 H SER 9 H SER 9 -33.273 -59.860 -17.055 685 HA SER 9 HA SER 9 -32.841 -58.354 -19.551 686 1HB SER 9 1HB SER 9 -34.997 -57.410 -17.766 687 2HB SER 9 2HB SER 9 -34.953 -57.509 -19.526 688 HG SER 9 HG SER 9 -34.962 -59.983 -18.722 689 H VAL 10 H VAL 10 -30.885 -58.517 -17.683 690 HA VAL 10 HA VAL 10 -31.091 -56.134 -15.988 691 HB VAL 10 HB VAL 10 -28.636 -57.077 -15.409 692 1HG1 VAL 10 1HG1 VAL 10 -30.382 -58.639 -13.845 693 2HG1 VAL 10 2HG1 VAL 10 -31.242 -57.152 -14.243 694 3HG1 VAL 10 3HG1 VAL 10 -29.669 -57.076 -13.448 695 1HG2 VAL 10 1HG2 VAL 10 -30.245 -59.518 -16.158 696 2HG2 VAL 10 2HG2 VAL 10 -28.707 -59.522 -15.295 697 3HG2 VAL 10 3HG2 VAL 10 -28.782 -58.949 -16.961 698 H LYS 11 H LYS 11 -30.599 -56.390 -19.018 699 HA LYS 11 HA LYS 11 -27.985 -55.418 -19.509 700 1HB LYS 11 1HB LYS 11 -29.346 -56.535 -21.234 701 2HB LYS 11 2HB LYS 11 -30.475 -55.187 -21.212 702 1HG LYS 11 1HG LYS 11 -29.265 -54.445 -22.941 703 2HG LYS 11 2HG LYS 11 -28.146 -53.893 -21.695 704 1HD LYS 11 1HD LYS 11 -26.949 -56.063 -21.889 705 2HD LYS 11 2HD LYS 11 -28.004 -56.476 -23.242 706 1HE LYS 11 1HE LYS 11 -26.607 -55.414 -24.605 707 2HE LYS 11 2HE LYS 11 -26.999 -53.908 -23.777 708 1HZ LYS 11 1HZ LYS 11 -24.887 -55.782 -22.858 709 2HZ LYS 11 2HZ LYS 11 -25.186 -54.211 -22.297 710 3HZ LYS 11 3HZ LYS 11 -24.590 -54.448 -23.862 711 H LYS 12 H LYS 12 -27.270 -53.552 -18.764 712 HA LYS 12 HA LYS 12 -29.104 -51.284 -18.499 713 1HB LYS 12 1HB LYS 12 -27.025 -52.229 -16.909 714 2HB LYS 12 2HB LYS 12 -26.346 -50.814 -17.698 715 1HG LYS 12 1HG LYS 12 -29.044 -50.554 -16.500 716 2HG LYS 12 2HG LYS 12 -27.660 -50.661 -15.411 717 1HD LYS 12 1HD LYS 12 -26.597 -48.807 -16.696 718 2HD LYS 12 2HD LYS 12 -28.099 -48.647 -17.608 719 1HE LYS 12 1HE LYS 12 -28.612 -48.675 -14.770 720 2HE LYS 12 2HE LYS 12 -27.447 -47.418 -15.186 721 1HZ LYS 12 1HZ LYS 12 -29.149 -46.893 -17.052 722 2HZ LYS 12 2HZ LYS 12 -29.432 -46.338 -15.474 723 3HZ LYS 12 3HZ LYS 12 -30.241 -47.714 -16.049 724 H MET 13 H MET 13 -29.168 -49.759 -20.015 725 HA MET 13 HA MET 13 -27.619 -49.909 -22.353 726 1HB MET 13 1HB MET 13 -29.862 -48.879 -22.248 727 2HB MET 13 2HB MET 13 -29.198 -47.556 -21.300 728 1HG MET 13 1HG MET 13 -28.166 -46.596 -23.091 729 2HG MET 13 2HG MET 13 -27.967 -48.129 -23.938 730 1HE MET 13 1HE MET 13 -31.642 -45.639 -23.358 731 2HE MET 13 2HE MET 13 -30.744 -46.553 -22.143 732 3HE MET 13 3HE MET 13 -32.070 -47.316 -23.018 733 H THR 14 H THR 14 -25.768 -48.968 -22.994 734 HA THR 14 HA THR 14 -23.972 -47.888 -21.116 735 HB THR 14 HB THR 14 -22.956 -47.078 -23.500 736 HG1 THR 14 HG1 THR 14 -23.508 -48.752 -25.005 737 1HG2 THR 14 1HG2 THR 14 -21.882 -48.536 -21.822 738 2HG2 THR 14 2HG2 THR 14 -21.652 -49.125 -23.467 739 3HG2 THR 14 3HG2 THR 14 -22.842 -49.894 -22.415 740 H PHE 15 H PHE 15 -23.542 -45.857 -20.524 741 HA PHE 15 HA PHE 15 -25.563 -43.942 -20.871 742 1HB PHE 15 1HB PHE 15 -22.938 -44.038 -19.475 743 2HB PHE 15 2HB PHE 15 -23.671 -42.458 -19.733 744 HD1 PHE 15 HD1 PHE 15 -24.099 -41.950 -17.458 745 HD2 PHE 15 HD2 PHE 15 -25.585 -45.552 -19.167 746 HE1 PHE 15 HE1 PHE 15 -25.538 -42.289 -15.491 747 HE2 PHE 15 HE2 PHE 15 -27.024 -45.897 -17.207 748 HZ PHE 15 HZ PHE 15 -27.001 -44.266 -15.361 749 H GLY 16 H GLY 16 -22.485 -44.371 -22.472 750 1HA GLY 16 1HA GLY 16 -21.909 -43.467 -24.547 751 2HA GLY 16 2HA GLY 16 -23.263 -42.358 -24.419 752 H GLU 17 H GLU 17 -22.907 -40.880 -22.303 753 HA GLU 17 HA GLU 17 -20.527 -39.363 -22.927 754 1HB GLU 17 1HB GLU 17 -23.059 -38.686 -22.097 755 2HB GLU 17 2HB GLU 17 -22.118 -38.488 -20.624 756 1HG GLU 17 1HG GLU 17 -21.058 -37.304 -23.126 757 2HG GLU 17 2HG GLU 17 -22.443 -36.531 -22.357 758 H ASN 18 H ASN 18 -21.929 -40.331 -19.802 759 HA ASN 18 HA ASN 18 -21.001 -41.014 -17.843 760 1HB ASN 18 1HB ASN 18 -19.481 -42.385 -19.924 761 2HB ASN 18 2HB ASN 18 -18.562 -42.178 -18.437 762 1HD2 ASN 18 1HD2 ASN 18 -20.269 -44.341 -19.982 763 2HD2 ASN 18 2HD2 ASN 18 -21.054 -45.164 -18.670 764 H ARG 19 H ARG 19 -20.697 -38.502 -17.853 765 HA ARG 19 HA ARG 19 -18.059 -37.481 -18.023 766 1HB ARG 19 1HB ARG 19 -19.312 -35.635 -18.078 767 2HB ARG 19 2HB ARG 19 -20.698 -36.482 -17.421 768 1HG ARG 19 1HG ARG 19 -19.009 -36.071 -15.243 769 2HG ARG 19 2HG ARG 19 -18.954 -34.569 -16.168 770 1HD ARG 19 1HD ARG 19 -21.275 -34.266 -16.020 771 2HD ARG 19 2HD ARG 19 -21.546 -35.933 -15.519 772 HE ARG 19 HE ARG 19 -20.769 -33.701 -13.848 773 1HH1 ARG 19 1HH1 ARG 19 -21.056 -37.183 -14.126 774 2HH1 ARG 19 2HH1 ARG 19 -21.041 -37.450 -12.406 775 1HH2 ARG 19 1HH2 ARG 19 -20.754 -34.046 -11.582 776 2HH2 ARG 19 2HH2 ARG 19 -20.885 -35.670 -10.968 777 H ASP 20 H ASP 20 -16.518 -37.158 -16.519 778 HA ASP 20 HA ASP 20 -17.020 -38.199 -13.809 779 1HB ASP 20 1HB ASP 20 -15.554 -39.727 -15.093 780 2HB ASP 20 2HB ASP 20 -14.436 -38.396 -15.375 781 H LEU 21 H LEU 21 -17.086 -36.506 -12.498 782 HA LEU 21 HA LEU 21 -15.796 -34.028 -13.178 783 1HB LEU 21 1HB LEU 21 -18.009 -34.709 -11.716 784 2HB LEU 21 2HB LEU 21 -16.859 -34.295 -10.462 785 HG LEU 21 HG LEU 21 -18.361 -32.423 -11.224 786 1HD1 LEU 21 1HD1 LEU 21 -15.738 -31.345 -11.843 787 2HD1 LEU 21 2HD1 LEU 21 -15.723 -32.394 -10.425 788 3HD1 LEU 21 3HD1 LEU 21 -16.811 -31.005 -10.487 789 1HD2 LEU 21 1HD2 LEU 21 -18.303 -31.561 -13.318 790 2HD2 LEU 21 2HD2 LEU 21 -17.869 -33.222 -13.721 791 3HD2 LEU 21 3HD2 LEU 21 -16.611 -31.993 -13.572 792 H GLU 22 H GLU 22 -13.695 -33.787 -12.910 793 HA GLU 22 HA GLU 22 -12.408 -34.975 -10.548 794 1HB GLU 22 1HB GLU 22 -10.920 -33.761 -12.862 795 2HB GLU 22 2HB GLU 22 -10.365 -34.963 -11.708 796 1HG GLU 22 1HG GLU 22 -10.993 -36.623 -13.029 797 2HG GLU 22 2HG GLU 22 -12.619 -35.961 -13.186 798 H ARG 23 H ARG 23 -11.252 -33.694 -9.140 799 HA ARG 23 HA ARG 23 -11.406 -30.792 -9.603 800 1HB ARG 23 1HB ARG 23 -12.926 -32.031 -7.756 801 2HB ARG 23 2HB ARG 23 -11.473 -31.758 -6.802 802 1HG ARG 23 1HG ARG 23 -12.960 -29.928 -6.451 803 2HG ARG 23 2HG ARG 23 -11.599 -29.352 -7.413 804 1HD ARG 23 1HD ARG 23 -14.007 -30.342 -8.848 805 2HD ARG 23 2HD ARG 23 -14.113 -28.779 -8.040 806 HE ARG 23 HE ARG 23 -12.546 -29.442 -10.389 807 1HH1 ARG 23 1HH1 ARG 23 -13.147 -27.132 -7.821 808 2HH1 ARG 23 2HH1 ARG 23 -12.382 -25.810 -8.660 809 1HH2 ARG 23 1HH2 ARG 23 -11.540 -27.720 -11.488 810 2HH2 ARG 23 2HH2 ARG 23 -11.490 -26.141 -10.761 811 H VAL 24 H VAL 24 -9.341 -30.482 -10.216 812 HA VAL 24 HA VAL 24 -7.194 -31.560 -8.541 813 HB VAL 24 HB VAL 24 -6.852 -29.989 -11.096 814 1HG1 VAL 24 1HG1 VAL 24 -4.790 -31.652 -11.057 815 2HG1 VAL 24 2HG1 VAL 24 -5.103 -31.603 -9.321 816 3HG1 VAL 24 3HG1 VAL 24 -4.759 -30.111 -10.198 817 1HG2 VAL 24 1HG2 VAL 24 -6.771 -32.975 -11.044 818 2HG2 VAL 24 2HG2 VAL 24 -7.048 -31.882 -12.400 819 3HG2 VAL 24 3HG2 VAL 24 -8.319 -32.146 -11.208 820 H VAL 25 H VAL 25 -7.695 -30.165 -6.766 821 HA VAL 25 HA VAL 25 -7.051 -27.330 -7.208 822 HB VAL 25 HB VAL 25 -7.904 -27.719 -4.535 823 1HG1 VAL 25 1HG1 VAL 25 -8.506 -25.683 -5.261 824 2HG1 VAL 25 2HG1 VAL 25 -9.999 -26.494 -5.732 825 3HG1 VAL 25 3HG1 VAL 25 -8.728 -26.224 -6.925 826 1HG2 VAL 25 1HG2 VAL 25 -8.970 -29.777 -5.055 827 2HG2 VAL 25 2HG2 VAL 25 -9.664 -29.121 -6.537 828 3HG2 VAL 25 3HG2 VAL 25 -10.234 -28.552 -4.968 829 H THR 26 H THR 26 -5.279 -29.761 -6.883 830 HA THR 26 HA THR 26 -3.931 -29.453 -4.388 831 HB THR 26 HB THR 26 -2.367 -30.658 -6.546 832 HG1 THR 26 HG1 THR 26 -5.022 -31.570 -5.992 833 1HG2 THR 26 1HG2 THR 26 -3.518 -31.934 -4.068 834 2HG2 THR 26 2HG2 THR 26 -2.070 -30.928 -4.045 835 3HG2 THR 26 3HG2 THR 26 -2.090 -32.423 -4.978 836 H ALA 27 H ALA 27 -3.048 -27.511 -4.003 837 HA ALA 27 HA ALA 27 -0.899 -26.627 -5.772 838 1HB ALA 27 1HB ALA 27 -2.151 -24.992 -6.636 839 2HB ALA 27 2HB ALA 27 -2.041 -24.224 -5.052 840 3HB ALA 27 3HB ALA 27 -3.434 -25.232 -5.450 841 HA PRO 28 HA PRO 28 0.470 -26.315 -1.482 842 1HB PRO 28 1HB PRO 28 3.016 -27.010 -1.904 843 2HB PRO 28 2HB PRO 28 1.721 -28.213 -1.965 844 1HG PRO 28 1HG PRO 28 3.161 -26.860 -4.208 845 2HG PRO 28 2HG PRO 28 2.647 -28.550 -4.061 846 1HD PRO 28 1HD PRO 28 1.280 -26.589 -5.462 847 2HD PRO 28 2HD PRO 28 0.561 -28.095 -4.864 848 H VAL 29 H VAL 29 2.865 -25.368 -0.779 849 HA VAL 29 HA VAL 29 2.730 -22.588 -1.427 850 HB VAL 29 HB VAL 29 3.366 -23.374 0.820 851 1HG1 VAL 29 1HG1 VAL 29 6.099 -23.960 0.536 852 2HG1 VAL 29 2HG1 VAL 29 5.250 -24.962 -0.644 853 3HG1 VAL 29 3HG1 VAL 29 4.805 -25.041 1.061 854 1HG2 VAL 29 1HG2 VAL 29 4.518 -21.497 1.182 855 2HG2 VAL 29 2HG2 VAL 29 4.421 -21.246 -0.561 856 3HG2 VAL 29 3HG2 VAL 29 5.849 -22.008 0.140 857 H SER 30 H SER 30 4.215 -21.340 -2.559 858 HA SER 30 HA SER 30 5.524 -22.683 -4.732 859 1HB SER 30 1HB SER 30 6.125 -19.847 -4.463 860 2HB SER 30 2HB SER 30 5.269 -20.688 -5.757 861 HG SER 30 HG SER 30 3.380 -20.403 -4.733 862 H SER 31 H SER 31 7.797 -21.810 -5.349 863 HA SER 31 HA SER 31 9.492 -21.893 -2.942 864 1HB SER 31 1HB SER 31 10.727 -22.598 -5.524 865 2HB SER 31 2HB SER 31 10.873 -23.384 -3.952 866 HG SER 31 HG SER 31 8.639 -24.152 -4.385 867 H GLY 32 H GLY 32 9.216 -19.573 -2.844 868 1HA GLY 32 1HA GLY 32 10.242 -17.510 -3.066 869 2HA GLY 32 2HA GLY 32 11.299 -18.202 -4.288 870 H LYS 33 H LYS 33 7.897 -17.288 -3.826 871 HA LYS 33 HA LYS 33 7.640 -16.727 -6.668 872 1HB LYS 33 1HB LYS 33 5.875 -17.655 -4.747 873 2HB LYS 33 2HB LYS 33 5.392 -15.977 -4.951 874 1HG LYS 33 1HG LYS 33 5.689 -16.834 -7.537 875 2HG LYS 33 2HG LYS 33 5.037 -18.259 -6.722 876 1HD LYS 33 1HD LYS 33 3.570 -16.090 -5.741 877 2HD LYS 33 2HD LYS 33 3.717 -15.813 -7.478 878 1HE LYS 33 1HE LYS 33 2.655 -17.826 -8.006 879 2HE LYS 33 2HE LYS 33 2.916 -18.493 -6.394 880 1HZ LYS 33 1HZ LYS 33 0.655 -17.216 -7.324 881 2HZ LYS 33 2HZ LYS 33 1.374 -16.111 -6.256 882 3HZ LYS 33 3HZ LYS 33 0.981 -17.675 -5.727 883 H ILE 34 H ILE 34 5.820 -14.590 -6.508 884 HA ILE 34 HA ILE 34 7.364 -12.429 -5.257 885 HB ILE 34 HB ILE 34 6.186 -11.475 -7.704 886 1HG1 ILE 34 1HG1 ILE 34 8.448 -13.084 -8.569 887 2HG1 ILE 34 2HG1 ILE 34 7.119 -14.091 -8.001 888 1HG2 ILE 34 1HG2 ILE 34 9.028 -11.647 -6.716 889 2HG2 ILE 34 2HG2 ILE 34 7.902 -10.314 -6.459 890 3HG2 ILE 34 3HG2 ILE 34 8.483 -10.677 -8.085 891 1HD1 ILE 34 1HD1 ILE 34 7.414 -12.739 -10.481 892 2HD1 ILE 34 2HD1 ILE 34 6.003 -12.094 -9.641 893 3HD1 ILE 34 3HD1 ILE 34 6.129 -13.824 -9.953 894 H LYS 35 H LYS 35 6.141 -10.480 -4.932 895 HA LYS 35 HA LYS 35 3.226 -10.886 -4.796 896 1HB LYS 35 1HB LYS 35 5.114 -9.856 -2.671 897 2HB LYS 35 2HB LYS 35 3.367 -9.661 -2.584 898 1HG LYS 35 1HG LYS 35 4.506 -12.386 -2.968 899 2HG LYS 35 2HG LYS 35 4.561 -11.641 -1.368 900 1HD LYS 35 1HD LYS 35 2.402 -12.062 -1.029 901 2HD LYS 35 2HD LYS 35 1.955 -11.320 -2.566 902 1HE LYS 35 1HE LYS 35 1.365 -13.372 -3.209 903 2HE LYS 35 2HE LYS 35 3.093 -13.702 -3.335 904 1HZ LYS 35 1HZ LYS 35 3.115 -14.673 -1.205 905 2HZ LYS 35 2HZ LYS 35 1.755 -15.323 -1.989 906 3HZ LYS 35 3HZ LYS 35 1.563 -14.098 -0.829 907 H ARG 36 H ARG 36 1.960 -9.002 -4.998 908 HA ARG 36 HA ARG 36 3.435 -6.702 -6.108 909 1HB ARG 36 1HB ARG 36 0.539 -7.448 -6.552 910 2HB ARG 36 2HB ARG 36 1.423 -6.160 -7.355 911 1HG ARG 36 1HG ARG 36 1.701 -7.654 -8.988 912 2HG ARG 36 2HG ARG 36 2.964 -8.317 -7.950 913 1HD ARG 36 1HD ARG 36 1.793 -10.228 -8.220 914 2HD ARG 36 2HD ARG 36 0.830 -9.557 -6.904 915 HE ARG 36 HE ARG 36 -0.457 -8.564 -9.004 916 1HH1 ARG 36 1HH1 ARG 36 0.742 -11.793 -8.390 917 2HH1 ARG 36 2HH1 ARG 36 -0.464 -12.567 -9.381 918 1HH2 ARG 36 1HH2 ARG 36 -2.044 -9.566 -10.309 919 2HH2 ARG 36 2HH2 ARG 36 -2.070 -11.305 -10.446 920 H VAL 37 H VAL 37 3.617 -5.065 -4.762 921 HA VAL 37 HA VAL 37 1.347 -4.436 -2.979 922 HB VAL 37 HB VAL 37 4.200 -3.690 -2.357 923 1HG1 VAL 37 1HG1 VAL 37 1.796 -2.910 -1.259 924 2HG1 VAL 37 2HG1 VAL 37 3.377 -2.787 -0.484 925 3HG1 VAL 37 3HG1 VAL 37 2.346 -4.181 -0.165 926 1HG2 VAL 37 1HG2 VAL 37 4.624 -5.872 -2.075 927 2HG2 VAL 37 2HG2 VAL 37 2.917 -6.311 -2.110 928 3HG2 VAL 37 3HG2 VAL 37 3.643 -5.715 -0.619 929 H ASN 38 H ASN 38 0.454 -2.483 -3.280 930 HA ASN 38 HA ASN 38 1.941 -0.554 -4.933 931 1HB ASN 38 1HB ASN 38 -0.451 -1.410 -5.558 932 2HB ASN 38 2HB ASN 38 -0.981 -0.275 -4.316 933 1HD2 ASN 38 1HD2 ASN 38 0.851 -0.552 -7.295 934 2HD2 ASN 38 2HD2 ASN 38 0.618 1.087 -7.814 935 H VAL 39 H VAL 39 2.835 1.073 -3.933 936 HA VAL 39 HA VAL 39 1.757 1.898 -1.312 937 HB VAL 39 HB VAL 39 4.552 2.570 -2.097 938 1HG1 VAL 39 1HG1 VAL 39 4.590 3.216 0.022 939 2HG1 VAL 39 2HG1 VAL 39 4.287 1.557 0.533 940 3HG1 VAL 39 3HG1 VAL 39 2.934 2.648 0.240 941 1HG2 VAL 39 1HG2 VAL 39 5.317 0.485 -2.215 942 2HG2 VAL 39 2HG2 VAL 39 3.650 -0.085 -2.220 943 3HG2 VAL 39 3HG2 VAL 39 4.526 0.062 -0.696 944 H ASN 40 H ASN 40 1.716 4.117 -0.817 945 HA ASN 40 HA ASN 40 1.702 5.844 -3.195 946 1HB ASN 40 1HB ASN 40 -0.125 5.532 -0.927 947 2HB ASN 40 2HB ASN 40 0.316 7.211 -1.231 948 1HD2 ASN 40 1HD2 ASN 40 0.587 7.132 -4.009 949 2HD2 ASN 40 2HD2 ASN 40 -0.980 6.867 -4.698 950 H PHE 41 H PHE 41 3.529 6.958 -3.306 951 HA PHE 41 HA PHE 41 4.760 7.950 -0.827 952 1HB PHE 41 1HB PHE 41 6.005 7.794 -3.579 953 2HB PHE 41 2HB PHE 41 6.825 8.137 -2.061 954 HD1 PHE 41 HD1 PHE 41 6.507 6.229 -0.234 955 HD2 PHE 41 HD2 PHE 41 6.199 5.678 -4.440 956 HE1 PHE 41 HE1 PHE 41 6.985 3.833 0.049 957 HE2 PHE 41 HE2 PHE 41 6.682 3.281 -4.163 958 HZ PHE 41 HZ PHE 41 7.119 2.364 -1.946 959 H ASP 42 H ASP 42 5.769 10.109 -0.973 960 HA ASP 42 HA ASP 42 3.930 12.053 -1.956 961 1HB ASP 42 1HB ASP 42 5.382 12.298 0.092 962 2HB ASP 42 2HB ASP 42 6.757 12.513 -0.986 963 H GLU 43 H GLU 43 4.775 13.961 -3.258 964 HA GLU 43 HA GLU 43 5.591 13.125 -5.835 965 1HB GLU 43 1HB GLU 43 4.680 15.538 -4.585 966 2HB GLU 43 2HB GLU 43 6.123 15.894 -5.525 967 1HG GLU 43 1HG GLU 43 3.949 14.278 -6.760 968 2HG GLU 43 2HG GLU 43 3.750 16.023 -6.604 969 H GLU 44 H GLU 44 7.260 14.598 -3.096 970 HA GLU 44 HA GLU 44 9.766 15.056 -4.283 971 1HB GLU 44 1HB GLU 44 8.662 15.244 -1.723 972 2HB GLU 44 2HB GLU 44 9.974 14.080 -1.567 973 1HG GLU 44 1HG GLU 44 11.090 16.018 -1.148 974 2HG GLU 44 2HG GLU 44 11.321 15.894 -2.892 975 H LYS 45 H LYS 45 8.364 12.214 -2.780 976 HA LYS 45 HA LYS 45 10.689 10.613 -2.778 977 1HB LYS 45 1HB LYS 45 7.747 9.929 -2.733 978 2HB LYS 45 2HB LYS 45 9.022 8.727 -2.558 979 1HG LYS 45 1HG LYS 45 9.764 10.506 -0.669 980 2HG LYS 45 2HG LYS 45 8.011 10.713 -0.651 981 1HD LYS 45 1HD LYS 45 7.628 8.592 0.097 982 2HD LYS 45 2HD LYS 45 9.084 7.945 -0.661 983 1HE LYS 45 1HE LYS 45 10.054 8.016 1.335 984 2HE LYS 45 2HE LYS 45 10.002 9.774 1.226 985 1HZ LYS 45 1HZ LYS 45 8.996 8.847 3.281 986 2HZ LYS 45 2HZ LYS 45 7.793 8.123 2.331 987 3HZ LYS 45 3HZ LYS 45 7.931 9.811 2.376 988 H HIS 46 H HIS 46 8.279 11.332 -5.173 989 HA HIS 46 HA HIS 46 9.070 9.190 -6.938 990 1HB HIS 46 1HB HIS 46 6.757 10.134 -6.920 991 2HB HIS 46 2HB HIS 46 7.406 11.625 -7.594 992 HD1 HIS 46 HD1 HIS 46 7.408 11.764 -10.061 993 HD2 HIS 46 HD2 HIS 46 7.287 7.829 -8.724 994 HE1 HIS 46 HE1 HIS 46 7.167 10.350 -12.132 995 HE2 HIS 46 HE2 HIS 46 7.310 7.966 -11.310 996 H THR 47 H THR 47 9.596 12.698 -6.748 997 HA THR 47 HA THR 47 11.103 12.906 -9.127 998 HB THR 47 HB THR 47 11.592 14.687 -6.757 999 HG1 THR 47 HG1 THR 47 9.611 15.475 -6.872 1000 1HG2 THR 47 1HG2 THR 47 11.096 15.883 -9.364 1001 2HG2 THR 47 2HG2 THR 47 12.430 14.726 -9.397 1002 3HG2 THR 47 3HG2 THR 47 12.469 16.086 -8.273 1003 H ARG 48 H ARG 48 12.024 12.329 -5.761 1004 HA ARG 48 HA ARG 48 14.825 12.210 -6.201 1005 1HB ARG 48 1HB ARG 48 13.330 12.264 -3.985 1006 2HB ARG 48 2HB ARG 48 13.586 10.527 -4.088 1007 1HG ARG 48 1HG ARG 48 15.783 10.675 -3.580 1008 2HG ARG 48 2HG ARG 48 15.981 12.234 -4.385 1009 1HD ARG 48 1HD ARG 48 14.898 13.364 -2.541 1010 2HD ARG 48 2HD ARG 48 14.554 11.821 -1.761 1011 HE ARG 48 HE ARG 48 17.306 11.951 -2.128 1012 1HH1 ARG 48 1HH1 ARG 48 14.865 13.778 -0.396 1013 2HH1 ARG 48 2HH1 ARG 48 15.931 14.181 0.920 1014 1HH2 ARG 48 1HH2 ARG 48 18.708 12.494 -0.425 1015 2HH2 ARG 48 2HH2 ARG 48 18.129 13.506 0.874 1016 H PHE 49 H PHE 49 12.231 9.826 -6.331 1017 HA PHE 49 HA PHE 49 13.856 7.543 -6.656 1018 1HB PHE 49 1HB PHE 49 11.045 8.157 -6.720 1019 2HB PHE 49 2HB PHE 49 11.452 7.098 -8.065 1020 HD1 PHE 49 HD1 PHE 49 13.854 5.892 -6.355 1021 HD2 PHE 49 HD2 PHE 49 9.670 6.376 -5.760 1022 HE1 PHE 49 HE1 PHE 49 13.852 3.962 -4.832 1023 HE2 PHE 49 HE2 PHE 49 9.659 4.442 -4.243 1024 HZ PHE 49 HZ PHE 49 11.751 3.233 -3.776 1025 H LYS 50 H LYS 50 12.495 9.842 -8.961 1026 HA LYS 50 HA LYS 50 13.160 8.484 -11.332 1027 1HB LYS 50 1HB LYS 50 12.518 11.275 -10.570 1028 2HB LYS 50 2HB LYS 50 13.391 11.068 -12.081 1029 1HG LYS 50 1HG LYS 50 11.135 9.243 -11.799 1030 2HG LYS 50 2HG LYS 50 10.675 10.948 -11.765 1031 1HD LYS 50 1HD LYS 50 12.580 9.990 -13.854 1032 2HD LYS 50 2HD LYS 50 10.857 9.660 -14.041 1033 1HE LYS 50 1HE LYS 50 10.462 11.748 -14.688 1034 2HE LYS 50 2HE LYS 50 11.272 12.396 -13.262 1035 1HZ LYS 50 1HZ LYS 50 12.665 13.205 -14.819 1036 2HZ LYS 50 2HZ LYS 50 12.286 12.010 -15.962 1037 3HZ LYS 50 3HZ LYS 50 13.374 11.667 -14.705 1038 H ALA 51 H ALA 51 14.939 10.848 -9.402 1039 HA ALA 51 HA ALA 51 17.284 10.911 -10.984 1040 1HB ALA 51 1HB ALA 51 17.228 11.362 -8.020 1041 2HB ALA 51 2HB ALA 51 16.542 12.529 -9.150 1042 3HB ALA 51 3HB ALA 51 18.255 12.121 -9.234 1043 H ALA 52 H ALA 52 16.300 8.966 -8.196 1044 HA ALA 52 HA ALA 52 18.707 7.575 -7.803 1045 1HB ALA 52 1HB ALA 52 17.573 6.529 -6.187 1046 2HB ALA 52 2HB ALA 52 16.300 6.009 -7.293 1047 3HB ALA 52 3HB ALA 52 16.254 7.626 -6.593 1048 H CYS 53 H CYS 53 15.896 6.840 -9.834 1049 HA CYS 53 HA CYS 53 16.795 4.331 -10.765 1050 1HB CYS 53 1HB CYS 53 14.947 6.327 -12.085 1051 2HB CYS 53 2HB CYS 53 15.140 4.649 -12.576 1052 HG CYS 53 HG CYS 53 13.843 5.747 -9.608 1053 H ALA 54 H ALA 54 17.444 7.616 -11.788 1054 HA ALA 54 HA ALA 54 18.714 6.868 -14.255 1055 1HB ALA 54 1HB ALA 54 18.075 9.020 -14.497 1056 2HB ALA 54 2HB ALA 54 19.655 9.357 -13.788 1057 3HB ALA 54 3HB ALA 54 18.213 9.369 -12.775 1058 H ARG 55 H ARG 55 19.790 7.839 -11.034 1059 HA ARG 55 HA ARG 55 22.554 7.780 -11.497 1060 1HB ARG 55 1HB ARG 55 20.931 8.403 -9.374 1061 2HB ARG 55 2HB ARG 55 21.704 6.927 -8.816 1062 1HG ARG 55 1HG ARG 55 23.345 8.254 -8.123 1063 2HG ARG 55 2HG ARG 55 23.816 8.346 -9.821 1064 1HD ARG 55 1HD ARG 55 23.680 10.574 -8.916 1065 2HD ARG 55 2HD ARG 55 22.371 10.336 -10.074 1066 HE ARG 55 HE ARG 55 21.729 9.868 -7.268 1067 1HH1 ARG 55 1HH1 ARG 55 21.613 12.031 -10.027 1068 2HH1 ARG 55 2HH1 ARG 55 20.382 13.050 -9.336 1069 1HH2 ARG 55 1HH2 ARG 55 20.141 11.205 -6.353 1070 2HH2 ARG 55 2HH2 ARG 55 19.561 12.597 -7.224 1071 H LYS 56 H LYS 56 20.364 5.271 -10.279 1072 HA LYS 56 HA LYS 56 22.491 3.326 -10.101 1073 1HB LYS 56 1HB LYS 56 19.734 3.556 -9.209 1074 2HB LYS 56 2HB LYS 56 20.077 1.967 -9.881 1075 1HG LYS 56 1HG LYS 56 20.437 2.168 -7.417 1076 2HG LYS 56 2HG LYS 56 21.828 1.587 -8.335 1077 1HD LYS 56 1HD LYS 56 22.693 3.149 -6.797 1078 2HD LYS 56 2HD LYS 56 22.651 3.983 -8.349 1079 1HE LYS 56 1HE LYS 56 20.927 5.365 -7.712 1080 2HE LYS 56 2HE LYS 56 20.311 4.222 -6.520 1081 1HZ LYS 56 1HZ LYS 56 21.387 6.230 -5.566 1082 2HZ LYS 56 2HZ LYS 56 22.867 5.698 -6.212 1083 3HZ LYS 56 3HZ LYS 56 22.072 4.766 -5.040 1084 H GLY 57 H GLY 57 20.194 4.327 -12.461 1085 1HA GLY 57 1HA GLY 57 19.901 3.681 -14.640 1086 2HA GLY 57 2HA GLY 57 21.332 2.678 -14.467 1087 H THR 58 H THR 58 18.154 2.629 -12.884 1088 HA THR 58 HA THR 58 17.575 0.045 -14.068 1089 HB THR 58 HB THR 58 18.979 -0.306 -11.960 1090 HG1 THR 58 HG1 THR 58 17.358 -1.829 -12.985 1091 1HG2 THR 58 1HG2 THR 58 17.593 1.502 -10.725 1092 2HG2 THR 58 2HG2 THR 58 18.090 0.055 -9.846 1093 3HG2 THR 58 3HG2 THR 58 16.440 0.195 -10.453 1094 H SER 59 H SER 59 15.387 -0.758 -13.115 1095 HA SER 59 HA SER 59 13.518 1.330 -13.657 1096 1HB SER 59 1HB SER 59 12.359 -1.159 -12.711 1097 2HB SER 59 2HB SER 59 12.221 -0.384 -14.293 1098 HG SER 59 HG SER 59 14.073 -2.282 -13.368 1099 H ILE 60 H ILE 60 11.566 1.693 -12.355 1100 HA ILE 60 HA ILE 60 12.232 2.648 -9.821 1101 HB ILE 60 HB ILE 60 10.376 3.508 -11.235 1102 1HG1 ILE 60 1HG1 ILE 60 8.847 3.038 -8.834 1103 2HG1 ILE 60 2HG1 ILE 60 10.538 3.329 -8.438 1104 1HG2 ILE 60 1HG2 ILE 60 9.157 0.892 -10.502 1105 2HG2 ILE 60 2HG2 ILE 60 9.169 1.735 -12.049 1106 3HG2 ILE 60 3HG2 ILE 60 8.120 2.297 -10.747 1107 1HD1 ILE 60 1HD1 ILE 60 10.503 5.472 -9.294 1108 2HD1 ILE 60 2HD1 ILE 60 8.903 5.318 -8.564 1109 3HD1 ILE 60 3HD1 ILE 60 9.096 5.154 -10.310 1110 H THR 61 H THR 61 10.929 -0.448 -10.781 1111 HA THR 61 HA THR 61 10.070 -1.225 -8.198 1112 HB THR 61 HB THR 61 10.876 -3.432 -9.907 1113 HG1 THR 61 HG1 THR 61 10.251 -2.638 -11.754 1114 1HG2 THR 61 1HG2 THR 61 8.794 -4.273 -9.361 1115 2HG2 THR 61 2HG2 THR 61 8.053 -2.675 -9.284 1116 3HG2 THR 61 3HG2 THR 61 9.115 -3.217 -7.986 1117 H ASP 62 H ASP 62 13.051 -1.606 -10.013 1118 HA ASP 62 HA ASP 62 14.217 -3.467 -8.224 1119 1HB ASP 62 1HB ASP 62 15.520 -1.754 -10.345 1120 2HB ASP 62 2HB ASP 62 16.274 -3.122 -9.530 1121 H VAL 63 H VAL 63 14.309 0.050 -8.423 1122 HA VAL 63 HA VAL 63 16.456 0.333 -6.557 1123 HB VAL 63 HB VAL 63 15.324 2.665 -6.170 1124 1HG1 VAL 63 1HG1 VAL 63 16.340 3.404 -8.420 1125 2HG1 VAL 63 2HG1 VAL 63 16.799 1.711 -8.593 1126 3HG1 VAL 63 3HG1 VAL 63 17.390 2.650 -7.221 1127 1HG2 VAL 63 1HG2 VAL 63 13.931 3.457 -7.920 1128 2HG2 VAL 63 2HG2 VAL 63 13.215 1.951 -7.337 1129 3HG2 VAL 63 3HG2 VAL 63 14.132 1.969 -8.843 1130 H VAL 64 H VAL 64 12.978 -0.053 -6.283 1131 HA VAL 64 HA VAL 64 12.837 0.468 -3.475 1132 HB VAL 64 HB VAL 64 10.999 -1.275 -5.127 1133 1HG1 VAL 64 1HG1 VAL 64 9.509 -1.258 -3.375 1134 2HG1 VAL 64 2HG1 VAL 64 10.178 0.214 -2.677 1135 3HG1 VAL 64 3HG1 VAL 64 11.043 -1.314 -2.506 1136 1HG2 VAL 64 1HG2 VAL 64 10.870 1.675 -4.512 1137 2HG2 VAL 64 2HG2 VAL 64 9.539 0.740 -5.192 1138 3HG2 VAL 64 3HG2 VAL 64 11.040 0.923 -6.099 1139 H ASN 65 H ASN 65 13.512 -2.329 -5.476 1140 HA ASN 65 HA ASN 65 13.511 -4.265 -3.408 1141 1HB ASN 65 1HB ASN 65 13.804 -4.355 -6.131 1142 2HB ASN 65 2HB ASN 65 15.443 -4.697 -5.586 1143 1HD2 ASN 65 1HD2 ASN 65 13.391 -6.375 -6.896 1144 2HD2 ASN 65 2HD2 ASN 65 13.246 -7.770 -5.878 1145 H GLN 66 H GLN 66 15.810 -1.867 -4.437 1146 HA GLN 66 HA GLN 66 18.061 -2.959 -3.045 1147 1HB GLN 66 1HB GLN 66 17.556 -0.769 -4.793 1148 2HB GLN 66 2HB GLN 66 18.314 -0.135 -3.341 1149 1HG GLN 66 1HG GLN 66 19.464 -1.630 -5.526 1150 2HG GLN 66 2HG GLN 66 20.250 -0.676 -4.265 1151 1HE2 GLN 66 1HE2 GLN 66 19.268 -3.826 -5.288 1152 2HE2 GLN 66 2HE2 GLN 66 20.097 -4.712 -4.047 1153 H LEU 67 H LEU 67 15.667 -0.427 -2.282 1154 HA LEU 67 HA LEU 67 16.870 0.201 0.220 1155 1HB LEU 67 1HB LEU 67 14.386 1.048 0.659 1156 2HB LEU 67 2HB LEU 67 15.556 1.956 -0.274 1157 HG LEU 67 HG LEU 67 14.253 0.290 -2.122 1158 1HD1 LEU 67 1HD1 LEU 67 12.506 -0.137 -0.510 1159 2HD1 LEU 67 2HD1 LEU 67 11.902 0.931 -1.776 1160 3HD1 LEU 67 3HD1 LEU 67 12.334 1.590 -0.197 1161 1HD2 LEU 67 1HD2 LEU 67 13.645 3.183 -1.561 1162 2HD2 LEU 67 2HD2 LEU 67 13.585 2.334 -3.106 1163 3HD2 LEU 67 3HD2 LEU 67 15.139 2.647 -2.331 1164 H VAL 68 H VAL 68 14.297 -1.986 -0.785 1165 HA VAL 68 HA VAL 68 13.637 -2.807 1.871 1166 HB VAL 68 HB VAL 68 12.201 -3.074 -0.266 1167 1HG1 VAL 68 1HG1 VAL 68 13.781 -5.638 -0.418 1168 2HG1 VAL 68 2HG1 VAL 68 13.855 -4.316 -1.585 1169 3HG1 VAL 68 3HG1 VAL 68 12.358 -5.227 -1.376 1170 1HG2 VAL 68 1HG2 VAL 68 11.780 -5.594 0.947 1171 2HG2 VAL 68 2HG2 VAL 68 10.911 -4.084 1.222 1172 3HG2 VAL 68 3HG2 VAL 68 12.324 -4.480 2.200 1173 H ASP 69 H ASP 69 16.102 -3.598 -0.400 1174 HA ASP 69 HA ASP 69 16.973 -6.102 0.565 1175 1HB ASP 69 1HB ASP 69 17.863 -4.245 -1.333 1176 2HB ASP 69 2HB ASP 69 19.151 -4.297 -0.139 1177 H ASN 70 H ASN 70 18.124 -2.838 1.287 1178 HA ASN 70 HA ASN 70 19.883 -3.465 3.331 1179 1HB ASN 70 1HB ASN 70 19.706 -1.250 2.219 1180 2HB ASN 70 2HB ASN 70 18.214 -0.953 3.108 1181 1HD2 ASN 70 1HD2 ASN 70 21.563 -1.960 3.714 1182 2HD2 ASN 70 2HD2 ASN 70 21.768 -1.002 5.143 1183 H TRP 71 H TRP 71 16.563 -2.226 3.727 1184 HA TRP 71 HA TRP 71 16.473 -2.460 6.494 1185 1HB TRP 71 1HB TRP 71 14.849 -1.174 5.148 1186 2HB TRP 71 2HB TRP 71 14.149 -2.683 4.572 1187 HD1 TRP 71 HD1 TRP 71 14.265 -0.401 7.612 1188 HE1 TRP 71 HE1 TRP 71 12.462 -1.139 9.300 1189 HE3 TRP 71 HE3 TRP 71 12.817 -4.769 5.371 1190 HZ2 TRP 71 HZ2 TRP 71 10.668 -3.305 9.631 1191 HZ3 TRP 71 HZ3 TRP 71 11.041 -6.108 6.429 1192 HH2 TRP 71 HH2 TRP 71 9.987 -5.389 8.512 1193 H LEU 72 H LEU 72 15.094 -4.740 4.118 1194 HA LEU 72 HA LEU 72 13.975 -6.468 5.938 1195 1HB LEU 72 1HB LEU 72 14.048 -6.343 3.255 1196 2HB LEU 72 2HB LEU 72 15.090 -7.729 3.520 1197 HG LEU 72 HG LEU 72 12.724 -7.975 5.121 1198 1HD1 LEU 72 1HD1 LEU 72 11.497 -8.393 2.700 1199 2HD1 LEU 72 2HD1 LEU 72 12.353 -6.867 2.457 1200 3HD1 LEU 72 3HD1 LEU 72 11.207 -7.035 3.790 1201 1HD2 LEU 72 1HD2 LEU 72 12.735 -9.876 3.074 1202 2HD2 LEU 72 2HD2 LEU 72 13.375 -10.055 4.708 1203 3HD2 LEU 72 3HD2 LEU 72 14.433 -9.521 3.398 1204 H LYS 73 H LYS 73 17.261 -6.517 4.669 1205 HA LYS 73 HA LYS 73 17.760 -9.029 6.022 1206 1HB LYS 73 1HB LYS 73 19.740 -7.389 4.452 1207 2HB LYS 73 2HB LYS 73 19.791 -9.116 4.787 1208 1HG LYS 73 1HG LYS 73 17.686 -9.346 3.434 1209 2HG LYS 73 2HG LYS 73 17.886 -7.654 2.968 1210 1HD LYS 73 1HD LYS 73 19.884 -9.866 2.465 1211 2HD LYS 73 2HD LYS 73 18.769 -9.201 1.270 1212 1HE LYS 73 1HE LYS 73 19.835 -6.958 1.702 1213 2HE LYS 73 2HE LYS 73 21.067 -7.814 2.628 1214 1HZ LYS 73 1HZ LYS 73 20.645 -7.707 -0.245 1215 2HZ LYS 73 2HZ LYS 73 21.089 -9.223 0.376 1216 3HZ LYS 73 3HZ LYS 73 22.083 -7.874 0.638 1217 H GLU 74 H GLU 74 18.190 -5.696 6.704 1218 HA GLU 74 HA GLU 74 20.267 -6.267 8.680 1219 1HB GLU 74 1HB GLU 74 20.899 -4.099 8.549 1220 2HB GLU 74 2HB GLU 74 20.058 -4.179 7.010 1221 1HG GLU 74 1HG GLU 74 18.674 -2.578 7.643 1222 2HG GLU 74 2HG GLU 74 18.191 -3.507 9.062 1223 H ASN 75 H ASN 75 16.889 -5.342 8.489 1224 HA ASN 75 HA ASN 75 16.672 -4.608 11.239 1225 1HB ASN 75 1HB ASN 75 14.750 -3.712 10.549 1226 2HB ASN 75 2HB ASN 75 15.081 -4.348 8.943 1227 1HD2 ASN 75 1HD2 ASN 75 14.123 -6.331 8.317 1228 2HD2 ASN 75 2HD2 ASN 75 12.719 -6.931 9.127 1229 H GLU 76 H GLU 76 16.388 -7.599 9.520 1230 HA GLU 76 HA GLU 76 15.882 -8.983 12.026 1231 1HB GLU 76 1HB GLU 76 13.745 -8.455 10.448 1232 2HB GLU 76 2HB GLU 76 14.283 -9.974 9.745 1233 1HG GLU 76 1HG GLU 76 12.593 -10.367 11.421 1234 2HG GLU 76 2HG GLU 76 14.137 -11.042 11.938 Start of MODEL 10 1 1H MET 1 1H MET 1 25.530 86.292 10.212 2 2H MET 1 2H MET 1 25.810 86.350 11.885 3 3H MET 1 3H MET 1 24.975 87.614 11.122 4 HA MET 1 HA MET 1 23.141 86.169 10.611 5 1HB MET 1 1HB MET 1 25.149 84.187 11.413 6 2HB MET 1 2HB MET 1 23.568 83.900 12.125 7 1HG MET 1 1HG MET 1 22.873 82.992 10.239 8 2HG MET 1 2HG MET 1 23.194 84.500 9.380 9 1HE MET 1 1HE MET 1 23.469 81.969 7.538 10 2HE MET 1 2HE MET 1 23.493 81.070 9.055 11 3HE MET 1 3HE MET 1 24.818 80.893 7.907 12 H SER 2 H SER 2 21.454 85.683 12.198 13 HA SER 2 HA SER 2 21.792 87.309 14.557 14 1HB SER 2 1HB SER 2 19.291 85.778 14.299 15 2HB SER 2 2HB SER 2 19.538 87.511 14.508 16 HG SER 2 HG SER 2 19.213 87.743 12.458 17 H LEU 3 H LEU 3 23.209 86.201 15.860 18 HA LEU 3 HA LEU 3 23.772 84.905 17.631 19 1HB LEU 3 1HB LEU 3 21.059 83.610 17.377 20 2HB LEU 3 2HB LEU 3 22.153 83.481 18.741 21 HG LEU 3 HG LEU 3 21.211 86.194 17.932 22 1HD1 LEU 3 1HD1 LEU 3 19.144 86.006 18.991 23 2HD1 LEU 3 2HD1 LEU 3 19.566 84.474 19.752 24 3HD1 LEU 3 3HD1 LEU 3 19.252 84.540 18.019 25 1HD2 LEU 3 1HD2 LEU 3 22.720 85.100 20.026 26 2HD2 LEU 3 2HD2 LEU 3 21.175 85.569 20.733 27 3HD2 LEU 3 3HD2 LEU 3 22.146 86.760 19.867 28 H GLU 4 H GLU 4 21.977 83.014 15.210 29 HA GLU 4 HA GLU 4 22.531 81.177 13.995 30 1HB GLU 4 1HB GLU 4 25.124 82.200 14.729 31 2HB GLU 4 2HB GLU 4 25.139 80.442 14.766 32 1HG GLU 4 1HG GLU 4 24.293 82.155 12.438 33 2HG GLU 4 2HG GLU 4 25.824 81.297 12.595 34 H LYS 5 H LYS 5 22.083 81.373 17.119 35 HA LYS 5 HA LYS 5 21.935 78.482 17.430 36 1HB LYS 5 1HB LYS 5 23.545 80.320 19.156 37 2HB LYS 5 2HB LYS 5 22.721 78.963 19.910 38 1HG LYS 5 1HG LYS 5 24.092 77.426 18.970 39 2HG LYS 5 2HG LYS 5 24.335 78.376 17.501 40 1HD LYS 5 1HD LYS 5 25.461 79.295 20.120 41 2HD LYS 5 2HD LYS 5 26.308 78.085 19.153 42 1HE LYS 5 1HE LYS 5 27.177 79.723 17.929 43 2HE LYS 5 2HE LYS 5 25.553 80.149 17.391 44 1HZ LYS 5 1HZ LYS 5 26.992 81.923 18.529 45 2HZ LYS 5 2HZ LYS 5 26.573 81.137 19.975 46 3HZ LYS 5 3HZ LYS 5 25.361 81.790 18.987 47 H ALA 6 H ALA 6 20.139 80.883 17.066 48 HA ALA 6 HA ALA 6 18.730 81.286 19.505 49 1HB ALA 6 1HB ALA 6 17.297 82.619 18.296 50 2HB ALA 6 2HB ALA 6 17.409 81.616 16.851 51 3HB ALA 6 3HB ALA 6 18.743 82.681 17.291 52 H HIS 7 H HIS 7 18.351 79.114 16.761 53 HA HIS 7 HA HIS 7 16.095 77.782 18.085 54 1HB HIS 7 1HB HIS 7 16.545 78.400 15.426 55 2HB HIS 7 2HB HIS 7 16.973 76.690 15.513 56 HD1 HIS 7 HD1 HIS 7 14.392 78.101 14.128 57 HD2 HIS 7 HD2 HIS 7 14.501 75.901 17.662 58 HE1 HIS 7 HE1 HIS 7 12.054 77.225 14.460 59 HE2 HIS 7 HE2 HIS 7 12.122 75.964 16.643 60 H THR 8 H THR 8 18.200 77.353 19.580 61 HA THR 8 HA THR 8 19.810 75.135 18.722 62 HB THR 8 HB THR 8 20.053 75.269 21.478 63 HG1 THR 8 HG1 THR 8 20.062 77.968 20.668 64 1HG2 THR 8 1HG2 THR 8 22.086 76.705 20.906 65 2HG2 THR 8 2HG2 THR 8 21.542 76.610 19.231 66 3HG2 THR 8 3HG2 THR 8 21.965 75.138 20.106 67 H SER 9 H SER 9 19.762 73.018 19.596 68 HA SER 9 HA SER 9 17.131 72.016 20.106 69 1HB SER 9 1HB SER 9 19.469 70.266 20.591 70 2HB SER 9 2HB SER 9 18.033 69.982 19.612 71 HG SER 9 HG SER 9 18.928 71.335 18.002 72 H VAL 10 H VAL 10 16.370 72.787 22.062 73 HA VAL 10 HA VAL 10 18.001 72.192 24.443 74 HB VAL 10 HB VAL 10 15.706 74.144 24.155 75 1HG1 VAL 10 1HG1 VAL 10 15.966 74.721 26.381 76 2HG1 VAL 10 2HG1 VAL 10 17.586 74.031 26.479 77 3HG1 VAL 10 3HG1 VAL 10 16.177 72.971 26.424 78 1HG2 VAL 10 1HG2 VAL 10 17.504 75.845 24.510 79 2HG2 VAL 10 2HG2 VAL 10 17.614 74.978 22.978 80 3HG2 VAL 10 3HG2 VAL 10 18.688 74.554 24.310 81 H LYS 11 H LYS 11 17.474 70.304 25.254 82 HA LYS 11 HA LYS 11 16.314 68.573 26.137 83 1HB LYS 11 1HB LYS 11 14.012 70.531 26.238 84 2HB LYS 11 2HB LYS 11 14.047 68.964 27.033 85 1HG LYS 11 1HG LYS 11 15.396 69.685 28.699 86 2HG LYS 11 2HG LYS 11 16.260 70.820 27.661 87 1HD LYS 11 1HD LYS 11 15.056 72.444 28.595 88 2HD LYS 11 2HD LYS 11 13.654 71.785 27.751 89 1HE LYS 11 1HE LYS 11 12.941 70.587 29.617 90 2HE LYS 11 2HE LYS 11 14.518 70.673 30.398 91 1HZ LYS 11 1HZ LYS 11 14.015 72.618 31.337 92 2HZ LYS 11 2HZ LYS 11 12.402 72.281 30.933 93 3HZ LYS 11 3HZ LYS 11 13.344 73.252 29.914 94 H LYS 12 H LYS 12 16.269 69.321 23.226 95 HA LYS 12 HA LYS 12 14.518 67.227 22.330 96 1HB LYS 12 1HB LYS 12 13.440 69.806 22.482 97 2HB LYS 12 2HB LYS 12 13.869 69.603 20.789 98 1HG LYS 12 1HG LYS 12 11.845 68.670 20.625 99 2HG LYS 12 2HG LYS 12 12.637 67.242 21.298 100 1HD LYS 12 1HD LYS 12 11.993 68.749 23.524 101 2HD LYS 12 2HD LYS 12 10.607 68.970 22.455 102 1HE LYS 12 1HE LYS 12 9.900 67.034 23.345 103 2HE LYS 12 2HE LYS 12 11.038 66.304 22.213 104 1HZ LYS 12 1HZ LYS 12 11.074 65.778 24.784 105 2HZ LYS 12 2HZ LYS 12 12.085 67.136 24.808 106 3HZ LYS 12 3HZ LYS 12 12.490 65.796 23.853 107 H MET 13 H MET 13 16.388 66.328 21.451 108 HA MET 13 HA MET 13 17.650 67.881 19.283 109 1HB MET 13 1HB MET 13 19.071 67.100 21.257 110 2HB MET 13 2HB MET 13 18.847 65.470 20.637 111 1HG MET 13 1HG MET 13 19.832 67.545 18.764 112 2HG MET 13 2HG MET 13 20.940 66.943 19.996 113 1HE MET 13 1HE MET 13 22.753 65.523 18.371 114 2HE MET 13 2HE MET 13 21.945 66.763 17.416 115 3HE MET 13 3HE MET 13 22.120 65.129 16.773 116 H THR 14 H THR 14 16.690 64.593 20.220 117 HA THR 14 HA THR 14 16.151 64.058 17.376 118 HB THR 14 HB THR 14 16.654 61.681 18.971 119 HG1 THR 14 HG1 THR 14 18.770 63.553 18.550 120 1HG2 THR 14 1HG2 THR 14 17.967 61.047 17.040 121 2HG2 THR 14 2HG2 THR 14 17.915 62.702 16.428 122 3HG2 THR 14 3HG2 THR 14 16.436 61.745 16.512 123 H PHE 15 H PHE 15 14.169 63.285 16.912 124 HA PHE 15 HA PHE 15 12.381 62.867 19.217 125 1HB PHE 15 1HB PHE 15 11.263 63.661 16.574 126 2HB PHE 15 2HB PHE 15 10.763 64.136 18.195 127 HD1 PHE 15 HD1 PHE 15 12.030 65.894 19.409 128 HD2 PHE 15 HD2 PHE 15 12.785 64.974 15.323 129 HE1 PHE 15 HE1 PHE 15 13.179 68.051 19.140 130 HE2 PHE 15 HE2 PHE 15 13.935 67.131 15.049 131 HZ PHE 15 HZ PHE 15 14.198 68.639 16.974 132 H GLY 16 H GLY 16 13.489 61.573 16.210 133 1HA GLY 16 1HA GLY 16 13.289 59.139 15.955 134 2HA GLY 16 2HA GLY 16 11.654 59.285 16.584 135 H GLU 17 H GLU 17 13.699 60.472 13.940 136 HA GLU 17 HA GLU 17 11.349 60.278 12.167 137 1HB GLU 17 1HB GLU 17 13.694 62.170 11.897 138 2HB GLU 17 2HB GLU 17 12.294 62.093 10.837 139 1HG GLU 17 1HG GLU 17 10.939 63.173 12.311 140 2HG GLU 17 2HG GLU 17 11.810 62.569 13.721 141 H ASN 18 H ASN 18 13.506 58.346 12.941 142 HA ASN 18 HA ASN 18 15.097 58.048 10.539 143 1HB ASN 18 1HB ASN 18 15.434 57.285 13.186 144 2HB ASN 18 2HB ASN 18 15.091 55.767 12.361 145 1HD2 ASN 18 1HD2 ASN 18 17.405 55.586 13.272 146 2HD2 ASN 18 2HD2 ASN 18 18.672 55.984 12.156 147 H ARG 19 H ARG 19 12.542 56.280 12.222 148 HA ARG 19 HA ARG 19 10.917 54.866 11.526 149 1HB ARG 19 1HB ARG 19 10.976 56.774 9.613 150 2HB ARG 19 2HB ARG 19 11.323 55.352 8.638 151 1HG ARG 19 1HG ARG 19 9.070 55.294 8.502 152 2HG ARG 19 2HG ARG 19 9.247 54.407 10.017 153 1HD ARG 19 1HD ARG 19 8.846 57.388 9.875 154 2HD ARG 19 2HD ARG 19 7.520 56.236 10.022 155 HE ARG 19 HE ARG 19 8.491 55.538 12.161 156 1HH1 ARG 19 1HH1 ARG 19 9.491 58.628 10.820 157 2HH1 ARG 19 2HH1 ARG 19 9.993 59.267 12.360 158 1HH2 ARG 19 1HH2 ARG 19 9.176 56.379 14.173 159 2HH2 ARG 19 2HH2 ARG 19 9.836 57.984 14.256 160 H ASP 20 H ASP 20 11.255 52.778 11.739 161 HA ASP 20 HA ASP 20 13.114 51.447 9.874 162 1HB ASP 20 1HB ASP 20 13.508 51.380 12.470 163 2HB ASP 20 2HB ASP 20 12.214 50.187 12.448 164 H LEU 21 H LEU 21 10.972 51.810 8.607 165 HA LEU 21 HA LEU 21 9.039 49.687 9.183 166 1HB LEU 21 1HB LEU 21 8.850 52.349 8.130 167 2HB LEU 21 2HB LEU 21 8.208 51.212 6.959 168 HG LEU 21 HG LEU 21 6.715 50.300 8.731 169 1HD1 LEU 21 1HD1 LEU 21 8.379 51.753 10.439 170 2HD1 LEU 21 2HD1 LEU 21 6.914 50.866 10.859 171 3HD1 LEU 21 3HD1 LEU 21 6.822 52.584 10.468 172 1HD2 LEU 21 1HD2 LEU 21 6.000 52.032 7.100 173 2HD2 LEU 21 2HD2 LEU 21 6.392 53.264 8.300 174 3HD2 LEU 21 3HD2 LEU 21 5.124 52.084 8.628 175 H GLU 22 H GLU 22 9.994 47.871 8.414 176 HA GLU 22 HA GLU 22 10.381 47.759 5.504 177 1HB GLU 22 1HB GLU 22 12.348 47.272 7.576 178 2HB GLU 22 2HB GLU 22 12.100 45.834 6.594 179 1HG GLU 22 1HG GLU 22 13.673 46.783 5.307 180 2HG GLU 22 2HG GLU 22 12.298 47.673 4.657 181 H ARG 23 H ARG 23 8.840 46.478 4.748 182 HA ARG 23 HA ARG 23 7.813 44.322 6.441 183 1HB ARG 23 1HB ARG 23 6.734 45.913 4.165 184 2HB ARG 23 2HB ARG 23 6.131 44.276 4.375 185 1HG ARG 23 1HG ARG 23 6.132 46.317 6.580 186 2HG ARG 23 2HG ARG 23 4.783 46.096 5.462 187 1HD ARG 23 1HD ARG 23 5.035 43.579 6.186 188 2HD ARG 23 2HD ARG 23 5.796 44.295 7.607 189 HE ARG 23 HE ARG 23 3.011 44.709 6.743 190 1HH1 ARG 23 1HH1 ARG 23 5.516 45.011 9.180 191 2HH1 ARG 23 2HH1 ARG 23 4.393 45.383 10.460 192 1HH2 ARG 23 1HH2 ARG 23 1.548 45.227 8.406 193 2HH2 ARG 23 2HH2 ARG 23 2.133 45.450 10.030 194 H VAL 24 H VAL 24 8.496 42.328 6.140 195 HA VAL 24 HA VAL 24 9.853 41.624 3.648 196 HB VAL 24 HB VAL 24 9.598 39.951 6.149 197 1HG1 VAL 24 1HG1 VAL 24 11.741 38.964 5.189 198 2HG1 VAL 24 2HG1 VAL 24 11.317 39.792 3.690 199 3HG1 VAL 24 3HG1 VAL 24 10.236 38.570 4.357 200 1HG2 VAL 24 1HG2 VAL 24 11.596 40.837 6.976 201 2HG2 VAL 24 2HG2 VAL 24 10.710 42.254 6.414 202 3HG2 VAL 24 3HG2 VAL 24 12.013 41.583 5.434 203 H VAL 25 H VAL 25 8.551 40.901 2.082 204 HA VAL 25 HA VAL 25 6.107 39.468 2.765 205 HB VAL 25 HB VAL 25 7.170 40.312 0.061 206 1HG1 VAL 25 1HG1 VAL 25 4.450 39.983 -0.164 207 2HG1 VAL 25 2HG1 VAL 25 4.930 38.628 0.856 208 3HG1 VAL 25 3HG1 VAL 25 5.677 38.849 -0.726 209 1HG2 VAL 25 1HG2 VAL 25 6.337 42.333 0.449 210 2HG2 VAL 25 2HG2 VAL 25 6.018 41.847 2.114 211 3HG2 VAL 25 3HG2 VAL 25 4.772 41.647 0.884 212 H THR 26 H THR 26 6.130 37.347 3.002 213 HA THR 26 HA THR 26 7.960 35.746 1.329 214 HB THR 26 HB THR 26 6.996 34.617 3.909 215 HG1 THR 26 HG1 THR 26 7.665 36.527 4.763 216 1HG2 THR 26 1HG2 THR 26 9.803 34.576 2.870 217 2HG2 THR 26 2HG2 THR 26 8.567 33.571 2.117 218 3HG2 THR 26 3HG2 THR 26 8.944 33.367 3.826 219 H ALA 27 H ALA 27 7.058 34.078 0.209 220 HA ALA 27 HA ALA 27 4.337 33.226 0.846 221 1HB ALA 27 1HB ALA 27 4.850 35.152 -1.136 222 2HB ALA 27 2HB ALA 27 3.337 34.305 -0.814 223 3HB ALA 27 3HB ALA 27 4.484 33.649 -1.982 224 HA PRO 28 HA PRO 28 6.846 29.696 -0.596 225 1HB PRO 28 1HB PRO 28 6.106 27.969 1.323 226 2HB PRO 28 2HB PRO 28 7.320 29.219 1.611 227 1HG PRO 28 1HG PRO 28 4.457 29.131 2.433 228 2HG PRO 28 2HG PRO 28 5.858 29.775 3.305 229 1HD PRO 28 1HD PRO 28 4.018 31.282 1.856 230 2HD PRO 28 2HD PRO 28 5.638 31.821 2.343 231 H VAL 29 H VAL 29 6.061 28.613 -2.283 232 HA VAL 29 HA VAL 29 3.241 27.840 -2.347 233 HB VAL 29 HB VAL 29 5.209 27.341 -4.568 234 1HG1 VAL 29 1HG1 VAL 29 3.076 27.764 -5.900 235 2HG1 VAL 29 2HG1 VAL 29 2.231 27.631 -4.358 236 3HG1 VAL 29 3HG1 VAL 29 3.166 26.269 -4.971 237 1HG2 VAL 29 1HG2 VAL 29 3.686 29.894 -4.069 238 2HG2 VAL 29 2HG2 VAL 29 4.603 29.513 -5.526 239 3HG2 VAL 29 3HG2 VAL 29 5.435 29.695 -3.982 240 H SER 30 H SER 30 3.158 26.147 -0.929 241 HA SER 30 HA SER 30 5.072 23.999 -1.089 242 1HB SER 30 1HB SER 30 2.605 23.899 0.618 243 2HB SER 30 2HB SER 30 4.229 23.305 0.967 244 HG SER 30 HG SER 30 4.919 25.446 1.216 245 H SER 31 H SER 31 4.884 22.433 -2.531 246 HA SER 31 HA SER 31 2.336 21.777 -3.725 247 1HB SER 31 1HB SER 31 4.686 20.065 -4.273 248 2HB SER 31 2HB SER 31 3.554 20.824 -5.395 249 HG SER 31 HG SER 31 4.636 22.811 -5.032 250 H GLY 32 H GLY 32 1.017 20.225 -3.043 251 1HA GLY 32 1HA GLY 32 2.134 18.136 -1.269 252 2HA GLY 32 2HA GLY 32 0.567 18.885 -0.983 253 H LYS 33 H LYS 33 2.371 17.020 -3.407 254 HA LYS 33 HA LYS 33 -0.192 15.813 -4.219 255 1HB LYS 33 1HB LYS 33 1.606 17.270 -5.778 256 2HB LYS 33 2HB LYS 33 1.923 15.593 -6.196 257 1HG LYS 33 1HG LYS 33 0.277 16.620 -7.678 258 2HG LYS 33 2HG LYS 33 -0.406 15.268 -6.775 259 1HD LYS 33 1HD LYS 33 -1.225 17.027 -5.111 260 2HD LYS 33 2HD LYS 33 -0.841 18.211 -6.362 261 1HE LYS 33 1HE LYS 33 -3.062 17.788 -6.794 262 2HE LYS 33 2HE LYS 33 -2.267 16.654 -7.885 263 1HZ LYS 33 1HZ LYS 33 -2.789 15.595 -5.251 264 2HZ LYS 33 2HZ LYS 33 -3.071 14.907 -6.774 265 3HZ LYS 33 3HZ LYS 33 -4.190 16.000 -6.119 266 H ILE 34 H ILE 34 -0.354 13.716 -3.868 267 HA ILE 34 HA ILE 34 2.111 12.176 -3.376 268 HB ILE 34 HB ILE 34 -0.695 11.359 -2.610 269 1HG1 ILE 34 1HG1 ILE 34 1.012 12.199 -0.409 270 2HG1 ILE 34 2HG1 ILE 34 0.707 13.513 -1.537 271 1HG2 ILE 34 1HG2 ILE 34 1.630 9.905 -2.698 272 2HG2 ILE 34 2HG2 ILE 34 0.207 9.518 -1.729 273 3HG2 ILE 34 3HG2 ILE 34 1.548 10.410 -1.009 274 1HD1 ILE 34 1HD1 ILE 34 -0.888 13.194 0.443 275 2HD1 ILE 34 2HD1 ILE 34 -1.539 11.843 -0.486 276 3HD1 ILE 34 3HD1 ILE 34 -1.579 13.476 -1.155 277 H LYS 35 H LYS 35 2.608 10.479 -4.627 278 HA LYS 35 HA LYS 35 0.800 9.864 -6.865 279 1HB LYS 35 1HB LYS 35 3.765 9.948 -6.525 280 2HB LYS 35 2HB LYS 35 3.096 8.814 -7.693 281 1HG LYS 35 1HG LYS 35 1.862 11.351 -8.068 282 2HG LYS 35 2HG LYS 35 3.613 11.564 -8.016 283 1HD LYS 35 1HD LYS 35 3.839 10.677 -10.047 284 2HD LYS 35 2HD LYS 35 2.924 9.243 -9.573 285 1HE LYS 35 1HE LYS 35 1.422 9.965 -11.070 286 2HE LYS 35 2HE LYS 35 0.950 11.099 -9.808 287 1HZ LYS 35 1HZ LYS 35 1.802 12.824 -10.926 288 2HZ LYS 35 2HZ LYS 35 1.690 11.805 -12.280 289 3HZ LYS 35 3HZ LYS 35 3.164 11.964 -11.460 290 H ARG 36 H ARG 36 0.304 7.730 -7.352 291 HA ARG 36 HA ARG 36 0.920 5.810 -5.213 292 1HB ARG 36 1HB ARG 36 -1.019 4.503 -6.278 293 2HB ARG 36 2HB ARG 36 -1.413 5.963 -5.383 294 1HG ARG 36 1HG ARG 36 -1.819 7.185 -7.347 295 2HG ARG 36 2HG ARG 36 -1.051 5.961 -8.359 296 1HD ARG 36 1HD ARG 36 -3.113 4.663 -6.943 297 2HD ARG 36 2HD ARG 36 -3.788 6.178 -7.541 298 HE ARG 36 HE ARG 36 -2.814 3.938 -9.132 299 1HH1 ARG 36 1HH1 ARG 36 -4.173 7.165 -9.034 300 2HH1 ARG 36 2HH1 ARG 36 -4.488 7.212 -10.744 301 1HH2 ARG 36 1HH2 ARG 36 -3.265 3.984 -11.356 302 2HH2 ARG 36 2HH2 ARG 36 -3.985 5.407 -12.061 303 H VAL 37 H VAL 37 2.217 4.167 -5.576 304 HA VAL 37 HA VAL 37 2.785 3.383 -8.366 305 HB VAL 37 HB VAL 37 4.844 3.466 -6.152 306 1HG1 VAL 37 1HG1 VAL 37 5.426 1.865 -7.817 307 2HG1 VAL 37 2HG1 VAL 37 6.431 3.292 -8.079 308 3HG1 VAL 37 3HG1 VAL 37 5.038 2.989 -9.119 309 1HG2 VAL 37 1HG2 VAL 37 5.043 5.369 -8.402 310 2HG2 VAL 37 2HG2 VAL 37 5.487 5.563 -6.705 311 3HG2 VAL 37 3HG2 VAL 37 3.799 5.705 -7.197 312 H ASN 38 H ASN 38 3.002 1.212 -8.751 313 HA ASN 38 HA ASN 38 2.461 -0.576 -6.474 314 1HB ASN 38 1HB ASN 38 0.797 -0.580 -8.371 315 2HB ASN 38 2HB ASN 38 2.080 -1.200 -9.412 316 1HD2 ASN 38 1HD2 ASN 38 -0.411 -1.994 -7.338 317 2HD2 ASN 38 2HD2 ASN 38 -0.045 -3.673 -7.113 318 H VAL 39 H VAL 39 4.095 -1.814 -5.811 319 HA VAL 39 HA VAL 39 6.319 -2.292 -7.692 320 HB VAL 39 HB VAL 39 7.828 -2.366 -5.732 321 1HG1 VAL 39 1HG1 VAL 39 6.272 0.126 -6.328 322 2HG1 VAL 39 2HG1 VAL 39 7.897 -0.324 -6.849 323 3HG1 VAL 39 3HG1 VAL 39 7.604 0.139 -5.171 324 1HG2 VAL 39 1HG2 VAL 39 5.557 -2.651 -4.241 325 2HG2 VAL 39 2HG2 VAL 39 5.979 -0.963 -3.949 326 3HG2 VAL 39 3HG2 VAL 39 7.149 -2.237 -3.599 327 H ASN 40 H ASN 40 7.636 -4.251 -7.099 328 HA ASN 40 HA ASN 40 5.931 -6.351 -5.958 329 1HB ASN 40 1HB ASN 40 6.558 -7.905 -7.656 330 2HB ASN 40 2HB ASN 40 6.021 -6.448 -8.471 331 1HD2 ASN 40 1HD2 ASN 40 7.427 -5.329 -9.742 332 2HD2 ASN 40 2HD2 ASN 40 9.041 -5.866 -10.089 333 H PHE 41 H PHE 41 6.880 -7.750 -4.600 334 HA PHE 41 HA PHE 41 9.767 -7.387 -4.100 335 1HB PHE 41 1HB PHE 41 7.536 -7.980 -2.136 336 2HB PHE 41 2HB PHE 41 9.242 -8.070 -1.729 337 HD1 PHE 41 HD1 PHE 41 7.147 -6.350 -0.382 338 HD2 PHE 41 HD2 PHE 41 9.843 -5.586 -3.581 339 HE1 PHE 41 HE1 PHE 41 7.136 -3.957 0.182 340 HE2 PHE 41 HE2 PHE 41 9.838 -3.191 -3.022 341 HZ PHE 41 HZ PHE 41 8.412 -2.385 -1.116 342 H ASP 42 H ASP 42 10.856 -9.268 -3.193 343 HA ASP 42 HA ASP 42 10.120 -11.692 -4.560 344 1HB ASP 42 1HB ASP 42 12.400 -11.489 -4.579 345 2HB ASP 42 2HB ASP 42 12.461 -10.699 -3.011 346 H GLU 43 H GLU 43 10.005 -13.777 -3.404 347 HA GLU 43 HA GLU 43 7.881 -13.799 -1.632 348 1HB GLU 43 1HB GLU 43 9.833 -15.805 -2.583 349 2HB GLU 43 2HB GLU 43 8.984 -16.203 -1.095 350 1HG GLU 43 1HG GLU 43 7.275 -15.194 -3.252 351 2HG GLU 43 2HG GLU 43 8.071 -16.733 -3.586 352 H GLU 44 H GLU 44 11.314 -14.385 -0.846 353 HA GLU 44 HA GLU 44 11.026 -14.622 1.937 354 1HB GLU 44 1HB GLU 44 13.145 -14.584 0.107 355 2HB GLU 44 2HB GLU 44 13.463 -13.234 1.191 356 1HG GLU 44 1HG GLU 44 12.809 -15.963 2.244 357 2HG GLU 44 2HG GLU 44 14.450 -15.523 1.773 358 H LYS 45 H LYS 45 11.513 -11.815 -0.133 359 HA LYS 45 HA LYS 45 11.860 -9.919 1.903 360 1HB LYS 45 1HB LYS 45 10.667 -9.435 -0.834 361 2HB LYS 45 2HB LYS 45 11.428 -8.240 0.208 362 1HG LYS 45 1HG LYS 45 13.242 -10.404 -0.232 363 2HG LYS 45 2HG LYS 45 12.628 -9.818 -1.779 364 1HD LYS 45 1HD LYS 45 13.874 -7.973 -1.645 365 2HD LYS 45 2HD LYS 45 13.269 -7.618 -0.026 366 1HE LYS 45 1HE LYS 45 15.529 -7.874 0.360 367 2HE LYS 45 2HE LYS 45 14.918 -9.490 0.710 368 1HZ LYS 45 1HZ LYS 45 15.659 -9.078 -2.048 369 2HZ LYS 45 2HZ LYS 45 16.029 -10.359 -1.004 370 3HZ LYS 45 3HZ LYS 45 16.956 -8.937 -0.961 371 H HIS 46 H HIS 46 8.965 -11.361 0.568 372 HA HIS 46 HA HIS 46 7.287 -9.378 1.873 373 1HB HIS 46 1HB HIS 46 6.820 -10.638 -0.389 374 2HB HIS 46 2HB HIS 46 6.135 -11.857 0.685 375 HD1 HIS 46 HD1 HIS 46 3.760 -11.515 1.315 376 HD2 HIS 46 HD2 HIS 46 5.595 -7.966 0.113 377 HE1 HIS 46 HE1 HIS 46 1.969 -9.753 1.399 378 HE2 HIS 46 HE2 HIS 46 3.055 -7.648 0.540 379 H THR 47 H THR 47 8.120 -12.805 2.290 380 HA THR 47 HA THR 47 6.345 -13.291 4.438 381 HB THR 47 HB THR 47 9.041 -14.615 4.181 382 HG1 THR 47 HG1 THR 47 8.013 -16.033 2.669 383 1HG2 THR 47 1HG2 THR 47 8.180 -15.864 5.829 384 2HG2 THR 47 2HG2 THR 47 6.995 -16.462 4.670 385 3HG2 THR 47 3HG2 THR 47 6.613 -15.071 5.683 386 H ARG 48 H ARG 48 9.624 -12.041 4.249 387 HA ARG 48 HA ARG 48 10.029 -11.790 7.065 388 1HB ARG 48 1HB ARG 48 11.715 -11.704 5.021 389 2HB ARG 48 2HB ARG 48 11.385 -9.979 5.129 390 1HG ARG 48 1HG ARG 48 13.335 -10.437 6.407 391 2HG ARG 48 2HG ARG 48 12.023 -10.071 7.530 392 1HD ARG 48 1HD ARG 48 13.100 -11.939 8.442 393 2HD ARG 48 2HD ARG 48 11.654 -12.583 7.664 394 HE ARG 48 HE ARG 48 13.185 -13.146 5.746 395 1HH1 ARG 48 1HH1 ARG 48 14.296 -13.017 9.068 396 2HH1 ARG 48 2HH1 ARG 48 15.732 -13.947 8.745 397 1HH2 ARG 48 1HH2 ARG 48 15.037 -14.376 5.326 398 2HH2 ARG 48 2HH2 ARG 48 16.126 -14.765 6.627 399 H PHE 49 H PHE 49 8.843 -9.690 4.505 400 HA PHE 49 HA PHE 49 8.690 -7.252 5.783 401 1HB PHE 49 1HB PHE 49 7.769 -8.331 3.401 402 2HB PHE 49 2HB PHE 49 6.291 -7.856 4.228 403 HD1 PHE 49 HD1 PHE 49 5.485 -5.843 3.563 404 HD2 PHE 49 HD2 PHE 49 9.698 -6.392 3.797 405 HE1 PHE 49 HE1 PHE 49 5.827 -3.523 2.827 406 HE2 PHE 49 HE2 PHE 49 10.044 -4.071 3.067 407 HZ PHE 49 HZ PHE 49 8.107 -2.630 2.588 408 H LYS 50 H LYS 50 6.102 -9.690 5.599 409 HA LYS 50 HA LYS 50 4.348 -8.378 7.350 410 1HB LYS 50 1HB LYS 50 4.423 -11.363 6.968 411 2HB LYS 50 2HB LYS 50 3.030 -10.346 7.302 412 1HG LYS 50 1HG LYS 50 4.147 -9.418 4.892 413 2HG LYS 50 2HG LYS 50 4.090 -11.178 4.789 414 1HD LYS 50 1HD LYS 50 1.827 -9.252 5.248 415 2HD LYS 50 2HD LYS 50 2.022 -10.423 3.944 416 1HE LYS 50 1HE LYS 50 1.834 -11.347 6.788 417 2HE LYS 50 2HE LYS 50 0.375 -10.925 5.894 418 1HZ LYS 50 1HZ LYS 50 0.759 -12.618 4.342 419 2HZ LYS 50 2HZ LYS 50 1.074 -13.330 5.849 420 3HZ LYS 50 3HZ LYS 50 2.362 -12.861 4.850 421 H ALA 51 H ALA 51 6.728 -10.937 7.945 422 HA ALA 51 HA ALA 51 6.015 -11.427 10.619 423 1HB ALA 51 1HB ALA 51 7.776 -12.884 10.677 424 2HB ALA 51 2HB ALA 51 8.828 -11.828 9.734 425 3HB ALA 51 3HB ALA 51 7.547 -12.741 8.933 426 H ALA 52 H ALA 52 8.720 -9.517 9.307 427 HA ALA 52 HA ALA 52 9.700 -8.658 11.798 428 1HB ALA 52 1HB ALA 52 10.820 -8.625 9.493 429 2HB ALA 52 2HB ALA 52 11.164 -7.305 10.613 430 3HB ALA 52 3HB ALA 52 10.026 -7.064 9.287 431 H CYS 53 H CYS 53 7.478 -7.097 9.490 432 HA CYS 53 HA CYS 53 7.207 -4.703 10.956 433 1HB CYS 53 1HB CYS 53 5.838 -4.044 9.287 434 2HB CYS 53 2HB CYS 53 6.444 -5.487 8.484 435 HG CYS 53 HG CYS 53 3.375 -4.696 9.257 436 H ALA 54 H ALA 54 5.648 -7.817 11.236 437 HA ALA 54 HA ALA 54 3.493 -6.917 12.895 438 1HB ALA 54 1HB ALA 54 3.278 -8.990 11.663 439 2HB ALA 54 2HB ALA 54 3.167 -9.310 13.395 440 3HB ALA 54 3HB ALA 54 4.656 -9.674 12.524 441 H ARG 55 H ARG 55 6.776 -8.001 13.404 442 HA ARG 55 HA ARG 55 6.584 -8.361 16.222 443 1HB ARG 55 1HB ARG 55 8.674 -8.406 14.181 444 2HB ARG 55 2HB ARG 55 9.231 -7.721 15.703 445 1HG ARG 55 1HG ARG 55 7.680 -10.196 15.952 446 2HG ARG 55 2HG ARG 55 9.219 -10.360 15.106 447 1HD ARG 55 1HD ARG 55 8.834 -9.139 17.841 448 2HD ARG 55 2HD ARG 55 9.438 -10.762 17.522 449 HE ARG 55 HE ARG 55 10.846 -8.246 16.930 450 1HH1 ARG 55 1HH1 ARG 55 10.859 -11.733 17.288 451 2HH1 ARG 55 2HH1 ARG 55 12.596 -11.854 17.272 452 1HH2 ARG 55 1HH2 ARG 55 13.132 -8.405 16.872 453 2HH2 ARG 55 2HH2 ARG 55 13.883 -9.972 17.021 454 H LYS 56 H LYS 56 7.012 -5.610 14.161 455 HA LYS 56 HA LYS 56 7.861 -3.965 16.423 456 1HB LYS 56 1HB LYS 56 7.847 -3.363 13.465 457 2HB LYS 56 2HB LYS 56 8.457 -2.288 14.717 458 1HG LYS 56 1HG LYS 56 10.175 -3.882 15.304 459 2HG LYS 56 2HG LYS 56 9.532 -5.040 14.137 460 1HD LYS 56 1HD LYS 56 9.973 -2.585 12.783 461 2HD LYS 56 2HD LYS 56 11.423 -2.960 13.719 462 1HE LYS 56 1HE LYS 56 10.108 -5.084 12.083 463 2HE LYS 56 2HE LYS 56 11.149 -3.895 11.302 464 1HZ LYS 56 1HZ LYS 56 12.535 -5.681 11.826 465 2HZ LYS 56 2HZ LYS 56 11.871 -5.887 13.370 466 3HZ LYS 56 3HZ LYS 56 12.855 -4.543 13.040 467 H GLY 57 H GLY 57 5.167 -4.451 14.297 468 1HA GLY 57 1HA GLY 57 2.978 -3.682 14.763 469 2HA GLY 57 2HA GLY 57 3.662 -2.423 15.782 470 H THR 58 H THR 58 4.597 -3.271 12.500 471 HA THR 58 HA THR 58 4.004 -0.512 11.692 472 HB THR 58 HB THR 58 5.682 -2.335 10.029 473 HG1 THR 58 HG1 THR 58 6.645 -1.001 12.372 474 1HG2 THR 58 1HG2 THR 58 5.010 0.258 9.768 475 2HG2 THR 58 2HG2 THR 58 6.517 -0.424 9.153 476 3HG2 THR 58 3HG2 THR 58 6.497 0.421 10.700 477 H SER 59 H SER 59 2.882 -0.059 9.825 478 HA SER 59 HA SER 59 1.142 -2.143 8.791 479 1HB SER 59 1HB SER 59 1.246 0.547 7.519 480 2HB SER 59 2HB SER 59 -0.150 -0.437 7.959 481 HG SER 59 HG SER 59 1.020 0.205 10.218 482 H ILE 60 H ILE 60 1.332 -3.130 6.840 483 HA ILE 60 HA ILE 60 3.746 -3.577 5.678 484 HB ILE 60 HB ILE 60 1.017 -3.686 4.405 485 1HG1 ILE 60 1HG1 ILE 60 1.375 -5.243 6.245 486 2HG1 ILE 60 2HG1 ILE 60 1.304 -6.116 4.718 487 1HG2 ILE 60 1HG2 ILE 60 3.568 -4.824 3.274 488 2HG2 ILE 60 2HG2 ILE 60 2.730 -3.398 2.658 489 3HG2 ILE 60 3HG2 ILE 60 1.949 -4.979 2.592 490 1HD1 ILE 60 1HD1 ILE 60 3.649 -5.601 6.493 491 2HD1 ILE 60 2HD1 ILE 60 3.878 -5.967 4.782 492 3HD1 ILE 60 3HD1 ILE 60 3.059 -7.127 5.829 493 H THR 61 H THR 61 1.348 -1.236 4.482 494 HA THR 61 HA THR 61 2.840 -0.280 2.319 495 HB THR 61 HB THR 61 1.098 1.669 3.694 496 HG1 THR 61 HG1 THR 61 -0.523 0.349 3.974 497 1HG2 THR 61 1HG2 THR 61 1.291 0.520 0.912 498 2HG2 THR 61 2HG2 THR 61 1.769 2.131 1.452 499 3HG2 THR 61 3HG2 THR 61 0.062 1.688 1.400 500 H ASP 62 H ASP 62 2.689 0.769 5.680 501 HA ASP 62 HA ASP 62 4.200 3.124 5.455 502 1HB ASP 62 1HB ASP 62 2.798 2.016 7.458 503 2HB ASP 62 2HB ASP 62 4.419 1.551 7.966 504 H VAL 63 H VAL 63 5.163 -0.231 6.022 505 HA VAL 63 HA VAL 63 7.853 0.212 6.659 506 HB VAL 63 HB VAL 63 6.953 -2.150 5.015 507 1HG1 VAL 63 1HG1 VAL 63 8.640 -3.129 6.842 508 2HG1 VAL 63 2HG1 VAL 63 9.257 -1.481 6.740 509 3HG1 VAL 63 3HG1 VAL 63 9.172 -2.483 5.292 510 1HG2 VAL 63 1HG2 VAL 63 6.178 -3.271 6.947 511 2HG2 VAL 63 2HG2 VAL 63 5.390 -1.695 6.944 512 3HG2 VAL 63 3HG2 VAL 63 6.762 -1.993 8.013 513 H VAL 64 H VAL 64 6.345 -0.397 3.490 514 HA VAL 64 HA VAL 64 8.650 -0.271 1.923 515 HB VAL 64 HB VAL 64 6.099 0.902 0.882 516 1HG1 VAL 64 1HG1 VAL 64 6.836 -0.634 -1.057 517 2HG1 VAL 64 2HG1 VAL 64 8.381 -0.703 -0.205 518 3HG1 VAL 64 3HG1 VAL 64 7.745 0.849 -0.756 519 1HG2 VAL 64 1HG2 VAL 64 5.485 -1.072 2.266 520 2HG2 VAL 64 2HG2 VAL 64 6.540 -2.056 1.252 521 3HG2 VAL 64 3HG2 VAL 64 5.129 -1.267 0.550 522 H ASN 65 H ASN 65 6.385 2.339 2.764 523 HA ASN 65 HA ASN 65 7.674 4.413 1.415 524 1HB ASN 65 1HB ASN 65 5.448 4.177 3.055 525 2HB ASN 65 2HB ASN 65 6.499 5.276 3.935 526 1HD2 ASN 65 1HD2 ASN 65 3.977 5.315 2.032 527 2HD2 ASN 65 2HD2 ASN 65 4.276 6.734 1.082 528 H GLN 66 H GLN 66 8.175 3.140 4.657 529 HA GLN 66 HA GLN 66 10.001 5.093 5.546 530 1HB GLN 66 1HB GLN 66 9.299 2.312 6.378 531 2HB GLN 66 2HB GLN 66 10.725 3.074 7.067 532 1HG GLN 66 1HG GLN 66 9.298 4.958 7.804 533 2HG GLN 66 2HG GLN 66 7.890 4.067 7.223 534 1HE2 GLN 66 1HE2 GLN 66 6.826 3.361 8.920 535 2HE2 GLN 66 2HE2 GLN 66 7.522 2.567 10.296 536 H LEU 67 H LEU 67 10.484 1.918 4.026 537 HA LEU 67 HA LEU 67 13.319 2.050 4.171 538 1HB LEU 67 1HB LEU 67 11.788 0.354 2.217 539 2HB LEU 67 2HB LEU 67 13.356 0.033 2.938 540 HG LEU 67 HG LEU 67 10.687 -0.036 4.327 541 1HD1 LEU 67 1HD1 LEU 67 12.498 -2.353 4.330 542 2HD1 LEU 67 2HD1 LEU 67 11.766 -1.949 2.778 543 3HD1 LEU 67 3HD1 LEU 67 10.742 -2.278 4.177 544 1HD2 LEU 67 1HD2 LEU 67 12.803 0.845 5.592 545 2HD2 LEU 67 2HD2 LEU 67 13.220 -0.867 5.648 546 3HD2 LEU 67 3HD2 LEU 67 11.705 -0.304 6.354 547 H VAL 68 H VAL 68 10.961 2.932 1.719 548 HA VAL 68 HA VAL 68 12.762 3.529 -0.387 549 HB VAL 68 HB VAL 68 10.047 4.670 0.306 550 1HG1 VAL 68 1HG1 VAL 68 11.487 5.130 -2.291 551 2HG1 VAL 68 2HG1 VAL 68 11.548 6.283 -0.957 552 3HG1 VAL 68 3HG1 VAL 68 10.003 5.887 -1.712 553 1HG2 VAL 68 1HG2 VAL 68 9.884 2.411 -0.411 554 2HG2 VAL 68 2HG2 VAL 68 11.017 2.683 -1.737 555 3HG2 VAL 68 3HG2 VAL 68 9.414 3.416 -1.784 556 H ASP 69 H ASP 69 11.516 5.343 2.347 557 HA ASP 69 HA ASP 69 12.759 7.816 1.829 558 1HB ASP 69 1HB ASP 69 11.269 6.596 3.956 559 2HB ASP 69 2HB ASP 69 12.673 7.415 4.628 560 H ASN 70 H ASN 70 13.772 5.065 3.847 561 HA ASN 70 HA ASN 70 16.167 6.213 4.742 562 1HB ASN 70 1HB ASN 70 14.816 3.763 5.092 563 2HB ASN 70 2HB ASN 70 16.445 3.362 4.552 564 1HD2 ASN 70 1HD2 ASN 70 14.767 3.532 7.222 565 2HD2 ASN 70 2HD2 ASN 70 15.946 4.142 8.330 566 H TRP 71 H TRP 71 15.587 3.994 2.025 567 HA TRP 71 HA TRP 71 18.265 3.801 1.167 568 1HB TRP 71 1HB TRP 71 16.359 2.348 0.414 569 2HB TRP 71 2HB TRP 71 15.796 3.692 -0.575 570 HD1 TRP 71 HD1 TRP 71 18.787 1.266 -0.297 571 HE1 TRP 71 HE1 TRP 71 19.887 1.089 -2.617 572 HE3 TRP 71 HE3 TRP 71 16.000 4.746 -2.813 573 HZ2 TRP 71 HZ2 TRP 71 19.610 2.232 -5.162 574 HZ3 TRP 71 HZ3 TRP 71 16.476 5.127 -5.200 575 HH2 TRP 71 HH2 TRP 71 18.246 3.891 -6.354 576 H LEU 72 H LEU 72 15.639 5.973 0.190 577 HA LEU 72 HA LEU 72 17.050 7.359 -1.780 578 1HB LEU 72 1HB LEU 72 14.561 7.696 -0.294 579 2HB LEU 72 2HB LEU 72 15.291 9.216 -0.773 580 HG LEU 72 HG LEU 72 14.476 6.957 -2.601 581 1HD1 LEU 72 1HD1 LEU 72 12.507 8.011 -2.273 582 2HD1 LEU 72 2HD1 LEU 72 13.166 9.110 -3.485 583 3HD1 LEU 72 3HD1 LEU 72 13.269 9.521 -1.773 584 1HD2 LEU 72 1HD2 LEU 72 15.785 7.777 -4.191 585 2HD2 LEU 72 2HD2 LEU 72 16.529 8.823 -2.982 586 3HD2 LEU 72 3HD2 LEU 72 15.161 9.406 -3.931 587 H LYS 73 H LYS 73 16.783 7.947 1.696 588 HA LYS 73 HA LYS 73 18.131 10.458 1.529 589 1HB LYS 73 1HB LYS 73 17.077 8.742 3.723 590 2HB LYS 73 2HB LYS 73 18.269 9.969 4.137 591 1HG LYS 73 1HG LYS 73 16.845 11.684 3.752 592 2HG LYS 73 2HG LYS 73 16.013 10.842 2.442 593 1HD LYS 73 1HD LYS 73 14.694 9.595 3.941 594 2HD LYS 73 2HD LYS 73 15.723 10.009 5.316 595 1HE LYS 73 1HE LYS 73 14.805 12.089 5.554 596 2HE LYS 73 2HE LYS 73 14.401 12.223 3.842 597 1HZ LYS 73 1HZ LYS 73 12.611 10.609 4.195 598 2HZ LYS 73 2HZ LYS 73 12.407 11.995 5.151 599 3HZ LYS 73 3HZ LYS 73 12.975 10.560 5.853 600 H GLU 74 H GLU 74 19.120 7.181 2.418 601 HA GLU 74 HA GLU 74 21.714 8.081 3.262 602 1HB GLU 74 1HB GLU 74 20.508 5.337 2.959 603 2HB GLU 74 2HB GLU 74 22.163 5.598 3.488 604 1HG GLU 74 1HG GLU 74 19.654 6.520 4.871 605 2HG GLU 74 2HG GLU 74 20.757 5.250 5.400 606 H ASN 75 H ASN 75 20.428 6.509 0.373 607 HA ASN 75 HA ASN 75 23.105 6.093 -0.660 608 1HB ASN 75 1HB ASN 75 22.179 4.512 -1.934 609 2HB ASN 75 2HB ASN 75 20.689 4.797 -1.052 610 1HD2 ASN 75 1HD2 ASN 75 19.041 5.925 -2.015 611 2HD2 ASN 75 2HD2 ASN 75 19.000 6.215 -3.718 612 H GLU 76 H GLU 76 21.055 8.672 -0.529 613 HA GLU 76 HA GLU 76 21.765 9.860 -3.078 614 1HB GLU 76 1HB GLU 76 19.951 10.487 -0.898 615 2HB GLU 76 2HB GLU 76 20.901 11.890 -1.365 616 1HG GLU 76 1HG GLU 76 20.193 11.224 -3.779 617 2HG GLU 76 2HG GLU 76 18.915 10.334 -2.951 618 1H MET 1 1H MET 1 42.924 -76.136 15.230 619 2H MET 1 2H MET 1 42.591 -77.562 14.375 620 3H MET 1 3H MET 1 41.643 -76.183 14.118 621 HA MET 1 HA MET 1 43.233 -76.572 12.319 622 1HB MET 1 1HB MET 1 42.722 -74.197 13.814 623 2HB MET 1 2HB MET 1 44.397 -74.140 13.282 624 1HG MET 1 1HG MET 1 43.629 -74.552 10.966 625 2HG MET 1 2HG MET 1 41.964 -74.479 11.543 626 1HE MET 1 1HE MET 1 41.796 -72.206 13.583 627 2HE MET 1 2HE MET 1 40.703 -72.335 12.207 628 3HE MET 1 3HE MET 1 41.488 -70.796 12.570 629 H SER 2 H SER 2 45.460 -76.523 11.651 630 HA SER 2 HA SER 2 47.364 -77.027 13.840 631 1HB SER 2 1HB SER 2 47.566 -78.321 11.125 632 2HB SER 2 2HB SER 2 48.390 -78.774 12.615 633 HG SER 2 HG SER 2 46.279 -79.315 13.465 634 H LEU 3 H LEU 3 49.475 -76.307 13.527 635 HA LEU 3 HA LEU 3 51.153 -74.964 12.812 636 1HB LEU 3 1HB LEU 3 49.835 -75.630 10.368 637 2HB LEU 3 2HB LEU 3 50.278 -73.934 10.322 638 HG LEU 3 HG LEU 3 52.343 -75.914 11.162 639 1HD1 LEU 3 1HD1 LEU 3 52.621 -75.542 8.390 640 2HD1 LEU 3 2HD1 LEU 3 50.950 -76.044 8.663 641 3HD1 LEU 3 3HD1 LEU 3 52.280 -77.044 9.252 642 1HD2 LEU 3 1HD2 LEU 3 52.850 -73.682 9.289 643 2HD2 LEU 3 2HD2 LEU 3 53.810 -74.265 10.649 644 3HD2 LEU 3 3HD2 LEU 3 52.397 -73.248 10.940 645 H GLU 4 H GLU 4 48.357 -73.452 11.215 646 HA GLU 4 HA GLU 4 47.488 -71.355 11.330 647 1HB GLU 4 1HB GLU 4 48.171 -71.561 14.266 648 2HB GLU 4 2HB GLU 4 46.947 -70.529 13.540 649 1HG GLU 4 1HG GLU 4 45.539 -72.337 13.067 650 2HG GLU 4 2HG GLU 4 46.829 -73.515 13.301 651 H LYS 5 H LYS 5 49.962 -71.253 10.353 652 HA LYS 5 HA LYS 5 51.124 -68.863 11.609 653 1HB LYS 5 1HB LYS 5 52.448 -71.459 10.937 654 2HB LYS 5 2HB LYS 5 53.378 -69.971 10.818 655 1HG LYS 5 1HG LYS 5 52.881 -69.474 13.155 656 2HG LYS 5 2HG LYS 5 51.956 -70.973 13.275 657 1HD LYS 5 1HD LYS 5 53.830 -72.291 13.233 658 2HD LYS 5 2HD LYS 5 54.767 -71.116 12.307 659 1HE LYS 5 1HE LYS 5 55.509 -70.075 14.155 660 2HE LYS 5 2HE LYS 5 53.944 -70.182 14.956 661 1HZ LYS 5 1HZ LYS 5 55.925 -72.387 14.734 662 2HZ LYS 5 2HZ LYS 5 54.421 -72.484 15.514 663 3HZ LYS 5 3HZ LYS 5 55.626 -71.457 16.120 664 H ALA 6 H ALA 6 49.722 -70.042 8.927 665 HA ALA 6 HA ALA 6 51.433 -68.466 7.118 666 1HB ALA 6 1HB ALA 6 49.745 -69.961 5.519 667 2HB ALA 6 2HB ALA 6 50.143 -71.052 6.846 668 3HB ALA 6 3HB ALA 6 51.431 -70.325 5.885 669 H HIS 7 H HIS 7 49.150 -67.645 8.940 670 HA HIS 7 HA HIS 7 47.628 -66.233 6.858 671 1HB HIS 7 1HB HIS 7 46.602 -67.834 9.151 672 2HB HIS 7 2HB HIS 7 45.752 -66.342 8.759 673 HD1 HIS 7 HD1 HIS 7 45.107 -69.623 8.260 674 HD2 HIS 7 HD2 HIS 7 45.691 -66.539 5.525 675 HE1 HIS 7 HE1 HIS 7 44.009 -70.379 6.127 676 HE2 HIS 7 HE2 HIS 7 44.321 -68.483 4.502 677 H THR 8 H THR 8 49.969 -65.551 8.471 678 HA THR 8 HA THR 8 49.072 -63.627 10.426 679 HB THR 8 HB THR 8 51.866 -63.428 9.675 680 HG1 THR 8 HG1 THR 8 52.198 -65.706 10.563 681 1HG2 THR 8 1HG2 THR 8 51.158 -62.700 11.827 682 2HG2 THR 8 2HG2 THR 8 52.130 -64.153 12.080 683 3HG2 THR 8 3HG2 THR 8 50.369 -64.243 12.163 684 H SER 9 H SER 9 47.842 -62.674 8.374 685 HA SER 9 HA SER 9 47.556 -60.996 6.869 686 1HB SER 9 1HB SER 9 49.861 -59.458 7.993 687 2HB SER 9 2HB SER 9 48.239 -58.902 7.565 688 HG SER 9 HG SER 9 47.618 -60.354 9.454 689 H VAL 10 H VAL 10 49.000 -63.076 5.912 690 HA VAL 10 HA VAL 10 51.168 -61.830 4.363 691 HB VAL 10 HB VAL 10 51.786 -63.614 6.087 692 1HG1 VAL 10 1HG1 VAL 10 49.849 -65.086 4.627 693 2HG1 VAL 10 2HG1 VAL 10 50.789 -65.590 6.034 694 3HG1 VAL 10 3HG1 VAL 10 51.418 -65.866 4.407 695 1HG2 VAL 10 1HG2 VAL 10 52.763 -63.109 3.474 696 2HG2 VAL 10 2HG2 VAL 10 52.938 -64.832 3.807 697 3HG2 VAL 10 3HG2 VAL 10 53.649 -63.646 4.901 698 H LYS 11 H LYS 11 51.445 -62.465 2.215 699 HA LYS 11 HA LYS 11 50.895 -63.119 0.128 700 1HB LYS 11 1HB LYS 11 49.462 -65.076 1.743 701 2HB LYS 11 2HB LYS 11 48.676 -64.758 0.202 702 1HG LYS 11 1HG LYS 11 50.067 -66.411 -0.464 703 2HG LYS 11 2HG LYS 11 51.167 -65.050 -0.682 704 1HD LYS 11 1HD LYS 11 51.758 -65.554 1.835 705 2HD LYS 11 2HD LYS 11 51.139 -67.156 1.425 706 1HE LYS 11 1HE LYS 11 53.227 -65.749 -0.223 707 2HE LYS 11 2HE LYS 11 53.636 -66.786 1.143 708 1HZ LYS 11 1HZ LYS 11 51.936 -68.328 -0.285 709 2HZ LYS 11 2HZ LYS 11 53.627 -68.411 -0.366 710 3HZ LYS 11 3HZ LYS 11 52.769 -67.501 -1.509 711 H LYS 12 H LYS 12 47.917 -62.674 2.021 712 HA LYS 12 HA LYS 12 47.196 -60.455 0.384 713 1HB LYS 12 1HB LYS 12 46.339 -62.786 -0.631 714 2HB LYS 12 2HB LYS 12 45.031 -62.480 0.503 715 1HG LYS 12 1HG LYS 12 44.358 -61.593 -1.580 716 2HG LYS 12 2HG LYS 12 44.774 -60.218 -0.557 717 1HD LYS 12 1HD LYS 12 47.153 -60.898 -1.827 718 2HD LYS 12 2HD LYS 12 45.919 -61.063 -3.077 719 1HE LYS 12 1HE LYS 12 45.531 -58.853 -3.165 720 2HE LYS 12 2HE LYS 12 45.660 -58.661 -1.418 721 1HZ LYS 12 1HZ LYS 12 47.582 -57.654 -1.879 722 2HZ LYS 12 2HZ LYS 12 47.645 -58.268 -3.459 723 3HZ LYS 12 3HZ LYS 12 48.206 -59.205 -2.168 724 H MET 13 H MET 13 45.728 -59.108 1.341 725 HA MET 13 HA MET 13 44.811 -59.896 4.030 726 1HB MET 13 1HB MET 13 46.662 -58.026 3.647 727 2HB MET 13 2HB MET 13 45.254 -57.027 3.313 728 1HG MET 13 1HG MET 13 44.612 -58.347 5.666 729 2HG MET 13 2HG MET 13 46.319 -57.946 5.838 730 1HE MET 13 1HE MET 13 44.933 -56.602 8.025 731 2HE MET 13 2HE MET 13 43.373 -56.892 7.253 732 3HE MET 13 3HE MET 13 43.848 -55.251 7.693 733 H THR 14 H THR 14 43.132 -57.783 4.548 734 HA THR 14 HA THR 14 40.893 -58.341 2.836 735 HB THR 14 HB THR 14 40.189 -56.220 4.451 736 HG1 THR 14 HG1 THR 14 41.615 -58.006 6.126 737 1HG2 THR 14 1HG2 THR 14 39.983 -59.156 5.102 738 2HG2 THR 14 2HG2 THR 14 38.904 -58.283 4.014 739 3HG2 THR 14 3HG2 THR 14 38.956 -57.868 5.728 740 H PHE 15 H PHE 15 40.404 -57.263 1.045 741 HA PHE 15 HA PHE 15 42.031 -55.045 0.228 742 1HB PHE 15 1HB PHE 15 41.151 -55.362 -1.898 743 2HB PHE 15 2HB PHE 15 41.000 -56.970 -1.206 744 HD1 PHE 15 HD1 PHE 15 39.365 -54.594 -3.101 745 HD2 PHE 15 HD2 PHE 15 38.659 -57.293 0.112 746 HE1 PHE 15 HE1 PHE 15 36.964 -54.584 -3.625 747 HE2 PHE 15 HE2 PHE 15 36.255 -57.291 -0.410 748 HZ PHE 15 HZ PHE 15 35.406 -55.935 -2.282 749 H GLY 16 H GLY 16 39.332 -55.209 2.117 750 1HA GLY 16 1HA GLY 16 38.477 -53.081 3.020 751 2HA GLY 16 2HA GLY 16 38.477 -52.489 1.362 752 H GLU 17 H GLU 17 37.178 -55.118 3.350 753 HA GLU 17 HA GLU 17 35.062 -55.672 1.504 754 1HB GLU 17 1HB GLU 17 36.196 -56.879 3.855 755 2HB GLU 17 2HB GLU 17 34.445 -56.817 4.006 756 1HG GLU 17 1HG GLU 17 34.151 -58.424 2.495 757 2HG GLU 17 2HG GLU 17 35.314 -57.707 1.381 758 H ASN 18 H ASN 18 35.389 -53.015 3.134 759 HA ASN 18 HA ASN 18 32.928 -52.757 4.558 760 1HB ASN 18 1HB ASN 18 33.480 -50.210 4.135 761 2HB ASN 18 2HB ASN 18 34.416 -51.153 5.289 762 1HD2 ASN 18 1HD2 ASN 18 36.518 -50.856 5.149 763 2HD2 ASN 18 2HD2 ASN 18 37.401 -50.447 3.710 764 H ARG 19 H ARG 19 34.041 -51.354 1.495 765 HA ARG 19 HA ARG 19 32.979 -50.786 -0.422 766 1HB ARG 19 1HB ARG 19 31.800 -53.266 0.428 767 2HB ARG 19 2HB ARG 19 30.576 -52.274 -0.353 768 1HG ARG 19 1HG ARG 19 31.646 -53.731 -1.955 769 2HG ARG 19 2HG ARG 19 32.024 -52.045 -2.314 770 1HD ARG 19 1HD ARG 19 34.062 -52.799 -0.626 771 2HD ARG 19 2HD ARG 19 33.786 -54.252 -1.591 772 HE ARG 19 HE ARG 19 33.960 -52.605 -3.554 773 1HH1 ARG 19 1HH1 ARG 19 35.828 -52.439 -0.588 774 2HH1 ARG 19 2HH1 ARG 19 37.102 -51.494 -1.298 775 1HH2 ARG 19 1HH2 ARG 19 35.640 -51.417 -4.496 776 2HH2 ARG 19 2HH2 ARG 19 37.011 -50.938 -3.532 777 H ASP 20 H ASP 20 32.626 -48.692 0.518 778 HA ASP 20 HA ASP 20 30.044 -48.116 1.689 779 1HB ASP 20 1HB ASP 20 31.908 -46.836 2.522 780 2HB ASP 20 2HB ASP 20 32.347 -46.324 0.894 781 H LEU 21 H LEU 21 28.344 -48.137 0.401 782 HA LEU 21 HA LEU 21 28.550 -46.777 -2.209 783 1HB LEU 21 1HB LEU 21 27.397 -49.422 -1.467 784 2HB LEU 21 2HB LEU 21 26.550 -48.479 -2.679 785 HG LEU 21 HG LEU 21 29.138 -48.374 -3.588 786 1HD1 LEU 21 1HD1 LEU 21 30.093 -49.919 -2.125 787 2HD1 LEU 21 2HD1 LEU 21 29.749 -50.859 -3.576 788 3HD1 LEU 21 3HD1 LEU 21 28.687 -50.980 -2.176 789 1HD2 LEU 21 1HD2 LEU 21 28.382 -49.980 -5.273 790 2HD2 LEU 21 2HD2 LEU 21 27.144 -48.772 -4.927 791 3HD2 LEU 21 3HD2 LEU 21 27.004 -50.397 -4.257 792 H GLU 22 H GLU 22 27.585 -46.132 0.641 793 HA GLU 22 HA GLU 22 24.831 -45.889 0.748 794 1HB GLU 22 1HB GLU 22 26.948 -44.096 1.936 795 2HB GLU 22 2HB GLU 22 25.246 -44.040 2.368 796 1HG GLU 22 1HG GLU 22 27.089 -46.388 2.739 797 2HG GLU 22 2HG GLU 22 26.528 -45.293 4.002 798 H ARG 23 H ARG 23 23.355 -44.476 0.034 799 HA ARG 23 HA ARG 23 24.273 -42.191 -1.581 800 1HB ARG 23 1HB ARG 23 22.825 -44.552 -2.459 801 2HB ARG 23 2HB ARG 23 21.914 -43.083 -2.782 802 1HG ARG 23 1HG ARG 23 24.617 -42.644 -3.535 803 2HG ARG 23 2HG ARG 23 24.075 -44.171 -4.235 804 1HD ARG 23 1HD ARG 23 22.822 -41.452 -4.547 805 2HD ARG 23 2HD ARG 23 23.572 -42.445 -5.796 806 HE ARG 23 HE ARG 23 21.659 -44.064 -5.225 807 1HH1 ARG 23 1HH1 ARG 23 21.396 -40.567 -5.094 808 2HH1 ARG 23 2HH1 ARG 23 19.701 -40.564 -5.494 809 1HH2 ARG 23 1HH2 ARG 23 19.456 -44.061 -5.718 810 2HH2 ARG 23 2HH2 ARG 23 18.589 -42.554 -5.829 811 H VAL 24 H VAL 24 23.199 -40.340 -1.202 812 HA VAL 24 HA VAL 24 20.736 -40.490 0.419 813 HB VAL 24 HB VAL 24 22.712 -38.209 0.525 814 1HG1 VAL 24 1HG1 VAL 24 20.804 -38.891 2.703 815 2HG1 VAL 24 2HG1 VAL 24 20.178 -38.113 1.249 816 3HG1 VAL 24 3HG1 VAL 24 21.434 -37.321 2.203 817 1HG2 VAL 24 1HG2 VAL 24 22.684 -40.778 2.019 818 2HG2 VAL 24 2HG2 VAL 24 23.106 -39.308 2.897 819 3HG2 VAL 24 3HG2 VAL 24 24.048 -39.793 1.485 820 H VAL 25 H VAL 25 18.998 -39.497 -0.421 821 HA VAL 25 HA VAL 25 19.322 -38.061 -2.939 822 HB VAL 25 HB VAL 25 16.706 -38.656 -1.560 823 1HG1 VAL 25 1HG1 VAL 25 17.361 -37.272 -3.888 824 2HG1 VAL 25 2HG1 VAL 25 15.763 -37.827 -3.395 825 3HG1 VAL 25 3HG1 VAL 25 16.762 -38.836 -4.437 826 1HG2 VAL 25 1HG2 VAL 25 16.942 -40.836 -1.906 827 2HG2 VAL 25 2HG2 VAL 25 18.580 -40.568 -2.500 828 3HG2 VAL 25 3HG2 VAL 25 17.220 -40.542 -3.622 829 H THR 26 H THR 26 19.566 -35.908 -2.911 830 HA THR 26 HA THR 26 18.112 -34.362 -0.879 831 HB THR 26 HB THR 26 20.753 -33.256 -1.459 832 HG1 THR 26 HG1 THR 26 20.493 -35.878 -0.440 833 1HG2 THR 26 1HG2 THR 26 19.116 -32.556 0.336 834 2HG2 THR 26 2HG2 THR 26 20.769 -32.832 0.883 835 3HG2 THR 26 3HG2 THR 26 19.529 -34.051 1.180 836 H ALA 27 H ALA 27 16.675 -33.640 -2.437 837 HA ALA 27 HA ALA 27 17.802 -31.952 -4.573 838 1HB ALA 27 1HB ALA 27 15.369 -32.065 -5.428 839 2HB ALA 27 2HB ALA 27 15.202 -33.424 -4.317 840 3HB ALA 27 3HB ALA 27 16.393 -33.489 -5.617 841 HA PRO 28 HA PRO 28 16.417 -28.785 -1.697 842 1HB PRO 28 1HB PRO 28 17.813 -26.746 -2.789 843 2HB PRO 28 2HB PRO 28 18.574 -27.982 -1.781 844 1HG PRO 28 1HG PRO 28 18.498 -27.749 -4.763 845 2HG PRO 28 2HG PRO 28 19.858 -28.179 -3.710 846 1HD PRO 28 1HD PRO 28 18.389 -30.026 -5.060 847 2HD PRO 28 2HD PRO 28 19.174 -30.363 -3.506 848 H VAL 29 H VAL 29 15.003 -27.054 -1.754 849 HA VAL 29 HA VAL 29 14.002 -26.170 -4.362 850 HB VAL 29 HB VAL 29 11.658 -26.159 -3.116 851 1HG1 VAL 29 1HG1 VAL 29 11.252 -28.457 -4.129 852 2HG1 VAL 29 2HG1 VAL 29 12.959 -28.439 -4.574 853 3HG1 VAL 29 3HG1 VAL 29 11.867 -27.206 -5.209 854 1HG2 VAL 29 1HG2 VAL 29 12.470 -27.086 -1.022 855 2HG2 VAL 29 2HG2 VAL 29 13.084 -28.506 -1.869 856 3HG2 VAL 29 3HG2 VAL 29 11.348 -28.210 -1.794 857 H SER 30 H SER 30 13.265 -24.051 -4.398 858 HA SER 30 HA SER 30 13.576 -22.541 -1.889 859 1HB SER 30 1HB SER 30 14.396 -20.865 -4.011 860 2HB SER 30 2HB SER 30 15.403 -21.556 -2.738 861 HG SER 30 HG SER 30 16.017 -23.165 -4.053 862 H SER 31 H SER 31 12.500 -20.471 -1.840 863 HA SER 31 HA SER 31 9.889 -20.537 -2.960 864 1HB SER 31 1HB SER 31 10.400 -17.930 -2.033 865 2HB SER 31 2HB SER 31 9.615 -19.236 -1.142 866 HG SER 31 HG SER 31 12.207 -18.242 -0.952 867 H GLY 32 H GLY 32 9.093 -19.579 -4.783 868 1HA GLY 32 1HA GLY 32 10.786 -17.630 -6.182 869 2HA GLY 32 2HA GLY 32 10.383 -19.122 -7.015 870 H LYS 33 H LYS 33 9.140 -16.122 -5.731 871 HA LYS 33 HA LYS 33 7.262 -15.885 -7.834 872 1HB LYS 33 1HB LYS 33 6.198 -17.423 -5.903 873 2HB LYS 33 2HB LYS 33 5.813 -15.840 -5.239 874 1HG LYS 33 1HG LYS 33 3.942 -16.567 -6.519 875 2HG LYS 33 2HG LYS 33 4.739 -15.276 -7.421 876 1HD LYS 33 1HD LYS 33 5.974 -17.128 -8.661 877 2HD LYS 33 2HD LYS 33 4.799 -18.234 -7.947 878 1HE LYS 33 1HE LYS 33 2.993 -16.809 -8.938 879 2HE LYS 33 2HE LYS 33 4.247 -15.912 -9.791 880 1HZ LYS 33 1HZ LYS 33 4.654 -17.631 -11.201 881 2HZ LYS 33 2HZ LYS 33 3.021 -17.958 -10.872 882 3HZ LYS 33 3HZ LYS 33 4.235 -18.823 -10.066 883 H ILE 34 H ILE 34 6.142 -13.797 -7.760 884 HA ILE 34 HA ILE 34 7.576 -11.893 -6.031 885 HB ILE 34 HB ILE 34 6.701 -10.214 -7.852 886 1HG1 ILE 34 1HG1 ILE 34 7.240 -12.368 -9.799 887 2HG1 ILE 34 2HG1 ILE 34 5.692 -12.491 -8.966 888 1HG2 ILE 34 1HG2 ILE 34 9.112 -11.739 -7.485 889 2HG2 ILE 34 2HG2 ILE 34 8.909 -10.049 -7.946 890 3HG2 ILE 34 3HG2 ILE 34 8.892 -11.309 -9.182 891 1HD1 ILE 34 1HD1 ILE 34 6.685 -10.158 -10.584 892 2HD1 ILE 34 2HD1 ILE 34 5.171 -10.188 -9.679 893 3HD1 ILE 34 3HD1 ILE 34 5.413 -11.295 -11.030 894 H LYS 35 H LYS 35 6.471 -10.373 -4.928 895 HA LYS 35 HA LYS 35 3.562 -10.801 -4.741 896 1HB LYS 35 1HB LYS 35 5.101 -9.471 -2.562 897 2HB LYS 35 2HB LYS 35 3.708 -10.538 -2.456 898 1HG LYS 35 1HG LYS 35 6.465 -11.480 -3.209 899 2HG LYS 35 2HG LYS 35 5.849 -11.471 -1.554 900 1HD LYS 35 1HD LYS 35 4.232 -12.796 -3.682 901 2HD LYS 35 2HD LYS 35 5.667 -13.622 -3.066 902 1HE LYS 35 1HE LYS 35 4.691 -13.123 -0.738 903 2HE LYS 35 2HE LYS 35 3.183 -12.807 -1.598 904 1HZ LYS 35 1HZ LYS 35 4.680 -15.343 -1.371 905 2HZ LYS 35 2HZ LYS 35 3.570 -15.094 -2.630 906 3HZ LYS 35 3HZ LYS 35 3.049 -15.034 -1.019 907 H ARG 36 H ARG 36 2.180 -8.994 -4.489 908 HA ARG 36 HA ARG 36 3.313 -6.580 -5.713 909 1HB ARG 36 1HB ARG 36 0.853 -8.067 -6.020 910 2HB ARG 36 2HB ARG 36 0.526 -6.369 -5.704 911 1HG ARG 36 1HG ARG 36 0.693 -6.973 -8.112 912 2HG ARG 36 2HG ARG 36 1.786 -5.688 -7.594 913 1HD ARG 36 1HD ARG 36 3.340 -6.899 -8.675 914 2HD ARG 36 2HD ARG 36 3.343 -7.867 -7.202 915 HE ARG 36 HE ARG 36 1.856 -9.428 -8.311 916 1HH1 ARG 36 1HH1 ARG 36 3.357 -7.020 -10.357 917 2HH1 ARG 36 2HH1 ARG 36 3.282 -7.992 -11.799 918 1HH2 ARG 36 1HH2 ARG 36 1.750 -10.731 -10.200 919 2HH2 ARG 36 2HH2 ARG 36 2.373 -10.113 -11.705 920 H VAL 37 H VAL 37 3.462 -4.723 -4.687 921 HA VAL 37 HA VAL 37 1.775 -4.262 -2.312 922 HB VAL 37 HB VAL 37 4.633 -3.307 -2.523 923 1HG1 VAL 37 1HG1 VAL 37 3.877 -1.952 -0.906 924 2HG1 VAL 37 2HG1 VAL 37 3.947 -3.386 0.119 925 3HG1 VAL 37 3HG1 VAL 37 2.426 -2.921 -0.643 926 1HG2 VAL 37 1HG2 VAL 37 5.375 -5.299 -1.879 927 2HG2 VAL 37 2HG2 VAL 37 3.736 -5.939 -1.977 928 3HG2 VAL 37 3HG2 VAL 37 4.319 -5.245 -0.468 929 H ASN 38 H ASN 38 0.693 -2.389 -2.383 930 HA ASN 38 HA ASN 38 1.416 -0.466 -4.489 931 1HB ASN 38 1HB ASN 38 -0.780 -0.919 -4.977 932 2HB ASN 38 2HB ASN 38 -1.169 -1.354 -3.318 933 1HD2 ASN 38 1HD2 ASN 38 -0.585 1.362 -5.480 934 2HD2 ASN 38 2HD2 ASN 38 -1.509 2.510 -4.571 935 H VAL 39 H VAL 39 2.361 1.342 -3.857 936 HA VAL 39 HA VAL 39 1.884 2.287 -1.105 937 HB VAL 39 HB VAL 39 4.467 3.069 -2.226 938 1HG1 VAL 39 1HG1 VAL 39 3.381 2.022 0.351 939 2HG1 VAL 39 2HG1 VAL 39 4.232 3.529 0.015 940 3HG1 VAL 39 3HG1 VAL 39 5.122 2.007 0.069 941 1HG2 VAL 39 1HG2 VAL 39 5.291 0.625 -1.479 942 2HG2 VAL 39 2HG2 VAL 39 4.940 1.059 -3.153 943 3HG2 VAL 39 3HG2 VAL 39 3.731 0.204 -2.190 944 H ASN 40 H ASN 40 2.410 4.608 -0.818 945 HA ASN 40 HA ASN 40 2.002 6.161 -3.273 946 1HB ASN 40 1HB ASN 40 0.562 7.731 -1.918 947 2HB ASN 40 2HB ASN 40 -0.154 6.158 -2.244 948 1HD2 ASN 40 1HD2 ASN 40 -0.288 4.635 -0.549 949 2HD2 ASN 40 2HD2 ASN 40 -0.230 5.139 1.113 950 H PHE 41 H PHE 41 3.574 7.533 -3.579 951 HA PHE 41 HA PHE 41 5.049 8.549 -1.237 952 1HB PHE 41 1HB PHE 41 6.250 8.326 -3.988 953 2HB PHE 41 2HB PHE 41 7.073 8.500 -2.444 954 HD1 PHE 41 HD1 PHE 41 6.069 6.245 -4.969 955 HD2 PHE 41 HD2 PHE 41 6.827 6.526 -0.792 956 HE1 PHE 41 HE1 PHE 41 6.361 3.804 -4.861 957 HE2 PHE 41 HE2 PHE 41 7.120 4.086 -0.676 958 HZ PHE 41 HZ PHE 41 6.962 2.730 -2.749 959 H ASP 42 H ASP 42 5.517 10.711 -1.166 960 HA ASP 42 HA ASP 42 3.886 12.531 -2.580 961 1HB ASP 42 1HB ASP 42 4.887 13.023 -0.380 962 2HB ASP 42 2HB ASP 42 6.481 13.043 -1.118 963 H GLU 43 H GLU 43 4.476 14.088 -4.154 964 HA GLU 43 HA GLU 43 5.837 13.030 -6.336 965 1HB GLU 43 1HB GLU 43 4.385 15.429 -5.728 966 2HB GLU 43 2HB GLU 43 5.820 15.828 -6.665 967 1HG GLU 43 1HG GLU 43 3.869 13.689 -7.465 968 2HG GLU 43 2HG GLU 43 3.752 15.365 -7.998 969 H GLU 44 H GLU 44 7.015 14.962 -3.697 970 HA GLU 44 HA GLU 44 9.516 15.742 -4.807 971 1HB GLU 44 1HB GLU 44 8.236 16.248 -2.473 972 2HB GLU 44 2HB GLU 44 9.385 15.029 -1.938 973 1HG GLU 44 1HG GLU 44 10.524 17.160 -3.602 974 2HG GLU 44 2HG GLU 44 9.896 17.682 -2.039 975 H LYS 45 H LYS 45 8.586 13.070 -2.689 976 HA LYS 45 HA LYS 45 10.997 11.652 -2.712 977 1HB LYS 45 1HB LYS 45 8.904 11.381 -1.230 978 2HB LYS 45 2HB LYS 45 8.277 10.368 -2.522 979 1HG LYS 45 1HG LYS 45 10.330 8.952 -2.280 980 2HG LYS 45 2HG LYS 45 10.724 9.896 -0.840 981 1HD LYS 45 1HD LYS 45 8.052 9.169 -0.518 982 2HD LYS 45 2HD LYS 45 8.838 7.730 -1.166 983 1HE LYS 45 1HE LYS 45 9.793 7.311 0.792 984 2HE LYS 45 2HE LYS 45 10.494 8.928 0.843 985 1HZ LYS 45 1HZ LYS 45 8.273 9.702 1.669 986 2HZ LYS 45 2HZ LYS 45 9.137 8.710 2.741 987 3HZ LYS 45 3HZ LYS 45 7.841 8.069 1.850 988 H HIS 46 H HIS 46 8.272 11.683 -4.899 989 HA HIS 46 HA HIS 46 9.014 9.398 -6.418 990 1HB HIS 46 1HB HIS 46 6.723 10.299 -6.411 991 2HB HIS 46 2HB HIS 46 7.293 11.760 -7.208 992 HD1 HIS 46 HD1 HIS 46 6.421 11.687 -9.512 993 HD2 HIS 46 HD2 HIS 46 7.865 7.979 -8.281 994 HE1 HIS 46 HE1 HIS 46 6.300 10.199 -11.540 995 HE2 HIS 46 HE2 HIS 46 7.030 7.918 -10.736 996 H THR 47 H THR 47 9.571 12.877 -6.859 997 HA THR 47 HA THR 47 10.973 12.684 -9.311 998 HB THR 47 HB THR 47 11.380 14.807 -7.193 999 HG1 THR 47 HG1 THR 47 9.195 14.811 -7.545 1000 1HG2 THR 47 1HG2 THR 47 11.863 14.643 -10.150 1001 2HG2 THR 47 2HG2 THR 47 12.964 15.163 -8.871 1002 3HG2 THR 47 3HG2 THR 47 11.615 16.197 -9.356 1003 H ARG 48 H ARG 48 11.963 12.560 -5.940 1004 HA ARG 48 HA ARG 48 14.762 12.448 -6.356 1005 1HB ARG 48 1HB ARG 48 12.943 12.277 -4.165 1006 2HB ARG 48 2HB ARG 48 14.038 10.904 -4.077 1007 1HG ARG 48 1HG ARG 48 15.949 12.402 -4.140 1008 2HG ARG 48 2HG ARG 48 14.864 13.791 -4.269 1009 1HD ARG 48 1HD ARG 48 14.159 12.088 -2.041 1010 2HD ARG 48 2HD ARG 48 15.832 12.634 -1.932 1011 HE ARG 48 HE ARG 48 13.448 14.373 -2.041 1012 1HH1 ARG 48 1HH1 ARG 48 16.869 13.899 -1.390 1013 2HH1 ARG 48 2HH1 ARG 48 17.052 15.436 -0.596 1014 1HH2 ARG 48 1HH2 ARG 48 13.687 16.382 -0.991 1015 2HH2 ARG 48 2HH2 ARG 48 15.245 16.851 -0.362 1016 H PHE 49 H PHE 49 12.267 9.962 -6.036 1017 HA PHE 49 HA PHE 49 13.947 7.726 -6.183 1018 1HB PHE 49 1HB PHE 49 11.218 8.165 -5.910 1019 2HB PHE 49 2HB PHE 49 11.359 7.305 -7.441 1020 HD1 PHE 49 HD1 PHE 49 9.996 5.568 -6.201 1021 HD2 PHE 49 HD2 PHE 49 13.993 6.569 -5.143 1022 HE1 PHE 49 HE1 PHE 49 10.197 3.447 -4.975 1023 HE2 PHE 49 HE2 PHE 49 14.208 4.442 -3.925 1024 HZ PHE 49 HZ PHE 49 12.305 2.881 -3.837 1025 H LYS 50 H LYS 50 12.370 9.626 -8.702 1026 HA LYS 50 HA LYS 50 13.013 7.967 -10.881 1027 1HB LYS 50 1HB LYS 50 12.353 10.880 -10.599 1028 2HB LYS 50 2HB LYS 50 12.856 10.237 -12.156 1029 1HG LYS 50 1HG LYS 50 10.614 8.996 -10.604 1030 2HG LYS 50 2HG LYS 50 10.352 10.381 -11.667 1031 1HD LYS 50 1HD LYS 50 11.742 8.813 -13.331 1032 2HD LYS 50 2HD LYS 50 10.998 7.569 -12.325 1033 1HE LYS 50 1HE LYS 50 8.929 7.979 -13.123 1034 2HE LYS 50 2HE LYS 50 9.196 9.720 -13.212 1035 1HZ LYS 50 1HZ LYS 50 8.920 8.404 -15.375 1036 2HZ LYS 50 2HZ LYS 50 10.512 7.891 -15.113 1037 3HZ LYS 50 3HZ LYS 50 10.174 9.543 -15.290 1038 H ALA 51 H ALA 51 14.755 10.605 -9.314 1039 HA ALA 51 HA ALA 51 16.953 10.594 -11.137 1040 1HB ALA 51 1HB ALA 51 17.414 12.475 -10.046 1041 2HB ALA 51 2HB ALA 51 17.783 11.547 -8.594 1042 3HB ALA 51 3HB ALA 51 16.141 12.119 -8.881 1043 H ALA 52 H ALA 52 16.235 9.019 -8.069 1044 HA ALA 52 HA ALA 52 18.769 7.948 -7.567 1045 1HB ALA 52 1HB ALA 52 16.843 8.093 -5.962 1046 2HB ALA 52 2HB ALA 52 17.728 6.567 -5.945 1047 3HB ALA 52 3HB ALA 52 16.167 6.673 -6.759 1048 H CYS 53 H CYS 53 15.953 6.396 -9.152 1049 HA CYS 53 HA CYS 53 17.314 3.967 -9.674 1050 1HB CYS 53 1HB CYS 53 15.475 3.608 -11.386 1051 2HB CYS 53 2HB CYS 53 14.953 3.864 -9.726 1052 HG CYS 53 HG CYS 53 13.962 6.356 -10.061 1053 H ALA 54 H ALA 54 17.001 6.976 -11.473 1054 HA ALA 54 HA ALA 54 18.171 6.040 -13.892 1055 1HB ALA 54 1HB ALA 54 18.760 8.720 -13.808 1056 2HB ALA 54 2HB ALA 54 17.335 8.602 -12.773 1057 3HB ALA 54 3HB ALA 54 17.268 8.017 -14.435 1058 H ARG 55 H ARG 55 19.456 7.543 -10.963 1059 HA ARG 55 HA ARG 55 22.133 7.809 -11.847 1060 1HB ARG 55 1HB ARG 55 20.635 8.302 -9.468 1061 2HB ARG 55 2HB ARG 55 22.065 7.375 -9.031 1062 1HG ARG 55 1HG ARG 55 23.017 9.400 -8.920 1063 2HG ARG 55 2HG ARG 55 23.161 9.212 -10.669 1064 1HD ARG 55 1HD ARG 55 21.943 11.052 -10.917 1065 2HD ARG 55 2HD ARG 55 20.577 10.192 -10.208 1066 HE ARG 55 HE ARG 55 21.399 11.019 -8.012 1067 1HH1 ARG 55 1HH1 ARG 55 22.298 12.684 -10.963 1068 2HH1 ARG 55 2HH1 ARG 55 22.530 14.223 -10.180 1069 1HH2 ARG 55 1HH2 ARG 55 21.695 13.038 -6.980 1070 2HH2 ARG 55 2HH2 ARG 55 22.183 14.426 -7.915 1071 H LYS 56 H LYS 56 20.406 5.287 -10.082 1072 HA LYS 56 HA LYS 56 22.702 3.627 -9.742 1073 1HB LYS 56 1HB LYS 56 19.985 3.647 -8.877 1074 2HB LYS 56 2HB LYS 56 20.298 2.090 -9.624 1075 1HG LYS 56 1HG LYS 56 20.742 1.894 -7.294 1076 2HG LYS 56 2HG LYS 56 22.290 1.853 -8.143 1077 1HD LYS 56 1HD LYS 56 22.749 4.129 -7.549 1078 2HD LYS 56 2HD LYS 56 21.120 4.343 -6.904 1079 1HE LYS 56 1HE LYS 56 21.684 3.475 -4.926 1080 2HE LYS 56 2HE LYS 56 22.511 2.110 -5.673 1081 1HZ LYS 56 1HZ LYS 56 23.908 3.675 -4.284 1082 2HZ LYS 56 2HZ LYS 56 23.734 4.801 -5.540 1083 3HZ LYS 56 3HZ LYS 56 24.493 3.317 -5.837 1084 H GLY 57 H GLY 57 20.484 4.185 -12.288 1085 1HA GLY 57 1HA GLY 57 20.544 3.459 -14.470 1086 2HA GLY 57 2HA GLY 57 21.979 2.526 -14.067 1087 H THR 58 H THR 58 18.648 2.402 -12.828 1088 HA THR 58 HA THR 58 18.234 -0.191 -14.035 1089 HB THR 58 HB THR 58 19.573 -0.569 -11.905 1090 HG1 THR 58 HG1 THR 58 18.519 -2.337 -12.659 1091 1HG2 THR 58 1HG2 THR 58 18.684 -0.205 -9.816 1092 2HG2 THR 58 2HG2 THR 58 17.023 -0.198 -10.406 1093 3HG2 THR 58 3HG2 THR 58 18.062 1.198 -10.687 1094 H SER 59 H SER 59 16.054 -1.105 -13.227 1095 HA SER 59 HA SER 59 14.044 0.817 -13.740 1096 1HB SER 59 1HB SER 59 13.077 -1.624 -12.499 1097 2HB SER 59 2HB SER 59 12.825 -1.028 -14.143 1098 HG SER 59 HG SER 59 14.346 -3.041 -13.380 1099 H ILE 60 H ILE 60 12.407 1.616 -12.375 1100 HA ILE 60 HA ILE 60 13.322 2.393 -9.836 1101 HB ILE 60 HB ILE 60 11.693 3.663 -11.267 1102 1HG1 ILE 60 1HG1 ILE 60 10.639 3.282 -8.469 1103 2HG1 ILE 60 2HG1 ILE 60 12.203 4.031 -8.775 1104 1HG2 ILE 60 1HG2 ILE 60 9.236 2.905 -10.350 1105 2HG2 ILE 60 2HG2 ILE 60 10.026 1.353 -10.620 1106 3HG2 ILE 60 3HG2 ILE 60 9.895 2.516 -11.939 1107 1HD1 ILE 60 1HD1 ILE 60 10.228 5.260 -10.434 1108 2HD1 ILE 60 2HD1 ILE 60 11.231 5.976 -9.172 1109 3HD1 ILE 60 3HD1 ILE 60 9.678 5.249 -8.759 1110 H THR 61 H THR 61 11.263 -0.266 -10.840 1111 HA THR 61 HA THR 61 10.252 -0.906 -8.287 1112 HB THR 61 HB THR 61 10.553 -3.271 -9.872 1113 HG1 THR 61 HG1 THR 61 10.495 -2.467 -11.831 1114 1HG2 THR 61 1HG2 THR 61 8.166 -3.259 -9.854 1115 2HG2 THR 61 2HG2 THR 61 8.112 -1.525 -9.555 1116 3HG2 THR 61 3HG2 THR 61 8.694 -2.617 -8.300 1117 H ASP 62 H ASP 62 13.232 -1.654 -9.940 1118 HA ASP 62 HA ASP 62 14.066 -3.778 -8.261 1119 1HB ASP 62 1HB ASP 62 14.943 -2.867 -10.623 1120 2HB ASP 62 2HB ASP 62 16.121 -2.086 -9.571 1121 H VAL 63 H VAL 63 14.624 -0.276 -8.187 1122 HA VAL 63 HA VAL 63 16.479 -0.409 -6.038 1123 HB VAL 63 HB VAL 63 16.334 1.960 -5.831 1124 1HG1 VAL 63 1HG1 VAL 63 17.194 2.534 -7.855 1125 2HG1 VAL 63 2HG1 VAL 63 15.930 1.703 -8.762 1126 3HG1 VAL 63 3HG1 VAL 63 17.232 0.779 -8.009 1127 1HG2 VAL 63 1HG2 VAL 63 13.847 1.824 -7.526 1128 2HG2 VAL 63 2HG2 VAL 63 14.682 3.307 -7.063 1129 3HG2 VAL 63 3HG2 VAL 63 13.946 2.286 -5.825 1130 H VAL 64 H VAL 64 12.997 -0.341 -6.206 1131 HA VAL 64 HA VAL 64 12.525 0.290 -3.464 1132 HB VAL 64 HB VAL 64 10.759 -1.415 -5.223 1133 1HG1 VAL 64 1HG1 VAL 64 10.219 0.289 -2.797 1134 2HG1 VAL 64 2HG1 VAL 64 10.125 -1.468 -2.904 1135 3HG1 VAL 64 3HG1 VAL 64 8.970 -0.467 -3.784 1136 1HG2 VAL 64 1HG2 VAL 64 9.596 0.636 -5.845 1137 2HG2 VAL 64 2HG2 VAL 64 11.275 0.671 -6.380 1138 3HG2 VAL 64 3HG2 VAL 64 10.784 1.588 -4.955 1139 H ASN 65 H ASN 65 12.989 -2.693 -5.295 1140 HA ASN 65 HA ASN 65 12.667 -4.457 -3.094 1141 1HB ASN 65 1HB ASN 65 12.549 -5.168 -5.477 1142 2HB ASN 65 2HB ASN 65 14.281 -4.887 -5.618 1143 1HD2 ASN 65 1HD2 ASN 65 15.573 -6.522 -5.245 1144 2HD2 ASN 65 2HD2 ASN 65 15.156 -7.983 -4.406 1145 H GLN 66 H GLN 66 15.280 -2.454 -4.198 1146 HA GLN 66 HA GLN 66 17.350 -3.836 -2.786 1147 1HB GLN 66 1HB GLN 66 17.441 -2.110 -4.808 1148 2HB GLN 66 2HB GLN 66 17.680 -0.969 -3.488 1149 1HG GLN 66 1HG GLN 66 19.481 -2.680 -2.705 1150 2HG GLN 66 2HG GLN 66 19.414 -3.226 -4.379 1151 1HE2 GLN 66 1HE2 GLN 66 19.959 -1.755 -6.039 1152 2HE2 GLN 66 2HE2 GLN 66 21.025 -0.425 -5.711 1153 H LEU 67 H LEU 67 15.369 -0.953 -2.079 1154 HA LEU 67 HA LEU 67 16.747 -0.308 0.316 1155 1HB LEU 67 1HB LEU 67 14.370 0.705 0.908 1156 2HB LEU 67 2HB LEU 67 15.459 1.482 -0.217 1157 HG LEU 67 HG LEU 67 13.918 -0.216 -1.799 1158 1HD1 LEU 67 1HD1 LEU 67 11.666 0.142 -1.227 1159 2HD1 LEU 67 2HD1 LEU 67 12.080 1.337 0.001 1160 3HD1 LEU 67 3HD1 LEU 67 12.445 -0.368 0.270 1161 1HD2 LEU 67 1HD2 LEU 67 12.782 2.208 -2.145 1162 2HD2 LEU 67 2HD2 LEU 67 14.339 1.742 -2.826 1163 3HD2 LEU 67 3HD2 LEU 67 14.273 2.665 -1.325 1164 H VAL 68 H VAL 68 13.929 -2.290 -0.394 1165 HA VAL 68 HA VAL 68 13.366 -3.056 2.278 1166 HB VAL 68 HB VAL 68 12.785 -4.541 -0.292 1167 1HG1 VAL 68 1HG1 VAL 68 10.842 -5.348 1.309 1168 2HG1 VAL 68 2HG1 VAL 68 12.047 -5.004 2.551 1169 3HG1 VAL 68 3HG1 VAL 68 12.406 -6.168 1.271 1170 1HG2 VAL 68 1HG2 VAL 68 11.395 -2.343 1.162 1171 2HG2 VAL 68 2HG2 VAL 68 10.433 -3.552 0.311 1172 3HG2 VAL 68 3HG2 VAL 68 11.616 -2.587 -0.572 1173 H ASP 69 H ASP 69 15.500 -4.277 -0.229 1174 HA ASP 69 HA ASP 69 16.233 -6.733 0.841 1175 1HB ASP 69 1HB ASP 69 16.923 -5.923 -1.401 1176 2HB ASP 69 2HB ASP 69 18.029 -4.783 -0.625 1177 H ASN 70 H ASN 70 17.828 -3.600 1.296 1178 HA ASN 70 HA ASN 70 19.802 -4.509 3.059 1179 1HB ASN 70 1HB ASN 70 18.624 -1.816 2.474 1180 2HB ASN 70 2HB ASN 70 19.767 -2.003 3.800 1181 1HD2 ASN 70 1HD2 ASN 70 19.326 -2.554 0.353 1182 2HD2 ASN 70 2HD2 ASN 70 20.997 -2.398 -0.068 1183 H TRP 71 H TRP 71 16.673 -2.994 3.709 1184 HA TRP 71 HA TRP 71 16.798 -3.007 6.512 1185 1HB TRP 71 1HB TRP 71 15.082 -1.751 5.389 1186 2HB TRP 71 2HB TRP 71 14.461 -3.199 4.605 1187 HD1 TRP 71 HD1 TRP 71 14.501 -1.415 7.989 1188 HE1 TRP 71 HE1 TRP 71 12.577 -2.326 9.440 1189 HE3 TRP 71 HE3 TRP 71 12.987 -5.261 4.975 1190 HZ2 TRP 71 HZ2 TRP 71 10.682 -4.403 9.314 1191 HZ3 TRP 71 HZ3 TRP 71 11.106 -6.669 5.721 1192 HH2 TRP 71 HH2 TRP 71 9.978 -6.242 7.845 1193 H LEU 72 H LEU 72 15.387 -5.341 4.262 1194 HA LEU 72 HA LEU 72 14.349 -7.153 6.034 1195 1HB LEU 72 1HB LEU 72 14.517 -6.963 3.357 1196 2HB LEU 72 2HB LEU 72 15.645 -8.281 3.635 1197 HG LEU 72 HG LEU 72 13.419 -8.960 5.156 1198 1HD1 LEU 72 1HD1 LEU 72 11.631 -8.875 3.375 1199 2HD1 LEU 72 2HD1 LEU 72 12.628 -7.671 2.563 1200 3HD1 LEU 72 3HD1 LEU 72 12.003 -7.352 4.179 1201 1HD2 LEU 72 1HD2 LEU 72 15.005 -10.303 3.650 1202 2HD2 LEU 72 2HD2 LEU 72 13.875 -9.918 2.353 1203 3HD2 LEU 72 3HD2 LEU 72 13.324 -10.824 3.760 1204 H LYS 73 H LYS 73 17.598 -7.233 4.597 1205 HA LYS 73 HA LYS 73 18.210 -9.617 6.076 1206 1HB LYS 73 1HB LYS 73 20.123 -7.983 4.422 1207 2HB LYS 73 2HB LYS 73 20.212 -9.699 4.801 1208 1HG LYS 73 1HG LYS 73 18.214 -10.112 3.451 1209 2HG LYS 73 2HG LYS 73 18.095 -8.388 3.095 1210 1HD LYS 73 1HD LYS 73 19.755 -10.448 1.866 1211 2HD LYS 73 2HD LYS 73 19.265 -8.873 1.247 1212 1HE LYS 73 1HE LYS 73 21.311 -8.881 3.382 1213 2HE LYS 73 2HE LYS 73 21.807 -9.517 1.816 1214 1HZ LYS 73 1HZ LYS 73 20.536 -7.252 1.116 1215 2HZ LYS 73 2HZ LYS 73 22.212 -7.381 1.357 1216 3HZ LYS 73 3HZ LYS 73 21.223 -6.802 2.605 1217 H GLU 74 H GLU 74 18.472 -6.308 6.773 1218 HA GLU 74 HA GLU 74 20.651 -6.731 8.688 1219 1HB GLU 74 1HB GLU 74 20.109 -4.590 7.116 1220 2HB GLU 74 2HB GLU 74 19.293 -4.107 8.598 1221 1HG GLU 74 1HG GLU 74 22.051 -5.144 8.861 1222 2HG GLU 74 2HG GLU 74 21.854 -3.567 8.101 1223 H ASN 75 H ASN 75 17.209 -6.016 8.573 1224 HA ASN 75 HA ASN 75 17.047 -5.604 11.414 1225 1HB ASN 75 1HB ASN 75 15.028 -4.673 11.004 1226 2HB ASN 75 2HB ASN 75 15.574 -4.682 9.333 1227 1HD2 ASN 75 1HD2 ASN 75 14.803 -6.311 7.933 1228 2HD2 ASN 75 2HD2 ASN 75 13.343 -7.174 8.282 1229 H GLU 76 H GLU 76 16.594 -8.285 9.268 1230 HA GLU 76 HA GLU 76 15.647 -9.890 11.543 1231 1HB GLU 76 1HB GLU 76 14.325 -9.367 9.033 1232 2HB GLU 76 2HB GLU 76 14.664 -11.085 9.196 1233 1HG GLU 76 1HG GLU 76 13.395 -9.572 11.440 1234 2HG GLU 76 2HG GLU 76 12.432 -10.145 10.078 Start of MODEL 11 1 1H MET 1 1H MET 1 -73.310 56.878 -25.409 2 2H MET 1 2H MET 1 -71.649 56.706 -25.704 3 3H MET 1 3H MET 1 -72.400 58.205 -25.940 4 HA MET 1 HA MET 1 -71.036 57.599 -23.767 5 1HB MET 1 1HB MET 1 -71.902 59.800 -24.388 6 2HB MET 1 2HB MET 1 -73.532 59.304 -23.951 7 1HG MET 1 1HG MET 1 -71.896 58.838 -21.703 8 2HG MET 1 2HG MET 1 -71.500 60.443 -22.316 9 1HE MET 1 1HE MET 1 -73.811 59.437 -19.335 10 2HE MET 1 2HE MET 1 -73.502 58.183 -20.536 11 3HE MET 1 3HE MET 1 -75.132 58.820 -20.328 12 H SER 2 H SER 2 -74.602 57.222 -23.881 13 HA SER 2 HA SER 2 -74.815 56.119 -21.287 14 1HB SER 2 1HB SER 2 -76.791 55.331 -23.369 15 2HB SER 2 2HB SER 2 -77.061 55.946 -21.738 16 HG SER 2 HG SER 2 -76.798 57.989 -22.431 17 H LEU 3 H LEU 3 -74.242 54.735 -24.449 18 HA LEU 3 HA LEU 3 -74.129 52.033 -23.316 19 1HB LEU 3 1HB LEU 3 -74.814 53.061 -25.870 20 2HB LEU 3 2HB LEU 3 -73.322 52.157 -26.062 21 HG LEU 3 HG LEU 3 -75.373 50.758 -24.501 22 1HD1 LEU 3 1HD1 LEU 3 -75.848 51.530 -27.364 23 2HD1 LEU 3 2HD1 LEU 3 -76.932 51.720 -25.986 24 3HD1 LEU 3 3HD1 LEU 3 -76.585 50.112 -26.621 25 1HD2 LEU 3 1HD2 LEU 3 -73.185 49.840 -25.320 26 2HD2 LEU 3 2HD2 LEU 3 -73.842 49.925 -26.953 27 3HD2 LEU 3 3HD2 LEU 3 -74.603 48.883 -25.749 28 H GLU 4 H GLU 4 -72.239 51.078 -22.874 29 HA GLU 4 HA GLU 4 -69.780 52.356 -23.871 30 1HB GLU 4 1HB GLU 4 -70.636 52.140 -21.177 31 2HB GLU 4 2HB GLU 4 -69.309 51.006 -21.384 32 1HG GLU 4 1HG GLU 4 -68.911 53.698 -22.509 33 2HG GLU 4 2HG GLU 4 -68.973 53.577 -20.751 34 H LYS 5 H LYS 5 -67.879 50.699 -23.280 35 HA LYS 5 HA LYS 5 -68.766 48.047 -24.215 36 1HB LYS 5 1HB LYS 5 -66.580 49.814 -25.143 37 2HB LYS 5 2HB LYS 5 -66.146 48.121 -24.948 38 1HG LYS 5 1HG LYS 5 -68.103 47.539 -26.393 39 2HG LYS 5 2HG LYS 5 -68.307 49.265 -26.703 40 1HD LYS 5 1HD LYS 5 -65.591 48.703 -27.149 41 2HD LYS 5 2HD LYS 5 -66.494 47.398 -27.922 42 1HE LYS 5 1HE LYS 5 -67.942 49.236 -28.937 43 2HE LYS 5 2HE LYS 5 -66.686 50.357 -28.414 44 1HZ LYS 5 1HZ LYS 5 -66.184 49.793 -30.625 45 2HZ LYS 5 2HZ LYS 5 -66.455 48.139 -30.366 46 3HZ LYS 5 3HZ LYS 5 -65.096 48.890 -29.686 47 H ALA 6 H ALA 6 -66.900 46.390 -23.672 48 HA ALA 6 HA ALA 6 -66.637 46.367 -20.827 49 1HB ALA 6 1HB ALA 6 -66.595 44.197 -21.351 50 2HB ALA 6 2HB ALA 6 -64.903 44.436 -21.785 51 3HB ALA 6 3HB ALA 6 -66.151 44.532 -23.026 52 H HIS 7 H HIS 7 -65.438 48.086 -20.132 53 HA HIS 7 HA HIS 7 -62.783 48.481 -21.293 54 1HB HIS 7 1HB HIS 7 -64.809 50.212 -20.128 55 2HB HIS 7 2HB HIS 7 -63.221 50.502 -19.425 56 HD1 HIS 7 HD1 HIS 7 -65.257 51.645 -22.096 57 HD2 HIS 7 HD2 HIS 7 -61.210 50.753 -21.700 58 HE1 HIS 7 HE1 HIS 7 -64.105 52.831 -23.987 59 HE2 HIS 7 HE2 HIS 7 -61.691 52.145 -23.824 60 H THR 8 H THR 8 -63.226 46.249 -19.595 61 HA THR 8 HA THR 8 -61.722 46.964 -17.181 62 HB THR 8 HB THR 8 -62.388 44.179 -17.286 63 HG1 THR 8 HG1 THR 8 -64.634 44.325 -17.469 64 1HG2 THR 8 1HG2 THR 8 -62.020 45.431 -15.237 65 2HG2 THR 8 2HG2 THR 8 -63.646 44.749 -15.238 66 3HG2 THR 8 3HG2 THR 8 -63.408 46.461 -15.588 67 H SER 9 H SER 9 -59.617 46.499 -17.044 68 HA SER 9 HA SER 9 -58.245 45.493 -19.317 69 1HB SER 9 1HB SER 9 -56.581 45.583 -16.967 70 2HB SER 9 2HB SER 9 -56.566 46.640 -18.381 71 HG SER 9 HG SER 9 -57.626 48.103 -17.295 72 H VAL 10 H VAL 10 -58.114 43.421 -19.840 73 HA VAL 10 HA VAL 10 -58.368 41.350 -17.814 74 HB VAL 10 HB VAL 10 -57.897 40.974 -20.775 75 1HG1 VAL 10 1HG1 VAL 10 -59.314 39.110 -18.902 76 2HG1 VAL 10 2HG1 VAL 10 -57.562 39.070 -19.096 77 3HG1 VAL 10 3HG1 VAL 10 -58.610 38.769 -20.482 78 1HG2 VAL 10 1HG2 VAL 10 -59.925 42.386 -20.187 79 2HG2 VAL 10 2HG2 VAL 10 -60.584 40.937 -19.426 80 3HG2 VAL 10 3HG2 VAL 10 -60.223 40.939 -21.151 81 H LYS 11 H LYS 11 -56.385 41.813 -16.695 82 HA LYS 11 HA LYS 11 -54.076 40.557 -17.974 83 1HB LYS 11 1HB LYS 11 -54.167 43.178 -18.153 84 2HB LYS 11 2HB LYS 11 -53.651 43.110 -16.473 85 1HG LYS 11 1HG LYS 11 -51.773 43.360 -18.040 86 2HG LYS 11 2HG LYS 11 -51.669 41.882 -17.082 87 1HD LYS 11 1HD LYS 11 -52.849 40.768 -19.087 88 2HD LYS 11 2HD LYS 11 -52.360 42.209 -19.978 89 1HE LYS 11 1HE LYS 11 -50.730 40.425 -20.262 90 2HE LYS 11 2HE LYS 11 -50.025 41.783 -19.387 91 1HZ LYS 11 1HZ LYS 11 -49.460 39.585 -18.450 92 2HZ LYS 11 2HZ LYS 11 -51.095 39.340 -18.078 93 3HZ LYS 11 3HZ LYS 11 -50.234 40.603 -17.338 94 H LYS 12 H LYS 12 -53.232 39.112 -16.670 95 HA LYS 12 HA LYS 12 -53.320 39.570 -13.761 96 1HB LYS 12 1HB LYS 12 -54.944 37.793 -14.541 97 2HB LYS 12 2HB LYS 12 -53.556 36.860 -15.086 98 1HG LYS 12 1HG LYS 12 -52.999 36.222 -13.004 99 2HG LYS 12 2HG LYS 12 -53.424 37.782 -12.299 100 1HD LYS 12 1HD LYS 12 -55.788 37.202 -12.410 101 2HD LYS 12 2HD LYS 12 -55.384 35.659 -13.165 102 1HE LYS 12 1HE LYS 12 -53.850 35.831 -10.809 103 2HE LYS 12 2HE LYS 12 -55.482 36.342 -10.383 104 1HZ LYS 12 1HZ LYS 12 -56.367 34.309 -10.965 105 2HZ LYS 12 2HZ LYS 12 -54.882 33.856 -10.288 106 3HZ LYS 12 3HZ LYS 12 -55.064 33.895 -11.971 107 H MET 13 H MET 13 -51.423 39.183 -12.690 108 HA MET 13 HA MET 13 -49.172 38.202 -14.324 109 1HB MET 13 1HB MET 13 -49.209 40.701 -13.922 110 2HB MET 13 2HB MET 13 -48.981 40.352 -12.216 111 1HG MET 13 1HG MET 13 -46.949 40.914 -13.752 112 2HG MET 13 2HG MET 13 -46.815 39.690 -12.493 113 1HE MET 13 1HE MET 13 -45.483 40.416 -15.713 114 2HE MET 13 2HE MET 13 -47.148 40.425 -16.294 115 3HE MET 13 3HE MET 13 -46.021 39.197 -16.870 116 H THR 14 H THR 14 -47.968 36.643 -13.453 117 HA THR 14 HA THR 14 -48.586 35.772 -10.732 118 HB THR 14 HB THR 14 -46.753 34.011 -12.001 119 HG1 THR 14 HG1 THR 14 -49.027 34.674 -13.604 120 1HG2 THR 14 1HG2 THR 14 -48.357 33.272 -10.377 121 2HG2 THR 14 2HG2 THR 14 -48.708 32.459 -11.899 122 3HG2 THR 14 3HG2 THR 14 -49.698 33.822 -11.384 123 H PHE 15 H PHE 15 -46.650 34.865 -9.494 124 HA PHE 15 HA PHE 15 -44.711 36.981 -9.258 125 1HB PHE 15 1HB PHE 15 -44.934 34.361 -7.756 126 2HB PHE 15 2HB PHE 15 -43.887 35.707 -7.318 127 HD1 PHE 15 HD1 PHE 15 -45.391 38.043 -7.380 128 HD2 PHE 15 HD2 PHE 15 -46.715 34.134 -6.349 129 HE1 PHE 15 HE1 PHE 15 -47.205 39.018 -6.040 130 HE2 PHE 15 HE2 PHE 15 -48.529 35.103 -4.995 131 HZ PHE 15 HZ PHE 15 -48.774 37.540 -4.830 132 H GLY 16 H GLY 16 -44.783 33.675 -10.408 133 1HA GLY 16 1HA GLY 16 -43.310 32.526 -11.749 134 2HA GLY 16 2HA GLY 16 -42.478 34.048 -12.032 135 H GLU 17 H GLU 17 -42.984 31.867 -9.255 136 HA GLU 17 HA GLU 17 -40.292 32.389 -8.331 137 1HB GLU 17 1HB GLU 17 -42.021 30.263 -7.136 138 2HB GLU 17 2HB GLU 17 -40.908 31.371 -6.347 139 1HG GLU 17 1HG GLU 17 -42.673 32.563 -5.738 140 2HG GLU 17 2HG GLU 17 -42.862 33.013 -7.432 141 H ASN 18 H ASN 18 -38.608 31.331 -9.122 142 HA ASN 18 HA ASN 18 -38.965 28.958 -10.693 143 1HB ASN 18 1HB ASN 18 -37.346 30.638 -11.382 144 2HB ASN 18 2HB ASN 18 -36.455 30.444 -9.877 145 1HD2 ASN 18 1HD2 ASN 18 -37.423 28.839 -12.844 146 2HD2 ASN 18 2HD2 ASN 18 -36.113 27.702 -12.876 147 H ARG 19 H ARG 19 -36.533 29.464 -8.160 148 HA ARG 19 HA ARG 19 -35.645 28.088 -6.594 149 1HB ARG 19 1HB ARG 19 -38.560 27.801 -6.357 150 2HB ARG 19 2HB ARG 19 -37.646 26.473 -5.654 151 1HG ARG 19 1HG ARG 19 -36.781 29.234 -4.999 152 2HG ARG 19 2HG ARG 19 -38.275 28.641 -4.272 153 1HD ARG 19 1HD ARG 19 -36.685 28.023 -2.708 154 2HD ARG 19 2HD ARG 19 -36.862 26.556 -3.669 155 HE ARG 19 HE ARG 19 -34.749 28.374 -4.506 156 1HH1 ARG 19 1HH1 ARG 19 -35.611 25.553 -2.603 157 2HH1 ARG 19 2HH1 ARG 19 -33.997 24.908 -2.595 158 1HH2 ARG 19 1HH2 ARG 19 -32.624 27.546 -4.471 159 2HH2 ARG 19 2HH2 ARG 19 -32.292 26.040 -3.651 160 H ASP 20 H ASP 20 -35.392 27.185 -9.248 161 HA ASP 20 HA ASP 20 -35.334 24.271 -8.816 162 1HB ASP 20 1HB ASP 20 -37.177 24.774 -10.326 163 2HB ASP 20 2HB ASP 20 -36.108 25.718 -11.359 164 H LEU 21 H LEU 21 -33.805 27.119 -10.062 165 HA LEU 21 HA LEU 21 -31.683 25.724 -11.414 166 1HB LEU 21 1HB LEU 21 -32.586 28.465 -11.083 167 2HB LEU 21 2HB LEU 21 -30.843 28.336 -10.960 168 HG LEU 21 HG LEU 21 -31.367 26.839 -13.200 169 1HD1 LEU 21 1HD1 LEU 21 -33.657 27.409 -13.373 170 2HD1 LEU 21 2HD1 LEU 21 -32.807 28.370 -14.582 171 3HD1 LEU 21 3HD1 LEU 21 -33.329 29.115 -13.072 172 1HD2 LEU 21 1HD2 LEU 21 -30.242 28.529 -14.360 173 2HD2 LEU 21 2HD2 LEU 21 -29.665 28.679 -12.701 174 3HD2 LEU 21 3HD2 LEU 21 -30.883 29.797 -13.316 175 H GLU 22 H GLU 22 -31.704 24.617 -8.992 176 HA GLU 22 HA GLU 22 -29.683 25.974 -7.362 177 1HB GLU 22 1HB GLU 22 -31.642 25.220 -6.146 178 2HB GLU 22 2HB GLU 22 -31.447 23.588 -6.771 179 1HG GLU 22 1HG GLU 22 -29.611 23.155 -5.426 180 2HG GLU 22 2HG GLU 22 -29.277 24.865 -5.163 181 H ARG 23 H ARG 23 -27.662 25.270 -7.203 182 HA ARG 23 HA ARG 23 -26.995 22.608 -8.269 183 1HB ARG 23 1HB ARG 23 -26.354 24.924 -9.588 184 2HB ARG 23 2HB ARG 23 -24.923 24.676 -8.599 185 1HG ARG 23 1HG ARG 23 -24.408 23.597 -10.576 186 2HG ARG 23 2HG ARG 23 -24.951 22.281 -9.533 187 1HD ARG 23 1HD ARG 23 -25.903 22.098 -11.775 188 2HD ARG 23 2HD ARG 23 -27.154 22.356 -10.562 189 HE ARG 23 HE ARG 23 -26.158 24.702 -11.994 190 1HH1 ARG 23 1HH1 ARG 23 -28.686 22.326 -11.521 191 2HH1 ARG 23 2HH1 ARG 23 -29.884 23.230 -12.402 192 1HH2 ARG 23 1HH2 ARG 23 -27.717 25.882 -13.199 193 2HH2 ARG 23 2HH2 ARG 23 -29.317 25.223 -13.412 194 H VAL 24 H VAL 24 -25.984 21.426 -6.782 195 HA VAL 24 HA VAL 24 -24.891 22.793 -4.430 196 HB VAL 24 HB VAL 24 -25.180 19.812 -4.646 197 1HG1 VAL 24 1HG1 VAL 24 -24.622 19.876 -2.500 198 2HG1 VAL 24 2HG1 VAL 24 -25.945 20.986 -2.150 199 3HG1 VAL 24 3HG1 VAL 24 -24.372 21.616 -2.647 200 1HG2 VAL 24 1HG2 VAL 24 -27.441 21.279 -3.457 201 2HG2 VAL 24 2HG2 VAL 24 -27.421 19.789 -4.400 202 3HG2 VAL 24 3HG2 VAL 24 -27.321 21.349 -5.215 203 H VAL 25 H VAL 25 -22.783 22.727 -3.894 204 HA VAL 25 HA VAL 25 -20.993 21.223 -5.693 205 HB VAL 25 HB VAL 25 -20.060 23.576 -4.081 206 1HG1 VAL 25 1HG1 VAL 25 -18.264 22.450 -5.041 207 2HG1 VAL 25 2HG1 VAL 25 -18.584 23.752 -6.187 208 3HG1 VAL 25 3HG1 VAL 25 -19.144 22.115 -6.533 209 1HG2 VAL 25 1HG2 VAL 25 -22.135 24.110 -5.532 210 2HG2 VAL 25 2HG2 VAL 25 -21.028 23.931 -6.896 211 3HG2 VAL 25 3HG2 VAL 25 -20.715 25.150 -5.657 212 H THR 26 H THR 26 -20.617 19.375 -4.620 213 HA THR 26 HA THR 26 -19.611 19.587 -1.857 214 HB THR 26 HB THR 26 -20.724 17.003 -2.863 215 HG1 THR 26 HG1 THR 26 -22.608 18.658 -1.676 216 1HG2 THR 26 1HG2 THR 26 -19.673 17.449 -0.562 217 2HG2 THR 26 2HG2 THR 26 -21.216 16.598 -0.609 218 3HG2 THR 26 3HG2 THR 26 -21.166 18.312 -0.195 219 H ALA 27 H ALA 27 -17.583 20.013 -3.202 220 HA ALA 27 HA ALA 27 -16.422 17.503 -4.205 221 1HB ALA 27 1HB ALA 27 -14.790 19.085 -5.350 222 2HB ALA 27 2HB ALA 27 -15.897 20.379 -4.889 223 3HB ALA 27 3HB ALA 27 -16.451 19.078 -5.946 224 HA PRO 28 HA PRO 28 -14.017 17.900 -0.363 225 1HB PRO 28 1HB PRO 28 -13.195 15.176 -1.122 226 2HB PRO 28 2HB PRO 28 -13.968 15.740 0.362 227 1HG PRO 28 1HG PRO 28 -15.288 14.257 -1.447 228 2HG PRO 28 2HG PRO 28 -16.095 15.531 -0.510 229 1HD PRO 28 1HD PRO 28 -15.104 15.591 -3.337 230 2HD PRO 28 2HD PRO 28 -16.615 16.236 -2.660 231 H VAL 29 H VAL 29 -12.216 19.071 -0.611 232 HA VAL 29 HA VAL 29 -10.554 18.985 -2.866 233 HB VAL 29 HB VAL 29 -10.575 20.994 -1.608 234 1HG1 VAL 29 1HG1 VAL 29 -10.573 21.171 0.616 235 2HG1 VAL 29 2HG1 VAL 29 -9.188 20.091 0.795 236 3HG1 VAL 29 3HG1 VAL 29 -10.812 19.424 0.617 237 1HG2 VAL 29 1HG2 VAL 29 -8.417 21.488 -1.882 238 2HG2 VAL 29 2HG2 VAL 29 -8.244 19.809 -2.389 239 3HG2 VAL 29 3HG2 VAL 29 -7.889 20.268 -0.726 240 H SER 30 H SER 30 -9.383 17.328 -3.465 241 HA SER 30 HA SER 30 -8.182 15.587 -1.437 242 1HB SER 30 1HB SER 30 -8.045 14.809 -4.286 243 2HB SER 30 2HB SER 30 -8.518 13.858 -2.879 244 HG SER 30 HG SER 30 -10.407 15.625 -3.113 245 H SER 31 H SER 31 -6.159 15.976 -0.928 246 HA SER 31 HA SER 31 -4.487 17.717 -2.378 247 1HB SER 31 1HB SER 31 -3.262 15.843 -0.426 248 2HB SER 31 2HB SER 31 -3.100 17.592 -0.563 249 HG SER 31 HG SER 31 -5.123 17.834 0.396 250 H GLY 32 H GLY 32 -3.551 17.256 -4.261 251 1HA GLY 32 1HA GLY 32 -2.881 14.512 -4.961 252 2HA GLY 32 2HA GLY 32 -2.742 15.920 -6.005 253 H LYS 33 H LYS 33 -1.373 14.973 -2.857 254 HA LYS 33 HA LYS 33 1.281 15.689 -3.924 255 1HB LYS 33 1HB LYS 33 -0.098 16.496 -1.520 256 2HB LYS 33 2HB LYS 33 1.400 15.672 -1.111 257 1HG LYS 33 1HG LYS 33 2.077 17.401 -3.185 258 2HG LYS 33 2HG LYS 33 0.990 18.325 -2.145 259 1HD LYS 33 1HD LYS 33 2.376 17.852 -0.220 260 2HD LYS 33 2HD LYS 33 3.417 16.807 -1.192 261 1HE LYS 33 1HE LYS 33 3.899 18.817 -2.628 262 2HE LYS 33 2HE LYS 33 3.065 19.789 -1.415 263 1HZ LYS 33 1HZ LYS 33 4.770 18.490 0.136 264 2HZ LYS 33 2HZ LYS 33 5.156 19.963 -0.615 265 3HZ LYS 33 3HZ LYS 33 5.674 18.496 -1.298 266 H ILE 34 H ILE 34 -0.328 13.104 -3.771 267 HA ILE 34 HA ILE 34 1.762 11.500 -2.460 268 HB ILE 34 HB ILE 34 -0.457 9.827 -2.775 269 1HG1 ILE 34 1HG1 ILE 34 -1.327 12.361 -1.374 270 2HG1 ILE 34 2HG1 ILE 34 -1.774 11.989 -3.037 271 1HG2 ILE 34 1HG2 ILE 34 -0.329 9.620 -0.410 272 2HG2 ILE 34 2HG2 ILE 34 0.379 11.227 -0.247 273 3HG2 ILE 34 3HG2 ILE 34 1.307 9.926 -0.990 274 1HD1 ILE 34 1HD1 ILE 34 -2.580 9.730 -1.877 275 2HD1 ILE 34 2HD1 ILE 34 -3.600 11.163 -2.002 276 3HD1 ILE 34 3HD1 ILE 34 -2.737 10.824 -0.502 277 H LYS 35 H LYS 35 2.643 9.862 -3.587 278 HA LYS 35 HA LYS 35 1.826 9.602 -6.405 279 1HB LYS 35 1HB LYS 35 4.633 9.163 -5.373 280 2HB LYS 35 2HB LYS 35 4.100 9.420 -7.034 281 1HG LYS 35 1HG LYS 35 3.409 11.637 -5.297 282 2HG LYS 35 2HG LYS 35 5.143 11.317 -5.335 283 1HD LYS 35 1HD LYS 35 4.840 12.797 -7.099 284 2HD LYS 35 2HD LYS 35 4.847 11.222 -7.892 285 1HE LYS 35 1HE LYS 35 2.586 11.269 -8.315 286 2HE LYS 35 2HE LYS 35 2.253 12.382 -6.989 287 1HZ LYS 35 1HZ LYS 35 2.506 14.129 -8.319 288 2HZ LYS 35 2HZ LYS 35 2.441 13.047 -9.621 289 3HZ LYS 35 3HZ LYS 35 3.940 13.534 -8.996 290 H ARG 36 H ARG 36 1.251 7.607 -7.042 291 HA ARG 36 HA ARG 36 1.630 5.450 -5.088 292 1HB ARG 36 1HB ARG 36 -0.178 5.067 -7.410 293 2HB ARG 36 2HB ARG 36 -0.378 4.579 -5.734 294 1HG ARG 36 1HG ARG 36 -1.544 6.404 -5.230 295 2HG ARG 36 2HG ARG 36 -0.429 7.467 -6.093 296 1HD ARG 36 1HD ARG 36 -2.364 7.708 -7.326 297 2HD ARG 36 2HD ARG 36 -1.522 6.441 -8.217 298 HE ARG 36 HE ARG 36 -2.984 4.824 -7.152 299 1HH1 ARG 36 1HH1 ARG 36 -3.935 8.195 -6.973 300 2HH1 ARG 36 2HH1 ARG 36 -5.613 7.834 -6.661 301 1HH2 ARG 36 1HH2 ARG 36 -5.165 4.350 -6.715 302 2HH2 ARG 36 2HH2 ARG 36 -6.312 5.639 -6.511 303 H VAL 37 H VAL 37 2.809 3.730 -5.472 304 HA VAL 37 HA VAL 37 3.658 3.162 -8.233 305 HB VAL 37 HB VAL 37 5.373 3.569 -5.811 306 1HG1 VAL 37 1HG1 VAL 37 6.255 1.938 -8.188 307 2HG1 VAL 37 2HG1 VAL 37 5.833 1.266 -6.613 308 3HG1 VAL 37 3HG1 VAL 37 7.211 2.359 -6.765 309 1HG2 VAL 37 1HG2 VAL 37 6.518 5.072 -7.098 310 2HG2 VAL 37 2HG2 VAL 37 4.927 5.190 -7.843 311 3HG2 VAL 37 3HG2 VAL 37 6.182 4.212 -8.601 312 H ASN 38 H ASN 38 3.286 1.141 -8.797 313 HA ASN 38 HA ASN 38 2.664 -0.827 -6.704 314 1HB ASN 38 1HB ASN 38 1.019 -0.240 -8.588 315 2HB ASN 38 2HB ASN 38 2.113 -1.099 -9.663 316 1HD2 ASN 38 1HD2 ASN 38 2.457 -3.357 -9.303 317 2HD2 ASN 38 2HD2 ASN 38 1.221 -4.302 -8.540 318 H VAL 39 H VAL 39 4.064 -2.413 -6.293 319 HA VAL 39 HA VAL 39 5.965 -3.189 -8.397 320 HB VAL 39 HB VAL 39 7.494 -3.492 -6.169 321 1HG1 VAL 39 1HG1 VAL 39 7.901 -2.412 -8.470 322 2HG1 VAL 39 2HG1 VAL 39 8.867 -1.868 -7.097 323 3HG1 VAL 39 3HG1 VAL 39 7.505 -0.897 -7.658 324 1HG2 VAL 39 1HG2 VAL 39 5.596 -1.257 -5.673 325 2HG2 VAL 39 2HG2 VAL 39 7.286 -1.032 -5.213 326 3HG2 VAL 39 3HG2 VAL 39 6.356 -2.370 -4.536 327 H ASN 40 H ASN 40 7.013 -5.236 -8.021 328 HA ASN 40 HA ASN 40 5.273 -7.103 -6.566 329 1HB ASN 40 1HB ASN 40 7.285 -8.149 -8.480 330 2HB ASN 40 2HB ASN 40 5.633 -8.680 -8.188 331 1HD2 ASN 40 1HD2 ASN 40 7.658 -6.390 -9.869 332 2HD2 ASN 40 2HD2 ASN 40 6.472 -5.907 -11.045 333 H PHE 41 H PHE 41 6.048 -8.068 -4.823 334 HA PHE 41 HA PHE 41 8.952 -7.909 -4.322 335 1HB PHE 41 1HB PHE 41 6.619 -7.894 -2.402 336 2HB PHE 41 2HB PHE 41 8.288 -8.108 -1.888 337 HD1 PHE 41 HD1 PHE 41 9.273 -6.139 -4.160 338 HD2 PHE 41 HD2 PHE 41 6.413 -5.901 -1.020 339 HE1 PHE 41 HE1 PHE 41 9.556 -3.700 -4.094 340 HE2 PHE 41 HE2 PHE 41 6.703 -3.461 -0.942 341 HZ PHE 41 HZ PHE 41 8.275 -2.362 -2.480 342 H ASP 42 H ASP 42 10.012 -9.705 -3.511 343 HA ASP 42 HA ASP 42 9.007 -12.209 -4.404 344 1HB ASP 42 1HB ASP 42 11.421 -11.564 -4.336 345 2HB ASP 42 2HB ASP 42 11.361 -11.702 -2.581 346 H GLU 43 H GLU 43 8.452 -14.051 -3.205 347 HA GLU 43 HA GLU 43 6.803 -13.576 -0.983 348 1HB GLU 43 1HB GLU 43 7.216 -15.675 -2.727 349 2HB GLU 43 2HB GLU 43 7.746 -16.327 -1.183 350 1HG GLU 43 1HG GLU 43 5.143 -14.898 -1.314 351 2HG GLU 43 2HG GLU 43 5.256 -16.530 -1.968 352 H GLU 44 H GLU 44 10.167 -14.564 -1.193 353 HA GLU 44 HA GLU 44 10.476 -15.348 1.538 354 1HB GLU 44 1HB GLU 44 12.044 -15.769 -0.480 355 2HB GLU 44 2HB GLU 44 12.639 -14.143 -0.166 356 1HG GLU 44 1HG GLU 44 12.757 -15.278 2.311 357 2HG GLU 44 2HG GLU 44 13.138 -16.640 1.259 358 H LYS 45 H LYS 45 11.087 -12.373 -0.267 359 HA LYS 45 HA LYS 45 11.886 -10.794 1.934 360 1HB LYS 45 1HB LYS 45 10.608 -9.956 -0.679 361 2HB LYS 45 2HB LYS 45 11.391 -8.870 0.462 362 1HG LYS 45 1HG LYS 45 13.157 -11.028 -0.222 363 2HG LYS 45 2HG LYS 45 12.557 -10.234 -1.680 364 1HD LYS 45 1HD LYS 45 13.886 -8.488 -1.335 365 2HD LYS 45 2HD LYS 45 13.235 -8.262 0.288 366 1HE LYS 45 1HE LYS 45 15.456 -8.625 0.741 367 2HE LYS 45 2HE LYS 45 14.805 -10.256 0.886 368 1HZ LYS 45 1HZ LYS 45 16.127 -10.940 -0.734 369 2HZ LYS 45 2HZ LYS 45 16.861 -9.408 -0.765 370 3HZ LYS 45 3HZ LYS 45 15.553 -9.743 -1.795 371 H HIS 46 H HIS 46 8.796 -11.701 0.605 372 HA HIS 46 HA HIS 46 7.245 -9.792 2.064 373 1HB HIS 46 1HB HIS 46 6.594 -11.215 -0.037 374 2HB HIS 46 2HB HIS 46 6.094 -12.405 1.163 375 HD1 HIS 46 HD1 HIS 46 3.836 -12.074 2.212 376 HD2 HIS 46 HD2 HIS 46 5.207 -8.670 0.247 377 HE1 HIS 46 HE1 HIS 46 1.921 -10.450 2.255 378 HE2 HIS 46 HE2 HIS 46 2.796 -8.364 1.138 379 H THR 47 H THR 47 8.439 -13.012 2.692 380 HA THR 47 HA THR 47 6.848 -13.598 4.956 381 HB THR 47 HB THR 47 9.659 -14.597 4.435 382 HG1 THR 47 HG1 THR 47 8.113 -14.889 2.644 383 1HG2 THR 47 1HG2 THR 47 8.135 -14.982 6.630 384 2HG2 THR 47 2HG2 THR 47 9.295 -16.160 6.024 385 3HG2 THR 47 3HG2 THR 47 7.587 -16.321 5.625 386 H ARG 48 H ARG 48 10.106 -12.238 4.612 387 HA ARG 48 HA ARG 48 10.470 -11.707 7.385 388 1HB ARG 48 1HB ARG 48 12.348 -11.841 5.771 389 2HB ARG 48 2HB ARG 48 11.777 -10.361 5.011 390 1HG ARG 48 1HG ARG 48 12.952 -9.161 6.445 391 2HG ARG 48 2HG ARG 48 12.047 -9.860 7.788 392 1HD ARG 48 1HD ARG 48 14.737 -10.506 6.763 393 2HD ARG 48 2HD ARG 48 14.105 -10.566 8.408 394 HE ARG 48 HE ARG 48 13.939 -12.678 6.379 395 1HH1 ARG 48 1HH1 ARG 48 13.289 -11.562 9.635 396 2HH1 ARG 48 2HH1 ARG 48 12.919 -13.149 10.244 397 1HH2 ARG 48 1HH2 ARG 48 13.431 -14.762 7.162 398 2HH2 ARG 48 2HH2 ARG 48 13.001 -14.971 8.835 399 H PHE 49 H PHE 49 9.199 -9.894 4.663 400 HA PHE 49 HA PHE 49 8.974 -7.346 5.711 401 1HB PHE 49 1HB PHE 49 7.826 -8.853 3.549 402 2HB PHE 49 2HB PHE 49 6.585 -7.855 4.290 403 HD1 PHE 49 HD1 PHE 49 10.134 -6.897 4.163 404 HD2 PHE 49 HD2 PHE 49 6.278 -6.421 2.431 405 HE1 PHE 49 HE1 PHE 49 10.945 -4.956 2.891 406 HE2 PHE 49 HE2 PHE 49 7.085 -4.482 1.155 407 HZ PHE 49 HZ PHE 49 9.422 -3.749 1.381 408 H LYS 50 H LYS 50 6.449 -9.859 5.755 409 HA LYS 50 HA LYS 50 4.680 -8.423 7.392 410 1HB LYS 50 1HB LYS 50 4.921 -11.233 6.461 411 2HB LYS 50 2HB LYS 50 3.886 -10.946 7.854 412 1HG LYS 50 1HG LYS 50 2.928 -9.035 6.305 413 2HG LYS 50 2HG LYS 50 3.562 -10.084 5.035 414 1HD LYS 50 1HD LYS 50 1.342 -10.780 5.331 415 2HD LYS 50 2HD LYS 50 2.309 -11.973 6.203 416 1HE LYS 50 1HE LYS 50 0.642 -11.521 7.727 417 2HE LYS 50 2HE LYS 50 1.907 -10.407 8.244 418 1HZ LYS 50 1HZ LYS 50 -0.174 -9.260 8.193 419 2HZ LYS 50 2HZ LYS 50 -0.479 -9.750 6.599 420 3HZ LYS 50 3HZ LYS 50 0.782 -8.663 6.924 421 H ALA 51 H ALA 51 7.143 -10.826 8.208 422 HA ALA 51 HA ALA 51 6.491 -11.083 10.936 423 1HB ALA 51 1HB ALA 51 7.912 -12.759 10.508 424 2HB ALA 51 2HB ALA 51 9.181 -11.583 10.854 425 3HB ALA 51 3HB ALA 51 8.692 -11.885 9.185 426 H ALA 52 H ALA 52 8.921 -9.076 9.308 427 HA ALA 52 HA ALA 52 9.857 -7.829 11.673 428 1HB ALA 52 1HB ALA 52 11.013 -8.058 9.401 429 2HB ALA 52 2HB ALA 52 11.222 -6.552 10.294 430 3HB ALA 52 3HB ALA 52 10.091 -6.623 8.945 431 H CYS 53 H CYS 53 7.455 -6.924 9.239 432 HA CYS 53 HA CYS 53 7.013 -4.298 10.165 433 1HB CYS 53 1HB CYS 53 5.652 -4.190 8.390 434 2HB CYS 53 2HB CYS 53 6.106 -5.852 8.049 435 HG CYS 53 HG CYS 53 3.229 -4.642 9.352 436 H ALA 54 H ALA 54 5.628 -7.402 11.058 437 HA ALA 54 HA ALA 54 3.611 -6.364 12.776 438 1HB ALA 54 1HB ALA 54 2.990 -8.497 12.927 439 2HB ALA 54 2HB ALA 54 4.571 -8.988 13.533 440 3HB ALA 54 3HB ALA 54 4.292 -8.863 11.797 441 H ARG 55 H ARG 55 6.954 -7.385 13.216 442 HA ARG 55 HA ARG 55 7.007 -7.198 16.042 443 1HB ARG 55 1HB ARG 55 8.719 -8.418 14.761 444 2HB ARG 55 2HB ARG 55 9.276 -6.906 14.060 445 1HG ARG 55 1HG ARG 55 9.362 -6.486 16.809 446 2HG ARG 55 2HG ARG 55 9.961 -8.130 16.578 447 1HD ARG 55 1HD ARG 55 11.461 -7.182 14.773 448 2HD ARG 55 2HD ARG 55 11.002 -5.585 15.359 449 HE ARG 55 HE ARG 55 11.856 -6.830 17.605 450 1HH1 ARG 55 1HH1 ARG 55 13.279 -6.457 14.428 451 2HH1 ARG 55 2HH1 ARG 55 14.916 -6.409 15.027 452 1HH2 ARG 55 1HH2 ARG 55 13.976 -6.797 18.394 453 2HH2 ARG 55 2HH2 ARG 55 15.317 -6.615 17.294 454 H LYS 56 H LYS 56 7.832 -4.917 13.459 455 HA LYS 56 HA LYS 56 8.639 -2.817 15.193 456 1HB LYS 56 1HB LYS 56 7.842 -2.952 12.302 457 2HB LYS 56 2HB LYS 56 8.123 -1.400 13.079 458 1HG LYS 56 1HG LYS 56 10.297 -3.140 13.691 459 2HG LYS 56 2HG LYS 56 10.015 -3.158 11.948 460 1HD LYS 56 1HD LYS 56 9.887 -0.563 12.239 461 2HD LYS 56 2HD LYS 56 10.773 -0.881 13.731 462 1HE LYS 56 1HE LYS 56 11.858 -2.281 11.407 463 2HE LYS 56 2HE LYS 56 11.888 -0.526 11.246 464 1HZ LYS 56 1HZ LYS 56 12.968 -0.485 13.493 465 2HZ LYS 56 2HZ LYS 56 13.909 -1.161 12.254 466 3HZ LYS 56 3HZ LYS 56 13.134 -2.170 13.376 467 H GLY 57 H GLY 57 5.568 -3.763 13.774 468 1HA GLY 57 1HA GLY 57 3.488 -3.338 14.802 469 2HA GLY 57 2HA GLY 57 4.220 -2.009 15.688 470 H THR 58 H THR 58 4.142 -2.741 12.221 471 HA THR 58 HA THR 58 2.415 -0.461 11.745 472 HB THR 58 HB THR 58 4.841 0.358 11.843 473 HG1 THR 58 HG1 THR 58 4.453 1.584 9.781 474 1HG2 THR 58 1HG2 THR 58 6.341 -0.123 10.151 475 2HG2 THR 58 2HG2 THR 58 5.084 -0.670 9.045 476 3HG2 THR 58 3HG2 THR 58 5.571 -1.692 10.397 477 H SER 59 H SER 59 1.806 -0.308 9.425 478 HA SER 59 HA SER 59 1.113 -2.882 8.436 479 1HB SER 59 1HB SER 59 0.724 -0.799 6.491 480 2HB SER 59 2HB SER 59 -0.485 -1.670 7.435 481 HG SER 59 HG SER 59 -0.728 0.362 8.126 482 H ILE 60 H ILE 60 1.595 -3.701 6.283 483 HA ILE 60 HA ILE 60 4.370 -3.669 5.740 484 HB ILE 60 HB ILE 60 2.337 -5.359 5.076 485 1HG1 ILE 60 1HG1 ILE 60 4.914 -5.349 3.529 486 2HG1 ILE 60 2HG1 ILE 60 4.888 -5.652 5.263 487 1HG2 ILE 60 1HG2 ILE 60 3.103 -3.903 2.557 488 2HG2 ILE 60 2HG2 ILE 60 1.490 -4.089 3.249 489 3HG2 ILE 60 3HG2 ILE 60 2.333 -5.491 2.589 490 1HD1 ILE 60 1HD1 ILE 60 2.931 -7.298 4.041 491 2HD1 ILE 60 2HD1 ILE 60 4.405 -7.770 4.887 492 3HD1 ILE 60 3HD1 ILE 60 4.444 -7.468 3.150 493 H THR 61 H THR 61 1.690 -1.813 4.502 494 HA THR 61 HA THR 61 2.905 -0.785 2.184 495 HB THR 61 HB THR 61 1.176 1.144 3.350 496 HG1 THR 61 HG1 THR 61 -0.275 0.006 4.381 497 1HG2 THR 61 1HG2 THR 61 1.119 -0.776 1.073 498 2HG2 THR 61 2HG2 THR 61 1.022 0.986 1.062 499 3HG2 THR 61 3HG2 THR 61 -0.385 0.027 1.529 500 H ASP 62 H ASP 62 2.817 0.268 5.557 501 HA ASP 62 HA ASP 62 4.315 2.667 5.163 502 1HB ASP 62 1HB ASP 62 2.847 2.333 7.123 503 2HB ASP 62 2HB ASP 62 3.912 1.050 7.692 504 H VAL 63 H VAL 63 5.064 -0.673 5.789 505 HA VAL 63 HA VAL 63 7.769 -0.355 6.522 506 HB VAL 63 HB VAL 63 6.045 -2.598 5.710 507 1HG1 VAL 63 1HG1 VAL 63 8.009 -4.125 5.378 508 2HG1 VAL 63 2HG1 VAL 63 9.006 -2.685 5.172 509 3HG1 VAL 63 3HG1 VAL 63 7.694 -3.017 4.041 510 1HG2 VAL 63 1HG2 VAL 63 8.126 -3.293 7.506 511 2HG2 VAL 63 2HG2 VAL 63 6.409 -3.065 7.842 512 3HG2 VAL 63 3HG2 VAL 63 7.519 -1.699 7.949 513 H VAL 64 H VAL 64 6.182 -0.841 3.375 514 HA VAL 64 HA VAL 64 8.543 -0.866 1.823 515 HB VAL 64 HB VAL 64 5.899 0.230 0.866 516 1HG1 VAL 64 1HG1 VAL 64 6.812 0.220 -1.161 517 2HG1 VAL 64 2HG1 VAL 64 7.414 -1.425 -0.957 518 3HG1 VAL 64 3HG1 VAL 64 8.367 -0.057 -0.379 519 1HG2 VAL 64 1HG2 VAL 64 5.632 -1.977 2.015 520 2HG2 VAL 64 2HG2 VAL 64 6.743 -2.664 0.829 521 3HG2 VAL 64 3HG2 VAL 64 5.201 -1.989 0.304 522 H ASN 65 H ASN 65 6.490 1.742 2.999 523 HA ASN 65 HA ASN 65 7.809 3.845 1.630 524 1HB ASN 65 1HB ASN 65 5.649 3.600 3.439 525 2HB ASN 65 2HB ASN 65 6.798 4.709 4.182 526 1HD2 ASN 65 1HD2 ASN 65 4.096 4.926 2.757 527 2HD2 ASN 65 2HD2 ASN 65 4.332 6.227 1.633 528 H GLN 66 H GLN 66 8.460 2.087 4.569 529 HA GLN 66 HA GLN 66 10.357 3.884 5.673 530 1HB GLN 66 1HB GLN 66 9.121 2.037 6.884 531 2HB GLN 66 2HB GLN 66 10.236 0.906 6.131 532 1HG GLN 66 1HG GLN 66 12.091 1.833 7.274 533 2HG GLN 66 2HG GLN 66 11.145 3.218 7.819 534 1HE2 GLN 66 1HE2 GLN 66 9.086 2.480 9.038 535 2HE2 GLN 66 2HE2 GLN 66 9.362 1.306 10.283 536 H LEU 67 H LEU 67 10.691 0.988 3.620 537 HA LEU 67 HA LEU 67 13.525 1.007 3.639 538 1HB LEU 67 1HB LEU 67 12.777 -0.062 1.167 539 2HB LEU 67 2HB LEU 67 13.198 -0.937 2.626 540 HG LEU 67 HG LEU 67 10.416 -0.067 2.598 541 1HD1 LEU 67 1HD1 LEU 67 10.231 -2.221 0.901 542 2HD1 LEU 67 2HD1 LEU 67 11.538 -1.266 0.203 543 3HD1 LEU 67 3HD1 LEU 67 9.959 -0.531 0.472 544 1HD2 LEU 67 1HD2 LEU 67 12.031 -2.484 3.205 545 2HD2 LEU 67 2HD2 LEU 67 10.309 -2.688 2.880 546 3HD2 LEU 67 3HD2 LEU 67 10.839 -1.639 4.193 547 H VAL 68 H VAL 68 11.118 2.458 1.503 548 HA VAL 68 HA VAL 68 12.947 3.553 -0.366 549 HB VAL 68 HB VAL 68 10.165 4.458 0.399 550 1HG1 VAL 68 1HG1 VAL 68 10.143 5.742 -1.657 551 2HG1 VAL 68 2HG1 VAL 68 11.794 5.241 -2.016 552 3HG1 VAL 68 3HG1 VAL 68 11.472 6.282 -0.631 553 1HG2 VAL 68 1HG2 VAL 68 11.208 2.766 -1.862 554 2HG2 VAL 68 2HG2 VAL 68 9.547 3.353 -1.732 555 3HG2 VAL 68 3HG2 VAL 68 10.187 2.237 -0.524 556 H ASP 69 H ASP 69 11.527 4.739 2.630 557 HA ASP 69 HA ASP 69 12.541 7.350 2.657 558 1HB ASP 69 1HB ASP 69 11.215 5.595 4.461 559 2HB ASP 69 2HB ASP 69 12.632 6.224 5.294 560 H ASN 70 H ASN 70 13.833 4.384 4.067 561 HA ASN 70 HA ASN 70 16.276 5.366 5.013 562 1HB ASN 70 1HB ASN 70 15.171 2.696 4.301 563 2HB ASN 70 2HB ASN 70 16.923 2.822 4.440 564 1HD2 ASN 70 1HD2 ASN 70 13.930 2.711 6.090 565 2HD2 ASN 70 2HD2 ASN 70 14.567 2.717 7.698 566 H TRP 71 H TRP 71 15.689 3.482 2.068 567 HA TRP 71 HA TRP 71 18.254 3.582 1.045 568 1HB TRP 71 1HB TRP 71 16.177 2.206 0.345 569 2HB TRP 71 2HB TRP 71 15.827 3.559 -0.722 570 HD1 TRP 71 HD1 TRP 71 18.218 0.633 -0.281 571 HE1 TRP 71 HE1 TRP 71 19.586 0.340 -2.441 572 HE3 TRP 71 HE3 TRP 71 16.723 4.851 -2.750 573 HZ2 TRP 71 HZ2 TRP 71 19.959 1.711 -4.887 574 HZ3 TRP 71 HZ3 TRP 71 17.623 5.274 -5.005 575 HH2 TRP 71 HH2 TRP 71 19.206 3.739 -6.045 576 H LEU 72 H LEU 72 15.502 5.602 0.056 577 HA LEU 72 HA LEU 72 16.910 6.998 -1.883 578 1HB LEU 72 1HB LEU 72 14.290 7.006 -0.785 579 2HB LEU 72 2HB LEU 72 14.841 8.667 -0.882 580 HG LEU 72 HG LEU 72 14.818 6.729 -3.194 581 1HD1 LEU 72 1HD1 LEU 72 12.728 7.350 -3.670 582 2HD1 LEU 72 2HD1 LEU 72 13.072 9.047 -3.338 583 3HD1 LEU 72 3HD1 LEU 72 12.649 7.960 -2.018 584 1HD2 LEU 72 1HD2 LEU 72 15.951 9.387 -2.766 585 2HD2 LEU 72 2HD2 LEU 72 14.911 9.276 -4.185 586 3HD2 LEU 72 3HD2 LEU 72 16.292 8.196 -4.020 587 H LYS 73 H LYS 73 16.147 8.022 1.447 588 HA LYS 73 HA LYS 73 17.468 10.527 0.943 589 1HB LYS 73 1HB LYS 73 16.220 9.510 3.495 590 2HB LYS 73 2HB LYS 73 16.674 11.173 3.144 591 1HG LYS 73 1HG LYS 73 14.868 11.537 1.815 592 2HG LYS 73 2HG LYS 73 14.825 9.864 1.242 593 1HD LYS 73 1HD LYS 73 12.907 10.626 2.739 594 2HD LYS 73 2HD LYS 73 13.714 9.119 3.176 595 1HE LYS 73 1HE LYS 73 15.041 11.319 4.442 596 2HE LYS 73 2HE LYS 73 13.312 11.403 4.779 597 1HZ LYS 73 1HZ LYS 73 13.431 9.051 5.484 598 2HZ LYS 73 2HZ LYS 73 14.362 10.085 6.454 599 3HZ LYS 73 3HZ LYS 73 15.121 9.103 5.299 600 H GLU 74 H GLU 74 18.142 7.706 3.000 601 HA GLU 74 HA GLU 74 20.313 8.967 4.324 602 1HB GLU 74 1HB GLU 74 18.854 6.647 4.687 603 2HB GLU 74 2HB GLU 74 20.453 6.055 4.266 604 1HG GLU 74 1HG GLU 74 19.695 6.632 6.765 605 2HG GLU 74 2HG GLU 74 21.363 6.734 6.204 606 H ASN 75 H ASN 75 20.099 7.020 1.409 607 HA ASN 75 HA ASN 75 23.009 6.872 1.258 608 1HB ASN 75 1HB ASN 75 22.607 4.907 0.268 609 2HB ASN 75 2HB ASN 75 20.879 5.210 0.351 610 1HD2 ASN 75 1HD2 ASN 75 19.788 5.500 -1.477 611 2HD2 ASN 75 2HD2 ASN 75 20.499 5.658 -3.049 612 H GLU 76 H GLU 76 20.678 9.028 0.429 613 HA GLU 76 HA GLU 76 21.310 9.936 -2.132 614 1HB GLU 76 1HB GLU 76 19.671 10.762 -0.025 615 2HB GLU 76 2HB GLU 76 20.758 12.115 -0.306 616 1HG GLU 76 1HG GLU 76 19.897 11.227 -2.836 617 2HG GLU 76 2HG GLU 76 18.470 11.297 -1.801 618 1H MET 1 1H MET 1 -23.722 -79.203 -55.823 619 2H MET 1 2H MET 1 -24.861 -77.998 -56.169 620 3H MET 1 3H MET 1 -23.235 -77.586 -55.942 621 HA MET 1 HA MET 1 -22.564 -78.621 -57.925 622 1HB MET 1 1HB MET 1 -24.242 -80.524 -57.503 623 2HB MET 1 2HB MET 1 -25.405 -79.525 -58.363 624 1HG MET 1 1HG MET 1 -23.990 -79.539 -60.337 625 2HG MET 1 2HG MET 1 -22.783 -80.499 -59.480 626 1HE MET 1 1HE MET 1 -24.273 -81.713 -62.439 627 2HE MET 1 2HE MET 1 -23.769 -83.255 -61.749 628 3HE MET 1 3HE MET 1 -22.772 -81.818 -61.523 629 H SER 2 H SER 2 -25.875 -78.118 -58.878 630 HA SER 2 HA SER 2 -25.049 -75.827 -60.435 631 1HB SER 2 1HB SER 2 -27.877 -76.742 -60.424 632 2HB SER 2 2HB SER 2 -26.838 -76.305 -61.782 633 HG SER 2 HG SER 2 -25.887 -78.293 -61.710 634 H LEU 3 H LEU 3 -27.024 -76.518 -57.632 635 HA LEU 3 HA LEU 3 -28.163 -73.856 -57.586 636 1HB LEU 3 1HB LEU 3 -29.103 -76.196 -56.687 637 2HB LEU 3 2HB LEU 3 -28.325 -75.640 -55.217 638 HG LEU 3 HG LEU 3 -30.071 -73.667 -56.538 639 1HD1 LEU 3 1HD1 LEU 3 -31.546 -75.424 -56.939 640 2HD1 LEU 3 2HD1 LEU 3 -32.065 -74.794 -55.373 641 3HD1 LEU 3 3HD1 LEU 3 -31.095 -76.265 -55.456 642 1HD2 LEU 3 1HD2 LEU 3 -29.444 -74.563 -53.748 643 2HD2 LEU 3 2HD2 LEU 3 -30.838 -73.539 -54.079 644 3HD2 LEU 3 3HD2 LEU 3 -29.219 -72.978 -54.486 645 H GLU 4 H GLU 4 -26.154 -72.686 -57.510 646 HA GLU 4 HA GLU 4 -24.695 -72.906 -54.973 647 1HB GLU 4 1HB GLU 4 -23.947 -72.290 -57.695 648 2HB GLU 4 2HB GLU 4 -23.444 -71.002 -56.610 649 1HG GLU 4 1HG GLU 4 -22.593 -73.858 -56.680 650 2HG GLU 4 2HG GLU 4 -21.613 -72.392 -56.591 651 H LYS 5 H LYS 5 -23.867 -70.703 -54.161 652 HA LYS 5 HA LYS 5 -25.810 -68.557 -54.536 653 1HB LYS 5 1HB LYS 5 -25.588 -70.237 -52.117 654 2HB LYS 5 2HB LYS 5 -25.620 -68.502 -51.825 655 1HG LYS 5 1HG LYS 5 -27.811 -68.444 -52.133 656 2HG LYS 5 2HG LYS 5 -27.649 -69.198 -53.720 657 1HD LYS 5 1HD LYS 5 -28.000 -71.317 -52.901 658 2HD LYS 5 2HD LYS 5 -27.423 -70.904 -51.285 659 1HE LYS 5 1HE LYS 5 -29.596 -69.303 -51.470 660 2HE LYS 5 2HE LYS 5 -30.111 -70.664 -52.464 661 1HZ LYS 5 1HZ LYS 5 -30.512 -70.655 -49.900 662 2HZ LYS 5 2HZ LYS 5 -28.912 -71.211 -49.841 663 3HZ LYS 5 3HZ LYS 5 -30.080 -72.090 -50.696 664 H ALA 6 H ALA 6 -25.125 -66.601 -53.206 665 HA ALA 6 HA ALA 6 -22.200 -66.375 -53.352 666 1HB ALA 6 1HB ALA 6 -22.455 -64.251 -54.035 667 2HB ALA 6 2HB ALA 6 -23.762 -63.935 -52.894 668 3HB ALA 6 3HB ALA 6 -24.103 -64.753 -54.418 669 H HIS 7 H HIS 7 -22.227 -67.652 -51.311 670 HA HIS 7 HA HIS 7 -23.138 -66.218 -48.950 671 1HB HIS 7 1HB HIS 7 -22.399 -68.991 -49.602 672 2HB HIS 7 2HB HIS 7 -21.886 -68.454 -48.002 673 HD1 HIS 7 HD1 HIS 7 -24.122 -70.615 -48.512 674 HD2 HIS 7 HD2 HIS 7 -24.763 -66.590 -47.687 675 HE1 HIS 7 HE1 HIS 7 -26.464 -70.471 -47.603 676 HE2 HIS 7 HE2 HIS 7 -26.878 -68.011 -47.253 677 H THR 8 H THR 8 -21.116 -64.906 -50.312 678 HA THR 8 HA THR 8 -18.562 -65.474 -49.127 679 HB THR 8 HB THR 8 -18.972 -62.801 -50.280 680 HG1 THR 8 HG1 THR 8 -19.418 -65.168 -51.834 681 1HG2 THR 8 1HG2 THR 8 -16.942 -63.270 -51.404 682 2HG2 THR 8 2HG2 THR 8 -17.130 -65.011 -51.180 683 3HG2 THR 8 3HG2 THR 8 -16.772 -63.974 -49.796 684 H SER 9 H SER 9 -17.692 -64.615 -47.328 685 HA SER 9 HA SER 9 -19.391 -63.145 -45.540 686 1HB SER 9 1HB SER 9 -16.526 -63.476 -44.868 687 2HB SER 9 2HB SER 9 -17.961 -63.832 -43.906 688 HG SER 9 HG SER 9 -18.255 -65.649 -45.443 689 H VAL 10 H VAL 10 -19.358 -61.399 -47.398 690 HA VAL 10 HA VAL 10 -17.116 -59.553 -47.076 691 HB VAL 10 HB VAL 10 -19.521 -59.209 -48.869 692 1HG1 VAL 10 1HG1 VAL 10 -18.003 -57.241 -48.208 693 2HG1 VAL 10 2HG1 VAL 10 -18.344 -57.491 -49.920 694 3HG1 VAL 10 3HG1 VAL 10 -16.799 -58.010 -49.242 695 1HG2 VAL 10 1HG2 VAL 10 -18.273 -61.301 -49.375 696 2HG2 VAL 10 2HG2 VAL 10 -16.826 -60.325 -49.635 697 3HG2 VAL 10 3HG2 VAL 10 -18.231 -60.116 -50.682 698 H LYS 11 H LYS 11 -17.204 -58.129 -45.491 699 HA LYS 11 HA LYS 11 -19.672 -56.662 -45.021 700 1HB LYS 11 1HB LYS 11 -18.982 -56.954 -42.444 701 2HB LYS 11 2HB LYS 11 -20.134 -58.011 -43.246 702 1HG LYS 11 1HG LYS 11 -18.725 -59.786 -43.235 703 2HG LYS 11 2HG LYS 11 -17.279 -58.783 -43.366 704 1HD LYS 11 1HD LYS 11 -18.910 -58.657 -40.873 705 2HD LYS 11 2HD LYS 11 -17.847 -60.041 -41.133 706 1HE LYS 11 1HE LYS 11 -16.561 -57.494 -41.712 707 2HE LYS 11 2HE LYS 11 -17.115 -57.622 -40.043 708 1HZ LYS 11 1HZ LYS 11 -14.994 -58.515 -39.986 709 2HZ LYS 11 2HZ LYS 11 -15.163 -59.306 -41.479 710 3HZ LYS 11 3HZ LYS 11 -15.969 -59.898 -40.108 711 H LYS 12 H LYS 12 -18.593 -54.937 -45.946 712 HA LYS 12 HA LYS 12 -16.007 -54.100 -45.128 713 1HB LYS 12 1HB LYS 12 -18.202 -52.726 -46.680 714 2HB LYS 12 2HB LYS 12 -16.641 -51.976 -46.372 715 1HG LYS 12 1HG LYS 12 -15.508 -53.716 -47.591 716 2HG LYS 12 2HG LYS 12 -17.022 -54.600 -47.798 717 1HD LYS 12 1HD LYS 12 -16.879 -51.785 -48.766 718 2HD LYS 12 2HD LYS 12 -16.063 -53.039 -49.705 719 1HE LYS 12 1HE LYS 12 -18.125 -54.274 -49.921 720 2HE LYS 12 2HE LYS 12 -18.959 -53.133 -48.865 721 1HZ LYS 12 1HZ LYS 12 -19.558 -52.265 -50.846 722 2HZ LYS 12 2HZ LYS 12 -18.201 -52.860 -51.667 723 3HZ LYS 12 3HZ LYS 12 -18.068 -51.466 -50.708 724 H MET 13 H MET 13 -15.514 -53.248 -43.244 725 HA MET 13 HA MET 13 -17.195 -51.168 -42.093 726 1HB MET 13 1HB MET 13 -17.804 -53.519 -41.162 727 2HB MET 13 2HB MET 13 -16.270 -53.405 -40.312 728 1HG MET 13 1HG MET 13 -17.098 -51.210 -39.378 729 2HG MET 13 2HG MET 13 -18.679 -51.639 -40.025 730 1HE MET 13 1HE MET 13 -18.979 -52.071 -36.174 731 2HE MET 13 2HE MET 13 -18.762 -50.850 -37.428 732 3HE MET 13 3HE MET 13 -17.368 -51.446 -36.526 733 H THR 14 H THR 14 -16.001 -49.599 -41.194 734 HA THR 14 HA THR 14 -13.130 -49.811 -41.329 735 HB THR 14 HB THR 14 -13.420 -47.426 -40.266 736 HG1 THR 14 HG1 THR 14 -15.446 -46.850 -40.067 737 1HG2 THR 14 1HG2 THR 14 -13.568 -48.455 -42.994 738 2HG2 THR 14 2HG2 THR 14 -12.613 -47.122 -42.340 739 3HG2 THR 14 3HG2 THR 14 -14.292 -46.854 -42.815 740 H PHE 15 H PHE 15 -11.699 -49.864 -39.632 741 HA PHE 15 HA PHE 15 -12.806 -50.876 -37.170 742 1HB PHE 15 1HB PHE 15 -10.703 -51.747 -36.709 743 2HB PHE 15 2HB PHE 15 -10.746 -51.772 -38.466 744 HD1 PHE 15 HD1 PHE 15 -8.969 -50.700 -35.586 745 HD2 PHE 15 HD2 PHE 15 -9.629 -49.824 -39.695 746 HE1 PHE 15 HE1 PHE 15 -6.870 -49.426 -35.644 747 HE2 PHE 15 HE2 PHE 15 -7.533 -48.540 -39.760 748 HZ PHE 15 HZ PHE 15 -6.151 -48.336 -37.732 749 H GLY 16 H GLY 16 -11.670 -47.862 -38.299 750 1HA GLY 16 1HA GLY 16 -12.214 -45.942 -36.844 751 2HA GLY 16 2HA GLY 16 -11.556 -46.880 -35.510 752 H GLU 17 H GLU 17 -10.709 -45.364 -38.581 753 HA GLU 17 HA GLU 17 -7.912 -45.231 -37.681 754 1HB GLU 17 1HB GLU 17 -8.842 -46.325 -39.956 755 2HB GLU 17 2HB GLU 17 -8.621 -44.671 -40.507 756 1HG GLU 17 1HG GLU 17 -6.264 -44.879 -39.510 757 2HG GLU 17 2HG GLU 17 -6.576 -46.616 -39.530 758 H ASN 18 H ASN 18 -10.541 -43.375 -37.617 759 HA ASN 18 HA ASN 18 -9.633 -40.984 -38.870 760 1HB ASN 18 1HB ASN 18 -11.792 -40.458 -38.626 761 2HB ASN 18 2HB ASN 18 -12.036 -41.901 -37.658 762 1HD2 ASN 18 1HD2 ASN 18 -12.565 -41.679 -35.594 763 2HD2 ASN 18 2HD2 ASN 18 -12.579 -40.180 -34.722 764 H ARG 19 H ARG 19 -9.603 -42.199 -35.560 765 HA ARG 19 HA ARG 19 -8.547 -41.517 -33.664 766 1HB ARG 19 1HB ARG 19 -6.621 -42.095 -35.195 767 2HB ARG 19 2HB ARG 19 -6.472 -40.376 -35.536 768 1HG ARG 19 1HG ARG 19 -6.293 -40.127 -32.965 769 2HG ARG 19 2HG ARG 19 -5.911 -41.851 -33.000 770 1HD ARG 19 1HD ARG 19 -3.973 -41.510 -34.272 771 2HD ARG 19 2HD ARG 19 -4.475 -39.893 -34.764 772 HE ARG 19 HE ARG 19 -3.778 -40.500 -31.962 773 1HH1 ARG 19 1HH1 ARG 19 -3.391 -38.591 -34.879 774 2HH1 ARG 19 2HH1 ARG 19 -2.299 -37.448 -34.139 775 1HH2 ARG 19 1HH2 ARG 19 -2.358 -39.002 -30.990 776 2HH2 ARG 19 2HH2 ARG 19 -1.722 -37.685 -31.921 777 H ASP 20 H ASP 20 -10.413 -39.939 -33.589 778 HA ASP 20 HA ASP 20 -9.777 -37.176 -34.138 779 1HB ASP 20 1HB ASP 20 -12.078 -37.985 -34.413 780 2HB ASP 20 2HB ASP 20 -12.148 -38.393 -32.701 781 H LEU 21 H LEU 21 -7.882 -37.018 -32.829 782 HA LEU 21 HA LEU 21 -8.522 -36.494 -30.012 783 1HB LEU 21 1HB LEU 21 -6.507 -38.351 -31.134 784 2HB LEU 21 2HB LEU 21 -5.992 -37.372 -29.773 785 HG LEU 21 HG LEU 21 -8.484 -38.404 -29.018 786 1HD1 LEU 21 1HD1 LEU 21 -8.556 -40.646 -29.518 787 2HD1 LEU 21 2HD1 LEU 21 -6.833 -40.729 -29.895 788 3HD1 LEU 21 3HD1 LEU 21 -7.949 -39.973 -31.034 789 1HD2 LEU 21 1HD2 LEU 21 -7.189 -39.627 -27.363 790 2HD2 LEU 21 2HD2 LEU 21 -6.545 -37.998 -27.570 791 3HD2 LEU 21 3HD2 LEU 21 -5.718 -39.374 -28.302 792 H GLU 22 H GLU 22 -8.598 -34.365 -31.398 793 HA GLU 22 HA GLU 22 -5.920 -33.162 -31.513 794 1HB GLU 22 1HB GLU 22 -8.574 -32.156 -32.557 795 2HB GLU 22 2HB GLU 22 -7.050 -31.290 -32.688 796 1HG GLU 22 1HG GLU 22 -7.597 -33.991 -33.899 797 2HG GLU 22 2HG GLU 22 -7.701 -32.456 -34.760 798 H ARG 23 H ARG 23 -5.597 -32.889 -29.299 799 HA ARG 23 HA ARG 23 -7.310 -30.848 -28.047 800 1HB ARG 23 1HB ARG 23 -6.225 -33.363 -26.772 801 2HB ARG 23 2HB ARG 23 -6.941 -32.036 -25.870 802 1HG ARG 23 1HG ARG 23 -9.046 -32.366 -27.105 803 2HG ARG 23 2HG ARG 23 -8.317 -33.749 -27.926 804 1HD ARG 23 1HD ARG 23 -7.874 -34.132 -25.179 805 2HD ARG 23 2HD ARG 23 -9.549 -33.606 -25.338 806 HE ARG 23 HE ARG 23 -9.659 -35.469 -27.095 807 1HH1 ARG 23 1HH1 ARG 23 -7.545 -35.569 -24.304 808 2HH1 ARG 23 2HH1 ARG 23 -7.667 -37.292 -24.105 809 1HH2 ARG 23 1HH2 ARG 23 -9.797 -37.750 -26.856 810 2HH2 ARG 23 2HH2 ARG 23 -8.931 -38.533 -25.560 811 H VAL 24 H VAL 24 -6.178 -29.110 -27.543 812 HA VAL 24 HA VAL 24 -3.309 -29.118 -27.550 813 HB VAL 24 HB VAL 24 -5.142 -26.887 -26.649 814 1HG1 VAL 24 1HG1 VAL 24 -2.248 -26.998 -27.463 815 2HG1 VAL 24 2HG1 VAL 24 -2.934 -26.419 -25.947 816 3HG1 VAL 24 3HG1 VAL 24 -3.168 -25.496 -27.430 817 1HG2 VAL 24 1HG2 VAL 24 -5.359 -27.934 -29.063 818 2HG2 VAL 24 2HG2 VAL 24 -3.928 -26.950 -29.365 819 3HG2 VAL 24 3HG2 VAL 24 -5.421 -26.189 -28.813 820 H VAL 25 H VAL 25 -2.133 -29.817 -25.908 821 HA VAL 25 HA VAL 25 -3.120 -29.345 -23.166 822 HB VAL 25 HB VAL 25 -1.448 -31.723 -23.981 823 1HG1 VAL 25 1HG1 VAL 25 -1.938 -32.577 -21.812 824 2HG1 VAL 25 2HG1 VAL 25 -3.098 -31.288 -21.497 825 3HG1 VAL 25 3HG1 VAL 25 -1.377 -30.919 -21.607 826 1HG2 VAL 25 1HG2 VAL 25 -3.887 -31.522 -24.926 827 2HG2 VAL 25 2HG2 VAL 25 -4.337 -31.973 -23.283 828 3HG2 VAL 25 3HG2 VAL 25 -3.312 -33.040 -24.240 829 H THR 26 H THR 26 -1.916 -27.584 -22.664 830 HA THR 26 HA THR 26 0.933 -28.060 -22.291 831 HB THR 26 HB THR 26 0.716 -25.359 -23.195 832 HG1 THR 26 HG1 THR 26 -0.962 -25.831 -24.550 833 1HG2 THR 26 1HG2 THR 26 2.423 -26.086 -24.804 834 2HG2 THR 26 2HG2 THR 26 2.082 -27.770 -24.401 835 3HG2 THR 26 3HG2 THR 26 2.762 -26.690 -23.182 836 H ALA 27 H ALA 27 0.385 -28.117 -20.088 837 HA ALA 27 HA ALA 27 -0.689 -25.634 -18.940 838 1HB ALA 27 1HB ALA 27 -1.087 -28.398 -18.374 839 2HB ALA 27 2HB ALA 27 -1.876 -27.001 -17.644 840 3HB ALA 27 3HB ALA 27 -0.379 -27.630 -16.955 841 HA PRO 28 HA PRO 28 3.646 -24.957 -17.869 842 1HB PRO 28 1HB PRO 28 2.801 -22.244 -17.227 843 2HB PRO 28 2HB PRO 28 3.879 -22.794 -18.509 844 1HG PRO 28 1HG PRO 28 1.415 -21.774 -18.990 845 2HG PRO 28 2HG PRO 28 2.176 -22.988 -20.035 846 1HD PRO 28 1HD PRO 28 0.093 -23.354 -17.909 847 2HD PRO 28 2HD PRO 28 0.201 -24.098 -19.520 848 H VAL 29 H VAL 29 4.775 -24.422 -15.944 849 HA VAL 29 HA VAL 29 3.092 -24.215 -13.538 850 HB VAL 29 HB VAL 29 5.495 -25.493 -12.776 851 1HG1 VAL 29 1HG1 VAL 29 3.553 -25.826 -11.521 852 2HG1 VAL 29 2HG1 VAL 29 3.856 -27.388 -12.279 853 3HG1 VAL 29 3HG1 VAL 29 2.616 -26.319 -12.933 854 1HG2 VAL 29 1HG2 VAL 29 5.789 -26.220 -15.089 855 2HG2 VAL 29 2HG2 VAL 29 4.172 -26.916 -15.083 856 3HG2 VAL 29 3HG2 VAL 29 5.419 -27.586 -14.037 857 H SER 30 H SER 30 3.736 -21.912 -14.317 858 HA SER 30 HA SER 30 6.372 -20.992 -13.816 859 1HB SER 30 1HB SER 30 3.907 -19.272 -13.645 860 2HB SER 30 2HB SER 30 5.517 -18.838 -14.229 861 HG SER 30 HG SER 30 4.852 -20.753 -15.791 862 H SER 31 H SER 31 7.081 -19.635 -12.068 863 HA SER 31 HA SER 31 6.167 -20.642 -9.538 864 1HB SER 31 1HB SER 31 8.070 -18.445 -9.384 865 2HB SER 31 2HB SER 31 8.244 -20.120 -8.853 866 HG SER 31 HG SER 31 8.718 -20.667 -11.052 867 H GLY 32 H GLY 32 5.369 -19.436 -7.811 868 1HA GLY 32 1HA GLY 32 4.253 -16.790 -8.522 869 2HA GLY 32 2HA GLY 32 3.316 -17.994 -7.642 870 H LYS 33 H LYS 33 6.721 -17.255 -7.252 871 HA LYS 33 HA LYS 33 6.333 -16.864 -4.401 872 1HB LYS 33 1HB LYS 33 8.443 -17.776 -6.111 873 2HB LYS 33 2HB LYS 33 9.030 -16.421 -5.159 874 1HG LYS 33 1HG LYS 33 8.126 -17.644 -3.131 875 2HG LYS 33 2HG LYS 33 7.947 -19.044 -4.187 876 1HD LYS 33 1HD LYS 33 10.048 -19.429 -3.358 877 2HD LYS 33 2HD LYS 33 10.450 -18.480 -4.790 878 1HE LYS 33 1HE LYS 33 9.918 -16.741 -2.570 879 2HE LYS 33 2HE LYS 33 11.128 -17.940 -2.118 880 1HZ LYS 33 1HZ LYS 33 12.647 -17.003 -3.433 881 2HZ LYS 33 2HZ LYS 33 11.627 -15.646 -3.453 882 3HZ LYS 33 3HZ LYS 33 11.558 -16.774 -4.718 883 H ILE 34 H ILE 34 5.157 -14.845 -5.919 884 HA ILE 34 HA ILE 34 6.703 -12.547 -5.015 885 HB ILE 34 HB ILE 34 6.342 -13.267 -7.805 886 1HG1 ILE 34 1HG1 ILE 34 7.771 -10.812 -6.892 887 2HG1 ILE 34 2HG1 ILE 34 8.356 -12.377 -6.337 888 1HG2 ILE 34 1HG2 ILE 34 4.719 -11.828 -8.368 889 2HG2 ILE 34 2HG2 ILE 34 5.978 -10.602 -8.209 890 3HG2 ILE 34 3HG2 ILE 34 4.870 -10.911 -6.870 891 1HD1 ILE 34 1HD1 ILE 34 8.671 -13.105 -8.617 892 2HD1 ILE 34 2HD1 ILE 34 9.517 -11.582 -8.345 893 3HD1 ILE 34 3HD1 ILE 34 7.987 -11.597 -9.222 894 H LYS 35 H LYS 35 5.492 -10.791 -4.458 895 HA LYS 35 HA LYS 35 2.555 -11.071 -4.576 896 1HB LYS 35 1HB LYS 35 4.312 -10.052 -2.341 897 2HB LYS 35 2HB LYS 35 2.589 -9.703 -2.425 898 1HG LYS 35 1HG LYS 35 3.604 -12.518 -2.506 899 2HG LYS 35 2HG LYS 35 3.379 -11.667 -0.978 900 1HD LYS 35 1HD LYS 35 1.094 -11.603 -1.195 901 2HD LYS 35 2HD LYS 35 1.153 -11.670 -2.957 902 1HE LYS 35 1HE LYS 35 1.273 -13.938 -3.002 903 2HE LYS 35 2HE LYS 35 2.173 -14.031 -1.489 904 1HZ LYS 35 1HZ LYS 35 -0.648 -13.189 -1.471 905 2HZ LYS 35 2HZ LYS 35 0.258 -13.929 -0.242 906 3HZ LYS 35 3HZ LYS 35 -0.264 -14.838 -1.578 907 H ARG 36 H ARG 36 1.459 -8.854 -4.392 908 HA ARG 36 HA ARG 36 3.137 -6.844 -5.751 909 1HB ARG 36 1HB ARG 36 0.626 -6.180 -6.584 910 2HB ARG 36 2HB ARG 36 1.771 -7.133 -7.515 911 1HG ARG 36 1HG ARG 36 0.324 -8.854 -5.747 912 2HG ARG 36 2HG ARG 36 -0.805 -7.855 -6.666 913 1HD ARG 36 1HD ARG 36 -0.441 -9.034 -8.511 914 2HD ARG 36 2HD ARG 36 1.302 -8.810 -8.367 915 HE ARG 36 HE ARG 36 0.019 -10.874 -6.728 916 1HH1 ARG 36 1HH1 ARG 36 2.066 -10.033 -9.450 917 2HH1 ARG 36 2HH1 ARG 36 2.734 -11.635 -9.602 918 1HH2 ARG 36 1HH2 ARG 36 0.882 -12.983 -6.944 919 2HH2 ARG 36 2HH2 ARG 36 2.043 -13.315 -8.192 920 H VAL 37 H VAL 37 3.340 -5.004 -4.716 921 HA VAL 37 HA VAL 37 1.253 -4.200 -2.784 922 HB VAL 37 HB VAL 37 4.177 -3.512 -2.492 923 1HG1 VAL 37 1HG1 VAL 37 3.467 -2.196 -0.860 924 2HG1 VAL 37 2HG1 VAL 37 2.745 -3.584 -0.045 925 3HG1 VAL 37 3HG1 VAL 37 1.798 -2.652 -1.204 926 1HG2 VAL 37 1HG2 VAL 37 3.788 -5.987 -2.380 927 2HG2 VAL 37 2HG2 VAL 37 2.733 -5.695 -0.998 928 3HG2 VAL 37 3HG2 VAL 37 4.443 -5.273 -0.906 929 H ASN 38 H ASN 38 0.524 -2.147 -2.905 930 HA ASN 38 HA ASN 38 1.786 -0.385 -4.905 931 1HB ASN 38 1HB ASN 38 -0.509 -0.944 -5.542 932 2HB ASN 38 2HB ASN 38 -1.094 -0.445 -3.957 933 1HD2 ASN 38 1HD2 ASN 38 -2.157 1.386 -4.119 934 2HD2 ASN 38 2HD2 ASN 38 -1.701 2.747 -5.090 935 H VAL 39 H VAL 39 2.893 1.221 -4.015 936 HA VAL 39 HA VAL 39 2.313 1.890 -1.220 937 HB VAL 39 HB VAL 39 4.765 3.004 -2.384 938 1HG1 VAL 39 1HG1 VAL 39 3.854 1.687 0.116 939 2HG1 VAL 39 2HG1 VAL 39 4.736 3.196 -0.114 940 3HG1 VAL 39 3HG1 VAL 39 5.579 1.651 -0.256 941 1HG2 VAL 39 1HG2 VAL 39 5.155 1.110 -3.604 942 2HG2 VAL 39 2HG2 VAL 39 4.198 0.087 -2.533 943 3HG2 VAL 39 3HG2 VAL 39 5.814 0.604 -2.048 944 H ASN 40 H ASN 40 2.103 3.958 -0.491 945 HA ASN 40 HA ASN 40 1.582 6.002 -2.542 946 1HB ASN 40 1HB ASN 40 0.047 5.173 -0.349 947 2HB ASN 40 2HB ASN 40 0.744 6.714 0.144 948 1HD2 ASN 40 1HD2 ASN 40 -1.629 7.185 0.113 949 2HD2 ASN 40 2HD2 ASN 40 -2.284 7.804 -1.366 950 H PHE 41 H PHE 41 3.318 7.208 -2.849 951 HA PHE 41 HA PHE 41 5.141 7.747 -0.609 952 1HB PHE 41 1HB PHE 41 5.489 8.139 -3.592 953 2HB PHE 41 2HB PHE 41 6.718 8.464 -2.382 954 HD1 PHE 41 HD1 PHE 41 6.615 6.109 -0.671 955 HD2 PHE 41 HD2 PHE 41 6.224 6.449 -4.895 956 HE1 PHE 41 HE1 PHE 41 7.464 3.812 -0.934 957 HE2 PHE 41 HE2 PHE 41 7.066 4.157 -5.164 958 HZ PHE 41 HZ PHE 41 7.692 2.839 -3.191 959 H ASP 42 H ASP 42 6.154 9.943 -0.614 960 HA ASP 42 HA ASP 42 4.191 12.040 -0.777 961 1HB ASP 42 1HB ASP 42 6.284 11.838 0.804 962 2HB ASP 42 2HB ASP 42 7.135 12.559 -0.560 963 H GLU 43 H GLU 43 4.760 14.060 -2.039 964 HA GLU 43 HA GLU 43 4.874 13.515 -4.794 965 1HB GLU 43 1HB GLU 43 3.980 15.588 -3.509 966 2HB GLU 43 2HB GLU 43 5.636 16.169 -3.611 967 1HG GLU 43 1HG GLU 43 4.581 15.233 -6.161 968 2HG GLU 43 2HG GLU 43 3.677 16.580 -5.470 969 H GLU 44 H GLU 44 7.292 14.706 -2.527 970 HA GLU 44 HA GLU 44 9.406 15.042 -4.357 971 1HB GLU 44 1HB GLU 44 9.001 15.312 -1.571 972 2HB GLU 44 2HB GLU 44 10.387 14.250 -1.788 973 1HG GLU 44 1HG GLU 44 11.653 16.019 -2.143 974 2HG GLU 44 2HG GLU 44 10.713 16.386 -3.589 975 H LYS 45 H LYS 45 8.225 12.244 -2.619 976 HA LYS 45 HA LYS 45 10.538 10.691 -2.776 977 1HB LYS 45 1HB LYS 45 7.713 10.218 -2.126 978 2HB LYS 45 2HB LYS 45 8.595 8.804 -2.684 979 1HG LYS 45 1HG LYS 45 10.369 9.558 -0.940 980 2HG LYS 45 2HG LYS 45 9.020 10.455 -0.240 981 1HD LYS 45 1HD LYS 45 7.732 8.418 -0.022 982 2HD LYS 45 2HD LYS 45 8.998 7.498 -0.836 983 1HE LYS 45 1HE LYS 45 10.006 7.160 1.110 984 2HE LYS 45 2HE LYS 45 10.193 8.902 1.315 985 1HZ LYS 45 1HZ LYS 45 7.940 8.942 2.283 986 2HZ LYS 45 2HZ LYS 45 9.031 8.003 3.184 987 3HZ LYS 45 3HZ LYS 45 7.884 7.251 2.183 988 H HIS 46 H HIS 46 8.143 11.330 -5.189 989 HA HIS 46 HA HIS 46 8.930 9.044 -6.802 990 1HB HIS 46 1HB HIS 46 6.613 10.361 -6.736 991 2HB HIS 46 2HB HIS 46 7.400 11.287 -8.011 992 HD1 HIS 46 HD1 HIS 46 5.957 10.424 -9.924 993 HD2 HIS 46 HD2 HIS 46 7.825 7.386 -7.765 994 HE1 HIS 46 HE1 HIS 46 5.611 8.324 -11.262 995 HE2 HIS 46 HE2 HIS 46 6.905 6.544 -10.040 996 H THR 47 H THR 47 9.332 12.567 -6.898 997 HA THR 47 HA THR 47 10.955 12.613 -9.217 998 HB THR 47 HB THR 47 11.457 14.744 -7.274 999 HG1 THR 47 HG1 THR 47 9.386 15.352 -6.941 1000 1HG2 THR 47 1HG2 THR 47 10.568 16.111 -9.186 1001 2HG2 THR 47 2HG2 THR 47 10.306 14.603 -10.064 1002 3HG2 THR 47 3HG2 THR 47 11.939 15.081 -9.597 1003 H ARG 48 H ARG 48 11.583 12.219 -5.802 1004 HA ARG 48 HA ARG 48 14.424 12.367 -5.888 1005 1HB ARG 48 1HB ARG 48 12.414 11.906 -3.934 1006 2HB ARG 48 2HB ARG 48 13.512 10.537 -3.875 1007 1HG ARG 48 1HG ARG 48 14.761 11.789 -2.538 1008 2HG ARG 48 2HG ARG 48 15.218 12.685 -3.989 1009 1HD ARG 48 1HD ARG 48 13.860 14.443 -3.502 1010 2HD ARG 48 2HD ARG 48 12.677 13.437 -2.670 1011 HE ARG 48 HE ARG 48 13.784 13.788 -0.699 1012 1HH1 ARG 48 1HH1 ARG 48 15.809 14.811 -3.373 1013 2HH1 ARG 48 2HH1 ARG 48 17.036 15.504 -2.352 1014 1HH2 ARG 48 1HH2 ARG 48 15.376 14.745 0.657 1015 2HH2 ARG 48 2HH2 ARG 48 16.783 15.484 -0.063 1016 H PHE 49 H PHE 49 12.070 9.751 -6.164 1017 HA PHE 49 HA PHE 49 13.888 7.616 -6.283 1018 1HB PHE 49 1HB PHE 49 11.150 7.847 -6.287 1019 2HB PHE 49 2HB PHE 49 11.481 7.272 -7.920 1020 HD1 PHE 49 HD1 PHE 49 14.029 6.229 -5.742 1021 HD2 PHE 49 HD2 PHE 49 10.040 5.335 -6.923 1022 HE1 PHE 49 HE1 PHE 49 14.296 3.940 -4.891 1023 HE2 PHE 49 HE2 PHE 49 10.303 3.040 -6.076 1024 HZ PHE 49 HZ PHE 49 12.439 2.341 -5.062 1025 H LYS 50 H LYS 50 12.613 9.746 -8.773 1026 HA LYS 50 HA LYS 50 13.667 8.392 -11.013 1027 1HB LYS 50 1HB LYS 50 12.487 11.004 -10.442 1028 2HB LYS 50 2HB LYS 50 13.714 11.067 -11.702 1029 1HG LYS 50 1HG LYS 50 11.626 8.955 -11.841 1030 2HG LYS 50 2HG LYS 50 11.197 10.610 -12.271 1031 1HD LYS 50 1HD LYS 50 11.952 10.092 -14.312 1032 2HD LYS 50 2HD LYS 50 13.562 10.245 -13.607 1033 1HE LYS 50 1HE LYS 50 13.070 7.727 -12.919 1034 2HE LYS 50 2HE LYS 50 12.023 7.816 -14.335 1035 1HZ LYS 50 1HZ LYS 50 13.770 7.966 -15.729 1036 2HZ LYS 50 2HZ LYS 50 14.595 7.192 -14.466 1037 3HZ LYS 50 3HZ LYS 50 14.718 8.871 -14.650 1038 H ALA 51 H ALA 51 14.967 10.928 -8.926 1039 HA ALA 51 HA ALA 51 17.441 11.252 -10.265 1040 1HB ALA 51 1HB ALA 51 16.224 12.608 -8.301 1041 2HB ALA 51 2HB ALA 51 17.958 12.718 -8.619 1042 3HB ALA 51 3HB ALA 51 17.359 11.660 -7.340 1043 H ALA 52 H ALA 52 16.408 9.205 -7.567 1044 HA ALA 52 HA ALA 52 18.898 8.083 -6.939 1045 1HB ALA 52 1HB ALA 52 17.595 7.326 -5.309 1046 2HB ALA 52 2HB ALA 52 17.001 6.103 -6.433 1047 3HB ALA 52 3HB ALA 52 16.137 7.630 -6.254 1048 H CYS 53 H CYS 53 16.448 7.127 -9.293 1049 HA CYS 53 HA CYS 53 17.657 4.706 -10.104 1050 1HB CYS 53 1HB CYS 53 15.842 6.586 -11.627 1051 2HB CYS 53 2HB CYS 53 16.269 4.960 -12.150 1052 HG CYS 53 HG CYS 53 14.472 5.766 -9.351 1053 H ALA 54 H ALA 54 18.074 8.054 -11.078 1054 HA ALA 54 HA ALA 54 19.838 7.472 -13.261 1055 1HB ALA 54 1HB ALA 54 19.927 9.734 -13.617 1056 2HB ALA 54 2HB ALA 54 19.867 10.118 -11.895 1057 3HB ALA 54 3HB ALA 54 18.403 9.614 -12.739 1058 H ARG 55 H ARG 55 20.170 8.006 -9.844 1059 HA ARG 55 HA ARG 55 22.941 8.595 -9.817 1060 1HB ARG 55 1HB ARG 55 20.949 7.752 -7.742 1061 2HB ARG 55 2HB ARG 55 22.659 7.813 -7.342 1062 1HG ARG 55 1HG ARG 55 21.486 10.197 -8.643 1063 2HG ARG 55 2HG ARG 55 21.027 9.868 -6.970 1064 1HD ARG 55 1HD ARG 55 23.058 10.404 -6.180 1065 2HD ARG 55 2HD ARG 55 23.893 9.601 -7.510 1066 HE ARG 55 HE ARG 55 23.779 11.575 -8.769 1067 1HH1 ARG 55 1HH1 ARG 55 22.311 11.953 -5.607 1068 2HH1 ARG 55 2HH1 ARG 55 22.395 13.692 -5.639 1069 1HH2 ARG 55 1HH2 ARG 55 23.879 13.859 -8.816 1070 2HH2 ARG 55 2HH2 ARG 55 23.296 14.775 -7.460 1071 H LYS 56 H LYS 56 21.113 5.599 -9.291 1072 HA LYS 56 HA LYS 56 23.628 4.135 -9.031 1073 1HB LYS 56 1HB LYS 56 20.799 3.161 -8.633 1074 2HB LYS 56 2HB LYS 56 22.270 2.303 -8.199 1075 1HG LYS 56 1HG LYS 56 22.044 4.971 -7.022 1076 2HG LYS 56 2HG LYS 56 20.803 3.829 -6.502 1077 1HD LYS 56 1HD LYS 56 22.733 2.200 -6.102 1078 2HD LYS 56 2HD LYS 56 23.787 3.611 -6.233 1079 1HE LYS 56 1HE LYS 56 22.398 4.693 -4.450 1080 2HE LYS 56 2HE LYS 56 21.566 3.154 -4.246 1081 1HZ LYS 56 1HZ LYS 56 23.179 2.966 -2.668 1082 2HZ LYS 56 2HZ LYS 56 24.306 3.898 -3.531 1083 3HZ LYS 56 3HZ LYS 56 24.011 2.291 -3.983 1084 H GLY 57 H GLY 57 21.376 4.851 -11.423 1085 1HA GLY 57 1HA GLY 57 21.220 4.119 -13.612 1086 2HA GLY 57 2HA GLY 57 22.558 3.019 -13.298 1087 H THR 58 H THR 58 19.574 3.217 -11.488 1088 HA THR 58 HA THR 58 19.097 0.388 -12.087 1089 HB THR 58 HB THR 58 17.507 0.967 -9.952 1090 HG1 THR 58 HG1 THR 58 18.138 2.876 -9.254 1091 1HG2 THR 58 1HG2 THR 58 20.437 0.328 -9.674 1092 2HG2 THR 58 2HG2 THR 58 19.242 -0.842 -10.238 1093 3HG2 THR 58 3HG2 THR 58 19.117 -0.163 -8.614 1094 H SER 59 H SER 59 17.040 -0.383 -12.623 1095 HA SER 59 HA SER 59 15.234 1.430 -13.911 1096 1HB SER 59 1HB SER 59 14.126 -1.185 -13.224 1097 2HB SER 59 2HB SER 59 14.370 -0.453 -14.811 1098 HG SER 59 HG SER 59 16.451 -1.195 -14.842 1099 H ILE 60 H ILE 60 13.005 1.793 -13.264 1100 HA ILE 60 HA ILE 60 12.800 2.671 -10.620 1101 HB ILE 60 HB ILE 60 11.476 3.455 -12.657 1102 1HG1 ILE 60 1HG1 ILE 60 9.355 3.761 -11.051 1103 2HG1 ILE 60 2HG1 ILE 60 10.509 3.175 -9.858 1104 1HG2 ILE 60 1HG2 ILE 60 10.107 0.908 -12.071 1105 2HG2 ILE 60 2HG2 ILE 60 10.297 1.772 -13.596 1106 3HG2 ILE 60 3HG2 ILE 60 9.077 2.291 -12.435 1107 1HD1 ILE 60 1HD1 ILE 60 11.115 5.482 -11.677 1108 2HD1 ILE 60 2HD1 ILE 60 11.936 5.010 -10.189 1109 3HD1 ILE 60 3HD1 ILE 60 10.306 5.677 -10.123 1110 H THR 61 H THR 61 12.153 -0.443 -11.950 1111 HA THR 61 HA THR 61 10.572 -1.303 -9.681 1112 HB THR 61 HB THR 61 11.513 -3.481 -11.295 1113 HG1 THR 61 HG1 THR 61 10.564 -2.692 -13.310 1114 1HG2 THR 61 1HG2 THR 61 8.765 -2.281 -11.431 1115 2HG2 THR 61 2HG2 THR 61 9.324 -3.087 -9.964 1116 3HG2 THR 61 3HG2 THR 61 9.237 -3.980 -11.483 1117 H ASP 62 H ASP 62 13.824 -1.578 -10.938 1118 HA ASP 62 HA ASP 62 14.762 -3.605 -9.209 1119 1HB ASP 62 1HB ASP 62 15.808 -2.724 -11.390 1120 2HB ASP 62 2HB ASP 62 16.509 -1.456 -10.390 1121 H VAL 63 H VAL 63 14.707 -0.068 -8.937 1122 HA VAL 63 HA VAL 63 16.360 0.144 -6.674 1123 HB VAL 63 HB VAL 63 14.711 2.191 -6.187 1124 1HG1 VAL 63 1HG1 VAL 63 17.201 1.941 -7.098 1125 2HG1 VAL 63 2HG1 VAL 63 16.358 3.487 -6.991 1126 3HG1 VAL 63 3HG1 VAL 63 16.442 2.630 -8.534 1127 1HG2 VAL 63 1HG2 VAL 63 14.421 1.810 -9.159 1128 2HG2 VAL 63 2HG2 VAL 63 13.741 3.098 -8.164 1129 3HG2 VAL 63 3HG2 VAL 63 13.154 1.444 -7.987 1130 H VAL 64 H VAL 64 12.839 -0.266 -6.929 1131 HA VAL 64 HA VAL 64 12.315 -0.110 -4.169 1132 HB VAL 64 HB VAL 64 10.651 -1.878 -5.920 1133 1HG1 VAL 64 1HG1 VAL 64 10.368 -0.978 -3.368 1134 2HG1 VAL 64 2HG1 VAL 64 9.037 -1.491 -4.406 1135 3HG1 VAL 64 3HG1 VAL 64 9.440 0.222 -4.267 1136 1HG2 VAL 64 1HG2 VAL 64 11.350 0.206 -7.196 1137 2HG2 VAL 64 2HG2 VAL 64 10.423 1.118 -6.004 1138 3HG2 VAL 64 3HG2 VAL 64 9.617 -0.074 -7.024 1139 H ASN 65 H ASN 65 13.004 -2.873 -6.279 1140 HA ASN 65 HA ASN 65 12.804 -4.879 -4.305 1141 1HB ASN 65 1HB ASN 65 12.933 -5.840 -6.383 1142 2HB ASN 65 2HB ASN 65 14.042 -4.620 -6.996 1143 1HD2 ASN 65 1HD2 ASN 65 16.102 -5.151 -7.223 1144 2HD2 ASN 65 2HD2 ASN 65 16.860 -6.562 -6.554 1145 H GLN 66 H GLN 66 15.344 -2.650 -5.195 1146 HA GLN 66 HA GLN 66 17.455 -3.821 -3.729 1147 1HB GLN 66 1HB GLN 66 17.191 -1.704 -5.481 1148 2HB GLN 66 2HB GLN 66 17.585 -0.919 -3.959 1149 1HG GLN 66 1HG GLN 66 19.702 -1.543 -4.079 1150 2HG GLN 66 2HG GLN 66 19.265 -3.219 -4.427 1151 1HE2 GLN 66 1HE2 GLN 66 17.750 -2.510 -6.814 1152 2HE2 GLN 66 2HE2 GLN 66 18.936 -2.162 -8.023 1153 H LEU 67 H LEU 67 15.290 -1.071 -2.929 1154 HA LEU 67 HA LEU 67 16.424 -0.676 -0.385 1155 1HB LEU 67 1HB LEU 67 13.933 0.285 0.018 1156 2HB LEU 67 2HB LEU 67 15.244 1.181 -0.719 1157 HG LEU 67 HG LEU 67 14.042 -0.165 -2.842 1158 1HD1 LEU 67 1HD1 LEU 67 12.043 0.764 -0.813 1159 2HD1 LEU 67 2HD1 LEU 67 12.088 -0.752 -1.712 1160 3HD1 LEU 67 3HD1 LEU 67 11.671 0.751 -2.537 1161 1HD2 LEU 67 1HD2 LEU 67 14.361 2.575 -1.841 1162 2HD2 LEU 67 2HD2 LEU 67 13.020 2.346 -2.966 1163 3HD2 LEU 67 3HD2 LEU 67 14.659 1.910 -3.447 1164 H VAL 68 H VAL 68 13.867 -2.802 -1.495 1165 HA VAL 68 HA VAL 68 12.869 -3.555 1.050 1166 HB VAL 68 HB VAL 68 12.959 -5.133 -1.532 1167 1HG1 VAL 68 1HG1 VAL 68 11.836 -6.837 -0.568 1168 2HG1 VAL 68 2HG1 VAL 68 10.959 -5.777 0.530 1169 3HG1 VAL 68 3HG1 VAL 68 12.617 -6.244 0.898 1170 1HG2 VAL 68 1HG2 VAL 68 10.379 -4.523 -1.156 1171 2HG2 VAL 68 2HG2 VAL 68 11.489 -3.510 -2.076 1172 3HG2 VAL 68 3HG2 VAL 68 11.127 -3.121 -0.396 1173 H ASP 69 H ASP 69 15.456 -4.791 -1.009 1174 HA ASP 69 HA ASP 69 16.233 -6.949 0.650 1175 1HB ASP 69 1HB ASP 69 16.898 -6.600 -1.764 1176 2HB ASP 69 2HB ASP 69 18.021 -5.362 -1.199 1177 H ASN 70 H ASN 70 17.362 -3.617 0.339 1178 HA ASN 70 HA ASN 70 19.413 -3.637 2.220 1179 1HB ASN 70 1HB ASN 70 19.368 -1.676 1.000 1180 2HB ASN 70 2HB ASN 70 17.614 -1.543 1.076 1181 1HD2 ASN 70 1HD2 ASN 70 20.531 -1.291 3.062 1182 2HD2 ASN 70 2HD2 ASN 70 19.916 -0.054 4.108 1183 H TRP 71 H TRP 71 16.020 -2.692 2.675 1184 HA TRP 71 HA TRP 71 16.129 -2.260 5.434 1185 1HB TRP 71 1HB TRP 71 14.294 -1.535 3.938 1186 2HB TRP 71 2HB TRP 71 13.781 -3.210 3.786 1187 HD1 TRP 71 HD1 TRP 71 13.929 -0.363 6.346 1188 HE1 TRP 71 HE1 TRP 71 12.199 -0.835 8.195 1189 HE3 TRP 71 HE3 TRP 71 12.475 -5.038 4.893 1190 HZ2 TRP 71 HZ2 TRP 71 10.439 -2.924 8.931 1191 HZ3 TRP 71 HZ3 TRP 71 10.748 -6.202 6.208 1192 HH2 TRP 71 HH2 TRP 71 9.748 -5.164 8.189 1193 H LEU 72 H LEU 72 15.375 -5.178 3.586 1194 HA LEU 72 HA LEU 72 14.560 -6.785 5.710 1195 1HB LEU 72 1HB LEU 72 14.902 -7.077 2.984 1196 2HB LEU 72 2HB LEU 72 16.033 -8.234 3.662 1197 HG LEU 72 HG LEU 72 13.799 -8.752 5.133 1198 1HD1 LEU 72 1HD1 LEU 72 12.488 -8.785 2.557 1199 2HD1 LEU 72 2HD1 LEU 72 12.858 -7.143 3.084 1200 3HD1 LEU 72 3HD1 LEU 72 11.903 -8.205 4.116 1201 1HD2 LEU 72 1HD2 LEU 72 15.328 -9.979 3.049 1202 2HD2 LEU 72 2HD2 LEU 72 13.621 -10.368 2.837 1203 3HD2 LEU 72 3HD2 LEU 72 14.426 -10.736 4.364 1204 H LYS 73 H LYS 73 17.786 -5.998 4.587 1205 HA LYS 73 HA LYS 73 18.952 -7.982 6.371 1206 1HB LYS 73 1HB LYS 73 20.314 -6.040 4.500 1207 2HB LYS 73 2HB LYS 73 21.074 -7.396 5.328 1208 1HG LYS 73 1HG LYS 73 19.703 -8.962 4.077 1209 2HG LYS 73 2HG LYS 73 18.866 -7.625 3.289 1210 1HD LYS 73 1HD LYS 73 20.620 -7.163 1.904 1211 2HD LYS 73 2HD LYS 73 21.826 -7.684 3.082 1212 1HE LYS 73 1HE LYS 73 21.785 -9.207 1.192 1213 2HE LYS 73 2HE LYS 73 21.220 -10.025 2.648 1214 1HZ LYS 73 1HZ LYS 73 18.955 -9.765 1.910 1215 2HZ LYS 73 2HZ LYS 73 19.852 -10.521 0.688 1216 3HZ LYS 73 3HZ LYS 73 19.450 -8.881 0.550 1217 H GLU 74 H GLU 74 18.336 -4.580 6.261 1218 HA GLU 74 HA GLU 74 20.251 -3.935 8.322 1219 1HB GLU 74 1HB GLU 74 18.158 -2.396 6.822 1220 2HB GLU 74 2HB GLU 74 18.904 -1.706 8.258 1221 1HG GLU 74 1HG GLU 74 20.481 -2.730 5.920 1222 2HG GLU 74 2HG GLU 74 19.930 -1.062 6.058 1223 H ASN 75 H ASN 75 16.738 -4.242 8.075 1224 HA ASN 75 HA ASN 75 16.314 -3.582 10.826 1225 1HB ASN 75 1HB ASN 75 14.162 -3.350 10.221 1226 2HB ASN 75 2HB ASN 75 14.741 -3.578 8.574 1227 1HD2 ASN 75 1HD2 ASN 75 14.469 -5.589 7.576 1228 2HD2 ASN 75 2HD2 ASN 75 13.332 -6.749 8.174 1229 H GLU 76 H GLU 76 17.119 -6.470 9.194 1230 HA GLU 76 HA GLU 76 15.843 -8.331 10.917 1231 1HB GLU 76 1HB GLU 76 17.150 -8.541 8.544 1232 2HB GLU 76 2HB GLU 76 18.375 -9.159 9.644 1233 1HG GLU 76 1HG GLU 76 15.763 -10.276 10.194 1234 2HG GLU 76 2HG GLU 76 16.281 -10.574 8.536
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