NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
12207 | 1so9 | 6190 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H VAL 21 H VAL 21 -0.612 10.524 14.458 2 HA VAL 21 HA VAL 21 -1.044 8.015 16.066 3 HB VAL 21 HB VAL 21 -2.685 9.333 17.288 4 1HG1 VAL 21 1HG1 VAL 21 -1.084 10.648 18.597 5 2HG1 VAL 21 2HG1 VAL 21 -0.357 9.109 18.105 6 3HG1 VAL 21 3HG1 VAL 21 0.086 10.610 17.265 7 1HG2 VAL 21 1HG2 VAL 21 -2.777 11.772 17.134 8 2HG2 VAL 21 2HG2 VAL 21 -1.621 11.781 15.795 9 3HG2 VAL 21 3HG2 VAL 21 -3.232 11.067 15.581 10 H GLU 22 H GLU 22 -1.263 7.979 13.319 11 HA GLU 22 HA GLU 22 -2.479 7.960 11.472 12 1HB GLU 22 1HB GLU 22 -3.240 5.910 12.826 13 2HB GLU 22 2HB GLU 22 -4.808 6.716 12.938 14 1HG GLU 22 1HG GLU 22 -5.104 6.622 10.540 15 2HG GLU 22 2HG GLU 22 -3.397 6.335 10.244 16 H GLN 23 H GLN 23 -2.533 10.309 13.037 17 HA GLN 23 HA GLN 23 -3.916 11.624 11.062 18 1HB GLN 23 1HB GLN 23 -4.497 12.195 13.998 19 2HB GLN 23 2HB GLN 23 -4.128 13.569 13.035 20 1HG GLN 23 1HG GLN 23 -6.191 11.730 11.839 21 2HG GLN 23 2HG GLN 23 -6.636 12.793 13.186 22 1HE2 GLN 23 1HE2 GLN 23 -4.683 13.088 10.006 23 2HE2 GLN 23 2HE2 GLN 23 -4.959 14.777 10.002 24 H ALA 24 H ALA 24 -2.820 13.751 10.916 25 HA ALA 24 HA ALA 24 -0.347 14.085 12.471 26 1HB ALA 24 1HB ALA 24 0.157 12.992 10.176 27 2HB ALA 24 2HB ALA 24 -0.570 14.440 9.468 28 3HB ALA 24 3HB ALA 24 0.907 14.591 10.443 29 H SER 25 H SER 25 -0.621 16.161 13.314 30 HA SER 25 HA SER 25 -2.023 18.222 11.755 31 1HB SER 25 1HB SER 25 -3.057 17.468 14.531 32 2HB SER 25 2HB SER 25 -3.761 18.623 13.390 33 HG SER 25 HG SER 25 -3.795 16.551 11.979 34 H ASP 26 H ASP 26 0.505 18.029 12.356 35 HA ASP 26 HA ASP 26 1.174 20.528 13.640 36 1HB ASP 26 1HB ASP 26 1.184 19.345 15.706 37 2HB ASP 26 2HB ASP 26 1.895 17.895 14.997 38 H LEU 27 H LEU 27 2.335 17.362 12.711 39 HA LEU 27 HA LEU 27 4.778 17.980 11.473 40 1HB LEU 27 1HB LEU 27 2.826 15.728 10.887 41 2HB LEU 27 2HB LEU 27 4.494 15.786 10.366 42 HG LEU 27 HG LEU 27 4.398 14.338 12.171 43 1HD1 LEU 27 1HD1 LEU 27 5.539 16.905 13.338 44 2HD1 LEU 27 2HD1 LEU 27 5.955 15.246 13.790 45 3HD1 LEU 27 3HD1 LEU 27 6.366 15.843 12.177 46 1HD2 LEU 27 1HD2 LEU 27 2.225 15.265 13.180 47 2HD2 LEU 27 2HD2 LEU 27 3.435 14.667 14.317 48 3HD2 LEU 27 3HD2 LEU 27 3.279 16.386 14.093 49 H ILE 28 H ILE 28 1.502 18.307 10.269 50 HA ILE 28 HA ILE 28 2.138 18.311 7.452 51 HB ILE 28 HB ILE 28 -0.302 19.408 8.913 52 1HG1 ILE 28 1HG1 ILE 28 0.391 16.720 7.660 53 2HG1 ILE 28 2HG1 ILE 28 0.008 17.062 9.345 54 1HG2 ILE 28 1HG2 ILE 28 -1.402 19.388 6.810 55 2HG2 ILE 28 2HG2 ILE 28 0.122 20.182 6.438 56 3HG2 ILE 28 3HG2 ILE 28 -0.089 18.465 6.045 57 1HD1 ILE 28 1HD1 ILE 28 -1.997 17.317 7.091 58 2HD1 ILE 28 2HD1 ILE 28 -1.943 16.054 8.322 59 3HD1 ILE 28 3HD1 ILE 28 -2.272 17.740 8.793 60 H LEU 29 H LEU 29 3.972 19.686 7.531 61 HA LEU 29 HA LEU 29 3.340 22.599 7.466 62 1HB LEU 29 1HB LEU 29 5.854 21.479 6.295 63 2HB LEU 29 2HB LEU 29 5.549 22.995 7.118 64 HG LEU 29 HG LEU 29 5.903 20.201 8.312 65 1HD1 LEU 29 1HD1 LEU 29 7.867 21.137 9.383 66 2HD1 LEU 29 2HD1 LEU 29 7.947 21.352 7.625 67 3HD1 LEU 29 3HD1 LEU 29 7.529 22.731 8.671 68 1HD2 LEU 29 1HD2 LEU 29 4.213 21.243 9.773 69 2HD2 LEU 29 2HD2 LEU 29 5.767 21.245 10.570 70 3HD2 LEU 29 3HD2 LEU 29 5.167 22.742 9.812 71 H ASP 30 H ASP 30 3.187 23.654 5.301 72 HA ASP 30 HA ASP 30 2.136 21.860 3.308 73 1HB ASP 30 1HB ASP 30 2.569 24.839 3.333 74 2HB ASP 30 2HB ASP 30 1.843 23.986 1.970 75 H GLU 31 H GLU 31 4.386 20.806 3.530 76 HA GLU 31 HA GLU 31 6.064 21.465 1.153 77 1HB GLU 31 1HB GLU 31 6.977 20.990 3.734 78 2HB GLU 31 2HB GLU 31 6.845 19.327 3.140 79 1HG GLU 31 1HG GLU 31 8.415 21.590 1.827 80 2HG GLU 31 2HG GLU 31 9.083 20.336 2.877 81 H LYS 32 H LYS 32 6.145 19.722 -0.374 82 HA LYS 32 HA LYS 32 3.725 18.010 -0.173 83 1HB LYS 32 1HB LYS 32 3.968 19.782 -2.035 84 2HB LYS 32 2HB LYS 32 5.298 18.775 -2.658 85 1HG LYS 32 1HG LYS 32 3.626 16.821 -2.306 86 2HG LYS 32 2HG LYS 32 2.395 18.072 -2.162 87 1HD LYS 32 1HD LYS 32 4.330 17.833 -4.520 88 2HD LYS 32 2HD LYS 32 2.899 16.823 -4.462 89 1HE LYS 32 1HE LYS 32 2.740 19.878 -4.304 90 2HE LYS 32 2HE LYS 32 2.733 18.992 -5.839 91 1HZ LYS 32 1HZ LYS 32 0.806 17.802 -5.144 92 2HZ LYS 32 2HZ LYS 32 0.739 18.576 -3.715 93 3HZ LYS 32 3HZ LYS 32 0.496 19.413 -5.118 94 H ILE 33 H ILE 33 4.089 15.985 0.276 95 HA ILE 33 HA ILE 33 6.576 14.647 -0.614 96 HB ILE 33 HB ILE 33 5.195 14.564 1.808 97 1HG1 ILE 33 1HG1 ILE 33 7.543 14.042 1.391 98 2HG1 ILE 33 2HG1 ILE 33 6.739 12.899 2.440 99 1HG2 ILE 33 1HG2 ILE 33 3.383 13.257 0.727 100 2HG2 ILE 33 2HG2 ILE 33 4.507 11.990 0.310 101 3HG2 ILE 33 3HG2 ILE 33 4.182 12.385 2.011 102 1HD1 ILE 33 1HD1 ILE 33 7.341 12.456 -0.494 103 2HD1 ILE 33 2HD1 ILE 33 8.190 11.708 0.882 104 3HD1 ILE 33 3HD1 ILE 33 6.525 11.287 0.524 105 H LYS 34 H LYS 34 6.335 13.015 -2.197 106 HA LYS 34 HA LYS 34 3.680 12.669 -3.517 107 1HB LYS 34 1HB LYS 34 5.964 13.563 -4.632 108 2HB LYS 34 2HB LYS 34 6.299 11.833 -4.719 109 1HG LYS 34 1HG LYS 34 3.690 13.058 -5.733 110 2HG LYS 34 2HG LYS 34 5.178 13.022 -6.721 111 1HD LYS 34 1HD LYS 34 5.268 10.556 -6.454 112 2HD LYS 34 2HD LYS 34 3.873 10.637 -5.459 113 1HE LYS 34 1HE LYS 34 3.453 9.967 -7.826 114 2HE LYS 34 2HE LYS 34 2.348 11.113 -6.943 115 1HZ LYS 34 1HZ LYS 34 2.544 11.560 -9.090 116 2HZ LYS 34 2HZ LYS 34 3.143 12.843 -8.223 117 3HZ LYS 34 3HZ LYS 34 4.188 11.841 -9.070 118 H VAL 35 H VAL 35 3.070 10.285 -3.762 119 HA VAL 35 HA VAL 35 5.032 8.374 -2.636 120 HB VAL 35 HB VAL 35 2.207 8.898 -1.779 121 1HG1 VAL 35 1HG1 VAL 35 2.100 6.633 -0.724 122 2HG1 VAL 35 2HG1 VAL 35 2.032 6.582 -2.486 123 3HG1 VAL 35 3HG1 VAL 35 3.543 6.174 -1.646 124 1HG2 VAL 35 1HG2 VAL 35 2.990 8.548 0.442 125 2HG2 VAL 35 2HG2 VAL 35 4.591 8.019 -0.156 126 3HG2 VAL 35 3HG2 VAL 35 4.046 9.707 -0.345 127 H THR 36 H THR 36 4.775 6.354 -3.704 128 HA THR 36 HA THR 36 3.094 6.465 -6.147 129 HB THR 36 HB THR 36 6.102 6.293 -6.077 130 HG1 THR 36 HG1 THR 36 4.168 8.166 -6.551 131 1HG2 THR 36 1HG2 THR 36 4.202 5.978 -8.441 132 2HG2 THR 36 2HG2 THR 36 5.974 6.144 -8.512 133 3HG2 THR 36 3HG2 THR 36 5.255 4.700 -7.778 134 H PHE 37 H PHE 37 1.842 4.905 -5.788 135 HA PHE 37 HA PHE 37 2.453 2.506 -4.226 136 1HB PHE 37 1HB PHE 37 -0.032 3.424 -5.752 137 2HB PHE 37 2HB PHE 37 0.070 2.054 -4.670 138 HD1 PHE 37 HD1 PHE 37 1.730 3.588 -2.435 139 HD2 PHE 37 HD2 PHE 37 -1.876 4.432 -4.664 140 HE1 PHE 37 HE1 PHE 37 0.763 4.687 -0.469 141 HE2 PHE 37 HE2 PHE 37 -2.862 5.467 -2.655 142 HZ PHE 37 HZ PHE 37 -1.535 5.589 -0.534 143 H ASP 38 H ASP 38 3.917 1.320 -5.576 144 HA ASP 38 HA ASP 38 3.002 0.683 -8.312 145 1HB ASP 38 1HB ASP 38 5.425 1.218 -7.757 146 2HB ASP 38 2HB ASP 38 5.510 -0.330 -6.927 147 H ALA 39 H ALA 39 1.055 -0.255 -7.655 148 HA ALA 39 HA ALA 39 1.002 -2.703 -6.100 149 1HB ALA 39 1HB ALA 39 -1.368 -2.768 -6.833 150 2HB ALA 39 2HB ALA 39 -0.906 -1.176 -6.191 151 3HB ALA 39 3HB ALA 39 -1.048 -1.433 -7.947 152 H ASN 40 H ASN 40 2.240 -4.417 -6.992 153 HA ASN 40 HA ASN 40 1.744 -5.161 -9.841 154 1HB ASN 40 1HB ASN 40 3.763 -6.379 -7.915 155 2HB ASN 40 2HB ASN 40 3.606 -6.651 -9.645 156 1HD2 ASN 40 1HD2 ASN 40 4.360 -4.175 -7.174 157 2HD2 ASN 40 2HD2 ASN 40 5.198 -3.098 -8.305 158 H VAL 41 H VAL 41 1.006 -7.255 -10.350 159 HA VAL 41 HA VAL 41 0.331 -9.106 -8.209 160 HB VAL 41 HB VAL 41 -1.755 -7.899 -8.424 161 1HG1 VAL 41 1HG1 VAL 41 -1.471 -6.813 -10.608 162 2HG1 VAL 41 2HG1 VAL 41 -1.620 -8.383 -11.430 163 3HG1 VAL 41 3HG1 VAL 41 -2.996 -7.703 -10.542 164 1HG2 VAL 41 1HG2 VAL 41 -3.272 -9.664 -9.006 165 2HG2 VAL 41 2HG2 VAL 41 -2.078 -10.455 -10.046 166 3HG2 VAL 41 3HG2 VAL 41 -1.839 -10.418 -8.291 167 H ALA 42 H ALA 42 0.425 -11.237 -8.866 168 HA ALA 42 HA ALA 42 0.975 -11.821 -11.717 169 1HB ALA 42 1HB ALA 42 2.708 -12.804 -9.409 170 2HB ALA 42 2HB ALA 42 2.911 -13.203 -11.125 171 3HB ALA 42 3HB ALA 42 3.197 -11.544 -10.565 172 H ALA 43 H ALA 43 0.983 -14.277 -11.929 173 HA ALA 43 HA ALA 43 -1.385 -15.395 -11.677 174 1HB ALA 43 1HB ALA 43 -0.264 -17.628 -11.748 175 2HB ALA 43 2HB ALA 43 0.494 -16.452 -12.837 176 3HB ALA 43 3HB ALA 43 1.264 -16.857 -11.290 177 H GLY 44 H GLY 44 1.053 -15.926 -9.196 178 1HA GLY 44 1HA GLY 44 -0.023 -17.473 -7.290 179 2HA GLY 44 2HA GLY 44 0.932 -16.045 -6.908 180 H LEU 45 H LEU 45 -1.077 -14.067 -7.828 181 HA LEU 45 HA LEU 45 -3.354 -14.605 -6.000 182 1HB LEU 45 1HB LEU 45 -1.400 -12.553 -5.736 183 2HB LEU 45 2HB LEU 45 -2.874 -11.768 -6.251 184 HG LEU 45 HG LEU 45 -3.027 -13.831 -4.008 185 1HD1 LEU 45 1HD1 LEU 45 -1.810 -11.100 -3.970 186 2HD1 LEU 45 2HD1 LEU 45 -3.081 -11.333 -2.765 187 3HD1 LEU 45 3HD1 LEU 45 -1.661 -12.372 -2.782 188 1HD2 LEU 45 1HD2 LEU 45 -4.948 -12.629 -3.469 189 2HD2 LEU 45 2HD2 LEU 45 -4.624 -11.360 -4.684 190 3HD2 LEU 45 3HD2 LEU 45 -5.025 -13.023 -5.203 191 HA PRO 46 HA PRO 46 -4.790 -13.964 -10.298 192 1HB PRO 46 1HB PRO 46 -6.727 -15.821 -10.415 193 2HB PRO 46 2HB PRO 46 -5.008 -16.280 -10.208 194 1HG PRO 46 1HG PRO 46 -7.048 -15.952 -7.989 195 2HG PRO 46 2HG PRO 46 -6.082 -17.413 -8.344 196 1HD PRO 46 1HD PRO 46 -5.274 -15.527 -6.547 197 2HD PRO 46 2HD PRO 46 -4.085 -16.383 -7.582 198 H TRP 47 H TRP 47 -5.379 -12.006 -8.351 199 HA TRP 47 HA TRP 47 -8.351 -11.698 -8.362 200 1HB TRP 47 1HB TRP 47 -6.332 -10.777 -6.303 201 2HB TRP 47 2HB TRP 47 -8.052 -10.401 -6.323 202 HD1 TRP 47 HD1 TRP 47 -8.042 -13.880 -7.260 203 HE1 TRP 47 HE1 TRP 47 -8.331 -15.455 -5.315 204 HE3 TRP 47 HE3 TRP 47 -7.088 -10.670 -3.345 205 HZ2 TRP 47 HZ2 TRP 47 -8.243 -15.441 -2.538 206 HZ3 TRP 47 HZ3 TRP 47 -6.830 -11.706 -1.108 207 HH2 TRP 47 HH2 TRP 47 -7.474 -13.985 -0.645 208 H GLU 48 H GLU 48 -9.126 -9.712 -8.927 209 HA GLU 48 HA GLU 48 -7.422 -8.177 -10.762 210 1HB GLU 48 1HB GLU 48 -9.769 -8.920 -11.227 211 2HB GLU 48 2HB GLU 48 -10.336 -7.901 -9.910 212 1HG GLU 48 1HG GLU 48 -9.591 -5.894 -11.116 213 2HG GLU 48 2HG GLU 48 -8.932 -6.900 -12.418 214 H PHE 49 H PHE 49 -6.024 -7.675 -9.029 215 HA PHE 49 HA PHE 49 -6.788 -5.905 -6.861 216 1HB PHE 49 1HB PHE 49 -5.068 -7.571 -6.534 217 2HB PHE 49 2HB PHE 49 -4.090 -6.862 -7.821 218 HD1 PHE 49 HD1 PHE 49 -2.140 -5.956 -6.852 219 HD2 PHE 49 HD2 PHE 49 -5.918 -5.377 -4.834 220 HE1 PHE 49 HE1 PHE 49 -1.024 -4.602 -5.121 221 HE2 PHE 49 HE2 PHE 49 -4.788 -4.021 -3.120 222 HZ PHE 49 HZ PHE 49 -2.352 -3.572 -3.281 223 H VAL 50 H VAL 50 -7.605 -4.003 -7.792 224 HA VAL 50 HA VAL 50 -5.968 -2.698 -9.873 225 HB VAL 50 HB VAL 50 -7.758 -1.219 -10.289 226 1HG1 VAL 50 1HG1 VAL 50 -8.908 -4.004 -9.864 227 2HG1 VAL 50 2HG1 VAL 50 -9.425 -2.796 -11.052 228 3HG1 VAL 50 3HG1 VAL 50 -7.832 -3.556 -11.207 229 1HG2 VAL 50 1HG2 VAL 50 -8.698 -0.657 -8.167 230 2HG2 VAL 50 2HG2 VAL 50 -9.968 -1.513 -9.051 231 3HG2 VAL 50 3HG2 VAL 50 -9.037 -2.359 -7.796 232 HA PRO 51 HA PRO 51 -4.481 0.285 -6.726 233 1HB PRO 51 1HB PRO 51 -3.091 1.953 -8.375 234 2HB PRO 51 2HB PRO 51 -2.443 0.375 -7.859 235 1HG PRO 51 1HG PRO 51 -3.842 1.062 -10.454 236 2HG PRO 51 2HG PRO 51 -2.336 0.122 -10.241 237 1HD PRO 51 1HD PRO 51 -4.809 -1.008 -10.592 238 2HD PRO 51 2HD PRO 51 -3.547 -1.808 -9.603 239 H VAL 52 H VAL 52 -5.196 2.441 -6.344 240 HA VAL 52 HA VAL 52 -7.674 3.149 -7.709 241 HB VAL 52 HB VAL 52 -7.428 5.186 -6.027 242 1HG1 VAL 52 1HG1 VAL 52 -8.776 3.816 -4.462 243 2HG1 VAL 52 2HG1 VAL 52 -9.308 3.664 -6.143 244 3HG1 VAL 52 3HG1 VAL 52 -8.353 2.363 -5.404 245 1HG2 VAL 52 1HG2 VAL 52 -5.995 2.884 -4.672 246 2HG2 VAL 52 2HG2 VAL 52 -5.183 4.363 -5.220 247 3HG2 VAL 52 3HG2 VAL 52 -6.422 4.444 -3.944 248 H GLN 53 H GLN 53 -4.537 4.655 -7.063 249 HA GLN 53 HA GLN 53 -4.439 5.840 -9.731 250 1HB GLN 53 1HB GLN 53 -3.624 7.289 -7.187 251 2HB GLN 53 2HB GLN 53 -3.313 7.837 -8.813 252 1HG GLN 53 1HG GLN 53 -5.127 9.138 -8.142 253 2HG GLN 53 2HG GLN 53 -5.803 7.933 -9.246 254 1HE2 GLN 53 1HE2 GLN 53 -4.910 7.684 -5.734 255 2HE2 GLN 53 2HE2 GLN 53 -6.530 7.266 -5.232 256 H ARG 54 H ARG 54 -1.996 6.066 -10.211 257 HA ARG 54 HA ARG 54 -0.534 3.813 -9.124 258 1HB ARG 54 1HB ARG 54 -0.208 4.849 -11.420 259 2HB ARG 54 2HB ARG 54 0.587 6.201 -10.636 260 1HG ARG 54 1HG ARG 54 2.248 4.634 -11.495 261 2HG ARG 54 2HG ARG 54 2.353 4.693 -9.741 262 1HD ARG 54 1HD ARG 54 1.384 2.620 -9.491 263 2HD ARG 54 2HD ARG 54 0.762 2.617 -11.135 264 HE ARG 54 HE ARG 54 3.362 1.629 -10.209 265 1HH1 ARG 54 1HH1 ARG 54 1.805 3.113 -12.996 266 2HH1 ARG 54 2HH1 ARG 54 2.838 2.333 -14.163 267 1HH2 ARG 54 1HH2 ARG 54 4.648 0.611 -11.613 268 2HH2 ARG 54 2HH2 ARG 54 4.581 0.858 -13.349 269 H ASP 55 H ASP 55 -0.771 7.311 -8.395 270 HA ASP 55 HA ASP 55 1.026 7.073 -6.095 271 1HB ASP 55 1HB ASP 55 1.777 9.160 -6.919 272 2HB ASP 55 2HB ASP 55 2.156 7.896 -8.100 273 H ILE 56 H ILE 56 0.976 9.089 -4.836 274 HA ILE 56 HA ILE 56 -1.531 10.591 -4.851 275 HB ILE 56 HB ILE 56 -1.876 10.520 -2.452 276 1HG1 ILE 56 1HG1 ILE 56 0.218 8.360 -2.547 277 2HG1 ILE 56 2HG1 ILE 56 0.397 9.986 -1.829 278 1HG2 ILE 56 1HG2 ILE 56 -1.902 7.711 -3.594 279 2HG2 ILE 56 2HG2 ILE 56 -2.946 8.395 -2.321 280 3HG2 ILE 56 3HG2 ILE 56 -3.104 8.969 -3.988 281 1HD1 ILE 56 1HD1 ILE 56 -1.474 7.846 -0.743 282 2HD1 ILE 56 2HD1 ILE 56 0.105 8.261 -0.080 283 3HD1 ILE 56 3HD1 ILE 56 -1.196 9.462 -0.072 284 H ASP 57 H ASP 57 -1.298 12.518 -3.451 285 HA ASP 57 HA ASP 57 1.502 13.341 -2.888 286 1HB ASP 57 1HB ASP 57 -0.934 15.031 -3.623 287 2HB ASP 57 2HB ASP 57 0.512 15.670 -2.834 288 H VAL 58 H VAL 58 1.767 13.951 -0.757 289 HA VAL 58 HA VAL 58 -0.579 14.360 1.028 290 HB VAL 58 HB VAL 58 -0.465 12.621 2.159 291 1HG1 VAL 58 1HG1 VAL 58 0.964 10.708 1.854 292 2HG1 VAL 58 2HG1 VAL 58 0.299 11.300 0.336 293 3HG1 VAL 58 3HG1 VAL 58 1.997 11.599 0.731 294 1HG2 VAL 58 1HG2 VAL 58 1.274 12.258 3.787 295 2HG2 VAL 58 2HG2 VAL 58 2.368 13.345 2.928 296 3HG2 VAL 58 3HG2 VAL 58 0.857 13.957 3.638 297 H ARG 59 H ARG 59 -0.171 16.365 2.193 298 HA ARG 59 HA ARG 59 2.640 17.307 2.071 299 1HB ARG 59 1HB ARG 59 0.149 18.630 3.128 300 2HB ARG 59 2HB ARG 59 1.788 19.152 3.511 301 1HG ARG 59 1HG ARG 59 1.498 20.419 1.640 302 2HG ARG 59 2HG ARG 59 2.249 19.048 0.928 303 1HD ARG 59 1HD ARG 59 0.488 19.437 -0.537 304 2HD ARG 59 2HD ARG 59 0.010 18.053 0.387 305 HE ARG 59 HE ARG 59 -1.700 19.079 1.353 306 1HH1 ARG 59 1HH1 ARG 59 0.272 21.811 0.168 307 2HH1 ARG 59 2HH1 ARG 59 -0.223 22.790 1.557 308 1HH2 ARG 59 1HH2 ARG 59 -2.329 20.460 2.967 309 2HH2 ARG 59 2HH2 ARG 59 -1.548 22.097 3.083 310 H ILE 60 H ILE 60 3.694 15.787 2.958 311 HA ILE 60 HA ILE 60 4.338 14.266 4.673 312 HB ILE 60 HB ILE 60 5.754 15.774 6.200 313 1HG1 ILE 60 1HG1 ILE 60 4.983 17.807 4.080 314 2HG1 ILE 60 2HG1 ILE 60 4.199 17.772 5.654 315 1HG2 ILE 60 1HG2 ILE 60 7.414 15.999 4.489 316 2HG2 ILE 60 2HG2 ILE 60 6.529 14.511 4.187 317 3HG2 ILE 60 3HG2 ILE 60 6.194 15.964 3.208 318 1HD1 ILE 60 1HD1 ILE 60 7.190 18.075 5.190 319 2HD1 ILE 60 2HD1 ILE 60 6.055 19.405 5.478 320 3HD1 ILE 60 3HD1 ILE 60 6.330 18.208 6.756 321 H GLY 61 H GLY 61 2.019 13.781 5.328 322 1HA GLY 61 1HA GLY 61 1.558 13.043 7.713 323 2HA GLY 61 2HA GLY 61 1.400 14.753 8.091 324 H GLU 62 H GLU 62 0.167 15.441 5.582 325 HA GLU 62 HA GLU 62 -2.489 15.440 6.047 326 1HB GLU 62 1HB GLU 62 -0.904 16.342 4.130 327 2HB GLU 62 2HB GLU 62 -1.653 15.037 3.194 328 1HG GLU 62 1HG GLU 62 -3.832 16.108 3.486 329 2HG GLU 62 2HG GLU 62 -3.178 17.211 4.724 330 H THR 63 H THR 63 -3.704 13.841 6.750 331 HA THR 63 HA THR 63 -3.019 11.152 6.144 332 HB THR 63 HB THR 63 -5.304 11.920 7.946 333 HG1 THR 63 HG1 THR 63 -2.595 12.737 8.228 334 1HG2 THR 63 1HG2 THR 63 -3.997 9.602 7.699 335 2HG2 THR 63 2HG2 THR 63 -2.806 10.444 8.731 336 3HG2 THR 63 3HG2 THR 63 -4.471 10.211 9.291 337 H VAL 64 H VAL 64 -3.695 10.643 4.053 338 HA VAL 64 HA VAL 64 -6.352 11.487 3.148 339 HB VAL 64 HB VAL 64 -4.324 11.866 1.845 340 1HG1 VAL 64 1HG1 VAL 64 -4.226 8.839 1.531 341 2HG1 VAL 64 2HG1 VAL 64 -3.342 9.997 0.518 342 3HG1 VAL 64 3HG1 VAL 64 -2.995 9.901 2.250 343 1HG2 VAL 64 1HG2 VAL 64 -6.587 11.690 0.731 344 2HG2 VAL 64 2HG2 VAL 64 -5.167 11.454 -0.298 345 3HG2 VAL 64 3HG2 VAL 64 -6.106 10.052 0.206 346 H GLN 65 H GLN 65 -7.555 9.866 1.635 347 HA GLN 65 HA GLN 65 -7.699 7.094 2.777 348 1HB GLN 65 1HB GLN 65 -9.956 8.767 1.628 349 2HB GLN 65 2HB GLN 65 -10.059 7.123 2.270 350 1HG GLN 65 1HG GLN 65 -9.339 9.574 3.957 351 2HG GLN 65 2HG GLN 65 -10.961 8.919 3.768 352 1HE2 GLN 65 1HE2 GLN 65 -7.628 7.910 4.835 353 2HE2 GLN 65 2HE2 GLN 65 -8.265 6.803 6.043 354 H ILE 66 H ILE 66 -7.021 5.672 1.376 355 HA ILE 66 HA ILE 66 -7.763 6.030 -1.447 356 HB ILE 66 HB ILE 66 -5.331 4.940 -1.859 357 1HG1 ILE 66 1HG1 ILE 66 -3.675 6.566 -0.768 358 2HG1 ILE 66 2HG1 ILE 66 -4.871 6.889 0.466 359 1HG2 ILE 66 1HG2 ILE 66 -5.819 7.923 -1.711 360 2HG2 ILE 66 2HG2 ILE 66 -4.708 7.043 -2.788 361 3HG2 ILE 66 3HG2 ILE 66 -6.447 6.863 -3.002 362 1HD1 ILE 66 1HD1 ILE 66 -3.688 4.154 -0.219 363 2HD1 ILE 66 2HD1 ILE 66 -3.238 5.186 1.163 364 3HD1 ILE 66 3HD1 ILE 66 -4.859 4.493 1.071 365 H MET 67 H MET 67 -9.075 4.487 -1.705 366 HA MET 67 HA MET 67 -8.955 2.017 -0.154 367 1HB MET 67 1HB MET 67 -10.778 2.591 -2.520 368 2HB MET 67 2HB MET 67 -10.988 1.399 -1.229 369 1HG MET 67 1HG MET 67 -12.409 3.033 -0.485 370 2HG MET 67 2HG MET 67 -10.935 3.537 0.350 371 1HE MET 67 1HE MET 67 -12.626 6.955 -0.371 372 2HE MET 67 2HE MET 67 -13.400 5.432 0.129 373 3HE MET 67 3HE MET 67 -11.839 5.917 0.842 374 H TYR 68 H TYR 68 -9.080 -0.161 -1.208 375 HA TYR 68 HA TYR 68 -7.828 -0.344 -3.895 376 1HB TYR 68 1HB TYR 68 -6.871 -1.723 -1.359 377 2HB TYR 68 2HB TYR 68 -6.634 -2.429 -2.952 378 HD1 TYR 68 HD1 TYR 68 -5.760 0.528 -0.843 379 HD2 TYR 68 HD2 TYR 68 -4.992 -1.617 -4.505 380 HE1 TYR 68 HE1 TYR 68 -3.684 1.834 -1.173 381 HE2 TYR 68 HE2 TYR 68 -2.883 -0.352 -4.798 382 HH TYR 68 HH TYR 68 -1.856 2.251 -2.589 383 H ARG 69 H ARG 69 -8.468 -2.217 -5.009 384 HA ARG 69 HA ARG 69 -10.810 -3.702 -3.923 385 1HB ARG 69 1HB ARG 69 -10.894 -1.756 -5.970 386 2HB ARG 69 2HB ARG 69 -10.782 -3.290 -6.845 387 1HG ARG 69 1HG ARG 69 -12.722 -4.152 -5.528 388 2HG ARG 69 2HG ARG 69 -12.869 -2.533 -4.805 389 1HD ARG 69 1HD ARG 69 -13.003 -3.068 -7.793 390 2HD ARG 69 2HD ARG 69 -14.418 -2.953 -6.755 391 HE ARG 69 HE ARG 69 -12.702 -0.780 -7.704 392 1HH1 ARG 69 1HH1 ARG 69 -15.094 -1.726 -5.221 393 2HH1 ARG 69 2HH1 ARG 69 -15.184 -0.246 -4.487 394 1HH2 ARG 69 1HH2 ARG 69 -13.048 1.395 -6.912 395 2HH2 ARG 69 2HH2 ARG 69 -14.247 1.667 -5.679 396 H ALA 70 H ALA 70 -10.389 -5.878 -4.013 397 HA ALA 70 HA ALA 70 -8.710 -6.990 -6.197 398 1HB ALA 70 1HB ALA 70 -7.880 -8.677 -4.675 399 2HB ALA 70 2HB ALA 70 -7.369 -7.055 -4.162 400 3HB ALA 70 3HB ALA 70 -8.687 -7.883 -3.305 401 H LYS 71 H LYS 71 -10.263 -7.924 -7.479 402 HA LYS 71 HA LYS 71 -12.513 -9.385 -6.188 403 1HB LYS 71 1HB LYS 71 -13.480 -7.863 -7.550 404 2HB LYS 71 2HB LYS 71 -12.154 -7.809 -8.718 405 1HG LYS 71 1HG LYS 71 -12.733 -9.875 -9.708 406 2HG LYS 71 2HG LYS 71 -13.836 -10.256 -8.354 407 1HD LYS 71 1HD LYS 71 -15.183 -8.141 -9.142 408 2HD LYS 71 2HD LYS 71 -14.144 -8.186 -10.578 409 1HE LYS 71 1HE LYS 71 -16.199 -9.323 -11.117 410 2HE LYS 71 2HE LYS 71 -14.940 -10.564 -10.994 411 1HZ LYS 71 1HZ LYS 71 -16.895 -9.880 -8.867 412 2HZ LYS 71 2HZ LYS 71 -17.007 -11.178 -9.847 413 3HZ LYS 71 3HZ LYS 71 -15.803 -11.071 -8.747 414 H ASN 72 H ASN 72 -12.429 -11.597 -6.152 415 HA ASN 72 HA ASN 72 -10.076 -12.798 -7.303 416 1HB ASN 72 1HB ASN 72 -10.993 -13.511 -5.152 417 2HB ASN 72 2HB ASN 72 -12.475 -14.066 -5.944 418 1HD2 ASN 72 1HD2 ASN 72 -11.565 -16.054 -4.603 419 2HD2 ASN 72 2HD2 ASN 72 -10.437 -17.120 -5.441 420 H LEU 73 H LEU 73 -9.764 -13.758 -9.282 421 HA LEU 73 HA LEU 73 -12.183 -14.373 -10.951 422 1HB LEU 73 1HB LEU 73 -9.364 -13.640 -11.804 423 2HB LEU 73 2HB LEU 73 -10.731 -13.958 -12.871 424 HG LEU 73 HG LEU 73 -10.504 -11.613 -10.938 425 1HD1 LEU 73 1HD1 LEU 73 -9.011 -11.434 -12.873 426 2HD1 LEU 73 2HD1 LEU 73 -10.354 -11.800 -13.975 427 3HD1 LEU 73 3HD1 LEU 73 -10.358 -10.295 -13.041 428 1HD2 LEU 73 1HD2 LEU 73 -12.537 -10.775 -12.135 429 2HD2 LEU 73 2HD2 LEU 73 -12.686 -12.346 -12.942 430 3HD2 LEU 73 3HD2 LEU 73 -12.869 -12.221 -11.180 431 H ALA 74 H ALA 74 -10.406 -16.098 -8.952 432 HA ALA 74 HA ALA 74 -9.496 -18.227 -10.739 433 1HB ALA 74 1HB ALA 74 -8.364 -17.765 -8.605 434 2HB ALA 74 2HB ALA 74 -9.850 -18.135 -7.722 435 3HB ALA 74 3HB ALA 74 -9.004 -19.410 -8.622 436 H SER 75 H SER 75 -10.299 -20.524 -10.043 437 HA SER 75 HA SER 75 -13.307 -20.562 -10.085 438 1HB SER 75 1HB SER 75 -12.250 -21.421 -12.125 439 2HB SER 75 2HB SER 75 -11.378 -22.644 -11.164 440 HG SER 75 HG SER 75 -13.605 -23.200 -10.409 441 H THR 76 H THR 76 -10.845 -20.837 -7.929 442 HA THR 76 HA THR 76 -12.393 -22.436 -6.075 443 HB THR 76 HB THR 76 -9.985 -23.472 -5.458 444 HG1 THR 76 HG1 THR 76 -8.790 -23.875 -7.366 445 1HG2 THR 76 1HG2 THR 76 -10.438 -25.476 -6.762 446 2HG2 THR 76 2HG2 THR 76 -11.979 -24.817 -6.185 447 3HG2 THR 76 3HG2 THR 76 -11.484 -24.576 -7.873 448 HA PRO 77 HA PRO 77 -11.159 -19.111 -3.647 449 1HB PRO 77 1HB PRO 77 -10.263 -20.133 -1.184 450 2HB PRO 77 2HB PRO 77 -11.974 -20.037 -1.661 451 1HG PRO 77 1HG PRO 77 -10.121 -22.405 -1.948 452 2HG PRO 77 2HG PRO 77 -11.783 -22.378 -1.277 453 1HD PRO 77 1HD PRO 77 -11.383 -23.158 -3.804 454 2HD PRO 77 2HD PRO 77 -12.728 -22.047 -3.454 455 H THR 78 H THR 78 -9.298 -17.881 -2.784 456 HA THR 78 HA THR 78 -6.681 -19.267 -2.882 457 HB THR 78 HB THR 78 -6.270 -16.464 -3.544 458 HG1 THR 78 HG1 THR 78 -6.841 -16.608 -5.672 459 1HG2 THR 78 1HG2 THR 78 -4.711 -18.427 -3.754 460 2HG2 THR 78 2HG2 THR 78 -5.655 -18.911 -5.186 461 3HG2 THR 78 3HG2 THR 78 -4.778 -17.364 -5.162 462 H THR 79 H THR 79 -5.008 -17.805 -1.839 463 HA THR 79 HA THR 79 -6.153 -16.215 0.377 464 HB THR 79 HB THR 79 -5.036 -18.123 1.365 465 HG1 THR 79 HG1 THR 79 -4.888 -15.947 2.259 466 1HG2 THR 79 1HG2 THR 79 -2.524 -17.149 -0.078 467 2HG2 THR 79 2HG2 THR 79 -2.599 -18.416 1.158 468 3HG2 THR 79 3HG2 THR 79 -3.389 -18.668 -0.409 469 H GLY 80 H GLY 80 -4.627 -14.420 0.922 470 1HA GLY 80 1HA GLY 80 -3.005 -13.352 -1.251 471 2HA GLY 80 2HA GLY 80 -4.529 -12.524 -1.014 472 H GLN 81 H GLN 81 -1.637 -13.715 0.573 473 HA GLN 81 HA GLN 81 -1.723 -11.610 2.713 474 1HB GLN 81 1HB GLN 81 -0.352 -13.204 4.040 475 2HB GLN 81 2HB GLN 81 -2.021 -13.698 3.798 476 1HG GLN 81 1HG GLN 81 -1.467 -15.620 2.777 477 2HG GLN 81 2HG GLN 81 -0.323 -14.840 1.680 478 1HE2 GLN 81 1HE2 GLN 81 1.693 -13.954 2.848 479 2HE2 GLN 81 2HE2 GLN 81 2.516 -15.141 3.872 480 H ALA 82 H ALA 82 -0.954 -10.524 0.676 481 HA ALA 82 HA ALA 82 1.462 -11.451 -0.580 482 1HB ALA 82 1HB ALA 82 1.152 -9.389 -1.935 483 2HB ALA 82 2HB ALA 82 -0.326 -10.410 -1.835 484 3HB ALA 82 3HB ALA 82 -0.186 -8.919 -0.871 485 H THR 83 H THR 83 3.446 -10.343 -0.850 486 HA THR 83 HA THR 83 4.299 -8.886 1.485 487 HB THR 83 HB THR 83 5.898 -9.455 -0.962 488 HG1 THR 83 HG1 THR 83 6.451 -11.429 0.183 489 1HG2 THR 83 1HG2 THR 83 7.792 -9.579 0.664 490 2HG2 THR 83 2HG2 THR 83 7.010 -7.995 0.711 491 3HG2 THR 83 3HG2 THR 83 6.670 -9.188 1.981 492 H PHE 84 H PHE 84 5.047 -6.737 1.558 493 HA PHE 84 HA PHE 84 4.913 -5.127 -0.902 494 1HB PHE 84 1HB PHE 84 3.984 -3.248 0.469 495 2HB PHE 84 2HB PHE 84 2.868 -4.566 0.178 496 HD1 PHE 84 HD1 PHE 84 1.774 -5.682 2.012 497 HD2 PHE 84 HD2 PHE 84 5.257 -3.258 2.773 498 HE1 PHE 84 HE1 PHE 84 1.229 -5.643 4.421 499 HE2 PHE 84 HE2 PHE 84 4.747 -3.288 5.190 500 HZ PHE 84 HZ PHE 84 2.719 -4.447 6.022 501 H ASN 85 H ASN 85 6.377 -3.433 -0.948 502 HA ASN 85 HA ASN 85 8.373 -3.151 1.286 503 1HB ASN 85 1HB ASN 85 9.586 -4.278 -0.418 504 2HB ASN 85 2HB ASN 85 8.733 -3.452 -1.715 505 1HD2 ASN 85 1HD2 ASN 85 9.096 -1.010 -1.851 506 2HD2 ASN 85 2HD2 ASN 85 10.733 -0.441 -1.643 507 H VAL 86 H VAL 86 7.794 -1.251 2.191 508 HA VAL 86 HA VAL 86 6.597 0.833 0.483 509 HB VAL 86 HB VAL 86 6.754 0.959 3.473 510 1HG1 VAL 86 1HG1 VAL 86 4.574 2.273 2.917 511 2HG1 VAL 86 2HG1 VAL 86 6.072 3.029 2.371 512 3HG1 VAL 86 3HG1 VAL 86 5.031 2.161 1.234 513 1HG2 VAL 86 1HG2 VAL 86 4.411 -0.001 3.429 514 2HG2 VAL 86 2HG2 VAL 86 4.779 -0.608 1.801 515 3HG2 VAL 86 3HG2 VAL 86 5.744 -1.128 3.200 516 H THR 87 H THR 87 8.821 1.100 -0.552 517 HA THR 87 HA THR 87 10.009 3.426 0.504 518 HB THR 87 HB THR 87 10.884 1.829 2.080 519 HG1 THR 87 HG1 THR 87 13.254 2.411 1.547 520 1HG2 THR 87 1HG2 THR 87 11.087 -0.119 0.734 521 2HG2 THR 87 2HG2 THR 87 12.418 0.600 -0.211 522 3HG2 THR 87 3HG2 THR 87 12.636 0.236 1.514 523 HA PRO 88 HA PRO 88 11.370 3.347 -3.801 524 1HB PRO 88 1HB PRO 88 13.157 5.443 -3.775 525 2HB PRO 88 2HB PRO 88 11.400 5.721 -3.747 526 1HG PRO 88 1HG PRO 88 13.296 5.835 -1.417 527 2HG PRO 88 2HG PRO 88 11.922 6.888 -1.810 528 1HD PRO 88 1HD PRO 88 11.770 4.834 0.003 529 2HD PRO 88 2HD PRO 88 10.389 5.391 -0.944 530 H MET 89 H MET 89 13.430 3.649 -0.942 531 HA MET 89 HA MET 89 14.972 1.410 -1.197 532 1HB MET 89 1HB MET 89 17.231 2.366 -1.799 533 2HB MET 89 2HB MET 89 16.110 2.136 -3.119 534 1HG MET 89 1HG MET 89 15.572 4.744 -2.688 535 2HG MET 89 2HG MET 89 17.180 4.680 -1.953 536 1HE MET 89 1HE MET 89 15.865 2.795 -5.267 537 2HE MET 89 2HE MET 89 15.100 4.403 -5.233 538 3HE MET 89 3HE MET 89 16.357 4.034 -6.435 539 H ALA 90 H ALA 90 15.953 4.775 -0.503 540 HA ALA 90 HA ALA 90 17.452 4.132 1.724 541 1HB ALA 90 1HB ALA 90 17.551 6.538 2.125 542 2HB ALA 90 2HB ALA 90 17.610 6.246 0.375 543 3HB ALA 90 3HB ALA 90 16.098 6.803 1.151 544 H ALA 91 H ALA 91 14.074 5.221 1.608 545 HA ALA 91 HA ALA 91 14.093 5.999 4.386 546 1HB ALA 91 1HB ALA 91 12.900 7.270 2.763 547 2HB ALA 91 2HB ALA 91 11.840 5.913 2.352 548 3HB ALA 91 3HB ALA 91 11.769 6.641 3.983 549 H GLY 92 H GLY 92 11.256 4.243 3.292 550 1HA GLY 92 1HA GLY 92 10.125 2.490 4.232 551 2HA GLY 92 2HA GLY 92 11.686 1.796 4.671 552 H ALA 93 H ALA 93 12.734 3.092 6.603 553 HA ALA 93 HA ALA 93 11.402 2.712 8.967 554 1HB ALA 93 1HB ALA 93 13.074 4.260 9.955 555 2HB ALA 93 2HB ALA 93 13.810 3.136 8.796 556 3HB ALA 93 3HB ALA 93 13.509 4.822 8.328 557 H TYR 94 H TYR 94 11.655 5.765 7.170 558 HA TYR 94 HA TYR 94 9.917 7.234 8.924 559 1HB TYR 94 1HB TYR 94 10.808 7.995 6.135 560 2HB TYR 94 2HB TYR 94 10.312 9.068 7.446 561 HD1 TYR 94 HD1 TYR 94 11.722 8.818 9.702 562 HD2 TYR 94 HD2 TYR 94 13.127 7.575 5.828 563 HE1 TYR 94 HE1 TYR 94 14.000 8.504 10.623 564 HE2 TYR 94 HE2 TYR 94 15.406 7.247 6.759 565 HH TYR 94 HH TYR 94 16.766 7.338 8.664 566 H PHE 95 H PHE 95 8.809 4.734 7.199 567 HA PHE 95 HA PHE 95 6.522 6.113 6.011 568 1HB PHE 95 1HB PHE 95 7.335 3.921 4.956 569 2HB PHE 95 2HB PHE 95 6.989 3.149 6.483 570 HD1 PHE 95 HD1 PHE 95 4.736 5.779 4.901 571 HD2 PHE 95 HD2 PHE 95 5.372 1.584 5.686 572 HE1 PHE 95 HE1 PHE 95 2.358 5.377 4.627 573 HE2 PHE 95 HE2 PHE 95 2.927 1.183 5.338 574 HZ PHE 95 HZ PHE 95 1.458 3.103 4.655 575 H ASN 96 H ASN 96 4.624 6.502 7.092 576 HA ASN 96 HA ASN 96 4.583 5.667 9.826 577 1HB ASN 96 1HB ASN 96 2.591 7.316 8.241 578 2HB ASN 96 2HB ASN 96 2.371 6.894 9.940 579 1HD2 ASN 96 1HD2 ASN 96 3.435 9.390 8.079 580 2HD2 ASN 96 2HD2 ASN 96 4.584 10.105 9.231 581 H LYS 97 H LYS 97 3.682 3.831 10.549 582 HA LYS 97 HA LYS 97 2.306 2.094 10.876 583 1HB LYS 97 1HB LYS 97 0.501 3.777 10.429 584 2HB LYS 97 2HB LYS 97 0.407 3.181 8.763 585 1HG LYS 97 1HG LYS 97 -0.229 0.961 9.535 586 2HG LYS 97 2HG LYS 97 0.027 1.427 11.230 587 1HD LYS 97 1HD LYS 97 -1.771 3.112 11.070 588 2HD LYS 97 2HD LYS 97 -1.996 2.744 9.352 589 1HE LYS 97 1HE LYS 97 -2.692 0.442 9.899 590 2HE LYS 97 2HE LYS 97 -2.397 0.741 11.629 591 1HZ LYS 97 1HZ LYS 97 -4.146 2.361 11.628 592 2HZ LYS 97 2HZ LYS 97 -4.320 2.336 10.071 593 3HZ LYS 97 3HZ LYS 97 -4.767 0.982 10.945 594 H VAL 98 H VAL 98 4.446 1.484 9.684 595 HA VAL 98 HA VAL 98 4.379 0.336 7.140 596 HB VAL 98 HB VAL 98 6.399 0.890 8.429 597 1HG1 VAL 98 1HG1 VAL 98 5.715 -0.047 10.647 598 2HG1 VAL 98 2HG1 VAL 98 5.900 -1.685 9.982 599 3HG1 VAL 98 3HG1 VAL 98 7.303 -0.615 10.111 600 1HG2 VAL 98 1HG2 VAL 98 6.375 -2.019 7.527 601 2HG2 VAL 98 2HG2 VAL 98 6.523 -0.609 6.456 602 3HG2 VAL 98 3HG2 VAL 98 7.780 -0.946 7.658 603 H GLN 99 H GLN 99 3.085 -1.018 10.116 604 HA GLN 99 HA GLN 99 1.664 -2.936 8.525 605 1HB GLN 99 1HB GLN 99 2.345 -4.950 9.705 606 2HB GLN 99 2HB GLN 99 3.751 -4.227 8.922 607 1HG GLN 99 1HG GLN 99 4.410 -3.195 11.115 608 2HG GLN 99 2HG GLN 99 3.054 -4.021 11.894 609 1HE2 GLN 99 1HE2 GLN 99 3.003 -6.543 11.275 610 2HE2 GLN 99 2HE2 GLN 99 4.568 -7.316 11.451 611 H CYS 100 H CYS 100 0.206 -4.262 10.181 612 HA CYS 100 HA CYS 100 -0.294 -3.082 12.734 613 1HB CYS 100 1HB CYS 100 -1.342 -1.390 11.064 614 2HB CYS 100 2HB CYS 100 -2.464 -2.693 10.615 615 HG CYS 100 HG CYS 100 -1.847 -1.319 13.553 616 H PHE 101 H PHE 101 -2.309 -4.282 13.635 617 HA PHE 101 HA PHE 101 -2.394 -7.084 12.762 618 1HB PHE 101 1HB PHE 101 -3.845 -5.438 14.868 619 2HB PHE 101 2HB PHE 101 -4.385 -7.043 14.433 620 HD1 PHE 101 HD1 PHE 101 -1.278 -5.237 15.590 621 HD2 PHE 101 HD2 PHE 101 -3.473 -8.956 15.463 622 HE1 PHE 101 HE1 PHE 101 0.422 -6.300 17.042 623 HE2 PHE 101 HE2 PHE 101 -1.784 -9.996 16.936 624 HZ PHE 101 HZ PHE 101 0.174 -8.679 17.720 625 H CYS 102 H CYS 102 -4.541 -8.023 12.192 626 HA CYS 102 HA CYS 102 -6.307 -8.235 10.788 627 1HB CYS 102 1HB CYS 102 -6.868 -5.329 11.529 628 2HB CYS 102 2HB CYS 102 -7.962 -6.412 10.657 629 HG CYS 102 HG CYS 102 -8.739 -6.178 13.113 630 H PHE 103 H PHE 103 -4.435 -8.454 9.271 631 HA PHE 103 HA PHE 103 -3.782 -6.499 7.329 632 1HB PHE 103 1HB PHE 103 -2.886 -8.966 7.801 633 2HB PHE 103 2HB PHE 103 -4.073 -9.413 6.584 634 HD1 PHE 103 HD1 PHE 103 -3.920 -7.995 4.305 635 HD2 PHE 103 HD2 PHE 103 -0.700 -8.502 7.129 636 HE1 PHE 103 HE1 PHE 103 -2.274 -7.608 2.501 637 HE2 PHE 103 HE2 PHE 103 0.938 -8.194 5.299 638 HZ PHE 103 HZ PHE 103 0.153 -7.742 2.982 639 H THR 104 H THR 104 -4.886 -5.797 5.454 640 HA THR 104 HA THR 104 -7.729 -5.936 5.467 641 HB THR 104 HB THR 104 -7.229 -4.761 3.168 642 HG1 THR 104 HG1 THR 104 -5.033 -4.125 3.023 643 1HG2 THR 104 1HG2 THR 104 -6.024 -3.632 5.740 644 2HG2 THR 104 2HG2 THR 104 -6.490 -2.695 4.303 645 3HG2 THR 104 3HG2 THR 104 -7.730 -3.523 5.260 646 H GLU 105 H GLU 105 -5.450 -6.901 2.944 647 HA GLU 105 HA GLU 105 -7.282 -8.697 1.640 648 1HB GLU 105 1HB GLU 105 -5.260 -7.404 0.654 649 2HB GLU 105 2HB GLU 105 -4.240 -8.675 1.376 650 1HG GLU 105 1HG GLU 105 -4.638 -9.241 -0.928 651 2HG GLU 105 2HG GLU 105 -5.621 -10.334 0.041 652 H THR 106 H THR 106 -7.222 -11.071 1.635 653 HA THR 106 HA THR 106 -5.504 -12.459 3.509 654 HB THR 106 HB THR 106 -6.717 -11.508 5.238 655 HG1 THR 106 HG1 THR 106 -8.066 -13.951 4.956 656 1HG2 THR 106 1HG2 THR 106 -9.089 -11.455 5.541 657 2HG2 THR 106 2HG2 THR 106 -8.703 -10.634 4.030 658 3HG2 THR 106 3HG2 THR 106 -9.401 -12.265 4.005 659 H THR 107 H THR 107 -8.809 -13.030 2.322 660 HA THR 107 HA THR 107 -8.027 -15.441 0.904 661 HB THR 107 HB THR 107 -7.937 -16.130 3.271 662 HG1 THR 107 HG1 THR 107 -9.230 -17.991 2.836 663 1HG2 THR 107 1HG2 THR 107 -9.889 -14.703 3.975 664 2HG2 THR 107 2HG2 THR 107 -10.948 -15.820 3.096 665 3HG2 THR 107 3HG2 THR 107 -10.012 -16.404 4.493 666 H LEU 108 H LEU 108 -9.610 -16.040 -0.616 667 HA LEU 108 HA LEU 108 -12.295 -14.916 -0.359 668 1HB LEU 108 1HB LEU 108 -10.565 -14.273 -2.787 669 2HB LEU 108 2HB LEU 108 -12.294 -13.995 -2.701 670 HG LEU 108 HG LEU 108 -10.291 -12.604 -0.911 671 1HD1 LEU 108 1HD1 LEU 108 -10.337 -10.758 -2.361 672 2HD1 LEU 108 2HD1 LEU 108 -10.160 -12.128 -3.437 673 3HD1 LEU 108 3HD1 LEU 108 -11.746 -11.366 -3.262 674 1HD2 LEU 108 1HD2 LEU 108 -12.715 -12.822 -0.055 675 2HD2 LEU 108 2HD2 LEU 108 -12.158 -11.182 -0.279 676 3HD2 LEU 108 3HD2 LEU 108 -13.220 -11.927 -1.494 677 H GLU 109 H GLU 109 -13.785 -15.982 -1.488 678 HA GLU 109 HA GLU 109 -13.111 -18.525 -2.758 679 1HB GLU 109 1HB GLU 109 -15.467 -17.328 -1.466 680 2HB GLU 109 2HB GLU 109 -15.887 -18.043 -2.996 681 1HG GLU 109 1HG GLU 109 -14.524 -20.141 -2.170 682 2HG GLU 109 2HG GLU 109 -14.551 -19.347 -0.588 683 HA PRO 110 HA PRO 110 -12.855 -17.418 -6.817 684 1HB PRO 110 1HB PRO 110 -14.215 -19.259 -8.290 685 2HB PRO 110 2HB PRO 110 -12.846 -19.621 -7.208 686 1HG PRO 110 1HG PRO 110 -15.803 -19.852 -6.579 687 2HG PRO 110 2HG PRO 110 -14.562 -21.125 -6.383 688 1HD PRO 110 1HD PRO 110 -15.317 -19.492 -4.344 689 2HD PRO 110 2HD PRO 110 -13.616 -20.009 -4.507 690 H GLY 111 H GLY 111 -13.973 -15.351 -6.392 691 1HA GLY 111 1HA GLY 111 -15.234 -14.482 -8.687 692 2HA GLY 111 2HA GLY 111 -16.585 -14.946 -7.646 693 H GLU 112 H GLU 112 -15.121 -14.235 -5.135 694 HA GLU 112 HA GLU 112 -16.814 -12.010 -5.146 695 1HB GLU 112 1HB GLU 112 -15.939 -12.121 -2.570 696 2HB GLU 112 2HB GLU 112 -17.330 -12.943 -3.257 697 1HG GLU 112 1HG GLU 112 -16.053 -14.949 -3.527 698 2HG GLU 112 2HG GLU 112 -14.541 -14.069 -3.166 699 H GLU 113 H GLU 113 -16.584 -9.937 -4.372 700 HA GLU 113 HA GLU 113 -14.143 -8.523 -5.021 701 1HB GLU 113 1HB GLU 113 -16.910 -7.612 -4.119 702 2HB GLU 113 2HB GLU 113 -15.604 -6.575 -4.690 703 1HG GLU 113 1HG GLU 113 -17.076 -6.826 -6.466 704 2HG GLU 113 2HG GLU 113 -15.672 -7.842 -6.809 705 H MET 114 H MET 114 -12.568 -8.463 -3.461 706 HA MET 114 HA MET 114 -13.243 -7.728 -0.674 707 1HB MET 114 1HB MET 114 -11.445 -9.376 -1.136 708 2HB MET 114 2HB MET 114 -10.613 -8.187 -2.121 709 1HG MET 114 1HG MET 114 -9.529 -7.684 -0.229 710 2HG MET 114 2HG MET 114 -10.933 -6.738 0.207 711 1HE MET 114 1HE MET 114 -12.712 -9.234 2.739 712 2HE MET 114 2HE MET 114 -12.890 -7.722 1.816 713 3HE MET 114 3HE MET 114 -12.983 -9.299 0.988 714 H GLU 115 H GLU 115 -13.318 -5.572 -0.277 715 HA GLU 115 HA GLU 115 -11.336 -3.966 -1.585 716 1HB GLU 115 1HB GLU 115 -12.688 -2.131 -2.316 717 2HB GLU 115 2HB GLU 115 -13.230 -3.651 -3.058 718 1HG GLU 115 1HG GLU 115 -15.161 -3.745 -1.540 719 2HG GLU 115 2HG GLU 115 -14.674 -2.187 -0.832 720 H MET 116 H MET 116 -10.515 -2.369 -0.348 721 HA MET 116 HA MET 116 -11.541 -2.123 2.432 722 1HB MET 116 1HB MET 116 -8.881 -3.263 1.485 723 2HB MET 116 2HB MET 116 -9.096 -2.626 3.122 724 1HG MET 116 1HG MET 116 -10.934 -4.794 2.036 725 2HG MET 116 2HG MET 116 -9.390 -5.159 2.757 726 1HE MET 116 1HE MET 116 -12.191 -6.325 3.743 727 2HE MET 116 2HE MET 116 -10.610 -6.772 4.431 728 3HE MET 116 3HE MET 116 -11.937 -6.261 5.502 729 HA PRO 117 HA PRO 117 -9.724 1.970 1.697 730 1HB PRO 117 1HB PRO 117 -9.832 3.045 4.145 731 2HB PRO 117 2HB PRO 117 -11.278 2.796 3.123 732 1HG PRO 117 1HG PRO 117 -10.294 1.059 5.392 733 2HG PRO 117 2HG PRO 117 -11.946 1.631 4.987 734 1HD PRO 117 1HD PRO 117 -10.952 -0.882 4.312 735 2HD PRO 117 2HD PRO 117 -12.252 -0.047 3.405 736 H VAL 118 H VAL 118 -7.623 2.787 1.903 737 HA VAL 118 HA VAL 118 -5.905 1.792 4.092 738 HB VAL 118 HB VAL 118 -5.072 2.166 1.175 739 1HG1 VAL 118 1HG1 VAL 118 -3.328 3.169 2.520 740 2HG1 VAL 118 2HG1 VAL 118 -3.305 1.754 3.603 741 3HG1 VAL 118 3HG1 VAL 118 -2.797 1.610 1.906 742 1HG2 VAL 118 1HG2 VAL 118 -4.310 -0.154 1.369 743 2HG2 VAL 118 2HG2 VAL 118 -4.949 -0.234 3.026 744 3HG2 VAL 118 3HG2 VAL 118 -6.051 -0.027 1.646 745 H VAL 119 H VAL 119 -4.383 3.438 4.721 746 HA VAL 119 HA VAL 119 -4.880 6.205 3.915 747 HB VAL 119 HB VAL 119 -6.293 6.129 5.791 748 1HG1 VAL 119 1HG1 VAL 119 -5.842 3.922 6.706 749 2HG1 VAL 119 2HG1 VAL 119 -4.243 4.460 7.274 750 3HG1 VAL 119 3HG1 VAL 119 -5.733 5.145 7.969 751 1HG2 VAL 119 1HG2 VAL 119 -3.633 6.912 7.047 752 2HG2 VAL 119 2HG2 VAL 119 -4.527 7.945 5.914 753 3HG2 VAL 119 3HG2 VAL 119 -5.251 7.498 7.469 754 H PHE 120 H PHE 120 -2.936 7.401 4.108 755 HA PHE 120 HA PHE 120 -0.458 5.987 4.855 756 1HB PHE 120 1HB PHE 120 -1.352 5.198 2.560 757 2HB PHE 120 2HB PHE 120 -1.085 6.844 1.998 758 HD1 PHE 120 HD1 PHE 120 0.262 3.592 2.189 759 HD2 PHE 120 HD2 PHE 120 1.458 7.741 2.429 760 HE1 PHE 120 HE1 PHE 120 2.547 2.998 1.468 761 HE2 PHE 120 HE2 PHE 120 3.791 7.063 1.956 762 HZ PHE 120 HZ PHE 120 4.315 4.745 1.338 763 H PHE 121 H PHE 121 0.944 7.686 5.610 764 HA PHE 121 HA PHE 121 1.017 10.117 4.037 765 1HB PHE 121 1HB PHE 121 0.757 11.525 6.092 766 2HB PHE 121 2HB PHE 121 -0.726 10.792 5.510 767 HD1 PHE 121 HD1 PHE 121 1.664 10.957 8.274 768 HD2 PHE 121 HD2 PHE 121 -1.691 8.793 6.692 769 HE1 PHE 121 HE1 PHE 121 1.412 9.811 10.430 770 HE2 PHE 121 HE2 PHE 121 -1.824 7.470 8.803 771 HZ PHE 121 HZ PHE 121 -0.258 7.970 10.673 772 H VAL 122 H VAL 122 3.107 10.746 3.870 773 HA VAL 122 HA VAL 122 5.072 9.030 5.193 774 HB VAL 122 HB VAL 122 5.454 11.456 3.435 775 1HG1 VAL 122 1HG1 VAL 122 7.534 11.008 4.541 776 2HG1 VAL 122 2HG1 VAL 122 7.382 9.263 4.271 777 3HG1 VAL 122 3HG1 VAL 122 7.665 10.363 2.905 778 1HG2 VAL 122 1HG2 VAL 122 5.749 9.687 1.633 779 2HG2 VAL 122 2HG2 VAL 122 5.218 8.491 2.815 780 3HG2 VAL 122 3HG2 VAL 122 4.112 9.765 2.266 781 H ASP 123 H ASP 123 6.634 9.597 6.821 782 HA ASP 123 HA ASP 123 5.765 11.799 8.490 783 1HB ASP 123 1HB ASP 123 6.606 9.569 9.393 784 2HB ASP 123 2HB ASP 123 8.228 10.102 8.922 785 HA PRO 124 HA PRO 124 8.625 14.680 6.538 786 1HB PRO 124 1HB PRO 124 8.704 16.486 8.773 787 2HB PRO 124 2HB PRO 124 7.806 16.614 7.248 788 1HG PRO 124 1HG PRO 124 6.852 15.858 9.918 789 2HG PRO 124 2HG PRO 124 5.857 16.294 8.500 790 1HD PRO 124 1HD PRO 124 6.224 13.722 9.598 791 2HD PRO 124 2HD PRO 124 5.512 14.089 8.005 792 H GLU 125 H GLU 125 9.302 13.031 9.656 793 HA GLU 125 HA GLU 125 11.900 13.882 10.079 794 1HB GLU 125 1HB GLU 125 10.513 12.564 11.603 795 2HB GLU 125 2HB GLU 125 10.541 11.177 10.507 796 1HG GLU 125 1HG GLU 125 12.690 10.639 11.014 797 2HG GLU 125 2HG GLU 125 13.163 12.313 11.271 798 H ILE 126 H ILE 126 10.585 11.973 7.399 799 HA ILE 126 HA ILE 126 12.932 10.746 6.503 800 HB ILE 126 HB ILE 126 10.643 10.582 5.542 801 1HG1 ILE 126 1HG1 ILE 126 12.760 11.142 3.418 802 2HG1 ILE 126 2HG1 ILE 126 12.816 9.713 4.444 803 1HG2 ILE 126 1HG2 ILE 126 10.337 13.131 5.250 804 2HG2 ILE 126 2HG2 ILE 126 11.374 12.962 3.810 805 3HG2 ILE 126 3HG2 ILE 126 9.828 12.110 3.902 806 1HD1 ILE 126 1HD1 ILE 126 10.541 10.422 2.574 807 2HD1 ILE 126 2HD1 ILE 126 11.680 9.073 2.450 808 3HD1 ILE 126 3HD1 ILE 126 10.523 9.116 3.789 809 H VAL 127 H VAL 127 12.065 14.259 6.290 810 HA VAL 127 HA VAL 127 14.598 14.741 4.796 811 HB VAL 127 HB VAL 127 13.885 17.105 4.766 812 1HG1 VAL 127 1HG1 VAL 127 13.584 15.585 2.854 813 2HG1 VAL 127 2HG1 VAL 127 11.976 15.135 3.461 814 3HG1 VAL 127 3HG1 VAL 127 12.297 16.800 2.949 815 1HG2 VAL 127 1HG2 VAL 127 12.197 16.985 6.675 816 2HG2 VAL 127 2HG2 VAL 127 11.635 17.772 5.192 817 3HG2 VAL 127 3HG2 VAL 127 11.118 16.123 5.546 818 H LYS 128 H LYS 128 15.318 13.591 6.954 819 HA LYS 128 HA LYS 128 16.706 15.828 8.364 820 1HB LYS 128 1HB LYS 128 15.573 13.377 9.713 821 2HB LYS 128 2HB LYS 128 16.885 14.360 10.389 822 1HG LYS 128 1HG LYS 128 15.303 16.348 10.247 823 2HG LYS 128 2HG LYS 128 14.044 15.205 9.729 824 1HD LYS 128 1HD LYS 128 14.610 13.824 11.809 825 2HD LYS 128 2HD LYS 128 15.638 15.151 12.346 826 1HE LYS 128 1HE LYS 128 13.728 16.644 12.545 827 2HE LYS 128 2HE LYS 128 12.661 15.483 11.733 828 1HZ LYS 128 1HZ LYS 128 12.863 13.995 13.554 829 2HZ LYS 128 2HZ LYS 128 13.961 14.931 14.318 830 3HZ LYS 128 3HZ LYS 128 12.421 15.454 14.149 831 HA PRO 129 HA PRO 129 20.002 12.664 8.501 832 1HB PRO 129 1HB PRO 129 19.826 10.011 7.913 833 2HB PRO 129 2HB PRO 129 19.141 10.695 9.414 834 1HG PRO 129 1HG PRO 129 17.666 10.250 6.783 835 2HG PRO 129 2HG PRO 129 17.240 9.618 8.393 836 1HD PRO 129 1HD PRO 129 16.091 11.853 7.558 837 2HD PRO 129 2HD PRO 129 16.744 11.725 9.222 838 H VAL 130 H VAL 130 21.754 11.974 7.237 839 HA VAL 130 HA VAL 130 21.953 12.780 4.578 840 HB VAL 130 HB VAL 130 23.626 10.832 6.212 841 1HG1 VAL 130 1HG1 VAL 130 24.168 10.578 3.844 842 2HG1 VAL 130 2HG1 VAL 130 24.258 12.345 3.648 843 3HG1 VAL 130 3HG1 VAL 130 25.453 11.487 4.648 844 1HG2 VAL 130 1HG2 VAL 130 25.073 12.830 6.571 845 2HG2 VAL 130 2HG2 VAL 130 23.890 13.838 5.716 846 3HG2 VAL 130 3HG2 VAL 130 23.471 13.080 7.265 847 H GLU 131 H GLU 131 21.077 9.678 5.982 848 HA GLU 131 HA GLU 131 21.107 7.776 4.004 849 1HB GLU 131 1HB GLU 131 18.773 8.548 5.804 850 2HB GLU 131 2HB GLU 131 18.961 6.982 5.023 851 1HG GLU 131 1HG GLU 131 20.839 6.418 6.417 852 2HG GLU 131 2HG GLU 131 20.935 8.039 7.107 853 H THR 132 H THR 132 18.588 10.294 4.355 854 HA THR 132 HA THR 132 17.366 9.291 1.864 855 HB THR 132 HB THR 132 15.370 10.554 2.972 856 HG1 THR 132 HG1 THR 132 15.764 11.291 5.032 857 1HG2 THR 132 1HG2 THR 132 16.692 8.341 4.602 858 2HG2 THR 132 2HG2 THR 132 15.012 8.875 4.716 859 3HG2 THR 132 3HG2 THR 132 15.595 8.117 3.224 860 H GLN 133 H GLN 133 17.963 12.283 3.637 861 HA GLN 133 HA GLN 133 17.948 14.472 2.920 862 1HB GLN 133 1HB GLN 133 20.267 13.143 3.184 863 2HB GLN 133 2HB GLN 133 20.459 13.539 1.507 864 1HG GLN 133 1HG GLN 133 21.538 15.238 2.810 865 2HG GLN 133 2HG GLN 133 20.113 15.965 2.054 866 1HE2 GLN 133 1HE2 GLN 133 19.371 13.885 4.794 867 2HE2 GLN 133 2HE2 GLN 133 19.220 15.144 5.977 868 H GLY 134 H GLY 134 16.071 13.807 1.230 869 1HA GLY 134 1HA GLY 134 15.719 15.414 -0.817 870 2HA GLY 134 2HA GLY 134 16.960 14.392 -1.565 871 H ILE 135 H ILE 135 16.201 11.924 -0.271 872 HA ILE 135 HA ILE 135 14.149 10.883 -1.916 873 HB ILE 135 HB ILE 135 15.263 10.052 0.766 874 1HG1 ILE 135 1HG1 ILE 135 16.769 9.798 -1.204 875 2HG1 ILE 135 2HG1 ILE 135 16.242 8.232 -0.580 876 1HG2 ILE 135 1HG2 ILE 135 14.106 7.798 0.267 877 2HG2 ILE 135 2HG2 ILE 135 13.174 9.114 0.964 878 3HG2 ILE 135 3HG2 ILE 135 12.999 8.749 -0.752 879 1HD1 ILE 135 1HD1 ILE 135 14.420 8.219 -2.319 880 2HD1 ILE 135 2HD1 ILE 135 15.233 9.606 -3.081 881 3HD1 ILE 135 3HD1 ILE 135 16.088 8.058 -2.909 882 H LYS 136 H LYS 136 12.180 11.510 -2.116 883 HA LYS 136 HA LYS 136 10.445 11.246 0.173 884 1HB LYS 136 1HB LYS 136 9.399 13.397 0.004 885 2HB LYS 136 2HB LYS 136 11.026 13.472 0.638 886 1HG LYS 136 1HG LYS 136 11.907 14.506 -1.220 887 2HG LYS 136 2HG LYS 136 10.680 13.883 -2.326 888 1HD LYS 136 1HD LYS 136 8.906 15.159 -1.169 889 2HD LYS 136 2HD LYS 136 10.067 15.744 0.032 890 1HE LYS 136 1HE LYS 136 11.181 17.099 -1.745 891 2HE LYS 136 2HE LYS 136 9.979 16.522 -2.922 892 1HZ LYS 136 1HZ LYS 136 9.331 18.691 -1.934 893 2HZ LYS 136 2HZ LYS 136 8.252 17.538 -1.493 894 3HZ LYS 136 3HZ LYS 136 9.370 18.044 -0.452 895 H THR 137 H THR 137 10.350 9.452 -1.570 896 HA THR 137 HA THR 137 7.696 9.863 -2.499 897 HB THR 137 HB THR 137 9.492 8.439 -4.490 898 HG1 THR 137 HG1 THR 137 9.384 10.333 -5.745 899 1HG2 THR 137 1HG2 THR 137 7.563 8.772 -5.961 900 2HG2 THR 137 2HG2 THR 137 7.146 7.870 -4.491 901 3HG2 THR 137 3HG2 THR 137 6.697 9.578 -4.634 902 H LEU 138 H LEU 138 7.008 8.559 -0.867 903 HA LEU 138 HA LEU 138 8.661 6.266 -0.162 904 1HB LEU 138 1HB LEU 138 6.921 7.889 1.175 905 2HB LEU 138 2HB LEU 138 6.019 6.363 1.127 906 HG LEU 138 HG LEU 138 8.267 5.340 1.858 907 1HD1 LEU 138 1HD1 LEU 138 8.801 8.223 2.599 908 2HD1 LEU 138 2HD1 LEU 138 9.701 6.816 3.210 909 3HD1 LEU 138 3HD1 LEU 138 9.769 7.231 1.491 910 1HD2 LEU 138 1HD2 LEU 138 6.404 5.411 3.411 911 2HD2 LEU 138 2HD2 LEU 138 7.866 5.915 4.278 912 3HD2 LEU 138 3HD2 LEU 138 6.678 7.111 3.808 913 H THR 139 H THR 139 8.663 5.280 -2.207 914 HA THR 139 HA THR 139 6.248 4.597 -3.438 915 HB THR 139 HB THR 139 8.932 4.641 -4.251 916 HG1 THR 139 HG1 THR 139 6.506 3.937 -5.512 917 1HG2 THR 139 1HG2 THR 139 9.249 2.620 -5.568 918 2HG2 THR 139 2HG2 THR 139 9.228 2.195 -3.856 919 3HG2 THR 139 3HG2 THR 139 7.805 1.871 -4.872 920 H LEU 140 H LEU 140 4.896 2.895 -3.224 921 HA LEU 140 HA LEU 140 5.773 0.760 -1.339 922 1HB LEU 140 1HB LEU 140 3.764 2.052 -0.699 923 2HB LEU 140 2HB LEU 140 2.935 1.545 -2.167 924 HG LEU 140 HG LEU 140 4.073 -0.592 -0.361 925 1HD1 LEU 140 1HD1 LEU 140 2.931 0.832 1.246 926 2HD1 LEU 140 2HD1 LEU 140 1.504 0.957 0.188 927 3HD1 LEU 140 3HD1 LEU 140 1.935 -0.591 0.947 928 1HD2 LEU 140 1HD2 LEU 140 2.966 -1.292 -2.461 929 2HD2 LEU 140 2HD2 LEU 140 2.056 -1.811 -1.051 930 3HD2 LEU 140 3HD2 LEU 140 1.500 -0.410 -1.994 931 H SER 141 H SER 141 6.712 -0.768 -2.567 932 HA SER 141 HA SER 141 5.565 -1.625 -5.179 933 1HB SER 141 1HB SER 141 7.967 -1.449 -5.086 934 2HB SER 141 2HB SER 141 8.040 -2.476 -3.648 935 HG SER 141 HG SER 141 7.245 -4.194 -4.922 936 H TYR 142 H TYR 142 3.657 -2.639 -4.760 937 HA TYR 142 HA TYR 142 3.482 -4.639 -2.562 938 1HB TYR 142 1HB TYR 142 1.585 -2.865 -3.610 939 2HB TYR 142 2HB TYR 142 1.173 -4.384 -4.380 940 HD1 TYR 142 HD1 TYR 142 1.731 -6.393 -2.215 941 HD2 TYR 142 HD2 TYR 142 -0.194 -2.535 -2.093 942 HE1 TYR 142 HE1 TYR 142 0.747 -6.949 -0.022 943 HE2 TYR 142 HE2 TYR 142 -1.290 -3.158 0.029 944 HH TYR 142 HH TYR 142 -1.457 -4.748 1.713 945 H THR 143 H THR 143 3.588 -6.843 -3.075 946 HA THR 143 HA THR 143 3.614 -7.600 -5.972 947 HB THR 143 HB THR 143 5.316 -8.966 -3.864 948 HG1 THR 143 HG1 THR 143 5.870 -6.736 -3.931 949 1HG2 THR 143 1HG2 THR 143 6.631 -9.610 -5.831 950 2HG2 THR 143 2HG2 THR 143 4.928 -10.026 -6.127 951 3HG2 THR 143 3HG2 THR 143 5.637 -8.585 -6.882 952 H PHE 144 H PHE 144 1.436 -8.053 -5.882 953 HA PHE 144 HA PHE 144 0.365 -10.066 -4.039 954 1HB PHE 144 1HB PHE 144 -0.630 -8.461 -6.369 955 2HB PHE 144 2HB PHE 144 -1.361 -10.014 -6.098 956 HD1 PHE 144 HD1 PHE 144 -0.169 -7.487 -3.567 957 HD2 PHE 144 HD2 PHE 144 -3.535 -9.398 -5.466 958 HE1 PHE 144 HE1 PHE 144 -1.715 -6.485 -1.892 959 HE2 PHE 144 HE2 PHE 144 -5.042 -8.458 -3.729 960 HZ PHE 144 HZ PHE 144 -4.138 -7.002 -1.963 961 H TYR 145 H TYR 145 1.911 -11.782 -4.200 962 HA TYR 145 HA TYR 145 1.226 -13.630 -6.394 963 1HB TYR 145 1HB TYR 145 3.382 -13.931 -7.236 964 2HB TYR 145 2HB TYR 145 3.054 -12.203 -7.254 965 HD1 TYR 145 HD1 TYR 145 5.690 -13.159 -7.772 966 HD2 TYR 145 HD2 TYR 145 3.873 -12.357 -3.933 967 HE1 TYR 145 HE1 TYR 145 7.925 -12.786 -6.768 968 HE2 TYR 145 HE2 TYR 145 6.079 -11.968 -2.965 969 HH TYR 145 HH TYR 145 8.363 -11.964 -3.321 970 HA PRO 146 HA PRO 146 2.427 -15.945 -2.516 971 1HB PRO 146 1HB PRO 146 0.050 -16.712 -1.412 972 2HB PRO 146 2HB PRO 146 0.874 -15.171 -1.073 973 1HG PRO 146 1HG PRO 146 -1.416 -15.621 -3.002 974 2HG PRO 146 2HG PRO 146 -1.170 -14.339 -1.796 975 1HD PRO 146 1HD PRO 146 -0.547 -14.074 -4.486 976 2HD PRO 146 2HD PRO 146 0.328 -13.182 -3.201 977 H ARG 147 H ARG 147 -0.736 -17.373 -3.540 978 HA ARG 147 HA ARG 147 0.672 -19.448 -5.105 979 1HB ARG 147 1HB ARG 147 -0.844 -20.116 -2.549 980 2HB ARG 147 2HB ARG 147 -0.286 -21.272 -3.765 981 1HG ARG 147 1HG ARG 147 2.091 -20.406 -3.319 982 2HG ARG 147 2HG ARG 147 1.425 -19.610 -1.882 983 1HD ARG 147 1HD ARG 147 1.398 -22.573 -2.580 984 2HD ARG 147 2HD ARG 147 2.353 -21.799 -1.294 985 HE ARG 147 HE ARG 147 -0.256 -21.141 -0.673 986 1HH1 ARG 147 1HH1 ARG 147 1.523 -24.148 -1.101 987 2HH1 ARG 147 2HH1 ARG 147 0.466 -25.119 -0.127 988 1HH2 ARG 147 1HH2 ARG 147 -1.699 -22.391 0.644 989 2HH2 ARG 147 2HH2 ARG 147 -1.402 -24.077 0.912 990 H GLU 148 H GLU 148 -0.595 -20.017 -6.765 991 HA GLU 148 HA GLU 148 -3.505 -19.427 -6.680 992 1HB GLU 148 1HB GLU 148 -2.095 -18.239 -8.313 993 2HB GLU 148 2HB GLU 148 -1.609 -19.789 -9.024 994 1HG GLU 148 1HG GLU 148 -4.321 -20.039 -9.195 995 2HG GLU 148 2HG GLU 148 -4.174 -18.279 -9.217 996 HA PRO 149 HA PRO 149 -3.732 -23.981 -7.100 997 1HB PRO 149 1HB PRO 149 -6.442 -24.266 -7.471 998 2HB PRO 149 2HB PRO 149 -5.667 -23.979 -5.893 999 1HG PRO 149 1HG PRO 149 -7.052 -21.945 -7.645 1000 2HG PRO 149 2HG PRO 149 -7.126 -22.131 -5.882 1001 1HD PRO 149 1HD PRO 149 -5.515 -20.305 -7.149 1002 2HD PRO 149 2HD PRO 149 -5.081 -21.060 -5.581 1003 H SER 150 H SER 150 -6.052 -22.292 -9.266 1004 HA SER 150 HA SER 150 -4.721 -22.669 -11.733 1005 1HB SER 150 1HB SER 150 -6.713 -24.838 -10.957 1006 2HB SER 150 2HB SER 150 -6.453 -24.373 -12.642 1007 HG SER 150 HG SER 150 -4.272 -25.066 -11.008 1008 H LYS 151 H LYS 151 -5.484 -20.504 -11.900 1009 HA LYS 151 HA LYS 151 -8.394 -20.012 -11.909 1010 1HB LYS 151 1HB LYS 151 -7.816 -17.714 -12.567 1011 2HB LYS 151 2HB LYS 151 -7.055 -18.259 -11.071 1012 1HG LYS 151 1HG LYS 151 -5.104 -17.686 -11.839 1013 2HG LYS 151 2HG LYS 151 -5.185 -18.901 -13.114 1014 1HD LYS 151 1HD LYS 151 -6.411 -17.177 -14.531 1015 2HD LYS 151 2HD LYS 151 -5.974 -15.976 -13.300 1016 1HE LYS 151 1HE LYS 151 -4.123 -17.726 -15.000 1017 2HE LYS 151 2HE LYS 151 -4.263 -15.962 -15.054 1018 1HZ LYS 151 1HZ LYS 151 -2.305 -16.657 -13.848 1019 2HZ LYS 151 2HZ LYS 151 -3.341 -15.942 -12.784 1020 3HZ LYS 151 3HZ LYS 151 -3.157 -17.558 -12.791 Start of MODEL 2 1 H VAL 21 H VAL 21 -1.207 9.438 13.454 2 HA VAL 21 HA VAL 21 -2.925 7.427 14.638 3 HB VAL 21 HB VAL 21 -2.368 9.110 16.486 4 1HG1 VAL 21 1HG1 VAL 21 -2.476 11.186 15.159 5 2HG1 VAL 21 2HG1 VAL 21 -4.224 10.971 14.946 6 3HG1 VAL 21 3HG1 VAL 21 -3.547 11.221 16.563 7 1HG2 VAL 21 1HG2 VAL 21 -4.478 9.040 17.489 8 2HG2 VAL 21 2HG2 VAL 21 -5.343 8.918 15.961 9 3HG2 VAL 21 3HG2 VAL 21 -4.335 7.564 16.526 10 H GLU 22 H GLU 22 -5.372 8.700 14.099 11 HA GLU 22 HA GLU 22 -5.244 9.087 11.218 12 1HB GLU 22 1HB GLU 22 -7.086 7.883 12.481 13 2HB GLU 22 2HB GLU 22 -7.660 9.471 13.015 14 1HG GLU 22 1HG GLU 22 -7.993 10.140 10.662 15 2HG GLU 22 2HG GLU 22 -7.253 8.628 10.102 16 H GLN 23 H GLN 23 -3.570 10.794 11.915 17 HA GLN 23 HA GLN 23 -3.773 12.972 10.703 18 1HB GLN 23 1HB GLN 23 -5.122 13.525 13.357 19 2HB GLN 23 2HB GLN 23 -4.027 14.756 12.768 20 1HG GLN 23 1HG GLN 23 -6.251 13.721 10.966 21 2HG GLN 23 2HG GLN 23 -6.477 15.025 12.134 22 1HE2 GLN 23 1HE2 GLN 23 -4.571 14.039 9.247 23 2HE2 GLN 23 2HE2 GLN 23 -4.107 15.682 8.821 24 H ALA 24 H ALA 24 -2.072 14.668 11.380 25 HA ALA 24 HA ALA 24 0.024 13.474 13.124 26 1HB ALA 24 1HB ALA 24 1.671 13.517 11.350 27 2HB ALA 24 2HB ALA 24 0.260 12.613 10.758 28 3HB ALA 24 3HB ALA 24 0.508 14.285 10.253 29 H SER 25 H SER 25 -1.791 16.022 12.809 30 HA SER 25 HA SER 25 -0.310 18.169 12.053 31 1HB SER 25 1HB SER 25 -2.793 18.400 13.735 32 2HB SER 25 2HB SER 25 -2.378 19.193 12.201 33 HG SER 25 HG SER 25 -3.894 17.522 11.765 34 H ASP 26 H ASP 26 0.748 16.773 14.568 35 HA ASP 26 HA ASP 26 1.348 19.190 16.200 36 1HB ASP 26 1HB ASP 26 1.472 17.161 17.454 37 2HB ASP 26 2HB ASP 26 2.298 16.293 16.158 38 H LEU 27 H LEU 27 2.439 17.081 13.548 39 HA LEU 27 HA LEU 27 4.660 18.852 12.825 40 1HB LEU 27 1HB LEU 27 3.821 16.164 11.653 41 2HB LEU 27 2HB LEU 27 5.313 17.078 11.395 42 HG LEU 27 HG LEU 27 5.375 16.899 14.120 43 1HD1 LEU 27 1HD1 LEU 27 3.308 15.480 14.311 44 2HD1 LEU 27 2HD1 LEU 27 4.020 14.307 13.197 45 3HD1 LEU 27 3HD1 LEU 27 4.745 14.593 14.791 46 1HD2 LEU 27 1HD2 LEU 27 7.140 16.179 12.527 47 2HD2 LEU 27 2HD2 LEU 27 6.931 15.089 13.910 48 3HD2 LEU 27 3HD2 LEU 27 6.254 14.631 12.338 49 H ILE 28 H ILE 28 2.804 17.212 10.323 50 HA ILE 28 HA ILE 28 2.487 18.139 8.258 51 HB ILE 28 HB ILE 28 0.152 19.245 9.823 52 1HG1 ILE 28 1HG1 ILE 28 0.885 16.496 8.692 53 2HG1 ILE 28 2HG1 ILE 28 0.627 16.928 10.371 54 1HG2 ILE 28 1HG2 ILE 28 -1.075 18.903 7.766 55 2HG2 ILE 28 2HG2 ILE 28 0.319 19.886 7.326 56 3HG2 ILE 28 3HG2 ILE 28 0.332 18.138 6.995 57 1HD1 ILE 28 1HD1 ILE 28 -1.294 15.768 9.718 58 2HD1 ILE 28 2HD1 ILE 28 -1.733 17.484 9.892 59 3HD1 ILE 28 3HD1 ILE 28 -1.520 16.769 8.275 60 H LEU 29 H LEU 29 4.393 19.382 8.219 61 HA LEU 29 HA LEU 29 4.239 22.271 8.561 62 1HB LEU 29 1HB LEU 29 6.389 20.514 7.321 63 2HB LEU 29 2HB LEU 29 6.519 22.220 7.745 64 HG LEU 29 HG LEU 29 7.575 21.150 9.470 65 1HD1 LEU 29 1HD1 LEU 29 6.332 21.616 11.479 66 2HD1 LEU 29 2HD1 LEU 29 5.929 22.828 10.242 67 3HD1 LEU 29 3HD1 LEU 29 4.791 21.509 10.624 68 1HD2 LEU 29 1HD2 LEU 29 6.812 18.801 9.054 69 2HD2 LEU 29 2HD2 LEU 29 6.900 19.246 10.764 70 3HD2 LEU 29 3HD2 LEU 29 5.338 19.139 9.981 71 H ASP 30 H ASP 30 4.635 23.784 6.765 72 HA ASP 30 HA ASP 30 2.856 23.091 4.574 73 1HB ASP 30 1HB ASP 30 2.790 25.217 5.826 74 2HB ASP 30 2HB ASP 30 4.257 25.729 4.947 75 H GLU 31 H GLU 31 4.184 21.489 3.860 76 HA GLU 31 HA GLU 31 5.738 22.387 1.498 77 1HB GLU 31 1HB GLU 31 6.844 20.827 3.746 78 2HB GLU 31 2HB GLU 31 6.931 19.907 2.240 79 1HG GLU 31 1HG GLU 31 7.921 22.749 2.413 80 2HG GLU 31 2HG GLU 31 8.915 21.339 2.798 81 H LYS 32 H LYS 32 5.974 20.082 0.148 82 HA LYS 32 HA LYS 32 3.512 18.435 0.467 83 1HB LYS 32 1HB LYS 32 4.227 20.161 -1.873 84 2HB LYS 32 2HB LYS 32 3.630 18.547 -2.256 85 1HG LYS 32 1HG LYS 32 2.111 20.179 -0.227 86 2HG LYS 32 2HG LYS 32 1.980 20.600 -1.926 87 1HD LYS 32 1HD LYS 32 0.961 18.661 -2.538 88 2HD LYS 32 2HD LYS 32 1.672 17.679 -1.259 89 1HE LYS 32 1HE LYS 32 0.128 18.635 0.399 90 2HE LYS 32 2HE LYS 32 -0.557 19.720 -0.828 91 1HZ LYS 32 1HZ LYS 32 -1.952 17.801 -0.459 92 2HZ LYS 32 2HZ LYS 32 -1.279 17.693 -1.991 93 3HZ LYS 32 3HZ LYS 32 -0.772 16.749 -0.798 94 H ILE 33 H ILE 33 3.777 16.326 0.099 95 HA ILE 33 HA ILE 33 6.442 15.328 -0.805 96 HB ILE 33 HB ILE 33 5.942 15.454 1.682 97 1HG1 ILE 33 1HG1 ILE 33 6.936 13.188 2.007 98 2HG1 ILE 33 2HG1 ILE 33 6.926 12.975 0.249 99 1HG2 ILE 33 1HG2 ILE 33 4.561 12.824 1.270 100 2HG2 ILE 33 2HG2 ILE 33 4.678 13.840 2.728 101 3HG2 ILE 33 3HG2 ILE 33 3.636 14.333 1.400 102 1HD1 ILE 33 1HD1 ILE 33 8.364 15.040 0.090 103 2HD1 ILE 33 2HD1 ILE 33 8.297 15.200 1.857 104 3HD1 ILE 33 3HD1 ILE 33 9.096 13.793 1.132 105 H LYS 34 H LYS 34 6.292 14.222 -2.613 106 HA LYS 34 HA LYS 34 3.649 13.448 -3.647 107 1HB LYS 34 1HB LYS 34 5.668 14.706 -4.798 108 2HB LYS 34 2HB LYS 34 6.337 13.089 -5.023 109 1HG LYS 34 1HG LYS 34 3.541 13.944 -5.940 110 2HG LYS 34 2HG LYS 34 5.021 14.210 -6.866 111 1HD LYS 34 1HD LYS 34 5.411 11.630 -6.624 112 2HD LYS 34 2HD LYS 34 3.706 11.560 -6.176 113 1HE LYS 34 1HE LYS 34 2.959 12.164 -8.293 114 2HE LYS 34 2HE LYS 34 4.360 13.161 -8.663 115 1HZ LYS 34 1HZ LYS 34 3.925 10.618 -9.519 116 2HZ LYS 34 2HZ LYS 34 5.321 11.491 -9.695 117 3HZ LYS 34 3HZ LYS 34 5.088 10.430 -8.445 118 H VAL 35 H VAL 35 3.182 11.173 -4.080 119 HA VAL 35 HA VAL 35 5.204 9.190 -3.107 120 HB VAL 35 HB VAL 35 2.412 9.791 -2.103 121 1HG1 VAL 35 1HG1 VAL 35 2.086 7.540 -2.037 122 2HG1 VAL 35 2HG1 VAL 35 3.804 7.168 -2.246 123 3HG1 VAL 35 3HG1 VAL 35 3.184 7.574 -0.650 124 1HG2 VAL 35 1HG2 VAL 35 4.123 10.978 -0.870 125 2HG2 VAL 35 2HG2 VAL 35 3.499 9.677 0.119 126 3HG2 VAL 35 3HG2 VAL 35 5.070 9.479 -0.680 127 H THR 36 H THR 36 5.452 8.592 -5.279 128 HA THR 36 HA THR 36 3.288 7.509 -6.903 129 HB THR 36 HB THR 36 6.324 7.441 -6.961 130 HG1 THR 36 HG1 THR 36 4.372 8.691 -8.556 131 1HG2 THR 36 1HG2 THR 36 6.168 6.698 -9.283 132 2HG2 THR 36 2HG2 THR 36 5.612 5.449 -8.164 133 3HG2 THR 36 3HG2 THR 36 4.418 6.401 -9.087 134 H PHE 37 H PHE 37 2.228 5.828 -6.175 135 HA PHE 37 HA PHE 37 3.455 3.636 -4.561 136 1HB PHE 37 1HB PHE 37 0.670 4.486 -5.435 137 2HB PHE 37 2HB PHE 37 0.968 2.806 -5.094 138 HD1 PHE 37 HD1 PHE 37 -0.946 3.136 -3.552 139 HD2 PHE 37 HD2 PHE 37 2.906 4.974 -2.869 140 HE1 PHE 37 HE1 PHE 37 -1.654 3.819 -1.305 141 HE2 PHE 37 HE2 PHE 37 2.226 5.504 -0.563 142 HZ PHE 37 HZ PHE 37 -0.180 5.348 -0.004 143 H ASP 38 H ASP 38 3.291 1.358 -5.329 144 HA ASP 38 HA ASP 38 2.811 1.061 -8.220 145 1HB ASP 38 1HB ASP 38 5.221 1.714 -7.870 146 2HB ASP 38 2HB ASP 38 5.454 0.287 -6.899 147 H ALA 39 H ALA 39 0.949 -0.005 -7.776 148 HA ALA 39 HA ALA 39 1.060 -2.516 -6.240 149 1HB ALA 39 1HB ALA 39 -1.183 -1.190 -7.798 150 2HB ALA 39 2HB ALA 39 -1.353 -2.577 -6.711 151 3HB ALA 39 3HB ALA 39 -0.875 -0.996 -6.059 152 H ASN 40 H ASN 40 1.531 -4.477 -7.186 153 HA ASN 40 HA ASN 40 1.034 -4.867 -10.109 154 1HB ASN 40 1HB ASN 40 3.309 -6.098 -8.496 155 2HB ASN 40 2HB ASN 40 3.050 -6.151 -10.237 156 1HD2 ASN 40 1HD2 ASN 40 3.809 -3.975 -7.482 157 2HD2 ASN 40 2HD2 ASN 40 4.653 -2.771 -8.464 158 H VAL 41 H VAL 41 0.414 -7.026 -10.682 159 HA VAL 41 HA VAL 41 0.002 -8.992 -8.568 160 HB VAL 41 HB VAL 41 -2.145 -7.909 -8.550 161 1HG1 VAL 41 1HG1 VAL 41 -2.212 -8.160 -11.585 162 2HG1 VAL 41 2HG1 VAL 41 -3.555 -7.625 -10.558 163 3HG1 VAL 41 3HG1 VAL 41 -2.086 -6.649 -10.655 164 1HG2 VAL 41 1HG2 VAL 41 -2.512 -10.351 -10.318 165 2HG2 VAL 41 2HG2 VAL 41 -2.142 -10.420 -8.585 166 3HG2 VAL 41 3HG2 VAL 41 -3.647 -9.673 -9.141 167 H ALA 42 H ALA 42 0.049 -11.113 -9.295 168 HA ALA 42 HA ALA 42 0.493 -11.613 -12.170 169 1HB ALA 42 1HB ALA 42 2.686 -12.662 -11.708 170 2HB ALA 42 2HB ALA 42 2.721 -10.958 -11.219 171 3HB ALA 42 3HB ALA 42 2.538 -12.232 -9.992 172 H ALA 43 H ALA 43 1.002 -14.031 -12.400 173 HA ALA 43 HA ALA 43 -0.990 -15.726 -11.340 174 1HB ALA 43 1HB ALA 43 1.812 -16.398 -12.329 175 2HB ALA 43 2HB ALA 43 0.493 -17.558 -12.066 176 3HB ALA 43 3HB ALA 43 0.335 -16.308 -13.323 177 H GLY 44 H GLY 44 -1.276 -16.236 -9.275 178 1HA GLY 44 1HA GLY 44 0.086 -17.313 -7.273 179 2HA GLY 44 2HA GLY 44 0.878 -15.740 -7.325 180 H LEU 45 H LEU 45 -1.423 -14.205 -8.240 181 HA LEU 45 HA LEU 45 -3.534 -14.688 -6.201 182 1HB LEU 45 1HB LEU 45 -1.582 -12.567 -6.145 183 2HB LEU 45 2HB LEU 45 -3.175 -11.876 -6.330 184 HG LEU 45 HG LEU 45 -2.837 -14.010 -4.155 185 1HD1 LEU 45 1HD1 LEU 45 -2.611 -11.057 -3.527 186 2HD1 LEU 45 2HD1 LEU 45 -1.949 -12.404 -2.654 187 3HD1 LEU 45 3HD1 LEU 45 -1.138 -11.824 -4.104 188 1HD2 LEU 45 1HD2 LEU 45 -4.588 -11.607 -4.520 189 2HD2 LEU 45 2HD2 LEU 45 -5.011 -13.315 -4.846 190 3HD2 LEU 45 3HD2 LEU 45 -4.600 -12.799 -3.190 191 HA PRO 46 HA PRO 46 -5.338 -13.869 -10.371 192 1HB PRO 46 1HB PRO 46 -7.312 -15.694 -10.344 193 2HB PRO 46 2HB PRO 46 -5.608 -16.204 -10.443 194 1HG PRO 46 1HG PRO 46 -7.333 -16.054 -7.976 195 2HG PRO 46 2HG PRO 46 -6.348 -17.444 -8.522 196 1HD PRO 46 1HD PRO 46 -5.538 -15.540 -6.675 197 2HD PRO 46 2HD PRO 46 -4.368 -16.397 -7.713 198 H TRP 47 H TRP 47 -5.630 -11.924 -8.500 199 HA TRP 47 HA TRP 47 -8.534 -11.687 -7.801 200 1HB TRP 47 1HB TRP 47 -6.055 -10.952 -6.258 201 2HB TRP 47 2HB TRP 47 -7.630 -10.267 -5.903 202 HD1 TRP 47 HD1 TRP 47 -8.012 -13.875 -6.787 203 HE1 TRP 47 HE1 TRP 47 -8.367 -15.286 -4.722 204 HE3 TRP 47 HE3 TRP 47 -6.631 -10.518 -3.155 205 HZ2 TRP 47 HZ2 TRP 47 -7.984 -15.152 -1.951 206 HZ3 TRP 47 HZ3 TRP 47 -6.177 -11.468 -0.914 207 HH2 TRP 47 HH2 TRP 47 -7.066 -13.616 -0.209 208 H GLU 48 H GLU 48 -9.473 -9.685 -7.954 209 HA GLU 48 HA GLU 48 -8.414 -7.810 -9.944 210 1HB GLU 48 1HB GLU 48 -10.889 -8.455 -9.643 211 2HB GLU 48 2HB GLU 48 -10.842 -7.527 -8.145 212 1HG GLU 48 1HG GLU 48 -10.027 -5.554 -9.613 213 2HG GLU 48 2HG GLU 48 -10.573 -6.525 -10.990 214 H PHE 49 H PHE 49 -6.514 -7.222 -8.950 215 HA PHE 49 HA PHE 49 -6.606 -5.575 -6.462 216 1HB PHE 49 1HB PHE 49 -5.153 -7.548 -6.354 217 2HB PHE 49 2HB PHE 49 -4.328 -7.054 -7.827 218 HD1 PHE 49 HD1 PHE 49 -2.255 -5.883 -7.566 219 HD2 PHE 49 HD2 PHE 49 -5.177 -5.747 -4.407 220 HE1 PHE 49 HE1 PHE 49 -0.542 -5.038 -6.001 221 HE2 PHE 49 HE2 PHE 49 -3.508 -4.725 -2.901 222 HZ PHE 49 HZ PHE 49 -1.176 -4.438 -3.664 223 H VAL 50 H VAL 50 -6.506 -3.404 -6.887 224 HA VAL 50 HA VAL 50 -5.028 -2.487 -9.267 225 HB VAL 50 HB VAL 50 -6.802 -1.076 -10.035 226 1HG1 VAL 50 1HG1 VAL 50 -8.075 -3.796 -9.503 227 2HG1 VAL 50 2HG1 VAL 50 -8.446 -2.671 -10.816 228 3HG1 VAL 50 3HG1 VAL 50 -6.868 -3.480 -10.779 229 1HG2 VAL 50 1HG2 VAL 50 -9.093 -1.128 -9.054 230 2HG2 VAL 50 2HG2 VAL 50 -8.460 -2.080 -7.700 231 3HG2 VAL 50 3HG2 VAL 50 -7.910 -0.408 -7.959 232 HA PRO 51 HA PRO 51 -4.070 0.705 -6.175 233 1HB PRO 51 1HB PRO 51 -2.799 2.536 -7.731 234 2HB PRO 51 2HB PRO 51 -2.040 0.965 -7.366 235 1HG PRO 51 1HG PRO 51 -3.588 1.756 -9.850 236 2HG PRO 51 2HG PRO 51 -2.006 0.929 -9.772 237 1HD PRO 51 1HD PRO 51 -4.418 -0.376 -10.100 238 2HD PRO 51 2HD PRO 51 -3.030 -1.135 -9.272 239 H VAL 52 H VAL 52 -4.782 2.940 -5.848 240 HA VAL 52 HA VAL 52 -7.332 3.523 -7.185 241 HB VAL 52 HB VAL 52 -7.232 5.485 -5.422 242 1HG1 VAL 52 1HG1 VAL 52 -8.486 3.969 -3.930 243 2HG1 VAL 52 2HG1 VAL 52 -9.026 3.885 -5.614 244 3HG1 VAL 52 3HG1 VAL 52 -8.006 2.590 -4.952 245 1HG2 VAL 52 1HG2 VAL 52 -6.242 4.729 -3.362 246 2HG2 VAL 52 2HG2 VAL 52 -5.706 3.216 -4.121 247 3HG2 VAL 52 3HG2 VAL 52 -4.964 4.761 -4.606 248 H GLN 53 H GLN 53 -4.218 5.146 -6.513 249 HA GLN 53 HA GLN 53 -4.445 6.559 -9.105 250 1HB GLN 53 1HB GLN 53 -3.251 7.803 -6.601 251 2HB GLN 53 2HB GLN 53 -3.307 8.488 -8.198 252 1HG GLN 53 1HG GLN 53 -4.991 9.634 -7.101 253 2HG GLN 53 2HG GLN 53 -5.819 8.478 -8.153 254 1HE2 GLN 53 1HE2 GLN 53 -4.270 7.898 -4.912 255 2HE2 GLN 53 2HE2 GLN 53 -5.765 7.472 -4.145 256 H ARG 54 H ARG 54 -2.287 6.915 -10.001 257 HA ARG 54 HA ARG 54 -0.326 4.896 -9.408 258 1HB ARG 54 1HB ARG 54 -0.557 5.989 -11.602 259 2HB ARG 54 2HB ARG 54 -0.125 7.544 -10.925 260 1HG ARG 54 1HG ARG 54 1.732 6.416 -12.182 261 2HG ARG 54 2HG ARG 54 2.161 6.854 -10.525 262 1HD ARG 54 1HD ARG 54 1.958 4.703 -9.772 263 2HD ARG 54 2HD ARG 54 1.134 4.167 -11.250 264 HE ARG 54 HE ARG 54 3.628 4.939 -12.152 265 1HH1 ARG 54 1HH1 ARG 54 2.807 2.943 -9.326 266 2HH1 ARG 54 2HH1 ARG 54 3.764 1.598 -9.907 267 1HH2 ARG 54 1HH2 ARG 54 5.317 3.104 -12.497 268 2HH2 ARG 54 2HH2 ARG 54 5.200 1.779 -11.323 269 H ASP 55 H ASP 55 -0.903 8.267 -8.403 270 HA ASP 55 HA ASP 55 1.267 8.071 -6.450 271 1HB ASP 55 1HB ASP 55 0.960 10.721 -7.739 272 2HB ASP 55 2HB ASP 55 2.394 9.893 -7.156 273 H ILE 56 H ILE 56 0.996 9.211 -4.638 274 HA ILE 56 HA ILE 56 -1.636 10.469 -4.073 275 HB ILE 56 HB ILE 56 0.345 9.189 -2.231 276 1HG1 ILE 56 1HG1 ILE 56 -2.448 8.385 -3.142 277 2HG1 ILE 56 2HG1 ILE 56 -0.926 7.595 -3.601 278 1HG2 ILE 56 1HG2 ILE 56 -0.789 11.156 -1.186 279 2HG2 ILE 56 2HG2 ILE 56 -2.357 10.470 -1.676 280 3HG2 ILE 56 3HG2 ILE 56 -1.313 9.642 -0.489 281 1HD1 ILE 56 1HD1 ILE 56 -0.458 7.302 -1.124 282 2HD1 ILE 56 2HD1 ILE 56 -2.180 7.664 -0.857 283 3HD1 ILE 56 3HD1 ILE 56 -1.710 6.302 -1.900 284 H ASP 57 H ASP 57 -1.452 12.564 -3.010 285 HA ASP 57 HA ASP 57 1.225 13.908 -3.030 286 1HB ASP 57 1HB ASP 57 -0.027 14.627 -4.977 287 2HB ASP 57 2HB ASP 57 -1.478 14.918 -3.991 288 H VAL 58 H VAL 58 1.479 13.581 -0.811 289 HA VAL 58 HA VAL 58 -0.696 14.444 1.083 290 HB VAL 58 HB VAL 58 -0.257 12.552 1.960 291 1HG1 VAL 58 1HG1 VAL 58 1.038 11.521 0.292 292 2HG1 VAL 58 2HG1 VAL 58 2.488 12.420 0.743 293 3HG1 VAL 58 3HG1 VAL 58 1.807 11.214 1.847 294 1HG2 VAL 58 1HG2 VAL 58 1.355 12.547 3.754 295 2HG2 VAL 58 2HG2 VAL 58 2.198 13.944 3.080 296 3HG2 VAL 58 3HG2 VAL 58 0.529 14.097 3.664 297 H ARG 59 H ARG 59 -0.352 16.318 2.356 298 HA ARG 59 HA ARG 59 1.771 18.150 1.930 299 1HB ARG 59 1HB ARG 59 0.040 17.590 4.350 300 2HB ARG 59 2HB ARG 59 1.279 18.811 4.425 301 1HG ARG 59 1HG ARG 59 -0.982 18.939 2.405 302 2HG ARG 59 2HG ARG 59 -0.950 19.719 3.994 303 1HD ARG 59 1HD ARG 59 1.359 20.654 3.344 304 2HD ARG 59 2HD ARG 59 0.949 20.222 1.675 305 HE ARG 59 HE ARG 59 -1.161 21.776 2.700 306 1HH1 ARG 59 1HH1 ARG 59 2.310 21.997 1.934 307 2HH1 ARG 59 2HH1 ARG 59 2.341 23.754 2.017 308 1HH2 ARG 59 1HH2 ARG 59 -1.085 24.129 2.814 309 2HH2 ARG 59 2HH2 ARG 59 0.464 24.907 2.828 310 H ILE 60 H ILE 60 1.906 17.077 5.190 311 HA ILE 60 HA ILE 60 4.539 15.782 4.947 312 HB ILE 60 HB ILE 60 4.060 18.317 6.481 313 1HG1 ILE 60 1HG1 ILE 60 4.212 18.829 4.069 314 2HG1 ILE 60 2HG1 ILE 60 5.560 19.355 5.019 315 1HG2 ILE 60 1HG2 ILE 60 6.485 16.513 6.118 316 2HG2 ILE 60 2HG2 ILE 60 6.630 18.195 6.653 317 3HG2 ILE 60 3HG2 ILE 60 5.749 17.045 7.646 318 1HD1 ILE 60 1HD1 ILE 60 7.095 18.149 3.958 319 2HD1 ILE 60 2HD1 ILE 60 6.059 16.727 3.754 320 3HD1 ILE 60 3HD1 ILE 60 5.866 18.103 2.672 321 H GLY 61 H GLY 61 2.120 14.575 5.520 322 1HA GLY 61 1HA GLY 61 1.936 13.080 7.496 323 2HA GLY 61 2HA GLY 61 1.848 14.487 8.515 324 H GLU 62 H GLU 62 0.229 15.458 5.844 325 HA GLU 62 HA GLU 62 -2.441 15.329 6.723 326 1HB GLU 62 1HB GLU 62 -1.803 16.867 5.094 327 2HB GLU 62 2HB GLU 62 -1.060 15.605 4.075 328 1HG GLU 62 1HG GLU 62 -3.300 14.840 3.411 329 2HG GLU 62 2HG GLU 62 -4.013 16.140 4.390 330 H THR 63 H THR 63 -3.342 13.456 7.378 331 HA THR 63 HA THR 63 -2.959 10.859 6.327 332 HB THR 63 HB THR 63 -5.371 10.723 7.511 333 HG1 THR 63 HG1 THR 63 -5.667 12.939 7.537 334 1HG2 THR 63 1HG2 THR 63 -3.353 9.756 8.426 335 2HG2 THR 63 2HG2 THR 63 -2.819 11.351 9.038 336 3HG2 THR 63 3HG2 THR 63 -4.297 10.564 9.659 337 H VAL 64 H VAL 64 -3.325 10.458 4.199 338 HA VAL 64 HA VAL 64 -5.933 11.360 3.045 339 HB VAL 64 HB VAL 64 -4.394 12.221 1.652 340 1HG1 VAL 64 1HG1 VAL 64 -2.304 11.216 2.538 341 2HG1 VAL 64 2HG1 VAL 64 -2.704 9.688 1.716 342 3HG1 VAL 64 3HG1 VAL 64 -2.384 11.180 0.792 343 1HG2 VAL 64 1HG2 VAL 64 -6.058 10.848 0.448 344 2HG2 VAL 64 2HG2 VAL 64 -4.538 11.040 -0.440 345 3HG2 VAL 64 3HG2 VAL 64 -4.885 9.511 0.382 346 H GLN 65 H GLN 65 -7.342 9.923 2.412 347 HA GLN 65 HA GLN 65 -7.061 7.092 3.200 348 1HB GLN 65 1HB GLN 65 -9.079 8.387 3.731 349 2HB GLN 65 2HB GLN 65 -9.418 8.649 2.024 350 1HG GLN 65 1HG GLN 65 -9.025 5.822 3.090 351 2HG GLN 65 2HG GLN 65 -10.511 6.686 3.469 352 1HE2 GLN 65 1HE2 GLN 65 -9.225 7.427 0.254 353 2HE2 GLN 65 2HE2 GLN 65 -10.374 6.395 -0.574 354 H ILE 66 H ILE 66 -6.315 5.645 1.804 355 HA ILE 66 HA ILE 66 -7.092 5.920 -1.029 356 HB ILE 66 HB ILE 66 -4.923 4.541 -1.496 357 1HG1 ILE 66 1HG1 ILE 66 -2.946 5.502 -0.307 358 2HG1 ILE 66 2HG1 ILE 66 -3.980 6.119 0.966 359 1HG2 ILE 66 1HG2 ILE 66 -4.650 7.508 -0.982 360 2HG2 ILE 66 2HG2 ILE 66 -3.912 6.527 -2.276 361 3HG2 ILE 66 3HG2 ILE 66 -5.639 6.854 -2.301 362 1HD1 ILE 66 1HD1 ILE 66 -4.473 3.899 1.668 363 2HD1 ILE 66 2HD1 ILE 66 -3.825 3.180 0.162 364 3HD1 ILE 66 3HD1 ILE 66 -2.733 3.923 1.351 365 H MET 67 H MET 67 -8.656 4.547 -1.233 366 HA MET 67 HA MET 67 -8.633 2.047 0.330 367 1HB MET 67 1HB MET 67 -10.681 1.450 -0.752 368 2HB MET 67 2HB MET 67 -10.820 3.099 -0.154 369 1HG MET 67 1HG MET 67 -10.101 2.497 -3.040 370 2HG MET 67 2HG MET 67 -11.762 2.471 -2.484 371 1HE MET 67 1HE MET 67 -12.426 4.710 -0.690 372 2HE MET 67 2HE MET 67 -12.719 6.083 -1.781 373 3HE MET 67 3HE MET 67 -13.301 4.460 -2.213 374 H TYR 68 H TYR 68 -8.691 -0.070 -0.578 375 HA TYR 68 HA TYR 68 -7.307 -0.331 -3.213 376 1HB TYR 68 1HB TYR 68 -6.382 -1.311 -0.539 377 2HB TYR 68 2HB TYR 68 -6.381 -2.498 -1.831 378 HD1 TYR 68 HD1 TYR 68 -5.029 0.855 -0.884 379 HD2 TYR 68 HD2 TYR 68 -4.828 -2.455 -3.641 380 HE1 TYR 68 HE1 TYR 68 -2.875 1.713 -1.775 381 HE2 TYR 68 HE2 TYR 68 -2.664 -1.633 -4.484 382 HH TYR 68 HH TYR 68 -0.961 -0.078 -4.188 383 H ARG 69 H ARG 69 -7.893 -2.098 -4.341 384 HA ARG 69 HA ARG 69 -10.265 -3.660 -3.471 385 1HB ARG 69 1HB ARG 69 -9.741 -2.321 -5.890 386 2HB ARG 69 2HB ARG 69 -9.232 -3.963 -6.243 387 1HG ARG 69 1HG ARG 69 -11.359 -4.458 -6.671 388 2HG ARG 69 2HG ARG 69 -11.722 -4.305 -4.960 389 1HD ARG 69 1HD ARG 69 -11.834 -1.683 -5.557 390 2HD ARG 69 2HD ARG 69 -12.094 -2.286 -7.205 391 HE ARG 69 HE ARG 69 -13.980 -2.108 -5.048 392 1HH1 ARG 69 1HH1 ARG 69 -13.287 -4.411 -7.786 393 2HH1 ARG 69 2HH1 ARG 69 -14.837 -5.186 -7.407 394 1HH2 ARG 69 1HH2 ARG 69 -15.841 -3.131 -4.864 395 2HH2 ARG 69 2HH2 ARG 69 -16.229 -4.544 -5.929 396 H ALA 70 H ALA 70 -9.890 -5.949 -3.278 397 HA ALA 70 HA ALA 70 -7.595 -7.112 -4.659 398 1HB ALA 70 1HB ALA 70 -7.714 -7.163 -1.633 399 2HB ALA 70 2HB ALA 70 -6.709 -8.200 -2.664 400 3HB ALA 70 3HB ALA 70 -6.424 -6.437 -2.630 401 H LYS 71 H LYS 71 -9.481 -7.896 -5.555 402 HA LYS 71 HA LYS 71 -11.415 -9.425 -3.885 403 1HB LYS 71 1HB LYS 71 -12.653 -7.840 -4.833 404 2HB LYS 71 2HB LYS 71 -11.458 -7.453 -6.042 405 1HG LYS 71 1HG LYS 71 -12.173 -9.377 -7.435 406 2HG LYS 71 2HG LYS 71 -13.360 -9.806 -6.185 407 1HD LYS 71 1HD LYS 71 -14.343 -7.562 -6.418 408 2HD LYS 71 2HD LYS 71 -13.153 -7.140 -7.636 409 1HE LYS 71 1HE LYS 71 -14.030 -9.076 -9.047 410 2HE LYS 71 2HE LYS 71 -15.367 -9.233 -7.881 411 1HZ LYS 71 1HZ LYS 71 -15.996 -7.843 -9.714 412 2HZ LYS 71 2HZ LYS 71 -15.882 -6.902 -8.364 413 3HZ LYS 71 3HZ LYS 71 -14.642 -6.897 -9.510 414 H ASN 72 H ASN 72 -12.178 -11.519 -4.397 415 HA ASN 72 HA ASN 72 -10.221 -13.043 -5.885 416 1HB ASN 72 1HB ASN 72 -10.983 -13.828 -3.808 417 2HB ASN 72 2HB ASN 72 -12.673 -13.850 -4.333 418 1HD2 ASN 72 1HD2 ASN 72 -10.455 -16.049 -3.521 419 2HD2 ASN 72 2HD2 ASN 72 -10.585 -17.203 -4.818 420 H LEU 73 H LEU 73 -10.209 -13.617 -7.952 421 HA LEU 73 HA LEU 73 -12.782 -14.218 -9.320 422 1HB LEU 73 1HB LEU 73 -10.330 -12.818 -10.467 423 2HB LEU 73 2HB LEU 73 -11.659 -13.453 -11.440 424 HG LEU 73 HG LEU 73 -11.967 -11.259 -9.337 425 1HD1 LEU 73 1HD1 LEU 73 -12.163 -9.751 -11.291 426 2HD1 LEU 73 2HD1 LEU 73 -10.571 -10.529 -11.227 427 3HD1 LEU 73 3HD1 LEU 73 -11.796 -11.107 -12.377 428 1HD2 LEU 73 1HD2 LEU 73 -14.159 -10.901 -10.553 429 2HD2 LEU 73 2HD2 LEU 73 -13.865 -12.403 -11.444 430 3HD2 LEU 73 3HD2 LEU 73 -14.093 -12.434 -9.682 431 H ALA 74 H ALA 74 -11.707 -16.102 -7.900 432 HA ALA 74 HA ALA 74 -9.937 -17.795 -9.608 433 1HB ALA 74 1HB ALA 74 -9.135 -17.039 -7.301 434 2HB ALA 74 2HB ALA 74 -10.498 -17.949 -6.647 435 3HB ALA 74 3HB ALA 74 -9.215 -18.799 -7.528 436 H SER 75 H SER 75 -10.333 -20.136 -9.316 437 HA SER 75 HA SER 75 -13.156 -20.890 -9.538 438 1HB SER 75 1HB SER 75 -10.671 -22.615 -9.356 439 2HB SER 75 2HB SER 75 -12.238 -23.075 -10.046 440 HG SER 75 HG SER 75 -10.353 -22.401 -11.448 441 H THR 76 H THR 76 -10.733 -20.624 -7.031 442 HA THR 76 HA THR 76 -12.214 -22.223 -5.062 443 HB THR 76 HB THR 76 -9.879 -23.368 -4.636 444 HG1 THR 76 HG1 THR 76 -9.529 -22.376 -7.256 445 1HG2 THR 76 1HG2 THR 76 -10.308 -25.196 -6.150 446 2HG2 THR 76 2HG2 THR 76 -11.859 -24.602 -5.528 447 3HG2 THR 76 3HG2 THR 76 -11.343 -24.191 -7.176 448 HA PRO 77 HA PRO 77 -10.742 -19.042 -2.506 449 1HB PRO 77 1HB PRO 77 -9.779 -20.199 -0.166 450 2HB PRO 77 2HB PRO 77 -11.504 -20.047 -0.565 451 1HG PRO 77 1HG PRO 77 -9.712 -22.434 -1.022 452 2HG PRO 77 2HG PRO 77 -11.344 -22.407 -0.291 453 1HD PRO 77 1HD PRO 77 -11.026 -23.088 -2.861 454 2HD PRO 77 2HD PRO 77 -12.365 -22.013 -2.410 455 H THR 78 H THR 78 -8.878 -17.803 -2.920 456 HA THR 78 HA THR 78 -6.308 -19.208 -3.266 457 HB THR 78 HB THR 78 -6.345 -16.237 -3.184 458 HG1 THR 78 HG1 THR 78 -6.946 -16.350 -5.432 459 1HG2 THR 78 1HG2 THR 78 -5.305 -17.745 -5.528 460 2HG2 THR 78 2HG2 THR 78 -4.600 -16.388 -4.631 461 3HG2 THR 78 3HG2 THR 78 -4.478 -18.036 -4.012 462 H THR 79 H THR 79 -4.436 -17.752 -2.218 463 HA THR 79 HA THR 79 -5.005 -17.049 0.566 464 HB THR 79 HB THR 79 -3.648 -19.026 0.742 465 HG1 THR 79 HG1 THR 79 -1.977 -18.114 1.835 466 1HG2 THR 79 1HG2 THR 79 -1.741 -17.735 -1.267 467 2HG2 THR 79 2HG2 THR 79 -1.418 -19.208 -0.331 468 3HG2 THR 79 3HG2 THR 79 -2.718 -19.198 -1.531 469 H GLY 80 H GLY 80 -3.731 -15.211 1.093 470 1HA GLY 80 1HA GLY 80 -2.640 -13.549 -1.043 471 2HA GLY 80 2HA GLY 80 -4.130 -12.997 -0.288 472 H GLN 81 H GLN 81 -0.852 -14.007 0.152 473 HA GLN 81 HA GLN 81 -0.401 -12.164 2.424 474 1HB GLN 81 1HB GLN 81 1.289 -13.806 3.300 475 2HB GLN 81 2HB GLN 81 -0.392 -14.257 3.559 476 1HG GLN 81 1HG GLN 81 -0.210 -16.180 2.424 477 2HG GLN 81 2HG GLN 81 0.551 -15.416 1.028 478 1HE2 GLN 81 1HE2 GLN 81 2.855 -14.568 1.549 479 2HE2 GLN 81 2HE2 GLN 81 3.927 -15.791 2.251 480 H ALA 82 H ALA 82 -0.292 -11.158 0.147 481 HA ALA 82 HA ALA 82 1.823 -11.810 -1.647 482 1HB ALA 82 1HB ALA 82 0.281 -9.271 -1.052 483 2HB ALA 82 2HB ALA 82 1.345 -9.453 -2.457 484 3HB ALA 82 3HB ALA 82 -0.108 -10.484 -2.268 485 H THR 83 H THR 83 3.601 -10.139 -2.188 486 HA THR 83 HA THR 83 5.062 -9.444 0.336 487 HB THR 83 HB THR 83 6.130 -9.792 -2.421 488 HG1 THR 83 HG1 THR 83 5.350 -11.694 -1.166 489 1HG2 THR 83 1HG2 THR 83 7.568 -8.263 -1.114 490 2HG2 THR 83 2HG2 THR 83 7.518 -9.380 0.268 491 3HG2 THR 83 3HG2 THR 83 8.346 -9.847 -1.227 492 H PHE 84 H PHE 84 5.930 -7.267 0.488 493 HA PHE 84 HA PHE 84 5.692 -5.617 -1.842 494 1HB PHE 84 1HB PHE 84 4.555 -3.754 -0.773 495 2HB PHE 84 2HB PHE 84 3.510 -5.161 -0.890 496 HD1 PHE 84 HD1 PHE 84 5.419 -3.054 1.467 497 HD2 PHE 84 HD2 PHE 84 2.501 -6.181 1.009 498 HE1 PHE 84 HE1 PHE 84 4.583 -2.612 3.763 499 HE2 PHE 84 HE2 PHE 84 1.643 -5.720 3.289 500 HZ PHE 84 HZ PHE 84 2.682 -3.961 4.677 501 H ASN 85 H ASN 85 7.011 -3.808 -1.755 502 HA ASN 85 HA ASN 85 8.964 -3.631 0.516 503 1HB ASN 85 1HB ASN 85 10.399 -4.262 -1.141 504 2HB ASN 85 2HB ASN 85 9.435 -3.612 -2.450 505 1HD2 ASN 85 1HD2 ASN 85 9.500 -1.304 -2.885 506 2HD2 ASN 85 2HD2 ASN 85 10.770 -0.269 -2.243 507 H VAL 86 H VAL 86 8.700 -1.824 1.593 508 HA VAL 86 HA VAL 86 6.688 0.122 0.605 509 HB VAL 86 HB VAL 86 6.266 -1.261 2.481 510 1HG1 VAL 86 1HG1 VAL 86 8.461 0.123 4.056 511 2HG1 VAL 86 2HG1 VAL 86 7.248 -0.992 4.687 512 3HG1 VAL 86 3HG1 VAL 86 8.452 -1.573 3.540 513 1HG2 VAL 86 1HG2 VAL 86 6.410 1.555 3.524 514 2HG2 VAL 86 2HG2 VAL 86 5.246 1.021 2.287 515 3HG2 VAL 86 3HG2 VAL 86 5.226 0.302 3.906 516 H THR 87 H THR 87 8.830 0.968 -0.695 517 HA THR 87 HA THR 87 9.778 3.354 0.482 518 HB THR 87 HB THR 87 10.880 1.921 2.095 519 HG1 THR 87 HG1 THR 87 13.131 2.443 1.527 520 1HG2 THR 87 1HG2 THR 87 12.581 0.295 1.488 521 2HG2 THR 87 2HG2 THR 87 11.003 -0.121 0.804 522 3HG2 THR 87 3HG2 THR 87 12.264 0.584 -0.235 523 HA PRO 88 HA PRO 88 11.381 3.484 -3.741 524 1HB PRO 88 1HB PRO 88 13.161 5.599 -3.523 525 2HB PRO 88 2HB PRO 88 11.404 5.818 -3.676 526 1HG PRO 88 1HG PRO 88 13.047 6.000 -1.175 527 2HG PRO 88 2HG PRO 88 11.642 6.970 -1.690 528 1HD PRO 88 1HD PRO 88 11.482 4.901 0.108 529 2HD PRO 88 2HD PRO 88 10.150 5.405 -0.941 530 H MET 89 H MET 89 13.261 3.488 -0.751 531 HA MET 89 HA MET 89 14.820 1.314 -1.181 532 1HB MET 89 1HB MET 89 17.120 2.295 -1.566 533 2HB MET 89 2HB MET 89 16.074 2.205 -2.959 534 1HG MET 89 1HG MET 89 15.527 4.761 -2.339 535 2HG MET 89 2HG MET 89 17.061 4.621 -1.472 536 1HE MET 89 1HE MET 89 16.667 4.387 -6.051 537 2HE MET 89 2HE MET 89 16.061 3.056 -5.047 538 3HE MET 89 3HE MET 89 15.301 4.662 -4.946 539 H ALA 90 H ALA 90 15.729 4.595 -0.112 540 HA ALA 90 HA ALA 90 17.117 3.625 2.132 541 1HB ALA 90 1HB ALA 90 16.134 6.425 1.480 542 2HB ALA 90 2HB ALA 90 17.437 6.020 2.619 543 3HB ALA 90 3HB ALA 90 17.648 5.702 0.883 544 H ALA 91 H ALA 91 13.779 4.750 1.860 545 HA ALA 91 HA ALA 91 13.718 5.629 4.652 546 1HB ALA 91 1HB ALA 91 12.757 7.014 2.964 547 2HB ALA 91 2HB ALA 91 11.648 5.738 2.439 548 3HB ALA 91 3HB ALA 91 11.486 6.454 4.067 549 H GLY 92 H GLY 92 10.840 4.158 3.379 550 1HA GLY 92 1HA GLY 92 9.439 2.631 4.249 551 2HA GLY 92 2HA GLY 92 10.819 1.627 4.687 552 H ALA 93 H ALA 93 11.964 2.964 6.774 553 HA ALA 93 HA ALA 93 10.388 2.652 9.025 554 1HB ALA 93 1HB ALA 93 12.021 4.160 10.153 555 2HB ALA 93 2HB ALA 93 12.812 2.955 9.115 556 3HB ALA 93 3HB ALA 93 12.657 4.635 8.563 557 H TYR 94 H TYR 94 11.028 5.622 7.243 558 HA TYR 94 HA TYR 94 9.180 7.266 8.689 559 1HB TYR 94 1HB TYR 94 10.480 7.903 6.045 560 2HB TYR 94 2HB TYR 94 10.019 9.012 7.338 561 HD1 TYR 94 HD1 TYR 94 11.150 8.165 9.758 562 HD2 TYR 94 HD2 TYR 94 12.780 7.471 5.841 563 HE1 TYR 94 HE1 TYR 94 13.322 7.557 10.770 564 HE2 TYR 94 HE2 TYR 94 14.943 6.793 6.869 565 HH TYR 94 HH TYR 94 16.157 6.503 8.865 566 H PHE 95 H PHE 95 8.130 4.831 6.923 567 HA PHE 95 HA PHE 95 6.010 6.255 5.401 568 1HB PHE 95 1HB PHE 95 7.202 4.003 4.742 569 2HB PHE 95 2HB PHE 95 6.267 3.283 6.029 570 HD1 PHE 95 HD1 PHE 95 6.347 4.145 2.552 571 HD2 PHE 95 HD2 PHE 95 3.687 3.356 5.853 572 HE1 PHE 95 HE1 PHE 95 4.493 3.817 0.971 573 HE2 PHE 95 HE2 PHE 95 1.881 2.820 4.247 574 HZ PHE 95 HZ PHE 95 2.249 3.135 1.807 575 H ASN 96 H ASN 96 4.058 6.843 6.347 576 HA ASN 96 HA ASN 96 3.918 6.106 9.133 577 1HB ASN 96 1HB ASN 96 2.902 8.362 7.739 578 2HB ASN 96 2HB ASN 96 1.626 7.614 8.703 579 1HD2 ASN 96 1HD2 ASN 96 4.654 9.324 8.730 580 2HD2 ASN 96 2HD2 ASN 96 4.921 9.393 10.450 581 H LYS 97 H LYS 97 3.888 3.888 8.339 582 HA LYS 97 HA LYS 97 1.220 2.717 7.983 583 1HB LYS 97 1HB LYS 97 2.401 0.587 8.529 584 2HB LYS 97 2HB LYS 97 2.959 1.413 7.079 585 1HG LYS 97 1HG LYS 97 4.971 2.210 8.247 586 2HG LYS 97 2HG LYS 97 4.393 1.484 9.769 587 1HD LYS 97 1HD LYS 97 4.508 -0.760 8.749 588 2HD LYS 97 2HD LYS 97 4.899 -0.048 7.181 589 1HE LYS 97 1HE LYS 97 6.926 -0.923 8.135 590 2HE LYS 97 2HE LYS 97 7.039 0.841 8.080 591 1HZ LYS 97 1HZ LYS 97 6.511 0.878 10.425 592 2HZ LYS 97 2HZ LYS 97 6.359 -0.763 10.465 593 3HZ LYS 97 3HZ LYS 97 7.820 -0.075 10.158 594 H VAL 98 H VAL 98 -0.194 2.581 9.597 595 HA VAL 98 HA VAL 98 0.390 1.774 12.259 596 HB VAL 98 HB VAL 98 1.042 4.102 12.561 597 1HG1 VAL 98 1HG1 VAL 98 -0.073 5.166 10.623 598 2HG1 VAL 98 2HG1 VAL 98 -1.655 4.919 11.389 599 3HG1 VAL 98 3HG1 VAL 98 -0.463 5.995 12.133 600 1HG2 VAL 98 1HG2 VAL 98 -0.472 4.758 14.314 601 2HG2 VAL 98 2HG2 VAL 98 -1.777 3.775 13.639 602 3HG2 VAL 98 3HG2 VAL 98 -0.330 2.995 14.328 603 H GLN 99 H GLN 99 -1.604 1.026 13.129 604 HA GLN 99 HA GLN 99 -3.496 -0.270 12.667 605 1HB GLN 99 1HB GLN 99 -4.236 2.642 13.004 606 2HB GLN 99 2HB GLN 99 -5.481 1.401 12.854 607 1HG GLN 99 1HG GLN 99 -5.097 1.849 15.168 608 2HG GLN 99 2HG GLN 99 -4.670 0.184 14.782 609 1HE2 GLN 99 1HE2 GLN 99 -2.421 -0.464 14.943 610 2HE2 GLN 99 2HE2 GLN 99 -1.266 0.581 15.755 611 H CYS 100 H CYS 100 -2.637 -0.788 10.434 612 HA CYS 100 HA CYS 100 -4.748 -0.951 8.589 613 1HB CYS 100 1HB CYS 100 -3.161 1.557 8.252 614 2HB CYS 100 2HB CYS 100 -3.192 0.532 6.814 615 HG CYS 100 HG CYS 100 -5.736 1.633 8.577 616 H PHE 101 H PHE 101 -1.285 -0.720 8.996 617 HA PHE 101 HA PHE 101 -0.075 -1.918 7.000 618 1HB PHE 101 1HB PHE 101 0.946 -1.118 9.114 619 2HB PHE 101 2HB PHE 101 0.396 -2.579 9.926 620 HD1 PHE 101 HD1 PHE 101 2.067 -4.174 10.321 621 HD2 PHE 101 HD2 PHE 101 2.319 -1.733 6.767 622 HE1 PHE 101 HE1 PHE 101 4.214 -5.244 9.732 623 HE2 PHE 101 HE2 PHE 101 4.486 -2.800 6.205 624 HZ PHE 101 HZ PHE 101 5.426 -4.564 7.672 625 H CYS 102 H CYS 102 -2.138 -3.819 9.138 626 HA CYS 102 HA CYS 102 -1.171 -6.418 8.765 627 1HB CYS 102 1HB CYS 102 -2.955 -5.861 10.352 628 2HB CYS 102 2HB CYS 102 -4.044 -5.425 9.010 629 HG CYS 102 HG CYS 102 -4.769 -7.721 9.979 630 H PHE 103 H PHE 103 -1.382 -7.980 7.206 631 HA PHE 103 HA PHE 103 -1.881 -7.323 4.478 632 1HB PHE 103 1HB PHE 103 -1.594 -9.963 5.958 633 2HB PHE 103 2HB PHE 103 -1.848 -9.860 4.228 634 HD1 PHE 103 HD1 PHE 103 -0.265 -8.685 2.720 635 HD2 PHE 103 HD2 PHE 103 0.671 -9.483 6.858 636 HE1 PHE 103 HE1 PHE 103 2.111 -8.241 2.265 637 HE2 PHE 103 HE2 PHE 103 3.064 -9.025 6.394 638 HZ PHE 103 HZ PHE 103 3.792 -8.400 4.096 639 H THR 104 H THR 104 -3.926 -6.262 4.793 640 HA THR 104 HA THR 104 -6.372 -7.699 5.163 641 HB THR 104 HB THR 104 -6.136 -5.347 5.586 642 HG1 THR 104 HG1 THR 104 -7.997 -4.686 4.242 643 1HG2 THR 104 1HG2 THR 104 -6.028 -3.635 3.883 644 2HG2 THR 104 2HG2 THR 104 -4.588 -4.645 3.772 645 3HG2 THR 104 3HG2 THR 104 -5.899 -4.834 2.591 646 H GLU 105 H GLU 105 -5.428 -9.508 3.803 647 HA GLU 105 HA GLU 105 -6.858 -9.584 1.234 648 1HB GLU 105 1HB GLU 105 -4.580 -10.758 0.389 649 2HB GLU 105 2HB GLU 105 -5.010 -9.073 0.113 650 1HG GLU 105 1HG GLU 105 -3.569 -8.342 1.951 651 2HG GLU 105 2HG GLU 105 -3.247 -10.013 2.428 652 H THR 106 H THR 106 -4.385 -11.601 2.864 653 HA THR 106 HA THR 106 -4.434 -13.542 3.916 654 HB THR 106 HB THR 106 -5.459 -12.424 5.649 655 HG1 THR 106 HG1 THR 106 -5.292 -14.685 5.795 656 1HG2 THR 106 1HG2 THR 106 -7.822 -12.374 6.154 657 2HG2 THR 106 2HG2 THR 106 -7.479 -11.416 4.716 658 3HG2 THR 106 3HG2 THR 106 -8.241 -13.021 4.570 659 H THR 107 H THR 107 -7.786 -13.689 2.815 660 HA THR 107 HA THR 107 -7.308 -15.731 0.913 661 HB THR 107 HB THR 107 -7.715 -16.549 3.726 662 HG1 THR 107 HG1 THR 107 -6.962 -17.894 1.344 663 1HG2 THR 107 1HG2 THR 107 -9.418 -17.921 1.572 664 2HG2 THR 107 2HG2 THR 107 -9.119 -18.533 3.205 665 3HG2 THR 107 3HG2 THR 107 -10.046 -17.046 2.989 666 H LEU 108 H LEU 108 -9.261 -16.109 -0.256 667 HA LEU 108 HA LEU 108 -11.770 -14.912 0.669 668 1HB LEU 108 1HB LEU 108 -10.258 -14.065 -1.821 669 2HB LEU 108 2HB LEU 108 -11.992 -13.808 -1.654 670 HG LEU 108 HG LEU 108 -9.889 -12.573 0.149 671 1HD1 LEU 108 1HD1 LEU 108 -11.489 -11.242 -2.078 672 2HD1 LEU 108 2HD1 LEU 108 -10.151 -10.590 -1.102 673 3HD1 LEU 108 3HD1 LEU 108 -9.833 -11.849 -2.290 674 1HD2 LEU 108 1HD2 LEU 108 -12.875 -11.994 -0.209 675 2HD2 LEU 108 2HD2 LEU 108 -12.144 -12.773 1.214 676 3HD2 LEU 108 3HD2 LEU 108 -11.764 -11.089 0.835 677 H GLU 109 H GLU 109 -13.249 -16.380 0.151 678 HA GLU 109 HA GLU 109 -12.954 -18.601 -1.459 679 1HB GLU 109 1HB GLU 109 -15.271 -17.050 -0.286 680 2HB GLU 109 2HB GLU 109 -15.616 -18.447 -1.267 681 1HG GLU 109 1HG GLU 109 -15.500 -19.031 1.121 682 2HG GLU 109 2HG GLU 109 -14.229 -19.868 0.218 683 HA PRO 110 HA PRO 110 -13.196 -17.721 -5.577 684 1HB PRO 110 1HB PRO 110 -14.858 -19.546 -6.744 685 2HB PRO 110 2HB PRO 110 -13.292 -19.870 -5.977 686 1HG PRO 110 1HG PRO 110 -16.002 -20.122 -4.663 687 2HG PRO 110 2HG PRO 110 -14.726 -21.377 -4.777 688 1HD PRO 110 1HD PRO 110 -14.871 -19.866 -2.586 689 2HD PRO 110 2HD PRO 110 -13.278 -20.117 -3.324 690 H GLY 111 H GLY 111 -13.992 -15.585 -5.519 691 1HA GLY 111 1HA GLY 111 -15.454 -14.397 -7.169 692 2HA GLY 111 2HA GLY 111 -16.837 -15.191 -6.410 693 H GLU 112 H GLU 112 -14.784 -14.595 -3.822 694 HA GLU 112 HA GLU 112 -16.697 -12.687 -3.039 695 1HB GLU 112 1HB GLU 112 -14.214 -13.744 -1.653 696 2HB GLU 112 2HB GLU 112 -15.404 -12.690 -0.895 697 1HG GLU 112 1HG GLU 112 -15.967 -15.417 -1.964 698 2HG GLU 112 2HG GLU 112 -15.888 -14.902 -0.271 699 H GLU 113 H GLU 113 -16.714 -10.573 -2.848 700 HA GLU 113 HA GLU 113 -14.660 -9.095 -4.325 701 1HB GLU 113 1HB GLU 113 -17.052 -9.128 -4.936 702 2HB GLU 113 2HB GLU 113 -17.444 -8.302 -3.425 703 1HG GLU 113 1HG GLU 113 -17.109 -6.367 -4.277 704 2HG GLU 113 2HG GLU 113 -15.420 -6.751 -4.610 705 H MET 114 H MET 114 -12.987 -8.488 -2.983 706 HA MET 114 HA MET 114 -13.532 -7.265 -0.357 707 1HB MET 114 1HB MET 114 -11.861 -9.265 -0.757 708 2HB MET 114 2HB MET 114 -10.860 -8.056 -1.520 709 1HG MET 114 1HG MET 114 -10.834 -6.741 0.572 710 2HG MET 114 2HG MET 114 -11.956 -7.900 1.312 711 1HE MET 114 1HE MET 114 -10.534 -8.237 3.406 712 2HE MET 114 2HE MET 114 -8.802 -8.630 3.391 713 3HE MET 114 3HE MET 114 -9.354 -7.040 2.807 714 H GLU 115 H GLU 115 -13.485 -5.098 -0.307 715 HA GLU 115 HA GLU 115 -11.084 -3.858 -1.277 716 1HB GLU 115 1HB GLU 115 -12.187 -1.803 -2.115 717 2HB GLU 115 2HB GLU 115 -12.622 -3.199 -3.105 718 1HG GLU 115 1HG GLU 115 -14.815 -3.350 -2.002 719 2HG GLU 115 2HG GLU 115 -14.388 -2.022 -0.907 720 H MET 116 H MET 116 -10.519 -2.016 0.090 721 HA MET 116 HA MET 116 -12.434 -1.110 2.030 722 1HB MET 116 1HB MET 116 -10.021 -2.669 3.051 723 2HB MET 116 2HB MET 116 -10.869 -1.459 4.018 724 1HG MET 116 1HG MET 116 -13.025 -2.788 3.489 725 2HG MET 116 2HG MET 116 -11.921 -4.112 3.079 726 1HE MET 116 1HE MET 116 -10.289 -5.209 4.867 727 2HE MET 116 2HE MET 116 -9.613 -3.613 5.308 728 3HE MET 116 3HE MET 116 -10.204 -4.712 6.574 729 HA PRO 117 HA PRO 117 -9.840 2.663 1.896 730 1HB PRO 117 1HB PRO 117 -10.696 2.773 4.752 731 2HB PRO 117 2HB PRO 117 -10.624 4.070 3.555 732 1HG PRO 117 1HG PRO 117 -13.015 2.945 4.108 733 2HG PRO 117 2HG PRO 117 -12.559 3.216 2.402 734 1HD PRO 117 1HD PRO 117 -12.340 0.638 3.987 735 2HD PRO 117 2HD PRO 117 -13.031 0.933 2.359 736 H VAL 118 H VAL 118 -7.598 2.875 2.311 737 HA VAL 118 HA VAL 118 -6.600 1.930 4.933 738 HB VAL 118 HB VAL 118 -5.261 1.836 2.201 739 1HG1 VAL 118 1HG1 VAL 118 -3.107 1.420 3.292 740 2HG1 VAL 118 2HG1 VAL 118 -3.660 3.064 3.594 741 3HG1 VAL 118 3HG1 VAL 118 -3.808 1.838 4.869 742 1HG2 VAL 118 1HG2 VAL 118 -5.435 -0.179 4.460 743 2HG2 VAL 118 2HG2 VAL 118 -6.407 -0.186 2.972 744 3HG2 VAL 118 3HG2 VAL 118 -4.655 -0.418 2.882 745 H VAL 119 H VAL 119 -5.191 3.560 5.917 746 HA VAL 119 HA VAL 119 -5.495 6.290 4.740 747 HB VAL 119 HB VAL 119 -6.831 6.007 6.773 748 1HG1 VAL 119 1HG1 VAL 119 -4.197 5.495 8.228 749 2HG1 VAL 119 2HG1 VAL 119 -5.790 5.727 8.967 750 3HG1 VAL 119 3HG1 VAL 119 -5.486 4.300 7.970 751 1HG2 VAL 119 1HG2 VAL 119 -6.035 7.989 7.929 752 2HG2 VAL 119 2HG2 VAL 119 -4.426 7.825 7.204 753 3HG2 VAL 119 3HG2 VAL 119 -5.832 8.198 6.182 754 H PHE 120 H PHE 120 -3.606 7.556 4.618 755 HA PHE 120 HA PHE 120 -1.062 6.400 5.603 756 1HB PHE 120 1HB PHE 120 -1.346 5.119 3.606 757 2HB PHE 120 2HB PHE 120 -2.059 6.473 2.737 758 HD1 PHE 120 HD1 PHE 120 1.173 5.351 4.269 759 HD2 PHE 120 HD2 PHE 120 -0.760 7.983 1.460 760 HE1 PHE 120 HE1 PHE 120 3.383 6.139 3.482 761 HE2 PHE 120 HE2 PHE 120 1.438 8.781 0.688 762 HZ PHE 120 HZ PHE 120 3.533 7.841 1.693 763 H PHE 121 H PHE 121 0.706 7.796 5.559 764 HA PHE 121 HA PHE 121 0.742 10.147 3.955 765 1HB PHE 121 1HB PHE 121 1.236 11.660 5.902 766 2HB PHE 121 2HB PHE 121 -0.435 11.165 5.753 767 HD1 PHE 121 HD1 PHE 121 2.512 11.079 7.945 768 HD2 PHE 121 HD2 PHE 121 -1.391 9.412 7.264 769 HE1 PHE 121 HE1 PHE 121 2.193 10.824 10.385 770 HE2 PHE 121 HE2 PHE 121 -1.552 8.834 9.688 771 HZ PHE 121 HZ PHE 121 0.179 9.627 11.248 772 H VAL 122 H VAL 122 2.970 11.231 4.316 773 HA VAL 122 HA VAL 122 5.061 9.170 4.879 774 HB VAL 122 HB VAL 122 5.249 11.961 3.694 775 1HG1 VAL 122 1HG1 VAL 122 7.380 9.852 4.184 776 2HG1 VAL 122 2HG1 VAL 122 7.572 11.150 2.997 777 3HG1 VAL 122 3HG1 VAL 122 7.360 11.546 4.702 778 1HG2 VAL 122 1HG2 VAL 122 4.108 10.457 2.170 779 2HG2 VAL 122 2HG2 VAL 122 5.755 10.716 1.571 780 3HG2 VAL 122 3HG2 VAL 122 5.342 9.209 2.417 781 H ASP 123 H ASP 123 6.665 9.521 6.518 782 HA ASP 123 HA ASP 123 5.836 11.378 8.619 783 1HB ASP 123 1HB ASP 123 6.727 8.916 8.959 784 2HB ASP 123 2HB ASP 123 8.306 9.656 8.764 785 HA PRO 124 HA PRO 124 8.916 14.351 7.046 786 1HB PRO 124 1HB PRO 124 8.987 16.063 9.243 787 2HB PRO 124 2HB PRO 124 7.846 16.135 7.889 788 1HG PRO 124 1HG PRO 124 7.518 14.859 10.579 789 2HG PRO 124 2HG PRO 124 6.281 15.828 9.698 790 1HD PRO 124 1HD PRO 124 6.208 13.142 9.823 791 2HD PRO 124 2HD PRO 124 5.738 13.986 8.317 792 H GLU 125 H GLU 125 9.267 12.307 9.977 793 HA GLU 125 HA GLU 125 11.886 12.836 10.707 794 1HB GLU 125 1HB GLU 125 10.175 11.345 11.697 795 2HB GLU 125 2HB GLU 125 10.443 10.224 10.359 796 1HG GLU 125 1HG GLU 125 11.894 9.355 11.797 797 2HG GLU 125 2HG GLU 125 13.001 10.627 11.268 798 H ILE 126 H ILE 126 10.601 11.547 7.615 799 HA ILE 126 HA ILE 126 12.967 10.412 6.652 800 HB ILE 126 HB ILE 126 10.688 10.378 5.605 801 1HG1 ILE 126 1HG1 ILE 126 12.851 11.098 3.581 802 2HG1 ILE 126 2HG1 ILE 126 12.926 9.619 4.543 803 1HG2 ILE 126 1HG2 ILE 126 9.967 12.043 4.065 804 2HG2 ILE 126 2HG2 ILE 126 10.399 12.929 5.533 805 3HG2 ILE 126 3HG2 ILE 126 11.506 12.902 4.139 806 1HD1 ILE 126 1HD1 ILE 126 11.861 9.067 2.489 807 2HD1 ILE 126 2HD1 ILE 126 10.688 8.976 3.808 808 3HD1 ILE 126 3HD1 ILE 126 10.657 10.357 2.676 809 H VAL 127 H VAL 127 12.143 13.922 6.835 810 HA VAL 127 HA VAL 127 14.658 14.539 5.347 811 HB VAL 127 HB VAL 127 13.964 16.903 5.596 812 1HG1 VAL 127 1HG1 VAL 127 13.618 15.602 3.534 813 2HG1 VAL 127 2HG1 VAL 127 12.007 15.121 4.111 814 3HG1 VAL 127 3HG1 VAL 127 12.360 16.826 3.782 815 1HG2 VAL 127 1HG2 VAL 127 11.714 17.518 6.132 816 2HG2 VAL 127 2HG2 VAL 127 11.214 15.835 6.341 817 3HG2 VAL 127 3HG2 VAL 127 12.322 16.591 7.512 818 H LYS 128 H LYS 128 15.315 13.127 7.409 819 HA LYS 128 HA LYS 128 16.737 15.118 9.080 820 1HB LYS 128 1HB LYS 128 15.283 12.764 10.322 821 2HB LYS 128 2HB LYS 128 16.451 13.820 11.124 822 1HG LYS 128 1HG LYS 128 14.928 15.766 10.609 823 2HG LYS 128 2HG LYS 128 13.787 14.613 9.879 824 1HD LYS 128 1HD LYS 128 13.741 13.351 12.036 825 2HD LYS 128 2HD LYS 128 14.706 14.629 12.788 826 1HE LYS 128 1HE LYS 128 12.934 16.282 12.389 827 2HE LYS 128 2HE LYS 128 12.024 15.131 11.395 828 1HZ LYS 128 1HZ LYS 128 11.754 13.744 13.327 829 2HZ LYS 128 2HZ LYS 128 12.507 14.813 14.283 830 3HZ LYS 128 3HZ LYS 128 11.069 15.215 13.571 831 HA PRO 129 HA PRO 129 19.633 11.551 9.328 832 1HB PRO 129 1HB PRO 129 19.216 9.001 8.465 833 2HB PRO 129 2HB PRO 129 18.510 9.617 9.987 834 1HG PRO 129 1HG PRO 129 17.188 9.533 7.251 835 2HG PRO 129 2HG PRO 129 16.570 8.867 8.782 836 1HD PRO 129 1HD PRO 129 15.775 11.276 7.978 837 2HD PRO 129 2HD PRO 129 16.191 10.969 9.693 838 H VAL 130 H VAL 130 21.423 10.894 8.105 839 HA VAL 130 HA VAL 130 21.806 11.916 5.537 840 HB VAL 130 HB VAL 130 23.307 9.773 7.093 841 1HG1 VAL 130 1HG1 VAL 130 25.245 10.470 5.683 842 2HG1 VAL 130 2HG1 VAL 130 23.974 9.673 4.749 843 3HG1 VAL 130 3HG1 VAL 130 24.138 11.445 4.690 844 1HG2 VAL 130 1HG2 VAL 130 23.180 11.939 8.309 845 2HG2 VAL 130 2HG2 VAL 130 24.809 11.670 7.688 846 3HG2 VAL 130 3HG2 VAL 130 23.722 12.792 6.849 847 H GLU 131 H GLU 131 20.720 8.754 6.622 848 HA GLU 131 HA GLU 131 20.829 7.006 4.522 849 1HB GLU 131 1HB GLU 131 18.387 7.753 6.192 850 2HB GLU 131 2HB GLU 131 18.576 6.243 5.302 851 1HG GLU 131 1HG GLU 131 20.390 5.542 6.758 852 2HG GLU 131 2HG GLU 131 20.370 7.073 7.638 853 H THR 132 H THR 132 18.345 9.564 4.864 854 HA THR 132 HA THR 132 17.290 8.763 2.246 855 HB THR 132 HB THR 132 15.289 10.093 3.258 856 HG1 THR 132 HG1 THR 132 15.587 10.800 5.326 857 1HG2 THR 132 1HG2 THR 132 15.329 7.653 3.385 858 2HG2 THR 132 2HG2 THR 132 16.401 7.701 4.800 859 3HG2 THR 132 3HG2 THR 132 14.760 8.334 4.916 860 H GLN 133 H GLN 133 17.870 11.630 4.181 861 HA GLN 133 HA GLN 133 18.002 13.863 3.575 862 1HB GLN 133 1HB GLN 133 20.203 12.413 4.062 863 2HB GLN 133 2HB GLN 133 20.622 12.854 2.442 864 1HG GLN 133 1HG GLN 133 21.616 14.447 3.924 865 2HG GLN 133 2HG GLN 133 20.334 15.277 3.035 866 1HE2 GLN 133 1HE2 GLN 133 19.255 13.128 5.650 867 2HE2 GLN 133 2HE2 GLN 133 19.050 14.367 6.844 868 H GLY 134 H GLY 134 16.333 13.321 1.592 869 1HA GLY 134 1HA GLY 134 16.444 15.051 -0.439 870 2HA GLY 134 2HA GLY 134 17.630 13.871 -1.025 871 H ILE 135 H ILE 135 16.408 11.515 0.081 872 HA ILE 135 HA ILE 135 14.552 10.735 -1.871 873 HB ILE 135 HB ILE 135 15.073 9.747 0.924 874 1HG1 ILE 135 1HG1 ILE 135 16.798 9.391 -0.893 875 2HG1 ILE 135 2HG1 ILE 135 16.127 7.929 -0.162 876 1HG2 ILE 135 1HG2 ILE 135 13.092 8.633 -1.092 877 2HG2 ILE 135 2HG2 ILE 135 13.723 7.725 0.313 878 3HG2 ILE 135 3HG2 ILE 135 12.752 9.175 0.547 879 1HD1 ILE 135 1HD1 ILE 135 15.187 8.963 -2.850 880 2HD1 ILE 135 2HD1 ILE 135 16.412 7.707 -2.585 881 3HD1 ILE 135 3HD1 ILE 135 14.756 7.437 -2.037 882 H LYS 136 H LYS 136 12.587 11.391 -2.333 883 HA LYS 136 HA LYS 136 10.597 11.765 -0.258 884 1HB LYS 136 1HB LYS 136 9.980 14.007 -0.952 885 2HB LYS 136 2HB LYS 136 11.487 13.929 -0.044 886 1HG LYS 136 1HG LYS 136 12.689 14.765 -1.722 887 2HG LYS 136 2HG LYS 136 11.949 13.712 -2.944 888 1HD LYS 136 1HD LYS 136 9.947 15.073 -3.024 889 2HD LYS 136 2HD LYS 136 10.513 16.121 -1.724 890 1HE LYS 136 1HE LYS 136 11.838 15.848 -4.477 891 2HE LYS 136 2HE LYS 136 10.741 17.155 -4.003 892 1HZ LYS 136 1HZ LYS 136 13.344 16.587 -2.748 893 2HZ LYS 136 2HZ LYS 136 13.013 17.827 -3.777 894 3HZ LYS 136 3HZ LYS 136 12.304 17.783 -2.295 895 H THR 137 H THR 137 10.429 9.750 -1.896 896 HA THR 137 HA THR 137 7.927 10.454 -2.959 897 HB THR 137 HB THR 137 9.650 9.003 -4.985 898 HG1 THR 137 HG1 THR 137 9.195 11.729 -4.572 899 1HG2 THR 137 1HG2 THR 137 7.771 9.517 -6.461 900 2HG2 THR 137 2HG2 THR 137 7.354 8.481 -5.075 901 3HG2 THR 137 3HG2 THR 137 6.894 10.213 -5.073 902 H LEU 138 H LEU 138 7.135 9.236 -1.326 903 HA LEU 138 HA LEU 138 8.611 6.890 -0.541 904 1HB LEU 138 1HB LEU 138 7.509 8.754 0.866 905 2HB LEU 138 2HB LEU 138 6.036 7.783 0.752 906 HG LEU 138 HG LEU 138 7.797 5.870 1.409 907 1HD1 LEU 138 1HD1 LEU 138 8.958 8.386 2.621 908 2HD1 LEU 138 2HD1 LEU 138 9.438 6.734 3.056 909 3HD1 LEU 138 3HD1 LEU 138 9.776 7.354 1.422 910 1HD2 LEU 138 1HD2 LEU 138 7.237 6.094 3.717 911 2HD2 LEU 138 2HD2 LEU 138 6.802 7.792 3.579 912 3HD2 LEU 138 3HD2 LEU 138 5.781 6.571 2.812 913 H THR 139 H THR 139 8.335 5.284 -2.111 914 HA THR 139 HA THR 139 5.636 4.796 -3.062 915 HB THR 139 HB THR 139 7.526 4.719 -4.629 916 HG1 THR 139 HG1 THR 139 5.839 3.653 -5.371 917 1HG2 THR 139 1HG2 THR 139 8.235 2.129 -3.206 918 2HG2 THR 139 2HG2 THR 139 8.935 2.727 -4.727 919 3HG2 THR 139 3HG2 THR 139 9.161 3.656 -3.230 920 H LEU 140 H LEU 140 5.163 2.423 -3.416 921 HA LEU 140 HA LEU 140 5.931 0.618 -1.344 922 1HB LEU 140 1HB LEU 140 3.893 1.776 -0.373 923 2HB LEU 140 2HB LEU 140 2.933 1.162 -1.724 924 HG LEU 140 HG LEU 140 4.482 -0.648 0.202 925 1HD1 LEU 140 1HD1 LEU 140 1.581 0.269 0.367 926 2HD1 LEU 140 2HD1 LEU 140 2.331 -0.988 1.377 927 3HD1 LEU 140 3HD1 LEU 140 2.884 0.687 1.502 928 1HD2 LEU 140 1HD2 LEU 140 2.711 -2.293 -0.551 929 2HD2 LEU 140 2HD2 LEU 140 2.208 -1.102 -1.770 930 3HD2 LEU 140 3HD2 LEU 140 3.832 -1.818 -1.830 931 H SER 141 H SER 141 6.744 -0.772 -2.829 932 HA SER 141 HA SER 141 5.411 -1.281 -5.416 933 1HB SER 141 1HB SER 141 7.456 -2.690 -5.744 934 2HB SER 141 2HB SER 141 7.751 -0.946 -5.578 935 HG SER 141 HG SER 141 7.795 -2.764 -3.417 936 H TYR 142 H TYR 142 3.647 -2.511 -5.013 937 HA TYR 142 HA TYR 142 3.699 -4.679 -3.004 938 1HB TYR 142 1HB TYR 142 1.856 -2.681 -3.543 939 2HB TYR 142 2HB TYR 142 1.186 -4.008 -4.467 940 HD1 TYR 142 HD1 TYR 142 0.254 -2.393 -1.854 941 HD2 TYR 142 HD2 TYR 142 1.706 -6.373 -2.681 942 HE1 TYR 142 HE1 TYR 142 -0.949 -3.254 0.124 943 HE2 TYR 142 HE2 TYR 142 0.565 -7.189 -0.649 944 HH TYR 142 HH TYR 142 -1.166 -6.722 0.847 945 H THR 143 H THR 143 3.730 -6.797 -3.672 946 HA THR 143 HA THR 143 3.323 -7.402 -6.568 947 HB THR 143 HB THR 143 5.344 -8.711 -4.720 948 HG1 THR 143 HG1 THR 143 6.843 -7.357 -5.802 949 1HG2 THR 143 1HG2 THR 143 4.613 -9.945 -6.809 950 2HG2 THR 143 2HG2 THR 143 5.136 -8.549 -7.769 951 3HG2 THR 143 3HG2 THR 143 6.324 -9.484 -6.837 952 H PHE 144 H PHE 144 1.184 -7.996 -6.248 953 HA PHE 144 HA PHE 144 0.407 -10.160 -4.464 954 1HB PHE 144 1HB PHE 144 -0.837 -8.534 -6.655 955 2HB PHE 144 2HB PHE 144 -1.444 -10.161 -6.426 956 HD1 PHE 144 HD1 PHE 144 -3.631 -9.463 -5.906 957 HD2 PHE 144 HD2 PHE 144 -0.306 -7.951 -3.612 958 HE1 PHE 144 HE1 PHE 144 -5.157 -8.910 -4.063 959 HE2 PHE 144 HE2 PHE 144 -1.846 -7.451 -1.734 960 HZ PHE 144 HZ PHE 144 -4.257 -7.942 -1.932 961 H TYR 145 H TYR 145 2.077 -11.733 -4.807 962 HA TYR 145 HA TYR 145 1.316 -13.529 -7.016 963 1HB TYR 145 1HB TYR 145 3.338 -13.715 -8.041 964 2HB TYR 145 2HB TYR 145 3.157 -11.982 -7.806 965 HD1 TYR 145 HD1 TYR 145 5.661 -13.783 -8.391 966 HD2 TYR 145 HD2 TYR 145 4.130 -11.977 -4.780 967 HE1 TYR 145 HE1 TYR 145 7.924 -13.803 -7.411 968 HE2 TYR 145 HE2 TYR 145 6.398 -11.975 -3.825 969 HH TYR 145 HH TYR 145 9.214 -13.308 -5.564 970 HA PRO 146 HA PRO 146 2.815 -15.844 -3.202 971 1HB PRO 146 1HB PRO 146 0.555 -16.533 -1.821 972 2HB PRO 146 2HB PRO 146 1.464 -15.016 -1.593 973 1HG PRO 146 1HG PRO 146 -1.044 -15.412 -3.234 974 2HG PRO 146 2HG PRO 146 -0.638 -14.115 -2.087 975 1HD PRO 146 1HD PRO 146 -0.308 -13.858 -4.821 976 2HD PRO 146 2HD PRO 146 0.744 -13.034 -3.628 977 H ARG 147 H ARG 147 -0.496 -17.149 -4.016 978 HA ARG 147 HA ARG 147 0.747 -19.439 -5.407 979 1HB ARG 147 1HB ARG 147 -0.702 -19.711 -2.745 980 2HB ARG 147 2HB ARG 147 -0.361 -21.057 -3.825 981 1HG ARG 147 1HG ARG 147 1.759 -19.347 -2.451 982 2HG ARG 147 2HG ARG 147 1.173 -20.920 -1.906 983 1HD ARG 147 1HD ARG 147 1.930 -21.967 -4.019 984 2HD ARG 147 2HD ARG 147 2.585 -20.396 -4.552 985 HE ARG 147 HE ARG 147 3.648 -20.984 -1.999 986 1HH1 ARG 147 1HH1 ARG 147 3.866 -22.058 -5.339 987 2HH1 ARG 147 2HH1 ARG 147 5.493 -22.658 -5.232 988 1HH2 ARG 147 1HH2 ARG 147 5.822 -21.766 -1.791 989 2HH2 ARG 147 2HH2 ARG 147 6.632 -22.477 -3.147 990 H GLU 148 H GLU 148 -0.557 -20.005 -7.016 991 HA GLU 148 HA GLU 148 -3.314 -18.955 -7.090 992 1HB GLU 148 1HB GLU 148 -1.421 -18.421 -8.701 993 2HB GLU 148 2HB GLU 148 -1.636 -20.039 -9.367 994 1HG GLU 148 1HG GLU 148 -3.767 -17.851 -9.231 995 2HG GLU 148 2HG GLU 148 -2.801 -18.256 -10.650 996 HA PRO 149 HA PRO 149 -4.216 -23.428 -6.658 997 1HB PRO 149 1HB PRO 149 -6.817 -23.324 -5.969 998 2HB PRO 149 2HB PRO 149 -5.531 -22.767 -4.857 999 1HG PRO 149 1HG PRO 149 -7.247 -21.058 -6.690 1000 2HG PRO 149 2HG PRO 149 -6.918 -20.810 -4.957 1001 1HD PRO 149 1HD PRO 149 -5.504 -19.552 -6.937 1002 2HD PRO 149 2HD PRO 149 -4.718 -20.062 -5.405 1003 H SER 150 H SER 150 -6.073 -21.215 -8.765 1004 HA SER 150 HA SER 150 -6.510 -22.475 -10.995 1005 1HB SER 150 1HB SER 150 -7.369 -24.548 -10.154 1006 2HB SER 150 2HB SER 150 -8.466 -23.727 -9.026 1007 HG SER 150 HG SER 150 -9.347 -24.593 -11.087 1008 H LYS 151 H LYS 151 -7.866 -21.283 -12.235 1009 HA LYS 151 HA LYS 151 -9.828 -19.443 -11.160 1010 1HB LYS 151 1HB LYS 151 -8.904 -17.435 -12.084 1011 2HB LYS 151 2HB LYS 151 -7.678 -18.153 -11.056 1012 1HG LYS 151 1HG LYS 151 -7.763 -18.167 -14.117 1013 2HG LYS 151 2HG LYS 151 -6.699 -17.242 -13.051 1014 1HD LYS 151 1HD LYS 151 -6.003 -19.566 -12.108 1015 2HD LYS 151 2HD LYS 151 -6.683 -20.220 -13.613 1016 1HE LYS 151 1HE LYS 151 -5.112 -18.843 -14.932 1017 2HE LYS 151 2HE LYS 151 -4.479 -18.124 -13.433 1018 1HZ LYS 151 1HZ LYS 151 -4.307 -20.980 -14.130 1019 2HZ LYS 151 2HZ LYS 151 -3.058 -19.899 -14.120 1020 3HZ LYS 151 3HZ LYS 151 -3.817 -20.308 -12.720 Start of MODEL 3 1 H VAL 21 H VAL 21 -1.062 12.299 15.510 2 HA VAL 21 HA VAL 21 -1.725 9.730 16.789 3 HB VAL 21 HB VAL 21 -3.640 10.942 17.742 4 1HG1 VAL 21 1HG1 VAL 21 -1.432 10.855 18.858 5 2HG1 VAL 21 2HG1 VAL 21 -0.963 12.367 18.053 6 3HG1 VAL 21 3HG1 VAL 21 -2.301 12.356 19.216 7 1HG2 VAL 21 1HG2 VAL 21 -2.514 13.429 16.353 8 2HG2 VAL 21 2HG2 VAL 21 -4.049 12.635 15.951 9 3HG2 VAL 21 3HG2 VAL 21 -3.825 13.370 17.538 10 H GLU 22 H GLU 22 -1.611 9.066 14.312 11 HA GLU 22 HA GLU 22 -2.428 8.821 12.260 12 1HB GLU 22 1HB GLU 22 -3.414 6.881 13.620 13 2HB GLU 22 2HB GLU 22 -4.977 7.688 13.414 14 1HG GLU 22 1HG GLU 22 -4.723 7.547 10.942 15 2HG GLU 22 2HG GLU 22 -3.086 6.920 11.112 16 H GLN 23 H GLN 23 -2.540 11.275 12.975 17 HA GLN 23 HA GLN 23 -4.098 12.375 10.964 18 1HB GLN 23 1HB GLN 23 -4.820 12.982 13.814 19 2HB GLN 23 2HB GLN 23 -4.353 14.400 12.915 20 1HG GLN 23 1HG GLN 23 -6.396 12.549 11.664 21 2HG GLN 23 2HG GLN 23 -6.848 13.763 12.876 22 1HE2 GLN 23 1HE2 GLN 23 -5.105 13.485 9.655 23 2HE2 GLN 23 2HE2 GLN 23 -5.100 15.208 9.426 24 H ALA 24 H ALA 24 -3.177 14.674 10.787 25 HA ALA 24 HA ALA 24 -0.646 15.075 12.224 26 1HB ALA 24 1HB ALA 24 -0.937 15.108 9.208 27 2HB ALA 24 2HB ALA 24 0.529 15.540 10.116 28 3HB ALA 24 3HB ALA 24 -0.051 13.858 10.090 29 H SER 25 H SER 25 -1.059 17.007 13.109 30 HA SER 25 HA SER 25 -2.094 19.211 11.520 31 1HB SER 25 1HB SER 25 -3.694 18.421 14.014 32 2HB SER 25 2HB SER 25 -4.031 19.775 12.923 33 HG SER 25 HG SER 25 -4.018 17.732 11.346 34 H ASP 26 H ASP 26 0.189 18.502 12.700 35 HA ASP 26 HA ASP 26 0.908 20.422 14.810 36 1HB ASP 26 1HB ASP 26 1.799 18.378 16.065 37 2HB ASP 26 2HB ASP 26 0.049 18.600 16.083 38 H LEU 27 H LEU 27 1.875 17.531 12.994 39 HA LEU 27 HA LEU 27 4.603 18.560 12.571 40 1HB LEU 27 1HB LEU 27 5.101 16.324 11.796 41 2HB LEU 27 2HB LEU 27 4.273 16.310 13.347 42 HG LEU 27 HG LEU 27 2.149 16.090 11.542 43 1HD1 LEU 27 1HD1 LEU 27 4.406 14.290 10.582 44 2HD1 LEU 27 2HD1 LEU 27 2.740 14.304 9.993 45 3HD1 LEU 27 3HD1 LEU 27 3.791 15.704 9.692 46 1HD2 LEU 27 1HD2 LEU 27 2.387 14.852 13.631 47 2HD2 LEU 27 2HD2 LEU 27 2.027 13.751 12.292 48 3HD2 LEU 27 3HD2 LEU 27 3.685 13.858 12.932 49 H ILE 28 H ILE 28 1.672 18.900 10.825 50 HA ILE 28 HA ILE 28 2.821 18.693 8.170 51 HB ILE 28 HB ILE 28 0.280 20.073 9.117 52 1HG1 ILE 28 1HG1 ILE 28 0.883 17.357 7.848 53 2HG1 ILE 28 2HG1 ILE 28 0.270 17.698 9.470 54 1HG2 ILE 28 1HG2 ILE 28 1.168 20.962 6.907 55 2HG2 ILE 28 2HG2 ILE 28 1.182 19.276 6.332 56 3HG2 ILE 28 3HG2 ILE 28 -0.345 20.081 6.762 57 1HD1 ILE 28 1HD1 ILE 28 -1.275 18.116 6.891 58 2HD1 ILE 28 2HD1 ILE 28 -1.586 16.933 8.148 59 3HD1 ILE 28 3HD1 ILE 28 -1.806 18.651 8.512 60 H LEU 29 H LEU 29 4.575 19.908 7.832 61 HA LEU 29 HA LEU 29 4.199 22.883 7.846 62 1HB LEU 29 1HB LEU 29 6.720 21.319 7.227 63 2HB LEU 29 2HB LEU 29 6.483 23.058 7.151 64 HG LEU 29 HG LEU 29 7.615 22.654 9.100 65 1HD1 LEU 29 1HD1 LEU 29 6.228 23.486 10.895 66 2HD1 LEU 29 2HD1 LEU 29 5.721 24.257 9.379 67 3HD1 LEU 29 3HD1 LEU 29 4.753 22.943 10.090 68 1HD2 LEU 29 1HD2 LEU 29 5.619 20.683 10.224 69 2HD2 LEU 29 2HD2 LEU 29 7.048 20.170 9.293 70 3HD2 LEU 29 3HD2 LEU 29 7.233 21.076 10.805 71 H ASP 30 H ASP 30 4.829 23.793 5.565 72 HA ASP 30 HA ASP 30 2.842 22.591 3.951 73 1HB ASP 30 1HB ASP 30 4.570 25.054 3.599 74 2HB ASP 30 2HB ASP 30 3.302 24.581 2.471 75 H GLU 31 H GLU 31 5.128 20.814 3.975 76 HA GLU 31 HA GLU 31 6.189 20.945 1.213 77 1HB GLU 31 1HB GLU 31 6.690 18.786 3.258 78 2HB GLU 31 2HB GLU 31 7.471 19.014 1.714 79 1HG GLU 31 1HG GLU 31 8.419 21.166 2.458 80 2HG GLU 31 2HG GLU 31 7.631 20.987 4.035 81 H LYS 32 H LYS 32 4.932 20.489 -0.266 82 HA LYS 32 HA LYS 32 2.797 18.499 -0.394 83 1HB LYS 32 1HB LYS 32 2.716 20.588 -1.637 84 2HB LYS 32 2HB LYS 32 4.341 20.342 -2.265 85 1HG LYS 32 1HG LYS 32 2.854 20.015 -4.019 86 2HG LYS 32 2HG LYS 32 3.618 18.482 -3.633 87 1HD LYS 32 1HD LYS 32 1.379 17.959 -4.070 88 2HD LYS 32 2HD LYS 32 1.519 17.891 -2.303 89 1HE LYS 32 1HE LYS 32 0.462 20.153 -2.153 90 2HE LYS 32 2HE LYS 32 0.386 20.235 -3.926 91 1HZ LYS 32 1HZ LYS 32 -0.961 18.191 -2.278 92 2HZ LYS 32 2HZ LYS 32 -1.741 19.487 -2.984 93 3HZ LYS 32 3HZ LYS 32 -1.036 18.243 -3.843 94 H ILE 33 H ILE 33 3.783 16.518 0.201 95 HA ILE 33 HA ILE 33 6.217 15.593 -1.278 96 HB ILE 33 HB ILE 33 6.385 15.731 1.122 97 1HG1 ILE 33 1HG1 ILE 33 7.210 13.430 1.398 98 2HG1 ILE 33 2HG1 ILE 33 6.533 12.956 -0.159 99 1HG2 ILE 33 1HG2 ILE 33 4.126 15.166 1.832 100 2HG2 ILE 33 2HG2 ILE 33 4.314 13.507 1.196 101 3HG2 ILE 33 3HG2 ILE 33 5.307 14.089 2.531 102 1HD1 ILE 33 1HD1 ILE 33 8.111 14.476 -1.283 103 2HD1 ILE 33 2HD1 ILE 33 8.572 15.202 0.278 104 3HD1 ILE 33 3HD1 ILE 33 8.996 13.521 -0.081 105 H LYS 34 H LYS 34 5.975 14.199 -2.866 106 HA LYS 34 HA LYS 34 3.308 13.221 -3.564 107 1HB LYS 34 1HB LYS 34 5.123 14.317 -5.048 108 2HB LYS 34 2HB LYS 34 5.852 12.712 -5.124 109 1HG LYS 34 1HG LYS 34 2.921 13.203 -5.817 110 2HG LYS 34 2HG LYS 34 4.222 13.598 -6.924 111 1HD LYS 34 1HD LYS 34 4.841 10.919 -6.328 112 2HD LYS 34 2HD LYS 34 3.103 10.991 -6.128 113 1HE LYS 34 1HE LYS 34 2.750 11.922 -8.323 114 2HE LYS 34 2HE LYS 34 4.476 12.194 -8.603 115 1HZ LYS 34 1HZ LYS 34 3.122 10.171 -9.494 116 2HZ LYS 34 2HZ LYS 34 4.778 10.072 -9.194 117 3HZ LYS 34 3HZ LYS 34 3.693 9.458 -8.138 118 H VAL 35 H VAL 35 2.815 10.899 -3.905 119 HA VAL 35 HA VAL 35 4.748 8.984 -2.707 120 HB VAL 35 HB VAL 35 1.952 9.648 -1.866 121 1HG1 VAL 35 1HG1 VAL 35 1.747 7.469 -0.698 122 2HG1 VAL 35 2HG1 VAL 35 1.773 7.243 -2.440 123 3HG1 VAL 35 3HG1 VAL 35 3.236 6.909 -1.487 124 1HG2 VAL 35 1HG2 VAL 35 4.375 8.819 -0.265 125 2HG2 VAL 35 2HG2 VAL 35 3.865 10.502 -0.553 126 3HG2 VAL 35 3HG2 VAL 35 2.816 9.415 0.365 127 H THR 36 H THR 36 4.503 6.930 -3.671 128 HA THR 36 HA THR 36 2.730 6.758 -6.056 129 HB THR 36 HB THR 36 5.742 7.091 -6.059 130 HG1 THR 36 HG1 THR 36 3.735 8.625 -6.400 131 1HG2 THR 36 1HG2 THR 36 5.381 5.125 -7.411 132 2HG2 THR 36 2HG2 THR 36 4.005 5.891 -8.251 133 3HG2 THR 36 3HG2 THR 36 5.664 6.508 -8.481 134 H PHE 37 H PHE 37 1.757 5.031 -5.676 135 HA PHE 37 HA PHE 37 2.820 2.942 -3.943 136 1HB PHE 37 1HB PHE 37 0.349 3.045 -5.747 137 2HB PHE 37 2HB PHE 37 0.667 1.834 -4.522 138 HD1 PHE 37 HD1 PHE 37 1.088 2.694 -2.075 139 HD2 PHE 37 HD2 PHE 37 -1.099 4.821 -5.130 140 HE1 PHE 37 HE1 PHE 37 -0.119 3.973 -0.347 141 HE2 PHE 37 HE2 PHE 37 -2.260 6.118 -3.379 142 HZ PHE 37 HZ PHE 37 -1.600 5.861 -0.990 143 H ASP 38 H ASP 38 2.983 0.593 -4.644 144 HA ASP 38 HA ASP 38 2.833 0.214 -7.569 145 1HB ASP 38 1HB ASP 38 5.234 0.605 -6.850 146 2HB ASP 38 2HB ASP 38 5.156 -0.924 -5.985 147 H ALA 39 H ALA 39 0.797 -0.570 -7.190 148 HA ALA 39 HA ALA 39 0.328 -2.909 -5.520 149 1HB ALA 39 1HB ALA 39 -1.437 -1.244 -5.904 150 2HB ALA 39 2HB ALA 39 -1.360 -1.551 -7.656 151 3HB ALA 39 3HB ALA 39 -1.916 -2.822 -6.559 152 H ASN 40 H ASN 40 1.486 -4.740 -6.198 153 HA ASN 40 HA ASN 40 1.755 -5.236 -9.133 154 1HB ASN 40 1HB ASN 40 3.120 -6.400 -6.687 155 2HB ASN 40 2HB ASN 40 3.257 -7.097 -8.298 156 1HD2 ASN 40 1HD2 ASN 40 3.656 -3.828 -6.639 157 2HD2 ASN 40 2HD2 ASN 40 5.064 -3.442 -7.611 158 H VAL 41 H VAL 41 0.962 -7.146 -10.031 159 HA VAL 41 HA VAL 41 -0.483 -9.040 -8.287 160 HB VAL 41 HB VAL 41 -1.506 -8.076 -10.995 161 1HG1 VAL 41 1HG1 VAL 41 -3.473 -9.494 -10.435 162 2HG1 VAL 41 2HG1 VAL 41 -2.001 -10.465 -10.555 163 3HG1 VAL 41 3HG1 VAL 41 -2.656 -10.043 -8.959 164 1HG2 VAL 41 1HG2 VAL 41 -2.484 -7.582 -8.174 165 2HG2 VAL 41 2HG2 VAL 41 -1.960 -6.343 -9.335 166 3HG2 VAL 41 3HG2 VAL 41 -3.459 -7.236 -9.626 167 H ALA 42 H ALA 42 0.067 -11.124 -8.817 168 HA ALA 42 HA ALA 42 1.813 -11.561 -11.194 169 1HB ALA 42 1HB ALA 42 3.128 -13.113 -9.832 170 2HB ALA 42 2HB ALA 42 3.171 -11.469 -9.156 171 3HB ALA 42 3HB ALA 42 2.156 -12.716 -8.395 172 H ALA 43 H ALA 43 1.701 -13.828 -11.887 173 HA ALA 43 HA ALA 43 -0.777 -14.832 -12.399 174 1HB ALA 43 1HB ALA 43 1.772 -16.445 -11.962 175 2HB ALA 43 2HB ALA 43 0.327 -17.001 -12.833 176 3HB ALA 43 3HB ALA 43 1.274 -15.643 -13.470 177 H GLY 44 H GLY 44 1.256 -15.601 -9.642 178 1HA GLY 44 1HA GLY 44 -0.033 -17.581 -8.274 179 2HA GLY 44 2HA GLY 44 0.861 -16.261 -7.518 180 H LEU 45 H LEU 45 -1.170 -14.102 -8.344 181 HA LEU 45 HA LEU 45 -3.342 -14.962 -6.499 182 1HB LEU 45 1HB LEU 45 -1.460 -13.263 -5.843 183 2HB LEU 45 2HB LEU 45 -2.478 -12.110 -6.669 184 HG LEU 45 HG LEU 45 -3.551 -14.066 -4.511 185 1HD1 LEU 45 1HD1 LEU 45 -3.196 -12.522 -2.847 186 2HD1 LEU 45 2HD1 LEU 45 -1.692 -12.355 -3.782 187 3HD1 LEU 45 3HD1 LEU 45 -2.991 -11.190 -3.966 188 1HD2 LEU 45 1HD2 LEU 45 -4.551 -11.532 -5.893 189 2HD2 LEU 45 2HD2 LEU 45 -5.305 -13.148 -5.894 190 3HD2 LEU 45 3HD2 LEU 45 -5.243 -12.187 -4.400 191 HA PRO 46 HA PRO 46 -5.377 -13.927 -10.444 192 1HB PRO 46 1HB PRO 46 -7.381 -15.744 -10.389 193 2HB PRO 46 2HB PRO 46 -5.689 -16.293 -10.413 194 1HG PRO 46 1HG PRO 46 -7.422 -15.996 -7.970 195 2HG PRO 46 2HG PRO 46 -6.490 -17.438 -8.486 196 1HD PRO 46 1HD PRO 46 -5.512 -15.571 -6.724 197 2HD PRO 46 2HD PRO 46 -4.456 -16.485 -7.854 198 H TRP 47 H TRP 47 -5.731 -12.087 -8.226 199 HA TRP 47 HA TRP 47 -8.678 -11.668 -8.266 200 1HB TRP 47 1HB TRP 47 -6.720 -10.866 -6.114 201 2HB TRP 47 2HB TRP 47 -8.434 -10.538 -6.163 202 HD1 TRP 47 HD1 TRP 47 -8.525 -13.973 -7.173 203 HE1 TRP 47 HE1 TRP 47 -8.929 -15.542 -5.231 204 HE3 TRP 47 HE3 TRP 47 -7.144 -10.894 -3.319 205 HZ2 TRP 47 HZ2 TRP 47 -8.629 -15.550 -2.389 206 HZ3 TRP 47 HZ3 TRP 47 -6.835 -11.913 -1.099 207 HH2 TRP 47 HH2 TRP 47 -7.601 -14.152 -0.578 208 H GLU 48 H GLU 48 -9.363 -9.605 -8.752 209 HA GLU 48 HA GLU 48 -7.505 -8.055 -10.428 210 1HB GLU 48 1HB GLU 48 -9.846 -8.615 -11.051 211 2HB GLU 48 2HB GLU 48 -10.436 -7.682 -9.673 212 1HG GLU 48 1HG GLU 48 -9.436 -5.623 -10.692 213 2HG GLU 48 2HG GLU 48 -8.976 -6.568 -12.111 214 H PHE 49 H PHE 49 -6.098 -7.590 -8.597 215 HA PHE 49 HA PHE 49 -6.997 -5.771 -6.494 216 1HB PHE 49 1HB PHE 49 -5.342 -7.405 -5.959 217 2HB PHE 49 2HB PHE 49 -4.322 -6.856 -7.284 218 HD1 PHE 49 HD1 PHE 49 -2.319 -6.163 -6.274 219 HD2 PHE 49 HD2 PHE 49 -6.076 -4.861 -4.575 220 HE1 PHE 49 HE1 PHE 49 -1.111 -4.861 -4.602 221 HE2 PHE 49 HE2 PHE 49 -4.834 -3.577 -2.868 222 HZ PHE 49 HZ PHE 49 -2.360 -3.541 -2.881 223 H VAL 50 H VAL 50 -7.697 -3.852 -7.407 224 HA VAL 50 HA VAL 50 -6.039 -2.624 -9.517 225 HB VAL 50 HB VAL 50 -7.789 -1.062 -9.881 226 1HG1 VAL 50 1HG1 VAL 50 -9.106 -3.752 -9.360 227 2HG1 VAL 50 2HG1 VAL 50 -9.564 -2.543 -10.566 228 3HG1 VAL 50 3HG1 VAL 50 -8.038 -3.431 -10.750 229 1HG2 VAL 50 1HG2 VAL 50 -9.045 -2.176 -7.363 230 2HG2 VAL 50 2HG2 VAL 50 -8.601 -0.485 -7.685 231 3HG2 VAL 50 3HG2 VAL 50 -9.947 -1.226 -8.562 232 HA PRO 51 HA PRO 51 -4.298 0.242 -6.409 233 1HB PRO 51 1HB PRO 51 -3.150 2.079 -8.090 234 2HB PRO 51 2HB PRO 51 -2.411 0.485 -7.785 235 1HG PRO 51 1HG PRO 51 -4.172 1.306 -10.108 236 2HG PRO 51 2HG PRO 51 -2.617 0.425 -10.178 237 1HD PRO 51 1HD PRO 51 -5.035 -0.823 -10.293 238 2HD PRO 51 2HD PRO 51 -3.647 -1.595 -9.468 239 H VAL 52 H VAL 52 -4.889 2.425 -5.802 240 HA VAL 52 HA VAL 52 -7.641 3.014 -6.571 241 HB VAL 52 HB VAL 52 -5.929 4.683 -4.687 242 1HG1 VAL 52 1HG1 VAL 52 -8.098 5.012 -3.581 243 2HG1 VAL 52 2HG1 VAL 52 -8.216 5.451 -5.289 244 3HG1 VAL 52 3HG1 VAL 52 -8.879 3.907 -4.729 245 1HG2 VAL 52 1HG2 VAL 52 -7.067 1.921 -4.219 246 2HG2 VAL 52 2HG2 VAL 52 -5.435 2.513 -3.860 247 3HG2 VAL 52 3HG2 VAL 52 -6.796 3.057 -2.886 248 H GLN 53 H GLN 53 -4.606 4.818 -6.407 249 HA GLN 53 HA GLN 53 -4.917 5.796 -9.132 250 1HB GLN 53 1HB GLN 53 -3.896 7.508 -6.821 251 2HB GLN 53 2HB GLN 53 -3.761 7.908 -8.512 252 1HG GLN 53 1HG GLN 53 -5.552 9.210 -7.797 253 2HG GLN 53 2HG GLN 53 -6.271 7.890 -8.728 254 1HE2 GLN 53 1HE2 GLN 53 -5.078 8.003 -5.305 255 2HE2 GLN 53 2HE2 GLN 53 -6.631 7.570 -4.623 256 H ARG 54 H ARG 54 -2.508 6.249 -9.831 257 HA ARG 54 HA ARG 54 -0.800 4.122 -8.879 258 1HB ARG 54 1HB ARG 54 -0.580 5.033 -11.159 259 2HB ARG 54 2HB ARG 54 -0.179 6.619 -10.516 260 1HG ARG 54 1HG ARG 54 1.839 5.494 -11.264 261 2HG ARG 54 2HG ARG 54 1.909 5.734 -9.519 262 1HD ARG 54 1HD ARG 54 1.274 3.439 -9.175 263 2HD ARG 54 2HD ARG 54 1.102 3.246 -10.940 264 HE ARG 54 HE ARG 54 3.739 4.166 -10.216 265 1HH1 ARG 54 1HH1 ARG 54 1.767 1.182 -10.130 266 2HH1 ARG 54 2HH1 ARG 54 3.202 0.194 -9.790 267 1HH2 ARG 54 1HH2 ARG 54 5.566 2.665 -9.793 268 2HH2 ARG 54 2HH2 ARG 54 5.132 0.961 -9.631 269 H ASP 55 H ASP 55 -1.048 7.688 -8.322 270 HA ASP 55 HA ASP 55 0.754 7.573 -6.033 271 1HB ASP 55 1HB ASP 55 1.619 9.701 -7.108 272 2HB ASP 55 2HB ASP 55 1.976 8.204 -8.007 273 H ILE 56 H ILE 56 0.699 9.631 -4.915 274 HA ILE 56 HA ILE 56 -1.799 11.141 -4.965 275 HB ILE 56 HB ILE 56 -2.181 11.071 -2.571 276 1HG1 ILE 56 1HG1 ILE 56 -0.004 8.989 -2.628 277 2HG1 ILE 56 2HG1 ILE 56 0.052 10.607 -1.872 278 1HG2 ILE 56 1HG2 ILE 56 -2.175 8.278 -3.716 279 2HG2 ILE 56 2HG2 ILE 56 -3.203 8.894 -2.399 280 3HG2 ILE 56 3HG2 ILE 56 -3.414 9.513 -4.047 281 1HD1 ILE 56 1HD1 ILE 56 -1.663 9.917 -0.243 282 2HD1 ILE 56 2HD1 ILE 56 -1.620 8.262 -0.918 283 3HD1 ILE 56 3HD1 ILE 56 -0.189 8.936 -0.136 284 H ASP 57 H ASP 57 -1.412 12.996 -3.260 285 HA ASP 57 HA ASP 57 1.378 13.180 -2.515 286 1HB ASP 57 1HB ASP 57 1.635 15.478 -2.816 287 2HB ASP 57 2HB ASP 57 0.990 14.922 -4.365 288 H VAL 58 H VAL 58 1.614 14.264 -0.565 289 HA VAL 58 HA VAL 58 -0.789 14.573 1.173 290 HB VAL 58 HB VAL 58 -0.308 12.805 2.297 291 1HG1 VAL 58 1HG1 VAL 58 2.352 12.477 0.882 292 2HG1 VAL 58 2HG1 VAL 58 1.635 11.323 2.013 293 3HG1 VAL 58 3HG1 VAL 58 0.815 11.673 0.494 294 1HG2 VAL 58 1HG2 VAL 58 1.460 12.799 3.916 295 2HG2 VAL 58 2HG2 VAL 58 2.365 14.032 3.022 296 3HG2 VAL 58 3HG2 VAL 58 0.795 14.427 3.771 297 H ARG 59 H ARG 59 -0.532 16.464 2.471 298 HA ARG 59 HA ARG 59 1.887 18.145 2.175 299 1HB ARG 59 1HB ARG 59 -0.752 18.447 3.666 300 2HB ARG 59 2HB ARG 59 0.635 19.471 4.001 301 1HG ARG 59 1HG ARG 59 -0.677 19.198 1.263 302 2HG ARG 59 2HG ARG 59 -1.001 20.472 2.441 303 1HD ARG 59 1HD ARG 59 1.771 20.593 2.320 304 2HD ARG 59 2HD ARG 59 1.398 20.036 0.700 305 HE ARG 59 HE ARG 59 0.723 22.156 0.179 306 1HH1 ARG 59 1HH1 ARG 59 0.328 21.816 3.715 307 2HH1 ARG 59 2HH1 ARG 59 0.605 23.553 3.952 308 1HH2 ARG 59 1HH2 ARG 59 0.873 24.493 0.664 309 2HH2 ARG 59 2HH2 ARG 59 0.861 24.912 2.378 310 H ILE 60 H ILE 60 3.540 17.020 3.132 311 HA ILE 60 HA ILE 60 4.032 14.992 4.522 312 HB ILE 60 HB ILE 60 5.579 16.245 6.168 313 1HG1 ILE 60 1HG1 ILE 60 4.803 18.552 4.340 314 2HG1 ILE 60 2HG1 ILE 60 4.163 18.342 5.950 315 1HG2 ILE 60 1HG2 ILE 60 7.179 16.652 4.318 316 2HG2 ILE 60 2HG2 ILE 60 6.334 15.130 4.169 317 3HG2 ILE 60 3HG2 ILE 60 5.839 16.521 3.167 318 1HD1 ILE 60 1HD1 ILE 60 6.303 18.704 6.960 319 2HD1 ILE 60 2HD1 ILE 60 7.163 18.482 5.418 320 3HD1 ILE 60 3HD1 ILE 60 6.173 19.904 5.658 321 H GLY 61 H GLY 61 2.101 14.134 5.420 322 1HA GLY 61 1HA GLY 61 1.779 13.427 7.885 323 2HA GLY 61 2HA GLY 61 1.397 15.128 8.133 324 H GLU 62 H GLU 62 0.002 15.578 5.686 325 HA GLU 62 HA GLU 62 -2.588 15.300 6.300 326 1HB GLU 62 1HB GLU 62 -1.454 16.431 4.310 327 2HB GLU 62 2HB GLU 62 -1.623 14.883 3.448 328 1HG GLU 62 1HG GLU 62 -3.468 16.234 2.792 329 2HG GLU 62 2HG GLU 62 -4.153 15.098 3.965 330 H THR 63 H THR 63 -3.677 13.491 7.049 331 HA THR 63 HA THR 63 -3.091 10.812 6.235 332 HB THR 63 HB THR 63 -5.479 10.579 7.426 333 HG1 THR 63 HG1 THR 63 -5.855 12.832 7.326 334 1HG2 THR 63 1HG2 THR 63 -3.375 9.820 8.415 335 2HG2 THR 63 2HG2 THR 63 -2.975 11.484 8.910 336 3HG2 THR 63 3HG2 THR 63 -4.385 10.630 9.600 337 H VAL 64 H VAL 64 -3.348 10.348 4.101 338 HA VAL 64 HA VAL 64 -5.665 11.289 2.624 339 HB VAL 64 HB VAL 64 -3.286 10.536 1.827 340 1HG1 VAL 64 1HG1 VAL 64 -3.120 8.332 0.884 341 2HG1 VAL 64 2HG1 VAL 64 -3.593 8.154 2.582 342 3HG1 VAL 64 3HG1 VAL 64 -4.785 7.934 1.291 343 1HG2 VAL 64 1HG2 VAL 64 -4.021 10.345 -0.438 344 2HG2 VAL 64 2HG2 VAL 64 -5.675 9.977 0.044 345 3HG2 VAL 64 3HG2 VAL 64 -4.981 11.573 0.392 346 H GLN 65 H GLN 65 -6.945 9.472 1.345 347 HA GLN 65 HA GLN 65 -7.550 7.039 2.865 348 1HB GLN 65 1HB GLN 65 -9.096 9.094 3.656 349 2HB GLN 65 2HB GLN 65 -9.891 8.819 2.118 350 1HG GLN 65 1HG GLN 65 -11.079 7.558 3.743 351 2HG GLN 65 2HG GLN 65 -10.168 6.374 2.804 352 1HE2 GLN 65 1HE2 GLN 65 -7.810 7.867 4.812 353 2HE2 GLN 65 2HE2 GLN 65 -8.002 6.793 6.169 354 H ILE 66 H ILE 66 -6.616 5.931 1.315 355 HA ILE 66 HA ILE 66 -7.987 6.050 -1.344 356 HB ILE 66 HB ILE 66 -5.974 5.137 -2.361 357 1HG1 ILE 66 1HG1 ILE 66 -3.847 6.015 -0.933 358 2HG1 ILE 66 2HG1 ILE 66 -4.805 5.385 0.389 359 1HG2 ILE 66 1HG2 ILE 66 -4.914 7.253 -2.622 360 2HG2 ILE 66 2HG2 ILE 66 -6.653 7.519 -2.453 361 3HG2 ILE 66 3HG2 ILE 66 -5.577 7.845 -1.081 362 1HD1 ILE 66 1HD1 ILE 66 -4.980 3.199 -0.908 363 2HD1 ILE 66 2HD1 ILE 66 -3.897 3.902 -2.122 364 3HD1 ILE 66 3HD1 ILE 66 -3.322 3.649 -0.462 365 H MET 67 H MET 67 -9.324 4.578 -1.576 366 HA MET 67 HA MET 67 -9.350 2.065 -0.065 367 1HB MET 67 1HB MET 67 -11.301 3.434 -1.927 368 2HB MET 67 2HB MET 67 -11.629 1.886 -1.145 369 1HG MET 67 1HG MET 67 -11.692 2.776 0.994 370 2HG MET 67 2HG MET 67 -10.795 4.235 0.580 371 1HE MET 67 1HE MET 67 -12.262 5.497 -1.909 372 2HE MET 67 2HE MET 67 -13.410 6.541 -1.050 373 3HE MET 67 3HE MET 67 -11.745 6.377 -0.449 374 H TYR 68 H TYR 68 -8.359 0.289 -0.783 375 HA TYR 68 HA TYR 68 -7.889 -0.145 -3.704 376 1HB TYR 68 1HB TYR 68 -7.027 -1.688 -1.234 377 2HB TYR 68 2HB TYR 68 -6.727 -2.188 -2.890 378 HD1 TYR 68 HD1 TYR 68 -5.127 -0.993 -4.345 379 HD2 TYR 68 HD2 TYR 68 -5.695 0.083 -0.218 380 HE1 TYR 68 HE1 TYR 68 -2.934 0.162 -4.350 381 HE2 TYR 68 HE2 TYR 68 -3.434 1.133 -0.195 382 HH TYR 68 HH TYR 68 -1.523 1.638 -3.100 383 H ARG 69 H ARG 69 -8.608 -2.111 -4.689 384 HA ARG 69 HA ARG 69 -10.839 -3.576 -3.409 385 1HB ARG 69 1HB ARG 69 -11.734 -1.748 -4.831 386 2HB ARG 69 2HB ARG 69 -10.866 -2.401 -6.216 387 1HG ARG 69 1HG ARG 69 -12.174 -4.527 -6.035 388 2HG ARG 69 2HG ARG 69 -13.081 -3.828 -4.692 389 1HD ARG 69 1HD ARG 69 -12.922 -2.829 -7.580 390 2HD ARG 69 2HD ARG 69 -14.332 -3.564 -6.848 391 HE ARG 69 HE ARG 69 -13.530 -0.820 -6.745 392 1HH1 ARG 69 1HH1 ARG 69 -15.376 -3.209 -4.830 393 2HH1 ARG 69 2HH1 ARG 69 -15.639 -2.099 -3.501 394 1HH2 ARG 69 1HH2 ARG 69 -14.085 0.673 -5.100 395 2HH2 ARG 69 2HH2 ARG 69 -14.877 0.123 -3.661 396 H ALA 70 H ALA 70 -10.766 -5.758 -3.905 397 HA ALA 70 HA ALA 70 -8.945 -6.801 -5.988 398 1HB ALA 70 1HB ALA 70 -7.925 -8.370 -4.470 399 2HB ALA 70 2HB ALA 70 -7.546 -6.699 -3.998 400 3HB ALA 70 3HB ALA 70 -8.758 -7.626 -3.089 401 H LYS 71 H LYS 71 -10.438 -7.877 -7.209 402 HA LYS 71 HA LYS 71 -12.522 -9.531 -5.813 403 1HB LYS 71 1HB LYS 71 -14.073 -8.569 -6.844 404 2HB LYS 71 2HB LYS 71 -12.912 -7.387 -7.426 405 1HG LYS 71 1HG LYS 71 -12.535 -8.952 -9.402 406 2HG LYS 71 2HG LYS 71 -13.787 -9.989 -8.678 407 1HD LYS 71 1HD LYS 71 -14.926 -8.660 -10.373 408 2HD LYS 71 2HD LYS 71 -15.401 -8.079 -8.775 409 1HE LYS 71 1HE LYS 71 -14.908 -5.999 -9.495 410 2HE LYS 71 2HE LYS 71 -13.214 -6.438 -9.311 411 1HZ LYS 71 1HZ LYS 71 -13.333 -5.649 -11.403 412 2HZ LYS 71 2HZ LYS 71 -13.248 -7.197 -11.639 413 3HZ LYS 71 3HZ LYS 71 -14.733 -6.463 -11.820 414 H ASN 72 H ASN 72 -12.717 -11.641 -6.029 415 HA ASN 72 HA ASN 72 -10.396 -12.821 -7.227 416 1HB ASN 72 1HB ASN 72 -11.134 -13.659 -5.101 417 2HB ASN 72 2HB ASN 72 -12.743 -14.046 -5.742 418 1HD2 ASN 72 1HD2 ASN 72 -11.844 -16.263 -4.590 419 2HD2 ASN 72 2HD2 ASN 72 -11.118 -17.358 -5.753 420 H LEU 73 H LEU 73 -10.090 -13.401 -9.281 421 HA LEU 73 HA LEU 73 -12.450 -14.152 -10.959 422 1HB LEU 73 1HB LEU 73 -9.721 -13.095 -11.781 423 2HB LEU 73 2HB LEU 73 -11.080 -13.455 -12.849 424 HG LEU 73 HG LEU 73 -10.943 -11.228 -10.773 425 1HD1 LEU 73 1HD1 LEU 73 -9.616 -10.831 -12.799 426 2HD1 LEU 73 2HD1 LEU 73 -11.016 -11.227 -13.820 427 3HD1 LEU 73 3HD1 LEU 73 -11.047 -9.786 -12.791 428 1HD2 LEU 73 1HD2 LEU 73 -13.122 -10.487 -11.760 429 2HD2 LEU 73 2HD2 LEU 73 -13.215 -12.020 -12.653 430 3HD2 LEU 73 3HD2 LEU 73 -13.267 -12.008 -10.874 431 H ALA 74 H ALA 74 -11.224 -16.042 -9.143 432 HA ALA 74 HA ALA 74 -10.167 -18.005 -11.152 433 1HB ALA 74 1HB ALA 74 -9.934 -18.047 -8.114 434 2HB ALA 74 2HB ALA 74 -9.268 -19.242 -9.246 435 3HB ALA 74 3HB ALA 74 -8.657 -17.584 -9.261 436 H SER 75 H SER 75 -10.859 -20.310 -10.483 437 HA SER 75 HA SER 75 -13.797 -20.414 -10.370 438 1HB SER 75 1HB SER 75 -13.139 -22.882 -10.845 439 2HB SER 75 2HB SER 75 -12.800 -21.669 -12.090 440 HG SER 75 HG SER 75 -10.958 -23.054 -11.583 441 H THR 76 H THR 76 -11.304 -20.395 -8.075 442 HA THR 76 HA THR 76 -12.770 -22.106 -6.172 443 HB THR 76 HB THR 76 -10.265 -22.887 -5.638 444 HG1 THR 76 HG1 THR 76 -10.141 -22.419 -8.429 445 1HG2 THR 76 1HG2 THR 76 -12.096 -24.425 -6.305 446 2HG2 THR 76 2HG2 THR 76 -11.811 -24.031 -8.012 447 3HG2 THR 76 3HG2 THR 76 -10.559 -24.865 -7.069 448 HA PRO 77 HA PRO 77 -11.651 -18.950 -3.405 449 1HB PRO 77 1HB PRO 77 -11.198 -20.222 -0.995 450 2HB PRO 77 2HB PRO 77 -12.812 -20.059 -1.729 451 1HG PRO 77 1HG PRO 77 -10.946 -22.429 -1.908 452 2HG PRO 77 2HG PRO 77 -12.690 -22.427 -1.517 453 1HD PRO 77 1HD PRO 77 -11.808 -22.974 -4.014 454 2HD PRO 77 2HD PRO 77 -13.281 -22.001 -3.770 455 H THR 78 H THR 78 -9.598 -17.918 -3.815 456 HA THR 78 HA THR 78 -7.164 -19.546 -3.528 457 HB THR 78 HB THR 78 -6.698 -16.665 -3.760 458 HG1 THR 78 HG1 THR 78 -7.386 -16.548 -5.868 459 1HG2 THR 78 1HG2 THR 78 -5.222 -17.389 -5.505 460 2HG2 THR 78 2HG2 THR 78 -5.109 -18.601 -4.241 461 3HG2 THR 78 3HG2 THR 78 -6.084 -18.932 -5.693 462 H THR 79 H THR 79 -5.320 -18.235 -2.277 463 HA THR 79 HA THR 79 -6.345 -17.006 0.189 464 HB THR 79 HB THR 79 -5.668 -19.214 0.872 465 HG1 THR 79 HG1 THR 79 -4.125 -18.570 2.363 466 1HG2 THR 79 1HG2 THR 79 -3.385 -20.075 0.597 467 2HG2 THR 79 2HG2 THR 79 -4.140 -19.848 -0.985 468 3HG2 THR 79 3HG2 THR 79 -2.941 -18.676 -0.394 469 H GLY 80 H GLY 80 -5.324 -15.095 0.540 470 1HA GLY 80 1HA GLY 80 -3.108 -14.238 -1.264 471 2HA GLY 80 2HA GLY 80 -4.374 -13.190 -0.630 472 H GLN 81 H GLN 81 -1.240 -14.116 -0.226 473 HA GLN 81 HA GLN 81 -1.097 -13.013 2.511 474 1HB GLN 81 1HB GLN 81 0.801 -14.693 2.985 475 2HB GLN 81 2HB GLN 81 -0.874 -15.187 3.127 476 1HG GLN 81 1HG GLN 81 0.118 -17.008 2.210 477 2HG GLN 81 2HG GLN 81 -0.720 -16.300 0.850 478 1HE2 GLN 81 1HE2 GLN 81 1.149 -14.457 -0.187 479 2HE2 GLN 81 2HE2 GLN 81 2.489 -15.392 -0.779 480 H ALA 82 H ALA 82 -0.968 -11.461 0.438 481 HA ALA 82 HA ALA 82 1.358 -11.339 -1.111 482 1HB ALA 82 1HB ALA 82 -0.356 -9.058 -0.019 483 2HB ALA 82 2HB ALA 82 0.744 -8.985 -1.414 484 3HB ALA 82 3HB ALA 82 -0.717 -10.022 -1.465 485 H THR 83 H THR 83 3.335 -10.180 -0.912 486 HA THR 83 HA THR 83 4.013 -9.363 1.882 487 HB THR 83 HB THR 83 5.618 -10.899 0.752 488 HG1 THR 83 HG1 THR 83 6.335 -9.763 2.458 489 1HG2 THR 83 1HG2 THR 83 5.581 -9.794 -1.514 490 2HG2 THR 83 2HG2 THR 83 6.417 -8.395 -0.772 491 3HG2 THR 83 3HG2 THR 83 7.207 -9.980 -0.819 492 H PHE 84 H PHE 84 5.561 -7.338 1.674 493 HA PHE 84 HA PHE 84 4.129 -5.174 0.281 494 1HB PHE 84 1HB PHE 84 3.128 -4.246 2.193 495 2HB PHE 84 2HB PHE 84 2.553 -5.893 2.038 496 HD1 PHE 84 HD1 PHE 84 4.401 -7.603 3.510 497 HD2 PHE 84 HD2 PHE 84 3.099 -3.597 4.425 498 HE1 PHE 84 HE1 PHE 84 5.771 -7.619 5.542 499 HE2 PHE 84 HE2 PHE 84 4.279 -3.718 6.583 500 HZ PHE 84 HZ PHE 84 5.651 -5.714 7.150 501 H ASN 85 H ASN 85 6.128 -4.552 -0.512 502 HA ASN 85 HA ASN 85 8.387 -4.042 1.338 503 1HB ASN 85 1HB ASN 85 9.025 -4.750 -0.838 504 2HB ASN 85 2HB ASN 85 7.891 -3.609 -1.571 505 1HD2 ASN 85 1HD2 ASN 85 8.842 -1.754 -2.393 506 2HD2 ASN 85 2HD2 ASN 85 10.166 -0.900 -1.622 507 H VAL 86 H VAL 86 7.409 -2.620 2.793 508 HA VAL 86 HA VAL 86 6.081 -0.199 1.938 509 HB VAL 86 HB VAL 86 7.137 -0.837 4.725 510 1HG1 VAL 86 1HG1 VAL 86 5.143 0.451 5.439 511 2HG1 VAL 86 2HG1 VAL 86 6.206 1.419 4.428 512 3HG1 VAL 86 3HG1 VAL 86 4.720 0.734 3.735 513 1HG2 VAL 86 1HG2 VAL 86 5.939 -2.798 4.238 514 2HG2 VAL 86 2HG2 VAL 86 4.802 -1.778 5.105 515 3HG2 VAL 86 3HG2 VAL 86 4.670 -1.926 3.340 516 H THR 87 H THR 87 8.244 0.248 0.472 517 HA THR 87 HA THR 87 9.286 2.620 1.531 518 HB THR 87 HB THR 87 10.614 1.232 3.031 519 HG1 THR 87 HG1 THR 87 12.724 1.959 2.327 520 1HG2 THR 87 1HG2 THR 87 10.711 -0.790 1.707 521 2HG2 THR 87 2HG2 THR 87 11.813 -0.013 0.549 522 3HG2 THR 87 3HG2 THR 87 12.329 -0.287 2.227 523 HA PRO 88 HA PRO 88 10.786 2.998 -2.740 524 1HB PRO 88 1HB PRO 88 12.706 4.963 -2.225 525 2HB PRO 88 2HB PRO 88 11.020 5.242 -2.702 526 1HG PRO 88 1HG PRO 88 12.224 5.486 0.002 527 2HG PRO 88 2HG PRO 88 10.833 6.339 -0.690 528 1HD PRO 88 1HD PRO 88 10.691 4.250 1.125 529 2HD PRO 88 2HD PRO 88 9.384 4.690 0.020 530 H MET 89 H MET 89 12.878 3.116 0.110 531 HA MET 89 HA MET 89 14.242 0.783 -0.158 532 1HB MET 89 1HB MET 89 16.595 1.844 -0.823 533 2HB MET 89 2HB MET 89 15.534 1.089 -1.995 534 1HG MET 89 1HG MET 89 14.864 3.101 -2.956 535 2HG MET 89 2HG MET 89 15.433 4.097 -1.619 536 1HE MET 89 1HE MET 89 16.170 5.436 -4.011 537 2HE MET 89 2HE MET 89 17.478 4.817 -5.046 538 3HE MET 89 3HE MET 89 15.892 4.015 -5.044 539 H ALA 90 H ALA 90 15.943 3.858 0.275 540 HA ALA 90 HA ALA 90 17.034 3.231 2.712 541 1HB ALA 90 1HB ALA 90 16.342 6.064 1.889 542 2HB ALA 90 2HB ALA 90 17.721 5.508 2.840 543 3HB ALA 90 3HB ALA 90 17.651 5.136 1.102 544 H ALA 91 H ALA 91 13.811 4.658 2.177 545 HA ALA 91 HA ALA 91 13.742 5.843 4.845 546 1HB ALA 91 1HB ALA 91 11.554 6.683 4.085 547 2HB ALA 91 2HB ALA 91 12.868 6.999 2.923 548 3HB ALA 91 3HB ALA 91 11.702 5.722 2.587 549 H GLY 92 H GLY 92 10.732 4.459 3.915 550 1HA GLY 92 1HA GLY 92 9.485 2.788 4.799 551 2HA GLY 92 2HA GLY 92 10.968 1.943 5.259 552 H ALA 93 H ALA 93 12.094 3.542 7.198 553 HA ALA 93 HA ALA 93 10.522 3.336 9.534 554 1HB ALA 93 1HB ALA 93 12.146 4.954 10.504 555 2HB ALA 93 2HB ALA 93 12.950 3.662 9.592 556 3HB ALA 93 3HB ALA 93 12.791 5.279 8.881 557 H TYR 94 H TYR 94 11.247 6.271 7.628 558 HA TYR 94 HA TYR 94 9.059 7.813 8.715 559 1HB TYR 94 1HB TYR 94 10.589 8.499 6.214 560 2HB TYR 94 2HB TYR 94 9.909 9.568 7.435 561 HD1 TYR 94 HD1 TYR 94 12.887 8.093 6.199 562 HD2 TYR 94 HD2 TYR 94 10.959 8.985 9.941 563 HE1 TYR 94 HE1 TYR 94 15.032 7.732 7.393 564 HE2 TYR 94 HE2 TYR 94 13.115 8.682 11.119 565 HH TYR 94 HH TYR 94 16.104 7.618 9.462 566 H PHE 95 H PHE 95 7.812 5.572 7.935 567 HA PHE 95 HA PHE 95 6.126 6.445 5.644 568 1HB PHE 95 1HB PHE 95 7.524 4.320 5.060 569 2HB PHE 95 2HB PHE 95 6.761 3.554 6.434 570 HD1 PHE 95 HD1 PHE 95 4.237 3.259 6.550 571 HD2 PHE 95 HD2 PHE 95 6.458 3.958 2.931 572 HE1 PHE 95 HE1 PHE 95 2.217 2.761 5.218 573 HE2 PHE 95 HE2 PHE 95 4.472 3.358 1.606 574 HZ PHE 95 HZ PHE 95 2.294 2.903 2.750 575 H ASN 96 H ASN 96 4.010 6.756 6.444 576 HA ASN 96 HA ASN 96 3.272 4.878 8.600 577 1HB ASN 96 1HB ASN 96 3.283 7.865 8.804 578 2HB ASN 96 2HB ASN 96 2.093 6.898 9.706 579 1HD2 ASN 96 1HD2 ASN 96 5.511 7.772 9.510 580 2HD2 ASN 96 2HD2 ASN 96 6.032 6.808 10.879 581 H LYS 97 H LYS 97 1.914 3.667 7.738 582 HA LYS 97 HA LYS 97 -0.753 4.760 6.997 583 1HB LYS 97 1HB LYS 97 -0.106 2.858 5.633 584 2HB LYS 97 2HB LYS 97 0.378 1.923 7.051 585 1HG LYS 97 1HG LYS 97 -2.093 2.030 7.793 586 2HG LYS 97 2HG LYS 97 -2.438 2.749 6.229 587 1HD LYS 97 1HD LYS 97 -1.520 0.755 5.086 588 2HD LYS 97 2HD LYS 97 -1.103 0.035 6.655 589 1HE LYS 97 1HE LYS 97 -3.496 0.006 7.312 590 2HE LYS 97 2HE LYS 97 -3.943 0.775 5.785 591 1HZ LYS 97 1HZ LYS 97 -4.316 -1.567 5.704 592 2HZ LYS 97 2HZ LYS 97 -3.132 -1.193 4.639 593 3HZ LYS 97 3HZ LYS 97 -2.759 -1.918 6.069 594 H VAL 98 H VAL 98 0.297 2.026 9.078 595 HA VAL 98 HA VAL 98 -0.485 3.375 11.546 596 HB VAL 98 HB VAL 98 -2.627 2.670 10.603 597 1HG1 VAL 98 1HG1 VAL 98 -1.711 0.532 9.421 598 2HG1 VAL 98 2HG1 VAL 98 -1.941 -0.257 10.986 599 3HG1 VAL 98 3HG1 VAL 98 -3.318 0.486 10.174 600 1HG2 VAL 98 1HG2 VAL 98 -3.517 1.612 12.567 601 2HG2 VAL 98 2HG2 VAL 98 -1.920 1.020 13.056 602 3HG2 VAL 98 3HG2 VAL 98 -2.262 2.763 13.054 603 H GLN 99 H GLN 99 1.887 2.982 11.329 604 HA GLN 99 HA GLN 99 3.815 1.943 11.874 605 1HB GLN 99 1HB GLN 99 2.151 -0.212 13.281 606 2HB GLN 99 2HB GLN 99 3.887 -0.025 13.339 607 1HG GLN 99 1HG GLN 99 3.023 0.861 15.354 608 2HG GLN 99 2HG GLN 99 3.690 2.183 14.395 609 1HE2 GLN 99 1HE2 GLN 99 0.451 0.507 14.448 610 2HE2 GLN 99 2HE2 GLN 99 -0.454 1.975 14.734 611 H CYS 100 H CYS 100 5.021 -0.278 11.475 612 HA CYS 100 HA CYS 100 4.336 -1.133 8.751 613 1HB CYS 100 1HB CYS 100 6.662 -0.677 9.403 614 2HB CYS 100 2HB CYS 100 6.611 -2.011 10.578 615 HG CYS 100 HG CYS 100 6.135 -3.893 8.919 616 H PHE 101 H PHE 101 2.175 -1.803 10.024 617 HA PHE 101 HA PHE 101 2.350 -4.506 11.214 618 1HB PHE 101 1HB PHE 101 0.798 -2.827 12.140 619 2HB PHE 101 2HB PHE 101 -0.050 -2.753 10.601 620 HD1 PHE 101 HD1 PHE 101 -1.766 -4.359 10.090 621 HD2 PHE 101 HD2 PHE 101 0.965 -5.133 13.338 622 HE1 PHE 101 HE1 PHE 101 -3.091 -6.349 10.737 623 HE2 PHE 101 HE2 PHE 101 -0.342 -7.149 13.948 624 HZ PHE 101 HZ PHE 101 -2.374 -7.757 12.653 625 H CYS 102 H CYS 102 2.807 -6.064 9.721 626 HA CYS 102 HA CYS 102 1.938 -6.025 6.983 627 1HB CYS 102 1HB CYS 102 2.758 -8.231 6.829 628 2HB CYS 102 2HB CYS 102 3.842 -7.453 8.001 629 HG CYS 102 HG CYS 102 3.334 -9.937 8.668 630 H PHE 103 H PHE 103 0.258 -7.441 6.014 631 HA PHE 103 HA PHE 103 -1.651 -8.731 7.718 632 1HB PHE 103 1HB PHE 103 -3.600 -7.438 7.070 633 2HB PHE 103 2HB PHE 103 -2.474 -6.420 7.948 634 HD1 PHE 103 HD1 PHE 103 -1.053 -4.738 6.673 635 HD2 PHE 103 HD2 PHE 103 -4.164 -7.008 4.732 636 HE1 PHE 103 HE1 PHE 103 -0.920 -3.256 4.706 637 HE2 PHE 103 HE2 PHE 103 -4.078 -5.482 2.804 638 HZ PHE 103 HZ PHE 103 -2.520 -3.582 2.782 639 H THR 104 H THR 104 -3.246 -9.872 6.328 640 HA THR 104 HA THR 104 -2.280 -10.427 3.562 641 HB THR 104 HB THR 104 -2.458 -12.861 4.290 642 HG1 THR 104 HG1 THR 104 -3.673 -12.260 6.214 643 1HG2 THR 104 1HG2 THR 104 -0.219 -11.609 4.178 644 2HG2 THR 104 2HG2 THR 104 -0.372 -11.333 5.923 645 3HG2 THR 104 3HG2 THR 104 -0.260 -12.987 5.300 646 H GLU 105 H GLU 105 -4.080 -10.402 2.267 647 HA GLU 105 HA GLU 105 -6.651 -10.019 3.429 648 1HB GLU 105 1HB GLU 105 -5.831 -10.350 0.513 649 2HB GLU 105 2HB GLU 105 -7.332 -9.660 1.135 650 1HG GLU 105 1HG GLU 105 -6.134 -7.753 0.685 651 2HG GLU 105 2HG GLU 105 -5.783 -7.957 2.401 652 H THR 106 H THR 106 -5.954 -12.514 4.274 653 HA THR 106 HA THR 106 -6.620 -14.737 4.337 654 HB THR 106 HB THR 106 -8.045 -13.419 5.714 655 HG1 THR 106 HG1 THR 106 -9.789 -14.794 5.823 656 1HG2 THR 106 1HG2 THR 106 -8.999 -11.755 4.249 657 2HG2 THR 106 2HG2 THR 106 -9.860 -12.983 3.303 658 3HG2 THR 106 3HG2 THR 106 -10.314 -12.670 4.987 659 H THR 107 H THR 107 -9.515 -15.115 3.194 660 HA THR 107 HA THR 107 -8.708 -16.129 0.528 661 HB THR 107 HB THR 107 -8.670 -17.937 2.064 662 HG1 THR 107 HG1 THR 107 -9.492 -18.609 0.159 663 1HG2 THR 107 1HG2 THR 107 -10.050 -17.104 3.826 664 2HG2 THR 107 2HG2 THR 107 -11.476 -17.060 2.760 665 3HG2 THR 107 3HG2 THR 107 -10.764 -18.622 3.240 666 H LEU 108 H LEU 108 -10.448 -16.284 -0.998 667 HA LEU 108 HA LEU 108 -12.941 -14.774 -0.435 668 1HB LEU 108 1HB LEU 108 -11.002 -14.299 -2.748 669 2HB LEU 108 2HB LEU 108 -12.673 -13.748 -2.769 670 HG LEU 108 HG LEU 108 -10.600 -12.875 -0.733 671 1HD1 LEU 108 1HD1 LEU 108 -10.266 -10.945 -1.980 672 2HD1 LEU 108 2HD1 LEU 108 -10.339 -12.169 -3.238 673 3HD1 LEU 108 3HD1 LEU 108 -11.754 -11.150 -2.944 674 1HD2 LEU 108 1HD2 LEU 108 -12.840 -12.674 0.210 675 2HD2 LEU 108 2HD2 LEU 108 -12.345 -11.065 -0.318 676 3HD2 LEU 108 3HD2 LEU 108 -13.469 -12.001 -1.312 677 H GLU 109 H GLU 109 -14.547 -16.146 -1.054 678 HA GLU 109 HA GLU 109 -14.079 -18.459 -2.628 679 1HB GLU 109 1HB GLU 109 -16.630 -16.981 -1.845 680 2HB GLU 109 2HB GLU 109 -16.627 -18.530 -2.660 681 1HG GLU 109 1HG GLU 109 -15.120 -19.410 -0.783 682 2HG GLU 109 2HG GLU 109 -15.466 -17.903 0.083 683 HA PRO 110 HA PRO 110 -13.674 -17.060 -6.644 684 1HB PRO 110 1HB PRO 110 -14.911 -18.922 -8.220 685 2HB PRO 110 2HB PRO 110 -13.489 -19.210 -7.195 686 1HG PRO 110 1HG PRO 110 -16.387 -19.750 -6.474 687 2HG PRO 110 2HG PRO 110 -15.036 -20.922 -6.425 688 1HD PRO 110 1HD PRO 110 -15.754 -19.574 -4.208 689 2HD PRO 110 2HD PRO 110 -14.028 -19.784 -4.576 690 H GLY 111 H GLY 111 -14.634 -15.060 -6.603 691 1HA GLY 111 1HA GLY 111 -16.341 -13.961 -8.256 692 2HA GLY 111 2HA GLY 111 -17.526 -14.772 -7.213 693 H GLU 112 H GLU 112 -15.588 -14.385 -4.821 694 HA GLU 112 HA GLU 112 -17.086 -12.098 -4.071 695 1HB GLU 112 1HB GLU 112 -15.004 -13.674 -2.508 696 2HB GLU 112 2HB GLU 112 -16.205 -12.556 -1.842 697 1HG GLU 112 1HG GLU 112 -16.788 -15.161 -3.182 698 2HG GLU 112 2HG GLU 112 -17.055 -14.687 -1.499 699 H GLU 113 H GLU 113 -16.290 -10.188 -3.001 700 HA GLU 113 HA GLU 113 -13.797 -9.168 -4.238 701 1HB GLU 113 1HB GLU 113 -15.885 -8.288 -5.300 702 2HB GLU 113 2HB GLU 113 -16.311 -7.555 -3.734 703 1HG GLU 113 1HG GLU 113 -14.606 -6.135 -3.740 704 2HG GLU 113 2HG GLU 113 -13.711 -6.977 -5.019 705 H MET 114 H MET 114 -12.367 -8.167 -3.036 706 HA MET 114 HA MET 114 -12.858 -7.649 -0.197 707 1HB MET 114 1HB MET 114 -10.708 -8.888 -1.691 708 2HB MET 114 2HB MET 114 -10.106 -7.316 -1.196 709 1HG MET 114 1HG MET 114 -11.438 -9.328 0.648 710 2HG MET 114 2HG MET 114 -9.699 -9.100 0.501 711 1HE MET 114 1HE MET 114 -11.623 -7.635 3.932 712 2HE MET 114 2HE MET 114 -12.506 -8.604 2.732 713 3HE MET 114 3HE MET 114 -10.900 -9.136 3.298 714 H GLU 115 H GLU 115 -12.579 -5.579 0.469 715 HA GLU 115 HA GLU 115 -11.534 -3.491 -1.269 716 1HB GLU 115 1HB GLU 115 -13.876 -3.437 -1.900 717 2HB GLU 115 2HB GLU 115 -14.398 -3.397 -0.210 718 1HG GLU 115 1HG GLU 115 -13.512 -1.165 0.106 719 2HG GLU 115 2HG GLU 115 -12.652 -1.231 -1.445 720 H MET 116 H MET 116 -10.382 -2.030 -0.009 721 HA MET 116 HA MET 116 -10.982 -1.887 2.867 722 1HB MET 116 1HB MET 116 -8.231 -2.763 1.886 723 2HB MET 116 2HB MET 116 -8.645 -2.283 3.536 724 1HG MET 116 1HG MET 116 -10.357 -4.181 3.548 725 2HG MET 116 2HG MET 116 -9.663 -4.681 1.998 726 1HE MET 116 1HE MET 116 -7.531 -4.973 6.080 727 2HE MET 116 2HE MET 116 -7.837 -3.389 5.341 728 3HE MET 116 3HE MET 116 -9.203 -4.415 5.848 729 HA PRO 117 HA PRO 117 -9.365 2.285 1.989 730 1HB PRO 117 1HB PRO 117 -9.583 3.383 4.417 731 2HB PRO 117 2HB PRO 117 -11.030 3.026 3.429 732 1HG PRO 117 1HG PRO 117 -9.848 1.352 5.660 733 2HG PRO 117 2HG PRO 117 -11.543 1.856 5.414 734 1HD PRO 117 1HD PRO 117 -10.555 -0.594 4.631 735 2HD PRO 117 2HD PRO 117 -11.869 0.228 3.731 736 H VAL 118 H VAL 118 -7.354 3.124 2.175 737 HA VAL 118 HA VAL 118 -5.568 2.213 4.365 738 HB VAL 118 HB VAL 118 -4.893 2.457 1.413 739 1HG1 VAL 118 1HG1 VAL 118 -3.010 2.272 3.799 740 2HG1 VAL 118 2HG1 VAL 118 -2.535 1.988 2.113 741 3HG1 VAL 118 3HG1 VAL 118 -3.098 3.587 2.607 742 1HG2 VAL 118 1HG2 VAL 118 -5.766 0.262 2.112 743 2HG2 VAL 118 2HG2 VAL 118 -4.024 0.124 1.823 744 3HG2 VAL 118 3HG2 VAL 118 -4.642 0.219 3.477 745 H VAL 119 H VAL 119 -4.960 3.823 5.530 746 HA VAL 119 HA VAL 119 -5.074 6.614 4.583 747 HB VAL 119 HB VAL 119 -6.098 6.162 6.717 748 1HG1 VAL 119 1HG1 VAL 119 -4.768 5.443 8.694 749 2HG1 VAL 119 2HG1 VAL 119 -4.891 4.158 7.496 750 3HG1 VAL 119 3HG1 VAL 119 -3.386 5.095 7.650 751 1HG2 VAL 119 1HG2 VAL 119 -3.460 7.602 7.223 752 2HG2 VAL 119 2HG2 VAL 119 -4.864 8.322 6.405 753 3HG2 VAL 119 3HG2 VAL 119 -4.988 7.809 8.094 754 H PHE 120 H PHE 120 -3.094 7.891 4.708 755 HA PHE 120 HA PHE 120 -0.541 6.489 4.976 756 1HB PHE 120 1HB PHE 120 -1.589 5.994 2.636 757 2HB PHE 120 2HB PHE 120 -1.303 7.691 2.286 758 HD1 PHE 120 HD1 PHE 120 1.238 8.522 2.779 759 HD2 PHE 120 HD2 PHE 120 -0.010 4.501 1.860 760 HE1 PHE 120 HE1 PHE 120 3.540 7.940 2.122 761 HE2 PHE 120 HE2 PHE 120 2.148 4.149 0.664 762 HZ PHE 120 HZ PHE 120 3.972 5.810 0.930 763 H PHE 121 H PHE 121 0.829 8.146 5.906 764 HA PHE 121 HA PHE 121 0.993 10.484 4.147 765 1HB PHE 121 1HB PHE 121 1.469 11.881 6.193 766 2HB PHE 121 2HB PHE 121 -0.213 11.436 5.893 767 HD1 PHE 121 HD1 PHE 121 -1.365 9.791 7.272 768 HD2 PHE 121 HD2 PHE 121 2.704 10.890 8.131 769 HE1 PHE 121 HE1 PHE 121 -1.500 8.579 9.445 770 HE2 PHE 121 HE2 PHE 121 2.575 9.701 10.256 771 HZ PHE 121 HZ PHE 121 0.459 8.545 10.951 772 H VAL 122 H VAL 122 3.093 11.473 4.231 773 HA VAL 122 HA VAL 122 5.315 9.688 5.134 774 HB VAL 122 HB VAL 122 5.392 12.114 3.310 775 1HG1 VAL 122 1HG1 VAL 122 7.632 11.209 2.684 776 2HG1 VAL 122 2HG1 VAL 122 7.542 11.666 4.389 777 3HG1 VAL 122 3HG1 VAL 122 7.453 9.957 3.930 778 1HG2 VAL 122 1HG2 VAL 122 4.087 10.415 2.176 779 2HG2 VAL 122 2HG2 VAL 122 5.684 10.554 1.432 780 3HG2 VAL 122 3HG2 VAL 122 5.335 9.199 2.526 781 H ASP 123 H ASP 123 6.053 10.261 7.177 782 HA ASP 123 HA ASP 123 5.479 12.758 8.353 783 1HB ASP 123 1HB ASP 123 7.703 10.919 9.268 784 2HB ASP 123 2HB ASP 123 6.620 11.929 10.242 785 HA PRO 124 HA PRO 124 8.876 15.003 6.471 786 1HB PRO 124 1HB PRO 124 8.936 17.312 7.991 787 2HB PRO 124 2HB PRO 124 7.675 16.822 6.848 788 1HG PRO 124 1HG PRO 124 7.614 16.547 9.860 789 2HG PRO 124 2HG PRO 124 6.326 17.126 8.760 790 1HD PRO 124 1HD PRO 124 6.497 14.544 9.731 791 2HD PRO 124 2HD PRO 124 5.692 14.995 8.195 792 H GLU 125 H GLU 125 9.624 12.959 8.486 793 HA GLU 125 HA GLU 125 12.140 14.034 9.638 794 1HB GLU 125 1HB GLU 125 10.857 11.295 9.744 795 2HB GLU 125 2HB GLU 125 12.383 11.770 10.525 796 1HG GLU 125 1HG GLU 125 9.612 12.820 11.144 797 2HG GLU 125 2HG GLU 125 10.683 11.855 12.172 798 H ILE 126 H ILE 126 10.868 12.280 6.822 799 HA ILE 126 HA ILE 126 13.167 10.920 6.148 800 HB ILE 126 HB ILE 126 10.919 10.694 5.153 801 1HG1 ILE 126 1HG1 ILE 126 13.156 11.019 3.104 802 2HG1 ILE 126 2HG1 ILE 126 13.059 9.695 4.271 803 1HG2 ILE 126 1HG2 ILE 126 11.690 12.926 3.239 804 2HG2 ILE 126 2HG2 ILE 126 10.160 12.046 3.326 805 3HG2 ILE 126 3HG2 ILE 126 10.582 13.175 4.615 806 1HD1 ILE 126 1HD1 ILE 126 12.126 8.927 2.238 807 2HD1 ILE 126 2HD1 ILE 126 10.840 9.081 3.458 808 3HD1 ILE 126 3HD1 ILE 126 10.986 10.285 2.148 809 H VAL 127 H VAL 127 12.407 14.338 5.341 810 HA VAL 127 HA VAL 127 15.033 14.675 4.032 811 HB VAL 127 HB VAL 127 14.319 17.069 3.872 812 1HG1 VAL 127 1HG1 VAL 127 12.775 16.662 2.038 813 2HG1 VAL 127 2HG1 VAL 127 14.085 15.466 2.032 814 3HG1 VAL 127 3HG1 VAL 127 12.469 15.014 2.617 815 1HG2 VAL 127 1HG2 VAL 127 12.619 17.057 5.753 816 2HG2 VAL 127 2HG2 VAL 127 12.018 17.696 4.218 817 3HG2 VAL 127 3HG2 VAL 127 11.561 16.069 4.726 818 H LYS 128 H LYS 128 15.706 13.665 6.301 819 HA LYS 128 HA LYS 128 17.064 15.932 7.586 820 1HB LYS 128 1HB LYS 128 15.535 13.976 9.333 821 2HB LYS 128 2HB LYS 128 16.742 15.148 9.857 822 1HG LYS 128 1HG LYS 128 15.251 16.947 8.849 823 2HG LYS 128 2HG LYS 128 14.027 15.684 8.587 824 1HD LYS 128 1HD LYS 128 14.083 15.167 11.057 825 2HD LYS 128 2HD LYS 128 15.307 16.418 11.259 826 1HE LYS 128 1HE LYS 128 13.365 17.501 11.930 827 2HE LYS 128 2HE LYS 128 13.598 18.090 10.276 828 1HZ LYS 128 1HZ LYS 128 11.314 17.475 10.692 829 2HZ LYS 128 2HZ LYS 128 11.890 16.393 9.613 830 3HZ LYS 128 3HZ LYS 128 11.708 15.990 11.189 831 HA PRO 129 HA PRO 129 19.807 12.433 8.764 832 1HB PRO 129 1HB PRO 129 19.310 9.768 8.517 833 2HB PRO 129 2HB PRO 129 18.572 10.753 9.813 834 1HG PRO 129 1HG PRO 129 17.358 10.061 7.114 835 2HG PRO 129 2HG PRO 129 16.647 9.798 8.725 836 1HD PRO 129 1HD PRO 129 15.997 11.978 7.335 837 2HD PRO 129 2HD PRO 129 16.323 12.060 9.095 838 H VAL 130 H VAL 130 21.583 11.360 7.823 839 HA VAL 130 HA VAL 130 22.134 11.758 5.113 840 HB VAL 130 HB VAL 130 23.396 9.911 7.183 841 1HG1 VAL 130 1HG1 VAL 130 24.129 9.224 4.962 842 2HG1 VAL 130 2HG1 VAL 130 24.453 10.917 4.513 843 3HG1 VAL 130 3HG1 VAL 130 25.434 10.111 5.759 844 1HG2 VAL 130 1HG2 VAL 130 23.417 12.302 7.872 845 2HG2 VAL 130 2HG2 VAL 130 25.037 11.768 7.420 846 3HG2 VAL 130 3HG2 VAL 130 24.088 12.753 6.291 847 H GLU 131 H GLU 131 20.788 8.986 6.818 848 HA GLU 131 HA GLU 131 20.850 6.817 5.157 849 1HB GLU 131 1HB GLU 131 18.386 8.027 6.492 850 2HB GLU 131 2HB GLU 131 18.540 6.350 5.973 851 1HG GLU 131 1HG GLU 131 20.254 5.930 7.648 852 2HG GLU 131 2HG GLU 131 20.258 7.618 8.168 853 H THR 132 H THR 132 18.489 9.489 4.834 854 HA THR 132 HA THR 132 17.489 8.209 2.408 855 HB THR 132 HB THR 132 15.610 9.963 3.000 856 HG1 THR 132 HG1 THR 132 15.886 10.955 4.937 857 1HG2 THR 132 1HG2 THR 132 16.406 7.728 4.948 858 2HG2 THR 132 2HG2 THR 132 14.844 8.542 4.948 859 3HG2 THR 132 3HG2 THR 132 15.336 7.580 3.541 860 H GLN 133 H GLN 133 18.279 11.378 3.677 861 HA GLN 133 HA GLN 133 18.446 13.428 2.567 862 1HB GLN 133 1HB GLN 133 20.610 12.089 3.440 863 2HB GLN 133 2HB GLN 133 21.073 12.153 1.774 864 1HG GLN 133 1HG GLN 133 22.052 14.028 2.909 865 2HG GLN 133 2HG GLN 133 20.825 14.648 1.799 866 1HE2 GLN 133 1HE2 GLN 133 19.638 13.148 4.806 867 2HE2 GLN 133 2HE2 GLN 133 19.385 14.629 5.667 868 H GLY 134 H GLY 134 16.797 12.526 0.739 869 1HA GLY 134 1HA GLY 134 17.120 13.634 -1.713 870 2HA GLY 134 2HA GLY 134 18.123 12.179 -1.869 871 H ILE 135 H ILE 135 16.633 10.384 -0.232 872 HA ILE 135 HA ILE 135 14.484 9.547 -1.958 873 HB ILE 135 HB ILE 135 14.909 8.947 0.984 874 1HG1 ILE 135 1HG1 ILE 135 16.802 7.998 -0.098 875 2HG1 ILE 135 2HG1 ILE 135 15.588 6.704 0.025 876 1HG2 ILE 135 1HG2 ILE 135 13.428 7.113 0.675 877 2HG2 ILE 135 2HG2 ILE 135 12.549 8.546 0.152 878 3HG2 ILE 135 3HG2 ILE 135 13.208 7.459 -1.059 879 1HD1 ILE 135 1HD1 ILE 135 16.200 8.230 -2.499 880 2HD1 ILE 135 2HD1 ILE 135 16.673 6.575 -2.070 881 3HD1 ILE 135 3HD1 ILE 135 14.954 6.964 -2.285 882 H LYS 136 H LYS 136 12.635 10.619 -2.274 883 HA LYS 136 HA LYS 136 11.172 11.754 -0.027 884 1HB LYS 136 1HB LYS 136 11.136 14.029 -0.827 885 2HB LYS 136 2HB LYS 136 12.772 13.511 -0.510 886 1HG LYS 136 1HG LYS 136 13.379 14.037 -2.539 887 2HG LYS 136 2HG LYS 136 12.405 12.745 -3.193 888 1HD LYS 136 1HD LYS 136 10.526 14.810 -2.708 889 2HD LYS 136 2HD LYS 136 11.965 15.671 -3.234 890 1HE LYS 136 1HE LYS 136 10.605 15.246 -5.153 891 2HE LYS 136 2HE LYS 136 12.009 14.181 -5.314 892 1HZ LYS 136 1HZ LYS 136 9.605 13.286 -5.665 893 2HZ LYS 136 2HZ LYS 136 10.627 12.314 -4.834 894 3HZ LYS 136 3HZ LYS 136 9.576 13.198 -4.008 895 H THR 137 H THR 137 10.510 9.550 -1.680 896 HA THR 137 HA THR 137 7.979 10.517 -2.610 897 HB THR 137 HB THR 137 9.065 8.892 -4.814 898 HG1 THR 137 HG1 THR 137 10.981 9.944 -4.570 899 1HG2 THR 137 1HG2 THR 137 6.965 10.117 -4.887 900 2HG2 THR 137 2HG2 THR 137 7.825 11.656 -4.681 901 3HG2 THR 137 3HG2 THR 137 8.064 10.690 -6.160 902 H LEU 138 H LEU 138 7.058 9.168 -1.155 903 HA LEU 138 HA LEU 138 8.380 6.626 -0.592 904 1HB LEU 138 1HB LEU 138 6.967 8.458 0.925 905 2HB LEU 138 2HB LEU 138 5.800 7.152 0.726 906 HG LEU 138 HG LEU 138 7.784 5.660 1.527 907 1HD1 LEU 138 1HD1 LEU 138 8.832 8.336 2.475 908 2HD1 LEU 138 2HD1 LEU 138 9.429 6.735 2.955 909 3HD1 LEU 138 3HD1 LEU 138 9.622 7.285 1.277 910 1HD2 LEU 138 1HD2 LEU 138 5.763 6.349 2.961 911 2HD2 LEU 138 2HD2 LEU 138 7.284 6.113 3.844 912 3HD2 LEU 138 3HD2 LEU 138 6.711 7.737 3.507 913 H THR 139 H THR 139 7.457 4.531 -0.781 914 HA THR 139 HA THR 139 5.100 4.287 -2.456 915 HB THR 139 HB THR 139 7.024 4.256 -4.039 916 HG1 THR 139 HG1 THR 139 5.478 2.916 -4.708 917 1HG2 THR 139 1HG2 THR 139 8.693 3.504 -2.471 918 2HG2 THR 139 2HG2 THR 139 7.970 1.871 -2.422 919 3HG2 THR 139 3HG2 THR 139 8.674 2.486 -3.933 920 H LEU 140 H LEU 140 4.715 1.866 -2.612 921 HA LEU 140 HA LEU 140 5.531 0.288 -0.336 922 1HB LEU 140 1HB LEU 140 3.464 1.593 0.430 923 2HB LEU 140 2HB LEU 140 2.542 0.766 -0.824 924 HG LEU 140 HG LEU 140 3.973 -0.519 1.548 925 1HD1 LEU 140 1HD1 LEU 140 1.041 -0.056 0.943 926 2HD1 LEU 140 2HD1 LEU 140 1.671 -1.024 2.302 927 3HD1 LEU 140 3HD1 LEU 140 2.005 0.706 2.217 928 1HD2 LEU 140 1HD2 LEU 140 2.449 -1.759 -0.758 929 2HD2 LEU 140 2HD2 LEU 140 4.057 -2.195 -0.124 930 3HD2 LEU 140 3HD2 LEU 140 2.614 -2.562 0.811 931 H SER 141 H SER 141 6.170 -1.485 -1.641 932 HA SER 141 HA SER 141 4.713 -1.993 -4.163 933 1HB SER 141 1HB SER 141 7.016 -3.721 -3.532 934 2HB SER 141 2HB SER 141 6.542 -2.918 -5.018 935 HG SER 141 HG SER 141 7.247 -0.930 -4.078 936 H TYR 142 H TYR 142 2.876 -3.101 -3.850 937 HA TYR 142 HA TYR 142 2.683 -5.175 -1.714 938 1HB TYR 142 1HB TYR 142 0.703 -3.833 -3.561 939 2HB TYR 142 2HB TYR 142 0.305 -5.318 -2.707 940 HD1 TYR 142 HD1 TYR 142 -0.173 -1.903 -2.513 941 HD2 TYR 142 HD2 TYR 142 0.886 -5.324 -0.104 942 HE1 TYR 142 HE1 TYR 142 -1.098 -0.784 -0.503 943 HE2 TYR 142 HE2 TYR 142 0.027 -4.180 1.904 944 HH TYR 142 HH TYR 142 -0.614 -2.143 2.739 945 H THR 143 H THR 143 4.206 -6.702 -2.638 946 HA THR 143 HA THR 143 3.619 -7.875 -5.226 947 HB THR 143 HB THR 143 5.470 -9.483 -3.888 948 HG1 THR 143 HG1 THR 143 6.889 -7.840 -3.072 949 1HG2 THR 143 1HG2 THR 143 5.538 -8.625 -6.239 950 2HG2 THR 143 2HG2 THR 143 5.934 -7.012 -5.619 951 3HG2 THR 143 3HG2 THR 143 7.067 -8.361 -5.383 952 H PHE 144 H PHE 144 1.560 -8.442 -5.102 953 HA PHE 144 HA PHE 144 0.441 -10.410 -3.337 954 1HB PHE 144 1HB PHE 144 -0.292 -9.251 -6.033 955 2HB PHE 144 2HB PHE 144 -1.183 -10.578 -5.347 956 HD1 PHE 144 HD1 PHE 144 -3.316 -9.394 -5.256 957 HD2 PHE 144 HD2 PHE 144 0.128 -7.742 -3.239 958 HE1 PHE 144 HE1 PHE 144 -4.787 -8.274 -3.626 959 HE2 PHE 144 HE2 PHE 144 -1.368 -6.713 -1.561 960 HZ PHE 144 HZ PHE 144 -3.811 -6.995 -1.732 961 H TYR 145 H TYR 145 2.244 -11.906 -3.270 962 HA TYR 145 HA TYR 145 2.144 -13.971 -5.460 963 1HB TYR 145 1HB TYR 145 4.405 -12.784 -3.869 964 2HB TYR 145 2HB TYR 145 4.512 -14.445 -4.400 965 HD1 TYR 145 HD1 TYR 145 4.697 -15.112 -6.704 966 HD2 TYR 145 HD2 TYR 145 4.409 -10.961 -5.606 967 HE1 TYR 145 HE1 TYR 145 5.750 -14.470 -8.861 968 HE2 TYR 145 HE2 TYR 145 5.471 -10.322 -7.768 969 HH TYR 145 HH TYR 145 6.393 -11.069 -9.737 970 HA PRO 146 HA PRO 146 1.250 -16.856 -2.090 971 1HB PRO 146 1HB PRO 146 -1.367 -17.195 -2.119 972 2HB PRO 146 2HB PRO 146 -0.697 -15.660 -1.547 973 1HG PRO 146 1HG PRO 146 -1.905 -16.169 -4.265 974 2HG PRO 146 2HG PRO 146 -2.071 -14.785 -3.159 975 1HD PRO 146 1HD PRO 146 -0.152 -15.032 -5.306 976 2HD PRO 146 2HD PRO 146 -0.193 -13.784 -4.030 977 H ARG 147 H ARG 147 -1.347 -18.154 -3.802 978 HA ARG 147 HA ARG 147 0.311 -19.646 -5.733 979 1HB ARG 147 1HB ARG 147 -1.235 -20.974 -3.462 980 2HB ARG 147 2HB ARG 147 -0.524 -21.803 -4.855 981 1HG ARG 147 1HG ARG 147 1.752 -20.958 -4.133 982 2HG ARG 147 2HG ARG 147 0.991 -20.262 -2.696 983 1HD ARG 147 1HD ARG 147 1.961 -22.374 -2.098 984 2HD ARG 147 2HD ARG 147 0.186 -22.486 -2.005 985 HE ARG 147 HE ARG 147 1.113 -23.310 -4.596 986 1HH1 ARG 147 1HH1 ARG 147 1.075 -24.413 -1.255 987 2HH1 ARG 147 2HH1 ARG 147 1.076 -26.109 -1.627 988 1HH2 ARG 147 1HH2 ARG 147 1.107 -25.560 -5.154 989 2HH2 ARG 147 2HH2 ARG 147 1.107 -26.771 -3.916 990 H GLU 148 H GLU 148 -0.932 -20.673 -7.344 991 HA GLU 148 HA GLU 148 -3.825 -20.212 -7.457 992 1HB GLU 148 1HB GLU 148 -2.817 -18.207 -8.295 993 2HB GLU 148 2HB GLU 148 -1.712 -19.081 -9.353 994 1HG GLU 148 1HG GLU 148 -4.741 -19.191 -9.712 995 2HG GLU 148 2HG GLU 148 -3.748 -17.849 -10.273 996 HA PRO 149 HA PRO 149 -2.953 -24.174 -9.479 997 1HB PRO 149 1HB PRO 149 -5.454 -25.006 -10.116 998 2HB PRO 149 2HB PRO 149 -4.883 -24.872 -8.430 999 1HG PRO 149 1HG PRO 149 -6.627 -22.921 -9.945 1000 2HG PRO 149 2HG PRO 149 -6.808 -23.505 -8.277 1001 1HD PRO 149 1HD PRO 149 -5.600 -21.100 -8.920 1002 2HD PRO 149 2HD PRO 149 -5.191 -22.055 -7.469 1003 H SER 150 H SER 150 -5.268 -22.059 -11.162 1004 HA SER 150 HA SER 150 -4.159 -21.561 -13.595 1005 1HB SER 150 1HB SER 150 -5.473 -24.302 -13.605 1006 2HB SER 150 2HB SER 150 -5.531 -23.257 -15.032 1007 HG SER 150 HG SER 150 -3.131 -23.967 -13.731 1008 H LYS 151 H LYS 151 -5.452 -19.719 -13.276 1009 HA LYS 151 HA LYS 151 -8.208 -19.773 -12.617 1010 1HB LYS 151 1HB LYS 151 -8.185 -17.371 -13.025 1011 2HB LYS 151 2HB LYS 151 -6.764 -17.906 -12.153 1012 1HG LYS 151 1HG LYS 151 -5.674 -17.972 -14.624 1013 2HG LYS 151 2HG LYS 151 -7.031 -16.919 -14.999 1014 1HD LYS 151 1HD LYS 151 -5.288 -15.439 -14.546 1015 2HD LYS 151 2HD LYS 151 -6.263 -15.430 -13.057 1016 1HE LYS 151 1HE LYS 151 -4.710 -17.150 -12.113 1017 2HE LYS 151 2HE LYS 151 -3.721 -17.108 -13.567 1018 1HZ LYS 151 1HZ LYS 151 -3.112 -14.885 -13.020 1019 2HZ LYS 151 2HZ LYS 151 -4.161 -14.828 -11.750 1020 3HZ LYS 151 3HZ LYS 151 -2.880 -15.840 -11.690 Start of MODEL 4 1 H VAL 21 H VAL 21 1.163 10.071 15.851 2 HA VAL 21 HA VAL 21 0.403 7.250 15.904 3 HB VAL 21 HB VAL 21 -1.413 8.038 17.425 4 1HG1 VAL 21 1HG1 VAL 21 0.068 8.430 19.303 5 2HG1 VAL 21 2HG1 VAL 21 0.746 7.187 18.239 6 3HG1 VAL 21 3HG1 VAL 21 1.406 8.835 18.215 7 1HG2 VAL 21 1HG2 VAL 21 -1.377 10.262 18.352 8 2HG2 VAL 21 2HG2 VAL 21 0.008 10.739 17.364 9 3HG2 VAL 21 3HG2 VAL 21 -1.565 10.430 16.602 10 H GLU 22 H GLU 22 0.227 7.554 13.418 11 HA GLU 22 HA GLU 22 -0.991 7.726 11.533 12 1HB GLU 22 1HB GLU 22 -1.646 5.572 12.647 13 2HB GLU 22 2HB GLU 22 -3.198 6.329 13.045 14 1HG GLU 22 1HG GLU 22 -3.794 6.496 10.726 15 2HG GLU 22 2HG GLU 22 -2.122 6.318 10.192 16 H GLN 23 H GLN 23 -0.966 10.203 12.151 17 HA GLN 23 HA GLN 23 -3.655 11.307 11.994 18 1HB GLN 23 1HB GLN 23 -1.588 11.627 14.224 19 2HB GLN 23 2HB GLN 23 -2.342 13.103 13.664 20 1HG GLN 23 1HG GLN 23 -3.777 10.680 14.836 21 2HG GLN 23 2HG GLN 23 -3.587 12.292 15.568 22 1HE2 GLN 23 1HE2 GLN 23 -4.126 13.958 13.385 23 2HE2 GLN 23 2HE2 GLN 23 -5.717 13.603 12.721 24 H ALA 24 H ALA 24 -3.652 13.461 11.423 25 HA ALA 24 HA ALA 24 -1.269 14.620 10.075 26 1HB ALA 24 1HB ALA 24 -2.973 14.920 8.116 27 2HB ALA 24 2HB ALA 24 -2.272 13.311 8.421 28 3HB ALA 24 3HB ALA 24 -3.935 13.699 8.941 29 H SER 25 H SER 25 -1.529 15.893 12.071 30 HA SER 25 HA SER 25 -2.790 18.277 11.629 31 1HB SER 25 1HB SER 25 -4.995 17.149 12.166 32 2HB SER 25 2HB SER 25 -4.346 16.715 13.760 33 HG SER 25 HG SER 25 -4.099 18.983 14.121 34 H ASP 26 H ASP 26 -0.348 17.481 12.319 35 HA ASP 26 HA ASP 26 0.336 18.821 14.817 36 1HB ASP 26 1HB ASP 26 -0.406 16.827 15.885 37 2HB ASP 26 2HB ASP 26 0.236 15.781 14.617 38 H LEU 27 H LEU 27 1.255 16.327 12.508 39 HA LEU 27 HA LEU 27 4.056 16.962 12.573 40 1HB LEU 27 1HB LEU 27 2.491 15.244 10.589 41 2HB LEU 27 2HB LEU 27 4.240 15.328 10.778 42 HG LEU 27 HG LEU 27 3.645 14.675 13.328 43 1HD1 LEU 27 1HD1 LEU 27 1.464 13.330 11.655 44 2HD1 LEU 27 2HD1 LEU 27 1.890 12.911 13.324 45 3HD1 LEU 27 3HD1 LEU 27 1.167 14.477 12.973 46 1HD2 LEU 27 1HD2 LEU 27 4.102 12.330 12.655 47 2HD2 LEU 27 2HD2 LEU 27 3.841 12.779 10.958 48 3HD2 LEU 27 3HD2 LEU 27 5.194 13.482 11.878 49 H ILE 28 H ILE 28 1.407 18.107 10.618 50 HA ILE 28 HA ILE 28 2.711 18.117 8.152 51 HB ILE 28 HB ILE 28 0.208 19.517 9.132 52 1HG1 ILE 28 1HG1 ILE 28 0.441 17.121 7.280 53 2HG1 ILE 28 2HG1 ILE 28 0.603 16.891 8.999 54 1HG2 ILE 28 1HG2 ILE 28 0.849 20.703 7.104 55 2HG2 ILE 28 2HG2 ILE 28 1.293 19.167 6.320 56 3HG2 ILE 28 3HG2 ILE 28 -0.405 19.533 6.665 57 1HD1 ILE 28 1HD1 ILE 28 -1.677 16.526 8.404 58 2HD1 ILE 28 2HD1 ILE 28 -1.563 17.924 9.466 59 3HD1 ILE 28 3HD1 ILE 28 -1.849 18.140 7.715 60 H LEU 29 H LEU 29 3.952 19.474 7.068 61 HA LEU 29 HA LEU 29 4.278 22.299 7.970 62 1HB LEU 29 1HB LEU 29 6.291 20.639 6.422 63 2HB LEU 29 2HB LEU 29 6.455 22.285 7.021 64 HG LEU 29 HG LEU 29 7.681 21.185 8.548 65 1HD1 LEU 29 1HD1 LEU 29 6.667 21.126 10.669 66 2HD1 LEU 29 2HD1 LEU 29 5.780 22.360 9.753 67 3HD1 LEU 29 3HD1 LEU 29 5.076 20.744 10.035 68 1HD2 LEU 29 1HD2 LEU 29 7.377 18.922 7.746 69 2HD2 LEU 29 2HD2 LEU 29 7.180 18.933 9.513 70 3HD2 LEU 29 3HD2 LEU 29 5.763 18.839 8.467 71 H ASP 30 H ASP 30 4.728 23.767 6.090 72 HA ASP 30 HA ASP 30 2.693 23.305 4.074 73 1HB ASP 30 1HB ASP 30 2.919 25.395 5.222 74 2HB ASP 30 2HB ASP 30 4.540 25.653 4.526 75 H GLU 31 H GLU 31 3.825 21.472 3.292 76 HA GLU 31 HA GLU 31 5.317 22.135 0.828 77 1HB GLU 31 1HB GLU 31 6.473 20.747 3.160 78 2HB GLU 31 2HB GLU 31 6.462 19.683 1.748 79 1HG GLU 31 1HG GLU 31 7.579 22.497 1.660 80 2HG GLU 31 2HG GLU 31 8.527 21.069 2.090 81 H LYS 32 H LYS 32 5.524 19.780 -0.300 82 HA LYS 32 HA LYS 32 3.104 18.081 0.257 83 1HB LYS 32 1HB LYS 32 4.239 18.922 -2.438 84 2HB LYS 32 2HB LYS 32 3.192 17.509 -2.198 85 1HG LYS 32 1HG LYS 32 1.547 19.227 -1.098 86 2HG LYS 32 2HG LYS 32 2.455 20.439 -2.022 87 1HD LYS 32 1HD LYS 32 1.118 17.901 -3.081 88 2HD LYS 32 2HD LYS 32 0.421 19.508 -3.229 89 1HE LYS 32 1HE LYS 32 1.827 20.149 -4.947 90 2HE LYS 32 2HE LYS 32 3.185 19.170 -4.388 91 1HZ LYS 32 1HZ LYS 32 0.793 17.954 -5.632 92 2HZ LYS 32 2HZ LYS 32 2.214 18.277 -6.426 93 3HZ LYS 32 3HZ LYS 32 2.093 17.200 -5.174 94 H ILE 33 H ILE 33 3.530 15.874 -0.086 95 HA ILE 33 HA ILE 33 6.134 15.072 -1.227 96 HB ILE 33 HB ILE 33 6.551 15.060 1.106 97 1HG1 ILE 33 1HG1 ILE 33 7.253 12.806 1.341 98 2HG1 ILE 33 2HG1 ILE 33 6.251 12.227 0.007 99 1HG2 ILE 33 1HG2 ILE 33 4.483 12.891 1.440 100 2HG2 ILE 33 2HG2 ILE 33 5.421 13.770 2.674 101 3HG2 ILE 33 3HG2 ILE 33 4.125 14.595 1.791 102 1HD1 ILE 33 1HD1 ILE 33 8.553 14.231 -0.171 103 2HD1 ILE 33 2HD1 ILE 33 8.659 12.486 -0.494 104 3HD1 ILE 33 3HD1 ILE 33 7.695 13.515 -1.562 105 H LYS 34 H LYS 34 5.917 12.864 -2.151 106 HA LYS 34 HA LYS 34 3.125 12.444 -3.101 107 1HB LYS 34 1HB LYS 34 4.926 13.645 -4.520 108 2HB LYS 34 2HB LYS 34 5.670 12.062 -4.732 109 1HG LYS 34 1HG LYS 34 2.736 12.619 -5.395 110 2HG LYS 34 2HG LYS 34 4.038 13.083 -6.474 111 1HD LYS 34 1HD LYS 34 4.564 10.349 -5.845 112 2HD LYS 34 2HD LYS 34 2.830 10.485 -6.060 113 1HE LYS 34 1HE LYS 34 3.365 11.779 -8.265 114 2HE LYS 34 2HE LYS 34 5.065 11.348 -7.982 115 1HZ LYS 34 1HZ LYS 34 4.101 8.954 -7.993 116 2HZ LYS 34 2HZ LYS 34 2.794 9.687 -8.708 117 3HZ LYS 34 3HZ LYS 34 4.235 9.769 -9.429 118 H VAL 35 H VAL 35 2.626 10.190 -3.778 119 HA VAL 35 HA VAL 35 4.472 8.091 -2.724 120 HB VAL 35 HB VAL 35 1.674 8.755 -1.932 121 1HG1 VAL 35 1HG1 VAL 35 1.435 6.437 -2.605 122 2HG1 VAL 35 2HG1 VAL 35 2.916 5.982 -1.751 123 3HG1 VAL 35 3HG1 VAL 35 1.495 6.504 -0.837 124 1HG2 VAL 35 1HG2 VAL 35 3.615 9.499 -0.511 125 2HG2 VAL 35 2HG2 VAL 35 2.412 8.495 0.285 126 3HG2 VAL 35 3HG2 VAL 35 3.959 7.771 -0.244 127 H THR 36 H THR 36 4.305 6.203 -3.909 128 HA THR 36 HA THR 36 2.520 6.223 -6.271 129 HB THR 36 HB THR 36 5.546 5.997 -6.399 130 HG1 THR 36 HG1 THR 36 4.742 8.063 -6.079 131 1HG2 THR 36 1HG2 THR 36 4.484 4.569 -8.098 132 2HG2 THR 36 2HG2 THR 36 3.477 5.938 -8.630 133 3HG2 THR 36 3HG2 THR 36 5.248 5.996 -8.818 134 H PHE 37 H PHE 37 1.397 4.542 -5.977 135 HA PHE 37 HA PHE 37 2.220 2.251 -4.405 136 1HB PHE 37 1HB PHE 37 -0.380 2.971 -5.839 137 2HB PHE 37 2HB PHE 37 -0.148 1.606 -4.765 138 HD1 PHE 37 HD1 PHE 37 -1.224 4.990 -4.943 139 HD2 PHE 37 HD2 PHE 37 0.677 2.136 -2.329 140 HE1 PHE 37 HE1 PHE 37 -1.814 6.362 -2.960 141 HE2 PHE 37 HE2 PHE 37 0.205 3.583 -0.396 142 HZ PHE 37 HZ PHE 37 -0.978 5.766 -0.729 143 H ASP 38 H ASP 38 3.638 0.963 -5.734 144 HA ASP 38 HA ASP 38 2.832 0.278 -8.503 145 1HB ASP 38 1HB ASP 38 5.201 0.707 -8.027 146 2HB ASP 38 2HB ASP 38 5.205 -0.528 -6.773 147 H ALA 39 H ALA 39 0.788 -0.624 -7.904 148 HA ALA 39 HA ALA 39 0.745 -3.086 -6.332 149 1HB ALA 39 1HB ALA 39 -1.639 -3.109 -6.890 150 2HB ALA 39 2HB ALA 39 -1.138 -1.504 -6.314 151 3HB ALA 39 3HB ALA 39 -1.390 -1.795 -8.052 152 H ASN 40 H ASN 40 1.630 -4.932 -7.208 153 HA ASN 40 HA ASN 40 1.184 -5.550 -10.100 154 1HB ASN 40 1HB ASN 40 3.224 -6.823 -8.242 155 2HB ASN 40 2HB ASN 40 3.090 -6.983 -9.988 156 1HD2 ASN 40 1HD2 ASN 40 3.877 -4.742 -7.325 157 2HD2 ASN 40 2HD2 ASN 40 4.901 -3.685 -8.293 158 H VAL 41 H VAL 41 0.613 -7.733 -10.640 159 HA VAL 41 HA VAL 41 -0.001 -9.607 -8.529 160 HB VAL 41 HB VAL 41 -2.129 -8.427 -8.676 161 1HG1 VAL 41 1HG1 VAL 41 -1.949 -7.374 -10.887 162 2HG1 VAL 41 2HG1 VAL 41 -2.087 -8.961 -11.675 163 3HG1 VAL 41 3HG1 VAL 41 -3.448 -8.302 -10.751 164 1HG2 VAL 41 1HG2 VAL 41 -2.454 -11.005 -10.250 165 2HG2 VAL 41 2HG2 VAL 41 -2.114 -10.950 -8.508 166 3HG2 VAL 41 3HG2 VAL 41 -3.604 -10.245 -9.142 167 H ALA 42 H ALA 42 0.033 -11.780 -9.246 168 HA ALA 42 HA ALA 42 0.421 -12.377 -12.067 169 1HB ALA 42 1HB ALA 42 2.724 -12.674 -10.081 170 2HB ALA 42 2HB ALA 42 2.726 -13.254 -11.758 171 3HB ALA 42 3HB ALA 42 2.680 -11.514 -11.426 172 H ALA 43 H ALA 43 0.932 -14.743 -12.290 173 HA ALA 43 HA ALA 43 -0.703 -16.573 -11.224 174 1HB ALA 43 1HB ALA 43 1.017 -18.258 -11.748 175 2HB ALA 43 2HB ALA 43 0.853 -17.049 -13.043 176 3HB ALA 43 3HB ALA 43 2.230 -16.971 -11.913 177 H GLY 44 H GLY 44 -1.171 -17.024 -9.176 178 1HA GLY 44 1HA GLY 44 0.008 -17.987 -7.019 179 2HA GLY 44 2HA GLY 44 0.798 -16.403 -7.042 180 H LEU 45 H LEU 45 -1.288 -14.879 -8.199 181 HA LEU 45 HA LEU 45 -3.724 -15.283 -6.582 182 1HB LEU 45 1HB LEU 45 -1.783 -13.078 -6.304 183 2HB LEU 45 2HB LEU 45 -3.404 -12.506 -6.627 184 HG LEU 45 HG LEU 45 -3.013 -14.578 -4.414 185 1HD1 LEU 45 1HD1 LEU 45 -2.742 -12.811 -2.803 186 2HD1 LEU 45 2HD1 LEU 45 -1.500 -12.483 -4.024 187 3HD1 LEU 45 3HD1 LEU 45 -2.993 -11.556 -4.006 188 1HD2 LEU 45 1HD2 LEU 45 -5.030 -13.474 -3.610 189 2HD2 LEU 45 2HD2 LEU 45 -4.935 -12.300 -4.949 190 3HD2 LEU 45 3HD2 LEU 45 -5.257 -14.025 -5.290 191 HA PRO 46 HA PRO 46 -4.727 -14.291 -10.951 192 1HB PRO 46 1HB PRO 46 -7.123 -15.545 -11.160 193 2HB PRO 46 2HB PRO 46 -5.608 -16.461 -11.054 194 1HG PRO 46 1HG PRO 46 -7.563 -15.899 -8.843 195 2HG PRO 46 2HG PRO 46 -6.757 -17.433 -9.232 196 1HD PRO 46 1HD PRO 46 -5.846 -15.678 -7.292 197 2HD PRO 46 2HD PRO 46 -4.772 -16.795 -8.194 198 H TRP 47 H TRP 47 -5.686 -12.831 -8.141 199 HA TRP 47 HA TRP 47 -8.352 -12.105 -8.806 200 1HB TRP 47 1HB TRP 47 -6.491 -10.963 -6.690 201 2HB TRP 47 2HB TRP 47 -8.236 -10.705 -6.783 202 HD1 TRP 47 HD1 TRP 47 -8.023 -14.157 -7.601 203 HE1 TRP 47 HE1 TRP 47 -8.361 -15.694 -5.658 204 HE3 TRP 47 HE3 TRP 47 -7.167 -10.809 -3.810 205 HZ2 TRP 47 HZ2 TRP 47 -8.407 -15.505 -2.736 206 HZ3 TRP 47 HZ3 TRP 47 -7.069 -11.667 -1.476 207 HH2 TRP 47 HH2 TRP 47 -7.904 -13.900 -0.916 208 H GLU 48 H GLU 48 -9.196 -10.121 -9.536 209 HA GLU 48 HA GLU 48 -7.259 -8.591 -11.180 210 1HB GLU 48 1HB GLU 48 -9.404 -9.165 -12.138 211 2HB GLU 48 2HB GLU 48 -10.260 -8.233 -10.893 212 1HG GLU 48 1HG GLU 48 -9.429 -6.163 -11.759 213 2HG GLU 48 2HG GLU 48 -8.134 -6.964 -12.654 214 H PHE 49 H PHE 49 -6.011 -7.917 -9.483 215 HA PHE 49 HA PHE 49 -6.900 -6.197 -7.336 216 1HB PHE 49 1HB PHE 49 -5.085 -7.815 -7.103 217 2HB PHE 49 2HB PHE 49 -4.174 -6.999 -8.372 218 HD1 PHE 49 HD1 PHE 49 -5.964 -5.235 -5.546 219 HD2 PHE 49 HD2 PHE 49 -2.185 -6.643 -7.109 220 HE1 PHE 49 HE1 PHE 49 -4.775 -4.211 -3.648 221 HE2 PHE 49 HE2 PHE 49 -1.021 -5.603 -5.216 222 HZ PHE 49 HZ PHE 49 -2.309 -4.361 -3.479 223 H VAL 50 H VAL 50 -7.791 -4.287 -8.189 224 HA VAL 50 HA VAL 50 -6.265 -2.892 -10.284 225 HB VAL 50 HB VAL 50 -8.094 -1.461 -10.600 226 1HG1 VAL 50 1HG1 VAL 50 -9.775 -3.047 -11.292 227 2HG1 VAL 50 2HG1 VAL 50 -8.189 -3.810 -11.506 228 3HG1 VAL 50 3HG1 VAL 50 -9.216 -4.251 -10.121 229 1HG2 VAL 50 1HG2 VAL 50 -8.932 -0.925 -8.417 230 2HG2 VAL 50 2HG2 VAL 50 -10.235 -1.752 -9.276 231 3HG2 VAL 50 3HG2 VAL 50 -9.277 -2.633 -8.070 232 HA PRO 51 HA PRO 51 -4.618 -0.035 -7.088 233 1HB PRO 51 1HB PRO 51 -3.277 1.677 -8.737 234 2HB PRO 51 2HB PRO 51 -2.622 0.090 -8.263 235 1HG PRO 51 1HG PRO 51 -4.083 0.818 -10.807 236 2HG PRO 51 2HG PRO 51 -2.571 -0.128 -10.647 237 1HD PRO 51 1HD PRO 51 -5.030 -1.264 -10.971 238 2HD PRO 51 2HD PRO 51 -3.773 -2.059 -9.976 239 H VAL 52 H VAL 52 -5.544 1.904 -6.446 240 HA VAL 52 HA VAL 52 -7.975 2.687 -7.801 241 HB VAL 52 HB VAL 52 -8.074 4.429 -5.927 242 1HG1 VAL 52 1HG1 VAL 52 -9.029 2.705 -4.452 243 2HG1 VAL 52 2HG1 VAL 52 -9.545 2.475 -6.129 244 3HG1 VAL 52 3HG1 VAL 52 -8.281 1.430 -5.446 245 1HG2 VAL 52 1HG2 VAL 52 -6.840 3.827 -3.947 246 2HG2 VAL 52 2HG2 VAL 52 -6.136 2.413 -4.761 247 3HG2 VAL 52 3HG2 VAL 52 -5.661 4.043 -5.261 248 H GLN 53 H GLN 53 -4.881 4.209 -7.055 249 HA GLN 53 HA GLN 53 -4.988 5.791 -9.503 250 1HB GLN 53 1HB GLN 53 -3.945 6.902 -6.861 251 2HB GLN 53 2HB GLN 53 -3.842 7.659 -8.427 252 1HG GLN 53 1HG GLN 53 -5.587 8.799 -7.370 253 2HG GLN 53 2HG GLN 53 -6.349 7.752 -8.576 254 1HE2 GLN 53 1HE2 GLN 53 -5.102 7.033 -5.253 255 2HE2 GLN 53 2HE2 GLN 53 -6.645 6.455 -4.663 256 H ARG 54 H ARG 54 -2.609 6.153 -10.092 257 HA ARG 54 HA ARG 54 -0.866 3.937 -9.269 258 1HB ARG 54 1HB ARG 54 -0.691 6.274 -11.139 259 2HB ARG 54 2HB ARG 54 0.799 5.860 -10.310 260 1HG ARG 54 1HG ARG 54 0.704 4.652 -12.395 261 2HG ARG 54 2HG ARG 54 0.668 3.527 -11.033 262 1HD ARG 54 1HD ARG 54 -1.743 3.359 -11.284 263 2HD ARG 54 2HD ARG 54 -1.634 4.496 -12.644 264 HE ARG 54 HE ARG 54 0.136 2.377 -13.190 265 1HH1 ARG 54 1HH1 ARG 54 -3.333 2.747 -12.755 266 2HH1 ARG 54 2HH1 ARG 54 -3.779 1.324 -13.646 267 1HH2 ARG 54 1HH2 ARG 54 -0.391 0.458 -14.372 268 2HH2 ARG 54 2HH2 ARG 54 -2.044 -0.003 -14.607 269 H ASP 55 H ASP 55 -1.247 7.438 -8.460 270 HA ASP 55 HA ASP 55 0.455 7.122 -6.109 271 1HB ASP 55 1HB ASP 55 1.471 9.221 -7.073 272 2HB ASP 55 2HB ASP 55 1.797 7.751 -8.011 273 H ILE 56 H ILE 56 0.517 9.166 -4.907 274 HA ILE 56 HA ILE 56 -1.952 10.767 -4.978 275 HB ILE 56 HB ILE 56 -2.273 10.667 -2.553 276 1HG1 ILE 56 1HG1 ILE 56 -0.326 8.368 -2.768 277 2HG1 ILE 56 2HG1 ILE 56 -0.038 9.955 -1.999 278 1HG2 ILE 56 1HG2 ILE 56 -3.406 8.463 -2.550 279 2HG2 ILE 56 2HG2 ILE 56 -3.690 9.360 -4.054 280 3HG2 ILE 56 3HG2 ILE 56 -2.519 8.030 -4.031 281 1HD1 ILE 56 1HD1 ILE 56 -2.023 7.901 -0.950 282 2HD1 ILE 56 2HD1 ILE 56 -0.409 8.231 -0.307 283 3HD1 ILE 56 3HD1 ILE 56 -1.640 9.493 -0.264 284 H ASP 57 H ASP 57 -1.703 12.775 -3.947 285 HA ASP 57 HA ASP 57 1.028 13.702 -3.185 286 1HB ASP 57 1HB ASP 57 -1.597 15.058 -3.947 287 2HB ASP 57 2HB ASP 57 -0.560 15.822 -2.750 288 H VAL 58 H VAL 58 1.343 14.081 -0.993 289 HA VAL 58 HA VAL 58 -1.029 14.205 0.786 290 HB VAL 58 HB VAL 58 0.028 13.101 2.577 291 1HG1 VAL 58 1HG1 VAL 58 -0.010 11.321 0.113 292 2HG1 VAL 58 2HG1 VAL 58 -0.315 10.842 1.790 293 3HG1 VAL 58 3HG1 VAL 58 -1.459 11.904 0.960 294 1HG2 VAL 58 1HG2 VAL 58 2.265 12.413 0.642 295 2HG2 VAL 58 2HG2 VAL 58 2.347 13.353 2.164 296 3HG2 VAL 58 3HG2 VAL 58 1.975 11.626 2.206 297 H ARG 59 H ARG 59 -1.042 16.115 1.811 298 HA ARG 59 HA ARG 59 0.975 18.125 1.528 299 1HB ARG 59 1HB ARG 59 -1.681 17.810 2.892 300 2HB ARG 59 2HB ARG 59 -0.588 18.919 3.690 301 1HG ARG 59 1HG ARG 59 -1.457 19.117 0.786 302 2HG ARG 59 2HG ARG 59 -2.066 20.044 2.171 303 1HD ARG 59 1HD ARG 59 0.624 20.436 2.481 304 2HD ARG 59 2HD ARG 59 0.538 20.285 0.713 305 HE ARG 59 HE ARG 59 -1.462 22.114 1.554 306 1HH1 ARG 59 1HH1 ARG 59 2.100 21.781 1.502 307 2HH1 ARG 59 2HH1 ARG 59 2.316 23.537 1.700 308 1HH2 ARG 59 1HH2 ARG 59 -0.978 24.486 1.816 309 2HH2 ARG 59 2HH2 ARG 59 0.739 24.900 1.909 310 H ILE 60 H ILE 60 2.774 16.747 2.114 311 HA ILE 60 HA ILE 60 4.442 16.025 3.406 312 HB ILE 60 HB ILE 60 3.292 18.079 5.275 313 1HG1 ILE 60 1HG1 ILE 60 4.690 18.520 3.162 314 2HG1 ILE 60 2HG1 ILE 60 5.164 19.299 4.663 315 1HG2 ILE 60 1HG2 ILE 60 5.379 17.669 6.664 316 2HG2 ILE 60 2HG2 ILE 60 4.050 16.544 6.917 317 3HG2 ILE 60 3HG2 ILE 60 5.432 16.050 5.921 318 1HD1 ILE 60 1HD1 ILE 60 7.133 18.430 3.440 319 2HD1 ILE 60 2HD1 ILE 60 6.981 17.685 5.015 320 3HD1 ILE 60 3HD1 ILE 60 6.501 16.786 3.559 321 H GLY 61 H GLY 61 1.805 16.163 5.800 322 1HA GLY 61 1HA GLY 61 2.013 13.210 6.121 323 2HA GLY 61 2HA GLY 61 2.111 14.279 7.532 324 H GLU 62 H GLU 62 0.138 13.939 4.569 325 HA GLU 62 HA GLU 62 -2.305 14.771 6.017 326 1HB GLU 62 1HB GLU 62 -1.507 15.944 4.014 327 2HB GLU 62 2HB GLU 62 -1.752 14.461 3.056 328 1HG GLU 62 1HG GLU 62 -3.635 15.927 2.698 329 2HG GLU 62 2HG GLU 62 -4.196 14.551 3.657 330 H THR 63 H THR 63 -3.419 13.063 6.881 331 HA THR 63 HA THR 63 -2.977 10.333 6.107 332 HB THR 63 HB THR 63 -5.038 11.537 8.013 333 HG1 THR 63 HG1 THR 63 -2.340 10.758 8.363 334 1HG2 THR 63 1HG2 THR 63 -4.937 9.365 9.141 335 2HG2 THR 63 2HG2 THR 63 -5.511 9.167 7.476 336 3HG2 THR 63 3HG2 THR 63 -3.822 8.758 7.905 337 H VAL 64 H VAL 64 -3.590 10.158 3.913 338 HA VAL 64 HA VAL 64 -6.493 10.531 3.329 339 HB VAL 64 HB VAL 64 -5.114 11.639 1.799 340 1HG1 VAL 64 1HG1 VAL 64 -2.986 10.434 1.992 341 2HG1 VAL 64 2HG1 VAL 64 -3.704 8.995 1.232 342 3HG1 VAL 64 3HG1 VAL 64 -3.525 10.509 0.311 343 1HG2 VAL 64 1HG2 VAL 64 -6.077 9.135 0.374 344 2HG2 VAL 64 2HG2 VAL 64 -7.137 10.471 0.896 345 3HG2 VAL 64 3HG2 VAL 64 -5.865 10.755 -0.302 346 H GLN 65 H GLN 65 -7.739 8.954 2.471 347 HA GLN 65 HA GLN 65 -7.109 6.122 3.127 348 1HB GLN 65 1HB GLN 65 -9.199 7.023 3.941 349 2HB GLN 65 2HB GLN 65 -9.676 7.568 2.336 350 1HG GLN 65 1HG GLN 65 -8.972 4.659 2.503 351 2HG GLN 65 2HG GLN 65 -10.315 5.149 3.529 352 1HE2 GLN 65 1HE2 GLN 65 -9.626 6.591 0.244 353 2HE2 GLN 65 2HE2 GLN 65 -11.119 5.960 -0.415 354 H ILE 66 H ILE 66 -6.421 4.792 1.588 355 HA ILE 66 HA ILE 66 -7.563 5.072 -1.103 356 HB ILE 66 HB ILE 66 -5.397 4.199 -2.088 357 1HG1 ILE 66 1HG1 ILE 66 -3.420 5.508 -0.829 358 2HG1 ILE 66 2HG1 ILE 66 -4.292 5.056 0.605 359 1HG2 ILE 66 1HG2 ILE 66 -5.386 7.054 -1.073 360 2HG2 ILE 66 2HG2 ILE 66 -4.633 6.418 -2.552 361 3HG2 ILE 66 3HG2 ILE 66 -6.394 6.468 -2.416 362 1HD1 ILE 66 1HD1 ILE 66 -2.572 3.392 0.060 363 2HD1 ILE 66 2HD1 ILE 66 -4.122 2.614 -0.266 364 3HD1 ILE 66 3HD1 ILE 66 -3.172 3.260 -1.606 365 H MET 67 H MET 67 -8.879 3.464 -1.169 366 HA MET 67 HA MET 67 -8.161 0.834 0.025 367 1HB MET 67 1HB MET 67 -10.397 0.119 -0.492 368 2HB MET 67 2HB MET 67 -10.474 1.683 0.315 369 1HG MET 67 1HG MET 67 -12.095 1.713 -1.298 370 2HG MET 67 2HG MET 67 -10.826 2.791 -1.877 371 1HE MET 67 1HE MET 67 -12.045 2.828 -4.234 372 2HE MET 67 2HE MET 67 -12.456 1.367 -5.162 373 3HE MET 67 3HE MET 67 -13.295 1.707 -3.629 374 H TYR 68 H TYR 68 -8.832 -1.077 -1.487 375 HA TYR 68 HA TYR 68 -7.899 -0.695 -4.247 376 1HB TYR 68 1HB TYR 68 -6.835 -2.877 -2.394 377 2HB TYR 68 2HB TYR 68 -6.535 -2.728 -4.124 378 HD1 TYR 68 HD1 TYR 68 -4.993 -1.024 -5.005 379 HD2 TYR 68 HD2 TYR 68 -5.629 -1.487 -0.770 380 HE1 TYR 68 HE1 TYR 68 -2.947 0.307 -4.554 381 HE2 TYR 68 HE2 TYR 68 -3.561 -0.192 -0.322 382 HH TYR 68 HH TYR 68 -1.708 1.410 -2.876 383 H ARG 69 H ARG 69 -8.781 -2.503 -5.555 384 HA ARG 69 HA ARG 69 -10.783 -4.192 -4.136 385 1HB ARG 69 1HB ARG 69 -11.133 -3.113 -6.947 386 2HB ARG 69 2HB ARG 69 -12.192 -4.210 -6.066 387 1HG ARG 69 1HG ARG 69 -12.537 -2.363 -4.338 388 2HG ARG 69 2HG ARG 69 -11.577 -1.306 -5.381 389 1HD ARG 69 1HD ARG 69 -13.843 -0.821 -5.920 390 2HD ARG 69 2HD ARG 69 -13.218 -1.779 -7.254 391 HE ARG 69 HE ARG 69 -14.462 -3.701 -6.534 392 1HH1 ARG 69 1HH1 ARG 69 -14.892 -1.253 -4.083 393 2HH1 ARG 69 2HH1 ARG 69 -16.354 -1.797 -3.605 394 1HH2 ARG 69 1HH2 ARG 69 -16.526 -4.468 -5.787 395 2HH2 ARG 69 2HH2 ARG 69 -17.360 -3.567 -4.559 396 H ALA 70 H ALA 70 -10.360 -6.333 -4.432 397 HA ALA 70 HA ALA 70 -8.787 -7.198 -6.803 398 1HB ALA 70 1HB ALA 70 -7.567 -8.797 -5.493 399 2HB ALA 70 2HB ALA 70 -7.257 -7.153 -4.909 400 3HB ALA 70 3HB ALA 70 -8.324 -8.227 -3.997 401 H LYS 71 H LYS 71 -10.203 -8.253 -8.011 402 HA LYS 71 HA LYS 71 -12.503 -9.595 -6.709 403 1HB LYS 71 1HB LYS 71 -12.215 -9.409 -9.669 404 2HB LYS 71 2HB LYS 71 -13.649 -9.363 -8.635 405 1HG LYS 71 1HG LYS 71 -12.766 -7.085 -7.792 406 2HG LYS 71 2HG LYS 71 -11.618 -7.091 -9.110 407 1HD LYS 71 1HD LYS 71 -14.620 -7.395 -9.605 408 2HD LYS 71 2HD LYS 71 -13.872 -5.833 -9.321 409 1HE LYS 71 1HE LYS 71 -14.023 -6.130 -11.707 410 2HE LYS 71 2HE LYS 71 -12.329 -6.107 -11.207 411 1HZ LYS 71 1HZ LYS 71 -13.885 -8.494 -11.973 412 2HZ LYS 71 2HZ LYS 71 -12.588 -7.793 -12.746 413 3HZ LYS 71 3HZ LYS 71 -12.358 -8.523 -11.338 414 H ASN 72 H ASN 72 -12.618 -11.799 -6.482 415 HA ASN 72 HA ASN 72 -10.284 -13.264 -7.245 416 1HB ASN 72 1HB ASN 72 -11.315 -13.631 -5.073 417 2HB ASN 72 2HB ASN 72 -12.798 -14.221 -5.847 418 1HD2 ASN 72 1HD2 ASN 72 -12.299 -16.262 -4.526 419 2HD2 ASN 72 2HD2 ASN 72 -11.176 -17.412 -5.234 420 H LEU 73 H LEU 73 -10.291 -13.274 -9.497 421 HA LEU 73 HA LEU 73 -12.236 -14.863 -11.005 422 1HB LEU 73 1HB LEU 73 -9.469 -13.788 -11.620 423 2HB LEU 73 2HB LEU 73 -10.467 -14.624 -12.806 424 HG LEU 73 HG LEU 73 -11.524 -12.163 -11.336 425 1HD1 LEU 73 1HD1 LEU 73 -9.833 -12.227 -13.848 426 2HD1 LEU 73 2HD1 LEU 73 -10.720 -10.810 -13.253 427 3HD1 LEU 73 3HD1 LEU 73 -9.388 -11.502 -12.294 428 1HD2 LEU 73 1HD2 LEU 73 -13.155 -13.524 -12.638 429 2HD2 LEU 73 2HD2 LEU 73 -12.896 -11.939 -13.380 430 3HD2 LEU 73 3HD2 LEU 73 -12.123 -13.375 -14.076 431 H ALA 74 H ALA 74 -11.974 -16.543 -9.176 432 HA ALA 74 HA ALA 74 -10.246 -18.701 -10.296 433 1HB ALA 74 1HB ALA 74 -9.206 -17.811 -8.194 434 2HB ALA 74 2HB ALA 74 -10.728 -18.178 -7.337 435 3HB ALA 74 3HB ALA 74 -9.764 -19.479 -8.016 436 H SER 75 H SER 75 -11.201 -20.785 -10.163 437 HA SER 75 HA SER 75 -14.118 -20.873 -9.844 438 1HB SER 75 1HB SER 75 -13.647 -23.212 -10.789 439 2HB SER 75 2HB SER 75 -13.298 -21.819 -11.823 440 HG SER 75 HG SER 75 -11.549 -23.162 -11.916 441 H THR 76 H THR 76 -11.590 -21.171 -7.686 442 HA THR 76 HA THR 76 -13.155 -22.701 -5.787 443 HB THR 76 HB THR 76 -11.039 -24.056 -5.186 444 HG1 THR 76 HG1 THR 76 -9.496 -22.896 -6.211 445 1HG2 THR 76 1HG2 THR 76 -12.885 -25.101 -6.494 446 2HG2 THR 76 2HG2 THR 76 -12.044 -24.663 -7.993 447 3HG2 THR 76 3HG2 THR 76 -11.285 -25.778 -6.845 448 HA PRO 77 HA PRO 77 -11.568 -19.480 -3.355 449 1HB PRO 77 1HB PRO 77 -10.461 -20.600 -1.017 450 2HB PRO 77 2HB PRO 77 -12.195 -20.321 -1.300 451 1HG PRO 77 1HG PRO 77 -10.627 -22.861 -1.781 452 2HG PRO 77 2HG PRO 77 -12.206 -22.678 -0.953 453 1HD PRO 77 1HD PRO 77 -12.146 -23.478 -3.492 454 2HD PRO 77 2HD PRO 77 -13.315 -22.234 -3.024 455 H THR 78 H THR 78 -9.627 -18.371 -2.637 456 HA THR 78 HA THR 78 -7.030 -19.647 -3.383 457 HB THR 78 HB THR 78 -6.971 -16.760 -3.803 458 HG1 THR 78 HG1 THR 78 -9.120 -17.158 -4.518 459 1HG2 THR 78 1HG2 THR 78 -5.851 -17.304 -5.799 460 2HG2 THR 78 2HG2 THR 78 -5.233 -18.354 -4.526 461 3HG2 THR 78 3HG2 THR 78 -6.385 -18.999 -5.729 462 H THR 79 H THR 79 -5.194 -17.947 -2.486 463 HA THR 79 HA THR 79 -5.987 -16.882 0.079 464 HB THR 79 HB THR 79 -5.347 -19.397 0.331 465 HG1 THR 79 HG1 THR 79 -5.557 -18.004 2.042 466 1HG2 THR 79 1HG2 THR 79 -2.530 -18.263 0.138 467 2HG2 THR 79 2HG2 THR 79 -3.015 -19.909 0.580 468 3HG2 THR 79 3HG2 THR 79 -3.293 -19.322 -1.075 469 H GLY 80 H GLY 80 -4.732 -15.227 0.690 470 1HA GLY 80 1HA GLY 80 -2.530 -14.350 -1.056 471 2HA GLY 80 2HA GLY 80 -3.893 -13.314 -0.588 472 H GLN 81 H GLN 81 -0.807 -13.973 0.134 473 HA GLN 81 HA GLN 81 -1.000 -12.473 2.630 474 1HB GLN 81 1HB GLN 81 1.057 -14.189 3.344 475 2HB GLN 81 2HB GLN 81 -0.579 -14.198 3.954 476 1HG GLN 81 1HG GLN 81 0.097 -16.433 3.440 477 2HG GLN 81 2HG GLN 81 -1.278 -15.968 2.452 478 1HE2 GLN 81 1HE2 GLN 81 1.833 -14.659 1.385 479 2HE2 GLN 81 2HE2 GLN 81 2.120 -15.886 0.167 480 H ALA 82 H ALA 82 -0.691 -11.284 0.475 481 HA ALA 82 HA ALA 82 1.670 -11.816 -1.060 482 1HB ALA 82 1HB ALA 82 -0.247 -9.469 -1.062 483 2HB ALA 82 2HB ALA 82 1.019 -9.750 -2.259 484 3HB ALA 82 3HB ALA 82 -0.342 -10.908 -2.102 485 H THR 83 H THR 83 3.456 -10.414 -1.482 486 HA THR 83 HA THR 83 4.407 -9.179 0.922 487 HB THR 83 HB THR 83 5.828 -8.979 -1.678 488 HG1 THR 83 HG1 THR 83 5.439 -11.350 -0.175 489 1HG2 THR 83 1HG2 THR 83 6.725 -9.707 1.147 490 2HG2 THR 83 2HG2 THR 83 7.787 -9.458 -0.255 491 3HG2 THR 83 3HG2 THR 83 6.864 -8.093 0.409 492 H PHE 84 H PHE 84 4.263 -7.047 1.457 493 HA PHE 84 HA PHE 84 3.978 -5.020 -0.700 494 1HB PHE 84 1HB PHE 84 2.923 -3.575 1.017 495 2HB PHE 84 2HB PHE 84 1.947 -4.941 0.513 496 HD1 PHE 84 HD1 PHE 84 1.349 -6.746 2.060 497 HD2 PHE 84 HD2 PHE 84 4.048 -3.602 3.273 498 HE1 PHE 84 HE1 PHE 84 1.248 -7.548 4.388 499 HE2 PHE 84 HE2 PHE 84 4.020 -4.461 5.572 500 HZ PHE 84 HZ PHE 84 2.575 -6.415 6.166 501 H ASN 85 H ASN 85 5.559 -3.549 -0.733 502 HA ASN 85 HA ASN 85 7.526 -3.353 1.538 503 1HB ASN 85 1HB ASN 85 8.511 -4.683 -0.196 504 2HB ASN 85 2HB ASN 85 7.889 -3.630 -1.458 505 1HD2 ASN 85 1HD2 ASN 85 8.773 -1.306 -1.445 506 2HD2 ASN 85 2HD2 ASN 85 10.484 -1.159 -1.132 507 H VAL 86 H VAL 86 6.624 -1.526 2.396 508 HA VAL 86 HA VAL 86 5.844 0.702 0.677 509 HB VAL 86 HB VAL 86 5.860 0.742 3.692 510 1HG1 VAL 86 1HG1 VAL 86 3.875 2.321 3.046 511 2HG1 VAL 86 2HG1 VAL 86 5.495 2.913 2.659 512 3HG1 VAL 86 3HG1 VAL 86 4.453 2.224 1.401 513 1HG2 VAL 86 1HG2 VAL 86 4.559 -1.276 2.992 514 2HG2 VAL 86 2HG2 VAL 86 3.628 -0.019 3.801 515 3HG2 VAL 86 3HG2 VAL 86 3.501 -0.198 2.058 516 H THR 87 H THR 87 8.011 1.037 -0.236 517 HA THR 87 HA THR 87 9.311 3.167 0.907 518 HB THR 87 HB THR 87 10.196 1.505 2.488 519 HG1 THR 87 HG1 THR 87 12.510 2.050 1.979 520 1HG2 THR 87 1HG2 THR 87 11.637 0.322 0.115 521 2HG2 THR 87 2HG2 THR 87 11.895 -0.102 1.821 522 3HG2 THR 87 3HG2 THR 87 10.322 -0.418 1.068 523 HA PRO 88 HA PRO 88 10.777 2.940 -3.372 524 1HB PRO 88 1HB PRO 88 12.840 4.812 -3.231 525 2HB PRO 88 2HB PRO 88 11.137 5.236 -3.474 526 1HG PRO 88 1HG PRO 88 12.718 5.481 -0.970 527 2HG PRO 88 2HG PRO 88 11.368 6.468 -1.563 528 1HD PRO 88 1HD PRO 88 11.152 4.498 0.379 529 2HD PRO 88 2HD PRO 88 9.816 5.108 -0.600 530 H MET 89 H MET 89 12.842 3.164 -0.491 531 HA MET 89 HA MET 89 14.145 0.708 -0.731 532 1HB MET 89 1HB MET 89 16.521 1.807 -1.159 533 2HB MET 89 2HB MET 89 15.538 1.199 -2.474 534 1HG MET 89 1HG MET 89 14.861 3.324 -3.202 535 2HG MET 89 2HG MET 89 15.442 4.159 -1.776 536 1HE MET 89 1HE MET 89 18.436 3.025 -1.426 537 2HE MET 89 2HE MET 89 19.319 4.163 -2.462 538 3HE MET 89 3HE MET 89 18.022 4.762 -1.408 539 H ALA 90 H ALA 90 15.768 3.723 0.004 540 HA ALA 90 HA ALA 90 16.811 2.964 2.402 541 1HB ALA 90 1HB ALA 90 16.159 5.756 1.408 542 2HB ALA 90 2HB ALA 90 17.430 5.345 2.594 543 3HB ALA 90 3HB ALA 90 17.573 4.800 0.910 544 H ALA 91 H ALA 91 13.636 4.493 1.965 545 HA ALA 91 HA ALA 91 13.607 5.609 4.672 546 1HB ALA 91 1HB ALA 91 11.399 6.466 4.028 547 2HB ALA 91 2HB ALA 91 12.639 6.829 2.797 548 3HB ALA 91 3HB ALA 91 11.466 5.543 2.506 549 H GLY 92 H GLY 92 10.625 4.138 3.683 550 1HA GLY 92 1HA GLY 92 9.300 2.631 4.761 551 2HA GLY 92 2HA GLY 92 10.762 1.801 5.278 552 H ALA 93 H ALA 93 11.954 3.342 7.139 553 HA ALA 93 HA ALA 93 10.367 3.238 9.446 554 1HB ALA 93 1HB ALA 93 12.157 4.574 10.504 555 2HB ALA 93 2HB ALA 93 12.826 3.296 9.468 556 3HB ALA 93 3HB ALA 93 12.808 4.982 8.902 557 H TYR 94 H TYR 94 11.034 5.948 7.290 558 HA TYR 94 HA TYR 94 9.330 7.840 8.706 559 1HB TYR 94 1HB TYR 94 10.550 8.067 5.953 560 2HB TYR 94 2HB TYR 94 9.945 9.366 6.985 561 HD1 TYR 94 HD1 TYR 94 11.072 9.007 9.596 562 HD2 TYR 94 HD2 TYR 94 12.914 7.966 5.835 563 HE1 TYR 94 HE1 TYR 94 13.308 9.187 10.630 564 HE2 TYR 94 HE2 TYR 94 15.150 8.370 6.843 565 HH TYR 94 HH TYR 94 16.303 8.925 8.706 566 H PHE 95 H PHE 95 8.307 5.152 7.199 567 HA PHE 95 HA PHE 95 6.036 6.455 5.890 568 1HB PHE 95 1HB PHE 95 6.830 4.147 5.015 569 2HB PHE 95 2HB PHE 95 6.468 3.526 6.613 570 HD1 PHE 95 HD1 PHE 95 4.841 1.895 6.046 571 HD2 PHE 95 HD2 PHE 95 4.242 6.013 4.818 572 HE1 PHE 95 HE1 PHE 95 2.491 1.419 5.423 573 HE2 PHE 95 HE2 PHE 95 1.871 5.589 4.590 574 HZ PHE 95 HZ PHE 95 1.045 3.289 4.546 575 H ASN 96 H ASN 96 3.971 6.511 6.894 576 HA ASN 96 HA ASN 96 4.040 5.873 9.732 577 1HB ASN 96 1HB ASN 96 2.251 7.713 8.127 578 2HB ASN 96 2HB ASN 96 1.791 7.136 9.739 579 1HD2 ASN 96 1HD2 ASN 96 3.429 9.715 8.250 580 2HD2 ASN 96 2HD2 ASN 96 4.440 10.105 9.661 581 H LYS 97 H LYS 97 3.497 3.858 10.210 582 HA LYS 97 HA LYS 97 0.715 3.155 9.802 583 1HB LYS 97 1HB LYS 97 2.283 2.201 7.824 584 2HB LYS 97 2HB LYS 97 2.653 0.964 9.005 585 1HG LYS 97 1HG LYS 97 0.811 0.063 7.865 586 2HG LYS 97 2HG LYS 97 0.052 0.800 9.279 587 1HD LYS 97 1HD LYS 97 -0.122 2.950 7.647 588 2HD LYS 97 2HD LYS 97 0.196 1.771 6.383 589 1HE LYS 97 1HE LYS 97 -2.174 2.055 6.519 590 2HE LYS 97 2HE LYS 97 -1.819 0.455 7.187 591 1HZ LYS 97 1HZ LYS 97 -3.366 1.751 8.611 592 2HZ LYS 97 2HZ LYS 97 -1.969 1.446 9.384 593 3HZ LYS 97 3HZ LYS 97 -2.230 2.914 8.831 594 H VAL 98 H VAL 98 2.132 3.946 12.069 595 HA VAL 98 HA VAL 98 3.594 2.014 13.382 596 HB VAL 98 HB VAL 98 3.652 4.341 13.956 597 1HG1 VAL 98 1HG1 VAL 98 1.255 4.951 13.798 598 2HG1 VAL 98 2HG1 VAL 98 0.928 4.028 15.281 599 3HG1 VAL 98 3HG1 VAL 98 1.982 5.444 15.335 600 1HG2 VAL 98 1HG2 VAL 98 2.818 2.702 16.384 601 2HG2 VAL 98 2HG2 VAL 98 4.418 2.660 15.611 602 3HG2 VAL 98 3HG2 VAL 98 3.835 4.153 16.368 603 H GLN 99 H GLN 99 0.037 2.482 13.700 604 HA GLN 99 HA GLN 99 -0.262 -0.323 14.165 605 1HB GLN 99 1HB GLN 99 -1.537 -0.178 16.256 606 2HB GLN 99 2HB GLN 99 0.146 0.303 16.508 607 1HG GLN 99 1HG GLN 99 -0.519 2.689 16.470 608 2HG GLN 99 2HG GLN 99 -2.206 2.227 16.182 609 1HE2 GLN 99 1HE2 GLN 99 -2.251 3.718 18.227 610 2HE2 GLN 99 2HE2 GLN 99 -2.188 2.844 19.747 611 H CYS 100 H CYS 100 -2.510 -0.922 13.705 612 HA CYS 100 HA CYS 100 -4.541 0.964 13.023 613 1HB CYS 100 1HB CYS 100 -2.709 1.414 11.238 614 2HB CYS 100 2HB CYS 100 -2.995 -0.249 10.685 615 HG CYS 100 HG CYS 100 -4.878 2.438 10.773 616 H PHE 101 H PHE 101 -6.218 -0.353 11.615 617 HA PHE 101 HA PHE 101 -6.785 -2.976 12.409 618 1HB PHE 101 1HB PHE 101 -7.221 -1.642 9.701 619 2HB PHE 101 2HB PHE 101 -8.014 -3.110 10.240 620 HD1 PHE 101 HD1 PHE 101 -9.686 -3.069 12.096 621 HD2 PHE 101 HD2 PHE 101 -8.014 0.554 10.443 622 HE1 PHE 101 HE1 PHE 101 -11.552 -1.758 13.064 623 HE2 PHE 101 HE2 PHE 101 -9.864 1.858 11.445 624 HZ PHE 101 HZ PHE 101 -11.644 0.706 12.744 625 H CYS 102 H CYS 102 -5.979 -4.976 11.846 626 HA CYS 102 HA CYS 102 -3.513 -5.174 10.341 627 1HB CYS 102 1HB CYS 102 -4.000 -6.640 12.275 628 2HB CYS 102 2HB CYS 102 -5.335 -7.386 11.363 629 HG CYS 102 HG CYS 102 -2.117 -7.190 10.631 630 H PHE 103 H PHE 103 -4.415 -4.095 8.428 631 HA PHE 103 HA PHE 103 -6.220 -5.411 6.631 632 1HB PHE 103 1HB PHE 103 -5.654 -3.096 6.269 633 2HB PHE 103 2HB PHE 103 -3.930 -3.472 6.197 634 HD1 PHE 103 HD1 PHE 103 -2.887 -3.769 4.100 635 HD2 PHE 103 HD2 PHE 103 -7.135 -4.441 4.446 636 HE1 PHE 103 HE1 PHE 103 -3.037 -4.085 1.664 637 HE2 PHE 103 HE2 PHE 103 -7.252 -4.830 1.992 638 HZ PHE 103 HZ PHE 103 -5.209 -4.646 0.601 639 H THR 104 H THR 104 -5.935 -7.080 5.205 640 HA THR 104 HA THR 104 -3.481 -7.711 4.000 641 HB THR 104 HB THR 104 -2.840 -8.912 5.978 642 HG1 THR 104 HG1 THR 104 -2.639 -10.065 3.930 643 1HG2 THR 104 1HG2 THR 104 -4.247 -10.693 6.982 644 2HG2 THR 104 2HG2 THR 104 -4.984 -9.095 7.159 645 3HG2 THR 104 3HG2 THR 104 -5.594 -10.223 5.926 646 H GLU 105 H GLU 105 -3.884 -9.635 2.608 647 HA GLU 105 HA GLU 105 -6.391 -9.126 1.160 648 1HB GLU 105 1HB GLU 105 -5.163 -10.427 -0.644 649 2HB GLU 105 2HB GLU 105 -4.571 -8.825 -0.209 650 1HG GLU 105 1HG GLU 105 -3.327 -11.334 0.916 651 2HG GLU 105 2HG GLU 105 -2.802 -10.597 -0.609 652 H THR 106 H THR 106 -4.874 -11.685 3.010 653 HA THR 106 HA THR 106 -5.624 -13.714 3.693 654 HB THR 106 HB THR 106 -6.932 -12.172 5.000 655 HG1 THR 106 HG1 THR 106 -8.469 -13.654 5.652 656 1HG2 THR 106 1HG2 THR 106 -9.120 -12.440 2.894 657 2HG2 THR 106 2HG2 THR 106 -9.372 -11.838 4.541 658 3HG2 THR 106 3HG2 THR 106 -8.317 -10.953 3.446 659 H THR 107 H THR 107 -8.396 -14.708 3.245 660 HA THR 107 HA THR 107 -7.927 -15.971 0.570 661 HB THR 107 HB THR 107 -8.529 -17.026 3.290 662 HG1 THR 107 HG1 THR 107 -7.522 -18.206 0.931 663 1HG2 THR 107 1HG2 THR 107 -9.686 -19.042 2.474 664 2HG2 THR 107 2HG2 THR 107 -10.702 -17.611 2.282 665 3HG2 THR 107 3HG2 THR 107 -9.882 -18.317 0.872 666 H LEU 108 H LEU 108 -9.696 -16.422 -0.739 667 HA LEU 108 HA LEU 108 -12.329 -15.460 0.067 668 1HB LEU 108 1HB LEU 108 -10.775 -14.321 -2.300 669 2HB LEU 108 2HB LEU 108 -12.521 -14.447 -2.334 670 HG LEU 108 HG LEU 108 -10.918 -12.760 -0.395 671 1HD1 LEU 108 1HD1 LEU 108 -11.062 -11.825 -2.637 672 2HD1 LEU 108 2HD1 LEU 108 -12.796 -12.190 -2.738 673 3HD1 LEU 108 3HD1 LEU 108 -12.233 -10.976 -1.595 674 1HD2 LEU 108 1HD2 LEU 108 -12.880 -13.508 0.852 675 2HD2 LEU 108 2HD2 LEU 108 -13.202 -11.880 0.272 676 3HD2 LEU 108 3HD2 LEU 108 -13.926 -13.265 -0.566 677 H GLU 109 H GLU 109 -13.871 -16.567 -0.738 678 HA GLU 109 HA GLU 109 -13.692 -18.916 -2.248 679 1HB GLU 109 1HB GLU 109 -15.909 -17.047 -1.330 680 2HB GLU 109 2HB GLU 109 -16.285 -18.517 -2.191 681 1HG GLU 109 1HG GLU 109 -16.446 -18.908 0.199 682 2HG GLU 109 2HG GLU 109 -15.122 -19.870 -0.468 683 HA PRO 110 HA PRO 110 -13.577 -17.788 -6.362 684 1HB PRO 110 1HB PRO 110 -15.186 -19.556 -7.698 685 2HB PRO 110 2HB PRO 110 -13.708 -19.991 -6.798 686 1HG PRO 110 1HG PRO 110 -16.563 -20.131 -5.800 687 2HG PRO 110 2HG PRO 110 -15.346 -21.442 -5.786 688 1HD PRO 110 1HD PRO 110 -15.744 -19.906 -3.623 689 2HD PRO 110 2HD PRO 110 -14.082 -20.336 -4.086 690 H GLY 111 H GLY 111 -14.284 -15.707 -6.728 691 1HA GLY 111 1HA GLY 111 -15.696 -14.572 -8.348 692 2HA GLY 111 2HA GLY 111 -17.125 -15.353 -7.653 693 H GLU 112 H GLU 112 -15.258 -14.722 -4.987 694 HA GLU 112 HA GLU 112 -16.923 -12.500 -4.362 695 1HB GLU 112 1HB GLU 112 -14.586 -13.795 -2.935 696 2HB GLU 112 2HB GLU 112 -15.686 -12.620 -2.218 697 1HG GLU 112 1HG GLU 112 -16.435 -15.357 -3.155 698 2HG GLU 112 2HG GLU 112 -16.399 -14.729 -1.506 699 H GLU 113 H GLU 113 -16.006 -10.455 -3.331 700 HA GLU 113 HA GLU 113 -13.608 -9.492 -4.813 701 1HB GLU 113 1HB GLU 113 -16.150 -8.571 -5.304 702 2HB GLU 113 2HB GLU 113 -15.598 -7.424 -4.065 703 1HG GLU 113 1HG GLU 113 -13.522 -7.240 -5.500 704 2HG GLU 113 2HG GLU 113 -14.472 -8.186 -6.686 705 H MET 114 H MET 114 -11.974 -8.764 -3.605 706 HA MET 114 HA MET 114 -12.282 -8.394 -0.699 707 1HB MET 114 1HB MET 114 -10.420 -9.800 -1.508 708 2HB MET 114 2HB MET 114 -9.933 -8.533 -2.622 709 1HG MET 114 1HG MET 114 -8.560 -8.621 -0.628 710 2HG MET 114 2HG MET 114 -9.373 -7.062 -0.735 711 1HE MET 114 1HE MET 114 -9.137 -6.256 1.712 712 2HE MET 114 2HE MET 114 -9.112 -7.406 3.077 713 3HE MET 114 3HE MET 114 -7.951 -7.577 1.742 714 H GLU 115 H GLU 115 -12.688 -6.316 -0.075 715 HA GLU 115 HA GLU 115 -10.766 -4.395 -1.017 716 1HB GLU 115 1HB GLU 115 -12.185 -2.522 -1.412 717 2HB GLU 115 2HB GLU 115 -12.649 -3.826 -2.505 718 1HG GLU 115 1HG GLU 115 -14.610 -4.335 -1.069 719 2HG GLU 115 2HG GLU 115 -14.152 -3.020 0.032 720 H MET 116 H MET 116 -10.077 -3.032 0.552 721 HA MET 116 HA MET 116 -11.677 -2.393 2.851 722 1HB MET 116 1HB MET 116 -8.979 -3.790 3.147 723 2HB MET 116 2HB MET 116 -9.755 -2.847 4.421 724 1HG MET 116 1HG MET 116 -11.709 -4.410 4.315 725 2HG MET 116 2HG MET 116 -10.820 -5.398 3.163 726 1HE MET 116 1HE MET 116 -9.275 -3.659 6.460 727 2HE MET 116 2HE MET 116 -10.944 -4.136 6.872 728 3HE MET 116 3HE MET 116 -9.561 -4.995 7.590 729 HA PRO 117 HA PRO 117 -9.074 1.165 1.869 730 1HB PRO 117 1HB PRO 117 -9.416 2.725 4.097 731 2HB PRO 117 2HB PRO 117 -10.547 2.596 2.719 732 1HG PRO 117 1HG PRO 117 -10.798 1.375 5.425 733 2HG PRO 117 2HG PRO 117 -12.032 1.914 4.232 734 1HD PRO 117 1HD PRO 117 -11.203 -0.767 4.697 735 2HD PRO 117 2HD PRO 117 -12.157 -0.167 3.307 736 H VAL 118 H VAL 118 -7.041 1.633 2.046 737 HA VAL 118 HA VAL 118 -5.500 0.962 4.506 738 HB VAL 118 HB VAL 118 -4.632 1.263 1.603 739 1HG1 VAL 118 1HG1 VAL 118 -2.856 1.325 4.065 740 2HG1 VAL 118 2HG1 VAL 118 -2.300 1.091 2.394 741 3HG1 VAL 118 3HG1 VAL 118 -3.057 2.617 2.849 742 1HG2 VAL 118 1HG2 VAL 118 -4.201 -0.913 3.684 743 2HG2 VAL 118 2HG2 VAL 118 -5.330 -0.987 2.316 744 3HG2 VAL 118 3HG2 VAL 118 -3.586 -0.929 2.020 745 H VAL 119 H VAL 119 -4.298 2.756 5.316 746 HA VAL 119 HA VAL 119 -5.251 5.437 4.463 747 HB VAL 119 HB VAL 119 -6.450 4.789 6.465 748 1HG1 VAL 119 1HG1 VAL 119 -3.745 4.366 7.809 749 2HG1 VAL 119 2HG1 VAL 119 -5.330 4.333 8.596 750 3HG1 VAL 119 3HG1 VAL 119 -4.920 3.085 7.415 751 1HG2 VAL 119 1HG2 VAL 119 -5.824 6.660 7.894 752 2HG2 VAL 119 2HG2 VAL 119 -4.222 6.734 7.129 753 3HG2 VAL 119 3HG2 VAL 119 -5.681 7.129 6.184 754 H PHE 120 H PHE 120 -3.581 6.966 4.294 755 HA PHE 120 HA PHE 120 -0.826 6.066 4.953 756 1HB PHE 120 1HB PHE 120 -1.840 5.141 2.681 757 2HB PHE 120 2HB PHE 120 -1.717 6.792 2.111 758 HD1 PHE 120 HD1 PHE 120 0.776 7.879 2.398 759 HD2 PHE 120 HD2 PHE 120 -0.140 3.669 2.140 760 HE1 PHE 120 HE1 PHE 120 3.178 7.351 2.109 761 HE2 PHE 120 HE2 PHE 120 2.191 3.230 1.436 762 HZ PHE 120 HZ PHE 120 3.862 5.064 1.435 763 H PHE 121 H PHE 121 0.508 7.692 5.417 764 HA PHE 121 HA PHE 121 0.599 9.977 3.699 765 1HB PHE 121 1HB PHE 121 0.683 11.601 5.504 766 2HB PHE 121 2HB PHE 121 -0.881 10.821 5.397 767 HD1 PHE 121 HD1 PHE 121 -1.414 8.829 6.970 768 HD2 PHE 121 HD2 PHE 121 1.744 11.698 7.693 769 HE1 PHE 121 HE1 PHE 121 -1.205 8.041 9.265 770 HE2 PHE 121 HE2 PHE 121 1.772 11.048 10.057 771 HZ PHE 121 HZ PHE 121 0.528 9.029 10.763 772 H VAL 122 H VAL 122 2.723 11.042 4.013 773 HA VAL 122 HA VAL 122 4.796 9.075 4.869 774 HB VAL 122 HB VAL 122 5.014 11.758 3.468 775 1HG1 VAL 122 1HG1 VAL 122 7.304 10.828 2.797 776 2HG1 VAL 122 2HG1 VAL 122 7.137 11.314 4.481 777 3HG1 VAL 122 3HG1 VAL 122 7.068 9.594 4.049 778 1HG2 VAL 122 1HG2 VAL 122 5.483 10.328 1.428 779 2HG2 VAL 122 2HG2 VAL 122 4.959 8.924 2.387 780 3HG2 VAL 122 3HG2 VAL 122 3.823 10.223 2.009 781 H ASP 123 H ASP 123 6.550 9.826 6.399 782 HA ASP 123 HA ASP 123 5.481 11.846 8.278 783 1HB ASP 123 1HB ASP 123 6.434 9.439 8.892 784 2HB ASP 123 2HB ASP 123 7.968 10.296 8.877 785 HA PRO 124 HA PRO 124 8.684 14.600 6.655 786 1HB PRO 124 1HB PRO 124 8.367 16.747 8.362 787 2HB PRO 124 2HB PRO 124 7.323 16.312 7.005 788 1HG PRO 124 1HG PRO 124 6.921 15.685 9.940 789 2HG PRO 124 2HG PRO 124 5.703 16.340 8.801 790 1HD PRO 124 1HD PRO 124 5.855 13.709 9.458 791 2HD PRO 124 2HD PRO 124 5.348 14.238 7.832 792 H GLU 125 H GLU 125 9.604 12.451 8.187 793 HA GLU 125 HA GLU 125 11.972 13.807 9.302 794 1HB GLU 125 1HB GLU 125 12.323 11.326 10.327 795 2HB GLU 125 2HB GLU 125 11.852 12.821 11.107 796 1HG GLU 125 1HG GLU 125 9.588 12.380 11.044 797 2HG GLU 125 2HG GLU 125 9.841 10.923 10.063 798 H ILE 126 H ILE 126 10.811 11.970 6.674 799 HA ILE 126 HA ILE 126 13.159 10.629 5.959 800 HB ILE 126 HB ILE 126 10.938 10.582 4.849 801 1HG1 ILE 126 1HG1 ILE 126 13.283 10.989 2.948 802 2HG1 ILE 126 2HG1 ILE 126 13.060 9.578 4.007 803 1HG2 ILE 126 1HG2 ILE 126 11.876 13.020 3.292 804 2HG2 ILE 126 2HG2 ILE 126 10.356 12.134 3.103 805 3HG2 ILE 126 3HG2 ILE 126 10.641 13.070 4.574 806 1HD1 ILE 126 1HD1 ILE 126 11.212 10.418 1.775 807 2HD1 ILE 126 2HD1 ILE 126 12.213 8.953 1.935 808 3HD1 ILE 126 3HD1 ILE 126 10.825 9.192 3.014 809 H VAL 127 H VAL 127 12.429 14.058 5.747 810 HA VAL 127 HA VAL 127 15.145 14.736 4.812 811 HB VAL 127 HB VAL 127 14.302 17.082 5.030 812 1HG1 VAL 127 1HG1 VAL 127 12.682 15.244 3.226 813 2HG1 VAL 127 2HG1 VAL 127 12.935 16.986 3.010 814 3HG1 VAL 127 3HG1 VAL 127 14.308 15.872 2.889 815 1HG2 VAL 127 1HG2 VAL 127 11.946 17.539 5.264 816 2HG2 VAL 127 2HG2 VAL 127 11.535 15.824 5.383 817 3HG2 VAL 127 3HG2 VAL 127 12.431 16.619 6.693 818 H LYS 128 H LYS 128 15.556 13.288 6.954 819 HA LYS 128 HA LYS 128 16.541 15.372 8.867 820 1HB LYS 128 1HB LYS 128 15.564 12.621 9.591 821 2HB LYS 128 2HB LYS 128 16.808 13.459 10.537 822 1HG LYS 128 1HG LYS 128 15.287 15.364 10.886 823 2HG LYS 128 2HG LYS 128 14.064 14.569 9.886 824 1HD LYS 128 1HD LYS 128 14.031 12.657 11.517 825 2HD LYS 128 2HD LYS 128 15.193 13.506 12.534 826 1HE LYS 128 1HE LYS 128 13.658 15.264 13.076 827 2HE LYS 128 2HE LYS 128 12.557 14.836 11.771 828 1HZ LYS 128 1HZ LYS 128 12.932 13.257 14.268 829 2HZ LYS 128 2HZ LYS 128 11.636 14.133 13.822 830 3HZ LYS 128 3HZ LYS 128 12.001 12.764 13.048 831 HA PRO 129 HA PRO 129 20.395 12.987 8.252 832 1HB PRO 129 1HB PRO 129 20.647 10.381 7.596 833 2HB PRO 129 2HB PRO 129 20.047 10.872 9.202 834 1HG PRO 129 1HG PRO 129 18.408 10.142 6.763 835 2HG PRO 129 2HG PRO 129 18.289 9.435 8.397 836 1HD PRO 129 1HD PRO 129 16.635 11.468 7.636 837 2HD PRO 129 2HD PRO 129 17.322 11.375 9.288 838 H VAL 130 H VAL 130 21.992 12.394 6.496 839 HA VAL 130 HA VAL 130 21.254 13.805 4.165 840 HB VAL 130 HB VAL 130 23.437 13.975 5.093 841 1HG1 VAL 130 1HG1 VAL 130 23.869 11.747 6.025 842 2HG1 VAL 130 2HG1 VAL 130 23.940 11.052 4.386 843 3HG1 VAL 130 3HG1 VAL 130 25.150 12.226 4.915 844 1HG2 VAL 130 1HG2 VAL 130 23.577 12.604 2.393 845 2HG2 VAL 130 2HG2 VAL 130 23.084 14.293 2.675 846 3HG2 VAL 130 3HG2 VAL 130 24.737 13.770 3.070 847 H GLU 131 H GLU 131 21.788 10.341 4.839 848 HA GLU 131 HA GLU 131 21.672 9.168 2.356 849 1HB GLU 131 1HB GLU 131 20.328 8.150 4.877 850 2HB GLU 131 2HB GLU 131 20.796 7.221 3.442 851 1HG GLU 131 1HG GLU 131 22.703 6.862 4.566 852 2HG GLU 131 2HG GLU 131 23.195 8.441 3.991 853 H THR 132 H THR 132 18.758 9.907 4.370 854 HA THR 132 HA THR 132 17.132 9.170 2.057 855 HB THR 132 HB THR 132 15.244 9.487 3.671 856 HG1 THR 132 HG1 THR 132 16.102 10.856 5.185 857 1HG2 THR 132 1HG2 THR 132 16.318 7.305 3.241 858 2HG2 THR 132 2HG2 THR 132 17.473 7.601 4.561 859 3HG2 THR 132 3HG2 THR 132 15.741 7.421 4.902 860 H GLN 133 H GLN 133 18.505 12.096 3.184 861 HA GLN 133 HA GLN 133 16.549 13.990 2.889 862 1HB GLN 133 1HB GLN 133 19.278 14.095 3.174 863 2HB GLN 133 2HB GLN 133 19.154 14.557 1.503 864 1HG GLN 133 1HG GLN 133 19.121 16.571 2.705 865 2HG GLN 133 2HG GLN 133 17.452 16.328 2.188 866 1HE2 GLN 133 1HE2 GLN 133 18.342 14.236 4.913 867 2HE2 GLN 133 2HE2 GLN 133 17.884 15.343 6.165 868 H GLY 134 H GLY 134 18.309 12.358 0.278 869 1HA GLY 134 1HA GLY 134 17.166 13.937 -1.884 870 2HA GLY 134 2HA GLY 134 18.145 12.469 -2.019 871 H ILE 135 H ILE 135 16.086 11.114 -0.071 872 HA ILE 135 HA ILE 135 14.565 9.938 -2.286 873 HB ILE 135 HB ILE 135 14.723 9.293 0.657 874 1HG1 ILE 135 1HG1 ILE 135 16.755 8.753 -0.730 875 2HG1 ILE 135 2HG1 ILE 135 15.904 7.375 -0.036 876 1HG2 ILE 135 1HG2 ILE 135 12.469 8.716 -0.181 877 2HG2 ILE 135 2HG2 ILE 135 13.178 7.899 -1.561 878 3HG2 ILE 135 3HG2 ILE 135 13.447 7.276 0.098 879 1HD1 ILE 135 1HD1 ILE 135 16.682 6.945 -2.336 880 2HD1 ILE 135 2HD1 ILE 135 14.943 6.724 -2.115 881 3HD1 ILE 135 3HD1 ILE 135 15.564 8.181 -2.937 882 H LYS 136 H LYS 136 12.506 10.555 -2.799 883 HA LYS 136 HA LYS 136 10.761 11.515 -0.684 884 1HB LYS 136 1HB LYS 136 10.267 13.659 -1.751 885 2HB LYS 136 2HB LYS 136 11.823 13.540 -0.947 886 1HG LYS 136 1HG LYS 136 13.022 13.339 -3.018 887 2HG LYS 136 2HG LYS 136 11.514 13.125 -3.947 888 1HD LYS 136 1HD LYS 136 10.678 15.289 -3.148 889 2HD LYS 136 2HD LYS 136 12.148 15.520 -2.185 890 1HE LYS 136 1HE LYS 136 13.507 15.631 -4.271 891 2HE LYS 136 2HE LYS 136 12.064 15.306 -5.249 892 1HZ LYS 136 1HZ LYS 136 12.467 17.690 -3.557 893 2HZ LYS 136 2HZ LYS 136 12.585 17.643 -5.197 894 3HZ LYS 136 3HZ LYS 136 11.134 17.380 -4.468 895 H THR 137 H THR 137 10.198 9.227 -1.893 896 HA THR 137 HA THR 137 7.624 9.963 -2.632 897 HB THR 137 HB THR 137 8.851 8.082 -4.727 898 HG1 THR 137 HG1 THR 137 8.799 10.889 -4.720 899 1HG2 THR 137 1HG2 THR 137 6.467 7.982 -4.368 900 2HG2 THR 137 2HG2 THR 137 6.351 9.744 -4.608 901 3HG2 THR 137 3HG2 THR 137 6.856 8.692 -5.958 902 H LEU 138 H LEU 138 6.646 8.725 -1.095 903 HA LEU 138 HA LEU 138 8.191 6.407 -0.189 904 1HB LEU 138 1HB LEU 138 6.663 8.204 1.113 905 2HB LEU 138 2HB LEU 138 5.572 6.781 1.127 906 HG LEU 138 HG LEU 138 7.744 5.531 1.779 907 1HD1 LEU 138 1HD1 LEU 138 9.321 6.718 3.156 908 2HD1 LEU 138 2HD1 LEU 138 9.368 7.366 1.506 909 3HD1 LEU 138 3HD1 LEU 138 8.536 8.271 2.792 910 1HD2 LEU 138 1HD2 LEU 138 7.369 6.095 4.215 911 2HD2 LEU 138 2HD2 LEU 138 6.231 7.347 3.738 912 3HD2 LEU 138 3HD2 LEU 138 5.897 5.654 3.336 913 H THR 139 H THR 139 8.163 5.192 -2.039 914 HA THR 139 HA THR 139 5.684 4.525 -3.294 915 HB THR 139 HB THR 139 8.534 4.259 -3.908 916 HG1 THR 139 HG1 THR 139 6.151 4.112 -5.424 917 1HG2 THR 139 1HG2 THR 139 6.841 1.897 -4.827 918 2HG2 THR 139 2HG2 THR 139 8.461 2.336 -5.383 919 3HG2 THR 139 3HG2 THR 139 8.231 1.806 -3.714 920 H LEU 140 H LEU 140 4.672 2.488 -3.501 921 HA LEU 140 HA LEU 140 5.423 0.542 -1.356 922 1HB LEU 140 1HB LEU 140 3.302 1.861 -0.954 923 2HB LEU 140 2HB LEU 140 2.619 1.108 -2.400 924 HG LEU 140 HG LEU 140 3.676 -0.488 -0.041 925 1HD1 LEU 140 1HD1 LEU 140 1.827 1.040 0.696 926 2HD1 LEU 140 2HD1 LEU 140 0.797 0.394 -0.598 927 3HD1 LEU 140 3HD1 LEU 140 1.324 -0.656 0.731 928 1HD2 LEU 140 1HD2 LEU 140 1.855 -1.191 -2.360 929 2HD2 LEU 140 2HD2 LEU 140 3.429 -1.914 -1.941 930 3HD2 LEU 140 3HD2 LEU 140 2.042 -2.203 -0.909 931 H SER 141 H SER 141 6.353 -1.110 -2.416 932 HA SER 141 HA SER 141 5.424 -1.965 -5.137 933 1HB SER 141 1HB SER 141 7.707 -2.028 -5.204 934 2HB SER 141 2HB SER 141 7.889 -2.391 -3.487 935 HG SER 141 HG SER 141 7.109 -4.515 -3.950 936 H TYR 142 H TYR 142 3.590 -3.127 -5.020 937 HA TYR 142 HA TYR 142 3.234 -5.081 -2.795 938 1HB TYR 142 1HB TYR 142 1.517 -3.064 -3.630 939 2HB TYR 142 2HB TYR 142 0.915 -4.439 -4.525 940 HD1 TYR 142 HD1 TYR 142 -0.258 -2.704 -2.101 941 HD2 TYR 142 HD2 TYR 142 1.366 -6.683 -2.525 942 HE1 TYR 142 HE1 TYR 142 -1.549 -3.458 -0.135 943 HE2 TYR 142 HE2 TYR 142 0.214 -7.365 -0.464 944 HH TYR 142 HH TYR 142 -1.618 -6.871 0.870 945 H THR 143 H THR 143 3.319 -7.225 -3.406 946 HA THR 143 HA THR 143 3.010 -7.894 -6.311 947 HB THR 143 HB THR 143 4.996 -9.233 -4.450 948 HG1 THR 143 HG1 THR 143 6.533 -7.793 -5.393 949 1HG2 THR 143 1HG2 THR 143 6.062 -9.863 -6.560 950 2HG2 THR 143 2HG2 THR 143 4.341 -10.273 -6.683 951 3HG2 THR 143 3HG2 THR 143 4.960 -8.818 -7.481 952 H PHE 144 H PHE 144 0.879 -8.498 -6.104 953 HA PHE 144 HA PHE 144 0.100 -10.724 -4.386 954 1HB PHE 144 1HB PHE 144 -1.086 -9.210 -6.724 955 2HB PHE 144 2HB PHE 144 -1.729 -10.757 -6.233 956 HD1 PHE 144 HD1 PHE 144 -0.526 -8.433 -3.589 957 HD2 PHE 144 HD2 PHE 144 -3.890 -9.713 -5.975 958 HE1 PHE 144 HE1 PHE 144 -2.093 -7.529 -1.895 959 HE2 PHE 144 HE2 PHE 144 -5.431 -8.712 -4.315 960 HZ PHE 144 HZ PHE 144 -4.529 -7.582 -2.296 961 H TYR 145 H TYR 145 2.078 -11.999 -4.865 962 HA TYR 145 HA TYR 145 1.427 -13.899 -7.071 963 1HB TYR 145 1HB TYR 145 3.551 -14.032 -7.909 964 2HB TYR 145 2HB TYR 145 3.227 -12.311 -7.778 965 HD1 TYR 145 HD1 TYR 145 5.901 -13.652 -8.219 966 HD2 TYR 145 HD2 TYR 145 3.979 -12.413 -4.552 967 HE1 TYR 145 HE1 TYR 145 8.098 -13.446 -7.118 968 HE2 TYR 145 HE2 TYR 145 6.172 -12.138 -3.496 969 HH TYR 145 HH TYR 145 9.224 -12.938 -5.171 970 HA PRO 146 HA PRO 146 2.677 -16.088 -3.118 971 1HB PRO 146 1HB PRO 146 0.351 -16.717 -1.839 972 2HB PRO 146 2HB PRO 146 1.191 -15.150 -1.693 973 1HG PRO 146 1HG PRO 146 -1.180 -15.765 -3.463 974 2HG PRO 146 2HG PRO 146 -0.891 -14.371 -2.392 975 1HD PRO 146 1HD PRO 146 -0.356 -14.248 -5.073 976 2HD PRO 146 2HD PRO 146 0.569 -13.367 -3.811 977 H ARG 147 H ARG 147 -0.538 -17.574 -3.836 978 HA ARG 147 HA ARG 147 0.666 -19.763 -5.335 979 1HB ARG 147 1HB ARG 147 -0.076 -21.409 -3.525 980 2HB ARG 147 2HB ARG 147 1.470 -20.582 -3.314 981 1HG ARG 147 1HG ARG 147 0.739 -19.286 -1.534 982 2HG ARG 147 2HG ARG 147 -0.948 -19.302 -2.041 983 1HD ARG 147 1HD ARG 147 -0.609 -20.624 -0.011 984 2HD ARG 147 2HD ARG 147 -1.255 -21.574 -1.374 985 HE ARG 147 HE ARG 147 1.626 -21.699 -1.272 986 1HH1 ARG 147 1HH1 ARG 147 -1.243 -22.942 0.338 987 2HH1 ARG 147 2HH1 ARG 147 -0.544 -24.457 0.818 988 1HH2 ARG 147 1HH2 ARG 147 2.624 -23.704 -0.645 989 2HH2 ARG 147 2HH2 ARG 147 1.732 -24.885 0.254 990 H GLU 148 H GLU 148 -0.885 -20.070 -6.849 991 HA GLU 148 HA GLU 148 -3.728 -20.095 -5.972 992 1HB GLU 148 1HB GLU 148 -4.342 -19.331 -8.140 993 2HB GLU 148 2HB GLU 148 -3.103 -18.235 -7.519 994 1HG GLU 148 1HG GLU 148 -1.409 -19.298 -8.951 995 2HG GLU 148 2HG GLU 148 -2.614 -20.435 -9.562 996 HA PRO 149 HA PRO 149 -3.470 -24.280 -7.787 997 1HB PRO 149 1HB PRO 149 -6.092 -25.032 -7.582 998 2HB PRO 149 2HB PRO 149 -4.945 -25.002 -6.223 999 1HG PRO 149 1HG PRO 149 -7.101 -23.017 -6.832 1000 2HG PRO 149 2HG PRO 149 -6.526 -23.595 -5.259 1001 1HD PRO 149 1HD PRO 149 -5.770 -21.186 -6.525 1002 2HD PRO 149 2HD PRO 149 -4.885 -21.976 -5.186 1003 H SER 150 H SER 150 -2.920 -22.613 -9.520 1004 HA SER 150 HA SER 150 -3.039 -21.779 -11.620 1005 1HB SER 150 1HB SER 150 -2.358 -24.210 -11.644 1006 2HB SER 150 2HB SER 150 -3.998 -24.601 -12.187 1007 HG SER 150 HG SER 150 -2.164 -22.843 -13.490 1008 H LYS 151 H LYS 151 -4.614 -20.129 -11.823 1009 HA LYS 151 HA LYS 151 -7.245 -21.007 -12.953 1010 1HB LYS 151 1HB LYS 151 -6.563 -18.603 -11.231 1011 2HB LYS 151 2HB LYS 151 -8.170 -18.955 -11.847 1012 1HG LYS 151 1HG LYS 151 -6.559 -20.626 -9.859 1013 2HG LYS 151 2HG LYS 151 -7.959 -19.617 -9.515 1014 1HD LYS 151 1HD LYS 151 -9.332 -21.105 -11.067 1015 2HD LYS 151 2HD LYS 151 -7.917 -22.168 -11.201 1016 1HE LYS 151 1HE LYS 151 -7.842 -22.419 -8.752 1017 2HE LYS 151 2HE LYS 151 -9.339 -21.500 -8.598 1018 1HZ LYS 151 1HZ LYS 151 -8.991 -24.098 -9.904 1019 2HZ LYS 151 2HZ LYS 151 -9.820 -23.727 -8.511 1020 3HZ LYS 151 3HZ LYS 151 -10.397 -23.209 -9.974 Start of MODEL 5 1 H VAL 21 H VAL 21 -1.587 10.247 14.930 2 HA VAL 21 HA VAL 21 -3.247 8.015 15.851 3 HB VAL 21 HB VAL 21 -2.541 9.827 17.230 4 1HG1 VAL 21 1HG1 VAL 21 -4.494 11.693 15.818 5 2HG1 VAL 21 2HG1 VAL 21 -3.482 12.053 17.217 6 3HG1 VAL 21 3HG1 VAL 21 -2.729 11.762 15.646 7 1HG2 VAL 21 1HG2 VAL 21 -4.596 10.164 18.479 8 2HG2 VAL 21 2HG2 VAL 21 -5.579 9.723 17.075 9 3HG2 VAL 21 3HG2 VAL 21 -4.530 8.512 17.843 10 H GLU 22 H GLU 22 -3.385 7.739 13.384 11 HA GLU 22 HA GLU 22 -4.151 8.128 11.303 12 1HB GLU 22 1HB GLU 22 -5.949 6.671 12.463 13 2HB GLU 22 2HB GLU 22 -6.978 8.110 12.384 14 1HG GLU 22 1HG GLU 22 -6.615 8.174 9.883 15 2HG GLU 22 2HG GLU 22 -5.568 6.760 10.020 16 H GLN 23 H GLN 23 -3.300 10.430 12.495 17 HA GLN 23 HA GLN 23 -4.243 12.303 10.629 18 1HB GLN 23 1HB GLN 23 -4.803 12.785 13.613 19 2HB GLN 23 2HB GLN 23 -4.314 14.114 12.610 20 1HG GLN 23 1HG GLN 23 -6.840 12.511 12.197 21 2HG GLN 23 2HG GLN 23 -6.685 14.201 12.683 22 1HE2 GLN 23 1HE2 GLN 23 -4.656 15.138 10.849 23 2HE2 GLN 23 2HE2 GLN 23 -5.213 14.831 9.212 24 H ALA 24 H ALA 24 -2.805 14.078 10.634 25 HA ALA 24 HA ALA 24 -0.571 14.042 12.537 26 1HB ALA 24 1HB ALA 24 0.200 13.169 10.276 27 2HB ALA 24 2HB ALA 24 -0.404 14.672 9.570 28 3HB ALA 24 3HB ALA 24 0.940 14.731 10.732 29 H SER 25 H SER 25 -0.434 16.196 13.364 30 HA SER 25 HA SER 25 -1.620 18.428 11.965 31 1HB SER 25 1HB SER 25 -3.244 18.926 13.938 32 2HB SER 25 2HB SER 25 -3.726 17.689 12.773 33 HG SER 25 HG SER 25 -2.893 16.110 14.232 34 H ASP 26 H ASP 26 0.825 17.895 12.613 35 HA ASP 26 HA ASP 26 1.729 20.147 14.247 36 1HB ASP 26 1HB ASP 26 1.601 18.550 16.044 37 2HB ASP 26 2HB ASP 26 2.213 17.229 15.037 38 H LEU 27 H LEU 27 2.617 17.062 12.866 39 HA LEU 27 HA LEU 27 5.033 17.654 11.569 40 1HB LEU 27 1HB LEU 27 2.847 15.770 10.616 41 2HB LEU 27 2HB LEU 27 4.547 15.655 10.234 42 HG LEU 27 HG LEU 27 3.290 15.186 12.975 43 1HD1 LEU 27 1HD1 LEU 27 2.937 13.378 11.337 44 2HD1 LEU 27 2HD1 LEU 27 4.686 13.293 11.046 45 3HD1 LEU 27 3HD1 LEU 27 4.027 12.883 12.643 46 1HD2 LEU 27 1HD2 LEU 27 5.500 16.213 13.301 47 2HD2 LEU 27 2HD2 LEU 27 5.561 14.493 13.687 48 3HD2 LEU 27 3HD2 LEU 27 6.225 15.072 12.148 49 H ILE 28 H ILE 28 1.749 18.441 10.620 50 HA ILE 28 HA ILE 28 2.289 18.787 7.818 51 HB ILE 28 HB ILE 28 -0.084 19.740 9.470 52 1HG1 ILE 28 1HG1 ILE 28 0.719 17.146 8.120 53 2HG1 ILE 28 2HG1 ILE 28 0.094 17.427 9.748 54 1HG2 ILE 28 1HG2 ILE 28 -1.259 19.790 7.368 55 2HG2 ILE 28 2HG2 ILE 28 0.170 20.796 7.155 56 3HG2 ILE 28 3HG2 ILE 28 0.158 19.143 6.506 57 1HD1 ILE 28 1HD1 ILE 28 -2.134 18.012 8.860 58 2HD1 ILE 28 2HD1 ILE 28 -1.576 17.567 7.227 59 3HD1 ILE 28 3HD1 ILE 28 -1.651 16.346 8.497 60 H LEU 29 H LEU 29 4.194 20.029 8.055 61 HA LEU 29 HA LEU 29 3.751 22.966 7.974 62 1HB LEU 29 1HB LEU 29 5.994 21.254 6.953 63 2HB LEU 29 2HB LEU 29 5.930 23.004 6.864 64 HG LEU 29 HG LEU 29 7.323 22.421 8.600 65 1HD1 LEU 29 1HD1 LEU 29 4.772 23.350 9.944 66 2HD1 LEU 29 2HD1 LEU 29 6.442 23.675 10.441 67 3HD1 LEU 29 3HD1 LEU 29 5.828 24.367 8.925 68 1HD2 LEU 29 1HD2 LEU 29 5.202 20.882 10.135 69 2HD2 LEU 29 2HD2 LEU 29 6.484 20.138 9.137 70 3HD2 LEU 29 3HD2 LEU 29 6.896 21.125 10.547 71 H ASP 30 H ASP 30 4.741 23.469 5.328 72 HA ASP 30 HA ASP 30 2.329 23.027 3.786 73 1HB ASP 30 1HB ASP 30 3.516 24.453 2.175 74 2HB ASP 30 2HB ASP 30 3.522 25.185 3.786 75 H GLU 31 H GLU 31 5.711 22.106 3.713 76 HA GLU 31 HA GLU 31 6.166 21.360 1.367 77 1HB GLU 31 1HB GLU 31 7.374 20.635 3.818 78 2HB GLU 31 2HB GLU 31 7.319 19.128 2.892 79 1HG GLU 31 1HG GLU 31 8.431 21.785 1.897 80 2HG GLU 31 2HG GLU 31 9.390 20.470 2.576 81 H LYS 32 H LYS 32 6.014 19.960 -0.209 82 HA LYS 32 HA LYS 32 3.523 18.343 -0.087 83 1HB LYS 32 1HB LYS 32 3.523 20.332 -1.485 84 2HB LYS 32 2HB LYS 32 5.019 19.791 -2.285 85 1HG LYS 32 1HG LYS 32 3.904 17.939 -3.308 86 2HG LYS 32 2HG LYS 32 2.559 18.066 -2.178 87 1HD LYS 32 1HD LYS 32 1.674 18.820 -4.214 88 2HD LYS 32 2HD LYS 32 1.906 20.271 -3.250 89 1HE LYS 32 1HE LYS 32 3.705 19.202 -5.499 90 2HE LYS 32 2HE LYS 32 2.564 20.546 -5.634 91 1HZ LYS 32 1HZ LYS 32 3.908 21.682 -3.911 92 2HZ LYS 32 2HZ LYS 32 5.022 20.479 -4.034 93 3HZ LYS 32 3HZ LYS 32 4.710 21.432 -5.330 94 H ILE 33 H ILE 33 4.486 16.456 0.691 95 HA ILE 33 HA ILE 33 6.754 15.231 -0.794 96 HB ILE 33 HB ILE 33 6.575 15.257 1.636 97 1HG1 ILE 33 1HG1 ILE 33 8.204 13.964 0.536 98 2HG1 ILE 33 2HG1 ILE 33 7.595 13.173 1.970 99 1HG2 ILE 33 1HG2 ILE 33 5.325 13.591 2.812 100 2HG2 ILE 33 2HG2 ILE 33 4.233 14.670 1.966 101 3HG2 ILE 33 3HG2 ILE 33 4.521 13.044 1.320 102 1HD1 ILE 33 1HD1 ILE 33 6.137 11.723 0.424 103 2HD1 ILE 33 2HD1 ILE 33 7.064 12.451 -0.911 104 3HD1 ILE 33 3HD1 ILE 33 7.888 11.479 0.308 105 H LYS 34 H LYS 34 6.394 14.054 -2.546 106 HA LYS 34 HA LYS 34 3.650 13.463 -3.454 107 1HB LYS 34 1HB LYS 34 5.472 14.663 -4.776 108 2HB LYS 34 2HB LYS 34 6.338 13.119 -4.857 109 1HG LYS 34 1HG LYS 34 3.528 13.623 -5.933 110 2HG LYS 34 2HG LYS 34 5.027 13.815 -6.850 111 1HD LYS 34 1HD LYS 34 5.413 11.245 -6.013 112 2HD LYS 34 2HD LYS 34 3.679 11.340 -5.867 113 1HE LYS 34 1HE LYS 34 3.577 10.880 -8.104 114 2HE LYS 34 2HE LYS 34 4.132 12.502 -8.417 115 1HZ LYS 34 1HZ LYS 34 5.689 10.032 -8.079 116 2HZ LYS 34 2HZ LYS 34 5.431 10.833 -9.500 117 3HZ LYS 34 3HZ LYS 34 6.400 11.514 -8.341 118 H VAL 35 H VAL 35 2.998 11.159 -3.710 119 HA VAL 35 HA VAL 35 5.078 9.156 -2.880 120 HB VAL 35 HB VAL 35 2.313 9.534 -1.840 121 1HG1 VAL 35 1HG1 VAL 35 2.153 7.280 -2.623 122 2HG1 VAL 35 2HG1 VAL 35 3.782 6.896 -2.055 123 3HG1 VAL 35 3HG1 VAL 35 2.485 7.195 -0.885 124 1HG2 VAL 35 1HG2 VAL 35 3.306 9.180 0.285 125 2HG2 VAL 35 2HG2 VAL 35 4.867 8.735 -0.449 126 3HG2 VAL 35 3HG2 VAL 35 4.251 10.403 -0.570 127 H THR 36 H THR 36 4.919 7.238 -3.993 128 HA THR 36 HA THR 36 3.115 7.141 -6.338 129 HB THR 36 HB THR 36 6.171 7.121 -6.430 130 HG1 THR 36 HG1 THR 36 4.233 9.017 -6.702 131 1HG2 THR 36 1HG2 THR 36 5.228 5.578 -8.088 132 2HG2 THR 36 2HG2 THR 36 4.186 6.885 -8.715 133 3HG2 THR 36 3HG2 THR 36 5.960 7.003 -8.841 134 H PHE 37 H PHE 37 2.094 5.511 -5.588 135 HA PHE 37 HA PHE 37 3.317 3.252 -4.194 136 1HB PHE 37 1HB PHE 37 0.539 3.590 -5.401 137 2HB PHE 37 2HB PHE 37 1.046 2.421 -4.200 138 HD1 PHE 37 HD1 PHE 37 1.880 3.328 -1.883 139 HD2 PHE 37 HD2 PHE 37 -0.442 5.618 -4.717 140 HE1 PHE 37 HE1 PHE 37 1.070 4.792 -0.048 141 HE2 PHE 37 HE2 PHE 37 -1.261 7.038 -2.871 142 HZ PHE 37 HZ PHE 37 -0.509 6.670 -0.572 143 H ASP 38 H ASP 38 3.011 0.994 -5.056 144 HA ASP 38 HA ASP 38 3.078 0.841 -8.023 145 1HB ASP 38 1HB ASP 38 5.290 1.549 -7.148 146 2HB ASP 38 2HB ASP 38 5.311 0.201 -6.064 147 H ALA 39 H ALA 39 1.146 -0.266 -7.976 148 HA ALA 39 HA ALA 39 0.911 -2.803 -6.577 149 1HB ALA 39 1HB ALA 39 -0.768 -1.491 -8.739 150 2HB ALA 39 2HB ALA 39 -1.205 -2.934 -7.801 151 3HB ALA 39 3HB ALA 39 -1.010 -1.364 -6.984 152 H ASN 40 H ASN 40 2.202 -4.509 -7.248 153 HA ASN 40 HA ASN 40 2.241 -5.154 -10.173 154 1HB ASN 40 1HB ASN 40 4.237 -6.162 -8.114 155 2HB ASN 40 2HB ASN 40 4.310 -6.266 -9.868 156 1HD2 ASN 40 1HD2 ASN 40 4.490 -4.054 -7.079 157 2HD2 ASN 40 2HD2 ASN 40 5.491 -2.830 -7.884 158 H VAL 41 H VAL 41 1.448 -7.202 -10.695 159 HA VAL 41 HA VAL 41 0.715 -9.046 -8.493 160 HB VAL 41 HB VAL 41 -1.100 -8.400 -10.850 161 1HG1 VAL 41 1HG1 VAL 41 -2.803 -9.604 -9.517 162 2HG1 VAL 41 2HG1 VAL 41 -1.430 -10.635 -9.930 163 3HG1 VAL 41 3HG1 VAL 41 -1.574 -9.969 -8.291 164 1HG2 VAL 41 1HG2 VAL 41 -1.046 -6.378 -9.434 165 2HG2 VAL 41 2HG2 VAL 41 -2.587 -7.222 -9.368 166 3HG2 VAL 41 3HG2 VAL 41 -1.452 -7.366 -8.012 167 H ALA 42 H ALA 42 0.940 -11.209 -9.049 168 HA ALA 42 HA ALA 42 1.497 -11.902 -11.873 169 1HB ALA 42 1HB ALA 42 3.349 -13.365 -11.221 170 2HB ALA 42 2HB ALA 42 3.726 -11.702 -10.723 171 3HB ALA 42 3HB ALA 42 3.167 -12.890 -9.522 172 H ALA 43 H ALA 43 1.167 -14.231 -12.157 173 HA ALA 43 HA ALA 43 -1.176 -15.313 -11.786 174 1HB ALA 43 1HB ALA 43 1.454 -16.815 -11.447 175 2HB ALA 43 2HB ALA 43 -0.102 -17.577 -11.811 176 3HB ALA 43 3HB ALA 43 0.616 -16.445 -12.968 177 H GLY 44 H GLY 44 1.297 -16.006 -9.383 178 1HA GLY 44 1HA GLY 44 0.204 -17.424 -7.412 179 2HA GLY 44 2HA GLY 44 1.243 -16.036 -7.087 180 H LEU 45 H LEU 45 -0.580 -13.901 -7.825 181 HA LEU 45 HA LEU 45 -2.908 -14.389 -6.042 182 1HB LEU 45 1HB LEU 45 -1.033 -12.278 -5.812 183 2HB LEU 45 2HB LEU 45 -2.476 -11.576 -6.474 184 HG LEU 45 HG LEU 45 -2.824 -13.508 -4.127 185 1HD1 LEU 45 1HD1 LEU 45 -2.758 -11.240 -2.759 186 2HD1 LEU 45 2HD1 LEU 45 -1.260 -12.129 -3.035 187 3HD1 LEU 45 3HD1 LEU 45 -1.635 -10.742 -4.027 188 1HD2 LEU 45 1HD2 LEU 45 -4.700 -12.064 -3.770 189 2HD2 LEU 45 2HD2 LEU 45 -4.200 -10.956 -5.074 190 3HD2 LEU 45 3HD2 LEU 45 -4.710 -12.617 -5.462 191 HA PRO 46 HA PRO 46 -4.362 -14.067 -10.261 192 1HB PRO 46 1HB PRO 46 -6.648 -15.563 -10.055 193 2HB PRO 46 2HB PRO 46 -5.003 -16.269 -9.982 194 1HG PRO 46 1HG PRO 46 -6.851 -15.671 -7.694 195 2HG PRO 46 2HG PRO 46 -5.831 -17.103 -7.971 196 1HD PRO 46 1HD PRO 46 -5.099 -14.937 -6.374 197 2HD PRO 46 2HD PRO 46 -3.942 -16.054 -7.155 198 H TRP 47 H TRP 47 -5.329 -12.279 -7.682 199 HA TRP 47 HA TRP 47 -8.088 -11.733 -8.310 200 1HB TRP 47 1HB TRP 47 -6.238 -10.472 -6.304 201 2HB TRP 47 2HB TRP 47 -7.987 -10.259 -6.415 202 HD1 TRP 47 HD1 TRP 47 -7.788 -13.691 -7.216 203 HE1 TRP 47 HE1 TRP 47 -8.015 -15.256 -5.300 204 HE3 TRP 47 HE3 TRP 47 -6.871 -10.385 -3.385 205 HZ2 TRP 47 HZ2 TRP 47 -8.006 -15.118 -2.376 206 HZ3 TRP 47 HZ3 TRP 47 -6.639 -11.307 -1.086 207 HH2 TRP 47 HH2 TRP 47 -7.286 -13.588 -0.553 208 H GLU 48 H GLU 48 -9.028 -9.934 -8.905 209 HA GLU 48 HA GLU 48 -7.745 -8.255 -10.949 210 1HB GLU 48 1HB GLU 48 -9.939 -9.247 -11.283 211 2HB GLU 48 2HB GLU 48 -10.508 -8.649 -9.730 212 1HG GLU 48 1HG GLU 48 -10.446 -6.322 -10.621 213 2HG GLU 48 2HG GLU 48 -10.034 -6.973 -12.210 214 H PHE 49 H PHE 49 -6.204 -7.455 -9.430 215 HA PHE 49 HA PHE 49 -7.024 -5.753 -7.184 216 1HB PHE 49 1HB PHE 49 -5.104 -7.315 -7.048 217 2HB PHE 49 2HB PHE 49 -4.273 -6.346 -8.258 218 HD1 PHE 49 HD1 PHE 49 -5.186 -6.630 -4.740 219 HD2 PHE 49 HD2 PHE 49 -3.601 -3.945 -7.721 220 HE1 PHE 49 HE1 PHE 49 -4.355 -5.138 -2.958 221 HE2 PHE 49 HE2 PHE 49 -2.802 -2.441 -5.913 222 HZ PHE 49 HZ PHE 49 -3.055 -3.117 -3.528 223 H VAL 50 H VAL 50 -7.791 -3.757 -7.804 224 HA VAL 50 HA VAL 50 -6.455 -2.386 -10.093 225 HB VAL 50 HB VAL 50 -8.351 -1.066 -10.384 226 1HG1 VAL 50 1HG1 VAL 50 -10.017 -2.724 -10.938 227 2HG1 VAL 50 2HG1 VAL 50 -8.432 -3.487 -11.177 228 3HG1 VAL 50 3HG1 VAL 50 -9.402 -3.853 -9.725 229 1HG2 VAL 50 1HG2 VAL 50 -10.436 -1.430 -8.974 230 2HG2 VAL 50 2HG2 VAL 50 -9.378 -2.262 -7.815 231 3HG2 VAL 50 3HG2 VAL 50 -9.149 -0.526 -8.165 232 HA PRO 51 HA PRO 51 -4.831 0.391 -6.808 233 1HB PRO 51 1HB PRO 51 -3.096 1.840 -8.327 234 2HB PRO 51 2HB PRO 51 -2.706 0.196 -7.746 235 1HG PRO 51 1HG PRO 51 -3.809 0.986 -10.453 236 2HG PRO 51 2HG PRO 51 -2.407 -0.071 -10.119 237 1HD PRO 51 1HD PRO 51 -4.868 -1.042 -10.655 238 2HD PRO 51 2HD PRO 51 -3.826 -1.866 -9.465 239 H VAL 52 H VAL 52 -4.934 2.805 -6.755 240 HA VAL 52 HA VAL 52 -7.447 3.647 -8.019 241 HB VAL 52 HB VAL 52 -7.150 5.568 -6.274 242 1HG1 VAL 52 1HG1 VAL 52 -8.049 2.713 -5.756 243 2HG1 VAL 52 2HG1 VAL 52 -8.417 4.100 -4.703 244 3HG1 VAL 52 3HG1 VAL 52 -9.029 4.060 -6.366 245 1HG2 VAL 52 1HG2 VAL 52 -5.694 3.228 -5.014 246 2HG2 VAL 52 2HG2 VAL 52 -4.889 4.721 -5.532 247 3HG2 VAL 52 3HG2 VAL 52 -6.108 4.770 -4.239 248 H GLN 53 H GLN 53 -4.246 5.026 -7.336 249 HA GLN 53 HA GLN 53 -4.117 6.223 -9.980 250 1HB GLN 53 1HB GLN 53 -3.205 7.765 -7.535 251 2HB GLN 53 2HB GLN 53 -3.076 8.250 -9.200 252 1HG GLN 53 1HG GLN 53 -4.846 9.539 -8.405 253 2HG GLN 53 2HG GLN 53 -5.583 8.285 -9.413 254 1HE2 GLN 53 1HE2 GLN 53 -4.383 8.174 -6.007 255 2HE2 GLN 53 2HE2 GLN 53 -5.933 7.716 -5.332 256 H ARG 54 H ARG 54 -1.574 6.792 -10.148 257 HA ARG 54 HA ARG 54 -0.046 4.568 -9.014 258 1HB ARG 54 1HB ARG 54 0.341 5.903 -11.281 259 2HB ARG 54 2HB ARG 54 1.180 7.049 -10.242 260 1HG ARG 54 1HG ARG 54 2.743 5.450 -11.221 261 2HG ARG 54 2HG ARG 54 2.678 5.166 -9.470 262 1HD ARG 54 1HD ARG 54 1.554 3.166 -9.747 263 2HD ARG 54 2HD ARG 54 0.927 3.665 -11.318 264 HE ARG 54 HE ARG 54 2.734 2.804 -12.384 265 1HH1 ARG 54 1HH1 ARG 54 3.625 3.011 -8.890 266 2HH1 ARG 54 2HH1 ARG 54 4.840 1.763 -9.138 267 1HH2 ARG 54 1HH2 ARG 54 4.359 1.040 -12.415 268 2HH2 ARG 54 2HH2 ARG 54 5.120 0.680 -10.864 269 H ASP 55 H ASP 55 -0.488 8.115 -8.519 270 HA ASP 55 HA ASP 55 1.120 8.067 -6.093 271 1HB ASP 55 1HB ASP 55 1.823 10.292 -7.076 272 2HB ASP 55 2HB ASP 55 2.361 8.862 -7.991 273 H ILE 56 H ILE 56 1.057 10.162 -5.025 274 HA ILE 56 HA ILE 56 -1.482 11.596 -4.929 275 HB ILE 56 HB ILE 56 -1.631 11.474 -2.459 276 1HG1 ILE 56 1HG1 ILE 56 0.319 9.191 -2.876 277 2HG1 ILE 56 2HG1 ILE 56 0.664 10.769 -2.120 278 1HG2 ILE 56 1HG2 ILE 56 -1.944 8.810 -3.874 279 2HG2 ILE 56 2HG2 ILE 56 -2.804 9.346 -2.411 280 3HG2 ILE 56 3HG2 ILE 56 -3.106 10.147 -3.960 281 1HD1 ILE 56 1HD1 ILE 56 -1.305 8.787 -0.921 282 2HD1 ILE 56 2HD1 ILE 56 0.417 8.880 -0.508 283 3HD1 ILE 56 3HD1 ILE 56 -0.622 10.256 -0.199 284 H ASP 57 H ASP 57 -1.140 13.563 -3.466 285 HA ASP 57 HA ASP 57 1.682 14.222 -2.868 286 1HB ASP 57 1HB ASP 57 -0.431 15.960 -4.181 287 2HB ASP 57 2HB ASP 57 0.600 16.676 -2.944 288 H VAL 58 H VAL 58 1.958 14.824 -0.788 289 HA VAL 58 HA VAL 58 -0.429 15.015 1.042 290 HB VAL 58 HB VAL 58 2.039 13.322 1.111 291 1HG1 VAL 58 1HG1 VAL 58 1.550 12.798 3.480 292 2HG1 VAL 58 2HG1 VAL 58 2.136 14.446 3.258 293 3HG1 VAL 58 3HG1 VAL 58 0.406 14.141 3.539 294 1HG2 VAL 58 1HG2 VAL 58 0.416 11.587 1.703 295 2HG2 VAL 58 2HG2 VAL 58 -0.876 12.808 1.748 296 3HG2 VAL 58 3HG2 VAL 58 -0.074 12.416 0.213 297 H ARG 59 H ARG 59 -0.289 16.941 2.169 298 HA ARG 59 HA ARG 59 2.189 18.536 2.232 299 1HB ARG 59 1HB ARG 59 -0.166 19.040 4.053 300 2HB ARG 59 2HB ARG 59 1.123 20.115 3.544 301 1HG ARG 59 1HG ARG 59 -1.369 19.260 2.142 302 2HG ARG 59 2HG ARG 59 -0.736 20.866 2.421 303 1HD ARG 59 1HD ARG 59 1.044 20.485 0.729 304 2HD ARG 59 2HD ARG 59 0.369 18.901 0.346 305 HE ARG 59 HE ARG 59 -0.592 21.472 -0.521 306 1HH1 ARG 59 1HH1 ARG 59 -1.711 18.178 0.275 307 2HH1 ARG 59 2HH1 ARG 59 -3.304 18.474 -0.028 308 1HH2 ARG 59 1HH2 ARG 59 -2.722 21.744 -1.454 309 2HH2 ARG 59 2HH2 ARG 59 -3.810 20.385 -1.484 310 H ILE 60 H ILE 60 3.756 17.340 3.265 311 HA ILE 60 HA ILE 60 4.019 15.207 4.541 312 HB ILE 60 HB ILE 60 5.654 16.174 6.270 313 1HG1 ILE 60 1HG1 ILE 60 5.317 18.634 4.510 314 2HG1 ILE 60 2HG1 ILE 60 4.522 18.485 6.068 315 1HG2 ILE 60 1HG2 ILE 60 5.935 16.598 3.278 316 2HG2 ILE 60 2HG2 ILE 60 7.295 16.503 4.406 317 3HG2 ILE 60 3HG2 ILE 60 6.276 15.096 4.180 318 1HD1 ILE 60 1HD1 ILE 60 6.824 19.701 5.896 319 2HD1 ILE 60 2HD1 ILE 60 6.613 18.535 7.224 320 3HD1 ILE 60 3HD1 ILE 60 7.549 18.130 5.762 321 H GLY 61 H GLY 61 1.951 14.535 5.249 322 1HA GLY 61 1HA GLY 61 1.554 13.450 7.492 323 2HA GLY 61 2HA GLY 61 1.363 15.068 8.133 324 H GLU 62 H GLU 62 0.031 15.924 5.524 325 HA GLU 62 HA GLU 62 -2.643 15.834 5.992 326 1HB GLU 62 1HB GLU 62 -1.459 17.034 4.169 327 2HB GLU 62 2HB GLU 62 -1.302 15.490 3.310 328 1HG GLU 62 1HG GLU 62 -3.782 15.369 3.098 329 2HG GLU 62 2HG GLU 62 -3.904 16.951 3.899 330 H THR 63 H THR 63 -3.943 14.133 6.564 331 HA THR 63 HA THR 63 -3.470 11.430 5.833 332 HB THR 63 HB THR 63 -6.035 11.585 6.864 333 HG1 THR 63 HG1 THR 63 -6.153 13.288 8.210 334 1HG2 THR 63 1HG2 THR 63 -4.153 10.298 7.765 335 2HG2 THR 63 2HG2 THR 63 -3.465 11.798 8.460 336 3HG2 THR 63 3HG2 THR 63 -5.056 11.166 8.995 337 H VAL 64 H VAL 64 -3.583 10.970 3.671 338 HA VAL 64 HA VAL 64 -6.127 11.696 2.242 339 HB VAL 64 HB VAL 64 -4.283 12.582 1.114 340 1HG1 VAL 64 1HG1 VAL 64 -2.430 11.167 1.999 341 2HG1 VAL 64 2HG1 VAL 64 -3.017 9.804 1.022 342 3HG1 VAL 64 3HG1 VAL 64 -2.436 11.295 0.238 343 1HG2 VAL 64 1HG2 VAL 64 -6.025 11.573 -0.314 344 2HG2 VAL 64 2HG2 VAL 64 -4.416 11.601 -1.063 345 3HG2 VAL 64 3HG2 VAL 64 -5.053 10.080 -0.415 346 H GLN 65 H GLN 65 -7.180 10.087 1.062 347 HA GLN 65 HA GLN 65 -6.779 7.316 2.105 348 1HB GLN 65 1HB GLN 65 -9.282 7.125 1.382 349 2HB GLN 65 2HB GLN 65 -8.801 7.702 2.974 350 1HG GLN 65 1HG GLN 65 -10.619 9.063 2.029 351 2HG GLN 65 2HG GLN 65 -9.177 10.005 2.411 352 1HE2 GLN 65 1HE2 GLN 65 -10.738 8.225 -0.303 353 2HE2 GLN 65 2HE2 GLN 65 -10.055 9.240 -1.556 354 H ILE 66 H ILE 66 -6.443 5.738 0.792 355 HA ILE 66 HA ILE 66 -6.827 6.047 -2.125 356 HB ILE 66 HB ILE 66 -4.524 5.029 -2.465 357 1HG1 ILE 66 1HG1 ILE 66 -2.980 6.437 -0.668 358 2HG1 ILE 66 2HG1 ILE 66 -4.188 5.796 0.421 359 1HG2 ILE 66 1HG2 ILE 66 -4.676 7.930 -1.634 360 2HG2 ILE 66 2HG2 ILE 66 -3.579 7.175 -2.815 361 3HG2 ILE 66 3HG2 ILE 66 -5.302 7.283 -3.168 362 1HD1 ILE 66 1HD1 ILE 66 -2.497 4.213 -1.564 363 2HD1 ILE 66 2HD1 ILE 66 -2.230 4.305 0.191 364 3HD1 ILE 66 3HD1 ILE 66 -3.670 3.496 -0.446 365 H MET 67 H MET 67 -8.426 4.614 -2.186 366 HA MET 67 HA MET 67 -8.190 2.191 -0.627 367 1HB MET 67 1HB MET 67 -10.458 1.692 -1.306 368 2HB MET 67 2HB MET 67 -10.335 3.421 -0.933 369 1HG MET 67 1HG MET 67 -11.777 3.150 -2.692 370 2HG MET 67 2HG MET 67 -10.319 3.884 -3.374 371 1HE MET 67 1HE MET 67 -11.320 3.346 -5.798 372 2HE MET 67 2HE MET 67 -11.826 1.722 -6.319 373 3HE MET 67 3HE MET 67 -12.752 2.580 -5.066 374 H TYR 68 H TYR 68 -8.801 0.020 -1.495 375 HA TYR 68 HA TYR 68 -7.588 -0.464 -4.153 376 1HB TYR 68 1HB TYR 68 -6.867 -1.966 -1.601 377 2HB TYR 68 2HB TYR 68 -6.448 -2.478 -3.234 378 HD1 TYR 68 HD1 TYR 68 -5.106 -0.812 -4.715 379 HD2 TYR 68 HD2 TYR 68 -5.358 -0.529 -0.424 380 HE1 TYR 68 HE1 TYR 68 -3.127 0.683 -4.699 381 HE2 TYR 68 HE2 TYR 68 -3.339 0.913 -0.403 382 HH TYR 68 HH TYR 68 -1.764 2.040 -3.399 383 H ARG 69 H ARG 69 -8.433 -2.250 -5.172 384 HA ARG 69 HA ARG 69 -10.648 -3.679 -3.842 385 1HB ARG 69 1HB ARG 69 -11.965 -2.228 -5.014 386 2HB ARG 69 2HB ARG 69 -10.835 -2.004 -6.321 387 1HG ARG 69 1HG ARG 69 -11.332 -4.205 -7.237 388 2HG ARG 69 2HG ARG 69 -12.284 -4.631 -5.810 389 1HD ARG 69 1HD ARG 69 -13.853 -2.741 -6.334 390 2HD ARG 69 2HD ARG 69 -12.985 -2.442 -7.840 391 HE ARG 69 HE ARG 69 -14.897 -4.514 -7.162 392 1HH1 ARG 69 1HH1 ARG 69 -12.030 -3.872 -9.229 393 2HH1 ARG 69 2HH1 ARG 69 -12.451 -5.182 -10.348 394 1HH2 ARG 69 1HH2 ARG 69 -15.282 -6.301 -8.764 395 2HH2 ARG 69 2HH2 ARG 69 -14.134 -6.386 -10.134 396 H ALA 70 H ALA 70 -10.199 -5.750 -3.901 397 HA ALA 70 HA ALA 70 -8.694 -6.921 -6.199 398 1HB ALA 70 1HB ALA 70 -7.332 -6.833 -4.157 399 2HB ALA 70 2HB ALA 70 -8.533 -7.829 -3.323 400 3HB ALA 70 3HB ALA 70 -7.685 -8.477 -4.743 401 H LYS 71 H LYS 71 -10.299 -7.913 -7.388 402 HA LYS 71 HA LYS 71 -12.455 -9.381 -5.935 403 1HB LYS 71 1HB LYS 71 -13.618 -8.136 -7.414 404 2HB LYS 71 2HB LYS 71 -12.303 -7.993 -8.576 405 1HG LYS 71 1HG LYS 71 -12.654 -10.166 -9.451 406 2HG LYS 71 2HG LYS 71 -13.663 -10.628 -8.069 407 1HD LYS 71 1HD LYS 71 -15.512 -9.349 -8.787 408 2HD LYS 71 2HD LYS 71 -14.558 -8.441 -9.970 409 1HE LYS 71 1HE LYS 71 -14.781 -11.455 -10.188 410 2HE LYS 71 2HE LYS 71 -16.104 -10.432 -10.768 411 1HZ LYS 71 1HZ LYS 71 -13.338 -9.916 -11.654 412 2HZ LYS 71 2HZ LYS 71 -14.321 -10.988 -12.447 413 3HZ LYS 71 3HZ LYS 71 -14.692 -9.387 -12.296 414 H ASN 72 H ASN 72 -12.427 -11.596 -5.839 415 HA ASN 72 HA ASN 72 -10.020 -12.819 -6.905 416 1HB ASN 72 1HB ASN 72 -10.934 -13.537 -4.768 417 2HB ASN 72 2HB ASN 72 -12.397 -14.125 -5.571 418 1HD2 ASN 72 1HD2 ASN 72 -11.579 -16.160 -4.336 419 2HD2 ASN 72 2HD2 ASN 72 -10.433 -17.193 -5.197 420 H LEU 73 H LEU 73 -9.813 -14.310 -8.498 421 HA LEU 73 HA LEU 73 -11.936 -14.445 -10.583 422 1HB LEU 73 1HB LEU 73 -9.581 -12.899 -10.681 423 2HB LEU 73 2HB LEU 73 -9.131 -14.359 -11.542 424 HG LEU 73 HG LEU 73 -9.882 -12.676 -13.065 425 1HD1 LEU 73 1HD1 LEU 73 -11.620 -13.810 -14.317 426 2HD1 LEU 73 2HD1 LEU 73 -10.504 -15.006 -13.637 427 3HD1 LEU 73 3HD1 LEU 73 -12.103 -14.755 -12.900 428 1HD2 LEU 73 1HD2 LEU 73 -11.273 -11.369 -11.485 429 2HD2 LEU 73 2HD2 LEU 73 -12.056 -11.642 -13.052 430 3HD2 LEU 73 3HD2 LEU 73 -12.565 -12.579 -11.631 431 H ALA 74 H ALA 74 -9.980 -16.288 -8.498 432 HA ALA 74 HA ALA 74 -9.384 -18.425 -10.423 433 1HB ALA 74 1HB ALA 74 -7.839 -18.050 -8.591 434 2HB ALA 74 2HB ALA 74 -9.138 -18.255 -7.395 435 3HB ALA 74 3HB ALA 74 -8.617 -19.629 -8.395 436 H SER 75 H SER 75 -10.444 -20.482 -10.407 437 HA SER 75 HA SER 75 -13.289 -20.318 -9.747 438 1HB SER 75 1HB SER 75 -11.751 -22.658 -10.916 439 2HB SER 75 2HB SER 75 -13.488 -22.323 -11.024 440 HG SER 75 HG SER 75 -12.792 -20.297 -12.110 441 H THR 76 H THR 76 -11.019 -20.652 -7.580 442 HA THR 76 HA THR 76 -12.552 -22.226 -5.786 443 HB THR 76 HB THR 76 -11.458 -24.217 -5.988 444 HG1 THR 76 HG1 THR 76 -9.344 -24.353 -5.234 445 1HG2 THR 76 1HG2 THR 76 -9.472 -22.920 -7.898 446 2HG2 THR 76 2HG2 THR 76 -9.475 -24.635 -7.466 447 3HG2 THR 76 3HG2 THR 76 -10.856 -23.956 -8.318 448 HA PRO 77 HA PRO 77 -11.157 -19.176 -3.241 449 1HB PRO 77 1HB PRO 77 -10.063 -20.340 -0.896 450 2HB PRO 77 2HB PRO 77 -11.785 -20.090 -1.246 451 1HG PRO 77 1HG PRO 77 -10.129 -22.573 -1.723 452 2HG PRO 77 2HG PRO 77 -11.771 -22.455 -1.009 453 1HD PRO 77 1HD PRO 77 -11.474 -23.168 -3.569 454 2HD PRO 77 2HD PRO 77 -12.739 -21.999 -3.138 455 H THR 78 H THR 78 -9.295 -17.982 -2.281 456 HA THR 78 HA THR 78 -6.589 -19.096 -2.836 457 HB THR 78 HB THR 78 -6.514 -16.298 -3.492 458 HG1 THR 78 HG1 THR 78 -8.721 -16.621 -4.045 459 1HG2 THR 78 1HG2 THR 78 -6.145 -18.669 -5.272 460 2HG2 THR 78 2HG2 THR 78 -5.593 -16.997 -5.530 461 3HG2 THR 78 3HG2 THR 78 -4.919 -17.929 -4.195 462 H THR 79 H THR 79 -4.905 -17.653 -1.931 463 HA THR 79 HA THR 79 -5.694 -16.248 0.548 464 HB THR 79 HB THR 79 -4.571 -18.292 1.187 465 HG1 THR 79 HG1 THR 79 -2.923 -17.320 2.329 466 1HG2 THR 79 1HG2 THR 79 -3.334 -18.844 -0.897 467 2HG2 THR 79 2HG2 THR 79 -2.264 -17.450 -0.634 468 3HG2 THR 79 3HG2 THR 79 -2.258 -18.805 0.504 469 H GLY 80 H GLY 80 -4.646 -14.242 0.740 470 1HA GLY 80 1HA GLY 80 -2.964 -13.323 -1.555 471 2HA GLY 80 2HA GLY 80 -4.422 -12.463 -1.114 472 H GLN 81 H GLN 81 -1.260 -13.545 -0.027 473 HA GLN 81 HA GLN 81 -1.236 -11.499 2.135 474 1HB GLN 81 1HB GLN 81 0.201 -12.873 3.428 475 2HB GLN 81 2HB GLN 81 -1.260 -13.749 2.987 476 1HG GLN 81 1HG GLN 81 0.422 -15.335 2.816 477 2HG GLN 81 2HG GLN 81 0.132 -14.890 1.134 478 1HE2 GLN 81 1HE2 GLN 81 1.910 -14.011 -0.021 479 2HE2 GLN 81 2HE2 GLN 81 3.338 -13.384 0.760 480 H ALA 82 H ALA 82 0.275 -12.463 -0.815 481 HA ALA 82 HA ALA 82 1.813 -11.375 -2.080 482 1HB ALA 82 1HB ALA 82 0.932 -8.999 -0.388 483 2HB ALA 82 2HB ALA 82 1.563 -8.960 -2.042 484 3HB ALA 82 3HB ALA 82 -0.004 -9.732 -1.703 485 H THR 83 H THR 83 3.681 -9.517 -1.985 486 HA THR 83 HA THR 83 4.517 -9.234 0.773 487 HB THR 83 HB THR 83 6.326 -10.687 -0.159 488 HG1 THR 83 HG1 THR 83 6.834 -9.425 1.539 489 1HG2 THR 83 1HG2 THR 83 6.439 -9.806 -2.458 490 2HG2 THR 83 2HG2 THR 83 6.989 -8.222 -1.839 491 3HG2 THR 83 3HG2 THR 83 8.003 -9.659 -1.632 492 H PHE 84 H PHE 84 5.798 -7.106 0.903 493 HA PHE 84 HA PHE 84 4.583 -5.075 -0.859 494 1HB PHE 84 1HB PHE 84 3.182 -4.135 0.821 495 2HB PHE 84 2HB PHE 84 2.780 -5.816 0.631 496 HD1 PHE 84 HD1 PHE 84 3.939 -3.270 2.952 497 HD2 PHE 84 HD2 PHE 84 3.500 -7.520 2.372 498 HE1 PHE 84 HE1 PHE 84 4.848 -3.663 5.182 499 HE2 PHE 84 HE2 PHE 84 4.434 -7.909 4.618 500 HZ PHE 84 HZ PHE 84 5.050 -5.984 6.076 501 H ASN 85 H ASN 85 6.618 -4.401 -1.386 502 HA ASN 85 HA ASN 85 8.629 -3.838 0.688 503 1HB ASN 85 1HB ASN 85 9.420 -4.720 -1.350 504 2HB ASN 85 2HB ASN 85 8.506 -3.551 -2.282 505 1HD2 ASN 85 1HD2 ASN 85 9.217 -1.196 -2.029 506 2HD2 ASN 85 2HD2 ASN 85 10.908 -0.847 -1.820 507 H VAL 86 H VAL 86 7.448 -2.455 1.922 508 HA VAL 86 HA VAL 86 6.519 0.149 1.057 509 HB VAL 86 HB VAL 86 5.515 -1.017 2.828 510 1HG1 VAL 86 1HG1 VAL 86 6.399 -1.390 5.054 511 2HG1 VAL 86 2HG1 VAL 86 7.303 -2.321 3.865 512 3HG1 VAL 86 3HG1 VAL 86 8.002 -0.845 4.557 513 1HG2 VAL 86 1HG2 VAL 86 5.471 1.438 2.857 514 2HG2 VAL 86 2HG2 VAL 86 5.158 0.668 4.422 515 3HG2 VAL 86 3HG2 VAL 86 6.728 1.422 4.112 516 H THR 87 H THR 87 8.618 0.743 -0.127 517 HA THR 87 HA THR 87 10.025 2.637 1.342 518 HB THR 87 HB THR 87 11.006 0.579 2.438 519 HG1 THR 87 HG1 THR 87 12.691 1.780 2.839 520 1HG2 THR 87 1HG2 THR 87 12.793 -0.594 1.388 521 2HG2 THR 87 2HG2 THR 87 11.290 -0.774 0.462 522 3HG2 THR 87 3HG2 THR 87 12.575 0.320 -0.117 523 HA PRO 88 HA PRO 88 11.231 3.294 -2.968 524 1HB PRO 88 1HB PRO 88 12.995 5.409 -2.585 525 2HB PRO 88 2HB PRO 88 11.247 5.561 -2.785 526 1HG PRO 88 1HG PRO 88 12.806 5.880 -0.297 527 2HG PRO 88 2HG PRO 88 11.198 6.490 -0.711 528 1HD PRO 88 1HD PRO 88 11.801 4.222 0.918 529 2HD PRO 88 2HD PRO 88 10.195 4.718 0.330 530 H MET 89 H MET 89 13.806 3.698 -0.503 531 HA MET 89 HA MET 89 15.327 1.382 -1.440 532 1HB MET 89 1HB MET 89 17.171 2.742 -2.415 533 2HB MET 89 2HB MET 89 15.691 2.918 -3.343 534 1HG MET 89 1HG MET 89 15.168 5.033 -2.163 535 2HG MET 89 2HG MET 89 16.639 4.904 -1.224 536 1HE MET 89 1HE MET 89 18.822 3.944 -3.434 537 2HE MET 89 2HE MET 89 19.419 5.548 -3.902 538 3HE MET 89 3HE MET 89 19.061 5.201 -2.194 539 H ALA 90 H ALA 90 14.501 2.973 1.212 540 HA ALA 90 HA ALA 90 16.988 2.898 2.641 541 1HB ALA 90 1HB ALA 90 17.385 5.356 2.823 542 2HB ALA 90 2HB ALA 90 17.666 4.786 1.176 543 3HB ALA 90 3HB ALA 90 16.162 5.647 1.574 544 H ALA 91 H ALA 91 14.071 4.906 2.227 545 HA ALA 91 HA ALA 91 13.654 5.179 5.091 546 1HB ALA 91 1HB ALA 91 13.129 6.967 3.563 547 2HB ALA 91 2HB ALA 91 11.919 5.967 2.737 548 3HB ALA 91 3HB ALA 91 11.686 6.446 4.447 549 H GLY 92 H GLY 92 10.612 4.645 3.788 550 1HA GLY 92 1HA GLY 92 9.060 2.925 4.207 551 2HA GLY 92 2HA GLY 92 10.406 1.793 4.336 552 H ALA 93 H ALA 93 11.881 2.741 6.459 553 HA ALA 93 HA ALA 93 10.727 1.810 8.765 554 1HB ALA 93 1HB ALA 93 13.100 2.379 8.552 555 2HB ALA 93 2HB ALA 93 12.715 4.112 8.500 556 3HB ALA 93 3HB ALA 93 12.401 3.175 9.977 557 H TYR 94 H TYR 94 10.833 5.334 7.865 558 HA TYR 94 HA TYR 94 9.072 6.069 9.990 559 1HB TYR 94 1HB TYR 94 10.027 7.647 7.578 560 2HB TYR 94 2HB TYR 94 9.379 8.259 9.103 561 HD1 TYR 94 HD1 TYR 94 10.730 6.880 11.226 562 HD2 TYR 94 HD2 TYR 94 12.258 8.462 7.514 563 HE1 TYR 94 HE1 TYR 94 12.839 7.425 12.331 564 HE2 TYR 94 HE2 TYR 94 14.349 9.114 8.679 565 HH TYR 94 HH TYR 94 14.333 9.247 12.142 566 H PHE 95 H PHE 95 8.536 5.093 6.695 567 HA PHE 95 HA PHE 95 6.258 6.348 5.875 568 1HB PHE 95 1HB PHE 95 7.439 4.429 4.691 569 2HB PHE 95 2HB PHE 95 6.696 3.316 5.827 570 HD1 PHE 95 HD1 PHE 95 6.422 4.594 2.568 571 HD2 PHE 95 HD2 PHE 95 4.153 3.041 5.888 572 HE1 PHE 95 HE1 PHE 95 4.522 4.175 1.067 573 HE2 PHE 95 HE2 PHE 95 2.270 2.570 4.363 574 HZ PHE 95 HZ PHE 95 2.404 3.238 1.974 575 H ASN 96 H ASN 96 4.279 6.767 6.782 576 HA ASN 96 HA ASN 96 3.918 5.662 9.337 577 1HB ASN 96 1HB ASN 96 2.029 7.459 7.787 578 2HB ASN 96 2HB ASN 96 1.844 7.067 9.472 579 1HD2 ASN 96 1HD2 ASN 96 3.467 9.069 7.242 580 2HD2 ASN 96 2HD2 ASN 96 4.561 9.882 8.373 581 H LYS 97 H LYS 97 3.802 3.354 8.430 582 HA LYS 97 HA LYS 97 1.475 2.284 7.290 583 1HB LYS 97 1HB LYS 97 2.042 0.171 8.282 584 2HB LYS 97 2HB LYS 97 3.405 0.901 7.476 585 1HG LYS 97 1HG LYS 97 2.965 0.873 10.509 586 2HG LYS 97 2HG LYS 97 3.828 -0.379 9.635 587 1HD LYS 97 1HD LYS 97 4.730 2.511 9.876 588 2HD LYS 97 2HD LYS 97 5.330 1.157 10.802 589 1HE LYS 97 1HE LYS 97 6.427 0.124 8.980 590 2HE LYS 97 2HE LYS 97 5.521 1.041 7.776 591 1HZ LYS 97 1HZ LYS 97 6.607 3.022 8.480 592 2HZ LYS 97 2HZ LYS 97 7.629 2.246 9.477 593 3HZ LYS 97 3HZ LYS 97 7.662 1.958 7.870 594 H VAL 98 H VAL 98 -0.528 2.090 7.963 595 HA VAL 98 HA VAL 98 -1.654 3.753 9.659 596 HB VAL 98 HB VAL 98 -2.782 0.964 9.137 597 1HG1 VAL 98 1HG1 VAL 98 -4.177 3.607 9.767 598 2HG1 VAL 98 2HG1 VAL 98 -4.979 2.080 9.352 599 3HG1 VAL 98 3HG1 VAL 98 -4.071 2.211 10.859 600 1HG2 VAL 98 1HG2 VAL 98 -2.200 1.993 6.987 601 2HG2 VAL 98 2HG2 VAL 98 -3.941 2.099 7.217 602 3HG2 VAL 98 3HG2 VAL 98 -2.933 3.530 7.495 603 H GLN 99 H GLN 99 -1.089 0.365 10.650 604 HA GLN 99 HA GLN 99 -0.849 1.290 13.499 605 1HB GLN 99 1HB GLN 99 -1.740 -1.433 12.453 606 2HB GLN 99 2HB GLN 99 -1.430 -1.004 14.150 607 1HG GLN 99 1HG GLN 99 -3.216 0.756 13.974 608 2HG GLN 99 2HG GLN 99 -3.531 0.232 12.314 609 1HE2 GLN 99 1HE2 GLN 99 -3.922 -0.617 15.729 610 2HE2 GLN 99 2HE2 GLN 99 -4.967 -1.992 15.422 611 H CYS 100 H CYS 100 0.165 -1.727 11.931 612 HA CYS 100 HA CYS 100 2.982 -1.182 11.889 613 1HB CYS 100 1HB CYS 100 2.660 -1.147 14.385 614 2HB CYS 100 2HB CYS 100 2.014 -2.799 14.289 615 HG CYS 100 HG CYS 100 4.174 -3.752 13.002 616 H PHE 101 H PHE 101 0.398 -3.619 12.335 617 HA PHE 101 HA PHE 101 1.831 -5.880 11.562 618 1HB PHE 101 1HB PHE 101 -0.417 -5.853 12.639 619 2HB PHE 101 2HB PHE 101 -1.120 -5.292 11.122 620 HD1 PHE 101 HD1 PHE 101 -1.970 -6.914 9.603 621 HD2 PHE 101 HD2 PHE 101 0.974 -8.102 12.535 622 HE1 PHE 101 HE1 PHE 101 -2.269 -9.277 8.951 623 HE2 PHE 101 HE2 PHE 101 0.726 -10.460 11.812 624 HZ PHE 101 HZ PHE 101 -0.911 -11.058 10.040 625 H CYS 102 H CYS 102 1.577 -7.198 9.629 626 HA CYS 102 HA CYS 102 2.473 -5.815 7.298 627 1HB CYS 102 1HB CYS 102 2.743 -7.960 6.333 628 2HB CYS 102 2HB CYS 102 3.022 -8.233 8.061 629 HG CYS 102 HG CYS 102 0.470 -8.902 8.501 630 H PHE 103 H PHE 103 1.500 -6.192 5.091 631 HA PHE 103 HA PHE 103 -1.410 -5.578 5.129 632 1HB PHE 103 1HB PHE 103 0.439 -4.188 3.902 633 2HB PHE 103 2HB PHE 103 0.408 -5.484 2.715 634 HD1 PHE 103 HD1 PHE 103 -1.528 -2.779 4.367 635 HD2 PHE 103 HD2 PHE 103 -1.639 -5.786 1.266 636 HE1 PHE 103 HE1 PHE 103 -3.523 -1.701 3.379 637 HE2 PHE 103 HE2 PHE 103 -3.520 -4.600 0.194 638 HZ PHE 103 HZ PHE 103 -4.508 -2.595 1.264 639 H THR 104 H THR 104 -2.785 -7.270 4.661 640 HA THR 104 HA THR 104 -2.138 -9.373 2.764 641 HB THR 104 HB THR 104 -1.996 -9.848 5.761 642 HG1 THR 104 HG1 THR 104 -0.176 -9.681 4.058 643 1HG2 THR 104 1HG2 THR 104 -3.584 -11.545 5.253 644 2HG2 THR 104 2HG2 THR 104 -2.839 -11.902 3.685 645 3HG2 THR 104 3HG2 THR 104 -2.014 -12.338 5.194 646 H GLU 105 H GLU 105 -4.075 -8.871 1.720 647 HA GLU 105 HA GLU 105 -6.609 -8.783 3.052 648 1HB GLU 105 1HB GLU 105 -5.910 -9.347 0.141 649 2HB GLU 105 2HB GLU 105 -7.497 -8.916 0.775 650 1HG GLU 105 1HG GLU 105 -6.863 -6.816 0.201 651 2HG GLU 105 2HG GLU 105 -6.059 -6.814 1.775 652 H THR 106 H THR 106 -5.617 -10.898 4.233 653 HA THR 106 HA THR 106 -5.960 -13.158 4.698 654 HB THR 106 HB THR 106 -7.661 -11.836 5.718 655 HG1 THR 106 HG1 THR 106 -9.242 -13.410 5.962 656 1HG2 THR 106 1HG2 THR 106 -8.729 -10.628 3.929 657 2HG2 THR 106 2HG2 THR 106 -9.322 -12.118 3.173 658 3HG2 THR 106 3HG2 THR 106 -9.954 -11.597 4.742 659 H THR 107 H THR 107 -8.706 -14.137 3.500 660 HA THR 107 HA THR 107 -7.660 -15.425 1.076 661 HB THR 107 HB THR 107 -7.253 -16.957 2.839 662 HG1 THR 107 HG1 THR 107 -8.307 -17.763 0.871 663 1HG2 THR 107 1HG2 THR 107 -10.153 -16.517 3.566 664 2HG2 THR 107 2HG2 THR 107 -9.129 -17.809 4.247 665 3HG2 THR 107 3HG2 THR 107 -8.718 -16.105 4.536 666 H LEU 108 H LEU 108 -9.316 -16.004 -0.460 667 HA LEU 108 HA LEU 108 -12.023 -14.893 0.080 668 1HB LEU 108 1HB LEU 108 -10.386 -14.344 -2.421 669 2HB LEU 108 2HB LEU 108 -12.086 -13.948 -2.228 670 HG LEU 108 HG LEU 108 -9.867 -12.745 -0.554 671 1HD1 LEU 108 1HD1 LEU 108 -9.985 -10.823 -1.947 672 2HD1 LEU 108 2HD1 LEU 108 -9.893 -12.183 -3.060 673 3HD1 LEU 108 3HD1 LEU 108 -11.453 -11.404 -2.776 674 1HD2 LEU 108 1HD2 LEU 108 -12.822 -12.021 -0.813 675 2HD2 LEU 108 2HD2 LEU 108 -12.039 -12.695 0.628 676 3HD2 LEU 108 3HD2 LEU 108 -11.605 -11.076 0.073 677 H GLU 109 H GLU 109 -13.613 -15.975 -0.847 678 HA GLU 109 HA GLU 109 -13.233 -18.563 -2.125 679 1HB GLU 109 1HB GLU 109 -15.497 -16.857 -1.133 680 2HB GLU 109 2HB GLU 109 -15.913 -18.013 -2.356 681 1HG GLU 109 1HG GLU 109 -14.356 -18.787 0.147 682 2HG GLU 109 2HG GLU 109 -16.122 -18.768 0.066 683 HA PRO 110 HA PRO 110 -12.910 -17.517 -6.252 684 1HB PRO 110 1HB PRO 110 -14.397 -19.302 -7.664 685 2HB PRO 110 2HB PRO 110 -13.060 -19.740 -6.570 686 1HG PRO 110 1HG PRO 110 -16.000 -19.735 -5.872 687 2HG PRO 110 2HG PRO 110 -14.851 -21.100 -5.710 688 1HD PRO 110 1HD PRO 110 -15.367 -19.430 -3.661 689 2HD PRO 110 2HD PRO 110 -13.707 -20.021 -3.913 690 H GLY 111 H GLY 111 -13.964 -15.380 -5.748 691 1HA GLY 111 1HA GLY 111 -14.995 -14.367 -8.041 692 2HA GLY 111 2HA GLY 111 -16.480 -14.897 -7.243 693 H GLU 112 H GLU 112 -14.981 -14.179 -4.517 694 HA GLU 112 HA GLU 112 -16.758 -11.995 -4.496 695 1HB GLU 112 1HB GLU 112 -15.731 -11.983 -1.972 696 2HB GLU 112 2HB GLU 112 -17.143 -12.861 -2.541 697 1HG GLU 112 1HG GLU 112 -15.845 -14.849 -2.808 698 2HG GLU 112 2HG GLU 112 -14.334 -13.931 -2.573 699 H GLU 113 H GLU 113 -16.411 -9.886 -3.551 700 HA GLU 113 HA GLU 113 -14.080 -8.636 -4.868 701 1HB GLU 113 1HB GLU 113 -16.813 -7.504 -4.242 702 2HB GLU 113 2HB GLU 113 -15.521 -6.766 -5.217 703 1HG GLU 113 1HG GLU 113 -15.723 -8.912 -6.598 704 2HG GLU 113 2HG GLU 113 -17.249 -9.105 -5.711 705 H MET 114 H MET 114 -12.459 -8.364 -3.390 706 HA MET 114 HA MET 114 -13.050 -7.418 -0.678 707 1HB MET 114 1HB MET 114 -11.322 -9.145 -1.493 708 2HB MET 114 2HB MET 114 -10.350 -7.809 -2.058 709 1HG MET 114 1HG MET 114 -11.329 -8.252 0.801 710 2HG MET 114 2HG MET 114 -9.720 -8.618 0.180 711 1HE MET 114 1HE MET 114 -9.045 -5.708 2.680 712 2HE MET 114 2HE MET 114 -10.241 -7.018 2.834 713 3HE MET 114 3HE MET 114 -8.615 -7.365 2.207 714 H GLU 115 H GLU 115 -14.088 -5.404 -1.301 715 HA GLU 115 HA GLU 115 -12.391 -3.306 -2.574 716 1HB GLU 115 1HB GLU 115 -15.370 -3.198 -1.983 717 2HB GLU 115 2HB GLU 115 -14.421 -2.188 -3.076 718 1HG GLU 115 1HG GLU 115 -13.949 -4.344 -4.403 719 2HG GLU 115 2HG GLU 115 -15.171 -5.122 -3.394 720 H MET 116 H MET 116 -11.132 -2.220 -0.971 721 HA MET 116 HA MET 116 -12.624 -1.213 1.372 722 1HB MET 116 1HB MET 116 -10.193 -3.014 1.649 723 2HB MET 116 2HB MET 116 -10.884 -2.020 2.941 724 1HG MET 116 1HG MET 116 -13.096 -3.214 2.555 725 2HG MET 116 2HG MET 116 -12.200 -4.358 1.535 726 1HE MET 116 1HE MET 116 -12.978 -6.464 4.701 727 2HE MET 116 2HE MET 116 -14.022 -5.250 3.921 728 3HE MET 116 3HE MET 116 -13.060 -6.372 2.925 729 HA PRO 117 HA PRO 117 -9.686 2.045 0.712 730 1HB PRO 117 1HB PRO 117 -10.502 3.946 2.424 731 2HB PRO 117 2HB PRO 117 -11.462 3.431 1.022 732 1HG PRO 117 1HG PRO 117 -11.863 2.539 3.862 733 2HG PRO 117 2HG PRO 117 -13.057 3.028 2.601 734 1HD PRO 117 1HD PRO 117 -12.363 0.372 3.198 735 2HD PRO 117 2HD PRO 117 -13.058 0.946 1.652 736 H VAL 118 H VAL 118 -7.790 2.868 1.406 737 HA VAL 118 HA VAL 118 -6.752 2.116 4.088 738 HB VAL 118 HB VAL 118 -5.413 2.094 1.350 739 1HG1 VAL 118 1HG1 VAL 118 -3.872 3.361 2.711 740 2HG1 VAL 118 2HG1 VAL 118 -4.014 2.183 4.042 741 3HG1 VAL 118 3HG1 VAL 118 -3.252 1.724 2.504 742 1HG2 VAL 118 1HG2 VAL 118 -6.474 -0.006 2.094 743 2HG2 VAL 118 2HG2 VAL 118 -4.711 -0.138 1.992 744 3HG2 VAL 118 3HG2 VAL 118 -5.496 0.034 3.579 745 H VAL 119 H VAL 119 -5.449 3.797 4.994 746 HA VAL 119 HA VAL 119 -5.734 6.492 3.773 747 HB VAL 119 HB VAL 119 -6.006 7.425 5.934 748 1HG1 VAL 119 1HG1 VAL 119 -8.220 6.646 6.543 749 2HG1 VAL 119 2HG1 VAL 119 -8.052 6.593 4.780 750 3HG1 VAL 119 3HG1 VAL 119 -7.962 5.094 5.726 751 1HG2 VAL 119 1HG2 VAL 119 -6.350 5.978 7.960 752 2HG2 VAL 119 2HG2 VAL 119 -5.806 4.573 7.041 753 3HG2 VAL 119 3HG2 VAL 119 -4.689 5.920 7.364 754 H PHE 120 H PHE 120 -3.847 7.851 3.988 755 HA PHE 120 HA PHE 120 -1.537 6.735 5.362 756 1HB PHE 120 1HB PHE 120 -1.654 5.445 3.191 757 2HB PHE 120 2HB PHE 120 -1.576 6.976 2.318 758 HD1 PHE 120 HD1 PHE 120 0.587 7.390 1.406 759 HD2 PHE 120 HD2 PHE 120 0.258 5.310 5.179 760 HE1 PHE 120 HE1 PHE 120 3.059 7.336 1.621 761 HE2 PHE 120 HE2 PHE 120 2.674 5.541 5.499 762 HZ PHE 120 HZ PHE 120 4.091 6.590 3.750 763 H PHE 121 H PHE 121 0.345 8.096 5.375 764 HA PHE 121 HA PHE 121 0.528 10.476 3.850 765 1HB PHE 121 1HB PHE 121 0.746 11.988 5.821 766 2HB PHE 121 2HB PHE 121 -0.894 11.444 5.531 767 HD1 PHE 121 HD1 PHE 121 -2.019 9.862 7.002 768 HD2 PHE 121 HD2 PHE 121 1.978 11.212 7.872 769 HE1 PHE 121 HE1 PHE 121 -2.382 9.378 9.411 770 HE2 PHE 121 HE2 PHE 121 1.612 10.739 10.276 771 HZ PHE 121 HZ PHE 121 -0.634 9.969 11.047 772 H VAL 122 H VAL 122 2.706 11.425 4.226 773 HA VAL 122 HA VAL 122 4.677 9.428 5.248 774 HB VAL 122 HB VAL 122 4.709 11.586 3.144 775 1HG1 VAL 122 1HG1 VAL 122 7.158 10.851 2.786 776 2HG1 VAL 122 2HG1 VAL 122 6.826 11.959 4.118 777 3HG1 VAL 122 3HG1 VAL 122 7.099 10.242 4.451 778 1HG2 VAL 122 1HG2 VAL 122 3.814 9.447 2.489 779 2HG2 VAL 122 2HG2 VAL 122 5.367 9.748 1.692 780 3HG2 VAL 122 3HG2 VAL 122 5.273 8.618 3.062 781 H ASP 123 H ASP 123 6.411 10.167 6.629 782 HA ASP 123 HA ASP 123 5.546 12.259 8.452 783 1HB ASP 123 1HB ASP 123 7.496 11.416 9.719 784 2HB ASP 123 2HB ASP 123 6.510 10.053 9.182 785 HA PRO 124 HA PRO 124 9.096 14.806 6.875 786 1HB PRO 124 1HB PRO 124 8.832 17.011 8.414 787 2HB PRO 124 2HB PRO 124 7.635 16.433 7.236 788 1HG PRO 124 1HG PRO 124 7.470 16.188 10.228 789 2HG PRO 124 2HG PRO 124 6.178 16.592 9.041 790 1HD PRO 124 1HD PRO 124 6.814 13.980 10.074 791 2HD PRO 124 2HD PRO 124 5.699 14.410 8.737 792 H GLU 125 H GLU 125 9.574 12.546 8.934 793 HA GLU 125 HA GLU 125 11.765 13.696 10.509 794 1HB GLU 125 1HB GLU 125 10.239 12.042 11.575 795 2HB GLU 125 2HB GLU 125 10.695 10.840 10.345 796 1HG GLU 125 1HG GLU 125 13.020 11.088 10.939 797 2HG GLU 125 2HG GLU 125 12.604 12.331 12.137 798 H ILE 126 H ILE 126 10.959 11.515 7.805 799 HA ILE 126 HA ILE 126 13.293 10.552 6.951 800 HB ILE 126 HB ILE 126 11.120 10.281 5.922 801 1HG1 ILE 126 1HG1 ILE 126 13.348 10.996 3.949 802 2HG1 ILE 126 2HG1 ILE 126 13.233 9.519 4.946 803 1HG2 ILE 126 1HG2 ILE 126 10.547 12.759 5.704 804 2HG2 ILE 126 2HG2 ILE 126 11.610 12.784 4.277 805 3HG2 ILE 126 3HG2 ILE 126 10.175 11.748 4.308 806 1HD1 ILE 126 1HD1 ILE 126 11.285 10.359 2.791 807 2HD1 ILE 126 2HD1 ILE 126 12.400 8.971 2.804 808 3HD1 ILE 126 3HD1 ILE 126 11.052 9.035 3.968 809 H VAL 127 H VAL 127 12.412 13.963 6.313 810 HA VAL 127 HA VAL 127 15.054 14.522 5.121 811 HB VAL 127 HB VAL 127 14.191 16.882 5.078 812 1HG1 VAL 127 1HG1 VAL 127 12.671 16.517 3.217 813 2HG1 VAL 127 2HG1 VAL 127 14.034 15.387 3.134 814 3HG1 VAL 127 3HG1 VAL 127 12.443 14.824 3.686 815 1HG2 VAL 127 1HG2 VAL 127 12.482 16.652 6.947 816 2HG2 VAL 127 2HG2 VAL 127 11.860 17.363 5.452 817 3HG2 VAL 127 3HG2 VAL 127 11.486 15.682 5.844 818 H LYS 128 H LYS 128 15.693 13.427 7.385 819 HA LYS 128 HA LYS 128 16.884 15.684 8.844 820 1HB LYS 128 1HB LYS 128 15.348 13.584 10.423 821 2HB LYS 128 2HB LYS 128 16.483 14.770 11.058 822 1HG LYS 128 1HG LYS 128 15.014 16.582 10.080 823 2HG LYS 128 2HG LYS 128 13.840 15.319 9.654 824 1HD LYS 128 1HD LYS 128 13.764 14.635 12.089 825 2HD LYS 128 2HD LYS 128 14.916 15.925 12.444 826 1HE LYS 128 1HE LYS 128 12.851 16.856 13.043 827 2HE LYS 128 2HE LYS 128 13.228 17.595 11.481 828 1HZ LYS 128 1HZ LYS 128 10.940 16.875 11.631 829 2HZ LYS 128 2HZ LYS 128 11.665 15.995 10.465 830 3HZ LYS 128 3HZ LYS 128 11.381 15.328 11.933 831 HA PRO 129 HA PRO 129 19.755 12.177 9.825 832 1HB PRO 129 1HB PRO 129 19.333 9.543 9.288 833 2HB PRO 129 2HB PRO 129 18.614 10.346 10.715 834 1HG PRO 129 1HG PRO 129 17.341 9.924 7.997 835 2HG PRO 129 2HG PRO 129 16.677 9.449 9.582 836 1HD PRO 129 1HD PRO 129 15.903 11.757 8.476 837 2HD PRO 129 2HD PRO 129 16.304 11.677 10.217 838 H VAL 130 H VAL 130 21.522 11.180 8.693 839 HA VAL 130 HA VAL 130 21.968 12.094 6.089 840 HB VAL 130 HB VAL 130 23.336 9.917 7.728 841 1HG1 VAL 130 1HG1 VAL 130 24.275 11.437 5.263 842 2HG1 VAL 130 2HG1 VAL 130 25.302 10.405 6.285 843 3HG1 VAL 130 3HG1 VAL 130 23.967 9.688 5.376 844 1HG2 VAL 130 1HG2 VAL 130 24.962 11.727 8.248 845 2HG2 VAL 130 2HG2 VAL 130 23.955 12.889 7.362 846 3HG2 VAL 130 3HG2 VAL 130 23.354 12.135 8.853 847 H GLU 131 H GLU 131 21.062 8.844 7.302 848 HA GLU 131 HA GLU 131 21.318 7.274 5.069 849 1HB GLU 131 1HB GLU 131 19.130 7.284 7.185 850 2HB GLU 131 2HB GLU 131 19.460 5.921 6.111 851 1HG GLU 131 1HG GLU 131 21.281 5.251 7.302 852 2HG GLU 131 2HG GLU 131 21.897 6.884 7.536 853 H THR 132 H THR 132 18.377 9.208 5.828 854 HA THR 132 HA THR 132 17.368 8.466 3.155 855 HB THR 132 HB THR 132 15.217 9.336 4.075 856 HG1 THR 132 HG1 THR 132 15.840 10.600 5.809 857 1HG2 THR 132 1HG2 THR 132 16.572 7.097 5.649 858 2HG2 THR 132 2HG2 THR 132 14.828 7.380 5.537 859 3HG2 THR 132 3HG2 THR 132 15.747 6.926 4.085 860 H GLN 133 H GLN 133 19.043 11.062 4.501 861 HA GLN 133 HA GLN 133 17.936 13.383 3.797 862 1HB GLN 133 1HB GLN 133 20.434 12.694 4.510 863 2HB GLN 133 2HB GLN 133 20.750 12.872 2.810 864 1HG GLN 133 1HG GLN 133 21.258 14.954 3.793 865 2HG GLN 133 2HG GLN 133 19.732 15.210 2.945 866 1HE2 GLN 133 1HE2 GLN 133 19.196 13.387 5.898 867 2HE2 GLN 133 2HE2 GLN 133 18.937 14.745 6.942 868 H GLY 134 H GLY 134 16.635 13.805 2.065 869 1HA GLY 134 1HA GLY 134 16.700 14.783 -0.144 870 2HA GLY 134 2HA GLY 134 17.810 13.530 -0.690 871 H ILE 135 H ILE 135 16.166 11.415 0.806 872 HA ILE 135 HA ILE 135 14.570 10.496 -1.373 873 HB ILE 135 HB ILE 135 14.547 9.749 1.541 874 1HG1 ILE 135 1HG1 ILE 135 16.736 9.346 0.454 875 2HG1 ILE 135 2HG1 ILE 135 15.863 7.869 0.840 876 1HG2 ILE 135 1HG2 ILE 135 13.482 7.671 0.808 877 2HG2 ILE 135 2HG2 ILE 135 12.430 9.055 0.530 878 3HG2 ILE 135 3HG2 ILE 135 13.278 8.333 -0.837 879 1HD1 ILE 135 1HD1 ILE 135 16.073 9.053 -1.948 880 2HD1 ILE 135 2HD1 ILE 135 16.991 7.692 -1.291 881 3HD1 ILE 135 3HD1 ILE 135 15.243 7.539 -1.496 882 H LYS 136 H LYS 136 12.505 11.025 -1.964 883 HA LYS 136 HA LYS 136 10.560 11.808 0.029 884 1HB LYS 136 1HB LYS 136 9.997 13.993 -0.973 885 2HB LYS 136 2HB LYS 136 11.480 13.866 -0.032 886 1HG LYS 136 1HG LYS 136 12.755 13.593 -2.219 887 2HG LYS 136 2HG LYS 136 11.244 13.935 -3.081 888 1HD LYS 136 1HD LYS 136 11.012 16.069 -2.061 889 2HD LYS 136 2HD LYS 136 12.217 15.718 -0.826 890 1HE LYS 136 1HE LYS 136 12.906 15.878 -3.806 891 2HE LYS 136 2HE LYS 136 12.993 17.283 -2.733 892 1HZ LYS 136 1HZ LYS 136 14.620 16.210 -1.432 893 2HZ LYS 136 2HZ LYS 136 14.500 14.783 -2.218 894 3HZ LYS 136 3HZ LYS 136 15.115 16.102 -2.995 895 H THR 137 H THR 137 10.472 9.561 -1.553 896 HA THR 137 HA THR 137 7.861 10.093 -2.471 897 HB THR 137 HB THR 137 9.585 8.656 -4.533 898 HG1 THR 137 HG1 THR 137 8.939 11.354 -4.212 899 1HG2 THR 137 1HG2 THR 137 7.252 8.003 -4.453 900 2HG2 THR 137 2HG2 THR 137 6.759 9.708 -4.612 901 3HG2 THR 137 3HG2 THR 137 7.643 8.913 -5.934 902 H LEU 138 H LEU 138 7.175 8.887 -0.802 903 HA LEU 138 HA LEU 138 8.602 6.421 -0.092 904 1HB LEU 138 1HB LEU 138 7.138 8.371 1.288 905 2HB LEU 138 2HB LEU 138 6.160 6.915 1.447 906 HG LEU 138 HG LEU 138 8.320 5.803 2.179 907 1HD1 LEU 138 1HD1 LEU 138 10.060 7.283 3.081 908 2HD1 LEU 138 2HD1 LEU 138 9.973 7.420 1.321 909 3HD1 LEU 138 3HD1 LEU 138 9.263 8.689 2.343 910 1HD2 LEU 138 1HD2 LEU 138 6.518 6.645 3.779 911 2HD2 LEU 138 2HD2 LEU 138 8.144 6.632 4.493 912 3HD2 LEU 138 3HD2 LEU 138 7.430 8.138 3.938 913 H THR 139 H THR 139 8.310 5.018 -1.717 914 HA THR 139 HA THR 139 5.646 4.574 -2.811 915 HB THR 139 HB THR 139 7.638 4.453 -4.277 916 HG1 THR 139 HG1 THR 139 6.004 3.337 -5.115 917 1HG2 THR 139 1HG2 THR 139 8.197 1.811 -2.869 918 2HG2 THR 139 2HG2 THR 139 9.120 2.554 -4.186 919 3HG2 THR 139 3HG2 THR 139 9.088 3.320 -2.577 920 H LEU 140 H LEU 140 5.215 2.165 -3.151 921 HA LEU 140 HA LEU 140 5.817 0.451 -0.948 922 1HB LEU 140 1HB LEU 140 3.617 1.900 -0.385 923 2HB LEU 140 2HB LEU 140 2.817 0.759 -1.461 924 HG LEU 140 HG LEU 140 4.322 0.230 1.123 925 1HD1 LEU 140 1HD1 LEU 140 1.440 -0.197 0.293 926 2HD1 LEU 140 2HD1 LEU 140 2.134 -0.698 1.849 927 3HD1 LEU 140 3HD1 LEU 140 2.048 1.018 1.421 928 1HD2 LEU 140 1HD2 LEU 140 3.136 -1.873 -0.739 929 2HD2 LEU 140 2HD2 LEU 140 4.874 -1.628 -0.454 930 3HD2 LEU 140 3HD2 LEU 140 3.845 -2.119 0.880 931 H SER 141 H SER 141 6.726 -0.892 -2.481 932 HA SER 141 HA SER 141 5.321 -1.560 -5.002 933 1HB SER 141 1HB SER 141 8.032 -2.309 -3.946 934 2HB SER 141 2HB SER 141 7.272 -3.092 -5.346 935 HG SER 141 HG SER 141 7.194 -1.152 -6.394 936 H TYR 142 H TYR 142 3.521 -2.519 -4.533 937 HA TYR 142 HA TYR 142 3.353 -4.819 -2.678 938 1HB TYR 142 1HB TYR 142 1.450 -3.491 -4.631 939 2HB TYR 142 2HB TYR 142 1.058 -4.970 -3.785 940 HD1 TYR 142 HD1 TYR 142 0.532 -1.526 -3.689 941 HD2 TYR 142 HD2 TYR 142 1.529 -4.839 -1.121 942 HE1 TYR 142 HE1 TYR 142 -0.707 -0.465 -1.818 943 HE2 TYR 142 HE2 TYR 142 0.337 -3.751 0.749 944 HH TYR 142 HH TYR 142 -1.342 -2.171 1.225 945 H THR 143 H THR 143 3.907 -6.795 -3.331 946 HA THR 143 HA THR 143 3.993 -7.461 -6.243 947 HB THR 143 HB THR 143 5.892 -8.434 -4.091 948 HG1 THR 143 HG1 THR 143 7.370 -7.043 -5.126 949 1HG2 THR 143 1HG2 THR 143 5.541 -9.968 -6.045 950 2HG2 THR 143 2HG2 THR 143 5.976 -8.642 -7.141 951 3HG2 THR 143 3HG2 THR 143 7.183 -9.298 -6.014 952 H PHE 144 H PHE 144 1.994 -8.181 -6.218 953 HA PHE 144 HA PHE 144 0.962 -10.036 -4.194 954 1HB PHE 144 1HB PHE 144 -0.097 -8.460 -6.536 955 2HB PHE 144 2HB PHE 144 -0.979 -9.853 -5.989 956 HD1 PHE 144 HD1 PHE 144 -2.946 -8.842 -5.041 957 HD2 PHE 144 HD2 PHE 144 0.950 -7.351 -3.910 958 HE1 PHE 144 HE1 PHE 144 -3.898 -7.868 -2.969 959 HE2 PHE 144 HE2 PHE 144 -0.025 -6.406 -1.853 960 HZ PHE 144 HZ PHE 144 -2.422 -6.682 -1.367 961 H TYR 145 H TYR 145 2.296 -11.840 -4.412 962 HA TYR 145 HA TYR 145 1.631 -13.595 -6.699 963 1HB TYR 145 1HB TYR 145 3.882 -13.963 -7.338 964 2HB TYR 145 2HB TYR 145 3.530 -12.241 -7.395 965 HD1 TYR 145 HD1 TYR 145 4.099 -12.685 -3.946 966 HD2 TYR 145 HD2 TYR 145 6.169 -12.800 -7.742 967 HE1 TYR 145 HE1 TYR 145 6.200 -12.215 -2.809 968 HE2 TYR 145 HE2 TYR 145 8.292 -12.282 -6.572 969 HH TYR 145 HH TYR 145 8.474 -11.857 -3.031 970 HA PRO 146 HA PRO 146 2.432 -16.229 -2.907 971 1HB PRO 146 1HB PRO 146 0.000 -16.708 -1.813 972 2HB PRO 146 2HB PRO 146 0.983 -15.282 -1.427 973 1HG PRO 146 1HG PRO 146 -1.275 -15.416 -3.440 974 2HG PRO 146 2HG PRO 146 -1.022 -14.240 -2.128 975 1HD PRO 146 1HD PRO 146 -0.214 -13.819 -4.724 976 2HD PRO 146 2HD PRO 146 0.695 -13.132 -3.346 977 H ARG 147 H ARG 147 -0.813 -17.442 -3.620 978 HA ARG 147 HA ARG 147 0.324 -19.465 -5.496 979 1HB ARG 147 1HB ARG 147 -1.108 -20.108 -2.888 980 2HB ARG 147 2HB ARG 147 -0.610 -21.272 -4.107 981 1HG ARG 147 1HG ARG 147 1.280 -19.635 -2.350 982 2HG ARG 147 2HG ARG 147 0.710 -21.265 -2.021 983 1HD ARG 147 1HD ARG 147 2.862 -21.533 -2.895 984 2HD ARG 147 2HD ARG 147 1.759 -22.040 -4.195 985 HE ARG 147 HE ARG 147 2.123 -19.382 -4.700 986 1HH1 ARG 147 1HH1 ARG 147 4.505 -21.952 -4.377 987 2HH1 ARG 147 2HH1 ARG 147 5.795 -21.015 -5.072 988 1HH2 ARG 147 1HH2 ARG 147 3.653 -18.157 -5.484 989 2HH2 ARG 147 2HH2 ARG 147 5.282 -18.730 -5.805 990 H GLU 148 H GLU 148 -1.102 -19.432 -7.188 991 HA GLU 148 HA GLU 148 -3.982 -19.200 -6.557 992 1HB GLU 148 1HB GLU 148 -4.401 -18.959 -8.862 993 2HB GLU 148 2HB GLU 148 -3.181 -17.776 -8.363 994 1HG GLU 148 1HG GLU 148 -1.464 -18.876 -9.587 995 2HG GLU 148 2HG GLU 148 -2.406 -20.365 -9.768 996 HA PRO 149 HA PRO 149 -4.002 -23.717 -7.182 997 1HB PRO 149 1HB PRO 149 -6.697 -24.138 -7.482 998 2HB PRO 149 2HB PRO 149 -5.913 -23.843 -5.907 999 1HG PRO 149 1HG PRO 149 -7.457 -21.870 -7.586 1000 2HG PRO 149 2HG PRO 149 -7.475 -22.087 -5.823 1001 1HD PRO 149 1HD PRO 149 -5.999 -20.147 -7.128 1002 2HD PRO 149 2HD PRO 149 -5.526 -20.856 -5.548 1003 H SER 150 H SER 150 -6.275 -21.729 -9.127 1004 HA SER 150 HA SER 150 -4.837 -21.769 -11.500 1005 1HB SER 150 1HB SER 150 -5.440 -24.198 -11.651 1006 2HB SER 150 2HB SER 150 -7.151 -23.751 -11.544 1007 HG SER 150 HG SER 150 -5.280 -22.978 -13.550 1008 H LYS 151 H LYS 151 -5.579 -19.790 -12.238 1009 HA LYS 151 HA LYS 151 -8.550 -19.268 -12.270 1010 1HB LYS 151 1HB LYS 151 -7.928 -17.054 -13.179 1011 2HB LYS 151 2HB LYS 151 -7.520 -17.365 -11.493 1012 1HG LYS 151 1HG LYS 151 -5.254 -17.505 -11.880 1013 2HG LYS 151 2HG LYS 151 -5.393 -17.798 -13.613 1014 1HD LYS 151 1HD LYS 151 -6.086 -15.529 -14.029 1015 2HD LYS 151 2HD LYS 151 -6.275 -15.196 -12.296 1016 1HE LYS 151 1HE LYS 151 -3.811 -15.627 -11.972 1017 2HE LYS 151 2HE LYS 151 -3.636 -15.855 -13.710 1018 1HZ LYS 151 1HZ LYS 151 -4.329 -13.579 -14.012 1019 2HZ LYS 151 2HZ LYS 151 -4.589 -13.383 -12.397 1020 3HZ LYS 151 3HZ LYS 151 -3.063 -13.634 -12.959 Start of MODEL 6 1 H VAL 21 H VAL 21 -1.771 10.173 16.157 2 HA VAL 21 HA VAL 21 -0.621 7.585 15.293 3 HB VAL 21 HB VAL 21 -0.898 7.437 17.694 4 1HG1 VAL 21 1HG1 VAL 21 -2.643 9.216 18.029 5 2HG1 VAL 21 2HG1 VAL 21 -3.857 8.108 17.362 6 3HG1 VAL 21 3HG1 VAL 21 -3.004 7.692 18.852 7 1HG2 VAL 21 1HG2 VAL 21 -2.375 5.490 17.787 8 2HG2 VAL 21 2HG2 VAL 21 -3.137 5.949 16.253 9 3HG2 VAL 21 3HG2 VAL 21 -1.426 5.469 16.290 10 H GLU 22 H GLU 22 -1.620 6.974 13.500 11 HA GLU 22 HA GLU 22 -2.782 7.272 11.614 12 1HB GLU 22 1HB GLU 22 -4.051 5.610 13.179 13 2HB GLU 22 2HB GLU 22 -5.306 6.853 13.212 14 1HG GLU 22 1HG GLU 22 -5.416 6.788 10.724 15 2HG GLU 22 2HG GLU 22 -4.104 5.602 10.682 16 H GLN 23 H GLN 23 -2.139 9.763 12.647 17 HA GLN 23 HA GLN 23 -3.991 11.473 11.285 18 1HB GLN 23 1HB GLN 23 -3.459 11.788 14.283 19 2HB GLN 23 2HB GLN 23 -3.972 13.119 13.256 20 1HG GLN 23 1HG GLN 23 -5.573 10.643 13.975 21 2HG GLN 23 2HG GLN 23 -5.860 12.329 14.444 22 1HE2 GLN 23 1HE2 GLN 23 -5.306 13.441 11.742 23 2HE2 GLN 23 2HE2 GLN 23 -6.640 12.922 10.735 24 H ALA 24 H ALA 24 -3.013 13.575 11.102 25 HA ALA 24 HA ALA 24 -0.392 14.079 12.257 26 1HB ALA 24 1HB ALA 24 -1.082 14.331 9.300 27 2HB ALA 24 2HB ALA 24 0.422 14.901 10.046 28 3HB ALA 24 3HB ALA 24 0.075 13.151 9.946 29 H SER 25 H SER 25 -0.713 16.400 13.073 30 HA SER 25 HA SER 25 -2.532 18.000 11.491 31 1HB SER 25 1HB SER 25 -4.165 16.727 12.935 32 2HB SER 25 2HB SER 25 -3.259 17.250 14.372 33 HG SER 25 HG SER 25 -3.756 19.421 13.705 34 H ASP 26 H ASP 26 0.069 18.111 11.961 35 HA ASP 26 HA ASP 26 0.617 20.603 13.415 36 1HB ASP 26 1HB ASP 26 2.381 18.372 14.378 37 2HB ASP 26 2HB ASP 26 1.674 19.720 15.235 38 H LEU 27 H LEU 27 1.944 17.598 12.350 39 HA LEU 27 HA LEU 27 4.453 18.687 11.425 40 1HB LEU 27 1HB LEU 27 4.949 16.259 11.064 41 2HB LEU 27 2HB LEU 27 4.427 16.680 12.673 42 HG LEU 27 HG LEU 27 2.079 15.953 11.108 43 1HD1 LEU 27 1HD1 LEU 27 4.288 13.882 11.114 44 2HD1 LEU 27 2HD1 LEU 27 2.591 13.577 10.712 45 3HD1 LEU 27 3HD1 LEU 27 3.557 14.644 9.681 46 1HD2 LEU 27 1HD2 LEU 27 1.815 14.303 12.918 47 2HD2 LEU 27 2HD2 LEU 27 3.496 14.551 13.407 48 3HD2 LEU 27 3HD2 LEU 27 2.319 15.861 13.600 49 H ILE 28 H ILE 28 2.329 19.724 9.829 50 HA ILE 28 HA ILE 28 2.626 18.308 7.224 51 HB ILE 28 HB ILE 28 0.345 20.043 8.217 52 1HG1 ILE 28 1HG1 ILE 28 0.901 17.051 8.521 53 2HG1 ILE 28 2HG1 ILE 28 0.539 18.244 9.768 54 1HG2 ILE 28 1HG2 ILE 28 0.738 19.359 5.689 55 2HG2 ILE 28 2HG2 ILE 28 0.209 17.771 6.250 56 3HG2 ILE 28 3HG2 ILE 28 -0.876 19.157 6.432 57 1HD1 ILE 28 1HD1 ILE 28 -1.523 17.341 7.776 58 2HD1 ILE 28 2HD1 ILE 28 -1.394 16.926 9.484 59 3HD1 ILE 28 3HD1 ILE 28 -1.685 18.613 9.022 60 H LEU 29 H LEU 29 4.670 19.573 7.269 61 HA LEU 29 HA LEU 29 4.575 22.416 6.604 62 1HB LEU 29 1HB LEU 29 6.837 20.414 6.398 63 2HB LEU 29 2HB LEU 29 6.944 22.160 6.209 64 HG LEU 29 HG LEU 29 7.734 21.745 8.311 65 1HD1 LEU 29 1HD1 LEU 29 4.867 22.572 8.880 66 2HD1 LEU 29 2HD1 LEU 29 6.307 22.938 9.842 67 3HD1 LEU 29 3HD1 LEU 29 6.133 23.639 8.222 68 1HD2 LEU 29 1HD2 LEU 29 6.867 20.398 10.051 69 2HD2 LEU 29 2HD2 LEU 29 5.319 20.169 9.245 70 3HD2 LEU 29 3HD2 LEU 29 6.786 19.408 8.583 71 H ASP 30 H ASP 30 4.949 23.288 4.538 72 HA ASP 30 HA ASP 30 3.627 21.880 2.508 73 1HB ASP 30 1HB ASP 30 5.017 24.571 2.397 74 2HB ASP 30 2HB ASP 30 3.746 23.983 1.308 75 H GLU 31 H GLU 31 5.560 20.210 2.697 76 HA GLU 31 HA GLU 31 7.096 20.436 0.134 77 1HB GLU 31 1HB GLU 31 7.723 19.305 2.800 78 2HB GLU 31 2HB GLU 31 7.959 18.130 1.496 79 1HG GLU 31 1HG GLU 31 9.136 20.928 1.334 80 2HG GLU 31 2HG GLU 31 9.941 19.621 2.211 81 H LYS 32 H LYS 32 5.556 19.918 -1.271 82 HA LYS 32 HA LYS 32 3.411 18.136 -0.475 83 1HB LYS 32 1HB LYS 32 3.500 20.321 -1.969 84 2HB LYS 32 2HB LYS 32 3.761 19.203 -3.293 85 1HG LYS 32 1HG LYS 32 1.517 19.142 -1.213 86 2HG LYS 32 2HG LYS 32 1.367 19.894 -2.796 87 1HD LYS 32 1HD LYS 32 1.860 16.907 -2.324 88 2HD LYS 32 2HD LYS 32 0.299 17.651 -2.669 89 1HE LYS 32 1HE LYS 32 1.199 18.536 -4.836 90 2HE LYS 32 2HE LYS 32 2.722 17.669 -4.549 91 1HZ LYS 32 1HZ LYS 32 1.505 15.627 -4.562 92 2HZ LYS 32 2HZ LYS 32 0.082 16.390 -4.694 93 3HZ LYS 32 3HZ LYS 32 1.150 16.447 -5.952 94 H ILE 33 H ILE 33 4.666 16.359 0.005 95 HA ILE 33 HA ILE 33 6.168 14.950 -1.987 96 HB ILE 33 HB ILE 33 6.962 15.078 0.128 97 1HG1 ILE 33 1HG1 ILE 33 7.338 13.069 -1.295 98 2HG1 ILE 33 2HG1 ILE 33 7.788 12.957 0.413 99 1HG2 ILE 33 1HG2 ILE 33 6.145 14.043 2.131 100 2HG2 ILE 33 2HG2 ILE 33 4.984 15.239 1.536 101 3HG2 ILE 33 3HG2 ILE 33 4.696 13.489 1.299 102 1HD1 ILE 33 1HD1 ILE 33 6.736 10.898 -0.486 103 2HD1 ILE 33 2HD1 ILE 33 5.876 11.564 0.910 104 3HD1 ILE 33 3HD1 ILE 33 5.230 11.798 -0.722 105 H LYS 34 H LYS 34 5.788 13.283 -3.201 106 HA LYS 34 HA LYS 34 2.995 12.303 -3.556 107 1HB LYS 34 1HB LYS 34 3.845 13.619 -5.405 108 2HB LYS 34 2HB LYS 34 5.326 12.662 -5.484 109 1HG LYS 34 1HG LYS 34 2.539 11.538 -6.033 110 2HG LYS 34 2HG LYS 34 3.604 12.291 -7.224 111 1HD LYS 34 1HD LYS 34 5.309 10.411 -6.074 112 2HD LYS 34 2HD LYS 34 3.783 9.569 -5.984 113 1HE LYS 34 1HE LYS 34 5.388 10.468 -8.391 114 2HE LYS 34 2HE LYS 34 4.662 8.895 -8.037 115 1HZ LYS 34 1HZ LYS 34 2.465 10.149 -8.377 116 2HZ LYS 34 2HZ LYS 34 3.339 11.289 -9.100 117 3HZ LYS 34 3HZ LYS 34 3.343 9.761 -9.698 118 H VAL 35 H VAL 35 2.813 9.978 -3.858 119 HA VAL 35 HA VAL 35 5.290 8.380 -3.403 120 HB VAL 35 HB VAL 35 3.862 6.940 -2.048 121 1HG1 VAL 35 1HG1 VAL 35 4.320 9.652 -0.693 122 2HG1 VAL 35 2HG1 VAL 35 4.526 8.052 0.039 123 3HG1 VAL 35 3HG1 VAL 35 5.654 8.615 -1.202 124 1HG2 VAL 35 1HG2 VAL 35 1.600 7.881 -2.319 125 2HG2 VAL 35 2HG2 VAL 35 2.071 7.914 -0.620 126 3HG2 VAL 35 3HG2 VAL 35 2.142 9.403 -1.568 127 H THR 36 H THR 36 5.441 6.964 -5.017 128 HA THR 36 HA THR 36 3.057 6.382 -6.661 129 HB THR 36 HB THR 36 5.693 6.836 -7.342 130 HG1 THR 36 HG1 THR 36 4.905 6.123 -9.396 131 1HG2 THR 36 1HG2 THR 36 5.222 3.858 -7.696 132 2HG2 THR 36 2HG2 THR 36 6.478 4.823 -8.493 133 3HG2 THR 36 3HG2 THR 36 6.509 4.649 -6.743 134 H PHE 37 H PHE 37 1.769 4.823 -6.103 135 HA PHE 37 HA PHE 37 2.553 2.774 -4.090 136 1HB PHE 37 1HB PHE 37 -0.030 3.734 -5.376 137 2HB PHE 37 2HB PHE 37 0.107 2.109 -4.741 138 HD1 PHE 37 HD1 PHE 37 -1.557 2.341 -3.056 139 HD2 PHE 37 HD2 PHE 37 1.845 5.008 -3.123 140 HE1 PHE 37 HE1 PHE 37 -2.055 3.094 -0.745 141 HE2 PHE 37 HE2 PHE 37 1.218 5.842 -0.896 142 HZ PHE 37 HZ PHE 37 -0.938 5.132 0.106 143 H ASP 38 H ASP 38 4.088 1.579 -5.287 144 HA ASP 38 HA ASP 38 3.421 0.911 -8.038 145 1HB ASP 38 1HB ASP 38 5.685 1.444 -7.629 146 2HB ASP 38 2HB ASP 38 5.801 0.361 -6.275 147 H ALA 39 H ALA 39 1.333 -0.026 -7.391 148 HA ALA 39 HA ALA 39 1.321 -2.659 -6.220 149 1HB ALA 39 1HB ALA 39 -1.018 -2.710 -7.091 150 2HB ALA 39 2HB ALA 39 -0.660 -1.202 -6.223 151 3HB ALA 39 3HB ALA 39 -0.687 -1.233 -8.005 152 H ASN 40 H ASN 40 1.989 -4.566 -7.203 153 HA ASN 40 HA ASN 40 1.675 -4.843 -10.153 154 1HB ASN 40 1HB ASN 40 3.963 -6.085 -8.599 155 2HB ASN 40 2HB ASN 40 3.776 -5.897 -10.338 156 1HD2 ASN 40 1HD2 ASN 40 4.590 -4.313 -7.293 157 2HD2 ASN 40 2HD2 ASN 40 5.454 -2.942 -7.995 158 H VAL 41 H VAL 41 1.098 -7.016 -10.773 159 HA VAL 41 HA VAL 41 0.623 -8.992 -8.674 160 HB VAL 41 HB VAL 41 -1.438 -7.750 -8.582 161 1HG1 VAL 41 1HG1 VAL 41 -1.369 -6.505 -10.694 162 2HG1 VAL 41 2HG1 VAL 41 -1.651 -8.004 -11.608 163 3HG1 VAL 41 3HG1 VAL 41 -2.901 -7.366 -10.524 164 1HG2 VAL 41 1HG2 VAL 41 -2.041 -10.165 -10.323 165 2HG2 VAL 41 2HG2 VAL 41 -1.615 -10.261 -8.604 166 3HG2 VAL 41 3HG2 VAL 41 -3.081 -9.409 -9.109 167 H ALA 42 H ALA 42 0.477 -11.083 -9.473 168 HA ALA 42 HA ALA 42 0.525 -11.469 -12.415 169 1HB ALA 42 1HB ALA 42 2.334 -12.957 -10.457 170 2HB ALA 42 2HB ALA 42 2.195 -13.256 -12.201 171 3HB ALA 42 3HB ALA 42 2.884 -11.728 -11.620 172 H ALA 43 H ALA 43 -0.110 -13.817 -12.856 173 HA ALA 43 HA ALA 43 -2.607 -14.380 -11.855 174 1HB ALA 43 1HB ALA 43 -1.619 -15.330 -13.927 175 2HB ALA 43 2HB ALA 43 -0.612 -16.412 -12.934 176 3HB ALA 43 3HB ALA 43 -2.381 -16.563 -12.908 177 H GLY 44 H GLY 44 0.479 -15.480 -10.603 178 1HA GLY 44 1HA GLY 44 0.117 -17.245 -8.609 179 2HA GLY 44 2HA GLY 44 1.086 -15.783 -8.413 180 H LEU 45 H LEU 45 -1.027 -13.806 -8.421 181 HA LEU 45 HA LEU 45 -2.846 -14.673 -6.244 182 1HB LEU 45 1HB LEU 45 -0.975 -12.708 -5.993 183 2HB LEU 45 2HB LEU 45 -2.326 -11.764 -6.563 184 HG LEU 45 HG LEU 45 -2.595 -13.746 -4.233 185 1HD1 LEU 45 1HD1 LEU 45 -1.192 -12.201 -3.164 186 2HD1 LEU 45 2HD1 LEU 45 -1.400 -11.038 -4.433 187 3HD1 LEU 45 3HD1 LEU 45 -2.627 -11.171 -3.165 188 1HD2 LEU 45 1HD2 LEU 45 -4.661 -13.068 -5.410 189 2HD2 LEU 45 2HD2 LEU 45 -4.532 -12.481 -3.745 190 3HD2 LEU 45 3HD2 LEU 45 -4.245 -11.359 -5.100 191 HA PRO 46 HA PRO 46 -5.018 -13.907 -10.192 192 1HB PRO 46 1HB PRO 46 -6.930 -15.810 -10.068 193 2HB PRO 46 2HB PRO 46 -5.197 -16.249 -10.129 194 1HG PRO 46 1HG PRO 46 -6.868 -15.940 -7.625 195 2HG PRO 46 2HG PRO 46 -5.974 -17.411 -8.140 196 1HD PRO 46 1HD PRO 46 -4.906 -15.561 -6.455 197 2HD PRO 46 2HD PRO 46 -3.887 -16.356 -7.694 198 H TRP 47 H TRP 47 -5.405 -11.989 -8.175 199 HA TRP 47 HA TRP 47 -8.369 -11.686 -7.903 200 1HB TRP 47 1HB TRP 47 -6.179 -10.658 -6.089 201 2HB TRP 47 2HB TRP 47 -7.905 -10.353 -5.956 202 HD1 TRP 47 HD1 TRP 47 -7.885 -13.853 -6.738 203 HE1 TRP 47 HE1 TRP 47 -8.007 -15.335 -4.697 204 HE3 TRP 47 HE3 TRP 47 -6.485 -10.473 -3.128 205 HZ2 TRP 47 HZ2 TRP 47 -7.614 -15.166 -1.924 206 HZ3 TRP 47 HZ3 TRP 47 -6.106 -11.334 -0.854 207 HH2 TRP 47 HH2 TRP 47 -6.719 -13.590 -0.201 208 H GLU 48 H GLU 48 -9.170 -9.668 -8.398 209 HA GLU 48 HA GLU 48 -7.690 -8.178 -10.424 210 1HB GLU 48 1HB GLU 48 -10.160 -8.729 -10.414 211 2HB GLU 48 2HB GLU 48 -10.320 -7.704 -8.990 212 1HG GLU 48 1HG GLU 48 -9.337 -5.838 -10.603 213 2HG GLU 48 2HG GLU 48 -9.884 -6.934 -11.883 214 H PHE 49 H PHE 49 -5.891 -7.715 -8.959 215 HA PHE 49 HA PHE 49 -6.301 -5.802 -6.773 216 1HB PHE 49 1HB PHE 49 -4.698 -7.613 -6.541 217 2HB PHE 49 2HB PHE 49 -3.801 -7.036 -7.945 218 HD1 PHE 49 HD1 PHE 49 -1.809 -5.858 -7.431 219 HD2 PHE 49 HD2 PHE 49 -5.120 -5.647 -4.664 220 HE1 PHE 49 HE1 PHE 49 -0.352 -4.791 -5.750 221 HE2 PHE 49 HE2 PHE 49 -3.696 -4.429 -3.067 222 HZ PHE 49 HZ PHE 49 -1.309 -4.005 -3.586 223 H VAL 50 H VAL 50 -7.165 -4.009 -7.886 224 HA VAL 50 HA VAL 50 -5.424 -2.748 -9.918 225 HB VAL 50 HB VAL 50 -7.154 -1.500 -10.680 226 1HG1 VAL 50 1HG1 VAL 50 -8.627 -3.945 -9.646 227 2HG1 VAL 50 2HG1 VAL 50 -8.971 -3.028 -11.122 228 3HG1 VAL 50 3HG1 VAL 50 -7.481 -3.988 -11.013 229 1HG2 VAL 50 1HG2 VAL 50 -9.357 -1.186 -9.586 230 2HG2 VAL 50 2HG2 VAL 50 -8.714 -1.952 -8.122 231 3HG2 VAL 50 3HG2 VAL 50 -8.042 -0.412 -8.702 232 HA PRO 51 HA PRO 51 -4.371 0.250 -6.601 233 1HB PRO 51 1HB PRO 51 -2.818 1.944 -8.078 234 2HB PRO 51 2HB PRO 51 -2.193 0.393 -7.470 235 1HG PRO 51 1HG PRO 51 -3.277 1.028 -10.228 236 2HG PRO 51 2HG PRO 51 -1.781 0.138 -9.831 237 1HD PRO 51 1HD PRO 51 -4.168 -1.064 -10.472 238 2HD PRO 51 2HD PRO 51 -3.004 -1.834 -9.351 239 H VAL 52 H VAL 52 -5.176 2.385 -6.398 240 HA VAL 52 HA VAL 52 -7.653 2.725 -7.862 241 HB VAL 52 HB VAL 52 -7.604 4.884 -6.220 242 1HG1 VAL 52 1HG1 VAL 52 -8.943 3.481 -4.702 243 2HG1 VAL 52 2HG1 VAL 52 -9.380 3.206 -6.396 244 3HG1 VAL 52 3HG1 VAL 52 -8.367 2.019 -5.543 245 1HG2 VAL 52 1HG2 VAL 52 -5.331 4.151 -5.322 246 2HG2 VAL 52 2HG2 VAL 52 -6.640 4.226 -4.116 247 3HG2 VAL 52 3HG2 VAL 52 -6.124 2.661 -4.770 248 H GLN 53 H GLN 53 -4.862 4.754 -7.158 249 HA GLN 53 HA GLN 53 -4.743 5.706 -9.925 250 1HB GLN 53 1HB GLN 53 -3.946 7.348 -7.492 251 2HB GLN 53 2HB GLN 53 -3.720 7.794 -9.159 252 1HG GLN 53 1HG GLN 53 -5.580 9.052 -8.451 253 2HG GLN 53 2HG GLN 53 -6.220 7.775 -9.497 254 1HE2 GLN 53 1HE2 GLN 53 -5.210 7.722 -6.007 255 2HE2 GLN 53 2HE2 GLN 53 -6.776 7.196 -5.438 256 H ARG 54 H ARG 54 -2.294 5.849 -10.405 257 HA ARG 54 HA ARG 54 -1.043 3.567 -9.210 258 1HB ARG 54 1HB ARG 54 -0.578 5.085 -11.509 259 2HB ARG 54 2HB ARG 54 0.861 5.392 -10.542 260 1HG ARG 54 1HG ARG 54 -0.272 2.700 -11.405 261 2HG ARG 54 2HG ARG 54 1.155 3.514 -12.071 262 1HD ARG 54 1HD ARG 54 2.325 3.236 -10.044 263 2HD ARG 54 2HD ARG 54 0.900 2.619 -9.257 264 HE ARG 54 HE ARG 54 0.925 0.611 -10.618 265 1HH1 ARG 54 1HH1 ARG 54 4.042 2.372 -10.688 266 2HH1 ARG 54 2HH1 ARG 54 4.908 0.884 -10.271 267 1HH2 ARG 54 1HH2 ARG 54 2.297 -1.327 -10.253 268 2HH2 ARG 54 2HH2 ARG 54 4.025 -1.022 -10.174 269 H ASP 55 H ASP 55 -1.093 7.012 -8.360 270 HA ASP 55 HA ASP 55 0.842 6.594 -6.195 271 1HB ASP 55 1HB ASP 55 1.807 8.673 -6.900 272 2HB ASP 55 2HB ASP 55 1.754 7.633 -8.320 273 H ILE 56 H ILE 56 0.705 8.444 -4.675 274 HA ILE 56 HA ILE 56 -1.897 9.815 -4.508 275 HB ILE 56 HB ILE 56 -2.701 8.884 -2.736 276 1HG1 ILE 56 1HG1 ILE 56 -0.063 9.338 -1.415 277 2HG1 ILE 56 2HG1 ILE 56 -1.627 10.110 -1.159 278 1HG2 ILE 56 1HG2 ILE 56 -1.986 6.622 -2.060 279 2HG2 ILE 56 2HG2 ILE 56 -1.969 6.795 -3.802 280 3HG2 ILE 56 3HG2 ILE 56 -0.442 6.887 -2.892 281 1HD1 ILE 56 1HD1 ILE 56 -2.437 7.922 -0.176 282 2HD1 ILE 56 2HD1 ILE 56 -0.743 7.362 -0.272 283 3HD1 ILE 56 3HD1 ILE 56 -1.150 8.744 0.731 284 H ASP 57 H ASP 57 -1.637 11.740 -2.912 285 HA ASP 57 HA ASP 57 1.170 12.238 -2.281 286 1HB ASP 57 1HB ASP 57 0.851 14.616 -2.755 287 2HB ASP 57 2HB ASP 57 0.635 13.624 -4.218 288 H VAL 58 H VAL 58 1.597 13.347 -0.483 289 HA VAL 58 HA VAL 58 -0.514 13.904 1.558 290 HB VAL 58 HB VAL 58 0.681 12.661 3.232 291 1HG1 VAL 58 1HG1 VAL 58 -1.263 11.773 1.928 292 2HG1 VAL 58 2HG1 VAL 58 -0.118 10.853 0.926 293 3HG1 VAL 58 3HG1 VAL 58 -0.247 10.528 2.662 294 1HG2 VAL 58 1HG2 VAL 58 2.228 10.792 2.542 295 2HG2 VAL 58 2HG2 VAL 58 2.362 11.530 0.939 296 3HG2 VAL 58 3HG2 VAL 58 2.938 12.395 2.381 297 H ARG 59 H ARG 59 0.051 16.058 2.255 298 HA ARG 59 HA ARG 59 2.656 17.040 1.343 299 1HB ARG 59 1HB ARG 59 0.528 18.251 1.135 300 2HB ARG 59 2HB ARG 59 0.495 18.433 2.909 301 1HG ARG 59 1HG ARG 59 2.454 19.825 2.915 302 2HG ARG 59 2HG ARG 59 2.857 19.367 1.269 303 1HD ARG 59 1HD ARG 59 1.839 21.235 0.617 304 2HD ARG 59 2HD ARG 59 0.331 20.365 0.909 305 HE ARG 59 HE ARG 59 1.381 22.691 2.291 306 1HH1 ARG 59 1HH1 ARG 59 -0.893 20.002 3.145 307 2HH1 ARG 59 2HH1 ARG 59 -0.879 20.513 4.788 308 1HH2 ARG 59 1HH2 ARG 59 1.284 23.246 4.288 309 2HH2 ARG 59 2HH2 ARG 59 0.987 22.045 5.532 310 H ILE 60 H ILE 60 3.411 15.220 2.876 311 HA ILE 60 HA ILE 60 4.383 14.462 4.701 312 HB ILE 60 HB ILE 60 4.628 17.255 5.880 313 1HG1 ILE 60 1HG1 ILE 60 6.090 15.996 3.557 314 2HG1 ILE 60 2HG1 ILE 60 5.568 17.657 3.796 315 1HG2 ILE 60 1HG2 ILE 60 5.086 15.251 7.297 316 2HG2 ILE 60 2HG2 ILE 60 6.303 14.720 6.119 317 3HG2 ILE 60 3HG2 ILE 60 6.510 16.244 7.014 318 1HD1 ILE 60 1HD1 ILE 60 7.893 16.294 5.224 319 2HD1 ILE 60 2HD1 ILE 60 8.009 17.477 3.941 320 3HD1 ILE 60 3HD1 ILE 60 7.331 17.966 5.513 321 H GLY 61 H GLY 61 3.236 13.347 6.189 322 1HA GLY 61 1HA GLY 61 1.843 12.901 7.878 323 2HA GLY 61 2HA GLY 61 1.725 14.625 8.216 324 H GLU 62 H GLU 62 0.414 15.561 6.072 325 HA GLU 62 HA GLU 62 -2.209 15.573 6.277 326 1HB GLU 62 1HB GLU 62 -0.446 16.398 4.426 327 2HB GLU 62 2HB GLU 62 -1.178 15.089 3.502 328 1HG GLU 62 1HG GLU 62 -3.364 16.211 3.670 329 2HG GLU 62 2HG GLU 62 -2.663 17.452 4.738 330 H THR 63 H THR 63 -3.466 13.783 6.967 331 HA THR 63 HA THR 63 -3.019 11.155 5.936 332 HB THR 63 HB THR 63 -5.228 10.818 7.317 333 HG1 THR 63 HG1 THR 63 -5.686 13.104 7.234 334 1HG2 THR 63 1HG2 THR 63 -2.804 11.910 8.795 335 2HG2 THR 63 2HG2 THR 63 -4.008 10.692 9.325 336 3HG2 THR 63 3HG2 THR 63 -2.872 10.302 8.046 337 H VAL 64 H VAL 64 -3.915 10.182 4.277 338 HA VAL 64 HA VAL 64 -6.430 11.224 3.039 339 HB VAL 64 HB VAL 64 -4.673 11.816 1.576 340 1HG1 VAL 64 1HG1 VAL 64 -2.855 10.342 2.483 341 2HG1 VAL 64 2HG1 VAL 64 -3.622 8.949 1.706 342 3HG1 VAL 64 3HG1 VAL 64 -2.982 10.287 0.724 343 1HG2 VAL 64 1HG2 VAL 64 -6.641 10.682 0.481 344 2HG2 VAL 64 2HG2 VAL 64 -5.132 10.603 -0.445 345 3HG2 VAL 64 3HG2 VAL 64 -5.678 9.178 0.445 346 H GLN 65 H GLN 65 -7.782 9.678 2.227 347 HA GLN 65 HA GLN 65 -7.428 6.775 2.961 348 1HB GLN 65 1HB GLN 65 -9.497 7.839 3.768 349 2HB GLN 65 2HB GLN 65 -9.934 8.322 2.133 350 1HG GLN 65 1HG GLN 65 -9.303 5.400 2.747 351 2HG GLN 65 2HG GLN 65 -10.824 6.088 3.297 352 1HE2 GLN 65 1HE2 GLN 65 -9.859 7.441 0.171 353 2HE2 GLN 65 2HE2 GLN 65 -10.999 6.445 -0.705 354 H ILE 66 H ILE 66 -6.616 5.592 1.471 355 HA ILE 66 HA ILE 66 -7.704 6.031 -1.258 356 HB ILE 66 HB ILE 66 -5.806 4.905 -2.238 357 1HG1 ILE 66 1HG1 ILE 66 -3.633 5.005 -0.726 358 2HG1 ILE 66 2HG1 ILE 66 -4.778 4.780 0.585 359 1HG2 ILE 66 1HG2 ILE 66 -4.850 7.295 -0.644 360 2HG2 ILE 66 2HG2 ILE 66 -4.314 6.758 -2.248 361 3HG2 ILE 66 3HG2 ILE 66 -5.945 7.408 -2.041 362 1HD1 ILE 66 1HD1 ILE 66 -4.158 2.991 -1.822 363 2HD1 ILE 66 2HD1 ILE 66 -4.070 2.567 -0.093 364 3HD1 ILE 66 3HD1 ILE 66 -5.623 2.704 -0.907 365 H MET 67 H MET 67 -9.070 4.529 -1.689 366 HA MET 67 HA MET 67 -9.396 2.121 -0.068 367 1HB MET 67 1HB MET 67 -11.243 3.402 -1.345 368 2HB MET 67 2HB MET 67 -10.642 2.565 -2.787 369 1HG MET 67 1HG MET 67 -10.983 0.375 -1.495 370 2HG MET 67 2HG MET 67 -11.679 1.346 -0.195 371 1HE MET 67 1HE MET 67 -12.109 -0.101 -3.772 372 2HE MET 67 2HE MET 67 -13.689 0.556 -4.256 373 3HE MET 67 3HE MET 67 -12.275 1.633 -4.158 374 H TYR 68 H TYR 68 -8.706 0.010 -0.554 375 HA TYR 68 HA TYR 68 -7.191 -0.418 -3.116 376 1HB TYR 68 1HB TYR 68 -6.560 -1.240 -0.324 377 2HB TYR 68 2HB TYR 68 -6.535 -2.550 -1.484 378 HD1 TYR 68 HD1 TYR 68 -4.532 0.008 -0.093 379 HD2 TYR 68 HD2 TYR 68 -5.271 -2.138 -3.758 380 HE1 TYR 68 HE1 TYR 68 -2.216 0.465 -0.829 381 HE2 TYR 68 HE2 TYR 68 -2.978 -1.613 -4.526 382 HH TYR 68 HH TYR 68 -0.628 0.132 -2.473 383 H ARG 69 H ARG 69 -7.520 -2.576 -4.012 384 HA ARG 69 HA ARG 69 -10.164 -3.779 -3.457 385 1HB ARG 69 1HB ARG 69 -10.393 -1.989 -5.197 386 2HB ARG 69 2HB ARG 69 -9.147 -2.820 -6.148 387 1HG ARG 69 1HG ARG 69 -10.669 -4.864 -6.212 388 2HG ARG 69 2HG ARG 69 -11.909 -3.888 -5.427 389 1HD ARG 69 1HD ARG 69 -10.674 -3.617 -8.179 390 2HD ARG 69 2HD ARG 69 -12.360 -3.882 -7.792 391 HE ARG 69 HE ARG 69 -10.902 -1.363 -7.919 392 1HH1 ARG 69 1HH1 ARG 69 -13.727 -2.899 -6.333 393 2HH1 ARG 69 2HH1 ARG 69 -14.459 -1.475 -5.925 394 1HH2 ARG 69 1HH2 ARG 69 -12.033 0.629 -7.530 395 2HH2 ARG 69 2HH2 ARG 69 -13.627 0.582 -6.833 396 H ALA 70 H ALA 70 -10.151 -5.941 -3.775 397 HA ALA 70 HA ALA 70 -8.427 -7.222 -5.704 398 1HB ALA 70 1HB ALA 70 -7.527 -8.861 -4.227 399 2HB ALA 70 2HB ALA 70 -6.905 -7.254 -3.796 400 3HB ALA 70 3HB ALA 70 -8.165 -8.020 -2.791 401 H LYS 71 H LYS 71 -10.235 -7.881 -6.724 402 HA LYS 71 HA LYS 71 -12.345 -9.389 -5.217 403 1HB LYS 71 1HB LYS 71 -12.400 -8.507 -8.108 404 2HB LYS 71 2HB LYS 71 -13.720 -9.199 -7.150 405 1HG LYS 71 1HG LYS 71 -13.262 -7.134 -5.550 406 2HG LYS 71 2HG LYS 71 -12.514 -6.400 -6.954 407 1HD LYS 71 1HD LYS 71 -15.343 -7.570 -6.990 408 2HD LYS 71 2HD LYS 71 -15.023 -5.939 -6.416 409 1HE LYS 71 1HE LYS 71 -15.812 -6.147 -8.841 410 2HE LYS 71 2HE LYS 71 -14.394 -5.133 -8.523 411 1HZ LYS 71 1HZ LYS 71 -14.188 -7.912 -9.500 412 2HZ LYS 71 2HZ LYS 71 -13.873 -6.546 -10.409 413 3HZ LYS 71 3HZ LYS 71 -12.992 -6.810 -9.157 414 H ASN 72 H ASN 72 -12.312 -11.642 -5.308 415 HA ASN 72 HA ASN 72 -9.973 -12.759 -6.614 416 1HB ASN 72 1HB ASN 72 -10.600 -13.451 -4.377 417 2HB ASN 72 2HB ASN 72 -12.140 -14.097 -4.966 418 1HD2 ASN 72 1HD2 ASN 72 -10.971 -16.055 -3.735 419 2HD2 ASN 72 2HD2 ASN 72 -9.907 -17.058 -4.710 420 H LEU 73 H LEU 73 -9.808 -13.644 -8.657 421 HA LEU 73 HA LEU 73 -12.319 -14.590 -10.010 422 1HB LEU 73 1HB LEU 73 -9.788 -13.289 -11.072 423 2HB LEU 73 2HB LEU 73 -10.857 -14.244 -12.094 424 HG LEU 73 HG LEU 73 -12.766 -12.778 -11.595 425 1HD1 LEU 73 1HD1 LEU 73 -10.649 -11.107 -10.184 426 2HD1 LEU 73 2HD1 LEU 73 -12.196 -10.448 -10.757 427 3HD1 LEU 73 3HD1 LEU 73 -12.195 -11.693 -9.514 428 1HD2 LEU 73 1HD2 LEU 73 -11.377 -12.538 -13.626 429 2HD2 LEU 73 2HD2 LEU 73 -11.974 -10.966 -13.072 430 3HD2 LEU 73 3HD2 LEU 73 -10.289 -11.432 -12.759 431 H ALA 74 H ALA 74 -10.516 -16.120 -8.098 432 HA ALA 74 HA ALA 74 -9.155 -18.088 -9.753 433 1HB ALA 74 1HB ALA 74 -8.345 -17.499 -7.513 434 2HB ALA 74 2HB ALA 74 -9.877 -18.020 -6.817 435 3HB ALA 74 3HB ALA 74 -8.781 -19.208 -7.559 436 H SER 75 H SER 75 -9.591 -20.456 -9.328 437 HA SER 75 HA SER 75 -12.340 -21.285 -9.802 438 1HB SER 75 1HB SER 75 -10.907 -23.536 -9.588 439 2HB SER 75 2HB SER 75 -10.758 -22.509 -11.019 440 HG SER 75 HG SER 75 -8.675 -22.651 -10.413 441 H THR 76 H THR 76 -9.920 -21.212 -7.212 442 HA THR 76 HA THR 76 -11.762 -22.445 -5.192 443 HB THR 76 HB THR 76 -9.484 -23.243 -4.279 444 HG1 THR 76 HG1 THR 76 -8.181 -21.624 -5.035 445 1HG2 THR 76 1HG2 THR 76 -9.714 -23.995 -7.219 446 2HG2 THR 76 2HG2 THR 76 -8.922 -24.902 -5.922 447 3HG2 THR 76 3HG2 THR 76 -10.689 -24.720 -5.918 448 HA PRO 77 HA PRO 77 -10.602 -18.969 -2.687 449 1HB PRO 77 1HB PRO 77 -9.092 -20.078 -0.522 450 2HB PRO 77 2HB PRO 77 -10.856 -19.915 -0.548 451 1HG PRO 77 1HG PRO 77 -9.203 -22.314 -1.388 452 2HG PRO 77 2HG PRO 77 -10.643 -22.290 -0.322 453 1HD PRO 77 1HD PRO 77 -10.999 -22.969 -2.870 454 2HD PRO 77 2HD PRO 77 -12.076 -21.771 -2.153 455 H THR 78 H THR 78 -8.621 -17.761 -2.080 456 HA THR 78 HA THR 78 -6.063 -19.118 -2.559 457 HB THR 78 HB THR 78 -5.798 -16.262 -3.197 458 HG1 THR 78 HG1 THR 78 -6.472 -16.365 -5.256 459 1HG2 THR 78 1HG2 THR 78 -4.073 -18.069 -3.462 460 2HG2 THR 78 2HG2 THR 78 -5.026 -18.709 -4.816 461 3HG2 THR 78 3HG2 THR 78 -4.317 -17.078 -4.891 462 H THR 79 H THR 79 -4.316 -17.659 -1.602 463 HA THR 79 HA THR 79 -5.289 -15.910 0.553 464 HB THR 79 HB THR 79 -3.964 -17.673 1.584 465 HG1 THR 79 HG1 THR 79 -3.884 -15.430 2.252 466 1HG2 THR 79 1HG2 THR 79 -1.556 -17.869 1.129 467 2HG2 THR 79 2HG2 THR 79 -2.487 -18.300 -0.316 468 3HG2 THR 79 3HG2 THR 79 -1.681 -16.719 -0.213 469 H GLY 80 H GLY 80 -3.914 -13.993 0.652 470 1HA GLY 80 1HA GLY 80 -2.508 -13.195 -1.762 471 2HA GLY 80 2HA GLY 80 -4.023 -12.332 -1.477 472 H GLN 81 H GLN 81 -1.211 -13.496 0.326 473 HA GLN 81 HA GLN 81 -1.286 -11.152 2.131 474 1HB GLN 81 1HB GLN 81 0.161 -12.316 3.570 475 2HB GLN 81 2HB GLN 81 -1.131 -13.395 3.071 476 1HG GLN 81 1HG GLN 81 0.730 -14.771 3.050 477 2HG GLN 81 2HG GLN 81 0.541 -14.370 1.342 478 1HE2 GLN 81 1HE2 GLN 81 2.681 -14.222 0.517 479 2HE2 GLN 81 2HE2 GLN 81 3.879 -13.184 1.276 480 H ALA 82 H ALA 82 0.742 -12.697 -0.325 481 HA ALA 82 HA ALA 82 2.268 -11.884 -1.764 482 1HB ALA 82 1HB ALA 82 1.924 -9.534 -2.504 483 2HB ALA 82 2HB ALA 82 0.407 -10.444 -2.323 484 3HB ALA 82 3HB ALA 82 0.865 -9.261 -1.109 485 H THR 83 H THR 83 4.031 -9.965 -2.097 486 HA THR 83 HA THR 83 5.394 -9.470 0.505 487 HB THR 83 HB THR 83 6.782 -10.258 -2.007 488 HG1 THR 83 HG1 THR 83 7.243 -12.184 -0.834 489 1HG2 THR 83 1HG2 THR 83 7.783 -9.753 0.838 490 2HG2 THR 83 2HG2 THR 83 8.779 -10.417 -0.471 491 3HG2 THR 83 3HG2 THR 83 8.161 -8.767 -0.583 492 H PHE 84 H PHE 84 6.466 -7.443 0.574 493 HA PHE 84 HA PHE 84 6.239 -5.725 -1.792 494 1HB PHE 84 1HB PHE 84 5.377 -3.889 -0.383 495 2HB PHE 84 2HB PHE 84 4.234 -5.211 -0.486 496 HD1 PHE 84 HD1 PHE 84 3.903 -6.772 1.490 497 HD2 PHE 84 HD2 PHE 84 6.480 -3.336 1.732 498 HE1 PHE 84 HE1 PHE 84 3.722 -6.823 3.945 499 HE2 PHE 84 HE2 PHE 84 6.328 -3.403 4.213 500 HZ PHE 84 HZ PHE 84 4.936 -5.138 5.323 501 H ASN 85 H ASN 85 7.546 -3.866 -1.648 502 HA ASN 85 HA ASN 85 9.624 -3.766 0.501 503 1HB ASN 85 1HB ASN 85 11.020 -4.319 -1.218 504 2HB ASN 85 2HB ASN 85 9.990 -3.671 -2.477 505 1HD2 ASN 85 1HD2 ASN 85 10.000 -1.375 -2.903 506 2HD2 ASN 85 2HD2 ASN 85 11.268 -0.317 -2.288 507 H VAL 86 H VAL 86 9.002 -2.133 1.725 508 HA VAL 86 HA VAL 86 7.262 -0.006 0.637 509 HB VAL 86 HB VAL 86 6.497 -1.242 2.465 510 1HG1 VAL 86 1HG1 VAL 86 8.541 -1.819 3.703 511 2HG1 VAL 86 2HG1 VAL 86 8.713 -0.132 4.223 512 3HG1 VAL 86 3HG1 VAL 86 7.317 -1.077 4.741 513 1HG2 VAL 86 1HG2 VAL 86 6.895 1.563 3.476 514 2HG2 VAL 86 2HG2 VAL 86 5.838 1.146 2.110 515 3HG2 VAL 86 3HG2 VAL 86 5.539 0.445 3.705 516 H THR 87 H THR 87 9.349 0.795 -0.569 517 HA THR 87 HA THR 87 10.253 3.131 0.642 518 HB THR 87 HB THR 87 11.429 1.712 2.203 519 HG1 THR 87 HG1 THR 87 13.612 2.461 1.756 520 1HG2 THR 87 1HG2 THR 87 11.723 -0.261 0.868 521 2HG2 THR 87 2HG2 THR 87 12.905 0.567 -0.173 522 3HG2 THR 87 3HG2 THR 87 13.278 0.258 1.537 523 HA PRO 88 HA PRO 88 11.919 3.428 -3.553 524 1HB PRO 88 1HB PRO 88 13.545 5.649 -3.281 525 2HB PRO 88 2HB PRO 88 11.779 5.769 -3.446 526 1HG PRO 88 1HG PRO 88 13.391 6.002 -0.916 527 2HG PRO 88 2HG PRO 88 11.953 6.903 -1.431 528 1HD PRO 88 1HD PRO 88 11.858 4.787 0.318 529 2HD PRO 88 2HD PRO 88 10.527 5.245 -0.744 530 H MET 89 H MET 89 13.674 3.492 -0.488 531 HA MET 89 HA MET 89 15.470 1.513 -0.868 532 1HB MET 89 1HB MET 89 17.664 2.727 -1.199 533 2HB MET 89 2HB MET 89 16.671 2.522 -2.619 534 1HG MET 89 1HG MET 89 15.841 5.010 -2.032 535 2HG MET 89 2HG MET 89 17.351 5.034 -1.117 536 1HE MET 89 1HE MET 89 15.727 4.853 -4.658 537 2HE MET 89 2HE MET 89 17.158 4.725 -5.705 538 3HE MET 89 3HE MET 89 16.669 3.342 -4.711 539 H ALA 90 H ALA 90 15.992 4.886 0.205 540 HA ALA 90 HA ALA 90 17.343 3.994 2.547 541 1HB ALA 90 1HB ALA 90 17.938 6.025 1.252 542 2HB ALA 90 2HB ALA 90 16.388 6.760 1.730 543 3HB ALA 90 3HB ALA 90 17.621 6.405 2.958 544 H ALA 91 H ALA 91 14.009 5.057 2.016 545 HA ALA 91 HA ALA 91 13.741 5.881 4.822 546 1HB ALA 91 1HB ALA 91 11.761 6.049 2.534 547 2HB ALA 91 2HB ALA 91 11.526 6.661 4.195 548 3HB ALA 91 3HB ALA 91 12.816 7.323 3.168 549 H GLY 92 H GLY 92 10.894 4.535 3.467 550 1HA GLY 92 1HA GLY 92 9.449 2.996 4.284 551 2HA GLY 92 2HA GLY 92 10.823 1.955 4.638 552 H ALA 93 H ALA 93 12.090 3.182 6.754 553 HA ALA 93 HA ALA 93 10.641 2.623 9.021 554 1HB ALA 93 1HB ALA 93 13.067 3.015 8.985 555 2HB ALA 93 2HB ALA 93 12.806 4.750 8.705 556 3HB ALA 93 3HB ALA 93 12.293 4.010 10.236 557 H TYR 94 H TYR 94 10.951 5.865 7.556 558 HA TYR 94 HA TYR 94 9.240 7.162 9.471 559 1HB TYR 94 1HB TYR 94 10.045 8.177 6.731 560 2HB TYR 94 2HB TYR 94 9.604 9.129 8.148 561 HD1 TYR 94 HD1 TYR 94 12.345 7.850 6.274 562 HD2 TYR 94 HD2 TYR 94 11.089 8.525 10.342 563 HE1 TYR 94 HE1 TYR 94 14.628 7.325 7.078 564 HE2 TYR 94 HE2 TYR 94 13.397 8.104 11.122 565 HH TYR 94 HH TYR 94 16.001 7.056 8.911 566 H PHE 95 H PHE 95 8.313 4.983 7.111 567 HA PHE 95 HA PHE 95 6.146 6.362 5.896 568 1HB PHE 95 1HB PHE 95 7.045 4.171 4.985 569 2HB PHE 95 2HB PHE 95 6.564 3.405 6.497 570 HD1 PHE 95 HD1 PHE 95 4.340 5.856 4.708 571 HD2 PHE 95 HD2 PHE 95 5.154 1.709 5.643 572 HE1 PHE 95 HE1 PHE 95 2.004 5.306 4.399 573 HE2 PHE 95 HE2 PHE 95 2.902 1.112 4.781 574 HZ PHE 95 HZ PHE 95 1.315 2.942 4.108 575 H ASN 96 H ASN 96 4.041 6.753 6.673 576 HA ASN 96 HA ASN 96 3.417 5.436 9.227 577 1HB ASN 96 1HB ASN 96 2.809 8.238 8.273 578 2HB ASN 96 2HB ASN 96 1.817 7.401 9.470 579 1HD2 ASN 96 1HD2 ASN 96 5.444 7.949 8.962 580 2HD2 ASN 96 2HD2 ASN 96 5.572 8.565 10.610 581 H LYS 97 H LYS 97 1.733 4.171 9.252 582 HA LYS 97 HA LYS 97 -0.688 5.018 7.922 583 1HB LYS 97 1HB LYS 97 -1.359 2.888 6.966 584 2HB LYS 97 2HB LYS 97 0.011 3.633 6.167 585 1HG LYS 97 1HG LYS 97 0.476 1.414 6.091 586 2HG LYS 97 2HG LYS 97 1.528 1.967 7.391 587 1HD LYS 97 1HD LYS 97 0.266 0.776 9.011 588 2HD LYS 97 2HD LYS 97 -1.226 0.843 8.052 589 1HE LYS 97 1HE LYS 97 -0.363 -0.856 6.521 590 2HE LYS 97 2HE LYS 97 1.214 -0.848 7.335 591 1HZ LYS 97 1HZ LYS 97 -1.335 -1.644 8.625 592 2HZ LYS 97 2HZ LYS 97 -0.246 -2.707 8.072 593 3HZ LYS 97 3HZ LYS 97 0.139 -1.688 9.306 594 H VAL 98 H VAL 98 0.894 2.644 9.991 595 HA VAL 98 HA VAL 98 0.245 1.371 11.641 596 HB VAL 98 HB VAL 98 0.611 3.200 12.966 597 1HG1 VAL 98 1HG1 VAL 98 -0.742 4.987 11.985 598 2HG1 VAL 98 2HG1 VAL 98 -2.222 4.244 12.646 599 3HG1 VAL 98 3HG1 VAL 98 -0.968 4.850 13.726 600 1HG2 VAL 98 1HG2 VAL 98 -0.741 2.719 14.909 601 2HG2 VAL 98 2HG2 VAL 98 -2.010 1.987 13.914 602 3HG2 VAL 98 3HG2 VAL 98 -0.412 1.217 14.030 603 H GLN 99 H GLN 99 -2.891 3.050 11.321 604 HA GLN 99 HA GLN 99 -4.989 2.126 11.558 605 1HB GLN 99 1HB GLN 99 -4.400 2.736 9.248 606 2HB GLN 99 2HB GLN 99 -3.944 1.074 8.894 607 1HG GLN 99 1HG GLN 99 -6.369 0.422 9.446 608 2HG GLN 99 2HG GLN 99 -6.711 2.139 9.662 609 1HE2 GLN 99 1HE2 GLN 99 -8.205 0.795 7.843 610 2HE2 GLN 99 2HE2 GLN 99 -7.728 1.123 6.196 611 H CYS 100 H CYS 100 -4.405 -0.674 9.667 612 HA CYS 100 HA CYS 100 -4.572 -2.500 12.029 613 1HB CYS 100 1HB CYS 100 -6.560 -2.697 10.526 614 2HB CYS 100 2HB CYS 100 -5.469 -2.893 9.133 615 HG CYS 100 HG CYS 100 -6.239 -5.219 9.547 616 H PHE 101 H PHE 101 -2.904 -4.067 12.037 617 HA PHE 101 HA PHE 101 -0.438 -3.724 10.738 618 1HB PHE 101 1HB PHE 101 -0.557 -5.227 12.580 619 2HB PHE 101 2HB PHE 101 -1.842 -6.174 11.844 620 HD1 PHE 101 HD1 PHE 101 1.764 -5.212 11.327 621 HD2 PHE 101 HD2 PHE 101 -1.339 -8.129 10.598 622 HE1 PHE 101 HE1 PHE 101 3.399 -6.684 10.182 623 HE2 PHE 101 HE2 PHE 101 0.300 -9.581 9.454 624 HZ PHE 101 HZ PHE 101 2.669 -8.863 9.235 625 H CYS 102 H CYS 102 -3.041 -5.994 9.851 626 HA CYS 102 HA CYS 102 -1.919 -6.812 7.347 627 1HB CYS 102 1HB CYS 102 -3.449 -8.301 8.448 628 2HB CYS 102 2HB CYS 102 -4.693 -7.036 8.565 629 HG CYS 102 HG CYS 102 -3.451 -8.406 5.808 630 H PHE 103 H PHE 103 -2.016 -5.875 5.458 631 HA PHE 103 HA PHE 103 -3.297 -3.290 4.937 632 1HB PHE 103 1HB PHE 103 -2.230 -3.819 2.614 633 2HB PHE 103 2HB PHE 103 -1.192 -3.443 3.975 634 HD1 PHE 103 HD1 PHE 103 -2.457 -6.285 1.870 635 HD2 PHE 103 HD2 PHE 103 0.367 -5.041 4.902 636 HE1 PHE 103 HE1 PHE 103 -1.692 -8.614 2.123 637 HE2 PHE 103 HE2 PHE 103 1.152 -7.381 5.110 638 HZ PHE 103 HZ PHE 103 0.104 -9.174 3.746 639 H THR 104 H THR 104 -5.295 -4.776 5.657 640 HA THR 104 HA THR 104 -7.283 -5.601 5.180 641 HB THR 104 HB THR 104 -8.316 -4.759 2.931 642 HG1 THR 104 HG1 THR 104 -6.382 -4.157 1.874 643 1HG2 THR 104 1HG2 THR 104 -8.781 -3.772 5.133 644 2HG2 THR 104 2HG2 THR 104 -7.192 -2.973 5.147 645 3HG2 THR 104 3HG2 THR 104 -8.420 -2.457 3.993 646 H GLU 105 H GLU 105 -5.780 -6.208 1.952 647 HA GLU 105 HA GLU 105 -7.104 -8.598 1.465 648 1HB GLU 105 1HB GLU 105 -4.270 -7.827 0.636 649 2HB GLU 105 2HB GLU 105 -5.221 -9.141 -0.058 650 1HG GLU 105 1HG GLU 105 -5.600 -7.437 -1.585 651 2HG GLU 105 2HG GLU 105 -7.027 -7.302 -0.558 652 H THR 106 H THR 106 -6.728 -10.775 1.767 653 HA THR 106 HA THR 106 -4.534 -11.853 3.367 654 HB THR 106 HB THR 106 -5.683 -10.813 5.144 655 HG1 THR 106 HG1 THR 106 -6.117 -13.610 5.108 656 1HG2 THR 106 1HG2 THR 106 -8.005 -10.686 4.180 657 2HG2 THR 106 2HG2 THR 106 -8.215 -12.406 4.601 658 3HG2 THR 106 3HG2 THR 106 -7.887 -11.219 5.858 659 H THR 107 H THR 107 -7.883 -12.751 2.687 660 HA THR 107 HA THR 107 -7.105 -15.178 1.251 661 HB THR 107 HB THR 107 -7.691 -14.969 4.170 662 HG1 THR 107 HG1 THR 107 -6.137 -16.656 4.168 663 1HG2 THR 107 1HG2 THR 107 -9.540 -16.474 3.365 664 2HG2 THR 107 2HG2 THR 107 -8.363 -17.416 2.421 665 3HG2 THR 107 3HG2 THR 107 -8.310 -17.434 4.196 666 H LEU 108 H LEU 108 -8.840 -15.863 -0.006 667 HA LEU 108 HA LEU 108 -11.554 -14.888 0.574 668 1HB LEU 108 1HB LEU 108 -10.118 -14.264 -2.045 669 2HB LEU 108 2HB LEU 108 -11.824 -13.967 -1.728 670 HG LEU 108 HG LEU 108 -9.566 -12.562 -0.252 671 1HD1 LEU 108 1HD1 LEU 108 -9.876 -10.707 -1.719 672 2HD1 LEU 108 2HD1 LEU 108 -9.653 -12.114 -2.742 673 3HD1 LEU 108 3HD1 LEU 108 -11.282 -11.463 -2.516 674 1HD2 LEU 108 1HD2 LEU 108 -11.860 -12.683 0.899 675 2HD2 LEU 108 2HD2 LEU 108 -11.295 -11.058 0.527 676 3HD2 LEU 108 3HD2 LEU 108 -12.521 -11.822 -0.500 677 H GLU 109 H GLU 109 -13.076 -16.166 -0.380 678 HA GLU 109 HA GLU 109 -12.376 -18.695 -1.650 679 1HB GLU 109 1HB GLU 109 -14.580 -17.614 -0.219 680 2HB GLU 109 2HB GLU 109 -15.164 -18.103 -1.799 681 1HG GLU 109 1HG GLU 109 -15.386 -19.843 -0.061 682 2HG GLU 109 2HG GLU 109 -14.349 -20.420 -1.357 683 HA PRO 110 HA PRO 110 -12.496 -17.499 -5.862 684 1HB PRO 110 1HB PRO 110 -13.958 -19.348 -7.226 685 2HB PRO 110 2HB PRO 110 -12.482 -19.729 -6.347 686 1HG PRO 110 1HG PRO 110 -15.331 -20.099 -5.428 687 2HG PRO 110 2HG PRO 110 -13.994 -21.273 -5.315 688 1HD PRO 110 1HD PRO 110 -14.791 -19.546 -3.281 689 2HD PRO 110 2HD PRO 110 -13.132 -20.192 -3.400 690 H GLY 111 H GLY 111 -13.570 -15.444 -5.517 691 1HA GLY 111 1HA GLY 111 -15.255 -14.653 -7.451 692 2HA GLY 111 2HA GLY 111 -16.426 -15.242 -6.265 693 H GLU 112 H GLU 112 -14.659 -14.469 -3.968 694 HA GLU 112 HA GLU 112 -16.515 -12.482 -3.592 695 1HB GLU 112 1HB GLU 112 -14.416 -12.706 -1.516 696 2HB GLU 112 2HB GLU 112 -16.172 -12.709 -1.373 697 1HG GLU 112 1HG GLU 112 -15.971 -15.143 -2.288 698 2HG GLU 112 2HG GLU 112 -14.233 -14.891 -2.124 699 H GLU 113 H GLU 113 -16.491 -10.328 -3.190 700 HA GLU 113 HA GLU 113 -14.398 -8.787 -4.448 701 1HB GLU 113 1HB GLU 113 -17.110 -7.950 -3.360 702 2HB GLU 113 2HB GLU 113 -16.105 -7.084 -4.525 703 1HG GLU 113 1HG GLU 113 -17.442 -8.074 -5.981 704 2HG GLU 113 2HG GLU 113 -16.329 -9.450 -5.776 705 H MET 114 H MET 114 -12.638 -8.660 -2.900 706 HA MET 114 HA MET 114 -13.187 -7.483 -0.276 707 1HB MET 114 1HB MET 114 -11.470 -9.362 -1.084 708 2HB MET 114 2HB MET 114 -10.417 -7.979 -1.376 709 1HG MET 114 1HG MET 114 -11.815 -8.705 1.233 710 2HG MET 114 2HG MET 114 -10.116 -8.981 0.835 711 1HE MET 114 1HE MET 114 -11.243 -7.620 3.511 712 2HE MET 114 2HE MET 114 -9.570 -8.084 3.136 713 3HE MET 114 3HE MET 114 -9.925 -6.443 3.723 714 H GLU 115 H GLU 115 -13.390 -5.293 -0.237 715 HA GLU 115 HA GLU 115 -11.199 -3.755 -1.285 716 1HB GLU 115 1HB GLU 115 -12.685 -2.036 -2.435 717 2HB GLU 115 2HB GLU 115 -12.369 -3.557 -3.264 718 1HG GLU 115 1HG GLU 115 -14.638 -4.397 -2.520 719 2HG GLU 115 2HG GLU 115 -14.975 -2.740 -1.975 720 H MET 116 H MET 116 -10.710 -2.030 -0.027 721 HA MET 116 HA MET 116 -12.533 -1.181 2.099 722 1HB MET 116 1HB MET 116 -10.161 -3.038 2.573 723 2HB MET 116 2HB MET 116 -10.793 -1.990 3.846 724 1HG MET 116 1HG MET 116 -13.078 -3.061 3.412 725 2HG MET 116 2HG MET 116 -12.196 -4.295 2.494 726 1HE MET 116 1HE MET 116 -13.197 -6.162 5.760 727 2HE MET 116 2HE MET 116 -14.147 -4.908 4.925 728 3HE MET 116 3HE MET 116 -13.278 -6.143 3.980 729 HA PRO 117 HA PRO 117 -9.816 2.325 1.956 730 1HB PRO 117 1HB PRO 117 -10.175 3.522 4.340 731 2HB PRO 117 2HB PRO 117 -11.478 3.395 3.117 732 1HG PRO 117 1HG PRO 117 -11.026 1.585 5.500 733 2HG PRO 117 2HG PRO 117 -12.512 2.427 4.960 734 1HD PRO 117 1HD PRO 117 -12.027 -0.180 4.318 735 2HD PRO 117 2HD PRO 117 -12.844 0.925 3.177 736 H VAL 118 H VAL 118 -7.759 2.802 2.305 737 HA VAL 118 HA VAL 118 -6.298 1.755 4.658 738 HB VAL 118 HB VAL 118 -5.338 1.822 1.777 739 1HG1 VAL 118 1HG1 VAL 118 -3.803 1.249 4.352 740 2HG1 VAL 118 2HG1 VAL 118 -3.194 0.936 2.711 741 3HG1 VAL 118 3HG1 VAL 118 -3.516 2.595 3.225 742 1HG2 VAL 118 1HG2 VAL 118 -5.732 -0.453 3.776 743 2HG2 VAL 118 2HG2 VAL 118 -6.662 -0.181 2.289 744 3HG2 VAL 118 3HG2 VAL 118 -4.954 -0.625 2.194 745 H VAL 119 H VAL 119 -5.137 3.395 5.680 746 HA VAL 119 HA VAL 119 -5.100 6.034 4.292 747 HB VAL 119 HB VAL 119 -4.971 7.136 6.393 748 1HG1 VAL 119 1HG1 VAL 119 -7.200 6.654 5.445 749 2HG1 VAL 119 2HG1 VAL 119 -7.287 5.156 6.399 750 3HG1 VAL 119 3HG1 VAL 119 -7.230 6.728 7.216 751 1HG2 VAL 119 1HG2 VAL 119 -5.243 6.009 8.526 752 2HG2 VAL 119 2HG2 VAL 119 -5.266 4.423 7.748 753 3HG2 VAL 119 3HG2 VAL 119 -3.780 5.400 7.740 754 H PHE 120 H PHE 120 -3.213 7.393 4.607 755 HA PHE 120 HA PHE 120 -0.674 5.984 5.112 756 1HB PHE 120 1HB PHE 120 -1.511 5.293 2.827 757 2HB PHE 120 2HB PHE 120 -1.618 6.987 2.372 758 HD1 PHE 120 HD1 PHE 120 0.677 8.375 2.515 759 HD2 PHE 120 HD2 PHE 120 0.347 4.093 2.066 760 HE1 PHE 120 HE1 PHE 120 3.070 8.247 1.955 761 HE2 PHE 120 HE2 PHE 120 2.674 4.023 1.230 762 HZ PHE 120 HZ PHE 120 4.060 6.080 1.257 763 H PHE 121 H PHE 121 0.895 7.491 5.768 764 HA PHE 121 HA PHE 121 1.036 10.071 4.491 765 1HB PHE 121 1HB PHE 121 1.129 11.220 6.668 766 2HB PHE 121 2HB PHE 121 -0.471 10.690 6.186 767 HD1 PHE 121 HD1 PHE 121 1.745 10.886 8.951 768 HD2 PHE 121 HD2 PHE 121 -1.366 8.433 7.225 769 HE1 PHE 121 HE1 PHE 121 1.201 9.974 11.174 770 HE2 PHE 121 HE2 PHE 121 -1.757 7.387 9.406 771 HZ PHE 121 HZ PHE 121 -0.459 8.133 11.386 772 H VAL 122 H VAL 122 3.081 11.203 5.340 773 HA VAL 122 HA VAL 122 5.055 9.279 6.524 774 HB VAL 122 HB VAL 122 5.421 9.560 4.072 775 1HG1 VAL 122 1HG1 VAL 122 6.174 12.442 4.737 776 2HG1 VAL 122 2HG1 VAL 122 6.340 11.625 3.181 777 3HG1 VAL 122 3HG1 VAL 122 4.725 11.942 3.838 778 1HG2 VAL 122 1HG2 VAL 122 7.663 10.705 5.793 779 2HG2 VAL 122 2HG2 VAL 122 7.288 8.983 5.610 780 3HG2 VAL 122 3HG2 VAL 122 7.829 9.930 4.215 781 H ASP 123 H ASP 123 6.481 10.160 8.072 782 HA ASP 123 HA ASP 123 5.613 12.659 9.307 783 1HB ASP 123 1HB ASP 123 7.773 10.633 9.991 784 2HB ASP 123 2HB ASP 123 7.727 12.220 10.759 785 HA PRO 124 HA PRO 124 8.700 15.296 7.282 786 1HB PRO 124 1HB PRO 124 9.313 16.595 9.874 787 2HB PRO 124 2HB PRO 124 8.645 17.317 8.394 788 1HG PRO 124 1HG PRO 124 7.187 16.849 10.719 789 2HG PRO 124 2HG PRO 124 6.429 16.913 9.111 790 1HD PRO 124 1HD PRO 124 7.070 14.508 10.759 791 2HD PRO 124 2HD PRO 124 5.799 14.788 9.534 792 H GLU 125 H GLU 125 9.389 13.328 10.122 793 HA GLU 125 HA GLU 125 11.970 13.528 10.675 794 1HB GLU 125 1HB GLU 125 10.009 11.945 11.414 795 2HB GLU 125 2HB GLU 125 10.664 10.852 10.193 796 1HG GLU 125 1HG GLU 125 11.803 10.194 12.052 797 2HG GLU 125 2HG GLU 125 12.920 11.475 11.534 798 H ILE 126 H ILE 126 10.675 12.125 7.605 799 HA ILE 126 HA ILE 126 13.037 10.873 6.791 800 HB ILE 126 HB ILE 126 10.841 10.655 5.763 801 1HG1 ILE 126 1HG1 ILE 126 13.033 11.437 3.775 802 2HG1 ILE 126 2HG1 ILE 126 13.017 9.933 4.714 803 1HG2 ILE 126 1HG2 ILE 126 9.973 12.178 4.134 804 2HG2 ILE 126 2HG2 ILE 126 10.307 13.151 5.575 805 3HG2 ILE 126 3HG2 ILE 126 11.424 13.185 4.185 806 1HD1 ILE 126 1HD1 ILE 126 12.073 9.356 2.688 807 2HD1 ILE 126 2HD1 ILE 126 10.706 9.501 3.815 808 3HD1 ILE 126 3HD1 ILE 126 11.028 10.792 2.621 809 H VAL 127 H VAL 127 12.209 14.379 6.617 810 HA VAL 127 HA VAL 127 14.792 14.910 5.223 811 HB VAL 127 HB VAL 127 14.078 17.260 5.238 812 1HG1 VAL 127 1HG1 VAL 127 13.715 15.797 3.287 813 2HG1 VAL 127 2HG1 VAL 127 12.109 15.365 3.904 814 3HG1 VAL 127 3HG1 VAL 127 12.461 17.036 3.431 815 1HG2 VAL 127 1HG2 VAL 127 11.296 16.306 6.006 816 2HG2 VAL 127 2HG2 VAL 127 12.387 17.122 7.154 817 3HG2 VAL 127 3HG2 VAL 127 11.843 17.954 5.691 818 H LYS 128 H LYS 128 15.402 13.653 7.407 819 HA LYS 128 HA LYS 128 16.665 15.776 9.027 820 1HB LYS 128 1HB LYS 128 15.149 13.518 10.379 821 2HB LYS 128 2HB LYS 128 16.292 14.625 11.145 822 1HG LYS 128 1HG LYS 128 14.804 16.533 10.386 823 2HG LYS 128 2HG LYS 128 13.672 15.313 9.765 824 1HD LYS 128 1HD LYS 128 13.633 14.278 12.071 825 2HD LYS 128 2HD LYS 128 14.582 15.648 12.663 826 1HE LYS 128 1HE LYS 128 12.788 17.219 12.065 827 2HE LYS 128 2HE LYS 128 11.885 15.933 11.244 828 1HZ LYS 128 1HZ LYS 128 10.974 16.307 13.411 829 2HZ LYS 128 2HZ LYS 128 11.639 14.810 13.320 830 3HZ LYS 128 3HZ LYS 128 12.423 15.984 14.138 831 HA PRO 129 HA PRO 129 19.661 12.243 9.414 832 1HB PRO 129 1HB PRO 129 19.198 9.666 8.655 833 2HB PRO 129 2HB PRO 129 18.655 10.323 10.222 834 1HG PRO 129 1HG PRO 129 17.073 10.025 7.669 835 2HG PRO 129 2HG PRO 129 16.598 9.543 9.318 836 1HD PRO 129 1HD PRO 129 15.768 11.871 8.229 837 2HD PRO 129 2HD PRO 129 16.153 11.698 9.974 838 H VAL 130 H VAL 130 21.371 11.607 7.959 839 HA VAL 130 HA VAL 130 21.181 12.994 5.495 840 HB VAL 130 HB VAL 130 23.142 13.037 6.881 841 1HG1 VAL 130 1HG1 VAL 130 23.547 10.086 6.220 842 2HG1 VAL 130 2HG1 VAL 130 24.751 11.159 6.950 843 3HG1 VAL 130 3HG1 VAL 130 23.268 10.795 7.829 844 1HG2 VAL 130 1HG2 VAL 130 23.278 13.424 4.453 845 2HG2 VAL 130 2HG2 VAL 130 24.791 12.792 5.138 846 3HG2 VAL 130 3HG2 VAL 130 23.718 11.715 4.216 847 H GLU 131 H GLU 131 21.120 9.609 6.446 848 HA GLU 131 HA GLU 131 21.405 8.154 4.130 849 1HB GLU 131 1HB GLU 131 19.322 7.683 6.280 850 2HB GLU 131 2HB GLU 131 19.982 6.514 5.123 851 1HG GLU 131 1HG GLU 131 21.447 6.066 6.767 852 2HG GLU 131 2HG GLU 131 22.331 7.455 6.177 853 H THR 132 H THR 132 18.347 9.776 5.152 854 HA THR 132 HA THR 132 17.231 9.102 2.517 855 HB THR 132 HB THR 132 15.199 10.324 3.630 856 HG1 THR 132 HG1 THR 132 15.633 11.087 5.556 857 1HG2 THR 132 1HG2 THR 132 14.631 8.305 4.971 858 2HG2 THR 132 2HG2 THR 132 15.270 7.886 3.378 859 3HG2 THR 132 3HG2 THR 132 16.303 7.733 4.820 860 H GLN 133 H GLN 133 17.495 11.987 4.604 861 HA GLN 133 HA GLN 133 17.176 14.126 4.217 862 1HB GLN 133 1HB GLN 133 19.687 13.380 3.951 863 2HB GLN 133 2HB GLN 133 19.501 13.875 2.289 864 1HG GLN 133 1HG GLN 133 20.332 15.769 3.400 865 2HG GLN 133 2HG GLN 133 18.605 16.097 3.161 866 1HE2 GLN 133 1HE2 GLN 133 18.873 13.820 5.731 867 2HE2 GLN 133 2HE2 GLN 133 18.938 14.969 7.035 868 H GLY 134 H GLY 134 17.976 13.077 0.909 869 1HA GLY 134 1HA GLY 134 16.324 15.265 -0.260 870 2HA GLY 134 2HA GLY 134 17.509 14.252 -1.098 871 H ILE 135 H ILE 135 16.373 11.785 0.336 872 HA ILE 135 HA ILE 135 14.558 10.911 -1.654 873 HB ILE 135 HB ILE 135 15.150 9.950 1.145 874 1HG1 ILE 135 1HG1 ILE 135 16.893 9.692 -0.674 875 2HG1 ILE 135 2HG1 ILE 135 16.301 8.189 0.038 876 1HG2 ILE 135 1HG2 ILE 135 13.890 7.872 0.541 877 2HG2 ILE 135 2HG2 ILE 135 12.853 9.281 0.752 878 3HG2 ILE 135 3HG2 ILE 135 13.227 8.738 -0.874 879 1HD1 ILE 135 1HD1 ILE 135 16.577 8.018 -2.392 880 2HD1 ILE 135 2HD1 ILE 135 14.939 7.663 -1.836 881 3HD1 ILE 135 3HD1 ILE 135 15.290 9.216 -2.629 882 H LYS 136 H LYS 136 12.494 11.371 -2.008 883 HA LYS 136 HA LYS 136 10.649 11.610 0.215 884 1HB LYS 136 1HB LYS 136 9.705 13.738 -0.455 885 2HB LYS 136 2HB LYS 136 11.293 13.807 0.300 886 1HG LYS 136 1HG LYS 136 12.373 14.083 -1.903 887 2HG LYS 136 2HG LYS 136 10.788 13.987 -2.701 888 1HD LYS 136 1HD LYS 136 9.971 15.829 -1.220 889 2HD LYS 136 2HD LYS 136 11.589 15.958 -0.520 890 1HE LYS 136 1HE LYS 136 12.514 16.620 -2.737 891 2HE LYS 136 2HE LYS 136 10.917 16.400 -3.482 892 1HZ LYS 136 1HZ LYS 136 11.312 18.734 -2.994 893 2HZ LYS 136 2HZ LYS 136 10.101 18.206 -2.002 894 3HZ LYS 136 3HZ LYS 136 11.529 18.422 -1.390 895 H THR 137 H THR 137 10.634 9.509 -1.331 896 HA THR 137 HA THR 137 8.009 9.782 -2.463 897 HB THR 137 HB THR 137 10.042 8.347 -4.239 898 HG1 THR 137 HG1 THR 137 10.090 10.187 -5.551 899 1HG2 THR 137 1HG2 THR 137 8.317 8.601 -5.923 900 2HG2 THR 137 2HG2 THR 137 7.640 7.857 -4.457 901 3HG2 THR 137 3HG2 THR 137 7.341 9.578 -4.801 902 H LEU 138 H LEU 138 7.514 8.654 -0.620 903 HA LEU 138 HA LEU 138 8.693 6.048 -0.052 904 1HB LEU 138 1HB LEU 138 6.777 7.902 1.149 905 2HB LEU 138 2HB LEU 138 6.214 6.226 1.251 906 HG LEU 138 HG LEU 138 8.377 5.608 2.192 907 1HD1 LEU 138 1HD1 LEU 138 9.670 7.389 3.342 908 2HD1 LEU 138 2HD1 LEU 138 9.824 7.436 1.577 909 3HD1 LEU 138 3HD1 LEU 138 8.773 8.609 2.411 910 1HD2 LEU 138 1HD2 LEU 138 6.379 5.862 3.596 911 2HD2 LEU 138 2HD2 LEU 138 7.801 6.445 4.472 912 3HD2 LEU 138 3HD2 LEU 138 6.656 7.590 3.757 913 H THR 139 H THR 139 8.609 5.046 -1.988 914 HA THR 139 HA THR 139 5.993 4.371 -3.106 915 HB THR 139 HB THR 139 7.777 4.824 -4.642 916 HG1 THR 139 HG1 THR 139 6.172 3.210 -5.159 917 1HG2 THR 139 1HG2 THR 139 9.693 4.051 -3.366 918 2HG2 THR 139 2HG2 THR 139 9.134 2.360 -3.518 919 3HG2 THR 139 3HG2 THR 139 9.631 3.262 -4.961 920 H LEU 140 H LEU 140 5.022 2.398 -2.888 921 HA LEU 140 HA LEU 140 6.396 0.387 -1.181 922 1HB LEU 140 1HB LEU 140 4.378 1.495 -0.132 923 2HB LEU 140 2HB LEU 140 3.375 0.874 -1.445 924 HG LEU 140 HG LEU 140 5.013 -0.915 0.418 925 1HD1 LEU 140 1HD1 LEU 140 2.094 -0.071 0.656 926 2HD1 LEU 140 2HD1 LEU 140 2.924 -1.265 1.679 927 3HD1 LEU 140 3HD1 LEU 140 3.410 0.436 1.735 928 1HD2 LEU 140 1HD2 LEU 140 2.666 -1.452 -1.457 929 2HD2 LEU 140 2HD2 LEU 140 4.312 -2.104 -1.603 930 3HD2 LEU 140 3HD2 LEU 140 3.282 -2.613 -0.265 931 H SER 141 H SER 141 7.240 -0.914 -2.742 932 HA SER 141 HA SER 141 5.767 -1.451 -5.250 933 1HB SER 141 1HB SER 141 7.857 -2.727 -5.748 934 2HB SER 141 2HB SER 141 8.090 -0.987 -5.527 935 HG SER 141 HG SER 141 8.335 -2.891 -3.447 936 H TYR 142 H TYR 142 4.139 -2.828 -4.954 937 HA TYR 142 HA TYR 142 4.401 -5.061 -3.013 938 1HB TYR 142 1HB TYR 142 2.443 -3.176 -3.207 939 2HB TYR 142 2HB TYR 142 1.763 -4.383 -4.282 940 HD1 TYR 142 HD1 TYR 142 2.738 -6.915 -2.754 941 HD2 TYR 142 HD2 TYR 142 0.816 -3.278 -1.455 942 HE1 TYR 142 HE1 TYR 142 2.516 -7.834 -0.482 943 HE2 TYR 142 HE2 TYR 142 0.353 -4.331 0.738 944 HH TYR 142 HH TYR 142 0.649 -6.325 2.064 945 H THR 143 H THR 143 4.601 -7.110 -3.846 946 HA THR 143 HA THR 143 3.911 -7.582 -6.711 947 HB THR 143 HB THR 143 5.912 -9.173 -5.089 948 HG1 THR 143 HG1 THR 143 7.475 -7.790 -5.984 949 1HG2 THR 143 1HG2 THR 143 6.786 -9.669 -7.350 950 2HG2 THR 143 2HG2 THR 143 5.055 -10.065 -7.294 951 3HG2 THR 143 3HG2 THR 143 5.601 -8.571 -8.079 952 H PHE 144 H PHE 144 1.790 -8.093 -6.375 953 HA PHE 144 HA PHE 144 0.863 -10.158 -4.524 954 1HB PHE 144 1HB PHE 144 -0.277 -8.389 -6.675 955 2HB PHE 144 2HB PHE 144 -1.083 -9.894 -6.363 956 HD1 PHE 144 HD1 PHE 144 -3.111 -9.170 -5.406 957 HD2 PHE 144 HD2 PHE 144 0.600 -7.584 -3.892 958 HE1 PHE 144 HE1 PHE 144 -4.281 -8.351 -3.383 959 HE2 PHE 144 HE2 PHE 144 -0.596 -6.761 -1.872 960 HZ PHE 144 HZ PHE 144 -3.021 -7.157 -1.611 961 H TYR 145 H TYR 145 2.351 -11.846 -4.932 962 HA TYR 145 HA TYR 145 1.260 -13.697 -6.923 963 1HB TYR 145 1HB TYR 145 3.282 -14.190 -8.058 964 2HB TYR 145 2HB TYR 145 2.906 -12.484 -8.228 965 HD1 TYR 145 HD1 TYR 145 4.336 -12.479 -5.020 966 HD2 TYR 145 HD2 TYR 145 5.396 -13.226 -9.144 967 HE1 TYR 145 HE1 TYR 145 6.674 -11.964 -4.514 968 HE2 TYR 145 HE2 TYR 145 7.757 -12.735 -8.608 969 HH TYR 145 HH TYR 145 9.266 -12.151 -6.961 970 HA PRO 146 HA PRO 146 2.974 -15.766 -3.118 971 1HB PRO 146 1HB PRO 146 0.759 -16.454 -1.688 972 2HB PRO 146 2HB PRO 146 1.543 -14.854 -1.616 973 1HG PRO 146 1HG PRO 146 -0.968 -15.594 -3.113 974 2HG PRO 146 2HG PRO 146 -0.559 -14.116 -2.227 975 1HD PRO 146 1HD PRO 146 -0.327 -14.500 -5.001 976 2HD PRO 146 2HD PRO 146 0.489 -13.197 -4.070 977 H ARG 147 H ARG 147 -0.281 -17.213 -3.883 978 HA ARG 147 HA ARG 147 1.034 -19.506 -5.199 979 1HB ARG 147 1HB ARG 147 -0.738 -19.817 -2.735 980 2HB ARG 147 2HB ARG 147 -0.041 -21.113 -3.718 981 1HG ARG 147 1HG ARG 147 2.253 -20.250 -3.077 982 2HG ARG 147 2HG ARG 147 1.455 -19.134 -1.952 983 1HD ARG 147 1HD ARG 147 0.331 -21.082 -0.855 984 2HD ARG 147 2HD ARG 147 1.280 -22.187 -1.844 985 HE ARG 147 HE ARG 147 2.081 -20.723 0.520 986 1HH1 ARG 147 1HH1 ARG 147 3.364 -21.979 -2.504 987 2HH1 ARG 147 2HH1 ARG 147 4.999 -22.156 -1.945 988 1HH2 ARG 147 1HH2 ARG 147 4.241 -20.916 1.316 989 2HH2 ARG 147 2HH2 ARG 147 5.501 -21.522 0.295 990 H GLU 148 H GLU 148 -0.261 -20.277 -6.807 991 HA GLU 148 HA GLU 148 -3.179 -19.742 -6.790 992 1HB GLU 148 1HB GLU 148 -2.072 -18.118 -8.279 993 2HB GLU 148 2HB GLU 148 -1.202 -19.444 -9.074 994 1HG GLU 148 1HG GLU 148 -3.717 -20.293 -9.563 995 2HG GLU 148 2HG GLU 148 -4.073 -18.576 -9.323 996 HA PRO 149 HA PRO 149 -2.646 -24.162 -7.889 997 1HB PRO 149 1HB PRO 149 -5.280 -24.889 -8.127 998 2HB PRO 149 2HB PRO 149 -4.439 -24.674 -6.570 999 1HG PRO 149 1HG PRO 149 -6.382 -22.795 -7.882 1000 2HG PRO 149 2HG PRO 149 -6.124 -23.154 -6.160 1001 1HD PRO 149 1HD PRO 149 -5.086 -20.921 -7.524 1002 2HD PRO 149 2HD PRO 149 -4.480 -21.560 -5.969 1003 H SER 150 H SER 150 -5.345 -22.484 -9.576 1004 HA SER 150 HA SER 150 -4.122 -22.185 -12.082 1005 1HB SER 150 1HB SER 150 -4.192 -24.667 -12.253 1006 2HB SER 150 2HB SER 150 -5.938 -24.635 -11.929 1007 HG SER 150 HG SER 150 -5.381 -24.731 -14.179 1008 H LYS 151 H LYS 151 -5.170 -20.185 -12.016 1009 HA LYS 151 HA LYS 151 -7.987 -20.004 -11.355 1010 1HB LYS 151 1HB LYS 151 -7.720 -17.634 -11.625 1011 2HB LYS 151 2HB LYS 151 -6.349 -18.313 -10.754 1012 1HG LYS 151 1HG LYS 151 -5.035 -17.159 -12.182 1013 2HG LYS 151 2HG LYS 151 -5.383 -18.413 -13.328 1014 1HD LYS 151 1HD LYS 151 -7.601 -16.743 -13.688 1015 2HD LYS 151 2HD LYS 151 -6.383 -15.593 -13.138 1016 1HE LYS 151 1HE LYS 151 -6.210 -15.636 -15.522 1017 2HE LYS 151 2HE LYS 151 -4.821 -16.573 -14.938 1018 1HZ LYS 151 1HZ LYS 151 -6.245 -18.583 -15.313 1019 2HZ LYS 151 2HZ LYS 151 -7.394 -17.631 -15.925 1020 3HZ LYS 151 3HZ LYS 151 -5.942 -17.747 -16.714 Start of MODEL 7 1 H VAL 21 H VAL 21 -1.103 11.169 13.770 2 HA VAL 21 HA VAL 21 -2.730 9.169 15.155 3 HB VAL 21 HB VAL 21 -2.841 11.154 16.623 4 1HG1 VAL 21 1HG1 VAL 21 -3.759 12.703 14.165 5 2HG1 VAL 21 2HG1 VAL 21 -3.831 13.275 15.843 6 3HG1 VAL 21 3HG1 VAL 21 -2.265 12.955 15.099 7 1HG2 VAL 21 1HG2 VAL 21 -5.452 11.007 15.103 8 2HG2 VAL 21 2HG2 VAL 21 -4.878 9.741 16.222 9 3HG2 VAL 21 3HG2 VAL 21 -5.171 11.388 16.802 10 H GLU 22 H GLU 22 -4.964 9.342 13.909 11 HA GLU 22 HA GLU 22 -4.231 9.224 11.116 12 1HB GLU 22 1HB GLU 22 -5.805 7.709 12.592 13 2HB GLU 22 2HB GLU 22 -7.072 8.817 12.061 14 1HG GLU 22 1HG GLU 22 -6.707 8.200 9.761 15 2HG GLU 22 2HG GLU 22 -5.127 7.477 10.114 16 H GLN 23 H GLN 23 -3.652 11.617 11.505 17 HA GLN 23 HA GLN 23 -5.243 12.830 9.586 18 1HB GLN 23 1HB GLN 23 -5.816 13.780 12.145 19 2HB GLN 23 2HB GLN 23 -4.651 14.982 11.578 20 1HG GLN 23 1HG GLN 23 -7.004 14.012 9.931 21 2HG GLN 23 2HG GLN 23 -7.096 15.383 11.039 22 1HE2 GLN 23 1HE2 GLN 23 -4.607 14.359 8.477 23 2HE2 GLN 23 2HE2 GLN 23 -4.593 15.955 7.758 24 H ALA 24 H ALA 24 -2.866 13.904 11.893 25 HA ALA 24 HA ALA 24 -0.985 12.304 10.933 26 1HB ALA 24 1HB ALA 24 0.569 13.266 9.689 27 2HB ALA 24 2HB ALA 24 -0.677 14.480 9.282 28 3HB ALA 24 3HB ALA 24 0.542 14.820 10.516 29 H SER 25 H SER 25 -0.618 15.618 12.074 30 HA SER 25 HA SER 25 -1.811 15.273 14.384 31 1HB SER 25 1HB SER 25 0.109 14.000 15.286 32 2HB SER 25 2HB SER 25 1.196 15.345 14.894 33 HG SER 25 HG SER 25 -0.662 15.010 16.950 34 H ASP 26 H ASP 26 0.034 17.349 15.661 35 HA ASP 26 HA ASP 26 -0.779 19.765 14.244 36 1HB ASP 26 1HB ASP 26 -0.451 19.802 16.643 37 2HB ASP 26 2HB ASP 26 1.181 19.131 16.496 38 H LEU 27 H LEU 27 1.975 17.559 14.152 39 HA LEU 27 HA LEU 27 3.896 19.333 13.060 40 1HB LEU 27 1HB LEU 27 3.743 16.288 12.960 41 2HB LEU 27 2HB LEU 27 5.151 17.256 12.551 42 HG LEU 27 HG LEU 27 5.634 16.447 14.608 43 1HD1 LEU 27 1HD1 LEU 27 5.908 18.353 16.048 44 2HD1 LEU 27 2HD1 LEU 27 6.081 18.882 14.364 45 3HD1 LEU 27 3HD1 LEU 27 4.579 19.222 15.261 46 1HD2 LEU 27 1HD2 LEU 27 3.409 15.661 15.310 47 2HD2 LEU 27 2HD2 LEU 27 4.325 16.442 16.603 48 3HD2 LEU 27 3HD2 LEU 27 2.998 17.316 15.837 49 H ILE 28 H ILE 28 1.144 18.699 11.379 50 HA ILE 28 HA ILE 28 2.116 17.720 8.880 51 HB ILE 28 HB ILE 28 -0.248 19.509 9.554 52 1HG1 ILE 28 1HG1 ILE 28 -0.185 16.600 8.658 53 2HG1 ILE 28 2HG1 ILE 28 -0.108 17.080 10.348 54 1HG2 ILE 28 1HG2 ILE 28 0.381 19.849 7.159 55 2HG2 ILE 28 2HG2 ILE 28 0.465 18.081 6.957 56 3HG2 ILE 28 3HG2 ILE 28 -1.084 18.876 7.280 57 1HD1 ILE 28 1HD1 ILE 28 -2.290 18.256 10.137 58 2HD1 ILE 28 2HD1 ILE 28 -2.437 17.632 8.479 59 3HD1 ILE 28 3HD1 ILE 28 -2.387 16.511 9.841 60 H LEU 29 H LEU 29 3.504 18.688 7.421 61 HA LEU 29 HA LEU 29 3.917 21.664 7.618 62 1HB LEU 29 1HB LEU 29 5.758 19.581 6.380 63 2HB LEU 29 2HB LEU 29 5.979 21.323 6.353 64 HG LEU 29 HG LEU 29 7.393 20.884 8.007 65 1HD1 LEU 29 1HD1 LEU 29 4.897 20.915 9.741 66 2HD1 LEU 29 2HD1 LEU 29 6.543 21.357 10.207 67 3HD1 LEU 29 3HD1 LEU 29 5.673 22.353 9.031 68 1HD2 LEU 29 1HD2 LEU 29 7.328 18.555 8.000 69 2HD2 LEU 29 2HD2 LEU 29 7.080 19.022 9.695 70 3HD2 LEU 29 3HD2 LEU 29 5.701 18.493 8.699 71 H ASP 30 H ASP 30 4.091 22.878 5.740 72 HA ASP 30 HA ASP 30 2.191 22.324 3.755 73 1HB ASP 30 1HB ASP 30 4.360 24.401 4.148 74 2HB ASP 30 2HB ASP 30 3.584 24.292 2.574 75 H GLU 31 H GLU 31 5.583 21.484 3.883 76 HA GLU 31 HA GLU 31 6.278 21.443 1.233 77 1HB GLU 31 1HB GLU 31 7.202 20.025 3.686 78 2HB GLU 31 2HB GLU 31 7.683 19.275 2.153 79 1HG GLU 31 1HG GLU 31 8.129 22.233 2.677 80 2HG GLU 31 2HG GLU 31 9.298 20.981 3.126 81 H LYS 32 H LYS 32 5.476 20.594 -0.446 82 HA LYS 32 HA LYS 32 3.408 18.590 -0.393 83 1HB LYS 32 1HB LYS 32 3.612 20.840 -1.613 84 2HB LYS 32 2HB LYS 32 4.704 20.072 -2.749 85 1HG LYS 32 1HG LYS 32 1.837 19.259 -2.099 86 2HG LYS 32 2HG LYS 32 2.298 20.316 -3.434 87 1HD LYS 32 1HD LYS 32 3.069 17.378 -3.144 88 2HD LYS 32 2HD LYS 32 1.814 18.056 -4.192 89 1HE LYS 32 1HE LYS 32 3.539 19.345 -5.449 90 2HE LYS 32 2HE LYS 32 4.810 18.606 -4.455 91 1HZ LYS 32 1HZ LYS 32 4.009 16.437 -5.228 92 2HZ LYS 32 2HZ LYS 32 2.931 17.102 -6.165 93 3HZ LYS 32 3HZ LYS 32 4.544 17.376 -6.502 94 H ILE 33 H ILE 33 4.155 16.541 -0.098 95 HA ILE 33 HA ILE 33 6.662 15.566 -1.415 96 HB ILE 33 HB ILE 33 6.883 15.712 0.874 97 1HG1 ILE 33 1HG1 ILE 33 6.288 12.772 0.471 98 2HG1 ILE 33 2HG1 ILE 33 7.455 13.564 -0.600 99 1HG2 ILE 33 1HG2 ILE 33 4.599 15.790 1.708 100 2HG2 ILE 33 2HG2 ILE 33 4.303 14.129 1.173 101 3HG2 ILE 33 3HG2 ILE 33 5.451 14.447 2.476 102 1HD1 ILE 33 1HD1 ILE 33 7.670 13.591 2.404 103 2HD1 ILE 33 2HD1 ILE 33 8.633 12.629 1.243 104 3HD1 ILE 33 3HD1 ILE 33 8.728 14.411 1.222 105 H LYS 34 H LYS 34 6.581 13.731 -2.702 106 HA LYS 34 HA LYS 34 3.947 12.944 -3.528 107 1HB LYS 34 1HB LYS 34 5.546 14.030 -5.045 108 2HB LYS 34 2HB LYS 34 6.794 12.861 -4.612 109 1HG LYS 34 1HG LYS 34 5.866 12.560 -6.851 110 2HG LYS 34 2HG LYS 34 5.724 11.124 -5.808 111 1HD LYS 34 1HD LYS 34 3.546 11.117 -5.910 112 2HD LYS 34 2HD LYS 34 3.337 12.750 -5.477 113 1HE LYS 34 1HE LYS 34 2.266 12.372 -7.586 114 2HE LYS 34 2HE LYS 34 3.590 13.516 -7.816 115 1HZ LYS 34 1HZ LYS 34 4.749 11.925 -9.034 116 2HZ LYS 34 2HZ LYS 34 4.020 10.651 -8.262 117 3HZ LYS 34 3HZ LYS 34 3.171 11.477 -9.347 118 H VAL 35 H VAL 35 3.456 10.721 -4.074 119 HA VAL 35 HA VAL 35 5.109 8.685 -2.707 120 HB VAL 35 HB VAL 35 2.137 9.115 -2.800 121 1HG1 VAL 35 1HG1 VAL 35 3.770 6.865 -1.482 122 2HG1 VAL 35 2HG1 VAL 35 2.091 7.180 -1.083 123 3HG1 VAL 35 3HG1 VAL 35 2.510 6.664 -2.720 124 1HG2 VAL 35 1HG2 VAL 35 4.035 9.143 -0.423 125 2HG2 VAL 35 2HG2 VAL 35 3.262 10.584 -1.128 126 3HG2 VAL 35 3HG2 VAL 35 2.263 9.349 -0.362 127 H THR 36 H THR 36 4.822 6.577 -3.622 128 HA THR 36 HA THR 36 3.271 6.267 -6.127 129 HB THR 36 HB THR 36 6.280 5.802 -5.906 130 HG1 THR 36 HG1 THR 36 4.756 7.855 -6.727 131 1HG2 THR 36 1HG2 THR 36 4.387 5.193 -8.212 132 2HG2 THR 36 2HG2 THR 36 6.166 5.159 -8.277 133 3HG2 THR 36 3HG2 THR 36 5.303 4.005 -7.247 134 H PHE 37 H PHE 37 1.889 4.877 -5.452 135 HA PHE 37 HA PHE 37 2.535 2.678 -3.681 136 1HB PHE 37 1HB PHE 37 0.032 3.350 -5.298 137 2HB PHE 37 2HB PHE 37 0.181 2.107 -4.078 138 HD1 PHE 37 HD1 PHE 37 0.340 2.729 -1.648 139 HD2 PHE 37 HD2 PHE 37 -0.060 5.714 -4.734 140 HE1 PHE 37 HE1 PHE 37 -0.076 4.469 0.081 141 HE2 PHE 37 HE2 PHE 37 -0.188 7.448 -2.998 142 HZ PHE 37 HZ PHE 37 -0.360 6.858 -0.625 143 H ASP 38 H ASP 38 4.103 1.359 -4.983 144 HA ASP 38 HA ASP 38 3.471 0.903 -7.816 145 1HB ASP 38 1HB ASP 38 5.723 1.302 -7.434 146 2HB ASP 38 2HB ASP 38 5.788 0.236 -6.041 147 H ALA 39 H ALA 39 1.393 -0.106 -7.425 148 HA ALA 39 HA ALA 39 1.342 -2.766 -6.265 149 1HB ALA 39 1HB ALA 39 -0.985 -2.788 -6.973 150 2HB ALA 39 2HB ALA 39 -0.576 -1.219 -6.244 151 3HB ALA 39 3HB ALA 39 -0.709 -1.367 -8.010 152 H ASN 40 H ASN 40 1.661 -4.708 -7.224 153 HA ASN 40 HA ASN 40 1.486 -5.068 -10.162 154 1HB ASN 40 1HB ASN 40 3.746 -6.213 -8.453 155 2HB ASN 40 2HB ASN 40 3.565 -6.276 -10.204 156 1HD2 ASN 40 1HD2 ASN 40 4.231 -4.127 -7.406 157 2HD2 ASN 40 2HD2 ASN 40 4.870 -2.804 -8.391 158 H VAL 41 H VAL 41 0.923 -7.241 -10.749 159 HA VAL 41 HA VAL 41 0.358 -9.198 -8.617 160 HB VAL 41 HB VAL 41 -1.583 -8.558 -10.885 161 1HG1 VAL 41 1HG1 VAL 41 -3.163 -9.972 -9.642 162 2HG1 VAL 41 2HG1 VAL 41 -1.756 -10.858 -10.225 163 3HG1 VAL 41 3HG1 VAL 41 -1.868 -10.405 -8.516 164 1HG2 VAL 41 1HG2 VAL 41 -3.132 -7.626 -9.318 165 2HG2 VAL 41 2HG2 VAL 41 -1.982 -7.807 -7.980 166 3HG2 VAL 41 3HG2 VAL 41 -1.656 -6.663 -9.300 167 H ALA 42 H ALA 42 0.595 -11.359 -9.294 168 HA ALA 42 HA ALA 42 1.159 -11.888 -12.131 169 1HB ALA 42 1HB ALA 42 3.133 -12.599 -9.920 170 2HB ALA 42 2HB ALA 42 3.291 -13.005 -11.640 171 3HB ALA 42 3HB ALA 42 3.383 -11.311 -11.121 172 H ALA 43 H ALA 43 1.585 -14.355 -12.321 173 HA ALA 43 HA ALA 43 -0.539 -15.911 -11.398 174 1HB ALA 43 1HB ALA 43 0.873 -17.833 -12.028 175 2HB ALA 43 2HB ALA 43 0.891 -16.574 -13.284 176 3HB ALA 43 3HB ALA 43 2.279 -16.760 -12.181 177 H GLY 44 H GLY 44 -0.970 -16.652 -9.417 178 1HA GLY 44 1HA GLY 44 0.160 -17.631 -7.274 179 2HA GLY 44 2HA GLY 44 0.999 -16.071 -7.259 180 H LEU 45 H LEU 45 -1.007 -14.389 -8.347 181 HA LEU 45 HA LEU 45 -3.288 -14.690 -6.468 182 1HB LEU 45 1HB LEU 45 -1.222 -12.706 -6.359 183 2HB LEU 45 2HB LEU 45 -2.734 -11.909 -6.730 184 HG LEU 45 HG LEU 45 -2.710 -14.006 -4.504 185 1HD1 LEU 45 1HD1 LEU 45 -2.069 -12.447 -2.886 186 2HD1 LEU 45 2HD1 LEU 45 -0.987 -11.957 -4.207 187 3HD1 LEU 45 3HD1 LEU 45 -2.471 -11.071 -3.874 188 1HD2 LEU 45 1HD2 LEU 45 -4.581 -12.737 -3.811 189 2HD2 LEU 45 2HD2 LEU 45 -4.342 -11.535 -5.120 190 3HD2 LEU 45 3HD2 LEU 45 -4.802 -13.207 -5.519 191 HA PRO 46 HA PRO 46 -5.003 -13.957 -10.619 192 1HB PRO 46 1HB PRO 46 -7.064 -15.701 -10.523 193 2HB PRO 46 2HB PRO 46 -5.376 -16.293 -10.527 194 1HG PRO 46 1HG PRO 46 -7.169 -15.942 -8.125 195 2HG PRO 46 2HG PRO 46 -6.180 -17.369 -8.576 196 1HD PRO 46 1HD PRO 46 -5.334 -15.412 -6.831 197 2HD PRO 46 2HD PRO 46 -4.219 -16.374 -7.850 198 H TRP 47 H TRP 47 -5.289 -11.992 -8.579 199 HA TRP 47 HA TRP 47 -8.228 -11.586 -8.303 200 1HB TRP 47 1HB TRP 47 -6.002 -10.792 -6.433 201 2HB TRP 47 2HB TRP 47 -7.680 -10.300 -6.287 202 HD1 TRP 47 HD1 TRP 47 -7.876 -13.818 -7.243 203 HE1 TRP 47 HE1 TRP 47 -8.166 -15.348 -5.252 204 HE3 TRP 47 HE3 TRP 47 -6.509 -10.620 -3.462 205 HZ2 TRP 47 HZ2 TRP 47 -7.884 -15.298 -2.468 206 HZ3 TRP 47 HZ3 TRP 47 -5.982 -11.712 -1.293 207 HH2 TRP 47 HH2 TRP 47 -6.862 -13.875 -0.682 208 H GLU 48 H GLU 48 -9.049 -9.632 -8.894 209 HA GLU 48 HA GLU 48 -7.353 -7.976 -10.648 210 1HB GLU 48 1HB GLU 48 -9.696 -8.664 -11.153 211 2HB GLU 48 2HB GLU 48 -10.263 -7.711 -9.773 212 1HG GLU 48 1HG GLU 48 -9.511 -5.648 -10.868 213 2HG GLU 48 2HG GLU 48 -8.856 -6.568 -12.230 214 H PHE 49 H PHE 49 -5.877 -7.422 -8.895 215 HA PHE 49 HA PHE 49 -6.801 -5.699 -6.709 216 1HB PHE 49 1HB PHE 49 -5.089 -7.401 -6.377 217 2HB PHE 49 2HB PHE 49 -4.050 -6.591 -7.541 218 HD1 PHE 49 HD1 PHE 49 -2.164 -5.801 -6.412 219 HD2 PHE 49 HD2 PHE 49 -6.045 -5.279 -4.586 220 HE1 PHE 49 HE1 PHE 49 -1.097 -4.881 -4.389 221 HE2 PHE 49 HE2 PHE 49 -4.949 -4.469 -2.525 222 HZ PHE 49 HZ PHE 49 -2.479 -4.262 -2.419 223 H VAL 50 H VAL 50 -7.605 -3.830 -7.733 224 HA VAL 50 HA VAL 50 -5.862 -2.460 -9.652 225 HB VAL 50 HB VAL 50 -7.612 -0.973 -10.102 226 1HG1 VAL 50 1HG1 VAL 50 -9.360 -2.469 -10.823 227 2HG1 VAL 50 2HG1 VAL 50 -7.826 -3.356 -10.938 228 3HG1 VAL 50 3HG1 VAL 50 -8.944 -3.660 -9.583 229 1HG2 VAL 50 1HG2 VAL 50 -8.969 -2.033 -7.620 230 2HG2 VAL 50 2HG2 VAL 50 -8.515 -0.348 -7.960 231 3HG2 VAL 50 3HG2 VAL 50 -9.823 -1.114 -8.874 232 HA PRO 51 HA PRO 51 -4.463 0.396 -6.327 233 1HB PRO 51 1HB PRO 51 -2.811 1.969 -7.796 234 2HB PRO 51 2HB PRO 51 -2.335 0.321 -7.304 235 1HG PRO 51 1HG PRO 51 -3.500 1.201 -9.959 236 2HG PRO 51 2HG PRO 51 -2.062 0.176 -9.689 237 1HD PRO 51 1HD PRO 51 -4.551 -0.816 -10.234 238 2HD PRO 51 2HD PRO 51 -3.409 -1.706 -9.187 239 H VAL 52 H VAL 52 -4.751 2.785 -6.222 240 HA VAL 52 HA VAL 52 -7.293 3.514 -7.503 241 HB VAL 52 HB VAL 52 -6.678 5.598 -5.795 242 1HG1 VAL 52 1HG1 VAL 52 -8.845 4.609 -6.035 243 2HG1 VAL 52 2HG1 VAL 52 -8.281 3.060 -5.382 244 3HG1 VAL 52 3HG1 VAL 52 -8.367 4.496 -4.331 245 1HG2 VAL 52 1HG2 VAL 52 -5.789 2.990 -4.513 246 2HG2 VAL 52 2HG2 VAL 52 -4.724 4.367 -4.883 247 3HG2 VAL 52 3HG2 VAL 52 -6.034 4.534 -3.690 248 H GLN 53 H GLN 53 -4.100 4.925 -6.940 249 HA GLN 53 HA GLN 53 -3.984 5.935 -9.665 250 1HB GLN 53 1HB GLN 53 -3.024 7.599 -7.274 251 2HB GLN 53 2HB GLN 53 -2.780 7.953 -8.974 252 1HG GLN 53 1HG GLN 53 -4.583 9.236 -8.902 253 2HG GLN 53 2HG GLN 53 -5.557 7.771 -8.862 254 1HE2 GLN 53 1HE2 GLN 53 -4.819 6.989 -6.105 255 2HE2 GLN 53 2HE2 GLN 53 -5.556 8.189 -5.053 256 H ARG 54 H ARG 54 -1.544 6.077 -10.139 257 HA ARG 54 HA ARG 54 -0.033 3.994 -8.740 258 1HB ARG 54 1HB ARG 54 0.492 5.913 -10.976 259 2HB ARG 54 2HB ARG 54 1.888 5.452 -10.006 260 1HG ARG 54 1HG ARG 54 -0.013 3.342 -11.049 261 2HG ARG 54 2HG ARG 54 1.340 3.966 -12.016 262 1HD ARG 54 1HD ARG 54 2.912 3.149 -10.525 263 2HD ARG 54 2HD ARG 54 1.760 3.006 -9.243 264 HE ARG 54 HE ARG 54 1.259 0.892 -9.787 265 1HH1 ARG 54 1HH1 ARG 54 2.610 2.361 -12.652 266 2HH1 ARG 54 2HH1 ARG 54 2.932 0.873 -13.492 267 1HH2 ARG 54 1HH2 ARG 54 1.799 -1.180 -10.759 268 2HH2 ARG 54 2HH2 ARG 54 2.408 -1.177 -12.377 269 H ASP 55 H ASP 55 -0.092 7.609 -8.788 270 HA ASP 55 HA ASP 55 1.510 7.696 -6.336 271 1HB ASP 55 1HB ASP 55 2.402 9.693 -7.482 272 2HB ASP 55 2HB ASP 55 2.733 8.216 -8.390 273 H ILE 56 H ILE 56 1.166 9.484 -4.982 274 HA ILE 56 HA ILE 56 -1.057 11.282 -5.531 275 HB ILE 56 HB ILE 56 -2.183 11.202 -3.554 276 1HG1 ILE 56 1HG1 ILE 56 0.090 9.552 -2.529 277 2HG1 ILE 56 2HG1 ILE 56 -0.504 11.105 -1.947 278 1HG2 ILE 56 1HG2 ILE 56 -1.693 8.288 -4.225 279 2HG2 ILE 56 2HG2 ILE 56 -3.117 9.007 -3.438 280 3HG2 ILE 56 3HG2 ILE 56 -2.758 9.390 -5.124 281 1HD1 ILE 56 1HD1 ILE 56 -1.207 9.460 -0.346 282 2HD1 ILE 56 2HD1 ILE 56 -2.637 9.977 -1.279 283 3HD1 ILE 56 3HD1 ILE 56 -1.883 8.415 -1.604 284 H ASP 57 H ASP 57 -0.901 13.152 -3.975 285 HA ASP 57 HA ASP 57 1.880 13.595 -3.014 286 1HB ASP 57 1HB ASP 57 -0.158 15.489 -4.237 287 2HB ASP 57 2HB ASP 57 1.039 16.050 -3.068 288 H VAL 58 H VAL 58 2.011 13.944 -0.913 289 HA VAL 58 HA VAL 58 -0.353 14.579 0.811 290 HB VAL 58 HB VAL 58 0.062 12.718 1.882 291 1HG1 VAL 58 1HG1 VAL 58 1.362 11.635 0.177 292 2HG1 VAL 58 2HG1 VAL 58 2.843 12.468 0.708 293 3HG1 VAL 58 3HG1 VAL 58 2.041 11.289 1.760 294 1HG2 VAL 58 1HG2 VAL 58 0.964 14.332 3.483 295 2HG2 VAL 58 2HG2 VAL 58 1.728 12.757 3.640 296 3HG2 VAL 58 3HG2 VAL 58 2.605 14.068 2.845 297 H ARG 59 H ARG 59 0.296 16.226 2.465 298 HA ARG 59 HA ARG 59 2.727 17.784 1.747 299 1HB ARG 59 1HB ARG 59 0.254 18.797 3.187 300 2HB ARG 59 2HB ARG 59 1.680 19.703 2.646 301 1HG ARG 59 1HG ARG 59 0.936 18.451 0.296 302 2HG ARG 59 2HG ARG 59 -0.641 18.628 1.078 303 1HD ARG 59 1HD ARG 59 1.443 20.751 0.469 304 2HD ARG 59 2HD ARG 59 -0.078 20.525 -0.383 305 HE ARG 59 HE ARG 59 -1.141 20.943 1.976 306 1HH1 ARG 59 1HH1 ARG 59 1.952 22.545 1.132 307 2HH1 ARG 59 2HH1 ARG 59 1.442 24.016 1.928 308 1HH2 ARG 59 1HH2 ARG 59 -1.442 22.876 3.319 309 2HH2 ARG 59 2HH2 ARG 59 -0.158 24.087 3.237 310 H ILE 60 H ILE 60 4.284 17.403 3.236 311 HA ILE 60 HA ILE 60 4.180 15.105 4.364 312 HB ILE 60 HB ILE 60 5.743 16.884 6.173 313 1HG1 ILE 60 1HG1 ILE 60 6.417 16.644 3.215 314 2HG1 ILE 60 2HG1 ILE 60 6.004 18.108 4.142 315 1HG2 ILE 60 1HG2 ILE 60 6.415 14.353 4.602 316 2HG2 ILE 60 2HG2 ILE 60 7.364 15.060 5.914 317 3HG2 ILE 60 3HG2 ILE 60 5.779 14.395 6.256 318 1HD1 ILE 60 1HD1 ILE 60 7.864 17.621 5.691 319 2HD1 ILE 60 2HD1 ILE 60 8.421 16.356 4.556 320 3HD1 ILE 60 3HD1 ILE 60 8.381 18.046 4.039 321 H GLY 61 H GLY 61 3.113 13.963 5.786 322 1HA GLY 61 1HA GLY 61 2.322 13.570 8.029 323 2HA GLY 61 2HA GLY 61 1.897 15.274 8.193 324 H GLU 62 H GLU 62 0.738 15.710 5.666 325 HA GLU 62 HA GLU 62 -1.875 15.320 6.500 326 1HB GLU 62 1HB GLU 62 -1.003 16.924 4.688 327 2HB GLU 62 2HB GLU 62 -1.225 15.565 3.557 328 1HG GLU 62 1HG GLU 62 -3.160 16.914 3.383 329 2HG GLU 62 2HG GLU 62 -3.668 15.504 4.321 330 H THR 63 H THR 63 -2.898 13.369 6.937 331 HA THR 63 HA THR 63 -2.663 10.907 5.625 332 HB THR 63 HB THR 63 -5.155 10.760 6.499 333 HG1 THR 63 HG1 THR 63 -5.266 13.074 6.460 334 1HG2 THR 63 1HG2 THR 63 -2.761 11.130 8.310 335 2HG2 THR 63 2HG2 THR 63 -4.379 10.602 8.844 336 3HG2 THR 63 3HG2 THR 63 -3.466 9.638 7.693 337 H VAL 64 H VAL 64 -3.097 10.393 3.544 338 HA VAL 64 HA VAL 64 -5.572 11.534 2.293 339 HB VAL 64 HB VAL 64 -3.789 9.928 0.583 340 1HG1 VAL 64 1HG1 VAL 64 -5.798 11.122 -0.219 341 2HG1 VAL 64 2HG1 VAL 64 -5.064 12.673 0.250 342 3HG1 VAL 64 3HG1 VAL 64 -4.335 11.696 -1.037 343 1HG2 VAL 64 1HG2 VAL 64 -2.758 12.588 1.621 344 2HG2 VAL 64 2HG2 VAL 64 -1.969 10.981 1.661 345 3HG2 VAL 64 3HG2 VAL 64 -2.211 11.814 0.122 346 H GLN 65 H GLN 65 -7.223 10.114 1.884 347 HA GLN 65 HA GLN 65 -7.069 7.323 2.593 348 1HB GLN 65 1HB GLN 65 -9.108 8.847 2.835 349 2HB GLN 65 2HB GLN 65 -9.172 8.943 1.075 350 1HG GLN 65 1HG GLN 65 -10.765 7.335 1.580 351 2HG GLN 65 2HG GLN 65 -9.388 6.323 1.139 352 1HE2 GLN 65 1HE2 GLN 65 -7.981 5.535 3.099 353 2HE2 GLN 65 2HE2 GLN 65 -8.799 5.423 4.637 354 H ILE 66 H ILE 66 -6.446 5.720 1.158 355 HA ILE 66 HA ILE 66 -7.004 6.002 -1.708 356 HB ILE 66 HB ILE 66 -4.536 4.969 -1.985 357 1HG1 ILE 66 1HG1 ILE 66 -2.898 6.406 -0.821 358 2HG1 ILE 66 2HG1 ILE 66 -4.124 6.968 0.311 359 1HG2 ILE 66 1HG2 ILE 66 -3.830 6.985 -2.899 360 2HG2 ILE 66 2HG2 ILE 66 -5.568 6.885 -3.200 361 3HG2 ILE 66 3HG2 ILE 66 -4.955 7.952 -1.911 362 1HD1 ILE 66 1HD1 ILE 66 -3.284 4.053 -0.140 363 2HD1 ILE 66 2HD1 ILE 66 -2.706 5.102 1.156 364 3HD1 ILE 66 3HD1 ILE 66 -4.410 4.651 1.106 365 H MET 67 H MET 67 -8.606 4.442 -1.331 366 HA MET 67 HA MET 67 -7.936 1.979 -0.013 367 1HB MET 67 1HB MET 67 -10.205 1.338 -0.495 368 2HB MET 67 2HB MET 67 -10.210 3.068 -0.115 369 1HG MET 67 1HG MET 67 -11.617 2.997 -1.895 370 2HG MET 67 2HG MET 67 -10.101 3.393 -2.708 371 1HE MET 67 1HE MET 67 -11.950 1.238 -5.384 372 2HE MET 67 2HE MET 67 -12.648 2.448 -4.281 373 3HE MET 67 3HE MET 67 -11.066 2.747 -5.052 374 H TYR 68 H TYR 68 -7.688 -0.103 -0.901 375 HA TYR 68 HA TYR 68 -7.002 -0.252 -3.832 376 1HB TYR 68 1HB TYR 68 -6.363 -2.088 -1.490 377 2HB TYR 68 2HB TYR 68 -6.156 -2.522 -3.182 378 HD1 TYR 68 HD1 TYR 68 -4.332 -1.696 -4.520 379 HD2 TYR 68 HD2 TYR 68 -4.899 -0.313 -0.477 380 HE1 TYR 68 HE1 TYR 68 -1.992 -0.886 -4.464 381 HE2 TYR 68 HE2 TYR 68 -2.555 0.483 -0.419 382 HH TYR 68 HH TYR 68 -0.531 0.465 -1.505 383 H ARG 69 H ARG 69 -8.007 -2.080 -4.987 384 HA ARG 69 HA ARG 69 -10.230 -3.385 -3.554 385 1HB ARG 69 1HB ARG 69 -10.989 -1.326 -4.917 386 2HB ARG 69 2HB ARG 69 -10.707 -2.300 -6.349 387 1HG ARG 69 1HG ARG 69 -12.470 -3.731 -5.909 388 2HG ARG 69 2HG ARG 69 -12.362 -3.532 -4.166 389 1HD ARG 69 1HD ARG 69 -13.266 -1.199 -4.366 390 2HD ARG 69 2HD ARG 69 -13.457 -1.454 -6.116 391 HE ARG 69 HE ARG 69 -14.722 -3.611 -4.802 392 1HH1 ARG 69 1HH1 ARG 69 -15.302 -0.375 -3.777 393 2HH1 ARG 69 2HH1 ARG 69 -16.929 -0.319 -4.236 394 1HH2 ARG 69 1HH2 ARG 69 -16.946 -3.760 -4.974 395 2HH2 ARG 69 2HH2 ARG 69 -17.921 -2.432 -4.393 396 H ALA 70 H ALA 70 -9.948 -5.474 -3.665 397 HA ALA 70 HA ALA 70 -8.694 -6.759 -6.037 398 1HB ALA 70 1HB ALA 70 -8.655 -7.571 -3.113 399 2HB ALA 70 2HB ALA 70 -8.157 -8.618 -4.457 400 3HB ALA 70 3HB ALA 70 -7.274 -7.122 -4.120 401 H LYS 71 H LYS 71 -9.717 -8.729 -6.732 402 HA LYS 71 HA LYS 71 -12.341 -9.537 -5.718 403 1HB LYS 71 1HB LYS 71 -13.470 -8.200 -7.073 404 2HB LYS 71 2HB LYS 71 -11.996 -7.553 -7.792 405 1HG LYS 71 1HG LYS 71 -11.910 -9.470 -9.315 406 2HG LYS 71 2HG LYS 71 -13.400 -10.102 -8.584 407 1HD LYS 71 1HD LYS 71 -14.668 -8.192 -9.476 408 2HD LYS 71 2HD LYS 71 -13.169 -7.283 -9.724 409 1HE LYS 71 1HE LYS 71 -12.523 -9.166 -11.413 410 2HE LYS 71 2HE LYS 71 -14.250 -9.549 -11.452 411 1HZ LYS 71 1HZ LYS 71 -14.585 -7.517 -12.581 412 2HZ LYS 71 2HZ LYS 71 -13.306 -6.786 -11.790 413 3HZ LYS 71 3HZ LYS 71 -12.953 -7.772 -12.944 414 H ASN 72 H ASN 72 -12.317 -11.761 -5.836 415 HA ASN 72 HA ASN 72 -9.936 -12.882 -7.100 416 1HB ASN 72 1HB ASN 72 -10.478 -13.722 -4.932 417 2HB ASN 72 2HB ASN 72 -12.108 -14.193 -5.457 418 1HD2 ASN 72 1HD2 ASN 72 -11.080 -16.383 -4.454 419 2HD2 ASN 72 2HD2 ASN 72 -10.413 -17.435 -5.693 420 H LEU 73 H LEU 73 -9.793 -13.383 -9.174 421 HA LEU 73 HA LEU 73 -12.266 -13.889 -10.711 422 1HB LEU 73 1HB LEU 73 -9.834 -12.400 -11.137 423 2HB LEU 73 2HB LEU 73 -9.877 -13.670 -12.342 424 HG LEU 73 HG LEU 73 -12.191 -11.758 -11.798 425 1HD1 LEU 73 1HD1 LEU 73 -10.058 -11.671 -13.977 426 2HD1 LEU 73 2HD1 LEU 73 -11.464 -10.591 -13.850 427 3HD1 LEU 73 3HD1 LEU 73 -10.198 -10.544 -12.612 428 1HD2 LEU 73 1HD2 LEU 73 -12.896 -13.882 -12.895 429 2HD2 LEU 73 2HD2 LEU 73 -12.981 -12.531 -14.033 430 3HD2 LEU 73 3HD2 LEU 73 -11.626 -13.676 -14.115 431 H ALA 74 H ALA 74 -10.285 -15.871 -9.033 432 HA ALA 74 HA ALA 74 -9.813 -17.879 -11.119 433 1HB ALA 74 1HB ALA 74 -9.580 -18.016 -8.084 434 2HB ALA 74 2HB ALA 74 -9.054 -19.280 -9.211 435 3HB ALA 74 3HB ALA 74 -8.278 -17.701 -9.248 436 H SER 75 H SER 75 -10.581 -20.173 -10.317 437 HA SER 75 HA SER 75 -13.573 -20.075 -9.990 438 1HB SER 75 1HB SER 75 -12.824 -20.933 -12.194 439 2HB SER 75 2HB SER 75 -11.896 -22.206 -11.359 440 HG SER 75 HG SER 75 -13.942 -22.779 -10.356 441 H THR 76 H THR 76 -11.251 -20.075 -7.997 442 HA THR 76 HA THR 76 -12.142 -22.153 -6.177 443 HB THR 76 HB THR 76 -9.509 -22.613 -5.962 444 HG1 THR 76 HG1 THR 76 -8.946 -21.110 -7.579 445 1HG2 THR 76 1HG2 THR 76 -9.626 -24.553 -7.404 446 2HG2 THR 76 2HG2 THR 76 -11.193 -24.364 -6.591 447 3HG2 THR 76 3HG2 THR 76 -11.002 -23.887 -8.293 448 HA PRO 77 HA PRO 77 -10.912 -18.830 -3.524 449 1HB PRO 77 1HB PRO 77 -9.884 -20.058 -1.265 450 2HB PRO 77 2HB PRO 77 -11.624 -20.045 -1.649 451 1HG PRO 77 1HG PRO 77 -9.620 -22.223 -2.288 452 2HG PRO 77 2HG PRO 77 -11.220 -22.401 -1.507 453 1HD PRO 77 1HD PRO 77 -10.905 -22.860 -4.150 454 2HD PRO 77 2HD PRO 77 -12.352 -21.996 -3.567 455 H THR 78 H THR 78 -8.917 -17.739 -2.707 456 HA THR 78 HA THR 78 -6.414 -19.237 -3.155 457 HB THR 78 HB THR 78 -5.886 -16.447 -3.749 458 HG1 THR 78 HG1 THR 78 -6.761 -16.537 -5.843 459 1HG2 THR 78 1HG2 THR 78 -4.727 -17.397 -5.631 460 2HG2 THR 78 2HG2 THR 78 -4.502 -18.500 -4.271 461 3HG2 THR 78 3HG2 THR 78 -5.701 -18.886 -5.542 462 H THR 79 H THR 79 -4.554 -18.142 -2.122 463 HA THR 79 HA THR 79 -5.276 -17.204 0.610 464 HB THR 79 HB THR 79 -4.502 -19.349 0.991 465 HG1 THR 79 HG1 THR 79 -2.116 -17.842 0.787 466 1HG2 THR 79 1HG2 THR 79 -2.587 -20.436 -0.161 467 2HG2 THR 79 2HG2 THR 79 -3.949 -20.137 -1.242 468 3HG2 THR 79 3HG2 THR 79 -2.512 -19.088 -1.309 469 H GLY 80 H GLY 80 -4.952 -15.031 0.326 470 1HA GLY 80 1HA GLY 80 -2.851 -13.973 -1.405 471 2HA GLY 80 2HA GLY 80 -3.998 -13.073 -0.436 472 H GLN 81 H GLN 81 -0.981 -14.707 -0.522 473 HA GLN 81 HA GLN 81 -0.159 -13.427 2.025 474 1HB GLN 81 1HB GLN 81 0.630 -16.187 0.979 475 2HB GLN 81 2HB GLN 81 1.423 -15.410 2.347 476 1HG GLN 81 1HG GLN 81 -1.573 -16.065 2.273 477 2HG GLN 81 2HG GLN 81 -0.350 -17.162 2.888 478 1HE2 GLN 81 1HE2 GLN 81 0.659 -13.998 3.706 479 2HE2 GLN 81 2HE2 GLN 81 -0.021 -13.982 5.317 480 H ALA 82 H ALA 82 -0.211 -12.056 -0.213 481 HA ALA 82 HA ALA 82 2.071 -12.256 -1.914 482 1HB ALA 82 1HB ALA 82 0.025 -10.927 -2.366 483 2HB ALA 82 2HB ALA 82 0.426 -9.871 -1.011 484 3HB ALA 82 3HB ALA 82 1.482 -9.892 -2.427 485 H THR 83 H THR 83 3.637 -10.168 -1.935 486 HA THR 83 HA THR 83 4.519 -9.480 0.771 487 HB THR 83 HB THR 83 6.544 -10.717 -1.016 488 HG1 THR 83 HG1 THR 83 4.711 -11.994 0.696 489 1HG2 THR 83 1HG2 THR 83 7.426 -9.471 0.925 490 2HG2 THR 83 2HG2 THR 83 6.329 -10.369 2.009 491 3HG2 THR 83 3HG2 THR 83 7.651 -11.205 1.177 492 H PHE 84 H PHE 84 6.251 -7.812 0.675 493 HA PHE 84 HA PHE 84 6.203 -6.227 -1.791 494 1HB PHE 84 1HB PHE 84 5.451 -4.237 -0.316 495 2HB PHE 84 2HB PHE 84 4.251 -5.427 -0.779 496 HD1 PHE 84 HD1 PHE 84 6.689 -5.486 2.144 497 HD2 PHE 84 HD2 PHE 84 2.582 -5.285 0.808 498 HE1 PHE 84 HE1 PHE 84 5.943 -5.638 4.443 499 HE2 PHE 84 HE2 PHE 84 1.830 -5.454 3.141 500 HZ PHE 84 HZ PHE 84 3.502 -5.625 4.989 501 H ASN 85 H ASN 85 7.484 -4.264 -1.516 502 HA ASN 85 HA ASN 85 9.654 -4.368 0.562 503 1HB ASN 85 1HB ASN 85 10.830 -4.763 -1.456 504 2HB ASN 85 2HB ASN 85 9.735 -3.742 -2.387 505 1HD2 ASN 85 1HD2 ASN 85 9.783 -1.379 -1.953 506 2HD2 ASN 85 2HD2 ASN 85 11.319 -0.613 -1.622 507 H VAL 86 H VAL 86 8.942 -2.817 1.998 508 HA VAL 86 HA VAL 86 7.383 -0.487 1.003 509 HB VAL 86 HB VAL 86 7.911 -1.404 3.850 510 1HG1 VAL 86 1HG1 VAL 86 6.031 0.099 4.396 511 2HG1 VAL 86 2HG1 VAL 86 7.330 1.020 3.633 512 3HG1 VAL 86 3HG1 VAL 86 5.894 0.583 2.696 513 1HG2 VAL 86 1HG2 VAL 86 6.601 -3.099 2.686 514 2HG2 VAL 86 2HG2 VAL 86 5.571 -2.210 3.811 515 3HG2 VAL 86 3HG2 VAL 86 5.478 -1.868 2.072 516 H THR 87 H THR 87 9.350 0.377 -0.093 517 HA THR 87 HA THR 87 10.313 2.494 1.350 518 HB THR 87 HB THR 87 11.825 0.927 2.543 519 HG1 THR 87 HG1 THR 87 13.730 2.088 2.093 520 1HG2 THR 87 1HG2 THR 87 13.640 -0.171 1.430 521 2HG2 THR 87 2HG2 THR 87 12.083 -0.719 0.782 522 3HG2 THR 87 3HG2 THR 87 13.085 0.416 -0.150 523 HA PRO 88 HA PRO 88 11.547 3.483 -2.905 524 1HB PRO 88 1HB PRO 88 13.025 5.772 -2.352 525 2HB PRO 88 2HB PRO 88 11.273 5.738 -2.619 526 1HG PRO 88 1HG PRO 88 12.742 5.931 -0.037 527 2HG PRO 88 2HG PRO 88 11.170 6.630 -0.497 528 1HD PRO 88 1HD PRO 88 11.503 4.358 1.066 529 2HD PRO 88 2HD PRO 88 10.029 4.716 0.137 530 H MET 89 H MET 89 13.507 3.437 0.023 531 HA MET 89 HA MET 89 15.254 1.542 -0.474 532 1HB MET 89 1HB MET 89 17.446 2.615 -1.036 533 2HB MET 89 2HB MET 89 16.324 2.404 -2.355 534 1HG MET 89 1HG MET 89 15.698 4.932 -1.955 535 2HG MET 89 2HG MET 89 17.188 4.960 -0.998 536 1HE MET 89 1HE MET 89 16.432 3.096 -4.486 537 2HE MET 89 2HE MET 89 15.600 4.668 -4.537 538 3HE MET 89 3HE MET 89 17.023 4.375 -5.562 539 H ALA 90 H ALA 90 15.880 4.942 0.479 540 HA ALA 90 HA ALA 90 17.333 4.081 2.785 541 1HB ALA 90 1HB ALA 90 17.808 6.387 3.105 542 2HB ALA 90 2HB ALA 90 17.728 6.155 1.349 543 3HB ALA 90 3HB ALA 90 16.359 6.892 2.216 544 H ALA 91 H ALA 91 14.064 5.420 2.368 545 HA ALA 91 HA ALA 91 13.686 5.821 5.268 546 1HB ALA 91 1HB ALA 91 11.881 6.287 2.861 547 2HB ALA 91 2HB ALA 91 11.439 6.653 4.547 548 3HB ALA 91 3HB ALA 91 12.805 7.490 3.780 549 H GLY 92 H GLY 92 10.910 4.632 3.587 550 1HA GLY 92 1HA GLY 92 9.743 2.683 3.764 551 2HA GLY 92 2HA GLY 92 11.195 1.873 4.392 552 H ALA 93 H ALA 93 11.824 2.899 6.702 553 HA ALA 93 HA ALA 93 9.990 2.110 8.637 554 1HB ALA 93 1HB ALA 93 12.082 4.325 8.832 555 2HB ALA 93 2HB ALA 93 11.301 3.515 10.206 556 3HB ALA 93 3HB ALA 93 12.351 2.590 9.114 557 H TYR 94 H TYR 94 10.504 5.363 7.335 558 HA TYR 94 HA TYR 94 8.335 6.601 8.774 559 1HB TYR 94 1HB TYR 94 9.787 7.697 6.370 560 2HB TYR 94 2HB TYR 94 9.048 8.591 7.700 561 HD1 TYR 94 HD1 TYR 94 10.180 6.994 10.062 562 HD2 TYR 94 HD2 TYR 94 12.066 8.298 6.419 563 HE1 TYR 94 HE1 TYR 94 12.354 7.097 11.224 564 HE2 TYR 94 HE2 TYR 94 14.210 8.564 7.640 565 HH TYR 94 HH TYR 94 15.310 8.297 9.609 566 H PHE 95 H PHE 95 7.969 4.387 6.410 567 HA PHE 95 HA PHE 95 5.847 5.705 4.872 568 1HB PHE 95 1HB PHE 95 7.314 3.828 3.942 569 2HB PHE 95 2HB PHE 95 6.542 2.751 5.098 570 HD1 PHE 95 HD1 PHE 95 4.065 2.266 4.946 571 HD2 PHE 95 HD2 PHE 95 6.286 4.184 1.790 572 HE1 PHE 95 HE1 PHE 95 2.098 2.096 3.454 573 HE2 PHE 95 HE2 PHE 95 4.288 4.090 0.331 574 HZ PHE 95 HZ PHE 95 2.172 3.104 1.179 575 H ASN 96 H ASN 96 4.085 6.295 6.104 576 HA ASN 96 HA ASN 96 3.453 4.777 8.385 577 1HB ASN 96 1HB ASN 96 1.942 6.996 6.997 578 2HB ASN 96 2HB ASN 96 1.208 6.087 8.311 579 1HD2 ASN 96 1HD2 ASN 96 3.575 8.553 7.616 580 2HD2 ASN 96 2HD2 ASN 96 4.062 8.765 9.328 581 H LYS 97 H LYS 97 3.366 2.634 7.523 582 HA LYS 97 HA LYS 97 1.102 1.682 5.999 583 1HB LYS 97 1HB LYS 97 3.293 0.452 6.573 584 2HB LYS 97 2HB LYS 97 2.614 0.158 8.166 585 1HG LYS 97 1HG LYS 97 0.650 -0.636 6.155 586 2HG LYS 97 2HG LYS 97 2.222 -1.228 5.648 587 1HD LYS 97 1HD LYS 97 1.176 -2.952 6.915 588 2HD LYS 97 2HD LYS 97 2.522 -2.324 7.886 589 1HE LYS 97 1HE LYS 97 0.943 -0.984 9.238 590 2HE LYS 97 2HE LYS 97 -0.404 -1.463 8.181 591 1HZ LYS 97 1HZ LYS 97 1.108 -3.279 9.932 592 2HZ LYS 97 2HZ LYS 97 -0.415 -2.727 10.205 593 3HZ LYS 97 3HZ LYS 97 -0.139 -3.712 8.942 594 H VAL 98 H VAL 98 -0.936 0.989 6.800 595 HA VAL 98 HA VAL 98 -2.130 2.596 8.659 596 HB VAL 98 HB VAL 98 -3.026 -0.209 7.863 597 1HG1 VAL 98 1HG1 VAL 98 -4.609 2.145 8.991 598 2HG1 VAL 98 2HG1 VAL 98 -5.323 0.672 8.306 599 3HG1 VAL 98 3HG1 VAL 98 -4.354 0.569 9.776 600 1HG2 VAL 98 1HG2 VAL 98 -3.557 2.525 6.616 601 2HG2 VAL 98 2HG2 VAL 98 -2.660 1.175 5.883 602 3HG2 VAL 98 3HG2 VAL 98 -4.394 1.023 6.165 603 H GLN 99 H GLN 99 -2.605 2.593 10.799 604 HA GLN 99 HA GLN 99 -1.030 1.027 12.622 605 1HB GLN 99 1HB GLN 99 -2.305 2.253 14.358 606 2HB GLN 99 2HB GLN 99 -1.463 3.271 13.187 607 1HG GLN 99 1HG GLN 99 -3.560 3.793 12.024 608 2HG GLN 99 2HG GLN 99 -4.461 2.693 13.077 609 1HE2 GLN 99 1HE2 GLN 99 -5.252 5.350 12.808 610 2HE2 GLN 99 2HE2 GLN 99 -4.916 6.163 14.340 611 H CYS 100 H CYS 100 -1.858 -1.032 11.584 612 HA CYS 100 HA CYS 100 -3.844 -2.273 13.383 613 1HB CYS 100 1HB CYS 100 -5.243 -1.599 11.520 614 2HB CYS 100 2HB CYS 100 -4.080 -2.238 10.333 615 HG CYS 100 HG CYS 100 -4.254 -4.697 10.932 616 H PHE 101 H PHE 101 -3.376 -4.392 13.750 617 HA PHE 101 HA PHE 101 -0.757 -5.428 12.950 618 1HB PHE 101 1HB PHE 101 -1.728 -5.630 15.261 619 2HB PHE 101 2HB PHE 101 -2.950 -6.718 14.614 620 HD1 PHE 101 HD1 PHE 101 -2.429 -9.059 14.260 621 HD2 PHE 101 HD2 PHE 101 0.721 -6.253 15.177 622 HE1 PHE 101 HE1 PHE 101 -0.870 -10.936 14.667 623 HE2 PHE 101 HE2 PHE 101 2.276 -8.142 15.578 624 HZ PHE 101 HZ PHE 101 1.485 -10.485 15.328 625 H CYS 102 H CYS 102 -1.573 -5.213 10.624 626 HA CYS 102 HA CYS 102 -2.045 -7.893 9.644 627 1HB CYS 102 1HB CYS 102 -4.423 -7.063 9.990 628 2HB CYS 102 2HB CYS 102 -4.063 -5.729 8.865 629 HG CYS 102 HG CYS 102 -5.424 -7.505 7.577 630 H PHE 103 H PHE 103 -1.463 -7.946 7.296 631 HA PHE 103 HA PHE 103 0.287 -5.658 6.562 632 1HB PHE 103 1HB PHE 103 1.474 -7.138 5.189 633 2HB PHE 103 2HB PHE 103 1.313 -7.890 6.766 634 HD1 PHE 103 HD1 PHE 103 0.672 -8.169 3.192 635 HD2 PHE 103 HD2 PHE 103 -0.358 -9.829 7.052 636 HE1 PHE 103 HE1 PHE 103 -0.182 -10.197 2.098 637 HE2 PHE 103 HE2 PHE 103 -1.413 -11.764 5.915 638 HZ PHE 103 HZ PHE 103 -1.346 -11.942 3.442 639 H THR 104 H THR 104 -2.801 -6.704 5.942 640 HA THR 104 HA THR 104 -4.367 -5.789 4.535 641 HB THR 104 HB THR 104 -2.322 -5.506 2.307 642 HG1 THR 104 HG1 THR 104 -1.677 -4.114 3.813 643 1HG2 THR 104 1HG2 THR 104 -4.580 -5.484 1.429 644 2HG2 THR 104 2HG2 THR 104 -5.118 -4.368 2.716 645 3HG2 THR 104 3HG2 THR 104 -3.981 -3.828 1.469 646 H GLU 105 H GLU 105 -5.478 -6.899 2.698 647 HA GLU 105 HA GLU 105 -6.296 -8.660 1.711 648 1HB GLU 105 1HB GLU 105 -5.058 -9.600 0.067 649 2HB GLU 105 2HB GLU 105 -3.950 -8.329 0.551 650 1HG GLU 105 1HG GLU 105 -2.984 -10.256 2.165 651 2HG GLU 105 2HG GLU 105 -3.794 -11.303 1.013 652 H THR 106 H THR 106 -5.988 -11.323 1.567 653 HA THR 106 HA THR 106 -5.080 -12.775 3.664 654 HB THR 106 HB THR 106 -6.360 -11.828 5.350 655 HG1 THR 106 HG1 THR 106 -6.357 -14.022 5.473 656 1HG2 THR 106 1HG2 THR 106 -8.151 -10.693 3.926 657 2HG2 THR 106 2HG2 THR 106 -9.026 -12.240 3.937 658 3HG2 THR 106 3HG2 THR 106 -8.667 -11.423 5.447 659 H THR 107 H THR 107 -8.394 -13.105 2.426 660 HA THR 107 HA THR 107 -7.662 -15.357 0.716 661 HB THR 107 HB THR 107 -7.596 -16.326 2.940 662 HG1 THR 107 HG1 THR 107 -9.292 -17.926 2.377 663 1HG2 THR 107 1HG2 THR 107 -9.653 -16.546 4.231 664 2HG2 THR 107 2HG2 THR 107 -9.298 -14.824 3.956 665 3HG2 THR 107 3HG2 THR 107 -10.552 -15.637 2.992 666 H LEU 108 H LEU 108 -9.437 -15.951 -0.646 667 HA LEU 108 HA LEU 108 -12.030 -14.660 -0.357 668 1HB LEU 108 1HB LEU 108 -10.181 -14.001 -2.687 669 2HB LEU 108 2HB LEU 108 -11.926 -13.818 -2.791 670 HG LEU 108 HG LEU 108 -10.168 -12.280 -0.859 671 1HD1 LEU 108 1HD1 LEU 108 -11.504 -11.353 -3.422 672 2HD1 LEU 108 2HD1 LEU 108 -10.425 -10.429 -2.355 673 3HD1 LEU 108 3HD1 LEU 108 -9.788 -11.783 -3.277 674 1HD2 LEU 108 1HD2 LEU 108 -12.517 -12.559 -0.036 675 2HD2 LEU 108 2HD2 LEU 108 -12.290 -10.913 -0.593 676 3HD2 LEU 108 3HD2 LEU 108 -13.125 -12.060 -1.628 677 H GLU 109 H GLU 109 -13.385 -16.268 -0.808 678 HA GLU 109 HA GLU 109 -12.996 -18.450 -2.532 679 1HB GLU 109 1HB GLU 109 -15.417 -16.976 -1.444 680 2HB GLU 109 2HB GLU 109 -15.589 -18.424 -2.407 681 1HG GLU 109 1HG GLU 109 -15.668 -19.023 -0.074 682 2HG GLU 109 2HG GLU 109 -14.197 -19.695 -0.784 683 HA PRO 110 HA PRO 110 -13.100 -16.857 -6.503 684 1HB PRO 110 1HB PRO 110 -14.409 -18.675 -8.059 685 2HB PRO 110 2HB PRO 110 -12.880 -18.950 -7.204 686 1HG PRO 110 1HG PRO 110 -15.675 -19.707 -6.299 687 2HG PRO 110 2HG PRO 110 -14.251 -20.781 -6.371 688 1HD PRO 110 1HD PRO 110 -15.023 -19.536 -4.091 689 2HD PRO 110 2HD PRO 110 -13.298 -19.749 -4.451 690 H GLY 111 H GLY 111 -14.082 -14.917 -6.768 691 1HA GLY 111 1HA GLY 111 -15.812 -13.830 -8.116 692 2HA GLY 111 2HA GLY 111 -17.034 -14.833 -7.313 693 H GLU 112 H GLU 112 -15.021 -14.437 -4.793 694 HA GLU 112 HA GLU 112 -16.702 -12.341 -3.810 695 1HB GLU 112 1HB GLU 112 -14.400 -13.896 -2.559 696 2HB GLU 112 2HB GLU 112 -15.423 -12.742 -1.717 697 1HG GLU 112 1HG GLU 112 -16.384 -15.267 -2.976 698 2HG GLU 112 2HG GLU 112 -16.245 -14.893 -1.250 699 H GLU 113 H GLU 113 -15.923 -10.465 -2.665 700 HA GLU 113 HA GLU 113 -13.812 -9.099 -4.240 701 1HB GLU 113 1HB GLU 113 -16.477 -8.735 -4.609 702 2HB GLU 113 2HB GLU 113 -16.223 -7.599 -3.273 703 1HG GLU 113 1HG GLU 113 -14.122 -7.146 -5.163 704 2HG GLU 113 2HG GLU 113 -15.595 -7.490 -6.104 705 H MET 114 H MET 114 -12.748 -7.300 -3.246 706 HA MET 114 HA MET 114 -12.777 -7.152 -0.292 707 1HB MET 114 1HB MET 114 -11.384 -9.020 -0.901 708 2HB MET 114 2HB MET 114 -10.586 -8.139 -2.196 709 1HG MET 114 1HG MET 114 -9.422 -6.747 -0.601 710 2HG MET 114 2HG MET 114 -10.461 -7.321 0.706 711 1HE MET 114 1HE MET 114 -8.890 -10.820 1.470 712 2HE MET 114 2HE MET 114 -9.901 -9.497 2.099 713 3HE MET 114 3HE MET 114 -10.414 -10.412 0.665 714 H GLU 115 H GLU 115 -13.535 -4.896 -0.664 715 HA GLU 115 HA GLU 115 -11.391 -3.170 -1.766 716 1HB GLU 115 1HB GLU 115 -12.743 -1.309 -1.570 717 2HB GLU 115 2HB GLU 115 -13.520 -2.582 -2.513 718 1HG GLU 115 1HG GLU 115 -15.029 -3.098 -0.632 719 2HG GLU 115 2HG GLU 115 -14.341 -1.721 0.262 720 H MET 116 H MET 116 -9.981 -2.158 -0.591 721 HA MET 116 HA MET 116 -10.013 -2.535 2.382 722 1HB MET 116 1HB MET 116 -7.773 -2.905 0.367 723 2HB MET 116 2HB MET 116 -7.540 -2.917 2.117 724 1HG MET 116 1HG MET 116 -9.567 -4.840 1.002 725 2HG MET 116 2HG MET 116 -7.877 -5.121 0.611 726 1HE MET 116 1HE MET 116 -9.109 -3.672 4.140 727 2HE MET 116 2HE MET 116 -10.438 -4.717 3.559 728 3HE MET 116 3HE MET 116 -9.446 -5.212 4.951 729 HA PRO 117 HA PRO 117 -9.454 1.998 1.670 730 1HB PRO 117 1HB PRO 117 -10.301 1.847 4.526 731 2HB PRO 117 2HB PRO 117 -10.764 3.038 3.285 732 1HG PRO 117 1HG PRO 117 -12.507 1.070 3.983 733 2HG PRO 117 2HG PRO 117 -12.279 1.488 2.259 734 1HD PRO 117 1HD PRO 117 -11.015 -0.800 3.793 735 2HD PRO 117 2HD PRO 117 -11.815 -0.818 2.192 736 H VAL 118 H VAL 118 -7.378 2.782 1.914 737 HA VAL 118 HA VAL 118 -5.832 2.025 4.326 738 HB VAL 118 HB VAL 118 -4.907 2.196 1.427 739 1HG1 VAL 118 1HG1 VAL 118 -2.611 1.948 2.220 740 2HG1 VAL 118 2HG1 VAL 118 -3.292 3.470 2.790 741 3HG1 VAL 118 3HG1 VAL 118 -3.156 2.100 3.902 742 1HG2 VAL 118 1HG2 VAL 118 -3.969 -0.040 1.890 743 2HG2 VAL 118 2HG2 VAL 118 -4.655 0.011 3.527 744 3HG2 VAL 118 3HG2 VAL 118 -5.724 -0.012 2.109 745 H VAL 119 H VAL 119 -4.691 3.827 5.125 746 HA VAL 119 HA VAL 119 -5.239 6.437 3.867 747 HB VAL 119 HB VAL 119 -6.671 6.177 5.868 748 1HG1 VAL 119 1HG1 VAL 119 -5.230 4.623 7.190 749 2HG1 VAL 119 2HG1 VAL 119 -4.087 5.955 7.476 750 3HG1 VAL 119 3HG1 VAL 119 -5.742 6.047 8.098 751 1HG2 VAL 119 1HG2 VAL 119 -4.399 8.172 6.181 752 2HG2 VAL 119 2HG2 VAL 119 -5.878 8.393 5.223 753 3HG2 VAL 119 3HG2 VAL 119 -5.979 8.259 6.987 754 H PHE 120 H PHE 120 -3.330 7.717 3.774 755 HA PHE 120 HA PHE 120 -0.841 6.507 4.896 756 1HB PHE 120 1HB PHE 120 -1.227 5.515 2.630 757 2HB PHE 120 2HB PHE 120 -1.390 7.134 1.953 758 HD1 PHE 120 HD1 PHE 120 0.941 4.874 3.816 759 HD2 PHE 120 HD2 PHE 120 0.570 8.409 1.374 760 HE1 PHE 120 HE1 PHE 120 3.349 5.319 4.077 761 HE2 PHE 120 HE2 PHE 120 2.963 8.896 1.745 762 HZ PHE 120 HZ PHE 120 4.315 7.435 3.199 763 H PHE 121 H PHE 121 0.870 7.932 5.185 764 HA PHE 121 HA PHE 121 0.963 10.404 3.743 765 1HB PHE 121 1HB PHE 121 1.269 11.787 5.766 766 2HB PHE 121 2HB PHE 121 -0.380 11.233 5.538 767 HD1 PHE 121 HD1 PHE 121 2.458 11.277 7.785 768 HD2 PHE 121 HD2 PHE 121 -1.274 9.348 6.924 769 HE1 PHE 121 HE1 PHE 121 2.329 10.491 10.147 770 HE2 PHE 121 HE2 PHE 121 -1.385 8.495 9.270 771 HZ PHE 121 HZ PHE 121 0.427 9.057 10.868 772 H VAL 122 H VAL 122 3.095 11.096 3.557 773 HA VAL 122 HA VAL 122 5.223 9.452 4.717 774 HB VAL 122 HB VAL 122 5.459 12.142 3.299 775 1HG1 VAL 122 1HG1 VAL 122 7.813 11.248 2.923 776 2HG1 VAL 122 2HG1 VAL 122 7.429 11.614 4.610 777 3HG1 VAL 122 3HG1 VAL 122 7.437 9.935 4.042 778 1HG2 VAL 122 1HG2 VAL 122 6.181 10.689 1.332 779 2HG2 VAL 122 2HG2 VAL 122 5.468 9.313 2.189 780 3HG2 VAL 122 3HG2 VAL 122 4.455 10.685 1.694 781 H ASP 123 H ASP 123 6.257 9.938 6.595 782 HA ASP 123 HA ASP 123 4.899 11.767 8.391 783 1HB ASP 123 1HB ASP 123 5.953 9.264 8.650 784 2HB ASP 123 2HB ASP 123 7.333 10.189 9.201 785 HA PRO 124 HA PRO 124 8.255 14.817 7.896 786 1HB PRO 124 1HB PRO 124 7.685 16.595 9.877 787 2HB PRO 124 2HB PRO 124 6.670 16.345 8.424 788 1HG PRO 124 1HG PRO 124 6.253 15.075 11.142 789 2HG PRO 124 2HG PRO 124 5.070 16.028 10.190 790 1HD PRO 124 1HD PRO 124 5.072 13.368 10.068 791 2HD PRO 124 2HD PRO 124 4.840 14.314 8.580 792 H GLU 125 H GLU 125 8.779 12.325 9.302 793 HA GLU 125 HA GLU 125 10.971 12.993 11.120 794 1HB GLU 125 1HB GLU 125 9.251 11.604 11.966 795 2HB GLU 125 2HB GLU 125 9.170 10.621 10.488 796 1HG GLU 125 1HG GLU 125 11.427 9.749 11.056 797 2HG GLU 125 2HG GLU 125 11.324 10.677 12.569 798 H ILE 126 H ILE 126 10.018 11.840 7.818 799 HA ILE 126 HA ILE 126 12.493 10.648 7.200 800 HB ILE 126 HB ILE 126 10.388 10.532 5.878 801 1HG1 ILE 126 1HG1 ILE 126 12.736 11.481 4.167 802 2HG1 ILE 126 2HG1 ILE 126 12.736 9.960 5.071 803 1HG2 ILE 126 1HG2 ILE 126 9.804 12.259 4.268 804 2HG2 ILE 126 2HG2 ILE 126 9.886 13.041 5.853 805 3HG2 ILE 126 3HG2 ILE 126 11.218 13.223 4.685 806 1HD1 ILE 126 1HD1 ILE 126 10.651 9.274 3.978 807 2HD1 ILE 126 2HD1 ILE 126 10.736 10.711 2.926 808 3HD1 ILE 126 3HD1 ILE 126 12.015 9.479 2.850 809 H VAL 127 H VAL 127 11.524 14.027 7.281 810 HA VAL 127 HA VAL 127 14.149 14.983 6.389 811 HB VAL 127 HB VAL 127 13.210 17.221 7.045 812 1HG1 VAL 127 1HG1 VAL 127 13.177 16.376 4.738 813 2HG1 VAL 127 2HG1 VAL 127 11.609 15.594 5.031 814 3HG1 VAL 127 3HG1 VAL 127 11.748 17.362 5.089 815 1HG2 VAL 127 1HG2 VAL 127 11.447 16.392 8.679 816 2HG2 VAL 127 2HG2 VAL 127 10.848 17.496 7.434 817 3HG2 VAL 127 3HG2 VAL 127 10.534 15.764 7.291 818 H LYS 128 H LYS 128 14.949 13.341 8.125 819 HA LYS 128 HA LYS 128 15.827 15.063 10.372 820 1HB LYS 128 1HB LYS 128 14.619 12.317 10.803 821 2HB LYS 128 2HB LYS 128 15.803 13.041 11.905 822 1HG LYS 128 1HG LYS 128 14.336 15.048 12.077 823 2HG LYS 128 2HG LYS 128 13.129 14.230 11.065 824 1HD LYS 128 1HD LYS 128 12.903 12.409 12.660 825 2HD LYS 128 2HD LYS 128 14.204 13.037 13.666 826 1HE LYS 128 1HE LYS 128 11.480 14.362 13.196 827 2HE LYS 128 2HE LYS 128 12.030 13.539 14.661 828 1HZ LYS 128 1HZ LYS 128 13.891 15.267 14.593 829 2HZ LYS 128 2HZ LYS 128 12.887 16.126 13.609 830 3HZ LYS 128 3HZ LYS 128 12.444 15.727 15.156 831 HA PRO 129 HA PRO 129 19.583 12.503 9.765 832 1HB PRO 129 1HB PRO 129 19.728 10.034 8.642 833 2HB PRO 129 2HB PRO 129 19.170 10.288 10.320 834 1HG PRO 129 1HG PRO 129 17.508 10.009 7.830 835 2HG PRO 129 2HG PRO 129 17.308 9.104 9.353 836 1HD PRO 129 1HD PRO 129 15.777 11.301 8.843 837 2HD PRO 129 2HD PRO 129 16.419 10.967 10.481 838 H VAL 130 H VAL 130 21.214 12.121 7.961 839 HA VAL 130 HA VAL 130 20.654 14.136 5.988 840 HB VAL 130 HB VAL 130 23.020 12.261 6.458 841 1HG1 VAL 130 1HG1 VAL 130 23.061 13.080 4.161 842 2HG1 VAL 130 2HG1 VAL 130 22.776 14.745 4.723 843 3HG1 VAL 130 3HG1 VAL 130 24.297 13.909 5.117 844 1HG2 VAL 130 1HG2 VAL 130 22.623 13.779 8.372 845 2HG2 VAL 130 2HG2 VAL 130 24.067 14.263 7.481 846 3HG2 VAL 130 3HG2 VAL 130 22.555 15.168 7.267 847 H GLU 131 H GLU 131 21.206 10.664 6.033 848 HA GLU 131 HA GLU 131 21.142 9.876 3.387 849 1HB GLU 131 1HB GLU 131 19.841 8.409 5.699 850 2HB GLU 131 2HB GLU 131 20.470 7.760 4.177 851 1HG GLU 131 1HG GLU 131 22.332 7.430 5.380 852 2HG GLU 131 2HG GLU 131 22.702 9.103 5.054 853 H THR 132 H THR 132 18.257 9.943 5.570 854 HA THR 132 HA THR 132 16.620 9.487 3.255 855 HB THR 132 HB THR 132 14.761 9.336 4.719 856 HG1 THR 132 HG1 THR 132 15.189 11.002 6.221 857 1HG2 THR 132 1HG2 THR 132 16.387 7.447 4.606 858 2HG2 THR 132 2HG2 THR 132 17.166 8.048 6.082 859 3HG2 THR 132 3HG2 THR 132 15.489 7.488 6.120 860 H GLN 133 H GLN 133 17.659 12.392 4.919 861 HA GLN 133 HA GLN 133 15.829 14.293 4.108 862 1HB GLN 133 1HB GLN 133 18.555 14.327 4.891 863 2HB GLN 133 2HB GLN 133 18.590 14.995 3.294 864 1HG GLN 133 1HG GLN 133 18.360 16.803 4.802 865 2HG GLN 133 2HG GLN 133 16.830 16.650 3.931 866 1HE2 GLN 133 1HE2 GLN 133 17.668 14.397 6.653 867 2HE2 GLN 133 2HE2 GLN 133 16.679 15.213 7.811 868 H GLY 134 H GLY 134 18.124 12.491 2.052 869 1HA GLY 134 1HA GLY 134 17.738 13.854 -0.408 870 2HA GLY 134 2HA GLY 134 18.188 12.153 -0.208 871 H ILE 135 H ILE 135 16.033 11.035 1.011 872 HA ILE 135 HA ILE 135 14.357 10.524 -1.270 873 HB ILE 135 HB ILE 135 14.206 9.620 1.613 874 1HG1 ILE 135 1HG1 ILE 135 16.209 8.744 0.710 875 2HG1 ILE 135 2HG1 ILE 135 14.994 7.460 0.580 876 1HG2 ILE 135 1HG2 ILE 135 12.714 8.478 -0.776 877 2HG2 ILE 135 2HG2 ILE 135 12.708 7.896 0.914 878 3HG2 ILE 135 3HG2 ILE 135 11.974 9.432 0.520 879 1HD1 ILE 135 1HD1 ILE 135 16.061 9.165 -1.688 880 2HD1 ILE 135 2HD1 ILE 135 16.320 7.443 -1.400 881 3HD1 ILE 135 3HD1 ILE 135 14.703 8.020 -1.844 882 H LYS 136 H LYS 136 12.467 11.323 -1.861 883 HA LYS 136 HA LYS 136 10.558 11.885 0.122 884 1HB LYS 136 1HB LYS 136 10.032 14.317 -0.726 885 2HB LYS 136 2HB LYS 136 11.170 13.932 0.548 886 1HG LYS 136 1HG LYS 136 12.981 13.983 -1.389 887 2HG LYS 136 2HG LYS 136 11.736 14.882 -2.258 888 1HD LYS 136 1HD LYS 136 11.647 16.538 -0.470 889 2HD LYS 136 2HD LYS 136 12.619 15.526 0.605 890 1HE LYS 136 1HE LYS 136 13.674 16.708 -2.005 891 2HE LYS 136 2HE LYS 136 13.875 17.458 -0.414 892 1HZ LYS 136 1HZ LYS 136 14.930 14.779 -1.137 893 2HZ LYS 136 2HZ LYS 136 15.796 16.165 -0.994 894 3HZ LYS 136 3HZ LYS 136 15.087 15.489 0.317 895 H THR 137 H THR 137 10.678 9.962 -1.858 896 HA THR 137 HA THR 137 8.104 10.509 -3.108 897 HB THR 137 HB THR 137 8.914 9.181 -5.086 898 HG1 THR 137 HG1 THR 137 10.891 8.532 -4.132 899 1HG2 THR 137 1HG2 THR 137 9.758 11.170 -6.253 900 2HG2 THR 137 2HG2 THR 137 8.436 11.554 -5.117 901 3HG2 THR 137 3HG2 THR 137 10.116 11.941 -4.683 902 H LEU 138 H LEU 138 7.248 9.235 -1.486 903 HA LEU 138 HA LEU 138 8.795 6.876 -0.664 904 1HB LEU 138 1HB LEU 138 7.404 8.733 0.653 905 2HB LEU 138 2HB LEU 138 6.134 7.486 0.550 906 HG LEU 138 HG LEU 138 8.133 5.937 1.334 907 1HD1 LEU 138 1HD1 LEU 138 9.702 7.004 2.859 908 2HD1 LEU 138 2HD1 LEU 138 9.907 7.641 1.217 909 3HD1 LEU 138 3HD1 LEU 138 9.045 8.603 2.434 910 1HD2 LEU 138 1HD2 LEU 138 6.132 6.284 2.748 911 2HD2 LEU 138 2HD2 LEU 138 7.605 6.286 3.722 912 3HD2 LEU 138 3HD2 LEU 138 6.793 7.803 3.361 913 H THR 139 H THR 139 8.104 4.663 -0.767 914 HA THR 139 HA THR 139 5.707 4.147 -2.297 915 HB THR 139 HB THR 139 7.187 4.549 -4.140 916 HG1 THR 139 HG1 THR 139 6.032 2.684 -4.483 917 1HG2 THR 139 1HG2 THR 139 9.125 2.659 -2.808 918 2HG2 THR 139 2HG2 THR 139 9.284 3.351 -4.438 919 3HG2 THR 139 3HG2 THR 139 9.329 4.427 -3.015 920 H LEU 140 H LEU 140 5.130 2.015 -2.303 921 HA LEU 140 HA LEU 140 6.961 0.159 -1.122 922 1HB LEU 140 1HB LEU 140 5.374 -1.379 -0.341 923 2HB LEU 140 2HB LEU 140 5.209 0.161 0.521 924 HG LEU 140 HG LEU 140 3.068 -0.584 0.326 925 1HD1 LEU 140 1HD1 LEU 140 3.238 1.101 -2.180 926 2HD1 LEU 140 2HD1 LEU 140 1.871 0.941 -1.064 927 3HD1 LEU 140 3HD1 LEU 140 3.362 1.757 -0.539 928 1HD2 LEU 140 1HD2 LEU 140 3.498 -2.463 -1.197 929 2HD2 LEU 140 2HD2 LEU 140 2.017 -1.568 -1.604 930 3HD2 LEU 140 3HD2 LEU 140 3.478 -1.353 -2.579 931 H SER 141 H SER 141 7.188 -1.637 -2.395 932 HA SER 141 HA SER 141 5.810 -1.695 -5.041 933 1HB SER 141 1HB SER 141 8.305 -1.640 -5.131 934 2HB SER 141 2HB SER 141 8.340 -3.134 -4.163 935 HG SER 141 HG SER 141 7.296 -2.691 -6.756 936 H TYR 142 H TYR 142 4.104 -3.050 -4.947 937 HA TYR 142 HA TYR 142 4.002 -5.186 -2.885 938 1HB TYR 142 1HB TYR 142 2.156 -3.211 -3.386 939 2HB TYR 142 2HB TYR 142 1.549 -4.465 -4.437 940 HD1 TYR 142 HD1 TYR 142 2.342 -6.885 -2.538 941 HD2 TYR 142 HD2 TYR 142 0.245 -3.153 -1.954 942 HE1 TYR 142 HE1 TYR 142 1.163 -7.837 -0.599 943 HE2 TYR 142 HE2 TYR 142 -0.982 -4.160 -0.054 944 HH TYR 142 HH TYR 142 -0.954 -7.600 0.602 945 H THR 143 H THR 143 4.309 -7.214 -3.624 946 HA THR 143 HA THR 143 3.862 -7.787 -6.517 947 HB THR 143 HB THR 143 5.698 -9.312 -4.641 948 HG1 THR 143 HG1 THR 143 7.355 -7.974 -5.429 949 1HG2 THR 143 1HG2 THR 143 5.734 -8.817 -7.663 950 2HG2 THR 143 2HG2 THR 143 6.763 -9.947 -6.762 951 3HG2 THR 143 3HG2 THR 143 5.017 -10.250 -6.907 952 H PHE 144 H PHE 144 1.685 -8.219 -6.267 953 HA PHE 144 HA PHE 144 0.705 -10.324 -4.479 954 1HB PHE 144 1HB PHE 144 -0.375 -8.683 -6.726 955 2HB PHE 144 2HB PHE 144 -1.068 -10.273 -6.476 956 HD1 PHE 144 HD1 PHE 144 -3.245 -9.320 -6.161 957 HD2 PHE 144 HD2 PHE 144 0.030 -8.208 -3.576 958 HE1 PHE 144 HE1 PHE 144 -4.851 -8.712 -4.370 959 HE2 PHE 144 HE2 PHE 144 -1.598 -7.606 -1.811 960 HZ PHE 144 HZ PHE 144 -4.018 -7.859 -2.192 961 H TYR 145 H TYR 145 2.443 -11.837 -4.779 962 HA TYR 145 HA TYR 145 1.770 -13.743 -6.957 963 1HB TYR 145 1HB TYR 145 3.939 -14.015 -7.723 964 2HB TYR 145 2HB TYR 145 3.616 -12.286 -7.719 965 HD1 TYR 145 HD1 TYR 145 6.275 -13.279 -8.149 966 HD2 TYR 145 HD2 TYR 145 4.318 -12.488 -4.377 967 HE1 TYR 145 HE1 TYR 145 8.463 -12.855 -7.084 968 HE2 TYR 145 HE2 TYR 145 6.490 -12.030 -3.346 969 HH TYR 145 HH TYR 145 9.568 -12.264 -5.144 970 HA PRO 146 HA PRO 146 2.744 -16.090 -3.026 971 1HB PRO 146 1HB PRO 146 0.315 -16.689 -1.965 972 2HB PRO 146 2HB PRO 146 1.164 -15.158 -1.690 973 1HG PRO 146 1HG PRO 146 -1.024 -15.644 -3.720 974 2HG PRO 146 2HG PRO 146 -0.895 -14.336 -2.522 975 1HD PRO 146 1HD PRO 146 -0.051 -14.028 -5.117 976 2HD PRO 146 2HD PRO 146 0.753 -13.217 -3.733 977 H ARG 147 H ARG 147 -0.368 -17.595 -3.692 978 HA ARG 147 HA ARG 147 0.804 -19.392 -5.730 979 1HB ARG 147 1HB ARG 147 0.012 -20.316 -2.939 980 2HB ARG 147 2HB ARG 147 0.259 -21.396 -4.310 981 1HG ARG 147 1HG ARG 147 2.416 -19.617 -3.084 982 2HG ARG 147 2HG ARG 147 2.178 -21.328 -2.761 983 1HD ARG 147 1HD ARG 147 2.589 -21.911 -5.098 984 2HD ARG 147 2HD ARG 147 2.823 -20.233 -5.550 985 HE ARG 147 HE ARG 147 4.647 -22.003 -4.100 986 1HH1 ARG 147 1HH1 ARG 147 3.964 -18.596 -4.882 987 2HH1 ARG 147 2HH1 ARG 147 5.609 -18.086 -4.767 988 1HH2 ARG 147 1HH2 ARG 147 6.833 -21.326 -3.896 989 2HH2 ARG 147 2HH2 ARG 147 7.267 -19.667 -4.150 990 H GLU 148 H GLU 148 -0.704 -19.829 -7.168 991 HA GLU 148 HA GLU 148 -3.548 -19.709 -6.374 992 1HB GLU 148 1HB GLU 148 -4.065 -18.945 -8.575 993 2HB GLU 148 2HB GLU 148 -2.739 -17.949 -7.961 994 1HG GLU 148 1HG GLU 148 -1.127 -19.221 -9.331 995 2HG GLU 148 2HG GLU 148 -2.458 -20.198 -9.977 996 HA PRO 149 HA PRO 149 -3.385 -24.036 -7.725 997 1HB PRO 149 1HB PRO 149 -6.056 -24.573 -7.984 998 2HB PRO 149 2HB PRO 149 -5.235 -24.434 -6.400 999 1HG PRO 149 1HG PRO 149 -6.903 -22.379 -7.825 1000 2HG PRO 149 2HG PRO 149 -6.921 -22.791 -6.091 1001 1HD PRO 149 1HD PRO 149 -5.571 -20.627 -7.161 1002 2HD PRO 149 2HD PRO 149 -5.027 -21.476 -5.681 1003 H SER 150 H SER 150 -5.760 -21.822 -9.326 1004 HA SER 150 HA SER 150 -4.545 -21.752 -11.825 1005 1HB SER 150 1HB SER 150 -6.228 -23.084 -13.141 1006 2HB SER 150 2HB SER 150 -5.231 -24.113 -12.120 1007 HG SER 150 HG SER 150 -6.953 -24.006 -10.553 1008 H LYS 151 H LYS 151 -6.243 -20.745 -13.396 1009 HA LYS 151 HA LYS 151 -8.643 -19.585 -12.149 1010 1HB LYS 151 1HB LYS 151 -7.948 -17.313 -13.159 1011 2HB LYS 151 2HB LYS 151 -7.292 -17.797 -11.599 1012 1HG LYS 151 1HG LYS 151 -5.175 -18.281 -12.403 1013 2HG LYS 151 2HG LYS 151 -5.697 -18.462 -14.086 1014 1HD LYS 151 1HD LYS 151 -5.820 -16.216 -14.495 1015 2HD LYS 151 2HD LYS 151 -6.033 -15.774 -12.788 1016 1HE LYS 151 1HE LYS 151 -3.730 -16.356 -12.258 1017 2HE LYS 151 2HE LYS 151 -3.440 -16.980 -13.886 1018 1HZ LYS 151 1HZ LYS 151 -2.530 -14.815 -13.524 1019 2HZ LYS 151 2HZ LYS 151 -3.701 -14.720 -14.682 1020 3HZ LYS 151 3HZ LYS 151 -3.996 -14.180 -13.147 Start of MODEL 8 1 H VAL 21 H VAL 21 -0.623 10.699 14.148 2 HA VAL 21 HA VAL 21 -2.178 8.741 15.818 3 HB VAL 21 HB VAL 21 -3.418 11.273 14.790 4 1HG1 VAL 21 1HG1 VAL 21 -4.616 11.149 16.926 5 2HG1 VAL 21 2HG1 VAL 21 -4.679 9.551 16.177 6 3HG1 VAL 21 3HG1 VAL 21 -3.543 9.859 17.497 7 1HG2 VAL 21 1HG2 VAL 21 -1.376 12.270 15.656 8 2HG2 VAL 21 2HG2 VAL 21 -2.685 12.551 16.799 9 3HG2 VAL 21 3HG2 VAL 21 -1.482 11.291 17.139 10 H GLU 22 H GLU 22 -4.608 9.029 14.356 11 HA GLU 22 HA GLU 22 -3.967 8.337 11.553 12 1HB GLU 22 1HB GLU 22 -5.919 7.345 12.855 13 2HB GLU 22 2HB GLU 22 -6.684 8.940 12.780 14 1HG GLU 22 1HG GLU 22 -6.649 8.824 10.296 15 2HG GLU 22 2HG GLU 22 -5.766 7.294 10.375 16 H GLN 23 H GLN 23 -2.591 10.508 12.084 17 HA GLN 23 HA GLN 23 -3.181 12.554 10.534 18 1HB GLN 23 1HB GLN 23 -4.880 12.793 12.937 19 2HB GLN 23 2HB GLN 23 -3.699 14.088 12.933 20 1HG GLN 23 1HG GLN 23 -5.485 13.345 10.594 21 2HG GLN 23 2HG GLN 23 -5.727 14.739 11.673 22 1HE2 GLN 23 1HE2 GLN 23 -4.484 13.907 8.670 23 2HE2 GLN 23 2HE2 GLN 23 -3.183 15.085 8.550 24 H ALA 24 H ALA 24 -1.772 14.477 11.023 25 HA ALA 24 HA ALA 24 0.371 14.119 13.003 26 1HB ALA 24 1HB ALA 24 0.801 13.835 10.014 27 2HB ALA 24 2HB ALA 24 2.126 14.040 11.188 28 3HB ALA 24 3HB ALA 24 1.085 12.604 11.235 29 H SER 25 H SER 25 -1.733 16.233 11.916 30 HA SER 25 HA SER 25 -0.166 18.491 11.193 31 1HB SER 25 1HB SER 25 -2.742 17.985 10.800 32 2HB SER 25 2HB SER 25 -2.924 18.760 12.376 33 HG SER 25 HG SER 25 -3.050 20.282 10.714 34 H ASP 26 H ASP 26 0.481 17.157 13.887 35 HA ASP 26 HA ASP 26 0.692 19.631 15.509 36 1HB ASP 26 1HB ASP 26 2.046 16.899 15.591 37 2HB ASP 26 2HB ASP 26 2.466 18.253 16.658 38 H LEU 27 H LEU 27 2.211 17.773 12.899 39 HA LEU 27 HA LEU 27 4.529 19.625 12.789 40 1HB LEU 27 1HB LEU 27 4.102 16.801 11.786 41 2HB LEU 27 2HB LEU 27 5.453 17.828 11.328 42 HG LEU 27 HG LEU 27 6.103 16.265 13.024 43 1HD1 LEU 27 1HD1 LEU 27 6.151 19.057 14.222 44 2HD1 LEU 27 2HD1 LEU 27 7.287 17.730 14.503 45 3HD1 LEU 27 3HD1 LEU 27 7.209 18.495 12.906 46 1HD2 LEU 27 1HD2 LEU 27 3.870 16.139 14.189 47 2HD2 LEU 27 2HD2 LEU 27 5.314 16.139 15.218 48 3HD2 LEU 27 3HD2 LEU 27 4.351 17.614 15.070 49 H ILE 28 H ILE 28 2.039 18.173 10.739 50 HA ILE 28 HA ILE 28 2.655 18.288 8.322 51 HB ILE 28 HB ILE 28 0.128 19.588 9.301 52 1HG1 ILE 28 1HG1 ILE 28 0.877 17.041 7.750 53 2HG1 ILE 28 2HG1 ILE 28 0.579 17.145 9.469 54 1HG2 ILE 28 1HG2 ILE 28 0.490 20.686 7.122 55 2HG2 ILE 28 2HG2 ILE 28 0.842 19.090 6.405 56 3HG2 ILE 28 3HG2 ILE 28 -0.775 19.477 7.022 57 1HD1 ILE 28 1HD1 ILE 28 -1.420 17.351 7.227 58 2HD1 ILE 28 2HD1 ILE 28 -1.426 16.291 8.651 59 3HD1 ILE 28 3HD1 ILE 28 -1.778 18.024 8.827 60 H LEU 29 H LEU 29 3.834 19.214 6.912 61 HA LEU 29 HA LEU 29 4.761 21.930 7.513 62 1HB LEU 29 1HB LEU 29 6.010 19.616 6.037 63 2HB LEU 29 2HB LEU 29 6.772 21.183 6.310 64 HG LEU 29 HG LEU 29 6.312 20.750 8.857 65 1HD1 LEU 29 1HD1 LEU 29 6.253 17.920 7.754 66 2HD1 LEU 29 2HD1 LEU 29 6.506 18.370 9.450 67 3HD1 LEU 29 3HD1 LEU 29 4.952 18.660 8.699 68 1HD2 LEU 29 1HD2 LEU 29 8.476 19.623 9.021 69 2HD2 LEU 29 2HD2 LEU 29 8.411 19.219 7.290 70 3HD2 LEU 29 3HD2 LEU 29 8.506 20.917 7.813 71 H ASP 30 H ASP 30 6.030 22.738 5.304 72 HA ASP 30 HA ASP 30 3.978 23.765 3.561 73 1HB ASP 30 1HB ASP 30 5.883 24.975 2.606 74 2HB ASP 30 2HB ASP 30 5.821 25.158 4.365 75 H GLU 31 H GLU 31 6.852 21.662 3.301 76 HA GLU 31 HA GLU 31 6.686 21.195 0.546 77 1HB GLU 31 1HB GLU 31 8.196 20.092 2.797 78 2HB GLU 31 2HB GLU 31 7.711 18.777 1.713 79 1HG GLU 31 1HG GLU 31 9.092 21.307 0.745 80 2HG GLU 31 2HG GLU 31 9.947 19.860 1.293 81 H LYS 32 H LYS 32 6.139 19.486 -0.753 82 HA LYS 32 HA LYS 32 3.790 17.928 0.077 83 1HB LYS 32 1HB LYS 32 3.508 19.763 -1.587 84 2HB LYS 32 2HB LYS 32 4.785 19.073 -2.605 85 1HG LYS 32 1HG LYS 32 2.765 17.145 -1.697 86 2HG LYS 32 2HG LYS 32 2.080 18.496 -2.586 87 1HD LYS 32 1HD LYS 32 4.491 17.096 -3.819 88 2HD LYS 32 2HD LYS 32 3.021 16.170 -3.722 89 1HE LYS 32 1HE LYS 32 3.048 17.262 -5.871 90 2HE LYS 32 2HE LYS 32 1.775 18.007 -4.901 91 1HZ LYS 32 1HZ LYS 32 3.286 19.787 -4.369 92 2HZ LYS 32 2HZ LYS 32 4.461 19.126 -5.315 93 3HZ LYS 32 3HZ LYS 32 3.057 19.662 -5.998 94 H ILE 33 H ILE 33 4.810 16.017 0.729 95 HA ILE 33 HA ILE 33 6.918 14.854 -1.025 96 HB ILE 33 HB ILE 33 7.438 14.752 1.186 97 1HG1 ILE 33 1HG1 ILE 33 7.830 12.832 -0.534 98 2HG1 ILE 33 2HG1 ILE 33 8.313 12.644 1.162 99 1HG2 ILE 33 1HG2 ILE 33 5.284 14.760 2.311 100 2HG2 ILE 33 2HG2 ILE 33 4.973 13.118 1.746 101 3HG2 ILE 33 3HG2 ILE 33 6.304 13.429 2.875 102 1HD1 ILE 33 1HD1 ILE 33 7.133 10.678 0.090 103 2HD1 ILE 33 2HD1 ILE 33 6.423 11.260 1.609 104 3HD1 ILE 33 3HD1 ILE 33 5.672 11.696 0.062 105 H LYS 34 H LYS 34 6.485 13.694 -2.682 106 HA LYS 34 HA LYS 34 3.745 13.074 -3.560 107 1HB LYS 34 1HB LYS 34 5.903 13.923 -4.826 108 2HB LYS 34 2HB LYS 34 6.283 12.204 -4.912 109 1HG LYS 34 1HG LYS 34 3.624 13.380 -5.840 110 2HG LYS 34 2HG LYS 34 5.068 13.308 -6.881 111 1HD LYS 34 1HD LYS 34 5.115 10.828 -6.553 112 2HD LYS 34 2HD LYS 34 3.741 10.994 -5.539 113 1HE LYS 34 1HE LYS 34 3.232 10.230 -7.802 114 2HE LYS 34 2HE LYS 34 2.214 11.536 -7.053 115 1HZ LYS 34 1HZ LYS 34 3.172 13.032 -8.545 116 2HZ LYS 34 2HZ LYS 34 4.142 11.843 -9.218 117 3HZ LYS 34 3HZ LYS 34 2.484 11.693 -9.254 118 H VAL 35 H VAL 35 2.974 10.760 -3.782 119 HA VAL 35 HA VAL 35 4.827 8.735 -2.634 120 HB VAL 35 HB VAL 35 1.931 9.357 -2.018 121 1HG1 VAL 35 1HG1 VAL 35 2.052 6.928 -2.560 122 2HG1 VAL 35 2HG1 VAL 35 3.305 6.741 -1.315 123 3HG1 VAL 35 3HG1 VAL 35 1.652 7.242 -0.884 124 1HG2 VAL 35 1HG2 VAL 35 2.564 9.314 0.316 125 2HG2 VAL 35 2HG2 VAL 35 4.223 8.813 -0.117 126 3HG2 VAL 35 3HG2 VAL 35 3.612 10.422 -0.551 127 H THR 36 H THR 36 4.677 6.817 -3.772 128 HA THR 36 HA THR 36 2.897 6.792 -6.148 129 HB THR 36 HB THR 36 5.945 6.810 -6.236 130 HG1 THR 36 HG1 THR 36 3.958 8.608 -6.552 131 1HG2 THR 36 1HG2 THR 36 3.946 6.200 -8.446 132 2HG2 THR 36 2HG2 THR 36 5.674 6.562 -8.687 133 3HG2 THR 36 3HG2 THR 36 5.200 5.114 -7.786 134 H PHE 37 H PHE 37 1.839 5.097 -5.585 135 HA PHE 37 HA PHE 37 3.067 2.955 -4.037 136 1HB PHE 37 1HB PHE 37 0.357 3.095 -5.430 137 2HB PHE 37 2HB PHE 37 0.864 1.946 -4.217 138 HD1 PHE 37 HD1 PHE 37 -1.074 4.795 -4.644 139 HD2 PHE 37 HD2 PHE 37 1.818 3.074 -1.930 140 HE1 PHE 37 HE1 PHE 37 -1.939 6.200 -2.811 141 HE2 PHE 37 HE2 PHE 37 0.978 4.545 -0.116 142 HZ PHE 37 HZ PHE 37 -0.850 6.161 -0.581 143 H ASP 38 H ASP 38 3.149 0.654 -4.737 144 HA ASP 38 HA ASP 38 2.807 0.177 -7.659 145 1HB ASP 38 1HB ASP 38 5.189 0.423 -7.404 146 2HB ASP 38 2HB ASP 38 5.192 -0.447 -5.904 147 H ALA 39 H ALA 39 0.697 -0.396 -6.957 148 HA ALA 39 HA ALA 39 0.466 -3.066 -5.672 149 1HB ALA 39 1HB ALA 39 -1.307 -1.458 -5.226 150 2HB ALA 39 2HB ALA 39 -1.532 -1.167 -6.963 151 3HB ALA 39 3HB ALA 39 -1.947 -2.737 -6.279 152 H ASN 40 H ASN 40 1.896 -4.153 -7.153 153 HA ASN 40 HA ASN 40 0.887 -4.550 -9.940 154 1HB ASN 40 1HB ASN 40 2.902 -6.030 -10.173 155 2HB ASN 40 2HB ASN 40 3.299 -4.377 -9.860 156 1HD2 ASN 40 1HD2 ASN 40 4.134 -3.821 -7.875 157 2HD2 ASN 40 2HD2 ASN 40 4.884 -5.016 -6.812 158 H VAL 41 H VAL 41 0.452 -6.741 -10.649 159 HA VAL 41 HA VAL 41 0.052 -8.761 -8.556 160 HB VAL 41 HB VAL 41 -2.056 -7.755 -8.555 161 1HG1 VAL 41 1HG1 VAL 41 -3.536 -7.475 -10.473 162 2HG1 VAL 41 2HG1 VAL 41 -2.077 -6.501 -10.682 163 3HG1 VAL 41 3HG1 VAL 41 -2.271 -8.022 -11.581 164 1HG2 VAL 41 1HG2 VAL 41 -1.909 -10.220 -8.542 165 2HG2 VAL 41 2HG2 VAL 41 -3.472 -9.598 -9.100 166 3HG2 VAL 41 3HG2 VAL 41 -2.306 -10.235 -10.274 167 H ALA 42 H ALA 42 1.296 -10.293 -9.175 168 HA ALA 42 HA ALA 42 1.429 -11.117 -12.052 169 1HB ALA 42 1HB ALA 42 2.871 -12.316 -9.680 170 2HB ALA 42 2HB ALA 42 3.173 -12.637 -11.394 171 3HB ALA 42 3HB ALA 42 3.549 -11.038 -10.718 172 H ALA 43 H ALA 43 1.093 -13.440 -12.484 173 HA ALA 43 HA ALA 43 -1.466 -14.258 -12.080 174 1HB ALA 43 1HB ALA 43 0.048 -15.183 -13.786 175 2HB ALA 43 2HB ALA 43 0.942 -16.068 -12.527 176 3HB ALA 43 3HB ALA 43 -0.750 -16.476 -12.870 177 H GLY 44 H GLY 44 1.269 -15.174 -10.064 178 1HA GLY 44 1HA GLY 44 0.340 -17.064 -8.341 179 2HA GLY 44 2HA GLY 44 1.408 -15.756 -7.850 180 H LEU 45 H LEU 45 -0.803 -13.680 -8.379 181 HA LEU 45 HA LEU 45 -2.885 -14.587 -6.454 182 1HB LEU 45 1HB LEU 45 -1.109 -12.412 -6.074 183 2HB LEU 45 2HB LEU 45 -2.635 -11.694 -6.513 184 HG LEU 45 HG LEU 45 -2.610 -13.892 -4.369 185 1HD1 LEU 45 1HD1 LEU 45 -1.667 -11.064 -4.276 186 2HD1 LEU 45 2HD1 LEU 45 -2.752 -11.529 -2.981 187 3HD1 LEU 45 3HD1 LEU 45 -1.217 -12.392 -3.240 188 1HD2 LEU 45 1HD2 LEU 45 -4.633 -12.868 -3.789 189 2HD2 LEU 45 2HD2 LEU 45 -4.376 -11.510 -4.927 190 3HD2 LEU 45 3HD2 LEU 45 -4.680 -13.161 -5.539 191 HA PRO 46 HA PRO 46 -4.449 -13.737 -10.639 192 1HB PRO 46 1HB PRO 46 -6.325 -15.666 -10.860 193 2HB PRO 46 2HB PRO 46 -4.584 -16.072 -10.752 194 1HG PRO 46 1HG PRO 46 -6.587 -16.031 -8.477 195 2HG PRO 46 2HG PRO 46 -5.512 -17.382 -8.955 196 1HD PRO 46 1HD PRO 46 -4.844 -15.587 -7.000 197 2HD PRO 46 2HD PRO 46 -3.603 -16.269 -8.091 198 H TRP 47 H TRP 47 -5.094 -11.863 -8.748 199 HA TRP 47 HA TRP 47 -8.070 -11.774 -8.515 200 1HB TRP 47 1HB TRP 47 -5.915 -10.753 -6.660 201 2HB TRP 47 2HB TRP 47 -7.614 -10.297 -6.552 202 HD1 TRP 47 HD1 TRP 47 -7.546 -13.867 -7.441 203 HE1 TRP 47 HE1 TRP 47 -7.918 -15.344 -5.451 204 HE3 TRP 47 HE3 TRP 47 -6.477 -10.560 -3.664 205 HZ2 TRP 47 HZ2 TRP 47 -7.962 -15.174 -2.633 206 HZ3 TRP 47 HZ3 TRP 47 -6.026 -11.702 -1.487 207 HH2 TRP 47 HH2 TRP 47 -7.249 -13.668 -0.804 208 H GLU 48 H GLU 48 -9.098 -9.817 -8.914 209 HA GLU 48 HA GLU 48 -7.755 -7.986 -10.797 210 1HB GLU 48 1HB GLU 48 -10.197 -8.698 -10.872 211 2HB GLU 48 2HB GLU 48 -10.418 -7.850 -9.346 212 1HG GLU 48 1HG GLU 48 -9.716 -5.717 -10.544 213 2HG GLU 48 2HG GLU 48 -9.879 -6.627 -12.054 214 H PHE 49 H PHE 49 -6.005 -7.519 -9.240 215 HA PHE 49 HA PHE 49 -6.644 -5.931 -6.852 216 1HB PHE 49 1HB PHE 49 -4.922 -7.630 -6.700 217 2HB PHE 49 2HB PHE 49 -4.034 -6.854 -8.013 218 HD1 PHE 49 HD1 PHE 49 -5.649 -5.239 -4.975 219 HD2 PHE 49 HD2 PHE 49 -1.963 -6.268 -6.991 220 HE1 PHE 49 HE1 PHE 49 -4.352 -4.060 -3.249 221 HE2 PHE 49 HE2 PHE 49 -0.684 -5.237 -5.180 222 HZ PHE 49 HZ PHE 49 -1.860 -4.040 -3.342 223 H VAL 50 H VAL 50 -7.272 -3.867 -7.339 224 HA VAL 50 HA VAL 50 -5.922 -2.530 -9.627 225 HB VAL 50 HB VAL 50 -7.783 -1.095 -9.825 226 1HG1 VAL 50 1HG1 VAL 50 -9.503 -2.686 -10.422 227 2HG1 VAL 50 2HG1 VAL 50 -7.932 -3.442 -10.753 228 3HG1 VAL 50 3HG1 VAL 50 -8.860 -3.895 -9.303 229 1HG2 VAL 50 1HG2 VAL 50 -9.834 -1.435 -8.367 230 2HG2 VAL 50 2HG2 VAL 50 -8.784 -2.340 -7.254 231 3HG2 VAL 50 3HG2 VAL 50 -8.484 -0.615 -7.572 232 HA PRO 51 HA PRO 51 -4.212 0.417 -6.564 233 1HB PRO 51 1HB PRO 51 -3.130 2.226 -8.312 234 2HB PRO 51 2HB PRO 51 -2.323 0.680 -7.946 235 1HG PRO 51 1HG PRO 51 -4.071 1.348 -10.318 236 2HG PRO 51 2HG PRO 51 -2.501 0.494 -10.319 237 1HD PRO 51 1HD PRO 51 -4.917 -0.779 -10.416 238 2HD PRO 51 2HD PRO 51 -3.510 -1.518 -9.592 239 H VAL 52 H VAL 52 -5.296 2.206 -5.795 240 HA VAL 52 HA VAL 52 -7.824 2.869 -6.988 241 HB VAL 52 HB VAL 52 -7.529 2.495 -4.704 242 1HG1 VAL 52 1HG1 VAL 52 -6.522 4.130 -3.236 243 2HG1 VAL 52 2HG1 VAL 52 -5.346 3.600 -4.461 244 3HG1 VAL 52 3HG1 VAL 52 -6.172 5.171 -4.620 245 1HG2 VAL 52 1HG2 VAL 52 -9.493 3.697 -5.463 246 2HG2 VAL 52 2HG2 VAL 52 -8.961 4.332 -3.897 247 3HG2 VAL 52 3HG2 VAL 52 -8.620 5.248 -5.381 248 H GLN 53 H GLN 53 -4.927 4.682 -6.259 249 HA GLN 53 HA GLN 53 -5.017 5.934 -8.882 250 1HB GLN 53 1HB GLN 53 -4.159 7.487 -6.404 251 2HB GLN 53 2HB GLN 53 -3.895 7.961 -8.062 252 1HG GLN 53 1HG GLN 53 -5.744 9.236 -7.467 253 2HG GLN 53 2HG GLN 53 -6.392 7.938 -8.479 254 1HE2 GLN 53 1HE2 GLN 53 -5.449 8.033 -5.001 255 2HE2 GLN 53 2HE2 GLN 53 -7.039 7.589 -4.407 256 H ARG 54 H ARG 54 -2.651 6.207 -9.530 257 HA ARG 54 HA ARG 54 -1.066 4.034 -8.447 258 1HB ARG 54 1HB ARG 54 -0.925 4.826 -10.850 259 2HB ARG 54 2HB ARG 54 -0.188 6.320 -10.269 260 1HG ARG 54 1HG ARG 54 1.628 4.974 -10.936 261 2HG ARG 54 2HG ARG 54 1.633 4.837 -9.180 262 1HD ARG 54 1HD ARG 54 0.246 2.736 -9.547 263 2HD ARG 54 2HD ARG 54 0.656 2.919 -11.235 264 HE ARG 54 HE ARG 54 2.468 2.444 -8.872 265 1HH1 ARG 54 1HH1 ARG 54 2.282 2.503 -12.387 266 2HH1 ARG 54 2HH1 ARG 54 3.589 1.386 -12.636 267 1HH2 ARG 54 1HH2 ARG 54 4.131 0.910 -9.144 268 2HH2 ARG 54 2HH2 ARG 54 4.690 0.467 -10.717 269 H ASP 55 H ASP 55 -0.970 7.667 -8.232 270 HA ASP 55 HA ASP 55 0.822 7.531 -5.923 271 1HB ASP 55 1HB ASP 55 1.505 9.616 -6.878 272 2HB ASP 55 2HB ASP 55 1.965 8.248 -7.919 273 H ILE 56 H ILE 56 0.806 9.579 -4.770 274 HA ILE 56 HA ILE 56 -1.602 11.189 -4.824 275 HB ILE 56 HB ILE 56 -2.123 11.112 -2.477 276 1HG1 ILE 56 1HG1 ILE 56 -0.110 8.870 -2.421 277 2HG1 ILE 56 2HG1 ILE 56 0.090 10.486 -1.682 278 1HG2 ILE 56 1HG2 ILE 56 -3.243 8.998 -2.383 279 2HG2 ILE 56 2HG2 ILE 56 -3.298 9.568 -4.060 280 3HG2 ILE 56 3HG2 ILE 56 -2.132 8.300 -3.586 281 1HD1 ILE 56 1HD1 ILE 56 -1.901 9.977 -0.226 282 2HD1 ILE 56 2HD1 ILE 56 -1.811 8.295 -0.780 283 3HD1 ILE 56 3HD1 ILE 56 -0.451 9.029 0.094 284 H ASP 57 H ASP 57 -1.243 13.000 -3.086 285 HA ASP 57 HA ASP 57 1.634 13.713 -2.767 286 1HB ASP 57 1HB ASP 57 -0.794 15.478 -3.357 287 2HB ASP 57 2HB ASP 57 0.764 16.088 -2.814 288 H VAL 58 H VAL 58 2.102 13.924 -0.583 289 HA VAL 58 HA VAL 58 -0.152 14.476 1.333 290 HB VAL 58 HB VAL 58 0.631 13.096 2.939 291 1HG1 VAL 58 1HG1 VAL 58 -0.696 12.127 1.000 292 2HG1 VAL 58 2HG1 VAL 58 0.822 11.439 0.397 293 3HG1 VAL 58 3HG1 VAL 58 0.191 10.943 1.978 294 1HG2 VAL 58 1HG2 VAL 58 2.506 11.513 2.679 295 2HG2 VAL 58 2HG2 VAL 58 2.989 12.355 1.197 296 3HG2 VAL 58 3HG2 VAL 58 3.025 13.197 2.784 297 H ARG 59 H ARG 59 0.114 16.431 2.311 298 HA ARG 59 HA ARG 59 2.707 17.792 2.370 299 1HB ARG 59 1HB ARG 59 0.078 18.330 3.801 300 2HB ARG 59 2HB ARG 59 1.546 19.263 4.046 301 1HG ARG 59 1HG ARG 59 0.182 18.950 1.338 302 2HG ARG 59 2HG ARG 59 -0.126 20.254 2.493 303 1HD ARG 59 1HD ARG 59 2.603 20.415 2.419 304 2HD ARG 59 2HD ARG 59 2.323 19.739 0.829 305 HE ARG 59 HE ARG 59 1.377 21.713 0.127 306 1HH1 ARG 59 1HH1 ARG 59 2.028 21.926 3.651 307 2HH1 ARG 59 2HH1 ARG 59 1.412 23.528 3.784 308 1HH2 ARG 59 1HH2 ARG 59 0.827 23.934 0.306 309 2HH2 ARG 59 2HH2 ARG 59 0.883 24.740 1.841 310 H ILE 60 H ILE 60 3.764 15.890 3.134 311 HA ILE 60 HA ILE 60 4.707 14.536 4.749 312 HB ILE 60 HB ILE 60 5.252 17.267 5.877 313 1HG1 ILE 60 1HG1 ILE 60 6.745 15.940 3.598 314 2HG1 ILE 60 2HG1 ILE 60 5.532 17.173 3.314 315 1HG2 ILE 60 1HG2 ILE 60 7.014 14.763 5.559 316 2HG2 ILE 60 2HG2 ILE 60 7.398 16.225 6.485 317 3HG2 ILE 60 3HG2 ILE 60 6.149 15.124 7.045 318 1HD1 ILE 60 1HD1 ILE 60 8.114 17.767 3.604 319 2HD1 ILE 60 2HD1 ILE 60 6.783 18.862 4.079 320 3HD1 ILE 60 3HD1 ILE 60 7.652 17.926 5.292 321 H GLY 61 H GLY 61 2.247 14.029 5.500 322 1HA GLY 61 1HA GLY 61 1.841 13.272 7.920 323 2HA GLY 61 2HA GLY 61 1.765 14.992 8.301 324 H GLU 62 H GLU 62 0.485 15.547 5.645 325 HA GLU 62 HA GLU 62 -2.246 15.411 6.150 326 1HB GLU 62 1HB GLU 62 -1.035 16.619 4.369 327 2HB GLU 62 2HB GLU 62 -0.862 15.087 3.484 328 1HG GLU 62 1HG GLU 62 -3.295 14.987 3.174 329 2HG GLU 62 2HG GLU 62 -3.502 16.440 4.180 330 H THR 63 H THR 63 -3.588 13.713 6.534 331 HA THR 63 HA THR 63 -2.891 10.970 5.814 332 HB THR 63 HB THR 63 -5.067 10.665 7.209 333 HG1 THR 63 HG1 THR 63 -5.764 12.798 6.816 334 1HG2 THR 63 1HG2 THR 63 -3.950 11.035 9.252 335 2HG2 THR 63 2HG2 THR 63 -2.865 10.287 8.098 336 3HG2 THR 63 3HG2 THR 63 -2.666 12.015 8.458 337 H VAL 64 H VAL 64 -3.382 10.418 3.718 338 HA VAL 64 HA VAL 64 -5.989 11.337 2.574 339 HB VAL 64 HB VAL 64 -3.985 9.630 1.106 340 1HG1 VAL 64 1HG1 VAL 64 -4.943 10.759 -0.854 341 2HG1 VAL 64 2HG1 VAL 64 -6.229 10.012 0.100 342 3HG1 VAL 64 3HG1 VAL 64 -5.964 11.766 0.192 343 1HG2 VAL 64 1HG2 VAL 64 -3.067 11.801 0.181 344 2HG2 VAL 64 2HG2 VAL 64 -3.849 12.636 1.540 345 3HG2 VAL 64 3HG2 VAL 64 -2.605 11.390 1.846 346 H GLN 65 H GLN 65 -7.615 9.896 2.242 347 HA GLN 65 HA GLN 65 -7.370 7.057 3.090 348 1HB GLN 65 1HB GLN 65 -9.710 6.881 2.713 349 2HB GLN 65 2HB GLN 65 -9.369 8.252 3.758 350 1HG GLN 65 1HG GLN 65 -10.779 9.402 2.476 351 2HG GLN 65 2HG GLN 65 -9.499 9.507 1.274 352 1HE2 GLN 65 1HE2 GLN 65 -9.539 7.823 -0.484 353 2HE2 GLN 65 2HE2 GLN 65 -11.099 7.122 -0.926 354 H ILE 66 H ILE 66 -6.635 5.615 1.752 355 HA ILE 66 HA ILE 66 -7.279 5.875 -1.112 356 HB ILE 66 HB ILE 66 -4.864 4.741 -1.395 357 1HG1 ILE 66 1HG1 ILE 66 -3.158 6.164 -0.365 358 2HG1 ILE 66 2HG1 ILE 66 -4.313 6.927 0.718 359 1HG2 ILE 66 1HG2 ILE 66 -4.153 6.835 -2.329 360 2HG2 ILE 66 2HG2 ILE 66 -5.868 6.594 -2.675 361 3HG2 ILE 66 3HG2 ILE 66 -5.376 7.723 -1.386 362 1HD1 ILE 66 1HD1 ILE 66 -3.706 3.909 0.556 363 2HD1 ILE 66 2HD1 ILE 66 -2.921 5.024 1.679 364 3HD1 ILE 66 3HD1 ILE 66 -4.660 4.730 1.814 365 H MET 67 H MET 67 -8.614 4.352 -1.373 366 HA MET 67 HA MET 67 -8.626 1.891 0.168 367 1HB MET 67 1HB MET 67 -10.139 2.754 -2.336 368 2HB MET 67 2HB MET 67 -10.506 1.301 -1.397 369 1HG MET 67 1HG MET 67 -11.256 2.555 0.476 370 2HG MET 67 2HG MET 67 -10.572 4.065 -0.134 371 1HE MET 67 1HE MET 67 -14.333 2.075 -1.918 372 2HE MET 67 2HE MET 67 -12.708 1.451 -2.252 373 3HE MET 67 3HE MET 67 -13.375 1.361 -0.603 374 H TYR 68 H TYR 68 -8.782 -0.266 -0.940 375 HA TYR 68 HA TYR 68 -7.479 -0.442 -3.570 376 1HB TYR 68 1HB TYR 68 -6.578 -2.131 -1.199 377 2HB TYR 68 2HB TYR 68 -6.139 -2.404 -2.882 378 HD1 TYR 68 HD1 TYR 68 -5.345 -0.556 0.139 379 HD2 TYR 68 HD2 TYR 68 -4.812 -0.599 -4.136 380 HE1 TYR 68 HE1 TYR 68 -3.516 1.111 0.342 381 HE2 TYR 68 HE2 TYR 68 -2.999 1.079 -3.929 382 HH TYR 68 HH TYR 68 -1.840 2.525 -2.462 383 H ARG 69 H ARG 69 -8.207 -2.329 -4.680 384 HA ARG 69 HA ARG 69 -10.317 -3.938 -3.393 385 1HB ARG 69 1HB ARG 69 -11.669 -2.510 -4.655 386 2HB ARG 69 2HB ARG 69 -10.540 -2.407 -5.991 387 1HG ARG 69 1HG ARG 69 -10.953 -4.683 -6.691 388 2HG ARG 69 2HG ARG 69 -12.005 -4.990 -5.300 389 1HD ARG 69 1HD ARG 69 -12.687 -2.795 -7.303 390 2HD ARG 69 2HD ARG 69 -12.940 -4.470 -7.715 391 HE ARG 69 HE ARG 69 -14.665 -4.736 -6.133 392 1HH1 ARG 69 1HH1 ARG 69 -13.293 -1.493 -5.807 393 2HH1 ARG 69 2HH1 ARG 69 -14.432 -1.028 -4.569 394 1HH2 ARG 69 1HH2 ARG 69 -16.125 -4.180 -4.773 395 2HH2 ARG 69 2HH2 ARG 69 -16.045 -2.682 -3.816 396 H ALA 70 H ALA 70 -10.154 -6.056 -3.863 397 HA ALA 70 HA ALA 70 -8.368 -7.059 -5.988 398 1HB ALA 70 1HB ALA 70 -6.996 -7.028 -3.952 399 2HB ALA 70 2HB ALA 70 -8.202 -8.047 -3.139 400 3HB ALA 70 3HB ALA 70 -7.342 -8.654 -4.569 401 H LYS 71 H LYS 71 -9.898 -8.167 -7.231 402 HA LYS 71 HA LYS 71 -12.105 -9.567 -5.759 403 1HB LYS 71 1HB LYS 71 -12.026 -9.135 -8.745 404 2HB LYS 71 2HB LYS 71 -13.344 -9.603 -7.688 405 1HG LYS 71 1HG LYS 71 -12.643 -7.253 -6.481 406 2HG LYS 71 2HG LYS 71 -12.156 -6.863 -8.139 407 1HD LYS 71 1HD LYS 71 -14.827 -7.997 -7.241 408 2HD LYS 71 2HD LYS 71 -14.514 -6.271 -7.505 409 1HE LYS 71 1HE LYS 71 -14.323 -6.484 -9.822 410 2HE LYS 71 2HE LYS 71 -14.176 -8.248 -9.780 411 1HZ LYS 71 1HZ LYS 71 -16.565 -6.907 -8.722 412 2HZ LYS 71 2HZ LYS 71 -16.430 -7.252 -10.350 413 3HZ LYS 71 3HZ LYS 71 -16.408 -8.442 -9.199 414 H ASN 72 H ASN 72 -12.168 -11.822 -5.668 415 HA ASN 72 HA ASN 72 -9.857 -13.161 -6.809 416 1HB ASN 72 1HB ASN 72 -10.628 -13.836 -4.591 417 2HB ASN 72 2HB ASN 72 -12.161 -14.388 -5.285 418 1HD2 ASN 72 1HD2 ASN 72 -11.057 -16.447 -4.029 419 2HD2 ASN 72 2HD2 ASN 72 -10.229 -17.523 -5.150 420 H LEU 73 H LEU 73 -9.815 -13.380 -8.970 421 HA LEU 73 HA LEU 73 -12.213 -14.321 -10.416 422 1HB LEU 73 1HB LEU 73 -9.473 -13.604 -11.495 423 2HB LEU 73 2HB LEU 73 -10.964 -13.832 -12.410 424 HG LEU 73 HG LEU 73 -10.336 -11.556 -10.485 425 1HD1 LEU 73 1HD1 LEU 73 -10.790 -11.688 -13.496 426 2HD1 LEU 73 2HD1 LEU 73 -10.535 -10.204 -12.566 427 3HD1 LEU 73 3HD1 LEU 73 -9.240 -11.410 -12.671 428 1HD2 LEU 73 1HD2 LEU 73 -12.726 -12.066 -10.258 429 2HD2 LEU 73 2HD2 LEU 73 -12.524 -10.603 -11.226 430 3HD2 LEU 73 3HD2 LEU 73 -12.905 -12.143 -12.027 431 H ALA 74 H ALA 74 -10.043 -16.072 -8.613 432 HA ALA 74 HA ALA 74 -9.538 -18.157 -10.626 433 1HB ALA 74 1HB ALA 74 -8.788 -19.480 -8.693 434 2HB ALA 74 2HB ALA 74 -8.007 -17.891 -8.739 435 3HB ALA 74 3HB ALA 74 -9.330 -18.196 -7.598 436 H SER 75 H SER 75 -10.478 -20.375 -10.330 437 HA SER 75 HA SER 75 -13.378 -20.352 -10.059 438 1HB SER 75 1HB SER 75 -12.820 -22.852 -10.566 439 2HB SER 75 2HB SER 75 -12.438 -21.655 -11.816 440 HG SER 75 HG SER 75 -10.612 -23.010 -11.407 441 H THR 76 H THR 76 -10.777 -20.587 -7.879 442 HA THR 76 HA THR 76 -12.205 -22.225 -5.889 443 HB THR 76 HB THR 76 -9.639 -23.123 -5.682 444 HG1 THR 76 HG1 THR 76 -9.960 -22.729 -8.474 445 1HG2 THR 76 1HG2 THR 76 -10.277 -25.108 -7.006 446 2HG2 THR 76 2HG2 THR 76 -11.624 -24.585 -5.978 447 3HG2 THR 76 3HG2 THR 76 -11.639 -24.217 -7.715 448 HA PRO 77 HA PRO 77 -10.695 -19.177 -3.191 449 1HB PRO 77 1HB PRO 77 -9.512 -20.507 -1.033 450 2HB PRO 77 2HB PRO 77 -11.270 -20.373 -1.271 451 1HG PRO 77 1HG PRO 77 -9.470 -22.654 -2.103 452 2HG PRO 77 2HG PRO 77 -11.031 -22.746 -1.230 453 1HD PRO 77 1HD PRO 77 -10.935 -23.174 -3.877 454 2HD PRO 77 2HD PRO 77 -12.247 -22.173 -3.209 455 H THR 78 H THR 78 -8.733 -17.963 -2.746 456 HA THR 78 HA THR 78 -6.169 -19.420 -3.141 457 HB THR 78 HB THR 78 -5.090 -17.685 -4.345 458 HG1 THR 78 HG1 THR 78 -5.625 -15.849 -3.655 459 1HG2 THR 78 1HG2 THR 78 -6.337 -17.443 -6.385 460 2HG2 THR 78 2HG2 THR 78 -6.928 -19.001 -5.718 461 3HG2 THR 78 3HG2 THR 78 -7.886 -17.515 -5.525 462 H THR 79 H THR 79 -4.377 -18.068 -2.222 463 HA THR 79 HA THR 79 -5.247 -16.604 0.174 464 HB THR 79 HB THR 79 -3.686 -18.415 0.569 465 HG1 THR 79 HG1 THR 79 -3.820 -16.355 1.763 466 1HG2 THR 79 1HG2 THR 79 -2.308 -18.313 -1.502 467 2HG2 THR 79 2HG2 THR 79 -1.691 -16.720 -1.009 468 3HG2 THR 79 3HG2 THR 79 -1.315 -18.153 -0.040 469 H GLY 80 H GLY 80 -3.766 -14.701 0.462 470 1HA GLY 80 1HA GLY 80 -2.512 -13.430 -1.716 471 2HA GLY 80 2HA GLY 80 -4.115 -12.714 -1.494 472 H GLN 81 H GLN 81 -1.473 -13.989 0.411 473 HA GLN 81 HA GLN 81 -1.539 -11.859 2.480 474 1HB GLN 81 1HB GLN 81 0.629 -13.124 3.155 475 2HB GLN 81 2HB GLN 81 -0.940 -13.825 3.525 476 1HG GLN 81 1HG GLN 81 -0.789 -15.520 1.976 477 2HG GLN 81 2HG GLN 81 0.391 -14.719 0.947 478 1HE2 GLN 81 1HE2 GLN 81 2.542 -14.108 2.318 479 2HE2 GLN 81 2HE2 GLN 81 3.175 -15.508 3.168 480 H ALA 82 H ALA 82 0.376 -13.092 -0.223 481 HA ALA 82 HA ALA 82 1.837 -12.172 -1.649 482 1HB ALA 82 1HB ALA 82 1.501 -9.723 -2.139 483 2HB ALA 82 2HB ALA 82 0.020 -10.712 -2.126 484 3HB ALA 82 3HB ALA 82 0.359 -9.652 -0.788 485 H THR 83 H THR 83 3.653 -10.258 -1.809 486 HA THR 83 HA THR 83 5.026 -10.156 0.856 487 HB THR 83 HB THR 83 6.364 -10.397 -1.786 488 HG1 THR 83 HG1 THR 83 5.620 -12.286 0.165 489 1HG2 THR 83 1HG2 THR 83 8.377 -10.871 -0.401 490 2HG2 THR 83 2HG2 THR 83 7.742 -9.249 -0.092 491 3HG2 THR 83 3HG2 THR 83 7.432 -10.559 1.068 492 H PHE 84 H PHE 84 5.698 -8.134 1.457 493 HA PHE 84 HA PHE 84 5.153 -5.915 -0.453 494 1HB PHE 84 1HB PHE 84 5.035 -4.516 1.588 495 2HB PHE 84 2HB PHE 84 3.731 -5.661 1.356 496 HD1 PHE 84 HD1 PHE 84 3.000 -6.903 3.221 497 HD2 PHE 84 HD2 PHE 84 7.068 -5.442 3.175 498 HE1 PHE 84 HE1 PHE 84 3.337 -7.721 5.522 499 HE2 PHE 84 HE2 PHE 84 7.404 -6.282 5.429 500 HZ PHE 84 HZ PHE 84 5.530 -7.411 6.655 501 H ASN 85 H ASN 85 6.683 -4.413 -0.837 502 HA ASN 85 HA ASN 85 9.100 -4.301 0.918 503 1HB ASN 85 1HB ASN 85 10.066 -5.023 -1.098 504 2HB ASN 85 2HB ASN 85 8.942 -4.090 -2.078 505 1HD2 ASN 85 1HD2 ASN 85 9.106 -1.672 -1.911 506 2HD2 ASN 85 2HD2 ASN 85 10.680 -0.935 -1.728 507 H VAL 86 H VAL 86 8.381 -2.742 2.223 508 HA VAL 86 HA VAL 86 6.552 -0.648 1.255 509 HB VAL 86 HB VAL 86 7.522 -1.302 4.069 510 1HG1 VAL 86 1HG1 VAL 86 5.370 -0.198 4.729 511 2HG1 VAL 86 2HG1 VAL 86 6.488 0.906 3.939 512 3HG1 VAL 86 3HG1 VAL 86 5.116 0.257 3.031 513 1HG2 VAL 86 1HG2 VAL 86 5.032 -2.308 2.630 514 2HG2 VAL 86 2HG2 VAL 86 6.423 -3.279 3.143 515 3HG2 VAL 86 3HG2 VAL 86 5.393 -2.522 4.352 516 H THR 87 H THR 87 8.737 0.056 -0.071 517 HA THR 87 HA THR 87 9.644 2.432 1.173 518 HB THR 87 HB THR 87 10.950 0.890 2.552 519 HG1 THR 87 HG1 THR 87 13.040 1.819 2.030 520 1HG2 THR 87 1HG2 THR 87 12.316 0.039 -0.011 521 2HG2 THR 87 2HG2 THR 87 12.741 -0.458 1.640 522 3HG2 THR 87 3HG2 THR 87 11.179 -0.936 0.946 523 HA PRO 88 HA PRO 88 11.054 3.030 -3.096 524 1HB PRO 88 1HB PRO 88 12.690 5.238 -2.651 525 2HB PRO 88 2HB PRO 88 10.945 5.309 -2.954 526 1HG PRO 88 1HG PRO 88 12.374 5.620 -0.365 527 2HG PRO 88 2HG PRO 88 10.842 6.335 -0.902 528 1HD PRO 88 1HD PRO 88 11.080 4.154 0.820 529 2HD PRO 88 2HD PRO 88 9.618 4.526 -0.109 530 H MET 89 H MET 89 13.002 3.131 -0.146 531 HA MET 89 HA MET 89 14.567 1.027 -0.444 532 1HB MET 89 1HB MET 89 16.853 1.865 -1.072 533 2HB MET 89 2HB MET 89 15.721 1.609 -2.373 534 1HG MET 89 1HG MET 89 15.295 4.217 -2.217 535 2HG MET 89 2HG MET 89 16.804 4.209 -1.292 536 1HE MET 89 1HE MET 89 15.122 3.702 -4.763 537 2HE MET 89 2HE MET 89 16.496 3.190 -5.769 538 3HE MET 89 3HE MET 89 15.820 2.078 -4.564 539 H ALA 90 H ALA 90 15.591 4.396 0.204 540 HA ALA 90 HA ALA 90 17.073 3.631 2.462 541 1HB ALA 90 1HB ALA 90 16.080 6.443 1.896 542 2HB ALA 90 2HB ALA 90 17.586 5.953 2.685 543 3HB ALA 90 3HB ALA 90 17.375 5.677 0.944 544 H ALA 91 H ALA 91 13.871 5.156 2.241 545 HA ALA 91 HA ALA 91 13.738 5.737 5.098 546 1HB ALA 91 1HB ALA 91 11.426 6.559 4.467 547 2HB ALA 91 2HB ALA 91 12.779 7.299 3.578 548 3HB ALA 91 3HB ALA 91 11.789 6.055 2.797 549 H GLY 92 H GLY 92 10.821 4.471 3.715 550 1HA GLY 92 1HA GLY 92 9.558 2.683 4.230 551 2HA GLY 92 2HA GLY 92 11.009 1.817 4.736 552 H ALA 93 H ALA 93 11.874 3.164 6.978 553 HA ALA 93 HA ALA 93 10.225 2.510 9.101 554 1HB ALA 93 1HB ALA 93 12.585 3.138 9.346 555 2HB ALA 93 2HB ALA 93 12.208 4.824 8.936 556 3HB ALA 93 3HB ALA 93 11.572 4.109 10.432 557 H TYR 94 H TYR 94 10.516 5.705 7.574 558 HA TYR 94 HA TYR 94 8.351 6.961 8.937 559 1HB TYR 94 1HB TYR 94 9.640 7.782 6.337 560 2HB TYR 94 2HB TYR 94 8.867 8.822 7.531 561 HD1 TYR 94 HD1 TYR 94 9.982 8.060 10.105 562 HD2 TYR 94 HD2 TYR 94 11.963 8.117 6.275 563 HE1 TYR 94 HE1 TYR 94 12.179 8.170 11.235 564 HE2 TYR 94 HE2 TYR 94 14.142 8.370 7.419 565 HH TYR 94 HH TYR 94 15.235 8.471 9.410 566 H PHE 95 H PHE 95 8.083 4.520 6.640 567 HA PHE 95 HA PHE 95 5.853 5.668 5.164 568 1HB PHE 95 1HB PHE 95 7.437 3.854 4.202 569 2HB PHE 95 2HB PHE 95 6.718 2.743 5.351 570 HD1 PHE 95 HD1 PHE 95 6.519 3.844 1.989 571 HD2 PHE 95 HD2 PHE 95 4.185 2.292 5.246 572 HE1 PHE 95 HE1 PHE 95 4.575 3.600 0.479 573 HE2 PHE 95 HE2 PHE 95 2.258 2.001 3.732 574 HZ PHE 95 HZ PHE 95 2.414 2.735 1.362 575 H ASN 96 H ASN 96 4.009 6.039 6.280 576 HA ASN 96 HA ASN 96 3.645 4.554 8.687 577 1HB ASN 96 1HB ASN 96 2.037 6.775 7.412 578 2HB ASN 96 2HB ASN 96 1.404 5.886 8.795 579 1HD2 ASN 96 1HD2 ASN 96 4.479 7.552 7.778 580 2HD2 ASN 96 2HD2 ASN 96 4.875 8.046 9.404 581 H LYS 97 H LYS 97 1.270 3.678 9.180 582 HA LYS 97 HA LYS 97 0.123 2.227 6.878 583 1HB LYS 97 1HB LYS 97 1.093 0.923 9.474 584 2HB LYS 97 2HB LYS 97 -0.008 0.160 8.316 585 1HG LYS 97 1HG LYS 97 1.688 0.374 6.531 586 2HG LYS 97 2HG LYS 97 2.837 1.067 7.690 587 1HD LYS 97 1HD LYS 97 2.825 -0.973 9.023 588 2HD LYS 97 2HD LYS 97 1.536 -1.669 8.026 589 1HE LYS 97 1HE LYS 97 3.023 -1.632 6.031 590 2HE LYS 97 2HE LYS 97 4.316 -0.895 6.994 591 1HZ LYS 97 1HZ LYS 97 4.598 -3.267 6.726 592 2HZ LYS 97 2HZ LYS 97 4.395 -2.891 8.314 593 3HZ LYS 97 3HZ LYS 97 3.169 -3.576 7.465 594 H VAL 98 H VAL 98 -1.951 1.097 7.924 595 HA VAL 98 HA VAL 98 -3.484 3.188 9.272 596 HB VAL 98 HB VAL 98 -4.556 1.993 7.558 597 1HG1 VAL 98 1HG1 VAL 98 -5.117 -0.453 7.754 598 2HG1 VAL 98 2HG1 VAL 98 -3.430 -0.104 7.377 599 3HG1 VAL 98 3HG1 VAL 98 -3.885 -0.566 9.024 600 1HG2 VAL 98 1HG2 VAL 98 -6.592 1.336 8.608 601 2HG2 VAL 98 2HG2 VAL 98 -5.791 0.992 10.147 602 3HG2 VAL 98 3HG2 VAL 98 -5.899 2.663 9.556 603 H GLN 99 H GLN 99 -1.845 3.263 10.880 604 HA GLN 99 HA GLN 99 -0.678 2.736 12.721 605 1HB GLN 99 1HB GLN 99 -2.650 4.206 13.149 606 2HB GLN 99 2HB GLN 99 -3.492 2.826 13.855 607 1HG GLN 99 1HG GLN 99 -2.391 3.082 15.821 608 2HG GLN 99 2HG GLN 99 -0.820 3.091 15.023 609 1HE2 GLN 99 1HE2 GLN 99 0.291 4.852 15.817 610 2HE2 GLN 99 2HE2 GLN 99 -0.371 6.476 15.879 611 H CYS 100 H CYS 100 -0.831 0.345 11.472 612 HA CYS 100 HA CYS 100 0.226 -1.499 13.122 613 1HB CYS 100 1HB CYS 100 -1.680 -1.775 14.591 614 2HB CYS 100 2HB CYS 100 -2.800 -1.865 13.210 615 HG CYS 100 HG CYS 100 -2.706 -4.197 14.102 616 H PHE 101 H PHE 101 -2.662 -1.821 11.021 617 HA PHE 101 HA PHE 101 -1.711 -4.298 10.222 618 1HB PHE 101 1HB PHE 101 -3.955 -2.777 8.871 619 2HB PHE 101 2HB PHE 101 -3.703 -4.507 8.879 620 HD1 PHE 101 HD1 PHE 101 -3.877 -5.817 11.039 621 HD2 PHE 101 HD2 PHE 101 -5.012 -1.656 10.796 622 HE1 PHE 101 HE1 PHE 101 -4.994 -5.983 13.245 623 HE2 PHE 101 HE2 PHE 101 -6.075 -1.820 13.015 624 HZ PHE 101 HZ PHE 101 -6.073 -3.979 14.250 625 H CYS 102 H CYS 102 -0.778 -5.176 8.471 626 HA CYS 102 HA CYS 102 0.808 -3.472 6.717 627 1HB CYS 102 1HB CYS 102 0.379 -6.486 6.863 628 2HB CYS 102 2HB CYS 102 1.449 -5.696 5.691 629 HG CYS 102 HG CYS 102 1.555 -5.347 8.966 630 H PHE 103 H PHE 103 -2.084 -5.453 6.441 631 HA PHE 103 HA PHE 103 -3.492 -4.277 4.404 632 1HB PHE 103 1HB PHE 103 -1.290 -6.014 3.413 633 2HB PHE 103 2HB PHE 103 -2.841 -6.647 2.980 634 HD1 PHE 103 HD1 PHE 103 -2.676 -6.441 0.659 635 HD2 PHE 103 HD2 PHE 103 -2.203 -2.922 3.109 636 HE1 PHE 103 HE1 PHE 103 -2.842 -5.010 -1.342 637 HE2 PHE 103 HE2 PHE 103 -2.301 -1.512 1.098 638 HZ PHE 103 HZ PHE 103 -2.640 -2.535 -1.138 639 H THR 104 H THR 104 -4.977 -6.513 3.562 640 HA THR 104 HA THR 104 -5.412 -8.158 6.020 641 HB THR 104 HB THR 104 -7.462 -6.189 4.958 642 HG1 THR 104 HG1 THR 104 -5.543 -6.065 6.937 643 1HG2 THR 104 1HG2 THR 104 -7.554 -8.109 7.331 644 2HG2 THR 104 2HG2 THR 104 -8.660 -6.739 7.130 645 3HG2 THR 104 3HG2 THR 104 -8.677 -8.050 5.951 646 H GLU 105 H GLU 105 -5.421 -7.951 2.691 647 HA GLU 105 HA GLU 105 -7.693 -9.137 1.818 648 1HB GLU 105 1HB GLU 105 -4.842 -9.105 0.737 649 2HB GLU 105 2HB GLU 105 -6.209 -9.753 -0.172 650 1HG GLU 105 1HG GLU 105 -5.799 -7.480 -0.886 651 2HG GLU 105 2HG GLU 105 -7.367 -7.599 -0.109 652 H THR 106 H THR 106 -4.738 -10.781 2.834 653 HA THR 106 HA THR 106 -4.310 -12.881 3.555 654 HB THR 106 HB THR 106 -5.666 -11.883 5.296 655 HG1 THR 106 HG1 THR 106 -5.810 -13.853 6.387 656 1HG2 THR 106 1HG2 THR 106 -7.813 -12.683 5.927 657 2HG2 THR 106 2HG2 THR 106 -7.991 -12.008 4.317 658 3HG2 THR 106 3HG2 THR 106 -7.935 -13.769 4.548 659 H THR 107 H THR 107 -7.620 -13.480 2.488 660 HA THR 107 HA THR 107 -6.907 -15.542 0.675 661 HB THR 107 HB THR 107 -7.381 -16.143 3.584 662 HG1 THR 107 HG1 THR 107 -5.816 -17.650 3.253 663 1HG2 THR 107 1HG2 THR 107 -9.291 -17.372 2.546 664 2HG2 THR 107 2HG2 THR 107 -8.189 -18.084 1.345 665 3HG2 THR 107 3HG2 THR 107 -8.047 -18.517 3.059 666 H LEU 108 H LEU 108 -8.713 -16.179 -0.540 667 HA LEU 108 HA LEU 108 -11.375 -15.489 0.463 668 1HB LEU 108 1HB LEU 108 -10.198 -14.123 -2.003 669 2HB LEU 108 2HB LEU 108 -11.914 -14.365 -1.784 670 HG LEU 108 HG LEU 108 -10.191 -12.675 0.032 671 1HD1 LEU 108 1HD1 LEU 108 -10.459 -11.631 -2.110 672 2HD1 LEU 108 2HD1 LEU 108 -12.178 -12.060 -2.191 673 3HD1 LEU 108 3HD1 LEU 108 -11.635 -10.876 -1.009 674 1HD2 LEU 108 1HD2 LEU 108 -12.422 -11.918 0.930 675 2HD2 LEU 108 2HD2 LEU 108 -13.200 -13.226 0.017 676 3HD2 LEU 108 3HD2 LEU 108 -12.070 -13.593 1.338 677 H GLU 109 H GLU 109 -12.807 -16.853 -0.187 678 HA GLU 109 HA GLU 109 -12.758 -18.906 -2.036 679 1HB GLU 109 1HB GLU 109 -14.885 -17.091 -0.853 680 2HB GLU 109 2HB GLU 109 -15.339 -18.378 -1.940 681 1HG GLU 109 1HG GLU 109 -15.533 -19.146 0.353 682 2HG GLU 109 2HG GLU 109 -14.259 -20.057 -0.466 683 HA PRO 110 HA PRO 110 -12.866 -17.116 -6.016 684 1HB PRO 110 1HB PRO 110 -14.331 -18.824 -7.518 685 2HB PRO 110 2HB PRO 110 -12.826 -19.275 -6.687 686 1HG PRO 110 1HG PRO 110 -15.659 -19.721 -5.703 687 2HG PRO 110 2HG PRO 110 -14.369 -20.946 -5.856 688 1HD PRO 110 1HD PRO 110 -14.866 -19.669 -3.518 689 2HD PRO 110 2HD PRO 110 -13.199 -20.060 -3.998 690 H GLY 111 H GLY 111 -13.774 -15.219 -6.664 691 1HA GLY 111 1HA GLY 111 -15.508 -14.210 -7.952 692 2HA GLY 111 2HA GLY 111 -16.743 -15.050 -7.003 693 H GLU 112 H GLU 112 -14.538 -14.293 -4.707 694 HA GLU 112 HA GLU 112 -16.379 -12.424 -3.749 695 1HB GLU 112 1HB GLU 112 -13.789 -13.626 -2.728 696 2HB GLU 112 2HB GLU 112 -14.777 -12.541 -1.765 697 1HG GLU 112 1HG GLU 112 -15.694 -15.165 -2.861 698 2HG GLU 112 2HG GLU 112 -15.297 -14.783 -1.187 699 H GLU 113 H GLU 113 -16.142 -10.319 -3.072 700 HA GLU 113 HA GLU 113 -14.195 -8.597 -4.514 701 1HB GLU 113 1HB GLU 113 -16.778 -8.070 -2.999 702 2HB GLU 113 2HB GLU 113 -15.726 -6.801 -3.588 703 1HG GLU 113 1HG GLU 113 -16.455 -8.762 -5.650 704 2HG GLU 113 2HG GLU 113 -17.849 -8.023 -4.867 705 H MET 114 H MET 114 -12.222 -8.608 -3.211 706 HA MET 114 HA MET 114 -12.484 -7.888 -0.378 707 1HB MET 114 1HB MET 114 -10.475 -9.197 -1.883 708 2HB MET 114 2HB MET 114 -9.856 -7.566 -1.656 709 1HG MET 114 1HG MET 114 -10.856 -9.422 0.544 710 2HG MET 114 2HG MET 114 -9.187 -9.113 0.104 711 1HE MET 114 1HE MET 114 -12.312 -7.984 2.043 712 2HE MET 114 2HE MET 114 -11.022 -8.806 2.956 713 3HE MET 114 3HE MET 114 -11.443 -7.121 3.328 714 H GLU 115 H GLU 115 -12.750 -5.805 0.086 715 HA GLU 115 HA GLU 115 -11.525 -3.668 -1.503 716 1HB GLU 115 1HB GLU 115 -13.729 -3.753 -2.519 717 2HB GLU 115 2HB GLU 115 -14.522 -3.769 -0.935 718 1HG GLU 115 1HG GLU 115 -13.811 -1.495 -0.459 719 2HG GLU 115 2HG GLU 115 -12.747 -1.480 -1.880 720 H MET 116 H MET 116 -10.513 -2.328 -0.049 721 HA MET 116 HA MET 116 -11.837 -1.780 2.496 722 1HB MET 116 1HB MET 116 -9.103 -3.138 2.374 723 2HB MET 116 2HB MET 116 -9.657 -2.193 3.758 724 1HG MET 116 1HG MET 116 -11.709 -3.691 3.857 725 2HG MET 116 2HG MET 116 -10.914 -4.714 2.655 726 1HE MET 116 1HE MET 116 -10.738 -3.302 6.318 727 2HE MET 116 2HE MET 116 -9.357 -4.209 6.975 728 3HE MET 116 3HE MET 116 -9.078 -2.939 5.775 729 HA PRO 117 HA PRO 117 -9.562 2.105 1.915 730 1HB PRO 117 1HB PRO 117 -9.890 3.266 4.274 731 2HB PRO 117 2HB PRO 117 -11.232 3.061 3.113 732 1HG PRO 117 1HG PRO 117 -10.599 1.350 5.523 733 2HG PRO 117 2HG PRO 117 -12.159 2.025 4.955 734 1HD PRO 117 1HD PRO 117 -11.313 -0.567 4.435 735 2HD PRO 117 2HD PRO 117 -12.434 0.340 3.376 736 H VAL 118 H VAL 118 -7.465 2.698 2.293 737 HA VAL 118 HA VAL 118 -6.136 1.851 4.797 738 HB VAL 118 HB VAL 118 -4.928 2.111 2.008 739 1HG1 VAL 118 1HG1 VAL 118 -3.467 3.411 3.426 740 2HG1 VAL 118 2HG1 VAL 118 -3.423 2.104 4.639 741 3HG1 VAL 118 3HG1 VAL 118 -2.712 1.876 3.024 742 1HG2 VAL 118 1HG2 VAL 118 -4.792 -0.088 4.100 743 2HG2 VAL 118 2HG2 VAL 118 -5.768 -0.116 2.615 744 3HG2 VAL 118 3HG2 VAL 118 -4.002 -0.103 2.509 745 H VAL 119 H VAL 119 -4.851 3.668 5.618 746 HA VAL 119 HA VAL 119 -5.518 6.308 4.478 747 HB VAL 119 HB VAL 119 -5.521 7.214 6.792 748 1HG1 VAL 119 1HG1 VAL 119 -7.723 5.181 6.228 749 2HG1 VAL 119 2HG1 VAL 119 -7.835 6.597 7.291 750 3HG1 VAL 119 3HG1 VAL 119 -7.619 6.820 5.548 751 1HG2 VAL 119 1HG2 VAL 119 -5.778 4.289 7.648 752 2HG2 VAL 119 2HG2 VAL 119 -4.400 5.357 8.000 753 3HG2 VAL 119 3HG2 VAL 119 -5.990 5.699 8.687 754 H PHE 120 H PHE 120 -3.668 7.668 4.371 755 HA PHE 120 HA PHE 120 -1.154 6.600 5.530 756 1HB PHE 120 1HB PHE 120 -1.580 5.341 3.418 757 2HB PHE 120 2HB PHE 120 -1.675 6.875 2.543 758 HD1 PHE 120 HD1 PHE 120 0.621 5.054 4.929 759 HD2 PHE 120 HD2 PHE 120 0.290 7.422 1.345 760 HE1 PHE 120 HE1 PHE 120 3.070 4.937 4.586 761 HE2 PHE 120 HE2 PHE 120 2.761 7.241 1.032 762 HZ PHE 120 HZ PHE 120 4.119 6.018 2.646 763 H PHE 121 H PHE 121 0.589 7.933 5.554 764 HA PHE 121 HA PHE 121 0.757 10.464 4.246 765 1HB PHE 121 1HB PHE 121 0.975 11.770 6.269 766 2HB PHE 121 2HB PHE 121 -0.623 11.059 6.244 767 HD1 PHE 121 HD1 PHE 121 -1.116 9.018 7.647 768 HD2 PHE 121 HD2 PHE 121 2.581 11.174 8.025 769 HE1 PHE 121 HE1 PHE 121 -0.891 8.210 9.999 770 HE2 PHE 121 HE2 PHE 121 2.862 10.291 10.334 771 HZ PHE 121 HZ PHE 121 1.093 8.844 11.328 772 H VAL 122 H VAL 122 3.012 11.403 5.159 773 HA VAL 122 HA VAL 122 4.826 9.145 5.934 774 HB VAL 122 HB VAL 122 5.320 11.326 3.870 775 1HG1 VAL 122 1HG1 VAL 122 7.486 10.058 3.519 776 2HG1 VAL 122 2HG1 VAL 122 7.389 10.933 5.048 777 3HG1 VAL 122 3HG1 VAL 122 7.145 9.178 5.028 778 1HG2 VAL 122 1HG2 VAL 122 4.861 8.321 3.679 779 2HG2 VAL 122 2HG2 VAL 122 3.907 9.603 2.924 780 3HG2 VAL 122 3HG2 VAL 122 5.543 9.287 2.355 781 H ASP 123 H ASP 123 6.268 9.596 7.561 782 HA ASP 123 HA ASP 123 5.639 11.867 9.152 783 1HB ASP 123 1HB ASP 123 7.994 9.970 9.434 784 2HB ASP 123 2HB ASP 123 7.511 11.206 10.604 785 HA PRO 124 HA PRO 124 8.654 14.826 7.521 786 1HB PRO 124 1HB PRO 124 8.912 15.957 10.263 787 2HB PRO 124 2HB PRO 124 8.353 16.753 8.779 788 1HG PRO 124 1HG PRO 124 6.686 16.004 10.862 789 2HG PRO 124 2HG PRO 124 6.118 16.071 9.172 790 1HD PRO 124 1HD PRO 124 6.861 13.676 10.794 791 2HD PRO 124 2HD PRO 124 5.599 13.924 9.550 792 H GLU 125 H GLU 125 9.275 12.846 10.343 793 HA GLU 125 HA GLU 125 11.878 13.115 10.885 794 1HB GLU 125 1HB GLU 125 10.520 10.490 10.465 795 2HB GLU 125 2HB GLU 125 11.970 10.800 11.440 796 1HG GLU 125 1HG GLU 125 9.145 11.720 11.995 797 2HG GLU 125 2HG GLU 125 10.161 10.613 12.911 798 H ILE 126 H ILE 126 10.638 11.818 7.783 799 HA ILE 126 HA ILE 126 12.982 10.618 6.866 800 HB ILE 126 HB ILE 126 10.713 10.505 5.891 801 1HG1 ILE 126 1HG1 ILE 126 12.880 11.208 3.858 802 2HG1 ILE 126 2HG1 ILE 126 12.846 9.725 4.827 803 1HG2 ILE 126 1HG2 ILE 126 9.889 12.101 4.324 804 2HG2 ILE 126 2HG2 ILE 126 10.303 13.024 5.777 805 3HG2 ILE 126 3HG2 ILE 126 11.387 13.038 4.366 806 1HD1 ILE 126 1HD1 ILE 126 10.604 9.187 3.970 807 2HD1 ILE 126 2HD1 ILE 126 10.728 10.564 2.843 808 3HD1 ILE 126 3HD1 ILE 126 11.884 9.218 2.731 809 H VAL 127 H VAL 127 12.207 14.102 6.930 810 HA VAL 127 HA VAL 127 14.817 14.675 5.579 811 HB VAL 127 HB VAL 127 14.015 17.034 5.583 812 1HG1 VAL 127 1HG1 VAL 127 12.610 16.753 3.619 813 2HG1 VAL 127 2HG1 VAL 127 13.962 15.610 3.585 814 3HG1 VAL 127 3HG1 VAL 127 12.335 15.050 4.019 815 1HG2 VAL 127 1HG2 VAL 127 11.679 17.553 5.820 816 2HG2 VAL 127 2HG2 VAL 127 11.253 15.864 6.127 817 3HG2 VAL 127 3HG2 VAL 127 12.193 16.782 7.328 818 H LYS 128 H LYS 128 15.340 13.468 7.809 819 HA LYS 128 HA LYS 128 16.645 15.676 9.245 820 1HB LYS 128 1HB LYS 128 14.953 13.608 10.608 821 2HB LYS 128 2HB LYS 128 16.482 14.094 11.375 822 1HG LYS 128 1HG LYS 128 15.883 16.463 11.158 823 2HG LYS 128 2HG LYS 128 14.337 16.045 10.430 824 1HD LYS 128 1HD LYS 128 15.167 15.180 13.250 825 2HD LYS 128 2HD LYS 128 14.292 16.679 12.878 826 1HE LYS 128 1HE LYS 128 12.539 15.270 11.683 827 2HE LYS 128 2HE LYS 128 13.337 13.834 12.365 828 1HZ LYS 128 1HZ LYS 128 12.668 14.440 14.485 829 2HZ LYS 128 2HZ LYS 128 12.334 16.005 14.106 830 3HZ LYS 128 3HZ LYS 128 11.396 14.745 13.550 831 HA PRO 129 HA PRO 129 19.832 12.338 9.415 832 1HB PRO 129 1HB PRO 129 19.415 9.730 8.667 833 2HB PRO 129 2HB PRO 129 19.148 10.354 10.322 834 1HG PRO 129 1HG PRO 129 17.116 9.884 8.157 835 2HG PRO 129 2HG PRO 129 16.993 9.509 9.898 836 1HD PRO 129 1HD PRO 129 15.871 11.730 8.739 837 2HD PRO 129 2HD PRO 129 16.430 11.703 10.439 838 H VAL 130 H VAL 130 21.362 11.537 7.771 839 HA VAL 130 HA VAL 130 20.992 13.125 5.448 840 HB VAL 130 HB VAL 130 23.168 11.160 6.279 841 1HG1 VAL 130 1HG1 VAL 130 23.116 13.275 4.091 842 2HG1 VAL 130 2HG1 VAL 130 24.572 12.416 4.649 843 3HG1 VAL 130 3HG1 VAL 130 23.268 11.516 3.863 844 1HG2 VAL 130 1HG2 VAL 130 24.390 13.242 6.895 845 2HG2 VAL 130 2HG2 VAL 130 22.955 14.204 6.485 846 3HG2 VAL 130 3HG2 VAL 130 22.913 13.067 7.850 847 H GLU 131 H GLU 131 21.235 9.578 5.972 848 HA GLU 131 HA GLU 131 21.284 8.644 3.368 849 1HB GLU 131 1HB GLU 131 19.772 7.356 5.662 850 2HB GLU 131 2HB GLU 131 20.425 6.602 4.202 851 1HG GLU 131 1HG GLU 131 22.224 6.187 5.466 852 2HG GLU 131 2HG GLU 131 22.701 7.835 5.127 853 H THR 132 H THR 132 18.371 9.528 5.257 854 HA THR 132 HA THR 132 16.749 8.795 2.934 855 HB THR 132 HB THR 132 14.862 9.071 4.447 856 HG1 THR 132 HG1 THR 132 15.589 10.728 5.828 857 1HG2 THR 132 1HG2 THR 132 17.120 7.521 5.799 858 2HG2 THR 132 2HG2 THR 132 15.390 7.224 5.960 859 3HG2 THR 132 3HG2 THR 132 16.184 6.944 4.409 860 H GLN 133 H GLN 133 18.319 11.634 3.948 861 HA GLN 133 HA GLN 133 16.424 13.621 3.867 862 1HB GLN 133 1HB GLN 133 19.111 13.670 4.146 863 2HB GLN 133 2HB GLN 133 19.058 14.056 2.446 864 1HG GLN 133 1HG GLN 133 19.056 16.144 3.452 865 2HG GLN 133 2HG GLN 133 17.348 15.916 3.077 866 1HE2 GLN 133 1HE2 GLN 133 18.041 13.877 5.806 867 2HE2 GLN 133 2HE2 GLN 133 17.857 15.085 7.033 868 H GLY 134 H GLY 134 18.080 12.140 1.095 869 1HA GLY 134 1HA GLY 134 16.968 13.884 -0.919 870 2HA GLY 134 2HA GLY 134 17.815 12.353 -1.178 871 H ILE 135 H ILE 135 15.681 11.043 0.749 872 HA ILE 135 HA ILE 135 14.050 10.179 -1.529 873 HB ILE 135 HB ILE 135 14.103 9.329 1.388 874 1HG1 ILE 135 1HG1 ILE 135 16.051 8.460 0.363 875 2HG1 ILE 135 2HG1 ILE 135 14.849 7.158 0.284 876 1HG2 ILE 135 1HG2 ILE 135 12.451 8.166 -0.882 877 2HG2 ILE 135 2HG2 ILE 135 12.601 7.533 0.779 878 3HG2 ILE 135 3HG2 ILE 135 11.808 9.071 0.497 879 1HD1 ILE 135 1HD1 ILE 135 14.364 7.824 -2.097 880 2HD1 ILE 135 2HD1 ILE 135 15.762 8.923 -2.002 881 3HD1 ILE 135 3HD1 ILE 135 15.991 7.180 -1.791 882 H LYS 136 H LYS 136 12.306 11.121 -2.148 883 HA LYS 136 HA LYS 136 10.266 11.601 -0.159 884 1HB LYS 136 1HB LYS 136 9.695 13.850 -0.911 885 2HB LYS 136 2HB LYS 136 11.154 13.724 0.058 886 1HG LYS 136 1HG LYS 136 12.598 14.075 -1.771 887 2HG LYS 136 2HG LYS 136 11.326 13.733 -2.971 888 1HD LYS 136 1HD LYS 136 9.982 15.604 -2.208 889 2HD LYS 136 2HD LYS 136 11.114 15.948 -0.894 890 1HE LYS 136 1HE LYS 136 12.832 16.672 -2.481 891 2HE LYS 136 2HE LYS 136 11.840 16.165 -3.864 892 1HZ LYS 136 1HZ LYS 136 10.244 17.862 -3.285 893 2HZ LYS 136 2HZ LYS 136 11.010 18.269 -1.946 894 3HZ LYS 136 3HZ LYS 136 11.724 18.580 -3.395 895 H THR 137 H THR 137 10.324 9.513 -1.868 896 HA THR 137 HA THR 137 7.736 10.089 -2.667 897 HB THR 137 HB THR 137 9.177 8.599 -4.832 898 HG1 THR 137 HG1 THR 137 8.884 11.377 -4.477 899 1HG2 THR 137 1HG2 THR 137 6.513 9.985 -4.691 900 2HG2 THR 137 2HG2 THR 137 7.180 9.131 -6.100 901 3HG2 THR 137 3HG2 THR 137 6.822 8.246 -4.597 902 H LEU 138 H LEU 138 6.982 8.790 -1.149 903 HA LEU 138 HA LEU 138 8.385 6.267 -0.633 904 1HB LEU 138 1HB LEU 138 6.688 8.014 0.861 905 2HB LEU 138 2HB LEU 138 5.894 6.435 0.781 906 HG LEU 138 HG LEU 138 8.062 5.458 1.517 907 1HD1 LEU 138 1HD1 LEU 138 9.714 6.835 2.668 908 2HD1 LEU 138 2HD1 LEU 138 9.685 7.213 0.941 909 3HD1 LEU 138 3HD1 LEU 138 8.909 8.315 2.097 910 1HD2 LEU 138 1HD2 LEU 138 6.217 5.981 3.140 911 2HD2 LEU 138 2HD2 LEU 138 7.810 6.070 3.906 912 3HD2 LEU 138 3HD2 LEU 138 6.963 7.540 3.459 913 H THR 139 H THR 139 7.802 4.296 -1.308 914 HA THR 139 HA THR 139 5.302 3.970 -2.808 915 HB THR 139 HB THR 139 7.183 4.141 -4.428 916 HG1 THR 139 HG1 THR 139 5.656 2.808 -5.111 917 1HG2 THR 139 1HG2 THR 139 8.931 2.473 -4.469 918 2HG2 THR 139 2HG2 THR 139 8.935 3.371 -2.934 919 3HG2 THR 139 3HG2 THR 139 8.296 1.708 -2.997 920 H LEU 140 H LEU 140 4.748 1.713 -2.885 921 HA LEU 140 HA LEU 140 5.844 -0.022 -0.790 922 1HB LEU 140 1HB LEU 140 3.617 1.164 -0.066 923 2HB LEU 140 2HB LEU 140 2.823 0.220 -1.315 924 HG LEU 140 HG LEU 140 4.236 -0.750 1.185 925 1HD1 LEU 140 1HD1 LEU 140 2.022 -1.651 1.750 926 2HD1 LEU 140 2HD1 LEU 140 1.923 0.090 1.436 927 3HD1 LEU 140 3HD1 LEU 140 1.371 -1.068 0.205 928 1HD2 LEU 140 1HD2 LEU 140 4.848 -2.407 -0.448 929 2HD2 LEU 140 2HD2 LEU 140 3.478 -3.069 0.453 930 3HD2 LEU 140 3HD2 LEU 140 3.216 -2.378 -1.158 931 H SER 141 H SER 141 6.598 -1.605 -2.221 932 HA SER 141 HA SER 141 5.077 -2.224 -4.726 933 1HB SER 141 1HB SER 141 7.541 -2.066 -4.945 934 2HB SER 141 2HB SER 141 7.699 -3.391 -3.769 935 HG SER 141 HG SER 141 6.587 -3.381 -6.359 936 H TYR 142 H TYR 142 3.273 -3.341 -4.126 937 HA TYR 142 HA TYR 142 3.649 -5.464 -2.056 938 1HB TYR 142 1HB TYR 142 1.640 -3.681 -2.038 939 2HB TYR 142 2HB TYR 142 0.888 -4.934 -3.003 940 HD1 TYR 142 HD1 TYR 142 2.170 -7.412 -1.779 941 HD2 TYR 142 HD2 TYR 142 0.675 -3.834 0.125 942 HE1 TYR 142 HE1 TYR 142 1.957 -8.612 0.358 943 HE2 TYR 142 HE2 TYR 142 0.379 -5.100 2.219 944 HH TYR 142 HH TYR 142 0.589 -8.708 2.215 945 H THR 143 H THR 143 4.623 -7.088 -3.150 946 HA THR 143 HA THR 143 3.865 -7.686 -5.872 947 HB THR 143 HB THR 143 5.601 -9.520 -4.235 948 HG1 THR 143 HG1 THR 143 6.287 -6.865 -4.944 949 1HG2 THR 143 1HG2 THR 143 5.214 -9.795 -6.712 950 2HG2 THR 143 2HG2 THR 143 5.928 -8.194 -6.973 951 3HG2 THR 143 3HG2 THR 143 6.920 -9.502 -6.301 952 H PHE 144 H PHE 144 1.674 -8.042 -5.602 953 HA PHE 144 HA PHE 144 0.571 -10.370 -4.241 954 1HB PHE 144 1HB PHE 144 -0.316 -8.412 -6.366 955 2HB PHE 144 2HB PHE 144 -1.167 -9.911 -6.184 956 HD1 PHE 144 HD1 PHE 144 0.297 -7.733 -3.446 957 HD2 PHE 144 HD2 PHE 144 -3.275 -9.141 -5.413 958 HE1 PHE 144 HE1 PHE 144 -1.055 -7.071 -1.482 959 HE2 PHE 144 HE2 PHE 144 -4.622 -8.418 -3.464 960 HZ PHE 144 HZ PHE 144 -3.507 -7.460 -1.467 961 H TYR 145 H TYR 145 2.194 -11.897 -4.688 962 HA TYR 145 HA TYR 145 1.637 -13.378 -7.184 963 1HB TYR 145 1HB TYR 145 3.869 -13.510 -7.886 964 2HB TYR 145 2HB TYR 145 3.520 -11.804 -7.611 965 HD1 TYR 145 HD1 TYR 145 4.058 -12.684 -4.315 966 HD2 TYR 145 HD2 TYR 145 6.193 -12.543 -8.072 967 HE1 TYR 145 HE1 TYR 145 6.168 -12.551 -3.112 968 HE2 TYR 145 HE2 TYR 145 8.327 -12.348 -6.826 969 HH TYR 145 HH TYR 145 8.445 -12.347 -3.251 970 HA PRO 146 HA PRO 146 2.957 -16.019 -3.463 971 1HB PRO 146 1HB PRO 146 0.673 -16.857 -2.202 972 2HB PRO 146 2HB PRO 146 1.570 -15.368 -1.807 973 1HG PRO 146 1HG PRO 146 -0.895 -15.608 -3.552 974 2HG PRO 146 2HG PRO 146 -0.543 -14.437 -2.258 975 1HD PRO 146 1HD PRO 146 -0.131 -13.893 -4.920 976 2HD PRO 146 2HD PRO 146 0.906 -13.212 -3.624 977 H ARG 147 H ARG 147 -0.313 -17.147 -4.616 978 HA ARG 147 HA ARG 147 0.854 -19.362 -6.090 979 1HB ARG 147 1HB ARG 147 -0.643 -19.953 -3.494 980 2HB ARG 147 2HB ARG 147 -0.099 -21.127 -4.700 981 1HG ARG 147 1HG ARG 147 2.280 -20.377 -4.219 982 2HG ARG 147 2HG ARG 147 1.641 -19.447 -2.842 983 1HD ARG 147 1HD ARG 147 1.372 -22.449 -3.294 984 2HD ARG 147 2HD ARG 147 2.517 -21.659 -2.186 985 HE ARG 147 HE ARG 147 -0.047 -20.730 -1.502 986 1HH1 ARG 147 1HH1 ARG 147 1.720 -23.769 -1.505 987 2HH1 ARG 147 2HH1 ARG 147 0.863 -24.481 -0.172 988 1HH2 ARG 147 1HH2 ARG 147 -1.224 -21.622 0.293 989 2HH2 ARG 147 2HH2 ARG 147 -0.860 -23.213 0.874 990 H GLU 148 H GLU 148 -0.545 -19.433 -7.818 991 HA GLU 148 HA GLU 148 -3.417 -18.966 -7.375 992 1HB GLU 148 1HB GLU 148 -3.636 -19.119 -9.768 993 2HB GLU 148 2HB GLU 148 -2.445 -17.904 -9.310 994 1HG GLU 148 1HG GLU 148 -1.600 -20.693 -10.213 995 2HG GLU 148 2HG GLU 148 -1.946 -19.383 -11.338 996 HA PRO 149 HA PRO 149 -4.006 -23.455 -7.346 997 1HB PRO 149 1HB PRO 149 -6.701 -23.625 -7.786 998 2HB PRO 149 2HB PRO 149 -5.993 -23.053 -6.250 999 1HG PRO 149 1HG PRO 149 -7.103 -21.384 -8.504 1000 2HG PRO 149 2HG PRO 149 -7.352 -21.189 -6.753 1001 1HD PRO 149 1HD PRO 149 -5.491 -19.721 -8.159 1002 2HD PRO 149 2HD PRO 149 -5.231 -20.209 -6.454 1003 H SER 150 H SER 150 -5.619 -21.584 -9.901 1004 HA SER 150 HA SER 150 -4.465 -22.221 -12.207 1005 1HB SER 150 1HB SER 150 -5.975 -24.120 -13.152 1006 2HB SER 150 2HB SER 150 -4.524 -24.530 -12.233 1007 HG SER 150 HG SER 150 -5.728 -25.008 -10.487 1008 H LYS 151 H LYS 151 -5.362 -20.101 -12.362 1009 HA LYS 151 HA LYS 151 -8.192 -19.766 -11.986 1010 1HB LYS 151 1HB LYS 151 -7.810 -17.483 -12.042 1011 2HB LYS 151 2HB LYS 151 -6.335 -18.165 -11.378 1012 1HG LYS 151 1HG LYS 151 -5.415 -16.666 -12.887 1013 2HG LYS 151 2HG LYS 151 -5.524 -18.075 -13.927 1014 1HD LYS 151 1HD LYS 151 -8.025 -17.053 -14.316 1015 2HD LYS 151 2HD LYS 151 -7.244 -15.573 -13.780 1016 1HE LYS 151 1HE LYS 151 -5.651 -15.681 -15.639 1017 2HE LYS 151 2HE LYS 151 -6.175 -17.329 -16.047 1018 1HZ LYS 151 1HZ LYS 151 -7.884 -14.949 -16.267 1019 2HZ LYS 151 2HZ LYS 151 -7.182 -15.769 -17.516 1020 3HZ LYS 151 3HZ LYS 151 -8.322 -16.508 -16.581 Start of MODEL 9 1 H VAL 21 H VAL 21 -1.071 11.246 14.542 2 HA VAL 21 HA VAL 21 -1.216 8.272 14.701 3 HB VAL 21 HB VAL 21 -2.589 9.442 16.463 4 1HG1 VAL 21 1HG1 VAL 21 -4.645 10.566 15.917 5 2HG1 VAL 21 2HG1 VAL 21 -3.319 11.411 15.102 6 3HG1 VAL 21 3HG1 VAL 21 -4.392 10.339 14.182 7 1HG2 VAL 21 1HG2 VAL 21 -4.412 8.018 16.404 8 2HG2 VAL 21 2HG2 VAL 21 -4.442 7.889 14.651 9 3HG2 VAL 21 3HG2 VAL 21 -3.121 7.133 15.578 10 H GLU 22 H GLU 22 -3.485 7.976 13.040 11 HA GLU 22 HA GLU 22 -2.807 9.132 10.464 12 1HB GLU 22 1HB GLU 22 -5.164 7.565 11.545 13 2HB GLU 22 2HB GLU 22 -5.143 8.227 9.907 14 1HG GLU 22 1HG GLU 22 -3.221 6.992 9.256 15 2HG GLU 22 2HG GLU 22 -2.884 6.461 10.920 16 H GLN 23 H GLN 23 -2.535 11.187 11.604 17 HA GLN 23 HA GLN 23 -3.891 13.046 10.395 18 1HB GLN 23 1HB GLN 23 -5.507 12.358 12.752 19 2HB GLN 23 2HB GLN 23 -4.898 13.993 12.938 20 1HG GLN 23 1HG GLN 23 -6.244 13.021 10.398 21 2HG GLN 23 2HG GLN 23 -7.084 13.854 11.723 22 1HE2 GLN 23 1HE2 GLN 23 -4.784 14.290 9.036 23 2HE2 GLN 23 2HE2 GLN 23 -4.452 15.995 9.357 24 H ALA 24 H ALA 24 -1.807 13.732 10.122 25 HA ALA 24 HA ALA 24 -0.026 14.001 12.430 26 1HB ALA 24 1HB ALA 24 0.665 12.834 10.380 27 2HB ALA 24 2HB ALA 24 0.404 14.328 9.482 28 3HB ALA 24 3HB ALA 24 1.700 14.249 10.693 29 H SER 25 H SER 25 -2.222 16.084 11.309 30 HA SER 25 HA SER 25 -1.229 18.592 11.261 31 1HB SER 25 1HB SER 25 -3.809 17.769 12.641 32 2HB SER 25 2HB SER 25 -3.501 19.245 11.709 33 HG SER 25 HG SER 25 -4.664 17.344 10.740 34 H ASP 26 H ASP 26 0.462 17.979 12.809 35 HA ASP 26 HA ASP 26 0.323 19.448 15.338 36 1HB ASP 26 1HB ASP 26 -0.236 17.181 16.035 37 2HB ASP 26 2HB ASP 26 1.034 16.478 15.034 38 H LEU 27 H LEU 27 2.204 17.169 13.305 39 HA LEU 27 HA LEU 27 4.459 19.047 13.118 40 1HB LEU 27 1HB LEU 27 5.449 17.026 11.863 41 2HB LEU 27 2HB LEU 27 5.367 17.045 13.612 42 HG LEU 27 HG LEU 27 3.050 15.747 12.201 43 1HD1 LEU 27 1HD1 LEU 27 5.797 14.509 12.282 44 2HD1 LEU 27 2HD1 LEU 27 4.279 13.608 12.049 45 3HD1 LEU 27 3HD1 LEU 27 4.737 14.844 10.879 46 1HD2 LEU 27 1HD2 LEU 27 3.259 14.205 14.117 47 2HD2 LEU 27 2HD2 LEU 27 4.760 14.998 14.630 48 3HD2 LEU 27 3HD2 LEU 27 3.228 15.867 14.726 49 H ILE 28 H ILE 28 1.771 18.047 11.087 50 HA ILE 28 HA ILE 28 2.676 18.094 8.593 51 HB ILE 28 HB ILE 28 0.157 19.239 9.713 52 1HG1 ILE 28 1HG1 ILE 28 0.810 17.141 7.579 53 2HG1 ILE 28 2HG1 ILE 28 0.650 16.809 9.289 54 1HG2 ILE 28 1HG2 ILE 28 -0.785 19.654 7.497 55 2HG2 ILE 28 2HG2 ILE 28 0.515 20.785 7.805 56 3HG2 ILE 28 3HG2 ILE 28 0.794 19.366 6.751 57 1HD1 ILE 28 1HD1 ILE 28 -1.530 17.551 7.339 58 2HD1 ILE 28 2HD1 ILE 28 -1.472 16.199 8.484 59 3HD1 ILE 28 3HD1 ILE 28 -1.743 17.846 9.073 60 H LEU 29 H LEU 29 3.257 19.302 6.910 61 HA LEU 29 HA LEU 29 4.305 22.047 7.455 62 1HB LEU 29 1HB LEU 29 5.511 19.824 5.799 63 2HB LEU 29 2HB LEU 29 6.188 21.427 6.080 64 HG LEU 29 HG LEU 29 7.396 20.109 7.454 65 1HD1 LEU 29 1HD1 LEU 29 6.932 20.719 9.751 66 2HD1 LEU 29 2HD1 LEU 29 6.661 22.074 8.637 67 3HD1 LEU 29 3HD1 LEU 29 5.291 21.198 9.331 68 1HD2 LEU 29 1HD2 LEU 29 6.300 18.026 7.339 69 2HD2 LEU 29 2HD2 LEU 29 6.544 18.405 9.047 70 3HD2 LEU 29 3HD2 LEU 29 4.939 18.506 8.338 71 H ASP 30 H ASP 30 4.899 23.132 5.309 72 HA ASP 30 HA ASP 30 2.544 23.119 3.598 73 1HB ASP 30 1HB ASP 30 3.533 25.210 4.493 74 2HB ASP 30 2HB ASP 30 4.986 24.919 3.515 75 H GLU 31 H GLU 31 5.817 21.837 3.377 76 HA GLU 31 HA GLU 31 6.005 21.719 0.515 77 1HB GLU 31 1HB GLU 31 7.460 20.609 2.813 78 2HB GLU 31 2HB GLU 31 7.128 19.336 1.631 79 1HG GLU 31 1HG GLU 31 8.373 21.962 0.784 80 2HG GLU 31 2HG GLU 31 9.319 20.597 1.393 81 H LYS 32 H LYS 32 5.617 19.999 -0.929 82 HA LYS 32 HA LYS 32 3.318 18.338 -0.150 83 1HB LYS 32 1HB LYS 32 2.666 20.381 -1.459 84 2HB LYS 32 2HB LYS 32 3.679 19.811 -2.810 85 1HG LYS 32 1HG LYS 32 2.485 17.739 -2.896 86 2HG LYS 32 2HG LYS 32 1.642 18.097 -1.391 87 1HD LYS 32 1HD LYS 32 -0.038 18.449 -2.890 88 2HD LYS 32 2HD LYS 32 0.532 20.091 -2.591 89 1HE LYS 32 1HE LYS 32 1.701 20.148 -4.729 90 2HE LYS 32 2HE LYS 32 1.531 18.393 -4.930 91 1HZ LYS 32 1HZ LYS 32 -0.800 18.626 -5.098 92 2HZ LYS 32 2HZ LYS 32 -0.737 20.260 -4.966 93 3HZ LYS 32 3HZ LYS 32 -0.069 19.500 -6.276 94 H ILE 33 H ILE 33 4.260 16.455 0.048 95 HA ILE 33 HA ILE 33 6.424 15.528 -1.790 96 HB ILE 33 HB ILE 33 6.968 15.486 0.458 97 1HG1 ILE 33 1HG1 ILE 33 7.544 13.590 -1.132 98 2HG1 ILE 33 2HG1 ILE 33 7.858 13.391 0.602 99 1HG2 ILE 33 1HG2 ILE 33 4.887 15.520 1.589 100 2HG2 ILE 33 2HG2 ILE 33 4.446 13.918 0.986 101 3HG2 ILE 33 3HG2 ILE 33 5.781 14.093 2.144 102 1HD1 ILE 33 1HD1 ILE 33 5.436 12.261 -0.827 103 2HD1 ILE 33 2HD1 ILE 33 6.913 11.356 -0.447 104 3HD1 ILE 33 3HD1 ILE 33 5.896 12.016 0.851 105 H LYS 34 H LYS 34 6.230 13.745 -3.038 106 HA LYS 34 HA LYS 34 3.440 13.088 -3.801 107 1HB LYS 34 1HB LYS 34 5.053 14.364 -5.310 108 2HB LYS 34 2HB LYS 34 5.947 12.848 -5.497 109 1HG LYS 34 1HG LYS 34 2.961 13.052 -6.072 110 2HG LYS 34 2HG LYS 34 4.155 13.627 -7.216 111 1HD LYS 34 1HD LYS 34 5.021 10.992 -6.380 112 2HD LYS 34 2HD LYS 34 3.285 10.943 -6.681 113 1HE LYS 34 1HE LYS 34 3.804 12.152 -8.935 114 2HE LYS 34 2HE LYS 34 5.525 12.034 -8.515 115 1HZ LYS 34 1HZ LYS 34 5.213 10.275 -9.883 116 2HZ LYS 34 2HZ LYS 34 4.884 9.472 -8.470 117 3HZ LYS 34 3HZ LYS 34 3.672 10.040 -9.442 118 H VAL 35 H VAL 35 2.926 10.831 -4.272 119 HA VAL 35 HA VAL 35 4.818 8.812 -3.094 120 HB VAL 35 HB VAL 35 1.976 9.516 -2.458 121 1HG1 VAL 35 1HG1 VAL 35 1.939 7.071 -2.764 122 2HG1 VAL 35 2HG1 VAL 35 3.404 6.902 -1.780 123 3HG1 VAL 35 3HG1 VAL 35 1.882 7.439 -1.046 124 1HG2 VAL 35 1HG2 VAL 35 2.761 9.457 -0.129 125 2HG2 VAL 35 2HG2 VAL 35 4.389 9.003 -0.694 126 3HG2 VAL 35 3HG2 VAL 35 3.712 10.605 -1.081 127 H THR 36 H THR 36 5.192 7.521 -4.790 128 HA THR 36 HA THR 36 3.012 6.897 -6.724 129 HB THR 36 HB THR 36 6.039 6.740 -6.757 130 HG1 THR 36 HG1 THR 36 4.093 7.539 -8.637 131 1HG2 THR 36 1HG2 THR 36 5.921 5.531 -8.897 132 2HG2 THR 36 2HG2 THR 36 5.446 4.526 -7.529 133 3HG2 THR 36 3HG2 THR 36 4.196 5.186 -8.612 134 H PHE 37 H PHE 37 1.851 5.207 -6.473 135 HA PHE 37 HA PHE 37 2.602 3.149 -4.452 136 1HB PHE 37 1HB PHE 37 0.023 3.788 -5.943 137 2HB PHE 37 2HB PHE 37 0.239 2.477 -4.807 138 HD1 PHE 37 HD1 PHE 37 -1.348 5.437 -5.012 139 HD2 PHE 37 HD2 PHE 37 1.509 3.449 -2.457 140 HE1 PHE 37 HE1 PHE 37 -2.120 6.764 -3.082 141 HE2 PHE 37 HE2 PHE 37 0.828 4.903 -0.573 142 HZ PHE 37 HZ PHE 37 -0.936 6.633 -0.923 143 H ASP 38 H ASP 38 3.813 1.461 -5.382 144 HA ASP 38 HA ASP 38 3.241 0.814 -8.212 145 1HB ASP 38 1HB ASP 38 5.525 1.439 -7.726 146 2HB ASP 38 2HB ASP 38 5.664 0.170 -6.525 147 H ALA 39 H ALA 39 1.276 -0.273 -7.873 148 HA ALA 39 HA ALA 39 1.220 -2.691 -6.202 149 1HB ALA 39 1HB ALA 39 -0.737 -1.630 -8.280 150 2HB ALA 39 2HB ALA 39 -1.019 -3.012 -7.204 151 3HB ALA 39 3HB ALA 39 -0.840 -1.385 -6.517 152 H ASN 40 H ASN 40 1.690 -4.789 -6.972 153 HA ASN 40 HA ASN 40 2.067 -5.153 -9.914 154 1HB ASN 40 1HB ASN 40 3.797 -6.633 -8.004 155 2HB ASN 40 2HB ASN 40 4.128 -6.208 -9.665 156 1HD2 ASN 40 1HD2 ASN 40 3.678 -3.360 -9.169 157 2HD2 ASN 40 2HD2 ASN 40 5.033 -2.822 -8.154 158 H VAL 41 H VAL 41 1.450 -7.288 -10.622 159 HA VAL 41 HA VAL 41 0.486 -9.162 -8.599 160 HB VAL 41 HB VAL 41 -1.465 -7.761 -8.943 161 1HG1 VAL 41 1HG1 VAL 41 -1.269 -8.397 -11.917 162 2HG1 VAL 41 2HG1 VAL 41 -2.587 -7.530 -11.106 163 3HG1 VAL 41 3HG1 VAL 41 -0.972 -6.811 -11.168 164 1HG2 VAL 41 1HG2 VAL 41 -1.770 -10.234 -8.683 165 2HG2 VAL 41 2HG2 VAL 41 -3.089 -9.432 -9.548 166 3HG2 VAL 41 3HG2 VAL 41 -1.888 -10.373 -10.447 167 H ALA 42 H ALA 42 0.512 -11.237 -9.236 168 HA ALA 42 HA ALA 42 0.918 -11.952 -12.060 169 1HB ALA 42 1HB ALA 42 2.635 -12.984 -9.749 170 2HB ALA 42 2HB ALA 42 2.666 -13.594 -11.417 171 3HB ALA 42 3HB ALA 42 3.203 -11.941 -11.068 172 H ALA 43 H ALA 43 0.437 -14.342 -12.241 173 HA ALA 43 HA ALA 43 -2.105 -14.921 -11.532 174 1HB ALA 43 1HB ALA 43 -0.792 -16.216 -13.168 175 2HB ALA 43 2HB ALA 43 0.130 -16.972 -11.847 176 3HB ALA 43 3HB ALA 43 -1.611 -17.289 -12.015 177 H GLY 44 H GLY 44 0.712 -15.805 -9.618 178 1HA GLY 44 1HA GLY 44 -0.129 -17.388 -7.600 179 2HA GLY 44 2HA GLY 44 0.992 -16.051 -7.358 180 H LEU 45 H LEU 45 -1.044 -13.898 -7.856 181 HA LEU 45 HA LEU 45 -3.116 -14.530 -5.807 182 1HB LEU 45 1HB LEU 45 -1.246 -12.359 -5.727 183 2HB LEU 45 2HB LEU 45 -2.859 -11.715 -5.950 184 HG LEU 45 HG LEU 45 -2.451 -13.864 -3.821 185 1HD1 LEU 45 1HD1 LEU 45 -0.770 -11.920 -3.455 186 2HD1 LEU 45 2HD1 LEU 45 -2.182 -10.880 -3.290 187 3HD1 LEU 45 3HD1 LEU 45 -1.952 -12.200 -2.168 188 1HD2 LEU 45 1HD2 LEU 45 -4.674 -13.187 -4.557 189 2HD2 LEU 45 2HD2 LEU 45 -4.313 -12.758 -2.865 190 3HD2 LEU 45 3HD2 LEU 45 -4.286 -11.495 -4.131 191 HA PRO 46 HA PRO 46 -4.868 -13.986 -9.979 192 1HB PRO 46 1HB PRO 46 -6.747 -15.892 -9.933 193 2HB PRO 46 2HB PRO 46 -5.021 -16.342 -9.771 194 1HG PRO 46 1HG PRO 46 -6.990 -15.962 -7.508 195 2HG PRO 46 2HG PRO 46 -5.964 -17.374 -7.833 196 1HD PRO 46 1HD PRO 46 -5.190 -15.351 -6.141 197 2HD PRO 46 2HD PRO 46 -4.011 -16.253 -7.136 198 H TRP 47 H TRP 47 -5.367 -11.992 -8.103 199 HA TRP 47 HA TRP 47 -8.320 -11.806 -7.758 200 1HB TRP 47 1HB TRP 47 -6.111 -10.778 -5.970 201 2HB TRP 47 2HB TRP 47 -7.842 -10.467 -5.801 202 HD1 TRP 47 HD1 TRP 47 -7.685 -14.002 -6.633 203 HE1 TRP 47 HE1 TRP 47 -7.774 -15.488 -4.600 204 HE3 TRP 47 HE3 TRP 47 -6.459 -10.575 -3.027 205 HZ2 TRP 47 HZ2 TRP 47 -7.635 -15.235 -1.777 206 HZ3 TRP 47 HZ3 TRP 47 -5.738 -11.628 -0.873 207 HH2 TRP 47 HH2 TRP 47 -6.766 -13.664 -0.062 208 H GLU 48 H GLU 48 -9.227 -9.779 -8.343 209 HA GLU 48 HA GLU 48 -7.686 -8.304 -10.328 210 1HB GLU 48 1HB GLU 48 -10.173 -8.745 -10.415 211 2HB GLU 48 2HB GLU 48 -10.358 -7.662 -9.032 212 1HG GLU 48 1HG GLU 48 -9.158 -5.895 -10.563 213 2HG GLU 48 2HG GLU 48 -9.512 -6.992 -11.886 214 H PHE 49 H PHE 49 -5.922 -7.769 -8.841 215 HA PHE 49 HA PHE 49 -6.370 -5.867 -6.687 216 1HB PHE 49 1HB PHE 49 -4.758 -7.636 -6.474 217 2HB PHE 49 2HB PHE 49 -3.854 -7.050 -7.870 218 HD1 PHE 49 HD1 PHE 49 -1.744 -6.330 -7.100 219 HD2 PHE 49 HD2 PHE 49 -5.251 -5.313 -4.788 220 HE1 PHE 49 HE1 PHE 49 -0.323 -5.241 -5.414 221 HE2 PHE 49 HE2 PHE 49 -3.819 -4.154 -3.148 222 HZ PHE 49 HZ PHE 49 -1.350 -4.131 -3.436 223 H VAL 50 H VAL 50 -7.006 -3.867 -7.439 224 HA VAL 50 HA VAL 50 -5.381 -2.655 -9.635 225 HB VAL 50 HB VAL 50 -7.141 -1.186 -10.121 226 1HG1 VAL 50 1HG1 VAL 50 -8.879 -2.698 -10.811 227 2HG1 VAL 50 2HG1 VAL 50 -7.366 -3.624 -10.866 228 3HG1 VAL 50 3HG1 VAL 50 -8.507 -3.836 -9.509 229 1HG2 VAL 50 1HG2 VAL 50 -8.010 -0.561 -7.932 230 2HG2 VAL 50 2HG2 VAL 50 -9.331 -1.275 -8.874 231 3HG2 VAL 50 3HG2 VAL 50 -8.496 -2.249 -7.646 232 HA PRO 51 HA PRO 51 -3.854 0.198 -6.422 233 1HB PRO 51 1HB PRO 51 -2.608 2.046 -8.000 234 2HB PRO 51 2HB PRO 51 -1.914 0.420 -7.767 235 1HG PRO 51 1HG PRO 51 -3.619 1.395 -10.073 236 2HG PRO 51 2HG PRO 51 -2.076 0.498 -10.164 237 1HD PRO 51 1HD PRO 51 -4.535 -0.701 -10.362 238 2HD PRO 51 2HD PRO 51 -3.146 -1.541 -9.606 239 H VAL 52 H VAL 52 -4.319 2.476 -5.928 240 HA VAL 52 HA VAL 52 -7.092 3.027 -6.609 241 HB VAL 52 HB VAL 52 -5.343 4.843 -4.901 242 1HG1 VAL 52 1HG1 VAL 52 -7.473 5.098 -3.698 243 2HG1 VAL 52 2HG1 VAL 52 -7.658 5.500 -5.409 244 3HG1 VAL 52 3HG1 VAL 52 -8.257 3.954 -4.804 245 1HG2 VAL 52 1HG2 VAL 52 -6.231 2.036 -4.227 246 2HG2 VAL 52 2HG2 VAL 52 -4.661 2.809 -3.966 247 3HG2 VAL 52 3HG2 VAL 52 -6.039 3.278 -2.976 248 H GLN 53 H GLN 53 -4.086 4.893 -6.654 249 HA GLN 53 HA GLN 53 -4.536 5.836 -9.379 250 1HB GLN 53 1HB GLN 53 -3.661 7.637 -7.048 251 2HB GLN 53 2HB GLN 53 -3.490 8.028 -8.740 252 1HG GLN 53 1HG GLN 53 -5.373 9.220 -8.107 253 2HG GLN 53 2HG GLN 53 -5.971 7.858 -9.062 254 1HE2 GLN 53 1HE2 GLN 53 -4.952 8.009 -5.570 255 2HE2 GLN 53 2HE2 GLN 53 -6.528 7.537 -4.986 256 H ARG 54 H ARG 54 -2.318 6.133 -10.316 257 HA ARG 54 HA ARG 54 -0.461 4.245 -9.158 258 1HB ARG 54 1HB ARG 54 -0.818 5.243 -11.675 259 2HB ARG 54 2HB ARG 54 0.645 6.094 -11.194 260 1HG ARG 54 1HG ARG 54 0.178 3.065 -11.111 261 2HG ARG 54 2HG ARG 54 1.034 3.926 -12.386 262 1HD ARG 54 1HD ARG 54 2.677 4.654 -10.698 263 2HD ARG 54 2HD ARG 54 1.735 3.792 -9.505 264 HE ARG 54 HE ARG 54 2.777 1.870 -9.953 265 1HH1 ARG 54 1HH1 ARG 54 3.059 3.872 -12.819 266 2HH1 ARG 54 2HH1 ARG 54 4.153 2.810 -13.662 267 1HH2 ARG 54 1HH2 ARG 54 4.394 0.515 -10.947 268 2HH2 ARG 54 2HH2 ARG 54 4.842 0.799 -12.588 269 H ASP 55 H ASP 55 -1.015 7.740 -8.673 270 HA ASP 55 HA ASP 55 0.860 7.619 -6.579 271 1HB ASP 55 1HB ASP 55 2.466 9.112 -7.254 272 2HB ASP 55 2HB ASP 55 2.205 8.170 -8.709 273 H ILE 56 H ILE 56 0.851 9.635 -5.301 274 HA ILE 56 HA ILE 56 -1.543 11.326 -5.590 275 HB ILE 56 HB ILE 56 -2.111 11.234 -3.260 276 1HG1 ILE 56 1HG1 ILE 56 -0.089 8.994 -3.167 277 2HG1 ILE 56 2HG1 ILE 56 0.110 10.605 -2.432 278 1HG2 ILE 56 1HG2 ILE 56 -3.224 9.751 -4.925 279 2HG2 ILE 56 2HG2 ILE 56 -2.063 8.467 -4.497 280 3HG2 ILE 56 3HG2 ILE 56 -3.209 9.096 -3.279 281 1HD1 ILE 56 1HD1 ILE 56 -0.459 9.029 -0.705 282 2HD1 ILE 56 2HD1 ILE 56 -1.738 10.227 -0.917 283 3HD1 ILE 56 3HD1 ILE 56 -1.969 8.586 -1.528 284 H ASP 57 H ASP 57 -1.312 13.382 -4.289 285 HA ASP 57 HA ASP 57 1.426 13.964 -3.347 286 1HB ASP 57 1HB ASP 57 0.730 16.301 -3.604 287 2HB ASP 57 2HB ASP 57 0.770 15.420 -5.135 288 H VAL 58 H VAL 58 1.682 14.401 -1.248 289 HA VAL 58 HA VAL 58 -0.631 14.817 0.621 290 HB VAL 58 HB VAL 58 0.692 13.313 2.197 291 1HG1 VAL 58 1HG1 VAL 58 -1.567 12.883 1.404 292 2HG1 VAL 58 2HG1 VAL 58 -0.934 12.200 -0.107 293 3HG1 VAL 58 3HG1 VAL 58 -0.637 11.372 1.436 294 1HG2 VAL 58 1HG2 VAL 58 2.637 12.869 0.624 295 2HG2 VAL 58 2HG2 VAL 58 1.827 11.412 1.216 296 3HG2 VAL 58 3HG2 VAL 58 1.524 11.987 -0.433 297 H ARG 59 H ARG 59 -0.263 16.601 1.843 298 HA ARG 59 HA ARG 59 2.346 17.882 1.789 299 1HB ARG 59 1HB ARG 59 -0.184 18.696 3.252 300 2HB ARG 59 2HB ARG 59 1.311 19.606 3.126 301 1HG ARG 59 1HG ARG 59 0.468 18.710 0.466 302 2HG ARG 59 2HG ARG 59 -0.884 19.504 1.256 303 1HD ARG 59 1HD ARG 59 1.907 20.697 1.232 304 2HD ARG 59 2HD ARG 59 0.782 20.925 -0.094 305 HE ARG 59 HE ARG 59 -0.479 21.464 2.455 306 1HH1 ARG 59 1HH1 ARG 59 2.060 22.998 0.543 307 2HH1 ARG 59 2HH1 ARG 59 1.596 24.579 1.019 308 1HH2 ARG 59 1HH2 ARG 59 -0.681 23.638 3.369 309 2HH2 ARG 59 2HH2 ARG 59 0.467 24.827 2.746 310 H ILE 60 H ILE 60 3.524 16.261 2.663 311 HA ILE 60 HA ILE 60 4.303 14.779 4.280 312 HB ILE 60 HB ILE 60 5.110 17.413 5.504 313 1HG1 ILE 60 1HG1 ILE 60 6.398 16.102 3.094 314 2HG1 ILE 60 2HG1 ILE 60 5.442 17.592 3.047 315 1HG2 ILE 60 1HG2 ILE 60 6.722 14.851 5.077 316 2HG2 ILE 60 2HG2 ILE 60 7.028 16.156 6.242 317 3HG2 ILE 60 3HG2 ILE 60 5.705 15.038 6.502 318 1HD1 ILE 60 1HD1 ILE 60 7.991 17.213 4.672 319 2HD1 ILE 60 2HD1 ILE 60 7.872 18.024 3.130 320 3HD1 ILE 60 3HD1 ILE 60 7.002 18.686 4.540 321 H GLY 61 H GLY 61 2.107 14.166 5.084 322 1HA GLY 61 1HA GLY 61 1.635 13.408 7.385 323 2HA GLY 61 2HA GLY 61 1.658 15.079 7.911 324 H GLU 62 H GLU 62 0.349 15.839 5.296 325 HA GLU 62 HA GLU 62 -2.370 15.861 5.858 326 1HB GLU 62 1HB GLU 62 -1.041 16.940 4.014 327 2HB GLU 62 2HB GLU 62 -1.215 15.414 3.113 328 1HG GLU 62 1HG GLU 62 -3.644 15.737 3.031 329 2HG GLU 62 2HG GLU 62 -3.515 17.174 4.074 330 H THR 63 H THR 63 -3.561 14.106 6.516 331 HA THR 63 HA THR 63 -3.251 11.416 5.541 332 HB THR 63 HB THR 63 -5.552 11.396 6.891 333 HG1 THR 63 HG1 THR 63 -5.750 13.655 6.846 334 1HG2 THR 63 1HG2 THR 63 -3.473 10.420 7.720 335 2HG2 THR 63 2HG2 THR 63 -2.879 12.033 8.204 336 3HG2 THR 63 3HG2 THR 63 -4.336 11.329 8.956 337 H VAL 64 H VAL 64 -3.810 10.983 3.436 338 HA VAL 64 HA VAL 64 -6.515 11.944 2.536 339 HB VAL 64 HB VAL 64 -4.815 12.899 1.173 340 1HG1 VAL 64 1HG1 VAL 64 -4.040 10.073 0.298 341 2HG1 VAL 64 2HG1 VAL 64 -3.360 11.613 -0.269 342 3HG1 VAL 64 3HG1 VAL 64 -3.069 11.066 1.396 343 1HG2 VAL 64 1HG2 VAL 64 -6.979 12.329 0.154 344 2HG2 VAL 64 2HG2 VAL 64 -5.635 12.321 -1.001 345 3HG2 VAL 64 3HG2 VAL 64 -6.292 10.787 -0.416 346 H GLN 65 H GLN 65 -7.829 10.532 1.575 347 HA GLN 65 HA GLN 65 -7.555 7.734 2.471 348 1HB GLN 65 1HB GLN 65 -9.899 7.496 2.000 349 2HB GLN 65 2HB GLN 65 -9.563 8.870 3.047 350 1HG GLN 65 1HG GLN 65 -10.955 10.015 1.736 351 2HG GLN 65 2HG GLN 65 -9.635 10.132 0.577 352 1HE2 GLN 65 1HE2 GLN 65 -9.548 8.356 -1.109 353 2HE2 GLN 65 2HE2 GLN 65 -11.091 7.707 -1.668 354 H ILE 66 H ILE 66 -7.105 6.048 1.172 355 HA ILE 66 HA ILE 66 -7.537 6.238 -1.720 356 HB ILE 66 HB ILE 66 -5.151 5.183 -1.993 357 1HG1 ILE 66 1HG1 ILE 66 -3.423 6.350 -0.674 358 2HG1 ILE 66 2HG1 ILE 66 -4.629 6.953 0.457 359 1HG2 ILE 66 1HG2 ILE 66 -6.052 7.325 -2.948 360 2HG2 ILE 66 2HG2 ILE 66 -5.376 8.158 -1.525 361 3HG2 ILE 66 3HG2 ILE 66 -4.314 7.276 -2.639 362 1HD1 ILE 66 1HD1 ILE 66 -4.074 3.998 -0.064 363 2HD1 ILE 66 2HD1 ILE 66 -3.312 4.949 1.216 364 3HD1 ILE 66 3HD1 ILE 66 -5.066 4.718 1.241 365 H MET 67 H MET 67 -9.143 4.739 -1.625 366 HA MET 67 HA MET 67 -8.706 2.336 -0.058 367 1HB MET 67 1HB MET 67 -10.958 1.769 -0.464 368 2HB MET 67 2HB MET 67 -10.918 3.528 -0.281 369 1HG MET 67 1HG MET 67 -12.416 3.131 -1.947 370 2HG MET 67 2HG MET 67 -10.969 3.612 -2.857 371 1HE MET 67 1HE MET 67 -12.248 2.674 -5.049 372 2HE MET 67 2HE MET 67 -12.914 1.025 -5.158 373 3HE MET 67 3HE MET 67 -13.639 2.196 -4.038 374 H TYR 68 H TYR 68 -8.285 0.295 -0.643 375 HA TYR 68 HA TYR 68 -7.246 -0.100 -3.444 376 1HB TYR 68 1HB TYR 68 -6.385 -1.122 -0.740 377 2HB TYR 68 2HB TYR 68 -6.205 -2.162 -2.140 378 HD1 TYR 68 HD1 TYR 68 -5.065 1.046 -0.648 379 HD2 TYR 68 HD2 TYR 68 -4.649 -1.720 -3.933 380 HE1 TYR 68 HE1 TYR 68 -2.837 2.006 -1.190 381 HE2 TYR 68 HE2 TYR 68 -2.414 -0.804 -4.429 382 HH TYR 68 HH TYR 68 -0.729 0.570 -3.692 383 H ARG 69 H ARG 69 -7.697 -2.178 -4.400 384 HA ARG 69 HA ARG 69 -10.053 -3.596 -3.310 385 1HB ARG 69 1HB ARG 69 -10.713 -1.682 -4.856 386 2HB ARG 69 2HB ARG 69 -9.896 -2.547 -6.139 387 1HG ARG 69 1HG ARG 69 -11.404 -4.470 -5.878 388 2HG ARG 69 2HG ARG 69 -12.169 -3.691 -4.485 389 1HD ARG 69 1HD ARG 69 -13.605 -3.245 -6.401 390 2HD ARG 69 2HD ARG 69 -12.845 -1.767 -5.880 391 HE ARG 69 HE ARG 69 -11.756 -1.534 -7.851 392 1HH1 ARG 69 1HH1 ARG 69 -12.755 -4.860 -7.524 393 2HH1 ARG 69 2HH1 ARG 69 -12.416 -5.334 -9.178 394 1HH2 ARG 69 1HH2 ARG 69 -11.279 -2.075 -10.085 395 2HH2 ARG 69 2HH2 ARG 69 -11.549 -3.704 -10.645 396 H ALA 70 H ALA 70 -9.576 -5.730 -3.303 397 HA ALA 70 HA ALA 70 -8.510 -6.877 -5.822 398 1HB ALA 70 1HB ALA 70 -6.938 -7.167 -3.802 399 2HB ALA 70 2HB ALA 70 -8.195 -8.261 -3.166 400 3HB ALA 70 3HB ALA 70 -7.408 -8.608 -4.709 401 H LYS 71 H LYS 71 -9.741 -8.851 -6.450 402 HA LYS 71 HA LYS 71 -11.859 -9.775 -4.663 403 1HB LYS 71 1HB LYS 71 -12.485 -9.180 -7.590 404 2HB LYS 71 2HB LYS 71 -13.586 -9.775 -6.333 405 1HG LYS 71 1HG LYS 71 -13.132 -7.500 -5.158 406 2HG LYS 71 2HG LYS 71 -12.430 -6.989 -6.699 407 1HD LYS 71 1HD LYS 71 -15.252 -8.009 -6.144 408 2HD LYS 71 2HD LYS 71 -14.799 -6.329 -6.460 409 1HE LYS 71 1HE LYS 71 -14.033 -7.023 -8.771 410 2HE LYS 71 2HE LYS 71 -14.582 -8.670 -8.440 411 1HZ LYS 71 1HZ LYS 71 -16.190 -7.431 -9.661 412 2HZ LYS 71 2HZ LYS 71 -16.799 -7.835 -8.186 413 3HZ LYS 71 3HZ LYS 71 -16.306 -6.290 -8.481 414 H ASN 72 H ASN 72 -12.079 -12.088 -4.986 415 HA ASN 72 HA ASN 72 -9.813 -13.162 -6.486 416 1HB ASN 72 1HB ASN 72 -10.257 -13.967 -4.231 417 2HB ASN 72 2HB ASN 72 -11.842 -14.577 -4.729 418 1HD2 ASN 72 1HD2 ASN 72 -10.477 -16.540 -3.624 419 2HD2 ASN 72 2HD2 ASN 72 -9.786 -17.622 -4.827 420 H LEU 73 H LEU 73 -9.804 -13.835 -8.540 421 HA LEU 73 HA LEU 73 -12.385 -14.616 -9.827 422 1HB LEU 73 1HB LEU 73 -9.754 -13.541 -10.885 423 2HB LEU 73 2HB LEU 73 -10.916 -14.346 -11.926 424 HG LEU 73 HG LEU 73 -11.111 -11.979 -12.130 425 1HD1 LEU 73 1HD1 LEU 73 -13.139 -13.419 -12.397 426 2HD1 LEU 73 2HD1 LEU 73 -13.613 -13.006 -10.733 427 3HD1 LEU 73 3HD1 LEU 73 -13.491 -11.738 -11.959 428 1HD2 LEU 73 1HD2 LEU 73 -11.878 -10.490 -10.406 429 2HD2 LEU 73 2HD2 LEU 73 -12.015 -11.806 -9.235 430 3HD2 LEU 73 3HD2 LEU 73 -10.410 -11.317 -9.845 431 H ALA 74 H ALA 74 -9.736 -16.199 -8.401 432 HA ALA 74 HA ALA 74 -9.735 -18.411 -10.383 433 1HB ALA 74 1HB ALA 74 -8.462 -18.157 -7.627 434 2HB ALA 74 2HB ALA 74 -8.290 -19.543 -8.726 435 3HB ALA 74 3HB ALA 74 -7.659 -17.963 -9.206 436 H SER 75 H SER 75 -10.963 -20.299 -10.100 437 HA SER 75 HA SER 75 -13.224 -20.138 -8.370 438 1HB SER 75 1HB SER 75 -12.266 -22.512 -9.993 439 2HB SER 75 2HB SER 75 -13.912 -22.167 -9.425 440 HG SER 75 HG SER 75 -13.755 -21.439 -11.540 441 H THR 76 H THR 76 -10.834 -20.149 -6.745 442 HA THR 76 HA THR 76 -11.529 -22.220 -4.868 443 HB THR 76 HB THR 76 -8.991 -22.802 -4.661 444 HG1 THR 76 HG1 THR 76 -8.448 -21.010 -6.115 445 1HG2 THR 76 1HG2 THR 76 -10.649 -24.408 -5.716 446 2HG2 THR 76 2HG2 THR 76 -10.151 -23.768 -7.300 447 3HG2 THR 76 3HG2 THR 76 -8.971 -24.579 -6.266 448 HA PRO 77 HA PRO 77 -10.150 -18.862 -2.276 449 1HB PRO 77 1HB PRO 77 -9.248 -20.152 -0.020 450 2HB PRO 77 2HB PRO 77 -10.979 -19.998 -0.411 451 1HG PRO 77 1HG PRO 77 -9.160 -22.347 -0.986 452 2HG PRO 77 2HG PRO 77 -10.782 -22.373 -0.232 453 1HD PRO 77 1HD PRO 77 -10.432 -22.903 -2.866 454 2HD PRO 77 2HD PRO 77 -11.842 -21.961 -2.316 455 H THR 78 H THR 78 -8.129 -17.838 -1.974 456 HA THR 78 HA THR 78 -5.647 -19.470 -2.338 457 HB THR 78 HB THR 78 -4.538 -17.665 -3.431 458 HG1 THR 78 HG1 THR 78 -5.360 -15.724 -3.717 459 1HG2 THR 78 1HG2 THR 78 -5.706 -17.488 -5.492 460 2HG2 THR 78 2HG2 THR 78 -6.156 -19.082 -4.858 461 3HG2 THR 78 3HG2 THR 78 -7.289 -17.707 -4.724 462 H THR 79 H THR 79 -3.747 -17.918 -1.427 463 HA THR 79 HA THR 79 -4.617 -16.771 1.147 464 HB THR 79 HB THR 79 -3.834 -19.001 1.670 465 HG1 THR 79 HG1 THR 79 -3.334 -17.324 3.089 466 1HG2 THR 79 1HG2 THR 79 -1.203 -18.274 0.337 467 2HG2 THR 79 2HG2 THR 79 -1.516 -19.698 1.337 468 3HG2 THR 79 3HG2 THR 79 -2.365 -19.504 -0.209 469 H GLY 80 H GLY 80 -3.914 -14.793 1.314 470 1HA GLY 80 1HA GLY 80 -1.913 -13.701 -0.545 471 2HA GLY 80 2HA GLY 80 -3.140 -12.818 0.351 472 H GLN 81 H GLN 81 0.024 -13.924 0.329 473 HA GLN 81 HA GLN 81 0.540 -12.400 2.732 474 1HB GLN 81 1HB GLN 81 2.386 -14.352 3.285 475 2HB GLN 81 2HB GLN 81 0.845 -14.128 4.074 476 1HG GLN 81 1HG GLN 81 1.121 -16.434 3.654 477 2HG GLN 81 2HG GLN 81 -0.239 -15.849 2.714 478 1HE2 GLN 81 1HE2 GLN 81 2.738 -14.913 1.223 479 2HE2 GLN 81 2HE2 GLN 81 2.872 -16.284 0.134 480 H ALA 82 H ALA 82 0.575 -11.531 0.295 481 HA ALA 82 HA ALA 82 2.835 -12.132 -1.336 482 1HB ALA 82 1HB ALA 82 1.200 -11.042 -2.475 483 2HB ALA 82 2HB ALA 82 0.803 -9.945 -1.155 484 3HB ALA 82 3HB ALA 82 2.274 -9.659 -2.101 485 H THR 83 H THR 83 4.823 -11.147 -1.585 486 HA THR 83 HA THR 83 5.846 -9.708 0.719 487 HB THR 83 HB THR 83 7.394 -10.138 -1.777 488 HG1 THR 83 HG1 THR 83 6.620 -12.116 0.091 489 1HG2 THR 83 1HG2 THR 83 9.229 -10.616 -0.171 490 2HG2 THR 83 2HG2 THR 83 8.526 -9.017 0.118 491 3HG2 THR 83 3HG2 THR 83 8.104 -10.382 1.180 492 H PHE 84 H PHE 84 6.886 -7.573 0.536 493 HA PHE 84 HA PHE 84 6.358 -6.040 -1.875 494 1HB PHE 84 1HB PHE 84 5.136 -4.271 -0.621 495 2HB PHE 84 2HB PHE 84 4.248 -5.786 -0.725 496 HD1 PHE 84 HD1 PHE 84 6.177 -3.617 1.591 497 HD2 PHE 84 HD2 PHE 84 3.633 -7.082 1.205 498 HE1 PHE 84 HE1 PHE 84 5.791 -3.614 4.037 499 HE2 PHE 84 HE2 PHE 84 3.191 -7.028 3.629 500 HZ PHE 84 HZ PHE 84 4.273 -5.304 5.064 501 H ASN 85 H ASN 85 7.611 -4.223 -1.992 502 HA ASN 85 HA ASN 85 9.807 -3.832 0.018 503 1HB ASN 85 1HB ASN 85 10.789 -4.370 -2.077 504 2HB ASN 85 2HB ASN 85 9.621 -3.408 -2.974 505 1HD2 ASN 85 1HD2 ASN 85 9.665 -1.007 -2.582 506 2HD2 ASN 85 2HD2 ASN 85 11.209 -0.220 -2.391 507 H VAL 86 H VAL 86 8.784 -2.440 1.405 508 HA VAL 86 HA VAL 86 7.231 -0.123 0.380 509 HB VAL 86 HB VAL 86 6.270 -1.335 2.177 510 1HG1 VAL 86 1HG1 VAL 86 8.222 -2.335 3.323 511 2HG1 VAL 86 2HG1 VAL 86 8.592 -0.753 4.038 512 3HG1 VAL 86 3HG1 VAL 86 7.071 -1.549 4.402 513 1HG2 VAL 86 1HG2 VAL 86 5.811 0.463 3.710 514 2HG2 VAL 86 2HG2 VAL 86 7.259 1.334 3.170 515 3HG2 VAL 86 3HG2 VAL 86 5.910 1.060 2.044 516 H THR 87 H THR 87 8.967 1.059 -0.696 517 HA THR 87 HA THR 87 10.240 2.911 0.718 518 HB THR 87 HB THR 87 11.679 1.234 1.824 519 HG1 THR 87 HG1 THR 87 13.640 2.230 1.343 520 1HG2 THR 87 1HG2 THR 87 11.757 -0.407 0.049 521 2HG2 THR 87 2HG2 THR 87 12.807 0.665 -0.912 522 3HG2 THR 87 3HG2 THR 87 13.372 0.020 0.641 523 HA PRO 88 HA PRO 88 11.451 3.802 -3.564 524 1HB PRO 88 1HB PRO 88 13.178 5.957 -2.987 525 2HB PRO 88 2HB PRO 88 11.447 6.115 -3.289 526 1HG PRO 88 1HG PRO 88 12.878 6.212 -0.690 527 2HG PRO 88 2HG PRO 88 11.350 6.983 -1.152 528 1HD PRO 88 1HD PRO 88 11.616 4.668 0.400 529 2HD PRO 88 2HD PRO 88 10.125 5.153 -0.430 530 H MET 89 H MET 89 13.479 3.589 -0.674 531 HA MET 89 HA MET 89 15.217 1.666 -1.432 532 1HB MET 89 1HB MET 89 17.374 2.901 -1.868 533 2HB MET 89 2HB MET 89 16.235 2.837 -3.187 534 1HG MET 89 1HG MET 89 15.510 5.260 -2.297 535 2HG MET 89 2HG MET 89 17.105 5.194 -1.541 536 1HE MET 89 1HE MET 89 16.396 5.321 -6.088 537 2HE MET 89 2HE MET 89 15.987 3.856 -5.175 538 3HE MET 89 3HE MET 89 15.098 5.369 -4.872 539 H ALA 90 H ALA 90 15.896 4.906 -0.070 540 HA ALA 90 HA ALA 90 17.288 3.744 2.160 541 1HB ALA 90 1HB ALA 90 17.752 6.086 2.720 542 2HB ALA 90 2HB ALA 90 17.955 5.832 0.972 543 3HB ALA 90 3HB ALA 90 16.482 6.609 1.588 544 H ALA 91 H ALA 91 14.120 5.314 1.771 545 HA ALA 91 HA ALA 91 13.688 5.663 4.634 546 1HB ALA 91 1HB ALA 91 11.843 6.115 2.283 547 2HB ALA 91 2HB ALA 91 11.579 6.604 3.983 548 3HB ALA 91 3HB ALA 91 12.929 7.283 3.055 549 H GLY 92 H GLY 92 10.779 4.638 3.290 550 1HA GLY 92 1HA GLY 92 9.490 2.765 3.556 551 2HA GLY 92 2HA GLY 92 10.939 1.785 3.833 552 H ALA 93 H ALA 93 12.093 2.722 6.038 553 HA ALA 93 HA ALA 93 10.864 1.626 8.208 554 1HB ALA 93 1HB ALA 93 13.183 2.425 8.208 555 2HB ALA 93 2HB ALA 93 12.638 4.114 8.184 556 3HB ALA 93 3HB ALA 93 12.306 3.092 9.598 557 H TYR 94 H TYR 94 10.720 5.207 7.504 558 HA TYR 94 HA TYR 94 8.655 5.625 9.414 559 1HB TYR 94 1HB TYR 94 9.767 7.392 7.204 560 2HB TYR 94 2HB TYR 94 8.851 7.868 8.633 561 HD1 TYR 94 HD1 TYR 94 9.903 6.698 10.927 562 HD2 TYR 94 HD2 TYR 94 12.006 8.171 7.457 563 HE1 TYR 94 HE1 TYR 94 11.894 7.083 12.301 564 HE2 TYR 94 HE2 TYR 94 13.985 8.639 8.872 565 HH TYR 94 HH TYR 94 13.607 8.676 12.354 566 H PHE 95 H PHE 95 8.330 4.254 6.326 567 HA PHE 95 HA PHE 95 6.152 5.673 5.230 568 1HB PHE 95 1HB PHE 95 7.462 3.827 4.132 569 2HB PHE 95 2HB PHE 95 6.604 2.665 5.140 570 HD1 PHE 95 HD1 PHE 95 3.988 2.579 4.938 571 HD2 PHE 95 HD2 PHE 95 6.630 4.300 1.982 572 HE1 PHE 95 HE1 PHE 95 2.244 2.327 3.214 573 HE2 PHE 95 HE2 PHE 95 4.850 4.110 0.285 574 HZ PHE 95 HZ PHE 95 2.657 3.099 0.887 575 H ASN 96 H ASN 96 4.200 6.071 6.110 576 HA ASN 96 HA ASN 96 3.912 5.282 8.696 577 1HB ASN 96 1HB ASN 96 1.921 6.690 6.897 578 2HB ASN 96 2HB ASN 96 1.637 6.420 8.624 579 1HD2 ASN 96 1HD2 ASN 96 3.340 8.411 6.336 580 2HD2 ASN 96 2HD2 ASN 96 4.378 9.232 7.508 581 H LYS 97 H LYS 97 2.757 3.817 9.876 582 HA LYS 97 HA LYS 97 1.968 1.411 8.379 583 1HB LYS 97 1HB LYS 97 2.354 1.881 11.369 584 2HB LYS 97 2HB LYS 97 1.958 0.354 10.577 585 1HG LYS 97 1HG LYS 97 4.215 0.096 10.751 586 2HG LYS 97 2HG LYS 97 4.106 0.806 9.134 587 1HD LYS 97 1HD LYS 97 4.628 3.078 10.220 588 2HD LYS 97 2HD LYS 97 4.751 2.242 11.767 589 1HE LYS 97 1HE LYS 97 6.943 2.682 10.832 590 2HE LYS 97 2HE LYS 97 6.687 0.934 10.899 591 1HZ LYS 97 1HZ LYS 97 7.652 1.981 8.827 592 2HZ LYS 97 2HZ LYS 97 6.428 0.893 8.569 593 3HZ LYS 97 3HZ LYS 97 6.156 2.511 8.461 594 H VAL 98 H VAL 98 0.143 2.420 7.466 595 HA VAL 98 HA VAL 98 -1.951 3.643 8.689 596 HB VAL 98 HB VAL 98 -3.337 2.982 6.785 597 1HG1 VAL 98 1HG1 VAL 98 -1.950 3.835 5.015 598 2HG1 VAL 98 2HG1 VAL 98 -1.489 4.669 6.518 599 3HG1 VAL 98 3HG1 VAL 98 -0.466 3.379 5.846 600 1HG2 VAL 98 1HG2 VAL 98 -1.106 0.998 6.142 601 2HG2 VAL 98 2HG2 VAL 98 -2.785 0.583 6.569 602 3HG2 VAL 98 3HG2 VAL 98 -2.432 1.414 5.051 603 H GLN 99 H GLN 99 -3.958 3.149 9.478 604 HA GLN 99 HA GLN 99 -5.163 2.181 11.137 605 1HB GLN 99 1HB GLN 99 -6.580 0.304 10.128 606 2HB GLN 99 2HB GLN 99 -6.523 1.877 9.344 607 1HG GLN 99 1HG GLN 99 -4.898 1.021 7.663 608 2HG GLN 99 2HG GLN 99 -5.014 -0.588 8.384 609 1HE2 GLN 99 1HE2 GLN 99 -7.124 2.069 7.104 610 2HE2 GLN 99 2HE2 GLN 99 -8.137 1.013 6.129 611 H CYS 100 H CYS 100 -4.999 -1.164 10.380 612 HA CYS 100 HA CYS 100 -2.654 -1.744 11.954 613 1HB CYS 100 1HB CYS 100 -3.787 -3.077 13.669 614 2HB CYS 100 2HB CYS 100 -4.269 -1.380 13.814 615 HG CYS 100 HG CYS 100 -5.914 -3.716 12.124 616 H PHE 101 H PHE 101 -1.911 -3.779 11.353 617 HA PHE 101 HA PHE 101 -1.576 -5.416 9.822 618 1HB PHE 101 1HB PHE 101 -3.432 -6.399 11.266 619 2HB PHE 101 2HB PHE 101 -4.554 -6.005 9.966 620 HD1 PHE 101 HD1 PHE 101 -2.192 -6.875 7.758 621 HD2 PHE 101 HD2 PHE 101 -4.211 -8.704 11.129 622 HE1 PHE 101 HE1 PHE 101 -1.914 -9.070 6.738 623 HE2 PHE 101 HE2 PHE 101 -3.881 -10.924 10.090 624 HZ PHE 101 HZ PHE 101 -2.742 -11.115 7.887 625 H CYS 102 H CYS 102 -1.347 -3.215 8.596 626 HA CYS 102 HA CYS 102 -3.223 -2.370 6.694 627 1HB CYS 102 1HB CYS 102 -1.422 -1.259 5.585 628 2HB CYS 102 2HB CYS 102 -1.082 -1.178 7.332 629 HG CYS 102 HG CYS 102 1.126 -1.491 6.002 630 H PHE 103 H PHE 103 -3.496 -2.821 4.473 631 HA PHE 103 HA PHE 103 -4.014 -4.290 2.818 632 1HB PHE 103 1HB PHE 103 -1.059 -4.931 3.124 633 2HB PHE 103 2HB PHE 103 -2.062 -5.492 1.806 634 HD1 PHE 103 HD1 PHE 103 -2.735 -4.054 -0.017 635 HD2 PHE 103 HD2 PHE 103 -0.541 -2.469 3.337 636 HE1 PHE 103 HE1 PHE 103 -2.296 -1.975 -1.287 637 HE2 PHE 103 HE2 PHE 103 -0.119 -0.376 2.067 638 HZ PHE 103 HZ PHE 103 -0.985 -0.129 -0.250 639 H THR 104 H THR 104 -5.250 -5.278 4.816 640 HA THR 104 HA THR 104 -4.454 -7.808 5.768 641 HB THR 104 HB THR 104 -7.358 -6.967 5.649 642 HG1 THR 104 HG1 THR 104 -5.395 -5.514 7.068 643 1HG2 THR 104 1HG2 THR 104 -7.276 -7.559 8.019 644 2HG2 THR 104 2HG2 THR 104 -6.622 -8.889 7.042 645 3HG2 THR 104 3HG2 THR 104 -5.521 -7.814 7.930 646 H GLU 105 H GLU 105 -3.873 -8.378 3.302 647 HA GLU 105 HA GLU 105 -5.910 -8.887 1.473 648 1HB GLU 105 1HB GLU 105 -4.186 -10.060 0.158 649 2HB GLU 105 2HB GLU 105 -3.754 -8.447 0.710 650 1HG GLU 105 1HG GLU 105 -2.409 -9.455 2.603 651 2HG GLU 105 2HG GLU 105 -2.829 -11.053 1.991 652 H THR 106 H THR 106 -4.585 -11.078 3.884 653 HA THR 106 HA THR 106 -5.381 -13.103 4.676 654 HB THR 106 HB THR 106 -6.995 -11.432 5.439 655 HG1 THR 106 HG1 THR 106 -8.535 -12.973 6.019 656 1HG2 THR 106 1HG2 THR 106 -8.770 -12.267 3.092 657 2HG2 THR 106 2HG2 THR 106 -9.320 -11.431 4.548 658 3HG2 THR 106 3HG2 THR 106 -8.185 -10.650 3.463 659 H THR 107 H THR 107 -8.002 -14.167 3.782 660 HA THR 107 HA THR 107 -7.272 -15.533 1.235 661 HB THR 107 HB THR 107 -8.076 -16.570 3.942 662 HG1 THR 107 HG1 THR 107 -6.502 -17.591 1.826 663 1HG2 THR 107 1HG2 THR 107 -9.957 -17.426 2.595 664 2HG2 THR 107 2HG2 THR 107 -8.848 -17.935 1.305 665 3HG2 THR 107 3HG2 THR 107 -8.814 -18.738 2.886 666 H LEU 108 H LEU 108 -8.902 -15.424 -0.221 667 HA LEU 108 HA LEU 108 -11.620 -14.496 0.608 668 1HB LEU 108 1HB LEU 108 -10.113 -13.875 -1.960 669 2HB LEU 108 2HB LEU 108 -11.769 -13.403 -1.622 670 HG LEU 108 HG LEU 108 -9.320 -12.439 -0.145 671 1HD1 LEU 108 1HD1 LEU 108 -9.509 -10.407 -1.389 672 2HD1 LEU 108 2HD1 LEU 108 -9.598 -11.713 -2.572 673 3HD1 LEU 108 3HD1 LEU 108 -11.084 -10.890 -2.077 674 1HD2 LEU 108 1HD2 LEU 108 -11.311 -12.374 1.320 675 2HD2 LEU 108 2HD2 LEU 108 -10.808 -10.748 0.866 676 3HD2 LEU 108 3HD2 LEU 108 -12.211 -11.493 0.066 677 H GLU 109 H GLU 109 -12.855 -16.313 0.399 678 HA GLU 109 HA GLU 109 -12.453 -18.446 -1.283 679 1HB GLU 109 1HB GLU 109 -14.894 -17.127 -0.081 680 2HB GLU 109 2HB GLU 109 -15.102 -18.531 -1.107 681 1HG GLU 109 1HG GLU 109 -14.956 -19.150 1.282 682 2HG GLU 109 2HG GLU 109 -13.654 -19.883 0.335 683 HA PRO 110 HA PRO 110 -12.816 -17.373 -5.353 684 1HB PRO 110 1HB PRO 110 -14.314 -19.344 -6.568 685 2HB PRO 110 2HB PRO 110 -12.700 -19.503 -5.840 686 1HG PRO 110 1HG PRO 110 -15.315 -20.201 -4.526 687 2HG PRO 110 2HG PRO 110 -13.849 -21.232 -4.686 688 1HD PRO 110 1HD PRO 110 -14.256 -19.833 -2.451 689 2HD PRO 110 2HD PRO 110 -12.641 -19.879 -3.159 690 H GLY 111 H GLY 111 -13.775 -15.404 -5.541 691 1HA GLY 111 1HA GLY 111 -15.533 -14.417 -7.017 692 2HA GLY 111 2HA GLY 111 -16.728 -15.256 -6.011 693 H GLU 112 H GLU 112 -14.510 -14.630 -3.678 694 HA GLU 112 HA GLU 112 -16.299 -12.598 -2.825 695 1HB GLU 112 1HB GLU 112 -13.902 -13.890 -1.476 696 2HB GLU 112 2HB GLU 112 -15.041 -12.792 -0.706 697 1HG GLU 112 1HG GLU 112 -15.696 -15.479 -1.823 698 2HG GLU 112 2HG GLU 112 -15.677 -14.967 -0.132 699 H GLU 113 H GLU 113 -15.820 -10.599 -1.992 700 HA GLU 113 HA GLU 113 -13.961 -9.088 -3.728 701 1HB GLU 113 1HB GLU 113 -16.356 -8.708 -4.045 702 2HB GLU 113 2HB GLU 113 -16.569 -8.386 -2.323 703 1HG GLU 113 1HG GLU 113 -14.640 -6.617 -3.668 704 2HG GLU 113 2HG GLU 113 -16.322 -6.529 -4.230 705 H MET 114 H MET 114 -12.458 -7.659 -2.834 706 HA MET 114 HA MET 114 -12.593 -7.048 0.047 707 1HB MET 114 1HB MET 114 -10.969 -8.927 -0.551 708 2HB MET 114 2HB MET 114 -10.077 -7.803 -1.562 709 1HG MET 114 1HG MET 114 -9.984 -6.285 0.573 710 2HG MET 114 2HG MET 114 -10.723 -7.665 1.388 711 1HE MET 114 1HE MET 114 -6.406 -7.336 -0.235 712 2HE MET 114 2HE MET 114 -7.839 -7.202 -1.272 713 3HE MET 114 3HE MET 114 -7.533 -5.978 -0.035 714 H GLU 115 H GLU 115 -13.659 -5.126 -0.942 715 HA GLU 115 HA GLU 115 -11.739 -3.107 -1.991 716 1HB GLU 115 1HB GLU 115 -14.025 -3.562 -3.035 717 2HB GLU 115 2HB GLU 115 -14.747 -2.870 -1.586 718 1HG GLU 115 1HG GLU 115 -13.611 -0.730 -2.002 719 2HG GLU 115 2HG GLU 115 -12.700 -1.437 -3.345 720 H MET 116 H MET 116 -10.648 -1.951 -0.421 721 HA MET 116 HA MET 116 -12.021 -1.514 2.201 722 1HB MET 116 1HB MET 116 -9.236 -2.633 1.854 723 2HB MET 116 2HB MET 116 -10.005 -2.166 3.384 724 1HG MET 116 1HG MET 116 -11.867 -3.826 2.826 725 2HG MET 116 2HG MET 116 -10.840 -4.398 1.513 726 1HE MET 116 1HE MET 116 -8.264 -5.156 2.039 727 2HE MET 116 2HE MET 116 -7.927 -3.982 3.335 728 3HE MET 116 3HE MET 116 -7.732 -5.722 3.636 729 HA PRO 117 HA PRO 117 -10.029 2.456 1.531 730 1HB PRO 117 1HB PRO 117 -11.122 3.901 3.531 731 2HB PRO 117 2HB PRO 117 -11.922 3.512 1.992 732 1HG PRO 117 1HG PRO 117 -12.370 2.187 4.641 733 2HG PRO 117 2HG PRO 117 -13.520 2.570 3.312 734 1HD PRO 117 1HD PRO 117 -12.345 0.061 3.784 735 2HD PRO 117 2HD PRO 117 -13.068 0.590 2.233 736 H VAL 118 H VAL 118 -8.286 3.400 2.192 737 HA VAL 118 HA VAL 118 -6.976 2.760 4.762 738 HB VAL 118 HB VAL 118 -5.838 2.616 1.927 739 1HG1 VAL 118 1HG1 VAL 118 -4.320 2.725 4.551 740 2HG1 VAL 118 2HG1 VAL 118 -3.616 2.277 2.977 741 3HG1 VAL 118 3HG1 VAL 118 -4.231 3.907 3.228 742 1HG2 VAL 118 1HG2 VAL 118 -6.828 0.521 2.726 743 2HG2 VAL 118 2HG2 VAL 118 -5.069 0.387 2.613 744 3HG2 VAL 118 3HG2 VAL 118 -5.839 0.599 4.201 745 H VAL 119 H VAL 119 -5.672 4.602 5.421 746 HA VAL 119 HA VAL 119 -6.007 7.071 3.838 747 HB VAL 119 HB VAL 119 -7.485 7.176 5.799 748 1HG1 VAL 119 1HG1 VAL 119 -4.976 6.860 7.491 749 2HG1 VAL 119 2HG1 VAL 119 -6.612 7.199 8.079 750 3HG1 VAL 119 3HG1 VAL 119 -6.257 5.640 7.328 751 1HG2 VAL 119 1HG2 VAL 119 -6.440 9.246 4.996 752 2HG2 VAL 119 2HG2 VAL 119 -6.667 9.271 6.750 753 3HG2 VAL 119 3HG2 VAL 119 -5.050 8.984 6.075 754 H PHE 120 H PHE 120 -4.025 8.245 3.634 755 HA PHE 120 HA PHE 120 -1.665 7.086 4.992 756 1HB PHE 120 1HB PHE 120 -2.048 5.842 2.812 757 2HB PHE 120 2HB PHE 120 -1.864 7.371 1.965 758 HD1 PHE 120 HD1 PHE 120 -0.093 5.353 4.616 759 HD2 PHE 120 HD2 PHE 120 0.338 7.836 1.125 760 HE1 PHE 120 HE1 PHE 120 2.343 5.017 4.688 761 HE2 PHE 120 HE2 PHE 120 2.794 7.470 1.188 762 HZ PHE 120 HZ PHE 120 3.795 6.074 2.972 763 H PHE 121 H PHE 121 0.252 8.323 4.800 764 HA PHE 121 HA PHE 121 0.393 10.862 3.520 765 1HB PHE 121 1HB PHE 121 0.740 12.146 5.560 766 2HB PHE 121 2HB PHE 121 -0.893 11.508 5.536 767 HD1 PHE 121 HD1 PHE 121 -1.503 9.518 6.923 768 HD2 PHE 121 HD2 PHE 121 2.346 11.374 7.264 769 HE1 PHE 121 HE1 PHE 121 -1.149 8.407 9.132 770 HE2 PHE 121 HE2 PHE 121 2.569 10.510 9.590 771 HZ PHE 121 HZ PHE 121 0.805 9.040 10.533 772 H VAL 122 H VAL 122 2.667 11.741 4.136 773 HA VAL 122 HA VAL 122 4.567 9.522 4.788 774 HB VAL 122 HB VAL 122 4.773 11.847 2.854 775 1HG1 VAL 122 1HG1 VAL 122 6.905 11.864 3.889 776 2HG1 VAL 122 2HG1 VAL 122 6.975 10.102 4.021 777 3HG1 VAL 122 3HG1 VAL 122 7.133 10.883 2.441 778 1HG2 VAL 122 1HG2 VAL 122 4.907 8.806 2.602 779 2HG2 VAL 122 2HG2 VAL 122 3.649 9.877 1.980 780 3HG2 VAL 122 3HG2 VAL 122 5.273 9.925 1.282 781 H ASP 123 H ASP 123 6.343 10.061 6.193 782 HA ASP 123 HA ASP 123 5.513 11.889 8.261 783 1HB ASP 123 1HB ASP 123 7.502 10.897 9.358 784 2HB ASP 123 2HB ASP 123 6.485 9.632 8.652 785 HA PRO 124 HA PRO 124 8.750 14.927 6.988 786 1HB PRO 124 1HB PRO 124 8.887 15.807 9.810 787 2HB PRO 124 2HB PRO 124 8.429 16.754 8.372 788 1HG PRO 124 1HG PRO 124 6.636 15.982 10.294 789 2HG PRO 124 2HG PRO 124 6.140 16.075 8.585 790 1HD PRO 124 1HD PRO 124 6.852 13.624 10.157 791 2HD PRO 124 2HD PRO 124 5.583 13.907 8.931 792 H GLU 125 H GLU 125 9.109 12.509 9.542 793 HA GLU 125 HA GLU 125 11.521 13.231 10.629 794 1HB GLU 125 1HB GLU 125 9.825 11.548 11.445 795 2HB GLU 125 2HB GLU 125 10.521 10.379 10.302 796 1HG GLU 125 1HG GLU 125 12.694 10.628 11.294 797 2HG GLU 125 2HG GLU 125 12.121 11.948 12.334 798 H ILE 126 H ILE 126 10.838 11.291 7.760 799 HA ILE 126 HA ILE 126 13.174 10.373 6.841 800 HB ILE 126 HB ILE 126 11.001 10.267 5.774 801 1HG1 ILE 126 1HG1 ILE 126 13.163 11.201 3.834 802 2HG1 ILE 126 2HG1 ILE 126 13.149 9.636 4.685 803 1HG2 ILE 126 1HG2 ILE 126 10.490 12.761 5.893 804 2HG2 ILE 126 2HG2 ILE 126 11.568 12.969 4.505 805 3HG2 ILE 126 3HG2 ILE 126 10.111 11.976 4.357 806 1HD1 ILE 126 1HD1 ILE 126 11.017 10.595 2.757 807 2HD1 ILE 126 2HD1 ILE 126 12.232 9.324 2.514 808 3HD1 ILE 126 3HD1 ILE 126 10.967 9.105 3.742 809 H VAL 127 H VAL 127 12.537 13.909 7.032 810 HA VAL 127 HA VAL 127 15.252 14.356 5.801 811 HB VAL 127 HB VAL 127 14.441 16.708 5.432 812 1HG1 VAL 127 1HG1 VAL 127 13.144 14.439 3.888 813 2HG1 VAL 127 2HG1 VAL 127 13.316 16.117 3.337 814 3HG1 VAL 127 3HG1 VAL 127 14.757 15.129 3.626 815 1HG2 VAL 127 1HG2 VAL 127 11.667 15.485 5.724 816 2HG2 VAL 127 2HG2 VAL 127 12.413 16.584 6.912 817 3HG2 VAL 127 3HG2 VAL 127 12.085 17.142 5.263 818 H LYS 128 H LYS 128 14.530 13.671 8.711 819 HA LYS 128 HA LYS 128 15.935 15.931 10.024 820 1HB LYS 128 1HB LYS 128 14.655 13.396 11.050 821 2HB LYS 128 2HB LYS 128 15.819 14.301 11.998 822 1HG LYS 128 1HG LYS 128 13.541 14.842 12.570 823 2HG LYS 128 2HG LYS 128 14.470 16.252 12.070 824 1HD LYS 128 1HD LYS 128 12.837 14.871 9.956 825 2HD LYS 128 2HD LYS 128 11.904 15.616 11.236 826 1HE LYS 128 1HE LYS 128 13.966 17.088 9.521 827 2HE LYS 128 2HE LYS 128 12.226 17.053 9.225 828 1HZ LYS 128 1HZ LYS 128 11.898 18.106 11.351 829 2HZ LYS 128 2HZ LYS 128 13.524 18.149 11.627 830 3HZ LYS 128 3HZ LYS 128 12.877 19.014 10.388 831 HA PRO 129 HA PRO 129 19.315 12.640 10.511 832 1HB PRO 129 1HB PRO 129 19.264 10.212 9.341 833 2HB PRO 129 2HB PRO 129 18.111 10.593 10.635 834 1HG PRO 129 1HG PRO 129 17.676 10.889 7.650 835 2HG PRO 129 2HG PRO 129 16.690 9.898 8.758 836 1HD PRO 129 1HD PRO 129 15.982 12.368 8.135 837 2HD PRO 129 2HD PRO 129 15.796 11.796 9.826 838 H VAL 130 H VAL 130 21.013 11.213 8.711 839 HA VAL 130 HA VAL 130 21.470 13.250 6.560 840 HB VAL 130 HB VAL 130 23.215 11.112 7.871 841 1HG1 VAL 130 1HG1 VAL 130 23.807 13.034 5.592 842 2HG1 VAL 130 2HG1 VAL 130 25.023 12.066 6.468 843 3HG1 VAL 130 3HG1 VAL 130 23.770 11.252 5.516 844 1HG2 VAL 130 1HG2 VAL 130 24.539 13.059 8.624 845 2HG2 VAL 130 2HG2 VAL 130 23.350 14.160 7.894 846 3HG2 VAL 130 3HG2 VAL 130 22.892 13.128 9.268 847 H GLU 131 H GLU 131 21.355 9.826 7.308 848 HA GLU 131 HA GLU 131 21.656 8.358 5.121 849 1HB GLU 131 1HB GLU 131 19.379 7.998 7.090 850 2HB GLU 131 2HB GLU 131 20.135 6.773 6.052 851 1HG GLU 131 1HG GLU 131 21.411 6.418 7.864 852 2HG GLU 131 2HG GLU 131 22.393 7.725 7.244 853 H THR 132 H THR 132 18.343 9.586 5.832 854 HA THR 132 HA THR 132 17.599 8.925 3.106 855 HB THR 132 HB THR 132 15.299 9.627 4.147 856 HG1 THR 132 HG1 THR 132 15.874 10.632 5.991 857 1HG2 THR 132 1HG2 THR 132 16.898 7.262 5.231 858 2HG2 THR 132 2HG2 THR 132 15.144 7.472 5.399 859 3HG2 THR 132 3HG2 THR 132 15.858 7.292 3.786 860 H GLN 133 H GLN 133 19.015 11.656 4.379 861 HA GLN 133 HA GLN 133 17.195 13.722 3.996 862 1HB GLN 133 1HB GLN 133 19.423 13.750 5.194 863 2HB GLN 133 2HB GLN 133 20.219 13.869 3.635 864 1HG GLN 133 1HG GLN 133 20.049 16.069 4.621 865 2HG GLN 133 2HG GLN 133 19.025 16.005 3.180 866 1HE2 GLN 133 1HE2 GLN 133 18.645 15.035 6.688 867 2HE2 GLN 133 2HE2 GLN 133 17.163 15.939 6.896 868 H GLY 134 H GLY 134 16.084 14.033 2.144 869 1HA GLY 134 1HA GLY 134 16.324 15.320 0.008 870 2HA GLY 134 2HA GLY 134 17.543 14.142 -0.487 871 H ILE 135 H ILE 135 15.907 11.923 0.918 872 HA ILE 135 HA ILE 135 14.406 11.107 -1.404 873 HB ILE 135 HB ILE 135 14.414 10.071 1.436 874 1HG1 ILE 135 1HG1 ILE 135 16.607 9.819 0.395 875 2HG1 ILE 135 2HG1 ILE 135 15.758 8.278 0.465 876 1HG2 ILE 135 1HG2 ILE 135 13.394 8.045 0.509 877 2HG2 ILE 135 2HG2 ILE 135 12.312 9.422 0.321 878 3HG2 ILE 135 3HG2 ILE 135 13.201 8.835 -1.077 879 1HD1 ILE 135 1HD1 ILE 135 15.174 8.450 -1.924 880 2HD1 ILE 135 2HD1 ILE 135 16.090 9.979 -2.025 881 3HD1 ILE 135 3HD1 ILE 135 16.917 8.459 -1.626 882 H LYS 136 H LYS 136 12.440 11.712 -2.012 883 HA LYS 136 HA LYS 136 10.345 11.987 -0.041 884 1HB LYS 136 1HB LYS 136 9.634 14.226 -0.684 885 2HB LYS 136 2HB LYS 136 11.091 14.121 0.291 886 1HG LYS 136 1HG LYS 136 12.497 14.452 -1.722 887 2HG LYS 136 2HG LYS 136 11.025 14.556 -2.721 888 1HD LYS 136 1HD LYS 136 10.160 16.331 -1.149 889 2HD LYS 136 2HD LYS 136 11.709 16.274 -0.298 890 1HE LYS 136 1HE LYS 136 12.860 17.042 -2.401 891 2HE LYS 136 2HE LYS 136 11.293 17.064 -3.236 892 1HZ LYS 136 1HZ LYS 136 12.014 18.776 -0.940 893 2HZ LYS 136 2HZ LYS 136 11.851 19.263 -2.501 894 3HZ LYS 136 3HZ LYS 136 10.557 18.766 -1.638 895 H THR 137 H THR 137 10.608 10.026 -1.903 896 HA THR 137 HA THR 137 8.068 10.456 -3.248 897 HB THR 137 HB THR 137 9.146 8.931 -5.157 898 HG1 THR 137 HG1 THR 137 11.271 9.655 -5.599 899 1HG2 THR 137 1HG2 THR 137 9.542 11.948 -5.078 900 2HG2 THR 137 2HG2 THR 137 9.371 10.937 -6.531 901 3HG2 THR 137 3HG2 THR 137 8.002 11.129 -5.407 902 H LEU 138 H LEU 138 7.176 9.244 -1.606 903 HA LEU 138 HA LEU 138 8.786 7.002 -0.653 904 1HB LEU 138 1HB LEU 138 7.508 8.875 0.618 905 2HB LEU 138 2HB LEU 138 6.149 7.735 0.589 906 HG LEU 138 HG LEU 138 8.077 6.059 1.342 907 1HD1 LEU 138 1HD1 LEU 138 9.934 7.671 1.198 908 2HD1 LEU 138 2HD1 LEU 138 9.100 8.731 2.356 909 3HD1 LEU 138 3HD1 LEU 138 9.685 7.138 2.871 910 1HD2 LEU 138 1HD2 LEU 138 7.556 6.379 3.699 911 2HD2 LEU 138 2HD2 LEU 138 6.932 7.996 3.401 912 3HD2 LEU 138 3HD2 LEU 138 6.068 6.593 2.762 913 H THR 139 H THR 139 8.681 5.366 -2.159 914 HA THR 139 HA THR 139 5.975 4.534 -3.000 915 HB THR 139 HB THR 139 7.330 5.306 -4.830 916 HG1 THR 139 HG1 THR 139 5.880 3.705 -5.307 917 1HG2 THR 139 1HG2 THR 139 9.171 3.015 -4.089 918 2HG2 THR 139 2HG2 THR 139 9.217 3.918 -5.618 919 3HG2 THR 139 3HG2 THR 139 9.543 4.770 -4.088 920 H LEU 140 H LEU 140 6.051 2.237 -3.822 921 HA LEU 140 HA LEU 140 6.651 0.372 -1.648 922 1HB LEU 140 1HB LEU 140 4.853 1.681 -0.723 923 2HB LEU 140 2HB LEU 140 3.982 1.710 -2.257 924 HG LEU 140 HG LEU 140 3.145 0.317 -0.237 925 1HD1 LEU 140 1HD1 LEU 140 1.849 -1.050 -1.672 926 2HD1 LEU 140 2HD1 LEU 140 2.114 0.476 -2.505 927 3HD1 LEU 140 3HD1 LEU 140 3.038 -0.960 -2.980 928 1HD2 LEU 140 1HD2 LEU 140 3.769 -2.021 -0.203 929 2HD2 LEU 140 2HD2 LEU 140 4.981 -1.773 -1.468 930 3HD2 LEU 140 3HD2 LEU 140 5.173 -1.010 0.123 931 H SER 141 H SER 141 7.214 -1.294 -3.042 932 HA SER 141 HA SER 141 5.681 -1.853 -5.542 933 1HB SER 141 1HB SER 141 7.856 -1.920 -6.187 934 2HB SER 141 2HB SER 141 8.430 -2.554 -4.638 935 HG SER 141 HG SER 141 6.863 -4.042 -6.500 936 H TYR 142 H TYR 142 3.947 -3.173 -5.112 937 HA TYR 142 HA TYR 142 4.182 -5.087 -2.811 938 1HB TYR 142 1HB TYR 142 2.475 -3.098 -2.820 939 2HB TYR 142 2HB TYR 142 1.515 -4.154 -3.835 940 HD1 TYR 142 HD1 TYR 142 1.688 -3.023 -0.625 941 HD2 TYR 142 HD2 TYR 142 1.792 -6.818 -2.682 942 HE1 TYR 142 HE1 TYR 142 0.999 -4.172 1.440 943 HE2 TYR 142 HE2 TYR 142 1.069 -7.927 -0.604 944 HH TYR 142 HH TYR 142 -0.069 -7.566 1.363 945 H THR 143 H THR 143 4.510 -7.143 -3.484 946 HA THR 143 HA THR 143 3.818 -7.785 -6.269 947 HB THR 143 HB THR 143 5.570 -9.426 -4.428 948 HG1 THR 143 HG1 THR 143 7.278 -8.012 -5.084 949 1HG2 THR 143 1HG2 THR 143 5.052 -10.153 -6.796 950 2HG2 THR 143 2HG2 THR 143 5.781 -8.643 -7.378 951 3HG2 THR 143 3HG2 THR 143 6.779 -9.836 -6.526 952 H PHE 144 H PHE 144 1.599 -8.159 -6.082 953 HA PHE 144 HA PHE 144 0.610 -10.338 -4.433 954 1HB PHE 144 1HB PHE 144 -0.473 -8.605 -6.627 955 2HB PHE 144 2HB PHE 144 -1.184 -10.166 -6.415 956 HD1 PHE 144 HD1 PHE 144 0.126 -8.180 -3.529 957 HD2 PHE 144 HD2 PHE 144 -3.343 -9.371 -5.794 958 HE1 PHE 144 HE1 PHE 144 -1.335 -7.532 -1.640 959 HE2 PHE 144 HE2 PHE 144 -4.802 -8.636 -3.930 960 HZ PHE 144 HZ PHE 144 -3.794 -7.725 -1.847 961 H TYR 145 H TYR 145 2.280 -11.878 -4.780 962 HA TYR 145 HA TYR 145 1.780 -13.622 -7.163 963 1HB TYR 145 1HB TYR 145 4.104 -13.828 -7.543 964 2HB TYR 145 2HB TYR 145 3.729 -12.119 -7.436 965 HD1 TYR 145 HD1 TYR 145 3.751 -12.971 -4.013 966 HD2 TYR 145 HD2 TYR 145 6.447 -12.740 -7.393 967 HE1 TYR 145 HE1 TYR 145 5.629 -12.904 -2.504 968 HE2 TYR 145 HE2 TYR 145 8.345 -12.480 -5.814 969 HH TYR 145 HH TYR 145 7.857 -12.418 -2.264 970 HA PRO 146 HA PRO 146 2.996 -16.041 -3.184 971 1HB PRO 146 1HB PRO 146 0.757 -16.589 -1.684 972 2HB PRO 146 2HB PRO 146 1.739 -15.104 -1.542 973 1HG PRO 146 1HG PRO 146 -0.810 -15.431 -3.138 974 2HG PRO 146 2HG PRO 146 -0.368 -14.151 -1.976 975 1HD PRO 146 1HD PRO 146 -0.030 -13.799 -4.641 976 2HD PRO 146 2HD PRO 146 1.151 -13.170 -3.436 977 H ARG 147 H ARG 147 -0.414 -17.273 -3.730 978 HA ARG 147 HA ARG 147 0.640 -19.237 -5.598 979 1HB ARG 147 1HB ARG 147 -0.038 -21.188 -4.240 980 2HB ARG 147 2HB ARG 147 1.429 -20.384 -3.673 981 1HG ARG 147 1HG ARG 147 0.314 -19.364 -1.824 982 2HG ARG 147 2HG ARG 147 -1.289 -19.788 -2.429 983 1HD ARG 147 1HD ARG 147 0.806 -21.825 -1.532 984 2HD ARG 147 2HD ARG 147 -0.489 -21.203 -0.538 985 HE ARG 147 HE ARG 147 -2.143 -22.264 -1.761 986 1HH1 ARG 147 1HH1 ARG 147 1.030 -23.062 -3.101 987 2HH1 ARG 147 2HH1 ARG 147 0.484 -24.457 -3.974 988 1HH2 ARG 147 1HH2 ARG 147 -2.905 -24.072 -2.948 989 2HH2 ARG 147 2HH2 ARG 147 -1.815 -25.022 -3.902 990 H GLU 148 H GLU 148 -0.841 -20.215 -6.856 991 HA GLU 148 HA GLU 148 -3.665 -20.140 -6.163 992 1HB GLU 148 1HB GLU 148 -4.335 -18.801 -7.864 993 2HB GLU 148 2HB GLU 148 -2.773 -18.066 -7.574 994 1HG GLU 148 1HG GLU 148 -2.609 -18.210 -9.826 995 2HG GLU 148 2HG GLU 148 -2.020 -19.828 -9.524 996 HA PRO 149 HA PRO 149 -2.897 -24.151 -7.902 997 1HB PRO 149 1HB PRO 149 -5.384 -25.184 -8.281 998 2HB PRO 149 2HB PRO 149 -4.715 -24.816 -6.665 999 1HG PRO 149 1HG PRO 149 -6.581 -23.094 -8.322 1000 2HG PRO 149 2HG PRO 149 -6.713 -23.549 -6.596 1001 1HD PRO 149 1HD PRO 149 -5.644 -21.153 -7.407 1002 2HD PRO 149 2HD PRO 149 -5.042 -22.025 -5.971 1003 H SER 150 H SER 150 -4.987 -22.027 -9.858 1004 HA SER 150 HA SER 150 -4.168 -22.095 -12.313 1005 1HB SER 150 1HB SER 150 -5.497 -24.804 -11.932 1006 2HB SER 150 2HB SER 150 -5.570 -23.953 -13.479 1007 HG SER 150 HG SER 150 -3.195 -24.630 -12.121 1008 H LYS 151 H LYS 151 -5.406 -20.184 -12.145 1009 HA LYS 151 HA LYS 151 -8.200 -20.216 -11.614 1010 1HB LYS 151 1HB LYS 151 -8.117 -17.835 -12.097 1011 2HB LYS 151 2HB LYS 151 -6.666 -18.316 -11.212 1012 1HG LYS 151 1HG LYS 151 -5.532 -18.549 -13.537 1013 2HG LYS 151 2HG LYS 151 -6.951 -17.655 -14.142 1014 1HD LYS 151 1HD LYS 151 -6.385 -15.789 -12.560 1015 2HD LYS 151 2HD LYS 151 -5.023 -16.758 -11.959 1016 1HE LYS 151 1HE LYS 151 -4.268 -15.041 -13.571 1017 2HE LYS 151 2HE LYS 151 -3.868 -16.696 -14.055 1018 1HZ LYS 151 1HZ LYS 151 -6.159 -15.156 -15.092 1019 2HZ LYS 151 2HZ LYS 151 -4.731 -15.385 -15.880 1020 3HZ LYS 151 3HZ LYS 151 -5.708 -16.667 -15.564 Start of MODEL 10 1 H VAL 21 H VAL 21 -2.029 11.628 16.226 2 HA VAL 21 HA VAL 21 -1.524 8.739 15.694 3 HB VAL 21 HB VAL 21 -2.018 9.128 17.971 4 1HG1 VAL 21 1HG1 VAL 21 -4.648 10.479 17.227 5 2HG1 VAL 21 2HG1 VAL 21 -4.063 10.079 18.844 6 3HG1 VAL 21 3HG1 VAL 21 -3.219 11.302 17.893 7 1HG2 VAL 21 1HG2 VAL 21 -2.976 7.125 16.868 8 2HG2 VAL 21 2HG2 VAL 21 -3.937 7.664 18.255 9 3HG2 VAL 21 3HG2 VAL 21 -4.500 8.002 16.609 10 H GLU 22 H GLU 22 -2.194 8.183 13.771 11 HA GLU 22 HA GLU 22 -2.992 8.516 11.710 12 1HB GLU 22 1HB GLU 22 -4.216 6.676 13.093 13 2HB GLU 22 2HB GLU 22 -5.658 7.648 12.798 14 1HG GLU 22 1HG GLU 22 -5.449 7.333 10.416 15 2HG GLU 22 2HG GLU 22 -3.756 6.840 10.548 16 H GLN 23 H GLN 23 -2.592 10.800 11.655 17 HA GLN 23 HA GLN 23 -4.516 12.600 10.844 18 1HB GLN 23 1HB GLN 23 -3.543 12.726 13.762 19 2HB GLN 23 2HB GLN 23 -3.888 14.190 12.857 20 1HG GLN 23 1HG GLN 23 -5.866 12.033 13.654 21 2HG GLN 23 2HG GLN 23 -5.779 13.702 14.214 22 1HE2 GLN 23 1HE2 GLN 23 -5.349 15.004 11.649 23 2HE2 GLN 23 2HE2 GLN 23 -6.787 14.731 10.686 24 H ALA 24 H ALA 24 -3.224 14.211 9.959 25 HA ALA 24 HA ALA 24 -1.251 12.689 8.898 26 1HB ALA 24 1HB ALA 24 -0.950 15.412 8.008 27 2HB ALA 24 2HB ALA 24 -1.749 13.978 7.254 28 3HB ALA 24 3HB ALA 24 -2.654 15.080 8.317 29 H SER 25 H SER 25 -0.673 15.930 10.325 30 HA SER 25 HA SER 25 1.234 14.853 11.956 31 1HB SER 25 1HB SER 25 3.261 16.048 11.422 32 2HB SER 25 2HB SER 25 2.815 15.096 10.019 33 HG SER 25 HG SER 25 2.473 16.890 8.904 34 H ASP 26 H ASP 26 2.111 16.686 13.277 35 HA ASP 26 HA ASP 26 -0.159 18.392 14.047 36 1HB ASP 26 1HB ASP 26 1.527 17.205 15.654 37 2HB ASP 26 2HB ASP 26 2.615 18.545 15.283 38 H LEU 27 H LEU 27 2.908 18.617 12.380 39 HA LEU 27 HA LEU 27 3.028 21.523 12.461 40 1HB LEU 27 1HB LEU 27 4.852 19.540 11.051 41 2HB LEU 27 2HB LEU 27 5.136 21.259 11.335 42 HG LEU 27 HG LEU 27 6.470 20.202 12.867 43 1HD1 LEU 27 1HD1 LEU 27 5.683 20.849 15.057 44 2HD1 LEU 27 2HD1 LEU 27 5.142 22.046 13.866 45 3HD1 LEU 27 3HD1 LEU 27 3.996 20.850 14.517 46 1HD2 LEU 27 1HD2 LEU 27 5.490 17.925 12.706 47 2HD2 LEU 27 2HD2 LEU 27 5.929 18.418 14.362 48 3HD2 LEU 27 3HD2 LEU 27 4.248 18.391 13.869 49 H ILE 28 H ILE 28 2.315 19.018 10.061 50 HA ILE 28 HA ILE 28 2.325 19.173 7.754 51 HB ILE 28 HB ILE 28 -0.137 20.566 8.798 52 1HG1 ILE 28 1HG1 ILE 28 0.558 17.658 8.250 53 2HG1 ILE 28 2HG1 ILE 28 0.271 18.479 9.786 54 1HG2 ILE 28 1HG2 ILE 28 0.149 20.745 6.192 55 2HG2 ILE 28 2HG2 ILE 28 0.176 18.971 6.227 56 3HG2 ILE 28 3HG2 ILE 28 -1.261 19.864 6.759 57 1HD1 ILE 28 1HD1 ILE 28 -1.707 17.318 9.359 58 2HD1 ILE 28 2HD1 ILE 28 -2.045 19.024 9.042 59 3HD1 ILE 28 3HD1 ILE 28 -1.795 17.883 7.681 60 H LEU 29 H LEU 29 4.230 20.372 7.435 61 HA LEU 29 HA LEU 29 4.103 23.200 6.704 62 1HB LEU 29 1HB LEU 29 6.178 21.102 6.036 63 2HB LEU 29 2HB LEU 29 6.293 22.831 5.751 64 HG LEU 29 HG LEU 29 7.567 22.470 7.604 65 1HD1 LEU 29 1HD1 LEU 29 5.997 24.376 7.854 66 2HD1 LEU 29 2HD1 LEU 29 4.940 23.340 8.851 67 3HD1 LEU 29 3HD1 LEU 29 6.580 23.728 9.400 68 1HD2 LEU 29 1HD2 LEU 29 6.947 20.212 8.207 69 2HD2 LEU 29 2HD2 LEU 29 7.044 21.261 9.622 70 3HD2 LEU 29 3HD2 LEU 29 5.460 20.792 8.994 71 H ASP 30 H ASP 30 4.509 23.844 4.372 72 HA ASP 30 HA ASP 30 2.454 22.773 2.756 73 1HB ASP 30 1HB ASP 30 3.241 25.094 2.576 74 2HB ASP 30 2HB ASP 30 4.816 24.533 1.977 75 H GLU 31 H GLU 31 5.870 21.975 2.910 76 HA GLU 31 HA GLU 31 6.450 21.320 0.423 77 1HB GLU 31 1HB GLU 31 7.687 20.820 2.900 78 2HB GLU 31 2HB GLU 31 7.642 19.239 2.112 79 1HG GLU 31 1HG GLU 31 8.726 21.774 0.825 80 2HG GLU 31 2HG GLU 31 9.699 20.556 1.652 81 H LYS 32 H LYS 32 6.274 19.742 -1.113 82 HA LYS 32 HA LYS 32 3.890 18.074 -0.687 83 1HB LYS 32 1HB LYS 32 4.121 19.891 -2.454 84 2HB LYS 32 2HB LYS 32 5.284 18.844 -3.293 85 1HG LYS 32 1HG LYS 32 3.620 17.076 -3.405 86 2HG LYS 32 2HG LYS 32 2.526 17.994 -2.367 87 1HD LYS 32 1HD LYS 32 1.562 18.420 -4.432 88 2HD LYS 32 2HD LYS 32 2.544 19.848 -4.129 89 1HE LYS 32 1HE LYS 32 2.952 19.270 -6.411 90 2HE LYS 32 2HE LYS 32 4.399 18.731 -5.541 91 1HZ LYS 32 1HZ LYS 32 2.102 17.018 -6.316 92 2HZ LYS 32 2HZ LYS 32 3.582 17.012 -7.071 93 3HZ LYS 32 3HZ LYS 32 3.336 16.474 -5.515 94 H ILE 33 H ILE 33 5.018 16.581 0.550 95 HA ILE 33 HA ILE 33 7.006 14.769 -0.632 96 HB ILE 33 HB ILE 33 6.917 15.416 1.685 97 1HG1 ILE 33 1HG1 ILE 33 8.297 13.645 1.114 98 2HG1 ILE 33 2HG1 ILE 33 7.454 13.266 2.588 99 1HG2 ILE 33 1HG2 ILE 33 4.537 15.382 2.097 100 2HG2 ILE 33 2HG2 ILE 33 4.507 13.613 1.940 101 3HG2 ILE 33 3HG2 ILE 33 5.409 14.370 3.260 102 1HD1 ILE 33 1HD1 ILE 33 7.519 11.248 1.345 103 2HD1 ILE 33 2HD1 ILE 33 5.851 11.830 1.155 104 3HD1 ILE 33 3HD1 ILE 33 7.049 12.053 -0.147 105 H LYS 34 H LYS 34 6.522 13.271 -2.066 106 HA LYS 34 HA LYS 34 3.727 12.882 -2.849 107 1HB LYS 34 1HB LYS 34 5.863 13.588 -4.226 108 2HB LYS 34 2HB LYS 34 6.174 11.863 -4.328 109 1HG LYS 34 1HG LYS 34 3.477 13.058 -5.096 110 2HG LYS 34 2HG LYS 34 4.855 13.230 -6.166 111 1HD LYS 34 1HD LYS 34 4.595 10.445 -5.368 112 2HD LYS 34 2HD LYS 34 3.045 11.072 -5.859 113 1HE LYS 34 1HE LYS 34 3.821 10.403 -7.941 114 2HE LYS 34 2HE LYS 34 4.470 12.025 -7.960 115 1HZ LYS 34 1HZ LYS 34 6.146 10.463 -8.530 116 2HZ LYS 34 2HZ LYS 34 6.535 10.917 -6.982 117 3HZ LYS 34 3HZ LYS 34 5.755 9.478 -7.268 118 H VAL 35 H VAL 35 3.119 10.525 -3.636 119 HA VAL 35 HA VAL 35 4.769 8.390 -2.441 120 HB VAL 35 HB VAL 35 1.863 8.975 -1.909 121 1HG1 VAL 35 1HG1 VAL 35 1.767 6.682 -2.524 122 2HG1 VAL 35 2HG1 VAL 35 3.267 6.303 -1.661 123 3HG1 VAL 35 3HG1 VAL 35 1.796 6.695 -0.754 124 1HG2 VAL 35 1HG2 VAL 35 3.312 9.912 -0.198 125 2HG2 VAL 35 2HG2 VAL 35 2.370 8.579 0.441 126 3HG2 VAL 35 3HG2 VAL 35 4.084 8.326 0.029 127 H THR 36 H THR 36 4.550 6.485 -3.669 128 HA THR 36 HA THR 36 2.830 6.607 -6.068 129 HB THR 36 HB THR 36 5.866 6.430 -6.121 130 HG1 THR 36 HG1 THR 36 3.929 8.352 -6.521 131 1HG2 THR 36 1HG2 THR 36 3.890 6.172 -8.409 132 2HG2 THR 36 2HG2 THR 36 5.658 6.336 -8.549 133 3HG2 THR 36 3HG2 THR 36 4.967 4.895 -7.781 134 H PHE 37 H PHE 37 1.658 4.927 -5.737 135 HA PHE 37 HA PHE 37 2.557 2.650 -4.184 136 1HB PHE 37 1HB PHE 37 -0.044 3.196 -5.669 137 2HB PHE 37 2HB PHE 37 0.242 1.964 -4.454 138 HD1 PHE 37 HD1 PHE 37 -1.436 4.900 -4.877 139 HD2 PHE 37 HD2 PHE 37 1.451 3.153 -2.178 140 HE1 PHE 37 HE1 PHE 37 -2.306 6.287 -3.025 141 HE2 PHE 37 HE2 PHE 37 0.565 4.542 -0.335 142 HZ PHE 37 HZ PHE 37 -1.271 6.154 -0.770 143 H ASP 38 H ASP 38 3.425 0.876 -5.043 144 HA ASP 38 HA ASP 38 2.675 -0.018 -7.794 145 1HB ASP 38 1HB ASP 38 5.067 0.074 -7.695 146 2HB ASP 38 2HB ASP 38 5.098 -0.412 -6.009 147 H ALA 39 H ALA 39 0.649 -0.647 -7.198 148 HA ALA 39 HA ALA 39 0.364 -2.878 -5.215 149 1HB ALA 39 1HB ALA 39 -1.708 -1.110 -6.571 150 2HB ALA 39 2HB ALA 39 -2.055 -2.441 -5.458 151 3HB ALA 39 3HB ALA 39 -1.186 -1.007 -4.876 152 H ASN 40 H ASN 40 1.348 -4.480 -6.520 153 HA ASN 40 HA ASN 40 0.263 -4.858 -9.285 154 1HB ASN 40 1HB ASN 40 2.403 -5.974 -9.765 155 2HB ASN 40 2HB ASN 40 2.647 -4.330 -9.247 156 1HD2 ASN 40 1HD2 ASN 40 3.692 -4.007 -7.313 157 2HD2 ASN 40 2HD2 ASN 40 4.445 -5.273 -6.357 158 H VAL 41 H VAL 41 -0.160 -6.960 -10.005 159 HA VAL 41 HA VAL 41 -0.214 -9.082 -7.956 160 HB VAL 41 HB VAL 41 -2.438 -8.275 -8.016 161 1HG1 VAL 41 1HG1 VAL 41 -2.530 -7.194 -10.251 162 2HG1 VAL 41 2HG1 VAL 41 -2.541 -8.796 -11.020 163 3HG1 VAL 41 3HG1 VAL 41 -3.880 -8.306 -9.977 164 1HG2 VAL 41 1HG2 VAL 41 -2.377 -10.850 -9.612 165 2HG2 VAL 41 2HG2 VAL 41 -1.889 -10.744 -7.909 166 3HG2 VAL 41 3HG2 VAL 41 -3.543 -10.338 -8.372 167 H ALA 42 H ALA 42 1.281 -10.359 -8.437 168 HA ALA 42 HA ALA 42 1.801 -11.193 -11.225 169 1HB ALA 42 1HB ALA 42 2.836 -12.281 -8.595 170 2HB ALA 42 2HB ALA 42 3.368 -12.772 -10.214 171 3HB ALA 42 3HB ALA 42 3.692 -11.120 -9.638 172 H ALA 43 H ALA 43 1.149 -13.313 -11.920 173 HA ALA 43 HA ALA 43 -1.388 -14.139 -11.345 174 1HB ALA 43 1HB ALA 43 -0.823 -16.250 -12.497 175 2HB ALA 43 2HB ALA 43 -0.109 -14.853 -13.326 176 3HB ALA 43 3HB ALA 43 0.909 -15.900 -12.307 177 H GLY 44 H GLY 44 1.483 -15.010 -9.564 178 1HA GLY 44 1HA GLY 44 0.934 -17.136 -7.960 179 2HA GLY 44 2HA GLY 44 1.678 -15.639 -7.384 180 H LEU 45 H LEU 45 -0.637 -13.859 -7.616 181 HA LEU 45 HA LEU 45 -2.695 -15.214 -5.929 182 1HB LEU 45 1HB LEU 45 -1.324 -12.951 -5.231 183 2HB LEU 45 2HB LEU 45 -2.652 -12.252 -6.132 184 HG LEU 45 HG LEU 45 -3.215 -14.280 -3.886 185 1HD1 LEU 45 1HD1 LEU 45 -3.007 -11.246 -3.754 186 2HD1 LEU 45 2HD1 LEU 45 -3.571 -12.288 -2.452 187 3HD1 LEU 45 3HD1 LEU 45 -1.872 -12.336 -2.972 188 1HD2 LEU 45 1HD2 LEU 45 -4.776 -11.978 -5.053 189 2HD2 LEU 45 2HD2 LEU 45 -4.982 -13.668 -5.570 190 3HD2 LEU 45 3HD2 LEU 45 -5.303 -13.225 -3.881 191 HA PRO 46 HA PRO 46 -4.317 -14.687 -10.079 192 1HB PRO 46 1HB PRO 46 -6.509 -16.261 -9.995 193 2HB PRO 46 2HB PRO 46 -4.852 -16.937 -9.783 194 1HG PRO 46 1HG PRO 46 -6.823 -16.143 -7.672 195 2HG PRO 46 2HG PRO 46 -6.000 -17.728 -7.840 196 1HD PRO 46 1HD PRO 46 -4.999 -15.815 -6.181 197 2HD PRO 46 2HD PRO 46 -3.905 -16.806 -7.173 198 H TRP 47 H TRP 47 -5.383 -12.883 -7.610 199 HA TRP 47 HA TRP 47 -8.075 -12.154 -8.415 200 1HB TRP 47 1HB TRP 47 -6.123 -10.910 -6.507 201 2HB TRP 47 2HB TRP 47 -7.806 -10.460 -6.696 202 HD1 TRP 47 HD1 TRP 47 -7.868 -14.076 -7.049 203 HE1 TRP 47 HE1 TRP 47 -8.475 -15.246 -4.894 204 HE3 TRP 47 HE3 TRP 47 -6.813 -10.356 -3.683 205 HZ2 TRP 47 HZ2 TRP 47 -8.629 -14.679 -2.063 206 HZ3 TRP 47 HZ3 TRP 47 -6.573 -11.213 -1.352 207 HH2 TRP 47 HH2 TRP 47 -7.942 -12.984 -0.470 208 H GLU 48 H GLU 48 -8.730 -10.172 -9.105 209 HA GLU 48 HA GLU 48 -7.059 -8.500 -10.889 210 1HB GLU 48 1HB GLU 48 -9.412 -8.883 -11.479 211 2HB GLU 48 2HB GLU 48 -9.922 -8.519 -9.832 212 1HG GLU 48 1HG GLU 48 -9.172 -6.125 -10.208 213 2HG GLU 48 2HG GLU 48 -8.965 -6.550 -11.920 214 H PHE 49 H PHE 49 -6.194 -6.538 -10.024 215 HA PHE 49 HA PHE 49 -6.788 -5.751 -7.265 216 1HB PHE 49 1HB PHE 49 -4.905 -7.389 -7.131 217 2HB PHE 49 2HB PHE 49 -4.006 -6.396 -8.283 218 HD1 PHE 49 HD1 PHE 49 -2.092 -6.205 -6.841 219 HD2 PHE 49 HD2 PHE 49 -5.965 -4.994 -5.372 220 HE1 PHE 49 HE1 PHE 49 -1.061 -5.419 -4.750 221 HE2 PHE 49 HE2 PHE 49 -4.915 -4.139 -3.330 222 HZ PHE 49 HZ PHE 49 -2.471 -4.373 -2.984 223 H VAL 50 H VAL 50 -6.905 -3.536 -7.199 224 HA VAL 50 HA VAL 50 -6.158 -2.064 -9.644 225 HB VAL 50 HB VAL 50 -8.436 -2.010 -7.749 226 1HG1 VAL 50 1HG1 VAL 50 -7.804 -0.003 -9.906 227 2HG1 VAL 50 2HG1 VAL 50 -9.415 -0.199 -9.161 228 3HG1 VAL 50 3HG1 VAL 50 -8.043 0.267 -8.156 229 1HG2 VAL 50 1HG2 VAL 50 -8.628 -3.738 -9.498 230 2HG2 VAL 50 2HG2 VAL 50 -9.778 -2.439 -9.844 231 3HG2 VAL 50 3HG2 VAL 50 -8.261 -2.535 -10.753 232 HA PRO 51 HA PRO 51 -4.137 0.651 -6.487 233 1HB PRO 51 1HB PRO 51 -2.878 2.286 -8.308 234 2HB PRO 51 2HB PRO 51 -2.229 0.704 -7.815 235 1HG PRO 51 1HG PRO 51 -3.592 1.431 -10.364 236 2HG PRO 51 2HG PRO 51 -2.354 0.178 -10.070 237 1HD PRO 51 1HD PRO 51 -5.181 -0.142 -10.270 238 2HD PRO 51 2HD PRO 51 -4.080 -1.426 -9.705 239 H VAL 52 H VAL 52 -4.831 2.761 -5.866 240 HA VAL 52 HA VAL 52 -7.511 3.315 -6.816 241 HB VAL 52 HB VAL 52 -6.020 5.103 -4.857 242 1HG1 VAL 52 1HG1 VAL 52 -8.227 5.220 -3.820 243 2HG1 VAL 52 2HG1 VAL 52 -8.346 5.631 -5.537 244 3HG1 VAL 52 3HG1 VAL 52 -8.866 4.031 -4.974 245 1HG2 VAL 52 1HG2 VAL 52 -6.811 2.231 -4.429 246 2HG2 VAL 52 2HG2 VAL 52 -5.314 3.063 -3.961 247 3HG2 VAL 52 3HG2 VAL 52 -6.805 3.392 -3.090 248 H GLN 53 H GLN 53 -4.564 5.191 -6.471 249 HA GLN 53 HA GLN 53 -4.779 6.237 -9.187 250 1HB GLN 53 1HB GLN 53 -3.751 7.812 -6.769 251 2HB GLN 53 2HB GLN 53 -3.530 8.268 -8.441 252 1HG GLN 53 1HG GLN 53 -5.302 9.613 -7.709 253 2HG GLN 53 2HG GLN 53 -6.022 8.381 -8.757 254 1HE2 GLN 53 1HE2 GLN 53 -4.996 8.278 -5.277 255 2HE2 GLN 53 2HE2 GLN 53 -6.592 7.846 -4.698 256 H ARG 54 H ARG 54 -2.421 6.456 -9.908 257 HA ARG 54 HA ARG 54 -0.743 4.295 -8.990 258 1HB ARG 54 1HB ARG 54 -0.471 5.134 -11.194 259 2HB ARG 54 2HB ARG 54 -0.257 6.801 -10.642 260 1HG ARG 54 1HG ARG 54 1.820 5.758 -11.425 261 2HG ARG 54 2HG ARG 54 1.933 6.304 -9.752 262 1HD ARG 54 1HD ARG 54 1.878 4.153 -8.930 263 2HD ARG 54 2HD ARG 54 1.221 3.511 -10.453 264 HE ARG 54 HE ARG 54 3.709 4.592 -11.094 265 1HH1 ARG 54 1HH1 ARG 54 2.638 2.099 -8.817 266 2HH1 ARG 54 2HH1 ARG 54 3.900 0.977 -9.216 267 1HH2 ARG 54 1HH2 ARG 54 5.495 3.168 -11.524 268 2HH2 ARG 54 2HH2 ARG 54 5.614 1.652 -10.691 269 H ASP 55 H ASP 55 -0.755 7.878 -8.403 270 HA ASP 55 HA ASP 55 0.879 7.532 -6.009 271 1HB ASP 55 1HB ASP 55 2.058 9.521 -6.959 272 2HB ASP 55 2HB ASP 55 2.208 8.134 -8.046 273 H ILE 56 H ILE 56 0.976 9.581 -4.802 274 HA ILE 56 HA ILE 56 -1.389 11.295 -4.952 275 HB ILE 56 HB ILE 56 -1.967 11.117 -2.600 276 1HG1 ILE 56 1HG1 ILE 56 -0.101 8.748 -2.685 277 2HG1 ILE 56 2HG1 ILE 56 0.179 10.292 -1.820 278 1HG2 ILE 56 1HG2 ILE 56 -3.170 9.777 -4.361 279 2HG2 ILE 56 2HG2 ILE 56 -2.117 8.400 -3.937 280 3HG2 ILE 56 3HG2 ILE 56 -3.238 9.083 -2.733 281 1HD1 ILE 56 1HD1 ILE 56 -1.702 9.799 -0.322 282 2HD1 ILE 56 2HD1 ILE 56 -1.984 8.255 -1.137 283 3HD1 ILE 56 3HD1 ILE 56 -0.470 8.532 -0.260 284 H ASP 57 H ASP 57 -1.109 13.173 -3.512 285 HA ASP 57 HA ASP 57 1.695 13.747 -2.675 286 1HB ASP 57 1HB ASP 57 -0.561 15.598 -3.572 287 2HB ASP 57 2HB ASP 57 0.830 16.138 -2.630 288 H VAL 58 H VAL 58 1.875 14.063 -0.480 289 HA VAL 58 HA VAL 58 -0.624 14.410 1.161 290 HB VAL 58 HB VAL 58 0.611 12.839 2.801 291 1HG1 VAL 58 1HG1 VAL 58 -0.797 11.770 0.347 292 2HG1 VAL 58 2HG1 VAL 58 -0.644 10.943 1.914 293 3HG1 VAL 58 3HG1 VAL 58 -1.572 12.449 1.792 294 1HG2 VAL 58 1HG2 VAL 58 1.772 10.967 1.783 295 2HG2 VAL 58 2HG2 VAL 58 1.720 11.715 0.188 296 3HG2 VAL 58 3HG2 VAL 58 2.685 12.453 1.484 297 H ARG 59 H ARG 59 -0.033 16.640 1.108 298 HA ARG 59 HA ARG 59 2.553 17.637 1.324 299 1HB ARG 59 1HB ARG 59 -0.012 19.003 2.191 300 2HB ARG 59 2HB ARG 59 1.514 19.812 1.837 301 1HG ARG 59 1HG ARG 59 0.696 18.027 -0.372 302 2HG ARG 59 2HG ARG 59 -0.573 19.142 0.063 303 1HD ARG 59 1HD ARG 59 2.302 19.915 -0.579 304 2HD ARG 59 2HD ARG 59 1.013 19.903 -1.763 305 HE ARG 59 HE ARG 59 1.656 22.019 0.062 306 1HH1 ARG 59 1HH1 ARG 59 -1.290 20.392 -1.115 307 2HH1 ARG 59 2HH1 ARG 59 -2.265 21.814 -1.013 308 1HH2 ARG 59 1HH2 ARG 59 0.466 23.800 0.119 309 2HH2 ARG 59 2HH2 ARG 59 -1.248 23.882 -0.288 310 H ILE 60 H ILE 60 3.977 17.592 2.891 311 HA ILE 60 HA ILE 60 4.598 16.207 4.719 312 HB ILE 60 HB ILE 60 4.141 18.999 5.750 313 1HG1 ILE 60 1HG1 ILE 60 5.533 19.077 3.815 314 2HG1 ILE 60 2HG1 ILE 60 6.603 19.190 5.192 315 1HG2 ILE 60 1HG2 ILE 60 4.627 17.873 7.748 316 2HG2 ILE 60 2HG2 ILE 60 5.681 16.697 6.925 317 3HG2 ILE 60 3HG2 ILE 60 6.190 18.386 7.179 318 1HD1 ILE 60 1HD1 ILE 60 6.271 16.821 3.381 319 2HD1 ILE 60 2HD1 ILE 60 7.733 17.733 3.772 320 3HD1 ILE 60 3HD1 ILE 60 7.022 16.674 4.991 321 H GLY 61 H GLY 61 2.378 15.082 4.397 322 1HA GLY 61 1HA GLY 61 1.609 13.607 6.280 323 2HA GLY 61 2HA GLY 61 1.033 15.045 7.089 324 H GLU 62 H GLU 62 -0.316 16.533 5.552 325 HA GLU 62 HA GLU 62 -2.690 16.584 5.264 326 1HB GLU 62 1HB GLU 62 -1.209 17.389 3.442 327 2HB GLU 62 2HB GLU 62 -1.349 15.788 2.713 328 1HG GLU 62 1HG GLU 62 -3.739 16.209 2.252 329 2HG GLU 62 2HG GLU 62 -3.597 17.808 3.023 330 H THR 63 H THR 63 -3.689 14.781 6.419 331 HA THR 63 HA THR 63 -3.538 12.156 5.710 332 HB THR 63 HB THR 63 -6.113 12.649 6.947 333 HG1 THR 63 HG1 THR 63 -5.524 14.688 7.433 334 1HG2 THR 63 1HG2 THR 63 -3.457 11.876 8.198 335 2HG2 THR 63 2HG2 THR 63 -5.085 11.603 8.860 336 3HG2 THR 63 3HG2 THR 63 -4.581 10.754 7.394 337 H VAL 64 H VAL 64 -4.221 11.003 4.010 338 HA VAL 64 HA VAL 64 -6.797 11.771 2.684 339 HB VAL 64 HB VAL 64 -4.984 12.559 1.333 340 1HG1 VAL 64 1HG1 VAL 64 -3.303 11.146 0.357 341 2HG1 VAL 64 2HG1 VAL 64 -3.207 10.923 2.113 342 3HG1 VAL 64 3HG1 VAL 64 -3.977 9.683 1.110 343 1HG2 VAL 64 1HG2 VAL 64 -6.103 10.093 -0.022 344 2HG2 VAL 64 2HG2 VAL 64 -6.973 11.640 0.178 345 3HG2 VAL 64 3HG2 VAL 64 -5.477 11.567 -0.772 346 H GLN 65 H GLN 65 -7.898 10.126 1.676 347 HA GLN 65 HA GLN 65 -7.468 7.327 2.660 348 1HB GLN 65 1HB GLN 65 -9.435 8.332 3.593 349 2HB GLN 65 2HB GLN 65 -9.987 8.913 2.028 350 1HG GLN 65 1HG GLN 65 -9.479 5.952 2.199 351 2HG GLN 65 2HG GLN 65 -10.741 6.569 3.260 352 1HE2 GLN 65 1HE2 GLN 65 -10.045 7.952 -0.018 353 2HE2 GLN 65 2HE2 GLN 65 -11.571 7.405 -0.676 354 H ILE 66 H ILE 66 -6.839 5.955 1.182 355 HA ILE 66 HA ILE 66 -7.875 6.274 -1.570 356 HB ILE 66 HB ILE 66 -5.738 5.235 -2.401 357 1HG1 ILE 66 1HG1 ILE 66 -3.732 6.234 -0.948 358 2HG1 ILE 66 2HG1 ILE 66 -4.764 5.858 0.403 359 1HG2 ILE 66 1HG2 ILE 66 -5.416 8.010 -1.268 360 2HG2 ILE 66 2HG2 ILE 66 -4.722 7.323 -2.758 361 3HG2 ILE 66 3HG2 ILE 66 -6.459 7.629 -2.654 362 1HD1 ILE 66 1HD1 ILE 66 -4.804 3.441 -0.467 363 2HD1 ILE 66 2HD1 ILE 66 -3.756 3.976 -1.788 364 3HD1 ILE 66 3HD1 ILE 66 -3.181 4.039 -0.110 365 H MET 67 H MET 67 -9.366 4.828 -1.705 366 HA MET 67 HA MET 67 -9.261 2.302 -0.272 367 1HB MET 67 1HB MET 67 -11.350 1.752 -1.402 368 2HB MET 67 2HB MET 67 -11.412 3.259 -0.500 369 1HG MET 67 1HG MET 67 -10.833 3.421 -3.459 370 2HG MET 67 2HG MET 67 -12.452 2.983 -2.949 371 1HE MET 67 1HE MET 67 -13.831 6.115 -1.246 372 2HE MET 67 2HE MET 67 -14.201 4.542 -1.989 373 3HE MET 67 3HE MET 67 -13.225 4.617 -0.509 374 H TYR 68 H TYR 68 -7.933 0.706 -0.747 375 HA TYR 68 HA TYR 68 -7.189 0.168 -3.585 376 1HB TYR 68 1HB TYR 68 -6.614 -1.346 -1.022 377 2HB TYR 68 2HB TYR 68 -6.011 -1.787 -2.616 378 HD1 TYR 68 HD1 TYR 68 -4.873 -0.593 0.309 379 HD2 TYR 68 HD2 TYR 68 -4.844 0.422 -3.874 380 HE1 TYR 68 HE1 TYR 68 -2.763 0.676 0.630 381 HE2 TYR 68 HE2 TYR 68 -2.761 1.723 -3.545 382 HH TYR 68 HH TYR 68 -1.313 2.641 -1.937 383 H ARG 69 H ARG 69 -7.897 -1.716 -4.698 384 HA ARG 69 HA ARG 69 -10.035 -3.271 -3.407 385 1HB ARG 69 1HB ARG 69 -11.194 -1.452 -4.599 386 2HB ARG 69 2HB ARG 69 -10.326 -1.879 -6.086 387 1HG ARG 69 1HG ARG 69 -11.377 -4.143 -6.015 388 2HG ARG 69 2HG ARG 69 -12.255 -3.698 -4.554 389 1HD ARG 69 1HD ARG 69 -13.697 -2.271 -5.681 390 2HD ARG 69 2HD ARG 69 -12.569 -1.912 -6.979 391 HE ARG 69 HE ARG 69 -14.473 -4.134 -6.848 392 1HH1 ARG 69 1HH1 ARG 69 -11.305 -3.197 -8.201 393 2HH1 ARG 69 2HH1 ARG 69 -11.420 -4.448 -9.459 394 1HH2 ARG 69 1HH2 ARG 69 -14.428 -5.814 -8.517 395 2HH2 ARG 69 2HH2 ARG 69 -13.044 -5.750 -9.652 396 H ALA 70 H ALA 70 -10.020 -5.383 -3.915 397 HA ALA 70 HA ALA 70 -8.739 -6.251 -6.403 398 1HB ALA 70 1HB ALA 70 -7.933 -8.312 -5.214 399 2HB ALA 70 2HB ALA 70 -7.223 -6.850 -4.503 400 3HB ALA 70 3HB ALA 70 -8.567 -7.668 -3.689 401 H LYS 71 H LYS 71 -9.597 -8.547 -7.006 402 HA LYS 71 HA LYS 71 -12.206 -9.257 -5.942 403 1HB LYS 71 1HB LYS 71 -13.120 -7.897 -7.551 404 2HB LYS 71 2HB LYS 71 -11.667 -7.857 -8.552 405 1HG LYS 71 1HG LYS 71 -12.123 -10.085 -9.447 406 2HG LYS 71 2HG LYS 71 -13.449 -10.249 -8.301 407 1HD LYS 71 1HD LYS 71 -13.929 -7.835 -9.798 408 2HD LYS 71 2HD LYS 71 -13.252 -8.943 -10.969 409 1HE LYS 71 1HE LYS 71 -15.664 -9.058 -11.023 410 2HE LYS 71 2HE LYS 71 -15.047 -10.609 -10.420 411 1HZ LYS 71 1HZ LYS 71 -16.967 -9.557 -9.181 412 2HZ LYS 71 2HZ LYS 71 -15.717 -10.055 -8.266 413 3HZ LYS 71 3HZ LYS 71 -15.890 -8.447 -8.605 414 H ASN 72 H ASN 72 -12.359 -11.584 -6.114 415 HA ASN 72 HA ASN 72 -9.922 -12.843 -7.119 416 1HB ASN 72 1HB ASN 72 -10.760 -13.694 -5.096 417 2HB ASN 72 2HB ASN 72 -12.346 -14.046 -5.808 418 1HD2 ASN 72 1HD2 ASN 72 -11.679 -16.302 -4.767 419 2HD2 ASN 72 2HD2 ASN 72 -10.926 -17.411 -5.899 420 H LEU 73 H LEU 73 -9.515 -13.819 -8.958 421 HA LEU 73 HA LEU 73 -11.641 -13.989 -11.034 422 1HB LEU 73 1HB LEU 73 -9.351 -12.294 -10.921 423 2HB LEU 73 2HB LEU 73 -8.887 -13.571 -12.007 424 HG LEU 73 HG LEU 73 -11.073 -13.171 -13.277 425 1HD1 LEU 73 1HD1 LEU 73 -12.115 -10.933 -12.969 426 2HD1 LEU 73 2HD1 LEU 73 -12.296 -11.899 -11.498 427 3HD1 LEU 73 3HD1 LEU 73 -11.062 -10.629 -11.577 428 1HD2 LEU 73 1HD2 LEU 73 -8.889 -12.372 -14.085 429 2HD2 LEU 73 2HD2 LEU 73 -10.155 -11.183 -14.441 430 3HD2 LEU 73 3HD2 LEU 73 -9.037 -10.908 -13.089 431 H ALA 74 H ALA 74 -10.554 -16.075 -9.137 432 HA ALA 74 HA ALA 74 -9.701 -18.085 -11.178 433 1HB ALA 74 1HB ALA 74 -8.262 -17.861 -9.131 434 2HB ALA 74 2HB ALA 74 -9.673 -18.254 -8.133 435 3HB ALA 74 3HB ALA 74 -9.019 -19.456 -9.267 436 H SER 75 H SER 75 -10.705 -20.350 -10.646 437 HA SER 75 HA SER 75 -13.647 -20.068 -10.467 438 1HB SER 75 1HB SER 75 -13.430 -22.465 -11.334 439 2HB SER 75 2HB SER 75 -12.846 -21.188 -12.417 440 HG SER 75 HG SER 75 -11.358 -23.029 -12.046 441 H THR 76 H THR 76 -11.407 -20.228 -8.156 442 HA THR 76 HA THR 76 -12.919 -22.031 -6.430 443 HB THR 76 HB THR 76 -11.362 -23.662 -7.063 444 HG1 THR 76 HG1 THR 76 -9.793 -22.268 -5.135 445 1HG2 THR 76 1HG2 THR 76 -8.948 -23.208 -7.578 446 2HG2 THR 76 2HG2 THR 76 -10.067 -22.494 -8.735 447 3HG2 THR 76 3HG2 THR 76 -9.315 -21.466 -7.492 448 HA PRO 77 HA PRO 77 -11.709 -18.965 -3.437 449 1HB PRO 77 1HB PRO 77 -11.032 -20.537 -1.241 450 2HB PRO 77 2HB PRO 77 -12.702 -20.094 -1.697 451 1HG PRO 77 1HG PRO 77 -11.181 -22.625 -2.392 452 2HG PRO 77 2HG PRO 77 -12.840 -22.489 -1.732 453 1HD PRO 77 1HD PRO 77 -12.469 -22.857 -4.353 454 2HD PRO 77 2HD PRO 77 -13.672 -21.665 -3.816 455 H THR 78 H THR 78 -9.796 -18.282 -2.371 456 HA THR 78 HA THR 78 -7.163 -19.433 -3.188 457 HB THR 78 HB THR 78 -6.602 -16.897 -3.503 458 HG1 THR 78 HG1 THR 78 -9.391 -16.701 -3.930 459 1HG2 THR 78 1HG2 THR 78 -8.512 -18.080 -5.537 460 2HG2 THR 78 2HG2 THR 78 -7.394 -16.698 -5.700 461 3HG2 THR 78 3HG2 THR 78 -6.742 -18.334 -5.465 462 H THR 79 H THR 79 -5.463 -17.747 -1.928 463 HA THR 79 HA THR 79 -6.713 -16.603 0.352 464 HB THR 79 HB THR 79 -6.079 -18.725 1.385 465 HG1 THR 79 HG1 THR 79 -5.856 -16.630 2.448 466 1HG2 THR 79 1HG2 THR 79 -3.747 -19.403 1.630 467 2HG2 THR 79 2HG2 THR 79 -4.159 -19.348 -0.095 468 3HG2 THR 79 3HG2 THR 79 -3.196 -18.045 0.635 469 H GLY 80 H GLY 80 -5.726 -14.732 0.897 470 1HA GLY 80 1HA GLY 80 -3.466 -13.800 -0.803 471 2HA GLY 80 2HA GLY 80 -4.593 -12.795 0.109 472 H GLN 81 H GLN 81 -1.823 -14.943 0.325 473 HA GLN 81 HA GLN 81 -1.186 -13.822 3.037 474 1HB GLN 81 1HB GLN 81 -0.603 -16.527 1.801 475 2HB GLN 81 2HB GLN 81 0.416 -15.891 3.095 476 1HG GLN 81 1HG GLN 81 -2.549 -15.791 3.593 477 2HG GLN 81 2HG GLN 81 -1.789 -17.376 3.550 478 1HE2 GLN 81 1HE2 GLN 81 -0.498 -14.154 4.907 479 2HE2 GLN 81 2HE2 GLN 81 -0.222 -14.892 6.453 480 H ALA 82 H ALA 82 -0.971 -12.241 0.955 481 HA ALA 82 HA ALA 82 1.795 -12.263 -0.089 482 1HB ALA 82 1HB ALA 82 1.076 -10.179 -1.182 483 2HB ALA 82 2HB ALA 82 -0.095 -11.485 -1.489 484 3HB ALA 82 3HB ALA 82 -0.469 -10.223 -0.300 485 H THR 83 H THR 83 2.998 -10.084 0.316 486 HA THR 83 HA THR 83 2.122 -8.613 2.627 487 HB THR 83 HB THR 83 3.503 -10.325 3.740 488 HG1 THR 83 HG1 THR 83 4.953 -7.909 3.775 489 1HG2 THR 83 1HG2 THR 83 5.935 -10.387 3.419 490 2HG2 THR 83 2HG2 THR 83 5.097 -10.864 1.931 491 3HG2 THR 83 3HG2 THR 83 5.821 -9.242 2.068 492 H PHE 84 H PHE 84 3.304 -6.665 2.816 493 HA PHE 84 HA PHE 84 3.920 -5.457 0.182 494 1HB PHE 84 1HB PHE 84 3.954 -3.413 1.679 495 2HB PHE 84 2HB PHE 84 2.399 -4.230 1.481 496 HD1 PHE 84 HD1 PHE 84 5.313 -3.877 3.844 497 HD2 PHE 84 HD2 PHE 84 1.160 -4.979 3.379 498 HE1 PHE 84 HE1 PHE 84 5.078 -4.015 6.286 499 HE2 PHE 84 HE2 PHE 84 0.934 -5.107 5.833 500 HZ PHE 84 HZ PHE 84 2.877 -4.602 7.299 501 H ASN 85 H ASN 85 5.831 -4.391 -0.240 502 HA ASN 85 HA ASN 85 7.852 -4.219 1.958 503 1HB ASN 85 1HB ASN 85 9.056 -5.295 0.291 504 2HB ASN 85 2HB ASN 85 8.250 -4.447 -1.014 505 1HD2 ASN 85 1HD2 ASN 85 9.040 -2.356 -1.651 506 2HD2 ASN 85 2HD2 ASN 85 10.433 -1.601 -0.905 507 H VAL 86 H VAL 86 7.029 -2.491 2.924 508 HA VAL 86 HA VAL 86 6.033 -0.078 1.543 509 HB VAL 86 HB VAL 86 6.425 -1.018 4.404 510 1HG1 VAL 86 1HG1 VAL 86 7.020 1.310 4.607 511 2HG1 VAL 86 2HG1 VAL 86 5.730 1.764 3.473 512 3HG1 VAL 86 3HG1 VAL 86 5.349 1.131 5.103 513 1HG2 VAL 86 1HG2 VAL 86 4.361 -1.680 3.075 514 2HG2 VAL 86 2HG2 VAL 86 4.017 -0.770 4.553 515 3HG2 VAL 86 3HG2 VAL 86 3.951 0.043 2.978 516 H THR 87 H THR 87 7.753 0.995 0.462 517 HA THR 87 HA THR 87 9.288 2.671 1.630 518 HB THR 87 HB THR 87 10.676 0.990 2.759 519 HG1 THR 87 HG1 THR 87 12.673 1.816 2.099 520 1HG2 THR 87 1HG2 THR 87 12.233 -0.411 1.514 521 2HG2 THR 87 2HG2 THR 87 10.548 -0.759 1.083 522 3HG2 THR 87 3HG2 THR 87 11.569 0.190 -0.025 523 HA PRO 88 HA PRO 88 10.406 3.176 -2.748 524 1HB PRO 88 1HB PRO 88 12.289 5.229 -2.396 525 2HB PRO 88 2HB PRO 88 10.556 5.477 -2.670 526 1HG PRO 88 1HG PRO 88 12.068 5.758 -0.143 527 2HG PRO 88 2HG PRO 88 10.531 6.501 -0.618 528 1HD PRO 88 1HD PRO 88 10.868 4.303 1.119 529 2HD PRO 88 2HD PRO 88 9.329 4.798 0.401 530 H MET 89 H MET 89 12.659 3.306 -0.021 531 HA MET 89 HA MET 89 13.994 0.978 -0.510 532 1HB MET 89 1HB MET 89 16.342 2.081 -1.081 533 2HB MET 89 2HB MET 89 15.267 1.447 -2.316 534 1HG MET 89 1HG MET 89 14.558 3.604 -3.012 535 2HG MET 89 2HG MET 89 15.333 4.410 -1.645 536 1HE MET 89 1HE MET 89 15.546 5.132 -4.808 537 2HE MET 89 2HE MET 89 16.269 6.111 -3.505 538 3HE MET 89 3HE MET 89 17.265 5.583 -4.881 539 H ALA 90 H ALA 90 15.366 4.181 0.277 540 HA ALA 90 HA ALA 90 16.642 3.270 2.595 541 1HB ALA 90 1HB ALA 90 17.160 5.635 2.964 542 2HB ALA 90 2HB ALA 90 17.319 5.229 1.242 543 3HB ALA 90 3HB ALA 90 15.886 6.107 1.818 544 H ALA 91 H ALA 91 13.476 4.920 2.297 545 HA ALA 91 HA ALA 91 13.369 5.497 5.156 546 1HB ALA 91 1HB ALA 91 11.311 5.877 2.947 547 2HB ALA 91 2HB ALA 91 11.104 6.402 4.637 548 3HB ALA 91 3HB ALA 91 12.412 7.079 3.628 549 H GLY 92 H GLY 92 10.424 4.258 3.746 550 1HA GLY 92 1HA GLY 92 9.075 2.541 4.383 551 2HA GLY 92 2HA GLY 92 10.471 1.699 5.063 552 H ALA 93 H ALA 93 11.369 3.087 7.118 553 HA ALA 93 HA ALA 93 9.717 2.576 9.243 554 1HB ALA 93 1HB ALA 93 12.111 3.032 9.452 555 2HB ALA 93 2HB ALA 93 11.853 4.746 9.063 556 3HB ALA 93 3HB ALA 93 11.190 4.065 10.564 557 H TYR 94 H TYR 94 10.217 5.870 7.893 558 HA TYR 94 HA TYR 94 8.122 7.050 9.437 559 1HB TYR 94 1HB TYR 94 9.529 8.100 6.962 560 2HB TYR 94 2HB TYR 94 8.712 9.049 8.202 561 HD1 TYR 94 HD1 TYR 94 11.871 8.419 7.067 562 HD2 TYR 94 HD2 TYR 94 9.636 8.154 10.756 563 HE1 TYR 94 HE1 TYR 94 13.960 8.701 8.372 564 HE2 TYR 94 HE2 TYR 94 11.717 8.370 12.035 565 HH TYR 94 HH TYR 94 13.949 8.819 11.948 566 H PHE 95 H PHE 95 7.549 4.846 7.082 567 HA PHE 95 HA PHE 95 5.465 6.358 5.711 568 1HB PHE 95 1HB PHE 95 6.716 4.483 4.536 569 2HB PHE 95 2HB PHE 95 6.081 3.376 5.738 570 HD1 PHE 95 HD1 PHE 95 3.663 2.789 5.859 571 HD2 PHE 95 HD2 PHE 95 5.420 4.904 2.525 572 HE1 PHE 95 HE1 PHE 95 1.849 2.004 4.390 573 HE2 PHE 95 HE2 PHE 95 3.568 4.175 1.088 574 HZ PHE 95 HZ PHE 95 1.772 2.710 2.005 575 H ASN 96 H ASN 96 3.529 6.731 6.823 576 HA ASN 96 HA ASN 96 3.330 5.533 9.356 577 1HB ASN 96 1HB ASN 96 1.382 7.280 7.824 578 2HB ASN 96 2HB ASN 96 1.026 6.643 9.424 579 1HD2 ASN 96 1HD2 ASN 96 2.863 9.057 7.731 580 2HD2 ASN 96 2HD2 ASN 96 3.411 9.821 9.259 581 H LYS 97 H LYS 97 3.301 3.308 8.918 582 HA LYS 97 HA LYS 97 1.522 1.828 9.963 583 1HB LYS 97 1HB LYS 97 -0.326 2.797 8.753 584 2HB LYS 97 2HB LYS 97 0.269 2.118 7.210 585 1HG LYS 97 1HG LYS 97 -0.153 -0.153 8.245 586 2HG LYS 97 2HG LYS 97 -0.815 0.663 9.667 587 1HD LYS 97 1HD LYS 97 -1.829 0.680 6.794 588 2HD LYS 97 2HD LYS 97 -2.662 0.042 8.204 589 1HE LYS 97 1HE LYS 97 -2.203 2.986 7.468 590 2HE LYS 97 2HE LYS 97 -3.723 2.106 7.457 591 1HZ LYS 97 1HZ LYS 97 -3.567 3.477 9.414 592 2HZ LYS 97 2HZ LYS 97 -3.575 1.925 9.867 593 3HZ LYS 97 3HZ LYS 97 -2.169 2.783 9.867 594 H VAL 98 H VAL 98 3.799 1.101 9.924 595 HA VAL 98 HA VAL 98 4.621 -0.536 7.606 596 HB VAL 98 HB VAL 98 6.192 0.068 10.144 597 1HG1 VAL 98 1HG1 VAL 98 8.132 -0.398 8.700 598 2HG1 VAL 98 2HG1 VAL 98 7.066 -1.803 8.769 599 3HG1 VAL 98 3HG1 VAL 98 7.055 -0.751 7.336 600 1HG2 VAL 98 1HG2 VAL 98 7.328 1.823 8.778 601 2HG2 VAL 98 2HG2 VAL 98 6.024 1.677 7.580 602 3HG2 VAL 98 3HG2 VAL 98 5.677 2.211 9.249 603 H GLN 99 H GLN 99 4.361 -0.932 11.172 604 HA GLN 99 HA GLN 99 5.509 -3.521 11.005 605 1HB GLN 99 1HB GLN 99 4.245 -2.100 13.373 606 2HB GLN 99 2HB GLN 99 5.233 -3.570 13.440 607 1HG GLN 99 1HG GLN 99 7.099 -2.287 12.296 608 2HG GLN 99 2HG GLN 99 6.160 -0.807 12.548 609 1HE2 GLN 99 1HE2 GLN 99 5.173 -0.943 15.079 610 2HE2 GLN 99 2HE2 GLN 99 6.485 -1.157 16.226 611 H CYS 100 H CYS 100 3.849 -4.420 9.493 612 HA CYS 100 HA CYS 100 2.529 -6.427 11.190 613 1HB CYS 100 1HB CYS 100 0.701 -4.736 10.633 614 2HB CYS 100 2HB CYS 100 0.897 -5.205 8.930 615 HG CYS 100 HG CYS 100 0.180 -7.008 11.606 616 H PHE 101 H PHE 101 4.866 -6.774 10.067 617 HA PHE 101 HA PHE 101 4.684 -7.745 7.316 618 1HB PHE 101 1HB PHE 101 6.659 -6.517 8.299 619 2HB PHE 101 2HB PHE 101 7.028 -7.973 9.222 620 HD1 PHE 101 HD1 PHE 101 8.267 -9.754 8.168 621 HD2 PHE 101 HD2 PHE 101 6.478 -6.671 5.730 622 HE1 PHE 101 HE1 PHE 101 9.482 -10.608 6.188 623 HE2 PHE 101 HE2 PHE 101 7.702 -7.530 3.756 624 HZ PHE 101 HZ PHE 101 9.201 -9.503 3.977 625 H CYS 102 H CYS 102 2.869 -9.125 8.276 626 HA CYS 102 HA CYS 102 3.666 -11.858 7.902 627 1HB CYS 102 1HB CYS 102 4.165 -11.753 10.338 628 2HB CYS 102 2HB CYS 102 2.514 -11.177 10.658 629 HG CYS 102 HG CYS 102 1.286 -13.237 9.707 630 H PHE 103 H PHE 103 2.327 -10.327 6.322 631 HA PHE 103 HA PHE 103 -0.279 -9.630 7.308 632 1HB PHE 103 1HB PHE 103 1.368 -8.233 5.901 633 2HB PHE 103 2HB PHE 103 0.773 -9.142 4.516 634 HD1 PHE 103 HD1 PHE 103 -0.298 -7.020 7.408 635 HD2 PHE 103 HD2 PHE 103 -1.296 -8.455 3.472 636 HE1 PHE 103 HE1 PHE 103 -2.275 -5.515 7.361 637 HE2 PHE 103 HE2 PHE 103 -3.232 -6.906 3.400 638 HZ PHE 103 HZ PHE 103 -3.741 -5.455 5.345 639 H THR 104 H THR 104 -2.262 -9.759 5.892 640 HA THR 104 HA THR 104 -2.400 -11.809 3.954 641 HB THR 104 HB THR 104 -2.534 -13.337 5.859 642 HG1 THR 104 HG1 THR 104 -4.009 -13.635 4.100 643 1HG2 THR 104 1HG2 THR 104 -3.211 -11.773 7.643 644 2HG2 THR 104 2HG2 THR 104 -4.829 -11.638 6.918 645 3HG2 THR 104 3HG2 THR 104 -4.272 -13.189 7.571 646 H GLU 105 H GLU 105 -4.349 -11.748 2.836 647 HA GLU 105 HA GLU 105 -6.465 -9.869 3.737 648 1HB GLU 105 1HB GLU 105 -5.647 -10.297 0.823 649 2HB GLU 105 2HB GLU 105 -6.971 -9.299 1.438 650 1HG GLU 105 1HG GLU 105 -5.335 -7.928 2.723 651 2HG GLU 105 2HG GLU 105 -4.009 -8.859 1.995 652 H THR 106 H THR 106 -6.070 -12.549 4.498 653 HA THR 106 HA THR 106 -7.234 -14.458 4.736 654 HB THR 106 HB THR 106 -8.719 -13.003 5.800 655 HG1 THR 106 HG1 THR 106 -10.639 -14.136 5.534 656 1HG2 THR 106 1HG2 THR 106 -9.199 -11.237 4.221 657 2HG2 THR 106 2HG2 THR 106 -10.049 -12.355 3.134 658 3HG2 THR 106 3HG2 THR 106 -10.712 -11.977 4.729 659 H THR 107 H THR 107 -9.914 -14.385 2.934 660 HA THR 107 HA THR 107 -8.853 -15.759 0.532 661 HB THR 107 HB THR 107 -10.486 -16.802 2.869 662 HG1 THR 107 HG1 THR 107 -8.536 -18.035 1.244 663 1HG2 THR 107 1HG2 THR 107 -11.131 -18.800 1.513 664 2HG2 THR 107 2HG2 THR 107 -11.994 -17.338 1.039 665 3HG2 THR 107 3HG2 THR 107 -10.657 -17.939 0.038 666 H LEU 108 H LEU 108 -10.396 -15.819 -1.156 667 HA LEU 108 HA LEU 108 -13.003 -14.474 -0.773 668 1HB LEU 108 1HB LEU 108 -10.925 -13.941 -2.923 669 2HB LEU 108 2HB LEU 108 -12.624 -13.520 -3.139 670 HG LEU 108 HG LEU 108 -10.853 -12.372 -0.949 671 1HD1 LEU 108 1HD1 LEU 108 -10.343 -11.835 -3.478 672 2HD1 LEU 108 2HD1 LEU 108 -11.832 -10.885 -3.405 673 3HD1 LEU 108 3HD1 LEU 108 -10.463 -10.522 -2.327 674 1HD2 LEU 108 1HD2 LEU 108 -12.799 -10.691 -0.869 675 2HD2 LEU 108 2HD2 LEU 108 -13.684 -11.758 -1.944 676 3HD2 LEU 108 3HD2 LEU 108 -13.222 -12.310 -0.319 677 H GLU 109 H GLU 109 -14.496 -15.869 -1.503 678 HA GLU 109 HA GLU 109 -14.036 -18.123 -3.076 679 1HB GLU 109 1HB GLU 109 -16.458 -16.414 -2.426 680 2HB GLU 109 2HB GLU 109 -16.622 -17.849 -3.422 681 1HG GLU 109 1HG GLU 109 -17.098 -18.353 -1.067 682 2HG GLU 109 2HG GLU 109 -15.694 -19.263 -1.638 683 HA PRO 110 HA PRO 110 -13.349 -16.861 -7.098 684 1HB PRO 110 1HB PRO 110 -14.735 -18.611 -8.707 685 2HB PRO 110 2HB PRO 110 -13.314 -18.974 -7.693 686 1HG PRO 110 1HG PRO 110 -16.225 -19.428 -7.007 687 2HG PRO 110 2HG PRO 110 -14.877 -20.601 -6.858 688 1HD PRO 110 1HD PRO 110 -15.716 -19.188 -4.738 689 2HD PRO 110 2HD PRO 110 -13.987 -19.454 -4.990 690 H GLY 111 H GLY 111 -14.159 -14.779 -7.087 691 1HA GLY 111 1HA GLY 111 -15.484 -13.671 -9.073 692 2HA GLY 111 2HA GLY 111 -16.877 -14.262 -8.143 693 H GLU 112 H GLU 112 -15.336 -13.917 -5.543 694 HA GLU 112 HA GLU 112 -16.894 -11.618 -5.186 695 1HB GLU 112 1HB GLU 112 -15.169 -13.096 -3.162 696 2HB GLU 112 2HB GLU 112 -16.532 -12.021 -2.819 697 1HG GLU 112 1HG GLU 112 -16.641 -14.706 -4.105 698 2HG GLU 112 2HG GLU 112 -17.427 -14.142 -2.633 699 H GLU 113 H GLU 113 -16.521 -9.701 -4.142 700 HA GLU 113 HA GLU 113 -14.236 -8.219 -5.207 701 1HB GLU 113 1HB GLU 113 -16.802 -7.440 -3.789 702 2HB GLU 113 2HB GLU 113 -15.610 -6.288 -4.388 703 1HG GLU 113 1HG GLU 113 -16.792 -8.290 -6.243 704 2HG GLU 113 2HG GLU 113 -17.655 -6.825 -5.778 705 H MET 114 H MET 114 -12.864 -6.859 -3.872 706 HA MET 114 HA MET 114 -13.028 -7.077 -0.916 707 1HB MET 114 1HB MET 114 -11.671 -8.894 -1.548 708 2HB MET 114 2HB MET 114 -10.771 -8.020 -2.774 709 1HG MET 114 1HG MET 114 -9.492 -6.854 -1.183 710 2HG MET 114 2HG MET 114 -10.687 -7.078 0.100 711 1HE MET 114 1HE MET 114 -9.905 -10.596 1.443 712 2HE MET 114 2HE MET 114 -10.591 -9.002 1.828 713 3HE MET 114 3HE MET 114 -11.274 -9.975 0.509 714 H GLU 115 H GLU 115 -13.629 -4.795 -0.904 715 HA GLU 115 HA GLU 115 -11.500 -2.946 -1.884 716 1HB GLU 115 1HB GLU 115 -13.720 -2.590 -2.899 717 2HB GLU 115 2HB GLU 115 -14.392 -2.261 -1.293 718 1HG GLU 115 1HG GLU 115 -12.968 -0.308 -1.027 719 2HG GLU 115 2HG GLU 115 -12.020 -0.728 -2.463 720 H MET 116 H MET 116 -10.567 -1.496 -0.491 721 HA MET 116 HA MET 116 -11.467 -1.378 2.311 722 1HB MET 116 1HB MET 116 -9.114 -1.832 3.097 723 2HB MET 116 2HB MET 116 -10.180 -3.181 2.687 724 1HG MET 116 1HG MET 116 -9.125 -3.549 0.601 725 2HG MET 116 2HG MET 116 -8.199 -2.047 0.711 726 1HE MET 116 1HE MET 116 -5.404 -4.753 0.904 727 2HE MET 116 2HE MET 116 -6.917 -4.954 -0.010 728 3HE MET 116 3HE MET 116 -6.064 -3.386 -0.008 729 HA PRO 117 HA PRO 117 -10.107 2.976 1.483 730 1HB PRO 117 1HB PRO 117 -11.419 3.016 4.169 731 2HB PRO 117 2HB PRO 117 -11.471 4.217 2.859 732 1HG PRO 117 1HG PRO 117 -13.558 2.545 3.195 733 2HG PRO 117 2HG PRO 117 -12.922 2.822 1.546 734 1HD PRO 117 1HD PRO 117 -12.322 0.506 3.407 735 2HD PRO 117 2HD PRO 117 -12.783 0.467 1.676 736 H VAL 118 H VAL 118 -7.819 2.947 1.706 737 HA VAL 118 HA VAL 118 -6.717 2.464 4.442 738 HB VAL 118 HB VAL 118 -5.474 2.486 1.676 739 1HG1 VAL 118 1HG1 VAL 118 -4.074 2.517 4.378 740 2HG1 VAL 118 2HG1 VAL 118 -3.309 2.070 2.837 741 3HG1 VAL 118 3HG1 VAL 118 -3.911 3.710 3.063 742 1HG2 VAL 118 1HG2 VAL 118 -6.507 0.374 2.353 743 2HG2 VAL 118 2HG2 VAL 118 -4.743 0.213 2.442 744 3HG2 VAL 118 3HG2 VAL 118 -5.682 0.431 3.925 745 H VAL 119 H VAL 119 -6.533 4.220 5.657 746 HA VAL 119 HA VAL 119 -6.295 6.901 4.500 747 HB VAL 119 HB VAL 119 -7.658 6.578 6.481 748 1HG1 VAL 119 1HG1 VAL 119 -6.708 6.106 8.671 749 2HG1 VAL 119 2HG1 VAL 119 -6.403 4.735 7.605 750 3HG1 VAL 119 3HG1 VAL 119 -5.094 5.877 7.977 751 1HG2 VAL 119 1HG2 VAL 119 -6.801 8.440 7.791 752 2HG2 VAL 119 2HG2 VAL 119 -5.185 8.249 7.091 753 3HG2 VAL 119 3HG2 VAL 119 -6.546 8.756 6.066 754 H PHE 120 H PHE 120 -4.318 8.112 4.464 755 HA PHE 120 HA PHE 120 -1.903 6.889 5.574 756 1HB PHE 120 1HB PHE 120 -2.378 5.745 3.335 757 2HB PHE 120 2HB PHE 120 -2.165 7.317 2.563 758 HD1 PHE 120 HD1 PHE 120 0.081 8.034 2.015 759 HD2 PHE 120 HD2 PHE 120 -0.522 4.937 4.959 760 HE1 PHE 120 HE1 PHE 120 2.507 8.025 2.536 761 HE2 PHE 120 HE2 PHE 120 1.868 5.010 5.510 762 HZ PHE 120 HZ PHE 120 3.388 6.575 4.319 763 H PHE 121 H PHE 121 0.044 8.175 5.266 764 HA PHE 121 HA PHE 121 0.164 10.827 4.355 765 1HB PHE 121 1HB PHE 121 0.188 11.964 6.580 766 2HB PHE 121 2HB PHE 121 -1.406 11.437 6.087 767 HD1 PHE 121 HD1 PHE 121 1.294 11.197 8.524 768 HD2 PHE 121 HD2 PHE 121 -2.465 9.507 7.275 769 HE1 PHE 121 HE1 PHE 121 1.028 10.168 10.744 770 HE2 PHE 121 HE2 PHE 121 -2.596 8.243 9.392 771 HZ PHE 121 HZ PHE 121 -0.809 8.551 11.147 772 H VAL 122 H VAL 122 2.253 11.856 5.114 773 HA VAL 122 HA VAL 122 4.258 9.843 6.079 774 HB VAL 122 HB VAL 122 4.544 11.999 3.943 775 1HG1 VAL 122 1HG1 VAL 122 6.579 10.168 5.273 776 2HG1 VAL 122 2HG1 VAL 122 6.857 10.940 3.696 777 3HG1 VAL 122 3HG1 VAL 122 6.621 11.933 5.135 778 1HG2 VAL 122 1HG2 VAL 122 4.499 8.962 3.833 779 2HG2 VAL 122 2HG2 VAL 122 3.382 10.092 3.062 780 3HG2 VAL 122 3HG2 VAL 122 5.048 9.992 2.490 781 H ASP 123 H ASP 123 5.486 10.498 7.805 782 HA ASP 123 HA ASP 123 4.783 13.136 8.880 783 1HB ASP 123 1HB ASP 123 5.901 10.639 10.064 784 2HB ASP 123 2HB ASP 123 6.364 12.167 10.822 785 HA PRO 124 HA PRO 124 8.624 15.079 7.808 786 1HB PRO 124 1HB PRO 124 8.603 17.272 9.500 787 2HB PRO 124 2HB PRO 124 7.576 17.022 8.100 788 1HG PRO 124 1HG PRO 124 6.897 16.521 11.005 789 2HG PRO 124 2HG PRO 124 5.860 17.302 9.766 790 1HD PRO 124 1HD PRO 124 5.608 14.675 10.515 791 2HD PRO 124 2HD PRO 124 5.192 15.305 8.894 792 H GLU 125 H GLU 125 9.233 12.832 9.048 793 HA GLU 125 HA GLU 125 11.511 13.614 10.834 794 1HB GLU 125 1HB GLU 125 10.566 10.836 10.143 795 2HB GLU 125 2HB GLU 125 11.817 11.309 11.297 796 1HG GLU 125 1HG GLU 125 9.921 12.637 12.492 797 2HG GLU 125 2HG GLU 125 8.823 11.624 11.526 798 H ILE 126 H ILE 126 10.546 11.969 7.825 799 HA ILE 126 HA ILE 126 12.852 10.847 7.074 800 HB ILE 126 HB ILE 126 10.692 10.565 6.036 801 1HG1 ILE 126 1HG1 ILE 126 12.804 11.271 3.947 802 2HG1 ILE 126 2HG1 ILE 126 12.874 9.858 5.025 803 1HG2 ILE 126 1HG2 ILE 126 11.192 13.092 4.417 804 2HG2 ILE 126 2HG2 ILE 126 9.774 12.037 4.367 805 3HG2 ILE 126 3HG2 ILE 126 10.081 13.014 5.801 806 1HD1 ILE 126 1HD1 ILE 126 11.933 9.184 2.929 807 2HD1 ILE 126 2HD1 ILE 126 10.709 9.083 4.214 808 3HD1 ILE 126 3HD1 ILE 126 10.663 10.419 3.027 809 H VAL 127 H VAL 127 12.159 14.308 6.449 810 HA VAL 127 HA VAL 127 14.754 14.655 5.108 811 HB VAL 127 HB VAL 127 14.139 17.063 5.113 812 1HG1 VAL 127 1HG1 VAL 127 12.067 15.189 3.911 813 2HG1 VAL 127 2HG1 VAL 127 12.435 16.842 3.390 814 3HG1 VAL 127 3HG1 VAL 127 13.656 15.570 3.216 815 1HG2 VAL 127 1HG2 VAL 127 11.900 17.781 5.663 816 2HG2 VAL 127 2HG2 VAL 127 11.406 16.153 6.141 817 3HG2 VAL 127 3HG2 VAL 127 12.589 17.047 7.117 818 H LYS 128 H LYS 128 15.338 13.448 7.440 819 HA LYS 128 HA LYS 128 16.908 15.554 8.784 820 1HB LYS 128 1HB LYS 128 15.281 13.500 10.312 821 2HB LYS 128 2HB LYS 128 16.562 14.507 11.001 822 1HG LYS 128 1HG LYS 128 15.268 16.528 10.496 823 2HG LYS 128 2HG LYS 128 14.072 15.567 9.599 824 1HD LYS 128 1HD LYS 128 13.500 14.291 11.598 825 2HD LYS 128 2HD LYS 128 14.607 15.268 12.576 826 1HE LYS 128 1HE LYS 128 13.267 17.174 12.480 827 2HE LYS 128 2HE LYS 128 12.534 16.742 10.930 828 1HZ LYS 128 1HZ LYS 128 11.854 15.146 13.294 829 2HZ LYS 128 2HZ LYS 128 11.112 16.573 12.974 830 3HZ LYS 128 3HZ LYS 128 11.034 15.384 11.879 831 HA PRO 129 HA PRO 129 19.542 11.756 9.452 832 1HB PRO 129 1HB PRO 129 18.782 9.216 8.642 833 2HB PRO 129 2HB PRO 129 18.521 9.888 10.276 834 1HG PRO 129 1HG PRO 129 16.612 9.777 7.946 835 2HG PRO 129 2HG PRO 129 16.280 9.361 9.645 836 1HD PRO 129 1HD PRO 129 15.548 11.763 8.661 837 2HD PRO 129 2HD PRO 129 16.278 11.615 10.293 838 H VAL 130 H VAL 130 21.240 11.331 8.125 839 HA VAL 130 HA VAL 130 21.498 12.291 5.545 840 HB VAL 130 HB VAL 130 23.027 10.101 7.008 841 1HG1 VAL 130 1HG1 VAL 130 23.520 9.987 4.616 842 2HG1 VAL 130 2HG1 VAL 130 23.770 11.750 4.564 843 3HG1 VAL 130 3HG1 VAL 130 24.884 10.707 5.481 844 1HG2 VAL 130 1HG2 VAL 130 23.034 12.260 8.228 845 2HG2 VAL 130 2HG2 VAL 130 24.615 11.936 7.514 846 3HG2 VAL 130 3HG2 VAL 130 23.521 13.102 6.743 847 H GLU 131 H GLU 131 21.041 8.973 6.636 848 HA GLU 131 HA GLU 131 20.921 7.338 4.511 849 1HB GLU 131 1HB GLU 131 18.875 7.407 6.740 850 2HB GLU 131 2HB GLU 131 19.304 6.040 5.697 851 1HG GLU 131 1HG GLU 131 20.745 5.539 7.345 852 2HG GLU 131 2HG GLU 131 21.809 6.700 6.587 853 H THR 132 H THR 132 18.198 9.568 5.352 854 HA THR 132 HA THR 132 16.890 8.634 2.853 855 HB THR 132 HB THR 132 14.795 9.486 3.932 856 HG1 THR 132 HG1 THR 132 15.466 10.835 5.550 857 1HG2 THR 132 1HG2 THR 132 16.319 7.350 5.491 858 2HG2 THR 132 2HG2 THR 132 14.568 7.620 5.533 859 3HG2 THR 132 3HG2 THR 132 15.346 7.094 4.027 860 H GLN 133 H GLN 133 18.689 11.278 3.849 861 HA GLN 133 HA GLN 133 17.075 13.410 2.848 862 1HB GLN 133 1HB GLN 133 20.096 13.084 2.927 863 2HB GLN 133 2HB GLN 133 19.227 14.586 2.537 864 1HG GLN 133 1HG GLN 133 19.588 13.297 5.201 865 2HG GLN 133 2HG GLN 133 19.762 14.985 4.735 866 1HE2 GLN 133 1HE2 GLN 133 17.603 12.392 5.507 867 2HE2 GLN 133 2HE2 GLN 133 16.095 13.260 5.672 868 H GLY 134 H GLY 134 16.091 13.372 1.017 869 1HA GLY 134 1HA GLY 134 16.655 13.933 -1.457 870 2HA GLY 134 2HA GLY 134 17.389 12.318 -1.446 871 H ILE 135 H ILE 135 15.493 11.142 0.442 872 HA ILE 135 HA ILE 135 13.595 10.231 -1.527 873 HB ILE 135 HB ILE 135 13.806 9.675 1.447 874 1HG1 ILE 135 1HG1 ILE 135 15.817 8.883 0.443 875 2HG1 ILE 135 2HG1 ILE 135 14.730 7.498 0.580 876 1HG2 ILE 135 1HG2 ILE 135 11.537 9.162 0.623 877 2HG2 ILE 135 2HG2 ILE 135 12.217 8.238 -0.721 878 3HG2 ILE 135 3HG2 ILE 135 12.441 7.692 0.961 879 1HD1 ILE 135 1HD1 ILE 135 15.819 7.393 -1.544 880 2HD1 ILE 135 2HD1 ILE 135 14.111 7.783 -1.833 881 3HD1 ILE 135 3HD1 ILE 135 15.352 9.054 -1.954 882 H LYS 136 H LYS 136 11.790 11.151 -2.096 883 HA LYS 136 HA LYS 136 9.869 11.701 -0.045 884 1HB LYS 136 1HB LYS 136 9.226 13.961 -0.936 885 2HB LYS 136 2HB LYS 136 10.580 13.798 0.185 886 1HG LYS 136 1HG LYS 136 12.182 13.918 -1.744 887 2HG LYS 136 2HG LYS 136 10.783 14.197 -2.818 888 1HD LYS 136 1HD LYS 136 10.057 16.039 -1.187 889 2HD LYS 136 2HD LYS 136 11.595 15.805 -0.351 890 1HE LYS 136 1HE LYS 136 12.796 16.484 -2.470 891 2HE LYS 136 2HE LYS 136 11.219 16.711 -3.253 892 1HZ LYS 136 1HZ LYS 136 11.979 18.816 -2.473 893 2HZ LYS 136 2HZ LYS 136 10.730 18.385 -1.496 894 3HZ LYS 136 3HZ LYS 136 12.231 18.250 -0.947 895 H THR 137 H THR 137 9.771 9.649 -1.578 896 HA THR 137 HA THR 137 7.199 10.125 -2.659 897 HB THR 137 HB THR 137 9.123 8.758 -4.543 898 HG1 THR 137 HG1 THR 137 8.510 11.294 -4.344 899 1HG2 THR 137 1HG2 THR 137 7.035 7.582 -4.465 900 2HG2 THR 137 2HG2 THR 137 6.148 9.111 -4.635 901 3HG2 THR 137 3HG2 THR 137 7.187 8.507 -5.965 902 H LEU 138 H LEU 138 6.500 9.011 -0.892 903 HA LEU 138 HA LEU 138 8.233 6.874 0.051 904 1HB LEU 138 1HB LEU 138 7.033 8.775 1.345 905 2HB LEU 138 2HB LEU 138 5.673 7.645 1.420 906 HG LEU 138 HG LEU 138 7.486 5.972 2.199 907 1HD1 LEU 138 1HD1 LEU 138 9.534 7.268 1.789 908 2HD1 LEU 138 2HD1 LEU 138 8.908 8.568 2.838 909 3HD1 LEU 138 3HD1 LEU 138 9.296 6.972 3.519 910 1HD2 LEU 138 1HD2 LEU 138 7.249 6.767 4.559 911 2HD2 LEU 138 2HD2 LEU 138 6.719 8.337 3.975 912 3HD2 LEU 138 3HD2 LEU 138 5.703 6.917 3.679 913 H THR 139 H THR 139 8.095 5.186 -1.351 914 HA THR 139 HA THR 139 5.540 4.450 -2.464 915 HB THR 139 HB THR 139 8.441 3.942 -2.995 916 HG1 THR 139 HG1 THR 139 6.314 4.601 -4.696 917 1HG2 THR 139 1HG2 THR 139 6.295 2.255 -4.336 918 2HG2 THR 139 2HG2 THR 139 7.978 2.428 -4.850 919 3HG2 THR 139 3HG2 THR 139 7.622 1.663 -3.303 920 H LEU 140 H LEU 140 4.803 2.345 -2.682 921 HA LEU 140 HA LEU 140 5.535 0.335 -0.620 922 1HB LEU 140 1HB LEU 140 3.274 1.282 -0.026 923 2HB LEU 140 2HB LEU 140 2.851 1.330 -1.752 924 HG LEU 140 HG LEU 140 2.710 -1.094 -1.884 925 1HD1 LEU 140 1HD1 LEU 140 3.066 -1.025 1.128 926 2HD1 LEU 140 2HD1 LEU 140 2.648 -2.423 0.122 927 3HD1 LEU 140 3HD1 LEU 140 4.254 -1.683 -0.026 928 1HD2 LEU 140 1HD2 LEU 140 0.608 -1.282 -0.616 929 2HD2 LEU 140 2HD2 LEU 140 1.012 0.191 0.290 930 3HD2 LEU 140 3HD2 LEU 140 0.716 0.272 -1.459 931 H SER 141 H SER 141 6.143 -1.485 -1.700 932 HA SER 141 HA SER 141 5.008 -2.005 -4.416 933 1HB SER 141 1HB SER 141 7.002 -3.444 -4.694 934 2HB SER 141 2HB SER 141 7.419 -1.729 -4.593 935 HG SER 141 HG SER 141 7.313 -3.437 -2.343 936 H TYR 142 H TYR 142 3.291 -3.232 -4.075 937 HA TYR 142 HA TYR 142 3.398 -5.232 -1.886 938 1HB TYR 142 1HB TYR 142 1.728 -3.337 -1.788 939 2HB TYR 142 2HB TYR 142 0.920 -4.054 -3.170 940 HD1 TYR 142 HD1 TYR 142 -0.794 -3.631 -1.095 941 HD2 TYR 142 HD2 TYR 142 2.048 -6.887 -1.346 942 HE1 TYR 142 HE1 TYR 142 -2.163 -4.987 0.460 943 HE2 TYR 142 HE2 TYR 142 0.735 -8.150 0.274 944 HH TYR 142 HH TYR 142 -2.523 -7.192 1.114 945 H THR 143 H THR 143 4.391 -6.909 -3.026 946 HA THR 143 HA THR 143 3.326 -7.860 -5.557 947 HB THR 143 HB THR 143 4.946 -9.753 -4.958 948 HG1 THR 143 HG1 THR 143 4.871 -9.244 -2.704 949 1HG2 THR 143 1HG2 THR 143 6.014 -6.901 -5.128 950 2HG2 THR 143 2HG2 THR 143 6.946 -8.383 -5.436 951 3HG2 THR 143 3HG2 THR 143 5.583 -7.964 -6.492 952 H PHE 144 H PHE 144 1.131 -8.266 -5.143 953 HA PHE 144 HA PHE 144 0.197 -10.417 -3.421 954 1HB PHE 144 1HB PHE 144 -0.641 -9.073 -5.975 955 2HB PHE 144 2HB PHE 144 -1.366 -10.599 -5.536 956 HD1 PHE 144 HD1 PHE 144 -3.441 -9.287 -5.879 957 HD2 PHE 144 HD2 PHE 144 -0.678 -8.361 -2.688 958 HE1 PHE 144 HE1 PHE 144 -5.278 -8.259 -4.581 959 HE2 PHE 144 HE2 PHE 144 -2.557 -7.379 -1.392 960 HZ PHE 144 HZ PHE 144 -4.830 -7.324 -2.321 961 H TYR 145 H TYR 145 1.833 -12.047 -3.435 962 HA TYR 145 HA TYR 145 1.435 -13.906 -5.664 963 1HB TYR 145 1HB TYR 145 3.785 -14.317 -6.095 964 2HB TYR 145 2HB TYR 145 3.269 -12.693 -6.506 965 HD1 TYR 145 HD1 TYR 145 3.847 -12.723 -2.940 966 HD2 TYR 145 HD2 TYR 145 5.839 -12.679 -6.776 967 HE1 TYR 145 HE1 TYR 145 5.784 -11.624 -1.924 968 HE2 TYR 145 HE2 TYR 145 7.804 -11.597 -5.723 969 HH TYR 145 HH TYR 145 7.701 -10.356 -2.424 970 HA PRO 146 HA PRO 146 2.017 -16.420 -1.841 971 1HB PRO 146 1HB PRO 146 -0.489 -16.889 -0.950 972 2HB PRO 146 2HB PRO 146 0.387 -15.379 -0.622 973 1HG PRO 146 1HG PRO 146 -1.804 -15.790 -2.657 974 2HG PRO 146 2HG PRO 146 -1.470 -14.390 -1.614 975 1HD PRO 146 1HD PRO 146 -0.629 -14.769 -4.298 976 2HD PRO 146 2HD PRO 146 -0.090 -13.485 -3.159 977 H ARG 147 H ARG 147 -1.154 -17.599 -2.878 978 HA ARG 147 HA ARG 147 0.129 -19.714 -4.530 979 1HB ARG 147 1HB ARG 147 -1.923 -20.000 -2.310 980 2HB ARG 147 2HB ARG 147 -1.547 -21.289 -3.449 981 1HG ARG 147 1HG ARG 147 0.626 -20.056 -1.705 982 2HG ARG 147 2HG ARG 147 -0.472 -21.287 -1.095 983 1HD ARG 147 1HD ARG 147 1.517 -22.439 -1.818 984 2HD ARG 147 2HD ARG 147 0.168 -22.868 -2.852 985 HE ARG 147 HE ARG 147 1.248 -22.018 -4.661 986 1HH1 ARG 147 1HH1 ARG 147 2.764 -20.688 -1.781 987 2HH1 ARG 147 2HH1 ARG 147 3.954 -19.757 -2.636 988 1HH2 ARG 147 1HH2 ARG 147 2.874 -20.861 -5.838 989 2HH2 ARG 147 2HH2 ARG 147 4.012 -19.871 -4.987 990 H GLU 148 H GLU 148 -0.864 -20.179 -6.332 991 HA GLU 148 HA GLU 148 -3.568 -19.131 -6.937 992 1HB GLU 148 1HB GLU 148 -2.511 -17.990 -8.512 993 2HB GLU 148 2HB GLU 148 -1.007 -18.864 -8.308 994 1HG GLU 148 1HG GLU 148 -1.684 -19.032 -10.561 995 2HG GLU 148 2HG GLU 148 -1.815 -20.638 -9.862 996 HA PRO 149 HA PRO 149 -3.935 -23.657 -6.958 997 1HB PRO 149 1HB PRO 149 -6.633 -23.910 -7.018 998 2HB PRO 149 2HB PRO 149 -5.760 -23.329 -5.571 999 1HG PRO 149 1HG PRO 149 -7.054 -21.629 -7.726 1000 2HG PRO 149 2HG PRO 149 -7.318 -21.521 -5.953 1001 1HD PRO 149 1HD PRO 149 -5.585 -19.922 -7.257 1002 2HD PRO 149 2HD PRO 149 -5.155 -20.566 -5.645 1003 H SER 150 H SER 150 -5.164 -21.462 -9.435 1004 HA SER 150 HA SER 150 -4.620 -22.257 -11.767 1005 1HB SER 150 1HB SER 150 -6.621 -24.401 -10.948 1006 2HB SER 150 2HB SER 150 -6.375 -23.905 -12.624 1007 HG SER 150 HG SER 150 -4.408 -24.942 -10.898 1008 H LYS 151 H LYS 151 -5.374 -20.168 -12.178 1009 HA LYS 151 HA LYS 151 -8.258 -19.639 -11.910 1010 1HB LYS 151 1HB LYS 151 -7.725 -17.362 -12.005 1011 2HB LYS 151 2HB LYS 151 -6.664 -18.221 -10.919 1012 1HG LYS 151 1HG LYS 151 -4.837 -17.500 -11.912 1013 2HG LYS 151 2HG LYS 151 -5.297 -17.968 -13.503 1014 1HD LYS 151 1HD LYS 151 -6.299 -15.424 -12.092 1015 2HD LYS 151 2HD LYS 151 -4.845 -15.501 -13.070 1016 1HE LYS 151 1HE LYS 151 -6.696 -14.509 -14.310 1017 2HE LYS 151 2HE LYS 151 -6.105 -15.988 -15.088 1018 1HZ LYS 151 1HZ LYS 151 -7.968 -17.147 -14.369 1019 2HZ LYS 151 2HZ LYS 151 -8.529 -15.952 -13.366 1020 3HZ LYS 151 3HZ LYS 151 -8.557 -15.795 -14.999 Start of MODEL 11 1 H VAL 21 H VAL 21 -1.612 11.040 13.808 2 HA VAL 21 HA VAL 21 -3.480 8.803 14.553 3 HB VAL 21 HB VAL 21 -4.944 10.593 15.409 4 1HG1 VAL 21 1HG1 VAL 21 -2.218 10.512 16.764 5 2HG1 VAL 21 2HG1 VAL 21 -3.762 10.950 17.520 6 3HG1 VAL 21 3HG1 VAL 21 -3.500 9.296 16.938 7 1HG2 VAL 21 1HG2 VAL 21 -2.544 12.451 15.181 8 2HG2 VAL 21 2HG2 VAL 21 -3.977 12.500 14.128 9 3HG2 VAL 21 3HG2 VAL 21 -4.137 12.823 15.863 10 H GLU 22 H GLU 22 -5.740 9.256 13.614 11 HA GLU 22 HA GLU 22 -5.471 9.660 10.759 12 1HB GLU 22 1HB GLU 22 -6.969 7.968 11.923 13 2HB GLU 22 2HB GLU 22 -8.069 9.315 12.290 14 1HG GLU 22 1HG GLU 22 -8.358 9.753 9.897 15 2HG GLU 22 2HG GLU 22 -7.089 8.583 9.489 16 H GLN 23 H GLN 23 -4.540 11.765 11.203 17 HA GLN 23 HA GLN 23 -6.156 13.802 10.195 18 1HB GLN 23 1HB GLN 23 -5.807 13.803 13.169 19 2HB GLN 23 2HB GLN 23 -5.189 15.270 12.450 20 1HG GLN 23 1HG GLN 23 -7.989 14.255 11.933 21 2HG GLN 23 2HG GLN 23 -7.537 15.511 13.090 22 1HE2 GLN 23 1HE2 GLN 23 -5.366 15.977 10.597 23 2HE2 GLN 23 2HE2 GLN 23 -6.312 17.071 9.619 24 H ALA 24 H ALA 24 -3.563 13.821 12.433 25 HA ALA 24 HA ALA 24 -1.717 12.679 11.008 26 1HB ALA 24 1HB ALA 24 0.032 14.096 10.342 27 2HB ALA 24 2HB ALA 24 -1.410 14.644 9.541 28 3HB ALA 24 3HB ALA 24 -0.776 15.560 10.929 29 H SER 25 H SER 25 -0.475 14.556 14.460 30 HA SER 25 HA SER 25 -2.123 16.139 12.628 31 1HB SER 25 1HB SER 25 -3.757 14.830 14.133 32 2HB SER 25 2HB SER 25 -2.971 15.562 15.520 33 HG SER 25 HG SER 25 -3.538 17.584 14.727 34 H ASP 26 H ASP 26 0.310 16.604 12.825 35 HA ASP 26 HA ASP 26 0.699 19.079 14.317 36 1HB ASP 26 1HB ASP 26 1.525 17.796 16.099 37 2HB ASP 26 2HB ASP 26 2.143 16.504 15.058 38 H LEU 27 H LEU 27 2.379 16.465 12.895 39 HA LEU 27 HA LEU 27 4.261 16.971 11.273 40 1HB LEU 27 1HB LEU 27 1.861 15.496 10.156 41 2HB LEU 27 2HB LEU 27 3.545 15.159 9.831 42 HG LEU 27 HG LEU 27 1.986 14.580 12.369 43 1HD1 LEU 27 1HD1 LEU 27 2.582 12.288 11.939 44 2HD1 LEU 27 2HD1 LEU 27 1.868 12.952 10.464 45 3HD1 LEU 27 3HD1 LEU 27 3.611 12.744 10.573 46 1HD2 LEU 27 1HD2 LEU 27 5.007 14.354 11.964 47 2HD2 LEU 27 2HD2 LEU 27 4.194 15.402 13.136 48 3HD2 LEU 27 3HD2 LEU 27 4.088 13.649 13.303 49 H ILE 28 H ILE 28 1.313 18.672 10.587 50 HA ILE 28 HA ILE 28 1.494 18.474 7.692 51 HB ILE 28 HB ILE 28 -0.496 20.058 9.365 52 1HG1 ILE 28 1HG1 ILE 28 -0.097 17.100 9.113 53 2HG1 ILE 28 2HG1 ILE 28 -0.701 18.091 10.444 54 1HG2 ILE 28 1HG2 ILE 28 -0.822 18.588 6.730 55 2HG2 ILE 28 2HG2 ILE 28 -2.048 19.570 7.567 56 3HG2 ILE 28 3HG2 ILE 28 -0.642 20.353 6.894 57 1HD1 ILE 28 1HD1 ILE 28 -2.882 18.383 9.313 58 2HD1 ILE 28 2HD1 ILE 28 -2.342 17.260 8.032 59 3HD1 ILE 28 3HD1 ILE 28 -2.513 16.705 9.698 60 H LEU 29 H LEU 29 3.770 19.643 8.304 61 HA LEU 29 HA LEU 29 3.584 22.537 8.571 62 1HB LEU 29 1HB LEU 29 6.176 21.437 7.692 63 2HB LEU 29 2HB LEU 29 5.783 22.598 8.940 64 HG LEU 29 HG LEU 29 5.599 19.563 9.085 65 1HD1 LEU 29 1HD1 LEU 29 7.492 21.464 10.467 66 2HD1 LEU 29 2HD1 LEU 29 7.427 19.697 10.668 67 3HD1 LEU 29 3HD1 LEU 29 7.865 20.391 9.095 68 1HD2 LEU 29 1HD2 LEU 29 3.835 20.583 10.596 69 2HD2 LEU 29 2HD2 LEU 29 5.087 19.706 11.454 70 3HD2 LEU 29 3HD2 LEU 29 5.132 21.488 11.392 71 H ASP 30 H ASP 30 4.702 23.995 6.854 72 HA ASP 30 HA ASP 30 3.463 23.420 4.326 73 1HB ASP 30 1HB ASP 30 4.970 25.752 5.414 74 2HB ASP 30 2HB ASP 30 4.528 25.669 3.701 75 H GLU 31 H GLU 31 4.478 21.538 4.068 76 HA GLU 31 HA GLU 31 6.544 21.622 1.962 77 1HB GLU 31 1HB GLU 31 6.860 20.439 4.639 78 2HB GLU 31 2HB GLU 31 6.786 19.141 3.439 79 1HG GLU 31 1HG GLU 31 8.666 21.513 3.234 80 2HG GLU 31 2HG GLU 31 9.058 20.002 4.065 81 H LYS 32 H LYS 32 6.377 19.693 0.620 82 HA LYS 32 HA LYS 32 3.713 18.423 0.584 83 1HB LYS 32 1HB LYS 32 3.293 20.507 -0.524 84 2HB LYS 32 2HB LYS 32 4.815 20.417 -1.449 85 1HG LYS 32 1HG LYS 32 4.092 18.562 -2.698 86 2HG LYS 32 2HG LYS 32 2.740 18.237 -1.589 87 1HD LYS 32 1HD LYS 32 1.809 19.149 -3.559 88 2HD LYS 32 2HD LYS 32 1.657 20.351 -2.269 89 1HE LYS 32 1HE LYS 32 3.526 21.641 -3.238 90 2HE LYS 32 2HE LYS 32 3.870 20.335 -4.388 91 1HZ LYS 32 1HZ LYS 32 1.717 20.696 -5.370 92 2HZ LYS 32 2HZ LYS 32 1.398 21.928 -4.332 93 3HZ LYS 32 3HZ LYS 32 2.617 22.075 -5.432 94 H ILE 33 H ILE 33 4.254 16.326 0.372 95 HA ILE 33 HA ILE 33 6.799 15.650 -1.057 96 HB ILE 33 HB ILE 33 6.771 15.651 1.407 97 1HG1 ILE 33 1HG1 ILE 33 8.454 14.478 0.088 98 2HG1 ILE 33 2HG1 ILE 33 8.109 13.781 1.658 99 1HG2 ILE 33 1HG2 ILE 33 4.642 14.860 1.982 100 2HG2 ILE 33 2HG2 ILE 33 4.872 13.317 1.117 101 3HG2 ILE 33 3HG2 ILE 33 5.848 13.688 2.540 102 1HD1 ILE 33 1HD1 ILE 33 6.623 12.056 0.436 103 2HD1 ILE 33 2HD1 ILE 33 7.357 12.702 -1.049 104 3HD1 ILE 33 3HD1 ILE 33 8.369 11.944 0.187 105 H LYS 34 H LYS 34 6.558 14.359 -2.796 106 HA LYS 34 HA LYS 34 3.875 13.416 -3.556 107 1HB LYS 34 1HB LYS 34 5.201 14.739 -5.097 108 2HB LYS 34 2HB LYS 34 6.458 13.494 -5.142 109 1HG LYS 34 1HG LYS 34 3.559 12.925 -5.886 110 2HG LYS 34 2HG LYS 34 4.666 13.640 -7.030 111 1HD LYS 34 1HD LYS 34 5.958 11.330 -5.782 112 2HD LYS 34 2HD LYS 34 4.384 10.859 -6.332 113 1HE LYS 34 1HE LYS 34 6.095 12.498 -8.248 114 2HE LYS 34 2HE LYS 34 6.690 10.892 -7.838 115 1HZ LYS 34 1HZ LYS 34 4.794 9.894 -8.606 116 2HZ LYS 34 2HZ LYS 34 3.953 11.281 -8.889 117 3HZ LYS 34 3HZ LYS 34 5.261 10.918 -9.798 118 H VAL 35 H VAL 35 3.441 11.154 -4.112 119 HA VAL 35 HA VAL 35 5.394 9.170 -3.025 120 HB VAL 35 HB VAL 35 2.501 9.572 -2.299 121 1HG1 VAL 35 1HG1 VAL 35 3.269 7.114 -2.378 122 2HG1 VAL 35 2HG1 VAL 35 4.376 7.527 -1.053 123 3HG1 VAL 35 3HG1 VAL 35 2.625 7.687 -0.846 124 1HG2 VAL 35 1HG2 VAL 35 3.284 9.947 -0.002 125 2HG2 VAL 35 2HG2 VAL 35 4.970 9.893 -0.590 126 3HG2 VAL 35 3HG2 VAL 35 3.861 11.195 -1.088 127 H THR 36 H THR 36 5.763 8.271 -4.956 128 HA THR 36 HA THR 36 3.576 7.256 -6.722 129 HB THR 36 HB THR 36 6.612 7.485 -6.809 130 HG1 THR 36 HG1 THR 36 4.814 7.882 -8.914 131 1HG2 THR 36 1HG2 THR 36 5.010 5.590 -8.547 132 2HG2 THR 36 2HG2 THR 36 6.637 6.214 -8.933 133 3HG2 THR 36 3HG2 THR 36 6.406 5.226 -7.498 134 H PHE 37 H PHE 37 2.485 5.692 -5.895 135 HA PHE 37 HA PHE 37 3.761 3.661 -4.177 136 1HB PHE 37 1HB PHE 37 1.010 3.843 -5.470 137 2HB PHE 37 2HB PHE 37 1.526 2.657 -4.297 138 HD1 PHE 37 HD1 PHE 37 -0.408 5.481 -4.599 139 HD2 PHE 37 HD2 PHE 37 2.628 3.791 -2.033 140 HE1 PHE 37 HE1 PHE 37 -1.310 6.737 -2.667 141 HE2 PHE 37 HE2 PHE 37 1.802 5.185 -0.149 142 HZ PHE 37 HZ PHE 37 -0.119 6.738 -0.513 143 H ASP 38 H ASP 38 3.582 1.275 -4.871 144 HA ASP 38 HA ASP 38 3.092 0.929 -7.744 145 1HB ASP 38 1HB ASP 38 5.492 1.015 -7.725 146 2HB ASP 38 2HB ASP 38 5.586 -0.045 -6.347 147 H ALA 39 H ALA 39 1.040 0.169 -7.205 148 HA ALA 39 HA ALA 39 0.923 -2.548 -6.004 149 1HB ALA 39 1HB ALA 39 -1.349 -2.581 -6.904 150 2HB ALA 39 2HB ALA 39 -1.071 -1.083 -5.986 151 3HB ALA 39 3HB ALA 39 -1.053 -1.059 -7.764 152 H ASN 40 H ASN 40 1.593 -4.349 -7.167 153 HA ASN 40 HA ASN 40 1.494 -4.298 -10.131 154 1HB ASN 40 1HB ASN 40 3.618 -5.600 -10.177 155 2HB ASN 40 2HB ASN 40 3.847 -3.951 -9.653 156 1HD2 ASN 40 1HD2 ASN 40 4.817 -3.650 -7.649 157 2HD2 ASN 40 2HD2 ASN 40 5.277 -4.975 -6.601 158 H VAL 41 H VAL 41 1.091 -6.395 -11.017 159 HA VAL 41 HA VAL 41 0.237 -8.476 -9.084 160 HB VAL 41 HB VAL 41 -1.727 -7.236 -9.612 161 1HG1 VAL 41 1HG1 VAL 41 -1.101 -6.245 -11.809 162 2HG1 VAL 41 2HG1 VAL 41 -1.401 -7.823 -12.572 163 3HG1 VAL 41 3HG1 VAL 41 -2.713 -6.965 -11.763 164 1HG2 VAL 41 1HG2 VAL 41 -1.885 -9.681 -9.330 165 2HG2 VAL 41 2HG2 VAL 41 -3.146 -9.044 -10.400 166 3HG2 VAL 41 3HG2 VAL 41 -1.749 -9.892 -11.088 167 H ALA 42 H ALA 42 1.828 -9.884 -9.408 168 HA ALA 42 HA ALA 42 2.352 -10.806 -12.209 169 1HB ALA 42 1HB ALA 42 4.158 -12.107 -11.252 170 2HB ALA 42 2HB ALA 42 4.309 -10.410 -10.752 171 3HB ALA 42 3HB ALA 42 3.678 -11.624 -9.618 172 H ALA 43 H ALA 43 2.427 -13.270 -12.401 173 HA ALA 43 HA ALA 43 -0.049 -14.484 -11.682 174 1HB ALA 43 1HB ALA 43 1.038 -16.553 -12.519 175 2HB ALA 43 2HB ALA 43 1.271 -15.201 -13.645 176 3HB ALA 43 3HB ALA 43 2.602 -15.713 -12.579 177 H GLY 44 H GLY 44 -0.377 -16.125 -10.126 178 1HA GLY 44 1HA GLY 44 0.437 -17.311 -8.091 179 2HA GLY 44 2HA GLY 44 1.438 -15.920 -7.708 180 H LEU 45 H LEU 45 -0.863 -14.123 -8.802 181 HA LEU 45 HA LEU 45 -2.847 -14.485 -6.632 182 1HB LEU 45 1HB LEU 45 -0.776 -12.546 -6.695 183 2HB LEU 45 2HB LEU 45 -2.261 -11.670 -6.984 184 HG LEU 45 HG LEU 45 -2.228 -13.738 -4.721 185 1HD1 LEU 45 1HD1 LEU 45 -0.346 -11.694 -4.715 186 2HD1 LEU 45 2HD1 LEU 45 -1.758 -10.838 -4.089 187 3HD1 LEU 45 3HD1 LEU 45 -1.146 -12.235 -3.255 188 1HD2 LEU 45 1HD2 LEU 45 -4.306 -12.865 -5.519 189 2HD2 LEU 45 2HD2 LEU 45 -3.899 -12.329 -3.869 190 3HD2 LEU 45 3HD2 LEU 45 -3.744 -11.195 -5.245 191 HA PRO 46 HA PRO 46 -4.798 -13.934 -10.693 192 1HB PRO 46 1HB PRO 46 -6.814 -15.708 -10.452 193 2HB PRO 46 2HB PRO 46 -5.114 -16.266 -10.419 194 1HG PRO 46 1HG PRO 46 -6.890 -15.734 -8.031 195 2HG PRO 46 2HG PRO 46 -5.937 -17.207 -8.384 196 1HD PRO 46 1HD PRO 46 -5.011 -15.147 -6.803 197 2HD PRO 46 2HD PRO 46 -3.928 -16.161 -7.797 198 H TRP 47 H TRP 47 -5.090 -11.800 -8.960 199 HA TRP 47 HA TRP 47 -8.012 -11.493 -8.340 200 1HB TRP 47 1HB TRP 47 -5.539 -10.558 -6.886 201 2HB TRP 47 2HB TRP 47 -7.161 -9.962 -6.554 202 HD1 TRP 47 HD1 TRP 47 -7.531 -13.552 -7.258 203 HE1 TRP 47 HE1 TRP 47 -7.795 -14.887 -5.145 204 HE3 TRP 47 HE3 TRP 47 -5.754 -10.173 -3.821 205 HZ2 TRP 47 HZ2 TRP 47 -7.401 -14.636 -2.402 206 HZ3 TRP 47 HZ3 TRP 47 -5.251 -11.121 -1.598 207 HH2 TRP 47 HH2 TRP 47 -6.291 -13.121 -0.755 208 H GLU 48 H GLU 48 -8.999 -9.513 -8.710 209 HA GLU 48 HA GLU 48 -7.779 -7.859 -10.862 210 1HB GLU 48 1HB GLU 48 -10.280 -8.367 -10.746 211 2HB GLU 48 2HB GLU 48 -10.341 -7.389 -9.276 212 1HG GLU 48 1HG GLU 48 -9.291 -5.503 -10.750 213 2HG GLU 48 2HG GLU 48 -9.774 -6.491 -12.118 214 H PHE 49 H PHE 49 -5.887 -7.434 -9.548 215 HA PHE 49 HA PHE 49 -6.185 -5.826 -7.136 216 1HB PHE 49 1HB PHE 49 -4.460 -7.556 -7.252 217 2HB PHE 49 2HB PHE 49 -3.700 -6.699 -8.592 218 HD1 PHE 49 HD1 PHE 49 -1.562 -6.103 -7.702 219 HD2 PHE 49 HD2 PHE 49 -5.069 -5.412 -5.287 220 HE1 PHE 49 HE1 PHE 49 -0.153 -5.319 -5.855 221 HE2 PHE 49 HE2 PHE 49 -3.638 -4.623 -3.457 222 HZ PHE 49 HZ PHE 49 -1.190 -4.554 -3.725 223 H VAL 50 H VAL 50 -6.654 -3.689 -7.399 224 HA VAL 50 HA VAL 50 -5.376 -2.228 -9.660 225 HB VAL 50 HB VAL 50 -7.248 -2.320 -10.756 226 1HG1 VAL 50 1HG1 VAL 50 -9.482 -2.903 -9.886 227 2HG1 VAL 50 2HG1 VAL 50 -8.240 -4.094 -9.502 228 3HG1 VAL 50 3HG1 VAL 50 -8.799 -2.974 -8.251 229 1HG2 VAL 50 1HG2 VAL 50 -7.341 0.032 -10.025 230 2HG2 VAL 50 2HG2 VAL 50 -8.941 -0.649 -10.340 231 3HG2 VAL 50 3HG2 VAL 50 -8.407 -0.439 -8.666 232 HA PRO 51 HA PRO 51 -4.888 0.709 -6.223 233 1HB PRO 51 1HB PRO 51 -2.981 2.284 -7.292 234 2HB PRO 51 2HB PRO 51 -2.587 0.612 -6.807 235 1HG PRO 51 1HG PRO 51 -3.306 1.624 -9.582 236 2HG PRO 51 2HG PRO 51 -1.902 0.620 -9.135 237 1HD PRO 51 1HD PRO 51 -4.276 -0.387 -10.106 238 2HD PRO 51 2HD PRO 51 -3.253 -1.317 -8.967 239 H VAL 52 H VAL 52 -5.326 3.062 -6.165 240 HA VAL 52 HA VAL 52 -7.400 3.830 -8.019 241 HB VAL 52 HB VAL 52 -7.227 6.056 -6.708 242 1HG1 VAL 52 1HG1 VAL 52 -9.126 4.547 -6.608 243 2HG1 VAL 52 2HG1 VAL 52 -8.230 3.414 -5.581 244 3HG1 VAL 52 3HG1 VAL 52 -8.674 5.023 -4.963 245 1HG2 VAL 52 1HG2 VAL 52 -6.037 4.108 -4.727 246 2HG2 VAL 52 2HG2 VAL 52 -5.008 5.199 -5.662 247 3HG2 VAL 52 3HG2 VAL 52 -6.252 5.864 -4.568 248 H GLN 53 H GLN 53 -3.992 4.789 -7.524 249 HA GLN 53 HA GLN 53 -3.792 5.579 -10.251 250 1HB GLN 53 1HB GLN 53 -3.076 7.851 -9.991 251 2HB GLN 53 2HB GLN 53 -4.691 7.722 -9.329 252 1HG GLN 53 1HG GLN 53 -2.596 7.356 -7.241 253 2HG GLN 53 2HG GLN 53 -2.420 8.851 -8.159 254 1HE2 GLN 53 1HE2 GLN 53 -5.062 6.940 -6.660 255 2HE2 GLN 53 2HE2 GLN 53 -5.882 8.341 -5.984 256 H ARG 54 H ARG 54 -1.378 6.404 -10.535 257 HA ARG 54 HA ARG 54 0.508 4.559 -9.316 258 1HB ARG 54 1HB ARG 54 0.666 6.985 -11.085 259 2HB ARG 54 2HB ARG 54 2.099 6.471 -10.207 260 1HG ARG 54 1HG ARG 54 0.468 4.664 -12.049 261 2HG ARG 54 2HG ARG 54 2.005 5.480 -12.409 262 1HD ARG 54 1HD ARG 54 2.937 3.621 -11.800 263 2HD ARG 54 2HD ARG 54 2.721 4.274 -10.193 264 HE ARG 54 HE ARG 54 0.409 2.775 -10.797 265 1HH1 ARG 54 1HH1 ARG 54 3.861 2.188 -10.286 266 2HH1 ARG 54 2HH1 ARG 54 3.684 0.484 -9.963 267 1HH2 ARG 54 1HH2 ARG 54 0.156 0.503 -10.350 268 2HH2 ARG 54 2HH2 ARG 54 1.513 -0.471 -9.901 269 H ASP 55 H ASP 55 0.055 8.152 -8.983 270 HA ASP 55 HA ASP 55 1.520 8.007 -6.471 271 1HB ASP 55 1HB ASP 55 2.786 9.844 -7.378 272 2HB ASP 55 2HB ASP 55 2.865 8.431 -8.461 273 H ILE 56 H ILE 56 0.977 9.270 -4.872 274 HA ILE 56 HA ILE 56 -1.201 11.284 -5.243 275 HB ILE 56 HB ILE 56 -1.668 11.228 -2.942 276 1HG1 ILE 56 1HG1 ILE 56 0.452 9.087 -2.820 277 2HG1 ILE 56 2HG1 ILE 56 0.627 10.736 -2.161 278 1HG2 ILE 56 1HG2 ILE 56 -2.788 9.616 -4.455 279 2HG2 ILE 56 2HG2 ILE 56 -1.530 8.416 -4.075 280 3HG2 ILE 56 3HG2 ILE 56 -2.622 9.012 -2.797 281 1HD1 ILE 56 1HD1 ILE 56 -1.256 10.315 -0.612 282 2HD1 ILE 56 2HD1 ILE 56 -1.266 8.614 -1.118 283 3HD1 ILE 56 3HD1 ILE 56 0.171 9.300 -0.340 284 H ASP 57 H ASP 57 -0.789 13.260 -3.711 285 HA ASP 57 HA ASP 57 1.945 13.365 -2.732 286 1HB ASP 57 1HB ASP 57 2.148 15.746 -3.083 287 2HB ASP 57 2HB ASP 57 1.869 14.985 -4.656 288 H VAL 58 H VAL 58 2.105 14.344 -0.735 289 HA VAL 58 HA VAL 58 -0.460 14.784 0.769 290 HB VAL 58 HB VAL 58 0.444 13.615 2.666 291 1HG1 VAL 58 1HG1 VAL 58 -1.201 12.606 1.107 292 2HG1 VAL 58 2HG1 VAL 58 0.144 11.905 0.178 293 3HG1 VAL 58 3HG1 VAL 58 -0.152 11.388 1.849 294 1HG2 VAL 58 1HG2 VAL 58 2.588 12.645 0.719 295 2HG2 VAL 58 2HG2 VAL 58 2.806 13.488 2.281 296 3HG2 VAL 58 3HG2 VAL 58 2.166 11.842 2.226 297 H ARG 59 H ARG 59 -0.411 16.673 1.740 298 HA ARG 59 HA ARG 59 2.002 18.299 2.141 299 1HB ARG 59 1HB ARG 59 0.335 19.633 1.682 300 2HB ARG 59 2HB ARG 59 -0.908 18.615 2.349 301 1HG ARG 59 1HG ARG 59 -0.782 20.707 3.459 302 2HG ARG 59 2HG ARG 59 -0.510 19.354 4.559 303 1HD ARG 59 1HD ARG 59 1.873 19.815 4.636 304 2HD ARG 59 2HD ARG 59 1.775 20.971 3.342 305 HE ARG 59 HE ARG 59 1.012 21.199 6.201 306 1HH1 ARG 59 1HH1 ARG 59 0.816 22.927 3.133 307 2HH1 ARG 59 2HH1 ARG 59 1.121 24.480 3.886 308 1HH2 ARG 59 1HH2 ARG 59 1.083 23.069 7.171 309 2HH2 ARG 59 2HH2 ARG 59 1.337 24.573 6.288 310 H ILE 60 H ILE 60 3.132 16.550 2.976 311 HA ILE 60 HA ILE 60 3.678 14.870 4.501 312 HB ILE 60 HB ILE 60 5.221 15.996 6.115 313 1HG1 ILE 60 1HG1 ILE 60 4.451 18.559 4.666 314 2HG1 ILE 60 2HG1 ILE 60 3.720 18.086 6.207 315 1HG2 ILE 60 1HG2 ILE 60 5.976 15.266 3.981 316 2HG2 ILE 60 2HG2 ILE 60 5.391 16.754 3.180 317 3HG2 ILE 60 3HG2 ILE 60 6.745 16.792 4.322 318 1HD1 ILE 60 1HD1 ILE 60 6.727 18.378 5.739 319 2HD1 ILE 60 2HD1 ILE 60 5.679 19.579 6.512 320 3HD1 ILE 60 3HD1 ILE 60 5.930 18.000 7.277 321 H GLY 61 H GLY 61 1.113 14.737 5.086 322 1HA GLY 61 1HA GLY 61 0.778 13.883 7.666 323 2HA GLY 61 2HA GLY 61 0.658 15.624 7.812 324 H GLU 62 H GLU 62 -0.521 16.246 5.378 325 HA GLU 62 HA GLU 62 -3.227 16.115 5.468 326 1HB GLU 62 1HB GLU 62 -1.756 17.182 3.780 327 2HB GLU 62 2HB GLU 62 -1.514 15.584 3.036 328 1HG GLU 62 1HG GLU 62 -3.929 15.491 2.485 329 2HG GLU 62 2HG GLU 62 -4.172 17.063 3.280 330 H THR 63 H THR 63 -4.515 14.416 5.986 331 HA THR 63 HA THR 63 -3.661 11.716 5.710 332 HB THR 63 HB THR 63 -6.358 11.925 6.686 333 HG1 THR 63 HG1 THR 63 -4.785 13.875 7.923 334 1HG2 THR 63 1HG2 THR 63 -3.729 11.899 8.198 335 2HG2 THR 63 2HG2 THR 63 -5.347 11.483 8.822 336 3HG2 THR 63 3HG2 THR 63 -4.599 10.480 7.586 337 H VAL 64 H VAL 64 -3.627 10.965 3.586 338 HA VAL 64 HA VAL 64 -5.633 11.835 1.733 339 HB VAL 64 HB VAL 64 -3.175 11.135 1.372 340 1HG1 VAL 64 1HG1 VAL 64 -2.706 8.887 0.701 341 2HG1 VAL 64 2HG1 VAL 64 -3.545 8.773 2.249 342 3HG1 VAL 64 3HG1 VAL 64 -4.409 8.416 0.749 343 1HG2 VAL 64 1HG2 VAL 64 -3.457 10.814 -0.949 344 2HG2 VAL 64 2HG2 VAL 64 -5.091 10.194 -0.781 345 3HG2 VAL 64 3HG2 VAL 64 -4.742 11.904 -0.424 346 H GLN 65 H GLN 65 -6.677 10.064 0.251 347 HA GLN 65 HA GLN 65 -7.621 7.658 1.691 348 1HB GLN 65 1HB GLN 65 -9.261 9.792 1.885 349 2HB GLN 65 2HB GLN 65 -9.654 9.351 0.231 350 1HG GLN 65 1HG GLN 65 -11.222 8.192 1.519 351 2HG GLN 65 2HG GLN 65 -10.028 6.946 1.156 352 1HE2 GLN 65 1HE2 GLN 65 -8.224 8.527 3.441 353 2HE2 GLN 65 2HE2 GLN 65 -8.961 7.833 4.860 354 H ILE 66 H ILE 66 -6.326 6.441 0.495 355 HA ILE 66 HA ILE 66 -6.994 6.347 -2.415 356 HB ILE 66 HB ILE 66 -4.886 5.100 -2.735 357 1HG1 ILE 66 1HG1 ILE 66 -3.082 6.102 -0.945 358 2HG1 ILE 66 2HG1 ILE 66 -4.400 5.741 0.147 359 1HG2 ILE 66 1HG2 ILE 66 -3.613 7.037 -3.087 360 2HG2 ILE 66 2HG2 ILE 66 -5.289 7.530 -3.312 361 3HG2 ILE 66 3HG2 ILE 66 -4.461 7.939 -1.798 362 1HD1 ILE 66 1HD1 ILE 66 -2.983 3.867 -1.812 363 2HD1 ILE 66 2HD1 ILE 66 -2.903 3.817 -0.040 364 3HD1 ILE 66 3HD1 ILE 66 -4.405 3.374 -0.877 365 H MET 67 H MET 67 -8.381 4.852 -2.814 366 HA MET 67 HA MET 67 -8.837 2.603 -1.012 367 1HB MET 67 1HB MET 67 -9.978 3.265 -3.749 368 2HB MET 67 2HB MET 67 -10.476 1.895 -2.745 369 1HG MET 67 1HG MET 67 -11.286 3.358 -1.000 370 2HG MET 67 2HG MET 67 -10.600 4.783 -1.786 371 1HE MET 67 1HE MET 67 -12.705 1.853 -3.530 372 2HE MET 67 2HE MET 67 -13.390 2.037 -1.895 373 3HE MET 67 3HE MET 67 -14.325 2.541 -3.318 374 H TYR 68 H TYR 68 -8.329 0.506 -1.243 375 HA TYR 68 HA TYR 68 -6.586 -0.281 -3.549 376 1HB TYR 68 1HB TYR 68 -6.266 -0.764 -0.616 377 2HB TYR 68 2HB TYR 68 -6.142 -2.191 -1.626 378 HD1 TYR 68 HD1 TYR 68 -4.503 -2.334 -3.492 379 HD2 TYR 68 HD2 TYR 68 -4.442 0.899 -0.649 380 HE1 TYR 68 HE1 TYR 68 -2.131 -1.914 -4.034 381 HE2 TYR 68 HE2 TYR 68 -2.067 1.357 -1.230 382 HH TYR 68 HH TYR 68 -0.265 -0.629 -3.596 383 H ARG 69 H ARG 69 -7.193 -2.166 -4.568 384 HA ARG 69 HA ARG 69 -9.641 -3.531 -3.652 385 1HB ARG 69 1HB ARG 69 -10.418 -1.818 -5.067 386 2HB ARG 69 2HB ARG 69 -9.213 -2.137 -6.306 387 1HG ARG 69 1HG ARG 69 -10.256 -4.201 -6.992 388 2HG ARG 69 2HG ARG 69 -11.125 -4.352 -5.472 389 1HD ARG 69 1HD ARG 69 -12.911 -3.403 -6.299 390 2HD ARG 69 2HD ARG 69 -12.005 -1.897 -6.506 391 HE ARG 69 HE ARG 69 -11.627 -3.762 -8.743 392 1HH1 ARG 69 1HH1 ARG 69 -13.937 -1.500 -7.255 393 2HH1 ARG 69 2HH1 ARG 69 -14.593 -0.964 -8.771 394 1HH2 ARG 69 1HH2 ARG 69 -12.458 -3.233 -10.599 395 2HH2 ARG 69 2HH2 ARG 69 -13.656 -1.946 -10.855 396 H ALA 70 H ALA 70 -9.630 -5.637 -4.003 397 HA ALA 70 HA ALA 70 -7.959 -6.949 -6.014 398 1HB ALA 70 1HB ALA 70 -6.985 -8.473 -4.533 399 2HB ALA 70 2HB ALA 70 -6.399 -6.836 -4.158 400 3HB ALA 70 3HB ALA 70 -7.600 -7.612 -3.096 401 H LYS 71 H LYS 71 -9.879 -7.637 -6.915 402 HA LYS 71 HA LYS 71 -11.911 -9.148 -5.297 403 1HB LYS 71 1HB LYS 71 -11.696 -9.013 -8.326 404 2HB LYS 71 2HB LYS 71 -13.068 -9.544 -7.353 405 1HG LYS 71 1HG LYS 71 -13.393 -7.211 -6.561 406 2HG LYS 71 2HG LYS 71 -12.033 -6.678 -7.561 407 1HD LYS 71 1HD LYS 71 -13.109 -7.656 -9.567 408 2HD LYS 71 2HD LYS 71 -14.521 -8.136 -8.609 409 1HE LYS 71 1HE LYS 71 -15.279 -5.927 -8.358 410 2HE LYS 71 2HE LYS 71 -13.661 -5.246 -8.583 411 1HZ LYS 71 1HZ LYS 71 -13.769 -5.870 -10.879 412 2HZ LYS 71 2HZ LYS 71 -15.289 -6.465 -10.705 413 3HZ LYS 71 3HZ LYS 71 -15.004 -4.849 -10.492 414 H ASN 72 H ASN 72 -12.079 -11.532 -5.535 415 HA ASN 72 HA ASN 72 -9.623 -12.729 -6.713 416 1HB ASN 72 1HB ASN 72 -10.043 -13.524 -4.542 417 2HB ASN 72 2HB ASN 72 -11.717 -13.973 -4.960 418 1HD2 ASN 72 1HD2 ASN 72 -10.754 -16.204 -4.059 419 2HD2 ASN 72 2HD2 ASN 72 -10.066 -17.229 -5.312 420 H LEU 73 H LEU 73 -9.609 -13.140 -8.812 421 HA LEU 73 HA LEU 73 -12.131 -13.499 -10.243 422 1HB LEU 73 1HB LEU 73 -9.826 -12.146 -10.863 423 2HB LEU 73 2HB LEU 73 -9.462 -13.697 -11.585 424 HG LEU 73 HG LEU 73 -11.725 -13.529 -12.805 425 1HD1 LEU 73 1HD1 LEU 73 -12.607 -11.228 -13.103 426 2HD1 LEU 73 2HD1 LEU 73 -12.762 -11.732 -11.418 427 3HD1 LEU 73 3HD1 LEU 73 -11.462 -10.621 -11.890 428 1HD2 LEU 73 1HD2 LEU 73 -9.557 -13.153 -13.907 429 2HD2 LEU 73 2HD2 LEU 73 -10.780 -12.034 -14.532 430 3HD2 LEU 73 3HD2 LEU 73 -9.560 -11.458 -13.373 431 H ALA 74 H ALA 74 -10.105 -15.655 -8.620 432 HA ALA 74 HA ALA 74 -9.866 -17.636 -10.711 433 1HB ALA 74 1HB ALA 74 -9.443 -17.778 -7.697 434 2HB ALA 74 2HB ALA 74 -9.015 -19.067 -8.826 435 3HB ALA 74 3HB ALA 74 -8.208 -17.501 -8.942 436 H SER 75 H SER 75 -10.646 -19.941 -10.062 437 HA SER 75 HA SER 75 -13.575 -19.772 -9.348 438 1HB SER 75 1HB SER 75 -12.305 -21.746 -11.230 439 2HB SER 75 2HB SER 75 -13.974 -21.740 -10.660 440 HG SER 75 HG SER 75 -12.753 -19.905 -12.433 441 H THR 76 H THR 76 -10.933 -20.140 -7.769 442 HA THR 76 HA THR 76 -12.063 -21.994 -5.854 443 HB THR 76 HB THR 76 -9.532 -22.839 -5.591 444 HG1 THR 76 HG1 THR 76 -8.639 -22.978 -7.803 445 1HG2 THR 76 1HG2 THR 76 -11.454 -24.307 -6.291 446 2HG2 THR 76 2HG2 THR 76 -11.126 -23.863 -7.980 447 3HG2 THR 76 3HG2 THR 76 -9.908 -24.743 -7.044 448 HA PRO 77 HA PRO 77 -10.762 -18.671 -3.335 449 1HB PRO 77 1HB PRO 77 -9.767 -19.814 -1.017 450 2HB PRO 77 2HB PRO 77 -11.501 -19.814 -1.426 451 1HG PRO 77 1HG PRO 77 -9.504 -22.023 -1.946 452 2HG PRO 77 2HG PRO 77 -11.114 -22.157 -1.175 453 1HD PRO 77 1HD PRO 77 -10.804 -22.739 -3.778 454 2HD PRO 77 2HD PRO 77 -12.222 -21.793 -3.264 455 H THR 78 H THR 78 -8.871 -17.435 -2.744 456 HA THR 78 HA THR 78 -6.282 -18.877 -2.959 457 HB THR 78 HB THR 78 -5.767 -16.142 -3.672 458 HG1 THR 78 HG1 THR 78 -6.595 -16.228 -5.743 459 1HG2 THR 78 1HG2 THR 78 -4.665 -17.155 -5.554 460 2HG2 THR 78 2HG2 THR 78 -4.424 -18.219 -4.162 461 3HG2 THR 78 3HG2 THR 78 -5.679 -18.612 -5.382 462 H THR 79 H THR 79 -4.542 -17.683 -2.026 463 HA THR 79 HA THR 79 -5.253 -15.965 0.262 464 HB THR 79 HB THR 79 -4.013 -17.953 0.979 465 HG1 THR 79 HG1 THR 79 -3.714 -15.797 1.890 466 1HG2 THR 79 1HG2 THR 79 -2.719 -18.441 -1.075 467 2HG2 THR 79 2HG2 THR 79 -1.764 -16.962 -0.822 468 3HG2 THR 79 3HG2 THR 79 -1.688 -18.290 0.355 469 H GLY 80 H GLY 80 -3.531 -14.280 0.494 470 1HA GLY 80 1HA GLY 80 -2.185 -13.451 -1.931 471 2HA GLY 80 2HA GLY 80 -3.389 -12.299 -1.342 472 H GLN 81 H GLN 81 -0.698 -14.309 -0.311 473 HA GLN 81 HA GLN 81 -0.234 -12.714 2.177 474 1HB GLN 81 1HB GLN 81 1.254 -14.608 2.803 475 2HB GLN 81 2HB GLN 81 -0.450 -15.018 2.691 476 1HG GLN 81 1HG GLN 81 -0.124 -16.595 1.152 477 2HG GLN 81 2HG GLN 81 0.829 -15.534 0.111 478 1HE2 GLN 81 1HE2 GLN 81 3.030 -14.940 1.268 479 2HE2 GLN 81 2HE2 GLN 81 4.005 -16.351 1.680 480 H ALA 82 H ALA 82 0.180 -11.218 0.246 481 HA ALA 82 HA ALA 82 2.431 -11.776 -1.459 482 1HB ALA 82 1HB ALA 82 0.747 -9.297 -1.003 483 2HB ALA 82 2HB ALA 82 1.893 -9.529 -2.332 484 3HB ALA 82 3HB ALA 82 0.443 -10.596 -2.194 485 H THR 83 H THR 83 4.420 -10.684 -1.617 486 HA THR 83 HA THR 83 5.381 -9.564 0.874 487 HB THR 83 HB THR 83 6.898 -9.647 -1.686 488 HG1 THR 83 HG1 THR 83 7.504 -11.836 -0.942 489 1HG2 THR 83 1HG2 THR 83 7.732 -10.052 1.222 490 2HG2 THR 83 2HG2 THR 83 8.824 -10.171 -0.171 491 3HG2 THR 83 3HG2 THR 83 8.078 -8.622 0.222 492 H PHE 84 H PHE 84 6.473 -7.354 0.908 493 HA PHE 84 HA PHE 84 5.747 -5.639 -1.336 494 1HB PHE 84 1HB PHE 84 4.923 -3.866 0.216 495 2HB PHE 84 2HB PHE 84 3.845 -5.240 0.007 496 HD1 PHE 84 HD1 PHE 84 3.204 -6.647 1.872 497 HD2 PHE 84 HD2 PHE 84 6.345 -3.731 2.326 498 HE1 PHE 84 HE1 PHE 84 3.232 -7.049 4.308 499 HE2 PHE 84 HE2 PHE 84 6.446 -4.200 4.731 500 HZ PHE 84 HZ PHE 84 4.852 -5.835 5.760 501 H ASN 85 H ASN 85 7.245 -4.152 -1.769 502 HA ASN 85 HA ASN 85 9.590 -3.844 0.085 503 1HB ASN 85 1HB ASN 85 10.718 -4.173 -1.807 504 2HB ASN 85 2HB ASN 85 9.278 -4.009 -2.790 505 1HD2 ASN 85 1HD2 ASN 85 11.690 -1.959 -0.979 506 2HD2 ASN 85 2HD2 ASN 85 11.466 -0.574 -2.052 507 H VAL 86 H VAL 86 8.575 -2.545 1.615 508 HA VAL 86 HA VAL 86 7.033 -0.187 0.803 509 HB VAL 86 HB VAL 86 6.323 -1.490 2.614 510 1HG1 VAL 86 1HG1 VAL 86 8.786 -0.729 4.222 511 2HG1 VAL 86 2HG1 VAL 86 7.359 -1.589 4.810 512 3HG1 VAL 86 3HG1 VAL 86 8.405 -2.347 3.607 513 1HG2 VAL 86 1HG2 VAL 86 5.663 0.166 4.121 514 2HG2 VAL 86 2HG2 VAL 86 7.069 1.179 3.779 515 3HG2 VAL 86 3HG2 VAL 86 5.825 0.936 2.534 516 H THR 87 H THR 87 9.235 0.356 -0.479 517 HA THR 87 HA THR 87 10.177 2.699 0.818 518 HB THR 87 HB THR 87 11.457 1.224 2.212 519 HG1 THR 87 HG1 THR 87 13.600 1.958 1.620 520 1HG2 THR 87 1HG2 THR 87 12.781 0.169 -0.283 521 2HG2 THR 87 2HG2 THR 87 13.197 -0.242 1.393 522 3HG2 THR 87 3HG2 THR 87 11.611 -0.702 0.749 523 HA PRO 88 HA PRO 88 11.449 3.465 -3.448 524 1HB PRO 88 1HB PRO 88 13.249 5.561 -2.935 525 2HB PRO 88 2HB PRO 88 11.506 5.751 -3.148 526 1HG PRO 88 1HG PRO 88 13.033 5.791 -0.601 527 2HG PRO 88 2HG PRO 88 11.544 6.648 -1.038 528 1HD PRO 88 1HD PRO 88 11.632 4.373 0.527 529 2HD PRO 88 2HD PRO 88 10.214 4.876 -0.410 530 H MET 89 H MET 89 13.525 3.204 -0.585 531 HA MET 89 HA MET 89 15.188 1.192 -1.376 532 1HB MET 89 1HB MET 89 17.390 2.422 -1.679 533 2HB MET 89 2HB MET 89 16.306 2.382 -3.057 534 1HG MET 89 1HG MET 89 15.539 4.740 -2.394 535 2HG MET 89 2HG MET 89 16.928 4.783 -1.309 536 1HE MET 89 1HE MET 89 19.237 3.302 -2.876 537 2HE MET 89 2HE MET 89 19.967 4.710 -3.678 538 3HE MET 89 3HE MET 89 19.402 4.845 -1.996 539 H ALA 90 H ALA 90 15.793 4.381 0.107 540 HA ALA 90 HA ALA 90 17.203 3.111 2.310 541 1HB ALA 90 1HB ALA 90 17.924 5.389 2.768 542 2HB ALA 90 2HB ALA 90 17.985 5.130 1.006 543 3HB ALA 90 3HB ALA 90 16.633 6.026 1.733 544 H ALA 91 H ALA 91 14.069 4.646 1.847 545 HA ALA 91 HA ALA 91 13.887 5.523 4.624 546 1HB ALA 91 1HB ALA 91 11.767 6.507 3.955 547 2HB ALA 91 2HB ALA 91 13.097 6.943 2.852 548 3HB ALA 91 3HB ALA 91 11.898 5.753 2.343 549 H GLY 92 H GLY 92 10.850 4.459 3.496 550 1HA GLY 92 1HA GLY 92 9.413 2.806 4.145 551 2HA GLY 92 2HA GLY 92 10.807 1.760 4.350 552 H ALA 93 H ALA 93 12.077 3.113 6.577 553 HA ALA 93 HA ALA 93 10.590 2.468 8.893 554 1HB ALA 93 1HB ALA 93 12.714 4.628 8.470 555 2HB ALA 93 2HB ALA 93 12.122 4.062 10.046 556 3HB ALA 93 3HB ALA 93 12.983 2.948 8.966 557 H TYR 94 H TYR 94 11.130 5.762 7.570 558 HA TYR 94 HA TYR 94 8.916 6.988 8.852 559 1HB TYR 94 1HB TYR 94 10.470 8.062 6.494 560 2HB TYR 94 2HB TYR 94 9.810 8.947 7.867 561 HD1 TYR 94 HD1 TYR 94 10.849 7.711 10.228 562 HD2 TYR 94 HD2 TYR 94 12.812 7.994 6.409 563 HE1 TYR 94 HE1 TYR 94 13.027 7.306 11.321 564 HE2 TYR 94 HE2 TYR 94 14.992 7.523 7.506 565 HH TYR 94 HH TYR 94 16.084 6.914 9.507 566 H PHE 95 H PHE 95 8.119 4.708 7.157 567 HA PHE 95 HA PHE 95 6.247 6.076 5.295 568 1HB PHE 95 1HB PHE 95 7.691 4.312 4.180 569 2HB PHE 95 2HB PHE 95 7.055 3.130 5.310 570 HD1 PHE 95 HD1 PHE 95 6.690 4.339 2.034 571 HD2 PHE 95 HD2 PHE 95 4.456 2.729 5.345 572 HE1 PHE 95 HE1 PHE 95 4.743 4.008 0.561 573 HE2 PHE 95 HE2 PHE 95 2.547 2.325 3.854 574 HZ PHE 95 HZ PHE 95 2.652 3.014 1.466 575 H ASN 96 H ASN 96 4.868 6.659 6.986 576 HA ASN 96 HA ASN 96 4.138 5.209 8.999 577 1HB ASN 96 1HB ASN 96 1.797 6.287 8.969 578 2HB ASN 96 2HB ASN 96 3.144 7.402 8.870 579 1HD2 ASN 96 1HD2 ASN 96 3.757 8.222 6.713 580 2HD2 ASN 96 2HD2 ASN 96 2.615 8.162 5.357 581 H LYS 97 H LYS 97 2.546 3.557 9.599 582 HA LYS 97 HA LYS 97 1.269 2.079 7.336 583 1HB LYS 97 1HB LYS 97 2.497 0.853 9.837 584 2HB LYS 97 2HB LYS 97 1.630 0.029 8.533 585 1HG LYS 97 1HG LYS 97 3.717 -0.455 7.810 586 2HG LYS 97 2HG LYS 97 3.564 1.134 7.039 587 1HD LYS 97 1HD LYS 97 4.689 2.132 9.057 588 2HD LYS 97 2HD LYS 97 4.890 0.517 9.742 589 1HE LYS 97 1HE LYS 97 6.512 -0.128 8.145 590 2HE LYS 97 2HE LYS 97 5.938 1.045 6.951 591 1HZ LYS 97 1HZ LYS 97 6.771 2.801 8.264 592 2HZ LYS 97 2HZ LYS 97 7.467 1.784 9.362 593 3HZ LYS 97 3HZ LYS 97 7.975 1.837 7.784 594 H VAL 98 H VAL 98 -0.883 1.736 7.670 595 HA VAL 98 HA VAL 98 -2.164 2.909 9.977 596 HB VAL 98 HB VAL 98 -4.243 2.173 8.945 597 1HG1 VAL 98 1HG1 VAL 98 -3.117 4.261 8.216 598 2HG1 VAL 98 2HG1 VAL 98 -2.330 3.369 6.896 599 3HG1 VAL 98 3HG1 VAL 98 -4.098 3.517 6.939 600 1HG2 VAL 98 1HG2 VAL 98 -4.263 1.107 6.708 601 2HG2 VAL 98 2HG2 VAL 98 -2.527 0.790 6.825 602 3HG2 VAL 98 3HG2 VAL 98 -3.664 0.009 7.947 603 H GLN 99 H GLN 99 -1.453 -0.400 8.963 604 HA GLN 99 HA GLN 99 -2.717 -1.465 11.462 605 1HB GLN 99 1HB GLN 99 -3.969 -1.955 9.405 606 2HB GLN 99 2HB GLN 99 -2.531 -2.650 8.660 607 1HG GLN 99 1HG GLN 99 -4.059 -4.387 9.466 608 2HG GLN 99 2HG GLN 99 -2.493 -4.467 10.273 609 1HE2 GLN 99 1HE2 GLN 99 -5.348 -2.322 10.969 610 2HE2 GLN 99 2HE2 GLN 99 -5.542 -2.925 12.602 611 H CYS 100 H CYS 100 -0.284 -2.402 8.982 612 HA CYS 100 HA CYS 100 1.681 -3.518 9.130 613 1HB CYS 100 1HB CYS 100 2.286 -1.373 10.250 614 2HB CYS 100 2HB CYS 100 2.016 -2.131 11.828 615 HG CYS 100 HG CYS 100 3.733 -4.033 11.536 616 H PHE 101 H PHE 101 -0.299 -5.206 9.629 617 HA PHE 101 HA PHE 101 0.984 -7.209 11.285 618 1HB PHE 101 1HB PHE 101 -0.236 -5.986 13.040 619 2HB PHE 101 2HB PHE 101 -1.737 -6.121 12.156 620 HD1 PHE 101 HD1 PHE 101 0.870 -8.009 14.015 621 HD2 PHE 101 HD2 PHE 101 -3.058 -8.180 12.230 622 HE1 PHE 101 HE1 PHE 101 0.436 -10.168 15.156 623 HE2 PHE 101 HE2 PHE 101 -3.466 -10.347 13.339 624 HZ PHE 101 HZ PHE 101 -1.730 -11.344 14.819 625 H CYS 102 H CYS 102 -2.356 -6.554 10.190 626 HA CYS 102 HA CYS 102 -2.130 -8.719 8.131 627 1HB CYS 102 1HB CYS 102 -4.543 -7.444 9.498 628 2HB CYS 102 2HB CYS 102 -4.655 -8.424 8.022 629 HG CYS 102 HG CYS 102 -5.372 -9.912 9.953 630 H PHE 103 H PHE 103 -3.487 -8.065 6.164 631 HA PHE 103 HA PHE 103 -3.675 -5.240 5.559 632 1HB PHE 103 1HB PHE 103 -2.672 -5.656 3.245 633 2HB PHE 103 2HB PHE 103 -1.583 -5.446 4.589 634 HD1 PHE 103 HD1 PHE 103 -0.295 -7.330 5.554 635 HD2 PHE 103 HD2 PHE 103 -2.596 -7.682 1.929 636 HE1 PHE 103 HE1 PHE 103 1.239 -9.099 4.744 637 HE2 PHE 103 HE2 PHE 103 -0.991 -9.322 1.066 638 HZ PHE 103 HZ PHE 103 0.928 -10.069 2.484 639 H THR 104 H THR 104 -4.811 -5.565 2.944 640 HA THR 104 HA THR 104 -7.326 -6.485 4.240 641 HB THR 104 HB THR 104 -7.296 -4.170 3.729 642 HG1 THR 104 HG1 THR 104 -8.918 -5.798 2.097 643 1HG2 THR 104 1HG2 THR 104 -5.682 -3.979 1.894 644 2HG2 THR 104 2HG2 THR 104 -6.794 -4.846 0.811 645 3HG2 THR 104 3HG2 THR 104 -7.234 -3.261 1.458 646 H GLU 105 H GLU 105 -5.182 -7.283 1.675 647 HA GLU 105 HA GLU 105 -7.171 -8.531 0.020 648 1HB GLU 105 1HB GLU 105 -4.159 -8.816 -0.259 649 2HB GLU 105 2HB GLU 105 -5.432 -8.865 -1.493 650 1HG GLU 105 1HG GLU 105 -4.812 -6.667 -1.819 651 2HG GLU 105 2HG GLU 105 -5.954 -6.398 -0.549 652 H THR 106 H THR 106 -4.383 -9.980 1.716 653 HA THR 106 HA THR 106 -4.033 -11.944 2.705 654 HB THR 106 HB THR 106 -5.037 -10.509 4.321 655 HG1 THR 106 HG1 THR 106 -4.331 -12.518 4.991 656 1HG2 THR 106 1HG2 THR 106 -7.365 -10.258 3.460 657 2HG2 THR 106 2HG2 THR 106 -7.701 -11.939 3.942 658 3HG2 THR 106 3HG2 THR 106 -7.273 -10.734 5.155 659 H THR 107 H THR 107 -7.465 -12.456 1.942 660 HA THR 107 HA THR 107 -6.989 -14.805 0.511 661 HB THR 107 HB THR 107 -6.801 -15.353 3.226 662 HG1 THR 107 HG1 THR 107 -7.331 -16.936 0.959 663 1HG2 THR 107 1HG2 THR 107 -9.254 -15.091 3.523 664 2HG2 THR 107 2HG2 THR 107 -9.518 -16.355 2.293 665 3HG2 THR 107 3HG2 THR 107 -8.695 -16.751 3.812 666 H LEU 108 H LEU 108 -8.827 -15.503 -0.641 667 HA LEU 108 HA LEU 108 -11.447 -14.281 -0.035 668 1HB LEU 108 1HB LEU 108 -9.690 -13.545 -2.367 669 2HB LEU 108 2HB LEU 108 -11.434 -13.592 -2.603 670 HG LEU 108 HG LEU 108 -10.515 -11.986 -0.277 671 1HD1 LEU 108 1HD1 LEU 108 -10.207 -11.014 -3.135 672 2HD1 LEU 108 2HD1 LEU 108 -9.891 -10.091 -1.641 673 3HD1 LEU 108 3HD1 LEU 108 -8.860 -11.441 -2.058 674 1HD2 LEU 108 1HD2 LEU 108 -12.384 -10.595 -0.925 675 2HD2 LEU 108 2HD2 LEU 108 -12.566 -11.466 -2.456 676 3HD2 LEU 108 3HD2 LEU 108 -12.910 -12.285 -0.915 677 H GLU 109 H GLU 109 -13.064 -15.524 -0.750 678 HA GLU 109 HA GLU 109 -12.661 -18.033 -2.070 679 1HB GLU 109 1HB GLU 109 -15.199 -16.499 -1.354 680 2HB GLU 109 2HB GLU 109 -15.086 -18.208 -1.754 681 1HG GLU 109 1HG GLU 109 -15.198 -18.273 0.536 682 2HG GLU 109 2HG GLU 109 -13.464 -18.435 0.244 683 HA PRO 110 HA PRO 110 -12.826 -16.944 -6.158 684 1HB PRO 110 1HB PRO 110 -14.314 -18.806 -7.497 685 2HB PRO 110 2HB PRO 110 -12.751 -19.094 -6.683 686 1HG PRO 110 1HG PRO 110 -15.539 -19.636 -5.646 687 2HG PRO 110 2HG PRO 110 -14.148 -20.754 -5.616 688 1HD PRO 110 1HD PRO 110 -14.875 -19.267 -3.501 689 2HD PRO 110 2HD PRO 110 -13.145 -19.555 -3.821 690 H GLY 111 H GLY 111 -13.701 -14.974 -6.651 691 1HA GLY 111 1HA GLY 111 -15.183 -14.080 -8.358 692 2HA GLY 111 2HA GLY 111 -16.545 -14.891 -7.567 693 H GLU 112 H GLU 112 -14.712 -14.128 -4.948 694 HA GLU 112 HA GLU 112 -16.723 -12.164 -4.441 695 1HB GLU 112 1HB GLU 112 -14.653 -13.358 -2.577 696 2HB GLU 112 2HB GLU 112 -16.125 -12.493 -2.160 697 1HG GLU 112 1HG GLU 112 -15.853 -15.230 -3.252 698 2HG GLU 112 2HG GLU 112 -16.756 -14.682 -1.843 699 H GLU 113 H GLU 113 -16.412 -10.179 -3.363 700 HA GLU 113 HA GLU 113 -14.441 -8.665 -4.944 701 1HB GLU 113 1HB GLU 113 -17.144 -8.655 -5.026 702 2HB GLU 113 2HB GLU 113 -16.919 -7.424 -3.779 703 1HG GLU 113 1HG GLU 113 -15.688 -7.454 -6.483 704 2HG GLU 113 2HG GLU 113 -17.132 -6.526 -6.048 705 H MET 114 H MET 114 -12.775 -7.692 -3.823 706 HA MET 114 HA MET 114 -13.279 -6.702 -1.093 707 1HB MET 114 1HB MET 114 -11.523 -8.714 -2.056 708 2HB MET 114 2HB MET 114 -10.476 -7.319 -1.940 709 1HG MET 114 1HG MET 114 -12.292 -8.381 0.251 710 2HG MET 114 2HG MET 114 -10.541 -8.550 0.102 711 1HE MET 114 1HE MET 114 -11.285 -6.119 3.224 712 2HE MET 114 2HE MET 114 -12.421 -7.353 2.632 713 3HE MET 114 3HE MET 114 -10.686 -7.727 2.749 714 H GLU 115 H GLU 115 -13.512 -4.458 -1.275 715 HA GLU 115 HA GLU 115 -11.038 -3.192 -2.019 716 1HB GLU 115 1HB GLU 115 -12.054 -1.280 -3.197 717 2HB GLU 115 2HB GLU 115 -12.244 -2.798 -4.086 718 1HG GLU 115 1HG GLU 115 -14.565 -2.946 -3.600 719 2HG GLU 115 2HG GLU 115 -14.478 -1.636 -2.413 720 H MET 116 H MET 116 -10.548 -1.348 -0.788 721 HA MET 116 HA MET 116 -12.576 -0.199 0.889 722 1HB MET 116 1HB MET 116 -11.898 -0.778 3.047 723 2HB MET 116 2HB MET 116 -12.034 -2.293 2.177 724 1HG MET 116 1HG MET 116 -9.641 -2.354 1.842 725 2HG MET 116 2HG MET 116 -9.447 -0.780 2.623 726 1HE MET 116 1HE MET 116 -11.409 -0.979 5.218 727 2HE MET 116 2HE MET 116 -10.175 -1.494 6.380 728 3HE MET 116 3HE MET 116 -9.775 -0.267 5.155 729 HA PRO 117 HA PRO 117 -9.709 3.257 0.692 730 1HB PRO 117 1HB PRO 117 -10.242 4.651 2.935 731 2HB PRO 117 2HB PRO 117 -11.323 4.609 1.508 732 1HG PRO 117 1HG PRO 117 -11.514 2.947 4.032 733 2HG PRO 117 2HG PRO 117 -12.790 3.889 3.201 734 1HD PRO 117 1HD PRO 117 -12.556 1.234 2.822 735 2HD PRO 117 2HD PRO 117 -12.946 2.292 1.445 736 H VAL 118 H VAL 118 -7.683 3.762 1.346 737 HA VAL 118 HA VAL 118 -6.672 2.814 3.968 738 HB VAL 118 HB VAL 118 -5.183 2.850 1.305 739 1HG1 VAL 118 1HG1 VAL 118 -4.161 2.289 4.113 740 2HG1 VAL 118 2HG1 VAL 118 -3.267 1.970 2.610 741 3HG1 VAL 118 3HG1 VAL 118 -3.680 3.630 3.044 742 1HG2 VAL 118 1HG2 VAL 118 -4.889 0.418 1.758 743 2HG2 VAL 118 2HG2 VAL 118 -5.952 0.568 3.173 744 3HG2 VAL 118 3HG2 VAL 118 -6.588 0.855 1.539 745 H VAL 119 H VAL 119 -5.736 4.407 5.104 746 HA VAL 119 HA VAL 119 -5.563 7.131 3.947 747 HB VAL 119 HB VAL 119 -7.101 6.997 5.802 748 1HG1 VAL 119 1HG1 VAL 119 -6.417 6.380 8.079 749 2HG1 VAL 119 2HG1 VAL 119 -6.289 4.993 6.999 750 3HG1 VAL 119 3HG1 VAL 119 -4.825 5.878 7.491 751 1HG2 VAL 119 1HG2 VAL 119 -5.607 9.006 5.601 752 2HG2 VAL 119 2HG2 VAL 119 -6.182 8.691 7.244 753 3HG2 VAL 119 3HG2 VAL 119 -4.521 8.259 6.792 754 H PHE 120 H PHE 120 -3.578 8.277 4.193 755 HA PHE 120 HA PHE 120 -1.267 6.981 5.359 756 1HB PHE 120 1HB PHE 120 -1.495 5.708 3.237 757 2HB PHE 120 2HB PHE 120 -1.576 7.212 2.335 758 HD1 PHE 120 HD1 PHE 120 0.411 8.298 1.611 759 HD2 PHE 120 HD2 PHE 120 0.663 5.250 4.645 760 HE1 PHE 120 HE1 PHE 120 2.875 8.193 1.319 761 HE2 PHE 120 HE2 PHE 120 3.132 5.344 4.509 762 HZ PHE 120 HZ PHE 120 4.232 6.720 2.772 763 H PHE 121 H PHE 121 0.385 8.548 5.696 764 HA PHE 121 HA PHE 121 0.413 11.058 4.189 765 1HB PHE 121 1HB PHE 121 0.119 12.370 6.259 766 2HB PHE 121 2HB PHE 121 -1.338 11.686 5.581 767 HD1 PHE 121 HD1 PHE 121 0.813 11.790 8.510 768 HD2 PHE 121 HD2 PHE 121 -2.476 9.773 6.650 769 HE1 PHE 121 HE1 PHE 121 0.260 10.728 10.678 770 HE2 PHE 121 HE2 PHE 121 -2.984 8.602 8.807 771 HZ PHE 121 HZ PHE 121 -1.616 9.085 10.818 772 H VAL 122 H VAL 122 2.509 10.756 3.715 773 HA VAL 122 HA VAL 122 4.544 9.514 4.968 774 HB VAL 122 HB VAL 122 4.650 12.028 3.309 775 1HG1 VAL 122 1HG1 VAL 122 6.795 12.001 4.463 776 2HG1 VAL 122 2HG1 VAL 122 6.958 10.250 4.225 777 3HG1 VAL 122 3HG1 VAL 122 7.065 11.358 2.846 778 1HG2 VAL 122 1HG2 VAL 122 5.346 10.420 1.552 779 2HG2 VAL 122 2HG2 VAL 122 5.120 9.082 2.690 780 3HG2 VAL 122 3HG2 VAL 122 3.733 10.076 2.195 781 H ASP 123 H ASP 123 5.793 9.649 6.667 782 HA ASP 123 HA ASP 123 5.185 11.486 8.685 783 1HB ASP 123 1HB ASP 123 7.502 9.526 8.651 784 2HB ASP 123 2HB ASP 123 6.514 10.062 10.014 785 HA PRO 124 HA PRO 124 8.570 14.251 7.290 786 1HB PRO 124 1HB PRO 124 8.093 16.440 8.867 787 2HB PRO 124 2HB PRO 124 7.124 15.973 7.454 788 1HG PRO 124 1HG PRO 124 6.497 15.495 10.358 789 2HG PRO 124 2HG PRO 124 5.381 16.025 9.055 790 1HD PRO 124 1HD PRO 124 5.642 13.399 9.947 791 2HD PRO 124 2HD PRO 124 5.074 13.857 8.313 792 H GLU 125 H GLU 125 9.397 12.162 8.675 793 HA GLU 125 HA GLU 125 11.416 13.202 10.589 794 1HB GLU 125 1HB GLU 125 10.713 10.325 10.018 795 2HB GLU 125 2HB GLU 125 11.679 10.949 11.347 796 1HG GLU 125 1HG GLU 125 9.667 12.122 12.264 797 2HG GLU 125 2HG GLU 125 8.712 11.409 10.950 798 H ILE 126 H ILE 126 10.835 11.703 7.412 799 HA ILE 126 HA ILE 126 13.274 10.605 6.898 800 HB ILE 126 HB ILE 126 11.250 10.296 5.626 801 1HG1 ILE 126 1HG1 ILE 126 13.471 11.274 3.778 802 2HG1 ILE 126 2HG1 ILE 126 13.593 9.797 4.736 803 1HG2 ILE 126 1HG2 ILE 126 10.435 11.807 3.951 804 2HG2 ILE 126 2HG2 ILE 126 10.554 12.744 5.445 805 3HG2 ILE 126 3HG2 ILE 126 11.795 12.911 4.177 806 1HD1 ILE 126 1HD1 ILE 126 12.843 9.159 2.623 807 2HD1 ILE 126 2HD1 ILE 126 11.473 8.970 3.737 808 3HD1 ILE 126 3HD1 ILE 126 11.522 10.343 2.598 809 H VAL 127 H VAL 127 12.445 14.058 6.390 810 HA VAL 127 HA VAL 127 15.057 14.623 5.184 811 HB VAL 127 HB VAL 127 14.283 17.002 5.327 812 1HG1 VAL 127 1HG1 VAL 127 13.976 15.616 3.324 813 2HG1 VAL 127 2HG1 VAL 127 12.386 15.095 3.923 814 3HG1 VAL 127 3HG1 VAL 127 12.672 16.800 3.532 815 1HG2 VAL 127 1HG2 VAL 127 11.994 17.537 5.853 816 2HG2 VAL 127 2HG2 VAL 127 11.584 15.851 6.185 817 3HG2 VAL 127 3HG2 VAL 127 12.676 16.733 7.273 818 H LYS 128 H LYS 128 15.760 13.371 7.383 819 HA LYS 128 HA LYS 128 16.930 15.486 9.081 820 1HB LYS 128 1HB LYS 128 15.280 13.254 10.323 821 2HB LYS 128 2HB LYS 128 16.341 14.377 11.182 822 1HG LYS 128 1HG LYS 128 14.961 16.274 10.357 823 2HG LYS 128 2HG LYS 128 13.949 15.125 9.457 824 1HD LYS 128 1HD LYS 128 13.256 14.019 11.499 825 2HD LYS 128 2HD LYS 128 14.178 15.173 12.477 826 1HE LYS 128 1HE LYS 128 12.801 16.999 11.928 827 2HE LYS 128 2HE LYS 128 12.221 16.277 10.424 828 1HZ LYS 128 1HZ LYS 128 10.620 16.395 12.294 829 2HZ LYS 128 2HZ LYS 128 10.708 15.012 11.465 830 3HZ LYS 128 3HZ LYS 128 11.400 15.113 12.977 831 HA PRO 129 HA PRO 129 19.746 11.865 9.836 832 1HB PRO 129 1HB PRO 129 19.272 9.286 9.068 833 2HB PRO 129 2HB PRO 129 18.564 9.989 10.549 834 1HG PRO 129 1HG PRO 129 17.276 9.831 7.798 835 2HG PRO 129 2HG PRO 129 16.612 9.244 9.344 836 1HD PRO 129 1HD PRO 129 15.889 11.651 8.468 837 2HD PRO 129 2HD PRO 129 16.348 11.415 10.183 838 H VAL 130 H VAL 130 21.580 11.197 8.712 839 HA VAL 130 HA VAL 130 22.002 11.975 6.077 840 HB VAL 130 HB VAL 130 23.684 11.723 7.859 841 1HG1 VAL 130 1HG1 VAL 130 22.990 9.495 8.767 842 2HG1 VAL 130 2HG1 VAL 130 23.594 8.727 7.282 843 3HG1 VAL 130 3HG1 VAL 130 24.710 9.578 8.359 844 1HG2 VAL 130 1HG2 VAL 130 25.495 10.985 6.432 845 2HG2 VAL 130 2HG2 VAL 130 24.361 10.166 5.340 846 3HG2 VAL 130 3HG2 VAL 130 24.327 11.937 5.496 847 H GLU 131 H GLU 131 20.845 8.949 7.364 848 HA GLU 131 HA GLU 131 21.066 6.984 5.486 849 1HB GLU 131 1HB GLU 131 18.534 7.977 6.873 850 2HB GLU 131 2HB GLU 131 18.712 6.374 6.161 851 1HG GLU 131 1HG GLU 131 20.279 5.689 7.824 852 2HG GLU 131 2HG GLU 131 20.488 7.320 8.459 853 H THR 132 H THR 132 18.613 9.572 5.362 854 HA THR 132 HA THR 132 17.779 8.554 2.739 855 HB THR 132 HB THR 132 15.701 9.954 3.522 856 HG1 THR 132 HG1 THR 132 15.860 10.764 5.549 857 1HG2 THR 132 1HG2 THR 132 16.680 7.567 5.178 858 2HG2 THR 132 2HG2 THR 132 15.013 8.137 5.114 859 3HG2 THR 132 3HG2 THR 132 15.773 7.480 3.656 860 H GLN 133 H GLN 133 18.171 11.558 4.517 861 HA GLN 133 HA GLN 133 18.307 13.748 3.761 862 1HB GLN 133 1HB GLN 133 20.481 12.364 4.489 863 2HB GLN 133 2HB GLN 133 20.995 12.676 2.866 864 1HG GLN 133 1HG GLN 133 21.897 14.388 4.278 865 2HG GLN 133 2HG GLN 133 20.682 15.135 3.235 866 1HE2 GLN 133 1HE2 GLN 133 19.508 13.197 6.000 867 2HE2 GLN 133 2HE2 GLN 133 19.207 14.546 7.047 868 H GLY 134 H GLY 134 16.768 13.042 1.719 869 1HA GLY 134 1HA GLY 134 17.067 14.568 -0.484 870 2HA GLY 134 2HA GLY 134 18.222 13.269 -0.844 871 H ILE 135 H ILE 135 16.882 11.081 0.390 872 HA ILE 135 HA ILE 135 14.887 10.321 -1.519 873 HB ILE 135 HB ILE 135 15.280 9.351 1.321 874 1HG1 ILE 135 1HG1 ILE 135 17.249 8.803 0.037 875 2HG1 ILE 135 2HG1 ILE 135 16.212 7.374 0.167 876 1HG2 ILE 135 1HG2 ILE 135 13.940 7.420 0.640 877 2HG2 ILE 135 2HG2 ILE 135 12.966 8.881 0.513 878 3HG2 ILE 135 3HG2 ILE 135 13.615 8.163 -0.946 879 1HD1 ILE 135 1HD1 ILE 135 16.465 9.082 -2.304 880 2HD1 ILE 135 2HD1 ILE 135 17.142 7.473 -2.017 881 3HD1 ILE 135 3HD1 ILE 135 15.384 7.672 -2.091 882 H LYS 136 H LYS 136 12.994 11.227 -1.823 883 HA LYS 136 HA LYS 136 11.226 11.800 0.400 884 1HB LYS 136 1HB LYS 136 10.875 14.143 -0.080 885 2HB LYS 136 2HB LYS 136 12.535 13.830 0.379 886 1HG LYS 136 1HG LYS 136 13.253 14.772 -1.457 887 2HG LYS 136 2HG LYS 136 12.609 13.455 -2.401 888 1HD LYS 136 1HD LYS 136 10.339 15.080 -1.939 889 2HD LYS 136 2HD LYS 136 11.650 16.239 -2.118 890 1HE LYS 136 1HE LYS 136 10.873 15.965 -4.332 891 2HE LYS 136 2HE LYS 136 12.289 14.909 -4.277 892 1HZ LYS 136 1HZ LYS 136 10.525 13.685 -5.269 893 2HZ LYS 136 2HZ LYS 136 10.583 13.081 -3.740 894 3HZ LYS 136 3HZ LYS 136 9.446 14.151 -4.112 895 H THR 137 H THR 137 11.002 9.790 -1.504 896 HA THR 137 HA THR 137 8.459 10.617 -2.518 897 HB THR 137 HB THR 137 9.957 9.152 -4.647 898 HG1 THR 137 HG1 THR 137 11.267 10.747 -5.145 899 1HG2 THR 137 1HG2 THR 137 7.601 9.778 -4.772 900 2HG2 THR 137 2HG2 THR 137 8.070 11.496 -4.708 901 3HG2 THR 137 3HG2 THR 137 8.574 10.485 -6.086 902 H LEU 138 H LEU 138 7.595 9.283 -1.051 903 HA LEU 138 HA LEU 138 8.837 6.691 -0.549 904 1HB LEU 138 1HB LEU 138 7.084 8.490 0.860 905 2HB LEU 138 2HB LEU 138 6.241 6.946 0.692 906 HG LEU 138 HG LEU 138 8.252 5.862 1.616 907 1HD1 LEU 138 1HD1 LEU 138 9.288 8.643 2.214 908 2HD1 LEU 138 2HD1 LEU 138 9.922 7.106 2.850 909 3HD1 LEU 138 3HD1 LEU 138 10.045 7.454 1.126 910 1HD2 LEU 138 1HD2 LEU 138 6.367 6.492 3.167 911 2HD2 LEU 138 2HD2 LEU 138 7.930 6.574 3.970 912 3HD2 LEU 138 3HD2 LEU 138 7.132 8.051 3.453 913 H THR 139 H THR 139 7.833 4.633 -0.805 914 HA THR 139 HA THR 139 5.653 4.459 -2.674 915 HB THR 139 HB THR 139 7.645 4.747 -4.183 916 HG1 THR 139 HG1 THR 139 6.124 3.575 -5.109 917 1HG2 THR 139 1HG2 THR 139 8.562 2.118 -2.977 918 2HG2 THR 139 2HG2 THR 139 9.279 2.986 -4.350 919 3HG2 THR 139 3HG2 THR 139 9.276 3.738 -2.733 920 H LEU 140 H LEU 140 5.553 2.027 -3.223 921 HA LEU 140 HA LEU 140 6.390 0.231 -1.175 922 1HB LEU 140 1HB LEU 140 4.452 1.326 -0.072 923 2HB LEU 140 2HB LEU 140 3.392 0.811 -1.385 924 HG LEU 140 HG LEU 140 4.944 -1.155 0.364 925 1HD1 LEU 140 1HD1 LEU 140 3.540 0.251 1.818 926 2HD1 LEU 140 2HD1 LEU 140 2.131 -0.057 0.779 927 3HD1 LEU 140 3HD1 LEU 140 2.876 -1.383 1.699 928 1HD2 LEU 140 1HD2 LEU 140 2.513 -1.391 -1.463 929 2HD2 LEU 140 2HD2 LEU 140 4.075 -2.232 -1.612 930 3HD2 LEU 140 3HD2 LEU 140 2.979 -2.640 -0.294 931 H SER 141 H SER 141 7.065 -1.292 -2.712 932 HA SER 141 HA SER 141 5.439 -1.774 -5.156 933 1HB SER 141 1HB SER 141 7.895 -1.596 -5.391 934 2HB SER 141 2HB SER 141 8.048 -3.061 -4.397 935 HG SER 141 HG SER 141 6.620 -2.839 -6.852 936 H TYR 142 H TYR 142 3.611 -2.802 -4.521 937 HA TYR 142 HA TYR 142 3.696 -4.822 -2.410 938 1HB TYR 142 1HB TYR 142 1.831 -3.012 -3.108 939 2HB TYR 142 2HB TYR 142 1.188 -4.372 -3.997 940 HD1 TYR 142 HD1 TYR 142 0.208 -2.719 -1.433 941 HD2 TYR 142 HD2 TYR 142 1.980 -6.619 -1.995 942 HE1 TYR 142 HE1 TYR 142 -0.500 -3.384 0.842 943 HE2 TYR 142 HE2 TYR 142 1.257 -7.268 0.269 944 HH TYR 142 HH TYR 142 0.112 -6.591 2.212 945 H THR 143 H THR 143 4.807 -6.635 -3.130 946 HA THR 143 HA THR 143 4.539 -7.437 -5.899 947 HB THR 143 HB THR 143 6.195 -9.115 -4.111 948 HG1 THR 143 HG1 THR 143 6.626 -6.324 -4.334 949 1HG2 THR 143 1HG2 THR 143 6.196 -9.170 -6.608 950 2HG2 THR 143 2HG2 THR 143 6.731 -7.482 -6.639 951 3HG2 THR 143 3HG2 THR 143 7.790 -8.734 -5.947 952 H PHE 144 H PHE 144 2.466 -8.061 -6.064 953 HA PHE 144 HA PHE 144 1.389 -10.347 -4.610 954 1HB PHE 144 1HB PHE 144 0.628 -8.660 -6.991 955 2HB PHE 144 2HB PHE 144 -0.186 -10.177 -6.723 956 HD1 PHE 144 HD1 PHE 144 0.853 -7.930 -3.889 957 HD2 PHE 144 HD2 PHE 144 -2.352 -9.100 -6.529 958 HE1 PHE 144 HE1 PHE 144 -0.818 -7.375 -2.130 959 HE2 PHE 144 HE2 PHE 144 -3.999 -8.486 -4.774 960 HZ PHE 144 HZ PHE 144 -3.186 -7.801 -2.517 961 H TYR 145 H TYR 145 2.842 -12.091 -4.857 962 HA TYR 145 HA TYR 145 2.394 -13.527 -7.367 963 1HB TYR 145 1HB TYR 145 4.612 -13.893 -7.978 964 2HB TYR 145 2HB TYR 145 4.518 -12.170 -7.663 965 HD1 TYR 145 HD1 TYR 145 6.530 -14.986 -7.191 966 HD2 TYR 145 HD2 TYR 145 5.097 -11.538 -5.058 967 HE1 TYR 145 HE1 TYR 145 8.534 -15.047 -5.734 968 HE2 TYR 145 HE2 TYR 145 7.096 -11.584 -3.614 969 HH TYR 145 HH TYR 145 9.150 -12.579 -3.229 970 HA PRO 146 HA PRO 146 3.166 -16.152 -3.497 971 1HB PRO 146 1HB PRO 146 0.768 -16.652 -2.305 972 2HB PRO 146 2HB PRO 146 1.780 -15.213 -1.998 973 1HG PRO 146 1HG PRO 146 -0.605 -15.380 -3.864 974 2HG PRO 146 2HG PRO 146 -0.219 -14.163 -2.626 975 1HD PRO 146 1HD PRO 146 0.409 -13.803 -5.280 976 2HD PRO 146 2HD PRO 146 1.395 -13.157 -3.924 977 H ARG 147 H ARG 147 -0.169 -17.228 -4.373 978 HA ARG 147 HA ARG 147 0.934 -19.429 -6.012 979 1HB ARG 147 1HB ARG 147 -0.601 -19.966 -3.433 980 2HB ARG 147 2HB ARG 147 -0.035 -21.162 -4.609 981 1HG ARG 147 1HG ARG 147 2.332 -20.510 -4.065 982 2HG ARG 147 2HG ARG 147 1.701 -19.381 -2.860 983 1HD ARG 147 1HD ARG 147 0.440 -21.566 -1.934 984 2HD ARG 147 2HD ARG 147 1.692 -22.398 -2.841 985 HE ARG 147 HE ARG 147 3.257 -21.784 -1.266 986 1HH1 ARG 147 1HH1 ARG 147 0.395 -19.719 -0.897 987 2HH1 ARG 147 2HH1 ARG 147 1.038 -18.904 0.528 988 1HH2 ARG 147 1HH2 ARG 147 4.054 -20.617 0.667 989 2HH2 ARG 147 2HH2 ARG 147 3.031 -19.346 1.318 990 H GLU 148 H GLU 148 -0.428 -19.241 -7.772 991 HA GLU 148 HA GLU 148 -3.304 -18.769 -7.261 992 1HB GLU 148 1HB GLU 148 -3.584 -18.190 -9.501 993 2HB GLU 148 2HB GLU 148 -2.249 -17.238 -8.851 994 1HG GLU 148 1HG GLU 148 -0.624 -18.581 -10.070 995 2HG GLU 148 2HG GLU 148 -1.921 -19.625 -10.689 996 HA PRO 149 HA PRO 149 -3.362 -23.252 -7.914 997 1HB PRO 149 1HB PRO 149 -5.965 -23.771 -7.267 998 2HB PRO 149 2HB PRO 149 -4.715 -23.368 -6.058 999 1HG PRO 149 1HG PRO 149 -6.795 -21.521 -7.238 1000 2HG PRO 149 2HG PRO 149 -6.289 -21.672 -5.541 1001 1HD PRO 149 1HD PRO 149 -5.343 -19.746 -7.282 1002 2HD PRO 149 2HD PRO 149 -4.362 -20.402 -5.919 1003 H SER 150 H SER 150 -6.174 -21.327 -9.136 1004 HA SER 150 HA SER 150 -5.972 -22.386 -11.841 1005 1HB SER 150 1HB SER 150 -8.106 -23.720 -11.611 1006 2HB SER 150 2HB SER 150 -6.753 -24.415 -10.719 1007 HG SER 150 HG SER 150 -8.633 -22.628 -9.562 1008 H LYS 151 H LYS 151 -6.538 -20.487 -12.860 1009 HA LYS 151 HA LYS 151 -9.084 -19.160 -12.014 1010 1HB LYS 151 1HB LYS 151 -8.256 -17.089 -12.965 1011 2HB LYS 151 2HB LYS 151 -7.278 -17.651 -11.620 1012 1HG LYS 151 1HG LYS 151 -5.485 -18.384 -13.064 1013 2HG LYS 151 2HG LYS 151 -6.465 -18.121 -14.523 1014 1HD LYS 151 1HD LYS 151 -6.639 -15.667 -13.845 1015 2HD LYS 151 2HD LYS 151 -5.402 -15.993 -12.631 1016 1HE LYS 151 1HE LYS 151 -5.131 -16.245 -15.661 1017 2HE LYS 151 2HE LYS 151 -4.399 -15.022 -14.612 1018 1HZ LYS 151 1HZ LYS 151 -2.758 -16.644 -15.084 1019 2HZ LYS 151 2HZ LYS 151 -3.185 -16.913 -13.520 1020 3HZ LYS 151 3HZ LYS 151 -3.735 -17.894 -14.648 Start of MODEL 12 1 H VAL 21 H VAL 21 -1.377 11.114 15.614 2 HA VAL 21 HA VAL 21 -2.571 8.475 15.384 3 HB VAL 21 HB VAL 21 -3.908 10.835 16.708 4 1HG1 VAL 21 1HG1 VAL 21 -5.201 8.671 16.535 5 2HG1 VAL 21 2HG1 VAL 21 -3.865 7.846 17.352 6 3HG1 VAL 21 3HG1 VAL 21 -4.802 9.088 18.201 7 1HG2 VAL 21 1HG2 VAL 21 -1.675 10.863 17.658 8 2HG2 VAL 21 2HG2 VAL 21 -2.782 10.145 18.819 9 3HG2 VAL 21 3HG2 VAL 21 -1.713 9.090 17.878 10 H GLU 22 H GLU 22 -2.516 9.237 12.852 11 HA GLU 22 HA GLU 22 -3.709 9.709 10.944 12 1HB GLU 22 1HB GLU 22 -4.370 7.469 11.981 13 2HB GLU 22 2HB GLU 22 -5.896 8.227 12.454 14 1HG GLU 22 1HG GLU 22 -6.426 8.654 10.092 15 2HG GLU 22 2HG GLU 22 -4.820 8.080 9.599 16 H GLN 23 H GLN 23 -3.695 12.070 11.609 17 HA GLN 23 HA GLN 23 -6.443 13.148 11.571 18 1HB GLN 23 1HB GLN 23 -5.120 15.055 13.093 19 2HB GLN 23 2HB GLN 23 -6.276 13.872 13.711 20 1HG GLN 23 1HG GLN 23 -4.346 14.119 15.115 21 2HG GLN 23 2HG GLN 23 -4.393 12.475 14.479 22 1HE2 GLN 23 1HE2 GLN 23 -2.572 11.782 13.219 23 2HE2 GLN 23 2HE2 GLN 23 -1.261 12.871 12.795 24 H ALA 24 H ALA 24 -3.758 12.998 9.779 25 HA ALA 24 HA ALA 24 -2.400 14.597 11.364 26 1HB ALA 24 1HB ALA 24 -1.766 13.883 8.540 27 2HB ALA 24 2HB ALA 24 -0.538 14.279 9.784 28 3HB ALA 24 3HB ALA 24 -1.520 12.808 9.913 29 H SER 25 H SER 25 -2.039 16.718 11.682 30 HA SER 25 HA SER 25 -2.281 18.726 9.812 31 1HB SER 25 1HB SER 25 -4.771 17.979 9.923 32 2HB SER 25 2HB SER 25 -4.775 18.634 11.569 33 HG SER 25 HG SER 25 -5.466 20.157 9.983 34 H ASP 26 H ASP 26 -0.424 18.190 11.509 35 HA ASP 26 HA ASP 26 -0.303 20.440 13.380 36 1HB ASP 26 1HB ASP 26 -1.460 18.820 14.803 37 2HB ASP 26 2HB ASP 26 -0.295 17.549 14.394 38 H LEU 27 H LEU 27 1.063 17.289 12.543 39 HA LEU 27 HA LEU 27 3.839 17.991 12.801 40 1HB LEU 27 1HB LEU 27 2.424 15.832 11.192 41 2HB LEU 27 2HB LEU 27 4.172 16.011 11.255 42 HG LEU 27 HG LEU 27 3.504 14.280 12.703 43 1HD1 LEU 27 1HD1 LEU 27 5.450 15.679 13.359 44 2HD1 LEU 27 2HD1 LEU 27 4.393 16.589 14.465 45 3HD1 LEU 27 3HD1 LEU 27 4.664 14.858 14.717 46 1HD2 LEU 27 1HD2 LEU 27 2.116 14.474 14.629 47 2HD2 LEU 27 2HD2 LEU 27 1.921 16.220 14.422 48 3HD2 LEU 27 3HD2 LEU 27 1.192 15.091 13.250 49 H ILE 28 H ILE 28 1.469 18.607 10.308 50 HA ILE 28 HA ILE 28 3.303 18.432 8.119 51 HB ILE 28 HB ILE 28 0.423 19.329 8.365 52 1HG1 ILE 28 1HG1 ILE 28 1.095 16.902 6.859 53 2HG1 ILE 28 2HG1 ILE 28 1.723 16.793 8.500 54 1HG2 ILE 28 1HG2 ILE 28 1.218 20.398 6.342 55 2HG2 ILE 28 2HG2 ILE 28 2.086 18.931 5.844 56 3HG2 ILE 28 3HG2 ILE 28 0.309 18.959 5.876 57 1HD1 ILE 28 1HD1 ILE 28 -0.574 15.945 8.319 58 2HD1 ILE 28 2HD1 ILE 28 -0.398 17.279 9.470 59 3HD1 ILE 28 3HD1 ILE 28 -1.129 17.569 7.862 60 H LEU 29 H LEU 29 4.329 19.860 7.030 61 HA LEU 29 HA LEU 29 3.961 22.772 7.480 62 1HB LEU 29 1HB LEU 29 6.543 21.540 6.571 63 2HB LEU 29 2HB LEU 29 6.178 23.144 7.165 64 HG LEU 29 HG LEU 29 7.295 22.199 8.900 65 1HD1 LEU 29 1HD1 LEU 29 4.692 21.218 10.039 66 2HD1 LEU 29 2HD1 LEU 29 5.989 22.127 10.777 67 3HD1 LEU 29 3HD1 LEU 29 4.902 22.939 9.638 68 1HD2 LEU 29 1HD2 LEU 29 5.928 19.511 8.516 69 2HD2 LEU 29 2HD2 LEU 29 7.603 19.952 8.147 70 3HD2 LEU 29 3HD2 LEU 29 7.037 19.910 9.826 71 H ASP 30 H ASP 30 3.888 23.879 5.377 72 HA ASP 30 HA ASP 30 2.628 22.254 3.434 73 1HB ASP 30 1HB ASP 30 3.291 25.198 3.490 74 2HB ASP 30 2HB ASP 30 2.265 24.453 2.265 75 H GLU 31 H GLU 31 4.493 20.956 3.153 76 HA GLU 31 HA GLU 31 6.377 21.664 0.957 77 1HB GLU 31 1HB GLU 31 6.739 20.522 3.460 78 2HB GLU 31 2HB GLU 31 6.566 19.073 2.476 79 1HG GLU 31 1HG GLU 31 8.539 21.285 1.774 80 2HG GLU 31 2HG GLU 31 8.882 20.111 3.044 81 H LYS 32 H LYS 32 6.684 19.152 -0.184 82 HA LYS 32 HA LYS 32 4.071 17.774 -0.320 83 1HB LYS 32 1HB LYS 32 5.392 19.046 -2.745 84 2HB LYS 32 2HB LYS 32 4.340 17.624 -2.851 85 1HG LYS 32 1HG LYS 32 2.697 19.189 -1.419 86 2HG LYS 32 2HG LYS 32 3.614 20.469 -2.220 87 1HD LYS 32 1HD LYS 32 3.050 19.396 -4.430 88 2HD LYS 32 2HD LYS 32 2.212 18.098 -3.553 89 1HE LYS 32 1HE LYS 32 0.696 19.879 -2.538 90 2HE LYS 32 2HE LYS 32 1.387 21.027 -3.698 91 1HZ LYS 32 1HZ LYS 32 -0.073 18.522 -4.326 92 2HZ LYS 32 2HZ LYS 32 -0.667 20.024 -4.488 93 3HZ LYS 32 3HZ LYS 32 0.565 19.511 -5.455 94 H ILE 33 H ILE 33 4.260 15.648 -0.536 95 HA ILE 33 HA ILE 33 6.891 14.398 -1.118 96 HB ILE 33 HB ILE 33 6.598 14.819 1.240 97 1HG1 ILE 33 1HG1 ILE 33 8.053 13.161 0.546 98 2HG1 ILE 33 2HG1 ILE 33 7.175 12.595 1.946 99 1HG2 ILE 33 1HG2 ILE 33 5.081 13.664 2.627 100 2HG2 ILE 33 2HG2 ILE 33 4.154 14.583 1.438 101 3HG2 ILE 33 3HG2 ILE 33 4.346 12.820 1.270 102 1HD1 ILE 33 1HD1 ILE 33 7.392 10.732 0.462 103 2HD1 ILE 33 2HD1 ILE 33 5.694 11.246 0.303 104 3HD1 ILE 33 3HD1 ILE 33 6.884 11.676 -0.935 105 H LYS 34 H LYS 34 6.408 13.485 -3.027 106 HA LYS 34 HA LYS 34 3.722 12.584 -3.714 107 1HB LYS 34 1HB LYS 34 5.204 13.770 -5.267 108 2HB LYS 34 2HB LYS 34 6.363 12.442 -5.230 109 1HG LYS 34 1HG LYS 34 3.450 12.138 -6.127 110 2HG LYS 34 2HG LYS 34 4.761 12.627 -7.192 111 1HD LYS 34 1HD LYS 34 5.818 10.318 -6.028 112 2HD LYS 34 2HD LYS 34 4.090 9.936 -6.150 113 1HE LYS 34 1HE LYS 34 4.272 10.766 -8.622 114 2HE LYS 34 2HE LYS 34 6.020 10.888 -8.348 115 1HZ LYS 34 1HZ LYS 34 5.777 8.861 -9.302 116 2HZ LYS 34 2HZ LYS 34 5.699 8.372 -7.719 117 3HZ LYS 34 3HZ LYS 34 4.337 8.559 -8.657 118 H VAL 35 H VAL 35 3.017 10.381 -3.707 119 HA VAL 35 HA VAL 35 4.992 8.437 -2.590 120 HB VAL 35 HB VAL 35 2.036 8.519 -2.234 121 1HG1 VAL 35 1HG1 VAL 35 2.404 6.640 -0.683 122 2HG1 VAL 35 2HG1 VAL 35 3.083 6.205 -2.237 123 3HG1 VAL 35 3HG1 VAL 35 4.153 6.736 -0.932 124 1HG2 VAL 35 1HG2 VAL 35 2.437 9.026 0.125 125 2HG2 VAL 35 2HG2 VAL 35 4.191 9.083 -0.160 126 3HG2 VAL 35 3HG2 VAL 35 3.115 10.308 -0.879 127 H THR 36 H THR 36 5.214 6.646 -3.828 128 HA THR 36 HA THR 36 3.686 6.474 -6.402 129 HB THR 36 HB THR 36 6.471 5.542 -5.596 130 HG1 THR 36 HG1 THR 36 6.423 7.719 -5.588 131 1HG2 THR 36 1HG2 THR 36 6.898 5.384 -7.994 132 2HG2 THR 36 2HG2 THR 36 5.639 4.245 -7.472 133 3HG2 THR 36 3HG2 THR 36 5.180 5.735 -8.341 134 H PHE 37 H PHE 37 2.046 5.160 -6.190 135 HA PHE 37 HA PHE 37 2.065 3.051 -4.185 136 1HB PHE 37 1HB PHE 37 0.062 4.045 -6.269 137 2HB PHE 37 2HB PHE 37 -0.172 2.626 -5.281 138 HD1 PHE 37 HD1 PHE 37 1.395 5.777 -3.912 139 HD2 PHE 37 HD2 PHE 37 -2.198 3.413 -4.291 140 HE1 PHE 37 HE1 PHE 37 0.532 6.729 -1.819 141 HE2 PHE 37 HE2 PHE 37 -3.092 4.482 -2.260 142 HZ PHE 37 HZ PHE 37 -1.606 6.044 -0.927 143 H ASP 38 H ASP 38 3.876 1.762 -5.123 144 HA ASP 38 HA ASP 38 3.498 0.849 -7.824 145 1HB ASP 38 1HB ASP 38 5.687 1.437 -7.089 146 2HB ASP 38 2HB ASP 38 5.715 0.111 -5.942 147 H ALA 39 H ALA 39 1.472 -0.134 -7.652 148 HA ALA 39 HA ALA 39 1.236 -2.705 -6.296 149 1HB ALA 39 1HB ALA 39 -1.011 -2.717 -7.326 150 2HB ALA 39 2HB ALA 39 -0.670 -1.153 -6.551 151 3HB ALA 39 3HB ALA 39 -0.571 -1.313 -8.318 152 H ASN 40 H ASN 40 2.014 -4.641 -7.130 153 HA ASN 40 HA ASN 40 1.813 -5.038 -10.077 154 1HB ASN 40 1HB ASN 40 4.013 -6.303 -8.424 155 2HB ASN 40 2HB ASN 40 3.855 -6.188 -10.169 156 1HD2 ASN 40 1HD2 ASN 40 4.410 -4.326 -7.187 157 2HD2 ASN 40 2HD2 ASN 40 5.370 -3.041 -7.930 158 H VAL 41 H VAL 41 1.085 -7.097 -10.666 159 HA VAL 41 HA VAL 41 0.435 -9.046 -8.550 160 HB VAL 41 HB VAL 41 -1.529 -8.259 -10.746 161 1HG1 VAL 41 1HG1 VAL 41 -1.861 -9.929 -8.232 162 2HG1 VAL 41 2HG1 VAL 41 -3.160 -9.490 -9.356 163 3HG1 VAL 41 3HG1 VAL 41 -1.834 -10.516 -9.906 164 1HG2 VAL 41 1HG2 VAL 41 -1.707 -7.334 -7.856 165 2HG2 VAL 41 2HG2 VAL 41 -1.348 -6.291 -9.252 166 3HG2 VAL 41 3HG2 VAL 41 -2.901 -7.102 -9.158 167 H ALA 42 H ALA 42 0.676 -11.151 -9.324 168 HA ALA 42 HA ALA 42 0.970 -11.512 -12.268 169 1HB ALA 42 1HB ALA 42 2.471 -13.368 -11.929 170 2HB ALA 42 2HB ALA 42 3.189 -11.947 -11.152 171 3HB ALA 42 3HB ALA 42 2.386 -13.194 -10.173 172 H ALA 43 H ALA 43 -0.028 -13.540 -12.923 173 HA ALA 43 HA ALA 43 -2.581 -13.830 -12.015 174 1HB ALA 43 1HB ALA 43 -0.966 -16.057 -13.309 175 2HB ALA 43 2HB ALA 43 -2.725 -15.803 -13.384 176 3HB ALA 43 3HB ALA 43 -1.638 -14.658 -14.180 177 H GLY 44 H GLY 44 0.245 -15.529 -10.821 178 1HA GLY 44 1HA GLY 44 -0.399 -17.393 -9.020 179 2HA GLY 44 2HA GLY 44 0.704 -16.060 -8.656 180 H LEU 45 H LEU 45 -1.133 -13.845 -8.425 181 HA LEU 45 HA LEU 45 -3.061 -14.802 -6.379 182 1HB LEU 45 1HB LEU 45 -1.257 -12.784 -6.008 183 2HB LEU 45 2HB LEU 45 -2.620 -11.887 -6.616 184 HG LEU 45 HG LEU 45 -3.073 -13.988 -4.406 185 1HD1 LEU 45 1HD1 LEU 45 -2.944 -11.698 -2.983 186 2HD1 LEU 45 2HD1 LEU 45 -1.555 -12.766 -3.184 187 3HD1 LEU 45 3HD1 LEU 45 -1.693 -11.353 -4.198 188 1HD2 LEU 45 1HD2 LEU 45 -4.996 -12.994 -5.625 189 2HD2 LEU 45 2HD2 LEU 45 -4.907 -12.536 -3.917 190 3HD2 LEU 45 3HD2 LEU 45 -4.432 -11.368 -5.182 191 HA PRO 46 HA PRO 46 -5.125 -14.254 -10.224 192 1HB PRO 46 1HB PRO 46 -7.426 -15.689 -9.815 193 2HB PRO 46 2HB PRO 46 -5.808 -16.446 -9.925 194 1HG PRO 46 1HG PRO 46 -7.343 -15.663 -7.471 195 2HG PRO 46 2HG PRO 46 -6.560 -17.236 -7.805 196 1HD PRO 46 1HD PRO 46 -5.346 -15.311 -6.294 197 2HD PRO 46 2HD PRO 46 -4.407 -16.345 -7.404 198 H TRP 47 H TRP 47 -6.081 -12.660 -7.435 199 HA TRP 47 HA TRP 47 -8.775 -11.955 -7.926 200 1HB TRP 47 1HB TRP 47 -6.654 -10.664 -6.232 201 2HB TRP 47 2HB TRP 47 -8.384 -10.367 -6.130 202 HD1 TRP 47 HD1 TRP 47 -8.425 -13.913 -6.572 203 HE1 TRP 47 HE1 TRP 47 -8.575 -15.131 -4.291 204 HE3 TRP 47 HE3 TRP 47 -6.660 -10.254 -3.469 205 HZ2 TRP 47 HZ2 TRP 47 -7.930 -14.648 -1.542 206 HZ3 TRP 47 HZ3 TRP 47 -5.871 -11.066 -1.312 207 HH2 TRP 47 HH2 TRP 47 -6.764 -13.016 -0.182 208 H GLU 48 H GLU 48 -9.663 -9.925 -8.434 209 HA GLU 48 HA GLU 48 -8.284 -8.271 -10.463 210 1HB GLU 48 1HB GLU 48 -10.730 -8.801 -10.589 211 2HB GLU 48 2HB GLU 48 -10.940 -8.106 -8.979 212 1HG GLU 48 1HG GLU 48 -10.124 -5.873 -10.044 213 2HG GLU 48 2HG GLU 48 -10.467 -6.673 -11.586 214 H PHE 49 H PHE 49 -6.475 -7.823 -8.968 215 HA PHE 49 HA PHE 49 -7.095 -6.008 -6.710 216 1HB PHE 49 1HB PHE 49 -5.385 -7.902 -6.560 217 2HB PHE 49 2HB PHE 49 -4.331 -6.861 -7.512 218 HD1 PHE 49 HD1 PHE 49 -5.470 -7.662 -4.218 219 HD2 PHE 49 HD2 PHE 49 -4.037 -4.355 -6.597 220 HE1 PHE 49 HE1 PHE 49 -5.330 -6.259 -2.195 221 HE2 PHE 49 HE2 PHE 49 -4.102 -2.910 -4.598 222 HZ PHE 49 HZ PHE 49 -4.613 -3.892 -2.362 223 H VAL 50 H VAL 50 -7.041 -3.828 -6.972 224 HA VAL 50 HA VAL 50 -5.608 -2.775 -9.379 225 HB VAL 50 HB VAL 50 -7.352 -1.279 -9.895 226 1HG1 VAL 50 1HG1 VAL 50 -9.179 -2.743 -10.493 227 2HG1 VAL 50 2HG1 VAL 50 -7.685 -3.696 -10.612 228 3HG1 VAL 50 3HG1 VAL 50 -8.774 -3.889 -9.210 229 1HG2 VAL 50 1HG2 VAL 50 -8.171 -0.561 -7.722 230 2HG2 VAL 50 2HG2 VAL 50 -9.529 -1.274 -8.600 231 3HG2 VAL 50 3HG2 VAL 50 -8.681 -2.229 -7.361 232 HA PRO 51 HA PRO 51 -4.173 0.223 -6.259 233 1HB PRO 51 1HB PRO 51 -2.857 1.967 -7.887 234 2HB PRO 51 2HB PRO 51 -2.163 0.378 -7.473 235 1HG PRO 51 1HG PRO 51 -3.707 1.139 -9.966 236 2HG PRO 51 2HG PRO 51 -2.157 0.254 -9.874 237 1HD PRO 51 1HD PRO 51 -4.591 -0.972 -10.146 238 2HD PRO 51 2HD PRO 51 -3.254 -1.745 -9.244 239 H VAL 52 H VAL 52 -4.810 2.491 -5.928 240 HA VAL 52 HA VAL 52 -7.380 3.125 -7.134 241 HB VAL 52 HB VAL 52 -7.099 5.259 -5.734 242 1HG1 VAL 52 1HG1 VAL 52 -7.959 4.009 -3.773 243 2HG1 VAL 52 2HG1 VAL 52 -8.747 3.517 -5.282 244 3HG1 VAL 52 3HG1 VAL 52 -7.494 2.483 -4.561 245 1HG2 VAL 52 1HG2 VAL 52 -5.314 3.359 -4.208 246 2HG2 VAL 52 2HG2 VAL 52 -4.616 4.590 -5.281 247 3HG2 VAL 52 3HG2 VAL 52 -5.634 5.088 -3.921 248 H GLN 53 H GLN 53 -4.077 4.471 -7.179 249 HA GLN 53 HA GLN 53 -4.266 5.094 -9.896 250 1HB GLN 53 1HB GLN 53 -3.814 7.457 -9.888 251 2HB GLN 53 2HB GLN 53 -5.376 7.180 -9.167 252 1HG GLN 53 1HG GLN 53 -3.062 7.406 -7.254 253 2HG GLN 53 2HG GLN 53 -3.427 8.835 -8.242 254 1HE2 GLN 53 1HE2 GLN 53 -5.017 6.453 -6.099 255 2HE2 GLN 53 2HE2 GLN 53 -6.262 7.582 -5.575 256 H ARG 54 H ARG 54 -1.952 6.209 -10.442 257 HA ARG 54 HA ARG 54 -0.147 4.239 -9.488 258 1HB ARG 54 1HB ARG 54 -0.071 5.333 -11.718 259 2HB ARG 54 2HB ARG 54 0.473 6.819 -10.985 260 1HG ARG 54 1HG ARG 54 2.357 5.603 -11.953 261 2HG ARG 54 2HG ARG 54 2.560 5.832 -10.223 262 1HD ARG 54 1HD ARG 54 1.915 3.568 -9.820 263 2HD ARG 54 2HD ARG 54 1.554 3.375 -11.554 264 HE ARG 54 HE ARG 54 4.227 4.198 -11.369 265 1HH1 ARG 54 1HH1 ARG 54 2.428 1.295 -10.258 266 2HH1 ARG 54 2HH1 ARG 54 3.950 0.458 -9.886 267 1HH2 ARG 54 1HH2 ARG 54 6.162 2.862 -10.873 268 2HH2 ARG 54 2HH2 ARG 54 5.835 1.276 -10.160 269 H ASP 55 H ASP 55 -0.694 7.623 -8.526 270 HA ASP 55 HA ASP 55 1.017 7.320 -6.240 271 1HB ASP 55 1HB ASP 55 2.019 9.719 -7.205 272 2HB ASP 55 2HB ASP 55 2.813 8.160 -7.337 273 H ILE 56 H ILE 56 1.006 9.275 -4.914 274 HA ILE 56 HA ILE 56 -1.353 11.039 -5.269 275 HB ILE 56 HB ILE 56 -1.967 10.942 -2.953 276 1HG1 ILE 56 1HG1 ILE 56 0.024 8.700 -2.822 277 2HG1 ILE 56 2HG1 ILE 56 0.314 10.302 -2.121 278 1HG2 ILE 56 1HG2 ILE 56 -3.006 9.325 -4.626 279 2HG2 ILE 56 2HG2 ILE 56 -1.863 8.091 -4.042 280 3HG2 ILE 56 3HG2 ILE 56 -3.076 8.780 -2.942 281 1HD1 ILE 56 1HD1 ILE 56 -0.333 8.809 -0.330 282 2HD1 ILE 56 2HD1 ILE 56 -1.612 10.014 -0.611 283 3HD1 ILE 56 3HD1 ILE 56 -1.811 8.343 -1.185 284 H ASP 57 H ASP 57 -0.972 13.212 -4.183 285 HA ASP 57 HA ASP 57 1.852 13.650 -3.376 286 1HB ASP 57 1HB ASP 57 1.391 15.967 -3.788 287 2HB ASP 57 2HB ASP 57 1.164 14.989 -5.245 288 H VAL 58 H VAL 58 1.910 13.032 -1.273 289 HA VAL 58 HA VAL 58 -0.111 14.037 0.689 290 HB VAL 58 HB VAL 58 2.328 12.269 0.880 291 1HG1 VAL 58 1HG1 VAL 58 2.390 13.637 2.923 292 2HG1 VAL 58 2HG1 VAL 58 0.642 13.392 3.161 293 3HG1 VAL 58 3HG1 VAL 58 1.780 12.045 3.294 294 1HG2 VAL 58 1HG2 VAL 58 0.710 10.627 1.638 295 2HG2 VAL 58 2HG2 VAL 58 -0.601 11.821 1.545 296 3HG2 VAL 58 3HG2 VAL 58 0.228 11.280 0.069 297 H ARG 59 H ARG 59 0.860 15.428 2.442 298 HA ARG 59 HA ARG 59 3.227 17.038 1.622 299 1HB ARG 59 1HB ARG 59 0.747 18.152 2.988 300 2HB ARG 59 2HB ARG 59 2.163 19.023 2.377 301 1HG ARG 59 1HG ARG 59 1.515 17.957 0.058 302 2HG ARG 59 2HG ARG 59 -0.038 17.587 0.822 303 1HD ARG 59 1HD ARG 59 1.234 20.289 0.393 304 2HD ARG 59 2HD ARG 59 -0.225 19.603 -0.364 305 HE ARG 59 HE ARG 59 -1.181 19.494 2.010 306 1HH1 ARG 59 1HH1 ARG 59 0.876 22.215 0.891 307 2HH1 ARG 59 2HH1 ARG 59 0.546 23.118 2.376 308 1HH2 ARG 59 1HH2 ARG 59 -1.410 20.775 3.954 309 2HH2 ARG 59 2HH2 ARG 59 -0.622 22.398 3.986 310 H ILE 60 H ILE 60 4.612 16.025 2.919 311 HA ILE 60 HA ILE 60 5.037 14.528 4.754 312 HB ILE 60 HB ILE 60 6.381 15.987 6.222 313 1HG1 ILE 60 1HG1 ILE 60 5.376 18.121 4.264 314 2HG1 ILE 60 2HG1 ILE 60 5.063 17.992 5.994 315 1HG2 ILE 60 1HG2 ILE 60 7.197 14.790 4.188 316 2HG2 ILE 60 2HG2 ILE 60 6.899 16.272 3.246 317 3HG2 ILE 60 3HG2 ILE 60 8.086 16.256 4.574 318 1HD1 ILE 60 1HD1 ILE 60 7.753 18.485 4.612 319 2HD1 ILE 60 2HD1 ILE 60 6.812 19.648 5.550 320 3HD1 ILE 60 3HD1 ILE 60 7.573 18.281 6.363 321 H GLY 61 H GLY 61 2.895 13.867 5.229 322 1HA GLY 61 1HA GLY 61 2.333 12.986 7.451 323 2HA GLY 61 2HA GLY 61 2.079 14.634 8.014 324 H GLU 62 H GLU 62 0.823 15.471 5.420 325 HA GLU 62 HA GLU 62 -1.710 15.493 6.334 326 1HB GLU 62 1HB GLU 62 -0.497 16.770 4.459 327 2HB GLU 62 2HB GLU 62 -1.216 15.601 3.344 328 1HG GLU 62 1HG GLU 62 -3.411 16.417 3.868 329 2HG GLU 62 2HG GLU 62 -2.851 17.217 5.353 330 H THR 63 H THR 63 -2.979 13.829 6.938 331 HA THR 63 HA THR 63 -2.773 11.225 5.924 332 HB THR 63 HB THR 63 -4.937 12.524 7.662 333 HG1 THR 63 HG1 THR 63 -2.439 11.274 8.177 334 1HG2 THR 63 1HG2 THR 63 -5.692 10.303 6.913 335 2HG2 THR 63 2HG2 THR 63 -4.106 9.620 7.361 336 3HG2 THR 63 3HG2 THR 63 -5.166 10.291 8.616 337 H VAL 64 H VAL 64 -3.364 10.603 3.886 338 HA VAL 64 HA VAL 64 -5.677 11.835 2.563 339 HB VAL 64 HB VAL 64 -3.334 11.107 1.663 340 1HG1 VAL 64 1HG1 VAL 64 -3.143 8.968 0.652 341 2HG1 VAL 64 2HG1 VAL 64 -3.620 8.715 2.333 342 3HG1 VAL 64 3HG1 VAL 64 -4.815 8.563 1.025 343 1HG2 VAL 64 1HG2 VAL 64 -4.096 11.025 -0.600 344 2HG2 VAL 64 2HG2 VAL 64 -5.736 10.586 -0.116 345 3HG2 VAL 64 3HG2 VAL 64 -5.086 12.192 0.288 346 H GLN 65 H GLN 65 -7.025 10.155 1.260 347 HA GLN 65 HA GLN 65 -7.373 7.615 2.659 348 1HB GLN 65 1HB GLN 65 -9.352 8.964 3.303 349 2HB GLN 65 2HB GLN 65 -9.649 9.388 1.616 350 1HG GLN 65 1HG GLN 65 -11.149 7.562 2.574 351 2HG GLN 65 2HG GLN 65 -10.345 7.184 1.046 352 1HE2 GLN 65 1HE2 GLN 65 -8.876 7.179 4.298 353 2HE2 GLN 65 2HE2 GLN 65 -8.319 5.534 4.170 354 H ILE 66 H ILE 66 -7.107 5.946 1.374 355 HA ILE 66 HA ILE 66 -7.664 6.188 -1.524 356 HB ILE 66 HB ILE 66 -5.446 4.833 -1.806 357 1HG1 ILE 66 1HG1 ILE 66 -3.632 6.090 -0.493 358 2HG1 ILE 66 2HG1 ILE 66 -4.801 6.384 0.740 359 1HG2 ILE 66 1HG2 ILE 66 -6.066 7.074 -2.828 360 2HG2 ILE 66 2HG2 ILE 66 -5.287 7.836 -1.426 361 3HG2 ILE 66 3HG2 ILE 66 -4.344 6.821 -2.539 362 1HD1 ILE 66 1HD1 ILE 66 -3.335 4.343 1.055 363 2HD1 ILE 66 2HD1 ILE 66 -5.069 4.005 1.103 364 3HD1 ILE 66 3HD1 ILE 66 -4.128 3.604 -0.348 365 H MET 67 H MET 67 -9.400 4.923 -1.457 366 HA MET 67 HA MET 67 -9.555 2.502 0.065 367 1HB MET 67 1HB MET 67 -11.394 4.121 -0.546 368 2HB MET 67 2HB MET 67 -11.382 3.437 -2.175 369 1HG MET 67 1HG MET 67 -11.693 1.136 -1.004 370 2HG MET 67 2HG MET 67 -12.051 2.082 0.449 371 1HE MET 67 1HE MET 67 -15.351 3.923 -0.581 372 2HE MET 67 2HE MET 67 -14.110 3.719 0.677 373 3HE MET 67 3HE MET 67 -13.715 4.564 -0.844 374 H TYR 68 H TYR 68 -8.156 0.843 -0.546 375 HA TYR 68 HA TYR 68 -7.635 0.223 -3.374 376 1HB TYR 68 1HB TYR 68 -6.806 -1.039 -0.740 377 2HB TYR 68 2HB TYR 68 -6.434 -1.776 -2.287 378 HD1 TYR 68 HD1 TYR 68 -5.081 0.334 0.162 379 HD2 TYR 68 HD2 TYR 68 -5.297 -0.243 -4.100 380 HE1 TYR 68 HE1 TYR 68 -2.791 1.233 -0.072 381 HE2 TYR 68 HE2 TYR 68 -3.026 0.743 -4.339 382 HH TYR 68 HH TYR 68 -1.071 1.778 -1.576 383 H ARG 69 H ARG 69 -7.892 -2.049 -4.179 384 HA ARG 69 HA ARG 69 -10.253 -3.481 -3.176 385 1HB ARG 69 1HB ARG 69 -11.349 -2.016 -4.631 386 2HB ARG 69 2HB ARG 69 -10.077 -2.050 -5.824 387 1HG ARG 69 1HG ARG 69 -10.611 -4.390 -6.436 388 2HG ARG 69 2HG ARG 69 -11.835 -4.458 -5.156 389 1HD ARG 69 1HD ARG 69 -11.880 -2.733 -7.682 390 2HD ARG 69 2HD ARG 69 -12.760 -4.207 -7.351 391 HE ARG 69 HE ARG 69 -14.185 -3.156 -5.799 392 1HH1 ARG 69 1HH1 ARG 69 -11.878 -0.778 -7.008 393 2HH1 ARG 69 2HH1 ARG 69 -12.731 0.579 -6.329 394 1HH2 ARG 69 1HH2 ARG 69 -15.232 -1.575 -4.930 395 2HH2 ARG 69 2HH2 ARG 69 -14.785 0.126 -5.075 396 H ALA 70 H ALA 70 -10.158 -5.536 -3.411 397 HA ALA 70 HA ALA 70 -8.700 -6.908 -5.564 398 1HB ALA 70 1HB ALA 70 -9.114 -7.872 -2.722 399 2HB ALA 70 2HB ALA 70 -8.379 -8.782 -4.055 400 3HB ALA 70 3HB ALA 70 -7.576 -7.339 -3.392 401 H LYS 71 H LYS 71 -10.145 -8.543 -6.524 402 HA LYS 71 HA LYS 71 -12.497 -9.341 -4.929 403 1HB LYS 71 1HB LYS 71 -12.758 -8.834 -7.924 404 2HB LYS 71 2HB LYS 71 -13.987 -9.424 -6.811 405 1HG LYS 71 1HG LYS 71 -13.870 -7.183 -5.636 406 2HG LYS 71 2HG LYS 71 -12.802 -6.626 -6.943 407 1HD LYS 71 1HD LYS 71 -14.478 -7.177 -8.648 408 2HD LYS 71 2HD LYS 71 -15.590 -7.809 -7.433 409 1HE LYS 71 1HE LYS 71 -14.704 -4.916 -7.773 410 2HE LYS 71 2HE LYS 71 -16.273 -5.584 -8.182 411 1HZ LYS 71 1HZ LYS 71 -15.278 -5.637 -5.393 412 2HZ LYS 71 2HZ LYS 71 -16.117 -4.404 -5.928 413 3HZ LYS 71 3HZ LYS 71 -16.804 -5.899 -5.947 414 H ASN 72 H ASN 72 -12.700 -11.618 -4.951 415 HA ASN 72 HA ASN 72 -10.431 -12.916 -6.201 416 1HB ASN 72 1HB ASN 72 -10.935 -13.403 -3.980 417 2HB ASN 72 2HB ASN 72 -12.591 -13.929 -4.357 418 1HD2 ASN 72 1HD2 ASN 72 -11.869 -15.849 -6.597 419 2HD2 ASN 72 2HD2 ASN 72 -10.959 -17.101 -5.797 420 H LEU 73 H LEU 73 -10.820 -12.486 -8.343 421 HA LEU 73 HA LEU 73 -12.835 -14.041 -9.807 422 1HB LEU 73 1HB LEU 73 -10.470 -12.315 -10.607 423 2HB LEU 73 2HB LEU 73 -11.296 -13.327 -11.781 424 HG LEU 73 HG LEU 73 -12.043 -11.014 -11.854 425 1HD1 LEU 73 1HD1 LEU 73 -13.484 -12.873 -12.651 426 2HD1 LEU 73 2HD1 LEU 73 -14.295 -12.909 -11.069 427 3HD1 LEU 73 3HD1 LEU 73 -14.401 -11.466 -12.088 428 1HD2 LEU 73 1HD2 LEU 73 -11.951 -10.487 -9.447 429 2HD2 LEU 73 2HD2 LEU 73 -13.495 -10.045 -10.189 430 3HD2 LEU 73 3HD2 LEU 73 -13.392 -11.492 -9.168 431 H ALA 74 H ALA 74 -12.291 -16.049 -8.689 432 HA ALA 74 HA ALA 74 -10.700 -17.611 -10.551 433 1HB ALA 74 1HB ALA 74 -10.155 -17.879 -7.558 434 2HB ALA 74 2HB ALA 74 -9.420 -18.827 -8.863 435 3HB ALA 74 3HB ALA 74 -9.059 -17.093 -8.706 436 H SER 75 H SER 75 -11.365 -19.926 -10.355 437 HA SER 75 HA SER 75 -14.215 -20.062 -9.582 438 1HB SER 75 1HB SER 75 -13.466 -20.860 -11.809 439 2HB SER 75 2HB SER 75 -12.501 -22.128 -11.004 440 HG SER 75 HG SER 75 -14.602 -22.666 -9.961 441 H THR 76 H THR 76 -11.328 -20.591 -7.951 442 HA THR 76 HA THR 76 -12.565 -22.420 -6.053 443 HB THR 76 HB THR 76 -9.946 -23.422 -6.337 444 HG1 THR 76 HG1 THR 76 -9.380 -22.869 -8.401 445 1HG2 THR 76 1HG2 THR 76 -11.041 -25.360 -7.387 446 2HG2 THR 76 2HG2 THR 76 -12.063 -24.729 -6.079 447 3HG2 THR 76 3HG2 THR 76 -12.457 -24.363 -7.770 448 HA PRO 77 HA PRO 77 -10.995 -19.787 -3.174 449 1HB PRO 77 1HB PRO 77 -10.182 -21.252 -0.994 450 2HB PRO 77 2HB PRO 77 -11.875 -21.145 -1.550 451 1HG PRO 77 1HG PRO 77 -9.862 -23.312 -2.205 452 2HG PRO 77 2HG PRO 77 -11.535 -23.516 -1.602 453 1HD PRO 77 1HD PRO 77 -10.965 -23.713 -4.233 454 2HD PRO 77 2HD PRO 77 -12.453 -22.874 -3.701 455 H THR 78 H THR 78 -9.261 -18.586 -2.504 456 HA THR 78 HA THR 78 -6.618 -19.302 -3.689 457 HB THR 78 HB THR 78 -6.396 -16.827 -3.881 458 HG1 THR 78 HG1 THR 78 -9.036 -16.607 -3.026 459 1HG2 THR 78 1HG2 THR 78 -9.044 -17.697 -4.997 460 2HG2 THR 78 2HG2 THR 78 -7.961 -16.378 -5.510 461 3HG2 THR 78 3HG2 THR 78 -7.456 -18.052 -5.716 462 H THR 79 H THR 79 -4.913 -17.545 -2.510 463 HA THR 79 HA THR 79 -5.533 -17.015 0.147 464 HB THR 79 HB THR 79 -4.575 -19.430 0.307 465 HG1 THR 79 HG1 THR 79 -4.883 -18.194 2.081 466 1HG2 THR 79 1HG2 THR 79 -2.185 -19.645 0.442 467 2HG2 THR 79 2HG2 THR 79 -2.605 -19.017 -1.168 468 3HG2 THR 79 3HG2 THR 79 -1.938 -17.930 0.072 469 H GLY 80 H GLY 80 -4.520 -15.118 0.635 470 1HA GLY 80 1HA GLY 80 -2.789 -13.931 -1.516 471 2HA GLY 80 2HA GLY 80 -4.136 -13.125 -0.742 472 H GLN 81 H GLN 81 -0.959 -14.582 -0.144 473 HA GLN 81 HA GLN 81 -0.846 -13.433 2.598 474 1HB GLN 81 1HB GLN 81 1.108 -14.898 2.915 475 2HB GLN 81 2HB GLN 81 -0.408 -15.710 2.557 476 1HG GLN 81 1HG GLN 81 1.251 -16.899 1.435 477 2HG GLN 81 2HG GLN 81 0.358 -16.065 0.181 478 1HE2 GLN 81 1HE2 GLN 81 1.514 -14.190 -0.912 479 2HE2 GLN 81 2HE2 GLN 81 3.262 -14.139 -0.793 480 H ALA 82 H ALA 82 -0.766 -11.538 0.517 481 HA ALA 82 HA ALA 82 1.884 -11.312 -0.581 482 1HB ALA 82 1HB ALA 82 -0.472 -9.395 -0.686 483 2HB ALA 82 2HB ALA 82 0.967 -9.367 -1.736 484 3HB ALA 82 3HB ALA 82 -0.168 -10.734 -1.815 485 H THR 83 H THR 83 3.154 -9.244 -0.545 486 HA THR 83 HA THR 83 2.846 -7.591 1.801 487 HB THR 83 HB THR 83 4.260 -9.540 2.603 488 HG1 THR 83 HG1 THR 83 5.474 -8.156 3.747 489 1HG2 THR 83 1HG2 THR 83 5.635 -9.797 0.475 490 2HG2 THR 83 2HG2 THR 83 6.425 -8.246 0.865 491 3HG2 THR 83 3HG2 THR 83 6.603 -9.628 1.953 492 H PHE 84 H PHE 84 4.933 -6.141 1.795 493 HA PHE 84 HA PHE 84 5.039 -4.865 -0.892 494 1HB PHE 84 1HB PHE 84 4.468 -2.714 0.437 495 2HB PHE 84 2HB PHE 84 3.182 -3.811 -0.013 496 HD1 PHE 84 HD1 PHE 84 5.537 -3.935 2.967 497 HD2 PHE 84 HD2 PHE 84 1.466 -3.644 1.559 498 HE1 PHE 84 HE1 PHE 84 4.843 -3.289 5.160 499 HE2 PHE 84 HE2 PHE 84 0.721 -3.288 3.879 500 HZ PHE 84 HZ PHE 84 2.382 -2.956 5.683 501 H ASN 85 H ASN 85 6.575 -3.186 -1.056 502 HA ASN 85 HA ASN 85 8.848 -3.160 0.926 503 1HB ASN 85 1HB ASN 85 9.568 -4.085 -1.150 504 2HB ASN 85 2HB ASN 85 8.494 -3.035 -2.036 505 1HD2 ASN 85 1HD2 ASN 85 11.185 -2.247 0.308 506 2HD2 ASN 85 2HD2 ASN 85 11.798 -0.993 -0.769 507 H VAL 86 H VAL 86 7.792 -1.610 2.179 508 HA VAL 86 HA VAL 86 6.535 0.635 0.952 509 HB VAL 86 HB VAL 86 7.048 0.345 3.888 510 1HG1 VAL 86 1HG1 VAL 86 4.665 1.353 3.810 511 2HG1 VAL 86 2HG1 VAL 86 5.964 2.466 3.359 512 3HG1 VAL 86 3HG1 VAL 86 4.941 1.721 2.121 513 1HG2 VAL 86 1HG2 VAL 86 4.968 -1.060 2.192 514 2HG2 VAL 86 2HG2 VAL 86 6.191 -1.768 3.280 515 3HG2 VAL 86 3HG2 VAL 86 4.849 -0.850 3.949 516 H THR 87 H THR 87 8.986 1.043 -0.080 517 HA THR 87 HA THR 87 9.922 3.485 1.143 518 HB THR 87 HB THR 87 10.706 1.830 2.734 519 HG1 THR 87 HG1 THR 87 13.070 2.432 2.452 520 1HG2 THR 87 1HG2 THR 87 12.405 0.705 0.517 521 2HG2 THR 87 2HG2 THR 87 12.473 0.258 2.235 522 3HG2 THR 87 3HG2 THR 87 10.994 -0.055 1.308 523 HA PRO 88 HA PRO 88 11.629 3.658 -3.025 524 1HB PRO 88 1HB PRO 88 13.428 5.734 -2.725 525 2HB PRO 88 2HB PRO 88 11.673 5.957 -2.923 526 1HG PRO 88 1HG PRO 88 13.270 6.145 -0.376 527 2HG PRO 88 2HG PRO 88 11.863 7.076 -0.890 528 1HD PRO 88 1HD PRO 88 11.755 4.934 0.856 529 2HD PRO 88 2HD PRO 88 10.390 5.458 -0.136 530 H MET 89 H MET 89 13.462 3.704 -0.024 531 HA MET 89 HA MET 89 14.946 1.446 -0.280 532 1HB MET 89 1HB MET 89 17.282 2.336 -0.636 533 2HB MET 89 2HB MET 89 16.278 2.233 -2.061 534 1HG MET 89 1HG MET 89 15.794 4.817 -1.563 535 2HG MET 89 2HG MET 89 17.274 4.669 -0.609 536 1HE MET 89 1HE MET 89 15.682 4.641 -4.162 537 2HE MET 89 2HE MET 89 17.085 4.284 -5.195 538 3HE MET 89 3HE MET 89 16.394 3.008 -4.175 539 H ALA 90 H ALA 90 15.774 4.789 0.615 540 HA ALA 90 HA ALA 90 17.110 4.103 2.973 541 1HB ALA 90 1HB ALA 90 17.472 6.200 1.699 542 2HB ALA 90 2HB ALA 90 15.837 6.757 2.158 543 3HB ALA 90 3HB ALA 90 17.072 6.526 3.401 544 H ALA 91 H ALA 91 13.845 5.436 2.525 545 HA ALA 91 HA ALA 91 13.608 6.143 5.300 546 1HB ALA 91 1HB ALA 91 12.683 7.527 3.592 547 2HB ALA 91 2HB ALA 91 11.631 6.238 2.987 548 3HB ALA 91 3HB ALA 91 11.349 6.934 4.602 549 H GLY 92 H GLY 92 10.784 4.641 3.904 550 1HA GLY 92 1HA GLY 92 9.406 3.031 4.725 551 2HA GLY 92 2HA GLY 92 10.842 2.157 5.255 552 H ALA 93 H ALA 93 11.827 3.443 7.353 553 HA ALA 93 HA ALA 93 10.244 3.040 9.550 554 1HB ALA 93 1HB ALA 93 11.826 4.527 10.755 555 2HB ALA 93 2HB ALA 93 12.660 3.412 9.656 556 3HB ALA 93 3HB ALA 93 12.449 5.114 9.200 557 H TYR 94 H TYR 94 10.758 6.129 7.875 558 HA TYR 94 HA TYR 94 8.903 7.625 9.449 559 1HB TYR 94 1HB TYR 94 10.026 8.370 6.738 560 2HB TYR 94 2HB TYR 94 9.503 9.445 8.034 561 HD1 TYR 94 HD1 TYR 94 12.316 7.753 6.579 562 HD2 TYR 94 HD2 TYR 94 10.791 9.179 10.345 563 HE1 TYR 94 HE1 TYR 94 14.494 7.248 7.650 564 HE2 TYR 94 HE2 TYR 94 12.980 8.708 11.401 565 HH TYR 94 HH TYR 94 15.708 7.175 9.637 566 H PHE 95 H PHE 95 7.971 5.181 7.442 567 HA PHE 95 HA PHE 95 5.907 6.568 5.956 568 1HB PHE 95 1HB PHE 95 6.692 4.282 5.188 569 2HB PHE 95 2HB PHE 95 6.194 3.639 6.741 570 HD1 PHE 95 HD1 PHE 95 4.504 2.068 6.135 571 HD2 PHE 95 HD2 PHE 95 4.225 6.125 4.669 572 HE1 PHE 95 HE1 PHE 95 2.253 1.623 5.171 573 HE2 PHE 95 HE2 PHE 95 1.853 5.793 4.248 574 HZ PHE 95 HZ PHE 95 0.938 3.524 4.182 575 H ASN 96 H ASN 96 3.834 7.088 6.653 576 HA ASN 96 HA ASN 96 3.309 6.394 9.389 577 1HB ASN 96 1HB ASN 96 2.107 8.400 7.569 578 2HB ASN 96 2HB ASN 96 1.016 7.624 8.699 579 1HD2 ASN 96 1HD2 ASN 96 3.844 9.761 8.488 580 2HD2 ASN 96 2HD2 ASN 96 3.833 10.160 10.203 581 H LYS 97 H LYS 97 2.958 4.276 9.524 582 HA LYS 97 HA LYS 97 0.295 3.318 8.529 583 1HB LYS 97 1HB LYS 97 1.203 1.010 8.833 584 2HB LYS 97 2HB LYS 97 1.959 1.892 7.522 585 1HG LYS 97 1HG LYS 97 3.979 2.258 8.735 586 2HG LYS 97 2HG LYS 97 3.216 1.879 10.286 587 1HD LYS 97 1HD LYS 97 2.835 -0.475 9.500 588 2HD LYS 97 2HD LYS 97 3.796 -0.097 8.050 589 1HE LYS 97 1HE LYS 97 5.723 0.523 9.556 590 2HE LYS 97 2HE LYS 97 4.713 0.149 10.968 591 1HZ LYS 97 1HZ LYS 97 5.584 -1.775 8.926 592 2HZ LYS 97 2HZ LYS 97 6.110 -1.685 10.483 593 3HZ LYS 97 3HZ LYS 97 4.556 -2.125 10.159 594 H VAL 98 H VAL 98 -0.503 1.571 10.083 595 HA VAL 98 HA VAL 98 -0.195 2.306 12.929 596 HB VAL 98 HB VAL 98 -1.930 0.616 13.304 597 1HG1 VAL 98 1HG1 VAL 98 -2.555 2.943 12.801 598 2HG1 VAL 98 2HG1 VAL 98 -2.698 2.538 11.077 599 3HG1 VAL 98 3HG1 VAL 98 -3.775 1.779 12.261 600 1HG2 VAL 98 1HG2 VAL 98 -1.400 -0.967 11.421 601 2HG2 VAL 98 2HG2 VAL 98 -3.099 -0.490 11.481 602 3HG2 VAL 98 3HG2 VAL 98 -2.029 0.229 10.272 603 H GLN 99 H GLN 99 -0.433 -0.574 13.746 604 HA GLN 99 HA GLN 99 2.431 -1.186 13.756 605 1HB GLN 99 1HB GLN 99 0.024 -2.627 14.946 606 2HB GLN 99 2HB GLN 99 1.719 -3.043 15.242 607 1HG GLN 99 1HG GLN 99 2.111 -0.788 16.219 608 2HG GLN 99 2HG GLN 99 0.405 -0.389 15.970 609 1HE2 GLN 99 1HE2 GLN 99 2.479 -2.920 17.548 610 2HE2 GLN 99 2HE2 GLN 99 1.383 -3.129 18.902 611 H CYS 100 H CYS 100 2.832 -3.713 13.545 612 HA CYS 100 HA CYS 100 3.069 -5.519 12.261 613 1HB CYS 100 1HB CYS 100 0.484 -5.494 12.782 614 2HB CYS 100 2HB CYS 100 0.326 -5.179 11.040 615 HG CYS 100 HG CYS 100 -0.021 -7.692 11.374 616 H PHE 101 H PHE 101 2.128 -6.157 9.530 617 HA PHE 101 HA PHE 101 2.663 -4.142 7.689 618 1HB PHE 101 1HB PHE 101 4.872 -4.899 6.872 619 2HB PHE 101 2HB PHE 101 4.983 -4.185 8.454 620 HD1 PHE 101 HD1 PHE 101 5.719 -7.068 6.437 621 HD2 PHE 101 HD2 PHE 101 5.297 -5.694 10.507 622 HE1 PHE 101 HE1 PHE 101 7.009 -9.020 7.239 623 HE2 PHE 101 HE2 PHE 101 6.578 -7.653 11.296 624 HZ PHE 101 HZ PHE 101 7.436 -9.323 9.669 625 H CYS 102 H CYS 102 3.314 -5.504 5.516 626 HA CYS 102 HA CYS 102 2.792 -7.029 3.999 627 1HB CYS 102 1HB CYS 102 1.600 -8.844 6.152 628 2HB CYS 102 2HB CYS 102 1.892 -9.243 4.464 629 HG CYS 102 HG CYS 102 3.595 -10.497 5.825 630 H PHE 103 H PHE 103 0.824 -8.071 2.959 631 HA PHE 103 HA PHE 103 -1.788 -7.012 3.888 632 1HB PHE 103 1HB PHE 103 -0.824 -7.166 1.003 633 2HB PHE 103 2HB PHE 103 -2.485 -6.903 1.502 634 HD1 PHE 103 HD1 PHE 103 -0.723 -5.170 -0.348 635 HD2 PHE 103 HD2 PHE 103 -1.999 -4.841 3.759 636 HE1 PHE 103 HE1 PHE 103 -0.788 -2.716 -0.562 637 HE2 PHE 103 HE2 PHE 103 -2.084 -2.396 3.527 638 HZ PHE 103 HZ PHE 103 -1.461 -1.313 1.376 639 H THR 104 H THR 104 -1.313 -9.131 5.035 640 HA THR 104 HA THR 104 -1.649 -11.555 3.457 641 HB THR 104 HB THR 104 -2.004 -12.504 5.802 642 HG1 THR 104 HG1 THR 104 -2.732 -10.539 6.685 643 1HG2 THR 104 1HG2 THR 104 0.232 -12.531 4.753 644 2HG2 THR 104 2HG2 THR 104 0.534 -10.886 5.342 645 3HG2 THR 104 3HG2 THR 104 0.343 -12.217 6.497 646 H GLU 105 H GLU 105 -3.526 -10.780 2.245 647 HA GLU 105 HA GLU 105 -6.004 -10.069 3.622 648 1HB GLU 105 1HB GLU 105 -5.232 -10.562 0.736 649 2HB GLU 105 2HB GLU 105 -6.849 -10.019 1.213 650 1HG GLU 105 1HG GLU 105 -6.005 -7.956 2.103 651 2HG GLU 105 2HG GLU 105 -4.328 -8.495 1.992 652 H THR 106 H THR 106 -5.205 -12.502 4.588 653 HA THR 106 HA THR 106 -5.634 -14.745 4.782 654 HB THR 106 HB THR 106 -7.344 -13.533 6.014 655 HG1 THR 106 HG1 THR 106 -7.432 -15.694 6.246 656 1HG2 THR 106 1HG2 THR 106 -8.616 -12.329 4.359 657 2HG2 THR 106 2HG2 THR 106 -9.126 -13.828 3.558 658 3HG2 THR 106 3HG2 THR 106 -9.686 -13.455 5.194 659 H THR 107 H THR 107 -8.198 -15.868 3.773 660 HA THR 107 HA THR 107 -7.433 -16.641 0.996 661 HB THR 107 HB THR 107 -8.048 -18.218 3.477 662 HG1 THR 107 HG1 THR 107 -6.712 -18.948 1.114 663 1HG2 THR 107 1HG2 THR 107 -8.793 -20.188 2.101 664 2HG2 THR 107 2HG2 THR 107 -10.005 -18.911 2.241 665 3HG2 THR 107 3HG2 THR 107 -9.084 -19.087 0.736 666 H LEU 108 H LEU 108 -8.952 -16.145 -0.431 667 HA LEU 108 HA LEU 108 -11.713 -15.548 0.547 668 1HB LEU 108 1HB LEU 108 -10.240 -14.551 -1.897 669 2HB LEU 108 2HB LEU 108 -11.943 -14.262 -1.575 670 HG LEU 108 HG LEU 108 -9.571 -13.281 0.046 671 1HD1 LEU 108 1HD1 LEU 108 -10.073 -12.264 -2.276 672 2HD1 LEU 108 2HD1 LEU 108 -11.550 -11.614 -1.552 673 3HD1 LEU 108 3HD1 LEU 108 -9.940 -11.159 -0.935 674 1HD2 LEU 108 1HD2 LEU 108 -11.207 -11.874 1.273 675 2HD2 LEU 108 2HD2 LEU 108 -12.538 -12.727 0.468 676 3HD2 LEU 108 3HD2 LEU 108 -11.450 -13.589 1.582 677 H GLU 109 H GLU 109 -13.363 -16.316 -0.647 678 HA GLU 109 HA GLU 109 -12.897 -18.894 -1.969 679 1HB GLU 109 1HB GLU 109 -15.392 -17.588 -0.756 680 2HB GLU 109 2HB GLU 109 -15.305 -19.228 -1.346 681 1HG GLU 109 1HG GLU 109 -13.245 -19.484 0.260 682 2HG GLU 109 2HG GLU 109 -13.960 -18.083 1.077 683 HA PRO 110 HA PRO 110 -13.464 -17.514 -5.944 684 1HB PRO 110 1HB PRO 110 -15.024 -19.304 -7.273 685 2HB PRO 110 2HB PRO 110 -13.457 -19.671 -6.496 686 1HG PRO 110 1HG PRO 110 -16.198 -20.105 -5.301 687 2HG PRO 110 2HG PRO 110 -14.902 -21.325 -5.502 688 1HD PRO 110 1HD PRO 110 -15.216 -19.938 -3.214 689 2HD PRO 110 2HD PRO 110 -13.569 -20.287 -3.807 690 H GLY 111 H GLY 111 -14.454 -15.546 -5.187 691 1HA GLY 111 1HA GLY 111 -16.438 -14.455 -6.777 692 2HA GLY 111 2HA GLY 111 -17.320 -15.161 -5.408 693 H GLU 112 H GLU 112 -15.002 -14.640 -3.499 694 HA GLU 112 HA GLU 112 -16.577 -12.573 -2.570 695 1HB GLU 112 1HB GLU 112 -14.004 -13.500 -1.296 696 2HB GLU 112 2HB GLU 112 -15.432 -12.805 -0.525 697 1HG GLU 112 1HG GLU 112 -15.171 -15.540 -1.680 698 2HG GLU 112 2HG GLU 112 -15.645 -15.036 -0.059 699 H GLU 113 H GLU 113 -16.403 -10.443 -2.294 700 HA GLU 113 HA GLU 113 -14.333 -8.951 -3.723 701 1HB GLU 113 1HB GLU 113 -16.960 -8.218 -2.375 702 2HB GLU 113 2HB GLU 113 -15.866 -7.034 -3.112 703 1HG GLU 113 1HG GLU 113 -16.034 -7.873 -5.154 704 2HG GLU 113 2HG GLU 113 -16.863 -9.337 -4.674 705 H MET 114 H MET 114 -12.727 -7.733 -2.791 706 HA MET 114 HA MET 114 -12.784 -7.181 0.121 707 1HB MET 114 1HB MET 114 -10.874 -8.784 -1.579 708 2HB MET 114 2HB MET 114 -10.097 -7.595 -0.525 709 1HG MET 114 1HG MET 114 -12.121 -9.618 0.461 710 2HG MET 114 2HG MET 114 -10.358 -9.730 0.557 711 1HE MET 114 1HE MET 114 -12.284 -10.117 3.047 712 2HE MET 114 2HE MET 114 -10.508 -10.272 3.132 713 3HE MET 114 3HE MET 114 -11.369 -9.233 4.292 714 H GLU 115 H GLU 115 -13.591 -5.068 -0.482 715 HA GLU 115 HA GLU 115 -11.352 -3.324 -1.328 716 1HB GLU 115 1HB GLU 115 -13.017 -1.799 -2.407 717 2HB GLU 115 2HB GLU 115 -12.672 -3.323 -3.223 718 1HG GLU 115 1HG GLU 115 -14.970 -3.881 -1.642 719 2HG GLU 115 2HG GLU 115 -15.243 -2.295 -2.356 720 H MET 116 H MET 116 -10.868 -1.708 -0.021 721 HA MET 116 HA MET 116 -12.622 -1.161 2.283 722 1HB MET 116 1HB MET 116 -9.894 -2.519 2.527 723 2HB MET 116 2HB MET 116 -10.816 -1.829 3.866 724 1HG MET 116 1HG MET 116 -12.691 -3.444 3.317 725 2HG MET 116 2HG MET 116 -11.618 -4.187 2.122 726 1HE MET 116 1HE MET 116 -10.667 -2.934 5.829 727 2HE MET 116 2HE MET 116 -12.323 -3.594 5.912 728 3HE MET 116 3HE MET 116 -10.973 -4.460 6.679 729 HA PRO 117 HA PRO 117 -10.348 2.673 1.969 730 1HB PRO 117 1HB PRO 117 -10.760 3.782 4.422 731 2HB PRO 117 2HB PRO 117 -11.998 3.691 3.136 732 1HG PRO 117 1HG PRO 117 -11.656 1.868 5.519 733 2HG PRO 117 2HG PRO 117 -13.148 2.580 4.816 734 1HD PRO 117 1HD PRO 117 -12.326 0.003 4.314 735 2HD PRO 117 2HD PRO 117 -13.256 0.978 3.135 736 H VAL 118 H VAL 118 -8.338 3.496 2.519 737 HA VAL 118 HA VAL 118 -6.753 2.345 4.703 738 HB VAL 118 HB VAL 118 -6.023 2.045 1.752 739 1HG1 VAL 118 1HG1 VAL 118 -4.054 3.008 2.843 740 2HG1 VAL 118 2HG1 VAL 118 -4.168 1.819 4.156 741 3HG1 VAL 118 3HG1 VAL 118 -3.779 1.309 2.497 742 1HG2 VAL 118 1HG2 VAL 118 -6.186 0.062 4.046 743 2HG2 VAL 118 2HG2 VAL 118 -7.223 0.132 2.601 744 3HG2 VAL 118 3HG2 VAL 118 -5.520 -0.303 2.443 745 H VAL 119 H VAL 119 -5.072 3.842 5.267 746 HA VAL 119 HA VAL 119 -5.248 6.505 3.913 747 HB VAL 119 HB VAL 119 -4.615 7.517 5.950 748 1HG1 VAL 119 1HG1 VAL 119 -6.972 5.672 6.506 749 2HG1 VAL 119 2HG1 VAL 119 -6.620 7.219 7.296 750 3HG1 VAL 119 3HG1 VAL 119 -7.019 7.187 5.574 751 1HG2 VAL 119 1HG2 VAL 119 -4.448 6.289 8.095 752 2HG2 VAL 119 2HG2 VAL 119 -4.713 4.750 7.270 753 3HG2 VAL 119 3HG2 VAL 119 -3.233 5.688 6.971 754 H PHE 120 H PHE 120 -3.146 7.696 4.022 755 HA PHE 120 HA PHE 120 -0.735 6.115 4.376 756 1HB PHE 120 1HB PHE 120 -1.612 5.518 2.047 757 2HB PHE 120 2HB PHE 120 -1.445 7.212 1.599 758 HD1 PHE 120 HD1 PHE 120 1.018 8.240 1.992 759 HD2 PHE 120 HD2 PHE 120 0.127 4.045 1.503 760 HE1 PHE 120 HE1 PHE 120 3.432 7.716 2.016 761 HE2 PHE 120 HE2 PHE 120 2.549 3.565 1.344 762 HZ PHE 120 HZ PHE 120 4.189 5.375 1.782 763 H PHE 121 H PHE 121 0.749 7.565 5.253 764 HA PHE 121 HA PHE 121 1.067 10.079 3.900 765 1HB PHE 121 1HB PHE 121 1.147 11.291 6.128 766 2HB PHE 121 2HB PHE 121 -0.410 11.026 5.367 767 HD1 PHE 121 HD1 PHE 121 1.078 11.173 8.478 768 HD2 PHE 121 HD2 PHE 121 -1.775 8.845 6.235 769 HE1 PHE 121 HE1 PHE 121 0.083 10.335 10.569 770 HE2 PHE 121 HE2 PHE 121 -2.572 7.815 8.324 771 HZ PHE 121 HZ PHE 121 -1.623 8.512 10.489 772 H VAL 122 H VAL 122 3.064 11.226 4.719 773 HA VAL 122 HA VAL 122 5.141 9.273 5.661 774 HB VAL 122 HB VAL 122 5.559 11.765 3.956 775 1HG1 VAL 122 1HG1 VAL 122 7.729 10.669 3.475 776 2HG1 VAL 122 2HG1 VAL 122 7.539 11.016 5.193 777 3HG1 VAL 122 3HG1 VAL 122 7.311 9.359 4.607 778 1HG2 VAL 122 1HG2 VAL 122 4.905 8.938 3.150 779 2HG2 VAL 122 2HG2 VAL 122 4.263 10.456 2.508 780 3HG2 VAL 122 3HG2 VAL 122 5.921 9.961 2.129 781 H ASP 123 H ASP 123 6.260 9.840 7.553 782 HA ASP 123 HA ASP 123 5.303 12.235 8.889 783 1HB ASP 123 1HB ASP 123 6.021 9.780 9.853 784 2HB ASP 123 2HB ASP 123 7.503 10.686 10.175 785 HA PRO 124 HA PRO 124 8.370 14.824 7.162 786 1HB PRO 124 1HB PRO 124 8.695 16.757 9.255 787 2HB PRO 124 2HB PRO 124 7.581 16.776 7.891 788 1HG PRO 124 1HG PRO 124 7.031 15.948 10.689 789 2HG PRO 124 2HG PRO 124 5.939 16.684 9.469 790 1HD PRO 124 1HD PRO 124 5.838 14.054 10.166 791 2HD PRO 124 2HD PRO 124 5.425 14.619 8.534 792 H GLU 125 H GLU 125 9.199 13.311 10.282 793 HA GLU 125 HA GLU 125 11.834 14.145 10.432 794 1HB GLU 125 1HB GLU 125 10.468 12.966 12.173 795 2HB GLU 125 2HB GLU 125 10.642 11.455 11.252 796 1HG GLU 125 1HG GLU 125 12.983 11.436 11.567 797 2HG GLU 125 2HG GLU 125 12.996 13.143 12.046 798 H ILE 126 H ILE 126 10.413 12.154 7.920 799 HA ILE 126 HA ILE 126 12.645 10.747 7.048 800 HB ILE 126 HB ILE 126 10.365 10.848 6.028 801 1HG1 ILE 126 1HG1 ILE 126 12.620 11.142 3.995 802 2HG1 ILE 126 2HG1 ILE 126 12.447 9.730 5.040 803 1HG2 ILE 126 1HG2 ILE 126 9.825 12.460 4.329 804 2HG2 ILE 126 2HG2 ILE 126 10.315 13.387 5.749 805 3HG2 ILE 126 3HG2 ILE 126 11.445 13.168 4.385 806 1HD1 ILE 126 1HD1 ILE 126 10.158 9.369 4.240 807 2HD1 ILE 126 2HD1 ILE 126 10.368 10.682 3.054 808 3HD1 ILE 126 3HD1 ILE 126 11.378 9.230 2.954 809 H VAL 127 H VAL 127 12.134 14.319 6.897 810 HA VAL 127 HA VAL 127 14.859 14.594 5.694 811 HB VAL 127 HB VAL 127 14.358 17.030 5.703 812 1HG1 VAL 127 1HG1 VAL 127 14.293 15.643 3.694 813 2HG1 VAL 127 2HG1 VAL 127 12.600 15.213 4.016 814 3HG1 VAL 127 3HG1 VAL 127 13.038 16.892 3.643 815 1HG2 VAL 127 1HG2 VAL 127 12.388 16.955 7.316 816 2HG2 VAL 127 2HG2 VAL 127 12.109 17.833 5.803 817 3HG2 VAL 127 3HG2 VAL 127 11.445 16.207 6.001 818 H LYS 128 H LYS 128 15.325 13.344 7.787 819 HA LYS 128 HA LYS 128 16.796 15.420 9.327 820 1HB LYS 128 1HB LYS 128 15.252 13.166 10.584 821 2HB LYS 128 2HB LYS 128 16.811 13.670 11.256 822 1HG LYS 128 1HG LYS 128 15.780 16.053 11.334 823 2HG LYS 128 2HG LYS 128 14.238 15.221 11.033 824 1HD LYS 128 1HD LYS 128 14.973 13.608 12.952 825 2HD LYS 128 2HD LYS 128 16.231 14.786 13.323 826 1HE LYS 128 1HE LYS 128 14.552 16.477 13.895 827 2HE LYS 128 2HE LYS 128 13.250 15.436 13.285 828 1HZ LYS 128 1HZ LYS 128 14.927 14.734 15.628 829 2HZ LYS 128 2HZ LYS 128 13.378 15.286 15.672 830 3HZ LYS 128 3HZ LYS 128 13.711 13.857 14.961 831 HA PRO 129 HA PRO 129 19.712 11.982 9.702 832 1HB PRO 129 1HB PRO 129 19.315 9.334 9.269 833 2HB PRO 129 2HB PRO 129 18.519 10.189 10.620 834 1HG PRO 129 1HG PRO 129 17.360 9.699 7.845 835 2HG PRO 129 2HG PRO 129 16.665 9.231 9.417 836 1HD PRO 129 1HD PRO 129 15.893 11.498 8.273 837 2HD PRO 129 2HD PRO 129 16.243 11.412 10.025 838 H VAL 130 H VAL 130 21.449 10.852 8.691 839 HA VAL 130 HA VAL 130 22.100 11.565 6.081 840 HB VAL 130 HB VAL 130 23.188 9.369 7.892 841 1HG1 VAL 130 1HG1 VAL 130 25.278 9.654 6.561 842 2HG1 VAL 130 2HG1 VAL 130 23.953 8.979 5.606 843 3HG1 VAL 130 3HG1 VAL 130 24.385 10.697 5.429 844 1HG2 VAL 130 1HG2 VAL 130 24.923 11.074 8.434 845 2HG2 VAL 130 2HG2 VAL 130 24.055 12.267 7.450 846 3HG2 VAL 130 3HG2 VAL 130 23.322 11.623 8.933 847 H GLU 131 H GLU 131 20.534 8.664 7.350 848 HA GLU 131 HA GLU 131 20.499 6.791 5.325 849 1HB GLU 131 1HB GLU 131 18.072 7.849 6.837 850 2HB GLU 131 2HB GLU 131 18.202 6.273 6.072 851 1HG GLU 131 1HG GLU 131 19.852 5.560 7.714 852 2HG GLU 131 2HG GLU 131 19.878 7.154 8.476 853 H THR 132 H THR 132 18.323 9.627 5.541 854 HA THR 132 HA THR 132 17.224 8.881 2.935 855 HB THR 132 HB THR 132 15.401 10.513 3.883 856 HG1 THR 132 HG1 THR 132 15.715 11.098 5.987 857 1HG2 THR 132 1HG2 THR 132 15.085 8.095 4.049 858 2HG2 THR 132 2HG2 THR 132 16.120 8.019 5.490 859 3HG2 THR 132 3HG2 THR 132 14.582 8.887 5.553 860 H GLN 133 H GLN 133 18.257 11.703 4.779 861 HA GLN 133 HA GLN 133 18.546 13.893 4.085 862 1HB GLN 133 1HB GLN 133 20.655 12.262 4.468 863 2HB GLN 133 2HB GLN 133 20.993 12.642 2.808 864 1HG GLN 133 1HG GLN 133 22.201 14.163 4.250 865 2HG GLN 133 2HG GLN 133 20.978 15.076 3.356 866 1HE2 GLN 133 1HE2 GLN 133 19.743 13.118 6.014 867 2HE2 GLN 133 2HE2 GLN 133 19.573 14.408 7.160 868 H GLY 134 H GLY 134 16.692 13.564 2.338 869 1HA GLY 134 1HA GLY 134 16.658 15.244 0.344 870 2HA GLY 134 2HA GLY 134 17.765 14.083 -0.408 871 H ILE 135 H ILE 135 16.605 11.697 0.739 872 HA ILE 135 HA ILE 135 14.619 10.987 -1.104 873 HB ILE 135 HB ILE 135 15.306 9.952 1.634 874 1HG1 ILE 135 1HG1 ILE 135 16.924 9.623 -0.293 875 2HG1 ILE 135 2HG1 ILE 135 16.303 8.144 0.438 876 1HG2 ILE 135 1HG2 ILE 135 13.027 9.352 1.485 877 2HG2 ILE 135 2HG2 ILE 135 13.161 8.897 -0.220 878 3HG2 ILE 135 3HG2 ILE 135 13.942 7.916 1.048 879 1HD1 ILE 135 1HD1 ILE 135 15.288 9.280 -2.191 880 2HD1 ILE 135 2HD1 ILE 135 16.418 7.933 -1.980 881 3HD1 ILE 135 3HD1 ILE 135 14.756 7.779 -1.401 882 H LYS 136 H LYS 136 12.558 11.532 -1.343 883 HA LYS 136 HA LYS 136 10.819 11.869 0.896 884 1HB LYS 136 1HB LYS 136 10.017 14.186 0.326 885 2HB LYS 136 2HB LYS 136 11.565 14.008 1.118 886 1HG LYS 136 1HG LYS 136 12.322 15.406 -0.376 887 2HG LYS 136 2HG LYS 136 12.460 14.012 -1.416 888 1HD LYS 136 1HD LYS 136 11.250 15.078 -2.914 889 2HD LYS 136 2HD LYS 136 9.841 14.757 -1.920 890 1HE LYS 136 1HE LYS 136 11.554 17.291 -1.613 891 2HE LYS 136 2HE LYS 136 10.227 17.152 -2.769 892 1HZ LYS 136 1HZ LYS 136 9.325 18.155 -0.873 893 2HZ LYS 136 2HZ LYS 136 8.724 16.687 -0.892 894 3HZ LYS 136 3HZ LYS 136 9.908 17.147 0.183 895 H THR 137 H THR 137 10.792 9.850 -0.833 896 HA THR 137 HA THR 137 8.274 10.245 -2.232 897 HB THR 137 HB THR 137 9.508 8.856 -4.175 898 HG1 THR 137 HG1 THR 137 11.610 9.670 -4.476 899 1HG2 THR 137 1HG2 THR 137 9.682 10.908 -5.458 900 2HG2 THR 137 2HG2 THR 137 8.257 10.973 -4.397 901 3HG2 THR 137 3HG2 THR 137 9.720 11.882 -3.971 902 H LEU 138 H LEU 138 7.325 8.980 -0.767 903 HA LEU 138 HA LEU 138 8.479 6.340 -0.171 904 1HB LEU 138 1HB LEU 138 6.521 8.106 0.976 905 2HB LEU 138 2HB LEU 138 5.838 6.472 0.822 906 HG LEU 138 HG LEU 138 7.968 5.654 1.870 907 1HD1 LEU 138 1HD1 LEU 138 9.416 7.592 1.618 908 2HD1 LEU 138 2HD1 LEU 138 8.350 8.533 2.685 909 3HD1 LEU 138 3HD1 LEU 138 9.251 7.138 3.324 910 1HD2 LEU 138 1HD2 LEU 138 6.175 7.332 3.708 911 2HD2 LEU 138 2HD2 LEU 138 5.972 5.634 3.263 912 3HD2 LEU 138 3HD2 LEU 138 7.345 6.154 4.236 913 H THR 139 H THR 139 7.145 4.385 -0.420 914 HA THR 139 HA THR 139 5.398 4.298 -2.625 915 HB THR 139 HB THR 139 7.472 4.383 -3.947 916 HG1 THR 139 HG1 THR 139 6.024 2.904 -4.769 917 1HG2 THR 139 1HG2 THR 139 8.372 2.055 -2.240 918 2HG2 THR 139 2HG2 THR 139 9.203 2.671 -3.684 919 3HG2 THR 139 3HG2 THR 139 9.035 3.718 -2.253 920 H LEU 140 H LEU 140 5.278 1.753 -3.058 921 HA LEU 140 HA LEU 140 5.949 0.120 -0.904 922 1HB LEU 140 1HB LEU 140 3.526 -0.834 -0.621 923 2HB LEU 140 2HB LEU 140 4.288 0.325 0.455 924 HG LEU 140 HG LEU 140 3.139 2.191 -0.583 925 1HD1 LEU 140 1HD1 LEU 140 1.392 1.707 -2.318 926 2HD1 LEU 140 2HD1 LEU 140 3.033 1.270 -2.867 927 3HD1 LEU 140 3HD1 LEU 140 1.938 0.006 -2.319 928 1HD2 LEU 140 1HD2 LEU 140 0.879 1.532 0.205 929 2HD2 LEU 140 2HD2 LEU 140 1.366 -0.184 0.125 930 3HD2 LEU 140 3HD2 LEU 140 2.160 0.907 1.276 931 H SER 141 H SER 141 7.130 -0.908 -2.570 932 HA SER 141 HA SER 141 5.667 -1.754 -4.960 933 1HB SER 141 1HB SER 141 8.067 -1.167 -5.044 934 2HB SER 141 2HB SER 141 8.437 -2.644 -4.139 935 HG SER 141 HG SER 141 7.159 -2.442 -6.668 936 H TYR 142 H TYR 142 4.082 -3.211 -4.728 937 HA TYR 142 HA TYR 142 4.683 -5.661 -3.092 938 1HB TYR 142 1HB TYR 142 2.267 -6.006 -2.889 939 2HB TYR 142 2HB TYR 142 2.917 -4.661 -1.994 940 HD1 TYR 142 HD1 TYR 142 2.089 -2.466 -2.222 941 HD2 TYR 142 HD2 TYR 142 0.824 -5.542 -4.965 942 HE1 TYR 142 HE1 TYR 142 0.036 -1.178 -2.727 943 HE2 TYR 142 HE2 TYR 142 -1.291 -4.319 -5.350 944 HH TYR 142 HH TYR 142 -1.907 -1.116 -3.858 945 H THR 143 H THR 143 4.523 -7.565 -3.968 946 HA THR 143 HA THR 143 3.729 -7.830 -6.833 947 HB THR 143 HB THR 143 5.958 -9.340 -5.410 948 HG1 THR 143 HG1 THR 143 6.376 -7.065 -5.843 949 1HG2 THR 143 1HG2 THR 143 6.517 -10.072 -7.692 950 2HG2 THR 143 2HG2 THR 143 4.845 -10.535 -7.313 951 3HG2 THR 143 3HG2 THR 143 5.164 -9.134 -8.356 952 H PHE 144 H PHE 144 1.705 -8.350 -6.341 953 HA PHE 144 HA PHE 144 0.933 -10.431 -4.401 954 1HB PHE 144 1HB PHE 144 -0.401 -8.708 -6.488 955 2HB PHE 144 2HB PHE 144 -1.204 -10.159 -5.971 956 HD1 PHE 144 HD1 PHE 144 0.873 -7.676 -4.014 957 HD2 PHE 144 HD2 PHE 144 -3.033 -9.410 -4.625 958 HE1 PHE 144 HE1 PHE 144 0.029 -6.497 -2.029 959 HE2 PHE 144 HE2 PHE 144 -3.782 -8.431 -2.474 960 HZ PHE 144 HZ PHE 144 -2.322 -6.887 -1.242 961 H TYR 145 H TYR 145 2.075 -12.318 -4.855 962 HA TYR 145 HA TYR 145 1.078 -13.885 -7.131 963 1HB TYR 145 1HB TYR 145 3.169 -14.319 -8.129 964 2HB TYR 145 2HB TYR 145 2.909 -12.580 -8.069 965 HD1 TYR 145 HD1 TYR 145 3.993 -13.030 -4.800 966 HD2 TYR 145 HD2 TYR 145 5.441 -13.455 -8.850 967 HE1 TYR 145 HE1 TYR 145 6.273 -12.569 -4.036 968 HE2 TYR 145 HE2 TYR 145 7.743 -13.045 -8.053 969 HH TYR 145 HH TYR 145 9.083 -12.557 -6.238 970 HA PRO 146 HA PRO 146 2.262 -16.762 -3.684 971 1HB PRO 146 1HB PRO 146 -0.079 -17.375 -2.458 972 2HB PRO 146 2HB PRO 146 0.930 -15.968 -2.068 973 1HG PRO 146 1HG PRO 146 -1.570 -15.987 -3.755 974 2HG PRO 146 2HG PRO 146 -1.030 -14.826 -2.519 975 1HD PRO 146 1HD PRO 146 -0.684 -14.663 -5.310 976 2HD PRO 146 2HD PRO 146 0.223 -13.676 -4.106 977 H ARG 147 H ARG 147 -1.111 -17.713 -4.454 978 HA ARG 147 HA ARG 147 -0.188 -19.684 -6.443 979 1HB ARG 147 1HB ARG 147 -1.004 -21.603 -5.047 980 2HB ARG 147 2HB ARG 147 0.528 -20.884 -4.582 981 1HG ARG 147 1HG ARG 147 -0.151 -20.505 -2.507 982 2HG ARG 147 2HG ARG 147 -1.527 -19.555 -3.057 983 1HD ARG 147 1HD ARG 147 -1.525 -22.593 -2.814 984 2HD ARG 147 2HD ARG 147 -2.159 -21.456 -1.605 985 HE ARG 147 HE ARG 147 -3.181 -21.018 -4.287 986 1HH1 ARG 147 1HH1 ARG 147 -3.916 -22.646 -1.228 987 2HH1 ARG 147 2HH1 ARG 147 -5.632 -22.674 -1.524 988 1HH2 ARG 147 1HH2 ARG 147 -5.309 -21.255 -4.767 989 2HH2 ARG 147 2HH2 ARG 147 -6.483 -21.756 -3.586 990 H GLU 148 H GLU 148 -1.706 -19.211 -7.986 991 HA GLU 148 HA GLU 148 -4.478 -18.850 -7.219 992 1HB GLU 148 1HB GLU 148 -4.931 -18.749 -9.585 993 2HB GLU 148 2HB GLU 148 -3.649 -17.632 -9.105 994 1HG GLU 148 1HG GLU 148 -1.953 -18.920 -10.175 995 2HG GLU 148 2HG GLU 148 -3.005 -20.330 -10.367 996 HA PRO 149 HA PRO 149 -5.303 -23.307 -7.856 997 1HB PRO 149 1HB PRO 149 -7.870 -23.434 -7.259 998 2HB PRO 149 2HB PRO 149 -6.726 -22.935 -6.001 999 1HG PRO 149 1HG PRO 149 -8.451 -21.084 -7.693 1000 2HG PRO 149 2HG PRO 149 -8.200 -21.055 -5.930 1001 1HD PRO 149 1HD PRO 149 -6.778 -19.535 -7.789 1002 2HD PRO 149 2HD PRO 149 -6.174 -19.950 -6.155 1003 H SER 150 H SER 150 -4.649 -22.124 -10.064 1004 HA SER 150 HA SER 150 -4.961 -21.692 -12.270 1005 1HB SER 150 1HB SER 150 -6.642 -24.198 -11.940 1006 2HB SER 150 2HB SER 150 -5.833 -23.651 -13.422 1007 HG SER 150 HG SER 150 -4.574 -25.193 -12.236 1008 H LYS 151 H LYS 151 -6.209 -19.664 -12.193 1009 HA LYS 151 HA LYS 151 -9.074 -19.826 -11.862 1010 1HB LYS 151 1HB LYS 151 -9.086 -17.416 -12.355 1011 2HB LYS 151 2HB LYS 151 -8.073 -17.913 -11.007 1012 1HG LYS 151 1HG LYS 151 -6.122 -17.303 -12.005 1013 2HG LYS 151 2HG LYS 151 -6.657 -17.584 -13.651 1014 1HD LYS 151 1HD LYS 151 -7.955 -15.579 -13.708 1015 2HD LYS 151 2HD LYS 151 -7.882 -15.387 -11.955 1016 1HE LYS 151 1HE LYS 151 -5.318 -15.124 -12.265 1017 2HE LYS 151 2HE LYS 151 -5.664 -14.926 -13.981 1018 1HZ LYS 151 1HZ LYS 151 -6.855 -13.275 -11.819 1019 2HZ LYS 151 2HZ LYS 151 -5.579 -12.818 -12.750 1020 3HZ LYS 151 3HZ LYS 151 -7.059 -13.047 -13.431 Start of MODEL 13 1 H VAL 21 H VAL 21 -0.674 9.710 17.330 2 HA VAL 21 HA VAL 21 0.058 7.610 15.461 3 HB VAL 21 HB VAL 21 -1.678 6.300 16.590 4 1HG1 VAL 21 1HG1 VAL 21 0.655 6.384 17.407 5 2HG1 VAL 21 2HG1 VAL 21 0.223 7.716 18.503 6 3HG1 VAL 21 3HG1 VAL 21 -0.502 6.111 18.719 7 1HG2 VAL 21 1HG2 VAL 21 -2.149 8.760 18.345 8 2HG2 VAL 21 2HG2 VAL 21 -3.339 7.966 17.292 9 3HG2 VAL 21 3HG2 VAL 21 -2.702 7.116 18.694 10 H GLU 22 H GLU 22 -0.620 7.584 13.457 11 HA GLU 22 HA GLU 22 -1.685 8.149 11.579 12 1HB GLU 22 1HB GLU 22 -2.743 6.045 12.558 13 2HB GLU 22 2HB GLU 22 -4.157 7.043 12.928 14 1HG GLU 22 1HG GLU 22 -4.385 7.585 10.520 15 2HG GLU 22 2HG GLU 22 -2.893 6.695 10.159 16 H GLN 23 H GLN 23 -1.338 10.572 12.415 17 HA GLN 23 HA GLN 23 -3.806 11.915 11.780 18 1HB GLN 23 1HB GLN 23 -2.301 12.400 14.404 19 2HB GLN 23 2HB GLN 23 -3.250 13.682 13.660 20 1HG GLN 23 1HG GLN 23 -4.430 11.043 14.619 21 2HG GLN 23 2HG GLN 23 -4.473 12.610 15.452 22 1HE2 GLN 23 1HE2 GLN 23 -5.504 10.964 12.437 23 2HE2 GLN 23 2HE2 GLN 23 -6.783 12.122 12.072 24 H ALA 24 H ALA 24 -3.634 14.039 11.505 25 HA ALA 24 HA ALA 24 -1.055 15.270 10.904 26 1HB ALA 24 1HB ALA 24 -2.087 15.835 8.621 27 2HB ALA 24 2HB ALA 24 -1.620 14.115 8.860 28 3HB ALA 24 3HB ALA 24 -3.323 14.620 8.968 29 H SER 25 H SER 25 -1.565 16.741 12.625 30 HA SER 25 HA SER 25 -3.349 18.787 11.885 31 1HB SER 25 1HB SER 25 -4.171 17.071 14.291 32 2HB SER 25 2HB SER 25 -4.732 18.736 14.131 33 HG SER 25 HG SER 25 -5.159 16.993 11.989 34 H ASP 26 H ASP 26 -0.708 18.518 12.383 35 HA ASP 26 HA ASP 26 -0.100 20.666 14.222 36 1HB ASP 26 1HB ASP 26 1.105 17.932 14.951 37 2HB ASP 26 2HB ASP 26 1.331 19.473 15.759 38 H LEU 27 H LEU 27 1.027 17.704 12.794 39 HA LEU 27 HA LEU 27 3.721 18.684 12.332 40 1HB LEU 27 1HB LEU 27 4.157 16.301 11.914 41 2HB LEU 27 2HB LEU 27 3.305 16.551 13.418 42 HG LEU 27 HG LEU 27 1.439 16.092 11.155 43 1HD1 LEU 27 1HD1 LEU 27 1.914 13.716 10.874 44 2HD1 LEU 27 2HD1 LEU 27 3.278 14.705 10.330 45 3HD1 LEU 27 3HD1 LEU 27 3.365 13.860 11.891 46 1HD2 LEU 27 1HD2 LEU 27 0.746 15.977 13.568 47 2HD2 LEU 27 2HD2 LEU 27 0.462 14.466 12.707 48 3HD2 LEU 27 3HD2 LEU 27 1.845 14.609 13.792 49 H ILE 28 H ILE 28 1.777 19.961 10.598 50 HA ILE 28 HA ILE 28 2.144 18.588 7.984 51 HB ILE 28 HB ILE 28 0.125 20.717 8.708 52 1HG1 ILE 28 1HG1 ILE 28 0.149 17.695 9.088 53 2HG1 ILE 28 2HG1 ILE 28 -0.212 18.977 10.232 54 1HG2 ILE 28 1HG2 ILE 28 0.151 18.513 6.620 55 2HG2 ILE 28 2HG2 ILE 28 -1.024 19.839 6.780 56 3HG2 ILE 28 3HG2 ILE 28 0.633 20.196 6.264 57 1HD1 ILE 28 1HD1 ILE 28 -2.202 19.658 8.961 58 2HD1 ILE 28 2HD1 ILE 28 -2.040 18.146 8.008 59 3HD1 ILE 28 3HD1 ILE 28 -2.270 18.093 9.760 60 H LEU 29 H LEU 29 3.894 19.375 6.914 61 HA LEU 29 HA LEU 29 4.367 22.347 6.951 62 1HB LEU 29 1HB LEU 29 6.279 20.277 5.929 63 2HB LEU 29 2HB LEU 29 6.525 21.990 6.199 64 HG LEU 29 HG LEU 29 7.609 21.019 7.951 65 1HD1 LEU 29 1HD1 LEU 29 6.557 21.751 9.969 66 2HD1 LEU 29 2HD1 LEU 29 6.105 22.865 8.665 67 3HD1 LEU 29 3HD1 LEU 29 4.945 21.654 9.261 68 1HD2 LEU 29 1HD2 LEU 29 6.672 18.727 7.732 69 2HD2 LEU 29 2HD2 LEU 29 6.901 19.253 9.408 70 3HD2 LEU 29 3HD2 LEU 29 5.278 19.203 8.728 71 H ASP 30 H ASP 30 4.201 23.484 5.074 72 HA ASP 30 HA ASP 30 2.329 22.849 3.286 73 1HB ASP 30 1HB ASP 30 4.694 24.687 2.750 74 2HB ASP 30 2HB ASP 30 3.089 24.805 2.029 75 H GLU 31 H GLU 31 5.671 21.937 2.985 76 HA GLU 31 HA GLU 31 5.980 21.666 0.253 77 1HB GLU 31 1HB GLU 31 7.366 20.736 2.700 78 2HB GLU 31 2HB GLU 31 7.473 19.555 1.391 79 1HG GLU 31 1HG GLU 31 8.158 22.463 0.961 80 2HG GLU 31 2HG GLU 31 9.315 21.239 1.505 81 H LYS 32 H LYS 32 6.043 19.828 -1.043 82 HA LYS 32 HA LYS 32 3.457 18.299 -0.732 83 1HB LYS 32 1HB LYS 32 4.600 20.193 -2.746 84 2HB LYS 32 2HB LYS 32 3.605 18.865 -3.375 85 1HG LYS 32 1HG LYS 32 2.607 20.495 -1.027 86 2HG LYS 32 2HG LYS 32 2.527 21.213 -2.631 87 1HD LYS 32 1HD LYS 32 1.471 18.400 -2.168 88 2HD LYS 32 2HD LYS 32 0.471 19.800 -1.773 89 1HE LYS 32 1HE LYS 32 0.334 20.569 -3.978 90 2HE LYS 32 2HE LYS 32 1.782 19.706 -4.508 91 1HZ LYS 32 1HZ LYS 32 -0.318 18.717 -5.295 92 2HZ LYS 32 2HZ LYS 32 0.618 17.672 -4.444 93 3HZ LYS 32 3HZ LYS 32 -0.696 18.273 -3.757 94 H ILE 33 H ILE 33 4.355 16.364 -0.155 95 HA ILE 33 HA ILE 33 6.549 15.218 -1.796 96 HB ILE 33 HB ILE 33 6.818 15.296 0.546 97 1HG1 ILE 33 1HG1 ILE 33 7.692 13.425 -0.924 98 2HG1 ILE 33 2HG1 ILE 33 7.841 13.299 0.831 99 1HG2 ILE 33 1HG2 ILE 33 4.293 13.667 0.615 100 2HG2 ILE 33 2HG2 ILE 33 5.421 13.658 1.964 101 3HG2 ILE 33 3HG2 ILE 33 4.620 15.159 1.506 102 1HD1 ILE 33 1HD1 ILE 33 7.107 11.201 -0.405 103 2HD1 ILE 33 2HD1 ILE 33 6.115 11.673 0.988 104 3HD1 ILE 33 3HD1 ILE 33 5.548 12.015 -0.653 105 H LYS 34 H LYS 34 6.405 13.363 -2.938 106 HA LYS 34 HA LYS 34 3.711 12.800 -4.029 107 1HB LYS 34 1HB LYS 34 5.982 13.622 -5.219 108 2HB LYS 34 2HB LYS 34 6.296 11.888 -5.270 109 1HG LYS 34 1HG LYS 34 3.743 13.153 -6.367 110 2HG LYS 34 2HG LYS 34 5.271 13.086 -7.270 111 1HD LYS 34 1HD LYS 34 5.212 10.507 -6.651 112 2HD LYS 34 2HD LYS 34 3.478 10.806 -6.446 113 1HE LYS 34 1HE LYS 34 5.208 11.342 -8.953 114 2HE LYS 34 2HE LYS 34 4.063 10.025 -8.722 115 1HZ LYS 34 1HZ LYS 34 2.699 11.369 -9.747 116 2HZ LYS 34 2HZ LYS 34 2.420 11.936 -8.311 117 3HZ LYS 34 3HZ LYS 34 3.436 12.824 -9.302 118 H VAL 35 H VAL 35 2.963 10.596 -4.163 119 HA VAL 35 HA VAL 35 4.572 8.523 -2.699 120 HB VAL 35 HB VAL 35 1.699 9.404 -2.421 121 1HG1 VAL 35 1HG1 VAL 35 1.752 6.927 -2.281 122 2HG1 VAL 35 2HG1 VAL 35 3.069 7.016 -1.098 123 3HG1 VAL 35 3HG1 VAL 35 1.459 7.627 -0.689 124 1HG2 VAL 35 1HG2 VAL 35 2.202 9.833 -0.123 125 2HG2 VAL 35 2HG2 VAL 35 3.876 9.242 -0.324 126 3HG2 VAL 35 3HG2 VAL 35 3.334 10.753 -1.107 127 H THR 36 H THR 36 5.088 7.301 -4.490 128 HA THR 36 HA THR 36 2.967 6.667 -6.481 129 HB THR 36 HB THR 36 5.943 6.006 -6.412 130 HG1 THR 36 HG1 THR 36 5.270 8.242 -6.625 131 1HG2 THR 36 1HG2 THR 36 4.687 4.398 -7.798 132 2HG2 THR 36 2HG2 THR 36 3.889 5.749 -8.642 133 3HG2 THR 36 3HG2 THR 36 5.646 5.510 -8.798 134 H PHE 37 H PHE 37 1.608 5.218 -5.887 135 HA PHE 37 HA PHE 37 2.273 3.145 -3.917 136 1HB PHE 37 1HB PHE 37 -0.258 3.907 -5.448 137 2HB PHE 37 2HB PHE 37 -0.138 2.580 -4.324 138 HD1 PHE 37 HD1 PHE 37 1.159 3.496 -1.939 139 HD2 PHE 37 HD2 PHE 37 -1.593 5.578 -4.534 140 HE1 PHE 37 HE1 PHE 37 0.497 4.970 -0.063 141 HE2 PHE 37 HE2 PHE 37 -2.352 6.926 -2.610 142 HZ PHE 37 HZ PHE 37 -1.195 6.766 -0.437 143 H ASP 38 H ASP 38 3.308 1.309 -4.850 144 HA ASP 38 HA ASP 38 2.666 0.709 -7.706 145 1HB ASP 38 1HB ASP 38 4.922 1.441 -7.317 146 2HB ASP 38 2HB ASP 38 5.139 0.255 -6.037 147 H ALA 39 H ALA 39 0.736 -0.442 -7.213 148 HA ALA 39 HA ALA 39 0.972 -2.889 -5.581 149 1HB ALA 39 1HB ALA 39 -1.040 -1.604 -5.355 150 2HB ALA 39 2HB ALA 39 -1.294 -1.589 -7.108 151 3HB ALA 39 3HB ALA 39 -1.441 -3.105 -6.213 152 H ASN 40 H ASN 40 1.973 -4.651 -6.515 153 HA ASN 40 HA ASN 40 1.623 -5.129 -9.445 154 1HB ASN 40 1HB ASN 40 3.750 -6.318 -7.621 155 2HB ASN 40 2HB ASN 40 3.647 -6.364 -9.377 156 1HD2 ASN 40 1HD2 ASN 40 4.176 -4.234 -6.558 157 2HD2 ASN 40 2HD2 ASN 40 5.050 -2.989 -7.461 158 H VAL 41 H VAL 41 0.297 -6.758 -9.973 159 HA VAL 41 HA VAL 41 -0.113 -9.049 -8.107 160 HB VAL 41 HB VAL 41 -1.734 -8.238 -10.542 161 1HG1 VAL 41 1HG1 VAL 41 -2.158 -10.350 -8.391 162 2HG1 VAL 41 2HG1 VAL 41 -3.334 -9.920 -9.648 163 3HG1 VAL 41 3HG1 VAL 41 -1.801 -10.659 -10.105 164 1HG2 VAL 41 1HG2 VAL 41 -2.341 -7.907 -7.577 165 2HG2 VAL 41 2HG2 VAL 41 -2.092 -6.597 -8.756 166 3HG2 VAL 41 3HG2 VAL 41 -3.492 -7.672 -8.912 167 H ALA 42 H ALA 42 1.373 -10.567 -8.424 168 HA ALA 42 HA ALA 42 2.290 -11.221 -11.171 169 1HB ALA 42 1HB ALA 42 3.852 -11.474 -9.209 170 2HB ALA 42 2HB ALA 42 2.721 -12.698 -8.568 171 3HB ALA 42 3HB ALA 42 3.557 -12.982 -10.104 172 H ALA 43 H ALA 43 1.607 -13.283 -12.070 173 HA ALA 43 HA ALA 43 -1.067 -13.931 -11.981 174 1HB ALA 43 1HB ALA 43 -0.419 -16.028 -13.108 175 2HB ALA 43 2HB ALA 43 0.565 -14.683 -13.705 176 3HB ALA 43 3HB ALA 43 1.247 -15.839 -12.539 177 H GLY 44 H GLY 44 1.503 -15.232 -9.987 178 1HA GLY 44 1HA GLY 44 0.544 -17.202 -8.439 179 2HA GLY 44 2HA GLY 44 1.511 -15.870 -7.798 180 H LEU 45 H LEU 45 -0.601 -13.763 -8.114 181 HA LEU 45 HA LEU 45 -2.695 -14.838 -6.285 182 1HB LEU 45 1HB LEU 45 -1.052 -12.701 -5.795 183 2HB LEU 45 2HB LEU 45 -2.476 -11.923 -6.443 184 HG LEU 45 HG LEU 45 -2.773 -14.062 -4.231 185 1HD1 LEU 45 1HD1 LEU 45 -2.849 -12.127 -2.669 186 2HD1 LEU 45 2HD1 LEU 45 -1.244 -12.192 -3.434 187 3HD1 LEU 45 3HD1 LEU 45 -2.459 -11.048 -3.985 188 1HD2 LEU 45 1HD2 LEU 45 -4.449 -11.705 -5.043 189 2HD2 LEU 45 2HD2 LEU 45 -4.702 -13.370 -5.640 190 3HD2 LEU 45 3HD2 LEU 45 -4.785 -13.039 -3.894 191 HA PRO 46 HA PRO 46 -4.520 -14.235 -10.409 192 1HB PRO 46 1HB PRO 46 -6.355 -16.210 -10.375 193 2HB PRO 46 2HB PRO 46 -4.610 -16.594 -10.288 194 1HG PRO 46 1HG PRO 46 -6.529 -16.346 -7.957 195 2HG PRO 46 2HG PRO 46 -5.442 -17.723 -8.333 196 1HD PRO 46 1HD PRO 46 -4.772 -15.675 -6.619 197 2HD PRO 46 2HD PRO 46 -3.551 -16.524 -7.624 198 H TRP 47 H TRP 47 -5.130 -12.243 -8.609 199 HA TRP 47 HA TRP 47 -8.140 -12.063 -8.361 200 1HB TRP 47 1HB TRP 47 -5.957 -11.077 -6.554 201 2HB TRP 47 2HB TRP 47 -7.635 -10.586 -6.452 202 HD1 TRP 47 HD1 TRP 47 -7.745 -14.181 -7.217 203 HE1 TRP 47 HE1 TRP 47 -8.179 -15.558 -5.153 204 HE3 TRP 47 HE3 TRP 47 -6.611 -10.726 -3.597 205 HZ2 TRP 47 HZ2 TRP 47 -7.976 -15.354 -2.383 206 HZ3 TRP 47 HZ3 TRP 47 -6.168 -11.683 -1.360 207 HH2 TRP 47 HH2 TRP 47 -7.116 -13.791 -0.624 208 H GLU 48 H GLU 48 -8.966 -9.992 -8.616 209 HA GLU 48 HA GLU 48 -7.566 -8.079 -10.383 210 1HB GLU 48 1HB GLU 48 -10.106 -8.508 -10.424 211 2HB GLU 48 2HB GLU 48 -10.160 -7.882 -8.778 212 1HG GLU 48 1HG GLU 48 -9.165 -5.707 -9.708 213 2HG GLU 48 2HG GLU 48 -9.493 -6.368 -11.320 214 H PHE 49 H PHE 49 -6.584 -6.215 -9.456 215 HA PHE 49 HA PHE 49 -7.138 -5.488 -6.708 216 1HB PHE 49 1HB PHE 49 -5.175 -7.038 -6.498 217 2HB PHE 49 2HB PHE 49 -4.303 -6.002 -7.635 218 HD1 PHE 49 HD1 PHE 49 -6.403 -4.608 -4.835 219 HD2 PHE 49 HD2 PHE 49 -2.438 -5.739 -6.133 220 HE1 PHE 49 HE1 PHE 49 -5.448 -3.740 -2.746 221 HE2 PHE 49 HE2 PHE 49 -1.498 -4.754 -4.077 222 HZ PHE 49 HZ PHE 49 -2.998 -3.740 -2.381 223 H VAL 50 H VAL 50 -7.718 -3.418 -7.045 224 HA VAL 50 HA VAL 50 -6.893 -1.942 -9.424 225 HB VAL 50 HB VAL 50 -9.014 -1.636 -7.334 226 1HG1 VAL 50 1HG1 VAL 50 -10.085 -0.083 -8.933 227 2HG1 VAL 50 2HG1 VAL 50 -8.553 0.506 -8.279 228 3HG1 VAL 50 3HG1 VAL 50 -8.609 -0.156 -9.936 229 1HG2 VAL 50 1HG2 VAL 50 -10.582 -2.393 -9.146 230 2HG2 VAL 50 2HG2 VAL 50 -9.173 -2.755 -10.164 231 3HG2 VAL 50 3HG2 VAL 50 -9.447 -3.645 -8.649 232 HA PRO 51 HA PRO 51 -4.429 0.489 -6.351 233 1HB PRO 51 1HB PRO 51 -3.615 1.947 -8.836 234 2HB PRO 51 2HB PRO 51 -2.558 1.215 -7.601 235 1HG PRO 51 1HG PRO 51 -2.850 0.107 -10.106 236 2HG PRO 51 2HG PRO 51 -2.686 -0.918 -8.655 237 1HD PRO 51 1HD PRO 51 -5.229 -0.126 -10.065 238 2HD PRO 51 2HD PRO 51 -4.743 -1.740 -9.470 239 H VAL 52 H VAL 52 -4.949 2.626 -5.639 240 HA VAL 52 HA VAL 52 -7.635 3.331 -6.394 241 HB VAL 52 HB VAL 52 -5.865 5.056 -4.616 242 1HG1 VAL 52 1HG1 VAL 52 -8.148 5.831 -5.078 243 2HG1 VAL 52 2HG1 VAL 52 -8.811 4.257 -4.608 244 3HG1 VAL 52 3HG1 VAL 52 -8.036 5.287 -3.395 245 1HG2 VAL 52 1HG2 VAL 52 -6.627 3.471 -2.745 246 2HG2 VAL 52 2HG2 VAL 52 -6.893 2.276 -4.030 247 3HG2 VAL 52 3HG2 VAL 52 -5.281 2.959 -3.753 248 H GLN 53 H GLN 53 -4.471 4.878 -6.637 249 HA GLN 53 HA GLN 53 -4.900 5.381 -9.322 250 1HB GLN 53 1HB GLN 53 -4.308 7.755 -9.455 251 2HB GLN 53 2HB GLN 53 -5.880 7.528 -8.735 252 1HG GLN 53 1HG GLN 53 -3.592 7.788 -6.803 253 2HG GLN 53 2HG GLN 53 -3.935 9.193 -7.830 254 1HE2 GLN 53 1HE2 GLN 53 -5.575 6.889 -5.640 255 2HE2 GLN 53 2HE2 GLN 53 -6.836 8.033 -5.195 256 H ARG 54 H ARG 54 -2.630 6.064 -10.217 257 HA ARG 54 HA ARG 54 -0.839 4.178 -9.186 258 1HB ARG 54 1HB ARG 54 -0.754 5.051 -11.483 259 2HB ARG 54 2HB ARG 54 -0.255 6.627 -10.906 260 1HG ARG 54 1HG ARG 54 1.657 5.406 -11.788 261 2HG ARG 54 2HG ARG 54 1.876 5.757 -10.079 262 1HD ARG 54 1HD ARG 54 1.259 3.498 -9.530 263 2HD ARG 54 2HD ARG 54 0.931 3.198 -11.255 264 HE ARG 54 HE ARG 54 3.609 4.133 -10.937 265 1HH1 ARG 54 1HH1 ARG 54 1.729 1.190 -10.145 266 2HH1 ARG 54 2HH1 ARG 54 3.219 0.272 -9.840 267 1HH2 ARG 54 1HH2 ARG 54 5.510 2.710 -10.546 268 2HH2 ARG 54 2HH2 ARG 54 5.134 1.063 -10.024 269 H ASP 55 H ASP 55 -1.066 7.678 -8.552 270 HA ASP 55 HA ASP 55 0.698 7.364 -6.270 271 1HB ASP 55 1HB ASP 55 2.312 8.903 -6.933 272 2HB ASP 55 2HB ASP 55 2.076 7.954 -8.398 273 H ILE 56 H ILE 56 0.650 9.249 -4.859 274 HA ILE 56 HA ILE 56 -1.538 11.176 -5.383 275 HB ILE 56 HB ILE 56 -2.284 11.265 -3.140 276 1HG1 ILE 56 1HG1 ILE 56 -0.459 8.913 -2.692 277 2HG1 ILE 56 2HG1 ILE 56 -0.153 10.560 -2.086 278 1HG2 ILE 56 1HG2 ILE 56 -2.289 8.425 -4.217 279 2HG2 ILE 56 2HG2 ILE 56 -3.490 9.143 -3.108 280 3HG2 ILE 56 3HG2 ILE 56 -3.353 9.738 -4.771 281 1HD1 ILE 56 1HD1 ILE 56 -1.027 9.258 -0.259 282 2HD1 ILE 56 2HD1 ILE 56 -2.173 10.522 -0.738 283 3HD1 ILE 56 3HD1 ILE 56 -2.477 8.829 -1.175 284 H ASP 57 H ASP 57 -1.250 13.228 -4.086 285 HA ASP 57 HA ASP 57 1.516 13.666 -3.155 286 1HB ASP 57 1HB ASP 57 0.823 15.984 -2.966 287 2HB ASP 57 2HB ASP 57 0.617 15.394 -4.633 288 H VAL 58 H VAL 58 1.801 14.059 -0.996 289 HA VAL 58 HA VAL 58 -0.536 14.513 0.821 290 HB VAL 58 HB VAL 58 0.412 13.453 2.632 291 1HG1 VAL 58 1HG1 VAL 58 -1.112 12.257 0.998 292 2HG1 VAL 58 2HG1 VAL 58 0.316 11.438 0.354 293 3HG1 VAL 58 3HG1 VAL 58 -0.160 11.200 2.050 294 1HG2 VAL 58 1HG2 VAL 58 2.244 11.806 2.454 295 2HG2 VAL 58 2HG2 VAL 58 2.577 12.361 0.809 296 3HG2 VAL 58 3HG2 VAL 58 2.786 13.462 2.214 297 H ARG 59 H ARG 59 -0.117 16.561 1.888 298 HA ARG 59 HA ARG 59 2.460 17.840 1.387 299 1HB ARG 59 1HB ARG 59 0.335 18.482 3.465 300 2HB ARG 59 2HB ARG 59 1.908 19.235 3.437 301 1HG ARG 59 1HG ARG 59 0.605 20.747 2.344 302 2HG ARG 59 2HG ARG 59 1.505 19.954 1.044 303 1HD ARG 59 1HD ARG 59 -0.470 18.629 0.431 304 2HD ARG 59 2HD ARG 59 -1.225 19.073 1.961 305 HE ARG 59 HE ARG 59 -0.593 21.371 0.309 306 1HH1 ARG 59 1HH1 ARG 59 -3.163 18.997 1.150 307 2HH1 ARG 59 2HH1 ARG 59 -4.403 19.886 0.367 308 1HH2 ARG 59 1HH2 ARG 59 -2.315 22.631 -0.527 309 2HH2 ARG 59 2HH2 ARG 59 -3.942 22.028 -0.512 310 H ILE 60 H ILE 60 4.034 18.264 3.293 311 HA ILE 60 HA ILE 60 4.909 15.723 4.209 312 HB ILE 60 HB ILE 60 5.838 18.150 5.617 313 1HG1 ILE 60 1HG1 ILE 60 6.068 18.871 3.386 314 2HG1 ILE 60 2HG1 ILE 60 7.621 18.199 3.908 315 1HG2 ILE 60 1HG2 ILE 60 6.426 15.754 6.270 316 2HG2 ILE 60 2HG2 ILE 60 7.349 15.654 4.782 317 3HG2 ILE 60 3HG2 ILE 60 7.776 16.877 5.982 318 1HD1 ILE 60 1HD1 ILE 60 5.696 17.043 1.910 319 2HD1 ILE 60 2HD1 ILE 60 7.416 17.380 1.723 320 3HD1 ILE 60 3HD1 ILE 60 6.903 16.015 2.710 321 H GLY 61 H GLY 61 3.102 14.809 5.248 322 1HA GLY 61 1HA GLY 61 2.523 13.932 7.364 323 2HA GLY 61 2HA GLY 61 2.741 15.507 8.128 324 H GLU 62 H GLU 62 0.965 15.005 5.064 325 HA GLU 62 HA GLU 62 -1.609 15.740 6.365 326 1HB GLU 62 1HB GLU 62 -0.796 16.978 4.468 327 2HB GLU 62 2HB GLU 62 -0.703 15.484 3.514 328 1HG GLU 62 1HG GLU 62 -3.195 15.279 3.651 329 2HG GLU 62 2HG GLU 62 -3.244 16.797 4.574 330 H THR 63 H THR 63 -2.700 13.921 7.208 331 HA THR 63 HA THR 63 -2.669 11.296 6.118 332 HB THR 63 HB THR 63 -4.741 12.630 7.901 333 HG1 THR 63 HG1 THR 63 -2.184 11.576 8.522 334 1HG2 THR 63 1HG2 THR 63 -5.352 10.355 7.178 335 2HG2 THR 63 2HG2 THR 63 -3.775 9.747 7.759 336 3HG2 THR 63 3HG2 THR 63 -4.954 10.409 8.906 337 H VAL 64 H VAL 64 -3.469 10.824 4.068 338 HA VAL 64 HA VAL 64 -6.330 11.601 3.635 339 HB VAL 64 HB VAL 64 -5.131 12.903 2.096 340 1HG1 VAL 64 1HG1 VAL 64 -2.962 11.736 2.098 341 2HG1 VAL 64 2HG1 VAL 64 -3.669 10.385 1.188 342 3HG1 VAL 64 3HG1 VAL 64 -3.544 12.000 0.449 343 1HG2 VAL 64 1HG2 VAL 64 -7.162 11.774 1.216 344 2HG2 VAL 64 2HG2 VAL 64 -5.975 12.183 -0.033 345 3HG2 VAL 64 3HG2 VAL 64 -6.124 10.508 0.513 346 H GLN 65 H GLN 65 -7.636 10.092 2.731 347 HA GLN 65 HA GLN 65 -6.860 7.267 3.195 348 1HB GLN 65 1HB GLN 65 -9.148 6.765 3.405 349 2HB GLN 65 2HB GLN 65 -8.748 8.138 4.428 350 1HG GLN 65 1HG GLN 65 -10.648 9.003 3.603 351 2HG GLN 65 2HG GLN 65 -9.661 9.497 2.229 352 1HE2 GLN 65 1HE2 GLN 65 -9.678 7.977 0.311 353 2HE2 GLN 65 2HE2 GLN 65 -11.152 7.045 0.029 354 H ILE 66 H ILE 66 -6.859 5.738 1.684 355 HA ILE 66 HA ILE 66 -7.769 6.327 -1.047 356 HB ILE 66 HB ILE 66 -5.335 5.124 -1.578 357 1HG1 ILE 66 1HG1 ILE 66 -3.653 6.769 -0.651 358 2HG1 ILE 66 2HG1 ILE 66 -4.805 7.255 0.569 359 1HG2 ILE 66 1HG2 ILE 66 -4.758 7.194 -2.638 360 2HG2 ILE 66 2HG2 ILE 66 -6.491 6.953 -2.818 361 3HG2 ILE 66 3HG2 ILE 66 -5.884 8.103 -1.605 362 1HD1 ILE 66 1HD1 ILE 66 -3.272 5.619 1.485 363 2HD1 ILE 66 2HD1 ILE 66 -4.847 4.823 1.314 364 3HD1 ILE 66 3HD1 ILE 66 -3.562 4.505 0.132 365 H MET 67 H MET 67 -9.328 4.894 -0.908 366 HA MET 67 HA MET 67 -9.045 2.298 0.287 367 1HB MET 67 1HB MET 67 -11.079 3.696 0.359 368 2HB MET 67 2HB MET 67 -11.293 3.501 -1.384 369 1HG MET 67 1HG MET 67 -11.222 1.186 0.589 370 2HG MET 67 2HG MET 67 -12.709 2.024 0.163 371 1HE MET 67 1HE MET 67 -12.741 2.456 -2.921 372 2HE MET 67 2HE MET 67 -13.434 0.905 -3.448 373 3HE MET 67 3HE MET 67 -14.067 1.699 -1.994 374 H TYR 68 H TYR 68 -8.552 0.352 -0.591 375 HA TYR 68 HA TYR 68 -7.963 0.197 -3.534 376 1HB TYR 68 1HB TYR 68 -6.874 -1.290 -1.123 377 2HB TYR 68 2HB TYR 68 -6.694 -1.844 -2.782 378 HD1 TYR 68 HD1 TYR 68 -4.959 -1.067 -4.179 379 HD2 TYR 68 HD2 TYR 68 -5.896 1.044 -0.540 380 HE1 TYR 68 HE1 TYR 68 -2.870 0.253 -4.400 381 HE2 TYR 68 HE2 TYR 68 -3.833 2.389 -0.789 382 HH TYR 68 HH TYR 68 -2.008 2.901 -2.174 383 H ARG 69 H ARG 69 -8.826 -1.520 -4.690 384 HA ARG 69 HA ARG 69 -10.947 -3.172 -3.394 385 1HB ARG 69 1HB ARG 69 -11.923 -1.264 -4.516 386 2HB ARG 69 2HB ARG 69 -11.010 -1.597 -5.993 387 1HG ARG 69 1HG ARG 69 -12.319 -3.587 -6.450 388 2HG ARG 69 2HG ARG 69 -13.109 -3.495 -4.859 389 1HD ARG 69 1HD ARG 69 -14.073 -1.271 -5.453 390 2HD ARG 69 2HD ARG 69 -13.218 -1.336 -7.004 391 HE ARG 69 HE ARG 69 -14.956 -2.404 -7.875 392 1HH1 ARG 69 1HH1 ARG 69 -15.283 -2.895 -4.343 393 2HH1 ARG 69 2HH1 ARG 69 -16.464 -4.183 -4.541 394 1HH2 ARG 69 1HH2 ARG 69 -16.921 -3.594 -8.009 395 2HH2 ARG 69 2HH2 ARG 69 -17.356 -4.613 -6.670 396 H ALA 70 H ALA 70 -10.995 -5.309 -4.018 397 HA ALA 70 HA ALA 70 -9.432 -6.242 -6.305 398 1HB ALA 70 1HB ALA 70 -9.131 -7.116 -3.375 399 2HB ALA 70 2HB ALA 70 -8.439 -8.016 -4.726 400 3HB ALA 70 3HB ALA 70 -7.878 -6.371 -4.380 401 H LYS 71 H LYS 71 -9.869 -8.648 -6.624 402 HA LYS 71 HA LYS 71 -12.358 -9.712 -5.509 403 1HB LYS 71 1HB LYS 71 -12.129 -9.317 -8.531 404 2HB LYS 71 2HB LYS 71 -13.485 -10.009 -7.623 405 1HG LYS 71 1HG LYS 71 -13.800 -7.692 -6.615 406 2HG LYS 71 2HG LYS 71 -12.595 -7.122 -7.779 407 1HD LYS 71 1HD LYS 71 -14.031 -8.236 -9.614 408 2HD LYS 71 2HD LYS 71 -15.247 -8.537 -8.366 409 1HE LYS 71 1HE LYS 71 -15.918 -6.570 -9.528 410 2HE LYS 71 2HE LYS 71 -15.346 -6.053 -7.934 411 1HZ LYS 71 1HZ LYS 71 -13.625 -6.020 -10.364 412 2HZ LYS 71 2HZ LYS 71 -14.477 -4.702 -9.862 413 3HZ LYS 71 3HZ LYS 71 -13.250 -5.375 -8.986 414 H ASN 72 H ASN 72 -12.413 -12.059 -5.834 415 HA ASN 72 HA ASN 72 -9.863 -13.138 -6.803 416 1HB ASN 72 1HB ASN 72 -10.654 -14.036 -4.750 417 2HB ASN 72 2HB ASN 72 -12.207 -14.503 -5.474 418 1HD2 ASN 72 1HD2 ASN 72 -11.098 -16.652 -4.276 419 2HD2 ASN 72 2HD2 ASN 72 -10.332 -17.692 -5.468 420 H LEU 73 H LEU 73 -9.473 -13.669 -8.875 421 HA LEU 73 HA LEU 73 -11.789 -14.236 -10.675 422 1HB LEU 73 1HB LEU 73 -8.999 -13.214 -11.323 423 2HB LEU 73 2HB LEU 73 -10.299 -13.491 -12.470 424 HG LEU 73 HG LEU 73 -10.284 -11.391 -10.254 425 1HD1 LEU 73 1HD1 LEU 73 -10.198 -9.836 -12.234 426 2HD1 LEU 73 2HD1 LEU 73 -8.758 -10.862 -12.084 427 3HD1 LEU 73 3HD1 LEU 73 -10.008 -11.241 -13.290 428 1HD2 LEU 73 1HD2 LEU 73 -12.596 -12.117 -10.637 429 2HD2 LEU 73 2HD2 LEU 73 -12.344 -10.540 -11.389 430 3HD2 LEU 73 3HD2 LEU 73 -12.370 -12.002 -12.399 431 H ALA 74 H ALA 74 -10.029 -16.138 -8.869 432 HA ALA 74 HA ALA 74 -9.279 -18.054 -11.033 433 1HB ALA 74 1HB ALA 74 -7.624 -17.836 -9.292 434 2HB ALA 74 2HB ALA 74 -8.828 -18.145 -8.019 435 3HB ALA 74 3HB ALA 74 -8.378 -19.420 -9.172 436 H SER 75 H SER 75 -10.025 -20.268 -10.651 437 HA SER 75 HA SER 75 -12.921 -20.315 -9.893 438 1HB SER 75 1HB SER 75 -11.346 -22.390 -11.451 439 2HB SER 75 2HB SER 75 -13.103 -22.272 -11.255 440 HG SER 75 HG SER 75 -12.881 -20.146 -12.298 441 H THR 76 H THR 76 -10.755 -20.230 -7.897 442 HA THR 76 HA THR 76 -11.476 -22.569 -6.342 443 HB THR 76 HB THR 76 -8.998 -22.936 -5.810 444 HG1 THR 76 HG1 THR 76 -8.647 -21.414 -8.170 445 1HG2 THR 76 1HG2 THR 76 -10.213 -24.465 -7.410 446 2HG2 THR 76 2HG2 THR 76 -9.569 -23.492 -8.751 447 3HG2 THR 76 3HG2 THR 76 -8.463 -24.354 -7.672 448 HA PRO 77 HA PRO 77 -10.878 -19.408 -3.283 449 1HB PRO 77 1HB PRO 77 -10.190 -20.814 -1.007 450 2HB PRO 77 2HB PRO 77 -11.839 -20.825 -1.686 451 1HG PRO 77 1HG PRO 77 -9.669 -22.884 -2.129 452 2HG PRO 77 2HG PRO 77 -11.379 -23.157 -1.685 453 1HD PRO 77 1HD PRO 77 -10.539 -23.358 -4.252 454 2HD PRO 77 2HD PRO 77 -12.122 -22.633 -3.872 455 H THR 78 H THR 78 -9.107 -18.044 -3.225 456 HA THR 78 HA THR 78 -6.421 -19.326 -3.118 457 HB THR 78 HB THR 78 -6.081 -16.572 -3.709 458 HG1 THR 78 HG1 THR 78 -6.770 -16.664 -5.812 459 1HG2 THR 78 1HG2 THR 78 -4.717 -17.499 -5.456 460 2HG2 THR 78 2HG2 THR 78 -4.542 -18.538 -4.053 461 3HG2 THR 78 3HG2 THR 78 -5.593 -19.041 -5.417 462 H THR 79 H THR 79 -4.818 -18.139 -1.996 463 HA THR 79 HA THR 79 -5.770 -16.799 0.455 464 HB THR 79 HB THR 79 -4.536 -18.893 0.935 465 HG1 THR 79 HG1 THR 79 -3.206 -16.506 1.672 466 1HG2 THR 79 1HG2 THR 79 -2.132 -17.497 -0.328 467 2HG2 THR 79 2HG2 THR 79 -2.136 -19.042 0.541 468 3HG2 THR 79 3HG2 THR 79 -2.986 -18.896 -1.009 469 H GLY 80 H GLY 80 -4.432 -14.940 0.880 470 1HA GLY 80 1HA GLY 80 -2.825 -13.720 -1.213 471 2HA GLY 80 2HA GLY 80 -4.373 -12.956 -0.862 472 H GLN 81 H GLN 81 -1.375 -14.126 0.472 473 HA GLN 81 HA GLN 81 -1.486 -12.284 2.823 474 1HB GLN 81 1HB GLN 81 0.019 -13.931 3.946 475 2HB GLN 81 2HB GLN 81 -1.654 -14.442 3.782 476 1HG GLN 81 1HG GLN 81 -1.122 -16.296 2.642 477 2HG GLN 81 2HG GLN 81 -0.113 -15.424 1.483 478 1HE2 GLN 81 1HE2 GLN 81 1.989 -14.555 2.488 479 2HE2 GLN 81 2HE2 GLN 81 2.929 -15.764 3.376 480 H ALA 82 H ALA 82 -0.858 -10.952 0.955 481 HA ALA 82 HA ALA 82 1.404 -11.662 -0.658 482 1HB ALA 82 1HB ALA 82 0.993 -9.387 -1.600 483 2HB ALA 82 2HB ALA 82 -0.483 -10.401 -1.497 484 3HB ALA 82 3HB ALA 82 -0.194 -9.106 -0.319 485 H THR 83 H THR 83 3.171 -9.938 -1.060 486 HA THR 83 HA THR 83 4.399 -9.233 1.577 487 HB THR 83 HB THR 83 5.712 -9.884 -1.014 488 HG1 THR 83 HG1 THR 83 4.650 -11.628 0.189 489 1HG2 THR 83 1HG2 THR 83 7.186 -8.440 0.312 490 2HG2 THR 83 2HG2 THR 83 6.875 -9.421 1.768 491 3HG2 THR 83 3HG2 THR 83 7.780 -10.101 0.404 492 H PHE 84 H PHE 84 5.619 -7.136 1.555 493 HA PHE 84 HA PHE 84 5.316 -5.528 -0.838 494 1HB PHE 84 1HB PHE 84 4.404 -3.580 0.382 495 2HB PHE 84 2HB PHE 84 3.257 -4.898 0.204 496 HD1 PHE 84 HD1 PHE 84 5.525 -3.214 2.650 497 HD2 PHE 84 HD2 PHE 84 2.247 -5.966 2.119 498 HE1 PHE 84 HE1 PHE 84 5.127 -3.211 5.086 499 HE2 PHE 84 HE2 PHE 84 1.797 -5.896 4.543 500 HZ PHE 84 HZ PHE 84 3.266 -4.561 6.051 501 H ASN 85 H ASN 85 6.839 -4.039 -1.064 502 HA ASN 85 HA ASN 85 8.988 -3.719 1.002 503 1HB ASN 85 1HB ASN 85 9.939 -4.376 -1.061 504 2HB ASN 85 2HB ASN 85 8.817 -3.398 -1.998 505 1HD2 ASN 85 1HD2 ASN 85 8.986 -1.000 -1.732 506 2HD2 ASN 85 2HD2 ASN 85 10.568 -0.287 -1.627 507 H VAL 86 H VAL 86 8.098 -2.195 2.370 508 HA VAL 86 HA VAL 86 6.612 0.139 1.299 509 HB VAL 86 HB VAL 86 5.627 -0.919 3.139 510 1HG1 VAL 86 1HG1 VAL 86 8.095 -0.512 4.865 511 2HG1 VAL 86 2HG1 VAL 86 6.515 -1.097 5.375 512 3HG1 VAL 86 3HG1 VAL 86 7.483 -2.066 4.264 513 1HG2 VAL 86 1HG2 VAL 86 6.821 1.670 4.142 514 2HG2 VAL 86 2HG2 VAL 86 5.497 1.523 2.966 515 3HG2 VAL 86 3HG2 VAL 86 5.290 0.919 4.619 516 H THR 87 H THR 87 8.380 1.178 0.106 517 HA THR 87 HA THR 87 9.776 3.092 1.322 518 HB THR 87 HB THR 87 11.147 1.426 2.539 519 HG1 THR 87 HG1 THR 87 13.152 2.214 1.907 520 1HG2 THR 87 1HG2 THR 87 12.100 0.557 -0.203 521 2HG2 THR 87 2HG2 THR 87 12.703 -0.018 1.365 522 3HG2 THR 87 3HG2 THR 87 11.034 -0.367 0.877 523 HA PRO 88 HA PRO 88 10.884 3.466 -3.068 524 1HB PRO 88 1HB PRO 88 12.697 5.550 -2.928 525 2HB PRO 88 2HB PRO 88 10.936 5.745 -3.011 526 1HG PRO 88 1HG PRO 88 12.733 5.941 -0.601 527 2HG PRO 88 2HG PRO 88 11.274 6.879 -0.960 528 1HD PRO 88 1HD PRO 88 11.381 4.714 0.774 529 2HD PRO 88 2HD PRO 88 9.908 5.284 -0.024 530 H MET 89 H MET 89 12.995 3.355 -0.251 531 HA MET 89 HA MET 89 14.561 1.256 -0.866 532 1HB MET 89 1HB MET 89 16.795 2.266 -1.447 533 2HB MET 89 2HB MET 89 15.625 2.180 -2.739 534 1HG MET 89 1HG MET 89 15.109 4.710 -2.106 535 2HG MET 89 2HG MET 89 16.674 4.603 -1.290 536 1HE MET 89 1HE MET 89 14.760 4.627 -4.676 537 2HE MET 89 2HE MET 89 16.068 4.353 -5.850 538 3HE MET 89 3HE MET 89 15.519 3.023 -4.814 539 H ALA 90 H ALA 90 15.391 4.581 0.208 540 HA ALA 90 HA ALA 90 16.793 3.576 2.491 541 1HB ALA 90 1HB ALA 90 15.963 6.411 1.788 542 2HB ALA 90 2HB ALA 90 17.204 5.933 2.965 543 3HB ALA 90 3HB ALA 90 17.453 5.601 1.238 544 H ALA 91 H ALA 91 13.595 5.160 2.144 545 HA ALA 91 HA ALA 91 13.494 5.768 4.980 546 1HB ALA 91 1HB ALA 91 11.436 6.164 2.780 547 2HB ALA 91 2HB ALA 91 11.252 6.713 4.461 548 3HB ALA 91 3HB ALA 91 12.581 7.336 3.457 549 H GLY 92 H GLY 92 10.496 4.624 3.655 550 1HA GLY 92 1HA GLY 92 9.040 3.060 4.338 551 2HA GLY 92 2HA GLY 92 10.375 2.020 4.851 552 H ALA 93 H ALA 93 11.517 3.334 6.967 553 HA ALA 93 HA ALA 93 9.892 2.950 9.177 554 1HB ALA 93 1HB ALA 93 12.322 3.295 9.303 555 2HB ALA 93 2HB ALA 93 12.131 5.004 8.858 556 3HB ALA 93 3HB ALA 93 11.479 4.408 10.398 557 H TYR 94 H TYR 94 10.487 6.076 7.553 558 HA TYR 94 HA TYR 94 8.456 7.486 9.047 559 1HB TYR 94 1HB TYR 94 9.976 8.291 6.547 560 2HB TYR 94 2HB TYR 94 9.102 9.376 7.625 561 HD1 TYR 94 HD1 TYR 94 12.335 8.230 6.866 562 HD2 TYR 94 HD2 TYR 94 9.786 8.929 10.280 563 HE1 TYR 94 HE1 TYR 94 14.324 8.371 8.345 564 HE2 TYR 94 HE2 TYR 94 11.755 9.006 11.738 565 HH TYR 94 HH TYR 94 14.040 9.325 11.767 566 H PHE 95 H PHE 95 7.712 5.114 7.047 567 HA PHE 95 HA PHE 95 5.631 6.473 5.479 568 1HB PHE 95 1HB PHE 95 6.935 4.446 4.640 569 2HB PHE 95 2HB PHE 95 6.131 3.499 5.885 570 HD1 PHE 95 HD1 PHE 95 3.572 3.262 5.844 571 HD2 PHE 95 HD2 PHE 95 5.914 4.673 2.496 572 HE1 PHE 95 HE1 PHE 95 1.713 2.752 4.318 573 HE2 PHE 95 HE2 PHE 95 4.006 4.257 0.991 574 HZ PHE 95 HZ PHE 95 1.902 3.272 1.888 575 H ASN 96 H ASN 96 4.087 7.376 6.927 576 HA ASN 96 HA ASN 96 3.594 5.898 9.310 577 1HB ASN 96 1HB ASN 96 2.327 8.384 8.193 578 2HB ASN 96 2HB ASN 96 1.395 7.421 9.320 579 1HD2 ASN 96 1HD2 ASN 96 4.435 9.277 9.008 580 2HD2 ASN 96 2HD2 ASN 96 4.683 9.455 10.738 581 H LYS 97 H LYS 97 1.677 4.745 9.908 582 HA LYS 97 HA LYS 97 0.164 3.115 9.645 583 1HB LYS 97 1HB LYS 97 -1.070 5.087 8.649 584 2HB LYS 97 2HB LYS 97 -0.733 4.423 7.052 585 1HG LYS 97 1HG LYS 97 -2.196 2.948 9.308 586 2HG LYS 97 2HG LYS 97 -2.976 3.922 8.073 587 1HD LYS 97 1HD LYS 97 -1.935 2.443 6.306 588 2HD LYS 97 2HD LYS 97 -1.418 1.351 7.617 589 1HE LYS 97 1HE LYS 97 -3.727 1.036 8.346 590 2HE LYS 97 2HE LYS 97 -4.320 2.148 7.104 591 1HZ LYS 97 1HZ LYS 97 -2.827 -0.325 6.508 592 2HZ LYS 97 2HZ LYS 97 -4.475 -0.227 6.509 593 3HZ LYS 97 3HZ LYS 97 -3.586 0.642 5.426 594 H VAL 98 H VAL 98 2.244 1.926 9.359 595 HA VAL 98 HA VAL 98 2.661 0.609 6.785 596 HB VAL 98 HB VAL 98 4.080 -0.927 8.040 597 1HG1 VAL 98 1HG1 VAL 98 4.977 1.266 7.269 598 2HG1 VAL 98 2HG1 VAL 98 4.616 1.957 8.866 599 3HG1 VAL 98 3HG1 VAL 98 5.803 0.651 8.712 600 1HG2 VAL 98 1HG2 VAL 98 3.270 0.596 10.561 601 2HG2 VAL 98 2HG2 VAL 98 2.853 -1.087 10.181 602 3HG2 VAL 98 3HG2 VAL 98 4.539 -0.629 10.435 603 H GLN 99 H GLN 99 2.036 -1.564 6.315 604 HA GLN 99 HA GLN 99 0.534 -3.226 6.102 605 1HB GLN 99 1HB GLN 99 1.984 -3.727 8.179 606 2HB GLN 99 2HB GLN 99 0.551 -3.404 9.146 607 1HG GLN 99 1HG GLN 99 -0.615 -5.307 7.897 608 2HG GLN 99 2HG GLN 99 0.830 -5.469 6.908 609 1HE2 GLN 99 1HE2 GLN 99 -0.556 -6.107 10.182 610 2HE2 GLN 99 2HE2 GLN 99 0.814 -7.077 10.659 611 H CYS 100 H CYS 100 -1.452 -3.715 8.549 612 HA CYS 100 HA CYS 100 -3.307 -1.568 8.486 613 1HB CYS 100 1HB CYS 100 -3.564 -2.563 6.085 614 2HB CYS 100 2HB CYS 100 -4.268 -3.980 6.868 615 HG CYS 100 HG CYS 100 -6.160 -2.445 5.976 616 H PHE 101 H PHE 101 -2.371 -2.488 10.615 617 HA PHE 101 HA PHE 101 -2.487 -3.749 12.482 618 1HB PHE 101 1HB PHE 101 -4.542 -2.458 12.706 619 2HB PHE 101 2HB PHE 101 -5.452 -3.642 11.788 620 HD1 PHE 101 HD1 PHE 101 -6.888 -4.961 13.140 621 HD2 PHE 101 HD2 PHE 101 -3.135 -3.588 14.792 622 HE1 PHE 101 HE1 PHE 101 -7.372 -6.147 15.252 623 HE2 PHE 101 HE2 PHE 101 -3.641 -4.775 16.902 624 HZ PHE 101 HZ PHE 101 -5.753 -6.064 17.136 625 H CYS 102 H CYS 102 -5.198 -5.722 11.800 626 HA CYS 102 HA CYS 102 -3.664 -8.130 11.840 627 1HB CYS 102 1HB CYS 102 -5.810 -9.237 11.783 628 2HB CYS 102 2HB CYS 102 -5.930 -7.834 12.864 629 HG CYS 102 HG CYS 102 -8.133 -8.123 11.471 630 H PHE 103 H PHE 103 -4.093 -6.091 9.255 631 HA PHE 103 HA PHE 103 -2.814 -6.409 7.397 632 1HB PHE 103 1HB PHE 103 -2.433 -8.945 8.151 633 2HB PHE 103 2HB PHE 103 -3.613 -9.255 6.888 634 HD1 PHE 103 HD1 PHE 103 -2.918 -8.823 4.488 635 HD2 PHE 103 HD2 PHE 103 -0.223 -8.279 7.810 636 HE1 PHE 103 HE1 PHE 103 -0.986 -8.865 2.948 637 HE2 PHE 103 HE2 PHE 103 1.696 -8.233 6.248 638 HZ PHE 103 HZ PHE 103 1.313 -8.531 3.806 639 H THR 104 H THR 104 -3.408 -6.474 5.108 640 HA THR 104 HA THR 104 -6.111 -5.471 4.839 641 HB THR 104 HB THR 104 -3.814 -5.708 2.850 642 HG1 THR 104 HG1 THR 104 -3.223 -3.777 3.528 643 1HG2 THR 104 1HG2 THR 104 -6.032 -5.200 1.755 644 2HG2 THR 104 2HG2 THR 104 -6.241 -3.846 2.891 645 3HG2 THR 104 3HG2 THR 104 -4.924 -3.826 1.699 646 H GLU 105 H GLU 105 -4.790 -7.241 2.063 647 HA GLU 105 HA GLU 105 -7.011 -8.921 1.773 648 1HB GLU 105 1HB GLU 105 -5.651 -10.051 0.098 649 2HB GLU 105 2HB GLU 105 -5.674 -8.308 -0.102 650 1HG GLU 105 1HG GLU 105 -3.388 -9.795 1.295 651 2HG GLU 105 2HG GLU 105 -3.422 -9.500 -0.449 652 H THR 106 H THR 106 -6.927 -11.387 1.775 653 HA THR 106 HA THR 106 -5.076 -12.668 3.581 654 HB THR 106 HB THR 106 -6.142 -11.930 5.424 655 HG1 THR 106 HG1 THR 106 -7.279 -13.669 6.223 656 1HG2 THR 106 1HG2 THR 106 -8.824 -12.079 3.989 657 2HG2 THR 106 2HG2 THR 106 -8.637 -11.843 5.735 658 3HG2 THR 106 3HG2 THR 106 -7.963 -10.654 4.628 659 H THR 107 H THR 107 -8.417 -13.396 2.584 660 HA THR 107 HA THR 107 -7.507 -15.514 0.814 661 HB THR 107 HB THR 107 -7.241 -16.484 3.078 662 HG1 THR 107 HG1 THR 107 -8.412 -18.381 2.509 663 1HG2 THR 107 1HG2 THR 107 -10.271 -16.348 3.078 664 2HG2 THR 107 2HG2 THR 107 -9.240 -17.070 4.339 665 3HG2 THR 107 3HG2 THR 107 -9.209 -15.309 4.059 666 H LEU 108 H LEU 108 -9.217 -16.249 -0.588 667 HA LEU 108 HA LEU 108 -11.910 -15.141 -0.178 668 1HB LEU 108 1HB LEU 108 -10.227 -14.404 -2.594 669 2HB LEU 108 2HB LEU 108 -11.956 -14.149 -2.504 670 HG LEU 108 HG LEU 108 -9.956 -12.792 -0.680 671 1HD1 LEU 108 1HD1 LEU 108 -11.456 -11.590 -3.028 672 2HD1 LEU 108 2HD1 LEU 108 -10.129 -10.882 -2.071 673 3HD1 LEU 108 3HD1 LEU 108 -9.809 -12.226 -3.152 674 1HD2 LEU 108 1HD2 LEU 108 -11.861 -11.382 -0.028 675 2HD2 LEU 108 2HD2 LEU 108 -12.918 -12.201 -1.192 676 3HD2 LEU 108 3HD2 LEU 108 -12.323 -13.046 0.246 677 H GLU 109 H GLU 109 -13.421 -16.412 -1.013 678 HA GLU 109 HA GLU 109 -12.699 -18.828 -2.413 679 1HB GLU 109 1HB GLU 109 -15.464 -17.851 -1.665 680 2HB GLU 109 2HB GLU 109 -14.915 -19.498 -2.005 681 1HG GLU 109 1HG GLU 109 -13.174 -19.022 -0.050 682 2HG GLU 109 2HG GLU 109 -14.438 -17.888 0.462 683 HA PRO 110 HA PRO 110 -12.844 -17.635 -6.426 684 1HB PRO 110 1HB PRO 110 -14.211 -19.445 -7.929 685 2HB PRO 110 2HB PRO 110 -12.750 -19.784 -6.985 686 1HG PRO 110 1HG PRO 110 -15.598 -20.303 -6.146 687 2HG PRO 110 2HG PRO 110 -14.231 -21.456 -6.116 688 1HD PRO 110 1HD PRO 110 -15.006 -20.032 -3.962 689 2HD PRO 110 2HD PRO 110 -13.273 -20.370 -4.220 690 H GLY 111 H GLY 111 -13.693 -15.627 -6.691 691 1HA GLY 111 1HA GLY 111 -15.167 -14.413 -8.183 692 2HA GLY 111 2HA GLY 111 -16.529 -15.397 -7.635 693 H GLU 112 H GLU 112 -14.632 -14.881 -4.872 694 HA GLU 112 HA GLU 112 -16.638 -13.067 -3.993 695 1HB GLU 112 1HB GLU 112 -14.181 -14.300 -2.706 696 2HB GLU 112 2HB GLU 112 -15.191 -13.140 -1.858 697 1HG GLU 112 1HG GLU 112 -16.225 -15.682 -3.028 698 2HG GLU 112 2HG GLU 112 -15.856 -15.410 -1.321 699 H GLU 113 H GLU 113 -16.431 -10.995 -3.153 700 HA GLU 113 HA GLU 113 -14.469 -9.336 -4.633 701 1HB GLU 113 1HB GLU 113 -17.176 -9.118 -4.611 702 2HB GLU 113 2HB GLU 113 -16.790 -8.056 -3.236 703 1HG GLU 113 1HG GLU 113 -15.123 -7.009 -4.829 704 2HG GLU 113 2HG GLU 113 -15.941 -8.016 -6.066 705 H MET 114 H MET 114 -13.180 -7.724 -3.496 706 HA MET 114 HA MET 114 -13.314 -7.747 -0.554 707 1HB MET 114 1HB MET 114 -11.918 -9.673 -1.415 708 2HB MET 114 2HB MET 114 -10.814 -8.549 -2.196 709 1HG MET 114 1HG MET 114 -10.376 -7.463 0.019 710 2HG MET 114 2HG MET 114 -11.658 -8.457 0.723 711 1HE MET 114 1HE MET 114 -9.229 -8.140 2.347 712 2HE MET 114 2HE MET 114 -10.551 -9.278 2.723 713 3HE MET 114 3HE MET 114 -8.868 -9.825 2.789 714 H GLU 115 H GLU 115 -13.365 -5.504 -0.090 715 HA GLU 115 HA GLU 115 -11.104 -3.993 -1.249 716 1HB GLU 115 1HB GLU 115 -12.401 -2.072 -1.716 717 2HB GLU 115 2HB GLU 115 -13.069 -3.445 -2.596 718 1HG GLU 115 1HG GLU 115 -14.954 -3.587 -1.053 719 2HG GLU 115 2HG GLU 115 -14.267 -2.287 -0.055 720 H MET 116 H MET 116 -10.225 -2.404 -0.003 721 HA MET 116 HA MET 116 -10.968 -2.390 2.869 722 1HB MET 116 1HB MET 116 -8.349 -3.250 1.576 723 2HB MET 116 2HB MET 116 -8.448 -2.750 3.272 724 1HG MET 116 1HG MET 116 -10.136 -5.015 2.137 725 2HG MET 116 2HG MET 116 -8.541 -5.222 2.836 726 1HE MET 116 1HE MET 116 -10.939 -6.692 5.585 727 2HE MET 116 2HE MET 116 -11.138 -6.777 3.818 728 3HE MET 116 3HE MET 116 -9.527 -7.013 4.552 729 HA PRO 117 HA PRO 117 -9.492 1.826 2.178 730 1HB PRO 117 1HB PRO 117 -9.679 2.910 4.585 731 2HB PRO 117 2HB PRO 117 -11.116 2.461 3.627 732 1HG PRO 117 1HG PRO 117 -9.854 0.832 5.846 733 2HG PRO 117 2HG PRO 117 -11.574 1.253 5.566 734 1HD PRO 117 1HD PRO 117 -10.426 -1.149 4.768 735 2HD PRO 117 2HD PRO 117 -11.815 -0.397 3.923 736 H VAL 118 H VAL 118 -7.512 2.796 2.320 737 HA VAL 118 HA VAL 118 -5.571 1.952 4.372 738 HB VAL 118 HB VAL 118 -4.957 2.443 1.419 739 1HG1 VAL 118 1HG1 VAL 118 -3.037 1.996 3.736 740 2HG1 VAL 118 2HG1 VAL 118 -2.604 1.966 2.014 741 3HG1 VAL 118 3HG1 VAL 118 -3.180 3.462 2.736 742 1HG2 VAL 118 1HG2 VAL 118 -4.598 -0.043 3.137 743 2HG2 VAL 118 2HG2 VAL 118 -5.771 0.160 1.821 744 3HG2 VAL 118 3HG2 VAL 118 -4.043 0.149 1.461 745 H VAL 119 H VAL 119 -4.142 3.887 4.845 746 HA VAL 119 HA VAL 119 -5.066 6.439 3.891 747 HB VAL 119 HB VAL 119 -6.654 5.929 5.756 748 1HG1 VAL 119 1HG1 VAL 119 -5.183 4.426 7.093 749 2HG1 VAL 119 2HG1 VAL 119 -4.211 5.843 7.569 750 3HG1 VAL 119 3HG1 VAL 119 -5.911 5.716 8.050 751 1HG2 VAL 119 1HG2 VAL 119 -6.122 8.257 5.424 752 2HG2 VAL 119 2HG2 VAL 119 -6.238 7.934 7.156 753 3HG2 VAL 119 3HG2 VAL 119 -4.642 8.105 6.397 754 H PHE 120 H PHE 120 -3.406 8.033 4.187 755 HA PHE 120 HA PHE 120 -0.818 6.968 5.161 756 1HB PHE 120 1HB PHE 120 -1.226 6.010 2.859 757 2HB PHE 120 2HB PHE 120 -1.439 7.651 2.250 758 HD1 PHE 120 HD1 PHE 120 0.465 8.900 1.545 759 HD2 PHE 120 HD2 PHE 120 0.980 5.553 4.213 760 HE1 PHE 120 HE1 PHE 120 2.807 9.581 1.984 761 HE2 PHE 120 HE2 PHE 120 3.277 6.263 4.647 762 HZ PHE 120 HZ PHE 120 4.157 8.336 3.590 763 H PHE 121 H PHE 121 0.765 8.465 5.524 764 HA PHE 121 HA PHE 121 0.945 10.938 4.140 765 1HB PHE 121 1HB PHE 121 1.066 12.350 6.155 766 2HB PHE 121 2HB PHE 121 -0.523 11.658 5.877 767 HD1 PHE 121 HD1 PHE 121 -1.343 9.701 7.183 768 HD2 PHE 121 HD2 PHE 121 2.137 11.963 8.291 769 HE1 PHE 121 HE1 PHE 121 -1.475 8.766 9.464 770 HE2 PHE 121 HE2 PHE 121 1.979 11.086 10.606 771 HZ PHE 121 HZ PHE 121 0.230 9.447 11.190 772 H VAL 122 H VAL 122 3.148 11.830 4.498 773 HA VAL 122 HA VAL 122 5.095 9.770 5.350 774 HB VAL 122 HB VAL 122 5.505 11.260 3.388 775 1HG1 VAL 122 1HG1 VAL 122 6.375 13.565 3.859 776 2HG1 VAL 122 2HG1 VAL 122 4.636 13.401 4.222 777 3HG1 VAL 122 3HG1 VAL 122 5.848 13.442 5.520 778 1HG2 VAL 122 1HG2 VAL 122 7.626 11.698 5.518 779 2HG2 VAL 122 2HG2 VAL 122 7.374 10.132 4.738 780 3HG2 VAL 122 3HG2 VAL 122 7.830 11.542 3.768 781 H ASP 123 H ASP 123 6.506 9.965 7.215 782 HA ASP 123 HA ASP 123 5.527 11.761 9.309 783 1HB ASP 123 1HB ASP 123 6.611 9.346 9.590 784 2HB ASP 123 2HB ASP 123 8.109 10.268 9.580 785 HA PRO 124 HA PRO 124 8.369 14.897 7.679 786 1HB PRO 124 1HB PRO 124 7.962 16.941 9.522 787 2HB PRO 124 2HB PRO 124 6.861 16.445 8.234 788 1HG PRO 124 1HG PRO 124 6.738 15.607 11.116 789 2HG PRO 124 2HG PRO 124 5.421 16.262 10.078 790 1HD PRO 124 1HD PRO 124 5.688 13.627 10.470 791 2HD PRO 124 2HD PRO 124 5.241 14.256 8.864 792 H GLU 125 H GLU 125 9.643 12.816 9.170 793 HA GLU 125 HA GLU 125 11.934 14.341 10.238 794 1HB GLU 125 1HB GLU 125 11.046 12.926 11.956 795 2HB GLU 125 2HB GLU 125 10.938 11.530 10.870 796 1HG GLU 125 1HG GLU 125 13.271 11.342 10.674 797 2HG GLU 125 2HG GLU 125 13.532 12.978 11.251 798 H ILE 126 H ILE 126 10.758 12.262 7.627 799 HA ILE 126 HA ILE 126 12.940 10.884 6.881 800 HB ILE 126 HB ILE 126 10.779 10.834 5.790 801 1HG1 ILE 126 1HG1 ILE 126 12.898 11.342 3.651 802 2HG1 ILE 126 2HG1 ILE 126 12.959 9.929 4.714 803 1HG2 ILE 126 1HG2 ILE 126 10.096 12.408 4.079 804 2HG2 ILE 126 2HG2 ILE 126 10.466 13.342 5.530 805 3HG2 ILE 126 3HG2 ILE 126 11.623 13.280 4.177 806 1HD1 ILE 126 1HD1 ILE 126 10.667 10.626 2.851 807 2HD1 ILE 126 2HD1 ILE 126 11.821 9.292 2.715 808 3HD1 ILE 126 3HD1 ILE 126 10.669 9.315 4.061 809 H VAL 127 H VAL 127 12.618 14.377 6.282 810 HA VAL 127 HA VAL 127 15.259 14.528 4.989 811 HB VAL 127 HB VAL 127 14.851 16.998 5.142 812 1HG1 VAL 127 1HG1 VAL 127 12.742 15.342 3.705 813 2HG1 VAL 127 2HG1 VAL 127 13.218 17.008 3.323 814 3HG1 VAL 127 3HG1 VAL 127 14.383 15.688 3.121 815 1HG2 VAL 127 1HG2 VAL 127 12.656 17.857 5.633 816 2HG2 VAL 127 2HG2 VAL 127 11.995 16.246 5.930 817 3HG2 VAL 127 3HG2 VAL 127 13.175 16.945 7.057 818 H LYS 128 H LYS 128 15.901 13.187 7.060 819 HA LYS 128 HA LYS 128 17.547 15.156 8.540 820 1HB LYS 128 1HB LYS 128 15.940 13.038 9.980 821 2HB LYS 128 2HB LYS 128 17.379 13.828 10.647 822 1HG LYS 128 1HG LYS 128 16.167 16.055 10.274 823 2HG LYS 128 2HG LYS 128 14.747 15.085 9.853 824 1HD LYS 128 1HD LYS 128 15.289 13.840 12.142 825 2HD LYS 128 2HD LYS 128 16.218 15.285 12.517 826 1HE LYS 128 1HE LYS 128 14.268 16.687 12.481 827 2HE LYS 128 2HE LYS 128 13.319 15.496 11.588 828 1HZ LYS 128 1HZ LYS 128 13.330 14.060 13.499 829 2HZ LYS 128 2HZ LYS 128 14.166 15.145 14.379 830 3HZ LYS 128 3HZ LYS 128 12.646 15.499 13.847 831 HA PRO 129 HA PRO 129 20.156 11.400 8.923 832 1HB PRO 129 1HB PRO 129 19.513 8.841 8.230 833 2HB PRO 129 2HB PRO 129 18.970 9.598 9.753 834 1HG PRO 129 1HG PRO 129 17.449 9.424 7.139 835 2HG PRO 129 2HG PRO 129 16.885 8.949 8.761 836 1HD PRO 129 1HD PRO 129 16.212 11.357 7.828 837 2HD PRO 129 2HD PRO 129 16.759 11.139 9.517 838 H VAL 130 H VAL 130 21.827 10.490 7.704 839 HA VAL 130 HA VAL 130 22.274 11.480 5.143 840 HB VAL 130 HB VAL 130 23.584 9.194 6.670 841 1HG1 VAL 130 1HG1 VAL 130 24.223 9.050 4.319 842 2HG1 VAL 130 2HG1 VAL 130 24.558 10.799 4.276 843 3HG1 VAL 130 3HG1 VAL 130 25.569 9.711 5.255 844 1HG2 VAL 130 1HG2 VAL 130 23.666 11.351 7.904 845 2HG2 VAL 130 2HG2 VAL 130 25.259 10.936 7.270 846 3HG2 VAL 130 3HG2 VAL 130 24.276 12.164 6.448 847 H GLU 131 H GLU 131 21.016 8.340 6.222 848 HA GLU 131 HA GLU 131 21.138 6.812 3.877 849 1HB GLU 131 1HB GLU 131 19.047 6.944 6.087 850 2HB GLU 131 2HB GLU 131 19.202 5.603 4.948 851 1HG GLU 131 1HG GLU 131 21.172 4.814 5.907 852 2HG GLU 131 2HG GLU 131 21.660 6.376 6.558 853 H THR 132 H THR 132 18.590 9.173 4.838 854 HA THR 132 HA THR 132 17.155 8.466 2.379 855 HB THR 132 HB THR 132 15.417 10.018 3.430 856 HG1 THR 132 HG1 THR 132 15.909 10.860 5.404 857 1HG2 THR 132 1HG2 THR 132 15.286 7.592 3.853 858 2HG2 THR 132 2HG2 THR 132 16.442 7.736 5.194 859 3HG2 THR 132 3HG2 THR 132 14.849 8.499 5.312 860 H GLN 133 H GLN 133 18.440 11.277 4.036 861 HA GLN 133 HA GLN 133 18.526 13.499 3.248 862 1HB GLN 133 1HB GLN 133 20.715 11.992 3.627 863 2HB GLN 133 2HB GLN 133 20.996 12.323 1.953 864 1HG GLN 133 1HG GLN 133 22.155 13.973 3.262 865 2HG GLN 133 2HG GLN 133 20.825 14.794 2.441 866 1HE2 GLN 133 1HE2 GLN 133 19.818 12.813 5.190 867 2HE2 GLN 133 2HE2 GLN 133 19.755 14.089 6.355 868 H GLY 134 H GLY 134 16.645 13.174 1.570 869 1HA GLY 134 1HA GLY 134 16.654 14.825 -0.455 870 2HA GLY 134 2HA GLY 134 17.668 13.591 -1.216 871 H ILE 135 H ILE 135 16.333 11.328 0.068 872 HA ILE 135 HA ILE 135 14.410 10.616 -1.810 873 HB ILE 135 HB ILE 135 14.918 9.719 1.014 874 1HG1 ILE 135 1HG1 ILE 135 16.578 9.218 -0.857 875 2HG1 ILE 135 2HG1 ILE 135 15.914 7.840 0.022 876 1HG2 ILE 135 1HG2 ILE 135 13.474 7.757 0.561 877 2HG2 ILE 135 2HG2 ILE 135 12.556 9.252 0.686 878 3HG2 ILE 135 3HG2 ILE 135 12.866 8.570 -0.909 879 1HD1 ILE 135 1HD1 ILE 135 14.885 8.682 -2.703 880 2HD1 ILE 135 2HD1 ILE 135 16.103 7.431 -2.397 881 3HD1 ILE 135 3HD1 ILE 135 14.466 7.225 -1.772 882 H LYS 136 H LYS 136 12.334 11.151 -2.175 883 HA LYS 136 HA LYS 136 10.543 11.856 -0.018 884 1HB LYS 136 1HB LYS 136 9.893 14.056 -0.867 885 2HB LYS 136 2HB LYS 136 11.467 13.909 -0.096 886 1HG LYS 136 1HG LYS 136 12.486 13.712 -2.437 887 2HG LYS 136 2HG LYS 136 10.891 14.132 -3.085 888 1HD LYS 136 1HD LYS 136 10.844 16.209 -1.928 889 2HD LYS 136 2HD LYS 136 12.195 15.762 -0.882 890 1HE LYS 136 1HE LYS 136 12.506 16.046 -3.912 891 2HE LYS 136 2HE LYS 136 12.731 17.418 -2.820 892 1HZ LYS 136 1HZ LYS 136 14.258 14.906 -2.491 893 2HZ LYS 136 2HZ LYS 136 14.788 16.185 -3.396 894 3HZ LYS 136 3HZ LYS 136 14.515 16.352 -1.783 895 H THR 137 H THR 137 10.470 9.648 -1.659 896 HA THR 137 HA THR 137 7.944 10.091 -3.085 897 HB THR 137 HB THR 137 8.864 8.370 -4.784 898 HG1 THR 137 HG1 THR 137 10.787 7.963 -3.683 899 1HG2 THR 137 1HG2 THR 137 8.274 10.711 -5.238 900 2HG2 THR 137 2HG2 THR 137 9.926 11.220 -4.817 901 3HG2 THR 137 3HG2 THR 137 9.655 10.173 -6.234 902 H LEU 138 H LEU 138 6.902 9.148 -1.329 903 HA LEU 138 HA LEU 138 8.372 6.940 -0.103 904 1HB LEU 138 1HB LEU 138 7.173 9.001 0.930 905 2HB LEU 138 2HB LEU 138 5.768 7.912 1.007 906 HG LEU 138 HG LEU 138 7.609 6.242 1.939 907 1HD1 LEU 138 1HD1 LEU 138 9.311 7.282 3.317 908 2HD1 LEU 138 2HD1 LEU 138 9.562 7.762 1.628 909 3HD1 LEU 138 3HD1 LEU 138 8.795 8.896 2.772 910 1HD2 LEU 138 1HD2 LEU 138 5.763 6.851 3.352 911 2HD2 LEU 138 2HD2 LEU 138 7.242 7.109 4.293 912 3HD2 LEU 138 3HD2 LEU 138 6.396 8.491 3.591 913 H THR 139 H THR 139 8.265 5.373 -1.645 914 HA THR 139 HA THR 139 5.689 4.545 -2.672 915 HB THR 139 HB THR 139 8.591 4.050 -3.296 916 HG1 THR 139 HG1 THR 139 6.248 4.577 -4.794 917 1HG2 THR 139 1HG2 THR 139 6.408 2.189 -4.308 918 2HG2 THR 139 2HG2 THR 139 8.036 2.355 -4.986 919 3HG2 THR 139 3HG2 THR 139 7.846 1.740 -3.343 920 H LEU 140 H LEU 140 4.689 2.631 -2.423 921 HA LEU 140 HA LEU 140 5.961 0.597 -0.693 922 1HB LEU 140 1HB LEU 140 3.974 1.610 0.395 923 2HB LEU 140 2HB LEU 140 2.966 1.158 -0.986 924 HG LEU 140 HG LEU 140 4.544 -0.968 0.512 925 1HD1 LEU 140 1HD1 LEU 140 1.852 0.175 1.372 926 2HD1 LEU 140 2HD1 LEU 140 2.639 -1.267 2.050 927 3HD1 LEU 140 3HD1 LEU 140 3.380 0.324 2.264 928 1HD2 LEU 140 1HD2 LEU 140 3.358 -1.700 -1.517 929 2HD2 LEU 140 2HD2 LEU 140 2.510 -2.323 -0.099 930 3HD2 LEU 140 3HD2 LEU 140 1.865 -0.918 -0.962 931 H SER 141 H SER 141 6.549 -1.000 -2.047 932 HA SER 141 HA SER 141 5.188 -1.380 -4.661 933 1HB SER 141 1HB SER 141 7.620 -0.969 -4.776 934 2HB SER 141 2HB SER 141 7.884 -2.429 -3.802 935 HG SER 141 HG SER 141 6.670 -2.235 -6.379 936 H TYR 142 H TYR 142 3.513 -2.677 -4.294 937 HA TYR 142 HA TYR 142 3.533 -4.725 -2.173 938 1HB TYR 142 1HB TYR 142 1.595 -2.979 -3.229 939 2HB TYR 142 2HB TYR 142 1.151 -4.535 -3.916 940 HD1 TYR 142 HD1 TYR 142 0.045 -2.492 -1.553 941 HD2 TYR 142 HD2 TYR 142 1.611 -6.495 -1.843 942 HE1 TYR 142 HE1 TYR 142 -1.047 -3.081 0.590 943 HE2 TYR 142 HE2 TYR 142 0.588 -7.047 0.343 944 HH TYR 142 HH TYR 142 -1.291 -6.355 1.655 945 H THR 143 H THR 143 3.930 -6.878 -2.672 946 HA THR 143 HA THR 143 3.739 -7.775 -5.509 947 HB THR 143 HB THR 143 5.376 -9.575 -4.575 948 HG1 THR 143 HG1 THR 143 6.790 -8.587 -3.019 949 1HG2 THR 143 1HG2 THR 143 7.275 -8.141 -5.268 950 2HG2 THR 143 2HG2 THR 143 5.889 -7.956 -6.356 951 3HG2 THR 143 3HG2 THR 143 6.234 -6.704 -5.144 952 H PHE 144 H PHE 144 1.655 -8.304 -5.487 953 HA PHE 144 HA PHE 144 0.509 -10.328 -3.660 954 1HB PHE 144 1HB PHE 144 -0.332 -8.734 -6.076 955 2HB PHE 144 2HB PHE 144 -1.142 -10.244 -5.747 956 HD1 PHE 144 HD1 PHE 144 -0.017 -7.871 -3.062 957 HD2 PHE 144 HD2 PHE 144 -3.286 -9.128 -5.583 958 HE1 PHE 144 HE1 PHE 144 -1.646 -6.843 -1.496 959 HE2 PHE 144 HE2 PHE 144 -4.888 -8.057 -4.027 960 HZ PHE 144 HZ PHE 144 -4.064 -6.953 -1.957 961 H TYR 145 H TYR 145 1.978 -12.099 -3.811 962 HA TYR 145 HA TYR 145 1.718 -13.663 -6.272 963 1HB TYR 145 1HB TYR 145 3.922 -13.781 -6.893 964 2HB TYR 145 2HB TYR 145 3.654 -12.064 -6.611 965 HD1 TYR 145 HD1 TYR 145 4.070 -12.050 -3.525 966 HD2 TYR 145 HD2 TYR 145 6.239 -13.913 -6.759 967 HE1 TYR 145 HE1 TYR 145 6.144 -11.953 -2.201 968 HE2 TYR 145 HE2 TYR 145 8.302 -13.825 -5.416 969 HH TYR 145 HH TYR 145 9.257 -13.207 -3.410 970 HA PRO 146 HA PRO 146 2.502 -16.355 -2.489 971 1HB PRO 146 1HB PRO 146 0.031 -17.093 -1.608 972 2HB PRO 146 2HB PRO 146 0.849 -15.586 -1.124 973 1HG PRO 146 1HG PRO 146 -1.298 -15.876 -3.257 974 2HG PRO 146 2HG PRO 146 -1.127 -14.658 -1.982 975 1HD PRO 146 1HD PRO 146 -0.268 -14.247 -4.550 976 2HD PRO 146 2HD PRO 146 0.484 -13.490 -3.094 977 H ARG 147 H ARG 147 -0.638 -17.511 -3.902 978 HA ARG 147 HA ARG 147 0.778 -19.483 -5.532 979 1HB ARG 147 1HB ARG 147 -0.164 -21.439 -4.473 980 2HB ARG 147 2HB ARG 147 0.791 -20.525 -3.314 981 1HG ARG 147 1HG ARG 147 -0.949 -20.941 -1.957 982 2HG ARG 147 2HG ARG 147 -1.608 -19.482 -2.699 983 1HD ARG 147 1HD ARG 147 -2.933 -20.921 -4.262 984 2HD ARG 147 2HD ARG 147 -2.222 -22.367 -3.530 985 HE ARG 147 HE ARG 147 -3.260 -21.265 -1.347 986 1HH1 ARG 147 1HH1 ARG 147 -4.829 -21.883 -4.492 987 2HH1 ARG 147 2HH1 ARG 147 -6.443 -21.613 -3.835 988 1HH2 ARG 147 1HH2 ARG 147 -5.492 -21.165 -0.534 989 2HH2 ARG 147 2HH2 ARG 147 -6.783 -21.293 -1.718 990 H GLU 148 H GLU 148 -0.406 -20.071 -7.288 991 HA GLU 148 HA GLU 148 -3.341 -19.679 -7.219 992 1HB GLU 148 1HB GLU 148 -3.325 -19.316 -9.603 993 2HB GLU 148 2HB GLU 148 -2.353 -18.081 -8.795 994 1HG GLU 148 1HG GLU 148 -0.273 -19.237 -9.473 995 2HG GLU 148 2HG GLU 148 -1.220 -20.511 -10.259 996 HA PRO 149 HA PRO 149 -2.764 -24.112 -8.219 997 1HB PRO 149 1HB PRO 149 -5.358 -24.902 -8.312 998 2HB PRO 149 2HB PRO 149 -4.515 -24.553 -6.772 999 1HG PRO 149 1HG PRO 149 -6.493 -22.871 -8.254 1000 2HG PRO 149 2HG PRO 149 -6.284 -23.045 -6.495 1001 1HD PRO 149 1HD PRO 149 -5.279 -20.918 -8.080 1002 2HD PRO 149 2HD PRO 149 -4.709 -21.343 -6.449 1003 H SER 150 H SER 150 -5.434 -22.270 -9.771 1004 HA SER 150 HA SER 150 -4.396 -22.253 -12.388 1005 1HB SER 150 1HB SER 150 -6.565 -24.305 -11.725 1006 2HB SER 150 2HB SER 150 -6.398 -23.605 -13.344 1007 HG SER 150 HG SER 150 -4.169 -24.764 -12.077 1008 H LYS 151 H LYS 151 -5.702 -20.882 -13.624 1009 HA LYS 151 HA LYS 151 -8.248 -19.811 -12.531 1010 1HB LYS 151 1HB LYS 151 -7.437 -17.504 -13.223 1011 2HB LYS 151 2HB LYS 151 -6.910 -18.156 -11.674 1012 1HG LYS 151 1HG LYS 151 -4.733 -18.478 -12.307 1013 2HG LYS 151 2HG LYS 151 -5.089 -18.608 -14.036 1014 1HD LYS 151 1HD LYS 151 -5.432 -16.301 -14.307 1015 2HD LYS 151 2HD LYS 151 -5.512 -15.990 -12.563 1016 1HE LYS 151 1HE LYS 151 -3.158 -16.530 -12.260 1017 2HE LYS 151 2HE LYS 151 -3.012 -17.106 -13.925 1018 1HZ LYS 151 1HZ LYS 151 -2.114 -14.944 -13.669 1019 2HZ LYS 151 2HZ LYS 151 -3.435 -14.838 -14.642 1020 3HZ LYS 151 3HZ LYS 151 -3.519 -14.335 -13.070 Start of MODEL 14 1 H VAL 21 H VAL 21 -1.322 9.818 14.653 2 HA VAL 21 HA VAL 21 -2.715 7.588 16.044 3 HB VAL 21 HB VAL 21 -2.306 9.648 17.165 4 1HG1 VAL 21 1HG1 VAL 21 -3.492 11.720 16.756 5 2HG1 VAL 21 2HG1 VAL 21 -2.538 11.311 15.325 6 3HG1 VAL 21 3HG1 VAL 21 -4.296 11.044 15.336 7 1HG2 VAL 21 1HG2 VAL 21 -5.296 9.198 16.827 8 2HG2 VAL 21 2HG2 VAL 21 -4.203 8.220 17.832 9 3HG2 VAL 21 3HG2 VAL 21 -4.471 9.931 18.211 10 H GLU 22 H GLU 22 -2.556 6.977 13.623 11 HA GLU 22 HA GLU 22 -2.916 7.338 11.451 12 1HB GLU 22 1HB GLU 22 -4.431 5.439 12.231 13 2HB GLU 22 2HB GLU 22 -5.796 6.525 11.939 14 1HG GLU 22 1HG GLU 22 -5.302 6.617 9.586 15 2HG GLU 22 2HG GLU 22 -3.657 6.022 9.810 16 H GLN 23 H GLN 23 -2.667 9.664 12.434 17 HA GLN 23 HA GLN 23 -3.778 11.455 10.640 18 1HB GLN 23 1HB GLN 23 -5.199 11.236 13.182 19 2HB GLN 23 2HB GLN 23 -4.252 12.704 13.224 20 1HG GLN 23 1HG GLN 23 -6.037 11.993 10.891 21 2HG GLN 23 2HG GLN 23 -6.561 12.982 12.274 22 1HE2 GLN 23 1HE2 GLN 23 -4.746 13.062 9.249 23 2HE2 GLN 23 2HE2 GLN 23 -3.948 14.597 9.537 24 H ALA 24 H ALA 24 -2.659 13.481 11.007 25 HA ALA 24 HA ALA 24 -0.292 13.485 12.794 26 1HB ALA 24 1HB ALA 24 -0.469 14.004 9.805 27 2HB ALA 24 2HB ALA 24 0.928 14.435 10.800 28 3HB ALA 24 3HB ALA 24 0.485 12.727 10.580 29 H SER 25 H SER 25 -1.243 15.025 14.117 30 HA SER 25 HA SER 25 -2.623 17.353 12.868 31 1HB SER 25 1HB SER 25 -3.015 16.388 15.723 32 2HB SER 25 2HB SER 25 -4.121 17.336 14.717 33 HG SER 25 HG SER 25 -4.328 15.394 13.400 34 H ASP 26 H ASP 26 0.017 17.353 13.015 35 HA ASP 26 HA ASP 26 0.790 19.647 14.626 36 1HB ASP 26 1HB ASP 26 1.085 18.024 16.393 37 2HB ASP 26 2HB ASP 26 1.821 16.848 15.292 38 H LEU 27 H LEU 27 1.897 16.746 12.992 39 HA LEU 27 HA LEU 27 4.306 17.808 11.982 40 1HB LEU 27 1HB LEU 27 2.768 15.404 10.985 41 2HB LEU 27 2HB LEU 27 4.476 15.670 10.779 42 HG LEU 27 HG LEU 27 3.220 15.331 13.537 43 1HD1 LEU 27 1HD1 LEU 27 4.476 13.251 11.708 44 2HD1 LEU 27 2HD1 LEU 27 4.055 13.005 13.412 45 3HD1 LEU 27 3HD1 LEU 27 2.780 13.316 12.220 46 1HD2 LEU 27 1HD2 LEU 27 5.455 16.432 13.478 47 2HD2 LEU 27 2HD2 LEU 27 5.521 14.822 14.207 48 3HD2 LEU 27 3HD2 LEU 27 6.091 15.061 12.543 49 H ILE 28 H ILE 28 1.210 18.510 10.763 50 HA ILE 28 HA ILE 28 1.909 18.376 7.921 51 HB ILE 28 HB ILE 28 -0.527 19.469 9.381 52 1HG1 ILE 28 1HG1 ILE 28 0.221 16.884 7.939 53 2HG1 ILE 28 2HG1 ILE 28 -0.169 17.092 9.632 54 1HG2 ILE 28 1HG2 ILE 28 -0.189 20.433 6.990 55 2HG2 ILE 28 2HG2 ILE 28 -0.289 18.744 6.457 56 3HG2 ILE 28 3HG2 ILE 28 -1.658 19.505 7.283 57 1HD1 ILE 28 1HD1 ILE 28 -2.064 16.045 8.607 58 2HD1 ILE 28 2HD1 ILE 28 -2.514 17.694 9.070 59 3HD1 ILE 28 3HD1 ILE 28 -2.172 17.298 7.365 60 H LEU 29 H LEU 29 3.918 19.555 8.395 61 HA LEU 29 HA LEU 29 3.612 22.511 8.346 62 1HB LEU 29 1HB LEU 29 6.204 21.005 7.898 63 2HB LEU 29 2HB LEU 29 5.937 22.670 8.338 64 HG LEU 29 HG LEU 29 6.550 22.021 10.352 65 1HD1 LEU 29 1HD1 LEU 29 4.904 21.415 11.951 66 2HD1 LEU 29 2HD1 LEU 29 4.023 22.324 10.711 67 3HD1 LEU 29 3HD1 LEU 29 3.926 20.548 10.787 68 1HD2 LEU 29 1HD2 LEU 29 5.887 19.162 9.735 69 2HD2 LEU 29 2HD2 LEU 29 7.466 19.950 9.708 70 3HD2 LEU 29 3HD2 LEU 29 6.597 19.736 11.243 71 H ASP 30 H ASP 30 4.674 23.635 6.376 72 HA ASP 30 HA ASP 30 3.169 22.651 4.176 73 1HB ASP 30 1HB ASP 30 4.935 25.080 4.447 74 2HB ASP 30 2HB ASP 30 3.794 24.802 3.124 75 H GLU 31 H GLU 31 4.769 20.663 4.275 76 HA GLU 31 HA GLU 31 6.327 20.883 1.705 77 1HB GLU 31 1HB GLU 31 6.825 19.179 4.145 78 2HB GLU 31 2HB GLU 31 7.341 18.629 2.557 79 1HG GLU 31 1HG GLU 31 8.124 21.369 3.624 80 2HG GLU 31 2HG GLU 31 9.058 19.910 3.975 81 H LYS 32 H LYS 32 4.991 20.512 0.271 82 HA LYS 32 HA LYS 32 2.987 18.354 0.324 83 1HB LYS 32 1HB LYS 32 2.481 20.401 -0.801 84 2HB LYS 32 2HB LYS 32 4.009 20.403 -1.690 85 1HG LYS 32 1HG LYS 32 3.378 18.751 -3.119 86 2HG LYS 32 2HG LYS 32 2.086 18.130 -2.049 87 1HD LYS 32 1HD LYS 32 0.628 19.946 -2.519 88 2HD LYS 32 2HD LYS 32 1.947 20.978 -3.085 89 1HE LYS 32 1HE LYS 32 0.526 20.349 -4.956 90 2HE LYS 32 2HE LYS 32 2.173 19.732 -5.161 91 1HZ LYS 32 1HZ LYS 32 0.471 18.097 -5.723 92 2HZ LYS 32 2HZ LYS 32 1.369 17.569 -4.455 93 3HZ LYS 32 3HZ LYS 32 -0.140 18.117 -4.217 94 H ILE 33 H ILE 33 4.359 16.653 0.885 95 HA ILE 33 HA ILE 33 6.561 15.788 -0.942 96 HB ILE 33 HB ILE 33 6.766 15.715 1.541 97 1HG1 ILE 33 1HG1 ILE 33 7.870 13.626 1.583 98 2HG1 ILE 33 2HG1 ILE 33 7.045 12.996 0.162 99 1HG2 ILE 33 1HG2 ILE 33 4.487 14.817 2.077 100 2HG2 ILE 33 2HG2 ILE 33 4.977 13.274 1.317 101 3HG2 ILE 33 3HG2 ILE 33 5.841 13.894 2.726 102 1HD1 ILE 33 1HD1 ILE 33 9.399 13.703 -0.130 103 2HD1 ILE 33 2HD1 ILE 33 8.328 14.546 -1.254 104 3HD1 ILE 33 3HD1 ILE 33 8.947 15.390 0.196 105 H LYS 34 H LYS 34 6.398 13.510 -1.757 106 HA LYS 34 HA LYS 34 3.673 12.949 -2.754 107 1HB LYS 34 1HB LYS 34 4.876 14.634 -4.165 108 2HB LYS 34 2HB LYS 34 6.144 13.448 -4.488 109 1HG LYS 34 1HG LYS 34 3.186 12.963 -5.090 110 2HG LYS 34 2HG LYS 34 4.241 13.819 -6.202 111 1HD LYS 34 1HD LYS 34 5.565 11.340 -5.415 112 2HD LYS 34 2HD LYS 34 3.907 11.002 -5.868 113 1HE LYS 34 1HE LYS 34 4.375 12.346 -8.036 114 2HE LYS 34 2HE LYS 34 6.032 12.582 -7.448 115 1HZ LYS 34 1HZ LYS 34 4.768 10.140 -8.441 116 2HZ LYS 34 2HZ LYS 34 6.157 10.815 -8.910 117 3HZ LYS 34 3HZ LYS 34 6.050 9.970 -7.493 118 H VAL 35 H VAL 35 3.399 10.778 -3.571 119 HA VAL 35 HA VAL 35 5.608 8.914 -2.892 120 HB VAL 35 HB VAL 35 2.769 8.960 -1.846 121 1HG1 VAL 35 1HG1 VAL 35 3.329 6.863 -0.635 122 2HG1 VAL 35 2HG1 VAL 35 3.488 6.598 -2.375 123 3HG1 VAL 35 3HG1 VAL 35 4.929 6.843 -1.392 124 1HG2 VAL 35 1HG2 VAL 35 5.507 9.403 -0.624 125 2HG2 VAL 35 2HG2 VAL 35 4.041 10.385 -0.448 126 3HG2 VAL 35 3HG2 VAL 35 4.189 8.816 0.376 127 H THR 36 H THR 36 5.744 7.400 -4.404 128 HA THR 36 HA THR 36 3.660 7.170 -6.541 129 HB THR 36 HB THR 36 6.643 6.603 -6.294 130 HG1 THR 36 HG1 THR 36 5.144 8.167 -8.097 131 1HG2 THR 36 1HG2 THR 36 4.845 5.937 -8.657 132 2HG2 THR 36 2HG2 THR 36 6.630 5.956 -8.656 133 3HG2 THR 36 3HG2 THR 36 5.765 4.779 -7.656 134 H PHE 37 H PHE 37 2.240 5.673 -6.149 135 HA PHE 37 HA PHE 37 2.750 3.424 -4.298 136 1HB PHE 37 1HB PHE 37 0.349 4.553 -5.790 137 2HB PHE 37 2HB PHE 37 0.329 2.958 -5.078 138 HD1 PHE 37 HD1 PHE 37 1.259 6.489 -4.153 139 HD2 PHE 37 HD2 PHE 37 -0.322 2.703 -2.813 140 HE1 PHE 37 HE1 PHE 37 1.030 7.382 -1.891 141 HE2 PHE 37 HE2 PHE 37 -0.754 3.696 -0.578 142 HZ PHE 37 HZ PHE 37 -0.125 6.080 -0.153 143 H ASP 38 H ASP 38 3.247 1.337 -5.002 144 HA ASP 38 HA ASP 38 3.195 0.886 -7.944 145 1HB ASP 38 1HB ASP 38 5.360 1.697 -7.038 146 2HB ASP 38 2HB ASP 38 5.445 0.313 -6.008 147 H ALA 39 H ALA 39 1.258 -0.198 -7.850 148 HA ALA 39 HA ALA 39 1.042 -2.642 -6.216 149 1HB ALA 39 1HB ALA 39 -0.843 -1.445 -8.272 150 2HB ALA 39 2HB ALA 39 -1.223 -2.722 -7.118 151 3HB ALA 39 3HB ALA 39 -0.873 -1.085 -6.532 152 H ASN 40 H ASN 40 2.318 -4.340 -7.018 153 HA ASN 40 HA ASN 40 2.153 -4.949 -9.945 154 1HB ASN 40 1HB ASN 40 4.162 -6.104 -7.987 155 2HB ASN 40 2HB ASN 40 4.169 -6.157 -9.742 156 1HD2 ASN 40 1HD2 ASN 40 4.469 -3.986 -6.919 157 2HD2 ASN 40 2HD2 ASN 40 5.441 -2.757 -7.751 158 H VAL 41 H VAL 41 1.570 -7.106 -10.521 159 HA VAL 41 HA VAL 41 0.811 -8.977 -8.405 160 HB VAL 41 HB VAL 41 -1.272 -7.830 -8.741 161 1HG1 VAL 41 1HG1 VAL 41 -0.935 -8.244 -11.740 162 2HG1 VAL 41 2HG1 VAL 41 -2.382 -7.612 -10.936 163 3HG1 VAL 41 3HG1 VAL 41 -0.877 -6.689 -10.883 164 1HG2 VAL 41 1HG2 VAL 41 -2.741 -9.572 -9.458 165 2HG2 VAL 41 2HG2 VAL 41 -1.470 -10.360 -10.404 166 3HG2 VAL 41 3HG2 VAL 41 -1.367 -10.322 -8.632 167 H ALA 42 H ALA 42 0.857 -11.124 -9.104 168 HA ALA 42 HA ALA 42 1.396 -11.663 -11.946 169 1HB ALA 42 1HB ALA 42 3.208 -13.214 -11.461 170 2HB ALA 42 2HB ALA 42 3.653 -11.622 -10.814 171 3HB ALA 42 3HB ALA 42 3.073 -12.902 -9.723 172 H ALA 43 H ALA 43 1.114 -14.076 -12.263 173 HA ALA 43 HA ALA 43 -1.493 -14.649 -11.774 174 1HB ALA 43 1HB ALA 43 -0.035 -15.673 -13.516 175 2HB ALA 43 2HB ALA 43 0.655 -16.743 -12.268 176 3HB ALA 43 3HB ALA 43 -1.077 -16.825 -12.671 177 H GLY 44 H GLY 44 1.164 -15.555 -9.669 178 1HA GLY 44 1HA GLY 44 0.151 -17.406 -7.902 179 2HA GLY 44 2HA GLY 44 1.178 -16.047 -7.435 180 H LEU 45 H LEU 45 -0.753 -13.935 -8.100 181 HA LEU 45 HA LEU 45 -3.054 -14.530 -6.306 182 1HB LEU 45 1HB LEU 45 -1.049 -12.536 -5.977 183 2HB LEU 45 2HB LEU 45 -2.511 -11.697 -6.432 184 HG LEU 45 HG LEU 45 -2.564 -13.798 -4.212 185 1HD1 LEU 45 1HD1 LEU 45 -1.496 -11.025 -4.242 186 2HD1 LEU 45 2HD1 LEU 45 -2.765 -11.250 -3.038 187 3HD1 LEU 45 3HD1 LEU 45 -1.308 -12.239 -3.006 188 1HD2 LEU 45 1HD2 LEU 45 -4.571 -12.681 -3.638 189 2HD2 LEU 45 2HD2 LEU 45 -4.310 -11.439 -4.898 190 3HD2 LEU 45 3HD2 LEU 45 -4.655 -13.132 -5.356 191 HA PRO 46 HA PRO 46 -4.495 -13.560 -10.583 192 1HB PRO 46 1HB PRO 46 -6.405 -15.427 -10.859 193 2HB PRO 46 2HB PRO 46 -4.678 -15.874 -10.824 194 1HG PRO 46 1HG PRO 46 -6.631 -15.946 -8.514 195 2HG PRO 46 2HG PRO 46 -5.538 -17.263 -9.069 196 1HD PRO 46 1HD PRO 46 -4.947 -15.502 -7.038 197 2HD PRO 46 2HD PRO 46 -3.687 -16.245 -8.060 198 H TRP 47 H TRP 47 -4.992 -11.698 -8.742 199 HA TRP 47 HA TRP 47 -7.938 -11.497 -8.357 200 1HB TRP 47 1HB TRP 47 -5.691 -10.550 -6.592 201 2HB TRP 47 2HB TRP 47 -7.352 -9.990 -6.454 202 HD1 TRP 47 HD1 TRP 47 -7.444 -13.625 -7.184 203 HE1 TRP 47 HE1 TRP 47 -8.026 -14.941 -5.130 204 HE3 TRP 47 HE3 TRP 47 -6.403 -10.115 -3.588 205 HZ2 TRP 47 HZ2 TRP 47 -7.878 -14.702 -2.327 206 HZ3 TRP 47 HZ3 TRP 47 -6.207 -10.948 -1.272 207 HH2 TRP 47 HH2 TRP 47 -7.130 -13.082 -0.570 208 H GLU 48 H GLU 48 -8.911 -9.491 -8.865 209 HA GLU 48 HA GLU 48 -7.571 -7.888 -10.896 210 1HB GLU 48 1HB GLU 48 -10.090 -8.347 -10.713 211 2HB GLU 48 2HB GLU 48 -10.092 -7.274 -9.310 212 1HG GLU 48 1HG GLU 48 -8.996 -5.551 -11.027 213 2HG GLU 48 2HG GLU 48 -9.784 -6.584 -12.214 214 H PHE 49 H PHE 49 -5.714 -7.385 -9.571 215 HA PHE 49 HA PHE 49 -6.005 -5.762 -7.191 216 1HB PHE 49 1HB PHE 49 -4.308 -7.529 -7.361 217 2HB PHE 49 2HB PHE 49 -3.506 -6.634 -8.653 218 HD1 PHE 49 HD1 PHE 49 -1.435 -5.819 -7.829 219 HD2 PHE 49 HD2 PHE 49 -4.914 -5.588 -5.270 220 HE1 PHE 49 HE1 PHE 49 -0.039 -5.003 -5.980 221 HE2 PHE 49 HE2 PHE 49 -3.539 -4.553 -3.513 222 HZ PHE 49 HZ PHE 49 -1.103 -4.275 -3.836 223 H VAL 50 H VAL 50 -6.692 -3.698 -7.561 224 HA VAL 50 HA VAL 50 -5.757 -2.264 -9.939 225 HB VAL 50 HB VAL 50 -7.972 -1.991 -7.995 226 1HG1 VAL 50 1HG1 VAL 50 -7.476 0.230 -8.651 227 2HG1 VAL 50 2HG1 VAL 50 -7.305 -0.258 -10.366 228 3HG1 VAL 50 3HG1 VAL 50 -8.903 -0.285 -9.562 229 1HG2 VAL 50 1HG2 VAL 50 -9.402 -2.560 -9.969 230 2HG2 VAL 50 2HG2 VAL 50 -7.945 -2.692 -10.977 231 3HG2 VAL 50 3HG2 VAL 50 -8.225 -3.836 -9.655 232 HA PRO 51 HA PRO 51 -3.639 0.636 -7.018 233 1HB PRO 51 1HB PRO 51 -2.352 2.045 -9.046 234 2HB PRO 51 2HB PRO 51 -1.678 0.616 -8.241 235 1HG PRO 51 1HG PRO 51 -2.787 0.847 -10.980 236 2HG PRO 51 2HG PRO 51 -1.727 -0.421 -10.312 237 1HD PRO 51 1HD PRO 51 -4.603 -0.450 -10.711 238 2HD PRO 51 2HD PRO 51 -3.633 -1.789 -10.041 239 H VAL 52 H VAL 52 -4.503 2.617 -6.522 240 HA VAL 52 HA VAL 52 -6.940 3.326 -7.921 241 HB VAL 52 HB VAL 52 -5.875 5.075 -5.740 242 1HG1 VAL 52 1HG1 VAL 52 -8.579 3.823 -6.266 243 2HG1 VAL 52 2HG1 VAL 52 -8.191 5.052 -5.041 244 3HG1 VAL 52 3HG1 VAL 52 -8.064 5.450 -6.759 245 1HG2 VAL 52 1HG2 VAL 52 -6.618 2.192 -5.276 246 2HG2 VAL 52 2HG2 VAL 52 -5.130 3.020 -4.771 247 3HG2 VAL 52 3HG2 VAL 52 -6.653 3.444 -4.008 248 H GLN 53 H GLN 53 -3.811 4.863 -7.265 249 HA GLN 53 HA GLN 53 -3.837 6.304 -9.766 250 1HB GLN 53 1HB GLN 53 -3.146 8.415 -8.718 251 2HB GLN 53 2HB GLN 53 -4.845 8.057 -8.365 252 1HG GLN 53 1HG GLN 53 -2.364 7.861 -6.582 253 2HG GLN 53 2HG GLN 53 -3.593 9.132 -6.546 254 1HE2 GLN 53 1HE2 GLN 53 -2.731 5.934 -5.524 255 2HE2 GLN 53 2HE2 GLN 53 -4.228 5.628 -4.676 256 H ARG 54 H ARG 54 -1.667 6.814 -10.361 257 HA ARG 54 HA ARG 54 0.219 4.921 -9.452 258 1HB ARG 54 1HB ARG 54 0.177 5.952 -11.692 259 2HB ARG 54 2HB ARG 54 0.685 7.487 -11.037 260 1HG ARG 54 1HG ARG 54 2.544 6.191 -12.110 261 2HG ARG 54 2HG ARG 54 2.873 6.645 -10.438 262 1HD ARG 54 1HD ARG 54 2.431 4.533 -9.652 263 2HD ARG 54 2HD ARG 54 1.730 4.013 -11.192 264 HE ARG 54 HE ARG 54 4.206 4.442 -12.034 265 1HH1 ARG 54 1HH1 ARG 54 3.324 3.002 -8.834 266 2HH1 ARG 54 2HH1 ARG 54 4.605 1.810 -9.012 267 1HH2 ARG 54 1HH2 ARG 54 5.922 2.653 -11.997 268 2HH2 ARG 54 2HH2 ARG 54 5.865 1.599 -10.574 269 H ASP 55 H ASP 55 -0.311 8.359 -8.573 270 HA ASP 55 HA ASP 55 1.474 7.962 -6.326 271 1HB ASP 55 1HB ASP 55 1.918 10.590 -7.631 272 2HB ASP 55 2HB ASP 55 3.042 9.433 -6.914 273 H ILE 56 H ILE 56 1.298 9.480 -4.672 274 HA ILE 56 HA ILE 56 -1.280 10.987 -4.496 275 HB ILE 56 HB ILE 56 0.154 9.370 -2.380 276 1HG1 ILE 56 1HG1 ILE 56 -2.491 8.883 -3.831 277 2HG1 ILE 56 2HG1 ILE 56 -1.003 7.940 -4.016 278 1HG2 ILE 56 1HG2 ILE 56 -2.360 11.066 -2.247 279 2HG2 ILE 56 2HG2 ILE 56 -1.954 9.861 -1.017 280 3HG2 ILE 56 3HG2 ILE 56 -0.870 11.216 -1.278 281 1HD1 ILE 56 1HD1 ILE 56 -1.245 7.788 -1.324 282 2HD1 ILE 56 2HD1 ILE 56 -2.931 7.944 -1.747 283 3HD1 ILE 56 3HD1 ILE 56 -1.942 6.634 -2.475 284 H ASP 57 H ASP 57 -0.948 13.161 -3.748 285 HA ASP 57 HA ASP 57 1.706 13.868 -2.660 286 1HB ASP 57 1HB ASP 57 0.982 16.138 -2.982 287 2HB ASP 57 2HB ASP 57 0.977 15.238 -4.520 288 H VAL 58 H VAL 58 1.769 14.962 -0.672 289 HA VAL 58 HA VAL 58 -0.565 14.800 1.185 290 HB VAL 58 HB VAL 58 0.014 12.655 1.478 291 1HG1 VAL 58 1HG1 VAL 58 2.395 11.801 1.537 292 2HG1 VAL 58 2HG1 VAL 58 1.797 12.286 -0.053 293 3HG1 VAL 58 3HG1 VAL 58 2.875 13.364 0.853 294 1HG2 VAL 58 1HG2 VAL 58 1.222 12.413 3.526 295 2HG2 VAL 58 2HG2 VAL 58 2.080 13.940 3.305 296 3HG2 VAL 58 3HG2 VAL 58 0.327 13.930 3.625 297 H ARG 59 H ARG 59 -0.453 16.665 2.419 298 HA ARG 59 HA ARG 59 2.056 18.193 2.682 299 1HB ARG 59 1HB ARG 59 -0.706 18.444 3.936 300 2HB ARG 59 2HB ARG 59 0.674 19.401 4.457 301 1HG ARG 59 1HG ARG 59 -0.445 19.378 1.627 302 2HG ARG 59 2HG ARG 59 -0.810 20.568 2.881 303 1HD ARG 59 1HD ARG 59 1.919 20.679 3.007 304 2HD ARG 59 2HD ARG 59 1.741 20.123 1.357 305 HE ARG 59 HE ARG 59 1.009 22.208 0.723 306 1HH1 ARG 59 1HH1 ARG 59 0.557 21.982 4.261 307 2HH1 ARG 59 2HH1 ARG 59 0.883 23.714 4.462 308 1HH2 ARG 59 1HH2 ARG 59 1.264 24.559 1.157 309 2HH2 ARG 59 2HH2 ARG 59 1.244 25.021 2.862 310 H ILE 60 H ILE 60 3.414 16.627 3.425 311 HA ILE 60 HA ILE 60 3.910 14.689 4.829 312 HB ILE 60 HB ILE 60 5.367 15.894 6.585 313 1HG1 ILE 60 1HG1 ILE 60 4.744 18.270 4.803 314 2HG1 ILE 60 2HG1 ILE 60 3.919 18.014 6.322 315 1HG2 ILE 60 1HG2 ILE 60 7.023 16.439 4.799 316 2HG2 ILE 60 2HG2 ILE 60 6.244 14.880 4.616 317 3HG2 ILE 60 3HG2 ILE 60 5.731 16.264 3.606 318 1HD1 ILE 60 1HD1 ILE 60 5.937 19.552 6.341 319 2HD1 ILE 60 2HD1 ILE 60 5.984 18.258 7.556 320 3HD1 ILE 60 3HD1 ILE 60 6.963 18.152 6.076 321 H GLY 61 H GLY 61 1.555 14.196 5.444 322 1HA GLY 61 1HA GLY 61 1.219 13.184 7.859 323 2HA GLY 61 2HA GLY 61 0.958 14.866 8.268 324 H GLU 62 H GLU 62 -0.283 15.539 5.754 325 HA GLU 62 HA GLU 62 -2.956 15.312 6.108 326 1HB GLU 62 1HB GLU 62 -1.632 16.574 4.420 327 2HB GLU 62 2HB GLU 62 -1.572 15.113 3.417 328 1HG GLU 62 1HG GLU 62 -4.005 15.192 3.142 329 2HG GLU 62 2HG GLU 62 -4.107 16.574 4.259 330 H THR 63 H THR 63 -4.089 13.497 6.664 331 HA THR 63 HA THR 63 -3.492 10.880 5.649 332 HB THR 63 HB THR 63 -5.790 10.574 7.013 333 HG1 THR 63 HG1 THR 63 -6.212 12.772 7.115 334 1HG2 THR 63 1HG2 THR 63 -3.513 9.786 7.659 335 2HG2 THR 63 2HG2 THR 63 -3.202 11.382 8.376 336 3HG2 THR 63 3HG2 THR 63 -4.521 10.331 8.991 337 H VAL 64 H VAL 64 -3.830 10.684 3.516 338 HA VAL 64 HA VAL 64 -6.108 11.725 2.131 339 HB VAL 64 HB VAL 64 -3.750 11.146 1.316 340 1HG1 VAL 64 1HG1 VAL 64 -3.341 8.935 0.432 341 2HG1 VAL 64 2HG1 VAL 64 -3.812 8.773 2.134 342 3HG1 VAL 64 3HG1 VAL 64 -4.961 8.383 0.843 343 1HG2 VAL 64 1HG2 VAL 64 -4.334 10.933 -0.943 344 2HG2 VAL 64 2HG2 VAL 64 -5.908 10.230 -0.601 345 3HG2 VAL 64 3HG2 VAL 64 -5.581 11.928 -0.184 346 H GLN 65 H GLN 65 -7.353 10.093 0.606 347 HA GLN 65 HA GLN 65 -8.011 7.444 1.780 348 1HB GLN 65 1HB GLN 65 -9.722 9.473 2.456 349 2HB GLN 65 2HB GLN 65 -10.273 9.205 0.813 350 1HG GLN 65 1HG GLN 65 -11.631 7.790 2.061 351 2HG GLN 65 2HG GLN 65 -10.391 6.672 1.490 352 1HE2 GLN 65 1HE2 GLN 65 -8.467 8.103 3.718 353 2HE2 GLN 65 2HE2 GLN 65 -9.054 7.286 5.146 354 H ILE 66 H ILE 66 -6.712 6.557 0.338 355 HA ILE 66 HA ILE 66 -7.874 6.678 -2.407 356 HB ILE 66 HB ILE 66 -5.898 5.698 -3.277 357 1HG1 ILE 66 1HG1 ILE 66 -3.787 5.902 -1.991 358 2HG1 ILE 66 2HG1 ILE 66 -4.659 5.999 -0.488 359 1HG2 ILE 66 1HG2 ILE 66 -6.302 8.167 -3.139 360 2HG2 ILE 66 2HG2 ILE 66 -5.343 8.212 -1.647 361 3HG2 ILE 66 3HG2 ILE 66 -4.589 7.754 -3.174 362 1HD1 ILE 66 1HD1 ILE 66 -4.343 3.775 -2.591 363 2HD1 ILE 66 2HD1 ILE 66 -3.779 3.743 -0.914 364 3HD1 ILE 66 3HD1 ILE 66 -5.503 3.574 -1.282 365 H MET 67 H MET 67 -8.864 5.107 -3.068 366 HA MET 67 HA MET 67 -9.608 2.830 -1.314 367 1HB MET 67 1HB MET 67 -10.908 3.922 -3.826 368 2HB MET 67 2HB MET 67 -11.524 2.590 -2.831 369 1HG MET 67 1HG MET 67 -11.632 4.106 -0.870 370 2HG MET 67 2HG MET 67 -11.076 5.452 -1.880 371 1HE MET 67 1HE MET 67 -13.628 5.583 -0.037 372 2HE MET 67 2HE MET 67 -13.060 6.924 -1.067 373 3HE MET 67 3HE MET 67 -14.762 6.410 -1.131 374 H TYR 68 H TYR 68 -8.289 1.082 -1.516 375 HA TYR 68 HA TYR 68 -7.103 0.329 -4.147 376 1HB TYR 68 1HB TYR 68 -6.593 -0.305 -1.287 377 2HB TYR 68 2HB TYR 68 -6.569 -1.708 -2.329 378 HD1 TYR 68 HD1 TYR 68 -5.024 -1.868 -4.289 379 HD2 TYR 68 HD2 TYR 68 -4.739 1.262 -1.341 380 HE1 TYR 68 HE1 TYR 68 -2.683 -1.474 -4.945 381 HE2 TYR 68 HE2 TYR 68 -2.397 1.696 -2.032 382 HH TYR 68 HH TYR 68 -0.740 -0.287 -4.496 383 H ARG 69 H ARG 69 -7.492 -1.822 -5.057 384 HA ARG 69 HA ARG 69 -9.730 -3.275 -3.909 385 1HB ARG 69 1HB ARG 69 -10.770 -1.674 -5.514 386 2HB ARG 69 2HB ARG 69 -9.861 -2.426 -6.838 387 1HG ARG 69 1HG ARG 69 -11.003 -4.573 -6.485 388 2HG ARG 69 2HG ARG 69 -11.686 -3.977 -4.968 389 1HD ARG 69 1HD ARG 69 -13.458 -3.791 -6.293 390 2HD ARG 69 2HD ARG 69 -12.832 -2.142 -6.445 391 HE ARG 69 HE ARG 69 -11.768 -3.820 -8.570 392 1HH1 ARG 69 1HH1 ARG 69 -14.909 -2.601 -7.407 393 2HH1 ARG 69 2HH1 ARG 69 -15.702 -2.871 -8.926 394 1HH2 ARG 69 1HH2 ARG 69 -12.696 -4.064 -10.474 395 2HH2 ARG 69 2HH2 ARG 69 -14.359 -3.599 -10.838 396 H ALA 70 H ALA 70 -9.875 -5.344 -4.339 397 HA ALA 70 HA ALA 70 -8.153 -6.750 -6.276 398 1HB ALA 70 1HB ALA 70 -7.830 -8.523 -4.563 399 2HB ALA 70 2HB ALA 70 -6.934 -7.022 -4.233 400 3HB ALA 70 3HB ALA 70 -8.428 -7.371 -3.346 401 H LYS 71 H LYS 71 -9.517 -8.597 -7.184 402 HA LYS 71 HA LYS 71 -11.854 -9.390 -5.636 403 1HB LYS 71 1HB LYS 71 -13.136 -8.262 -7.122 404 2HB LYS 71 2HB LYS 71 -11.837 -8.037 -8.287 405 1HG LYS 71 1HG LYS 71 -12.138 -10.237 -9.167 406 2HG LYS 71 2HG LYS 71 -13.256 -10.674 -7.851 407 1HD LYS 71 1HD LYS 71 -14.533 -10.276 -9.784 408 2HD LYS 71 2HD LYS 71 -14.859 -9.009 -8.583 409 1HE LYS 71 1HE LYS 71 -12.782 -8.521 -10.752 410 2HE LYS 71 2HE LYS 71 -14.494 -8.419 -11.175 411 1HZ LYS 71 1HZ LYS 71 -13.362 -6.829 -8.947 412 2HZ LYS 71 2HZ LYS 71 -13.455 -6.330 -10.513 413 3HZ LYS 71 3HZ LYS 71 -14.807 -6.710 -9.560 414 H ASN 72 H ASN 72 -12.044 -11.692 -5.808 415 HA ASN 72 HA ASN 72 -9.639 -12.905 -6.936 416 1HB ASN 72 1HB ASN 72 -10.385 -13.658 -4.793 417 2HB ASN 72 2HB ASN 72 -11.948 -14.176 -5.458 418 1HD2 ASN 72 1HD2 ASN 72 -11.048 -16.334 -4.320 419 2HD2 ASN 72 2HD2 ASN 72 -10.202 -17.392 -5.451 420 H LEU 73 H LEU 73 -9.349 -13.475 -8.989 421 HA LEU 73 HA LEU 73 -11.705 -14.308 -10.623 422 1HB LEU 73 1HB LEU 73 -8.980 -13.246 -11.461 423 2HB LEU 73 2HB LEU 73 -10.277 -13.709 -12.544 424 HG LEU 73 HG LEU 73 -10.378 -11.417 -10.516 425 1HD1 LEU 73 1HD1 LEU 73 -10.300 -9.978 -12.525 426 2HD1 LEU 73 2HD1 LEU 73 -8.848 -10.984 -12.385 427 3HD1 LEU 73 3HD1 LEU 73 -10.120 -11.415 -13.550 428 1HD2 LEU 73 1HD2 LEU 73 -12.647 -12.273 -10.861 429 2HD2 LEU 73 2HD2 LEU 73 -12.464 -10.776 -11.779 430 3HD2 LEU 73 3HD2 LEU 73 -12.394 -12.334 -12.621 431 H ALA 74 H ALA 74 -9.780 -15.953 -8.714 432 HA ALA 74 HA ALA 74 -9.031 -18.050 -10.649 433 1HB ALA 74 1HB ALA 74 -9.143 -18.007 -7.605 434 2HB ALA 74 2HB ALA 74 -8.615 -19.397 -8.572 435 3HB ALA 74 3HB ALA 74 -7.695 -17.900 -8.615 436 H SER 75 H SER 75 -10.037 -20.267 -9.941 437 HA SER 75 HA SER 75 -13.034 -19.973 -9.840 438 1HB SER 75 1HB SER 75 -12.115 -21.032 -11.909 439 2HB SER 75 2HB SER 75 -11.424 -22.315 -10.877 440 HG SER 75 HG SER 75 -13.609 -22.617 -10.088 441 H THR 76 H THR 76 -10.842 -20.063 -7.651 442 HA THR 76 HA THR 76 -12.070 -21.913 -5.795 443 HB THR 76 HB THR 76 -9.521 -22.695 -5.403 444 HG1 THR 76 HG1 THR 76 -8.900 -21.380 -7.281 445 1HG2 THR 76 1HG2 THR 76 -11.436 -24.236 -5.907 446 2HG2 THR 76 2HG2 THR 76 -11.151 -23.959 -7.639 447 3HG2 THR 76 3HG2 THR 76 -9.904 -24.733 -6.653 448 HA PRO 77 HA PRO 77 -10.760 -18.565 -3.337 449 1HB PRO 77 1HB PRO 77 -10.136 -19.607 -0.853 450 2HB PRO 77 2HB PRO 77 -11.794 -19.496 -1.502 451 1HG PRO 77 1HG PRO 77 -9.939 -21.889 -1.587 452 2HG PRO 77 2HG PRO 77 -11.652 -21.848 -1.075 453 1HD PRO 77 1HD PRO 77 -10.948 -22.621 -3.575 454 2HD PRO 77 2HD PRO 77 -12.398 -21.610 -3.321 455 H THR 78 H THR 78 -8.812 -17.381 -3.527 456 HA THR 78 HA THR 78 -6.249 -18.866 -3.299 457 HB THR 78 HB THR 78 -5.972 -15.964 -3.557 458 HG1 THR 78 HG1 THR 78 -6.522 -15.958 -5.716 459 1HG2 THR 78 1HG2 THR 78 -5.192 -18.019 -5.608 460 2HG2 THR 78 2HG2 THR 78 -4.332 -16.546 -5.129 461 3HG2 THR 78 3HG2 THR 78 -4.301 -17.946 -4.062 462 H THR 79 H THR 79 -4.586 -17.326 -2.094 463 HA THR 79 HA THR 79 -5.764 -15.987 0.182 464 HB THR 79 HB THR 79 -4.664 -17.947 1.184 465 HG1 THR 79 HG1 THR 79 -4.555 -15.820 2.138 466 1HG2 THR 79 1HG2 THR 79 -2.110 -16.921 -0.148 467 2HG2 THR 79 2HG2 THR 79 -2.234 -18.244 1.025 468 3HG2 THR 79 3HG2 THR 79 -2.972 -18.414 -0.582 469 H GLY 80 H GLY 80 -4.338 -14.163 0.724 470 1HA GLY 80 1HA GLY 80 -2.659 -13.144 -1.458 471 2HA GLY 80 2HA GLY 80 -4.158 -12.266 -1.158 472 H GLN 81 H GLN 81 -1.353 -13.667 0.377 473 HA GLN 81 HA GLN 81 -1.197 -11.566 2.507 474 1HB GLN 81 1HB GLN 81 0.063 -13.283 3.800 475 2HB GLN 81 2HB GLN 81 -1.649 -13.634 3.603 476 1HG GLN 81 1HG GLN 81 -1.280 -15.591 2.564 477 2HG GLN 81 2HG GLN 81 -0.107 -14.907 1.437 478 1HE2 GLN 81 1HE2 GLN 81 2.024 -14.220 2.548 479 2HE2 GLN 81 2HE2 GLN 81 2.754 -15.483 3.550 480 H ALA 82 H ALA 82 -0.374 -10.552 0.458 481 HA ALA 82 HA ALA 82 1.848 -11.759 -0.911 482 1HB ALA 82 1HB ALA 82 1.730 -9.590 -2.203 483 2HB ALA 82 2HB ALA 82 0.205 -10.533 -2.124 484 3HB ALA 82 3HB ALA 82 0.420 -9.093 -1.117 485 H THR 83 H THR 83 3.868 -10.667 -1.439 486 HA THR 83 HA THR 83 5.142 -9.510 0.905 487 HB THR 83 HB THR 83 6.374 -9.890 -1.778 488 HG1 THR 83 HG1 THR 83 5.793 -11.867 0.155 489 1HG2 THR 83 1HG2 THR 83 7.805 -8.824 -0.080 490 2HG2 THR 83 2HG2 THR 83 7.486 -10.159 1.050 491 3HG2 THR 83 3HG2 THR 83 8.398 -10.451 -0.444 492 H PHE 84 H PHE 84 6.185 -7.368 0.882 493 HA PHE 84 HA PHE 84 5.771 -5.734 -1.481 494 1HB PHE 84 1HB PHE 84 4.700 -3.903 -0.239 495 2HB PHE 84 2HB PHE 84 3.692 -5.331 -0.309 496 HD1 PHE 84 HD1 PHE 84 3.035 -6.572 1.693 497 HD2 PHE 84 HD2 PHE 84 5.817 -3.290 1.938 498 HE1 PHE 84 HE1 PHE 84 2.536 -6.336 4.094 499 HE2 PHE 84 HE2 PHE 84 5.345 -3.079 4.368 500 HZ PHE 84 HZ PHE 84 3.685 -4.592 5.446 501 H ASN 85 H ASN 85 7.146 -4.009 -1.614 502 HA ASN 85 HA ASN 85 9.319 -3.736 0.443 503 1HB ASN 85 1HB ASN 85 10.316 -4.438 -1.574 504 2HB ASN 85 2HB ASN 85 9.279 -3.420 -2.564 505 1HD2 ASN 85 1HD2 ASN 85 9.532 -1.030 -2.324 506 2HD2 ASN 85 2HD2 ASN 85 11.131 -0.373 -2.061 507 H VAL 86 H VAL 86 8.472 -2.207 1.770 508 HA VAL 86 HA VAL 86 6.931 0.066 0.719 509 HB VAL 86 HB VAL 86 6.151 -1.176 2.565 510 1HG1 VAL 86 1HG1 VAL 86 8.480 -0.246 4.273 511 2HG1 VAL 86 2HG1 VAL 86 7.042 -1.111 4.811 512 3HG1 VAL 86 3HG1 VAL 86 8.181 -1.905 3.724 513 1HG2 VAL 86 1HG2 VAL 86 5.589 1.253 2.316 514 2HG2 VAL 86 2HG2 VAL 86 5.391 0.592 3.948 515 3HG2 VAL 86 3HG2 VAL 86 6.793 1.596 3.570 516 H THR 87 H THR 87 9.233 0.548 -0.463 517 HA THR 87 HA THR 87 10.218 2.896 0.899 518 HB THR 87 HB THR 87 11.288 1.128 2.218 519 HG1 THR 87 HG1 THR 87 13.187 2.124 2.353 520 1HG2 THR 87 1HG2 THR 87 12.860 0.493 -0.287 521 2HG2 THR 87 2HG2 THR 87 13.121 -0.184 1.334 522 3HG2 THR 87 3HG2 THR 87 11.609 -0.521 0.474 523 HA PRO 88 HA PRO 88 11.560 3.720 -3.335 524 1HB PRO 88 1HB PRO 88 13.337 5.783 -2.846 525 2HB PRO 88 2HB PRO 88 11.582 5.937 -3.085 526 1HG PRO 88 1HG PRO 88 13.099 6.140 -0.540 527 2HG PRO 88 2HG PRO 88 11.544 6.844 -0.992 528 1HD PRO 88 1HD PRO 88 11.918 4.558 0.621 529 2HD PRO 88 2HD PRO 88 10.391 5.052 -0.143 530 H MET 89 H MET 89 14.057 4.001 -0.806 531 HA MET 89 HA MET 89 15.458 1.590 -1.563 532 1HB MET 89 1HB MET 89 17.506 2.718 -2.458 533 2HB MET 89 2HB MET 89 16.115 2.928 -3.505 534 1HG MET 89 1HG MET 89 15.723 5.201 -2.493 535 2HG MET 89 2HG MET 89 17.142 4.962 -1.480 536 1HE MET 89 1HE MET 89 15.775 5.528 -5.093 537 2HE MET 89 2HE MET 89 17.268 5.589 -6.058 538 3HE MET 89 3HE MET 89 16.724 4.046 -5.375 539 H ALA 90 H ALA 90 14.463 3.110 0.923 540 HA ALA 90 HA ALA 90 16.768 2.931 2.597 541 1HB ALA 90 1HB ALA 90 17.089 5.377 3.055 542 2HB ALA 90 2HB ALA 90 17.621 4.920 1.433 543 3HB ALA 90 3HB ALA 90 16.072 5.749 1.649 544 H ALA 91 H ALA 91 14.286 5.458 2.438 545 HA ALA 91 HA ALA 91 13.688 5.643 5.098 546 1HB ALA 91 1HB ALA 91 11.971 6.133 2.631 547 2HB ALA 91 2HB ALA 91 11.457 6.621 4.261 548 3HB ALA 91 3HB ALA 91 12.952 7.285 3.538 549 H GLY 92 H GLY 92 10.973 4.466 3.270 550 1HA GLY 92 1HA GLY 92 9.257 3.204 3.889 551 2HA GLY 92 2HA GLY 92 10.445 2.019 4.479 552 H ALA 93 H ALA 93 11.333 3.249 6.852 553 HA ALA 93 HA ALA 93 9.452 2.890 8.783 554 1HB ALA 93 1HB ALA 93 11.708 4.938 8.776 555 2HB ALA 93 2HB ALA 93 10.869 4.329 10.218 556 3HB ALA 93 3HB ALA 93 11.840 3.224 9.223 557 H TYR 94 H TYR 94 10.222 5.954 7.169 558 HA TYR 94 HA TYR 94 8.220 7.504 8.502 559 1HB TYR 94 1HB TYR 94 9.645 8.126 5.900 560 2HB TYR 94 2HB TYR 94 8.942 9.276 7.034 561 HD1 TYR 94 HD1 TYR 94 9.898 8.744 9.635 562 HD2 TYR 94 HD2 TYR 94 12.012 8.100 5.930 563 HE1 TYR 94 HE1 TYR 94 12.052 8.808 10.841 564 HE2 TYR 94 HE2 TYR 94 14.174 8.190 7.157 565 HH TYR 94 HH TYR 94 15.169 8.214 9.206 566 H PHE 95 H PHE 95 7.814 5.166 6.061 567 HA PHE 95 HA PHE 95 5.764 6.500 4.529 568 1HB PHE 95 1HB PHE 95 7.206 4.522 3.674 569 2HB PHE 95 2HB PHE 95 6.254 3.496 4.714 570 HD1 PHE 95 HD1 PHE 95 6.539 4.671 1.409 571 HD2 PHE 95 HD2 PHE 95 3.623 3.480 4.347 572 HE1 PHE 95 HE1 PHE 95 4.783 4.658 -0.329 573 HE2 PHE 95 HE2 PHE 95 1.899 3.386 2.576 574 HZ PHE 95 HZ PHE 95 2.448 4.071 0.256 575 H ASN 96 H ASN 96 4.022 7.163 5.921 576 HA ASN 96 HA ASN 96 3.578 5.391 8.114 577 1HB ASN 96 1HB ASN 96 2.497 8.105 7.476 578 2HB ASN 96 2HB ASN 96 1.564 7.076 8.553 579 1HD2 ASN 96 1HD2 ASN 96 5.055 8.040 8.102 580 2HD2 ASN 96 2HD2 ASN 96 5.210 8.403 9.829 581 H LYS 97 H LYS 97 2.809 3.477 7.179 582 HA LYS 97 HA LYS 97 -0.103 3.586 7.141 583 1HB LYS 97 1HB LYS 97 0.910 3.497 4.696 584 2HB LYS 97 2HB LYS 97 1.037 1.778 5.002 585 1HG LYS 97 1HG LYS 97 -1.457 3.541 5.066 586 2HG LYS 97 2HG LYS 97 -1.006 2.365 3.843 587 1HD LYS 97 1HD LYS 97 -2.568 1.118 4.939 588 2HD LYS 97 2HD LYS 97 -1.122 0.599 5.764 589 1HE LYS 97 1HE LYS 97 -2.896 0.959 7.383 590 2HE LYS 97 2HE LYS 97 -1.704 2.207 7.670 591 1HZ LYS 97 1HZ LYS 97 -4.301 2.491 6.343 592 2HZ LYS 97 2HZ LYS 97 -3.813 3.135 7.761 593 3HZ LYS 97 3HZ LYS 97 -3.192 3.702 6.361 594 H VAL 98 H VAL 98 0.944 2.925 9.334 595 HA VAL 98 HA VAL 98 1.574 0.083 9.582 596 HB VAL 98 HB VAL 98 2.425 1.741 11.183 597 1HG1 VAL 98 1HG1 VAL 98 -0.447 2.032 12.185 598 2HG1 VAL 98 2HG1 VAL 98 1.006 2.722 12.912 599 3HG1 VAL 98 3HG1 VAL 98 0.468 3.286 11.323 600 1HG2 VAL 98 1HG2 VAL 98 1.995 0.457 13.207 601 2HG2 VAL 98 2HG2 VAL 98 0.556 -0.283 12.486 602 3HG2 VAL 98 3HG2 VAL 98 2.167 -0.639 11.826 603 H GLN 99 H GLN 99 0.096 -1.572 9.934 604 HA GLN 99 HA GLN 99 -2.315 -1.278 11.276 605 1HB GLN 99 1HB GLN 99 -2.580 -0.929 8.351 606 2HB GLN 99 2HB GLN 99 -3.524 -2.287 8.927 607 1HG GLN 99 1HG GLN 99 -3.792 0.540 10.021 608 2HG GLN 99 2HG GLN 99 -4.881 -0.270 8.895 609 1HE2 GLN 99 1HE2 GLN 99 -5.995 0.729 11.161 610 2HE2 GLN 99 2HE2 GLN 99 -6.402 -0.584 12.250 611 H CYS 100 H CYS 100 -2.416 -3.199 12.264 612 HA CYS 100 HA CYS 100 -1.827 -5.329 12.845 613 1HB CYS 100 1HB CYS 100 -3.069 -5.816 10.097 614 2HB CYS 100 2HB CYS 100 -2.816 -7.054 11.353 615 HG CYS 100 HG CYS 100 -4.556 -4.267 11.573 616 H PHE 101 H PHE 101 -1.219 -7.007 10.029 617 HA PHE 101 HA PHE 101 1.559 -6.091 9.609 618 1HB PHE 101 1HB PHE 101 2.361 -8.444 9.787 619 2HB PHE 101 2HB PHE 101 1.825 -7.773 11.319 620 HD1 PHE 101 HD1 PHE 101 -0.144 -8.654 12.483 621 HD2 PHE 101 HD2 PHE 101 0.982 -10.180 8.605 622 HE1 PHE 101 HE1 PHE 101 -1.832 -10.457 12.695 623 HE2 PHE 101 HE2 PHE 101 -0.723 -11.963 8.817 624 HZ PHE 101 HZ PHE 101 -2.136 -12.104 10.858 625 H CYS 102 H CYS 102 -1.280 -6.409 8.223 626 HA CYS 102 HA CYS 102 -0.518 -7.094 5.569 627 1HB CYS 102 1HB CYS 102 -0.396 -9.399 6.536 628 2HB CYS 102 2HB CYS 102 -2.058 -9.243 7.146 629 HG CYS 102 HG CYS 102 -3.234 -9.119 4.890 630 H PHE 103 H PHE 103 -2.236 -6.050 4.304 631 HA PHE 103 HA PHE 103 -3.825 -4.462 6.202 632 1HB PHE 103 1HB PHE 103 -3.339 -4.088 3.238 633 2HB PHE 103 2HB PHE 103 -4.058 -2.926 4.343 634 HD1 PHE 103 HD1 PHE 103 -0.995 -4.000 2.866 635 HD2 PHE 103 HD2 PHE 103 -2.570 -2.421 6.539 636 HE1 PHE 103 HE1 PHE 103 1.277 -3.255 3.509 637 HE2 PHE 103 HE2 PHE 103 -0.290 -1.701 7.206 638 HZ PHE 103 HZ PHE 103 1.627 -2.064 5.672 639 H THR 104 H THR 104 -5.131 -6.492 6.553 640 HA THR 104 HA THR 104 -7.244 -7.286 6.636 641 HB THR 104 HB THR 104 -8.094 -5.430 4.377 642 HG1 THR 104 HG1 THR 104 -7.078 -4.337 6.155 643 1HG2 THR 104 1HG2 THR 104 -9.742 -7.172 4.957 644 2HG2 THR 104 2HG2 THR 104 -9.622 -6.720 6.674 645 3HG2 THR 104 3HG2 THR 104 -10.278 -5.569 5.491 646 H GLU 105 H GLU 105 -6.077 -6.848 3.299 647 HA GLU 105 HA GLU 105 -7.080 -8.930 1.890 648 1HB GLU 105 1HB GLU 105 -4.897 -8.888 0.702 649 2HB GLU 105 2HB GLU 105 -5.455 -7.262 1.107 650 1HG GLU 105 1HG GLU 105 -3.967 -7.689 3.322 651 2HG GLU 105 2HG GLU 105 -3.182 -8.858 2.260 652 H THR 106 H THR 106 -7.020 -11.128 1.902 653 HA THR 106 HA THR 106 -5.254 -12.681 3.645 654 HB THR 106 HB THR 106 -6.649 -11.694 5.308 655 HG1 THR 106 HG1 THR 106 -7.475 -14.370 4.940 656 1HG2 THR 106 1HG2 THR 106 -8.957 -11.807 5.515 657 2HG2 THR 106 2HG2 THR 106 -8.729 -11.288 3.845 658 3HG2 THR 106 3HG2 THR 106 -9.174 -12.973 4.215 659 H THR 107 H THR 107 -8.537 -13.121 2.394 660 HA THR 107 HA THR 107 -7.753 -15.053 0.427 661 HB THR 107 HB THR 107 -8.345 -15.864 3.204 662 HG1 THR 107 HG1 THR 107 -7.429 -17.257 0.918 663 1HG2 THR 107 1HG2 THR 107 -10.601 -16.431 2.326 664 2HG2 THR 107 2HG2 THR 107 -9.854 -17.326 0.975 665 3HG2 THR 107 3HG2 THR 107 -9.649 -17.886 2.643 666 H LEU 108 H LEU 108 -9.642 -15.629 -0.865 667 HA LEU 108 HA LEU 108 -12.192 -14.272 -0.278 668 1HB LEU 108 1HB LEU 108 -10.391 -13.755 -2.672 669 2HB LEU 108 2HB LEU 108 -12.118 -13.373 -2.702 670 HG LEU 108 HG LEU 108 -10.053 -12.132 -0.873 671 1HD1 LEU 108 1HD1 LEU 108 -9.821 -11.537 -3.277 672 2HD1 LEU 108 2HD1 LEU 108 -11.504 -10.966 -3.277 673 3HD1 LEU 108 3HD1 LEU 108 -10.283 -10.168 -2.266 674 1HD2 LEU 108 1HD2 LEU 108 -12.307 -12.156 0.177 675 2HD2 LEU 108 2HD2 LEU 108 -11.853 -10.527 -0.299 676 3HD2 LEU 108 3HD2 LEU 108 -12.997 -11.452 -1.302 677 H GLU 109 H GLU 109 -13.864 -15.462 -1.114 678 HA GLU 109 HA GLU 109 -13.325 -17.935 -2.474 679 1HB GLU 109 1HB GLU 109 -15.902 -16.419 -1.867 680 2HB GLU 109 2HB GLU 109 -15.860 -18.008 -2.605 681 1HG GLU 109 1HG GLU 109 -14.444 -18.793 -0.619 682 2HG GLU 109 2HG GLU 109 -14.839 -17.249 0.159 683 HA PRO 110 HA PRO 110 -12.831 -16.600 -6.537 684 1HB PRO 110 1HB PRO 110 -13.954 -18.559 -8.075 685 2HB PRO 110 2HB PRO 110 -12.522 -18.759 -7.034 686 1HG PRO 110 1HG PRO 110 -15.408 -19.424 -6.351 687 2HG PRO 110 2HG PRO 110 -14.007 -20.523 -6.231 688 1HD PRO 110 1HD PRO 110 -14.878 -19.127 -4.084 689 2HD PRO 110 2HD PRO 110 -13.129 -19.301 -4.366 690 H GLY 111 H GLY 111 -13.806 -14.680 -6.964 691 1HA GLY 111 1HA GLY 111 -15.494 -13.831 -8.627 692 2HA GLY 111 2HA GLY 111 -16.722 -14.613 -7.614 693 H GLU 112 H GLU 112 -14.822 -13.922 -5.148 694 HA GLU 112 HA GLU 112 -16.659 -11.834 -4.616 695 1HB GLU 112 1HB GLU 112 -14.450 -13.098 -2.944 696 2HB GLU 112 2HB GLU 112 -15.692 -12.002 -2.352 697 1HG GLU 112 1HG GLU 112 -16.201 -14.712 -3.503 698 2HG GLU 112 2HG GLU 112 -16.410 -14.169 -1.834 699 H GLU 113 H GLU 113 -16.358 -9.746 -4.026 700 HA GLU 113 HA GLU 113 -14.057 -8.370 -5.274 701 1HB GLU 113 1HB GLU 113 -16.438 -7.994 -6.076 702 2HB GLU 113 2HB GLU 113 -16.751 -7.249 -4.502 703 1HG GLU 113 1HG GLU 113 -16.329 -5.455 -5.772 704 2HG GLU 113 2HG GLU 113 -14.710 -5.773 -5.153 705 H MET 114 H MET 114 -12.621 -7.270 -4.056 706 HA MET 114 HA MET 114 -13.224 -6.624 -1.221 707 1HB MET 114 1HB MET 114 -11.791 -8.643 -1.527 708 2HB MET 114 2HB MET 114 -10.626 -7.715 -2.458 709 1HG MET 114 1HG MET 114 -10.200 -6.275 -0.472 710 2HG MET 114 2HG MET 114 -11.559 -7.045 0.351 711 1HE MET 114 1HE MET 114 -8.592 -8.815 -1.679 712 2HE MET 114 2HE MET 114 -7.865 -7.405 -0.862 713 3HE MET 114 3HE MET 114 -7.454 -9.058 -0.353 714 H GLU 115 H GLU 115 -13.818 -4.477 -1.986 715 HA GLU 115 HA GLU 115 -11.501 -2.787 -2.781 716 1HB GLU 115 1HB GLU 115 -13.758 -1.148 -2.656 717 2HB GLU 115 2HB GLU 115 -12.903 -1.708 -4.080 718 1HG GLU 115 1HG GLU 115 -14.455 -3.695 -4.186 719 2HG GLU 115 2HG GLU 115 -15.361 -2.990 -2.834 720 H MET 116 H MET 116 -10.734 -1.222 -1.359 721 HA MET 116 HA MET 116 -12.151 -0.833 1.152 722 1HB MET 116 1HB MET 116 -10.282 -1.500 2.586 723 2HB MET 116 2HB MET 116 -11.065 -2.853 1.756 724 1HG MET 116 1HG MET 116 -9.326 -2.900 0.072 725 2HG MET 116 2HG MET 116 -8.531 -1.497 0.789 726 1HE MET 116 1HE MET 116 -7.394 -1.459 3.125 727 2HE MET 116 2HE MET 116 -8.710 -2.280 4.003 728 3HE MET 116 3HE MET 116 -7.056 -2.901 4.106 729 HA PRO 117 HA PRO 117 -9.951 3.076 0.757 730 1HB PRO 117 1HB PRO 117 -10.496 4.212 3.138 731 2HB PRO 117 2HB PRO 117 -11.746 4.010 1.874 732 1HG PRO 117 1HG PRO 117 -11.225 2.241 4.276 733 2HG PRO 117 2HG PRO 117 -12.779 2.902 3.683 734 1HD PRO 117 1HD PRO 117 -11.909 0.361 3.101 735 2HD PRO 117 2HD PRO 117 -12.896 1.314 1.950 736 H VAL 118 H VAL 118 -7.976 3.825 1.333 737 HA VAL 118 HA VAL 118 -6.543 2.716 3.669 738 HB VAL 118 HB VAL 118 -5.427 2.951 0.849 739 1HG1 VAL 118 1HG1 VAL 118 -4.107 2.137 3.466 740 2HG1 VAL 118 2HG1 VAL 118 -3.366 1.977 1.860 741 3HG1 VAL 118 3HG1 VAL 118 -3.728 3.582 2.503 742 1HG2 VAL 118 1HG2 VAL 118 -6.782 0.919 1.073 743 2HG2 VAL 118 2HG2 VAL 118 -5.069 0.486 1.070 744 3HG2 VAL 118 3HG2 VAL 118 -5.966 0.517 2.600 745 H VAL 119 H VAL 119 -5.956 4.323 4.858 746 HA VAL 119 HA VAL 119 -5.414 7.033 3.783 747 HB VAL 119 HB VAL 119 -6.990 7.239 5.517 748 1HG1 VAL 119 1HG1 VAL 119 -6.811 6.124 7.743 749 2HG1 VAL 119 2HG1 VAL 119 -7.121 5.000 6.425 750 3HG1 VAL 119 3HG1 VAL 119 -5.479 5.144 7.097 751 1HG2 VAL 119 1HG2 VAL 119 -5.884 8.319 7.345 752 2HG2 VAL 119 2HG2 VAL 119 -4.357 7.492 7.012 753 3HG2 VAL 119 3HG2 VAL 119 -4.997 8.676 5.843 754 H PHE 120 H PHE 120 -3.334 7.939 4.158 755 HA PHE 120 HA PHE 120 -1.373 6.566 5.706 756 1HB PHE 120 1HB PHE 120 -0.201 5.457 4.108 757 2HB PHE 120 2HB PHE 120 -1.613 5.550 3.086 758 HD1 PHE 120 HD1 PHE 120 1.858 6.203 3.375 759 HD2 PHE 120 HD2 PHE 120 -1.746 7.913 1.758 760 HE1 PHE 120 HE1 PHE 120 3.197 7.808 2.120 761 HE2 PHE 120 HE2 PHE 120 -0.391 9.645 0.610 762 HZ PHE 120 HZ PHE 120 2.062 9.581 0.736 763 H PHE 121 H PHE 121 0.796 7.828 5.437 764 HA PHE 121 HA PHE 121 0.726 10.230 3.920 765 1HB PHE 121 1HB PHE 121 1.113 11.831 5.771 766 2HB PHE 121 2HB PHE 121 -0.497 11.152 5.803 767 HD1 PHE 121 HD1 PHE 121 -1.196 9.648 7.596 768 HD2 PHE 121 HD2 PHE 121 2.788 11.288 7.516 769 HE1 PHE 121 HE1 PHE 121 -0.866 8.980 9.968 770 HE2 PHE 121 HE2 PHE 121 3.121 10.612 9.869 771 HZ PHE 121 HZ PHE 121 1.329 9.400 11.058 772 H VAL 122 H VAL 122 2.916 11.528 4.545 773 HA VAL 122 HA VAL 122 5.086 9.504 5.017 774 HB VAL 122 HB VAL 122 5.044 12.096 3.481 775 1HG1 VAL 122 1HG1 VAL 122 7.429 11.441 2.841 776 2HG1 VAL 122 2HG1 VAL 122 7.234 11.962 4.515 777 3HG1 VAL 122 3HG1 VAL 122 7.368 10.234 4.141 778 1HG2 VAL 122 1HG2 VAL 122 5.635 10.637 1.547 779 2HG2 VAL 122 2HG2 VAL 122 5.350 9.216 2.581 780 3HG2 VAL 122 3HG2 VAL 122 4.024 10.328 2.216 781 H ASP 123 H ASP 123 6.392 9.849 6.755 782 HA ASP 123 HA ASP 123 5.614 11.891 8.618 783 1HB ASP 123 1HB ASP 123 6.727 9.361 8.810 784 2HB ASP 123 2HB ASP 123 8.065 10.380 9.280 785 HA PRO 124 HA PRO 124 8.883 14.683 7.165 786 1HB PRO 124 1HB PRO 124 8.324 16.920 8.718 787 2HB PRO 124 2HB PRO 124 7.415 16.314 7.319 788 1HG PRO 124 1HG PRO 124 6.807 15.913 10.243 789 2HG PRO 124 2HG PRO 124 5.662 16.346 8.927 790 1HD PRO 124 1HD PRO 124 6.014 13.790 9.897 791 2HD PRO 124 2HD PRO 124 5.437 14.172 8.251 792 H GLU 125 H GLU 125 9.538 12.616 9.139 793 HA GLU 125 HA GLU 125 11.801 13.990 10.442 794 1HB GLU 125 1HB GLU 125 12.140 11.392 11.173 795 2HB GLU 125 2HB GLU 125 11.537 12.724 12.160 796 1HG GLU 125 1HG GLU 125 9.247 12.223 11.595 797 2HG GLU 125 2HG GLU 125 9.810 10.947 10.492 798 H ILE 126 H ILE 126 10.868 12.205 7.601 799 HA ILE 126 HA ILE 126 13.176 10.855 7.001 800 HB ILE 126 HB ILE 126 11.067 10.770 5.793 801 1HG1 ILE 126 1HG1 ILE 126 13.375 11.360 3.891 802 2HG1 ILE 126 2HG1 ILE 126 13.296 9.922 4.928 803 1HG2 ILE 126 1HG2 ILE 126 11.903 13.241 4.236 804 2HG2 ILE 126 2HG2 ILE 126 10.414 12.305 4.082 805 3HG2 ILE 126 3HG2 ILE 126 10.686 13.268 5.538 806 1HD1 ILE 126 1HD1 ILE 126 11.311 10.672 2.764 807 2HD1 ILE 126 2HD1 ILE 126 12.441 9.305 2.807 808 3HD1 ILE 126 3HD1 ILE 126 11.081 9.361 3.949 809 H VAL 127 H VAL 127 12.606 14.312 6.309 810 HA VAL 127 HA VAL 127 15.400 14.690 5.436 811 HB VAL 127 HB VAL 127 14.704 17.111 5.340 812 1HG1 VAL 127 1HG1 VAL 127 13.175 15.115 3.628 813 2HG1 VAL 127 2HG1 VAL 127 13.487 16.817 3.233 814 3HG1 VAL 127 3HG1 VAL 127 14.840 15.679 3.365 815 1HG2 VAL 127 1HG2 VAL 127 12.681 16.930 6.874 816 2HG2 VAL 127 2HG2 VAL 127 12.373 17.701 5.311 817 3HG2 VAL 127 3HG2 VAL 127 11.854 16.033 5.581 818 H LYS 128 H LYS 128 15.886 13.588 7.613 819 HA LYS 128 HA LYS 128 16.944 15.781 9.261 820 1HB LYS 128 1HB LYS 128 15.399 13.536 10.604 821 2HB LYS 128 2HB LYS 128 16.467 14.692 11.400 822 1HG LYS 128 1HG LYS 128 15.065 16.553 10.527 823 2HG LYS 128 2HG LYS 128 13.973 15.340 9.806 824 1HD LYS 128 1HD LYS 128 13.379 14.460 11.984 825 2HD LYS 128 2HD LYS 128 14.596 15.444 12.781 826 1HE LYS 128 1HE LYS 128 12.213 16.314 12.978 827 2HE LYS 128 2HE LYS 128 13.436 17.468 12.440 828 1HZ LYS 128 1HZ LYS 128 12.682 17.146 10.178 829 2HZ LYS 128 2HZ LYS 128 11.492 16.116 10.643 830 3HZ LYS 128 3HZ LYS 128 11.459 17.665 11.142 831 HA PRO 129 HA PRO 129 19.911 12.168 9.946 832 1HB PRO 129 1HB PRO 129 19.450 9.689 8.818 833 2HB PRO 129 2HB PRO 129 18.912 10.141 10.469 834 1HG PRO 129 1HG PRO 129 17.352 10.256 7.887 835 2HG PRO 129 2HG PRO 129 16.835 9.522 9.427 836 1HD PRO 129 1HD PRO 129 16.002 11.969 8.764 837 2HD PRO 129 2HD PRO 129 16.534 11.634 10.434 838 H VAL 130 H VAL 130 21.520 11.052 8.455 839 HA VAL 130 HA VAL 130 21.903 12.788 6.204 840 HB VAL 130 HB VAL 130 23.455 10.384 7.267 841 1HG1 VAL 130 1HG1 VAL 130 24.037 10.763 4.928 842 2HG1 VAL 130 2HG1 VAL 130 24.226 12.507 5.232 843 3HG1 VAL 130 3HG1 VAL 130 25.346 11.336 5.969 844 1HG2 VAL 130 1HG2 VAL 130 23.337 12.256 8.890 845 2HG2 VAL 130 2HG2 VAL 130 24.959 12.121 8.205 846 3HG2 VAL 130 3HG2 VAL 130 23.861 13.389 7.627 847 H GLU 131 H GLU 131 21.424 9.262 6.572 848 HA GLU 131 HA GLU 131 21.736 8.372 3.995 849 1HB GLU 131 1HB GLU 131 19.715 7.473 6.096 850 2HB GLU 131 2HB GLU 131 20.182 6.521 4.680 851 1HG GLU 131 1HG GLU 131 22.433 6.258 5.459 852 2HG GLU 131 2HG GLU 131 22.239 7.448 6.750 853 H THR 132 H THR 132 18.598 9.514 5.350 854 HA THR 132 HA THR 132 17.469 9.275 2.696 855 HB THR 132 HB THR 132 15.364 10.045 3.925 856 HG1 THR 132 HG1 THR 132 16.050 10.899 5.811 857 1HG2 THR 132 1HG2 THR 132 15.845 7.685 3.379 858 2HG2 THR 132 2HG2 THR 132 16.809 7.527 4.865 859 3HG2 THR 132 3HG2 THR 132 15.064 7.829 4.963 860 H GLN 133 H GLN 133 19.348 11.702 3.998 861 HA GLN 133 HA GLN 133 17.767 14.002 3.413 862 1HB GLN 133 1HB GLN 133 20.023 13.635 4.809 863 2HB GLN 133 2HB GLN 133 20.795 14.062 3.318 864 1HG GLN 133 1HG GLN 133 20.521 16.050 4.649 865 2HG GLN 133 2HG GLN 133 19.442 16.182 3.255 866 1HE2 GLN 133 1HE2 GLN 133 18.984 14.303 6.369 867 2HE2 GLN 133 2HE2 GLN 133 17.633 15.261 6.883 868 H GLY 134 H GLY 134 16.891 13.273 1.364 869 1HA GLY 134 1HA GLY 134 17.559 14.460 -1.015 870 2HA GLY 134 2HA GLY 134 18.625 13.039 -0.978 871 H ILE 135 H ILE 135 16.742 11.413 0.615 872 HA ILE 135 HA ILE 135 15.030 10.341 -1.484 873 HB ILE 135 HB ILE 135 15.221 9.759 1.477 874 1HG1 ILE 135 1HG1 ILE 135 17.260 9.111 0.285 875 2HG1 ILE 135 2HG1 ILE 135 16.282 7.710 0.722 876 1HG2 ILE 135 1HG2 ILE 135 13.616 8.402 -0.723 877 2HG2 ILE 135 2HG2 ILE 135 13.897 7.736 0.911 878 3HG2 ILE 135 3HG2 ILE 135 12.974 9.223 0.691 879 1HD1 ILE 135 1HD1 ILE 135 16.452 8.900 -2.068 880 2HD1 ILE 135 2HD1 ILE 135 17.210 7.417 -1.477 881 3HD1 ILE 135 3HD1 ILE 135 15.442 7.511 -1.570 882 H LYS 136 H LYS 136 13.296 11.436 -2.119 883 HA LYS 136 HA LYS 136 11.358 12.238 -0.105 884 1HB LYS 136 1HB LYS 136 11.267 14.578 -0.835 885 2HB LYS 136 2HB LYS 136 12.774 14.182 -0.037 886 1HG LYS 136 1HG LYS 136 14.040 14.523 -1.881 887 2HG LYS 136 2HG LYS 136 12.889 13.737 -2.969 888 1HD LYS 136 1HD LYS 136 11.354 15.625 -2.819 889 2HD LYS 136 2HD LYS 136 12.438 16.458 -1.682 890 1HE LYS 136 1HE LYS 136 14.202 16.562 -3.467 891 2HE LYS 136 2HE LYS 136 13.088 15.773 -4.599 892 1HZ LYS 136 1HZ LYS 136 12.647 18.388 -3.305 893 2HZ LYS 136 2HZ LYS 136 13.094 18.153 -4.870 894 3HZ LYS 136 3HZ LYS 136 11.612 17.659 -4.353 895 H THR 137 H THR 137 11.103 10.176 -1.855 896 HA THR 137 HA THR 137 8.627 11.017 -2.941 897 HB THR 137 HB THR 137 9.688 9.460 -5.142 898 HG1 THR 137 HG1 THR 137 11.313 10.856 -5.890 899 1HG2 THR 137 1HG2 THR 137 8.916 12.396 -4.998 900 2HG2 THR 137 2HG2 THR 137 9.046 11.411 -6.473 901 3HG2 THR 137 3HG2 THR 137 7.824 11.015 -5.249 902 H LEU 138 H LEU 138 7.686 9.525 -1.601 903 HA LEU 138 HA LEU 138 9.182 7.064 -0.965 904 1HB LEU 138 1HB LEU 138 7.428 8.762 0.422 905 2HB LEU 138 2HB LEU 138 6.486 7.286 0.163 906 HG LEU 138 HG LEU 138 8.417 6.066 1.144 907 1HD1 LEU 138 1HD1 LEU 138 9.983 7.270 2.598 908 2HD1 LEU 138 2HD1 LEU 138 10.284 7.612 0.891 909 3HD1 LEU 138 3HD1 LEU 138 9.449 8.815 1.898 910 1HD2 LEU 138 1HD2 LEU 138 7.312 8.237 3.015 911 2HD2 LEU 138 2HD2 LEU 138 6.363 6.845 2.514 912 3HD2 LEU 138 3HD2 LEU 138 7.830 6.637 3.489 913 H THR 139 H THR 139 8.075 4.866 -1.013 914 HA THR 139 HA THR 139 5.948 4.674 -2.859 915 HB THR 139 HB THR 139 7.803 4.756 -4.534 916 HG1 THR 139 HG1 THR 139 6.179 3.396 -5.183 917 1HG2 THR 139 1HG2 THR 139 9.472 3.037 -4.608 918 2HG2 THR 139 2HG2 THR 139 9.472 3.759 -2.964 919 3HG2 THR 139 3HG2 THR 139 8.727 2.161 -3.258 920 H LEU 140 H LEU 140 5.612 2.295 -3.331 921 HA LEU 140 HA LEU 140 6.139 0.491 -1.151 922 1HB LEU 140 1HB LEU 140 4.337 1.749 -0.149 923 2HB LEU 140 2HB LEU 140 3.376 1.741 -1.624 924 HG LEU 140 HG LEU 140 2.565 0.345 0.272 925 1HD1 LEU 140 1HD1 LEU 140 1.691 -1.420 -0.996 926 2HD1 LEU 140 2HD1 LEU 140 1.872 -0.066 -2.124 927 3HD1 LEU 140 3HD1 LEU 140 3.038 -1.414 -2.135 928 1HD2 LEU 140 1HD2 LEU 140 4.900 -1.485 -0.409 929 2HD2 LEU 140 2HD2 LEU 140 4.647 -0.550 1.085 930 3HD2 LEU 140 3HD2 LEU 140 3.543 -1.868 0.676 931 H SER 141 H SER 141 6.926 -0.912 -2.651 932 HA SER 141 HA SER 141 5.461 -1.575 -5.151 933 1HB SER 141 1HB SER 141 8.179 -2.343 -4.140 934 2HB SER 141 2HB SER 141 7.384 -3.098 -5.533 935 HG SER 141 HG SER 141 7.273 -1.123 -6.547 936 H TYR 142 H TYR 142 3.636 -2.556 -4.449 937 HA TYR 142 HA TYR 142 3.787 -4.810 -2.551 938 1HB TYR 142 1HB TYR 142 1.751 -3.047 -3.195 939 2HB TYR 142 2HB TYR 142 1.330 -4.419 -4.196 940 HD1 TYR 142 HD1 TYR 142 2.142 -6.722 -2.380 941 HD2 TYR 142 HD2 TYR 142 -0.006 -3.073 -1.578 942 HE1 TYR 142 HE1 TYR 142 1.657 -7.498 -0.095 943 HE2 TYR 142 HE2 TYR 142 -0.757 -4.014 0.580 944 HH TYR 142 HH TYR 142 -0.649 -6.092 2.008 945 H THR 143 H THR 143 4.033 -6.944 -3.271 946 HA THR 143 HA THR 143 3.829 -7.464 -6.207 947 HB THR 143 HB THR 143 5.669 -8.958 -4.320 948 HG1 THR 143 HG1 THR 143 6.087 -6.492 -5.629 949 1HG2 THR 143 1HG2 THR 143 6.867 -9.411 -6.414 950 2HG2 THR 143 2HG2 THR 143 5.162 -9.867 -6.614 951 3HG2 THR 143 3HG2 THR 143 5.767 -8.358 -7.322 952 H PHE 144 H PHE 144 1.665 -7.947 -6.016 953 HA PHE 144 HA PHE 144 0.637 -10.047 -4.283 954 1HB PHE 144 1HB PHE 144 -0.360 -8.337 -6.549 955 2HB PHE 144 2HB PHE 144 -1.122 -9.886 -6.328 956 HD1 PHE 144 HD1 PHE 144 0.152 -7.668 -3.570 957 HD2 PHE 144 HD2 PHE 144 -3.284 -9.164 -5.704 958 HE1 PHE 144 HE1 PHE 144 -1.336 -6.989 -1.685 959 HE2 PHE 144 HE2 PHE 144 -4.746 -8.430 -3.846 960 HZ PHE 144 HZ PHE 144 -3.753 -7.402 -1.803 961 H TYR 145 H TYR 145 2.322 -11.632 -4.568 962 HA TYR 145 HA TYR 145 1.529 -13.532 -6.702 963 1HB TYR 145 1HB TYR 145 3.694 -13.825 -7.573 964 2HB TYR 145 2HB TYR 145 3.316 -12.106 -7.622 965 HD1 TYR 145 HD1 TYR 145 5.944 -12.797 -8.207 966 HD2 TYR 145 HD2 TYR 145 4.222 -12.374 -4.262 967 HE1 TYR 145 HE1 TYR 145 8.184 -12.328 -7.252 968 HE2 TYR 145 HE2 TYR 145 6.432 -11.923 -3.343 969 HH TYR 145 HH TYR 145 8.683 -11.721 -3.767 970 HA PRO 146 HA PRO 146 2.992 -15.602 -2.735 971 1HB PRO 146 1HB PRO 146 0.715 -16.302 -1.393 972 2HB PRO 146 2HB PRO 146 1.528 -14.724 -1.242 973 1HG PRO 146 1HG PRO 146 -0.901 -15.365 -2.936 974 2HG PRO 146 2HG PRO 146 -0.587 -13.975 -1.882 975 1HD PRO 146 1HD PRO 146 -0.168 -13.958 -4.623 976 2HD PRO 146 2HD PRO 146 0.759 -12.932 -3.472 977 H ARG 147 H ARG 147 -0.241 -17.022 -3.618 978 HA ARG 147 HA ARG 147 1.045 -19.270 -4.959 979 1HB ARG 147 1HB ARG 147 0.215 -20.945 -3.289 980 2HB ARG 147 2HB ARG 147 1.637 -20.022 -2.838 981 1HG ARG 147 1HG ARG 147 0.716 -19.312 -0.956 982 2HG ARG 147 2HG ARG 147 -0.674 -18.619 -1.787 983 1HD ARG 147 1HD ARG 147 -0.431 -21.568 -1.044 984 2HD ARG 147 2HD ARG 147 -1.240 -20.329 -0.057 985 HE ARG 147 HE ARG 147 -2.213 -20.234 -2.745 986 1HH1 ARG 147 1HH1 ARG 147 -2.519 -22.186 0.169 987 2HH1 ARG 147 2HH1 ARG 147 -4.167 -22.657 -0.118 988 1HH2 ARG 147 1HH2 ARG 147 -4.335 -20.864 -3.203 989 2HH2 ARG 147 2HH2 ARG 147 -5.263 -21.826 -2.096 990 H GLU 148 H GLU 148 -0.300 -19.423 -6.663 991 HA GLU 148 HA GLU 148 -3.167 -19.083 -6.331 992 1HB GLU 148 1HB GLU 148 -3.251 -19.661 -8.734 993 2HB GLU 148 2HB GLU 148 -2.208 -18.285 -8.363 994 1HG GLU 148 1HG GLU 148 -0.194 -19.639 -8.682 995 2HG GLU 148 2HG GLU 148 -1.158 -21.118 -8.820 996 HA PRO 149 HA PRO 149 -3.766 -23.651 -6.061 997 1HB PRO 149 1HB PRO 149 -6.466 -23.737 -6.475 998 2HB PRO 149 2HB PRO 149 -5.745 -23.264 -4.913 999 1HG PRO 149 1HG PRO 149 -6.873 -21.464 -7.050 1000 2HG PRO 149 2HG PRO 149 -7.042 -21.324 -5.285 1001 1HD PRO 149 1HD PRO 149 -5.222 -19.932 -6.880 1002 2HD PRO 149 2HD PRO 149 -4.990 -20.240 -5.129 1003 H SER 150 H SER 150 -5.480 -21.553 -8.407 1004 HA SER 150 HA SER 150 -3.997 -22.015 -10.622 1005 1HB SER 150 1HB SER 150 -4.931 -24.363 -10.675 1006 2HB SER 150 2HB SER 150 -6.559 -23.675 -10.717 1007 HG SER 150 HG SER 150 -4.478 -23.573 -12.637 1008 H LYS 151 H LYS 151 -5.952 -21.517 -12.545 1009 HA LYS 151 HA LYS 151 -7.994 -19.736 -11.606 1010 1HB LYS 151 1HB LYS 151 -7.301 -17.642 -12.626 1011 2HB LYS 151 2HB LYS 151 -6.228 -18.095 -11.321 1012 1HG LYS 151 1HG LYS 151 -5.520 -18.633 -14.237 1013 2HG LYS 151 2HG LYS 151 -5.211 -17.096 -13.450 1014 1HD LYS 151 1HD LYS 151 -3.630 -18.028 -11.925 1015 2HD LYS 151 2HD LYS 151 -4.106 -19.681 -12.299 1016 1HE LYS 151 1HE LYS 151 -3.336 -19.414 -14.644 1017 2HE LYS 151 2HE LYS 151 -2.731 -17.793 -14.248 1018 1HZ LYS 151 1HZ LYS 151 -1.028 -19.612 -14.092 1019 2HZ LYS 151 2HZ LYS 151 -1.239 -18.834 -12.640 1020 3HZ LYS 151 3HZ LYS 151 -1.893 -20.240 -12.810 Start of MODEL 15 1 H VAL 21 H VAL 21 -2.053 11.769 15.067 2 HA VAL 21 HA VAL 21 -3.588 9.243 14.618 3 HB VAL 21 HB VAL 21 -3.154 9.658 16.882 4 1HG1 VAL 21 1HG1 VAL 21 -4.069 11.491 18.195 5 2HG1 VAL 21 2HG1 VAL 21 -2.938 12.118 16.997 6 3HG1 VAL 21 3HG1 VAL 21 -4.684 12.293 16.747 7 1HG2 VAL 21 1HG2 VAL 21 -5.270 8.584 16.212 8 2HG2 VAL 21 2HG2 VAL 21 -5.406 9.434 17.759 9 3HG2 VAL 21 3HG2 VAL 21 -6.097 10.154 16.296 10 H GLU 22 H GLU 22 -3.681 10.069 12.500 11 HA GLU 22 HA GLU 22 -5.014 10.615 10.777 12 1HB GLU 22 1HB GLU 22 -6.913 10.200 12.517 13 2HB GLU 22 2HB GLU 22 -7.079 11.956 12.488 14 1HG GLU 22 1HG GLU 22 -7.320 11.713 9.906 15 2HG GLU 22 2HG GLU 22 -7.388 9.969 10.183 16 H GLN 23 H GLN 23 -5.489 12.481 9.432 17 HA GLN 23 HA GLN 23 -5.016 14.424 8.467 18 1HB GLN 23 1HB GLN 23 -5.139 15.579 11.274 19 2HB GLN 23 2HB GLN 23 -4.580 16.513 9.875 20 1HG GLN 23 1HG GLN 23 -6.946 16.891 10.312 21 2HG GLN 23 2HG GLN 23 -6.578 16.300 8.688 22 1HE2 GLN 23 1HE2 GLN 23 -7.001 14.531 11.825 23 2HE2 GLN 23 2HE2 GLN 23 -8.277 13.485 11.211 24 H ALA 24 H ALA 24 -3.074 15.524 10.716 25 HA ALA 24 HA ALA 24 -1.654 13.904 11.666 26 1HB ALA 24 1HB ALA 24 -0.577 12.902 9.748 27 2HB ALA 24 2HB ALA 24 0.149 14.464 9.303 28 3HB ALA 24 3HB ALA 24 0.676 13.603 10.754 29 H SER 25 H SER 25 -1.966 17.084 11.042 30 HA SER 25 HA SER 25 0.186 18.349 11.951 31 1HB SER 25 1HB SER 25 -1.961 19.164 10.716 32 2HB SER 25 2HB SER 25 -2.564 19.524 12.342 33 HG SER 25 HG SER 25 -1.450 21.294 11.398 34 H ASP 26 H ASP 26 -0.031 16.449 13.945 35 HA ASP 26 HA ASP 26 0.606 18.290 16.183 36 1HB ASP 26 1HB ASP 26 0.179 16.019 16.788 37 2HB ASP 26 2HB ASP 26 1.204 15.375 15.495 38 H LEU 27 H LEU 27 1.781 16.711 13.191 39 HA LEU 27 HA LEU 27 4.422 18.043 13.452 40 1HB LEU 27 1HB LEU 27 3.453 15.753 11.728 41 2HB LEU 27 2HB LEU 27 5.118 16.332 11.836 42 HG LEU 27 HG LEU 27 3.567 15.196 14.216 43 1HD1 LEU 27 1HD1 LEU 27 4.873 13.143 13.794 44 2HD1 LEU 27 2HD1 LEU 27 3.815 13.570 12.449 45 3HD1 LEU 27 3HD1 LEU 27 5.567 13.881 12.341 46 1HD2 LEU 27 1HD2 LEU 27 5.413 16.658 14.923 47 2HD2 LEU 27 2HD2 LEU 27 5.863 14.975 15.189 48 3HD2 LEU 27 3HD2 LEU 27 6.524 15.848 13.793 49 H ILE 28 H ILE 28 1.842 17.628 11.088 50 HA ILE 28 HA ILE 28 2.898 18.126 8.774 51 HB ILE 28 HB ILE 28 0.255 19.238 9.723 52 1HG1 ILE 28 1HG1 ILE 28 1.126 16.899 7.943 53 2HG1 ILE 28 2HG1 ILE 28 0.604 16.817 9.617 54 1HG2 ILE 28 1HG2 ILE 28 0.897 20.618 7.732 55 2HG2 ILE 28 2HG2 ILE 28 1.173 19.090 6.841 56 3HG2 ILE 28 3HG2 ILE 28 -0.443 19.546 7.422 57 1HD1 ILE 28 1HD1 ILE 28 -1.207 16.118 8.265 58 2HD1 ILE 28 2HD1 ILE 28 -1.660 17.714 8.883 59 3HD1 ILE 28 3HD1 ILE 28 -1.097 17.508 7.207 60 H LEU 29 H LEU 29 3.628 19.511 7.370 61 HA LEU 29 HA LEU 29 4.450 22.190 8.368 62 1HB LEU 29 1HB LEU 29 5.824 20.282 6.433 63 2HB LEU 29 2HB LEU 29 6.318 21.938 6.814 64 HG LEU 29 HG LEU 29 6.370 21.159 9.294 65 1HD1 LEU 29 1HD1 LEU 29 6.455 18.436 7.900 66 2HD1 LEU 29 2HD1 LEU 29 6.914 18.757 9.588 67 3HD1 LEU 29 3HD1 LEU 29 5.248 18.926 9.073 68 1HD2 LEU 29 1HD2 LEU 29 8.345 21.696 7.952 69 2HD2 LEU 29 2HD2 LEU 29 8.664 20.284 8.975 70 3HD2 LEU 29 3HD2 LEU 29 8.335 20.068 7.239 71 H ASP 30 H ASP 30 4.459 20.812 5.078 72 HA ASP 30 HA ASP 30 2.221 22.196 3.997 73 1HB ASP 30 1HB ASP 30 3.381 24.272 4.250 74 2HB ASP 30 2HB ASP 30 4.932 23.579 3.760 75 H GLU 31 H GLU 31 5.541 21.728 2.948 76 HA GLU 31 HA GLU 31 5.420 21.127 0.468 77 1HB GLU 31 1HB GLU 31 7.547 21.145 1.513 78 2HB GLU 31 2HB GLU 31 7.174 19.709 2.467 79 1HG GLU 31 1HG GLU 31 7.261 18.264 0.566 80 2HG GLU 31 2HG GLU 31 7.417 19.647 -0.548 81 H LYS 32 H LYS 32 4.834 19.888 -0.984 82 HA LYS 32 HA LYS 32 3.066 17.633 -0.511 83 1HB LYS 32 1HB LYS 32 2.450 19.091 -2.188 84 2HB LYS 32 2HB LYS 32 4.083 19.265 -2.843 85 1HG LYS 32 1HG LYS 32 4.063 17.275 -3.959 86 2HG LYS 32 2HG LYS 32 2.764 16.571 -2.938 87 1HD LYS 32 1HD LYS 32 1.115 17.991 -3.929 88 2HD LYS 32 2HD LYS 32 2.318 18.996 -4.715 89 1HE LYS 32 1HE LYS 32 1.044 17.350 -6.239 90 2HE LYS 32 2HE LYS 32 2.800 17.460 -6.419 91 1HZ LYS 32 1HZ LYS 32 1.932 15.174 -6.392 92 2HZ LYS 32 2HZ LYS 32 3.062 15.452 -5.229 93 3HZ LYS 32 3HZ LYS 32 1.474 15.373 -4.834 94 H ILE 33 H ILE 33 4.358 16.114 0.520 95 HA ILE 33 HA ILE 33 6.725 14.983 -0.897 96 HB ILE 33 HB ILE 33 6.532 15.233 1.607 97 1HG1 ILE 33 1HG1 ILE 33 8.366 14.152 0.585 98 2HG1 ILE 33 2HG1 ILE 33 7.836 13.241 1.984 99 1HG2 ILE 33 1HG2 ILE 33 5.587 13.434 2.866 100 2HG2 ILE 33 2HG2 ILE 33 4.314 14.229 1.938 101 3HG2 ILE 33 3HG2 ILE 33 4.950 12.662 1.404 102 1HD1 ILE 33 1HD1 ILE 33 8.376 11.642 0.309 103 2HD1 ILE 33 2HD1 ILE 33 6.615 11.654 0.367 104 3HD1 ILE 33 3HD1 ILE 33 7.472 12.514 -0.937 105 H LYS 34 H LYS 34 6.275 13.900 -2.645 106 HA LYS 34 HA LYS 34 3.574 12.878 -3.234 107 1HB LYS 34 1HB LYS 34 4.847 14.148 -4.832 108 2HB LYS 34 2HB LYS 34 6.157 12.969 -4.819 109 1HG LYS 34 1HG LYS 34 3.292 12.115 -5.439 110 2HG LYS 34 2HG LYS 34 4.247 12.887 -6.687 111 1HD LYS 34 1HD LYS 34 5.745 10.774 -5.216 112 2HD LYS 34 2HD LYS 34 4.301 10.213 -5.958 113 1HE LYS 34 1HE LYS 34 5.125 10.964 -8.172 114 2HE LYS 34 2HE LYS 34 6.308 12.050 -7.413 115 1HZ LYS 34 1HZ LYS 34 7.393 10.135 -8.283 116 2HZ LYS 34 2HZ LYS 34 7.529 10.157 -6.635 117 3HZ LYS 34 3HZ LYS 34 6.445 9.136 -7.373 118 H VAL 35 H VAL 35 3.112 10.634 -3.636 119 HA VAL 35 HA VAL 35 5.126 8.630 -2.636 120 HB VAL 35 HB VAL 35 2.265 9.132 -1.925 121 1HG1 VAL 35 1HG1 VAL 35 2.148 6.809 -2.557 122 2HG1 VAL 35 2HG1 VAL 35 3.636 6.436 -1.668 123 3HG1 VAL 35 3HG1 VAL 35 2.156 6.885 -0.802 124 1HG2 VAL 35 1HG2 VAL 35 4.001 10.045 -0.408 125 2HG2 VAL 35 2HG2 VAL 35 2.972 8.846 0.383 126 3HG2 VAL 35 3HG2 VAL 35 4.608 8.390 -0.158 127 H THR 36 H THR 36 5.236 6.930 -4.066 128 HA THR 36 HA THR 36 3.220 6.819 -6.265 129 HB THR 36 HB THR 36 6.214 6.384 -6.367 130 HG1 THR 36 HG1 THR 36 4.340 8.140 -7.569 131 1HG2 THR 36 1HG2 THR 36 5.930 5.919 -8.734 132 2HG2 THR 36 2HG2 THR 36 5.256 4.640 -7.715 133 3HG2 THR 36 3HG2 THR 36 4.162 5.801 -8.507 134 H PHE 37 H PHE 37 1.961 5.333 -5.902 135 HA PHE 37 HA PHE 37 2.569 2.900 -4.333 136 1HB PHE 37 1HB PHE 37 0.069 3.874 -5.782 137 2HB PHE 37 2HB PHE 37 0.178 2.427 -4.803 138 HD1 PHE 37 HD1 PHE 37 -1.356 5.361 -4.686 139 HD2 PHE 37 HD2 PHE 37 1.503 3.134 -2.334 140 HE1 PHE 37 HE1 PHE 37 -2.213 6.397 -2.619 141 HE2 PHE 37 HE2 PHE 37 0.760 4.329 -0.299 142 HZ PHE 37 HZ PHE 37 -1.088 6.010 -0.458 143 H ASP 38 H ASP 38 3.805 1.456 -5.486 144 HA ASP 38 HA ASP 38 3.169 1.059 -8.363 145 1HB ASP 38 1HB ASP 38 5.442 1.701 -7.941 146 2HB ASP 38 2HB ASP 38 5.639 0.470 -6.717 147 H ALA 39 H ALA 39 1.247 -0.067 -8.007 148 HA ALA 39 HA ALA 39 1.275 -2.623 -6.589 149 1HB ALA 39 1HB ALA 39 -0.761 -1.422 -8.499 150 2HB ALA 39 2HB ALA 39 -1.019 -2.824 -7.451 151 3HB ALA 39 3HB ALA 39 -0.755 -1.223 -6.732 152 H ASN 40 H ASN 40 2.040 -4.543 -7.459 153 HA ASN 40 HA ASN 40 1.871 -4.960 -10.407 154 1HB ASN 40 1HB ASN 40 4.038 -6.138 -8.629 155 2HB ASN 40 2HB ASN 40 3.937 -6.123 -10.385 156 1HD2 ASN 40 1HD2 ASN 40 4.398 -4.087 -7.495 157 2HD2 ASN 40 2HD2 ASN 40 5.322 -2.812 -8.312 158 H VAL 41 H VAL 41 1.286 -7.108 -10.992 159 HA VAL 41 HA VAL 41 0.716 -9.031 -8.858 160 HB VAL 41 HB VAL 41 -1.404 -7.926 -9.054 161 1HG1 VAL 41 1HG1 VAL 41 -1.169 -6.781 -11.219 162 2HG1 VAL 41 2HG1 VAL 41 -1.265 -8.339 -12.069 163 3HG1 VAL 41 3HG1 VAL 41 -2.660 -7.727 -11.163 164 1HG2 VAL 41 1HG2 VAL 41 -2.867 -9.715 -9.667 165 2HG2 VAL 41 2HG2 VAL 41 -1.646 -10.459 -10.710 166 3HG2 VAL 41 3HG2 VAL 41 -1.413 -10.430 -8.951 167 H ALA 42 H ALA 42 0.884 -11.117 -9.487 168 HA ALA 42 HA ALA 42 1.273 -11.767 -12.352 169 1HB ALA 42 1HB ALA 42 3.526 -11.807 -11.292 170 2HB ALA 42 2HB ALA 42 2.905 -12.874 -10.013 171 3HB ALA 42 3HB ALA 42 2.977 -13.446 -11.694 172 H ALA 43 H ALA 43 0.710 -14.112 -12.636 173 HA ALA 43 HA ALA 43 -1.824 -14.729 -11.881 174 1HB ALA 43 1HB ALA 43 0.404 -16.748 -12.380 175 2HB ALA 43 2HB ALA 43 -1.340 -17.053 -12.515 176 3HB ALA 43 3HB ALA 43 -0.554 -15.920 -13.629 177 H GLY 44 H GLY 44 1.075 -15.588 -10.100 178 1HA GLY 44 1HA GLY 44 0.477 -17.171 -8.008 179 2HA GLY 44 2HA GLY 44 1.434 -15.712 -7.865 180 H LEU 45 H LEU 45 -0.765 -13.769 -8.271 181 HA LEU 45 HA LEU 45 -2.756 -14.581 -6.217 182 1HB LEU 45 1HB LEU 45 -1.041 -12.339 -6.037 183 2HB LEU 45 2HB LEU 45 -2.620 -11.709 -6.426 184 HG LEU 45 HG LEU 45 -2.521 -13.805 -4.200 185 1HD1 LEU 45 1HD1 LEU 45 -0.768 -11.743 -3.903 186 2HD1 LEU 45 2HD1 LEU 45 -2.248 -10.827 -3.644 187 3HD1 LEU 45 3HD1 LEU 45 -1.876 -12.187 -2.606 188 1HD2 LEU 45 1HD2 LEU 45 -4.346 -12.647 -3.452 189 2HD2 LEU 45 2HD2 LEU 45 -4.208 -11.393 -4.723 190 3HD2 LEU 45 3HD2 LEU 45 -4.582 -13.087 -5.165 191 HA PRO 46 HA PRO 46 -4.574 -14.088 -10.325 192 1HB PRO 46 1HB PRO 46 -6.610 -15.893 -10.117 193 2HB PRO 46 2HB PRO 46 -4.890 -16.387 -10.122 194 1HG PRO 46 1HG PRO 46 -6.682 -15.986 -7.724 195 2HG PRO 46 2HG PRO 46 -5.675 -17.415 -8.123 196 1HD PRO 46 1HD PRO 46 -4.814 -15.415 -6.460 197 2HD PRO 46 2HD PRO 46 -3.692 -16.300 -7.541 198 H TRP 47 H TRP 47 -5.019 -11.955 -8.531 199 HA TRP 47 HA TRP 47 -7.970 -11.683 -8.267 200 1HB TRP 47 1HB TRP 47 -5.760 -10.783 -6.415 201 2HB TRP 47 2HB TRP 47 -7.440 -10.286 -6.277 202 HD1 TRP 47 HD1 TRP 47 -7.605 -13.826 -7.162 203 HE1 TRP 47 HE1 TRP 47 -7.936 -15.306 -5.154 204 HE3 TRP 47 HE3 TRP 47 -6.332 -10.552 -3.401 205 HZ2 TRP 47 HZ2 TRP 47 -7.741 -15.211 -2.364 206 HZ3 TRP 47 HZ3 TRP 47 -5.874 -11.614 -1.200 207 HH2 TRP 47 HH2 TRP 47 -6.817 -13.746 -0.567 208 H GLU 48 H GLU 48 -8.884 -9.637 -8.533 209 HA GLU 48 HA GLU 48 -7.659 -8.035 -10.633 210 1HB GLU 48 1HB GLU 48 -10.123 -8.536 -10.364 211 2HB GLU 48 2HB GLU 48 -10.116 -7.563 -8.891 212 1HG GLU 48 1HG GLU 48 -9.345 -5.611 -10.426 213 2HG GLU 48 2HG GLU 48 -9.839 -6.653 -11.766 214 H PHE 49 H PHE 49 -5.677 -7.484 -9.420 215 HA PHE 49 HA PHE 49 -5.902 -5.883 -7.025 216 1HB PHE 49 1HB PHE 49 -4.114 -7.534 -7.323 217 2HB PHE 49 2HB PHE 49 -3.461 -6.595 -8.663 218 HD1 PHE 49 HD1 PHE 49 -1.275 -6.083 -7.817 219 HD2 PHE 49 HD2 PHE 49 -4.718 -5.281 -5.322 220 HE1 PHE 49 HE1 PHE 49 0.188 -5.192 -6.054 221 HE2 PHE 49 HE2 PHE 49 -3.253 -4.244 -3.655 222 HZ PHE 49 HZ PHE 49 -0.799 -4.218 -3.981 223 H VAL 50 H VAL 50 -6.560 -3.799 -7.229 224 HA VAL 50 HA VAL 50 -5.800 -2.285 -9.654 225 HB VAL 50 HB VAL 50 -8.100 -2.379 -7.825 226 1HG1 VAL 50 1HG1 VAL 50 -7.852 -0.052 -8.227 227 2HG1 VAL 50 2HG1 VAL 50 -7.538 -0.326 -9.965 228 3HG1 VAL 50 3HG1 VAL 50 -9.157 -0.630 -9.276 229 1HG2 VAL 50 1HG2 VAL 50 -7.905 -4.054 -9.713 230 2HG2 VAL 50 2HG2 VAL 50 -9.325 -3.020 -9.867 231 3HG2 VAL 50 3HG2 VAL 50 -7.888 -2.706 -10.859 232 HA PRO 51 HA PRO 51 -3.866 0.529 -6.553 233 1HB PRO 51 1HB PRO 51 -2.508 2.068 -8.371 234 2HB PRO 51 2HB PRO 51 -1.926 0.481 -7.826 235 1HG PRO 51 1HG PRO 51 -3.265 1.196 -10.410 236 2HG PRO 51 2HG PRO 51 -2.010 -0.037 -10.122 237 1HD PRO 51 1HD PRO 51 -4.815 -0.418 -10.331 238 2HD PRO 51 2HD PRO 51 -3.717 -1.663 -9.678 239 H VAL 52 H VAL 52 -4.324 2.778 -6.176 240 HA VAL 52 HA VAL 52 -7.032 3.346 -7.097 241 HB VAL 52 HB VAL 52 -5.492 5.066 -5.130 242 1HG1 VAL 52 1HG1 VAL 52 -7.731 5.243 -4.127 243 2HG1 VAL 52 2HG1 VAL 52 -7.799 5.667 -5.842 244 3HG1 VAL 52 3HG1 VAL 52 -8.376 4.082 -5.302 245 1HG2 VAL 52 1HG2 VAL 52 -4.875 2.952 -4.264 246 2HG2 VAL 52 2HG2 VAL 52 -6.352 3.344 -3.380 247 3HG2 VAL 52 3HG2 VAL 52 -6.413 2.215 -4.740 248 H GLN 53 H GLN 53 -4.001 5.161 -6.816 249 HA GLN 53 HA GLN 53 -4.281 6.246 -9.504 250 1HB GLN 53 1HB GLN 53 -3.497 7.938 -7.082 251 2HB GLN 53 2HB GLN 53 -3.276 8.402 -8.747 252 1HG GLN 53 1HG GLN 53 -5.183 9.570 -8.130 253 2HG GLN 53 2HG GLN 53 -5.761 8.237 -9.137 254 1HE2 GLN 53 1HE2 GLN 53 -4.805 8.302 -5.633 255 2HE2 GLN 53 2HE2 GLN 53 -6.381 7.784 -5.078 256 H ARG 54 H ARG 54 -1.983 6.721 -10.225 257 HA ARG 54 HA ARG 54 -0.168 4.712 -9.308 258 1HB ARG 54 1HB ARG 54 -0.114 5.724 -11.576 259 2HB ARG 54 2HB ARG 54 0.393 7.256 -10.893 260 1HG ARG 54 1HG ARG 54 2.310 6.107 -11.823 261 2HG ARG 54 2HG ARG 54 2.499 6.265 -10.081 262 1HD ARG 54 1HD ARG 54 1.862 3.966 -9.796 263 2HD ARG 54 2HD ARG 54 1.535 3.862 -11.543 264 HE ARG 54 HE ARG 54 4.226 4.714 -11.119 265 1HH1 ARG 54 1HH1 ARG 54 2.307 1.706 -10.766 266 2HH1 ARG 54 2HH1 ARG 54 3.784 0.749 -10.532 267 1HH2 ARG 54 1HH2 ARG 54 6.105 3.235 -10.882 268 2HH2 ARG 54 2HH2 ARG 54 5.705 1.540 -10.571 269 H ASP 55 H ASP 55 -0.621 8.176 -8.532 270 HA ASP 55 HA ASP 55 1.195 7.839 -6.279 271 1HB ASP 55 1HB ASP 55 2.484 9.703 -6.816 272 2HB ASP 55 2HB ASP 55 2.215 9.046 -8.426 273 H ILE 56 H ILE 56 1.073 9.639 -4.710 274 HA ILE 56 HA ILE 56 -1.482 11.098 -4.685 275 HB ILE 56 HB ILE 56 -1.884 10.814 -2.329 276 1HG1 ILE 56 1HG1 ILE 56 0.181 8.637 -2.527 277 2HG1 ILE 56 2HG1 ILE 56 0.476 10.228 -1.773 278 1HG2 ILE 56 1HG2 ILE 56 -1.787 8.198 -3.871 279 2HG2 ILE 56 2HG2 ILE 56 -2.840 8.580 -2.480 280 3HG2 ILE 56 3HG2 ILE 56 -3.058 9.432 -4.017 281 1HD1 ILE 56 1HD1 ILE 56 0.079 8.538 -0.065 282 2HD1 ILE 56 2HD1 ILE 56 -1.080 9.869 -0.027 283 3HD1 ILE 56 3HD1 ILE 56 -1.565 8.283 -0.680 284 H ASP 57 H ASP 57 -1.433 12.979 -3.294 285 HA ASP 57 HA ASP 57 1.239 14.234 -3.098 286 1HB ASP 57 1HB ASP 57 -0.131 16.248 -3.664 287 2HB ASP 57 2HB ASP 57 -0.350 14.973 -4.904 288 H VAL 58 H VAL 58 1.591 13.555 -0.836 289 HA VAL 58 HA VAL 58 -0.472 14.494 1.097 290 HB VAL 58 HB VAL 58 -0.152 12.478 1.790 291 1HG1 VAL 58 1HG1 VAL 58 1.452 11.654 0.104 292 2HG1 VAL 58 2HG1 VAL 58 2.774 12.355 1.069 293 3HG1 VAL 58 3HG1 VAL 58 1.787 11.056 1.729 294 1HG2 VAL 58 1HG2 VAL 58 1.228 12.402 3.749 295 2HG2 VAL 58 2HG2 VAL 58 2.298 13.668 3.118 296 3HG2 VAL 58 3HG2 VAL 58 0.619 14.052 3.566 297 H ARG 59 H ARG 59 -0.248 16.252 2.286 298 HA ARG 59 HA ARG 59 2.054 18.051 1.941 299 1HB ARG 59 1HB ARG 59 -0.570 18.198 3.473 300 2HB ARG 59 2HB ARG 59 0.715 19.383 3.671 301 1HG ARG 59 1HG ARG 59 -1.054 20.105 2.150 302 2HG ARG 59 2HG ARG 59 0.546 20.107 1.396 303 1HD ARG 59 1HD ARG 59 0.098 18.122 0.162 304 2HD ARG 59 2HD ARG 59 -1.436 17.845 1.050 305 HE ARG 59 HE ARG 59 -1.410 20.405 -0.262 306 1HH1 ARG 59 1HH1 ARG 59 -1.765 16.896 -0.979 307 2HH1 ARG 59 2HH1 ARG 59 -2.677 17.182 -2.400 308 1HH2 ARG 59 1HH2 ARG 59 -2.724 20.695 -2.194 309 2HH2 ARG 59 2HH2 ARG 59 -3.261 19.281 -3.064 310 H ILE 60 H ILE 60 3.775 17.093 2.919 311 HA ILE 60 HA ILE 60 4.285 15.071 4.164 312 HB ILE 60 HB ILE 60 5.404 17.056 6.068 313 1HG1 ILE 60 1HG1 ILE 60 6.293 17.146 3.181 314 2HG1 ILE 60 2HG1 ILE 60 5.402 18.418 4.071 315 1HG2 ILE 60 1HG2 ILE 60 5.982 14.606 5.966 316 2HG2 ILE 60 2HG2 ILE 60 6.680 14.887 4.360 317 3HG2 ILE 60 3HG2 ILE 60 7.375 15.662 5.789 318 1HD1 ILE 60 1HD1 ILE 60 7.656 19.057 4.389 319 2HD1 ILE 60 2HD1 ILE 60 7.206 18.221 5.863 320 3HD1 ILE 60 3HD1 ILE 60 8.178 17.379 4.633 321 H GLY 61 H GLY 61 2.556 14.010 5.047 322 1HA GLY 61 1HA GLY 61 2.289 12.918 7.251 323 2HA GLY 61 2HA GLY 61 2.025 14.508 7.964 324 H GLU 62 H GLU 62 0.486 15.491 5.617 325 HA GLU 62 HA GLU 62 -2.041 14.983 6.642 326 1HB GLU 62 1HB GLU 62 -1.333 16.789 4.994 327 2HB GLU 62 2HB GLU 62 -1.681 15.608 3.709 328 1HG GLU 62 1HG GLU 62 -3.621 17.003 3.989 329 2HG GLU 62 2HG GLU 62 -4.043 15.440 4.700 330 H THR 63 H THR 63 -3.278 13.267 6.879 331 HA THR 63 HA THR 63 -3.046 10.797 5.487 332 HB THR 63 HB THR 63 -5.273 10.500 6.876 333 HG1 THR 63 HG1 THR 63 -5.678 12.717 6.735 334 1HG2 THR 63 1HG2 THR 63 -3.527 9.589 8.022 335 2HG2 THR 63 2HG2 THR 63 -2.507 11.036 7.883 336 3HG2 THR 63 3HG2 THR 63 -3.814 10.986 9.058 337 H VAL 64 H VAL 64 -3.697 10.417 3.436 338 HA VAL 64 HA VAL 64 -6.214 11.670 2.417 339 HB VAL 64 HB VAL 64 -4.240 11.822 1.032 340 1HG1 VAL 64 1HG1 VAL 64 -3.373 9.851 -0.198 341 2HG1 VAL 64 2HG1 VAL 64 -3.004 9.781 1.534 342 3HG1 VAL 64 3HG1 VAL 64 -4.304 8.778 0.853 343 1HG2 VAL 64 1HG2 VAL 64 -6.528 11.693 -0.005 344 2HG2 VAL 64 2HG2 VAL 64 -5.185 11.239 -1.068 345 3HG2 VAL 64 3HG2 VAL 64 -6.188 9.976 -0.356 346 H GLN 65 H GLN 65 -7.709 10.231 1.328 347 HA GLN 65 HA GLN 65 -7.631 7.403 2.188 348 1HB GLN 65 1HB GLN 65 -9.685 8.938 2.903 349 2HB GLN 65 2HB GLN 65 -10.147 8.743 1.209 350 1HG GLN 65 1HG GLN 65 -11.260 6.988 2.286 351 2HG GLN 65 2HG GLN 65 -9.830 6.156 1.665 352 1HE2 GLN 65 1HE2 GLN 65 -7.849 6.112 3.402 353 2HE2 GLN 65 2HE2 GLN 65 -8.366 6.065 5.064 354 H ILE 66 H ILE 66 -7.030 6.031 0.834 355 HA ILE 66 HA ILE 66 -7.946 6.354 -1.966 356 HB ILE 66 HB ILE 66 -5.794 5.402 -2.759 357 1HG1 ILE 66 1HG1 ILE 66 -3.877 6.362 -1.026 358 2HG1 ILE 66 2HG1 ILE 66 -5.004 5.653 0.109 359 1HG2 ILE 66 1HG2 ILE 66 -4.755 7.473 -3.038 360 2HG2 ILE 66 2HG2 ILE 66 -6.487 7.800 -2.948 361 3HG2 ILE 66 3HG2 ILE 66 -5.456 8.134 -1.543 362 1HD1 ILE 66 1HD1 ILE 66 -3.700 4.290 -2.304 363 2HD1 ILE 66 2HD1 ILE 66 -3.331 3.992 -0.595 364 3HD1 ILE 66 3HD1 ILE 66 -4.902 3.512 -1.273 365 H MET 67 H MET 67 -9.300 4.836 -2.251 366 HA MET 67 HA MET 67 -9.323 2.328 -0.765 367 1HB MET 67 1HB MET 67 -11.022 3.144 -3.138 368 2HB MET 67 2HB MET 67 -11.284 1.778 -2.040 369 1HG MET 67 1HG MET 67 -11.328 3.571 -0.151 370 2HG MET 67 2HG MET 67 -11.561 4.735 -1.460 371 1HE MET 67 1HE MET 67 -13.366 2.746 -3.427 372 2HE MET 67 2HE MET 67 -14.979 3.311 -2.965 373 3HE MET 67 3HE MET 67 -13.666 4.490 -3.212 374 H TYR 68 H TYR 68 -7.956 0.721 -1.161 375 HA TYR 68 HA TYR 68 -6.949 0.174 -3.927 376 1HB TYR 68 1HB TYR 68 -6.030 -0.427 -1.178 377 2HB TYR 68 2HB TYR 68 -6.106 -1.853 -2.184 378 HD1 TYR 68 HD1 TYR 68 -4.330 1.294 -1.607 379 HD2 TYR 68 HD2 TYR 68 -4.761 -2.086 -4.243 380 HE1 TYR 68 HE1 TYR 68 -2.040 1.689 -2.491 381 HE2 TYR 68 HE2 TYR 68 -2.466 -1.735 -5.076 382 HH TYR 68 HH TYR 68 -0.478 -0.590 -4.752 383 H ARG 69 H ARG 69 -7.400 -1.955 -4.877 384 HA ARG 69 HA ARG 69 -9.474 -3.494 -3.462 385 1HB ARG 69 1HB ARG 69 -10.730 -2.000 -4.961 386 2HB ARG 69 2HB ARG 69 -9.804 -2.601 -6.346 387 1HG ARG 69 1HG ARG 69 -10.706 -4.867 -6.005 388 2HG ARG 69 2HG ARG 69 -11.524 -4.345 -4.519 389 1HD ARG 69 1HD ARG 69 -13.098 -4.530 -6.291 390 2HD ARG 69 2HD ARG 69 -12.955 -2.841 -5.880 391 HE ARG 69 HE ARG 69 -11.728 -4.221 -8.276 392 1HH1 ARG 69 1HH1 ARG 69 -12.566 -1.053 -6.778 393 2HH1 ARG 69 2HH1 ARG 69 -12.382 -0.222 -8.278 394 1HH2 ARG 69 1HH2 ARG 69 -11.638 -3.243 -10.080 395 2HH2 ARG 69 2HH2 ARG 69 -11.794 -1.492 -10.288 396 H ALA 70 H ALA 70 -9.534 -5.573 -3.754 397 HA ALA 70 HA ALA 70 -8.049 -6.882 -5.939 398 1HB ALA 70 1HB ALA 70 -7.686 -8.825 -4.474 399 2HB ALA 70 2HB ALA 70 -6.779 -7.390 -3.954 400 3HB ALA 70 3HB ALA 70 -8.236 -7.877 -3.081 401 H LYS 71 H LYS 71 -9.342 -8.819 -6.657 402 HA LYS 71 HA LYS 71 -11.796 -9.429 -5.233 403 1HB LYS 71 1HB LYS 71 -11.883 -9.102 -8.273 404 2HB LYS 71 2HB LYS 71 -13.158 -9.670 -7.199 405 1HG LYS 71 1HG LYS 71 -13.015 -7.221 -6.212 406 2HG LYS 71 2HG LYS 71 -12.195 -6.869 -7.742 407 1HD LYS 71 1HD LYS 71 -14.173 -8.201 -8.855 408 2HD LYS 71 2HD LYS 71 -14.958 -8.097 -7.280 409 1HE LYS 71 1HE LYS 71 -15.900 -6.413 -8.623 410 2HE LYS 71 2HE LYS 71 -14.859 -5.557 -7.481 411 1HZ LYS 71 1HZ LYS 71 -14.725 -4.913 -9.931 412 2HZ LYS 71 2HZ LYS 71 -13.264 -5.231 -9.243 413 3HZ LYS 71 3HZ LYS 71 -13.881 -6.320 -10.179 414 H ASN 72 H ASN 72 -12.117 -11.788 -5.493 415 HA ASN 72 HA ASN 72 -9.767 -13.079 -6.677 416 1HB ASN 72 1HB ASN 72 -10.455 -13.843 -4.526 417 2HB ASN 72 2HB ASN 72 -12.063 -14.277 -5.139 418 1HD2 ASN 72 1HD2 ASN 72 -10.938 -16.440 -3.969 419 2HD2 ASN 72 2HD2 ASN 72 -10.261 -17.518 -5.183 420 H LEU 73 H LEU 73 -9.667 -13.293 -8.810 421 HA LEU 73 HA LEU 73 -12.065 -14.220 -10.332 422 1HB LEU 73 1HB LEU 73 -9.579 -12.651 -11.077 423 2HB LEU 73 2HB LEU 73 -10.515 -13.515 -12.295 424 HG LEU 73 HG LEU 73 -12.535 -12.281 -11.792 425 1HD1 LEU 73 1HD1 LEU 73 -12.337 -10.156 -10.445 426 2HD1 LEU 73 2HD1 LEU 73 -12.313 -11.626 -9.472 427 3HD1 LEU 73 3HD1 LEU 73 -10.791 -10.766 -9.817 428 1HD2 LEU 73 1HD2 LEU 73 -10.099 -10.526 -12.325 429 2HD2 LEU 73 2HD2 LEU 73 -10.952 -11.513 -13.531 430 3HD2 LEU 73 3HD2 LEU 73 -11.775 -10.145 -12.766 431 H ALA 74 H ALA 74 -10.551 -16.009 -8.600 432 HA ALA 74 HA ALA 74 -9.778 -18.007 -10.679 433 1HB ALA 74 1HB ALA 74 -9.227 -18.094 -7.679 434 2HB ALA 74 2HB ALA 74 -8.669 -19.247 -8.904 435 3HB ALA 74 3HB ALA 74 -8.040 -17.594 -8.899 436 H SER 75 H SER 75 -10.477 -20.225 -9.976 437 HA SER 75 HA SER 75 -13.393 -20.087 -9.323 438 1HB SER 75 1HB SER 75 -11.888 -22.245 -10.824 439 2HB SER 75 2HB SER 75 -13.642 -22.045 -10.665 440 HG SER 75 HG SER 75 -13.337 -19.950 -11.702 441 H THR 76 H THR 76 -10.871 -20.376 -7.479 442 HA THR 76 HA THR 76 -12.204 -22.204 -5.679 443 HB THR 76 HB THR 76 -9.860 -23.076 -5.002 444 HG1 THR 76 HG1 THR 76 -9.330 -22.352 -7.694 445 1HG2 THR 76 1HG2 THR 76 -9.932 -24.961 -6.541 446 2HG2 THR 76 2HG2 THR 76 -11.585 -24.528 -6.064 447 3HG2 THR 76 3HG2 THR 76 -10.970 -24.068 -7.666 448 HA PRO 77 HA PRO 77 -10.982 -18.845 -3.063 449 1HB PRO 77 1HB PRO 77 -9.987 -20.823 -1.008 450 2HB PRO 77 2HB PRO 77 -11.114 -19.462 -0.766 451 1HG PRO 77 1HG PRO 77 -12.022 -22.032 -0.883 452 2HG PRO 77 2HG PRO 77 -12.926 -20.724 -1.686 453 1HD PRO 77 1HD PRO 77 -10.977 -22.687 -2.926 454 2HD PRO 77 2HD PRO 77 -12.590 -22.179 -3.507 455 H THR 78 H THR 78 -8.986 -17.655 -2.768 456 HA THR 78 HA THR 78 -6.477 -19.295 -2.905 457 HB THR 78 HB THR 78 -5.914 -16.511 -3.452 458 HG1 THR 78 HG1 THR 78 -6.618 -16.620 -5.589 459 1HG2 THR 78 1HG2 THR 78 -4.503 -18.561 -3.879 460 2HG2 THR 78 2HG2 THR 78 -5.622 -18.963 -5.208 461 3HG2 THR 78 3HG2 THR 78 -4.657 -17.469 -5.260 462 H THR 79 H THR 79 -4.631 -18.093 -1.878 463 HA THR 79 HA THR 79 -5.394 -16.782 0.637 464 HB THR 79 HB THR 79 -4.022 -18.736 1.065 465 HG1 THR 79 HG1 THR 79 -2.417 -17.670 2.149 466 1HG2 THR 79 1HG2 THR 79 -2.937 -19.098 -1.113 467 2HG2 THR 79 2HG2 THR 79 -2.009 -17.590 -0.925 468 3HG2 THR 79 3HG2 THR 79 -1.727 -18.957 0.168 469 H GLY 80 H GLY 80 -4.023 -14.880 0.931 470 1HA GLY 80 1HA GLY 80 -2.712 -13.745 -1.410 471 2HA GLY 80 2HA GLY 80 -3.850 -12.724 -0.505 472 H GLN 81 H GLN 81 -1.028 -12.124 -0.472 473 HA GLN 81 HA GLN 81 -0.011 -12.624 2.088 474 1HB GLN 81 1HB GLN 81 0.113 -14.948 0.268 475 2HB GLN 81 2HB GLN 81 1.739 -14.465 0.720 476 1HG GLN 81 1HG GLN 81 -0.337 -14.750 2.909 477 2HG GLN 81 2HG GLN 81 0.318 -16.185 2.131 478 1HE2 GLN 81 1HE2 GLN 81 2.045 -13.018 2.776 479 2HE2 GLN 81 2HE2 GLN 81 3.188 -13.742 3.882 480 H ALA 82 H ALA 82 0.994 -12.802 -1.316 481 HA ALA 82 HA ALA 82 2.445 -11.628 -2.593 482 1HB ALA 82 1HB ALA 82 2.426 -9.202 -2.275 483 2HB ALA 82 2HB ALA 82 0.824 -9.881 -1.981 484 3HB ALA 82 3HB ALA 82 1.869 -9.418 -0.611 485 H THR 83 H THR 83 4.357 -9.970 -2.565 486 HA THR 83 HA THR 83 5.620 -9.766 0.003 487 HB THR 83 HB THR 83 7.400 -10.399 -2.300 488 HG1 THR 83 HG1 THR 83 6.135 -12.006 -0.458 489 1HG2 THR 83 1HG2 THR 83 8.562 -9.015 -0.654 490 2HG2 THR 83 2HG2 THR 83 7.926 -10.016 0.680 491 3HG2 THR 83 3HG2 THR 83 9.111 -10.679 -0.458 492 H PHE 84 H PHE 84 7.017 -7.717 -0.061 493 HA PHE 84 HA PHE 84 6.409 -5.882 -2.242 494 1HB PHE 84 1HB PHE 84 5.277 -4.329 -0.514 495 2HB PHE 84 2HB PHE 84 4.335 -5.664 -1.154 496 HD1 PHE 84 HD1 PHE 84 6.628 -4.984 1.779 497 HD2 PHE 84 HD2 PHE 84 3.165 -7.095 0.290 498 HE1 PHE 84 HE1 PHE 84 6.273 -5.945 3.990 499 HE2 PHE 84 HE2 PHE 84 2.826 -8.087 2.519 500 HZ PHE 84 HZ PHE 84 4.351 -7.501 4.399 501 H ASN 85 H ASN 85 7.324 -3.805 -1.782 502 HA ASN 85 HA ASN 85 9.662 -3.714 0.072 503 1HB ASN 85 1HB ASN 85 10.611 -4.221 -2.032 504 2HB ASN 85 2HB ASN 85 9.425 -3.247 -2.895 505 1HD2 ASN 85 1HD2 ASN 85 9.515 -0.853 -2.489 506 2HD2 ASN 85 2HD2 ASN 85 11.064 -0.085 -2.335 507 H VAL 86 H VAL 86 8.647 -2.433 1.518 508 HA VAL 86 HA VAL 86 6.896 -0.191 0.755 509 HB VAL 86 HB VAL 86 7.793 -1.303 3.450 510 1HG1 VAL 86 1HG1 VAL 86 5.496 0.547 2.697 511 2HG1 VAL 86 2HG1 VAL 86 5.748 -0.154 4.314 512 3HG1 VAL 86 3HG1 VAL 86 6.926 0.984 3.651 513 1HG2 VAL 86 1HG2 VAL 86 6.226 -2.769 1.761 514 2HG2 VAL 86 2HG2 VAL 86 6.097 -2.789 3.528 515 3HG2 VAL 86 3HG2 VAL 86 4.992 -1.807 2.577 516 H THR 87 H THR 87 8.749 1.024 -0.366 517 HA THR 87 HA THR 87 10.042 2.924 1.075 518 HB THR 87 HB THR 87 11.340 1.088 2.141 519 HG1 THR 87 HG1 THR 87 13.416 2.020 1.648 520 1HG2 THR 87 1HG2 THR 87 12.498 0.615 -0.605 521 2HG2 THR 87 2HG2 THR 87 12.999 -0.151 0.915 522 3HG2 THR 87 3HG2 THR 87 11.375 -0.453 0.270 523 HA PRO 88 HA PRO 88 11.248 3.661 -3.241 524 1HB PRO 88 1HB PRO 88 13.157 5.662 -2.835 525 2HB PRO 88 2HB PRO 88 11.422 5.964 -2.993 526 1HG PRO 88 1HG PRO 88 13.084 5.939 -0.515 527 2HG PRO 88 2HG PRO 88 11.610 6.869 -0.860 528 1HD PRO 88 1HD PRO 88 11.742 4.557 0.702 529 2HD PRO 88 2HD PRO 88 10.268 5.187 -0.019 530 H MET 89 H MET 89 13.448 3.665 -0.459 531 HA MET 89 HA MET 89 14.967 1.442 -1.059 532 1HB MET 89 1HB MET 89 17.208 2.799 -1.463 533 2HB MET 89 2HB MET 89 16.229 2.211 -2.791 534 1HG MET 89 1HG MET 89 15.378 4.295 -3.355 535 2HG MET 89 2HG MET 89 15.836 5.068 -1.844 536 1HE MET 89 1HE MET 89 19.653 5.660 -2.338 537 2HE MET 89 2HE MET 89 18.232 5.997 -1.327 538 3HE MET 89 3HE MET 89 18.890 4.341 -1.429 539 H ALA 90 H ALA 90 16.186 4.617 -0.024 540 HA ALA 90 HA ALA 90 17.409 3.593 2.261 541 1HB ALA 90 1HB ALA 90 18.170 5.584 1.073 542 2HB ALA 90 2HB ALA 90 16.691 6.456 1.533 543 3HB ALA 90 3HB ALA 90 17.866 5.966 2.777 544 H ALA 91 H ALA 91 14.220 5.206 2.023 545 HA ALA 91 HA ALA 91 14.085 5.647 4.912 546 1HB ALA 91 1HB ALA 91 12.016 6.042 2.735 547 2HB ALA 91 2HB ALA 91 11.796 6.453 4.457 548 3HB ALA 91 3HB ALA 91 13.055 7.262 3.494 549 H GLY 92 H GLY 92 11.147 4.441 3.563 550 1HA GLY 92 1HA GLY 92 9.906 2.633 3.985 551 2HA GLY 92 2HA GLY 92 11.365 1.713 4.395 552 H ALA 93 H ALA 93 12.316 2.899 6.660 553 HA ALA 93 HA ALA 93 10.819 2.025 8.780 554 1HB ALA 93 1HB ALA 93 13.156 2.738 8.959 555 2HB ALA 93 2HB ALA 93 12.686 4.438 8.745 556 3HB ALA 93 3HB ALA 93 12.170 3.547 10.193 557 H TYR 94 H TYR 94 10.863 5.413 7.620 558 HA TYR 94 HA TYR 94 8.714 6.277 9.330 559 1HB TYR 94 1HB TYR 94 9.912 7.619 6.891 560 2HB TYR 94 2HB TYR 94 9.064 8.403 8.222 561 HD1 TYR 94 HD1 TYR 94 12.153 8.354 6.938 562 HD2 TYR 94 HD2 TYR 94 10.255 7.237 10.654 563 HE1 TYR 94 HE1 TYR 94 14.242 8.813 8.165 564 HE2 TYR 94 HE2 TYR 94 12.345 7.643 11.853 565 HH TYR 94 HH TYR 94 14.494 8.413 11.718 566 H PHE 95 H PHE 95 8.503 4.312 6.643 567 HA PHE 95 HA PHE 95 6.212 5.566 5.441 568 1HB PHE 95 1HB PHE 95 7.736 3.849 4.282 569 2HB PHE 95 2HB PHE 95 7.003 2.618 5.292 570 HD1 PHE 95 HD1 PHE 95 4.410 2.293 5.149 571 HD2 PHE 95 HD2 PHE 95 6.854 4.121 2.106 572 HE1 PHE 95 HE1 PHE 95 2.594 2.001 3.502 573 HE2 PHE 95 HE2 PHE 95 5.026 3.833 0.472 574 HZ PHE 95 HZ PHE 95 2.861 2.844 1.183 575 H ASN 96 H ASN 96 4.747 5.964 7.022 576 HA ASN 96 HA ASN 96 4.566 4.852 9.349 577 1HB ASN 96 1HB ASN 96 2.241 6.084 7.828 578 2HB ASN 96 2HB ASN 96 2.163 5.697 9.552 579 1HD2 ASN 96 1HD2 ASN 96 3.065 8.123 7.339 580 2HD2 ASN 96 2HD2 ASN 96 3.769 9.164 8.570 581 H LYS 97 H LYS 97 2.531 3.496 6.698 582 HA LYS 97 HA LYS 97 1.475 1.411 8.478 583 1HB LYS 97 1HB LYS 97 0.137 2.196 6.573 584 2HB LYS 97 2HB LYS 97 1.358 1.569 5.452 585 1HG LYS 97 1HG LYS 97 1.024 -0.723 6.387 586 2HG LYS 97 2HG LYS 97 -0.181 -0.104 7.512 587 1HD LYS 97 1HD LYS 97 -0.395 0.058 4.465 588 2HD LYS 97 2HD LYS 97 -0.980 -1.305 5.431 589 1HE LYS 97 1HE LYS 97 -2.420 0.334 6.752 590 2HE LYS 97 2HE LYS 97 -1.989 1.577 5.564 591 1HZ LYS 97 1HZ LYS 97 -3.364 -0.975 4.985 592 2HZ LYS 97 2HZ LYS 97 -4.069 0.504 5.048 593 3HZ LYS 97 3HZ LYS 97 -2.976 0.168 3.866 594 H VAL 98 H VAL 98 3.716 1.041 9.274 595 HA VAL 98 HA VAL 98 5.576 -0.468 7.709 596 HB VAL 98 HB VAL 98 6.149 0.731 9.755 597 1HG1 VAL 98 1HG1 VAL 98 4.134 0.214 11.150 598 2HG1 VAL 98 2HG1 VAL 98 4.715 -1.458 11.327 599 3HG1 VAL 98 3HG1 VAL 98 5.661 -0.112 11.976 600 1HG2 VAL 98 1HG2 VAL 98 7.675 -0.899 10.695 601 2HG2 VAL 98 2HG2 VAL 98 6.729 -2.242 10.032 602 3HG2 VAL 98 3HG2 VAL 98 7.578 -1.127 8.940 603 H GLN 99 H GLN 99 2.773 -1.365 9.689 604 HA GLN 99 HA GLN 99 2.178 -3.766 8.306 605 1HB GLN 99 1HB GLN 99 3.715 -3.926 10.910 606 2HB GLN 99 2HB GLN 99 2.318 -4.977 10.768 607 1HG GLN 99 1HG GLN 99 3.345 -6.432 9.456 608 2HG GLN 99 2HG GLN 99 3.904 -5.206 8.328 609 1HE2 GLN 99 1HE2 GLN 99 5.939 -4.147 8.721 610 2HE2 GLN 99 2HE2 GLN 99 7.161 -4.934 9.729 611 H CYS 100 H CYS 100 0.203 -4.782 9.608 612 HA CYS 100 HA CYS 100 -1.133 -3.060 11.493 613 1HB CYS 100 1HB CYS 100 -1.610 -1.786 9.381 614 2HB CYS 100 2HB CYS 100 -2.264 -3.274 8.655 615 HG CYS 100 HG CYS 100 -3.231 -1.669 11.370 616 H PHE 101 H PHE 101 -2.592 -4.371 12.631 617 HA PHE 101 HA PHE 101 -2.704 -7.167 12.265 618 1HB PHE 101 1HB PHE 101 -4.713 -5.297 13.602 619 2HB PHE 101 2HB PHE 101 -4.732 -7.048 13.720 620 HD1 PHE 101 HD1 PHE 101 -2.847 -8.290 14.820 621 HD2 PHE 101 HD2 PHE 101 -3.241 -3.994 15.052 622 HE1 PHE 101 HE1 PHE 101 -1.383 -8.257 16.817 623 HE2 PHE 101 HE2 PHE 101 -1.747 -3.972 17.026 624 HZ PHE 101 HZ PHE 101 -0.827 -6.100 17.921 625 H CYS 102 H CYS 102 -4.921 -4.597 11.174 626 HA CYS 102 HA CYS 102 -6.601 -6.462 9.604 627 1HB CYS 102 1HB CYS 102 -6.580 -3.436 9.937 628 2HB CYS 102 2HB CYS 102 -7.588 -4.282 8.745 629 HG CYS 102 HG CYS 102 -7.473 -4.908 11.966 630 H PHE 103 H PHE 103 -4.434 -7.265 8.755 631 HA PHE 103 HA PHE 103 -3.213 -5.758 6.595 632 1HB PHE 103 1HB PHE 103 -2.111 -7.682 7.738 633 2HB PHE 103 2HB PHE 103 -3.329 -8.763 7.062 634 HD1 PHE 103 HD1 PHE 103 -0.870 -6.119 5.931 635 HD2 PHE 103 HD2 PHE 103 -2.758 -9.906 5.042 636 HE1 PHE 103 HE1 PHE 103 0.465 -6.314 3.840 637 HE2 PHE 103 HE2 PHE 103 -1.300 -10.147 3.055 638 HZ PHE 103 HZ PHE 103 0.267 -8.353 2.428 639 H THR 104 H THR 104 -3.486 -6.378 4.283 640 HA THR 104 HA THR 104 -6.351 -6.384 3.673 641 HB THR 104 HB THR 104 -3.984 -5.988 1.791 642 HG1 THR 104 HG1 THR 104 -5.223 -4.287 3.650 643 1HG2 THR 104 1HG2 THR 104 -6.841 -4.875 1.781 644 2HG2 THR 104 2HG2 THR 104 -5.585 -4.570 0.569 645 3HG2 THR 104 3HG2 THR 104 -6.293 -6.185 0.720 646 H GLU 105 H GLU 105 -4.770 -7.648 1.011 647 HA GLU 105 HA GLU 105 -6.022 -9.934 0.525 648 1HB GLU 105 1HB GLU 105 -3.783 -10.589 -0.553 649 2HB GLU 105 2HB GLU 105 -4.540 -9.090 -1.053 650 1HG GLU 105 1HG GLU 105 -2.872 -7.772 -0.177 651 2HG GLU 105 2HG GLU 105 -2.698 -8.755 1.276 652 H THR 106 H THR 106 -6.544 -11.514 1.900 653 HA THR 106 HA THR 106 -4.414 -13.020 3.347 654 HB THR 106 HB THR 106 -5.363 -11.542 4.967 655 HG1 THR 106 HG1 THR 106 -6.029 -13.131 6.409 656 1HG2 THR 106 1HG2 THR 106 -8.135 -12.723 4.521 657 2HG2 THR 106 2HG2 THR 106 -7.641 -11.453 5.641 658 3HG2 THR 106 3HG2 THR 106 -7.625 -11.127 3.909 659 H THR 107 H THR 107 -7.883 -13.243 2.602 660 HA THR 107 HA THR 107 -7.353 -15.420 0.845 661 HB THR 107 HB THR 107 -7.087 -16.572 2.955 662 HG1 THR 107 HG1 THR 107 -8.043 -17.567 1.016 663 1HG2 THR 107 1HG2 THR 107 -8.663 -15.233 4.273 664 2HG2 THR 107 2HG2 THR 107 -10.020 -15.899 3.332 665 3HG2 THR 107 3HG2 THR 107 -9.049 -16.970 4.376 666 H LEU 108 H LEU 108 -9.219 -15.911 -0.464 667 HA LEU 108 HA LEU 108 -11.737 -14.503 0.070 668 1HB LEU 108 1HB LEU 108 -10.030 -13.992 -2.391 669 2HB LEU 108 2HB LEU 108 -11.740 -13.588 -2.315 670 HG LEU 108 HG LEU 108 -9.576 -12.360 -0.594 671 1HD1 LEU 108 1HD1 LEU 108 -9.724 -10.439 -2.011 672 2HD1 LEU 108 2HD1 LEU 108 -9.528 -11.830 -3.075 673 3HD1 LEU 108 3HD1 LEU 108 -11.128 -11.100 -2.882 674 1HD2 LEU 108 1HD2 LEU 108 -12.515 -11.576 -0.918 675 2HD2 LEU 108 2HD2 LEU 108 -11.828 -12.343 0.527 676 3HD2 LEU 108 3HD2 LEU 108 -11.306 -10.730 0.070 677 H GLU 109 H GLU 109 -13.383 -15.714 -0.683 678 HA GLU 109 HA GLU 109 -12.900 -18.231 -2.021 679 1HB GLU 109 1HB GLU 109 -15.463 -16.817 -1.157 680 2HB GLU 109 2HB GLU 109 -15.355 -18.474 -1.706 681 1HG GLU 109 1HG GLU 109 -13.392 -18.507 0.220 682 2HG GLU 109 2HG GLU 109 -14.523 -17.327 0.899 683 HA PRO 110 HA PRO 110 -12.955 -17.055 -6.070 684 1HB PRO 110 1HB PRO 110 -14.343 -18.905 -7.508 685 2HB PRO 110 2HB PRO 110 -12.853 -19.240 -6.592 686 1HG PRO 110 1HG PRO 110 -15.710 -19.717 -5.721 687 2HG PRO 110 2HG PRO 110 -14.348 -20.873 -5.649 688 1HD PRO 110 1HD PRO 110 -15.128 -19.395 -3.531 689 2HD PRO 110 2HD PRO 110 -13.400 -19.736 -3.790 690 H GLY 111 H GLY 111 -13.835 -15.041 -6.323 691 1HA GLY 111 1HA GLY 111 -15.498 -13.977 -7.842 692 2HA GLY 111 2HA GLY 111 -16.763 -14.797 -6.912 693 H GLU 112 H GLU 112 -14.622 -14.227 -4.475 694 HA GLU 112 HA GLU 112 -16.408 -12.190 -3.658 695 1HB GLU 112 1HB GLU 112 -13.973 -13.436 -2.339 696 2HB GLU 112 2HB GLU 112 -15.051 -12.286 -1.554 697 1HG GLU 112 1HG GLU 112 -15.893 -14.937 -2.629 698 2HG GLU 112 2HG GLU 112 -15.692 -14.492 -0.928 699 H GLU 113 H GLU 113 -16.129 -10.075 -3.226 700 HA GLU 113 HA GLU 113 -13.985 -8.671 -4.673 701 1HB GLU 113 1HB GLU 113 -16.390 -8.080 -5.000 702 2HB GLU 113 2HB GLU 113 -16.495 -7.632 -3.290 703 1HG GLU 113 1HG GLU 113 -14.332 -6.262 -4.727 704 2HG GLU 113 2HG GLU 113 -15.955 -5.997 -5.400 705 H MET 114 H MET 114 -12.463 -7.291 -3.595 706 HA MET 114 HA MET 114 -12.761 -6.918 -0.690 707 1HB MET 114 1HB MET 114 -11.281 -8.939 -1.323 708 2HB MET 114 2HB MET 114 -10.192 -7.836 -2.125 709 1HG MET 114 1HG MET 114 -9.904 -6.620 0.059 710 2HG MET 114 2HG MET 114 -11.133 -7.702 0.740 711 1HE MET 114 1HE MET 114 -8.203 -9.026 2.773 712 2HE MET 114 2HE MET 114 -8.587 -7.326 2.399 713 3HE MET 114 3HE MET 114 -9.888 -8.495 2.755 714 H GLU 115 H GLU 115 -13.549 -4.821 -1.728 715 HA GLU 115 HA GLU 115 -11.300 -3.012 -2.419 716 1HB GLU 115 1HB GLU 115 -13.447 -2.859 -3.638 717 2HB GLU 115 2HB GLU 115 -14.253 -2.357 -2.154 718 1HG GLU 115 1HG GLU 115 -13.062 -0.296 -2.071 719 2HG GLU 115 2HG GLU 115 -11.767 -0.878 -3.119 720 H MET 116 H MET 116 -10.228 -1.872 -0.905 721 HA MET 116 HA MET 116 -11.382 -1.682 1.829 722 1HB MET 116 1HB MET 116 -8.659 -2.752 0.996 723 2HB MET 116 2HB MET 116 -9.062 -2.289 2.659 724 1HG MET 116 1HG MET 116 -10.610 -4.365 1.058 725 2HG MET 116 2HG MET 116 -9.308 -4.740 2.179 726 1HE MET 116 1HE MET 116 -11.178 -6.477 3.167 727 2HE MET 116 2HE MET 116 -12.720 -5.926 3.864 728 3HE MET 116 3HE MET 116 -12.444 -5.789 2.112 729 HA PRO 117 HA PRO 117 -9.730 2.488 1.257 730 1HB PRO 117 1HB PRO 117 -10.199 3.539 3.684 731 2HB PRO 117 2HB PRO 117 -11.508 3.235 2.499 732 1HG PRO 117 1HG PRO 117 -10.667 1.479 4.820 733 2HG PRO 117 2HG PRO 117 -12.292 2.037 4.332 734 1HD PRO 117 1HD PRO 117 -11.274 -0.429 3.650 735 2HD PRO 117 2HD PRO 117 -12.407 0.451 2.575 736 H VAL 118 H VAL 118 -7.736 3.116 1.464 737 HA VAL 118 HA VAL 118 -6.036 2.169 3.735 738 HB VAL 118 HB VAL 118 -5.195 2.970 0.928 739 1HG1 VAL 118 1HG1 VAL 118 -2.893 2.419 1.727 740 2HG1 VAL 118 2HG1 VAL 118 -3.582 3.880 2.441 741 3HG1 VAL 118 3HG1 VAL 118 -3.523 2.382 3.390 742 1HG2 VAL 118 1HG2 VAL 118 -6.044 0.670 1.048 743 2HG2 VAL 118 2HG2 VAL 118 -4.287 0.659 0.851 744 3HG2 VAL 118 3HG2 VAL 118 -5.004 0.332 2.443 745 H VAL 119 H VAL 119 -5.520 3.716 5.090 746 HA VAL 119 HA VAL 119 -5.554 6.541 4.231 747 HB VAL 119 HB VAL 119 -6.837 6.229 6.250 748 1HG1 VAL 119 1HG1 VAL 119 -4.340 5.059 7.556 749 2HG1 VAL 119 2HG1 VAL 119 -5.869 5.455 8.355 750 3HG1 VAL 119 3HG1 VAL 119 -5.819 4.154 7.161 751 1HG2 VAL 119 1HG2 VAL 119 -5.699 7.850 7.660 752 2HG2 VAL 119 2HG2 VAL 119 -4.150 7.509 6.865 753 3HG2 VAL 119 3HG2 VAL 119 -5.475 8.265 5.951 754 H PHE 120 H PHE 120 -3.501 7.458 3.955 755 HA PHE 120 HA PHE 120 -1.222 6.219 5.199 756 1HB PHE 120 1HB PHE 120 -1.491 4.752 3.164 757 2HB PHE 120 2HB PHE 120 -1.414 6.202 2.160 758 HD1 PHE 120 HD1 PHE 120 0.716 6.607 1.176 759 HD2 PHE 120 HD2 PHE 120 0.520 4.677 5.032 760 HE1 PHE 120 HE1 PHE 120 3.191 6.720 1.377 761 HE2 PHE 120 HE2 PHE 120 2.957 5.037 5.309 762 HZ PHE 120 HZ PHE 120 4.284 6.036 3.487 763 H PHE 121 H PHE 121 0.621 7.567 5.181 764 HA PHE 121 HA PHE 121 0.767 10.027 3.721 765 1HB PHE 121 1HB PHE 121 0.771 11.281 5.863 766 2HB PHE 121 2HB PHE 121 -0.828 10.746 5.387 767 HD1 PHE 121 HD1 PHE 121 1.614 10.784 7.999 768 HD2 PHE 121 HD2 PHE 121 -1.825 8.642 6.580 769 HE1 PHE 121 HE1 PHE 121 1.517 9.561 10.120 770 HE2 PHE 121 HE2 PHE 121 -1.941 7.396 8.723 771 HZ PHE 121 HZ PHE 121 -0.294 7.878 10.526 772 H VAL 122 H VAL 122 2.811 11.106 4.445 773 HA VAL 122 HA VAL 122 4.887 9.158 5.375 774 HB VAL 122 HB VAL 122 4.847 11.349 3.267 775 1HG1 VAL 122 1HG1 VAL 122 7.227 9.847 4.411 776 2HG1 VAL 122 2HG1 VAL 122 7.255 10.642 2.821 777 3HG1 VAL 122 3HG1 VAL 122 6.993 11.594 4.283 778 1HG2 VAL 122 1HG2 VAL 122 3.867 9.279 2.498 779 2HG2 VAL 122 2HG2 VAL 122 5.437 9.538 1.726 780 3HG2 VAL 122 3HG2 VAL 122 5.271 8.361 3.057 781 H ASP 123 H ASP 123 5.985 9.875 7.187 782 HA ASP 123 HA ASP 123 5.162 12.541 8.151 783 1HB ASP 123 1HB ASP 123 6.258 10.081 9.484 784 2HB ASP 123 2HB ASP 123 6.507 11.652 10.254 785 HA PRO 124 HA PRO 124 9.028 14.561 7.463 786 1HB PRO 124 1HB PRO 124 8.929 16.613 9.258 787 2HB PRO 124 2HB PRO 124 7.773 16.419 7.921 788 1HG PRO 124 1HG PRO 124 7.377 15.498 10.785 789 2HG PRO 124 2HG PRO 124 6.291 16.555 9.827 790 1HD PRO 124 1HD PRO 124 5.851 13.905 9.975 791 2HD PRO 124 2HD PRO 124 5.600 14.796 8.451 792 H GLU 125 H GLU 125 9.231 12.152 9.027 793 HA GLU 125 HA GLU 125 11.397 12.736 10.973 794 1HB GLU 125 1HB GLU 125 10.432 10.082 9.924 795 2HB GLU 125 2HB GLU 125 11.552 10.374 11.256 796 1HG GLU 125 1HG GLU 125 9.699 11.551 12.492 797 2HG GLU 125 2HG GLU 125 8.599 11.022 11.202 798 H ILE 126 H ILE 126 10.752 11.496 7.652 799 HA ILE 126 HA ILE 126 13.258 10.639 6.975 800 HB ILE 126 HB ILE 126 11.171 10.318 5.726 801 1HG1 ILE 126 1HG1 ILE 126 13.412 11.457 3.986 802 2HG1 ILE 126 2HG1 ILE 126 13.502 9.914 4.859 803 1HG2 ILE 126 1HG2 ILE 126 11.659 13.085 4.520 804 2HG2 ILE 126 2HG2 ILE 126 10.341 11.965 4.148 805 3HG2 ILE 126 3HG2 ILE 126 10.403 12.743 5.732 806 1HD1 ILE 126 1HD1 ILE 126 11.442 9.157 3.732 807 2HD1 ILE 126 2HD1 ILE 126 11.486 10.614 2.704 808 3HD1 ILE 126 3HD1 ILE 126 12.817 9.437 2.645 809 H VAL 127 H VAL 127 12.195 14.031 7.087 810 HA VAL 127 HA VAL 127 14.729 14.993 5.953 811 HB VAL 127 HB VAL 127 13.896 17.219 6.681 812 1HG1 VAL 127 1HG1 VAL 127 11.951 15.580 5.004 813 2HG1 VAL 127 2HG1 VAL 127 12.129 17.345 4.996 814 3HG1 VAL 127 3HG1 VAL 127 13.458 16.322 4.430 815 1HG2 VAL 127 1HG2 VAL 127 11.628 17.530 7.448 816 2HG2 VAL 127 2HG2 VAL 127 11.290 15.796 7.408 817 3HG2 VAL 127 3HG2 VAL 127 12.424 16.455 8.605 818 H LYS 128 H LYS 128 15.594 13.244 7.695 819 HA LYS 128 HA LYS 128 16.926 14.839 9.738 820 1HB LYS 128 1HB LYS 128 15.274 12.444 10.641 821 2HB LYS 128 2HB LYS 128 16.492 13.294 11.592 822 1HG LYS 128 1HG LYS 128 15.173 15.379 11.373 823 2HG LYS 128 2HG LYS 128 13.986 14.485 10.385 824 1HD LYS 128 1HD LYS 128 13.376 13.039 12.192 825 2HD LYS 128 2HD LYS 128 14.616 13.728 13.244 826 1HE LYS 128 1HE LYS 128 12.239 14.587 13.638 827 2HE LYS 128 2HE LYS 128 13.507 15.814 13.447 828 1HZ LYS 128 1HZ LYS 128 11.607 15.032 11.293 829 2HZ LYS 128 2HZ LYS 128 11.545 16.379 12.208 830 3HZ LYS 128 3HZ LYS 128 12.802 16.144 11.186 831 HA PRO 129 HA PRO 129 19.566 11.012 9.422 832 1HB PRO 129 1HB PRO 129 18.865 8.748 7.985 833 2HB PRO 129 2HB PRO 129 18.543 9.011 9.718 834 1HG PRO 129 1HG PRO 129 16.684 9.453 7.377 835 2HG PRO 129 2HG PRO 129 16.367 8.647 8.929 836 1HD PRO 129 1HD PRO 129 15.605 11.222 8.524 837 2HD PRO 129 2HD PRO 129 16.274 10.657 10.090 838 H VAL 130 H VAL 130 21.281 10.815 8.117 839 HA VAL 130 HA VAL 130 21.565 12.447 5.807 840 HB VAL 130 HB VAL 130 23.336 10.328 7.085 841 1HG1 VAL 130 1HG1 VAL 130 24.066 10.726 4.786 842 2HG1 VAL 130 2HG1 VAL 130 23.975 12.486 5.034 843 3HG1 VAL 130 3HG1 VAL 130 25.181 11.514 5.908 844 1HG2 VAL 130 1HG2 VAL 130 23.275 13.370 7.364 845 2HG2 VAL 130 2HG2 VAL 130 22.828 12.203 8.626 846 3HG2 VAL 130 3HG2 VAL 130 24.500 12.293 8.065 847 H GLU 131 H GLU 131 21.185 9.023 6.455 848 HA GLU 131 HA GLU 131 21.538 7.712 4.058 849 1HB GLU 131 1HB GLU 131 19.336 7.198 6.069 850 2HB GLU 131 2HB GLU 131 20.055 6.073 4.908 851 1HG GLU 131 1HG GLU 131 21.396 5.528 6.621 852 2HG GLU 131 2HG GLU 131 22.344 6.920 6.158 853 H THR 132 H THR 132 18.835 9.861 4.897 854 HA THR 132 HA THR 132 17.503 9.018 2.365 855 HB THR 132 HB THR 132 15.431 9.830 3.359 856 HG1 THR 132 HG1 THR 132 16.996 10.367 5.685 857 1HG2 THR 132 1HG2 THR 132 16.036 7.470 3.747 858 2HG2 THR 132 2HG2 THR 132 16.893 7.911 5.238 859 3HG2 THR 132 3HG2 THR 132 15.141 8.135 5.124 860 H GLN 133 H GLN 133 17.716 11.846 4.425 861 HA GLN 133 HA GLN 133 17.746 14.097 3.922 862 1HB GLN 133 1HB GLN 133 20.031 12.739 4.318 863 2HB GLN 133 2HB GLN 133 20.439 13.364 2.760 864 1HG GLN 133 1HG GLN 133 21.298 14.900 4.354 865 2HG GLN 133 2HG GLN 133 19.905 15.702 3.626 866 1HE2 GLN 133 1HE2 GLN 133 19.022 13.171 5.961 867 2HE2 GLN 133 2HE2 GLN 133 18.892 14.229 7.331 868 H GLY 134 H GLY 134 16.162 13.479 1.825 869 1HA GLY 134 1HA GLY 134 16.245 15.326 -0.127 870 2HA GLY 134 2HA GLY 134 17.527 14.242 -0.697 871 H ILE 135 H ILE 135 16.242 11.794 0.390 872 HA ILE 135 HA ILE 135 14.632 11.008 -1.756 873 HB ILE 135 HB ILE 135 14.804 10.040 1.087 874 1HG1 ILE 135 1HG1 ILE 135 16.697 9.690 -0.583 875 2HG1 ILE 135 2HG1 ILE 135 16.021 8.242 0.164 876 1HG2 ILE 135 1HG2 ILE 135 13.063 8.840 -1.112 877 2HG2 ILE 135 2HG2 ILE 135 13.532 8.023 0.403 878 3HG2 ILE 135 3HG2 ILE 135 12.512 9.457 0.442 879 1HD1 ILE 135 1HD1 ILE 135 15.169 9.159 -2.608 880 2HD1 ILE 135 2HD1 ILE 135 16.486 8.013 -2.283 881 3HD1 ILE 135 3HD1 ILE 135 14.836 7.609 -1.796 882 H LYS 136 H LYS 136 12.657 11.487 -2.433 883 HA LYS 136 HA LYS 136 10.498 11.707 -0.532 884 1HB LYS 136 1HB LYS 136 9.601 13.841 -1.475 885 2HB LYS 136 2HB LYS 136 10.863 13.862 -0.241 886 1HG LYS 136 1HG LYS 136 12.580 14.332 -1.887 887 2HG LYS 136 2HG LYS 136 11.416 14.212 -3.222 888 1HD LYS 136 1HD LYS 136 10.099 16.043 -2.323 889 2HD LYS 136 2HD LYS 136 10.987 16.004 -0.797 890 1HE LYS 136 1HE LYS 136 13.024 16.837 -1.853 891 2HE LYS 136 2HE LYS 136 12.267 16.809 -3.458 892 1HZ LYS 136 1HZ LYS 136 11.202 18.431 -1.222 893 2HZ LYS 136 2HZ LYS 136 12.282 19.030 -2.321 894 3HZ LYS 136 3HZ LYS 136 10.772 18.518 -2.751 895 H THR 137 H THR 137 10.541 9.668 -1.887 896 HA THR 137 HA THR 137 7.958 10.133 -2.661 897 HB THR 137 HB THR 137 9.466 8.537 -4.798 898 HG1 THR 137 HG1 THR 137 9.011 11.062 -4.799 899 1HG2 THR 137 1HG2 THR 137 6.531 8.981 -4.353 900 2HG2 THR 137 2HG2 THR 137 7.301 8.148 -5.737 901 3HG2 THR 137 3HG2 THR 137 7.392 7.444 -4.136 902 H LEU 138 H LEU 138 7.246 9.013 -0.952 903 HA LEU 138 HA LEU 138 8.891 6.771 -0.110 904 1HB LEU 138 1HB LEU 138 7.520 8.588 1.262 905 2HB LEU 138 2HB LEU 138 6.318 7.275 1.281 906 HG LEU 138 HG LEU 138 8.449 5.844 1.866 907 1HD1 LEU 138 1HD1 LEU 138 10.040 7.050 3.298 908 2HD1 LEU 138 2HD1 LEU 138 10.175 7.548 1.600 909 3HD1 LEU 138 3HD1 LEU 138 9.343 8.596 2.778 910 1HD2 LEU 138 1HD2 LEU 138 8.088 6.167 4.268 911 2HD2 LEU 138 2HD2 LEU 138 7.286 7.708 3.989 912 3HD2 LEU 138 3HD2 LEU 138 6.534 6.219 3.405 913 H THR 139 H THR 139 8.754 5.345 -1.785 914 HA THR 139 HA THR 139 6.163 4.692 -2.893 915 HB THR 139 HB THR 139 9.015 4.323 -3.665 916 HG1 THR 139 HG1 THR 139 6.578 4.682 -5.055 917 1HG2 THR 139 1HG2 THR 139 6.943 2.379 -4.774 918 2HG2 THR 139 2HG2 THR 139 8.571 2.675 -5.398 919 3HG2 THR 139 3HG2 THR 139 8.379 1.939 -3.806 920 H LEU 140 H LEU 140 5.237 2.694 -3.090 921 HA LEU 140 HA LEU 140 6.231 0.529 -1.304 922 1HB LEU 140 1HB LEU 140 4.169 1.413 -0.353 923 2HB LEU 140 2HB LEU 140 3.382 1.466 -1.937 924 HG LEU 140 HG LEU 140 3.273 -0.972 -2.039 925 1HD1 LEU 140 1HD1 LEU 140 5.308 -1.613 -0.846 926 2HD1 LEU 140 2HD1 LEU 140 4.686 -0.840 0.632 927 3HD1 LEU 140 3HD1 LEU 140 3.908 -2.306 -0.007 928 1HD2 LEU 140 1HD2 LEU 140 1.721 -1.288 -0.093 929 2HD2 LEU 140 2HD2 LEU 140 2.323 0.219 0.610 930 3HD2 LEU 140 3HD2 LEU 140 1.446 0.250 -0.936 931 H SER 141 H SER 141 7.084 -0.872 -2.826 932 HA SER 141 HA SER 141 5.708 -1.213 -5.458 933 1HB SER 141 1HB SER 141 8.135 -0.740 -5.608 934 2HB SER 141 2HB SER 141 8.447 -2.213 -4.665 935 HG SER 141 HG SER 141 7.117 -2.029 -7.196 936 H TYR 142 H TYR 142 4.290 -2.799 -5.488 937 HA TYR 142 HA TYR 142 4.277 -4.759 -3.236 938 1HB TYR 142 1HB TYR 142 2.585 -2.723 -3.615 939 2HB TYR 142 2HB TYR 142 1.817 -3.844 -4.725 940 HD1 TYR 142 HD1 TYR 142 0.972 -2.516 -1.926 941 HD2 TYR 142 HD2 TYR 142 2.113 -6.457 -3.248 942 HE1 TYR 142 HE1 TYR 142 -0.207 -3.527 0.014 943 HE2 TYR 142 HE2 TYR 142 0.983 -7.428 -1.330 944 HH TYR 142 HH TYR 142 -0.393 -7.080 0.442 945 H THR 143 H THR 143 4.442 -6.906 -3.887 946 HA THR 143 HA THR 143 3.903 -7.555 -6.745 947 HB THR 143 HB THR 143 5.827 -8.951 -4.862 948 HG1 THR 143 HG1 THR 143 7.404 -7.648 -5.870 949 1HG2 THR 143 1HG2 THR 143 5.673 -8.757 -7.908 950 2HG2 THR 143 2HG2 THR 143 6.823 -9.729 -6.965 951 3HG2 THR 143 3HG2 THR 143 5.098 -10.138 -6.954 952 H PHE 144 H PHE 144 1.715 -8.044 -6.432 953 HA PHE 144 HA PHE 144 0.788 -10.127 -4.621 954 1HB PHE 144 1HB PHE 144 -0.288 -8.526 -6.925 955 2HB PHE 144 2HB PHE 144 -0.970 -10.113 -6.699 956 HD1 PHE 144 HD1 PHE 144 0.099 -7.924 -3.853 957 HD2 PHE 144 HD2 PHE 144 -3.167 -9.405 -6.251 958 HE1 PHE 144 HE1 PHE 144 -1.526 -7.061 -2.196 959 HE2 PHE 144 HE2 PHE 144 -4.778 -8.524 -4.599 960 HZ PHE 144 HZ PHE 144 -3.958 -7.314 -2.582 961 H TYR 145 H TYR 145 2.237 -11.864 -4.837 962 HA TYR 145 HA TYR 145 1.838 -13.514 -7.280 963 1HB TYR 145 1HB TYR 145 4.160 -13.777 -7.652 964 2HB TYR 145 2HB TYR 145 3.820 -12.060 -7.562 965 HD1 TYR 145 HD1 TYR 145 3.795 -12.893 -4.141 966 HD2 TYR 145 HD2 TYR 145 6.533 -12.713 -7.487 967 HE1 TYR 145 HE1 TYR 145 5.647 -13.092 -2.626 968 HE2 TYR 145 HE2 TYR 145 8.426 -12.634 -5.880 969 HH TYR 145 HH TYR 145 7.889 -12.670 -2.342 970 HA PRO 146 HA PRO 146 3.016 -15.863 -3.276 971 1HB PRO 146 1HB PRO 146 0.783 -16.448 -1.791 972 2HB PRO 146 2HB PRO 146 1.726 -14.938 -1.669 973 1HG PRO 146 1HG PRO 146 -0.825 -15.379 -3.261 974 2HG PRO 146 2HG PRO 146 -0.442 -14.062 -2.138 975 1HD PRO 146 1HD PRO 146 -0.087 -13.824 -4.837 976 2HD PRO 146 2HD PRO 146 1.020 -13.050 -3.653 977 H ARG 147 H ARG 147 -0.352 -17.007 -4.154 978 HA ARG 147 HA ARG 147 0.799 -19.580 -5.064 979 1HB ARG 147 1HB ARG 147 -1.103 -19.267 -2.707 980 2HB ARG 147 2HB ARG 147 -0.596 -20.801 -3.411 981 1HG ARG 147 1HG ARG 147 1.265 -18.812 -2.006 982 2HG ARG 147 2HG ARG 147 0.519 -20.212 -1.258 983 1HD ARG 147 1HD ARG 147 1.627 -21.751 -2.783 984 2HD ARG 147 2HD ARG 147 2.378 -20.451 -3.680 985 HE ARG 147 HE ARG 147 3.049 -21.471 -0.993 986 1HH1 ARG 147 1HH1 ARG 147 3.694 -18.891 -3.361 987 2HH1 ARG 147 2HH1 ARG 147 5.297 -18.578 -2.787 988 1HH2 ARG 147 1HH2 ARG 147 5.142 -20.996 -0.179 989 2HH2 ARG 147 2HH2 ARG 147 6.106 -19.753 -0.906 990 H GLU 148 H GLU 148 -0.325 -20.151 -6.831 991 HA GLU 148 HA GLU 148 -3.175 -19.349 -7.127 992 1HB GLU 148 1HB GLU 148 -2.396 -18.041 -8.704 993 2HB GLU 148 2HB GLU 148 -0.821 -18.832 -8.789 994 1HG GLU 148 1HG GLU 148 -1.757 -18.916 -10.920 995 2HG GLU 148 2HG GLU 148 -1.753 -20.562 -10.308 996 HA PRO 149 HA PRO 149 -3.122 -23.893 -7.388 997 1HB PRO 149 1HB PRO 149 -5.769 -24.404 -7.109 998 2HB PRO 149 2HB PRO 149 -4.769 -23.819 -5.747 999 1HG PRO 149 1HG PRO 149 -6.525 -22.163 -7.586 1000 2HG PRO 149 2HG PRO 149 -6.520 -22.161 -5.798 1001 1HD PRO 149 1HD PRO 149 -5.149 -20.327 -7.243 1002 2HD PRO 149 2HD PRO 149 -4.458 -20.988 -5.730 1003 H SER 150 H SER 150 -4.803 -21.628 -9.487 1004 HA SER 150 HA SER 150 -4.518 -22.168 -11.909 1005 1HB SER 150 1HB SER 150 -4.660 -24.585 -11.861 1006 2HB SER 150 2HB SER 150 -6.289 -24.514 -11.133 1007 HG SER 150 HG SER 150 -6.283 -24.849 -13.419 1008 H LYS 151 H LYS 151 -5.523 -20.219 -12.210 1009 HA LYS 151 HA LYS 151 -8.387 -19.909 -11.531 1010 1HB LYS 151 1HB LYS 151 -8.048 -17.604 -11.853 1011 2HB LYS 151 2HB LYS 151 -6.791 -18.253 -10.830 1012 1HG LYS 151 1HG LYS 151 -5.192 -17.462 -12.105 1013 2HG LYS 151 2HG LYS 151 -5.785 -18.143 -13.579 1014 1HD LYS 151 1HD LYS 151 -6.848 -15.553 -12.290 1015 2HD LYS 151 2HD LYS 151 -5.553 -15.624 -13.473 1016 1HE LYS 151 1HE LYS 151 -7.598 -14.913 -14.530 1017 2HE LYS 151 2HE LYS 151 -7.076 -16.466 -15.200 1018 1HZ LYS 151 1HZ LYS 151 -8.764 -17.553 -14.056 1019 2HZ LYS 151 2HZ LYS 151 -9.173 -16.246 -13.113 1020 3HZ LYS 151 3HZ LYS 151 -9.493 -16.277 -14.726 Start of MODEL 16 1 H VAL 21 H VAL 21 0.894 10.324 13.975 2 HA VAL 21 HA VAL 21 -0.867 8.095 14.941 3 HB VAL 21 HB VAL 21 -0.936 11.017 15.738 4 1HG1 VAL 21 1HG1 VAL 21 -3.170 9.957 15.807 5 2HG1 VAL 21 2HG1 VAL 21 -2.510 8.610 16.760 6 3HG1 VAL 21 3HG1 VAL 21 -2.572 10.247 17.442 7 1HG2 VAL 21 1HG2 VAL 21 -0.239 10.198 17.996 8 2HG2 VAL 21 2HG2 VAL 21 0.035 8.586 17.301 9 3HG2 VAL 21 3HG2 VAL 21 1.021 9.971 16.782 10 H GLU 22 H GLU 22 -3.000 8.124 13.986 11 HA GLU 22 HA GLU 22 -3.094 9.464 11.391 12 1HB GLU 22 1HB GLU 22 -3.837 7.086 11.850 13 2HB GLU 22 2HB GLU 22 -5.239 7.748 12.706 14 1HG GLU 22 1HG GLU 22 -5.906 8.956 10.647 15 2HG GLU 22 2HG GLU 22 -4.445 8.336 9.828 16 H GLN 23 H GLN 23 -3.386 11.694 11.626 17 HA GLN 23 HA GLN 23 -6.119 12.345 12.129 18 1HB GLN 23 1HB GLN 23 -5.085 14.540 13.513 19 2HB GLN 23 2HB GLN 23 -6.076 13.231 14.173 20 1HG GLN 23 1HG GLN 23 -4.260 13.599 15.633 21 2HG GLN 23 2HG GLN 23 -3.881 12.082 14.820 22 1HE2 GLN 23 1HE2 GLN 23 -1.959 12.029 13.496 23 2HE2 GLN 23 2HE2 GLN 23 -0.987 13.437 13.261 24 H ALA 24 H ALA 24 -3.732 12.836 10.026 25 HA ALA 24 HA ALA 24 -2.553 14.304 11.752 26 1HB ALA 24 1HB ALA 24 -0.771 14.629 10.050 27 2HB ALA 24 2HB ALA 24 -1.468 12.992 10.052 28 3HB ALA 24 3HB ALA 24 -1.997 14.157 8.833 29 H SER 25 H SER 25 -2.336 16.337 12.488 30 HA SER 25 HA SER 25 -2.923 18.673 10.990 31 1HB SER 25 1HB SER 25 -5.287 17.857 11.187 32 2HB SER 25 2HB SER 25 -5.076 17.698 12.941 33 HG SER 25 HG SER 25 -4.652 19.964 12.978 34 H ASP 26 H ASP 26 -0.800 17.984 12.224 35 HA ASP 26 HA ASP 26 -0.428 19.902 14.414 36 1HB ASP 26 1HB ASP 26 -1.099 18.064 15.802 37 2HB ASP 26 2HB ASP 26 -0.275 16.870 14.792 38 H LEU 27 H LEU 27 0.895 16.998 12.872 39 HA LEU 27 HA LEU 27 3.590 18.026 12.923 40 1HB LEU 27 1HB LEU 27 4.138 15.788 12.144 41 2HB LEU 27 2HB LEU 27 3.058 15.756 13.530 42 HG LEU 27 HG LEU 27 1.685 15.629 10.865 43 1HD1 LEU 27 1HD1 LEU 27 3.616 14.288 10.364 44 2HD1 LEU 27 2HD1 LEU 27 3.410 13.332 11.849 45 3HD1 LEU 27 3HD1 LEU 27 2.209 13.238 10.544 46 1HD2 LEU 27 1HD2 LEU 27 1.416 14.033 13.450 47 2HD2 LEU 27 2HD2 LEU 27 0.289 15.259 12.850 48 3HD2 LEU 27 3HD2 LEU 27 0.481 13.741 11.979 49 H ILE 28 H ILE 28 1.691 19.486 11.120 50 HA ILE 28 HA ILE 28 2.761 18.744 8.421 51 HB ILE 28 HB ILE 28 0.002 19.739 9.188 52 1HG1 ILE 28 1HG1 ILE 28 0.910 17.143 7.838 53 2HG1 ILE 28 2HG1 ILE 28 0.680 17.285 9.560 54 1HG2 ILE 28 1HG2 ILE 28 1.261 19.054 6.501 55 2HG2 ILE 28 2HG2 ILE 28 -0.454 19.422 6.747 56 3HG2 ILE 28 3HG2 ILE 28 0.753 20.688 7.001 57 1HD1 ILE 28 1HD1 ILE 28 -1.610 17.949 9.380 58 2HD1 ILE 28 2HD1 ILE 28 -1.582 17.749 7.612 59 3HD1 ILE 28 3HD1 ILE 28 -1.317 16.361 8.673 60 H LEU 29 H LEU 29 4.237 20.137 7.949 61 HA LEU 29 HA LEU 29 4.084 22.910 8.978 62 1HB LEU 29 1HB LEU 29 6.383 21.324 7.792 63 2HB LEU 29 2HB LEU 29 6.426 22.969 8.411 64 HG LEU 29 HG LEU 29 7.261 21.635 10.150 65 1HD1 LEU 29 1HD1 LEU 29 4.337 21.853 10.998 66 2HD1 LEU 29 2HD1 LEU 29 5.765 21.830 12.028 67 3HD1 LEU 29 3HD1 LEU 29 5.479 23.223 10.968 68 1HD2 LEU 29 1HD2 LEU 29 6.461 19.394 9.280 69 2HD2 LEU 29 2HD2 LEU 29 6.411 19.593 11.039 70 3HD2 LEU 29 3HD2 LEU 29 4.926 19.697 10.116 71 H ASP 30 H ASP 30 5.093 21.394 5.955 72 HA ASP 30 HA ASP 30 2.946 21.667 4.720 73 1HB ASP 30 1HB ASP 30 3.399 24.395 4.637 74 2HB ASP 30 2HB ASP 30 4.083 23.898 3.112 75 H GLU 31 H GLU 31 6.293 21.113 4.397 76 HA GLU 31 HA GLU 31 6.736 21.067 1.720 77 1HB GLU 31 1HB GLU 31 7.693 18.935 3.661 78 2HB GLU 31 2HB GLU 31 8.361 19.239 2.074 79 1HG GLU 31 1HG GLU 31 8.358 21.320 4.316 80 2HG GLU 31 2HG GLU 31 9.715 20.282 3.873 81 H LYS 32 H LYS 32 6.050 20.231 0.060 82 HA LYS 32 HA LYS 32 3.782 18.463 -0.078 83 1HB LYS 32 1HB LYS 32 4.036 20.509 -1.389 84 2HB LYS 32 2HB LYS 32 5.617 20.003 -1.974 85 1HG LYS 32 1HG LYS 32 4.070 19.839 -3.727 86 2HG LYS 32 2HG LYS 32 4.680 18.243 -3.293 87 1HD LYS 32 1HD LYS 32 2.350 18.020 -3.749 88 2HD LYS 32 2HD LYS 32 2.558 17.831 -2.000 89 1HE LYS 32 1HE LYS 32 1.779 20.176 -1.661 90 2HE LYS 32 2HE LYS 32 1.632 20.386 -3.417 91 1HZ LYS 32 1HZ LYS 32 0.001 18.550 -3.378 92 2HZ LYS 32 2HZ LYS 32 0.134 18.403 -1.823 93 3HZ LYS 32 3HZ LYS 32 -0.523 19.815 -2.420 94 H ILE 33 H ILE 33 4.297 16.356 0.428 95 HA ILE 33 HA ILE 33 6.770 15.105 -0.673 96 HB ILE 33 HB ILE 33 6.842 15.295 1.643 97 1HG1 ILE 33 1HG1 ILE 33 7.097 13.053 2.258 98 2HG1 ILE 33 2HG1 ILE 33 6.075 12.418 0.947 99 1HG2 ILE 33 1HG2 ILE 33 4.578 15.535 2.292 100 2HG2 ILE 33 2HG2 ILE 33 4.161 13.896 1.728 101 3HG2 ILE 33 3HG2 ILE 33 5.247 14.124 3.106 102 1HD1 ILE 33 1HD1 ILE 33 8.487 12.062 0.616 103 2HD1 ILE 33 2HD1 ILE 33 7.840 13.114 -0.651 104 3HD1 ILE 33 3HD1 ILE 33 8.770 13.818 0.706 105 H LYS 34 H LYS 34 6.528 13.644 -2.243 106 HA LYS 34 HA LYS 34 3.927 12.977 -3.360 107 1HB LYS 34 1HB LYS 34 6.383 13.586 -4.330 108 2HB LYS 34 2HB LYS 34 6.502 11.828 -4.354 109 1HG LYS 34 1HG LYS 34 4.152 13.329 -5.599 110 2HG LYS 34 2HG LYS 34 5.705 13.105 -6.451 111 1HD LYS 34 1HD LYS 34 5.503 10.637 -6.133 112 2HD LYS 34 2HD LYS 34 4.029 10.914 -5.283 113 1HE LYS 34 1HE LYS 34 3.682 10.171 -7.557 114 2HE LYS 34 2HE LYS 34 2.768 11.636 -7.006 115 1HZ LYS 34 1HZ LYS 34 4.155 12.904 -8.416 116 2HZ LYS 34 2HZ LYS 34 4.984 11.539 -8.909 117 3HZ LYS 34 3HZ LYS 34 3.342 11.658 -9.153 118 H VAL 35 H VAL 35 3.065 10.716 -3.595 119 HA VAL 35 HA VAL 35 4.736 8.574 -2.422 120 HB VAL 35 HB VAL 35 1.908 9.270 -1.767 121 1HG1 VAL 35 1HG1 VAL 35 3.063 6.474 -1.548 122 2HG1 VAL 35 2HG1 VAL 35 1.603 7.024 -0.723 123 3HG1 VAL 35 3HG1 VAL 35 1.647 6.976 -2.489 124 1HG2 VAL 35 1HG2 VAL 35 3.673 9.999 -0.239 125 2HG2 VAL 35 2HG2 VAL 35 2.508 8.902 0.498 126 3HG2 VAL 35 3HG2 VAL 35 4.116 8.286 0.013 127 H THR 36 H THR 36 4.389 6.623 -3.542 128 HA THR 36 HA THR 36 2.830 6.865 -6.059 129 HB THR 36 HB THR 36 5.815 6.333 -5.886 130 HG1 THR 36 HG1 THR 36 4.165 8.454 -6.361 131 1HG2 THR 36 1HG2 THR 36 3.934 6.235 -8.286 132 2HG2 THR 36 2HG2 THR 36 5.714 6.226 -8.347 133 3HG2 THR 36 3HG2 THR 36 4.854 4.869 -7.603 134 H PHE 37 H PHE 37 1.459 5.363 -5.892 135 HA PHE 37 HA PHE 37 2.006 2.950 -4.307 136 1HB PHE 37 1HB PHE 37 -0.413 3.871 -5.925 137 2HB PHE 37 2HB PHE 37 -0.326 2.407 -4.964 138 HD1 PHE 37 HD1 PHE 37 0.707 2.863 -2.439 139 HD2 PHE 37 HD2 PHE 37 -1.552 5.655 -4.841 140 HE1 PHE 37 HE1 PHE 37 0.411 4.320 -0.471 141 HE2 PHE 37 HE2 PHE 37 -1.988 7.002 -2.799 142 HZ PHE 37 HZ PHE 37 -0.857 6.456 -0.681 143 H ASP 38 H ASP 38 2.928 1.158 -5.212 144 HA ASP 38 HA ASP 38 2.867 0.900 -8.185 145 1HB ASP 38 1HB ASP 38 5.034 1.741 -7.084 146 2HB ASP 38 2HB ASP 38 5.195 0.198 -6.328 147 H ALA 39 H ALA 39 0.910 -0.200 -7.889 148 HA ALA 39 HA ALA 39 0.763 -2.614 -6.327 149 1HB ALA 39 1HB ALA 39 -0.992 -1.570 -8.589 150 2HB ALA 39 2HB ALA 39 -1.398 -2.919 -7.511 151 3HB ALA 39 3HB ALA 39 -1.225 -1.282 -6.850 152 H ASN 40 H ASN 40 1.554 -4.667 -6.895 153 HA ASN 40 HA ASN 40 2.225 -5.138 -9.795 154 1HB ASN 40 1HB ASN 40 3.707 -6.190 -7.454 155 2HB ASN 40 2HB ASN 40 4.224 -6.256 -9.132 156 1HD2 ASN 40 1HD2 ASN 40 3.394 -3.298 -9.302 157 2HD2 ASN 40 2HD2 ASN 40 4.721 -2.457 -8.475 158 H VAL 41 H VAL 41 0.389 -6.173 -10.165 159 HA VAL 41 HA VAL 41 -0.366 -8.611 -8.688 160 HB VAL 41 HB VAL 41 -2.066 -7.093 -9.636 161 1HG1 VAL 41 1HG1 VAL 41 -0.951 -6.524 -11.801 162 2HG1 VAL 41 2HG1 VAL 41 -1.318 -8.165 -12.378 163 3HG1 VAL 41 3HG1 VAL 41 -2.630 -7.056 -11.962 164 1HG2 VAL 41 1HG2 VAL 41 -3.527 -8.881 -10.477 165 2HG2 VAL 41 2HG2 VAL 41 -2.123 -9.937 -10.729 166 3HG2 VAL 41 3HG2 VAL 41 -2.583 -9.441 -9.087 167 H ALA 42 H ALA 42 0.502 -10.587 -9.101 168 HA ALA 42 HA ALA 42 1.585 -11.124 -11.829 169 1HB ALA 42 1HB ALA 42 3.444 -10.807 -10.186 170 2HB ALA 42 2HB ALA 42 2.718 -12.086 -9.183 171 3HB ALA 42 3HB ALA 42 3.340 -12.471 -10.799 172 H ALA 43 H ALA 43 1.626 -13.563 -12.155 173 HA ALA 43 HA ALA 43 -0.746 -14.990 -11.377 174 1HB ALA 43 1HB ALA 43 2.033 -16.011 -12.108 175 2HB ALA 43 2HB ALA 43 0.562 -16.995 -11.962 176 3HB ALA 43 3HB ALA 43 0.676 -15.759 -13.240 177 H GLY 44 H GLY 44 -1.227 -15.838 -9.390 178 1HA GLY 44 1HA GLY 44 0.247 -16.543 -7.183 179 2HA GLY 44 2HA GLY 44 0.484 -14.789 -7.287 180 H LEU 45 H LEU 45 -1.830 -13.870 -8.360 181 HA LEU 45 HA LEU 45 -4.057 -15.164 -6.981 182 1HB LEU 45 1HB LEU 45 -4.112 -12.150 -7.167 183 2HB LEU 45 2HB LEU 45 -5.191 -13.252 -6.326 184 HG LEU 45 HG LEU 45 -3.104 -13.827 -4.829 185 1HD1 LEU 45 1HD1 LEU 45 -1.611 -11.747 -4.658 186 2HD1 LEU 45 2HD1 LEU 45 -1.527 -12.331 -6.346 187 3HD1 LEU 45 3HD1 LEU 45 -2.583 -11.010 -5.931 188 1HD2 LEU 45 1HD2 LEU 45 -3.630 -11.866 -3.385 189 2HD2 LEU 45 2HD2 LEU 45 -4.615 -11.214 -4.708 190 3HD2 LEU 45 3HD2 LEU 45 -5.025 -12.791 -3.959 191 HA PRO 46 HA PRO 46 -5.533 -14.412 -11.215 192 1HB PRO 46 1HB PRO 46 -8.023 -15.460 -10.988 193 2HB PRO 46 2HB PRO 46 -6.558 -16.490 -10.934 194 1HG PRO 46 1HG PRO 46 -8.241 -15.524 -8.643 195 2HG PRO 46 2HG PRO 46 -7.532 -17.140 -8.907 196 1HD PRO 46 1HD PRO 46 -6.353 -15.108 -7.339 197 2HD PRO 46 2HD PRO 46 -5.471 -16.476 -8.073 198 H TRP 47 H TRP 47 -6.321 -12.678 -8.416 199 HA TRP 47 HA TRP 47 -8.865 -11.691 -8.981 200 1HB TRP 47 1HB TRP 47 -6.691 -10.452 -7.262 201 2HB TRP 47 2HB TRP 47 -8.419 -10.104 -7.174 202 HD1 TRP 47 HD1 TRP 47 -8.567 -13.590 -7.611 203 HE1 TRP 47 HE1 TRP 47 -8.590 -14.918 -5.473 204 HE3 TRP 47 HE3 TRP 47 -6.956 -9.976 -4.331 205 HZ2 TRP 47 HZ2 TRP 47 -7.834 -14.578 -2.689 206 HZ3 TRP 47 HZ3 TRP 47 -6.530 -10.637 -1.984 207 HH2 TRP 47 HH2 TRP 47 -6.904 -12.885 -1.169 208 H GLU 48 H GLU 48 -9.619 -9.662 -9.592 209 HA GLU 48 HA GLU 48 -7.958 -8.141 -11.529 210 1HB GLU 48 1HB GLU 48 -10.388 -8.665 -11.914 211 2HB GLU 48 2HB GLU 48 -10.787 -7.693 -10.493 212 1HG GLU 48 1HG GLU 48 -9.733 -5.706 -11.639 213 2HG GLU 48 2HG GLU 48 -9.528 -6.702 -13.090 214 H PHE 49 H PHE 49 -6.339 -7.601 -9.962 215 HA PHE 49 HA PHE 49 -7.035 -5.860 -7.694 216 1HB PHE 49 1HB PHE 49 -5.290 -7.541 -7.393 217 2HB PHE 49 2HB PHE 49 -4.381 -6.848 -8.737 218 HD1 PHE 49 HD1 PHE 49 -6.077 -4.889 -5.969 219 HD2 PHE 49 HD2 PHE 49 -2.339 -6.379 -7.550 220 HE1 PHE 49 HE1 PHE 49 -4.849 -3.786 -4.155 221 HE2 PHE 49 HE2 PHE 49 -1.130 -5.227 -5.747 222 HZ PHE 49 HZ PHE 49 -2.379 -3.930 -4.037 223 H VAL 50 H VAL 50 -7.301 -3.697 -7.991 224 HA VAL 50 HA VAL 50 -5.695 -2.407 -10.152 225 HB VAL 50 HB VAL 50 -7.483 -1.011 -10.777 226 1HG1 VAL 50 1HG1 VAL 50 -8.712 -3.780 -10.421 227 2HG1 VAL 50 2HG1 VAL 50 -9.093 -2.584 -11.669 228 3HG1 VAL 50 3HG1 VAL 50 -7.506 -3.378 -11.670 229 1HG2 VAL 50 1HG2 VAL 50 -9.782 -1.255 -9.749 230 2HG2 VAL 50 2HG2 VAL 50 -9.011 -2.191 -8.452 231 3HG2 VAL 50 3HG2 VAL 50 -8.591 -0.482 -8.694 232 HA PRO 51 HA PRO 51 -4.703 0.431 -6.747 233 1HB PRO 51 1HB PRO 51 -3.258 2.286 -8.092 234 2HB PRO 51 2HB PRO 51 -2.621 0.636 -7.844 235 1HG PRO 51 1HG PRO 51 -4.044 1.718 -10.293 236 2HG PRO 51 2HG PRO 51 -2.492 0.831 -10.239 237 1HD PRO 51 1HD PRO 51 -4.908 -0.375 -10.750 238 2HD PRO 51 2HD PRO 51 -3.592 -1.228 -9.884 239 H VAL 52 H VAL 52 -5.102 2.840 -6.475 240 HA VAL 52 HA VAL 52 -7.720 3.537 -7.637 241 HB VAL 52 HB VAL 52 -7.510 5.411 -5.824 242 1HG1 VAL 52 1HG1 VAL 52 -8.236 2.502 -5.348 243 2HG1 VAL 52 2HG1 VAL 52 -8.722 3.874 -4.315 244 3HG1 VAL 52 3HG1 VAL 52 -9.295 3.775 -5.984 245 1HG2 VAL 52 1HG2 VAL 52 -5.190 4.695 -5.174 246 2HG2 VAL 52 2HG2 VAL 52 -6.364 4.599 -3.838 247 3HG2 VAL 52 3HG2 VAL 52 -5.863 3.127 -4.696 248 H GLN 53 H GLN 53 -4.535 5.001 -7.036 249 HA GLN 53 HA GLN 53 -4.692 6.490 -9.550 250 1HB GLN 53 1HB GLN 53 -3.676 7.724 -6.955 251 2HB GLN 53 2HB GLN 53 -3.558 8.415 -8.550 252 1HG GLN 53 1HG GLN 53 -5.328 9.585 -7.593 253 2HG GLN 53 2HG GLN 53 -6.066 8.463 -8.744 254 1HE2 GLN 53 1HE2 GLN 53 -4.850 7.954 -5.375 255 2HE2 GLN 53 2HE2 GLN 53 -6.394 7.401 -4.762 256 H ARG 54 H ARG 54 -2.358 6.962 -10.167 257 HA ARG 54 HA ARG 54 -0.573 4.789 -9.546 258 1HB ARG 54 1HB ARG 54 -0.408 6.036 -11.640 259 2HB ARG 54 2HB ARG 54 -0.093 7.544 -10.774 260 1HG ARG 54 1HG ARG 54 1.945 6.545 -11.768 261 2HG ARG 54 2HG ARG 54 2.078 6.717 -10.016 262 1HD ARG 54 1HD ARG 54 1.674 4.464 -9.665 263 2HD ARG 54 2HD ARG 54 1.181 4.209 -11.340 264 HE ARG 54 HE ARG 54 3.590 4.812 -11.945 265 1HH1 ARG 54 1HH1 ARG 54 2.822 3.133 -8.806 266 2HH1 ARG 54 2HH1 ARG 54 4.278 2.166 -9.005 267 1HH2 ARG 54 1HH2 ARG 54 5.483 3.318 -11.950 268 2HH2 ARG 54 2HH2 ARG 54 5.569 2.188 -10.592 269 H ASP 55 H ASP 55 -0.857 8.248 -8.447 270 HA ASP 55 HA ASP 55 0.799 7.731 -6.097 271 1HB ASP 55 1HB ASP 55 1.769 9.838 -6.810 272 2HB ASP 55 2HB ASP 55 2.207 8.482 -7.883 273 H ILE 56 H ILE 56 0.891 9.733 -4.847 274 HA ILE 56 HA ILE 56 -1.424 11.498 -4.945 275 HB ILE 56 HB ILE 56 -1.844 11.444 -2.528 276 1HG1 ILE 56 1HG1 ILE 56 -0.077 9.003 -2.646 277 2HG1 ILE 56 2HG1 ILE 56 0.328 10.582 -1.904 278 1HG2 ILE 56 1HG2 ILE 56 -3.150 9.398 -2.521 279 2HG2 ILE 56 2HG2 ILE 56 -3.265 10.199 -4.099 280 3HG2 ILE 56 3HG2 ILE 56 -2.210 8.783 -3.911 281 1HD1 ILE 56 1HD1 ILE 56 -1.857 8.776 -0.816 282 2HD1 ILE 56 2HD1 ILE 56 -0.200 8.854 -0.208 283 3HD1 ILE 56 3HD1 ILE 56 -1.211 10.296 -0.135 284 H ASP 57 H ASP 57 -0.925 13.282 -3.229 285 HA ASP 57 HA ASP 57 1.821 13.190 -2.321 286 1HB ASP 57 1HB ASP 57 2.336 15.418 -2.572 287 2HB ASP 57 2HB ASP 57 1.621 15.036 -4.141 288 H VAL 58 H VAL 58 1.988 14.297 -0.323 289 HA VAL 58 HA VAL 58 -0.459 14.817 1.295 290 HB VAL 58 HB VAL 58 -0.187 12.975 2.413 291 1HG1 VAL 58 1HG1 VAL 58 0.967 11.770 0.670 292 2HG1 VAL 58 2HG1 VAL 58 2.534 12.430 1.190 293 3HG1 VAL 58 3HG1 VAL 58 1.622 11.336 2.236 294 1HG2 VAL 58 1HG2 VAL 58 2.533 13.963 3.341 295 2HG2 VAL 58 2HG2 VAL 58 0.975 14.530 3.960 296 3HG2 VAL 58 3HG2 VAL 58 1.435 12.848 4.171 297 H ARG 59 H ARG 59 0.111 16.797 2.617 298 HA ARG 59 HA ARG 59 2.887 17.822 2.239 299 1HB ARG 59 1HB ARG 59 0.424 18.980 3.580 300 2HB ARG 59 2HB ARG 59 2.057 19.567 3.865 301 1HG ARG 59 1HG ARG 59 1.592 20.949 2.200 302 2HG ARG 59 2HG ARG 59 2.298 19.668 1.255 303 1HD ARG 59 1HD ARG 59 0.252 20.577 0.208 304 2HD ARG 59 2HD ARG 59 0.091 18.850 0.616 305 HE ARG 59 HE ARG 59 -1.595 19.273 1.981 306 1HH1 ARG 59 1HH1 ARG 59 0.265 22.389 1.880 307 2HH1 ARG 59 2HH1 ARG 59 -0.366 22.891 3.320 308 1HH2 ARG 59 1HH2 ARG 59 -2.828 20.264 3.510 309 2HH2 ARG 59 2HH2 ARG 59 -2.491 21.896 4.090 310 H ILE 60 H ILE 60 4.390 17.123 3.573 311 HA ILE 60 HA ILE 60 4.570 15.010 4.987 312 HB ILE 60 HB ILE 60 6.049 16.195 6.748 313 1HG1 ILE 60 1HG1 ILE 60 5.673 18.435 4.713 314 2HG1 ILE 60 2HG1 ILE 60 4.968 18.400 6.320 315 1HG2 ILE 60 1HG2 ILE 60 7.868 16.211 5.122 316 2HG2 ILE 60 2HG2 ILE 60 6.801 14.864 4.794 317 3HG2 ILE 60 3HG2 ILE 60 6.708 16.328 3.783 318 1HD1 ILE 60 1HD1 ILE 60 7.091 19.751 6.101 319 2HD1 ILE 60 2HD1 ILE 60 7.224 18.463 7.308 320 3HD1 ILE 60 3HD1 ILE 60 7.966 18.265 5.711 321 H GLY 61 H GLY 61 2.843 14.074 5.810 322 1HA GLY 61 1HA GLY 61 2.170 13.398 7.981 323 2HA GLY 61 2HA GLY 61 1.837 15.062 8.469 324 H GLU 62 H GLU 62 0.514 15.796 6.008 325 HA GLU 62 HA GLU 62 -2.101 15.605 6.569 326 1HB GLU 62 1HB GLU 62 -0.857 16.895 4.807 327 2HB GLU 62 2HB GLU 62 -1.043 15.488 3.741 328 1HG GLU 62 1HG GLU 62 -3.443 15.793 3.705 329 2HG GLU 62 2HG GLU 62 -3.356 17.004 5.011 330 H THR 63 H THR 63 -3.126 13.813 7.236 331 HA THR 63 HA THR 63 -2.795 11.183 6.189 332 HB THR 63 HB THR 63 -4.844 12.443 8.084 333 HG1 THR 63 HG1 THR 63 -2.236 11.416 8.332 334 1HG2 THR 63 1HG2 THR 63 -4.004 9.552 7.813 335 2HG2 THR 63 2HG2 THR 63 -5.081 10.309 9.012 336 3HG2 THR 63 3HG2 THR 63 -5.595 10.200 7.314 337 H VAL 64 H VAL 64 -3.399 10.743 4.072 338 HA VAL 64 HA VAL 64 -6.176 11.535 3.295 339 HB VAL 64 HB VAL 64 -4.305 12.304 1.879 340 1HG1 VAL 64 1HG1 VAL 64 -3.968 9.345 1.215 341 2HG1 VAL 64 2HG1 VAL 64 -3.346 10.698 0.256 342 3HG1 VAL 64 3HG1 VAL 64 -2.755 10.452 1.907 343 1HG2 VAL 64 1HG2 VAL 64 -6.112 10.460 0.298 344 2HG2 VAL 64 2HG2 VAL 64 -6.665 11.988 1.034 345 3HG2 VAL 64 3HG2 VAL 64 -5.379 11.990 -0.180 346 H GLN 65 H GLN 65 -7.221 9.857 1.844 347 HA GLN 65 HA GLN 65 -7.022 7.096 2.990 348 1HB GLN 65 1HB GLN 65 -9.473 8.558 1.946 349 2HB GLN 65 2HB GLN 65 -9.429 6.965 2.711 350 1HG GLN 65 1HG GLN 65 -8.750 9.605 4.127 351 2HG GLN 65 2HG GLN 65 -10.316 8.813 4.136 352 1HE2 GLN 65 1HE2 GLN 65 -6.828 8.138 5.034 353 2HE2 GLN 65 2HE2 GLN 65 -7.326 7.223 6.450 354 H ILE 66 H ILE 66 -6.559 5.594 1.466 355 HA ILE 66 HA ILE 66 -7.326 6.067 -1.339 356 HB ILE 66 HB ILE 66 -4.963 5.233 -2.000 357 1HG1 ILE 66 1HG1 ILE 66 -3.211 6.517 -0.647 358 2HG1 ILE 66 2HG1 ILE 66 -4.299 6.501 0.718 359 1HG2 ILE 66 1HG2 ILE 66 -6.069 7.420 -2.551 360 2HG2 ILE 66 2HG2 ILE 66 -5.261 8.107 -1.120 361 3HG2 ILE 66 3HG2 ILE 66 -4.309 7.442 -2.466 362 1HD1 ILE 66 1HD1 ILE 66 -3.448 3.963 -0.754 363 2HD1 ILE 66 2HD1 ILE 66 -2.516 4.649 0.582 364 3HD1 ILE 66 3HD1 ILE 66 -4.178 4.126 0.866 365 H MET 67 H MET 67 -8.786 4.526 -1.329 366 HA MET 67 HA MET 67 -8.310 1.981 -0.025 367 1HB MET 67 1HB MET 67 -10.545 2.692 -1.968 368 2HB MET 67 2HB MET 67 -10.543 1.428 -0.731 369 1HG MET 67 1HG MET 67 -10.268 3.354 0.992 370 2HG MET 67 2HG MET 67 -10.662 4.441 -0.337 371 1HE MET 67 1HE MET 67 -12.241 4.427 2.374 372 2HE MET 67 2HE MET 67 -12.630 5.491 0.998 373 3HE MET 67 3HE MET 67 -13.913 4.535 1.777 374 H TYR 68 H TYR 68 -8.885 -0.120 -1.385 375 HA TYR 68 HA TYR 68 -7.703 -0.024 -4.125 376 1HB TYR 68 1HB TYR 68 -6.965 -1.863 -1.814 377 2HB TYR 68 2HB TYR 68 -6.697 -2.305 -3.494 378 HD1 TYR 68 HD1 TYR 68 -5.707 0.130 -0.853 379 HD2 TYR 68 HD2 TYR 68 -4.959 -1.328 -4.843 380 HE1 TYR 68 HE1 TYR 68 -3.643 1.486 -0.963 381 HE2 TYR 68 HE2 TYR 68 -2.850 -0.029 -4.917 382 HH TYR 68 HH TYR 68 -1.915 2.242 -2.347 383 H ARG 69 H ARG 69 -8.231 -2.139 -5.277 384 HA ARG 69 HA ARG 69 -10.676 -3.466 -4.298 385 1HB ARG 69 1HB ARG 69 -10.990 -1.468 -6.144 386 2HB ARG 69 2HB ARG 69 -10.613 -2.828 -7.201 387 1HG ARG 69 1HG ARG 69 -12.864 -3.087 -7.142 388 2HG ARG 69 2HG ARG 69 -12.410 -4.116 -5.785 389 1HD ARG 69 1HD ARG 69 -14.270 -2.776 -5.105 390 2HD ARG 69 2HD ARG 69 -12.827 -2.127 -4.263 391 HE ARG 69 HE ARG 69 -13.026 -0.676 -6.600 392 1HH1 ARG 69 1HH1 ARG 69 -15.368 -1.206 -3.867 393 2HH1 ARG 69 2HH1 ARG 69 -15.860 0.422 -3.869 394 1HH2 ARG 69 1HH2 ARG 69 -13.820 1.469 -6.584 395 2HH2 ARG 69 2HH2 ARG 69 -15.059 1.945 -5.466 396 H ALA 70 H ALA 70 -10.138 -5.630 -4.302 397 HA ALA 70 HA ALA 70 -8.772 -6.651 -6.731 398 1HB ALA 70 1HB ALA 70 -8.136 -7.835 -4.038 399 2HB ALA 70 2HB ALA 70 -7.416 -8.158 -5.623 400 3HB ALA 70 3HB ALA 70 -7.138 -6.601 -4.830 401 H LYS 71 H LYS 71 -10.389 -7.613 -7.806 402 HA LYS 71 HA LYS 71 -12.457 -9.069 -6.211 403 1HB LYS 71 1HB LYS 71 -13.930 -8.034 -7.251 404 2HB LYS 71 2HB LYS 71 -12.688 -7.095 -8.066 405 1HG LYS 71 1HG LYS 71 -12.673 -8.916 -9.829 406 2HG LYS 71 2HG LYS 71 -13.966 -9.712 -8.894 407 1HD LYS 71 1HD LYS 71 -14.885 -8.417 -10.809 408 2HD LYS 71 2HD LYS 71 -15.460 -7.793 -9.254 409 1HE LYS 71 1HE LYS 71 -14.491 -5.754 -9.555 410 2HE LYS 71 2HE LYS 71 -12.962 -6.463 -10.086 411 1HZ LYS 71 1HZ LYS 71 -13.822 -6.805 -12.237 412 2HZ LYS 71 2HZ LYS 71 -15.215 -5.930 -11.871 413 3HZ LYS 71 3HZ LYS 71 -13.653 -5.298 -11.836 414 H ASN 72 H ASN 72 -12.535 -11.160 -6.058 415 HA ASN 72 HA ASN 72 -10.626 -12.701 -7.616 416 1HB ASN 72 1HB ASN 72 -10.893 -13.138 -5.231 417 2HB ASN 72 2HB ASN 72 -12.601 -13.542 -5.465 418 1HD2 ASN 72 1HD2 ASN 72 -12.202 -15.671 -4.597 419 2HD2 ASN 72 2HD2 ASN 72 -11.384 -16.920 -5.543 420 H LEU 73 H LEU 73 -11.487 -12.409 -9.695 421 HA LEU 73 HA LEU 73 -13.920 -13.864 -10.468 422 1HB LEU 73 1HB LEU 73 -11.603 -12.727 -12.080 423 2HB LEU 73 2HB LEU 73 -13.077 -13.404 -12.782 424 HG LEU 73 HG LEU 73 -13.037 -10.995 -10.915 425 1HD1 LEU 73 1HD1 LEU 73 -11.834 -10.503 -12.999 426 2HD1 LEU 73 2HD1 LEU 73 -13.200 -11.121 -13.953 427 3HD1 LEU 73 3HD1 LEU 73 -13.390 -9.660 -12.961 428 1HD2 LEU 73 1HD2 LEU 73 -15.230 -12.115 -10.923 429 2HD2 LEU 73 2HD2 LEU 73 -15.331 -10.627 -11.866 430 3HD2 LEU 73 3HD2 LEU 73 -15.213 -12.188 -12.699 431 H ALA 74 H ALA 74 -12.827 -15.692 -8.984 432 HA ALA 74 HA ALA 74 -11.899 -17.705 -10.975 433 1HB ALA 74 1HB ALA 74 -9.967 -17.018 -9.467 434 2HB ALA 74 2HB ALA 74 -10.923 -17.602 -8.090 435 3HB ALA 74 3HB ALA 74 -10.424 -18.732 -9.359 436 H SER 75 H SER 75 -12.761 -19.791 -10.565 437 HA SER 75 HA SER 75 -15.267 -19.859 -9.167 438 1HB SER 75 1HB SER 75 -13.705 -22.201 -10.296 439 2HB SER 75 2HB SER 75 -15.463 -22.026 -10.112 440 HG SER 75 HG SER 75 -14.854 -21.579 -12.267 441 H THR 76 H THR 76 -12.168 -20.005 -7.868 442 HA THR 76 HA THR 76 -13.013 -21.762 -5.622 443 HB THR 76 HB THR 76 -10.532 -22.405 -5.579 444 HG1 THR 76 HG1 THR 76 -9.628 -20.719 -6.649 445 1HG2 THR 76 1HG2 THR 76 -10.550 -23.943 -7.454 446 2HG2 THR 76 2HG2 THR 76 -12.183 -23.878 -6.757 447 3HG2 THR 76 3HG2 THR 76 -11.822 -23.023 -8.273 448 HA PRO 77 HA PRO 77 -11.430 -18.492 -3.082 449 1HB PRO 77 1HB PRO 77 -10.181 -19.842 -1.014 450 2HB PRO 77 2HB PRO 77 -11.955 -19.737 -1.165 451 1HG PRO 77 1HG PRO 77 -10.165 -21.979 -2.138 452 2HG PRO 77 2HG PRO 77 -11.637 -22.115 -1.129 453 1HD PRO 77 1HD PRO 77 -11.767 -22.503 -3.781 454 2HD PRO 77 2HD PRO 77 -13.044 -21.565 -2.977 455 H THR 78 H THR 78 -9.306 -17.755 -2.235 456 HA THR 78 HA THR 78 -6.836 -18.642 -3.628 457 HB THR 78 HB THR 78 -6.928 -15.940 -4.141 458 HG1 THR 78 HG1 THR 78 -9.236 -15.986 -3.446 459 1HG2 THR 78 1HG2 THR 78 -7.706 -16.378 -6.371 460 2HG2 THR 78 2HG2 THR 78 -6.293 -17.321 -5.842 461 3HG2 THR 78 3HG2 THR 78 -7.932 -18.082 -5.966 462 H THR 79 H THR 79 -5.004 -17.011 -2.865 463 HA THR 79 HA THR 79 -5.756 -15.740 -0.307 464 HB THR 79 HB THR 79 -4.908 -17.930 0.339 465 HG1 THR 79 HG1 THR 79 -4.354 -16.035 1.558 466 1HG2 THR 79 1HG2 THR 79 -3.487 -18.470 -1.606 467 2HG2 THR 79 2HG2 THR 79 -2.368 -17.160 -1.174 468 3HG2 THR 79 3HG2 THR 79 -2.556 -18.559 -0.101 469 H GLY 80 H GLY 80 -4.364 -14.211 0.453 470 1HA GLY 80 1HA GLY 80 -2.603 -12.826 -1.505 471 2HA GLY 80 2HA GLY 80 -3.821 -11.966 -0.600 472 H GLN 81 H GLN 81 -1.271 -14.323 -0.186 473 HA GLN 81 HA GLN 81 -0.349 -13.111 2.398 474 1HB GLN 81 1HB GLN 81 1.276 -15.062 2.452 475 2HB GLN 81 2HB GLN 81 -0.406 -15.302 2.866 476 1HG GLN 81 1HG GLN 81 -0.381 -17.110 1.663 477 2HG GLN 81 2HG GLN 81 -0.493 -16.115 0.238 478 1HE2 GLN 81 1HE2 GLN 81 2.210 -15.118 0.103 479 2HE2 GLN 81 2HE2 GLN 81 3.244 -16.498 -0.208 480 H ALA 82 H ALA 82 -0.346 -11.366 0.637 481 HA ALA 82 HA ALA 82 1.674 -11.554 -1.437 482 1HB ALA 82 1HB ALA 82 0.920 -9.247 -1.912 483 2HB ALA 82 2HB ALA 82 -0.447 -10.378 -1.708 484 3HB ALA 82 3HB ALA 82 -0.025 -9.245 -0.405 485 H THR 83 H THR 83 3.276 -9.587 -1.595 486 HA THR 83 HA THR 83 4.536 -9.080 1.080 487 HB THR 83 HB THR 83 6.066 -9.673 -1.400 488 HG1 THR 83 HG1 THR 83 4.750 -11.492 -0.457 489 1HG2 THR 83 1HG2 THR 83 7.886 -10.165 0.238 490 2HG2 THR 83 2HG2 THR 83 7.356 -8.477 0.353 491 3HG2 THR 83 3HG2 THR 83 6.807 -9.680 1.554 492 H PHE 84 H PHE 84 5.878 -7.003 1.001 493 HA PHE 84 HA PHE 84 5.590 -5.509 -1.441 494 1HB PHE 84 1HB PHE 84 4.674 -3.467 -0.370 495 2HB PHE 84 2HB PHE 84 3.538 -4.800 -0.423 496 HD1 PHE 84 HD1 PHE 84 6.097 -3.335 1.981 497 HD2 PHE 84 HD2 PHE 84 2.159 -5.026 1.430 498 HE1 PHE 84 HE1 PHE 84 5.621 -3.026 4.379 499 HE2 PHE 84 HE2 PHE 84 1.656 -4.586 3.802 500 HZ PHE 84 HZ PHE 84 3.390 -3.632 5.299 501 H ASN 85 H ASN 85 6.864 -3.665 -1.537 502 HA ASN 85 HA ASN 85 9.014 -3.308 0.512 503 1HB ASN 85 1HB ASN 85 10.150 -4.202 -1.341 504 2HB ASN 85 2HB ASN 85 9.155 -3.357 -2.515 505 1HD2 ASN 85 1HD2 ASN 85 9.294 -0.905 -2.448 506 2HD2 ASN 85 2HD2 ASN 85 10.868 -0.187 -2.228 507 H VAL 86 H VAL 86 7.997 -1.719 1.626 508 HA VAL 86 HA VAL 86 6.474 0.396 0.252 509 HB VAL 86 HB VAL 86 5.494 -0.746 2.072 510 1HG1 VAL 86 1HG1 VAL 86 7.416 -1.295 3.514 511 2HG1 VAL 86 2HG1 VAL 86 7.577 0.411 3.966 512 3HG1 VAL 86 3HG1 VAL 86 6.121 -0.484 4.399 513 1HG2 VAL 86 1HG2 VAL 86 5.940 2.118 2.959 514 2HG2 VAL 86 2HG2 VAL 86 4.943 1.656 1.567 515 3HG2 VAL 86 3HG2 VAL 86 4.520 1.089 3.190 516 H THR 87 H THR 87 8.748 0.945 -0.755 517 HA THR 87 HA THR 87 9.792 3.240 0.592 518 HB THR 87 HB THR 87 10.692 1.507 2.009 519 HG1 THR 87 HG1 THR 87 12.652 2.428 2.146 520 1HG2 THR 87 1HG2 THR 87 10.931 -0.301 0.462 521 2HG2 THR 87 2HG2 THR 87 12.241 0.548 -0.399 522 3HG2 THR 87 3HG2 THR 87 12.475 0.012 1.277 523 HA PRO 88 HA PRO 88 11.432 3.611 -3.595 524 1HB PRO 88 1HB PRO 88 13.250 5.681 -3.209 525 2HB PRO 88 2HB PRO 88 11.508 5.957 -3.380 526 1HG PRO 88 1HG PRO 88 13.108 6.045 -0.866 527 2HG PRO 88 2HG PRO 88 11.677 6.956 -1.328 528 1HD PRO 88 1HD PRO 88 11.680 4.710 0.323 529 2HD PRO 88 2HD PRO 88 10.263 5.340 -0.518 530 H MET 89 H MET 89 13.197 3.244 -0.528 531 HA MET 89 HA MET 89 14.999 1.304 -1.200 532 1HB MET 89 1HB MET 89 17.158 2.629 -1.405 533 2HB MET 89 2HB MET 89 16.145 2.574 -2.820 534 1HG MET 89 1HG MET 89 15.228 4.932 -1.899 535 2HG MET 89 2HG MET 89 16.715 4.891 -0.976 536 1HE MET 89 1HE MET 89 16.633 5.144 -5.583 537 2HE MET 89 2HE MET 89 16.191 3.629 -4.777 538 3HE MET 89 3HE MET 89 15.172 5.073 -4.575 539 H ALA 90 H ALA 90 15.289 4.521 0.291 540 HA ALA 90 HA ALA 90 16.636 3.351 2.641 541 1HB ALA 90 1HB ALA 90 17.343 5.687 3.010 542 2HB ALA 90 2HB ALA 90 17.717 5.162 1.355 543 3HB ALA 90 3HB ALA 90 16.316 6.214 1.660 544 H ALA 91 H ALA 91 13.717 5.144 1.771 545 HA ALA 91 HA ALA 91 13.031 5.701 4.580 546 1HB ALA 91 1HB ALA 91 11.385 6.189 2.071 547 2HB ALA 91 2HB ALA 91 11.101 6.819 3.710 548 3HB ALA 91 3HB ALA 91 12.521 7.344 2.795 549 H GLY 92 H GLY 92 10.138 5.049 3.545 550 1HA GLY 92 1HA GLY 92 8.627 3.376 4.155 551 2HA GLY 92 2HA GLY 92 9.921 2.193 3.955 552 H ALA 93 H ALA 93 11.781 2.869 5.811 553 HA ALA 93 HA ALA 93 11.085 1.876 8.258 554 1HB ALA 93 1HB ALA 93 13.387 2.394 7.578 555 2HB ALA 93 2HB ALA 93 13.057 4.136 7.675 556 3HB ALA 93 3HB ALA 93 13.025 3.140 9.146 557 H TYR 94 H TYR 94 10.996 5.409 7.383 558 HA TYR 94 HA TYR 94 9.759 6.091 9.893 559 1HB TYR 94 1HB TYR 94 10.387 7.757 7.438 560 2HB TYR 94 2HB TYR 94 9.868 8.325 9.027 561 HD1 TYR 94 HD1 TYR 94 11.240 7.918 11.071 562 HD2 TYR 94 HD2 TYR 94 12.784 7.228 7.105 563 HE1 TYR 94 HE1 TYR 94 13.511 7.607 12.004 564 HE2 TYR 94 HE2 TYR 94 15.060 6.931 8.046 565 HH TYR 94 HH TYR 94 16.422 6.934 10.055 566 H PHE 95 H PHE 95 8.479 4.899 6.925 567 HA PHE 95 HA PHE 95 6.285 6.460 6.443 568 1HB PHE 95 1HB PHE 95 6.808 4.463 5.021 569 2HB PHE 95 2HB PHE 95 6.395 3.419 6.359 570 HD1 PHE 95 HD1 PHE 95 4.400 6.394 5.106 571 HD2 PHE 95 HD2 PHE 95 4.607 2.099 5.632 572 HE1 PHE 95 HE1 PHE 95 1.971 6.234 4.887 573 HE2 PHE 95 HE2 PHE 95 2.160 1.968 5.291 574 HZ PHE 95 HZ PHE 95 0.836 4.062 4.916 575 H ASN 96 H ASN 96 4.210 6.743 7.258 576 HA ASN 96 HA ASN 96 4.079 6.272 9.949 577 1HB ASN 96 1HB ASN 96 1.929 7.309 8.085 578 2HB ASN 96 2HB ASN 96 1.723 7.211 9.841 579 1HD2 ASN 96 1HD2 ASN 96 3.316 8.937 7.256 580 2HD2 ASN 96 2HD2 ASN 96 4.210 10.056 8.286 581 H LYS 97 H LYS 97 3.576 4.401 11.015 582 HA LYS 97 HA LYS 97 1.326 2.730 10.196 583 1HB LYS 97 1HB LYS 97 2.695 0.679 10.022 584 2HB LYS 97 2HB LYS 97 3.061 1.868 8.769 585 1HG LYS 97 1HG LYS 97 5.003 2.624 10.347 586 2HG LYS 97 2HG LYS 97 4.738 1.102 11.184 587 1HD LYS 97 1HD LYS 97 5.240 -0.186 9.217 588 2HD LYS 97 2HD LYS 97 5.182 1.226 8.156 589 1HE LYS 97 1HE LYS 97 7.197 0.971 10.426 590 2HE LYS 97 2HE LYS 97 7.534 0.364 8.800 591 1HZ LYS 97 1HZ LYS 97 7.659 2.484 7.954 592 2HZ LYS 97 2HZ LYS 97 6.696 3.160 9.113 593 3HZ LYS 97 3HZ LYS 97 8.242 2.729 9.443 594 H VAL 98 H VAL 98 0.470 1.647 11.927 595 HA VAL 98 HA VAL 98 1.734 1.432 14.520 596 HB VAL 98 HB VAL 98 -0.130 2.738 15.615 597 1HG1 VAL 98 1HG1 VAL 98 2.148 3.714 15.337 598 2HG1 VAL 98 2HG1 VAL 98 1.555 4.553 13.878 599 3HG1 VAL 98 3HG1 VAL 98 0.833 4.893 15.457 600 1HG2 VAL 98 1HG2 VAL 98 -0.622 3.917 12.844 601 2HG2 VAL 98 2HG2 VAL 98 -1.720 2.809 13.691 602 3HG2 VAL 98 3HG2 VAL 98 -1.384 4.411 14.363 603 H GLN 99 H GLN 99 -0.270 0.648 16.012 604 HA GLN 99 HA GLN 99 -1.849 -0.862 16.447 605 1HB GLN 99 1HB GLN 99 -2.987 1.029 15.038 606 2HB GLN 99 2HB GLN 99 -3.074 -0.175 13.754 607 1HG GLN 99 1HG GLN 99 -5.167 -0.138 14.895 608 2HG GLN 99 2HG GLN 99 -4.388 -1.659 15.339 609 1HE2 GLN 99 1HE2 GLN 99 -6.253 -1.262 17.041 610 2HE2 GLN 99 2HE2 GLN 99 -5.728 -0.451 18.508 611 H CYS 100 H CYS 100 0.433 -1.975 15.302 612 HA CYS 100 HA CYS 100 1.241 -3.996 14.763 613 1HB CYS 100 1HB CYS 100 -0.677 -5.000 15.990 614 2HB CYS 100 2HB CYS 100 -1.612 -5.038 14.475 615 HG CYS 100 HG CYS 100 -0.767 -7.405 14.930 616 H PHE 101 H PHE 101 1.971 -5.051 12.891 617 HA PHE 101 HA PHE 101 1.671 -3.823 10.408 618 1HB PHE 101 1HB PHE 101 2.289 -6.767 10.875 619 2HB PHE 101 2HB PHE 101 2.738 -5.794 9.483 620 HD1 PHE 101 HD1 PHE 101 3.764 -6.933 12.756 621 HD2 PHE 101 HD2 PHE 101 4.317 -3.773 9.866 622 HE1 PHE 101 HE1 PHE 101 5.872 -6.277 13.871 623 HE2 PHE 101 HE2 PHE 101 6.447 -3.143 10.975 624 HZ PHE 101 HZ PHE 101 7.221 -4.388 12.983 625 H CYS 102 H CYS 102 -0.111 -6.551 11.786 626 HA CYS 102 HA CYS 102 -1.734 -7.943 10.908 627 1HB CYS 102 1HB CYS 102 -2.736 -6.035 12.234 628 2HB CYS 102 2HB CYS 102 -3.109 -5.241 10.688 629 HG CYS 102 HG CYS 102 -4.022 -8.176 11.894 630 H PHE 103 H PHE 103 -0.206 -8.091 8.877 631 HA PHE 103 HA PHE 103 -1.485 -6.867 6.481 632 1HB PHE 103 1HB PHE 103 0.661 -5.944 6.883 633 2HB PHE 103 2HB PHE 103 1.366 -7.543 7.160 634 HD1 PHE 103 HD1 PHE 103 2.957 -7.950 5.487 635 HD2 PHE 103 HD2 PHE 103 -0.886 -6.309 4.364 636 HE1 PHE 103 HE1 PHE 103 3.422 -8.443 3.116 637 HE2 PHE 103 HE2 PHE 103 -0.465 -6.941 2.037 638 HZ PHE 103 HZ PHE 103 1.729 -7.922 1.375 639 H THR 104 H THR 104 -2.788 -8.347 5.594 640 HA THR 104 HA THR 104 -1.629 -9.908 3.687 641 HB THR 104 HB THR 104 -1.139 -11.732 5.193 642 HG1 THR 104 HG1 THR 104 -2.279 -12.256 3.221 643 1HG2 THR 104 1HG2 THR 104 -2.545 -11.131 7.142 644 2HG2 THR 104 2HG2 THR 104 -4.012 -11.523 6.221 645 3HG2 THR 104 3HG2 THR 104 -2.847 -12.796 6.630 646 H GLU 105 H GLU 105 -3.300 -10.556 2.168 647 HA GLU 105 HA GLU 105 -5.971 -9.413 2.733 648 1HB GLU 105 1HB GLU 105 -5.434 -10.810 0.183 649 2HB GLU 105 2HB GLU 105 -6.350 -9.367 0.525 650 1HG GLU 105 1HG GLU 105 -3.288 -9.501 0.364 651 2HG GLU 105 2HG GLU 105 -4.383 -8.957 -0.892 652 H THR 106 H THR 106 -4.566 -12.045 3.860 653 HA THR 106 HA THR 106 -5.220 -14.058 4.561 654 HB THR 106 HB THR 106 -6.742 -12.686 5.818 655 HG1 THR 106 HG1 THR 106 -8.223 -14.305 6.293 656 1HG2 THR 106 1HG2 THR 106 -9.176 -12.538 5.213 657 2HG2 THR 106 2HG2 THR 106 -8.126 -11.504 4.254 658 3HG2 THR 106 3HG2 THR 106 -8.768 -13.004 3.558 659 H THR 107 H THR 107 -7.970 -15.095 3.826 660 HA THR 107 HA THR 107 -7.328 -16.210 1.160 661 HB THR 107 HB THR 107 -7.177 -17.750 3.076 662 HG1 THR 107 HG1 THR 107 -8.378 -19.362 1.931 663 1HG2 THR 107 1HG2 THR 107 -9.233 -18.613 4.052 664 2HG2 THR 107 2HG2 THR 107 -9.155 -16.850 4.293 665 3HG2 THR 107 3HG2 THR 107 -10.199 -17.525 3.024 666 H LEU 108 H LEU 108 -8.910 -15.746 -0.457 667 HA LEU 108 HA LEU 108 -11.350 -14.363 0.426 668 1HB LEU 108 1HB LEU 108 -9.259 -13.052 -0.707 669 2HB LEU 108 2HB LEU 108 -9.991 -13.740 -2.186 670 HG LEU 108 HG LEU 108 -12.148 -12.929 -1.055 671 1HD1 LEU 108 1HD1 LEU 108 -11.106 -12.030 1.004 672 2HD1 LEU 108 2HD1 LEU 108 -10.147 -10.897 0.027 673 3HD1 LEU 108 3HD1 LEU 108 -11.915 -10.733 0.101 674 1HD2 LEU 108 1HD2 LEU 108 -10.235 -11.130 -2.599 675 2HD2 LEU 108 2HD2 LEU 108 -11.488 -12.200 -3.263 676 3HD2 LEU 108 3HD2 LEU 108 -11.962 -10.753 -2.367 677 H GLU 109 H GLU 109 -13.124 -15.216 -0.434 678 HA GLU 109 HA GLU 109 -12.962 -17.734 -1.770 679 1HB GLU 109 1HB GLU 109 -15.395 -16.245 -0.739 680 2HB GLU 109 2HB GLU 109 -15.185 -17.983 -0.983 681 1HG GLU 109 1HG GLU 109 -14.849 -18.011 1.200 682 2HG GLU 109 2HG GLU 109 -13.176 -17.742 0.714 683 HA PRO 110 HA PRO 110 -13.894 -16.811 -5.849 684 1HB PRO 110 1HB PRO 110 -15.764 -18.536 -6.792 685 2HB PRO 110 2HB PRO 110 -14.137 -18.968 -6.229 686 1HG PRO 110 1HG PRO 110 -16.707 -19.176 -4.688 687 2HG PRO 110 2HG PRO 110 -15.431 -20.420 -4.871 688 1HD PRO 110 1HD PRO 110 -15.636 -18.786 -2.756 689 2HD PRO 110 2HD PRO 110 -14.028 -19.302 -3.320 690 H GLY 111 H GLY 111 -14.575 -14.796 -6.338 691 1HA GLY 111 1HA GLY 111 -16.321 -13.693 -7.618 692 2HA GLY 111 2HA GLY 111 -17.526 -14.266 -6.456 693 H GLU 112 H GLU 112 -15.050 -13.689 -4.449 694 HA GLU 112 HA GLU 112 -16.505 -11.496 -3.530 695 1HB GLU 112 1HB GLU 112 -13.982 -12.890 -2.559 696 2HB GLU 112 2HB GLU 112 -14.805 -11.631 -1.650 697 1HG GLU 112 1HG GLU 112 -16.059 -14.209 -2.474 698 2HG GLU 112 2HG GLU 112 -15.521 -13.764 -0.854 699 H GLU 113 H GLU 113 -16.036 -9.388 -3.159 700 HA GLU 113 HA GLU 113 -14.004 -8.104 -4.914 701 1HB GLU 113 1HB GLU 113 -16.466 -7.616 -5.151 702 2HB GLU 113 2HB GLU 113 -16.412 -6.893 -3.543 703 1HG GLU 113 1HG GLU 113 -16.175 -5.081 -4.809 704 2HG GLU 113 2HG GLU 113 -14.476 -5.489 -4.597 705 H MET 114 H MET 114 -12.064 -8.120 -3.623 706 HA MET 114 HA MET 114 -12.203 -7.385 -0.795 707 1HB MET 114 1HB MET 114 -10.461 -8.914 -1.838 708 2HB MET 114 2HB MET 114 -9.812 -7.508 -2.662 709 1HG MET 114 1HG MET 114 -9.842 -6.544 -0.109 710 2HG MET 114 2HG MET 114 -9.709 -8.266 0.213 711 1HE MET 114 1HE MET 114 -8.098 -5.905 -2.639 712 2HE MET 114 2HE MET 114 -7.976 -5.023 -1.105 713 3HE MET 114 3HE MET 114 -6.510 -5.655 -1.881 714 H GLU 115 H GLU 115 -13.402 -5.337 -1.090 715 HA GLU 115 HA GLU 115 -11.868 -3.130 -2.307 716 1HB GLU 115 1HB GLU 115 -13.818 -1.794 -2.000 717 2HB GLU 115 2HB GLU 115 -14.113 -3.305 -2.894 718 1HG GLU 115 1HG GLU 115 -15.302 -4.288 -1.052 719 2HG GLU 115 2HG GLU 115 -14.967 -2.871 -0.032 720 H MET 116 H MET 116 -10.174 -3.823 -0.513 721 HA MET 116 HA MET 116 -10.714 -3.040 2.101 722 1HB MET 116 1HB MET 116 -9.115 -4.790 1.130 723 2HB MET 116 2HB MET 116 -8.014 -3.454 0.726 724 1HG MET 116 1HG MET 116 -8.051 -2.805 3.100 725 2HG MET 116 2HG MET 116 -9.160 -4.163 3.413 726 1HE MET 116 1HE MET 116 -5.838 -5.284 5.206 727 2HE MET 116 2HE MET 116 -6.464 -3.622 5.072 728 3HE MET 116 3HE MET 116 -7.580 -4.974 5.403 729 HA PRO 117 HA PRO 117 -9.444 1.276 1.474 730 1HB PRO 117 1HB PRO 117 -9.744 2.294 3.959 731 2HB PRO 117 2HB PRO 117 -11.113 1.920 2.869 732 1HG PRO 117 1HG PRO 117 -10.056 0.216 5.123 733 2HG PRO 117 2HG PRO 117 -11.742 0.630 4.668 734 1HD PRO 117 1HD PRO 117 -10.476 -1.738 3.958 735 2HD PRO 117 2HD PRO 117 -11.802 -1.002 3.004 736 H VAL 118 H VAL 118 -7.455 2.449 1.928 737 HA VAL 118 HA VAL 118 -5.734 1.479 4.101 738 HB VAL 118 HB VAL 118 -4.821 1.945 1.233 739 1HG1 VAL 118 1HG1 VAL 118 -3.282 3.221 2.681 740 2HG1 VAL 118 2HG1 VAL 118 -3.094 1.805 3.735 741 3HG1 VAL 118 3HG1 VAL 118 -2.506 1.770 2.058 742 1HG2 VAL 118 1HG2 VAL 118 -4.421 -0.375 3.146 743 2HG2 VAL 118 2HG2 VAL 118 -5.495 -0.350 1.730 744 3HG2 VAL 118 3HG2 VAL 118 -3.745 -0.241 1.508 745 H VAL 119 H VAL 119 -4.580 3.184 5.018 746 HA VAL 119 HA VAL 119 -5.521 5.934 4.376 747 HB VAL 119 HB VAL 119 -5.429 6.420 6.693 748 1HG1 VAL 119 1HG1 VAL 119 -6.743 3.659 6.573 749 2HG1 VAL 119 2HG1 VAL 119 -7.215 5.034 7.574 750 3HG1 VAL 119 3HG1 VAL 119 -7.458 5.090 5.819 751 1HG2 VAL 119 1HG2 VAL 119 -4.872 4.727 8.442 752 2HG2 VAL 119 2HG2 VAL 119 -4.295 3.630 7.175 753 3HG2 VAL 119 3HG2 VAL 119 -3.478 5.186 7.461 754 H PHE 120 H PHE 120 -3.753 7.548 4.378 755 HA PHE 120 HA PHE 120 -1.044 6.431 4.774 756 1HB PHE 120 1HB PHE 120 -2.069 5.873 2.402 757 2HB PHE 120 2HB PHE 120 -1.661 7.538 2.033 758 HD1 PHE 120 HD1 PHE 120 0.886 8.229 2.501 759 HD2 PHE 120 HD2 PHE 120 -0.466 4.137 2.424 760 HE1 PHE 120 HE1 PHE 120 3.204 7.444 2.161 761 HE2 PHE 120 HE2 PHE 120 1.832 3.397 1.884 762 HZ PHE 120 HZ PHE 120 3.668 5.067 1.714 763 H PHE 121 H PHE 121 0.452 7.884 5.294 764 HA PHE 121 HA PHE 121 0.515 10.444 4.013 765 1HB PHE 121 1HB PHE 121 0.991 11.588 6.203 766 2HB PHE 121 2HB PHE 121 -0.683 11.290 5.800 767 HD1 PHE 121 HD1 PHE 121 -1.805 9.135 6.866 768 HD2 PHE 121 HD2 PHE 121 1.585 11.253 8.432 769 HE1 PHE 121 HE1 PHE 121 -2.157 8.052 9.067 770 HE2 PHE 121 HE2 PHE 121 1.086 10.364 10.695 771 HZ PHE 121 HZ PHE 121 -0.701 8.654 10.984 772 H VAL 122 H VAL 122 2.683 11.205 3.982 773 HA VAL 122 HA VAL 122 4.778 9.357 4.969 774 HB VAL 122 HB VAL 122 4.975 11.877 3.273 775 1HG1 VAL 122 1HG1 VAL 122 7.048 9.861 4.242 776 2HG1 VAL 122 2HG1 VAL 122 7.304 10.866 2.807 777 3HG1 VAL 122 3HG1 VAL 122 7.062 11.620 4.377 778 1HG2 VAL 122 1HG2 VAL 122 3.835 10.220 2.025 779 2HG2 VAL 122 2HG2 VAL 122 5.511 10.201 1.448 780 3HG2 VAL 122 3HG2 VAL 122 4.932 8.940 2.560 781 H ASP 123 H ASP 123 6.235 10.008 6.568 782 HA ASP 123 HA ASP 123 5.223 11.903 8.512 783 1HB ASP 123 1HB ASP 123 7.298 11.054 9.693 784 2HB ASP 123 2HB ASP 123 6.256 9.738 9.136 785 HA PRO 124 HA PRO 124 8.121 15.180 7.235 786 1HB PRO 124 1HB PRO 124 8.653 16.213 9.834 787 2HB PRO 124 2HB PRO 124 7.459 16.783 8.656 788 1HG PRO 124 1HG PRO 124 6.983 15.145 11.079 789 2HG PRO 124 2HG PRO 124 5.857 16.182 10.150 790 1HD PRO 124 1HD PRO 124 5.799 13.445 10.104 791 2HD PRO 124 2HD PRO 124 5.204 14.494 8.789 792 H GLU 125 H GLU 125 8.866 12.914 9.926 793 HA GLU 125 HA GLU 125 11.362 13.491 10.526 794 1HB GLU 125 1HB GLU 125 9.609 11.632 11.269 795 2HB GLU 125 2HB GLU 125 10.549 10.613 10.172 796 1HG GLU 125 1HG GLU 125 11.633 10.273 12.124 797 2HG GLU 125 2HG GLU 125 12.577 11.647 11.515 798 H ILE 126 H ILE 126 10.437 11.516 7.626 799 HA ILE 126 HA ILE 126 12.795 10.497 6.898 800 HB ILE 126 HB ILE 126 10.592 10.121 6.001 801 1HG1 ILE 126 1HG1 ILE 126 12.974 9.576 4.976 802 2HG1 ILE 126 2HG1 ILE 126 11.467 9.087 4.254 803 1HG2 ILE 126 1HG2 ILE 126 9.893 12.461 5.606 804 2HG2 ILE 126 2HG2 ILE 126 11.017 12.594 4.260 805 3HG2 ILE 126 3HG2 ILE 126 9.681 11.431 4.176 806 1HD1 ILE 126 1HD1 ILE 126 12.943 11.628 3.542 807 2HD1 ILE 126 2HD1 ILE 126 13.069 10.094 2.643 808 3HD1 ILE 126 3HD1 ILE 126 11.518 10.955 2.709 809 H VAL 127 H VAL 127 11.887 13.955 6.466 810 HA VAL 127 HA VAL 127 14.444 14.445 4.978 811 HB VAL 127 HB VAL 127 13.586 16.776 4.773 812 1HG1 VAL 127 1HG1 VAL 127 13.474 15.150 2.956 813 2HG1 VAL 127 2HG1 VAL 127 11.893 14.583 3.531 814 3HG1 VAL 127 3HG1 VAL 127 12.077 16.245 2.935 815 1HG2 VAL 127 1HG2 VAL 127 11.291 17.308 5.161 816 2HG2 VAL 127 2HG2 VAL 127 10.881 15.634 5.563 817 3HG2 VAL 127 3HG2 VAL 127 11.886 16.595 6.675 818 H LYS 128 H LYS 128 14.940 13.490 7.390 819 HA LYS 128 HA LYS 128 16.231 15.732 8.691 820 1HB LYS 128 1HB LYS 128 14.731 16.116 10.129 821 2HB LYS 128 2HB LYS 128 13.720 14.800 9.631 822 1HG LYS 128 1HG LYS 128 14.914 13.296 11.168 823 2HG LYS 128 2HG LYS 128 15.931 14.635 11.694 824 1HD LYS 128 1HD LYS 128 12.875 14.515 11.762 825 2HD LYS 128 2HD LYS 128 13.808 13.911 13.110 826 1HE LYS 128 1HE LYS 128 13.974 16.812 12.156 827 2HE LYS 128 2HE LYS 128 12.717 16.244 13.258 828 1HZ LYS 128 1HZ LYS 128 14.297 15.684 14.877 829 2HZ LYS 128 2HZ LYS 128 15.571 15.934 13.851 830 3HZ LYS 128 3HZ LYS 128 14.644 17.193 14.368 831 HA PRO 129 HA PRO 129 18.706 12.130 10.242 832 1HB PRO 129 1HB PRO 129 18.217 9.530 9.879 833 2HB PRO 129 2HB PRO 129 17.225 10.461 11.037 834 1HG PRO 129 1HG PRO 129 16.588 9.840 8.128 835 2HG PRO 129 2HG PRO 129 15.566 9.533 9.557 836 1HD PRO 129 1HD PRO 129 15.232 11.728 8.115 837 2HD PRO 129 2HD PRO 129 15.070 11.708 9.885 838 H VAL 130 H VAL 130 20.342 10.477 9.281 839 HA VAL 130 HA VAL 130 21.315 11.783 6.938 840 HB VAL 130 HB VAL 130 22.312 9.391 8.547 841 1HG1 VAL 130 1HG1 VAL 130 23.715 11.127 6.479 842 2HG1 VAL 130 2HG1 VAL 130 24.518 9.948 7.542 843 3HG1 VAL 130 3HG1 VAL 130 23.351 9.391 6.337 844 1HG2 VAL 130 1HG2 VAL 130 23.856 11.063 9.554 845 2HG2 VAL 130 2HG2 VAL 130 23.041 12.356 8.650 846 3HG2 VAL 130 3HG2 VAL 130 22.172 11.455 9.911 847 H GLU 131 H GLU 131 20.160 8.502 7.648 848 HA GLU 131 HA GLU 131 20.619 6.974 5.459 849 1HB GLU 131 1HB GLU 131 17.897 7.099 6.739 850 2HB GLU 131 2HB GLU 131 18.662 5.771 5.852 851 1HG GLU 131 1HG GLU 131 19.213 5.126 7.937 852 2HG GLU 131 2HG GLU 131 20.611 6.147 7.687 853 H THR 132 H THR 132 17.805 9.155 5.699 854 HA THR 132 HA THR 132 17.175 8.585 2.927 855 HB THR 132 HB THR 132 15.045 9.889 3.778 856 HG1 THR 132 HG1 THR 132 15.423 10.693 5.708 857 1HG2 THR 132 1HG2 THR 132 15.079 7.463 3.454 858 2HG2 THR 132 2HG2 THR 132 15.981 7.223 4.966 859 3HG2 THR 132 3HG2 THR 132 14.314 7.798 5.019 860 H GLN 133 H GLN 133 17.970 11.341 4.996 861 HA GLN 133 HA GLN 133 17.627 13.633 4.318 862 1HB GLN 133 1HB GLN 133 19.893 12.608 5.189 863 2HB GLN 133 2HB GLN 133 20.458 12.822 3.570 864 1HG GLN 133 1HG GLN 133 21.125 14.717 4.896 865 2HG GLN 133 2HG GLN 133 19.952 15.268 3.698 866 1HE2 GLN 133 1HE2 GLN 133 18.764 13.483 6.563 867 2HE2 GLN 133 2HE2 GLN 133 18.238 14.879 7.440 868 H GLY 134 H GLY 134 16.185 13.403 2.321 869 1HA GLY 134 1HA GLY 134 16.478 15.100 0.379 870 2HA GLY 134 2HA GLY 134 17.690 13.961 -0.219 871 H ILE 135 H ILE 135 16.289 11.562 0.658 872 HA ILE 135 HA ILE 135 14.695 10.846 -1.544 873 HB ILE 135 HB ILE 135 14.854 9.851 1.284 874 1HG1 ILE 135 1HG1 ILE 135 16.817 9.551 -0.266 875 2HG1 ILE 135 2HG1 ILE 135 16.097 8.085 0.391 876 1HG2 ILE 135 1HG2 ILE 135 12.598 9.230 0.589 877 2HG2 ILE 135 2HG2 ILE 135 13.195 8.689 -0.984 878 3HG2 ILE 135 3HG2 ILE 135 13.644 7.816 0.507 879 1HD1 ILE 135 1HD1 ILE 135 15.031 7.531 -1.690 880 2HD1 ILE 135 2HD1 ILE 135 15.570 9.057 -2.433 881 3HD1 ILE 135 3HD1 ILE 135 16.754 7.839 -1.948 882 H LYS 136 H LYS 136 12.530 11.027 -2.073 883 HA LYS 136 HA LYS 136 10.652 11.860 -0.071 884 1HB LYS 136 1HB LYS 136 9.948 13.979 -1.240 885 2HB LYS 136 2HB LYS 136 11.394 13.951 -0.237 886 1HG LYS 136 1HG LYS 136 12.780 13.742 -2.309 887 2HG LYS 136 2HG LYS 136 11.302 13.841 -3.288 888 1HD LYS 136 1HD LYS 136 10.793 16.008 -2.556 889 2HD LYS 136 2HD LYS 136 11.777 15.871 -1.103 890 1HE LYS 136 1HE LYS 136 12.999 15.931 -3.908 891 2HE LYS 136 2HE LYS 136 12.721 17.400 -2.957 892 1HZ LYS 136 1HZ LYS 136 14.965 16.505 -2.704 893 2HZ LYS 136 2HZ LYS 136 14.161 16.589 -1.274 894 3HZ LYS 136 3HZ LYS 136 14.376 15.139 -1.996 895 H THR 137 H THR 137 10.453 9.530 -1.392 896 HA THR 137 HA THR 137 7.765 9.927 -2.066 897 HB THR 137 HB THR 137 9.232 8.332 -4.213 898 HG1 THR 137 HG1 THR 137 8.739 11.081 -4.113 899 1HG2 THR 137 1HG2 THR 137 7.153 8.575 -5.401 900 2HG2 THR 137 2HG2 THR 137 6.913 7.793 -3.822 901 3HG2 THR 137 3HG2 THR 137 6.461 9.497 -4.046 902 H LEU 138 H LEU 138 7.056 8.657 -0.494 903 HA LEU 138 HA LEU 138 8.325 6.020 0.046 904 1HB LEU 138 1HB LEU 138 6.158 7.699 1.179 905 2HB LEU 138 2HB LEU 138 5.990 5.945 1.362 906 HG LEU 138 HG LEU 138 8.183 5.864 2.373 907 1HD1 LEU 138 1HD1 LEU 138 8.164 8.873 2.120 908 2HD1 LEU 138 2HD1 LEU 138 9.189 8.009 3.285 909 3HD1 LEU 138 3HD1 LEU 138 9.392 7.724 1.548 910 1HD2 LEU 138 1HD2 LEU 138 7.533 6.721 4.589 911 2HD2 LEU 138 2HD2 LEU 138 6.339 7.794 3.871 912 3HD2 LEU 138 3HD2 LEU 138 6.126 6.062 3.737 913 H THR 139 H THR 139 8.299 5.251 -2.074 914 HA THR 139 HA THR 139 5.724 4.854 -3.333 915 HB THR 139 HB THR 139 7.773 5.316 -4.674 916 HG1 THR 139 HG1 THR 139 5.840 3.941 -5.399 917 1HG2 THR 139 1HG2 THR 139 9.257 3.832 -3.339 918 2HG2 THR 139 2HG2 THR 139 8.464 2.417 -4.073 919 3HG2 THR 139 3HG2 THR 139 9.367 3.550 -5.098 920 H LEU 140 H LEU 140 4.795 2.681 -3.682 921 HA LEU 140 HA LEU 140 5.751 0.695 -1.645 922 1HB LEU 140 1HB LEU 140 3.737 2.103 -0.986 923 2HB LEU 140 2HB LEU 140 2.830 1.318 -2.281 924 HG LEU 140 HG LEU 140 4.201 -0.217 -0.015 925 1HD1 LEU 140 1HD1 LEU 140 1.330 0.795 -0.158 926 2HD1 LEU 140 2HD1 LEU 140 1.997 -0.278 1.093 927 3HD1 LEU 140 3HD1 LEU 140 2.594 1.380 0.946 928 1HD2 LEU 140 1HD2 LEU 140 2.465 -1.942 -0.552 929 2HD2 LEU 140 2HD2 LEU 140 1.956 -0.953 -1.934 930 3HD2 LEU 140 3HD2 LEU 140 3.582 -1.676 -1.886 931 H SER 141 H SER 141 6.671 -0.759 -2.973 932 HA SER 141 HA SER 141 5.391 -1.727 -5.480 933 1HB SER 141 1HB SER 141 7.722 -1.601 -5.620 934 2HB SER 141 2HB SER 141 7.948 -2.342 -4.028 935 HG SER 141 HG SER 141 6.784 -3.696 -6.244 936 H TYR 142 H TYR 142 3.630 -2.940 -5.171 937 HA TYR 142 HA TYR 142 3.353 -4.533 -2.675 938 1HB TYR 142 1HB TYR 142 1.747 -2.624 -3.492 939 2HB TYR 142 2HB TYR 142 1.076 -3.849 -4.542 940 HD1 TYR 142 HD1 TYR 142 -0.536 -2.391 -2.603 941 HD2 TYR 142 HD2 TYR 142 1.673 -6.077 -2.128 942 HE1 TYR 142 HE1 TYR 142 -2.017 -3.059 -0.728 943 HE2 TYR 142 HE2 TYR 142 0.250 -6.677 -0.224 944 HH TYR 142 HH TYR 142 -2.529 -5.698 0.507 945 H THR 143 H THR 143 4.427 -6.467 -3.260 946 HA THR 143 HA THR 143 4.031 -7.646 -5.851 947 HB THR 143 HB THR 143 5.350 -9.289 -3.783 948 HG1 THR 143 HG1 THR 143 7.152 -7.709 -3.828 949 1HG2 THR 143 1HG2 THR 143 6.320 -7.983 -6.365 950 2HG2 THR 143 2HG2 THR 143 7.091 -9.328 -5.500 951 3HG2 THR 143 3HG2 THR 143 5.511 -9.560 -6.278 952 H PHE 144 H PHE 144 1.869 -7.926 -5.955 953 HA PHE 144 HA PHE 144 0.490 -10.012 -4.317 954 1HB PHE 144 1HB PHE 144 -0.216 -8.113 -6.513 955 2HB PHE 144 2HB PHE 144 -0.987 -9.672 -6.604 956 HD1 PHE 144 HD1 PHE 144 -0.162 -7.794 -3.446 957 HD2 PHE 144 HD2 PHE 144 -3.214 -8.838 -6.310 958 HE1 PHE 144 HE1 PHE 144 -1.939 -7.110 -1.841 959 HE2 PHE 144 HE2 PHE 144 -4.951 -8.052 -4.739 960 HZ PHE 144 HZ PHE 144 -4.304 -7.158 -2.511 961 H TYR 145 H TYR 145 2.453 -11.335 -4.580 962 HA TYR 145 HA TYR 145 2.022 -13.203 -6.866 963 1HB TYR 145 1HB TYR 145 4.285 -13.517 -7.269 964 2HB TYR 145 2HB TYR 145 3.968 -11.788 -7.318 965 HD1 TYR 145 HD1 TYR 145 4.170 -12.180 -3.868 966 HD2 TYR 145 HD2 TYR 145 6.635 -12.560 -7.398 967 HE1 TYR 145 HE1 TYR 145 6.177 -11.963 -2.497 968 HE2 TYR 145 HE2 TYR 145 8.656 -12.253 -5.995 969 HH TYR 145 HH TYR 145 8.466 -11.871 -2.445 970 HA PRO 146 HA PRO 146 2.323 -15.357 -2.687 971 1HB PRO 146 1HB PRO 146 -0.248 -15.847 -1.960 972 2HB PRO 146 2HB PRO 146 0.564 -14.277 -1.719 973 1HG PRO 146 1HG PRO 146 -1.260 -15.035 -4.017 974 2HG PRO 146 2HG PRO 146 -1.345 -13.600 -2.987 975 1HD PRO 146 1HD PRO 146 -0.066 -13.521 -5.381 976 2HD PRO 146 2HD PRO 146 0.497 -12.622 -3.929 977 H ARG 147 H ARG 147 -0.699 -16.856 -3.791 978 HA ARG 147 HA ARG 147 0.750 -19.246 -4.780 979 1HB ARG 147 1HB ARG 147 -1.152 -19.173 -2.404 980 2HB ARG 147 2HB ARG 147 -0.581 -20.644 -3.193 981 1HG ARG 147 1HG ARG 147 1.198 -18.611 -1.779 982 2HG ARG 147 2HG ARG 147 0.601 -20.120 -1.080 983 1HD ARG 147 1HD ARG 147 1.770 -21.401 -2.874 984 2HD ARG 147 2HD ARG 147 2.439 -19.868 -3.494 985 HE ARG 147 HE ARG 147 3.013 -20.070 -0.725 986 1HH1 ARG 147 1HH1 ARG 147 3.947 -21.404 -3.845 987 2HH1 ARG 147 2HH1 ARG 147 5.555 -21.863 -3.381 988 1HH2 ARG 147 1HH2 ARG 147 5.152 -20.688 -0.034 989 2HH2 ARG 147 2HH2 ARG 147 6.257 -21.433 -1.146 990 H GLU 148 H GLU 148 -0.143 -19.585 -6.656 991 HA GLU 148 HA GLU 148 -2.747 -18.491 -7.281 992 1HB GLU 148 1HB GLU 148 -0.721 -18.058 -8.539 993 2HB GLU 148 2HB GLU 148 -0.549 -19.762 -8.958 994 1HG GLU 148 1HG GLU 148 -1.473 -18.400 -10.814 995 2HG GLU 148 2HG GLU 148 -2.591 -19.665 -10.305 996 HA PRO 149 HA PRO 149 -4.381 -22.809 -7.598 997 1HB PRO 149 1HB PRO 149 -7.033 -22.231 -7.612 998 2HB PRO 149 2HB PRO 149 -6.069 -22.276 -6.106 999 1HG PRO 149 1HG PRO 149 -6.858 -19.848 -7.729 1000 2HG PRO 149 2HG PRO 149 -6.955 -20.097 -5.957 1001 1HD PRO 149 1HD PRO 149 -4.890 -18.767 -7.185 1002 2HD PRO 149 2HD PRO 149 -4.657 -19.708 -5.686 1003 H SER 150 H SER 150 -4.858 -19.791 -9.479 1004 HA SER 150 HA SER 150 -4.980 -19.442 -11.643 1005 1HB SER 150 1HB SER 150 -3.775 -21.728 -11.948 1006 2HB SER 150 2HB SER 150 -5.383 -22.348 -12.371 1007 HG SER 150 HG SER 150 -3.917 -20.258 -13.617 1008 H LYS 151 H LYS 151 -6.792 -18.590 -12.572 1009 HA LYS 151 HA LYS 151 -9.394 -19.529 -11.620 1010 1HB LYS 151 1HB LYS 151 -10.328 -17.693 -12.968 1011 2HB LYS 151 2HB LYS 151 -9.248 -17.233 -11.658 1012 1HG LYS 151 1HG LYS 151 -7.467 -16.673 -13.207 1013 2HG LYS 151 2HG LYS 151 -8.407 -17.275 -14.585 1014 1HD LYS 151 1HD LYS 151 -10.137 -15.636 -14.267 1015 2HD LYS 151 2HD LYS 151 -9.452 -15.065 -12.754 1016 1HE LYS 151 1HE LYS 151 -7.996 -14.822 -15.424 1017 2HE LYS 151 2HE LYS 151 -9.091 -13.589 -14.780 1018 1HZ LYS 151 1HZ LYS 151 -7.691 -13.396 -12.833 1019 2HZ LYS 151 2HZ LYS 151 -6.642 -14.506 -13.440 1020 3HZ LYS 151 3HZ LYS 151 -6.854 -13.067 -14.204 Start of MODEL 17 1 H VAL 21 H VAL 21 -1.024 10.768 12.679 2 HA VAL 21 HA VAL 21 -2.285 8.448 13.850 3 HB VAL 21 HB VAL 21 -2.064 10.072 15.766 4 1HG1 VAL 21 1HG1 VAL 21 -2.202 12.194 14.480 5 2HG1 VAL 21 2HG1 VAL 21 -3.918 11.883 14.152 6 3HG1 VAL 21 3HG1 VAL 21 -3.360 12.132 15.814 7 1HG2 VAL 21 1HG2 VAL 21 -3.970 8.442 15.614 8 2HG2 VAL 21 2HG2 VAL 21 -4.261 9.880 16.605 9 3HG2 VAL 21 3HG2 VAL 21 -4.984 9.773 14.999 10 H GLU 22 H GLU 22 -4.792 8.777 13.227 11 HA GLU 22 HA GLU 22 -4.918 9.562 10.470 12 1HB GLU 22 1HB GLU 22 -6.403 7.869 11.618 13 2HB GLU 22 2HB GLU 22 -7.300 9.244 12.311 14 1HG GLU 22 1HG GLU 22 -7.851 10.046 10.068 15 2HG GLU 22 2HG GLU 22 -6.792 8.828 9.332 16 H GLN 23 H GLN 23 -4.159 11.537 10.330 17 HA GLN 23 HA GLN 23 -4.651 13.510 9.559 18 1HB GLN 23 1HB GLN 23 -7.123 13.282 10.696 19 2HB GLN 23 2HB GLN 23 -6.467 14.577 11.697 20 1HG GLN 23 1HG GLN 23 -6.902 14.403 8.709 21 2HG GLN 23 2HG GLN 23 -7.577 15.588 9.843 22 1HE2 GLN 23 1HE2 GLN 23 -4.898 14.703 7.811 23 2HE2 GLN 23 2HE2 GLN 23 -3.938 16.168 8.065 24 H ALA 24 H ALA 24 -2.436 13.459 10.177 25 HA ALA 24 HA ALA 24 -1.659 13.841 12.892 26 1HB ALA 24 1HB ALA 24 0.534 13.360 12.059 27 2HB ALA 24 2HB ALA 24 -0.616 12.306 11.205 28 3HB ALA 24 3HB ALA 24 0.045 13.727 10.386 29 H SER 25 H SER 25 -2.825 16.118 12.650 30 HA SER 25 HA SER 25 -1.257 18.386 11.751 31 1HB SER 25 1HB SER 25 -3.851 18.181 13.318 32 2HB SER 25 2HB SER 25 -3.063 19.710 12.899 33 HG SER 25 HG SER 25 -4.176 17.835 11.101 34 H ASP 26 H ASP 26 0.369 17.173 13.103 35 HA ASP 26 HA ASP 26 1.309 19.056 15.144 36 1HB ASP 26 1HB ASP 26 1.250 16.004 15.514 37 2HB ASP 26 2HB ASP 26 2.359 17.079 16.381 38 H LEU 27 H LEU 27 1.921 15.995 13.416 39 HA LEU 27 HA LEU 27 4.508 16.639 12.392 40 1HB LEU 27 1HB LEU 27 2.364 14.703 11.422 41 2HB LEU 27 2HB LEU 27 4.012 14.725 10.846 42 HG LEU 27 HG LEU 27 3.059 14.012 13.644 43 1HD1 LEU 27 1HD1 LEU 27 2.838 12.292 11.881 44 2HD1 LEU 27 2HD1 LEU 27 4.548 12.455 11.483 45 3HD1 LEU 27 3HD1 LEU 27 4.087 11.836 13.068 46 1HD2 LEU 27 1HD2 LEU 27 5.923 14.352 12.637 47 2HD2 LEU 27 2HD2 LEU 27 5.154 15.212 13.995 48 3HD2 LEU 27 3HD2 LEU 27 5.484 13.482 14.115 49 H ILE 28 H ILE 28 1.262 17.307 11.138 50 HA ILE 28 HA ILE 28 2.174 17.983 8.496 51 HB ILE 28 HB ILE 28 -0.359 18.868 9.882 52 1HG1 ILE 28 1HG1 ILE 28 0.162 16.812 7.719 53 2HG1 ILE 28 2HG1 ILE 28 0.189 16.360 9.389 54 1HG2 ILE 28 1HG2 ILE 28 0.153 20.379 7.982 55 2HG2 ILE 28 2HG2 ILE 28 0.501 18.960 6.965 56 3HG2 ILE 28 3HG2 ILE 28 -1.144 19.267 7.545 57 1HD1 ILE 28 1HD1 ILE 28 -2.243 17.363 7.907 58 2HD1 ILE 28 2HD1 ILE 28 -1.986 15.801 8.728 59 3HD1 ILE 28 3HD1 ILE 28 -2.157 17.281 9.677 60 H LEU 29 H LEU 29 3.888 19.311 8.453 61 HA LEU 29 HA LEU 29 3.592 22.031 9.620 62 1HB LEU 29 1HB LEU 29 5.942 20.956 8.045 63 2HB LEU 29 2HB LEU 29 5.797 22.453 8.949 64 HG LEU 29 HG LEU 29 6.877 21.240 10.556 65 1HD1 LEU 29 1HD1 LEU 29 4.206 19.901 11.236 66 2HD1 LEU 29 2HD1 LEU 29 5.555 20.268 12.277 67 3HD1 LEU 29 3HD1 LEU 29 4.594 21.586 11.607 68 1HD2 LEU 29 1HD2 LEU 29 6.600 18.676 10.729 69 2HD2 LEU 29 2HD2 LEU 29 5.879 18.831 9.111 70 3HD2 LEU 29 3HD2 LEU 29 7.525 19.394 9.394 71 H ASP 30 H ASP 30 4.631 21.003 6.318 72 HA ASP 30 HA ASP 30 2.217 21.675 5.219 73 1HB ASP 30 1HB ASP 30 3.074 24.142 5.720 74 2HB ASP 30 2HB ASP 30 4.070 23.885 4.290 75 H GLU 31 H GLU 31 5.632 21.125 4.594 76 HA GLU 31 HA GLU 31 5.741 21.503 1.896 77 1HB GLU 31 1HB GLU 31 7.302 19.625 3.729 78 2HB GLU 31 2HB GLU 31 7.771 19.909 2.061 79 1HG GLU 31 1HG GLU 31 7.467 22.207 4.052 80 2HG GLU 31 2HG GLU 31 8.974 21.322 3.803 81 H LYS 32 H LYS 32 5.213 20.585 0.118 82 HA LYS 32 HA LYS 32 3.546 18.290 0.242 83 1HB LYS 32 1HB LYS 32 3.163 20.363 -1.072 84 2HB LYS 32 2HB LYS 32 4.531 19.962 -2.120 85 1HG LYS 32 1HG LYS 32 2.738 17.687 -1.756 86 2HG LYS 32 2HG LYS 32 1.822 19.090 -2.274 87 1HD LYS 32 1HD LYS 32 4.414 18.257 -3.677 88 2HD LYS 32 2HD LYS 32 2.932 17.413 -4.062 89 1HE LYS 32 1HE LYS 32 3.245 20.446 -4.295 90 2HE LYS 32 2HE LYS 32 3.500 19.306 -5.628 91 1HZ LYS 32 1HZ LYS 32 0.947 19.620 -4.191 92 2HZ LYS 32 2HZ LYS 32 1.279 20.174 -5.705 93 3HZ LYS 32 3HZ LYS 32 1.226 18.567 -5.388 94 H ILE 33 H ILE 33 4.288 16.342 0.321 95 HA ILE 33 HA ILE 33 6.814 15.502 -1.054 96 HB ILE 33 HB ILE 33 6.736 15.587 1.385 97 1HG1 ILE 33 1HG1 ILE 33 8.452 14.401 0.347 98 2HG1 ILE 33 2HG1 ILE 33 7.839 13.445 1.676 99 1HG2 ILE 33 1HG2 ILE 33 4.388 14.735 1.674 100 2HG2 ILE 33 2HG2 ILE 33 5.019 13.113 1.320 101 3HG2 ILE 33 3HG2 ILE 33 5.635 14.027 2.708 102 1HD1 ILE 33 1HD1 ILE 33 6.463 12.148 -0.145 103 2HD1 ILE 33 2HD1 ILE 33 7.560 12.945 -1.292 104 3HD1 ILE 33 3HD1 ILE 33 8.206 11.871 -0.045 105 H LYS 34 H LYS 34 6.415 14.355 -2.917 106 HA LYS 34 HA LYS 34 3.660 13.506 -3.471 107 1HB LYS 34 1HB LYS 34 5.061 14.919 -4.968 108 2HB LYS 34 2HB LYS 34 6.142 13.551 -5.252 109 1HG LYS 34 1HG LYS 34 3.135 13.436 -5.772 110 2HG LYS 34 2HG LYS 34 4.227 14.158 -6.915 111 1HD LYS 34 1HD LYS 34 5.350 11.576 -6.170 112 2HD LYS 34 2HD LYS 34 3.638 11.367 -6.518 113 1HE LYS 34 1HE LYS 34 4.041 12.614 -8.728 114 2HE LYS 34 2HE LYS 34 5.729 12.864 -8.237 115 1HZ LYS 34 1HZ LYS 34 5.822 10.289 -8.263 116 2HZ LYS 34 2HZ LYS 34 4.457 10.373 -9.105 117 3HZ LYS 34 3HZ LYS 34 5.770 11.099 -9.699 118 H VAL 35 H VAL 35 3.222 11.208 -4.339 119 HA VAL 35 HA VAL 35 5.292 9.226 -3.525 120 HB VAL 35 HB VAL 35 2.617 9.605 -2.317 121 1HG1 VAL 35 1HG1 VAL 35 3.086 7.255 -1.233 122 2HG1 VAL 35 2HG1 VAL 35 2.418 7.303 -2.861 123 3HG1 VAL 35 3HG1 VAL 35 4.143 7.013 -2.640 124 1HG2 VAL 35 1HG2 VAL 35 4.357 10.616 -1.025 125 2HG2 VAL 35 2HG2 VAL 35 3.961 9.112 -0.199 126 3HG2 VAL 35 3HG2 VAL 35 5.399 9.188 -1.208 127 H THR 36 H THR 36 5.627 8.281 -5.350 128 HA THR 36 HA THR 36 3.514 7.374 -7.222 129 HB THR 36 HB THR 36 6.547 6.995 -6.951 130 HG1 THR 36 HG1 THR 36 5.090 8.452 -8.847 131 1HG2 THR 36 1HG2 THR 36 4.710 6.226 -9.256 132 2HG2 THR 36 2HG2 THR 36 6.493 6.226 -9.291 133 3HG2 THR 36 3HG2 THR 36 5.633 5.111 -8.219 134 H PHE 37 H PHE 37 2.359 5.704 -6.713 135 HA PHE 37 HA PHE 37 3.306 3.581 -4.875 136 1HB PHE 37 1HB PHE 37 0.800 4.023 -6.568 137 2HB PHE 37 2HB PHE 37 1.128 2.567 -5.668 138 HD1 PHE 37 HD1 PHE 37 -0.047 5.982 -5.468 139 HD2 PHE 37 HD2 PHE 37 1.465 2.693 -3.122 140 HE1 PHE 37 HE1 PHE 37 -0.706 7.130 -3.383 141 HE2 PHE 37 HE2 PHE 37 0.795 3.879 -1.039 142 HZ PHE 37 HZ PHE 37 -0.209 6.174 -1.201 143 H ASP 38 H ASP 38 3.675 1.375 -5.666 144 HA ASP 38 HA ASP 38 3.503 1.083 -8.588 145 1HB ASP 38 1HB ASP 38 5.842 1.682 -8.149 146 2HB ASP 38 2HB ASP 38 5.991 0.383 -6.991 147 H ALA 39 H ALA 39 1.599 -0.075 -8.346 148 HA ALA 39 HA ALA 39 1.643 -2.563 -6.741 149 1HB ALA 39 1HB ALA 39 -0.541 -1.352 -8.467 150 2HB ALA 39 2HB ALA 39 -0.709 -2.715 -7.342 151 3HB ALA 39 3HB ALA 39 -0.343 -1.092 -6.716 152 H ASN 40 H ASN 40 2.172 -4.556 -7.632 153 HA ASN 40 HA ASN 40 1.910 -4.925 -10.581 154 1HB ASN 40 1HB ASN 40 4.152 -6.088 -8.873 155 2HB ASN 40 2HB ASN 40 4.001 -6.090 -10.626 156 1HD2 ASN 40 1HD2 ASN 40 4.508 -3.982 -7.768 157 2HD2 ASN 40 2HD2 ASN 40 5.442 -2.757 -8.635 158 H VAL 41 H VAL 41 1.476 -7.114 -11.231 159 HA VAL 41 HA VAL 41 0.882 -9.041 -9.125 160 HB VAL 41 HB VAL 41 -1.222 -7.774 -9.423 161 1HG1 VAL 41 1HG1 VAL 41 -2.472 -7.796 -11.516 162 2HG1 VAL 41 2HG1 VAL 41 -0.919 -6.980 -11.741 163 3HG1 VAL 41 3HG1 VAL 41 -1.149 -8.637 -12.342 164 1HG2 VAL 41 1HG2 VAL 41 -2.743 -9.600 -9.808 165 2HG2 VAL 41 2HG2 VAL 41 -1.520 -10.522 -10.693 166 3HG2 VAL 41 3HG2 VAL 41 -1.329 -10.233 -8.953 167 H ALA 42 H ALA 42 0.906 -11.160 -9.715 168 HA ALA 42 HA ALA 42 1.290 -11.854 -12.558 169 1HB ALA 42 1HB ALA 42 3.075 -12.847 -10.291 170 2HB ALA 42 2HB ALA 42 3.108 -13.429 -11.969 171 3HB ALA 42 3HB ALA 42 3.588 -11.759 -11.600 172 H ALA 43 H ALA 43 0.842 -14.207 -12.807 173 HA ALA 43 HA ALA 43 -1.637 -14.891 -12.200 174 1HB ALA 43 1HB ALA 43 0.661 -16.882 -12.399 175 2HB ALA 43 2HB ALA 43 -1.054 -17.228 -12.694 176 3HB ALA 43 3HB ALA 43 -0.183 -16.118 -13.765 177 H GLY 44 H GLY 44 1.062 -15.808 -10.137 178 1HA GLY 44 1HA GLY 44 0.121 -17.378 -8.145 179 2HA GLY 44 2HA GLY 44 1.215 -16.024 -7.859 180 H LEU 45 H LEU 45 -0.693 -13.882 -8.462 181 HA LEU 45 HA LEU 45 -2.928 -14.389 -6.568 182 1HB LEU 45 1HB LEU 45 -1.029 -12.233 -6.490 183 2HB LEU 45 2HB LEU 45 -2.576 -11.569 -6.938 184 HG LEU 45 HG LEU 45 -2.477 -13.497 -4.560 185 1HD1 LEU 45 1HD1 LEU 45 -2.213 -10.444 -4.465 186 2HD1 LEU 45 2HD1 LEU 45 -2.207 -11.547 -3.100 187 3HD1 LEU 45 3HD1 LEU 45 -0.833 -11.531 -4.216 188 1HD2 LEU 45 1HD2 LEU 45 -4.250 -11.190 -5.312 189 2HD2 LEU 45 2HD2 LEU 45 -4.595 -12.910 -5.657 190 3HD2 LEU 45 3HD2 LEU 45 -4.416 -12.367 -3.972 191 HA PRO 46 HA PRO 46 -4.493 -13.889 -10.806 192 1HB PRO 46 1HB PRO 46 -6.828 -15.290 -10.596 193 2HB PRO 46 2HB PRO 46 -5.214 -16.057 -10.626 194 1HG PRO 46 1HG PRO 46 -6.909 -15.446 -8.208 195 2HG PRO 46 2HG PRO 46 -6.090 -16.974 -8.612 196 1HD PRO 46 1HD PRO 46 -5.003 -15.085 -6.933 197 2HD PRO 46 2HD PRO 46 -3.987 -16.130 -7.973 198 H TRP 47 H TRP 47 -5.248 -12.168 -8.125 199 HA TRP 47 HA TRP 47 -7.971 -11.484 -8.607 200 1HB TRP 47 1HB TRP 47 -5.901 -10.240 -6.800 201 2HB TRP 47 2HB TRP 47 -7.631 -9.883 -6.788 202 HD1 TRP 47 HD1 TRP 47 -7.577 -13.424 -7.428 203 HE1 TRP 47 HE1 TRP 47 -7.860 -14.815 -5.363 204 HE3 TRP 47 HE3 TRP 47 -6.189 -9.996 -3.894 205 HZ2 TRP 47 HZ2 TRP 47 -7.704 -14.505 -2.477 206 HZ3 TRP 47 HZ3 TRP 47 -5.500 -11.116 -1.800 207 HH2 TRP 47 HH2 TRP 47 -6.680 -12.972 -0.855 208 H GLU 48 H GLU 48 -8.877 -9.557 -9.268 209 HA GLU 48 HA GLU 48 -7.275 -7.979 -11.243 210 1HB GLU 48 1HB GLU 48 -9.606 -8.649 -11.761 211 2HB GLU 48 2HB GLU 48 -10.154 -7.778 -10.324 212 1HG GLU 48 1HG GLU 48 -9.319 -5.647 -11.343 213 2HG GLU 48 2HG GLU 48 -8.934 -6.549 -12.821 214 H PHE 49 H PHE 49 -5.773 -7.337 -9.691 215 HA PHE 49 HA PHE 49 -6.656 -5.850 -7.311 216 1HB PHE 49 1HB PHE 49 -4.968 -7.870 -7.535 217 2HB PHE 49 2HB PHE 49 -3.798 -6.585 -7.766 218 HD1 PHE 49 HD1 PHE 49 -5.141 -4.512 -5.829 219 HD2 PHE 49 HD2 PHE 49 -4.100 -8.687 -5.485 220 HE1 PHE 49 HE1 PHE 49 -4.984 -4.285 -3.372 221 HE2 PHE 49 HE2 PHE 49 -3.976 -8.442 -3.028 222 HZ PHE 49 HZ PHE 49 -4.372 -6.241 -1.978 223 H VAL 50 H VAL 50 -7.220 -3.850 -8.127 224 HA VAL 50 HA VAL 50 -5.446 -2.651 -10.125 225 HB VAL 50 HB VAL 50 -7.185 -1.132 -10.626 226 1HG1 VAL 50 1HG1 VAL 50 -8.953 -2.642 -11.278 227 2HG1 VAL 50 2HG1 VAL 50 -7.421 -3.531 -11.383 228 3HG1 VAL 50 3HG1 VAL 50 -8.524 -3.799 -10.009 229 1HG2 VAL 50 1HG2 VAL 50 -8.540 -2.080 -8.084 230 2HG2 VAL 50 2HG2 VAL 50 -8.048 -0.422 -8.490 231 3HG2 VAL 50 3HG2 VAL 50 -9.378 -1.185 -9.369 232 HA PRO 51 HA PRO 51 -3.959 0.481 -7.111 233 1HB PRO 51 1HB PRO 51 -2.617 2.115 -8.821 234 2HB PRO 51 2HB PRO 51 -1.956 0.530 -8.332 235 1HG PRO 51 1HG PRO 51 -3.482 1.207 -10.862 236 2HG PRO 51 2HG PRO 51 -1.951 0.293 -10.723 237 1HD PRO 51 1HD PRO 51 -4.419 -0.885 -10.941 238 2HD PRO 51 2HD PRO 51 -3.092 -1.651 -10.014 239 H VAL 52 H VAL 52 -4.429 2.845 -7.013 240 HA VAL 52 HA VAL 52 -7.086 3.385 -8.181 241 HB VAL 52 HB VAL 52 -6.931 5.322 -6.410 242 1HG1 VAL 52 1HG1 VAL 52 -8.691 3.679 -6.556 243 2HG1 VAL 52 2HG1 VAL 52 -7.626 2.416 -5.902 244 3HG1 VAL 52 3HG1 VAL 52 -8.112 3.801 -4.888 245 1HG2 VAL 52 1HG2 VAL 52 -5.298 3.060 -5.214 246 2HG2 VAL 52 2HG2 VAL 52 -4.602 4.618 -5.695 247 3HG2 VAL 52 3HG2 VAL 52 -5.804 4.545 -4.383 248 H GLN 53 H GLN 53 -4.003 5.088 -7.557 249 HA GLN 53 HA GLN 53 -4.157 6.393 -10.142 250 1HB GLN 53 1HB GLN 53 -3.614 8.607 -9.249 251 2HB GLN 53 2HB GLN 53 -5.197 8.089 -8.706 252 1HG GLN 53 1HG GLN 53 -3.164 7.339 -6.712 253 2HG GLN 53 2HG GLN 53 -2.999 9.031 -7.169 254 1HE2 GLN 53 1HE2 GLN 53 -5.376 6.632 -6.040 255 2HE2 GLN 53 2HE2 GLN 53 -6.408 7.822 -5.259 256 H ARG 54 H ARG 54 -1.917 6.919 -10.798 257 HA ARG 54 HA ARG 54 -0.140 4.920 -9.802 258 1HB ARG 54 1HB ARG 54 -0.088 5.752 -12.112 259 2HB ARG 54 2HB ARG 54 0.458 7.316 -11.572 260 1HG ARG 54 1HG ARG 54 2.346 6.052 -12.412 261 2HG ARG 54 2HG ARG 54 2.560 6.336 -10.690 262 1HD ARG 54 1HD ARG 54 1.907 4.102 -10.201 263 2HD ARG 54 2HD ARG 54 1.493 3.844 -11.916 264 HE ARG 54 HE ARG 54 4.216 4.668 -11.678 265 1HH1 ARG 54 1HH1 ARG 54 2.290 1.739 -10.910 266 2HH1 ARG 54 2HH1 ARG 54 3.783 0.776 -10.714 267 1HH2 ARG 54 1HH2 ARG 54 6.076 3.174 -11.489 268 2HH2 ARG 54 2HH2 ARG 54 5.692 1.532 -10.983 269 H ASP 55 H ASP 55 -0.379 8.463 -9.254 270 HA ASP 55 HA ASP 55 1.407 8.177 -6.974 271 1HB ASP 55 1HB ASP 55 1.677 10.706 -8.526 272 2HB ASP 55 2HB ASP 55 2.869 9.733 -7.666 273 H ILE 56 H ILE 56 0.976 9.503 -5.280 274 HA ILE 56 HA ILE 56 -1.455 11.228 -5.354 275 HB ILE 56 HB ILE 56 -1.551 11.024 -2.920 276 1HG1 ILE 56 1HG1 ILE 56 0.610 8.960 -3.395 277 2HG1 ILE 56 2HG1 ILE 56 0.782 10.528 -2.586 278 1HG2 ILE 56 1HG2 ILE 56 -3.003 9.727 -4.311 279 2HG2 ILE 56 2HG2 ILE 56 -1.753 8.505 -4.596 280 3HG2 ILE 56 3HG2 ILE 56 -2.461 8.720 -2.968 281 1HD1 ILE 56 1HD1 ILE 56 -1.019 8.408 -1.399 282 2HD1 ILE 56 2HD1 ILE 56 0.727 8.457 -1.133 283 3HD1 ILE 56 3HD1 ILE 56 -0.258 9.831 -0.656 284 H ASP 57 H ASP 57 -1.246 13.175 -4.008 285 HA ASP 57 HA ASP 57 1.525 14.062 -3.341 286 1HB ASP 57 1HB ASP 57 -1.035 15.626 -3.888 287 2HB ASP 57 2HB ASP 57 0.269 16.265 -2.886 288 H VAL 58 H VAL 58 1.931 14.044 -1.171 289 HA VAL 58 HA VAL 58 -0.307 14.506 0.672 290 HB VAL 58 HB VAL 58 0.954 13.061 2.383 291 1HG1 VAL 58 1HG1 VAL 58 -1.302 12.582 1.634 292 2HG1 VAL 58 2HG1 VAL 58 -0.686 11.810 0.169 293 3HG1 VAL 58 3HG1 VAL 58 -0.368 11.080 1.766 294 1HG2 VAL 58 1HG2 VAL 58 2.923 12.498 0.984 295 2HG2 VAL 58 2HG2 VAL 58 2.052 11.074 1.570 296 3HG2 VAL 58 3HG2 VAL 58 1.878 11.579 -0.120 297 H ARG 59 H ARG 59 0.875 15.233 2.824 298 HA ARG 59 HA ARG 59 3.177 16.931 2.062 299 1HB ARG 59 1HB ARG 59 0.683 18.140 3.298 300 2HB ARG 59 2HB ARG 59 2.130 18.923 2.676 301 1HG ARG 59 1HG ARG 59 1.424 17.834 0.362 302 2HG ARG 59 2HG ARG 59 -0.145 17.618 1.142 303 1HD ARG 59 1HD ARG 59 1.429 20.180 0.741 304 2HD ARG 59 2HD ARG 59 -0.001 19.663 -0.190 305 HE ARG 59 HE ARG 59 -1.130 19.623 2.180 306 1HH1 ARG 59 1HH1 ARG 59 0.875 22.169 0.837 307 2HH1 ARG 59 2HH1 ARG 59 0.858 23.189 2.231 308 1HH2 ARG 59 1HH2 ARG 59 -1.158 20.868 4.102 309 2HH2 ARG 59 2HH2 ARG 59 -0.305 22.444 4.143 310 H ILE 60 H ILE 60 4.528 15.959 3.406 311 HA ILE 60 HA ILE 60 4.849 14.462 5.233 312 HB ILE 60 HB ILE 60 6.169 15.971 6.787 313 1HG1 ILE 60 1HG1 ILE 60 5.582 18.008 4.612 314 2HG1 ILE 60 2HG1 ILE 60 4.813 18.002 6.187 315 1HG2 ILE 60 1HG2 ILE 60 7.970 16.126 5.189 316 2HG2 ILE 60 2HG2 ILE 60 7.090 14.629 4.907 317 3HG2 ILE 60 3HG2 ILE 60 6.834 16.019 3.825 318 1HD1 ILE 60 1HD1 ILE 60 7.088 18.264 7.227 319 2HD1 ILE 60 2HD1 ILE 60 7.799 18.315 5.603 320 3HD1 ILE 60 3HD1 ILE 60 6.685 19.589 6.125 321 H GLY 61 H GLY 61 3.134 13.479 6.271 322 1HA GLY 61 1HA GLY 61 2.005 13.202 8.358 323 2HA GLY 61 2HA GLY 61 1.911 14.932 8.584 324 H GLU 62 H GLU 62 0.975 15.441 5.788 325 HA GLU 62 HA GLU 62 -1.751 15.471 6.504 326 1HB GLU 62 1HB GLU 62 -0.478 17.178 5.223 327 2HB GLU 62 2HB GLU 62 -0.615 16.145 3.787 328 1HG GLU 62 1HG GLU 62 -3.028 16.400 3.801 329 2HG GLU 62 2HG GLU 62 -2.972 17.256 5.361 330 H THR 63 H THR 63 -3.267 14.008 6.340 331 HA THR 63 HA THR 63 -2.884 11.401 5.336 332 HB THR 63 HB THR 63 -5.464 11.463 5.956 333 HG1 THR 63 HG1 THR 63 -5.508 13.749 5.746 334 1HG2 THR 63 1HG2 THR 63 -3.354 12.103 8.052 335 2HG2 THR 63 2HG2 THR 63 -4.999 11.444 8.321 336 3HG2 THR 63 3HG2 THR 63 -3.807 10.489 7.450 337 H VAL 64 H VAL 64 -3.239 10.649 3.318 338 HA VAL 64 HA VAL 64 -5.622 11.724 1.857 339 HB VAL 64 HB VAL 64 -3.549 12.055 0.552 340 1HG1 VAL 64 1HG1 VAL 64 -3.426 8.994 0.420 341 2HG1 VAL 64 2HG1 VAL 64 -2.410 10.158 -0.437 342 3HG1 VAL 64 3HG1 VAL 64 -2.299 10.009 1.334 343 1HG2 VAL 64 1HG2 VAL 64 -4.351 11.280 -1.530 344 2HG2 VAL 64 2HG2 VAL 64 -5.263 9.960 -0.795 345 3HG2 VAL 64 3HG2 VAL 64 -5.779 11.654 -0.550 346 H GLN 65 H GLN 65 -6.808 10.047 0.790 347 HA GLN 65 HA GLN 65 -6.686 7.359 2.094 348 1HB GLN 65 1HB GLN 65 -9.010 7.063 1.615 349 2HB GLN 65 2HB GLN 65 -8.743 8.491 2.607 350 1HG GLN 65 1HG GLN 65 -10.157 9.514 1.222 351 2HG GLN 65 2HG GLN 65 -8.815 9.651 0.093 352 1HE2 GLN 65 1HE2 GLN 65 -8.691 7.975 -1.646 353 2HE2 GLN 65 2HE2 GLN 65 -10.191 7.195 -2.156 354 H ILE 66 H ILE 66 -5.954 5.790 0.872 355 HA ILE 66 HA ILE 66 -6.407 5.862 -2.055 356 HB ILE 66 HB ILE 66 -4.192 4.526 -2.176 357 1HG1 ILE 66 1HG1 ILE 66 -2.520 6.065 -0.674 358 2HG1 ILE 66 2HG1 ILE 66 -3.795 5.907 0.502 359 1HG2 ILE 66 1HG2 ILE 66 -4.743 6.638 -3.321 360 2HG2 ILE 66 2HG2 ILE 66 -4.184 7.529 -1.883 361 3HG2 ILE 66 3HG2 ILE 66 -3.056 6.524 -2.835 362 1HD1 ILE 66 1HD1 ILE 66 -2.100 4.132 0.733 363 2HD1 ILE 66 2HD1 ILE 66 -3.612 3.386 0.183 364 3HD1 ILE 66 3HD1 ILE 66 -2.302 3.684 -0.976 365 H MET 67 H MET 67 -8.015 4.520 -2.217 366 HA MET 67 HA MET 67 -7.986 1.988 -0.686 367 1HB MET 67 1HB MET 67 -10.233 1.641 -1.472 368 2HB MET 67 2HB MET 67 -10.106 3.304 -0.913 369 1HG MET 67 1HG MET 67 -11.400 3.458 -2.771 370 2HG MET 67 2HG MET 67 -9.825 4.050 -3.278 371 1HE MET 67 1HE MET 67 -12.615 1.378 -3.643 372 2HE MET 67 2HE MET 67 -11.848 0.118 -4.624 373 3HE MET 67 3HE MET 67 -11.335 0.360 -2.942 374 H TYR 68 H TYR 68 -8.556 -0.015 -1.853 375 HA TYR 68 HA TYR 68 -7.327 -0.207 -4.533 376 1HB TYR 68 1HB TYR 68 -6.517 -1.862 -2.096 377 2HB TYR 68 2HB TYR 68 -6.312 -2.411 -3.754 378 HD1 TYR 68 HD1 TYR 68 -4.450 -1.774 -5.075 379 HD2 TYR 68 HD2 TYR 68 -5.248 0.265 -1.358 380 HE1 TYR 68 HE1 TYR 68 -2.270 -0.613 -5.238 381 HE2 TYR 68 HE2 TYR 68 -3.086 1.446 -1.544 382 HH TYR 68 HH TYR 68 -1.254 1.902 -2.925 383 H ARG 69 H ARG 69 -8.175 -2.063 -5.630 384 HA ARG 69 HA ARG 69 -10.350 -3.519 -4.263 385 1HB ARG 69 1HB ARG 69 -11.521 -1.978 -5.663 386 2HB ARG 69 2HB ARG 69 -10.495 -2.314 -7.055 387 1HG ARG 69 1HG ARG 69 -11.485 -4.359 -7.506 388 2HG ARG 69 2HG ARG 69 -11.945 -4.643 -5.817 389 1HD ARG 69 1HD ARG 69 -13.954 -4.192 -7.157 390 2HD ARG 69 2HD ARG 69 -13.658 -3.029 -5.874 391 HE ARG 69 HE ARG 69 -12.585 -2.273 -8.490 392 1HH1 ARG 69 1HH1 ARG 69 -15.336 -1.895 -6.204 393 2HH1 ARG 69 2HH1 ARG 69 -15.948 -0.505 -6.991 394 1HH2 ARG 69 1HH2 ARG 69 -13.417 -0.385 -9.489 395 2HH2 ARG 69 2HH2 ARG 69 -14.864 0.364 -8.891 396 H ALA 70 H ALA 70 -10.055 -5.611 -4.394 397 HA ALA 70 HA ALA 70 -8.260 -6.882 -6.393 398 1HB ALA 70 1HB ALA 70 -8.507 -7.564 -3.442 399 2HB ALA 70 2HB ALA 70 -7.544 -8.403 -4.676 400 3HB ALA 70 3HB ALA 70 -7.138 -6.744 -4.200 401 H LYS 71 H LYS 71 -9.711 -7.880 -7.676 402 HA LYS 71 HA LYS 71 -12.109 -9.207 -6.329 403 1HB LYS 71 1HB LYS 71 -11.780 -8.614 -9.254 404 2HB LYS 71 2HB LYS 71 -13.197 -9.281 -8.458 405 1HG LYS 71 1HG LYS 71 -13.866 -7.232 -7.575 406 2HG LYS 71 2HG LYS 71 -12.217 -6.626 -7.449 407 1HD LYS 71 1HD LYS 71 -13.279 -5.371 -9.198 408 2HD LYS 71 2HD LYS 71 -12.054 -6.426 -9.881 409 1HE LYS 71 1HE LYS 71 -14.147 -8.085 -10.255 410 2HE LYS 71 2HE LYS 71 -15.080 -6.599 -10.041 411 1HZ LYS 71 1HZ LYS 71 -14.659 -6.658 -12.329 412 2HZ LYS 71 2HZ LYS 71 -13.313 -5.787 -11.839 413 3HZ LYS 71 3HZ LYS 71 -13.155 -7.314 -12.148 414 H ASN 72 H ASN 72 -12.042 -11.414 -6.050 415 HA ASN 72 HA ASN 72 -9.724 -12.726 -7.231 416 1HB ASN 72 1HB ASN 72 -10.245 -13.320 -4.983 417 2HB ASN 72 2HB ASN 72 -11.888 -13.826 -5.433 418 1HD2 ASN 72 1HD2 ASN 72 -11.549 -16.025 -4.699 419 2HD2 ASN 72 2HD2 ASN 72 -10.560 -17.158 -5.618 420 H LEU 73 H LEU 73 -10.114 -12.448 -9.414 421 HA LEU 73 HA LEU 73 -12.243 -13.937 -10.703 422 1HB LEU 73 1HB LEU 73 -9.759 -12.514 -11.698 423 2HB LEU 73 2HB LEU 73 -10.719 -13.522 -12.775 424 HG LEU 73 HG LEU 73 -11.269 -11.213 -13.053 425 1HD1 LEU 73 1HD1 LEU 73 -13.658 -11.383 -13.070 426 2HD1 LEU 73 2HD1 LEU 73 -12.992 -12.981 -13.449 427 3HD1 LEU 73 3HD1 LEU 73 -13.661 -12.645 -11.833 428 1HD2 LEU 73 1HD2 LEU 73 -12.449 -9.885 -11.417 429 2HD2 LEU 73 2HD2 LEU 73 -12.369 -11.192 -10.219 430 3HD2 LEU 73 3HD2 LEU 73 -10.877 -10.391 -10.781 431 H ALA 74 H ALA 74 -11.672 -15.874 -9.254 432 HA ALA 74 HA ALA 74 -10.401 -17.815 -11.038 433 1HB ALA 74 1HB ALA 74 -8.531 -17.009 -9.529 434 2HB ALA 74 2HB ALA 74 -9.480 -17.561 -8.136 435 3HB ALA 74 3HB ALA 74 -8.917 -18.736 -9.330 436 H SER 75 H SER 75 -11.676 -19.632 -10.979 437 HA SER 75 HA SER 75 -13.781 -19.966 -9.003 438 1HB SER 75 1HB SER 75 -12.735 -21.867 -11.132 439 2HB SER 75 2HB SER 75 -14.188 -22.118 -10.149 440 HG SER 75 HG SER 75 -14.677 -21.181 -12.160 441 H THR 76 H THR 76 -11.341 -19.730 -7.618 442 HA THR 76 HA THR 76 -11.545 -22.092 -6.021 443 HB THR 76 HB THR 76 -8.947 -22.177 -5.846 444 HG1 THR 76 HG1 THR 76 -8.962 -21.217 -8.501 445 1HG2 THR 76 1HG2 THR 76 -8.638 -23.807 -7.574 446 2HG2 THR 76 2HG2 THR 76 -10.288 -23.994 -6.954 447 3HG2 THR 76 3HG2 THR 76 -10.007 -23.191 -8.513 448 HA PRO 77 HA PRO 77 -10.775 -18.857 -3.108 449 1HB PRO 77 1HB PRO 77 -9.816 -20.221 -0.922 450 2HB PRO 77 2HB PRO 77 -11.530 -20.317 -1.418 451 1HG PRO 77 1HG PRO 77 -9.309 -22.258 -2.102 452 2HG PRO 77 2HG PRO 77 -10.931 -22.637 -1.448 453 1HD PRO 77 1HD PRO 77 -10.372 -22.791 -4.105 454 2HD PRO 77 2HD PRO 77 -11.961 -22.203 -3.542 455 H THR 78 H THR 78 -8.889 -17.698 -2.399 456 HA THR 78 HA THR 78 -6.194 -18.892 -2.937 457 HB THR 78 HB THR 78 -5.589 -16.502 -3.796 458 HG1 THR 78 HG1 THR 78 -8.374 -16.581 -4.298 459 1HG2 THR 78 1HG2 THR 78 -6.203 -16.846 -6.055 460 2HG2 THR 78 2HG2 THR 78 -5.506 -18.333 -5.372 461 3HG2 THR 78 3HG2 THR 78 -7.278 -18.212 -5.655 462 H THR 79 H THR 79 -4.477 -17.608 -1.916 463 HA THR 79 HA THR 79 -5.400 -15.867 0.278 464 HB THR 79 HB THR 79 -4.734 -17.932 1.328 465 HG1 THR 79 HG1 THR 79 -4.257 -15.786 2.203 466 1HG2 THR 79 1HG2 THR 79 -3.085 -18.773 -0.345 467 2HG2 THR 79 2HG2 THR 79 -1.973 -17.460 0.108 468 3HG2 THR 79 3HG2 THR 79 -2.411 -18.700 1.294 469 H GLY 80 H GLY 80 -4.369 -14.023 0.502 470 1HA GLY 80 1HA GLY 80 -2.530 -13.155 -1.648 471 2HA GLY 80 2HA GLY 80 -3.576 -12.138 -0.651 472 H GLN 81 H GLN 81 -0.788 -14.271 -0.609 473 HA GLN 81 HA GLN 81 0.269 -12.958 1.863 474 1HB GLN 81 1HB GLN 81 0.748 -15.739 0.696 475 2HB GLN 81 2HB GLN 81 1.795 -15.050 1.930 476 1HG GLN 81 1HG GLN 81 -1.212 -15.459 2.247 477 2HG GLN 81 2HG GLN 81 0.016 -16.588 2.815 478 1HE2 GLN 81 1HE2 GLN 81 1.559 -13.720 3.431 479 2HE2 GLN 81 2HE2 GLN 81 0.916 -13.438 5.036 480 H ALA 82 H ALA 82 0.280 -11.431 -0.163 481 HA ALA 82 HA ALA 82 2.384 -11.842 -2.110 482 1HB ALA 82 1HB ALA 82 1.772 -9.561 -2.761 483 2HB ALA 82 2HB ALA 82 0.292 -10.505 -2.389 484 3HB ALA 82 3HB ALA 82 0.937 -9.321 -1.224 485 H THR 83 H THR 83 4.020 -9.861 -2.275 486 HA THR 83 HA THR 83 5.051 -9.133 0.405 487 HB THR 83 HB THR 83 7.033 -9.817 -1.683 488 HG1 THR 83 HG1 THR 83 5.569 -11.685 -1.281 489 1HG2 THR 83 1HG2 THR 83 7.740 -8.703 0.441 490 2HG2 THR 83 2HG2 THR 83 6.989 -10.031 1.364 491 3HG2 THR 83 3HG2 THR 83 8.397 -10.347 0.335 492 H PHE 84 H PHE 84 6.230 -7.118 0.361 493 HA PHE 84 HA PHE 84 6.159 -5.620 -2.144 494 1HB PHE 84 1HB PHE 84 4.998 -3.735 -1.059 495 2HB PHE 84 2HB PHE 84 3.971 -5.155 -1.213 496 HD1 PHE 84 HD1 PHE 84 5.786 -3.044 1.202 497 HD2 PHE 84 HD2 PHE 84 3.154 -6.413 0.715 498 HE1 PHE 84 HE1 PHE 84 5.105 -2.861 3.590 499 HE2 PHE 84 HE2 PHE 84 2.523 -6.273 3.096 500 HZ PHE 84 HZ PHE 84 3.474 -4.479 4.539 501 H ASN 85 H ASN 85 7.601 -3.937 -2.144 502 HA ASN 85 HA ASN 85 9.446 -3.665 0.221 503 1HB ASN 85 1HB ASN 85 10.935 -4.148 -1.417 504 2HB ASN 85 2HB ASN 85 9.955 -3.538 -2.728 505 1HD2 ASN 85 1HD2 ASN 85 9.882 -1.205 -3.104 506 2HD2 ASN 85 2HD2 ASN 85 11.085 -0.114 -2.412 507 H VAL 86 H VAL 86 8.831 -1.995 1.433 508 HA VAL 86 HA VAL 86 7.107 0.150 0.287 509 HB VAL 86 HB VAL 86 6.089 -1.027 2.006 510 1HG1 VAL 86 1HG1 VAL 86 7.890 -2.093 3.238 511 2HG1 VAL 86 2HG1 VAL 86 8.436 -0.528 3.872 512 3HG1 VAL 86 3HG1 VAL 86 6.858 -1.170 4.330 513 1HG2 VAL 86 1HG2 VAL 86 5.780 1.405 1.905 514 2HG2 VAL 86 2HG2 VAL 86 5.427 0.676 3.483 515 3HG2 VAL 86 3HG2 VAL 86 6.932 1.574 3.246 516 H THR 87 H THR 87 9.059 1.151 -0.782 517 HA THR 87 HA THR 87 10.067 3.264 0.578 518 HB THR 87 HB THR 87 11.313 1.863 2.085 519 HG1 THR 87 HG1 THR 87 13.445 2.532 1.592 520 1HG2 THR 87 1HG2 THR 87 12.641 0.651 -0.345 521 2HG2 THR 87 2HG2 THR 87 13.070 0.337 1.350 522 3HG2 THR 87 3HG2 THR 87 11.478 -0.144 0.744 523 HA PRO 88 HA PRO 88 11.709 3.751 -3.615 524 1HB PRO 88 1HB PRO 88 13.389 5.953 -3.129 525 2HB PRO 88 2HB PRO 88 11.658 6.085 -3.471 526 1HG PRO 88 1HG PRO 88 13.012 6.363 -0.850 527 2HG PRO 88 2HG PRO 88 11.513 7.110 -1.434 528 1HD PRO 88 1HD PRO 88 11.655 4.934 0.297 529 2HD PRO 88 2HD PRO 88 10.236 5.346 -0.673 530 H MET 89 H MET 89 13.506 3.633 -0.572 531 HA MET 89 HA MET 89 15.220 1.626 -1.138 532 1HB MET 89 1HB MET 89 17.462 2.762 -1.366 533 2HB MET 89 2HB MET 89 16.462 2.731 -2.795 534 1HG MET 89 1HG MET 89 15.754 5.189 -2.022 535 2HG MET 89 2HG MET 89 17.237 5.070 -1.067 536 1HE MET 89 1HE MET 89 15.674 5.286 -4.623 537 2HE MET 89 2HE MET 89 17.108 5.167 -5.668 538 3HE MET 89 3HE MET 89 16.526 3.734 -4.800 539 H ALA 90 H ALA 90 15.821 4.868 0.248 540 HA ALA 90 HA ALA 90 17.143 3.789 2.508 541 1HB ALA 90 1HB ALA 90 17.336 6.141 3.174 542 2HB ALA 90 2HB ALA 90 17.620 5.980 1.427 543 3HB ALA 90 3HB ALA 90 16.055 6.581 2.018 544 H ALA 91 H ALA 91 13.903 5.263 2.180 545 HA ALA 91 HA ALA 91 13.642 5.574 5.038 546 1HB ALA 91 1HB ALA 91 11.411 6.550 4.425 547 2HB ALA 91 2HB ALA 91 12.798 7.265 3.567 548 3HB ALA 91 3HB ALA 91 11.751 6.115 2.728 549 H GLY 92 H GLY 92 10.773 4.467 3.408 550 1HA GLY 92 1HA GLY 92 9.260 2.919 3.952 551 2HA GLY 92 2HA GLY 92 10.548 1.809 4.450 552 H ALA 93 H ALA 93 11.533 3.084 6.758 553 HA ALA 93 HA ALA 93 9.736 2.522 8.791 554 1HB ALA 93 1HB ALA 93 12.129 2.929 9.160 555 2HB ALA 93 2HB ALA 93 11.923 4.652 8.784 556 3HB ALA 93 3HB ALA 93 11.156 3.960 10.228 557 H TYR 94 H TYR 94 10.395 5.737 7.418 558 HA TYR 94 HA TYR 94 8.139 7.024 8.668 559 1HB TYR 94 1HB TYR 94 9.963 7.972 6.444 560 2HB TYR 94 2HB TYR 94 8.977 8.989 7.486 561 HD1 TYR 94 HD1 TYR 94 9.465 7.928 10.208 562 HD2 TYR 94 HD2 TYR 94 12.238 8.457 6.940 563 HE1 TYR 94 HE1 TYR 94 11.307 8.185 11.809 564 HE2 TYR 94 HE2 TYR 94 14.057 8.873 8.579 565 HH TYR 94 HH TYR 94 13.271 9.531 11.918 566 H PHE 95 H PHE 95 7.713 4.724 6.531 567 HA PHE 95 HA PHE 95 5.724 6.132 4.847 568 1HB PHE 95 1HB PHE 95 7.271 4.310 3.857 569 2HB PHE 95 2HB PHE 95 6.426 3.170 4.877 570 HD1 PHE 95 HD1 PHE 95 3.842 2.929 4.607 571 HD2 PHE 95 HD2 PHE 95 6.484 4.571 1.626 572 HE1 PHE 95 HE1 PHE 95 2.058 2.742 2.897 573 HE2 PHE 95 HE2 PHE 95 4.705 4.357 -0.065 574 HZ PHE 95 HZ PHE 95 2.484 3.466 0.569 575 H ASN 96 H ASN 96 3.828 6.520 6.082 576 HA ASN 96 HA ASN 96 3.483 4.791 8.292 577 1HB ASN 96 1HB ASN 96 1.730 7.069 7.366 578 2HB ASN 96 2HB ASN 96 1.357 6.059 8.752 579 1HD2 ASN 96 1HD2 ASN 96 3.505 8.587 7.615 580 2HD2 ASN 96 2HD2 ASN 96 4.281 8.831 9.214 581 H LYS 97 H LYS 97 3.321 2.758 7.156 582 HA LYS 97 HA LYS 97 0.430 2.006 6.918 583 1HB LYS 97 1HB LYS 97 1.286 1.689 4.725 584 2HB LYS 97 2HB LYS 97 2.740 0.862 5.316 585 1HG LYS 97 1HG LYS 97 1.466 -1.060 6.019 586 2HG LYS 97 2HG LYS 97 -0.078 -0.254 5.713 587 1HD LYS 97 1HD LYS 97 1.961 -0.574 3.491 588 2HD LYS 97 2HD LYS 97 1.027 -1.986 3.961 589 1HE LYS 97 1HE LYS 97 -0.424 0.615 3.377 590 2HE LYS 97 2HE LYS 97 0.175 -0.355 2.030 591 1HZ LYS 97 1HZ LYS 97 -1.561 -1.600 4.079 592 2HZ LYS 97 2HZ LYS 97 -2.147 -0.796 2.771 593 3HZ LYS 97 3HZ LYS 97 -1.208 -2.112 2.570 594 H VAL 98 H VAL 98 0.411 1.753 9.183 595 HA VAL 98 HA VAL 98 1.476 -0.860 10.004 596 HB VAL 98 HB VAL 98 1.961 0.021 12.278 597 1HG1 VAL 98 1HG1 VAL 98 4.193 0.831 11.783 598 2HG1 VAL 98 2HG1 VAL 98 3.767 -0.446 10.632 599 3HG1 VAL 98 3HG1 VAL 98 3.727 1.259 10.128 600 1HG2 VAL 98 1HG2 VAL 98 2.486 2.413 12.596 601 2HG2 VAL 98 2HG2 VAL 98 1.868 2.787 10.979 602 3HG2 VAL 98 3HG2 VAL 98 0.773 2.187 12.245 603 H GLN 99 H GLN 99 -0.171 -2.043 10.876 604 HA GLN 99 HA GLN 99 -2.323 -0.873 12.364 605 1HB GLN 99 1HB GLN 99 -3.010 -0.325 9.977 606 2HB GLN 99 2HB GLN 99 -3.020 -2.060 9.632 607 1HG GLN 99 1HG GLN 99 -4.751 -2.371 11.412 608 2HG GLN 99 2HG GLN 99 -4.722 -0.630 11.733 609 1HE2 GLN 99 1HE2 GLN 99 -5.037 0.758 9.581 610 2HE2 GLN 99 2HE2 GLN 99 -6.352 0.181 8.571 611 H CYS 100 H CYS 100 -2.852 -2.485 13.816 612 HA CYS 100 HA CYS 100 -1.706 -5.152 13.510 613 1HB CYS 100 1HB CYS 100 -3.482 -3.910 15.655 614 2HB CYS 100 2HB CYS 100 -2.778 -5.539 15.728 615 HG CYS 100 HG CYS 100 -1.430 -3.965 17.268 616 H PHE 101 H PHE 101 -3.032 -5.282 11.358 617 HA PHE 101 HA PHE 101 -5.240 -7.075 11.725 618 1HB PHE 101 1HB PHE 101 -6.292 -4.745 12.124 619 2HB PHE 101 2HB PHE 101 -5.843 -4.365 10.465 620 HD1 PHE 101 HD1 PHE 101 -7.499 -7.294 12.219 621 HD2 PHE 101 HD2 PHE 101 -7.809 -4.249 9.171 622 HE1 PHE 101 HE1 PHE 101 -9.669 -8.233 11.494 623 HE2 PHE 101 HE2 PHE 101 -10.020 -5.145 8.515 624 HZ PHE 101 HZ PHE 101 -10.938 -7.163 9.644 625 H CYS 102 H CYS 102 -6.313 -6.877 9.108 626 HA CYS 102 HA CYS 102 -4.235 -7.978 7.514 627 1HB CYS 102 1HB CYS 102 -5.742 -7.869 5.622 628 2HB CYS 102 2HB CYS 102 -6.477 -8.623 7.044 629 HG CYS 102 HG CYS 102 -7.917 -6.661 7.760 630 H PHE 103 H PHE 103 -2.496 -6.838 7.247 631 HA PHE 103 HA PHE 103 -1.861 -4.261 6.907 632 1HB PHE 103 1HB PHE 103 0.066 -4.981 5.600 633 2HB PHE 103 2HB PHE 103 -0.247 -6.112 6.904 634 HD1 PHE 103 HD1 PHE 103 -1.343 -8.383 6.371 635 HD2 PHE 103 HD2 PHE 103 0.025 -5.687 3.286 636 HE1 PHE 103 HE1 PHE 103 -1.846 -10.082 4.643 637 HE2 PHE 103 HE2 PHE 103 -0.415 -7.436 1.579 638 HZ PHE 103 HZ PHE 103 -1.376 -9.613 2.251 639 H THR 104 H THR 104 -3.061 -6.326 4.297 640 HA THR 104 HA THR 104 -4.531 -4.180 3.076 641 HB THR 104 HB THR 104 -2.374 -5.566 1.425 642 HG1 THR 104 HG1 THR 104 -2.474 -3.385 2.883 643 1HG2 THR 104 1HG2 THR 104 -3.101 -4.076 -0.403 644 2HG2 THR 104 2HG2 THR 104 -4.469 -5.072 0.108 645 3HG2 THR 104 3HG2 THR 104 -4.371 -3.379 0.629 646 H GLU 105 H GLU 105 -3.637 -7.114 1.229 647 HA GLU 105 HA GLU 105 -6.347 -8.090 1.552 648 1HB GLU 105 1HB GLU 105 -5.797 -9.558 -0.205 649 2HB GLU 105 2HB GLU 105 -5.197 -7.971 -0.614 650 1HG GLU 105 1HG GLU 105 -3.393 -10.144 0.547 651 2HG GLU 105 2HG GLU 105 -3.687 -9.944 -1.185 652 H THR 106 H THR 106 -5.977 -10.855 1.354 653 HA THR 106 HA THR 106 -4.484 -11.998 3.457 654 HB THR 106 HB THR 106 -5.675 -10.906 5.099 655 HG1 THR 106 HG1 THR 106 -6.836 -12.550 6.079 656 1HG2 THR 106 1HG2 THR 106 -8.393 -11.527 3.861 657 2HG2 THR 106 2HG2 THR 106 -8.034 -10.605 5.316 658 3HG2 THR 106 3HG2 THR 106 -7.574 -9.955 3.748 659 H THR 107 H THR 107 -7.829 -12.553 2.380 660 HA THR 107 HA THR 107 -7.083 -14.693 0.644 661 HB THR 107 HB THR 107 -7.333 -15.373 3.388 662 HG1 THR 107 HG1 THR 107 -7.376 -16.921 1.024 663 1HG2 THR 107 1HG2 THR 107 -9.725 -16.496 1.874 664 2HG2 THR 107 2HG2 THR 107 -9.180 -16.933 3.500 665 3HG2 THR 107 3HG2 THR 107 -9.809 -15.305 3.199 666 H LEU 108 H LEU 108 -8.876 -15.447 -0.634 667 HA LEU 108 HA LEU 108 -11.502 -14.295 -0.082 668 1HB LEU 108 1HB LEU 108 -10.099 -13.833 -2.747 669 2HB LEU 108 2HB LEU 108 -11.804 -13.508 -2.446 670 HG LEU 108 HG LEU 108 -9.529 -12.099 -1.026 671 1HD1 LEU 108 1HD1 LEU 108 -9.628 -11.644 -3.496 672 2HD1 LEU 108 2HD1 LEU 108 -11.252 -10.986 -3.261 673 3HD1 LEU 108 3HD1 LEU 108 -9.844 -10.236 -2.469 674 1HD2 LEU 108 1HD2 LEU 108 -11.792 -12.166 0.192 675 2HD2 LEU 108 2HD2 LEU 108 -11.191 -10.568 -0.195 676 3HD2 LEU 108 3HD2 LEU 108 -12.470 -11.304 -1.195 677 H GLU 109 H GLU 109 -13.136 -15.485 -1.018 678 HA GLU 109 HA GLU 109 -12.352 -18.154 -1.905 679 1HB GLU 109 1HB GLU 109 -15.204 -17.477 -1.424 680 2HB GLU 109 2HB GLU 109 -14.233 -18.936 -1.083 681 1HG GLU 109 1HG GLU 109 -13.045 -17.693 0.734 682 2HG GLU 109 2HG GLU 109 -14.262 -16.405 0.568 683 HA PRO 110 HA PRO 110 -12.926 -17.836 -5.994 684 1HB PRO 110 1HB PRO 110 -14.836 -19.593 -6.993 685 2HB PRO 110 2HB PRO 110 -13.293 -20.045 -6.228 686 1HG PRO 110 1HG PRO 110 -15.971 -19.931 -4.913 687 2HG PRO 110 2HG PRO 110 -14.742 -21.243 -4.849 688 1HD PRO 110 1HD PRO 110 -14.981 -19.434 -2.920 689 2HD PRO 110 2HD PRO 110 -13.352 -19.981 -3.407 690 H GLY 111 H GLY 111 -13.532 -15.607 -6.126 691 1HA GLY 111 1HA GLY 111 -14.799 -14.807 -8.259 692 2HA GLY 111 2HA GLY 111 -16.234 -15.086 -7.272 693 H GLU 112 H GLU 112 -14.530 -14.250 -4.813 694 HA GLU 112 HA GLU 112 -16.365 -12.196 -4.797 695 1HB GLU 112 1HB GLU 112 -14.343 -12.806 -2.637 696 2HB GLU 112 2HB GLU 112 -15.934 -12.057 -2.481 697 1HG GLU 112 1HG GLU 112 -15.366 -14.908 -3.118 698 2HG GLU 112 2HG GLU 112 -16.234 -14.219 -1.760 699 H GLU 113 H GLU 113 -16.327 -10.002 -4.790 700 HA GLU 113 HA GLU 113 -13.938 -8.537 -5.472 701 1HB GLU 113 1HB GLU 113 -16.738 -7.564 -4.825 702 2HB GLU 113 2HB GLU 113 -15.462 -6.674 -5.662 703 1HG GLU 113 1HG GLU 113 -16.547 -7.373 -7.456 704 2HG GLU 113 2HG GLU 113 -15.580 -8.845 -7.222 705 H MET 114 H MET 114 -12.415 -7.946 -3.946 706 HA MET 114 HA MET 114 -13.257 -7.212 -1.219 707 1HB MET 114 1HB MET 114 -11.569 -9.016 -1.694 708 2HB MET 114 2HB MET 114 -10.534 -7.842 -2.475 709 1HG MET 114 1HG MET 114 -9.814 -8.207 -0.237 710 2HG MET 114 2HG MET 114 -10.348 -6.532 -0.405 711 1HE MET 114 1HE MET 114 -10.276 -6.224 2.209 712 2HE MET 114 2HE MET 114 -11.097 -7.312 3.354 713 3HE MET 114 3HE MET 114 -9.725 -7.908 2.391 714 H GLU 115 H GLU 115 -13.204 -5.016 -0.810 715 HA GLU 115 HA GLU 115 -11.045 -3.467 -1.912 716 1HB GLU 115 1HB GLU 115 -12.384 -1.647 -2.867 717 2HB GLU 115 2HB GLU 115 -12.593 -3.154 -3.749 718 1HG GLU 115 1HG GLU 115 -14.782 -3.512 -2.622 719 2HG GLU 115 2HG GLU 115 -14.592 -1.951 -1.799 720 H MET 116 H MET 116 -10.435 -1.759 -0.615 721 HA MET 116 HA MET 116 -12.184 -0.772 1.473 722 1HB MET 116 1HB MET 116 -9.684 -2.366 2.220 723 2HB MET 116 2HB MET 116 -10.553 -1.277 3.302 724 1HG MET 116 1HG MET 116 -12.628 -2.713 2.933 725 2HG MET 116 2HG MET 116 -11.570 -3.863 2.100 726 1HE MET 116 1HE MET 116 -12.605 -2.251 5.485 727 2HE MET 116 2HE MET 116 -11.457 -2.985 6.627 728 3HE MET 116 3HE MET 116 -10.890 -1.763 5.475 729 HA PRO 117 HA PRO 117 -9.152 2.557 0.863 730 1HB PRO 117 1HB PRO 117 -9.908 4.304 2.789 731 2HB PRO 117 2HB PRO 117 -10.775 4.064 1.249 732 1HG PRO 117 1HG PRO 117 -11.504 3.027 3.963 733 2HG PRO 117 2HG PRO 117 -12.526 3.573 2.587 734 1HD PRO 117 1HD PRO 117 -11.947 0.885 3.252 735 2HD PRO 117 2HD PRO 117 -12.579 1.474 1.684 736 H VAL 118 H VAL 118 -7.203 3.111 1.570 737 HA VAL 118 HA VAL 118 -6.363 2.430 4.358 738 HB VAL 118 HB VAL 118 -4.869 2.224 1.716 739 1HG1 VAL 118 1HG1 VAL 118 -2.825 1.763 3.037 740 2HG1 VAL 118 2HG1 VAL 118 -3.357 3.438 3.136 741 3HG1 VAL 118 3HG1 VAL 118 -3.666 2.329 4.499 742 1HG2 VAL 118 1HG2 VAL 118 -6.120 0.231 2.437 743 2HG2 VAL 118 2HG2 VAL 118 -4.373 -0.038 2.477 744 3HG2 VAL 118 3HG2 VAL 118 -5.260 0.251 3.992 745 H VAL 119 H VAL 119 -6.050 4.292 5.476 746 HA VAL 119 HA VAL 119 -5.681 6.834 4.060 747 HB VAL 119 HB VAL 119 -7.131 6.700 6.050 748 1HG1 VAL 119 1HG1 VAL 119 -4.562 6.291 7.649 749 2HG1 VAL 119 2HG1 VAL 119 -6.189 6.558 8.293 750 3HG1 VAL 119 3HG1 VAL 119 -5.829 5.067 7.415 751 1HG2 VAL 119 1HG2 VAL 119 -4.715 8.513 6.415 752 2HG2 VAL 119 2HG2 VAL 119 -6.085 8.822 5.324 753 3HG2 VAL 119 3HG2 VAL 119 -6.345 8.758 7.070 754 H PHE 120 H PHE 120 -3.678 8.023 4.113 755 HA PHE 120 HA PHE 120 -1.272 6.650 5.190 756 1HB PHE 120 1HB PHE 120 -1.644 5.519 3.053 757 2HB PHE 120 2HB PHE 120 -1.986 7.048 2.264 758 HD1 PHE 120 HD1 PHE 120 0.785 5.321 4.158 759 HD2 PHE 120 HD2 PHE 120 -0.301 8.307 1.252 760 HE1 PHE 120 HE1 PHE 120 3.180 5.861 3.794 761 HE2 PHE 120 HE2 PHE 120 2.077 8.799 0.857 762 HZ PHE 120 HZ PHE 120 3.840 7.526 2.087 763 H PHE 121 H PHE 121 0.500 8.014 5.478 764 HA PHE 121 HA PHE 121 0.836 10.334 3.823 765 1HB PHE 121 1HB PHE 121 1.212 11.873 5.762 766 2HB PHE 121 2HB PHE 121 -0.463 11.428 5.495 767 HD1 PHE 121 HD1 PHE 121 -1.675 9.996 7.015 768 HD2 PHE 121 HD2 PHE 121 2.445 10.959 7.768 769 HE1 PHE 121 HE1 PHE 121 -1.917 9.182 9.360 770 HE2 PHE 121 HE2 PHE 121 2.220 10.154 10.087 771 HZ PHE 121 HZ PHE 121 0.028 9.239 10.885 772 H VAL 122 H VAL 122 2.983 11.109 3.886 773 HA VAL 122 HA VAL 122 5.063 9.250 4.798 774 HB VAL 122 HB VAL 122 5.107 11.998 3.492 775 1HG1 VAL 122 1HG1 VAL 122 7.187 11.836 4.641 776 2HG1 VAL 122 2HG1 VAL 122 7.410 10.140 4.192 777 3HG1 VAL 122 3HG1 VAL 122 7.528 11.413 2.963 778 1HG2 VAL 122 1HG2 VAL 122 5.464 9.204 2.367 779 2HG2 VAL 122 2HG2 VAL 122 4.199 10.364 1.970 780 3HG2 VAL 122 3HG2 VAL 122 5.864 10.677 1.476 781 H ASP 123 H ASP 123 6.375 9.586 6.615 782 HA ASP 123 HA ASP 123 5.384 11.481 8.563 783 1HB ASP 123 1HB ASP 123 6.569 8.998 8.730 784 2HB ASP 123 2HB ASP 123 7.885 10.063 9.241 785 HA PRO 124 HA PRO 124 8.136 14.774 7.243 786 1HB PRO 124 1HB PRO 124 8.246 15.809 10.028 787 2HB PRO 124 2HB PRO 124 7.666 16.604 8.569 788 1HG PRO 124 1HG PRO 124 6.041 15.623 10.574 789 2HG PRO 124 2HG PRO 124 5.481 15.787 8.896 790 1HD PRO 124 1HD PRO 124 6.296 13.308 10.347 791 2HD PRO 124 2HD PRO 124 5.134 13.545 9.001 792 H GLU 125 H GLU 125 8.882 12.873 10.126 793 HA GLU 125 HA GLU 125 11.438 13.275 10.809 794 1HB GLU 125 1HB GLU 125 9.951 10.755 10.175 795 2HB GLU 125 2HB GLU 125 11.633 10.739 10.680 796 1HG GLU 125 1HG GLU 125 9.664 12.235 12.387 797 2HG GLU 125 2HG GLU 125 9.768 10.476 12.449 798 H ILE 126 H ILE 126 10.389 11.920 7.644 799 HA ILE 126 HA ILE 126 12.795 10.809 6.853 800 HB ILE 126 HB ILE 126 10.591 10.632 5.746 801 1HG1 ILE 126 1HG1 ILE 126 12.845 11.372 3.817 802 2HG1 ILE 126 2HG1 ILE 126 12.798 9.894 4.807 803 1HG2 ILE 126 1HG2 ILE 126 10.115 13.132 5.626 804 2HG2 ILE 126 2HG2 ILE 126 11.298 13.228 4.307 805 3HG2 ILE 126 3HG2 ILE 126 9.833 12.253 4.121 806 1HD1 ILE 126 1HD1 ILE 126 10.746 10.663 2.719 807 2HD1 ILE 126 2HD1 ILE 126 11.926 9.334 2.669 808 3HD1 ILE 126 3HD1 ILE 126 10.625 9.303 3.875 809 H VAL 127 H VAL 127 12.022 14.295 6.894 810 HA VAL 127 HA VAL 127 14.707 14.847 5.674 811 HB VAL 127 HB VAL 127 14.039 17.224 5.836 812 1HG1 VAL 127 1HG1 VAL 127 12.231 15.434 4.168 813 2HG1 VAL 127 2HG1 VAL 127 12.585 17.147 3.870 814 3HG1 VAL 127 3HG1 VAL 127 13.880 15.944 3.747 815 1HG2 VAL 127 1HG2 VAL 127 12.185 16.916 7.578 816 2HG2 VAL 127 2HG2 VAL 127 11.770 17.895 6.161 817 3HG2 VAL 127 3HG2 VAL 127 11.197 16.228 6.267 818 H LYS 128 H LYS 128 15.067 13.401 7.857 819 HA LYS 128 HA LYS 128 16.354 15.428 9.626 820 1HB LYS 128 1HB LYS 128 14.901 12.960 10.594 821 2HB LYS 128 2HB LYS 128 16.158 13.806 11.512 822 1HG LYS 128 1HG LYS 128 14.813 15.876 11.459 823 2HG LYS 128 2HG LYS 128 13.638 15.089 10.394 824 1HD LYS 128 1HD LYS 128 12.722 15.042 12.607 825 2HD LYS 128 2HD LYS 128 13.166 13.396 12.129 826 1HE LYS 128 1HE LYS 128 15.188 13.458 13.493 827 2HE LYS 128 2HE LYS 128 14.863 15.143 13.960 828 1HZ LYS 128 1HZ LYS 128 12.878 14.369 15.060 829 2HZ LYS 128 2HZ LYS 128 13.039 12.876 14.483 830 3HZ LYS 128 3HZ LYS 128 14.133 13.430 15.591 831 HA PRO 129 HA PRO 129 19.569 12.225 9.844 832 1HB PRO 129 1HB PRO 129 19.423 9.603 9.118 833 2HB PRO 129 2HB PRO 129 18.708 10.223 10.635 834 1HG PRO 129 1HG PRO 129 17.324 9.802 7.984 835 2HG PRO 129 2HG PRO 129 16.801 9.197 9.574 836 1HD PRO 129 1HD PRO 129 15.735 11.483 8.612 837 2HD PRO 129 2HD PRO 129 16.209 11.313 10.334 838 H VAL 130 H VAL 130 21.373 11.630 8.577 839 HA VAL 130 HA VAL 130 21.613 12.784 6.063 840 HB VAL 130 HB VAL 130 23.278 10.624 7.423 841 1HG1 VAL 130 1HG1 VAL 130 25.118 11.495 5.995 842 2HG1 VAL 130 2HG1 VAL 130 23.835 10.734 5.042 843 3HG1 VAL 130 3HG1 VAL 130 23.940 12.509 5.128 844 1HG2 VAL 130 1HG2 VAL 130 24.707 12.551 8.094 845 2HG2 VAL 130 2HG2 VAL 130 23.528 13.670 7.384 846 3HG2 VAL 130 3HG2 VAL 130 23.095 12.688 8.797 847 H GLU 131 H GLU 131 20.979 9.328 6.982 848 HA GLU 131 HA GLU 131 21.230 7.947 4.720 849 1HB GLU 131 1HB GLU 131 20.884 7.309 7.155 850 2HB GLU 131 2HB GLU 131 19.200 7.873 7.028 851 1HG GLU 131 1HG GLU 131 18.847 6.325 5.279 852 2HG GLU 131 2HG GLU 131 20.528 5.725 5.390 853 H THR 132 H THR 132 18.275 9.772 5.801 854 HA THR 132 HA THR 132 17.063 9.016 3.221 855 HB THR 132 HB THR 132 14.969 9.807 4.323 856 HG1 THR 132 HG1 THR 132 15.585 11.127 5.935 857 1HG2 THR 132 1HG2 THR 132 15.575 7.410 4.377 858 2HG2 THR 132 2HG2 THR 132 16.525 7.667 5.855 859 3HG2 THR 132 3HG2 THR 132 14.769 7.896 5.879 860 H GLN 133 H GLN 133 18.774 11.630 4.531 861 HA GLN 133 HA GLN 133 17.458 13.900 3.898 862 1HB GLN 133 1HB GLN 133 20.030 13.345 4.613 863 2HB GLN 133 2HB GLN 133 20.309 13.762 2.945 864 1HG GLN 133 1HG GLN 133 20.571 15.762 4.155 865 2HG GLN 133 2HG GLN 133 19.001 15.923 3.367 866 1HE2 GLN 133 1HE2 GLN 133 18.699 13.698 6.050 867 2HE2 GLN 133 2HE2 GLN 133 18.340 14.885 7.265 868 H GLY 134 H GLY 134 16.253 14.379 2.153 869 1HA GLY 134 1HA GLY 134 16.154 15.331 -0.011 870 2HA GLY 134 2HA GLY 134 17.552 14.393 -0.532 871 H ILE 135 H ILE 135 15.923 11.993 0.958 872 HA ILE 135 HA ILE 135 14.649 11.003 -1.445 873 HB ILE 135 HB ILE 135 14.553 10.103 1.434 874 1HG1 ILE 135 1HG1 ILE 135 16.696 9.771 0.148 875 2HG1 ILE 135 2HG1 ILE 135 15.883 8.296 0.669 876 1HG2 ILE 135 1HG2 ILE 135 12.407 9.484 0.487 877 2HG2 ILE 135 2HG2 ILE 135 13.175 8.869 -0.974 878 3HG2 ILE 135 3HG2 ILE 135 13.439 8.061 0.599 879 1HD1 ILE 135 1HD1 ILE 135 15.064 7.803 -1.526 880 2HD1 ILE 135 2HD1 ILE 135 15.722 9.327 -2.178 881 3HD1 ILE 135 3HD1 ILE 135 16.809 8.064 -1.578 882 H LYS 136 H LYS 136 12.732 11.630 -2.220 883 HA LYS 136 HA LYS 136 10.519 12.182 -0.407 884 1HB LYS 136 1HB LYS 136 10.043 14.380 -1.308 885 2HB LYS 136 2HB LYS 136 11.475 14.333 -0.284 886 1HG LYS 136 1HG LYS 136 12.950 14.733 -1.993 887 2HG LYS 136 2HG LYS 136 11.971 13.907 -3.217 888 1HD LYS 136 1HD LYS 136 10.278 15.638 -3.134 889 2HD LYS 136 2HD LYS 136 11.161 16.492 -1.849 890 1HE LYS 136 1HE LYS 136 13.082 16.859 -3.430 891 2HE LYS 136 2HE LYS 136 12.186 16.018 -4.707 892 1HZ LYS 136 1HZ LYS 136 11.351 18.529 -3.402 893 2HZ LYS 136 2HZ LYS 136 11.997 18.394 -4.908 894 3HZ LYS 136 3HZ LYS 136 10.519 17.749 -4.588 895 H THR 137 H THR 137 10.583 10.042 -1.958 896 HA THR 137 HA THR 137 8.125 10.585 -3.149 897 HB THR 137 HB THR 137 9.671 9.033 -5.187 898 HG1 THR 137 HG1 THR 137 9.884 11.835 -4.827 899 1HG2 THR 137 1HG2 THR 137 8.105 10.162 -6.657 900 2HG2 THR 137 2HG2 THR 137 7.246 9.462 -5.262 901 3HG2 THR 137 3HG2 THR 137 7.574 11.210 -5.314 902 H LEU 138 H LEU 138 7.417 9.398 -1.476 903 HA LEU 138 HA LEU 138 8.922 7.090 -0.663 904 1HB LEU 138 1HB LEU 138 7.695 8.940 0.706 905 2HB LEU 138 2HB LEU 138 6.294 7.876 0.610 906 HG LEU 138 HG LEU 138 8.103 6.084 1.353 907 1HD1 LEU 138 1HD1 LEU 138 10.080 7.473 1.253 908 2HD1 LEU 138 2HD1 LEU 138 9.281 8.701 2.259 909 3HD1 LEU 138 3HD1 LEU 138 9.722 7.131 2.960 910 1HD2 LEU 138 1HD2 LEU 138 7.601 6.486 3.735 911 2HD2 LEU 138 2HD2 LEU 138 7.065 8.110 3.408 912 3HD2 LEU 138 3HD2 LEU 138 6.122 6.750 2.793 913 H THR 139 H THR 139 8.711 5.473 -2.212 914 HA THR 139 HA THR 139 6.006 4.868 -3.141 915 HB THR 139 HB THR 139 7.779 5.113 -4.809 916 HG1 THR 139 HG1 THR 139 6.135 3.845 -5.452 917 1HG2 THR 139 1HG2 THR 139 9.608 4.165 -3.519 918 2HG2 THR 139 2HG2 THR 139 8.882 2.537 -3.630 919 3HG2 THR 139 3HG2 THR 139 9.446 3.360 -5.100 920 H LEU 140 H LEU 140 5.692 2.509 -3.671 921 HA LEU 140 HA LEU 140 6.556 0.644 -1.675 922 1HB LEU 140 1HB LEU 140 4.549 1.709 -0.622 923 2HB LEU 140 2HB LEU 140 3.558 1.226 -2.003 924 HG LEU 140 HG LEU 140 5.041 -0.802 -0.272 925 1HD1 LEU 140 1HD1 LEU 140 2.220 0.285 0.118 926 2HD1 LEU 140 2HD1 LEU 140 2.948 -1.073 1.008 927 3HD1 LEU 140 3HD1 LEU 140 3.600 0.559 1.201 928 1HD2 LEU 140 1HD2 LEU 140 2.634 -0.967 -2.139 929 2HD2 LEU 140 2HD2 LEU 140 4.200 -1.779 -2.333 930 3HD2 LEU 140 3HD2 LEU 140 3.119 -2.264 -1.030 931 H SER 141 H SER 141 7.259 -0.849 -3.114 932 HA SER 141 HA SER 141 5.933 -1.304 -5.715 933 1HB SER 141 1HB SER 141 7.980 -2.689 -6.083 934 2HB SER 141 2HB SER 141 8.257 -0.948 -5.884 935 HG SER 141 HG SER 141 8.360 -2.842 -3.788 936 H TYR 142 H TYR 142 4.153 -2.463 -5.280 937 HA TYR 142 HA TYR 142 4.081 -4.655 -3.339 938 1HB TYR 142 1HB TYR 142 2.227 -2.744 -4.322 939 2HB TYR 142 2HB TYR 142 1.687 -4.255 -5.032 940 HD1 TYR 142 HD1 TYR 142 0.584 -2.250 -2.742 941 HD2 TYR 142 HD2 TYR 142 2.127 -6.273 -2.926 942 HE1 TYR 142 HE1 TYR 142 -0.395 -2.726 -0.527 943 HE2 TYR 142 HE2 TYR 142 1.142 -6.741 -0.698 944 HH TYR 142 HH TYR 142 -0.703 -4.337 1.137 945 H THR 143 H THR 143 4.309 -6.807 -3.954 946 HA THR 143 HA THR 143 3.962 -7.485 -6.850 947 HB THR 143 HB THR 143 5.966 -8.744 -4.926 948 HG1 THR 143 HG1 THR 143 6.440 -6.519 -5.389 949 1HG2 THR 143 1HG2 THR 143 5.761 -8.758 -7.977 950 2HG2 THR 143 2HG2 THR 143 6.965 -9.617 -6.997 951 3HG2 THR 143 3HG2 THR 143 5.260 -10.101 -6.929 952 H PHE 144 H PHE 144 1.890 -8.006 -6.644 953 HA PHE 144 HA PHE 144 0.962 -10.038 -4.790 954 1HB PHE 144 1HB PHE 144 -0.181 -8.875 -7.339 955 2HB PHE 144 2HB PHE 144 -1.037 -9.862 -6.216 956 HD1 PHE 144 HD1 PHE 144 -0.610 -8.720 -3.558 957 HD2 PHE 144 HD2 PHE 144 -1.202 -6.800 -7.373 958 HE1 PHE 144 HE1 PHE 144 -1.384 -6.691 -2.427 959 HE2 PHE 144 HE2 PHE 144 -2.329 -4.956 -6.201 960 HZ PHE 144 HZ PHE 144 -2.075 -4.711 -3.733 961 H TYR 145 H TYR 145 2.444 -11.803 -5.095 962 HA TYR 145 HA TYR 145 1.681 -13.499 -7.387 963 1HB TYR 145 1HB TYR 145 3.766 -13.847 -8.249 964 2HB TYR 145 2HB TYR 145 3.696 -12.106 -8.033 965 HD1 TYR 145 HD1 TYR 145 4.463 -11.992 -5.013 966 HD2 TYR 145 HD2 TYR 145 6.057 -14.268 -8.321 967 HE1 TYR 145 HE1 TYR 145 6.605 -12.183 -3.844 968 HE2 TYR 145 HE2 TYR 145 8.207 -14.477 -7.116 969 HH TYR 145 HH TYR 145 8.732 -13.074 -3.873 970 HA PRO 146 HA PRO 146 2.767 -15.990 -3.520 971 1HB PRO 146 1HB PRO 146 0.473 -16.303 -2.096 972 2HB PRO 146 2HB PRO 146 1.485 -14.848 -2.018 973 1HG PRO 146 1HG PRO 146 -0.983 -15.201 -3.760 974 2HG PRO 146 2HG PRO 146 -0.628 -13.885 -2.607 975 1HD PRO 146 1HD PRO 146 -0.060 -13.664 -5.251 976 2HD PRO 146 2HD PRO 146 0.988 -12.948 -3.981 977 H ARG 147 H ARG 147 -0.545 -17.148 -3.713 978 HA ARG 147 HA ARG 147 0.393 -19.571 -5.201 979 1HB ARG 147 1HB ARG 147 -1.248 -19.423 -2.649 980 2HB ARG 147 2HB ARG 147 -0.891 -20.888 -3.554 981 1HG ARG 147 1HG ARG 147 1.161 -19.167 -2.087 982 2HG ARG 147 2HG ARG 147 0.422 -20.652 -1.499 983 1HD ARG 147 1HD ARG 147 2.560 -21.279 -2.279 984 2HD ARG 147 2HD ARG 147 1.398 -21.881 -3.487 985 HE ARG 147 HE ARG 147 2.247 -19.250 -4.195 986 1HH1 ARG 147 1HH1 ARG 147 3.638 -22.481 -4.163 987 2HH1 ARG 147 2HH1 ARG 147 4.671 -22.190 -5.533 988 1HH2 ARG 147 1HH2 ARG 147 3.435 -18.829 -5.881 989 2HH2 ARG 147 2HH2 ARG 147 4.596 -19.962 -6.563 990 H GLU 148 H GLU 148 -0.697 -19.527 -7.037 991 HA GLU 148 HA GLU 148 -3.645 -19.149 -7.010 992 1HB GLU 148 1HB GLU 148 -2.309 -17.905 -8.669 993 2HB GLU 148 2HB GLU 148 -1.714 -19.428 -9.340 994 1HG GLU 148 1HG GLU 148 -4.573 -19.666 -9.245 995 2HG GLU 148 2HG GLU 148 -4.216 -18.024 -9.790 996 HA PRO 149 HA PRO 149 -3.265 -23.720 -7.276 997 1HB PRO 149 1HB PRO 149 -5.804 -24.430 -6.631 998 2HB PRO 149 2HB PRO 149 -4.604 -23.894 -5.420 999 1HG PRO 149 1HG PRO 149 -6.796 -22.293 -6.689 1000 2HG PRO 149 2HG PRO 149 -6.333 -22.316 -4.970 1001 1HD PRO 149 1HD PRO 149 -5.545 -20.376 -6.785 1002 2HD PRO 149 2HD PRO 149 -4.554 -20.832 -5.364 1003 H SER 150 H SER 150 -6.132 -21.931 -8.620 1004 HA SER 150 HA SER 150 -5.584 -22.703 -11.333 1005 1HB SER 150 1HB SER 150 -7.666 -24.270 -9.769 1006 2HB SER 150 2HB SER 150 -7.844 -24.016 -11.502 1007 HG SER 150 HG SER 150 -5.432 -25.030 -10.506 1008 H LYS 151 H LYS 151 -6.037 -20.627 -12.017 1009 HA LYS 151 HA LYS 151 -8.837 -19.607 -11.651 1010 1HB LYS 151 1HB LYS 151 -8.005 -17.448 -12.185 1011 2HB LYS 151 2HB LYS 151 -7.056 -18.152 -10.874 1012 1HG LYS 151 1HG LYS 151 -5.171 -17.816 -11.969 1013 2HG LYS 151 2HG LYS 151 -5.690 -18.795 -13.328 1014 1HD LYS 151 1HD LYS 151 -6.813 -16.779 -14.300 1015 2HD LYS 151 2HD LYS 151 -6.313 -15.830 -12.889 1016 1HE LYS 151 1HE LYS 151 -3.914 -16.319 -13.415 1017 2HE LYS 151 2HE LYS 151 -4.422 -17.267 -14.822 1018 1HZ LYS 151 1HZ LYS 151 -3.784 -15.052 -15.439 1019 2HZ LYS 151 2HZ LYS 151 -5.385 -15.272 -15.744 1020 3HZ LYS 151 3HZ LYS 151 -4.911 -14.386 -14.440 Start of MODEL 18 1 H VAL 21 H VAL 21 -0.914 10.491 14.452 2 HA VAL 21 HA VAL 21 -1.957 7.920 15.579 3 HB VAL 21 HB VAL 21 -2.203 9.988 16.916 4 1HG1 VAL 21 1HG1 VAL 21 -3.886 11.664 16.344 5 2HG1 VAL 21 2HG1 VAL 21 -2.573 11.667 15.162 6 3HG1 VAL 21 3HG1 VAL 21 -4.134 10.910 14.762 7 1HG2 VAL 21 1HG2 VAL 21 -4.965 8.999 16.191 8 2HG2 VAL 21 2HG2 VAL 21 -3.780 8.006 17.079 9 3HG2 VAL 21 3HG2 VAL 21 -4.327 9.556 17.733 10 H GLU 22 H GLU 22 -4.638 8.172 14.541 11 HA GLU 22 HA GLU 22 -4.168 7.981 11.641 12 1HB GLU 22 1HB GLU 22 -5.821 6.596 13.251 13 2HB GLU 22 2HB GLU 22 -6.955 7.833 12.700 14 1HG GLU 22 1HG GLU 22 -6.559 7.182 10.380 15 2HG GLU 22 2HG GLU 22 -5.162 6.209 10.812 16 H GLN 23 H GLN 23 -3.185 10.140 12.065 17 HA GLN 23 HA GLN 23 -4.126 12.073 10.581 18 1HB GLN 23 1HB GLN 23 -5.132 12.487 13.388 19 2HB GLN 23 2HB GLN 23 -4.165 13.794 12.808 20 1HG GLN 23 1HG GLN 23 -6.432 12.777 11.085 21 2HG GLN 23 2HG GLN 23 -6.622 14.038 12.313 22 1HE2 GLN 23 1HE2 GLN 23 -4.972 13.252 9.222 23 2HE2 GLN 23 2HE2 GLN 23 -4.474 14.880 8.856 24 H ALA 24 H ALA 24 -2.601 13.871 10.614 25 HA ALA 24 HA ALA 24 -0.607 13.792 12.757 26 1HB ALA 24 1HB ALA 24 0.274 14.421 9.944 27 2HB ALA 24 2HB ALA 24 1.266 14.060 11.359 28 3HB ALA 24 3HB ALA 24 0.363 12.757 10.549 29 H SER 25 H SER 25 -0.650 15.802 13.621 30 HA SER 25 HA SER 25 -1.325 18.206 12.137 31 1HB SER 25 1HB SER 25 -3.619 17.380 12.522 32 2HB SER 25 2HB SER 25 -3.260 17.118 14.244 33 HG SER 25 HG SER 25 -2.841 19.383 14.382 34 H ASP 26 H ASP 26 0.864 17.405 13.166 35 HA ASP 26 HA ASP 26 1.614 18.852 15.607 36 1HB ASP 26 1HB ASP 26 0.625 16.830 16.537 37 2HB ASP 26 2HB ASP 26 1.422 15.796 15.346 38 H LEU 27 H LEU 27 2.425 16.113 13.546 39 HA LEU 27 HA LEU 27 5.146 16.863 13.052 40 1HB LEU 27 1HB LEU 27 3.398 14.929 11.481 41 2HB LEU 27 2HB LEU 27 5.156 14.934 11.556 42 HG LEU 27 HG LEU 27 3.305 14.284 13.891 43 1HD1 LEU 27 1HD1 LEU 27 3.287 12.573 12.115 44 2HD1 LEU 27 2HD1 LEU 27 5.061 12.518 12.140 45 3HD1 LEU 27 3HD1 LEU 27 4.137 11.986 13.552 46 1HD2 LEU 27 1HD2 LEU 27 5.498 15.314 14.597 47 2HD2 LEU 27 2HD2 LEU 27 5.311 13.642 15.087 48 3HD2 LEU 27 3HD2 LEU 27 6.342 14.039 13.692 49 H ILE 28 H ILE 28 2.136 17.526 11.336 50 HA ILE 28 HA ILE 28 3.305 17.791 8.790 51 HB ILE 28 HB ILE 28 0.724 19.060 9.768 52 1HG1 ILE 28 1HG1 ILE 28 1.524 16.322 8.728 53 2HG1 ILE 28 2HG1 ILE 28 0.567 16.792 10.133 54 1HG2 ILE 28 1HG2 ILE 28 1.625 18.350 6.955 55 2HG2 ILE 28 2HG2 ILE 28 0.096 19.123 7.439 56 3HG2 ILE 28 3HG2 ILE 28 1.601 20.013 7.594 57 1HD1 ILE 28 1HD1 ILE 28 -0.933 15.841 8.535 58 2HD1 ILE 28 2HD1 ILE 28 -1.271 17.572 8.654 59 3HD1 ILE 28 3HD1 ILE 28 -0.378 16.916 7.253 60 H LEU 29 H LEU 29 4.824 19.140 8.226 61 HA LEU 29 HA LEU 29 4.489 22.058 8.767 62 1HB LEU 29 1HB LEU 29 6.854 20.756 7.395 63 2HB LEU 29 2HB LEU 29 6.663 22.399 7.986 64 HG LEU 29 HG LEU 29 7.984 21.599 9.611 65 1HD1 LEU 29 1HD1 LEU 29 5.776 22.204 10.720 66 2HD1 LEU 29 2HD1 LEU 29 5.498 20.458 10.932 67 3HD1 LEU 29 3HD1 LEU 29 6.906 21.213 11.659 68 1HD2 LEU 29 1HD2 LEU 29 6.777 18.857 9.249 69 2HD2 LEU 29 2HD2 LEU 29 8.386 19.408 8.771 70 3HD2 LEU 29 3HD2 LEU 29 7.974 19.243 10.491 71 H ASP 30 H ASP 30 4.410 23.379 6.803 72 HA ASP 30 HA ASP 30 2.731 22.348 4.811 73 1HB ASP 30 1HB ASP 30 4.323 24.929 4.864 74 2HB ASP 30 2HB ASP 30 2.839 24.617 3.945 75 H GLU 31 H GLU 31 4.493 20.559 4.364 76 HA GLU 31 HA GLU 31 6.034 21.334 1.928 77 1HB GLU 31 1HB GLU 31 7.057 20.292 4.377 78 2HB GLU 31 2HB GLU 31 7.033 18.931 3.233 79 1HG GLU 31 1HG GLU 31 8.258 21.629 2.570 80 2HG GLU 31 2HG GLU 31 9.142 20.308 3.341 81 H LYS 32 H LYS 32 5.992 19.781 0.301 82 HA LYS 32 HA LYS 32 3.433 18.173 0.282 83 1HB LYS 32 1HB LYS 32 4.685 20.138 -1.643 84 2HB LYS 32 2HB LYS 32 3.745 18.798 -2.299 85 1HG LYS 32 1HG LYS 32 2.537 20.337 -0.005 86 2HG LYS 32 2HG LYS 32 2.603 21.154 -1.563 87 1HD LYS 32 1HD LYS 32 1.550 18.295 -1.411 88 2HD LYS 32 2HD LYS 32 0.492 19.651 -1.011 89 1HE LYS 32 1HE LYS 32 0.573 20.590 -3.154 90 2HE LYS 32 2HE LYS 32 2.084 19.777 -3.591 91 1HZ LYS 32 1HZ LYS 32 -0.405 18.250 -3.165 92 2HZ LYS 32 2HZ LYS 32 0.109 18.782 -4.655 93 3HZ LYS 32 3HZ LYS 32 0.963 17.714 -3.725 94 H ILE 33 H ILE 33 3.555 16.121 -0.335 95 HA ILE 33 HA ILE 33 6.108 15.025 -1.413 96 HB ILE 33 HB ILE 33 6.313 15.313 0.891 97 1HG1 ILE 33 1HG1 ILE 33 7.444 13.609 -0.116 98 2HG1 ILE 33 2HG1 ILE 33 6.969 13.139 1.496 99 1HG2 ILE 33 1HG2 ILE 33 3.817 13.730 1.224 100 2HG2 ILE 33 2HG2 ILE 33 4.987 13.999 2.533 101 3HG2 ILE 33 3HG2 ILE 33 4.158 15.375 1.793 102 1HD1 ILE 33 1HD1 ILE 33 6.021 12.046 -1.162 103 2HD1 ILE 33 2HD1 ILE 33 6.714 11.181 0.192 104 3HD1 ILE 33 3HD1 ILE 33 5.046 11.816 0.310 105 H LYS 34 H LYS 34 5.602 13.917 -3.154 106 HA LYS 34 HA LYS 34 2.935 12.701 -3.564 107 1HB LYS 34 1HB LYS 34 3.738 14.088 -5.312 108 2HB LYS 34 2HB LYS 34 5.295 13.250 -5.379 109 1HG LYS 34 1HG LYS 34 2.636 11.881 -6.011 110 2HG LYS 34 2HG LYS 34 3.578 12.747 -7.207 111 1HD LYS 34 1HD LYS 34 5.509 11.092 -6.051 112 2HD LYS 34 2HD LYS 34 4.067 10.088 -6.008 113 1HE LYS 34 1HE LYS 34 3.786 10.267 -8.414 114 2HE LYS 34 2HE LYS 34 5.027 11.515 -8.528 115 1HZ LYS 34 1HZ LYS 34 5.640 8.760 -7.616 116 2HZ LYS 34 2HZ LYS 34 5.778 9.295 -9.167 117 3HZ LYS 34 3HZ LYS 34 6.680 9.963 -7.972 118 H VAL 35 H VAL 35 2.643 10.488 -3.534 119 HA VAL 35 HA VAL 35 5.032 8.740 -2.964 120 HB VAL 35 HB VAL 35 2.235 8.927 -1.925 121 1HG1 VAL 35 1HG1 VAL 35 2.592 6.589 -0.922 122 2HG1 VAL 35 2HG1 VAL 35 2.143 6.663 -2.626 123 3HG1 VAL 35 3HG1 VAL 35 3.828 6.363 -2.184 124 1HG2 VAL 35 1HG2 VAL 35 4.830 8.221 -0.612 125 2HG2 VAL 35 2HG2 VAL 35 4.159 9.872 -0.691 126 3HG2 VAL 35 3HG2 VAL 35 3.290 8.599 0.193 127 H THR 36 H THR 36 5.457 7.393 -4.652 128 HA THR 36 HA THR 36 3.460 7.020 -6.754 129 HB THR 36 HB THR 36 5.993 5.404 -6.609 130 HG1 THR 36 HG1 THR 36 6.968 7.160 -6.083 131 1HG2 THR 36 1HG2 THR 36 4.539 5.246 -8.574 132 2HG2 THR 36 2HG2 THR 36 4.627 7.001 -8.824 133 3HG2 THR 36 3HG2 THR 36 6.089 6.002 -8.997 134 H PHE 37 H PHE 37 2.035 5.493 -6.834 135 HA PHE 37 HA PHE 37 2.228 3.099 -5.019 136 1HB PHE 37 1HB PHE 37 -0.031 4.613 -6.391 137 2HB PHE 37 2HB PHE 37 -0.200 2.920 -6.010 138 HD1 PHE 37 HD1 PHE 37 -2.264 4.049 -4.923 139 HD2 PHE 37 HD2 PHE 37 1.753 4.444 -3.380 140 HE1 PHE 37 HE1 PHE 37 -3.157 4.425 -2.641 141 HE2 PHE 37 HE2 PHE 37 0.850 4.778 -1.118 142 HZ PHE 37 HZ PHE 37 -1.587 4.796 -0.741 143 H ASP 38 H ASP 38 3.646 1.771 -6.268 144 HA ASP 38 HA ASP 38 2.667 1.138 -9.045 145 1HB ASP 38 1HB ASP 38 4.924 2.399 -8.663 146 2HB ASP 38 2HB ASP 38 5.546 0.881 -8.066 147 H ALA 39 H ALA 39 1.258 -0.379 -8.107 148 HA ALA 39 HA ALA 39 2.403 -2.628 -6.582 149 1HB ALA 39 1HB ALA 39 0.322 -1.549 -5.802 150 2HB ALA 39 2HB ALA 39 -0.477 -2.005 -7.327 151 3HB ALA 39 3HB ALA 39 0.091 -3.265 -6.212 152 H ASN 40 H ASN 40 2.252 -4.801 -7.222 153 HA ASN 40 HA ASN 40 1.765 -5.315 -10.127 154 1HB ASN 40 1HB ASN 40 4.065 -6.479 -8.507 155 2HB ASN 40 2HB ASN 40 3.804 -6.544 -10.248 156 1HD2 ASN 40 1HD2 ASN 40 4.459 -4.356 -7.510 157 2HD2 ASN 40 2HD2 ASN 40 5.197 -3.069 -8.434 158 H VAL 41 H VAL 41 1.234 -7.576 -10.584 159 HA VAL 41 HA VAL 41 0.411 -9.218 -8.271 160 HB VAL 41 HB VAL 41 -1.378 -8.686 -10.684 161 1HG1 VAL 41 1HG1 VAL 41 -1.897 -10.060 -8.013 162 2HG1 VAL 41 2HG1 VAL 41 -3.110 -9.768 -9.273 163 3HG1 VAL 41 3HG1 VAL 41 -1.759 -10.853 -9.597 164 1HG2 VAL 41 1HG2 VAL 41 -1.645 -7.455 -7.910 165 2HG2 VAL 41 2HG2 VAL 41 -1.312 -6.580 -9.421 166 3HG2 VAL 41 3HG2 VAL 41 -2.859 -7.391 -9.206 167 H ALA 42 H ALA 42 0.543 -11.470 -8.730 168 HA ALA 42 HA ALA 42 1.137 -12.272 -11.504 169 1HB ALA 42 1HB ALA 42 3.023 -12.984 -9.228 170 2HB ALA 42 2HB ALA 42 3.202 -13.415 -10.933 171 3HB ALA 42 3HB ALA 42 3.366 -11.722 -10.431 172 H ALA 43 H ALA 43 1.466 -14.739 -11.509 173 HA ALA 43 HA ALA 43 -0.786 -16.094 -10.585 174 1HB ALA 43 1HB ALA 43 0.715 -16.962 -12.355 175 2HB ALA 43 2HB ALA 43 2.010 -17.188 -11.157 176 3HB ALA 43 3HB ALA 43 0.525 -18.156 -11.052 177 H GLY 44 H GLY 44 -1.257 -17.175 -8.708 178 1HA GLY 44 1HA GLY 44 -0.523 -17.836 -6.377 179 2HA GLY 44 2HA GLY 44 0.478 -16.385 -6.352 180 H LEU 45 H LEU 45 -1.188 -14.514 -7.649 181 HA LEU 45 HA LEU 45 -3.664 -14.470 -5.985 182 1HB LEU 45 1HB LEU 45 -1.472 -12.596 -5.907 183 2HB LEU 45 2HB LEU 45 -2.906 -11.775 -6.453 184 HG LEU 45 HG LEU 45 -3.216 -13.621 -4.045 185 1HD1 LEU 45 1HD1 LEU 45 -2.566 -11.915 -2.551 186 2HD1 LEU 45 2HD1 LEU 45 -1.309 -11.707 -3.782 187 3HD1 LEU 45 3HD1 LEU 45 -2.714 -10.658 -3.761 188 1HD2 LEU 45 1HD2 LEU 45 -4.585 -11.097 -4.969 189 2HD2 LEU 45 2HD2 LEU 45 -5.146 -12.771 -5.235 190 3HD2 LEU 45 3HD2 LEU 45 -4.980 -12.133 -3.575 191 HA PRO 46 HA PRO 46 -4.834 -14.084 -10.402 192 1HB PRO 46 1HB PRO 46 -6.784 -15.928 -10.491 193 2HB PRO 46 2HB PRO 46 -5.080 -16.429 -10.246 194 1HG PRO 46 1HG PRO 46 -7.148 -16.013 -8.085 195 2HG PRO 46 2HG PRO 46 -6.153 -17.481 -8.379 196 1HD PRO 46 1HD PRO 46 -5.462 -15.490 -6.627 197 2HD PRO 46 2HD PRO 46 -4.230 -16.434 -7.524 198 H TRP 47 H TRP 47 -5.356 -12.082 -8.500 199 HA TRP 47 HA TRP 47 -8.307 -11.700 -8.518 200 1HB TRP 47 1HB TRP 47 -6.274 -10.771 -6.477 201 2HB TRP 47 2HB TRP 47 -7.957 -10.279 -6.542 202 HD1 TRP 47 HD1 TRP 47 -8.038 -13.850 -7.253 203 HE1 TRP 47 HE1 TRP 47 -8.528 -15.236 -5.207 204 HE3 TRP 47 HE3 TRP 47 -7.140 -10.379 -3.562 205 HZ2 TRP 47 HZ2 TRP 47 -8.516 -15.013 -2.434 206 HZ3 TRP 47 HZ3 TRP 47 -6.953 -11.263 -1.249 207 HH2 TRP 47 HH2 TRP 47 -7.730 -13.477 -0.628 208 H GLU 48 H GLU 48 -8.980 -9.691 -9.248 209 HA GLU 48 HA GLU 48 -6.967 -8.133 -10.801 210 1HB GLU 48 1HB GLU 48 -9.258 -8.604 -11.685 211 2HB GLU 48 2HB GLU 48 -9.923 -7.762 -10.278 212 1HG GLU 48 1HG GLU 48 -8.589 -5.693 -11.119 213 2HG GLU 48 2HG GLU 48 -8.449 -6.548 -12.651 214 H PHE 49 H PHE 49 -5.714 -7.734 -8.825 215 HA PHE 49 HA PHE 49 -6.839 -5.920 -6.792 216 1HB PHE 49 1HB PHE 49 -5.240 -7.568 -6.073 217 2HB PHE 49 2HB PHE 49 -4.044 -6.978 -7.227 218 HD1 PHE 49 HD1 PHE 49 -6.039 -6.003 -4.210 219 HD2 PHE 49 HD2 PHE 49 -2.614 -5.132 -6.684 220 HE1 PHE 49 HE1 PHE 49 -5.202 -4.429 -2.500 221 HE2 PHE 49 HE2 PHE 49 -1.810 -3.518 -4.979 222 HZ PHE 49 HZ PHE 49 -3.068 -3.199 -2.885 223 H VAL 50 H VAL 50 -7.367 -3.952 -7.695 224 HA VAL 50 HA VAL 50 -5.533 -2.805 -9.704 225 HB VAL 50 HB VAL 50 -7.168 -1.131 -10.133 226 1HG1 VAL 50 1HG1 VAL 50 -7.441 -3.448 -11.110 227 2HG1 VAL 50 2HG1 VAL 50 -8.610 -3.790 -9.806 228 3HG1 VAL 50 3HG1 VAL 50 -8.950 -2.522 -10.991 229 1HG2 VAL 50 1HG2 VAL 50 -9.410 -1.200 -9.018 230 2HG2 VAL 50 2HG2 VAL 50 -8.723 -2.305 -7.815 231 3HG2 VAL 50 3HG2 VAL 50 -8.118 -0.635 -7.944 232 HA PRO 51 HA PRO 51 -3.735 -0.126 -6.492 233 1HB PRO 51 1HB PRO 51 -2.371 1.644 -8.073 234 2HB PRO 51 2HB PRO 51 -1.799 -0.031 -7.822 235 1HG PRO 51 1HG PRO 51 -3.417 1.042 -10.145 236 2HG PRO 51 2HG PRO 51 -1.942 0.034 -10.216 237 1HD PRO 51 1HD PRO 51 -4.463 -0.997 -10.426 238 2HD PRO 51 2HD PRO 51 -3.156 -1.915 -9.614 239 H VAL 52 H VAL 52 -4.215 2.082 -5.822 240 HA VAL 52 HA VAL 52 -6.946 2.618 -6.495 241 HB VAL 52 HB VAL 52 -5.178 4.386 -4.755 242 1HG1 VAL 52 1HG1 VAL 52 -7.450 5.225 -5.221 243 2HG1 VAL 52 2HG1 VAL 52 -8.146 3.665 -4.761 244 3HG1 VAL 52 3HG1 VAL 52 -7.348 4.670 -3.542 245 1HG2 VAL 52 1HG2 VAL 52 -6.053 2.787 -2.897 246 2HG2 VAL 52 2HG2 VAL 52 -6.288 1.633 -4.217 247 3HG2 VAL 52 3HG2 VAL 52 -4.674 2.284 -3.871 248 H GLN 53 H GLN 53 -3.890 4.374 -7.019 249 HA GLN 53 HA GLN 53 -4.714 5.159 -9.562 250 1HB GLN 53 1HB GLN 53 -4.532 7.552 -9.474 251 2HB GLN 53 2HB GLN 53 -5.837 7.059 -8.423 252 1HG GLN 53 1HG GLN 53 -3.226 7.345 -7.010 253 2HG GLN 53 2HG GLN 53 -3.772 8.813 -7.840 254 1HE2 GLN 53 1HE2 GLN 53 -5.105 6.222 -5.743 255 2HE2 GLN 53 2HE2 GLN 53 -6.125 7.315 -4.815 256 H ARG 54 H ARG 54 -2.728 6.595 -10.453 257 HA ARG 54 HA ARG 54 -0.432 5.031 -10.393 258 1HB ARG 54 1HB ARG 54 -1.103 7.724 -11.363 259 2HB ARG 54 2HB ARG 54 0.601 7.474 -10.976 260 1HG ARG 54 1HG ARG 54 -0.830 5.351 -12.560 261 2HG ARG 54 2HG ARG 54 -0.339 6.860 -13.334 262 1HD ARG 54 1HD ARG 54 1.330 5.082 -13.451 263 2HD ARG 54 2HD ARG 54 1.858 6.600 -12.699 264 HE ARG 54 HE ARG 54 1.521 5.424 -10.468 265 1HH1 ARG 54 1HH1 ARG 54 3.181 3.903 -13.293 266 2HH1 ARG 54 2HH1 ARG 54 3.907 2.721 -12.182 267 1HH2 ARG 54 1HH2 ARG 54 2.254 3.590 -9.338 268 2HH2 ARG 54 2HH2 ARG 54 3.550 2.691 -10.134 269 H ASP 55 H ASP 55 -1.136 7.935 -8.354 270 HA ASP 55 HA ASP 55 0.865 7.249 -6.422 271 1HB ASP 55 1HB ASP 55 2.122 9.344 -6.816 272 2HB ASP 55 2HB ASP 55 2.223 8.294 -8.238 273 H ILE 56 H ILE 56 0.691 8.771 -4.604 274 HA ILE 56 HA ILE 56 -1.922 10.227 -4.510 275 HB ILE 56 HB ILE 56 -2.152 9.776 -2.184 276 1HG1 ILE 56 1HG1 ILE 56 0.281 8.052 -2.565 277 2HG1 ILE 56 2HG1 ILE 56 0.237 9.598 -1.671 278 1HG2 ILE 56 1HG2 ILE 56 -1.706 7.203 -3.765 279 2HG2 ILE 56 2HG2 ILE 56 -2.763 7.437 -2.363 280 3HG2 ILE 56 3HG2 ILE 56 -3.139 8.248 -3.889 281 1HD1 ILE 56 1HD1 ILE 56 0.297 7.659 -0.160 282 2HD1 ILE 56 2HD1 ILE 56 -1.119 8.688 0.070 283 3HD1 ILE 56 3HD1 ILE 56 -1.277 7.133 -0.767 284 H ASP 57 H ASP 57 -1.876 12.075 -2.932 285 HA ASP 57 HA ASP 57 0.804 13.370 -2.730 286 1HB ASP 57 1HB ASP 57 -0.633 14.398 -4.466 287 2HB ASP 57 2HB ASP 57 -1.930 14.605 -3.274 288 H VAL 58 H VAL 58 1.336 13.506 -0.614 289 HA VAL 58 HA VAL 58 -0.795 14.185 1.405 290 HB VAL 58 HB VAL 58 0.295 13.154 3.122 291 1HG1 VAL 58 1HG1 VAL 58 -1.502 12.045 1.801 292 2HG1 VAL 58 2HG1 VAL 58 -0.259 11.198 0.854 293 3HG1 VAL 58 3HG1 VAL 58 -0.420 10.898 2.591 294 1HG2 VAL 58 1HG2 VAL 58 2.281 12.078 1.101 295 2HG2 VAL 58 2HG2 VAL 58 2.566 12.880 2.688 296 3HG2 VAL 58 3HG2 VAL 58 1.908 11.254 2.621 297 H ARG 59 H ARG 59 -0.090 15.938 2.755 298 HA ARG 59 HA ARG 59 2.474 17.243 2.051 299 1HB ARG 59 1HB ARG 59 0.385 17.940 4.157 300 2HB ARG 59 2HB ARG 59 1.959 18.715 4.017 301 1HG ARG 59 1HG ARG 59 1.082 20.201 2.601 302 2HG ARG 59 2HG ARG 59 1.007 18.904 1.404 303 1HD ARG 59 1HD ARG 59 -1.155 19.925 1.579 304 2HD ARG 59 2HD ARG 59 -1.234 18.281 2.214 305 HE ARG 59 HE ARG 59 -0.752 20.540 4.116 306 1HH1 ARG 59 1HH1 ARG 59 -3.250 18.294 2.886 307 2HH1 ARG 59 2HH1 ARG 59 -3.833 17.994 4.533 308 1HH2 ARG 59 1HH2 ARG 59 -1.780 20.119 6.252 309 2HH2 ARG 59 2HH2 ARG 59 -3.073 18.912 6.246 310 H ILE 60 H ILE 60 3.934 17.402 3.912 311 HA ILE 60 HA ILE 60 5.339 15.561 4.839 312 HB ILE 60 HB ILE 60 3.980 17.504 6.676 313 1HG1 ILE 60 1HG1 ILE 60 5.428 18.458 4.962 314 2HG1 ILE 60 2HG1 ILE 60 6.074 18.671 6.580 315 1HG2 ILE 60 1HG2 ILE 60 4.658 15.814 8.237 316 2HG2 ILE 60 2HG2 ILE 60 6.171 15.523 7.356 317 3HG2 ILE 60 3HG2 ILE 60 5.918 17.035 8.257 318 1HD1 ILE 60 1HD1 ILE 60 7.922 18.190 5.224 319 2HD1 ILE 60 2HD1 ILE 60 7.650 16.724 6.156 320 3HD1 ILE 60 3HD1 ILE 60 7.137 16.803 4.453 321 H GLY 61 H GLY 61 2.323 15.781 6.805 322 1HA GLY 61 1HA GLY 61 2.446 12.819 7.126 323 2HA GLY 61 2HA GLY 61 2.221 13.883 8.502 324 H GLU 62 H GLU 62 0.552 14.703 5.421 325 HA GLU 62 HA GLU 62 -1.907 14.621 6.969 326 1HB GLU 62 1HB GLU 62 -1.513 16.291 5.121 327 2HB GLU 62 2HB GLU 62 -1.724 14.952 3.966 328 1HG GLU 62 1HG GLU 62 -3.882 15.985 4.165 329 2HG GLU 62 2HG GLU 62 -4.006 14.511 5.081 330 H THR 63 H THR 63 -3.166 12.899 7.369 331 HA THR 63 HA THR 63 -2.844 10.297 6.185 332 HB THR 63 HB THR 63 -5.217 10.070 7.226 333 HG1 THR 63 HG1 THR 63 -5.490 12.380 7.160 334 1HG2 THR 63 1HG2 THR 63 -4.347 10.022 9.501 335 2HG2 THR 63 2HG2 THR 63 -3.270 9.226 8.377 336 3HG2 THR 63 3HG2 THR 63 -2.843 10.848 8.982 337 H VAL 64 H VAL 64 -3.353 9.846 4.118 338 HA VAL 64 HA VAL 64 -5.949 10.929 3.077 339 HB VAL 64 HB VAL 64 -4.131 11.681 1.708 340 1HG1 VAL 64 1HG1 VAL 64 -2.843 10.181 0.283 341 2HG1 VAL 64 2HG1 VAL 64 -2.537 9.766 1.978 342 3HG1 VAL 64 3HG1 VAL 64 -3.616 8.754 1.000 343 1HG2 VAL 64 1HG2 VAL 64 -5.042 11.087 -0.444 344 2HG2 VAL 64 2HG2 VAL 64 -5.826 9.648 0.220 345 3HG2 VAL 64 3HG2 VAL 64 -6.361 11.269 0.723 346 H GLN 65 H GLN 65 -7.262 9.494 2.080 347 HA GLN 65 HA GLN 65 -7.157 6.699 3.120 348 1HB GLN 65 1HB GLN 65 -9.027 8.402 3.813 349 2HB GLN 65 2HB GLN 65 -9.547 8.320 2.141 350 1HG GLN 65 1HG GLN 65 -10.885 6.800 3.440 351 2HG GLN 65 2HG GLN 65 -9.870 5.854 2.348 352 1HE2 GLN 65 1HE2 GLN 65 -8.245 7.230 5.183 353 2HE2 GLN 65 2HE2 GLN 65 -8.273 5.746 6.115 354 H ILE 66 H ILE 66 -6.773 5.159 1.651 355 HA ILE 66 HA ILE 66 -7.743 5.551 -1.108 356 HB ILE 66 HB ILE 66 -5.361 4.628 -1.806 357 1HG1 ILE 66 1HG1 ILE 66 -3.585 6.013 -0.734 358 2HG1 ILE 66 2HG1 ILE 66 -4.667 6.431 0.580 359 1HG2 ILE 66 1HG2 ILE 66 -6.606 6.709 -2.578 360 2HG2 ILE 66 2HG2 ILE 66 -5.750 7.574 -1.279 361 3HG2 ILE 66 3HG2 ILE 66 -4.851 6.788 -2.597 362 1HD1 ILE 66 1HD1 ILE 66 -3.832 3.591 -0.155 363 2HD1 ILE 66 2HD1 ILE 66 -3.079 4.590 1.110 364 3HD1 ILE 66 3HD1 ILE 66 -4.774 4.109 1.264 365 H MET 67 H MET 67 -9.173 4.079 -1.085 366 HA MET 67 HA MET 67 -8.861 1.428 0.030 367 1HB MET 67 1HB MET 67 -10.935 2.599 -1.869 368 2HB MET 67 2HB MET 67 -11.064 1.038 -1.048 369 1HG MET 67 1HG MET 67 -11.101 2.144 1.131 370 2HG MET 67 2HG MET 67 -10.882 3.728 0.371 371 1HE MET 67 1HE MET 67 -13.112 3.147 2.502 372 2HE MET 67 2HE MET 67 -12.888 4.719 1.689 373 3HE MET 67 3HE MET 67 -14.500 3.966 1.745 374 H TYR 68 H TYR 68 -8.007 -0.350 -0.943 375 HA TYR 68 HA TYR 68 -7.423 -0.313 -3.898 376 1HB TYR 68 1HB TYR 68 -6.425 -2.132 -1.679 377 2HB TYR 68 2HB TYR 68 -6.076 -2.278 -3.401 378 HD1 TYR 68 HD1 TYR 68 -5.534 -0.109 -0.404 379 HD2 TYR 68 HD2 TYR 68 -4.321 -1.051 -4.430 380 HE1 TYR 68 HE1 TYR 68 -3.433 1.174 -0.083 381 HE2 TYR 68 HE2 TYR 68 -2.245 0.274 -4.117 382 HH TYR 68 HH TYR 68 -1.174 1.901 -2.661 383 H ARG 69 H ARG 69 -8.487 -1.811 -5.208 384 HA ARG 69 HA ARG 69 -10.674 -3.382 -3.925 385 1HB ARG 69 1HB ARG 69 -11.248 -1.395 -5.423 386 2HB ARG 69 2HB ARG 69 -10.670 -2.357 -6.782 387 1HG ARG 69 1HG ARG 69 -12.364 -4.081 -6.349 388 2HG ARG 69 2HG ARG 69 -12.849 -3.266 -4.866 389 1HD ARG 69 1HD ARG 69 -13.375 -1.200 -6.374 390 2HD ARG 69 2HD ARG 69 -13.303 -2.357 -7.700 391 HE ARG 69 HE ARG 69 -15.199 -3.523 -6.864 392 1HH1 ARG 69 1HH1 ARG 69 -14.411 -0.842 -4.598 393 2HH1 ARG 69 2HH1 ARG 69 -15.873 -0.944 -3.829 394 1HH2 ARG 69 1HH2 ARG 69 -17.122 -3.684 -5.599 395 2HH2 ARG 69 2HH2 ARG 69 -17.508 -2.414 -4.480 396 H ALA 70 H ALA 70 -10.818 -5.548 -4.357 397 HA ALA 70 HA ALA 70 -9.001 -6.769 -6.367 398 1HB ALA 70 1HB ALA 70 -8.777 -8.693 -4.830 399 2HB ALA 70 2HB ALA 70 -8.039 -7.211 -4.200 400 3HB ALA 70 3HB ALA 70 -9.597 -7.753 -3.569 401 H LYS 71 H LYS 71 -9.936 -8.487 -7.512 402 HA LYS 71 HA LYS 71 -12.673 -9.407 -6.777 403 1HB LYS 71 1HB LYS 71 -11.902 -8.738 -9.645 404 2HB LYS 71 2HB LYS 71 -13.431 -9.386 -9.046 405 1HG LYS 71 1HG LYS 71 -13.451 -7.183 -7.600 406 2HG LYS 71 2HG LYS 71 -12.363 -6.539 -8.807 407 1HD LYS 71 1HD LYS 71 -15.044 -7.876 -9.499 408 2HD LYS 71 2HD LYS 71 -14.953 -6.192 -9.023 409 1HE LYS 71 1HE LYS 71 -15.025 -6.682 -11.551 410 2HE LYS 71 2HE LYS 71 -13.884 -5.475 -10.930 411 1HZ LYS 71 1HZ LYS 71 -13.069 -8.244 -11.539 412 2HZ LYS 71 2HZ LYS 71 -12.688 -6.891 -12.450 413 3HZ LYS 71 3HZ LYS 71 -12.186 -6.943 -10.980 414 H ASN 72 H ASN 72 -12.593 -11.657 -6.635 415 HA ASN 72 HA ASN 72 -10.078 -12.871 -7.477 416 1HB ASN 72 1HB ASN 72 -10.939 -13.473 -5.304 417 2HB ASN 72 2HB ASN 72 -12.460 -14.047 -6.020 418 1HD2 ASN 72 1HD2 ASN 72 -11.477 -16.044 -4.553 419 2HD2 ASN 72 2HD2 ASN 72 -10.562 -17.180 -5.526 420 H LEU 73 H LEU 73 -9.689 -13.644 -9.473 421 HA LEU 73 HA LEU 73 -11.965 -14.543 -11.176 422 1HB LEU 73 1HB LEU 73 -9.087 -13.800 -11.825 423 2HB LEU 73 2HB LEU 73 -10.293 -14.280 -13.002 424 HG LEU 73 HG LEU 73 -10.428 -11.793 -11.212 425 1HD1 LEU 73 1HD1 LEU 73 -8.674 -11.657 -12.927 426 2HD1 LEU 73 2HD1 LEU 73 -9.853 -12.082 -14.187 427 3HD1 LEU 73 3HD1 LEU 73 -10.009 -10.553 -13.297 428 1HD2 LEU 73 1HD2 LEU 73 -12.274 -12.742 -13.450 429 2HD2 LEU 73 2HD2 LEU 73 -12.707 -12.512 -11.739 430 3HD2 LEU 73 3HD2 LEU 73 -12.302 -11.115 -12.740 431 H ALA 74 H ALA 74 -10.383 -16.132 -8.962 432 HA ALA 74 HA ALA 74 -9.324 -18.373 -10.518 433 1HB ALA 74 1HB ALA 74 -10.040 -18.116 -7.577 434 2HB ALA 74 2HB ALA 74 -9.074 -19.424 -8.286 435 3HB ALA 74 3HB ALA 74 -8.446 -17.780 -8.257 436 H SER 75 H SER 75 -10.224 -20.601 -9.807 437 HA SER 75 HA SER 75 -13.232 -20.573 -9.671 438 1HB SER 75 1HB SER 75 -11.447 -22.729 -10.825 439 2HB SER 75 2HB SER 75 -13.220 -22.742 -10.723 440 HG SER 75 HG SER 75 -12.980 -20.621 -11.933 441 H THR 76 H THR 76 -10.972 -20.345 -7.593 442 HA THR 76 HA THR 76 -12.075 -22.264 -5.718 443 HB THR 76 HB THR 76 -9.607 -22.727 -5.014 444 HG1 THR 76 HG1 THR 76 -9.190 -21.953 -7.729 445 1HG2 THR 76 1HG2 THR 76 -10.540 -24.022 -7.610 446 2HG2 THR 76 2HG2 THR 76 -9.389 -24.687 -6.441 447 3HG2 THR 76 3HG2 THR 76 -11.086 -24.471 -5.985 448 HA PRO 77 HA PRO 77 -11.470 -18.680 -3.243 449 1HB PRO 77 1HB PRO 77 -11.112 -19.671 -0.691 450 2HB PRO 77 2HB PRO 77 -12.685 -19.713 -1.531 451 1HG PRO 77 1HG PRO 77 -10.655 -21.941 -1.344 452 2HG PRO 77 2HG PRO 77 -12.417 -22.026 -1.060 453 1HD PRO 77 1HD PRO 77 -11.321 -22.755 -3.436 454 2HD PRO 77 2HD PRO 77 -12.883 -21.890 -3.381 455 H THR 78 H THR 78 -9.534 -17.459 -3.314 456 HA THR 78 HA THR 78 -6.987 -18.937 -2.830 457 HB THR 78 HB THR 78 -6.627 -16.094 -3.376 458 HG1 THR 78 HG1 THR 78 -7.033 -16.372 -5.582 459 1HG2 THR 78 1HG2 THR 78 -5.797 -18.504 -4.957 460 2HG2 THR 78 2HG2 THR 78 -4.986 -16.926 -4.905 461 3HG2 THR 78 3HG2 THR 78 -4.927 -17.971 -3.489 462 H THR 79 H THR 79 -5.393 -17.732 -1.551 463 HA THR 79 HA THR 79 -6.461 -16.217 0.736 464 HB THR 79 HB THR 79 -5.524 -18.297 1.565 465 HG1 THR 79 HG1 THR 79 -3.758 -16.113 1.966 466 1HG2 THR 79 1HG2 THR 79 -2.911 -17.579 0.156 467 2HG2 THR 79 2HG2 THR 79 -3.175 -18.906 1.299 468 3HG2 THR 79 3HG2 THR 79 -3.988 -18.927 -0.272 469 H GLY 80 H GLY 80 -5.495 -14.223 0.848 470 1HA GLY 80 1HA GLY 80 -3.622 -13.374 -1.286 471 2HA GLY 80 2HA GLY 80 -5.003 -12.419 -0.740 472 H GLN 81 H GLN 81 -1.937 -13.782 0.136 473 HA GLN 81 HA GLN 81 -1.910 -12.334 2.751 474 1HB GLN 81 1HB GLN 81 -0.113 -14.026 3.413 475 2HB GLN 81 2HB GLN 81 -1.809 -14.427 3.479 476 1HG GLN 81 1HG GLN 81 -1.239 -16.358 2.626 477 2HG GLN 81 2HG GLN 81 -1.314 -15.565 1.067 478 1HE2 GLN 81 1HE2 GLN 81 1.160 -14.051 1.397 479 2HE2 GLN 81 2HE2 GLN 81 2.475 -15.208 1.277 480 H ALA 82 H ALA 82 -1.718 -10.922 0.560 481 HA ALA 82 HA ALA 82 0.948 -10.714 -0.512 482 1HB ALA 82 1HB ALA 82 -1.351 -8.716 -0.547 483 2HB ALA 82 2HB ALA 82 0.094 -8.718 -1.583 484 3HB ALA 82 3HB ALA 82 -1.100 -10.013 -1.735 485 H THR 83 H THR 83 1.907 -8.297 -0.410 486 HA THR 83 HA THR 83 1.810 -7.184 2.300 487 HB THR 83 HB THR 83 4.471 -8.061 1.311 488 HG1 THR 83 HG1 THR 83 2.524 -9.602 2.633 489 1HG2 THR 83 1HG2 THR 83 4.952 -8.184 3.759 490 2HG2 THR 83 2HG2 THR 83 4.570 -6.545 3.227 491 3HG2 THR 83 3HG2 THR 83 3.340 -7.526 4.079 492 H PHE 84 H PHE 84 3.600 -5.234 2.210 493 HA PHE 84 HA PHE 84 3.873 -4.296 -0.563 494 1HB PHE 84 1HB PHE 84 3.537 -1.950 0.242 495 2HB PHE 84 2HB PHE 84 2.123 -2.975 0.033 496 HD1 PHE 84 HD1 PHE 84 0.475 -2.101 1.433 497 HD2 PHE 84 HD2 PHE 84 4.502 -2.425 2.969 498 HE1 PHE 84 HE1 PHE 84 -0.299 -1.383 3.651 499 HE2 PHE 84 HE2 PHE 84 3.728 -1.731 5.163 500 HZ PHE 84 HZ PHE 84 1.296 -1.232 5.544 501 H ASN 85 H ASN 85 5.644 -2.819 -0.796 502 HA ASN 85 HA ASN 85 7.526 -2.525 1.481 503 1HB ASN 85 1HB ASN 85 8.999 -3.577 -0.003 504 2HB ASN 85 2HB ASN 85 8.071 -3.093 -1.418 505 1HD2 ASN 85 1HD2 ASN 85 8.758 -1.340 -2.582 506 2HD2 ASN 85 2HD2 ASN 85 9.925 -0.125 -2.055 507 H VAL 86 H VAL 86 7.425 -0.413 2.040 508 HA VAL 86 HA VAL 86 6.379 1.594 0.081 509 HB VAL 86 HB VAL 86 6.157 1.659 3.092 510 1HG1 VAL 86 1HG1 VAL 86 4.691 3.605 2.613 511 2HG1 VAL 86 2HG1 VAL 86 6.331 3.922 2.062 512 3HG1 VAL 86 3HG1 VAL 86 5.079 3.479 0.884 513 1HG2 VAL 86 1HG2 VAL 86 4.646 -0.009 2.218 514 2HG2 VAL 86 2HG2 VAL 86 3.664 1.444 2.448 515 3HG2 VAL 86 3HG2 VAL 86 4.218 1.011 0.829 516 H THR 87 H THR 87 8.432 1.745 -0.871 517 HA THR 87 HA THR 87 9.995 3.746 0.340 518 HB THR 87 HB THR 87 10.710 1.457 1.392 519 HG1 THR 87 HG1 THR 87 12.800 2.373 1.636 520 1HG2 THR 87 1HG2 THR 87 12.673 1.515 -0.900 521 2HG2 THR 87 2HG2 THR 87 12.496 0.291 0.360 522 3HG2 THR 87 3HG2 THR 87 11.283 0.481 -0.919 523 HA PRO 88 HA PRO 88 10.894 3.992 -4.091 524 1HB PRO 88 1HB PRO 88 12.798 5.991 -4.005 525 2HB PRO 88 2HB PRO 88 11.055 6.308 -3.910 526 1HG PRO 88 1HG PRO 88 13.023 6.372 -1.658 527 2HG PRO 88 2HG PRO 88 11.558 7.324 -1.919 528 1HD PRO 88 1HD PRO 88 11.785 5.052 -0.282 529 2HD PRO 88 2HD PRO 88 10.254 5.763 -0.844 530 H MET 89 H MET 89 13.179 3.890 -1.387 531 HA MET 89 HA MET 89 14.628 1.623 -2.191 532 1HB MET 89 1HB MET 89 16.831 2.803 -2.738 533 2HB MET 89 2HB MET 89 15.587 2.721 -3.979 534 1HG MET 89 1HG MET 89 14.875 5.094 -3.260 535 2HG MET 89 2HG MET 89 16.320 5.116 -2.264 536 1HE MET 89 1HE MET 89 15.837 3.701 -5.996 537 2HE MET 89 2HE MET 89 14.829 5.163 -5.850 538 3HE MET 89 3HE MET 89 16.283 5.177 -6.874 539 H ALA 90 H ALA 90 15.200 4.842 -0.704 540 HA ALA 90 HA ALA 90 16.909 3.578 1.338 541 1HB ALA 90 1HB ALA 90 16.440 6.490 0.639 542 2HB ALA 90 2HB ALA 90 17.776 5.841 1.606 543 3HB ALA 90 3HB ALA 90 17.683 5.470 -0.129 544 H ALA 91 H ALA 91 13.640 4.376 1.312 545 HA ALA 91 HA ALA 91 13.683 5.801 3.940 546 1HB ALA 91 1HB ALA 91 11.422 5.518 1.923 547 2HB ALA 91 2HB ALA 91 11.478 6.519 3.393 548 3HB ALA 91 3HB ALA 91 12.545 6.874 2.015 549 H GLY 92 H GLY 92 10.846 4.041 3.081 550 1HA GLY 92 1HA GLY 92 9.732 2.392 4.211 551 2HA GLY 92 2HA GLY 92 11.285 1.613 4.453 552 H ALA 93 H ALA 93 12.614 2.982 6.278 553 HA ALA 93 HA ALA 93 11.429 2.519 8.742 554 1HB ALA 93 1HB ALA 93 13.840 2.786 8.436 555 2HB ALA 93 2HB ALA 93 13.637 4.505 8.040 556 3HB ALA 93 3HB ALA 93 13.258 3.917 9.673 557 H TYR 94 H TYR 94 11.931 5.746 7.258 558 HA TYR 94 HA TYR 94 10.082 7.089 9.018 559 1HB TYR 94 1HB TYR 94 11.315 7.998 6.398 560 2HB TYR 94 2HB TYR 94 10.623 9.020 7.663 561 HD1 TYR 94 HD1 TYR 94 11.699 8.411 10.132 562 HD2 TYR 94 HD2 TYR 94 13.685 7.884 6.347 563 HE1 TYR 94 HE1 TYR 94 13.872 8.887 11.209 564 HE2 TYR 94 HE2 TYR 94 15.862 8.366 7.427 565 HH TYR 94 HH TYR 94 16.104 9.277 10.877 566 H PHE 95 H PHE 95 8.568 5.054 8.150 567 HA PHE 95 HA PHE 95 6.665 6.357 6.268 568 1HB PHE 95 1HB PHE 95 7.490 4.120 5.397 569 2HB PHE 95 2HB PHE 95 7.010 3.405 6.921 570 HD1 PHE 95 HD1 PHE 95 4.678 5.954 5.462 571 HD2 PHE 95 HD2 PHE 95 5.695 1.749 5.660 572 HE1 PHE 95 HE1 PHE 95 2.444 5.388 4.715 573 HE2 PHE 95 HE2 PHE 95 3.435 1.202 4.798 574 HZ PHE 95 HZ PHE 95 1.843 3.047 4.235 575 H ASN 96 H ASN 96 4.890 7.133 7.337 576 HA ASN 96 HA ASN 96 4.368 6.057 9.979 577 1HB ASN 96 1HB ASN 96 3.165 8.354 8.440 578 2HB ASN 96 2HB ASN 96 2.365 7.661 9.861 579 1HD2 ASN 96 1HD2 ASN 96 4.192 10.286 9.207 580 2HD2 ASN 96 2HD2 ASN 96 5.197 10.276 10.671 581 H LYS 97 H LYS 97 4.246 3.891 8.946 582 HA LYS 97 HA LYS 97 1.525 3.210 8.084 583 1HB LYS 97 1HB LYS 97 3.671 1.797 7.649 584 2HB LYS 97 2HB LYS 97 3.457 1.186 9.272 585 1HG LYS 97 1HG LYS 97 0.854 1.106 8.024 586 2HG LYS 97 2HG LYS 97 2.000 0.615 6.795 587 1HD LYS 97 1HD LYS 97 1.138 -1.332 7.898 588 2HD LYS 97 2HD LYS 97 2.840 -1.186 8.383 589 1HE LYS 97 1HE LYS 97 2.236 -0.463 10.591 590 2HE LYS 97 2HE LYS 97 0.649 0.086 10.052 591 1HZ LYS 97 1HZ LYS 97 1.397 -2.702 10.517 592 2HZ LYS 97 2HZ LYS 97 0.296 -1.719 11.283 593 3HZ LYS 97 3HZ LYS 97 -0.005 -2.249 9.772 594 H VAL 98 H VAL 98 0.583 4.587 9.801 595 HA VAL 98 HA VAL 98 0.554 3.649 12.536 596 HB VAL 98 HB VAL 98 -0.265 5.874 11.729 597 1HG1 VAL 98 1HG1 VAL 98 -1.577 5.146 9.757 598 2HG1 VAL 98 2HG1 VAL 98 -2.740 4.325 10.822 599 3HG1 VAL 98 3HG1 VAL 98 -2.567 6.082 10.896 600 1HG2 VAL 98 1HG2 VAL 98 -2.401 4.418 13.327 601 2HG2 VAL 98 2HG2 VAL 98 -0.827 4.936 13.990 602 3HG2 VAL 98 3HG2 VAL 98 -1.969 6.122 13.355 603 H GLN 99 H GLN 99 -1.455 2.594 13.463 604 HA GLN 99 HA GLN 99 -2.969 1.021 13.688 605 1HB GLN 99 1HB GLN 99 -3.214 1.262 10.667 606 2HB GLN 99 2HB GLN 99 -3.942 -0.106 11.464 607 1HG GLN 99 1HG GLN 99 -4.420 2.765 12.354 608 2HG GLN 99 2HG GLN 99 -5.402 1.931 11.140 609 1HE2 GLN 99 1HE2 GLN 99 -6.858 2.777 13.031 610 2HE2 GLN 99 2HE2 GLN 99 -7.323 1.480 14.166 611 H CYS 100 H CYS 100 -3.245 -1.195 13.920 612 HA CYS 100 HA CYS 100 -0.755 -2.701 13.758 613 1HB CYS 100 1HB CYS 100 -1.888 -4.443 14.884 614 2HB CYS 100 2HB CYS 100 -2.461 -2.932 15.619 615 HG CYS 100 HG CYS 100 -4.411 -4.672 15.428 616 H PHE 101 H PHE 101 -3.594 -2.295 11.792 617 HA PHE 101 HA PHE 101 -3.913 -4.622 10.496 618 1HB PHE 101 1HB PHE 101 -5.059 -2.250 10.213 619 2HB PHE 101 2HB PHE 101 -4.000 -2.109 8.820 620 HD1 PHE 101 HD1 PHE 101 -6.927 -3.756 10.312 621 HD2 PHE 101 HD2 PHE 101 -4.290 -3.754 6.887 622 HE1 PHE 101 HE1 PHE 101 -8.519 -5.191 9.073 623 HE2 PHE 101 HE2 PHE 101 -5.859 -5.244 5.689 624 HZ PHE 101 HZ PHE 101 -7.977 -5.955 6.768 625 H CYS 102 H CYS 102 -3.209 -5.658 8.614 626 HA CYS 102 HA CYS 102 -0.493 -4.977 7.581 627 1HB CYS 102 1HB CYS 102 -1.537 -7.651 8.631 628 2HB CYS 102 2HB CYS 102 -0.088 -7.478 7.624 629 HG CYS 102 HG CYS 102 -0.705 -5.980 10.506 630 H PHE 103 H PHE 103 -0.230 -5.622 5.385 631 HA PHE 103 HA PHE 103 -2.748 -5.387 3.985 632 1HB PHE 103 1HB PHE 103 -0.428 -4.224 3.589 633 2HB PHE 103 2HB PHE 103 -0.029 -5.687 2.698 634 HD1 PHE 103 HD1 PHE 103 0.096 -5.004 0.441 635 HD2 PHE 103 HD2 PHE 103 -3.174 -3.541 2.860 636 HE1 PHE 103 HE1 PHE 103 -0.555 -3.429 -1.356 637 HE2 PHE 103 HE2 PHE 103 -3.958 -2.189 0.956 638 HZ PHE 103 HZ PHE 103 -2.536 -1.957 -1.059 639 H THR 104 H THR 104 -2.124 -8.064 5.283 640 HA THR 104 HA THR 104 -1.941 -9.948 3.042 641 HB THR 104 HB THR 104 -2.354 -11.532 5.019 642 HG1 THR 104 HG1 THR 104 -3.390 -9.965 6.290 643 1HG2 THR 104 1HG2 THR 104 -0.123 -11.206 6.022 644 2HG2 THR 104 2HG2 THR 104 -0.047 -11.043 4.258 645 3HG2 THR 104 3HG2 THR 104 -0.003 -9.596 5.284 646 H GLU 105 H GLU 105 -3.756 -8.693 2.086 647 HA GLU 105 HA GLU 105 -6.106 -7.998 2.342 648 1HB GLU 105 1HB GLU 105 -5.738 -10.449 0.586 649 2HB GLU 105 2HB GLU 105 -6.971 -9.206 0.385 650 1HG GLU 105 1HG GLU 105 -5.287 -7.545 -0.167 651 2HG GLU 105 2HG GLU 105 -3.969 -8.688 0.162 652 H THR 106 H THR 106 -6.188 -11.566 2.233 653 HA THR 106 HA THR 106 -7.013 -12.584 4.419 654 HB THR 106 HB THR 106 -8.738 -10.941 4.992 655 HG1 THR 106 HG1 THR 106 -9.143 -12.872 5.789 656 1HG2 THR 106 1HG2 THR 106 -10.867 -10.820 3.776 657 2HG2 THR 106 2HG2 THR 106 -9.551 -10.243 2.755 658 3HG2 THR 106 3HG2 THR 106 -10.243 -11.845 2.478 659 H THR 107 H THR 107 -9.635 -13.776 3.380 660 HA THR 107 HA THR 107 -8.543 -15.363 1.118 661 HB THR 107 HB THR 107 -8.543 -16.564 3.259 662 HG1 THR 107 HG1 THR 107 -9.575 -18.400 2.343 663 1HG2 THR 107 1HG2 THR 107 -11.553 -16.456 2.923 664 2HG2 THR 107 2HG2 THR 107 -10.661 -17.309 4.206 665 3HG2 THR 107 3HG2 THR 107 -10.640 -15.528 4.134 666 H LEU 108 H LEU 108 -9.895 -15.550 -0.676 667 HA LEU 108 HA LEU 108 -12.555 -14.242 -0.522 668 1HB LEU 108 1HB LEU 108 -10.309 -13.045 -1.486 669 2HB LEU 108 2HB LEU 108 -10.852 -13.861 -2.970 670 HG LEU 108 HG LEU 108 -12.255 -11.977 -1.138 671 1HD1 LEU 108 1HD1 LEU 108 -12.255 -10.497 -3.262 672 2HD1 LEU 108 2HD1 LEU 108 -10.623 -10.855 -2.629 673 3HD1 LEU 108 3HD1 LEU 108 -11.257 -11.713 -4.038 674 1HD2 LEU 108 1HD2 LEU 108 -14.013 -13.416 -2.057 675 2HD2 LEU 108 2HD2 LEU 108 -14.109 -11.850 -2.846 676 3HD2 LEU 108 3HD2 LEU 108 -13.347 -13.209 -3.701 677 H GLU 109 H GLU 109 -14.120 -15.507 -1.393 678 HA GLU 109 HA GLU 109 -13.536 -17.976 -2.665 679 1HB GLU 109 1HB GLU 109 -16.213 -16.559 -2.396 680 2HB GLU 109 2HB GLU 109 -15.924 -18.281 -2.659 681 1HG GLU 109 1HG GLU 109 -14.523 -18.213 -0.469 682 2HG GLU 109 2HG GLU 109 -15.380 -16.694 -0.145 683 HA PRO 110 HA PRO 110 -13.093 -16.925 -6.772 684 1HB PRO 110 1HB PRO 110 -14.061 -19.009 -8.216 685 2HB PRO 110 2HB PRO 110 -12.696 -19.111 -7.078 686 1HG PRO 110 1HG PRO 110 -15.596 -19.855 -6.617 687 2HG PRO 110 2HG PRO 110 -14.159 -20.838 -6.223 688 1HD PRO 110 1HD PRO 110 -15.473 -19.247 -4.435 689 2HD PRO 110 2HD PRO 110 -13.713 -19.537 -4.307 690 H GLY 111 H GLY 111 -14.046 -15.122 -7.594 691 1HA GLY 111 1HA GLY 111 -15.538 -14.428 -9.418 692 2HA GLY 111 2HA GLY 111 -16.866 -15.268 -8.593 693 H GLU 112 H GLU 112 -15.535 -14.466 -5.945 694 HA GLU 112 HA GLU 112 -17.308 -12.269 -5.706 695 1HB GLU 112 1HB GLU 112 -15.581 -13.835 -3.760 696 2HB GLU 112 2HB GLU 112 -16.664 -12.546 -3.272 697 1HG GLU 112 1HG GLU 112 -17.458 -15.076 -4.645 698 2HG GLU 112 2HG GLU 112 -17.754 -14.634 -2.966 699 H GLU 113 H GLU 113 -16.833 -10.375 -4.362 700 HA GLU 113 HA GLU 113 -14.474 -8.988 -5.492 701 1HB GLU 113 1HB GLU 113 -17.140 -8.328 -5.711 702 2HB GLU 113 2HB GLU 113 -16.657 -7.356 -4.305 703 1HG GLU 113 1HG GLU 113 -14.705 -6.663 -5.783 704 2HG GLU 113 2HG GLU 113 -15.635 -7.488 -7.072 705 H MET 114 H MET 114 -13.387 -7.344 -4.199 706 HA MET 114 HA MET 114 -13.840 -7.273 -1.314 707 1HB MET 114 1HB MET 114 -11.502 -8.567 -2.726 708 2HB MET 114 2HB MET 114 -11.054 -7.337 -1.565 709 1HG MET 114 1HG MET 114 -12.582 -8.418 0.127 710 2HG MET 114 2HG MET 114 -12.767 -9.763 -0.983 711 1HE MET 114 1HE MET 114 -9.366 -7.670 -0.175 712 2HE MET 114 2HE MET 114 -10.464 -7.640 1.230 713 3HE MET 114 3HE MET 114 -8.934 -8.534 1.307 714 H GLU 115 H GLU 115 -12.988 -5.363 -0.387 715 HA GLU 115 HA GLU 115 -10.907 -4.120 -1.790 716 1HB GLU 115 1HB GLU 115 -11.699 -1.767 -1.707 717 2HB GLU 115 2HB GLU 115 -12.601 -2.772 -2.825 718 1HG GLU 115 1HG GLU 115 -14.415 -2.980 -1.052 719 2HG GLU 115 2HG GLU 115 -13.568 -1.687 -0.176 720 H MET 116 H MET 116 -9.627 -2.802 -0.432 721 HA MET 116 HA MET 116 -10.242 -3.058 2.462 722 1HB MET 116 1HB MET 116 -7.741 -3.798 0.933 723 2HB MET 116 2HB MET 116 -7.638 -3.303 2.633 724 1HG MET 116 1HG MET 116 -9.581 -5.436 1.715 725 2HG MET 116 2HG MET 116 -7.924 -5.806 2.181 726 1HE MET 116 1HE MET 116 -9.316 -7.549 3.816 727 2HE MET 116 2HE MET 116 -10.337 -7.000 5.164 728 3HE MET 116 3HE MET 116 -10.902 -6.805 3.490 729 HA PRO 117 HA PRO 117 -9.184 1.352 2.095 730 1HB PRO 117 1HB PRO 117 -9.538 2.047 4.690 731 2HB PRO 117 2HB PRO 117 -10.903 1.821 3.555 732 1HG PRO 117 1HG PRO 117 -9.836 -0.094 5.625 733 2HG PRO 117 2HG PRO 117 -11.531 0.307 5.205 734 1HD PRO 117 1HD PRO 117 -10.182 -1.924 4.302 735 2HD PRO 117 2HD PRO 117 -11.516 -1.159 3.381 736 H VAL 118 H VAL 118 -7.316 2.398 2.497 737 HA VAL 118 HA VAL 118 -5.507 1.471 4.623 738 HB VAL 118 HB VAL 118 -4.754 1.954 1.715 739 1HG1 VAL 118 1HG1 VAL 118 -2.873 1.935 4.116 740 2HG1 VAL 118 2HG1 VAL 118 -2.386 1.930 2.405 741 3HG1 VAL 118 3HG1 VAL 118 -3.216 3.333 3.072 742 1HG2 VAL 118 1HG2 VAL 118 -3.496 -0.151 2.020 743 2HG2 VAL 118 2HG2 VAL 118 -4.153 -0.299 3.662 744 3HG2 VAL 118 3HG2 VAL 118 -5.242 -0.360 2.257 745 H VAL 119 H VAL 119 -4.565 3.213 5.612 746 HA VAL 119 HA VAL 119 -5.279 5.928 4.689 747 HB VAL 119 HB VAL 119 -6.411 5.356 6.827 748 1HG1 VAL 119 1HG1 VAL 119 -5.218 4.949 8.869 749 2HG1 VAL 119 2HG1 VAL 119 -4.743 3.709 7.711 750 3HG1 VAL 119 3HG1 VAL 119 -3.645 5.063 8.063 751 1HG2 VAL 119 1HG2 VAL 119 -5.668 7.323 8.079 752 2HG2 VAL 119 2HG2 VAL 119 -4.155 7.374 7.155 753 3HG2 VAL 119 3HG2 VAL 119 -5.706 7.674 6.342 754 H PHE 120 H PHE 120 -3.407 7.243 4.448 755 HA PHE 120 HA PHE 120 -0.776 6.058 5.233 756 1HB PHE 120 1HB PHE 120 -1.619 5.240 2.945 757 2HB PHE 120 2HB PHE 120 -1.582 6.908 2.394 758 HD1 PHE 120 HD1 PHE 120 0.107 3.907 2.167 759 HD2 PHE 120 HD2 PHE 120 0.879 8.112 2.793 760 HE1 PHE 120 HE1 PHE 120 2.402 3.652 1.276 761 HE2 PHE 120 HE2 PHE 120 3.251 7.746 2.279 762 HZ PHE 120 HZ PHE 120 3.982 5.576 1.339 763 H PHE 121 H PHE 121 0.733 7.584 5.802 764 HA PHE 121 HA PHE 121 0.831 10.051 4.328 765 1HB PHE 121 1HB PHE 121 1.038 11.374 6.359 766 2HB PHE 121 2HB PHE 121 -0.582 10.757 6.104 767 HD1 PHE 121 HD1 PHE 121 -1.331 8.662 7.309 768 HD2 PHE 121 HD2 PHE 121 1.888 11.188 8.587 769 HE1 PHE 121 HE1 PHE 121 -1.512 7.713 9.596 770 HE2 PHE 121 HE2 PHE 121 1.642 10.336 10.903 771 HZ PHE 121 HZ PHE 121 -0.008 8.497 11.371 772 H VAL 122 H VAL 122 2.914 11.119 4.768 773 HA VAL 122 HA VAL 122 5.054 9.118 5.272 774 HB VAL 122 HB VAL 122 5.052 11.911 4.054 775 1HG1 VAL 122 1HG1 VAL 122 7.267 11.690 4.962 776 2HG1 VAL 122 2HG1 VAL 122 7.374 9.985 4.446 777 3HG1 VAL 122 3HG1 VAL 122 7.369 11.298 3.257 778 1HG2 VAL 122 1HG2 VAL 122 5.235 9.078 2.969 779 2HG2 VAL 122 2HG2 VAL 122 3.996 10.288 2.612 780 3HG2 VAL 122 3HG2 VAL 122 5.640 10.504 2.024 781 H ASP 123 H ASP 123 7.102 10.193 6.467 782 HA ASP 123 HA ASP 123 6.110 11.655 8.851 783 1HB ASP 123 1HB ASP 123 6.757 9.224 9.320 784 2HB ASP 123 2HB ASP 123 8.406 9.665 8.852 785 HA PRO 124 HA PRO 124 9.055 14.605 7.311 786 1HB PRO 124 1HB PRO 124 9.438 16.179 9.593 787 2HB PRO 124 2HB PRO 124 8.112 16.325 8.432 788 1HG PRO 124 1HG PRO 124 8.123 14.956 11.103 789 2HG PRO 124 2HG PRO 124 6.803 15.885 10.326 790 1HD PRO 124 1HD PRO 124 6.905 13.155 10.432 791 2HD PRO 124 2HD PRO 124 6.101 14.014 9.105 792 H GLU 125 H GLU 125 9.865 12.468 10.113 793 HA GLU 125 HA GLU 125 12.431 13.401 10.569 794 1HB GLU 125 1HB GLU 125 10.809 11.805 11.792 795 2HB GLU 125 2HB GLU 125 11.495 10.545 10.780 796 1HG GLU 125 1HG GLU 125 12.629 10.534 12.796 797 2HG GLU 125 2HG GLU 125 13.746 11.425 11.735 798 H ILE 126 H ILE 126 11.200 11.795 7.706 799 HA ILE 126 HA ILE 126 13.606 10.652 6.797 800 HB ILE 126 HB ILE 126 11.310 10.397 5.856 801 1HG1 ILE 126 1HG1 ILE 126 13.402 11.160 3.779 802 2HG1 ILE 126 2HG1 ILE 126 13.495 9.695 4.765 803 1HG2 ILE 126 1HG2 ILE 126 11.845 12.917 4.261 804 2HG2 ILE 126 2HG2 ILE 126 10.378 11.928 4.297 805 3HG2 ILE 126 3HG2 ILE 126 10.810 12.905 5.706 806 1HD1 ILE 126 1HD1 ILE 126 11.285 10.332 2.825 807 2HD1 ILE 126 2HD1 ILE 126 12.536 9.059 2.753 808 3HD1 ILE 126 3HD1 ILE 126 11.265 8.995 4.001 809 H VAL 127 H VAL 127 12.578 14.102 6.792 810 HA VAL 127 HA VAL 127 15.012 14.783 5.221 811 HB VAL 127 HB VAL 127 14.190 17.097 5.320 812 1HG1 VAL 127 1HG1 VAL 127 13.772 15.599 3.393 813 2HG1 VAL 127 2HG1 VAL 127 12.215 15.136 4.107 814 3HG1 VAL 127 3HG1 VAL 127 12.500 16.813 3.616 815 1HG2 VAL 127 1HG2 VAL 127 12.659 16.819 7.362 816 2HG2 VAL 127 2HG2 VAL 127 11.977 17.674 5.968 817 3HG2 VAL 127 3HG2 VAL 127 11.523 15.995 6.266 818 H LYS 128 H LYS 128 15.809 13.554 7.393 819 HA LYS 128 HA LYS 128 17.105 15.773 8.906 820 1HB LYS 128 1HB LYS 128 15.774 13.335 10.030 821 2HB LYS 128 2HB LYS 128 17.272 13.914 10.787 822 1HG LYS 128 1HG LYS 128 16.362 16.137 11.065 823 2HG LYS 128 2HG LYS 128 14.898 15.714 10.153 824 1HD LYS 128 1HD LYS 128 14.227 14.115 11.757 825 2HD LYS 128 2HD LYS 128 15.727 14.231 12.686 826 1HE LYS 128 1HE LYS 128 15.200 16.454 13.455 827 2HE LYS 128 2HE LYS 128 13.842 16.611 12.319 828 1HZ LYS 128 1HZ LYS 128 12.630 15.004 13.484 829 2HZ LYS 128 2HZ LYS 128 13.841 14.474 14.331 830 3HZ LYS 128 3HZ LYS 128 13.200 15.987 14.685 831 HA PRO 129 HA PRO 129 20.674 12.897 8.488 832 1HB PRO 129 1HB PRO 129 20.618 10.353 7.532 833 2HB PRO 129 2HB PRO 129 20.153 10.752 9.215 834 1HG PRO 129 1HG PRO 129 18.345 10.441 6.824 835 2HG PRO 129 2HG PRO 129 18.178 9.629 8.400 836 1HD PRO 129 1HD PRO 129 16.761 11.855 7.841 837 2HD PRO 129 2HD PRO 129 17.467 11.629 9.464 838 H VAL 130 H VAL 130 22.236 12.703 6.770 839 HA VAL 130 HA VAL 130 21.631 14.224 4.557 840 HB VAL 130 HB VAL 130 23.884 13.661 3.867 841 1HG1 VAL 130 1HG1 VAL 130 23.741 14.135 6.867 842 2HG1 VAL 130 2HG1 VAL 130 25.059 14.583 5.772 843 3HG1 VAL 130 3HG1 VAL 130 23.478 15.365 5.612 844 1HG2 VAL 130 1HG2 VAL 130 23.930 11.620 6.130 845 2HG2 VAL 130 2HG2 VAL 130 24.086 11.289 4.390 846 3HG2 VAL 130 3HG2 VAL 130 25.342 12.197 5.229 847 H GLU 131 H GLU 131 21.706 10.674 4.864 848 HA GLU 131 HA GLU 131 21.701 10.034 2.101 849 1HB GLU 131 1HB GLU 131 20.529 8.522 4.489 850 2HB GLU 131 2HB GLU 131 20.851 7.841 2.889 851 1HG GLU 131 1HG GLU 131 23.256 8.253 3.154 852 2HG GLU 131 2HG GLU 131 22.990 9.033 4.723 853 H THR 132 H THR 132 18.900 10.112 4.395 854 HA THR 132 HA THR 132 17.167 9.884 2.083 855 HB THR 132 HB THR 132 15.359 9.719 3.675 856 HG1 THR 132 HG1 THR 132 16.062 10.981 5.396 857 1HG2 THR 132 1HG2 THR 132 17.733 7.968 4.442 858 2HG2 THR 132 2HG2 THR 132 16.021 7.602 4.704 859 3HG2 THR 132 3HG2 THR 132 16.656 7.706 3.053 860 H GLN 133 H GLN 133 18.549 12.552 3.688 861 HA GLN 133 HA GLN 133 16.920 14.605 3.801 862 1HB GLN 133 1HB GLN 133 19.596 14.454 3.483 863 2HB GLN 133 2HB GLN 133 19.217 14.940 1.855 864 1HG GLN 133 1HG GLN 133 19.641 16.943 2.992 865 2HG GLN 133 2HG GLN 133 17.881 16.897 2.864 866 1HE2 GLN 133 1HE2 GLN 133 18.754 14.596 5.279 867 2HE2 GLN 133 2HE2 GLN 133 18.767 15.685 6.635 868 H GLY 134 H GLY 134 17.884 13.296 0.617 869 1HA GLY 134 1HA GLY 134 16.255 15.260 -0.860 870 2HA GLY 134 2HA GLY 134 17.282 13.984 -1.524 871 H ILE 135 H ILE 135 15.788 12.093 0.513 872 HA ILE 135 HA ILE 135 13.907 11.154 -1.537 873 HB ILE 135 HB ILE 135 14.764 9.945 1.115 874 1HG1 ILE 135 1HG1 ILE 135 16.617 9.935 -0.466 875 2HG1 ILE 135 2HG1 ILE 135 15.892 8.326 -0.403 876 1HG2 ILE 135 1HG2 ILE 135 12.924 8.937 -1.093 877 2HG2 ILE 135 2HG2 ILE 135 13.649 7.896 0.156 878 3HG2 ILE 135 3HG2 ILE 135 12.518 9.184 0.588 879 1HD1 ILE 135 1HD1 ILE 135 16.323 8.798 -2.691 880 2HD1 ILE 135 2HD1 ILE 135 14.566 8.876 -2.450 881 3HD1 ILE 135 3HD1 ILE 135 15.513 10.377 -2.600 882 H LYS 136 H LYS 136 11.990 11.899 -1.634 883 HA LYS 136 HA LYS 136 10.313 11.604 0.697 884 1HB LYS 136 1HB LYS 136 9.414 13.802 0.747 885 2HB LYS 136 2HB LYS 136 11.096 13.816 1.195 886 1HG LYS 136 1HG LYS 136 11.834 14.927 -0.653 887 2HG LYS 136 2HG LYS 136 10.608 14.261 -1.722 888 1HD LYS 136 1HD LYS 136 8.819 15.487 -0.466 889 2HD LYS 136 2HD LYS 136 10.062 16.262 0.531 890 1HE LYS 136 1HE LYS 136 10.928 17.413 -1.511 891 2HE LYS 136 2HE LYS 136 9.678 16.612 -2.489 892 1HZ LYS 136 1HZ LYS 136 9.009 18.862 -1.815 893 2HZ LYS 136 2HZ LYS 136 7.998 17.782 -1.107 894 3HZ LYS 136 3HZ LYS 136 9.192 18.481 -0.254 895 H THR 137 H THR 137 10.217 9.898 -1.206 896 HA THR 137 HA THR 137 7.614 10.459 -2.340 897 HB THR 137 HB THR 137 8.361 9.276 -4.436 898 HG1 THR 137 HG1 THR 137 10.327 8.514 -3.526 899 1HG2 THR 137 1HG2 THR 137 8.067 11.782 -4.206 900 2HG2 THR 137 2HG2 THR 137 9.823 11.904 -3.985 901 3HG2 THR 137 3HG2 THR 137 9.172 11.295 -5.524 902 H LEU 138 H LEU 138 6.887 9.153 -0.671 903 HA LEU 138 HA LEU 138 8.517 6.873 0.042 904 1HB LEU 138 1HB LEU 138 7.137 8.632 1.395 905 2HB LEU 138 2HB LEU 138 5.810 7.445 1.252 906 HG LEU 138 HG LEU 138 7.752 5.800 1.958 907 1HD1 LEU 138 1HD1 LEU 138 8.615 8.366 3.340 908 2HD1 LEU 138 2HD1 LEU 138 9.214 6.736 3.690 909 3HD1 LEU 138 3HD1 LEU 138 9.540 7.483 2.108 910 1HD2 LEU 138 1HD2 LEU 138 5.562 6.257 3.200 911 2HD2 LEU 138 2HD2 LEU 138 6.944 5.824 4.195 912 3HD2 LEU 138 3HD2 LEU 138 6.424 7.500 4.134 913 H THR 139 H THR 139 8.367 5.923 -2.006 914 HA THR 139 HA THR 139 5.972 5.383 -3.255 915 HB THR 139 HB THR 139 8.857 4.734 -3.666 916 HG1 THR 139 HG1 THR 139 8.651 6.137 -5.268 917 1HG2 THR 139 1HG2 THR 139 8.395 3.752 -5.916 918 2HG2 THR 139 2HG2 THR 139 8.098 2.700 -4.533 919 3HG2 THR 139 3HG2 THR 139 6.722 3.463 -5.381 920 H LEU 140 H LEU 140 4.537 3.699 -3.155 921 HA LEU 140 HA LEU 140 5.318 1.273 -1.656 922 1HB LEU 140 1HB LEU 140 3.049 2.147 -1.279 923 2HB LEU 140 2HB LEU 140 2.673 1.994 -3.003 924 HG LEU 140 HG LEU 140 3.647 -0.482 -1.613 925 1HD1 LEU 140 1HD1 LEU 140 2.103 0.338 0.076 926 2HD1 LEU 140 2HD1 LEU 140 0.881 0.702 -1.160 927 3HD1 LEU 140 3HD1 LEU 140 1.328 -0.979 -0.816 928 1HD2 LEU 140 1HD2 LEU 140 2.965 -0.527 -4.045 929 2HD2 LEU 140 2HD2 LEU 140 1.970 -1.572 -3.036 930 3HD2 LEU 140 3HD2 LEU 140 1.347 0.003 -3.565 931 H SER 141 H SER 141 6.115 -0.484 -2.773 932 HA SER 141 HA SER 141 4.920 -1.065 -5.293 933 1HB SER 141 1HB SER 141 6.838 0.441 -6.053 934 2HB SER 141 2HB SER 141 7.962 -0.737 -5.347 935 HG SER 141 HG SER 141 6.059 -1.190 -7.422 936 H TYR 142 H TYR 142 4.524 -3.177 -5.351 937 HA TYR 142 HA TYR 142 6.362 -5.101 -4.260 938 1HB TYR 142 1HB TYR 142 5.062 -4.027 -2.299 939 2HB TYR 142 2HB TYR 142 3.659 -4.918 -2.876 940 HD1 TYR 142 HD1 TYR 142 3.510 -7.336 -2.434 941 HD2 TYR 142 HD2 TYR 142 7.148 -5.195 -1.575 942 HE1 TYR 142 HE1 TYR 142 4.398 -9.313 -1.261 943 HE2 TYR 142 HE2 TYR 142 7.989 -7.123 -0.303 944 HH TYR 142 HH TYR 142 7.606 -9.321 0.332 945 H THR 143 H THR 143 5.295 -7.278 -4.223 946 HA THR 143 HA THR 143 3.634 -7.664 -6.663 947 HB THR 143 HB THR 143 5.835 -9.394 -5.475 948 HG1 THR 143 HG1 THR 143 6.941 -8.673 -7.353 949 1HG2 THR 143 1HG2 THR 143 4.073 -10.655 -6.634 950 2HG2 THR 143 2HG2 THR 143 4.236 -9.622 -8.066 951 3HG2 THR 143 3HG2 THR 143 5.580 -10.684 -7.565 952 H PHE 144 H PHE 144 1.684 -8.269 -6.205 953 HA PHE 144 HA PHE 144 0.892 -9.961 -3.901 954 1HB PHE 144 1HB PHE 144 -0.442 -8.695 -6.318 955 2HB PHE 144 2HB PHE 144 -1.233 -9.937 -5.394 956 HD1 PHE 144 HD1 PHE 144 0.938 -7.104 -4.045 957 HD2 PHE 144 HD2 PHE 144 -3.078 -8.621 -4.579 958 HE1 PHE 144 HE1 PHE 144 0.147 -5.680 -2.214 959 HE2 PHE 144 HE2 PHE 144 -3.858 -7.146 -2.808 960 HZ PHE 144 HZ PHE 144 -2.256 -5.758 -1.513 961 H TYR 145 H TYR 145 1.932 -11.949 -4.045 962 HA TYR 145 HA TYR 145 1.111 -13.756 -6.200 963 1HB TYR 145 1HB TYR 145 3.199 -14.294 -7.039 964 2HB TYR 145 2HB TYR 145 3.040 -12.547 -7.110 965 HD1 TYR 145 HD1 TYR 145 3.936 -12.132 -4.024 966 HD2 TYR 145 HD2 TYR 145 5.548 -14.326 -7.381 967 HE1 TYR 145 HE1 TYR 145 6.175 -11.882 -3.101 968 HE2 TYR 145 HE2 TYR 145 7.813 -14.110 -6.401 969 HH TYR 145 HH TYR 145 8.407 -12.414 -3.314 970 HA PRO 146 HA PRO 146 1.988 -15.987 -2.210 971 1HB PRO 146 1HB PRO 146 -0.497 -16.421 -1.172 972 2HB PRO 146 2HB PRO 146 0.406 -14.896 -0.985 973 1HG PRO 146 1HG PRO 146 -1.776 -15.442 -3.010 974 2HG PRO 146 2HG PRO 146 -1.578 -14.052 -1.921 975 1HD PRO 146 1HD PRO 146 -0.703 -14.015 -4.513 976 2HD PRO 146 2HD PRO 146 0.150 -13.146 -3.194 977 H ARG 147 H ARG 147 -1.220 -17.299 -3.135 978 HA ARG 147 HA ARG 147 0.097 -19.813 -4.049 979 1HB ARG 147 1HB ARG 147 -1.542 -19.561 -1.491 980 2HB ARG 147 2HB ARG 147 -0.823 -21.036 -2.154 981 1HG ARG 147 1HG ARG 147 1.450 -20.044 -1.776 982 2HG ARG 147 2HG ARG 147 0.673 -18.605 -1.088 983 1HD ARG 147 1HD ARG 147 -0.491 -20.079 0.580 984 2HD ARG 147 2HD ARG 147 0.600 -21.382 0.119 985 HE ARG 147 HE ARG 147 1.159 -18.837 1.550 986 1HH1 ARG 147 1HH1 ARG 147 2.681 -21.453 -0.247 987 2HH1 ARG 147 2HH1 ARG 147 4.267 -21.209 0.419 988 1HH2 ARG 147 1HH2 ARG 147 3.176 -18.468 2.443 989 2HH2 ARG 147 2HH2 ARG 147 4.560 -19.436 2.019 990 H GLU 148 H GLU 148 -1.178 -19.876 -5.965 991 HA GLU 148 HA GLU 148 -4.079 -19.539 -5.702 992 1HB GLU 148 1HB GLU 148 -4.137 -19.608 -8.106 993 2HB GLU 148 2HB GLU 148 -3.101 -18.338 -7.447 994 1HG GLU 148 1HG GLU 148 -1.082 -19.565 -8.061 995 2HG GLU 148 2HG GLU 148 -2.054 -20.939 -8.608 996 HA PRO 149 HA PRO 149 -4.387 -24.066 -5.621 997 1HB PRO 149 1HB PRO 149 -7.326 -23.703 -5.636 998 2HB PRO 149 2HB PRO 149 -6.301 -24.542 -4.456 999 1HG PRO 149 1HG PRO 149 -7.487 -22.104 -3.908 1000 2HG PRO 149 2HG PRO 149 -5.904 -22.591 -3.242 1001 1HD PRO 149 1HD PRO 149 -6.452 -20.787 -5.599 1002 2HD PRO 149 2HD PRO 149 -5.277 -20.633 -4.253 1003 H SER 150 H SER 150 -7.066 -22.381 -7.464 1004 HA SER 150 HA SER 150 -5.939 -23.381 -9.989 1005 1HB SER 150 1HB SER 150 -7.279 -25.288 -8.971 1006 2HB SER 150 2HB SER 150 -8.716 -24.264 -9.132 1007 HG SER 150 HG SER 150 -7.013 -25.271 -11.164 1008 H LYS 151 H LYS 151 -6.055 -21.705 -11.301 1009 HA LYS 151 HA LYS 151 -8.578 -20.147 -11.543 1010 1HB LYS 151 1HB LYS 151 -7.377 -18.151 -12.074 1011 2HB LYS 151 2HB LYS 151 -6.949 -18.720 -10.470 1012 1HG LYS 151 1HG LYS 151 -4.780 -18.725 -10.955 1013 2HG LYS 151 2HG LYS 151 -5.009 -19.851 -12.288 1014 1HD LYS 151 1HD LYS 151 -5.763 -17.848 -13.716 1015 2HD LYS 151 2HD LYS 151 -5.219 -16.801 -12.420 1016 1HE LYS 151 1HE LYS 151 -3.612 -18.601 -14.251 1017 2HE LYS 151 2HE LYS 151 -3.461 -16.856 -13.998 1018 1HZ LYS 151 1HZ LYS 151 -2.606 -19.032 -12.187 1019 2HZ LYS 151 2HZ LYS 151 -1.661 -17.909 -12.898 1020 3HZ LYS 151 3HZ LYS 151 -2.654 -17.558 -11.628 Start of MODEL 19 1 H VAL 21 H VAL 21 -2.440 12.142 14.135 2 HA VAL 21 HA VAL 21 -4.632 10.569 15.391 3 HB VAL 21 HB VAL 21 -4.440 13.569 15.090 4 1HG1 VAL 21 1HG1 VAL 21 -6.689 12.654 15.732 5 2HG1 VAL 21 2HG1 VAL 21 -5.931 11.784 17.077 6 3HG1 VAL 21 3HG1 VAL 21 -5.947 13.558 17.054 7 1HG2 VAL 21 1HG2 VAL 21 -3.370 11.797 17.327 8 2HG2 VAL 21 2HG2 VAL 21 -2.427 12.898 16.300 9 3HG2 VAL 21 3HG2 VAL 21 -3.587 13.555 17.452 10 H GLU 22 H GLU 22 -4.524 9.695 12.998 11 HA GLU 22 HA GLU 22 -5.012 9.686 10.814 12 1HB GLU 22 1HB GLU 22 -7.216 9.132 12.064 13 2HB GLU 22 2HB GLU 22 -7.791 10.694 11.457 14 1HG GLU 22 1HG GLU 22 -7.404 9.947 9.141 15 2HG GLU 22 2HG GLU 22 -6.603 8.472 9.711 16 H GLN 23 H GLN 23 -3.643 11.847 11.501 17 HA GLN 23 HA GLN 23 -3.514 13.643 9.415 18 1HB GLN 23 1HB GLN 23 -5.084 14.488 11.902 19 2HB GLN 23 2HB GLN 23 -3.885 15.605 11.312 20 1HG GLN 23 1HG GLN 23 -6.322 14.644 9.757 21 2HG GLN 23 2HG GLN 23 -6.039 16.237 10.444 22 1HE2 GLN 23 1HE2 GLN 23 -3.087 16.091 9.550 23 2HE2 GLN 23 2HE2 GLN 23 -3.160 16.356 7.830 24 H ALA 24 H ALA 24 -1.272 14.256 9.687 25 HA ALA 24 HA ALA 24 -0.135 12.272 11.219 26 1HB ALA 24 1HB ALA 24 2.014 13.186 10.498 27 2HB ALA 24 2HB ALA 24 0.771 13.170 9.218 28 3HB ALA 24 3HB ALA 24 1.206 14.705 10.034 29 H SER 25 H SER 25 0.268 15.814 11.861 30 HA SER 25 HA SER 25 -0.488 15.505 14.493 31 1HB SER 25 1HB SER 25 1.529 15.895 15.812 32 2HB SER 25 2HB SER 25 1.869 14.530 14.775 33 HG SER 25 HG SER 25 2.884 15.810 13.312 34 H ASP 26 H ASP 26 1.155 17.795 15.395 35 HA ASP 26 HA ASP 26 0.028 20.119 14.031 36 1HB ASP 26 1HB ASP 26 0.210 20.054 16.468 37 2HB ASP 26 2HB ASP 26 1.925 19.619 16.373 38 H LEU 27 H LEU 27 2.894 18.072 13.978 39 HA LEU 27 HA LEU 27 4.906 19.821 13.145 40 1HB LEU 27 1HB LEU 27 4.421 16.938 12.302 41 2HB LEU 27 2HB LEU 27 5.946 17.794 12.130 42 HG LEU 27 HG LEU 27 4.759 17.412 14.890 43 1HD1 LEU 27 1HD1 LEU 27 6.126 15.373 15.081 44 2HD1 LEU 27 2HD1 LEU 27 4.944 15.148 13.788 45 3HD1 LEU 27 3HD1 LEU 27 6.627 15.517 13.384 46 1HD2 LEU 27 1HD2 LEU 27 7.593 17.814 13.856 47 2HD2 LEU 27 2HD2 LEU 27 6.581 19.053 14.630 48 3HD2 LEU 27 3HD2 LEU 27 7.105 17.634 15.553 49 H ILE 28 H ILE 28 2.093 19.046 11.323 50 HA ILE 28 HA ILE 28 3.050 18.632 8.741 51 HB ILE 28 HB ILE 28 0.498 19.958 9.740 52 1HG1 ILE 28 1HG1 ILE 28 1.165 17.137 8.752 53 2HG1 ILE 28 2HG1 ILE 28 0.917 17.628 10.416 54 1HG2 ILE 28 1HG2 ILE 28 0.920 20.544 7.311 55 2HG2 ILE 28 2HG2 ILE 28 1.002 18.792 6.987 56 3HG2 ILE 28 3HG2 ILE 28 -0.494 19.528 7.589 57 1HD1 ILE 28 1HD1 ILE 28 -1.060 16.572 9.746 58 2HD1 ILE 28 2HD1 ILE 28 -1.431 18.307 9.832 59 3HD1 ILE 28 3HD1 ILE 28 -1.176 17.514 8.250 60 H LEU 29 H LEU 29 4.258 19.837 7.440 61 HA LEU 29 HA LEU 29 4.611 22.716 8.029 62 1HB LEU 29 1HB LEU 29 6.225 20.852 6.251 63 2HB LEU 29 2HB LEU 29 6.524 22.567 6.545 64 HG LEU 29 HG LEU 29 6.326 21.603 9.141 65 1HD1 LEU 29 1HD1 LEU 29 6.206 19.260 8.288 66 2HD1 LEU 29 2HD1 LEU 29 7.792 19.486 7.516 67 3HD1 LEU 29 3HD1 LEU 29 7.636 19.562 9.286 68 1HD2 LEU 29 1HD2 LEU 29 8.818 21.803 7.409 69 2HD2 LEU 29 2HD2 LEU 29 8.027 23.131 8.291 70 3HD2 LEU 29 3HD2 LEU 29 8.775 21.796 9.188 71 H ASP 30 H ASP 30 4.765 21.090 4.854 72 HA ASP 30 HA ASP 30 2.755 22.689 3.526 73 1HB ASP 30 1HB ASP 30 4.184 24.572 4.065 74 2HB ASP 30 2HB ASP 30 5.646 23.674 3.629 75 H GLU 31 H GLU 31 6.078 21.633 3.106 76 HA GLU 31 HA GLU 31 6.206 21.247 0.502 77 1HB GLU 31 1HB GLU 31 7.887 20.730 2.625 78 2HB GLU 31 2HB GLU 31 7.685 19.098 1.983 79 1HG GLU 31 1HG GLU 31 8.473 21.494 0.251 80 2HG GLU 31 2HG GLU 31 9.644 20.523 1.146 81 H LYS 32 H LYS 32 6.313 19.672 -1.023 82 HA LYS 32 HA LYS 32 3.835 18.030 -0.919 83 1HB LYS 32 1HB LYS 32 3.763 19.863 -2.411 84 2HB LYS 32 2HB LYS 32 5.359 19.520 -3.093 85 1HG LYS 32 1HG LYS 32 4.636 17.857 -4.403 86 2HG LYS 32 2HG LYS 32 3.376 17.322 -3.267 87 1HD LYS 32 1HD LYS 32 1.858 19.011 -3.899 88 2HD LYS 32 2HD LYS 32 3.092 19.972 -4.732 89 1HE LYS 32 1HE LYS 32 3.074 18.678 -6.647 90 2HE LYS 32 2HE LYS 32 2.581 17.208 -5.816 91 1HZ LYS 32 1HZ LYS 32 0.359 18.054 -5.632 92 2HZ LYS 32 2HZ LYS 32 0.776 19.488 -6.323 93 3HZ LYS 32 3HZ LYS 32 0.821 18.087 -7.185 94 H ILE 33 H ILE 33 4.649 16.215 -0.012 95 HA ILE 33 HA ILE 33 7.024 14.864 -1.161 96 HB ILE 33 HB ILE 33 7.094 15.078 1.118 97 1HG1 ILE 33 1HG1 ILE 33 7.882 12.992 -0.013 98 2HG1 ILE 33 2HG1 ILE 33 7.684 12.962 1.735 99 1HG2 ILE 33 1HG2 ILE 33 4.376 13.808 1.338 100 2HG2 ILE 33 2HG2 ILE 33 5.505 13.967 2.689 101 3HG2 ILE 33 3HG2 ILE 33 4.887 15.411 1.878 102 1HD1 ILE 33 1HD1 ILE 33 6.930 10.873 0.806 103 2HD1 ILE 33 2HD1 ILE 33 5.504 11.745 1.411 104 3HD1 ILE 33 3HD1 ILE 33 5.850 11.688 -0.323 105 H LYS 34 H LYS 34 6.622 13.849 -2.967 106 HA LYS 34 HA LYS 34 3.938 13.003 -3.703 107 1HB LYS 34 1HB LYS 34 5.621 14.121 -5.181 108 2HB LYS 34 2HB LYS 34 6.574 12.640 -5.181 109 1HG LYS 34 1HG LYS 34 3.686 12.815 -6.135 110 2HG LYS 34 2HG LYS 34 5.081 13.147 -7.152 111 1HD LYS 34 1HD LYS 34 5.653 10.614 -5.962 112 2HD LYS 34 2HD LYS 34 3.942 10.604 -6.345 113 1HE LYS 34 1HE LYS 34 4.647 11.483 -8.711 114 2HE LYS 34 2HE LYS 34 6.318 11.174 -8.199 115 1HZ LYS 34 1HZ LYS 34 4.160 9.349 -8.830 116 2HZ LYS 34 2HZ LYS 34 5.685 9.308 -9.348 117 3HZ LYS 34 3HZ LYS 34 5.356 8.787 -7.808 118 H VAL 35 H VAL 35 3.321 10.718 -4.031 119 HA VAL 35 HA VAL 35 5.140 8.730 -2.743 120 HB VAL 35 HB VAL 35 2.219 9.311 -2.259 121 1HG1 VAL 35 1HG1 VAL 35 2.402 6.861 -2.467 122 2HG1 VAL 35 2HG1 VAL 35 3.711 6.856 -1.260 123 3HG1 VAL 35 3HG1 VAL 35 2.067 7.342 -0.813 124 1HG2 VAL 35 1HG2 VAL 35 2.782 9.533 0.076 125 2HG2 VAL 35 2HG2 VAL 35 4.470 9.050 -0.250 126 3HG2 VAL 35 3HG2 VAL 35 3.824 10.597 -0.860 127 H THR 36 H THR 36 4.953 6.700 -3.655 128 HA THR 36 HA THR 36 3.382 6.513 -6.201 129 HB THR 36 HB THR 36 6.345 5.872 -5.793 130 HG1 THR 36 HG1 THR 36 6.037 8.054 -5.739 131 1HG2 THR 36 1HG2 THR 36 6.470 5.727 -8.211 132 2HG2 THR 36 2HG2 THR 36 5.315 4.534 -7.585 133 3HG2 THR 36 3HG2 THR 36 4.719 6.026 -8.359 134 H PHE 37 H PHE 37 1.926 5.160 -5.554 135 HA PHE 37 HA PHE 37 2.499 2.972 -3.733 136 1HB PHE 37 1HB PHE 37 0.060 3.701 -5.420 137 2HB PHE 37 2HB PHE 37 0.122 2.451 -4.206 138 HD1 PHE 37 HD1 PHE 37 -1.121 5.573 -4.734 139 HD2 PHE 37 HD2 PHE 37 1.209 3.402 -1.813 140 HE1 PHE 37 HE1 PHE 37 -1.933 7.060 -2.947 141 HE2 PHE 37 HE2 PHE 37 0.526 5.022 -0.066 142 HZ PHE 37 HZ PHE 37 -1.019 6.890 -0.659 143 H ASP 38 H ASP 38 4.064 1.714 -4.951 144 HA ASP 38 HA ASP 38 3.427 0.936 -7.674 145 1HB ASP 38 1HB ASP 38 5.678 1.496 -6.962 146 2HB ASP 38 2HB ASP 38 5.698 0.156 -5.827 147 H ALA 39 H ALA 39 1.372 0.045 -7.247 148 HA ALA 39 HA ALA 39 1.137 -2.506 -5.863 149 1HB ALA 39 1HB ALA 39 -1.219 -2.304 -6.592 150 2HB ALA 39 2HB ALA 39 -0.637 -0.788 -5.876 151 3HB ALA 39 3HB ALA 39 -0.779 -0.951 -7.639 152 H ASN 40 H ASN 40 2.227 -4.227 -6.889 153 HA ASN 40 HA ASN 40 1.872 -4.556 -9.833 154 1HB ASN 40 1HB ASN 40 3.801 -6.037 -8.077 155 2HB ASN 40 2HB ASN 40 3.743 -5.975 -9.827 156 1HD2 ASN 40 1HD2 ASN 40 4.391 -4.040 -6.881 157 2HD2 ASN 40 2HD2 ASN 40 5.439 -2.872 -7.690 158 H VAL 41 H VAL 41 0.218 -5.773 -10.319 159 HA VAL 41 HA VAL 41 -0.680 -8.065 -8.718 160 HB VAL 41 HB VAL 41 -2.277 -6.631 -9.995 161 1HG1 VAL 41 1HG1 VAL 41 -0.918 -6.245 -12.045 162 2HG1 VAL 41 2HG1 VAL 41 -1.155 -7.947 -12.498 163 3HG1 VAL 41 3HG1 VAL 41 -2.545 -6.858 -12.378 164 1HG2 VAL 41 1HG2 VAL 41 -2.818 -8.966 -9.295 165 2HG2 VAL 41 2HG2 VAL 41 -3.659 -8.463 -10.771 166 3HG2 VAL 41 3HG2 VAL 41 -2.263 -9.548 -10.878 167 H ALA 42 H ALA 42 -0.323 -10.278 -9.405 168 HA ALA 42 HA ALA 42 0.998 -10.783 -11.936 169 1HB ALA 42 1HB ALA 42 2.955 -10.559 -10.444 170 2HB ALA 42 2HB ALA 42 2.241 -11.746 -9.324 171 3HB ALA 42 3HB ALA 42 2.716 -12.245 -10.961 172 H ALA 43 H ALA 43 0.631 -13.024 -12.527 173 HA ALA 43 HA ALA 43 -1.906 -13.917 -12.080 174 1HB ALA 43 1HB ALA 43 -1.212 -16.036 -13.106 175 2HB ALA 43 2HB ALA 43 -0.432 -14.672 -13.924 176 3HB ALA 43 3HB ALA 43 0.493 -15.668 -12.775 177 H GLY 44 H GLY 44 0.977 -14.917 -10.357 178 1HA GLY 44 1HA GLY 44 0.482 -16.798 -8.535 179 2HA GLY 44 2HA GLY 44 1.238 -15.262 -8.108 180 H LEU 45 H LEU 45 -0.933 -13.465 -8.291 181 HA LEU 45 HA LEU 45 -2.923 -14.524 -6.346 182 1HB LEU 45 1HB LEU 45 -1.128 -12.636 -5.782 183 2HB LEU 45 2HB LEU 45 -2.324 -11.612 -6.573 184 HG LEU 45 HG LEU 45 -3.100 -13.534 -4.350 185 1HD1 LEU 45 1HD1 LEU 45 -1.253 -11.945 -3.538 186 2HD1 LEU 45 2HD1 LEU 45 -2.253 -10.613 -4.056 187 3HD1 LEU 45 3HD1 LEU 45 -2.825 -11.648 -2.765 188 1HD2 LEU 45 1HD2 LEU 45 -4.855 -11.959 -4.047 189 2HD2 LEU 45 2HD2 LEU 45 -4.263 -10.930 -5.377 190 3HD2 LEU 45 3HD2 LEU 45 -4.877 -12.576 -5.719 191 HA PRO 46 HA PRO 46 -4.552 -13.899 -10.500 192 1HB PRO 46 1HB PRO 46 -6.853 -15.485 -10.348 193 2HB PRO 46 2HB PRO 46 -5.184 -16.105 -10.494 194 1HG PRO 46 1HG PRO 46 -6.886 -15.693 -8.067 195 2HG PRO 46 2HG PRO 46 -5.972 -17.171 -8.498 196 1HD PRO 46 1HD PRO 46 -4.970 -15.381 -6.723 197 2HD PRO 46 2HD PRO 46 -3.886 -16.142 -7.925 198 H TRP 47 H TRP 47 -5.582 -12.142 -8.063 199 HA TRP 47 HA TRP 47 -8.354 -11.650 -8.551 200 1HB TRP 47 1HB TRP 47 -6.283 -10.296 -6.830 201 2HB TRP 47 2HB TRP 47 -8.011 -9.954 -6.793 202 HD1 TRP 47 HD1 TRP 47 -7.813 -13.559 -7.321 203 HE1 TRP 47 HE1 TRP 47 -8.212 -14.825 -5.194 204 HE3 TRP 47 HE3 TRP 47 -6.676 -9.910 -3.905 205 HZ2 TRP 47 HZ2 TRP 47 -8.193 -14.348 -2.295 206 HZ3 TRP 47 HZ3 TRP 47 -6.211 -10.821 -1.655 207 HH2 TRP 47 HH2 TRP 47 -7.271 -12.747 -0.762 208 H GLU 48 H GLU 48 -9.363 -9.710 -9.050 209 HA GLU 48 HA GLU 48 -8.180 -8.060 -11.198 210 1HB GLU 48 1HB GLU 48 -10.587 -8.700 -11.144 211 2HB GLU 48 2HB GLU 48 -10.739 -7.974 -9.541 212 1HG GLU 48 1HG GLU 48 -10.119 -5.732 -10.760 213 2HG GLU 48 2HG GLU 48 -10.549 -6.617 -12.229 214 H PHE 49 H PHE 49 -6.317 -7.544 -9.804 215 HA PHE 49 HA PHE 49 -6.805 -5.743 -7.524 216 1HB PHE 49 1HB PHE 49 -5.217 -7.545 -7.193 217 2HB PHE 49 2HB PHE 49 -4.277 -6.994 -8.582 218 HD1 PHE 49 HD1 PHE 49 -5.760 -5.321 -5.512 219 HD2 PHE 49 HD2 PHE 49 -2.200 -6.142 -7.808 220 HE1 PHE 49 HE1 PHE 49 -4.421 -4.013 -3.922 221 HE2 PHE 49 HE2 PHE 49 -0.879 -4.817 -6.220 222 HZ PHE 49 HZ PHE 49 -1.987 -3.696 -4.294 223 H VAL 50 H VAL 50 -6.770 -3.532 -7.815 224 HA VAL 50 HA VAL 50 -5.061 -2.484 -10.008 225 HB VAL 50 HB VAL 50 -6.688 -1.058 -10.904 226 1HG1 VAL 50 1HG1 VAL 50 -6.900 -3.457 -11.609 227 2HG1 VAL 50 2HG1 VAL 50 -8.195 -3.660 -10.399 228 3HG1 VAL 50 3HG1 VAL 50 -8.406 -2.535 -11.749 229 1HG2 VAL 50 1HG2 VAL 50 -7.863 -0.196 -8.989 230 2HG2 VAL 50 2HG2 VAL 50 -9.060 -0.965 -10.036 231 3HG2 VAL 50 3HG2 VAL 50 -8.475 -1.810 -8.588 232 HA PRO 51 HA PRO 51 -4.216 0.630 -6.806 233 1HB PRO 51 1HB PRO 51 -2.802 2.427 -8.280 234 2HB PRO 51 2HB PRO 51 -2.099 0.864 -7.800 235 1HG PRO 51 1HG PRO 51 -3.391 1.591 -10.444 236 2HG PRO 51 2HG PRO 51 -1.831 0.757 -10.187 237 1HD PRO 51 1HD PRO 51 -4.183 -0.553 -10.724 238 2HD PRO 51 2HD PRO 51 -2.914 -1.280 -9.690 239 H VAL 52 H VAL 52 -4.932 2.843 -6.537 240 HA VAL 52 HA VAL 52 -7.422 3.436 -7.936 241 HB VAL 52 HB VAL 52 -6.705 5.650 -6.293 242 1HG1 VAL 52 1HG1 VAL 52 -8.629 3.343 -5.941 243 2HG1 VAL 52 2HG1 VAL 52 -8.610 4.810 -4.934 244 3HG1 VAL 52 3HG1 VAL 52 -8.945 4.924 -6.672 245 1HG2 VAL 52 1HG2 VAL 52 -4.970 4.322 -5.181 246 2HG2 VAL 52 2HG2 VAL 52 -6.362 4.571 -4.110 247 3HG2 VAL 52 3HG2 VAL 52 -6.134 3.006 -4.905 248 H GLN 53 H GLN 53 -4.251 4.918 -7.488 249 HA GLN 53 HA GLN 53 -4.018 5.441 -10.237 250 1HB GLN 53 1HB GLN 53 -3.448 7.741 -10.241 251 2HB GLN 53 2HB GLN 53 -5.064 7.640 -9.590 252 1HG GLN 53 1HG GLN 53 -2.693 7.810 -7.691 253 2HG GLN 53 2HG GLN 53 -3.155 9.228 -8.637 254 1HE2 GLN 53 1HE2 GLN 53 -4.509 6.779 -6.409 255 2HE2 GLN 53 2HE2 GLN 53 -5.793 7.842 -5.847 256 H ARG 54 H ARG 54 -1.544 6.053 -10.539 257 HA ARG 54 HA ARG 54 -0.158 4.103 -8.997 258 1HB ARG 54 1HB ARG 54 0.452 4.846 -11.334 259 2HB ARG 54 2HB ARG 54 1.080 6.341 -10.641 260 1HG ARG 54 1HG ARG 54 2.918 4.827 -11.021 261 2HG ARG 54 2HG ARG 54 2.715 4.971 -9.280 262 1HD ARG 54 1HD ARG 54 1.761 2.875 -9.098 263 2HD ARG 54 2HD ARG 54 1.480 2.758 -10.832 264 HE ARG 54 HE ARG 54 3.852 1.967 -9.355 265 1HH1 ARG 54 1HH1 ARG 54 2.884 3.262 -12.473 266 2HH1 ARG 54 2HH1 ARG 54 4.142 2.459 -13.369 267 1HH2 ARG 54 1HH2 ARG 54 5.405 0.795 -10.478 268 2HH2 ARG 54 2HH2 ARG 54 5.685 1.061 -12.174 269 H ASP 55 H ASP 55 -0.222 7.720 -8.788 270 HA ASP 55 HA ASP 55 1.231 7.616 -6.244 271 1HB ASP 55 1HB ASP 55 2.475 9.537 -7.360 272 2HB ASP 55 2HB ASP 55 2.852 7.893 -7.920 273 H ILE 56 H ILE 56 1.315 9.617 -5.134 274 HA ILE 56 HA ILE 56 -0.983 11.439 -5.517 275 HB ILE 56 HB ILE 56 -1.678 11.360 -3.228 276 1HG1 ILE 56 1HG1 ILE 56 0.188 8.996 -3.053 277 2HG1 ILE 56 2HG1 ILE 56 0.515 10.595 -2.334 278 1HG2 ILE 56 1HG2 ILE 56 -2.871 9.246 -3.359 279 2HG2 ILE 56 2HG2 ILE 56 -2.757 9.933 -4.985 280 3HG2 ILE 56 3HG2 ILE 56 -1.678 8.603 -4.514 281 1HD1 ILE 56 1HD1 ILE 56 -1.804 8.841 -1.464 282 2HD1 ILE 56 2HD1 ILE 56 -0.244 9.044 -0.633 283 3HD1 ILE 56 3HD1 ILE 56 -1.337 10.419 -0.833 284 H ASP 57 H ASP 57 -0.727 13.426 -4.030 285 HA ASP 57 HA ASP 57 2.127 14.094 -3.524 286 1HB ASP 57 1HB ASP 57 1.392 16.337 -4.137 287 2HB ASP 57 2HB ASP 57 1.254 15.177 -5.480 288 H VAL 58 H VAL 58 2.113 13.503 -1.291 289 HA VAL 58 HA VAL 58 -0.032 14.392 0.536 290 HB VAL 58 HB VAL 58 2.534 12.892 0.794 291 1HG1 VAL 58 1HG1 VAL 58 1.951 12.600 3.205 292 2HG1 VAL 58 2HG1 VAL 58 2.410 14.263 2.842 293 3HG1 VAL 58 3HG1 VAL 58 0.695 13.842 3.034 294 1HG2 VAL 58 1HG2 VAL 58 0.503 11.758 -0.083 295 2HG2 VAL 58 2HG2 VAL 58 1.139 11.071 1.420 296 3HG2 VAL 58 3HG2 VAL 58 -0.290 12.122 1.469 297 H ARG 59 H ARG 59 -0.072 16.408 1.381 298 HA ARG 59 HA ARG 59 2.315 18.174 1.407 299 1HB ARG 59 1HB ARG 59 -0.563 18.455 2.304 300 2HB ARG 59 2HB ARG 59 0.689 19.534 2.921 301 1HG ARG 59 1HG ARG 59 -0.355 20.560 0.999 302 2HG ARG 59 2HG ARG 59 1.348 20.210 0.700 303 1HD ARG 59 1HD ARG 59 0.179 19.668 -1.273 304 2HD ARG 59 2HD ARG 59 0.697 18.157 -0.574 305 HE ARG 59 HE ARG 59 -1.873 18.441 0.472 306 1HH1 ARG 59 1HH1 ARG 59 -0.466 17.355 -2.388 307 2HH1 ARG 59 2HH1 ARG 59 -1.706 17.592 -3.514 308 1HH2 ARG 59 1HH2 ARG 59 -3.687 17.729 -0.430 309 2HH2 ARG 59 2HH2 ARG 59 -3.821 17.272 -2.132 310 H ILE 60 H ILE 60 3.856 17.407 2.739 311 HA ILE 60 HA ILE 60 4.365 15.595 4.395 312 HB ILE 60 HB ILE 60 4.827 18.440 5.182 313 1HG1 ILE 60 1HG1 ILE 60 5.829 17.265 3.024 314 2HG1 ILE 60 2HG1 ILE 60 6.820 18.272 4.061 315 1HG2 ILE 60 1HG2 ILE 60 5.192 17.315 7.278 316 2HG2 ILE 60 2HG2 ILE 60 6.004 15.958 6.471 317 3HG2 ILE 60 3HG2 ILE 60 6.743 17.579 6.505 318 1HD1 ILE 60 1HD1 ILE 60 6.747 15.238 4.235 319 2HD1 ILE 60 2HD1 ILE 60 7.885 16.170 3.240 320 3HD1 ILE 60 3HD1 ILE 60 7.922 16.340 4.993 321 H GLY 61 H GLY 61 2.418 14.530 5.098 322 1HA GLY 61 1HA GLY 61 1.695 13.615 7.104 323 2HA GLY 61 2HA GLY 61 1.850 15.152 7.937 324 H GLU 62 H GLU 62 0.256 15.836 5.130 325 HA GLU 62 HA GLU 62 -2.481 15.896 5.929 326 1HB GLU 62 1HB GLU 62 -1.498 17.205 4.112 327 2HB GLU 62 2HB GLU 62 -0.992 15.711 3.310 328 1HG GLU 62 1HG GLU 62 -3.455 15.166 2.959 329 2HG GLU 62 2HG GLU 62 -3.819 16.800 3.556 330 H THR 63 H THR 63 -3.869 14.115 6.242 331 HA THR 63 HA THR 63 -3.074 11.461 5.346 332 HB THR 63 HB THR 63 -5.440 11.162 6.616 333 HG1 THR 63 HG1 THR 63 -5.612 12.747 8.195 334 1HG2 THR 63 1HG2 THR 63 -4.063 10.817 8.651 335 2HG2 THR 63 2HG2 THR 63 -3.296 10.183 7.220 336 3HG2 THR 63 3HG2 THR 63 -2.717 11.724 7.914 337 H VAL 64 H VAL 64 -3.491 10.825 3.344 338 HA VAL 64 HA VAL 64 -5.967 11.806 1.977 339 HB VAL 64 HB VAL 64 -4.160 10.256 0.290 340 1HG1 VAL 64 1HG1 VAL 64 -4.314 12.206 -1.147 341 2HG1 VAL 64 2HG1 VAL 64 -5.919 11.791 -0.512 342 3HG1 VAL 64 3HG1 VAL 64 -5.011 13.169 0.171 343 1HG2 VAL 64 1HG2 VAL 64 -2.901 12.650 1.688 344 2HG2 VAL 64 2HG2 VAL 64 -2.304 10.963 1.550 345 3HG2 VAL 64 3HG2 VAL 64 -2.381 12.025 0.129 346 H GLN 65 H GLN 65 -7.453 10.259 1.136 347 HA GLN 65 HA GLN 65 -7.139 7.500 2.168 348 1HB GLN 65 1HB GLN 65 -9.069 8.920 2.967 349 2HB GLN 65 2HB GLN 65 -9.712 8.853 1.326 350 1HG GLN 65 1HG GLN 65 -9.091 6.482 3.179 351 2HG GLN 65 2HG GLN 65 -10.697 7.146 2.869 352 1HE2 GLN 65 1HE2 GLN 65 -10.769 7.482 0.127 353 2HE2 GLN 65 2HE2 GLN 65 -10.575 5.931 -0.654 354 H ILE 66 H ILE 66 -6.870 5.926 0.722 355 HA ILE 66 HA ILE 66 -7.494 6.312 -2.129 356 HB ILE 66 HB ILE 66 -4.997 5.331 -2.421 357 1HG1 ILE 66 1HG1 ILE 66 -3.432 6.796 -1.155 358 2HG1 ILE 66 2HG1 ILE 66 -4.684 7.247 -0.021 359 1HG2 ILE 66 1HG2 ILE 66 -5.599 8.280 -2.164 360 2HG2 ILE 66 2HG2 ILE 66 -4.356 7.500 -3.168 361 3HG2 ILE 66 3HG2 ILE 66 -6.062 7.266 -3.558 362 1HD1 ILE 66 1HD1 ILE 66 -3.693 4.401 -0.610 363 2HD1 ILE 66 2HD1 ILE 66 -3.202 5.398 0.769 364 3HD1 ILE 66 3HD1 ILE 66 -4.882 4.854 0.635 365 H MET 67 H MET 67 -9.016 4.794 -2.021 366 HA MET 67 HA MET 67 -8.771 2.317 -0.622 367 1HB MET 67 1HB MET 67 -10.921 3.367 -1.002 368 2HB MET 67 2HB MET 67 -10.680 3.369 -2.755 369 1HG MET 67 1HG MET 67 -10.797 0.919 -2.830 370 2HG MET 67 2HG MET 67 -11.018 0.855 -1.084 371 1HE MET 67 1HE MET 67 -13.219 1.517 0.152 372 2HE MET 67 2HE MET 67 -13.164 3.173 -0.510 373 3HE MET 67 3HE MET 67 -14.644 2.202 -0.662 374 H TYR 68 H TYR 68 -8.200 0.274 -1.314 375 HA TYR 68 HA TYR 68 -7.102 -0.023 -4.093 376 1HB TYR 68 1HB TYR 68 -6.591 -1.510 -1.496 377 2HB TYR 68 2HB TYR 68 -6.131 -2.134 -3.072 378 HD1 TYR 68 HD1 TYR 68 -4.125 -1.457 -4.150 379 HD2 TYR 68 HD2 TYR 68 -5.602 0.803 -0.790 380 HE1 TYR 68 HE1 TYR 68 -1.908 -0.405 -3.886 381 HE2 TYR 68 HE2 TYR 68 -3.383 1.887 -0.551 382 HH TYR 68 HH TYR 68 -0.591 0.938 -2.573 383 H ARG 69 H ARG 69 -7.955 -1.625 -5.410 384 HA ARG 69 HA ARG 69 -10.350 -3.086 -4.381 385 1HB ARG 69 1HB ARG 69 -10.512 -1.359 -6.431 386 2HB ARG 69 2HB ARG 69 -9.875 -2.766 -7.310 387 1HG ARG 69 1HG ARG 69 -11.750 -4.096 -6.013 388 2HG ARG 69 2HG ARG 69 -12.429 -2.468 -5.785 389 1HD ARG 69 1HD ARG 69 -12.249 -2.223 -8.342 390 2HD ARG 69 2HD ARG 69 -11.900 -3.968 -8.392 391 HE ARG 69 HE ARG 69 -14.224 -3.466 -6.767 392 1HH1 ARG 69 1HH1 ARG 69 -13.496 -3.877 -10.191 393 2HH1 ARG 69 2HH1 ARG 69 -15.038 -3.269 -10.721 394 1HH2 ARG 69 1HH2 ARG 69 -16.174 -3.080 -7.307 395 2HH2 ARG 69 2HH2 ARG 69 -16.768 -2.964 -8.970 396 H ALA 70 H ALA 70 -10.141 -5.232 -4.289 397 HA ALA 70 HA ALA 70 -8.627 -6.690 -6.353 398 1HB ALA 70 1HB ALA 70 -8.562 -7.295 -3.385 399 2HB ALA 70 2HB ALA 70 -8.004 -8.360 -4.692 400 3HB ALA 70 3HB ALA 70 -7.189 -6.811 -4.395 401 H LYS 71 H LYS 71 -9.985 -8.423 -7.137 402 HA LYS 71 HA LYS 71 -12.092 -9.442 -5.356 403 1HB LYS 71 1HB LYS 71 -12.637 -8.764 -8.274 404 2HB LYS 71 2HB LYS 71 -13.743 -9.536 -7.117 405 1HG LYS 71 1HG LYS 71 -13.357 -7.330 -5.722 406 2HG LYS 71 2HG LYS 71 -12.868 -6.624 -7.266 407 1HD LYS 71 1HD LYS 71 -15.502 -8.057 -6.617 408 2HD LYS 71 2HD LYS 71 -15.260 -6.319 -6.500 409 1HE LYS 71 1HE LYS 71 -16.458 -6.936 -8.560 410 2HE LYS 71 2HE LYS 71 -14.937 -6.088 -8.898 411 1HZ LYS 71 1HZ LYS 71 -15.417 -8.072 -10.283 412 2HZ LYS 71 2HZ LYS 71 -13.950 -7.952 -9.650 413 3HZ LYS 71 3HZ LYS 71 -15.037 -9.014 -8.969 414 H ASN 72 H ASN 72 -12.455 -11.710 -5.749 415 HA ASN 72 HA ASN 72 -10.057 -12.855 -6.905 416 1HB ASN 72 1HB ASN 72 -10.681 -13.610 -4.757 417 2HB ASN 72 2HB ASN 72 -12.290 -14.110 -5.324 418 1HD2 ASN 72 1HD2 ASN 72 -11.894 -16.315 -4.641 419 2HD2 ASN 72 2HD2 ASN 72 -10.887 -17.393 -5.619 420 H LEU 73 H LEU 73 -10.217 -12.521 -9.070 421 HA LEU 73 HA LEU 73 -12.219 -13.963 -10.674 422 1HB LEU 73 1HB LEU 73 -9.703 -12.396 -11.304 423 2HB LEU 73 2HB LEU 73 -10.505 -13.355 -12.531 424 HG LEU 73 HG LEU 73 -11.101 -10.925 -12.546 425 1HD1 LEU 73 1HD1 LEU 73 -13.424 -12.879 -12.274 426 2HD1 LEU 73 2HD1 LEU 73 -13.435 -11.323 -13.124 427 3HD1 LEU 73 3HD1 LEU 73 -12.420 -12.644 -13.721 428 1HD2 LEU 73 1HD2 LEU 73 -12.877 -11.594 -10.158 429 2HD2 LEU 73 2HD2 LEU 73 -11.403 -10.602 -10.095 430 3HD2 LEU 73 3HD2 LEU 73 -12.793 -10.066 -11.050 431 H ALA 74 H ALA 74 -11.707 -15.945 -9.331 432 HA ALA 74 HA ALA 74 -10.414 -17.681 -11.285 433 1HB ALA 74 1HB ALA 74 -9.124 -18.927 -9.545 434 2HB ALA 74 2HB ALA 74 -8.536 -17.254 -9.682 435 3HB ALA 74 3HB ALA 74 -9.588 -17.716 -8.333 436 H SER 75 H SER 75 -11.738 -19.599 -11.364 437 HA SER 75 HA SER 75 -14.066 -19.585 -9.598 438 1HB SER 75 1HB SER 75 -14.171 -20.329 -12.014 439 2HB SER 75 2HB SER 75 -13.413 -21.850 -11.473 440 HG SER 75 HG SER 75 -15.048 -22.086 -9.966 441 H THR 76 H THR 76 -11.601 -19.778 -8.108 442 HA THR 76 HA THR 76 -12.145 -22.113 -6.521 443 HB THR 76 HB THR 76 -9.487 -22.414 -6.475 444 HG1 THR 76 HG1 THR 76 -8.589 -22.025 -8.581 445 1HG2 THR 76 1HG2 THR 76 -11.020 -23.472 -8.889 446 2HG2 THR 76 2HG2 THR 76 -9.570 -24.176 -8.155 447 3HG2 THR 76 3HG2 THR 76 -11.101 -24.169 -7.258 448 HA PRO 77 HA PRO 77 -11.268 -19.103 -3.480 449 1HB PRO 77 1HB PRO 77 -10.479 -20.567 -1.296 450 2HB PRO 77 2HB PRO 77 -12.146 -20.627 -1.930 451 1HG PRO 77 1HG PRO 77 -9.892 -22.555 -2.534 452 2HG PRO 77 2HG PRO 77 -11.557 -22.946 -2.011 453 1HD PRO 77 1HD PRO 77 -10.844 -22.998 -4.629 454 2HD PRO 77 2HD PRO 77 -12.445 -22.375 -4.137 455 H THR 78 H THR 78 -9.434 -17.868 -2.748 456 HA THR 78 HA THR 78 -6.722 -18.896 -3.548 457 HB THR 78 HB THR 78 -6.348 -16.325 -3.834 458 HG1 THR 78 HG1 THR 78 -9.122 -16.297 -4.255 459 1HG2 THR 78 1HG2 THR 78 -7.189 -16.268 -6.035 460 2HG2 THR 78 2HG2 THR 78 -6.397 -17.821 -5.743 461 3HG2 THR 78 3HG2 THR 78 -8.183 -17.732 -5.795 462 H THR 79 H THR 79 -5.003 -17.282 -2.569 463 HA THR 79 HA THR 79 -5.328 -16.922 0.335 464 HB THR 79 HB THR 79 -3.433 -18.673 -1.281 465 HG1 THR 79 HG1 THR 79 -3.934 -20.113 0.397 466 1HG2 THR 79 1HG2 THR 79 -1.934 -18.883 0.650 467 2HG2 THR 79 2HG2 THR 79 -1.880 -17.284 -0.076 468 3HG2 THR 79 3HG2 THR 79 -2.773 -17.526 1.451 469 H GLY 80 H GLY 80 -4.574 -14.812 0.688 470 1HA GLY 80 1HA GLY 80 -3.038 -13.483 -1.506 471 2HA GLY 80 2HA GLY 80 -4.426 -12.772 -0.675 472 H GLN 81 H GLN 81 -1.062 -12.837 -0.708 473 HA GLN 81 HA GLN 81 -1.066 -11.476 1.887 474 1HB GLN 81 1HB GLN 81 0.940 -12.649 2.739 475 2HB GLN 81 2HB GLN 81 -0.553 -13.578 2.733 476 1HG GLN 81 1HG GLN 81 1.005 -15.122 2.161 477 2HG GLN 81 2HG GLN 81 0.233 -14.762 0.631 478 1HE2 GLN 81 1HE2 GLN 81 1.801 -14.398 -1.058 479 2HE2 GLN 81 2HE2 GLN 81 3.463 -13.979 -0.749 480 H ALA 82 H ALA 82 0.963 -12.506 -0.831 481 HA ALA 82 HA ALA 82 2.300 -11.355 -2.220 482 1HB ALA 82 1HB ALA 82 0.347 -9.834 -2.482 483 2HB ALA 82 2HB ALA 82 0.914 -8.848 -1.157 484 3HB ALA 82 3HB ALA 82 1.887 -8.950 -2.614 485 H THR 83 H THR 83 4.118 -9.502 -2.146 486 HA THR 83 HA THR 83 5.160 -9.313 0.668 487 HB THR 83 HB THR 83 6.636 -10.688 -0.752 488 HG1 THR 83 HG1 THR 83 7.872 -8.257 -0.048 489 1HG2 THR 83 1HG2 THR 83 7.208 -8.060 -2.204 490 2HG2 THR 83 2HG2 THR 83 8.041 -9.608 -2.440 491 3HG2 THR 83 3HG2 THR 83 6.338 -9.446 -2.916 492 H PHE 84 H PHE 84 5.821 -7.328 1.300 493 HA PHE 84 HA PHE 84 4.870 -5.006 -0.329 494 1HB PHE 84 1HB PHE 84 4.293 -4.065 1.989 495 2HB PHE 84 2HB PHE 84 3.247 -5.278 1.303 496 HD1 PHE 84 HD1 PHE 84 3.153 -7.604 2.212 497 HD2 PHE 84 HD2 PHE 84 5.619 -4.549 4.012 498 HE1 PHE 84 HE1 PHE 84 3.916 -9.204 3.914 499 HE2 PHE 84 HE2 PHE 84 6.492 -6.165 5.586 500 HZ PHE 84 HZ PHE 84 5.608 -8.521 5.614 501 H ASN 85 H ASN 85 6.953 -4.527 -1.158 502 HA ASN 85 HA ASN 85 9.151 -4.067 0.802 503 1HB ASN 85 1HB ASN 85 10.133 -4.775 -1.088 504 2HB ASN 85 2HB ASN 85 8.832 -4.191 -2.102 505 1HD2 ASN 85 1HD2 ASN 85 11.379 -2.739 0.106 506 2HD2 ASN 85 2HD2 ASN 85 11.736 -1.431 -1.016 507 H VAL 86 H VAL 86 7.931 -2.752 2.130 508 HA VAL 86 HA VAL 86 6.865 -0.177 1.334 509 HB VAL 86 HB VAL 86 7.541 -1.204 4.119 510 1HG1 VAL 86 1HG1 VAL 86 7.122 1.244 4.194 511 2HG1 VAL 86 2HG1 VAL 86 5.744 1.030 3.101 512 3HG1 VAL 86 3HG1 VAL 86 5.686 0.411 4.768 513 1HG2 VAL 86 1HG2 VAL 86 5.271 -1.902 4.336 514 2HG2 VAL 86 2HG2 VAL 86 4.814 -1.185 2.786 515 3HG2 VAL 86 3HG2 VAL 86 5.857 -2.620 2.836 516 H THR 87 H THR 87 9.034 0.421 0.116 517 HA THR 87 HA THR 87 10.011 2.634 1.466 518 HB THR 87 HB THR 87 11.330 1.141 2.863 519 HG1 THR 87 HG1 THR 87 13.390 2.051 2.433 520 1HG2 THR 87 1HG2 THR 87 13.148 -0.205 1.985 521 2HG2 THR 87 2HG2 THR 87 11.576 -0.721 1.342 522 3HG2 THR 87 3HG2 THR 87 12.689 0.232 0.324 523 HA PRO 88 HA PRO 88 11.626 3.306 -2.722 524 1HB PRO 88 1HB PRO 88 13.209 5.506 -2.274 525 2HB PRO 88 2HB PRO 88 11.448 5.590 -2.491 526 1HG PRO 88 1HG PRO 88 13.005 5.706 0.083 527 2HG PRO 88 2HG PRO 88 11.550 6.611 -0.386 528 1HD PRO 88 1HD PRO 88 11.499 4.370 1.223 529 2HD PRO 88 2HD PRO 88 10.150 4.870 0.199 530 H MET 89 H MET 89 13.397 3.239 0.309 531 HA MET 89 HA MET 89 15.111 1.270 0.014 532 1HB MET 89 1HB MET 89 17.357 2.267 -0.497 533 2HB MET 89 2HB MET 89 16.299 2.019 -1.860 534 1HG MET 89 1HG MET 89 15.713 4.591 -1.571 535 2HG MET 89 2HG MET 89 17.187 4.607 -0.593 536 1HE MET 89 1HE MET 89 16.436 2.630 -4.022 537 2HE MET 89 2HE MET 89 15.654 4.224 -4.154 538 3HE MET 89 3HE MET 89 17.089 3.846 -5.135 539 H ALA 90 H ALA 90 15.784 4.702 0.763 540 HA ALA 90 HA ALA 90 17.088 4.104 3.206 541 1HB ALA 90 1HB ALA 90 15.885 6.745 2.284 542 2HB ALA 90 2HB ALA 90 17.166 6.514 3.488 543 3HB ALA 90 3HB ALA 90 17.487 6.130 1.785 544 H ALA 91 H ALA 91 13.808 5.341 2.534 545 HA ALA 91 HA ALA 91 13.391 6.051 5.315 546 1HB ALA 91 1HB ALA 91 12.566 7.482 3.649 547 2HB ALA 91 2HB ALA 91 11.580 6.214 2.898 548 3HB ALA 91 3HB ALA 91 11.170 6.808 4.531 549 H GLY 92 H GLY 92 10.609 4.683 3.768 550 1HA GLY 92 1HA GLY 92 9.285 2.913 4.264 551 2HA GLY 92 2HA GLY 92 10.688 2.081 4.945 552 H ALA 93 H ALA 93 11.417 3.425 7.135 553 HA ALA 93 HA ALA 93 9.752 2.770 9.171 554 1HB ALA 93 1HB ALA 93 10.992 4.411 10.561 555 2HB ALA 93 2HB ALA 93 12.064 3.487 9.489 556 3HB ALA 93 3HB ALA 93 11.637 5.163 9.086 557 H TYR 94 H TYR 94 9.944 6.058 7.827 558 HA TYR 94 HA TYR 94 7.739 7.121 9.271 559 1HB TYR 94 1HB TYR 94 8.946 8.249 6.737 560 2HB TYR 94 2HB TYR 94 8.249 9.130 8.091 561 HD1 TYR 94 HD1 TYR 94 11.283 8.060 6.599 562 HD2 TYR 94 HD2 TYR 94 9.449 8.501 10.470 563 HE1 TYR 94 HE1 TYR 94 13.490 7.781 7.675 564 HE2 TYR 94 HE2 TYR 94 11.674 8.287 11.542 565 HH TYR 94 HH TYR 94 14.611 7.513 9.679 566 H PHE 95 H PHE 95 7.409 4.826 6.928 567 HA PHE 95 HA PHE 95 5.551 6.139 5.207 568 1HB PHE 95 1HB PHE 95 7.012 4.140 4.544 569 2HB PHE 95 2HB PHE 95 6.072 3.140 5.634 570 HD1 PHE 95 HD1 PHE 95 6.356 4.382 2.256 571 HD2 PHE 95 HD2 PHE 95 3.804 2.366 5.048 572 HE1 PHE 95 HE1 PHE 95 4.715 3.993 0.446 573 HE2 PHE 95 HE2 PHE 95 2.338 1.687 3.169 574 HZ PHE 95 HZ PHE 95 2.575 2.836 0.949 575 H ASN 96 H ASN 96 3.801 6.986 6.362 576 HA ASN 96 HA ASN 96 2.845 5.362 8.509 577 1HB ASN 96 1HB ASN 96 2.228 8.164 7.629 578 2HB ASN 96 2HB ASN 96 1.122 7.308 8.706 579 1HD2 ASN 96 1HD2 ASN 96 4.700 7.973 8.477 580 2HD2 ASN 96 2HD2 ASN 96 4.735 8.442 10.186 581 H LYS 97 H LYS 97 2.081 3.563 7.259 582 HA LYS 97 HA LYS 97 -0.750 3.951 6.304 583 1HB LYS 97 1HB LYS 97 1.168 2.945 4.816 584 2HB LYS 97 2HB LYS 97 0.832 1.445 5.651 585 1HG LYS 97 1HG LYS 97 -1.388 3.082 4.304 586 2HG LYS 97 2HG LYS 97 -0.277 2.101 3.372 587 1HD LYS 97 1HD LYS 97 -2.133 0.783 3.595 588 2HD LYS 97 2HD LYS 97 -0.955 0.070 4.697 589 1HE LYS 97 1HE LYS 97 -2.164 0.745 6.610 590 2HE LYS 97 2HE LYS 97 -2.975 2.079 5.778 591 1HZ LYS 97 1HZ LYS 97 -4.291 0.435 4.627 592 2HZ LYS 97 2HZ LYS 97 -3.515 -0.796 5.398 593 3HZ LYS 97 3HZ LYS 97 -4.436 0.266 6.253 594 H VAL 98 H VAL 98 1.338 1.522 7.989 595 HA VAL 98 HA VAL 98 -1.013 0.736 9.627 596 HB VAL 98 HB VAL 98 -0.746 -0.706 7.576 597 1HG1 VAL 98 1HG1 VAL 98 1.085 -2.310 7.447 598 2HG1 VAL 98 2HG1 VAL 98 1.717 -0.657 7.369 599 3HG1 VAL 98 3HG1 VAL 98 1.857 -1.592 8.871 600 1HG2 VAL 98 1HG2 VAL 98 -1.850 -1.550 9.603 601 2HG2 VAL 98 2HG2 VAL 98 -0.989 -2.825 8.723 602 3HG2 VAL 98 3HG2 VAL 98 -0.292 -2.154 10.203 603 H GLN 99 H GLN 99 -0.481 -0.140 11.639 604 HA GLN 99 HA GLN 99 2.078 0.708 12.764 605 1HB GLN 99 1HB GLN 99 -0.119 0.946 13.900 606 2HB GLN 99 2HB GLN 99 -0.259 -0.815 14.015 607 1HG GLN 99 1HG GLN 99 1.712 -0.906 15.478 608 2HG GLN 99 2HG GLN 99 2.033 0.812 15.196 609 1HE2 GLN 99 1HE2 GLN 99 -0.225 -1.476 16.779 610 2HE2 GLN 99 2HE2 GLN 99 -0.942 -0.272 17.828 611 H CYS 100 H CYS 100 0.334 -2.394 12.297 612 HA CYS 100 HA CYS 100 2.759 -4.009 12.789 613 1HB CYS 100 1HB CYS 100 0.723 -4.951 13.604 614 2HB CYS 100 2HB CYS 100 -0.110 -4.712 12.048 615 HG CYS 100 HG CYS 100 1.263 -6.285 10.634 616 H PHE 101 H PHE 101 4.195 -3.503 11.145 617 HA PHE 101 HA PHE 101 3.532 -3.128 8.409 618 1HB PHE 101 1HB PHE 101 6.193 -3.910 9.634 619 2HB PHE 101 2HB PHE 101 5.941 -3.207 8.046 620 HD1 PHE 101 HD1 PHE 101 6.487 -2.477 11.545 621 HD2 PHE 101 HD2 PHE 101 4.847 -0.857 7.893 622 HE1 PHE 101 HE1 PHE 101 6.629 -0.194 12.485 623 HE2 PHE 101 HE2 PHE 101 5.012 1.429 8.842 624 HZ PHE 101 HZ PHE 101 5.921 1.767 11.125 625 H CYS 102 H CYS 102 2.083 -5.185 8.468 626 HA CYS 102 HA CYS 102 3.265 -6.939 6.516 627 1HB CYS 102 1HB CYS 102 4.106 -8.131 8.518 628 2HB CYS 102 2HB CYS 102 2.455 -8.233 9.166 629 HG CYS 102 HG CYS 102 1.447 -9.577 7.172 630 H PHE 103 H PHE 103 1.482 -5.523 5.640 631 HA PHE 103 HA PHE 103 -1.241 -6.359 6.356 632 1HB PHE 103 1HB PHE 103 -0.890 -4.057 5.646 633 2HB PHE 103 2HB PHE 103 -0.259 -4.598 4.093 634 HD1 PHE 103 HD1 PHE 103 -1.796 -4.640 2.272 635 HD2 PHE 103 HD2 PHE 103 -3.299 -5.146 6.291 636 HE1 PHE 103 HE1 PHE 103 -4.035 -5.120 1.371 637 HE2 PHE 103 HE2 PHE 103 -5.532 -5.691 5.365 638 HZ PHE 103 HZ PHE 103 -5.889 -5.716 2.904 639 H THR 104 H THR 104 -2.599 -7.625 4.980 640 HA THR 104 HA THR 104 -1.386 -9.437 3.033 641 HB THR 104 HB THR 104 -1.554 -9.989 6.005 642 HG1 THR 104 HG1 THR 104 0.371 -9.536 4.493 643 1HG2 THR 104 1HG2 THR 104 -1.273 -12.437 5.516 644 2HG2 THR 104 2HG2 THR 104 -2.910 -11.815 5.279 645 3HG2 THR 104 3HG2 THR 104 -1.876 -12.126 3.879 646 H GLU 105 H GLU 105 -3.077 -9.650 1.695 647 HA GLU 105 HA GLU 105 -5.759 -9.058 2.566 648 1HB GLU 105 1HB GLU 105 -4.632 -9.900 -0.132 649 2HB GLU 105 2HB GLU 105 -6.262 -9.268 0.163 650 1HG GLU 105 1HG GLU 105 -5.348 -7.172 1.012 651 2HG GLU 105 2HG GLU 105 -3.684 -7.729 0.744 652 H THR 106 H THR 106 -5.132 -11.208 4.012 653 HA THR 106 HA THR 106 -5.748 -13.414 4.501 654 HB THR 106 HB THR 106 -7.284 -11.863 5.435 655 HG1 THR 106 HG1 THR 106 -7.925 -13.933 5.763 656 1HG2 THR 106 1HG2 THR 106 -8.059 -10.516 3.615 657 2HG2 THR 106 2HG2 THR 106 -8.839 -11.888 2.812 658 3HG2 THR 106 3HG2 THR 106 -9.458 -11.290 4.358 659 H THR 107 H THR 107 -8.630 -13.897 3.048 660 HA THR 107 HA THR 107 -7.664 -15.491 0.767 661 HB THR 107 HB THR 107 -7.496 -17.000 2.599 662 HG1 THR 107 HG1 THR 107 -8.460 -17.890 0.743 663 1HG2 THR 107 1HG2 THR 107 -8.889 -15.893 4.222 664 2HG2 THR 107 2HG2 THR 107 -10.335 -16.163 3.222 665 3HG2 THR 107 3HG2 THR 107 -9.500 -17.543 3.977 666 H LEU 108 H LEU 108 -9.481 -16.030 -0.691 667 HA LEU 108 HA LEU 108 -12.104 -14.895 -0.069 668 1HB LEU 108 1HB LEU 108 -10.509 -14.129 -2.549 669 2HB LEU 108 2HB LEU 108 -12.259 -13.988 -2.451 670 HG LEU 108 HG LEU 108 -10.323 -12.449 -0.677 671 1HD1 LEU 108 1HD1 LEU 108 -11.952 -11.692 -3.142 672 2HD1 LEU 108 2HD1 LEU 108 -11.138 -10.527 -2.097 673 3HD1 LEU 108 3HD1 LEU 108 -10.187 -11.708 -3.005 674 1HD2 LEU 108 1HD2 LEU 108 -12.515 -12.803 0.440 675 2HD2 LEU 108 2HD2 LEU 108 -12.375 -11.143 -0.107 676 3HD2 LEU 108 3HD2 LEU 108 -13.361 -12.284 -1.033 677 H GLU 109 H GLU 109 -13.684 -16.098 -0.902 678 HA GLU 109 HA GLU 109 -13.086 -18.572 -2.262 679 1HB GLU 109 1HB GLU 109 -15.863 -17.480 -1.804 680 2HB GLU 109 2HB GLU 109 -15.251 -19.147 -1.766 681 1HG GLU 109 1HG GLU 109 -15.549 -18.910 0.416 682 2HG GLU 109 2HG GLU 109 -13.880 -18.358 0.336 683 HA PRO 110 HA PRO 110 -13.352 -17.416 -6.330 684 1HB PRO 110 1HB PRO 110 -15.046 -19.036 -7.722 685 2HB PRO 110 2HB PRO 110 -13.557 -19.537 -6.885 686 1HG PRO 110 1HG PRO 110 -16.350 -19.753 -5.811 687 2HG PRO 110 2HG PRO 110 -15.116 -21.050 -5.935 688 1HD PRO 110 1HD PRO 110 -15.459 -19.673 -3.694 689 2HD PRO 110 2HD PRO 110 -13.796 -20.058 -4.206 690 H GLY 111 H GLY 111 -13.953 -15.303 -6.528 691 1HA GLY 111 1HA GLY 111 -15.199 -14.070 -8.236 692 2HA GLY 111 2HA GLY 111 -16.702 -14.771 -7.611 693 H GLU 112 H GLU 112 -15.054 -14.415 -4.860 694 HA GLU 112 HA GLU 112 -16.770 -12.240 -4.266 695 1HB GLU 112 1HB GLU 112 -14.993 -13.925 -2.484 696 2HB GLU 112 2HB GLU 112 -16.314 -12.866 -1.974 697 1HG GLU 112 1HG GLU 112 -16.651 -15.288 -3.686 698 2HG GLU 112 2HG GLU 112 -17.055 -15.102 -2.000 699 H GLU 113 H GLU 113 -15.757 -10.730 -2.299 700 HA GLU 113 HA GLU 113 -14.232 -8.929 -4.095 701 1HB GLU 113 1HB GLU 113 -16.612 -8.593 -4.001 702 2HB GLU 113 2HB GLU 113 -16.607 -8.583 -2.236 703 1HG GLU 113 1HG GLU 113 -14.955 -6.541 -3.564 704 2HG GLU 113 2HG GLU 113 -16.714 -6.414 -3.739 705 H MET 114 H MET 114 -12.690 -7.503 -3.361 706 HA MET 114 HA MET 114 -12.411 -6.948 -0.488 707 1HB MET 114 1HB MET 114 -10.431 -8.288 -2.328 708 2HB MET 114 2HB MET 114 -9.757 -7.002 -1.332 709 1HG MET 114 1HG MET 114 -11.423 -9.067 0.059 710 2HG MET 114 2HG MET 114 -9.801 -9.474 -0.506 711 1HE MET 114 1HE MET 114 -11.858 -7.135 1.892 712 2HE MET 114 2HE MET 114 -10.550 -6.223 2.682 713 3HE MET 114 3HE MET 114 -10.916 -5.930 0.970 714 H GLU 115 H GLU 115 -13.601 -4.990 -1.256 715 HA GLU 115 HA GLU 115 -11.822 -2.997 -2.629 716 1HB GLU 115 1HB GLU 115 -14.716 -2.635 -1.794 717 2HB GLU 115 2HB GLU 115 -13.713 -1.603 -2.823 718 1HG GLU 115 1HG GLU 115 -13.490 -3.802 -4.299 719 2HG GLU 115 2HG GLU 115 -14.900 -4.318 -3.383 720 H MET 116 H MET 116 -10.213 -2.577 -0.954 721 HA MET 116 HA MET 116 -11.264 -2.134 1.743 722 1HB MET 116 1HB MET 116 -9.763 -3.904 1.625 723 2HB MET 116 2HB MET 116 -8.623 -3.035 0.574 724 1HG MET 116 1HG MET 116 -7.934 -1.619 2.242 725 2HG MET 116 2HG MET 116 -9.380 -1.900 3.233 726 1HE MET 116 1HE MET 116 -6.531 -1.687 4.492 727 2HE MET 116 2HE MET 116 -8.013 -2.001 5.428 728 3HE MET 116 3HE MET 116 -6.581 -3.036 5.658 729 HA PRO 117 HA PRO 117 -10.037 2.223 0.989 730 1HB PRO 117 1HB PRO 117 -10.835 3.263 3.376 731 2HB PRO 117 2HB PRO 117 -11.895 2.992 1.968 732 1HG PRO 117 1HG PRO 117 -11.622 1.304 4.437 733 2HG PRO 117 2HG PRO 117 -13.072 1.696 3.454 734 1HD PRO 117 1HD PRO 117 -11.639 -0.677 3.318 735 2HD PRO 117 2HD PRO 117 -12.675 -0.058 1.998 736 H VAL 118 H VAL 118 -8.289 3.514 1.862 737 HA VAL 118 HA VAL 118 -6.676 2.431 4.075 738 HB VAL 118 HB VAL 118 -5.720 2.688 1.189 739 1HG1 VAL 118 1HG1 VAL 118 -3.435 2.231 2.030 740 2HG1 VAL 118 2HG1 VAL 118 -4.045 3.805 2.515 741 3HG1 VAL 118 3HG1 VAL 118 -4.033 2.481 3.691 742 1HG2 VAL 118 1HG2 VAL 118 -5.727 0.359 3.131 743 2HG2 VAL 118 2HG2 VAL 118 -6.586 0.499 1.585 744 3HG2 VAL 118 3HG2 VAL 118 -4.827 0.378 1.599 745 H VAL 119 H VAL 119 -5.788 4.163 5.165 746 HA VAL 119 HA VAL 119 -5.875 6.839 3.881 747 HB VAL 119 HB VAL 119 -7.125 6.673 5.989 748 1HG1 VAL 119 1HG1 VAL 119 -5.992 6.378 8.130 749 2HG1 VAL 119 2HG1 VAL 119 -5.809 4.917 7.154 750 3HG1 VAL 119 3HG1 VAL 119 -4.450 6.051 7.320 751 1HG2 VAL 119 1HG2 VAL 119 -6.164 8.623 7.064 752 2HG2 VAL 119 2HG2 VAL 119 -4.609 8.363 6.252 753 3HG2 VAL 119 3HG2 VAL 119 -6.050 8.795 5.304 754 H PHE 120 H PHE 120 -3.861 8.007 3.779 755 HA PHE 120 HA PHE 120 -1.471 6.703 4.863 756 1HB PHE 120 1HB PHE 120 -1.916 5.641 2.589 757 2HB PHE 120 2HB PHE 120 -1.769 7.245 1.868 758 HD1 PHE 120 HD1 PHE 120 0.007 4.969 4.239 759 HD2 PHE 120 HD2 PHE 120 0.445 7.998 1.230 760 HE1 PHE 120 HE1 PHE 120 2.459 4.880 4.500 761 HE2 PHE 120 HE2 PHE 120 2.919 7.816 1.431 762 HZ PHE 120 HZ PHE 120 3.908 6.268 3.066 763 H PHE 121 H PHE 121 0.445 7.955 4.741 764 HA PHE 121 HA PHE 121 0.674 10.528 3.660 765 1HB PHE 121 1HB PHE 121 0.633 11.917 5.644 766 2HB PHE 121 2HB PHE 121 -0.920 11.156 5.458 767 HD1 PHE 121 HD1 PHE 121 -1.461 9.056 6.830 768 HD2 PHE 121 HD2 PHE 121 2.016 11.456 7.621 769 HE1 PHE 121 HE1 PHE 121 -1.565 8.400 9.218 770 HE2 PHE 121 HE2 PHE 121 2.006 10.673 9.974 771 HZ PHE 121 HZ PHE 121 0.203 9.179 10.764 772 H VAL 122 H VAL 122 2.712 11.601 4.865 773 HA VAL 122 HA VAL 122 4.582 9.496 5.843 774 HB VAL 122 HB VAL 122 5.152 11.639 3.747 775 1HG1 VAL 122 1HG1 VAL 122 7.124 11.360 5.080 776 2HG1 VAL 122 2HG1 VAL 122 6.953 9.598 5.109 777 3HG1 VAL 122 3HG1 VAL 122 7.381 10.441 3.598 778 1HG2 VAL 122 1HG2 VAL 122 4.766 8.627 3.572 779 2HG2 VAL 122 2HG2 VAL 122 3.907 9.896 2.680 780 3HG2 VAL 122 3HG2 VAL 122 5.598 9.562 2.315 781 H ASP 123 H ASP 123 5.854 10.167 7.526 782 HA ASP 123 HA ASP 123 5.134 12.748 8.726 783 1HB ASP 123 1HB ASP 123 6.924 10.479 9.698 784 2HB ASP 123 2HB ASP 123 6.768 12.020 10.548 785 HA PRO 124 HA PRO 124 8.553 15.162 7.210 786 1HB PRO 124 1HB PRO 124 9.115 16.743 9.469 787 2HB PRO 124 2HB PRO 124 7.858 17.047 8.266 788 1HG PRO 124 1HG PRO 124 7.582 15.710 10.945 789 2HG PRO 124 2HG PRO 124 6.480 16.886 10.155 790 1HD PRO 124 1HD PRO 124 5.941 14.247 10.182 791 2HD PRO 124 2HD PRO 124 5.566 15.229 8.750 792 H GLU 125 H GLU 125 8.913 13.335 10.202 793 HA GLU 125 HA GLU 125 11.498 13.418 10.906 794 1HB GLU 125 1HB GLU 125 9.935 10.892 10.511 795 2HB GLU 125 2HB GLU 125 11.333 11.132 11.575 796 1HG GLU 125 1HG GLU 125 8.562 12.295 11.866 797 2HG GLU 125 2HG GLU 125 9.442 11.213 12.942 798 H ILE 126 H ILE 126 10.294 12.023 7.864 799 HA ILE 126 HA ILE 126 12.534 10.561 7.078 800 HB ILE 126 HB ILE 126 10.312 10.693 5.989 801 1HG1 ILE 126 1HG1 ILE 126 12.671 10.990 4.071 802 2HG1 ILE 126 2HG1 ILE 126 12.369 9.558 5.067 803 1HG2 ILE 126 1HG2 ILE 126 9.805 12.334 4.324 804 2HG2 ILE 126 2HG2 ILE 126 10.316 13.259 5.739 805 3HG2 ILE 126 3HG2 ILE 126 11.442 13.004 4.376 806 1HD1 ILE 126 1HD1 ILE 126 11.369 9.136 2.932 807 2HD1 ILE 126 2HD1 ILE 126 10.078 9.401 4.115 808 3HD1 ILE 126 3HD1 ILE 126 10.508 10.680 2.948 809 H VAL 127 H VAL 127 12.101 14.146 6.874 810 HA VAL 127 HA VAL 127 14.829 14.360 5.677 811 HB VAL 127 HB VAL 127 14.351 16.795 5.619 812 1HG1 VAL 127 1HG1 VAL 127 12.457 15.019 4.043 813 2HG1 VAL 127 2HG1 VAL 127 12.971 16.661 3.619 814 3HG1 VAL 127 3HG1 VAL 127 14.157 15.346 3.647 815 1HG2 VAL 127 1HG2 VAL 127 11.437 16.037 6.071 816 2HG2 VAL 127 2HG2 VAL 127 12.452 16.808 7.314 817 3HG2 VAL 127 3HG2 VAL 127 12.118 17.643 5.790 818 H LYS 128 H LYS 128 15.135 13.145 7.907 819 HA LYS 128 HA LYS 128 16.563 15.199 9.524 820 1HB LYS 128 1HB LYS 128 14.935 12.982 10.799 821 2HB LYS 128 2HB LYS 128 16.089 14.048 11.618 822 1HG LYS 128 1HG LYS 128 14.731 16.024 10.795 823 2HG LYS 128 2HG LYS 128 13.554 14.865 10.145 824 1HD LYS 128 1HD LYS 128 13.313 13.888 12.440 825 2HD LYS 128 2HD LYS 128 14.368 15.167 13.076 826 1HE LYS 128 1HE LYS 128 12.746 16.905 12.343 827 2HE LYS 128 2HE LYS 128 11.779 15.667 11.528 828 1HZ LYS 128 1HZ LYS 128 10.639 15.602 13.360 829 2HZ LYS 128 2HZ LYS 128 11.747 14.637 13.885 830 3HZ LYS 128 3HZ LYS 128 11.833 16.232 14.369 831 HA PRO 129 HA PRO 129 19.350 11.416 10.008 832 1HB PRO 129 1HB PRO 129 18.769 9.035 8.704 833 2HB PRO 129 2HB PRO 129 18.303 9.412 10.384 834 1HG PRO 129 1HG PRO 129 16.659 9.710 7.865 835 2HG PRO 129 2HG PRO 129 16.170 8.961 9.402 836 1HD PRO 129 1HD PRO 129 15.429 11.439 8.859 837 2HD PRO 129 2HD PRO 129 16.005 11.031 10.498 838 H VAL 130 H VAL 130 20.981 10.288 8.380 839 HA VAL 130 HA VAL 130 21.363 12.334 6.293 840 HB VAL 130 HB VAL 130 23.083 10.079 7.422 841 1HG1 VAL 130 1HG1 VAL 130 24.930 11.174 6.180 842 2HG1 VAL 130 2HG1 VAL 130 23.709 10.475 5.110 843 3HG1 VAL 130 3HG1 VAL 130 23.743 12.234 5.383 844 1HG2 VAL 130 1HG2 VAL 130 24.395 11.937 8.403 845 2HG2 VAL 130 2HG2 VAL 130 23.220 13.109 7.771 846 3HG2 VAL 130 3HG2 VAL 130 22.738 11.940 9.019 847 H GLU 131 H GLU 131 21.033 8.912 6.809 848 HA GLU 131 HA GLU 131 21.242 7.568 4.467 849 1HB GLU 131 1HB GLU 131 19.015 7.205 6.483 850 2HB GLU 131 2HB GLU 131 19.704 6.009 5.372 851 1HG GLU 131 1HG GLU 131 21.012 5.493 7.121 852 2HG GLU 131 2HG GLU 131 22.012 6.823 6.606 853 H THR 132 H THR 132 18.353 9.478 5.383 854 HA THR 132 HA THR 132 17.156 8.861 2.795 855 HB THR 132 HB THR 132 15.306 10.365 3.908 856 HG1 THR 132 HG1 THR 132 15.738 10.985 5.981 857 1HG2 THR 132 1HG2 THR 132 16.236 7.905 5.459 858 2HG2 THR 132 2HG2 THR 132 14.668 8.710 5.636 859 3HG2 THR 132 3HG2 THR 132 15.087 7.939 4.100 860 H GLN 133 H GLN 133 17.884 11.719 4.710 861 HA GLN 133 HA GLN 133 17.386 13.876 3.843 862 1HB GLN 133 1HB GLN 133 19.688 13.205 5.008 863 2HB GLN 133 2HB GLN 133 20.387 13.699 3.499 864 1HG GLN 133 1HG GLN 133 20.360 15.554 5.094 865 2HG GLN 133 2HG GLN 133 19.315 15.930 3.717 866 1HE2 GLN 133 1HE2 GLN 133 18.555 13.776 6.551 867 2HE2 GLN 133 2HE2 GLN 133 17.283 14.787 7.155 868 H GLY 134 H GLY 134 16.229 13.708 1.914 869 1HA GLY 134 1HA GLY 134 16.603 15.046 -0.307 870 2HA GLY 134 2HA GLY 134 17.742 13.726 -0.653 871 H ILE 135 H ILE 135 16.492 11.582 0.563 872 HA ILE 135 HA ILE 135 14.474 10.743 -1.220 873 HB ILE 135 HB ILE 135 15.288 9.855 1.546 874 1HG1 ILE 135 1HG1 ILE 135 16.786 9.249 -0.354 875 2HG1 ILE 135 2HG1 ILE 135 15.981 7.829 0.340 876 1HG2 ILE 135 1HG2 ILE 135 13.814 7.820 1.183 877 2HG2 ILE 135 2HG2 ILE 135 13.041 9.322 1.658 878 3HG2 ILE 135 3HG2 ILE 135 12.930 8.787 -0.024 879 1HD1 ILE 135 1HD1 ILE 135 15.173 9.148 -2.270 880 2HD1 ILE 135 2HD1 ILE 135 15.974 7.587 -2.010 881 3HD1 ILE 135 3HD1 ILE 135 14.313 7.827 -1.448 882 H LYS 136 H LYS 136 12.599 11.520 -1.563 883 HA LYS 136 HA LYS 136 10.725 11.586 0.611 884 1HB LYS 136 1HB LYS 136 9.932 13.836 0.331 885 2HB LYS 136 2HB LYS 136 11.617 13.869 0.796 886 1HG LYS 136 1HG LYS 136 12.275 14.892 -1.067 887 2HG LYS 136 2HG LYS 136 11.440 13.764 -2.113 888 1HD LYS 136 1HD LYS 136 9.235 14.901 -1.513 889 2HD LYS 136 2HD LYS 136 10.138 16.078 -0.548 890 1HE LYS 136 1HE LYS 136 11.198 16.903 -2.652 891 2HE LYS 136 2HE LYS 136 10.204 15.761 -3.585 892 1HZ LYS 136 1HZ LYS 136 9.189 17.893 -1.810 893 2HZ LYS 136 2HZ LYS 136 9.215 18.025 -3.420 894 3HZ LYS 136 3HZ LYS 136 8.208 16.953 -2.683 895 H THR 137 H THR 137 10.817 9.706 -1.228 896 HA THR 137 HA THR 137 8.271 10.218 -2.418 897 HB THR 137 HB THR 137 9.690 8.666 -4.429 898 HG1 THR 137 HG1 THR 137 10.478 11.375 -3.967 899 1HG2 THR 137 1HG2 THR 137 7.482 9.631 -4.696 900 2HG2 THR 137 2HG2 THR 137 8.177 11.266 -4.561 901 3HG2 THR 137 3HG2 THR 137 8.608 10.225 -5.938 902 H LEU 138 H LEU 138 7.376 8.981 -0.946 903 HA LEU 138 HA LEU 138 8.659 6.447 -0.275 904 1HB LEU 138 1HB LEU 138 6.713 8.189 0.940 905 2HB LEU 138 2HB LEU 138 6.034 6.561 0.828 906 HG LEU 138 HG LEU 138 8.109 5.723 1.863 907 1HD1 LEU 138 1HD1 LEU 138 9.552 7.310 3.102 908 2HD1 LEU 138 2HD1 LEU 138 9.803 7.370 1.355 909 3HD1 LEU 138 3HD1 LEU 138 8.846 8.643 2.153 910 1HD2 LEU 138 1HD2 LEU 138 6.932 7.915 3.616 911 2HD2 LEU 138 2HD2 LEU 138 6.055 6.448 3.219 912 3HD2 LEU 138 3HD2 LEU 138 7.566 6.364 4.143 913 H THR 139 H THR 139 8.126 4.462 -0.939 914 HA THR 139 HA THR 139 5.791 4.088 -2.627 915 HB THR 139 HB THR 139 7.535 4.552 -4.266 916 HG1 THR 139 HG1 THR 139 6.158 2.915 -4.848 917 1HG2 THR 139 1HG2 THR 139 9.487 4.065 -2.901 918 2HG2 THR 139 2HG2 THR 139 9.089 2.322 -2.930 919 3HG2 THR 139 3HG2 THR 139 9.532 3.159 -4.433 920 H LEU 140 H LEU 140 5.161 1.978 -2.667 921 HA LEU 140 HA LEU 140 6.392 0.119 -0.740 922 1HB LEU 140 1HB LEU 140 4.518 0.681 0.486 923 2HB LEU 140 2HB LEU 140 3.562 1.130 -0.930 924 HG LEU 140 HG LEU 140 2.952 -1.102 -1.426 925 1HD1 LEU 140 1HD1 LEU 140 4.978 -2.398 -0.979 926 2HD1 LEU 140 2HD1 LEU 140 4.897 -1.996 0.734 927 3HD1 LEU 140 3HD1 LEU 140 3.642 -3.013 -0.014 928 1HD2 LEU 140 1HD2 LEU 140 2.809 -0.583 1.572 929 2HD2 LEU 140 2HD2 LEU 140 1.706 0.057 0.336 930 3HD2 LEU 140 3HD2 LEU 140 1.761 -1.682 0.662 931 H SER 141 H SER 141 7.293 -1.242 -2.330 932 HA SER 141 HA SER 141 5.822 -1.721 -4.865 933 1HB SER 141 1HB SER 141 8.345 -1.541 -4.799 934 2HB SER 141 2HB SER 141 8.331 -3.142 -4.031 935 HG SER 141 HG SER 141 7.195 -2.436 -6.552 936 H TYR 142 H TYR 142 3.947 -2.632 -4.292 937 HA TYR 142 HA TYR 142 3.925 -4.976 -2.501 938 1HB TYR 142 1HB TYR 142 2.007 -3.012 -3.124 939 2HB TYR 142 2HB TYR 142 1.416 -4.452 -3.938 940 HD1 TYR 142 HD1 TYR 142 0.546 -2.738 -1.299 941 HD2 TYR 142 HD2 TYR 142 2.214 -6.637 -2.057 942 HE1 TYR 142 HE1 TYR 142 -0.157 -3.484 0.950 943 HE2 TYR 142 HE2 TYR 142 1.604 -7.337 0.247 944 HH TYR 142 HH TYR 142 0.587 -6.730 2.282 945 H THR 143 H THR 143 4.352 -6.959 -3.395 946 HA THR 143 HA THR 143 3.861 -7.350 -6.311 947 HB THR 143 HB THR 143 5.970 -9.054 -5.606 948 HG1 THR 143 HG1 THR 143 6.402 -6.425 -4.612 949 1HG2 THR 143 1HG2 THR 143 7.234 -7.665 -7.169 950 2HG2 THR 143 2HG2 THR 143 5.574 -7.860 -7.769 951 3HG2 THR 143 3HG2 THR 143 6.066 -6.341 -6.993 952 H PHE 144 H PHE 144 2.187 -8.514 -6.539 953 HA PHE 144 HA PHE 144 1.132 -10.179 -4.480 954 1HB PHE 144 1HB PHE 144 0.362 -9.335 -7.257 955 2HB PHE 144 2HB PHE 144 -0.536 -10.553 -6.416 956 HD1 PHE 144 HD1 PHE 144 0.914 -7.552 -4.646 957 HD2 PHE 144 HD2 PHE 144 -2.659 -9.390 -6.270 958 HE1 PHE 144 HE1 PHE 144 -0.488 -6.300 -3.055 959 HE2 PHE 144 HE2 PHE 144 -4.016 -8.116 -4.657 960 HZ PHE 144 HZ PHE 144 -2.941 -6.625 -3.026 961 H TYR 145 H TYR 145 2.882 -11.730 -4.237 962 HA TYR 145 HA TYR 145 2.439 -14.120 -6.019 963 1HB TYR 145 1HB TYR 145 5.023 -13.149 -4.784 964 2HB TYR 145 2HB TYR 145 4.798 -14.717 -5.554 965 HD1 TYR 145 HD1 TYR 145 4.520 -14.950 -7.957 966 HD2 TYR 145 HD2 TYR 145 4.828 -11.083 -6.147 967 HE1 TYR 145 HE1 TYR 145 5.111 -13.976 -10.177 968 HE2 TYR 145 HE2 TYR 145 5.417 -10.082 -8.369 969 HH TYR 145 HH TYR 145 5.805 -10.499 -10.605 970 HA PRO 146 HA PRO 146 1.804 -16.155 -2.015 971 1HB PRO 146 1HB PRO 146 -0.848 -16.333 -1.789 972 2HB PRO 146 2HB PRO 146 -0.055 -14.777 -1.517 973 1HG PRO 146 1HG PRO 146 -1.480 -15.569 -4.057 974 2HG PRO 146 2HG PRO 146 -1.536 -14.095 -3.064 975 1HD PRO 146 1HD PRO 146 0.152 -14.496 -5.313 976 2HD PRO 146 2HD PRO 146 0.383 -13.268 -4.040 977 H ARG 147 H ARG 147 -1.065 -17.349 -3.468 978 HA ARG 147 HA ARG 147 0.267 -19.612 -4.829 979 1HB ARG 147 1HB ARG 147 -1.762 -19.699 -2.555 980 2HB ARG 147 2HB ARG 147 -1.425 -21.072 -3.602 981 1HG ARG 147 1HG ARG 147 0.665 -19.701 -1.837 982 2HG ARG 147 2HG ARG 147 -0.283 -21.129 -1.391 983 1HD ARG 147 1HD ARG 147 0.587 -22.268 -3.476 984 2HD ARG 147 2HD ARG 147 1.741 -20.917 -3.657 985 HE ARG 147 HE ARG 147 2.107 -21.725 -1.063 986 1HH1 ARG 147 1HH1 ARG 147 2.302 -23.317 -4.200 987 2HH1 ARG 147 2HH1 ARG 147 3.360 -24.593 -3.683 988 1HH2 ARG 147 1HH2 ARG 147 3.534 -23.396 -0.327 989 2HH2 ARG 147 2HH2 ARG 147 4.104 -24.609 -1.424 990 H GLU 148 H GLU 148 -0.553 -19.410 -6.789 991 HA GLU 148 HA GLU 148 -3.364 -18.645 -7.266 992 1HB GLU 148 1HB GLU 148 -1.560 -17.786 -8.778 993 2HB GLU 148 2HB GLU 148 -1.269 -19.444 -9.314 994 1HG GLU 148 1HG GLU 148 -3.825 -19.472 -9.883 995 2HG GLU 148 2HG GLU 148 -3.758 -17.729 -9.625 996 HA PRO 149 HA PRO 149 -4.051 -23.222 -7.663 997 1HB PRO 149 1HB PRO 149 -6.705 -23.292 -7.210 998 2HB PRO 149 2HB PRO 149 -5.556 -23.021 -5.873 999 1HG PRO 149 1HG PRO 149 -7.103 -20.901 -7.400 1000 2HG PRO 149 2HG PRO 149 -6.961 -21.108 -5.635 1001 1HD PRO 149 1HD PRO 149 -5.408 -19.407 -7.141 1002 2HD PRO 149 2HD PRO 149 -4.822 -20.164 -5.623 1003 H SER 150 H SER 150 -3.269 -22.101 -9.748 1004 HA SER 150 HA SER 150 -3.518 -21.327 -11.920 1005 1HB SER 150 1HB SER 150 -4.748 -24.107 -11.893 1006 2HB SER 150 2HB SER 150 -3.950 -23.326 -13.271 1007 HG SER 150 HG SER 150 -2.049 -23.197 -11.902 1008 H LYS 151 H LYS 151 -4.979 -19.582 -12.240 1009 HA LYS 151 HA LYS 151 -7.608 -19.866 -11.384 1010 1HB LYS 151 1HB LYS 151 -7.960 -17.556 -12.230 1011 2HB LYS 151 2HB LYS 151 -6.518 -17.805 -11.278 1012 1HG LYS 151 1HG LYS 151 -5.316 -16.778 -12.842 1013 2HG LYS 151 2HG LYS 151 -5.511 -18.177 -13.841 1014 1HD LYS 151 1HD LYS 151 -5.995 -16.049 -15.003 1015 2HD LYS 151 2HD LYS 151 -7.276 -17.239 -15.124 1016 1HE LYS 151 1HE LYS 151 -8.102 -14.891 -14.778 1017 2HE LYS 151 2HE LYS 151 -8.703 -16.073 -13.630 1018 1HZ LYS 151 1HZ LYS 151 -6.654 -15.245 -12.288 1019 2HZ LYS 151 2HZ LYS 151 -6.874 -13.855 -13.137 1020 3HZ LYS 151 3HZ LYS 151 -8.083 -14.488 -12.203 Start of MODEL 20 1 H VAL 21 H VAL 21 -0.373 9.921 13.870 2 HA VAL 21 HA VAL 21 -1.320 7.984 15.776 3 HB VAL 21 HB VAL 21 -1.744 10.017 17.039 4 1HG1 VAL 21 1HG1 VAL 21 -1.659 11.738 15.313 5 2HG1 VAL 21 2HG1 VAL 21 -3.142 11.101 14.578 6 3HG1 VAL 21 3HG1 VAL 21 -3.191 11.845 16.187 7 1HG2 VAL 21 1HG2 VAL 21 -4.438 9.305 15.852 8 2HG2 VAL 21 2HG2 VAL 21 -3.540 8.229 16.957 9 3HG2 VAL 21 3HG2 VAL 21 -4.043 9.845 17.483 10 H GLU 22 H GLU 22 -3.959 7.791 14.629 11 HA GLU 22 HA GLU 22 -3.314 7.678 11.752 12 1HB GLU 22 1HB GLU 22 -4.579 5.875 12.929 13 2HB GLU 22 2HB GLU 22 -5.997 6.937 12.885 14 1HG GLU 22 1HG GLU 22 -6.141 6.784 10.533 15 2HG GLU 22 2HG GLU 22 -4.419 6.521 10.304 16 H GLN 23 H GLN 23 -2.769 9.960 12.154 17 HA GLN 23 HA GLN 23 -4.215 11.714 10.650 18 1HB GLN 23 1HB GLN 23 -4.959 11.893 13.513 19 2HB GLN 23 2HB GLN 23 -4.070 13.299 13.017 20 1HG GLN 23 1HG GLN 23 -6.332 12.301 11.286 21 2HG GLN 23 2HG GLN 23 -6.604 13.373 12.677 22 1HE2 GLN 23 1HE2 GLN 23 -5.084 13.226 9.404 23 2HE2 GLN 23 2HE2 GLN 23 -4.446 14.870 9.503 24 H ALA 24 H ALA 24 -2.940 13.613 10.424 25 HA ALA 24 HA ALA 24 -0.911 14.052 12.419 26 1HB ALA 24 1HB ALA 24 0.150 12.972 10.220 27 2HB ALA 24 2HB ALA 24 -0.235 14.558 9.538 28 3HB ALA 24 3HB ALA 24 0.888 14.456 10.899 29 H SER 25 H SER 25 -1.337 16.117 13.049 30 HA SER 25 HA SER 25 -1.711 18.231 11.163 31 1HB SER 25 1HB SER 25 -4.095 17.625 12.988 32 2HB SER 25 2HB SER 25 -3.815 19.215 12.256 33 HG SER 25 HG SER 25 -4.199 16.789 10.869 34 H ASP 26 H ASP 26 0.175 17.398 12.904 35 HA ASP 26 HA ASP 26 0.107 19.278 15.210 36 1HB ASP 26 1HB ASP 26 1.810 16.766 15.030 37 2HB ASP 26 2HB ASP 26 1.205 17.620 16.438 38 H LEU 27 H LEU 27 2.320 17.444 13.091 39 HA LEU 27 HA LEU 27 3.964 19.882 12.578 40 1HB LEU 27 1HB LEU 27 4.888 16.989 12.657 41 2HB LEU 27 2HB LEU 27 5.895 18.431 12.539 42 HG LEU 27 HG LEU 27 4.191 17.707 14.983 43 1HD1 LEU 27 1HD1 LEU 27 7.151 17.311 14.473 44 2HD1 LEU 27 2HD1 LEU 27 6.300 17.045 16.016 45 3HD1 LEU 27 3HD1 LEU 27 5.899 16.050 14.604 46 1HD2 LEU 27 1HD2 LEU 27 5.574 19.411 16.112 47 2HD2 LEU 27 2HD2 LEU 27 6.387 19.790 14.576 48 3HD2 LEU 27 3HD2 LEU 27 4.655 20.128 14.783 49 H ILE 28 H ILE 28 1.625 19.187 10.953 50 HA ILE 28 HA ILE 28 2.850 18.217 8.444 51 HB ILE 28 HB ILE 28 0.188 19.529 9.113 52 1HG1 ILE 28 1HG1 ILE 28 0.987 16.872 7.806 53 2HG1 ILE 28 2HG1 ILE 28 0.612 17.089 9.507 54 1HG2 ILE 28 1HG2 ILE 28 0.911 20.474 6.949 55 2HG2 ILE 28 2HG2 ILE 28 1.467 18.855 6.456 56 3HG2 ILE 28 3HG2 ILE 28 -0.266 19.211 6.637 57 1HD1 ILE 28 1HD1 ILE 28 -1.315 16.192 8.368 58 2HD1 ILE 28 2HD1 ILE 28 -1.668 17.838 8.941 59 3HD1 ILE 28 3HD1 ILE 28 -1.358 17.508 7.219 60 H LEU 29 H LEU 29 4.482 19.434 7.676 61 HA LEU 29 HA LEU 29 4.194 22.415 7.707 62 1HB LEU 29 1HB LEU 29 6.799 21.032 7.134 63 2HB LEU 29 2HB LEU 29 6.443 22.703 7.502 64 HG LEU 29 HG LEU 29 7.374 22.070 9.422 65 1HD1 LEU 29 1HD1 LEU 29 4.662 21.088 10.335 66 2HD1 LEU 29 2HD1 LEU 29 5.882 21.990 11.211 67 3HD1 LEU 29 3HD1 LEU 29 4.963 22.797 9.927 68 1HD2 LEU 29 1HD2 LEU 29 7.879 19.792 8.968 69 2HD2 LEU 29 2HD2 LEU 29 7.085 19.839 10.556 70 3HD2 LEU 29 3HD2 LEU 29 6.187 19.311 9.126 71 H ASP 30 H ASP 30 5.571 23.182 5.578 72 HA ASP 30 HA ASP 30 3.678 23.109 3.697 73 1HB ASP 30 1HB ASP 30 6.627 23.695 3.216 74 2HB ASP 30 2HB ASP 30 5.256 24.334 2.297 75 H GLU 31 H GLU 31 6.407 20.850 3.735 76 HA GLU 31 HA GLU 31 6.520 20.147 1.021 77 1HB GLU 31 1HB GLU 31 7.034 18.478 3.494 78 2HB GLU 31 2HB GLU 31 7.418 17.926 1.875 79 1HG GLU 31 1HG GLU 31 8.532 20.609 2.689 80 2HG GLU 31 2HG GLU 31 9.200 19.170 3.459 81 H LYS 32 H LYS 32 4.648 20.153 0.044 82 HA LYS 32 HA LYS 32 2.715 18.032 0.349 83 1HB LYS 32 1HB LYS 32 2.342 20.225 -0.822 84 2HB LYS 32 2HB LYS 32 3.550 19.738 -2.020 85 1HG LYS 32 1HG LYS 32 2.058 17.500 -2.041 86 2HG LYS 32 2HG LYS 32 0.861 18.542 -1.353 87 1HD LYS 32 1HD LYS 32 0.584 18.346 -3.723 88 2HD LYS 32 2HD LYS 32 0.934 20.019 -3.237 89 1HE LYS 32 1HE LYS 32 2.094 19.250 -5.379 90 2HE LYS 32 2HE LYS 32 3.184 19.910 -4.164 91 1HZ LYS 32 1HZ LYS 32 2.690 17.055 -4.706 92 2HZ LYS 32 2HZ LYS 32 4.057 17.874 -5.097 93 3HZ LYS 32 3HZ LYS 32 3.681 17.567 -3.524 94 H ILE 33 H ILE 33 3.935 16.189 0.627 95 HA ILE 33 HA ILE 33 6.099 15.534 -1.246 96 HB ILE 33 HB ILE 33 6.510 15.519 1.130 97 1HG1 ILE 33 1HG1 ILE 33 7.593 13.939 -0.591 98 2HG1 ILE 33 2HG1 ILE 33 7.871 13.698 1.154 99 1HG2 ILE 33 1HG2 ILE 33 5.604 13.663 2.544 100 2HG2 ILE 33 2HG2 ILE 33 4.453 14.939 2.123 101 3HG2 ILE 33 3HG2 ILE 33 4.397 13.368 1.291 102 1HD1 ILE 33 1HD1 ILE 33 6.315 11.881 1.221 103 2HD1 ILE 33 2HD1 ILE 33 5.868 12.110 -0.480 104 3HD1 ILE 33 3HD1 ILE 33 7.502 11.575 -0.040 105 H LYS 34 H LYS 34 5.961 14.059 -2.772 106 HA LYS 34 HA LYS 34 3.305 13.040 -3.505 107 1HB LYS 34 1HB LYS 34 4.737 14.387 -5.007 108 2HB LYS 34 2HB LYS 34 5.971 13.123 -4.975 109 1HG LYS 34 1HG LYS 34 3.111 12.741 -6.003 110 2HG LYS 34 2HG LYS 34 4.470 13.252 -6.999 111 1HD LYS 34 1HD LYS 34 5.614 11.026 -5.937 112 2HD LYS 34 2HD LYS 34 3.915 10.597 -5.731 113 1HE LYS 34 1HE LYS 34 4.478 9.664 -7.813 114 2HE LYS 34 2HE LYS 34 3.567 11.129 -8.202 115 1HZ LYS 34 1HZ LYS 34 5.666 12.233 -8.589 116 2HZ LYS 34 2HZ LYS 34 6.489 10.837 -8.258 117 3HZ LYS 34 3HZ LYS 34 5.480 10.916 -9.557 118 H VAL 35 H VAL 35 2.894 10.746 -3.505 119 HA VAL 35 HA VAL 35 5.111 8.953 -2.511 120 HB VAL 35 HB VAL 35 2.282 9.385 -1.602 121 1HG1 VAL 35 1HG1 VAL 35 2.069 7.100 -2.348 122 2HG1 VAL 35 2HG1 VAL 35 3.618 6.661 -1.615 123 3HG1 VAL 35 3HG1 VAL 35 2.236 7.096 -0.592 124 1HG2 VAL 35 1HG2 VAL 35 4.285 10.149 -0.293 125 2HG2 VAL 35 2HG2 VAL 35 3.132 9.109 0.560 126 3HG2 VAL 35 3HG2 VAL 35 4.664 8.425 -0.029 127 H THR 36 H THR 36 5.253 7.066 -3.622 128 HA THR 36 HA THR 36 3.633 6.830 -6.138 129 HB THR 36 HB THR 36 6.569 6.293 -5.525 130 HG1 THR 36 HG1 THR 36 5.833 8.471 -5.820 131 1HG2 THR 36 1HG2 THR 36 5.120 5.966 -8.172 132 2HG2 THR 36 2HG2 THR 36 6.880 5.883 -7.883 133 3HG2 THR 36 3HG2 THR 36 5.812 4.653 -7.179 134 H PHE 37 H PHE 37 2.194 5.375 -5.845 135 HA PHE 37 HA PHE 37 2.707 2.988 -4.189 136 1HB PHE 37 1HB PHE 37 0.329 3.873 -5.889 137 2HB PHE 37 2HB PHE 37 0.414 2.460 -4.865 138 HD1 PHE 37 HD1 PHE 37 1.937 4.047 -2.489 139 HD2 PHE 37 HD2 PHE 37 -1.664 4.692 -4.800 140 HE1 PHE 37 HE1 PHE 37 0.849 5.006 -0.524 141 HE2 PHE 37 HE2 PHE 37 -2.770 5.584 -2.791 142 HZ PHE 37 HZ PHE 37 -1.508 5.731 -0.624 143 H ASP 38 H ASP 38 2.895 0.961 -5.063 144 HA ASP 38 HA ASP 38 3.016 0.657 -8.011 145 1HB ASP 38 1HB ASP 38 5.232 1.446 -7.135 146 2HB ASP 38 2HB ASP 38 5.270 0.174 -5.992 147 H ALA 39 H ALA 39 1.110 -0.394 -7.886 148 HA ALA 39 HA ALA 39 0.705 -2.665 -6.098 149 1HB ALA 39 1HB ALA 39 -1.071 -1.042 -6.538 150 2HB ALA 39 2HB ALA 39 -1.016 -1.421 -8.274 151 3HB ALA 39 3HB ALA 39 -1.547 -2.650 -7.117 152 H ASN 40 H ASN 40 2.214 -4.262 -6.805 153 HA ASN 40 HA ASN 40 2.122 -5.114 -9.636 154 1HB ASN 40 1HB ASN 40 3.823 -6.248 -7.453 155 2HB ASN 40 2HB ASN 40 3.992 -6.475 -9.182 156 1HD2 ASN 40 1HD2 ASN 40 4.288 -4.080 -6.525 157 2HD2 ASN 40 2HD2 ASN 40 5.353 -2.988 -7.429 158 H VAL 41 H VAL 41 0.470 -6.308 -10.068 159 HA VAL 41 HA VAL 41 -0.477 -8.574 -8.425 160 HB VAL 41 HB VAL 41 -2.070 -7.237 -9.773 161 1HG1 VAL 41 1HG1 VAL 41 -0.648 -6.739 -11.754 162 2HG1 VAL 41 2HG1 VAL 41 -0.751 -8.446 -12.236 163 3HG1 VAL 41 3HG1 VAL 41 -2.210 -7.447 -12.179 164 1HG2 VAL 41 1HG2 VAL 41 -2.587 -9.568 -9.152 165 2HG2 VAL 41 2HG2 VAL 41 -3.296 -9.131 -10.714 166 3HG2 VAL 41 3HG2 VAL 41 -1.845 -10.144 -10.659 167 H ALA 42 H ALA 42 0.101 -10.801 -9.022 168 HA ALA 42 HA ALA 42 1.697 -11.242 -11.406 169 1HB ALA 42 1HB ALA 42 3.448 -10.426 -9.839 170 2HB ALA 42 2HB ALA 42 2.952 -11.655 -8.657 171 3HB ALA 42 3HB ALA 42 3.651 -12.146 -10.214 172 H ALA 43 H ALA 43 2.125 -13.520 -11.741 173 HA ALA 43 HA ALA 43 0.018 -15.287 -11.173 174 1HB ALA 43 1HB ALA 43 2.936 -15.910 -11.808 175 2HB ALA 43 2HB ALA 43 1.578 -17.051 -11.913 176 3HB ALA 43 3HB ALA 43 1.638 -15.646 -12.999 177 H GLY 44 H GLY 44 -0.380 -16.650 -9.516 178 1HA GLY 44 1HA GLY 44 0.364 -17.637 -7.301 179 2HA GLY 44 2HA GLY 44 1.175 -16.095 -6.999 180 H LEU 45 H LEU 45 -0.647 -14.234 -8.083 181 HA LEU 45 HA LEU 45 -3.143 -14.709 -6.543 182 1HB LEU 45 1HB LEU 45 -1.038 -13.057 -5.853 183 2HB LEU 45 2HB LEU 45 -2.190 -11.946 -6.593 184 HG LEU 45 HG LEU 45 -2.937 -13.947 -4.399 185 1HD1 LEU 45 1HD1 LEU 45 -1.261 -12.129 -3.684 186 2HD1 LEU 45 2HD1 LEU 45 -2.502 -10.954 -4.110 187 3HD1 LEU 45 3HD1 LEU 45 -2.833 -12.129 -2.851 188 1HD2 LEU 45 1HD2 LEU 45 -4.350 -11.502 -5.500 189 2HD2 LEU 45 2HD2 LEU 45 -4.808 -13.199 -5.816 190 3HD2 LEU 45 3HD2 LEU 45 -4.845 -12.565 -4.156 191 HA PRO 46 HA PRO 46 -4.213 -13.572 -10.853 192 1HB PRO 46 1HB PRO 46 -6.503 -15.014 -11.137 193 2HB PRO 46 2HB PRO 46 -4.904 -15.791 -11.070 194 1HG PRO 46 1HG PRO 46 -6.848 -15.418 -8.788 195 2HG PRO 46 2HG PRO 46 -6.054 -16.935 -9.304 196 1HD PRO 46 1HD PRO 46 -5.053 -15.386 -7.291 197 2HD PRO 46 2HD PRO 46 -3.962 -16.236 -8.424 198 H TRP 47 H TRP 47 -5.364 -12.270 -8.034 199 HA TRP 47 HA TRP 47 -7.999 -11.495 -8.822 200 1HB TRP 47 1HB TRP 47 -6.212 -10.322 -6.693 201 2HB TRP 47 2HB TRP 47 -7.959 -10.099 -6.868 202 HD1 TRP 47 HD1 TRP 47 -7.797 -13.531 -7.649 203 HE1 TRP 47 HE1 TRP 47 -8.173 -15.044 -5.687 204 HE3 TRP 47 HE3 TRP 47 -6.759 -10.208 -3.887 205 HZ2 TRP 47 HZ2 TRP 47 -7.972 -14.897 -2.751 206 HZ3 TRP 47 HZ3 TRP 47 -6.510 -11.084 -1.601 207 HH2 TRP 47 HH2 TRP 47 -7.131 -13.363 -1.000 208 H GLU 48 H GLU 48 -8.826 -9.609 -9.440 209 HA GLU 48 HA GLU 48 -7.290 -8.013 -11.340 210 1HB GLU 48 1HB GLU 48 -9.546 -8.870 -11.733 211 2HB GLU 48 2HB GLU 48 -10.158 -8.034 -10.308 212 1HG GLU 48 1HG GLU 48 -9.841 -5.858 -11.374 213 2HG GLU 48 2HG GLU 48 -9.170 -6.647 -12.817 214 H PHE 49 H PHE 49 -5.808 -7.284 -9.799 215 HA PHE 49 HA PHE 49 -6.561 -5.635 -7.517 216 1HB PHE 49 1HB PHE 49 -4.833 -7.347 -7.377 217 2HB PHE 49 2HB PHE 49 -3.939 -6.580 -8.680 218 HD1 PHE 49 HD1 PHE 49 -5.476 -4.737 -5.765 219 HD2 PHE 49 HD2 PHE 49 -1.870 -6.365 -7.506 220 HE1 PHE 49 HE1 PHE 49 -4.115 -3.598 -4.052 221 HE2 PHE 49 HE2 PHE 49 -0.534 -5.258 -5.759 222 HZ PHE 49 HZ PHE 49 -1.646 -3.806 -4.074 223 H VAL 50 H VAL 50 -7.418 -3.705 -8.406 224 HA VAL 50 HA VAL 50 -5.808 -2.358 -10.485 225 HB VAL 50 HB VAL 50 -7.602 -0.878 -10.839 226 1HG1 VAL 50 1HG1 VAL 50 -7.755 -3.220 -11.751 227 2HG1 VAL 50 2HG1 VAL 50 -8.789 -3.649 -10.368 228 3HG1 VAL 50 3HG1 VAL 50 -9.326 -2.428 -11.532 229 1HG2 VAL 50 1HG2 VAL 50 -8.453 -0.314 -8.677 230 2HG2 VAL 50 2HG2 VAL 50 -9.768 -1.158 -9.511 231 3HG2 VAL 50 3HG2 VAL 50 -8.782 -2.020 -8.307 232 HA PRO 51 HA PRO 51 -4.186 0.469 -7.257 233 1HB PRO 51 1HB PRO 51 -2.805 2.189 -8.860 234 2HB PRO 51 2HB PRO 51 -2.175 0.574 -8.441 235 1HG PRO 51 1HG PRO 51 -3.636 1.402 -10.958 236 2HG PRO 51 2HG PRO 51 -2.137 0.437 -10.834 237 1HD PRO 51 1HD PRO 51 -4.619 -0.660 -11.167 238 2HD PRO 51 2HD PRO 51 -3.353 -1.504 -10.225 239 H VAL 52 H VAL 52 -4.961 2.534 -6.683 240 HA VAL 52 HA VAL 52 -7.394 3.380 -8.053 241 HB VAL 52 HB VAL 52 -6.821 5.298 -6.087 242 1HG1 VAL 52 1HG1 VAL 52 -9.006 4.460 -6.669 243 2HG1 VAL 52 2HG1 VAL 52 -8.599 2.850 -6.040 244 3HG1 VAL 52 3HG1 VAL 52 -8.716 4.245 -4.937 245 1HG2 VAL 52 1HG2 VAL 52 -6.191 2.523 -5.041 246 2HG2 VAL 52 2HG2 VAL 52 -5.032 3.872 -5.158 247 3HG2 VAL 52 3HG2 VAL 52 -6.423 3.986 -4.064 248 H GLN 53 H GLN 53 -4.329 4.905 -7.098 249 HA GLN 53 HA GLN 53 -4.135 6.313 -9.674 250 1HB GLN 53 1HB GLN 53 -3.557 7.528 -6.941 251 2HB GLN 53 2HB GLN 53 -3.053 8.208 -8.473 252 1HG GLN 53 1HG GLN 53 -4.933 9.456 -7.942 253 2HG GLN 53 2HG GLN 53 -5.466 8.338 -9.203 254 1HE2 GLN 53 1HE2 GLN 53 -5.013 7.866 -5.622 255 2HE2 GLN 53 2HE2 GLN 53 -6.689 7.451 -5.356 256 H ARG 54 H ARG 54 -1.780 6.571 -10.166 257 HA ARG 54 HA ARG 54 -0.217 4.340 -9.172 258 1HB ARG 54 1HB ARG 54 -0.047 5.402 -11.500 259 2HB ARG 54 2HB ARG 54 0.796 6.749 -10.733 260 1HG ARG 54 1HG ARG 54 2.371 5.140 -11.718 261 2HG ARG 54 2HG ARG 54 2.583 5.166 -9.963 262 1HD ARG 54 1HD ARG 54 1.593 3.079 -9.724 263 2HD ARG 54 2HD ARG 54 0.809 3.201 -11.294 264 HE ARG 54 HE ARG 54 2.690 2.486 -12.404 265 1HH1 ARG 54 1HH1 ARG 54 3.582 2.841 -8.915 266 2HH1 ARG 54 2HH1 ARG 54 4.790 1.577 -9.114 267 1HH2 ARG 54 1HH2 ARG 54 4.315 0.727 -12.356 268 2HH2 ARG 54 2HH2 ARG 54 5.076 0.433 -10.790 269 H ASP 55 H ASP 55 -0.431 7.888 -8.518 270 HA ASP 55 HA ASP 55 1.312 7.557 -6.193 271 1HB ASP 55 1HB ASP 55 2.073 9.835 -6.832 272 2HB ASP 55 2HB ASP 55 2.386 8.670 -8.137 273 H ILE 56 H ILE 56 1.059 9.484 -4.756 274 HA ILE 56 HA ILE 56 -1.532 10.848 -4.807 275 HB ILE 56 HB ILE 56 -1.979 10.617 -2.442 276 1HG1 ILE 56 1HG1 ILE 56 0.303 8.653 -2.526 277 2HG1 ILE 56 2HG1 ILE 56 0.332 10.253 -1.747 278 1HG2 ILE 56 1HG2 ILE 56 -2.996 9.042 -4.104 279 2HG2 ILE 56 2HG2 ILE 56 -1.715 7.869 -3.699 280 3HG2 ILE 56 3HG2 ILE 56 -2.873 8.411 -2.457 281 1HD1 ILE 56 1HD1 ILE 56 -1.283 9.591 -0.094 282 2HD1 ILE 56 2HD1 ILE 56 -1.450 7.983 -0.818 283 3HD1 ILE 56 3HD1 ILE 56 0.084 8.470 -0.081 284 H ASP 57 H ASP 57 -1.390 12.634 -3.012 285 HA ASP 57 HA ASP 57 1.375 13.478 -2.463 286 1HB ASP 57 1HB ASP 57 -0.662 14.967 -4.025 287 2HB ASP 57 2HB ASP 57 -0.186 15.831 -2.563 288 H VAL 58 H VAL 58 1.637 13.963 -0.360 289 HA VAL 58 HA VAL 58 -0.763 14.421 1.412 290 HB VAL 58 HB VAL 58 0.254 13.267 3.192 291 1HG1 VAL 58 1HG1 VAL 58 -0.292 11.027 2.416 292 2HG1 VAL 58 2HG1 VAL 58 -1.376 12.193 1.645 293 3HG1 VAL 58 3HG1 VAL 58 -0.023 11.494 0.729 294 1HG2 VAL 58 1HG2 VAL 58 2.360 12.321 1.213 295 2HG2 VAL 58 2HG2 VAL 58 2.614 13.291 2.698 296 3HG2 VAL 58 3HG2 VAL 58 2.055 11.621 2.809 297 H ARG 59 H ARG 59 -0.514 16.402 2.516 298 HA ARG 59 HA ARG 59 2.082 17.844 2.404 299 1HB ARG 59 1HB ARG 59 -0.602 18.426 3.649 300 2HB ARG 59 2HB ARG 59 0.861 19.161 4.310 301 1HG ARG 59 1HG ARG 59 -0.031 20.695 2.725 302 2HG ARG 59 2HG ARG 59 1.524 20.075 2.168 303 1HD ARG 59 1HD ARG 59 0.094 20.027 0.243 304 2HD ARG 59 2HD ARG 59 0.283 18.382 0.771 305 HE ARG 59 HE ARG 59 -1.887 18.163 1.382 306 1HH1 ARG 59 1HH1 ARG 59 -1.234 21.579 0.886 307 2HH1 ARG 59 2HH1 ARG 59 -2.896 22.090 0.999 308 1HH2 ARG 59 1HH2 ARG 59 -4.058 18.778 1.656 309 2HH2 ARG 59 2HH2 ARG 59 -4.574 20.423 1.425 310 H ILE 60 H ILE 60 3.550 16.605 3.183 311 HA ILE 60 HA ILE 60 4.107 14.603 4.577 312 HB ILE 60 HB ILE 60 5.641 15.782 6.321 313 1HG1 ILE 60 1HG1 ILE 60 4.968 18.134 4.505 314 2HG1 ILE 60 2HG1 ILE 60 4.309 17.905 6.115 315 1HG2 ILE 60 1HG2 ILE 60 6.105 16.108 3.359 316 2HG2 ILE 60 2HG2 ILE 60 7.343 16.090 4.626 317 3HG2 ILE 60 3HG2 ILE 60 6.404 14.647 4.339 318 1HD1 ILE 60 1HD1 ILE 60 6.417 18.270 7.130 319 2HD1 ILE 60 2HD1 ILE 60 7.323 17.945 5.638 320 3HD1 ILE 60 3HD1 ILE 60 6.375 19.417 5.771 321 H GLY 61 H GLY 61 1.994 13.895 5.352 322 1HA GLY 61 1HA GLY 61 1.761 12.860 7.658 323 2HA GLY 61 2HA GLY 61 1.580 14.505 8.256 324 H GLU 62 H GLU 62 0.075 15.296 5.768 325 HA GLU 62 HA GLU 62 -2.564 15.081 6.475 326 1HB GLU 62 1HB GLU 62 -1.545 16.449 4.679 327 2HB GLU 62 2HB GLU 62 -1.378 14.979 3.698 328 1HG GLU 62 1HG GLU 62 -3.828 14.769 3.559 329 2HG GLU 62 2HG GLU 62 -4.017 16.192 4.612 330 H THR 63 H THR 63 -3.581 13.172 7.121 331 HA THR 63 HA THR 63 -3.224 10.587 5.945 332 HB THR 63 HB THR 63 -5.614 10.385 7.084 333 HG1 THR 63 HG1 THR 63 -5.862 12.649 7.191 334 1HG2 THR 63 1HG2 THR 63 -4.567 10.113 9.266 335 2HG2 THR 63 2HG2 THR 63 -3.630 9.393 7.981 336 3HG2 THR 63 3HG2 THR 63 -3.076 10.940 8.685 337 H VAL 64 H VAL 64 -3.707 10.172 3.854 338 HA VAL 64 HA VAL 64 -6.401 11.058 2.899 339 HB VAL 64 HB VAL 64 -4.754 12.097 1.546 340 1HG1 VAL 64 1HG1 VAL 64 -2.870 10.448 1.822 341 2HG1 VAL 64 2HG1 VAL 64 -3.740 9.320 0.767 342 3HG1 VAL 64 3HG1 VAL 64 -3.184 10.883 0.133 343 1HG2 VAL 64 1HG2 VAL 64 -5.511 11.428 -0.635 344 2HG2 VAL 64 2HG2 VAL 64 -6.038 9.850 -0.036 345 3HG2 VAL 64 3HG2 VAL 64 -6.863 11.332 0.504 346 H GLN 65 H GLN 65 -7.638 9.592 1.990 347 HA GLN 65 HA GLN 65 -7.192 6.728 2.667 348 1HB GLN 65 1HB GLN 65 -9.191 7.706 3.581 349 2HB GLN 65 2HB GLN 65 -9.708 8.342 2.022 350 1HG GLN 65 1HG GLN 65 -9.202 5.364 2.215 351 2HG GLN 65 2HG GLN 65 -10.568 6.008 3.111 352 1HE2 GLN 65 1HE2 GLN 65 -9.745 7.549 -0.058 353 2HE2 GLN 65 2HE2 GLN 65 -11.167 6.877 -0.824 354 H ILE 66 H ILE 66 -6.824 5.309 1.045 355 HA ILE 66 HA ILE 66 -7.632 5.943 -1.718 356 HB ILE 66 HB ILE 66 -5.070 4.994 -2.151 357 1HG1 ILE 66 1HG1 ILE 66 -3.588 6.689 -1.001 358 2HG1 ILE 66 2HG1 ILE 66 -4.862 7.040 0.130 359 1HG2 ILE 66 1HG2 ILE 66 -4.650 7.147 -3.087 360 2HG2 ILE 66 2HG2 ILE 66 -6.339 6.724 -3.362 361 3HG2 ILE 66 3HG2 ILE 66 -5.918 7.894 -2.085 362 1HD1 ILE 66 1HD1 ILE 66 -3.299 5.424 1.071 363 2HD1 ILE 66 2HD1 ILE 66 -4.844 4.615 0.819 364 3HD1 ILE 66 3HD1 ILE 66 -3.520 4.326 -0.313 365 H MET 67 H MET 67 -9.057 4.343 -1.717 366 HA MET 67 HA MET 67 -8.327 1.780 -0.550 367 1HB MET 67 1HB MET 67 -10.608 1.199 -0.664 368 2HB MET 67 2HB MET 67 -10.637 2.946 -0.412 369 1HG MET 67 1HG MET 67 -12.257 2.565 -1.960 370 2HG MET 67 2HG MET 67 -10.903 3.081 -2.987 371 1HE MET 67 1HE MET 67 -12.805 0.522 -5.275 372 2HE MET 67 2HE MET 67 -13.496 1.732 -4.169 373 3HE MET 67 3HE MET 67 -12.072 2.140 -5.163 374 H TYR 68 H TYR 68 -8.233 -0.226 -1.437 375 HA TYR 68 HA TYR 68 -7.504 -0.248 -4.357 376 1HB TYR 68 1HB TYR 68 -6.398 -1.819 -2.003 377 2HB TYR 68 2HB TYR 68 -6.177 -2.292 -3.682 378 HD1 TYR 68 HD1 TYR 68 -4.589 -1.211 -5.123 379 HD2 TYR 68 HD2 TYR 68 -5.449 0.449 -1.236 380 HE1 TYR 68 HE1 TYR 68 -2.567 0.215 -5.273 381 HE2 TYR 68 HE2 TYR 68 -3.440 1.883 -1.403 382 HH TYR 68 HH TYR 68 -1.600 2.508 -2.736 383 H ARG 69 H ARG 69 -8.353 -1.918 -5.562 384 HA ARG 69 HA ARG 69 -10.496 -3.560 -4.310 385 1HB ARG 69 1HB ARG 69 -11.326 -1.720 -5.744 386 2HB ARG 69 2HB ARG 69 -10.492 -2.446 -7.119 387 1HG ARG 69 1HG ARG 69 -11.827 -4.531 -6.846 388 2HG ARG 69 2HG ARG 69 -12.630 -3.804 -5.447 389 1HD ARG 69 1HD ARG 69 -13.048 -1.822 -7.274 390 2HD ARG 69 2HD ARG 69 -12.948 -3.177 -8.387 391 HE ARG 69 HE ARG 69 -14.916 -2.710 -6.140 392 1HH1 ARG 69 1HH1 ARG 69 -14.098 -4.925 -8.845 393 2HH1 ARG 69 2HH1 ARG 69 -15.703 -5.674 -8.658 394 1HH2 ARG 69 1HH2 ARG 69 -16.748 -3.759 -6.031 395 2HH2 ARG 69 2HH2 ARG 69 -17.205 -4.972 -7.271 396 H ALA 70 H ALA 70 -9.872 -5.673 -4.321 397 HA ALA 70 HA ALA 70 -8.383 -6.725 -6.702 398 1HB ALA 70 1HB ALA 70 -8.323 -7.885 -3.919 399 2HB ALA 70 2HB ALA 70 -7.441 -8.414 -5.360 400 3HB ALA 70 3HB ALA 70 -7.063 -6.847 -4.630 401 H LYS 71 H LYS 71 -9.922 -7.643 -8.046 402 HA LYS 71 HA LYS 71 -12.219 -9.080 -6.811 403 1HB LYS 71 1HB LYS 71 -13.240 -7.539 -7.940 404 2HB LYS 71 2HB LYS 71 -11.912 -7.214 -9.056 405 1HG LYS 71 1HG LYS 71 -12.466 -9.046 -10.442 406 2HG LYS 71 2HG LYS 71 -13.589 -9.706 -9.240 407 1HD LYS 71 1HD LYS 71 -15.177 -7.965 -9.541 408 2HD LYS 71 2HD LYS 71 -14.016 -6.907 -10.352 409 1HE LYS 71 1HE LYS 71 -14.999 -9.510 -11.605 410 2HE LYS 71 2HE LYS 71 -15.850 -7.965 -11.767 411 1HZ LYS 71 1HZ LYS 71 -13.104 -8.511 -12.747 412 2HZ LYS 71 2HZ LYS 71 -14.428 -8.084 -13.622 413 3HZ LYS 71 3HZ LYS 71 -13.642 -7.055 -12.582 414 H ASN 72 H ASN 72 -12.216 -11.198 -6.781 415 HA ASN 72 HA ASN 72 -9.887 -12.467 -7.803 416 1HB ASN 72 1HB ASN 72 -10.692 -12.993 -5.617 417 2HB ASN 72 2HB ASN 72 -12.262 -13.525 -6.255 418 1HD2 ASN 72 1HD2 ASN 72 -11.861 -15.635 -5.192 419 2HD2 ASN 72 2HD2 ASN 72 -10.575 -16.685 -5.777 420 H LEU 73 H LEU 73 -9.878 -12.596 -10.041 421 HA LEU 73 HA LEU 73 -11.857 -14.328 -11.402 422 1HB LEU 73 1HB LEU 73 -9.262 -13.096 -12.395 423 2HB LEU 73 2HB LEU 73 -10.489 -13.916 -13.371 424 HG LEU 73 HG LEU 73 -10.806 -11.267 -11.883 425 1HD1 LEU 73 1HD1 LEU 73 -10.990 -10.359 -14.181 426 2HD1 LEU 73 2HD1 LEU 73 -9.435 -11.164 -13.923 427 3HD1 LEU 73 3HD1 LEU 73 -10.716 -11.978 -14.848 428 1HD2 LEU 73 1HD2 LEU 73 -13.009 -11.131 -13.069 429 2HD2 LEU 73 2HD2 LEU 73 -12.825 -12.828 -13.558 430 3HD2 LEU 73 3HD2 LEU 73 -12.976 -12.395 -11.838 431 H ALA 74 H ALA 74 -11.387 -16.089 -9.771 432 HA ALA 74 HA ALA 74 -9.273 -17.877 -10.910 433 1HB ALA 74 1HB ALA 74 -10.079 -17.712 -7.982 434 2HB ALA 74 2HB ALA 74 -8.919 -18.848 -8.697 435 3HB ALA 74 3HB ALA 74 -8.546 -17.117 -8.665 436 H SER 75 H SER 75 -9.785 -20.228 -10.491 437 HA SER 75 HA SER 75 -12.581 -20.833 -11.112 438 1HB SER 75 1HB SER 75 -11.539 -23.219 -10.803 439 2HB SER 75 2HB SER 75 -11.038 -22.230 -12.168 440 HG SER 75 HG SER 75 -9.658 -22.554 -9.681 441 H THR 76 H THR 76 -10.484 -20.748 -8.289 442 HA THR 76 HA THR 76 -12.454 -22.077 -6.539 443 HB THR 76 HB THR 76 -10.082 -23.332 -5.925 444 HG1 THR 76 HG1 THR 76 -9.072 -23.890 -7.875 445 1HG2 THR 76 1HG2 THR 76 -12.245 -24.472 -6.428 446 2HG2 THR 76 2HG2 THR 76 -11.955 -24.235 -8.162 447 3HG2 THR 76 3HG2 THR 76 -10.877 -25.277 -7.214 448 HA PRO 77 HA PRO 77 -11.309 -19.214 -3.613 449 1HB PRO 77 1HB PRO 77 -10.736 -20.573 -1.249 450 2HB PRO 77 2HB PRO 77 -12.368 -20.285 -1.907 451 1HG PRO 77 1HG PRO 77 -10.635 -22.741 -2.260 452 2HG PRO 77 2HG PRO 77 -12.366 -22.675 -1.806 453 1HD PRO 77 1HD PRO 77 -11.660 -23.180 -4.337 454 2HD PRO 77 2HD PRO 77 -12.992 -22.036 -4.031 455 H THR 78 H THR 78 -9.599 -17.980 -3.662 456 HA THR 78 HA THR 78 -6.866 -19.060 -3.890 457 HB THR 78 HB THR 78 -6.818 -16.250 -4.002 458 HG1 THR 78 HG1 THR 78 -9.101 -16.108 -4.105 459 1HG2 THR 78 1HG2 THR 78 -7.179 -18.176 -6.279 460 2HG2 THR 78 2HG2 THR 78 -6.704 -16.465 -6.377 461 3HG2 THR 78 3HG2 THR 78 -5.634 -17.611 -5.544 462 H THR 79 H THR 79 -5.151 -17.465 -2.751 463 HA THR 79 HA THR 79 -6.052 -16.480 -0.219 464 HB THR 79 HB THR 79 -5.454 -18.745 0.409 465 HG1 THR 79 HG1 THR 79 -4.938 -16.893 1.740 466 1HG2 THR 79 1HG2 THR 79 -3.185 -19.582 0.210 467 2HG2 THR 79 2HG2 THR 79 -3.811 -19.235 -1.410 468 3HG2 THR 79 3HG2 THR 79 -2.663 -18.111 -0.644 469 H GLY 80 H GLY 80 -4.375 -15.093 0.717 470 1HA GLY 80 1HA GLY 80 -2.658 -13.749 -1.277 471 2HA GLY 80 2HA GLY 80 -3.958 -12.889 -0.434 472 H GLN 81 H GLN 81 -1.152 -12.358 -0.222 473 HA GLN 81 HA GLN 81 -1.046 -11.898 2.438 474 1HB GLN 81 1HB GLN 81 1.312 -13.241 2.843 475 2HB GLN 81 2HB GLN 81 -0.266 -13.618 3.486 476 1HG GLN 81 1HG GLN 81 0.484 -15.640 2.883 477 2HG GLN 81 2HG GLN 81 -0.595 -15.296 1.550 478 1HE2 GLN 81 1HE2 GLN 81 2.032 -13.422 0.750 479 2HE2 GLN 81 2HE2 GLN 81 2.831 -14.596 -0.276 480 H ALA 82 H ALA 82 0.816 -12.360 -0.492 481 HA ALA 82 HA ALA 82 2.296 -11.060 -1.569 482 1HB ALA 82 1HB ALA 82 1.008 -8.841 0.037 483 2HB ALA 82 2HB ALA 82 1.867 -8.623 -1.489 484 3HB ALA 82 3HB ALA 82 0.356 -9.529 -1.465 485 H THR 83 H THR 83 3.928 -9.136 -1.315 486 HA THR 83 HA THR 83 4.663 -8.736 1.488 487 HB THR 83 HB THR 83 6.613 -9.958 0.540 488 HG1 THR 83 HG1 THR 83 7.066 -8.565 2.146 489 1HG2 THR 83 1HG2 THR 83 8.083 -8.817 -1.069 490 2HG2 THR 83 2HG2 THR 83 6.521 -9.220 -1.801 491 3HG2 THR 83 3HG2 THR 83 6.879 -7.541 -1.311 492 H PHE 84 H PHE 84 5.562 -6.442 1.647 493 HA PHE 84 HA PHE 84 4.434 -4.609 -0.359 494 1HB PHE 84 1HB PHE 84 3.098 -3.400 1.281 495 2HB PHE 84 2HB PHE 84 2.495 -5.020 0.969 496 HD1 PHE 84 HD1 PHE 84 3.675 -2.728 3.493 497 HD2 PHE 84 HD2 PHE 84 2.943 -6.890 2.686 498 HE1 PHE 84 HE1 PHE 84 4.621 -3.312 5.675 499 HE2 PHE 84 HE2 PHE 84 3.736 -7.466 4.952 500 HZ PHE 84 HZ PHE 84 4.577 -5.683 6.474 501 H ASN 85 H ASN 85 6.444 -3.985 -0.839 502 HA ASN 85 HA ASN 85 8.408 -3.250 1.240 503 1HB ASN 85 1HB ASN 85 9.200 -4.394 -0.693 504 2HB ASN 85 2HB ASN 85 8.331 -3.305 -1.761 505 1HD2 ASN 85 1HD2 ASN 85 9.132 -0.954 -1.770 506 2HD2 ASN 85 2HD2 ASN 85 10.867 -0.725 -1.655 507 H VAL 86 H VAL 86 7.216 -1.649 2.297 508 HA VAL 86 HA VAL 86 6.489 0.834 0.946 509 HB VAL 86 HB VAL 86 6.806 0.517 3.943 510 1HG1 VAL 86 1HG1 VAL 86 4.980 2.237 3.837 511 2HG1 VAL 86 2HG1 VAL 86 6.487 2.792 3.101 512 3HG1 VAL 86 3HG1 VAL 86 5.133 2.275 2.080 513 1HG2 VAL 86 1HG2 VAL 86 5.454 -1.326 3.451 514 2HG2 VAL 86 2HG2 VAL 86 4.369 -0.036 3.975 515 3HG2 VAL 86 3HG2 VAL 86 4.495 -0.438 2.250 516 H THR 87 H THR 87 8.436 1.494 -0.105 517 HA THR 87 HA THR 87 9.910 3.334 1.247 518 HB THR 87 HB THR 87 11.076 1.410 2.323 519 HG1 THR 87 HG1 THR 87 13.180 2.241 1.899 520 1HG2 THR 87 1HG2 THR 87 12.689 0.099 1.052 521 2HG2 THR 87 2HG2 THR 87 11.016 -0.148 0.520 522 3HG2 THR 87 3HG2 THR 87 12.121 0.848 -0.458 523 HA PRO 88 HA PRO 88 11.154 3.854 -3.095 524 1HB PRO 88 1HB PRO 88 12.948 5.937 -2.821 525 2HB PRO 88 2HB PRO 88 11.195 6.212 -2.807 526 1HG PRO 88 1HG PRO 88 13.061 6.128 -0.452 527 2HG PRO 88 2HG PRO 88 11.648 7.156 -0.723 528 1HD PRO 88 1HD PRO 88 11.625 4.870 0.843 529 2HD PRO 88 2HD PRO 88 10.192 5.556 0.071 530 H MET 89 H MET 89 13.121 3.603 -0.179 531 HA MET 89 HA MET 89 14.753 1.573 -0.731 532 1HB MET 89 1HB MET 89 16.989 2.622 -1.265 533 2HB MET 89 2HB MET 89 15.856 2.473 -2.585 534 1HG MET 89 1HG MET 89 15.256 5.001 -2.028 535 2HG MET 89 2HG MET 89 16.794 4.959 -1.163 536 1HE MET 89 1HE MET 89 15.849 3.260 -4.689 537 2HE MET 89 2HE MET 89 15.027 4.839 -4.633 538 3HE MET 89 3HE MET 89 16.399 4.584 -5.734 539 H ALA 90 H ALA 90 15.577 4.910 0.311 540 HA ALA 90 HA ALA 90 16.941 3.851 2.617 541 1HB ALA 90 1HB ALA 90 17.807 5.728 1.247 542 2HB ALA 90 2HB ALA 90 16.435 6.727 1.788 543 3HB ALA 90 3HB ALA 90 17.638 6.159 2.961 544 H ALA 91 H ALA 91 13.793 5.420 2.155 545 HA ALA 91 HA ALA 91 13.595 6.113 5.008 546 1HB ALA 91 1HB ALA 91 11.548 6.421 2.782 547 2HB ALA 91 2HB ALA 91 11.373 6.960 4.472 548 3HB ALA 91 3HB ALA 91 12.634 7.661 3.423 549 H GLY 92 H GLY 92 10.637 4.953 3.772 550 1HA GLY 92 1HA GLY 92 9.294 3.245 4.352 551 2HA GLY 92 2HA GLY 92 10.725 2.225 4.626 552 H ALA 93 H ALA 93 11.972 3.190 6.759 553 HA ALA 93 HA ALA 93 10.508 2.565 9.053 554 1HB ALA 93 1HB ALA 93 12.312 3.737 10.286 555 2HB ALA 93 2HB ALA 93 12.962 2.713 8.991 556 3HB ALA 93 3HB ALA 93 12.879 4.474 8.772 557 H TYR 94 H TYR 94 11.237 5.836 7.787 558 HA TYR 94 HA TYR 94 9.452 7.195 9.609 559 1HB TYR 94 1HB TYR 94 10.700 8.204 7.041 560 2HB TYR 94 2HB TYR 94 10.085 9.174 8.385 561 HD1 TYR 94 HD1 TYR 94 11.202 8.558 10.769 562 HD2 TYR 94 HD2 TYR 94 13.021 7.777 6.938 563 HE1 TYR 94 HE1 TYR 94 13.412 8.293 11.861 564 HE2 TYR 94 HE2 TYR 94 15.221 7.498 8.041 565 HH TYR 94 HH TYR 94 16.386 7.468 10.051 566 H PHE 95 H PHE 95 7.915 5.193 8.398 567 HA PHE 95 HA PHE 95 6.123 6.709 6.592 568 1HB PHE 95 1HB PHE 95 6.786 4.487 5.652 569 2HB PHE 95 2HB PHE 95 6.322 3.732 7.168 570 HD1 PHE 95 HD1 PHE 95 4.596 2.242 6.549 571 HD2 PHE 95 HD2 PHE 95 4.338 6.391 5.334 572 HE1 PHE 95 HE1 PHE 95 2.272 1.900 5.771 573 HE2 PHE 95 HE2 PHE 95 1.995 6.070 4.774 574 HZ PHE 95 HZ PHE 95 0.992 3.829 4.798 575 H ASN 96 H ASN 96 3.902 7.035 7.427 576 HA ASN 96 HA ASN 96 3.746 6.534 10.237 577 1HB ASN 96 1HB ASN 96 1.607 7.662 8.426 578 2HB ASN 96 2HB ASN 96 1.410 7.360 10.150 579 1HD2 ASN 96 1HD2 ASN 96 3.215 9.278 7.841 580 2HD2 ASN 96 2HD2 ASN 96 3.721 10.532 8.986 581 H LYS 97 H LYS 97 1.762 5.333 11.194 582 HA LYS 97 HA LYS 97 0.725 3.347 11.517 583 1HB LYS 97 1HB LYS 97 -0.656 4.586 9.716 584 2HB LYS 97 2HB LYS 97 -0.057 3.379 8.583 585 1HG LYS 97 1HG LYS 97 -1.682 2.879 11.135 586 2HG LYS 97 2HG LYS 97 -2.304 2.883 9.491 587 1HD LYS 97 1HD LYS 97 -0.770 0.966 8.928 588 2HD LYS 97 2HD LYS 97 -0.296 0.899 10.644 589 1HE LYS 97 1HE LYS 97 -2.646 0.472 11.277 590 2HE LYS 97 2HE LYS 97 -3.108 0.444 9.565 591 1HZ LYS 97 1HZ LYS 97 -2.643 -1.790 10.533 592 2HZ LYS 97 2HZ LYS 97 -1.699 -1.492 9.255 593 3HZ LYS 97 3HZ LYS 97 -1.055 -1.352 10.726 594 H VAL 98 H VAL 98 3.248 2.850 11.536 595 HA VAL 98 HA VAL 98 4.034 0.778 9.654 596 HB VAL 98 HB VAL 98 5.609 2.285 10.879 597 1HG1 VAL 98 1HG1 VAL 98 6.278 1.789 13.157 598 2HG1 VAL 98 2HG1 VAL 98 4.555 2.191 13.139 599 3HG1 VAL 98 3HG1 VAL 98 5.073 0.500 13.295 600 1HG2 VAL 98 1HG2 VAL 98 7.324 0.590 11.225 601 2HG2 VAL 98 2HG2 VAL 98 6.103 -0.694 11.230 602 3HG2 VAL 98 3HG2 VAL 98 6.387 0.259 9.761 603 H GLN 99 H GLN 99 3.975 -1.437 10.028 604 HA GLN 99 HA GLN 99 3.339 -3.433 10.740 605 1HB GLN 99 1HB GLN 99 2.733 -2.231 13.472 606 2HB GLN 99 2HB GLN 99 2.840 -3.941 13.065 607 1HG GLN 99 1HG GLN 99 5.230 -3.626 12.389 608 2HG GLN 99 2HG GLN 99 5.114 -1.929 12.878 609 1HE2 GLN 99 1HE2 GLN 99 4.506 -5.242 14.227 610 2HE2 GLN 99 2HE2 GLN 99 5.082 -4.814 15.829 611 H CYS 100 H CYS 100 1.593 -4.801 11.071 612 HA CYS 100 HA CYS 100 -0.476 -5.566 10.791 613 1HB CYS 100 1HB CYS 100 -1.363 -4.780 12.717 614 2HB CYS 100 2HB CYS 100 -1.069 -3.079 12.365 615 HG CYS 100 HG CYS 100 -3.620 -3.572 12.591 616 H PHE 101 H PHE 101 -2.077 -5.748 9.235 617 HA PHE 101 HA PHE 101 -1.517 -4.497 6.714 618 1HB PHE 101 1HB PHE 101 -3.678 -5.749 6.080 619 2HB PHE 101 2HB PHE 101 -2.327 -6.688 6.665 620 HD1 PHE 101 HD1 PHE 101 -5.554 -5.110 7.816 621 HD2 PHE 101 HD2 PHE 101 -2.623 -8.218 8.453 622 HE1 PHE 101 HE1 PHE 101 -6.950 -6.066 9.616 623 HE2 PHE 101 HE2 PHE 101 -4.031 -9.164 10.254 624 HZ PHE 101 HZ PHE 101 -6.192 -8.088 10.845 625 H CYS 102 H CYS 102 -3.572 -3.680 5.433 626 HA CYS 102 HA CYS 102 -5.559 -2.258 6.986 627 1HB CYS 102 1HB CYS 102 -3.622 -0.566 6.823 628 2HB CYS 102 2HB CYS 102 -3.900 -0.570 5.067 629 HG CYS 102 HG CYS 102 -5.817 0.251 7.616 630 H PHE 103 H PHE 103 -5.906 -4.447 5.638 631 HA PHE 103 HA PHE 103 -7.511 -4.124 3.335 632 1HB PHE 103 1HB PHE 103 -5.798 -5.312 1.803 633 2HB PHE 103 2HB PHE 103 -5.639 -3.586 2.036 634 HD1 PHE 103 HD1 PHE 103 -3.582 -2.644 2.733 635 HD2 PHE 103 HD2 PHE 103 -4.233 -6.885 3.191 636 HE1 PHE 103 HE1 PHE 103 -1.213 -2.946 3.386 637 HE2 PHE 103 HE2 PHE 103 -1.850 -7.186 3.747 638 HZ PHE 103 HZ PHE 103 -0.338 -5.218 3.889 639 H THR 104 H THR 104 -7.991 -6.449 2.535 640 HA THR 104 HA THR 104 -7.288 -8.511 4.578 641 HB THR 104 HB THR 104 -9.519 -7.565 5.021 642 HG1 THR 104 HG1 THR 104 -10.495 -9.652 5.124 643 1HG2 THR 104 1HG2 THR 104 -10.525 -8.979 2.523 644 2HG2 THR 104 2HG2 THR 104 -11.409 -7.932 3.636 645 3HG2 THR 104 3HG2 THR 104 -10.193 -7.237 2.551 646 H GLU 105 H GLU 105 -5.731 -8.217 2.504 647 HA GLU 105 HA GLU 105 -6.478 -9.950 0.287 648 1HB GLU 105 1HB GLU 105 -4.888 -8.051 0.072 649 2HB GLU 105 2HB GLU 105 -3.797 -8.871 1.203 650 1HG GLU 105 1HG GLU 105 -4.255 -10.796 -0.793 651 2HG GLU 105 2HG GLU 105 -4.224 -9.289 -1.696 652 H THR 106 H THR 106 -7.298 -11.529 1.933 653 HA THR 106 HA THR 106 -5.183 -13.315 3.103 654 HB THR 106 HB THR 106 -6.502 -12.062 4.730 655 HG1 THR 106 HG1 THR 106 -5.679 -14.129 5.188 656 1HG2 THR 106 1HG2 THR 106 -8.939 -13.713 3.967 657 2HG2 THR 106 2HG2 THR 106 -8.790 -12.453 5.188 658 3HG2 THR 106 3HG2 THR 106 -8.734 -12.015 3.479 659 H THR 107 H THR 107 -8.500 -13.527 1.884 660 HA THR 107 HA THR 107 -7.899 -15.635 0.078 661 HB THR 107 HB THR 107 -8.534 -16.269 2.866 662 HG1 THR 107 HG1 THR 107 -7.898 -17.854 0.614 663 1HG2 THR 107 1HG2 THR 107 -10.893 -16.528 2.089 664 2HG2 THR 107 2HG2 THR 107 -10.347 -17.591 0.770 665 3HG2 THR 107 3HG2 THR 107 -10.161 -18.094 2.457 666 H LEU 108 H LEU 108 -9.626 -16.047 -1.320 667 HA LEU 108 HA LEU 108 -12.161 -14.683 -0.877 668 1HB LEU 108 1HB LEU 108 -10.404 -14.001 -3.271 669 2HB LEU 108 2HB LEU 108 -12.107 -13.590 -3.142 670 HG LEU 108 HG LEU 108 -9.960 -12.538 -1.274 671 1HD1 LEU 108 1HD1 LEU 108 -9.837 -11.811 -3.727 672 2HD1 LEU 108 2HD1 LEU 108 -11.368 -10.973 -3.451 673 3HD1 LEU 108 3HD1 LEU 108 -9.917 -10.550 -2.502 674 1HD2 LEU 108 1HD2 LEU 108 -11.682 -10.891 -0.607 675 2HD2 LEU 108 2HD2 LEU 108 -12.865 -11.668 -1.677 676 3HD2 LEU 108 3HD2 LEU 108 -12.253 -12.522 -0.250 677 H GLU 109 H GLU 109 -13.660 -16.001 -1.566 678 HA GLU 109 HA GLU 109 -13.377 -18.327 -3.081 679 1HB GLU 109 1HB GLU 109 -15.687 -16.503 -2.321 680 2HB GLU 109 2HB GLU 109 -15.966 -17.979 -3.221 681 1HG GLU 109 1HG GLU 109 -16.291 -18.374 -0.839 682 2HG GLU 109 2HG GLU 109 -14.919 -19.319 -1.425 683 HA PRO 110 HA PRO 110 -12.904 -17.138 -7.157 684 1HB PRO 110 1HB PRO 110 -14.240 -18.968 -8.664 685 2HB PRO 110 2HB PRO 110 -12.876 -19.328 -7.577 686 1HG PRO 110 1HG PRO 110 -15.829 -19.584 -6.938 687 2HG PRO 110 2HG PRO 110 -14.583 -20.858 -6.789 688 1HD PRO 110 1HD PRO 110 -15.283 -19.350 -4.676 689 2HD PRO 110 2HD PRO 110 -13.563 -19.741 -4.940 690 H GLY 111 H GLY 111 -13.743 -15.058 -7.171 691 1HA GLY 111 1HA GLY 111 -15.215 -14.052 -9.091 692 2HA GLY 111 2HA GLY 111 -16.537 -14.599 -8.042 693 H GLU 112 H GLU 112 -14.743 -14.080 -5.580 694 HA GLU 112 HA GLU 112 -16.407 -11.863 -5.206 695 1HB GLU 112 1HB GLU 112 -14.432 -13.106 -3.276 696 2HB GLU 112 2HB GLU 112 -15.810 -12.078 -2.878 697 1HG GLU 112 1HG GLU 112 -15.955 -14.828 -4.024 698 2HG GLU 112 2HG GLU 112 -16.523 -14.250 -2.458 699 H GLU 113 H GLU 113 -16.047 -9.891 -4.155 700 HA GLU 113 HA GLU 113 -13.819 -8.431 -5.464 701 1HB GLU 113 1HB GLU 113 -16.608 -7.559 -4.618 702 2HB GLU 113 2HB GLU 113 -15.410 -6.578 -5.486 703 1HG GLU 113 1HG GLU 113 -15.443 -8.099 -7.278 704 2HG GLU 113 2HG GLU 113 -16.669 -9.079 -6.459 705 H MET 114 H MET 114 -12.211 -7.787 -4.105 706 HA MET 114 HA MET 114 -12.870 -7.073 -1.294 707 1HB MET 114 1HB MET 114 -11.180 -8.862 -1.889 708 2HB MET 114 2HB MET 114 -10.194 -7.636 -2.650 709 1HG MET 114 1HG MET 114 -10.644 -6.447 -0.193 710 2HG MET 114 2HG MET 114 -10.865 -8.147 0.206 711 1HE MET 114 1HE MET 114 -8.440 -5.262 -0.742 712 2HE MET 114 2HE MET 114 -6.923 -6.115 -1.120 713 3HE MET 114 3HE MET 114 -8.309 -6.235 -2.222 714 H GLU 115 H GLU 115 -13.788 -4.846 -2.224 715 HA GLU 115 HA GLU 115 -11.724 -2.837 -2.526 716 1HB GLU 115 1HB GLU 115 -14.538 -2.704 -1.351 717 2HB GLU 115 2HB GLU 115 -13.461 -1.332 -1.629 718 1HG GLU 115 1HG GLU 115 -14.786 -1.217 -3.472 719 2HG GLU 115 2HG GLU 115 -13.407 -2.108 -4.113 720 H MET 116 H MET 116 -10.278 -2.197 -0.898 721 HA MET 116 HA MET 116 -11.549 -1.792 1.683 722 1HB MET 116 1HB MET 116 -9.025 -3.458 1.482 723 2HB MET 116 2HB MET 116 -9.352 -2.431 2.880 724 1HG MET 116 1HG MET 116 -11.709 -3.598 2.914 725 2HG MET 116 2HG MET 116 -10.914 -4.816 1.922 726 1HE MET 116 1HE MET 116 -9.894 -3.850 6.346 727 2HE MET 116 2HE MET 116 -9.387 -2.736 5.067 728 3HE MET 116 3HE MET 116 -11.122 -2.992 5.389 729 HA PRO 117 HA PRO 117 -9.303 2.054 1.204 730 1HB PRO 117 1HB PRO 117 -9.831 3.158 3.631 731 2HB PRO 117 2HB PRO 117 -10.874 3.211 2.183 732 1HG PRO 117 1HG PRO 117 -11.190 1.540 4.613 733 2HG PRO 117 2HG PRO 117 -12.377 2.174 3.428 734 1HD PRO 117 1HD PRO 117 -11.370 -0.475 3.551 735 2HD PRO 117 2HD PRO 117 -12.298 0.263 2.206 736 H VAL 118 H VAL 118 -7.301 2.259 1.341 737 HA VAL 118 HA VAL 118 -5.690 1.453 3.719 738 HB VAL 118 HB VAL 118 -4.877 2.223 0.891 739 1HG1 VAL 118 1HG1 VAL 118 -3.280 3.310 2.354 740 2HG1 VAL 118 2HG1 VAL 118 -3.084 1.819 3.308 741 3HG1 VAL 118 3HG1 VAL 118 -2.540 1.895 1.616 742 1HG2 VAL 118 1HG2 VAL 118 -3.855 0.015 0.831 743 2HG2 VAL 118 2HG2 VAL 118 -4.343 -0.286 2.509 744 3HG2 VAL 118 3HG2 VAL 118 -5.573 -0.145 1.235 745 H VAL 119 H VAL 119 -4.536 3.212 4.732 746 HA VAL 119 HA VAL 119 -5.233 5.947 3.869 747 HB VAL 119 HB VAL 119 -6.517 5.456 5.902 748 1HG1 VAL 119 1HG1 VAL 119 -3.851 4.943 7.299 749 2HG1 VAL 119 2HG1 VAL 119 -5.455 5.004 8.043 750 3HG1 VAL 119 3HG1 VAL 119 -5.067 3.705 6.913 751 1HG2 VAL 119 1HG2 VAL 119 -5.774 7.341 7.264 752 2HG2 VAL 119 2HG2 VAL 119 -4.191 7.342 6.469 753 3HG2 VAL 119 3HG2 VAL 119 -5.656 7.741 5.543 754 H PHE 120 H PHE 120 -3.379 7.332 3.855 755 HA PHE 120 HA PHE 120 -0.783 6.110 4.692 756 1HB PHE 120 1HB PHE 120 -1.459 5.415 2.335 757 2HB PHE 120 2HB PHE 120 -1.315 7.114 1.878 758 HD1 PHE 120 HD1 PHE 120 1.105 8.212 2.501 759 HD2 PHE 120 HD2 PHE 120 0.357 3.965 2.237 760 HE1 PHE 120 HE1 PHE 120 3.518 7.767 2.318 761 HE2 PHE 120 HE2 PHE 120 2.770 3.583 1.859 762 HZ PHE 120 HZ PHE 120 4.352 5.485 1.960 763 H PHE 121 H PHE 121 0.588 7.683 5.569 764 HA PHE 121 HA PHE 121 0.771 10.280 4.334 765 1HB PHE 121 1HB PHE 121 0.552 11.311 6.569 766 2HB PHE 121 2HB PHE 121 -0.959 10.801 5.838 767 HD1 PHE 121 HD1 PHE 121 0.549 11.080 8.889 768 HD2 PHE 121 HD2 PHE 121 -1.832 8.368 6.599 769 HE1 PHE 121 HE1 PHE 121 -0.065 9.839 10.955 770 HE2 PHE 121 HE2 PHE 121 -2.166 6.926 8.586 771 HZ PHE 121 HZ PHE 121 -1.243 7.644 10.765 772 H VAL 122 H VAL 122 2.749 11.249 4.834 773 HA VAL 122 HA VAL 122 4.847 9.350 5.699 774 HB VAL 122 HB VAL 122 4.860 11.943 4.101 775 1HG1 VAL 122 1HG1 VAL 122 7.022 11.790 5.154 776 2HG1 VAL 122 2HG1 VAL 122 7.136 10.053 4.824 777 3HG1 VAL 122 3HG1 VAL 122 7.205 11.227 3.490 778 1HG2 VAL 122 1HG2 VAL 122 5.081 8.998 3.373 779 2HG2 VAL 122 2HG2 VAL 122 3.763 10.090 2.933 780 3HG2 VAL 122 3HG2 VAL 122 5.352 10.313 2.228 781 H ASP 123 H ASP 123 6.371 9.752 7.337 782 HA ASP 123 HA ASP 123 5.625 11.810 9.281 783 1HB ASP 123 1HB ASP 123 6.156 9.621 10.129 784 2HB ASP 123 2HB ASP 123 7.733 9.637 9.318 785 HA PRO 124 HA PRO 124 8.506 14.553 7.106 786 1HB PRO 124 1HB PRO 124 8.651 16.623 8.950 787 2HB PRO 124 2HB PRO 124 7.334 16.350 7.785 788 1HG PRO 124 1HG PRO 124 7.411 15.511 10.686 789 2HG PRO 124 2HG PRO 124 6.090 16.331 9.794 790 1HD PRO 124 1HD PRO 124 6.061 13.690 10.238 791 2HD PRO 124 2HD PRO 124 5.481 14.339 8.678 792 H GLU 125 H GLU 125 9.165 12.980 10.254 793 HA GLU 125 HA GLU 125 11.758 13.747 10.728 794 1HB GLU 125 1HB GLU 125 10.090 12.078 11.875 795 2HB GLU 125 2HB GLU 125 10.746 10.897 10.739 796 1HG GLU 125 1HG GLU 125 12.131 10.632 12.512 797 2HG GLU 125 2HG GLU 125 13.034 11.933 11.708 798 H ILE 126 H ILE 126 10.446 11.946 7.893 799 HA ILE 126 HA ILE 126 12.739 10.662 7.060 800 HB ILE 126 HB ILE 126 10.484 10.405 6.226 801 1HG1 ILE 126 1HG1 ILE 126 12.807 9.748 5.169 802 2HG1 ILE 126 2HG1 ILE 126 11.309 9.473 4.345 803 1HG2 ILE 126 1HG2 ILE 126 9.603 11.754 4.423 804 2HG2 ILE 126 2HG2 ILE 126 9.803 12.761 5.866 805 3HG2 ILE 126 3HG2 ILE 126 10.941 12.903 4.539 806 1HD1 ILE 126 1HD1 ILE 126 12.936 11.963 3.882 807 2HD1 ILE 126 2HD1 ILE 126 13.126 10.461 2.954 808 3HD1 ILE 126 3HD1 ILE 126 11.575 11.339 2.927 809 H VAL 127 H VAL 127 11.848 14.157 6.689 810 HA VAL 127 HA VAL 127 14.368 14.582 5.126 811 HB VAL 127 HB VAL 127 13.500 16.947 4.937 812 1HG1 VAL 127 1HG1 VAL 127 12.089 16.375 3.033 813 2HG1 VAL 127 2HG1 VAL 127 13.541 15.359 3.105 814 3HG1 VAL 127 3HG1 VAL 127 11.970 14.696 3.600 815 1HG2 VAL 127 1HG2 VAL 127 10.817 15.696 5.672 816 2HG2 VAL 127 2HG2 VAL 127 11.730 16.814 6.716 817 3HG2 VAL 127 3HG2 VAL 127 11.132 17.353 5.139 818 H LYS 128 H LYS 128 15.080 13.676 7.378 819 HA LYS 128 HA LYS 128 16.330 16.031 8.649 820 1HB LYS 128 1HB LYS 128 15.004 13.909 10.359 821 2HB LYS 128 2HB LYS 128 16.062 15.212 10.909 822 1HG LYS 128 1HG LYS 128 14.414 16.863 9.898 823 2HG LYS 128 2HG LYS 128 13.361 15.474 9.537 824 1HD LYS 128 1HD LYS 128 13.510 14.843 11.968 825 2HD LYS 128 2HD LYS 128 14.314 16.384 12.289 826 1HE LYS 128 1HE LYS 128 12.344 17.638 11.520 827 2HE LYS 128 2HE LYS 128 11.574 16.150 10.940 828 1HZ LYS 128 1HZ LYS 128 10.658 16.748 13.048 829 2HZ LYS 128 2HZ LYS 128 11.507 15.344 13.166 830 3HZ LYS 128 3HZ LYS 128 12.146 16.720 13.769 831 HA PRO 129 HA PRO 129 19.401 12.747 9.626 832 1HB PRO 129 1HB PRO 129 19.172 10.068 9.266 833 2HB PRO 129 2HB PRO 129 18.338 10.917 10.600 834 1HG PRO 129 1HG PRO 129 17.200 10.207 7.878 835 2HG PRO 129 2HG PRO 129 16.519 9.829 9.479 836 1HD PRO 129 1HD PRO 129 15.674 11.949 8.126 837 2HD PRO 129 2HD PRO 129 15.911 12.026 9.894 838 H VAL 130 H VAL 130 21.219 11.741 8.622 839 HA VAL 130 HA VAL 130 21.793 12.530 6.016 840 HB VAL 130 HB VAL 130 23.118 10.468 7.818 841 1HG1 VAL 130 1HG1 VAL 130 24.154 11.940 5.365 842 2HG1 VAL 130 2HG1 VAL 130 25.160 10.999 6.490 843 3HG1 VAL 130 3HG1 VAL 130 23.921 10.183 5.529 844 1HG2 VAL 130 1HG2 VAL 130 22.989 12.717 8.871 845 2HG2 VAL 130 2HG2 VAL 130 24.643 12.360 8.369 846 3HG2 VAL 130 3HG2 VAL 130 23.641 13.450 7.391 847 H GLU 131 H GLU 131 20.601 9.472 7.286 848 HA GLU 131 HA GLU 131 20.880 7.563 5.321 849 1HB GLU 131 1HB GLU 131 18.323 8.272 6.838 850 2HB GLU 131 2HB GLU 131 18.685 6.714 6.098 851 1HG GLU 131 1HG GLU 131 20.486 6.316 7.699 852 2HG GLU 131 2HG GLU 131 20.253 7.901 8.450 853 H THR 132 H THR 132 18.289 10.001 5.406 854 HA THR 132 HA THR 132 17.401 9.085 2.764 855 HB THR 132 HB THR 132 15.363 10.498 3.701 856 HG1 THR 132 HG1 THR 132 15.554 11.080 5.790 857 1HG2 THR 132 1HG2 THR 132 15.327 8.037 3.697 858 2HG2 THR 132 2HG2 THR 132 16.375 7.980 5.128 859 3HG2 THR 132 3HG2 THR 132 14.737 8.616 5.267 860 H GLN 133 H GLN 133 18.147 12.005 4.624 861 HA GLN 133 HA GLN 133 18.001 14.237 3.850 862 1HB GLN 133 1HB GLN 133 20.293 13.034 4.488 863 2HB GLN 133 2HB GLN 133 20.708 13.313 2.830 864 1HG GLN 133 1HG GLN 133 21.555 15.135 4.167 865 2HG GLN 133 2HG GLN 133 20.264 15.765 3.139 866 1HE2 GLN 133 1HE2 GLN 133 19.145 13.850 5.888 867 2HE2 GLN 133 2HE2 GLN 133 18.775 15.188 6.926 868 H GLY 134 H GLY 134 16.346 13.931 2.071 869 1HA GLY 134 1HA GLY 134 16.292 15.450 0.026 870 2HA GLY 134 2HA GLY 134 17.558 14.415 -0.643 871 H ILE 135 H ILE 135 16.203 11.979 0.773 872 HA ILE 135 HA ILE 135 14.456 11.190 -1.368 873 HB ILE 135 HB ILE 135 14.942 10.165 1.430 874 1HG1 ILE 135 1HG1 ILE 135 16.736 9.874 -0.307 875 2HG1 ILE 135 2HG1 ILE 135 16.054 8.381 0.331 876 1HG2 ILE 135 1HG2 ILE 135 12.623 9.569 0.969 877 2HG2 ILE 135 2HG2 ILE 135 13.029 9.069 -0.672 878 3HG2 ILE 135 3HG2 ILE 135 13.631 8.144 0.730 879 1HD1 ILE 135 1HD1 ILE 135 15.265 9.574 -2.348 880 2HD1 ILE 135 2HD1 ILE 135 16.437 8.269 -2.071 881 3HD1 ILE 135 3HD1 ILE 135 14.735 8.021 -1.652 882 H LYS 136 H LYS 136 12.386 11.648 -1.691 883 HA LYS 136 HA LYS 136 10.623 11.901 0.526 884 1HB LYS 136 1HB LYS 136 9.685 14.123 -0.099 885 2HB LYS 136 2HB LYS 136 11.143 14.050 0.866 886 1HG LYS 136 1HG LYS 136 12.529 14.546 -1.108 887 2HG LYS 136 2HG LYS 136 11.073 14.575 -2.131 888 1HD LYS 136 1HD LYS 136 10.042 16.259 -0.566 889 2HD LYS 136 2HD LYS 136 11.516 16.243 0.403 890 1HE LYS 136 1HE LYS 136 12.779 17.248 -1.479 891 2HE LYS 136 2HE LYS 136 11.325 17.200 -2.498 892 1HZ LYS 136 1HZ LYS 136 11.518 18.738 0.041 893 2HZ LYS 136 2HZ LYS 136 11.628 19.396 -1.472 894 3HZ LYS 136 3HZ LYS 136 10.248 18.707 -0.875 895 H THR 137 H THR 137 10.427 9.929 -0.945 896 HA THR 137 HA THR 137 7.807 10.347 -1.960 897 HB THR 137 HB THR 137 9.765 8.846 -3.801 898 HG1 THR 137 HG1 THR 137 9.003 11.514 -3.704 899 1HG2 THR 137 1HG2 THR 137 7.449 8.050 -3.834 900 2HG2 THR 137 2HG2 THR 137 6.936 9.666 -4.371 901 3HG2 THR 137 3HG2 THR 137 8.051 8.712 -5.366 902 H LEU 138 H LEU 138 7.015 9.174 -0.283 903 HA LEU 138 HA LEU 138 8.533 6.837 0.581 904 1HB LEU 138 1HB LEU 138 6.827 8.634 1.800 905 2HB LEU 138 2HB LEU 138 5.885 7.139 1.810 906 HG LEU 138 HG LEU 138 8.137 6.108 2.637 907 1HD1 LEU 138 1HD1 LEU 138 9.409 7.740 4.083 908 2HD1 LEU 138 2HD1 LEU 138 9.630 7.983 2.335 909 3HD1 LEU 138 3HD1 LEU 138 8.565 9.057 3.264 910 1HD2 LEU 138 1HD2 LEU 138 7.609 6.496 4.968 911 2HD2 LEU 138 2HD2 LEU 138 6.526 7.825 4.585 912 3HD2 LEU 138 3HD2 LEU 138 6.141 6.184 4.041 913 H THR 139 H THR 139 8.533 5.812 -1.404 914 HA THR 139 HA THR 139 6.220 5.121 -2.776 915 HB THR 139 HB THR 139 9.067 4.159 -2.767 916 HG1 THR 139 HG1 THR 139 9.214 5.500 -4.575 917 1HG2 THR 139 1HG2 THR 139 8.855 3.218 -5.018 918 2HG2 THR 139 2HG2 THR 139 7.968 2.295 -3.812 919 3HG2 THR 139 3HG2 THR 139 7.092 3.379 -4.927 920 H LEU 140 H LEU 140 5.254 2.983 -3.147 921 HA LEU 140 HA LEU 140 5.902 0.947 -1.068 922 1HB LEU 140 1HB LEU 140 4.067 2.363 -0.250 923 2HB LEU 140 2HB LEU 140 3.101 2.025 -1.683 924 HG LEU 140 HG LEU 140 4.061 -0.248 0.081 925 1HD1 LEU 140 1HD1 LEU 140 3.015 1.348 1.634 926 2HD1 LEU 140 2HD1 LEU 140 1.608 1.511 0.559 927 3HD1 LEU 140 3HD1 LEU 140 1.938 -0.025 1.389 928 1HD2 LEU 140 1HD2 LEU 140 1.588 0.156 -1.663 929 2HD2 LEU 140 2HD2 LEU 140 2.937 -0.963 -1.948 930 3HD2 LEU 140 3HD2 LEU 140 1.852 -1.240 -0.598 931 H SER 141 H SER 141 6.659 -0.635 -2.345 932 HA SER 141 HA SER 141 5.177 -1.474 -4.792 933 1HB SER 141 1HB SER 141 7.834 -2.346 -3.685 934 2HB SER 141 2HB SER 141 6.977 -3.153 -5.013 935 HG SER 141 HG SER 141 7.092 -1.314 -6.229 936 H TYR 142 H TYR 142 3.350 -2.312 -4.219 937 HA TYR 142 HA TYR 142 3.143 -4.327 -2.073 938 1HB TYR 142 1HB TYR 142 1.369 -2.455 -2.876 939 2HB TYR 142 2HB TYR 142 0.929 -3.710 -4.016 940 HD1 TYR 142 HD1 TYR 142 1.578 -5.992 -1.738 941 HD2 TYR 142 HD2 TYR 142 -0.900 -2.461 -1.979 942 HE1 TYR 142 HE1 TYR 142 -0.047 -7.005 -0.215 943 HE2 TYR 142 HE2 TYR 142 -2.626 -3.611 -0.619 944 HH TYR 142 HH TYR 142 -2.290 -7.101 0.066 945 H THR 143 H THR 143 3.484 -6.490 -2.655 946 HA THR 143 HA THR 143 3.585 -7.161 -5.557 947 HB THR 143 HB THR 143 5.690 -8.110 -3.633 948 HG1 THR 143 HG1 THR 143 6.917 -6.276 -4.174 949 1HG2 THR 143 1HG2 THR 143 5.865 -7.286 -6.564 950 2HG2 THR 143 2HG2 THR 143 7.000 -8.303 -5.652 951 3HG2 THR 143 3HG2 THR 143 5.376 -8.910 -6.060 952 H PHE 144 H PHE 144 1.890 -8.369 -5.741 953 HA PHE 144 HA PHE 144 0.919 -10.208 -3.749 954 1HB PHE 144 1HB PHE 144 0.339 -9.658 -6.677 955 2HB PHE 144 2HB PHE 144 -0.477 -10.885 -5.746 956 HD1 PHE 144 HD1 PHE 144 -2.508 -9.657 -6.661 957 HD2 PHE 144 HD2 PHE 144 0.058 -8.084 -3.554 958 HE1 PHE 144 HE1 PHE 144 -4.452 -8.645 -5.536 959 HE2 PHE 144 HE2 PHE 144 -1.886 -7.013 -2.520 960 HZ PHE 144 HZ PHE 144 -4.139 -7.259 -3.500 961 H TYR 145 H TYR 145 2.647 -11.663 -3.289 962 HA TYR 145 HA TYR 145 2.658 -13.967 -5.197 963 1HB TYR 145 1HB TYR 145 5.010 -12.851 -3.658 964 2HB TYR 145 2HB TYR 145 4.963 -14.484 -4.320 965 HD1 TYR 145 HD1 TYR 145 4.301 -14.751 -6.817 966 HD2 TYR 145 HD2 TYR 145 5.646 -11.067 -5.098 967 HE1 TYR 145 HE1 TYR 145 5.189 -14.073 -9.032 968 HE2 TYR 145 HE2 TYR 145 6.629 -10.395 -7.324 969 HH TYR 145 HH TYR 145 6.357 -12.464 -10.209 970 HA PRO 146 HA PRO 146 1.778 -16.364 -1.588 971 1HB PRO 146 1HB PRO 146 -0.902 -16.715 -1.673 972 2HB PRO 146 2HB PRO 146 -0.221 -15.152 -1.178 973 1HG PRO 146 1HG PRO 146 -1.475 -15.787 -3.833 974 2HG PRO 146 2HG PRO 146 -1.433 -14.296 -2.877 975 1HD PRO 146 1HD PRO 146 0.389 -15.049 -5.005 976 2HD PRO 146 2HD PRO 146 0.356 -13.558 -4.038 977 H ARG 147 H ARG 147 -0.830 -17.596 -3.530 978 HA ARG 147 HA ARG 147 0.707 -19.431 -5.128 979 1HB ARG 147 1HB ARG 147 -0.152 -21.454 -3.861 980 2HB ARG 147 2HB ARG 147 1.133 -20.524 -3.083 981 1HG ARG 147 1HG ARG 147 -0.750 -19.312 -1.766 982 2HG ARG 147 2HG ARG 147 -1.825 -20.568 -2.350 983 1HD ARG 147 1HD ARG 147 -0.796 -22.239 -1.093 984 2HD ARG 147 2HD ARG 147 0.761 -21.435 -1.020 985 HE ARG 147 HE ARG 147 -1.419 -21.157 0.839 986 1HH1 ARG 147 1HH1 ARG 147 1.288 -19.433 -0.613 987 2HH1 ARG 147 2HH1 ARG 147 1.352 -18.160 0.570 988 1HH2 ARG 147 1HH2 ARG 147 -1.408 -19.435 2.437 989 2HH2 ARG 147 2HH2 ARG 147 -0.162 -18.231 2.383 990 H GLU 148 H GLU 148 -0.598 -19.823 -6.892 991 HA GLU 148 HA GLU 148 -3.433 -19.042 -6.686 992 1HB GLU 148 1HB GLU 148 -3.364 -19.052 -9.159 993 2HB GLU 148 2HB GLU 148 -2.311 -17.885 -8.376 994 1HG GLU 148 1HG GLU 148 -0.331 -19.330 -8.837 995 2HG GLU 148 2HG GLU 148 -1.397 -20.497 -9.633 996 HA PRO 149 HA PRO 149 -4.348 -23.477 -6.962 997 1HB PRO 149 1HB PRO 149 -7.070 -23.380 -7.166 998 2HB PRO 149 2HB PRO 149 -6.186 -23.099 -5.646 999 1HG PRO 149 1HG PRO 149 -7.424 -21.028 -7.449 1000 2HG PRO 149 2HG PRO 149 -7.348 -21.074 -5.679 1001 1HD PRO 149 1HD PRO 149 -5.596 -19.619 -7.306 1002 2HD PRO 149 2HD PRO 149 -5.218 -20.158 -5.638 1003 H SER 150 H SER 150 -6.479 -21.440 -9.084 1004 HA SER 150 HA SER 150 -4.861 -21.701 -11.292 1005 1HB SER 150 1HB SER 150 -5.776 -24.054 -11.452 1006 2HB SER 150 2HB SER 150 -7.395 -23.352 -11.648 1007 HG SER 150 HG SER 150 -6.157 -23.820 -13.633 1008 H LYS 151 H LYS 151 -6.321 -20.972 -13.280 1009 HA LYS 151 HA LYS 151 -8.446 -19.108 -12.604 1010 1HB LYS 151 1HB LYS 151 -7.300 -17.067 -13.354 1011 2HB LYS 151 2HB LYS 151 -6.773 -17.664 -11.797 1012 1HG LYS 151 1HG LYS 151 -5.219 -18.205 -14.366 1013 2HG LYS 151 2HG LYS 151 -5.023 -16.745 -13.409 1014 1HD LYS 151 1HD LYS 151 -3.584 -17.745 -12.014 1015 2HD LYS 151 2HD LYS 151 -4.827 -18.858 -11.519 1016 1HE LYS 151 1HE LYS 151 -3.185 -20.324 -12.269 1017 2HE LYS 151 2HE LYS 151 -4.191 -20.206 -13.719 1018 1HZ LYS 151 1HZ LYS 151 -1.648 -18.901 -13.076 1019 2HZ LYS 151 2HZ LYS 151 -1.920 -19.941 -14.291 1020 3HZ LYS 151 3HZ LYS 151 -2.540 -18.404 -14.387 Start of MODEL 21 1 H VAL 21 H VAL 21 -1.504 12.107 14.853 2 HA VAL 21 HA VAL 21 -3.368 10.398 16.362 3 HB VAL 21 HB VAL 21 -3.611 13.350 15.761 4 1HG1 VAL 21 1HG1 VAL 21 -4.879 13.368 17.884 5 2HG1 VAL 21 2HG1 VAL 21 -5.634 12.240 16.757 6 3HG1 VAL 21 3HG1 VAL 21 -4.621 11.623 18.074 7 1HG2 VAL 21 1HG2 VAL 21 -2.068 11.980 18.003 8 2HG2 VAL 21 2HG2 VAL 21 -1.412 13.088 16.777 9 3HG2 VAL 21 3HG2 VAL 21 -2.524 13.696 17.999 10 H GLU 22 H GLU 22 -3.362 9.319 14.041 11 HA GLU 22 HA GLU 22 -3.803 9.388 11.812 12 1HB GLU 22 1HB GLU 22 -5.344 7.829 13.238 13 2HB GLU 22 2HB GLU 22 -6.643 8.876 12.635 14 1HG GLU 22 1HG GLU 22 -6.054 8.332 10.327 15 2HG GLU 22 2HG GLU 22 -4.569 7.514 10.836 16 H GLN 23 H GLN 23 -3.443 11.812 12.021 17 HA GLN 23 HA GLN 23 -5.114 12.864 9.949 18 1HB GLN 23 1HB GLN 23 -5.288 13.969 12.662 19 2HB GLN 23 2HB GLN 23 -4.695 15.212 11.588 20 1HG GLN 23 1HG GLN 23 -7.221 13.599 11.137 21 2HG GLN 23 2HG GLN 23 -7.121 15.272 11.701 22 1HE2 GLN 23 1HE2 GLN 23 -4.668 15.415 9.622 23 2HE2 GLN 23 2HE2 GLN 23 -5.448 15.616 8.096 24 H ALA 24 H ALA 24 -2.925 14.453 12.027 25 HA ALA 24 HA ALA 24 -1.153 12.522 11.926 26 1HB ALA 24 1HB ALA 24 -0.152 12.973 9.906 27 2HB ALA 24 2HB ALA 24 -0.028 14.734 10.196 28 3HB ALA 24 3HB ALA 24 1.006 13.591 11.094 29 H SER 25 H SER 25 -0.178 15.969 12.101 30 HA SER 25 HA SER 25 -1.179 16.337 14.680 31 1HB SER 25 1HB SER 25 0.727 14.951 15.411 32 2HB SER 25 2HB SER 25 1.863 16.041 14.584 33 HG SER 25 HG SER 25 1.608 16.417 16.878 34 H ASP 26 H ASP 26 0.587 18.360 15.425 35 HA ASP 26 HA ASP 26 -0.157 20.590 13.725 36 1HB ASP 26 1HB ASP 26 0.049 20.765 16.162 37 2HB ASP 26 2HB ASP 26 1.730 20.204 16.099 38 H LEU 27 H LEU 27 2.474 18.318 13.813 39 HA LEU 27 HA LEU 27 4.548 19.880 12.666 40 1HB LEU 27 1HB LEU 27 4.103 16.879 12.496 41 2HB LEU 27 2HB LEU 27 5.642 17.729 12.331 42 HG LEU 27 HG LEU 27 3.985 17.529 14.896 43 1HD1 LEU 27 1HD1 LEU 27 5.772 16.058 15.654 44 2HD1 LEU 27 2HD1 LEU 27 5.046 15.423 14.166 45 3HD1 LEU 27 3HD1 LEU 27 6.621 16.238 14.104 46 1HD2 LEU 27 1HD2 LEU 27 6.000 18.509 15.977 47 2HD2 LEU 27 2HD2 LEU 27 6.705 18.809 14.375 48 3HD2 LEU 27 3HD2 LEU 27 5.219 19.651 14.876 49 H ILE 28 H ILE 28 1.643 19.265 11.089 50 HA ILE 28 HA ILE 28 2.709 18.494 8.486 51 HB ILE 28 HB ILE 28 0.130 19.861 9.343 52 1HG1 ILE 28 1HG1 ILE 28 0.494 17.079 8.160 53 2HG1 ILE 28 2HG1 ILE 28 0.710 17.356 9.879 54 1HG2 ILE 28 1HG2 ILE 28 1.014 18.800 6.635 55 2HG2 ILE 28 2HG2 ILE 28 -0.651 19.265 7.026 56 3HG2 ILE 28 3HG2 ILE 28 0.615 20.497 7.005 57 1HD1 ILE 28 1HD1 ILE 28 -1.836 17.907 8.324 58 2HD1 ILE 28 2HD1 ILE 28 -1.549 16.617 9.504 59 3HD1 ILE 28 3HD1 ILE 28 -1.567 18.313 10.034 60 H LEU 29 H LEU 29 3.833 19.809 7.067 61 HA LEU 29 HA LEU 29 3.812 22.772 7.549 62 1HB LEU 29 1HB LEU 29 6.249 21.225 6.682 63 2HB LEU 29 2HB LEU 29 6.109 22.918 7.115 64 HG LEU 29 HG LEU 29 5.172 21.542 9.414 65 1HD1 LEU 29 1HD1 LEU 29 6.103 19.461 8.364 66 2HD1 LEU 29 2HD1 LEU 29 7.707 20.223 8.330 67 3HD1 LEU 29 3HD1 LEU 29 6.910 19.898 9.886 68 1HD2 LEU 29 1HD2 LEU 29 7.905 22.716 8.840 69 2HD2 LEU 29 2HD2 LEU 29 6.452 23.591 9.388 70 3HD2 LEU 29 3HD2 LEU 29 7.206 22.377 10.445 71 H ASP 30 H ASP 30 4.439 24.030 5.641 72 HA ASP 30 HA ASP 30 3.164 23.041 3.248 73 1HB ASP 30 1HB ASP 30 4.441 25.628 4.068 74 2HB ASP 30 2HB ASP 30 3.944 25.372 2.393 75 H GLU 31 H GLU 31 4.660 21.266 3.181 76 HA GLU 31 HA GLU 31 6.159 21.854 0.721 77 1HB GLU 31 1HB GLU 31 7.597 20.918 2.939 78 2HB GLU 31 2HB GLU 31 7.228 19.429 2.049 79 1HG GLU 31 1HG GLU 31 8.517 21.908 0.814 80 2HG GLU 31 2HG GLU 31 9.429 20.590 1.551 81 H LYS 32 H LYS 32 6.013 19.903 -0.746 82 HA LYS 32 HA LYS 32 3.513 18.364 -0.279 83 1HB LYS 32 1HB LYS 32 3.270 20.504 -1.644 84 2HB LYS 32 2HB LYS 32 4.435 19.820 -2.822 85 1HG LYS 32 1HG LYS 32 2.990 17.747 -2.786 86 2HG LYS 32 2HG LYS 32 1.817 18.676 -1.848 87 1HD LYS 32 1HD LYS 32 2.672 19.021 -4.755 88 2HD LYS 32 2HD LYS 32 1.128 18.458 -4.117 89 1HE LYS 32 1HE LYS 32 0.678 20.668 -4.804 90 2HE LYS 32 2HE LYS 32 0.789 20.733 -3.041 91 1HZ LYS 32 1HZ LYS 32 2.906 21.487 -4.963 92 2HZ LYS 32 2HZ LYS 32 1.993 22.532 -4.079 93 3HZ LYS 32 3HZ LYS 32 3.071 21.536 -3.332 94 H ILE 33 H ILE 33 4.200 16.242 -0.275 95 HA ILE 33 HA ILE 33 6.634 15.546 -1.886 96 HB ILE 33 HB ILE 33 7.185 15.623 0.336 97 1HG1 ILE 33 1HG1 ILE 33 8.049 13.785 -1.101 98 2HG1 ILE 33 2HG1 ILE 33 8.140 13.578 0.651 99 1HG2 ILE 33 1HG2 ILE 33 6.196 14.210 2.079 100 2HG2 ILE 33 2HG2 ILE 33 5.179 15.548 1.518 101 3HG2 ILE 33 3HG2 ILE 33 4.835 13.887 1.007 102 1HD1 ILE 33 1HD1 ILE 33 6.177 12.023 0.556 103 2HD1 ILE 33 2HD1 ILE 33 6.207 12.161 -1.196 104 3HD1 ILE 33 3HD1 ILE 33 7.587 11.462 -0.354 105 H LYS 34 H LYS 34 6.318 14.128 -3.456 106 HA LYS 34 HA LYS 34 3.608 13.045 -3.891 107 1HB LYS 34 1HB LYS 34 4.610 14.293 -5.673 108 2HB LYS 34 2HB LYS 34 6.077 13.304 -5.632 109 1HG LYS 34 1HG LYS 34 3.318 12.153 -6.301 110 2HG LYS 34 2HG LYS 34 4.368 12.889 -7.492 111 1HD LYS 34 1HD LYS 34 6.117 11.123 -6.205 112 2HD LYS 34 2HD LYS 34 4.603 10.244 -6.167 113 1HE LYS 34 1HE LYS 34 4.398 10.557 -8.652 114 2HE LYS 34 2HE LYS 34 5.843 11.557 -8.669 115 1HZ LYS 34 1HZ LYS 34 5.951 8.756 -7.748 116 2HZ LYS 34 2HZ LYS 34 6.089 9.193 -9.335 117 3HZ LYS 34 3HZ LYS 34 7.161 9.736 -8.215 118 H VAL 35 H VAL 35 3.234 10.780 -3.888 119 HA VAL 35 HA VAL 35 5.598 9.054 -3.150 120 HB VAL 35 HB VAL 35 2.832 9.231 -1.980 121 1HG1 VAL 35 1HG1 VAL 35 4.853 7.030 -1.428 122 2HG1 VAL 35 2HG1 VAL 35 3.267 7.209 -0.673 123 3HG1 VAL 35 3HG1 VAL 35 3.392 6.788 -2.387 124 1HG2 VAL 35 1HG2 VAL 35 4.273 9.231 0.158 125 2HG2 VAL 35 2HG2 VAL 35 5.659 9.412 -0.903 126 3HG2 VAL 35 3HG2 VAL 35 4.401 10.668 -0.879 127 H THR 36 H THR 36 5.777 7.284 -4.256 128 HA THR 36 HA THR 36 4.054 6.897 -6.648 129 HB THR 36 HB THR 36 6.771 5.761 -5.806 130 HG1 THR 36 HG1 THR 36 7.683 7.464 -6.517 131 1HG2 THR 36 1HG2 THR 36 7.162 5.416 -8.192 132 2HG2 THR 36 2HG2 THR 36 5.767 4.478 -7.626 133 3HG2 THR 36 3HG2 THR 36 5.508 5.972 -8.566 134 H PHE 37 H PHE 37 2.418 5.614 -6.288 135 HA PHE 37 HA PHE 37 2.537 3.487 -4.266 136 1HB PHE 37 1HB PHE 37 0.404 4.648 -6.088 137 2HB PHE 37 2HB PHE 37 0.206 3.063 -5.398 138 HD1 PHE 37 HD1 PHE 37 -0.685 2.836 -3.190 139 HD2 PHE 37 HD2 PHE 37 1.281 6.501 -4.341 140 HE1 PHE 37 HE1 PHE 37 -1.034 3.762 -0.915 141 HE2 PHE 37 HE2 PHE 37 1.126 7.272 -2.000 142 HZ PHE 37 HZ PHE 37 -0.388 6.160 -0.453 143 H ASP 38 H ASP 38 3.207 1.369 -4.822 144 HA ASP 38 HA ASP 38 3.258 0.683 -7.717 145 1HB ASP 38 1HB ASP 38 5.391 1.679 -6.838 146 2HB ASP 38 2HB ASP 38 5.535 0.338 -5.734 147 H ALA 39 H ALA 39 1.386 -0.495 -7.497 148 HA ALA 39 HA ALA 39 1.506 -2.981 -5.874 149 1HB ALA 39 1HB ALA 39 -0.834 -3.204 -6.463 150 2HB ALA 39 2HB ALA 39 -0.535 -1.571 -5.830 151 3HB ALA 39 3HB ALA 39 -0.732 -1.824 -7.575 152 H ASN 40 H ASN 40 2.832 -4.471 -6.935 153 HA ASN 40 HA ASN 40 2.556 -4.811 -9.881 154 1HB ASN 40 1HB ASN 40 4.571 -6.122 -8.026 155 2HB ASN 40 2HB ASN 40 4.572 -6.070 -9.782 156 1HD2 ASN 40 1HD2 ASN 40 4.957 -4.124 -6.821 157 2HD2 ASN 40 2HD2 ASN 40 5.821 -2.783 -7.599 158 H VAL 41 H VAL 41 1.257 -6.439 -10.592 159 HA VAL 41 HA VAL 41 0.748 -8.782 -8.832 160 HB VAL 41 HB VAL 41 -1.259 -7.419 -9.063 161 1HG1 VAL 41 1HG1 VAL 41 -0.846 -6.373 -11.275 162 2HG1 VAL 41 2HG1 VAL 41 -1.095 -7.947 -12.063 163 3HG1 VAL 41 3HG1 VAL 41 -2.424 -7.165 -11.193 164 1HG2 VAL 41 1HG2 VAL 41 -1.450 -10.037 -10.611 165 2HG2 VAL 41 2HG2 VAL 41 -1.434 -9.873 -8.841 166 3HG2 VAL 41 3HG2 VAL 41 -2.772 -9.193 -9.784 167 H ALA 42 H ALA 42 1.240 -10.734 -9.577 168 HA ALA 42 HA ALA 42 1.948 -11.056 -12.444 169 1HB ALA 42 1HB ALA 42 3.998 -12.242 -11.782 170 2HB ALA 42 2HB ALA 42 4.032 -10.578 -11.171 171 3HB ALA 42 3HB ALA 42 3.644 -11.921 -10.073 172 H ALA 43 H ALA 43 2.383 -13.551 -12.725 173 HA ALA 43 HA ALA 43 0.090 -15.076 -12.054 174 1HB ALA 43 1HB ALA 43 2.922 -16.011 -12.675 175 2HB ALA 43 2HB ALA 43 1.462 -17.024 -12.675 176 3HB ALA 43 3HB ALA 43 1.628 -15.711 -13.862 177 H GLY 44 H GLY 44 -0.518 -15.892 -10.139 178 1HA GLY 44 1HA GLY 44 0.750 -16.970 -7.970 179 2HA GLY 44 2HA GLY 44 1.138 -15.250 -7.839 180 H LEU 45 H LEU 45 -1.316 -14.246 -9.077 181 HA LEU 45 HA LEU 45 -3.481 -15.612 -7.698 182 1HB LEU 45 1HB LEU 45 -3.537 -12.588 -7.588 183 2HB LEU 45 2HB LEU 45 -4.555 -13.766 -6.767 184 HG LEU 45 HG LEU 45 -2.354 -14.400 -5.475 185 1HD1 LEU 45 1HD1 LEU 45 -2.041 -11.467 -6.347 186 2HD1 LEU 45 2HD1 LEU 45 -0.945 -12.289 -5.225 187 3HD1 LEU 45 3HD1 LEU 45 -0.955 -12.718 -6.956 188 1HD2 LEU 45 1HD2 LEU 45 -4.028 -11.948 -5.082 189 2HD2 LEU 45 2HD2 LEU 45 -4.176 -13.534 -4.272 190 3HD2 LEU 45 3HD2 LEU 45 -2.818 -12.441 -3.899 191 HA PRO 46 HA PRO 46 -5.287 -13.912 -11.560 192 1HB PRO 46 1HB PRO 46 -7.825 -14.852 -11.349 193 2HB PRO 46 2HB PRO 46 -6.430 -15.954 -11.539 194 1HG PRO 46 1HG PRO 46 -7.931 -15.367 -9.020 195 2HG PRO 46 2HG PRO 46 -7.290 -16.916 -9.632 196 1HD PRO 46 1HD PRO 46 -5.968 -15.270 -7.790 197 2HD PRO 46 2HD PRO 46 -5.191 -16.519 -8.781 198 H TRP 47 H TRP 47 -5.411 -12.490 -8.634 199 HA TRP 47 HA TRP 47 -7.977 -11.386 -8.613 200 1HB TRP 47 1HB TRP 47 -5.552 -10.715 -6.970 201 2HB TRP 47 2HB TRP 47 -7.186 -10.125 -6.654 202 HD1 TRP 47 HD1 TRP 47 -7.721 -13.510 -7.777 203 HE1 TRP 47 HE1 TRP 47 -7.895 -15.199 -5.920 204 HE3 TRP 47 HE3 TRP 47 -5.913 -10.644 -3.907 205 HZ2 TRP 47 HZ2 TRP 47 -7.473 -15.283 -3.068 206 HZ3 TRP 47 HZ3 TRP 47 -5.643 -11.700 -1.675 207 HH2 TRP 47 HH2 TRP 47 -6.580 -13.940 -1.225 208 H GLU 48 H GLU 48 -8.896 -9.469 -9.001 209 HA GLU 48 HA GLU 48 -7.599 -7.731 -10.950 210 1HB GLU 48 1HB GLU 48 -10.101 -8.284 -10.830 211 2HB GLU 48 2HB GLU 48 -10.126 -7.278 -9.380 212 1HG GLU 48 1HG GLU 48 -9.162 -5.413 -10.922 213 2HG GLU 48 2HG GLU 48 -9.806 -6.412 -12.229 214 H PHE 49 H PHE 49 -5.742 -7.216 -9.620 215 HA PHE 49 HA PHE 49 -6.114 -5.322 -7.384 216 1HB PHE 49 1HB PHE 49 -3.761 -6.661 -8.717 217 2HB PHE 49 2HB PHE 49 -3.531 -5.167 -7.826 218 HD1 PHE 49 HD1 PHE 49 -3.923 -8.722 -7.396 219 HD2 PHE 49 HD2 PHE 49 -4.318 -4.872 -5.494 220 HE1 PHE 49 HE1 PHE 49 -3.804 -9.791 -5.154 221 HE2 PHE 49 HE2 PHE 49 -4.350 -5.969 -3.271 222 HZ PHE 49 HZ PHE 49 -4.088 -8.429 -3.100 223 H VAL 50 H VAL 50 -7.293 -3.623 -8.379 224 HA VAL 50 HA VAL 50 -5.872 -2.117 -10.473 225 HB VAL 50 HB VAL 50 -7.657 -0.818 -10.841 226 1HG1 VAL 50 1HG1 VAL 50 -9.503 -2.336 -11.213 227 2HG1 VAL 50 2HG1 VAL 50 -7.991 -3.244 -11.416 228 3HG1 VAL 50 3HG1 VAL 50 -8.944 -3.404 -9.917 229 1HG2 VAL 50 1HG2 VAL 50 -8.895 -1.543 -8.171 230 2HG2 VAL 50 2HG2 VAL 50 -8.336 0.061 -8.704 231 3HG2 VAL 50 3HG2 VAL 50 -9.730 -0.690 -9.475 232 HA PRO 51 HA PRO 51 -4.128 0.357 -6.991 233 1HB PRO 51 1HB PRO 51 -2.315 1.803 -8.441 234 2HB PRO 51 2HB PRO 51 -1.990 0.136 -7.888 235 1HG PRO 51 1HG PRO 51 -2.977 1.028 -10.603 236 2HG PRO 51 2HG PRO 51 -1.654 -0.120 -10.250 237 1HD PRO 51 1HD PRO 51 -4.184 -0.897 -10.889 238 2HD PRO 51 2HD PRO 51 -3.200 -1.834 -9.728 239 H VAL 52 H VAL 52 -4.877 2.410 -6.492 240 HA VAL 52 HA VAL 52 -7.052 3.309 -8.120 241 HB VAL 52 HB VAL 52 -7.253 5.108 -6.310 242 1HG1 VAL 52 1HG1 VAL 52 -8.786 3.214 -6.586 243 2HG1 VAL 52 2HG1 VAL 52 -7.634 2.130 -5.773 244 3HG1 VAL 52 3HG1 VAL 52 -8.399 3.462 -4.876 245 1HG2 VAL 52 1HG2 VAL 52 -6.186 4.594 -4.251 246 2HG2 VAL 52 2HG2 VAL 52 -5.590 3.035 -4.865 247 3HG2 VAL 52 3HG2 VAL 52 -4.878 4.531 -5.468 248 H GLN 53 H GLN 53 -3.859 4.678 -7.339 249 HA GLN 53 HA GLN 53 -3.885 6.081 -9.858 250 1HB GLN 53 1HB GLN 53 -3.087 8.227 -8.896 251 2HB GLN 53 2HB GLN 53 -4.770 7.894 -8.535 252 1HG GLN 53 1HG GLN 53 -2.990 6.918 -6.376 253 2HG GLN 53 2HG GLN 53 -2.716 8.614 -6.752 254 1HE2 GLN 53 1HE2 GLN 53 -5.332 6.332 -6.027 255 2HE2 GLN 53 2HE2 GLN 53 -6.386 7.532 -5.300 256 H ARG 54 H ARG 54 -1.640 6.609 -10.465 257 HA ARG 54 HA ARG 54 0.172 4.571 -9.580 258 1HB ARG 54 1HB ARG 54 0.251 5.493 -11.829 259 2HB ARG 54 2HB ARG 54 0.663 7.093 -11.222 260 1HG ARG 54 1HG ARG 54 2.624 5.894 -12.154 261 2HG ARG 54 2HG ARG 54 2.846 6.340 -10.459 262 1HD ARG 54 1HD ARG 54 2.361 4.175 -9.746 263 2HD ARG 54 2HD ARG 54 1.886 3.677 -11.374 264 HE ARG 54 HE ARG 54 4.485 4.365 -11.770 265 1HH1 ARG 54 1HH1 ARG 54 3.097 2.501 -9.003 266 2HH1 ARG 54 2HH1 ARG 54 4.384 1.314 -9.145 267 1HH2 ARG 54 1HH2 ARG 54 6.321 2.707 -11.527 268 2HH2 ARG 54 2HH2 ARG 54 6.058 1.492 -10.263 269 H ASP 55 H ASP 55 -0.216 8.045 -8.852 270 HA ASP 55 HA ASP 55 1.446 7.687 -6.478 271 1HB ASP 55 1HB ASP 55 2.758 9.668 -7.095 272 2HB ASP 55 2HB ASP 55 2.991 8.374 -8.292 273 H ILE 56 H ILE 56 1.136 9.198 -4.877 274 HA ILE 56 HA ILE 56 -1.335 10.876 -5.104 275 HB ILE 56 HB ILE 56 -1.699 10.790 -2.821 276 1HG1 ILE 56 1HG1 ILE 56 0.824 9.173 -2.752 277 2HG1 ILE 56 2HG1 ILE 56 0.590 10.757 -2.026 278 1HG2 ILE 56 1HG2 ILE 56 -1.248 7.941 -3.794 279 2HG2 ILE 56 2HG2 ILE 56 -2.403 8.518 -2.573 280 3HG2 ILE 56 3HG2 ILE 56 -2.611 8.978 -4.260 281 1HD1 ILE 56 1HD1 ILE 56 0.515 9.093 -0.298 282 2HD1 ILE 56 2HD1 ILE 56 -1.038 9.945 -0.455 283 3HD1 ILE 56 3HD1 ILE 56 -0.875 8.293 -1.059 284 H ASP 57 H ASP 57 -1.197 12.848 -3.740 285 HA ASP 57 HA ASP 57 1.523 13.904 -3.150 286 1HB ASP 57 1HB ASP 57 0.127 15.537 -4.322 287 2HB ASP 57 2HB ASP 57 -1.221 15.232 -3.209 288 H VAL 58 H VAL 58 2.007 14.141 -1.001 289 HA VAL 58 HA VAL 58 -0.107 13.994 1.048 290 HB VAL 58 HB VAL 58 1.822 13.031 2.575 291 1HG1 VAL 58 1HG1 VAL 58 -0.468 12.189 2.467 292 2HG1 VAL 58 2HG1 VAL 58 -0.139 11.416 0.915 293 3HG1 VAL 58 3HG1 VAL 58 0.660 10.828 2.386 294 1HG2 VAL 58 1HG2 VAL 58 3.081 11.268 1.646 295 2HG2 VAL 58 2HG2 VAL 58 2.171 11.284 0.110 296 3HG2 VAL 58 3HG2 VAL 58 3.305 12.576 0.494 297 H ARG 59 H ARG 59 -0.060 15.952 1.916 298 HA ARG 59 HA ARG 59 2.208 17.781 1.654 299 1HB ARG 59 1HB ARG 59 -0.513 17.852 3.007 300 2HB ARG 59 2HB ARG 59 0.665 19.145 3.206 301 1HG ARG 59 1HG ARG 59 0.202 18.239 0.370 302 2HG ARG 59 2HG ARG 59 -1.174 19.028 1.142 303 1HD ARG 59 1HD ARG 59 1.631 20.187 1.274 304 2HD ARG 59 2HD ARG 59 0.544 20.514 -0.070 305 HE ARG 59 HE ARG 59 -0.894 20.950 2.346 306 1HH1 ARG 59 1HH1 ARG 59 1.928 22.455 0.761 307 2HH1 ARG 59 2HH1 ARG 59 1.680 23.965 1.667 308 1HH2 ARG 59 1HH2 ARG 59 -1.014 22.988 3.556 309 2HH2 ARG 59 2HH2 ARG 59 0.182 24.216 3.138 310 H ILE 60 H ILE 60 3.685 16.296 2.557 311 HA ILE 60 HA ILE 60 4.552 14.937 4.332 312 HB ILE 60 HB ILE 60 5.912 16.633 5.777 313 1HG1 ILE 60 1HG1 ILE 60 5.158 18.384 3.415 314 2HG1 ILE 60 2HG1 ILE 60 4.462 18.520 5.041 315 1HG2 ILE 60 1HG2 ILE 60 6.813 15.120 4.036 316 2HG2 ILE 60 2HG2 ILE 60 6.649 16.480 2.879 317 3HG2 ILE 60 3HG2 ILE 60 7.687 16.615 4.304 318 1HD1 ILE 60 1HD1 ILE 60 6.751 18.941 5.950 319 2HD1 ILE 60 2HD1 ILE 60 7.418 18.816 4.305 320 3HD1 ILE 60 3HD1 ILE 60 6.300 20.128 4.708 321 H GLY 61 H GLY 61 2.563 14.187 5.289 322 1HA GLY 61 1HA GLY 61 2.224 13.617 7.666 323 2HA GLY 61 2HA GLY 61 2.081 15.335 8.030 324 H GLU 62 H GLU 62 0.454 15.900 5.472 325 HA GLU 62 HA GLU 62 -2.019 15.448 6.767 326 1HB GLU 62 1HB GLU 62 -1.694 17.261 5.148 327 2HB GLU 62 2HB GLU 62 -1.600 16.063 3.828 328 1HG GLU 62 1HG GLU 62 -3.834 17.173 4.021 329 2HG GLU 62 2HG GLU 62 -3.926 15.420 4.174 330 H THR 63 H THR 63 -3.663 14.069 6.451 331 HA THR 63 HA THR 63 -2.956 11.313 5.888 332 HB THR 63 HB THR 63 -5.720 11.616 6.635 333 HG1 THR 63 HG1 THR 63 -5.181 13.840 7.050 334 1HG2 THR 63 1HG2 THR 63 -4.274 9.857 7.457 335 2HG2 THR 63 2HG2 THR 63 -3.250 11.043 8.291 336 3HG2 THR 63 3HG2 THR 63 -4.932 10.791 8.805 337 H VAL 64 H VAL 64 -3.081 10.499 3.818 338 HA VAL 64 HA VAL 64 -5.001 11.709 1.929 339 HB VAL 64 HB VAL 64 -2.705 10.826 1.372 340 1HG1 VAL 64 1HG1 VAL 64 -2.867 8.631 2.460 341 2HG1 VAL 64 2HG1 VAL 64 -4.084 8.114 1.279 342 3HG1 VAL 64 3HG1 VAL 64 -2.439 8.487 0.757 343 1HG2 VAL 64 1HG2 VAL 64 -4.872 9.779 -0.459 344 2HG2 VAL 64 2HG2 VAL 64 -4.412 11.497 -0.318 345 3HG2 VAL 64 3HG2 VAL 64 -3.246 10.296 -0.876 346 H GLN 65 H GLN 65 -6.442 10.216 0.728 347 HA GLN 65 HA GLN 65 -7.190 7.732 2.074 348 1HB GLN 65 1HB GLN 65 -9.089 9.508 2.129 349 2HB GLN 65 2HB GLN 65 -9.077 9.422 0.364 350 1HG GLN 65 1HG GLN 65 -10.809 7.966 1.036 351 2HG GLN 65 2HG GLN 65 -9.482 6.853 0.672 352 1HE2 GLN 65 1HE2 GLN 65 -8.047 6.217 2.701 353 2HE2 GLN 65 2HE2 GLN 65 -8.783 6.406 4.250 354 H ILE 66 H ILE 66 -6.250 6.193 1.022 355 HA ILE 66 HA ILE 66 -6.902 6.153 -1.871 356 HB ILE 66 HB ILE 66 -4.963 4.771 -2.383 357 1HG1 ILE 66 1HG1 ILE 66 -2.923 5.448 -0.744 358 2HG1 ILE 66 2HG1 ILE 66 -4.183 5.306 0.454 359 1HG2 ILE 66 1HG2 ILE 66 -4.205 7.541 -1.447 360 2HG2 ILE 66 2HG2 ILE 66 -3.472 6.570 -2.754 361 3HG2 ILE 66 3HG2 ILE 66 -5.118 7.188 -2.930 362 1HD1 ILE 66 1HD1 ILE 66 -3.046 3.128 0.123 363 2HD1 ILE 66 2HD1 ILE 66 -4.672 2.963 -0.565 364 3HD1 ILE 66 3HD1 ILE 66 -3.295 3.228 -1.631 365 H MET 67 H MET 67 -8.249 4.667 -2.234 366 HA MET 67 HA MET 67 -8.709 2.429 -0.382 367 1HB MET 67 1HB MET 67 -10.495 3.721 -1.835 368 2HB MET 67 2HB MET 67 -9.853 2.779 -3.185 369 1HG MET 67 1HG MET 67 -10.407 0.690 -1.769 370 2HG MET 67 2HG MET 67 -11.201 1.813 -0.654 371 1HE MET 67 1HE MET 67 -11.253 1.787 -4.675 372 2HE MET 67 2HE MET 67 -11.252 0.084 -4.147 373 3HE MET 67 3HE MET 67 -12.704 0.788 -4.891 374 H TYR 68 H TYR 68 -8.362 0.220 -0.906 375 HA TYR 68 HA TYR 68 -6.588 -0.302 -3.272 376 1HB TYR 68 1HB TYR 68 -6.060 -0.878 -0.495 377 2HB TYR 68 2HB TYR 68 -6.429 -2.396 -1.281 378 HD1 TYR 68 HD1 TYR 68 -4.023 0.338 -0.975 379 HD2 TYR 68 HD2 TYR 68 -5.049 -3.156 -3.290 380 HE1 TYR 68 HE1 TYR 68 -1.682 0.157 -1.736 381 HE2 TYR 68 HE2 TYR 68 -2.686 -3.366 -4.007 382 HH TYR 68 HH TYR 68 -0.136 -1.122 -2.896 383 H ARG 69 H ARG 69 -7.058 -2.332 -4.326 384 HA ARG 69 HA ARG 69 -9.556 -3.685 -3.566 385 1HB ARG 69 1HB ARG 69 -10.213 -2.165 -5.366 386 2HB ARG 69 2HB ARG 69 -8.868 -2.767 -6.360 387 1HG ARG 69 1HG ARG 69 -9.838 -5.012 -6.432 388 2HG ARG 69 2HG ARG 69 -11.151 -4.542 -5.350 389 1HD ARG 69 1HD ARG 69 -10.587 -3.577 -8.179 390 2HD ARG 69 2HD ARG 69 -11.865 -4.692 -7.658 391 HE ARG 69 HE ARG 69 -12.395 -2.420 -6.180 392 1HH1 ARG 69 1HH1 ARG 69 -12.247 -3.293 -9.638 393 2HH1 ARG 69 2HH1 ARG 69 -13.526 -2.202 -10.068 394 1HH2 ARG 69 1HH2 ARG 69 -14.041 -1.235 -6.647 395 2HH2 ARG 69 2HH2 ARG 69 -14.630 -0.907 -8.282 396 H ALA 70 H ALA 70 -9.455 -5.851 -3.848 397 HA ALA 70 HA ALA 70 -7.801 -6.958 -5.950 398 1HB ALA 70 1HB ALA 70 -6.987 -8.788 -4.736 399 2HB ALA 70 2HB ALA 70 -6.720 -7.440 -3.610 400 3HB ALA 70 3HB ALA 70 -8.081 -8.536 -3.369 401 H LYS 71 H LYS 71 -8.954 -8.871 -6.744 402 HA LYS 71 HA LYS 71 -11.807 -9.222 -5.764 403 1HB LYS 71 1HB LYS 71 -11.172 -9.001 -8.661 404 2HB LYS 71 2HB LYS 71 -12.723 -9.345 -7.931 405 1HG LYS 71 1HG LYS 71 -11.194 -6.766 -7.398 406 2HG LYS 71 2HG LYS 71 -12.289 -7.064 -8.740 407 1HD LYS 71 1HD LYS 71 -13.744 -7.824 -6.491 408 2HD LYS 71 2HD LYS 71 -12.988 -6.284 -6.051 409 1HE LYS 71 1HE LYS 71 -13.838 -5.415 -8.372 410 2HE LYS 71 2HE LYS 71 -14.791 -6.897 -8.460 411 1HZ LYS 71 1HZ LYS 71 -15.993 -4.962 -7.594 412 2HZ LYS 71 2HZ LYS 71 -16.035 -6.169 -6.558 413 3HZ LYS 71 3HZ LYS 71 -15.028 -4.894 -6.280 414 H ASN 72 H ASN 72 -11.961 -11.591 -5.370 415 HA ASN 72 HA ASN 72 -9.912 -13.185 -6.739 416 1HB ASN 72 1HB ASN 72 -10.484 -13.801 -4.481 417 2HB ASN 72 2HB ASN 72 -12.127 -14.218 -5.003 418 1HD2 ASN 72 1HD2 ASN 72 -11.126 -16.395 -3.980 419 2HD2 ASN 72 2HD2 ASN 72 -10.524 -17.503 -5.225 420 H LEU 73 H LEU 73 -10.401 -12.693 -8.871 421 HA LEU 73 HA LEU 73 -12.754 -13.843 -10.179 422 1HB LEU 73 1HB LEU 73 -10.101 -12.868 -11.308 423 2HB LEU 73 2HB LEU 73 -11.536 -13.280 -12.249 424 HG LEU 73 HG LEU 73 -11.276 -10.987 -10.242 425 1HD1 LEU 73 1HD1 LEU 73 -11.500 -9.577 -12.267 426 2HD1 LEU 73 2HD1 LEU 73 -10.067 -10.621 -12.346 427 3HD1 LEU 73 3HD1 LEU 73 -11.524 -11.033 -13.278 428 1HD2 LEU 73 1HD2 LEU 73 -13.508 -10.272 -11.129 429 2HD2 LEU 73 2HD2 LEU 73 -13.648 -11.831 -11.966 430 3HD2 LEU 73 3HD2 LEU 73 -13.594 -11.762 -10.188 431 H ALA 74 H ALA 74 -12.382 -15.914 -8.926 432 HA ALA 74 HA ALA 74 -11.381 -17.836 -10.900 433 1HB ALA 74 1HB ALA 74 -10.500 -17.979 -7.974 434 2HB ALA 74 2HB ALA 74 -10.150 -19.177 -9.237 435 3HB ALA 74 3HB ALA 74 -9.440 -17.558 -9.331 436 H SER 75 H SER 75 -12.075 -20.086 -9.999 437 HA SER 75 HA SER 75 -14.806 -19.826 -8.763 438 1HB SER 75 1HB SER 75 -13.793 -22.049 -10.547 439 2HB SER 75 2HB SER 75 -15.420 -21.845 -9.881 440 HG SER 75 HG SER 75 -14.135 -20.411 -11.930 441 H THR 76 H THR 76 -11.945 -20.062 -7.577 442 HA THR 76 HA THR 76 -12.609 -22.040 -5.537 443 HB THR 76 HB THR 76 -10.074 -22.754 -5.811 444 HG1 THR 76 HG1 THR 76 -9.481 -21.247 -7.360 445 1HG2 THR 76 1HG2 THR 76 -11.992 -24.289 -6.334 446 2HG2 THR 76 2HG2 THR 76 -11.970 -23.686 -8.006 447 3HG2 THR 76 3HG2 THR 76 -10.568 -24.551 -7.361 448 HA PRO 77 HA PRO 77 -10.755 -18.964 -3.050 449 1HB PRO 77 1HB PRO 77 -9.315 -20.362 -1.126 450 2HB PRO 77 2HB PRO 77 -11.091 -20.247 -1.124 451 1HG PRO 77 1HG PRO 77 -9.397 -22.467 -2.289 452 2HG PRO 77 2HG PRO 77 -10.807 -22.620 -1.196 453 1HD PRO 77 1HD PRO 77 -11.105 -22.941 -3.845 454 2HD PRO 77 2HD PRO 77 -12.317 -21.999 -2.942 455 H THR 78 H THR 78 -8.703 -17.917 -2.623 456 HA THR 78 HA THR 78 -6.262 -19.207 -3.700 457 HB THR 78 HB THR 78 -6.050 -16.423 -4.332 458 HG1 THR 78 HG1 THR 78 -8.473 -16.698 -4.520 459 1HG2 THR 78 1HG2 THR 78 -6.389 -18.734 -6.204 460 2HG2 THR 78 2HG2 THR 78 -5.651 -17.146 -6.533 461 3HG2 THR 78 3HG2 THR 78 -4.849 -18.240 -5.398 462 H THR 79 H THR 79 -4.282 -18.036 -2.934 463 HA THR 79 HA THR 79 -4.728 -16.808 -0.265 464 HB THR 79 HB THR 79 -4.002 -19.078 -0.003 465 HG1 THR 79 HG1 THR 79 -3.270 -17.559 1.454 466 1HG2 THR 79 1HG2 THR 79 -1.854 -19.903 -0.689 467 2HG2 THR 79 2HG2 THR 79 -2.718 -19.392 -2.149 468 3HG2 THR 79 3HG2 THR 79 -1.429 -18.373 -1.462 469 H GLY 80 H GLY 80 -4.364 -14.711 -0.448 470 1HA GLY 80 1HA GLY 80 -2.199 -13.637 -2.106 471 2HA GLY 80 2HA GLY 80 -3.356 -12.751 -1.105 472 H GLN 81 H GLN 81 -0.273 -13.714 -1.224 473 HA GLN 81 HA GLN 81 0.080 -13.390 1.690 474 1HB GLN 81 1HB GLN 81 1.467 -15.420 -0.132 475 2HB GLN 81 2HB GLN 81 2.165 -14.946 1.409 476 1HG GLN 81 1HG GLN 81 -0.678 -16.052 1.152 477 2HG GLN 81 2HG GLN 81 0.712 -17.097 1.316 478 1HE2 GLN 81 1HE2 GLN 81 1.221 -14.160 3.098 479 2HE2 GLN 81 2HE2 GLN 81 0.733 -14.808 4.652 480 H ALA 82 H ALA 82 1.739 -13.522 -1.466 481 HA ALA 82 HA ALA 82 2.957 -11.994 -2.605 482 1HB ALA 82 1HB ALA 82 2.373 -9.623 -2.328 483 2HB ALA 82 2HB ALA 82 0.913 -10.611 -2.145 484 3HB ALA 82 3HB ALA 82 1.719 -9.935 -0.725 485 H THR 83 H THR 83 4.640 -10.075 -2.268 486 HA THR 83 HA THR 83 5.378 -9.787 0.502 487 HB THR 83 HB THR 83 7.829 -9.958 -1.130 488 HG1 THR 83 HG1 THR 83 6.640 -11.954 -1.562 489 1HG2 THR 83 1HG2 THR 83 8.715 -10.765 1.046 490 2HG2 THR 83 2HG2 THR 83 7.794 -9.262 1.269 491 3HG2 THR 83 3HG2 THR 83 7.061 -10.836 1.692 492 H PHE 84 H PHE 84 6.001 -7.668 0.938 493 HA PHE 84 HA PHE 84 6.079 -5.864 -1.423 494 1HB PHE 84 1HB PHE 84 5.394 -4.094 0.208 495 2HB PHE 84 2HB PHE 84 4.181 -5.275 -0.245 496 HD1 PHE 84 HD1 PHE 84 6.825 -5.277 2.512 497 HD2 PHE 84 HD2 PHE 84 2.638 -5.424 1.460 498 HE1 PHE 84 HE1 PHE 84 6.245 -5.510 4.863 499 HE2 PHE 84 HE2 PHE 84 2.058 -5.621 3.844 500 HZ PHE 84 HZ PHE 84 3.850 -5.648 5.568 501 H ASN 85 H ASN 85 7.442 -4.039 -1.254 502 HA ASN 85 HA ASN 85 9.490 -4.075 0.921 503 1HB ASN 85 1HB ASN 85 10.957 -4.563 -0.726 504 2HB ASN 85 2HB ASN 85 9.972 -3.911 -2.012 505 1HD2 ASN 85 1HD2 ASN 85 9.995 -1.592 -2.396 506 2HD2 ASN 85 2HD2 ASN 85 11.237 -0.539 -1.725 507 H VAL 86 H VAL 86 8.814 -2.540 2.212 508 HA VAL 86 HA VAL 86 7.013 -0.434 1.270 509 HB VAL 86 HB VAL 86 8.013 -0.907 4.098 510 1HG1 VAL 86 1HG1 VAL 86 5.432 0.278 2.969 511 2HG1 VAL 86 2HG1 VAL 86 5.770 -0.003 4.688 512 3HG1 VAL 86 3HG1 VAL 86 6.726 1.161 3.776 513 1HG2 VAL 86 1HG2 VAL 86 7.261 -3.066 3.489 514 2HG2 VAL 86 2HG2 VAL 86 5.958 -2.319 4.406 515 3HG2 VAL 86 3HG2 VAL 86 5.837 -2.431 2.642 516 H THR 87 H THR 87 9.293 0.326 -0.035 517 HA THR 87 HA THR 87 9.980 2.777 1.202 518 HB THR 87 HB THR 87 11.270 1.467 2.752 519 HG1 THR 87 HG1 THR 87 13.421 2.281 2.224 520 1HG2 THR 87 1HG2 THR 87 11.597 -0.536 1.465 521 2HG2 THR 87 2HG2 THR 87 12.710 0.306 0.361 522 3HG2 THR 87 3HG2 THR 87 13.153 0.060 2.063 523 HA PRO 88 HA PRO 88 11.678 3.431 -2.944 524 1HB PRO 88 1HB PRO 88 13.232 5.647 -2.477 525 2HB PRO 88 2HB PRO 88 11.468 5.696 -2.700 526 1HG PRO 88 1HG PRO 88 13.004 5.772 -0.111 527 2HG PRO 88 2HG PRO 88 11.580 6.729 -0.592 528 1HD PRO 88 1HD PRO 88 11.402 4.515 0.997 529 2HD PRO 88 2HD PRO 88 10.118 4.947 -0.136 530 H MET 89 H MET 89 13.492 3.449 0.091 531 HA MET 89 HA MET 89 15.174 1.440 -0.230 532 1HB MET 89 1HB MET 89 17.439 2.429 -0.734 533 2HB MET 89 2HB MET 89 16.372 2.148 -2.082 534 1HG MET 89 1HG MET 89 15.791 4.731 -1.846 535 2HG MET 89 2HG MET 89 17.292 4.766 -0.911 536 1HE MET 89 1HE MET 89 15.678 4.284 -4.422 537 2HE MET 89 2HE MET 89 17.091 3.872 -5.419 538 3HE MET 89 3HE MET 89 16.455 2.690 -4.260 539 H ALA 90 H ALA 90 16.167 4.784 0.599 540 HA ALA 90 HA ALA 90 17.421 4.043 2.984 541 1HB ALA 90 1HB ALA 90 17.584 6.400 3.436 542 2HB ALA 90 2HB ALA 90 17.727 6.217 1.674 543 3HB ALA 90 3HB ALA 90 16.192 6.771 2.417 544 H ALA 91 H ALA 91 14.157 5.289 2.425 545 HA ALA 91 HA ALA 91 13.822 6.073 5.162 546 1HB ALA 91 1HB ALA 91 11.596 6.844 4.387 547 2HB ALA 91 2HB ALA 91 12.968 7.401 3.399 548 3HB ALA 91 3HB ALA 91 11.927 6.105 2.795 549 H GLY 92 H GLY 92 10.992 4.594 3.792 550 1HA GLY 92 1HA GLY 92 9.714 2.866 4.437 551 2HA GLY 92 2HA GLY 92 11.151 2.040 5.064 552 H ALA 93 H ALA 93 11.935 3.564 7.191 553 HA ALA 93 HA ALA 93 10.310 3.013 9.315 554 1HB ALA 93 1HB ALA 93 12.177 5.405 9.009 555 2HB ALA 93 2HB ALA 93 11.557 4.769 10.546 556 3HB ALA 93 3HB ALA 93 12.623 3.770 9.539 557 H TYR 94 H TYR 94 10.485 6.178 7.690 558 HA TYR 94 HA TYR 94 8.160 7.248 9.014 559 1HB TYR 94 1HB TYR 94 9.647 8.328 6.598 560 2HB TYR 94 2HB TYR 94 8.644 9.246 7.728 561 HD1 TYR 94 HD1 TYR 94 11.997 8.482 6.973 562 HD2 TYR 94 HD2 TYR 94 9.299 8.880 10.314 563 HE1 TYR 94 HE1 TYR 94 13.922 8.857 8.495 564 HE2 TYR 94 HE2 TYR 94 11.216 9.147 11.831 565 HH TYR 94 HH TYR 94 13.458 9.753 11.908 566 H PHE 95 H PHE 95 8.011 4.806 6.837 567 HA PHE 95 HA PHE 95 6.010 5.996 5.076 568 1HB PHE 95 1HB PHE 95 7.527 4.090 4.293 569 2HB PHE 95 2HB PHE 95 6.742 3.042 5.465 570 HD1 PHE 95 HD1 PHE 95 4.196 2.582 5.241 571 HD2 PHE 95 HD2 PHE 95 6.681 4.045 2.054 572 HE1 PHE 95 HE1 PHE 95 2.315 2.327 3.661 573 HE2 PHE 95 HE2 PHE 95 4.774 3.866 0.486 574 HZ PHE 95 HZ PHE 95 2.571 3.048 1.293 575 H ASN 96 H ASN 96 4.112 6.525 5.939 576 HA ASN 96 HA ASN 96 3.390 5.178 8.378 577 1HB ASN 96 1HB ASN 96 2.262 7.565 6.991 578 2HB ASN 96 2HB ASN 96 1.397 6.803 8.329 579 1HD2 ASN 96 1HD2 ASN 96 4.858 7.780 7.620 580 2HD2 ASN 96 2HD2 ASN 96 5.170 8.379 9.201 581 H LYS 97 H LYS 97 3.186 3.125 7.394 582 HA LYS 97 HA LYS 97 0.803 2.231 6.091 583 1HB LYS 97 1HB LYS 97 1.272 0.128 7.006 584 2HB LYS 97 2HB LYS 97 2.861 0.855 6.797 585 1HG LYS 97 1HG LYS 97 1.283 0.540 9.397 586 2HG LYS 97 2HG LYS 97 2.695 -0.379 8.874 587 1HD LYS 97 1HD LYS 97 4.129 1.640 9.074 588 2HD LYS 97 2HD LYS 97 2.717 2.627 9.463 589 1HE LYS 97 1HE LYS 97 3.874 2.166 11.495 590 2HE LYS 97 2HE LYS 97 2.267 1.429 11.507 591 1HZ LYS 97 1HZ LYS 97 3.959 -0.033 12.377 592 2HZ LYS 97 2HZ LYS 97 3.298 -0.682 11.020 593 3HZ LYS 97 3HZ LYS 97 4.796 0.007 10.961 594 H VAL 98 H VAL 98 -1.110 1.227 7.261 595 HA VAL 98 HA VAL 98 -2.147 3.088 9.252 596 HB VAL 98 HB VAL 98 -3.435 0.584 8.092 597 1HG1 VAL 98 1HG1 VAL 98 -4.535 1.407 10.206 598 2HG1 VAL 98 2HG1 VAL 98 -4.619 3.031 9.503 599 3HG1 VAL 98 3HG1 VAL 98 -5.540 1.697 8.786 600 1HG2 VAL 98 1HG2 VAL 98 -4.637 2.190 6.636 601 2HG2 VAL 98 2HG2 VAL 98 -3.603 3.499 7.240 602 3HG2 VAL 98 3HG2 VAL 98 -2.906 2.171 6.288 603 H GLN 99 H GLN 99 -2.923 -0.331 9.807 604 HA GLN 99 HA GLN 99 -1.218 -0.609 12.128 605 1HB GLN 99 1HB GLN 99 -2.841 1.198 12.784 606 2HB GLN 99 2HB GLN 99 -4.182 0.099 12.443 607 1HG GLN 99 1HG GLN 99 -3.617 -1.276 14.342 608 2HG GLN 99 2HG GLN 99 -2.003 -0.537 14.474 609 1HE2 GLN 99 1HE2 GLN 99 -5.313 0.938 14.154 610 2HE2 GLN 99 2HE2 GLN 99 -5.152 1.882 15.620 611 H CYS 100 H CYS 100 -2.088 -2.564 13.399 612 HA CYS 100 HA CYS 100 -2.686 -4.716 13.509 613 1HB CYS 100 1HB CYS 100 -4.953 -3.677 12.795 614 2HB CYS 100 2HB CYS 100 -4.644 -4.400 11.204 615 HG CYS 100 HG CYS 100 -4.595 -5.863 14.179 616 H PHE 101 H PHE 101 -3.302 -6.568 11.226 617 HA PHE 101 HA PHE 101 -0.575 -7.145 10.741 618 1HB PHE 101 1HB PHE 101 -2.416 -8.791 11.128 619 2HB PHE 101 2HB PHE 101 -3.059 -8.407 9.531 620 HD1 PHE 101 HD1 PHE 101 0.294 -9.312 11.057 621 HD2 PHE 101 HD2 PHE 101 -2.589 -10.079 7.932 622 HE1 PHE 101 HE1 PHE 101 1.813 -10.991 10.060 623 HE2 PHE 101 HE2 PHE 101 -1.071 -11.777 6.963 624 HZ PHE 101 HZ PHE 101 1.144 -12.213 8.001 625 H CYS 102 H CYS 102 -2.622 -5.080 8.983 626 HA CYS 102 HA CYS 102 -2.345 -3.866 7.146 627 1HB CYS 102 1HB CYS 102 -0.056 -3.505 7.769 628 2HB CYS 102 2HB CYS 102 0.475 -5.011 6.984 629 HG CYS 102 HG CYS 102 -1.172 -2.570 5.520 630 H PHE 103 H PHE 103 -1.021 -7.123 6.445 631 HA PHE 103 HA PHE 103 -1.873 -7.306 3.736 632 1HB PHE 103 1HB PHE 103 -1.329 -9.406 5.849 633 2HB PHE 103 2HB PHE 103 -1.730 -9.799 4.192 634 HD1 PHE 103 HD1 PHE 103 0.934 -8.574 6.414 635 HD2 PHE 103 HD2 PHE 103 -0.219 -9.391 2.344 636 HE1 PHE 103 HE1 PHE 103 3.303 -8.433 5.695 637 HE2 PHE 103 HE2 PHE 103 2.103 -9.122 1.607 638 HZ PHE 103 HZ PHE 103 3.899 -8.666 3.291 639 H THR 104 H THR 104 -3.916 -6.234 4.008 640 HA THR 104 HA THR 104 -6.211 -7.590 5.130 641 HB THR 104 HB THR 104 -6.143 -5.321 3.098 642 HG1 THR 104 HG1 THR 104 -4.781 -4.898 4.965 643 1HG2 THR 104 1HG2 THR 104 -8.203 -4.611 4.210 644 2HG2 THR 104 2HG2 THR 104 -8.406 -6.280 3.647 645 3HG2 THR 104 3HG2 THR 104 -8.092 -5.957 5.362 646 H GLU 105 H GLU 105 -4.483 -7.726 2.132 647 HA GLU 105 HA GLU 105 -6.366 -8.856 0.383 648 1HB GLU 105 1HB GLU 105 -4.309 -9.824 -0.731 649 2HB GLU 105 2HB GLU 105 -4.441 -8.078 -0.544 650 1HG GLU 105 1HG GLU 105 -2.234 -8.336 -0.019 651 2HG GLU 105 2HG GLU 105 -2.866 -8.434 1.595 652 H THR 106 H THR 106 -3.957 -10.758 2.324 653 HA THR 106 HA THR 106 -4.030 -12.854 3.104 654 HB THR 106 HB THR 106 -5.272 -11.695 4.820 655 HG1 THR 106 HG1 THR 106 -6.104 -13.526 5.753 656 1HG2 THR 106 1HG2 THR 106 -7.288 -10.902 3.743 657 2HG2 THR 106 2HG2 THR 106 -7.814 -12.547 3.359 658 3HG2 THR 106 3HG2 THR 106 -7.744 -11.997 5.042 659 H THR 107 H THR 107 -6.510 -14.501 3.304 660 HA THR 107 HA THR 107 -6.364 -15.616 0.553 661 HB THR 107 HB THR 107 -6.059 -16.799 2.994 662 HG1 THR 107 HG1 THR 107 -6.765 -17.817 0.464 663 1HG2 THR 107 1HG2 THR 107 -8.496 -16.641 3.492 664 2HG2 THR 107 2HG2 THR 107 -8.841 -17.575 2.016 665 3HG2 THR 107 3HG2 THR 107 -7.935 -18.320 3.346 666 H LEU 108 H LEU 108 -8.232 -16.013 -0.693 667 HA LEU 108 HA LEU 108 -10.801 -14.878 0.327 668 1HB LEU 108 1HB LEU 108 -9.554 -14.249 -2.370 669 2HB LEU 108 2HB LEU 108 -11.196 -13.882 -1.908 670 HG LEU 108 HG LEU 108 -8.742 -12.667 -0.640 671 1HD1 LEU 108 1HD1 LEU 108 -9.184 -12.034 -3.050 672 2HD1 LEU 108 2HD1 LEU 108 -10.763 -11.406 -2.547 673 3HD1 LEU 108 3HD1 LEU 108 -9.261 -10.684 -1.918 674 1HD2 LEU 108 1HD2 LEU 108 -10.312 -11.058 0.382 675 2HD2 LEU 108 2HD2 LEU 108 -11.688 -11.945 -0.305 676 3HD2 LEU 108 3HD2 LEU 108 -10.666 -12.695 0.937 677 H GLU 109 H GLU 109 -12.252 -16.445 0.133 678 HA GLU 109 HA GLU 109 -12.480 -18.550 -1.666 679 1HB GLU 109 1HB GLU 109 -14.424 -16.754 -0.191 680 2HB GLU 109 2HB GLU 109 -15.007 -18.070 -1.180 681 1HG GLU 109 1HG GLU 109 -14.805 -18.771 1.154 682 2HG GLU 109 2HG GLU 109 -13.732 -19.715 0.113 683 HA PRO 110 HA PRO 110 -13.153 -16.861 -5.591 684 1HB PRO 110 1HB PRO 110 -15.004 -18.423 -6.827 685 2HB PRO 110 2HB PRO 110 -13.395 -18.936 -6.293 686 1HG PRO 110 1HG PRO 110 -16.034 -19.298 -4.852 687 2HG PRO 110 2HG PRO 110 -14.820 -20.565 -5.201 688 1HD PRO 110 1HD PRO 110 -14.947 -19.275 -2.829 689 2HD PRO 110 2HD PRO 110 -13.373 -19.738 -3.513 690 H GLY 111 H GLY 111 -13.920 -14.925 -6.186 691 1HA GLY 111 1HA GLY 111 -15.569 -13.603 -7.167 692 2HA GLY 111 2HA GLY 111 -16.857 -14.477 -6.320 693 H GLU 112 H GLU 112 -14.224 -13.841 -4.207 694 HA GLU 112 HA GLU 112 -15.859 -12.006 -2.807 695 1HB GLU 112 1HB GLU 112 -13.114 -13.197 -2.424 696 2HB GLU 112 2HB GLU 112 -13.845 -12.112 -1.258 697 1HG GLU 112 1HG GLU 112 -15.062 -14.707 -2.104 698 2HG GLU 112 2HG GLU 112 -14.200 -14.393 -0.598 699 H GLU 113 H GLU 113 -15.697 -9.839 -2.604 700 HA GLU 113 HA GLU 113 -13.822 -8.372 -4.378 701 1HB GLU 113 1HB GLU 113 -16.500 -7.609 -3.148 702 2HB GLU 113 2HB GLU 113 -15.515 -6.562 -4.195 703 1HG GLU 113 1HG GLU 113 -15.753 -8.124 -5.962 704 2HG GLU 113 2HG GLU 113 -16.631 -9.200 -4.917 705 H MET 114 H MET 114 -11.976 -8.266 -3.104 706 HA MET 114 HA MET 114 -12.156 -7.266 -0.330 707 1HB MET 114 1HB MET 114 -10.742 -9.155 -1.077 708 2HB MET 114 2HB MET 114 -9.808 -8.102 -2.114 709 1HG MET 114 1HG MET 114 -10.038 -7.709 0.926 710 2HG MET 114 2HG MET 114 -8.906 -8.803 0.157 711 1HE MET 114 1HE MET 114 -9.769 -4.820 0.116 712 2HE MET 114 2HE MET 114 -9.217 -5.418 1.685 713 3HE MET 114 3HE MET 114 -8.172 -4.362 0.711 714 H GLU 115 H GLU 115 -13.064 -5.077 -0.927 715 HA GLU 115 HA GLU 115 -10.752 -3.379 -1.591 716 1HB GLU 115 1HB GLU 115 -12.185 -1.772 -2.846 717 2HB GLU 115 2HB GLU 115 -11.783 -3.284 -3.643 718 1HG GLU 115 1HG GLU 115 -14.085 -4.159 -3.021 719 2HG GLU 115 2HG GLU 115 -14.481 -2.499 -2.536 720 H MET 116 H MET 116 -10.392 -1.674 -0.388 721 HA MET 116 HA MET 116 -12.339 -0.867 1.649 722 1HB MET 116 1HB MET 116 -9.738 -2.316 2.356 723 2HB MET 116 2HB MET 116 -10.747 -1.434 3.507 724 1HG MET 116 1HG MET 116 -12.659 -2.966 2.924 725 2HG MET 116 2HG MET 116 -11.518 -3.935 1.973 726 1HE MET 116 1HE MET 116 -13.368 -5.155 4.191 727 2HE MET 116 2HE MET 116 -12.193 -6.100 3.239 728 3HE MET 116 3HE MET 116 -12.214 -6.235 5.012 729 HA PRO 117 HA PRO 117 -9.786 2.848 1.250 730 1HB PRO 117 1HB PRO 117 -10.542 4.266 3.380 731 2HB PRO 117 2HB PRO 117 -11.616 3.974 1.980 732 1HG PRO 117 1HG PRO 117 -11.550 2.482 4.616 733 2HG PRO 117 2HG PRO 117 -12.940 3.164 3.716 734 1HD PRO 117 1HD PRO 117 -12.211 0.512 3.561 735 2HD PRO 117 2HD PRO 117 -12.949 1.384 2.183 736 H VAL 118 H VAL 118 -7.776 3.513 2.010 737 HA VAL 118 HA VAL 118 -7.053 2.946 4.791 738 HB VAL 118 HB VAL 118 -4.755 2.335 4.182 739 1HG1 VAL 118 1HG1 VAL 118 -6.408 0.577 4.788 740 2HG1 VAL 118 2HG1 VAL 118 -6.757 0.339 3.060 741 3HG1 VAL 118 3HG1 VAL 118 -5.139 -0.011 3.696 742 1HG2 VAL 118 1HG2 VAL 118 -4.693 3.226 1.892 743 2HG2 VAL 118 2HG2 VAL 118 -4.087 1.568 2.028 744 3HG2 VAL 118 3HG2 VAL 118 -5.704 1.847 1.361 745 H VAL 119 H VAL 119 -5.301 4.337 5.505 746 HA VAL 119 HA VAL 119 -5.101 6.850 3.941 747 HB VAL 119 HB VAL 119 -5.010 8.080 5.969 748 1HG1 VAL 119 1HG1 VAL 119 -7.259 7.683 5.064 749 2HG1 VAL 119 2HG1 VAL 119 -7.440 6.250 6.103 750 3HG1 VAL 119 3HG1 VAL 119 -7.286 7.862 6.822 751 1HG2 VAL 119 1HG2 VAL 119 -5.466 5.468 7.504 752 2HG2 VAL 119 2HG2 VAL 119 -3.948 6.388 7.485 753 3HG2 VAL 119 3HG2 VAL 119 -5.399 7.094 8.204 754 H PHE 120 H PHE 120 -3.094 8.067 4.424 755 HA PHE 120 HA PHE 120 -0.818 6.676 5.476 756 1HB PHE 120 1HB PHE 120 -0.818 5.394 3.485 757 2HB PHE 120 2HB PHE 120 -1.326 6.749 2.492 758 HD1 PHE 120 HD1 PHE 120 1.589 5.101 4.050 759 HD2 PHE 120 HD2 PHE 120 0.187 8.524 1.854 760 HE1 PHE 120 HE1 PHE 120 3.928 5.771 3.597 761 HE2 PHE 120 HE2 PHE 120 2.502 9.174 1.374 762 HZ PHE 120 HZ PHE 120 4.406 7.832 2.279 763 H PHE 121 H PHE 121 1.070 8.087 5.411 764 HA PHE 121 HA PHE 121 0.980 10.856 4.649 765 1HB PHE 121 1HB PHE 121 0.775 11.716 6.999 766 2HB PHE 121 2HB PHE 121 -0.711 11.275 6.195 767 HD1 PHE 121 HD1 PHE 121 -1.997 9.291 6.903 768 HD2 PHE 121 HD2 PHE 121 1.418 10.713 9.072 769 HE1 PHE 121 HE1 PHE 121 -2.676 7.910 8.867 770 HE2 PHE 121 HE2 PHE 121 0.775 9.331 11.018 771 HZ PHE 121 HZ PHE 121 -1.296 7.922 10.921 772 H VAL 122 H VAL 122 3.222 10.459 4.085 773 HA VAL 122 HA VAL 122 5.069 9.248 5.806 774 HB VAL 122 HB VAL 122 5.461 9.759 3.423 775 1HG1 VAL 122 1HG1 VAL 122 6.278 11.930 2.719 776 2HG1 VAL 122 2HG1 VAL 122 4.632 12.111 3.357 777 3HG1 VAL 122 3HG1 VAL 122 6.039 12.621 4.317 778 1HG2 VAL 122 1HG2 VAL 122 7.373 9.205 4.956 779 2HG2 VAL 122 2HG2 VAL 122 7.839 10.231 3.590 780 3HG2 VAL 122 3HG2 VAL 122 7.643 10.938 5.198 781 H ASP 123 H ASP 123 6.353 9.925 7.570 782 HA ASP 123 HA ASP 123 5.555 12.337 8.930 783 1HB ASP 123 1HB ASP 123 8.187 10.868 9.351 784 2HB ASP 123 2HB ASP 123 7.454 12.071 10.418 785 HA PRO 124 HA PRO 124 8.128 15.270 6.571 786 1HB PRO 124 1HB PRO 124 8.530 17.156 8.639 787 2HB PRO 124 2HB PRO 124 7.209 17.149 7.457 788 1HG PRO 124 1HG PRO 124 7.185 16.190 10.287 789 2HG PRO 124 2HG PRO 124 5.869 16.929 9.324 790 1HD PRO 124 1HD PRO 124 5.980 14.284 9.888 791 2HD PRO 124 2HD PRO 124 5.269 14.896 8.369 792 H GLU 125 H GLU 125 8.978 13.967 9.769 793 HA GLU 125 HA GLU 125 11.580 14.602 10.092 794 1HB GLU 125 1HB GLU 125 10.150 13.322 11.653 795 2HB GLU 125 2HB GLU 125 10.208 11.906 10.577 796 1HG GLU 125 1HG GLU 125 12.575 11.731 10.823 797 2HG GLU 125 2HG GLU 125 12.642 13.283 11.689 798 H ILE 126 H ILE 126 10.289 12.446 7.511 799 HA ILE 126 HA ILE 126 12.620 11.098 6.877 800 HB ILE 126 HB ILE 126 10.404 10.822 5.847 801 1HG1 ILE 126 1HG1 ILE 126 12.636 11.218 3.803 802 2HG1 ILE 126 2HG1 ILE 126 12.610 9.879 4.944 803 1HG2 ILE 126 1HG2 ILE 126 9.636 12.189 4.024 804 2HG2 ILE 126 2HG2 ILE 126 10.037 13.312 5.324 805 3HG2 ILE 126 3HG2 ILE 126 11.153 13.096 3.961 806 1HD1 ILE 126 1HD1 ILE 126 10.356 9.242 4.154 807 2HD1 ILE 126 2HD1 ILE 126 10.516 10.442 2.840 808 3HD1 ILE 126 3HD1 ILE 126 11.648 9.077 2.943 809 H VAL 127 H VAL 127 11.934 14.575 6.233 810 HA VAL 127 HA VAL 127 14.593 14.773 4.863 811 HB VAL 127 HB VAL 127 13.959 17.170 4.539 812 1HG1 VAL 127 1HG1 VAL 127 12.291 15.021 3.190 813 2HG1 VAL 127 2HG1 VAL 127 12.607 16.652 2.561 814 3HG1 VAL 127 3HG1 VAL 127 13.946 15.506 2.762 815 1HG2 VAL 127 1HG2 VAL 127 12.045 17.229 6.207 816 2HG2 VAL 127 2HG2 VAL 127 11.658 17.840 4.590 817 3HG2 VAL 127 3HG2 VAL 127 11.112 16.227 5.066 818 H LYS 128 H LYS 128 15.067 13.857 7.168 819 HA LYS 128 HA LYS 128 16.562 16.072 8.253 820 1HB LYS 128 1HB LYS 128 15.941 16.464 10.200 821 2HB LYS 128 2HB LYS 128 14.369 15.978 9.531 822 1HG LYS 128 1HG LYS 128 14.560 13.837 10.542 823 2HG LYS 128 2HG LYS 128 16.188 14.191 11.147 824 1HD LYS 128 1HD LYS 128 13.516 15.471 11.934 825 2HD LYS 128 2HD LYS 128 14.478 14.392 12.939 826 1HE LYS 128 1HE LYS 128 15.096 17.267 12.116 827 2HE LYS 128 2HE LYS 128 14.762 16.654 13.735 828 1HZ LYS 128 1HZ LYS 128 17.099 17.006 13.424 829 2HZ LYS 128 2HZ LYS 128 16.819 15.395 13.614 830 3HZ LYS 128 3HZ LYS 128 17.139 16.008 12.118 831 HA PRO 129 HA PRO 129 19.093 12.612 9.917 832 1HB PRO 129 1HB PRO 129 18.670 9.987 9.472 833 2HB PRO 129 2HB PRO 129 17.798 10.875 10.745 834 1HG PRO 129 1HG PRO 129 16.867 10.277 7.926 835 2HG PRO 129 2HG PRO 129 16.000 9.958 9.448 836 1HD PRO 129 1HD PRO 129 15.427 12.184 8.112 837 2HD PRO 129 2HD PRO 129 15.601 12.165 9.878 838 H VAL 130 H VAL 130 20.904 11.238 8.971 839 HA VAL 130 HA VAL 130 21.700 12.555 6.543 840 HB VAL 130 HB VAL 130 22.975 10.382 8.261 841 1HG1 VAL 130 1HG1 VAL 130 24.145 12.108 6.047 842 2HG1 VAL 130 2HG1 VAL 130 25.085 11.083 7.159 843 3HG1 VAL 130 3HG1 VAL 130 23.949 10.338 6.027 844 1HG2 VAL 130 1HG2 VAL 130 23.404 13.404 8.162 845 2HG2 VAL 130 2HG2 VAL 130 22.650 12.505 9.496 846 3HG2 VAL 130 3HG2 VAL 130 24.358 12.255 9.122 847 H GLU 131 H GLU 131 20.833 9.318 7.557 848 HA GLU 131 HA GLU 131 21.202 7.637 5.429 849 1HB GLU 131 1HB GLU 131 18.766 7.735 7.226 850 2HB GLU 131 2HB GLU 131 19.399 6.356 6.308 851 1HG GLU 131 1HG GLU 131 20.484 5.897 8.223 852 2HG GLU 131 2HG GLU 131 21.677 7.040 7.661 853 H THR 132 H THR 132 18.408 9.880 5.784 854 HA THR 132 HA THR 132 17.444 8.963 3.172 855 HB THR 132 HB THR 132 15.487 10.506 3.881 856 HG1 THR 132 HG1 THR 132 15.635 11.414 5.842 857 1HG2 THR 132 1HG2 THR 132 16.301 8.280 5.821 858 2HG2 THR 132 2HG2 THR 132 14.683 8.982 5.678 859 3HG2 THR 132 3HG2 THR 132 15.374 8.071 4.321 860 H GLN 133 H GLN 133 18.255 11.962 4.858 861 HA GLN 133 HA GLN 133 18.133 14.128 3.944 862 1HB GLN 133 1HB GLN 133 20.428 13.046 4.777 863 2HB GLN 133 2HB GLN 133 20.923 13.274 3.132 864 1HG GLN 133 1HG GLN 133 21.609 15.191 4.401 865 2HG GLN 133 2HG GLN 133 20.312 15.716 3.323 866 1HE2 GLN 133 1HE2 GLN 133 19.176 13.847 6.085 867 2HE2 GLN 133 2HE2 GLN 133 18.769 15.184 7.100 868 H GLY 134 H GLY 134 16.602 13.510 2.069 869 1HA GLY 134 1HA GLY 134 16.811 14.919 -0.180 870 2HA GLY 134 2HA GLY 134 17.930 13.604 -0.588 871 H ILE 135 H ILE 135 16.600 11.470 0.800 872 HA ILE 135 HA ILE 135 14.685 10.645 -1.128 873 HB ILE 135 HB ILE 135 15.105 9.723 1.739 874 1HG1 ILE 135 1HG1 ILE 135 17.029 9.129 0.421 875 2HG1 ILE 135 2HG1 ILE 135 15.994 7.692 0.511 876 1HG2 ILE 135 1HG2 ILE 135 13.304 8.527 -0.416 877 2HG2 ILE 135 2HG2 ILE 135 13.789 7.709 1.087 878 3HG2 ILE 135 3HG2 ILE 135 12.815 9.171 1.143 879 1HD1 ILE 135 1HD1 ILE 135 16.306 9.520 -1.853 880 2HD1 ILE 135 2HD1 ILE 135 16.728 7.796 -1.687 881 3HD1 ILE 135 3HD1 ILE 135 15.020 8.294 -1.694 882 H LYS 136 H LYS 136 12.943 11.609 -1.651 883 HA LYS 136 HA LYS 136 10.806 11.684 0.288 884 1HB LYS 136 1HB LYS 136 10.175 13.969 -0.048 885 2HB LYS 136 2HB LYS 136 11.694 13.838 0.807 886 1HG LYS 136 1HG LYS 136 12.897 14.856 -0.803 887 2HG LYS 136 2HG LYS 136 12.071 14.029 -2.119 888 1HD LYS 136 1HD LYS 136 10.038 15.401 -1.785 889 2HD LYS 136 2HD LYS 136 10.772 16.211 -0.390 890 1HE LYS 136 1HE LYS 136 12.440 17.281 -1.875 891 2HE LYS 136 2HE LYS 136 11.712 16.479 -3.282 892 1HZ LYS 136 1HZ LYS 136 10.301 18.387 -1.492 893 2HZ LYS 136 2HZ LYS 136 10.892 18.758 -2.967 894 3HZ LYS 136 3HZ LYS 136 9.653 17.691 -2.797 895 H THR 137 H THR 137 10.856 9.854 -1.498 896 HA THR 137 HA THR 137 8.459 10.550 -2.812 897 HB THR 137 HB THR 137 10.134 9.031 -4.782 898 HG1 THR 137 HG1 THR 137 10.543 11.802 -4.194 899 1HG2 THR 137 1HG2 THR 137 8.316 11.423 -5.060 900 2HG2 THR 137 2HG2 THR 137 8.916 10.371 -6.362 901 3HG2 THR 137 3HG2 THR 137 7.808 9.713 -5.127 902 H LEU 138 H LEU 138 7.635 9.221 -1.297 903 HA LEU 138 HA LEU 138 9.025 6.759 -0.664 904 1HB LEU 138 1HB LEU 138 7.223 8.443 0.652 905 2HB LEU 138 2HB LEU 138 6.268 6.986 0.357 906 HG LEU 138 HG LEU 138 8.157 5.718 1.402 907 1HD1 LEU 138 1HD1 LEU 138 9.712 6.962 2.889 908 2HD1 LEU 138 2HD1 LEU 138 10.034 7.305 1.189 909 3HD1 LEU 138 3HD1 LEU 138 9.138 8.483 2.165 910 1HD2 LEU 138 1HD2 LEU 138 6.153 6.301 2.776 911 2HD2 LEU 138 2HD2 LEU 138 7.622 6.436 3.753 912 3HD2 LEU 138 3HD2 LEU 138 6.840 7.881 3.116 913 H THR 139 H THR 139 7.983 4.586 -0.737 914 HA THR 139 HA THR 139 5.861 4.297 -2.565 915 HB THR 139 HB THR 139 7.757 4.509 -4.198 916 HG1 THR 139 HG1 THR 139 6.060 3.124 -4.779 917 1HG2 THR 139 1HG2 THR 139 9.429 2.774 -4.332 918 2HG2 THR 139 2HG2 THR 139 9.481 3.580 -2.737 919 3HG2 THR 139 3HG2 THR 139 8.759 1.953 -2.908 920 H LEU 140 H LEU 140 5.413 1.989 -2.825 921 HA LEU 140 HA LEU 140 6.306 0.193 -0.703 922 1HB LEU 140 1HB LEU 140 4.324 1.111 0.379 923 2HB LEU 140 2HB LEU 140 3.453 1.223 -1.156 924 HG LEU 140 HG LEU 140 3.293 -1.297 -1.209 925 1HD1 LEU 140 1HD1 LEU 140 4.268 -1.079 1.649 926 2HD1 LEU 140 2HD1 LEU 140 3.697 -2.541 0.831 927 3HD1 LEU 140 3HD1 LEU 140 5.213 -1.772 0.306 928 1HD2 LEU 140 1HD2 LEU 140 2.125 0.144 1.206 929 2HD2 LEU 140 2HD2 LEU 140 1.436 0.108 -0.431 930 3HD2 LEU 140 3HD2 LEU 140 1.530 -1.383 0.522 931 H SER 141 H SER 141 7.252 -1.071 -2.277 932 HA SER 141 HA SER 141 5.866 -1.587 -4.848 933 1HB SER 141 1HB SER 141 7.929 -2.858 -5.285 934 2HB SER 141 2HB SER 141 8.197 -1.131 -5.001 935 HG SER 141 HG SER 141 8.372 -3.173 -3.046 936 H TYR 142 H TYR 142 4.077 -2.712 -4.239 937 HA TYR 142 HA TYR 142 4.232 -5.062 -2.480 938 1HB TYR 142 1HB TYR 142 2.173 -3.289 -3.303 939 2HB TYR 142 2HB TYR 142 1.786 -4.808 -4.087 940 HD1 TYR 142 HD1 TYR 142 0.957 -2.955 -1.356 941 HD2 TYR 142 HD2 TYR 142 2.193 -6.962 -2.365 942 HE1 TYR 142 HE1 TYR 142 -0.301 -3.839 0.586 943 HE2 TYR 142 HE2 TYR 142 0.950 -7.828 -0.409 944 HH TYR 142 HH TYR 142 -0.341 -7.307 1.425 945 H THR 143 H THR 143 4.641 -7.127 -3.267 946 HA THR 143 HA THR 143 4.506 -7.556 -6.211 947 HB THR 143 HB THR 143 6.375 -9.225 -4.607 948 HG1 THR 143 HG1 THR 143 6.773 -7.298 -3.646 949 1HG2 THR 143 1HG2 THR 143 7.774 -8.913 -6.578 950 2HG2 THR 143 2HG2 THR 143 6.128 -9.317 -7.114 951 3HG2 THR 143 3HG2 THR 143 6.703 -7.638 -7.189 952 H PHE 144 H PHE 144 2.536 -8.371 -6.331 953 HA PHE 144 HA PHE 144 1.633 -10.591 -4.637 954 1HB PHE 144 1HB PHE 144 0.485 -8.797 -6.789 955 2HB PHE 144 2HB PHE 144 -0.342 -10.214 -6.260 956 HD1 PHE 144 HD1 PHE 144 0.257 -6.736 -5.650 957 HD2 PHE 144 HD2 PHE 144 -0.950 -10.430 -3.770 958 HE1 PHE 144 HE1 PHE 144 -0.930 -5.474 -3.872 959 HE2 PHE 144 HE2 PHE 144 -2.107 -9.168 -2.044 960 HZ PHE 144 HZ PHE 144 -1.942 -6.677 -1.956 961 H TYR 145 H TYR 145 3.188 -12.156 -5.237 962 HA TYR 145 HA TYR 145 2.534 -13.553 -7.771 963 1HB TYR 145 1HB TYR 145 4.789 -14.014 -8.279 964 2HB TYR 145 2HB TYR 145 4.634 -12.279 -8.055 965 HD1 TYR 145 HD1 TYR 145 5.327 -11.281 -5.779 966 HD2 TYR 145 HD2 TYR 145 6.508 -15.188 -7.117 967 HE1 TYR 145 HE1 TYR 145 7.096 -11.352 -4.018 968 HE2 TYR 145 HE2 TYR 145 8.318 -15.226 -5.435 969 HH TYR 145 HH TYR 145 9.314 -14.116 -3.665 970 HA PRO 146 HA PRO 146 3.141 -16.227 -3.846 971 1HB PRO 146 1HB PRO 146 0.664 -16.620 -2.742 972 2HB PRO 146 2HB PRO 146 1.724 -15.235 -2.409 973 1HG PRO 146 1HG PRO 146 -0.591 -15.331 -4.362 974 2HG PRO 146 2HG PRO 146 -0.239 -14.086 -3.155 975 1HD PRO 146 1HD PRO 146 0.546 -13.821 -5.770 976 2HD PRO 146 2HD PRO 146 1.470 -13.178 -4.368 977 H ARG 147 H ARG 147 -0.194 -17.085 -4.981 978 HA ARG 147 HA ARG 147 0.800 -19.603 -6.100 979 1HB ARG 147 1HB ARG 147 -0.174 -19.276 -3.308 980 2HB ARG 147 2HB ARG 147 -0.937 -20.603 -4.170 981 1HG ARG 147 1HG ARG 147 2.062 -20.395 -4.332 982 2HG ARG 147 2HG ARG 147 1.329 -20.894 -2.818 983 1HD ARG 147 1HD ARG 147 1.964 -22.779 -4.328 984 2HD ARG 147 2HD ARG 147 0.278 -22.796 -3.764 985 HE ARG 147 HE ARG 147 0.200 -21.499 -6.233 986 1HH1 ARG 147 1HH1 ARG 147 1.194 -24.661 -5.068 987 2HH1 ARG 147 2HH1 ARG 147 0.738 -25.521 -6.506 988 1HH2 ARG 147 1HH2 ARG 147 -0.539 -22.624 -8.153 989 2HH2 ARG 147 2HH2 ARG 147 -0.216 -24.315 -8.307 990 H GLU 148 H GLU 148 -0.229 -18.999 -7.929 991 HA GLU 148 HA GLU 148 -3.134 -18.695 -8.076 992 1HB GLU 148 1HB GLU 148 -1.895 -17.581 -9.714 993 2HB GLU 148 2HB GLU 148 -0.822 -18.964 -10.005 994 1HG GLU 148 1HG GLU 148 -2.215 -18.682 -11.908 995 2HG GLU 148 2HG GLU 148 -2.688 -20.178 -11.113 996 HA PRO 149 HA PRO 149 -3.232 -23.317 -7.956 997 1HB PRO 149 1HB PRO 149 -5.900 -23.688 -7.639 998 2HB PRO 149 2HB PRO 149 -4.854 -23.143 -6.297 999 1HG PRO 149 1HG PRO 149 -6.578 -21.426 -8.104 1000 2HG PRO 149 2HG PRO 149 -6.495 -21.399 -6.321 1001 1HD PRO 149 1HD PRO 149 -5.083 -19.657 -7.858 1002 2HD PRO 149 2HD PRO 149 -4.400 -20.329 -6.347 1003 H SER 150 H SER 150 -5.011 -21.002 -9.964 1004 HA SER 150 HA SER 150 -5.034 -21.378 -12.383 1005 1HB SER 150 1HB SER 150 -6.439 -23.955 -11.535 1006 2HB SER 150 2HB SER 150 -6.608 -23.216 -13.132 1007 HG SER 150 HG SER 150 -4.226 -24.132 -11.948 1008 H LYS 151 H LYS 151 -6.793 -20.394 -13.355 1009 HA LYS 151 HA LYS 151 -9.146 -19.688 -11.626 1010 1HB LYS 151 1HB LYS 151 -9.224 -17.669 -13.219 1011 2HB LYS 151 2HB LYS 151 -8.052 -17.702 -11.907 1012 1HG LYS 151 1HG LYS 151 -6.242 -18.237 -13.315 1013 2HG LYS 151 2HG LYS 151 -7.283 -18.624 -14.700 1014 1HD LYS 151 1HD LYS 151 -7.780 -16.424 -15.179 1015 2HD LYS 151 2HD LYS 151 -7.409 -15.820 -13.574 1016 1HE LYS 151 1HE LYS 151 -5.312 -16.961 -15.493 1017 2HE LYS 151 2HE LYS 151 -5.701 -15.238 -15.381 1018 1HZ LYS 151 1HZ LYS 151 -3.768 -15.887 -14.042 1019 2HZ LYS 151 2HZ LYS 151 -4.957 -15.226 -13.128 1020 3HZ LYS 151 3HZ LYS 151 -4.698 -16.824 -13.076 Start of MODEL 22 1 H VAL 21 H VAL 21 -0.859 10.517 14.511 2 HA VAL 21 HA VAL 21 -2.413 8.291 15.793 3 HB VAL 21 HB VAL 21 -3.073 11.240 15.576 4 1HG1 VAL 21 1HG1 VAL 21 -4.793 10.619 17.359 5 2HG1 VAL 21 2HG1 VAL 21 -5.171 10.107 15.729 6 3HG1 VAL 21 3HG1 VAL 21 -4.528 8.927 16.907 7 1HG2 VAL 21 1HG2 VAL 21 -2.703 11.270 18.038 8 2HG2 VAL 21 2HG2 VAL 21 -2.111 9.598 17.951 9 3HG2 VAL 21 3HG2 VAL 21 -1.221 10.917 17.157 10 H GLU 22 H GLU 22 -4.815 8.499 14.634 11 HA GLU 22 HA GLU 22 -4.454 8.570 11.713 12 1HB GLU 22 1HB GLU 22 -6.043 7.028 12.899 13 2HB GLU 22 2HB GLU 22 -7.064 8.429 13.269 14 1HG GLU 22 1HG GLU 22 -7.343 8.880 10.869 15 2HG GLU 22 2HG GLU 22 -6.181 7.610 10.456 16 H GLN 23 H GLN 23 -3.339 10.607 12.155 17 HA GLN 23 HA GLN 23 -3.897 12.848 11.165 18 1HB GLN 23 1HB GLN 23 -5.460 12.919 13.731 19 2HB GLN 23 2HB GLN 23 -4.590 14.364 13.244 20 1HG GLN 23 1HG GLN 23 -6.498 12.981 11.317 21 2HG GLN 23 2HG GLN 23 -6.997 14.216 12.468 22 1HE2 GLN 23 1HE2 GLN 23 -4.817 13.638 9.611 23 2HE2 GLN 23 2HE2 GLN 23 -4.935 15.247 9.027 24 H ALA 24 H ALA 24 -2.487 14.596 11.737 25 HA ALA 24 HA ALA 24 -0.228 13.806 13.466 26 1HB ALA 24 1HB ALA 24 1.293 13.568 11.545 27 2HB ALA 24 2HB ALA 24 -0.088 12.470 11.288 28 3HB ALA 24 3HB ALA 24 -0.023 14.012 10.437 29 H SER 25 H SER 25 -2.114 16.001 13.345 30 HA SER 25 HA SER 25 -1.394 17.854 11.519 31 1HB SER 25 1HB SER 25 -3.319 18.362 13.785 32 2HB SER 25 2HB SER 25 -3.474 18.809 12.069 33 HG SER 25 HG SER 25 -4.630 16.945 12.098 34 H ASP 26 H ASP 26 -0.181 17.609 14.568 35 HA ASP 26 HA ASP 26 0.577 20.342 15.038 36 1HB ASP 26 1HB ASP 26 2.152 17.891 15.908 37 2HB ASP 26 2HB ASP 26 1.946 19.421 16.764 38 H LEU 27 H LEU 27 1.815 17.604 13.131 39 HA LEU 27 HA LEU 27 4.261 19.096 12.324 40 1HB LEU 27 1HB LEU 27 3.499 16.183 12.610 41 2HB LEU 27 2HB LEU 27 4.796 16.671 11.537 42 HG LEU 27 HG LEU 27 6.012 17.771 13.373 43 1HD1 LEU 27 1HD1 LEU 27 3.810 16.595 15.120 44 2HD1 LEU 27 2HD1 LEU 27 5.384 17.138 15.734 45 3HD1 LEU 27 3HD1 LEU 27 4.298 18.313 15.008 46 1HD2 LEU 27 1HD2 LEU 27 6.501 15.476 12.729 47 2HD2 LEU 27 2HD2 LEU 27 6.630 15.606 14.491 48 3HD2 LEU 27 3HD2 LEU 27 5.174 14.881 13.753 49 H ILE 28 H ILE 28 1.235 19.125 11.117 50 HA ILE 28 HA ILE 28 1.917 18.338 8.349 51 HB ILE 28 HB ILE 28 -0.518 19.652 9.586 52 1HG1 ILE 28 1HG1 ILE 28 0.139 16.951 8.292 53 2HG1 ILE 28 2HG1 ILE 28 -0.014 17.243 9.991 54 1HG2 ILE 28 1HG2 ILE 28 -0.163 18.687 6.730 55 2HG2 ILE 28 2HG2 ILE 28 -1.626 19.383 7.443 56 3HG2 ILE 28 3HG2 ILE 28 -0.235 20.412 7.147 57 1HD1 ILE 28 1HD1 ILE 28 -2.091 16.274 9.395 58 2HD1 ILE 28 2HD1 ILE 28 -2.435 18.004 9.607 59 3HD1 ILE 28 3HD1 ILE 28 -2.278 17.334 7.990 60 H LEU 29 H LEU 29 3.911 19.511 8.370 61 HA LEU 29 HA LEU 29 3.691 22.460 8.124 62 1HB LEU 29 1HB LEU 29 6.184 20.774 7.800 63 2HB LEU 29 2HB LEU 29 6.059 22.508 8.000 64 HG LEU 29 HG LEU 29 6.554 22.178 10.104 65 1HD1 LEU 29 1HD1 LEU 29 4.876 21.804 11.742 66 2HD1 LEU 29 2HD1 LEU 29 4.113 22.672 10.405 67 3HD1 LEU 29 3HD1 LEU 29 3.827 20.938 10.645 68 1HD2 LEU 29 1HD2 LEU 29 6.374 19.918 11.267 69 2HD2 LEU 29 2HD2 LEU 29 5.917 19.277 9.678 70 3HD2 LEU 29 3HD2 LEU 29 7.474 20.070 9.880 71 H ASP 30 H ASP 30 5.246 23.296 6.218 72 HA ASP 30 HA ASP 30 3.612 22.648 3.857 73 1HB ASP 30 1HB ASP 30 5.394 24.978 4.499 74 2HB ASP 30 2HB ASP 30 4.345 24.843 3.081 75 H GLU 31 H GLU 31 5.015 20.595 3.952 76 HA GLU 31 HA GLU 31 6.379 20.901 1.345 77 1HB GLU 31 1HB GLU 31 6.773 18.616 3.348 78 2HB GLU 31 2HB GLU 31 7.404 18.723 1.720 79 1HG GLU 31 1HG GLU 31 8.748 20.746 2.427 80 2HG GLU 31 2HG GLU 31 8.221 20.434 4.095 81 H LYS 32 H LYS 32 5.655 19.198 -0.137 82 HA LYS 32 HA LYS 32 3.139 17.890 0.611 83 1HB LYS 32 1HB LYS 32 2.967 20.154 -0.625 84 2HB LYS 32 2HB LYS 32 3.764 19.362 -2.001 85 1HG LYS 32 1HG LYS 32 2.028 17.628 -1.928 86 2HG LYS 32 2HG LYS 32 1.318 18.390 -0.515 87 1HD LYS 32 1HD LYS 32 -0.032 18.962 -2.491 88 2HD LYS 32 2HD LYS 32 0.695 20.397 -1.764 89 1HE LYS 32 1HE LYS 32 0.797 20.492 -4.211 90 2HE LYS 32 2HE LYS 32 2.428 20.470 -3.531 91 1HZ LYS 32 1HZ LYS 32 2.131 18.957 -5.429 92 2HZ LYS 32 2HZ LYS 32 2.524 18.116 -4.062 93 3HZ LYS 32 3HZ LYS 32 0.979 18.136 -4.590 94 H ILE 33 H ILE 33 4.154 15.899 0.823 95 HA ILE 33 HA ILE 33 6.388 15.178 -1.007 96 HB ILE 33 HB ILE 33 6.785 15.237 1.361 97 1HG1 ILE 33 1HG1 ILE 33 6.894 12.308 0.544 98 2HG1 ILE 33 2HG1 ILE 33 7.716 13.489 -0.488 99 1HG2 ILE 33 1HG2 ILE 33 5.949 13.474 2.793 100 2HG2 ILE 33 2HG2 ILE 33 4.621 14.511 2.273 101 3HG2 ILE 33 3HG2 ILE 33 4.839 12.901 1.548 102 1HD1 ILE 33 1HD1 ILE 33 9.187 12.592 1.225 103 2HD1 ILE 33 2HD1 ILE 33 8.981 14.369 1.270 104 3HD1 ILE 33 3HD1 ILE 33 8.187 13.338 2.490 105 H LYS 34 H LYS 34 6.480 13.489 -2.232 106 HA LYS 34 HA LYS 34 4.007 12.591 -3.375 107 1HB LYS 34 1HB LYS 34 6.398 13.320 -4.319 108 2HB LYS 34 2HB LYS 34 6.753 11.612 -4.091 109 1HG LYS 34 1HG LYS 34 4.585 12.833 -5.811 110 2HG LYS 34 2HG LYS 34 6.174 12.256 -6.342 111 1HD LYS 34 1HD LYS 34 5.390 9.934 -5.314 112 2HD LYS 34 2HD LYS 34 3.781 10.662 -5.389 113 1HE LYS 34 1HE LYS 34 3.889 9.593 -7.463 114 2HE LYS 34 2HE LYS 34 4.414 11.208 -7.916 115 1HZ LYS 34 1HZ LYS 34 6.701 10.190 -7.699 116 2HZ LYS 34 2HZ LYS 34 5.935 8.736 -7.399 117 3HZ LYS 34 3HZ LYS 34 5.740 9.490 -8.847 118 H VAL 35 H VAL 35 3.168 10.425 -3.367 119 HA VAL 35 HA VAL 35 4.976 8.281 -2.511 120 HB VAL 35 HB VAL 35 2.277 8.938 -1.354 121 1HG1 VAL 35 1HG1 VAL 35 3.411 6.119 -1.514 122 2HG1 VAL 35 2HG1 VAL 35 2.118 6.623 -0.412 123 3HG1 VAL 35 3HG1 VAL 35 1.878 6.708 -2.159 124 1HG2 VAL 35 1HG2 VAL 35 5.025 8.471 -0.347 125 2HG2 VAL 35 2HG2 VAL 35 3.787 9.592 0.220 126 3HG2 VAL 35 3HG2 VAL 35 3.727 7.862 0.664 127 H THR 36 H THR 36 4.641 6.418 -3.596 128 HA THR 36 HA THR 36 2.785 6.551 -5.922 129 HB THR 36 HB THR 36 5.573 5.372 -6.133 130 HG1 THR 36 HG1 THR 36 5.797 7.531 -5.467 131 1HG2 THR 36 1HG2 THR 36 3.930 4.885 -7.904 132 2HG2 THR 36 2HG2 THR 36 3.724 6.627 -8.196 133 3HG2 THR 36 3HG2 THR 36 5.293 5.850 -8.504 134 H PHE 37 H PHE 37 1.379 5.056 -5.579 135 HA PHE 37 HA PHE 37 1.941 2.638 -4.033 136 1HB PHE 37 1HB PHE 37 -0.452 3.623 -5.672 137 2HB PHE 37 2HB PHE 37 -0.404 2.142 -4.749 138 HD1 PHE 37 HD1 PHE 37 0.164 2.310 -2.201 139 HD2 PHE 37 HD2 PHE 37 -1.074 5.661 -4.615 140 HE1 PHE 37 HE1 PHE 37 0.198 3.776 -0.189 141 HE2 PHE 37 HE2 PHE 37 -1.189 7.052 -2.581 142 HZ PHE 37 HZ PHE 37 -0.419 6.189 -0.416 143 H ASP 38 H ASP 38 3.631 1.556 -5.313 144 HA ASP 38 HA ASP 38 3.097 1.293 -8.180 145 1HB ASP 38 1HB ASP 38 5.333 1.618 -7.762 146 2HB ASP 38 2HB ASP 38 5.408 0.361 -6.542 147 H ALA 39 H ALA 39 1.000 0.377 -7.894 148 HA ALA 39 HA ALA 39 0.650 -2.273 -6.874 149 1HB ALA 39 1HB ALA 39 -1.197 -0.721 -7.055 150 2HB ALA 39 2HB ALA 39 -1.003 -0.635 -8.823 151 3HB ALA 39 3HB ALA 39 -1.526 -2.148 -8.058 152 H ASN 40 H ASN 40 1.650 -4.036 -7.730 153 HA ASN 40 HA ASN 40 1.366 -4.496 -10.670 154 1HB ASN 40 1HB ASN 40 3.479 -5.881 -8.997 155 2HB ASN 40 2HB ASN 40 3.349 -5.750 -10.742 156 1HD2 ASN 40 1HD2 ASN 40 4.116 -3.991 -7.763 157 2HD2 ASN 40 2HD2 ASN 40 5.132 -2.750 -8.527 158 H VAL 41 H VAL 41 1.414 -7.055 -10.976 159 HA VAL 41 HA VAL 41 0.614 -8.588 -8.703 160 HB VAL 41 HB VAL 41 -1.583 -7.679 -9.366 161 1HG1 VAL 41 1HG1 VAL 41 -1.162 -7.296 -11.780 162 2HG1 VAL 41 2HG1 VAL 41 -1.148 -9.052 -12.054 163 3HG1 VAL 41 3HG1 VAL 41 -2.627 -8.248 -11.499 164 1HG2 VAL 41 1HG2 VAL 41 -1.427 -9.962 -8.414 165 2HG2 VAL 41 2HG2 VAL 41 -2.808 -9.759 -9.504 166 3HG2 VAL 41 3HG2 VAL 41 -1.373 -10.635 -10.060 167 H ALA 42 H ALA 42 0.967 -10.898 -9.159 168 HA ALA 42 HA ALA 42 1.809 -11.807 -11.728 169 1HB ALA 42 1HB ALA 42 3.834 -10.458 -11.209 170 2HB ALA 42 2HB ALA 42 3.988 -11.284 -9.649 171 3HB ALA 42 3HB ALA 42 4.197 -12.187 -11.159 172 H ALA 43 H ALA 43 2.837 -14.032 -11.434 173 HA ALA 43 HA ALA 43 2.511 -16.148 -10.882 174 1HB ALA 43 1HB ALA 43 2.801 -16.804 -8.580 175 2HB ALA 43 2HB ALA 43 3.769 -15.341 -8.842 176 3HB ALA 43 3HB ALA 43 2.201 -15.230 -8.014 177 H GLY 44 H GLY 44 0.878 -17.456 -8.990 178 1HA GLY 44 1HA GLY 44 -1.518 -17.420 -10.619 179 2HA GLY 44 2HA GLY 44 -1.122 -18.463 -9.251 180 H LEU 45 H LEU 45 -1.449 -14.950 -9.476 181 HA LEU 45 HA LEU 45 -3.502 -15.039 -7.303 182 1HB LEU 45 1HB LEU 45 -1.149 -13.922 -7.103 183 2HB LEU 45 2HB LEU 45 -1.875 -12.601 -8.010 184 HG LEU 45 HG LEU 45 -2.850 -13.850 -5.378 185 1HD1 LEU 45 1HD1 LEU 45 -0.943 -12.426 -5.087 186 2HD1 LEU 45 2HD1 LEU 45 -1.733 -11.139 -6.048 187 3HD1 LEU 45 3HD1 LEU 45 -2.378 -11.614 -4.455 188 1HD2 LEU 45 1HD2 LEU 45 -3.915 -11.540 -7.099 189 2HD2 LEU 45 2HD2 LEU 45 -4.806 -13.032 -6.666 190 3HD2 LEU 45 3HD2 LEU 45 -4.416 -11.821 -5.428 191 HA PRO 46 HA PRO 46 -5.582 -13.806 -11.274 192 1HB PRO 46 1HB PRO 46 -7.701 -15.435 -11.255 193 2HB PRO 46 2HB PRO 46 -6.055 -16.111 -11.393 194 1HG PRO 46 1HG PRO 46 -7.704 -15.819 -8.861 195 2HG PRO 46 2HG PRO 46 -6.914 -17.305 -9.470 196 1HD PRO 46 1HD PRO 46 -5.727 -15.647 -7.629 197 2HD PRO 46 2HD PRO 46 -4.813 -16.570 -8.853 198 H TRP 47 H TRP 47 -5.618 -12.025 -9.065 199 HA TRP 47 HA TRP 47 -8.501 -11.624 -8.435 200 1HB TRP 47 1HB TRP 47 -6.092 -10.776 -6.839 201 2HB TRP 47 2HB TRP 47 -7.762 -10.392 -6.497 202 HD1 TRP 47 HD1 TRP 47 -8.026 -13.830 -7.545 203 HE1 TRP 47 HE1 TRP 47 -8.127 -15.432 -5.627 204 HE3 TRP 47 HE3 TRP 47 -6.011 -10.871 -3.854 205 HZ2 TRP 47 HZ2 TRP 47 -7.697 -15.432 -2.806 206 HZ3 TRP 47 HZ3 TRP 47 -5.370 -12.059 -1.752 207 HH2 TRP 47 HH2 TRP 47 -6.386 -14.162 -1.120 208 H GLU 48 H GLU 48 -9.418 -9.710 -8.851 209 HA GLU 48 HA GLU 48 -8.158 -7.964 -10.839 210 1HB GLU 48 1HB GLU 48 -10.509 -8.722 -10.861 211 2HB GLU 48 2HB GLU 48 -10.772 -7.936 -9.304 212 1HG GLU 48 1HG GLU 48 -10.459 -5.719 -10.370 213 2HG GLU 48 2HG GLU 48 -10.292 -6.516 -11.945 214 H PHE 49 H PHE 49 -6.367 -7.418 -9.466 215 HA PHE 49 HA PHE 49 -6.789 -5.723 -7.115 216 1HB PHE 49 1HB PHE 49 -4.959 -7.337 -7.125 217 2HB PHE 49 2HB PHE 49 -4.287 -6.596 -8.578 218 HD1 PHE 49 HD1 PHE 49 -2.358 -5.309 -8.167 219 HD2 PHE 49 HD2 PHE 49 -5.459 -5.428 -5.160 220 HE1 PHE 49 HE1 PHE 49 -0.852 -4.218 -6.557 221 HE2 PHE 49 HE2 PHE 49 -3.955 -4.269 -3.575 222 HZ PHE 49 HZ PHE 49 -1.627 -3.730 -4.240 223 H VAL 50 H VAL 50 -7.043 -3.529 -7.277 224 HA VAL 50 HA VAL 50 -5.937 -2.189 -9.705 225 HB VAL 50 HB VAL 50 -7.851 -0.866 -9.994 226 1HG1 VAL 50 1HG1 VAL 50 -9.577 -2.466 -10.530 227 2HG1 VAL 50 2HG1 VAL 50 -8.019 -3.266 -10.814 228 3HG1 VAL 50 3HG1 VAL 50 -8.968 -3.628 -9.346 229 1HG2 VAL 50 1HG2 VAL 50 -9.911 -1.151 -8.542 230 2HG2 VAL 50 2HG2 VAL 50 -8.872 -2.033 -7.403 231 3HG2 VAL 50 3HG2 VAL 50 -8.566 -0.316 -7.751 232 HA PRO 51 HA PRO 51 -4.523 0.707 -6.462 233 1HB PRO 51 1HB PRO 51 -3.405 2.613 -8.043 234 2HB PRO 51 2HB PRO 51 -2.592 1.050 -7.762 235 1HG PRO 51 1HG PRO 51 -4.299 1.856 -10.130 236 2HG PRO 51 2HG PRO 51 -2.699 1.063 -10.161 237 1HD PRO 51 1HD PRO 51 -5.082 -0.281 -10.391 238 2HD PRO 51 2HD PRO 51 -3.652 -1.035 -9.623 239 H VAL 52 H VAL 52 -5.248 2.900 -6.021 240 HA VAL 52 HA VAL 52 -7.932 3.480 -7.018 241 HB VAL 52 HB VAL 52 -7.280 5.638 -5.442 242 1HG1 VAL 52 1HG1 VAL 52 -9.335 4.353 -5.313 243 2HG1 VAL 52 2HG1 VAL 52 -8.450 2.939 -4.701 244 3HG1 VAL 52 3HG1 VAL 52 -8.572 4.416 -3.712 245 1HG2 VAL 52 1HG2 VAL 52 -6.004 3.171 -4.220 246 2HG2 VAL 52 2HG2 VAL 52 -5.071 4.537 -4.833 247 3HG2 VAL 52 3HG2 VAL 52 -6.183 4.765 -3.462 248 H GLN 53 H GLN 53 -4.899 5.250 -6.700 249 HA GLN 53 HA GLN 53 -4.820 5.976 -9.474 250 1HB GLN 53 1HB GLN 53 -4.349 8.280 -9.142 251 2HB GLN 53 2HB GLN 53 -5.944 8.002 -8.461 252 1HG GLN 53 1HG GLN 53 -3.294 8.343 -6.987 253 2HG GLN 53 2HG GLN 53 -4.503 9.606 -7.226 254 1HE2 GLN 53 1HE2 GLN 53 -3.768 6.553 -5.538 255 2HE2 GLN 53 2HE2 GLN 53 -5.117 6.724 -4.427 256 H ARG 54 H ARG 54 -2.555 6.451 -9.981 257 HA ARG 54 HA ARG 54 -0.815 4.634 -8.720 258 1HB ARG 54 1HB ARG 54 -0.696 6.431 -10.971 259 2HB ARG 54 2HB ARG 54 0.808 6.526 -10.057 260 1HG ARG 54 1HG ARG 54 -0.496 3.862 -10.775 261 2HG ARG 54 2HG ARG 54 0.699 4.688 -11.813 262 1HD ARG 54 1HD ARG 54 2.385 4.360 -10.336 263 2HD ARG 54 2HD ARG 54 1.329 4.307 -8.972 264 HE ARG 54 HE ARG 54 1.552 2.172 -8.888 265 1HH1 ARG 54 1HH1 ARG 54 0.771 2.690 -12.267 266 2HH1 ARG 54 2HH1 ARG 54 1.191 1.071 -12.764 267 1HH2 ARG 54 1HH2 ARG 54 2.927 0.197 -10.013 268 2HH2 ARG 54 2HH2 ARG 54 1.607 -0.565 -10.832 269 H ASP 55 H ASP 55 -0.940 8.258 -8.157 270 HA ASP 55 HA ASP 55 0.716 7.795 -5.780 271 1HB ASP 55 1HB ASP 55 1.972 9.743 -6.591 272 2HB ASP 55 2HB ASP 55 2.131 8.300 -7.628 273 H ILE 56 H ILE 56 0.943 9.614 -4.441 274 HA ILE 56 HA ILE 56 -1.343 11.487 -4.321 275 HB ILE 56 HB ILE 56 -1.630 11.155 -1.936 276 1HG1 ILE 56 1HG1 ILE 56 0.246 8.826 -2.403 277 2HG1 ILE 56 2HG1 ILE 56 0.591 10.303 -1.486 278 1HG2 ILE 56 1HG2 ILE 56 -2.858 8.999 -2.073 279 2HG2 ILE 56 2HG2 ILE 56 -3.156 10.030 -3.483 280 3HG2 ILE 56 3HG2 ILE 56 -2.049 8.659 -3.622 281 1HD1 ILE 56 1HD1 ILE 56 0.173 8.468 0.001 282 2HD1 ILE 56 2HD1 ILE 56 -1.052 9.735 0.204 283 3HD1 ILE 56 3HD1 ILE 56 -1.464 8.232 -0.622 284 H ASP 57 H ASP 57 -0.763 13.469 -3.124 285 HA ASP 57 HA ASP 57 2.116 13.782 -2.487 286 1HB ASP 57 1HB ASP 57 1.846 16.015 -3.359 287 2HB ASP 57 2HB ASP 57 1.459 14.803 -4.573 288 H VAL 58 H VAL 58 1.853 13.329 -0.254 289 HA VAL 58 HA VAL 58 -0.441 14.447 1.247 290 HB VAL 58 HB VAL 58 0.326 13.211 3.119 291 1HG1 VAL 58 1HG1 VAL 58 -0.113 11.001 2.207 292 2HG1 VAL 58 2HG1 VAL 58 -1.113 12.195 1.360 293 3HG1 VAL 58 3HG1 VAL 58 0.345 11.543 0.580 294 1HG2 VAL 58 1HG2 VAL 58 2.640 12.271 1.376 295 2HG2 VAL 58 2HG2 VAL 58 2.754 13.230 2.879 296 3HG2 VAL 58 3HG2 VAL 58 2.154 11.569 2.919 297 H ARG 59 H ARG 59 -0.365 16.027 2.814 298 HA ARG 59 HA ARG 59 1.958 17.842 2.791 299 1HB ARG 59 1HB ARG 59 -0.736 17.895 4.180 300 2HB ARG 59 2HB ARG 59 0.518 19.088 4.501 301 1HG ARG 59 1HG ARG 59 -0.506 18.538 1.694 302 2HG ARG 59 2HG ARG 59 -1.297 19.680 2.786 303 1HD ARG 59 1HD ARG 59 1.619 20.130 2.728 304 2HD ARG 59 2HD ARG 59 0.941 20.175 1.122 305 HE ARG 59 HE ARG 59 -0.451 21.991 1.695 306 1HH1 ARG 59 1HH1 ARG 59 1.702 21.186 4.554 307 2HH1 ARG 59 2HH1 ARG 59 1.711 22.886 4.957 308 1HH2 ARG 59 1HH2 ARG 59 -0.281 24.188 2.535 309 2HH2 ARG 59 2HH2 ARG 59 0.802 24.402 3.913 310 H ILE 60 H ILE 60 3.274 15.985 3.464 311 HA ILE 60 HA ILE 60 4.101 14.475 5.104 312 HB ILE 60 HB ILE 60 5.653 15.960 6.504 313 1HG1 ILE 60 1HG1 ILE 60 4.716 18.062 4.513 314 2HG1 ILE 60 2HG1 ILE 60 4.094 17.968 6.162 315 1HG2 ILE 60 1HG2 ILE 60 7.138 16.291 4.584 316 2HG2 ILE 60 2HG2 ILE 60 6.325 14.743 4.520 317 3HG2 ILE 60 3HG2 ILE 60 5.767 16.089 3.481 318 1HD1 ILE 60 1HD1 ILE 60 7.074 18.207 5.541 319 2HD1 ILE 60 2HD1 ILE 60 6.015 19.598 5.775 320 3HD1 ILE 60 3HD1 ILE 60 6.250 18.440 7.100 321 H GLY 61 H GLY 61 1.881 13.968 5.985 322 1HA GLY 61 1HA GLY 61 1.611 13.372 8.542 323 2HA GLY 61 2HA GLY 61 1.393 15.109 8.689 324 H GLU 62 H GLU 62 0.012 15.692 6.288 325 HA GLU 62 HA GLU 62 -2.490 15.169 7.287 326 1HB GLU 62 1HB GLU 62 -2.029 17.063 5.763 327 2HB GLU 62 2HB GLU 62 -1.978 15.929 4.386 328 1HG GLU 62 1HG GLU 62 -4.159 17.109 4.594 329 2HG GLU 62 2HG GLU 62 -4.352 15.364 4.762 330 H THR 63 H THR 63 -4.109 13.824 6.969 331 HA THR 63 HA THR 63 -2.853 11.189 6.536 332 HB THR 63 HB THR 63 -5.259 11.823 8.253 333 HG1 THR 63 HG1 THR 63 -2.566 12.641 8.578 334 1HG2 THR 63 1HG2 THR 63 -3.946 9.462 8.050 335 2HG2 THR 63 2HG2 THR 63 -2.878 10.301 9.228 336 3HG2 THR 63 3HG2 THR 63 -4.589 10.076 9.585 337 H VAL 64 H VAL 64 -3.392 10.688 4.365 338 HA VAL 64 HA VAL 64 -6.212 11.103 3.549 339 HB VAL 64 HB VAL 64 -4.621 12.013 2.099 340 1HG1 VAL 64 1HG1 VAL 64 -2.644 10.556 2.471 341 2HG1 VAL 64 2HG1 VAL 64 -3.480 9.207 1.673 342 3HG1 VAL 64 3HG1 VAL 64 -3.055 10.663 0.753 343 1HG2 VAL 64 1HG2 VAL 64 -5.340 11.149 -0.012 344 2HG2 VAL 64 2HG2 VAL 64 -5.802 9.601 0.705 345 3HG2 VAL 64 3HG2 VAL 64 -6.695 11.083 1.126 346 H GLN 65 H GLN 65 -7.513 9.582 2.795 347 HA GLN 65 HA GLN 65 -6.969 6.712 3.414 348 1HB GLN 65 1HB GLN 65 -9.301 6.327 3.097 349 2HB GLN 65 2HB GLN 65 -9.007 7.557 4.317 350 1HG GLN 65 1HG GLN 65 -10.542 8.812 3.325 351 2HG GLN 65 2HG GLN 65 -9.419 9.099 1.999 352 1HE2 GLN 65 1HE2 GLN 65 -9.501 7.469 0.177 353 2HE2 GLN 65 2HE2 GLN 65 -11.075 6.767 -0.213 354 H ILE 66 H ILE 66 -6.001 5.617 1.941 355 HA ILE 66 HA ILE 66 -7.017 5.879 -0.850 356 HB ILE 66 HB ILE 66 -4.860 4.868 -1.650 357 1HG1 ILE 66 1HG1 ILE 66 -2.890 6.014 -0.264 358 2HG1 ILE 66 2HG1 ILE 66 -3.895 5.649 1.102 359 1HG2 ILE 66 1HG2 ILE 66 -4.755 7.714 -0.632 360 2HG2 ILE 66 2HG2 ILE 66 -3.919 7.016 -2.045 361 3HG2 ILE 66 3HG2 ILE 66 -5.676 7.185 -2.062 362 1HD1 ILE 66 1HD1 ILE 66 -2.797 3.749 -1.040 363 2HD1 ILE 66 2HD1 ILE 66 -2.310 3.813 0.670 364 3HD1 ILE 66 3HD1 ILE 66 -3.900 3.192 0.204 365 H MET 67 H MET 67 -8.295 4.339 -1.216 366 HA MET 67 HA MET 67 -8.116 1.834 0.372 367 1HB MET 67 1HB MET 67 -10.353 1.333 -0.323 368 2HB MET 67 2HB MET 67 -10.291 2.993 0.258 369 1HG MET 67 1HG MET 67 -11.659 3.116 -1.617 370 2HG MET 67 2HG MET 67 -10.117 3.744 -2.163 371 1HE MET 67 1HE MET 67 -12.869 1.043 -2.471 372 2HE MET 67 2HE MET 67 -12.078 -0.238 -3.410 373 3HE MET 67 3HE MET 67 -11.581 0.067 -1.732 374 H TYR 68 H TYR 68 -8.253 -0.247 -0.543 375 HA TYR 68 HA TYR 68 -7.278 -0.448 -3.364 376 1HB TYR 68 1HB TYR 68 -6.093 -1.657 -0.862 377 2HB TYR 68 2HB TYR 68 -6.096 -2.591 -2.349 378 HD1 TYR 68 HD1 TYR 68 -4.946 -1.780 -4.402 379 HD2 TYR 68 HD2 TYR 68 -4.431 0.090 -0.553 380 HE1 TYR 68 HE1 TYR 68 -2.652 -1.130 -5.030 381 HE2 TYR 68 HE2 TYR 68 -2.128 0.758 -1.191 382 HH TYR 68 HH TYR 68 -0.622 -0.401 -4.208 383 H ARG 69 H ARG 69 -7.925 -2.390 -4.370 384 HA ARG 69 HA ARG 69 -10.100 -3.931 -3.101 385 1HB ARG 69 1HB ARG 69 -11.139 -2.119 -4.433 386 2HB ARG 69 2HB ARG 69 -10.165 -2.565 -5.815 387 1HG ARG 69 1HG ARG 69 -11.275 -4.720 -6.006 388 2HG ARG 69 2HG ARG 69 -12.241 -4.404 -4.555 389 1HD ARG 69 1HD ARG 69 -12.266 -2.664 -7.064 390 2HD ARG 69 2HD ARG 69 -13.413 -3.982 -6.742 391 HE ARG 69 HE ARG 69 -13.545 -2.329 -4.471 392 1HH1 ARG 69 1HH1 ARG 69 -14.323 -2.079 -7.903 393 2HH1 ARG 69 2HH1 ARG 69 -15.678 -1.017 -7.646 394 1HH2 ARG 69 1HH2 ARG 69 -15.159 -1.016 -4.111 395 2HH2 ARG 69 2HH2 ARG 69 -16.204 -0.337 -5.360 396 H ALA 70 H ALA 70 -10.079 -6.064 -3.734 397 HA ALA 70 HA ALA 70 -8.438 -7.034 -5.978 398 1HB ALA 70 1HB ALA 70 -7.413 -8.771 -4.575 399 2HB ALA 70 2HB ALA 70 -6.888 -7.147 -4.091 400 3HB ALA 70 3HB ALA 70 -8.094 -8.015 -3.121 401 H LYS 71 H LYS 71 -10.008 -8.192 -7.117 402 HA LYS 71 HA LYS 71 -12.135 -9.582 -5.487 403 1HB LYS 71 1HB LYS 71 -12.535 -8.695 -8.344 404 2HB LYS 71 2HB LYS 71 -13.689 -9.228 -7.128 405 1HG LYS 71 1HG LYS 71 -12.821 -7.210 -5.716 406 2HG LYS 71 2HG LYS 71 -12.131 -6.593 -7.224 407 1HD LYS 71 1HD LYS 71 -15.002 -7.477 -7.109 408 2HD LYS 71 2HD LYS 71 -14.595 -5.970 -6.312 409 1HE LYS 71 1HE LYS 71 -15.265 -5.190 -8.361 410 2HE LYS 71 2HE LYS 71 -13.521 -5.336 -8.650 411 1HZ LYS 71 1HZ LYS 71 -14.563 -6.240 -10.433 412 2HZ LYS 71 2HZ LYS 71 -14.025 -7.508 -9.696 413 3HZ LYS 71 3HZ LYS 71 -15.660 -7.173 -9.534 414 H ASN 72 H ASN 72 -12.229 -11.763 -5.558 415 HA ASN 72 HA ASN 72 -10.075 -12.984 -7.042 416 1HB ASN 72 1HB ASN 72 -10.447 -13.616 -4.750 417 2HB ASN 72 2HB ASN 72 -12.092 -14.177 -5.114 418 1HD2 ASN 72 1HD2 ASN 72 -10.724 -16.223 -3.937 419 2HD2 ASN 72 2HD2 ASN 72 -10.126 -17.320 -5.153 420 H LEU 73 H LEU 73 -10.235 -13.436 -9.191 421 HA LEU 73 HA LEU 73 -12.757 -14.646 -10.247 422 1HB LEU 73 1HB LEU 73 -10.436 -13.176 -11.537 423 2HB LEU 73 2HB LEU 73 -11.542 -14.183 -12.463 424 HG LEU 73 HG LEU 73 -13.477 -12.848 -11.712 425 1HD1 LEU 73 1HD1 LEU 73 -13.002 -10.525 -10.862 426 2HD1 LEU 73 2HD1 LEU 73 -12.690 -11.781 -9.668 427 3HD1 LEU 73 3HD1 LEU 73 -11.331 -11.029 -10.545 428 1HD2 LEU 73 1HD2 LEU 73 -12.359 -12.478 -13.883 429 2HD2 LEU 73 2HD2 LEU 73 -12.973 -10.956 -13.215 430 3HD2 LEU 73 3HD2 LEU 73 -11.240 -11.327 -13.117 431 H ALA 74 H ALA 74 -10.841 -16.147 -8.544 432 HA ALA 74 HA ALA 74 -9.833 -18.214 -10.351 433 1HB ALA 74 1HB ALA 74 -8.755 -17.702 -8.148 434 2HB ALA 74 2HB ALA 74 -10.260 -18.184 -7.361 435 3HB ALA 74 3HB ALA 74 -9.285 -19.381 -8.249 436 H SER 75 H SER 75 -10.623 -20.548 -9.708 437 HA SER 75 HA SER 75 -13.541 -20.597 -9.021 438 1HB SER 75 1HB SER 75 -12.927 -21.384 -11.390 439 2HB SER 75 2HB SER 75 -12.228 -22.815 -10.568 440 HG SER 75 HG SER 75 -14.381 -23.212 -11.070 441 H THR 76 H THR 76 -10.834 -20.569 -7.493 442 HA THR 76 HA THR 76 -11.619 -22.536 -5.520 443 HB THR 76 HB THR 76 -9.021 -23.061 -5.362 444 HG1 THR 76 HG1 THR 76 -9.296 -22.243 -8.057 445 1HG2 THR 76 1HG2 THR 76 -10.751 -24.771 -5.695 446 2HG2 THR 76 2HG2 THR 76 -10.751 -24.460 -7.438 447 3HG2 THR 76 3HG2 THR 76 -9.302 -25.120 -6.652 448 HA PRO 77 HA PRO 77 -10.258 -19.080 -3.090 449 1HB PRO 77 1HB PRO 77 -9.222 -20.218 -0.796 450 2HB PRO 77 2HB PRO 77 -10.971 -20.149 -1.145 451 1HG PRO 77 1HG PRO 77 -9.084 -22.457 -1.671 452 2HG PRO 77 2HG PRO 77 -10.678 -22.507 -0.860 453 1HD PRO 77 1HD PRO 77 -10.413 -23.147 -3.478 454 2HD PRO 77 2HD PRO 77 -11.824 -22.205 -2.926 455 H THR 78 H THR 78 -8.197 -17.920 -2.847 456 HA THR 78 HA THR 78 -5.765 -19.517 -3.555 457 HB THR 78 HB THR 78 -4.934 -17.893 -4.990 458 HG1 THR 78 HG1 THR 78 -5.306 -15.931 -4.946 459 1HG2 THR 78 1HG2 THR 78 -7.098 -19.121 -5.936 460 2HG2 THR 78 2HG2 THR 78 -7.913 -17.592 -5.602 461 3HG2 THR 78 3HG2 THR 78 -6.576 -17.640 -6.763 462 H THR 79 H THR 79 -3.758 -18.328 -3.111 463 HA THR 79 HA THR 79 -3.853 -16.989 -0.452 464 HB THR 79 HB THR 79 -1.612 -18.272 -2.077 465 HG1 THR 79 HG1 THR 79 -1.797 -19.627 -0.017 466 1HG2 THR 79 1HG2 THR 79 -1.559 -17.203 0.775 467 2HG2 THR 79 2HG2 THR 79 -0.234 -18.042 -0.072 468 3HG2 THR 79 3HG2 THR 79 -0.769 -16.458 -0.637 469 H GLY 80 H GLY 80 -3.130 -14.804 -0.397 470 1HA GLY 80 1HA GLY 80 -1.667 -13.569 -2.579 471 2HA GLY 80 2HA GLY 80 -3.366 -13.095 -2.551 472 H GLN 81 H GLN 81 -0.696 -13.652 -0.202 473 HA GLN 81 HA GLN 81 -1.419 -11.175 1.318 474 1HB GLN 81 1HB GLN 81 -0.497 -12.590 3.301 475 2HB GLN 81 2HB GLN 81 -2.145 -12.844 2.760 476 1HG GLN 81 1HG GLN 81 -0.988 -14.956 3.272 477 2HG GLN 81 2HG GLN 81 -1.644 -14.873 1.644 478 1HE2 GLN 81 1HE2 GLN 81 1.328 -15.073 3.551 479 2HE2 GLN 81 2HE2 GLN 81 2.388 -15.315 2.176 480 H ALA 82 H ALA 82 0.153 -10.565 -0.550 481 HA ALA 82 HA ALA 82 2.827 -11.645 -0.392 482 1HB ALA 82 1HB ALA 82 1.661 -9.358 -1.982 483 2HB ALA 82 2HB ALA 82 3.304 -10.009 -2.182 484 3HB ALA 82 3HB ALA 82 1.908 -11.081 -2.437 485 H THR 83 H THR 83 4.747 -10.238 -0.384 486 HA THR 83 HA THR 83 4.689 -8.289 1.875 487 HB THR 83 HB THR 83 7.312 -8.816 1.459 488 HG1 THR 83 HG1 THR 83 7.240 -10.480 0.030 489 1HG2 THR 83 1HG2 THR 83 5.362 -10.484 3.096 490 2HG2 THR 83 2HG2 THR 83 7.122 -10.420 3.338 491 3HG2 THR 83 3HG2 THR 83 6.144 -8.964 3.599 492 H PHE 84 H PHE 84 4.126 -6.442 0.879 493 HA PHE 84 HA PHE 84 5.197 -5.720 -1.735 494 1HB PHE 84 1HB PHE 84 3.940 -3.589 -1.310 495 2HB PHE 84 2HB PHE 84 2.976 -5.065 -1.273 496 HD1 PHE 84 HD1 PHE 84 1.625 -5.664 0.601 497 HD2 PHE 84 HD2 PHE 84 4.677 -2.629 0.987 498 HE1 PHE 84 HE1 PHE 84 0.917 -5.249 2.902 499 HE2 PHE 84 HE2 PHE 84 4.097 -2.354 3.350 500 HZ PHE 84 HZ PHE 84 2.135 -3.588 4.320 501 H ASN 85 H ASN 85 6.773 -4.176 -2.132 502 HA ASN 85 HA ASN 85 8.817 -4.035 -0.003 503 1HB ASN 85 1HB ASN 85 9.413 -4.815 -2.153 504 2HB ASN 85 2HB ASN 85 8.840 -3.346 -2.952 505 1HD2 ASN 85 1HD2 ASN 85 9.916 -1.228 -2.233 506 2HD2 ASN 85 2HD2 ASN 85 11.648 -1.309 -1.992 507 H VAL 86 H VAL 86 7.770 -2.608 1.360 508 HA VAL 86 HA VAL 86 6.899 0.031 0.605 509 HB VAL 86 HB VAL 86 5.924 -1.197 2.381 510 1HG1 VAL 86 1HG1 VAL 86 6.800 -1.666 4.520 511 2HG1 VAL 86 2HG1 VAL 86 7.861 -2.430 3.337 512 3HG1 VAL 86 3HG1 VAL 86 8.361 -0.939 4.156 513 1HG2 VAL 86 1HG2 VAL 86 5.825 1.258 2.416 514 2HG2 VAL 86 2HG2 VAL 86 5.678 0.519 4.022 515 3HG2 VAL 86 3HG2 VAL 86 7.201 1.285 3.537 516 H THR 87 H THR 87 8.831 0.831 -0.563 517 HA THR 87 HA THR 87 10.165 2.714 0.823 518 HB THR 87 HB THR 87 11.503 1.026 2.003 519 HG1 THR 87 HG1 THR 87 13.551 1.823 1.410 520 1HG2 THR 87 1HG2 THR 87 11.460 -0.721 0.294 521 2HG2 THR 87 2HG2 THR 87 12.572 0.244 -0.711 522 3HG2 THR 87 3HG2 THR 87 13.103 -0.376 0.866 523 HA PRO 88 HA PRO 88 11.376 3.444 -3.488 524 1HB PRO 88 1HB PRO 88 13.129 5.564 -3.076 525 2HB PRO 88 2HB PRO 88 11.372 5.746 -3.203 526 1HG PRO 88 1HG PRO 88 13.050 5.768 -0.734 527 2HG PRO 88 2HG PRO 88 11.554 6.666 -1.083 528 1HD PRO 88 1HD PRO 88 11.702 4.367 0.466 529 2HD PRO 88 2HD PRO 88 10.232 4.932 -0.347 530 H MET 89 H MET 89 13.423 3.124 -0.639 531 HA MET 89 HA MET 89 15.044 1.126 -1.401 532 1HB MET 89 1HB MET 89 17.267 2.226 -1.872 533 2HB MET 89 2HB MET 89 16.118 2.208 -3.182 534 1HG MET 89 1HG MET 89 15.543 4.682 -2.353 535 2HG MET 89 2HG MET 89 17.119 4.539 -1.564 536 1HE MET 89 1HE MET 89 16.504 4.623 -6.125 537 2HE MET 89 2HE MET 89 15.987 3.206 -5.193 538 3HE MET 89 3HE MET 89 15.189 4.776 -4.936 539 H ALA 90 H ALA 90 15.893 4.345 -0.096 540 HA ALA 90 HA ALA 90 17.293 3.173 2.108 541 1HB ALA 90 1HB ALA 90 16.521 6.048 1.511 542 2HB ALA 90 2HB ALA 90 17.755 5.529 2.682 543 3HB ALA 90 3HB ALA 90 17.996 5.235 0.945 544 H ALA 91 H ALA 91 14.090 4.697 1.808 545 HA ALA 91 HA ALA 91 13.955 5.218 4.666 546 1HB ALA 91 1HB ALA 91 13.115 6.855 3.160 547 2HB ALA 91 2HB ALA 91 11.941 5.726 2.469 548 3HB ALA 91 3HB ALA 91 11.796 6.240 4.174 549 H GLY 92 H GLY 92 10.913 4.255 3.370 550 1HA GLY 92 1HA GLY 92 9.449 2.608 3.864 551 2HA GLY 92 2HA GLY 92 10.787 1.504 4.180 552 H ALA 93 H ALA 93 12.011 2.604 6.415 553 HA ALA 93 HA ALA 93 10.506 1.957 8.662 554 1HB ALA 93 1HB ALA 93 12.918 2.370 8.726 555 2HB ALA 93 2HB ALA 93 12.672 4.095 8.392 556 3HB ALA 93 3HB ALA 93 12.093 3.395 9.917 557 H TYR 94 H TYR 94 11.042 5.237 7.376 558 HA TYR 94 HA TYR 94 9.056 6.524 8.972 559 1HB TYR 94 1HB TYR 94 10.424 7.579 6.490 560 2HB TYR 94 2HB TYR 94 9.820 8.497 7.869 561 HD1 TYR 94 HD1 TYR 94 12.768 7.991 6.402 562 HD2 TYR 94 HD2 TYR 94 10.963 6.935 10.180 563 HE1 TYR 94 HE1 TYR 94 15.017 7.773 7.438 564 HE2 TYR 94 HE2 TYR 94 13.190 6.808 11.207 565 HH TYR 94 HH TYR 94 16.223 7.025 9.391 566 H PHE 95 H PHE 95 8.316 4.400 6.576 567 HA PHE 95 HA PHE 95 6.217 6.053 5.295 568 1HB PHE 95 1HB PHE 95 7.442 4.364 3.915 569 2HB PHE 95 2HB PHE 95 6.903 3.104 5.014 570 HD1 PHE 95 HD1 PHE 95 6.012 5.003 2.049 571 HD2 PHE 95 HD2 PHE 95 4.469 2.494 5.212 572 HE1 PHE 95 HE1 PHE 95 3.908 4.717 0.806 573 HE2 PHE 95 HE2 PHE 95 2.337 2.277 3.984 574 HZ PHE 95 HZ PHE 95 2.031 3.425 1.811 575 H ASN 96 H ASN 96 4.163 6.231 6.196 576 HA ASN 96 HA ASN 96 3.802 4.776 8.596 577 1HB ASN 96 1HB ASN 96 1.900 6.637 7.180 578 2HB ASN 96 2HB ASN 96 1.443 5.715 8.606 579 1HD2 ASN 96 1HD2 ASN 96 3.717 8.210 7.500 580 2HD2 ASN 96 2HD2 ASN 96 4.468 8.445 9.109 581 H LYS 97 H LYS 97 3.961 2.667 8.094 582 HA LYS 97 HA LYS 97 2.311 1.222 6.315 583 1HB LYS 97 1HB LYS 97 3.110 -0.764 7.419 584 2HB LYS 97 2HB LYS 97 4.403 0.341 6.999 585 1HG LYS 97 1HG LYS 97 3.259 0.267 9.821 586 2HG LYS 97 2HG LYS 97 4.369 -0.978 9.284 587 1HD LYS 97 1HD LYS 97 5.051 1.985 9.475 588 2HD LYS 97 2HD LYS 97 5.495 0.727 10.593 589 1HE LYS 97 1HE LYS 97 7.281 0.057 9.404 590 2HE LYS 97 2HE LYS 97 6.363 -0.052 7.909 591 1HZ LYS 97 1HZ LYS 97 7.678 2.399 8.957 592 2HZ LYS 97 2HZ LYS 97 7.979 1.624 7.553 593 3HZ LYS 97 3HZ LYS 97 6.581 2.399 7.766 594 H VAL 98 H VAL 98 1.496 2.503 9.387 595 HA VAL 98 HA VAL 98 -0.164 2.109 10.901 596 HB VAL 98 HB VAL 98 -1.842 2.323 8.374 597 1HG1 VAL 98 1HG1 VAL 98 -2.269 3.310 11.239 598 2HG1 VAL 98 2HG1 VAL 98 -3.337 3.638 9.862 599 3HG1 VAL 98 3HG1 VAL 98 -3.164 1.995 10.459 600 1HG2 VAL 98 1HG2 VAL 98 -0.341 4.462 9.947 601 2HG2 VAL 98 2HG2 VAL 98 -0.162 4.044 8.226 602 3HG2 VAL 98 3HG2 VAL 98 -1.639 4.807 8.789 603 H GLN 99 H GLN 99 0.739 -0.160 11.100 604 HA GLN 99 HA GLN 99 -0.683 -2.406 10.028 605 1HB GLN 99 1HB GLN 99 1.702 -2.391 10.752 606 2HB GLN 99 2HB GLN 99 1.177 -2.193 12.424 607 1HG GLN 99 1HG GLN 99 -0.264 -4.464 11.453 608 2HG GLN 99 2HG GLN 99 1.340 -4.606 10.744 609 1HE2 GLN 99 1HE2 GLN 99 -0.187 -3.726 13.889 610 2HE2 GLN 99 2HE2 GLN 99 0.936 -4.666 14.878 611 H CYS 100 H CYS 100 -2.767 -1.420 10.576 612 HA CYS 100 HA CYS 100 -4.252 -2.660 12.628 613 1HB CYS 100 1HB CYS 100 -4.748 -0.892 14.169 614 2HB CYS 100 2HB CYS 100 -2.994 -1.056 14.153 615 HG CYS 100 HG CYS 100 -4.966 1.136 12.670 616 H PHE 101 H PHE 101 -3.832 -0.018 10.275 617 HA PHE 101 HA PHE 101 -6.578 -0.505 9.344 618 1HB PHE 101 1HB PHE 101 -6.662 1.424 10.952 619 2HB PHE 101 2HB PHE 101 -5.559 2.309 9.897 620 HD1 PHE 101 HD1 PHE 101 -7.746 0.527 7.681 621 HD2 PHE 101 HD2 PHE 101 -7.680 3.847 10.470 622 HE1 PHE 101 HE1 PHE 101 -9.817 1.378 6.730 623 HE2 PHE 101 HE2 PHE 101 -9.709 4.750 9.423 624 HZ PHE 101 HZ PHE 101 -10.815 3.513 7.558 625 H CYS 102 H CYS 102 -4.988 -1.717 7.993 626 HA CYS 102 HA CYS 102 -4.414 -0.228 5.597 627 1HB CYS 102 1HB CYS 102 -2.071 -0.706 5.430 628 2HB CYS 102 2HB CYS 102 -2.307 0.028 7.022 629 HG CYS 102 HG CYS 102 -0.577 -1.777 7.313 630 H PHE 103 H PHE 103 -3.349 -1.961 3.993 631 HA PHE 103 HA PHE 103 -5.629 -3.570 3.594 632 1HB PHE 103 1HB PHE 103 -3.984 -2.427 1.901 633 2HB PHE 103 2HB PHE 103 -3.036 -3.901 2.056 634 HD1 PHE 103 HD1 PHE 103 -3.343 -5.213 0.103 635 HD2 PHE 103 HD2 PHE 103 -6.664 -2.912 1.600 636 HE1 PHE 103 HE1 PHE 103 -4.781 -6.131 -1.674 637 HE2 PHE 103 HE2 PHE 103 -8.123 -3.887 -0.138 638 HZ PHE 103 HZ PHE 103 -7.196 -5.504 -1.785 639 H THR 104 H THR 104 -6.088 -5.446 4.597 640 HA THR 104 HA THR 104 -4.020 -6.988 5.905 641 HB THR 104 HB THR 104 -6.293 -6.487 6.811 642 HG1 THR 104 HG1 THR 104 -6.418 -8.478 7.830 643 1HG2 THR 104 1HG2 THR 104 -8.184 -7.877 6.217 644 2HG2 THR 104 2HG2 THR 104 -7.591 -7.121 4.728 645 3HG2 THR 104 3HG2 THR 104 -7.215 -8.820 5.071 646 H GLU 105 H GLU 105 -5.702 -7.260 2.877 647 HA GLU 105 HA GLU 105 -5.951 -9.000 1.365 648 1HB GLU 105 1HB GLU 105 -3.719 -9.238 0.232 649 2HB GLU 105 2HB GLU 105 -4.385 -7.636 0.465 650 1HG GLU 105 1HG GLU 105 -2.863 -7.317 2.468 651 2HG GLU 105 2HG GLU 105 -2.124 -8.878 2.088 652 H THR 106 H THR 106 -6.728 -10.475 3.077 653 HA THR 106 HA THR 106 -5.011 -12.875 3.491 654 HB THR 106 HB THR 106 -6.275 -11.966 5.393 655 HG1 THR 106 HG1 THR 106 -7.086 -13.955 6.012 656 1HG2 THR 106 1HG2 THR 106 -8.784 -12.755 3.830 657 2HG2 THR 106 2HG2 THR 106 -8.721 -12.246 5.524 658 3HG2 THR 106 3HG2 THR 106 -8.306 -11.098 4.248 659 H THR 107 H THR 107 -6.977 -14.751 3.438 660 HA THR 107 HA THR 107 -6.904 -15.395 0.606 661 HB THR 107 HB THR 107 -6.307 -16.956 2.333 662 HG1 THR 107 HG1 THR 107 -7.017 -17.668 0.248 663 1HG2 THR 107 1HG2 THR 107 -8.054 -18.119 3.586 664 2HG2 THR 107 2HG2 THR 107 -8.111 -16.374 3.944 665 3HG2 THR 107 3HG2 THR 107 -9.295 -17.091 2.832 666 H LEU 108 H LEU 108 -8.680 -15.717 -0.791 667 HA LEU 108 HA LEU 108 -11.351 -14.701 0.090 668 1HB LEU 108 1HB LEU 108 -9.966 -14.216 -2.575 669 2HB LEU 108 2HB LEU 108 -11.576 -13.667 -2.147 670 HG LEU 108 HG LEU 108 -8.992 -12.751 -0.879 671 1HD1 LEU 108 1HD1 LEU 108 -10.857 -11.253 -2.761 672 2HD1 LEU 108 2HD1 LEU 108 -9.285 -10.698 -2.123 673 3HD1 LEU 108 3HD1 LEU 108 -9.354 -12.044 -3.254 674 1HD2 LEU 108 1HD2 LEU 108 -11.813 -11.660 -0.479 675 2HD2 LEU 108 2HD2 LEU 108 -10.932 -12.633 0.714 676 3HD2 LEU 108 3HD2 LEU 108 -10.315 -11.057 0.276 677 H GLU 109 H GLU 109 -12.986 -16.031 -0.504 678 HA GLU 109 HA GLU 109 -12.443 -18.482 -1.918 679 1HB GLU 109 1HB GLU 109 -15.062 -17.209 -0.987 680 2HB GLU 109 2HB GLU 109 -14.878 -18.857 -1.558 681 1HG GLU 109 1HG GLU 109 -13.040 -19.123 0.255 682 2HG GLU 109 2HG GLU 109 -13.727 -17.652 0.965 683 HA PRO 110 HA PRO 110 -12.744 -17.172 -6.001 684 1HB PRO 110 1HB PRO 110 -14.009 -19.167 -7.351 685 2HB PRO 110 2HB PRO 110 -12.423 -19.332 -6.556 686 1HG PRO 110 1HG PRO 110 -15.144 -20.126 -5.483 687 2HG PRO 110 2HG PRO 110 -13.675 -21.139 -5.534 688 1HD PRO 110 1HD PRO 110 -14.419 -19.747 -3.332 689 2HD PRO 110 2HD PRO 110 -12.696 -19.918 -3.738 690 H GLY 111 H GLY 111 -13.877 -15.273 -6.083 691 1HA GLY 111 1HA GLY 111 -15.916 -14.512 -7.435 692 2HA GLY 111 2HA GLY 111 -16.849 -15.318 -6.158 693 H GLU 112 H GLU 112 -14.499 -14.495 -4.172 694 HA GLU 112 HA GLU 112 -16.298 -12.504 -3.283 695 1HB GLU 112 1HB GLU 112 -13.735 -13.570 -2.073 696 2HB GLU 112 2HB GLU 112 -14.939 -12.581 -1.251 697 1HG GLU 112 1HG GLU 112 -15.419 -15.324 -2.335 698 2HG GLU 112 2HG GLU 112 -15.326 -14.821 -0.645 699 H GLU 113 H GLU 113 -16.164 -10.365 -3.073 700 HA GLU 113 HA GLU 113 -14.010 -8.888 -4.442 701 1HB GLU 113 1HB GLU 113 -16.675 -7.925 -3.325 702 2HB GLU 113 2HB GLU 113 -15.556 -7.017 -4.341 703 1HG GLU 113 1HG GLU 113 -16.035 -9.151 -5.915 704 2HG GLU 113 2HG GLU 113 -17.484 -9.159 -4.903 705 H MET 114 H MET 114 -12.208 -8.514 -3.047 706 HA MET 114 HA MET 114 -12.668 -7.834 -0.236 707 1HB MET 114 1HB MET 114 -10.900 -9.469 -1.176 708 2HB MET 114 2HB MET 114 -10.055 -8.068 -1.803 709 1HG MET 114 1HG MET 114 -10.752 -8.454 1.129 710 2HG MET 114 2HG MET 114 -9.237 -8.928 0.346 711 1HE MET 114 1HE MET 114 -9.309 -7.120 2.939 712 2HE MET 114 2HE MET 114 -7.843 -7.690 2.102 713 3HE MET 114 3HE MET 114 -8.022 -5.962 2.497 714 H GLU 115 H GLU 115 -12.545 -5.732 0.328 715 HA GLU 115 HA GLU 115 -10.563 -4.124 -0.893 716 1HB GLU 115 1HB GLU 115 -11.858 -2.103 -1.348 717 2HB GLU 115 2HB GLU 115 -12.368 -3.422 -2.391 718 1HG GLU 115 1HG GLU 115 -14.386 -3.765 -1.036 719 2HG GLU 115 2HG GLU 115 -13.856 -2.523 0.119 720 H MET 116 H MET 116 -9.932 -2.291 0.392 721 HA MET 116 HA MET 116 -11.314 -1.817 2.894 722 1HB MET 116 1HB MET 116 -8.475 -2.927 2.941 723 2HB MET 116 2HB MET 116 -9.225 -2.031 4.263 724 1HG MET 116 1HG MET 116 -11.066 -3.755 4.295 725 2HG MET 116 2HG MET 116 -10.128 -4.693 3.134 726 1HE MET 116 1HE MET 116 -8.627 -2.695 6.313 727 2HE MET 116 2HE MET 116 -10.246 -3.278 6.787 728 3HE MET 116 3HE MET 116 -8.785 -3.997 7.503 729 HA PRO 117 HA PRO 117 -9.172 2.172 2.112 730 1HB PRO 117 1HB PRO 117 -9.689 2.850 4.904 731 2HB PRO 117 2HB PRO 117 -10.226 3.670 3.427 732 1HG PRO 117 1HG PRO 117 -11.972 2.240 5.028 733 2HG PRO 117 2HG PRO 117 -12.154 2.389 3.258 734 1HD PRO 117 1HD PRO 117 -10.976 0.075 4.806 735 2HD PRO 117 2HD PRO 117 -12.119 0.092 3.427 736 H VAL 118 H VAL 118 -6.947 2.583 2.390 737 HA VAL 118 HA VAL 118 -5.616 1.663 4.898 738 HB VAL 118 HB VAL 118 -4.375 2.524 2.248 739 1HG1 VAL 118 1HG1 VAL 118 -3.107 1.463 4.776 740 2HG1 VAL 118 2HG1 VAL 118 -2.277 1.668 3.218 741 3HG1 VAL 118 3HG1 VAL 118 -2.933 3.073 4.058 742 1HG2 VAL 118 1HG2 VAL 118 -3.665 0.144 2.005 743 2HG2 VAL 118 2HG2 VAL 118 -4.786 -0.273 3.324 744 3HG2 VAL 118 3HG2 VAL 118 -5.402 0.408 1.810 745 H VAL 119 H VAL 119 -5.103 3.416 6.245 746 HA VAL 119 HA VAL 119 -5.435 6.150 5.065 747 HB VAL 119 HB VAL 119 -5.666 7.020 7.198 748 1HG1 VAL 119 1HG1 VAL 119 -7.669 6.176 6.040 749 2HG1 VAL 119 2HG1 VAL 119 -7.515 4.623 6.886 750 3HG1 VAL 119 3HG1 VAL 119 -7.847 6.106 7.801 751 1HG2 VAL 119 1HG2 VAL 119 -5.363 4.168 8.274 752 2HG2 VAL 119 2HG2 VAL 119 -4.270 5.536 8.586 753 3HG2 VAL 119 3HG2 VAL 119 -5.914 5.548 9.236 754 H PHE 120 H PHE 120 -3.687 7.568 5.033 755 HA PHE 120 HA PHE 120 -1.040 6.457 5.825 756 1HB PHE 120 1HB PHE 120 -1.697 5.394 3.689 757 2HB PHE 120 2HB PHE 120 -2.071 6.972 3.005 758 HD1 PHE 120 HD1 PHE 120 -0.352 8.438 2.227 759 HD2 PHE 120 HD2 PHE 120 0.693 4.917 4.451 760 HE1 PHE 120 HE1 PHE 120 2.036 9.011 1.982 761 HE2 PHE 120 HE2 PHE 120 3.077 5.551 4.319 762 HZ PHE 120 HZ PHE 120 3.770 7.562 3.063 763 H PHE 121 H PHE 121 0.685 7.871 5.785 764 HA PHE 121 HA PHE 121 0.727 10.277 4.341 765 1HB PHE 121 1HB PHE 121 1.049 11.850 6.215 766 2HB PHE 121 2HB PHE 121 -0.574 11.201 6.181 767 HD1 PHE 121 HD1 PHE 121 2.577 11.312 8.061 768 HD2 PHE 121 HD2 PHE 121 -1.303 9.504 7.785 769 HE1 PHE 121 HE1 PHE 121 2.847 10.405 10.367 770 HE2 PHE 121 HE2 PHE 121 -1.056 8.599 10.109 771 HZ PHE 121 HZ PHE 121 1.036 9.005 11.356 772 H VAL 122 H VAL 122 2.902 11.429 4.904 773 HA VAL 122 HA VAL 122 5.019 9.411 5.549 774 HB VAL 122 HB VAL 122 5.003 11.989 3.968 775 1HG1 VAL 122 1HG1 VAL 122 7.434 11.278 3.419 776 2HG1 VAL 122 2HG1 VAL 122 7.141 11.969 5.018 777 3HG1 VAL 122 3HG1 VAL 122 7.316 10.216 4.835 778 1HG2 VAL 122 1HG2 VAL 122 4.065 10.135 2.688 779 2HG2 VAL 122 2HG2 VAL 122 5.656 10.549 2.043 780 3HG2 VAL 122 3HG2 VAL 122 5.465 9.124 3.077 781 H ASP 123 H ASP 123 6.296 9.853 7.371 782 HA ASP 123 HA ASP 123 5.478 12.026 9.106 783 1HB ASP 123 1HB ASP 123 7.641 9.913 9.209 784 2HB ASP 123 2HB ASP 123 7.510 11.197 10.417 785 HA PRO 124 HA PRO 124 8.712 14.798 7.417 786 1HB PRO 124 1HB PRO 124 8.344 16.949 9.120 787 2HB PRO 124 2HB PRO 124 7.370 16.572 7.695 788 1HG PRO 124 1HG PRO 124 6.744 16.092 10.568 789 2HG PRO 124 2HG PRO 124 5.601 16.501 9.244 790 1HD PRO 124 1HD PRO 124 6.008 13.941 10.312 791 2HD PRO 124 2HD PRO 124 5.280 14.301 8.725 792 H GLU 125 H GLU 125 9.820 12.870 8.377 793 HA GLU 125 HA GLU 125 11.865 13.776 10.308 794 1HB GLU 125 1HB GLU 125 12.002 11.718 11.448 795 2HB GLU 125 2HB GLU 125 10.367 12.400 11.550 796 1HG GLU 125 1HG GLU 125 9.860 11.025 9.464 797 2HG GLU 125 2HG GLU 125 11.411 10.231 9.757 798 H ILE 126 H ILE 126 11.083 11.566 7.631 799 HA ILE 126 HA ILE 126 13.474 10.650 6.837 800 HB ILE 126 HB ILE 126 11.345 10.215 5.811 801 1HG1 ILE 126 1HG1 ILE 126 13.336 11.208 3.720 802 2HG1 ILE 126 2HG1 ILE 126 13.560 9.760 4.723 803 1HG2 ILE 126 1HG2 ILE 126 10.261 11.635 4.208 804 2HG2 ILE 126 2HG2 ILE 126 10.498 12.607 5.659 805 3HG2 ILE 126 3HG2 ILE 126 11.572 12.820 4.259 806 1HD1 ILE 126 1HD1 ILE 126 11.404 8.869 3.915 807 2HD1 ILE 126 2HD1 ILE 126 11.318 10.218 2.745 808 3HD1 ILE 126 3HD1 ILE 126 12.652 9.050 2.666 809 H VAL 127 H VAL 127 12.427 14.035 6.313 810 HA VAL 127 HA VAL 127 14.904 14.748 4.910 811 HB VAL 127 HB VAL 127 13.971 17.071 5.089 812 1HG1 VAL 127 1HG1 VAL 127 12.240 16.730 3.426 813 2HG1 VAL 127 2HG1 VAL 127 13.623 15.660 3.123 814 3HG1 VAL 127 3HG1 VAL 127 12.131 15.009 3.836 815 1HG2 VAL 127 1HG2 VAL 127 11.721 17.464 5.806 816 2HG2 VAL 127 2HG2 VAL 127 11.418 15.755 6.130 817 3HG2 VAL 127 3HG2 VAL 127 12.536 16.674 7.159 818 H LYS 128 H LYS 128 15.755 13.559 7.142 819 HA LYS 128 HA LYS 128 17.027 15.767 8.601 820 1HB LYS 128 1HB LYS 128 15.535 13.684 10.227 821 2HB LYS 128 2HB LYS 128 16.613 14.940 10.826 822 1HG LYS 128 1HG LYS 128 15.099 16.681 9.934 823 2HG LYS 128 2HG LYS 128 14.032 15.415 9.288 824 1HD LYS 128 1HD LYS 128 13.576 14.554 11.504 825 2HD LYS 128 2HD LYS 128 14.622 15.776 12.241 826 1HE LYS 128 1HE LYS 128 13.171 17.535 11.834 827 2HE LYS 128 2HE LYS 128 12.502 16.822 10.363 828 1HZ LYS 128 1HZ LYS 128 11.059 15.520 11.512 829 2HZ LYS 128 2HZ LYS 128 11.827 15.704 12.986 830 3HZ LYS 128 3HZ LYS 128 10.991 16.937 12.284 831 HA PRO 129 HA PRO 129 19.791 12.135 9.481 832 1HB PRO 129 1HB PRO 129 19.287 9.535 8.854 833 2HB PRO 129 2HB PRO 129 18.613 10.308 10.314 834 1HG PRO 129 1HG PRO 129 17.260 10.023 7.609 835 2HG PRO 129 2HG PRO 129 16.626 9.519 9.197 836 1HD PRO 129 1HD PRO 129 15.912 11.872 8.186 837 2HD PRO 129 2HD PRO 129 16.351 11.734 9.913 838 H VAL 130 H VAL 130 21.549 11.352 8.322 839 HA VAL 130 HA VAL 130 21.966 12.115 5.667 840 HB VAL 130 HB VAL 130 23.409 10.102 7.438 841 1HG1 VAL 130 1HG1 VAL 130 24.085 9.762 5.117 842 2HG1 VAL 130 2HG1 VAL 130 24.299 11.515 4.895 843 3HG1 VAL 130 3HG1 VAL 130 25.371 10.607 5.987 844 1HG2 VAL 130 1HG2 VAL 130 24.951 12.011 7.863 845 2HG2 VAL 130 2HG2 VAL 130 23.897 13.074 6.910 846 3HG2 VAL 130 3HG2 VAL 130 23.325 12.378 8.439 847 H GLU 131 H GLU 131 20.855 9.099 7.068 848 HA GLU 131 HA GLU 131 20.995 7.116 5.217 849 1HB GLU 131 1HB GLU 131 18.523 8.074 6.730 850 2HB GLU 131 2HB GLU 131 18.698 6.465 6.040 851 1HG GLU 131 1HG GLU 131 20.253 5.792 7.667 852 2HG GLU 131 2HG GLU 131 20.673 7.436 8.145 853 H THR 132 H THR 132 18.364 9.527 5.213 854 HA THR 132 HA THR 132 17.587 8.552 2.554 855 HB THR 132 HB THR 132 15.412 9.740 3.372 856 HG1 THR 132 HG1 THR 132 15.891 10.873 5.181 857 1HG2 THR 132 1HG2 THR 132 14.852 7.827 4.853 858 2HG2 THR 132 2HG2 THR 132 15.691 7.295 3.386 859 3HG2 THR 132 3HG2 THR 132 16.560 7.380 4.933 860 H GLN 133 H GLN 133 18.249 11.511 4.364 861 HA GLN 133 HA GLN 133 18.070 13.740 3.544 862 1HB GLN 133 1HB GLN 133 20.339 12.528 4.223 863 2HB GLN 133 2HB GLN 133 20.762 12.739 2.561 864 1HG GLN 133 1HG GLN 133 21.651 14.588 3.806 865 2HG GLN 133 2HG GLN 133 20.358 15.216 2.785 866 1HE2 GLN 133 1HE2 GLN 133 19.311 13.411 5.668 867 2HE2 GLN 133 2HE2 GLN 133 19.042 14.802 6.668 868 H GLY 134 H GLY 134 16.426 13.253 1.655 869 1HA GLY 134 1HA GLY 134 16.566 14.809 -0.453 870 2HA GLY 134 2HA GLY 134 17.732 13.603 -1.016 871 H ILE 135 H ILE 135 16.464 11.300 0.179 872 HA ILE 135 HA ILE 135 14.580 10.469 -1.754 873 HB ILE 135 HB ILE 135 15.001 9.589 1.097 874 1HG1 ILE 135 1HG1 ILE 135 16.920 9.183 -0.434 875 2HG1 ILE 135 2HG1 ILE 135 16.110 7.722 0.128 876 1HG2 ILE 135 1HG2 ILE 135 13.265 8.323 -1.060 877 2HG2 ILE 135 2HG2 ILE 135 13.746 7.547 0.476 878 3HG2 ILE 135 3HG2 ILE 135 12.705 8.967 0.478 879 1HD1 ILE 135 1HD1 ILE 135 15.030 7.382 -2.002 880 2HD1 ILE 135 2HD1 ILE 135 15.734 8.896 -2.637 881 3HD1 ILE 135 3HD1 ILE 135 16.781 7.538 -2.189 882 H LYS 136 H LYS 136 12.534 11.141 -2.116 883 HA LYS 136 HA LYS 136 10.732 11.610 0.067 884 1HB LYS 136 1HB LYS 136 10.143 13.959 -0.644 885 2HB LYS 136 2HB LYS 136 11.606 13.733 0.296 886 1HG LYS 136 1HG LYS 136 12.865 14.627 -1.247 887 2HG LYS 136 2HG LYS 136 12.315 13.507 -2.514 888 1HD LYS 136 1HD LYS 136 10.253 14.809 -2.797 889 2HD LYS 136 2HD LYS 136 10.814 16.000 -1.614 890 1HE LYS 136 1HE LYS 136 12.090 15.340 -4.327 891 2HE LYS 136 2HE LYS 136 11.263 16.843 -3.891 892 1HZ LYS 136 1HZ LYS 136 13.793 15.854 -2.740 893 2HZ LYS 136 2HZ LYS 136 13.628 17.112 -3.784 894 3HZ LYS 136 3HZ LYS 136 13.018 17.226 -2.260 895 H THR 137 H THR 137 10.621 9.658 -1.705 896 HA THR 137 HA THR 137 8.042 10.228 -2.971 897 HB THR 137 HB THR 137 8.936 8.601 -4.860 898 HG1 THR 137 HG1 THR 137 10.898 8.186 -3.838 899 1HG2 THR 137 1HG2 THR 137 9.777 11.504 -4.692 900 2HG2 THR 137 2HG2 THR 137 9.808 10.525 -6.183 901 3HG2 THR 137 3HG2 THR 137 8.267 10.820 -5.342 902 H LEU 138 H LEU 138 7.147 9.013 -1.236 903 HA LEU 138 HA LEU 138 8.760 6.705 -0.364 904 1HB LEU 138 1HB LEU 138 7.669 8.715 0.934 905 2HB LEU 138 2HB LEU 138 6.315 7.580 1.120 906 HG LEU 138 HG LEU 138 8.134 5.925 1.848 907 1HD1 LEU 138 1HD1 LEU 138 10.172 7.141 1.271 908 2HD1 LEU 138 2HD1 LEU 138 9.635 8.532 2.242 909 3HD1 LEU 138 3HD1 LEU 138 10.042 6.993 3.029 910 1HD2 LEU 138 1HD2 LEU 138 7.997 6.707 4.194 911 2HD2 LEU 138 2HD2 LEU 138 7.529 8.312 3.650 912 3HD2 LEU 138 3HD2 LEU 138 6.429 6.948 3.392 913 H THR 139 H THR 139 8.451 5.152 -1.892 914 HA THR 139 HA THR 139 5.702 4.542 -2.709 915 HB THR 139 HB THR 139 7.180 5.104 -4.489 916 HG1 THR 139 HG1 THR 139 5.713 3.327 -4.875 917 1HG2 THR 139 1HG2 THR 139 9.105 3.671 -5.073 918 2HG2 THR 139 2HG2 THR 139 9.334 4.568 -3.558 919 3HG2 THR 139 3HG2 THR 139 8.918 2.828 -3.522 920 H LEU 140 H LEU 140 4.989 2.360 -3.006 921 HA LEU 140 HA LEU 140 6.506 0.322 -1.534 922 1HB LEU 140 1HB LEU 140 3.650 -0.323 -1.897 923 2HB LEU 140 2HB LEU 140 4.838 -0.827 -0.717 924 HG LEU 140 HG LEU 140 4.644 1.670 0.145 925 1HD1 LEU 140 1HD1 LEU 140 3.225 2.377 -1.836 926 2HD1 LEU 140 2HD1 LEU 140 2.015 1.184 -1.363 927 3HD1 LEU 140 3HD1 LEU 140 2.349 2.578 -0.314 928 1HD2 LEU 140 1HD2 LEU 140 4.049 -0.254 1.414 929 2HD2 LEU 140 2HD2 LEU 140 2.676 0.866 1.540 930 3HD2 LEU 140 3HD2 LEU 140 2.580 -0.543 0.460 931 H SER 141 H SER 141 7.077 -1.308 -3.102 932 HA SER 141 HA SER 141 5.409 -1.521 -5.595 933 1HB SER 141 1HB SER 141 8.048 -2.817 -4.927 934 2HB SER 141 2HB SER 141 7.013 -3.249 -6.298 935 HG SER 141 HG SER 141 7.189 -1.231 -7.122 936 H TYR 142 H TYR 142 3.570 -2.457 -5.176 937 HA TYR 142 HA TYR 142 3.349 -4.875 -3.462 938 1HB TYR 142 1HB TYR 142 1.462 -3.210 -5.126 939 2HB TYR 142 2HB TYR 142 1.062 -4.878 -4.755 940 HD1 TYR 142 HD1 TYR 142 1.746 -1.548 -3.201 941 HD2 TYR 142 HD2 TYR 142 0.184 -5.538 -2.662 942 HE1 TYR 142 HE1 TYR 142 0.749 -0.882 -1.021 943 HE2 TYR 142 HE2 TYR 142 -0.785 -4.865 -0.507 944 HH TYR 142 HH TYR 142 -0.644 -3.307 1.176 945 H THR 143 H THR 143 4.725 -6.300 -4.347 946 HA THR 143 HA THR 143 4.185 -7.243 -7.140 947 HB THR 143 HB THR 143 6.717 -7.489 -5.446 948 HG1 THR 143 HG1 THR 143 7.502 -5.967 -7.000 949 1HG2 THR 143 1HG2 THR 143 6.445 -9.334 -7.075 950 2HG2 THR 143 2HG2 THR 143 6.160 -8.154 -8.376 951 3HG2 THR 143 3HG2 THR 143 7.744 -8.241 -7.575 952 H PHE 144 H PHE 144 2.376 -8.339 -6.301 953 HA PHE 144 HA PHE 144 2.402 -10.344 -4.394 954 1HB PHE 144 1HB PHE 144 0.899 -9.938 -6.988 955 2HB PHE 144 2HB PHE 144 0.602 -11.294 -5.964 956 HD1 PHE 144 HD1 PHE 144 0.022 -10.794 -3.427 957 HD2 PHE 144 HD2 PHE 144 -0.509 -8.010 -6.674 958 HE1 PHE 144 HE1 PHE 144 -1.538 -9.454 -2.030 959 HE2 PHE 144 HE2 PHE 144 -2.312 -6.927 -5.383 960 HZ PHE 144 HZ PHE 144 -2.689 -7.518 -3.003 961 H TYR 145 H TYR 145 2.723 -12.507 -4.368 962 HA TYR 145 HA TYR 145 3.640 -14.099 -6.589 963 1HB TYR 145 1HB TYR 145 5.881 -14.454 -5.835 964 2HB TYR 145 2HB TYR 145 5.643 -12.767 -6.224 965 HD1 TYR 145 HD1 TYR 145 7.584 -14.581 -4.274 966 HD2 TYR 145 HD2 TYR 145 4.553 -11.561 -3.655 967 HE1 TYR 145 HE1 TYR 145 8.939 -13.558 -2.483 968 HE2 TYR 145 HE2 TYR 145 6.005 -10.439 -2.051 969 HH TYR 145 HH TYR 145 9.194 -11.726 -1.100 970 HA PRO 146 HA PRO 146 2.095 -15.954 -2.547 971 1HB PRO 146 1HB PRO 146 -0.462 -16.648 -3.025 972 2HB PRO 146 2HB PRO 146 0.094 -15.018 -2.595 973 1HG PRO 146 1HG PRO 146 -0.491 -16.040 -5.421 974 2HG PRO 146 2HG PRO 146 -1.063 -14.586 -4.591 975 1HD PRO 146 1HD PRO 146 1.107 -14.483 -6.216 976 2HD PRO 146 2HD PRO 146 0.977 -13.552 -4.696 977 H ARG 147 H ARG 147 0.106 -17.699 -4.874 978 HA ARG 147 HA ARG 147 1.620 -20.118 -5.101 979 1HB ARG 147 1HB ARG 147 -0.967 -20.063 -3.452 980 2HB ARG 147 2HB ARG 147 -0.145 -21.508 -4.048 981 1HG ARG 147 1HG ARG 147 1.890 -20.832 -2.708 982 2HG ARG 147 2HG ARG 147 0.888 -19.580 -1.943 983 1HD ARG 147 1HD ARG 147 -0.727 -21.336 -1.222 984 2HD ARG 147 2HD ARG 147 0.306 -22.574 -1.979 985 HE ARG 147 HE ARG 147 1.902 -21.076 -0.187 986 1HH1 ARG 147 1HH1 ARG 147 -0.760 -23.381 -0.121 987 2HH1 ARG 147 2HH1 ARG 147 -0.339 -24.095 1.404 988 1HH2 ARG 147 1HH2 ARG 147 2.511 -21.995 1.858 989 2HH2 ARG 147 2HH2 ARG 147 1.573 -23.273 2.557 990 H GLU 148 H GLU 148 -0.255 -21.693 -6.210 991 HA GLU 148 HA GLU 148 -1.917 -20.035 -8.015 992 1HB GLU 148 1HB GLU 148 0.424 -20.046 -8.780 993 2HB GLU 148 2HB GLU 148 0.374 -21.800 -8.944 994 1HG GLU 148 1HG GLU 148 -1.787 -20.289 -10.378 995 2HG GLU 148 2HG GLU 148 -0.141 -19.933 -10.922 996 HA PRO 149 HA PRO 149 -4.057 -24.029 -7.510 997 1HB PRO 149 1HB PRO 149 -6.392 -23.239 -6.482 998 2HB PRO 149 2HB PRO 149 -4.905 -23.079 -5.533 999 1HG PRO 149 1HG PRO 149 -6.227 -20.898 -7.164 1000 2HG PRO 149 2HG PRO 149 -5.702 -20.852 -5.454 1001 1HD PRO 149 1HD PRO 149 -4.155 -19.962 -7.601 1002 2HD PRO 149 2HD PRO 149 -3.466 -20.547 -6.059 1003 H SER 150 H SER 150 -7.105 -22.765 -8.253 1004 HA SER 150 HA SER 150 -6.566 -23.114 -11.178 1005 1HB SER 150 1HB SER 150 -8.490 -24.486 -11.361 1006 2HB SER 150 2HB SER 150 -7.412 -25.150 -10.134 1007 HG SER 150 HG SER 150 -8.788 -24.026 -8.572 1008 H LYS 151 H LYS 151 -7.180 -21.542 -12.396 1009 HA LYS 151 HA LYS 151 -9.543 -19.848 -11.783 1010 1HB LYS 151 1HB LYS 151 -8.254 -17.956 -12.908 1011 2HB LYS 151 2HB LYS 151 -7.815 -18.306 -11.270 1012 1HG LYS 151 1HG LYS 151 -6.275 -19.658 -13.500 1013 2HG LYS 151 2HG LYS 151 -5.952 -17.975 -13.104 1014 1HD LYS 151 1HD LYS 151 -4.870 -18.444 -11.161 1015 2HD LYS 151 2HD LYS 151 -6.062 -19.625 -10.664 1016 1HE LYS 151 1HE LYS 151 -3.969 -20.739 -10.852 1017 2HE LYS 151 2HE LYS 151 -5.025 -21.366 -12.107 1018 1HZ LYS 151 1HZ LYS 151 -3.825 -20.032 -13.709 1019 2HZ LYS 151 2HZ LYS 151 -2.880 -19.386 -12.508 1020 3HZ LYS 151 3HZ LYS 151 -2.803 -20.975 -12.817 Start of MODEL 23 1 H VAL 21 H VAL 21 0.697 9.622 13.552 2 HA VAL 21 HA VAL 21 -0.373 6.884 14.172 3 HB VAL 21 HB VAL 21 0.664 7.667 16.134 4 1HG1 VAL 21 1HG1 VAL 21 0.423 10.139 15.862 5 2HG1 VAL 21 2HG1 VAL 21 -1.291 10.003 16.285 6 3HG1 VAL 21 3HG1 VAL 21 -0.051 9.554 17.461 7 1HG2 VAL 21 1HG2 VAL 21 -1.138 7.274 17.704 8 2HG2 VAL 21 2HG2 VAL 21 -2.357 7.659 16.479 9 3HG2 VAL 21 3HG2 VAL 21 -1.324 6.228 16.288 10 H GLU 22 H GLU 22 -1.295 7.282 12.171 11 HA GLU 22 HA GLU 22 -2.999 7.812 10.742 12 1HB GLU 22 1HB GLU 22 -3.824 6.170 12.635 13 2HB GLU 22 2HB GLU 22 -4.896 7.511 13.059 14 1HG GLU 22 1HG GLU 22 -5.703 7.526 10.665 15 2HG GLU 22 2HG GLU 22 -4.632 6.155 10.331 16 H GLN 23 H GLN 23 -1.787 10.150 11.817 17 HA GLN 23 HA GLN 23 -3.200 12.268 10.966 18 1HB GLN 23 1HB GLN 23 -4.186 11.382 13.615 19 2HB GLN 23 2HB GLN 23 -3.369 12.924 13.776 20 1HG GLN 23 1HG GLN 23 -5.462 12.427 11.624 21 2HG GLN 23 2HG GLN 23 -5.847 13.035 13.245 22 1HE2 GLN 23 1HE2 GLN 23 -4.119 13.863 10.178 23 2HE2 GLN 23 2HE2 GLN 23 -3.755 15.510 10.670 24 H ALA 24 H ALA 24 -1.954 14.196 11.452 25 HA ALA 24 HA ALA 24 0.686 13.754 12.787 26 1HB ALA 24 1HB ALA 24 0.432 14.718 9.954 27 2HB ALA 24 2HB ALA 24 1.890 14.111 10.765 28 3HB ALA 24 3HB ALA 24 0.575 12.990 10.315 29 H SER 25 H SER 25 -1.825 15.959 12.314 30 HA SER 25 HA SER 25 -0.678 18.285 11.707 31 1HB SER 25 1HB SER 25 -3.128 18.084 13.452 32 2HB SER 25 2HB SER 25 -2.855 19.116 12.036 33 HG SER 25 HG SER 25 -4.094 16.840 12.081 34 H ASP 26 H ASP 26 0.322 16.916 14.411 35 HA ASP 26 HA ASP 26 0.609 19.364 16.049 36 1HB ASP 26 1HB ASP 26 0.592 17.166 17.149 37 2HB ASP 26 2HB ASP 26 1.902 16.605 16.094 38 H LEU 27 H LEU 27 2.240 17.338 13.598 39 HA LEU 27 HA LEU 27 4.537 19.165 13.416 40 1HB LEU 27 1HB LEU 27 3.927 16.484 12.116 41 2HB LEU 27 2HB LEU 27 5.322 17.507 11.763 42 HG LEU 27 HG LEU 27 6.094 17.350 14.106 43 1HD1 LEU 27 1HD1 LEU 27 4.118 16.793 15.361 44 2HD1 LEU 27 2HD1 LEU 27 3.798 15.355 14.360 45 3HD1 LEU 27 3HD1 LEU 27 5.191 15.406 15.463 46 1HD2 LEU 27 1HD2 LEU 27 6.905 15.020 13.866 47 2HD2 LEU 27 2HD2 LEU 27 5.669 14.720 12.626 48 3HD2 LEU 27 3HD2 LEU 27 6.975 15.888 12.326 49 H ILE 28 H ILE 28 1.756 18.163 11.484 50 HA ILE 28 HA ILE 28 2.424 18.394 9.025 51 HB ILE 28 HB ILE 28 -0.121 19.596 10.100 52 1HG1 ILE 28 1HG1 ILE 28 0.546 17.206 8.289 53 2HG1 ILE 28 2HG1 ILE 28 0.392 17.115 10.030 54 1HG2 ILE 28 1HG2 ILE 28 0.543 19.287 7.157 55 2HG2 ILE 28 2HG2 ILE 28 -1.054 19.650 7.834 56 3HG2 ILE 28 3HG2 ILE 28 0.219 20.837 7.988 57 1HD1 ILE 28 1HD1 ILE 28 -2.016 18.057 9.677 58 2HD1 ILE 28 2HD1 ILE 28 -1.789 17.581 7.990 59 3HD1 ILE 28 3HD1 ILE 28 -1.701 16.355 9.264 60 H LEU 29 H LEU 29 3.075 19.530 7.375 61 HA LEU 29 HA LEU 29 3.941 22.339 7.915 62 1HB LEU 29 1HB LEU 29 5.095 20.225 6.068 63 2HB LEU 29 2HB LEU 29 5.673 21.884 6.280 64 HG LEU 29 HG LEU 29 7.080 20.545 7.510 65 1HD1 LEU 29 1HD1 LEU 29 6.879 21.235 9.819 66 2HD1 LEU 29 2HD1 LEU 29 6.430 22.553 8.714 67 3HD1 LEU 29 3HD1 LEU 29 5.177 21.649 9.592 68 1HD2 LEU 29 1HD2 LEU 29 5.783 18.498 7.549 69 2HD2 LEU 29 2HD2 LEU 29 6.535 18.837 9.114 70 3HD2 LEU 29 3HD2 LEU 29 4.804 19.047 8.910 71 H ASP 30 H ASP 30 4.000 21.122 4.679 72 HA ASP 30 HA ASP 30 1.618 22.315 3.645 73 1HB ASP 30 1HB ASP 30 2.527 24.466 4.285 74 2HB ASP 30 2HB ASP 30 4.149 24.028 3.719 75 H GLU 31 H GLU 31 5.092 21.977 3.117 76 HA GLU 31 HA GLU 31 5.446 21.636 0.524 77 1HB GLU 31 1HB GLU 31 6.933 20.948 2.801 78 2HB GLU 31 2HB GLU 31 6.821 19.425 1.915 79 1HG GLU 31 1HG GLU 31 7.810 22.012 0.705 80 2HG GLU 31 2HG GLU 31 8.822 20.767 1.444 81 H LYS 32 H LYS 32 5.236 20.077 -1.116 82 HA LYS 32 HA LYS 32 2.866 18.362 -0.600 83 1HB LYS 32 1HB LYS 32 2.721 20.407 -2.049 84 2HB LYS 32 2HB LYS 32 3.906 19.677 -3.151 85 1HG LYS 32 1HG LYS 32 2.362 17.678 -3.309 86 2HG LYS 32 2HG LYS 32 1.292 18.491 -2.173 87 1HD LYS 32 1HD LYS 32 0.189 19.034 -4.057 88 2HD LYS 32 2HD LYS 32 1.266 20.431 -3.952 89 1HE LYS 32 1HE LYS 32 1.477 17.926 -5.710 90 2HE LYS 32 2HE LYS 32 1.301 19.596 -6.259 91 1HZ LYS 32 1HZ LYS 32 3.549 18.788 -6.508 92 2HZ LYS 32 2HZ LYS 32 3.529 20.009 -5.400 93 3HZ LYS 32 3HZ LYS 32 3.661 18.448 -4.901 94 H ILE 33 H ILE 33 3.954 16.572 0.056 95 HA ILE 33 HA ILE 33 6.364 15.534 -1.325 96 HB ILE 33 HB ILE 33 6.171 15.916 1.052 97 1HG1 ILE 33 1HG1 ILE 33 7.963 14.755 0.312 98 2HG1 ILE 33 2HG1 ILE 33 7.340 13.911 1.702 99 1HG2 ILE 33 1HG2 ILE 33 4.466 13.417 1.182 100 2HG2 ILE 33 2HG2 ILE 33 5.166 14.336 2.532 101 3HG2 ILE 33 3HG2 ILE 33 3.920 15.070 1.538 102 1HD1 ILE 33 1HD1 ILE 33 6.143 12.314 0.044 103 2HD1 ILE 33 2HD1 ILE 33 7.196 13.028 -1.189 104 3HD1 ILE 33 3HD1 ILE 33 7.900 12.174 0.192 105 H LYS 34 H LYS 34 6.103 14.269 -3.032 106 HA LYS 34 HA LYS 34 3.518 13.236 -3.761 107 1HB LYS 34 1HB LYS 34 5.422 14.234 -5.194 108 2HB LYS 34 2HB LYS 34 6.142 12.624 -5.171 109 1HG LYS 34 1HG LYS 34 3.244 13.096 -6.022 110 2HG LYS 34 2HG LYS 34 4.578 13.464 -7.098 111 1HD LYS 34 1HD LYS 34 5.036 10.789 -6.152 112 2HD LYS 34 2HD LYS 34 3.336 10.934 -6.501 113 1HE LYS 34 1HE LYS 34 4.064 11.998 -8.782 114 2HE LYS 34 2HE LYS 34 5.730 11.582 -8.327 115 1HZ LYS 34 1HZ LYS 34 4.955 9.908 -9.710 116 2HZ LYS 34 2HZ LYS 34 4.768 9.198 -8.226 117 3HZ LYS 34 3HZ LYS 34 3.490 9.867 -9.043 118 H VAL 35 H VAL 35 3.141 10.847 -4.298 119 HA VAL 35 HA VAL 35 4.965 8.895 -3.030 120 HB VAL 35 HB VAL 35 2.142 9.554 -2.227 121 1HG1 VAL 35 1HG1 VAL 35 2.198 7.082 -2.577 122 2HG1 VAL 35 2HG1 VAL 35 3.578 6.980 -1.460 123 3HG1 VAL 35 3HG1 VAL 35 2.000 7.519 -0.886 124 1HG2 VAL 35 1HG2 VAL 35 3.299 9.224 0.093 125 2HG2 VAL 35 2HG2 VAL 35 4.799 9.340 -0.789 126 3HG2 VAL 35 3HG2 VAL 35 3.645 10.701 -0.802 127 H THR 36 H THR 36 4.677 6.875 -3.898 128 HA THR 36 HA THR 36 2.982 6.644 -6.334 129 HB THR 36 HB THR 36 6.034 6.429 -6.086 130 HG1 THR 36 HG1 THR 36 5.159 8.496 -6.307 131 1HG2 THR 36 1HG2 THR 36 6.051 5.937 -8.505 132 2HG2 THR 36 2HG2 THR 36 5.339 4.653 -7.519 133 3HG2 THR 36 3HG2 THR 36 4.278 5.742 -8.456 134 H PHE 37 H PHE 37 1.773 5.042 -5.683 135 HA PHE 37 HA PHE 37 2.798 2.988 -3.874 136 1HB PHE 37 1HB PHE 37 0.180 3.284 -5.414 137 2HB PHE 37 2HB PHE 37 0.521 2.114 -4.154 138 HD1 PHE 37 HD1 PHE 37 -1.090 5.153 -4.729 139 HD2 PHE 37 HD2 PHE 37 1.511 3.228 -1.860 140 HE1 PHE 37 HE1 PHE 37 -1.782 6.759 -2.994 141 HE2 PHE 37 HE2 PHE 37 0.888 4.929 -0.164 142 HZ PHE 37 HZ PHE 37 -0.706 6.735 -0.754 143 H ASP 38 H ASP 38 3.200 0.743 -4.430 144 HA ASP 38 HA ASP 38 2.964 0.080 -7.331 145 1HB ASP 38 1HB ASP 38 5.293 0.705 -6.877 146 2HB ASP 38 2HB ASP 38 5.327 -0.313 -5.457 147 H ALA 39 H ALA 39 0.940 -0.771 -6.787 148 HA ALA 39 HA ALA 39 0.953 -3.325 -5.271 149 1HB ALA 39 1HB ALA 39 -1.259 -1.781 -6.702 150 2HB ALA 39 2HB ALA 39 -1.468 -3.279 -5.776 151 3HB ALA 39 3HB ALA 39 -0.943 -1.795 -4.957 152 H ASN 40 H ASN 40 2.051 -4.913 -6.518 153 HA ASN 40 HA ASN 40 1.351 -5.014 -9.425 154 1HB ASN 40 1HB ASN 40 3.615 -6.072 -9.733 155 2HB ASN 40 2HB ASN 40 3.516 -4.366 -9.442 156 1HD2 ASN 40 1HD2 ASN 40 4.502 -3.472 -7.716 157 2HD2 ASN 40 2HD2 ASN 40 5.498 -4.382 -6.608 158 H VAL 41 H VAL 41 0.524 -6.706 -10.234 159 HA VAL 41 HA VAL 41 0.030 -9.005 -8.484 160 HB VAL 41 HB VAL 41 -1.907 -7.784 -9.162 161 1HG1 VAL 41 1HG1 VAL 41 -2.764 -7.649 -11.392 162 2HG1 VAL 41 2HG1 VAL 41 -1.175 -6.878 -11.372 163 3HG1 VAL 41 3HG1 VAL 41 -1.375 -8.499 -12.073 164 1HG2 VAL 41 1HG2 VAL 41 -2.075 -10.145 -8.750 165 2HG2 VAL 41 2HG2 VAL 41 -3.198 -9.697 -10.047 166 3HG2 VAL 41 3HG2 VAL 41 -1.695 -10.535 -10.444 167 H ALA 42 H ALA 42 1.704 -10.306 -8.654 168 HA ALA 42 HA ALA 42 2.684 -11.174 -11.315 169 1HB ALA 42 1HB ALA 42 4.296 -10.711 -9.502 170 2HB ALA 42 2HB ALA 42 3.525 -11.975 -8.520 171 3HB ALA 42 3HB ALA 42 4.364 -12.406 -10.023 172 H ALA 43 H ALA 43 3.054 -13.602 -11.522 173 HA ALA 43 HA ALA 43 0.624 -15.101 -11.418 174 1HB ALA 43 1HB ALA 43 2.089 -17.026 -11.945 175 2HB ALA 43 2HB ALA 43 2.459 -15.633 -12.981 176 3HB ALA 43 3HB ALA 43 3.524 -16.034 -11.613 177 H GLY 44 H GLY 44 -0.221 -16.310 -9.775 178 1HA GLY 44 1HA GLY 44 0.356 -17.645 -7.655 179 2HA GLY 44 2HA GLY 44 1.147 -16.162 -7.115 180 H LEU 45 H LEU 45 -0.681 -14.250 -8.292 181 HA LEU 45 HA LEU 45 -3.170 -14.796 -6.733 182 1HB LEU 45 1HB LEU 45 -1.043 -12.959 -6.157 183 2HB LEU 45 2HB LEU 45 -2.466 -12.021 -6.553 184 HG LEU 45 HG LEU 45 -2.673 -14.355 -4.582 185 1HD1 LEU 45 1HD1 LEU 45 -2.321 -11.394 -3.883 186 2HD1 LEU 45 2HD1 LEU 45 -2.444 -12.759 -2.768 187 3HD1 LEU 45 3HD1 LEU 45 -0.990 -12.550 -3.758 188 1HD2 LEU 45 1HD2 LEU 45 -4.690 -13.437 -5.678 189 2HD2 LEU 45 2HD2 LEU 45 -4.619 -13.164 -3.919 190 3HD2 LEU 45 3HD2 LEU 45 -4.248 -11.829 -5.056 191 HA PRO 46 HA PRO 46 -4.378 -13.352 -10.906 192 1HB PRO 46 1HB PRO 46 -6.437 -14.991 -11.399 193 2HB PRO 46 2HB PRO 46 -4.772 -15.630 -11.274 194 1HG PRO 46 1HG PRO 46 -6.880 -15.577 -9.106 195 2HG PRO 46 2HG PRO 46 -5.927 -16.995 -9.648 196 1HD PRO 46 1HD PRO 46 -5.256 -15.399 -7.507 197 2HD PRO 46 2HD PRO 46 -4.023 -16.258 -8.473 198 H TRP 47 H TRP 47 -4.795 -11.632 -8.840 199 HA TRP 47 HA TRP 47 -7.757 -11.199 -8.570 200 1HB TRP 47 1HB TRP 47 -5.482 -10.511 -6.707 201 2HB TRP 47 2HB TRP 47 -7.120 -9.865 -6.565 202 HD1 TRP 47 HD1 TRP 47 -7.509 -13.332 -7.681 203 HE1 TRP 47 HE1 TRP 47 -8.141 -14.859 -5.826 204 HE3 TRP 47 HE3 TRP 47 -6.156 -10.416 -3.649 205 HZ2 TRP 47 HZ2 TRP 47 -8.151 -14.933 -3.011 206 HZ3 TRP 47 HZ3 TRP 47 -6.055 -11.621 -1.450 207 HH2 TRP 47 HH2 TRP 47 -7.346 -13.635 -1.055 208 H GLU 48 H GLU 48 -8.612 -9.273 -9.117 209 HA GLU 48 HA GLU 48 -6.938 -7.612 -10.936 210 1HB GLU 48 1HB GLU 48 -9.301 -8.364 -11.493 211 2HB GLU 48 2HB GLU 48 -9.874 -7.304 -10.192 212 1HG GLU 48 1HG GLU 48 -8.905 -5.356 -11.356 213 2HG GLU 48 2HG GLU 48 -8.303 -6.404 -12.650 214 H PHE 49 H PHE 49 -5.533 -7.026 -9.263 215 HA PHE 49 HA PHE 49 -6.543 -5.522 -6.918 216 1HB PHE 49 1HB PHE 49 -4.778 -7.528 -7.104 217 2HB PHE 49 2HB PHE 49 -3.650 -6.202 -7.278 218 HD1 PHE 49 HD1 PHE 49 -4.578 -8.428 -4.981 219 HD2 PHE 49 HD2 PHE 49 -4.615 -4.129 -5.423 220 HE1 PHE 49 HE1 PHE 49 -4.656 -8.171 -2.539 221 HE2 PHE 49 HE2 PHE 49 -4.646 -3.892 -2.960 222 HZ PHE 49 HZ PHE 49 -4.707 -5.911 -1.505 223 H VAL 50 H VAL 50 -7.158 -3.585 -7.908 224 HA VAL 50 HA VAL 50 -5.266 -2.450 -9.828 225 HB VAL 50 HB VAL 50 -6.927 -0.894 -10.455 226 1HG1 VAL 50 1HG1 VAL 50 -7.088 -3.278 -11.237 227 2HG1 VAL 50 2HG1 VAL 50 -8.272 -3.579 -9.944 228 3HG1 VAL 50 3HG1 VAL 50 -8.639 -2.420 -11.232 229 1HG2 VAL 50 1HG2 VAL 50 -9.227 -0.990 -9.359 230 2HG2 VAL 50 2HG2 VAL 50 -8.432 -1.817 -8.003 231 3HG2 VAL 50 3HG2 VAL 50 -7.970 -0.158 -8.431 232 HA PRO 51 HA PRO 51 -3.799 0.615 -6.751 233 1HB PRO 51 1HB PRO 51 -2.179 2.069 -8.391 234 2HB PRO 51 2HB PRO 51 -1.681 0.487 -7.729 235 1HG PRO 51 1HG PRO 51 -2.794 1.086 -10.473 236 2HG PRO 51 2HG PRO 51 -1.405 0.046 -10.052 237 1HD PRO 51 1HD PRO 51 -3.946 -0.883 -10.551 238 2HD PRO 51 2HD PRO 51 -2.824 -1.731 -9.441 239 H VAL 52 H VAL 52 -5.328 2.159 -6.345 240 HA VAL 52 HA VAL 52 -7.310 2.722 -8.276 241 HB VAL 52 HB VAL 52 -8.274 4.228 -6.632 242 1HG1 VAL 52 1HG1 VAL 52 -8.854 1.818 -6.721 243 2HG1 VAL 52 2HG1 VAL 52 -7.447 1.429 -5.714 244 3HG1 VAL 52 3HG1 VAL 52 -8.798 2.366 -5.037 245 1HG2 VAL 52 1HG2 VAL 52 -5.904 3.341 -4.977 246 2HG2 VAL 52 2HG2 VAL 52 -6.208 4.952 -5.630 247 3HG2 VAL 52 3HG2 VAL 52 -7.301 4.297 -4.401 248 H GLN 53 H GLN 53 -4.576 4.518 -7.167 249 HA GLN 53 HA GLN 53 -4.464 5.646 -9.803 250 1HB GLN 53 1HB GLN 53 -3.681 7.838 -9.200 251 2HB GLN 53 2HB GLN 53 -5.309 7.620 -8.576 252 1HG GLN 53 1HG GLN 53 -2.715 7.393 -6.954 253 2HG GLN 53 2HG GLN 53 -3.778 8.807 -7.018 254 1HE2 GLN 53 1HE2 GLN 53 -6.221 8.121 -6.637 255 2HE2 GLN 53 2HE2 GLN 53 -6.438 7.177 -5.174 256 H ARG 54 H ARG 54 -2.088 6.096 -10.251 257 HA ARG 54 HA ARG 54 -0.391 4.073 -9.072 258 1HB ARG 54 1HB ARG 54 -0.056 4.822 -11.354 259 2HB ARG 54 2HB ARG 54 0.167 6.490 -10.837 260 1HG ARG 54 1HG ARG 54 2.264 5.371 -11.465 261 2HG ARG 54 2HG ARG 54 2.294 5.983 -9.810 262 1HD ARG 54 1HD ARG 54 2.158 3.882 -8.905 263 2HD ARG 54 2HD ARG 54 1.563 3.179 -10.426 264 HE ARG 54 HE ARG 54 4.103 4.163 -11.002 265 1HH1 ARG 54 1HH1 ARG 54 3.014 1.864 -8.552 266 2HH1 ARG 54 2HH1 ARG 54 4.123 0.597 -9.001 267 1HH2 ARG 54 1HH2 ARG 54 5.821 2.636 -11.383 268 2HH2 ARG 54 2HH2 ARG 54 5.874 1.162 -10.466 269 H ASP 55 H ASP 55 -0.651 7.671 -8.754 270 HA ASP 55 HA ASP 55 0.943 7.627 -6.311 271 1HB ASP 55 1HB ASP 55 2.129 9.499 -7.488 272 2HB ASP 55 2HB ASP 55 2.394 7.912 -8.230 273 H ILE 56 H ILE 56 0.945 9.581 -5.181 274 HA ILE 56 HA ILE 56 -1.397 11.358 -5.458 275 HB ILE 56 HB ILE 56 -1.942 11.273 -3.122 276 1HG1 ILE 56 1HG1 ILE 56 0.076 9.033 -3.033 277 2HG1 ILE 56 2HG1 ILE 56 0.289 10.651 -2.319 278 1HG2 ILE 56 1HG2 ILE 56 -1.948 8.492 -4.320 279 2HG2 ILE 56 2HG2 ILE 56 -3.035 9.152 -3.063 280 3HG2 ILE 56 3HG2 ILE 56 -3.112 9.783 -4.717 281 1HD1 ILE 56 1HD1 ILE 56 -0.254 9.101 -0.577 282 2HD1 ILE 56 2HD1 ILE 56 -1.543 10.306 -0.774 283 3HD1 ILE 56 3HD1 ILE 56 -1.775 8.647 -1.357 284 H ASP 57 H ASP 57 -1.064 13.158 -3.654 285 HA ASP 57 HA ASP 57 1.651 13.159 -2.673 286 1HB ASP 57 1HB ASP 57 2.011 15.491 -2.779 287 2HB ASP 57 2HB ASP 57 1.633 14.976 -4.428 288 H VAL 58 H VAL 58 1.862 14.219 -0.742 289 HA VAL 58 HA VAL 58 -0.550 14.442 1.064 290 HB VAL 58 HB VAL 58 2.202 13.322 1.522 291 1HG1 VAL 58 1HG1 VAL 58 0.049 14.204 3.485 292 2HG1 VAL 58 2HG1 VAL 58 1.378 13.114 3.930 293 3HG1 VAL 58 3HG1 VAL 58 1.720 14.767 3.421 294 1HG2 VAL 58 1HG2 VAL 58 0.968 11.380 2.250 295 2HG2 VAL 58 2HG2 VAL 58 -0.563 12.210 1.948 296 3HG2 VAL 58 3HG2 VAL 58 0.506 11.781 0.591 297 H ARG 59 H ARG 59 -0.486 16.380 2.258 298 HA ARG 59 HA ARG 59 1.630 18.415 1.720 299 1HB ARG 59 1HB ARG 59 -0.972 18.638 3.290 300 2HB ARG 59 2HB ARG 59 0.099 19.959 2.805 301 1HG ARG 59 1HG ARG 59 -1.456 18.110 0.918 302 2HG ARG 59 2HG ARG 59 -1.959 19.725 1.393 303 1HD ARG 59 1HD ARG 59 0.690 19.132 -0.020 304 2HD ARG 59 2HD ARG 59 -0.747 19.493 -0.894 305 HE ARG 59 HE ARG 59 0.975 21.301 0.685 306 1HH1 ARG 59 1HH1 ARG 59 -2.259 20.901 -0.634 307 2HH1 ARG 59 2HH1 ARG 59 -2.658 22.596 -0.653 308 1HH2 ARG 59 1HH2 ARG 59 0.453 23.576 0.790 309 2HH2 ARG 59 2HH2 ARG 59 -1.043 24.156 0.156 310 H ILE 60 H ILE 60 3.330 17.868 2.889 311 HA ILE 60 HA ILE 60 3.592 15.690 4.123 312 HB ILE 60 HB ILE 60 5.105 17.853 5.550 313 1HG1 ILE 60 1HG1 ILE 60 5.234 16.903 2.729 314 2HG1 ILE 60 2HG1 ILE 60 5.555 18.493 3.450 315 1HG2 ILE 60 1HG2 ILE 60 6.748 16.070 5.829 316 2HG2 ILE 60 2HG2 ILE 60 5.209 15.460 6.399 317 3HG2 ILE 60 3HG2 ILE 60 5.790 14.961 4.818 318 1HD1 ILE 60 1HD1 ILE 60 7.629 17.482 2.586 319 2HD1 ILE 60 2HD1 ILE 60 7.688 17.609 4.361 320 3HD1 ILE 60 3HD1 ILE 60 7.356 16.044 3.562 321 H GLY 61 H GLY 61 2.620 14.502 5.531 322 1HA GLY 61 1HA GLY 61 2.187 13.827 7.729 323 2HA GLY 61 2HA GLY 61 1.939 15.489 8.246 324 H GLU 62 H GLU 62 0.283 15.928 5.620 325 HA GLU 62 HA GLU 62 -2.126 15.526 7.013 326 1HB GLU 62 1HB GLU 62 -1.882 17.335 5.410 327 2HB GLU 62 2HB GLU 62 -1.897 16.171 4.066 328 1HG GLU 62 1HG GLU 62 -4.105 17.269 4.425 329 2HG GLU 62 2HG GLU 62 -4.215 15.522 4.618 330 H THR 63 H THR 63 -3.735 14.237 6.966 331 HA THR 63 HA THR 63 -3.332 11.428 6.317 332 HB THR 63 HB THR 63 -5.754 11.755 7.652 333 HG1 THR 63 HG1 THR 63 -5.081 14.097 7.924 334 1HG2 THR 63 1HG2 THR 63 -2.937 11.527 8.810 335 2HG2 THR 63 2HG2 THR 63 -4.477 11.037 9.575 336 3HG2 THR 63 3HG2 THR 63 -3.898 10.174 8.153 337 H VAL 64 H VAL 64 -3.685 10.903 4.280 338 HA VAL 64 HA VAL 64 -6.215 11.784 2.946 339 HB VAL 64 HB VAL 64 -4.376 12.755 1.864 340 1HG1 VAL 64 1HG1 VAL 64 -3.052 10.010 1.755 341 2HG1 VAL 64 2HG1 VAL 64 -2.481 11.471 0.919 342 3HG1 VAL 64 3HG1 VAL 64 -2.501 11.431 2.680 343 1HG2 VAL 64 1HG2 VAL 64 -4.406 11.900 -0.365 344 2HG2 VAL 64 2HG2 VAL 64 -5.035 10.332 0.165 345 3HG2 VAL 64 3HG2 VAL 64 -6.047 11.795 0.314 346 H GLN 65 H GLN 65 -7.216 10.214 1.585 347 HA GLN 65 HA GLN 65 -6.947 7.346 2.512 348 1HB GLN 65 1HB GLN 65 -9.372 8.969 1.719 349 2HB GLN 65 2HB GLN 65 -9.355 7.229 2.041 350 1HG GLN 65 1HG GLN 65 -8.646 7.588 4.357 351 2HG GLN 65 2HG GLN 65 -8.566 9.340 4.103 352 1HE2 GLN 65 1HE2 GLN 65 -10.726 10.154 2.920 353 2HE2 GLN 65 2HE2 GLN 65 -12.189 9.670 3.768 354 H ILE 66 H ILE 66 -6.304 5.995 1.111 355 HA ILE 66 HA ILE 66 -7.338 6.289 -1.631 356 HB ILE 66 HB ILE 66 -5.220 5.272 -2.505 357 1HG1 ILE 66 1HG1 ILE 66 -3.190 6.309 -1.101 358 2HG1 ILE 66 2HG1 ILE 66 -4.191 5.963 0.276 359 1HG2 ILE 66 1HG2 ILE 66 -4.222 7.403 -2.817 360 2HG2 ILE 66 2HG2 ILE 66 -5.971 7.634 -2.803 361 3HG2 ILE 66 3HG2 ILE 66 -5.008 8.078 -1.373 362 1HD1 ILE 66 1HD1 ILE 66 -3.244 4.028 -1.889 363 2HD1 ILE 66 2HD1 ILE 66 -2.633 4.114 -0.225 364 3HD1 ILE 66 3HD1 ILE 66 -4.282 3.542 -0.537 365 H MET 67 H MET 67 -8.605 4.761 -1.948 366 HA MET 67 HA MET 67 -8.680 2.293 -0.408 367 1HB MET 67 1HB MET 67 -10.121 3.094 -2.973 368 2HB MET 67 2HB MET 67 -10.476 1.644 -2.025 369 1HG MET 67 1HG MET 67 -11.098 3.023 -0.092 370 2HG MET 67 2HG MET 67 -10.765 4.497 -1.018 371 1HE MET 67 1HE MET 67 -13.456 3.941 0.565 372 2HE MET 67 2HE MET 67 -13.132 5.427 -0.368 373 3HE MET 67 3HE MET 67 -14.646 4.527 -0.621 374 H TYR 68 H TYR 68 -8.706 0.131 -1.431 375 HA TYR 68 HA TYR 68 -7.309 -0.090 -4.018 376 1HB TYR 68 1HB TYR 68 -6.586 -1.756 -1.578 377 2HB TYR 68 2HB TYR 68 -6.108 -2.099 -3.241 378 HD1 TYR 68 HD1 TYR 68 -4.681 -0.389 -4.514 379 HD2 TYR 68 HD2 TYR 68 -5.301 -0.208 -0.255 380 HE1 TYR 68 HE1 TYR 68 -2.650 1.015 -4.279 381 HE2 TYR 68 HE2 TYR 68 -3.218 1.125 -0.015 382 HH TYR 68 HH TYR 68 -1.417 2.405 -2.737 383 H ARG 69 H ARG 69 -8.190 -1.735 -5.240 384 HA ARG 69 HA ARG 69 -10.548 -3.190 -4.134 385 1HB ARG 69 1HB ARG 69 -11.034 -1.207 -5.684 386 2HB ARG 69 2HB ARG 69 -10.284 -2.156 -6.971 387 1HG ARG 69 1HG ARG 69 -11.971 -3.998 -6.474 388 2HG ARG 69 2HG ARG 69 -12.737 -2.861 -5.345 389 1HD ARG 69 1HD ARG 69 -12.829 -1.209 -7.364 390 2HD ARG 69 2HD ARG 69 -12.402 -2.601 -8.356 391 HE ARG 69 HE ARG 69 -14.438 -3.659 -7.932 392 1HH1 ARG 69 1HH1 ARG 69 -14.219 -0.672 -6.045 393 2HH1 ARG 69 2HH1 ARG 69 -15.704 -0.811 -5.365 394 1HH2 ARG 69 1HH2 ARG 69 -16.662 -3.700 -7.180 395 2HH2 ARG 69 2HH2 ARG 69 -17.316 -2.297 -6.381 396 H ALA 70 H ALA 70 -10.051 -5.299 -4.090 397 HA ALA 70 HA ALA 70 -8.210 -6.498 -6.109 398 1HB ALA 70 1HB ALA 70 -7.473 -7.973 -4.343 399 2HB ALA 70 2HB ALA 70 -7.150 -6.259 -3.968 400 3HB ALA 70 3HB ALA 70 -8.474 -7.096 -3.160 401 H LYS 71 H LYS 71 -9.510 -7.528 -7.486 402 HA LYS 71 HA LYS 71 -11.934 -8.931 -6.392 403 1HB LYS 71 1HB LYS 71 -13.029 -7.644 -7.706 404 2HB LYS 71 2HB LYS 71 -11.562 -6.968 -8.408 405 1HG LYS 71 1HG LYS 71 -11.486 -8.893 -9.977 406 2HG LYS 71 2HG LYS 71 -12.985 -9.491 -9.244 407 1HD LYS 71 1HD LYS 71 -14.207 -7.490 -10.015 408 2HD LYS 71 2HD LYS 71 -12.684 -6.667 -10.345 409 1HE LYS 71 1HE LYS 71 -12.296 -8.692 -12.044 410 2HE LYS 71 2HE LYS 71 -14.063 -8.778 -12.035 411 1HZ LYS 71 1HZ LYS 71 -14.074 -6.774 -13.221 412 2HZ LYS 71 2HZ LYS 71 -12.769 -6.175 -12.365 413 3HZ LYS 71 3HZ LYS 71 -12.458 -7.189 -13.505 414 H ASN 72 H ASN 72 -12.030 -11.063 -6.312 415 HA ASN 72 HA ASN 72 -9.706 -12.429 -7.266 416 1HB ASN 72 1HB ASN 72 -10.705 -12.973 -5.128 417 2HB ASN 72 2HB ASN 72 -12.205 -13.495 -5.921 418 1HD2 ASN 72 1HD2 ASN 72 -11.521 -15.507 -4.528 419 2HD2 ASN 72 2HD2 ASN 72 -10.400 -16.639 -5.270 420 H LEU 73 H LEU 73 -9.365 -13.053 -9.351 421 HA LEU 73 HA LEU 73 -11.683 -13.872 -10.998 422 1HB LEU 73 1HB LEU 73 -9.717 -12.118 -11.570 423 2HB LEU 73 2HB LEU 73 -8.885 -13.598 -12.036 424 HG LEU 73 HG LEU 73 -10.968 -14.114 -13.498 425 1HD1 LEU 73 1HD1 LEU 73 -12.261 -12.124 -14.206 426 2HD1 LEU 73 2HD1 LEU 73 -12.516 -12.433 -12.484 427 3HD1 LEU 73 3HD1 LEU 73 -11.424 -11.131 -12.995 428 1HD2 LEU 73 1HD2 LEU 73 -9.214 -11.701 -14.123 429 2HD2 LEU 73 2HD2 LEU 73 -8.796 -13.405 -14.410 430 3HD2 LEU 73 3HD2 LEU 73 -10.128 -12.657 -15.310 431 H ALA 74 H ALA 74 -9.981 -15.575 -8.852 432 HA ALA 74 HA ALA 74 -9.137 -17.815 -10.557 433 1HB ALA 74 1HB ALA 74 -9.526 -17.665 -7.552 434 2HB ALA 74 2HB ALA 74 -8.750 -18.979 -8.464 435 3HB ALA 74 3HB ALA 74 -7.993 -17.387 -8.398 436 H SER 75 H SER 75 -10.116 -19.979 -10.116 437 HA SER 75 HA SER 75 -13.110 -19.867 -9.798 438 1HB SER 75 1HB SER 75 -11.348 -21.864 -11.233 439 2HB SER 75 2HB SER 75 -13.091 -22.059 -10.951 440 HG SER 75 HG SER 75 -12.108 -19.683 -12.101 441 H THR 76 H THR 76 -10.498 -20.282 -7.880 442 HA THR 76 HA THR 76 -11.938 -21.943 -5.973 443 HB THR 76 HB THR 76 -9.494 -23.051 -5.671 444 HG1 THR 76 HG1 THR 76 -8.479 -23.305 -7.724 445 1HG2 THR 76 1HG2 THR 76 -11.290 -24.016 -7.936 446 2HG2 THR 76 2HG2 THR 76 -10.129 -24.977 -7.006 447 3HG2 THR 76 3HG2 THR 76 -11.579 -24.333 -6.211 448 HA PRO 77 HA PRO 77 -10.520 -18.820 -3.457 449 1HB PRO 77 1HB PRO 77 -9.956 -19.929 -0.984 450 2HB PRO 77 2HB PRO 77 -11.598 -19.785 -1.671 451 1HG PRO 77 1HG PRO 77 -9.755 -22.186 -1.780 452 2HG PRO 77 2HG PRO 77 -11.477 -22.148 -1.294 453 1HD PRO 77 1HD PRO 77 -10.761 -22.865 -3.795 454 2HD PRO 77 2HD PRO 77 -12.182 -21.814 -3.546 455 H THR 78 H THR 78 -8.615 -17.614 -3.539 456 HA THR 78 HA THR 78 -6.057 -18.932 -3.862 457 HB THR 78 HB THR 78 -6.186 -16.006 -3.416 458 HG1 THR 78 HG1 THR 78 -7.120 -16.528 -5.860 459 1HG2 THR 78 1HG2 THR 78 -5.295 -17.407 -5.939 460 2HG2 THR 78 2HG2 THR 78 -4.829 -15.826 -5.301 461 3HG2 THR 78 3HG2 THR 78 -4.234 -17.290 -4.522 462 H THR 79 H THR 79 -4.110 -17.856 -2.634 463 HA THR 79 HA THR 79 -4.745 -17.871 0.292 464 HB THR 79 HB THR 79 -2.898 -19.423 0.596 465 HG1 THR 79 HG1 THR 79 -1.683 -18.674 -1.205 466 1HG2 THR 79 1HG2 THR 79 -5.160 -20.389 -0.033 467 2HG2 THR 79 2HG2 THR 79 -4.584 -20.492 -1.716 468 3HG2 THR 79 3HG2 THR 79 -3.776 -21.428 -0.450 469 H GLY 80 H GLY 80 -4.581 -15.459 -0.041 470 1HA GLY 80 1HA GLY 80 -2.114 -14.307 -0.847 471 2HA GLY 80 2HA GLY 80 -3.401 -13.535 0.070 472 H GLN 81 H GLN 81 -0.512 -13.586 0.278 473 HA GLN 81 HA GLN 81 -0.259 -13.093 2.998 474 1HB GLN 81 1HB GLN 81 1.476 -14.842 3.672 475 2HB GLN 81 2HB GLN 81 -0.199 -15.351 3.593 476 1HG GLN 81 1HG GLN 81 1.041 -17.117 2.720 477 2HG GLN 81 2HG GLN 81 0.242 -16.404 1.331 478 1HE2 GLN 81 1HE2 GLN 81 1.666 -14.925 -0.064 479 2HE2 GLN 81 2HE2 GLN 81 3.372 -15.337 -0.149 480 H ALA 82 H ALA 82 0.216 -11.795 0.522 481 HA ALA 82 HA ALA 82 2.892 -12.230 -0.416 482 1HB ALA 82 1HB ALA 82 2.290 -10.197 -1.802 483 2HB ALA 82 2HB ALA 82 1.191 -11.608 -1.930 484 3HB ALA 82 3HB ALA 82 0.727 -10.186 -0.982 485 H THR 83 H THR 83 4.516 -10.526 -0.636 486 HA THR 83 HA THR 83 4.798 -9.115 1.922 487 HB THR 83 HB THR 83 6.628 -10.484 1.268 488 HG1 THR 83 HG1 THR 83 7.408 -7.776 1.121 489 1HG2 THR 83 1HG2 THR 83 7.139 -8.558 -1.042 490 2HG2 THR 83 2HG2 THR 83 8.146 -9.932 -0.559 491 3HG2 THR 83 3HG2 THR 83 6.535 -10.218 -1.242 492 H PHE 84 H PHE 84 4.645 -7.098 2.172 493 HA PHE 84 HA PHE 84 4.094 -5.162 -0.034 494 1HB PHE 84 1HB PHE 84 3.226 -3.847 2.045 495 2HB PHE 84 2HB PHE 84 2.225 -5.087 1.304 496 HD1 PHE 84 HD1 PHE 84 1.799 -7.262 2.411 497 HD2 PHE 84 HD2 PHE 84 4.235 -4.246 4.284 498 HE1 PHE 84 HE1 PHE 84 2.404 -8.848 4.173 499 HE2 PHE 84 HE2 PHE 84 5.040 -5.903 5.887 500 HZ PHE 84 HZ PHE 84 4.040 -8.199 5.937 501 H ASN 85 H ASN 85 6.320 -4.805 -0.591 502 HA ASN 85 HA ASN 85 8.246 -4.341 1.582 503 1HB ASN 85 1HB ASN 85 9.102 -5.389 -0.327 504 2HB ASN 85 2HB ASN 85 8.381 -4.197 -1.398 505 1HD2 ASN 85 1HD2 ASN 85 9.346 -2.059 -1.476 506 2HD2 ASN 85 2HD2 ASN 85 10.991 -1.747 -0.921 507 H VAL 86 H VAL 86 7.315 -2.733 2.733 508 HA VAL 86 HA VAL 86 6.390 -0.244 1.663 509 HB VAL 86 HB VAL 86 7.171 -0.798 4.560 510 1HG1 VAL 86 1HG1 VAL 86 5.359 0.774 5.029 511 2HG1 VAL 86 2HG1 VAL 86 6.533 1.514 3.930 512 3HG1 VAL 86 3HG1 VAL 86 4.992 0.903 3.294 513 1HG2 VAL 86 1HG2 VAL 86 5.846 -2.642 4.202 514 2HG2 VAL 86 2HG2 VAL 86 4.720 -1.452 4.829 515 3HG2 VAL 86 3HG2 VAL 86 4.732 -1.798 3.090 516 H THR 87 H THR 87 8.515 0.251 0.336 517 HA THR 87 HA THR 87 9.752 2.345 1.724 518 HB THR 87 HB THR 87 11.076 0.689 2.875 519 HG1 THR 87 HG1 THR 87 13.027 1.603 2.504 520 1HG2 THR 87 1HG2 THR 87 11.029 -1.074 1.228 521 2HG2 THR 87 2HG2 THR 87 12.171 -0.166 0.204 522 3HG2 THR 87 3HG2 THR 87 12.669 -0.734 1.808 523 HA PRO 88 HA PRO 88 11.079 3.284 -2.521 524 1HB PRO 88 1HB PRO 88 11.980 5.816 -2.110 525 2HB PRO 88 2HB PRO 88 10.247 5.498 -2.171 526 1HG PRO 88 1HG PRO 88 11.985 5.771 0.261 527 2HG PRO 88 2HG PRO 88 10.392 6.494 -0.035 528 1HD PRO 88 1HD PRO 88 10.874 4.158 1.405 529 2HD PRO 88 2HD PRO 88 9.305 4.469 0.595 530 H MET 89 H MET 89 12.488 1.476 -1.442 531 HA MET 89 HA MET 89 14.519 0.586 -0.886 532 1HB MET 89 1HB MET 89 16.196 1.196 -2.556 533 2HB MET 89 2HB MET 89 14.596 1.079 -3.281 534 1HG MET 89 1HG MET 89 14.334 3.434 -3.419 535 2HG MET 89 2HG MET 89 15.685 3.764 -2.348 536 1HE MET 89 1HE MET 89 18.091 1.998 -3.503 537 2HE MET 89 2HE MET 89 18.784 3.196 -4.613 538 3HE MET 89 3HE MET 89 18.182 3.709 -3.021 539 H ALA 90 H ALA 90 13.973 2.872 1.030 540 HA ALA 90 HA ALA 90 16.674 3.275 2.078 541 1HB ALA 90 1HB ALA 90 15.286 5.673 0.798 542 2HB ALA 90 2HB ALA 90 16.822 5.687 1.669 543 3HB ALA 90 3HB ALA 90 16.710 4.868 0.106 544 H ALA 91 H ALA 91 13.528 4.963 1.834 545 HA ALA 91 HA ALA 91 13.610 5.746 4.640 546 1HB ALA 91 1HB ALA 91 11.333 6.670 4.168 547 2HB ALA 91 2HB ALA 91 12.615 7.238 3.068 548 3HB ALA 91 3HB ALA 91 11.435 6.042 2.523 549 H GLY 92 H GLY 92 10.686 4.368 3.377 550 1HA GLY 92 1HA GLY 92 9.226 2.876 4.297 551 2HA GLY 92 2HA GLY 92 10.663 1.918 4.666 552 H ALA 93 H ALA 93 11.874 3.154 6.765 553 HA ALA 93 HA ALA 93 10.531 2.682 9.105 554 1HB ALA 93 1HB ALA 93 12.598 4.849 8.537 555 2HB ALA 93 2HB ALA 93 12.165 4.228 10.143 556 3HB ALA 93 3HB ALA 93 12.929 3.155 8.955 557 H TYR 94 H TYR 94 10.715 5.724 7.303 558 HA TYR 94 HA TYR 94 8.952 7.258 8.956 559 1HB TYR 94 1HB TYR 94 9.971 7.820 6.165 560 2HB TYR 94 2HB TYR 94 9.421 8.987 7.373 561 HD1 TYR 94 HD1 TYR 94 10.665 8.479 9.801 562 HD2 TYR 94 HD2 TYR 94 12.362 7.721 5.923 563 HE1 TYR 94 HE1 TYR 94 12.900 8.246 10.826 564 HE2 TYR 94 HE2 TYR 94 14.629 7.695 6.940 565 HH TYR 94 HH TYR 94 15.152 8.051 10.445 566 H PHE 95 H PHE 95 8.251 4.850 6.634 567 HA PHE 95 HA PHE 95 5.858 6.061 5.578 568 1HB PHE 95 1HB PHE 95 7.232 4.114 4.586 569 2HB PHE 95 2HB PHE 95 6.436 3.087 5.769 570 HD1 PHE 95 HD1 PHE 95 6.343 4.062 2.412 571 HD2 PHE 95 HD2 PHE 95 3.849 3.029 5.738 572 HE1 PHE 95 HE1 PHE 95 4.470 3.618 0.869 573 HE2 PHE 95 HE2 PHE 95 1.947 2.632 4.218 574 HZ PHE 95 HZ PHE 95 2.253 2.923 1.756 575 H ASN 96 H ASN 96 3.809 5.826 6.228 576 HA ASN 96 HA ASN 96 3.412 5.691 9.038 577 1HB ASN 96 1HB ASN 96 0.903 5.992 8.349 578 2HB ASN 96 2HB ASN 96 2.055 7.301 8.071 579 1HD2 ASN 96 1HD2 ASN 96 2.710 7.830 6.037 580 2HD2 ASN 96 2HD2 ASN 96 2.147 7.106 4.556 581 H LYS 97 H LYS 97 2.613 4.013 10.297 582 HA LYS 97 HA LYS 97 1.207 1.749 9.183 583 1HB LYS 97 1HB LYS 97 2.977 0.049 9.666 584 2HB LYS 97 2HB LYS 97 3.284 1.087 8.277 585 1HG LYS 97 1HG LYS 97 4.758 2.515 9.806 586 2HG LYS 97 2HG LYS 97 4.632 1.210 10.999 587 1HD LYS 97 1HD LYS 97 5.657 -0.375 9.516 588 2HD LYS 97 2HD LYS 97 5.602 0.730 8.139 589 1HE LYS 97 1HE LYS 97 7.143 1.328 10.706 590 2HE LYS 97 2HE LYS 97 7.880 0.511 9.322 591 1HZ LYS 97 1HZ LYS 97 8.086 3.060 9.503 592 2HZ LYS 97 2HZ LYS 97 7.749 2.424 8.037 593 3HZ LYS 97 3HZ LYS 97 6.566 3.111 8.928 594 H VAL 98 H VAL 98 3.328 2.782 11.873 595 HA VAL 98 HA VAL 98 3.284 2.369 14.048 596 HB VAL 98 HB VAL 98 1.999 4.220 14.118 597 1HG1 VAL 98 1HG1 VAL 98 -0.569 2.743 13.435 598 2HG1 VAL 98 2HG1 VAL 98 -0.424 4.421 13.951 599 3HG1 VAL 98 3HG1 VAL 98 0.302 3.920 12.428 600 1HG2 VAL 98 1HG2 VAL 98 2.035 2.850 16.220 601 2HG2 VAL 98 2HG2 VAL 98 0.750 4.066 16.108 602 3HG2 VAL 98 3HG2 VAL 98 0.361 2.363 15.849 603 H GLN 99 H GLN 99 -0.026 0.993 13.916 604 HA GLN 99 HA GLN 99 0.761 -1.677 13.680 605 1HB GLN 99 1HB GLN 99 0.226 -2.485 15.962 606 2HB GLN 99 2HB GLN 99 1.701 -1.526 15.942 607 1HG GLN 99 1HG GLN 99 0.637 0.347 16.983 608 2HG GLN 99 2HG GLN 99 -0.986 -0.280 16.664 609 1HE2 GLN 99 1HE2 GLN 99 1.941 -0.754 18.665 610 2HE2 GLN 99 2HE2 GLN 99 1.112 -1.713 19.881 611 H CYS 100 H CYS 100 -1.294 -3.041 14.504 612 HA CYS 100 HA CYS 100 -3.482 -3.505 14.146 613 1HB CYS 100 1HB CYS 100 -3.826 -0.770 15.460 614 2HB CYS 100 2HB CYS 100 -5.126 -1.937 15.170 615 HG CYS 100 HG CYS 100 -2.421 -2.304 17.004 616 H PHE 101 H PHE 101 -2.254 -2.733 11.833 617 HA PHE 101 HA PHE 101 -4.373 -1.241 10.347 618 1HB PHE 101 1HB PHE 101 -2.695 -0.940 8.594 619 2HB PHE 101 2HB PHE 101 -2.201 -0.192 10.103 620 HD1 PHE 101 HD1 PHE 101 -0.283 -1.016 11.366 621 HD2 PHE 101 HD2 PHE 101 -1.523 -2.976 7.733 622 HE1 PHE 101 HE1 PHE 101 1.862 -2.269 11.309 623 HE2 PHE 101 HE2 PHE 101 0.609 -4.236 7.687 624 HZ PHE 101 HZ PHE 101 2.303 -3.891 9.472 625 H CYS 102 H CYS 102 -4.810 -2.234 8.175 626 HA CYS 102 HA CYS 102 -4.383 -5.176 8.033 627 1HB CYS 102 1HB CYS 102 -7.032 -3.665 7.820 628 2HB CYS 102 2HB CYS 102 -6.772 -5.291 7.159 629 HG CYS 102 HG CYS 102 -8.098 -5.466 9.372 630 H PHE 103 H PHE 103 -4.016 -5.812 5.929 631 HA PHE 103 HA PHE 103 -4.821 -4.346 3.675 632 1HB PHE 103 1HB PHE 103 -2.917 -2.833 4.432 633 2HB PHE 103 2HB PHE 103 -1.818 -4.180 4.148 634 HD1 PHE 103 HD1 PHE 103 -4.508 -3.880 1.612 635 HD2 PHE 103 HD2 PHE 103 -0.635 -2.369 2.832 636 HE1 PHE 103 HE1 PHE 103 -4.178 -2.922 -0.606 637 HE2 PHE 103 HE2 PHE 103 -0.330 -1.405 0.569 638 HZ PHE 103 HZ PHE 103 -2.085 -1.699 -1.161 639 H THR 104 H THR 104 -2.404 -6.497 5.040 640 HA THR 104 HA THR 104 -1.713 -8.552 3.505 641 HB THR 104 HB THR 104 -2.517 -9.979 5.480 642 HG1 THR 104 HG1 THR 104 -4.291 -8.559 5.896 643 1HG2 THR 104 1HG2 THR 104 -0.271 -8.918 5.450 644 2HG2 THR 104 2HG2 THR 104 -0.949 -7.440 6.162 645 3HG2 THR 104 3HG2 THR 104 -0.971 -8.954 7.080 646 H GLU 105 H GLU 105 -2.726 -9.431 1.749 647 HA GLU 105 HA GLU 105 -5.474 -8.944 1.418 648 1HB GLU 105 1HB GLU 105 -5.139 -9.549 -0.806 649 2HB GLU 105 2HB GLU 105 -3.760 -8.592 -0.260 650 1HG GLU 105 1HG GLU 105 -3.808 -11.595 -0.734 651 2HG GLU 105 2HG GLU 105 -3.118 -10.385 -1.799 652 H THR 106 H THR 106 -3.953 -11.769 2.620 653 HA THR 106 HA THR 106 -4.789 -13.841 3.217 654 HB THR 106 HB THR 106 -5.809 -12.319 4.802 655 HG1 THR 106 HG1 THR 106 -6.195 -14.483 5.061 656 1HG2 THR 106 1HG2 THR 106 -7.284 -10.887 3.565 657 2HG2 THR 106 2HG2 THR 106 -8.238 -12.263 2.964 658 3HG2 THR 106 3HG2 THR 106 -8.255 -11.842 4.683 659 H THR 107 H THR 107 -7.699 -14.492 2.986 660 HA THR 107 HA THR 107 -7.467 -15.739 0.265 661 HB THR 107 HB THR 107 -8.198 -16.705 3.012 662 HG1 THR 107 HG1 THR 107 -6.779 -17.839 0.847 663 1HG2 THR 107 1HG2 THR 107 -9.129 -18.005 0.392 664 2HG2 THR 107 2HG2 THR 107 -9.100 -18.818 1.970 665 3HG2 THR 107 3HG2 THR 107 -10.176 -17.439 1.716 666 H LEU 108 H LEU 108 -9.166 -15.659 -1.069 667 HA LEU 108 HA LEU 108 -11.770 -14.547 -0.143 668 1HB LEU 108 1HB LEU 108 -10.355 -13.899 -2.764 669 2HB LEU 108 2HB LEU 108 -11.977 -13.398 -2.337 670 HG LEU 108 HG LEU 108 -9.494 -12.527 -0.832 671 1HD1 LEU 108 1HD1 LEU 108 -9.599 -11.752 -3.238 672 2HD1 LEU 108 2HD1 LEU 108 -11.121 -10.939 -2.855 673 3HD1 LEU 108 3HD1 LEU 108 -9.603 -10.457 -2.046 674 1HD2 LEU 108 1HD2 LEU 108 -10.942 -10.820 0.155 675 2HD2 LEU 108 2HD2 LEU 108 -12.345 -11.478 -0.721 676 3HD2 LEU 108 3HD2 LEU 108 -11.538 -12.431 0.544 677 H GLU 109 H GLU 109 -13.521 -15.499 -1.191 678 HA GLU 109 HA GLU 109 -13.038 -18.053 -2.460 679 1HB GLU 109 1HB GLU 109 -15.581 -16.490 -1.807 680 2HB GLU 109 2HB GLU 109 -15.582 -18.093 -2.504 681 1HG GLU 109 1HG GLU 109 -14.095 -18.842 -0.555 682 2HG GLU 109 2HG GLU 109 -14.457 -17.279 0.197 683 HA PRO 110 HA PRO 110 -12.687 -16.860 -6.613 684 1HB PRO 110 1HB PRO 110 -13.983 -18.793 -8.014 685 2HB PRO 110 2HB PRO 110 -12.517 -19.038 -7.025 686 1HG PRO 110 1HG PRO 110 -15.397 -19.515 -6.186 687 2HG PRO 110 2HG PRO 110 -14.053 -20.694 -6.113 688 1HD PRO 110 1HD PRO 110 -14.696 -19.189 -3.958 689 2HD PRO 110 2HD PRO 110 -12.982 -19.462 -4.357 690 H GLY 111 H GLY 111 -13.783 -14.871 -6.337 691 1HA GLY 111 1HA GLY 111 -15.492 -14.007 -8.265 692 2HA GLY 111 2HA GLY 111 -16.614 -14.634 -7.038 693 H GLU 112 H GLU 112 -14.620 -13.896 -4.808 694 HA GLU 112 HA GLU 112 -16.292 -11.704 -4.340 695 1HB GLU 112 1HB GLU 112 -14.019 -12.653 -2.587 696 2HB GLU 112 2HB GLU 112 -15.488 -11.800 -2.112 697 1HG GLU 112 1HG GLU 112 -15.315 -14.643 -3.021 698 2HG GLU 112 2HG GLU 112 -15.934 -13.970 -1.513 699 H GLU 113 H GLU 113 -15.953 -9.563 -3.918 700 HA GLU 113 HA GLU 113 -13.549 -8.372 -5.172 701 1HB GLU 113 1HB GLU 113 -15.721 -7.971 -6.270 702 2HB GLU 113 2HB GLU 113 -16.271 -7.104 -4.817 703 1HG GLU 113 1HG GLU 113 -14.968 -5.388 -5.102 704 2HG GLU 113 2HG GLU 113 -13.712 -6.251 -6.004 705 H MET 114 H MET 114 -12.098 -8.157 -3.585 706 HA MET 114 HA MET 114 -12.801 -7.270 -0.888 707 1HB MET 114 1HB MET 114 -11.275 -9.091 -1.341 708 2HB MET 114 2HB MET 114 -10.194 -8.058 -2.257 709 1HG MET 114 1HG MET 114 -9.361 -8.403 -0.013 710 2HG MET 114 2HG MET 114 -9.776 -6.699 -0.199 711 1HE MET 114 1HE MET 114 -9.604 -6.339 2.400 712 2HE MET 114 2HE MET 114 -10.410 -7.378 3.599 713 3HE MET 114 3HE MET 114 -9.118 -8.046 2.570 714 H GLU 115 H GLU 115 -13.567 -5.120 -1.308 715 HA GLU 115 HA GLU 115 -11.504 -3.171 -2.198 716 1HB GLU 115 1HB GLU 115 -13.732 -3.067 -3.265 717 2HB GLU 115 2HB GLU 115 -14.465 -2.694 -1.702 718 1HG GLU 115 1HG GLU 115 -13.454 -0.556 -1.601 719 2HG GLU 115 2HG GLU 115 -12.142 -1.013 -2.699 720 H MET 116 H MET 116 -10.520 -1.817 -0.744 721 HA MET 116 HA MET 116 -11.721 -1.453 1.897 722 1HB MET 116 1HB MET 116 -9.888 -2.241 3.193 723 2HB MET 116 2HB MET 116 -10.494 -3.553 2.167 724 1HG MET 116 1HG MET 116 -8.693 -2.931 0.503 725 2HG MET 116 2HG MET 116 -8.025 -1.852 1.733 726 1HE MET 116 1HE MET 116 -7.127 -2.749 4.133 727 2HE MET 116 2HE MET 116 -8.605 -3.718 4.384 728 3HE MET 116 3HE MET 116 -7.016 -4.482 4.532 729 HA PRO 117 HA PRO 117 -9.481 2.453 1.412 730 1HB PRO 117 1HB PRO 117 -9.915 3.642 3.737 731 2HB PRO 117 2HB PRO 117 -11.233 3.328 2.572 732 1HG PRO 117 1HG PRO 117 -10.504 1.668 4.998 733 2HG PRO 117 2HG PRO 117 -12.097 2.285 4.458 734 1HD PRO 117 1HD PRO 117 -11.182 -0.275 3.911 735 2HD PRO 117 2HD PRO 117 -12.318 0.611 2.848 736 H VAL 118 H VAL 118 -7.416 3.163 1.830 737 HA VAL 118 HA VAL 118 -6.020 2.238 4.285 738 HB VAL 118 HB VAL 118 -4.926 2.394 1.456 739 1HG1 VAL 118 1HG1 VAL 118 -3.333 3.629 2.795 740 2HG1 VAL 118 2HG1 VAL 118 -3.367 2.382 4.066 741 3HG1 VAL 118 3HG1 VAL 118 -2.682 2.025 2.465 742 1HG2 VAL 118 1HG2 VAL 118 -5.864 0.225 2.155 743 2HG2 VAL 118 2HG2 VAL 118 -4.101 0.121 2.023 744 3HG2 VAL 118 3HG2 VAL 118 -4.860 0.246 3.619 745 H VAL 119 H VAL 119 -5.898 3.950 5.539 746 HA VAL 119 HA VAL 119 -5.841 6.688 4.472 747 HB VAL 119 HB VAL 119 -7.186 6.258 6.435 748 1HG1 VAL 119 1HG1 VAL 119 -5.921 4.385 7.478 749 2HG1 VAL 119 2HG1 VAL 119 -4.614 5.514 7.898 750 3HG1 VAL 119 3HG1 VAL 119 -6.232 5.704 8.601 751 1HG2 VAL 119 1HG2 VAL 119 -4.752 7.945 7.149 752 2HG2 VAL 119 2HG2 VAL 119 -6.114 8.476 6.135 753 3HG2 VAL 119 3HG2 VAL 119 -6.378 8.069 7.840 754 H PHE 120 H PHE 120 -3.951 7.991 4.560 755 HA PHE 120 HA PHE 120 -1.369 6.691 5.159 756 1HB PHE 120 1HB PHE 120 -2.068 5.790 2.975 757 2HB PHE 120 2HB PHE 120 -2.464 7.405 2.407 758 HD1 PHE 120 HD1 PHE 120 -0.730 9.015 1.822 759 HD2 PHE 120 HD2 PHE 120 0.312 5.082 3.246 760 HE1 PHE 120 HE1 PHE 120 1.624 9.474 1.360 761 HE2 PHE 120 HE2 PHE 120 2.704 5.576 2.792 762 HZ PHE 120 HZ PHE 120 3.374 7.730 1.838 763 H PHE 121 H PHE 121 0.369 8.189 5.222 764 HA PHE 121 HA PHE 121 0.217 10.867 4.272 765 1HB PHE 121 1HB PHE 121 0.275 12.038 6.359 766 2HB PHE 121 2HB PHE 121 -1.256 11.234 6.130 767 HD1 PHE 121 HD1 PHE 121 1.459 11.711 8.349 768 HD2 PHE 121 HD2 PHE 121 -1.694 9.004 7.318 769 HE1 PHE 121 HE1 PHE 121 1.698 10.596 10.576 770 HE2 PHE 121 HE2 PHE 121 -1.234 7.667 9.368 771 HZ PHE 121 HZ PHE 121 0.420 8.502 11.035 772 H VAL 122 H VAL 122 2.371 11.258 3.719 773 HA VAL 122 HA VAL 122 4.537 9.730 4.843 774 HB VAL 122 HB VAL 122 4.579 12.355 3.323 775 1HG1 VAL 122 1HG1 VAL 122 6.791 10.326 3.881 776 2HG1 VAL 122 2HG1 VAL 122 6.921 11.662 2.722 777 3HG1 VAL 122 3HG1 VAL 122 6.733 12.011 4.441 778 1HG2 VAL 122 1HG2 VAL 122 3.506 10.670 1.972 779 2HG2 VAL 122 2HG2 VAL 122 5.152 10.858 1.370 780 3HG2 VAL 122 3HG2 VAL 122 4.754 9.469 2.388 781 H ASP 123 H ASP 123 5.831 10.154 6.599 782 HA ASP 123 HA ASP 123 4.984 12.297 8.392 783 1HB ASP 123 1HB ASP 123 5.035 10.179 9.252 784 2HB ASP 123 2HB ASP 123 6.649 9.817 8.679 785 HA PRO 124 HA PRO 124 8.331 15.033 7.106 786 1HB PRO 124 1HB PRO 124 8.354 15.711 10.045 787 2HB PRO 124 2HB PRO 124 8.378 16.822 8.645 788 1HG PRO 124 1HG PRO 124 6.079 16.371 10.033 789 2HG PRO 124 2HG PRO 124 6.019 16.452 8.260 790 1HD PRO 124 1HD PRO 124 5.977 14.027 10.004 791 2HD PRO 124 2HD PRO 124 5.080 14.401 8.506 792 H GLU 125 H GLU 125 8.754 12.809 9.878 793 HA GLU 125 HA GLU 125 11.409 13.118 10.473 794 1HB GLU 125 1HB GLU 125 9.644 11.787 11.596 795 2HB GLU 125 2HB GLU 125 9.815 10.522 10.366 796 1HG GLU 125 1HG GLU 125 12.272 10.451 11.148 797 2HG GLU 125 2HG GLU 125 11.759 11.586 12.406 798 H ILE 126 H ILE 126 10.064 11.683 7.455 799 HA ILE 126 HA ILE 126 12.381 10.384 6.641 800 HB ILE 126 HB ILE 126 10.264 10.407 5.430 801 1HG1 ILE 126 1HG1 ILE 126 12.487 11.287 3.543 802 2HG1 ILE 126 2HG1 ILE 126 12.639 9.822 4.523 803 1HG2 ILE 126 1HG2 ILE 126 9.840 12.904 5.494 804 2HG2 ILE 126 2HG2 ILE 126 11.099 13.101 4.264 805 3HG2 ILE 126 3HG2 ILE 126 9.641 12.169 3.897 806 1HD1 ILE 126 1HD1 ILE 126 11.760 9.185 2.409 807 2HD1 ILE 126 2HD1 ILE 126 10.521 8.976 3.672 808 3HD1 ILE 126 3HD1 ILE 126 10.418 10.356 2.553 809 H VAL 127 H VAL 127 11.895 13.926 6.676 810 HA VAL 127 HA VAL 127 14.667 14.249 5.614 811 HB VAL 127 HB VAL 127 14.218 16.683 5.825 812 1HG1 VAL 127 1HG1 VAL 127 12.389 15.087 3.991 813 2HG1 VAL 127 2HG1 VAL 127 12.859 16.783 3.777 814 3HG1 VAL 127 3HG1 VAL 127 14.084 15.510 3.683 815 1HG2 VAL 127 1HG2 VAL 127 12.001 17.549 6.009 816 2HG2 VAL 127 2HG2 VAL 127 11.281 15.937 6.055 817 3HG2 VAL 127 3HG2 VAL 127 12.245 16.528 7.433 818 H LYS 128 H LYS 128 14.969 12.762 7.626 819 HA LYS 128 HA LYS 128 16.208 14.620 9.615 820 1HB LYS 128 1HB LYS 128 14.970 11.926 10.171 821 2HB LYS 128 2HB LYS 128 16.378 12.501 11.096 822 1HG LYS 128 1HG LYS 128 15.094 14.635 11.544 823 2HG LYS 128 2HG LYS 128 13.695 13.865 10.763 824 1HD LYS 128 1HD LYS 128 13.947 11.945 12.400 825 2HD LYS 128 2HD LYS 128 15.212 12.831 13.237 826 1HE LYS 128 1HE LYS 128 12.350 13.850 12.840 827 2HE LYS 128 2HE LYS 128 12.902 12.995 14.286 828 1HZ LYS 128 1HZ LYS 128 12.911 15.405 14.494 829 2HZ LYS 128 2HZ LYS 128 14.391 14.759 14.766 830 3HZ LYS 128 3HZ LYS 128 14.069 15.527 13.337 831 HA PRO 129 HA PRO 129 19.855 12.032 8.729 832 1HB PRO 129 1HB PRO 129 19.914 9.535 7.626 833 2HB PRO 129 2HB PRO 129 19.441 9.826 9.323 834 1HG PRO 129 1HG PRO 129 17.639 9.541 6.926 835 2HG PRO 129 2HG PRO 129 17.517 8.648 8.460 836 1HD PRO 129 1HD PRO 129 15.995 10.852 8.038 837 2HD PRO 129 2HD PRO 129 16.722 10.530 9.636 838 H VAL 130 H VAL 130 21.412 11.864 6.950 839 HA VAL 130 HA VAL 130 20.716 13.677 4.943 840 HB VAL 130 HB VAL 130 22.998 13.298 4.201 841 1HG1 VAL 130 1HG1 VAL 130 22.490 14.854 6.048 842 2HG1 VAL 130 2HG1 VAL 130 22.781 13.557 7.224 843 3HG1 VAL 130 3HG1 VAL 130 24.103 14.142 6.201 844 1HG2 VAL 130 1HG2 VAL 130 24.555 11.847 5.405 845 2HG2 VAL 130 2HG2 VAL 130 23.234 11.154 6.351 846 3HG2 VAL 130 3HG2 VAL 130 23.315 10.891 4.598 847 H GLU 131 H GLU 131 21.019 10.118 4.882 848 HA GLU 131 HA GLU 131 20.925 9.709 2.084 849 1HB GLU 131 1HB GLU 131 19.853 7.937 4.310 850 2HB GLU 131 2HB GLU 131 20.259 7.490 2.643 851 1HG GLU 131 1HG GLU 131 22.261 6.979 3.509 852 2HG GLU 131 2HG GLU 131 22.620 8.686 3.391 853 H THR 132 H THR 132 18.227 9.457 4.484 854 HA THR 132 HA THR 132 16.411 9.272 2.280 855 HB THR 132 HB THR 132 14.645 9.028 3.897 856 HG1 THR 132 HG1 THR 132 15.237 10.473 5.524 857 1HG2 THR 132 1HG2 THR 132 17.151 7.538 4.810 858 2HG2 THR 132 2HG2 THR 132 15.478 7.013 4.999 859 3HG2 THR 132 3HG2 THR 132 16.177 7.123 3.383 860 H GLN 133 H GLN 133 17.695 11.998 4.005 861 HA GLN 133 HA GLN 133 15.914 14.026 3.396 862 1HB GLN 133 1HB GLN 133 18.708 13.889 3.903 863 2HB GLN 133 2HB GLN 133 18.607 14.572 2.311 864 1HG GLN 133 1HG GLN 133 18.577 16.435 3.669 865 2HG GLN 133 2HG GLN 133 16.881 16.240 3.232 866 1HE2 GLN 133 1HE2 GLN 133 17.719 13.821 5.616 867 2HE2 GLN 133 2HE2 GLN 133 17.443 14.806 7.020 868 H GLY 134 H GLY 134 17.909 12.116 1.103 869 1HA GLY 134 1HA GLY 134 17.329 13.669 -1.242 870 2HA GLY 134 2HA GLY 134 17.926 12.003 -1.173 871 H ILE 135 H ILE 135 15.492 11.207 0.524 872 HA ILE 135 HA ILE 135 13.794 10.510 -1.809 873 HB ILE 135 HB ILE 135 13.850 9.542 1.062 874 1HG1 ILE 135 1HG1 ILE 135 15.740 8.617 -0.051 875 2HG1 ILE 135 2HG1 ILE 135 14.465 7.394 -0.142 876 1HG2 ILE 135 1HG2 ILE 135 12.119 8.539 -1.246 877 2HG2 ILE 135 2HG2 ILE 135 12.236 7.907 0.410 878 3HG2 ILE 135 3HG2 ILE 135 11.530 9.482 0.130 879 1HD1 ILE 135 1HD1 ILE 135 15.419 9.231 -2.366 880 2HD1 ILE 135 2HD1 ILE 135 15.497 7.456 -2.283 881 3HD1 ILE 135 3HD1 ILE 135 13.930 8.276 -2.481 882 H LYS 136 H LYS 136 12.167 11.590 -2.339 883 HA LYS 136 HA LYS 136 10.188 11.813 -0.268 884 1HB LYS 136 1HB LYS 136 9.377 14.004 -1.044 885 2HB LYS 136 2HB LYS 136 10.733 13.982 0.090 886 1HG LYS 136 1HG LYS 136 12.298 14.606 -1.559 887 2HG LYS 136 2HG LYS 136 11.198 14.214 -2.898 888 1HD LYS 136 1HD LYS 136 9.561 15.875 -2.176 889 2HD LYS 136 2HD LYS 136 10.463 16.206 -0.693 890 1HE LYS 136 1HE LYS 136 12.208 17.365 -1.932 891 2HE LYS 136 2HE LYS 136 11.474 16.913 -3.483 892 1HZ LYS 136 1HZ LYS 136 9.568 18.269 -2.932 893 2HZ LYS 136 2HZ LYS 136 10.099 18.629 -1.462 894 3HZ LYS 136 3HZ LYS 136 10.912 19.192 -2.762 895 H THR 137 H THR 137 10.116 9.810 -1.816 896 HA THR 137 HA THR 137 7.632 10.395 -2.939 897 HB THR 137 HB THR 137 9.417 8.869 -4.877 898 HG1 THR 137 HG1 THR 137 8.942 11.609 -4.631 899 1HG2 THR 137 1HG2 THR 137 7.491 9.301 -6.379 900 2HG2 THR 137 2HG2 THR 137 7.090 8.303 -4.959 901 3HG2 THR 137 3HG2 THR 137 6.643 10.021 -4.982 902 H LEU 138 H LEU 138 6.832 9.158 -1.331 903 HA LEU 138 HA LEU 138 8.243 6.727 -0.545 904 1HB LEU 138 1HB LEU 138 6.554 8.563 0.718 905 2HB LEU 138 2HB LEU 138 5.523 7.135 0.530 906 HG LEU 138 HG LEU 138 7.522 5.881 1.499 907 1HD1 LEU 138 1HD1 LEU 138 9.134 6.933 2.844 908 2HD1 LEU 138 2HD1 LEU 138 9.199 7.759 1.271 909 3HD1 LEU 138 3HD1 LEU 138 8.384 8.539 2.628 910 1HD2 LEU 138 1HD2 LEU 138 6.221 7.932 3.398 911 2HD2 LEU 138 2HD2 LEU 138 5.423 6.447 2.889 912 3HD2 LEU 138 3HD2 LEU 138 6.928 6.381 3.824 913 H THR 139 H THR 139 7.553 4.533 -0.819 914 HA THR 139 HA THR 139 5.267 4.104 -2.528 915 HB THR 139 HB THR 139 7.159 4.339 -4.126 916 HG1 THR 139 HG1 THR 139 5.709 2.859 -4.799 917 1HG2 THR 139 1HG2 THR 139 8.355 1.953 -2.671 918 2HG2 THR 139 2HG2 THR 139 8.999 2.775 -4.109 919 3HG2 THR 139 3HG2 THR 139 8.911 3.643 -2.555 920 H LEU 140 H LEU 140 5.214 1.617 -2.829 921 HA LEU 140 HA LEU 140 6.021 0.029 -0.555 922 1HB LEU 140 1HB LEU 140 4.016 1.165 0.321 923 2HB LEU 140 2HB LEU 140 3.061 0.634 -1.067 924 HG LEU 140 HG LEU 140 4.389 -1.339 0.839 925 1HD1 LEU 140 1HD1 LEU 140 2.202 -1.416 2.041 926 2HD1 LEU 140 2HD1 LEU 140 2.987 0.160 2.188 927 3HD1 LEU 140 3HD1 LEU 140 1.636 -0.047 1.058 928 1HD2 LEU 140 1HD2 LEU 140 2.369 -2.739 0.105 929 2HD2 LEU 140 2HD2 LEU 140 2.076 -1.519 -1.141 930 3HD2 LEU 140 3HD2 LEU 140 3.585 -2.462 -1.132 931 H SER 141 H SER 141 6.822 -1.620 -1.874 932 HA SER 141 HA SER 141 5.520 -2.268 -4.438 933 1HB SER 141 1HB SER 141 7.710 -3.836 -4.306 934 2HB SER 141 2HB SER 141 7.658 -2.191 -4.951 935 HG SER 141 HG SER 141 9.329 -2.355 -3.487 936 H TYR 142 H TYR 142 3.675 -3.312 -3.917 937 HA TYR 142 HA TYR 142 3.703 -5.582 -2.067 938 1HB TYR 142 1HB TYR 142 1.848 -3.670 -2.497 939 2HB TYR 142 2HB TYR 142 1.249 -4.867 -3.632 940 HD1 TYR 142 HD1 TYR 142 -0.216 -3.780 -1.262 941 HD2 TYR 142 HD2 TYR 142 2.185 -7.330 -1.758 942 HE1 TYR 142 HE1 TYR 142 -1.514 -4.939 0.512 943 HE2 TYR 142 HE2 TYR 142 1.027 -8.362 0.160 944 HH TYR 142 HH TYR 142 -1.107 -8.329 1.160 945 H THR 143 H THR 143 4.469 -7.454 -2.879 946 HA THR 143 HA THR 143 4.057 -8.083 -5.784 947 HB THR 143 HB THR 143 5.894 -9.912 -4.839 948 HG1 THR 143 HG1 THR 143 6.412 -7.490 -3.439 949 1HG2 THR 143 1HG2 THR 143 6.191 -8.534 -6.816 950 2HG2 THR 143 2HG2 THR 143 6.541 -7.109 -5.803 951 3HG2 THR 143 3HG2 THR 143 7.648 -8.502 -5.803 952 H PHE 144 H PHE 144 1.987 -8.710 -5.703 953 HA PHE 144 HA PHE 144 1.096 -10.819 -3.954 954 1HB PHE 144 1HB PHE 144 0.050 -9.800 -6.587 955 2HB PHE 144 2HB PHE 144 -0.810 -10.789 -5.459 956 HD1 PHE 144 HD1 PHE 144 -0.752 -9.728 -2.883 957 HD2 PHE 144 HD2 PHE 144 -0.831 -7.612 -6.643 958 HE1 PHE 144 HE1 PHE 144 -1.698 -7.741 -1.769 959 HE2 PHE 144 HE2 PHE 144 -1.868 -5.683 -5.504 960 HZ PHE 144 HZ PHE 144 -2.005 -5.627 -3.025 961 H TYR 145 H TYR 145 2.846 -12.333 -4.214 962 HA TYR 145 HA TYR 145 2.501 -14.100 -6.605 963 1HB TYR 145 1HB TYR 145 4.756 -14.361 -6.890 964 2HB TYR 145 2HB TYR 145 4.530 -12.632 -6.670 965 HD1 TYR 145 HD1 TYR 145 4.424 -13.066 -3.385 966 HD2 TYR 145 HD2 TYR 145 7.129 -14.089 -6.597 967 HE1 TYR 145 HE1 TYR 145 6.297 -13.018 -1.818 968 HE2 TYR 145 HE2 TYR 145 9.010 -14.085 -4.985 969 HH TYR 145 HH TYR 145 8.557 -13.358 -1.517 970 HA PRO 146 HA PRO 146 2.496 -16.875 -2.829 971 1HB PRO 146 1HB PRO 146 -0.075 -17.271 -2.150 972 2HB PRO 146 2HB PRO 146 0.791 -15.802 -1.683 973 1HG PRO 146 1HG PRO 146 -1.038 -16.057 -4.086 974 2HG PRO 146 2HG PRO 146 -1.080 -14.852 -2.779 975 1HD PRO 146 1HD PRO 146 0.244 -14.381 -5.137 976 2HD PRO 146 2HD PRO 146 0.854 -13.787 -3.555 977 H ARG 147 H ARG 147 -0.621 -17.968 -3.961 978 HA ARG 147 HA ARG 147 0.590 -20.002 -5.733 979 1HB ARG 147 1HB ARG 147 -1.181 -20.674 -3.352 980 2HB ARG 147 2HB ARG 147 -0.412 -21.780 -4.492 981 1HG ARG 147 1HG ARG 147 1.850 -20.860 -3.634 982 2HG ARG 147 2HG ARG 147 0.920 -20.015 -2.384 983 1HD ARG 147 1HD ARG 147 1.733 -22.062 -1.444 984 2HD ARG 147 2HD ARG 147 -0.033 -22.188 -1.641 985 HE ARG 147 HE ARG 147 1.279 -23.207 -3.970 986 1HH1 ARG 147 1HH1 ARG 147 0.777 -24.042 -0.593 987 2HH1 ARG 147 2HH1 ARG 147 0.909 -25.760 -0.810 988 1HH2 ARG 147 1HH2 ARG 147 1.452 -25.489 -4.329 989 2HH2 ARG 147 2HH2 ARG 147 1.308 -26.598 -3.007 990 H GLU 148 H GLU 148 -0.642 -20.154 -7.464 991 HA GLU 148 HA GLU 148 -3.231 -18.814 -7.656 992 1HB GLU 148 1HB GLU 148 -1.204 -18.671 -9.199 993 2HB GLU 148 2HB GLU 148 -1.641 -20.281 -9.787 994 1HG GLU 148 1HG GLU 148 -3.262 -17.708 -9.996 995 2HG GLU 148 2HG GLU 148 -2.398 -18.524 -11.298 996 HA PRO 149 HA PRO 149 -4.723 -23.062 -6.824 997 1HB PRO 149 1HB PRO 149 -7.207 -22.587 -5.972 998 2HB PRO 149 2HB PRO 149 -5.826 -21.921 -5.066 999 1HG PRO 149 1HG PRO 149 -7.404 -20.481 -7.238 1000 2HG PRO 149 2HG PRO 149 -7.186 -19.942 -5.555 1001 1HD PRO 149 1HD PRO 149 -5.504 -19.083 -7.472 1002 2HD PRO 149 2HD PRO 149 -4.845 -19.596 -5.886 1003 H SER 150 H SER 150 -5.686 -21.031 -9.412 1004 HA SER 150 HA SER 150 -5.828 -22.273 -11.493 1005 1HB SER 150 1HB SER 150 -6.846 -24.337 -10.652 1006 2HB SER 150 2HB SER 150 -8.365 -23.456 -10.318 1007 HG SER 150 HG SER 150 -8.313 -24.573 -12.347 1008 H LYS 151 H LYS 151 -5.954 -20.223 -12.275 1009 HA LYS 151 HA LYS 151 -8.650 -18.918 -12.437 1010 1HB LYS 151 1HB LYS 151 -7.535 -16.968 -13.216 1011 2HB LYS 151 2HB LYS 151 -6.886 -17.512 -11.680 1012 1HG LYS 151 1HG LYS 151 -4.804 -17.567 -12.499 1013 2HG LYS 151 2HG LYS 151 -5.270 -18.720 -13.735 1014 1HD LYS 151 1HD LYS 151 -6.120 -16.795 -15.136 1015 2HD LYS 151 2HD LYS 151 -5.473 -15.681 -13.913 1016 1HE LYS 151 1HE LYS 151 -3.192 -16.599 -14.274 1017 2HE LYS 151 2HE LYS 151 -3.835 -17.794 -15.414 1018 1HZ LYS 151 1HZ LYS 151 -2.879 -15.938 -16.554 1019 2HZ LYS 151 2HZ LYS 151 -4.494 -16.007 -16.853 1020 3HZ LYS 151 3HZ LYS 151 -3.896 -14.878 -15.813 Start of MODEL 24 1 H VAL 21 H VAL 21 -1.872 10.566 14.625 2 HA VAL 21 HA VAL 21 -3.242 8.466 16.250 3 HB VAL 21 HB VAL 21 -2.535 10.475 17.309 4 1HG1 VAL 21 1HG1 VAL 21 -3.551 12.640 17.041 5 2HG1 VAL 21 2HG1 VAL 21 -2.883 12.154 15.480 6 3HG1 VAL 21 3HG1 VAL 21 -4.632 12.056 15.776 7 1HG2 VAL 21 1HG2 VAL 21 -4.547 10.924 18.599 8 2HG2 VAL 21 2HG2 VAL 21 -5.569 10.241 17.323 9 3HG2 VAL 21 3HG2 VAL 21 -4.436 9.199 18.208 10 H GLU 22 H GLU 22 -3.471 7.773 13.912 11 HA GLU 22 HA GLU 22 -3.954 8.142 11.780 12 1HB GLU 22 1HB GLU 22 -5.622 6.443 12.648 13 2HB GLU 22 2HB GLU 22 -6.862 7.704 12.504 14 1HG GLU 22 1HG GLU 22 -6.474 7.871 10.101 15 2HG GLU 22 2HG GLU 22 -4.985 6.926 10.209 16 H GLN 23 H GLN 23 -3.334 10.448 12.639 17 HA GLN 23 HA GLN 23 -4.460 12.232 10.805 18 1HB GLN 23 1HB GLN 23 -5.371 12.439 13.632 19 2HB GLN 23 2HB GLN 23 -4.471 13.833 13.154 20 1HG GLN 23 1HG GLN 23 -6.645 12.912 11.263 21 2HG GLN 23 2HG GLN 23 -7.038 13.825 12.728 22 1HE2 GLN 23 1HE2 GLN 23 -4.830 14.001 9.791 23 2HE2 GLN 23 2HE2 GLN 23 -4.395 15.650 10.156 24 H ALA 24 H ALA 24 -3.012 13.936 10.607 25 HA ALA 24 HA ALA 24 -0.792 14.176 12.551 26 1HB ALA 24 1HB ALA 24 0.670 14.801 10.743 27 2HB ALA 24 2HB ALA 24 -0.108 13.282 10.201 28 3HB ALA 24 3HB ALA 24 -0.693 14.850 9.614 29 H SER 25 H SER 25 -1.178 16.124 13.557 30 HA SER 25 HA SER 25 -2.132 18.437 12.016 31 1HB SER 25 1HB SER 25 -4.185 17.221 12.983 32 2HB SER 25 2HB SER 25 -3.604 17.726 14.584 33 HG SER 25 HG SER 25 -5.098 19.202 13.564 34 H ASP 26 H ASP 26 0.253 18.012 12.637 35 HA ASP 26 HA ASP 26 1.166 19.944 14.640 36 1HB ASP 26 1HB ASP 26 0.999 18.130 16.173 37 2HB ASP 26 2HB ASP 26 1.433 16.921 14.960 38 H LEU 27 H LEU 27 2.083 17.085 12.899 39 HA LEU 27 HA LEU 27 4.615 17.833 11.924 40 1HB LEU 27 1HB LEU 27 2.617 15.846 10.788 41 2HB LEU 27 2HB LEU 27 4.343 15.823 10.510 42 HG LEU 27 HG LEU 27 3.034 15.381 13.246 43 1HD1 LEU 27 1HD1 LEU 27 4.167 13.439 11.227 44 2HD1 LEU 27 2HD1 LEU 27 3.683 13.036 12.889 45 3HD1 LEU 27 3HD1 LEU 27 2.474 13.585 11.721 46 1HD2 LEU 27 1HD2 LEU 27 5.274 14.578 13.909 47 2HD2 LEU 27 2HD2 LEU 27 5.931 15.095 12.349 48 3HD2 LEU 27 3HD2 LEU 27 5.295 16.293 13.493 49 H ILE 28 H ILE 28 1.518 18.853 10.744 50 HA ILE 28 HA ILE 28 2.213 18.852 7.938 51 HB ILE 28 HB ILE 28 -0.127 20.104 9.430 52 1HG1 ILE 28 1HG1 ILE 28 0.564 17.383 8.273 53 2HG1 ILE 28 2HG1 ILE 28 -0.127 17.793 9.843 54 1HG2 ILE 28 1HG2 ILE 28 -1.247 20.156 7.328 55 2HG2 ILE 28 2HG2 ILE 28 0.293 20.971 7.037 56 3HG2 ILE 28 3HG2 ILE 28 0.077 19.276 6.535 57 1HD1 ILE 28 1HD1 ILE 28 -1.686 17.917 7.246 58 2HD1 ILE 28 2HD1 ILE 28 -1.811 16.692 8.500 59 3HD1 ILE 28 3HD1 ILE 28 -2.283 18.362 8.866 60 H LEU 29 H LEU 29 4.245 19.898 8.218 61 HA LEU 29 HA LEU 29 4.219 22.855 8.315 62 1HB LEU 29 1HB LEU 29 6.440 20.862 7.821 63 2HB LEU 29 2HB LEU 29 6.619 22.613 7.735 64 HG LEU 29 HG LEU 29 7.435 21.898 9.756 65 1HD1 LEU 29 1HD1 LEU 29 6.181 24.024 9.628 66 2HD1 LEU 29 2HD1 LEU 29 4.798 23.210 10.415 67 3HD1 LEU 29 3HD1 LEU 29 6.347 23.352 11.267 68 1HD2 LEU 29 1HD2 LEU 29 6.261 20.782 11.552 69 2HD2 LEU 29 2HD2 LEU 29 4.777 20.691 10.615 70 3HD2 LEU 29 3HD2 LEU 29 6.225 19.770 10.105 71 H ASP 30 H ASP 30 6.326 22.133 5.819 72 HA ASP 30 HA ASP 30 4.422 23.381 3.967 73 1HB ASP 30 1HB ASP 30 6.479 24.263 2.971 74 2HB ASP 30 2HB ASP 30 6.359 24.670 4.688 75 H GLU 31 H GLU 31 7.103 21.027 3.975 76 HA GLU 31 HA GLU 31 7.318 20.389 1.395 77 1HB GLU 31 1HB GLU 31 7.400 18.476 3.736 78 2HB GLU 31 2HB GLU 31 7.881 17.969 2.127 79 1HG GLU 31 1HG GLU 31 9.166 20.485 3.177 80 2HG GLU 31 2HG GLU 31 9.613 18.972 3.945 81 H LYS 32 H LYS 32 5.851 20.403 0.029 82 HA LYS 32 HA LYS 32 3.394 18.872 0.096 83 1HB LYS 32 1HB LYS 32 4.083 21.171 -0.957 84 2HB LYS 32 2HB LYS 32 4.766 20.256 -2.282 85 1HG LYS 32 1HG LYS 32 1.917 20.186 -1.233 86 2HG LYS 32 2HG LYS 32 2.456 21.184 -2.585 87 1HD LYS 32 1HD LYS 32 2.503 18.135 -2.503 88 2HD LYS 32 2HD LYS 32 1.218 19.105 -3.226 89 1HE LYS 32 1HE LYS 32 2.736 20.061 -4.875 90 2HE LYS 32 2HE LYS 32 4.129 19.220 -4.165 91 1HZ LYS 32 1HZ LYS 32 3.160 18.096 -6.117 92 2HZ LYS 32 2HZ LYS 32 3.184 17.158 -4.756 93 3HZ LYS 32 3HZ LYS 32 1.784 17.804 -5.243 94 H ILE 33 H ILE 33 4.300 16.758 0.523 95 HA ILE 33 HA ILE 33 6.504 15.855 -1.192 96 HB ILE 33 HB ILE 33 6.510 15.974 1.313 97 1HG1 ILE 33 1HG1 ILE 33 8.269 15.025 -0.010 98 2HG1 ILE 33 2HG1 ILE 33 8.041 14.211 1.528 99 1HG2 ILE 33 1HG2 ILE 33 5.932 13.922 2.507 100 2HG2 ILE 33 2HG2 ILE 33 4.524 14.847 2.010 101 3HG2 ILE 33 3HG2 ILE 33 4.964 13.367 1.137 102 1HD1 ILE 33 1HD1 ILE 33 6.681 12.416 0.180 103 2HD1 ILE 33 2HD1 ILE 33 7.450 13.165 -1.238 104 3HD1 ILE 33 3HD1 ILE 33 8.431 12.442 0.044 105 H LYS 34 H LYS 34 6.303 14.472 -2.785 106 HA LYS 34 HA LYS 34 3.689 13.522 -3.609 107 1HB LYS 34 1HB LYS 34 5.688 14.520 -4.947 108 2HB LYS 34 2HB LYS 34 6.377 12.903 -4.895 109 1HG LYS 34 1HG LYS 34 3.638 13.627 -6.054 110 2HG LYS 34 2HG LYS 34 5.172 13.614 -6.956 111 1HD LYS 34 1HD LYS 34 5.304 11.099 -6.060 112 2HD LYS 34 2HD LYS 34 3.557 11.297 -5.936 113 1HE LYS 34 1HE LYS 34 5.326 11.616 -8.406 114 2HE LYS 34 2HE LYS 34 4.153 10.331 -8.096 115 1HZ LYS 34 1HZ LYS 34 3.257 11.976 -9.591 116 2HZ LYS 34 2HZ LYS 34 2.384 11.987 -8.248 117 3HZ LYS 34 3HZ LYS 34 3.469 13.188 -8.500 118 H VAL 35 H VAL 35 3.134 11.173 -3.908 119 HA VAL 35 HA VAL 35 5.081 9.230 -2.819 120 HB VAL 35 HB VAL 35 2.376 9.868 -1.705 121 1HG1 VAL 35 1HG1 VAL 35 3.636 7.090 -1.564 122 2HG1 VAL 35 2HG1 VAL 35 2.194 7.633 -0.687 123 3HG1 VAL 35 3HG1 VAL 35 2.141 7.484 -2.436 124 1HG2 VAL 35 1HG2 VAL 35 4.382 10.593 -0.480 125 2HG2 VAL 35 2HG2 VAL 35 3.424 9.416 0.413 126 3HG2 VAL 35 3HG2 VAL 35 4.910 8.891 -0.408 127 H THR 36 H THR 36 4.834 7.244 -3.716 128 HA THR 36 HA THR 36 3.133 7.096 -6.191 129 HB THR 36 HB THR 36 6.076 6.422 -5.697 130 HG1 THR 36 HG1 THR 36 6.398 8.059 -7.239 131 1HG2 THR 36 1HG2 THR 36 5.124 4.778 -7.243 132 2HG2 THR 36 2HG2 THR 36 4.444 6.090 -8.241 133 3HG2 THR 36 3HG2 THR 36 6.210 5.895 -8.085 134 H PHE 37 H PHE 37 1.724 5.556 -5.896 135 HA PHE 37 HA PHE 37 2.204 3.322 -4.060 136 1HB PHE 37 1HB PHE 37 -0.029 4.057 -6.034 137 2HB PHE 37 2HB PHE 37 -0.002 2.602 -5.069 138 HD1 PHE 37 HD1 PHE 37 -0.089 2.710 -2.565 139 HD2 PHE 37 HD2 PHE 37 -0.441 6.236 -5.014 140 HE1 PHE 37 HE1 PHE 37 -0.278 4.091 -0.535 141 HE2 PHE 37 HE2 PHE 37 -0.436 7.615 -2.982 142 HZ PHE 37 HZ PHE 37 -0.328 6.601 -0.754 143 H ASP 38 H ASP 38 2.960 1.250 -4.837 144 HA ASP 38 HA ASP 38 3.053 0.905 -7.802 145 1HB ASP 38 1HB ASP 38 5.218 1.657 -6.832 146 2HB ASP 38 2HB ASP 38 5.247 0.235 -5.830 147 H ALA 39 H ALA 39 1.035 -0.074 -7.593 148 HA ALA 39 HA ALA 39 0.767 -2.526 -6.034 149 1HB ALA 39 1HB ALA 39 -0.982 -0.838 -6.228 150 2HB ALA 39 2HB ALA 39 -1.069 -1.084 -7.982 151 3HB ALA 39 3HB ALA 39 -1.542 -2.396 -6.889 152 H ASN 40 H ASN 40 2.142 -4.124 -6.957 153 HA ASN 40 HA ASN 40 1.902 -4.671 -9.862 154 1HB ASN 40 1HB ASN 40 3.763 -6.006 -7.916 155 2HB ASN 40 2HB ASN 40 3.807 -6.039 -9.671 156 1HD2 ASN 40 1HD2 ASN 40 4.258 -3.975 -6.796 157 2HD2 ASN 40 2HD2 ASN 40 5.223 -2.744 -7.631 158 H VAL 41 H VAL 41 0.290 -5.915 -10.348 159 HA VAL 41 HA VAL 41 -0.511 -8.260 -8.759 160 HB VAL 41 HB VAL 41 -2.197 -6.883 -9.973 161 1HG1 VAL 41 1HG1 VAL 41 -2.509 -7.109 -12.362 162 2HG1 VAL 41 2HG1 VAL 41 -0.911 -6.415 -12.051 163 3HG1 VAL 41 3HG1 VAL 41 -1.065 -8.124 -12.512 164 1HG2 VAL 41 1HG2 VAL 41 -2.650 -9.219 -9.281 165 2HG2 VAL 41 2HG2 VAL 41 -3.501 -8.781 -10.771 166 3HG2 VAL 41 3HG2 VAL 41 -2.055 -9.799 -10.850 167 H ALA 42 H ALA 42 -0.076 -10.438 -9.543 168 HA ALA 42 HA ALA 42 1.409 -10.793 -12.006 169 1HB ALA 42 1HB ALA 42 3.225 -12.083 -10.939 170 2HB ALA 42 2HB ALA 42 3.257 -10.370 -10.468 171 3HB ALA 42 3HB ALA 42 2.625 -11.596 -9.337 172 H ALA 43 H ALA 43 1.366 -13.131 -12.537 173 HA ALA 43 HA ALA 43 -1.066 -14.334 -12.234 174 1HB ALA 43 1HB ALA 43 0.620 -15.027 -13.888 175 2HB ALA 43 2HB ALA 43 1.611 -15.748 -12.598 176 3HB ALA 43 3HB ALA 43 0.013 -16.426 -12.980 177 H GLY 44 H GLY 44 1.720 -14.765 -10.139 178 1HA GLY 44 1HA GLY 44 1.123 -16.785 -8.404 179 2HA GLY 44 2HA GLY 44 1.880 -15.262 -7.919 180 H LEU 45 H LEU 45 -0.525 -13.563 -8.438 181 HA LEU 45 HA LEU 45 -2.543 -14.727 -6.608 182 1HB LEU 45 1HB LEU 45 -0.830 -12.709 -5.917 183 2HB LEU 45 2HB LEU 45 -2.205 -11.801 -6.562 184 HG LEU 45 HG LEU 45 -2.574 -13.985 -4.485 185 1HD1 LEU 45 1HD1 LEU 45 -2.529 -12.129 -2.813 186 2HD1 LEU 45 2HD1 LEU 45 -0.972 -12.159 -3.671 187 3HD1 LEU 45 3HD1 LEU 45 -2.182 -10.970 -4.091 188 1HD2 LEU 45 1HD2 LEU 45 -4.513 -13.158 -5.824 189 2HD2 LEU 45 2HD2 LEU 45 -4.556 -12.855 -4.075 190 3HD2 LEU 45 3HD2 LEU 45 -4.172 -11.516 -5.210 191 HA PRO 46 HA PRO 46 -4.195 -13.915 -10.659 192 1HB PRO 46 1HB PRO 46 -6.694 -15.150 -10.371 193 2HB PRO 46 2HB PRO 46 -5.134 -15.979 -10.711 194 1HG PRO 46 1HG PRO 46 -6.673 -15.691 -8.163 195 2HG PRO 46 2HG PRO 46 -5.704 -17.071 -8.733 196 1HD PRO 46 1HD PRO 46 -4.820 -15.219 -6.864 197 2HD PRO 46 2HD PRO 46 -3.732 -16.131 -7.936 198 H TRP 47 H TRP 47 -5.274 -12.207 -8.045 199 HA TRP 47 HA TRP 47 -7.957 -11.604 -8.713 200 1HB TRP 47 1HB TRP 47 -6.090 -10.459 -6.658 201 2HB TRP 47 2HB TRP 47 -7.839 -10.250 -6.695 202 HD1 TRP 47 HD1 TRP 47 -7.624 -13.663 -7.716 203 HE1 TRP 47 HE1 TRP 47 -7.867 -15.304 -5.836 204 HE3 TRP 47 HE3 TRP 47 -6.450 -10.554 -3.821 205 HZ2 TRP 47 HZ2 TRP 47 -7.690 -15.283 -2.901 206 HZ3 TRP 47 HZ3 TRP 47 -5.806 -11.683 -1.713 207 HH2 TRP 47 HH2 TRP 47 -6.705 -13.879 -1.114 208 H GLU 48 H GLU 48 -8.981 -9.570 -9.094 209 HA GLU 48 HA GLU 48 -7.559 -7.920 -11.089 210 1HB GLU 48 1HB GLU 48 -10.035 -8.509 -11.198 211 2HB GLU 48 2HB GLU 48 -10.264 -7.509 -9.759 212 1HG GLU 48 1HG GLU 48 -9.007 -5.734 -11.447 213 2HG GLU 48 2HG GLU 48 -9.882 -6.731 -12.609 214 H PHE 49 H PHE 49 -5.882 -7.432 -9.510 215 HA PHE 49 HA PHE 49 -6.431 -5.863 -7.164 216 1HB PHE 49 1HB PHE 49 -4.618 -7.464 -7.191 217 2HB PHE 49 2HB PHE 49 -3.866 -6.626 -8.542 218 HD1 PHE 49 HD1 PHE 49 -1.725 -6.201 -7.580 219 HD2 PHE 49 HD2 PHE 49 -5.277 -5.028 -5.416 220 HE1 PHE 49 HE1 PHE 49 -0.339 -4.995 -5.945 221 HE2 PHE 49 HE2 PHE 49 -3.877 -3.812 -3.799 222 HZ PHE 49 HZ PHE 49 -1.416 -3.727 -4.082 223 H VAL 50 H VAL 50 -7.002 -3.773 -7.282 224 HA VAL 50 HA VAL 50 -6.147 -2.155 -9.604 225 HB VAL 50 HB VAL 50 -8.574 -2.462 -7.965 226 1HG1 VAL 50 1HG1 VAL 50 -8.504 -0.122 -8.355 227 2HG1 VAL 50 2HG1 VAL 50 -8.009 -0.354 -10.054 228 3HG1 VAL 50 3HG1 VAL 50 -9.653 -0.793 -9.521 229 1HG2 VAL 50 1HG2 VAL 50 -8.561 -2.626 -10.975 230 2HG2 VAL 50 2HG2 VAL 50 -7.864 -3.978 -10.085 231 3HG2 VAL 50 3HG2 VAL 50 -9.531 -3.518 -9.775 232 HA PRO 51 HA PRO 51 -4.871 0.756 -6.245 233 1HB PRO 51 1HB PRO 51 -3.136 2.226 -7.733 234 2HB PRO 51 2HB PRO 51 -2.721 0.591 -7.161 235 1HG PRO 51 1HG PRO 51 -3.653 1.429 -9.898 236 2HG PRO 51 2HG PRO 51 -2.383 0.247 -9.487 237 1HD PRO 51 1HD PRO 51 -5.065 -0.303 -10.125 238 2HD PRO 51 2HD PRO 51 -4.050 -1.480 -9.248 239 H VAL 52 H VAL 52 -4.919 3.241 -6.425 240 HA VAL 52 HA VAL 52 -7.512 3.925 -7.647 241 HB VAL 52 HB VAL 52 -7.269 5.920 -6.005 242 1HG1 VAL 52 1HG1 VAL 52 -9.059 4.284 -5.954 243 2HG1 VAL 52 2HG1 VAL 52 -7.971 3.047 -5.295 244 3HG1 VAL 52 3HG1 VAL 52 -8.410 4.468 -4.317 245 1HG2 VAL 52 1HG2 VAL 52 -5.639 3.732 -4.673 246 2HG2 VAL 52 2HG2 VAL 52 -4.932 5.220 -5.328 247 3HG2 VAL 52 3HG2 VAL 52 -6.102 5.300 -3.986 248 H GLN 53 H GLN 53 -4.269 5.322 -7.212 249 HA GLN 53 HA GLN 53 -4.356 6.443 -9.900 250 1HB GLN 53 1HB GLN 53 -3.272 8.039 -7.573 251 2HB GLN 53 2HB GLN 53 -3.260 8.498 -9.248 252 1HG GLN 53 1HG GLN 53 -4.962 9.805 -8.354 253 2HG GLN 53 2HG GLN 53 -5.779 8.533 -9.273 254 1HE2 GLN 53 1HE2 GLN 53 -4.318 8.456 -5.955 255 2HE2 GLN 53 2HE2 GLN 53 -5.826 8.043 -5.169 256 H ARG 54 H ARG 54 -1.845 7.038 -10.306 257 HA ARG 54 HA ARG 54 -0.247 4.797 -9.367 258 1HB ARG 54 1HB ARG 54 0.029 5.976 -11.611 259 2HB ARG 54 2HB ARG 54 0.732 7.331 -10.732 260 1HG ARG 54 1HG ARG 54 2.470 5.857 -11.664 261 2HG ARG 54 2HG ARG 54 2.557 5.847 -9.900 262 1HD ARG 54 1HD ARG 54 1.643 3.707 -9.781 263 2HD ARG 54 2HD ARG 54 1.042 3.805 -11.429 264 HE ARG 54 HE ARG 54 3.169 3.383 -12.322 265 1HH1 ARG 54 1HH1 ARG 54 3.313 3.143 -8.705 266 2HH1 ARG 54 2HH1 ARG 54 4.608 1.961 -8.855 267 1HH2 ARG 54 1HH2 ARG 54 4.840 1.667 -12.219 268 2HH2 ARG 54 2HH2 ARG 54 5.292 1.135 -10.595 269 H ASP 55 H ASP 55 -0.710 8.258 -8.519 270 HA ASP 55 HA ASP 55 1.106 8.024 -6.236 271 1HB ASP 55 1HB ASP 55 1.912 10.198 -7.064 272 2HB ASP 55 2HB ASP 55 2.074 8.978 -8.336 273 H ILE 56 H ILE 56 1.043 10.084 -5.009 274 HA ILE 56 HA ILE 56 -1.413 11.637 -4.927 275 HB ILE 56 HB ILE 56 -1.654 11.601 -2.506 276 1HG1 ILE 56 1HG1 ILE 56 0.489 9.497 -2.695 277 2HG1 ILE 56 2HG1 ILE 56 0.551 11.068 -1.899 278 1HG2 ILE 56 1HG2 ILE 56 -1.959 8.859 -3.741 279 2HG2 ILE 56 2HG2 ILE 56 -2.792 9.493 -2.299 280 3HG2 ILE 56 3HG2 ILE 56 -3.089 10.212 -3.887 281 1HD1 ILE 56 1HD1 ILE 56 0.387 9.188 -0.281 282 2HD1 ILE 56 2HD1 ILE 56 -0.921 10.366 -0.138 283 3HD1 ILE 56 3HD1 ILE 56 -1.208 8.784 -0.908 284 H ASP 57 H ASP 57 -0.902 13.497 -3.227 285 HA ASP 57 HA ASP 57 1.799 13.421 -2.363 286 1HB ASP 57 1HB ASP 57 2.371 15.728 -2.672 287 2HB ASP 57 2HB ASP 57 2.017 15.018 -4.256 288 H VAL 58 H VAL 58 2.054 14.752 -0.460 289 HA VAL 58 HA VAL 58 -0.412 15.158 1.197 290 HB VAL 58 HB VAL 58 -0.146 13.171 2.025 291 1HG1 VAL 58 1HG1 VAL 58 1.361 12.230 0.367 292 2HG1 VAL 58 2HG1 VAL 58 2.749 13.017 1.150 293 3HG1 VAL 58 3HG1 VAL 58 1.856 11.736 1.984 294 1HG2 VAL 58 1HG2 VAL 58 0.721 14.709 3.818 295 2HG2 VAL 58 2HG2 VAL 58 1.235 13.036 3.970 296 3HG2 VAL 58 3HG2 VAL 58 2.371 14.232 3.341 297 H ARG 59 H ARG 59 -0.120 17.047 2.443 298 HA ARG 59 HA ARG 59 2.535 18.357 2.562 299 1HB ARG 59 1HB ARG 59 -0.242 19.156 3.235 300 2HB ARG 59 2HB ARG 59 0.904 19.494 4.523 301 1HG ARG 59 1HG ARG 59 0.952 21.428 3.302 302 2HG ARG 59 2HG ARG 59 2.441 20.574 2.939 303 1HD ARG 59 1HD ARG 59 1.914 21.082 0.829 304 2HD ARG 59 2HD ARG 59 0.907 19.626 0.880 305 HE ARG 59 HE ARG 59 0.114 22.497 1.023 306 1HH1 ARG 59 1HH1 ARG 59 -1.154 19.087 1.087 307 2HH1 ARG 59 2HH1 ARG 59 -2.739 19.572 1.040 308 1HH2 ARG 59 1HH2 ARG 59 -2.108 23.077 0.824 309 2HH2 ARG 59 2HH2 ARG 59 -3.309 21.823 0.708 310 H ILE 60 H ILE 60 3.760 16.739 3.404 311 HA ILE 60 HA ILE 60 4.106 14.869 4.924 312 HB ILE 60 HB ILE 60 5.623 16.127 6.626 313 1HG1 ILE 60 1HG1 ILE 60 5.179 18.339 4.576 314 2HG1 ILE 60 2HG1 ILE 60 4.335 18.302 6.117 315 1HG2 ILE 60 1HG2 ILE 60 7.345 16.290 4.874 316 2HG2 ILE 60 2HG2 ILE 60 6.378 14.833 4.688 317 3HG2 ILE 60 3HG2 ILE 60 6.083 16.230 3.629 318 1HD1 ILE 60 1HD1 ILE 60 6.371 18.573 7.340 319 2HD1 ILE 60 2HD1 ILE 60 7.379 18.231 5.917 320 3HD1 ILE 60 3HD1 ILE 60 6.436 19.715 5.970 321 H GLY 61 H GLY 61 1.862 14.414 5.563 322 1HA GLY 61 1HA GLY 61 1.347 13.571 7.938 323 2HA GLY 61 2HA GLY 61 1.190 15.275 8.335 324 H GLU 62 H GLU 62 0.028 16.054 5.813 325 HA GLU 62 HA GLU 62 -2.658 16.025 6.108 326 1HB GLU 62 1HB GLU 62 -1.243 17.167 4.384 327 2HB GLU 62 2HB GLU 62 -1.281 15.656 3.445 328 1HG GLU 62 1HG GLU 62 -3.706 15.858 3.171 329 2HG GLU 62 2HG GLU 62 -3.726 17.297 4.219 330 H THR 63 H THR 63 -3.844 14.337 6.725 331 HA THR 63 HA THR 63 -2.955 11.709 6.215 332 HB THR 63 HB THR 63 -5.460 12.485 7.739 333 HG1 THR 63 HG1 THR 63 -2.780 13.229 8.254 334 1HG2 THR 63 1HG2 THR 63 -3.176 10.900 8.852 335 2HG2 THR 63 2HG2 THR 63 -4.916 10.734 9.151 336 3HG2 THR 63 3HG2 THR 63 -4.236 10.103 7.648 337 H VAL 64 H VAL 64 -3.390 11.132 3.990 338 HA VAL 64 HA VAL 64 -6.115 11.728 3.006 339 HB VAL 64 HB VAL 64 -3.930 12.176 1.843 340 1HG1 VAL 64 1HG1 VAL 64 -3.131 10.544 0.221 341 2HG1 VAL 64 2HG1 VAL 64 -2.933 9.947 1.876 342 3HG1 VAL 64 3HG1 VAL 64 -4.239 9.320 0.845 343 1HG2 VAL 64 1HG2 VAL 64 -6.081 10.905 0.127 344 2HG2 VAL 64 2HG2 VAL 64 -6.174 12.544 0.823 345 3HG2 VAL 64 3HG2 VAL 64 -4.912 12.139 -0.349 346 H GLN 65 H GLN 65 -7.234 10.230 1.691 347 HA GLN 65 HA GLN 65 -6.983 7.394 2.491 348 1HB GLN 65 1HB GLN 65 -9.217 8.818 2.904 349 2HB GLN 65 2HB GLN 65 -9.438 8.558 1.172 350 1HG GLN 65 1HG GLN 65 -10.587 6.770 2.152 351 2HG GLN 65 2HG GLN 65 -9.045 6.009 1.745 352 1HE2 GLN 65 1HE2 GLN 65 -7.325 6.096 3.673 353 2HE2 GLN 65 2HE2 GLN 65 -8.013 5.977 5.274 354 H ILE 66 H ILE 66 -6.304 5.984 1.139 355 HA ILE 66 HA ILE 66 -6.964 6.364 -1.694 356 HB ILE 66 HB ILE 66 -4.650 5.232 -2.183 357 1HG1 ILE 66 1HG1 ILE 66 -2.828 6.382 -0.949 358 2HG1 ILE 66 2HG1 ILE 66 -3.942 6.868 0.317 359 1HG2 ILE 66 1HG2 ILE 66 -5.543 7.429 -3.025 360 2HG2 ILE 66 2HG2 ILE 66 -4.847 8.201 -1.584 361 3HG2 ILE 66 3HG2 ILE 66 -3.796 7.399 -2.776 362 1HD1 ILE 66 1HD1 ILE 66 -4.258 4.598 0.983 363 2HD1 ILE 66 2HD1 ILE 66 -3.491 3.955 -0.495 364 3HD1 ILE 66 3HD1 ILE 66 -2.518 4.783 0.735 365 H MET 67 H MET 67 -8.299 4.881 -2.071 366 HA MET 67 HA MET 67 -8.559 2.527 -0.425 367 1HB MET 67 1HB MET 67 -10.322 4.021 -1.828 368 2HB MET 67 2HB MET 67 -10.017 2.766 -3.031 369 1HG MET 67 1HG MET 67 -10.644 1.068 -1.194 370 2HG MET 67 2HG MET 67 -11.013 2.457 -0.165 371 1HE MET 67 1HE MET 67 -13.444 1.098 -3.841 372 2HE MET 67 2HE MET 67 -11.802 1.748 -4.044 373 3HE MET 67 3HE MET 67 -12.056 0.228 -3.145 374 H TYR 68 H TYR 68 -8.630 0.273 -1.222 375 HA TYR 68 HA TYR 68 -7.223 -0.256 -3.782 376 1HB TYR 68 1HB TYR 68 -6.492 -1.235 -1.010 377 2HB TYR 68 2HB TYR 68 -6.378 -2.361 -2.353 378 HD1 TYR 68 HD1 TYR 68 -4.598 0.242 -0.647 379 HD2 TYR 68 HD2 TYR 68 -5.146 -1.636 -4.485 380 HE1 TYR 68 HE1 TYR 68 -2.290 0.876 -1.287 381 HE2 TYR 68 HE2 TYR 68 -2.871 -0.986 -5.137 382 HH TYR 68 HH TYR 68 -0.602 0.538 -2.834 383 H ARG 69 H ARG 69 -7.897 -2.182 -4.793 384 HA ARG 69 HA ARG 69 -10.187 -3.614 -3.624 385 1HB ARG 69 1HB ARG 69 -11.023 -1.609 -4.883 386 2HB ARG 69 2HB ARG 69 -10.289 -2.283 -6.348 387 1HG ARG 69 1HG ARG 69 -11.704 -4.301 -6.092 388 2HG ARG 69 2HG ARG 69 -12.385 -3.667 -4.600 389 1HD ARG 69 1HD ARG 69 -13.969 -3.260 -6.412 390 2HD ARG 69 2HD ARG 69 -13.344 -1.740 -5.792 391 HE ARG 69 HE ARG 69 -12.542 -1.252 -7.863 392 1HH1 ARG 69 1HH1 ARG 69 -12.978 -4.785 -7.723 393 2HH1 ARG 69 2HH1 ARG 69 -12.103 -5.068 -9.230 394 1HH2 ARG 69 1HH2 ARG 69 -11.798 -1.623 -10.031 395 2HH2 ARG 69 2HH2 ARG 69 -11.637 -3.252 -10.622 396 H ALA 70 H ALA 70 -10.467 -5.719 -4.463 397 HA ALA 70 HA ALA 70 -8.759 -6.754 -6.582 398 1HB ALA 70 1HB ALA 70 -7.152 -6.757 -4.819 399 2HB ALA 70 2HB ALA 70 -8.274 -7.575 -3.727 400 3HB ALA 70 3HB ALA 70 -7.663 -8.419 -5.160 401 H LYS 71 H LYS 71 -10.293 -7.858 -7.744 402 HA LYS 71 HA LYS 71 -12.405 -9.444 -6.367 403 1HB LYS 71 1HB LYS 71 -11.695 -9.133 -9.311 404 2HB LYS 71 2HB LYS 71 -12.951 -10.204 -8.671 405 1HG LYS 71 1HG LYS 71 -14.022 -8.264 -7.658 406 2HG LYS 71 2HG LYS 71 -12.852 -7.218 -8.513 407 1HD LYS 71 1HD LYS 71 -13.656 -8.406 -10.659 408 2HD LYS 71 2HD LYS 71 -14.861 -9.254 -9.662 409 1HE LYS 71 1HE LYS 71 -15.793 -7.338 -10.955 410 2HE LYS 71 2HE LYS 71 -16.049 -7.201 -9.208 411 1HZ LYS 71 1HZ LYS 71 -15.170 -5.170 -10.445 412 2HZ LYS 71 2HZ LYS 71 -14.497 -5.624 -9.008 413 3HZ LYS 71 3HZ LYS 71 -13.698 -5.961 -10.416 414 H ASN 72 H ASN 72 -12.222 -11.703 -6.080 415 HA ASN 72 HA ASN 72 -9.794 -12.966 -7.105 416 1HB ASN 72 1HB ASN 72 -10.493 -13.750 -5.012 417 2HB ASN 72 2HB ASN 72 -12.122 -14.131 -5.613 418 1HD2 ASN 72 1HD2 ASN 72 -11.786 -16.367 -4.919 419 2HD2 ASN 72 2HD2 ASN 72 -10.821 -17.475 -5.903 420 H LEU 73 H LEU 73 -9.888 -12.618 -9.326 421 HA LEU 73 HA LEU 73 -11.922 -13.973 -10.963 422 1HB LEU 73 1HB LEU 73 -9.244 -12.671 -11.539 423 2HB LEU 73 2HB LEU 73 -10.065 -13.645 -12.757 424 HG LEU 73 HG LEU 73 -11.999 -12.256 -12.818 425 1HD1 LEU 73 1HD1 LEU 73 -12.007 -10.061 -11.581 426 2HD1 LEU 73 2HD1 LEU 73 -12.221 -11.479 -10.546 427 3HD1 LEU 73 3HD1 LEU 73 -10.633 -10.673 -10.624 428 1HD2 LEU 73 1HD2 LEU 73 -9.430 -10.610 -12.935 429 2HD2 LEU 73 2HD2 LEU 73 -10.044 -11.669 -14.225 430 3HD2 LEU 73 3HD2 LEU 73 -10.957 -10.225 -13.756 431 H ALA 74 H ALA 74 -11.607 -15.953 -9.432 432 HA ALA 74 HA ALA 74 -10.340 -17.885 -11.225 433 1HB ALA 74 1HB ALA 74 -9.089 -19.057 -9.481 434 2HB ALA 74 2HB ALA 74 -8.498 -17.386 -9.565 435 3HB ALA 74 3HB ALA 74 -9.595 -17.884 -8.259 436 H SER 75 H SER 75 -11.643 -19.721 -11.278 437 HA SER 75 HA SER 75 -14.113 -19.630 -9.704 438 1HB SER 75 1HB SER 75 -14.088 -20.235 -12.110 439 2HB SER 75 2HB SER 75 -13.185 -21.709 -11.719 440 HG SER 75 HG SER 75 -14.907 -22.254 -10.293 441 H THR 76 H THR 76 -11.801 -19.885 -8.056 442 HA THR 76 HA THR 76 -12.524 -22.171 -6.482 443 HB THR 76 HB THR 76 -9.923 -22.671 -6.226 444 HG1 THR 76 HG1 THR 76 -9.295 -20.917 -7.569 445 1HG2 THR 76 1HG2 THR 76 -11.513 -24.317 -7.200 446 2HG2 THR 76 2HG2 THR 76 -11.263 -23.590 -8.799 447 3HG2 THR 76 3HG2 THR 76 -9.911 -24.364 -7.961 448 HA PRO 77 HA PRO 77 -11.397 -19.061 -3.533 449 1HB PRO 77 1HB PRO 77 -10.537 -20.525 -1.351 450 2HB PRO 77 2HB PRO 77 -12.257 -20.421 -1.816 451 1HG PRO 77 1HG PRO 77 -10.297 -22.607 -2.544 452 2HG PRO 77 2HG PRO 77 -11.939 -22.789 -1.857 453 1HD PRO 77 1HD PRO 77 -11.481 -23.018 -4.518 454 2HD PRO 77 2HD PRO 77 -12.952 -22.198 -3.928 455 H THR 78 H THR 78 -9.387 -18.042 -2.937 456 HA THR 78 HA THR 78 -6.884 -19.469 -3.847 457 HB THR 78 HB THR 78 -6.470 -16.662 -4.113 458 HG1 THR 78 HG1 THR 78 -8.730 -16.460 -4.322 459 1HG2 THR 78 1HG2 THR 78 -6.896 -18.716 -6.284 460 2HG2 THR 78 2HG2 THR 78 -6.075 -17.139 -6.363 461 3HG2 THR 78 3HG2 THR 78 -5.358 -18.436 -5.403 462 H THR 79 H THR 79 -4.897 -18.074 -3.236 463 HA THR 79 HA THR 79 -4.851 -17.780 -0.278 464 HB THR 79 HB THR 79 -2.579 -18.456 -2.206 465 HG1 THR 79 HG1 THR 79 -4.211 -20.102 -2.008 466 1HG2 THR 79 1HG2 THR 79 -2.785 -18.558 0.841 467 2HG2 THR 79 2HG2 THR 79 -1.380 -19.091 -0.101 468 3HG2 THR 79 3HG2 THR 79 -1.842 -17.400 -0.123 469 H GLY 80 H GLY 80 -3.903 -15.799 0.427 470 1HA GLY 80 1HA GLY 80 -2.724 -13.974 -1.583 471 2HA GLY 80 2HA GLY 80 -3.934 -13.418 -0.412 472 H GLN 81 H GLN 81 -0.673 -13.481 -0.881 473 HA GLN 81 HA GLN 81 -0.264 -12.482 1.680 474 1HB GLN 81 1HB GLN 81 1.652 -14.173 2.367 475 2HB GLN 81 2HB GLN 81 -0.003 -14.286 2.881 476 1HG GLN 81 1HG GLN 81 0.579 -16.447 2.510 477 2HG GLN 81 2HG GLN 81 -0.467 -16.060 1.165 478 1HE2 GLN 81 1HE2 GLN 81 2.634 -14.689 0.606 479 2HE2 GLN 81 2HE2 GLN 81 3.345 -16.047 -0.242 480 H ALA 82 H ALA 82 -0.141 -11.267 -0.423 481 HA ALA 82 HA ALA 82 2.141 -11.245 -2.090 482 1HB ALA 82 1HB ALA 82 1.495 -8.894 -2.473 483 2HB ALA 82 2HB ALA 82 0.037 -9.922 -2.431 484 3HB ALA 82 3HB ALA 82 0.459 -8.916 -1.035 485 H THR 83 H THR 83 4.117 -10.044 -1.921 486 HA THR 83 HA THR 83 4.854 -9.271 0.871 487 HB THR 83 HB THR 83 6.455 -10.727 -0.350 488 HG1 THR 83 HG1 THR 83 7.194 -9.526 1.326 489 1HG2 THR 83 1HG2 THR 83 7.008 -8.213 -1.986 490 2HG2 THR 83 2HG2 THR 83 7.956 -9.707 -1.983 491 3HG2 THR 83 3HG2 THR 83 6.301 -9.736 -2.616 492 H PHE 84 H PHE 84 6.057 -7.164 0.957 493 HA PHE 84 HA PHE 84 4.829 -5.036 -0.704 494 1HB PHE 84 1HB PHE 84 4.089 -3.980 1.524 495 2HB PHE 84 2HB PHE 84 3.085 -5.213 0.785 496 HD1 PHE 84 HD1 PHE 84 2.791 -7.431 1.772 497 HD2 PHE 84 HD2 PHE 84 5.390 -4.528 3.620 498 HE1 PHE 84 HE1 PHE 84 3.433 -9.074 3.483 499 HE2 PHE 84 HE2 PHE 84 6.121 -6.177 5.219 500 HZ PHE 84 HZ PHE 84 5.083 -8.471 5.253 501 H ASN 85 H ASN 85 6.785 -4.354 -1.411 502 HA ASN 85 HA ASN 85 8.975 -3.867 0.544 503 1HB ASN 85 1HB ASN 85 9.989 -4.497 -1.337 504 2HB ASN 85 2HB ASN 85 8.640 -4.037 -2.340 505 1HD2 ASN 85 1HD2 ASN 85 11.440 -2.657 -0.479 506 2HD2 ASN 85 2HD2 ASN 85 11.613 -1.269 -1.552 507 H VAL 86 H VAL 86 7.791 -2.604 1.935 508 HA VAL 86 HA VAL 86 6.458 -0.149 1.203 509 HB VAL 86 HB VAL 86 7.377 -1.163 3.919 510 1HG1 VAL 86 1HG1 VAL 86 5.398 0.242 4.728 511 2HG1 VAL 86 2HG1 VAL 86 6.762 1.206 4.189 512 3HG1 VAL 86 3HG1 VAL 86 5.367 0.980 3.118 513 1HG2 VAL 86 1HG2 VAL 86 4.557 -1.272 2.839 514 2HG2 VAL 86 2HG2 VAL 86 5.678 -2.596 2.545 515 3HG2 VAL 86 3HG2 VAL 86 5.254 -2.143 4.205 516 H THR 87 H THR 87 8.676 0.401 -0.136 517 HA THR 87 HA THR 87 9.679 2.686 1.156 518 HB THR 87 HB THR 87 10.989 1.089 2.465 519 HG1 THR 87 HG1 THR 87 13.098 1.983 1.932 520 1HG2 THR 87 1HG2 THR 87 12.275 0.258 -0.122 521 2HG2 THR 87 2HG2 THR 87 12.758 -0.244 1.512 522 3HG2 THR 87 3HG2 THR 87 11.158 -0.696 0.893 523 HA PRO 88 HA PRO 88 11.091 3.405 -3.096 524 1HB PRO 88 1HB PRO 88 12.850 5.481 -2.594 525 2HB PRO 88 2HB PRO 88 11.095 5.690 -2.774 526 1HG PRO 88 1HG PRO 88 12.680 5.531 -0.228 527 2HG PRO 88 2HG PRO 88 11.312 6.607 -0.628 528 1HD PRO 88 1HD PRO 88 11.033 4.351 0.874 529 2HD PRO 88 2HD PRO 88 9.738 4.916 -0.204 530 H MET 89 H MET 89 13.082 3.167 -0.187 531 HA MET 89 HA MET 89 14.614 1.063 -0.706 532 1HB MET 89 1HB MET 89 16.877 1.950 -1.379 533 2HB MET 89 2HB MET 89 15.689 1.789 -2.642 534 1HG MET 89 1HG MET 89 15.281 4.401 -2.198 535 2HG MET 89 2HG MET 89 16.889 4.281 -1.470 536 1HE MET 89 1HE MET 89 14.834 4.115 -4.775 537 2HE MET 89 2HE MET 89 16.092 3.687 -5.956 538 3HE MET 89 3HE MET 89 15.521 2.471 -4.798 539 H ALA 90 H ALA 90 15.871 4.305 0.080 540 HA ALA 90 HA ALA 90 17.138 3.376 2.462 541 1HB ALA 90 1HB ALA 90 17.992 5.210 1.001 542 2HB ALA 90 2HB ALA 90 16.594 6.205 1.476 543 3HB ALA 90 3HB ALA 90 17.800 5.733 2.689 544 H ALA 91 H ALA 91 14.025 4.903 1.831 545 HA ALA 91 HA ALA 91 13.762 5.874 4.565 546 1HB ALA 91 1HB ALA 91 11.635 6.770 3.862 547 2HB ALA 91 2HB ALA 91 12.942 7.192 2.727 548 3HB ALA 91 3HB ALA 91 11.767 5.952 2.283 549 H GLY 92 H GLY 92 10.742 4.744 3.585 550 1HA GLY 92 1HA GLY 92 9.433 2.979 4.155 551 2HA GLY 92 2HA GLY 92 10.892 2.015 4.428 552 H ALA 93 H ALA 93 12.129 3.166 6.543 553 HA ALA 93 HA ALA 93 10.853 2.478 8.891 554 1HB ALA 93 1HB ALA 93 12.818 4.764 8.423 555 2HB ALA 93 2HB ALA 93 12.414 4.061 10.004 556 3HB ALA 93 3HB ALA 93 13.219 3.071 8.770 557 H TYR 94 H TYR 94 10.973 5.727 7.443 558 HA TYR 94 HA TYR 94 9.059 6.915 9.198 559 1HB TYR 94 1HB TYR 94 10.025 8.016 6.564 560 2HB TYR 94 2HB TYR 94 9.570 8.899 8.019 561 HD1 TYR 94 HD1 TYR 94 11.170 7.424 10.126 562 HD2 TYR 94 HD2 TYR 94 12.274 8.503 6.097 563 HE1 TYR 94 HE1 TYR 94 13.537 7.225 10.727 564 HE2 TYR 94 HE2 TYR 94 14.672 8.382 6.752 565 HH TYR 94 HH TYR 94 15.744 7.210 9.925 566 H PHE 95 H PHE 95 8.432 4.764 6.695 567 HA PHE 95 HA PHE 95 6.210 6.150 5.451 568 1HB PHE 95 1HB PHE 95 7.469 4.224 4.405 569 2HB PHE 95 2HB PHE 95 6.792 3.159 5.627 570 HD1 PHE 95 HD1 PHE 95 4.192 2.959 5.770 571 HD2 PHE 95 HD2 PHE 95 6.434 4.151 2.292 572 HE1 PHE 95 HE1 PHE 95 2.293 2.335 4.352 573 HE2 PHE 95 HE2 PHE 95 4.535 3.490 0.868 574 HZ PHE 95 HZ PHE 95 2.412 2.689 1.892 575 H ASN 96 H ASN 96 4.051 6.271 6.171 576 HA ASN 96 HA ASN 96 3.653 5.309 8.857 577 1HB ASN 96 1HB ASN 96 1.894 6.870 6.979 578 2HB ASN 96 2HB ASN 96 1.224 6.112 8.425 579 1HD2 ASN 96 1HD2 ASN 96 3.260 8.720 7.315 580 2HD2 ASN 96 2HD2 ASN 96 3.578 9.383 8.934 581 H LYS 97 H LYS 97 3.967 3.093 8.670 582 HA LYS 97 HA LYS 97 2.282 1.255 7.228 583 1HB LYS 97 1HB LYS 97 3.690 1.091 9.937 584 2HB LYS 97 2HB LYS 97 2.649 -0.182 9.330 585 1HG LYS 97 1HG LYS 97 4.834 -0.880 8.822 586 2HG LYS 97 2HG LYS 97 4.022 -0.459 7.318 587 1HD LYS 97 1HD LYS 97 6.263 0.311 7.144 588 2HD LYS 97 2HD LYS 97 5.244 1.729 7.327 589 1HE LYS 97 1HE LYS 97 5.871 1.637 9.859 590 2HE LYS 97 2HE LYS 97 7.080 0.428 9.399 591 1HZ LYS 97 1HZ LYS 97 6.859 3.196 8.431 592 2HZ LYS 97 2HZ LYS 97 8.017 2.711 9.428 593 3HZ LYS 97 3HZ LYS 97 8.003 2.189 7.873 594 H VAL 98 H VAL 98 0.069 1.050 7.388 595 HA VAL 98 HA VAL 98 -1.433 2.762 9.031 596 HB VAL 98 HB VAL 98 -2.339 0.155 7.731 597 1HG1 VAL 98 1HG1 VAL 98 -3.970 0.849 9.386 598 2HG1 VAL 98 2HG1 VAL 98 -3.864 2.543 8.871 599 3HG1 VAL 98 3HG1 VAL 98 -4.587 1.332 7.802 600 1HG2 VAL 98 1HG2 VAL 98 -3.196 1.689 5.965 601 2HG2 VAL 98 2HG2 VAL 98 -2.344 3.042 6.736 602 3HG2 VAL 98 3HG2 VAL 98 -1.427 1.690 6.041 603 H GLN 99 H GLN 99 -2.032 2.663 11.112 604 HA GLN 99 HA GLN 99 -0.798 0.631 12.760 605 1HB GLN 99 1HB GLN 99 -0.890 3.197 12.997 606 2HB GLN 99 2HB GLN 99 -2.514 2.979 13.650 607 1HG GLN 99 1HG GLN 99 -1.552 1.675 15.529 608 2HG GLN 99 2HG GLN 99 0.043 1.709 14.754 609 1HE2 GLN 99 1HE2 GLN 99 -2.538 4.046 15.737 610 2HE2 GLN 99 2HE2 GLN 99 -1.428 5.296 16.254 611 H CYS 100 H CYS 100 -2.627 -0.747 11.313 612 HA CYS 100 HA CYS 100 -4.542 -1.819 13.190 613 1HB CYS 100 1HB CYS 100 -5.842 0.179 12.525 614 2HB CYS 100 2HB CYS 100 -5.556 -0.192 10.808 615 HG CYS 100 HG CYS 100 -7.991 -0.796 11.372 616 H PHE 101 H PHE 101 -5.247 -3.873 12.424 617 HA PHE 101 HA PHE 101 -3.583 -5.003 10.317 618 1HB PHE 101 1HB PHE 101 -4.224 -6.101 12.536 619 2HB PHE 101 2HB PHE 101 -5.797 -6.423 11.821 620 HD1 PHE 101 HD1 PHE 101 -2.176 -7.185 11.765 621 HD2 PHE 101 HD2 PHE 101 -5.990 -8.086 9.951 622 HE1 PHE 101 HE1 PHE 101 -1.189 -9.169 10.657 623 HE2 PHE 101 HE2 PHE 101 -4.979 -10.035 8.809 624 HZ PHE 101 HZ PHE 101 -2.583 -10.587 9.163 625 H CYS 102 H CYS 102 -4.539 -3.439 8.741 626 HA CYS 102 HA CYS 102 -6.770 -4.759 7.232 627 1HB CYS 102 1HB CYS 102 -7.633 -2.545 6.615 628 2HB CYS 102 2HB CYS 102 -7.722 -2.810 8.365 629 HG CYS 102 HG CYS 102 -7.142 -0.311 7.739 630 H PHE 103 H PHE 103 -4.355 -5.596 6.648 631 HA PHE 103 HA PHE 103 -3.591 -4.302 4.123 632 1HB PHE 103 1HB PHE 103 -2.448 -3.029 5.955 633 2HB PHE 103 2HB PHE 103 -1.749 -4.532 6.542 634 HD1 PHE 103 HD1 PHE 103 -1.859 -2.189 3.618 635 HD2 PHE 103 HD2 PHE 103 0.328 -5.307 5.644 636 HE1 PHE 103 HE1 PHE 103 0.167 -1.636 2.295 637 HE2 PHE 103 HE2 PHE 103 2.348 -4.730 4.355 638 HZ PHE 103 HZ PHE 103 2.286 -2.879 2.690 639 H THR 104 H THR 104 -2.360 -5.728 2.830 640 HA THR 104 HA THR 104 -1.925 -7.694 1.881 641 HB THR 104 HB THR 104 -0.820 -8.373 4.618 642 HG1 THR 104 HG1 THR 104 1.021 -7.381 3.720 643 1HG2 THR 104 1HG2 THR 104 -0.108 -9.388 1.818 644 2HG2 THR 104 2HG2 THR 104 0.790 -9.747 3.305 645 3HG2 THR 104 3HG2 THR 104 -0.862 -10.351 3.109 646 H GLU 105 H GLU 105 -3.954 -8.299 1.328 647 HA GLU 105 HA GLU 105 -5.832 -9.703 2.829 648 1HB GLU 105 1HB GLU 105 -6.304 -8.676 0.687 649 2HB GLU 105 2HB GLU 105 -5.195 -9.774 -0.150 650 1HG GLU 105 1HG GLU 105 -7.586 -10.336 -0.476 651 2HG GLU 105 2HG GLU 105 -6.686 -11.657 0.275 652 H THR 106 H THR 106 -6.501 -11.907 2.648 653 HA THR 106 HA THR 106 -4.270 -13.793 3.131 654 HB THR 106 HB THR 106 -5.212 -13.090 5.172 655 HG1 THR 106 HG1 THR 106 -4.989 -15.345 4.924 656 1HG2 THR 106 1HG2 THR 106 -7.282 -11.982 4.507 657 2HG2 THR 106 2HG2 THR 106 -8.031 -13.505 4.046 658 3HG2 THR 106 3HG2 THR 106 -7.615 -13.203 5.733 659 H THR 107 H THR 107 -7.689 -13.619 2.128 660 HA THR 107 HA THR 107 -7.385 -15.785 0.288 661 HB THR 107 HB THR 107 -7.065 -17.122 2.269 662 HG1 THR 107 HG1 THR 107 -8.105 -18.018 0.431 663 1HG2 THR 107 1HG2 THR 107 -9.901 -16.312 2.940 664 2HG2 THR 107 2HG2 THR 107 -8.916 -17.517 3.806 665 3HG2 THR 107 3HG2 THR 107 -8.432 -15.803 3.806 666 H LEU 108 H LEU 108 -9.181 -15.986 -1.079 667 HA LEU 108 HA LEU 108 -11.710 -14.715 -0.279 668 1HB LEU 108 1HB LEU 108 -10.167 -14.017 -2.793 669 2HB LEU 108 2HB LEU 108 -11.872 -13.605 -2.561 670 HG LEU 108 HG LEU 108 -9.698 -12.677 -0.664 671 1HD1 LEU 108 1HD1 LEU 108 -9.321 -10.777 -1.797 672 2HD1 LEU 108 2HD1 LEU 108 -9.388 -11.948 -3.106 673 3HD1 LEU 108 3HD1 LEU 108 -10.792 -10.897 -2.826 674 1HD2 LEU 108 1HD2 LEU 108 -12.062 -12.549 0.184 675 2HD2 LEU 108 2HD2 LEU 108 -11.312 -10.969 -0.003 676 3HD2 LEU 108 3HD2 LEU 108 -12.477 -11.534 -1.221 677 H GLU 109 H GLU 109 -13.427 -15.683 -1.204 678 HA GLU 109 HA GLU 109 -12.978 -18.305 -2.306 679 1HB GLU 109 1HB GLU 109 -15.730 -17.209 -1.897 680 2HB GLU 109 2HB GLU 109 -15.027 -18.821 -1.593 681 1HG GLU 109 1HG GLU 109 -13.707 -17.862 0.309 682 2HG GLU 109 2HG GLU 109 -14.716 -16.400 0.181 683 HA PRO 110 HA PRO 110 -13.275 -17.815 -6.412 684 1HB PRO 110 1HB PRO 110 -15.295 -19.322 -7.566 685 2HB PRO 110 2HB PRO 110 -13.881 -19.955 -6.699 686 1HG PRO 110 1HG PRO 110 -16.600 -19.536 -5.540 687 2HG PRO 110 2HG PRO 110 -15.552 -20.996 -5.456 688 1HD PRO 110 1HD PRO 110 -15.648 -19.230 -3.484 689 2HD PRO 110 2HD PRO 110 -14.077 -19.949 -3.922 690 H GLY 111 H GLY 111 -13.728 -15.483 -6.187 691 1HA GLY 111 1HA GLY 111 -14.731 -14.385 -8.427 692 2HA GLY 111 2HA GLY 111 -16.207 -14.524 -7.490 693 H GLU 112 H GLU 112 -14.617 -14.105 -4.881 694 HA GLU 112 HA GLU 112 -16.272 -11.886 -5.028 695 1HB GLU 112 1HB GLU 112 -15.010 -12.620 -2.480 696 2HB GLU 112 2HB GLU 112 -16.627 -12.027 -2.849 697 1HG GLU 112 1HG GLU 112 -15.510 -14.735 -3.213 698 2HG GLU 112 2HG GLU 112 -16.908 -14.226 -2.281 699 H GLU 113 H GLU 113 -16.001 -9.760 -3.918 700 HA GLU 113 HA GLU 113 -13.499 -8.441 -4.707 701 1HB GLU 113 1HB GLU 113 -16.232 -7.487 -3.828 702 2HB GLU 113 2HB GLU 113 -14.842 -6.394 -3.832 703 1HG GLU 113 1HG GLU 113 -15.533 -7.970 -6.216 704 2HG GLU 113 2HG GLU 113 -16.386 -6.454 -5.844 705 H MET 114 H MET 114 -11.909 -8.155 -3.364 706 HA MET 114 HA MET 114 -12.285 -7.671 -0.468 707 1HB MET 114 1HB MET 114 -10.550 -9.163 -1.186 708 2HB MET 114 2HB MET 114 -9.897 -8.033 -2.352 709 1HG MET 114 1HG MET 114 -9.993 -7.676 0.686 710 2HG MET 114 2HG MET 114 -8.615 -8.223 -0.265 711 1HE MET 114 1HE MET 114 -7.399 -4.810 1.154 712 2HE MET 114 2HE MET 114 -8.283 -6.169 1.894 713 3HE MET 114 3HE MET 114 -6.904 -6.482 0.824 714 H GLU 115 H GLU 115 -12.551 -5.486 -0.003 715 HA GLU 115 HA GLU 115 -10.937 -3.637 -1.536 716 1HB GLU 115 1HB GLU 115 -12.510 -1.922 -1.853 717 2HB GLU 115 2HB GLU 115 -13.298 -3.385 -2.434 718 1HG GLU 115 1HG GLU 115 -14.993 -2.317 -1.258 719 2HG GLU 115 2HG GLU 115 -14.417 -3.503 -0.083 720 H MET 116 H MET 116 -10.092 -1.994 -0.229 721 HA MET 116 HA MET 116 -11.170 -1.665 2.414 722 1HB MET 116 1HB MET 116 -8.266 -2.589 2.116 723 2HB MET 116 2HB MET 116 -8.910 -1.788 3.556 724 1HG MET 116 1HG MET 116 -10.632 -3.594 3.741 725 2HG MET 116 2HG MET 116 -9.794 -4.466 2.453 726 1HE MET 116 1HE MET 116 -10.522 -5.670 5.301 727 2HE MET 116 2HE MET 116 -9.718 -6.590 4.006 728 3HE MET 116 3HE MET 116 -9.030 -6.578 5.646 729 HA PRO 117 HA PRO 117 -9.306 2.391 1.445 730 1HB PRO 117 1HB PRO 117 -9.653 3.649 3.790 731 2HB PRO 117 2HB PRO 117 -10.990 3.387 2.626 732 1HG PRO 117 1HG PRO 117 -10.336 1.800 5.113 733 2HG PRO 117 2HG PRO 117 -11.905 2.388 4.479 734 1HD PRO 117 1HD PRO 117 -10.928 -0.199 4.125 735 2HD PRO 117 2HD PRO 117 -12.094 0.576 3.008 736 H VAL 118 H VAL 118 -7.224 3.056 1.751 737 HA VAL 118 HA VAL 118 -5.729 2.131 4.153 738 HB VAL 118 HB VAL 118 -4.728 2.387 1.293 739 1HG1 VAL 118 1HG1 VAL 118 -2.458 2.094 2.125 740 2HG1 VAL 118 2HG1 VAL 118 -3.120 3.602 2.760 741 3HG1 VAL 118 3HG1 VAL 118 -3.026 2.172 3.800 742 1HG2 VAL 118 1HG2 VAL 118 -3.864 0.127 1.733 743 2HG2 VAL 118 2HG2 VAL 118 -4.574 0.165 3.360 744 3HG2 VAL 118 3HG2 VAL 118 -5.624 0.198 1.927 745 H VAL 119 H VAL 119 -4.608 3.766 5.159 746 HA VAL 119 HA VAL 119 -5.318 6.532 4.364 747 HB VAL 119 HB VAL 119 -6.210 5.865 6.544 748 1HG1 VAL 119 1HG1 VAL 119 -4.576 4.132 7.190 749 2HG1 VAL 119 2HG1 VAL 119 -3.320 5.376 7.400 750 3HG1 VAL 119 3HG1 VAL 119 -4.746 5.355 8.444 751 1HG2 VAL 119 1HG2 VAL 119 -5.346 7.710 7.861 752 2HG2 VAL 119 2HG2 VAL 119 -3.893 7.815 6.851 753 3HG2 VAL 119 3HG2 VAL 119 -5.491 8.205 6.170 754 H PHE 120 H PHE 120 -3.559 8.032 4.181 755 HA PHE 120 HA PHE 120 -0.831 6.898 4.555 756 1HB PHE 120 1HB PHE 120 -1.844 6.465 2.203 757 2HB PHE 120 2HB PHE 120 -1.582 8.175 1.916 758 HD1 PHE 120 HD1 PHE 120 -0.169 4.974 1.594 759 HD2 PHE 120 HD2 PHE 120 0.932 9.044 2.488 760 HE1 PHE 120 HE1 PHE 120 2.140 4.620 0.739 761 HE2 PHE 120 HE2 PHE 120 3.315 8.369 2.475 762 HZ PHE 120 HZ PHE 120 3.940 6.180 1.478 763 H PHE 121 H PHE 121 0.642 8.354 5.247 764 HA PHE 121 HA PHE 121 0.770 10.896 4.044 765 1HB PHE 121 1HB PHE 121 0.997 12.121 6.248 766 2HB PHE 121 2HB PHE 121 -0.639 11.730 5.746 767 HD1 PHE 121 HD1 PHE 121 -1.839 9.766 6.788 768 HD2 PHE 121 HD2 PHE 121 1.848 11.323 8.387 769 HE1 PHE 121 HE1 PHE 121 -2.103 8.336 8.804 770 HE2 PHE 121 HE2 PHE 121 1.473 10.071 10.468 771 HZ PHE 121 HZ PHE 121 -0.436 8.465 10.627 772 H VAL 122 H VAL 122 2.930 11.879 4.662 773 HA VAL 122 HA VAL 122 4.931 9.782 5.431 774 HB VAL 122 HB VAL 122 5.214 12.397 3.909 775 1HG1 VAL 122 1HG1 VAL 122 7.282 11.903 5.110 776 2HG1 VAL 122 2HG1 VAL 122 7.263 10.226 4.532 777 3HG1 VAL 122 3HG1 VAL 122 7.520 11.565 3.395 778 1HG2 VAL 122 1HG2 VAL 122 4.067 10.761 2.508 779 2HG2 VAL 122 2HG2 VAL 122 5.727 10.956 1.941 780 3HG2 VAL 122 3HG2 VAL 122 5.286 9.530 2.898 781 H ASP 123 H ASP 123 6.029 10.142 7.414 782 HA ASP 123 HA ASP 123 5.271 12.552 8.879 783 1HB ASP 123 1HB ASP 123 6.648 10.007 9.627 784 2HB ASP 123 2HB ASP 123 6.990 11.463 10.563 785 HA PRO 124 HA PRO 124 8.837 14.718 7.291 786 1HB PRO 124 1HB PRO 124 8.740 17.009 8.803 787 2HB PRO 124 2HB PRO 124 7.626 16.564 7.505 788 1HG PRO 124 1HG PRO 124 7.190 16.291 10.474 789 2HG PRO 124 2HG PRO 124 6.027 16.830 9.212 790 1HD PRO 124 1HD PRO 124 6.091 14.265 10.231 791 2HD PRO 124 2HD PRO 124 5.497 14.711 8.602 792 H GLU 125 H GLU 125 9.761 12.650 8.648 793 HA GLU 125 HA GLU 125 11.954 13.703 10.337 794 1HB GLU 125 1HB GLU 125 12.278 10.966 10.307 795 2HB GLU 125 2HB GLU 125 11.642 11.964 11.612 796 1HG GLU 125 1HG GLU 125 9.382 11.683 10.860 797 2HG GLU 125 2HG GLU 125 9.951 10.803 9.416 798 H ILE 126 H ILE 126 11.130 11.984 7.369 799 HA ILE 126 HA ILE 126 13.424 10.884 6.633 800 HB ILE 126 HB ILE 126 11.293 10.608 5.557 801 1HG1 ILE 126 1HG1 ILE 126 13.383 11.451 3.506 802 2HG1 ILE 126 2HG1 ILE 126 13.524 10.015 4.526 803 1HG2 ILE 126 1HG2 ILE 126 10.362 12.099 3.917 804 2HG2 ILE 126 2HG2 ILE 126 10.613 13.036 5.389 805 3HG2 ILE 126 3HG2 ILE 126 11.741 13.197 4.027 806 1HD1 ILE 126 1HD1 ILE 126 12.622 9.338 2.452 807 2HD1 ILE 126 2HD1 ILE 126 11.344 9.191 3.682 808 3HD1 ILE 126 3HD1 ILE 126 11.313 10.540 2.516 809 H VAL 127 H VAL 127 12.781 14.350 5.948 810 HA VAL 127 HA VAL 127 15.364 14.578 4.525 811 HB VAL 127 HB VAL 127 14.736 17.011 4.388 812 1HG1 VAL 127 1HG1 VAL 127 12.787 15.029 3.180 813 2HG1 VAL 127 2HG1 VAL 127 13.136 16.675 2.617 814 3HG1 VAL 127 3HG1 VAL 127 14.399 15.433 2.554 815 1HG2 VAL 127 1HG2 VAL 127 11.978 16.098 5.328 816 2HG2 VAL 127 2HG2 VAL 127 13.104 17.046 6.325 817 3HG2 VAL 127 3HG2 VAL 127 12.475 17.712 4.810 818 H LYS 128 H LYS 128 16.050 13.583 6.830 819 HA LYS 128 HA LYS 128 17.443 15.831 8.163 820 1HB LYS 128 1HB LYS 128 15.835 13.840 9.783 821 2HB LYS 128 2HB LYS 128 16.975 15.029 10.414 822 1HG LYS 128 1HG LYS 128 15.600 16.857 9.484 823 2HG LYS 128 2HG LYS 128 14.493 15.670 8.769 824 1HD LYS 128 1HD LYS 128 13.854 14.809 10.912 825 2HD LYS 128 2HD LYS 128 14.934 15.936 11.753 826 1HE LYS 128 1HE LYS 128 13.655 17.832 11.187 827 2HE LYS 128 2HE LYS 128 12.914 17.063 9.777 828 1HZ LYS 128 1HZ LYS 128 11.464 15.876 11.061 829 2HZ LYS 128 2HZ LYS 128 12.233 16.202 12.499 830 3HZ LYS 128 3HZ LYS 128 11.423 17.377 11.670 831 HA PRO 129 HA PRO 129 20.174 12.222 9.164 832 1HB PRO 129 1HB PRO 129 19.620 9.588 8.720 833 2HB PRO 129 2HB PRO 129 18.985 10.478 10.134 834 1HG PRO 129 1HG PRO 129 17.592 10.017 7.475 835 2HG PRO 129 2HG PRO 129 16.974 9.663 9.110 836 1HD PRO 129 1HD PRO 129 16.269 11.942 7.938 837 2HD PRO 129 2HD PRO 129 16.747 11.911 9.660 838 H VAL 130 H VAL 130 21.879 11.195 8.090 839 HA VAL 130 HA VAL 130 22.426 11.879 5.451 840 HB VAL 130 HB VAL 130 23.642 9.765 7.269 841 1HG1 VAL 130 1HG1 VAL 130 24.342 9.335 4.970 842 2HG1 VAL 130 2HG1 VAL 130 24.710 11.059 4.731 843 3HG1 VAL 130 3HG1 VAL 130 25.673 10.079 5.860 844 1HG2 VAL 130 1HG2 VAL 130 23.730 12.053 8.241 845 2HG2 VAL 130 2HG2 VAL 130 25.332 11.536 7.712 846 3HG2 VAL 130 3HG2 VAL 130 24.401 12.674 6.719 847 H GLU 131 H GLU 131 21.132 8.890 6.851 848 HA GLU 131 HA GLU 131 21.364 7.018 4.837 849 1HB GLU 131 1HB GLU 131 19.055 7.565 6.758 850 2HB GLU 131 2HB GLU 131 19.274 6.050 5.873 851 1HG GLU 131 1HG GLU 131 21.217 5.464 7.085 852 2HG GLU 131 2HG GLU 131 21.500 7.098 7.685 853 H THR 132 H THR 132 18.542 9.258 5.193 854 HA THR 132 HA THR 132 17.695 8.420 2.530 855 HB THR 132 HB THR 132 15.743 10.059 3.283 856 HG1 THR 132 HG1 THR 132 16.072 10.834 5.236 857 1HG2 THR 132 1HG2 THR 132 16.335 7.395 4.669 858 2HG2 THR 132 2HG2 THR 132 14.738 8.148 4.523 859 3HG2 THR 132 3HG2 THR 132 15.573 7.595 3.075 860 H GLN 133 H GLN 133 18.797 11.336 4.191 861 HA GLN 133 HA GLN 133 18.645 13.544 3.265 862 1HB GLN 133 1HB GLN 133 20.891 12.327 3.978 863 2HB GLN 133 2HB GLN 133 21.302 12.439 2.301 864 1HG GLN 133 1HG GLN 133 22.237 14.339 3.409 865 2HG GLN 133 2HG GLN 133 20.909 14.942 2.417 866 1HE2 GLN 133 1HE2 GLN 133 19.806 13.290 5.327 867 2HE2 GLN 133 2HE2 GLN 133 19.647 14.700 6.323 868 H GLY 134 H GLY 134 16.964 13.088 1.462 869 1HA GLY 134 1HA GLY 134 17.255 14.439 -0.833 870 2HA GLY 134 2HA GLY 134 18.160 12.973 -1.249 871 H ILE 135 H ILE 135 16.646 11.034 0.180 872 HA ILE 135 HA ILE 135 14.567 10.493 -1.678 873 HB ILE 135 HB ILE 135 14.848 9.459 1.166 874 1HG1 ILE 135 1HG1 ILE 135 16.801 8.740 -0.012 875 2HG1 ILE 135 2HG1 ILE 135 15.650 7.403 -0.102 876 1HG2 ILE 135 1HG2 ILE 135 12.529 9.128 0.288 877 2HG2 ILE 135 2HG2 ILE 135 13.174 8.368 -1.154 878 3HG2 ILE 135 3HG2 ILE 135 13.416 7.616 0.432 879 1HD1 ILE 135 1HD1 ILE 135 14.951 8.206 -2.358 880 2HD1 ILE 135 2HD1 ILE 135 16.279 9.388 -2.295 881 3HD1 ILE 135 3HD1 ILE 135 16.631 7.638 -2.242 882 H LYS 136 H LYS 136 12.790 11.519 -2.054 883 HA LYS 136 HA LYS 136 10.883 11.581 0.073 884 1HB LYS 136 1HB LYS 136 10.166 13.924 -0.299 885 2HB LYS 136 2HB LYS 136 11.517 13.591 0.773 886 1HG LYS 136 1HG LYS 136 13.132 14.270 -0.931 887 2HG LYS 136 2HG LYS 136 11.819 14.540 -2.101 888 1HD LYS 136 1HD LYS 136 10.676 16.055 -0.424 889 2HD LYS 136 2HD LYS 136 12.034 15.826 0.673 890 1HE LYS 136 1HE LYS 136 13.518 17.032 -0.917 891 2HE LYS 136 2HE LYS 136 12.164 17.202 -2.054 892 1HZ LYS 136 1HZ LYS 136 10.996 18.532 -0.330 893 2HZ LYS 136 2HZ LYS 136 12.170 18.367 0.692 894 3HZ LYS 136 3HZ LYS 136 12.451 19.207 -0.694 895 H THR 137 H THR 137 10.618 9.854 -1.695 896 HA THR 137 HA THR 137 8.075 10.727 -2.490 897 HB THR 137 HB THR 137 9.533 9.174 -4.683 898 HG1 THR 137 HG1 THR 137 9.394 11.922 -4.201 899 1HG2 THR 137 1HG2 THR 137 6.900 10.622 -4.546 900 2HG2 THR 137 2HG2 THR 137 7.575 9.837 -5.992 901 3HG2 THR 137 3HG2 THR 137 7.145 8.865 -4.566 902 H LEU 138 H LEU 138 7.165 9.376 -1.053 903 HA LEU 138 HA LEU 138 8.547 6.861 -0.450 904 1HB LEU 138 1HB LEU 138 6.884 8.645 0.990 905 2HB LEU 138 2HB LEU 138 5.957 7.143 0.836 906 HG LEU 138 HG LEU 138 8.023 5.977 1.640 907 1HD1 LEU 138 1HD1 LEU 138 8.971 8.780 2.354 908 2HD1 LEU 138 2HD1 LEU 138 9.687 7.254 2.914 909 3HD1 LEU 138 3HD1 LEU 138 9.762 7.682 1.202 910 1HD2 LEU 138 1HD2 LEU 138 6.128 6.498 3.206 911 2HD2 LEU 138 2HD2 LEU 138 7.716 6.561 4.006 912 3HD2 LEU 138 3HD2 LEU 138 6.885 8.052 3.579 913 H THR 139 H THR 139 7.562 4.745 -0.578 914 HA THR 139 HA THR 139 5.332 4.455 -2.305 915 HB THR 139 HB THR 139 7.001 4.937 -4.034 916 HG1 THR 139 HG1 THR 139 5.581 3.405 -4.696 917 1HG2 THR 139 1HG2 THR 139 8.908 3.478 -4.393 918 2HG2 THR 139 2HG2 THR 139 8.992 4.298 -2.809 919 3HG2 THR 139 3HG2 THR 139 8.512 2.573 -2.916 920 H LEU 140 H LEU 140 5.389 2.061 -3.021 921 HA LEU 140 HA LEU 140 5.817 0.204 -0.817 922 1HB LEU 140 1HB LEU 140 3.820 1.290 0.031 923 2HB LEU 140 2HB LEU 140 3.170 1.513 -1.591 924 HG LEU 140 HG LEU 140 2.739 -0.996 -1.710 925 1HD1 LEU 140 1HD1 LEU 140 4.337 -1.607 0.163 926 2HD1 LEU 140 2HD1 LEU 140 3.166 -0.838 1.271 927 3HD1 LEU 140 3HD1 LEU 140 2.691 -2.260 0.319 928 1HD2 LEU 140 1HD2 LEU 140 1.375 0.652 0.450 929 2HD2 LEU 140 2HD2 LEU 140 0.977 0.632 -1.280 930 3HD2 LEU 140 3HD2 LEU 140 0.728 -0.821 -0.297 931 H SER 141 H SER 141 6.860 -1.100 -2.435 932 HA SER 141 HA SER 141 5.424 -1.653 -4.978 933 1HB SER 141 1HB SER 141 7.959 -1.418 -4.829 934 2HB SER 141 2HB SER 141 7.920 -3.052 -4.134 935 HG SER 141 HG SER 141 6.867 -2.230 -6.648 936 H TYR 142 H TYR 142 3.547 -2.441 -4.287 937 HA TYR 142 HA TYR 142 3.404 -4.685 -2.401 938 1HB TYR 142 1HB TYR 142 1.613 -2.700 -3.217 939 2HB TYR 142 2HB TYR 142 1.029 -4.104 -4.091 940 HD1 TYR 142 HD1 TYR 142 -0.331 -2.435 -1.860 941 HD2 TYR 142 HD2 TYR 142 1.728 -6.226 -1.877 942 HE1 TYR 142 HE1 TYR 142 -1.408 -3.046 0.289 943 HE2 TYR 142 HE2 TYR 142 0.732 -6.776 0.314 944 HH TYR 142 HH TYR 142 -0.400 -5.859 2.188 945 H THR 143 H THR 143 3.650 -6.768 -3.110 946 HA THR 143 HA THR 143 3.786 -7.240 -6.054 947 HB THR 143 HB THR 143 5.864 -8.013 -3.994 948 HG1 THR 143 HG1 THR 143 5.891 -5.773 -4.267 949 1HG2 THR 143 1HG2 THR 143 5.995 -9.492 -5.860 950 2HG2 THR 143 2HG2 THR 143 5.652 -8.194 -7.032 951 3HG2 THR 143 3HG2 THR 143 7.211 -8.251 -6.179 952 H PHE 144 H PHE 144 2.013 -8.361 -6.247 953 HA PHE 144 HA PHE 144 1.013 -10.283 -4.384 954 1HB PHE 144 1HB PHE 144 0.354 -9.251 -7.122 955 2HB PHE 144 2HB PHE 144 -0.492 -10.616 -6.508 956 HD1 PHE 144 HD1 PHE 144 -2.698 -9.595 -6.500 957 HD2 PHE 144 HD2 PHE 144 0.525 -7.694 -4.339 958 HE1 PHE 144 HE1 PHE 144 -4.323 -8.555 -4.958 959 HE2 PHE 144 HE2 PHE 144 -1.117 -6.653 -2.827 960 HZ PHE 144 HZ PHE 144 -3.538 -7.107 -3.105 961 H TYR 145 H TYR 145 3.061 -11.555 -4.274 962 HA TYR 145 HA TYR 145 2.922 -13.867 -6.206 963 1HB TYR 145 1HB TYR 145 5.301 -12.459 -4.986 964 2HB TYR 145 2HB TYR 145 5.395 -14.089 -5.625 965 HD1 TYR 145 HD1 TYR 145 4.277 -10.682 -6.693 966 HD2 TYR 145 HD2 TYR 145 5.866 -14.491 -7.862 967 HE1 TYR 145 HE1 TYR 145 5.060 -9.690 -8.851 968 HE2 TYR 145 HE2 TYR 145 6.553 -13.547 -10.050 969 HH TYR 145 HH TYR 145 6.709 -11.640 -11.346 970 HA PRO 146 HA PRO 146 2.620 -16.061 -2.238 971 1HB PRO 146 1HB PRO 146 0.004 -16.668 -1.974 972 2HB PRO 146 2HB PRO 146 0.672 -15.081 -1.530 973 1HG PRO 146 1HG PRO 146 -0.773 -15.728 -4.109 974 2HG PRO 146 2HG PRO 146 -1.013 -14.386 -2.971 975 1HD PRO 146 1HD PRO 146 0.618 -14.212 -5.241 976 2HD PRO 146 2HD PRO 146 0.860 -13.247 -3.754 977 H ARG 147 H ARG 147 -0.079 -17.520 -3.868 978 HA ARG 147 HA ARG 147 1.482 -19.422 -5.422 979 1HB ARG 147 1HB ARG 147 0.234 -21.246 -3.850 980 2HB ARG 147 2HB ARG 147 1.919 -20.759 -3.674 981 1HG ARG 147 1HG ARG 147 1.523 -19.389 -1.838 982 2HG ARG 147 2HG ARG 147 -0.217 -19.269 -2.132 983 1HD ARG 147 1HD ARG 147 0.988 -21.979 -1.564 984 2HD ARG 147 2HD ARG 147 0.765 -20.818 -0.236 985 HE ARG 147 HE ARG 147 -1.676 -20.824 -1.607 986 1HH1 ARG 147 1HH1 ARG 147 0.212 -23.204 0.173 987 2HH1 ARG 147 2HH1 ARG 147 -1.149 -23.860 1.035 988 1HH2 ARG 147 1HH2 ARG 147 -3.391 -21.489 -0.427 989 2HH2 ARG 147 2HH2 ARG 147 -3.339 -22.901 0.614 990 H GLU 148 H GLU 148 0.256 -19.039 -7.130 991 HA GLU 148 HA GLU 148 -2.639 -19.685 -7.083 992 1HB GLU 148 1HB GLU 148 -2.021 -17.507 -7.974 993 2HB GLU 148 2HB GLU 148 -0.942 -18.231 -9.159 994 1HG GLU 148 1HG GLU 148 -3.890 -18.996 -9.146 995 2HG GLU 148 2HG GLU 148 -3.379 -17.419 -9.759 996 HA PRO 149 HA PRO 149 -0.874 -23.427 -8.985 997 1HB PRO 149 1HB PRO 149 -3.132 -24.893 -9.370 998 2HB PRO 149 2HB PRO 149 -2.456 -24.570 -7.750 999 1HG PRO 149 1HG PRO 149 -4.773 -23.170 -9.095 1000 2HG PRO 149 2HG PRO 149 -4.645 -23.735 -7.413 1001 1HD PRO 149 1HD PRO 149 -4.161 -21.120 -8.179 1002 2HD PRO 149 2HD PRO 149 -3.370 -21.891 -6.774 1003 H SER 150 H SER 150 -3.762 -21.956 -10.390 1004 HA SER 150 HA SER 150 -3.005 -21.090 -12.824 1005 1HB SER 150 1HB SER 150 -2.336 -23.378 -13.545 1006 2HB SER 150 2HB SER 150 -3.951 -23.979 -13.115 1007 HG SER 150 HG SER 150 -3.296 -22.012 -15.069 1008 H LYS 151 H LYS 151 -4.722 -19.622 -12.603 1009 HA LYS 151 HA LYS 151 -7.021 -20.260 -11.184 1010 1HB LYS 151 1HB LYS 151 -7.971 -18.100 -12.084 1011 2HB LYS 151 2HB LYS 151 -6.454 -18.028 -11.194 1012 1HG LYS 151 1HG LYS 151 -5.177 -17.544 -13.115 1013 2HG LYS 151 2HG LYS 151 -6.445 -18.041 -14.244 1014 1HD LYS 151 1HD LYS 151 -7.748 -16.137 -13.871 1015 2HD LYS 151 2HD LYS 151 -7.121 -15.954 -12.244 1016 1HE LYS 151 1HE LYS 151 -4.920 -15.173 -13.154 1017 2HE LYS 151 2HE LYS 151 -5.676 -15.125 -14.756 1018 1HZ LYS 151 1HZ LYS 151 -5.778 -12.986 -13.692 1019 2HZ LYS 151 2HZ LYS 151 -7.309 -13.574 -13.795 1020 3HZ LYS 151 3HZ LYS 151 -6.520 -13.562 -12.357 Start of MODEL 25 1 H VAL 21 H VAL 21 -1.874 11.753 15.568 2 HA VAL 21 HA VAL 21 -1.764 9.563 13.600 3 HB VAL 21 HB VAL 21 -3.517 9.712 16.066 4 1HG1 VAL 21 1HG1 VAL 21 -4.366 7.491 15.292 5 2HG1 VAL 21 2HG1 VAL 21 -4.794 8.794 14.186 6 3HG1 VAL 21 3HG1 VAL 21 -3.458 7.692 13.782 7 1HG2 VAL 21 1HG2 VAL 21 -1.265 8.886 16.640 8 2HG2 VAL 21 2HG2 VAL 21 -2.425 7.555 16.683 9 3HG2 VAL 21 3HG2 VAL 21 -1.332 7.728 15.294 10 H GLU 22 H GLU 22 -3.477 9.792 12.135 11 HA GLU 22 HA GLU 22 -4.991 10.770 10.920 12 1HB GLU 22 1HB GLU 22 -6.190 10.857 13.235 13 2HB GLU 22 2HB GLU 22 -6.025 12.599 13.070 14 1HG GLU 22 1HG GLU 22 -7.176 12.345 10.775 15 2HG GLU 22 2HG GLU 22 -7.295 10.613 11.094 16 H GLN 23 H GLN 23 -5.674 13.807 11.471 17 HA GLN 23 HA GLN 23 -3.912 14.635 9.350 18 1HB GLN 23 1HB GLN 23 -5.132 16.620 9.118 19 2HB GLN 23 2HB GLN 23 -6.275 15.312 9.332 20 1HG GLN 23 1HG GLN 23 -5.600 17.538 11.309 21 2HG GLN 23 2HG GLN 23 -7.100 17.258 10.447 22 1HE2 GLN 23 1HE2 GLN 23 -7.679 14.648 10.761 23 2HE2 GLN 23 2HE2 GLN 23 -7.827 14.187 12.438 24 H ALA 24 H ALA 24 -1.862 14.936 9.986 25 HA ALA 24 HA ALA 24 -1.440 15.449 12.783 26 1HB ALA 24 1HB ALA 24 -0.698 13.580 11.433 27 2HB ALA 24 2HB ALA 24 0.437 14.638 10.570 28 3HB ALA 24 3HB ALA 24 0.632 14.375 12.323 29 H SER 25 H SER 25 -2.234 17.746 12.201 30 HA SER 25 HA SER 25 -0.598 19.623 10.888 31 1HB SER 25 1HB SER 25 -2.419 21.196 11.847 32 2HB SER 25 2HB SER 25 -2.962 19.866 10.812 33 HG SER 25 HG SER 25 -2.979 19.847 13.646 34 H ASP 26 H ASP 26 0.088 18.415 13.810 35 HA ASP 26 HA ASP 26 1.252 20.885 14.946 36 1HB ASP 26 1HB ASP 26 0.385 18.945 16.323 37 2HB ASP 26 2HB ASP 26 1.677 17.955 15.623 38 H LEU 27 H LEU 27 1.878 18.361 12.617 39 HA LEU 27 HA LEU 27 4.798 18.900 12.499 40 1HB LEU 27 1HB LEU 27 3.133 16.549 11.551 41 2HB LEU 27 2HB LEU 27 4.879 16.648 11.524 42 HG LEU 27 HG LEU 27 3.386 16.850 14.150 43 1HD1 LEU 27 1HD1 LEU 27 4.406 14.339 12.764 44 2HD1 LEU 27 2HD1 LEU 27 3.650 14.481 14.373 45 3HD1 LEU 27 3HD1 LEU 27 2.699 14.801 12.932 46 1HD2 LEU 27 1HD2 LEU 27 5.526 16.025 15.053 47 2HD2 LEU 27 2HD2 LEU 27 6.217 15.968 13.418 48 3HD2 LEU 27 3HD2 LEU 27 5.780 17.530 14.150 49 H ILE 28 H ILE 28 1.855 18.913 10.585 50 HA ILE 28 HA ILE 28 2.548 18.442 8.071 51 HB ILE 28 HB ILE 28 0.695 20.575 9.182 52 1HG1 ILE 28 1HG1 ILE 28 0.423 17.897 7.777 53 2HG1 ILE 28 2HG1 ILE 28 0.247 18.200 9.457 54 1HG2 ILE 28 1HG2 ILE 28 1.115 21.538 7.014 55 2HG2 ILE 28 2HG2 ILE 28 1.108 19.926 6.269 56 3HG2 ILE 28 3HG2 ILE 28 -0.382 20.643 6.905 57 1HD1 ILE 28 1HD1 ILE 28 -1.729 19.765 8.873 58 2HD1 ILE 28 2HD1 ILE 28 -1.713 18.949 7.306 59 3HD1 ILE 28 3HD1 ILE 28 -1.970 18.006 8.776 60 H LEU 29 H LEU 29 2.630 21.853 8.922 61 HA LEU 29 HA LEU 29 3.744 23.614 8.239 62 1HB LEU 29 1HB LEU 29 6.085 22.229 7.064 63 2HB LEU 29 2HB LEU 29 5.984 23.670 8.076 64 HG LEU 29 HG LEU 29 5.929 20.774 8.832 65 1HD1 LEU 29 1HD1 LEU 29 7.875 21.302 10.160 66 2HD1 LEU 29 2HD1 LEU 29 8.092 21.787 8.468 67 3HD1 LEU 29 3HD1 LEU 29 7.741 23.020 9.708 68 1HD2 LEU 29 1HD2 LEU 29 4.255 21.676 10.422 69 2HD2 LEU 29 2HD2 LEU 29 5.782 21.543 11.255 70 3HD2 LEU 29 3HD2 LEU 29 5.256 23.132 10.631 71 H ASP 30 H ASP 30 4.583 24.858 6.365 72 HA ASP 30 HA ASP 30 3.073 24.427 4.042 73 1HB ASP 30 1HB ASP 30 5.399 26.333 4.474 74 2HB ASP 30 2HB ASP 30 4.045 26.511 3.345 75 H GLU 31 H GLU 31 4.220 22.132 3.893 76 HA GLU 31 HA GLU 31 5.994 22.217 1.506 77 1HB GLU 31 1HB GLU 31 6.747 21.154 4.151 78 2HB GLU 31 2HB GLU 31 6.557 19.847 2.985 79 1HG GLU 31 1HG GLU 31 8.348 22.218 2.475 80 2HG GLU 31 2HG GLU 31 8.858 20.776 3.350 81 H LYS 32 H LYS 32 5.899 20.000 0.428 82 HA LYS 32 HA LYS 32 3.544 18.490 1.027 83 1HB LYS 32 1HB LYS 32 2.845 20.493 -0.432 84 2HB LYS 32 2HB LYS 32 3.893 19.830 -1.716 85 1HG LYS 32 1HG LYS 32 2.741 17.692 -1.512 86 2HG LYS 32 2HG LYS 32 1.791 18.329 -0.167 87 1HD LYS 32 1HD LYS 32 0.254 18.487 -1.906 88 2HD LYS 32 2HD LYS 32 0.898 20.128 -1.832 89 1HE LYS 32 1HE LYS 32 2.344 19.725 -3.766 90 2HE LYS 32 2HE LYS 32 2.002 17.986 -3.716 91 1HZ LYS 32 1HZ LYS 32 -0.264 18.424 -4.218 92 2HZ LYS 32 2HZ LYS 32 -0.001 20.037 -4.359 93 3HZ LYS 32 3HZ LYS 32 0.706 18.980 -5.417 94 H ILE 33 H ILE 33 4.258 16.478 1.006 95 HA ILE 33 HA ILE 33 6.584 15.706 -0.730 96 HB ILE 33 HB ILE 33 7.029 15.207 1.450 97 1HG1 ILE 33 1HG1 ILE 33 6.064 12.549 0.292 98 2HG1 ILE 33 2HG1 ILE 33 7.275 13.518 -0.578 99 1HG2 ILE 33 1HG2 ILE 33 5.661 13.715 2.819 100 2HG2 ILE 33 2HG2 ILE 33 4.768 15.188 2.465 101 3HG2 ILE 33 3HG2 ILE 33 4.412 13.697 1.561 102 1HD1 ILE 33 1HD1 ILE 33 7.616 12.532 2.228 103 2HD1 ILE 33 2HD1 ILE 33 8.417 11.975 0.727 104 3HD1 ILE 33 3HD1 ILE 33 8.662 13.648 1.317 105 H LYS 34 H LYS 34 6.297 14.120 -2.214 106 HA LYS 34 HA LYS 34 3.553 13.425 -3.044 107 1HB LYS 34 1HB LYS 34 5.411 14.639 -4.439 108 2HB LYS 34 2HB LYS 34 6.133 13.040 -4.622 109 1HG LYS 34 1HG LYS 34 3.213 13.606 -5.239 110 2HG LYS 34 2HG LYS 34 4.509 14.064 -6.347 111 1HD LYS 34 1HD LYS 34 5.077 11.368 -5.782 112 2HD LYS 34 2HD LYS 34 3.309 11.426 -5.833 113 1HE LYS 34 1HE LYS 34 3.589 12.742 -8.074 114 2HE LYS 34 2HE LYS 34 5.331 12.424 -7.941 115 1HZ LYS 34 1HZ LYS 34 3.136 10.631 -8.532 116 2HZ LYS 34 2HZ LYS 34 4.518 10.814 -9.339 117 3HZ LYS 34 3HZ LYS 34 4.531 9.970 -7.912 118 H VAL 35 H VAL 35 3.108 11.111 -3.580 119 HA VAL 35 HA VAL 35 5.168 9.166 -2.722 120 HB VAL 35 HB VAL 35 2.312 9.234 -1.845 121 1HG1 VAL 35 1HG1 VAL 35 2.786 7.175 -0.550 122 2HG1 VAL 35 2HG1 VAL 35 2.950 6.904 -2.285 123 3HG1 VAL 35 3HG1 VAL 35 4.398 7.100 -1.273 124 1HG2 VAL 35 1HG2 VAL 35 3.492 9.112 0.484 125 2HG2 VAL 35 2HG2 VAL 35 4.914 9.688 -0.387 126 3HG2 VAL 35 3HG2 VAL 35 3.440 10.678 -0.354 127 H THR 36 H THR 36 5.014 7.306 -3.931 128 HA THR 36 HA THR 36 3.116 7.215 -6.227 129 HB THR 36 HB THR 36 6.198 7.140 -6.205 130 HG1 THR 36 HG1 THR 36 5.404 9.184 -6.062 131 1HG2 THR 36 1HG2 THR 36 4.297 6.764 -8.539 132 2HG2 THR 36 2HG2 THR 36 6.062 7.011 -8.662 133 3HG2 THR 36 3HG2 THR 36 5.435 5.576 -7.841 134 H PHE 37 H PHE 37 2.025 5.517 -5.490 135 HA PHE 37 HA PHE 37 3.394 3.371 -4.120 136 1HB PHE 37 1HB PHE 37 0.600 3.501 -5.334 137 2HB PHE 37 2HB PHE 37 1.199 2.378 -4.135 138 HD1 PHE 37 HD1 PHE 37 -0.864 5.126 -4.470 139 HD2 PHE 37 HD2 PHE 37 2.304 3.614 -1.947 140 HE1 PHE 37 HE1 PHE 37 -1.740 6.429 -2.577 141 HE2 PHE 37 HE2 PHE 37 1.455 5.010 -0.073 142 HZ PHE 37 HZ PHE 37 -0.565 6.407 -0.383 143 H ASP 38 H ASP 38 3.272 1.032 -5.004 144 HA ASP 38 HA ASP 38 3.090 0.874 -7.973 145 1HB ASP 38 1HB ASP 38 5.404 1.449 -7.447 146 2HB ASP 38 2HB ASP 38 5.499 0.195 -6.242 147 H ALA 39 H ALA 39 1.094 -0.162 -7.583 148 HA ALA 39 HA ALA 39 1.097 -2.695 -6.077 149 1HB ALA 39 1HB ALA 39 -0.806 -1.389 -5.739 150 2HB ALA 39 2HB ALA 39 -0.956 -0.966 -7.454 151 3HB ALA 39 3HB ALA 39 -1.349 -2.605 -6.921 152 H ASN 40 H ASN 40 2.199 -4.319 -7.165 153 HA ASN 40 HA ASN 40 1.726 -4.684 -10.081 154 1HB ASN 40 1HB ASN 40 3.603 -6.230 -8.254 155 2HB ASN 40 2HB ASN 40 3.544 -6.250 -10.012 156 1HD2 ASN 40 1HD2 ASN 40 4.379 -4.276 -7.173 157 2HD2 ASN 40 2HD2 ASN 40 5.340 -3.081 -8.054 158 H VAL 41 H VAL 41 1.449 -7.042 -10.739 159 HA VAL 41 HA VAL 41 0.166 -8.784 -8.762 160 HB VAL 41 HB VAL 41 -1.027 -8.201 -11.515 161 1HG1 VAL 41 1HG1 VAL 41 -2.813 -9.805 -10.777 162 2HG1 VAL 41 2HG1 VAL 41 -1.259 -10.592 -11.027 163 3HG1 VAL 41 3HG1 VAL 41 -1.817 -10.235 -9.376 164 1HG2 VAL 41 1HG2 VAL 41 -3.038 -7.542 -10.188 165 2HG2 VAL 41 2HG2 VAL 41 -2.082 -7.745 -8.700 166 3HG2 VAL 41 3HG2 VAL 41 -1.662 -6.478 -9.879 167 H ALA 42 H ALA 42 0.559 -11.027 -9.372 168 HA ALA 42 HA ALA 42 1.966 -11.553 -11.864 169 1HB ALA 42 1HB ALA 42 3.849 -11.305 -10.273 170 2HB ALA 42 2HB ALA 42 3.075 -12.481 -9.183 171 3HB ALA 42 3HB ALA 42 3.631 -12.994 -10.787 172 H ALA 43 H ALA 43 1.577 -13.773 -12.448 173 HA ALA 43 HA ALA 43 -0.974 -14.640 -12.061 174 1HB ALA 43 1HB ALA 43 1.441 -16.392 -12.698 175 2HB ALA 43 2HB ALA 43 -0.256 -16.800 -13.025 176 3HB ALA 43 3HB ALA 43 0.501 -15.436 -13.869 177 H GLY 44 H GLY 44 1.807 -15.502 -10.111 178 1HA GLY 44 1HA GLY 44 1.127 -17.521 -8.431 179 2HA GLY 44 2HA GLY 44 1.918 -16.034 -7.897 180 H LEU 45 H LEU 45 -0.241 -14.152 -8.231 181 HA LEU 45 HA LEU 45 -2.252 -15.170 -6.284 182 1HB LEU 45 1HB LEU 45 -0.490 -13.356 -5.673 183 2HB LEU 45 2HB LEU 45 -1.464 -12.306 -6.668 184 HG LEU 45 HG LEU 45 -2.666 -13.984 -4.396 185 1HD1 LEU 45 1HD1 LEU 45 -1.613 -11.147 -4.195 186 2HD1 LEU 45 2HD1 LEU 45 -2.485 -12.036 -2.945 187 3HD1 LEU 45 3HD1 LEU 45 -0.869 -12.542 -3.456 188 1HD2 LEU 45 1HD2 LEU 45 -3.538 -11.710 -6.209 189 2HD2 LEU 45 2HD2 LEU 45 -4.392 -13.188 -5.721 190 3HD2 LEU 45 3HD2 LEU 45 -4.169 -11.832 -4.578 191 HA PRO 46 HA PRO 46 -4.104 -14.594 -10.294 192 1HB PRO 46 1HB PRO 46 -6.466 -15.997 -9.991 193 2HB PRO 46 2HB PRO 46 -4.857 -16.771 -10.003 194 1HG PRO 46 1HG PRO 46 -6.492 -16.007 -7.606 195 2HG PRO 46 2HG PRO 46 -5.702 -17.570 -7.970 196 1HD PRO 46 1HD PRO 46 -4.505 -15.691 -6.384 197 2HD PRO 46 2HD PRO 46 -3.552 -16.697 -7.518 198 H TRP 47 H TRP 47 -4.653 -12.341 -8.250 199 HA TRP 47 HA TRP 47 -7.580 -11.895 -8.559 200 1HB TRP 47 1HB TRP 47 -5.635 -10.816 -6.535 201 2HB TRP 47 2HB TRP 47 -7.348 -10.458 -6.606 202 HD1 TRP 47 HD1 TRP 47 -7.532 -13.866 -7.491 203 HE1 TRP 47 HE1 TRP 47 -7.995 -15.386 -5.547 204 HE3 TRP 47 HE3 TRP 47 -6.072 -10.797 -3.630 205 HZ2 TRP 47 HZ2 TRP 47 -7.528 -15.464 -2.727 206 HZ3 TRP 47 HZ3 TRP 47 -5.466 -11.960 -1.514 207 HH2 TRP 47 HH2 TRP 47 -6.190 -14.174 -1.018 208 H GLU 48 H GLU 48 -8.513 -9.984 -9.047 209 HA GLU 48 HA GLU 48 -7.046 -8.230 -10.916 210 1HB GLU 48 1HB GLU 48 -9.347 -8.970 -11.373 211 2HB GLU 48 2HB GLU 48 -9.898 -8.213 -9.876 212 1HG GLU 48 1HG GLU 48 -9.392 -5.983 -10.781 213 2HG GLU 48 2HG GLU 48 -8.738 -6.721 -12.256 214 H PHE 49 H PHE 49 -5.482 -7.287 -9.550 215 HA PHE 49 HA PHE 49 -6.363 -5.830 -7.151 216 1HB PHE 49 1HB PHE 49 -4.283 -7.288 -7.149 217 2HB PHE 49 2HB PHE 49 -3.578 -6.090 -8.244 218 HD1 PHE 49 HD1 PHE 49 -5.653 -5.575 -5.115 219 HD2 PHE 49 HD2 PHE 49 -1.757 -5.302 -6.941 220 HE1 PHE 49 HE1 PHE 49 -4.821 -4.371 -3.147 221 HE2 PHE 49 HE2 PHE 49 -0.920 -4.133 -4.933 222 HZ PHE 49 HZ PHE 49 -2.457 -3.624 -3.044 223 H VAL 50 H VAL 50 -6.759 -3.718 -7.151 224 HA VAL 50 HA VAL 50 -6.391 -2.199 -9.659 225 HB VAL 50 HB VAL 50 -8.403 -2.247 -7.450 226 1HG1 VAL 50 1HG1 VAL 50 -9.722 -0.732 -8.898 227 2HG1 VAL 50 2HG1 VAL 50 -8.226 -0.004 -8.290 228 3HG1 VAL 50 3HG1 VAL 50 -8.301 -0.594 -9.974 229 1HG2 VAL 50 1HG2 VAL 50 -9.962 -3.073 -9.242 230 2HG2 VAL 50 2HG2 VAL 50 -8.584 -3.165 -10.357 231 3HG2 VAL 50 3HG2 VAL 50 -8.650 -4.206 -8.921 232 HA PRO 51 HA PRO 51 -4.098 0.546 -6.713 233 1HB PRO 51 1HB PRO 51 -3.220 1.945 -9.142 234 2HB PRO 51 2HB PRO 51 -2.211 1.086 -7.955 235 1HG PRO 51 1HG PRO 51 -2.682 0.213 -10.595 236 2HG PRO 51 2HG PRO 51 -2.175 -0.854 -9.260 237 1HD PRO 51 1HD PRO 51 -4.909 -0.432 -10.384 238 2HD PRO 51 2HD PRO 51 -4.202 -1.933 -9.702 239 H VAL 52 H VAL 52 -5.280 2.270 -5.999 240 HA VAL 52 HA VAL 52 -7.650 3.054 -7.427 241 HB VAL 52 HB VAL 52 -8.057 4.537 -5.491 242 1HG1 VAL 52 1HG1 VAL 52 -7.566 1.550 -5.029 243 2HG1 VAL 52 2HG1 VAL 52 -8.608 2.598 -4.048 244 3HG1 VAL 52 3HG1 VAL 52 -9.032 2.266 -5.733 245 1HG2 VAL 52 1HG2 VAL 52 -5.600 4.639 -4.919 246 2HG2 VAL 52 2HG2 VAL 52 -6.673 4.276 -3.551 247 3HG2 VAL 52 3HG2 VAL 52 -5.720 2.988 -4.338 248 H GLN 53 H GLN 53 -4.566 4.544 -6.745 249 HA GLN 53 HA GLN 53 -4.705 5.945 -9.210 250 1HB GLN 53 1HB GLN 53 -4.019 8.112 -8.484 251 2HB GLN 53 2HB GLN 53 -5.530 7.748 -7.668 252 1HG GLN 53 1HG GLN 53 -2.716 7.574 -6.460 253 2HG GLN 53 2HG GLN 53 -3.874 8.885 -6.220 254 1HE2 GLN 53 1HE2 GLN 53 -6.176 7.910 -5.574 255 2HE2 GLN 53 2HE2 GLN 53 -6.092 6.811 -4.207 256 H ARG 54 H ARG 54 -2.208 6.731 -9.530 257 HA ARG 54 HA ARG 54 -0.590 4.507 -8.515 258 1HB ARG 54 1HB ARG 54 -0.322 5.439 -10.856 259 2HB ARG 54 2HB ARG 54 0.335 6.907 -10.132 260 1HG ARG 54 1HG ARG 54 2.206 5.558 -10.757 261 2HG ARG 54 2HG ARG 54 2.107 5.431 -9.003 262 1HD ARG 54 1HD ARG 54 1.033 3.313 -9.179 263 2HD ARG 54 2HD ARG 54 0.995 3.435 -10.928 264 HE ARG 54 HE ARG 54 3.213 2.802 -9.068 265 1HH1 ARG 54 1HH1 ARG 54 2.572 3.954 -12.307 266 2HH1 ARG 54 2HH1 ARG 54 3.856 3.084 -13.097 267 1HH2 ARG 54 1HH2 ARG 54 4.777 1.266 -10.193 268 2HH2 ARG 54 2HH2 ARG 54 5.252 1.683 -11.787 269 H ASP 55 H ASP 55 -0.686 8.124 -8.194 270 HA ASP 55 HA ASP 55 1.022 7.986 -5.836 271 1HB ASP 55 1HB ASP 55 2.007 10.006 -6.935 272 2HB ASP 55 2HB ASP 55 2.256 8.516 -7.871 273 H ILE 56 H ILE 56 1.006 9.882 -4.567 274 HA ILE 56 HA ILE 56 -1.477 11.487 -4.530 275 HB ILE 56 HB ILE 56 -1.737 11.173 -2.115 276 1HG1 ILE 56 1HG1 ILE 56 0.260 8.951 -2.545 277 2HG1 ILE 56 2HG1 ILE 56 0.623 10.501 -1.737 278 1HG2 ILE 56 1HG2 ILE 56 -3.027 9.810 -3.786 279 2HG2 ILE 56 2HG2 ILE 56 -1.812 8.520 -3.577 280 3HG2 ILE 56 3HG2 ILE 56 -2.817 9.049 -2.199 281 1HD1 ILE 56 1HD1 ILE 56 -1.405 8.538 -0.629 282 2HD1 ILE 56 2HD1 ILE 56 0.304 8.629 -0.155 283 3HD1 ILE 56 3HD1 ILE 56 -0.749 10.018 0.110 284 H ASP 57 H ASP 57 -1.217 13.350 -2.943 285 HA ASP 57 HA ASP 57 1.555 13.880 -2.125 286 1HB ASP 57 1HB ASP 57 0.889 16.266 -2.204 287 2HB ASP 57 2HB ASP 57 0.993 15.494 -3.792 288 H VAL 58 H VAL 58 1.813 14.468 -0.042 289 HA VAL 58 HA VAL 58 -0.548 14.878 1.780 290 HB VAL 58 HB VAL 58 0.458 13.776 3.566 291 1HG1 VAL 58 1HG1 VAL 58 -0.038 11.955 1.184 292 2HG1 VAL 58 2HG1 VAL 58 -0.242 11.553 2.900 293 3HG1 VAL 58 3HG1 VAL 58 -1.302 12.750 2.149 294 1HG2 VAL 58 1HG2 VAL 58 2.777 13.621 3.025 295 2HG2 VAL 58 2HG2 VAL 58 2.128 11.986 3.173 296 3HG2 VAL 58 3HG2 VAL 58 2.435 12.645 1.557 297 H ARG 59 H ARG 59 -0.362 16.873 2.643 298 HA ARG 59 HA ARG 59 2.139 18.412 2.647 299 1HB ARG 59 1HB ARG 59 -0.209 18.911 4.466 300 2HB ARG 59 2HB ARG 59 1.053 20.034 3.994 301 1HG ARG 59 1HG ARG 59 -0.905 18.861 2.014 302 2HG ARG 59 2HG ARG 59 -1.295 20.254 3.049 303 1HD ARG 59 1HD ARG 59 1.071 21.004 1.879 304 2HD ARG 59 2HD ARG 59 0.405 19.966 0.625 305 HE ARG 59 HE ARG 59 -0.305 22.583 1.038 306 1HH1 ARG 59 1HH1 ARG 59 -2.574 19.713 1.360 307 2HH1 ARG 59 2HH1 ARG 59 -3.683 20.415 0.295 308 1HH2 ARG 59 1HH2 ARG 59 -2.048 23.533 -0.035 309 2HH2 ARG 59 2HH2 ARG 59 -3.527 22.659 -0.276 310 H ILE 60 H ILE 60 3.415 16.650 3.438 311 HA ILE 60 HA ILE 60 3.886 14.937 4.932 312 HB ILE 60 HB ILE 60 5.352 17.103 6.396 313 1HG1 ILE 60 1HG1 ILE 60 6.098 16.645 3.530 314 2HG1 ILE 60 2HG1 ILE 60 5.136 18.046 4.028 315 1HG2 ILE 60 1HG2 ILE 60 7.230 15.463 5.778 316 2HG2 ILE 60 2HG2 ILE 60 5.876 14.675 6.606 317 3HG2 ILE 60 3HG2 ILE 60 6.073 14.558 4.851 318 1HD1 ILE 60 1HD1 ILE 60 6.750 18.940 5.399 319 2HD1 ILE 60 2HD1 ILE 60 7.731 17.477 5.482 320 3HD1 ILE 60 3HD1 ILE 60 7.686 18.373 3.983 321 H GLY 61 H GLY 61 1.551 14.851 5.888 322 1HA GLY 61 1HA GLY 61 1.405 14.115 8.426 323 2HA GLY 61 2HA GLY 61 1.434 15.864 8.678 324 H GLU 62 H GLU 62 0.044 16.485 6.228 325 HA GLU 62 HA GLU 62 -2.733 16.344 6.963 326 1HB GLU 62 1HB GLU 62 -1.933 17.949 5.340 327 2HB GLU 62 2HB GLU 62 -1.224 16.630 4.403 328 1HG GLU 62 1HG GLU 62 -3.677 15.904 3.915 329 2HG GLU 62 2HG GLU 62 -4.116 17.513 4.523 330 H THR 63 H THR 63 -4.183 14.588 6.891 331 HA THR 63 HA THR 63 -3.192 12.086 5.873 332 HB THR 63 HB THR 63 -5.696 11.649 6.874 333 HG1 THR 63 HG1 THR 63 -5.879 13.090 8.648 334 1HG2 THR 63 1HG2 THR 63 -4.528 11.136 8.937 335 2HG2 THR 63 2HG2 THR 63 -3.580 10.651 7.550 336 3HG2 THR 63 3HG2 THR 63 -3.126 12.129 8.439 337 H VAL 64 H VAL 64 -3.800 10.966 4.214 338 HA VAL 64 HA VAL 64 -6.214 11.829 2.681 339 HB VAL 64 HB VAL 64 -4.248 12.379 1.391 340 1HG1 VAL 64 1HG1 VAL 64 -3.527 9.409 1.472 341 2HG1 VAL 64 2HG1 VAL 64 -2.757 10.683 0.505 342 3HG1 VAL 64 3HG1 VAL 64 -2.625 10.716 2.271 343 1HG2 VAL 64 1HG2 VAL 64 -4.803 11.304 -0.677 344 2HG2 VAL 64 2HG2 VAL 64 -5.575 9.946 0.150 345 3HG2 VAL 64 3HG2 VAL 64 -6.303 11.573 0.226 346 H GLN 65 H GLN 65 -7.348 10.161 1.726 347 HA GLN 65 HA GLN 65 -7.185 7.448 2.997 348 1HB GLN 65 1HB GLN 65 -9.312 9.118 3.242 349 2HB GLN 65 2HB GLN 65 -9.620 8.555 1.609 350 1HG GLN 65 1HG GLN 65 -10.809 7.033 2.895 351 2HG GLN 65 2HG GLN 65 -9.315 6.141 2.595 352 1HE2 GLN 65 1HE2 GLN 65 -8.035 8.189 4.735 353 2HE2 GLN 65 2HE2 GLN 65 -8.568 7.459 6.238 354 H ILE 66 H ILE 66 -6.276 6.045 1.739 355 HA ILE 66 HA ILE 66 -7.132 6.043 -1.101 356 HB ILE 66 HB ILE 66 -4.984 5.076 -1.798 357 1HG1 ILE 66 1HG1 ILE 66 -3.005 6.099 -0.323 358 2HG1 ILE 66 2HG1 ILE 66 -4.095 5.804 1.005 359 1HG2 ILE 66 1HG2 ILE 66 -5.709 7.469 -2.119 360 2HG2 ILE 66 2HG2 ILE 66 -4.739 7.884 -0.686 361 3HG2 ILE 66 3HG2 ILE 66 -3.965 7.189 -2.125 362 1HD1 ILE 66 1HD1 ILE 66 -2.967 3.829 -1.058 363 2HD1 ILE 66 2HD1 ILE 66 -2.563 3.901 0.667 364 3HD1 ILE 66 3HD1 ILE 66 -4.161 3.336 0.147 365 H MET 67 H MET 67 -8.413 4.477 -1.326 366 HA MET 67 HA MET 67 -8.373 2.072 0.356 367 1HB MET 67 1HB MET 67 -9.912 2.810 -2.168 368 2HB MET 67 2HB MET 67 -10.128 1.289 -1.287 369 1HG MET 67 1HG MET 67 -10.992 2.410 0.637 370 2HG MET 67 2HG MET 67 -10.505 4.001 0.032 371 1HE MET 67 1HE MET 67 -14.022 1.543 -1.686 372 2HE MET 67 2HE MET 67 -12.339 1.125 -2.045 373 3HE MET 67 3HE MET 67 -12.959 0.967 -0.384 374 H TYR 68 H TYR 68 -8.222 -0.103 -0.584 375 HA TYR 68 HA TYR 68 -6.810 -0.274 -3.192 376 1HB TYR 68 1HB TYR 68 -5.962 -1.573 -0.582 377 2HB TYR 68 2HB TYR 68 -5.826 -2.481 -2.077 378 HD1 TYR 68 HD1 TYR 68 -4.009 -0.319 0.030 379 HD2 TYR 68 HD2 TYR 68 -4.720 -1.230 -4.127 380 HE1 TYR 68 HE1 TYR 68 -1.745 0.518 -0.552 381 HE2 TYR 68 HE2 TYR 68 -2.517 -0.303 -4.710 382 HH TYR 68 HH TYR 68 -0.507 0.462 -3.905 383 H ARG 69 H ARG 69 -7.543 -2.082 -4.381 384 HA ARG 69 HA ARG 69 -9.614 -3.740 -3.131 385 1HB ARG 69 1HB ARG 69 -10.917 -2.079 -4.238 386 2HB ARG 69 2HB ARG 69 -9.970 -2.201 -5.724 387 1HG ARG 69 1HG ARG 69 -10.963 -4.206 -6.383 388 2HG ARG 69 2HG ARG 69 -11.287 -4.721 -4.725 389 1HD ARG 69 1HD ARG 69 -13.377 -4.198 -5.911 390 2HD ARG 69 2HD ARG 69 -13.105 -3.271 -4.450 391 HE ARG 69 HE ARG 69 -12.127 -1.854 -6.749 392 1HH1 ARG 69 1HH1 ARG 69 -15.031 -2.400 -4.738 393 2HH1 ARG 69 2HH1 ARG 69 -16.008 -1.283 -5.599 394 1HH2 ARG 69 1HH2 ARG 69 -13.347 -0.130 -7.664 395 2HH2 ARG 69 2HH2 ARG 69 -14.982 0.155 -7.155 396 H ALA 70 H ALA 70 -9.443 -5.803 -3.664 397 HA ALA 70 HA ALA 70 -7.828 -6.770 -5.945 398 1HB ALA 70 1HB ALA 70 -6.580 -7.270 -3.837 399 2HB ALA 70 2HB ALA 70 -8.032 -8.045 -3.184 400 3HB ALA 70 3HB ALA 70 -7.218 -8.737 -4.602 401 H LYS 71 H LYS 71 -8.815 -8.946 -6.696 402 HA LYS 71 HA LYS 71 -11.419 -9.566 -5.529 403 1HB LYS 71 1HB LYS 71 -11.317 -9.189 -8.512 404 2HB LYS 71 2HB LYS 71 -12.726 -9.318 -7.475 405 1HG LYS 71 1HG LYS 71 -12.379 -6.994 -6.707 406 2HG LYS 71 2HG LYS 71 -10.845 -6.890 -7.626 407 1HD LYS 71 1HD LYS 71 -12.014 -7.406 -9.709 408 2HD LYS 71 2HD LYS 71 -13.527 -7.548 -8.846 409 1HE LYS 71 1HE LYS 71 -13.202 -5.090 -8.126 410 2HE LYS 71 2HE LYS 71 -11.809 -5.047 -9.228 411 1HZ LYS 71 1HZ LYS 71 -14.550 -5.798 -9.934 412 2HZ LYS 71 2HZ LYS 71 -13.871 -4.325 -10.289 413 3HZ LYS 71 3HZ LYS 71 -13.200 -5.679 -10.983 414 H ASN 72 H ASN 72 -11.814 -11.778 -5.676 415 HA ASN 72 HA ASN 72 -9.655 -13.271 -6.973 416 1HB ASN 72 1HB ASN 72 -10.261 -13.875 -4.731 417 2HB ASN 72 2HB ASN 72 -11.911 -14.266 -5.259 418 1HD2 ASN 72 1HD2 ASN 72 -11.506 -16.466 -4.480 419 2HD2 ASN 72 2HD2 ASN 72 -10.552 -17.621 -5.436 420 H LEU 73 H LEU 73 -10.063 -12.772 -9.093 421 HA LEU 73 HA LEU 73 -12.234 -14.247 -10.467 422 1HB LEU 73 1HB LEU 73 -9.837 -12.636 -11.429 423 2HB LEU 73 2HB LEU 73 -10.853 -13.606 -12.503 424 HG LEU 73 HG LEU 73 -12.856 -12.317 -11.852 425 1HD1 LEU 73 1HD1 LEU 73 -12.446 -10.047 -10.789 426 2HD1 LEU 73 2HD1 LEU 73 -12.314 -11.406 -9.672 427 3HD1 LEU 73 3HD1 LEU 73 -10.840 -10.635 -10.313 428 1HD2 LEU 73 1HD2 LEU 73 -12.243 -10.319 -13.158 429 2HD2 LEU 73 2HD2 LEU 73 -10.521 -10.672 -12.920 430 3HD2 LEU 73 3HD2 LEU 73 -11.537 -11.777 -13.872 431 H ALA 74 H ALA 74 -11.369 -16.155 -9.007 432 HA ALA 74 HA ALA 74 -9.948 -17.858 -10.966 433 1HB ALA 74 1HB ALA 74 -9.532 -18.069 -7.950 434 2HB ALA 74 2HB ALA 74 -8.818 -19.106 -9.190 435 3HB ALA 74 3HB ALA 74 -8.333 -17.403 -9.076 436 H SER 75 H SER 75 -10.619 -20.156 -10.568 437 HA SER 75 HA SER 75 -13.518 -20.225 -9.809 438 1HB SER 75 1HB SER 75 -11.875 -22.265 -11.333 439 2HB SER 75 2HB SER 75 -13.610 -22.318 -11.009 440 HG SER 75 HG SER 75 -12.275 -20.357 -12.610 441 H THR 76 H THR 76 -11.046 -20.200 -7.944 442 HA THR 76 HA THR 76 -11.973 -22.291 -6.155 443 HB THR 76 HB THR 76 -9.404 -22.756 -5.753 444 HG1 THR 76 HG1 THR 76 -9.189 -22.041 -8.480 445 1HG2 THR 76 1HG2 THR 76 -10.597 -23.872 -8.330 446 2HG2 THR 76 2HG2 THR 76 -9.305 -24.583 -7.347 447 3HG2 THR 76 3HG2 THR 76 -10.952 -24.474 -6.697 448 HA PRO 77 HA PRO 77 -10.962 -18.986 -3.392 449 1HB PRO 77 1HB PRO 77 -10.092 -20.256 -1.095 450 2HB PRO 77 2HB PRO 77 -11.801 -20.277 -1.600 451 1HG PRO 77 1HG PRO 77 -9.715 -22.395 -2.154 452 2HG PRO 77 2HG PRO 77 -11.352 -22.619 -1.466 453 1HD PRO 77 1HD PRO 77 -10.890 -23.012 -4.094 454 2HD PRO 77 2HD PRO 77 -12.380 -22.184 -3.573 455 H THR 78 H THR 78 -8.972 -17.963 -2.430 456 HA THR 78 HA THR 78 -6.446 -19.432 -2.767 457 HB THR 78 HB THR 78 -5.751 -16.825 -3.674 458 HG1 THR 78 HG1 THR 78 -6.889 -16.962 -5.690 459 1HG2 THR 78 1HG2 THR 78 -5.001 -17.968 -5.635 460 2HG2 THR 78 2HG2 THR 78 -4.689 -18.991 -4.229 461 3HG2 THR 78 3HG2 THR 78 -6.090 -19.339 -5.297 462 H THR 79 H THR 79 -4.581 -17.965 -1.995 463 HA THR 79 HA THR 79 -5.407 -16.355 0.314 464 HB THR 79 HB THR 79 -4.731 -18.504 1.233 465 HG1 THR 79 HG1 THR 79 -4.151 -16.480 2.239 466 1HG2 THR 79 1HG2 THR 79 -2.041 -18.030 -0.127 467 2HG2 THR 79 2HG2 THR 79 -2.429 -19.319 1.023 468 3HG2 THR 79 3HG2 THR 79 -3.209 -19.296 -0.568 469 H GLY 80 H GLY 80 -3.920 -14.705 0.837 470 1HA GLY 80 1HA GLY 80 -1.987 -13.916 -1.288 471 2HA GLY 80 2HA GLY 80 -3.168 -12.784 -0.620 472 H GLN 81 H GLN 81 -0.079 -13.462 -0.433 473 HA GLN 81 HA GLN 81 0.168 -12.157 2.153 474 1HB GLN 81 1HB GLN 81 2.081 -13.736 2.864 475 2HB GLN 81 2HB GLN 81 0.413 -14.224 3.099 476 1HG GLN 81 1HG GLN 81 1.505 -16.140 2.435 477 2HG GLN 81 2HG GLN 81 0.534 -15.682 1.054 478 1HE2 GLN 81 1HE2 GLN 81 2.009 -14.143 -0.574 479 2HE2 GLN 81 2HE2 GLN 81 3.516 -14.943 -0.971 480 H ALA 82 H ALA 82 0.285 -11.113 -0.328 481 HA ALA 82 HA ALA 82 2.663 -11.244 -1.811 482 1HB ALA 82 1HB ALA 82 0.789 -8.916 -1.262 483 2HB ALA 82 2HB ALA 82 1.980 -8.973 -2.570 484 3HB ALA 82 3HB ALA 82 0.590 -10.115 -2.542 485 H THR 83 H THR 83 4.581 -9.888 -1.868 486 HA THR 83 HA THR 83 5.243 -8.915 0.852 487 HB THR 83 HB THR 83 6.903 -10.331 -0.197 488 HG1 THR 83 HG1 THR 83 8.602 -8.928 0.345 489 1HG2 THR 83 1HG2 THR 83 7.356 -8.002 -2.119 490 2HG2 THR 83 2HG2 THR 83 8.359 -9.457 -1.981 491 3HG2 THR 83 3HG2 THR 83 6.694 -9.604 -2.571 492 H PHE 84 H PHE 84 5.620 -6.837 1.312 493 HA PHE 84 HA PHE 84 4.632 -4.769 -0.619 494 1HB PHE 84 1HB PHE 84 3.931 -3.615 1.552 495 2HB PHE 84 2HB PHE 84 2.975 -4.972 0.994 496 HD1 PHE 84 HD1 PHE 84 5.315 -3.856 3.640 497 HD2 PHE 84 HD2 PHE 84 2.954 -7.140 2.157 498 HE1 PHE 84 HE1 PHE 84 6.435 -5.357 5.191 499 HE2 PHE 84 HE2 PHE 84 3.927 -8.603 3.885 500 HZ PHE 84 HZ PHE 84 5.690 -7.739 5.411 501 H ASN 85 H ASN 85 6.749 -4.304 -1.460 502 HA ASN 85 HA ASN 85 8.895 -3.704 0.502 503 1HB ASN 85 1HB ASN 85 9.528 -4.703 -1.546 504 2HB ASN 85 2HB ASN 85 8.647 -3.499 -2.463 505 1HD2 ASN 85 1HD2 ASN 85 9.510 -1.158 -2.235 506 2HD2 ASN 85 2HD2 ASN 85 11.249 -0.974 -2.144 507 H VAL 86 H VAL 86 7.658 -2.282 1.729 508 HA VAL 86 HA VAL 86 6.638 0.263 0.783 509 HB VAL 86 HB VAL 86 7.290 -0.677 3.598 510 1HG1 VAL 86 1HG1 VAL 86 5.558 0.997 4.263 511 2HG1 VAL 86 2HG1 VAL 86 6.936 1.795 3.509 512 3HG1 VAL 86 3HG1 VAL 86 5.456 1.538 2.573 513 1HG2 VAL 86 1HG2 VAL 86 5.497 -2.031 2.240 514 2HG2 VAL 86 2HG2 VAL 86 5.092 -1.430 3.856 515 3HG2 VAL 86 3HG2 VAL 86 4.503 -0.586 2.427 516 H THR 87 H THR 87 8.873 0.616 -0.459 517 HA THR 87 HA THR 87 10.044 2.782 0.960 518 HB THR 87 HB THR 87 11.269 0.950 2.063 519 HG1 THR 87 HG1 THR 87 13.360 1.926 1.670 520 1HG2 THR 87 1HG2 THR 87 12.984 -0.293 0.918 521 2HG2 THR 87 2HG2 THR 87 11.383 -0.608 0.221 522 3HG2 THR 87 3HG2 THR 87 12.536 0.451 -0.631 523 HA PRO 88 HA PRO 88 11.312 3.804 -3.276 524 1HB PRO 88 1HB PRO 88 13.057 5.863 -2.627 525 2HB PRO 88 2HB PRO 88 11.317 6.049 -2.885 526 1HG PRO 88 1HG PRO 88 12.814 5.997 -0.308 527 2HG PRO 88 2HG PRO 88 11.309 6.842 -0.702 528 1HD PRO 88 1HD PRO 88 11.492 4.457 0.732 529 2HD PRO 88 2HD PRO 88 10.016 5.016 -0.081 530 H MET 89 H MET 89 13.284 3.441 -0.372 531 HA MET 89 HA MET 89 14.909 1.441 -0.932 532 1HB MET 89 1HB MET 89 17.146 2.426 -1.508 533 2HB MET 89 2HB MET 89 15.996 2.316 -2.815 534 1HG MET 89 1HG MET 89 15.500 4.866 -2.272 535 2HG MET 89 2HG MET 89 17.039 4.769 -1.404 536 1HE MET 89 1HE MET 89 16.021 3.102 -4.922 537 2HE MET 89 2HE MET 89 15.269 4.714 -4.869 538 3HE MET 89 3HE MET 89 16.629 4.398 -5.970 539 H ALA 90 H ALA 90 15.767 4.773 0.038 540 HA ALA 90 HA ALA 90 16.942 3.767 2.516 541 1HB ALA 90 1HB ALA 90 18.143 5.366 1.078 542 2HB ALA 90 2HB ALA 90 16.838 6.554 1.308 543 3HB ALA 90 3HB ALA 90 17.823 6.038 2.692 544 H ALA 91 H ALA 91 14.018 5.515 1.590 545 HA ALA 91 HA ALA 91 13.509 6.372 4.371 546 1HB ALA 91 1HB ALA 91 12.734 7.853 2.616 547 2HB ALA 91 2HB ALA 91 11.710 6.576 1.930 548 3HB ALA 91 3HB ALA 91 11.370 7.211 3.553 549 H GLY 92 H GLY 92 10.586 5.313 3.194 550 1HA GLY 92 1HA GLY 92 9.337 3.429 3.459 551 2HA GLY 92 2HA GLY 92 10.830 2.499 3.657 552 H ALA 93 H ALA 93 11.982 3.312 5.933 553 HA ALA 93 HA ALA 93 10.582 2.338 8.104 554 1HB ALA 93 1HB ALA 93 12.660 4.571 8.095 555 2HB ALA 93 2HB ALA 93 12.180 3.606 9.507 556 3HB ALA 93 3HB ALA 93 12.987 2.824 8.132 557 H TYR 94 H TYR 94 10.788 5.743 7.081 558 HA TYR 94 HA TYR 94 8.978 6.756 9.057 559 1HB TYR 94 1HB TYR 94 9.915 8.016 6.465 560 2HB TYR 94 2HB TYR 94 9.187 8.839 7.836 561 HD1 TYR 94 HD1 TYR 94 12.320 7.583 6.444 562 HD2 TYR 94 HD2 TYR 94 10.371 8.748 10.110 563 HE1 TYR 94 HE1 TYR 94 14.544 8.015 7.501 564 HE2 TYR 94 HE2 TYR 94 12.571 9.170 11.148 565 HH TYR 94 HH TYR 94 14.842 9.101 10.877 566 H PHE 95 H PHE 95 8.305 4.960 6.200 567 HA PHE 95 HA PHE 95 6.051 6.457 5.264 568 1HB PHE 95 1HB PHE 95 7.257 4.673 3.895 569 2HB PHE 95 2HB PHE 95 6.661 3.467 5.033 570 HD1 PHE 95 HD1 PHE 95 6.092 4.695 1.827 571 HD2 PHE 95 HD2 PHE 95 4.119 3.099 5.290 572 HE1 PHE 95 HE1 PHE 95 4.077 4.250 0.478 573 HE2 PHE 95 HE2 PHE 95 2.088 2.698 3.962 574 HZ PHE 95 HZ PHE 95 2.047 3.278 1.550 575 H ASN 96 H ASN 96 4.039 6.583 6.188 576 HA ASN 96 HA ASN 96 3.828 5.225 8.673 577 1HB ASN 96 1HB ASN 96 2.221 7.320 7.335 578 2HB ASN 96 2HB ASN 96 1.462 6.431 8.653 579 1HD2 ASN 96 1HD2 ASN 96 4.963 7.579 8.292 580 2HD2 ASN 96 2HD2 ASN 96 4.890 8.381 9.846 581 H LYS 97 H LYS 97 3.878 3.121 7.861 582 HA LYS 97 HA LYS 97 1.772 1.715 6.596 583 1HB LYS 97 1HB LYS 97 2.655 -0.242 7.843 584 2HB LYS 97 2HB LYS 97 3.935 0.723 7.092 585 1HG LYS 97 1HG LYS 97 4.333 1.848 9.333 586 2HG LYS 97 2HG LYS 97 3.137 0.758 10.045 587 1HD LYS 97 1HD LYS 97 4.513 -1.186 9.405 588 2HD LYS 97 2HD LYS 97 5.676 -0.105 8.596 589 1HE LYS 97 1HE LYS 97 6.106 1.059 10.769 590 2HE LYS 97 2HE LYS 97 4.976 -0.040 11.580 591 1HZ LYS 97 1HZ LYS 97 7.485 -0.825 10.244 592 2HZ LYS 97 2HZ LYS 97 7.245 -0.712 11.865 593 3HZ LYS 97 3HZ LYS 97 6.443 -1.858 11.000 594 H VAL 98 H VAL 98 -0.112 0.666 7.395 595 HA VAL 98 HA VAL 98 -0.820 0.748 10.177 596 HB VAL 98 HB VAL 98 -1.559 2.999 9.474 597 1HG1 VAL 98 1HG1 VAL 98 -1.940 2.610 7.070 598 2HG1 VAL 98 2HG1 VAL 98 -3.346 1.586 7.452 599 3HG1 VAL 98 3HG1 VAL 98 -3.363 3.314 7.848 600 1HG2 VAL 98 1HG2 VAL 98 -3.815 2.919 10.281 601 2HG2 VAL 98 2HG2 VAL 98 -3.977 1.202 9.889 602 3HG2 VAL 98 3HG2 VAL 98 -2.861 1.724 11.175 603 H GLN 99 H GLN 99 -2.806 -0.688 10.458 604 HA GLN 99 HA GLN 99 -3.530 -2.413 8.226 605 1HB GLN 99 1HB GLN 99 -1.290 -3.275 8.903 606 2HB GLN 99 2HB GLN 99 -1.835 -3.378 10.584 607 1HG GLN 99 1HG GLN 99 -3.514 -5.083 9.938 608 2HG GLN 99 2HG GLN 99 -2.979 -4.984 8.250 609 1HE2 GLN 99 1HE2 GLN 99 -0.551 -5.477 7.918 610 2HE2 GLN 99 2HE2 GLN 99 0.138 -6.709 8.960 611 H CYS 100 H CYS 100 -5.350 -3.730 8.877 612 HA CYS 100 HA CYS 100 -6.722 -2.784 11.330 613 1HB CYS 100 1HB CYS 100 -8.698 -3.868 10.553 614 2HB CYS 100 2HB CYS 100 -8.092 -2.741 9.330 615 HG CYS 100 HG CYS 100 -7.180 -4.430 7.699 616 H PHE 101 H PHE 101 -5.944 -5.992 9.812 617 HA PHE 101 HA PHE 101 -4.852 -7.067 12.234 618 1HB PHE 101 1HB PHE 101 -7.261 -7.101 12.886 619 2HB PHE 101 2HB PHE 101 -7.641 -7.987 11.417 620 HD1 PHE 101 HD1 PHE 101 -7.230 -10.395 11.279 621 HD2 PHE 101 HD2 PHE 101 -5.890 -8.134 14.703 622 HE1 PHE 101 HE1 PHE 101 -6.768 -12.502 12.494 623 HE2 PHE 101 HE2 PHE 101 -5.440 -10.250 15.917 624 HZ PHE 101 HZ PHE 101 -5.879 -12.437 14.816 625 H CYS 102 H CYS 102 -3.171 -7.740 10.883 626 HA CYS 102 HA CYS 102 -2.011 -9.081 9.536 627 1HB CYS 102 1HB CYS 102 -3.082 -10.884 10.845 628 2HB CYS 102 2HB CYS 102 -4.379 -10.983 9.631 629 HG CYS 102 HG CYS 102 -1.125 -11.395 9.323 630 H PHE 103 H PHE 103 -1.900 -7.678 7.776 631 HA PHE 103 HA PHE 103 -2.066 -7.083 5.589 632 1HB PHE 103 1HB PHE 103 -2.813 -10.015 5.573 633 2HB PHE 103 2HB PHE 103 -3.107 -9.129 4.128 634 HD1 PHE 103 HD1 PHE 103 -1.287 -7.995 2.866 635 HD2 PHE 103 HD2 PHE 103 -0.559 -10.661 6.186 636 HE1 PHE 103 HE1 PHE 103 0.834 -8.655 1.862 637 HE2 PHE 103 HE2 PHE 103 1.657 -11.232 5.221 638 HZ PHE 103 HZ PHE 103 2.342 -10.268 3.030 639 H THR 104 H THR 104 -3.823 -7.311 3.558 640 HA THR 104 HA THR 104 -6.554 -7.430 4.456 641 HB THR 104 HB THR 104 -6.079 -5.071 4.904 642 HG1 THR 104 HG1 THR 104 -8.139 -5.619 4.323 643 1HG2 THR 104 1HG2 THR 104 -5.700 -3.448 3.164 644 2HG2 THR 104 2HG2 THR 104 -4.361 -4.609 3.172 645 3HG2 THR 104 3HG2 THR 104 -5.618 -4.698 1.918 646 H GLU 105 H GLU 105 -5.214 -9.217 3.170 647 HA GLU 105 HA GLU 105 -6.508 -9.311 0.529 648 1HB GLU 105 1HB GLU 105 -4.508 -10.178 -0.591 649 2HB GLU 105 2HB GLU 105 -4.290 -8.528 -0.030 650 1HG GLU 105 1HG GLU 105 -3.010 -9.414 1.948 651 2HG GLU 105 2HG GLU 105 -3.101 -11.032 1.227 652 H THR 106 H THR 106 -4.352 -11.110 2.706 653 HA THR 106 HA THR 106 -4.449 -13.097 3.680 654 HB THR 106 HB THR 106 -5.603 -11.750 5.212 655 HG1 THR 106 HG1 THR 106 -5.423 -13.899 5.746 656 1HG2 THR 106 1HG2 THR 106 -8.313 -12.588 4.116 657 2HG2 THR 106 2HG2 THR 106 -7.952 -11.567 5.500 658 3HG2 THR 106 3HG2 THR 106 -7.582 -10.982 3.878 659 H THR 107 H THR 107 -7.746 -13.243 2.380 660 HA THR 107 HA THR 107 -7.211 -15.392 0.702 661 HB THR 107 HB THR 107 -7.637 -16.151 3.484 662 HG1 THR 107 HG1 THR 107 -7.239 -17.594 1.084 663 1HG2 THR 107 1HG2 THR 107 -9.662 -17.414 1.580 664 2HG2 THR 107 2HG2 THR 107 -9.292 -17.919 3.235 665 3HG2 THR 107 3HG2 THR 107 -10.051 -16.347 2.955 666 H LEU 108 H LEU 108 -8.999 -16.036 -0.563 667 HA LEU 108 HA LEU 108 -11.577 -14.717 -0.060 668 1HB LEU 108 1HB LEU 108 -9.949 -14.350 -2.603 669 2HB LEU 108 2HB LEU 108 -11.653 -13.901 -2.460 670 HG LEU 108 HG LEU 108 -9.379 -12.675 -0.881 671 1HD1 LEU 108 1HD1 LEU 108 -9.558 -10.757 -2.316 672 2HD1 LEU 108 2HD1 LEU 108 -9.318 -12.179 -3.325 673 3HD1 LEU 108 3HD1 LEU 108 -10.935 -11.468 -3.193 674 1HD2 LEU 108 1HD2 LEU 108 -11.662 -12.585 0.269 675 2HD2 LEU 108 2HD2 LEU 108 -10.965 -11.028 -0.116 676 3HD2 LEU 108 3HD2 LEU 108 -12.259 -11.697 -1.140 677 H GLU 109 H GLU 109 -13.249 -15.630 -1.295 678 HA GLU 109 HA GLU 109 -12.738 -18.366 -2.262 679 1HB GLU 109 1HB GLU 109 -15.417 -17.105 -1.617 680 2HB GLU 109 2HB GLU 109 -14.986 -18.819 -1.770 681 1HG GLU 109 1HG GLU 109 -13.359 -18.495 0.163 682 2HG GLU 109 2HG GLU 109 -14.209 -16.970 0.483 683 HA PRO 110 HA PRO 110 -13.013 -17.276 -6.397 684 1HB PRO 110 1HB PRO 110 -14.550 -19.086 -7.715 685 2HB PRO 110 2HB PRO 110 -13.045 -19.467 -6.857 686 1HG PRO 110 1HG PRO 110 -15.859 -19.816 -5.837 687 2HG PRO 110 2HG PRO 110 -14.530 -21.015 -5.810 688 1HD PRO 110 1HD PRO 110 -15.170 -19.404 -3.704 689 2HD PRO 110 2HD PRO 110 -13.481 -19.907 -3.990 690 H GLY 111 H GLY 111 -13.834 -15.188 -6.487 691 1HA GLY 111 1HA GLY 111 -15.627 -14.297 -8.137 692 2HA GLY 111 2HA GLY 111 -16.765 -14.816 -6.879 693 H GLU 112 H GLU 112 -14.579 -14.091 -4.768 694 HA GLU 112 HA GLU 112 -16.235 -11.905 -4.223 695 1HB GLU 112 1HB GLU 112 -13.838 -12.927 -2.660 696 2HB GLU 112 2HB GLU 112 -15.203 -11.987 -2.057 697 1HG GLU 112 1HG GLU 112 -15.272 -14.833 -2.949 698 2HG GLU 112 2HG GLU 112 -15.691 -14.132 -1.392 699 H GLU 113 H GLU 113 -15.995 -9.736 -4.466 700 HA GLU 113 HA GLU 113 -13.392 -8.532 -5.145 701 1HB GLU 113 1HB GLU 113 -16.095 -7.222 -4.644 702 2HB GLU 113 2HB GLU 113 -14.594 -6.406 -5.090 703 1HG GLU 113 1HG GLU 113 -14.848 -8.258 -7.079 704 2HG GLU 113 2HG GLU 113 -16.530 -7.976 -6.624 705 H MET 114 H MET 114 -12.088 -7.492 -3.672 706 HA MET 114 HA MET 114 -12.739 -7.628 -0.773 707 1HB MET 114 1HB MET 114 -11.351 -9.447 -1.613 708 2HB MET 114 2HB MET 114 -10.295 -8.350 -2.476 709 1HG MET 114 1HG MET 114 -9.320 -9.060 -0.406 710 2HG MET 114 2HG MET 114 -9.553 -7.315 -0.383 711 1HE MET 114 1HE MET 114 -8.764 -8.854 2.200 712 2HE MET 114 2HE MET 114 -9.120 -7.105 2.164 713 3HE MET 114 3HE MET 114 -9.881 -8.146 3.392 714 H GLU 115 H GLU 115 -12.563 -5.466 0.107 715 HA GLU 115 HA GLU 115 -10.317 -3.879 -0.806 716 1HB GLU 115 1HB GLU 115 -11.650 -1.899 -1.474 717 2HB GLU 115 2HB GLU 115 -11.932 -3.295 -2.509 718 1HG GLU 115 1HG GLU 115 -14.050 -3.762 -1.177 719 2HG GLU 115 2HG GLU 115 -13.802 -2.197 -0.380 720 H MET 116 H MET 116 -9.844 -1.986 0.488 721 HA MET 116 HA MET 116 -11.284 -1.647 2.979 722 1HB MET 116 1HB MET 116 -9.922 -3.373 3.760 723 2HB MET 116 2HB MET 116 -8.637 -3.058 2.577 724 1HG MET 116 1HG MET 116 -7.794 -1.222 3.741 725 2HG MET 116 2HG MET 116 -9.260 -1.101 4.729 726 1HE MET 116 1HE MET 116 -6.396 -0.751 5.938 727 2HE MET 116 2HE MET 116 -7.891 -0.685 6.901 728 3HE MET 116 3HE MET 116 -6.537 -1.713 7.428 729 HA PRO 117 HA PRO 117 -9.290 2.430 2.102 730 1HB PRO 117 1HB PRO 117 -9.931 3.752 4.321 731 2HB PRO 117 2HB PRO 117 -11.125 3.400 3.035 732 1HG PRO 117 1HG PRO 117 -10.672 1.890 5.620 733 2HG PRO 117 2HG PRO 117 -12.195 2.465 4.875 734 1HD PRO 117 1HD PRO 117 -11.295 -0.111 4.613 735 2HD PRO 117 2HD PRO 117 -12.217 0.703 3.319 736 H VAL 118 H VAL 118 -7.309 3.222 2.580 737 HA VAL 118 HA VAL 118 -5.963 2.466 5.127 738 HB VAL 118 HB VAL 118 -4.679 2.819 2.381 739 1HG1 VAL 118 1HG1 VAL 118 -3.432 2.228 5.077 740 2HG1 VAL 118 2HG1 VAL 118 -2.591 2.180 3.513 741 3HG1 VAL 118 3HG1 VAL 118 -3.230 3.712 4.115 742 1HG2 VAL 118 1HG2 VAL 118 -4.988 0.342 4.125 743 2HG2 VAL 118 2HG2 VAL 118 -5.779 0.626 2.558 744 3HG2 VAL 118 3HG2 VAL 118 -4.023 0.446 2.637 745 H VAL 119 H VAL 119 -5.423 4.244 6.276 746 HA VAL 119 HA VAL 119 -5.716 6.930 5.049 747 HB VAL 119 HB VAL 119 -6.943 6.513 7.102 748 1HG1 VAL 119 1HG1 VAL 119 -5.835 6.255 9.273 749 2HG1 VAL 119 2HG1 VAL 119 -5.480 4.869 8.240 750 3HG1 VAL 119 3HG1 VAL 119 -4.253 6.129 8.491 751 1HG2 VAL 119 1HG2 VAL 119 -6.239 8.519 8.304 752 2HG2 VAL 119 2HG2 VAL 119 -4.640 8.458 7.542 753 3HG2 VAL 119 3HG2 VAL 119 -6.082 8.787 6.559 754 H PHE 120 H PHE 120 -3.852 8.258 4.832 755 HA PHE 120 HA PHE 120 -1.272 7.168 5.844 756 1HB PHE 120 1HB PHE 120 -1.583 6.080 3.698 757 2HB PHE 120 2HB PHE 120 -1.976 7.616 2.928 758 HD1 PHE 120 HD1 PHE 120 0.776 5.606 4.453 759 HD2 PHE 120 HD2 PHE 120 -0.264 9.254 2.402 760 HE1 PHE 120 HE1 PHE 120 3.174 6.065 4.030 761 HE2 PHE 120 HE2 PHE 120 2.130 9.793 2.143 762 HZ PHE 120 HZ PHE 120 3.861 8.138 2.849 763 H PHE 121 H PHE 121 0.283 8.612 6.189 764 HA PHE 121 HA PHE 121 0.533 11.212 5.064 765 1HB PHE 121 1HB PHE 121 0.293 12.483 7.103 766 2HB PHE 121 2HB PHE 121 -1.239 11.768 6.684 767 HD1 PHE 121 HD1 PHE 121 -1.799 9.459 7.874 768 HD2 PHE 121 HD2 PHE 121 1.246 12.138 9.229 769 HE1 PHE 121 HE1 PHE 121 -1.782 8.307 10.076 770 HE2 PHE 121 HE2 PHE 121 1.249 11.025 11.455 771 HZ PHE 121 HZ PHE 121 -0.231 9.089 11.862 772 H VAL 122 H VAL 122 2.812 11.333 4.984 773 HA VAL 122 HA VAL 122 4.323 9.418 6.678 774 HB VAL 122 HB VAL 122 4.849 9.597 4.318 775 1HG1 VAL 122 1HG1 VAL 122 4.445 12.082 4.055 776 2HG1 VAL 122 2HG1 VAL 122 5.998 12.336 4.885 777 3HG1 VAL 122 3HG1 VAL 122 5.939 11.462 3.338 778 1HG2 VAL 122 1HG2 VAL 122 6.612 8.834 5.804 779 2HG2 VAL 122 2HG2 VAL 122 7.321 9.825 4.523 780 3HG2 VAL 122 3HG2 VAL 122 7.130 10.499 6.137 781 H ASP 123 H ASP 123 5.890 10.024 8.255 782 HA ASP 123 HA ASP 123 5.281 12.494 9.645 783 1HB ASP 123 1HB ASP 123 7.557 10.526 10.068 784 2HB ASP 123 2HB ASP 123 7.257 11.952 11.064 785 HA PRO 124 HA PRO 124 8.490 14.882 7.442 786 1HB PRO 124 1HB PRO 124 8.354 17.244 8.876 787 2HB PRO 124 2HB PRO 124 7.185 16.744 7.665 788 1HG PRO 124 1HG PRO 124 6.913 16.661 10.608 789 2HG PRO 124 2HG PRO 124 5.649 16.911 9.344 790 1HD PRO 124 1HD PRO 124 6.151 14.494 10.722 791 2HD PRO 124 2HD PRO 124 5.203 14.695 9.227 792 H GLU 125 H GLU 125 9.552 12.957 8.743 793 HA GLU 125 HA GLU 125 11.955 14.293 9.805 794 1HB GLU 125 1HB GLU 125 12.411 12.421 11.308 795 2HB GLU 125 2HB GLU 125 11.191 13.638 11.805 796 1HG GLU 125 1HG GLU 125 9.444 12.250 11.300 797 2HG GLU 125 2HG GLU 125 10.460 11.131 10.386 798 H ILE 126 H ILE 126 10.772 12.291 7.335 799 HA ILE 126 HA ILE 126 12.774 10.450 6.932 800 HB ILE 126 HB ILE 126 10.776 10.523 5.739 801 1HG1 ILE 126 1HG1 ILE 126 13.141 9.656 4.919 802 2HG1 ILE 126 2HG1 ILE 126 11.685 9.550 3.957 803 1HG2 ILE 126 1HG2 ILE 126 10.335 12.046 3.870 804 2HG2 ILE 126 2HG2 ILE 126 10.337 12.902 5.406 805 3HG2 ILE 126 3HG2 ILE 126 11.718 13.046 4.321 806 1HD1 ILE 126 1HD1 ILE 126 13.663 11.828 3.644 807 2HD1 ILE 126 2HD1 ILE 126 13.656 10.332 2.689 808 3HD1 ILE 126 3HD1 ILE 126 12.258 11.421 2.623 809 H VAL 127 H VAL 127 12.828 13.944 6.228 810 HA VAL 127 HA VAL 127 15.584 13.850 5.220 811 HB VAL 127 HB VAL 127 15.354 16.349 5.263 812 1HG1 VAL 127 1HG1 VAL 127 13.896 16.404 3.290 813 2HG1 VAL 127 2HG1 VAL 127 14.988 15.009 3.239 814 3HG1 VAL 127 3HG1 VAL 127 13.279 14.782 3.673 815 1HG2 VAL 127 1HG2 VAL 127 13.193 17.384 5.499 816 2HG2 VAL 127 2HG2 VAL 127 12.383 15.837 5.777 817 3HG2 VAL 127 3HG2 VAL 127 13.497 16.493 6.999 818 H LYS 128 H LYS 128 16.000 12.544 7.295 819 HA LYS 128 HA LYS 128 17.396 14.427 9.150 820 1HB LYS 128 1HB LYS 128 15.830 11.969 9.895 821 2HB LYS 128 2HB LYS 128 17.232 12.488 10.843 822 1HG LYS 128 1HG LYS 128 16.154 14.695 11.201 823 2HG LYS 128 2HG LYS 128 14.760 14.143 10.261 824 1HD LYS 128 1HD LYS 128 14.521 12.205 11.853 825 2HD LYS 128 2HD LYS 128 15.838 12.862 12.830 826 1HE LYS 128 1HE LYS 128 14.570 14.812 13.444 827 2HE LYS 128 2HE LYS 128 13.334 14.494 12.225 828 1HZ LYS 128 1HZ LYS 128 12.644 12.535 13.487 829 2HZ LYS 128 2HZ LYS 128 13.808 12.797 14.604 830 3HZ LYS 128 3HZ LYS 128 12.572 13.863 14.408 831 HA PRO 129 HA PRO 129 20.423 10.982 8.995 832 1HB PRO 129 1HB PRO 129 20.057 8.484 7.952 833 2HB PRO 129 2HB PRO 129 19.396 8.966 9.540 834 1HG PRO 129 1HG PRO 129 17.961 9.053 6.861 835 2HG PRO 129 2HG PRO 129 17.423 8.249 8.359 836 1HD PRO 129 1HD PRO 129 16.505 10.687 7.847 837 2HD PRO 129 2HD PRO 129 17.107 10.276 9.483 838 H VAL 130 H VAL 130 22.145 10.331 7.699 839 HA VAL 130 HA VAL 130 22.566 11.630 5.248 840 HB VAL 130 HB VAL 130 23.992 9.288 6.573 841 1HG1 VAL 130 1HG1 VAL 130 25.948 10.034 5.224 842 2HG1 VAL 130 2HG1 VAL 130 24.639 9.392 4.224 843 3HG1 VAL 130 3HG1 VAL 130 24.883 11.152 4.341 844 1HG2 VAL 130 1HG2 VAL 130 23.946 11.329 7.993 845 2HG2 VAL 130 2HG2 VAL 130 25.564 11.056 7.345 846 3HG2 VAL 130 3HG2 VAL 130 24.524 12.298 6.623 847 H GLU 131 H GLU 131 21.459 8.388 6.059 848 HA GLU 131 HA GLU 131 21.543 6.975 3.659 849 1HB GLU 131 1HB GLU 131 19.392 7.062 5.823 850 2HB GLU 131 2HB GLU 131 19.586 5.763 4.644 851 1HG GLU 131 1HG GLU 131 21.669 5.061 5.586 852 2HG GLU 131 2HG GLU 131 21.833 6.503 6.593 853 H THR 132 H THR 132 19.026 9.354 4.689 854 HA THR 132 HA THR 132 17.631 8.789 2.155 855 HB THR 132 HB THR 132 15.912 10.337 3.284 856 HG1 THR 132 HG1 THR 132 16.291 10.734 5.469 857 1HG2 THR 132 1HG2 THR 132 15.660 7.897 3.413 858 2HG2 THR 132 2HG2 THR 132 16.788 7.811 4.781 859 3HG2 THR 132 3HG2 THR 132 15.225 8.618 4.972 860 H GLN 133 H GLN 133 18.680 11.522 4.069 861 HA GLN 133 HA GLN 133 18.771 13.793 3.435 862 1HB GLN 133 1HB GLN 133 20.992 12.278 3.829 863 2HB GLN 133 2HB GLN 133 21.381 12.856 2.250 864 1HG GLN 133 1HG GLN 133 22.349 14.360 3.844 865 2HG GLN 133 2HG GLN 133 21.030 15.223 3.047 866 1HE2 GLN 133 1HE2 GLN 133 19.998 12.830 5.447 867 2HE2 GLN 133 2HE2 GLN 133 19.790 13.930 6.764 868 H GLY 134 H GLY 134 17.039 13.331 1.521 869 1HA GLY 134 1HA GLY 134 17.284 14.992 -0.608 870 2HA GLY 134 2HA GLY 134 18.269 13.615 -1.141 871 H ILE 135 H ILE 135 16.700 11.535 0.221 872 HA ILE 135 HA ILE 135 14.635 11.057 -1.728 873 HB ILE 135 HB ILE 135 15.187 9.917 1.031 874 1HG1 ILE 135 1HG1 ILE 135 16.906 9.297 -0.538 875 2HG1 ILE 135 2HG1 ILE 135 15.826 7.924 -0.300 876 1HG2 ILE 135 1HG2 ILE 135 13.052 9.075 -0.990 877 2HG2 ILE 135 2HG2 ILE 135 13.613 8.087 0.377 878 3HG2 ILE 135 3HG2 ILE 135 12.799 9.624 0.668 879 1HD1 ILE 135 1HD1 ILE 135 16.281 8.027 -2.615 880 2HD1 ILE 135 2HD1 ILE 135 14.616 8.618 -2.418 881 3HD1 ILE 135 3HD1 ILE 135 15.937 9.769 -2.700 882 H LYS 136 H LYS 136 12.651 11.775 -1.878 883 HA LYS 136 HA LYS 136 11.099 12.042 0.465 884 1HB LYS 136 1HB LYS 136 10.223 14.310 0.059 885 2HB LYS 136 2HB LYS 136 11.776 14.154 0.876 886 1HG LYS 136 1HG LYS 136 12.955 14.735 -1.209 887 2HG LYS 136 2HG LYS 136 11.385 14.891 -2.041 888 1HD LYS 136 1HD LYS 136 10.631 16.385 -0.034 889 2HD LYS 136 2HD LYS 136 12.328 16.435 0.445 890 1HE LYS 136 1HE LYS 136 12.834 17.722 -1.622 891 2HE LYS 136 2HE LYS 136 11.159 17.532 -2.171 892 1HZ LYS 136 1HZ LYS 136 10.464 18.915 -0.149 893 2HZ LYS 136 2HZ LYS 136 12.025 19.057 0.222 894 3HZ LYS 136 3HZ LYS 136 11.465 19.682 -1.178 895 H THR 137 H THR 137 10.851 10.165 -1.414 896 HA THR 137 HA THR 137 8.238 10.771 -2.540 897 HB THR 137 HB THR 137 9.092 9.527 -4.649 898 HG1 THR 137 HG1 THR 137 11.158 9.123 -3.835 899 1HG2 THR 137 1HG2 THR 137 9.953 12.417 -4.296 900 2HG2 THR 137 2HG2 THR 137 9.476 11.605 -5.802 901 3HG2 THR 137 3HG2 THR 137 8.272 11.875 -4.514 902 H LEU 138 H LEU 138 7.349 9.312 -1.193 903 HA LEU 138 HA LEU 138 8.653 6.717 -0.663 904 1HB LEU 138 1HB LEU 138 6.450 8.359 0.397 905 2HB LEU 138 2HB LEU 138 6.087 6.626 0.386 906 HG LEU 138 HG LEU 138 8.071 6.220 1.684 907 1HD1 LEU 138 1HD1 LEU 138 8.584 9.205 1.653 908 2HD1 LEU 138 2HD1 LEU 138 9.387 8.032 2.722 909 3HD1 LEU 138 3HD1 LEU 138 9.628 7.927 0.981 910 1HD2 LEU 138 1HD2 LEU 138 6.407 8.480 2.892 911 2HD2 LEU 138 2HD2 LEU 138 5.966 6.782 2.973 912 3HD2 LEU 138 3HD2 LEU 138 7.397 7.349 3.828 913 H THR 139 H THR 139 7.766 4.704 -1.212 914 HA THR 139 HA THR 139 5.589 4.580 -3.050 915 HB THR 139 HB THR 139 7.512 4.710 -4.629 916 HG1 THR 139 HG1 THR 139 6.019 3.354 -5.399 917 1HG2 THR 139 1HG2 THR 139 9.266 3.048 -4.606 918 2HG2 THR 139 2HG2 THR 139 9.179 3.867 -3.025 919 3HG2 THR 139 3HG2 THR 139 8.523 2.220 -3.222 920 H LEU 140 H LEU 140 5.435 2.079 -3.498 921 HA LEU 140 HA LEU 140 6.089 0.401 -1.261 922 1HB LEU 140 1HB LEU 140 4.081 1.610 -0.416 923 2HB LEU 140 2HB LEU 140 3.134 1.073 -1.802 924 HG LEU 140 HG LEU 140 4.424 -0.793 0.233 925 1HD1 LEU 140 1HD1 LEU 140 1.553 0.246 0.067 926 2HD1 LEU 140 2HD1 LEU 140 2.152 -0.951 1.234 927 3HD1 LEU 140 3HD1 LEU 140 2.747 0.714 1.295 928 1HD2 LEU 140 1HD2 LEU 140 2.637 -2.395 -0.576 929 2HD2 LEU 140 2HD2 LEU 140 2.341 -1.277 -1.923 930 3HD2 LEU 140 3HD2 LEU 140 3.925 -2.075 -1.726 931 H SER 141 H SER 141 6.997 -1.024 -2.720 932 HA SER 141 HA SER 141 5.617 -1.657 -5.264 933 1HB SER 141 1HB SER 141 8.040 -1.205 -5.272 934 2HB SER 141 2HB SER 141 8.289 -2.717 -4.381 935 HG SER 141 HG SER 141 7.032 -2.398 -6.915 936 H TYR 142 H TYR 142 3.816 -2.610 -4.647 937 HA TYR 142 HA TYR 142 3.795 -4.822 -2.741 938 1HB TYR 142 1HB TYR 142 1.903 -2.939 -3.614 939 2HB TYR 142 2HB TYR 142 1.377 -4.419 -4.395 940 HD1 TYR 142 HD1 TYR 142 2.288 -6.331 -2.023 941 HD2 TYR 142 HD2 TYR 142 -0.068 -2.718 -2.279 942 HE1 TYR 142 HE1 TYR 142 0.935 -7.062 -0.098 943 HE2 TYR 142 HE2 TYR 142 -1.515 -3.556 -0.449 944 HH TYR 142 HH TYR 142 -1.332 -6.897 0.593 945 H THR 143 H THR 143 4.255 -6.844 -3.391 946 HA THR 143 HA THR 143 4.292 -7.508 -6.293 947 HB THR 143 HB THR 143 6.473 -8.116 -4.279 948 HG1 THR 143 HG1 THR 143 6.343 -5.860 -4.512 949 1HG2 THR 143 1HG2 THR 143 6.380 -8.077 -7.334 950 2HG2 THR 143 2HG2 THR 143 7.823 -8.387 -6.348 951 3HG2 THR 143 3HG2 THR 143 6.467 -9.523 -6.305 952 H PHE 144 H PHE 144 2.872 -9.026 -6.532 953 HA PHE 144 HA PHE 144 1.834 -10.516 -4.276 954 1HB PHE 144 1HB PHE 144 1.002 -10.088 -7.155 955 2HB PHE 144 2HB PHE 144 0.201 -11.187 -6.068 956 HD1 PHE 144 HD1 PHE 144 -1.960 -10.123 -6.412 957 HD2 PHE 144 HD2 PHE 144 1.327 -7.956 -4.621 958 HE1 PHE 144 HE1 PHE 144 -3.544 -8.705 -5.209 959 HE2 PHE 144 HE2 PHE 144 -0.303 -6.588 -3.374 960 HZ PHE 144 HZ PHE 144 -2.723 -7.013 -3.591 961 H TYR 145 H TYR 145 3.219 -12.242 -3.729 962 HA TYR 145 HA TYR 145 3.080 -14.546 -5.637 963 1HB TYR 145 1HB TYR 145 5.542 -13.429 -4.298 964 2HB TYR 145 2HB TYR 145 5.434 -15.085 -4.871 965 HD1 TYR 145 HD1 TYR 145 5.247 -15.650 -7.246 966 HD2 TYR 145 HD2 TYR 145 5.507 -11.562 -5.955 967 HE1 TYR 145 HE1 TYR 145 5.949 -14.988 -9.528 968 HE2 TYR 145 HE2 TYR 145 6.173 -10.879 -8.269 969 HH TYR 145 HH TYR 145 6.637 -13.251 -10.890 970 HA PRO 146 HA PRO 146 2.077 -16.731 -1.794 971 1HB PRO 146 1HB PRO 146 -0.553 -16.997 -1.865 972 2HB PRO 146 2HB PRO 146 0.156 -15.433 -1.444 973 1HG PRO 146 1HG PRO 146 -0.919 -16.226 -4.165 974 2HG PRO 146 2HG PRO 146 -1.188 -14.766 -3.186 975 1HD PRO 146 1HD PRO 146 0.811 -15.074 -5.201 976 2HD PRO 146 2HD PRO 146 0.803 -13.804 -3.933 977 H ARG 147 H ARG 147 -0.475 -18.150 -3.389 978 HA ARG 147 HA ARG 147 1.116 -19.913 -5.135 979 1HB ARG 147 1HB ARG 147 -0.907 -20.825 -3.036 980 2HB ARG 147 2HB ARG 147 -0.051 -21.866 -4.173 981 1HG ARG 147 1HG ARG 147 1.201 -20.286 -1.871 982 2HG ARG 147 2HG ARG 147 0.789 -22.001 -1.862 983 1HD ARG 147 1HD ARG 147 2.859 -22.482 -2.637 984 2HD ARG 147 2HD ARG 147 2.371 -21.776 -4.164 985 HE ARG 147 HE ARG 147 3.324 -19.708 -3.647 986 1HH1 ARG 147 1HH1 ARG 147 3.924 -21.984 -1.007 987 2HH1 ARG 147 2HH1 ARG 147 5.004 -20.926 -0.150 988 1HH2 ARG 147 1HH2 ARG 147 4.636 -18.289 -2.530 989 2HH2 ARG 147 2HH2 ARG 147 5.421 -18.747 -1.047 990 H GLU 148 H GLU 148 -0.100 -20.420 -6.961 991 HA GLU 148 HA GLU 148 -2.915 -19.474 -7.106 992 1HB GLU 148 1HB GLU 148 -2.165 -18.242 -8.742 993 2HB GLU 148 2HB GLU 148 -0.621 -19.075 -8.832 994 1HG GLU 148 1HG GLU 148 -1.671 -19.136 -10.957 995 2HG GLU 148 2HG GLU 148 -1.579 -20.779 -10.337 996 HA PRO 149 HA PRO 149 -3.236 -24.006 -7.259 997 1HB PRO 149 1HB PRO 149 -5.898 -24.292 -6.835 998 2HB PRO 149 2HB PRO 149 -4.785 -23.760 -5.539 999 1HG PRO 149 1HG PRO 149 -6.468 -22.005 -7.351 1000 2HG PRO 149 2HG PRO 149 -6.406 -21.962 -5.564 1001 1HD PRO 149 1HD PRO 149 -4.944 -20.290 -7.114 1002 2HD PRO 149 2HD PRO 149 -4.230 -20.976 -5.617 1003 H SER 150 H SER 150 -4.911 -21.674 -9.317 1004 HA SER 150 HA SER 150 -4.797 -22.398 -11.756 1005 1HB SER 150 1HB SER 150 -6.694 -24.479 -10.633 1006 2HB SER 150 2HB SER 150 -6.775 -23.925 -12.307 1007 HG SER 150 HG SER 150 -4.527 -25.075 -11.102 1008 H LYS 151 H LYS 151 -5.552 -20.360 -12.181 1009 HA LYS 151 HA LYS 151 -8.370 -19.648 -11.536 1010 1HB LYS 151 1HB LYS 151 -7.831 -17.434 -12.289 1011 2HB LYS 151 2HB LYS 151 -6.714 -18.005 -11.044 1012 1HG LYS 151 1HG LYS 151 -4.936 -18.285 -12.611 1013 2HG LYS 151 2HG LYS 151 -5.955 -18.091 -14.007 1014 1HD LYS 151 1HD LYS 151 -5.067 -15.924 -12.066 1015 2HD LYS 151 2HD LYS 151 -4.546 -16.223 -13.704 1016 1HE LYS 151 1HE LYS 151 -5.949 -14.487 -14.094 1017 2HE LYS 151 2HE LYS 151 -7.063 -15.832 -14.372 1018 1HZ LYS 151 1HZ LYS 151 -7.947 -14.018 -12.999 1019 2HZ LYS 151 2HZ LYS 151 -8.006 -15.413 -12.192 1020 3HZ LYS 151 3HZ LYS 151 -6.867 -14.302 -11.807 Start of MODEL 26 1 H VAL 21 H VAL 21 -0.417 11.412 13.839 2 HA VAL 21 HA VAL 21 -2.079 9.460 15.207 3 HB VAL 21 HB VAL 21 -1.661 11.267 16.886 4 1HG1 VAL 21 1HG1 VAL 21 -1.519 13.223 15.375 5 2HG1 VAL 21 2HG1 VAL 21 -3.256 13.074 15.026 6 3HG1 VAL 21 3HG1 VAL 21 -2.704 13.456 16.665 7 1HG2 VAL 21 1HG2 VAL 21 -3.785 9.879 16.842 8 2HG2 VAL 21 2HG2 VAL 21 -3.830 11.412 17.728 9 3HG2 VAL 21 3HG2 VAL 21 -4.593 11.309 16.144 10 H GLU 22 H GLU 22 -4.580 10.341 14.480 11 HA GLU 22 HA GLU 22 -4.422 10.173 11.631 12 1HB GLU 22 1HB GLU 22 -6.211 9.157 13.082 13 2HB GLU 22 2HB GLU 22 -6.947 10.771 13.175 14 1HG GLU 22 1HG GLU 22 -7.140 10.827 10.710 15 2HG GLU 22 2HG GLU 22 -6.281 9.285 10.577 16 H GLN 23 H GLN 23 -3.212 11.865 11.205 17 HA GLN 23 HA GLN 23 -3.237 13.737 9.751 18 1HB GLN 23 1HB GLN 23 -4.640 15.085 12.132 19 2HB GLN 23 2HB GLN 23 -3.758 16.015 10.967 20 1HG GLN 23 1HG GLN 23 -6.018 14.192 10.066 21 2HG GLN 23 2HG GLN 23 -6.268 15.861 10.578 22 1HE2 GLN 23 1HE2 GLN 23 -3.168 15.569 8.997 23 2HE2 GLN 23 2HE2 GLN 23 -3.720 16.179 7.475 24 H ALA 24 H ALA 24 -1.022 14.241 9.955 25 HA ALA 24 HA ALA 24 -0.276 12.351 11.658 26 1HB ALA 24 1HB ALA 24 1.697 14.295 10.439 27 2HB ALA 24 2HB ALA 24 2.010 12.630 10.949 28 3HB ALA 24 3HB ALA 24 0.867 12.928 9.616 29 H SER 25 H SER 25 0.869 15.704 12.042 30 HA SER 25 HA SER 25 -0.248 16.166 14.264 31 1HB SER 25 1HB SER 25 0.921 14.681 15.730 32 2HB SER 25 2HB SER 25 2.481 15.030 14.988 33 HG SER 25 HG SER 25 1.129 16.942 16.649 34 H ASP 26 H ASP 26 1.830 17.870 15.441 35 HA ASP 26 HA ASP 26 1.411 20.214 13.880 36 1HB ASP 26 1HB ASP 26 3.162 19.628 16.314 37 2HB ASP 26 2HB ASP 26 2.527 21.211 15.833 38 H LEU 27 H LEU 27 2.762 18.290 12.403 39 HA LEU 27 HA LEU 27 5.653 18.936 12.259 40 1HB LEU 27 1HB LEU 27 4.204 16.649 10.916 41 2HB LEU 27 2HB LEU 27 5.903 16.761 11.388 42 HG LEU 27 HG LEU 27 3.613 16.422 13.357 43 1HD1 LEU 27 1HD1 LEU 27 3.813 14.548 11.738 44 2HD1 LEU 27 2HD1 LEU 27 5.513 14.373 12.200 45 3HD1 LEU 27 3HD1 LEU 27 4.226 14.075 13.381 46 1HD2 LEU 27 1HD2 LEU 27 6.632 16.108 13.668 47 2HD2 LEU 27 2HD2 LEU 27 5.658 17.438 14.336 48 3HD2 LEU 27 3HD2 LEU 27 5.408 15.782 14.914 49 H ILE 28 H ILE 28 2.556 19.166 10.643 50 HA ILE 28 HA ILE 28 3.347 18.799 7.987 51 HB ILE 28 HB ILE 28 0.995 20.293 9.215 52 1HG1 ILE 28 1HG1 ILE 28 1.457 17.452 8.250 53 2HG1 ILE 28 2HG1 ILE 28 1.059 18.034 9.856 54 1HG2 ILE 28 1HG2 ILE 28 1.339 20.972 6.801 55 2HG2 ILE 28 2HG2 ILE 28 1.349 19.239 6.387 56 3HG2 ILE 28 3HG2 ILE 28 -0.112 20.003 7.051 57 1HD1 ILE 28 1HD1 ILE 28 -0.915 17.062 9.051 58 2HD1 ILE 28 2HD1 ILE 28 -1.172 18.814 8.999 59 3HD1 ILE 28 3HD1 ILE 28 -0.819 17.908 7.500 60 H LEU 29 H LEU 29 5.045 19.890 7.115 61 HA LEU 29 HA LEU 29 5.263 22.822 7.330 62 1HB LEU 29 1HB LEU 29 7.030 21.026 5.655 63 2HB LEU 29 2HB LEU 29 7.308 22.678 6.228 64 HG LEU 29 HG LEU 29 8.687 21.642 7.538 65 1HD1 LEU 29 1HD1 LEU 29 7.230 22.961 8.932 66 2HD1 LEU 29 2HD1 LEU 29 6.215 21.553 9.286 67 3HD1 LEU 29 3HD1 LEU 29 7.902 21.581 9.817 68 1HD2 LEU 29 1HD2 LEU 29 6.870 19.235 7.637 69 2HD2 LEU 29 2HD2 LEU 29 8.462 19.409 6.908 70 3HD2 LEU 29 3HD2 LEU 29 8.301 19.426 8.673 71 H ASP 30 H ASP 30 6.404 22.967 4.508 72 HA ASP 30 HA ASP 30 3.984 23.640 3.046 73 1HB ASP 30 1HB ASP 30 5.615 24.821 1.660 74 2HB ASP 30 2HB ASP 30 5.807 25.276 3.360 75 H GLU 31 H GLU 31 6.911 21.638 2.870 76 HA GLU 31 HA GLU 31 6.881 20.772 0.330 77 1HB GLU 31 1HB GLU 31 7.914 19.679 2.881 78 2HB GLU 31 2HB GLU 31 7.667 18.423 1.663 79 1HG GLU 31 1HG GLU 31 9.173 20.988 1.052 80 2HG GLU 31 2HG GLU 31 9.943 19.538 1.699 81 H LYS 32 H LYS 32 6.457 18.852 -0.791 82 HA LYS 32 HA LYS 32 3.817 17.650 -0.200 83 1HB LYS 32 1HB LYS 32 3.720 19.570 -1.841 84 2HB LYS 32 2HB LYS 32 4.872 18.698 -2.885 85 1HG LYS 32 1HG LYS 32 3.369 16.782 -2.926 86 2HG LYS 32 2HG LYS 32 2.266 17.600 -1.805 87 1HD LYS 32 1HD LYS 32 1.281 17.804 -3.975 88 2HD LYS 32 2HD LYS 32 1.878 19.406 -3.529 89 1HE LYS 32 1HE LYS 32 3.700 19.286 -5.071 90 2HE LYS 32 2HE LYS 32 3.633 17.512 -5.140 91 1HZ LYS 32 1HZ LYS 32 1.539 19.220 -6.281 92 2HZ LYS 32 2HZ LYS 32 2.737 18.470 -7.126 93 3HZ LYS 32 3HZ LYS 32 1.646 17.567 -6.299 94 H ILE 33 H ILE 33 4.818 15.897 0.594 95 HA ILE 33 HA ILE 33 7.029 14.476 -0.738 96 HB ILE 33 HB ILE 33 6.969 14.938 1.594 97 1HG1 ILE 33 1HG1 ILE 33 8.436 13.244 0.896 98 2HG1 ILE 33 2HG1 ILE 33 7.705 12.877 2.413 99 1HG2 ILE 33 1HG2 ILE 33 4.700 12.986 1.777 100 2HG2 ILE 33 2HG2 ILE 33 5.612 13.670 3.144 101 3HG2 ILE 33 3HG2 ILE 33 4.641 14.730 2.128 102 1HD1 ILE 33 1HD1 ILE 33 7.171 11.526 -0.234 103 2HD1 ILE 33 2HD1 ILE 33 7.815 10.826 1.245 104 3HD1 ILE 33 3HD1 ILE 33 6.104 11.290 1.167 105 H LYS 34 H LYS 34 6.693 12.647 -2.100 106 HA LYS 34 HA LYS 34 3.910 12.263 -3.027 107 1HB LYS 34 1HB LYS 34 6.147 13.038 -4.271 108 2HB LYS 34 2HB LYS 34 6.356 11.299 -4.431 109 1HG LYS 34 1HG LYS 34 3.754 12.699 -5.151 110 2HG LYS 34 2HG LYS 34 5.120 12.651 -6.295 111 1HD LYS 34 1HD LYS 34 5.104 10.222 -6.221 112 2HD LYS 34 2HD LYS 34 3.834 10.226 -5.092 113 1HE LYS 34 1HE LYS 34 3.383 10.132 -7.758 114 2HE LYS 34 2HE LYS 34 2.231 10.479 -6.409 115 1HZ LYS 34 1HZ LYS 34 1.882 11.796 -8.086 116 2HZ LYS 34 2HZ LYS 34 2.322 12.720 -6.779 117 3HZ LYS 34 3HZ LYS 34 3.366 12.537 -8.065 118 H VAL 35 H VAL 35 3.040 10.001 -3.415 119 HA VAL 35 HA VAL 35 4.658 7.861 -2.165 120 HB VAL 35 HB VAL 35 1.730 8.567 -1.800 121 1HG1 VAL 35 1HG1 VAL 35 1.945 6.124 -2.065 122 2HG1 VAL 35 2HG1 VAL 35 3.131 6.089 -0.746 123 3HG1 VAL 35 3HG1 VAL 35 1.463 6.575 -0.432 124 1HG2 VAL 35 1HG2 VAL 35 3.944 8.369 0.257 125 2HG2 VAL 35 2HG2 VAL 35 3.176 9.867 -0.304 126 3HG2 VAL 35 3HG2 VAL 35 2.224 8.706 0.598 127 H THR 36 H THR 36 4.750 6.150 -3.537 128 HA THR 36 HA THR 36 2.857 6.174 -5.845 129 HB THR 36 HB THR 36 5.578 4.860 -5.874 130 HG1 THR 36 HG1 THR 36 6.140 6.697 -7.157 131 1HG2 THR 36 1HG2 THR 36 5.198 4.850 -8.298 132 2HG2 THR 36 2HG2 THR 36 3.887 3.994 -7.467 133 3HG2 THR 36 3HG2 THR 36 3.625 5.643 -8.072 134 H PHE 37 H PHE 37 1.350 4.775 -5.560 135 HA PHE 37 HA PHE 37 1.627 2.553 -3.608 136 1HB PHE 37 1HB PHE 37 -0.653 3.615 -5.329 137 2HB PHE 37 2HB PHE 37 -0.765 2.216 -4.306 138 HD1 PHE 37 HD1 PHE 37 -2.048 5.249 -4.368 139 HD2 PHE 37 HD2 PHE 37 0.472 2.911 -1.754 140 HE1 PHE 37 HE1 PHE 37 -2.780 6.577 -2.417 141 HE2 PHE 37 HE2 PHE 37 -0.096 4.402 0.130 142 HZ PHE 37 HZ PHE 37 -1.650 6.318 -0.235 143 H ASP 38 H ASP 38 3.206 1.243 -4.702 144 HA ASP 38 HA ASP 38 2.632 0.585 -7.504 145 1HB ASP 38 1HB ASP 38 4.845 1.296 -6.995 146 2HB ASP 38 2HB ASP 38 5.038 0.067 -5.761 147 H ALA 39 H ALA 39 0.690 -0.540 -7.119 148 HA ALA 39 HA ALA 39 0.826 -3.114 -5.661 149 1HB ALA 39 1HB ALA 39 -1.117 -1.638 -5.386 150 2HB ALA 39 2HB ALA 39 -1.466 -1.771 -7.122 151 3HB ALA 39 3HB ALA 39 -1.572 -3.208 -6.086 152 H ASN 40 H ASN 40 1.900 -4.682 -6.805 153 HA ASN 40 HA ASN 40 1.453 -4.925 -9.744 154 1HB ASN 40 1HB ASN 40 3.569 -6.299 -8.094 155 2HB ASN 40 2HB ASN 40 3.465 -6.162 -9.839 156 1HD2 ASN 40 1HD2 ASN 40 4.075 -4.349 -6.802 157 2HD2 ASN 40 2HD2 ASN 40 5.002 -3.061 -7.577 158 H VAL 41 H VAL 41 -0.064 -6.366 -10.262 159 HA VAL 41 HA VAL 41 -0.576 -8.720 -8.532 160 HB VAL 41 HB VAL 41 -2.480 -7.332 -8.846 161 1HG1 VAL 41 1HG1 VAL 41 -3.644 -7.033 -10.915 162 2HG1 VAL 41 2HG1 VAL 41 -2.011 -6.382 -11.108 163 3HG1 VAL 41 3HG1 VAL 41 -2.439 -7.954 -11.824 164 1HG2 VAL 41 1HG2 VAL 41 -2.732 -9.766 -8.541 165 2HG2 VAL 41 2HG2 VAL 41 -4.042 -9.083 -9.517 166 3HG2 VAL 41 3HG2 VAL 41 -2.739 -9.995 -10.302 167 H ALA 42 H ALA 42 0.672 -10.439 -9.047 168 HA ALA 42 HA ALA 42 1.159 -11.028 -11.927 169 1HB ALA 42 1HB ALA 42 2.627 -12.770 -11.148 170 2HB ALA 42 2HB ALA 42 3.084 -11.247 -10.356 171 3HB ALA 42 3HB ALA 42 2.174 -12.486 -9.461 172 H ALA 43 H ALA 43 0.433 -13.073 -12.714 173 HA ALA 43 HA ALA 43 -2.185 -13.787 -12.310 174 1HB ALA 43 1HB ALA 43 -0.762 -14.496 -14.214 175 2HB ALA 43 2HB ALA 43 0.112 -15.617 -13.145 176 3HB ALA 43 3HB ALA 43 -1.605 -15.876 -13.494 177 H GLY 44 H GLY 44 0.636 -15.053 -10.660 178 1HA GLY 44 1HA GLY 44 -0.148 -17.111 -9.077 179 2HA GLY 44 2HA GLY 44 0.923 -15.816 -8.530 180 H LEU 45 H LEU 45 -1.208 -13.666 -8.536 181 HA LEU 45 HA LEU 45 -3.013 -14.752 -6.430 182 1HB LEU 45 1HB LEU 45 -1.229 -12.787 -6.089 183 2HB LEU 45 2HB LEU 45 -2.608 -11.822 -6.593 184 HG LEU 45 HG LEU 45 -2.803 -13.978 -4.390 185 1HD1 LEU 45 1HD1 LEU 45 -2.409 -10.972 -4.086 186 2HD1 LEU 45 2HD1 LEU 45 -2.590 -12.131 -2.778 187 3HD1 LEU 45 3HD1 LEU 45 -1.129 -12.180 -3.789 188 1HD2 LEU 45 1HD2 LEU 45 -4.888 -13.248 -5.475 189 2HD2 LEU 45 2HD2 LEU 45 -4.713 -12.813 -3.759 190 3HD2 LEU 45 3HD2 LEU 45 -4.486 -11.564 -5.019 191 HA PRO 46 HA PRO 46 -5.377 -14.026 -10.243 192 1HB PRO 46 1HB PRO 46 -7.198 -16.007 -10.022 193 2HB PRO 46 2HB PRO 46 -5.454 -16.386 -10.154 194 1HG PRO 46 1HG PRO 46 -7.078 -16.191 -7.607 195 2HG PRO 46 2HG PRO 46 -6.047 -17.557 -8.140 196 1HD PRO 46 1HD PRO 46 -5.152 -15.559 -6.478 197 2HD PRO 46 2HD PRO 46 -4.076 -16.379 -7.655 198 H TRP 47 H TRP 47 -5.750 -12.083 -8.304 199 HA TRP 47 HA TRP 47 -8.691 -11.956 -7.735 200 1HB TRP 47 1HB TRP 47 -6.349 -10.940 -6.130 201 2HB TRP 47 2HB TRP 47 -8.025 -10.541 -5.818 202 HD1 TRP 47 HD1 TRP 47 -8.026 -14.127 -6.646 203 HE1 TRP 47 HE1 TRP 47 -8.215 -15.548 -4.565 204 HE3 TRP 47 HE3 TRP 47 -6.548 -10.709 -3.126 205 HZ2 TRP 47 HZ2 TRP 47 -7.718 -15.361 -1.816 206 HZ3 TRP 47 HZ3 TRP 47 -5.684 -11.797 -1.066 207 HH2 TRP 47 HH2 TRP 47 -6.601 -13.839 -0.185 208 H GLU 48 H GLU 48 -9.680 -9.942 -8.164 209 HA GLU 48 HA GLU 48 -8.332 -8.231 -10.164 210 1HB GLU 48 1HB GLU 48 -10.785 -8.777 -10.260 211 2HB GLU 48 2HB GLU 48 -10.991 -7.920 -8.724 212 1HG GLU 48 1HG GLU 48 -10.075 -5.835 -9.905 213 2HG GLU 48 2HG GLU 48 -10.220 -6.743 -11.419 214 H PHE 49 H PHE 49 -6.556 -7.774 -8.776 215 HA PHE 49 HA PHE 49 -7.034 -6.108 -6.390 216 1HB PHE 49 1HB PHE 49 -5.476 -8.288 -6.745 217 2HB PHE 49 2HB PHE 49 -4.287 -7.043 -7.084 218 HD1 PHE 49 HD1 PHE 49 -4.569 -9.155 -4.736 219 HD2 PHE 49 HD2 PHE 49 -5.321 -4.910 -5.054 220 HE1 PHE 49 HE1 PHE 49 -4.299 -8.906 -2.286 221 HE2 PHE 49 HE2 PHE 49 -5.131 -4.698 -2.614 222 HZ PHE 49 HZ PHE 49 -4.607 -6.688 -1.217 223 H VAL 50 H VAL 50 -6.881 -3.898 -6.628 224 HA VAL 50 HA VAL 50 -5.112 -2.871 -8.814 225 HB VAL 50 HB VAL 50 -6.762 -1.347 -9.558 226 1HG1 VAL 50 1HG1 VAL 50 -8.250 -3.970 -9.124 227 2HG1 VAL 50 2HG1 VAL 50 -8.492 -2.786 -10.416 228 3HG1 VAL 50 3HG1 VAL 50 -6.988 -3.722 -10.357 229 1HG2 VAL 50 1HG2 VAL 50 -9.089 -1.318 -8.559 230 2HG2 VAL 50 2HG2 VAL 50 -8.416 -2.225 -7.187 231 3HG2 VAL 50 3HG2 VAL 50 -7.839 -0.593 -7.543 232 HA PRO 51 HA PRO 51 -3.961 0.168 -5.645 233 1HB PRO 51 1HB PRO 51 -2.745 2.051 -7.181 234 2HB PRO 51 2HB PRO 51 -1.982 0.468 -6.906 235 1HG PRO 51 1HG PRO 51 -3.628 1.355 -9.290 236 2HG PRO 51 2HG PRO 51 -2.049 0.517 -9.307 237 1HD PRO 51 1HD PRO 51 -4.468 -0.765 -9.594 238 2HD PRO 51 2HD PRO 51 -3.066 -1.559 -8.827 239 H VAL 52 H VAL 52 -4.665 2.412 -5.164 240 HA VAL 52 HA VAL 52 -7.412 2.738 -6.053 241 HB VAL 52 HB VAL 52 -5.915 4.713 -4.278 242 1HG1 VAL 52 1HG1 VAL 52 -8.197 4.808 -3.226 243 2HG1 VAL 52 2HG1 VAL 52 -8.184 5.306 -4.926 244 3HG1 VAL 52 3HG1 VAL 52 -8.787 3.706 -4.478 245 1HG2 VAL 52 1HG2 VAL 52 -5.232 2.706 -3.256 246 2HG2 VAL 52 2HG2 VAL 52 -6.669 3.193 -2.365 247 3HG2 VAL 52 3HG2 VAL 52 -6.779 1.911 -3.589 248 H GLN 53 H GLN 53 -4.551 4.791 -5.989 249 HA GLN 53 HA GLN 53 -4.976 5.662 -8.753 250 1HB GLN 53 1HB GLN 53 -4.003 7.423 -6.433 251 2HB GLN 53 2HB GLN 53 -3.750 7.787 -8.121 252 1HG GLN 53 1HG GLN 53 -5.588 9.096 -7.531 253 2HG GLN 53 2HG GLN 53 -6.219 7.781 -8.529 254 1HE2 GLN 53 1HE2 GLN 53 -5.341 7.941 -5.000 255 2HE2 GLN 53 2HE2 GLN 53 -6.951 7.508 -4.475 256 H ARG 54 H ARG 54 -2.743 5.872 -9.691 257 HA ARG 54 HA ARG 54 -1.026 3.760 -8.923 258 1HB ARG 54 1HB ARG 54 -1.000 4.777 -11.154 259 2HB ARG 54 2HB ARG 54 -0.477 6.314 -10.498 260 1HG ARG 54 1HG ARG 54 1.389 5.176 -11.542 261 2HG ARG 54 2HG ARG 54 1.688 5.389 -9.821 262 1HD ARG 54 1HD ARG 54 1.061 3.097 -9.433 263 2HD ARG 54 2HD ARG 54 0.698 2.930 -11.168 264 HE ARG 54 HE ARG 54 3.351 3.835 -10.965 265 1HH1 ARG 54 1HH1 ARG 54 1.593 0.870 -9.993 266 2HH1 ARG 54 2HH1 ARG 54 3.120 0.039 -9.630 267 1HH2 ARG 54 1HH2 ARG 54 5.310 2.509 -10.537 268 2HH2 ARG 54 2HH2 ARG 54 5.005 0.889 -9.896 269 H ASP 55 H ASP 55 -0.996 7.269 -8.105 270 HA ASP 55 HA ASP 55 0.854 6.904 -5.925 271 1HB ASP 55 1HB ASP 55 2.177 8.569 -6.997 272 2HB ASP 55 2HB ASP 55 1.943 7.425 -8.234 273 H ILE 56 H ILE 56 0.907 8.979 -4.700 274 HA ILE 56 HA ILE 56 -1.323 10.810 -5.109 275 HB ILE 56 HB ILE 56 -2.034 10.910 -2.828 276 1HG1 ILE 56 1HG1 ILE 56 -0.343 8.443 -2.484 277 2HG1 ILE 56 2HG1 ILE 56 0.089 10.050 -1.857 278 1HG2 ILE 56 1HG2 ILE 56 -2.167 8.089 -3.932 279 2HG2 ILE 56 2HG2 ILE 56 -3.352 8.857 -2.842 280 3HG2 ILE 56 3HG2 ILE 56 -3.179 9.439 -4.503 281 1HD1 ILE 56 1HD1 ILE 56 -1.934 10.068 -0.432 282 2HD1 ILE 56 2HD1 ILE 56 -2.317 8.423 -0.940 283 3HD1 ILE 56 3HD1 ILE 56 -0.830 8.734 -0.033 284 H ASP 57 H ASP 57 -0.967 12.794 -3.801 285 HA ASP 57 HA ASP 57 1.889 13.295 -3.079 286 1HB ASP 57 1HB ASP 57 -0.310 15.225 -3.939 287 2HB ASP 57 2HB ASP 57 1.269 15.662 -3.295 288 H VAL 58 H VAL 58 2.092 13.631 -0.827 289 HA VAL 58 HA VAL 58 -0.415 14.225 0.713 290 HB VAL 58 HB VAL 58 0.261 12.981 2.538 291 1HG1 VAL 58 1HG1 VAL 58 -0.101 10.751 1.662 292 2HG1 VAL 58 2HG1 VAL 58 -0.993 11.902 0.652 293 3HG1 VAL 58 3HG1 VAL 58 0.544 11.216 0.079 294 1HG2 VAL 58 1HG2 VAL 58 2.731 12.170 0.971 295 2HG2 VAL 58 2HG2 VAL 58 2.648 13.068 2.521 296 3HG2 VAL 58 3HG2 VAL 58 2.178 11.368 2.439 297 H ARG 59 H ARG 59 -0.352 16.132 1.677 298 HA ARG 59 HA ARG 59 2.114 17.681 1.749 299 1HB ARG 59 1HB ARG 59 -0.756 18.123 2.630 300 2HB ARG 59 2HB ARG 59 0.479 19.264 3.081 301 1HG ARG 59 1HG ARG 59 0.015 18.316 0.209 302 2HG ARG 59 2HG ARG 59 -0.793 19.725 0.888 303 1HD ARG 59 1HD ARG 59 2.273 19.474 0.726 304 2HD ARG 59 2HD ARG 59 1.300 20.202 -0.468 305 HE ARG 59 HE ARG 59 0.745 21.991 0.985 306 1HH1 ARG 59 1HH1 ARG 59 3.223 19.890 2.481 307 2HH1 ARG 59 2HH1 ARG 59 3.128 20.750 4.006 308 1HH2 ARG 59 1HH2 ARG 59 0.916 23.204 3.007 309 2HH2 ARG 59 2HH2 ARG 59 2.073 22.620 4.196 310 H ILE 60 H ILE 60 3.302 16.087 2.778 311 HA ILE 60 HA ILE 60 4.372 15.098 4.534 312 HB ILE 60 HB ILE 60 3.412 17.520 6.062 313 1HG1 ILE 60 1HG1 ILE 60 4.643 18.263 4.160 314 2HG1 ILE 60 2HG1 ILE 60 5.652 18.356 5.589 315 1HG2 ILE 60 1HG2 ILE 60 5.407 17.049 7.479 316 2HG2 ILE 60 2HG2 ILE 60 4.150 15.829 7.642 317 3HG2 ILE 60 3HG2 ILE 60 5.583 15.477 6.664 318 1HD1 ILE 60 1HD1 ILE 60 7.038 17.589 3.836 319 2HD1 ILE 60 2HD1 ILE 60 6.780 16.195 4.887 320 3HD1 ILE 60 3HD1 ILE 60 5.891 16.340 3.350 321 H GLY 61 H GLY 61 1.910 16.358 6.689 322 1HA GLY 61 1HA GLY 61 1.374 13.580 7.539 323 2HA GLY 61 2HA GLY 61 1.150 15.067 8.489 324 H GLU 62 H GLU 62 0.074 14.749 5.208 325 HA GLU 62 HA GLU 62 -2.669 15.467 5.878 326 1HB GLU 62 1HB GLU 62 -1.322 16.491 4.071 327 2HB GLU 62 2HB GLU 62 -1.285 14.927 3.233 328 1HG GLU 62 1HG GLU 62 -3.747 15.007 2.985 329 2HG GLU 62 2HG GLU 62 -3.795 16.538 3.885 330 H THR 63 H THR 63 -3.621 13.640 6.859 331 HA THR 63 HA THR 63 -3.330 10.944 5.990 332 HB THR 63 HB THR 63 -5.557 10.957 7.498 333 HG1 THR 63 HG1 THR 63 -5.837 13.178 7.391 334 1HG2 THR 63 1HG2 THR 63 -2.785 11.638 8.572 335 2HG2 THR 63 2HG2 THR 63 -4.174 10.936 9.457 336 3HG2 THR 63 3HG2 THR 63 -3.441 10.024 8.170 337 H VAL 64 H VAL 64 -3.682 10.858 3.741 338 HA VAL 64 HA VAL 64 -6.323 11.606 2.645 339 HB VAL 64 HB VAL 64 -4.232 9.845 1.337 340 1HG1 VAL 64 1HG1 VAL 64 -6.426 11.611 0.182 341 2HG1 VAL 64 2HG1 VAL 64 -5.238 10.690 -0.761 342 3HG1 VAL 64 3HG1 VAL 64 -6.420 9.835 0.225 343 1HG2 VAL 64 1HG2 VAL 64 -3.051 11.886 1.875 344 2HG2 VAL 64 2HG2 VAL 64 -3.450 11.903 0.155 345 3HG2 VAL 64 3HG2 VAL 64 -4.405 12.885 1.290 346 H GLN 65 H GLN 65 -7.948 10.142 2.251 347 HA GLN 65 HA GLN 65 -7.767 7.345 3.296 348 1HB GLN 65 1HB GLN 65 -9.645 8.822 4.019 349 2HB GLN 65 2HB GLN 65 -10.215 8.915 2.359 350 1HG GLN 65 1HG GLN 65 -9.831 6.325 3.962 351 2HG GLN 65 2HG GLN 65 -11.339 7.232 3.905 352 1HE2 GLN 65 1HE2 GLN 65 -10.523 7.659 0.749 353 2HE2 GLN 65 2HE2 GLN 65 -11.311 6.216 0.147 354 H ILE 66 H ILE 66 -7.233 5.849 1.871 355 HA ILE 66 HA ILE 66 -8.069 6.154 -0.942 356 HB ILE 66 HB ILE 66 -5.553 4.975 -1.178 357 1HG1 ILE 66 1HG1 ILE 66 -4.022 6.808 -0.378 358 2HG1 ILE 66 2HG1 ILE 66 -5.273 7.413 0.682 359 1HG2 ILE 66 1HG2 ILE 66 -6.721 6.505 -2.712 360 2HG2 ILE 66 2HG2 ILE 66 -6.362 7.867 -1.628 361 3HG2 ILE 66 3HG2 ILE 66 -5.048 6.992 -2.444 362 1HD1 ILE 66 1HD1 ILE 66 -5.290 5.058 1.726 363 2HD1 ILE 66 2HD1 ILE 66 -3.886 4.685 0.716 364 3HD1 ILE 66 3HD1 ILE 66 -3.797 5.975 1.938 365 H MET 67 H MET 67 -9.515 4.690 -1.017 366 HA MET 67 HA MET 67 -9.414 2.191 0.437 367 1HB MET 67 1HB MET 67 -11.481 3.483 0.039 368 2HB MET 67 2HB MET 67 -11.363 3.143 -1.696 369 1HG MET 67 1HG MET 67 -11.506 0.695 -1.197 370 2HG MET 67 2HG MET 67 -11.672 1.074 0.520 371 1HE MET 67 1HE MET 67 -13.769 2.250 1.580 372 2HE MET 67 2HE MET 67 -13.724 3.614 0.431 373 3HE MET 67 3HE MET 67 -15.225 2.694 0.659 374 H TYR 68 H TYR 68 -8.478 0.336 -0.155 375 HA TYR 68 HA TYR 68 -7.585 -0.065 -2.978 376 1HB TYR 68 1HB TYR 68 -6.780 -1.182 -0.296 377 2HB TYR 68 2HB TYR 68 -6.585 -2.173 -1.728 378 HD1 TYR 68 HD1 TYR 68 -5.541 1.091 -0.226 379 HD2 TYR 68 HD2 TYR 68 -4.897 -1.792 -3.363 380 HE1 TYR 68 HE1 TYR 68 -3.227 1.944 -0.543 381 HE2 TYR 68 HE2 TYR 68 -2.629 -0.902 -3.722 382 HH TYR 68 HH TYR 68 -0.940 0.321 -2.772 383 H ARG 69 H ARG 69 -8.028 -2.023 -4.048 384 HA ARG 69 HA ARG 69 -10.432 -3.495 -3.104 385 1HB ARG 69 1HB ARG 69 -10.671 -1.778 -5.162 386 2HB ARG 69 2HB ARG 69 -9.942 -3.140 -6.038 387 1HG ARG 69 1HG ARG 69 -11.773 -4.571 -4.754 388 2HG ARG 69 2HG ARG 69 -12.531 -2.971 -4.585 389 1HD ARG 69 1HD ARG 69 -12.252 -2.781 -7.149 390 2HD ARG 69 2HD ARG 69 -11.889 -4.524 -7.134 391 HE ARG 69 HE ARG 69 -14.240 -4.035 -5.576 392 1HH1 ARG 69 1HH1 ARG 69 -13.490 -4.238 -9.027 393 2HH1 ARG 69 2HH1 ARG 69 -15.011 -3.536 -9.510 394 1HH2 ARG 69 1HH2 ARG 69 -16.147 -3.477 -6.091 395 2HH2 ARG 69 2HH2 ARG 69 -16.743 -3.282 -7.744 396 H ALA 70 H ALA 70 -10.163 -5.615 -3.066 397 HA ALA 70 HA ALA 70 -8.682 -6.986 -5.182 398 1HB ALA 70 1HB ALA 70 -7.925 -8.716 -3.640 399 2HB ALA 70 2HB ALA 70 -7.245 -7.143 -3.186 400 3HB ALA 70 3HB ALA 70 -8.585 -7.814 -2.259 401 H LYS 71 H LYS 71 -9.896 -8.961 -5.792 402 HA LYS 71 HA LYS 71 -12.191 -9.799 -4.221 403 1HB LYS 71 1HB LYS 71 -13.364 -8.227 -5.506 404 2HB LYS 71 2HB LYS 71 -12.162 -8.242 -6.806 405 1HG LYS 71 1HG LYS 71 -12.955 -10.426 -7.619 406 2HG LYS 71 2HG LYS 71 -13.988 -10.536 -6.191 407 1HD LYS 71 1HD LYS 71 -15.295 -9.865 -8.150 408 2HD LYS 71 2HD LYS 71 -15.192 -8.479 -7.022 409 1HE LYS 71 1HE LYS 71 -13.492 -7.397 -8.345 410 2HE LYS 71 2HE LYS 71 -13.191 -8.862 -9.299 411 1HZ LYS 71 1HZ LYS 71 -14.283 -7.309 -10.535 412 2HZ LYS 71 2HZ LYS 71 -15.329 -8.559 -10.321 413 3HZ LYS 71 3HZ LYS 71 -15.548 -7.138 -9.483 414 H ASN 72 H ASN 72 -12.367 -12.091 -4.617 415 HA ASN 72 HA ASN 72 -10.090 -13.144 -6.092 416 1HB ASN 72 1HB ASN 72 -10.603 -14.051 -3.909 417 2HB ASN 72 2HB ASN 72 -12.198 -14.590 -4.481 418 1HD2 ASN 72 1HD2 ASN 72 -10.824 -16.675 -3.443 419 2HD2 ASN 72 2HD2 ASN 72 -9.829 -17.527 -4.620 420 H LEU 73 H LEU 73 -10.001 -13.939 -8.108 421 HA LEU 73 HA LEU 73 -12.559 -14.234 -9.600 422 1HB LEU 73 1HB LEU 73 -10.368 -12.521 -10.013 423 2HB LEU 73 2HB LEU 73 -10.054 -13.846 -11.116 424 HG LEU 73 HG LEU 73 -11.209 -12.043 -12.206 425 1HD1 LEU 73 1HD1 LEU 73 -11.762 -14.326 -12.966 426 2HD1 LEU 73 2HD1 LEU 73 -13.178 -14.344 -11.891 427 3HD1 LEU 73 3HD1 LEU 73 -13.091 -13.184 -13.226 428 1HD2 LEU 73 1HD2 LEU 73 -12.326 -11.080 -10.211 429 2HD2 LEU 73 2HD2 LEU 73 -13.396 -11.223 -11.617 430 3HD2 LEU 73 3HD2 LEU 73 -13.546 -12.369 -10.277 431 H ALA 74 H ALA 74 -10.427 -16.219 -8.087 432 HA ALA 74 HA ALA 74 -9.960 -18.112 -10.277 433 1HB ALA 74 1HB ALA 74 -8.331 -17.936 -8.501 434 2HB ALA 74 2HB ALA 74 -9.551 -18.316 -7.268 435 3HB ALA 74 3HB ALA 74 -9.058 -19.546 -8.450 436 H SER 75 H SER 75 -10.686 -20.381 -10.039 437 HA SER 75 HA SER 75 -13.592 -20.507 -9.597 438 1HB SER 75 1HB SER 75 -11.678 -22.650 -10.597 439 2HB SER 75 2HB SER 75 -13.449 -22.639 -10.720 440 HG SER 75 HG SER 75 -12.382 -21.906 -12.649 441 H THR 76 H THR 76 -10.892 -21.027 -7.624 442 HA THR 76 HA THR 76 -12.378 -22.594 -5.660 443 HB THR 76 HB THR 76 -9.878 -23.751 -5.436 444 HG1 THR 76 HG1 THR 76 -10.294 -23.482 -8.212 445 1HG2 THR 76 1HG2 THR 76 -10.798 -25.728 -6.592 446 2HG2 THR 76 2HG2 THR 76 -12.035 -24.988 -5.558 447 3HG2 THR 76 3HG2 THR 76 -12.080 -24.729 -7.313 448 HA PRO 77 HA PRO 77 -10.823 -19.616 -3.034 449 1HB PRO 77 1HB PRO 77 -9.435 -20.915 -0.932 450 2HB PRO 77 2HB PRO 77 -11.202 -20.801 -1.043 451 1HG PRO 77 1HG PRO 77 -9.457 -23.066 -1.985 452 2HG PRO 77 2HG PRO 77 -10.966 -23.152 -1.023 453 1HD PRO 77 1HD PRO 77 -11.072 -23.606 -3.636 454 2HD PRO 77 2HD PRO 77 -12.290 -22.529 -2.927 455 H THR 78 H THR 78 -8.905 -18.343 -2.416 456 HA THR 78 HA THR 78 -6.301 -19.588 -3.037 457 HB THR 78 HB THR 78 -6.044 -16.739 -3.472 458 HG1 THR 78 HG1 THR 78 -6.968 -16.673 -5.487 459 1HG2 THR 78 1HG2 THR 78 -5.707 -19.033 -5.421 460 2HG2 THR 78 2HG2 THR 78 -4.856 -17.473 -5.414 461 3HG2 THR 78 3HG2 THR 78 -4.525 -18.643 -4.144 462 H THR 79 H THR 79 -4.545 -18.269 -2.153 463 HA THR 79 HA THR 79 -5.034 -17.202 0.531 464 HB THR 79 HB THR 79 -3.714 -19.254 0.718 465 HG1 THR 79 HG1 THR 79 -1.892 -18.283 1.658 466 1HG2 THR 79 1HG2 THR 79 -1.843 -18.055 -1.355 467 2HG2 THR 79 2HG2 THR 79 -1.518 -19.496 -0.377 468 3HG2 THR 79 3HG2 THR 79 -2.840 -19.513 -1.553 469 H GLY 80 H GLY 80 -3.576 -15.330 0.792 470 1HA GLY 80 1HA GLY 80 -2.497 -14.006 -1.578 471 2HA GLY 80 2HA GLY 80 -4.021 -13.334 -0.983 472 H GLN 81 H GLN 81 -0.886 -14.480 0.068 473 HA GLN 81 HA GLN 81 -0.732 -12.536 2.331 474 1HB GLN 81 1HB GLN 81 1.419 -14.080 2.690 475 2HB GLN 81 2HB GLN 81 -0.172 -14.471 3.341 476 1HG GLN 81 1HG GLN 81 -0.673 -16.010 1.566 477 2HG GLN 81 2HG GLN 81 0.822 -15.647 0.699 478 1HE2 GLN 81 1HE2 GLN 81 2.740 -15.695 2.717 479 2HE2 GLN 81 2HE2 GLN 81 2.770 -17.305 3.416 480 H ALA 82 H ALA 82 1.393 -13.936 -0.217 481 HA ALA 82 HA ALA 82 2.943 -13.012 -1.559 482 1HB ALA 82 1HB ALA 82 2.627 -10.795 -2.428 483 2HB ALA 82 2HB ALA 82 1.038 -11.561 -2.220 484 3HB ALA 82 3HB ALA 82 1.597 -10.321 -1.077 485 H THR 83 H THR 83 4.589 -10.894 -1.615 486 HA THR 83 HA THR 83 5.437 -10.212 1.098 487 HB THR 83 HB THR 83 7.480 -11.168 -0.844 488 HG1 THR 83 HG1 THR 83 5.857 -12.718 0.463 489 1HG2 THR 83 1HG2 THR 83 7.567 -10.614 2.152 490 2HG2 THR 83 2HG2 THR 83 8.933 -11.164 1.164 491 3HG2 THR 83 3HG2 THR 83 8.246 -9.549 0.897 492 H PHE 84 H PHE 84 6.031 -8.096 1.127 493 HA PHE 84 HA PHE 84 5.864 -6.521 -1.414 494 1HB PHE 84 1HB PHE 84 5.035 -4.771 0.252 495 2HB PHE 84 2HB PHE 84 3.955 -6.105 -0.099 496 HD1 PHE 84 HD1 PHE 84 6.600 -5.145 2.447 497 HD2 PHE 84 HD2 PHE 84 2.975 -7.350 1.651 498 HE1 PHE 84 HE1 PHE 84 6.415 -5.723 4.836 499 HE2 PHE 84 HE2 PHE 84 2.769 -7.876 4.040 500 HZ PHE 84 HZ PHE 84 4.494 -7.079 5.651 501 H ASN 85 H ASN 85 6.931 -4.400 -1.208 502 HA ASN 85 HA ASN 85 9.123 -4.198 0.798 503 1HB ASN 85 1HB ASN 85 10.461 -4.766 -0.951 504 2HB ASN 85 2HB ASN 85 9.422 -4.100 -2.188 505 1HD2 ASN 85 1HD2 ASN 85 9.420 -1.772 -2.539 506 2HD2 ASN 85 2HD2 ASN 85 10.700 -0.732 -1.928 507 H VAL 86 H VAL 86 8.314 -2.698 2.062 508 HA VAL 86 HA VAL 86 6.716 -0.406 1.102 509 HB VAL 86 HB VAL 86 7.579 -1.216 3.906 510 1HG1 VAL 86 1HG1 VAL 86 6.845 1.139 3.785 511 2HG1 VAL 86 2HG1 VAL 86 5.394 0.657 2.888 512 3HG1 VAL 86 3HG1 VAL 86 5.599 0.177 4.582 513 1HG2 VAL 86 1HG2 VAL 86 6.035 -2.936 2.699 514 2HG2 VAL 86 2HG2 VAL 86 5.612 -2.351 4.310 515 3HG2 VAL 86 3HG2 VAL 86 4.778 -1.699 2.906 516 H THR 87 H THR 87 8.622 0.600 -0.168 517 HA THR 87 HA THR 87 9.792 2.637 1.072 518 HB THR 87 HB THR 87 11.149 1.217 2.464 519 HG1 THR 87 HG1 THR 87 13.235 2.012 1.841 520 1HG2 THR 87 1HG2 THR 87 11.279 -0.741 1.092 521 2HG2 THR 87 2HG2 THR 87 12.345 0.090 -0.067 522 3HG2 THR 87 3HG2 THR 87 12.901 -0.231 1.590 523 HA PRO 88 HA PRO 88 11.227 3.106 -3.204 524 1HB PRO 88 1HB PRO 88 12.872 5.334 -2.822 525 2HB PRO 88 2HB PRO 88 11.131 5.409 -3.142 526 1HG PRO 88 1HG PRO 88 12.550 5.797 -0.547 527 2HG PRO 88 2HG PRO 88 11.019 6.488 -1.093 528 1HD PRO 88 1HD PRO 88 11.277 4.344 0.673 529 2HD PRO 88 2HD PRO 88 9.804 4.702 -0.240 530 H MET 89 H MET 89 13.171 3.162 -0.278 531 HA MET 89 HA MET 89 14.750 1.091 -0.634 532 1HB MET 89 1HB MET 89 17.019 1.944 -1.310 533 2HB MET 89 2HB MET 89 15.863 1.702 -2.591 534 1HG MET 89 1HG MET 89 15.435 4.317 -2.367 535 2HG MET 89 2HG MET 89 16.982 4.281 -1.509 536 1HE MET 89 1HE MET 89 16.495 3.369 -5.991 537 2HE MET 89 2HE MET 89 15.851 2.236 -4.787 538 3HE MET 89 3HE MET 89 15.164 3.872 -4.925 539 H ALA 90 H ALA 90 15.797 4.451 -0.014 540 HA ALA 90 HA ALA 90 17.256 3.694 2.283 541 1HB ALA 90 1HB ALA 90 17.822 5.586 0.792 542 2HB ALA 90 2HB ALA 90 16.383 6.461 1.358 543 3HB ALA 90 3HB ALA 90 17.708 6.098 2.487 544 H ALA 91 H ALA 91 14.000 5.080 1.967 545 HA ALA 91 HA ALA 91 13.874 5.769 4.823 546 1HB ALA 91 1HB ALA 91 12.872 7.300 3.262 547 2HB ALA 91 2HB ALA 91 11.844 6.026 2.583 548 3HB ALA 91 3HB ALA 91 11.603 6.566 4.266 549 H GLY 92 H GLY 92 10.952 4.459 3.530 550 1HA GLY 92 1HA GLY 92 9.717 2.646 4.104 551 2HA GLY 92 2HA GLY 92 11.195 1.808 4.608 552 H ALA 93 H ALA 93 12.146 3.104 6.730 553 HA ALA 93 HA ALA 93 10.689 2.331 8.915 554 1HB ALA 93 1HB ALA 93 12.101 3.881 10.230 555 2HB ALA 93 2HB ALA 93 13.041 3.008 9.004 556 3HB ALA 93 3HB ALA 93 12.594 4.705 8.737 557 H TYR 94 H TYR 94 10.765 5.656 7.614 558 HA TYR 94 HA TYR 94 8.783 6.708 9.369 559 1HB TYR 94 1HB TYR 94 9.722 7.840 6.725 560 2HB TYR 94 2HB TYR 94 9.134 8.724 8.130 561 HD1 TYR 94 HD1 TYR 94 10.562 8.206 10.394 562 HD2 TYR 94 HD2 TYR 94 12.059 7.645 6.396 563 HE1 TYR 94 HE1 TYR 94 12.887 8.502 11.214 564 HE2 TYR 94 HE2 TYR 94 14.374 7.992 7.212 565 HH TYR 94 HH TYR 94 15.710 8.430 9.025 566 H PHE 95 H PHE 95 8.314 4.587 6.758 567 HA PHE 95 HA PHE 95 6.097 5.894 5.484 568 1HB PHE 95 1HB PHE 95 7.486 3.974 4.500 569 2HB PHE 95 2HB PHE 95 6.722 2.902 5.665 570 HD1 PHE 95 HD1 PHE 95 4.140 2.616 5.586 571 HD2 PHE 95 HD2 PHE 95 6.515 4.190 2.343 572 HE1 PHE 95 HE1 PHE 95 2.306 2.143 3.998 573 HE2 PHE 95 HE2 PHE 95 4.642 3.783 0.784 574 HZ PHE 95 HZ PHE 95 2.505 2.841 1.621 575 H ASN 96 H ASN 96 4.163 6.248 6.416 576 HA ASN 96 HA ASN 96 3.915 5.328 9.086 577 1HB ASN 96 1HB ASN 96 2.700 7.438 7.422 578 2HB ASN 96 2HB ASN 96 1.588 6.759 8.606 579 1HD2 ASN 96 1HD2 ASN 96 5.205 7.608 8.651 580 2HD2 ASN 96 2HD2 ASN 96 4.986 8.448 10.199 581 H LYS 97 H LYS 97 3.822 3.097 8.628 582 HA LYS 97 HA LYS 97 1.743 1.668 7.388 583 1HB LYS 97 1HB LYS 97 3.419 0.986 9.833 584 2HB LYS 97 2HB LYS 97 2.437 -0.193 8.951 585 1HG LYS 97 1HG LYS 97 3.777 -0.011 6.972 586 2HG LYS 97 2HG LYS 97 4.588 1.444 7.560 587 1HD LYS 97 1HD LYS 97 5.581 0.161 9.432 588 2HD LYS 97 2HD LYS 97 4.901 -1.331 8.742 589 1HE LYS 97 1HE LYS 97 6.206 -0.986 6.667 590 2HE LYS 97 2HE LYS 97 6.773 0.591 7.244 591 1HZ LYS 97 1HZ LYS 97 7.948 -0.510 8.996 592 2HZ LYS 97 2HZ LYS 97 7.435 -1.991 8.486 593 3HZ LYS 97 3HZ LYS 97 8.425 -1.085 7.534 594 H VAL 98 H VAL 98 -0.398 1.510 7.842 595 HA VAL 98 HA VAL 98 -1.538 2.592 10.276 596 HB VAL 98 HB VAL 98 -2.883 0.994 8.067 597 1HG1 VAL 98 1HG1 VAL 98 -4.908 2.208 8.799 598 2HG1 VAL 98 2HG1 VAL 98 -4.252 1.290 10.158 599 3HG1 VAL 98 3HG1 VAL 98 -3.979 3.040 10.062 600 1HG2 VAL 98 1HG2 VAL 98 -2.438 3.999 8.285 601 2HG2 VAL 98 2HG2 VAL 98 -1.765 2.926 7.039 602 3HG2 VAL 98 3HG2 VAL 98 -3.507 3.184 7.122 603 H GLN 99 H GLN 99 -0.102 1.157 11.564 604 HA GLN 99 HA GLN 99 0.194 -0.460 13.091 605 1HB GLN 99 1HB GLN 99 -2.149 -0.044 13.703 606 2HB GLN 99 2HB GLN 99 -2.700 -1.270 12.558 607 1HG GLN 99 1HG GLN 99 -1.360 -2.989 13.811 608 2HG GLN 99 2HG GLN 99 -0.926 -1.735 14.990 609 1HE2 GLN 99 1HE2 GLN 99 -2.153 -3.967 15.978 610 2HE2 GLN 99 2HE2 GLN 99 -3.824 -3.602 16.372 611 H CYS 100 H CYS 100 -1.914 -2.195 10.802 612 HA CYS 100 HA CYS 100 -0.046 -3.767 9.460 613 1HB CYS 100 1HB CYS 100 0.698 -4.833 11.525 614 2HB CYS 100 2HB CYS 100 -0.977 -5.100 12.054 615 HG CYS 100 HG CYS 100 0.544 -6.268 9.367 616 H PHE 101 H PHE 101 -2.967 -4.552 11.369 617 HA PHE 101 HA PHE 101 -4.255 -5.883 9.177 618 1HB PHE 101 1HB PHE 101 -5.470 -5.037 11.825 619 2HB PHE 101 2HB PHE 101 -5.984 -6.347 10.772 620 HD1 PHE 101 HD1 PHE 101 -4.075 -8.177 10.259 621 HD2 PHE 101 HD2 PHE 101 -4.097 -5.551 13.686 622 HE1 PHE 101 HE1 PHE 101 -2.464 -9.663 11.413 623 HE2 PHE 101 HE2 PHE 101 -2.483 -7.042 14.830 624 HZ PHE 101 HZ PHE 101 -1.656 -9.094 13.694 625 H CYS 102 H CYS 102 -3.884 -3.722 7.952 626 HA CYS 102 HA CYS 102 -6.478 -2.208 7.891 627 1HB CYS 102 1HB CYS 102 -4.825 -0.638 8.574 628 2HB CYS 102 2HB CYS 102 -3.642 -1.232 7.385 629 HG CYS 102 HG CYS 102 -6.645 0.009 6.698 630 H PHE 103 H PHE 103 -3.631 -2.828 5.784 631 HA PHE 103 HA PHE 103 -5.086 -2.930 3.380 632 1HB PHE 103 1HB PHE 103 -2.420 -3.032 4.082 633 2HB PHE 103 2HB PHE 103 -2.671 -4.679 3.537 634 HD1 PHE 103 HD1 PHE 103 -1.954 -1.319 2.512 635 HD2 PHE 103 HD2 PHE 103 -3.810 -4.991 1.221 636 HE1 PHE 103 HE1 PHE 103 -1.372 -0.792 0.165 637 HE2 PHE 103 HE2 PHE 103 -3.154 -4.508 -1.094 638 HZ PHE 103 HZ PHE 103 -1.907 -2.429 -1.642 639 H THR 104 H THR 104 -3.976 -5.603 5.438 640 HA THR 104 HA THR 104 -4.670 -7.696 5.796 641 HB THR 104 HB THR 104 -7.491 -6.654 5.549 642 HG1 THR 104 HG1 THR 104 -6.690 -4.927 6.427 643 1HG2 THR 104 1HG2 THR 104 -6.011 -8.152 7.765 644 2HG2 THR 104 2HG2 THR 104 -7.737 -7.736 7.744 645 3HG2 THR 104 3HG2 THR 104 -7.098 -8.908 6.579 646 H GLU 105 H GLU 105 -4.044 -7.801 3.043 647 HA GLU 105 HA GLU 105 -6.186 -9.539 1.953 648 1HB GLU 105 1HB GLU 105 -4.453 -10.329 0.402 649 2HB GLU 105 2HB GLU 105 -4.812 -8.607 0.286 650 1HG GLU 105 1HG GLU 105 -2.451 -9.585 1.936 651 2HG GLU 105 2HG GLU 105 -2.340 -9.389 0.186 652 H THR 106 H THR 106 -5.954 -11.897 1.951 653 HA THR 106 HA THR 106 -4.012 -13.181 3.606 654 HB THR 106 HB THR 106 -4.998 -12.345 5.531 655 HG1 THR 106 HG1 THR 106 -4.692 -14.534 5.682 656 1HG2 THR 106 1HG2 THR 106 -7.812 -13.065 4.606 657 2HG2 THR 106 2HG2 THR 106 -7.316 -12.369 6.144 658 3HG2 THR 106 3HG2 THR 106 -7.119 -11.426 4.670 659 H THR 107 H THR 107 -7.437 -13.859 2.933 660 HA THR 107 HA THR 107 -6.793 -15.957 1.071 661 HB THR 107 HB THR 107 -6.199 -17.006 3.204 662 HG1 THR 107 HG1 THR 107 -7.557 -18.838 2.877 663 1HG2 THR 107 1HG2 THR 107 -7.819 -15.758 4.592 664 2HG2 THR 107 2HG2 THR 107 -9.146 -16.657 3.825 665 3HG2 THR 107 3HG2 THR 107 -7.954 -17.516 4.833 666 H LEU 108 H LEU 108 -8.741 -16.690 -0.026 667 HA LEU 108 HA LEU 108 -11.339 -15.701 0.856 668 1HB LEU 108 1HB LEU 108 -10.075 -14.643 -1.708 669 2HB LEU 108 2HB LEU 108 -11.801 -14.652 -1.419 670 HG LEU 108 HG LEU 108 -9.781 -13.030 0.164 671 1HD1 LEU 108 1HD1 LEU 108 -11.890 -12.313 -1.912 672 2HD1 LEU 108 2HD1 LEU 108 -10.936 -11.153 -0.981 673 3HD1 LEU 108 3HD1 LEU 108 -10.124 -12.238 -2.112 674 1HD2 LEU 108 1HD2 LEU 108 -11.666 -13.623 1.656 675 2HD2 LEU 108 2HD2 LEU 108 -11.870 -11.960 1.122 676 3HD2 LEU 108 3HD2 LEU 108 -12.832 -13.239 0.395 677 H GLU 109 H GLU 109 -12.999 -16.809 -0.072 678 HA GLU 109 HA GLU 109 -12.411 -19.168 -1.656 679 1HB GLU 109 1HB GLU 109 -14.529 -18.284 0.077 680 2HB GLU 109 2HB GLU 109 -15.235 -18.682 -1.459 681 1HG GLU 109 1HG GLU 109 -13.794 -20.915 -1.238 682 2HG GLU 109 2HG GLU 109 -13.521 -20.374 0.420 683 HA PRO 110 HA PRO 110 -12.899 -17.683 -5.668 684 1HB PRO 110 1HB PRO 110 -14.467 -19.398 -7.063 685 2HB PRO 110 2HB PRO 110 -12.950 -19.879 -6.256 686 1HG PRO 110 1HG PRO 110 -15.778 -20.222 -5.228 687 2HG PRO 110 2HG PRO 110 -14.494 -21.456 -5.296 688 1HD PRO 110 1HD PRO 110 -15.060 -19.923 -3.077 689 2HD PRO 110 2HD PRO 110 -13.408 -20.518 -3.413 690 H GLY 111 H GLY 111 -13.846 -15.606 -5.446 691 1HA GLY 111 1HA GLY 111 -15.495 -14.437 -6.924 692 2HA GLY 111 2HA GLY 111 -16.762 -15.402 -6.167 693 H GLU 112 H GLU 112 -14.679 -14.910 -3.647 694 HA GLU 112 HA GLU 112 -16.531 -13.040 -2.616 695 1HB GLU 112 1HB GLU 112 -13.905 -13.823 -1.375 696 2HB GLU 112 2HB GLU 112 -15.368 -13.287 -0.546 697 1HG GLU 112 1HG GLU 112 -16.250 -15.639 -1.630 698 2HG GLU 112 2HG GLU 112 -14.547 -15.911 -1.685 699 H GLU 113 H GLU 113 -15.607 -11.142 -1.204 700 HA GLU 113 HA GLU 113 -14.244 -9.290 -3.101 701 1HB GLU 113 1HB GLU 113 -16.613 -8.964 -3.022 702 2HB GLU 113 2HB GLU 113 -16.647 -9.033 -1.256 703 1HG GLU 113 1HG GLU 113 -15.011 -6.912 -2.481 704 2HG GLU 113 2HG GLU 113 -16.769 -6.800 -2.638 705 H MET 114 H MET 114 -12.704 -7.851 -2.287 706 HA MET 114 HA MET 114 -12.392 -7.486 0.608 707 1HB MET 114 1HB MET 114 -10.479 -8.841 -1.309 708 2HB MET 114 2HB MET 114 -9.761 -7.548 -0.333 709 1HG MET 114 1HG MET 114 -10.562 -8.484 1.688 710 2HG MET 114 2HG MET 114 -11.342 -9.815 0.846 711 1HE MET 114 1HE MET 114 -8.293 -11.561 2.634 712 2HE MET 114 2HE MET 114 -9.151 -10.139 3.278 713 3HE MET 114 3HE MET 114 -10.060 -11.470 2.517 714 H GLU 115 H GLU 115 -13.631 -5.517 -0.098 715 HA GLU 115 HA GLU 115 -11.805 -3.438 -1.270 716 1HB GLU 115 1HB GLU 115 -14.726 -3.070 -0.551 717 2HB GLU 115 2HB GLU 115 -13.667 -2.051 -1.537 718 1HG GLU 115 1HG GLU 115 -13.485 -4.253 -3.035 719 2HG GLU 115 2HG GLU 115 -14.951 -4.702 -2.173 720 H MET 116 H MET 116 -10.620 -2.232 0.205 721 HA MET 116 HA MET 116 -11.799 -1.839 2.898 722 1HB MET 116 1HB MET 116 -9.089 -3.136 2.424 723 2HB MET 116 2HB MET 116 -9.643 -2.470 3.964 724 1HG MET 116 1HG MET 116 -11.670 -4.028 3.791 725 2HG MET 116 2HG MET 116 -10.853 -4.787 2.422 726 1HE MET 116 1HE MET 116 -9.317 -3.511 5.917 727 2HE MET 116 2HE MET 116 -10.912 -4.209 6.288 728 3HE MET 116 3HE MET 116 -9.427 -5.036 6.814 729 HA PRO 117 HA PRO 117 -9.961 2.179 2.377 730 1HB PRO 117 1HB PRO 117 -10.215 3.222 4.818 731 2HB PRO 117 2HB PRO 117 -11.614 2.904 3.749 732 1HG PRO 117 1HG PRO 117 -10.597 1.160 6.003 733 2HG PRO 117 2HG PRO 117 -12.258 1.719 5.627 734 1HD PRO 117 1HD PRO 117 -11.301 -0.753 4.869 735 2HD PRO 117 2HD PRO 117 -12.511 0.150 3.904 736 H VAL 118 H VAL 118 -7.937 2.956 2.536 737 HA VAL 118 HA VAL 118 -6.198 2.143 4.787 738 HB VAL 118 HB VAL 118 -5.276 2.736 1.934 739 1HG1 VAL 118 1HG1 VAL 118 -3.679 2.110 4.440 740 2HG1 VAL 118 2HG1 VAL 118 -3.028 2.156 2.787 741 3HG1 VAL 118 3HG1 VAL 118 -3.673 3.628 3.507 742 1HG2 VAL 118 1HG2 VAL 118 -4.427 0.422 1.933 743 2HG2 VAL 118 2HG2 VAL 118 -5.191 0.131 3.503 744 3HG2 VAL 118 3HG2 VAL 118 -6.189 0.464 2.075 745 H VAL 119 H VAL 119 -5.021 3.965 5.601 746 HA VAL 119 HA VAL 119 -5.832 6.588 4.548 747 HB VAL 119 HB VAL 119 -6.990 6.287 6.671 748 1HG1 VAL 119 1HG1 VAL 119 -5.476 4.664 7.781 749 2HG1 VAL 119 2HG1 VAL 119 -4.250 5.940 7.968 750 3HG1 VAL 119 3HG1 VAL 119 -5.810 6.073 8.796 751 1HG2 VAL 119 1HG2 VAL 119 -6.188 8.528 6.033 752 2HG2 VAL 119 2HG2 VAL 119 -6.197 8.311 7.790 753 3HG2 VAL 119 3HG2 VAL 119 -4.664 8.240 6.901 754 H PHE 120 H PHE 120 -3.936 7.934 4.176 755 HA PHE 120 HA PHE 120 -1.420 6.981 5.317 756 1HB PHE 120 1HB PHE 120 -1.927 5.540 3.224 757 2HB PHE 120 2HB PHE 120 -1.633 7.009 2.290 758 HD1 PHE 120 HD1 PHE 120 0.630 7.411 1.628 759 HD2 PHE 120 HD2 PHE 120 -0.154 4.935 5.070 760 HE1 PHE 120 HE1 PHE 120 3.085 7.068 1.968 761 HE2 PHE 120 HE2 PHE 120 2.269 4.687 5.432 762 HZ PHE 120 HZ PHE 120 3.891 5.808 3.917 763 H PHE 121 H PHE 121 0.451 8.190 4.771 764 HA PHE 121 HA PHE 121 0.519 10.854 3.866 765 1HB PHE 121 1HB PHE 121 0.501 11.993 6.013 766 2HB PHE 121 2HB PHE 121 -1.057 11.270 5.701 767 HD1 PHE 121 HD1 PHE 121 -1.740 9.134 6.873 768 HD2 PHE 121 HD2 PHE 121 1.845 11.277 7.948 769 HE1 PHE 121 HE1 PHE 121 -1.839 8.160 9.144 770 HE2 PHE 121 HE2 PHE 121 1.686 10.371 10.242 771 HZ PHE 121 HZ PHE 121 -0.225 8.893 10.867 772 H VAL 122 H VAL 122 2.675 11.829 5.056 773 HA VAL 122 HA VAL 122 4.435 9.562 5.934 774 HB VAL 122 HB VAL 122 5.011 11.549 3.716 775 1HG1 VAL 122 1HG1 VAL 122 7.258 10.385 3.620 776 2HG1 VAL 122 2HG1 VAL 122 7.030 11.432 5.017 777 3HG1 VAL 122 3HG1 VAL 122 6.887 9.675 5.208 778 1HG2 VAL 122 1HG2 VAL 122 3.768 9.637 2.902 779 2HG2 VAL 122 2HG2 VAL 122 5.451 9.419 2.429 780 3HG2 VAL 122 3HG2 VAL 122 4.793 8.515 3.810 781 H ASP 123 H ASP 123 5.766 10.006 7.612 782 HA ASP 123 HA ASP 123 5.374 12.601 8.894 783 1HB ASP 123 1HB ASP 123 7.001 10.142 9.636 784 2HB ASP 123 2HB ASP 123 7.080 11.648 10.551 785 HA PRO 124 HA PRO 124 8.875 14.451 6.867 786 1HB PRO 124 1HB PRO 124 9.309 16.670 8.375 787 2HB PRO 124 2HB PRO 124 7.862 16.464 7.353 788 1HG PRO 124 1HG PRO 124 8.113 16.030 10.330 789 2HG PRO 124 2HG PRO 124 6.807 16.841 9.408 790 1HD PRO 124 1HD PRO 124 6.741 14.183 10.297 791 2HD PRO 124 2HD PRO 124 5.784 14.795 8.931 792 H GLU 125 H GLU 125 9.017 12.972 9.947 793 HA GLU 125 HA GLU 125 11.564 12.934 10.876 794 1HB GLU 125 1HB GLU 125 9.819 10.667 9.985 795 2HB GLU 125 2HB GLU 125 11.267 10.504 10.998 796 1HG GLU 125 1HG GLU 125 9.062 12.370 11.893 797 2HG GLU 125 2HG GLU 125 8.989 10.630 12.139 798 H ILE 126 H ILE 126 10.397 11.705 7.637 799 HA ILE 126 HA ILE 126 12.716 10.385 6.873 800 HB ILE 126 HB ILE 126 10.440 10.125 6.066 801 1HG1 ILE 126 1HG1 ILE 126 12.778 9.456 4.954 802 2HG1 ILE 126 2HG1 ILE 126 11.225 9.056 4.270 803 1HG2 ILE 126 1HG2 ILE 126 9.814 12.486 5.680 804 2HG2 ILE 126 2HG2 ILE 126 10.944 12.585 4.341 805 3HG2 ILE 126 3HG2 ILE 126 9.565 11.477 4.250 806 1HD1 ILE 126 1HD1 ILE 126 11.330 10.919 2.736 807 2HD1 ILE 126 2HD1 ILE 126 12.812 11.520 3.521 808 3HD1 ILE 126 3HD1 ILE 126 12.822 9.961 2.658 809 H VAL 127 H VAL 127 12.016 13.854 6.829 810 HA VAL 127 HA VAL 127 14.547 14.354 5.312 811 HB VAL 127 HB VAL 127 13.705 16.661 5.065 812 1HG1 VAL 127 1HG1 VAL 127 12.162 16.203 3.264 813 2HG1 VAL 127 2HG1 VAL 127 13.470 15.007 3.258 814 3HG1 VAL 127 3HG1 VAL 127 11.863 14.567 3.873 815 1HG2 VAL 127 1HG2 VAL 127 12.086 16.601 7.002 816 2HG2 VAL 127 2HG2 VAL 127 11.424 17.252 5.490 817 3HG2 VAL 127 3HG2 VAL 127 11.013 15.604 5.988 818 H LYS 128 H LYS 128 14.006 13.643 8.380 819 HA LYS 128 HA LYS 128 15.355 15.978 9.516 820 1HB LYS 128 1HB LYS 128 14.874 15.405 11.461 821 2HB LYS 128 2HB LYS 128 13.577 14.530 10.616 822 1HG LYS 128 1HG LYS 128 14.787 12.487 10.886 823 2HG LYS 128 2HG LYS 128 16.176 13.345 11.613 824 1HD LYS 128 1HD LYS 128 15.024 13.703 13.639 825 2HD LYS 128 2HD LYS 128 13.452 13.791 12.819 826 1HE LYS 128 1HE LYS 128 13.527 11.367 12.370 827 2HE LYS 128 2HE LYS 128 14.980 11.207 13.382 828 1HZ LYS 128 1HZ LYS 128 12.619 10.829 14.344 829 2HZ LYS 128 2HZ LYS 128 13.541 11.857 15.308 830 3HZ LYS 128 3HZ LYS 128 12.409 12.362 14.252 831 HA PRO 129 HA PRO 129 19.245 13.331 9.502 832 1HB PRO 129 1HB PRO 129 19.463 10.957 8.292 833 2HB PRO 129 2HB PRO 129 18.410 11.081 9.727 834 1HG PRO 129 1HG PRO 129 17.561 11.404 6.814 835 2HG PRO 129 2HG PRO 129 16.926 10.198 7.963 836 1HD PRO 129 1HD PRO 129 15.667 12.531 7.649 837 2HD PRO 129 2HD PRO 129 15.872 11.802 9.255 838 H VAL 130 H VAL 130 20.980 12.545 7.720 839 HA VAL 130 HA VAL 130 20.784 14.296 5.390 840 HB VAL 130 HB VAL 130 22.914 12.371 6.429 841 1HG1 VAL 130 1HG1 VAL 130 24.410 13.533 4.824 842 2HG1 VAL 130 2HG1 VAL 130 23.146 12.595 4.017 843 3HG1 VAL 130 3HG1 VAL 130 22.995 14.366 4.135 844 1HG2 VAL 130 1HG2 VAL 130 24.112 14.459 7.025 845 2HG2 VAL 130 2HG2 VAL 130 22.720 15.418 6.485 846 3HG2 VAL 130 3HG2 VAL 130 22.576 14.344 7.891 847 H GLU 131 H GLU 131 21.147 10.785 6.032 848 HA GLU 131 HA GLU 131 21.469 9.820 3.500 849 1HB GLU 131 1HB GLU 131 19.900 8.578 5.801 850 2HB GLU 131 2HB GLU 131 20.490 7.690 4.390 851 1HG GLU 131 1HG GLU 131 22.794 8.116 4.969 852 2HG GLU 131 2HG GLU 131 22.355 9.218 6.278 853 H THR 132 H THR 132 18.205 10.023 5.016 854 HA THR 132 HA THR 132 17.057 9.358 2.449 855 HB THR 132 HB THR 132 14.894 9.609 3.863 856 HG1 THR 132 HG1 THR 132 15.533 10.761 5.589 857 1HG2 THR 132 1HG2 THR 132 17.088 7.636 4.651 858 2HG2 THR 132 2HG2 THR 132 15.381 7.493 5.102 859 3HG2 THR 132 3HG2 THR 132 15.842 7.437 3.395 860 H GLN 133 H GLN 133 18.237 12.305 3.491 861 HA GLN 133 HA GLN 133 16.165 14.100 3.390 862 1HB GLN 133 1HB GLN 133 18.648 14.485 3.886 863 2HB GLN 133 2HB GLN 133 18.916 14.562 2.152 864 1HG GLN 133 1HG GLN 133 18.750 16.797 3.108 865 2HG GLN 133 2HG GLN 133 17.392 16.521 2.011 866 1HE2 GLN 133 1HE2 GLN 133 17.794 15.349 5.465 867 2HE2 GLN 133 2HE2 GLN 133 16.413 16.230 6.031 868 H GLY 134 H GLY 134 17.893 12.737 0.584 869 1HA GLY 134 1HA GLY 134 16.635 14.401 -1.404 870 2HA GLY 134 2HA GLY 134 17.509 12.887 -1.678 871 H ILE 135 H ILE 135 15.500 11.546 0.317 872 HA ILE 135 HA ILE 135 13.828 10.532 -1.852 873 HB ILE 135 HB ILE 135 14.142 9.809 1.062 874 1HG1 ILE 135 1HG1 ILE 135 16.061 9.118 -0.107 875 2HG1 ILE 135 2HG1 ILE 135 15.015 7.710 0.117 876 1HG2 ILE 135 1HG2 ILE 135 12.321 8.519 -1.004 877 2HG2 ILE 135 2HG2 ILE 135 12.754 7.817 0.575 878 3HG2 ILE 135 3HG2 ILE 135 11.827 9.306 0.503 879 1HD1 ILE 135 1HD1 ILE 135 14.143 8.077 -2.224 880 2HD1 ILE 135 2HD1 ILE 135 15.447 9.273 -2.433 881 3HD1 ILE 135 3HD1 ILE 135 15.848 7.576 -2.083 882 H LYS 136 H LYS 136 11.856 11.113 -2.350 883 HA LYS 136 HA LYS 136 10.002 11.596 -0.215 884 1HB LYS 136 1HB LYS 136 9.084 13.682 -1.091 885 2HB LYS 136 2HB LYS 136 10.602 13.791 -0.188 886 1HG LYS 136 1HG LYS 136 11.848 13.984 -2.326 887 2HG LYS 136 2HG LYS 136 10.297 13.882 -3.201 888 1HD LYS 136 1HD LYS 136 9.626 15.724 -1.288 889 2HD LYS 136 2HD LYS 136 11.345 16.070 -1.383 890 1HE LYS 136 1HE LYS 136 11.099 16.613 -3.796 891 2HE LYS 136 2HE LYS 136 9.413 16.050 -3.775 892 1HZ LYS 136 1HZ LYS 136 9.536 18.464 -3.625 893 2HZ LYS 136 2HZ LYS 136 8.896 17.896 -2.218 894 3HZ LYS 136 3HZ LYS 136 10.393 18.381 -2.225 895 H THR 137 H THR 137 10.258 9.501 -2.017 896 HA THR 137 HA THR 137 7.574 9.613 -3.250 897 HB THR 137 HB THR 137 8.610 7.976 -4.967 898 HG1 THR 137 HG1 THR 137 10.783 8.519 -5.487 899 1HG2 THR 137 1HG2 THR 137 7.573 9.980 -5.649 900 2HG2 THR 137 2HG2 THR 137 8.923 10.990 -5.074 901 3HG2 THR 137 3HG2 THR 137 9.129 9.939 -6.501 902 H LEU 138 H LEU 138 6.947 8.690 -1.307 903 HA LEU 138 HA LEU 138 8.593 6.510 -0.316 904 1HB LEU 138 1HB LEU 138 7.396 8.527 0.833 905 2HB LEU 138 2HB LEU 138 6.064 7.374 1.050 906 HG LEU 138 HG LEU 138 8.078 5.811 1.790 907 1HD1 LEU 138 1HD1 LEU 138 9.203 8.553 2.449 908 2HD1 LEU 138 2HD1 LEU 138 9.790 6.997 3.064 909 3HD1 LEU 138 3HD1 LEU 138 9.915 7.362 1.335 910 1HD2 LEU 138 1HD2 LEU 138 7.077 7.967 3.688 911 2HD2 LEU 138 2HD2 LEU 138 6.190 6.485 3.300 912 3HD2 LEU 138 3HD2 LEU 138 7.753 6.407 4.144 913 H THR 139 H THR 139 8.333 4.845 -1.794 914 HA THR 139 HA THR 139 5.601 4.197 -2.592 915 HB THR 139 HB THR 139 7.148 4.645 -4.353 916 HG1 THR 139 HG1 THR 139 5.492 2.942 -4.576 917 1HG2 THR 139 1HG2 THR 139 8.935 3.071 -4.918 918 2HG2 THR 139 2HG2 THR 139 9.216 3.945 -3.393 919 3HG2 THR 139 3HG2 THR 139 8.686 2.234 -3.371 920 H LEU 140 H LEU 140 4.673 2.227 -2.476 921 HA LEU 140 HA LEU 140 6.038 0.121 -0.863 922 1HB LEU 140 1HB LEU 140 4.163 0.816 0.435 923 2HB LEU 140 2HB LEU 140 3.142 1.055 -0.993 924 HG LEU 140 HG LEU 140 2.785 -1.279 -1.302 925 1HD1 LEU 140 1HD1 LEU 140 4.928 -1.704 0.767 926 2HD1 LEU 140 2HD1 LEU 140 3.710 -2.936 0.380 927 3HD1 LEU 140 3HD1 LEU 140 4.839 -2.372 -0.858 928 1HD2 LEU 140 1HD2 LEU 140 1.659 -1.821 0.823 929 2HD2 LEU 140 2HD2 LEU 140 2.609 -0.579 1.659 930 3HD2 LEU 140 3HD2 LEU 140 1.434 -0.114 0.410 931 H SER 141 H SER 141 6.768 -1.255 -2.393 932 HA SER 141 HA SER 141 5.227 -1.864 -4.858 933 1HB SER 141 1HB SER 141 7.226 -3.257 -5.317 934 2HB SER 141 2HB SER 141 7.538 -1.514 -5.247 935 HG SER 141 HG SER 141 7.782 -3.263 -3.034 936 H TYR 142 H TYR 142 3.480 -2.956 -4.167 937 HA TYR 142 HA TYR 142 3.781 -5.311 -2.374 938 1HB TYR 142 1HB TYR 142 1.685 -3.463 -2.783 939 2HB TYR 142 2HB TYR 142 1.155 -4.887 -3.657 940 HD1 TYR 142 HD1 TYR 142 1.868 -7.194 -2.109 941 HD2 TYR 142 HD2 TYR 142 0.579 -3.312 -0.746 942 HE1 TYR 142 HE1 TYR 142 1.112 -8.184 0.041 943 HE2 TYR 142 HE2 TYR 142 -0.211 -4.320 1.371 944 HH TYR 142 HH TYR 142 -0.823 -6.760 2.300 945 H THR 143 H THR 143 4.105 -7.307 -3.374 946 HA THR 143 HA THR 143 3.583 -7.493 -6.305 947 HB THR 143 HB THR 143 6.023 -8.629 -4.923 948 HG1 THR 143 HG1 THR 143 7.100 -6.796 -5.724 949 1HG2 THR 143 1HG2 THR 143 5.334 -9.546 -7.180 950 2HG2 THR 143 2HG2 THR 143 5.417 -7.903 -7.839 951 3HG2 THR 143 3HG2 THR 143 6.888 -8.688 -7.244 952 H PHE 144 H PHE 144 1.759 -8.564 -6.211 953 HA PHE 144 HA PHE 144 1.276 -10.674 -4.327 954 1HB PHE 144 1HB PHE 144 -0.187 -9.678 -6.762 955 2HB PHE 144 2HB PHE 144 -0.847 -10.730 -5.570 956 HD1 PHE 144 HD1 PHE 144 -0.441 -9.739 -2.975 957 HD2 PHE 144 HD2 PHE 144 -1.299 -7.593 -6.613 958 HE1 PHE 144 HE1 PHE 144 -1.325 -7.851 -1.671 959 HE2 PHE 144 HE2 PHE 144 -2.391 -5.836 -5.267 960 HZ PHE 144 HZ PHE 144 -2.120 -5.816 -2.794 961 H TYR 145 H TYR 145 2.856 -12.262 -4.756 962 HA TYR 145 HA TYR 145 2.246 -14.026 -7.099 963 1HB TYR 145 1HB TYR 145 4.720 -14.496 -7.188 964 2HB TYR 145 2HB TYR 145 4.172 -12.914 -7.703 965 HD1 TYR 145 HD1 TYR 145 6.436 -12.062 -7.611 966 HD2 TYR 145 HD2 TYR 145 4.589 -13.597 -4.017 967 HE1 TYR 145 HE1 TYR 145 7.931 -10.665 -6.214 968 HE2 TYR 145 HE2 TYR 145 6.060 -12.189 -2.664 969 HH TYR 145 HH TYR 145 7.082 -9.913 -2.950 970 HA PRO 146 HA PRO 146 2.433 -16.732 -3.301 971 1HB PRO 146 1HB PRO 146 -0.154 -17.174 -2.635 972 2HB PRO 146 2HB PRO 146 0.758 -15.749 -2.088 973 1HG PRO 146 1HG PRO 146 -1.213 -15.857 -4.390 974 2HG PRO 146 2HG PRO 146 -1.042 -14.650 -3.097 975 1HD PRO 146 1HD PRO 146 0.095 -14.394 -5.631 976 2HD PRO 146 2HD PRO 146 0.715 -13.609 -4.139 977 H ARG 147 H ARG 147 -0.716 -17.682 -4.705 978 HA ARG 147 HA ARG 147 0.433 -19.367 -6.751 979 1HB ARG 147 1HB ARG 147 -0.308 -21.500 -5.764 980 2HB ARG 147 2HB ARG 147 0.952 -20.737 -4.786 981 1HG ARG 147 1HG ARG 147 -0.899 -19.854 -3.258 982 2HG ARG 147 2HG ARG 147 -2.044 -20.814 -4.205 983 1HD ARG 147 1HD ARG 147 -1.475 -22.053 -2.255 984 2HD ARG 147 2HD ARG 147 -0.761 -22.869 -3.667 985 HE ARG 147 HE ARG 147 1.176 -21.087 -2.645 986 1HH1 ARG 147 1HH1 ARG 147 -0.499 -24.009 -1.628 987 2HH1 ARG 147 2HH1 ARG 147 0.748 -24.568 -0.558 988 1HH2 ARG 147 1HH2 ARG 147 2.882 -21.788 -1.240 989 2HH2 ARG 147 2HH2 ARG 147 2.729 -23.261 -0.341 990 H GLU 148 H GLU 148 -1.206 -19.896 -8.274 991 HA GLU 148 HA GLU 148 -4.011 -19.396 -7.437 992 1HB GLU 148 1HB GLU 148 -4.617 -18.987 -9.701 993 2HB GLU 148 2HB GLU 148 -3.369 -17.829 -9.238 994 1HG GLU 148 1HG GLU 148 -1.737 -18.863 -10.617 995 2HG GLU 148 2HG GLU 148 -2.694 -20.341 -10.822 996 HA PRO 149 HA PRO 149 -4.291 -23.800 -8.456 997 1HB PRO 149 1HB PRO 149 -7.010 -24.087 -8.739 998 2HB PRO 149 2HB PRO 149 -6.185 -23.927 -7.167 999 1HG PRO 149 1HG PRO 149 -7.707 -21.813 -8.672 1000 2HG PRO 149 2HG PRO 149 -7.632 -22.107 -6.921 1001 1HD PRO 149 1HD PRO 149 -6.143 -20.158 -8.214 1002 2HD PRO 149 2HD PRO 149 -5.671 -20.942 -6.676 1003 H SER 150 H SER 150 -6.585 -21.739 -10.288 1004 HA SER 150 HA SER 150 -5.366 -21.840 -12.812 1005 1HB SER 150 1HB SER 150 -6.944 -23.423 -13.962 1006 2HB SER 150 2HB SER 150 -5.805 -24.252 -12.898 1007 HG SER 150 HG SER 150 -8.425 -23.457 -12.154 1008 H LYS 151 H LYS 151 -6.095 -19.649 -12.715 1009 HA LYS 151 HA LYS 151 -8.847 -19.048 -12.172 1010 1HB LYS 151 1HB LYS 151 -8.262 -16.759 -12.608 1011 2HB LYS 151 2HB LYS 151 -6.950 -17.561 -11.730 1012 1HG LYS 151 1HG LYS 151 -5.838 -17.959 -14.023 1013 2HG LYS 151 2HG LYS 151 -7.057 -16.841 -14.674 1014 1HD LYS 151 1HD LYS 151 -6.203 -15.061 -13.138 1015 2HD LYS 151 2HD LYS 151 -5.081 -16.232 -12.421 1016 1HE LYS 151 1HE LYS 151 -3.916 -14.789 -14.023 1017 2HE LYS 151 2HE LYS 151 -3.836 -16.504 -14.447 1018 1HZ LYS 151 1HZ LYS 151 -5.535 -16.167 -16.060 1019 2HZ LYS 151 2HZ LYS 151 -5.695 -14.575 -15.666 1020 3HZ LYS 151 3HZ LYS 151 -4.298 -15.127 -16.347 Start of MODEL 27 1 H VAL 21 H VAL 21 -0.322 10.817 13.974 2 HA VAL 21 HA VAL 21 -1.975 9.269 15.878 3 HB VAL 21 HB VAL 21 -2.559 12.084 14.975 4 1HG1 VAL 21 1HG1 VAL 21 -4.194 10.998 16.530 5 2HG1 VAL 21 2HG1 VAL 21 -2.871 10.656 17.658 6 3HG1 VAL 21 3HG1 VAL 21 -3.348 12.328 17.308 7 1HG2 VAL 21 1HG2 VAL 21 -0.417 11.247 16.973 8 2HG2 VAL 21 2HG2 VAL 21 -0.223 12.278 15.534 9 3HG2 VAL 21 3HG2 VAL 21 -1.132 12.870 16.912 10 H GLU 22 H GLU 22 -1.814 8.864 12.789 11 HA GLU 22 HA GLU 22 -3.079 8.763 10.938 12 1HB GLU 22 1HB GLU 22 -3.836 6.844 12.560 13 2HB GLU 22 2HB GLU 22 -5.372 7.731 12.597 14 1HG GLU 22 1HG GLU 22 -5.558 7.523 10.147 15 2HG GLU 22 2HG GLU 22 -3.936 6.822 10.042 16 H GLN 23 H GLN 23 -3.003 11.186 11.943 17 HA GLN 23 HA GLN 23 -4.601 12.879 10.600 18 1HB GLN 23 1HB GLN 23 -6.048 11.894 13.017 19 2HB GLN 23 2HB GLN 23 -5.880 13.629 13.030 20 1HG GLN 23 1HG GLN 23 -7.027 12.037 10.712 21 2HG GLN 23 2HG GLN 23 -7.954 12.938 11.920 22 1HE2 GLN 23 1HE2 GLN 23 -5.441 14.966 11.624 23 2HE2 GLN 23 2HE2 GLN 23 -5.942 15.881 10.207 24 H ALA 24 H ALA 24 -2.241 13.002 10.680 25 HA ALA 24 HA ALA 24 -0.873 13.779 13.136 26 1HB ALA 24 1HB ALA 24 1.048 13.790 11.462 27 2HB ALA 24 2HB ALA 24 0.161 12.258 11.598 28 3HB ALA 24 3HB ALA 24 -0.149 13.345 10.236 29 H SER 25 H SER 25 -2.146 15.729 13.490 30 HA SER 25 HA SER 25 -2.154 17.845 11.438 31 1HB SER 25 1HB SER 25 -4.271 18.514 12.498 32 2HB SER 25 2HB SER 25 -4.309 16.825 11.959 33 HG SER 25 HG SER 25 -3.763 17.753 14.586 34 H ASP 26 H ASP 26 -0.009 18.080 12.420 35 HA ASP 26 HA ASP 26 0.045 20.657 13.780 36 1HB ASP 26 1HB ASP 26 0.265 19.459 15.826 37 2HB ASP 26 2HB ASP 26 1.137 18.116 15.082 38 H LEU 27 H LEU 27 2.032 17.867 13.181 39 HA LEU 27 HA LEU 27 4.085 18.997 11.700 40 1HB LEU 27 1HB LEU 27 4.736 16.688 11.348 41 2HB LEU 27 2HB LEU 27 4.361 17.039 13.021 42 HG LEU 27 HG LEU 27 2.238 15.814 11.233 43 1HD1 LEU 27 1HD1 LEU 27 3.977 14.390 10.796 44 2HD1 LEU 27 2HD1 LEU 27 4.643 14.443 12.453 45 3HD1 LEU 27 3HD1 LEU 27 3.155 13.545 12.096 46 1HD2 LEU 27 1HD2 LEU 27 1.261 16.248 13.372 47 2HD2 LEU 27 2HD2 LEU 27 1.753 14.591 13.496 48 3HD2 LEU 27 3HD2 LEU 27 2.764 15.844 14.234 49 H ILE 28 H ILE 28 1.368 19.577 10.377 50 HA ILE 28 HA ILE 28 1.857 18.355 7.699 51 HB ILE 28 HB ILE 28 -0.450 20.118 8.608 52 1HG1 ILE 28 1HG1 ILE 28 0.058 17.120 8.738 53 2HG1 ILE 28 2HG1 ILE 28 -0.427 18.250 10.020 54 1HG2 ILE 28 1HG2 ILE 28 -0.439 17.984 6.497 55 2HG2 ILE 28 2HG2 ILE 28 -1.498 19.402 6.622 56 3HG2 ILE 28 3HG2 ILE 28 0.190 19.576 6.078 57 1HD1 ILE 28 1HD1 ILE 28 -2.346 16.876 9.402 58 2HD1 ILE 28 2HD1 ILE 28 -2.584 18.623 9.152 59 3HD1 ILE 28 3HD1 ILE 28 -2.309 17.541 7.768 60 H LEU 29 H LEU 29 3.949 19.665 8.128 61 HA LEU 29 HA LEU 29 3.724 22.527 8.219 62 1HB LEU 29 1HB LEU 29 6.241 20.979 7.507 63 2HB LEU 29 2HB LEU 29 6.087 22.605 8.142 64 HG LEU 29 HG LEU 29 6.710 21.591 10.027 65 1HD1 LEU 29 1HD1 LEU 29 3.761 20.870 10.295 66 2HD1 LEU 29 2HD1 LEU 29 4.906 21.204 11.583 67 3HD1 LEU 29 3HD1 LEU 29 4.427 22.505 10.479 68 1HD2 LEU 29 1HD2 LEU 29 6.218 19.296 10.760 69 2HD2 LEU 29 2HD2 LEU 29 5.362 19.022 9.247 70 3HD2 LEU 29 3HD2 LEU 29 7.087 19.392 9.217 71 H ASP 30 H ASP 30 5.103 23.896 6.546 72 HA ASP 30 HA ASP 30 3.930 23.685 3.980 73 1HB ASP 30 1HB ASP 30 6.348 25.307 4.844 74 2HB ASP 30 2HB ASP 30 5.242 25.631 3.499 75 H GLU 31 H GLU 31 4.810 21.260 4.013 76 HA GLU 31 HA GLU 31 6.994 21.152 2.067 77 1HB GLU 31 1HB GLU 31 7.226 20.155 4.801 78 2HB GLU 31 2HB GLU 31 7.178 18.775 3.693 79 1HG GLU 31 1HG GLU 31 9.046 21.150 3.429 80 2HG GLU 31 2HG GLU 31 9.448 19.623 4.219 81 H LYS 32 H LYS 32 6.720 19.401 0.653 82 HA LYS 32 HA LYS 32 4.004 18.199 0.551 83 1HB LYS 32 1HB LYS 32 4.084 20.347 -0.679 84 2HB LYS 32 2HB LYS 32 5.623 19.902 -1.404 85 1HG LYS 32 1HG LYS 32 3.975 19.688 -2.999 86 2HG LYS 32 2HG LYS 32 4.621 18.093 -2.643 87 1HD LYS 32 1HD LYS 32 2.213 17.930 -2.955 88 2HD LYS 32 2HD LYS 32 2.611 17.538 -1.281 89 1HE LYS 32 1HE LYS 32 1.896 19.914 -0.656 90 2HE LYS 32 2HE LYS 32 1.455 20.161 -2.352 91 1HZ LYS 32 1HZ LYS 32 0.260 18.157 -0.541 92 2HZ LYS 32 2HZ LYS 32 -0.471 19.526 -1.095 93 3HZ LYS 32 3HZ LYS 32 -0.080 18.298 -2.118 94 H ILE 33 H ILE 33 4.202 16.099 0.080 95 HA ILE 33 HA ILE 33 6.836 14.937 -0.755 96 HB ILE 33 HB ILE 33 6.901 15.122 1.568 97 1HG1 ILE 33 1HG1 ILE 33 5.907 12.283 1.350 98 2HG1 ILE 33 2HG1 ILE 33 7.188 12.751 0.246 99 1HG2 ILE 33 1HG2 ILE 33 5.081 14.048 2.992 100 2HG2 ILE 33 2HG2 ILE 33 4.708 15.606 2.203 101 3HG2 ILE 33 3HG2 ILE 33 4.088 14.075 1.537 102 1HD1 ILE 33 1HD1 ILE 33 7.368 12.887 3.226 103 2HD1 ILE 33 2HD1 ILE 33 8.335 11.946 2.041 104 3HD1 ILE 33 3HD1 ILE 33 8.481 13.712 2.113 105 H LYS 34 H LYS 34 6.663 12.860 -1.672 106 HA LYS 34 HA LYS 34 4.102 12.468 -3.092 107 1HB LYS 34 1HB LYS 34 6.668 13.143 -3.836 108 2HB LYS 34 2HB LYS 34 6.712 11.394 -3.983 109 1HG LYS 34 1HG LYS 34 4.497 13.066 -5.184 110 2HG LYS 34 2HG LYS 34 6.087 12.894 -5.982 111 1HD LYS 34 1HD LYS 34 5.856 10.418 -5.977 112 2HD LYS 34 2HD LYS 34 4.383 10.557 -5.093 113 1HE LYS 34 1HE LYS 34 4.078 10.017 -7.416 114 2HE LYS 34 2HE LYS 34 3.097 11.387 -6.743 115 1HZ LYS 34 1HZ LYS 34 5.327 11.572 -8.629 116 2HZ LYS 34 2HZ LYS 34 3.685 11.652 -8.876 117 3HZ LYS 34 3HZ LYS 34 4.441 12.848 -8.009 118 H VAL 35 H VAL 35 3.276 10.267 -3.454 119 HA VAL 35 HA VAL 35 4.858 8.074 -2.269 120 HB VAL 35 HB VAL 35 1.931 8.606 -2.079 121 1HG1 VAL 35 1HG1 VAL 35 3.290 6.102 -1.043 122 2HG1 VAL 35 2HG1 VAL 35 1.598 6.528 -0.869 123 3HG1 VAL 35 3HG1 VAL 35 2.243 6.183 -2.480 124 1HG2 VAL 35 1HG2 VAL 35 2.142 8.557 0.319 125 2HG2 VAL 35 2HG2 VAL 35 3.876 8.172 0.173 126 3HG2 VAL 35 3HG2 VAL 35 3.254 9.770 -0.312 127 H THR 36 H THR 36 4.841 6.317 -3.669 128 HA THR 36 HA THR 36 3.275 6.659 -6.199 129 HB THR 36 HB THR 36 6.153 5.664 -6.109 130 HG1 THR 36 HG1 THR 36 6.031 7.855 -5.567 131 1HG2 THR 36 1HG2 THR 36 4.794 4.867 -8.024 132 2HG2 THR 36 2HG2 THR 36 4.333 6.544 -8.398 133 3HG2 THR 36 3HG2 THR 36 6.027 6.034 -8.545 134 H PHE 37 H PHE 37 1.881 5.111 -6.247 135 HA PHE 37 HA PHE 37 2.285 2.755 -4.549 136 1HB PHE 37 1HB PHE 37 -0.065 3.811 -6.156 137 2HB PHE 37 2HB PHE 37 -0.092 2.326 -5.234 138 HD1 PHE 37 HD1 PHE 37 0.925 2.624 -2.685 139 HD2 PHE 37 HD2 PHE 37 -1.179 5.563 -5.044 140 HE1 PHE 37 HE1 PHE 37 0.345 3.854 -0.636 141 HE2 PHE 37 HE2 PHE 37 -1.902 6.672 -2.951 142 HZ PHE 37 HZ PHE 37 -0.952 5.986 -0.782 143 H ASP 38 H ASP 38 3.962 1.682 -5.931 144 HA ASP 38 HA ASP 38 3.113 0.926 -8.635 145 1HB ASP 38 1HB ASP 38 5.437 1.673 -8.179 146 2HB ASP 38 2HB ASP 38 5.706 0.290 -7.159 147 H ALA 39 H ALA 39 1.248 -0.247 -8.059 148 HA ALA 39 HA ALA 39 1.622 -2.799 -6.590 149 1HB ALA 39 1HB ALA 39 -0.292 -1.224 -6.165 150 2HB ALA 39 2HB ALA 39 -0.918 -1.670 -7.775 151 3HB ALA 39 3HB ALA 39 -0.746 -2.898 -6.522 152 H ASN 40 H ASN 40 2.169 -4.656 -7.698 153 HA ASN 40 HA ASN 40 1.197 -4.999 -10.504 154 1HB ASN 40 1HB ASN 40 3.786 -6.151 -9.418 155 2HB ASN 40 2HB ASN 40 3.232 -6.052 -11.081 156 1HD2 ASN 40 1HD2 ASN 40 4.370 -4.169 -8.281 157 2HD2 ASN 40 2HD2 ASN 40 5.034 -2.813 -9.168 158 H VAL 41 H VAL 41 0.985 -7.360 -11.087 159 HA VAL 41 HA VAL 41 0.591 -9.190 -8.849 160 HB VAL 41 HB VAL 41 -1.520 -7.946 -8.936 161 1HG1 VAL 41 1HG1 VAL 41 -1.494 -7.164 -11.276 162 2HG1 VAL 41 2HG1 VAL 41 -1.767 -8.827 -11.841 163 3HG1 VAL 41 3HG1 VAL 41 -3.004 -7.995 -10.883 164 1HG2 VAL 41 1HG2 VAL 41 -3.080 -9.764 -9.126 165 2HG2 VAL 41 2HG2 VAL 41 -1.965 -10.705 -10.128 166 3HG2 VAL 41 3HG2 VAL 41 -1.577 -10.382 -8.424 167 H ALA 42 H ALA 42 0.459 -11.380 -9.502 168 HA ALA 42 HA ALA 42 0.750 -12.012 -12.364 169 1HB ALA 42 1HB ALA 42 2.870 -12.759 -10.309 170 2HB ALA 42 2HB ALA 42 2.879 -13.190 -12.027 171 3HB ALA 42 3HB ALA 42 3.073 -11.495 -11.542 172 H ALA 43 H ALA 43 1.113 -14.481 -12.517 173 HA ALA 43 HA ALA 43 -0.989 -15.986 -11.437 174 1HB ALA 43 1HB ALA 43 0.369 -16.722 -13.357 175 2HB ALA 43 2HB ALA 43 1.789 -16.904 -12.301 176 3HB ALA 43 3HB ALA 43 0.374 -17.951 -12.075 177 H GLY 44 H GLY 44 -1.354 -16.742 -9.432 178 1HA GLY 44 1HA GLY 44 -0.257 -17.687 -7.311 179 2HA GLY 44 2HA GLY 44 0.726 -16.226 -7.352 180 H LEU 45 H LEU 45 -1.220 -14.376 -8.373 181 HA LEU 45 HA LEU 45 -3.422 -14.475 -6.365 182 1HB LEU 45 1HB LEU 45 -1.274 -12.558 -6.508 183 2HB LEU 45 2HB LEU 45 -2.792 -11.738 -6.792 184 HG LEU 45 HG LEU 45 -2.660 -13.726 -4.484 185 1HD1 LEU 45 1HD1 LEU 45 -1.903 -12.102 -2.959 186 2HD1 LEU 45 2HD1 LEU 45 -0.791 -11.835 -4.322 187 3HD1 LEU 45 3HD1 LEU 45 -2.173 -10.777 -4.071 188 1HD2 LEU 45 1HD2 LEU 45 -4.220 -11.191 -5.042 189 2HD2 LEU 45 2HD2 LEU 45 -4.791 -12.869 -5.262 190 3HD2 LEU 45 3HD2 LEU 45 -4.350 -12.278 -3.636 191 HA PRO 46 HA PRO 46 -5.184 -14.011 -10.576 192 1HB PRO 46 1HB PRO 46 -7.165 -15.865 -10.395 193 2HB PRO 46 2HB PRO 46 -5.449 -16.356 -10.473 194 1HG PRO 46 1HG PRO 46 -7.184 -16.019 -8.003 195 2HG PRO 46 2HG PRO 46 -6.207 -17.431 -8.430 196 1HD PRO 46 1HD PRO 46 -5.305 -15.475 -6.764 197 2HD PRO 46 2HD PRO 46 -4.191 -16.361 -7.853 198 H TRP 47 H TRP 47 -5.551 -12.090 -8.509 199 HA TRP 47 HA TRP 47 -8.495 -11.875 -8.134 200 1HB TRP 47 1HB TRP 47 -6.246 -10.893 -6.376 201 2HB TRP 47 2HB TRP 47 -7.954 -10.534 -6.154 202 HD1 TRP 47 HD1 TRP 47 -7.865 -14.076 -7.065 203 HE1 TRP 47 HE1 TRP 47 -7.941 -15.597 -5.036 204 HE3 TRP 47 HE3 TRP 47 -6.548 -10.729 -3.414 205 HZ2 TRP 47 HZ2 TRP 47 -7.647 -15.427 -2.237 206 HZ3 TRP 47 HZ3 TRP 47 -5.719 -11.821 -1.326 207 HH2 TRP 47 HH2 TRP 47 -6.611 -13.929 -0.552 208 H GLU 48 H GLU 48 -9.411 -9.864 -8.594 209 HA GLU 48 HA GLU 48 -8.066 -8.378 -10.670 210 1HB GLU 48 1HB GLU 48 -10.554 -8.955 -10.304 211 2HB GLU 48 2HB GLU 48 -10.611 -7.618 -9.160 212 1HG GLU 48 1HG GLU 48 -10.913 -6.182 -10.877 213 2HG GLU 48 2HG GLU 48 -9.371 -6.647 -11.595 214 H PHE 49 H PHE 49 -6.183 -7.850 -9.303 215 HA PHE 49 HA PHE 49 -6.584 -6.013 -7.085 216 1HB PHE 49 1HB PHE 49 -5.023 -7.851 -6.845 217 2HB PHE 49 2HB PHE 49 -4.075 -7.244 -8.207 218 HD1 PHE 49 HD1 PHE 49 -2.008 -6.410 -7.409 219 HD2 PHE 49 HD2 PHE 49 -5.591 -5.568 -5.139 220 HE1 PHE 49 HE1 PHE 49 -0.685 -5.167 -5.754 221 HE2 PHE 49 HE2 PHE 49 -4.270 -4.184 -3.590 222 HZ PHE 49 HZ PHE 49 -1.812 -3.976 -3.883 223 H VAL 50 H VAL 50 -6.847 -3.889 -7.509 224 HA VAL 50 HA VAL 50 -5.288 -2.708 -9.775 225 HB VAL 50 HB VAL 50 -6.991 -1.073 -10.068 226 1HG1 VAL 50 1HG1 VAL 50 -7.322 -3.353 -11.112 227 2HG1 VAL 50 2HG1 VAL 50 -8.394 -3.766 -9.750 228 3HG1 VAL 50 3HG1 VAL 50 -8.825 -2.448 -10.846 229 1HG2 VAL 50 1HG2 VAL 50 -9.153 -1.195 -8.784 230 2HG2 VAL 50 2HG2 VAL 50 -8.354 -2.343 -7.685 231 3HG2 VAL 50 3HG2 VAL 50 -7.787 -0.660 -7.799 232 HA PRO 51 HA PRO 51 -3.581 -0.009 -6.501 233 1HB PRO 51 1HB PRO 51 -2.474 1.939 -8.093 234 2HB PRO 51 2HB PRO 51 -1.688 0.363 -7.879 235 1HG PRO 51 1HG PRO 51 -3.466 1.274 -10.149 236 2HG PRO 51 2HG PRO 51 -1.911 0.401 -10.264 237 1HD PRO 51 1HD PRO 51 -4.355 -0.822 -10.441 238 2HD PRO 51 2HD PRO 51 -2.943 -1.657 -9.725 239 H VAL 52 H VAL 52 -4.115 2.243 -5.893 240 HA VAL 52 HA VAL 52 -6.885 2.808 -6.573 241 HB VAL 52 HB VAL 52 -5.065 4.536 -4.860 242 1HG1 VAL 52 1HG1 VAL 52 -8.051 3.903 -4.816 243 2HG1 VAL 52 2HG1 VAL 52 -7.205 5.005 -3.716 244 3HG1 VAL 52 3HG1 VAL 52 -7.327 5.388 -5.438 245 1HG2 VAL 52 1HG2 VAL 52 -6.015 3.013 -2.960 246 2HG2 VAL 52 2HG2 VAL 52 -6.236 1.825 -4.253 247 3HG2 VAL 52 3HG2 VAL 52 -4.623 2.450 -3.884 248 H GLN 53 H GLN 53 -3.714 4.377 -6.995 249 HA GLN 53 HA GLN 53 -4.361 5.222 -9.622 250 1HB GLN 53 1HB GLN 53 -3.834 7.587 -9.382 251 2HB GLN 53 2HB GLN 53 -5.296 7.187 -8.494 252 1HG GLN 53 1HG GLN 53 -2.518 7.439 -7.253 253 2HG GLN 53 2HG GLN 53 -3.701 8.753 -7.314 254 1HE2 GLN 53 1HE2 GLN 53 -5.994 7.889 -6.518 255 2HE2 GLN 53 2HE2 GLN 53 -5.932 7.063 -4.968 256 H ARG 54 H ARG 54 -2.103 6.353 -10.440 257 HA ARG 54 HA ARG 54 0.093 4.692 -9.850 258 1HB ARG 54 1HB ARG 54 -0.420 7.129 -11.401 259 2HB ARG 54 2HB ARG 54 1.157 7.170 -10.624 260 1HG ARG 54 1HG ARG 54 0.110 4.843 -12.301 261 2HG ARG 54 2HG ARG 54 1.281 6.087 -12.796 262 1HD ARG 54 1HD ARG 54 2.913 4.948 -12.043 263 2HD ARG 54 2HD ARG 54 2.281 5.111 -10.435 264 HE ARG 54 HE ARG 54 0.935 2.918 -11.581 265 1HH1 ARG 54 1HH1 ARG 54 4.312 3.699 -10.650 266 2HH1 ARG 54 2HH1 ARG 54 4.725 1.974 -10.548 267 1HH2 ARG 54 1HH2 ARG 54 1.718 0.629 -11.444 268 2HH2 ARG 54 2HH2 ARG 54 3.408 0.425 -10.963 269 H ASP 55 H ASP 55 -0.542 8.071 -8.520 270 HA ASP 55 HA ASP 55 1.094 7.465 -6.197 271 1HB ASP 55 1HB ASP 55 2.179 9.527 -6.791 272 2HB ASP 55 2HB ASP 55 2.585 8.244 -7.947 273 H ILE 56 H ILE 56 1.095 9.279 -4.717 274 HA ILE 56 HA ILE 56 -1.172 11.158 -4.931 275 HB ILE 56 HB ILE 56 -1.721 11.030 -2.561 276 1HG1 ILE 56 1HG1 ILE 56 -0.059 8.519 -2.684 277 2HG1 ILE 56 2HG1 ILE 56 0.418 10.039 -1.859 278 1HG2 ILE 56 1HG2 ILE 56 -3.026 8.979 -2.728 279 2HG2 ILE 56 2HG2 ILE 56 -3.057 9.883 -4.257 280 3HG2 ILE 56 3HG2 ILE 56 -2.006 8.456 -4.102 281 1HD1 ILE 56 1HD1 ILE 56 -1.290 9.737 -0.184 282 2HD1 ILE 56 2HD1 ILE 56 -1.899 8.267 -0.977 283 3HD1 ILE 56 3HD1 ILE 56 -0.280 8.291 -0.272 284 H ASP 57 H ASP 57 -0.808 13.105 -3.659 285 HA ASP 57 HA ASP 57 1.924 13.386 -2.580 286 1HB ASP 57 1HB ASP 57 1.900 15.688 -3.076 287 2HB ASP 57 2HB ASP 57 1.497 14.861 -4.585 288 H VAL 58 H VAL 58 1.991 14.159 -0.548 289 HA VAL 58 HA VAL 58 -0.496 14.852 0.998 290 HB VAL 58 HB VAL 58 0.254 13.580 2.861 291 1HG1 VAL 58 1HG1 VAL 58 -0.169 11.884 0.369 292 2HG1 VAL 58 2HG1 VAL 58 -0.574 11.459 2.038 293 3HG1 VAL 58 3HG1 VAL 58 -1.440 12.777 1.234 294 1HG2 VAL 58 1HG2 VAL 58 1.747 11.552 2.272 295 2HG2 VAL 58 2HG2 VAL 58 2.416 12.545 0.986 296 3HG2 VAL 58 3HG2 VAL 58 2.534 13.080 2.691 297 H ARG 59 H ARG 59 0.089 16.386 2.752 298 HA ARG 59 HA ARG 59 2.929 17.334 2.743 299 1HB ARG 59 1HB ARG 59 0.491 18.638 3.987 300 2HB ARG 59 2HB ARG 59 2.190 19.109 4.174 301 1HG ARG 59 1HG ARG 59 2.142 19.140 1.518 302 2HG ARG 59 2HG ARG 59 0.410 19.308 1.744 303 1HD ARG 59 1HD ARG 59 2.678 21.177 2.385 304 2HD ARG 59 2HD ARG 59 1.109 21.545 1.696 305 HE ARG 59 HE ARG 59 1.990 21.584 4.469 306 1HH1 ARG 59 1HH1 ARG 59 -0.901 20.447 2.806 307 2HH1 ARG 59 2HH1 ARG 59 -1.992 21.019 3.907 308 1HH2 ARG 59 1HH2 ARG 59 0.480 22.112 6.162 309 2HH2 ARG 59 2HH2 ARG 59 -1.223 22.188 5.808 310 H ILE 60 H ILE 60 3.523 15.384 3.609 311 HA ILE 60 HA ILE 60 4.082 13.999 5.288 312 HB ILE 60 HB ILE 60 5.439 15.472 6.950 313 1HG1 ILE 60 1HG1 ILE 60 4.809 17.546 4.800 314 2HG1 ILE 60 2HG1 ILE 60 4.018 17.481 6.382 315 1HG2 ILE 60 1HG2 ILE 60 6.341 14.199 4.991 316 2HG2 ILE 60 2HG2 ILE 60 6.197 15.713 4.049 317 3HG2 ILE 60 3HG2 ILE 60 7.242 15.632 5.465 318 1HD1 ILE 60 1HD1 ILE 60 6.212 17.768 7.483 319 2HD1 ILE 60 2HD1 ILE 60 7.004 17.835 5.889 320 3HD1 ILE 60 3HD1 ILE 60 5.843 19.091 6.362 321 H GLY 61 H GLY 61 1.392 14.075 5.800 322 1HA GLY 61 1HA GLY 61 0.854 13.300 8.318 323 2HA GLY 61 2HA GLY 61 0.980 15.044 8.566 324 H GLU 62 H GLU 62 -0.016 15.723 5.902 325 HA GLU 62 HA GLU 62 -2.779 15.881 6.297 326 1HB GLU 62 1HB GLU 62 -1.043 17.012 4.588 327 2HB GLU 62 2HB GLU 62 -1.743 15.851 3.463 328 1HG GLU 62 1HG GLU 62 -3.827 16.920 3.510 329 2HG GLU 62 2HG GLU 62 -3.583 17.570 5.137 330 H THR 63 H THR 63 -3.877 14.056 6.809 331 HA THR 63 HA THR 63 -3.546 11.479 5.765 332 HB THR 63 HB THR 63 -6.048 11.525 6.886 333 HG1 THR 63 HG1 THR 63 -6.206 13.676 7.277 334 1HG2 THR 63 1HG2 THR 63 -4.936 11.171 9.042 335 2HG2 THR 63 2HG2 THR 63 -4.216 10.224 7.747 336 3HG2 THR 63 3HG2 THR 63 -3.377 11.687 8.346 337 H VAL 64 H VAL 64 -3.812 11.004 3.631 338 HA VAL 64 HA VAL 64 -6.497 11.663 2.468 339 HB VAL 64 HB VAL 64 -4.798 12.519 1.058 340 1HG1 VAL 64 1HG1 VAL 64 -3.114 11.134 -0.045 341 2HG1 VAL 64 2HG1 VAL 64 -2.892 11.054 1.710 342 3HG1 VAL 64 3HG1 VAL 64 -3.645 9.695 0.856 343 1HG2 VAL 64 1HG2 VAL 64 -6.803 11.458 0.006 344 2HG2 VAL 64 2HG2 VAL 64 -5.367 11.484 -1.031 345 3HG2 VAL 64 3HG2 VAL 64 -5.839 9.977 -0.238 346 H GLN 65 H GLN 65 -7.671 10.055 1.630 347 HA GLN 65 HA GLN 65 -7.233 7.254 2.572 348 1HB GLN 65 1HB GLN 65 -9.327 8.275 3.229 349 2HB GLN 65 2HB GLN 65 -9.704 8.743 1.574 350 1HG GLN 65 1HG GLN 65 -9.130 5.816 2.004 351 2HG GLN 65 2HG GLN 65 -10.535 6.448 2.845 352 1HE2 GLN 65 1HE2 GLN 65 -9.552 7.679 -0.440 353 2HE2 GLN 65 2HE2 GLN 65 -10.981 7.002 -1.189 354 H ILE 66 H ILE 66 -6.571 5.799 1.184 355 HA ILE 66 HA ILE 66 -7.408 6.022 -1.628 356 HB ILE 66 HB ILE 66 -5.187 5.003 -2.317 357 1HG1 ILE 66 1HG1 ILE 66 -3.309 6.181 -0.826 358 2HG1 ILE 66 2HG1 ILE 66 -4.385 5.820 0.492 359 1HG2 ILE 66 1HG2 ILE 66 -5.087 7.857 -1.336 360 2HG2 ILE 66 2HG2 ILE 66 -4.244 7.122 -2.716 361 3HG2 ILE 66 3HG2 ILE 66 -5.993 7.328 -2.773 362 1HD1 ILE 66 1HD1 ILE 66 -4.263 3.368 -0.230 363 2HD1 ILE 66 2HD1 ILE 66 -3.195 3.862 -1.549 364 3HD1 ILE 66 3HD1 ILE 66 -2.682 4.057 0.139 365 H MET 67 H MET 67 -8.864 4.510 -1.740 366 HA MET 67 HA MET 67 -8.499 2.014 -0.235 367 1HB MET 67 1HB MET 67 -10.774 1.662 -0.357 368 2HB MET 67 2HB MET 67 -10.671 3.420 -0.311 369 1HG MET 67 1HG MET 67 -12.294 2.974 -1.840 370 2HG MET 67 2HG MET 67 -10.899 3.245 -2.906 371 1HE MET 67 1HE MET 67 -13.664 1.891 -3.826 372 2HE MET 67 2HE MET 67 -12.263 2.109 -4.912 373 3HE MET 67 3HE MET 67 -13.060 0.521 -4.785 374 H TYR 68 H TYR 68 -8.008 0.108 -0.901 375 HA TYR 68 HA TYR 68 -7.171 -0.219 -3.763 376 1HB TYR 68 1HB TYR 68 -6.504 -1.664 -1.177 377 2HB TYR 68 2HB TYR 68 -6.220 -2.389 -2.750 378 HD1 TYR 68 HD1 TYR 68 -4.528 -1.590 -4.291 379 HD2 TYR 68 HD2 TYR 68 -5.110 0.289 -0.453 380 HE1 TYR 68 HE1 TYR 68 -2.234 -0.685 -4.392 381 HE2 TYR 68 HE2 TYR 68 -2.800 1.196 -0.557 382 HH TYR 68 HH TYR 68 -0.594 0.452 -3.270 383 H ARG 69 H ARG 69 -7.786 -2.200 -4.820 384 HA ARG 69 HA ARG 69 -10.159 -3.609 -3.772 385 1HB ARG 69 1HB ARG 69 -11.267 -2.132 -5.197 386 2HB ARG 69 2HB ARG 69 -9.937 -2.019 -6.314 387 1HG ARG 69 1HG ARG 69 -10.408 -4.326 -7.153 388 2HG ARG 69 2HG ARG 69 -11.770 -4.443 -6.015 389 1HD ARG 69 1HD ARG 69 -11.424 -2.345 -8.199 390 2HD ARG 69 2HD ARG 69 -12.398 -3.822 -8.371 391 HE ARG 69 HE ARG 69 -13.544 -2.844 -6.169 392 1HH1 ARG 69 1HH1 ARG 69 -12.935 -1.344 -9.287 393 2HH1 ARG 69 2HH1 ARG 69 -14.144 -0.108 -9.101 394 1HH2 ARG 69 1HH2 ARG 69 -14.991 -1.155 -5.794 395 2HH2 ARG 69 2HH2 ARG 69 -15.433 -0.057 -7.071 396 H ALA 70 H ALA 70 -9.893 -5.694 -3.819 397 HA ALA 70 HA ALA 70 -8.510 -7.037 -6.052 398 1HB ALA 70 1HB ALA 70 -7.039 -7.223 -4.084 399 2HB ALA 70 2HB ALA 70 -8.406 -7.797 -3.107 400 3HB ALA 70 3HB ALA 70 -7.801 -8.781 -4.456 401 H LYS 71 H LYS 71 -9.722 -8.958 -6.674 402 HA LYS 71 HA LYS 71 -12.087 -9.763 -5.131 403 1HB LYS 71 1HB LYS 71 -12.233 -8.978 -8.064 404 2HB LYS 71 2HB LYS 71 -13.569 -9.640 -7.094 405 1HG LYS 71 1HG LYS 71 -13.437 -7.543 -5.682 406 2HG LYS 71 2HG LYS 71 -12.274 -6.884 -6.835 407 1HD LYS 71 1HD LYS 71 -15.146 -7.733 -7.451 408 2HD LYS 71 2HD LYS 71 -14.548 -6.101 -7.191 409 1HE LYS 71 1HE LYS 71 -14.675 -6.194 -9.516 410 2HE LYS 71 2HE LYS 71 -12.957 -6.437 -9.183 411 1HZ LYS 71 1HZ LYS 71 -13.425 -8.851 -9.500 412 2HZ LYS 71 2HZ LYS 71 -14.927 -8.458 -10.006 413 3HZ LYS 71 3HZ LYS 71 -13.574 -7.950 -10.852 414 H ASN 72 H ASN 72 -12.234 -12.085 -5.348 415 HA ASN 72 HA ASN 72 -9.951 -13.170 -6.814 416 1HB ASN 72 1HB ASN 72 -10.377 -14.018 -4.593 417 2HB ASN 72 2HB ASN 72 -11.993 -14.560 -5.073 418 1HD2 ASN 72 1HD2 ASN 72 -10.533 -16.573 -3.966 419 2HD2 ASN 72 2HD2 ASN 72 -9.963 -17.656 -5.233 420 H LEU 73 H LEU 73 -9.923 -13.767 -8.879 421 HA LEU 73 HA LEU 73 -12.446 -14.772 -10.138 422 1HB LEU 73 1HB LEU 73 -10.158 -13.182 -11.356 423 2HB LEU 73 2HB LEU 73 -11.558 -13.811 -12.233 424 HG LEU 73 HG LEU 73 -11.641 -11.695 -10.033 425 1HD1 LEU 73 1HD1 LEU 73 -10.645 -10.887 -12.120 426 2HD1 LEU 73 2HD1 LEU 73 -12.010 -11.540 -13.056 427 3HD1 LEU 73 3HD1 LEU 73 -12.276 -10.227 -11.904 428 1HD2 LEU 73 1HD2 LEU 73 -13.754 -12.951 -10.003 429 2HD2 LEU 73 2HD2 LEU 73 -14.017 -11.395 -10.787 430 3HD2 LEU 73 3HD2 LEU 73 -13.863 -12.861 -11.776 431 H ALA 74 H ALA 74 -10.456 -16.373 -8.703 432 HA ALA 74 HA ALA 74 -9.921 -18.276 -10.952 433 1HB ALA 74 1HB ALA 74 -8.067 -18.160 -9.401 434 2HB ALA 74 2HB ALA 74 -9.146 -18.395 -8.006 435 3HB ALA 74 3HB ALA 74 -8.893 -19.701 -9.186 436 H SER 75 H SER 75 -10.704 -20.559 -10.168 437 HA SER 75 HA SER 75 -13.555 -20.303 -9.300 438 1HB SER 75 1HB SER 75 -13.114 -21.431 -11.459 439 2HB SER 75 2HB SER 75 -12.125 -22.642 -10.602 440 HG SER 75 HG SER 75 -14.067 -22.986 -9.298 441 H THR 76 H THR 76 -10.850 -20.320 -7.642 442 HA THR 76 HA THR 76 -11.756 -22.205 -5.588 443 HB THR 76 HB THR 76 -9.139 -22.763 -5.471 444 HG1 THR 76 HG1 THR 76 -8.378 -21.449 -7.119 445 1HG2 THR 76 1HG2 THR 76 -10.914 -24.441 -5.997 446 2HG2 THR 76 2HG2 THR 76 -10.816 -23.976 -7.710 447 3HG2 THR 76 3HG2 THR 76 -9.416 -24.706 -6.910 448 HA PRO 77 HA PRO 77 -10.352 -18.862 -3.050 449 1HB PRO 77 1HB PRO 77 -9.624 -20.122 -0.726 450 2HB PRO 77 2HB PRO 77 -11.329 -19.951 -1.231 451 1HG PRO 77 1HG PRO 77 -9.513 -22.340 -1.647 452 2HG PRO 77 2HG PRO 77 -11.176 -22.330 -0.987 453 1HD PRO 77 1HD PRO 77 -10.666 -22.901 -3.595 454 2HD PRO 77 2HD PRO 77 -12.110 -21.954 -3.135 455 H THR 78 H THR 78 -8.291 -17.918 -2.548 456 HA THR 78 HA THR 78 -5.872 -19.630 -2.887 457 HB THR 78 HB THR 78 -4.676 -17.864 -3.945 458 HG1 THR 78 HG1 THR 78 -5.503 -15.905 -4.359 459 1HG2 THR 78 1HG2 THR 78 -6.290 -19.190 -5.449 460 2HG2 THR 78 2HG2 THR 78 -7.409 -17.806 -5.295 461 3HG2 THR 78 3HG2 THR 78 -5.820 -17.586 -6.038 462 H THR 79 H THR 79 -3.961 -18.167 -1.842 463 HA THR 79 HA THR 79 -5.021 -16.900 0.610 464 HB THR 79 HB THR 79 -4.283 -19.313 0.981 465 HG1 THR 79 HG1 THR 79 -4.662 -17.879 2.603 466 1HG2 THR 79 1HG2 THR 79 -2.142 -19.169 -0.317 467 2HG2 THR 79 2HG2 THR 79 -1.499 -18.110 0.968 468 3HG2 THR 79 3HG2 THR 79 -1.973 -19.775 1.348 469 H GLY 80 H GLY 80 -4.629 -14.890 0.420 470 1HA GLY 80 1HA GLY 80 -2.591 -13.731 -1.233 471 2HA GLY 80 2HA GLY 80 -3.644 -12.940 -0.069 472 H GLN 81 H GLN 81 -0.579 -14.334 -0.626 473 HA GLN 81 HA GLN 81 0.434 -13.189 1.913 474 1HB GLN 81 1HB GLN 81 1.302 -15.830 0.660 475 2HB GLN 81 2HB GLN 81 2.174 -15.008 1.964 476 1HG GLN 81 1HG GLN 81 -0.732 -15.937 2.241 477 2HG GLN 81 2HG GLN 81 0.662 -16.902 2.700 478 1HE2 GLN 81 1HE2 GLN 81 -0.952 -13.750 3.409 479 2HE2 GLN 81 2HE2 GLN 81 -0.324 -13.673 5.052 480 H ALA 82 H ALA 82 -0.052 -11.794 -0.288 481 HA ALA 82 HA ALA 82 2.498 -11.334 -1.667 482 1HB ALA 82 1HB ALA 82 0.135 -9.458 -1.282 483 2HB ALA 82 2HB ALA 82 1.458 -9.323 -2.450 484 3HB ALA 82 3HB ALA 82 0.263 -10.622 -2.615 485 H THR 83 H THR 83 3.138 -8.813 -1.204 486 HA THR 83 HA THR 83 3.021 -8.064 1.572 487 HB THR 83 HB THR 83 5.862 -8.249 0.897 488 HG1 THR 83 HG1 THR 83 4.364 -10.631 1.278 489 1HG2 THR 83 1HG2 THR 83 4.207 -9.245 3.252 490 2HG2 THR 83 2HG2 THR 83 5.978 -9.093 3.203 491 3HG2 THR 83 3HG2 THR 83 4.969 -7.637 3.118 492 H PHE 84 H PHE 84 4.943 -6.020 1.608 493 HA PHE 84 HA PHE 84 5.045 -4.958 -1.073 494 1HB PHE 84 1HB PHE 84 4.167 -2.730 -0.423 495 2HB PHE 84 2HB PHE 84 2.952 -3.991 -0.536 496 HD1 PHE 84 HD1 PHE 84 5.122 -2.197 1.956 497 HD2 PHE 84 HD2 PHE 84 1.466 -4.385 1.295 498 HE1 PHE 84 HE1 PHE 84 4.456 -1.764 4.275 499 HE2 PHE 84 HE2 PHE 84 0.754 -3.878 3.611 500 HZ PHE 84 HZ PHE 84 2.237 -2.568 5.118 501 H ASN 85 H ASN 85 6.628 -3.559 -1.485 502 HA ASN 85 HA ASN 85 8.688 -3.060 0.623 503 1HB ASN 85 1HB ASN 85 9.604 -4.033 -1.337 504 2HB ASN 85 2HB ASN 85 8.625 -3.042 -2.414 505 1HD2 ASN 85 1HD2 ASN 85 9.019 -0.665 -2.397 506 2HD2 ASN 85 2HD2 ASN 85 10.663 -0.094 -2.267 507 H VAL 86 H VAL 86 7.608 -1.392 1.763 508 HA VAL 86 HA VAL 86 6.477 0.886 0.258 509 HB VAL 86 HB VAL 86 5.230 0.075 2.041 510 1HG1 VAL 86 1HG1 VAL 86 7.410 0.917 3.999 511 2HG1 VAL 86 2HG1 VAL 86 5.796 0.318 4.385 512 3HG1 VAL 86 3HG1 VAL 86 6.964 -0.755 3.608 513 1HG2 VAL 86 1HG2 VAL 86 5.157 2.469 1.381 514 2HG2 VAL 86 2HG2 VAL 86 4.609 2.130 3.023 515 3HG2 VAL 86 3HG2 VAL 86 6.205 2.848 2.763 516 H THR 87 H THR 87 8.667 1.239 -0.820 517 HA THR 87 HA THR 87 9.914 3.422 0.460 518 HB THR 87 HB THR 87 10.913 1.667 1.839 519 HG1 THR 87 HG1 THR 87 13.126 2.299 1.466 520 1HG2 THR 87 1HG2 THR 87 12.203 0.692 -0.729 521 2HG2 THR 87 2HG2 THR 87 12.558 0.107 0.913 522 3HG2 THR 87 3HG2 THR 87 10.938 -0.115 0.224 523 HA PRO 88 HA PRO 88 11.400 3.832 -3.801 524 1HB PRO 88 1HB PRO 88 13.164 5.942 -3.402 525 2HB PRO 88 2HB PRO 88 11.418 6.227 -3.494 526 1HG PRO 88 1HG PRO 88 13.102 6.172 -1.022 527 2HG PRO 88 2HG PRO 88 11.703 7.153 -1.410 528 1HD PRO 88 1HD PRO 88 11.662 4.862 0.149 529 2HD PRO 88 2HD PRO 88 10.232 5.500 -0.650 530 H MET 89 H MET 89 13.201 3.565 -0.760 531 HA MET 89 HA MET 89 15.117 1.726 -1.442 532 1HB MET 89 1HB MET 89 17.179 3.167 -1.648 533 2HB MET 89 2HB MET 89 16.146 3.137 -3.062 534 1HG MET 89 1HG MET 89 15.133 5.378 -2.014 535 2HG MET 89 2HG MET 89 16.683 5.421 -1.180 536 1HE MET 89 1HE MET 89 19.021 5.575 -2.325 537 2HE MET 89 2HE MET 89 18.676 4.155 -3.348 538 3HE MET 89 3HE MET 89 19.250 5.667 -4.087 539 H ALA 90 H ALA 90 15.318 4.954 0.068 540 HA ALA 90 HA ALA 90 16.637 3.762 2.405 541 1HB ALA 90 1HB ALA 90 17.724 5.568 1.118 542 2HB ALA 90 2HB ALA 90 16.332 6.636 1.434 543 3HB ALA 90 3HB ALA 90 17.353 6.080 2.776 544 H ALA 91 H ALA 91 13.533 5.115 1.633 545 HA ALA 91 HA ALA 91 13.059 6.057 4.398 546 1HB ALA 91 1HB ALA 91 10.923 6.823 3.610 547 2HB ALA 91 2HB ALA 91 12.198 7.399 2.527 548 3HB ALA 91 3HB ALA 91 11.161 6.047 2.027 549 H GLY 92 H GLY 92 10.203 4.854 3.501 550 1HA GLY 92 1HA GLY 92 8.913 3.159 4.282 551 2HA GLY 92 2HA GLY 92 10.298 2.073 4.053 552 H ALA 93 H ALA 93 12.043 3.047 6.069 553 HA ALA 93 HA ALA 93 11.088 2.161 8.556 554 1HB ALA 93 1HB ALA 93 13.455 2.605 8.129 555 2HB ALA 93 2HB ALA 93 13.140 4.338 7.925 556 3HB ALA 93 3HB ALA 93 12.911 3.575 9.511 557 H TYR 94 H TYR 94 11.345 5.571 7.428 558 HA TYR 94 HA TYR 94 9.377 6.605 9.270 559 1HB TYR 94 1HB TYR 94 10.612 7.946 6.862 560 2HB TYR 94 2HB TYR 94 9.990 8.683 8.336 561 HD1 TYR 94 HD1 TYR 94 11.314 7.676 10.568 562 HD2 TYR 94 HD2 TYR 94 12.884 7.600 6.555 563 HE1 TYR 94 HE1 TYR 94 13.544 7.051 11.439 564 HE2 TYR 94 HE2 TYR 94 15.096 6.943 7.430 565 HH TYR 94 HH TYR 94 16.341 6.377 9.306 566 H PHE 95 H PHE 95 8.058 4.628 8.155 567 HA PHE 95 HA PHE 95 6.163 6.075 6.395 568 1HB PHE 95 1HB PHE 95 6.867 4.061 5.162 569 2HB PHE 95 2HB PHE 95 6.544 3.070 6.583 570 HD1 PHE 95 HD1 PHE 95 4.450 5.806 4.984 571 HD2 PHE 95 HD2 PHE 95 4.707 1.647 6.130 572 HE1 PHE 95 HE1 PHE 95 2.052 5.537 4.579 573 HE2 PHE 95 HE2 PHE 95 2.342 1.343 5.440 574 HZ PHE 95 HZ PHE 95 1.037 3.319 4.557 575 H ASN 96 H ASN 96 4.113 5.909 7.035 576 HA ASN 96 HA ASN 96 3.457 6.388 9.479 577 1HB ASN 96 1HB ASN 96 1.566 4.996 7.520 578 2HB ASN 96 2HB ASN 96 1.065 5.964 8.909 579 1HD2 ASN 96 1HD2 ASN 96 3.730 7.757 7.949 580 2HD2 ASN 96 2HD2 ASN 96 2.790 8.847 6.983 581 H LYS 97 H LYS 97 3.040 3.228 7.945 582 HA LYS 97 HA LYS 97 3.160 1.066 8.723 583 1HB LYS 97 1HB LYS 97 5.365 2.215 8.856 584 2HB LYS 97 2HB LYS 97 5.057 2.521 10.575 585 1HG LYS 97 1HG LYS 97 5.230 0.090 11.025 586 2HG LYS 97 2HG LYS 97 5.301 -0.229 9.282 587 1HD LYS 97 1HD LYS 97 7.563 -0.312 10.101 588 2HD LYS 97 2HD LYS 97 7.385 1.162 9.137 589 1HE LYS 97 1HE LYS 97 6.970 2.396 11.414 590 2HE LYS 97 2HE LYS 97 7.498 0.895 12.182 591 1HZ LYS 97 1HZ LYS 97 9.266 2.462 11.940 592 2HZ LYS 97 2HZ LYS 97 9.592 1.208 10.922 593 3HZ LYS 97 3HZ LYS 97 9.007 2.641 10.339 594 H VAL 98 H VAL 98 0.876 2.172 9.775 595 HA VAL 98 HA VAL 98 0.697 2.218 12.568 596 HB VAL 98 HB VAL 98 -0.936 3.202 11.027 597 1HG1 VAL 98 1HG1 VAL 98 -2.067 0.404 10.597 598 2HG1 VAL 98 2HG1 VAL 98 -2.680 1.937 9.960 599 3HG1 VAL 98 3HG1 VAL 98 -1.129 1.307 9.387 600 1HG2 VAL 98 1HG2 VAL 98 -1.526 2.881 13.372 601 2HG2 VAL 98 2HG2 VAL 98 -2.947 2.674 12.337 602 3HG2 VAL 98 3HG2 VAL 98 -2.143 1.252 13.028 603 H GLN 99 H GLN 99 0.606 0.669 14.108 604 HA GLN 99 HA GLN 99 1.036 -2.120 13.351 605 1HB GLN 99 1HB GLN 99 0.815 -0.724 16.047 606 2HB GLN 99 2HB GLN 99 1.235 -2.430 15.806 607 1HG GLN 99 1HG GLN 99 3.229 -1.795 14.501 608 2HG GLN 99 2HG GLN 99 2.807 -0.083 14.627 609 1HE2 GLN 99 1HE2 GLN 99 3.094 -2.859 16.960 610 2HE2 GLN 99 2HE2 GLN 99 4.077 -1.948 18.094 611 H CYS 100 H CYS 100 -1.142 -1.964 12.165 612 HA CYS 100 HA CYS 100 -3.235 -3.288 13.737 613 1HB CYS 100 1HB CYS 100 -3.767 -0.933 14.191 614 2HB CYS 100 2HB CYS 100 -3.593 -0.528 12.467 615 HG CYS 100 HG CYS 100 -6.106 -0.496 13.174 616 H PHE 101 H PHE 101 -4.722 -4.328 12.287 617 HA PHE 101 HA PHE 101 -3.607 -5.190 9.795 618 1HB PHE 101 1HB PHE 101 -6.367 -5.605 11.013 619 2HB PHE 101 2HB PHE 101 -5.692 -6.525 9.687 620 HD1 PHE 101 HD1 PHE 101 -5.873 -6.245 13.307 621 HD2 PHE 101 HD2 PHE 101 -3.594 -7.922 10.047 622 HE1 PHE 101 HE1 PHE 101 -4.755 -7.798 14.880 623 HE2 PHE 101 HE2 PHE 101 -2.496 -9.488 11.627 624 HZ PHE 101 HZ PHE 101 -3.070 -9.423 14.047 625 H CYS 102 H CYS 102 -3.667 -2.587 9.260 626 HA CYS 102 HA CYS 102 -6.182 -1.724 7.972 627 1HB CYS 102 1HB CYS 102 -3.432 -0.464 8.297 628 2HB CYS 102 2HB CYS 102 -4.751 0.281 7.365 629 HG CYS 102 HG CYS 102 -4.990 -0.815 10.446 630 H PHE 103 H PHE 103 -5.982 -3.805 6.806 631 HA PHE 103 HA PHE 103 -6.143 -4.319 4.417 632 1HB PHE 103 1HB PHE 103 -4.560 -2.617 3.579 633 2HB PHE 103 2HB PHE 103 -3.217 -3.496 4.321 634 HD1 PHE 103 HD1 PHE 103 -2.385 -5.602 3.369 635 HD2 PHE 103 HD2 PHE 103 -5.718 -3.511 1.585 636 HE1 PHE 103 HE1 PHE 103 -2.198 -7.018 1.332 637 HE2 PHE 103 HE2 PHE 103 -5.507 -4.922 -0.444 638 HZ PHE 103 HZ PHE 103 -3.737 -6.676 -0.562 639 H THR 104 H THR 104 -6.320 -6.488 4.591 640 HA THR 104 HA THR 104 -3.991 -8.135 5.169 641 HB THR 104 HB THR 104 -6.439 -8.326 6.982 642 HG1 THR 104 HG1 THR 104 -4.062 -6.991 7.167 643 1HG2 THR 104 1HG2 THR 104 -5.095 -10.031 8.175 644 2HG2 THR 104 2HG2 THR 104 -5.439 -10.552 6.518 645 3HG2 THR 104 3HG2 THR 104 -3.830 -9.919 6.936 646 H GLU 105 H GLU 105 -4.288 -8.620 3.019 647 HA GLU 105 HA GLU 105 -6.576 -9.153 1.640 648 1HB GLU 105 1HB GLU 105 -5.041 -10.274 0.018 649 2HB GLU 105 2HB GLU 105 -4.551 -8.684 0.560 650 1HG GLU 105 1HG GLU 105 -2.890 -9.724 2.142 651 2HG GLU 105 2HG GLU 105 -3.393 -11.317 1.570 652 H THR 106 H THR 106 -4.910 -11.460 3.705 653 HA THR 106 HA THR 106 -5.471 -13.580 4.398 654 HB THR 106 HB THR 106 -7.116 -12.172 5.501 655 HG1 THR 106 HG1 THR 106 -8.456 -13.868 6.066 656 1HG2 THR 106 1HG2 THR 106 -8.526 -11.243 3.778 657 2HG2 THR 106 2HG2 THR 106 -9.025 -12.851 3.219 658 3HG2 THR 106 3HG2 THR 106 -9.518 -12.259 4.812 659 H THR 107 H THR 107 -8.041 -14.882 3.684 660 HA THR 107 HA THR 107 -7.294 -15.978 1.005 661 HB THR 107 HB THR 107 -7.854 -17.251 3.641 662 HG1 THR 107 HG1 THR 107 -6.562 -18.088 1.271 663 1HG2 THR 107 1HG2 THR 107 -8.903 -18.476 1.038 664 2HG2 THR 107 2HG2 THR 107 -8.647 -19.368 2.552 665 3HG2 THR 107 3HG2 THR 107 -9.860 -18.085 2.487 666 H LEU 108 H LEU 108 -8.753 -15.601 -0.481 667 HA LEU 108 HA LEU 108 -11.416 -14.563 0.278 668 1HB LEU 108 1HB LEU 108 -9.350 -13.319 -0.935 669 2HB LEU 108 2HB LEU 108 -10.063 -14.069 -2.372 670 HG LEU 108 HG LEU 108 -11.172 -12.119 -0.400 671 1HD1 LEU 108 1HD1 LEU 108 -11.383 -10.669 -2.453 672 2HD1 LEU 108 2HD1 LEU 108 -9.707 -11.211 -2.198 673 3HD1 LEU 108 3HD1 LEU 108 -10.719 -11.983 -3.427 674 1HD2 LEU 108 1HD2 LEU 108 -13.255 -12.013 -1.697 675 2HD2 LEU 108 2HD2 LEU 108 -12.707 -13.392 -2.688 676 3HD2 LEU 108 3HD2 LEU 108 -13.054 -13.585 -0.944 677 H GLU 109 H GLU 109 -13.188 -15.726 -0.537 678 HA GLU 109 HA GLU 109 -12.706 -18.146 -2.001 679 1HB GLU 109 1HB GLU 109 -15.328 -16.860 -1.133 680 2HB GLU 109 2HB GLU 109 -15.098 -18.529 -1.659 681 1HG GLU 109 1HG GLU 109 -13.365 -18.773 0.218 682 2HG GLU 109 2HG GLU 109 -13.995 -17.247 0.866 683 HA PRO 110 HA PRO 110 -12.957 -16.853 -6.055 684 1HB PRO 110 1HB PRO 110 -14.135 -18.901 -7.431 685 2HB PRO 110 2HB PRO 110 -12.553 -18.996 -6.605 686 1HG PRO 110 1HG PRO 110 -15.263 -19.869 -5.550 687 2HG PRO 110 2HG PRO 110 -13.770 -20.846 -5.593 688 1HD PRO 110 1HD PRO 110 -14.502 -19.520 -3.383 689 2HD PRO 110 2HD PRO 110 -12.787 -19.538 -3.849 690 H GLY 111 H GLY 111 -14.119 -15.045 -6.485 691 1HA GLY 111 1HA GLY 111 -16.037 -14.388 -7.993 692 2HA GLY 111 2HA GLY 111 -17.082 -15.182 -6.792 693 H GLU 112 H GLU 112 -15.218 -14.492 -4.584 694 HA GLU 112 HA GLU 112 -16.809 -12.212 -3.980 695 1HB GLU 112 1HB GLU 112 -14.935 -13.870 -2.258 696 2HB GLU 112 2HB GLU 112 -16.194 -12.769 -1.720 697 1HG GLU 112 1HG GLU 112 -16.533 -15.379 -3.113 698 2HG GLU 112 2HG GLU 112 -17.105 -14.884 -1.524 699 H GLU 113 H GLU 113 -15.799 -10.616 -2.300 700 HA GLU 113 HA GLU 113 -13.878 -9.057 -3.931 701 1HB GLU 113 1HB GLU 113 -16.074 -8.237 -4.192 702 2HB GLU 113 2HB GLU 113 -16.453 -8.411 -2.478 703 1HG GLU 113 1HG GLU 113 -14.340 -6.483 -3.235 704 2HG GLU 113 2HG GLU 113 -16.033 -6.108 -3.556 705 H MET 114 H MET 114 -12.337 -7.836 -2.957 706 HA MET 114 HA MET 114 -12.299 -7.425 -0.059 707 1HB MET 114 1HB MET 114 -10.203 -8.834 -1.724 708 2HB MET 114 2HB MET 114 -9.620 -7.739 -0.472 709 1HG MET 114 1HG MET 114 -11.625 -9.825 0.329 710 2HG MET 114 2HG MET 114 -9.944 -10.259 0.009 711 1HE MET 114 1HE MET 114 -12.249 -8.034 2.283 712 2HE MET 114 2HE MET 114 -11.059 -7.406 3.445 713 3HE MET 114 3HE MET 114 -11.034 -6.829 1.766 714 H GLU 115 H GLU 115 -13.124 -5.322 -0.843 715 HA GLU 115 HA GLU 115 -10.785 -3.662 -1.630 716 1HB GLU 115 1HB GLU 115 -12.121 -2.159 -2.911 717 2HB GLU 115 2HB GLU 115 -12.340 -3.811 -3.522 718 1HG GLU 115 1HG GLU 115 -14.530 -3.929 -2.367 719 2HG GLU 115 2HG GLU 115 -14.343 -2.234 -1.882 720 H MET 116 H MET 116 -10.268 -1.963 -0.394 721 HA MET 116 HA MET 116 -12.063 -1.166 1.770 722 1HB MET 116 1HB MET 116 -9.519 -2.751 2.350 723 2HB MET 116 2HB MET 116 -10.391 -1.783 3.540 724 1HG MET 116 1HG MET 116 -12.451 -3.207 3.056 725 2HG MET 116 2HG MET 116 -11.394 -4.254 2.103 726 1HE MET 116 1HE MET 116 -10.683 -2.473 5.656 727 2HE MET 116 2HE MET 116 -12.392 -2.983 5.640 728 3HE MET 116 3HE MET 116 -11.220 -3.807 6.693 729 HA PRO 117 HA PRO 117 -9.471 2.492 1.477 730 1HB PRO 117 1HB PRO 117 -10.048 3.675 3.871 731 2HB PRO 117 2HB PRO 117 -10.990 3.786 2.359 732 1HG PRO 117 1HG PRO 117 -11.571 2.146 4.774 733 2HG PRO 117 2HG PRO 117 -12.659 2.892 3.552 734 1HD PRO 117 1HD PRO 117 -11.950 0.177 3.663 735 2HD PRO 117 2HD PRO 117 -12.616 1.027 2.236 736 H VAL 118 H VAL 118 -7.467 2.924 1.872 737 HA VAL 118 HA VAL 118 -6.166 2.174 4.434 738 HB VAL 118 HB VAL 118 -5.048 2.128 1.593 739 1HG1 VAL 118 1HG1 VAL 118 -2.809 1.755 2.598 740 2HG1 VAL 118 2HG1 VAL 118 -3.414 3.393 2.840 741 3HG1 VAL 118 3HG1 VAL 118 -3.463 2.218 4.184 742 1HG2 VAL 118 1HG2 VAL 118 -4.286 -0.120 2.231 743 2HG2 VAL 118 2HG2 VAL 118 -4.996 0.086 3.847 744 3HG2 VAL 118 3HG2 VAL 118 -6.040 0.026 2.411 745 H VAL 119 H VAL 119 -4.696 3.958 5.092 746 HA VAL 119 HA VAL 119 -5.310 6.559 3.809 747 HB VAL 119 HB VAL 119 -5.147 7.569 6.092 748 1HG1 VAL 119 1HG1 VAL 119 -7.480 5.663 5.637 749 2HG1 VAL 119 2HG1 VAL 119 -7.473 7.065 6.724 750 3HG1 VAL 119 3HG1 VAL 119 -7.313 7.304 4.978 751 1HG2 VAL 119 1HG2 VAL 119 -5.628 4.720 7.100 752 2HG2 VAL 119 2HG2 VAL 119 -4.098 5.602 7.273 753 3HG2 VAL 119 3HG2 VAL 119 -5.567 6.203 8.059 754 H PHE 120 H PHE 120 -3.558 8.078 3.873 755 HA PHE 120 HA PHE 120 -0.903 6.950 4.604 756 1HB PHE 120 1HB PHE 120 -1.966 6.427 2.136 757 2HB PHE 120 2HB PHE 120 -1.245 7.990 1.829 758 HD1 PHE 120 HD1 PHE 120 1.334 8.199 2.598 759 HD2 PHE 120 HD2 PHE 120 -0.718 4.447 2.020 760 HE1 PHE 120 HE1 PHE 120 3.498 7.057 2.199 761 HE2 PHE 120 HE2 PHE 120 1.456 3.338 1.576 762 HZ PHE 120 HZ PHE 120 3.557 4.663 1.589 763 H PHE 121 H PHE 121 0.552 8.522 5.136 764 HA PHE 121 HA PHE 121 0.455 11.303 4.233 765 1HB PHE 121 1HB PHE 121 0.035 12.079 6.593 766 2HB PHE 121 2HB PHE 121 -1.352 11.553 5.679 767 HD1 PHE 121 HD1 PHE 121 -2.496 9.407 6.245 768 HD2 PHE 121 HD2 PHE 121 0.668 10.989 8.674 769 HE1 PHE 121 HE1 PHE 121 -2.785 7.519 7.850 770 HE2 PHE 121 HE2 PHE 121 0.377 9.133 10.285 771 HZ PHE 121 HZ PHE 121 -1.307 7.346 9.836 772 H VAL 122 H VAL 122 2.716 10.848 3.766 773 HA VAL 122 HA VAL 122 4.389 9.286 5.222 774 HB VAL 122 HB VAL 122 5.268 11.796 3.748 775 1HG1 VAL 122 1HG1 VAL 122 7.139 10.888 4.982 776 2HG1 VAL 122 2HG1 VAL 122 6.740 9.231 4.492 777 3HG1 VAL 122 3HG1 VAL 122 7.327 10.412 3.310 778 1HG2 VAL 122 1HG2 VAL 122 3.952 10.647 2.164 779 2HG2 VAL 122 2HG2 VAL 122 5.575 10.049 1.840 780 3HG2 VAL 122 3HG2 VAL 122 4.433 9.059 2.765 781 H ASP 123 H ASP 123 5.896 9.365 6.957 782 HA ASP 123 HA ASP 123 5.302 11.262 8.955 783 1HB ASP 123 1HB ASP 123 7.596 9.272 8.828 784 2HB ASP 123 2HB ASP 123 6.846 9.991 10.267 785 HA PRO 124 HA PRO 124 8.655 14.102 7.668 786 1HB PRO 124 1HB PRO 124 8.188 16.189 9.453 787 2HB PRO 124 2HB PRO 124 7.342 15.845 7.942 788 1HG PRO 124 1HG PRO 124 6.481 15.244 10.745 789 2HG PRO 124 2HG PRO 124 5.439 15.768 9.379 790 1HD PRO 124 1HD PRO 124 5.744 13.155 10.315 791 2HD PRO 124 2HD PRO 124 5.165 13.581 8.684 792 H GLU 125 H GLU 125 9.127 11.838 9.426 793 HA GLU 125 HA GLU 125 11.432 12.746 11.036 794 1HB GLU 125 1HB GLU 125 10.618 9.889 10.437 795 2HB GLU 125 2HB GLU 125 11.621 10.507 11.756 796 1HG GLU 125 1HG GLU 125 9.424 11.761 12.461 797 2HG GLU 125 2HG GLU 125 8.635 10.622 11.373 798 H ILE 126 H ILE 126 10.353 11.577 7.840 799 HA ILE 126 HA ILE 126 12.579 10.186 7.047 800 HB ILE 126 HB ILE 126 10.402 10.135 6.080 801 1HG1 ILE 126 1HG1 ILE 126 12.760 9.539 5.019 802 2HG1 ILE 126 2HG1 ILE 126 11.258 9.306 4.176 803 1HG2 ILE 126 1HG2 ILE 126 10.999 12.784 4.701 804 2HG2 ILE 126 2HG2 ILE 126 9.622 11.705 4.417 805 3HG2 ILE 126 3HG2 ILE 126 9.810 12.524 5.969 806 1HD1 ILE 126 1HD1 ILE 126 13.011 10.372 2.801 807 2HD1 ILE 126 2HD1 ILE 126 11.523 11.337 2.941 808 3HD1 ILE 126 3HD1 ILE 126 12.965 11.785 3.886 809 H VAL 127 H VAL 127 11.965 13.706 6.712 810 HA VAL 127 HA VAL 127 14.610 14.140 5.484 811 HB VAL 127 HB VAL 127 13.947 16.567 5.683 812 1HG1 VAL 127 1HG1 VAL 127 12.153 14.718 4.072 813 2HG1 VAL 127 2HG1 VAL 127 12.433 16.444 3.766 814 3HG1 VAL 127 3HG1 VAL 127 13.770 15.291 3.613 815 1HG2 VAL 127 1HG2 VAL 127 11.653 17.169 6.063 816 2HG2 VAL 127 2HG2 VAL 127 11.151 15.488 6.274 817 3HG2 VAL 127 3HG2 VAL 127 12.183 16.268 7.491 818 H LYS 128 H LYS 128 15.361 12.858 7.495 819 HA LYS 128 HA LYS 128 16.661 14.907 9.176 820 1HB LYS 128 1HB LYS 128 15.285 12.533 10.474 821 2HB LYS 128 2HB LYS 128 16.445 13.625 11.241 822 1HG LYS 128 1HG LYS 128 14.880 15.530 10.647 823 2HG LYS 128 2HG LYS 128 13.711 14.316 10.094 824 1HD LYS 128 1HD LYS 128 13.734 13.279 12.370 825 2HD LYS 128 2HD LYS 128 14.867 14.542 12.904 826 1HE LYS 128 1HE LYS 128 13.119 16.266 12.169 827 2HE LYS 128 2HE LYS 128 11.991 14.931 11.915 828 1HZ LYS 128 1HZ LYS 128 13.257 15.662 14.480 829 2HZ LYS 128 2HZ LYS 128 11.706 15.958 14.046 830 3HZ LYS 128 3HZ LYS 128 12.198 14.426 14.313 831 HA PRO 129 HA PRO 129 19.674 11.406 9.392 832 1HB PRO 129 1HB PRO 129 19.268 8.839 8.561 833 2HB PRO 129 2HB PRO 129 18.610 9.458 10.103 834 1HG PRO 129 1HG PRO 129 17.188 9.359 7.414 835 2HG PRO 129 2HG PRO 129 16.645 8.670 8.965 836 1HD PRO 129 1HD PRO 129 15.741 11.059 8.268 837 2HD PRO 129 2HD PRO 129 16.315 10.759 9.933 838 H VAL 130 H VAL 130 21.387 10.580 8.124 839 HA VAL 130 HA VAL 130 21.813 11.689 5.604 840 HB VAL 130 HB VAL 130 23.158 9.365 7.044 841 1HG1 VAL 130 1HG1 VAL 130 24.105 11.054 4.698 842 2HG1 VAL 130 2HG1 VAL 130 25.135 9.952 5.642 843 3HG1 VAL 130 3HG1 VAL 130 23.797 9.301 4.691 844 1HG2 VAL 130 1HG2 VAL 130 24.814 11.100 7.701 845 2HG2 VAL 130 2HG2 VAL 130 23.823 12.345 6.917 846 3HG2 VAL 130 3HG2 VAL 130 23.217 11.483 8.346 847 H GLU 131 H GLU 131 20.562 8.530 6.543 848 HA GLU 131 HA GLU 131 20.585 6.902 4.338 849 1HB GLU 131 1HB GLU 131 18.166 7.576 6.082 850 2HB GLU 131 2HB GLU 131 18.361 6.118 5.112 851 1HG GLU 131 1HG GLU 131 20.208 5.370 6.524 852 2HG GLU 131 2HG GLU 131 20.131 6.839 7.504 853 H THR 132 H THR 132 18.175 9.473 4.883 854 HA THR 132 HA THR 132 17.076 8.926 2.223 855 HB THR 132 HB THR 132 15.194 10.329 3.447 856 HG1 THR 132 HG1 THR 132 15.532 10.568 5.621 857 1HG2 THR 132 1HG2 THR 132 14.578 8.305 4.869 858 2HG2 THR 132 2HG2 THR 132 14.985 7.898 3.191 859 3HG2 THR 132 3HG2 THR 132 16.152 7.611 4.500 860 H GLN 133 H GLN 133 17.948 11.578 4.367 861 HA GLN 133 HA GLN 133 17.970 13.871 3.935 862 1HB GLN 133 1HB GLN 133 20.218 12.428 4.146 863 2HB GLN 133 2HB GLN 133 20.500 12.975 2.525 864 1HG GLN 133 1HG GLN 133 21.598 14.474 4.056 865 2HG GLN 133 2HG GLN 133 20.268 15.351 3.291 866 1HE2 GLN 133 1HE2 GLN 133 19.309 13.044 5.800 867 2HE2 GLN 133 2HE2 GLN 133 19.127 14.202 7.075 868 H GLY 134 H GLY 134 16.125 13.634 2.149 869 1HA GLY 134 1HA GLY 134 15.989 15.530 0.371 870 2HA GLY 134 2HA GLY 134 17.163 14.542 -0.511 871 H ILE 135 H ILE 135 15.961 11.968 0.494 872 HA ILE 135 HA ILE 135 14.094 11.413 -1.571 873 HB ILE 135 HB ILE 135 14.716 10.139 1.091 874 1HG1 ILE 135 1HG1 ILE 135 16.375 10.060 -0.814 875 2HG1 ILE 135 2HG1 ILE 135 15.819 8.501 -0.215 876 1HG2 ILE 135 1HG2 ILE 135 12.394 9.536 0.757 877 2HG2 ILE 135 2HG2 ILE 135 12.673 9.201 -0.955 878 3HG2 ILE 135 3HG2 ILE 135 13.396 8.161 0.300 879 1HD1 ILE 135 1HD1 ILE 135 15.981 8.601 -2.678 880 2HD1 ILE 135 2HD1 ILE 135 14.352 8.193 -2.116 881 3HD1 ILE 135 3HD1 ILE 135 14.699 9.823 -2.730 882 H LYS 136 H LYS 136 11.921 11.613 -1.755 883 HA LYS 136 HA LYS 136 10.306 11.659 0.551 884 1HB LYS 136 1HB LYS 136 9.081 13.799 0.024 885 2HB LYS 136 2HB LYS 136 10.582 13.848 0.952 886 1HG LYS 136 1HG LYS 136 11.794 14.544 -1.109 887 2HG LYS 136 2HG LYS 136 10.240 14.526 -1.986 888 1HD LYS 136 1HD LYS 136 9.284 15.959 -0.056 889 2HD LYS 136 2HD LYS 136 10.935 16.109 0.546 890 1HE LYS 136 1HE LYS 136 11.553 17.315 -1.559 891 2HE LYS 136 2HE LYS 136 9.890 17.110 -2.155 892 1HZ LYS 136 1HZ LYS 136 10.209 19.292 -1.139 893 2HZ LYS 136 2HZ LYS 136 9.131 18.467 -0.219 894 3HZ LYS 136 3HZ LYS 136 10.612 18.622 0.305 895 H THR 137 H THR 137 10.353 9.786 -1.137 896 HA THR 137 HA THR 137 7.833 9.920 -2.667 897 HB THR 137 HB THR 137 9.240 8.364 -4.301 898 HG1 THR 137 HG1 THR 137 11.368 9.172 -4.540 899 1HG2 THR 137 1HG2 THR 137 9.115 11.378 -4.340 900 2HG2 THR 137 2HG2 THR 137 9.688 10.410 -5.732 901 3HG2 THR 137 3HG2 THR 137 8.046 10.165 -5.102 902 H LEU 138 H LEU 138 6.887 8.784 -1.027 903 HA LEU 138 HA LEU 138 8.175 6.247 -0.201 904 1HB LEU 138 1HB LEU 138 6.093 7.979 0.693 905 2HB LEU 138 2HB LEU 138 5.492 6.291 0.677 906 HG LEU 138 HG LEU 138 7.645 5.706 1.853 907 1HD1 LEU 138 1HD1 LEU 138 9.074 7.544 1.506 908 2HD1 LEU 138 2HD1 LEU 138 7.879 8.688 2.125 909 3HD1 LEU 138 3HD1 LEU 138 8.689 7.558 3.235 910 1HD2 LEU 138 1HD2 LEU 138 5.707 7.423 3.465 911 2HD2 LEU 138 2HD2 LEU 138 5.557 5.706 3.063 912 3HD2 LEU 138 3HD2 LEU 138 6.844 6.267 4.132 913 H THR 139 H THR 139 8.577 5.515 -2.225 914 HA THR 139 HA THR 139 6.476 4.721 -3.989 915 HB THR 139 HB THR 139 9.362 4.041 -3.657 916 HG1 THR 139 HG1 THR 139 9.467 5.251 -5.613 917 1HG2 THR 139 1HG2 THR 139 9.293 2.958 -5.930 918 2HG2 THR 139 2HG2 THR 139 8.602 2.020 -4.610 919 3HG2 THR 139 3HG2 THR 139 7.521 2.873 -5.753 920 H LEU 140 H LEU 140 4.988 3.247 -3.275 921 HA LEU 140 HA LEU 140 5.892 0.924 -1.677 922 1HB LEU 140 1HB LEU 140 3.617 1.847 -1.255 923 2HB LEU 140 2HB LEU 140 3.186 1.526 -2.944 924 HG LEU 140 HG LEU 140 4.310 -0.804 -1.490 925 1HD1 LEU 140 1HD1 LEU 140 3.015 0.139 0.345 926 2HD1 LEU 140 2HD1 LEU 140 1.600 0.350 -0.714 927 3HD1 LEU 140 3HD1 LEU 140 2.170 -1.279 -0.299 928 1HD2 LEU 140 1HD2 LEU 140 3.327 -0.951 -3.802 929 2HD2 LEU 140 2HD2 LEU 140 2.487 -1.988 -2.640 930 3HD2 LEU 140 3HD2 LEU 140 1.763 -0.446 -3.138 931 H SER 141 H SER 141 6.497 -0.970 -2.850 932 HA SER 141 HA SER 141 5.304 -1.184 -5.478 933 1HB SER 141 1HB SER 141 7.606 -0.397 -6.031 934 2HB SER 141 2HB SER 141 8.250 -1.798 -5.156 935 HG SER 141 HG SER 141 6.698 -1.797 -7.573 936 H TYR 142 H TYR 142 4.634 -3.288 -5.947 937 HA TYR 142 HA TYR 142 6.210 -5.340 -4.946 938 1HB TYR 142 1HB TYR 142 4.383 -4.827 -2.991 939 2HB TYR 142 2HB TYR 142 3.468 -5.965 -3.914 940 HD1 TYR 142 HD1 TYR 142 7.002 -5.605 -2.580 941 HD2 TYR 142 HD2 TYR 142 3.726 -8.273 -3.437 942 HE1 TYR 142 HE1 TYR 142 8.121 -7.395 -1.306 943 HE2 TYR 142 HE2 TYR 142 4.920 -10.101 -2.276 944 HH TYR 142 HH TYR 142 6.457 -10.237 -0.340 945 H THR 143 H THR 143 5.415 -7.474 -5.325 946 HA THR 143 HA THR 143 3.775 -7.786 -7.807 947 HB THR 143 HB THR 143 6.268 -9.247 -6.813 948 HG1 THR 143 HG1 THR 143 7.092 -8.432 -8.767 949 1HG2 THR 143 1HG2 THR 143 4.747 -10.873 -7.711 950 2HG2 THR 143 2HG2 THR 143 4.410 -9.869 -9.142 951 3HG2 THR 143 3HG2 THR 143 6.024 -10.596 -8.903 952 H PHE 144 H PHE 144 1.853 -8.248 -6.948 953 HA PHE 144 HA PHE 144 1.434 -10.139 -4.757 954 1HB PHE 144 1HB PHE 144 -0.272 -8.756 -6.853 955 2HB PHE 144 2HB PHE 144 -0.897 -10.078 -5.919 956 HD1 PHE 144 HD1 PHE 144 -2.640 -8.742 -4.854 957 HD2 PHE 144 HD2 PHE 144 1.479 -7.466 -4.553 958 HE1 PHE 144 HE1 PHE 144 -3.151 -7.551 -2.767 959 HE2 PHE 144 HE2 PHE 144 0.941 -6.236 -2.494 960 HZ PHE 144 HZ PHE 144 -1.355 -6.343 -1.540 961 H TYR 145 H TYR 145 2.446 -12.109 -5.108 962 HA TYR 145 HA TYR 145 1.336 -13.820 -7.238 963 1HB TYR 145 1HB TYR 145 3.300 -14.313 -8.307 964 2HB TYR 145 2HB TYR 145 3.296 -12.564 -8.161 965 HD1 TYR 145 HD1 TYR 145 4.406 -12.491 -5.174 966 HD2 TYR 145 HD2 TYR 145 5.589 -14.644 -8.729 967 HE1 TYR 145 HE1 TYR 145 6.686 -12.685 -4.299 968 HE2 TYR 145 HE2 TYR 145 7.871 -14.862 -7.818 969 HH TYR 145 HH TYR 145 9.269 -14.438 -6.033 970 HA PRO 146 HA PRO 146 2.617 -16.154 -3.366 971 1HB PRO 146 1HB PRO 146 0.263 -16.558 -2.017 972 2HB PRO 146 2HB PRO 146 1.289 -15.107 -1.867 973 1HG PRO 146 1HG PRO 146 -1.184 -15.428 -3.588 974 2HG PRO 146 2HG PRO 146 -0.755 -14.077 -2.518 975 1HD PRO 146 1HD PRO 146 -0.256 -13.964 -5.185 976 2HD PRO 146 2HD PRO 146 0.845 -13.238 -3.968 977 H ARG 147 H ARG 147 -0.774 -17.238 -4.220 978 HA ARG 147 HA ARG 147 0.363 -19.828 -5.133 979 1HB ARG 147 1HB ARG 147 -1.293 -19.513 -2.602 980 2HB ARG 147 2HB ARG 147 -0.879 -21.043 -3.389 981 1HG ARG 147 1HG ARG 147 1.556 -20.512 -3.057 982 2HG ARG 147 2HG ARG 147 1.075 -19.072 -2.148 983 1HD ARG 147 1HD ARG 147 -0.250 -20.631 -0.587 984 2HD ARG 147 2HD ARG 147 0.464 -21.974 -1.466 985 HE ARG 147 HE ARG 147 2.426 -21.704 -0.349 986 1HH1 ARG 147 1HH1 ARG 147 0.591 -18.711 -0.058 987 2HH1 ARG 147 2HH1 ARG 147 1.673 -17.956 1.074 988 1HH2 ARG 147 1HH2 ARG 147 3.887 -20.744 1.174 989 2HH2 ARG 147 2HH2 ARG 147 3.584 -19.158 1.799 990 H GLU 148 H GLU 148 -0.729 -20.005 -7.002 991 HA GLU 148 HA GLU 148 -3.505 -20.764 -6.837 992 1HB GLU 148 1HB GLU 148 -4.007 -18.527 -7.294 993 2HB GLU 148 2HB GLU 148 -2.591 -18.307 -8.340 994 1HG GLU 148 1HG GLU 148 -4.585 -18.276 -9.701 995 2HG GLU 148 2HG GLU 148 -3.628 -19.672 -10.111 996 HA PRO 149 HA PRO 149 -1.346 -23.356 -9.888 997 1HB PRO 149 1HB PRO 149 -3.439 -24.902 -10.795 998 2HB PRO 149 2HB PRO 149 -2.589 -25.158 -9.244 999 1HG PRO 149 1HG PRO 149 -5.189 -23.674 -9.703 1000 2HG PRO 149 2HG PRO 149 -4.834 -24.909 -8.464 1001 1HD PRO 149 1HD PRO 149 -4.741 -22.291 -7.863 1002 2HD PRO 149 2HD PRO 149 -3.503 -23.387 -7.212 1003 H SER 150 H SER 150 -4.593 -21.958 -10.888 1004 HA SER 150 HA SER 150 -3.718 -20.765 -13.268 1005 1HB SER 150 1HB SER 150 -4.644 -22.594 -14.866 1006 2HB SER 150 2HB SER 150 -2.993 -22.754 -14.257 1007 HG SER 150 HG SER 150 -4.154 -24.717 -14.082 1008 H LYS 151 H LYS 151 -5.352 -19.257 -13.182 1009 HA LYS 151 HA LYS 151 -7.944 -19.978 -12.229 1010 1HB LYS 151 1HB LYS 151 -8.605 -17.728 -12.619 1011 2HB LYS 151 2HB LYS 151 -7.018 -17.788 -11.846 1012 1HG LYS 151 1HG LYS 151 -6.000 -17.233 -14.104 1013 2HG LYS 151 2HG LYS 151 -7.646 -17.133 -14.760 1014 1HD LYS 151 1HD LYS 151 -8.183 -15.451 -12.928 1015 2HD LYS 151 2HD LYS 151 -6.441 -15.390 -12.587 1016 1HE LYS 151 1HE LYS 151 -5.996 -14.612 -14.889 1017 2HE LYS 151 2HE LYS 151 -7.715 -14.769 -15.295 1018 1HZ LYS 151 1HZ LYS 151 -7.157 -12.510 -14.789 1019 2HZ LYS 151 2HZ LYS 151 -8.205 -13.079 -13.662 1020 3HZ LYS 151 3HZ LYS 151 -6.612 -12.908 -13.291 Start of MODEL 28 1 H VAL 21 H VAL 21 -0.859 10.517 14.511 2 HA VAL 21 HA VAL 21 -2.413 8.291 15.793 3 HB VAL 21 HB VAL 21 -3.073 11.240 15.576 4 1HG1 VAL 21 1HG1 VAL 21 -4.793 10.619 17.359 5 2HG1 VAL 21 2HG1 VAL 21 -5.171 10.107 15.729 6 3HG1 VAL 21 3HG1 VAL 21 -4.528 8.927 16.907 7 1HG2 VAL 21 1HG2 VAL 21 -2.703 11.270 18.038 8 2HG2 VAL 21 2HG2 VAL 21 -2.111 9.598 17.951 9 3HG2 VAL 21 3HG2 VAL 21 -1.221 10.917 17.157 10 H GLU 22 H GLU 22 -4.815 8.499 14.634 11 HA GLU 22 HA GLU 22 -4.454 8.570 11.713 12 1HB GLU 22 1HB GLU 22 -6.043 7.028 12.899 13 2HB GLU 22 2HB GLU 22 -7.064 8.429 13.269 14 1HG GLU 22 1HG GLU 22 -7.343 8.880 10.869 15 2HG GLU 22 2HG GLU 22 -6.181 7.610 10.456 16 H GLN 23 H GLN 23 -3.339 10.607 12.155 17 HA GLN 23 HA GLN 23 -3.897 12.848 11.165 18 1HB GLN 23 1HB GLN 23 -5.460 12.919 13.731 19 2HB GLN 23 2HB GLN 23 -4.590 14.364 13.244 20 1HG GLN 23 1HG GLN 23 -6.498 12.981 11.317 21 2HG GLN 23 2HG GLN 23 -6.997 14.216 12.468 22 1HE2 GLN 23 1HE2 GLN 23 -4.817 13.638 9.611 23 2HE2 GLN 23 2HE2 GLN 23 -4.935 15.247 9.027 24 H ALA 24 H ALA 24 -2.487 14.596 11.737 25 HA ALA 24 HA ALA 24 -0.228 13.806 13.466 26 1HB ALA 24 1HB ALA 24 1.293 13.568 11.545 27 2HB ALA 24 2HB ALA 24 -0.088 12.470 11.288 28 3HB ALA 24 3HB ALA 24 -0.023 14.012 10.437 29 H SER 25 H SER 25 -2.114 16.001 13.345 30 HA SER 25 HA SER 25 -1.394 17.854 11.519 31 1HB SER 25 1HB SER 25 -3.319 18.362 13.785 32 2HB SER 25 2HB SER 25 -3.474 18.809 12.069 33 HG SER 25 HG SER 25 -4.630 16.945 12.098 34 H ASP 26 H ASP 26 -0.181 17.609 14.568 35 HA ASP 26 HA ASP 26 0.577 20.342 15.038 36 1HB ASP 26 1HB ASP 26 2.152 17.891 15.908 37 2HB ASP 26 2HB ASP 26 1.946 19.421 16.764 38 H LEU 27 H LEU 27 1.815 17.604 13.131 39 HA LEU 27 HA LEU 27 4.261 19.096 12.324 40 1HB LEU 27 1HB LEU 27 3.499 16.183 12.610 41 2HB LEU 27 2HB LEU 27 4.796 16.671 11.537 42 HG LEU 27 HG LEU 27 6.012 17.771 13.373 43 1HD1 LEU 27 1HD1 LEU 27 3.810 16.595 15.120 44 2HD1 LEU 27 2HD1 LEU 27 5.384 17.138 15.734 45 3HD1 LEU 27 3HD1 LEU 27 4.298 18.313 15.008 46 1HD2 LEU 27 1HD2 LEU 27 6.501 15.476 12.729 47 2HD2 LEU 27 2HD2 LEU 27 6.630 15.606 14.491 48 3HD2 LEU 27 3HD2 LEU 27 5.174 14.881 13.753 49 H ILE 28 H ILE 28 1.235 19.125 11.117 50 HA ILE 28 HA ILE 28 1.917 18.338 8.349 51 HB ILE 28 HB ILE 28 -0.518 19.652 9.586 52 1HG1 ILE 28 1HG1 ILE 28 0.139 16.951 8.292 53 2HG1 ILE 28 2HG1 ILE 28 -0.014 17.243 9.991 54 1HG2 ILE 28 1HG2 ILE 28 -0.163 18.687 6.730 55 2HG2 ILE 28 2HG2 ILE 28 -1.626 19.383 7.443 56 3HG2 ILE 28 3HG2 ILE 28 -0.235 20.412 7.147 57 1HD1 ILE 28 1HD1 ILE 28 -2.091 16.274 9.395 58 2HD1 ILE 28 2HD1 ILE 28 -2.435 18.004 9.607 59 3HD1 ILE 28 3HD1 ILE 28 -2.278 17.334 7.990 60 H LEU 29 H LEU 29 3.911 19.511 8.370 61 HA LEU 29 HA LEU 29 3.691 22.460 8.124 62 1HB LEU 29 1HB LEU 29 6.184 20.774 7.800 63 2HB LEU 29 2HB LEU 29 6.059 22.508 8.000 64 HG LEU 29 HG LEU 29 6.554 22.178 10.104 65 1HD1 LEU 29 1HD1 LEU 29 4.876 21.804 11.742 66 2HD1 LEU 29 2HD1 LEU 29 4.113 22.672 10.405 67 3HD1 LEU 29 3HD1 LEU 29 3.827 20.938 10.645 68 1HD2 LEU 29 1HD2 LEU 29 6.374 19.918 11.267 69 2HD2 LEU 29 2HD2 LEU 29 5.917 19.277 9.678 70 3HD2 LEU 29 3HD2 LEU 29 7.474 20.070 9.880 71 H ASP 30 H ASP 30 5.246 23.296 6.218 72 HA ASP 30 HA ASP 30 3.612 22.648 3.857 73 1HB ASP 30 1HB ASP 30 5.394 24.978 4.499 74 2HB ASP 30 2HB ASP 30 4.345 24.843 3.081 75 H GLU 31 H GLU 31 5.015 20.595 3.952 76 HA GLU 31 HA GLU 31 6.379 20.901 1.345 77 1HB GLU 31 1HB GLU 31 6.773 18.616 3.348 78 2HB GLU 31 2HB GLU 31 7.404 18.723 1.720 79 1HG GLU 31 1HG GLU 31 8.748 20.746 2.427 80 2HG GLU 31 2HG GLU 31 8.221 20.434 4.095 81 H LYS 32 H LYS 32 5.655 19.198 -0.137 82 HA LYS 32 HA LYS 32 3.139 17.890 0.611 83 1HB LYS 32 1HB LYS 32 2.967 20.154 -0.625 84 2HB LYS 32 2HB LYS 32 3.764 19.362 -2.001 85 1HG LYS 32 1HG LYS 32 2.028 17.628 -1.928 86 2HG LYS 32 2HG LYS 32 1.318 18.390 -0.515 87 1HD LYS 32 1HD LYS 32 -0.032 18.962 -2.491 88 2HD LYS 32 2HD LYS 32 0.695 20.397 -1.764 89 1HE LYS 32 1HE LYS 32 0.797 20.492 -4.211 90 2HE LYS 32 2HE LYS 32 2.428 20.470 -3.531 91 1HZ LYS 32 1HZ LYS 32 2.131 18.957 -5.429 92 2HZ LYS 32 2HZ LYS 32 2.524 18.116 -4.062 93 3HZ LYS 32 3HZ LYS 32 0.979 18.136 -4.590 94 H ILE 33 H ILE 33 4.154 15.899 0.823 95 HA ILE 33 HA ILE 33 6.388 15.178 -1.007 96 HB ILE 33 HB ILE 33 6.785 15.237 1.361 97 1HG1 ILE 33 1HG1 ILE 33 6.894 12.308 0.544 98 2HG1 ILE 33 2HG1 ILE 33 7.716 13.489 -0.488 99 1HG2 ILE 33 1HG2 ILE 33 5.949 13.474 2.793 100 2HG2 ILE 33 2HG2 ILE 33 4.621 14.511 2.273 101 3HG2 ILE 33 3HG2 ILE 33 4.839 12.901 1.548 102 1HD1 ILE 33 1HD1 ILE 33 9.187 12.592 1.225 103 2HD1 ILE 33 2HD1 ILE 33 8.981 14.369 1.270 104 3HD1 ILE 33 3HD1 ILE 33 8.187 13.338 2.490 105 H LYS 34 H LYS 34 6.480 13.489 -2.232 106 HA LYS 34 HA LYS 34 4.007 12.591 -3.375 107 1HB LYS 34 1HB LYS 34 6.398 13.320 -4.319 108 2HB LYS 34 2HB LYS 34 6.753 11.612 -4.091 109 1HG LYS 34 1HG LYS 34 4.585 12.833 -5.811 110 2HG LYS 34 2HG LYS 34 6.174 12.256 -6.342 111 1HD LYS 34 1HD LYS 34 5.390 9.934 -5.314 112 2HD LYS 34 2HD LYS 34 3.781 10.662 -5.389 113 1HE LYS 34 1HE LYS 34 3.889 9.593 -7.463 114 2HE LYS 34 2HE LYS 34 4.414 11.208 -7.916 115 1HZ LYS 34 1HZ LYS 34 6.701 10.190 -7.699 116 2HZ LYS 34 2HZ LYS 34 5.935 8.736 -7.399 117 3HZ LYS 34 3HZ LYS 34 5.740 9.490 -8.847 118 H VAL 35 H VAL 35 3.168 10.425 -3.367 119 HA VAL 35 HA VAL 35 4.976 8.281 -2.511 120 HB VAL 35 HB VAL 35 2.277 8.938 -1.354 121 1HG1 VAL 35 1HG1 VAL 35 3.411 6.119 -1.514 122 2HG1 VAL 35 2HG1 VAL 35 2.118 6.623 -0.412 123 3HG1 VAL 35 3HG1 VAL 35 1.878 6.708 -2.159 124 1HG2 VAL 35 1HG2 VAL 35 5.025 8.471 -0.347 125 2HG2 VAL 35 2HG2 VAL 35 3.787 9.592 0.220 126 3HG2 VAL 35 3HG2 VAL 35 3.727 7.862 0.664 127 H THR 36 H THR 36 4.641 6.418 -3.596 128 HA THR 36 HA THR 36 2.785 6.551 -5.922 129 HB THR 36 HB THR 36 5.573 5.372 -6.133 130 HG1 THR 36 HG1 THR 36 5.797 7.531 -5.467 131 1HG2 THR 36 1HG2 THR 36 3.930 4.885 -7.904 132 2HG2 THR 36 2HG2 THR 36 3.724 6.627 -8.196 133 3HG2 THR 36 3HG2 THR 36 5.293 5.850 -8.504 134 H PHE 37 H PHE 37 1.379 5.056 -5.579 135 HA PHE 37 HA PHE 37 1.941 2.638 -4.033 136 1HB PHE 37 1HB PHE 37 -0.452 3.623 -5.672 137 2HB PHE 37 2HB PHE 37 -0.404 2.142 -4.749 138 HD1 PHE 37 HD1 PHE 37 0.164 2.310 -2.201 139 HD2 PHE 37 HD2 PHE 37 -1.074 5.661 -4.615 140 HE1 PHE 37 HE1 PHE 37 0.198 3.776 -0.189 141 HE2 PHE 37 HE2 PHE 37 -1.189 7.052 -2.581 142 HZ PHE 37 HZ PHE 37 -0.419 6.189 -0.416 143 H ASP 38 H ASP 38 3.631 1.556 -5.313 144 HA ASP 38 HA ASP 38 3.097 1.293 -8.180 145 1HB ASP 38 1HB ASP 38 5.333 1.618 -7.762 146 2HB ASP 38 2HB ASP 38 5.408 0.361 -6.542 147 H ALA 39 H ALA 39 1.000 0.377 -7.894 148 HA ALA 39 HA ALA 39 0.650 -2.273 -6.874 149 1HB ALA 39 1HB ALA 39 -1.197 -0.721 -7.055 150 2HB ALA 39 2HB ALA 39 -1.003 -0.635 -8.823 151 3HB ALA 39 3HB ALA 39 -1.526 -2.148 -8.058 152 H ASN 40 H ASN 40 1.650 -4.036 -7.730 153 HA ASN 40 HA ASN 40 1.366 -4.496 -10.670 154 1HB ASN 40 1HB ASN 40 3.479 -5.881 -8.997 155 2HB ASN 40 2HB ASN 40 3.349 -5.750 -10.742 156 1HD2 ASN 40 1HD2 ASN 40 4.116 -3.991 -7.763 157 2HD2 ASN 40 2HD2 ASN 40 5.132 -2.750 -8.527 158 H VAL 41 H VAL 41 1.414 -7.055 -10.976 159 HA VAL 41 HA VAL 41 0.614 -8.588 -8.703 160 HB VAL 41 HB VAL 41 -1.583 -7.679 -9.366 161 1HG1 VAL 41 1HG1 VAL 41 -1.162 -7.296 -11.780 162 2HG1 VAL 41 2HG1 VAL 41 -1.148 -9.052 -12.054 163 3HG1 VAL 41 3HG1 VAL 41 -2.627 -8.248 -11.499 164 1HG2 VAL 41 1HG2 VAL 41 -1.427 -9.962 -8.414 165 2HG2 VAL 41 2HG2 VAL 41 -2.808 -9.759 -9.504 166 3HG2 VAL 41 3HG2 VAL 41 -1.373 -10.635 -10.060 167 H ALA 42 H ALA 42 0.967 -10.898 -9.159 168 HA ALA 42 HA ALA 42 1.809 -11.807 -11.728 169 1HB ALA 42 1HB ALA 42 3.834 -10.458 -11.209 170 2HB ALA 42 2HB ALA 42 3.988 -11.284 -9.649 171 3HB ALA 42 3HB ALA 42 4.197 -12.187 -11.159 172 H ALA 43 H ALA 43 2.837 -14.032 -11.434 173 HA ALA 43 HA ALA 43 2.511 -16.148 -10.882 174 1HB ALA 43 1HB ALA 43 2.801 -16.804 -8.580 175 2HB ALA 43 2HB ALA 43 3.769 -15.341 -8.842 176 3HB ALA 43 3HB ALA 43 2.201 -15.230 -8.014 177 H GLY 44 H GLY 44 0.878 -17.456 -8.990 178 1HA GLY 44 1HA GLY 44 -1.518 -17.420 -10.619 179 2HA GLY 44 2HA GLY 44 -1.122 -18.463 -9.251 180 H LEU 45 H LEU 45 -1.449 -14.950 -9.476 181 HA LEU 45 HA LEU 45 -3.502 -15.039 -7.303 182 1HB LEU 45 1HB LEU 45 -1.149 -13.922 -7.103 183 2HB LEU 45 2HB LEU 45 -1.875 -12.601 -8.010 184 HG LEU 45 HG LEU 45 -2.850 -13.850 -5.378 185 1HD1 LEU 45 1HD1 LEU 45 -0.943 -12.426 -5.087 186 2HD1 LEU 45 2HD1 LEU 45 -1.733 -11.139 -6.048 187 3HD1 LEU 45 3HD1 LEU 45 -2.378 -11.614 -4.455 188 1HD2 LEU 45 1HD2 LEU 45 -3.915 -11.540 -7.099 189 2HD2 LEU 45 2HD2 LEU 45 -4.806 -13.032 -6.666 190 3HD2 LEU 45 3HD2 LEU 45 -4.416 -11.821 -5.428 191 HA PRO 46 HA PRO 46 -5.582 -13.806 -11.274 192 1HB PRO 46 1HB PRO 46 -7.701 -15.435 -11.255 193 2HB PRO 46 2HB PRO 46 -6.055 -16.111 -11.393 194 1HG PRO 46 1HG PRO 46 -7.704 -15.819 -8.861 195 2HG PRO 46 2HG PRO 46 -6.914 -17.305 -9.470 196 1HD PRO 46 1HD PRO 46 -5.727 -15.647 -7.629 197 2HD PRO 46 2HD PRO 46 -4.813 -16.570 -8.853 198 H TRP 47 H TRP 47 -5.618 -12.025 -9.065 199 HA TRP 47 HA TRP 47 -8.501 -11.624 -8.435 200 1HB TRP 47 1HB TRP 47 -6.092 -10.776 -6.839 201 2HB TRP 47 2HB TRP 47 -7.762 -10.392 -6.497 202 HD1 TRP 47 HD1 TRP 47 -8.026 -13.830 -7.545 203 HE1 TRP 47 HE1 TRP 47 -8.127 -15.432 -5.627 204 HE3 TRP 47 HE3 TRP 47 -6.011 -10.871 -3.854 205 HZ2 TRP 47 HZ2 TRP 47 -7.697 -15.432 -2.806 206 HZ3 TRP 47 HZ3 TRP 47 -5.370 -12.059 -1.752 207 HH2 TRP 47 HH2 TRP 47 -6.386 -14.162 -1.120 208 H GLU 48 H GLU 48 -9.418 -9.710 -8.851 209 HA GLU 48 HA GLU 48 -8.158 -7.964 -10.839 210 1HB GLU 48 1HB GLU 48 -10.509 -8.722 -10.861 211 2HB GLU 48 2HB GLU 48 -10.772 -7.936 -9.304 212 1HG GLU 48 1HG GLU 48 -10.459 -5.719 -10.370 213 2HG GLU 48 2HG GLU 48 -10.292 -6.516 -11.945 214 H PHE 49 H PHE 49 -6.367 -7.418 -9.466 215 HA PHE 49 HA PHE 49 -6.789 -5.723 -7.115 216 1HB PHE 49 1HB PHE 49 -4.959 -7.337 -7.125 217 2HB PHE 49 2HB PHE 49 -4.287 -6.596 -8.578 218 HD1 PHE 49 HD1 PHE 49 -2.358 -5.309 -8.167 219 HD2 PHE 49 HD2 PHE 49 -5.459 -5.428 -5.160 220 HE1 PHE 49 HE1 PHE 49 -0.852 -4.218 -6.557 221 HE2 PHE 49 HE2 PHE 49 -3.955 -4.269 -3.575 222 HZ PHE 49 HZ PHE 49 -1.627 -3.730 -4.240 223 H VAL 50 H VAL 50 -7.043 -3.529 -7.277 224 HA VAL 50 HA VAL 50 -5.937 -2.189 -9.705 225 HB VAL 50 HB VAL 50 -7.851 -0.866 -9.994 226 1HG1 VAL 50 1HG1 VAL 50 -9.577 -2.466 -10.530 227 2HG1 VAL 50 2HG1 VAL 50 -8.019 -3.266 -10.814 228 3HG1 VAL 50 3HG1 VAL 50 -8.968 -3.628 -9.346 229 1HG2 VAL 50 1HG2 VAL 50 -9.911 -1.151 -8.542 230 2HG2 VAL 50 2HG2 VAL 50 -8.872 -2.033 -7.403 231 3HG2 VAL 50 3HG2 VAL 50 -8.566 -0.316 -7.751 232 HA PRO 51 HA PRO 51 -4.523 0.707 -6.462 233 1HB PRO 51 1HB PRO 51 -3.405 2.613 -8.043 234 2HB PRO 51 2HB PRO 51 -2.592 1.050 -7.762 235 1HG PRO 51 1HG PRO 51 -4.299 1.856 -10.130 236 2HG PRO 51 2HG PRO 51 -2.699 1.063 -10.161 237 1HD PRO 51 1HD PRO 51 -5.082 -0.281 -10.391 238 2HD PRO 51 2HD PRO 51 -3.652 -1.035 -9.623 239 H VAL 52 H VAL 52 -5.248 2.900 -6.021 240 HA VAL 52 HA VAL 52 -7.932 3.480 -7.018 241 HB VAL 52 HB VAL 52 -7.280 5.638 -5.442 242 1HG1 VAL 52 1HG1 VAL 52 -9.335 4.353 -5.313 243 2HG1 VAL 52 2HG1 VAL 52 -8.450 2.939 -4.701 244 3HG1 VAL 52 3HG1 VAL 52 -8.572 4.416 -3.712 245 1HG2 VAL 52 1HG2 VAL 52 -6.004 3.171 -4.220 246 2HG2 VAL 52 2HG2 VAL 52 -5.071 4.537 -4.833 247 3HG2 VAL 52 3HG2 VAL 52 -6.183 4.765 -3.462 248 H GLN 53 H GLN 53 -4.899 5.250 -6.700 249 HA GLN 53 HA GLN 53 -4.820 5.976 -9.474 250 1HB GLN 53 1HB GLN 53 -4.349 8.280 -9.142 251 2HB GLN 53 2HB GLN 53 -5.944 8.002 -8.461 252 1HG GLN 53 1HG GLN 53 -3.294 8.343 -6.987 253 2HG GLN 53 2HG GLN 53 -4.503 9.606 -7.226 254 1HE2 GLN 53 1HE2 GLN 53 -3.768 6.553 -5.538 255 2HE2 GLN 53 2HE2 GLN 53 -5.117 6.724 -4.427 256 H ARG 54 H ARG 54 -2.555 6.451 -9.981 257 HA ARG 54 HA ARG 54 -0.815 4.634 -8.720 258 1HB ARG 54 1HB ARG 54 -0.696 6.431 -10.971 259 2HB ARG 54 2HB ARG 54 0.808 6.526 -10.057 260 1HG ARG 54 1HG ARG 54 -0.496 3.862 -10.775 261 2HG ARG 54 2HG ARG 54 0.699 4.688 -11.813 262 1HD ARG 54 1HD ARG 54 2.385 4.360 -10.336 263 2HD ARG 54 2HD ARG 54 1.329 4.307 -8.972 264 HE ARG 54 HE ARG 54 1.552 2.172 -8.888 265 1HH1 ARG 54 1HH1 ARG 54 0.771 2.690 -12.267 266 2HH1 ARG 54 2HH1 ARG 54 1.191 1.071 -12.764 267 1HH2 ARG 54 1HH2 ARG 54 2.927 0.197 -10.013 268 2HH2 ARG 54 2HH2 ARG 54 1.607 -0.565 -10.832 269 H ASP 55 H ASP 55 -0.940 8.258 -8.157 270 HA ASP 55 HA ASP 55 0.716 7.795 -5.780 271 1HB ASP 55 1HB ASP 55 1.972 9.743 -6.591 272 2HB ASP 55 2HB ASP 55 2.131 8.300 -7.628 273 H ILE 56 H ILE 56 0.943 9.614 -4.441 274 HA ILE 56 HA ILE 56 -1.343 11.487 -4.321 275 HB ILE 56 HB ILE 56 -1.630 11.155 -1.936 276 1HG1 ILE 56 1HG1 ILE 56 0.246 8.826 -2.403 277 2HG1 ILE 56 2HG1 ILE 56 0.591 10.303 -1.486 278 1HG2 ILE 56 1HG2 ILE 56 -2.858 8.999 -2.073 279 2HG2 ILE 56 2HG2 ILE 56 -3.156 10.030 -3.483 280 3HG2 ILE 56 3HG2 ILE 56 -2.049 8.659 -3.622 281 1HD1 ILE 56 1HD1 ILE 56 0.173 8.468 0.001 282 2HD1 ILE 56 2HD1 ILE 56 -1.052 9.735 0.204 283 3HD1 ILE 56 3HD1 ILE 56 -1.464 8.232 -0.622 284 H ASP 57 H ASP 57 -0.763 13.469 -3.124 285 HA ASP 57 HA ASP 57 2.116 13.782 -2.487 286 1HB ASP 57 1HB ASP 57 1.846 16.015 -3.359 287 2HB ASP 57 2HB ASP 57 1.459 14.803 -4.573 288 H VAL 58 H VAL 58 1.853 13.329 -0.254 289 HA VAL 58 HA VAL 58 -0.441 14.447 1.247 290 HB VAL 58 HB VAL 58 0.326 13.211 3.119 291 1HG1 VAL 58 1HG1 VAL 58 -0.113 11.001 2.207 292 2HG1 VAL 58 2HG1 VAL 58 -1.113 12.195 1.360 293 3HG1 VAL 58 3HG1 VAL 58 0.345 11.543 0.580 294 1HG2 VAL 58 1HG2 VAL 58 2.640 12.271 1.376 295 2HG2 VAL 58 2HG2 VAL 58 2.754 13.230 2.879 296 3HG2 VAL 58 3HG2 VAL 58 2.154 11.569 2.919 297 H ARG 59 H ARG 59 -0.365 16.027 2.814 298 HA ARG 59 HA ARG 59 1.958 17.842 2.791 299 1HB ARG 59 1HB ARG 59 -0.736 17.895 4.180 300 2HB ARG 59 2HB ARG 59 0.518 19.088 4.501 301 1HG ARG 59 1HG ARG 59 -0.506 18.538 1.694 302 2HG ARG 59 2HG ARG 59 -1.297 19.680 2.786 303 1HD ARG 59 1HD ARG 59 1.619 20.130 2.728 304 2HD ARG 59 2HD ARG 59 0.941 20.175 1.122 305 HE ARG 59 HE ARG 59 -0.451 21.991 1.695 306 1HH1 ARG 59 1HH1 ARG 59 1.702 21.186 4.554 307 2HH1 ARG 59 2HH1 ARG 59 1.711 22.886 4.957 308 1HH2 ARG 59 1HH2 ARG 59 -0.281 24.188 2.535 309 2HH2 ARG 59 2HH2 ARG 59 0.802 24.402 3.913 310 H ILE 60 H ILE 60 3.274 15.985 3.464 311 HA ILE 60 HA ILE 60 4.101 14.475 5.104 312 HB ILE 60 HB ILE 60 5.653 15.960 6.504 313 1HG1 ILE 60 1HG1 ILE 60 4.716 18.062 4.513 314 2HG1 ILE 60 2HG1 ILE 60 4.094 17.968 6.162 315 1HG2 ILE 60 1HG2 ILE 60 7.138 16.291 4.584 316 2HG2 ILE 60 2HG2 ILE 60 6.325 14.743 4.520 317 3HG2 ILE 60 3HG2 ILE 60 5.767 16.089 3.481 318 1HD1 ILE 60 1HD1 ILE 60 7.074 18.207 5.541 319 2HD1 ILE 60 2HD1 ILE 60 6.015 19.598 5.775 320 3HD1 ILE 60 3HD1 ILE 60 6.250 18.440 7.100 321 H GLY 61 H GLY 61 1.881 13.968 5.985 322 1HA GLY 61 1HA GLY 61 1.611 13.372 8.542 323 2HA GLY 61 2HA GLY 61 1.393 15.109 8.689 324 H GLU 62 H GLU 62 0.012 15.692 6.288 325 HA GLU 62 HA GLU 62 -2.490 15.169 7.287 326 1HB GLU 62 1HB GLU 62 -2.029 17.063 5.763 327 2HB GLU 62 2HB GLU 62 -1.978 15.929 4.386 328 1HG GLU 62 1HG GLU 62 -4.159 17.109 4.594 329 2HG GLU 62 2HG GLU 62 -4.352 15.364 4.762 330 H THR 63 H THR 63 -4.109 13.824 6.969 331 HA THR 63 HA THR 63 -2.853 11.189 6.536 332 HB THR 63 HB THR 63 -5.259 11.823 8.253 333 HG1 THR 63 HG1 THR 63 -2.566 12.641 8.578 334 1HG2 THR 63 1HG2 THR 63 -3.946 9.462 8.050 335 2HG2 THR 63 2HG2 THR 63 -2.878 10.301 9.228 336 3HG2 THR 63 3HG2 THR 63 -4.589 10.076 9.585 337 H VAL 64 H VAL 64 -3.392 10.688 4.365 338 HA VAL 64 HA VAL 64 -6.212 11.103 3.549 339 HB VAL 64 HB VAL 64 -4.621 12.013 2.099 340 1HG1 VAL 64 1HG1 VAL 64 -2.644 10.556 2.471 341 2HG1 VAL 64 2HG1 VAL 64 -3.480 9.207 1.673 342 3HG1 VAL 64 3HG1 VAL 64 -3.055 10.663 0.753 343 1HG2 VAL 64 1HG2 VAL 64 -5.340 11.149 -0.012 344 2HG2 VAL 64 2HG2 VAL 64 -5.802 9.601 0.705 345 3HG2 VAL 64 3HG2 VAL 64 -6.695 11.083 1.126 346 H GLN 65 H GLN 65 -7.513 9.582 2.795 347 HA GLN 65 HA GLN 65 -6.969 6.712 3.414 348 1HB GLN 65 1HB GLN 65 -9.301 6.327 3.097 349 2HB GLN 65 2HB GLN 65 -9.007 7.557 4.317 350 1HG GLN 65 1HG GLN 65 -10.542 8.812 3.325 351 2HG GLN 65 2HG GLN 65 -9.419 9.099 1.999 352 1HE2 GLN 65 1HE2 GLN 65 -9.501 7.469 0.177 353 2HE2 GLN 65 2HE2 GLN 65 -11.075 6.767 -0.213 354 H ILE 66 H ILE 66 -6.001 5.617 1.941 355 HA ILE 66 HA ILE 66 -7.017 5.879 -0.850 356 HB ILE 66 HB ILE 66 -4.860 4.868 -1.650 357 1HG1 ILE 66 1HG1 ILE 66 -2.890 6.014 -0.264 358 2HG1 ILE 66 2HG1 ILE 66 -3.895 5.649 1.102 359 1HG2 ILE 66 1HG2 ILE 66 -4.755 7.714 -0.632 360 2HG2 ILE 66 2HG2 ILE 66 -3.919 7.016 -2.045 361 3HG2 ILE 66 3HG2 ILE 66 -5.676 7.185 -2.062 362 1HD1 ILE 66 1HD1 ILE 66 -2.797 3.749 -1.040 363 2HD1 ILE 66 2HD1 ILE 66 -2.310 3.813 0.670 364 3HD1 ILE 66 3HD1 ILE 66 -3.900 3.192 0.204 365 H MET 67 H MET 67 -8.295 4.339 -1.216 366 HA MET 67 HA MET 67 -8.116 1.834 0.372 367 1HB MET 67 1HB MET 67 -10.353 1.333 -0.323 368 2HB MET 67 2HB MET 67 -10.291 2.993 0.258 369 1HG MET 67 1HG MET 67 -11.659 3.116 -1.617 370 2HG MET 67 2HG MET 67 -10.117 3.744 -2.163 371 1HE MET 67 1HE MET 67 -12.869 1.043 -2.471 372 2HE MET 67 2HE MET 67 -12.078 -0.238 -3.410 373 3HE MET 67 3HE MET 67 -11.581 0.067 -1.732 374 H TYR 68 H TYR 68 -8.253 -0.247 -0.543 375 HA TYR 68 HA TYR 68 -7.278 -0.448 -3.364 376 1HB TYR 68 1HB TYR 68 -6.093 -1.657 -0.862 377 2HB TYR 68 2HB TYR 68 -6.096 -2.591 -2.349 378 HD1 TYR 68 HD1 TYR 68 -4.946 -1.780 -4.402 379 HD2 TYR 68 HD2 TYR 68 -4.431 0.090 -0.553 380 HE1 TYR 68 HE1 TYR 68 -2.652 -1.130 -5.030 381 HE2 TYR 68 HE2 TYR 68 -2.128 0.758 -1.191 382 HH TYR 68 HH TYR 68 -0.622 -0.401 -4.208 383 H ARG 69 H ARG 69 -7.925 -2.390 -4.370 384 HA ARG 69 HA ARG 69 -10.100 -3.931 -3.101 385 1HB ARG 69 1HB ARG 69 -11.139 -2.119 -4.433 386 2HB ARG 69 2HB ARG 69 -10.165 -2.565 -5.815 387 1HG ARG 69 1HG ARG 69 -11.275 -4.720 -6.006 388 2HG ARG 69 2HG ARG 69 -12.241 -4.404 -4.555 389 1HD ARG 69 1HD ARG 69 -12.266 -2.664 -7.064 390 2HD ARG 69 2HD ARG 69 -13.413 -3.982 -6.742 391 HE ARG 69 HE ARG 69 -13.545 -2.329 -4.471 392 1HH1 ARG 69 1HH1 ARG 69 -14.323 -2.079 -7.903 393 2HH1 ARG 69 2HH1 ARG 69 -15.678 -1.017 -7.646 394 1HH2 ARG 69 1HH2 ARG 69 -15.159 -1.016 -4.111 395 2HH2 ARG 69 2HH2 ARG 69 -16.204 -0.337 -5.360 396 H ALA 70 H ALA 70 -10.079 -6.064 -3.734 397 HA ALA 70 HA ALA 70 -8.438 -7.034 -5.978 398 1HB ALA 70 1HB ALA 70 -7.413 -8.771 -4.575 399 2HB ALA 70 2HB ALA 70 -6.888 -7.147 -4.091 400 3HB ALA 70 3HB ALA 70 -8.094 -8.015 -3.121 401 H LYS 71 H LYS 71 -10.008 -8.192 -7.117 402 HA LYS 71 HA LYS 71 -12.135 -9.582 -5.487 403 1HB LYS 71 1HB LYS 71 -12.535 -8.695 -8.344 404 2HB LYS 71 2HB LYS 71 -13.689 -9.228 -7.128 405 1HG LYS 71 1HG LYS 71 -12.821 -7.210 -5.716 406 2HG LYS 71 2HG LYS 71 -12.131 -6.593 -7.224 407 1HD LYS 71 1HD LYS 71 -15.002 -7.477 -7.109 408 2HD LYS 71 2HD LYS 71 -14.595 -5.970 -6.312 409 1HE LYS 71 1HE LYS 71 -15.265 -5.190 -8.361 410 2HE LYS 71 2HE LYS 71 -13.521 -5.336 -8.650 411 1HZ LYS 71 1HZ LYS 71 -14.563 -6.240 -10.433 412 2HZ LYS 71 2HZ LYS 71 -14.025 -7.508 -9.696 413 3HZ LYS 71 3HZ LYS 71 -15.660 -7.173 -9.534 414 H ASN 72 H ASN 72 -12.229 -11.763 -5.558 415 HA ASN 72 HA ASN 72 -10.075 -12.984 -7.042 416 1HB ASN 72 1HB ASN 72 -10.447 -13.616 -4.750 417 2HB ASN 72 2HB ASN 72 -12.092 -14.177 -5.114 418 1HD2 ASN 72 1HD2 ASN 72 -10.724 -16.223 -3.937 419 2HD2 ASN 72 2HD2 ASN 72 -10.126 -17.320 -5.153 420 H LEU 73 H LEU 73 -10.235 -13.436 -9.191 421 HA LEU 73 HA LEU 73 -12.757 -14.646 -10.247 422 1HB LEU 73 1HB LEU 73 -10.436 -13.176 -11.537 423 2HB LEU 73 2HB LEU 73 -11.542 -14.183 -12.463 424 HG LEU 73 HG LEU 73 -13.477 -12.848 -11.712 425 1HD1 LEU 73 1HD1 LEU 73 -13.002 -10.525 -10.862 426 2HD1 LEU 73 2HD1 LEU 73 -12.690 -11.781 -9.668 427 3HD1 LEU 73 3HD1 LEU 73 -11.331 -11.029 -10.545 428 1HD2 LEU 73 1HD2 LEU 73 -12.359 -12.478 -13.883 429 2HD2 LEU 73 2HD2 LEU 73 -12.973 -10.956 -13.215 430 3HD2 LEU 73 3HD2 LEU 73 -11.240 -11.327 -13.117 431 H ALA 74 H ALA 74 -10.841 -16.147 -8.544 432 HA ALA 74 HA ALA 74 -9.833 -18.214 -10.351 433 1HB ALA 74 1HB ALA 74 -8.755 -17.702 -8.148 434 2HB ALA 74 2HB ALA 74 -10.260 -18.184 -7.361 435 3HB ALA 74 3HB ALA 74 -9.285 -19.381 -8.249 436 H SER 75 H SER 75 -10.623 -20.548 -9.708 437 HA SER 75 HA SER 75 -13.541 -20.597 -9.021 438 1HB SER 75 1HB SER 75 -12.927 -21.384 -11.390 439 2HB SER 75 2HB SER 75 -12.228 -22.815 -10.568 440 HG SER 75 HG SER 75 -14.381 -23.212 -11.070 441 H THR 76 H THR 76 -10.834 -20.569 -7.493 442 HA THR 76 HA THR 76 -11.619 -22.536 -5.520 443 HB THR 76 HB THR 76 -9.021 -23.061 -5.362 444 HG1 THR 76 HG1 THR 76 -9.296 -22.243 -8.057 445 1HG2 THR 76 1HG2 THR 76 -10.751 -24.771 -5.695 446 2HG2 THR 76 2HG2 THR 76 -10.751 -24.460 -7.438 447 3HG2 THR 76 3HG2 THR 76 -9.302 -25.120 -6.652 448 HA PRO 77 HA PRO 77 -10.258 -19.080 -3.090 449 1HB PRO 77 1HB PRO 77 -9.222 -20.218 -0.796 450 2HB PRO 77 2HB PRO 77 -10.971 -20.149 -1.145 451 1HG PRO 77 1HG PRO 77 -9.084 -22.457 -1.671 452 2HG PRO 77 2HG PRO 77 -10.678 -22.507 -0.860 453 1HD PRO 77 1HD PRO 77 -10.413 -23.147 -3.478 454 2HD PRO 77 2HD PRO 77 -11.824 -22.205 -2.926 455 H THR 78 H THR 78 -8.197 -17.920 -2.847 456 HA THR 78 HA THR 78 -5.765 -19.517 -3.555 457 HB THR 78 HB THR 78 -4.934 -17.893 -4.990 458 HG1 THR 78 HG1 THR 78 -5.306 -15.931 -4.946 459 1HG2 THR 78 1HG2 THR 78 -7.098 -19.121 -5.936 460 2HG2 THR 78 2HG2 THR 78 -7.913 -17.592 -5.602 461 3HG2 THR 78 3HG2 THR 78 -6.576 -17.640 -6.763 462 H THR 79 H THR 79 -3.758 -18.328 -3.111 463 HA THR 79 HA THR 79 -3.853 -16.989 -0.452 464 HB THR 79 HB THR 79 -1.612 -18.272 -2.077 465 HG1 THR 79 HG1 THR 79 -1.797 -19.627 -0.017 466 1HG2 THR 79 1HG2 THR 79 -1.559 -17.203 0.775 467 2HG2 THR 79 2HG2 THR 79 -0.234 -18.042 -0.072 468 3HG2 THR 79 3HG2 THR 79 -0.769 -16.458 -0.637 469 H GLY 80 H GLY 80 -3.130 -14.804 -0.397 470 1HA GLY 80 1HA GLY 80 -1.667 -13.569 -2.579 471 2HA GLY 80 2HA GLY 80 -3.366 -13.095 -2.551 472 H GLN 81 H GLN 81 -0.696 -13.652 -0.202 473 HA GLN 81 HA GLN 81 -1.419 -11.175 1.318 474 1HB GLN 81 1HB GLN 81 -0.497 -12.590 3.301 475 2HB GLN 81 2HB GLN 81 -2.145 -12.844 2.760 476 1HG GLN 81 1HG GLN 81 -0.988 -14.956 3.272 477 2HG GLN 81 2HG GLN 81 -1.644 -14.873 1.644 478 1HE2 GLN 81 1HE2 GLN 81 1.328 -15.073 3.551 479 2HE2 GLN 81 2HE2 GLN 81 2.388 -15.315 2.176 480 H ALA 82 H ALA 82 0.153 -10.565 -0.550 481 HA ALA 82 HA ALA 82 2.827 -11.645 -0.392 482 1HB ALA 82 1HB ALA 82 1.661 -9.358 -1.982 483 2HB ALA 82 2HB ALA 82 3.304 -10.009 -2.182 484 3HB ALA 82 3HB ALA 82 1.908 -11.081 -2.437 485 H THR 83 H THR 83 4.747 -10.238 -0.384 486 HA THR 83 HA THR 83 4.689 -8.289 1.875 487 HB THR 83 HB THR 83 7.312 -8.816 1.459 488 HG1 THR 83 HG1 THR 83 7.240 -10.480 0.030 489 1HG2 THR 83 1HG2 THR 83 5.362 -10.484 3.096 490 2HG2 THR 83 2HG2 THR 83 7.122 -10.420 3.338 491 3HG2 THR 83 3HG2 THR 83 6.144 -8.964 3.599 492 H PHE 84 H PHE 84 4.126 -6.442 0.879 493 HA PHE 84 HA PHE 84 5.197 -5.720 -1.735 494 1HB PHE 84 1HB PHE 84 3.940 -3.589 -1.310 495 2HB PHE 84 2HB PHE 84 2.976 -5.065 -1.273 496 HD1 PHE 84 HD1 PHE 84 1.625 -5.664 0.601 497 HD2 PHE 84 HD2 PHE 84 4.677 -2.629 0.987 498 HE1 PHE 84 HE1 PHE 84 0.917 -5.249 2.902 499 HE2 PHE 84 HE2 PHE 84 4.097 -2.354 3.350 500 HZ PHE 84 HZ PHE 84 2.135 -3.588 4.320 501 H ASN 85 H ASN 85 6.773 -4.176 -2.132 502 HA ASN 85 HA ASN 85 8.817 -4.035 -0.003 503 1HB ASN 85 1HB ASN 85 9.413 -4.815 -2.153 504 2HB ASN 85 2HB ASN 85 8.840 -3.346 -2.952 505 1HD2 ASN 85 1HD2 ASN 85 9.916 -1.228 -2.233 506 2HD2 ASN 85 2HD2 ASN 85 11.648 -1.309 -1.992 507 H VAL 86 H VAL 86 7.770 -2.608 1.360 508 HA VAL 86 HA VAL 86 6.899 0.031 0.605 509 HB VAL 86 HB VAL 86 5.924 -1.197 2.381 510 1HG1 VAL 86 1HG1 VAL 86 6.800 -1.666 4.520 511 2HG1 VAL 86 2HG1 VAL 86 7.861 -2.430 3.337 512 3HG1 VAL 86 3HG1 VAL 86 8.361 -0.939 4.156 513 1HG2 VAL 86 1HG2 VAL 86 5.825 1.258 2.416 514 2HG2 VAL 86 2HG2 VAL 86 5.678 0.519 4.022 515 3HG2 VAL 86 3HG2 VAL 86 7.201 1.285 3.537 516 H THR 87 H THR 87 8.831 0.831 -0.563 517 HA THR 87 HA THR 87 10.165 2.714 0.823 518 HB THR 87 HB THR 87 11.503 1.026 2.003 519 HG1 THR 87 HG1 THR 87 13.551 1.823 1.410 520 1HG2 THR 87 1HG2 THR 87 11.460 -0.721 0.294 521 2HG2 THR 87 2HG2 THR 87 12.572 0.244 -0.711 522 3HG2 THR 87 3HG2 THR 87 13.103 -0.376 0.866 523 HA PRO 88 HA PRO 88 11.376 3.444 -3.488 524 1HB PRO 88 1HB PRO 88 13.129 5.564 -3.076 525 2HB PRO 88 2HB PRO 88 11.372 5.746 -3.203 526 1HG PRO 88 1HG PRO 88 13.050 5.768 -0.734 527 2HG PRO 88 2HG PRO 88 11.554 6.666 -1.083 528 1HD PRO 88 1HD PRO 88 11.702 4.367 0.466 529 2HD PRO 88 2HD PRO 88 10.232 4.932 -0.347 530 H MET 89 H MET 89 13.423 3.124 -0.639 531 HA MET 89 HA MET 89 15.044 1.126 -1.401 532 1HB MET 89 1HB MET 89 17.267 2.226 -1.872 533 2HB MET 89 2HB MET 89 16.118 2.208 -3.182 534 1HG MET 89 1HG MET 89 15.543 4.682 -2.353 535 2HG MET 89 2HG MET 89 17.119 4.539 -1.564 536 1HE MET 89 1HE MET 89 16.504 4.623 -6.125 537 2HE MET 89 2HE MET 89 15.987 3.206 -5.193 538 3HE MET 89 3HE MET 89 15.189 4.776 -4.936 539 H ALA 90 H ALA 90 15.893 4.345 -0.096 540 HA ALA 90 HA ALA 90 17.293 3.173 2.108 541 1HB ALA 90 1HB ALA 90 16.521 6.048 1.511 542 2HB ALA 90 2HB ALA 90 17.755 5.529 2.682 543 3HB ALA 90 3HB ALA 90 17.996 5.235 0.945 544 H ALA 91 H ALA 91 14.090 4.697 1.808 545 HA ALA 91 HA ALA 91 13.955 5.218 4.666 546 1HB ALA 91 1HB ALA 91 13.115 6.855 3.160 547 2HB ALA 91 2HB ALA 91 11.941 5.726 2.469 548 3HB ALA 91 3HB ALA 91 11.796 6.240 4.174 549 H GLY 92 H GLY 92 10.913 4.255 3.370 550 1HA GLY 92 1HA GLY 92 9.449 2.608 3.864 551 2HA GLY 92 2HA GLY 92 10.787 1.504 4.180 552 H ALA 93 H ALA 93 12.011 2.604 6.415 553 HA ALA 93 HA ALA 93 10.506 1.957 8.662 554 1HB ALA 93 1HB ALA 93 12.918 2.370 8.726 555 2HB ALA 93 2HB ALA 93 12.672 4.095 8.392 556 3HB ALA 93 3HB ALA 93 12.093 3.395 9.917 557 H TYR 94 H TYR 94 11.042 5.237 7.376 558 HA TYR 94 HA TYR 94 9.056 6.524 8.972 559 1HB TYR 94 1HB TYR 94 10.424 7.579 6.490 560 2HB TYR 94 2HB TYR 94 9.820 8.497 7.869 561 HD1 TYR 94 HD1 TYR 94 12.768 7.991 6.402 562 HD2 TYR 94 HD2 TYR 94 10.963 6.935 10.180 563 HE1 TYR 94 HE1 TYR 94 15.017 7.773 7.438 564 HE2 TYR 94 HE2 TYR 94 13.190 6.808 11.207 565 HH TYR 94 HH TYR 94 16.223 7.025 9.391 566 H PHE 95 H PHE 95 8.316 4.400 6.576 567 HA PHE 95 HA PHE 95 6.217 6.053 5.295 568 1HB PHE 95 1HB PHE 95 7.442 4.364 3.915 569 2HB PHE 95 2HB PHE 95 6.903 3.104 5.014 570 HD1 PHE 95 HD1 PHE 95 6.012 5.003 2.049 571 HD2 PHE 95 HD2 PHE 95 4.469 2.494 5.212 572 HE1 PHE 95 HE1 PHE 95 3.908 4.717 0.806 573 HE2 PHE 95 HE2 PHE 95 2.337 2.277 3.984 574 HZ PHE 95 HZ PHE 95 2.031 3.425 1.811 575 H ASN 96 H ASN 96 4.163 6.231 6.196 576 HA ASN 96 HA ASN 96 3.802 4.776 8.596 577 1HB ASN 96 1HB ASN 96 1.900 6.637 7.180 578 2HB ASN 96 2HB ASN 96 1.443 5.715 8.606 579 1HD2 ASN 96 1HD2 ASN 96 3.717 8.210 7.500 580 2HD2 ASN 96 2HD2 ASN 96 4.468 8.445 9.109 581 H LYS 97 H LYS 97 3.961 2.667 8.094 582 HA LYS 97 HA LYS 97 2.311 1.222 6.315 583 1HB LYS 97 1HB LYS 97 3.110 -0.764 7.419 584 2HB LYS 97 2HB LYS 97 4.403 0.341 6.999 585 1HG LYS 97 1HG LYS 97 3.259 0.267 9.821 586 2HG LYS 97 2HG LYS 97 4.369 -0.978 9.284 587 1HD LYS 97 1HD LYS 97 5.051 1.985 9.475 588 2HD LYS 97 2HD LYS 97 5.495 0.727 10.593 589 1HE LYS 97 1HE LYS 97 7.281 0.057 9.404 590 2HE LYS 97 2HE LYS 97 6.363 -0.052 7.909 591 1HZ LYS 97 1HZ LYS 97 7.678 2.399 8.957 592 2HZ LYS 97 2HZ LYS 97 7.979 1.624 7.553 593 3HZ LYS 97 3HZ LYS 97 6.581 2.399 7.766 594 H VAL 98 H VAL 98 1.496 2.503 9.387 595 HA VAL 98 HA VAL 98 -0.164 2.109 10.901 596 HB VAL 98 HB VAL 98 -1.842 2.323 8.374 597 1HG1 VAL 98 1HG1 VAL 98 -2.269 3.310 11.239 598 2HG1 VAL 98 2HG1 VAL 98 -3.337 3.638 9.862 599 3HG1 VAL 98 3HG1 VAL 98 -3.164 1.995 10.459 600 1HG2 VAL 98 1HG2 VAL 98 -0.341 4.462 9.947 601 2HG2 VAL 98 2HG2 VAL 98 -0.162 4.044 8.226 602 3HG2 VAL 98 3HG2 VAL 98 -1.639 4.807 8.789 603 H GLN 99 H GLN 99 0.739 -0.160 11.100 604 HA GLN 99 HA GLN 99 -0.683 -2.406 10.028 605 1HB GLN 99 1HB GLN 99 1.702 -2.391 10.752 606 2HB GLN 99 2HB GLN 99 1.177 -2.193 12.424 607 1HG GLN 99 1HG GLN 99 -0.264 -4.464 11.453 608 2HG GLN 99 2HG GLN 99 1.340 -4.606 10.744 609 1HE2 GLN 99 1HE2 GLN 99 -0.187 -3.726 13.889 610 2HE2 GLN 99 2HE2 GLN 99 0.936 -4.666 14.878 611 H CYS 100 H CYS 100 -2.767 -1.420 10.576 612 HA CYS 100 HA CYS 100 -4.252 -2.660 12.628 613 1HB CYS 100 1HB CYS 100 -4.748 -0.892 14.169 614 2HB CYS 100 2HB CYS 100 -2.994 -1.056 14.153 615 HG CYS 100 HG CYS 100 -4.966 1.136 12.670 616 H PHE 101 H PHE 101 -3.832 -0.018 10.275 617 HA PHE 101 HA PHE 101 -6.578 -0.505 9.344 618 1HB PHE 101 1HB PHE 101 -6.662 1.424 10.952 619 2HB PHE 101 2HB PHE 101 -5.559 2.309 9.897 620 HD1 PHE 101 HD1 PHE 101 -7.746 0.527 7.681 621 HD2 PHE 101 HD2 PHE 101 -7.680 3.847 10.470 622 HE1 PHE 101 HE1 PHE 101 -9.817 1.378 6.730 623 HE2 PHE 101 HE2 PHE 101 -9.709 4.750 9.423 624 HZ PHE 101 HZ PHE 101 -10.815 3.513 7.558 625 H CYS 102 H CYS 102 -4.988 -1.717 7.993 626 HA CYS 102 HA CYS 102 -4.414 -0.228 5.597 627 1HB CYS 102 1HB CYS 102 -2.071 -0.706 5.430 628 2HB CYS 102 2HB CYS 102 -2.307 0.028 7.022 629 HG CYS 102 HG CYS 102 -0.577 -1.777 7.313 630 H PHE 103 H PHE 103 -3.349 -1.961 3.993 631 HA PHE 103 HA PHE 103 -5.629 -3.570 3.594 632 1HB PHE 103 1HB PHE 103 -3.984 -2.427 1.901 633 2HB PHE 103 2HB PHE 103 -3.036 -3.901 2.056 634 HD1 PHE 103 HD1 PHE 103 -3.343 -5.213 0.103 635 HD2 PHE 103 HD2 PHE 103 -6.664 -2.912 1.600 636 HE1 PHE 103 HE1 PHE 103 -4.781 -6.131 -1.674 637 HE2 PHE 103 HE2 PHE 103 -8.123 -3.887 -0.138 638 HZ PHE 103 HZ PHE 103 -7.196 -5.504 -1.785 639 H THR 104 H THR 104 -6.088 -5.446 4.597 640 HA THR 104 HA THR 104 -4.020 -6.988 5.905 641 HB THR 104 HB THR 104 -6.293 -6.487 6.811 642 HG1 THR 104 HG1 THR 104 -6.418 -8.478 7.830 643 1HG2 THR 104 1HG2 THR 104 -8.184 -7.877 6.217 644 2HG2 THR 104 2HG2 THR 104 -7.591 -7.121 4.728 645 3HG2 THR 104 3HG2 THR 104 -7.215 -8.820 5.071 646 H GLU 105 H GLU 105 -5.702 -7.260 2.877 647 HA GLU 105 HA GLU 105 -5.951 -9.000 1.365 648 1HB GLU 105 1HB GLU 105 -3.719 -9.238 0.232 649 2HB GLU 105 2HB GLU 105 -4.385 -7.636 0.465 650 1HG GLU 105 1HG GLU 105 -2.863 -7.317 2.468 651 2HG GLU 105 2HG GLU 105 -2.124 -8.878 2.088 652 H THR 106 H THR 106 -6.728 -10.475 3.077 653 HA THR 106 HA THR 106 -5.011 -12.875 3.491 654 HB THR 106 HB THR 106 -6.275 -11.966 5.393 655 HG1 THR 106 HG1 THR 106 -7.086 -13.955 6.012 656 1HG2 THR 106 1HG2 THR 106 -8.784 -12.755 3.830 657 2HG2 THR 106 2HG2 THR 106 -8.721 -12.246 5.524 658 3HG2 THR 106 3HG2 THR 106 -8.306 -11.098 4.248 659 H THR 107 H THR 107 -6.977 -14.751 3.438 660 HA THR 107 HA THR 107 -6.904 -15.395 0.606 661 HB THR 107 HB THR 107 -6.307 -16.956 2.333 662 HG1 THR 107 HG1 THR 107 -7.017 -17.668 0.248 663 1HG2 THR 107 1HG2 THR 107 -8.054 -18.119 3.586 664 2HG2 THR 107 2HG2 THR 107 -8.111 -16.374 3.944 665 3HG2 THR 107 3HG2 THR 107 -9.295 -17.091 2.832 666 H LEU 108 H LEU 108 -8.680 -15.717 -0.791 667 HA LEU 108 HA LEU 108 -11.351 -14.701 0.090 668 1HB LEU 108 1HB LEU 108 -9.966 -14.216 -2.575 669 2HB LEU 108 2HB LEU 108 -11.576 -13.667 -2.147 670 HG LEU 108 HG LEU 108 -8.992 -12.751 -0.879 671 1HD1 LEU 108 1HD1 LEU 108 -10.857 -11.253 -2.761 672 2HD1 LEU 108 2HD1 LEU 108 -9.285 -10.698 -2.123 673 3HD1 LEU 108 3HD1 LEU 108 -9.354 -12.044 -3.254 674 1HD2 LEU 108 1HD2 LEU 108 -11.813 -11.660 -0.479 675 2HD2 LEU 108 2HD2 LEU 108 -10.932 -12.633 0.714 676 3HD2 LEU 108 3HD2 LEU 108 -10.315 -11.057 0.276 677 H GLU 109 H GLU 109 -12.986 -16.031 -0.504 678 HA GLU 109 HA GLU 109 -12.443 -18.482 -1.918 679 1HB GLU 109 1HB GLU 109 -15.062 -17.209 -0.987 680 2HB GLU 109 2HB GLU 109 -14.878 -18.857 -1.558 681 1HG GLU 109 1HG GLU 109 -13.040 -19.123 0.255 682 2HG GLU 109 2HG GLU 109 -13.727 -17.652 0.965 683 HA PRO 110 HA PRO 110 -12.744 -17.172 -6.001 684 1HB PRO 110 1HB PRO 110 -14.009 -19.167 -7.351 685 2HB PRO 110 2HB PRO 110 -12.423 -19.332 -6.556 686 1HG PRO 110 1HG PRO 110 -15.144 -20.126 -5.483 687 2HG PRO 110 2HG PRO 110 -13.675 -21.139 -5.534 688 1HD PRO 110 1HD PRO 110 -14.419 -19.747 -3.332 689 2HD PRO 110 2HD PRO 110 -12.696 -19.918 -3.738 690 H GLY 111 H GLY 111 -13.877 -15.273 -6.083 691 1HA GLY 111 1HA GLY 111 -15.916 -14.512 -7.435 692 2HA GLY 111 2HA GLY 111 -16.849 -15.318 -6.158 693 H GLU 112 H GLU 112 -14.499 -14.495 -4.172 694 HA GLU 112 HA GLU 112 -16.298 -12.504 -3.283 695 1HB GLU 112 1HB GLU 112 -13.735 -13.570 -2.073 696 2HB GLU 112 2HB GLU 112 -14.939 -12.581 -1.251 697 1HG GLU 112 1HG GLU 112 -15.419 -15.324 -2.335 698 2HG GLU 112 2HG GLU 112 -15.326 -14.821 -0.645 699 H GLU 113 H GLU 113 -16.164 -10.365 -3.073 700 HA GLU 113 HA GLU 113 -14.010 -8.888 -4.442 701 1HB GLU 113 1HB GLU 113 -16.675 -7.925 -3.325 702 2HB GLU 113 2HB GLU 113 -15.556 -7.017 -4.341 703 1HG GLU 113 1HG GLU 113 -16.035 -9.151 -5.915 704 2HG GLU 113 2HG GLU 113 -17.484 -9.159 -4.903 705 H MET 114 H MET 114 -12.208 -8.514 -3.047 706 HA MET 114 HA MET 114 -12.668 -7.834 -0.236 707 1HB MET 114 1HB MET 114 -10.900 -9.469 -1.176 708 2HB MET 114 2HB MET 114 -10.055 -8.068 -1.803 709 1HG MET 114 1HG MET 114 -10.752 -8.454 1.129 710 2HG MET 114 2HG MET 114 -9.237 -8.928 0.346 711 1HE MET 114 1HE MET 114 -9.309 -7.120 2.939 712 2HE MET 114 2HE MET 114 -7.843 -7.690 2.102 713 3HE MET 114 3HE MET 114 -8.022 -5.962 2.497 714 H GLU 115 H GLU 115 -12.545 -5.732 0.328 715 HA GLU 115 HA GLU 115 -10.563 -4.124 -0.893 716 1HB GLU 115 1HB GLU 115 -11.858 -2.103 -1.348 717 2HB GLU 115 2HB GLU 115 -12.368 -3.422 -2.391 718 1HG GLU 115 1HG GLU 115 -14.386 -3.765 -1.036 719 2HG GLU 115 2HG GLU 115 -13.856 -2.523 0.119 720 H MET 116 H MET 116 -9.932 -2.291 0.392 721 HA MET 116 HA MET 116 -11.314 -1.817 2.894 722 1HB MET 116 1HB MET 116 -8.475 -2.927 2.941 723 2HB MET 116 2HB MET 116 -9.225 -2.031 4.263 724 1HG MET 116 1HG MET 116 -11.066 -3.755 4.295 725 2HG MET 116 2HG MET 116 -10.128 -4.693 3.134 726 1HE MET 116 1HE MET 116 -8.627 -2.695 6.313 727 2HE MET 116 2HE MET 116 -10.246 -3.278 6.787 728 3HE MET 116 3HE MET 116 -8.785 -3.997 7.503 729 HA PRO 117 HA PRO 117 -9.172 2.172 2.112 730 1HB PRO 117 1HB PRO 117 -9.689 2.850 4.904 731 2HB PRO 117 2HB PRO 117 -10.226 3.670 3.427 732 1HG PRO 117 1HG PRO 117 -11.972 2.240 5.028 733 2HG PRO 117 2HG PRO 117 -12.154 2.389 3.258 734 1HD PRO 117 1HD PRO 117 -10.976 0.075 4.806 735 2HD PRO 117 2HD PRO 117 -12.119 0.092 3.427 736 H VAL 118 H VAL 118 -6.947 2.583 2.390 737 HA VAL 118 HA VAL 118 -5.616 1.663 4.898 738 HB VAL 118 HB VAL 118 -4.375 2.524 2.248 739 1HG1 VAL 118 1HG1 VAL 118 -3.107 1.463 4.776 740 2HG1 VAL 118 2HG1 VAL 118 -2.277 1.668 3.218 741 3HG1 VAL 118 3HG1 VAL 118 -2.933 3.073 4.058 742 1HG2 VAL 118 1HG2 VAL 118 -3.665 0.144 2.005 743 2HG2 VAL 118 2HG2 VAL 118 -4.786 -0.273 3.324 744 3HG2 VAL 118 3HG2 VAL 118 -5.402 0.408 1.810 745 H VAL 119 H VAL 119 -5.103 3.416 6.245 746 HA VAL 119 HA VAL 119 -5.435 6.150 5.065 747 HB VAL 119 HB VAL 119 -5.666 7.020 7.198 748 1HG1 VAL 119 1HG1 VAL 119 -7.669 6.176 6.040 749 2HG1 VAL 119 2HG1 VAL 119 -7.515 4.623 6.886 750 3HG1 VAL 119 3HG1 VAL 119 -7.847 6.106 7.801 751 1HG2 VAL 119 1HG2 VAL 119 -5.363 4.168 8.274 752 2HG2 VAL 119 2HG2 VAL 119 -4.270 5.536 8.586 753 3HG2 VAL 119 3HG2 VAL 119 -5.914 5.548 9.236 754 H PHE 120 H PHE 120 -3.687 7.568 5.033 755 HA PHE 120 HA PHE 120 -1.040 6.457 5.825 756 1HB PHE 120 1HB PHE 120 -1.697 5.394 3.689 757 2HB PHE 120 2HB PHE 120 -2.071 6.972 3.005 758 HD1 PHE 120 HD1 PHE 120 -0.352 8.438 2.227 759 HD2 PHE 120 HD2 PHE 120 0.693 4.917 4.451 760 HE1 PHE 120 HE1 PHE 120 2.036 9.011 1.982 761 HE2 PHE 120 HE2 PHE 120 3.077 5.551 4.319 762 HZ PHE 120 HZ PHE 120 3.770 7.562 3.063 763 H PHE 121 H PHE 121 0.685 7.871 5.785 764 HA PHE 121 HA PHE 121 0.727 10.277 4.341 765 1HB PHE 121 1HB PHE 121 1.049 11.850 6.215 766 2HB PHE 121 2HB PHE 121 -0.574 11.201 6.181 767 HD1 PHE 121 HD1 PHE 121 2.577 11.312 8.061 768 HD2 PHE 121 HD2 PHE 121 -1.303 9.504 7.785 769 HE1 PHE 121 HE1 PHE 121 2.847 10.405 10.367 770 HE2 PHE 121 HE2 PHE 121 -1.056 8.599 10.109 771 HZ PHE 121 HZ PHE 121 1.036 9.005 11.356 772 H VAL 122 H VAL 122 2.902 11.429 4.904 773 HA VAL 122 HA VAL 122 5.019 9.411 5.549 774 HB VAL 122 HB VAL 122 5.003 11.989 3.968 775 1HG1 VAL 122 1HG1 VAL 122 7.434 11.278 3.419 776 2HG1 VAL 122 2HG1 VAL 122 7.141 11.969 5.018 777 3HG1 VAL 122 3HG1 VAL 122 7.316 10.216 4.835 778 1HG2 VAL 122 1HG2 VAL 122 4.065 10.135 2.688 779 2HG2 VAL 122 2HG2 VAL 122 5.656 10.549 2.043 780 3HG2 VAL 122 3HG2 VAL 122 5.465 9.124 3.077 781 H ASP 123 H ASP 123 6.296 9.853 7.371 782 HA ASP 123 HA ASP 123 5.478 12.026 9.106 783 1HB ASP 123 1HB ASP 123 7.641 9.913 9.209 784 2HB ASP 123 2HB ASP 123 7.510 11.197 10.417 785 HA PRO 124 HA PRO 124 8.712 14.798 7.417 786 1HB PRO 124 1HB PRO 124 8.344 16.949 9.120 787 2HB PRO 124 2HB PRO 124 7.370 16.572 7.695 788 1HG PRO 124 1HG PRO 124 6.744 16.092 10.568 789 2HG PRO 124 2HG PRO 124 5.601 16.501 9.244 790 1HD PRO 124 1HD PRO 124 6.008 13.941 10.312 791 2HD PRO 124 2HD PRO 124 5.280 14.301 8.725 792 H GLU 125 H GLU 125 9.820 12.870 8.377 793 HA GLU 125 HA GLU 125 11.865 13.776 10.308 794 1HB GLU 125 1HB GLU 125 12.002 11.718 11.448 795 2HB GLU 125 2HB GLU 125 10.367 12.400 11.550 796 1HG GLU 125 1HG GLU 125 9.860 11.025 9.464 797 2HG GLU 125 2HG GLU 125 11.411 10.231 9.757 798 H ILE 126 H ILE 126 11.083 11.566 7.631 799 HA ILE 126 HA ILE 126 13.474 10.650 6.837 800 HB ILE 126 HB ILE 126 11.345 10.215 5.811 801 1HG1 ILE 126 1HG1 ILE 126 13.336 11.208 3.720 802 2HG1 ILE 126 2HG1 ILE 126 13.560 9.760 4.723 803 1HG2 ILE 126 1HG2 ILE 126 10.261 11.635 4.208 804 2HG2 ILE 126 2HG2 ILE 126 10.498 12.607 5.659 805 3HG2 ILE 126 3HG2 ILE 126 11.572 12.820 4.259 806 1HD1 ILE 126 1HD1 ILE 126 11.404 8.869 3.915 807 2HD1 ILE 126 2HD1 ILE 126 11.318 10.218 2.745 808 3HD1 ILE 126 3HD1 ILE 126 12.652 9.050 2.666 809 H VAL 127 H VAL 127 12.427 14.035 6.313 810 HA VAL 127 HA VAL 127 14.904 14.748 4.910 811 HB VAL 127 HB VAL 127 13.971 17.071 5.089 812 1HG1 VAL 127 1HG1 VAL 127 12.240 16.730 3.426 813 2HG1 VAL 127 2HG1 VAL 127 13.623 15.660 3.123 814 3HG1 VAL 127 3HG1 VAL 127 12.131 15.009 3.836 815 1HG2 VAL 127 1HG2 VAL 127 11.721 17.464 5.806 816 2HG2 VAL 127 2HG2 VAL 127 11.418 15.755 6.130 817 3HG2 VAL 127 3HG2 VAL 127 12.536 16.674 7.159 818 H LYS 128 H LYS 128 15.755 13.559 7.142 819 HA LYS 128 HA LYS 128 17.027 15.767 8.601 820 1HB LYS 128 1HB LYS 128 15.535 13.684 10.227 821 2HB LYS 128 2HB LYS 128 16.613 14.940 10.826 822 1HG LYS 128 1HG LYS 128 15.099 16.681 9.934 823 2HG LYS 128 2HG LYS 128 14.032 15.415 9.288 824 1HD LYS 128 1HD LYS 128 13.576 14.554 11.504 825 2HD LYS 128 2HD LYS 128 14.622 15.776 12.241 826 1HE LYS 128 1HE LYS 128 13.171 17.535 11.834 827 2HE LYS 128 2HE LYS 128 12.502 16.822 10.363 828 1HZ LYS 128 1HZ LYS 128 11.059 15.520 11.512 829 2HZ LYS 128 2HZ LYS 128 11.827 15.704 12.986 830 3HZ LYS 128 3HZ LYS 128 10.991 16.937 12.284 831 HA PRO 129 HA PRO 129 19.791 12.135 9.481 832 1HB PRO 129 1HB PRO 129 19.287 9.535 8.854 833 2HB PRO 129 2HB PRO 129 18.613 10.308 10.314 834 1HG PRO 129 1HG PRO 129 17.260 10.023 7.609 835 2HG PRO 129 2HG PRO 129 16.626 9.519 9.197 836 1HD PRO 129 1HD PRO 129 15.912 11.872 8.186 837 2HD PRO 129 2HD PRO 129 16.351 11.734 9.913 838 H VAL 130 H VAL 130 21.549 11.352 8.322 839 HA VAL 130 HA VAL 130 21.966 12.115 5.667 840 HB VAL 130 HB VAL 130 23.409 10.102 7.438 841 1HG1 VAL 130 1HG1 VAL 130 24.085 9.762 5.117 842 2HG1 VAL 130 2HG1 VAL 130 24.299 11.515 4.895 843 3HG1 VAL 130 3HG1 VAL 130 25.371 10.607 5.987 844 1HG2 VAL 130 1HG2 VAL 130 24.951 12.011 7.863 845 2HG2 VAL 130 2HG2 VAL 130 23.897 13.074 6.910 846 3HG2 VAL 130 3HG2 VAL 130 23.325 12.378 8.439 847 H GLU 131 H GLU 131 20.855 9.099 7.068 848 HA GLU 131 HA GLU 131 20.995 7.116 5.217 849 1HB GLU 131 1HB GLU 131 18.523 8.074 6.730 850 2HB GLU 131 2HB GLU 131 18.698 6.465 6.040 851 1HG GLU 131 1HG GLU 131 20.253 5.792 7.667 852 2HG GLU 131 2HG GLU 131 20.673 7.436 8.145 853 H THR 132 H THR 132 18.364 9.527 5.213 854 HA THR 132 HA THR 132 17.587 8.552 2.554 855 HB THR 132 HB THR 132 15.412 9.740 3.372 856 HG1 THR 132 HG1 THR 132 15.891 10.873 5.181 857 1HG2 THR 132 1HG2 THR 132 14.852 7.827 4.853 858 2HG2 THR 132 2HG2 THR 132 15.691 7.295 3.386 859 3HG2 THR 132 3HG2 THR 132 16.560 7.380 4.933 860 H GLN 133 H GLN 133 18.249 11.511 4.364 861 HA GLN 133 HA GLN 133 18.070 13.740 3.544 862 1HB GLN 133 1HB GLN 133 20.339 12.528 4.223 863 2HB GLN 133 2HB GLN 133 20.762 12.739 2.561 864 1HG GLN 133 1HG GLN 133 21.651 14.588 3.806 865 2HG GLN 133 2HG GLN 133 20.358 15.216 2.785 866 1HE2 GLN 133 1HE2 GLN 133 19.311 13.411 5.668 867 2HE2 GLN 133 2HE2 GLN 133 19.042 14.802 6.668 868 H GLY 134 H GLY 134 16.426 13.253 1.655 869 1HA GLY 134 1HA GLY 134 16.566 14.809 -0.453 870 2HA GLY 134 2HA GLY 134 17.732 13.603 -1.016 871 H ILE 135 H ILE 135 16.464 11.300 0.179 872 HA ILE 135 HA ILE 135 14.580 10.469 -1.754 873 HB ILE 135 HB ILE 135 15.001 9.589 1.097 874 1HG1 ILE 135 1HG1 ILE 135 16.920 9.183 -0.434 875 2HG1 ILE 135 2HG1 ILE 135 16.110 7.722 0.128 876 1HG2 ILE 135 1HG2 ILE 135 13.265 8.323 -1.060 877 2HG2 ILE 135 2HG2 ILE 135 13.746 7.547 0.476 878 3HG2 ILE 135 3HG2 ILE 135 12.705 8.967 0.478 879 1HD1 ILE 135 1HD1 ILE 135 15.030 7.382 -2.002 880 2HD1 ILE 135 2HD1 ILE 135 15.734 8.896 -2.637 881 3HD1 ILE 135 3HD1 ILE 135 16.781 7.538 -2.189 882 H LYS 136 H LYS 136 12.534 11.141 -2.116 883 HA LYS 136 HA LYS 136 10.732 11.610 0.067 884 1HB LYS 136 1HB LYS 136 10.143 13.959 -0.644 885 2HB LYS 136 2HB LYS 136 11.606 13.733 0.296 886 1HG LYS 136 1HG LYS 136 12.865 14.627 -1.247 887 2HG LYS 136 2HG LYS 136 12.315 13.507 -2.514 888 1HD LYS 136 1HD LYS 136 10.253 14.809 -2.797 889 2HD LYS 136 2HD LYS 136 10.814 16.000 -1.614 890 1HE LYS 136 1HE LYS 136 12.090 15.340 -4.327 891 2HE LYS 136 2HE LYS 136 11.263 16.843 -3.891 892 1HZ LYS 136 1HZ LYS 136 13.793 15.854 -2.740 893 2HZ LYS 136 2HZ LYS 136 13.628 17.112 -3.784 894 3HZ LYS 136 3HZ LYS 136 13.018 17.226 -2.260 895 H THR 137 H THR 137 10.621 9.658 -1.705 896 HA THR 137 HA THR 137 8.042 10.228 -2.971 897 HB THR 137 HB THR 137 8.936 8.601 -4.860 898 HG1 THR 137 HG1 THR 137 10.898 8.186 -3.838 899 1HG2 THR 137 1HG2 THR 137 9.777 11.504 -4.692 900 2HG2 THR 137 2HG2 THR 137 9.808 10.525 -6.183 901 3HG2 THR 137 3HG2 THR 137 8.267 10.820 -5.342 902 H LEU 138 H LEU 138 7.147 9.013 -1.236 903 HA LEU 138 HA LEU 138 8.760 6.705 -0.364 904 1HB LEU 138 1HB LEU 138 7.669 8.715 0.934 905 2HB LEU 138 2HB LEU 138 6.315 7.580 1.120 906 HG LEU 138 HG LEU 138 8.134 5.925 1.848 907 1HD1 LEU 138 1HD1 LEU 138 10.172 7.141 1.271 908 2HD1 LEU 138 2HD1 LEU 138 9.635 8.532 2.242 909 3HD1 LEU 138 3HD1 LEU 138 10.042 6.993 3.029 910 1HD2 LEU 138 1HD2 LEU 138 7.997 6.707 4.194 911 2HD2 LEU 138 2HD2 LEU 138 7.529 8.312 3.650 912 3HD2 LEU 138 3HD2 LEU 138 6.429 6.948 3.392 913 H THR 139 H THR 139 8.451 5.152 -1.892 914 HA THR 139 HA THR 139 5.702 4.542 -2.709 915 HB THR 139 HB THR 139 7.180 5.104 -4.489 916 HG1 THR 139 HG1 THR 139 5.713 3.327 -4.875 917 1HG2 THR 139 1HG2 THR 139 9.105 3.671 -5.073 918 2HG2 THR 139 2HG2 THR 139 9.334 4.568 -3.558 919 3HG2 THR 139 3HG2 THR 139 8.918 2.828 -3.522 920 H LEU 140 H LEU 140 4.989 2.360 -3.006 921 HA LEU 140 HA LEU 140 6.506 0.322 -1.534 922 1HB LEU 140 1HB LEU 140 3.650 -0.323 -1.897 923 2HB LEU 140 2HB LEU 140 4.838 -0.827 -0.717 924 HG LEU 140 HG LEU 140 4.644 1.670 0.145 925 1HD1 LEU 140 1HD1 LEU 140 3.225 2.377 -1.836 926 2HD1 LEU 140 2HD1 LEU 140 2.015 1.184 -1.363 927 3HD1 LEU 140 3HD1 LEU 140 2.349 2.578 -0.314 928 1HD2 LEU 140 1HD2 LEU 140 4.049 -0.254 1.414 929 2HD2 LEU 140 2HD2 LEU 140 2.676 0.866 1.540 930 3HD2 LEU 140 3HD2 LEU 140 2.580 -0.543 0.460 931 H SER 141 H SER 141 7.077 -1.308 -3.102 932 HA SER 141 HA SER 141 5.409 -1.521 -5.595 933 1HB SER 141 1HB SER 141 8.048 -2.817 -4.927 934 2HB SER 141 2HB SER 141 7.013 -3.249 -6.298 935 HG SER 141 HG SER 141 7.189 -1.231 -7.122 936 H TYR 142 H TYR 142 3.570 -2.457 -5.176 937 HA TYR 142 HA TYR 142 3.349 -4.875 -3.462 938 1HB TYR 142 1HB TYR 142 1.462 -3.210 -5.126 939 2HB TYR 142 2HB TYR 142 1.062 -4.878 -4.755 940 HD1 TYR 142 HD1 TYR 142 1.746 -1.548 -3.201 941 HD2 TYR 142 HD2 TYR 142 0.184 -5.538 -2.662 942 HE1 TYR 142 HE1 TYR 142 0.749 -0.882 -1.021 943 HE2 TYR 142 HE2 TYR 142 -0.785 -4.865 -0.507 944 HH TYR 142 HH TYR 142 -0.644 -3.307 1.176 945 H THR 143 H THR 143 4.725 -6.300 -4.347 946 HA THR 143 HA THR 143 4.185 -7.243 -7.140 947 HB THR 143 HB THR 143 6.717 -7.489 -5.446 948 HG1 THR 143 HG1 THR 143 7.502 -5.967 -7.000 949 1HG2 THR 143 1HG2 THR 143 6.445 -9.334 -7.075 950 2HG2 THR 143 2HG2 THR 143 6.160 -8.154 -8.376 951 3HG2 THR 143 3HG2 THR 143 7.744 -8.241 -7.575 952 H PHE 144 H PHE 144 2.376 -8.339 -6.301 953 HA PHE 144 HA PHE 144 2.402 -10.344 -4.394 954 1HB PHE 144 1HB PHE 144 0.899 -9.938 -6.988 955 2HB PHE 144 2HB PHE 144 0.602 -11.294 -5.964 956 HD1 PHE 144 HD1 PHE 144 0.022 -10.794 -3.427 957 HD2 PHE 144 HD2 PHE 144 -0.509 -8.010 -6.674 958 HE1 PHE 144 HE1 PHE 144 -1.538 -9.454 -2.030 959 HE2 PHE 144 HE2 PHE 144 -2.312 -6.927 -5.383 960 HZ PHE 144 HZ PHE 144 -2.689 -7.518 -3.003 961 H TYR 145 H TYR 145 2.723 -12.507 -4.368 962 HA TYR 145 HA TYR 145 3.640 -14.099 -6.589 963 1HB TYR 145 1HB TYR 145 5.881 -14.454 -5.835 964 2HB TYR 145 2HB TYR 145 5.643 -12.767 -6.224 965 HD1 TYR 145 HD1 TYR 145 7.584 -14.581 -4.274 966 HD2 TYR 145 HD2 TYR 145 4.553 -11.561 -3.655 967 HE1 TYR 145 HE1 TYR 145 8.939 -13.558 -2.483 968 HE2 TYR 145 HE2 TYR 145 6.005 -10.439 -2.051 969 HH TYR 145 HH TYR 145 9.194 -11.726 -1.100 970 HA PRO 146 HA PRO 146 2.095 -15.954 -2.547 971 1HB PRO 146 1HB PRO 146 -0.462 -16.648 -3.025 972 2HB PRO 146 2HB PRO 146 0.094 -15.018 -2.595 973 1HG PRO 146 1HG PRO 146 -0.491 -16.040 -5.421 974 2HG PRO 146 2HG PRO 146 -1.063 -14.586 -4.591 975 1HD PRO 146 1HD PRO 146 1.107 -14.483 -6.216 976 2HD PRO 146 2HD PRO 146 0.977 -13.552 -4.696 977 H ARG 147 H ARG 147 0.106 -17.699 -4.874 978 HA ARG 147 HA ARG 147 1.620 -20.118 -5.101 979 1HB ARG 147 1HB ARG 147 -0.967 -20.063 -3.452 980 2HB ARG 147 2HB ARG 147 -0.145 -21.508 -4.048 981 1HG ARG 147 1HG ARG 147 1.890 -20.832 -2.708 982 2HG ARG 147 2HG ARG 147 0.888 -19.580 -1.943 983 1HD ARG 147 1HD ARG 147 -0.727 -21.336 -1.222 984 2HD ARG 147 2HD ARG 147 0.306 -22.574 -1.979 985 HE ARG 147 HE ARG 147 1.902 -21.076 -0.187 986 1HH1 ARG 147 1HH1 ARG 147 -0.760 -23.381 -0.121 987 2HH1 ARG 147 2HH1 ARG 147 -0.339 -24.095 1.404 988 1HH2 ARG 147 1HH2 ARG 147 2.511 -21.995 1.858 989 2HH2 ARG 147 2HH2 ARG 147 1.573 -23.273 2.557 990 H GLU 148 H GLU 148 -0.255 -21.693 -6.210 991 HA GLU 148 HA GLU 148 -1.917 -20.035 -8.015 992 1HB GLU 148 1HB GLU 148 0.424 -20.046 -8.780 993 2HB GLU 148 2HB GLU 148 0.374 -21.800 -8.944 994 1HG GLU 148 1HG GLU 148 -1.787 -20.289 -10.378 995 2HG GLU 148 2HG GLU 148 -0.141 -19.933 -10.922 996 HA PRO 149 HA PRO 149 -4.057 -24.029 -7.510 997 1HB PRO 149 1HB PRO 149 -6.392 -23.239 -6.482 998 2HB PRO 149 2HB PRO 149 -4.905 -23.079 -5.533 999 1HG PRO 149 1HG PRO 149 -6.227 -20.898 -7.164 1000 2HG PRO 149 2HG PRO 149 -5.702 -20.852 -5.454 1001 1HD PRO 149 1HD PRO 149 -4.155 -19.962 -7.601 1002 2HD PRO 149 2HD PRO 149 -3.466 -20.547 -6.059 1003 H SER 150 H SER 150 -7.105 -22.765 -8.253 1004 HA SER 150 HA SER 150 -6.566 -23.114 -11.178 1005 1HB SER 150 1HB SER 150 -8.490 -24.486 -11.361 1006 2HB SER 150 2HB SER 150 -7.412 -25.150 -10.134 1007 HG SER 150 HG SER 150 -8.788 -24.026 -8.572 1008 H LYS 151 H LYS 151 -7.180 -21.542 -12.396 1009 HA LYS 151 HA LYS 151 -9.543 -19.848 -11.783 1010 1HB LYS 151 1HB LYS 151 -8.254 -17.956 -12.908 1011 2HB LYS 151 2HB LYS 151 -7.815 -18.306 -11.270 1012 1HG LYS 151 1HG LYS 151 -6.275 -19.658 -13.500 1013 2HG LYS 151 2HG LYS 151 -5.952 -17.975 -13.104 1014 1HD LYS 151 1HD LYS 151 -4.870 -18.444 -11.161 1015 2HD LYS 151 2HD LYS 151 -6.062 -19.625 -10.664 1016 1HE LYS 151 1HE LYS 151 -3.969 -20.739 -10.852 1017 2HE LYS 151 2HE LYS 151 -5.025 -21.366 -12.107 1018 1HZ LYS 151 1HZ LYS 151 -3.825 -20.032 -13.709 1019 2HZ LYS 151 2HZ LYS 151 -2.880 -19.386 -12.508 1020 3HZ LYS 151 3HZ LYS 151 -2.803 -20.975 -12.817 Start of MODEL 29 1 H VAL 21 H VAL 21 0.697 9.622 13.552 2 HA VAL 21 HA VAL 21 -0.373 6.884 14.172 3 HB VAL 21 HB VAL 21 0.664 7.667 16.134 4 1HG1 VAL 21 1HG1 VAL 21 0.423 10.139 15.862 5 2HG1 VAL 21 2HG1 VAL 21 -1.291 10.003 16.285 6 3HG1 VAL 21 3HG1 VAL 21 -0.051 9.554 17.461 7 1HG2 VAL 21 1HG2 VAL 21 -1.138 7.274 17.704 8 2HG2 VAL 21 2HG2 VAL 21 -2.357 7.659 16.479 9 3HG2 VAL 21 3HG2 VAL 21 -1.324 6.228 16.288 10 H GLU 22 H GLU 22 -1.295 7.282 12.171 11 HA GLU 22 HA GLU 22 -2.999 7.812 10.742 12 1HB GLU 22 1HB GLU 22 -3.824 6.170 12.635 13 2HB GLU 22 2HB GLU 22 -4.896 7.511 13.059 14 1HG GLU 22 1HG GLU 22 -5.703 7.526 10.665 15 2HG GLU 22 2HG GLU 22 -4.632 6.155 10.331 16 H GLN 23 H GLN 23 -1.787 10.150 11.817 17 HA GLN 23 HA GLN 23 -3.200 12.268 10.966 18 1HB GLN 23 1HB GLN 23 -4.186 11.382 13.615 19 2HB GLN 23 2HB GLN 23 -3.369 12.924 13.776 20 1HG GLN 23 1HG GLN 23 -5.462 12.427 11.624 21 2HG GLN 23 2HG GLN 23 -5.847 13.035 13.245 22 1HE2 GLN 23 1HE2 GLN 23 -4.119 13.863 10.178 23 2HE2 GLN 23 2HE2 GLN 23 -3.755 15.510 10.670 24 H ALA 24 H ALA 24 -1.954 14.196 11.452 25 HA ALA 24 HA ALA 24 0.686 13.754 12.787 26 1HB ALA 24 1HB ALA 24 0.432 14.718 9.954 27 2HB ALA 24 2HB ALA 24 1.890 14.111 10.765 28 3HB ALA 24 3HB ALA 24 0.575 12.990 10.315 29 H SER 25 H SER 25 -1.825 15.959 12.314 30 HA SER 25 HA SER 25 -0.678 18.285 11.707 31 1HB SER 25 1HB SER 25 -3.128 18.084 13.452 32 2HB SER 25 2HB SER 25 -2.855 19.116 12.036 33 HG SER 25 HG SER 25 -4.094 16.840 12.081 34 H ASP 26 H ASP 26 0.322 16.916 14.411 35 HA ASP 26 HA ASP 26 0.609 19.364 16.049 36 1HB ASP 26 1HB ASP 26 0.592 17.166 17.149 37 2HB ASP 26 2HB ASP 26 1.902 16.605 16.094 38 H LEU 27 H LEU 27 2.240 17.338 13.598 39 HA LEU 27 HA LEU 27 4.537 19.165 13.416 40 1HB LEU 27 1HB LEU 27 3.927 16.484 12.116 41 2HB LEU 27 2HB LEU 27 5.322 17.507 11.763 42 HG LEU 27 HG LEU 27 6.094 17.350 14.106 43 1HD1 LEU 27 1HD1 LEU 27 4.118 16.793 15.361 44 2HD1 LEU 27 2HD1 LEU 27 3.798 15.355 14.360 45 3HD1 LEU 27 3HD1 LEU 27 5.191 15.406 15.463 46 1HD2 LEU 27 1HD2 LEU 27 6.905 15.020 13.866 47 2HD2 LEU 27 2HD2 LEU 27 5.669 14.720 12.626 48 3HD2 LEU 27 3HD2 LEU 27 6.975 15.888 12.326 49 H ILE 28 H ILE 28 1.756 18.163 11.484 50 HA ILE 28 HA ILE 28 2.424 18.394 9.025 51 HB ILE 28 HB ILE 28 -0.121 19.596 10.100 52 1HG1 ILE 28 1HG1 ILE 28 0.546 17.206 8.289 53 2HG1 ILE 28 2HG1 ILE 28 0.392 17.115 10.030 54 1HG2 ILE 28 1HG2 ILE 28 0.543 19.287 7.157 55 2HG2 ILE 28 2HG2 ILE 28 -1.054 19.650 7.834 56 3HG2 ILE 28 3HG2 ILE 28 0.219 20.837 7.988 57 1HD1 ILE 28 1HD1 ILE 28 -2.016 18.057 9.677 58 2HD1 ILE 28 2HD1 ILE 28 -1.789 17.581 7.990 59 3HD1 ILE 28 3HD1 ILE 28 -1.701 16.355 9.264 60 H LEU 29 H LEU 29 3.075 19.530 7.375 61 HA LEU 29 HA LEU 29 3.941 22.339 7.915 62 1HB LEU 29 1HB LEU 29 5.095 20.225 6.068 63 2HB LEU 29 2HB LEU 29 5.673 21.884 6.280 64 HG LEU 29 HG LEU 29 7.080 20.545 7.510 65 1HD1 LEU 29 1HD1 LEU 29 6.879 21.235 9.819 66 2HD1 LEU 29 2HD1 LEU 29 6.430 22.553 8.714 67 3HD1 LEU 29 3HD1 LEU 29 5.177 21.649 9.592 68 1HD2 LEU 29 1HD2 LEU 29 5.783 18.498 7.549 69 2HD2 LEU 29 2HD2 LEU 29 6.535 18.837 9.114 70 3HD2 LEU 29 3HD2 LEU 29 4.804 19.047 8.910 71 H ASP 30 H ASP 30 4.000 21.122 4.679 72 HA ASP 30 HA ASP 30 1.618 22.315 3.645 73 1HB ASP 30 1HB ASP 30 2.527 24.466 4.285 74 2HB ASP 30 2HB ASP 30 4.149 24.028 3.719 75 H GLU 31 H GLU 31 5.092 21.977 3.117 76 HA GLU 31 HA GLU 31 5.446 21.636 0.524 77 1HB GLU 31 1HB GLU 31 6.933 20.948 2.801 78 2HB GLU 31 2HB GLU 31 6.821 19.425 1.915 79 1HG GLU 31 1HG GLU 31 7.810 22.012 0.705 80 2HG GLU 31 2HG GLU 31 8.822 20.767 1.444 81 H LYS 32 H LYS 32 5.236 20.077 -1.116 82 HA LYS 32 HA LYS 32 2.866 18.362 -0.600 83 1HB LYS 32 1HB LYS 32 2.721 20.407 -2.049 84 2HB LYS 32 2HB LYS 32 3.906 19.677 -3.151 85 1HG LYS 32 1HG LYS 32 2.362 17.678 -3.309 86 2HG LYS 32 2HG LYS 32 1.292 18.491 -2.173 87 1HD LYS 32 1HD LYS 32 0.189 19.034 -4.057 88 2HD LYS 32 2HD LYS 32 1.266 20.431 -3.952 89 1HE LYS 32 1HE LYS 32 1.477 17.926 -5.710 90 2HE LYS 32 2HE LYS 32 1.301 19.596 -6.259 91 1HZ LYS 32 1HZ LYS 32 3.549 18.788 -6.508 92 2HZ LYS 32 2HZ LYS 32 3.529 20.009 -5.400 93 3HZ LYS 32 3HZ LYS 32 3.661 18.448 -4.901 94 H ILE 33 H ILE 33 3.954 16.572 0.056 95 HA ILE 33 HA ILE 33 6.364 15.534 -1.325 96 HB ILE 33 HB ILE 33 6.171 15.916 1.052 97 1HG1 ILE 33 1HG1 ILE 33 7.963 14.755 0.312 98 2HG1 ILE 33 2HG1 ILE 33 7.340 13.911 1.702 99 1HG2 ILE 33 1HG2 ILE 33 4.466 13.417 1.182 100 2HG2 ILE 33 2HG2 ILE 33 5.166 14.336 2.532 101 3HG2 ILE 33 3HG2 ILE 33 3.920 15.070 1.538 102 1HD1 ILE 33 1HD1 ILE 33 6.143 12.314 0.044 103 2HD1 ILE 33 2HD1 ILE 33 7.196 13.028 -1.189 104 3HD1 ILE 33 3HD1 ILE 33 7.900 12.174 0.192 105 H LYS 34 H LYS 34 6.103 14.269 -3.032 106 HA LYS 34 HA LYS 34 3.518 13.236 -3.761 107 1HB LYS 34 1HB LYS 34 5.422 14.234 -5.194 108 2HB LYS 34 2HB LYS 34 6.142 12.624 -5.171 109 1HG LYS 34 1HG LYS 34 3.244 13.096 -6.022 110 2HG LYS 34 2HG LYS 34 4.578 13.464 -7.098 111 1HD LYS 34 1HD LYS 34 5.036 10.789 -6.152 112 2HD LYS 34 2HD LYS 34 3.336 10.934 -6.501 113 1HE LYS 34 1HE LYS 34 4.064 11.998 -8.782 114 2HE LYS 34 2HE LYS 34 5.730 11.582 -8.327 115 1HZ LYS 34 1HZ LYS 34 4.955 9.908 -9.710 116 2HZ LYS 34 2HZ LYS 34 4.768 9.198 -8.226 117 3HZ LYS 34 3HZ LYS 34 3.490 9.867 -9.043 118 H VAL 35 H VAL 35 3.141 10.847 -4.298 119 HA VAL 35 HA VAL 35 4.965 8.895 -3.030 120 HB VAL 35 HB VAL 35 2.142 9.554 -2.227 121 1HG1 VAL 35 1HG1 VAL 35 2.198 7.082 -2.577 122 2HG1 VAL 35 2HG1 VAL 35 3.578 6.980 -1.460 123 3HG1 VAL 35 3HG1 VAL 35 2.000 7.519 -0.886 124 1HG2 VAL 35 1HG2 VAL 35 3.299 9.224 0.093 125 2HG2 VAL 35 2HG2 VAL 35 4.799 9.340 -0.789 126 3HG2 VAL 35 3HG2 VAL 35 3.645 10.701 -0.802 127 H THR 36 H THR 36 4.677 6.875 -3.898 128 HA THR 36 HA THR 36 2.982 6.644 -6.334 129 HB THR 36 HB THR 36 6.034 6.429 -6.086 130 HG1 THR 36 HG1 THR 36 5.159 8.496 -6.307 131 1HG2 THR 36 1HG2 THR 36 6.051 5.937 -8.505 132 2HG2 THR 36 2HG2 THR 36 5.339 4.653 -7.519 133 3HG2 THR 36 3HG2 THR 36 4.278 5.742 -8.456 134 H PHE 37 H PHE 37 1.773 5.042 -5.683 135 HA PHE 37 HA PHE 37 2.798 2.988 -3.874 136 1HB PHE 37 1HB PHE 37 0.180 3.284 -5.414 137 2HB PHE 37 2HB PHE 37 0.521 2.114 -4.154 138 HD1 PHE 37 HD1 PHE 37 -1.090 5.153 -4.729 139 HD2 PHE 37 HD2 PHE 37 1.511 3.228 -1.860 140 HE1 PHE 37 HE1 PHE 37 -1.782 6.759 -2.994 141 HE2 PHE 37 HE2 PHE 37 0.888 4.929 -0.164 142 HZ PHE 37 HZ PHE 37 -0.706 6.735 -0.754 143 H ASP 38 H ASP 38 3.200 0.743 -4.430 144 HA ASP 38 HA ASP 38 2.964 0.080 -7.331 145 1HB ASP 38 1HB ASP 38 5.293 0.705 -6.877 146 2HB ASP 38 2HB ASP 38 5.327 -0.313 -5.457 147 H ALA 39 H ALA 39 0.940 -0.771 -6.787 148 HA ALA 39 HA ALA 39 0.953 -3.325 -5.271 149 1HB ALA 39 1HB ALA 39 -1.259 -1.781 -6.702 150 2HB ALA 39 2HB ALA 39 -1.468 -3.279 -5.776 151 3HB ALA 39 3HB ALA 39 -0.943 -1.795 -4.957 152 H ASN 40 H ASN 40 2.051 -4.913 -6.518 153 HA ASN 40 HA ASN 40 1.351 -5.014 -9.425 154 1HB ASN 40 1HB ASN 40 3.615 -6.072 -9.733 155 2HB ASN 40 2HB ASN 40 3.516 -4.366 -9.442 156 1HD2 ASN 40 1HD2 ASN 40 4.502 -3.472 -7.716 157 2HD2 ASN 40 2HD2 ASN 40 5.498 -4.382 -6.608 158 H VAL 41 H VAL 41 0.524 -6.706 -10.234 159 HA VAL 41 HA VAL 41 0.030 -9.005 -8.484 160 HB VAL 41 HB VAL 41 -1.907 -7.784 -9.162 161 1HG1 VAL 41 1HG1 VAL 41 -2.764 -7.649 -11.392 162 2HG1 VAL 41 2HG1 VAL 41 -1.175 -6.878 -11.372 163 3HG1 VAL 41 3HG1 VAL 41 -1.375 -8.499 -12.073 164 1HG2 VAL 41 1HG2 VAL 41 -2.075 -10.145 -8.750 165 2HG2 VAL 41 2HG2 VAL 41 -3.198 -9.697 -10.047 166 3HG2 VAL 41 3HG2 VAL 41 -1.695 -10.535 -10.444 167 H ALA 42 H ALA 42 1.704 -10.306 -8.654 168 HA ALA 42 HA ALA 42 2.684 -11.174 -11.315 169 1HB ALA 42 1HB ALA 42 4.296 -10.711 -9.502 170 2HB ALA 42 2HB ALA 42 3.525 -11.975 -8.520 171 3HB ALA 42 3HB ALA 42 4.364 -12.406 -10.023 172 H ALA 43 H ALA 43 3.054 -13.602 -11.522 173 HA ALA 43 HA ALA 43 0.624 -15.101 -11.418 174 1HB ALA 43 1HB ALA 43 2.089 -17.026 -11.945 175 2HB ALA 43 2HB ALA 43 2.459 -15.633 -12.981 176 3HB ALA 43 3HB ALA 43 3.524 -16.034 -11.613 177 H GLY 44 H GLY 44 -0.221 -16.310 -9.775 178 1HA GLY 44 1HA GLY 44 0.356 -17.645 -7.655 179 2HA GLY 44 2HA GLY 44 1.147 -16.162 -7.115 180 H LEU 45 H LEU 45 -0.681 -14.250 -8.292 181 HA LEU 45 HA LEU 45 -3.170 -14.796 -6.733 182 1HB LEU 45 1HB LEU 45 -1.043 -12.959 -6.157 183 2HB LEU 45 2HB LEU 45 -2.466 -12.021 -6.553 184 HG LEU 45 HG LEU 45 -2.673 -14.355 -4.582 185 1HD1 LEU 45 1HD1 LEU 45 -2.321 -11.394 -3.883 186 2HD1 LEU 45 2HD1 LEU 45 -2.444 -12.759 -2.768 187 3HD1 LEU 45 3HD1 LEU 45 -0.990 -12.550 -3.758 188 1HD2 LEU 45 1HD2 LEU 45 -4.690 -13.437 -5.678 189 2HD2 LEU 45 2HD2 LEU 45 -4.619 -13.164 -3.919 190 3HD2 LEU 45 3HD2 LEU 45 -4.248 -11.829 -5.056 191 HA PRO 46 HA PRO 46 -4.378 -13.352 -10.906 192 1HB PRO 46 1HB PRO 46 -6.437 -14.991 -11.399 193 2HB PRO 46 2HB PRO 46 -4.772 -15.630 -11.274 194 1HG PRO 46 1HG PRO 46 -6.880 -15.577 -9.106 195 2HG PRO 46 2HG PRO 46 -5.927 -16.995 -9.648 196 1HD PRO 46 1HD PRO 46 -5.256 -15.399 -7.507 197 2HD PRO 46 2HD PRO 46 -4.023 -16.258 -8.473 198 H TRP 47 H TRP 47 -4.795 -11.632 -8.840 199 HA TRP 47 HA TRP 47 -7.757 -11.199 -8.570 200 1HB TRP 47 1HB TRP 47 -5.482 -10.511 -6.707 201 2HB TRP 47 2HB TRP 47 -7.120 -9.865 -6.565 202 HD1 TRP 47 HD1 TRP 47 -7.509 -13.332 -7.681 203 HE1 TRP 47 HE1 TRP 47 -8.141 -14.859 -5.826 204 HE3 TRP 47 HE3 TRP 47 -6.156 -10.416 -3.649 205 HZ2 TRP 47 HZ2 TRP 47 -8.151 -14.933 -3.011 206 HZ3 TRP 47 HZ3 TRP 47 -6.055 -11.621 -1.450 207 HH2 TRP 47 HH2 TRP 47 -7.346 -13.635 -1.055 208 H GLU 48 H GLU 48 -8.612 -9.273 -9.117 209 HA GLU 48 HA GLU 48 -6.938 -7.612 -10.936 210 1HB GLU 48 1HB GLU 48 -9.301 -8.364 -11.493 211 2HB GLU 48 2HB GLU 48 -9.874 -7.304 -10.192 212 1HG GLU 48 1HG GLU 48 -8.905 -5.356 -11.356 213 2HG GLU 48 2HG GLU 48 -8.303 -6.404 -12.650 214 H PHE 49 H PHE 49 -5.533 -7.026 -9.263 215 HA PHE 49 HA PHE 49 -6.543 -5.522 -6.918 216 1HB PHE 49 1HB PHE 49 -4.778 -7.528 -7.104 217 2HB PHE 49 2HB PHE 49 -3.650 -6.202 -7.278 218 HD1 PHE 49 HD1 PHE 49 -4.578 -8.428 -4.981 219 HD2 PHE 49 HD2 PHE 49 -4.615 -4.129 -5.423 220 HE1 PHE 49 HE1 PHE 49 -4.656 -8.171 -2.539 221 HE2 PHE 49 HE2 PHE 49 -4.646 -3.892 -2.960 222 HZ PHE 49 HZ PHE 49 -4.707 -5.911 -1.505 223 H VAL 50 H VAL 50 -7.158 -3.585 -7.908 224 HA VAL 50 HA VAL 50 -5.266 -2.450 -9.828 225 HB VAL 50 HB VAL 50 -6.927 -0.894 -10.455 226 1HG1 VAL 50 1HG1 VAL 50 -7.088 -3.278 -11.237 227 2HG1 VAL 50 2HG1 VAL 50 -8.272 -3.579 -9.944 228 3HG1 VAL 50 3HG1 VAL 50 -8.639 -2.420 -11.232 229 1HG2 VAL 50 1HG2 VAL 50 -9.227 -0.990 -9.359 230 2HG2 VAL 50 2HG2 VAL 50 -8.432 -1.817 -8.003 231 3HG2 VAL 50 3HG2 VAL 50 -7.970 -0.158 -8.431 232 HA PRO 51 HA PRO 51 -3.799 0.615 -6.751 233 1HB PRO 51 1HB PRO 51 -2.179 2.069 -8.391 234 2HB PRO 51 2HB PRO 51 -1.681 0.487 -7.729 235 1HG PRO 51 1HG PRO 51 -2.794 1.086 -10.473 236 2HG PRO 51 2HG PRO 51 -1.405 0.046 -10.052 237 1HD PRO 51 1HD PRO 51 -3.946 -0.883 -10.551 238 2HD PRO 51 2HD PRO 51 -2.824 -1.731 -9.441 239 H VAL 52 H VAL 52 -5.328 2.159 -6.345 240 HA VAL 52 HA VAL 52 -7.310 2.722 -8.276 241 HB VAL 52 HB VAL 52 -8.274 4.228 -6.632 242 1HG1 VAL 52 1HG1 VAL 52 -8.854 1.818 -6.721 243 2HG1 VAL 52 2HG1 VAL 52 -7.447 1.429 -5.714 244 3HG1 VAL 52 3HG1 VAL 52 -8.798 2.366 -5.037 245 1HG2 VAL 52 1HG2 VAL 52 -5.904 3.341 -4.977 246 2HG2 VAL 52 2HG2 VAL 52 -6.208 4.952 -5.630 247 3HG2 VAL 52 3HG2 VAL 52 -7.301 4.297 -4.401 248 H GLN 53 H GLN 53 -4.576 4.518 -7.167 249 HA GLN 53 HA GLN 53 -4.464 5.646 -9.803 250 1HB GLN 53 1HB GLN 53 -3.681 7.838 -9.200 251 2HB GLN 53 2HB GLN 53 -5.309 7.620 -8.576 252 1HG GLN 53 1HG GLN 53 -2.715 7.393 -6.954 253 2HG GLN 53 2HG GLN 53 -3.778 8.807 -7.018 254 1HE2 GLN 53 1HE2 GLN 53 -6.221 8.121 -6.637 255 2HE2 GLN 53 2HE2 GLN 53 -6.438 7.177 -5.174 256 H ARG 54 H ARG 54 -2.088 6.096 -10.251 257 HA ARG 54 HA ARG 54 -0.391 4.073 -9.072 258 1HB ARG 54 1HB ARG 54 -0.056 4.822 -11.354 259 2HB ARG 54 2HB ARG 54 0.167 6.490 -10.837 260 1HG ARG 54 1HG ARG 54 2.264 5.371 -11.465 261 2HG ARG 54 2HG ARG 54 2.294 5.983 -9.810 262 1HD ARG 54 1HD ARG 54 2.158 3.882 -8.905 263 2HD ARG 54 2HD ARG 54 1.563 3.179 -10.426 264 HE ARG 54 HE ARG 54 4.103 4.163 -11.002 265 1HH1 ARG 54 1HH1 ARG 54 3.014 1.864 -8.552 266 2HH1 ARG 54 2HH1 ARG 54 4.123 0.597 -9.001 267 1HH2 ARG 54 1HH2 ARG 54 5.821 2.636 -11.383 268 2HH2 ARG 54 2HH2 ARG 54 5.874 1.162 -10.466 269 H ASP 55 H ASP 55 -0.651 7.671 -8.754 270 HA ASP 55 HA ASP 55 0.943 7.627 -6.311 271 1HB ASP 55 1HB ASP 55 2.129 9.499 -7.488 272 2HB ASP 55 2HB ASP 55 2.394 7.912 -8.230 273 H ILE 56 H ILE 56 0.945 9.581 -5.181 274 HA ILE 56 HA ILE 56 -1.397 11.358 -5.458 275 HB ILE 56 HB ILE 56 -1.942 11.273 -3.122 276 1HG1 ILE 56 1HG1 ILE 56 0.076 9.033 -3.033 277 2HG1 ILE 56 2HG1 ILE 56 0.289 10.651 -2.319 278 1HG2 ILE 56 1HG2 ILE 56 -1.948 8.492 -4.320 279 2HG2 ILE 56 2HG2 ILE 56 -3.035 9.152 -3.063 280 3HG2 ILE 56 3HG2 ILE 56 -3.112 9.783 -4.717 281 1HD1 ILE 56 1HD1 ILE 56 -0.254 9.101 -0.577 282 2HD1 ILE 56 2HD1 ILE 56 -1.543 10.306 -0.774 283 3HD1 ILE 56 3HD1 ILE 56 -1.775 8.647 -1.357 284 H ASP 57 H ASP 57 -1.064 13.158 -3.654 285 HA ASP 57 HA ASP 57 1.651 13.159 -2.673 286 1HB ASP 57 1HB ASP 57 2.011 15.491 -2.779 287 2HB ASP 57 2HB ASP 57 1.633 14.976 -4.428 288 H VAL 58 H VAL 58 1.862 14.219 -0.742 289 HA VAL 58 HA VAL 58 -0.550 14.442 1.064 290 HB VAL 58 HB VAL 58 2.202 13.322 1.522 291 1HG1 VAL 58 1HG1 VAL 58 0.049 14.204 3.485 292 2HG1 VAL 58 2HG1 VAL 58 1.378 13.114 3.930 293 3HG1 VAL 58 3HG1 VAL 58 1.720 14.767 3.421 294 1HG2 VAL 58 1HG2 VAL 58 0.968 11.380 2.250 295 2HG2 VAL 58 2HG2 VAL 58 -0.563 12.210 1.948 296 3HG2 VAL 58 3HG2 VAL 58 0.506 11.781 0.591 297 H ARG 59 H ARG 59 -0.486 16.380 2.258 298 HA ARG 59 HA ARG 59 1.630 18.415 1.720 299 1HB ARG 59 1HB ARG 59 -0.972 18.638 3.290 300 2HB ARG 59 2HB ARG 59 0.099 19.959 2.805 301 1HG ARG 59 1HG ARG 59 -1.456 18.110 0.918 302 2HG ARG 59 2HG ARG 59 -1.959 19.725 1.393 303 1HD ARG 59 1HD ARG 59 0.690 19.132 -0.020 304 2HD ARG 59 2HD ARG 59 -0.747 19.493 -0.894 305 HE ARG 59 HE ARG 59 0.975 21.301 0.685 306 1HH1 ARG 59 1HH1 ARG 59 -2.259 20.901 -0.634 307 2HH1 ARG 59 2HH1 ARG 59 -2.658 22.596 -0.653 308 1HH2 ARG 59 1HH2 ARG 59 0.453 23.576 0.790 309 2HH2 ARG 59 2HH2 ARG 59 -1.043 24.156 0.156 310 H ILE 60 H ILE 60 3.330 17.868 2.889 311 HA ILE 60 HA ILE 60 3.592 15.690 4.123 312 HB ILE 60 HB ILE 60 5.105 17.853 5.550 313 1HG1 ILE 60 1HG1 ILE 60 5.234 16.903 2.729 314 2HG1 ILE 60 2HG1 ILE 60 5.555 18.493 3.450 315 1HG2 ILE 60 1HG2 ILE 60 6.748 16.070 5.829 316 2HG2 ILE 60 2HG2 ILE 60 5.209 15.460 6.399 317 3HG2 ILE 60 3HG2 ILE 60 5.790 14.961 4.818 318 1HD1 ILE 60 1HD1 ILE 60 7.629 17.482 2.586 319 2HD1 ILE 60 2HD1 ILE 60 7.688 17.609 4.361 320 3HD1 ILE 60 3HD1 ILE 60 7.356 16.044 3.562 321 H GLY 61 H GLY 61 2.620 14.502 5.531 322 1HA GLY 61 1HA GLY 61 2.187 13.827 7.729 323 2HA GLY 61 2HA GLY 61 1.939 15.489 8.246 324 H GLU 62 H GLU 62 0.283 15.928 5.620 325 HA GLU 62 HA GLU 62 -2.126 15.526 7.013 326 1HB GLU 62 1HB GLU 62 -1.882 17.335 5.410 327 2HB GLU 62 2HB GLU 62 -1.897 16.171 4.066 328 1HG GLU 62 1HG GLU 62 -4.105 17.269 4.425 329 2HG GLU 62 2HG GLU 62 -4.215 15.522 4.618 330 H THR 63 H THR 63 -3.735 14.237 6.966 331 HA THR 63 HA THR 63 -3.332 11.428 6.317 332 HB THR 63 HB THR 63 -5.754 11.755 7.652 333 HG1 THR 63 HG1 THR 63 -5.081 14.097 7.924 334 1HG2 THR 63 1HG2 THR 63 -2.937 11.527 8.810 335 2HG2 THR 63 2HG2 THR 63 -4.477 11.037 9.575 336 3HG2 THR 63 3HG2 THR 63 -3.898 10.174 8.153 337 H VAL 64 H VAL 64 -3.685 10.903 4.280 338 HA VAL 64 HA VAL 64 -6.215 11.784 2.946 339 HB VAL 64 HB VAL 64 -4.376 12.755 1.864 340 1HG1 VAL 64 1HG1 VAL 64 -3.052 10.010 1.755 341 2HG1 VAL 64 2HG1 VAL 64 -2.481 11.471 0.919 342 3HG1 VAL 64 3HG1 VAL 64 -2.501 11.431 2.680 343 1HG2 VAL 64 1HG2 VAL 64 -4.406 11.900 -0.365 344 2HG2 VAL 64 2HG2 VAL 64 -5.035 10.332 0.165 345 3HG2 VAL 64 3HG2 VAL 64 -6.047 11.795 0.314 346 H GLN 65 H GLN 65 -7.216 10.214 1.585 347 HA GLN 65 HA GLN 65 -6.947 7.346 2.512 348 1HB GLN 65 1HB GLN 65 -9.372 8.969 1.719 349 2HB GLN 65 2HB GLN 65 -9.355 7.229 2.041 350 1HG GLN 65 1HG GLN 65 -8.646 7.588 4.357 351 2HG GLN 65 2HG GLN 65 -8.566 9.340 4.103 352 1HE2 GLN 65 1HE2 GLN 65 -10.726 10.154 2.920 353 2HE2 GLN 65 2HE2 GLN 65 -12.189 9.670 3.768 354 H ILE 66 H ILE 66 -6.304 5.995 1.111 355 HA ILE 66 HA ILE 66 -7.338 6.289 -1.631 356 HB ILE 66 HB ILE 66 -5.220 5.272 -2.505 357 1HG1 ILE 66 1HG1 ILE 66 -3.190 6.309 -1.101 358 2HG1 ILE 66 2HG1 ILE 66 -4.191 5.963 0.276 359 1HG2 ILE 66 1HG2 ILE 66 -4.222 7.403 -2.817 360 2HG2 ILE 66 2HG2 ILE 66 -5.971 7.634 -2.803 361 3HG2 ILE 66 3HG2 ILE 66 -5.008 8.078 -1.373 362 1HD1 ILE 66 1HD1 ILE 66 -3.244 4.028 -1.889 363 2HD1 ILE 66 2HD1 ILE 66 -2.633 4.114 -0.225 364 3HD1 ILE 66 3HD1 ILE 66 -4.282 3.542 -0.537 365 H MET 67 H MET 67 -8.605 4.761 -1.948 366 HA MET 67 HA MET 67 -8.680 2.293 -0.408 367 1HB MET 67 1HB MET 67 -10.121 3.094 -2.973 368 2HB MET 67 2HB MET 67 -10.476 1.644 -2.025 369 1HG MET 67 1HG MET 67 -11.098 3.023 -0.092 370 2HG MET 67 2HG MET 67 -10.765 4.497 -1.018 371 1HE MET 67 1HE MET 67 -13.456 3.941 0.565 372 2HE MET 67 2HE MET 67 -13.132 5.427 -0.368 373 3HE MET 67 3HE MET 67 -14.646 4.527 -0.621 374 H TYR 68 H TYR 68 -8.706 0.131 -1.431 375 HA TYR 68 HA TYR 68 -7.309 -0.090 -4.018 376 1HB TYR 68 1HB TYR 68 -6.586 -1.756 -1.578 377 2HB TYR 68 2HB TYR 68 -6.108 -2.099 -3.241 378 HD1 TYR 68 HD1 TYR 68 -4.681 -0.389 -4.514 379 HD2 TYR 68 HD2 TYR 68 -5.301 -0.208 -0.255 380 HE1 TYR 68 HE1 TYR 68 -2.650 1.015 -4.279 381 HE2 TYR 68 HE2 TYR 68 -3.218 1.125 -0.015 382 HH TYR 68 HH TYR 68 -1.417 2.405 -2.737 383 H ARG 69 H ARG 69 -8.190 -1.735 -5.240 384 HA ARG 69 HA ARG 69 -10.548 -3.190 -4.134 385 1HB ARG 69 1HB ARG 69 -11.034 -1.207 -5.684 386 2HB ARG 69 2HB ARG 69 -10.284 -2.156 -6.971 387 1HG ARG 69 1HG ARG 69 -11.971 -3.998 -6.474 388 2HG ARG 69 2HG ARG 69 -12.737 -2.861 -5.345 389 1HD ARG 69 1HD ARG 69 -12.829 -1.209 -7.364 390 2HD ARG 69 2HD ARG 69 -12.402 -2.601 -8.356 391 HE ARG 69 HE ARG 69 -14.438 -3.659 -7.932 392 1HH1 ARG 69 1HH1 ARG 69 -14.219 -0.672 -6.045 393 2HH1 ARG 69 2HH1 ARG 69 -15.704 -0.811 -5.365 394 1HH2 ARG 69 1HH2 ARG 69 -16.662 -3.700 -7.180 395 2HH2 ARG 69 2HH2 ARG 69 -17.316 -2.297 -6.381 396 H ALA 70 H ALA 70 -10.051 -5.299 -4.090 397 HA ALA 70 HA ALA 70 -8.210 -6.498 -6.109 398 1HB ALA 70 1HB ALA 70 -7.473 -7.973 -4.343 399 2HB ALA 70 2HB ALA 70 -7.150 -6.259 -3.968 400 3HB ALA 70 3HB ALA 70 -8.474 -7.096 -3.160 401 H LYS 71 H LYS 71 -9.510 -7.528 -7.486 402 HA LYS 71 HA LYS 71 -11.934 -8.931 -6.392 403 1HB LYS 71 1HB LYS 71 -13.029 -7.644 -7.706 404 2HB LYS 71 2HB LYS 71 -11.562 -6.968 -8.408 405 1HG LYS 71 1HG LYS 71 -11.486 -8.893 -9.977 406 2HG LYS 71 2HG LYS 71 -12.985 -9.491 -9.244 407 1HD LYS 71 1HD LYS 71 -14.207 -7.490 -10.015 408 2HD LYS 71 2HD LYS 71 -12.684 -6.667 -10.345 409 1HE LYS 71 1HE LYS 71 -12.296 -8.692 -12.044 410 2HE LYS 71 2HE LYS 71 -14.063 -8.778 -12.035 411 1HZ LYS 71 1HZ LYS 71 -14.074 -6.774 -13.221 412 2HZ LYS 71 2HZ LYS 71 -12.769 -6.175 -12.365 413 3HZ LYS 71 3HZ LYS 71 -12.458 -7.189 -13.505 414 H ASN 72 H ASN 72 -12.030 -11.063 -6.312 415 HA ASN 72 HA ASN 72 -9.706 -12.429 -7.266 416 1HB ASN 72 1HB ASN 72 -10.705 -12.973 -5.128 417 2HB ASN 72 2HB ASN 72 -12.205 -13.495 -5.921 418 1HD2 ASN 72 1HD2 ASN 72 -11.521 -15.507 -4.528 419 2HD2 ASN 72 2HD2 ASN 72 -10.400 -16.639 -5.270 420 H LEU 73 H LEU 73 -9.365 -13.053 -9.351 421 HA LEU 73 HA LEU 73 -11.683 -13.872 -10.998 422 1HB LEU 73 1HB LEU 73 -9.717 -12.118 -11.570 423 2HB LEU 73 2HB LEU 73 -8.885 -13.598 -12.036 424 HG LEU 73 HG LEU 73 -10.968 -14.114 -13.498 425 1HD1 LEU 73 1HD1 LEU 73 -12.261 -12.124 -14.206 426 2HD1 LEU 73 2HD1 LEU 73 -12.516 -12.433 -12.484 427 3HD1 LEU 73 3HD1 LEU 73 -11.424 -11.131 -12.995 428 1HD2 LEU 73 1HD2 LEU 73 -9.214 -11.701 -14.123 429 2HD2 LEU 73 2HD2 LEU 73 -8.796 -13.405 -14.410 430 3HD2 LEU 73 3HD2 LEU 73 -10.128 -12.657 -15.310 431 H ALA 74 H ALA 74 -9.981 -15.575 -8.852 432 HA ALA 74 HA ALA 74 -9.137 -17.815 -10.557 433 1HB ALA 74 1HB ALA 74 -9.526 -17.665 -7.552 434 2HB ALA 74 2HB ALA 74 -8.750 -18.979 -8.464 435 3HB ALA 74 3HB ALA 74 -7.993 -17.387 -8.398 436 H SER 75 H SER 75 -10.116 -19.979 -10.116 437 HA SER 75 HA SER 75 -13.110 -19.867 -9.798 438 1HB SER 75 1HB SER 75 -11.348 -21.864 -11.233 439 2HB SER 75 2HB SER 75 -13.091 -22.059 -10.951 440 HG SER 75 HG SER 75 -12.108 -19.683 -12.101 441 H THR 76 H THR 76 -10.498 -20.282 -7.880 442 HA THR 76 HA THR 76 -11.938 -21.943 -5.973 443 HB THR 76 HB THR 76 -9.494 -23.051 -5.671 444 HG1 THR 76 HG1 THR 76 -8.479 -23.305 -7.724 445 1HG2 THR 76 1HG2 THR 76 -11.290 -24.016 -7.936 446 2HG2 THR 76 2HG2 THR 76 -10.129 -24.977 -7.006 447 3HG2 THR 76 3HG2 THR 76 -11.579 -24.333 -6.211 448 HA PRO 77 HA PRO 77 -10.520 -18.820 -3.457 449 1HB PRO 77 1HB PRO 77 -9.956 -19.929 -0.984 450 2HB PRO 77 2HB PRO 77 -11.598 -19.785 -1.671 451 1HG PRO 77 1HG PRO 77 -9.755 -22.186 -1.780 452 2HG PRO 77 2HG PRO 77 -11.477 -22.148 -1.294 453 1HD PRO 77 1HD PRO 77 -10.761 -22.865 -3.795 454 2HD PRO 77 2HD PRO 77 -12.182 -21.814 -3.546 455 H THR 78 H THR 78 -8.615 -17.614 -3.539 456 HA THR 78 HA THR 78 -6.057 -18.932 -3.862 457 HB THR 78 HB THR 78 -6.186 -16.006 -3.416 458 HG1 THR 78 HG1 THR 78 -7.120 -16.528 -5.860 459 1HG2 THR 78 1HG2 THR 78 -5.295 -17.407 -5.939 460 2HG2 THR 78 2HG2 THR 78 -4.829 -15.826 -5.301 461 3HG2 THR 78 3HG2 THR 78 -4.234 -17.290 -4.522 462 H THR 79 H THR 79 -4.110 -17.856 -2.634 463 HA THR 79 HA THR 79 -4.745 -17.871 0.292 464 HB THR 79 HB THR 79 -2.898 -19.423 0.596 465 HG1 THR 79 HG1 THR 79 -1.683 -18.674 -1.205 466 1HG2 THR 79 1HG2 THR 79 -5.160 -20.389 -0.033 467 2HG2 THR 79 2HG2 THR 79 -4.584 -20.492 -1.716 468 3HG2 THR 79 3HG2 THR 79 -3.776 -21.428 -0.450 469 H GLY 80 H GLY 80 -4.581 -15.459 -0.041 470 1HA GLY 80 1HA GLY 80 -2.114 -14.307 -0.847 471 2HA GLY 80 2HA GLY 80 -3.401 -13.535 0.070 472 H GLN 81 H GLN 81 -0.512 -13.586 0.278 473 HA GLN 81 HA GLN 81 -0.259 -13.093 2.998 474 1HB GLN 81 1HB GLN 81 1.476 -14.842 3.672 475 2HB GLN 81 2HB GLN 81 -0.199 -15.351 3.593 476 1HG GLN 81 1HG GLN 81 1.041 -17.117 2.720 477 2HG GLN 81 2HG GLN 81 0.242 -16.404 1.331 478 1HE2 GLN 81 1HE2 GLN 81 1.666 -14.925 -0.064 479 2HE2 GLN 81 2HE2 GLN 81 3.372 -15.337 -0.149 480 H ALA 82 H ALA 82 0.216 -11.795 0.522 481 HA ALA 82 HA ALA 82 2.892 -12.230 -0.416 482 1HB ALA 82 1HB ALA 82 2.290 -10.197 -1.802 483 2HB ALA 82 2HB ALA 82 1.191 -11.608 -1.930 484 3HB ALA 82 3HB ALA 82 0.727 -10.186 -0.982 485 H THR 83 H THR 83 4.516 -10.526 -0.636 486 HA THR 83 HA THR 83 4.798 -9.115 1.922 487 HB THR 83 HB THR 83 6.628 -10.484 1.268 488 HG1 THR 83 HG1 THR 83 7.408 -7.776 1.121 489 1HG2 THR 83 1HG2 THR 83 7.139 -8.558 -1.042 490 2HG2 THR 83 2HG2 THR 83 8.146 -9.932 -0.559 491 3HG2 THR 83 3HG2 THR 83 6.535 -10.218 -1.242 492 H PHE 84 H PHE 84 4.645 -7.098 2.172 493 HA PHE 84 HA PHE 84 4.094 -5.162 -0.034 494 1HB PHE 84 1HB PHE 84 3.226 -3.847 2.045 495 2HB PHE 84 2HB PHE 84 2.225 -5.087 1.304 496 HD1 PHE 84 HD1 PHE 84 1.799 -7.262 2.411 497 HD2 PHE 84 HD2 PHE 84 4.235 -4.246 4.284 498 HE1 PHE 84 HE1 PHE 84 2.404 -8.848 4.173 499 HE2 PHE 84 HE2 PHE 84 5.040 -5.903 5.887 500 HZ PHE 84 HZ PHE 84 4.040 -8.199 5.937 501 H ASN 85 H ASN 85 6.320 -4.805 -0.591 502 HA ASN 85 HA ASN 85 8.246 -4.341 1.582 503 1HB ASN 85 1HB ASN 85 9.102 -5.389 -0.327 504 2HB ASN 85 2HB ASN 85 8.381 -4.197 -1.398 505 1HD2 ASN 85 1HD2 ASN 85 9.346 -2.059 -1.476 506 2HD2 ASN 85 2HD2 ASN 85 10.991 -1.747 -0.921 507 H VAL 86 H VAL 86 7.315 -2.733 2.733 508 HA VAL 86 HA VAL 86 6.390 -0.244 1.663 509 HB VAL 86 HB VAL 86 7.171 -0.798 4.560 510 1HG1 VAL 86 1HG1 VAL 86 5.359 0.774 5.029 511 2HG1 VAL 86 2HG1 VAL 86 6.533 1.514 3.930 512 3HG1 VAL 86 3HG1 VAL 86 4.992 0.903 3.294 513 1HG2 VAL 86 1HG2 VAL 86 5.846 -2.642 4.202 514 2HG2 VAL 86 2HG2 VAL 86 4.720 -1.452 4.829 515 3HG2 VAL 86 3HG2 VAL 86 4.732 -1.798 3.090 516 H THR 87 H THR 87 8.515 0.251 0.336 517 HA THR 87 HA THR 87 9.752 2.345 1.724 518 HB THR 87 HB THR 87 11.076 0.689 2.875 519 HG1 THR 87 HG1 THR 87 13.027 1.603 2.504 520 1HG2 THR 87 1HG2 THR 87 11.029 -1.074 1.228 521 2HG2 THR 87 2HG2 THR 87 12.171 -0.166 0.204 522 3HG2 THR 87 3HG2 THR 87 12.669 -0.734 1.808 523 HA PRO 88 HA PRO 88 11.079 3.284 -2.521 524 1HB PRO 88 1HB PRO 88 11.980 5.816 -2.110 525 2HB PRO 88 2HB PRO 88 10.247 5.498 -2.171 526 1HG PRO 88 1HG PRO 88 11.985 5.771 0.261 527 2HG PRO 88 2HG PRO 88 10.392 6.494 -0.035 528 1HD PRO 88 1HD PRO 88 10.874 4.158 1.405 529 2HD PRO 88 2HD PRO 88 9.305 4.469 0.595 530 H MET 89 H MET 89 12.488 1.476 -1.442 531 HA MET 89 HA MET 89 14.519 0.586 -0.886 532 1HB MET 89 1HB MET 89 16.196 1.196 -2.556 533 2HB MET 89 2HB MET 89 14.596 1.079 -3.281 534 1HG MET 89 1HG MET 89 14.334 3.434 -3.419 535 2HG MET 89 2HG MET 89 15.685 3.764 -2.348 536 1HE MET 89 1HE MET 89 18.091 1.998 -3.503 537 2HE MET 89 2HE MET 89 18.784 3.196 -4.613 538 3HE MET 89 3HE MET 89 18.182 3.709 -3.021 539 H ALA 90 H ALA 90 13.973 2.872 1.030 540 HA ALA 90 HA ALA 90 16.674 3.275 2.078 541 1HB ALA 90 1HB ALA 90 15.286 5.673 0.798 542 2HB ALA 90 2HB ALA 90 16.822 5.687 1.669 543 3HB ALA 90 3HB ALA 90 16.710 4.868 0.106 544 H ALA 91 H ALA 91 13.528 4.963 1.834 545 HA ALA 91 HA ALA 91 13.610 5.746 4.640 546 1HB ALA 91 1HB ALA 91 11.333 6.670 4.168 547 2HB ALA 91 2HB ALA 91 12.615 7.238 3.068 548 3HB ALA 91 3HB ALA 91 11.435 6.042 2.523 549 H GLY 92 H GLY 92 10.686 4.368 3.377 550 1HA GLY 92 1HA GLY 92 9.226 2.876 4.297 551 2HA GLY 92 2HA GLY 92 10.663 1.918 4.666 552 H ALA 93 H ALA 93 11.874 3.154 6.765 553 HA ALA 93 HA ALA 93 10.531 2.682 9.105 554 1HB ALA 93 1HB ALA 93 12.598 4.849 8.537 555 2HB ALA 93 2HB ALA 93 12.165 4.228 10.143 556 3HB ALA 93 3HB ALA 93 12.929 3.155 8.955 557 H TYR 94 H TYR 94 10.715 5.724 7.303 558 HA TYR 94 HA TYR 94 8.952 7.258 8.956 559 1HB TYR 94 1HB TYR 94 9.971 7.820 6.165 560 2HB TYR 94 2HB TYR 94 9.421 8.987 7.373 561 HD1 TYR 94 HD1 TYR 94 10.665 8.479 9.801 562 HD2 TYR 94 HD2 TYR 94 12.362 7.721 5.923 563 HE1 TYR 94 HE1 TYR 94 12.900 8.246 10.826 564 HE2 TYR 94 HE2 TYR 94 14.629 7.695 6.940 565 HH TYR 94 HH TYR 94 15.152 8.051 10.445 566 H PHE 95 H PHE 95 8.251 4.850 6.634 567 HA PHE 95 HA PHE 95 5.858 6.061 5.578 568 1HB PHE 95 1HB PHE 95 7.232 4.114 4.586 569 2HB PHE 95 2HB PHE 95 6.436 3.087 5.769 570 HD1 PHE 95 HD1 PHE 95 6.343 4.062 2.412 571 HD2 PHE 95 HD2 PHE 95 3.849 3.029 5.738 572 HE1 PHE 95 HE1 PHE 95 4.470 3.618 0.869 573 HE2 PHE 95 HE2 PHE 95 1.947 2.632 4.218 574 HZ PHE 95 HZ PHE 95 2.253 2.923 1.756 575 H ASN 96 H ASN 96 3.809 5.826 6.228 576 HA ASN 96 HA ASN 96 3.412 5.691 9.038 577 1HB ASN 96 1HB ASN 96 0.903 5.992 8.349 578 2HB ASN 96 2HB ASN 96 2.055 7.301 8.071 579 1HD2 ASN 96 1HD2 ASN 96 2.710 7.830 6.037 580 2HD2 ASN 96 2HD2 ASN 96 2.147 7.106 4.556 581 H LYS 97 H LYS 97 2.613 4.013 10.297 582 HA LYS 97 HA LYS 97 1.207 1.749 9.183 583 1HB LYS 97 1HB LYS 97 2.977 0.049 9.666 584 2HB LYS 97 2HB LYS 97 3.284 1.087 8.277 585 1HG LYS 97 1HG LYS 97 4.758 2.515 9.806 586 2HG LYS 97 2HG LYS 97 4.632 1.210 10.999 587 1HD LYS 97 1HD LYS 97 5.657 -0.375 9.516 588 2HD LYS 97 2HD LYS 97 5.602 0.730 8.139 589 1HE LYS 97 1HE LYS 97 7.143 1.328 10.706 590 2HE LYS 97 2HE LYS 97 7.880 0.511 9.322 591 1HZ LYS 97 1HZ LYS 97 8.086 3.060 9.503 592 2HZ LYS 97 2HZ LYS 97 7.749 2.424 8.037 593 3HZ LYS 97 3HZ LYS 97 6.566 3.111 8.928 594 H VAL 98 H VAL 98 3.328 2.782 11.873 595 HA VAL 98 HA VAL 98 3.284 2.369 14.048 596 HB VAL 98 HB VAL 98 1.999 4.220 14.118 597 1HG1 VAL 98 1HG1 VAL 98 -0.569 2.743 13.435 598 2HG1 VAL 98 2HG1 VAL 98 -0.424 4.421 13.951 599 3HG1 VAL 98 3HG1 VAL 98 0.302 3.920 12.428 600 1HG2 VAL 98 1HG2 VAL 98 2.035 2.850 16.220 601 2HG2 VAL 98 2HG2 VAL 98 0.750 4.066 16.108 602 3HG2 VAL 98 3HG2 VAL 98 0.361 2.363 15.849 603 H GLN 99 H GLN 99 -0.026 0.993 13.916 604 HA GLN 99 HA GLN 99 0.761 -1.677 13.680 605 1HB GLN 99 1HB GLN 99 0.226 -2.485 15.962 606 2HB GLN 99 2HB GLN 99 1.701 -1.526 15.942 607 1HG GLN 99 1HG GLN 99 0.637 0.347 16.983 608 2HG GLN 99 2HG GLN 99 -0.986 -0.280 16.664 609 1HE2 GLN 99 1HE2 GLN 99 1.941 -0.754 18.665 610 2HE2 GLN 99 2HE2 GLN 99 1.112 -1.713 19.881 611 H CYS 100 H CYS 100 -1.294 -3.041 14.504 612 HA CYS 100 HA CYS 100 -3.482 -3.505 14.146 613 1HB CYS 100 1HB CYS 100 -3.826 -0.770 15.460 614 2HB CYS 100 2HB CYS 100 -5.126 -1.937 15.170 615 HG CYS 100 HG CYS 100 -2.421 -2.304 17.004 616 H PHE 101 H PHE 101 -2.254 -2.733 11.833 617 HA PHE 101 HA PHE 101 -4.373 -1.241 10.347 618 1HB PHE 101 1HB PHE 101 -2.695 -0.940 8.594 619 2HB PHE 101 2HB PHE 101 -2.201 -0.192 10.103 620 HD1 PHE 101 HD1 PHE 101 -0.283 -1.016 11.366 621 HD2 PHE 101 HD2 PHE 101 -1.523 -2.976 7.733 622 HE1 PHE 101 HE1 PHE 101 1.862 -2.269 11.309 623 HE2 PHE 101 HE2 PHE 101 0.609 -4.236 7.687 624 HZ PHE 101 HZ PHE 101 2.303 -3.891 9.472 625 H CYS 102 H CYS 102 -4.810 -2.234 8.175 626 HA CYS 102 HA CYS 102 -4.383 -5.176 8.033 627 1HB CYS 102 1HB CYS 102 -7.032 -3.665 7.820 628 2HB CYS 102 2HB CYS 102 -6.772 -5.291 7.159 629 HG CYS 102 HG CYS 102 -8.098 -5.466 9.372 630 H PHE 103 H PHE 103 -4.016 -5.812 5.929 631 HA PHE 103 HA PHE 103 -4.821 -4.346 3.675 632 1HB PHE 103 1HB PHE 103 -2.917 -2.833 4.432 633 2HB PHE 103 2HB PHE 103 -1.818 -4.180 4.148 634 HD1 PHE 103 HD1 PHE 103 -4.508 -3.880 1.612 635 HD2 PHE 103 HD2 PHE 103 -0.635 -2.369 2.832 636 HE1 PHE 103 HE1 PHE 103 -4.178 -2.922 -0.606 637 HE2 PHE 103 HE2 PHE 103 -0.330 -1.405 0.569 638 HZ PHE 103 HZ PHE 103 -2.085 -1.699 -1.161 639 H THR 104 H THR 104 -2.404 -6.497 5.040 640 HA THR 104 HA THR 104 -1.713 -8.552 3.505 641 HB THR 104 HB THR 104 -2.517 -9.979 5.480 642 HG1 THR 104 HG1 THR 104 -4.291 -8.559 5.896 643 1HG2 THR 104 1HG2 THR 104 -0.271 -8.918 5.450 644 2HG2 THR 104 2HG2 THR 104 -0.949 -7.440 6.162 645 3HG2 THR 104 3HG2 THR 104 -0.971 -8.954 7.080 646 H GLU 105 H GLU 105 -2.726 -9.431 1.749 647 HA GLU 105 HA GLU 105 -5.474 -8.944 1.418 648 1HB GLU 105 1HB GLU 105 -5.139 -9.549 -0.806 649 2HB GLU 105 2HB GLU 105 -3.760 -8.592 -0.260 650 1HG GLU 105 1HG GLU 105 -3.808 -11.595 -0.734 651 2HG GLU 105 2HG GLU 105 -3.118 -10.385 -1.799 652 H THR 106 H THR 106 -3.953 -11.769 2.620 653 HA THR 106 HA THR 106 -4.789 -13.841 3.217 654 HB THR 106 HB THR 106 -5.809 -12.319 4.802 655 HG1 THR 106 HG1 THR 106 -6.195 -14.483 5.061 656 1HG2 THR 106 1HG2 THR 106 -7.284 -10.887 3.565 657 2HG2 THR 106 2HG2 THR 106 -8.238 -12.263 2.964 658 3HG2 THR 106 3HG2 THR 106 -8.255 -11.842 4.683 659 H THR 107 H THR 107 -7.699 -14.492 2.986 660 HA THR 107 HA THR 107 -7.467 -15.739 0.265 661 HB THR 107 HB THR 107 -8.198 -16.705 3.012 662 HG1 THR 107 HG1 THR 107 -6.779 -17.839 0.847 663 1HG2 THR 107 1HG2 THR 107 -9.129 -18.005 0.392 664 2HG2 THR 107 2HG2 THR 107 -9.100 -18.818 1.970 665 3HG2 THR 107 3HG2 THR 107 -10.176 -17.439 1.716 666 H LEU 108 H LEU 108 -9.166 -15.659 -1.069 667 HA LEU 108 HA LEU 108 -11.770 -14.547 -0.143 668 1HB LEU 108 1HB LEU 108 -10.355 -13.899 -2.764 669 2HB LEU 108 2HB LEU 108 -11.977 -13.398 -2.337 670 HG LEU 108 HG LEU 108 -9.494 -12.527 -0.832 671 1HD1 LEU 108 1HD1 LEU 108 -9.599 -11.752 -3.238 672 2HD1 LEU 108 2HD1 LEU 108 -11.121 -10.939 -2.855 673 3HD1 LEU 108 3HD1 LEU 108 -9.603 -10.457 -2.046 674 1HD2 LEU 108 1HD2 LEU 108 -10.942 -10.820 0.155 675 2HD2 LEU 108 2HD2 LEU 108 -12.345 -11.478 -0.721 676 3HD2 LEU 108 3HD2 LEU 108 -11.538 -12.431 0.544 677 H GLU 109 H GLU 109 -13.521 -15.499 -1.191 678 HA GLU 109 HA GLU 109 -13.038 -18.053 -2.460 679 1HB GLU 109 1HB GLU 109 -15.581 -16.490 -1.807 680 2HB GLU 109 2HB GLU 109 -15.582 -18.093 -2.504 681 1HG GLU 109 1HG GLU 109 -14.095 -18.842 -0.555 682 2HG GLU 109 2HG GLU 109 -14.457 -17.279 0.197 683 HA PRO 110 HA PRO 110 -12.687 -16.860 -6.613 684 1HB PRO 110 1HB PRO 110 -13.983 -18.793 -8.014 685 2HB PRO 110 2HB PRO 110 -12.517 -19.038 -7.025 686 1HG PRO 110 1HG PRO 110 -15.397 -19.515 -6.186 687 2HG PRO 110 2HG PRO 110 -14.053 -20.694 -6.113 688 1HD PRO 110 1HD PRO 110 -14.696 -19.189 -3.958 689 2HD PRO 110 2HD PRO 110 -12.982 -19.462 -4.357 690 H GLY 111 H GLY 111 -13.783 -14.871 -6.337 691 1HA GLY 111 1HA GLY 111 -15.492 -14.007 -8.265 692 2HA GLY 111 2HA GLY 111 -16.614 -14.634 -7.038 693 H GLU 112 H GLU 112 -14.620 -13.896 -4.808 694 HA GLU 112 HA GLU 112 -16.292 -11.704 -4.340 695 1HB GLU 112 1HB GLU 112 -14.019 -12.653 -2.587 696 2HB GLU 112 2HB GLU 112 -15.488 -11.800 -2.112 697 1HG GLU 112 1HG GLU 112 -15.315 -14.643 -3.021 698 2HG GLU 112 2HG GLU 112 -15.934 -13.970 -1.513 699 H GLU 113 H GLU 113 -15.953 -9.563 -3.918 700 HA GLU 113 HA GLU 113 -13.549 -8.372 -5.172 701 1HB GLU 113 1HB GLU 113 -15.721 -7.971 -6.270 702 2HB GLU 113 2HB GLU 113 -16.271 -7.104 -4.817 703 1HG GLU 113 1HG GLU 113 -14.968 -5.388 -5.102 704 2HG GLU 113 2HG GLU 113 -13.712 -6.251 -6.004 705 H MET 114 H MET 114 -12.098 -8.157 -3.585 706 HA MET 114 HA MET 114 -12.801 -7.270 -0.888 707 1HB MET 114 1HB MET 114 -11.275 -9.091 -1.341 708 2HB MET 114 2HB MET 114 -10.194 -8.058 -2.257 709 1HG MET 114 1HG MET 114 -9.361 -8.403 -0.013 710 2HG MET 114 2HG MET 114 -9.776 -6.699 -0.199 711 1HE MET 114 1HE MET 114 -9.604 -6.339 2.400 712 2HE MET 114 2HE MET 114 -10.410 -7.378 3.599 713 3HE MET 114 3HE MET 114 -9.118 -8.046 2.570 714 H GLU 115 H GLU 115 -13.567 -5.120 -1.308 715 HA GLU 115 HA GLU 115 -11.504 -3.171 -2.198 716 1HB GLU 115 1HB GLU 115 -13.732 -3.067 -3.265 717 2HB GLU 115 2HB GLU 115 -14.465 -2.694 -1.702 718 1HG GLU 115 1HG GLU 115 -13.454 -0.556 -1.601 719 2HG GLU 115 2HG GLU 115 -12.142 -1.013 -2.699 720 H MET 116 H MET 116 -10.520 -1.817 -0.744 721 HA MET 116 HA MET 116 -11.721 -1.453 1.897 722 1HB MET 116 1HB MET 116 -9.888 -2.241 3.193 723 2HB MET 116 2HB MET 116 -10.494 -3.553 2.167 724 1HG MET 116 1HG MET 116 -8.693 -2.931 0.503 725 2HG MET 116 2HG MET 116 -8.025 -1.852 1.733 726 1HE MET 116 1HE MET 116 -7.127 -2.749 4.133 727 2HE MET 116 2HE MET 116 -8.605 -3.718 4.384 728 3HE MET 116 3HE MET 116 -7.016 -4.482 4.532 729 HA PRO 117 HA PRO 117 -9.481 2.453 1.412 730 1HB PRO 117 1HB PRO 117 -9.915 3.642 3.737 731 2HB PRO 117 2HB PRO 117 -11.233 3.328 2.572 732 1HG PRO 117 1HG PRO 117 -10.504 1.668 4.998 733 2HG PRO 117 2HG PRO 117 -12.097 2.285 4.458 734 1HD PRO 117 1HD PRO 117 -11.182 -0.275 3.911 735 2HD PRO 117 2HD PRO 117 -12.318 0.611 2.848 736 H VAL 118 H VAL 118 -7.416 3.163 1.830 737 HA VAL 118 HA VAL 118 -6.020 2.238 4.285 738 HB VAL 118 HB VAL 118 -4.926 2.394 1.456 739 1HG1 VAL 118 1HG1 VAL 118 -3.333 3.629 2.795 740 2HG1 VAL 118 2HG1 VAL 118 -3.367 2.382 4.066 741 3HG1 VAL 118 3HG1 VAL 118 -2.682 2.025 2.465 742 1HG2 VAL 118 1HG2 VAL 118 -5.864 0.225 2.155 743 2HG2 VAL 118 2HG2 VAL 118 -4.101 0.121 2.023 744 3HG2 VAL 118 3HG2 VAL 118 -4.860 0.246 3.619 745 H VAL 119 H VAL 119 -5.898 3.950 5.539 746 HA VAL 119 HA VAL 119 -5.841 6.688 4.472 747 HB VAL 119 HB VAL 119 -7.186 6.258 6.435 748 1HG1 VAL 119 1HG1 VAL 119 -5.921 4.385 7.478 749 2HG1 VAL 119 2HG1 VAL 119 -4.614 5.514 7.898 750 3HG1 VAL 119 3HG1 VAL 119 -6.232 5.704 8.601 751 1HG2 VAL 119 1HG2 VAL 119 -4.752 7.945 7.149 752 2HG2 VAL 119 2HG2 VAL 119 -6.114 8.476 6.135 753 3HG2 VAL 119 3HG2 VAL 119 -6.378 8.069 7.840 754 H PHE 120 H PHE 120 -3.951 7.991 4.560 755 HA PHE 120 HA PHE 120 -1.369 6.691 5.159 756 1HB PHE 120 1HB PHE 120 -2.068 5.790 2.975 757 2HB PHE 120 2HB PHE 120 -2.464 7.405 2.407 758 HD1 PHE 120 HD1 PHE 120 -0.730 9.015 1.822 759 HD2 PHE 120 HD2 PHE 120 0.312 5.082 3.246 760 HE1 PHE 120 HE1 PHE 120 1.624 9.474 1.360 761 HE2 PHE 120 HE2 PHE 120 2.704 5.576 2.792 762 HZ PHE 120 HZ PHE 120 3.374 7.730 1.838 763 H PHE 121 H PHE 121 0.369 8.189 5.222 764 HA PHE 121 HA PHE 121 0.217 10.867 4.272 765 1HB PHE 121 1HB PHE 121 0.275 12.038 6.359 766 2HB PHE 121 2HB PHE 121 -1.256 11.234 6.130 767 HD1 PHE 121 HD1 PHE 121 1.459 11.711 8.349 768 HD2 PHE 121 HD2 PHE 121 -1.694 9.004 7.318 769 HE1 PHE 121 HE1 PHE 121 1.698 10.596 10.576 770 HE2 PHE 121 HE2 PHE 121 -1.234 7.667 9.368 771 HZ PHE 121 HZ PHE 121 0.420 8.502 11.035 772 H VAL 122 H VAL 122 2.371 11.258 3.719 773 HA VAL 122 HA VAL 122 4.537 9.730 4.843 774 HB VAL 122 HB VAL 122 4.579 12.355 3.323 775 1HG1 VAL 122 1HG1 VAL 122 6.791 10.326 3.881 776 2HG1 VAL 122 2HG1 VAL 122 6.921 11.662 2.722 777 3HG1 VAL 122 3HG1 VAL 122 6.733 12.011 4.441 778 1HG2 VAL 122 1HG2 VAL 122 3.506 10.670 1.972 779 2HG2 VAL 122 2HG2 VAL 122 5.152 10.858 1.370 780 3HG2 VAL 122 3HG2 VAL 122 4.754 9.469 2.388 781 H ASP 123 H ASP 123 5.831 10.154 6.599 782 HA ASP 123 HA ASP 123 4.984 12.297 8.392 783 1HB ASP 123 1HB ASP 123 5.035 10.179 9.252 784 2HB ASP 123 2HB ASP 123 6.649 9.817 8.679 785 HA PRO 124 HA PRO 124 8.331 15.033 7.106 786 1HB PRO 124 1HB PRO 124 8.354 15.711 10.045 787 2HB PRO 124 2HB PRO 124 8.378 16.822 8.645 788 1HG PRO 124 1HG PRO 124 6.079 16.371 10.033 789 2HG PRO 124 2HG PRO 124 6.019 16.452 8.260 790 1HD PRO 124 1HD PRO 124 5.977 14.027 10.004 791 2HD PRO 124 2HD PRO 124 5.080 14.401 8.506 792 H GLU 125 H GLU 125 8.754 12.809 9.878 793 HA GLU 125 HA GLU 125 11.409 13.118 10.473 794 1HB GLU 125 1HB GLU 125 9.644 11.787 11.596 795 2HB GLU 125 2HB GLU 125 9.815 10.522 10.366 796 1HG GLU 125 1HG GLU 125 12.272 10.451 11.148 797 2HG GLU 125 2HG GLU 125 11.759 11.586 12.406 798 H ILE 126 H ILE 126 10.064 11.683 7.455 799 HA ILE 126 HA ILE 126 12.381 10.384 6.641 800 HB ILE 126 HB ILE 126 10.264 10.407 5.430 801 1HG1 ILE 126 1HG1 ILE 126 12.487 11.287 3.543 802 2HG1 ILE 126 2HG1 ILE 126 12.639 9.822 4.523 803 1HG2 ILE 126 1HG2 ILE 126 9.840 12.904 5.494 804 2HG2 ILE 126 2HG2 ILE 126 11.099 13.101 4.264 805 3HG2 ILE 126 3HG2 ILE 126 9.641 12.169 3.897 806 1HD1 ILE 126 1HD1 ILE 126 11.760 9.185 2.409 807 2HD1 ILE 126 2HD1 ILE 126 10.521 8.976 3.672 808 3HD1 ILE 126 3HD1 ILE 126 10.418 10.356 2.553 809 H VAL 127 H VAL 127 11.895 13.926 6.676 810 HA VAL 127 HA VAL 127 14.667 14.249 5.614 811 HB VAL 127 HB VAL 127 14.218 16.683 5.825 812 1HG1 VAL 127 1HG1 VAL 127 12.389 15.087 3.991 813 2HG1 VAL 127 2HG1 VAL 127 12.859 16.783 3.777 814 3HG1 VAL 127 3HG1 VAL 127 14.084 15.510 3.683 815 1HG2 VAL 127 1HG2 VAL 127 12.001 17.549 6.009 816 2HG2 VAL 127 2HG2 VAL 127 11.281 15.937 6.055 817 3HG2 VAL 127 3HG2 VAL 127 12.245 16.528 7.433 818 H LYS 128 H LYS 128 14.969 12.762 7.626 819 HA LYS 128 HA LYS 128 16.208 14.620 9.615 820 1HB LYS 128 1HB LYS 128 14.970 11.926 10.171 821 2HB LYS 128 2HB LYS 128 16.378 12.501 11.096 822 1HG LYS 128 1HG LYS 128 15.094 14.635 11.544 823 2HG LYS 128 2HG LYS 128 13.695 13.865 10.763 824 1HD LYS 128 1HD LYS 128 13.947 11.945 12.400 825 2HD LYS 128 2HD LYS 128 15.212 12.831 13.237 826 1HE LYS 128 1HE LYS 128 12.350 13.850 12.840 827 2HE LYS 128 2HE LYS 128 12.902 12.995 14.286 828 1HZ LYS 128 1HZ LYS 128 12.911 15.405 14.494 829 2HZ LYS 128 2HZ LYS 128 14.391 14.759 14.766 830 3HZ LYS 128 3HZ LYS 128 14.069 15.527 13.337 831 HA PRO 129 HA PRO 129 19.855 12.032 8.729 832 1HB PRO 129 1HB PRO 129 19.914 9.535 7.626 833 2HB PRO 129 2HB PRO 129 19.441 9.826 9.323 834 1HG PRO 129 1HG PRO 129 17.639 9.541 6.926 835 2HG PRO 129 2HG PRO 129 17.517 8.648 8.460 836 1HD PRO 129 1HD PRO 129 15.995 10.852 8.038 837 2HD PRO 129 2HD PRO 129 16.722 10.530 9.636 838 H VAL 130 H VAL 130 21.412 11.864 6.950 839 HA VAL 130 HA VAL 130 20.716 13.677 4.943 840 HB VAL 130 HB VAL 130 22.998 13.298 4.201 841 1HG1 VAL 130 1HG1 VAL 130 22.490 14.854 6.048 842 2HG1 VAL 130 2HG1 VAL 130 22.781 13.557 7.224 843 3HG1 VAL 130 3HG1 VAL 130 24.103 14.142 6.201 844 1HG2 VAL 130 1HG2 VAL 130 24.555 11.847 5.405 845 2HG2 VAL 130 2HG2 VAL 130 23.234 11.154 6.351 846 3HG2 VAL 130 3HG2 VAL 130 23.315 10.891 4.598 847 H GLU 131 H GLU 131 21.019 10.118 4.882 848 HA GLU 131 HA GLU 131 20.925 9.709 2.084 849 1HB GLU 131 1HB GLU 131 19.853 7.937 4.310 850 2HB GLU 131 2HB GLU 131 20.259 7.490 2.643 851 1HG GLU 131 1HG GLU 131 22.261 6.979 3.509 852 2HG GLU 131 2HG GLU 131 22.620 8.686 3.391 853 H THR 132 H THR 132 18.227 9.457 4.484 854 HA THR 132 HA THR 132 16.411 9.272 2.280 855 HB THR 132 HB THR 132 14.645 9.028 3.897 856 HG1 THR 132 HG1 THR 132 15.237 10.473 5.524 857 1HG2 THR 132 1HG2 THR 132 17.151 7.538 4.810 858 2HG2 THR 132 2HG2 THR 132 15.478 7.013 4.999 859 3HG2 THR 132 3HG2 THR 132 16.177 7.123 3.383 860 H GLN 133 H GLN 133 17.695 11.998 4.005 861 HA GLN 133 HA GLN 133 15.914 14.026 3.396 862 1HB GLN 133 1HB GLN 133 18.708 13.889 3.903 863 2HB GLN 133 2HB GLN 133 18.607 14.572 2.311 864 1HG GLN 133 1HG GLN 133 18.577 16.435 3.669 865 2HG GLN 133 2HG GLN 133 16.881 16.240 3.232 866 1HE2 GLN 133 1HE2 GLN 133 17.719 13.821 5.616 867 2HE2 GLN 133 2HE2 GLN 133 17.443 14.806 7.020 868 H GLY 134 H GLY 134 17.909 12.116 1.103 869 1HA GLY 134 1HA GLY 134 17.329 13.669 -1.242 870 2HA GLY 134 2HA GLY 134 17.926 12.003 -1.173 871 H ILE 135 H ILE 135 15.492 11.207 0.524 872 HA ILE 135 HA ILE 135 13.794 10.510 -1.809 873 HB ILE 135 HB ILE 135 13.850 9.542 1.062 874 1HG1 ILE 135 1HG1 ILE 135 15.740 8.617 -0.051 875 2HG1 ILE 135 2HG1 ILE 135 14.465 7.394 -0.142 876 1HG2 ILE 135 1HG2 ILE 135 12.119 8.539 -1.246 877 2HG2 ILE 135 2HG2 ILE 135 12.236 7.907 0.410 878 3HG2 ILE 135 3HG2 ILE 135 11.530 9.482 0.130 879 1HD1 ILE 135 1HD1 ILE 135 15.419 9.231 -2.366 880 2HD1 ILE 135 2HD1 ILE 135 15.497 7.456 -2.283 881 3HD1 ILE 135 3HD1 ILE 135 13.930 8.276 -2.481 882 H LYS 136 H LYS 136 12.167 11.590 -2.339 883 HA LYS 136 HA LYS 136 10.188 11.813 -0.268 884 1HB LYS 136 1HB LYS 136 9.377 14.004 -1.044 885 2HB LYS 136 2HB LYS 136 10.733 13.982 0.090 886 1HG LYS 136 1HG LYS 136 12.298 14.606 -1.559 887 2HG LYS 136 2HG LYS 136 11.198 14.214 -2.898 888 1HD LYS 136 1HD LYS 136 9.561 15.875 -2.176 889 2HD LYS 136 2HD LYS 136 10.463 16.206 -0.693 890 1HE LYS 136 1HE LYS 136 12.208 17.365 -1.932 891 2HE LYS 136 2HE LYS 136 11.474 16.913 -3.483 892 1HZ LYS 136 1HZ LYS 136 9.568 18.269 -2.932 893 2HZ LYS 136 2HZ LYS 136 10.099 18.629 -1.462 894 3HZ LYS 136 3HZ LYS 136 10.912 19.192 -2.762 895 H THR 137 H THR 137 10.116 9.810 -1.816 896 HA THR 137 HA THR 137 7.632 10.395 -2.939 897 HB THR 137 HB THR 137 9.417 8.869 -4.877 898 HG1 THR 137 HG1 THR 137 8.942 11.609 -4.631 899 1HG2 THR 137 1HG2 THR 137 7.491 9.301 -6.379 900 2HG2 THR 137 2HG2 THR 137 7.090 8.303 -4.959 901 3HG2 THR 137 3HG2 THR 137 6.643 10.021 -4.982 902 H LEU 138 H LEU 138 6.832 9.158 -1.331 903 HA LEU 138 HA LEU 138 8.243 6.727 -0.545 904 1HB LEU 138 1HB LEU 138 6.554 8.563 0.718 905 2HB LEU 138 2HB LEU 138 5.523 7.135 0.530 906 HG LEU 138 HG LEU 138 7.522 5.881 1.499 907 1HD1 LEU 138 1HD1 LEU 138 9.134 6.933 2.844 908 2HD1 LEU 138 2HD1 LEU 138 9.199 7.759 1.271 909 3HD1 LEU 138 3HD1 LEU 138 8.384 8.539 2.628 910 1HD2 LEU 138 1HD2 LEU 138 6.221 7.932 3.398 911 2HD2 LEU 138 2HD2 LEU 138 5.423 6.447 2.889 912 3HD2 LEU 138 3HD2 LEU 138 6.928 6.381 3.824 913 H THR 139 H THR 139 7.553 4.533 -0.819 914 HA THR 139 HA THR 139 5.267 4.104 -2.528 915 HB THR 139 HB THR 139 7.159 4.339 -4.126 916 HG1 THR 139 HG1 THR 139 5.709 2.859 -4.799 917 1HG2 THR 139 1HG2 THR 139 8.355 1.953 -2.671 918 2HG2 THR 139 2HG2 THR 139 8.999 2.775 -4.109 919 3HG2 THR 139 3HG2 THR 139 8.911 3.643 -2.555 920 H LEU 140 H LEU 140 5.214 1.617 -2.829 921 HA LEU 140 HA LEU 140 6.021 0.029 -0.555 922 1HB LEU 140 1HB LEU 140 4.016 1.165 0.321 923 2HB LEU 140 2HB LEU 140 3.061 0.634 -1.067 924 HG LEU 140 HG LEU 140 4.389 -1.339 0.839 925 1HD1 LEU 140 1HD1 LEU 140 2.202 -1.416 2.041 926 2HD1 LEU 140 2HD1 LEU 140 2.987 0.160 2.188 927 3HD1 LEU 140 3HD1 LEU 140 1.636 -0.047 1.058 928 1HD2 LEU 140 1HD2 LEU 140 2.369 -2.739 0.105 929 2HD2 LEU 140 2HD2 LEU 140 2.076 -1.519 -1.141 930 3HD2 LEU 140 3HD2 LEU 140 3.585 -2.462 -1.132 931 H SER 141 H SER 141 6.822 -1.620 -1.874 932 HA SER 141 HA SER 141 5.520 -2.268 -4.438 933 1HB SER 141 1HB SER 141 7.710 -3.836 -4.306 934 2HB SER 141 2HB SER 141 7.658 -2.191 -4.951 935 HG SER 141 HG SER 141 9.329 -2.355 -3.487 936 H TYR 142 H TYR 142 3.675 -3.312 -3.917 937 HA TYR 142 HA TYR 142 3.703 -5.582 -2.067 938 1HB TYR 142 1HB TYR 142 1.848 -3.670 -2.497 939 2HB TYR 142 2HB TYR 142 1.249 -4.867 -3.632 940 HD1 TYR 142 HD1 TYR 142 -0.216 -3.780 -1.262 941 HD2 TYR 142 HD2 TYR 142 2.185 -7.330 -1.758 942 HE1 TYR 142 HE1 TYR 142 -1.514 -4.939 0.512 943 HE2 TYR 142 HE2 TYR 142 1.027 -8.362 0.160 944 HH TYR 142 HH TYR 142 -1.107 -8.329 1.160 945 H THR 143 H THR 143 4.469 -7.454 -2.879 946 HA THR 143 HA THR 143 4.057 -8.083 -5.784 947 HB THR 143 HB THR 143 5.894 -9.912 -4.839 948 HG1 THR 143 HG1 THR 143 6.412 -7.490 -3.439 949 1HG2 THR 143 1HG2 THR 143 6.191 -8.534 -6.816 950 2HG2 THR 143 2HG2 THR 143 6.541 -7.109 -5.803 951 3HG2 THR 143 3HG2 THR 143 7.648 -8.502 -5.803 952 H PHE 144 H PHE 144 1.987 -8.710 -5.703 953 HA PHE 144 HA PHE 144 1.096 -10.819 -3.954 954 1HB PHE 144 1HB PHE 144 0.050 -9.800 -6.587 955 2HB PHE 144 2HB PHE 144 -0.810 -10.789 -5.459 956 HD1 PHE 144 HD1 PHE 144 -0.752 -9.728 -2.883 957 HD2 PHE 144 HD2 PHE 144 -0.831 -7.612 -6.643 958 HE1 PHE 144 HE1 PHE 144 -1.698 -7.741 -1.769 959 HE2 PHE 144 HE2 PHE 144 -1.868 -5.683 -5.504 960 HZ PHE 144 HZ PHE 144 -2.005 -5.627 -3.025 961 H TYR 145 H TYR 145 2.846 -12.333 -4.214 962 HA TYR 145 HA TYR 145 2.501 -14.100 -6.605 963 1HB TYR 145 1HB TYR 145 4.756 -14.361 -6.890 964 2HB TYR 145 2HB TYR 145 4.530 -12.632 -6.670 965 HD1 TYR 145 HD1 TYR 145 4.424 -13.066 -3.385 966 HD2 TYR 145 HD2 TYR 145 7.129 -14.089 -6.597 967 HE1 TYR 145 HE1 TYR 145 6.297 -13.018 -1.818 968 HE2 TYR 145 HE2 TYR 145 9.010 -14.085 -4.985 969 HH TYR 145 HH TYR 145 8.557 -13.358 -1.517 970 HA PRO 146 HA PRO 146 2.496 -16.875 -2.829 971 1HB PRO 146 1HB PRO 146 -0.075 -17.271 -2.150 972 2HB PRO 146 2HB PRO 146 0.791 -15.802 -1.683 973 1HG PRO 146 1HG PRO 146 -1.038 -16.057 -4.086 974 2HG PRO 146 2HG PRO 146 -1.080 -14.852 -2.779 975 1HD PRO 146 1HD PRO 146 0.244 -14.381 -5.137 976 2HD PRO 146 2HD PRO 146 0.854 -13.787 -3.555 977 H ARG 147 H ARG 147 -0.621 -17.968 -3.961 978 HA ARG 147 HA ARG 147 0.590 -20.002 -5.733 979 1HB ARG 147 1HB ARG 147 -1.181 -20.674 -3.352 980 2HB ARG 147 2HB ARG 147 -0.412 -21.780 -4.492 981 1HG ARG 147 1HG ARG 147 1.850 -20.860 -3.634 982 2HG ARG 147 2HG ARG 147 0.920 -20.015 -2.384 983 1HD ARG 147 1HD ARG 147 1.733 -22.062 -1.444 984 2HD ARG 147 2HD ARG 147 -0.033 -22.188 -1.641 985 HE ARG 147 HE ARG 147 1.279 -23.207 -3.970 986 1HH1 ARG 147 1HH1 ARG 147 0.777 -24.042 -0.593 987 2HH1 ARG 147 2HH1 ARG 147 0.909 -25.760 -0.810 988 1HH2 ARG 147 1HH2 ARG 147 1.452 -25.489 -4.329 989 2HH2 ARG 147 2HH2 ARG 147 1.308 -26.598 -3.007 990 H GLU 148 H GLU 148 -0.642 -20.154 -7.464 991 HA GLU 148 HA GLU 148 -3.231 -18.814 -7.656 992 1HB GLU 148 1HB GLU 148 -1.204 -18.671 -9.199 993 2HB GLU 148 2HB GLU 148 -1.641 -20.281 -9.787 994 1HG GLU 148 1HG GLU 148 -3.262 -17.708 -9.996 995 2HG GLU 148 2HG GLU 148 -2.398 -18.524 -11.298 996 HA PRO 149 HA PRO 149 -4.723 -23.062 -6.824 997 1HB PRO 149 1HB PRO 149 -7.207 -22.587 -5.972 998 2HB PRO 149 2HB PRO 149 -5.826 -21.921 -5.066 999 1HG PRO 149 1HG PRO 149 -7.404 -20.481 -7.238 1000 2HG PRO 149 2HG PRO 149 -7.186 -19.942 -5.555 1001 1HD PRO 149 1HD PRO 149 -5.504 -19.083 -7.472 1002 2HD PRO 149 2HD PRO 149 -4.845 -19.596 -5.886 1003 H SER 150 H SER 150 -5.686 -21.031 -9.412 1004 HA SER 150 HA SER 150 -5.828 -22.273 -11.493 1005 1HB SER 150 1HB SER 150 -6.846 -24.337 -10.652 1006 2HB SER 150 2HB SER 150 -8.365 -23.456 -10.318 1007 HG SER 150 HG SER 150 -8.313 -24.573 -12.347 1008 H LYS 151 H LYS 151 -5.954 -20.223 -12.275 1009 HA LYS 151 HA LYS 151 -8.650 -18.918 -12.437 1010 1HB LYS 151 1HB LYS 151 -7.535 -16.968 -13.216 1011 2HB LYS 151 2HB LYS 151 -6.886 -17.512 -11.680 1012 1HG LYS 151 1HG LYS 151 -4.804 -17.567 -12.499 1013 2HG LYS 151 2HG LYS 151 -5.270 -18.720 -13.735 1014 1HD LYS 151 1HD LYS 151 -6.120 -16.795 -15.136 1015 2HD LYS 151 2HD LYS 151 -5.473 -15.681 -13.913 1016 1HE LYS 151 1HE LYS 151 -3.192 -16.599 -14.274 1017 2HE LYS 151 2HE LYS 151 -3.835 -17.794 -15.414 1018 1HZ LYS 151 1HZ LYS 151 -2.879 -15.938 -16.554 1019 2HZ LYS 151 2HZ LYS 151 -4.494 -16.007 -16.853 1020 3HZ LYS 151 3HZ LYS 151 -3.896 -14.878 -15.813 Start of MODEL 30 1 H VAL 21 H VAL 21 -1.872 10.566 14.625 2 HA VAL 21 HA VAL 21 -3.242 8.466 16.250 3 HB VAL 21 HB VAL 21 -2.535 10.475 17.309 4 1HG1 VAL 21 1HG1 VAL 21 -3.551 12.640 17.041 5 2HG1 VAL 21 2HG1 VAL 21 -2.883 12.154 15.480 6 3HG1 VAL 21 3HG1 VAL 21 -4.632 12.056 15.776 7 1HG2 VAL 21 1HG2 VAL 21 -4.547 10.924 18.599 8 2HG2 VAL 21 2HG2 VAL 21 -5.569 10.241 17.323 9 3HG2 VAL 21 3HG2 VAL 21 -4.436 9.199 18.208 10 H GLU 22 H GLU 22 -3.471 7.773 13.912 11 HA GLU 22 HA GLU 22 -3.954 8.142 11.780 12 1HB GLU 22 1HB GLU 22 -5.622 6.443 12.648 13 2HB GLU 22 2HB GLU 22 -6.862 7.704 12.504 14 1HG GLU 22 1HG GLU 22 -6.474 7.871 10.101 15 2HG GLU 22 2HG GLU 22 -4.985 6.926 10.209 16 H GLN 23 H GLN 23 -3.334 10.448 12.639 17 HA GLN 23 HA GLN 23 -4.460 12.232 10.805 18 1HB GLN 23 1HB GLN 23 -5.371 12.439 13.632 19 2HB GLN 23 2HB GLN 23 -4.471 13.833 13.154 20 1HG GLN 23 1HG GLN 23 -6.645 12.912 11.263 21 2HG GLN 23 2HG GLN 23 -7.038 13.825 12.728 22 1HE2 GLN 23 1HE2 GLN 23 -4.830 14.001 9.791 23 2HE2 GLN 23 2HE2 GLN 23 -4.395 15.650 10.156 24 H ALA 24 H ALA 24 -3.012 13.936 10.607 25 HA ALA 24 HA ALA 24 -0.792 14.176 12.551 26 1HB ALA 24 1HB ALA 24 0.670 14.801 10.743 27 2HB ALA 24 2HB ALA 24 -0.108 13.282 10.201 28 3HB ALA 24 3HB ALA 24 -0.693 14.850 9.614 29 H SER 25 H SER 25 -1.178 16.124 13.557 30 HA SER 25 HA SER 25 -2.132 18.437 12.016 31 1HB SER 25 1HB SER 25 -4.185 17.221 12.983 32 2HB SER 25 2HB SER 25 -3.604 17.726 14.584 33 HG SER 25 HG SER 25 -5.098 19.202 13.564 34 H ASP 26 H ASP 26 0.253 18.012 12.637 35 HA ASP 26 HA ASP 26 1.166 19.944 14.640 36 1HB ASP 26 1HB ASP 26 0.999 18.130 16.173 37 2HB ASP 26 2HB ASP 26 1.433 16.921 14.960 38 H LEU 27 H LEU 27 2.083 17.085 12.899 39 HA LEU 27 HA LEU 27 4.615 17.833 11.924 40 1HB LEU 27 1HB LEU 27 2.617 15.846 10.788 41 2HB LEU 27 2HB LEU 27 4.343 15.823 10.510 42 HG LEU 27 HG LEU 27 3.034 15.381 13.246 43 1HD1 LEU 27 1HD1 LEU 27 4.167 13.439 11.227 44 2HD1 LEU 27 2HD1 LEU 27 3.683 13.036 12.889 45 3HD1 LEU 27 3HD1 LEU 27 2.474 13.585 11.721 46 1HD2 LEU 27 1HD2 LEU 27 5.274 14.578 13.909 47 2HD2 LEU 27 2HD2 LEU 27 5.931 15.095 12.349 48 3HD2 LEU 27 3HD2 LEU 27 5.295 16.293 13.493 49 H ILE 28 H ILE 28 1.518 18.853 10.744 50 HA ILE 28 HA ILE 28 2.213 18.852 7.938 51 HB ILE 28 HB ILE 28 -0.127 20.104 9.430 52 1HG1 ILE 28 1HG1 ILE 28 0.564 17.383 8.273 53 2HG1 ILE 28 2HG1 ILE 28 -0.127 17.793 9.843 54 1HG2 ILE 28 1HG2 ILE 28 -1.247 20.156 7.328 55 2HG2 ILE 28 2HG2 ILE 28 0.293 20.971 7.037 56 3HG2 ILE 28 3HG2 ILE 28 0.077 19.276 6.535 57 1HD1 ILE 28 1HD1 ILE 28 -1.686 17.917 7.246 58 2HD1 ILE 28 2HD1 ILE 28 -1.811 16.692 8.500 59 3HD1 ILE 28 3HD1 ILE 28 -2.283 18.362 8.866 60 H LEU 29 H LEU 29 4.245 19.898 8.218 61 HA LEU 29 HA LEU 29 4.219 22.855 8.315 62 1HB LEU 29 1HB LEU 29 6.440 20.862 7.821 63 2HB LEU 29 2HB LEU 29 6.619 22.613 7.735 64 HG LEU 29 HG LEU 29 7.435 21.898 9.756 65 1HD1 LEU 29 1HD1 LEU 29 6.181 24.024 9.628 66 2HD1 LEU 29 2HD1 LEU 29 4.798 23.210 10.415 67 3HD1 LEU 29 3HD1 LEU 29 6.347 23.352 11.267 68 1HD2 LEU 29 1HD2 LEU 29 6.261 20.782 11.552 69 2HD2 LEU 29 2HD2 LEU 29 4.777 20.691 10.615 70 3HD2 LEU 29 3HD2 LEU 29 6.225 19.770 10.105 71 H ASP 30 H ASP 30 6.326 22.133 5.819 72 HA ASP 30 HA ASP 30 4.422 23.381 3.967 73 1HB ASP 30 1HB ASP 30 6.479 24.263 2.971 74 2HB ASP 30 2HB ASP 30 6.359 24.670 4.688 75 H GLU 31 H GLU 31 7.103 21.027 3.975 76 HA GLU 31 HA GLU 31 7.318 20.389 1.395 77 1HB GLU 31 1HB GLU 31 7.400 18.476 3.736 78 2HB GLU 31 2HB GLU 31 7.881 17.969 2.127 79 1HG GLU 31 1HG GLU 31 9.166 20.485 3.177 80 2HG GLU 31 2HG GLU 31 9.613 18.972 3.945 81 H LYS 32 H LYS 32 5.851 20.403 0.029 82 HA LYS 32 HA LYS 32 3.394 18.872 0.096 83 1HB LYS 32 1HB LYS 32 4.083 21.171 -0.957 84 2HB LYS 32 2HB LYS 32 4.766 20.256 -2.282 85 1HG LYS 32 1HG LYS 32 1.917 20.186 -1.233 86 2HG LYS 32 2HG LYS 32 2.456 21.184 -2.585 87 1HD LYS 32 1HD LYS 32 2.503 18.135 -2.503 88 2HD LYS 32 2HD LYS 32 1.218 19.105 -3.226 89 1HE LYS 32 1HE LYS 32 2.736 20.061 -4.875 90 2HE LYS 32 2HE LYS 32 4.129 19.220 -4.165 91 1HZ LYS 32 1HZ LYS 32 3.160 18.096 -6.117 92 2HZ LYS 32 2HZ LYS 32 3.184 17.158 -4.756 93 3HZ LYS 32 3HZ LYS 32 1.784 17.804 -5.243 94 H ILE 33 H ILE 33 4.300 16.758 0.523 95 HA ILE 33 HA ILE 33 6.504 15.855 -1.192 96 HB ILE 33 HB ILE 33 6.510 15.974 1.313 97 1HG1 ILE 33 1HG1 ILE 33 8.269 15.025 -0.010 98 2HG1 ILE 33 2HG1 ILE 33 8.041 14.211 1.528 99 1HG2 ILE 33 1HG2 ILE 33 5.932 13.922 2.507 100 2HG2 ILE 33 2HG2 ILE 33 4.524 14.847 2.010 101 3HG2 ILE 33 3HG2 ILE 33 4.964 13.367 1.137 102 1HD1 ILE 33 1HD1 ILE 33 6.681 12.416 0.180 103 2HD1 ILE 33 2HD1 ILE 33 7.450 13.165 -1.238 104 3HD1 ILE 33 3HD1 ILE 33 8.431 12.442 0.044 105 H LYS 34 H LYS 34 6.303 14.472 -2.785 106 HA LYS 34 HA LYS 34 3.689 13.522 -3.609 107 1HB LYS 34 1HB LYS 34 5.688 14.520 -4.947 108 2HB LYS 34 2HB LYS 34 6.377 12.903 -4.895 109 1HG LYS 34 1HG LYS 34 3.638 13.627 -6.054 110 2HG LYS 34 2HG LYS 34 5.172 13.614 -6.956 111 1HD LYS 34 1HD LYS 34 5.304 11.099 -6.060 112 2HD LYS 34 2HD LYS 34 3.557 11.297 -5.936 113 1HE LYS 34 1HE LYS 34 5.326 11.616 -8.406 114 2HE LYS 34 2HE LYS 34 4.153 10.331 -8.096 115 1HZ LYS 34 1HZ LYS 34 3.257 11.976 -9.591 116 2HZ LYS 34 2HZ LYS 34 2.384 11.987 -8.248 117 3HZ LYS 34 3HZ LYS 34 3.469 13.188 -8.500 118 H VAL 35 H VAL 35 3.134 11.173 -3.908 119 HA VAL 35 HA VAL 35 5.081 9.230 -2.819 120 HB VAL 35 HB VAL 35 2.376 9.868 -1.705 121 1HG1 VAL 35 1HG1 VAL 35 3.636 7.090 -1.564 122 2HG1 VAL 35 2HG1 VAL 35 2.194 7.633 -0.687 123 3HG1 VAL 35 3HG1 VAL 35 2.141 7.484 -2.436 124 1HG2 VAL 35 1HG2 VAL 35 4.382 10.593 -0.480 125 2HG2 VAL 35 2HG2 VAL 35 3.424 9.416 0.413 126 3HG2 VAL 35 3HG2 VAL 35 4.910 8.891 -0.408 127 H THR 36 H THR 36 4.834 7.244 -3.716 128 HA THR 36 HA THR 36 3.133 7.096 -6.191 129 HB THR 36 HB THR 36 6.076 6.422 -5.697 130 HG1 THR 36 HG1 THR 36 6.398 8.059 -7.239 131 1HG2 THR 36 1HG2 THR 36 5.124 4.778 -7.243 132 2HG2 THR 36 2HG2 THR 36 4.444 6.090 -8.241 133 3HG2 THR 36 3HG2 THR 36 6.210 5.895 -8.085 134 H PHE 37 H PHE 37 1.724 5.556 -5.896 135 HA PHE 37 HA PHE 37 2.204 3.322 -4.060 136 1HB PHE 37 1HB PHE 37 -0.029 4.057 -6.034 137 2HB PHE 37 2HB PHE 37 -0.002 2.602 -5.069 138 HD1 PHE 37 HD1 PHE 37 -0.089 2.710 -2.565 139 HD2 PHE 37 HD2 PHE 37 -0.441 6.236 -5.014 140 HE1 PHE 37 HE1 PHE 37 -0.278 4.091 -0.535 141 HE2 PHE 37 HE2 PHE 37 -0.436 7.615 -2.982 142 HZ PHE 37 HZ PHE 37 -0.328 6.601 -0.754 143 H ASP 38 H ASP 38 2.960 1.250 -4.837 144 HA ASP 38 HA ASP 38 3.053 0.905 -7.802 145 1HB ASP 38 1HB ASP 38 5.218 1.657 -6.832 146 2HB ASP 38 2HB ASP 38 5.247 0.235 -5.830 147 H ALA 39 H ALA 39 1.035 -0.074 -7.593 148 HA ALA 39 HA ALA 39 0.767 -2.526 -6.034 149 1HB ALA 39 1HB ALA 39 -0.982 -0.838 -6.228 150 2HB ALA 39 2HB ALA 39 -1.069 -1.084 -7.982 151 3HB ALA 39 3HB ALA 39 -1.542 -2.396 -6.889 152 H ASN 40 H ASN 40 2.142 -4.124 -6.957 153 HA ASN 40 HA ASN 40 1.902 -4.671 -9.862 154 1HB ASN 40 1HB ASN 40 3.763 -6.006 -7.916 155 2HB ASN 40 2HB ASN 40 3.807 -6.039 -9.671 156 1HD2 ASN 40 1HD2 ASN 40 4.258 -3.975 -6.796 157 2HD2 ASN 40 2HD2 ASN 40 5.223 -2.744 -7.631 158 H VAL 41 H VAL 41 0.290 -5.915 -10.348 159 HA VAL 41 HA VAL 41 -0.511 -8.260 -8.759 160 HB VAL 41 HB VAL 41 -2.197 -6.883 -9.973 161 1HG1 VAL 41 1HG1 VAL 41 -2.509 -7.109 -12.362 162 2HG1 VAL 41 2HG1 VAL 41 -0.911 -6.415 -12.051 163 3HG1 VAL 41 3HG1 VAL 41 -1.065 -8.124 -12.512 164 1HG2 VAL 41 1HG2 VAL 41 -2.650 -9.219 -9.281 165 2HG2 VAL 41 2HG2 VAL 41 -3.501 -8.781 -10.771 166 3HG2 VAL 41 3HG2 VAL 41 -2.055 -9.799 -10.850 167 H ALA 42 H ALA 42 -0.076 -10.438 -9.543 168 HA ALA 42 HA ALA 42 1.409 -10.793 -12.006 169 1HB ALA 42 1HB ALA 42 3.225 -12.083 -10.939 170 2HB ALA 42 2HB ALA 42 3.257 -10.370 -10.468 171 3HB ALA 42 3HB ALA 42 2.625 -11.596 -9.337 172 H ALA 43 H ALA 43 1.366 -13.131 -12.537 173 HA ALA 43 HA ALA 43 -1.066 -14.334 -12.234 174 1HB ALA 43 1HB ALA 43 0.620 -15.027 -13.888 175 2HB ALA 43 2HB ALA 43 1.611 -15.748 -12.598 176 3HB ALA 43 3HB ALA 43 0.013 -16.426 -12.980 177 H GLY 44 H GLY 44 1.720 -14.765 -10.139 178 1HA GLY 44 1HA GLY 44 1.123 -16.785 -8.404 179 2HA GLY 44 2HA GLY 44 1.880 -15.262 -7.919 180 H LEU 45 H LEU 45 -0.525 -13.563 -8.438 181 HA LEU 45 HA LEU 45 -2.543 -14.727 -6.608 182 1HB LEU 45 1HB LEU 45 -0.830 -12.709 -5.917 183 2HB LEU 45 2HB LEU 45 -2.205 -11.801 -6.562 184 HG LEU 45 HG LEU 45 -2.574 -13.985 -4.485 185 1HD1 LEU 45 1HD1 LEU 45 -2.529 -12.129 -2.813 186 2HD1 LEU 45 2HD1 LEU 45 -0.972 -12.159 -3.671 187 3HD1 LEU 45 3HD1 LEU 45 -2.182 -10.970 -4.091 188 1HD2 LEU 45 1HD2 LEU 45 -4.513 -13.158 -5.824 189 2HD2 LEU 45 2HD2 LEU 45 -4.556 -12.855 -4.075 190 3HD2 LEU 45 3HD2 LEU 45 -4.172 -11.516 -5.210 191 HA PRO 46 HA PRO 46 -4.195 -13.915 -10.659 192 1HB PRO 46 1HB PRO 46 -6.694 -15.150 -10.371 193 2HB PRO 46 2HB PRO 46 -5.134 -15.979 -10.711 194 1HG PRO 46 1HG PRO 46 -6.673 -15.691 -8.163 195 2HG PRO 46 2HG PRO 46 -5.704 -17.071 -8.733 196 1HD PRO 46 1HD PRO 46 -4.820 -15.219 -6.864 197 2HD PRO 46 2HD PRO 46 -3.732 -16.131 -7.936 198 H TRP 47 H TRP 47 -5.274 -12.207 -8.045 199 HA TRP 47 HA TRP 47 -7.957 -11.604 -8.713 200 1HB TRP 47 1HB TRP 47 -6.090 -10.459 -6.658 201 2HB TRP 47 2HB TRP 47 -7.839 -10.250 -6.695 202 HD1 TRP 47 HD1 TRP 47 -7.624 -13.663 -7.716 203 HE1 TRP 47 HE1 TRP 47 -7.867 -15.304 -5.836 204 HE3 TRP 47 HE3 TRP 47 -6.450 -10.554 -3.821 205 HZ2 TRP 47 HZ2 TRP 47 -7.690 -15.283 -2.901 206 HZ3 TRP 47 HZ3 TRP 47 -5.806 -11.683 -1.713 207 HH2 TRP 47 HH2 TRP 47 -6.705 -13.879 -1.114 208 H GLU 48 H GLU 48 -8.981 -9.570 -9.094 209 HA GLU 48 HA GLU 48 -7.559 -7.920 -11.089 210 1HB GLU 48 1HB GLU 48 -10.035 -8.509 -11.198 211 2HB GLU 48 2HB GLU 48 -10.264 -7.509 -9.759 212 1HG GLU 48 1HG GLU 48 -9.007 -5.734 -11.447 213 2HG GLU 48 2HG GLU 48 -9.882 -6.731 -12.609 214 H PHE 49 H PHE 49 -5.882 -7.432 -9.510 215 HA PHE 49 HA PHE 49 -6.431 -5.863 -7.164 216 1HB PHE 49 1HB PHE 49 -4.618 -7.464 -7.191 217 2HB PHE 49 2HB PHE 49 -3.866 -6.626 -8.542 218 HD1 PHE 49 HD1 PHE 49 -1.725 -6.201 -7.580 219 HD2 PHE 49 HD2 PHE 49 -5.277 -5.028 -5.416 220 HE1 PHE 49 HE1 PHE 49 -0.339 -4.995 -5.945 221 HE2 PHE 49 HE2 PHE 49 -3.877 -3.812 -3.799 222 HZ PHE 49 HZ PHE 49 -1.416 -3.727 -4.082 223 H VAL 50 H VAL 50 -7.002 -3.773 -7.282 224 HA VAL 50 HA VAL 50 -6.147 -2.155 -9.604 225 HB VAL 50 HB VAL 50 -8.574 -2.462 -7.965 226 1HG1 VAL 50 1HG1 VAL 50 -8.504 -0.122 -8.355 227 2HG1 VAL 50 2HG1 VAL 50 -8.009 -0.354 -10.054 228 3HG1 VAL 50 3HG1 VAL 50 -9.653 -0.793 -9.521 229 1HG2 VAL 50 1HG2 VAL 50 -8.561 -2.626 -10.975 230 2HG2 VAL 50 2HG2 VAL 50 -7.864 -3.978 -10.085 231 3HG2 VAL 50 3HG2 VAL 50 -9.531 -3.518 -9.775 232 HA PRO 51 HA PRO 51 -4.871 0.756 -6.245 233 1HB PRO 51 1HB PRO 51 -3.136 2.226 -7.733 234 2HB PRO 51 2HB PRO 51 -2.721 0.591 -7.161 235 1HG PRO 51 1HG PRO 51 -3.653 1.429 -9.898 236 2HG PRO 51 2HG PRO 51 -2.383 0.247 -9.487 237 1HD PRO 51 1HD PRO 51 -5.065 -0.303 -10.125 238 2HD PRO 51 2HD PRO 51 -4.050 -1.480 -9.248 239 H VAL 52 H VAL 52 -4.919 3.241 -6.425 240 HA VAL 52 HA VAL 52 -7.512 3.925 -7.647 241 HB VAL 52 HB VAL 52 -7.269 5.920 -6.005 242 1HG1 VAL 52 1HG1 VAL 52 -9.059 4.284 -5.954 243 2HG1 VAL 52 2HG1 VAL 52 -7.971 3.047 -5.295 244 3HG1 VAL 52 3HG1 VAL 52 -8.410 4.468 -4.317 245 1HG2 VAL 52 1HG2 VAL 52 -5.639 3.732 -4.673 246 2HG2 VAL 52 2HG2 VAL 52 -4.932 5.220 -5.328 247 3HG2 VAL 52 3HG2 VAL 52 -6.102 5.300 -3.986 248 H GLN 53 H GLN 53 -4.269 5.322 -7.212 249 HA GLN 53 HA GLN 53 -4.356 6.443 -9.900 250 1HB GLN 53 1HB GLN 53 -3.272 8.039 -7.573 251 2HB GLN 53 2HB GLN 53 -3.260 8.498 -9.248 252 1HG GLN 53 1HG GLN 53 -4.962 9.805 -8.354 253 2HG GLN 53 2HG GLN 53 -5.779 8.533 -9.273 254 1HE2 GLN 53 1HE2 GLN 53 -4.318 8.456 -5.955 255 2HE2 GLN 53 2HE2 GLN 53 -5.826 8.043 -5.169 256 H ARG 54 H ARG 54 -1.845 7.038 -10.306 257 HA ARG 54 HA ARG 54 -0.247 4.797 -9.367 258 1HB ARG 54 1HB ARG 54 0.029 5.976 -11.611 259 2HB ARG 54 2HB ARG 54 0.732 7.331 -10.732 260 1HG ARG 54 1HG ARG 54 2.470 5.857 -11.664 261 2HG ARG 54 2HG ARG 54 2.557 5.847 -9.900 262 1HD ARG 54 1HD ARG 54 1.643 3.707 -9.781 263 2HD ARG 54 2HD ARG 54 1.042 3.805 -11.429 264 HE ARG 54 HE ARG 54 3.169 3.383 -12.322 265 1HH1 ARG 54 1HH1 ARG 54 3.313 3.143 -8.705 266 2HH1 ARG 54 2HH1 ARG 54 4.608 1.961 -8.855 267 1HH2 ARG 54 1HH2 ARG 54 4.840 1.667 -12.219 268 2HH2 ARG 54 2HH2 ARG 54 5.292 1.135 -10.595 269 H ASP 55 H ASP 55 -0.710 8.258 -8.519 270 HA ASP 55 HA ASP 55 1.106 8.024 -6.236 271 1HB ASP 55 1HB ASP 55 1.912 10.198 -7.064 272 2HB ASP 55 2HB ASP 55 2.074 8.978 -8.336 273 H ILE 56 H ILE 56 1.043 10.084 -5.009 274 HA ILE 56 HA ILE 56 -1.413 11.637 -4.927 275 HB ILE 56 HB ILE 56 -1.654 11.601 -2.506 276 1HG1 ILE 56 1HG1 ILE 56 0.489 9.497 -2.695 277 2HG1 ILE 56 2HG1 ILE 56 0.551 11.068 -1.899 278 1HG2 ILE 56 1HG2 ILE 56 -1.959 8.859 -3.741 279 2HG2 ILE 56 2HG2 ILE 56 -2.792 9.493 -2.299 280 3HG2 ILE 56 3HG2 ILE 56 -3.089 10.212 -3.887 281 1HD1 ILE 56 1HD1 ILE 56 0.387 9.188 -0.281 282 2HD1 ILE 56 2HD1 ILE 56 -0.921 10.366 -0.138 283 3HD1 ILE 56 3HD1 ILE 56 -1.208 8.784 -0.908 284 H ASP 57 H ASP 57 -0.902 13.497 -3.227 285 HA ASP 57 HA ASP 57 1.799 13.421 -2.363 286 1HB ASP 57 1HB ASP 57 2.371 15.728 -2.672 287 2HB ASP 57 2HB ASP 57 2.017 15.018 -4.256 288 H VAL 58 H VAL 58 2.054 14.752 -0.460 289 HA VAL 58 HA VAL 58 -0.412 15.158 1.197 290 HB VAL 58 HB VAL 58 -0.146 13.171 2.025 291 1HG1 VAL 58 1HG1 VAL 58 1.361 12.230 0.367 292 2HG1 VAL 58 2HG1 VAL 58 2.749 13.017 1.150 293 3HG1 VAL 58 3HG1 VAL 58 1.856 11.736 1.984 294 1HG2 VAL 58 1HG2 VAL 58 0.721 14.709 3.818 295 2HG2 VAL 58 2HG2 VAL 58 1.235 13.036 3.970 296 3HG2 VAL 58 3HG2 VAL 58 2.371 14.232 3.341 297 H ARG 59 H ARG 59 -0.120 17.047 2.443 298 HA ARG 59 HA ARG 59 2.535 18.357 2.562 299 1HB ARG 59 1HB ARG 59 -0.242 19.156 3.235 300 2HB ARG 59 2HB ARG 59 0.904 19.494 4.523 301 1HG ARG 59 1HG ARG 59 0.952 21.428 3.302 302 2HG ARG 59 2HG ARG 59 2.441 20.574 2.939 303 1HD ARG 59 1HD ARG 59 1.914 21.082 0.829 304 2HD ARG 59 2HD ARG 59 0.907 19.626 0.880 305 HE ARG 59 HE ARG 59 0.114 22.497 1.023 306 1HH1 ARG 59 1HH1 ARG 59 -1.154 19.087 1.087 307 2HH1 ARG 59 2HH1 ARG 59 -2.739 19.572 1.040 308 1HH2 ARG 59 1HH2 ARG 59 -2.108 23.077 0.824 309 2HH2 ARG 59 2HH2 ARG 59 -3.309 21.823 0.708 310 H ILE 60 H ILE 60 3.760 16.739 3.404 311 HA ILE 60 HA ILE 60 4.106 14.869 4.924 312 HB ILE 60 HB ILE 60 5.623 16.127 6.626 313 1HG1 ILE 60 1HG1 ILE 60 5.179 18.339 4.576 314 2HG1 ILE 60 2HG1 ILE 60 4.335 18.302 6.117 315 1HG2 ILE 60 1HG2 ILE 60 7.345 16.290 4.874 316 2HG2 ILE 60 2HG2 ILE 60 6.378 14.833 4.688 317 3HG2 ILE 60 3HG2 ILE 60 6.083 16.230 3.629 318 1HD1 ILE 60 1HD1 ILE 60 6.371 18.573 7.340 319 2HD1 ILE 60 2HD1 ILE 60 7.379 18.231 5.917 320 3HD1 ILE 60 3HD1 ILE 60 6.436 19.715 5.970 321 H GLY 61 H GLY 61 1.862 14.414 5.563 322 1HA GLY 61 1HA GLY 61 1.347 13.571 7.938 323 2HA GLY 61 2HA GLY 61 1.190 15.275 8.335 324 H GLU 62 H GLU 62 0.028 16.054 5.813 325 HA GLU 62 HA GLU 62 -2.658 16.025 6.108 326 1HB GLU 62 1HB GLU 62 -1.243 17.167 4.384 327 2HB GLU 62 2HB GLU 62 -1.281 15.656 3.445 328 1HG GLU 62 1HG GLU 62 -3.706 15.858 3.171 329 2HG GLU 62 2HG GLU 62 -3.726 17.297 4.219 330 H THR 63 H THR 63 -3.844 14.337 6.725 331 HA THR 63 HA THR 63 -2.955 11.709 6.215 332 HB THR 63 HB THR 63 -5.460 12.485 7.739 333 HG1 THR 63 HG1 THR 63 -2.780 13.229 8.254 334 1HG2 THR 63 1HG2 THR 63 -3.176 10.900 8.852 335 2HG2 THR 63 2HG2 THR 63 -4.916 10.734 9.151 336 3HG2 THR 63 3HG2 THR 63 -4.236 10.103 7.648 337 H VAL 64 H VAL 64 -3.390 11.132 3.990 338 HA VAL 64 HA VAL 64 -6.115 11.728 3.006 339 HB VAL 64 HB VAL 64 -3.930 12.176 1.843 340 1HG1 VAL 64 1HG1 VAL 64 -3.131 10.544 0.221 341 2HG1 VAL 64 2HG1 VAL 64 -2.933 9.947 1.876 342 3HG1 VAL 64 3HG1 VAL 64 -4.239 9.320 0.845 343 1HG2 VAL 64 1HG2 VAL 64 -6.081 10.905 0.127 344 2HG2 VAL 64 2HG2 VAL 64 -6.174 12.544 0.823 345 3HG2 VAL 64 3HG2 VAL 64 -4.912 12.139 -0.349 346 H GLN 65 H GLN 65 -7.234 10.230 1.691 347 HA GLN 65 HA GLN 65 -6.983 7.394 2.491 348 1HB GLN 65 1HB GLN 65 -9.217 8.818 2.904 349 2HB GLN 65 2HB GLN 65 -9.438 8.558 1.172 350 1HG GLN 65 1HG GLN 65 -10.587 6.770 2.152 351 2HG GLN 65 2HG GLN 65 -9.045 6.009 1.745 352 1HE2 GLN 65 1HE2 GLN 65 -7.325 6.096 3.673 353 2HE2 GLN 65 2HE2 GLN 65 -8.013 5.977 5.274 354 H ILE 66 H ILE 66 -6.304 5.984 1.139 355 HA ILE 66 HA ILE 66 -6.964 6.364 -1.694 356 HB ILE 66 HB ILE 66 -4.650 5.232 -2.183 357 1HG1 ILE 66 1HG1 ILE 66 -2.828 6.382 -0.949 358 2HG1 ILE 66 2HG1 ILE 66 -3.942 6.868 0.317 359 1HG2 ILE 66 1HG2 ILE 66 -5.543 7.429 -3.025 360 2HG2 ILE 66 2HG2 ILE 66 -4.847 8.201 -1.584 361 3HG2 ILE 66 3HG2 ILE 66 -3.796 7.399 -2.776 362 1HD1 ILE 66 1HD1 ILE 66 -4.258 4.598 0.983 363 2HD1 ILE 66 2HD1 ILE 66 -3.491 3.955 -0.495 364 3HD1 ILE 66 3HD1 ILE 66 -2.518 4.783 0.735 365 H MET 67 H MET 67 -8.299 4.881 -2.071 366 HA MET 67 HA MET 67 -8.559 2.527 -0.425 367 1HB MET 67 1HB MET 67 -10.322 4.021 -1.828 368 2HB MET 67 2HB MET 67 -10.017 2.766 -3.031 369 1HG MET 67 1HG MET 67 -10.644 1.068 -1.194 370 2HG MET 67 2HG MET 67 -11.013 2.457 -0.165 371 1HE MET 67 1HE MET 67 -13.444 1.098 -3.841 372 2HE MET 67 2HE MET 67 -11.802 1.748 -4.044 373 3HE MET 67 3HE MET 67 -12.056 0.228 -3.145 374 H TYR 68 H TYR 68 -8.630 0.273 -1.222 375 HA TYR 68 HA TYR 68 -7.223 -0.256 -3.782 376 1HB TYR 68 1HB TYR 68 -6.492 -1.235 -1.010 377 2HB TYR 68 2HB TYR 68 -6.378 -2.361 -2.353 378 HD1 TYR 68 HD1 TYR 68 -4.598 0.242 -0.647 379 HD2 TYR 68 HD2 TYR 68 -5.146 -1.636 -4.485 380 HE1 TYR 68 HE1 TYR 68 -2.290 0.876 -1.287 381 HE2 TYR 68 HE2 TYR 68 -2.871 -0.986 -5.137 382 HH TYR 68 HH TYR 68 -0.602 0.538 -2.834 383 H ARG 69 H ARG 69 -7.897 -2.182 -4.793 384 HA ARG 69 HA ARG 69 -10.187 -3.614 -3.624 385 1HB ARG 69 1HB ARG 69 -11.023 -1.609 -4.883 386 2HB ARG 69 2HB ARG 69 -10.289 -2.283 -6.348 387 1HG ARG 69 1HG ARG 69 -11.704 -4.301 -6.092 388 2HG ARG 69 2HG ARG 69 -12.385 -3.667 -4.600 389 1HD ARG 69 1HD ARG 69 -13.969 -3.260 -6.412 390 2HD ARG 69 2HD ARG 69 -13.344 -1.740 -5.792 391 HE ARG 69 HE ARG 69 -12.542 -1.252 -7.863 392 1HH1 ARG 69 1HH1 ARG 69 -12.978 -4.785 -7.723 393 2HH1 ARG 69 2HH1 ARG 69 -12.103 -5.068 -9.230 394 1HH2 ARG 69 1HH2 ARG 69 -11.798 -1.623 -10.031 395 2HH2 ARG 69 2HH2 ARG 69 -11.637 -3.252 -10.622 396 H ALA 70 H ALA 70 -10.467 -5.719 -4.463 397 HA ALA 70 HA ALA 70 -8.759 -6.754 -6.582 398 1HB ALA 70 1HB ALA 70 -7.152 -6.757 -4.819 399 2HB ALA 70 2HB ALA 70 -8.274 -7.575 -3.727 400 3HB ALA 70 3HB ALA 70 -7.663 -8.419 -5.160 401 H LYS 71 H LYS 71 -10.293 -7.858 -7.744 402 HA LYS 71 HA LYS 71 -12.405 -9.444 -6.367 403 1HB LYS 71 1HB LYS 71 -11.695 -9.133 -9.311 404 2HB LYS 71 2HB LYS 71 -12.951 -10.204 -8.671 405 1HG LYS 71 1HG LYS 71 -14.022 -8.264 -7.658 406 2HG LYS 71 2HG LYS 71 -12.852 -7.218 -8.513 407 1HD LYS 71 1HD LYS 71 -13.656 -8.406 -10.659 408 2HD LYS 71 2HD LYS 71 -14.861 -9.254 -9.662 409 1HE LYS 71 1HE LYS 71 -15.793 -7.338 -10.955 410 2HE LYS 71 2HE LYS 71 -16.049 -7.201 -9.208 411 1HZ LYS 71 1HZ LYS 71 -15.170 -5.170 -10.445 412 2HZ LYS 71 2HZ LYS 71 -14.497 -5.624 -9.008 413 3HZ LYS 71 3HZ LYS 71 -13.698 -5.961 -10.416 414 H ASN 72 H ASN 72 -12.222 -11.703 -6.080 415 HA ASN 72 HA ASN 72 -9.794 -12.966 -7.105 416 1HB ASN 72 1HB ASN 72 -10.493 -13.750 -5.012 417 2HB ASN 72 2HB ASN 72 -12.122 -14.131 -5.613 418 1HD2 ASN 72 1HD2 ASN 72 -11.786 -16.367 -4.919 419 2HD2 ASN 72 2HD2 ASN 72 -10.821 -17.475 -5.903 420 H LEU 73 H LEU 73 -9.888 -12.618 -9.326 421 HA LEU 73 HA LEU 73 -11.922 -13.973 -10.963 422 1HB LEU 73 1HB LEU 73 -9.244 -12.671 -11.539 423 2HB LEU 73 2HB LEU 73 -10.065 -13.645 -12.757 424 HG LEU 73 HG LEU 73 -11.999 -12.256 -12.818 425 1HD1 LEU 73 1HD1 LEU 73 -12.007 -10.061 -11.581 426 2HD1 LEU 73 2HD1 LEU 73 -12.221 -11.479 -10.546 427 3HD1 LEU 73 3HD1 LEU 73 -10.633 -10.673 -10.624 428 1HD2 LEU 73 1HD2 LEU 73 -9.430 -10.610 -12.935 429 2HD2 LEU 73 2HD2 LEU 73 -10.044 -11.669 -14.225 430 3HD2 LEU 73 3HD2 LEU 73 -10.957 -10.225 -13.756 431 H ALA 74 H ALA 74 -11.607 -15.953 -9.432 432 HA ALA 74 HA ALA 74 -10.340 -17.885 -11.225 433 1HB ALA 74 1HB ALA 74 -9.089 -19.057 -9.481 434 2HB ALA 74 2HB ALA 74 -8.498 -17.386 -9.565 435 3HB ALA 74 3HB ALA 74 -9.595 -17.884 -8.259 436 H SER 75 H SER 75 -11.643 -19.721 -11.278 437 HA SER 75 HA SER 75 -14.113 -19.630 -9.704 438 1HB SER 75 1HB SER 75 -14.088 -20.235 -12.110 439 2HB SER 75 2HB SER 75 -13.185 -21.709 -11.719 440 HG SER 75 HG SER 75 -14.907 -22.254 -10.293 441 H THR 76 H THR 76 -11.801 -19.885 -8.056 442 HA THR 76 HA THR 76 -12.524 -22.171 -6.482 443 HB THR 76 HB THR 76 -9.923 -22.671 -6.226 444 HG1 THR 76 HG1 THR 76 -9.295 -20.917 -7.569 445 1HG2 THR 76 1HG2 THR 76 -11.513 -24.317 -7.200 446 2HG2 THR 76 2HG2 THR 76 -11.263 -23.590 -8.799 447 3HG2 THR 76 3HG2 THR 76 -9.911 -24.364 -7.961 448 HA PRO 77 HA PRO 77 -11.397 -19.061 -3.533 449 1HB PRO 77 1HB PRO 77 -10.537 -20.525 -1.351 450 2HB PRO 77 2HB PRO 77 -12.257 -20.421 -1.816 451 1HG PRO 77 1HG PRO 77 -10.297 -22.607 -2.544 452 2HG PRO 77 2HG PRO 77 -11.939 -22.789 -1.857 453 1HD PRO 77 1HD PRO 77 -11.481 -23.018 -4.518 454 2HD PRO 77 2HD PRO 77 -12.952 -22.198 -3.928 455 H THR 78 H THR 78 -9.387 -18.042 -2.937 456 HA THR 78 HA THR 78 -6.884 -19.469 -3.847 457 HB THR 78 HB THR 78 -6.470 -16.662 -4.113 458 HG1 THR 78 HG1 THR 78 -8.730 -16.460 -4.322 459 1HG2 THR 78 1HG2 THR 78 -6.896 -18.716 -6.284 460 2HG2 THR 78 2HG2 THR 78 -6.075 -17.139 -6.363 461 3HG2 THR 78 3HG2 THR 78 -5.358 -18.436 -5.403 462 H THR 79 H THR 79 -4.897 -18.074 -3.236 463 HA THR 79 HA THR 79 -4.851 -17.780 -0.278 464 HB THR 79 HB THR 79 -2.579 -18.456 -2.206 465 HG1 THR 79 HG1 THR 79 -4.211 -20.102 -2.008 466 1HG2 THR 79 1HG2 THR 79 -2.785 -18.558 0.841 467 2HG2 THR 79 2HG2 THR 79 -1.380 -19.091 -0.101 468 3HG2 THR 79 3HG2 THR 79 -1.842 -17.400 -0.123 469 H GLY 80 H GLY 80 -3.903 -15.799 0.427 470 1HA GLY 80 1HA GLY 80 -2.724 -13.974 -1.583 471 2HA GLY 80 2HA GLY 80 -3.934 -13.418 -0.412 472 H GLN 81 H GLN 81 -0.673 -13.481 -0.881 473 HA GLN 81 HA GLN 81 -0.264 -12.482 1.680 474 1HB GLN 81 1HB GLN 81 1.652 -14.173 2.367 475 2HB GLN 81 2HB GLN 81 -0.003 -14.286 2.881 476 1HG GLN 81 1HG GLN 81 0.579 -16.447 2.510 477 2HG GLN 81 2HG GLN 81 -0.467 -16.060 1.165 478 1HE2 GLN 81 1HE2 GLN 81 2.634 -14.689 0.606 479 2HE2 GLN 81 2HE2 GLN 81 3.345 -16.047 -0.242 480 H ALA 82 H ALA 82 -0.141 -11.267 -0.423 481 HA ALA 82 HA ALA 82 2.141 -11.245 -2.090 482 1HB ALA 82 1HB ALA 82 1.495 -8.894 -2.473 483 2HB ALA 82 2HB ALA 82 0.037 -9.922 -2.431 484 3HB ALA 82 3HB ALA 82 0.459 -8.916 -1.035 485 H THR 83 H THR 83 4.117 -10.044 -1.921 486 HA THR 83 HA THR 83 4.854 -9.271 0.871 487 HB THR 83 HB THR 83 6.455 -10.727 -0.350 488 HG1 THR 83 HG1 THR 83 7.194 -9.526 1.326 489 1HG2 THR 83 1HG2 THR 83 7.008 -8.213 -1.986 490 2HG2 THR 83 2HG2 THR 83 7.956 -9.707 -1.983 491 3HG2 THR 83 3HG2 THR 83 6.301 -9.736 -2.616 492 H PHE 84 H PHE 84 6.057 -7.164 0.957 493 HA PHE 84 HA PHE 84 4.829 -5.036 -0.704 494 1HB PHE 84 1HB PHE 84 4.089 -3.980 1.524 495 2HB PHE 84 2HB PHE 84 3.085 -5.213 0.785 496 HD1 PHE 84 HD1 PHE 84 2.791 -7.431 1.772 497 HD2 PHE 84 HD2 PHE 84 5.390 -4.528 3.620 498 HE1 PHE 84 HE1 PHE 84 3.433 -9.074 3.483 499 HE2 PHE 84 HE2 PHE 84 6.121 -6.177 5.219 500 HZ PHE 84 HZ PHE 84 5.083 -8.471 5.253 501 H ASN 85 H ASN 85 6.785 -4.354 -1.411 502 HA ASN 85 HA ASN 85 8.975 -3.867 0.544 503 1HB ASN 85 1HB ASN 85 9.989 -4.497 -1.337 504 2HB ASN 85 2HB ASN 85 8.640 -4.037 -2.340 505 1HD2 ASN 85 1HD2 ASN 85 11.440 -2.657 -0.479 506 2HD2 ASN 85 2HD2 ASN 85 11.613 -1.269 -1.552 507 H VAL 86 H VAL 86 7.791 -2.604 1.935 508 HA VAL 86 HA VAL 86 6.458 -0.149 1.203 509 HB VAL 86 HB VAL 86 7.377 -1.163 3.919 510 1HG1 VAL 86 1HG1 VAL 86 5.398 0.242 4.728 511 2HG1 VAL 86 2HG1 VAL 86 6.762 1.206 4.189 512 3HG1 VAL 86 3HG1 VAL 86 5.367 0.980 3.118 513 1HG2 VAL 86 1HG2 VAL 86 4.557 -1.272 2.839 514 2HG2 VAL 86 2HG2 VAL 86 5.678 -2.596 2.545 515 3HG2 VAL 86 3HG2 VAL 86 5.254 -2.143 4.205 516 H THR 87 H THR 87 8.676 0.401 -0.136 517 HA THR 87 HA THR 87 9.679 2.686 1.156 518 HB THR 87 HB THR 87 10.989 1.089 2.465 519 HG1 THR 87 HG1 THR 87 13.098 1.983 1.932 520 1HG2 THR 87 1HG2 THR 87 12.275 0.258 -0.122 521 2HG2 THR 87 2HG2 THR 87 12.758 -0.244 1.512 522 3HG2 THR 87 3HG2 THR 87 11.158 -0.696 0.893 523 HA PRO 88 HA PRO 88 11.091 3.405 -3.096 524 1HB PRO 88 1HB PRO 88 12.850 5.481 -2.594 525 2HB PRO 88 2HB PRO 88 11.095 5.690 -2.774 526 1HG PRO 88 1HG PRO 88 12.680 5.531 -0.228 527 2HG PRO 88 2HG PRO 88 11.312 6.607 -0.628 528 1HD PRO 88 1HD PRO 88 11.033 4.351 0.874 529 2HD PRO 88 2HD PRO 88 9.738 4.916 -0.204 530 H MET 89 H MET 89 13.082 3.167 -0.187 531 HA MET 89 HA MET 89 14.614 1.063 -0.706 532 1HB MET 89 1HB MET 89 16.877 1.950 -1.379 533 2HB MET 89 2HB MET 89 15.689 1.789 -2.642 534 1HG MET 89 1HG MET 89 15.281 4.401 -2.198 535 2HG MET 89 2HG MET 89 16.889 4.281 -1.470 536 1HE MET 89 1HE MET 89 14.834 4.115 -4.775 537 2HE MET 89 2HE MET 89 16.092 3.687 -5.956 538 3HE MET 89 3HE MET 89 15.521 2.471 -4.798 539 H ALA 90 H ALA 90 15.871 4.305 0.080 540 HA ALA 90 HA ALA 90 17.138 3.376 2.462 541 1HB ALA 90 1HB ALA 90 17.992 5.210 1.001 542 2HB ALA 90 2HB ALA 90 16.594 6.205 1.476 543 3HB ALA 90 3HB ALA 90 17.800 5.733 2.689 544 H ALA 91 H ALA 91 14.025 4.903 1.831 545 HA ALA 91 HA ALA 91 13.762 5.874 4.565 546 1HB ALA 91 1HB ALA 91 11.635 6.770 3.862 547 2HB ALA 91 2HB ALA 91 12.942 7.192 2.727 548 3HB ALA 91 3HB ALA 91 11.767 5.952 2.283 549 H GLY 92 H GLY 92 10.742 4.744 3.585 550 1HA GLY 92 1HA GLY 92 9.433 2.979 4.155 551 2HA GLY 92 2HA GLY 92 10.892 2.015 4.428 552 H ALA 93 H ALA 93 12.129 3.166 6.543 553 HA ALA 93 HA ALA 93 10.853 2.478 8.891 554 1HB ALA 93 1HB ALA 93 12.818 4.764 8.423 555 2HB ALA 93 2HB ALA 93 12.414 4.061 10.004 556 3HB ALA 93 3HB ALA 93 13.219 3.071 8.770 557 H TYR 94 H TYR 94 10.973 5.727 7.443 558 HA TYR 94 HA TYR 94 9.059 6.915 9.198 559 1HB TYR 94 1HB TYR 94 10.025 8.016 6.564 560 2HB TYR 94 2HB TYR 94 9.570 8.899 8.019 561 HD1 TYR 94 HD1 TYR 94 11.170 7.424 10.126 562 HD2 TYR 94 HD2 TYR 94 12.274 8.503 6.097 563 HE1 TYR 94 HE1 TYR 94 13.537 7.225 10.727 564 HE2 TYR 94 HE2 TYR 94 14.672 8.382 6.752 565 HH TYR 94 HH TYR 94 15.744 7.210 9.925 566 H PHE 95 H PHE 95 8.432 4.764 6.695 567 HA PHE 95 HA PHE 95 6.210 6.150 5.451 568 1HB PHE 95 1HB PHE 95 7.469 4.224 4.405 569 2HB PHE 95 2HB PHE 95 6.792 3.159 5.627 570 HD1 PHE 95 HD1 PHE 95 4.192 2.959 5.770 571 HD2 PHE 95 HD2 PHE 95 6.434 4.151 2.292 572 HE1 PHE 95 HE1 PHE 95 2.293 2.335 4.352 573 HE2 PHE 95 HE2 PHE 95 4.535 3.490 0.868 574 HZ PHE 95 HZ PHE 95 2.412 2.689 1.892 575 H ASN 96 H ASN 96 4.051 6.271 6.171 576 HA ASN 96 HA ASN 96 3.653 5.309 8.857 577 1HB ASN 96 1HB ASN 96 1.894 6.870 6.979 578 2HB ASN 96 2HB ASN 96 1.224 6.112 8.425 579 1HD2 ASN 96 1HD2 ASN 96 3.260 8.720 7.315 580 2HD2 ASN 96 2HD2 ASN 96 3.578 9.383 8.934 581 H LYS 97 H LYS 97 3.967 3.093 8.670 582 HA LYS 97 HA LYS 97 2.282 1.255 7.228 583 1HB LYS 97 1HB LYS 97 3.690 1.091 9.937 584 2HB LYS 97 2HB LYS 97 2.649 -0.182 9.330 585 1HG LYS 97 1HG LYS 97 4.834 -0.880 8.822 586 2HG LYS 97 2HG LYS 97 4.022 -0.459 7.318 587 1HD LYS 97 1HD LYS 97 6.263 0.311 7.144 588 2HD LYS 97 2HD LYS 97 5.244 1.729 7.327 589 1HE LYS 97 1HE LYS 97 5.871 1.637 9.859 590 2HE LYS 97 2HE LYS 97 7.080 0.428 9.399 591 1HZ LYS 97 1HZ LYS 97 6.859 3.196 8.431 592 2HZ LYS 97 2HZ LYS 97 8.017 2.711 9.428 593 3HZ LYS 97 3HZ LYS 97 8.003 2.189 7.873 594 H VAL 98 H VAL 98 0.069 1.050 7.388 595 HA VAL 98 HA VAL 98 -1.433 2.762 9.031 596 HB VAL 98 HB VAL 98 -2.339 0.155 7.731 597 1HG1 VAL 98 1HG1 VAL 98 -3.970 0.849 9.386 598 2HG1 VAL 98 2HG1 VAL 98 -3.864 2.543 8.871 599 3HG1 VAL 98 3HG1 VAL 98 -4.587 1.332 7.802 600 1HG2 VAL 98 1HG2 VAL 98 -3.196 1.689 5.965 601 2HG2 VAL 98 2HG2 VAL 98 -2.344 3.042 6.736 602 3HG2 VAL 98 3HG2 VAL 98 -1.427 1.690 6.041 603 H GLN 99 H GLN 99 -2.032 2.663 11.112 604 HA GLN 99 HA GLN 99 -0.798 0.631 12.760 605 1HB GLN 99 1HB GLN 99 -0.890 3.197 12.997 606 2HB GLN 99 2HB GLN 99 -2.514 2.979 13.650 607 1HG GLN 99 1HG GLN 99 -1.552 1.675 15.529 608 2HG GLN 99 2HG GLN 99 0.043 1.709 14.754 609 1HE2 GLN 99 1HE2 GLN 99 -2.538 4.046 15.737 610 2HE2 GLN 99 2HE2 GLN 99 -1.428 5.296 16.254 611 H CYS 100 H CYS 100 -2.627 -0.747 11.313 612 HA CYS 100 HA CYS 100 -4.542 -1.819 13.190 613 1HB CYS 100 1HB CYS 100 -5.842 0.179 12.525 614 2HB CYS 100 2HB CYS 100 -5.556 -0.192 10.808 615 HG CYS 100 HG CYS 100 -7.991 -0.796 11.372 616 H PHE 101 H PHE 101 -5.247 -3.873 12.424 617 HA PHE 101 HA PHE 101 -3.583 -5.003 10.317 618 1HB PHE 101 1HB PHE 101 -4.224 -6.101 12.536 619 2HB PHE 101 2HB PHE 101 -5.797 -6.423 11.821 620 HD1 PHE 101 HD1 PHE 101 -2.176 -7.185 11.765 621 HD2 PHE 101 HD2 PHE 101 -5.990 -8.086 9.951 622 HE1 PHE 101 HE1 PHE 101 -1.189 -9.169 10.657 623 HE2 PHE 101 HE2 PHE 101 -4.979 -10.035 8.809 624 HZ PHE 101 HZ PHE 101 -2.583 -10.587 9.163 625 H CYS 102 H CYS 102 -4.539 -3.439 8.741 626 HA CYS 102 HA CYS 102 -6.770 -4.759 7.232 627 1HB CYS 102 1HB CYS 102 -7.633 -2.545 6.615 628 2HB CYS 102 2HB CYS 102 -7.722 -2.810 8.365 629 HG CYS 102 HG CYS 102 -7.142 -0.311 7.739 630 H PHE 103 H PHE 103 -4.355 -5.596 6.648 631 HA PHE 103 HA PHE 103 -3.591 -4.302 4.123 632 1HB PHE 103 1HB PHE 103 -2.448 -3.029 5.955 633 2HB PHE 103 2HB PHE 103 -1.749 -4.532 6.542 634 HD1 PHE 103 HD1 PHE 103 -1.859 -2.189 3.618 635 HD2 PHE 103 HD2 PHE 103 0.328 -5.307 5.644 636 HE1 PHE 103 HE1 PHE 103 0.167 -1.636 2.295 637 HE2 PHE 103 HE2 PHE 103 2.348 -4.730 4.355 638 HZ PHE 103 HZ PHE 103 2.286 -2.879 2.690 639 H THR 104 H THR 104 -2.360 -5.728 2.830 640 HA THR 104 HA THR 104 -1.925 -7.694 1.881 641 HB THR 104 HB THR 104 -0.820 -8.373 4.618 642 HG1 THR 104 HG1 THR 104 1.021 -7.381 3.720 643 1HG2 THR 104 1HG2 THR 104 -0.108 -9.388 1.818 644 2HG2 THR 104 2HG2 THR 104 0.790 -9.747 3.305 645 3HG2 THR 104 3HG2 THR 104 -0.862 -10.351 3.109 646 H GLU 105 H GLU 105 -3.954 -8.299 1.328 647 HA GLU 105 HA GLU 105 -5.832 -9.703 2.829 648 1HB GLU 105 1HB GLU 105 -6.304 -8.676 0.687 649 2HB GLU 105 2HB GLU 105 -5.195 -9.774 -0.150 650 1HG GLU 105 1HG GLU 105 -7.586 -10.336 -0.476 651 2HG GLU 105 2HG GLU 105 -6.686 -11.657 0.275 652 H THR 106 H THR 106 -6.501 -11.907 2.648 653 HA THR 106 HA THR 106 -4.270 -13.793 3.131 654 HB THR 106 HB THR 106 -5.212 -13.090 5.172 655 HG1 THR 106 HG1 THR 106 -4.989 -15.345 4.924 656 1HG2 THR 106 1HG2 THR 106 -7.282 -11.982 4.507 657 2HG2 THR 106 2HG2 THR 106 -8.031 -13.505 4.046 658 3HG2 THR 106 3HG2 THR 106 -7.615 -13.203 5.733 659 H THR 107 H THR 107 -7.689 -13.619 2.128 660 HA THR 107 HA THR 107 -7.385 -15.785 0.288 661 HB THR 107 HB THR 107 -7.065 -17.122 2.269 662 HG1 THR 107 HG1 THR 107 -8.105 -18.018 0.431 663 1HG2 THR 107 1HG2 THR 107 -9.901 -16.312 2.940 664 2HG2 THR 107 2HG2 THR 107 -8.916 -17.517 3.806 665 3HG2 THR 107 3HG2 THR 107 -8.432 -15.803 3.806 666 H LEU 108 H LEU 108 -9.181 -15.986 -1.079 667 HA LEU 108 HA LEU 108 -11.710 -14.715 -0.279 668 1HB LEU 108 1HB LEU 108 -10.167 -14.017 -2.793 669 2HB LEU 108 2HB LEU 108 -11.872 -13.605 -2.561 670 HG LEU 108 HG LEU 108 -9.698 -12.677 -0.664 671 1HD1 LEU 108 1HD1 LEU 108 -9.321 -10.777 -1.797 672 2HD1 LEU 108 2HD1 LEU 108 -9.388 -11.948 -3.106 673 3HD1 LEU 108 3HD1 LEU 108 -10.792 -10.897 -2.826 674 1HD2 LEU 108 1HD2 LEU 108 -12.062 -12.549 0.184 675 2HD2 LEU 108 2HD2 LEU 108 -11.312 -10.969 -0.003 676 3HD2 LEU 108 3HD2 LEU 108 -12.477 -11.534 -1.221 677 H GLU 109 H GLU 109 -13.427 -15.683 -1.204 678 HA GLU 109 HA GLU 109 -12.978 -18.305 -2.306 679 1HB GLU 109 1HB GLU 109 -15.730 -17.209 -1.897 680 2HB GLU 109 2HB GLU 109 -15.027 -18.821 -1.593 681 1HG GLU 109 1HG GLU 109 -13.707 -17.862 0.309 682 2HG GLU 109 2HG GLU 109 -14.716 -16.400 0.181 683 HA PRO 110 HA PRO 110 -13.275 -17.815 -6.412 684 1HB PRO 110 1HB PRO 110 -15.295 -19.322 -7.566 685 2HB PRO 110 2HB PRO 110 -13.881 -19.955 -6.699 686 1HG PRO 110 1HG PRO 110 -16.600 -19.536 -5.540 687 2HG PRO 110 2HG PRO 110 -15.552 -20.996 -5.456 688 1HD PRO 110 1HD PRO 110 -15.648 -19.230 -3.484 689 2HD PRO 110 2HD PRO 110 -14.077 -19.949 -3.922 690 H GLY 111 H GLY 111 -13.728 -15.483 -6.187 691 1HA GLY 111 1HA GLY 111 -14.731 -14.385 -8.427 692 2HA GLY 111 2HA GLY 111 -16.207 -14.524 -7.490 693 H GLU 112 H GLU 112 -14.617 -14.105 -4.881 694 HA GLU 112 HA GLU 112 -16.272 -11.886 -5.028 695 1HB GLU 112 1HB GLU 112 -15.010 -12.620 -2.480 696 2HB GLU 112 2HB GLU 112 -16.627 -12.027 -2.849 697 1HG GLU 112 1HG GLU 112 -15.510 -14.735 -3.213 698 2HG GLU 112 2HG GLU 112 -16.908 -14.226 -2.281 699 H GLU 113 H GLU 113 -16.001 -9.760 -3.918 700 HA GLU 113 HA GLU 113 -13.499 -8.441 -4.707 701 1HB GLU 113 1HB GLU 113 -16.232 -7.487 -3.828 702 2HB GLU 113 2HB GLU 113 -14.842 -6.394 -3.832 703 1HG GLU 113 1HG GLU 113 -15.533 -7.970 -6.216 704 2HG GLU 113 2HG GLU 113 -16.386 -6.454 -5.844 705 H MET 114 H MET 114 -11.909 -8.155 -3.364 706 HA MET 114 HA MET 114 -12.285 -7.671 -0.468 707 1HB MET 114 1HB MET 114 -10.550 -9.163 -1.186 708 2HB MET 114 2HB MET 114 -9.897 -8.033 -2.352 709 1HG MET 114 1HG MET 114 -9.993 -7.676 0.686 710 2HG MET 114 2HG MET 114 -8.615 -8.223 -0.265 711 1HE MET 114 1HE MET 114 -7.399 -4.810 1.154 712 2HE MET 114 2HE MET 114 -8.283 -6.169 1.894 713 3HE MET 114 3HE MET 114 -6.904 -6.482 0.824 714 H GLU 115 H GLU 115 -12.551 -5.486 -0.003 715 HA GLU 115 HA GLU 115 -10.937 -3.637 -1.536 716 1HB GLU 115 1HB GLU 115 -12.510 -1.922 -1.853 717 2HB GLU 115 2HB GLU 115 -13.298 -3.385 -2.434 718 1HG GLU 115 1HG GLU 115 -14.993 -2.317 -1.258 719 2HG GLU 115 2HG GLU 115 -14.417 -3.503 -0.083 720 H MET 116 H MET 116 -10.092 -1.994 -0.229 721 HA MET 116 HA MET 116 -11.170 -1.665 2.414 722 1HB MET 116 1HB MET 116 -8.266 -2.589 2.116 723 2HB MET 116 2HB MET 116 -8.910 -1.788 3.556 724 1HG MET 116 1HG MET 116 -10.632 -3.594 3.741 725 2HG MET 116 2HG MET 116 -9.794 -4.466 2.453 726 1HE MET 116 1HE MET 116 -10.522 -5.670 5.301 727 2HE MET 116 2HE MET 116 -9.718 -6.590 4.006 728 3HE MET 116 3HE MET 116 -9.030 -6.578 5.646 729 HA PRO 117 HA PRO 117 -9.306 2.391 1.445 730 1HB PRO 117 1HB PRO 117 -9.653 3.649 3.790 731 2HB PRO 117 2HB PRO 117 -10.990 3.387 2.626 732 1HG PRO 117 1HG PRO 117 -10.336 1.800 5.113 733 2HG PRO 117 2HG PRO 117 -11.905 2.388 4.479 734 1HD PRO 117 1HD PRO 117 -10.928 -0.199 4.125 735 2HD PRO 117 2HD PRO 117 -12.094 0.576 3.008 736 H VAL 118 H VAL 118 -7.224 3.056 1.751 737 HA VAL 118 HA VAL 118 -5.729 2.131 4.153 738 HB VAL 118 HB VAL 118 -4.728 2.387 1.293 739 1HG1 VAL 118 1HG1 VAL 118 -2.458 2.094 2.125 740 2HG1 VAL 118 2HG1 VAL 118 -3.120 3.602 2.760 741 3HG1 VAL 118 3HG1 VAL 118 -3.026 2.172 3.800 742 1HG2 VAL 118 1HG2 VAL 118 -3.864 0.127 1.733 743 2HG2 VAL 118 2HG2 VAL 118 -4.574 0.165 3.360 744 3HG2 VAL 118 3HG2 VAL 118 -5.624 0.198 1.927 745 H VAL 119 H VAL 119 -4.608 3.766 5.159 746 HA VAL 119 HA VAL 119 -5.318 6.532 4.364 747 HB VAL 119 HB VAL 119 -6.210 5.865 6.544 748 1HG1 VAL 119 1HG1 VAL 119 -4.576 4.132 7.190 749 2HG1 VAL 119 2HG1 VAL 119 -3.320 5.376 7.400 750 3HG1 VAL 119 3HG1 VAL 119 -4.746 5.355 8.444 751 1HG2 VAL 119 1HG2 VAL 119 -5.346 7.710 7.861 752 2HG2 VAL 119 2HG2 VAL 119 -3.893 7.815 6.851 753 3HG2 VAL 119 3HG2 VAL 119 -5.491 8.205 6.170 754 H PHE 120 H PHE 120 -3.559 8.032 4.181 755 HA PHE 120 HA PHE 120 -0.831 6.898 4.555 756 1HB PHE 120 1HB PHE 120 -1.844 6.465 2.203 757 2HB PHE 120 2HB PHE 120 -1.582 8.175 1.916 758 HD1 PHE 120 HD1 PHE 120 -0.169 4.974 1.594 759 HD2 PHE 120 HD2 PHE 120 0.932 9.044 2.488 760 HE1 PHE 120 HE1 PHE 120 2.140 4.620 0.739 761 HE2 PHE 120 HE2 PHE 120 3.315 8.369 2.475 762 HZ PHE 120 HZ PHE 120 3.940 6.180 1.478 763 H PHE 121 H PHE 121 0.642 8.354 5.247 764 HA PHE 121 HA PHE 121 0.770 10.896 4.044 765 1HB PHE 121 1HB PHE 121 0.997 12.121 6.248 766 2HB PHE 121 2HB PHE 121 -0.639 11.730 5.746 767 HD1 PHE 121 HD1 PHE 121 -1.839 9.766 6.788 768 HD2 PHE 121 HD2 PHE 121 1.848 11.323 8.387 769 HE1 PHE 121 HE1 PHE 121 -2.103 8.336 8.804 770 HE2 PHE 121 HE2 PHE 121 1.473 10.071 10.468 771 HZ PHE 121 HZ PHE 121 -0.436 8.465 10.627 772 H VAL 122 H VAL 122 2.930 11.879 4.662 773 HA VAL 122 HA VAL 122 4.931 9.782 5.431 774 HB VAL 122 HB VAL 122 5.214 12.397 3.909 775 1HG1 VAL 122 1HG1 VAL 122 7.282 11.903 5.110 776 2HG1 VAL 122 2HG1 VAL 122 7.263 10.226 4.532 777 3HG1 VAL 122 3HG1 VAL 122 7.520 11.565 3.395 778 1HG2 VAL 122 1HG2 VAL 122 4.067 10.761 2.508 779 2HG2 VAL 122 2HG2 VAL 122 5.727 10.956 1.941 780 3HG2 VAL 122 3HG2 VAL 122 5.286 9.530 2.898 781 H ASP 123 H ASP 123 6.029 10.142 7.414 782 HA ASP 123 HA ASP 123 5.271 12.552 8.879 783 1HB ASP 123 1HB ASP 123 6.648 10.007 9.627 784 2HB ASP 123 2HB ASP 123 6.990 11.463 10.563 785 HA PRO 124 HA PRO 124 8.837 14.718 7.291 786 1HB PRO 124 1HB PRO 124 8.740 17.009 8.803 787 2HB PRO 124 2HB PRO 124 7.626 16.564 7.505 788 1HG PRO 124 1HG PRO 124 7.190 16.291 10.474 789 2HG PRO 124 2HG PRO 124 6.027 16.830 9.212 790 1HD PRO 124 1HD PRO 124 6.091 14.265 10.231 791 2HD PRO 124 2HD PRO 124 5.497 14.711 8.602 792 H GLU 125 H GLU 125 9.761 12.650 8.648 793 HA GLU 125 HA GLU 125 11.954 13.703 10.337 794 1HB GLU 125 1HB GLU 125 12.278 10.966 10.307 795 2HB GLU 125 2HB GLU 125 11.642 11.964 11.612 796 1HG GLU 125 1HG GLU 125 9.382 11.683 10.860 797 2HG GLU 125 2HG GLU 125 9.951 10.803 9.416 798 H ILE 126 H ILE 126 11.130 11.984 7.369 799 HA ILE 126 HA ILE 126 13.424 10.884 6.633 800 HB ILE 126 HB ILE 126 11.293 10.608 5.557 801 1HG1 ILE 126 1HG1 ILE 126 13.383 11.451 3.506 802 2HG1 ILE 126 2HG1 ILE 126 13.524 10.015 4.526 803 1HG2 ILE 126 1HG2 ILE 126 10.362 12.099 3.917 804 2HG2 ILE 126 2HG2 ILE 126 10.613 13.036 5.389 805 3HG2 ILE 126 3HG2 ILE 126 11.741 13.197 4.027 806 1HD1 ILE 126 1HD1 ILE 126 12.622 9.338 2.452 807 2HD1 ILE 126 2HD1 ILE 126 11.344 9.191 3.682 808 3HD1 ILE 126 3HD1 ILE 126 11.313 10.540 2.516 809 H VAL 127 H VAL 127 12.781 14.350 5.948 810 HA VAL 127 HA VAL 127 15.364 14.578 4.525 811 HB VAL 127 HB VAL 127 14.736 17.011 4.388 812 1HG1 VAL 127 1HG1 VAL 127 12.787 15.029 3.180 813 2HG1 VAL 127 2HG1 VAL 127 13.136 16.675 2.617 814 3HG1 VAL 127 3HG1 VAL 127 14.399 15.433 2.554 815 1HG2 VAL 127 1HG2 VAL 127 11.978 16.098 5.328 816 2HG2 VAL 127 2HG2 VAL 127 13.104 17.046 6.325 817 3HG2 VAL 127 3HG2 VAL 127 12.475 17.712 4.810 818 H LYS 128 H LYS 128 16.050 13.583 6.830 819 HA LYS 128 HA LYS 128 17.443 15.831 8.163 820 1HB LYS 128 1HB LYS 128 15.835 13.840 9.783 821 2HB LYS 128 2HB LYS 128 16.975 15.029 10.414 822 1HG LYS 128 1HG LYS 128 15.600 16.857 9.484 823 2HG LYS 128 2HG LYS 128 14.493 15.670 8.769 824 1HD LYS 128 1HD LYS 128 13.854 14.809 10.912 825 2HD LYS 128 2HD LYS 128 14.934 15.936 11.753 826 1HE LYS 128 1HE LYS 128 13.655 17.832 11.187 827 2HE LYS 128 2HE LYS 128 12.914 17.063 9.777 828 1HZ LYS 128 1HZ LYS 128 11.464 15.876 11.061 829 2HZ LYS 128 2HZ LYS 128 12.233 16.202 12.499 830 3HZ LYS 128 3HZ LYS 128 11.423 17.377 11.670 831 HA PRO 129 HA PRO 129 20.174 12.222 9.164 832 1HB PRO 129 1HB PRO 129 19.620 9.588 8.720 833 2HB PRO 129 2HB PRO 129 18.985 10.478 10.134 834 1HG PRO 129 1HG PRO 129 17.592 10.017 7.475 835 2HG PRO 129 2HG PRO 129 16.974 9.663 9.110 836 1HD PRO 129 1HD PRO 129 16.269 11.942 7.938 837 2HD PRO 129 2HD PRO 129 16.747 11.911 9.660 838 H VAL 130 H VAL 130 21.879 11.195 8.090 839 HA VAL 130 HA VAL 130 22.426 11.879 5.451 840 HB VAL 130 HB VAL 130 23.642 9.765 7.269 841 1HG1 VAL 130 1HG1 VAL 130 24.342 9.335 4.970 842 2HG1 VAL 130 2HG1 VAL 130 24.710 11.059 4.731 843 3HG1 VAL 130 3HG1 VAL 130 25.673 10.079 5.860 844 1HG2 VAL 130 1HG2 VAL 130 23.730 12.053 8.241 845 2HG2 VAL 130 2HG2 VAL 130 25.332 11.536 7.712 846 3HG2 VAL 130 3HG2 VAL 130 24.401 12.674 6.719 847 H GLU 131 H GLU 131 21.132 8.890 6.851 848 HA GLU 131 HA GLU 131 21.364 7.018 4.837 849 1HB GLU 131 1HB GLU 131 19.055 7.565 6.758 850 2HB GLU 131 2HB GLU 131 19.274 6.050 5.873 851 1HG GLU 131 1HG GLU 131 21.217 5.464 7.085 852 2HG GLU 131 2HG GLU 131 21.500 7.098 7.685 853 H THR 132 H THR 132 18.542 9.258 5.193 854 HA THR 132 HA THR 132 17.695 8.420 2.530 855 HB THR 132 HB THR 132 15.743 10.059 3.283 856 HG1 THR 132 HG1 THR 132 16.072 10.834 5.236 857 1HG2 THR 132 1HG2 THR 132 16.335 7.395 4.669 858 2HG2 THR 132 2HG2 THR 132 14.738 8.148 4.523 859 3HG2 THR 132 3HG2 THR 132 15.573 7.595 3.075 860 H GLN 133 H GLN 133 18.797 11.336 4.191 861 HA GLN 133 HA GLN 133 18.645 13.544 3.265 862 1HB GLN 133 1HB GLN 133 20.891 12.327 3.978 863 2HB GLN 133 2HB GLN 133 21.302 12.439 2.301 864 1HG GLN 133 1HG GLN 133 22.237 14.339 3.409 865 2HG GLN 133 2HG GLN 133 20.909 14.942 2.417 866 1HE2 GLN 133 1HE2 GLN 133 19.806 13.290 5.327 867 2HE2 GLN 133 2HE2 GLN 133 19.647 14.700 6.323 868 H GLY 134 H GLY 134 16.964 13.088 1.462 869 1HA GLY 134 1HA GLY 134 17.255 14.439 -0.833 870 2HA GLY 134 2HA GLY 134 18.160 12.973 -1.249 871 H ILE 135 H ILE 135 16.646 11.034 0.180 872 HA ILE 135 HA ILE 135 14.567 10.493 -1.678 873 HB ILE 135 HB ILE 135 14.848 9.459 1.166 874 1HG1 ILE 135 1HG1 ILE 135 16.801 8.740 -0.012 875 2HG1 ILE 135 2HG1 ILE 135 15.650 7.403 -0.102 876 1HG2 ILE 135 1HG2 ILE 135 12.529 9.128 0.288 877 2HG2 ILE 135 2HG2 ILE 135 13.174 8.368 -1.154 878 3HG2 ILE 135 3HG2 ILE 135 13.416 7.616 0.432 879 1HD1 ILE 135 1HD1 ILE 135 14.951 8.206 -2.358 880 2HD1 ILE 135 2HD1 ILE 135 16.279 9.388 -2.295 881 3HD1 ILE 135 3HD1 ILE 135 16.631 7.638 -2.242 882 H LYS 136 H LYS 136 12.790 11.519 -2.054 883 HA LYS 136 HA LYS 136 10.883 11.581 0.073 884 1HB LYS 136 1HB LYS 136 10.166 13.924 -0.299 885 2HB LYS 136 2HB LYS 136 11.517 13.591 0.773 886 1HG LYS 136 1HG LYS 136 13.132 14.270 -0.931 887 2HG LYS 136 2HG LYS 136 11.819 14.540 -2.101 888 1HD LYS 136 1HD LYS 136 10.676 16.055 -0.424 889 2HD LYS 136 2HD LYS 136 12.034 15.826 0.673 890 1HE LYS 136 1HE LYS 136 13.518 17.032 -0.917 891 2HE LYS 136 2HE LYS 136 12.164 17.202 -2.054 892 1HZ LYS 136 1HZ LYS 136 10.996 18.532 -0.330 893 2HZ LYS 136 2HZ LYS 136 12.170 18.367 0.692 894 3HZ LYS 136 3HZ LYS 136 12.451 19.207 -0.694 895 H THR 137 H THR 137 10.618 9.854 -1.695 896 HA THR 137 HA THR 137 8.075 10.727 -2.490 897 HB THR 137 HB THR 137 9.533 9.174 -4.683 898 HG1 THR 137 HG1 THR 137 9.394 11.922 -4.201 899 1HG2 THR 137 1HG2 THR 137 6.900 10.622 -4.546 900 2HG2 THR 137 2HG2 THR 137 7.575 9.837 -5.992 901 3HG2 THR 137 3HG2 THR 137 7.145 8.865 -4.566 902 H LEU 138 H LEU 138 7.165 9.376 -1.053 903 HA LEU 138 HA LEU 138 8.547 6.861 -0.450 904 1HB LEU 138 1HB LEU 138 6.884 8.645 0.990 905 2HB LEU 138 2HB LEU 138 5.957 7.143 0.836 906 HG LEU 138 HG LEU 138 8.023 5.977 1.640 907 1HD1 LEU 138 1HD1 LEU 138 8.971 8.780 2.354 908 2HD1 LEU 138 2HD1 LEU 138 9.687 7.254 2.914 909 3HD1 LEU 138 3HD1 LEU 138 9.762 7.682 1.202 910 1HD2 LEU 138 1HD2 LEU 138 6.128 6.498 3.206 911 2HD2 LEU 138 2HD2 LEU 138 7.716 6.561 4.006 912 3HD2 LEU 138 3HD2 LEU 138 6.885 8.052 3.579 913 H THR 139 H THR 139 7.562 4.745 -0.578 914 HA THR 139 HA THR 139 5.332 4.455 -2.305 915 HB THR 139 HB THR 139 7.001 4.937 -4.034 916 HG1 THR 139 HG1 THR 139 5.581 3.405 -4.696 917 1HG2 THR 139 1HG2 THR 139 8.908 3.478 -4.393 918 2HG2 THR 139 2HG2 THR 139 8.992 4.298 -2.809 919 3HG2 THR 139 3HG2 THR 139 8.512 2.573 -2.916 920 H LEU 140 H LEU 140 5.389 2.061 -3.021 921 HA LEU 140 HA LEU 140 5.817 0.204 -0.817 922 1HB LEU 140 1HB LEU 140 3.820 1.290 0.031 923 2HB LEU 140 2HB LEU 140 3.170 1.513 -1.591 924 HG LEU 140 HG LEU 140 2.739 -0.996 -1.710 925 1HD1 LEU 140 1HD1 LEU 140 4.337 -1.607 0.163 926 2HD1 LEU 140 2HD1 LEU 140 3.166 -0.838 1.271 927 3HD1 LEU 140 3HD1 LEU 140 2.691 -2.260 0.319 928 1HD2 LEU 140 1HD2 LEU 140 1.375 0.652 0.450 929 2HD2 LEU 140 2HD2 LEU 140 0.977 0.632 -1.280 930 3HD2 LEU 140 3HD2 LEU 140 0.728 -0.821 -0.297 931 H SER 141 H SER 141 6.860 -1.100 -2.435 932 HA SER 141 HA SER 141 5.424 -1.653 -4.978 933 1HB SER 141 1HB SER 141 7.959 -1.418 -4.829 934 2HB SER 141 2HB SER 141 7.920 -3.052 -4.134 935 HG SER 141 HG SER 141 6.867 -2.230 -6.648 936 H TYR 142 H TYR 142 3.547 -2.441 -4.287 937 HA TYR 142 HA TYR 142 3.404 -4.685 -2.401 938 1HB TYR 142 1HB TYR 142 1.613 -2.700 -3.217 939 2HB TYR 142 2HB TYR 142 1.029 -4.104 -4.091 940 HD1 TYR 142 HD1 TYR 142 -0.331 -2.435 -1.860 941 HD2 TYR 142 HD2 TYR 142 1.728 -6.226 -1.877 942 HE1 TYR 142 HE1 TYR 142 -1.408 -3.046 0.289 943 HE2 TYR 142 HE2 TYR 142 0.732 -6.776 0.314 944 HH TYR 142 HH TYR 142 -0.400 -5.859 2.188 945 H THR 143 H THR 143 3.650 -6.768 -3.110 946 HA THR 143 HA THR 143 3.786 -7.240 -6.054 947 HB THR 143 HB THR 143 5.864 -8.013 -3.994 948 HG1 THR 143 HG1 THR 143 5.891 -5.773 -4.267 949 1HG2 THR 143 1HG2 THR 143 5.995 -9.492 -5.860 950 2HG2 THR 143 2HG2 THR 143 5.652 -8.194 -7.032 951 3HG2 THR 143 3HG2 THR 143 7.211 -8.251 -6.179 952 H PHE 144 H PHE 144 2.013 -8.361 -6.247 953 HA PHE 144 HA PHE 144 1.013 -10.283 -4.384 954 1HB PHE 144 1HB PHE 144 0.354 -9.251 -7.122 955 2HB PHE 144 2HB PHE 144 -0.492 -10.616 -6.508 956 HD1 PHE 144 HD1 PHE 144 -2.698 -9.595 -6.500 957 HD2 PHE 144 HD2 PHE 144 0.525 -7.694 -4.339 958 HE1 PHE 144 HE1 PHE 144 -4.323 -8.555 -4.958 959 HE2 PHE 144 HE2 PHE 144 -1.117 -6.653 -2.827 960 HZ PHE 144 HZ PHE 144 -3.538 -7.107 -3.105 961 H TYR 145 H TYR 145 3.061 -11.555 -4.274 962 HA TYR 145 HA TYR 145 2.922 -13.867 -6.206 963 1HB TYR 145 1HB TYR 145 5.301 -12.459 -4.986 964 2HB TYR 145 2HB TYR 145 5.395 -14.089 -5.625 965 HD1 TYR 145 HD1 TYR 145 4.277 -10.682 -6.693 966 HD2 TYR 145 HD2 TYR 145 5.866 -14.491 -7.862 967 HE1 TYR 145 HE1 TYR 145 5.060 -9.690 -8.851 968 HE2 TYR 145 HE2 TYR 145 6.553 -13.547 -10.050 969 HH TYR 145 HH TYR 145 6.709 -11.640 -11.346 970 HA PRO 146 HA PRO 146 2.620 -16.061 -2.238 971 1HB PRO 146 1HB PRO 146 0.004 -16.668 -1.974 972 2HB PRO 146 2HB PRO 146 0.672 -15.081 -1.530 973 1HG PRO 146 1HG PRO 146 -0.773 -15.728 -4.109 974 2HG PRO 146 2HG PRO 146 -1.013 -14.386 -2.971 975 1HD PRO 146 1HD PRO 146 0.618 -14.212 -5.241 976 2HD PRO 146 2HD PRO 146 0.860 -13.247 -3.754 977 H ARG 147 H ARG 147 -0.079 -17.520 -3.868 978 HA ARG 147 HA ARG 147 1.482 -19.422 -5.422 979 1HB ARG 147 1HB ARG 147 0.234 -21.246 -3.850 980 2HB ARG 147 2HB ARG 147 1.919 -20.759 -3.674 981 1HG ARG 147 1HG ARG 147 1.523 -19.389 -1.838 982 2HG ARG 147 2HG ARG 147 -0.217 -19.269 -2.132 983 1HD ARG 147 1HD ARG 147 0.988 -21.979 -1.564 984 2HD ARG 147 2HD ARG 147 0.765 -20.818 -0.236 985 HE ARG 147 HE ARG 147 -1.676 -20.824 -1.607 986 1HH1 ARG 147 1HH1 ARG 147 0.212 -23.204 0.173 987 2HH1 ARG 147 2HH1 ARG 147 -1.149 -23.860 1.035 988 1HH2 ARG 147 1HH2 ARG 147 -3.391 -21.489 -0.427 989 2HH2 ARG 147 2HH2 ARG 147 -3.339 -22.901 0.614 990 H GLU 148 H GLU 148 0.256 -19.039 -7.130 991 HA GLU 148 HA GLU 148 -2.639 -19.685 -7.083 992 1HB GLU 148 1HB GLU 148 -2.021 -17.507 -7.974 993 2HB GLU 148 2HB GLU 148 -0.942 -18.231 -9.159 994 1HG GLU 148 1HG GLU 148 -3.890 -18.996 -9.146 995 2HG GLU 148 2HG GLU 148 -3.379 -17.419 -9.759 996 HA PRO 149 HA PRO 149 -0.874 -23.427 -8.985 997 1HB PRO 149 1HB PRO 149 -3.132 -24.893 -9.370 998 2HB PRO 149 2HB PRO 149 -2.456 -24.570 -7.750 999 1HG PRO 149 1HG PRO 149 -4.773 -23.170 -9.095 1000 2HG PRO 149 2HG PRO 149 -4.645 -23.735 -7.413 1001 1HD PRO 149 1HD PRO 149 -4.161 -21.120 -8.179 1002 2HD PRO 149 2HD PRO 149 -3.370 -21.891 -6.774 1003 H SER 150 H SER 150 -3.762 -21.956 -10.390 1004 HA SER 150 HA SER 150 -3.005 -21.090 -12.824 1005 1HB SER 150 1HB SER 150 -2.336 -23.378 -13.545 1006 2HB SER 150 2HB SER 150 -3.951 -23.979 -13.115 1007 HG SER 150 HG SER 150 -3.296 -22.012 -15.069 1008 H LYS 151 H LYS 151 -4.722 -19.622 -12.603 1009 HA LYS 151 HA LYS 151 -7.021 -20.260 -11.184 1010 1HB LYS 151 1HB LYS 151 -7.971 -18.100 -12.084 1011 2HB LYS 151 2HB LYS 151 -6.454 -18.028 -11.194 1012 1HG LYS 151 1HG LYS 151 -5.177 -17.544 -13.115 1013 2HG LYS 151 2HG LYS 151 -6.445 -18.041 -14.244 1014 1HD LYS 151 1HD LYS 151 -7.748 -16.137 -13.871 1015 2HD LYS 151 2HD LYS 151 -7.121 -15.954 -12.244 1016 1HE LYS 151 1HE LYS 151 -4.920 -15.173 -13.154 1017 2HE LYS 151 2HE LYS 151 -5.676 -15.125 -14.756 1018 1HZ LYS 151 1HZ LYS 151 -5.778 -12.986 -13.692 1019 2HZ LYS 151 2HZ LYS 151 -7.309 -13.574 -13.795 1020 3HZ LYS 151 3HZ LYS 151 -6.520 -13.562 -12.357
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