NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
27902 | 2uz5 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 PHE 1 H1 PHE 1 -25.558 8.846 1.123 2 H2 PHE 1 H2 PHE 1 -25.959 8.966 2.763 3 H3 PHE 1 H3 PHE 1 -25.820 10.363 1.820 4 HA PHE 1 HA PHE 1 -23.473 9.966 1.502 5 1HB PHE 1 1HB PHE 1 -24.270 11.324 3.423 6 2HB PHE 1 2HB PHE 1 -24.273 9.874 4.421 7 HD1 PHE 1 HD1 PHE 1 -22.088 12.146 2.481 8 HD2 PHE 1 HD2 PHE 1 -22.317 9.123 5.467 9 HE1 PHE 1 HE1 PHE 1 -19.730 12.546 3.061 10 HE2 PHE 1 HE2 PHE 1 -19.960 9.517 6.052 11 HZ PHE 1 HZ PHE 1 -18.664 11.231 4.849 12 H ASN 2 H ASN 2 -24.784 7.722 3.947 13 HA ASN 2 HA ASN 2 -22.473 6.057 3.939 14 1HB ASN 2 1HB ASN 2 -23.860 4.498 5.265 15 2HB ASN 2 2HB ASN 2 -23.956 6.154 5.882 16 1HD2 ASN 2 1HD2 ASN 2 -25.860 7.317 5.622 17 2HD2 ASN 2 2HD2 ASN 2 -27.358 6.551 5.229 18 H LYS 3 H LYS 3 -25.235 6.275 1.895 19 HA LYS 3 HA LYS 3 -25.435 3.646 0.977 20 1HB LYS 3 1HB LYS 3 -26.379 4.618 -1.091 21 2HB LYS 3 2HB LYS 3 -27.075 5.331 0.357 22 1HG LYS 3 1HG LYS 3 -25.694 7.296 0.098 23 2HG LYS 3 2HG LYS 3 -24.889 6.576 -1.297 24 1HD LYS 3 1HD LYS 3 -27.029 6.524 -2.495 25 2HD LYS 3 2HD LYS 3 -27.820 7.263 -1.101 26 1HE LYS 3 1HE LYS 3 -27.320 8.919 -2.827 27 2HE LYS 3 2HE LYS 3 -26.425 9.244 -1.343 28 1HZ LYS 3 1HZ LYS 3 -25.319 7.876 -3.735 29 2HZ LYS 3 2HZ LYS 3 -25.048 9.495 -3.329 30 3HZ LYS 3 3HZ LYS 3 -24.467 8.262 -2.326 31 H LYS 4 H LYS 4 -23.278 6.271 0.063 32 HA LYS 4 HA LYS 4 -21.969 4.745 -1.997 33 1HB LYS 4 1HB LYS 4 -22.134 7.187 -2.161 34 2HB LYS 4 2HB LYS 4 -21.198 7.359 -0.683 35 1HG LYS 4 1HG LYS 4 -19.256 6.402 -1.758 36 2HG LYS 4 2HG LYS 4 -20.187 6.101 -3.226 37 1HD LYS 4 1HD LYS 4 -18.850 8.095 -3.508 38 2HD LYS 4 2HD LYS 4 -20.558 8.532 -3.451 39 1HE LYS 4 1HE LYS 4 -19.214 10.087 -2.135 40 2HE LYS 4 2HE LYS 4 -20.320 9.179 -1.105 41 1HZ LYS 4 1HZ LYS 4 -18.487 7.720 -0.493 42 2HZ LYS 4 2HZ LYS 4 -17.429 8.600 -1.476 43 3HZ LYS 4 3HZ LYS 4 -18.124 9.329 -0.119 44 H ALA 5 H ALA 5 -21.394 5.574 1.373 45 HA ALA 5 HA ALA 5 -18.749 4.725 1.617 46 1HB ALA 5 1HB ALA 5 -19.512 5.856 3.474 47 2HB ALA 5 2HB ALA 5 -19.523 4.186 4.047 48 3HB ALA 5 3HB ALA 5 -21.027 4.952 3.533 49 H ASP 6 H ASP 6 -21.752 2.914 2.205 50 HA ASP 6 HA ASP 6 -20.475 0.429 2.643 51 1HB ASP 6 1HB ASP 6 -23.311 1.072 1.806 52 2HB ASP 6 2HB ASP 6 -22.758 -0.537 2.256 53 H GLU 7 H GLU 7 -21.678 2.072 -0.211 54 HA GLU 7 HA GLU 7 -21.607 -0.019 -2.047 55 1HB GLU 7 1HB GLU 7 -22.486 2.228 -2.566 56 2HB GLU 7 2HB GLU 7 -20.855 2.880 -2.498 57 1HG GLU 7 1HG GLU 7 -20.219 1.471 -4.396 58 2HG GLU 7 2HG GLU 7 -21.866 0.845 -4.472 59 H ASN 8 H ASN 8 -19.083 1.894 -0.612 60 HA ASN 8 HA ASN 8 -16.989 0.972 -2.320 61 1HB ASN 8 1HB ASN 8 -16.763 2.206 0.434 62 2HB ASN 8 2HB ASN 8 -15.485 2.112 -0.806 63 1HD2 ASN 8 1HD2 ASN 8 -16.660 4.418 0.562 64 2HD2 ASN 8 2HD2 ASN 8 -17.255 5.453 -0.685 65 H LYS 9 H LYS 9 -18.257 0.090 0.837 66 HA LYS 9 HA LYS 9 -16.290 -1.678 1.682 67 1HB LYS 9 1HB LYS 9 -18.137 -0.947 3.109 68 2HB LYS 9 2HB LYS 9 -19.279 -1.836 2.114 69 1HG LYS 9 1HG LYS 9 -18.869 -3.102 4.088 70 2HG LYS 9 2HG LYS 9 -18.101 -3.934 2.735 71 1HD LYS 9 1HD LYS 9 -15.942 -2.948 3.374 72 2HD LYS 9 2HD LYS 9 -16.721 -2.150 4.742 73 1HE LYS 9 1HE LYS 9 -16.475 -5.122 4.286 74 2HE LYS 9 2HE LYS 9 -15.606 -4.166 5.486 75 1HZ LYS 9 1HZ LYS 9 -17.723 -3.651 6.543 76 2HZ LYS 9 2HZ LYS 9 -18.545 -4.588 5.398 77 3HZ LYS 9 3HZ LYS 9 -17.471 -5.322 6.478 78 H VAL 10 H VAL 10 -19.021 -2.245 -0.503 79 HA VAL 10 HA VAL 10 -18.527 -5.069 -0.670 80 HB VAL 10 HB VAL 10 -20.212 -5.009 -2.522 81 1HG1 VAL 10 1HG1 VAL 10 -20.996 -3.738 0.103 82 2HG1 VAL 10 2HG1 VAL 10 -22.109 -4.518 -1.041 83 3HG1 VAL 10 3HG1 VAL 10 -20.856 -5.477 -0.227 84 1HG2 VAL 10 1HG2 VAL 10 -20.362 -2.090 -1.779 85 2HG2 VAL 10 2HG2 VAL 10 -19.840 -2.751 -3.328 86 3HG2 VAL 10 3HG2 VAL 10 -21.514 -2.940 -2.808 87 H LYS 11 H LYS 11 -18.027 -2.325 -2.905 88 HA LYS 11 HA LYS 11 -16.984 -3.883 -5.008 89 1HB LYS 11 1HB LYS 11 -16.198 -1.801 -5.965 90 2HB LYS 11 2HB LYS 11 -17.811 -1.583 -5.304 91 1HG LYS 11 1HG LYS 11 -16.781 -0.582 -3.279 92 2HG LYS 11 2HG LYS 11 -15.215 -0.679 -4.086 93 1HD LYS 11 1HD LYS 11 -17.615 0.817 -5.138 94 2HD LYS 11 2HD LYS 11 -16.262 1.554 -4.280 95 1HE LYS 11 1HE LYS 11 -14.736 0.795 -6.036 96 2HE LYS 11 2HE LYS 11 -16.087 0.051 -6.891 97 1HZ LYS 11 1HZ LYS 11 -17.086 2.250 -7.125 98 2HZ LYS 11 2HZ LYS 11 -15.765 2.951 -6.336 99 3HZ LYS 11 3HZ LYS 11 -15.553 2.196 -7.836 100 H GLY 12 H GLY 12 -15.458 -2.454 -2.186 101 1HA GLY 12 1HA GLY 12 -13.248 -2.443 -1.486 102 2HA GLY 12 2HA GLY 12 -12.776 -2.921 -3.110 103 H GLU 13 H GLU 13 -14.783 -4.422 -0.570 104 HA GLU 13 HA GLU 13 -12.985 -6.432 0.135 105 1HB GLU 13 1HB GLU 13 -15.031 -5.843 1.417 106 2HB GLU 13 2HB GLU 13 -16.003 -6.602 0.164 107 1HG GLU 13 1HG GLU 13 -14.960 -8.749 0.635 108 2HG GLU 13 2HG GLU 13 -13.953 -7.997 1.870 109 H ALA 14 H ALA 14 -15.073 -6.113 -2.594 110 HA ALA 14 HA ALA 14 -15.004 -8.889 -3.348 111 1HB ALA 14 1HB ALA 14 -16.890 -7.436 -3.966 112 2HB ALA 14 2HB ALA 14 -16.127 -8.167 -5.378 113 3HB ALA 14 3HB ALA 14 -15.807 -6.479 -4.977 114 H PHE 15 H PHE 15 -13.330 -5.922 -4.298 115 HA PHE 15 HA PHE 15 -11.884 -6.951 -6.453 116 1HB PHE 15 1HB PHE 15 -11.674 -4.664 -6.358 117 2HB PHE 15 2HB PHE 15 -11.546 -4.646 -4.586 118 HD1 PHE 15 HD1 PHE 15 -9.529 -4.024 -3.720 119 HD2 PHE 15 HD2 PHE 15 -9.607 -5.939 -7.519 120 HE1 PHE 15 HE1 PHE 15 -7.084 -3.779 -3.888 121 HE2 PHE 15 HE2 PHE 15 -7.163 -5.707 -7.690 122 HZ PHE 15 HZ PHE 15 -5.898 -4.629 -5.870 123 H LEU 16 H LEU 16 -11.013 -6.752 -3.007 124 HA LEU 16 HA LEU 16 -8.508 -8.033 -3.328 125 1HB LEU 16 1HB LEU 16 -8.439 -8.191 -0.936 126 2HB LEU 16 2HB LEU 16 -9.064 -6.624 -1.402 127 HG LEU 16 HG LEU 16 -11.399 -7.806 -1.041 128 1HD1 LEU 16 1HD1 LEU 16 -9.518 -9.412 0.681 129 2HD1 LEU 16 2HD1 LEU 16 -11.265 -9.341 0.909 130 3HD1 LEU 16 3HD1 LEU 16 -10.597 -10.018 -0.575 131 1HD2 LEU 16 1HD2 LEU 16 -9.594 -6.788 1.146 132 2HD2 LEU 16 2HD2 LEU 16 -10.705 -5.844 0.153 133 3HD2 LEU 16 3HD2 LEU 16 -11.336 -7.014 1.310 134 H THR 17 H THR 17 -11.759 -9.210 -2.730 135 HA THR 17 HA THR 17 -11.177 -11.829 -1.964 136 HB THR 17 HB THR 17 -13.527 -10.698 -3.489 137 HG1 THR 17 HG1 THR 17 -13.180 -11.601 -0.805 138 1HG2 THR 17 1HG2 THR 17 -13.157 -13.506 -2.422 139 2HG2 THR 17 2HG2 THR 17 -14.697 -12.824 -2.982 140 3HG2 THR 17 3HG2 THR 17 -13.353 -13.034 -4.121 141 H GLU 18 H GLU 18 -11.737 -10.487 -5.202 142 HA GLU 18 HA GLU 18 -11.126 -12.938 -6.544 143 1HB GLU 18 1HB GLU 18 -11.285 -10.107 -7.600 144 2HB GLU 18 2HB GLU 18 -11.168 -11.552 -8.595 145 1HG GLU 18 1HG GLU 18 -13.426 -10.914 -6.709 146 2HG GLU 18 2HG GLU 18 -13.454 -10.691 -8.458 147 H ASN 19 H ASN 19 -9.371 -10.113 -5.537 148 HA ASN 19 HA ASN 19 -7.075 -10.259 -7.073 149 1HB ASN 19 1HB ASN 19 -7.162 -8.362 -5.753 150 2HB ASN 19 2HB ASN 19 -7.679 -9.253 -4.321 151 1HD2 ASN 19 1HD2 ASN 19 -6.104 -10.596 -3.266 152 2HD2 ASN 19 2HD2 ASN 19 -4.435 -10.174 -3.325 153 H LYS 20 H LYS 20 -8.025 -12.155 -4.290 154 HA LYS 20 HA LYS 20 -5.698 -13.272 -3.416 155 1HB LYS 20 1HB LYS 20 -8.373 -14.613 -3.807 156 2HB LYS 20 2HB LYS 20 -7.053 -15.301 -2.870 157 1HG LYS 20 1HG LYS 20 -7.161 -13.533 -1.277 158 2HG LYS 20 2HG LYS 20 -8.293 -12.625 -2.282 159 1HD LYS 20 1HD LYS 20 -9.993 -14.300 -1.966 160 2HD LYS 20 2HD LYS 20 -8.864 -15.335 -1.089 161 1HE LYS 20 1HE LYS 20 -8.662 -13.593 0.647 162 2HE LYS 20 2HE LYS 20 -9.851 -12.620 -0.218 163 1HZ LYS 20 1HZ LYS 20 -10.348 -15.327 0.897 164 2HZ LYS 20 2HZ LYS 20 -10.844 -13.873 1.607 165 3HZ LYS 20 3HZ LYS 20 -11.485 -14.348 0.115 166 H ASN 21 H ASN 21 -7.072 -13.684 -6.532 167 HA ASN 21 HA ASN 21 -6.020 -16.236 -7.152 168 1HB ASN 21 1HB ASN 21 -6.873 -13.942 -8.919 169 2HB ASN 21 2HB ASN 21 -6.401 -15.524 -9.533 170 1HD2 ASN 21 1HD2 ASN 21 -8.177 -14.889 -6.572 171 2HD2 ASN 21 2HD2 ASN 21 -9.637 -15.663 -7.069 172 H LYS 22 H LYS 22 -4.704 -12.984 -7.362 173 HA LYS 22 HA LYS 22 -2.536 -13.349 -9.029 174 1HB LYS 22 1HB LYS 22 -2.663 -11.715 -6.490 175 2HB LYS 22 2HB LYS 22 -1.438 -11.546 -7.738 176 1HG LYS 22 1HG LYS 22 -3.144 -10.877 -9.343 177 2HG LYS 22 2HG LYS 22 -4.388 -11.071 -8.107 178 1HD LYS 22 1HD LYS 22 -3.315 -9.336 -6.755 179 2HD LYS 22 2HD LYS 22 -2.072 -9.141 -7.991 180 1HE LYS 22 1HE LYS 22 -5.025 -8.663 -8.374 181 2HE LYS 22 2HE LYS 22 -3.804 -7.412 -8.149 182 1HZ LYS 22 1HZ LYS 22 -2.739 -8.141 -10.196 183 2HZ LYS 22 2HZ LYS 22 -3.917 -9.333 -10.410 184 3HZ LYS 22 3HZ LYS 22 -4.346 -7.697 -10.480 185 HA PRO 23 HA PRO 23 -0.323 -16.602 -6.845 186 1HB PRO 23 1HB PRO 23 1.999 -16.331 -8.328 187 2HB PRO 23 2HB PRO 23 0.614 -17.329 -8.788 188 1HG PRO 23 1HG PRO 23 1.341 -14.568 -9.678 189 2HG PRO 23 2HG PRO 23 0.693 -15.920 -10.627 190 1HD PRO 23 1HD PRO 23 -0.872 -13.896 -9.841 191 2HD PRO 23 2HD PRO 23 -1.477 -15.568 -9.872 192 H GLY 24 H GLY 24 1.199 -16.660 -5.226 193 1HA GLY 24 1HA GLY 24 3.054 -14.450 -4.897 194 2HA GLY 24 2HA GLY 24 3.003 -15.917 -3.941 195 H VAL 25 H VAL 25 -0.121 -14.883 -3.939 196 HA VAL 25 HA VAL 25 -0.140 -12.662 -2.247 197 HB VAL 25 HB VAL 25 -2.120 -14.916 -2.541 198 1HG1 VAL 25 1HG1 VAL 25 -2.299 -12.488 -0.759 199 2HG1 VAL 25 2HG1 VAL 25 -3.695 -13.457 -1.242 200 3HG1 VAL 25 3HG1 VAL 25 -2.405 -14.184 -0.280 201 1HG2 VAL 25 1HG2 VAL 25 -1.643 -13.006 -4.274 202 2HG2 VAL 25 2HG2 VAL 25 -3.298 -13.504 -3.917 203 3HG2 VAL 25 3HG2 VAL 25 -2.633 -12.049 -3.171 204 H VAL 26 H VAL 26 0.917 -12.473 -0.408 205 HA VAL 26 HA VAL 26 0.815 -14.700 1.517 206 HB VAL 26 HB VAL 26 3.058 -14.606 0.628 207 1HG1 VAL 26 1HG1 VAL 26 2.905 -12.237 -0.144 208 2HG1 VAL 26 2HG1 VAL 26 3.212 -11.739 1.521 209 3HG1 VAL 26 3HG1 VAL 26 4.430 -12.661 0.637 210 1HG2 VAL 26 1HG2 VAL 26 2.719 -15.007 3.068 211 2HG2 VAL 26 2HG2 VAL 26 4.313 -14.365 2.651 212 3HG2 VAL 26 3HG2 VAL 26 3.083 -13.299 3.343 213 H VAL 27 H VAL 27 -0.002 -14.189 3.440 214 HA VAL 27 HA VAL 27 -0.720 -11.448 3.996 215 HB VAL 27 HB VAL 27 -2.341 -13.169 4.522 216 1HG1 VAL 27 1HG1 VAL 27 -0.800 -15.013 4.934 217 2HG1 VAL 27 2HG1 VAL 27 -0.288 -14.256 6.443 218 3HG1 VAL 27 3HG1 VAL 27 -1.944 -14.833 6.264 219 1HG2 VAL 27 1HG2 VAL 27 -2.298 -11.159 5.930 220 2HG2 VAL 27 2HG2 VAL 27 -2.855 -12.572 6.826 221 3HG2 VAL 27 3HG2 VAL 27 -1.211 -11.976 7.053 222 H LEU 28 H LEU 28 0.031 -10.175 5.655 223 HA LEU 28 HA LEU 28 2.575 -11.025 6.849 224 1HB LEU 28 1HB LEU 28 1.405 -8.268 6.469 225 2HB LEU 28 2HB LEU 28 2.947 -8.599 7.229 226 HG LEU 28 HG LEU 28 2.217 -9.070 4.343 227 1HD1 LEU 28 1HD1 LEU 28 4.159 -7.196 5.681 228 2HD1 LEU 28 2HD1 LEU 28 4.009 -7.430 3.939 229 3HD1 LEU 28 3HD1 LEU 28 2.662 -6.756 4.858 230 1HD2 LEU 28 1HD2 LEU 28 4.739 -9.763 5.847 231 2HD2 LEU 28 2HD2 LEU 28 3.635 -10.883 5.049 232 3HD2 LEU 28 3HD2 LEU 28 4.592 -9.754 4.088 233 HA PRO 29 HA PRO 29 1.255 -11.010 11.077 234 1HB PRO 29 1HB PRO 29 2.843 -8.531 11.572 235 2HB PRO 29 2HB PRO 29 2.839 -10.059 12.461 236 1HG PRO 29 1HG PRO 29 4.836 -9.462 10.808 237 2HG PRO 29 2HG PRO 29 4.206 -11.116 10.913 238 1HD PRO 29 1HD PRO 29 3.800 -9.059 8.792 239 2HD PRO 29 2HD PRO 29 3.924 -10.832 8.648 240 H SER 30 H SER 30 1.270 -7.869 9.466 241 HA SER 30 HA SER 30 -0.801 -6.814 11.186 242 1HB SER 30 1HB SER 30 0.685 -5.702 8.813 243 2HB SER 30 2HB SER 30 -0.675 -4.852 9.548 244 HG SER 30 HG SER 30 0.545 -5.073 11.572 245 H GLY 31 H GLY 31 -0.699 -8.739 8.407 246 1HA GLY 31 1HA GLY 31 -3.569 -8.262 8.034 247 2HA GLY 31 2HA GLY 31 -2.744 -9.765 7.658 248 H LEU 32 H LEU 32 -0.608 -7.826 6.374 249 HA LEU 32 HA LEU 32 -2.090 -6.828 4.096 250 1HB LEU 32 1HB LEU 32 0.808 -6.775 4.855 251 2HB LEU 32 2HB LEU 32 0.246 -6.228 3.284 252 HG LEU 32 HG LEU 32 -1.386 -4.755 4.690 253 1HD1 LEU 32 1HD1 LEU 32 -0.356 -6.016 6.778 254 2HD1 LEU 32 2HD1 LEU 32 0.815 -4.702 6.666 255 3HD1 LEU 32 3HD1 LEU 32 -0.901 -4.341 6.858 256 1HD2 LEU 32 1HD2 LEU 32 0.640 -4.136 3.219 257 2HD2 LEU 32 2HD2 LEU 32 0.042 -2.963 4.391 258 3HD2 LEU 32 3HD2 LEU 32 1.482 -3.912 4.753 259 H GLN 33 H GLN 33 -2.258 -7.667 2.149 260 HA GLN 33 HA GLN 33 -0.749 -10.117 1.506 261 1HB GLN 33 1HB GLN 33 -3.538 -9.283 0.680 262 2HB GLN 33 2HB GLN 33 -2.673 -10.626 -0.049 263 1HG GLN 33 1HG GLN 33 -4.108 -11.584 1.534 264 2HG GLN 33 2HG GLN 33 -2.486 -11.603 2.278 265 1HE2 GLN 33 1HE2 GLN 33 -4.423 -8.712 1.980 266 2HE2 GLN 33 2HE2 GLN 33 -4.760 -8.526 3.664 267 H TYR 34 H TYR 34 0.186 -10.229 -0.559 268 HA TYR 34 HA TYR 34 -0.243 -8.113 -2.464 269 1HB TYR 34 1HB TYR 34 2.144 -7.346 -2.426 270 2HB TYR 34 2HB TYR 34 1.196 -6.880 -1.019 271 HD1 TYR 34 HD1 TYR 34 4.049 -8.775 -2.219 272 HD2 TYR 34 HD2 TYR 34 1.554 -8.042 1.147 273 HE1 TYR 34 HE1 TYR 34 5.737 -9.778 -0.752 274 HE2 TYR 34 HE2 TYR 34 3.234 -9.043 2.616 275 HH TYR 34 HH TYR 34 5.112 -10.581 2.506 276 H LYS 35 H LYS 35 1.482 -8.219 -4.253 277 HA LYS 35 HA LYS 35 2.156 -11.053 -4.762 278 1HB LYS 35 1HB LYS 35 0.300 -10.141 -6.187 279 2HB LYS 35 2HB LYS 35 1.433 -8.961 -6.830 280 1HG LYS 35 1HG LYS 35 2.219 -11.810 -6.998 281 2HG LYS 35 2HG LYS 35 0.902 -11.265 -8.048 282 1HD LYS 35 1HD LYS 35 2.349 -9.489 -8.923 283 2HD LYS 35 2HD LYS 35 3.657 -10.033 -7.871 284 1HE LYS 35 1HE LYS 35 3.716 -12.176 -9.014 285 2HE LYS 35 2HE LYS 35 2.352 -11.700 -10.023 286 1HZ LYS 35 1HZ LYS 35 5.006 -10.365 -9.990 287 2HZ LYS 35 2HZ LYS 35 4.472 -11.449 -11.173 288 3HZ LYS 35 3HZ LYS 35 3.701 -9.955 -10.984 289 H VAL 36 H VAL 36 4.244 -11.380 -4.769 290 HA VAL 36 HA VAL 36 6.126 -9.225 -4.836 291 HB VAL 36 HB VAL 36 6.602 -12.201 -4.752 292 1HG1 VAL 36 1HG1 VAL 36 8.445 -9.872 -4.244 293 2HG1 VAL 36 2HG1 VAL 36 8.815 -11.544 -3.821 294 3HG1 VAL 36 3HG1 VAL 36 8.587 -11.091 -5.510 295 1HG2 VAL 36 1HG2 VAL 36 6.245 -10.133 -2.605 296 2HG2 VAL 36 2HG2 VAL 36 5.376 -11.650 -2.823 297 3HG2 VAL 36 3HG2 VAL 36 7.063 -11.667 -2.308 298 H ILE 37 H ILE 37 7.139 -8.415 -6.495 299 HA ILE 37 HA ILE 37 7.228 -9.888 -9.032 300 HB ILE 37 HB ILE 37 7.875 -6.976 -8.508 301 1HG1 ILE 37 1HG1 ILE 37 5.393 -8.153 -9.777 302 2HG1 ILE 37 2HG1 ILE 37 5.476 -7.611 -8.104 303 1HG2 ILE 37 1HG2 ILE 37 9.001 -7.933 -10.467 304 2HG2 ILE 37 2HG2 ILE 37 7.440 -8.454 -11.102 305 3HG2 ILE 37 3HG2 ILE 37 7.791 -6.734 -10.927 306 1HD1 ILE 37 1HD1 ILE 37 5.926 -5.876 -10.521 307 2HD1 ILE 37 2HD1 ILE 37 4.442 -5.954 -9.570 308 3HD1 ILE 37 3HD1 ILE 37 5.928 -5.348 -8.839 309 H ASN 38 H ASN 38 9.347 -7.689 -7.174 310 HA ASN 38 HA ASN 38 11.591 -9.535 -7.628 311 1HB ASN 38 1HB ASN 38 11.820 -7.699 -9.245 312 2HB ASN 38 2HB ASN 38 11.682 -6.521 -7.943 313 1HD2 ASN 38 1HD2 ASN 38 13.662 -5.605 -8.220 314 2HD2 ASN 38 2HD2 ASN 38 15.148 -6.431 -7.911 315 H SER 39 H SER 39 11.766 -10.279 -5.549 316 HA SER 39 HA SER 39 11.789 -8.299 -3.379 317 1HB SER 39 1HB SER 39 11.517 -10.267 -1.872 318 2HB SER 39 2HB SER 39 10.199 -10.076 -3.026 319 HG SER 39 HG SER 39 10.632 -12.058 -3.549 320 H GLY 40 H GLY 40 13.430 -8.159 -1.894 321 1HA GLY 40 1HA GLY 40 15.789 -9.852 -2.230 322 2HA GLY 40 2HA GLY 40 15.470 -8.775 -0.881 323 H ASN 41 H ASN 41 17.520 -9.256 -3.243 324 HA ASN 41 HA ASN 41 19.031 -8.075 -4.418 325 1HB ASN 41 1HB ASN 41 17.116 -5.740 -4.372 326 2HB ASN 41 2HB ASN 41 18.422 -6.033 -5.512 327 1HD2 ASN 41 1HD2 ASN 41 15.169 -6.613 -4.703 328 2HD2 ASN 41 2HD2 ASN 41 14.771 -7.620 -6.050 329 H GLY 42 H GLY 42 17.745 -5.242 -2.684 330 1HA GLY 42 1HA GLY 42 19.113 -3.580 -1.735 331 2HA GLY 42 2HA GLY 42 20.444 -4.717 -1.724 332 H VAL 43 H VAL 43 20.735 -3.707 0.355 333 HA VAL 43 HA VAL 43 19.523 -5.268 2.501 334 HB VAL 43 HB VAL 43 21.718 -3.247 2.878 335 1HG1 VAL 43 1HG1 VAL 43 20.850 -5.765 4.263 336 2HG1 VAL 43 2HG1 VAL 43 22.444 -5.060 4.527 337 3HG1 VAL 43 3HG1 VAL 43 20.996 -4.136 4.921 338 1HG2 VAL 43 1HG2 VAL 43 22.392 -4.581 0.949 339 2HG2 VAL 43 2HG2 VAL 43 23.382 -4.963 2.358 340 3HG2 VAL 43 3HG2 VAL 43 22.096 -6.062 1.860 341 H LYS 44 H LYS 44 19.334 -3.829 4.668 342 HA LYS 44 HA LYS 44 18.753 -1.161 4.743 343 1HB LYS 44 1HB LYS 44 16.307 -1.021 4.451 344 2HB LYS 44 2HB LYS 44 17.128 -1.454 2.960 345 1HG LYS 44 1HG LYS 44 15.419 -2.940 2.891 346 2HG LYS 44 2HG LYS 44 16.587 -3.905 3.794 347 1HD LYS 44 1HD LYS 44 15.448 -2.754 5.864 348 2HD LYS 44 2HD LYS 44 14.111 -2.530 4.737 349 1HE LYS 44 1HE LYS 44 15.421 -5.155 5.441 350 2HE LYS 44 2HE LYS 44 13.858 -4.589 6.029 351 1HZ LYS 44 1HZ LYS 44 14.540 -5.133 3.190 352 2HZ LYS 44 2HZ LYS 44 13.614 -6.136 4.190 353 3HZ LYS 44 3HZ LYS 44 13.037 -4.605 3.759 354 HA PRO 45 HA PRO 45 17.661 -2.206 8.900 355 1HB PRO 45 1HB PRO 45 16.598 0.389 9.418 356 2HB PRO 45 2HB PRO 45 18.232 -0.194 9.729 357 1HG PRO 45 1HG PRO 45 17.571 1.745 7.875 358 2HG PRO 45 2HG PRO 45 19.059 0.785 7.854 359 1HD PRO 45 1HD PRO 45 16.540 0.412 6.286 360 2HD PRO 45 2HD PRO 45 18.229 0.209 5.777 361 H GLY 46 H GLY 46 15.949 -1.896 10.570 362 1HA GLY 46 1HA GLY 46 13.866 -2.498 11.309 363 2HA GLY 46 2HA GLY 46 13.500 -3.011 9.668 364 H LYS 47 H LYS 47 11.487 -1.875 11.040 365 HA LYS 47 HA LYS 47 10.390 -0.017 9.418 366 1HB LYS 47 1HB LYS 47 8.958 0.665 11.350 367 2HB LYS 47 2HB LYS 47 9.070 -1.071 11.091 368 1HG LYS 47 1HG LYS 47 10.725 -1.226 12.889 369 2HG LYS 47 2HG LYS 47 10.586 0.513 13.156 370 1HD LYS 47 1HD LYS 47 8.242 0.256 13.745 371 2HD LYS 47 2HD LYS 47 8.328 -1.475 13.408 372 1HE LYS 47 1HE LYS 47 9.905 -0.015 15.527 373 2HE LYS 47 2HE LYS 47 8.465 -0.992 15.813 374 1HZ LYS 47 1HZ LYS 47 11.032 -1.984 14.697 375 2HZ LYS 47 2HZ LYS 47 10.481 -2.236 16.275 376 3HZ LYS 47 3HZ LYS 47 9.651 -2.922 14.970 377 H SER 48 H SER 48 13.035 0.712 11.478 378 HA SER 48 HA SER 48 12.429 3.555 11.590 379 1HB SER 48 1HB SER 48 14.620 3.752 12.721 380 2HB SER 48 2HB SER 48 13.620 2.514 13.481 381 HG SER 48 HG SER 48 16.027 2.176 12.700 382 H ASP 49 H ASP 49 13.143 1.667 9.202 383 HA ASP 49 HA ASP 49 15.440 2.763 7.941 384 1HB ASP 49 1HB ASP 49 15.035 0.677 7.122 385 2HB ASP 49 2HB ASP 49 13.293 0.829 7.297 386 H THR 50 H THR 50 15.574 4.109 6.140 387 HA THR 50 HA THR 50 13.172 5.704 5.503 388 HB THR 50 HB THR 50 16.003 6.770 5.730 389 HG1 THR 50 HG1 THR 50 15.172 6.468 7.792 390 1HG2 THR 50 1HG2 THR 50 13.386 8.177 5.184 391 2HG2 THR 50 2HG2 THR 50 14.945 8.966 5.417 392 3HG2 THR 50 3HG2 THR 50 14.687 7.916 4.023 393 H VAL 51 H VAL 51 12.692 5.469 3.387 394 HA VAL 51 HA VAL 51 14.928 5.071 1.517 395 HB VAL 51 HB VAL 51 13.633 3.425 0.266 396 1HG1 VAL 51 1HG1 VAL 51 14.008 2.774 3.184 397 2HG1 VAL 51 2HG1 VAL 51 13.736 1.573 1.918 398 3HG1 VAL 51 3HG1 VAL 51 15.187 2.579 1.886 399 1HG2 VAL 51 1HG2 VAL 51 11.388 4.167 0.845 400 2HG2 VAL 51 2HG2 VAL 51 11.590 2.452 1.217 401 3HG2 VAL 51 3HG2 VAL 51 11.633 3.649 2.516 402 H THR 52 H THR 52 14.529 5.607 -0.658 403 HA THR 52 HA THR 52 12.367 7.583 -1.033 404 HB THR 52 HB THR 52 15.042 7.382 -2.446 405 HG1 THR 52 HG1 THR 52 14.632 8.345 -0.135 406 1HG2 THR 52 1HG2 THR 52 12.805 9.390 -2.744 407 2HG2 THR 52 2HG2 THR 52 14.406 9.540 -3.470 408 3HG2 THR 52 3HG2 THR 52 13.336 8.225 -3.955 409 H VAL 53 H VAL 53 10.794 6.945 -2.370 410 HA VAL 53 HA VAL 53 11.460 5.181 -4.604 411 HB VAL 53 HB VAL 53 9.843 3.555 -4.131 412 1HG1 VAL 53 1HG1 VAL 53 11.827 3.327 -2.734 413 2HG1 VAL 53 2HG1 VAL 53 11.049 4.301 -1.468 414 3HG1 VAL 53 3HG1 VAL 53 10.379 2.715 -1.906 415 1HG2 VAL 53 1HG2 VAL 53 8.759 5.419 -2.021 416 2HG2 VAL 53 2HG2 VAL 53 7.976 4.942 -3.531 417 3HG2 VAL 53 3HG2 VAL 53 8.223 3.754 -2.250 418 H GLU 54 H GLU 54 9.272 4.727 -5.831 419 HA GLU 54 HA GLU 54 7.705 7.208 -6.029 420 1HB GLU 54 1HB GLU 54 9.146 5.699 -8.191 421 2HB GLU 54 2HB GLU 54 7.686 6.599 -8.574 422 1HG GLU 54 1HG GLU 54 8.684 8.651 -7.868 423 2HG GLU 54 2HG GLU 54 10.101 7.803 -7.248 424 H TYR 55 H TYR 55 5.508 6.856 -6.164 425 HA TYR 55 HA TYR 55 4.617 4.202 -6.981 426 1HB TYR 55 1HB TYR 55 3.430 3.671 -5.049 427 2HB TYR 55 2HB TYR 55 4.936 4.324 -4.431 428 HD1 TYR 55 HD1 TYR 55 4.924 6.831 -3.761 429 HD2 TYR 55 HD2 TYR 55 1.389 4.516 -4.289 430 HE1 TYR 55 HE1 TYR 55 3.670 8.446 -2.399 431 HE2 TYR 55 HE2 TYR 55 0.116 6.131 -2.930 432 HH TYR 55 HH TYR 55 0.573 7.821 -1.181 433 H THR 56 H THR 56 2.407 4.014 -7.368 434 HA THR 56 HA THR 56 1.001 6.547 -7.888 435 HB THR 56 HB THR 56 0.961 4.084 -9.657 436 HG1 THR 56 HG1 THR 56 2.854 5.143 -10.076 437 1HG2 THR 56 1HG2 THR 56 -1.173 5.318 -9.602 438 2HG2 THR 56 2HG2 THR 56 -0.317 6.792 -10.053 439 3HG2 THR 56 3HG2 THR 56 -0.381 5.432 -11.174 440 H GLY 57 H GLY 57 -0.719 6.600 -6.568 441 1HA GLY 57 1HA GLY 57 -1.980 5.450 -4.837 442 2HA GLY 57 2HA GLY 57 -1.932 4.008 -5.841 443 H ARG 58 H ARG 58 -4.107 3.710 -5.860 444 HA ARG 58 HA ARG 58 -5.809 5.836 -6.890 445 1HB ARG 58 1HB ARG 58 -5.306 4.916 -8.961 446 2HB ARG 58 2HB ARG 58 -5.128 3.289 -8.309 447 1HG ARG 58 1HG ARG 58 -7.839 4.435 -8.164 448 2HG ARG 58 2HG ARG 58 -7.219 4.107 -9.786 449 1HD ARG 58 1HD ARG 58 -7.455 2.155 -7.498 450 2HD ARG 58 2HD ARG 58 -8.404 2.169 -8.984 451 HE ARG 58 HE ARG 58 -5.587 1.938 -9.459 452 1HH1 ARG 58 1HH1 ARG 58 -8.493 0.173 -8.685 453 2HH1 ARG 58 2HH1 ARG 58 -7.897 -1.331 -9.304 454 1HH2 ARG 58 1HH2 ARG 58 -4.798 -0.038 -10.278 455 2HH2 ARG 58 2HH2 ARG 58 -5.799 -1.450 -10.212 456 H LEU 59 H LEU 59 -7.983 5.578 -6.379 457 HA LEU 59 HA LEU 59 -8.493 3.809 -4.143 458 1HB LEU 59 1HB LEU 59 -10.311 5.801 -5.510 459 2HB LEU 59 2HB LEU 59 -10.644 4.986 -3.994 460 HG LEU 59 HG LEU 59 -8.214 6.719 -4.253 461 1HD1 LEU 59 1HD1 LEU 59 -10.076 8.077 -5.062 462 2HD1 LEU 59 2HD1 LEU 59 -11.001 7.677 -3.615 463 3HD1 LEU 59 3HD1 LEU 59 -9.522 8.629 -3.480 464 1HD2 LEU 59 1HD2 LEU 59 -10.035 5.997 -1.959 465 2HD2 LEU 59 2HD2 LEU 59 -8.444 5.313 -2.280 466 3HD2 LEU 59 3HD2 LEU 59 -8.600 7.015 -1.853 467 H ILE 60 H ILE 60 -10.385 2.409 -4.056 468 HA ILE 60 HA ILE 60 -10.582 0.664 -6.224 469 HB ILE 60 HB ILE 60 -11.245 0.110 -3.879 470 1HG1 ILE 60 1HG1 ILE 60 -13.162 -1.328 -4.491 471 2HG1 ILE 60 2HG1 ILE 60 -13.356 -0.418 -5.986 472 1HG2 ILE 60 1HG2 ILE 60 -13.719 1.691 -4.562 473 2HG2 ILE 60 2HG2 ILE 60 -13.510 0.684 -3.125 474 3HG2 ILE 60 3HG2 ILE 60 -12.501 2.114 -3.354 475 1HD1 ILE 60 1HD1 ILE 60 -10.934 -2.037 -5.228 476 2HD1 ILE 60 2HD1 ILE 60 -12.212 -2.546 -6.336 477 3HD1 ILE 60 3HD1 ILE 60 -11.180 -1.173 -6.747 478 H ASP 61 H ASP 61 -11.796 3.753 -5.853 479 HA ASP 61 HA ASP 61 -14.261 3.577 -7.242 480 1HB ASP 61 1HB ASP 61 -13.565 5.494 -5.794 481 2HB ASP 61 2HB ASP 61 -12.423 5.970 -7.047 482 H GLY 62 H GLY 62 -11.082 3.212 -8.311 483 1HA GLY 62 1HA GLY 62 -12.000 3.279 -11.075 484 2HA GLY 62 2HA GLY 62 -10.502 2.572 -10.496 485 H THR 63 H THR 63 -10.631 5.558 -9.083 486 HA THR 63 HA THR 63 -9.190 6.774 -11.346 487 HB THR 63 HB THR 63 -11.295 7.935 -11.109 488 HG1 THR 63 HG1 THR 63 -10.413 10.052 -10.555 489 1HG2 THR 63 1HG2 THR 63 -10.500 8.348 -8.225 490 2HG2 THR 63 2HG2 THR 63 -11.880 9.107 -9.018 491 3HG2 THR 63 3HG2 THR 63 -11.835 7.355 -8.810 492 H VAL 64 H VAL 64 -7.283 7.757 -10.925 493 HA VAL 64 HA VAL 64 -5.857 7.105 -8.602 494 HB VAL 64 HB VAL 64 -4.715 7.525 -10.713 495 1HG1 VAL 64 1HG1 VAL 64 -6.201 9.273 -11.574 496 2HG1 VAL 64 2HG1 VAL 64 -5.554 10.403 -10.384 497 3HG1 VAL 64 3HG1 VAL 64 -4.508 9.761 -11.650 498 1HG2 VAL 64 1HG2 VAL 64 -3.971 9.481 -8.543 499 2HG2 VAL 64 2HG2 VAL 64 -3.392 7.827 -8.730 500 3HG2 VAL 64 3HG2 VAL 64 -2.937 9.057 -9.907 501 H PHE 65 H PHE 65 -5.584 8.146 -6.726 502 HA PHE 65 HA PHE 65 -7.097 10.612 -6.350 503 1HB PHE 65 1HB PHE 65 -6.912 10.154 -3.931 504 2HB PHE 65 2HB PHE 65 -7.650 8.823 -4.812 505 HD1 PHE 65 HD1 PHE 65 -4.264 8.528 -5.515 506 HD2 PHE 65 HD2 PHE 65 -7.014 8.060 -2.319 507 HE1 PHE 65 HE1 PHE 65 -2.695 7.024 -4.404 508 HE2 PHE 65 HE2 PHE 65 -5.456 6.528 -1.219 509 HZ PHE 65 HZ PHE 65 -3.275 6.016 -2.247 510 H ASP 66 H ASP 66 -3.841 9.438 -6.428 511 HA ASP 66 HA ASP 66 -2.737 11.990 -6.610 512 1HB ASP 66 1HB ASP 66 -3.227 12.185 -4.224 513 2HB ASP 66 2HB ASP 66 -2.369 10.680 -3.905 514 H SER 67 H SER 67 -0.831 11.810 -7.608 515 HA SER 67 HA SER 67 0.675 9.295 -7.322 516 1HB SER 67 1HB SER 67 1.246 9.446 -9.737 517 2HB SER 67 2HB SER 67 -0.482 9.228 -9.465 518 HG SER 67 HG SER 67 -0.598 10.910 -10.737 519 H THR 68 H THR 68 2.752 9.575 -6.761 520 HA THR 68 HA THR 68 3.787 12.271 -6.556 521 HB THR 68 HB THR 68 5.744 11.250 -5.472 522 HG1 THR 68 HG1 THR 68 5.956 9.052 -5.352 523 1HG2 THR 68 1HG2 THR 68 3.761 11.731 -4.122 524 2HG2 THR 68 2HG2 THR 68 3.116 10.130 -4.480 525 3HG2 THR 68 3HG2 THR 68 4.593 10.294 -3.529 526 H GLU 69 H GLU 69 4.024 9.648 -8.766 527 HA GLU 69 HA GLU 69 6.555 10.367 -9.894 528 1HB GLU 69 1HB GLU 69 4.332 8.654 -11.018 529 2HB GLU 69 2HB GLU 69 5.957 8.772 -11.679 530 1HG GLU 69 1HG GLU 69 6.841 7.897 -9.540 531 2HG GLU 69 2HG GLU 69 5.182 7.677 -8.987 532 H LYS 70 H LYS 70 3.173 10.825 -10.892 533 HA LYS 70 HA LYS 70 3.739 12.191 -13.283 534 1HB LYS 70 1HB LYS 70 1.292 12.416 -11.522 535 2HB LYS 70 2HB LYS 70 1.399 12.926 -13.202 536 1HG LYS 70 1HG LYS 70 1.722 10.097 -12.221 537 2HG LYS 70 2HG LYS 70 0.261 10.769 -12.947 538 1HD LYS 70 1HD LYS 70 1.505 11.220 -15.013 539 2HD LYS 70 2HD LYS 70 2.960 10.538 -14.283 540 1HE LYS 70 1HE LYS 70 0.376 9.069 -14.815 541 2HE LYS 70 2HE LYS 70 1.872 8.910 -15.738 542 1HZ LYS 70 1HZ LYS 70 2.958 8.071 -13.738 543 2HZ LYS 70 2HZ LYS 70 1.509 8.199 -12.876 544 3HZ LYS 70 3HZ LYS 70 1.634 7.108 -14.164 545 H THR 71 H THR 71 3.339 13.314 -9.972 546 HA THR 71 HA THR 71 3.169 16.061 -10.459 547 HB THR 71 HB THR 71 4.502 14.727 -8.093 548 HG1 THR 71 HG1 THR 71 2.336 15.044 -7.178 549 1HG2 THR 71 1HG2 THR 71 3.253 17.461 -8.411 550 2HG2 THR 71 2HG2 THR 71 3.839 16.779 -6.893 551 3HG2 THR 71 3HG2 THR 71 4.971 17.113 -8.204 552 H GLY 72 H GLY 72 5.828 13.882 -10.711 553 1HA GLY 72 1HA GLY 72 7.528 16.080 -11.605 554 2HA GLY 72 2HA GLY 72 7.823 14.366 -11.858 555 H LYS 73 H LYS 73 6.990 14.487 -8.735 556 HA LYS 73 HA LYS 73 9.779 14.865 -7.869 557 1HB LYS 73 1HB LYS 73 7.248 15.704 -6.453 558 2HB LYS 73 2HB LYS 73 8.820 15.643 -5.672 559 1HG LYS 73 1HG LYS 73 9.677 17.292 -7.262 560 2HG LYS 73 2HG LYS 73 8.094 17.355 -8.040 561 1HD LYS 73 1HD LYS 73 7.094 18.173 -5.975 562 2HD LYS 73 2HD LYS 73 8.656 18.063 -5.160 563 1HE LYS 73 1HE LYS 73 8.020 19.823 -7.526 564 2HE LYS 73 2HE LYS 73 8.149 20.360 -5.852 565 1HZ LYS 73 1HZ LYS 73 10.468 19.661 -5.852 566 2HZ LYS 73 2HZ LYS 73 10.340 19.163 -7.462 567 3HZ LYS 73 3HZ LYS 73 10.182 20.800 -7.071 568 HA PRO 74 HA PRO 74 9.198 10.537 -6.757 569 1HB PRO 74 1HB PRO 74 11.676 11.103 -5.212 570 2HB PRO 74 2HB PRO 74 11.334 9.796 -6.352 571 1HG PRO 74 1HG PRO 74 12.901 11.829 -7.055 572 2HG PRO 74 2HG PRO 74 11.750 11.126 -8.207 573 1HD PRO 74 1HD PRO 74 11.567 13.677 -6.660 574 2HD PRO 74 2HD PRO 74 11.048 13.323 -8.320 575 H ALA 75 H ALA 75 8.824 9.344 -4.800 576 HA ALA 75 HA ALA 75 7.863 11.051 -2.643 577 1HB ALA 75 1HB ALA 75 7.201 8.360 -3.668 578 2HB ALA 75 2HB ALA 75 6.146 9.632 -3.053 579 3HB ALA 75 3HB ALA 75 7.032 8.605 -1.931 580 H THR 76 H THR 76 8.981 11.259 -0.786 581 HA THR 76 HA THR 76 10.917 9.148 -0.088 582 HB THR 76 HB THR 76 11.352 12.117 0.303 583 HG1 THR 76 HG1 THR 76 11.799 11.826 -1.795 584 1HG2 THR 76 1HG2 THR 76 13.165 9.752 0.810 585 2HG2 THR 76 2HG2 THR 76 13.627 11.447 0.958 586 3HG2 THR 76 3HG2 THR 76 12.413 10.768 2.040 587 H PHE 77 H PHE 77 10.207 8.186 1.693 588 HA PHE 77 HA PHE 77 9.693 9.721 4.077 589 1HB PHE 77 1HB PHE 77 7.451 8.827 4.483 590 2HB PHE 77 2HB PHE 77 7.481 9.768 2.994 591 HD1 PHE 77 HD1 PHE 77 7.385 8.643 0.816 592 HD2 PHE 77 HD2 PHE 77 7.004 6.480 4.465 593 HE1 PHE 77 HE1 PHE 77 6.463 6.728 -0.421 594 HE2 PHE 77 HE2 PHE 77 6.080 4.562 3.233 595 HZ PHE 77 HZ PHE 77 5.808 4.684 0.788 596 H GLN 78 H GLN 78 9.335 8.293 5.976 597 HA GLN 78 HA GLN 78 10.879 5.837 5.668 598 1HB GLN 78 1HB GLN 78 10.914 5.856 8.166 599 2HB GLN 78 2HB GLN 78 11.694 7.230 7.408 600 1HG GLN 78 1HG GLN 78 10.105 8.703 8.128 601 2HG GLN 78 2HG GLN 78 8.847 7.468 8.194 602 1HE2 GLN 78 1HE2 GLN 78 10.407 5.576 9.671 603 2HE2 GLN 78 2HE2 GLN 78 10.529 6.170 11.290 604 H VAL 79 H VAL 79 10.200 3.892 6.471 605 HA VAL 79 HA VAL 79 7.567 3.163 5.888 606 HB VAL 79 HB VAL 79 9.052 1.424 5.646 607 1HG1 VAL 79 1HG1 VAL 79 10.162 2.071 8.370 608 2HG1 VAL 79 2HG1 VAL 79 10.695 0.731 7.351 609 3HG1 VAL 79 3HG1 VAL 79 10.925 2.398 6.811 610 1HG2 VAL 79 1HG2 VAL 79 7.038 0.676 6.885 611 2HG2 VAL 79 2HG2 VAL 79 8.453 -0.331 7.188 612 3HG2 VAL 79 3HG2 VAL 79 7.938 0.851 8.391 613 H SER 80 H SER 80 8.953 4.185 8.947 614 HA SER 80 HA SER 80 6.720 3.136 10.469 615 1HB SER 80 1HB SER 80 8.937 3.120 11.482 616 2HB SER 80 2HB SER 80 9.036 4.873 11.337 617 HG SER 80 HG SER 80 8.379 4.221 13.429 618 H GLN 81 H GLN 81 7.033 5.809 8.552 619 HA GLN 81 HA GLN 81 5.493 7.560 10.320 620 1HB GLN 81 1HB GLN 81 7.496 8.360 8.965 621 2HB GLN 81 2HB GLN 81 6.458 8.241 7.552 622 1HG GLN 81 1HG GLN 81 6.514 10.512 8.357 623 2HG GLN 81 2HG GLN 81 4.902 9.834 8.576 624 1HE2 GLN 81 1HE2 GLN 81 7.787 10.945 10.149 625 2HE2 GLN 81 2HE2 GLN 81 7.141 11.001 11.750 626 H VAL 82 H VAL 82 4.622 5.110 8.400 627 HA VAL 82 HA VAL 82 2.278 6.540 7.323 628 HB VAL 82 HB VAL 82 2.047 4.429 5.857 629 1HG1 VAL 82 1HG1 VAL 82 4.269 6.429 5.455 630 2HG1 VAL 82 2HG1 VAL 82 3.620 5.382 4.193 631 3HG1 VAL 82 3HG1 VAL 82 2.588 6.595 4.949 632 1HG2 VAL 82 1HG2 VAL 82 3.706 3.079 7.055 633 2HG2 VAL 82 2HG2 VAL 82 4.141 3.285 5.359 634 3HG2 VAL 82 3HG2 VAL 82 4.965 4.228 6.601 635 H ILE 83 H ILE 83 0.442 4.737 6.883 636 HA ILE 83 HA ILE 83 -0.731 4.219 9.352 637 HB ILE 83 HB ILE 83 -2.301 2.734 8.085 638 1HG1 ILE 83 1HG1 ILE 83 -0.580 3.516 5.720 639 2HG1 ILE 83 2HG1 ILE 83 -0.622 1.912 6.442 640 1HG2 ILE 83 1HG2 ILE 83 -1.714 5.446 6.901 641 2HG2 ILE 83 2HG2 ILE 83 -3.224 4.556 6.711 642 3HG2 ILE 83 3HG2 ILE 83 -2.723 5.111 8.309 643 1HD1 ILE 83 1HD1 ILE 83 -2.936 3.312 5.122 644 2HD1 ILE 83 2HD1 ILE 83 -1.964 2.017 4.422 645 3HD1 ILE 83 3HD1 ILE 83 -2.972 1.699 5.834 646 HA PRO 84 HA PRO 84 0.786 0.538 11.222 647 1HB PRO 84 1HB PRO 84 -1.958 -0.584 10.815 648 2HB PRO 84 2HB PRO 84 -0.943 -0.590 12.261 649 1HG PRO 84 1HG PRO 84 -2.949 1.141 12.025 650 2HG PRO 84 2HG PRO 84 -1.411 1.625 12.761 651 1HD PRO 84 1HD PRO 84 -2.528 2.303 10.093 652 2HD PRO 84 2HD PRO 84 -1.440 3.240 11.135 653 H GLY 85 H GLY 85 -1.631 -0.560 8.804 654 1HA GLY 85 1HA GLY 85 -1.398 -1.976 7.010 655 2HA GLY 85 2HA GLY 85 -0.468 -2.961 8.130 656 H TRP 86 H TRP 86 0.178 0.187 6.585 657 HA TRP 86 HA TRP 86 2.012 -0.756 4.686 658 1HB TRP 86 1HB TRP 86 1.105 1.835 5.677 659 2HB TRP 86 2HB TRP 86 2.788 1.848 5.165 660 HD1 TRP 86 HD1 TRP 86 -0.072 -0.122 3.448 661 HE1 TRP 86 HE1 TRP 86 -0.244 0.698 1.010 662 HE3 TRP 86 HE3 TRP 86 3.353 3.664 3.617 663 HZ2 TRP 86 HZ2 TRP 86 0.911 2.691 -0.613 664 HZ3 TRP 86 HZ3 TRP 86 3.754 4.982 1.581 665 HH2 TRP 86 HH2 TRP 86 2.559 4.504 -0.490 666 H THR 87 H THR 87 2.566 0.560 7.953 667 HA THR 87 HA THR 87 5.345 0.696 7.862 668 HB THR 87 HB THR 87 5.353 0.581 10.284 669 HG1 THR 87 HG1 THR 87 3.928 -1.055 10.746 670 1HG2 THR 87 1HG2 THR 87 2.956 2.078 9.227 671 2HG2 THR 87 2HG2 THR 87 3.699 2.342 10.802 672 3HG2 THR 87 3HG2 THR 87 4.608 2.679 9.332 673 H GLU 88 H GLU 88 3.238 -2.063 8.407 674 HA GLU 88 HA GLU 88 5.277 -3.826 9.304 675 1HB GLU 88 1HB GLU 88 2.899 -4.205 9.769 676 2HB GLU 88 2HB GLU 88 2.601 -4.458 8.055 677 1HG GLU 88 1HG GLU 88 2.717 -6.569 9.236 678 2HG GLU 88 2HG GLU 88 4.048 -6.420 8.085 679 H ALA 89 H ALA 89 3.664 -3.475 6.132 680 HA ALA 89 HA ALA 89 5.207 -5.470 4.854 681 1HB ALA 89 1HB ALA 89 3.038 -4.673 4.015 682 2HB ALA 89 2HB ALA 89 4.301 -4.643 2.782 683 3HB ALA 89 3HB ALA 89 3.796 -3.142 3.567 684 H LEU 90 H LEU 90 5.491 -1.919 4.719 685 HA LEU 90 HA LEU 90 7.701 -1.791 3.035 686 1HB LEU 90 1HB LEU 90 6.544 0.024 5.096 687 2HB LEU 90 2HB LEU 90 8.120 0.409 4.435 688 HG LEU 90 HG LEU 90 6.229 1.586 3.324 689 1HD1 LEU 90 1HD1 LEU 90 7.892 -0.282 1.649 690 2HD1 LEU 90 2HD1 LEU 90 6.979 1.085 1.012 691 3HD1 LEU 90 3HD1 LEU 90 8.300 1.359 2.147 692 1HD2 LEU 90 1HD2 LEU 90 4.581 -0.229 3.453 693 2HD2 LEU 90 2HD2 LEU 90 4.784 0.363 1.804 694 3HD2 LEU 90 3HD2 LEU 90 5.527 -1.161 2.293 695 H GLN 91 H GLN 91 7.527 -2.583 6.415 696 HA GLN 91 HA GLN 91 10.229 -2.054 7.083 697 1HB GLN 91 1HB GLN 91 8.493 -2.302 8.789 698 2HB GLN 91 2HB GLN 91 8.264 -3.991 8.327 699 1HG GLN 91 1HG GLN 91 10.559 -4.480 9.028 700 2HG GLN 91 2HG GLN 91 10.764 -2.797 9.508 701 1HE2 GLN 91 1HE2 GLN 91 10.921 -5.262 11.085 702 2HE2 GLN 91 2HE2 GLN 91 9.779 -5.074 12.368 703 H LEU 92 H LEU 92 8.688 -4.631 5.387 704 HA LEU 92 HA LEU 92 11.055 -6.341 5.638 705 1HB LEU 92 1HB LEU 92 8.282 -6.873 4.587 706 2HB LEU 92 2HB LEU 92 9.597 -8.025 4.453 707 HG LEU 92 HG LEU 92 8.574 -6.952 7.083 708 1HD1 LEU 92 1HD1 LEU 92 7.910 -9.517 5.642 709 2HD1 LEU 92 2HD1 LEU 92 7.510 -9.171 7.326 710 3HD1 LEU 92 3HD1 LEU 92 6.800 -8.201 6.034 711 1HD2 LEU 92 1HD2 LEU 92 10.894 -7.759 7.089 712 2HD2 LEU 92 2HD2 LEU 92 9.832 -8.795 8.041 713 3HD2 LEU 92 3HD2 LEU 92 10.348 -9.303 6.433 714 H MET 93 H MET 93 9.820 -4.004 3.583 715 HA MET 93 HA MET 93 10.582 -5.158 1.082 716 1HB MET 93 1HB MET 93 9.837 -2.368 1.936 717 2HB MET 93 2HB MET 93 10.298 -2.763 0.284 718 1HG MET 93 1HG MET 93 8.454 -4.409 0.211 719 2HG MET 93 2HG MET 93 7.964 -3.877 1.819 720 1HE MET 93 1HE MET 93 5.877 -3.926 -0.454 721 2HE MET 93 2HE MET 93 5.522 -3.240 1.132 722 3HE MET 93 3HE MET 93 5.126 -2.334 -0.329 723 HA PRO 94 HA PRO 94 14.907 -4.025 1.768 724 1HB PRO 94 1HB PRO 94 15.999 -5.782 0.100 725 2HB PRO 94 2HB PRO 94 15.253 -6.319 1.615 726 1HG PRO 94 1HG PRO 94 14.147 -6.373 -1.166 727 2HG PRO 94 2HG PRO 94 14.073 -7.622 0.090 728 1HD PRO 94 1HD PRO 94 12.037 -5.839 -0.488 729 2HD PRO 94 2HD PRO 94 12.245 -6.684 1.085 730 H ALA 95 H ALA 95 16.355 -2.734 0.671 731 HA ALA 95 HA ALA 95 15.579 -1.017 -1.289 732 1HB ALA 95 1HB ALA 95 18.340 -2.041 -0.678 733 2HB ALA 95 2HB ALA 95 17.558 -0.593 -0.045 734 3HB ALA 95 3HB ALA 95 18.018 -0.676 -1.746 735 H GLY 96 H GLY 96 15.283 -1.047 -3.447 736 1HA GLY 96 1HA GLY 96 16.676 -3.000 -5.093 737 2HA GLY 96 2HA GLY 96 15.713 -1.648 -5.669 738 H SER 97 H SER 97 14.100 -3.457 -3.291 739 HA SER 97 HA SER 97 13.070 -5.556 -4.895 740 1HB SER 97 1HB SER 97 11.439 -5.884 -3.105 741 2HB SER 97 2HB SER 97 13.046 -5.622 -2.428 742 HG SER 97 HG SER 97 11.415 -4.402 -1.358 743 H THR 98 H THR 98 10.434 -5.643 -4.817 744 HA THR 98 HA THR 98 9.153 -3.205 -5.651 745 HB THR 98 HB THR 98 9.439 -5.375 -7.738 746 HG1 THR 98 HG1 THR 98 11.444 -4.339 -7.487 747 1HG2 THR 98 1HG2 THR 98 7.405 -4.025 -7.900 748 2HG2 THR 98 2HG2 THR 98 8.376 -2.552 -7.897 749 3HG2 THR 98 3HG2 THR 98 8.500 -3.689 -9.241 750 H TRP 99 H TRP 99 7.528 -3.618 -4.212 751 HA TRP 99 HA TRP 99 5.953 -6.071 -4.668 752 1HB TRP 99 1HB TRP 99 6.480 -4.538 -2.127 753 2HB TRP 99 2HB TRP 99 5.160 -5.687 -2.274 754 HD1 TRP 99 HD1 TRP 99 7.849 -7.227 -4.163 755 HE1 TRP 99 HE1 TRP 99 9.169 -8.899 -2.717 756 HE3 TRP 99 HE3 TRP 99 6.179 -5.800 0.450 757 HZ2 TRP 99 HZ2 TRP 99 9.459 -9.531 0.024 758 HZ3 TRP 99 HZ3 TRP 99 7.021 -6.987 2.433 759 HH2 TRP 99 HH2 TRP 99 8.627 -8.812 2.223 760 H GLU 100 H GLU 100 3.699 -5.921 -4.539 761 HA GLU 100 HA GLU 100 2.591 -3.194 -4.649 762 1HB GLU 100 1HB GLU 100 0.909 -4.019 -6.249 763 2HB GLU 100 2HB GLU 100 2.538 -4.200 -6.884 764 1HG GLU 100 1HG GLU 100 2.451 -6.594 -6.115 765 2HG GLU 100 2HG GLU 100 0.735 -6.340 -5.789 766 H ILE 101 H ILE 101 1.553 -2.906 -2.775 767 HA ILE 101 HA ILE 101 0.198 -5.217 -1.580 768 HB ILE 101 HB ILE 101 0.242 -3.920 0.532 769 1HG1 ILE 101 1HG1 ILE 101 1.999 -2.032 -1.051 770 2HG1 ILE 101 2HG1 ILE 101 0.374 -1.671 -0.481 771 1HG2 ILE 101 1HG2 ILE 101 2.907 -4.404 -0.794 772 2HG2 ILE 101 2HG2 ILE 101 2.648 -4.230 0.941 773 3HG2 ILE 101 3HG2 ILE 101 1.937 -5.592 0.076 774 1HD1 ILE 101 1HD1 ILE 101 1.140 -1.881 1.826 775 2HD1 ILE 101 2HD1 ILE 101 2.768 -2.236 1.249 776 3HD1 ILE 101 3HD1 ILE 101 2.049 -0.655 0.942 777 H TYR 102 H TYR 102 -1.848 -5.201 -0.970 778 HA TYR 102 HA TYR 102 -3.486 -2.814 -1.502 779 1HB TYR 102 1HB TYR 102 -5.276 -4.773 -1.929 780 2HB TYR 102 2HB TYR 102 -4.274 -4.122 -3.222 781 HD1 TYR 102 HD1 TYR 102 -4.804 -6.966 -0.968 782 HD2 TYR 102 HD2 TYR 102 -2.484 -5.456 -4.206 783 HE1 TYR 102 HE1 TYR 102 -3.915 -9.217 -1.380 784 HE2 TYR 102 HE2 TYR 102 -1.596 -7.702 -4.621 785 HH TYR 102 HH TYR 102 -2.926 -10.484 -3.285 786 H VAL 103 H VAL 103 -3.921 -2.104 0.509 787 HA VAL 103 HA VAL 103 -4.508 -4.079 2.610 788 HB VAL 103 HB VAL 103 -3.945 -1.159 3.067 789 1HG1 VAL 103 1HG1 VAL 103 -4.923 -2.404 4.920 790 2HG1 VAL 103 2HG1 VAL 103 -3.633 -3.602 4.809 791 3HG1 VAL 103 3HG1 VAL 103 -3.259 -1.942 5.277 792 1HG2 VAL 103 1HG2 VAL 103 -1.937 -3.407 2.885 793 2HG2 VAL 103 2HG2 VAL 103 -2.079 -2.040 1.781 794 3HG2 VAL 103 3HG2 VAL 103 -1.596 -1.774 3.456 795 HA PRO 104 HA PRO 104 -8.806 -2.637 2.174 796 1HB PRO 104 1HB PRO 104 -9.743 -4.330 4.143 797 2HB PRO 104 2HB PRO 104 -9.599 -4.765 2.438 798 1HG PRO 104 1HG PRO 104 -7.779 -5.381 4.722 799 2HG PRO 104 2HG PRO 104 -8.238 -6.397 3.342 800 1HD PRO 104 1HD PRO 104 -5.858 -5.146 3.472 801 2HD PRO 104 2HD PRO 104 -6.709 -5.396 1.931 802 H SER 105 H SER 105 -10.153 -1.366 3.519 803 HA SER 105 HA SER 105 -8.968 0.403 5.231 804 1HB SER 105 1HB SER 105 -11.482 0.458 6.214 805 2HB SER 105 2HB SER 105 -11.023 1.188 4.669 806 HG SER 105 HG SER 105 -12.576 -1.021 5.191 807 H GLY 106 H GLY 106 -10.562 -2.633 6.164 808 1HA GLY 106 1HA GLY 106 -10.524 -3.824 8.123 809 2HA GLY 106 2HA GLY 106 -10.580 -2.267 8.929 810 H LEU 107 H LEU 107 -7.847 -2.470 6.984 811 HA LEU 107 HA LEU 107 -6.214 -3.466 9.226 812 1HB LEU 107 1HB LEU 107 -5.877 -3.682 6.260 813 2HB LEU 107 2HB LEU 107 -4.488 -3.796 7.322 814 HG LEU 107 HG LEU 107 -5.434 -5.734 8.424 815 1HD1 LEU 107 1HD1 LEU 107 -7.769 -5.294 6.574 816 2HD1 LEU 107 2HD1 LEU 107 -7.476 -6.802 7.439 817 3HD1 LEU 107 3HD1 LEU 107 -7.778 -5.316 8.338 818 1HD2 LEU 107 1HD2 LEU 107 -5.479 -5.952 5.422 819 2HD2 LEU 107 2HD2 LEU 107 -4.059 -6.083 6.460 820 3HD2 LEU 107 3HD2 LEU 107 -5.331 -7.301 6.549 821 H ALA 108 H ALA 108 -7.017 -0.688 7.559 822 HA ALA 108 HA ALA 108 -4.429 0.570 8.190 823 1HB ALA 108 1HB ALA 108 -4.947 0.781 5.859 824 2HB ALA 108 2HB ALA 108 -6.560 1.399 6.224 825 3HB ALA 108 3HB ALA 108 -5.134 2.365 6.617 826 H TYR 109 H TYR 109 -7.103 2.645 7.599 827 HA TYR 109 HA TYR 109 -7.021 3.503 10.379 828 1HB TYR 109 1HB TYR 109 -7.714 4.758 7.807 829 2HB TYR 109 2HB TYR 109 -8.743 5.230 9.158 830 HD1 TYR 109 HD1 TYR 109 -5.489 5.578 7.618 831 HD2 TYR 109 HD2 TYR 109 -7.698 6.226 11.196 832 HE1 TYR 109 HE1 TYR 109 -3.764 7.149 8.393 833 HE2 TYR 109 HE2 TYR 109 -5.978 7.798 11.982 834 HH TYR 109 HH TYR 109 -3.572 8.246 11.581 835 H GLY 110 H GLY 110 -8.888 1.560 8.353 836 1HA GLY 110 1HA GLY 110 -10.984 1.440 10.407 837 2HA GLY 110 2HA GLY 110 -10.566 0.152 9.299 838 HA PRO 111 HA PRO 111 -13.552 1.250 6.229 839 1HB PRO 111 1HB PRO 111 -15.700 -0.155 7.273 840 2HB PRO 111 2HB PRO 111 -14.434 -0.845 6.252 841 1HG PRO 111 1HG PRO 111 -14.699 -0.878 9.231 842 2HG PRO 111 2HG PRO 111 -14.182 -2.176 8.135 843 1HD PRO 111 1HD PRO 111 -12.391 -0.796 9.541 844 2HD PRO 111 2HD PRO 111 -12.058 -1.261 7.859 845 H ARG 112 H ARG 112 -13.763 2.181 9.471 846 HA ARG 112 HA ARG 112 -16.366 3.374 9.389 847 1HB ARG 112 1HB ARG 112 -14.064 3.912 11.276 848 2HB ARG 112 2HB ARG 112 -15.737 4.392 11.525 849 1HG ARG 112 1HG ARG 112 -16.406 2.058 11.645 850 2HG ARG 112 2HG ARG 112 -14.741 1.556 11.350 851 1HD ARG 112 1HD ARG 112 -14.038 2.652 13.415 852 2HD ARG 112 2HD ARG 112 -15.694 3.183 13.704 853 HE ARG 112 HE ARG 112 -16.042 0.558 13.569 854 1HH1 ARG 112 1HH1 ARG 112 -13.584 2.406 15.211 855 2HH1 ARG 112 2HH1 ARG 112 -13.374 1.243 16.477 856 1HH2 ARG 112 1HH2 ARG 112 -15.773 -0.976 15.231 857 2HH2 ARG 112 2HH2 ARG 112 -14.616 -0.681 16.486 858 H SER 113 H SER 113 -16.530 5.799 9.935 859 HA SER 113 HA SER 113 -15.624 7.255 7.709 860 1HB SER 113 1HB SER 113 -16.762 8.261 10.322 861 2HB SER 113 2HB SER 113 -16.590 9.221 8.853 862 HG SER 113 HG SER 113 -17.934 6.801 8.617 863 H VAL 114 H VAL 114 -13.584 6.138 9.804 864 HA VAL 114 HA VAL 114 -12.085 8.628 10.232 865 HB VAL 114 HB VAL 114 -11.292 5.953 11.352 866 1HG1 VAL 114 1HG1 VAL 114 -10.855 8.798 12.255 867 2HG1 VAL 114 2HG1 VAL 114 -10.307 7.360 13.125 868 3HG1 VAL 114 3HG1 VAL 114 -9.656 7.727 11.522 869 1HG2 VAL 114 1HG2 VAL 114 -13.631 6.283 11.971 870 2HG2 VAL 114 2HG2 VAL 114 -12.574 6.449 13.373 871 3HG2 VAL 114 3HG2 VAL 114 -13.245 7.885 12.599 872 H GLY 115 H GLY 115 -12.416 6.933 7.717 873 1HA GLY 115 1HA GLY 115 -11.130 6.210 5.958 874 2HA GLY 115 2HA GLY 115 -9.943 5.683 7.145 875 H GLY 116 H GLY 116 -8.087 6.814 7.373 876 1HA GLY 116 1HA GLY 116 -6.493 8.438 7.049 877 2HA GLY 116 2HA GLY 116 -7.807 9.575 6.798 878 HA PRO 117 HA PRO 117 -5.523 9.335 2.766 879 1HB PRO 117 1HB PRO 117 -3.838 7.180 2.383 880 2HB PRO 117 2HB PRO 117 -3.345 8.726 3.080 881 1HG PRO 117 1HG PRO 117 -4.065 6.171 4.452 882 2HG PRO 117 2HG PRO 117 -2.779 7.329 4.838 883 1HD PRO 117 1HD PRO 117 -5.064 7.245 6.245 884 2HD PRO 117 2HD PRO 117 -4.235 8.788 5.902 885 H ILE 118 H ILE 118 -6.392 6.114 3.905 886 HA ILE 118 HA ILE 118 -7.354 5.346 1.268 887 HB ILE 118 HB ILE 118 -7.407 3.763 3.847 888 1HG1 ILE 118 1HG1 ILE 118 -5.456 3.653 1.538 889 2HG1 ILE 118 2HG1 ILE 118 -5.116 4.333 3.125 890 1HG2 ILE 118 1HG2 ILE 118 -9.065 3.057 2.173 891 2HG2 ILE 118 2HG2 ILE 118 -7.762 2.853 1.000 892 3HG2 ILE 118 3HG2 ILE 118 -7.815 1.838 2.442 893 1HD1 ILE 118 1HD1 ILE 118 -5.553 2.081 4.095 894 2HD1 ILE 118 2HD1 ILE 118 -5.665 1.457 2.450 895 3HD1 ILE 118 3HD1 ILE 118 -4.154 2.164 3.024 896 H GLY 119 H GLY 119 -9.324 5.927 0.664 897 1HA GLY 119 1HA GLY 119 -11.613 6.198 0.707 898 2HA GLY 119 2HA GLY 119 -11.250 7.221 2.086 899 HA PRO 120 HA PRO 120 -13.249 4.525 4.923 900 1HB PRO 120 1HB PRO 120 -15.894 5.168 4.587 901 2HB PRO 120 2HB PRO 120 -14.745 6.165 5.484 902 1HG PRO 120 1HG PRO 120 -15.722 6.462 2.672 903 2HG PRO 120 2HG PRO 120 -15.456 7.710 3.905 904 1HD PRO 120 1HD PRO 120 -13.690 7.268 1.919 905 2HD PRO 120 2HD PRO 120 -13.172 7.761 3.544 906 H ASN 121 H ASN 121 -13.743 2.419 4.830 907 HA ASN 121 HA ASN 121 -14.204 0.358 3.940 908 1HB ASN 121 1HB ASN 121 -16.569 1.668 2.605 909 2HB ASN 121 2HB ASN 121 -16.441 0.034 3.250 910 1HD2 ASN 121 1HD2 ASN 121 -16.874 3.386 3.999 911 2HD2 ASN 121 2HD2 ASN 121 -17.404 3.174 5.633 912 H GLU 122 H GLU 122 -12.479 2.048 2.369 913 HA GLU 122 HA GLU 122 -13.146 1.101 -0.338 914 1HB GLU 122 1HB GLU 122 -11.693 3.570 0.576 915 2HB GLU 122 2HB GLU 122 -11.515 2.948 -1.059 916 1HG GLU 122 1HG GLU 122 -13.935 3.151 -1.385 917 2HG GLU 122 2HG GLU 122 -14.088 3.812 0.241 918 H THR 123 H THR 123 -11.812 -0.313 -1.266 919 HA THR 123 HA THR 123 -9.330 -0.979 0.127 920 HB THR 123 HB THR 123 -10.655 -2.372 -2.219 921 HG1 THR 123 HG1 THR 123 -10.581 -3.678 0.189 922 1HG2 THR 123 1HG2 THR 123 -8.231 -2.769 -2.082 923 2HG2 THR 123 2HG2 THR 123 -8.414 -3.276 -0.402 924 3HG2 THR 123 3HG2 THR 123 -9.147 -4.225 -1.695 925 H LEU 124 H LEU 124 -7.391 -0.316 -0.615 926 HA LEU 124 HA LEU 124 -7.329 0.925 -3.294 927 1HB LEU 124 1HB LEU 124 -6.053 1.643 -0.693 928 2HB LEU 124 2HB LEU 124 -5.255 2.092 -2.186 929 HG LEU 124 HG LEU 124 -7.084 3.485 -2.844 930 1HD1 LEU 124 1HD1 LEU 124 -8.536 2.312 -0.481 931 2HD1 LEU 124 2HD1 LEU 124 -9.067 3.760 -1.334 932 3HD1 LEU 124 3HD1 LEU 124 -8.987 2.218 -2.183 933 1HD2 LEU 124 1HD2 LEU 124 -6.464 3.874 0.078 934 2HD2 LEU 124 2HD2 LEU 124 -5.501 4.455 -1.279 935 3HD2 LEU 124 3HD2 LEU 124 -7.119 5.100 -1.005 936 H ILE 125 H ILE 125 -5.366 0.822 -4.476 937 HA ILE 125 HA ILE 125 -3.688 -1.523 -3.871 938 HB ILE 125 HB ILE 125 -4.234 -0.279 -6.573 939 1HG1 ILE 125 1HG1 ILE 125 -5.311 -2.671 -6.847 940 2HG1 ILE 125 2HG1 ILE 125 -5.480 -2.556 -5.097 941 1HG2 ILE 125 1HG2 ILE 125 -2.765 -2.801 -5.813 942 2HG2 ILE 125 2HG2 ILE 125 -3.114 -2.274 -7.461 943 3HG2 ILE 125 3HG2 ILE 125 -2.040 -1.317 -6.438 944 1HD1 ILE 125 1HD1 ILE 125 -6.569 -0.574 -7.082 945 2HD1 ILE 125 2HD1 ILE 125 -7.495 -1.834 -6.269 946 3HD1 ILE 125 3HD1 ILE 125 -6.777 -0.524 -5.332 947 H PHE 126 H PHE 126 -1.474 -1.263 -3.894 948 HA PHE 126 HA PHE 126 -0.476 1.421 -4.558 949 1HB PHE 126 1HB PHE 126 0.326 -0.201 -2.136 950 2HB PHE 126 2HB PHE 126 0.964 1.378 -2.580 951 HD1 PHE 126 HD1 PHE 126 -1.555 -0.380 -0.791 952 HD2 PHE 126 HD2 PHE 126 -0.686 3.328 -2.693 953 HE1 PHE 126 HE1 PHE 126 -3.351 0.699 0.500 954 HE2 PHE 126 HE2 PHE 126 -2.479 4.410 -1.401 955 HZ PHE 126 HZ PHE 126 -3.814 3.096 0.194 956 H LYS 127 H LYS 127 1.283 1.471 -5.770 957 HA LYS 127 HA LYS 127 2.742 -1.047 -6.225 958 1HB LYS 127 1HB LYS 127 2.451 1.373 -8.025 959 2HB LYS 127 2HB LYS 127 3.407 -0.055 -8.399 960 1HG LYS 127 1HG LYS 127 0.431 -0.061 -7.938 961 2HG LYS 127 2HG LYS 127 1.207 -0.011 -9.522 962 1HD LYS 127 1HD LYS 127 1.875 -2.185 -7.567 963 2HD LYS 127 2HD LYS 127 0.412 -2.289 -8.564 964 1HE LYS 127 1HE LYS 127 2.191 -3.462 -9.673 965 2HE LYS 127 2HE LYS 127 1.832 -1.994 -10.578 966 1HZ LYS 127 1HZ LYS 127 4.055 -2.245 -8.629 967 2HZ LYS 127 2HZ LYS 127 4.230 -2.435 -10.299 968 3HZ LYS 127 3HZ LYS 127 3.755 -0.942 -9.665 969 H ILE 128 H ILE 128 4.455 -1.006 -4.889 970 HA ILE 128 HA ILE 128 5.921 1.518 -4.579 971 HB ILE 128 HB ILE 128 6.201 -0.987 -2.921 972 1HG1 ILE 128 1HG1 ILE 128 5.032 0.699 -1.219 973 2HG1 ILE 128 2HG1 ILE 128 4.356 1.354 -2.712 974 1HG2 ILE 128 1HG2 ILE 128 7.213 1.828 -2.558 975 2HG2 ILE 128 2HG2 ILE 128 7.272 0.582 -1.312 976 3HG2 ILE 128 3HG2 ILE 128 8.168 0.367 -2.815 977 1HD1 ILE 128 1HD1 ILE 128 4.170 -1.540 -1.931 978 2HD1 ILE 128 2HD1 ILE 128 2.940 -0.335 -1.550 979 3HD1 ILE 128 3HD1 ILE 128 3.313 -0.713 -3.231 980 H HIS 129 H HIS 129 7.663 1.788 -5.727 981 HA HIS 129 HA HIS 129 9.271 -0.576 -6.418 982 1HB HIS 129 1HB HIS 129 8.196 1.311 -8.136 983 2HB HIS 129 2HB HIS 129 9.851 1.868 -7.917 984 HD1 HIS 129 HD1 HIS 129 8.478 0.444 -10.511 985 HD2 HIS 129 HD2 HIS 129 11.191 -1.198 -7.831 986 HE1 HIS 129 HE1 HIS 129 9.558 -1.467 -11.736 987 HE2 HIS 129 HE2 HIS 129 11.015 -2.583 -10.008 988 H LEU 130 H LEU 130 10.647 -0.674 -4.751 989 HA LEU 130 HA LEU 130 11.827 1.699 -3.620 990 1HB LEU 130 1HB LEU 130 11.190 -0.108 -2.156 991 2HB LEU 130 2HB LEU 130 12.204 -1.233 -3.038 992 HG LEU 130 HG LEU 130 14.201 -0.197 -2.217 993 1HD1 LEU 130 1HD1 LEU 130 12.409 1.855 -0.934 994 2HD1 LEU 130 2HD1 LEU 130 14.152 1.722 -0.702 995 3HD1 LEU 130 3HD1 LEU 130 13.502 2.128 -2.291 996 1HD2 LEU 130 1HD2 LEU 130 13.027 -1.802 -0.744 997 2HD2 LEU 130 2HD2 LEU 130 13.994 -0.623 0.147 998 3HD2 LEU 130 3HD2 LEU 130 12.240 -0.441 0.059 999 H ILE 131 H ILE 131 13.620 2.634 -4.265 1000 HA ILE 131 HA ILE 131 15.338 1.287 -6.190 1001 HB ILE 131 HB ILE 131 15.546 4.106 -5.122 1002 1HG1 ILE 131 1HG1 ILE 131 14.322 3.171 -7.733 1003 2HG1 ILE 131 2HG1 ILE 131 13.377 3.601 -6.286 1004 1HG2 ILE 131 1HG2 ILE 131 17.620 3.247 -6.083 1005 2HG2 ILE 131 2HG2 ILE 131 16.762 2.815 -7.563 1006 3HG2 ILE 131 3HG2 ILE 131 16.923 4.509 -7.100 1007 1HD1 ILE 131 1HD1 ILE 131 15.201 5.443 -7.829 1008 2HD1 ILE 131 2HD1 ILE 131 13.439 5.427 -7.891 1009 3HD1 ILE 131 3HD1 ILE 131 14.265 5.873 -6.397 1010 H SER 132 H SER 132 15.793 3.079 -3.125 1011 HA SER 132 HA SER 132 17.654 1.129 -2.171 1012 1HB SER 132 1HB SER 132 19.661 2.423 -2.166 1013 2HB SER 132 2HB SER 132 19.031 2.454 -3.812 1014 HG SER 132 HG SER 132 18.926 4.493 -1.855 1015 H VAL 133 H VAL 133 18.624 1.760 -0.068 1016 HA VAL 133 HA VAL 133 16.737 3.444 1.449 1017 HB VAL 133 HB VAL 133 16.649 1.214 2.266 1018 1HG1 VAL 133 1HG1 VAL 133 18.698 0.365 1.256 1019 2HG1 VAL 133 2HG1 VAL 133 19.663 1.284 2.413 1020 3HG1 VAL 133 3HG1 VAL 133 18.637 -0.037 2.972 1021 1HG2 VAL 133 1HG2 VAL 133 16.760 3.010 3.965 1022 2HG2 VAL 133 2HG2 VAL 133 17.368 1.465 4.555 1023 3HG2 VAL 133 3HG2 VAL 133 18.498 2.739 4.099 1024 H LYS 134 H LYS 134 17.449 5.183 2.501 1025 HA LYS 134 HA LYS 134 18.891 6.955 2.847 1026 1HB LYS 134 1HB LYS 134 19.095 4.892 4.731 1027 2HB LYS 134 2HB LYS 134 20.748 5.415 4.444 1028 1HG LYS 134 1HG LYS 134 20.144 7.708 4.980 1029 2HG LYS 134 2HG LYS 134 18.450 7.209 5.220 1030 1HD LYS 134 1HD LYS 134 19.229 5.680 7.022 1031 2HD LYS 134 2HD LYS 134 20.855 6.342 6.833 1032 1HE LYS 134 1HE LYS 134 19.709 7.425 8.685 1033 2HE LYS 134 2HE LYS 134 19.997 8.576 7.381 1034 1HZ LYS 134 1HZ LYS 134 17.699 8.246 6.659 1035 2HZ LYS 134 2HZ LYS 134 17.432 7.194 7.956 1036 3HZ LYS 134 3HZ LYS 134 17.775 8.824 8.246 1037 H LYS 135 H LYS 135 19.585 6.641 0.487 1038 HA LYS 135 HA LYS 135 21.216 6.833 -1.070 1039 1HB LYS 135 1HB LYS 135 22.904 7.196 1.395 1040 2HB LYS 135 2HB LYS 135 23.521 7.399 -0.238 1041 1HG LYS 135 1HG LYS 135 21.745 9.140 -0.582 1042 2HG LYS 135 2HG LYS 135 21.408 9.027 1.145 1043 1HD LYS 135 1HD LYS 135 24.118 9.661 -0.010 1044 2HD LYS 135 2HD LYS 135 22.957 10.882 0.513 1045 1HE LYS 135 1HE LYS 135 24.149 8.724 2.255 1046 2HE LYS 135 2HE LYS 135 24.638 10.417 2.243 1047 1HZ LYS 135 1HZ LYS 135 22.389 11.012 2.944 1048 2HZ LYS 135 2HZ LYS 135 21.961 9.377 2.999 1049 3HZ LYS 135 3HZ LYS 135 23.134 9.981 4.059 1050 H SER 136 H SER 136 20.424 4.275 -0.455 1051 HA SER 136 HA SER 136 20.998 2.072 -0.566 1052 1HB SER 136 1HB SER 136 22.649 1.529 -2.302 1053 2HB SER 136 2HB SER 136 21.572 2.817 -2.838 1054 HG SER 136 HG SER 136 24.244 2.845 -2.591 1055 H SER 137 H SER 137 21.653 2.503 1.808 1056 HA SER 137 HA SER 137 24.449 2.457 2.416 1057 1HB SER 137 1HB SER 137 22.876 3.442 3.996 1058 2HB SER 137 2HB SER 137 22.032 1.902 4.154 1059 HG SER 137 HG SER 137 24.215 2.776 5.454 No H/Q in entry = 1059 Start of MODEL 2 1 H1 PHE 1 H1 PHE 1 -24.957 9.449 4.348 2 H2 PHE 1 H2 PHE 1 -24.774 10.922 3.539 3 H3 PHE 1 H3 PHE 1 -24.582 9.466 2.699 4 HA PHE 1 HA PHE 1 -22.448 10.453 3.141 5 1HB PHE 1 1HB PHE 1 -23.240 10.177 6.049 6 2HB PHE 1 2HB PHE 1 -21.671 10.709 5.455 7 HD1 PHE 1 HD1 PHE 1 -21.412 12.907 4.422 8 HD2 PHE 1 HD2 PHE 1 -25.136 11.642 6.049 9 HE1 PHE 1 HE1 PHE 1 -22.212 15.234 4.394 10 HE2 PHE 1 HE2 PHE 1 -25.943 13.967 6.022 11 HZ PHE 1 HZ PHE 1 -24.473 15.769 5.218 12 H ASN 2 H ASN 2 -23.585 8.188 5.655 13 HA ASN 2 HA ASN 2 -21.412 6.407 5.311 14 1HB ASN 2 1HB ASN 2 -22.714 4.870 6.741 15 2HB ASN 2 2HB ASN 2 -22.657 6.507 7.408 16 1HD2 ASN 2 1HD2 ASN 2 -24.643 4.083 5.905 17 2HD2 ASN 2 2HD2 ASN 2 -26.165 4.828 6.247 18 H LYS 3 H LYS 3 -24.328 6.825 3.556 19 HA LYS 3 HA LYS 3 -24.781 4.229 2.627 20 1HB LYS 3 1HB LYS 3 -26.340 6.078 2.210 21 2HB LYS 3 2HB LYS 3 -25.159 6.852 1.163 22 1HG LYS 3 1HG LYS 3 -26.800 5.767 -0.194 23 2HG LYS 3 2HG LYS 3 -25.277 4.889 -0.344 24 1HD LYS 3 1HD LYS 3 -26.097 3.262 1.331 25 2HD LYS 3 2HD LYS 3 -27.641 4.114 1.365 26 1HE LYS 3 1HE LYS 3 -27.928 3.662 -1.030 27 2HE LYS 3 2HE LYS 3 -26.400 2.783 -1.040 28 1HZ LYS 3 1HZ LYS 3 -27.351 1.223 0.562 29 2HZ LYS 3 2HZ LYS 3 -28.825 2.052 0.512 30 3HZ LYS 3 3HZ LYS 3 -28.251 1.265 -0.870 31 H LYS 4 H LYS 4 -22.589 6.756 1.516 32 HA LYS 4 HA LYS 4 -21.576 5.165 -0.663 33 1HB LYS 4 1HB LYS 4 -20.666 7.792 0.522 34 2HB LYS 4 2HB LYS 4 -19.894 7.027 -0.859 35 1HG LYS 4 1HG LYS 4 -22.784 7.871 -0.757 36 2HG LYS 4 2HG LYS 4 -21.478 8.808 -1.488 37 1HD LYS 4 1HD LYS 4 -21.034 6.953 -3.038 38 2HD LYS 4 2HD LYS 4 -22.365 6.043 -2.317 39 1HE LYS 4 1HE LYS 4 -23.083 7.113 -4.380 40 2HE LYS 4 2HE LYS 4 -23.929 7.806 -2.997 41 1HZ LYS 4 1HZ LYS 4 -21.572 9.013 -4.343 42 2HZ LYS 4 2HZ LYS 4 -23.177 9.504 -4.556 43 3HZ LYS 4 3HZ LYS 4 -22.430 9.686 -3.050 44 H ALA 5 H ALA 5 -20.637 5.954 2.624 45 HA ALA 5 HA ALA 5 -18.005 5.040 2.597 46 1HB ALA 5 1HB ALA 5 -19.100 6.289 4.461 47 2HB ALA 5 2HB ALA 5 -19.914 4.791 4.916 48 3HB ALA 5 3HB ALA 5 -18.153 4.893 4.979 49 H ASP 6 H ASP 6 -20.988 3.292 3.441 50 HA ASP 6 HA ASP 6 -19.717 0.780 3.743 51 1HB ASP 6 1HB ASP 6 -22.615 1.460 3.188 52 2HB ASP 6 2HB ASP 6 -22.034 -0.150 3.601 53 H GLU 7 H GLU 7 -21.185 2.448 1.012 54 HA GLU 7 HA GLU 7 -21.304 0.332 -0.797 55 1HB GLU 7 1HB GLU 7 -20.983 3.289 -1.068 56 2HB GLU 7 2HB GLU 7 -20.680 2.295 -2.486 57 1HG GLU 7 1HG GLU 7 -23.226 2.341 -0.880 58 2HG GLU 7 2HG GLU 7 -22.968 3.127 -2.437 59 H ASN 8 H ASN 8 -18.623 2.233 0.354 60 HA ASN 8 HA ASN 8 -16.736 1.262 -1.561 61 1HB ASN 8 1HB ASN 8 -16.119 2.445 1.152 62 2HB ASN 8 2HB ASN 8 -15.078 2.422 -0.296 63 1HD2 ASN 8 1HD2 ASN 8 -16.087 4.629 1.387 64 2HD2 ASN 8 2HD2 ASN 8 -16.874 5.712 0.299 65 H LYS 9 H LYS 9 -17.655 0.443 1.737 66 HA LYS 9 HA LYS 9 -15.661 -1.387 2.353 67 1HB LYS 9 1HB LYS 9 -17.755 -0.429 3.695 68 2HB LYS 9 2HB LYS 9 -18.446 -1.977 3.231 69 1HG LYS 9 1HG LYS 9 -15.802 -1.716 4.637 70 2HG LYS 9 2HG LYS 9 -17.339 -1.892 5.486 71 1HD LYS 9 1HD LYS 9 -16.279 -3.847 3.447 72 2HD LYS 9 2HD LYS 9 -16.102 -4.029 5.192 73 1HE LYS 9 1HE LYS 9 -18.548 -4.025 5.423 74 2HE LYS 9 2HE LYS 9 -18.704 -3.884 3.673 75 1HZ LYS 9 1HZ LYS 9 -17.578 -6.014 3.445 76 2HZ LYS 9 2HZ LYS 9 -17.446 -6.150 5.126 77 3HZ LYS 9 3HZ LYS 9 -18.971 -6.168 4.392 78 H VAL 10 H VAL 10 -18.684 -1.885 0.564 79 HA VAL 10 HA VAL 10 -18.345 -4.716 0.369 80 HB VAL 10 HB VAL 10 -20.177 -4.604 -1.319 81 1HG1 VAL 10 1HG1 VAL 10 -20.639 -3.180 1.298 82 2HG1 VAL 10 2HG1 VAL 10 -21.904 -3.875 0.284 83 3HG1 VAL 10 3HG1 VAL 10 -20.691 -4.922 1.023 84 1HG2 VAL 10 1HG2 VAL 10 -20.070 -1.647 -0.714 85 2HG2 VAL 10 2HG2 VAL 10 -19.718 -2.421 -2.274 86 3HG2 VAL 10 3HG2 VAL 10 -21.364 -2.467 -1.609 87 H LYS 11 H LYS 11 -17.886 -2.041 -1.960 88 HA LYS 11 HA LYS 11 -17.061 -3.693 -4.093 89 1HB LYS 11 1HB LYS 11 -16.292 -1.680 -5.172 90 2HB LYS 11 2HB LYS 11 -17.808 -1.339 -4.350 91 1HG LYS 11 1HG LYS 11 -16.603 -0.273 -2.531 92 2HG LYS 11 2HG LYS 11 -15.066 -0.650 -3.310 93 1HD LYS 11 1HD LYS 11 -15.467 1.575 -3.899 94 2HD LYS 11 2HD LYS 11 -15.980 0.660 -5.316 95 1HE LYS 11 1HE LYS 11 -17.853 1.593 -3.146 96 2HE LYS 11 2HE LYS 11 -17.532 2.503 -4.621 97 1HZ LYS 11 1HZ LYS 11 -18.293 0.496 -5.865 98 2HZ LYS 11 2HZ LYS 11 -18.798 -0.169 -4.394 99 3HZ LYS 11 3HZ LYS 11 -19.500 1.260 -4.961 100 H GLY 12 H GLY 12 -15.354 -2.379 -1.356 101 1HA GLY 12 1HA GLY 12 -13.131 -2.448 -0.738 102 2HA GLY 12 2HA GLY 12 -12.725 -2.868 -2.397 103 H GLU 13 H GLU 13 -14.784 -4.464 0.019 104 HA GLU 13 HA GLU 13 -13.023 -6.526 0.694 105 1HB GLU 13 1HB GLU 13 -15.119 -5.921 1.921 106 2HB GLU 13 2HB GLU 13 -16.042 -6.671 0.627 107 1HG GLU 13 1HG GLU 13 -15.887 -8.206 2.444 108 2HG GLU 13 2HG GLU 13 -14.901 -8.812 1.115 109 H ALA 14 H ALA 14 -15.152 -6.098 -2.016 110 HA ALA 14 HA ALA 14 -15.033 -8.828 -2.897 111 1HB ALA 14 1HB ALA 14 -16.312 -8.137 -4.767 112 2HB ALA 14 2HB ALA 14 -16.931 -7.256 -3.370 113 3HB ALA 14 3HB ALA 14 -15.875 -6.445 -4.528 114 H PHE 15 H PHE 15 -13.437 -5.786 -3.796 115 HA PHE 15 HA PHE 15 -12.061 -6.691 -6.041 116 1HB PHE 15 1HB PHE 15 -11.847 -4.407 -5.783 117 2HB PHE 15 2HB PHE 15 -11.577 -4.526 -4.031 118 HD1 PHE 15 HD1 PHE 15 -9.494 -3.922 -3.321 119 HD2 PHE 15 HD2 PHE 15 -9.890 -5.693 -7.170 120 HE1 PHE 15 HE1 PHE 15 -7.067 -3.691 -3.670 121 HE2 PHE 15 HE2 PHE 15 -7.464 -5.480 -7.521 122 HZ PHE 15 HZ PHE 15 -6.047 -4.481 -5.768 123 H LEU 16 H LEU 16 -10.971 -6.625 -2.649 124 HA LEU 16 HA LEU 16 -8.522 -7.942 -3.128 125 1HB LEU 16 1HB LEU 16 -8.379 -8.228 -0.749 126 2HB LEU 16 2HB LEU 16 -9.007 -6.630 -1.110 127 HG LEU 16 HG LEU 16 -11.338 -7.882 -0.773 128 1HD1 LEU 16 1HD1 LEU 16 -10.267 -10.064 -0.353 129 2HD1 LEU 16 2HD1 LEU 16 -9.471 -9.378 1.063 130 3HD1 LEU 16 3HD1 LEU 16 -11.229 -9.504 1.013 131 1HD2 LEU 16 1HD2 LEU 16 -9.575 -6.886 1.460 132 2HD2 LEU 16 2HD2 LEU 16 -10.598 -5.895 0.418 133 3HD2 LEU 16 3HD2 LEU 16 -11.329 -7.055 1.528 134 H THR 17 H THR 17 -11.767 -9.113 -2.431 135 HA THR 17 HA THR 17 -11.207 -11.785 -1.860 136 HB THR 17 HB THR 17 -13.591 -10.473 -3.157 137 HG1 THR 17 HG1 THR 17 -12.767 -10.801 -0.658 138 1HG2 THR 17 1HG2 THR 17 -13.305 -13.385 -2.387 139 2HG2 THR 17 2HG2 THR 17 -14.820 -12.584 -2.853 140 3HG2 THR 17 3HG2 THR 17 -13.503 -12.748 -4.032 141 H GLU 18 H GLU 18 -11.869 -10.232 -4.984 142 HA GLU 18 HA GLU 18 -11.413 -12.608 -6.505 143 1HB GLU 18 1HB GLU 18 -11.457 -9.709 -7.374 144 2HB GLU 18 2HB GLU 18 -11.470 -11.093 -8.457 145 1HG GLU 18 1HG GLU 18 -13.603 -10.485 -6.423 146 2HG GLU 18 2HG GLU 18 -13.691 -10.072 -8.134 147 H ASN 19 H ASN 19 -9.500 -9.938 -5.375 148 HA ASN 19 HA ASN 19 -7.264 -10.104 -7.011 149 1HB ASN 19 1HB ASN 19 -7.310 -8.252 -5.583 150 2HB ASN 19 2HB ASN 19 -7.656 -9.236 -4.159 151 1HD2 ASN 19 1HD2 ASN 19 -5.967 -10.649 -3.397 152 2HD2 ASN 19 2HD2 ASN 19 -4.317 -10.205 -3.617 153 H LYS 20 H LYS 20 -8.230 -12.117 -4.338 154 HA LYS 20 HA LYS 20 -5.970 -13.341 -3.487 155 1HB LYS 20 1HB LYS 20 -8.581 -14.704 -4.156 156 2HB LYS 20 2HB LYS 20 -7.318 -15.390 -3.143 157 1HG LYS 20 1HG LYS 20 -8.789 -12.831 -2.545 158 2HG LYS 20 2HG LYS 20 -9.193 -14.409 -1.868 159 1HD LYS 20 1HD LYS 20 -6.966 -14.541 -0.852 160 2HD LYS 20 2HD LYS 20 -6.569 -12.957 -1.526 161 1HE LYS 20 1HE LYS 20 -8.343 -11.931 -0.220 162 2HE LYS 20 2HE LYS 20 -8.817 -13.508 0.410 163 1HZ LYS 20 1HZ LYS 20 -6.640 -13.688 1.464 164 2HZ LYS 20 2HZ LYS 20 -6.212 -12.159 0.879 165 3HZ LYS 20 3HZ LYS 20 -7.468 -12.315 2.002 166 H ASN 21 H ASN 21 -7.187 -13.476 -6.691 167 HA ASN 21 HA ASN 21 -6.097 -15.958 -7.494 168 1HB ASN 21 1HB ASN 21 -6.923 -13.518 -9.059 169 2HB ASN 21 2HB ASN 21 -6.395 -15.021 -9.813 170 1HD2 ASN 21 1HD2 ASN 21 -8.234 -14.812 -6.846 171 2HD2 ASN 21 2HD2 ASN 21 -9.672 -15.533 -7.468 172 H LYS 22 H LYS 22 -4.763 -12.696 -7.392 173 HA LYS 22 HA LYS 22 -2.597 -12.852 -9.050 174 1HB LYS 22 1HB LYS 22 -2.454 -11.681 -6.275 175 2HB LYS 22 2HB LYS 22 -1.495 -11.222 -7.672 176 1HG LYS 22 1HG LYS 22 -4.326 -10.567 -7.018 177 2HG LYS 22 2HG LYS 22 -3.025 -9.516 -7.566 178 1HD LYS 22 1HD LYS 22 -3.160 -10.759 -9.781 179 2HD LYS 22 2HD LYS 22 -4.673 -11.444 -9.179 180 1HE LYS 22 1HE LYS 22 -5.594 -9.205 -8.909 181 2HE LYS 22 2HE LYS 22 -4.075 -8.500 -9.462 182 1HZ LYS 22 1HZ LYS 22 -5.858 -10.247 -11.072 183 2HZ LYS 22 2HZ LYS 22 -5.712 -8.568 -11.232 184 3HZ LYS 22 3HZ LYS 22 -4.402 -9.571 -11.604 185 HA PRO 23 HA PRO 23 -0.406 -16.444 -7.478 186 1HB PRO 23 1HB PRO 23 1.771 -15.295 -9.142 187 2HB PRO 23 2HB PRO 23 1.093 -16.929 -9.144 188 1HG PRO 23 1HG PRO 23 0.532 -15.213 -11.107 189 2HG PRO 23 2HG PRO 23 -0.701 -16.326 -10.481 190 1HD PRO 23 1HD PRO 23 -0.346 -13.401 -9.968 191 2HD PRO 23 2HD PRO 23 -1.841 -14.338 -10.178 192 H GLY 24 H GLY 24 0.818 -16.667 -5.691 193 1HA GLY 24 1HA GLY 24 2.897 -14.727 -5.087 194 2HA GLY 24 2HA GLY 24 2.594 -16.228 -4.232 195 H VAL 25 H VAL 25 -0.374 -14.826 -4.409 196 HA VAL 25 HA VAL 25 -0.350 -12.692 -2.643 197 HB VAL 25 HB VAL 25 -2.423 -14.806 -3.164 198 1HG1 VAL 25 1HG1 VAL 25 -2.624 -14.182 -0.779 199 2HG1 VAL 25 2HG1 VAL 25 -2.770 -12.489 -1.260 200 3HG1 VAL 25 3HG1 VAL 25 -4.006 -13.653 -1.739 201 1HG2 VAL 25 1HG2 VAL 25 -1.835 -12.808 -4.701 202 2HG2 VAL 25 2HG2 VAL 25 -3.531 -13.160 -4.365 203 3HG2 VAL 25 3HG2 VAL 25 -2.716 -11.849 -3.510 204 H VAL 26 H VAL 26 0.609 -12.586 -0.747 205 HA VAL 26 HA VAL 26 0.302 -14.836 1.127 206 HB VAL 26 HB VAL 26 2.563 -14.966 0.450 207 1HG1 VAL 26 1HG1 VAL 26 2.530 -11.980 0.641 208 2HG1 VAL 26 2HG1 VAL 26 4.044 -12.886 0.661 209 3HG1 VAL 26 3HG1 VAL 26 2.964 -13.003 -0.731 210 1HG2 VAL 26 1HG2 VAL 26 2.158 -15.018 2.912 211 2HG2 VAL 26 2HG2 VAL 26 3.796 -14.525 2.460 212 3HG2 VAL 26 3HG2 VAL 26 2.617 -13.311 2.969 213 H VAL 27 H VAL 27 -0.370 -14.324 3.119 214 HA VAL 27 HA VAL 27 -1.062 -11.567 3.662 215 HB VAL 27 HB VAL 27 -2.712 -13.272 4.183 216 1HG1 VAL 27 1HG1 VAL 27 -0.658 -14.373 6.098 217 2HG1 VAL 27 2HG1 VAL 27 -2.333 -14.911 5.972 218 3HG1 VAL 27 3HG1 VAL 27 -1.227 -15.144 4.618 219 1HG2 VAL 27 1HG2 VAL 27 -2.611 -11.237 5.579 220 2HG2 VAL 27 2HG2 VAL 27 -3.250 -12.628 6.455 221 3HG2 VAL 27 3HG2 VAL 27 -1.590 -12.102 6.728 222 H LEU 28 H LEU 28 -0.250 -10.303 5.295 223 HA LEU 28 HA LEU 28 2.287 -11.202 6.450 224 1HB LEU 28 1HB LEU 28 1.088 -8.448 6.163 225 2HB LEU 28 2HB LEU 28 2.619 -8.776 6.949 226 HG LEU 28 HG LEU 28 1.965 -9.181 4.033 227 1HD1 LEU 28 1HD1 LEU 28 2.368 -6.861 4.717 228 2HD1 LEU 28 2HD1 LEU 28 3.920 -7.342 5.405 229 3HD1 LEU 28 3HD1 LEU 28 3.646 -7.474 3.668 230 1HD2 LEU 28 1HD2 LEU 28 4.477 -9.842 5.570 231 2HD2 LEU 28 2HD2 LEU 28 3.404 -10.984 4.759 232 3HD2 LEU 28 3HD2 LEU 28 4.344 -9.830 3.811 233 HA PRO 29 HA PRO 29 0.988 -11.406 10.670 234 1HB PRO 29 1HB PRO 29 2.695 -9.051 11.329 235 2HB PRO 29 2HB PRO 29 2.647 -10.651 12.079 236 1HG PRO 29 1HG PRO 29 4.636 -9.976 10.440 237 2HG PRO 29 2HG PRO 29 3.954 -11.613 10.423 238 1HD PRO 29 1HD PRO 29 3.562 -9.371 8.490 239 2HD PRO 29 2HD PRO 29 3.648 -11.127 8.192 240 H SER 30 H SER 30 1.083 -8.216 9.191 241 HA SER 30 HA SER 30 -0.882 -7.145 11.030 242 1HB SER 30 1HB SER 30 0.861 -5.642 10.280 243 2HB SER 30 2HB SER 30 0.446 -5.939 8.594 244 HG SER 30 HG SER 30 -1.623 -5.060 10.202 245 H GLY 31 H GLY 31 -0.922 -8.928 8.144 246 1HA GLY 31 1HA GLY 31 -3.782 -8.328 7.871 247 2HA GLY 31 2HA GLY 31 -3.029 -9.847 7.415 248 H LEU 32 H LEU 32 -0.838 -7.946 6.173 249 HA LEU 32 HA LEU 32 -2.318 -6.858 3.931 250 1HB LEU 32 1HB LEU 32 0.596 -6.857 4.648 251 2HB LEU 32 2HB LEU 32 0.001 -6.234 3.119 252 HG LEU 32 HG LEU 32 -1.558 -4.777 4.609 253 1HD1 LEU 32 1HD1 LEU 32 -0.582 -6.154 6.635 254 2HD1 LEU 32 2HD1 LEU 32 0.668 -4.910 6.564 255 3HD1 LEU 32 3HD1 LEU 32 -1.021 -4.456 6.791 256 1HD2 LEU 32 1HD2 LEU 32 0.382 -4.074 3.141 257 2HD2 LEU 32 2HD2 LEU 32 -0.008 -3.008 4.491 258 3HD2 LEU 32 3HD2 LEU 32 1.369 -4.103 4.603 259 H GLN 33 H GLN 33 -2.378 -7.549 1.916 260 HA GLN 33 HA GLN 33 -1.014 -10.073 1.240 261 1HB GLN 33 1HB GLN 33 -3.670 -8.974 0.296 262 2HB GLN 33 2HB GLN 33 -2.880 -10.358 -0.439 263 1HG GLN 33 1HG GLN 33 -4.536 -11.186 1.038 264 2HG GLN 33 2HG GLN 33 -2.948 -11.486 1.796 265 1HE2 GLN 33 1HE2 GLN 33 -3.851 -11.612 3.846 266 2HE2 GLN 33 2HE2 GLN 33 -4.427 -10.220 4.692 267 H TYR 34 H TYR 34 0.034 -10.158 -0.798 268 HA TYR 34 HA TYR 34 -0.130 -7.901 -2.586 269 1HB TYR 34 1HB TYR 34 2.273 -7.287 -2.371 270 2HB TYR 34 2HB TYR 34 1.316 -6.916 -0.941 271 HD1 TYR 34 HD1 TYR 34 4.222 -8.569 -2.180 272 HD2 TYR 34 HD2 TYR 34 1.388 -8.617 0.989 273 HE1 TYR 34 HE1 TYR 34 5.790 -9.853 -0.801 274 HE2 TYR 34 HE2 TYR 34 2.946 -9.899 2.371 275 HH TYR 34 HH TYR 34 4.890 -11.415 2.048 276 H LYS 35 H LYS 35 1.666 -8.013 -4.284 277 HA LYS 35 HA LYS 35 2.207 -10.833 -4.987 278 1HB LYS 35 1HB LYS 35 0.453 -9.485 -6.349 279 2HB LYS 35 2HB LYS 35 1.838 -8.631 -7.010 280 1HG LYS 35 1HG LYS 35 2.692 -11.059 -7.527 281 2HG LYS 35 2HG LYS 35 0.965 -11.447 -7.418 282 1HD LYS 35 1HD LYS 35 0.475 -9.738 -9.096 283 2HD LYS 35 2HD LYS 35 2.194 -9.344 -9.206 284 1HE LYS 35 1HE LYS 35 0.961 -12.023 -9.854 285 2HE LYS 35 2HE LYS 35 1.460 -10.814 -11.037 286 1HZ LYS 35 1HZ LYS 35 3.735 -11.028 -10.219 287 2HZ LYS 35 2HZ LYS 35 3.244 -12.216 -9.119 288 3HZ LYS 35 3HZ LYS 35 3.143 -12.509 -10.782 289 H VAL 36 H VAL 36 4.317 -11.252 -4.930 290 HA VAL 36 HA VAL 36 6.288 -9.168 -4.817 291 HB VAL 36 HB VAL 36 6.654 -12.162 -4.899 292 1HG1 VAL 36 1HG1 VAL 36 8.563 -9.903 -4.357 293 2HG1 VAL 36 2HG1 VAL 36 8.868 -11.554 -3.817 294 3HG1 VAL 36 3HG1 VAL 36 8.713 -11.204 -5.539 295 1HG2 VAL 36 1HG2 VAL 36 6.317 -10.198 -2.657 296 2HG2 VAL 36 2HG2 VAL 36 5.432 -11.693 -2.954 297 3HG2 VAL 36 3HG2 VAL 36 7.110 -11.754 -2.417 298 H ILE 37 H ILE 37 7.423 -8.317 -6.388 299 HA ILE 37 HA ILE 37 7.423 -9.604 -9.023 300 HB ILE 37 HB ILE 37 8.132 -6.766 -8.262 301 1HG1 ILE 37 1HG1 ILE 37 5.735 -7.837 -9.768 302 2HG1 ILE 37 2HG1 ILE 37 5.717 -7.376 -8.068 303 1HG2 ILE 37 1HG2 ILE 37 7.961 -8.101 -10.961 304 2HG2 ILE 37 2HG2 ILE 37 8.123 -6.363 -10.705 305 3HG2 ILE 37 3HG2 ILE 37 9.409 -7.455 -10.189 306 1HD1 ILE 37 1HD1 ILE 37 6.288 -5.544 -10.387 307 2HD1 ILE 37 2HD1 ILE 37 4.784 -5.631 -9.469 308 3HD1 ILE 37 3HD1 ILE 37 6.265 -5.082 -8.685 309 H ASN 38 H ASN 38 9.740 -7.576 -7.175 310 HA ASN 38 HA ASN 38 11.806 -9.592 -7.570 311 1HB ASN 38 1HB ASN 38 12.021 -8.245 -9.584 312 2HB ASN 38 2HB ASN 38 12.063 -6.767 -8.627 313 1HD2 ASN 38 1HD2 ASN 38 13.919 -6.215 -7.528 314 2HD2 ASN 38 2HD2 ASN 38 15.435 -6.996 -7.802 315 H SER 39 H SER 39 11.533 -9.713 -5.259 316 HA SER 39 HA SER 39 12.631 -7.422 -3.780 317 1HB SER 39 1HB SER 39 10.447 -8.076 -2.990 318 2HB SER 39 2HB SER 39 10.965 -9.753 -2.823 319 HG SER 39 HG SER 39 12.066 -9.258 -1.051 320 H GLY 40 H GLY 40 14.313 -7.666 -2.322 321 1HA GLY 40 1HA GLY 40 15.577 -10.309 -2.136 322 2HA GLY 40 2HA GLY 40 15.879 -8.948 -1.069 323 H ASN 41 H ASN 41 17.512 -7.546 -1.517 324 HA ASN 41 HA ASN 41 19.585 -8.389 -3.193 325 1HB ASN 41 1HB ASN 41 19.537 -6.610 -4.918 326 2HB ASN 41 2HB ASN 41 18.171 -7.714 -5.047 327 1HD2 ASN 41 1HD2 ASN 41 16.102 -6.990 -4.421 328 2HD2 ASN 41 2HD2 ASN 41 15.736 -5.306 -4.328 329 H GLY 42 H GLY 42 18.140 -5.275 -2.173 330 1HA GLY 42 1HA GLY 42 19.308 -3.375 -1.430 331 2HA GLY 42 2HA GLY 42 20.780 -4.328 -1.386 332 H VAL 43 H VAL 43 21.047 -3.141 0.609 333 HA VAL 43 HA VAL 43 20.095 -4.675 2.896 334 HB VAL 43 HB VAL 43 22.023 -2.372 3.046 335 1HG1 VAL 43 1HG1 VAL 43 21.524 -4.857 4.655 336 2HG1 VAL 43 2HG1 VAL 43 23.013 -3.926 4.810 337 3HG1 VAL 43 3HG1 VAL 43 21.462 -3.173 5.177 338 1HG2 VAL 43 1HG2 VAL 43 22.679 -5.185 2.180 339 2HG2 VAL 43 2HG2 VAL 43 22.861 -3.713 1.226 340 3HG2 VAL 43 3HG2 VAL 43 23.869 -3.971 2.650 341 H LYS 44 H LYS 44 19.759 -3.184 4.958 342 HA LYS 44 HA LYS 44 18.877 -0.601 4.955 343 1HB LYS 44 1HB LYS 44 16.482 -0.666 4.644 344 2HB LYS 44 2HB LYS 44 17.265 -1.268 3.194 345 1HG LYS 44 1HG LYS 44 16.637 -3.475 3.627 346 2HG LYS 44 2HG LYS 44 16.277 -3.132 5.319 347 1HD LYS 44 1HD LYS 44 14.741 -1.967 3.003 348 2HD LYS 44 2HD LYS 44 14.266 -3.434 3.860 349 1HE LYS 44 1HE LYS 44 14.116 -2.162 5.945 350 2HE LYS 44 2HE LYS 44 14.590 -0.697 5.086 351 1HZ LYS 44 1HZ LYS 44 12.591 -0.903 3.731 352 2HZ LYS 44 2HZ LYS 44 12.135 -2.290 4.581 353 3HZ LYS 44 3HZ LYS 44 12.203 -0.797 5.373 354 HA PRO 45 HA PRO 45 17.943 -1.659 9.153 355 1HB PRO 45 1HB PRO 45 16.659 0.817 9.664 356 2HB PRO 45 2HB PRO 45 18.357 0.416 9.916 357 1HG PRO 45 1HG PRO 45 17.365 2.230 8.047 358 2HG PRO 45 2HG PRO 45 18.991 1.530 8.054 359 1HD PRO 45 1HD PRO 45 16.611 0.778 6.432 360 2HD PRO 45 2HD PRO 45 18.331 0.735 6.007 361 H GLY 46 H GLY 46 16.170 -1.441 10.813 362 1HA GLY 46 1HA GLY 46 14.130 -2.207 11.528 363 2HA GLY 46 2HA GLY 46 13.863 -2.819 9.900 364 H LYS 47 H LYS 47 11.712 -1.826 11.167 365 HA LYS 47 HA LYS 47 10.498 -0.147 9.436 366 1HB LYS 47 1HB LYS 47 10.014 -0.103 12.413 367 2HB LYS 47 2HB LYS 47 8.875 0.370 11.161 368 1HG LYS 47 1HG LYS 47 8.785 -1.912 10.345 369 2HG LYS 47 2HG LYS 47 9.982 -2.404 11.543 370 1HD LYS 47 1HD LYS 47 7.261 -1.255 12.170 371 2HD LYS 47 2HD LYS 47 7.675 -2.970 12.214 372 1HE LYS 47 1HE LYS 47 8.895 -0.796 13.913 373 2HE LYS 47 2HE LYS 47 7.726 -2.000 14.451 374 1HZ LYS 47 1HZ LYS 47 9.354 -3.730 13.936 375 2HZ LYS 47 2HZ LYS 47 10.475 -2.554 13.470 376 3HZ LYS 47 3HZ LYS 47 9.955 -2.637 15.079 377 H SER 48 H SER 48 13.014 0.882 11.517 378 HA SER 48 HA SER 48 12.165 3.656 11.559 379 1HB SER 48 1HB SER 48 13.395 2.756 13.482 380 2HB SER 48 2HB SER 48 14.767 2.374 12.442 381 HG SER 48 HG SER 48 15.295 4.308 13.245 382 H ASP 49 H ASP 49 13.141 1.819 9.166 383 HA ASP 49 HA ASP 49 15.313 3.286 8.003 384 1HB ASP 49 1HB ASP 49 15.051 1.811 6.124 385 2HB ASP 49 2HB ASP 49 14.860 0.863 7.596 386 H THR 50 H THR 50 15.264 4.569 6.135 387 HA THR 50 HA THR 50 12.629 5.681 5.377 388 HB THR 50 HB THR 50 15.221 7.234 5.682 389 HG1 THR 50 HG1 THR 50 14.495 7.221 7.695 390 1HG2 THR 50 1HG2 THR 50 12.451 8.152 4.901 391 2HG2 THR 50 2HG2 THR 50 13.836 9.204 5.187 392 3HG2 THR 50 3HG2 THR 50 13.855 8.069 3.837 393 H VAL 51 H VAL 51 12.290 5.280 3.242 394 HA VAL 51 HA VAL 51 14.665 5.105 1.502 395 HB VAL 51 HB VAL 51 13.657 3.340 0.232 396 1HG1 VAL 51 1HG1 VAL 51 14.892 2.714 2.260 397 2HG1 VAL 51 2HG1 VAL 51 13.381 2.716 3.170 398 3HG1 VAL 51 3HG1 VAL 51 13.625 1.551 1.866 399 1HG2 VAL 51 1HG2 VAL 51 11.323 4.072 0.394 400 2HG2 VAL 51 2HG2 VAL 51 11.494 2.364 0.808 401 3HG2 VAL 51 3HG2 VAL 51 11.283 3.564 2.085 402 H THR 52 H THR 52 14.329 5.556 -0.744 403 HA THR 52 HA THR 52 12.119 7.450 -1.216 404 HB THR 52 HB THR 52 14.824 7.348 -2.580 405 HG1 THR 52 HG1 THR 52 13.884 8.679 -0.338 406 1HG2 THR 52 1HG2 THR 52 13.037 8.188 -4.035 407 2HG2 THR 52 2HG2 THR 52 12.585 9.366 -2.802 408 3HG2 THR 52 3HG2 THR 52 14.158 9.475 -3.592 409 H VAL 53 H VAL 53 10.626 6.724 -2.599 410 HA VAL 53 HA VAL 53 11.450 4.951 -4.776 411 HB VAL 53 HB VAL 53 9.695 3.367 -4.361 412 1HG1 VAL 53 1HG1 VAL 53 11.232 3.946 -1.827 413 2HG1 VAL 53 2HG1 VAL 53 10.405 2.421 -2.206 414 3HG1 VAL 53 3HG1 VAL 53 11.781 2.954 -3.196 415 1HG2 VAL 53 1HG2 VAL 53 8.921 5.123 -2.033 416 2HG2 VAL 53 2HG2 VAL 53 7.980 4.834 -3.498 417 3HG2 VAL 53 3HG2 VAL 53 8.258 3.519 -2.355 418 H GLU 54 H GLU 54 9.355 4.408 -6.096 419 HA GLU 54 HA GLU 54 7.752 6.858 -6.439 420 1HB GLU 54 1HB GLU 54 9.102 5.154 -8.536 421 2HB GLU 54 2HB GLU 54 7.765 6.227 -8.923 422 1HG GLU 54 1HG GLU 54 9.001 8.134 -8.497 423 2HG GLU 54 2HG GLU 54 10.188 7.269 -7.519 424 H TYR 55 H TYR 55 5.562 6.499 -6.568 425 HA TYR 55 HA TYR 55 4.648 3.823 -7.265 426 1HB TYR 55 1HB TYR 55 3.450 3.391 -5.295 427 2HB TYR 55 2HB TYR 55 5.012 3.971 -4.740 428 HD1 TYR 55 HD1 TYR 55 5.124 6.558 -4.235 429 HD2 TYR 55 HD2 TYR 55 1.523 4.290 -4.374 430 HE1 TYR 55 HE1 TYR 55 4.004 8.264 -2.865 431 HE2 TYR 55 HE2 TYR 55 0.384 5.994 -3.005 432 HH TYR 55 HH TYR 55 1.054 7.759 -1.347 433 H THR 56 H THR 56 2.369 3.655 -7.533 434 HA THR 56 HA THR 56 1.028 6.208 -8.123 435 HB THR 56 HB THR 56 0.824 3.675 -9.776 436 HG1 THR 56 HG1 THR 56 1.949 6.155 -10.587 437 1HG2 THR 56 1HG2 THR 56 -1.244 4.982 -9.753 438 2HG2 THR 56 2HG2 THR 56 -0.344 6.426 -10.216 439 3HG2 THR 56 3HG2 THR 56 -0.464 5.066 -11.333 440 H GLY 57 H GLY 57 -0.614 6.370 -6.715 441 1HA GLY 57 1HA GLY 57 -1.825 5.297 -4.888 442 2HA GLY 57 2HA GLY 57 -1.943 3.864 -5.898 443 H ARG 58 H ARG 58 -4.126 3.709 -5.824 444 HA ARG 58 HA ARG 58 -5.750 5.981 -6.621 445 1HB ARG 58 1HB ARG 58 -6.865 4.748 -8.429 446 2HB ARG 58 2HB ARG 58 -5.149 4.980 -8.767 447 1HG ARG 58 1HG ARG 58 -5.297 2.805 -9.341 448 2HG ARG 58 2HG ARG 58 -5.031 2.575 -7.610 449 1HD ARG 58 1HD ARG 58 -7.391 2.316 -7.228 450 2HD ARG 58 2HD ARG 58 -7.749 2.731 -8.904 451 HE ARG 58 HE ARG 58 -6.044 0.425 -8.567 452 1HH1 ARG 58 1HH1 ARG 58 -9.317 1.590 -8.863 453 2HH1 ARG 58 2HH1 ARG 58 -9.942 0.071 -9.412 454 1HH2 ARG 58 1HH2 ARG 58 -6.862 -1.577 -9.288 455 2HH2 ARG 58 2HH2 ARG 58 -8.549 -1.729 -9.652 456 H LEU 59 H LEU 59 -7.918 5.779 -6.037 457 HA LEU 59 HA LEU 59 -8.402 3.969 -3.862 458 1HB LEU 59 1HB LEU 59 -10.295 5.877 -5.241 459 2HB LEU 59 2HB LEU 59 -10.578 5.084 -3.705 460 HG LEU 59 HG LEU 59 -8.246 6.941 -4.087 461 1HD1 LEU 59 1HD1 LEU 59 -11.049 7.681 -3.254 462 2HD1 LEU 59 2HD1 LEU 59 -9.637 8.735 -3.163 463 3HD1 LEU 59 3HD1 LEU 59 -10.229 8.189 -4.731 464 1HD2 LEU 59 1HD2 LEU 59 -9.819 5.997 -1.694 465 2HD2 LEU 59 2HD2 LEU 59 -8.169 5.549 -2.122 466 3HD2 LEU 59 3HD2 LEU 59 -8.535 7.206 -1.642 467 H ILE 60 H ILE 60 -10.336 2.561 -3.767 468 HA ILE 60 HA ILE 60 -10.433 0.760 -5.912 469 HB ILE 60 HB ILE 60 -11.109 0.141 -3.624 470 1HG1 ILE 60 1HG1 ILE 60 -13.081 -1.213 -4.208 471 2HG1 ILE 60 2HG1 ILE 60 -13.324 -0.235 -5.651 472 1HG2 ILE 60 1HG2 ILE 60 -13.526 1.857 -4.164 473 2HG2 ILE 60 2HG2 ILE 60 -13.333 0.774 -2.784 474 3HG2 ILE 60 3HG2 ILE 60 -12.258 2.162 -2.973 475 1HD1 ILE 60 1HD1 ILE 60 -10.901 -1.932 -5.095 476 2HD1 ILE 60 2HD1 ILE 60 -12.259 -2.388 -6.129 477 3HD1 ILE 60 3HD1 ILE 60 -11.233 -1.021 -6.571 478 H ASP 61 H ASP 61 -11.718 3.816 -5.571 479 HA ASP 61 HA ASP 61 -14.147 3.612 -7.004 480 1HB ASP 61 1HB ASP 61 -12.272 5.965 -6.676 481 2HB ASP 61 2HB ASP 61 -13.913 6.064 -7.309 482 H GLY 62 H GLY 62 -10.953 3.224 -8.014 483 1HA GLY 62 1HA GLY 62 -11.819 3.212 -10.795 484 2HA GLY 62 2HA GLY 62 -10.325 2.538 -10.168 485 H THR 63 H THR 63 -10.524 5.560 -8.849 486 HA THR 63 HA THR 63 -9.110 6.763 -11.136 487 HB THR 63 HB THR 63 -11.207 7.929 -10.796 488 HG1 THR 63 HG1 THR 63 -10.322 9.927 -10.761 489 1HG2 THR 63 1HG2 THR 63 -11.584 7.316 -8.449 490 2HG2 THR 63 2HG2 THR 63 -10.270 8.389 -7.960 491 3HG2 THR 63 3HG2 THR 63 -11.730 9.058 -8.691 492 H VAL 64 H VAL 64 -7.180 7.709 -10.779 493 HA VAL 64 HA VAL 64 -5.700 7.038 -8.491 494 HB VAL 64 HB VAL 64 -4.581 7.391 -10.610 495 1HG1 VAL 64 1HG1 VAL 64 -5.468 10.265 -10.380 496 2HG1 VAL 64 2HG1 VAL 64 -4.375 9.623 -11.606 497 3HG1 VAL 64 3HG1 VAL 64 -6.052 9.082 -11.550 498 1HG2 VAL 64 1HG2 VAL 64 -3.803 9.429 -8.529 499 2HG2 VAL 64 2HG2 VAL 64 -3.217 7.772 -8.670 500 3HG2 VAL 64 3HG2 VAL 64 -2.792 8.964 -9.896 501 H PHE 65 H PHE 65 -5.373 8.080 -6.633 502 HA PHE 65 HA PHE 65 -6.796 10.598 -6.246 503 1HB PHE 65 1HB PHE 65 -6.565 10.157 -3.829 504 2HB PHE 65 2HB PHE 65 -7.350 8.828 -4.672 505 HD1 PHE 65 HD1 PHE 65 -3.985 8.472 -5.454 506 HD2 PHE 65 HD2 PHE 65 -6.666 8.079 -2.190 507 HE1 PHE 65 HE1 PHE 65 -2.413 6.950 -4.367 508 HE2 PHE 65 HE2 PHE 65 -5.106 6.533 -1.112 509 HZ PHE 65 HZ PHE 65 -2.960 5.974 -2.188 510 H ASP 66 H ASP 66 -3.611 9.336 -6.500 511 HA ASP 66 HA ASP 66 -2.432 11.860 -6.674 512 1HB ASP 66 1HB ASP 66 -2.766 11.937 -4.237 513 2HB ASP 66 2HB ASP 66 -1.884 10.423 -4.064 514 H SER 67 H SER 67 -0.632 11.644 -7.838 515 HA SER 67 HA SER 67 0.777 9.060 -7.767 516 1HB SER 67 1HB SER 67 1.188 9.317 -10.207 517 2HB SER 67 2HB SER 67 -0.525 9.160 -9.819 518 HG SER 67 HG SER 67 -0.303 11.642 -9.766 519 H THR 68 H THR 68 2.865 9.230 -7.260 520 HA THR 68 HA THR 68 4.096 11.873 -7.223 521 HB THR 68 HB THR 68 5.904 10.842 -5.943 522 HG1 THR 68 HG1 THR 68 6.113 8.803 -6.715 523 1HG2 THR 68 1HG2 THR 68 3.165 9.982 -4.995 524 2HG2 THR 68 2HG2 THR 68 4.609 10.078 -3.987 525 3HG2 THR 68 3HG2 THR 68 3.934 11.542 -4.701 526 H GLU 69 H GLU 69 4.578 8.700 -8.704 527 HA GLU 69 HA GLU 69 6.993 9.395 -10.037 528 1HB GLU 69 1HB GLU 69 6.099 7.053 -9.486 529 2HB GLU 69 2HB GLU 69 5.098 7.231 -10.920 530 1HG GLU 69 1HG GLU 69 7.186 7.646 -12.226 531 2HG GLU 69 2HG GLU 69 8.098 7.229 -10.774 532 H LYS 70 H LYS 70 3.587 9.525 -10.903 533 HA LYS 70 HA LYS 70 3.898 9.983 -13.662 534 1HB LYS 70 1HB LYS 70 1.769 9.416 -12.326 535 2HB LYS 70 2HB LYS 70 1.660 11.143 -12.016 536 1HG LYS 70 1HG LYS 70 1.863 10.053 -14.804 537 2HG LYS 70 2HG LYS 70 0.317 10.189 -13.964 538 1HD LYS 70 1HD LYS 70 0.711 12.596 -13.660 539 2HD LYS 70 2HD LYS 70 2.238 12.448 -14.533 540 1HE LYS 70 1HE LYS 70 -0.500 11.841 -15.649 541 2HE LYS 70 2HE LYS 70 0.446 13.292 -15.979 542 1HZ LYS 70 1HZ LYS 70 2.152 11.897 -16.985 543 2HZ LYS 70 2HZ LYS 70 1.228 10.512 -16.680 544 3HZ LYS 70 3HZ LYS 70 0.664 11.687 -17.761 545 H THR 71 H THR 71 3.438 12.287 -10.979 546 HA THR 71 HA THR 71 3.581 14.630 -12.494 547 HB THR 71 HB THR 71 4.202 15.774 -10.390 548 HG1 THR 71 HG1 THR 71 5.096 13.324 -9.748 549 1HG2 THR 71 1HG2 THR 71 2.043 13.681 -10.099 550 2HG2 THR 71 2HG2 THR 71 2.208 15.122 -9.097 551 3HG2 THR 71 3HG2 THR 71 1.855 15.280 -10.818 552 H GLY 72 H GLY 72 6.032 12.396 -11.636 553 1HA GLY 72 1HA GLY 72 8.018 14.090 -12.955 554 2HA GLY 72 2HA GLY 72 8.164 12.367 -12.646 555 H LYS 73 H LYS 73 7.090 13.308 -9.807 556 HA LYS 73 HA LYS 73 9.745 14.097 -8.804 557 1HB LYS 73 1HB LYS 73 7.043 14.617 -7.550 558 2HB LYS 73 2HB LYS 73 8.597 15.143 -6.917 559 1HG LYS 73 1HG LYS 73 8.926 16.599 -8.811 560 2HG LYS 73 2HG LYS 73 7.443 16.006 -9.561 561 1HD LYS 73 1HD LYS 73 6.864 18.066 -8.577 562 2HD LYS 73 2HD LYS 73 6.239 16.834 -7.480 563 1HE LYS 73 1HE LYS 73 8.929 18.119 -7.093 564 2HE LYS 73 2HE LYS 73 7.450 18.822 -6.439 565 1HZ LYS 73 1HZ LYS 73 7.073 16.670 -5.289 566 2HZ LYS 73 2HZ LYS 73 8.605 16.165 -5.794 567 3HZ LYS 73 3HZ LYS 73 8.452 17.495 -4.759 568 HA PRO 74 HA PRO 74 9.671 9.943 -7.061 569 1HB PRO 74 1HB PRO 74 11.985 11.023 -5.553 570 2HB PRO 74 2HB PRO 74 11.870 9.560 -6.537 571 1HG PRO 74 1HG PRO 74 13.191 11.695 -7.424 572 2HG PRO 74 2HG PRO 74 12.204 10.712 -8.523 573 1HD PRO 74 1HD PRO 74 11.590 13.365 -7.279 574 2HD PRO 74 2HD PRO 74 11.241 12.780 -8.920 575 H ALA 75 H ALA 75 8.928 9.077 -5.168 576 HA ALA 75 HA ALA 75 8.064 10.980 -3.137 577 1HB ALA 75 1HB ALA 75 7.353 8.075 -3.352 578 2HB ALA 75 2HB ALA 75 6.551 9.303 -2.380 579 3HB ALA 75 3HB ALA 75 6.455 9.366 -4.140 580 H THR 76 H THR 76 9.101 11.212 -1.269 581 HA THR 76 HA THR 76 10.777 8.982 -0.316 582 HB THR 76 HB THR 76 12.317 10.628 -1.110 583 HG1 THR 76 HG1 THR 76 13.342 10.203 0.689 584 1HG2 THR 76 1HG2 THR 76 10.755 12.536 -1.192 585 2HG2 THR 76 2HG2 THR 76 10.842 12.663 0.565 586 3HG2 THR 76 3HG2 THR 76 12.279 12.959 -0.412 587 H PHE 77 H PHE 77 10.113 8.251 1.585 588 HA PHE 77 HA PHE 77 9.325 10.058 3.698 589 1HB PHE 77 1HB PHE 77 7.108 9.021 4.037 590 2HB PHE 77 2HB PHE 77 7.219 9.849 2.486 591 HD1 PHE 77 HD1 PHE 77 7.489 8.533 0.405 592 HD2 PHE 77 HD2 PHE 77 6.713 6.685 4.162 593 HE1 PHE 77 HE1 PHE 77 6.812 6.471 -0.752 594 HE2 PHE 77 HE2 PHE 77 6.038 4.618 3.010 595 HZ PHE 77 HZ PHE 77 6.087 4.511 0.550 596 H GLN 78 H GLN 78 8.689 8.838 5.691 597 HA GLN 78 HA GLN 78 10.532 6.617 6.097 598 1HB GLN 78 1HB GLN 78 10.720 8.075 7.867 599 2HB GLN 78 2HB GLN 78 9.031 8.548 7.816 600 1HG GLN 78 1HG GLN 78 9.184 7.416 9.808 601 2HG GLN 78 2HG GLN 78 8.593 6.167 8.718 602 1HE2 GLN 78 1HE2 GLN 78 9.873 4.415 8.280 603 2HE2 GLN 78 2HE2 GLN 78 11.380 4.114 9.064 604 H VAL 79 H VAL 79 9.886 4.575 6.808 605 HA VAL 79 HA VAL 79 7.326 3.732 5.793 606 HB VAL 79 HB VAL 79 8.062 1.465 6.262 607 1HG1 VAL 79 1HG1 VAL 79 8.809 2.538 4.203 608 2HG1 VAL 79 2HG1 VAL 79 10.233 3.163 5.034 609 3HG1 VAL 79 3HG1 VAL 79 10.035 1.426 4.810 610 1HG2 VAL 79 1HG2 VAL 79 9.204 1.885 8.386 611 2HG2 VAL 79 2HG2 VAL 79 10.242 1.011 7.254 612 3HG2 VAL 79 3HG2 VAL 79 10.488 2.740 7.525 613 H SER 80 H SER 80 8.660 4.315 8.969 614 HA SER 80 HA SER 80 6.521 2.891 10.303 615 1HB SER 80 1HB SER 80 7.592 3.678 12.383 616 2HB SER 80 2HB SER 80 8.746 2.887 11.311 617 HG SER 80 HG SER 80 8.379 5.680 11.656 618 H GLN 81 H GLN 81 6.652 5.797 8.776 619 HA GLN 81 HA GLN 81 5.073 7.260 10.744 620 1HB GLN 81 1HB GLN 81 6.884 7.998 8.683 621 2HB GLN 81 2HB GLN 81 5.320 8.704 8.301 622 1HG GLN 81 1HG GLN 81 6.626 10.256 9.593 623 2HG GLN 81 2HG GLN 81 5.242 9.710 10.537 624 1HE2 GLN 81 1HE2 GLN 81 8.691 9.631 10.189 625 2HE2 GLN 81 2HE2 GLN 81 9.039 8.942 11.734 626 H VAL 82 H VAL 82 4.258 4.956 8.629 627 HA VAL 82 HA VAL 82 1.812 6.344 7.749 628 HB VAL 82 HB VAL 82 1.702 4.123 6.261 629 1HG1 VAL 82 1HG1 VAL 82 3.298 6.606 5.646 630 2HG1 VAL 82 2HG1 VAL 82 2.730 5.449 4.444 631 3HG1 VAL 82 3HG1 VAL 82 1.568 6.373 5.395 632 1HG2 VAL 82 1HG2 VAL 82 3.840 3.283 7.228 633 2HG2 VAL 82 2HG2 VAL 82 3.864 3.453 5.474 634 3HG2 VAL 82 3HG2 VAL 82 4.660 4.657 6.487 635 H ILE 83 H ILE 83 0.089 4.406 7.208 636 HA ILE 83 HA ILE 83 -1.055 3.747 9.651 637 HB ILE 83 HB ILE 83 -2.519 2.203 8.365 638 1HG1 ILE 83 1HG1 ILE 83 -0.916 3.094 5.963 639 2HG1 ILE 83 2HG1 ILE 83 -0.707 1.529 6.740 640 1HG2 ILE 83 1HG2 ILE 83 -2.070 4.937 7.179 641 2HG2 ILE 83 2HG2 ILE 83 -3.520 3.959 6.958 642 3HG2 ILE 83 3HG2 ILE 83 -3.089 4.543 8.564 643 1HD1 ILE 83 1HD1 ILE 83 -3.278 2.517 5.533 644 2HD1 ILE 83 2HD1 ILE 83 -2.131 1.437 4.739 645 3HD1 ILE 83 3HD1 ILE 83 -2.970 0.914 6.199 646 HA PRO 84 HA PRO 84 0.678 0.108 11.380 647 1HB PRO 84 1HB PRO 84 -1.576 -1.582 11.343 648 2HB PRO 84 2HB PRO 84 -1.063 -0.534 12.666 649 1HG PRO 84 1HG PRO 84 -3.119 -0.067 10.567 650 2HG PRO 84 2HG PRO 84 -3.085 0.477 12.254 651 1HD PRO 84 1HD PRO 84 -2.581 2.167 10.248 652 2HD PRO 84 2HD PRO 84 -1.683 2.269 11.777 653 H GLY 85 H GLY 85 -1.638 -0.746 8.805 654 1HA GLY 85 1HA GLY 85 -1.450 -2.158 7.018 655 2HA GLY 85 2HA GLY 85 -0.472 -3.169 8.069 656 H TRP 86 H TRP 86 0.092 0.065 6.654 657 HA TRP 86 HA TRP 86 1.879 -0.804 4.672 658 1HB TRP 86 1HB TRP 86 0.891 1.722 5.658 659 2HB TRP 86 2HB TRP 86 2.608 1.828 5.291 660 HD1 TRP 86 HD1 TRP 86 -0.085 -0.151 3.327 661 HE1 TRP 86 HE1 TRP 86 -0.070 0.690 0.893 662 HE3 TRP 86 HE3 TRP 86 3.345 3.615 3.784 663 HZ2 TRP 86 HZ2 TRP 86 1.219 2.686 -0.627 664 HZ3 TRP 86 HZ3 TRP 86 3.908 4.941 1.793 665 HH2 TRP 86 HH2 TRP 86 2.870 4.486 -0.367 666 H THR 87 H THR 87 2.619 0.717 7.827 667 HA THR 87 HA THR 87 5.376 0.705 7.613 668 HB THR 87 HB THR 87 4.256 1.835 9.452 669 HG1 THR 87 HG1 THR 87 5.824 -0.104 10.750 670 1HG2 THR 87 1HG2 THR 87 3.666 -0.943 10.477 671 2HG2 THR 87 2HG2 THR 87 3.440 0.544 11.398 672 3HG2 THR 87 3HG2 THR 87 2.487 0.256 9.943 673 H GLU 88 H GLU 88 3.226 -1.952 8.423 674 HA GLU 88 HA GLU 88 5.237 -3.714 9.375 675 1HB GLU 88 1HB GLU 88 2.870 -4.036 9.896 676 2HB GLU 88 2HB GLU 88 2.523 -4.330 8.197 677 1HG GLU 88 1HG GLU 88 2.606 -6.413 9.415 678 2HG GLU 88 2HG GLU 88 3.936 -6.327 8.256 679 H ALA 89 H ALA 89 3.613 -3.474 6.205 680 HA ALA 89 HA ALA 89 5.049 -5.573 4.987 681 1HB ALA 89 1HB ALA 89 2.986 -4.838 4.030 682 2HB ALA 89 2HB ALA 89 4.270 -4.565 2.849 683 3HB ALA 89 3HB ALA 89 3.623 -3.210 3.780 684 H LEU 90 H LEU 90 5.594 -2.064 4.982 685 HA LEU 90 HA LEU 90 7.725 -1.974 3.197 686 1HB LEU 90 1HB LEU 90 6.763 -0.248 5.413 687 2HB LEU 90 2HB LEU 90 8.383 0.043 4.813 688 HG LEU 90 HG LEU 90 6.694 1.509 3.765 689 1HD1 LEU 90 1HD1 LEU 90 8.015 -0.464 1.909 690 2HD1 LEU 90 2HD1 LEU 90 7.363 1.104 1.432 691 3HD1 LEU 90 3HD1 LEU 90 8.724 1.016 2.551 692 1HD2 LEU 90 1HD2 LEU 90 5.592 -1.068 2.650 693 2HD2 LEU 90 2HD2 LEU 90 4.788 0.005 3.795 694 3HD2 LEU 90 3HD2 LEU 90 5.111 0.553 2.150 695 H GLN 91 H GLN 91 7.653 -2.917 6.558 696 HA GLN 91 HA GLN 91 10.412 -2.705 7.110 697 1HB GLN 91 1HB GLN 91 8.730 -2.935 8.874 698 2HB GLN 91 2HB GLN 91 8.340 -4.559 8.305 699 1HG GLN 91 1HG GLN 91 10.679 -5.228 8.818 700 2HG GLN 91 2HG GLN 91 10.929 -3.636 9.530 701 1HE2 GLN 91 1HE2 GLN 91 7.923 -5.402 9.754 702 2HE2 GLN 91 2HE2 GLN 91 8.011 -5.721 11.449 703 H LEU 92 H LEU 92 8.569 -5.012 5.335 704 HA LEU 92 HA LEU 92 10.714 -6.993 5.398 705 1HB LEU 92 1HB LEU 92 7.890 -7.021 4.374 706 2HB LEU 92 2HB LEU 92 9.030 -8.280 3.943 707 HG LEU 92 HG LEU 92 9.315 -8.794 6.363 708 1HD1 LEU 92 1HD1 LEU 92 7.043 -6.839 6.693 709 2HD1 LEU 92 2HD1 LEU 92 7.663 -7.916 7.945 710 3HD1 LEU 92 3HD1 LEU 92 8.689 -6.638 7.294 711 1HD2 LEU 92 1HD2 LEU 92 7.760 -10.047 4.930 712 2HD2 LEU 92 2HD2 LEU 92 7.201 -9.951 6.602 713 3HD2 LEU 92 3HD2 LEU 92 6.471 -8.922 5.368 714 H MET 93 H MET 93 9.851 -4.332 3.561 715 HA MET 93 HA MET 93 10.692 -5.414 1.012 716 1HB MET 93 1HB MET 93 9.912 -2.613 1.834 717 2HB MET 93 2HB MET 93 10.205 -3.149 0.183 718 1HG MET 93 1HG MET 93 8.317 -4.620 0.262 719 2HG MET 93 2HG MET 93 8.075 -4.281 1.975 720 1HE MET 93 1HE MET 93 5.639 -3.637 1.844 721 2HE MET 93 2HE MET 93 4.937 -2.501 0.691 722 3HE MET 93 3HE MET 93 5.577 -4.046 0.131 723 HA PRO 94 HA PRO 94 14.909 -4.082 2.095 724 1HB PRO 94 1HB PRO 94 16.200 -5.649 0.350 725 2HB PRO 94 2HB PRO 94 15.487 -6.314 1.829 726 1HG PRO 94 1HG PRO 94 14.427 -6.353 -0.972 727 2HG PRO 94 2HG PRO 94 14.449 -7.653 0.233 728 1HD PRO 94 1HD PRO 94 12.254 -6.091 -0.300 729 2HD PRO 94 2HD PRO 94 12.560 -6.898 1.278 730 H ALA 95 H ALA 95 16.253 -2.558 1.160 731 HA ALA 95 HA ALA 95 15.392 -0.881 -0.818 732 1HB ALA 95 1HB ALA 95 18.167 -1.560 0.101 733 2HB ALA 95 2HB ALA 95 17.190 -0.146 0.491 734 3HB ALA 95 3HB ALA 95 17.873 -0.328 -1.124 735 H GLY 96 H GLY 96 15.164 -0.985 -2.971 736 1HA GLY 96 1HA GLY 96 16.874 -2.801 -4.510 737 2HA GLY 96 2HA GLY 96 15.901 -1.495 -5.167 738 H SER 97 H SER 97 14.051 -3.189 -2.968 739 HA SER 97 HA SER 97 13.264 -5.398 -4.617 740 1HB SER 97 1HB SER 97 12.978 -5.747 -2.297 741 2HB SER 97 2HB SER 97 12.172 -4.194 -2.074 742 HG SER 97 HG SER 97 10.353 -5.139 -2.498 743 H THR 98 H THR 98 10.733 -5.632 -4.902 744 HA THR 98 HA THR 98 9.451 -3.183 -5.796 745 HB THR 98 HB THR 98 9.846 -5.453 -7.756 746 HG1 THR 98 HG1 THR 98 11.787 -4.573 -7.901 747 1HG2 THR 98 1HG2 THR 98 8.766 -2.651 -8.084 748 2HG2 THR 98 2HG2 THR 98 8.999 -3.817 -9.387 749 3HG2 THR 98 3HG2 THR 98 7.821 -4.141 -8.114 750 H TRP 99 H TRP 99 7.845 -3.599 -4.301 751 HA TRP 99 HA TRP 99 6.256 -6.041 -4.755 752 1HB TRP 99 1HB TRP 99 6.878 -4.488 -2.270 753 2HB TRP 99 2HB TRP 99 5.383 -5.409 -2.368 754 HD1 TRP 99 HD1 TRP 99 7.983 -7.289 -4.184 755 HE1 TRP 99 HE1 TRP 99 8.942 -9.158 -2.700 756 HE3 TRP 99 HE3 TRP 99 6.085 -5.807 0.323 757 HZ2 TRP 99 HZ2 TRP 99 8.896 -9.913 0.019 758 HZ3 TRP 99 HZ3 TRP 99 6.585 -7.160 2.318 759 HH2 TRP 99 HH2 TRP 99 7.961 -9.172 2.166 760 H GLU 100 H GLU 100 4.035 -5.902 -4.804 761 HA GLU 100 HA GLU 100 2.891 -3.190 -4.928 762 1HB GLU 100 1HB GLU 100 1.213 -4.148 -6.538 763 2HB GLU 100 2HB GLU 100 2.851 -4.068 -7.167 764 1HG GLU 100 1HG GLU 100 3.139 -6.454 -6.683 765 2HG GLU 100 2HG GLU 100 1.479 -6.522 -6.095 766 H ILE 101 H ILE 101 1.795 -2.931 -3.091 767 HA ILE 101 HA ILE 101 0.445 -5.270 -1.944 768 HB ILE 101 HB ILE 101 0.472 -4.054 0.187 769 1HG1 ILE 101 1HG1 ILE 101 2.145 -2.002 -1.279 770 2HG1 ILE 101 2HG1 ILE 101 0.466 -1.764 -0.804 771 1HG2 ILE 101 1HG2 ILE 101 3.135 -4.358 -1.185 772 2HG2 ILE 101 2HG2 ILE 101 2.928 -4.157 0.555 773 3HG2 ILE 101 3HG2 ILE 101 2.269 -5.579 -0.253 774 1HD1 ILE 101 1HD1 ILE 101 2.773 -2.234 1.070 775 2HD1 ILE 101 2HD1 ILE 101 1.996 -0.685 0.744 776 3HD1 ILE 101 3HD1 ILE 101 1.094 -1.976 1.539 777 H TYR 102 H TYR 102 -1.636 -5.296 -1.474 778 HA TYR 102 HA TYR 102 -3.238 -2.889 -2.025 779 1HB TYR 102 1HB TYR 102 -5.033 -4.938 -2.239 780 2HB TYR 102 2HB TYR 102 -4.195 -4.213 -3.606 781 HD1 TYR 102 HD1 TYR 102 -4.408 -7.135 -1.418 782 HD2 TYR 102 HD2 TYR 102 -2.369 -5.391 -4.715 783 HE1 TYR 102 HE1 TYR 102 -3.445 -9.323 -1.975 784 HE2 TYR 102 HE2 TYR 102 -1.400 -7.574 -5.280 785 HH TYR 102 HH TYR 102 -0.895 -9.699 -4.199 786 H VAL 103 H VAL 103 -3.628 -2.056 -0.081 787 HA VAL 103 HA VAL 103 -4.050 -3.829 2.202 788 HB VAL 103 HB VAL 103 -3.679 -0.836 2.162 789 1HG1 VAL 103 1HG1 VAL 103 -4.810 -1.638 4.160 790 2HG1 VAL 103 2HG1 VAL 103 -3.530 -2.824 4.421 791 3HG1 VAL 103 3HG1 VAL 103 -3.173 -1.101 4.536 792 1HG2 VAL 103 1HG2 VAL 103 -1.692 -3.062 2.586 793 2HG2 VAL 103 2HG2 VAL 103 -1.703 -1.877 1.280 794 3HG2 VAL 103 3HG2 VAL 103 -1.377 -1.363 2.935 795 HA PRO 104 HA PRO 104 -8.507 -3.001 1.653 796 1HB PRO 104 1HB PRO 104 -8.600 -4.794 4.009 797 2HB PRO 104 2HB PRO 104 -9.481 -4.898 2.483 798 1HG PRO 104 1HG PRO 104 -7.466 -6.564 3.046 799 2HG PRO 104 2HG PRO 104 -7.749 -5.968 1.399 800 1HD PRO 104 1HD PRO 104 -5.687 -5.135 3.393 801 2HD PRO 104 2HD PRO 104 -5.565 -5.290 1.628 802 H SER 105 H SER 105 -9.969 -1.788 2.884 803 HA SER 105 HA SER 105 -9.020 0.174 4.542 804 1HB SER 105 1HB SER 105 -11.498 0.192 5.410 805 2HB SER 105 2HB SER 105 -11.149 0.586 3.720 806 HG SER 105 HG SER 105 -11.425 -2.009 3.799 807 H GLY 106 H GLY 106 -10.362 -2.957 5.516 808 1HA GLY 106 1HA GLY 106 -10.285 -4.116 7.487 809 2HA GLY 106 2HA GLY 106 -10.494 -2.564 8.269 810 H LEU 107 H LEU 107 -7.674 -2.540 6.439 811 HA LEU 107 HA LEU 107 -6.003 -3.812 8.438 812 1HB LEU 107 1HB LEU 107 -5.784 -3.409 5.714 813 2HB LEU 107 2HB LEU 107 -4.612 -2.294 6.393 814 HG LEU 107 HG LEU 107 -3.500 -4.346 5.890 815 1HD1 LEU 107 1HD1 LEU 107 -2.909 -3.155 7.994 816 2HD1 LEU 107 2HD1 LEU 107 -3.950 -4.280 8.865 817 3HD1 LEU 107 3HD1 LEU 107 -2.530 -4.877 8.006 818 1HD2 LEU 107 1HD2 LEU 107 -5.611 -5.678 7.581 819 2HD2 LEU 107 2HD2 LEU 107 -5.392 -5.849 5.839 820 3HD2 LEU 107 3HD2 LEU 107 -4.171 -6.472 6.947 821 H ALA 108 H ALA 108 -6.988 -0.574 7.634 822 HA ALA 108 HA ALA 108 -5.186 0.403 9.755 823 1HB ALA 108 1HB ALA 108 -4.367 1.074 7.532 824 2HB ALA 108 2HB ALA 108 -5.894 1.908 7.236 825 3HB ALA 108 3HB ALA 108 -4.822 2.457 8.531 826 H TYR 109 H TYR 109 -6.748 3.040 8.638 827 HA TYR 109 HA TYR 109 -8.701 2.964 10.790 828 1HB TYR 109 1HB TYR 109 -8.047 5.244 8.915 829 2HB TYR 109 2HB TYR 109 -8.906 5.345 10.448 830 HD1 TYR 109 HD1 TYR 109 -5.658 5.228 8.831 831 HD2 TYR 109 HD2 TYR 109 -7.670 5.005 12.575 832 HE1 TYR 109 HE1 TYR 109 -3.534 5.645 9.992 833 HE2 TYR 109 HE2 TYR 109 -5.548 5.422 13.746 834 HH TYR 109 HH TYR 109 -3.175 5.239 13.377 835 H GLY 110 H GLY 110 -8.696 1.857 7.808 836 1HA GLY 110 1HA GLY 110 -10.415 1.077 6.505 837 2HA GLY 110 2HA GLY 110 -10.602 2.785 6.190 838 HA PRO 111 HA PRO 111 -14.477 0.610 8.035 839 1HB PRO 111 1HB PRO 111 -14.065 -0.589 10.510 840 2HB PRO 111 2HB PRO 111 -14.136 -1.429 8.959 841 1HG PRO 111 1HG PRO 111 -11.757 -0.544 10.532 842 2HG PRO 111 2HG PRO 111 -11.993 -2.028 9.589 843 1HD PRO 111 1HD PRO 111 -10.518 -0.007 8.639 844 2HD PRO 111 2HD PRO 111 -11.569 -0.959 7.568 845 H ARG 112 H ARG 112 -12.234 2.445 9.864 846 HA ARG 112 HA ARG 112 -14.164 3.337 11.820 847 1HB ARG 112 1HB ARG 112 -11.437 4.478 11.175 848 2HB ARG 112 2HB ARG 112 -12.396 4.809 12.610 849 1HG ARG 112 1HG ARG 112 -11.406 2.061 11.905 850 2HG ARG 112 2HG ARG 112 -10.489 3.194 12.899 851 1HD ARG 112 1HD ARG 112 -11.678 1.744 14.370 852 2HD ARG 112 2HD ARG 112 -12.464 3.320 14.428 853 HE ARG 112 HE ARG 112 -13.639 1.490 12.543 854 1HH1 ARG 112 1HH1 ARG 112 -13.624 2.609 15.843 855 2HH1 ARG 112 2HH1 ARG 112 -15.234 2.062 16.171 856 1HH2 ARG 112 1HH2 ARG 112 -15.760 0.765 12.967 857 2HH2 ARG 112 2HH2 ARG 112 -16.446 1.012 14.538 858 H SER 113 H SER 113 -15.283 5.246 11.811 859 HA SER 113 HA SER 113 -15.919 6.413 9.335 860 1HB SER 113 1HB SER 113 -17.461 6.418 11.258 861 2HB SER 113 2HB SER 113 -16.386 7.525 12.112 862 HG SER 113 HG SER 113 -16.742 9.022 10.387 863 H VAL 114 H VAL 114 -13.183 6.718 11.087 864 HA VAL 114 HA VAL 114 -12.636 9.459 10.156 865 HB VAL 114 HB VAL 114 -11.030 7.978 12.234 866 1HG1 VAL 114 1HG1 VAL 114 -9.945 9.892 11.184 867 2HG1 VAL 114 2HG1 VAL 114 -11.327 10.914 11.597 868 3HG1 VAL 114 3HG1 VAL 114 -10.319 10.230 12.878 869 1HG2 VAL 114 1HG2 VAL 114 -13.349 8.106 13.009 870 2HG2 VAL 114 2HG2 VAL 114 -12.292 9.154 13.955 871 3HG2 VAL 114 3HG2 VAL 114 -13.348 9.847 12.723 872 H GLY 115 H GLY 115 -12.473 7.788 8.143 873 1HA GLY 115 1HA GLY 115 -11.068 7.063 6.477 874 2HA GLY 115 2HA GLY 115 -10.234 6.201 7.761 875 H GLY 116 H GLY 116 -8.152 6.667 7.986 876 1HA GLY 116 1HA GLY 116 -6.189 7.874 8.045 877 2HA GLY 116 2HA GLY 116 -7.151 9.340 7.937 878 HA PRO 117 HA PRO 117 -4.789 9.346 4.009 879 1HB PRO 117 1HB PRO 117 -3.237 7.110 3.502 880 2HB PRO 117 2HB PRO 117 -2.687 8.543 4.376 881 1HG PRO 117 1HG PRO 117 -3.670 5.931 5.445 882 2HG PRO 117 2HG PRO 117 -2.337 6.949 6.020 883 1HD PRO 117 1HD PRO 117 -4.706 6.905 7.276 884 2HD PRO 117 2HD PRO 117 -3.764 8.414 7.121 885 H ILE 118 H ILE 118 -5.941 6.067 4.682 886 HA ILE 118 HA ILE 118 -6.790 5.740 1.912 887 HB ILE 118 HB ILE 118 -6.868 3.835 4.259 888 1HG1 ILE 118 1HG1 ILE 118 -5.333 2.541 2.657 889 2HG1 ILE 118 2HG1 ILE 118 -5.180 4.059 1.781 890 1HG2 ILE 118 1HG2 ILE 118 -7.793 3.384 1.432 891 2HG2 ILE 118 2HG2 ILE 118 -7.615 2.131 2.662 892 3HG2 ILE 118 3HG2 ILE 118 -8.806 3.417 2.879 893 1HD1 ILE 118 1HD1 ILE 118 -4.516 3.707 4.686 894 2HD1 ILE 118 2HD1 ILE 118 -3.344 3.620 3.371 895 3HD1 ILE 118 3HD1 ILE 118 -4.208 5.125 3.685 896 H GLY 119 H GLY 119 -8.839 5.992 1.229 897 1HA GLY 119 1HA GLY 119 -11.115 6.343 1.275 898 2HA GLY 119 2HA GLY 119 -10.730 7.437 2.595 899 HA PRO 120 HA PRO 120 -12.637 4.878 5.630 900 1HB PRO 120 1HB PRO 120 -15.279 5.575 5.367 901 2HB PRO 120 2HB PRO 120 -14.079 6.556 6.212 902 1HG PRO 120 1HG PRO 120 -15.133 6.834 3.427 903 2HG PRO 120 2HG PRO 120 -14.796 8.095 4.628 904 1HD PRO 120 1HD PRO 120 -13.105 7.584 2.600 905 2HD PRO 120 2HD PRO 120 -12.517 8.063 4.206 906 H ASN 121 H ASN 121 -13.126 2.791 5.600 907 HA ASN 121 HA ASN 121 -13.634 0.718 4.779 908 1HB ASN 121 1HB ASN 121 -16.126 1.984 3.658 909 2HB ASN 121 2HB ASN 121 -15.930 0.383 4.372 910 1HD2 ASN 121 1HD2 ASN 121 -16.336 3.756 4.968 911 2HD2 ASN 121 2HD2 ASN 121 -16.650 3.646 6.668 912 H GLU 122 H GLU 122 -12.052 2.356 3.051 913 HA GLU 122 HA GLU 122 -12.949 1.425 0.405 914 1HB GLU 122 1HB GLU 122 -11.312 3.826 1.203 915 2HB GLU 122 2HB GLU 122 -11.327 3.215 -0.445 916 1HG GLU 122 1HG GLU 122 -13.731 3.573 -0.567 917 2HG GLU 122 2HG GLU 122 -13.733 4.163 1.093 918 H THR 123 H THR 123 -11.684 0.042 -0.694 919 HA THR 123 HA THR 123 -9.151 -0.743 0.542 920 HB THR 123 HB THR 123 -10.687 -2.045 -1.723 921 HG1 THR 123 HG1 THR 123 -10.492 -2.621 1.058 922 1HG2 THR 123 1HG2 THR 123 -8.270 -2.983 -0.174 923 2HG2 THR 123 2HG2 THR 123 -9.175 -3.954 -1.335 924 3HG2 THR 123 3HG2 THR 123 -8.307 -2.517 -1.874 925 H LEU 124 H LEU 124 -7.241 -0.128 -0.305 926 HA LEU 124 HA LEU 124 -7.297 1.123 -2.980 927 1HB LEU 124 1HB LEU 124 -5.855 1.824 -0.457 928 2HB LEU 124 2HB LEU 124 -5.163 2.277 -2.001 929 HG LEU 124 HG LEU 124 -6.995 3.711 -2.512 930 1HD1 LEU 124 1HD1 LEU 124 -8.356 2.498 -0.116 931 2HD1 LEU 124 2HD1 LEU 124 -8.912 3.963 -0.925 932 3HD1 LEU 124 3HD1 LEU 124 -8.876 2.433 -1.800 933 1HD2 LEU 124 1HD2 LEU 124 -5.317 4.569 -0.927 934 2HD2 LEU 124 2HD2 LEU 124 -6.903 5.305 -0.704 935 3HD2 LEU 124 3HD2 LEU 124 -6.346 4.055 0.408 936 H ILE 125 H ILE 125 -5.395 0.965 -4.264 937 HA ILE 125 HA ILE 125 -3.766 -1.427 -3.727 938 HB ILE 125 HB ILE 125 -4.382 -0.158 -6.404 939 1HG1 ILE 125 1HG1 ILE 125 -5.579 -2.471 -6.662 940 2HG1 ILE 125 2HG1 ILE 125 -5.622 -2.433 -4.901 941 1HG2 ILE 125 1HG2 ILE 125 -2.896 -2.669 -5.653 942 2HG2 ILE 125 2HG2 ILE 125 -3.421 -2.285 -7.293 943 3HG2 ILE 125 3HG2 ILE 125 -2.255 -1.243 -6.473 944 1HD1 ILE 125 1HD1 ILE 125 -6.786 -0.344 -6.727 945 2HD1 ILE 125 2HD1 ILE 125 -7.689 -1.597 -5.875 946 3HD1 ILE 125 3HD1 ILE 125 -6.852 -0.338 -4.965 947 H PHE 126 H PHE 126 -1.539 -1.283 -3.967 948 HA PHE 126 HA PHE 126 -0.456 1.363 -4.626 949 1HB PHE 126 1HB PHE 126 0.415 -0.276 -2.240 950 2HB PHE 126 2HB PHE 126 1.042 1.299 -2.711 951 HD1 PHE 126 HD1 PHE 126 -1.403 -0.452 -0.804 952 HD2 PHE 126 HD2 PHE 126 -0.584 3.269 -2.708 953 HE1 PHE 126 HE1 PHE 126 -3.105 0.637 0.601 954 HE2 PHE 126 HE2 PHE 126 -2.281 4.360 -1.298 955 HZ PHE 126 HZ PHE 126 -3.545 3.048 0.357 956 H LYS 127 H LYS 127 1.263 1.330 -5.901 957 HA LYS 127 HA LYS 127 2.593 -1.250 -6.403 958 1HB LYS 127 1HB LYS 127 1.479 -0.234 -8.365 959 2HB LYS 127 2HB LYS 127 2.440 1.222 -8.150 960 1HG LYS 127 1HG LYS 127 3.390 -0.072 -9.918 961 2HG LYS 127 2HG LYS 127 4.483 -0.133 -8.535 962 1HD LYS 127 1HD LYS 127 3.685 -2.335 -7.945 963 2HD LYS 127 2HD LYS 127 2.463 -2.268 -9.228 964 1HE LYS 127 1HE LYS 127 5.458 -2.263 -9.604 965 2HE LYS 127 2HE LYS 127 4.372 -3.617 -9.912 966 1HZ LYS 127 1HZ LYS 127 3.263 -2.252 -11.603 967 2HZ LYS 127 2HZ LYS 127 4.386 -1.014 -11.341 968 3HZ LYS 127 3HZ LYS 127 4.898 -2.501 -11.960 969 H ILE 128 H ILE 128 4.329 -1.319 -5.080 970 HA ILE 128 HA ILE 128 5.877 1.139 -4.693 971 HB ILE 128 HB ILE 128 6.227 -1.406 -3.136 972 1HG1 ILE 128 1HG1 ILE 128 4.356 0.914 -2.570 973 2HG1 ILE 128 2HG1 ILE 128 3.883 -0.747 -2.932 974 1HG2 ILE 128 1HG2 ILE 128 8.022 0.258 -3.012 975 2HG2 ILE 128 2HG2 ILE 128 6.856 1.477 -2.500 976 3HG2 ILE 128 3HG2 ILE 128 7.191 0.088 -1.467 977 1HD1 ILE 128 1HD1 ILE 128 4.926 -1.489 -0.855 978 2HD1 ILE 128 2HD1 ILE 128 5.384 0.174 -0.493 979 3HD1 ILE 128 3HD1 ILE 128 3.681 -0.275 -0.567 980 H HIS 129 H HIS 129 7.685 1.423 -5.720 981 HA HIS 129 HA HIS 129 9.254 -0.931 -6.530 982 1HB HIS 129 1HB HIS 129 8.219 0.941 -8.234 983 2HB HIS 129 2HB HIS 129 9.811 1.622 -7.907 984 HD1 HIS 129 HD1 HIS 129 8.549 0.029 -10.546 985 HD2 HIS 129 HD2 HIS 129 11.538 -1.163 -7.921 986 HE1 HIS 129 HE1 HIS 129 9.881 -1.703 -11.787 987 HE2 HIS 129 HE2 HIS 129 11.528 -2.571 -10.087 988 H LEU 130 H LEU 130 10.664 -1.122 -4.896 989 HA LEU 130 HA LEU 130 11.758 1.153 -3.536 990 1HB LEU 130 1HB LEU 130 11.446 -1.575 -2.993 991 2HB LEU 130 2HB LEU 130 13.179 -1.316 -3.053 992 HG LEU 130 HG LEU 130 12.494 -1.094 -0.784 993 1HD1 LEU 130 1HD1 LEU 130 14.180 0.501 -1.503 994 2HD1 LEU 130 2HD1 LEU 130 12.920 1.650 -1.953 995 3HD1 LEU 130 3HD1 LEU 130 13.141 1.202 -0.263 996 1HD2 LEU 130 1HD2 LEU 130 10.385 0.761 -1.856 997 2HD2 LEU 130 2HD2 LEU 130 10.163 -0.744 -0.962 998 3HD2 LEU 130 3HD2 LEU 130 10.817 0.678 -0.147 999 H ILE 131 H ILE 131 13.437 2.315 -4.162 1000 HA ILE 131 HA ILE 131 15.249 1.233 -6.185 1001 HB ILE 131 HB ILE 131 15.037 4.020 -5.030 1002 1HG1 ILE 131 1HG1 ILE 131 13.095 3.374 -6.401 1003 2HG1 ILE 131 2HG1 ILE 131 14.070 4.633 -7.197 1004 1HG2 ILE 131 1HG2 ILE 131 16.748 2.951 -7.267 1005 2HG2 ILE 131 2HG2 ILE 131 16.508 4.663 -6.921 1006 3HG2 ILE 131 3HG2 ILE 131 17.295 3.626 -5.733 1007 1HD1 ILE 131 1HD1 ILE 131 15.091 2.903 -8.612 1008 2HD1 ILE 131 2HD1 ILE 131 14.072 1.685 -7.842 1009 3HD1 ILE 131 3HD1 ILE 131 13.338 2.973 -8.797 1010 H SER 132 H SER 132 15.535 3.016 -3.103 1011 HA SER 132 HA SER 132 17.504 1.204 -2.118 1012 1HB SER 132 1HB SER 132 19.417 2.636 -2.075 1013 2HB SER 132 2HB SER 132 18.829 2.602 -3.738 1014 HG SER 132 HG SER 132 18.594 4.658 -1.819 1015 H VAL 133 H VAL 133 18.347 1.854 0.004 1016 HA VAL 133 HA VAL 133 16.371 3.476 1.478 1017 HB VAL 133 HB VAL 133 16.523 1.116 2.167 1018 1HG1 VAL 133 1HG1 VAL 133 18.848 0.703 1.574 1019 2HG1 VAL 133 2HG1 VAL 133 19.382 1.787 2.856 1020 3HG1 VAL 133 3HG1 VAL 133 18.554 0.287 3.260 1021 1HG2 VAL 133 1HG2 VAL 133 17.584 3.084 4.194 1022 2HG2 VAL 133 2HG2 VAL 133 15.891 2.770 3.820 1023 3HG2 VAL 133 3HG2 VAL 133 16.873 1.517 4.572 1024 H LYS 134 H LYS 134 17.037 5.225 2.620 1025 HA LYS 134 HA LYS 134 18.401 7.042 3.003 1026 1HB LYS 134 1HB LYS 134 20.161 6.523 4.661 1027 2HB LYS 134 2HB LYS 134 18.617 5.785 5.051 1028 1HG LYS 134 1HG LYS 134 19.453 3.647 4.130 1029 2HG LYS 134 2HG LYS 134 21.034 4.426 3.867 1030 1HD LYS 134 1HD LYS 134 21.267 4.826 6.235 1031 2HD LYS 134 2HD LYS 134 19.642 4.212 6.542 1032 1HE LYS 134 1HE LYS 134 20.316 2.000 5.781 1033 2HE LYS 134 2HE LYS 134 21.931 2.604 5.408 1034 1HZ LYS 134 1HZ LYS 134 22.236 3.106 7.757 1035 2HZ LYS 134 2HZ LYS 134 20.694 2.507 8.107 1036 3HZ LYS 134 3HZ LYS 134 21.896 1.465 7.529 1037 H LYS 135 H LYS 135 21.315 6.789 3.472 1038 HA LYS 135 HA LYS 135 22.143 7.289 0.770 1039 1HB LYS 135 1HB LYS 135 23.542 7.374 3.431 1040 2HB LYS 135 2HB LYS 135 24.440 7.537 1.929 1041 1HG LYS 135 1HG LYS 135 24.008 9.723 2.709 1042 2HG LYS 135 2HG LYS 135 22.920 9.452 1.348 1043 1HD LYS 135 1HD LYS 135 21.119 8.892 2.957 1044 2HD LYS 135 2HD LYS 135 22.219 9.294 4.278 1045 1HE LYS 135 1HE LYS 135 21.269 11.165 2.108 1046 2HE LYS 135 2HE LYS 135 20.744 11.169 3.791 1047 1HZ LYS 135 1HZ LYS 135 23.522 11.671 2.870 1048 2HZ LYS 135 2HZ LYS 135 22.421 12.867 3.340 1049 3HZ LYS 135 3HZ LYS 135 22.975 11.736 4.470 1050 H SER 136 H SER 136 21.390 4.544 1.987 1051 HA SER 136 HA SER 136 21.867 2.372 1.546 1052 1HB SER 136 1HB SER 136 22.215 3.089 -0.769 1053 2HB SER 136 2HB SER 136 23.882 3.527 -0.396 1054 HG SER 136 HG SER 136 22.766 1.055 -0.863 1055 H SER 137 H SER 137 22.707 2.714 3.833 1056 HA SER 137 HA SER 137 25.609 2.258 3.975 1057 1HB SER 137 1HB SER 137 23.685 2.994 6.194 1058 2HB SER 137 2HB SER 137 25.436 2.859 6.341 1059 HG SER 137 HG SER 137 25.645 4.602 4.925 No H/Q in entry = 1059 Start of MODEL 3 1 H1 PHE 1 H1 PHE 1 -23.187 10.719 3.744 2 H2 PHE 1 H2 PHE 1 -21.954 10.980 2.617 3 H3 PHE 1 H3 PHE 1 -23.362 11.914 2.560 4 HA PHE 1 HA PHE 1 -24.676 9.984 2.009 5 1HB PHE 1 1HB PHE 1 -22.262 10.262 0.202 6 2HB PHE 1 2HB PHE 1 -23.846 9.651 -0.262 7 HD1 PHE 1 HD1 PHE 1 -21.850 12.604 0.439 8 HD2 PHE 1 HD2 PHE 1 -25.750 11.166 -0.470 9 HE1 PHE 1 HE1 PHE 1 -22.549 14.888 -0.151 10 HE2 PHE 1 HE2 PHE 1 -26.457 13.448 -1.062 11 HZ PHE 1 HZ PHE 1 -24.855 15.313 -0.904 12 H ASN 2 H ASN 2 -24.453 8.325 3.570 13 HA ASN 2 HA ASN 2 -22.237 6.551 3.633 14 1HB ASN 2 1HB ASN 2 -23.641 5.150 5.068 15 2HB ASN 2 2HB ASN 2 -23.760 6.847 5.551 16 1HD2 ASN 2 1HD2 ASN 2 -25.597 4.623 6.001 17 2HD2 ASN 2 2HD2 ASN 2 -27.110 5.110 5.323 18 H LYS 3 H LYS 3 -24.932 6.814 1.531 19 HA LYS 3 HA LYS 3 -25.308 4.157 0.761 20 1HB LYS 3 1HB LYS 3 -25.458 6.651 -0.947 21 2HB LYS 3 2HB LYS 3 -26.113 5.081 -1.391 22 1HG LYS 3 1HG LYS 3 -27.671 5.175 0.462 23 2HG LYS 3 2HG LYS 3 -26.979 6.711 0.988 24 1HD LYS 3 1HD LYS 3 -28.871 7.365 -0.195 25 2HD LYS 3 2HD LYS 3 -27.578 7.535 -1.383 26 1HE LYS 3 1HE LYS 3 -29.373 5.123 -1.136 27 2HE LYS 3 2HE LYS 3 -29.633 6.447 -2.270 28 1HZ LYS 3 1HZ LYS 3 -27.382 5.941 -3.177 29 2HZ LYS 3 2HZ LYS 3 -27.352 4.554 -2.211 30 3HZ LYS 3 3HZ LYS 3 -28.523 4.714 -3.419 31 H LYS 4 H LYS 4 -22.955 6.563 -0.277 32 HA LYS 4 HA LYS 4 -21.720 4.802 -2.192 33 1HB LYS 4 1HB LYS 4 -21.757 7.253 -2.518 34 2HB LYS 4 2HB LYS 4 -20.761 7.449 -1.084 35 1HG LYS 4 1HG LYS 4 -19.401 7.639 -3.063 36 2HG LYS 4 2HG LYS 4 -18.964 6.177 -2.179 37 1HD LYS 4 1HD LYS 4 -19.044 5.617 -4.496 38 2HD LYS 4 2HD LYS 4 -20.463 4.899 -3.730 39 1HE LYS 4 1HE LYS 4 -21.082 5.912 -5.846 40 2HE LYS 4 2HE LYS 4 -21.822 6.798 -4.513 41 1HZ LYS 4 1HZ LYS 4 -19.349 7.611 -5.944 42 2HZ LYS 4 2HZ LYS 4 -20.884 8.275 -6.193 43 3HZ LYS 4 3HZ LYS 4 -20.110 8.474 -4.702 44 H ALA 5 H ALA 5 -21.120 5.894 1.094 45 HA ALA 5 HA ALA 5 -18.534 4.952 1.472 46 1HB ALA 5 1HB ALA 5 -19.442 6.304 3.169 47 2HB ALA 5 2HB ALA 5 -19.249 4.710 3.901 48 3HB ALA 5 3HB ALA 5 -20.843 5.251 3.372 49 H ASP 6 H ASP 6 -21.618 3.298 2.097 50 HA ASP 6 HA ASP 6 -20.431 0.813 2.753 51 1HB ASP 6 1HB ASP 6 -22.707 1.352 3.471 52 2HB ASP 6 2HB ASP 6 -23.233 1.452 1.793 53 H GLU 7 H GLU 7 -21.594 2.252 -0.240 54 HA GLU 7 HA GLU 7 -21.512 -0.007 -1.876 55 1HB GLU 7 1HB GLU 7 -22.396 2.200 -2.591 56 2HB GLU 7 2HB GLU 7 -20.753 2.825 -2.635 57 1HG GLU 7 1HG GLU 7 -20.176 1.272 -4.399 58 2HG GLU 7 2HG GLU 7 -21.784 0.555 -4.323 59 H ASN 8 H ASN 8 -19.000 2.052 -0.620 60 HA ASN 8 HA ASN 8 -16.897 1.030 -2.237 61 1HB ASN 8 1HB ASN 8 -16.703 2.411 0.450 62 2HB ASN 8 2HB ASN 8 -15.397 2.228 -0.750 63 1HD2 ASN 8 1HD2 ASN 8 -16.603 4.617 0.457 64 2HD2 ASN 8 2HD2 ASN 8 -17.144 5.586 -0.865 65 H LYS 9 H LYS 9 -18.173 0.287 0.956 66 HA LYS 9 HA LYS 9 -16.210 -1.448 1.871 67 1HB LYS 9 1HB LYS 9 -18.103 -0.644 3.236 68 2HB LYS 9 2HB LYS 9 -19.193 -1.665 2.311 69 1HG LYS 9 1HG LYS 9 -17.960 -3.648 3.092 70 2HG LYS 9 2HG LYS 9 -16.941 -2.598 4.078 71 1HD LYS 9 1HD LYS 9 -19.941 -2.792 4.322 72 2HD LYS 9 2HD LYS 9 -18.797 -3.665 5.342 73 1HE LYS 9 1HE LYS 9 -17.867 -1.541 6.117 74 2HE LYS 9 2HE LYS 9 -18.997 -0.665 5.085 75 1HZ LYS 9 1HZ LYS 9 -20.826 -1.626 6.351 76 2HZ LYS 9 2HZ LYS 9 -19.731 -2.440 7.350 77 3HZ LYS 9 3HZ LYS 9 -19.787 -0.750 7.358 78 H VAL 10 H VAL 10 -18.899 -2.082 -0.331 79 HA VAL 10 HA VAL 10 -18.456 -4.921 -0.371 80 HB VAL 10 HB VAL 10 -19.954 -3.438 -2.498 81 1HG1 VAL 10 1HG1 VAL 10 -19.625 -5.834 -2.790 82 2HG1 VAL 10 2HG1 VAL 10 -20.357 -6.133 -1.199 83 3HG1 VAL 10 3HG1 VAL 10 -21.337 -5.452 -2.514 84 1HG2 VAL 10 1HG2 VAL 10 -20.701 -2.506 -0.364 85 2HG2 VAL 10 2HG2 VAL 10 -21.958 -3.499 -1.100 86 3HG2 VAL 10 3HG2 VAL 10 -21.008 -4.134 0.243 87 H LYS 11 H LYS 11 -17.935 -2.322 -2.768 88 HA LYS 11 HA LYS 11 -16.767 -3.951 -4.728 89 1HB LYS 11 1HB LYS 11 -15.989 -1.894 -5.758 90 2HB LYS 11 2HB LYS 11 -17.637 -1.699 -5.179 91 1HG LYS 11 1HG LYS 11 -16.698 -0.586 -3.144 92 2HG LYS 11 2HG LYS 11 -15.119 -0.628 -3.932 93 1HD LYS 11 1HD LYS 11 -17.586 0.698 -5.057 94 2HD LYS 11 2HD LYS 11 -16.276 1.535 -4.223 95 1HE LYS 11 1HE LYS 11 -14.707 0.817 -5.941 96 2HE LYS 11 2HE LYS 11 -15.988 -0.074 -6.759 97 1HZ LYS 11 1HZ LYS 11 -17.149 2.020 -7.124 98 2HZ LYS 11 2HZ LYS 11 -15.900 2.868 -6.360 99 3HZ LYS 11 3HZ LYS 11 -15.604 2.055 -7.813 100 H GLY 12 H GLY 12 -15.401 -2.461 -1.882 101 1HA GLY 12 1HA GLY 12 -13.227 -2.383 -1.088 102 2HA GLY 12 2HA GLY 12 -12.669 -2.794 -2.702 103 H GLU 13 H GLU 13 -14.723 -4.444 -0.299 104 HA GLU 13 HA GLU 13 -12.833 -6.435 0.331 105 1HB GLU 13 1HB GLU 13 -15.846 -6.464 0.576 106 2HB GLU 13 2HB GLU 13 -14.778 -7.666 1.286 107 1HG GLU 13 1HG GLU 13 -14.843 -4.730 1.940 108 2HG GLU 13 2HG GLU 13 -15.461 -6.042 2.941 109 H ALA 14 H ALA 14 -15.090 -6.071 -2.262 110 HA ALA 14 HA ALA 14 -15.071 -8.830 -3.069 111 1HB ALA 14 1HB ALA 14 -16.964 -7.336 -3.576 112 2HB ALA 14 2HB ALA 14 -16.287 -8.077 -5.026 113 3HB ALA 14 3HB ALA 14 -15.918 -6.397 -4.640 114 H PHE 15 H PHE 15 -13.386 -5.878 -4.012 115 HA PHE 15 HA PHE 15 -12.065 -6.857 -6.273 116 1HB PHE 15 1HB PHE 15 -11.825 -4.576 -6.108 117 2HB PHE 15 2HB PHE 15 -11.601 -4.622 -4.348 118 HD1 PHE 15 HD1 PHE 15 -9.541 -4.022 -3.584 119 HD2 PHE 15 HD2 PHE 15 -9.831 -5.854 -7.414 120 HE1 PHE 15 HE1 PHE 15 -7.108 -3.783 -3.875 121 HE2 PHE 15 HE2 PHE 15 -7.399 -5.631 -7.709 122 HZ PHE 15 HZ PHE 15 -6.032 -4.596 -5.935 123 H LEU 16 H LEU 16 -10.975 -6.730 -2.881 124 HA LEU 16 HA LEU 16 -8.529 -8.057 -3.359 125 1HB LEU 16 1HB LEU 16 -8.362 -8.308 -0.970 126 2HB LEU 16 2HB LEU 16 -8.942 -6.703 -1.367 127 HG LEU 16 HG LEU 16 -11.307 -7.845 -0.950 128 1HD1 LEU 16 1HD1 LEU 16 -9.430 -9.438 0.792 129 2HD1 LEU 16 2HD1 LEU 16 -11.188 -9.417 0.920 130 3HD1 LEU 16 3HD1 LEU 16 -10.417 -10.072 -0.525 131 1HD2 LEU 16 1HD2 LEU 16 -9.408 -6.846 1.164 132 2HD2 LEU 16 2HD2 LEU 16 -10.546 -5.892 0.212 133 3HD2 LEU 16 3HD2 LEU 16 -11.143 -7.053 1.398 134 H THR 17 H THR 17 -11.767 -9.199 -2.634 135 HA THR 17 HA THR 17 -11.208 -11.856 -1.991 136 HB THR 17 HB THR 17 -13.594 -10.607 -3.356 137 HG1 THR 17 HG1 THR 17 -14.518 -11.138 -1.262 138 1HG2 THR 17 1HG2 THR 17 -13.150 -13.487 -2.578 139 2HG2 THR 17 2HG2 THR 17 -14.764 -12.783 -2.793 140 3HG2 THR 17 3HG2 THR 17 -13.631 -12.842 -4.159 141 H GLU 18 H GLU 18 -11.862 -10.377 -5.149 142 HA GLU 18 HA GLU 18 -11.390 -12.785 -6.614 143 1HB GLU 18 1HB GLU 18 -12.824 -10.966 -7.479 144 2HB GLU 18 2HB GLU 18 -11.418 -9.916 -7.577 145 1HG GLU 18 1HG GLU 18 -10.404 -11.470 -9.195 146 2HG GLU 18 2HG GLU 18 -11.867 -12.451 -9.133 147 H ASN 19 H ASN 19 -9.487 -10.072 -5.556 148 HA ASN 19 HA ASN 19 -7.246 -10.315 -7.187 149 1HB ASN 19 1HB ASN 19 -7.284 -8.385 -5.877 150 2HB ASN 19 2HB ASN 19 -7.671 -9.272 -4.401 151 1HD2 ASN 19 1HD2 ASN 19 -6.010 -10.639 -3.510 152 2HD2 ASN 19 2HD2 ASN 19 -4.351 -10.218 -3.716 153 H LYS 20 H LYS 20 -8.283 -12.235 -4.490 154 HA LYS 20 HA LYS 20 -6.008 -13.404 -3.542 155 1HB LYS 20 1HB LYS 20 -8.689 -14.663 -4.108 156 2HB LYS 20 2HB LYS 20 -7.414 -15.474 -3.208 157 1HG LYS 20 1HG LYS 20 -7.512 -13.872 -1.461 158 2HG LYS 20 2HG LYS 20 -8.555 -12.810 -2.409 159 1HD LYS 20 1HD LYS 20 -10.358 -14.394 -2.298 160 2HD LYS 20 2HD LYS 20 -9.319 -15.587 -1.515 161 1HE LYS 20 1HE LYS 20 -10.072 -12.903 -0.358 162 2HE LYS 20 2HE LYS 20 -10.815 -14.443 0.080 163 1HZ LYS 20 1HZ LYS 20 -7.949 -13.749 0.439 164 2HZ LYS 20 2HZ LYS 20 -9.112 -13.784 1.666 165 3HZ LYS 20 3HZ LYS 20 -8.674 -15.213 0.876 166 H ASN 21 H ASN 21 -7.238 -13.670 -6.725 167 HA ASN 21 HA ASN 21 -6.186 -16.199 -7.424 168 1HB ASN 21 1HB ASN 21 -6.947 -13.824 -9.122 169 2HB ASN 21 2HB ASN 21 -6.502 -15.401 -9.772 170 1HD2 ASN 21 1HD2 ASN 21 -8.329 -14.847 -6.829 171 2HD2 ASN 21 2HD2 ASN 21 -9.798 -15.551 -7.393 172 H LYS 22 H LYS 22 -4.769 -12.984 -7.351 173 HA LYS 22 HA LYS 22 -2.616 -13.303 -9.065 174 1HB LYS 22 1HB LYS 22 -2.454 -11.863 -6.419 175 2HB LYS 22 2HB LYS 22 -1.514 -11.547 -7.868 176 1HG LYS 22 1HG LYS 22 -4.342 -10.832 -7.254 177 2HG LYS 22 2HG LYS 22 -3.042 -9.832 -7.893 178 1HD LYS 22 1HD LYS 22 -3.176 -11.250 -9.995 179 2HD LYS 22 2HD LYS 22 -4.676 -11.907 -9.332 180 1HE LYS 22 1HE LYS 22 -5.166 -10.090 -10.859 181 2HE LYS 22 2HE LYS 22 -5.602 -9.637 -9.212 182 1HZ LYS 22 1HZ LYS 22 -3.530 -8.395 -9.049 183 2HZ LYS 22 2HZ LYS 22 -3.125 -8.823 -10.636 184 3HZ LYS 22 3HZ LYS 22 -4.466 -7.837 -10.342 185 HA PRO 23 HA PRO 23 -0.501 -16.752 -7.107 186 1HB PRO 23 1HB PRO 23 1.809 -16.481 -8.598 187 2HB PRO 23 2HB PRO 23 0.381 -17.391 -9.106 188 1HG PRO 23 1HG PRO 23 1.214 -14.610 -9.823 189 2HG PRO 23 2HG PRO 23 0.506 -15.870 -10.853 190 1HD PRO 23 1HD PRO 23 -0.974 -13.843 -9.922 191 2HD PRO 23 2HD PRO 23 -1.643 -15.485 -10.056 192 H GLY 24 H GLY 24 0.880 -16.895 -5.410 193 1HA GLY 24 1HA GLY 24 2.958 -14.898 -5.043 194 2HA GLY 24 2HA GLY 24 2.725 -16.345 -4.083 195 H VAL 25 H VAL 25 -0.267 -15.001 -4.143 196 HA VAL 25 HA VAL 25 -0.156 -12.749 -2.533 197 HB VAL 25 HB VAL 25 -2.223 -14.912 -2.777 198 1HG1 VAL 25 1HG1 VAL 25 -2.282 -12.577 -0.870 199 2HG1 VAL 25 2HG1 VAL 25 -3.720 -13.472 -1.370 200 3HG1 VAL 25 3HG1 VAL 25 -2.435 -14.292 -0.480 201 1HG2 VAL 25 1HG2 VAL 25 -1.805 -13.057 -4.494 202 2HG2 VAL 25 2HG2 VAL 25 -3.466 -13.307 -3.946 203 3HG2 VAL 25 3HG2 VAL 25 -2.512 -11.971 -3.298 204 H VAL 26 H VAL 26 0.909 -12.493 -0.703 205 HA VAL 26 HA VAL 26 0.881 -14.674 1.273 206 HB VAL 26 HB VAL 26 3.008 -13.277 2.073 207 1HG1 VAL 26 1HG1 VAL 26 2.950 -15.669 1.596 208 2HG1 VAL 26 2HG1 VAL 26 3.046 -15.329 -0.137 209 3HG1 VAL 26 3HG1 VAL 26 4.402 -14.918 0.922 210 1HG2 VAL 26 1HG2 VAL 26 2.810 -11.634 0.260 211 2HG2 VAL 26 2HG2 VAL 26 4.332 -12.524 0.180 212 3HG2 VAL 26 3HG2 VAL 26 3.015 -12.929 -0.922 213 H VAL 27 H VAL 27 0.099 -14.246 3.220 214 HA VAL 27 HA VAL 27 -0.866 -11.566 3.801 215 HB VAL 27 HB VAL 27 -1.193 -14.082 5.445 216 1HG1 VAL 27 1HG1 VAL 27 -2.632 -11.433 5.490 217 2HG1 VAL 27 2HG1 VAL 27 -3.125 -12.861 6.399 218 3HG1 VAL 27 3HG1 VAL 27 -1.577 -12.089 6.742 219 1HG2 VAL 27 1HG2 VAL 27 -2.122 -14.361 3.189 220 2HG2 VAL 27 2HG2 VAL 27 -3.387 -14.309 4.418 221 3HG2 VAL 27 3HG2 VAL 27 -3.078 -12.895 3.409 222 H LEU 28 H LEU 28 0.008 -10.210 5.274 223 HA LEU 28 HA LEU 28 2.481 -11.058 6.568 224 1HB LEU 28 1HB LEU 28 1.275 -8.307 6.245 225 2HB LEU 28 2HB LEU 28 2.833 -8.640 6.978 226 HG LEU 28 HG LEU 28 2.067 -9.067 4.093 227 1HD1 LEU 28 1HD1 LEU 28 2.540 -6.742 4.767 228 2HD1 LEU 28 2HD1 LEU 28 4.121 -7.256 5.355 229 3HD1 LEU 28 3HD1 LEU 28 3.736 -7.380 3.638 230 1HD2 LEU 28 1HD2 LEU 28 4.581 -9.804 5.584 231 2HD2 LEU 28 2HD2 LEU 28 3.498 -10.881 4.701 232 3HD2 LEU 28 3HD2 LEU 28 4.476 -9.701 3.828 233 HA PRO 29 HA PRO 29 1.111 -11.281 10.749 234 1HB PRO 29 1HB PRO 29 2.832 -8.930 11.399 235 2HB PRO 29 2HB PRO 29 2.752 -10.515 12.178 236 1HG PRO 29 1HG PRO 29 4.769 -9.914 10.555 237 2HG PRO 29 2HG PRO 29 4.042 -11.532 10.537 238 1HD PRO 29 1HD PRO 29 3.728 -9.286 8.593 239 2HD PRO 29 2HD PRO 29 3.781 -11.044 8.300 240 H SER 30 H SER 30 1.212 -8.082 9.283 241 HA SER 30 HA SER 30 -0.747 -7.022 11.131 242 1HB SER 30 1HB SER 30 0.931 -5.910 8.947 243 2HB SER 30 2HB SER 30 -0.585 -5.080 9.300 244 HG SER 30 HG SER 30 1.209 -4.300 10.537 245 H GLY 31 H GLY 31 -0.820 -8.783 8.222 246 1HA GLY 31 1HA GLY 31 -3.672 -8.133 7.991 247 2HA GLY 31 2HA GLY 31 -2.960 -9.665 7.518 248 H LEU 32 H LEU 32 -0.726 -7.844 6.272 249 HA LEU 32 HA LEU 32 -2.158 -6.634 4.062 250 1HB LEU 32 1HB LEU 32 0.790 -6.976 4.548 251 2HB LEU 32 2HB LEU 32 0.086 -6.074 3.220 252 HG LEU 32 HG LEU 32 -1.095 -4.975 5.474 253 1HD1 LEU 32 1HD1 LEU 32 0.530 -6.202 6.847 254 2HD1 LEU 32 2HD1 LEU 32 1.844 -5.414 5.972 255 3HD1 LEU 32 3HD1 LEU 32 0.741 -4.454 6.958 256 1HD2 LEU 32 1HD2 LEU 32 -0.298 -3.867 3.400 257 2HD2 LEU 32 2HD2 LEU 32 0.170 -3.022 4.873 258 3HD2 LEU 32 3HD2 LEU 32 1.350 -4.004 4.007 259 H GLN 33 H GLN 33 -2.334 -7.352 2.056 260 HA GLN 33 HA GLN 33 -1.098 -9.930 1.350 261 1HB GLN 33 1HB GLN 33 -3.770 -8.793 0.527 262 2HB GLN 33 2HB GLN 33 -3.061 -10.231 -0.184 263 1HG GLN 33 1HG GLN 33 -3.083 -11.319 2.020 264 2HG GLN 33 2HG GLN 33 -3.861 -9.864 2.702 265 1HE2 GLN 33 1HE2 GLN 33 -4.823 -12.617 2.585 266 2HE2 GLN 33 2HE2 GLN 33 -6.327 -12.566 1.737 267 H TYR 34 H TYR 34 -0.055 -10.029 -0.628 268 HA TYR 34 HA TYR 34 -0.321 -7.908 -2.551 269 1HB TYR 34 1HB TYR 34 2.018 -7.137 -2.408 270 2HB TYR 34 2HB TYR 34 1.103 -6.777 -0.949 271 HD1 TYR 34 HD1 TYR 34 4.065 -8.240 -2.258 272 HD2 TYR 34 HD2 TYR 34 1.360 -8.439 1.019 273 HE1 TYR 34 HE1 TYR 34 5.782 -9.357 -0.914 274 HE2 TYR 34 HE2 TYR 34 3.068 -9.557 2.366 275 HH TYR 34 HH TYR 34 5.095 -10.873 2.064 276 H LYS 35 H LYS 35 1.479 -8.086 -4.258 277 HA LYS 35 HA LYS 35 2.091 -10.940 -4.717 278 1HB LYS 35 1HB LYS 35 0.296 -9.803 -6.190 279 2HB LYS 35 2HB LYS 35 1.638 -8.942 -6.927 280 1HG LYS 35 1HG LYS 35 1.708 -11.922 -6.748 281 2HG LYS 35 2HG LYS 35 0.742 -11.131 -8.003 282 1HD LYS 35 1HD LYS 35 2.774 -9.890 -8.706 283 2HD LYS 35 2HD LYS 35 3.707 -10.809 -7.523 284 1HE LYS 35 1HE LYS 35 3.902 -11.754 -9.783 285 2HE LYS 35 2HE LYS 35 3.151 -12.884 -8.657 286 1HZ LYS 35 1HZ LYS 35 0.987 -12.267 -9.541 287 2HZ LYS 35 2HZ LYS 35 1.710 -11.184 -10.622 288 3HZ LYS 35 3HZ LYS 35 1.991 -12.846 -10.773 289 H VAL 36 H VAL 36 4.173 -11.324 -4.656 290 HA VAL 36 HA VAL 36 6.137 -9.259 -4.626 291 HB VAL 36 HB VAL 36 6.485 -12.255 -4.705 292 1HG1 VAL 36 1HG1 VAL 36 8.423 -10.014 -4.185 293 2HG1 VAL 36 2HG1 VAL 36 8.722 -11.676 -3.678 294 3HG1 VAL 36 3HG1 VAL 36 8.535 -11.297 -5.390 295 1HG2 VAL 36 1HG2 VAL 36 6.239 -10.281 -2.454 296 2HG2 VAL 36 2HG2 VAL 36 5.279 -11.730 -2.751 297 3HG2 VAL 36 3HG2 VAL 36 6.961 -11.876 -2.240 298 H ILE 37 H ILE 37 7.236 -8.400 -6.207 299 HA ILE 37 HA ILE 37 7.291 -9.722 -8.830 300 HB ILE 37 HB ILE 37 7.970 -6.854 -8.156 301 1HG1 ILE 37 1HG1 ILE 37 5.478 -7.954 -9.474 302 2HG1 ILE 37 2HG1 ILE 37 5.569 -7.458 -7.788 303 1HG2 ILE 37 1HG2 ILE 37 9.107 -7.668 -10.146 304 2HG2 ILE 37 2HG2 ILE 37 7.573 -8.235 -10.808 305 3HG2 ILE 37 3HG2 ILE 37 7.851 -6.508 -10.583 306 1HD1 ILE 37 1HD1 ILE 37 6.129 -5.177 -8.521 307 2HD1 ILE 37 2HD1 ILE 37 5.944 -5.697 -10.197 308 3HD1 ILE 37 3HD1 ILE 37 4.557 -5.722 -9.107 309 H ASN 38 H ASN 38 9.495 -7.551 -7.023 310 HA ASN 38 HA ASN 38 11.689 -9.441 -7.567 311 1HB ASN 38 1HB ASN 38 11.894 -7.584 -9.143 312 2HB ASN 38 2HB ASN 38 11.789 -6.424 -7.821 313 1HD2 ASN 38 1HD2 ASN 38 13.762 -5.504 -8.179 314 2HD2 ASN 38 2HD2 ASN 38 15.257 -6.328 -7.909 315 H SER 39 H SER 39 11.659 -10.244 -5.459 316 HA SER 39 HA SER 39 12.073 -8.298 -3.294 317 1HB SER 39 1HB SER 39 11.372 -10.063 -1.765 318 2HB SER 39 2HB SER 39 10.169 -9.850 -3.036 319 HG SER 39 HG SER 39 10.599 -11.782 -3.784 320 H GLY 40 H GLY 40 13.775 -8.440 -1.879 321 1HA GLY 40 1HA GLY 40 15.643 -10.640 -1.985 322 2HA GLY 40 2HA GLY 40 15.754 -9.225 -0.952 323 H ASN 41 H ASN 41 16.999 -7.503 -1.568 324 HA ASN 41 HA ASN 41 18.818 -8.018 -3.761 325 1HB ASN 41 1HB ASN 41 17.154 -5.489 -3.725 326 2HB ASN 41 2HB ASN 41 18.461 -5.845 -4.849 327 1HD2 ASN 41 1HD2 ASN 41 15.206 -6.569 -3.897 328 2HD2 ASN 41 2HD2 ASN 41 14.760 -7.429 -5.327 329 H GLY 42 H GLY 42 18.086 -4.927 -2.173 330 1HA GLY 42 1HA GLY 42 19.710 -3.436 -1.358 331 2HA GLY 42 2HA GLY 42 20.872 -4.754 -1.346 332 H VAL 43 H VAL 43 21.096 -3.333 0.715 333 HA VAL 43 HA VAL 43 20.047 -4.882 2.931 334 HB VAL 43 HB VAL 43 21.639 -3.225 4.194 335 1HG1 VAL 43 1HG1 VAL 43 22.660 -5.422 2.404 336 2HG1 VAL 43 2HG1 VAL 43 23.516 -4.756 3.795 337 3HG1 VAL 43 3HG1 VAL 43 21.995 -5.619 4.026 338 1HG2 VAL 43 1HG2 VAL 43 22.017 -1.736 2.298 339 2HG2 VAL 43 2HG2 VAL 43 23.525 -2.474 2.838 340 3HG2 VAL 43 3HG2 VAL 43 22.721 -3.072 1.387 341 H LYS 44 H LYS 44 19.734 -3.380 5.011 342 HA LYS 44 HA LYS 44 18.780 -0.810 4.966 343 1HB LYS 44 1HB LYS 44 16.305 -1.116 4.790 344 2HB LYS 44 2HB LYS 44 17.166 -1.352 3.279 345 1HG LYS 44 1HG LYS 44 15.777 -3.141 3.185 346 2HG LYS 44 2HG LYS 44 17.114 -3.879 4.069 347 1HD LYS 44 1HD LYS 44 15.283 -4.513 5.334 348 2HD LYS 44 2HD LYS 44 15.827 -3.064 6.176 349 1HE LYS 44 1HE LYS 44 13.611 -3.174 4.132 350 2HE LYS 44 2HE LYS 44 13.387 -3.115 5.879 351 1HZ LYS 44 1HZ LYS 44 14.534 -0.960 5.884 352 2HZ LYS 44 2HZ LYS 44 14.645 -1.016 4.196 353 3HZ LYS 44 3HZ LYS 44 13.128 -0.930 4.941 354 HA PRO 45 HA PRO 45 17.938 -1.799 9.193 355 1HB PRO 45 1HB PRO 45 16.714 0.711 9.672 356 2HB PRO 45 2HB PRO 45 18.410 0.285 9.895 357 1HG PRO 45 1HG PRO 45 17.412 2.075 8.006 358 2HG PRO 45 2HG PRO 45 19.022 1.336 7.988 359 1HD PRO 45 1HD PRO 45 16.578 0.593 6.454 360 2HD PRO 45 2HD PRO 45 18.284 0.518 5.975 361 H GLY 46 H GLY 46 16.227 -1.546 10.882 362 1HA GLY 46 1HA GLY 46 14.188 -2.252 11.663 363 2HA GLY 46 2HA GLY 46 13.847 -2.851 10.043 364 H LYS 47 H LYS 47 11.765 -1.803 11.368 365 HA LYS 47 HA LYS 47 10.561 -0.062 9.689 366 1HB LYS 47 1HB LYS 47 10.147 -0.047 12.677 367 2HB LYS 47 2HB LYS 47 8.993 0.473 11.457 368 1HG LYS 47 1HG LYS 47 8.863 -1.814 10.605 369 2HG LYS 47 2HG LYS 47 10.018 -2.333 11.837 370 1HD LYS 47 1HD LYS 47 8.439 -1.567 13.581 371 2HD LYS 47 2HD LYS 47 7.277 -1.164 12.316 372 1HE LYS 47 1HE LYS 47 6.772 -3.334 13.298 373 2HE LYS 47 2HE LYS 47 7.242 -3.505 11.606 374 1HZ LYS 47 1HZ LYS 47 9.042 -3.960 13.924 375 2HZ LYS 47 2HZ LYS 47 8.273 -5.179 13.038 376 3HZ LYS 47 3HZ LYS 47 9.432 -4.193 12.295 377 H SER 48 H SER 48 13.153 0.860 11.728 378 HA SER 48 HA SER 48 12.375 3.656 11.816 379 1HB SER 48 1HB SER 48 13.597 2.683 13.719 380 2HB SER 48 2HB SER 48 14.959 2.315 12.661 381 HG SER 48 HG SER 48 13.937 4.919 13.152 382 H ASP 49 H ASP 49 13.289 1.832 9.388 383 HA ASP 49 HA ASP 49 15.494 3.259 8.234 384 1HB ASP 49 1HB ASP 49 15.128 1.863 6.300 385 2HB ASP 49 2HB ASP 49 14.996 0.875 7.751 386 H THR 50 H THR 50 15.416 4.505 6.276 387 HA THR 50 HA THR 50 12.800 5.776 5.713 388 HB THR 50 HB THR 50 15.504 7.155 5.630 389 HG1 THR 50 HG1 THR 50 14.756 8.227 7.516 390 1HG2 THR 50 1HG2 THR 50 13.845 8.049 4.054 391 2HG2 THR 50 2HG2 THR 50 12.702 8.258 5.381 392 3HG2 THR 50 3HG2 THR 50 14.194 9.197 5.346 393 H VAL 51 H VAL 51 12.221 5.473 3.603 394 HA VAL 51 HA VAL 51 14.402 4.950 1.694 395 HB VAL 51 HB VAL 51 13.005 3.297 0.556 396 1HG1 VAL 51 1HG1 VAL 51 13.418 2.742 3.493 397 2HG1 VAL 51 2HG1 VAL 51 13.159 1.516 2.247 398 3HG1 VAL 51 3HG1 VAL 51 14.607 2.527 2.204 399 1HG2 VAL 51 1HG2 VAL 51 11.101 3.718 2.862 400 2HG2 VAL 51 2HG2 VAL 51 10.807 4.131 1.170 401 3HG2 VAL 51 3HG2 VAL 51 10.972 2.440 1.649 402 H THR 52 H THR 52 14.079 5.503 -0.443 403 HA THR 52 HA THR 52 11.899 7.429 -0.923 404 HB THR 52 HB THR 52 14.655 7.328 -2.180 405 HG1 THR 52 HG1 THR 52 13.808 9.579 -0.801 406 1HG2 THR 52 1HG2 THR 52 12.368 9.253 -2.606 407 2HG2 THR 52 2HG2 THR 52 14.004 9.478 -3.221 408 3HG2 THR 52 3HG2 THR 52 13.027 8.124 -3.788 409 H VAL 53 H VAL 53 10.425 6.741 -2.343 410 HA VAL 53 HA VAL 53 11.268 5.017 -4.553 411 HB VAL 53 HB VAL 53 9.636 3.363 -4.191 412 1HG1 VAL 53 1HG1 VAL 53 11.587 3.124 -2.750 413 2HG1 VAL 53 2HG1 VAL 53 10.768 4.061 -1.482 414 3HG1 VAL 53 3HG1 VAL 53 10.127 2.477 -1.970 415 1HG2 VAL 53 1HG2 VAL 53 8.480 5.145 -2.050 416 2HG2 VAL 53 2HG2 VAL 53 7.745 4.738 -3.602 417 3HG2 VAL 53 3HG2 VAL 53 7.954 3.491 -2.370 418 H GLU 54 H GLU 54 9.247 4.568 -5.979 419 HA GLU 54 HA GLU 54 7.637 7.025 -6.224 420 1HB GLU 54 1HB GLU 54 9.457 6.912 -7.930 421 2HB GLU 54 2HB GLU 54 8.792 5.388 -8.497 422 1HG GLU 54 1HG GLU 54 6.827 6.436 -9.301 423 2HG GLU 54 2HG GLU 54 7.221 7.946 -8.477 424 H TYR 55 H TYR 55 5.461 6.666 -6.432 425 HA TYR 55 HA TYR 55 4.572 4.017 -7.276 426 1HB TYR 55 1HB TYR 55 3.338 3.504 -5.356 427 2HB TYR 55 2HB TYR 55 4.858 4.120 -4.722 428 HD1 TYR 55 HD1 TYR 55 4.882 6.675 -4.138 429 HD2 TYR 55 HD2 TYR 55 1.335 4.351 -4.534 430 HE1 TYR 55 HE1 TYR 55 3.656 8.328 -2.797 431 HE2 TYR 55 HE2 TYR 55 0.091 6.003 -3.191 432 HH TYR 55 HH TYR 55 1.363 9.077 -2.440 433 H THR 56 H THR 56 2.242 3.877 -7.506 434 HA THR 56 HA THR 56 0.936 6.450 -8.076 435 HB THR 56 HB THR 56 0.783 3.970 -9.815 436 HG1 THR 56 HG1 THR 56 2.171 4.966 -11.123 437 1HG2 THR 56 1HG2 THR 56 -1.323 5.245 -9.725 438 2HG2 THR 56 2HG2 THR 56 -0.450 6.701 -10.205 439 3HG2 THR 56 3HG2 THR 56 -0.566 5.336 -11.316 440 H GLY 57 H GLY 57 -0.757 6.580 -6.721 441 1HA GLY 57 1HA GLY 57 -1.983 5.470 -4.927 442 2HA GLY 57 2HA GLY 57 -2.045 4.040 -5.944 443 H ARG 58 H ARG 58 -4.201 3.794 -5.970 444 HA ARG 58 HA ARG 58 -5.894 6.030 -6.750 445 1HB ARG 58 1HB ARG 58 -6.934 4.721 -8.589 446 2HB ARG 58 2HB ARG 58 -5.248 5.138 -8.906 447 1HG ARG 58 1HG ARG 58 -5.155 2.972 -9.522 448 2HG ARG 58 2HG ARG 58 -4.891 2.734 -7.792 449 1HD ARG 58 1HD ARG 58 -6.551 1.175 -8.431 450 2HD ARG 58 2HD ARG 58 -7.391 2.466 -7.570 451 HE ARG 58 HE ARG 58 -7.834 3.339 -9.944 452 1HH1 ARG 58 1HH1 ARG 58 -7.623 -0.027 -9.064 453 2HH1 ARG 58 2HH1 ARG 58 -8.668 -0.558 -10.339 454 1HH2 ARG 58 1HH2 ARG 58 -9.206 2.647 -11.629 455 2HH2 ARG 58 2HH2 ARG 58 -9.566 0.962 -11.798 456 H LEU 59 H LEU 59 -8.049 5.757 -6.182 457 HA LEU 59 HA LEU 59 -8.498 3.826 -4.096 458 1HB LEU 59 1HB LEU 59 -10.166 6.024 -5.305 459 2HB LEU 59 2HB LEU 59 -10.824 4.917 -4.115 460 HG LEU 59 HG LEU 59 -8.314 6.375 -3.435 461 1HD1 LEU 59 1HD1 LEU 59 -9.733 8.119 -4.378 462 2HD1 LEU 59 2HD1 LEU 59 -11.065 7.608 -3.343 463 3HD1 LEU 59 3HD1 LEU 59 -9.605 8.289 -2.628 464 1HD2 LEU 59 1HD2 LEU 59 -9.269 4.669 -1.940 465 2HD2 LEU 59 2HD2 LEU 59 -9.259 6.270 -1.203 466 3HD2 LEU 59 3HD2 LEU 59 -10.760 5.605 -1.845 467 H ILE 60 H ILE 60 -10.339 2.366 -4.055 468 HA ILE 60 HA ILE 60 -10.540 0.739 -6.326 469 HB ILE 60 HB ILE 60 -11.061 -0.035 -4.031 470 1HG1 ILE 60 1HG1 ILE 60 -13.062 -1.395 -4.612 471 2HG1 ILE 60 2HG1 ILE 60 -13.301 -0.387 -6.034 472 1HG2 ILE 60 1HG2 ILE 60 -12.305 2.002 -3.353 473 2HG2 ILE 60 2HG2 ILE 60 -13.662 1.452 -4.341 474 3HG2 ILE 60 3HG2 ILE 60 -13.135 0.495 -2.954 475 1HD1 ILE 60 1HD1 ILE 60 -11.138 -1.111 -6.906 476 2HD1 ILE 60 2HD1 ILE 60 -10.912 -2.130 -5.482 477 3HD1 ILE 60 3HD1 ILE 60 -12.221 -2.475 -6.615 478 H ASP 61 H ASP 61 -11.851 3.739 -5.685 479 HA ASP 61 HA ASP 61 -14.371 3.572 -6.964 480 1HB ASP 61 1HB ASP 61 -13.701 5.415 -5.443 481 2HB ASP 61 2HB ASP 61 -12.568 5.983 -6.665 482 H GLY 62 H GLY 62 -11.264 3.305 -8.200 483 1HA GLY 62 1HA GLY 62 -12.302 3.544 -10.910 484 2HA GLY 62 2HA GLY 62 -10.780 2.806 -10.441 485 H THR 63 H THR 63 -10.841 5.685 -8.831 486 HA THR 63 HA THR 63 -9.542 7.076 -11.078 487 HB THR 63 HB THR 63 -11.631 8.197 -10.603 488 HG1 THR 63 HG1 THR 63 -9.329 9.347 -10.630 489 1HG2 THR 63 1HG2 THR 63 -10.632 8.406 -7.759 490 2HG2 THR 63 2HG2 THR 63 -12.082 9.186 -8.395 491 3HG2 THR 63 3HG2 THR 63 -11.989 7.426 -8.318 492 H VAL 64 H VAL 64 -7.617 8.023 -10.715 493 HA VAL 64 HA VAL 64 -6.064 7.221 -8.501 494 HB VAL 64 HB VAL 64 -5.001 7.629 -10.636 495 1HG1 VAL 64 1HG1 VAL 64 -6.496 9.350 -11.484 496 2HG1 VAL 64 2HG1 VAL 64 -5.863 10.500 -10.309 497 3HG1 VAL 64 3HG1 VAL 64 -4.818 9.880 -11.585 498 1HG2 VAL 64 1HG2 VAL 64 -4.155 9.613 -8.527 499 2HG2 VAL 64 2HG2 VAL 64 -3.583 7.956 -8.726 500 3HG2 VAL 64 3HG2 VAL 64 -3.186 9.177 -9.935 501 H PHE 65 H PHE 65 -5.666 8.210 -6.613 502 HA PHE 65 HA PHE 65 -7.070 10.720 -6.127 503 1HB PHE 65 1HB PHE 65 -6.814 10.209 -3.729 504 2HB PHE 65 2HB PHE 65 -7.620 8.914 -4.604 505 HD1 PHE 65 HD1 PHE 65 -4.245 8.573 -5.395 506 HD2 PHE 65 HD2 PHE 65 -6.946 8.057 -2.171 507 HE1 PHE 65 HE1 PHE 65 -2.676 7.018 -4.357 508 HE2 PHE 65 HE2 PHE 65 -5.394 6.468 -1.143 509 HZ PHE 65 HZ PHE 65 -3.234 5.957 -2.220 510 H ASP 66 H ASP 66 -3.851 9.433 -6.324 511 HA ASP 66 HA ASP 66 -2.653 11.935 -6.535 512 1HB ASP 66 1HB ASP 66 -3.105 12.139 -4.127 513 2HB ASP 66 2HB ASP 66 -2.256 10.625 -3.831 514 H SER 67 H SER 67 -0.772 11.648 -7.589 515 HA SER 67 HA SER 67 0.672 9.119 -7.204 516 1HB SER 67 1HB SER 67 -0.023 10.355 -9.877 517 2HB SER 67 2HB SER 67 1.062 8.984 -9.653 518 HG SER 67 HG SER 67 -1.256 8.562 -10.157 519 H THR 68 H THR 68 2.751 9.427 -6.776 520 HA THR 68 HA THR 68 3.905 12.073 -7.089 521 HB THR 68 HB THR 68 5.828 11.171 -5.836 522 HG1 THR 68 HG1 THR 68 4.821 8.825 -6.679 523 1HG2 THR 68 1HG2 THR 68 3.857 12.007 -4.608 524 2HG2 THR 68 2HG2 THR 68 3.192 10.374 -4.592 525 3HG2 THR 68 3HG2 THR 68 4.692 10.723 -3.733 526 H GLU 69 H GLU 69 3.737 9.205 -8.844 527 HA GLU 69 HA GLU 69 6.287 9.263 -10.108 528 1HB GLU 69 1HB GLU 69 4.840 7.249 -9.853 529 2HB GLU 69 2HB GLU 69 3.722 7.953 -11.012 530 1HG GLU 69 1HG GLU 69 6.515 7.751 -11.896 531 2HG GLU 69 2HG GLU 69 5.666 6.229 -11.638 532 H LYS 70 H LYS 70 3.013 10.231 -11.097 533 HA LYS 70 HA LYS 70 3.728 11.143 -13.665 534 1HB LYS 70 1HB LYS 70 1.423 10.605 -13.060 535 2HB LYS 70 2HB LYS 70 1.396 11.936 -11.912 536 1HG LYS 70 1HG LYS 70 1.648 13.531 -13.734 537 2HG LYS 70 2HG LYS 70 1.715 12.203 -14.895 538 1HD LYS 70 1HD LYS 70 -0.544 11.540 -14.306 539 2HD LYS 70 2HD LYS 70 -0.615 12.801 -13.073 540 1HE LYS 70 1HE LYS 70 -1.784 13.485 -15.108 541 2HE LYS 70 2HE LYS 70 -0.385 14.512 -14.799 542 1HZ LYS 70 1HZ LYS 70 0.864 13.220 -16.426 543 2HZ LYS 70 2HZ LYS 70 -0.498 12.263 -16.737 544 3HZ LYS 70 3HZ LYS 70 -0.514 13.910 -17.123 545 H THR 71 H THR 71 3.577 12.767 -10.539 546 HA THR 71 HA THR 71 3.857 15.408 -11.427 547 HB THR 71 HB THR 71 4.767 15.896 -9.171 548 HG1 THR 71 HG1 THR 71 4.416 13.634 -7.917 549 1HG2 THR 71 1HG2 THR 71 2.347 15.789 -9.528 550 2HG2 THR 71 2HG2 THR 71 2.369 14.059 -9.189 551 3HG2 THR 71 3HG2 THR 71 2.776 15.212 -7.918 552 H GLY 72 H GLY 72 6.065 12.835 -11.558 553 1HA GLY 72 1HA GLY 72 8.097 14.543 -12.676 554 2HA GLY 72 2HA GLY 72 8.167 12.794 -12.529 555 H LYS 73 H LYS 73 7.367 13.615 -9.543 556 HA LYS 73 HA LYS 73 10.166 13.960 -8.698 557 1HB LYS 73 1HB LYS 73 7.681 15.061 -7.379 558 2HB LYS 73 2HB LYS 73 9.303 15.167 -6.715 559 1HG LYS 73 1HG LYS 73 8.405 16.389 -9.314 560 2HG LYS 73 2HG LYS 73 8.600 17.250 -7.788 561 1HD LYS 73 1HD LYS 73 10.994 16.590 -7.784 562 2HD LYS 73 2HD LYS 73 10.762 15.872 -9.379 563 1HE LYS 73 1HE LYS 73 10.357 18.772 -8.654 564 2HE LYS 73 2HE LYS 73 11.720 18.108 -9.554 565 1HZ LYS 73 1HZ LYS 73 8.885 18.032 -10.437 566 2HZ LYS 73 2HZ LYS 73 10.059 19.104 -11.012 567 3HZ LYS 73 3HZ LYS 73 10.212 17.446 -11.307 568 HA PRO 74 HA PRO 74 9.424 9.893 -6.908 569 1HB PRO 74 1HB PRO 74 11.874 10.622 -5.388 570 2HB PRO 74 2HB PRO 74 11.524 9.169 -6.331 571 1HG PRO 74 1HG PRO 74 13.172 11.032 -7.276 572 2HG PRO 74 2HG PRO 74 12.034 10.194 -8.348 573 1HD PRO 74 1HD PRO 74 11.880 12.950 -7.198 574 2HD PRO 74 2HD PRO 74 11.409 12.372 -8.809 575 H ALA 75 H ALA 75 8.687 9.089 -4.953 576 HA ALA 75 HA ALA 75 7.940 11.110 -2.988 577 1HB ALA 75 1HB ALA 75 7.035 8.258 -3.016 578 2HB ALA 75 2HB ALA 75 6.266 9.642 -2.248 579 3HB ALA 75 3HB ALA 75 6.278 9.500 -4.004 580 H THR 76 H THR 76 8.917 11.291 -1.067 581 HA THR 76 HA THR 76 10.592 9.044 -0.132 582 HB THR 76 HB THR 76 11.046 11.999 0.343 583 HG1 THR 76 HG1 THR 76 13.009 11.395 -0.952 584 1HG2 THR 76 1HG2 THR 76 12.668 9.576 1.130 585 2HG2 THR 76 2HG2 THR 76 13.209 11.247 1.286 586 3HG2 THR 76 3HG2 THR 76 11.825 10.677 2.219 587 H PHE 77 H PHE 77 9.738 8.089 1.586 588 HA PHE 77 HA PHE 77 8.758 9.697 3.798 589 1HB PHE 77 1HB PHE 77 6.658 8.311 3.946 590 2HB PHE 77 2HB PHE 77 6.714 9.432 2.590 591 HD1 PHE 77 HD1 PHE 77 6.842 8.639 0.323 592 HD2 PHE 77 HD2 PHE 77 6.835 5.912 3.590 593 HE1 PHE 77 HE1 PHE 77 6.393 6.785 -1.231 594 HE2 PHE 77 HE2 PHE 77 6.386 4.053 2.041 595 HZ PHE 77 HZ PHE 77 6.166 4.488 -0.372 596 H GLN 78 H GLN 78 8.749 8.633 5.780 597 HA GLN 78 HA GLN 78 10.531 6.359 5.957 598 1HB GLN 78 1HB GLN 78 9.743 8.515 7.640 599 2HB GLN 78 2HB GLN 78 9.325 7.024 8.473 600 1HG GLN 78 1HG GLN 78 11.986 6.990 7.281 601 2HG GLN 78 2HG GLN 78 11.768 8.241 8.504 602 1HE2 GLN 78 1HE2 GLN 78 10.034 5.213 8.533 603 2HE2 GLN 78 2HE2 GLN 78 10.817 4.551 9.923 604 H VAL 79 H VAL 79 10.001 4.313 6.641 605 HA VAL 79 HA VAL 79 7.429 3.338 6.038 606 HB VAL 79 HB VAL 79 9.272 1.863 5.768 607 1HG1 VAL 79 1HG1 VAL 79 9.823 2.345 8.685 608 2HG1 VAL 79 2HG1 VAL 79 10.598 1.075 7.734 609 3HG1 VAL 79 3HG1 VAL 79 10.844 2.772 7.309 610 1HG2 VAL 79 1HG2 VAL 79 7.153 0.827 6.522 611 2HG2 VAL 79 2HG2 VAL 79 8.578 -0.103 6.986 612 3HG2 VAL 79 3HG2 VAL 79 7.744 0.891 8.182 613 H SER 80 H SER 80 8.787 4.543 9.001 614 HA SER 80 HA SER 80 6.692 3.325 10.619 615 1HB SER 80 1HB SER 80 8.952 3.398 11.547 616 2HB SER 80 2HB SER 80 8.971 5.156 11.403 617 HG SER 80 HG SER 80 7.884 3.590 13.338 618 H GLN 81 H GLN 81 7.067 6.111 8.794 619 HA GLN 81 HA GLN 81 5.406 7.776 10.514 620 1HB GLN 81 1HB GLN 81 6.738 8.316 7.861 621 2HB GLN 81 2HB GLN 81 5.727 9.484 8.700 622 1HG GLN 81 1HG GLN 81 7.262 9.429 10.608 623 2HG GLN 81 2HG GLN 81 8.286 8.288 9.737 624 1HE2 GLN 81 1HE2 GLN 81 10.045 9.670 9.762 625 2HE2 GLN 81 2HE2 GLN 81 10.124 11.088 8.778 626 H VAL 82 H VAL 82 4.664 5.312 8.579 627 HA VAL 82 HA VAL 82 2.265 6.640 7.494 628 HB VAL 82 HB VAL 82 2.170 4.696 5.881 629 1HG1 VAL 82 1HG1 VAL 82 4.527 6.575 5.738 630 2HG1 VAL 82 2HG1 VAL 82 3.850 5.681 4.378 631 3HG1 VAL 82 3HG1 VAL 82 2.884 6.911 5.191 632 1HG2 VAL 82 1HG2 VAL 82 4.978 4.291 6.907 633 2HG2 VAL 82 2HG2 VAL 82 3.634 3.157 7.033 634 3HG2 VAL 82 3HG2 VAL 82 4.316 3.543 5.453 635 H ILE 83 H ILE 83 0.560 4.756 6.954 636 HA ILE 83 HA ILE 83 -0.600 4.025 9.367 637 HB ILE 83 HB ILE 83 -2.028 2.484 7.986 638 1HG1 ILE 83 1HG1 ILE 83 -0.364 3.579 5.706 639 2HG1 ILE 83 2HG1 ILE 83 -0.252 1.933 6.322 640 1HG2 ILE 83 1HG2 ILE 83 -1.662 5.308 6.988 641 2HG2 ILE 83 2HG2 ILE 83 -3.095 4.309 6.739 642 3HG2 ILE 83 3HG2 ILE 83 -2.638 4.806 8.368 643 1HD1 ILE 83 1HD1 ILE 83 -2.687 3.183 5.070 644 2HD1 ILE 83 2HD1 ILE 83 -1.588 2.042 4.296 645 3HD1 ILE 83 3HD1 ILE 83 -2.565 1.531 5.672 646 HA PRO 84 HA PRO 84 1.173 0.351 11.019 647 1HB PRO 84 1HB PRO 84 -1.099 -1.320 10.994 648 2HB PRO 84 2HB PRO 84 -0.557 -0.290 12.320 649 1HG PRO 84 1HG PRO 84 -2.635 0.219 10.252 650 2HG PRO 84 2HG PRO 84 -2.582 0.736 11.947 651 1HD PRO 84 1HD PRO 84 -2.090 2.456 9.967 652 2HD PRO 84 2HD PRO 84 -1.164 2.522 11.483 653 H GLY 85 H GLY 85 -1.289 -0.749 8.655 654 1HA GLY 85 1HA GLY 85 -1.038 -2.019 6.745 655 2HA GLY 85 2HA GLY 85 -0.146 -3.082 7.827 656 H TRP 86 H TRP 86 0.580 0.144 6.486 657 HA TRP 86 HA TRP 86 2.455 -0.733 4.591 658 1HB TRP 86 1HB TRP 86 1.605 1.845 5.714 659 2HB TRP 86 2HB TRP 86 3.268 1.819 5.143 660 HD1 TRP 86 HD1 TRP 86 0.515 -0.173 3.352 661 HE1 TRP 86 HE1 TRP 86 0.187 0.824 0.997 662 HE3 TRP 86 HE3 TRP 86 3.519 3.939 3.783 663 HZ2 TRP 86 HZ2 TRP 86 1.076 3.060 -0.472 664 HZ3 TRP 86 HZ3 TRP 86 3.723 5.458 1.858 665 HH2 TRP 86 HH2 TRP 86 2.526 5.026 -0.226 666 H THR 87 H THR 87 2.859 0.176 7.992 667 HA THR 87 HA THR 87 5.646 0.397 8.016 668 HB THR 87 HB THR 87 5.594 0.063 10.389 669 HG1 THR 87 HG1 THR 87 4.282 -1.768 10.537 670 1HG2 THR 87 1HG2 THR 87 3.111 1.470 9.420 671 2HG2 THR 87 2HG2 THR 87 3.747 1.592 11.059 672 3HG2 THR 87 3HG2 THR 87 4.697 2.184 9.697 673 H GLU 88 H GLU 88 3.586 -2.462 8.337 674 HA GLU 88 HA GLU 88 5.711 -4.249 8.965 675 1HB GLU 88 1HB GLU 88 2.847 -4.506 8.247 676 2HB GLU 88 2HB GLU 88 3.858 -5.919 7.986 677 1HG GLU 88 1HG GLU 88 3.484 -4.447 10.585 678 2HG GLU 88 2HG GLU 88 2.796 -6.016 10.150 679 H ALA 89 H ALA 89 3.922 -3.685 5.925 680 HA ALA 89 HA ALA 89 5.398 -5.563 4.422 681 1HB ALA 89 1HB ALA 89 3.186 -4.754 3.759 682 2HB ALA 89 2HB ALA 89 4.375 -4.561 2.468 683 3HB ALA 89 3HB ALA 89 3.874 -3.162 3.424 684 H LEU 90 H LEU 90 5.630 -2.006 4.523 685 HA LEU 90 HA LEU 90 7.738 -1.720 2.727 686 1HB LEU 90 1HB LEU 90 6.694 -0.053 4.977 687 2HB LEU 90 2HB LEU 90 8.181 0.416 4.179 688 HG LEU 90 HG LEU 90 6.165 1.586 3.316 689 1HD1 LEU 90 1HD1 LEU 90 7.579 -0.195 1.342 690 2HD1 LEU 90 2HD1 LEU 90 6.686 1.274 0.948 691 3HD1 LEU 90 3HD1 LEU 90 8.147 1.367 1.932 692 1HD2 LEU 90 1HD2 LEU 90 4.553 -0.234 3.540 693 2HD2 LEU 90 2HD2 LEU 90 4.603 0.372 1.885 694 3HD2 LEU 90 3HD2 LEU 90 5.400 -1.148 2.293 695 H GLN 91 H GLN 91 7.779 -2.761 6.039 696 HA GLN 91 HA GLN 91 10.598 -2.259 6.407 697 1HB GLN 91 1HB GLN 91 9.080 -2.140 8.316 698 2HB GLN 91 2HB GLN 91 8.633 -3.832 8.086 699 1HG GLN 91 1HG GLN 91 11.497 -3.132 8.523 700 2HG GLN 91 2HG GLN 91 10.389 -3.133 9.893 701 1HE2 GLN 91 1HE2 GLN 91 12.674 -4.868 9.276 702 2HE2 GLN 91 2HE2 GLN 91 12.056 -6.481 9.284 703 H LEU 92 H LEU 92 8.700 -4.786 5.072 704 HA LEU 92 HA LEU 92 10.745 -6.809 5.511 705 1HB LEU 92 1HB LEU 92 8.068 -6.902 4.134 706 2HB LEU 92 2HB LEU 92 9.162 -8.268 4.212 707 HG LEU 92 HG LEU 92 7.985 -6.891 6.626 708 1HD1 LEU 92 1HD1 LEU 92 7.178 -9.441 5.239 709 2HD1 LEU 92 2HD1 LEU 92 6.587 -8.914 6.817 710 3HD1 LEU 92 3HD1 LEU 92 6.225 -7.962 5.374 711 1HD2 LEU 92 1HD2 LEU 92 9.541 -9.458 6.330 712 2HD2 LEU 92 2HD2 LEU 92 10.113 -7.971 7.085 713 3HD2 LEU 92 3HD2 LEU 92 8.791 -8.880 7.818 714 H MET 93 H MET 93 9.799 -4.571 3.049 715 HA MET 93 HA MET 93 11.061 -6.018 0.915 716 1HB MET 93 1HB MET 93 10.617 -3.943 -0.387 717 2HB MET 93 2HB MET 93 9.185 -4.656 0.342 718 1HG MET 93 1HG MET 93 9.110 -2.981 2.014 719 2HG MET 93 2HG MET 93 10.705 -2.375 1.569 720 1HE MET 93 1HE MET 93 6.967 -2.769 0.452 721 2HE MET 93 2HE MET 93 6.978 -1.974 -1.123 722 3HE MET 93 3HE MET 93 7.845 -3.495 -0.895 723 HA PRO 94 HA PRO 94 15.099 -4.295 1.915 724 1HB PRO 94 1HB PRO 94 16.537 -5.759 0.209 725 2HB PRO 94 2HB PRO 94 15.786 -6.506 1.628 726 1HG PRO 94 1HG PRO 94 14.825 -6.460 -1.215 727 2HG PRO 94 2HG PRO 94 14.919 -7.833 -0.098 728 1HD PRO 94 1HD PRO 94 12.620 -6.431 -0.568 729 2HD PRO 94 2HD PRO 94 12.978 -7.250 0.994 730 H ALA 95 H ALA 95 16.434 -2.736 0.993 731 HA ALA 95 HA ALA 95 15.506 -1.024 -0.922 732 1HB ALA 95 1HB ALA 95 18.304 -1.665 -0.053 733 2HB ALA 95 2HB ALA 95 17.306 -0.269 0.358 734 3HB ALA 95 3HB ALA 95 17.980 -0.425 -1.264 735 H GLY 96 H GLY 96 15.222 -1.081 -3.071 736 1HA GLY 96 1HA GLY 96 16.934 -2.821 -4.694 737 2HA GLY 96 2HA GLY 96 15.935 -1.506 -5.295 738 H SER 97 H SER 97 14.090 -3.218 -3.135 739 HA SER 97 HA SER 97 13.295 -5.396 -4.844 740 1HB SER 97 1HB SER 97 11.612 -5.848 -3.100 741 2HB SER 97 2HB SER 97 13.220 -5.638 -2.408 742 HG SER 97 HG SER 97 12.405 -3.299 -2.251 743 H THR 98 H THR 98 10.649 -5.586 -4.785 744 HA THR 98 HA THR 98 9.328 -3.161 -5.615 745 HB THR 98 HB THR 98 9.612 -5.328 -7.697 746 HG1 THR 98 HG1 THR 98 11.338 -4.327 -8.476 747 1HG2 THR 98 1HG2 THR 98 8.639 -2.471 -7.826 748 2HG2 THR 98 2HG2 THR 98 8.781 -3.565 -9.204 749 3HG2 THR 98 3HG2 THR 98 7.638 -3.922 -7.908 750 H TRP 99 H TRP 99 7.546 -3.491 -4.400 751 HA TRP 99 HA TRP 99 6.080 -6.017 -4.811 752 1HB TRP 99 1HB TRP 99 6.515 -4.474 -2.260 753 2HB TRP 99 2HB TRP 99 5.193 -5.618 -2.441 754 HD1 TRP 99 HD1 TRP 99 7.632 -7.405 -4.253 755 HE1 TRP 99 HE1 TRP 99 9.024 -8.984 -2.778 756 HE3 TRP 99 HE3 TRP 99 6.534 -5.424 0.327 757 HZ2 TRP 99 HZ2 TRP 99 9.582 -9.352 -0.036 758 HZ3 TRP 99 HZ3 TRP 99 7.534 -6.448 2.327 759 HH2 TRP 99 HH2 TRP 99 9.024 -8.373 2.148 760 H GLU 100 H GLU 100 3.845 -5.915 -4.856 761 HA GLU 100 HA GLU 100 2.667 -3.215 -4.992 762 1HB GLU 100 1HB GLU 100 0.958 -4.256 -6.527 763 2HB GLU 100 2HB GLU 100 2.580 -4.158 -7.198 764 1HG GLU 100 1HG GLU 100 2.944 -6.511 -6.698 765 2HG GLU 100 2HG GLU 100 1.334 -6.616 -5.987 766 H ILE 101 H ILE 101 1.608 -2.913 -3.126 767 HA ILE 101 HA ILE 101 0.276 -5.229 -1.911 768 HB ILE 101 HB ILE 101 0.403 -4.034 0.210 769 1HG1 ILE 101 1HG1 ILE 101 1.962 -1.943 -1.322 770 2HG1 ILE 101 2HG1 ILE 101 0.317 -1.737 -0.728 771 1HG2 ILE 101 1HG2 ILE 101 2.972 -4.376 -1.311 772 2HG2 ILE 101 2HG2 ILE 101 2.922 -4.032 0.418 773 3HG2 ILE 101 3HG2 ILE 101 2.198 -5.512 -0.207 774 1HD1 ILE 101 1HD1 ILE 101 1.121 -1.989 1.565 775 2HD1 ILE 101 2HD1 ILE 101 2.768 -2.178 0.962 776 3HD1 ILE 101 3HD1 ILE 101 1.914 -0.652 0.731 777 H TYR 102 H TYR 102 -1.781 -5.223 -1.346 778 HA TYR 102 HA TYR 102 -3.383 -2.818 -1.907 779 1HB TYR 102 1HB TYR 102 -5.194 -4.881 -1.947 780 2HB TYR 102 2HB TYR 102 -4.447 -4.178 -3.376 781 HD1 TYR 102 HD1 TYR 102 -4.697 -7.102 -1.256 782 HD2 TYR 102 HD2 TYR 102 -2.501 -5.337 -4.446 783 HE1 TYR 102 HE1 TYR 102 -3.768 -9.300 -1.832 784 HE2 TYR 102 HE2 TYR 102 -1.570 -7.531 -5.027 785 HH TYR 102 HH TYR 102 -2.795 -10.427 -3.823 786 H VAL 103 H VAL 103 -3.673 -1.898 0.029 787 HA VAL 103 HA VAL 103 -4.113 -3.602 2.382 788 HB VAL 103 HB VAL 103 -3.595 -0.632 2.378 789 1HG1 VAL 103 1HG1 VAL 103 -4.496 -1.547 4.442 790 2HG1 VAL 103 2HG1 VAL 103 -3.217 -2.761 4.477 791 3HG1 VAL 103 3HG1 VAL 103 -2.816 -1.054 4.657 792 1HG2 VAL 103 1HG2 VAL 103 -1.578 -2.875 2.496 793 2HG2 VAL 103 2HG2 VAL 103 -1.765 -1.704 1.190 794 3HG2 VAL 103 3HG2 VAL 103 -1.231 -1.170 2.784 795 HA PRO 104 HA PRO 104 -8.478 -2.262 1.904 796 1HB PRO 104 1HB PRO 104 -9.357 -3.963 3.892 797 2HB PRO 104 2HB PRO 104 -9.248 -4.400 2.184 798 1HG PRO 104 1HG PRO 104 -7.368 -4.991 4.428 799 2HG PRO 104 2HG PRO 104 -7.849 -6.018 3.064 800 1HD PRO 104 1HD PRO 104 -5.479 -4.747 3.131 801 2HD PRO 104 2HD PRO 104 -6.367 -5.002 1.613 802 H SER 105 H SER 105 -9.790 -0.966 3.289 803 HA SER 105 HA SER 105 -8.528 0.744 5.027 804 1HB SER 105 1HB SER 105 -11.039 0.618 4.045 805 2HB SER 105 2HB SER 105 -11.344 0.145 5.726 806 HG SER 105 HG SER 105 -9.707 2.195 5.816 807 H GLY 106 H GLY 106 -10.215 -2.265 5.858 808 1HA GLY 106 1HA GLY 106 -10.170 -3.556 7.756 809 2HA GLY 106 2HA GLY 106 -10.154 -2.039 8.638 810 H LEU 107 H LEU 107 -7.511 -2.269 6.573 811 HA LEU 107 HA LEU 107 -5.814 -3.500 8.625 812 1HB LEU 107 1HB LEU 107 -5.945 -3.917 5.906 813 2HB LEU 107 2HB LEU 107 -4.579 -2.834 6.062 814 HG LEU 107 HG LEU 107 -3.864 -5.149 6.046 815 1HD1 LEU 107 1HD1 LEU 107 -2.626 -3.440 7.350 816 2HD1 LEU 107 2HD1 LEU 107 -3.504 -3.962 8.788 817 3HD1 LEU 107 3HD1 LEU 107 -2.426 -5.083 7.957 818 1HD2 LEU 107 1HD2 LEU 107 -5.587 -5.406 8.505 819 2HD2 LEU 107 2HD2 LEU 107 -5.816 -6.223 6.960 820 3HD2 LEU 107 3HD2 LEU 107 -4.422 -6.612 7.964 821 H ALA 108 H ALA 108 -6.622 -0.487 7.260 822 HA ALA 108 HA ALA 108 -4.139 0.724 8.268 823 1HB ALA 108 1HB ALA 108 -4.459 1.202 5.945 824 2HB ALA 108 2HB ALA 108 -4.756 2.683 6.860 825 3HB ALA 108 3HB ALA 108 -6.114 1.743 6.233 826 H TYR 109 H TYR 109 -6.803 2.819 7.686 827 HA TYR 109 HA TYR 109 -6.922 3.428 10.525 828 1HB TYR 109 1HB TYR 109 -7.705 4.832 8.019 829 2HB TYR 109 2HB TYR 109 -8.558 5.253 9.502 830 HD1 TYR 109 HD1 TYR 109 -5.407 5.488 7.677 831 HD2 TYR 109 HD2 TYR 109 -7.328 6.205 11.406 832 HE1 TYR 109 HE1 TYR 109 -3.556 6.964 8.342 833 HE2 TYR 109 HE2 TYR 109 -5.481 7.684 12.080 834 HH TYR 109 HH TYR 109 -3.163 8.838 9.905 835 H GLY 110 H GLY 110 -8.685 1.682 8.192 836 1HA GLY 110 1HA GLY 110 -10.800 1.235 10.181 837 2HA GLY 110 2HA GLY 110 -10.339 0.121 8.908 838 HA PRO 111 HA PRO 111 -13.450 1.412 6.096 839 1HB PRO 111 1HB PRO 111 -15.602 0.027 7.141 840 2HB PRO 111 2HB PRO 111 -14.379 -0.660 6.067 841 1HG PRO 111 1HG PRO 111 -14.574 -0.790 9.049 842 2HG PRO 111 2HG PRO 111 -14.124 -2.063 7.898 843 1HD PRO 111 1HD PRO 111 -12.259 -0.780 9.302 844 2HD PRO 111 2HD PRO 111 -11.982 -1.209 7.601 845 H ARG 112 H ARG 112 -13.538 2.258 9.371 846 HA ARG 112 HA ARG 112 -16.142 3.450 9.416 847 1HB ARG 112 1HB ARG 112 -13.753 3.860 11.226 848 2HB ARG 112 2HB ARG 112 -15.372 4.474 11.539 849 1HG ARG 112 1HG ARG 112 -16.221 2.180 11.614 850 2HG ARG 112 2HG ARG 112 -14.589 1.575 11.323 851 1HD ARG 112 1HD ARG 112 -13.829 2.609 13.398 852 2HD ARG 112 2HD ARG 112 -15.447 3.245 13.684 853 HE ARG 112 HE ARG 112 -15.633 0.472 13.379 854 1HH1 ARG 112 1HH1 ARG 112 -14.312 2.808 15.603 855 2HH1 ARG 112 2HH1 ARG 112 -14.471 1.774 16.983 856 1HH2 ARG 112 1HH2 ARG 112 -15.847 -0.893 15.190 857 2HH2 ARG 112 2HH2 ARG 112 -15.343 -0.330 16.748 858 H SER 113 H SER 113 -16.317 5.846 10.020 859 HA SER 113 HA SER 113 -15.512 7.379 7.806 860 1HB SER 113 1HB SER 113 -16.467 9.297 9.047 861 2HB SER 113 2HB SER 113 -17.538 7.896 9.052 862 HG SER 113 HG SER 113 -16.403 7.432 11.158 863 H VAL 114 H VAL 114 -13.430 6.240 9.866 864 HA VAL 114 HA VAL 114 -11.926 8.723 10.288 865 HB VAL 114 HB VAL 114 -10.467 7.361 11.757 866 1HG1 VAL 114 1HG1 VAL 114 -13.414 7.296 12.396 867 2HG1 VAL 114 2HG1 VAL 114 -12.122 7.046 13.571 868 3HG1 VAL 114 3HG1 VAL 114 -12.281 8.600 12.752 869 1HG2 VAL 114 1HG2 VAL 114 -10.841 5.198 10.647 870 2HG2 VAL 114 2HG2 VAL 114 -11.121 5.110 12.391 871 3HG2 VAL 114 3HG2 VAL 114 -12.492 5.176 11.276 872 H GLY 115 H GLY 115 -12.278 7.062 7.751 873 1HA GLY 115 1HA GLY 115 -10.998 6.436 5.951 874 2HA GLY 115 2HA GLY 115 -9.846 5.796 7.118 875 H GLY 116 H GLY 116 -7.956 6.838 7.432 876 1HA GLY 116 1HA GLY 116 -6.296 8.411 7.215 877 2HA GLY 116 2HA GLY 116 -7.563 9.614 7.039 878 HA PRO 117 HA PRO 117 -5.291 9.487 2.998 879 1HB PRO 117 1HB PRO 117 -3.667 7.340 2.465 880 2HB PRO 117 2HB PRO 117 -3.141 8.778 3.344 881 1HG PRO 117 1HG PRO 117 -4.028 6.126 4.407 882 2HG PRO 117 2HG PRO 117 -2.679 7.149 4.935 883 1HD PRO 117 1HD PRO 117 -5.003 7.064 6.283 884 2HD PRO 117 2HD PRO 117 -4.060 8.573 6.136 885 H ILE 118 H ILE 118 -6.293 6.234 3.924 886 HA ILE 118 HA ILE 118 -7.262 5.661 1.239 887 HB ILE 118 HB ILE 118 -7.280 3.967 3.745 888 1HG1 ILE 118 1HG1 ILE 118 -5.612 3.702 1.241 889 2HG1 ILE 118 2HG1 ILE 118 -5.047 4.465 2.723 890 1HG2 ILE 118 1HG2 ILE 118 -9.140 3.384 2.286 891 2HG2 ILE 118 2HG2 ILE 118 -8.031 3.232 0.921 892 3HG2 ILE 118 3HG2 ILE 118 -7.914 2.114 2.282 893 1HD1 ILE 118 1HD1 ILE 118 -5.337 2.355 3.915 894 2HD1 ILE 118 2HD1 ILE 118 -5.901 1.594 2.427 895 3HD1 ILE 118 3HD1 ILE 118 -4.244 2.185 2.541 896 H GLY 119 H GLY 119 -9.275 6.049 0.615 897 1HA GLY 119 1HA GLY 119 -11.545 6.407 0.669 898 2HA GLY 119 2HA GLY 119 -11.162 7.448 2.030 899 HA PRO 120 HA PRO 120 -13.182 4.838 4.934 900 1HB PRO 120 1HB PRO 120 -15.825 5.497 4.540 901 2HB PRO 120 2HB PRO 120 -14.686 6.473 5.470 902 1HG PRO 120 1HG PRO 120 -15.604 6.805 2.645 903 2HG PRO 120 2HG PRO 120 -15.321 8.040 3.886 904 1HD PRO 120 1HD PRO 120 -13.545 7.569 1.918 905 2HD PRO 120 2HD PRO 120 -13.031 8.030 3.554 906 H ASN 121 H ASN 121 -13.684 2.733 4.878 907 HA ASN 121 HA ASN 121 -14.177 0.660 4.040 908 1HB ASN 121 1HB ASN 121 -16.500 1.988 2.642 909 2HB ASN 121 2HB ASN 121 -16.407 0.353 3.290 910 1HD2 ASN 121 1HD2 ASN 121 -16.815 3.709 4.022 911 2HD2 ASN 121 2HD2 ASN 121 -17.379 3.509 5.646 912 H GLU 122 H GLU 122 -12.397 2.275 2.452 913 HA GLU 122 HA GLU 122 -13.068 1.312 -0.247 914 1HB GLU 122 1HB GLU 122 -11.368 3.673 0.564 915 2HB GLU 122 2HB GLU 122 -11.564 3.104 -1.087 916 1HG GLU 122 1HG GLU 122 -14.140 3.490 0.071 917 2HG GLU 122 2HG GLU 122 -13.162 4.935 0.334 918 H THR 123 H THR 123 -11.795 -0.208 -1.099 919 HA THR 123 HA THR 123 -9.308 -0.870 0.274 920 HB THR 123 HB THR 123 -10.702 -2.282 -2.021 921 HG1 THR 123 HG1 THR 123 -11.626 -2.284 0.230 922 1HG2 THR 123 1HG2 THR 123 -8.267 -2.647 -2.027 923 2HG2 THR 123 2HG2 THR 123 -8.345 -3.157 -0.341 924 3HG2 THR 123 3HG2 THR 123 -9.142 -4.114 -1.590 925 H LEU 124 H LEU 124 -7.352 -0.304 -0.497 926 HA LEU 124 HA LEU 124 -7.299 1.011 -3.136 927 1HB LEU 124 1HB LEU 124 -6.476 1.868 -0.563 928 2HB LEU 124 2HB LEU 124 -5.037 1.695 -1.549 929 HG LEU 124 HG LEU 124 -7.210 3.094 -2.914 930 1HD1 LEU 124 1HD1 LEU 124 -7.636 3.865 -0.631 931 2HD1 LEU 124 2HD1 LEU 124 -5.946 4.344 -0.480 932 3HD1 LEU 124 3HD1 LEU 124 -6.992 5.156 -1.643 933 1HD2 LEU 124 1HD2 LEU 124 -4.844 2.873 -3.672 934 2HD2 LEU 124 2HD2 LEU 124 -5.421 4.536 -3.579 935 3HD2 LEU 124 3HD2 LEU 124 -4.370 3.897 -2.318 936 H ILE 125 H ILE 125 -5.427 0.848 -4.404 937 HA ILE 125 HA ILE 125 -3.788 -1.554 -3.934 938 HB ILE 125 HB ILE 125 -4.412 -0.222 -6.578 939 1HG1 ILE 125 1HG1 ILE 125 -5.564 -2.599 -6.842 940 2HG1 ILE 125 2HG1 ILE 125 -5.693 -2.463 -5.090 941 1HG2 ILE 125 1HG2 ILE 125 -2.251 -1.334 -6.555 942 2HG2 ILE 125 2HG2 ILE 125 -3.000 -2.811 -5.946 943 3HG2 ILE 125 3HG2 ILE 125 -3.394 -2.222 -7.564 944 1HD1 ILE 125 1HD1 ILE 125 -6.894 -0.346 -5.354 945 2HD1 ILE 125 2HD1 ILE 125 -6.785 -0.513 -7.106 946 3HD1 ILE 125 3HD1 ILE 125 -7.713 -1.681 -6.165 947 H PHE 126 H PHE 126 -1.577 -1.345 -4.024 948 HA PHE 126 HA PHE 126 -0.524 1.325 -4.666 949 1HB PHE 126 1HB PHE 126 0.305 -0.368 -2.301 950 2HB PHE 126 2HB PHE 126 0.998 1.186 -2.744 951 HD1 PHE 126 HD1 PHE 126 -1.377 -0.446 -0.744 952 HD2 PHE 126 HD2 PHE 126 -0.704 3.172 -2.887 953 HE1 PHE 126 HE1 PHE 126 -3.050 0.689 0.658 954 HE2 PHE 126 HE2 PHE 126 -2.374 4.312 -1.486 955 HZ PHE 126 HZ PHE 126 -3.551 3.072 0.289 956 H LYS 127 H LYS 127 1.220 1.351 -5.924 957 HA LYS 127 HA LYS 127 2.609 -1.195 -6.447 958 1HB LYS 127 1HB LYS 127 1.557 -0.276 -8.442 959 2HB LYS 127 2HB LYS 127 2.319 1.284 -8.166 960 1HG LYS 127 1HG LYS 127 3.468 0.119 -9.929 961 2HG LYS 127 2HG LYS 127 4.524 0.241 -8.520 962 1HD LYS 127 1HD LYS 127 3.943 -2.064 -7.896 963 2HD LYS 127 2HD LYS 127 2.909 -2.181 -9.333 964 1HE LYS 127 1HE LYS 127 5.888 -1.687 -9.331 965 2HE LYS 127 2HE LYS 127 5.100 -3.220 -9.697 966 1HZ LYS 127 1HZ LYS 127 4.722 -0.707 -11.232 967 2HZ LYS 127 2HZ LYS 127 5.727 -1.986 -11.698 968 3HZ LYS 127 3HZ LYS 127 4.054 -2.216 -11.605 969 H ILE 128 H ILE 128 4.324 -1.246 -5.104 970 HA ILE 128 HA ILE 128 5.829 1.236 -4.674 971 HB ILE 128 HB ILE 128 6.118 -1.321 -3.111 972 1HG1 ILE 128 1HG1 ILE 128 4.375 1.076 -2.463 973 2HG1 ILE 128 2HG1 ILE 128 3.780 -0.499 -2.994 974 1HG2 ILE 128 1HG2 ILE 128 7.971 0.260 -2.949 975 2HG2 ILE 128 2HG2 ILE 128 6.850 1.539 -2.482 976 3HG2 ILE 128 3HG2 ILE 128 7.097 0.151 -1.420 977 1HD1 ILE 128 1HD1 ILE 128 4.720 -1.517 -0.974 978 2HD1 ILE 128 2HD1 ILE 128 5.272 0.071 -0.442 979 3HD1 ILE 128 3HD1 ILE 128 3.546 -0.255 -0.602 980 H HIS 129 H HIS 129 7.670 1.529 -5.647 981 HA HIS 129 HA HIS 129 9.274 -0.822 -6.394 982 1HB HIS 129 1HB HIS 129 8.249 1.015 -8.151 983 2HB HIS 129 2HB HIS 129 9.842 1.692 -7.822 984 HD1 HIS 129 HD1 HIS 129 8.600 0.043 -10.435 985 HD2 HIS 129 HD2 HIS 129 11.542 -1.108 -7.742 986 HE1 HIS 129 HE1 HIS 129 9.929 -1.735 -11.614 987 HE2 HIS 129 HE2 HIS 129 11.534 -2.582 -9.865 988 H LEU 130 H LEU 130 10.633 -0.954 -4.712 989 HA LEU 130 HA LEU 130 11.705 1.381 -3.428 990 1HB LEU 130 1HB LEU 130 11.115 -0.700 -2.213 991 2HB LEU 130 2HB LEU 130 12.413 -1.526 -3.050 992 HG LEU 130 HG LEU 130 14.079 -0.225 -1.911 993 1HD1 LEU 130 1HD1 LEU 130 11.783 1.331 -0.732 994 2HD1 LEU 130 2HD1 LEU 130 13.472 1.480 -0.247 995 3HD1 LEU 130 3HD1 LEU 130 12.980 1.931 -1.879 996 1HD2 LEU 130 1HD2 LEU 130 13.106 -2.156 -0.724 997 2HD2 LEU 130 2HD2 LEU 130 13.699 -0.907 0.373 998 3HD2 LEU 130 3HD2 LEU 130 11.968 -1.065 0.069 999 H ILE 131 H ILE 131 13.408 2.480 -4.082 1000 HA ILE 131 HA ILE 131 15.229 1.306 -6.028 1001 HB ILE 131 HB ILE 131 15.160 4.105 -4.891 1002 1HG1 ILE 131 1HG1 ILE 131 13.128 3.610 -6.158 1003 2HG1 ILE 131 2HG1 ILE 131 14.163 4.742 -7.062 1004 1HG2 ILE 131 1HG2 ILE 131 16.692 2.958 -7.219 1005 2HG2 ILE 131 2HG2 ILE 131 16.599 4.672 -6.814 1006 3HG2 ILE 131 3HG2 ILE 131 17.364 3.542 -5.697 1007 1HD1 ILE 131 1HD1 ILE 131 14.939 2.892 -8.460 1008 2HD1 ILE 131 2HD1 ILE 131 13.913 1.775 -7.560 1009 3HD1 ILE 131 3HD1 ILE 131 13.185 3.061 -8.523 1010 H SER 132 H SER 132 15.532 3.067 -2.938 1011 HA SER 132 HA SER 132 17.525 1.239 -1.990 1012 1HB SER 132 1HB SER 132 18.487 4.074 -2.297 1013 2HB SER 132 2HB SER 132 19.423 2.618 -1.941 1014 HG SER 132 HG SER 132 19.409 2.076 -4.015 1015 H VAL 133 H VAL 133 18.360 1.909 0.181 1016 HA VAL 133 HA VAL 133 16.245 3.358 1.640 1017 HB VAL 133 HB VAL 133 16.359 1.000 2.227 1018 1HG1 VAL 133 1HG1 VAL 133 18.694 0.597 1.621 1019 2HG1 VAL 133 2HG1 VAL 133 19.220 1.538 3.015 1020 3HG1 VAL 133 3HG1 VAL 133 18.347 0.031 3.251 1021 1HG2 VAL 133 1HG2 VAL 133 15.886 2.767 3.957 1022 2HG2 VAL 133 2HG2 VAL 133 16.445 1.217 4.587 1023 3HG2 VAL 133 3HG2 VAL 133 17.558 2.581 4.488 1024 H LYS 134 H LYS 134 16.792 5.237 2.480 1025 HA LYS 134 HA LYS 134 18.061 7.044 3.082 1026 1HB LYS 134 1HB LYS 134 19.668 5.094 4.716 1027 2HB LYS 134 2HB LYS 134 19.196 6.738 5.118 1028 1HG LYS 134 1HG LYS 134 16.929 6.090 5.474 1029 2HG LYS 134 2HG LYS 134 17.263 4.449 4.875 1030 1HD LYS 134 1HD LYS 134 17.204 4.376 7.271 1031 2HD LYS 134 2HD LYS 134 18.880 4.176 6.757 1032 1HE LYS 134 1HE LYS 134 19.275 6.569 7.199 1033 2HE LYS 134 2HE LYS 134 17.612 6.723 7.764 1034 1HZ LYS 134 1HZ LYS 134 18.115 5.105 9.507 1035 2HZ LYS 134 2HZ LYS 134 19.718 5.017 8.979 1036 3HZ LYS 134 3HZ LYS 134 19.116 6.464 9.617 1037 H LYS 135 H LYS 135 18.920 6.845 0.773 1038 HA LYS 135 HA LYS 135 20.625 7.114 -0.688 1039 1HB LYS 135 1HB LYS 135 22.078 7.682 1.885 1040 2HB LYS 135 2HB LYS 135 22.854 7.816 0.312 1041 1HG LYS 135 1HG LYS 135 21.089 9.451 -0.338 1042 2HG LYS 135 2HG LYS 135 20.505 9.399 1.327 1043 1HD LYS 135 1HD LYS 135 22.627 10.209 2.140 1044 2HD LYS 135 2HD LYS 135 23.312 10.141 0.515 1045 1HE LYS 135 1HE LYS 135 21.747 11.851 -0.232 1046 2HE LYS 135 2HE LYS 135 21.008 11.893 1.369 1047 1HZ LYS 135 1HZ LYS 135 23.832 12.594 0.770 1048 2HZ LYS 135 2HZ LYS 135 22.587 13.707 1.038 1049 3HZ LYS 135 3HZ LYS 135 23.086 12.681 2.286 1050 H SER 136 H SER 136 20.015 4.468 0.320 1051 HA SER 136 HA SER 136 20.779 2.333 0.223 1052 1HB SER 136 1HB SER 136 21.317 2.983 -2.081 1053 2HB SER 136 2HB SER 136 22.890 3.580 -1.551 1054 HG SER 136 HG SER 136 23.567 1.547 -1.208 1055 H SER 137 H SER 137 21.349 2.945 2.575 1056 HA SER 137 HA SER 137 24.112 3.237 3.230 1057 1HB SER 137 1HB SER 137 21.763 2.419 4.959 1058 2HB SER 137 2HB SER 137 23.367 2.842 5.560 1059 HG SER 137 HG SER 137 21.458 4.494 5.259 No H/Q in entry = 1059 Start of MODEL 4 1 H1 PHE 1 H1 PHE 1 -26.114 8.915 2.290 2 H2 PHE 1 H2 PHE 1 -25.384 9.395 3.739 3 H3 PHE 1 H3 PHE 1 -25.760 10.547 2.559 4 HA PHE 1 HA PHE 1 -24.176 9.566 1.041 5 1HB PHE 1 1HB PHE 1 -23.073 10.258 3.773 6 2HB PHE 1 2HB PHE 1 -22.103 10.159 2.308 7 HD1 PHE 1 HD1 PHE 1 -22.280 11.851 0.581 8 HD2 PHE 1 HD2 PHE 1 -24.597 12.086 4.143 9 HE1 PHE 1 HE1 PHE 1 -22.802 14.204 0.083 10 HE2 PHE 1 HE2 PHE 1 -25.124 14.437 3.650 11 HZ PHE 1 HZ PHE 1 -24.205 15.503 1.608 12 H ASN 2 H ASN 2 -25.068 7.598 3.613 13 HA ASN 2 HA ASN 2 -22.851 5.821 3.670 14 1HB ASN 2 1HB ASN 2 -24.433 4.260 4.811 15 2HB ASN 2 2HB ASN 2 -24.379 5.868 5.544 16 1HD2 ASN 2 1HD2 ASN 2 -26.142 7.235 5.332 17 2HD2 ASN 2 2HD2 ASN 2 -27.698 6.663 4.844 18 H LYS 3 H LYS 3 -25.518 6.200 1.507 19 HA LYS 3 HA LYS 3 -25.618 3.585 0.476 20 1HB LYS 3 1HB LYS 3 -26.690 4.542 -1.484 21 2HB LYS 3 2HB LYS 3 -27.325 5.300 -0.033 22 1HG LYS 3 1HG LYS 3 -25.115 6.571 -1.608 23 2HG LYS 3 2HG LYS 3 -26.809 6.777 -2.057 24 1HD LYS 3 1HD LYS 3 -27.257 7.614 0.240 25 2HD LYS 3 2HD LYS 3 -25.524 7.528 0.566 26 1HE LYS 3 1HE LYS 3 -26.838 9.191 -1.581 27 2HE LYS 3 2HE LYS 3 -26.218 9.796 -0.046 28 1HZ LYS 3 1HZ LYS 3 -24.589 8.489 -2.158 29 2HZ LYS 3 2HZ LYS 3 -24.653 10.152 -1.860 30 3HZ LYS 3 3HZ LYS 3 -24.004 9.110 -0.697 31 H LYS 4 H LYS 4 -23.589 6.357 -0.229 32 HA LYS 4 HA LYS 4 -22.182 5.046 -2.379 33 1HB LYS 4 1HB LYS 4 -22.479 7.493 -2.365 34 2HB LYS 4 2HB LYS 4 -21.550 7.599 -0.877 35 1HG LYS 4 1HG LYS 4 -19.570 6.792 -2.026 36 2HG LYS 4 2HG LYS 4 -20.495 6.605 -3.518 37 1HD LYS 4 1HD LYS 4 -20.894 8.993 -3.609 38 2HD LYS 4 2HD LYS 4 -20.082 9.215 -2.058 39 1HE LYS 4 1HE LYS 4 -17.988 8.425 -3.030 40 2HE LYS 4 2HE LYS 4 -18.793 8.162 -4.576 41 1HZ LYS 4 1HZ LYS 4 -18.526 10.795 -3.226 42 2HZ LYS 4 2HZ LYS 4 -17.558 10.259 -4.505 43 3HZ LYS 4 3HZ LYS 4 -19.212 10.516 -4.748 44 H ALA 5 H ALA 5 -21.745 5.659 1.041 45 HA ALA 5 HA ALA 5 -19.047 4.922 1.269 46 1HB ALA 5 1HB ALA 5 -19.977 6.064 3.096 47 2HB ALA 5 2HB ALA 5 -19.690 4.424 3.682 48 3HB ALA 5 3HB ALA 5 -21.319 4.928 3.231 49 H ASP 6 H ASP 6 -22.032 3.038 1.460 50 HA ASP 6 HA ASP 6 -20.668 0.586 2.025 51 1HB ASP 6 1HB ASP 6 -23.027 0.976 2.700 52 2HB ASP 6 2HB ASP 6 -23.487 1.007 1.000 53 H GLU 7 H GLU 7 -21.723 2.267 -0.850 54 HA GLU 7 HA GLU 7 -21.581 0.193 -2.700 55 1HB GLU 7 1HB GLU 7 -22.390 2.481 -3.214 56 2HB GLU 7 2HB GLU 7 -20.736 3.070 -3.121 57 1HG GLU 7 1HG GLU 7 -21.372 2.780 -5.421 58 2HG GLU 7 2HG GLU 7 -20.127 1.606 -4.995 59 H ASN 8 H ASN 8 -19.020 2.230 -1.342 60 HA ASN 8 HA ASN 8 -17.005 0.946 -2.918 61 1HB ASN 8 1HB ASN 8 -15.381 2.281 -1.669 62 2HB ASN 8 2HB ASN 8 -16.722 3.291 -2.260 63 1HD2 ASN 8 1HD2 ASN 8 -16.850 4.862 -0.817 64 2HD2 ASN 8 2HD2 ASN 8 -17.033 4.652 0.887 65 H LYS 9 H LYS 9 -18.399 0.533 0.233 66 HA LYS 9 HA LYS 9 -16.464 -1.102 1.415 67 1HB LYS 9 1HB LYS 9 -18.426 -0.132 2.589 68 2HB LYS 9 2HB LYS 9 -19.466 -1.266 1.743 69 1HG LYS 9 1HG LYS 9 -18.413 -3.131 2.838 70 2HG LYS 9 2HG LYS 9 -17.233 -2.061 3.598 71 1HD LYS 9 1HD LYS 9 -19.024 -0.951 4.832 72 2HD LYS 9 2HD LYS 9 -20.217 -1.995 4.055 73 1HE LYS 9 1HE LYS 9 -19.682 -2.782 6.304 74 2HE LYS 9 2HE LYS 9 -19.183 -3.952 5.081 75 1HZ LYS 9 1HZ LYS 9 -17.395 -2.009 6.440 76 2HZ LYS 9 2HZ LYS 9 -17.490 -3.664 6.779 77 3HZ LYS 9 3HZ LYS 9 -16.919 -3.137 5.275 78 H VAL 10 H VAL 10 -19.113 -1.889 -0.789 79 HA VAL 10 HA VAL 10 -18.703 -4.719 -0.591 80 HB VAL 10 HB VAL 10 -20.324 -4.888 -2.446 81 1HG1 VAL 10 1HG1 VAL 10 -21.048 -4.763 -0.093 82 2HG1 VAL 10 2HG1 VAL 10 -21.203 -3.012 -0.255 83 3HG1 VAL 10 3HG1 VAL 10 -22.237 -4.081 -1.204 84 1HG2 VAL 10 1HG2 VAL 10 -20.286 -1.871 -2.334 85 2HG2 VAL 10 2HG2 VAL 10 -19.775 -2.892 -3.695 86 3HG2 VAL 10 3HG2 VAL 10 -21.483 -2.845 -3.211 87 H LYS 11 H LYS 11 -18.075 -2.319 -3.175 88 HA LYS 11 HA LYS 11 -16.904 -4.191 -4.938 89 1HB LYS 11 1HB LYS 11 -16.093 -2.276 -6.192 90 2HB LYS 11 2HB LYS 11 -17.753 -2.007 -5.680 91 1HG LYS 11 1HG LYS 11 -16.986 -0.575 -3.879 92 2HG LYS 11 2HG LYS 11 -15.308 -0.872 -4.337 93 1HD LYS 11 1HD LYS 11 -15.979 1.252 -5.235 94 2HD LYS 11 2HD LYS 11 -15.807 0.110 -6.569 95 1HE LYS 11 1HE LYS 11 -18.240 -0.239 -6.557 96 2HE LYS 11 2HE LYS 11 -18.393 0.937 -5.253 97 1HZ LYS 11 1HZ LYS 11 -17.476 2.624 -6.731 98 2HZ LYS 11 2HZ LYS 11 -17.361 1.493 -7.982 99 3HZ LYS 11 3HZ LYS 11 -18.879 1.940 -7.386 100 H GLY 12 H GLY 12 -15.640 -2.463 -2.207 101 1HA GLY 12 1HA GLY 12 -13.506 -2.299 -1.331 102 2HA GLY 12 2HA GLY 12 -12.876 -2.771 -2.902 103 H GLU 13 H GLU 13 -14.945 -4.349 -0.463 104 HA GLU 13 HA GLU 13 -13.032 -6.262 0.307 105 1HB GLU 13 1HB GLU 13 -15.070 -5.660 1.612 106 2HB GLU 13 2HB GLU 13 -16.041 -6.520 0.425 107 1HG GLU 13 1HG GLU 13 -14.832 -8.591 0.973 108 2HG GLU 13 2HG GLU 13 -13.933 -7.715 2.210 109 H ALA 14 H ALA 14 -15.169 -6.056 -2.387 110 HA ALA 14 HA ALA 14 -15.112 -8.854 -3.057 111 1HB ALA 14 1HB ALA 14 -17.002 -7.404 -3.684 112 2HB ALA 14 2HB ALA 14 -16.275 -8.198 -5.082 113 3HB ALA 14 3HB ALA 14 -15.933 -6.498 -4.755 114 H PHE 15 H PHE 15 -13.474 -5.920 -4.181 115 HA PHE 15 HA PHE 15 -12.080 -7.026 -6.326 116 1HB PHE 15 1HB PHE 15 -11.878 -4.734 -6.314 117 2HB PHE 15 2HB PHE 15 -11.681 -4.658 -4.550 118 HD1 PHE 15 HD1 PHE 15 -9.634 -4.008 -3.789 119 HD2 PHE 15 HD2 PHE 15 -9.855 -6.048 -7.514 120 HE1 PHE 15 HE1 PHE 15 -7.198 -3.767 -4.056 121 HE2 PHE 15 HE2 PHE 15 -7.421 -5.822 -7.787 122 HZ PHE 15 HZ PHE 15 -6.085 -4.682 -6.053 123 H LEU 16 H LEU 16 -11.110 -6.717 -2.914 124 HA LEU 16 HA LEU 16 -8.607 -7.999 -3.284 125 1HB LEU 16 1HB LEU 16 -8.475 -8.094 -0.868 126 2HB LEU 16 2HB LEU 16 -9.043 -6.523 -1.395 127 HG LEU 16 HG LEU 16 -11.417 -7.634 -0.945 128 1HD1 LEU 16 1HD1 LEU 16 -9.572 -9.083 0.948 129 2HD1 LEU 16 2HD1 LEU 16 -11.332 -9.050 1.053 130 3HD1 LEU 16 3HD1 LEU 16 -10.546 -9.816 -0.326 131 1HD2 LEU 16 1HD2 LEU 16 -9.577 -6.481 1.144 132 2HD2 LEU 16 2HD2 LEU 16 -10.656 -5.588 0.072 133 3HD2 LEU 16 3HD2 LEU 16 -11.325 -6.642 1.319 134 H THR 17 H THR 17 -11.825 -9.170 -2.468 135 HA THR 17 HA THR 17 -11.184 -11.775 -1.681 136 HB THR 17 HB THR 17 -13.617 -10.644 -3.070 137 HG1 THR 17 HG1 THR 17 -12.768 -10.909 -0.503 138 1HG2 THR 17 1HG2 THR 17 -13.339 -13.040 -3.695 139 2HG2 THR 17 2HG2 THR 17 -13.338 -13.448 -1.968 140 3HG2 THR 17 3HG2 THR 17 -14.779 -12.727 -2.711 141 H GLU 18 H GLU 18 -11.912 -10.479 -4.903 142 HA GLU 18 HA GLU 18 -11.389 -12.934 -6.254 143 1HB GLU 18 1HB GLU 18 -12.844 -11.117 -7.160 144 2HB GLU 18 2HB GLU 18 -11.407 -10.130 -7.389 145 1HG GLU 18 1HG GLU 18 -12.044 -11.136 -9.474 146 2HG GLU 18 2HG GLU 18 -10.515 -11.824 -8.929 147 H ASN 19 H ASN 19 -9.511 -10.158 -5.307 148 HA ASN 19 HA ASN 19 -7.261 -10.469 -6.924 149 1HB ASN 19 1HB ASN 19 -7.307 -8.467 -5.722 150 2HB ASN 19 2HB ASN 19 -7.689 -9.274 -4.199 151 1HD2 ASN 19 1HD2 ASN 19 -6.025 -10.574 -3.226 152 2HD2 ASN 19 2HD2 ASN 19 -4.364 -10.184 -3.471 153 H LYS 20 H LYS 20 -8.299 -12.251 -4.132 154 HA LYS 20 HA LYS 20 -6.020 -13.336 -3.108 155 1HB LYS 20 1HB LYS 20 -8.675 -14.660 -3.643 156 2HB LYS 20 2HB LYS 20 -7.402 -15.402 -2.682 157 1HG LYS 20 1HG LYS 20 -7.565 -13.765 -1.002 158 2HG LYS 20 2HG LYS 20 -8.513 -12.690 -2.031 159 1HD LYS 20 1HD LYS 20 -9.911 -13.782 -0.342 160 2HD LYS 20 2HD LYS 20 -10.379 -14.257 -1.974 161 1HE LYS 20 1HE LYS 20 -9.047 -16.318 -1.713 162 2HE LYS 20 2HE LYS 20 -8.695 -15.854 -0.049 163 1HZ LYS 20 1HZ LYS 20 -11.079 -15.914 0.415 164 2HZ LYS 20 2HZ LYS 20 -11.389 -16.405 -1.174 165 3HZ LYS 20 3HZ LYS 20 -10.521 -17.415 -0.132 166 H ASN 21 H ASN 21 -7.219 -13.768 -6.285 167 HA ASN 21 HA ASN 21 -6.046 -16.283 -6.863 168 1HB ASN 21 1HB ASN 21 -6.982 -14.048 -8.658 169 2HB ASN 21 2HB ASN 21 -6.433 -15.615 -9.247 170 1HD2 ASN 21 1HD2 ASN 21 -8.229 -15.094 -6.290 171 2HD2 ASN 21 2HD2 ASN 21 -9.657 -15.917 -6.795 172 H LYS 22 H LYS 22 -4.865 -12.972 -7.055 173 HA LYS 22 HA LYS 22 -2.749 -13.081 -8.742 174 1HB LYS 22 1HB LYS 22 -2.614 -11.844 -5.992 175 2HB LYS 22 2HB LYS 22 -1.625 -11.416 -7.378 176 1HG LYS 22 1HG LYS 22 -4.484 -10.783 -6.825 177 2HG LYS 22 2HG LYS 22 -3.179 -9.724 -7.346 178 1HD LYS 22 1HD LYS 22 -3.215 -11.008 -9.541 179 2HD LYS 22 2HD LYS 22 -4.735 -11.711 -8.981 180 1HE LYS 22 1HE LYS 22 -5.693 -9.471 -8.767 181 2HE LYS 22 2HE LYS 22 -4.175 -8.766 -9.323 182 1HZ LYS 22 1HZ LYS 22 -4.460 -9.918 -11.432 183 2HZ LYS 22 2HZ LYS 22 -5.922 -10.579 -10.898 184 3HZ LYS 22 3HZ LYS 22 -5.780 -8.909 -11.115 185 HA PRO 23 HA PRO 23 -0.339 -16.550 -7.218 186 1HB PRO 23 1HB PRO 23 1.848 -16.017 -8.824 187 2HB PRO 23 2HB PRO 23 0.439 -16.967 -9.316 188 1HG PRO 23 1HG PRO 23 1.064 -14.090 -9.838 189 2HG PRO 23 2HG PRO 23 0.361 -15.301 -10.929 190 1HD PRO 23 1HD PRO 23 -1.168 -13.459 -9.736 191 2HD PRO 23 2HD PRO 23 -1.747 -15.123 -9.963 192 H GLY 24 H GLY 24 0.963 -16.664 -5.501 193 1HA GLY 24 1HA GLY 24 3.087 -14.721 -5.118 194 2HA GLY 24 2HA GLY 24 2.800 -16.159 -4.151 195 H VAL 25 H VAL 25 -0.137 -14.698 -4.343 196 HA VAL 25 HA VAL 25 0.101 -12.500 -2.619 197 HB VAL 25 HB VAL 25 -1.937 -12.821 -3.877 198 1HG1 VAL 25 1HG1 VAL 25 -2.012 -15.267 -3.851 199 2HG1 VAL 25 2HG1 VAL 25 -2.455 -15.233 -2.142 200 3HG1 VAL 25 3HG1 VAL 25 -3.550 -14.556 -3.352 201 1HG2 VAL 25 1HG2 VAL 25 -2.415 -12.982 -0.904 202 2HG2 VAL 25 2HG2 VAL 25 -2.111 -11.520 -1.843 203 3HG2 VAL 25 3HG2 VAL 25 -3.595 -12.439 -2.099 204 H VAL 26 H VAL 26 0.860 -12.467 -0.643 205 HA VAL 26 HA VAL 26 0.240 -14.709 1.165 206 HB VAL 26 HB VAL 26 2.577 -14.858 0.447 207 1HG1 VAL 26 1HG1 VAL 26 2.605 -12.221 0.224 208 2HG1 VAL 26 2HG1 VAL 26 3.291 -12.344 1.848 209 3HG1 VAL 26 3HG1 VAL 26 4.082 -13.154 0.493 210 1HG2 VAL 26 1HG2 VAL 26 2.224 -13.972 3.309 211 2HG2 VAL 26 2HG2 VAL 26 2.058 -15.616 2.680 212 3HG2 VAL 26 3HG2 VAL 26 3.639 -14.824 2.682 213 H VAL 27 H VAL 27 -0.300 -14.188 3.240 214 HA VAL 27 HA VAL 27 -0.906 -11.392 3.749 215 HB VAL 27 HB VAL 27 -2.648 -13.009 4.232 216 1HG1 VAL 27 1HG1 VAL 27 -1.249 -14.946 4.702 217 2HG1 VAL 27 2HG1 VAL 27 -0.717 -14.205 6.212 218 3HG1 VAL 27 3HG1 VAL 27 -2.405 -14.671 6.006 219 1HG2 VAL 27 1HG2 VAL 27 -2.444 -10.972 5.631 220 2HG2 VAL 27 2HG2 VAL 27 -3.224 -12.317 6.464 221 3HG2 VAL 27 3HG2 VAL 27 -1.542 -11.918 6.814 222 H LEU 28 H LEU 28 -0.039 -10.163 5.357 223 HA LEU 28 HA LEU 28 2.434 -11.166 6.542 224 1HB LEU 28 1HB LEU 28 1.316 -8.377 6.270 225 2HB LEU 28 2HB LEU 28 2.821 -8.746 7.087 226 HG LEU 28 HG LEU 28 2.227 -9.157 4.158 227 1HD1 LEU 28 1HD1 LEU 28 2.593 -6.825 4.814 228 2HD1 LEU 28 2HD1 LEU 28 4.126 -7.280 5.558 229 3HD1 LEU 28 3HD1 LEU 28 3.910 -7.439 3.815 230 1HD2 LEU 28 1HD2 LEU 28 4.668 -9.829 5.793 231 2HD2 LEU 28 2HD2 LEU 28 3.657 -10.937 4.864 232 3HD2 LEU 28 3HD2 LEU 28 4.654 -9.744 4.031 233 HA PRO 29 HA PRO 29 1.145 -11.364 10.773 234 1HB PRO 29 1HB PRO 29 2.870 -9.012 11.406 235 2HB PRO 29 2HB PRO 29 2.799 -10.596 12.187 236 1HG PRO 29 1HG PRO 29 4.802 -9.982 10.545 237 2HG PRO 29 2HG PRO 29 4.092 -11.608 10.548 238 1HD PRO 29 1HD PRO 29 3.755 -9.391 8.578 239 2HD PRO 29 2HD PRO 29 3.796 -11.154 8.312 240 H SER 30 H SER 30 1.285 -8.170 9.303 241 HA SER 30 HA SER 30 -0.706 -7.095 11.110 242 1HB SER 30 1HB SER 30 0.870 -5.950 8.821 243 2HB SER 30 2HB SER 30 -0.482 -5.066 9.531 244 HG SER 30 HG SER 30 1.850 -5.985 10.866 245 H GLY 31 H GLY 31 -0.715 -8.872 8.229 246 1HA GLY 31 1HA GLY 31 -3.561 -8.243 7.919 247 2HA GLY 31 2HA GLY 31 -2.817 -9.764 7.463 248 H LEU 32 H LEU 32 -0.619 -7.829 6.213 249 HA LEU 32 HA LEU 32 -2.119 -6.727 3.988 250 1HB LEU 32 1HB LEU 32 0.846 -6.865 4.486 251 2HB LEU 32 2HB LEU 32 0.087 -6.017 3.152 252 HG LEU 32 HG LEU 32 -1.201 -4.933 5.303 253 1HD1 LEU 32 1HD1 LEU 32 0.395 -6.219 6.755 254 2HD1 LEU 32 2HD1 LEU 32 1.685 -5.205 6.103 255 3HD1 LEU 32 3HD1 LEU 32 0.364 -4.476 7.016 256 1HD2 LEU 32 1HD2 LEU 32 1.327 -4.010 3.946 257 2HD2 LEU 32 2HD2 LEU 32 -0.322 -3.717 3.402 258 3HD2 LEU 32 3HD2 LEU 32 0.253 -2.988 4.899 259 H GLN 33 H GLN 33 -2.345 -7.520 2.032 260 HA GLN 33 HA GLN 33 -0.928 -10.001 1.309 261 1HB GLN 33 1HB GLN 33 -3.631 -8.999 0.380 262 2HB GLN 33 2HB GLN 33 -2.846 -10.465 -0.189 263 1HG GLN 33 1HG GLN 33 -2.935 -11.396 2.077 264 2HG GLN 33 2HG GLN 33 -3.761 -9.914 2.633 265 1HE2 GLN 33 1HE2 GLN 33 -4.647 -12.718 2.629 266 2HE2 GLN 33 2HE2 GLN 33 -6.132 -12.739 1.748 267 H TYR 34 H TYR 34 0.110 -10.042 -0.716 268 HA TYR 34 HA TYR 34 -0.220 -7.772 -2.495 269 1HB TYR 34 1HB TYR 34 2.220 -7.199 -2.395 270 2HB TYR 34 2HB TYR 34 1.307 -6.803 -0.941 271 HD1 TYR 34 HD1 TYR 34 3.783 -9.119 -2.391 272 HD2 TYR 34 HD2 TYR 34 1.765 -7.881 1.142 273 HE1 TYR 34 HE1 TYR 34 5.355 -10.428 -1.040 274 HE2 TYR 34 HE2 TYR 34 3.332 -9.182 2.496 275 HH TYR 34 HH TYR 34 6.205 -10.539 1.207 276 H LYS 35 H LYS 35 1.488 -7.835 -4.279 277 HA LYS 35 HA LYS 35 1.976 -10.638 -5.083 278 1HB LYS 35 1HB LYS 35 0.218 -9.083 -6.324 279 2HB LYS 35 2HB LYS 35 1.661 -8.442 -7.096 280 1HG LYS 35 1HG LYS 35 2.234 -10.793 -7.763 281 2HG LYS 35 2HG LYS 35 0.631 -11.269 -7.178 282 1HD LYS 35 1HD LYS 35 -0.393 -9.678 -8.747 283 2HD LYS 35 2HD LYS 35 1.212 -9.252 -9.349 284 1HE LYS 35 1HE LYS 35 -0.021 -12.004 -9.450 285 2HE LYS 35 2HE LYS 35 0.067 -10.878 -10.804 286 1HZ LYS 35 1HZ LYS 35 2.491 -10.952 -10.633 287 2HZ LYS 35 2HZ LYS 35 2.379 -12.075 -9.372 288 3HZ LYS 35 3HZ LYS 35 1.844 -12.488 -10.923 289 H VAL 36 H VAL 36 4.066 -11.089 -5.130 290 HA VAL 36 HA VAL 36 6.084 -9.088 -4.913 291 HB VAL 36 HB VAL 36 6.452 -12.036 -5.423 292 1HG1 VAL 36 1HG1 VAL 36 8.450 -10.684 -5.835 293 2HG1 VAL 36 2HG1 VAL 36 8.307 -9.981 -4.224 294 3HG1 VAL 36 3HG1 VAL 36 8.645 -11.702 -4.409 295 1HG2 VAL 36 1HG2 VAL 36 6.188 -10.513 -2.835 296 2HG2 VAL 36 2HG2 VAL 36 5.091 -11.745 -3.458 297 3HG2 VAL 36 3HG2 VAL 36 6.725 -12.188 -2.961 298 H ILE 37 H ILE 37 7.197 -8.082 -6.403 299 HA ILE 37 HA ILE 37 7.102 -9.054 -9.174 300 HB ILE 37 HB ILE 37 7.825 -6.302 -8.154 301 1HG1 ILE 37 1HG1 ILE 37 5.329 -7.222 -9.595 302 2HG1 ILE 37 2HG1 ILE 37 5.428 -6.961 -7.857 303 1HG2 ILE 37 1HG2 ILE 37 7.417 -7.319 -10.964 304 2HG2 ILE 37 2HG2 ILE 37 7.686 -5.636 -10.512 305 3HG2 ILE 37 3HG2 ILE 37 8.952 -6.835 -10.243 306 1HD1 ILE 37 1HD1 ILE 37 5.876 -4.857 -9.959 307 2HD1 ILE 37 2HD1 ILE 37 4.397 -5.081 -9.025 308 3HD1 ILE 37 3HD1 ILE 37 5.890 -4.613 -8.212 309 H ASN 38 H ASN 38 9.442 -7.231 -7.142 310 HA ASN 38 HA ASN 38 11.520 -9.158 -7.779 311 1HB ASN 38 1HB ASN 38 11.685 -7.653 -9.681 312 2HB ASN 38 2HB ASN 38 11.723 -6.255 -8.611 313 1HD2 ASN 38 1HD2 ASN 38 13.599 -5.704 -7.592 314 2HD2 ASN 38 2HD2 ASN 38 15.118 -6.456 -7.921 315 H SER 39 H SER 39 11.235 -9.444 -5.457 316 HA SER 39 HA SER 39 12.379 -7.271 -3.841 317 1HB SER 39 1HB SER 39 11.388 -8.424 -1.896 318 2HB SER 39 2HB SER 39 10.177 -7.995 -3.104 319 HG SER 39 HG SER 39 10.496 -10.224 -3.892 320 H GLY 40 H GLY 40 14.068 -7.618 -2.421 321 1HA GLY 40 1HA GLY 40 15.318 -10.267 -2.388 322 2HA GLY 40 2HA GLY 40 15.658 -8.953 -1.275 323 H ASN 41 H ASN 41 17.284 -7.531 -1.718 324 HA ASN 41 HA ASN 41 19.307 -8.329 -3.489 325 1HB ASN 41 1HB ASN 41 19.218 -6.404 -5.085 326 2HB ASN 41 2HB ASN 41 17.903 -7.558 -5.279 327 1HD2 ASN 41 1HD2 ASN 41 15.820 -6.993 -4.493 328 2HD2 ASN 41 2HD2 ASN 41 15.368 -5.334 -4.321 329 H GLY 42 H GLY 42 17.999 -5.174 -2.408 330 1HA GLY 42 1HA GLY 42 19.257 -3.355 -1.618 331 2HA GLY 42 2HA GLY 42 20.671 -4.392 -1.549 332 H VAL 43 H VAL 43 21.053 -3.373 0.477 333 HA VAL 43 HA VAL 43 19.852 -4.812 2.692 334 HB VAL 43 HB VAL 43 21.692 -3.403 3.934 335 1HG1 VAL 43 1HG1 VAL 43 22.297 -5.737 2.128 336 2HG1 VAL 43 2HG1 VAL 43 23.334 -5.188 3.445 337 3HG1 VAL 43 3HG1 VAL 43 21.721 -5.809 3.793 338 1HG2 VAL 43 1HG2 VAL 43 22.228 -1.982 2.015 339 2HG2 VAL 43 2HG2 VAL 43 23.627 -2.913 2.547 340 3HG2 VAL 43 3HG2 VAL 43 22.735 -3.408 1.109 341 H LYS 44 H LYS 44 19.739 -3.365 4.798 342 HA LYS 44 HA LYS 44 19.203 -0.699 4.920 343 1HB LYS 44 1HB LYS 44 16.761 -0.493 4.661 344 2HB LYS 44 2HB LYS 44 17.552 -0.909 3.151 345 1HG LYS 44 1HG LYS 44 16.779 -3.130 3.239 346 2HG LYS 44 2HG LYS 44 16.296 -2.973 4.929 347 1HD LYS 44 1HD LYS 44 15.073 -1.294 2.758 348 2HD LYS 44 2HD LYS 44 14.451 -2.891 3.168 349 1HE LYS 44 1HE LYS 44 14.770 -0.630 5.133 350 2HE LYS 44 2HE LYS 44 13.266 -1.022 4.301 351 1HZ LYS 44 1HZ LYS 44 13.312 -3.210 5.329 352 2HZ LYS 44 2HZ LYS 44 14.753 -2.831 6.127 353 3HZ LYS 44 3HZ LYS 44 13.331 -1.995 6.507 354 HA PRO 45 HA PRO 45 18.222 -1.744 9.089 355 1HB PRO 45 1HB PRO 45 16.825 0.791 9.410 356 2HB PRO 45 2HB PRO 45 18.388 0.290 10.057 357 1HG PRO 45 1HG PRO 45 18.137 2.174 8.128 358 2HG PRO 45 2HG PRO 45 19.545 1.102 8.251 359 1HD PRO 45 1HD PRO 45 17.168 0.908 6.437 360 2HD PRO 45 2HD PRO 45 18.886 0.649 6.073 361 H GLY 46 H GLY 46 16.437 -1.655 10.721 362 1HA GLY 46 1HA GLY 46 14.390 -2.463 11.377 363 2HA GLY 46 2HA GLY 46 14.150 -3.004 9.718 364 H LYS 47 H LYS 47 11.961 -2.069 10.978 365 HA LYS 47 HA LYS 47 10.812 -0.289 9.298 366 1HB LYS 47 1HB LYS 47 9.180 0.214 11.085 367 2HB LYS 47 2HB LYS 47 9.525 -1.503 10.926 368 1HG LYS 47 1HG LYS 47 11.019 -1.388 12.850 369 2HG LYS 47 2HG LYS 47 10.686 0.338 13.007 370 1HD LYS 47 1HD LYS 47 8.320 -0.155 13.397 371 2HD LYS 47 2HD LYS 47 8.652 -1.881 13.233 372 1HE LYS 47 1HE LYS 47 9.806 -0.047 15.333 373 2HE LYS 47 2HE LYS 47 8.506 -1.211 15.582 374 1HZ LYS 47 1HZ LYS 47 10.042 -2.990 15.018 375 2HZ LYS 47 2HZ LYS 47 11.289 -1.872 14.780 376 3HZ LYS 47 3HZ LYS 47 10.627 -2.088 16.323 377 H SER 48 H SER 48 13.266 0.597 11.510 378 HA SER 48 HA SER 48 12.461 3.380 11.669 379 1HB SER 48 1HB SER 48 14.999 1.997 12.581 380 2HB SER 48 2HB SER 48 14.586 3.680 12.911 381 HG SER 48 HG SER 48 13.397 1.328 13.902 382 H ASP 49 H ASP 49 13.470 1.672 9.209 383 HA ASP 49 HA ASP 49 15.726 3.141 8.207 384 1HB ASP 49 1HB ASP 49 15.489 1.779 6.239 385 2HB ASP 49 2HB ASP 49 15.238 0.757 7.652 386 H THR 50 H THR 50 15.690 4.320 6.164 387 HA THR 50 HA THR 50 13.126 5.684 5.608 388 HB THR 50 HB THR 50 15.876 6.973 5.578 389 HG1 THR 50 HG1 THR 50 14.492 6.444 7.670 390 1HG2 THR 50 1HG2 THR 50 13.112 8.126 5.172 391 2HG2 THR 50 2HG2 THR 50 14.601 9.066 5.287 392 3HG2 THR 50 3HG2 THR 50 14.364 7.950 3.943 393 H VAL 51 H VAL 51 12.545 5.294 3.531 394 HA VAL 51 HA VAL 51 14.699 4.928 1.558 395 HB VAL 51 HB VAL 51 13.447 3.158 0.458 396 1HG1 VAL 51 1HG1 VAL 51 15.081 2.548 2.171 397 2HG1 VAL 51 2HG1 VAL 51 13.815 2.608 3.402 398 3HG1 VAL 51 3HG1 VAL 51 13.743 1.396 2.118 399 1HG2 VAL 51 1HG2 VAL 51 11.188 3.850 1.050 400 2HG2 VAL 51 2HG2 VAL 51 11.463 2.166 1.508 401 3HG2 VAL 51 3HG2 VAL 51 11.491 3.431 2.740 402 H THR 52 H THR 52 14.253 5.504 -0.565 403 HA THR 52 HA THR 52 11.917 7.271 -0.896 404 HB THR 52 HB THR 52 14.540 7.345 -2.411 405 HG1 THR 52 HG1 THR 52 15.122 8.278 -0.574 406 1HG2 THR 52 1HG2 THR 52 12.643 8.170 -3.715 407 2HG2 THR 52 2HG2 THR 52 12.201 9.258 -2.397 408 3HG2 THR 52 3HG2 THR 52 13.719 9.493 -3.264 409 H VAL 53 H VAL 53 10.397 6.509 -2.227 410 HA VAL 53 HA VAL 53 11.216 4.819 -4.473 411 HB VAL 53 HB VAL 53 9.599 3.155 -4.059 412 1HG1 VAL 53 1HG1 VAL 53 11.624 2.990 -2.676 413 2HG1 VAL 53 2HG1 VAL 53 10.782 3.856 -1.372 414 3HG1 VAL 53 3HG1 VAL 53 10.206 2.258 -1.893 415 1HG2 VAL 53 1HG2 VAL 53 8.506 4.941 -1.887 416 2HG2 VAL 53 2HG2 VAL 53 7.722 4.524 -3.412 417 3HG2 VAL 53 3HG2 VAL 53 7.980 3.284 -2.184 418 H GLU 54 H GLU 54 9.141 4.319 -5.828 419 HA GLU 54 HA GLU 54 7.548 6.782 -6.108 420 1HB GLU 54 1HB GLU 54 9.031 5.193 -8.182 421 2HB GLU 54 2HB GLU 54 7.592 6.094 -8.632 422 1HG GLU 54 1HG GLU 54 8.593 8.157 -7.991 423 2HG GLU 54 2HG GLU 54 9.975 7.326 -7.274 424 H TYR 55 H TYR 55 5.357 6.456 -6.300 425 HA TYR 55 HA TYR 55 4.440 3.797 -7.072 426 1HB TYR 55 1HB TYR 55 3.189 3.344 -5.155 427 2HB TYR 55 2HB TYR 55 4.702 3.966 -4.522 428 HD1 TYR 55 HD1 TYR 55 4.720 6.568 -4.048 429 HD2 TYR 55 HD2 TYR 55 1.198 4.190 -4.322 430 HE1 TYR 55 HE1 TYR 55 3.486 8.253 -2.751 431 HE2 TYR 55 HE2 TYR 55 -0.050 5.873 -3.028 432 HH TYR 55 HH TYR 55 0.409 7.671 -1.428 433 H THR 56 H THR 56 2.203 3.652 -7.476 434 HA THR 56 HA THR 56 0.901 6.219 -8.106 435 HB THR 56 HB THR 56 0.734 3.674 -9.748 436 HG1 THR 56 HG1 THR 56 1.737 5.359 -11.298 437 1HG2 THR 56 1HG2 THR 56 -1.329 4.996 -9.799 438 2HG2 THR 56 2HG2 THR 56 -0.404 6.427 -10.254 439 3HG2 THR 56 3HG2 THR 56 -0.499 5.052 -11.353 440 H GLY 57 H GLY 57 -0.778 6.409 -6.750 441 1HA GLY 57 1HA GLY 57 -2.067 5.366 -4.964 442 2HA GLY 57 2HA GLY 57 -2.152 3.920 -5.957 443 H ARG 58 H ARG 58 -4.295 3.697 -6.103 444 HA ARG 58 HA ARG 58 -5.937 5.972 -6.877 445 1HB ARG 58 1HB ARG 58 -6.908 4.794 -8.808 446 2HB ARG 58 2HB ARG 58 -5.183 5.088 -9.027 447 1HG ARG 58 1HG ARG 58 -5.284 2.933 -9.729 448 2HG ARG 58 2HG ARG 58 -5.011 2.651 -8.006 449 1HD ARG 58 1HD ARG 58 -7.399 2.342 -7.660 450 2HD ARG 58 2HD ARG 58 -7.709 2.698 -9.359 451 HE ARG 58 HE ARG 58 -5.937 0.461 -8.824 452 1HH1 ARG 58 1HH1 ARG 58 -9.167 1.552 -9.533 453 2HH1 ARG 58 2HH1 ARG 58 -9.696 0.015 -10.131 454 1HH2 ARG 58 1HH2 ARG 58 -6.623 -1.570 -9.610 455 2HH2 ARG 58 2HH2 ARG 58 -8.249 -1.761 -10.174 456 H LEU 59 H LEU 59 -8.102 5.721 -6.382 457 HA LEU 59 HA LEU 59 -8.683 3.847 -4.301 458 1HB LEU 59 1HB LEU 59 -10.854 5.354 -5.677 459 2HB LEU 59 2HB LEU 59 -10.622 5.046 -3.969 460 HG LEU 59 HG LEU 59 -8.576 6.798 -5.122 461 1HD1 LEU 59 1HD1 LEU 59 -11.454 7.690 -5.058 462 2HD1 LEU 59 2HD1 LEU 59 -10.061 8.753 -5.254 463 3HD1 LEU 59 3HD1 LEU 59 -10.429 7.547 -6.486 464 1HD2 LEU 59 1HD2 LEU 59 -10.451 7.027 -2.772 465 2HD2 LEU 59 2HD2 LEU 59 -8.798 6.412 -2.732 466 3HD2 LEU 59 3HD2 LEU 59 -9.099 8.106 -3.117 467 H ILE 60 H ILE 60 -10.621 2.426 -4.341 468 HA ILE 60 HA ILE 60 -10.510 0.573 -6.440 469 HB ILE 60 HB ILE 60 -11.373 0.030 -4.183 470 1HG1 ILE 60 1HG1 ILE 60 -13.257 -1.398 -4.898 471 2HG1 ILE 60 2HG1 ILE 60 -13.350 -0.504 -6.411 472 1HG2 ILE 60 1HG2 ILE 60 -13.790 1.616 -5.032 473 2HG2 ILE 60 2HG2 ILE 60 -13.672 0.623 -3.577 474 3HG2 ILE 60 3HG2 ILE 60 -12.645 2.049 -3.758 475 1HD1 ILE 60 1HD1 ILE 60 -10.940 -2.062 -5.508 476 2HD1 ILE 60 2HD1 ILE 60 -12.191 -2.683 -6.590 477 3HD1 ILE 60 3HD1 ILE 60 -11.199 -1.308 -7.085 478 H ASP 61 H ASP 61 -11.849 3.625 -6.312 479 HA ASP 61 HA ASP 61 -14.139 3.266 -7.982 480 1HB ASP 61 1HB ASP 61 -12.526 5.760 -7.398 481 2HB ASP 61 2HB ASP 61 -14.104 5.727 -8.180 482 H GLY 62 H GLY 62 -10.823 3.201 -8.606 483 1HA GLY 62 1HA GLY 62 -11.345 3.211 -11.471 484 2HA GLY 62 2HA GLY 62 -9.871 2.672 -10.683 485 H THR 63 H THR 63 -10.575 5.577 -9.306 486 HA THR 63 HA THR 63 -9.177 7.108 -11.384 487 HB THR 63 HB THR 63 -11.048 8.037 -9.201 488 HG1 THR 63 HG1 THR 63 -11.353 8.502 -11.968 489 1HG2 THR 63 1HG2 THR 63 -9.484 9.655 -11.209 490 2HG2 THR 63 2HG2 THR 63 -10.750 10.288 -10.153 491 3HG2 THR 63 3HG2 THR 63 -9.257 9.651 -9.459 492 H VAL 64 H VAL 64 -7.206 7.846 -10.953 493 HA VAL 64 HA VAL 64 -5.789 7.152 -8.651 494 HB VAL 64 HB VAL 64 -4.618 7.573 -10.722 495 1HG1 VAL 64 1HG1 VAL 64 -5.551 10.428 -10.457 496 2HG1 VAL 64 2HG1 VAL 64 -4.413 9.829 -11.663 497 3HG1 VAL 64 3HG1 VAL 64 -6.083 9.262 -11.669 498 1HG2 VAL 64 1HG2 VAL 64 -3.905 9.608 -8.615 499 2HG2 VAL 64 2HG2 VAL 64 -3.334 7.943 -8.710 500 3HG2 VAL 64 3HG2 VAL 64 -2.855 9.111 -9.941 501 H PHE 65 H PHE 65 -5.586 8.096 -6.731 502 HA PHE 65 HA PHE 65 -6.987 10.621 -6.308 503 1HB PHE 65 1HB PHE 65 -6.916 10.071 -3.914 504 2HB PHE 65 2HB PHE 65 -7.634 8.769 -4.855 505 HD1 PHE 65 HD1 PHE 65 -4.240 8.430 -5.455 506 HD2 PHE 65 HD2 PHE 65 -7.086 7.968 -2.343 507 HE1 PHE 65 HE1 PHE 65 -2.724 6.886 -4.319 508 HE2 PHE 65 HE2 PHE 65 -5.589 6.394 -1.222 509 HZ PHE 65 HZ PHE 65 -3.384 5.859 -2.191 510 H ASP 66 H ASP 66 -3.816 9.323 -6.464 511 HA ASP 66 HA ASP 66 -2.586 11.827 -6.446 512 1HB ASP 66 1HB ASP 66 -3.010 11.840 -4.046 513 2HB ASP 66 2HB ASP 66 -2.266 10.252 -3.879 514 H SER 67 H SER 67 -0.746 11.625 -7.548 515 HA SER 67 HA SER 67 0.685 9.058 -7.460 516 1HB SER 67 1HB SER 67 1.116 9.339 -9.931 517 2HB SER 67 2HB SER 67 -0.561 8.986 -9.513 518 HG SER 67 HG SER 67 -0.875 11.330 -9.600 519 H THR 68 H THR 68 2.755 9.327 -6.915 520 HA THR 68 HA THR 68 3.872 11.985 -6.799 521 HB THR 68 HB THR 68 5.835 10.938 -5.776 522 HG1 THR 68 HG1 THR 68 6.201 8.840 -5.968 523 1HG2 THR 68 1HG2 THR 68 3.203 9.854 -4.754 524 2HG2 THR 68 2HG2 THR 68 4.707 9.887 -3.835 525 3HG2 THR 68 3HG2 THR 68 3.944 11.397 -4.330 526 H GLU 69 H GLU 69 4.121 9.216 -8.899 527 HA GLU 69 HA GLU 69 6.533 9.980 -10.197 528 1HB GLU 69 1HB GLU 69 4.279 8.219 -11.174 529 2HB GLU 69 2HB GLU 69 5.864 8.348 -11.925 530 1HG GLU 69 1HG GLU 69 6.879 7.514 -9.830 531 2HG GLU 69 2HG GLU 69 5.256 7.294 -9.175 532 H LYS 70 H LYS 70 3.167 10.795 -10.634 533 HA LYS 70 HA LYS 70 3.437 11.920 -13.236 534 1HB LYS 70 1HB LYS 70 1.274 11.156 -12.365 535 2HB LYS 70 2HB LYS 70 1.330 12.396 -11.121 536 1HG LYS 70 1HG LYS 70 -0.145 13.088 -12.886 537 2HG LYS 70 2HG LYS 70 1.283 14.124 -12.878 538 1HD LYS 70 1HD LYS 70 2.235 12.800 -14.716 539 2HD LYS 70 2HD LYS 70 0.788 11.790 -14.729 540 1HE LYS 70 1HE LYS 70 0.671 13.471 -16.485 541 2HE LYS 70 2HE LYS 70 -0.573 13.759 -15.267 542 1HZ LYS 70 1HZ LYS 70 2.029 15.185 -15.431 543 2HZ LYS 70 2HZ LYS 70 0.538 15.806 -15.939 544 3HZ LYS 70 3HZ LYS 70 0.805 15.479 -14.301 545 H THR 71 H THR 71 3.493 13.266 -9.959 546 HA THR 71 HA THR 71 3.593 15.977 -10.651 547 HB THR 71 HB THR 71 4.675 16.331 -8.437 548 HG1 THR 71 HG1 THR 71 4.565 14.069 -7.262 549 1HG2 THR 71 1HG2 THR 71 2.231 16.150 -8.625 550 2HG2 THR 71 2HG2 THR 71 2.347 14.406 -8.392 551 3HG2 THR 71 3HG2 THR 71 2.814 15.502 -7.092 552 H GLY 72 H GLY 72 5.922 13.500 -11.007 553 1HA GLY 72 1HA GLY 72 7.829 15.447 -12.055 554 2HA GLY 72 2HA GLY 72 7.868 13.710 -12.315 555 H LYS 73 H LYS 73 7.311 14.009 -9.117 556 HA LYS 73 HA LYS 73 10.185 13.929 -8.500 557 1HB LYS 73 1HB LYS 73 9.737 15.009 -6.371 558 2HB LYS 73 2HB LYS 73 9.182 16.029 -7.688 559 1HG LYS 73 1HG LYS 73 6.893 15.339 -7.290 560 2HG LYS 73 2HG LYS 73 7.428 14.243 -6.013 561 1HD LYS 73 1HD LYS 73 8.361 16.228 -4.812 562 2HD LYS 73 2HD LYS 73 7.611 17.254 -6.035 563 1HE LYS 73 1HE LYS 73 6.177 15.343 -4.193 564 2HE LYS 73 2HE LYS 73 6.217 17.099 -4.040 565 1HZ LYS 73 1HZ LYS 73 5.058 15.599 -6.327 566 2HZ LYS 73 2HZ LYS 73 4.173 16.331 -5.085 567 3HZ LYS 73 3HZ LYS 73 5.074 17.281 -6.155 568 HA PRO 74 HA PRO 74 9.275 9.965 -6.840 569 1HB PRO 74 1HB PRO 74 11.474 9.573 -5.352 570 2HB PRO 74 2HB PRO 74 11.531 9.623 -7.119 571 1HG PRO 74 1HG PRO 74 12.157 11.811 -5.166 572 2HG PRO 74 2HG PRO 74 13.113 11.253 -6.556 573 1HD PRO 74 1HD PRO 74 11.502 13.409 -6.708 574 2HD PRO 74 2HD PRO 74 11.745 12.316 -8.087 575 H ALA 75 H ALA 75 8.779 8.885 -4.849 576 HA ALA 75 HA ALA 75 7.833 10.720 -2.813 577 1HB ALA 75 1HB ALA 75 7.290 7.827 -3.411 578 2HB ALA 75 2HB ALA 75 6.193 9.198 -3.556 579 3HB ALA 75 3HB ALA 75 6.693 8.633 -1.970 580 H THR 76 H THR 76 8.883 11.002 -0.937 581 HA THR 76 HA THR 76 10.723 8.885 -0.033 582 HB THR 76 HB THR 76 12.133 10.638 -0.837 583 HG1 THR 76 HG1 THR 76 11.984 11.105 1.961 584 1HG2 THR 76 1HG2 THR 76 10.443 12.433 -0.874 585 2HG2 THR 76 2HG2 THR 76 10.554 12.555 0.882 586 3HG2 THR 76 3HG2 THR 76 11.950 12.954 -0.118 587 H PHE 77 H PHE 77 10.087 8.068 1.834 588 HA PHE 77 HA PHE 77 9.275 9.780 4.015 589 1HB PHE 77 1HB PHE 77 7.112 8.627 4.373 590 2HB PHE 77 2HB PHE 77 7.149 9.528 2.861 591 HD1 PHE 77 HD1 PHE 77 7.450 8.302 0.712 592 HD2 PHE 77 HD2 PHE 77 6.764 6.289 4.402 593 HE1 PHE 77 HE1 PHE 77 6.804 6.272 -0.520 594 HE2 PHE 77 HE2 PHE 77 6.118 4.257 3.174 595 HZ PHE 77 HZ PHE 77 6.138 4.246 0.712 596 H GLN 78 H GLN 78 9.196 8.710 6.041 597 HA GLN 78 HA GLN 78 10.937 6.401 6.203 598 1HB GLN 78 1HB GLN 78 10.272 8.567 7.882 599 2HB GLN 78 2HB GLN 78 9.667 7.137 8.704 600 1HG GLN 78 1HG GLN 78 12.405 6.971 7.621 601 2HG GLN 78 2HG GLN 78 12.157 8.062 8.981 602 1HE2 GLN 78 1HE2 GLN 78 10.296 5.152 8.481 603 2HE2 GLN 78 2HE2 GLN 78 10.936 4.278 9.824 604 H VAL 79 H VAL 79 10.287 4.343 6.471 605 HA VAL 79 HA VAL 79 7.609 3.606 6.024 606 HB VAL 79 HB VAL 79 8.315 1.333 6.303 607 1HG1 VAL 79 1HG1 VAL 79 9.045 2.507 4.276 608 2HG1 VAL 79 2HG1 VAL 79 10.550 2.948 5.082 609 3HG1 VAL 79 3HG1 VAL 79 10.191 1.254 4.755 610 1HG2 VAL 79 1HG2 VAL 79 10.826 2.446 7.556 611 2HG2 VAL 79 2HG2 VAL 79 9.550 1.552 8.389 612 3HG2 VAL 79 3HG2 VAL 79 10.538 0.747 7.166 613 H SER 80 H SER 80 8.952 4.736 8.871 614 HA SER 80 HA SER 80 7.267 3.077 10.593 615 1HB SER 80 1HB SER 80 9.538 3.395 11.363 616 2HB SER 80 2HB SER 80 9.364 5.146 11.266 617 HG SER 80 HG SER 80 9.014 3.881 13.384 618 H GLN 81 H GLN 81 7.124 6.091 9.028 619 HA GLN 81 HA GLN 81 5.325 7.228 11.034 620 1HB GLN 81 1HB GLN 81 6.592 8.416 8.572 621 2HB GLN 81 2HB GLN 81 5.434 9.272 9.581 622 1HG GLN 81 1HG GLN 81 6.941 9.055 11.494 623 2HG GLN 81 2HG GLN 81 8.103 8.205 10.476 624 1HE2 GLN 81 1HE2 GLN 81 9.265 9.347 8.940 625 2HE2 GLN 81 2HE2 GLN 81 9.364 11.071 8.945 626 H VAL 82 H VAL 82 4.855 5.119 8.634 627 HA VAL 82 HA VAL 82 2.460 6.427 7.562 628 HB VAL 82 HB VAL 82 2.382 4.394 6.037 629 1HG1 VAL 82 1HG1 VAL 82 4.759 6.250 5.924 630 2HG1 VAL 82 2HG1 VAL 82 4.155 5.290 4.573 631 3HG1 VAL 82 3HG1 VAL 82 3.151 6.559 5.269 632 1HG2 VAL 82 1HG2 VAL 82 5.150 4.012 7.178 633 2HG2 VAL 82 2HG2 VAL 82 3.788 2.902 7.333 634 3HG2 VAL 82 3HG2 VAL 82 4.515 3.190 5.753 635 H ILE 83 H ILE 83 0.644 4.664 7.065 636 HA ILE 83 HA ILE 83 -0.574 4.050 9.479 637 HB ILE 83 HB ILE 83 -2.084 2.565 8.134 638 1HG1 ILE 83 1HG1 ILE 83 -0.345 3.470 5.825 639 2HG1 ILE 83 2HG1 ILE 83 -0.336 1.846 6.506 640 1HG2 ILE 83 1HG2 ILE 83 -1.536 5.326 7.048 641 2HG2 ILE 83 2HG2 ILE 83 -3.021 4.406 6.800 642 3HG2 ILE 83 3HG2 ILE 83 -2.565 4.925 8.423 643 1HD1 ILE 83 1HD1 ILE 83 -2.701 3.180 5.210 644 2HD1 ILE 83 2HD1 ILE 83 -1.652 1.980 4.457 645 3HD1 ILE 83 3HD1 ILE 83 -2.647 1.535 5.843 646 HA PRO 84 HA PRO 84 0.968 0.334 11.256 647 1HB PRO 84 1HB PRO 84 -1.383 -1.243 11.123 648 2HB PRO 84 2HB PRO 84 -0.827 -0.266 12.484 649 1HG PRO 84 1HG PRO 84 -2.821 0.381 10.376 650 2HG PRO 84 2HG PRO 84 -2.770 0.890 12.073 651 1HD PRO 84 1HD PRO 84 -2.143 2.586 10.110 652 2HD PRO 84 2HD PRO 84 -1.239 2.591 11.641 653 H GLY 85 H GLY 85 -1.422 -0.686 8.790 654 1HA GLY 85 1HA GLY 85 -1.185 -2.045 6.952 655 2HA GLY 85 2HA GLY 85 -0.255 -3.064 8.043 656 H TRP 86 H TRP 86 0.400 0.141 6.602 657 HA TRP 86 HA TRP 86 2.235 -0.751 4.681 658 1HB TRP 86 1HB TRP 86 1.368 1.824 5.760 659 2HB TRP 86 2HB TRP 86 3.047 1.824 5.237 660 HD1 TRP 86 HD1 TRP 86 0.282 -0.161 3.426 661 HE1 TRP 86 HE1 TRP 86 0.051 0.780 1.036 662 HE3 TRP 86 HE3 TRP 86 3.444 3.839 3.812 663 HZ2 TRP 86 HZ2 TRP 86 1.063 2.934 -0.472 664 HZ3 TRP 86 HZ3 TRP 86 3.752 5.293 1.851 665 HH2 TRP 86 HH2 TRP 86 2.586 4.847 -0.247 666 H THR 87 H THR 87 2.827 0.517 7.964 667 HA THR 87 HA THR 87 5.601 0.587 7.874 668 HB THR 87 HB THR 87 5.601 0.418 10.304 669 HG1 THR 87 HG1 THR 87 2.958 0.223 10.762 670 1HG2 THR 87 1HG2 THR 87 3.297 2.038 9.219 671 2HG2 THR 87 2HG2 THR 87 4.008 2.247 10.818 672 3HG2 THR 87 3HG2 THR 87 4.972 2.560 9.375 673 H GLU 88 H GLU 88 3.463 -2.154 8.454 674 HA GLU 88 HA GLU 88 5.508 -3.949 9.281 675 1HB GLU 88 1HB GLU 88 3.126 -4.277 9.822 676 2HB GLU 88 2HB GLU 88 2.785 -4.555 8.120 677 1HG GLU 88 1HG GLU 88 2.892 -6.657 9.268 678 2HG GLU 88 2HG GLU 88 4.268 -6.518 8.168 679 H ALA 89 H ALA 89 3.803 -3.529 6.175 680 HA ALA 89 HA ALA 89 5.193 -5.552 4.793 681 1HB ALA 89 1HB ALA 89 3.081 -4.637 3.999 682 2HB ALA 89 2HB ALA 89 4.332 -4.506 2.759 683 3HB ALA 89 3HB ALA 89 3.860 -3.082 3.690 684 H LEU 90 H LEU 90 5.692 -2.029 4.786 685 HA LEU 90 HA LEU 90 7.881 -1.961 3.071 686 1HB LEU 90 1HB LEU 90 6.852 -0.161 5.215 687 2HB LEU 90 2HB LEU 90 8.428 0.165 4.526 688 HG LEU 90 HG LEU 90 6.655 1.495 3.465 689 1HD1 LEU 90 1HD1 LEU 90 8.648 0.928 2.189 690 2HD1 LEU 90 2HD1 LEU 90 7.887 -0.566 1.642 691 3HD1 LEU 90 3HD1 LEU 90 7.228 0.993 1.145 692 1HD2 LEU 90 1HD2 LEU 90 5.567 -1.177 2.583 693 2HD2 LEU 90 2HD2 LEU 90 4.799 -0.052 3.702 694 3HD2 LEU 90 3HD2 LEU 90 5.013 0.396 2.011 695 H GLN 91 H GLN 91 7.716 -2.760 6.465 696 HA GLN 91 HA GLN 91 10.483 -2.444 7.036 697 1HB GLN 91 1HB GLN 91 8.735 -2.474 8.777 698 2HB GLN 91 2HB GLN 91 8.421 -4.174 8.419 699 1HG GLN 91 1HG GLN 91 10.734 -4.707 9.087 700 2HG GLN 91 2HG GLN 91 10.975 -3.014 9.519 701 1HE2 GLN 91 1HE2 GLN 91 11.372 -3.481 11.666 702 2HE2 GLN 91 2HE2 GLN 91 10.130 -3.993 12.752 703 H LEU 92 H LEU 92 8.724 -4.825 5.342 704 HA LEU 92 HA LEU 92 10.827 -6.833 5.708 705 1HB LEU 92 1HB LEU 92 8.109 -7.062 4.422 706 2HB LEU 92 2HB LEU 92 9.252 -8.378 4.608 707 HG LEU 92 HG LEU 92 7.960 -6.873 6.887 708 1HD1 LEU 92 1HD1 LEU 92 6.370 -8.248 5.608 709 2HD1 LEU 92 2HD1 LEU 92 7.411 -9.652 5.856 710 3HD1 LEU 92 3HD1 LEU 92 6.641 -8.870 7.238 711 1HD2 LEU 92 1HD2 LEU 92 10.199 -7.773 7.396 712 2HD2 LEU 92 2HD2 LEU 92 8.921 -8.580 8.306 713 3HD2 LEU 92 3HD2 LEU 92 9.645 -9.375 6.908 714 H MET 93 H MET 93 10.022 -4.374 3.591 715 HA MET 93 HA MET 93 10.934 -5.741 1.194 716 1HB MET 93 1HB MET 93 9.828 -3.005 1.766 717 2HB MET 93 2HB MET 93 10.563 -3.393 0.215 718 1HG MET 93 1HG MET 93 8.932 -5.169 -0.121 719 2HG MET 93 2HG MET 93 8.204 -4.798 1.442 720 1HE MET 93 1HE MET 93 8.787 -3.640 -2.238 721 2HE MET 93 2HE MET 93 8.121 -2.006 -2.229 722 3HE MET 93 3HE MET 93 9.599 -2.360 -1.336 723 HA PRO 94 HA PRO 94 15.101 -4.225 2.252 724 1HB PRO 94 1HB PRO 94 16.387 -5.686 0.345 725 2HB PRO 94 2HB PRO 94 15.932 -6.342 1.922 726 1HG PRO 94 1HG PRO 94 14.579 -6.649 -0.722 727 2HG PRO 94 2HG PRO 94 14.833 -7.852 0.553 728 1HD PRO 94 1HD PRO 94 12.459 -6.578 0.164 729 2HD PRO 94 2HD PRO 94 13.024 -7.134 1.780 730 H ALA 95 H ALA 95 16.284 -2.573 1.322 731 HA ALA 95 HA ALA 95 15.197 -0.914 -0.552 732 1HB ALA 95 1HB ALA 95 17.087 -0.317 0.889 733 2HB ALA 95 2HB ALA 95 18.148 -1.325 -0.096 734 3HB ALA 95 3HB ALA 95 17.388 0.103 -0.796 735 H GLY 96 H GLY 96 14.860 -0.962 -2.676 736 1HA GLY 96 1HA GLY 96 16.653 -2.580 -4.357 737 2HA GLY 96 2HA GLY 96 15.637 -1.266 -4.923 738 H SER 97 H SER 97 13.809 -3.081 -2.834 739 HA SER 97 HA SER 97 13.101 -5.242 -4.582 740 1HB SER 97 1HB SER 97 11.805 -4.188 -2.061 741 2HB SER 97 2HB SER 97 11.265 -5.629 -2.920 742 HG SER 97 HG SER 97 12.876 -6.700 -2.108 743 H THR 98 H THR 98 10.521 -5.524 -4.730 744 HA THR 98 HA THR 98 9.167 -3.119 -5.597 745 HB THR 98 HB THR 98 9.570 -5.323 -7.621 746 HG1 THR 98 HG1 THR 98 11.133 -4.032 -8.561 747 1HG2 THR 98 1HG2 THR 98 7.551 -3.955 -7.884 748 2HG2 THR 98 2HG2 THR 98 8.542 -2.494 -7.882 749 3HG2 THR 98 3HG2 THR 98 8.700 -3.665 -9.193 750 H TRP 99 H TRP 99 7.469 -3.553 -4.229 751 HA TRP 99 HA TRP 99 6.012 -6.074 -4.714 752 1HB TRP 99 1HB TRP 99 6.572 -4.601 -2.167 753 2HB TRP 99 2HB TRP 99 5.099 -5.546 -2.307 754 HD1 TRP 99 HD1 TRP 99 7.603 -7.412 -4.192 755 HE1 TRP 99 HE1 TRP 99 8.651 -9.273 -2.758 756 HE3 TRP 99 HE3 TRP 99 5.994 -5.894 0.417 757 HZ2 TRP 99 HZ2 TRP 99 8.780 -10.003 -0.030 758 HZ3 TRP 99 HZ3 TRP 99 6.622 -7.227 2.386 759 HH2 TRP 99 HH2 TRP 99 7.987 -9.239 2.167 760 H GLU 100 H GLU 100 3.782 -6.009 -4.763 761 HA GLU 100 HA GLU 100 2.562 -3.332 -4.977 762 1HB GLU 100 1HB GLU 100 2.386 -4.290 -7.127 763 2HB GLU 100 2HB GLU 100 2.069 -5.894 -6.485 764 1HG GLU 100 1HG GLU 100 -0.148 -5.278 -5.851 765 2HG GLU 100 2HG GLU 100 0.154 -3.587 -6.247 766 H ILE 101 H ILE 101 1.522 -2.960 -3.098 767 HA ILE 101 HA ILE 101 0.179 -5.229 -1.804 768 HB ILE 101 HB ILE 101 0.305 -3.945 0.278 769 1HG1 ILE 101 1HG1 ILE 101 1.992 -1.988 -1.294 770 2HG1 ILE 101 2HG1 ILE 101 0.327 -1.689 -0.804 771 1HG2 ILE 101 1HG2 ILE 101 2.848 -4.486 -1.221 772 2HG2 ILE 101 2HG2 ILE 101 2.842 -4.004 0.476 773 3HG2 ILE 101 3HG2 ILE 101 2.043 -5.495 -0.021 774 1HD1 ILE 101 1HD1 ILE 101 2.629 -2.189 1.069 775 2HD1 ILE 101 2HD1 ILE 101 1.945 -0.612 0.677 776 3HD1 ILE 101 3HD1 ILE 101 0.968 -1.809 1.526 777 H TYR 102 H TYR 102 -1.848 -5.099 -1.046 778 HA TYR 102 HA TYR 102 -3.434 -2.702 -1.674 779 1HB TYR 102 1HB TYR 102 -5.267 -4.730 -1.869 780 2HB TYR 102 2HB TYR 102 -4.444 -4.003 -3.245 781 HD1 TYR 102 HD1 TYR 102 -4.739 -6.943 -1.129 782 HD2 TYR 102 HD2 TYR 102 -2.568 -5.193 -4.337 783 HE1 TYR 102 HE1 TYR 102 -3.810 -9.144 -1.697 784 HE2 TYR 102 HE2 TYR 102 -1.633 -7.386 -4.913 785 HH TYR 102 HH TYR 102 -1.201 -9.544 -3.832 786 H VAL 103 H VAL 103 -3.758 -1.869 0.302 787 HA VAL 103 HA VAL 103 -4.292 -3.687 2.554 788 HB VAL 103 HB VAL 103 -3.755 -0.750 2.855 789 1HG1 VAL 103 1HG1 VAL 103 -3.191 -3.157 4.583 790 2HG1 VAL 103 2HG1 VAL 103 -2.798 -1.487 4.991 791 3HG1 VAL 103 3HG1 VAL 103 -4.482 -1.978 4.813 792 1HG2 VAL 103 1HG2 VAL 103 -1.695 -2.913 2.420 793 2HG2 VAL 103 2HG2 VAL 103 -1.963 -1.476 1.433 794 3HG2 VAL 103 3HG2 VAL 103 -1.337 -1.314 3.074 795 HA PRO 104 HA PRO 104 -8.589 -2.099 2.022 796 1HB PRO 104 1HB PRO 104 -9.558 -3.907 3.898 797 2HB PRO 104 2HB PRO 104 -9.520 -4.181 2.154 798 1HG PRO 104 1HG PRO 104 -7.649 -5.128 4.273 799 2HG PRO 104 2HG PRO 104 -8.200 -5.957 2.805 800 1HD PRO 104 1HD PRO 104 -5.755 -4.856 2.986 801 2HD PRO 104 2HD PRO 104 -6.667 -4.864 1.463 802 H SER 105 H SER 105 -9.856 -0.846 3.485 803 HA SER 105 HA SER 105 -8.542 0.690 5.332 804 1HB SER 105 1HB SER 105 -11.094 0.632 4.348 805 2HB SER 105 2HB SER 105 -11.351 0.233 6.054 806 HG SER 105 HG SER 105 -9.662 2.369 5.384 807 H GLY 106 H GLY 106 -10.248 -2.349 5.957 808 1HA GLY 106 1HA GLY 106 -10.240 -3.743 7.781 809 2HA GLY 106 2HA GLY 106 -10.279 -2.278 8.745 810 H LEU 107 H LEU 107 -7.576 -2.308 6.779 811 HA LEU 107 HA LEU 107 -5.910 -3.585 8.842 812 1HB LEU 107 1HB LEU 107 -5.571 -3.273 5.875 813 2HB LEU 107 2HB LEU 107 -4.196 -3.594 6.912 814 HG LEU 107 HG LEU 107 -5.064 -5.722 7.552 815 1HD1 LEU 107 1HD1 LEU 107 -7.557 -4.917 6.067 816 2HD1 LEU 107 2HD1 LEU 107 -7.209 -6.564 6.592 817 3HD1 LEU 107 3HD1 LEU 107 -7.399 -5.281 7.786 818 1HD2 LEU 107 1HD2 LEU 107 -5.304 -5.205 4.601 819 2HD2 LEU 107 2HD2 LEU 107 -3.884 -5.754 5.487 820 3HD2 LEU 107 3HD2 LEU 107 -5.282 -6.815 5.318 821 H ALA 108 H ALA 108 -6.707 -0.609 7.428 822 HA ALA 108 HA ALA 108 -4.189 0.598 8.350 823 1HB ALA 108 1HB ALA 108 -4.575 1.014 6.016 824 2HB ALA 108 2HB ALA 108 -4.799 2.523 6.905 825 3HB ALA 108 3HB ALA 108 -6.203 1.610 6.346 826 H TYR 109 H TYR 109 -6.851 2.698 7.786 827 HA TYR 109 HA TYR 109 -6.909 3.371 10.614 828 1HB TYR 109 1HB TYR 109 -7.638 4.731 8.089 829 2HB TYR 109 2HB TYR 109 -8.594 5.151 9.509 830 HD1 TYR 109 HD1 TYR 109 -5.332 5.431 7.891 831 HD2 TYR 109 HD2 TYR 109 -7.513 6.146 11.475 832 HE1 TYR 109 HE1 TYR 109 -3.565 6.958 8.657 833 HE2 TYR 109 HE2 TYR 109 -5.751 7.678 12.249 834 HH TYR 109 HH TYR 109 -3.411 8.133 11.868 835 H GLY 110 H GLY 110 -8.741 1.572 8.369 836 1HA GLY 110 1HA GLY 110 -10.872 1.298 10.383 837 2HA GLY 110 2HA GLY 110 -10.392 0.054 9.248 838 HA PRO 111 HA PRO 111 -13.283 1.201 6.138 839 1HB PRO 111 1HB PRO 111 -15.408 -0.346 6.934 840 2HB PRO 111 2HB PRO 111 -14.012 -0.956 6.038 841 1HG PRO 111 1HG PRO 111 -14.544 -1.023 8.987 842 2HG PRO 111 2HG PRO 111 -13.927 -2.311 7.932 843 1HD PRO 111 1HD PRO 111 -12.262 -0.912 9.461 844 2HD PRO 111 2HD PRO 111 -11.810 -1.356 7.802 845 H ARG 112 H ARG 112 -13.745 1.923 9.422 846 HA ARG 112 HA ARG 112 -16.405 2.967 9.210 847 1HB ARG 112 1HB ARG 112 -14.282 3.388 11.318 848 2HB ARG 112 2HB ARG 112 -15.953 3.920 11.455 849 1HG ARG 112 1HG ARG 112 -16.686 1.578 11.281 850 2HG ARG 112 2HG ARG 112 -14.996 1.075 11.229 851 1HD ARG 112 1HD ARG 112 -16.324 2.573 13.486 852 2HD ARG 112 2HD ARG 112 -15.941 0.852 13.478 853 HE ARG 112 HE ARG 112 -13.592 2.283 12.969 854 1HH1 ARG 112 1HH1 ARG 112 -15.869 1.746 15.549 855 2HH1 ARG 112 2HH1 ARG 112 -14.705 1.998 16.805 856 1HH2 ARG 112 1HH2 ARG 112 -12.050 2.620 14.613 857 2HH2 ARG 112 2HH2 ARG 112 -12.531 2.499 16.272 858 H SER 113 H SER 113 -16.785 5.310 9.920 859 HA SER 113 HA SER 113 -15.943 7.026 7.909 860 1HB SER 113 1HB SER 113 -17.972 7.403 9.229 861 2HB SER 113 2HB SER 113 -16.991 7.744 10.655 862 HG SER 113 HG SER 113 -17.802 9.471 8.903 863 H VAL 114 H VAL 114 -14.027 5.834 10.252 864 HA VAL 114 HA VAL 114 -12.465 8.256 10.706 865 HB VAL 114 HB VAL 114 -11.680 5.515 11.657 866 1HG1 VAL 114 1HG1 VAL 114 -11.268 8.299 12.744 867 2HG1 VAL 114 2HG1 VAL 114 -10.740 6.812 13.541 868 3HG1 VAL 114 3HG1 VAL 114 -10.052 7.268 11.977 869 1HG2 VAL 114 1HG2 VAL 114 -13.690 7.345 12.962 870 2HG2 VAL 114 2HG2 VAL 114 -14.011 5.750 12.280 871 3HG2 VAL 114 3HG2 VAL 114 -12.985 5.909 13.707 872 H GLY 115 H GLY 115 -12.778 6.729 8.084 873 1HA GLY 115 1HA GLY 115 -11.477 6.185 6.274 874 2HA GLY 115 2HA GLY 115 -10.345 5.480 7.424 875 H GLY 116 H GLY 116 -8.397 6.386 7.557 876 1HA GLY 116 1HA GLY 116 -6.712 7.946 7.450 877 2HA GLY 116 2HA GLY 116 -7.948 9.191 7.486 878 HA PRO 117 HA PRO 117 -5.959 9.553 3.337 879 1HB PRO 117 1HB PRO 117 -4.226 7.602 2.521 880 2HB PRO 117 2HB PRO 117 -3.756 8.957 3.554 881 1HG PRO 117 1HG PRO 117 -4.454 6.147 4.315 882 2HG PRO 117 2HG PRO 117 -3.137 7.173 4.911 883 1HD PRO 117 1HD PRO 117 -5.396 6.807 6.326 884 2HD PRO 117 2HD PRO 117 -4.534 8.369 6.323 885 H ILE 118 H ILE 118 -6.738 6.160 3.955 886 HA ILE 118 HA ILE 118 -7.740 5.828 1.242 887 HB ILE 118 HB ILE 118 -7.775 3.790 3.477 888 1HG1 ILE 118 1HG1 ILE 118 -5.481 4.422 3.140 889 2HG1 ILE 118 2HG1 ILE 118 -5.737 2.873 2.345 890 1HG2 ILE 118 1HG2 ILE 118 -9.301 3.323 1.634 891 2HG2 ILE 118 2HG2 ILE 118 -7.973 3.493 0.483 892 3HG2 ILE 118 3HG2 ILE 118 -7.961 2.175 1.657 893 1HD1 ILE 118 1HD1 ILE 118 -5.671 5.549 0.971 894 2HD1 ILE 118 2HD1 ILE 118 -4.356 4.376 1.013 895 3HD1 ILE 118 3HD1 ILE 118 -5.864 3.978 0.193 896 H GLY 119 H GLY 119 -9.775 6.105 0.686 897 1HA GLY 119 1HA GLY 119 -12.066 6.250 0.793 898 2HA GLY 119 2HA GLY 119 -11.725 7.284 2.170 899 HA PRO 120 HA PRO 120 -13.508 4.499 5.075 900 1HB PRO 120 1HB PRO 120 -16.199 5.006 4.729 901 2HB PRO 120 2HB PRO 120 -15.106 6.013 5.682 902 1HG PRO 120 1HG PRO 120 -16.081 6.393 2.884 903 2HG PRO 120 2HG PRO 120 -15.843 7.597 4.164 904 1HD PRO 120 1HD PRO 120 -14.077 7.300 2.157 905 2HD PRO 120 2HD PRO 120 -13.558 7.717 3.804 906 H ASN 121 H ASN 121 -13.932 2.376 4.999 907 HA ASN 121 HA ASN 121 -14.257 0.293 4.094 908 1HB ASN 121 1HB ASN 121 -16.724 1.386 2.772 909 2HB ASN 121 2HB ASN 121 -16.478 -0.183 3.525 910 1HD2 ASN 121 1HD2 ASN 121 -17.111 3.181 4.051 911 2HD2 ASN 121 2HD2 ASN 121 -17.613 3.049 5.704 912 H GLU 122 H GLU 122 -12.641 2.039 2.534 913 HA GLU 122 HA GLU 122 -13.336 1.193 -0.198 914 1HB GLU 122 1HB GLU 122 -13.302 3.630 0.114 915 2HB GLU 122 2HB GLU 122 -11.645 3.532 0.689 916 1HG GLU 122 1HG GLU 122 -10.980 2.630 -1.518 917 2HG GLU 122 2HG GLU 122 -12.635 2.882 -2.075 918 H THR 123 H THR 123 -12.013 -0.170 -1.206 919 HA THR 123 HA THR 123 -9.494 -0.879 0.101 920 HB THR 123 HB THR 123 -10.952 -2.262 -2.167 921 HG1 THR 123 HG1 THR 123 -11.187 -3.864 -0.359 922 1HG2 THR 123 1HG2 THR 123 -8.539 -3.111 -0.557 923 2HG2 THR 123 2HG2 THR 123 -9.390 -4.117 -1.729 924 3HG2 THR 123 3HG2 THR 123 -8.548 -2.663 -2.263 925 H LEU 124 H LEU 124 -7.571 -0.322 -0.741 926 HA LEU 124 HA LEU 124 -7.592 0.915 -3.421 927 1HB LEU 124 1HB LEU 124 -7.026 2.108 -0.990 928 2HB LEU 124 2HB LEU 124 -5.441 1.778 -1.669 929 HG LEU 124 HG LEU 124 -7.191 2.914 -3.660 930 1HD1 LEU 124 1HD1 LEU 124 -8.285 3.944 -1.728 931 2HD1 LEU 124 2HD1 LEU 124 -6.729 4.571 -1.188 932 3HD1 LEU 124 3HD1 LEU 124 -7.425 5.133 -2.706 933 1HD2 LEU 124 1HD2 LEU 124 -4.734 2.779 -3.757 934 2HD2 LEU 124 2HD2 LEU 124 -5.333 4.428 -3.953 935 3HD2 LEU 124 3HD2 LEU 124 -4.640 3.919 -2.414 936 H ILE 125 H ILE 125 -5.575 0.835 -4.592 937 HA ILE 125 HA ILE 125 -3.943 -1.531 -3.945 938 HB ILE 125 HB ILE 125 -4.396 -0.304 -6.671 939 1HG1 ILE 125 1HG1 ILE 125 -5.571 -2.634 -6.966 940 2HG1 ILE 125 2HG1 ILE 125 -5.753 -2.541 -5.215 941 1HG2 ILE 125 1HG2 ILE 125 -2.241 -1.439 -6.412 942 2HG2 ILE 125 2HG2 ILE 125 -3.078 -2.898 -5.874 943 3HG2 ILE 125 3HG2 ILE 125 -3.306 -2.306 -7.523 944 1HD1 ILE 125 1HD1 ILE 125 -6.719 -0.436 -7.133 945 2HD1 ILE 125 2HD1 ILE 125 -7.718 -1.733 -6.478 946 3HD1 ILE 125 3HD1 ILE 125 -7.025 -0.522 -5.400 947 H PHE 126 H PHE 126 -1.706 -1.363 -4.074 948 HA PHE 126 HA PHE 126 -0.626 1.305 -4.666 949 1HB PHE 126 1HB PHE 126 0.219 -0.391 -2.311 950 2HB PHE 126 2HB PHE 126 0.817 1.213 -2.716 951 HD1 PHE 126 HD1 PHE 126 -1.473 -0.616 -0.791 952 HD2 PHE 126 HD2 PHE 126 -0.996 3.095 -2.820 953 HE1 PHE 126 HE1 PHE 126 -3.228 0.372 0.618 954 HE2 PHE 126 HE2 PHE 126 -2.750 4.092 -1.409 955 HZ PHE 126 HZ PHE 126 -3.868 2.727 0.312 956 H LYS 127 H LYS 127 1.140 1.305 -5.897 957 HA LYS 127 HA LYS 127 2.509 -1.260 -6.382 958 1HB LYS 127 1HB LYS 127 1.266 0.067 -8.275 959 2HB LYS 127 2HB LYS 127 2.682 1.105 -8.229 960 1HG LYS 127 1HG LYS 127 2.832 -1.870 -8.639 961 2HG LYS 127 2HG LYS 127 2.717 -0.707 -9.961 962 1HD LYS 127 1HD LYS 127 4.777 0.395 -9.062 963 2HD LYS 127 2HD LYS 127 4.917 -0.947 -7.910 964 1HE LYS 127 1HE LYS 127 5.073 -2.527 -9.762 965 2HE LYS 127 2HE LYS 127 4.898 -1.207 -10.919 966 1HZ LYS 127 1HZ LYS 127 6.963 -0.257 -10.075 967 2HZ LYS 127 2HZ LYS 127 7.134 -1.545 -8.993 968 3HZ LYS 127 3HZ LYS 127 7.207 -1.824 -10.660 969 H ILE 128 H ILE 128 4.227 -1.270 -5.042 970 HA ILE 128 HA ILE 128 5.736 1.217 -4.666 971 HB ILE 128 HB ILE 128 6.053 -1.327 -3.089 972 1HG1 ILE 128 1HG1 ILE 128 4.326 1.076 -2.430 973 2HG1 ILE 128 2HG1 ILE 128 3.717 -0.497 -2.950 974 1HG2 ILE 128 1HG2 ILE 128 7.911 0.247 -2.966 975 2HG2 ILE 128 2HG2 ILE 128 6.801 1.535 -2.501 976 3HG2 ILE 128 3HG2 ILE 128 7.055 0.162 -1.426 977 1HD1 ILE 128 1HD1 ILE 128 5.274 0.037 -0.429 978 2HD1 ILE 128 2HD1 ILE 128 3.532 -0.205 -0.542 979 3HD1 ILE 128 3HD1 ILE 128 4.632 -1.523 -0.945 980 H HIS 129 H HIS 129 7.576 1.512 -5.668 981 HA HIS 129 HA HIS 129 9.171 -0.838 -6.451 982 1HB HIS 129 1HB HIS 129 8.094 0.924 -8.210 983 2HB HIS 129 2HB HIS 129 9.628 1.721 -7.877 984 HD1 HIS 129 HD1 HIS 129 8.590 0.104 -10.541 985 HD2 HIS 129 HD2 HIS 129 11.475 -1.041 -7.783 986 HE1 HIS 129 HE1 HIS 129 10.051 -1.550 -11.745 987 HE2 HIS 129 HE2 HIS 129 11.649 -2.382 -9.985 988 H LEU 130 H LEU 130 10.580 -0.956 -4.791 989 HA LEU 130 HA LEU 130 11.694 1.385 -3.561 990 1HB LEU 130 1HB LEU 130 11.261 -1.144 -2.703 991 2HB LEU 130 2HB LEU 130 12.971 -1.222 -3.072 992 HG LEU 130 HG LEU 130 11.652 0.688 -1.155 993 1HD1 LEU 130 1HD1 LEU 130 13.446 -1.680 -0.724 994 2HD1 LEU 130 2HD1 LEU 130 12.995 -0.523 0.529 995 3HD1 LEU 130 3HD1 LEU 130 11.756 -1.519 -0.242 996 1HD2 LEU 130 1HD2 LEU 130 14.217 0.810 -2.487 997 2HD2 LEU 130 2HD2 LEU 130 13.395 2.018 -1.501 998 3HD2 LEU 130 3HD2 LEU 130 14.377 0.773 -0.731 999 H ILE 131 H ILE 131 13.428 2.466 -4.142 1000 HA ILE 131 HA ILE 131 15.168 1.363 -6.209 1001 HB ILE 131 HB ILE 131 15.144 4.147 -5.036 1002 1HG1 ILE 131 1HG1 ILE 131 13.015 3.649 -6.147 1003 2HG1 ILE 131 2HG1 ILE 131 13.965 4.817 -7.095 1004 1HG2 ILE 131 1HG2 ILE 131 16.528 2.973 -7.439 1005 2HG2 ILE 131 2HG2 ILE 131 16.381 4.705 -7.135 1006 3HG2 ILE 131 3HG2 ILE 131 17.270 3.684 -6.004 1007 1HD1 ILE 131 1HD1 ILE 131 14.662 2.994 -8.585 1008 2HD1 ILE 131 2HD1 ILE 131 13.674 1.865 -7.657 1009 3HD1 ILE 131 3HD1 ILE 131 12.910 3.187 -8.542 1010 H SER 132 H SER 132 15.568 3.104 -3.102 1011 HA SER 132 HA SER 132 17.596 1.282 -2.227 1012 1HB SER 132 1HB SER 132 18.565 4.098 -2.707 1013 2HB SER 132 2HB SER 132 19.508 2.677 -2.253 1014 HG SER 132 HG SER 132 19.097 1.817 -4.307 1015 H VAL 133 H VAL 133 18.577 1.981 -0.123 1016 HA VAL 133 HA VAL 133 16.580 3.464 1.462 1017 HB VAL 133 HB VAL 133 16.860 1.138 2.144 1018 1HG1 VAL 133 1HG1 VAL 133 19.154 0.808 1.358 1019 2HG1 VAL 133 2HG1 VAL 133 19.747 1.847 2.654 1020 3HG1 VAL 133 3HG1 VAL 133 18.970 0.314 3.041 1021 1HG2 VAL 133 1HG2 VAL 133 16.349 2.813 3.850 1022 2HG2 VAL 133 2HG2 VAL 133 17.324 1.502 4.511 1023 3HG2 VAL 133 3HG2 VAL 133 18.072 3.054 4.135 1024 H LYS 134 H LYS 134 17.135 5.366 2.286 1025 HA LYS 134 HA LYS 134 18.435 7.274 2.467 1026 1HB LYS 134 1HB LYS 134 19.067 5.272 4.497 1027 2HB LYS 134 2HB LYS 134 20.326 6.485 4.309 1028 1HG LYS 134 1HG LYS 134 18.051 8.009 4.346 1029 2HG LYS 134 2HG LYS 134 17.664 6.696 5.486 1030 1HD LYS 134 1HD LYS 134 18.681 8.435 6.751 1031 2HD LYS 134 2HD LYS 134 19.888 7.158 6.583 1032 1HE LYS 134 1HE LYS 134 20.909 8.399 4.716 1033 2HE LYS 134 2HE LYS 134 19.725 9.686 4.940 1034 1HZ LYS 134 1HZ LYS 134 20.598 9.978 7.211 1035 2HZ LYS 134 2HZ LYS 134 21.798 8.830 6.886 1036 3HZ LYS 134 3HZ LYS 134 21.760 10.282 6.021 1037 H LYS 135 H LYS 135 19.287 7.051 0.255 1038 HA LYS 135 HA LYS 135 20.973 7.240 -1.241 1039 1HB LYS 135 1HB LYS 135 22.523 7.661 1.301 1040 2HB LYS 135 2HB LYS 135 23.246 7.820 -0.294 1041 1HG LYS 135 1HG LYS 135 21.522 9.549 -0.815 1042 2HG LYS 135 2HG LYS 135 21.016 9.467 0.874 1043 1HD LYS 135 1HD LYS 135 23.295 10.084 1.566 1044 2HD LYS 135 2HD LYS 135 23.764 10.203 -0.132 1045 1HE LYS 135 1HE LYS 135 22.097 11.973 -0.458 1046 2HE LYS 135 2HE LYS 135 21.646 11.857 1.243 1047 1HZ LYS 135 1HZ LYS 135 23.897 12.515 1.841 1048 2HZ LYS 135 2HZ LYS 135 24.319 12.638 0.208 1049 3HZ LYS 135 3HZ LYS 135 23.166 13.688 0.864 1050 H SER 136 H SER 136 20.243 4.612 -0.216 1051 HA SER 136 HA SER 136 20.893 2.438 -0.335 1052 1HB SER 136 1HB SER 136 21.357 3.040 -2.661 1053 2HB SER 136 2HB SER 136 22.974 3.581 -2.213 1054 HG SER 136 HG SER 136 22.675 1.116 -1.304 1055 H SER 137 H SER 137 21.573 2.931 1.976 1056 HA SER 137 HA SER 137 24.423 2.997 2.459 1057 1HB SER 137 1HB SER 137 22.088 2.711 4.367 1058 2HB SER 137 2HB SER 137 23.771 2.907 4.854 1059 HG SER 137 HG SER 137 23.625 4.966 4.464 No H/Q in entry = 1059 Start of MODEL 5 1 H1 PHE 1 H1 PHE 1 -22.817 9.248 0.352 2 H2 PHE 1 H2 PHE 1 -22.622 10.849 0.864 3 H3 PHE 1 H3 PHE 1 -21.376 9.729 1.095 4 HA PHE 1 HA PHE 1 -22.512 10.136 3.160 5 1HB PHE 1 1HB PHE 1 -24.941 9.133 1.655 6 2HB PHE 1 2HB PHE 1 -24.882 9.449 3.386 7 HD1 PHE 1 HD1 PHE 1 -24.865 10.972 0.050 8 HD2 PHE 1 HD2 PHE 1 -24.951 11.683 4.245 9 HE1 PHE 1 HE1 PHE 1 -25.496 13.314 -0.364 10 HE2 PHE 1 HE2 PHE 1 -25.582 14.026 3.838 11 HZ PHE 1 HZ PHE 1 -25.834 14.851 1.535 12 H ASN 2 H ASN 2 -23.956 8.100 4.293 13 HA ASN 2 HA ASN 2 -22.058 6.035 4.455 14 1HB ASN 2 1HB ASN 2 -23.683 6.605 6.253 15 2HB ASN 2 2HB ASN 2 -24.976 5.914 5.262 16 1HD2 ASN 2 1HD2 ASN 2 -25.470 4.353 6.781 17 2HD2 ASN 2 2HD2 ASN 2 -24.443 2.998 7.090 18 H LYS 3 H LYS 3 -24.995 6.342 2.533 19 HA LYS 3 HA LYS 3 -25.260 3.709 1.681 20 1HB LYS 3 1HB LYS 3 -26.892 5.480 1.151 21 2HB LYS 3 2HB LYS 3 -25.726 6.232 0.071 22 1HG LYS 3 1HG LYS 3 -27.364 4.974 -1.188 23 2HG LYS 3 2HG LYS 3 -25.766 4.246 -1.356 24 1HD LYS 3 1HD LYS 3 -27.397 2.499 -1.043 25 2HD LYS 3 2HD LYS 3 -26.383 2.600 0.396 26 1HE LYS 3 1HE LYS 3 -28.712 2.323 1.020 27 2HE LYS 3 2HE LYS 3 -28.126 3.907 1.522 28 1HZ LYS 3 1HZ LYS 3 -29.197 4.874 -0.420 29 2HZ LYS 3 2HZ LYS 3 -29.758 3.353 -0.898 30 3HZ LYS 3 3HZ LYS 3 -30.323 4.050 0.536 31 H LYS 4 H LYS 4 -23.121 6.273 0.612 32 HA LYS 4 HA LYS 4 -21.979 4.721 -1.530 33 1HB LYS 4 1HB LYS 4 -22.092 7.145 -1.740 34 2HB LYS 4 2HB LYS 4 -21.130 7.343 -0.283 35 1HG LYS 4 1HG LYS 4 -19.767 7.726 -2.232 36 2HG LYS 4 2HG LYS 4 -19.233 6.261 -1.408 37 1HD LYS 4 1HD LYS 4 -20.542 4.923 -3.028 38 2HD LYS 4 2HD LYS 4 -20.960 6.413 -3.877 39 1HE LYS 4 1HE LYS 4 -18.171 5.340 -3.452 40 2HE LYS 4 2HE LYS 4 -19.088 5.260 -4.957 41 1HZ LYS 4 1HZ LYS 4 -19.106 7.679 -5.023 42 2HZ LYS 4 2HZ LYS 4 -18.220 7.748 -3.585 43 3HZ LYS 4 3HZ LYS 4 -17.521 7.091 -4.979 44 H ALA 5 H ALA 5 -21.209 5.515 1.799 45 HA ALA 5 HA ALA 5 -18.556 4.652 1.888 46 1HB ALA 5 1HB ALA 5 -19.361 5.840 3.758 47 2HB ALA 5 2HB ALA 5 -19.060 4.201 4.339 48 3HB ALA 5 3HB ALA 5 -20.708 4.724 3.988 49 H ASP 6 H ASP 6 -21.541 2.862 2.633 50 HA ASP 6 HA ASP 6 -20.271 0.368 2.987 51 1HB ASP 6 1HB ASP 6 -23.131 0.961 2.183 52 2HB ASP 6 2HB ASP 6 -22.536 -0.602 2.735 53 H GLU 7 H GLU 7 -21.604 2.008 0.168 54 HA GLU 7 HA GLU 7 -21.535 -0.098 -1.656 55 1HB GLU 7 1HB GLU 7 -22.491 2.123 -2.167 56 2HB GLU 7 2HB GLU 7 -20.875 2.816 -2.162 57 1HG GLU 7 1HG GLU 7 -20.270 1.403 -4.066 58 2HG GLU 7 2HG GLU 7 -21.899 0.730 -4.076 59 H ASN 8 H ASN 8 -19.023 1.917 -0.330 60 HA ASN 8 HA ASN 8 -16.954 1.074 -2.087 61 1HB ASN 8 1HB ASN 8 -16.711 2.245 0.697 62 2HB ASN 8 2HB ASN 8 -15.428 2.171 -0.539 63 1HD2 ASN 8 1HD2 ASN 8 -16.561 4.468 0.841 64 2HD2 ASN 8 2HD2 ASN 8 -17.170 5.516 -0.389 65 H LYS 9 H LYS 9 -18.130 0.031 1.058 66 HA LYS 9 HA LYS 9 -16.084 -1.718 1.768 67 1HB LYS 9 1HB LYS 9 -17.982 -1.025 3.233 68 2HB LYS 9 2HB LYS 9 -19.033 -2.093 2.316 69 1HG LYS 9 1HG LYS 9 -17.673 -4.012 2.994 70 2HG LYS 9 2HG LYS 9 -16.634 -2.936 3.929 71 1HD LYS 9 1HD LYS 9 -18.064 -3.711 5.559 72 2HD LYS 9 2HD LYS 9 -18.880 -2.228 5.063 73 1HE LYS 9 1HE LYS 9 -19.524 -5.003 4.072 74 2HE LYS 9 2HE LYS 9 -20.438 -4.114 5.289 75 1HZ LYS 9 1HZ LYS 9 -20.851 -2.395 3.586 76 2HZ LYS 9 2HZ LYS 9 -20.092 -3.373 2.434 77 3HZ LYS 9 3HZ LYS 9 -21.518 -3.896 3.183 78 H VAL 10 H VAL 10 -18.808 -2.184 -0.418 79 HA VAL 10 HA VAL 10 -18.401 -5.009 -0.701 80 HB VAL 10 HB VAL 10 -19.887 -3.243 -2.626 81 1HG1 VAL 10 1HG1 VAL 10 -20.171 -6.155 -1.882 82 2HG1 VAL 10 2HG1 VAL 10 -21.222 -5.273 -3.009 83 3HG1 VAL 10 3HG1 VAL 10 -19.504 -5.507 -3.396 84 1HG2 VAL 10 1HG2 VAL 10 -20.869 -4.433 -0.035 85 2HG2 VAL 10 2HG2 VAL 10 -20.730 -2.720 -0.428 86 3HG2 VAL 10 3HG2 VAL 10 -21.907 -3.726 -1.273 87 H LYS 11 H LYS 11 -17.818 -2.227 -2.874 88 HA LYS 11 HA LYS 11 -16.667 -3.692 -4.957 89 1HB LYS 11 1HB LYS 11 -15.686 -1.556 -5.698 90 2HB LYS 11 2HB LYS 11 -17.384 -1.398 -5.271 91 1HG LYS 11 1HG LYS 11 -16.749 -0.445 -3.110 92 2HG LYS 11 2HG LYS 11 -15.046 -0.589 -3.554 93 1HD LYS 11 1HD LYS 11 -15.788 1.679 -3.933 94 2HD LYS 11 2HD LYS 11 -15.464 0.902 -5.483 95 1HE LYS 11 1HE LYS 11 -17.819 0.537 -5.841 96 2HE LYS 11 2HE LYS 11 -18.197 1.157 -4.235 97 1HZ LYS 11 1HZ LYS 11 -16.954 2.739 -6.421 98 2HZ LYS 11 2HZ LYS 11 -18.590 2.794 -5.995 99 3HZ LYS 11 3HZ LYS 11 -17.414 3.323 -4.900 100 H GLY 12 H GLY 12 -15.264 -2.466 -1.987 101 1HA GLY 12 1HA GLY 12 -13.103 -2.564 -1.163 102 2HA GLY 12 2HA GLY 12 -12.547 -2.945 -2.786 103 H GLU 13 H GLU 13 -14.729 -4.563 -0.468 104 HA GLU 13 HA GLU 13 -12.985 -6.671 0.146 105 1HB GLU 13 1HB GLU 13 -15.990 -6.455 0.278 106 2HB GLU 13 2HB GLU 13 -15.118 -7.875 0.837 107 1HG GLU 13 1HG GLU 13 -14.686 -5.083 1.875 108 2HG GLU 13 2HG GLU 13 -15.708 -6.298 2.641 109 H ALA 14 H ALA 14 -15.198 -6.190 -2.511 110 HA ALA 14 HA ALA 14 -15.107 -8.924 -3.405 111 1HB ALA 14 1HB ALA 14 -17.041 -7.527 -3.906 112 2HB ALA 14 2HB ALA 14 -16.278 -8.096 -5.392 113 3HB ALA 14 3HB ALA 14 -16.025 -6.437 -4.849 114 H PHE 15 H PHE 15 -13.347 -5.973 -4.033 115 HA PHE 15 HA PHE 15 -12.018 -6.784 -6.379 116 1HB PHE 15 1HB PHE 15 -11.730 -4.538 -6.104 117 2HB PHE 15 2HB PHE 15 -11.676 -4.660 -4.334 118 HD1 PHE 15 HD1 PHE 15 -9.691 -4.224 -3.295 119 HD2 PHE 15 HD2 PHE 15 -9.628 -5.614 -7.317 120 HE1 PHE 15 HE1 PHE 15 -7.241 -3.943 -3.349 121 HE2 PHE 15 HE2 PHE 15 -7.180 -5.357 -7.371 122 HZ PHE 15 HZ PHE 15 -5.984 -4.519 -5.384 123 H LEU 16 H LEU 16 -10.911 -6.802 -2.983 124 HA LEU 16 HA LEU 16 -8.497 -8.151 -3.554 125 1HB LEU 16 1HB LEU 16 -8.656 -8.722 -1.024 126 2HB LEU 16 2HB LEU 16 -8.363 -7.082 -1.562 127 HG LEU 16 HG LEU 16 -11.007 -6.931 -1.392 128 1HD1 LEU 16 1HD1 LEU 16 -11.266 -9.302 -0.794 129 2HD1 LEU 16 2HD1 LEU 16 -10.311 -9.026 0.664 130 3HD1 LEU 16 3HD1 LEU 16 -11.869 -8.225 0.465 131 1HD2 LEU 16 1HD2 LEU 16 -9.143 -6.802 0.978 132 2HD2 LEU 16 2HD2 LEU 16 -9.429 -5.515 -0.192 133 3HD2 LEU 16 3HD2 LEU 16 -10.731 -6.041 0.874 134 H THR 17 H THR 17 -11.730 -9.278 -2.817 135 HA THR 17 HA THR 17 -11.167 -11.940 -2.187 136 HB THR 17 HB THR 17 -13.552 -10.672 -3.540 137 HG1 THR 17 HG1 THR 17 -13.522 -11.999 -1.050 138 1HG2 THR 17 1HG2 THR 17 -13.122 -13.577 -2.827 139 2HG2 THR 17 2HG2 THR 17 -14.723 -12.859 -3.090 140 3HG2 THR 17 3HG2 THR 17 -13.541 -12.898 -4.412 141 H GLU 18 H GLU 18 -11.791 -10.425 -5.332 142 HA GLU 18 HA GLU 18 -11.251 -12.816 -6.813 143 1HB GLU 18 1HB GLU 18 -12.724 -11.048 -7.690 144 2HB GLU 18 2HB GLU 18 -11.364 -9.935 -7.736 145 1HG GLU 18 1HG GLU 18 -10.258 -11.347 -9.389 146 2HG GLU 18 2HG GLU 18 -11.612 -12.474 -9.337 147 H ASN 19 H ASN 19 -9.430 -10.080 -5.692 148 HA ASN 19 HA ASN 19 -7.163 -10.204 -7.297 149 1HB ASN 19 1HB ASN 19 -7.129 -8.320 -6.001 150 2HB ASN 19 2HB ASN 19 -7.793 -9.143 -4.592 151 1HD2 ASN 19 1HD2 ASN 19 -6.393 -10.488 -3.357 152 2HD2 ASN 19 2HD2 ASN 19 -4.695 -10.186 -3.323 153 H LYS 20 H LYS 20 -8.120 -12.240 -4.636 154 HA LYS 20 HA LYS 20 -5.763 -13.294 -3.735 155 1HB LYS 20 1HB LYS 20 -6.981 -15.180 -2.986 156 2HB LYS 20 2HB LYS 20 -8.092 -13.820 -2.937 157 1HG LYS 20 1HG LYS 20 -8.919 -14.604 -5.204 158 2HG LYS 20 2HG LYS 20 -8.012 -16.088 -4.900 159 1HD LYS 20 1HD LYS 20 -10.238 -14.952 -3.210 160 2HD LYS 20 2HD LYS 20 -10.326 -16.380 -4.241 161 1HE LYS 20 1HE LYS 20 -8.548 -16.056 -1.824 162 2HE LYS 20 2HE LYS 20 -10.054 -16.973 -1.874 163 1HZ LYS 20 1HZ LYS 20 -9.062 -18.432 -3.530 164 2HZ LYS 20 2HZ LYS 20 -7.618 -17.555 -3.471 165 3HZ LYS 20 3HZ LYS 20 -8.138 -18.417 -2.113 166 H ASN 21 H ASN 21 -7.008 -13.607 -6.905 167 HA ASN 21 HA ASN 21 -5.890 -16.108 -7.603 168 1HB ASN 21 1HB ASN 21 -6.695 -13.738 -9.289 169 2HB ASN 21 2HB ASN 21 -6.168 -15.279 -9.963 170 1HD2 ASN 21 1HD2 ASN 21 -8.063 -14.859 -7.049 171 2HD2 ASN 21 2HD2 ASN 21 -9.492 -15.619 -7.647 172 H LYS 22 H LYS 22 -4.594 -12.840 -7.582 173 HA LYS 22 HA LYS 22 -2.358 -13.130 -9.189 174 1HB LYS 22 1HB LYS 22 -2.666 -11.534 -6.645 175 2HB LYS 22 2HB LYS 22 -1.341 -11.346 -7.786 176 1HG LYS 22 1HG LYS 22 -2.868 -10.628 -9.509 177 2HG LYS 22 2HG LYS 22 -4.247 -10.930 -8.452 178 1HD LYS 22 1HD LYS 22 -3.435 -9.218 -6.906 179 2HD LYS 22 2HD LYS 22 -2.054 -8.916 -7.962 180 1HE LYS 22 1HE LYS 22 -4.954 -8.540 -8.701 181 2HE LYS 22 2HE LYS 22 -3.828 -7.252 -8.277 182 1HZ LYS 22 1HZ LYS 22 -3.565 -9.083 -10.603 183 2HZ LYS 22 2HZ LYS 22 -4.067 -7.469 -10.669 184 3HZ LYS 22 3HZ LYS 22 -2.486 -7.845 -10.197 185 HA PRO 23 HA PRO 23 -0.148 -16.390 -7.019 186 1HB PRO 23 1HB PRO 23 2.084 -15.378 -8.703 187 2HB PRO 23 2HB PRO 23 1.468 -17.026 -8.518 188 1HG PRO 23 1HG PRO 23 0.958 -15.622 -10.723 189 2HG PRO 23 2HG PRO 23 -0.272 -16.686 -10.012 190 1HD PRO 23 1HD PRO 23 -0.040 -13.707 -9.893 191 2HD PRO 23 2HD PRO 23 -1.490 -14.722 -10.051 192 H GLY 24 H GLY 24 1.261 -16.459 -5.308 193 1HA GLY 24 1HA GLY 24 3.046 -14.224 -4.801 194 2HA GLY 24 2HA GLY 24 2.966 -15.721 -3.891 195 H VAL 25 H VAL 25 -0.170 -14.755 -4.069 196 HA VAL 25 HA VAL 25 -0.336 -12.585 -2.308 197 HB VAL 25 HB VAL 25 -2.266 -14.813 -2.908 198 1HG1 VAL 25 1HG1 VAL 25 -2.619 -12.564 -0.931 199 2HG1 VAL 25 2HG1 VAL 25 -3.958 -13.493 -1.609 200 3HG1 VAL 25 3HG1 VAL 25 -2.737 -14.299 -0.621 201 1HG2 VAL 25 1HG2 VAL 25 -1.694 -12.765 -4.430 202 2HG2 VAL 25 2HG2 VAL 25 -3.370 -13.281 -4.224 203 3HG2 VAL 25 3HG2 VAL 25 -2.753 -11.899 -3.316 204 H VAL 26 H VAL 26 0.603 -12.489 -0.396 205 HA VAL 26 HA VAL 26 0.225 -14.732 1.468 206 HB VAL 26 HB VAL 26 2.539 -14.769 0.644 207 1HG1 VAL 26 1HG1 VAL 26 2.622 -12.288 0.208 208 2HG1 VAL 26 2HG1 VAL 26 2.918 -12.083 1.936 209 3HG1 VAL 26 3HG1 VAL 26 4.063 -12.992 0.947 210 1HG2 VAL 26 1HG2 VAL 26 2.292 -13.876 3.516 211 2HG2 VAL 26 2HG2 VAL 26 2.085 -15.525 2.912 212 3HG2 VAL 26 3HG2 VAL 26 3.668 -14.742 2.822 213 H VAL 27 H VAL 27 -0.634 -14.163 3.360 214 HA VAL 27 HA VAL 27 -1.158 -11.375 3.894 215 HB VAL 27 HB VAL 27 -2.907 -13.039 4.312 216 1HG1 VAL 27 1HG1 VAL 27 -1.511 -14.923 4.952 217 2HG1 VAL 27 2HG1 VAL 27 -1.054 -14.100 6.442 218 3HG1 VAL 27 3HG1 VAL 27 -2.725 -14.603 6.190 219 1HG2 VAL 27 1HG2 VAL 27 -2.927 -10.965 5.597 220 2HG2 VAL 27 2HG2 VAL 27 -3.562 -12.304 6.554 221 3HG2 VAL 27 3HG2 VAL 27 -1.924 -11.715 6.840 222 H LEU 28 H LEU 28 -0.256 -10.120 5.447 223 HA LEU 28 HA LEU 28 2.133 -11.166 6.763 224 1HB LEU 28 1HB LEU 28 1.112 -8.349 6.390 225 2HB LEU 28 2HB LEU 28 2.576 -8.750 7.265 226 HG LEU 28 HG LEU 28 2.063 -9.151 4.321 227 1HD1 LEU 28 1HD1 LEU 28 3.888 -7.333 5.878 228 2HD1 LEU 28 2HD1 LEU 28 3.997 -7.587 4.135 229 3HD1 LEU 28 3HD1 LEU 28 2.544 -6.871 4.832 230 1HD2 LEU 28 1HD2 LEU 28 4.422 -9.961 6.018 231 2HD2 LEU 28 2HD2 LEU 28 3.364 -11.021 5.087 232 3HD2 LEU 28 3HD2 LEU 28 4.441 -9.898 4.257 233 HA PRO 29 HA PRO 29 0.646 -11.228 10.926 234 1HB PRO 29 1HB PRO 29 2.478 -8.980 11.624 235 2HB PRO 29 2HB PRO 29 2.292 -10.560 12.395 236 1HG PRO 29 1HG PRO 29 4.387 -10.051 10.833 237 2HG PRO 29 2HG PRO 29 3.593 -11.636 10.805 238 1HD PRO 29 1HD PRO 29 3.436 -9.397 8.835 239 2HD PRO 29 2HD PRO 29 3.418 -11.159 8.558 240 H SER 30 H SER 30 1.023 -8.064 9.426 241 HA SER 30 HA SER 30 -0.950 -6.852 11.163 242 1HB SER 30 1HB SER 30 0.850 -5.416 10.515 243 2HB SER 30 2HB SER 30 0.618 -5.789 8.808 244 HG SER 30 HG SER 30 -0.996 -4.417 8.719 245 H GLY 31 H GLY 31 -1.011 -8.712 8.346 246 1HA GLY 31 1HA GLY 31 -3.809 -7.922 7.945 247 2HA GLY 31 2HA GLY 31 -3.141 -9.494 7.547 248 H LEU 32 H LEU 32 -0.797 -7.752 6.305 249 HA LEU 32 HA LEU 32 -2.188 -6.661 4.006 250 1HB LEU 32 1HB LEU 32 0.738 -6.782 4.685 251 2HB LEU 32 2HB LEU 32 0.101 -6.064 3.216 252 HG LEU 32 HG LEU 32 -1.347 -4.663 4.915 253 1HD1 LEU 32 1HD1 LEU 32 -0.395 -6.007 6.829 254 2HD1 LEU 32 2HD1 LEU 32 1.121 -5.147 6.553 255 3HD1 LEU 32 3HD1 LEU 32 -0.336 -4.256 6.992 256 1HD2 LEU 32 1HD2 LEU 32 0.398 -3.900 3.254 257 2HD2 LEU 32 2HD2 LEU 32 0.197 -2.893 4.687 258 3HD2 LEU 32 3HD2 LEU 32 1.563 -4.000 4.574 259 H GLN 33 H GLN 33 -2.299 -7.442 2.032 260 HA GLN 33 HA GLN 33 -0.940 -9.987 1.431 261 1HB GLN 33 1HB GLN 33 -3.627 -9.004 0.441 262 2HB GLN 33 2HB GLN 33 -2.845 -10.492 -0.070 263 1HG GLN 33 1HG GLN 33 -2.986 -11.377 2.187 264 2HG GLN 33 2HG GLN 33 -3.731 -9.852 2.742 265 1HE2 GLN 33 1HE2 GLN 33 -4.759 -12.587 2.821 266 2HE2 GLN 33 2HE2 GLN 33 -6.256 -12.560 1.960 267 H TYR 34 H TYR 34 0.127 -10.106 -0.551 268 HA TYR 34 HA TYR 34 -0.178 -7.952 -2.461 269 1HB TYR 34 1HB TYR 34 2.242 -7.341 -2.381 270 2HB TYR 34 2HB TYR 34 1.330 -6.876 -0.951 271 HD1 TYR 34 HD1 TYR 34 3.859 -9.206 -2.275 272 HD2 TYR 34 HD2 TYR 34 1.800 -7.852 1.194 273 HE1 TYR 34 HE1 TYR 34 5.472 -10.389 -0.860 274 HE2 TYR 34 HE2 TYR 34 3.409 -9.029 2.612 275 HH TYR 34 HH TYR 34 6.337 -10.262 1.454 276 H LYS 35 H LYS 35 1.585 -8.128 -4.205 277 HA LYS 35 HA LYS 35 2.036 -10.982 -4.831 278 1HB LYS 35 1HB LYS 35 0.293 -9.883 -6.245 279 2HB LYS 35 2HB LYS 35 1.507 -8.732 -6.787 280 1HG LYS 35 1HG LYS 35 2.771 -11.005 -7.411 281 2HG LYS 35 2HG LYS 35 1.095 -11.560 -7.537 282 1HD LYS 35 1HD LYS 35 2.206 -9.121 -8.926 283 2HD LYS 35 2HD LYS 35 2.022 -10.707 -9.678 284 1HE LYS 35 1HE LYS 35 -0.390 -10.616 -9.281 285 2HE LYS 35 2HE LYS 35 -0.209 -9.038 -8.514 286 1HZ LYS 35 1HZ LYS 35 0.638 -8.172 -10.618 287 2HZ LYS 35 2HZ LYS 35 0.409 -9.681 -11.347 288 3HZ LYS 35 3HZ LYS 35 -0.924 -8.797 -10.793 289 H VAL 36 H VAL 36 4.109 -11.480 -4.834 290 HA VAL 36 HA VAL 36 6.166 -9.505 -4.736 291 HB VAL 36 HB VAL 36 6.420 -12.500 -4.986 292 1HG1 VAL 36 1HG1 VAL 36 8.395 -10.351 -4.252 293 2HG1 VAL 36 2HG1 VAL 36 8.652 -12.061 -3.909 294 3HG1 VAL 36 3HG1 VAL 36 8.494 -11.509 -5.577 295 1HG2 VAL 36 1HG2 VAL 36 6.231 -10.693 -2.586 296 2HG2 VAL 36 2HG2 VAL 36 5.172 -12.035 -3.019 297 3HG2 VAL 36 3HG2 VAL 36 6.832 -12.349 -2.507 298 H ILE 37 H ILE 37 7.261 -8.620 -6.305 299 HA ILE 37 HA ILE 37 7.264 -9.864 -8.971 300 HB ILE 37 HB ILE 37 7.931 -7.001 -8.257 301 1HG1 ILE 37 1HG1 ILE 37 5.391 -8.110 -9.478 302 2HG1 ILE 37 2HG1 ILE 37 5.552 -7.587 -7.805 303 1HG2 ILE 37 1HG2 ILE 37 8.989 -7.815 -10.308 304 2HG2 ILE 37 2HG2 ILE 37 7.413 -8.310 -10.925 305 3HG2 ILE 37 3HG2 ILE 37 7.758 -6.602 -10.657 306 1HD1 ILE 37 1HD1 ILE 37 6.050 -5.316 -8.579 307 2HD1 ILE 37 2HD1 ILE 37 5.843 -5.852 -10.247 308 3HD1 ILE 37 3HD1 ILE 37 4.475 -5.882 -9.133 309 H ASN 38 H ASN 38 9.434 -7.687 -7.148 310 HA ASN 38 HA ASN 38 11.660 -9.533 -7.660 311 1HB ASN 38 1HB ASN 38 12.126 -7.966 -9.313 312 2HB ASN 38 2HB ASN 38 11.442 -6.634 -8.392 313 1HD2 ASN 38 1HD2 ASN 38 13.727 -8.908 -7.035 314 2HD2 ASN 38 2HD2 ASN 38 15.038 -7.793 -6.895 315 H SER 39 H SER 39 11.425 -10.191 -5.467 316 HA SER 39 HA SER 39 12.023 -8.127 -3.459 317 1HB SER 39 1HB SER 39 9.964 -9.368 -3.052 318 2HB SER 39 2HB SER 39 10.849 -10.891 -3.101 319 HG SER 39 HG SER 39 11.813 -10.406 -1.203 320 H GLY 40 H GLY 40 13.668 -8.343 -1.992 321 1HA GLY 40 1HA GLY 40 15.281 -10.725 -1.862 322 2HA GLY 40 2HA GLY 40 15.533 -9.243 -0.957 323 H ASN 41 H ASN 41 17.188 -7.978 -1.503 324 HA ASN 41 HA ASN 41 19.112 -8.833 -3.336 325 1HB ASN 41 1HB ASN 41 18.971 -7.025 -5.034 326 2HB ASN 41 2HB ASN 41 17.614 -8.143 -5.094 327 1HD2 ASN 41 1HD2 ASN 41 15.591 -7.456 -4.255 328 2HD2 ASN 41 2HD2 ASN 41 15.202 -5.774 -4.171 329 H GLY 42 H GLY 42 17.868 -5.617 -2.320 330 1HA GLY 42 1HA GLY 42 19.189 -3.787 -1.641 331 2HA GLY 42 2HA GLY 42 20.586 -4.849 -1.600 332 H VAL 43 H VAL 43 20.893 -3.543 0.379 333 HA VAL 43 HA VAL 43 19.945 -5.027 2.700 334 HB VAL 43 HB VAL 43 22.375 -4.499 2.345 335 1HG1 VAL 43 1HG1 VAL 43 22.151 -2.242 1.489 336 2HG1 VAL 43 2HG1 VAL 43 21.514 -1.706 3.044 337 3HG1 VAL 43 3HG1 VAL 43 23.181 -2.267 2.921 338 1HG2 VAL 43 1HG2 VAL 43 21.235 -4.998 4.585 339 2HG2 VAL 43 2HG2 VAL 43 22.857 -4.307 4.606 340 3HG2 VAL 43 3HG2 VAL 43 21.459 -3.278 4.912 341 H LYS 44 H LYS 44 19.746 -3.463 4.732 342 HA LYS 44 HA LYS 44 18.822 -0.897 4.682 343 1HB LYS 44 1HB LYS 44 16.408 -1.017 4.484 344 2HB LYS 44 2HB LYS 44 17.153 -1.625 3.016 345 1HG LYS 44 1HG LYS 44 16.619 -3.850 3.530 346 2HG LYS 44 2HG LYS 44 16.262 -3.459 5.215 347 1HD LYS 44 1HD LYS 44 14.681 -2.418 2.869 348 2HD LYS 44 2HD LYS 44 14.246 -3.859 3.790 349 1HE LYS 44 1HE LYS 44 14.091 -2.503 5.825 350 2HE LYS 44 2HE LYS 44 14.524 -1.066 4.900 351 1HZ LYS 44 1HZ LYS 44 12.516 -1.357 3.585 352 2HZ LYS 44 2HZ LYS 44 12.100 -2.731 4.479 353 3HZ LYS 44 3HZ LYS 44 12.140 -1.216 5.229 354 HA PRO 45 HA PRO 45 18.036 -1.790 8.954 355 1HB PRO 45 1HB PRO 45 16.812 0.741 9.377 356 2HB PRO 45 2HB PRO 45 18.503 0.307 9.626 357 1HG PRO 45 1HG PRO 45 17.557 2.069 7.698 358 2HG PRO 45 2HG PRO 45 19.144 1.283 7.686 359 1HD PRO 45 1HD PRO 45 16.664 0.568 6.192 360 2HD PRO 45 2HD PRO 45 18.359 0.460 5.687 361 H GLY 46 H GLY 46 16.327 -1.504 10.654 362 1HA GLY 46 1HA GLY 46 14.288 -2.192 11.455 363 2HA GLY 46 2HA GLY 46 13.942 -2.821 9.847 364 H LYS 47 H LYS 47 11.865 -1.734 11.165 365 HA LYS 47 HA LYS 47 10.663 -0.029 9.453 366 1HB LYS 47 1HB LYS 47 10.308 -0.105 12.448 367 2HB LYS 47 2HB LYS 47 9.193 0.677 11.336 368 1HG LYS 47 1HG LYS 47 8.743 -1.467 10.265 369 2HG LYS 47 2HG LYS 47 9.875 -2.255 11.367 370 1HD LYS 47 1HD LYS 47 8.486 -1.571 13.271 371 2HD LYS 47 2HD LYS 47 7.351 -0.802 12.160 372 1HE LYS 47 1HE LYS 47 6.909 -2.971 11.114 373 2HE LYS 47 2HE LYS 47 8.045 -3.738 12.222 374 1HZ LYS 47 1HZ LYS 47 6.628 -3.048 14.069 375 2HZ LYS 47 2HZ LYS 47 5.527 -2.360 12.986 376 3HZ LYS 47 3HZ LYS 47 5.787 -4.032 12.981 377 H SER 48 H SER 48 13.277 0.924 11.450 378 HA SER 48 HA SER 48 12.544 3.732 11.477 379 1HB SER 48 1HB SER 48 14.718 4.067 12.587 380 2HB SER 48 2HB SER 48 13.787 2.797 13.381 381 HG SER 48 HG SER 48 16.031 2.550 11.687 382 H ASP 49 H ASP 49 13.367 1.834 9.090 383 HA ASP 49 HA ASP 49 15.582 3.168 7.858 384 1HB ASP 49 1HB ASP 49 15.163 1.706 5.986 385 2HB ASP 49 2HB ASP 49 15.011 0.779 7.475 386 H THR 50 H THR 50 15.587 4.660 6.228 387 HA THR 50 HA THR 50 12.982 5.876 5.525 388 HB THR 50 HB THR 50 15.721 7.191 5.555 389 HG1 THR 50 HG1 THR 50 13.998 8.317 7.250 390 1HG2 THR 50 1HG2 THR 50 14.189 8.129 3.876 391 2HG2 THR 50 2HG2 THR 50 12.974 8.378 5.130 392 3HG2 THR 50 3HG2 THR 50 14.494 9.271 5.186 393 H VAL 51 H VAL 51 12.424 5.504 3.443 394 HA VAL 51 HA VAL 51 14.607 5.051 1.514 395 HB VAL 51 HB VAL 51 13.283 3.397 0.373 396 1HG1 VAL 51 1HG1 VAL 51 13.436 2.914 3.344 397 2HG1 VAL 51 2HG1 VAL 51 13.162 1.655 2.137 398 3HG1 VAL 51 3HG1 VAL 51 14.675 2.562 2.138 399 1HG2 VAL 51 1HG2 VAL 51 11.067 4.333 0.772 400 2HG2 VAL 51 2HG2 VAL 51 11.124 2.631 1.245 401 3HG2 VAL 51 3HG2 VAL 51 11.178 3.893 2.479 402 H THR 52 H THR 52 14.239 5.576 -0.647 403 HA THR 52 HA THR 52 12.111 7.570 -1.097 404 HB THR 52 HB THR 52 14.820 7.358 -2.445 405 HG1 THR 52 HG1 THR 52 14.737 9.630 -1.303 406 1HG2 THR 52 1HG2 THR 52 13.065 8.226 -3.933 407 2HG2 THR 52 2HG2 THR 52 12.660 9.452 -2.731 408 3HG2 THR 52 3HG2 THR 52 14.239 9.474 -3.515 409 H VAL 53 H VAL 53 10.586 6.896 -2.477 410 HA VAL 53 HA VAL 53 11.340 5.108 -4.664 411 HB VAL 53 HB VAL 53 9.644 3.510 -4.228 412 1HG1 VAL 53 1HG1 VAL 53 11.687 3.203 -2.931 413 2HG1 VAL 53 2HG1 VAL 53 10.992 4.163 -1.607 414 3HG1 VAL 53 3HG1 VAL 53 10.264 2.604 -2.050 415 1HG2 VAL 53 1HG2 VAL 53 8.715 5.340 -2.017 416 2HG2 VAL 53 2HG2 VAL 53 7.852 4.949 -3.506 417 3HG2 VAL 53 3HG2 VAL 53 8.110 3.704 -2.282 418 H GLU 54 H GLU 54 9.208 4.606 -5.947 419 HA GLU 54 HA GLU 54 7.632 7.076 -6.240 420 1HB GLU 54 1HB GLU 54 9.077 5.480 -8.341 421 2HB GLU 54 2HB GLU 54 7.652 6.418 -8.758 422 1HG GLU 54 1HG GLU 54 8.705 8.452 -8.104 423 2HG GLU 54 2HG GLU 54 10.080 7.583 -7.423 424 H TYR 55 H TYR 55 5.439 6.732 -6.406 425 HA TYR 55 HA TYR 55 4.526 4.077 -7.172 426 1HB TYR 55 1HB TYR 55 3.353 3.566 -5.222 427 2HB TYR 55 2HB TYR 55 4.878 4.199 -4.628 428 HD1 TYR 55 HD1 TYR 55 4.898 6.735 -4.010 429 HD2 TYR 55 HD2 TYR 55 1.346 4.413 -4.389 430 HE1 TYR 55 HE1 TYR 55 3.688 8.371 -2.631 431 HE2 TYR 55 HE2 TYR 55 0.120 6.050 -3.013 432 HH TYR 55 HH TYR 55 0.667 7.765 -1.280 433 H THR 56 H THR 56 2.262 3.913 -7.462 434 HA THR 56 HA THR 56 0.894 6.467 -7.976 435 HB THR 56 HB THR 56 0.767 4.011 -9.749 436 HG1 THR 56 HG1 THR 56 1.691 6.422 -10.761 437 1HG2 THR 56 1HG2 THR 56 -1.333 5.264 -9.692 438 2HG2 THR 56 2HG2 THR 56 -0.465 6.750 -10.072 439 3HG2 THR 56 3HG2 THR 56 -0.537 5.445 -11.255 440 H GLY 57 H GLY 57 -0.774 6.535 -6.601 441 1HA GLY 57 1HA GLY 57 -1.998 5.385 -4.839 442 2HA GLY 57 2HA GLY 57 -2.035 3.968 -5.876 443 H ARG 58 H ARG 58 -4.215 3.732 -5.819 444 HA ARG 58 HA ARG 58 -5.905 5.944 -6.642 445 1HB ARG 58 1HB ARG 58 -6.942 4.668 -8.470 446 2HB ARG 58 2HB ARG 58 -5.231 4.970 -8.775 447 1HG ARG 58 1HG ARG 58 -5.306 2.790 -9.369 448 2HG ARG 58 2HG ARG 58 -5.010 2.575 -7.640 449 1HD ARG 58 1HD ARG 58 -7.337 2.190 -7.226 450 2HD ARG 58 2HD ARG 58 -7.754 2.620 -8.884 451 HE ARG 58 HE ARG 58 -5.970 0.349 -8.523 452 1HH1 ARG 58 1HH1 ARG 58 -9.197 1.515 -9.133 453 2HH1 ARG 58 2HH1 ARG 58 -9.756 0.010 -9.785 454 1HH2 ARG 58 1HH2 ARG 58 -6.697 -1.636 -9.381 455 2HH2 ARG 58 2HH2 ARG 58 -8.336 -1.780 -9.924 456 H LEU 59 H LEU 59 -8.067 5.673 -6.085 457 HA LEU 59 HA LEU 59 -8.525 3.845 -3.918 458 1HB LEU 59 1HB LEU 59 -10.483 5.671 -5.317 459 2HB LEU 59 2HB LEU 59 -10.713 4.905 -3.758 460 HG LEU 59 HG LEU 59 -8.492 6.874 -4.253 461 1HD1 LEU 59 1HD1 LEU 59 -10.622 7.963 -4.772 462 2HD1 LEU 59 2HD1 LEU 59 -11.260 7.452 -3.210 463 3HD1 LEU 59 3HD1 LEU 59 -9.915 8.591 -3.284 464 1HD2 LEU 59 1HD2 LEU 59 -9.871 5.912 -1.750 465 2HD2 LEU 59 2HD2 LEU 59 -8.264 5.440 -2.297 466 3HD2 LEU 59 3HD2 LEU 59 -8.577 7.109 -1.821 467 H ILE 60 H ILE 60 -10.446 2.413 -3.846 468 HA ILE 60 HA ILE 60 -10.461 0.584 -5.966 469 HB ILE 60 HB ILE 60 -11.160 -0.048 -3.709 470 1HG1 ILE 60 1HG1 ILE 60 -13.133 -1.395 -4.279 471 2HG1 ILE 60 2HG1 ILE 60 -13.415 -0.397 -5.701 472 1HG2 ILE 60 1HG2 ILE 60 -13.531 1.733 -4.230 473 2HG2 ILE 60 2HG2 ILE 60 -13.410 0.595 -2.886 474 3HG2 ILE 60 3HG2 ILE 60 -12.280 1.948 -3.003 475 1HD1 ILE 60 1HD1 ILE 60 -11.007 -2.143 -5.228 476 2HD1 ILE 60 2HD1 ILE 60 -12.378 -2.524 -6.274 477 3HD1 ILE 60 3HD1 ILE 60 -11.318 -1.168 -6.667 478 H ASP 61 H ASP 61 -11.798 3.631 -5.727 479 HA ASP 61 HA ASP 61 -14.194 3.315 -7.221 480 1HB ASP 61 1HB ASP 61 -12.430 5.744 -6.839 481 2HB ASP 61 2HB ASP 61 -14.038 5.775 -7.554 482 H GLY 62 H GLY 62 -10.943 3.086 -8.106 483 1HA GLY 62 1HA GLY 62 -11.699 2.991 -10.917 484 2HA GLY 62 2HA GLY 62 -10.194 2.411 -10.226 485 H THR 63 H THR 63 -10.630 5.422 -8.948 486 HA THR 63 HA THR 63 -9.247 6.723 -11.197 487 HB THR 63 HB THR 63 -10.113 8.868 -10.318 488 HG1 THR 63 HG1 THR 63 -10.650 7.491 -8.183 489 1HG2 THR 63 1HG2 THR 63 -12.217 6.798 -10.957 490 2HG2 THR 63 2HG2 THR 63 -12.461 8.544 -11.018 491 3HG2 THR 63 3HG2 THR 63 -11.317 7.775 -12.120 492 H VAL 64 H VAL 64 -7.314 7.632 -10.831 493 HA VAL 64 HA VAL 64 -5.848 7.040 -8.519 494 HB VAL 64 HB VAL 64 -4.729 7.391 -10.643 495 1HG1 VAL 64 1HG1 VAL 64 -6.240 9.069 -11.573 496 2HG1 VAL 64 2HG1 VAL 64 -5.618 10.264 -10.435 497 3HG1 VAL 64 3HG1 VAL 64 -4.559 9.592 -11.675 498 1HG2 VAL 64 1HG2 VAL 64 -3.983 9.459 -8.580 499 2HG2 VAL 64 2HG2 VAL 64 -3.389 7.802 -8.691 500 3HG2 VAL 64 3HG2 VAL 64 -2.961 8.977 -9.934 501 H PHE 65 H PHE 65 -5.588 8.104 -6.662 502 HA PHE 65 HA PHE 65 -7.056 10.604 -6.328 503 1HB PHE 65 1HB PHE 65 -6.861 10.187 -3.901 504 2HB PHE 65 2HB PHE 65 -7.617 8.844 -4.750 505 HD1 PHE 65 HD1 PHE 65 -4.233 8.516 -5.474 506 HD2 PHE 65 HD2 PHE 65 -6.966 8.121 -2.252 507 HE1 PHE 65 HE1 PHE 65 -2.666 7.018 -4.349 508 HE2 PHE 65 HE2 PHE 65 -5.410 6.598 -1.136 509 HZ PHE 65 HZ PHE 65 -3.239 6.053 -2.171 510 H ASP 66 H ASP 66 -3.843 9.398 -6.507 511 HA ASP 66 HA ASP 66 -2.711 11.942 -6.663 512 1HB ASP 66 1HB ASP 66 -3.101 12.062 -4.252 513 2HB ASP 66 2HB ASP 66 -2.242 10.541 -4.021 514 H SER 67 H SER 67 -0.884 11.766 -7.773 515 HA SER 67 HA SER 67 0.600 9.224 -7.665 516 1HB SER 67 1HB SER 67 1.125 9.627 -10.106 517 2HB SER 67 2HB SER 67 -0.562 9.242 -9.765 518 HG SER 67 HG SER 67 -0.767 10.990 -10.990 519 H THR 68 H THR 68 2.686 9.454 -7.086 520 HA THR 68 HA THR 68 3.786 12.124 -6.850 521 HB THR 68 HB THR 68 5.687 11.075 -5.731 522 HG1 THR 68 HG1 THR 68 4.469 8.540 -6.024 523 1HG2 THR 68 1HG2 THR 68 3.043 9.909 -4.841 524 2HG2 THR 68 2HG2 THR 68 4.494 10.039 -3.849 525 3HG2 THR 68 3HG2 THR 68 3.677 11.497 -4.408 526 H GLU 69 H GLU 69 4.027 9.430 -9.007 527 HA GLU 69 HA GLU 69 6.522 10.179 -10.191 528 1HB GLU 69 1HB GLU 69 4.339 8.401 -11.289 529 2HB GLU 69 2HB GLU 69 5.992 8.498 -11.883 530 1HG GLU 69 1HG GLU 69 6.783 7.695 -9.683 531 2HG GLU 69 2HG GLU 69 5.101 7.499 -9.190 532 H LYS 70 H LYS 70 3.117 10.717 -10.947 533 HA LYS 70 HA LYS 70 3.491 11.891 -13.478 534 1HB LYS 70 1HB LYS 70 1.314 11.058 -12.527 535 2HB LYS 70 2HB LYS 70 1.267 12.500 -11.525 536 1HG LYS 70 1HG LYS 70 1.548 12.788 -14.479 537 2HG LYS 70 2HG LYS 70 -0.028 12.405 -13.787 538 1HD LYS 70 1HD LYS 70 0.194 14.388 -12.311 539 2HD LYS 70 2HD LYS 70 1.702 14.791 -13.136 540 1HE LYS 70 1HE LYS 70 -0.129 16.093 -14.055 541 2HE LYS 70 2HE LYS 70 0.478 14.959 -15.261 542 1HZ LYS 70 1HZ LYS 70 -1.948 14.570 -13.590 543 2HZ LYS 70 2HZ LYS 70 -1.936 15.009 -15.225 544 3HZ LYS 70 3HZ LYS 70 -1.371 13.487 -14.753 545 H THR 71 H THR 71 3.269 13.309 -10.237 546 HA THR 71 HA THR 71 3.380 16.002 -10.966 547 HB THR 71 HB THR 71 4.562 14.746 -8.477 548 HG1 THR 71 HG1 THR 71 1.940 15.389 -9.251 549 1HG2 THR 71 1HG2 THR 71 3.625 17.564 -9.037 550 2HG2 THR 71 2HG2 THR 71 4.135 16.952 -7.464 551 3HG2 THR 71 3HG2 THR 71 5.294 17.048 -8.790 552 H GLY 72 H GLY 72 5.792 13.555 -11.039 553 1HA GLY 72 1HA GLY 72 7.712 15.479 -12.094 554 2HA GLY 72 2HA GLY 72 7.833 13.728 -12.183 555 H LYS 73 H LYS 73 7.020 14.123 -9.114 556 HA LYS 73 HA LYS 73 9.816 14.399 -8.237 557 1HB LYS 73 1HB LYS 73 7.324 15.427 -6.879 558 2HB LYS 73 2HB LYS 73 8.905 15.369 -6.114 559 1HG LYS 73 1HG LYS 73 9.792 16.877 -7.819 560 2HG LYS 73 2HG LYS 73 8.206 16.932 -8.590 561 1HD LYS 73 1HD LYS 73 7.245 17.938 -6.598 562 2HD LYS 73 2HD LYS 73 8.798 17.819 -5.766 563 1HE LYS 73 1HE LYS 73 9.796 19.328 -7.408 564 2HE LYS 73 2HE LYS 73 8.255 19.434 -8.256 565 1HZ LYS 73 1HZ LYS 73 8.720 20.304 -5.456 566 2HZ LYS 73 2HZ LYS 73 8.643 21.335 -6.795 567 3HZ LYS 73 3HZ LYS 73 7.275 20.461 -6.321 568 HA PRO 74 HA PRO 74 9.024 10.178 -6.875 569 1HB PRO 74 1HB PRO 74 11.515 10.736 -5.348 570 2HB PRO 74 2HB PRO 74 11.123 9.372 -6.402 571 1HG PRO 74 1HG PRO 74 12.779 11.284 -7.227 572 2HG PRO 74 2HG PRO 74 11.600 10.563 -8.338 573 1HD PRO 74 1HD PRO 74 11.530 13.209 -6.948 574 2HD PRO 74 2HD PRO 74 11.002 12.781 -8.589 575 H ALA 75 H ALA 75 8.521 9.137 -4.885 576 HA ALA 75 HA ALA 75 7.704 11.007 -2.805 577 1HB ALA 75 1HB ALA 75 7.045 8.088 -2.923 578 2HB ALA 75 2HB ALA 75 6.202 9.362 -2.047 579 3HB ALA 75 3HB ALA 75 6.128 9.302 -3.808 580 H THR 76 H THR 76 8.833 11.236 -0.978 581 HA THR 76 HA THR 76 10.600 9.029 -0.148 582 HB THR 76 HB THR 76 12.074 10.697 -0.988 583 HG1 THR 76 HG1 THR 76 12.749 11.592 1.323 584 1HG2 THR 76 1HG2 THR 76 10.497 12.576 -1.037 585 2HG2 THR 76 2HG2 THR 76 10.594 12.703 0.719 586 3HG2 THR 76 3HG2 THR 76 12.016 13.034 -0.269 587 H PHE 77 H PHE 77 10.009 8.233 1.752 588 HA PHE 77 HA PHE 77 9.373 9.979 3.964 589 1HB PHE 77 1HB PHE 77 7.165 8.931 4.403 590 2HB PHE 77 2HB PHE 77 7.194 9.857 2.904 591 HD1 PHE 77 HD1 PHE 77 7.298 8.679 0.730 592 HD2 PHE 77 HD2 PHE 77 6.755 6.593 4.403 593 HE1 PHE 77 HE1 PHE 77 6.519 6.703 -0.512 594 HE2 PHE 77 HE2 PHE 77 5.975 4.615 3.165 595 HZ PHE 77 HZ PHE 77 5.858 4.669 0.705 596 H GLN 78 H GLN 78 9.015 8.791 5.981 597 HA GLN 78 HA GLN 78 10.775 6.498 6.174 598 1HB GLN 78 1HB GLN 78 11.185 7.668 8.057 599 2HB GLN 78 2HB GLN 78 9.667 8.539 7.959 600 1HG GLN 78 1HG GLN 78 9.438 7.450 9.950 601 2HG GLN 78 2HG GLN 78 8.656 6.309 8.861 602 1HE2 GLN 78 1HE2 GLN 78 11.035 5.263 7.710 603 2HE2 GLN 78 2HE2 GLN 78 11.826 4.317 8.918 604 H VAL 79 H VAL 79 10.154 4.421 6.620 605 HA VAL 79 HA VAL 79 7.548 3.646 5.810 606 HB VAL 79 HB VAL 79 8.246 1.367 6.238 607 1HG1 VAL 79 1HG1 VAL 79 9.012 2.461 4.193 608 2HG1 VAL 79 2HG1 VAL 79 10.458 3.025 5.031 609 3HG1 VAL 79 3HG1 VAL 79 10.204 1.298 4.775 610 1HG2 VAL 79 1HG2 VAL 79 10.668 2.599 7.553 611 2HG2 VAL 79 2HG2 VAL 79 9.391 1.677 8.356 612 3HG2 VAL 79 3HG2 VAL 79 10.459 0.881 7.194 613 H SER 80 H SER 80 8.818 4.404 8.935 614 HA SER 80 HA SER 80 6.690 2.909 10.270 615 1HB SER 80 1HB SER 80 8.959 2.803 11.226 616 2HB SER 80 2HB SER 80 8.927 4.548 11.473 617 HG SER 80 HG SER 80 7.546 2.528 12.823 618 H GLN 81 H GLN 81 6.953 5.874 8.855 619 HA GLN 81 HA GLN 81 5.380 7.273 10.882 620 1HB GLN 81 1HB GLN 81 7.016 8.111 8.556 621 2HB GLN 81 2HB GLN 81 5.629 9.117 8.955 622 1HG GLN 81 1HG GLN 81 6.474 9.380 11.232 623 2HG GLN 81 2HG GLN 81 7.865 8.374 10.831 624 1HE2 GLN 81 1HE2 GLN 81 9.495 9.208 9.556 625 2HE2 GLN 81 2HE2 GLN 81 9.635 10.892 9.201 626 H VAL 82 H VAL 82 4.617 5.150 8.595 627 HA VAL 82 HA VAL 82 2.247 6.625 7.662 628 HB VAL 82 HB VAL 82 2.049 4.645 6.038 629 1HG1 VAL 82 1HG1 VAL 82 4.338 6.597 5.830 630 2HG1 VAL 82 2HG1 VAL 82 3.666 5.677 4.484 631 3HG1 VAL 82 3HG1 VAL 82 2.671 6.869 5.321 632 1HG2 VAL 82 1HG2 VAL 82 3.639 3.172 7.181 633 2HG2 VAL 82 2HG2 VAL 82 4.136 3.492 5.520 634 3HG2 VAL 82 3HG2 VAL 82 4.937 4.321 6.854 635 H ILE 83 H ILE 83 0.455 4.761 7.068 636 HA ILE 83 HA ILE 83 -0.725 4.094 9.492 637 HB ILE 83 HB ILE 83 -2.265 2.653 8.224 638 1HG1 ILE 83 1HG1 ILE 83 -0.422 1.910 6.585 639 2HG1 ILE 83 2HG1 ILE 83 -2.035 2.177 5.937 640 1HG2 ILE 83 1HG2 ILE 83 -1.671 5.350 7.027 641 2HG2 ILE 83 2HG2 ILE 83 -3.157 4.439 6.758 642 3HG2 ILE 83 3HG2 ILE 83 -2.745 4.993 8.380 643 1HD1 ILE 83 1HD1 ILE 83 -1.308 4.399 5.149 644 2HD1 ILE 83 2HD1 ILE 83 0.319 4.040 5.727 645 3HD1 ILE 83 3HD1 ILE 83 -0.391 3.073 4.436 646 HA PRO 84 HA PRO 84 1.071 0.535 11.311 647 1HB PRO 84 1HB PRO 84 -1.675 -0.629 11.053 648 2HB PRO 84 2HB PRO 84 -0.582 -0.628 12.443 649 1HG PRO 84 1HG PRO 84 -2.621 1.081 12.314 650 2HG PRO 84 2HG PRO 84 -1.055 1.575 12.983 651 1HD PRO 84 1HD PRO 84 -2.315 2.289 10.396 652 2HD PRO 84 2HD PRO 84 -1.144 3.195 11.373 653 H GLY 85 H GLY 85 -1.404 -0.448 8.920 654 1HA GLY 85 1HA GLY 85 -1.272 -1.895 7.141 655 2HA GLY 85 2HA GLY 85 -0.341 -2.905 8.237 656 H TRP 86 H TRP 86 0.350 0.226 6.683 657 HA TRP 86 HA TRP 86 2.117 -0.756 4.751 658 1HB TRP 86 1HB TRP 86 1.333 1.856 5.785 659 2HB TRP 86 2HB TRP 86 3.010 1.808 5.258 660 HD1 TRP 86 HD1 TRP 86 0.256 -0.186 3.451 661 HE1 TRP 86 HE1 TRP 86 0.018 0.756 1.063 662 HE3 TRP 86 HE3 TRP 86 3.359 3.859 3.853 663 HZ2 TRP 86 HZ2 TRP 86 1.005 2.928 -0.441 664 HZ3 TRP 86 HZ3 TRP 86 3.653 5.319 1.897 665 HH2 TRP 86 HH2 TRP 86 2.501 4.862 -0.206 666 H THR 87 H THR 87 2.799 0.608 7.969 667 HA THR 87 HA THR 87 5.564 0.586 7.877 668 HB THR 87 HB THR 87 5.579 0.564 10.278 669 HG1 THR 87 HG1 THR 87 4.101 -0.463 11.410 670 1HG2 THR 87 1HG2 THR 87 3.089 1.959 9.289 671 2HG2 THR 87 2HG2 THR 87 3.933 2.308 10.797 672 3HG2 THR 87 3HG2 THR 87 4.725 2.612 9.252 673 H GLU 88 H GLU 88 3.347 -2.076 8.429 674 HA GLU 88 HA GLU 88 5.294 -3.924 9.357 675 1HB GLU 88 1HB GLU 88 2.887 -4.175 9.799 676 2HB GLU 88 2HB GLU 88 2.606 -4.452 8.085 677 1HG GLU 88 1HG GLU 88 2.607 -6.548 9.272 678 2HG GLU 88 2HG GLU 88 4.002 -6.464 8.192 679 H ALA 89 H ALA 89 3.724 -3.535 6.169 680 HA ALA 89 HA ALA 89 5.197 -5.625 4.941 681 1HB ALA 89 1HB ALA 89 3.089 -4.934 4.022 682 2HB ALA 89 2HB ALA 89 4.355 -4.683 2.817 683 3HB ALA 89 3HB ALA 89 3.709 -3.308 3.719 684 H LEU 90 H LEU 90 5.593 -2.092 4.827 685 HA LEU 90 HA LEU 90 7.710 -1.966 3.043 686 1HB LEU 90 1HB LEU 90 6.736 -0.217 5.246 687 2HB LEU 90 2HB LEU 90 8.304 0.133 4.545 688 HG LEU 90 HG LEU 90 6.522 1.480 3.532 689 1HD1 LEU 90 1HD1 LEU 90 8.494 0.904 2.212 690 2HD1 LEU 90 2HD1 LEU 90 7.683 -0.550 1.631 691 3HD1 LEU 90 3HD1 LEU 90 7.056 1.041 1.202 692 1HD2 LEU 90 1HD2 LEU 90 5.398 -1.183 2.676 693 2HD2 LEU 90 2HD2 LEU 90 4.647 -0.016 3.763 694 3HD2 LEU 90 3HD2 LEU 90 4.868 0.382 2.059 695 H GLN 91 H GLN 91 7.737 -2.802 6.439 696 HA GLN 91 HA GLN 91 10.501 -2.442 6.910 697 1HB GLN 91 1HB GLN 91 8.861 -2.656 8.722 698 2HB GLN 91 2HB GLN 91 8.557 -4.331 8.254 699 1HG GLN 91 1HG GLN 91 11.013 -4.755 8.703 700 2HG GLN 91 2HG GLN 91 11.050 -3.159 9.452 701 1HE2 GLN 91 1HE2 GLN 91 11.543 -3.992 11.471 702 2HE2 GLN 91 2HE2 GLN 91 10.385 -4.844 12.429 703 H LEU 92 H LEU 92 8.763 -4.876 5.216 704 HA LEU 92 HA LEU 92 10.966 -6.782 5.413 705 1HB LEU 92 1HB LEU 92 8.144 -6.950 4.433 706 2HB LEU 92 2HB LEU 92 9.316 -8.162 3.953 707 HG LEU 92 HG LEU 92 9.716 -8.693 6.338 708 1HD1 LEU 92 1HD1 LEU 92 7.473 -6.739 6.815 709 2HD1 LEU 92 2HD1 LEU 92 8.131 -7.845 8.020 710 3HD1 LEU 92 3HD1 LEU 92 9.146 -6.570 7.344 711 1HD2 LEU 92 1HD2 LEU 92 6.841 -8.850 5.447 712 2HD2 LEU 92 2HD2 LEU 92 8.121 -10.000 5.056 713 3HD2 LEU 92 3HD2 LEU 92 7.574 -9.822 6.725 714 H MET 93 H MET 93 9.676 -4.455 3.193 715 HA MET 93 HA MET 93 10.697 -5.620 0.804 716 1HB MET 93 1HB MET 93 8.922 -3.690 1.208 717 2HB MET 93 2HB MET 93 10.348 -2.665 1.023 718 1HG MET 93 1HG MET 93 10.789 -3.800 -1.147 719 2HG MET 93 2HG MET 93 9.245 -4.630 -0.970 720 1HE MET 93 1HE MET 93 6.913 -3.341 -0.785 721 2HE MET 93 2HE MET 93 7.530 -2.237 0.446 722 3HE MET 93 3HE MET 93 6.733 -1.599 -0.993 723 HA PRO 94 HA PRO 94 14.956 -4.398 1.788 724 1HB PRO 94 1HB PRO 94 15.714 -6.100 -0.447 725 2HB PRO 94 2HB PRO 94 16.060 -6.309 1.273 726 1HG PRO 94 1HG PRO 94 14.377 -7.937 -0.096 727 2HG PRO 94 2HG PRO 94 14.179 -7.578 1.629 728 1HD PRO 94 1HD PRO 94 12.753 -6.389 -0.739 729 2HD PRO 94 2HD PRO 94 12.086 -6.930 0.843 730 H ALA 95 H ALA 95 16.327 -2.911 0.864 731 HA ALA 95 HA ALA 95 15.467 -1.147 -1.046 732 1HB ALA 95 1HB ALA 95 18.258 -1.895 -0.226 733 2HB ALA 95 2HB ALA 95 17.288 -0.530 0.325 734 3HB ALA 95 3HB ALA 95 17.913 -0.561 -1.324 735 H GLY 96 H GLY 96 15.235 -1.165 -3.209 736 1HA GLY 96 1HA GLY 96 16.962 -2.894 -4.818 737 2HA GLY 96 2HA GLY 96 15.948 -1.595 -5.422 738 H SER 97 H SER 97 13.991 -3.232 -3.383 739 HA SER 97 HA SER 97 13.303 -5.408 -5.199 740 1HB SER 97 1HB SER 97 12.161 -4.609 -2.510 741 2HB SER 97 2HB SER 97 11.673 -6.033 -3.430 742 HG SER 97 HG SER 97 13.297 -6.996 -2.536 743 H THR 98 H THR 98 10.665 -5.699 -5.071 744 HA THR 98 HA THR 98 9.306 -3.222 -5.731 745 HB THR 98 HB THR 98 9.337 -5.418 -7.799 746 HG1 THR 98 HG1 THR 98 11.128 -3.298 -7.397 747 1HG2 THR 98 1HG2 THR 98 8.522 -2.511 -7.901 748 2HG2 THR 98 2HG2 THR 98 8.477 -3.638 -9.259 749 3HG2 THR 98 3HG2 THR 98 7.431 -3.897 -7.861 750 H TRP 99 H TRP 99 7.494 -3.417 -4.569 751 HA TRP 99 HA TRP 99 6.008 -5.954 -4.709 752 1HB TRP 99 1HB TRP 99 6.785 -4.380 -2.282 753 2HB TRP 99 2HB TRP 99 5.275 -5.280 -2.280 754 HD1 TRP 99 HD1 TRP 99 7.197 -7.545 -4.188 755 HE1 TRP 99 HE1 TRP 99 8.416 -9.289 -2.740 756 HE3 TRP 99 HE3 TRP 99 6.876 -5.208 0.344 757 HZ2 TRP 99 HZ2 TRP 99 9.143 -9.631 -0.035 758 HZ3 TRP 99 HZ3 TRP 99 7.855 -6.311 2.313 759 HH2 TRP 99 HH2 TRP 99 8.964 -8.478 2.127 760 H GLU 100 H GLU 100 3.776 -5.808 -4.595 761 HA GLU 100 HA GLU 100 2.635 -3.095 -4.684 762 1HB GLU 100 1HB GLU 100 0.953 -3.925 -6.287 763 2HB GLU 100 2HB GLU 100 2.581 -4.047 -6.933 764 1HG GLU 100 1HG GLU 100 2.590 -6.448 -6.319 765 2HG GLU 100 2HG GLU 100 0.904 -6.284 -5.822 766 H ILE 101 H ILE 101 1.594 -2.845 -2.812 767 HA ILE 101 HA ILE 101 0.248 -5.182 -1.646 768 HB ILE 101 HB ILE 101 0.280 -3.864 0.483 769 1HG1 ILE 101 1HG1 ILE 101 2.187 -2.099 -1.068 770 2HG1 ILE 101 2HG1 ILE 101 0.564 -1.635 -0.564 771 1HG2 ILE 101 1HG2 ILE 101 2.894 -4.580 -0.831 772 2HG2 ILE 101 2HG2 ILE 101 2.706 -4.255 0.892 773 3HG2 ILE 101 3HG2 ILE 101 1.870 -5.621 0.156 774 1HD1 ILE 101 1HD1 ILE 101 2.842 -2.336 1.274 775 2HD1 ILE 101 2HD1 ILE 101 2.266 -0.710 0.906 776 3HD1 ILE 101 3HD1 ILE 101 1.223 -1.841 1.768 777 H TYR 102 H TYR 102 -1.821 -5.181 -1.103 778 HA TYR 102 HA TYR 102 -3.417 -2.760 -1.621 779 1HB TYR 102 1HB TYR 102 -5.235 -4.743 -1.941 780 2HB TYR 102 2HB TYR 102 -4.302 -4.068 -3.272 781 HD1 TYR 102 HD1 TYR 102 -4.862 -6.977 -1.171 782 HD2 TYR 102 HD2 TYR 102 -2.357 -5.327 -4.192 783 HE1 TYR 102 HE1 TYR 102 -3.970 -9.212 -1.649 784 HE2 TYR 102 HE2 TYR 102 -1.464 -7.558 -4.675 785 HH TYR 102 HH TYR 102 -1.210 -9.719 -3.570 786 H VAL 103 H VAL 103 -3.824 -1.975 0.365 787 HA VAL 103 HA VAL 103 -4.446 -3.877 2.521 788 HB VAL 103 HB VAL 103 -3.708 -0.998 2.944 789 1HG1 VAL 103 1HG1 VAL 103 -4.694 -2.212 4.820 790 2HG1 VAL 103 2HG1 VAL 103 -3.448 -3.451 4.680 791 3HG1 VAL 103 3HG1 VAL 103 -3.007 -1.805 5.133 792 1HG2 VAL 103 1HG2 VAL 103 -1.935 -1.993 1.593 793 2HG2 VAL 103 2HG2 VAL 103 -1.382 -1.707 3.242 794 3HG2 VAL 103 3HG2 VAL 103 -1.811 -3.338 2.726 795 HA PRO 104 HA PRO 104 -8.639 -2.102 2.075 796 1HB PRO 104 1HB PRO 104 -9.680 -3.908 3.915 797 2HB PRO 104 2HB PRO 104 -9.653 -4.147 2.167 798 1HG PRO 104 1HG PRO 104 -7.841 -5.230 4.263 799 2HG PRO 104 2HG PRO 104 -8.407 -5.985 2.764 800 1HD PRO 104 1HD PRO 104 -5.917 -4.981 3.025 801 2HD PRO 104 2HD PRO 104 -6.797 -4.945 1.482 802 H SER 105 H SER 105 -9.824 -0.811 3.553 803 HA SER 105 HA SER 105 -8.431 0.632 5.413 804 1HB SER 105 1HB SER 105 -10.932 0.793 4.412 805 2HB SER 105 2HB SER 105 -11.294 0.249 6.057 806 HG SER 105 HG SER 105 -9.838 2.031 6.712 807 H GLY 106 H GLY 106 -10.067 -2.427 5.942 808 1HA GLY 106 1HA GLY 106 -10.115 -3.838 7.749 809 2HA GLY 106 2HA GLY 106 -10.309 -2.389 8.717 810 H LEU 107 H LEU 107 -7.406 -2.403 6.936 811 HA LEU 107 HA LEU 107 -5.944 -3.411 9.282 812 1HB LEU 107 1HB LEU 107 -5.198 -3.480 6.367 813 2HB LEU 107 2HB LEU 107 -4.069 -3.830 7.656 814 HG LEU 107 HG LEU 107 -4.784 -5.926 6.871 815 1HD1 LEU 107 1HD1 LEU 107 -4.848 -5.606 9.365 816 2HD1 LEU 107 2HD1 LEU 107 -6.596 -5.440 9.221 817 3HD1 LEU 107 3HD1 LEU 107 -5.814 -6.947 8.746 818 1HD2 LEU 107 1HD2 LEU 107 -6.727 -5.046 5.603 819 2HD2 LEU 107 2HD2 LEU 107 -7.057 -6.554 6.457 820 3HD2 LEU 107 3HD2 LEU 107 -7.646 -5.024 7.107 821 H ALA 108 H ALA 108 -6.711 -0.639 7.647 822 HA ALA 108 HA ALA 108 -4.200 0.681 8.430 823 1HB ALA 108 1HB ALA 108 -4.648 0.967 6.089 824 2HB ALA 108 2HB ALA 108 -6.295 1.512 6.422 825 3HB ALA 108 3HB ALA 108 -4.919 2.512 6.900 826 H TYR 109 H TYR 109 -6.929 2.684 7.824 827 HA TYR 109 HA TYR 109 -6.972 3.424 10.639 828 1HB TYR 109 1HB TYR 109 -7.715 4.750 8.098 829 2HB TYR 109 2HB TYR 109 -8.685 5.171 9.508 830 HD1 TYR 109 HD1 TYR 109 -5.461 5.537 7.872 831 HD2 TYR 109 HD2 TYR 109 -7.591 6.151 11.505 832 HE1 TYR 109 HE1 TYR 109 -3.705 7.075 8.635 833 HE2 TYR 109 HE2 TYR 109 -5.841 7.698 12.275 834 HH TYR 109 HH TYR 109 -3.428 8.112 11.829 835 H GLY 110 H GLY 110 -8.745 1.574 8.415 836 1HA GLY 110 1HA GLY 110 -10.850 1.200 10.429 837 2HA GLY 110 2HA GLY 110 -10.372 0.025 9.222 838 HA PRO 111 HA PRO 111 -13.378 1.225 6.244 839 1HB PRO 111 1HB PRO 111 -15.491 -0.307 7.149 840 2HB PRO 111 2HB PRO 111 -14.184 -0.895 6.119 841 1HG PRO 111 1HG PRO 111 -14.513 -1.122 9.082 842 2HG PRO 111 2HG PRO 111 -13.927 -2.330 7.920 843 1HD PRO 111 1HD PRO 111 -12.224 -0.969 9.461 844 2HD PRO 111 2HD PRO 111 -11.828 -1.350 7.772 845 H ARG 112 H ARG 112 -13.657 1.962 9.532 846 HA ARG 112 HA ARG 112 -16.315 3.035 9.483 847 1HB ARG 112 1HB ARG 112 -14.042 3.460 11.431 848 2HB ARG 112 2HB ARG 112 -15.696 4.003 11.682 849 1HG ARG 112 1HG ARG 112 -16.498 1.765 11.794 850 2HG ARG 112 2HG ARG 112 -14.941 1.122 11.267 851 1HD ARG 112 1HD ARG 112 -15.397 2.648 13.827 852 2HD ARG 112 2HD ARG 112 -15.327 0.891 13.704 853 HE ARG 112 HE ARG 112 -12.996 1.913 12.570 854 1HH1 ARG 112 1HH1 ARG 112 -14.545 1.770 15.689 855 2HH1 ARG 112 2HH1 ARG 112 -13.055 1.803 16.573 856 1HH2 ARG 112 1HH2 ARG 112 -11.033 1.959 13.723 857 2HH2 ARG 112 2HH2 ARG 112 -11.058 1.911 15.454 858 H SER 113 H SER 113 -16.622 5.398 10.164 859 HA SER 113 HA SER 113 -15.816 7.051 8.058 860 1HB SER 113 1HB SER 113 -16.826 8.890 9.364 861 2HB SER 113 2HB SER 113 -17.860 7.463 9.322 862 HG SER 113 HG SER 113 -17.790 8.169 11.423 863 H VAL 114 H VAL 114 -13.766 5.913 10.238 864 HA VAL 114 HA VAL 114 -12.312 8.421 10.672 865 HB VAL 114 HB VAL 114 -11.484 5.741 11.759 866 1HG1 VAL 114 1HG1 VAL 114 -11.037 8.593 12.634 867 2HG1 VAL 114 2HG1 VAL 114 -10.553 7.176 13.573 868 3HG1 VAL 114 3HG1 VAL 114 -9.838 7.470 11.983 869 1HG2 VAL 114 1HG2 VAL 114 -13.472 7.647 12.991 870 2HG2 VAL 114 2HG2 VAL 114 -13.810 6.020 12.396 871 3HG2 VAL 114 3HG2 VAL 114 -12.762 6.247 13.797 872 H GLY 115 H GLY 115 -12.570 6.806 8.109 873 1HA GLY 115 1HA GLY 115 -11.241 6.197 6.337 874 2HA GLY 115 2HA GLY 115 -10.097 5.581 7.523 875 H GLY 116 H GLY 116 -8.186 6.571 7.674 876 1HA GLY 116 1HA GLY 116 -6.583 8.226 7.578 877 2HA GLY 116 2HA GLY 116 -7.868 9.395 7.331 878 HA PRO 117 HA PRO 117 -5.392 9.383 3.406 879 1HB PRO 117 1HB PRO 117 -3.909 6.813 3.541 880 2HB PRO 117 2HB PRO 117 -3.322 8.430 3.138 881 1HG PRO 117 1HG PRO 117 -2.766 7.301 5.496 882 2HG PRO 117 2HG PRO 117 -3.080 9.040 5.354 883 1HD PRO 117 1HD PRO 117 -4.841 6.865 6.390 884 2HD PRO 117 2HD PRO 117 -4.682 8.556 6.934 885 H ILE 118 H ILE 118 -6.366 6.114 4.312 886 HA ILE 118 HA ILE 118 -7.241 5.542 1.593 887 HB ILE 118 HB ILE 118 -7.294 3.783 4.059 888 1HG1 ILE 118 1HG1 ILE 118 -5.532 2.566 2.523 889 2HG1 ILE 118 2HG1 ILE 118 -5.344 4.172 1.826 890 1HG2 ILE 118 1HG2 ILE 118 -7.920 3.162 1.184 891 2HG2 ILE 118 2HG2 ILE 118 -7.727 1.957 2.459 892 3HG2 ILE 118 3HG2 ILE 118 -9.044 3.131 2.545 893 1HD1 ILE 118 1HD1 ILE 118 -4.797 5.056 4.039 894 2HD1 ILE 118 2HD1 ILE 118 -4.965 3.437 4.717 895 3HD1 ILE 118 3HD1 ILE 118 -3.691 3.775 3.546 896 H GLY 119 H GLY 119 -9.225 6.010 0.946 897 1HA GLY 119 1HA GLY 119 -11.508 6.299 0.952 898 2HA GLY 119 2HA GLY 119 -11.177 7.289 2.361 899 HA PRO 120 HA PRO 120 -13.263 4.563 5.105 900 1HB PRO 120 1HB PRO 120 -15.902 5.180 4.630 901 2HB PRO 120 2HB PRO 120 -14.817 6.157 5.621 902 1HG PRO 120 1HG PRO 120 -15.640 6.534 2.773 903 2HG PRO 120 2HG PRO 120 -15.431 7.745 4.051 904 1HD PRO 120 1HD PRO 120 -13.574 7.359 2.140 905 2HD PRO 120 2HD PRO 120 -13.131 7.793 3.804 906 H ASN 121 H ASN 121 -13.720 2.462 4.991 907 HA ASN 121 HA ASN 121 -14.069 0.391 4.074 908 1HB ASN 121 1HB ASN 121 -16.478 1.616 2.732 909 2HB ASN 121 2HB ASN 121 -16.286 -0.018 3.357 910 1HD2 ASN 121 1HD2 ASN 121 -16.772 3.326 4.188 911 2HD2 ASN 121 2HD2 ASN 121 -17.350 3.054 5.795 912 H GLU 122 H GLU 122 -12.385 2.131 2.522 913 HA GLU 122 HA GLU 122 -13.021 1.204 -0.199 914 1HB GLU 122 1HB GLU 122 -11.604 3.678 0.762 915 2HB GLU 122 2HB GLU 122 -11.421 3.091 -0.886 916 1HG GLU 122 1HG GLU 122 -13.770 3.347 -1.296 917 2HG GLU 122 2HG GLU 122 -14.059 3.771 0.390 918 H THR 123 H THR 123 -11.733 -0.325 -0.992 919 HA THR 123 HA THR 123 -9.199 -0.871 0.336 920 HB THR 123 HB THR 123 -10.535 -2.357 -1.942 921 HG1 THR 123 HG1 THR 123 -10.771 -2.482 0.833 922 1HG2 THR 123 1HG2 THR 123 -8.210 -3.121 -0.168 923 2HG2 THR 123 2HG2 THR 123 -8.971 -4.166 -1.368 924 3HG2 THR 123 3HG2 THR 123 -8.117 -2.711 -1.880 925 H LEU 124 H LEU 124 -7.279 -0.227 -0.454 926 HA LEU 124 HA LEU 124 -7.277 0.984 -3.148 927 1HB LEU 124 1HB LEU 124 -5.934 1.720 -0.583 928 2HB LEU 124 2HB LEU 124 -5.181 2.165 -2.100 929 HG LEU 124 HG LEU 124 -6.993 3.577 -2.703 930 1HD1 LEU 124 1HD1 LEU 124 -8.463 2.365 -0.370 931 2HD1 LEU 124 2HD1 LEU 124 -8.998 3.809 -1.228 932 3HD1 LEU 124 3HD1 LEU 124 -8.890 2.267 -2.077 933 1HD2 LEU 124 1HD2 LEU 124 -5.433 4.517 -1.090 934 2HD2 LEU 124 2HD2 LEU 124 -7.057 5.155 -0.839 935 3HD2 LEU 124 3HD2 LEU 124 -6.423 3.911 0.237 936 H ILE 125 H ILE 125 -5.394 0.806 -4.411 937 HA ILE 125 HA ILE 125 -3.676 -1.500 -3.792 938 HB ILE 125 HB ILE 125 -4.306 -0.317 -6.504 939 1HG1 ILE 125 1HG1 ILE 125 -5.416 -2.686 -6.707 940 2HG1 ILE 125 2HG1 ILE 125 -5.499 -2.575 -4.950 941 1HG2 ILE 125 1HG2 ILE 125 -2.803 -2.809 -5.714 942 2HG2 ILE 125 2HG2 ILE 125 -3.240 -2.367 -7.366 943 3HG2 ILE 125 3HG2 ILE 125 -2.123 -1.355 -6.447 944 1HD1 ILE 125 1HD1 ILE 125 -6.670 -0.576 -6.869 945 2HD1 ILE 125 2HD1 ILE 125 -7.566 -1.843 -6.033 946 3HD1 ILE 125 3HD1 ILE 125 -6.805 -0.546 -5.112 947 H PHE 126 H PHE 126 -1.519 -1.186 -3.686 948 HA PHE 126 HA PHE 126 -0.492 1.442 -4.525 949 1HB PHE 126 1HB PHE 126 0.394 -0.115 -2.089 950 2HB PHE 126 2HB PHE 126 0.971 1.471 -2.582 951 HD1 PHE 126 HD1 PHE 126 -1.422 -0.322 -0.668 952 HD2 PHE 126 HD2 PHE 126 -0.737 3.378 -2.665 953 HE1 PHE 126 HE1 PHE 126 -3.186 0.730 0.687 954 HE2 PHE 126 HE2 PHE 126 -2.498 4.435 -1.304 955 HZ PHE 126 HZ PHE 126 -3.724 3.112 0.372 956 H LYS 127 H LYS 127 1.245 1.426 -5.785 957 HA LYS 127 HA LYS 127 2.674 -1.124 -6.162 958 1HB LYS 127 1HB LYS 127 1.489 -0.161 -8.159 959 2HB LYS 127 2HB LYS 127 2.538 1.245 -8.045 960 1HG LYS 127 1HG LYS 127 3.425 -0.165 -9.728 961 2HG LYS 127 2HG LYS 127 4.488 -0.298 -8.327 962 1HD LYS 127 1HD LYS 127 3.518 -2.408 -7.712 963 2HD LYS 127 2HD LYS 127 2.275 -2.248 -8.968 964 1HE LYS 127 1HE LYS 127 4.033 -3.782 -9.672 965 2HE LYS 127 2HE LYS 127 4.013 -2.342 -10.689 966 1HZ LYS 127 1HZ LYS 127 5.860 -1.459 -9.382 967 2HZ LYS 127 2HZ LYS 127 5.895 -2.873 -8.454 968 3HZ LYS 127 3HZ LYS 127 6.262 -2.936 -10.104 969 H ILE 128 H ILE 128 4.389 -1.041 -4.804 970 HA ILE 128 HA ILE 128 5.865 1.490 -4.618 971 HB ILE 128 HB ILE 128 5.936 -0.890 -2.764 972 1HG1 ILE 128 1HG1 ILE 128 4.986 1.002 -1.201 973 2HG1 ILE 128 2HG1 ILE 128 4.469 1.722 -2.729 974 1HG2 ILE 128 1HG2 ILE 128 7.297 1.791 -2.585 975 2HG2 ILE 128 2HG2 ILE 128 7.227 0.605 -1.282 976 3HG2 ILE 128 3HG2 ILE 128 8.072 0.220 -2.781 977 1HD1 ILE 128 1HD1 ILE 128 3.229 -0.317 -3.251 978 2HD1 ILE 128 2HD1 ILE 128 3.735 -1.011 -1.711 979 3HD1 ILE 128 3HD1 ILE 128 2.695 0.413 -1.737 980 H HIS 129 H HIS 129 7.638 1.664 -5.742 981 HA HIS 129 HA HIS 129 9.215 -0.755 -6.298 982 1HB HIS 129 1HB HIS 129 8.281 1.071 -8.111 983 2HB HIS 129 2HB HIS 129 9.886 1.714 -7.768 984 HD1 HIS 129 HD1 HIS 129 8.663 0.067 -10.381 985 HD2 HIS 129 HD2 HIS 129 11.505 -1.140 -7.603 986 HE1 HIS 129 HE1 HIS 129 9.975 -1.755 -11.512 987 HE2 HIS 129 HE2 HIS 129 11.528 -2.618 -9.725 988 H LEU 130 H LEU 130 10.551 -0.898 -4.596 989 HA LEU 130 HA LEU 130 11.692 1.431 -3.364 990 1HB LEU 130 1HB LEU 130 11.046 -0.529 -2.039 991 2HB LEU 130 2HB LEU 130 12.222 -1.502 -2.904 992 HG LEU 130 HG LEU 130 14.051 -0.299 -1.913 993 1HD1 LEU 130 1HD1 LEU 130 11.943 1.467 -0.684 994 2HD1 LEU 130 2HD1 LEU 130 13.652 1.481 -0.248 995 3HD1 LEU 130 3HD1 LEU 130 13.155 1.934 -1.878 996 1HD2 LEU 130 1HD2 LEU 130 13.044 -2.118 -0.612 997 2HD2 LEU 130 2HD2 LEU 130 13.737 -0.870 0.426 998 3HD2 LEU 130 3HD2 LEU 130 11.988 -0.952 0.187 999 H ILE 131 H ILE 131 13.350 2.488 -4.180 1000 HA ILE 131 HA ILE 131 15.173 1.200 -6.026 1001 HB ILE 131 HB ILE 131 15.218 4.027 -4.952 1002 1HG1 ILE 131 1HG1 ILE 131 14.195 3.035 -7.628 1003 2HG1 ILE 131 2HG1 ILE 131 13.145 3.392 -6.234 1004 1HG2 ILE 131 1HG2 ILE 131 16.651 2.769 -7.290 1005 2HG2 ILE 131 2HG2 ILE 131 16.656 4.488 -6.897 1006 3HG2 ILE 131 3HG2 ILE 131 17.385 3.327 -5.787 1007 1HD1 ILE 131 1HD1 ILE 131 14.937 5.360 -7.656 1008 2HD1 ILE 131 2HD1 ILE 131 13.187 5.230 -7.832 1009 3HD1 ILE 131 3HD1 ILE 131 13.884 5.715 -6.287 1010 H SER 132 H SER 132 15.531 3.028 -2.974 1011 HA SER 132 HA SER 132 17.389 1.126 -1.938 1012 1HB SER 132 1HB SER 132 19.406 2.286 -2.027 1013 2HB SER 132 2HB SER 132 18.714 2.582 -3.622 1014 HG SER 132 HG SER 132 19.490 4.507 -2.671 1015 H VAL 133 H VAL 133 18.300 1.824 0.181 1016 HA VAL 133 HA VAL 133 16.418 3.627 1.568 1017 HB VAL 133 HB VAL 133 16.083 1.334 2.272 1018 1HG1 VAL 133 1HG1 VAL 133 18.951 1.227 2.086 1019 2HG1 VAL 133 2HG1 VAL 133 18.410 0.662 3.666 1020 3HG1 VAL 133 3HG1 VAL 133 17.784 -0.089 2.199 1021 1HG2 VAL 133 1HG2 VAL 133 15.930 3.155 3.944 1022 2HG2 VAL 133 2HG2 VAL 133 16.363 1.598 4.649 1023 3HG2 VAL 133 3HG2 VAL 133 17.601 2.830 4.406 1024 H LYS 134 H LYS 134 17.302 5.398 2.402 1025 HA LYS 134 HA LYS 134 18.991 6.949 2.744 1026 1HB LYS 134 1HB LYS 134 18.716 5.014 4.866 1027 2HB LYS 134 2HB LYS 134 20.353 5.655 4.831 1028 1HG LYS 134 1HG LYS 134 19.430 7.942 4.901 1029 2HG LYS 134 2HG LYS 134 17.796 7.244 5.032 1030 1HD LYS 134 1HD LYS 134 18.472 6.116 7.109 1031 2HD LYS 134 2HD LYS 134 20.075 6.844 6.980 1032 1HE LYS 134 1HE LYS 134 17.468 8.338 7.263 1033 2HE LYS 134 2HE LYS 134 18.654 8.081 8.543 1034 1HZ LYS 134 1HZ LYS 134 20.263 9.340 7.241 1035 2HZ LYS 134 2HZ LYS 134 19.111 9.599 6.031 1036 3HZ LYS 134 3HZ LYS 134 18.887 10.270 7.567 1037 H LYS 135 H LYS 135 20.109 6.585 0.735 1038 HA LYS 135 HA LYS 135 21.912 6.198 -0.565 1039 1HB LYS 135 1HB LYS 135 24.016 6.752 0.307 1040 2HB LYS 135 2HB LYS 135 22.842 7.737 1.159 1041 1HG LYS 135 1HG LYS 135 23.123 6.573 3.143 1042 2HG LYS 135 2HG LYS 135 23.840 5.176 2.332 1043 1HD LYS 135 1HD LYS 135 25.823 6.391 1.839 1044 2HD LYS 135 2HD LYS 135 25.100 7.900 2.390 1045 1HE LYS 135 1HE LYS 135 25.672 5.503 4.133 1046 2HE LYS 135 2HE LYS 135 26.673 6.951 4.042 1047 1HZ LYS 135 1HZ LYS 135 23.839 6.867 4.931 1048 2HZ LYS 135 2HZ LYS 135 25.185 7.010 5.946 1049 3HZ LYS 135 3HZ LYS 135 24.809 8.250 4.858 1050 H SER 136 H SER 136 20.536 3.897 0.457 1051 HA SER 136 HA SER 136 20.717 1.625 0.584 1052 1HB SER 136 1HB SER 136 21.438 1.997 -1.748 1053 2HB SER 136 2HB SER 136 23.110 2.131 -1.202 1054 HG SER 136 HG SER 136 21.752 -0.149 -0.408 1055 H SER 137 H SER 137 21.772 2.827 2.798 1056 HA SER 137 HA SER 137 23.121 2.511 4.600 1057 1HB SER 137 1HB SER 137 22.206 0.238 4.462 1058 2HB SER 137 2HB SER 137 23.492 -0.219 3.346 1059 HG SER 137 HG SER 137 24.308 -0.833 5.237 No H/Q in entry = 1059 Start of MODEL 6 1 H1 PHE 1 H1 PHE 1 -22.570 10.268 2.916 2 H2 PHE 1 H2 PHE 1 -23.902 11.277 3.188 3 H3 PHE 1 H3 PHE 1 -23.469 10.117 4.341 4 HA PHE 1 HA PHE 1 -25.377 9.356 3.143 5 1HB PHE 1 1HB PHE 1 -23.616 9.761 0.716 6 2HB PHE 1 2HB PHE 1 -25.150 8.898 0.692 7 HD1 PHE 1 HD1 PHE 1 -23.529 12.137 0.800 8 HD2 PHE 1 HD2 PHE 1 -27.260 10.107 1.063 9 HE1 PHE 1 HE1 PHE 1 -24.708 14.265 0.435 10 HE2 PHE 1 HE2 PHE 1 -28.446 12.231 0.697 11 HZ PHE 1 HZ PHE 1 -27.183 14.307 0.389 12 H ASN 2 H ASN 2 -25.309 7.418 4.057 13 HA ASN 2 HA ASN 2 -23.026 5.724 4.048 14 1HB ASN 2 1HB ASN 2 -25.908 5.112 4.759 15 2HB ASN 2 2HB ASN 2 -24.525 4.070 5.118 16 1HD2 ASN 2 1HD2 ASN 2 -26.148 7.056 5.876 17 2HD2 ASN 2 2HD2 ASN 2 -25.327 7.357 7.366 18 H LYS 3 H LYS 3 -25.574 6.204 1.806 19 HA LYS 3 HA LYS 3 -25.777 3.670 0.645 20 1HB LYS 3 1HB LYS 3 -27.185 5.728 0.140 21 2HB LYS 3 2HB LYS 3 -25.865 6.276 -0.883 22 1HG LYS 3 1HG LYS 3 -27.025 3.563 -1.320 23 2HG LYS 3 2HG LYS 3 -27.890 4.987 -1.900 24 1HD LYS 3 1HD LYS 3 -24.988 4.636 -2.536 25 2HD LYS 3 2HD LYS 3 -26.208 3.767 -3.467 26 1HE LYS 3 1HE LYS 3 -25.664 5.834 -4.586 27 2HE LYS 3 2HE LYS 3 -27.312 5.917 -3.966 28 1HZ LYS 3 1HZ LYS 3 -24.933 7.103 -2.641 29 2HZ LYS 3 2HZ LYS 3 -26.060 7.961 -3.566 30 3HZ LYS 3 3HZ LYS 3 -26.536 7.232 -2.117 31 H LYS 4 H LYS 4 -23.473 6.289 0.137 32 HA LYS 4 HA LYS 4 -22.017 4.863 -1.904 33 1HB LYS 4 1HB LYS 4 -21.644 7.473 -0.468 34 2HB LYS 4 2HB LYS 4 -20.327 6.792 -1.412 35 1HG LYS 4 1HG LYS 4 -23.068 7.263 -2.550 36 2HG LYS 4 2HG LYS 4 -21.790 8.481 -2.579 37 1HD LYS 4 1HD LYS 4 -20.339 6.844 -3.768 38 2HD LYS 4 2HD LYS 4 -21.715 5.740 -3.840 39 1HE LYS 4 1HE LYS 4 -22.981 7.388 -5.121 40 2HE LYS 4 2HE LYS 4 -21.628 8.515 -5.025 41 1HZ LYS 4 1HZ LYS 4 -20.279 6.929 -6.265 42 2HZ LYS 4 2HZ LYS 4 -21.592 5.869 -6.373 43 3HZ LYS 4 3HZ LYS 4 -21.655 7.374 -7.142 44 H ALA 5 H ALA 5 -21.736 5.463 1.541 45 HA ALA 5 HA ALA 5 -19.122 4.586 1.947 46 1HB ALA 5 1HB ALA 5 -19.934 5.572 3.828 47 2HB ALA 5 2HB ALA 5 -20.177 3.878 4.267 48 3HB ALA 5 3HB ALA 5 -21.529 4.834 3.660 49 H ASP 6 H ASP 6 -22.168 2.759 2.071 50 HA ASP 6 HA ASP 6 -20.823 0.266 2.474 51 1HB ASP 6 1HB ASP 6 -23.119 0.636 3.297 52 2HB ASP 6 2HB ASP 6 -23.682 0.799 1.636 53 H GLU 7 H GLU 7 -21.980 2.054 -0.302 54 HA GLU 7 HA GLU 7 -21.959 0.012 -2.201 55 1HB GLU 7 1HB GLU 7 -22.789 2.301 -2.639 56 2HB GLU 7 2HB GLU 7 -21.136 2.900 -2.586 57 1HG GLU 7 1HG GLU 7 -20.560 1.626 -4.543 58 2HG GLU 7 2HG GLU 7 -22.154 0.872 -4.562 59 H ASN 8 H ASN 8 -19.346 2.030 -0.948 60 HA ASN 8 HA ASN 8 -17.397 0.814 -2.649 61 1HB ASN 8 1HB ASN 8 -15.749 2.182 -1.473 62 2HB ASN 8 2HB ASN 8 -17.159 3.157 -1.963 63 1HD2 ASN 8 1HD2 ASN 8 -17.386 4.664 -0.483 64 2HD2 ASN 8 2HD2 ASN 8 -17.411 4.418 1.226 65 H LYS 9 H LYS 9 -18.578 0.292 0.580 66 HA LYS 9 HA LYS 9 -16.511 -1.207 1.673 67 1HB LYS 9 1HB LYS 9 -18.557 -0.471 2.883 68 2HB LYS 9 2HB LYS 9 -19.475 -1.697 2.020 69 1HG LYS 9 1HG LYS 9 -18.190 -3.453 3.064 70 2HG LYS 9 2HG LYS 9 -17.154 -2.263 3.854 71 1HD LYS 9 1HD LYS 9 -19.157 -1.388 5.038 72 2HD LYS 9 2HD LYS 9 -20.105 -2.693 4.322 73 1HE LYS 9 1HE LYS 9 -17.701 -3.059 6.105 74 2HE LYS 9 2HE LYS 9 -19.379 -3.199 6.622 75 1HZ LYS 9 1HZ LYS 9 -18.155 -4.874 4.500 76 2HZ LYS 9 2HZ LYS 9 -18.287 -5.348 6.119 77 3HZ LYS 9 3HZ LYS 9 -19.681 -5.073 5.201 78 H VAL 10 H VAL 10 -19.175 -2.243 -0.411 79 HA VAL 10 HA VAL 10 -18.364 -4.994 -0.396 80 HB VAL 10 HB VAL 10 -20.076 -5.186 -2.270 81 1HG1 VAL 10 1HG1 VAL 10 -20.560 -5.759 0.052 82 2HG1 VAL 10 2HG1 VAL 10 -20.951 -4.061 0.396 83 3HG1 VAL 10 3HG1 VAL 10 -21.965 -4.996 -0.723 84 1HG2 VAL 10 1HG2 VAL 10 -19.902 -2.739 -2.868 85 2HG2 VAL 10 2HG2 VAL 10 -21.539 -3.369 -2.698 86 3HG2 VAL 10 3HG2 VAL 10 -20.828 -2.402 -1.406 87 H LYS 11 H LYS 11 -18.161 -2.339 -2.785 88 HA LYS 11 HA LYS 11 -17.105 -3.869 -4.879 89 1HB LYS 11 1HB LYS 11 -16.655 -1.872 -5.977 90 2HB LYS 11 2HB LYS 11 -17.960 -1.431 -4.886 91 1HG LYS 11 1HG LYS 11 -16.317 -0.490 -3.324 92 2HG LYS 11 2HG LYS 11 -15.028 -0.901 -4.452 93 1HD LYS 11 1HD LYS 11 -17.343 0.929 -5.077 94 2HD LYS 11 2HD LYS 11 -15.735 1.471 -4.597 95 1HE LYS 11 1HE LYS 11 -14.786 0.359 -6.568 96 2HE LYS 11 2HE LYS 11 -16.401 -0.161 -7.048 97 1HZ LYS 11 1HZ LYS 11 -17.038 2.180 -7.220 98 2HZ LYS 11 2HZ LYS 11 -15.461 2.647 -6.826 99 3HZ LYS 11 3HZ LYS 11 -15.758 1.804 -8.261 100 H GLY 12 H GLY 12 -15.530 -2.430 -2.095 101 1HA GLY 12 1HA GLY 12 -13.317 -2.392 -1.437 102 2HA GLY 12 2HA GLY 12 -12.866 -2.835 -3.077 103 H GLU 13 H GLU 13 -14.803 -4.411 -0.525 104 HA GLU 13 HA GLU 13 -12.942 -6.409 0.082 105 1HB GLU 13 1HB GLU 13 -15.953 -6.407 0.309 106 2HB GLU 13 2HB GLU 13 -14.927 -7.671 0.971 107 1HG GLU 13 1HG GLU 13 -13.810 -6.007 2.384 108 2HG GLU 13 2HG GLU 13 -14.878 -4.761 1.739 109 H ALA 14 H ALA 14 -15.133 -6.067 -2.561 110 HA ALA 14 HA ALA 14 -15.089 -8.837 -3.339 111 1HB ALA 14 1HB ALA 14 -17.014 -7.481 -3.905 112 2HB ALA 14 2HB ALA 14 -16.225 -8.038 -5.380 113 3HB ALA 14 3HB ALA 14 -15.999 -6.377 -4.833 114 H PHE 15 H PHE 15 -13.388 -5.882 -4.239 115 HA PHE 15 HA PHE 15 -12.030 -6.885 -6.480 116 1HB PHE 15 1HB PHE 15 -11.784 -4.620 -6.411 117 2HB PHE 15 2HB PHE 15 -11.701 -4.580 -4.637 118 HD1 PHE 15 HD1 PHE 15 -9.707 -4.073 -3.656 119 HD2 PHE 15 HD2 PHE 15 -9.681 -5.715 -7.580 120 HE1 PHE 15 HE1 PHE 15 -7.265 -3.750 -3.768 121 HE2 PHE 15 HE2 PHE 15 -7.239 -5.416 -7.694 122 HZ PHE 15 HZ PHE 15 -6.027 -4.434 -5.783 123 H LEU 16 H LEU 16 -10.958 -6.653 -3.074 124 HA LEU 16 HA LEU 16 -8.506 -7.990 -3.583 125 1HB LEU 16 1HB LEU 16 -8.617 -8.383 -1.014 126 2HB LEU 16 2HB LEU 16 -8.333 -6.787 -1.675 127 HG LEU 16 HG LEU 16 -10.961 -6.595 -1.458 128 1HD1 LEU 16 1HD1 LEU 16 -11.224 -8.941 -0.729 129 2HD1 LEU 16 2HD1 LEU 16 -10.269 -8.579 0.707 130 3HD1 LEU 16 3HD1 LEU 16 -11.825 -7.787 0.461 131 1HD2 LEU 16 1HD2 LEU 16 -9.248 -5.201 -0.339 132 2HD2 LEU 16 2HD2 LEU 16 -10.654 -5.518 0.674 133 3HD2 LEU 16 3HD2 LEU 16 -9.153 -6.402 0.947 134 H THR 17 H THR 17 -11.711 -9.112 -2.719 135 HA THR 17 HA THR 17 -11.082 -11.714 -1.917 136 HB THR 17 HB THR 17 -13.519 -10.577 -3.289 137 HG1 THR 17 HG1 THR 17 -14.273 -11.416 -1.059 138 1HG2 THR 17 1HG2 THR 17 -13.082 -13.428 -2.370 139 2HG2 THR 17 2HG2 THR 17 -14.659 -12.729 -2.786 140 3HG2 THR 17 3HG2 THR 17 -13.400 -12.881 -4.027 141 H GLU 18 H GLU 18 -11.721 -10.382 -5.131 142 HA GLU 18 HA GLU 18 -11.222 -12.852 -6.490 143 1HB GLU 18 1HB GLU 18 -12.669 -11.100 -7.452 144 2HB GLU 18 2HB GLU 18 -11.285 -10.021 -7.559 145 1HG GLU 18 1HG GLU 18 -11.743 -10.956 -9.719 146 2HG GLU 18 2HG GLU 18 -10.211 -11.591 -9.119 147 H ASN 19 H ASN 19 -9.363 -10.082 -5.511 148 HA ASN 19 HA ASN 19 -7.099 -10.379 -7.117 149 1HB ASN 19 1HB ASN 19 -7.091 -8.363 -6.013 150 2HB ASN 19 2HB ASN 19 -7.670 -9.061 -4.499 151 1HD2 ASN 19 1HD2 ASN 19 -6.195 -10.234 -3.202 152 2HD2 ASN 19 2HD2 ASN 19 -4.499 -9.944 -3.302 153 H LYS 20 H LYS 20 -8.089 -12.183 -4.302 154 HA LYS 20 HA LYS 20 -5.711 -13.105 -3.297 155 1HB LYS 20 1HB LYS 20 -6.877 -14.983 -2.421 156 2HB LYS 20 2HB LYS 20 -7.979 -13.617 -2.404 157 1HG LYS 20 1HG LYS 20 -8.877 -14.526 -4.606 158 2HG LYS 20 2HG LYS 20 -7.990 -16.003 -4.217 159 1HD LYS 20 1HD LYS 20 -10.136 -14.696 -2.550 160 2HD LYS 20 2HD LYS 20 -10.292 -16.190 -3.474 161 1HE LYS 20 1HE LYS 20 -8.442 -15.737 -1.135 162 2HE LYS 20 2HE LYS 20 -9.960 -16.634 -1.086 163 1HZ LYS 20 1HZ LYS 20 -9.008 -18.189 -2.711 164 2HZ LYS 20 2HZ LYS 20 -7.538 -17.356 -2.648 165 3HZ LYS 20 3HZ LYS 20 -8.121 -18.150 -1.271 166 H ASN 21 H ASN 21 -6.987 -13.701 -6.403 167 HA ASN 21 HA ASN 21 -5.766 -16.198 -6.942 168 1HB ASN 21 1HB ASN 21 -6.740 -14.012 -8.781 169 2HB ASN 21 2HB ASN 21 -6.180 -15.588 -9.337 170 1HD2 ASN 21 1HD2 ASN 21 -7.961 -15.025 -6.385 171 2HD2 ASN 21 2HD2 ASN 21 -9.387 -15.865 -6.863 172 H LYS 22 H LYS 22 -4.669 -12.866 -7.271 173 HA LYS 22 HA LYS 22 -2.531 -13.057 -8.951 174 1HB LYS 22 1HB LYS 22 -2.456 -11.551 -6.336 175 2HB LYS 22 2HB LYS 22 -1.520 -11.203 -7.781 176 1HG LYS 22 1HG LYS 22 -4.395 -10.670 -7.212 177 2HG LYS 22 2HG LYS 22 -3.166 -9.610 -7.896 178 1HD LYS 22 1HD LYS 22 -3.200 -11.092 -9.942 179 2HD LYS 22 2HD LYS 22 -4.627 -11.868 -9.248 180 1HE LYS 22 1HE LYS 22 -5.242 -10.132 -10.855 181 2HE LYS 22 2HE LYS 22 -5.799 -9.737 -9.229 182 1HZ LYS 22 1HZ LYS 22 -3.892 -8.264 -8.983 183 2HZ LYS 22 2HZ LYS 22 -3.378 -8.634 -10.551 184 3HZ LYS 22 3HZ LYS 22 -4.837 -7.813 -10.313 185 HA PRO 23 HA PRO 23 0.119 -16.168 -7.164 186 1HB PRO 23 1HB PRO 23 2.421 -15.363 -8.476 187 2HB PRO 23 2HB PRO 23 1.206 -16.461 -9.143 188 1HG PRO 23 1HG PRO 23 1.571 -13.529 -9.595 189 2HG PRO 23 2HG PRO 23 1.120 -14.797 -10.751 190 1HD PRO 23 1HD PRO 23 -0.703 -13.118 -9.734 191 2HD PRO 23 2HD PRO 23 -1.090 -14.825 -10.048 192 H GLY 24 H GLY 24 1.314 -16.215 -5.344 193 1HA GLY 24 1HA GLY 24 3.068 -13.996 -4.682 194 2HA GLY 24 2HA GLY 24 2.949 -15.520 -3.824 195 H VAL 25 H VAL 25 -0.175 -14.481 -4.165 196 HA VAL 25 HA VAL 25 -0.433 -12.398 -2.329 197 HB VAL 25 HB VAL 25 -2.327 -14.616 -3.075 198 1HG1 VAL 25 1HG1 VAL 25 -2.743 -13.949 -0.710 199 2HG1 VAL 25 2HG1 VAL 25 -2.994 -12.292 -1.269 200 3HG1 VAL 25 3HG1 VAL 25 -4.081 -13.578 -1.798 201 1HG2 VAL 25 1HG2 VAL 25 -1.706 -12.624 -4.589 202 2HG2 VAL 25 2HG2 VAL 25 -3.414 -13.017 -4.373 203 3HG2 VAL 25 3HG2 VAL 25 -2.697 -11.673 -3.482 204 H VAL 26 H VAL 26 0.584 -12.434 -0.445 205 HA VAL 26 HA VAL 26 0.091 -14.710 1.357 206 HB VAL 26 HB VAL 26 2.412 -14.770 0.602 207 1HG1 VAL 26 1HG1 VAL 26 2.502 -12.279 0.158 208 2HG1 VAL 26 2HG1 VAL 26 2.823 -12.086 1.884 209 3HG1 VAL 26 3HG1 VAL 26 3.942 -13.005 0.876 210 1HG2 VAL 26 1HG2 VAL 26 1.888 -15.475 2.889 211 2HG2 VAL 26 2HG2 VAL 26 3.506 -14.771 2.781 212 3HG2 VAL 26 3HG2 VAL 26 2.175 -13.827 3.458 213 H VAL 27 H VAL 27 -0.584 -14.224 3.375 214 HA VAL 27 HA VAL 27 -1.205 -11.449 3.936 215 HB VAL 27 HB VAL 27 -2.942 -13.083 4.377 216 1HG1 VAL 27 1HG1 VAL 27 -1.002 -14.313 6.331 217 2HG1 VAL 27 2HG1 VAL 27 -2.696 -14.770 6.147 218 3HG1 VAL 27 3HG1 VAL 27 -1.562 -15.031 4.821 219 1HG2 VAL 27 1HG2 VAL 27 -2.824 -11.091 5.812 220 2HG2 VAL 27 2HG2 VAL 27 -3.508 -12.477 6.663 221 3HG2 VAL 27 3HG2 VAL 27 -1.839 -11.990 6.966 222 H LEU 28 H LEU 28 -0.409 -10.243 5.614 223 HA LEU 28 HA LEU 28 2.041 -11.258 6.865 224 1HB LEU 28 1HB LEU 28 0.992 -8.449 6.520 225 2HB LEU 28 2HB LEU 28 2.471 -8.849 7.369 226 HG LEU 28 HG LEU 28 1.911 -9.202 4.430 227 1HD1 LEU 28 1HD1 LEU 28 2.451 -6.926 5.160 228 2HD1 LEU 28 2HD1 LEU 28 3.938 -7.525 5.897 229 3HD1 LEU 28 3HD1 LEU 28 3.722 -7.616 4.149 230 1HD2 LEU 28 1HD2 LEU 28 4.253 -10.121 6.091 231 2HD2 LEU 28 2HD2 LEU 28 3.187 -11.107 5.089 232 3HD2 LEU 28 3HD2 LEU 28 4.300 -9.966 4.334 233 HA PRO 29 HA PRO 29 0.535 -11.352 11.028 234 1HB PRO 29 1HB PRO 29 2.394 -9.129 11.736 235 2HB PRO 29 2HB PRO 29 2.189 -10.709 12.501 236 1HG PRO 29 1HG PRO 29 4.290 -10.230 10.944 237 2HG PRO 29 2HG PRO 29 3.464 -11.799 10.896 238 1HD PRO 29 1HD PRO 29 3.342 -9.526 8.959 239 2HD PRO 29 2HD PRO 29 3.312 -11.282 8.651 240 H SER 30 H SER 30 0.947 -8.191 9.538 241 HA SER 30 HA SER 30 -0.979 -6.934 11.287 242 1HB SER 30 1HB SER 30 0.875 -5.577 10.521 243 2HB SER 30 2HB SER 30 0.465 -5.901 8.839 244 HG SER 30 HG SER 30 -1.224 -4.571 10.690 245 H GLY 31 H GLY 31 -1.094 -8.798 8.457 246 1HA GLY 31 1HA GLY 31 -3.905 -8.021 8.120 247 2HA GLY 31 2HA GLY 31 -3.243 -9.594 7.707 248 H LEU 32 H LEU 32 -0.921 -7.857 6.457 249 HA LEU 32 HA LEU 32 -2.305 -6.739 4.171 250 1HB LEU 32 1HB LEU 32 0.587 -6.850 4.956 251 2HB LEU 32 2HB LEU 32 0.058 -6.238 3.398 252 HG LEU 32 HG LEU 32 -1.480 -4.689 4.817 253 1HD1 LEU 32 1HD1 LEU 32 -0.633 -6.047 6.896 254 2HD1 LEU 32 2HD1 LEU 32 0.699 -4.891 6.826 255 3HD1 LEU 32 3HD1 LEU 32 -0.961 -4.320 7.003 256 1HD2 LEU 32 1HD2 LEU 32 0.471 -4.056 3.372 257 2HD2 LEU 32 2HD2 LEU 32 0.178 -2.988 4.744 258 3HD2 LEU 32 3HD2 LEU 32 1.484 -4.169 4.813 259 H GLN 33 H GLN 33 -2.416 -7.481 2.183 260 HA GLN 33 HA GLN 33 -1.059 -10.011 1.517 261 1HB GLN 33 1HB GLN 33 -3.740 -8.983 0.549 262 2HB GLN 33 2HB GLN 33 -2.944 -10.425 -0.062 263 1HG GLN 33 1HG GLN 33 -4.561 -11.186 1.454 264 2HG GLN 33 2HG GLN 33 -2.999 -11.307 2.309 265 1HE2 GLN 33 1HE2 GLN 33 -4.046 -11.270 4.306 266 2HE2 GLN 33 2HE2 GLN 33 -4.711 -9.818 4.965 267 H TYR 34 H TYR 34 -0.024 -10.086 -0.529 268 HA TYR 34 HA TYR 34 -0.291 -7.831 -2.321 269 1HB TYR 34 1HB TYR 34 2.147 -7.233 -2.162 270 2HB TYR 34 2HB TYR 34 1.176 -6.797 -0.759 271 HD1 TYR 34 HD1 TYR 34 3.857 -8.940 -2.013 272 HD2 TYR 34 HD2 TYR 34 1.432 -8.002 1.353 273 HE1 TYR 34 HE1 TYR 34 5.392 -10.184 -0.564 274 HE2 TYR 34 HE2 TYR 34 2.961 -9.242 2.805 275 HH TYR 34 HH TYR 34 6.036 -10.321 1.757 276 H LYS 35 H LYS 35 1.472 -7.887 -4.051 277 HA LYS 35 HA LYS 35 2.036 -10.688 -4.813 278 1HB LYS 35 1HB LYS 35 0.238 -9.458 -6.147 279 2HB LYS 35 2HB LYS 35 1.523 -8.415 -6.738 280 1HG LYS 35 1HG LYS 35 2.566 -10.858 -7.274 281 2HG LYS 35 2HG LYS 35 0.835 -11.176 -7.468 282 1HD LYS 35 1HD LYS 35 2.161 -8.812 -8.766 283 2HD LYS 35 2HD LYS 35 2.160 -10.402 -9.528 284 1HE LYS 35 1HE LYS 35 0.315 -9.144 -10.401 285 2HE LYS 35 2HE LYS 35 -0.324 -10.415 -9.360 286 1HZ LYS 35 1HZ LYS 35 0.081 -7.601 -8.504 287 2HZ LYS 35 2HZ LYS 35 -1.396 -8.231 -9.038 288 3HZ LYS 35 3HZ LYS 35 -0.681 -8.828 -7.625 289 H VAL 36 H VAL 36 4.137 -11.089 -4.834 290 HA VAL 36 HA VAL 36 6.083 -8.964 -4.770 291 HB VAL 36 HB VAL 36 6.527 -11.948 -4.776 292 1HG1 VAL 36 1HG1 VAL 36 8.329 -9.610 -4.197 293 2HG1 VAL 36 2HG1 VAL 36 8.689 -11.250 -3.661 294 3HG1 VAL 36 3HG1 VAL 36 8.554 -10.896 -5.383 295 1HG2 VAL 36 1HG2 VAL 36 6.080 -9.977 -2.554 296 2HG2 VAL 36 2HG2 VAL 36 5.228 -11.488 -2.870 297 3HG2 VAL 36 3HG2 VAL 36 6.894 -11.519 -2.293 298 H ILE 37 H ILE 37 7.209 -8.174 -6.389 299 HA ILE 37 HA ILE 37 7.170 -9.558 -8.976 300 HB ILE 37 HB ILE 37 7.909 -6.697 -8.338 301 1HG1 ILE 37 1HG1 ILE 37 5.464 -7.794 -9.745 302 2HG1 ILE 37 2HG1 ILE 37 5.492 -7.287 -8.059 303 1HG2 ILE 37 1HG2 ILE 37 7.614 -8.105 -10.990 304 2HG2 ILE 37 2HG2 ILE 37 7.870 -6.374 -10.776 305 3HG2 ILE 37 3HG2 ILE 37 9.116 -7.518 -10.279 306 1HD1 ILE 37 1HD1 ILE 37 6.108 -5.016 -8.793 307 2HD1 ILE 37 2HD1 ILE 37 5.963 -5.550 -10.467 308 3HD1 ILE 37 3HD1 ILE 37 4.547 -5.549 -9.417 309 H ASN 38 H ASN 38 9.507 -7.494 -7.196 310 HA ASN 38 HA ASN 38 11.593 -9.488 -7.710 311 1HB ASN 38 1HB ASN 38 11.800 -7.923 -9.559 312 2HB ASN 38 2HB ASN 38 11.803 -6.560 -8.444 313 1HD2 ASN 38 1HD2 ASN 38 13.632 -6.115 -7.246 314 2HD2 ASN 38 2HD2 ASN 38 15.169 -6.820 -7.600 315 H SER 39 H SER 39 11.475 -9.931 -5.469 316 HA SER 39 HA SER 39 12.369 -7.768 -3.689 317 1HB SER 39 1HB SER 39 10.255 -8.817 -3.051 318 2HB SER 39 2HB SER 39 11.038 -10.395 -3.000 319 HG SER 39 HG SER 39 11.428 -8.173 -1.300 320 H GLY 40 H GLY 40 14.105 -8.031 -2.297 321 1HA GLY 40 1HA GLY 40 15.608 -10.536 -2.386 322 2HA GLY 40 2HA GLY 40 15.869 -9.209 -1.267 323 H ASN 41 H ASN 41 17.042 -7.341 -1.999 324 HA ASN 41 HA ASN 41 19.094 -8.073 -3.904 325 1HB ASN 41 1HB ASN 41 18.037 -5.384 -4.485 326 2HB ASN 41 2HB ASN 41 18.639 -6.621 -5.579 327 1HD2 ASN 41 1HD2 ASN 41 15.874 -5.359 -3.915 328 2HD2 ASN 41 2HD2 ASN 41 14.682 -6.253 -4.790 329 H GLY 42 H GLY 42 17.959 -4.970 -2.558 330 1HA GLY 42 1HA GLY 42 19.337 -3.260 -1.733 331 2HA GLY 42 2HA GLY 42 20.680 -4.389 -1.699 332 H VAL 43 H VAL 43 21.035 -3.280 0.333 333 HA VAL 43 HA VAL 43 19.896 -4.766 2.563 334 HB VAL 43 HB VAL 43 22.052 -2.684 2.808 335 1HG1 VAL 43 1HG1 VAL 43 21.279 -5.159 4.323 336 2HG1 VAL 43 2HG1 VAL 43 22.855 -4.391 4.523 337 3HG1 VAL 43 3HG1 VAL 43 21.385 -3.497 4.904 338 1HG2 VAL 43 1HG2 VAL 43 22.725 -4.079 0.933 339 2HG2 VAL 43 2HG2 VAL 43 23.735 -4.406 2.342 340 3HG2 VAL 43 3HG2 VAL 43 22.452 -5.530 1.897 341 H LYS 44 H LYS 44 19.717 -3.284 4.677 342 HA LYS 44 HA LYS 44 19.060 -0.623 4.702 343 1HB LYS 44 1HB LYS 44 16.564 -0.656 4.509 344 2HB LYS 44 2HB LYS 44 17.408 -0.929 2.994 345 1HG LYS 44 1HG LYS 44 15.826 -2.552 2.844 346 2HG LYS 44 2HG LYS 44 17.087 -3.461 3.677 347 1HD LYS 44 1HD LYS 44 15.998 -2.901 5.834 348 2HD LYS 44 2HD LYS 44 14.699 -2.114 4.937 349 1HE LYS 44 1HE LYS 44 14.052 -4.367 5.579 350 2HE LYS 44 2HE LYS 44 14.189 -4.236 3.826 351 1HZ LYS 44 1HZ LYS 44 16.390 -5.252 3.978 352 2HZ LYS 44 2HZ LYS 44 16.214 -5.414 5.653 353 3HZ LYS 44 3HZ LYS 44 15.197 -6.271 4.608 354 HA PRO 45 HA PRO 45 18.232 -1.556 8.925 355 1HB PRO 45 1HB PRO 45 16.784 0.939 9.226 356 2HB PRO 45 2HB PRO 45 18.403 0.521 9.785 357 1HG PRO 45 1HG PRO 45 17.935 2.318 7.803 358 2HG PRO 45 2HG PRO 45 19.406 1.332 7.892 359 1HD PRO 45 1HD PRO 45 16.953 0.927 6.219 360 2HD PRO 45 2HD PRO 45 18.662 0.746 5.774 361 H GLY 46 H GLY 46 16.529 -1.474 10.617 362 1HA GLY 46 1HA GLY 46 14.538 -2.305 11.395 363 2HA GLY 46 2HA GLY 46 14.226 -2.897 9.767 364 H LYS 47 H LYS 47 12.077 -1.983 11.093 365 HA LYS 47 HA LYS 47 10.816 -0.266 9.428 366 1HB LYS 47 1HB LYS 47 10.400 -0.554 12.398 367 2HB LYS 47 2HB LYS 47 9.275 0.265 11.324 368 1HG LYS 47 1HG LYS 47 8.861 -1.771 10.118 369 2HG LYS 47 2HG LYS 47 10.105 -2.614 11.043 370 1HD LYS 47 1HD LYS 47 7.666 -1.362 12.292 371 2HD LYS 47 2HD LYS 47 7.737 -3.047 11.773 372 1HE LYS 47 1HE LYS 47 9.668 -3.392 13.273 373 2HE LYS 47 2HE LYS 47 9.503 -1.728 13.830 374 1HZ LYS 47 1HZ LYS 47 7.284 -2.264 14.637 375 2HZ LYS 47 2HZ LYS 47 7.461 -3.865 14.117 376 3HZ LYS 47 3HZ LYS 47 8.445 -3.263 15.354 377 H SER 48 H SER 48 13.311 0.718 11.553 378 HA SER 48 HA SER 48 12.439 3.489 11.672 379 1HB SER 48 1HB SER 48 13.642 2.528 13.592 380 2HB SER 48 2HB SER 48 15.037 2.199 12.564 381 HG SER 48 HG SER 48 15.487 4.114 13.506 382 H ASP 49 H ASP 49 13.426 1.750 9.236 383 HA ASP 49 HA ASP 49 15.664 3.198 8.167 384 1HB ASP 49 1HB ASP 49 15.341 1.831 6.195 385 2HB ASP 49 2HB ASP 49 15.207 0.823 7.633 386 H THR 50 H THR 50 15.560 4.292 6.061 387 HA THR 50 HA THR 50 13.016 5.731 5.625 388 HB THR 50 HB THR 50 15.808 6.879 5.305 389 HG1 THR 50 HG1 THR 50 15.609 7.339 7.354 390 1HG2 THR 50 1HG2 THR 50 14.158 7.796 3.725 391 2HG2 THR 50 2HG2 THR 50 13.100 8.199 5.078 392 3HG2 THR 50 3HG2 THR 50 14.663 8.998 4.914 393 H VAL 51 H VAL 51 12.244 5.418 3.601 394 HA VAL 51 HA VAL 51 14.178 4.553 1.557 395 HB VAL 51 HB VAL 51 12.732 2.925 0.718 396 1HG1 VAL 51 1HG1 VAL 51 13.748 2.371 2.925 397 2HG1 VAL 51 2HG1 VAL 51 12.219 2.820 3.685 398 3HG1 VAL 51 3HG1 VAL 51 12.278 1.463 2.558 399 1HG2 VAL 51 1HG2 VAL 51 10.529 4.164 2.369 400 2HG2 VAL 51 2HG2 VAL 51 10.679 4.190 0.610 401 3HG2 VAL 51 3HG2 VAL 51 10.376 2.666 1.448 402 H THR 52 H THR 52 14.017 5.361 -0.453 403 HA THR 52 HA THR 52 11.909 7.366 -0.926 404 HB THR 52 HB THR 52 14.658 7.227 -2.198 405 HG1 THR 52 HG1 THR 52 15.243 8.250 -0.444 406 1HG2 THR 52 1HG2 THR 52 12.434 9.257 -2.415 407 2HG2 THR 52 2HG2 THR 52 14.070 9.499 -3.028 408 3HG2 THR 52 3HG2 THR 52 13.055 8.222 -3.700 409 H VAL 53 H VAL 53 10.452 6.749 -2.383 410 HA VAL 53 HA VAL 53 11.282 5.075 -4.629 411 HB VAL 53 HB VAL 53 9.598 3.425 -4.307 412 1HG1 VAL 53 1HG1 VAL 53 11.652 3.116 -2.986 413 2HG1 VAL 53 2HG1 VAL 53 10.867 3.927 -1.613 414 3HG1 VAL 53 3HG1 VAL 53 10.230 2.381 -2.214 415 1HG2 VAL 53 1HG2 VAL 53 8.616 5.118 -2.012 416 2HG2 VAL 53 2HG2 VAL 53 7.773 4.778 -3.525 417 3HG2 VAL 53 3HG2 VAL 53 8.050 3.483 -2.360 418 H GLU 54 H GLU 54 9.247 4.647 -6.035 419 HA GLU 54 HA GLU 54 7.604 7.085 -6.176 420 1HB GLU 54 1HB GLU 54 9.325 7.092 -7.946 421 2HB GLU 54 2HB GLU 54 8.771 5.514 -8.488 422 1HG GLU 54 1HG GLU 54 6.910 7.855 -8.417 423 2HG GLU 54 2HG GLU 54 8.013 7.606 -9.770 424 H TYR 55 H TYR 55 5.424 6.707 -6.322 425 HA TYR 55 HA TYR 55 4.556 4.049 -7.158 426 1HB TYR 55 1HB TYR 55 3.309 3.560 -5.225 427 2HB TYR 55 2HB TYR 55 4.870 4.102 -4.635 428 HD1 TYR 55 HD1 TYR 55 5.023 6.628 -3.975 429 HD2 TYR 55 HD2 TYR 55 1.361 4.487 -4.356 430 HE1 TYR 55 HE1 TYR 55 3.908 8.295 -2.555 431 HE2 TYR 55 HE2 TYR 55 0.227 6.154 -2.938 432 HH TYR 55 HH TYR 55 1.687 9.137 -2.096 433 H THR 56 H THR 56 2.345 3.848 -7.557 434 HA THR 56 HA THR 56 0.950 6.389 -8.084 435 HB THR 56 HB THR 56 0.799 3.864 -9.755 436 HG1 THR 56 HG1 THR 56 2.758 4.927 -10.132 437 1HG2 THR 56 1HG2 THR 56 -0.415 6.599 -10.168 438 2HG2 THR 56 2HG2 THR 56 -0.488 5.261 -11.316 439 3HG2 THR 56 3HG2 THR 56 -1.289 5.126 -9.750 440 H GLY 57 H GLY 57 -0.701 6.514 -6.692 441 1HA GLY 57 1HA GLY 57 -1.940 5.430 -4.899 442 2HA GLY 57 2HA GLY 57 -1.991 3.982 -5.894 443 H ARG 58 H ARG 58 -4.171 3.760 -5.878 444 HA ARG 58 HA ARG 58 -5.828 5.978 -6.754 445 1HB ARG 58 1HB ARG 58 -6.846 4.687 -8.586 446 2HB ARG 58 2HB ARG 58 -5.129 4.979 -8.865 447 1HG ARG 58 1HG ARG 58 -5.193 2.793 -9.429 448 2HG ARG 58 2HG ARG 58 -4.945 2.597 -7.690 449 1HD ARG 58 1HD ARG 58 -7.337 2.306 -7.364 450 2HD ARG 58 2HD ARG 58 -7.621 2.572 -9.084 451 HE ARG 58 HE ARG 58 -5.816 0.408 -8.578 452 1HH1 ARG 58 1HH1 ARG 58 -9.176 1.310 -8.756 453 2HH1 ARG 58 2HH1 ARG 58 -9.720 -0.292 -9.126 454 1HH2 ARG 58 1HH2 ARG 58 -6.522 -1.706 -9.065 455 2HH2 ARG 58 2HH2 ARG 58 -8.212 -2.007 -9.300 456 H LEU 59 H LEU 59 -7.978 5.758 -6.216 457 HA LEU 59 HA LEU 59 -8.540 3.960 -4.051 458 1HB LEU 59 1HB LEU 59 -9.375 6.297 -4.167 459 2HB LEU 59 2HB LEU 59 -10.364 5.852 -5.544 460 HG LEU 59 HG LEU 59 -11.598 4.254 -4.083 461 1HD1 LEU 59 1HD1 LEU 59 -9.871 3.893 -2.403 462 2HD1 LEU 59 2HD1 LEU 59 -10.005 5.574 -1.889 463 3HD1 LEU 59 3HD1 LEU 59 -11.362 4.472 -1.661 464 1HD2 LEU 59 1HD2 LEU 59 -12.464 6.485 -4.553 465 2HD2 LEU 59 2HD2 LEU 59 -12.876 5.979 -2.916 466 3HD2 LEU 59 3HD2 LEU 59 -11.569 7.132 -3.177 467 H ILE 60 H ILE 60 -10.437 2.528 -4.019 468 HA ILE 60 HA ILE 60 -10.412 0.666 -6.088 469 HB ILE 60 HB ILE 60 -11.260 0.202 -3.798 470 1HG1 ILE 60 1HG1 ILE 60 -13.102 -1.289 -4.477 471 2HG1 ILE 60 2HG1 ILE 60 -13.230 -0.429 -6.009 472 1HG2 ILE 60 1HG2 ILE 60 -12.558 2.232 -3.472 473 2HG2 ILE 60 2HG2 ILE 60 -13.700 1.714 -4.717 474 3HG2 ILE 60 3HG2 ILE 60 -13.557 0.798 -3.213 475 1HD1 ILE 60 1HD1 ILE 60 -10.837 -1.996 -5.073 476 2HD1 ILE 60 2HD1 ILE 60 -12.041 -2.539 -6.243 477 3HD1 ILE 60 3HD1 ILE 60 -10.998 -1.168 -6.624 478 H ASP 61 H ASP 61 -11.718 3.735 -6.026 479 HA ASP 61 HA ASP 61 -14.054 3.411 -7.596 480 1HB ASP 61 1HB ASP 61 -13.534 5.450 -6.273 481 2HB ASP 61 2HB ASP 61 -12.248 5.833 -7.414 482 H GLY 62 H GLY 62 -10.788 3.035 -8.369 483 1HA GLY 62 1HA GLY 62 -11.470 2.829 -11.194 484 2HA GLY 62 2HA GLY 62 -10.008 2.228 -10.431 485 H THR 63 H THR 63 -10.361 5.308 -9.305 486 HA THR 63 HA THR 63 -8.815 6.424 -11.549 487 HB THR 63 HB THR 63 -10.953 7.551 -11.421 488 HG1 THR 63 HG1 THR 63 -10.122 9.579 -11.406 489 1HG2 THR 63 1HG2 THR 63 -11.496 7.042 -9.084 490 2HG2 THR 63 2HG2 THR 63 -10.244 8.165 -8.549 491 3HG2 THR 63 3HG2 THR 63 -11.656 8.768 -9.418 492 H VAL 64 H VAL 64 -6.987 7.567 -11.088 493 HA VAL 64 HA VAL 64 -5.617 6.976 -8.700 494 HB VAL 64 HB VAL 64 -4.394 7.339 -10.764 495 1HG1 VAL 64 1HG1 VAL 64 -5.903 8.997 -11.765 496 2HG1 VAL 64 2HG1 VAL 64 -5.316 10.207 -10.624 497 3HG1 VAL 64 3HG1 VAL 64 -4.219 9.516 -11.820 498 1HG2 VAL 64 1HG2 VAL 64 -3.822 9.377 -8.622 499 2HG2 VAL 64 2HG2 VAL 64 -3.121 7.768 -8.799 500 3HG2 VAL 64 3HG2 VAL 64 -2.727 9.035 -9.962 501 H PHE 65 H PHE 65 -5.442 8.067 -6.853 502 HA PHE 65 HA PHE 65 -6.994 10.525 -6.598 503 1HB PHE 65 1HB PHE 65 -6.878 10.140 -4.165 504 2HB PHE 65 2HB PHE 65 -7.546 8.755 -5.019 505 HD1 PHE 65 HD1 PHE 65 -4.132 8.548 -5.611 506 HD2 PHE 65 HD2 PHE 65 -6.961 8.101 -2.481 507 HE1 PHE 65 HE1 PHE 65 -2.547 7.133 -4.404 508 HE2 PHE 65 HE2 PHE 65 -5.387 6.659 -1.281 509 HZ PHE 65 HZ PHE 65 -3.159 6.184 -2.229 510 H ASP 66 H ASP 66 -3.759 9.388 -6.657 511 HA ASP 66 HA ASP 66 -2.646 11.931 -6.860 512 1HB ASP 66 1HB ASP 66 -3.116 12.131 -4.463 513 2HB ASP 66 2HB ASP 66 -2.246 10.632 -4.153 514 H SER 67 H SER 67 -0.732 11.730 -7.867 515 HA SER 67 HA SER 67 0.730 9.190 -7.576 516 1HB SER 67 1HB SER 67 1.270 9.305 -10.008 517 2HB SER 67 2HB SER 67 -0.452 9.085 -9.692 518 HG SER 67 HG SER 67 0.524 11.691 -9.958 519 H THR 68 H THR 68 2.777 9.471 -6.966 520 HA THR 68 HA THR 68 3.906 12.123 -6.871 521 HB THR 68 HB THR 68 5.819 11.110 -5.757 522 HG1 THR 68 HG1 THR 68 4.600 8.566 -6.117 523 1HG2 THR 68 1HG2 THR 68 3.801 11.517 -4.424 524 2HG2 THR 68 2HG2 THR 68 3.218 9.897 -4.804 525 3HG2 THR 68 3HG2 THR 68 4.679 10.104 -3.838 526 H GLU 69 H GLU 69 3.861 9.613 -9.132 527 HA GLU 69 HA GLU 69 6.427 10.062 -10.320 528 1HB GLU 69 1HB GLU 69 5.003 7.948 -10.476 529 2HB GLU 69 2HB GLU 69 4.032 8.812 -11.659 530 1HG GLU 69 1HG GLU 69 6.995 8.394 -11.938 531 2HG GLU 69 2HG GLU 69 5.788 7.287 -12.591 532 H LYS 70 H LYS 70 3.094 10.895 -11.253 533 HA LYS 70 HA LYS 70 3.756 12.365 -13.545 534 1HB LYS 70 1HB LYS 70 1.472 11.544 -12.980 535 2HB LYS 70 2HB LYS 70 1.369 12.787 -11.740 536 1HG LYS 70 1HG LYS 70 1.717 14.488 -13.543 537 2HG LYS 70 2HG LYS 70 1.561 13.179 -14.716 538 1HD LYS 70 1HD LYS 70 -0.606 13.905 -14.651 539 2HD LYS 70 2HD LYS 70 -0.655 12.703 -13.359 540 1HE LYS 70 1HE LYS 70 -0.258 15.673 -13.003 541 2HE LYS 70 2HE LYS 70 -1.747 14.787 -12.683 542 1HZ LYS 70 1HZ LYS 70 -0.539 13.509 -10.992 543 2HZ LYS 70 2HZ LYS 70 0.842 14.445 -11.269 544 3HZ LYS 70 3HZ LYS 70 -0.556 15.165 -10.645 545 H THR 71 H THR 71 3.514 13.300 -10.165 546 HA THR 71 HA THR 71 3.589 16.075 -10.447 547 HB THR 71 HB THR 71 4.874 14.455 -8.237 548 HG1 THR 71 HG1 THR 71 2.296 15.595 -8.107 549 1HG2 THR 71 1HG2 THR 71 5.533 16.810 -8.223 550 2HG2 THR 71 2HG2 THR 71 3.838 17.292 -8.278 551 3HG2 THR 71 3HG2 THR 71 4.469 16.446 -6.865 552 H GLY 72 H GLY 72 5.997 13.715 -11.052 553 1HA GLY 72 1HA GLY 72 7.856 15.754 -11.910 554 2HA GLY 72 2HA GLY 72 8.049 14.017 -12.097 555 H LYS 73 H LYS 73 7.240 14.296 -8.992 556 HA LYS 73 HA LYS 73 10.042 14.552 -8.133 557 1HB LYS 73 1HB LYS 73 7.565 15.572 -6.742 558 2HB LYS 73 2HB LYS 73 9.136 15.449 -5.963 559 1HG LYS 73 1HG LYS 73 8.603 17.069 -8.439 560 2HG LYS 73 2HG LYS 73 8.587 17.718 -6.798 561 1HD LYS 73 1HD LYS 73 10.924 17.020 -6.516 562 2HD LYS 73 2HD LYS 73 10.932 16.403 -8.170 563 1HE LYS 73 1HE LYS 73 10.515 19.268 -7.321 564 2HE LYS 73 2HE LYS 73 11.958 18.601 -8.084 565 1HZ LYS 73 1HZ LYS 73 10.627 18.092 -10.045 566 2HZ LYS 73 2HZ LYS 73 9.259 18.766 -9.313 567 3HZ LYS 73 3HZ LYS 73 10.584 19.744 -9.692 568 HA PRO 74 HA PRO 74 9.318 10.291 -6.887 569 1HB PRO 74 1HB PRO 74 11.741 10.900 -5.270 570 2HB PRO 74 2HB PRO 74 11.424 9.537 -6.349 571 1HG PRO 74 1HG PRO 74 13.044 11.524 -7.086 572 2HG PRO 74 2HG PRO 74 11.953 10.749 -8.249 573 1HD PRO 74 1HD PRO 74 11.729 13.410 -6.922 574 2HD PRO 74 2HD PRO 74 11.227 12.909 -8.548 575 H ALA 75 H ALA 75 8.760 9.200 -4.943 576 HA ALA 75 HA ALA 75 7.839 11.003 -2.846 577 1HB ALA 75 1HB ALA 75 7.256 8.071 -3.071 578 2HB ALA 75 2HB ALA 75 6.375 9.286 -2.150 579 3HB ALA 75 3HB ALA 75 6.321 9.302 -3.912 580 H THR 76 H THR 76 8.890 11.208 -0.966 581 HA THR 76 HA THR 76 10.681 9.022 -0.127 582 HB THR 76 HB THR 76 12.145 10.716 -0.937 583 HG1 THR 76 HG1 THR 76 13.107 11.409 1.141 584 1HG2 THR 76 1HG2 THR 76 10.564 12.592 -0.960 585 2HG2 THR 76 2HG2 THR 76 10.650 12.685 0.800 586 3HG2 THR 76 3HG2 THR 76 12.079 13.036 -0.172 587 H PHE 77 H PHE 77 10.061 8.204 1.718 588 HA PHE 77 HA PHE 77 9.380 9.875 3.971 589 1HB PHE 77 1HB PHE 77 7.183 8.800 4.355 590 2HB PHE 77 2HB PHE 77 7.209 9.739 2.865 591 HD1 PHE 77 HD1 PHE 77 7.198 8.643 0.702 592 HD2 PHE 77 HD2 PHE 77 6.975 6.396 4.316 593 HE1 PHE 77 HE1 PHE 77 6.456 6.673 -0.572 594 HE2 PHE 77 HE2 PHE 77 6.239 4.421 3.044 595 HZ PHE 77 HZ PHE 77 5.979 4.563 0.597 596 H GLN 78 H GLN 78 8.937 8.510 5.936 597 HA GLN 78 HA GLN 78 10.792 6.276 5.980 598 1HB GLN 78 1HB GLN 78 10.522 8.113 7.794 599 2HB GLN 78 2HB GLN 78 9.111 7.194 8.300 600 1HG GLN 78 1HG GLN 78 10.692 5.188 8.402 601 2HG GLN 78 2HG GLN 78 11.987 6.384 8.347 602 1HE2 GLN 78 1HE2 GLN 78 9.237 5.222 10.141 603 2HE2 GLN 78 2HE2 GLN 78 9.696 5.898 11.667 604 H VAL 79 H VAL 79 10.221 4.153 6.527 605 HA VAL 79 HA VAL 79 7.732 3.280 5.497 606 HB VAL 79 HB VAL 79 8.441 1.026 6.184 607 1HG1 VAL 79 1HG1 VAL 79 9.203 1.962 4.063 608 2HG1 VAL 79 2HG1 VAL 79 10.606 2.664 4.868 609 3HG1 VAL 79 3HG1 VAL 79 10.432 0.911 4.766 610 1HG2 VAL 79 1HG2 VAL 79 9.536 1.600 8.287 611 2HG2 VAL 79 2HG2 VAL 79 10.632 0.704 7.229 612 3HG2 VAL 79 3HG2 VAL 79 10.806 2.454 7.403 613 H SER 80 H SER 80 8.780 4.012 8.750 614 HA SER 80 HA SER 80 6.437 2.660 9.860 615 1HB SER 80 1HB SER 80 8.482 2.272 11.073 616 2HB SER 80 2HB SER 80 8.785 4.002 11.209 617 HG SER 80 HG SER 80 7.477 4.087 12.852 618 H GLN 81 H GLN 81 7.085 5.636 8.572 619 HA GLN 81 HA GLN 81 5.578 7.208 10.481 620 1HB GLN 81 1HB GLN 81 6.945 7.808 7.881 621 2HB GLN 81 2HB GLN 81 5.821 8.965 8.581 622 1HG GLN 81 1HG GLN 81 8.233 7.865 10.001 623 2HG GLN 81 2HG GLN 81 8.194 9.398 9.132 624 1HE2 GLN 81 1HE2 GLN 81 7.130 7.662 11.943 625 2HE2 GLN 81 2HE2 GLN 81 6.561 9.033 12.827 626 H VAL 82 H VAL 82 4.580 4.959 8.419 627 HA VAL 82 HA VAL 82 2.203 6.474 7.560 628 HB VAL 82 HB VAL 82 1.896 4.417 6.002 629 1HG1 VAL 82 1HG1 VAL 82 4.065 6.468 5.560 630 2HG1 VAL 82 2HG1 VAL 82 3.335 5.479 4.294 631 3HG1 VAL 82 3HG1 VAL 82 2.352 6.645 5.179 632 1HG2 VAL 82 1HG2 VAL 82 3.678 3.074 7.069 633 2HG2 VAL 82 2HG2 VAL 82 3.944 3.311 5.341 634 3HG2 VAL 82 3HG2 VAL 82 4.867 4.254 6.511 635 H ILE 83 H ILE 83 0.398 4.541 7.064 636 HA ILE 83 HA ILE 83 -0.709 3.963 9.543 637 HB ILE 83 HB ILE 83 -2.185 2.358 8.315 638 1HG1 ILE 83 1HG1 ILE 83 -0.589 3.243 5.901 639 2HG1 ILE 83 2HG1 ILE 83 -0.431 1.665 6.665 640 1HG2 ILE 83 1HG2 ILE 83 -1.803 5.083 7.078 641 2HG2 ILE 83 2HG2 ILE 83 -3.253 4.089 6.939 642 3HG2 ILE 83 3HG2 ILE 83 -2.758 4.711 8.512 643 1HD1 ILE 83 1HD1 ILE 83 -2.963 2.739 5.447 644 2HD1 ILE 83 2HD1 ILE 83 -1.842 1.632 4.655 645 3HD1 ILE 83 3HD1 ILE 83 -2.707 1.122 6.104 646 HA PRO 84 HA PRO 84 1.147 0.431 11.376 647 1HB PRO 84 1HB PRO 84 -1.550 -0.844 11.239 648 2HB PRO 84 2HB PRO 84 -0.441 -0.703 12.609 649 1HG PRO 84 1HG PRO 84 -2.570 0.879 12.431 650 2HG PRO 84 2HG PRO 84 -1.019 1.507 13.019 651 1HD PRO 84 1HD PRO 84 -2.355 1.913 10.389 652 2HD PRO 84 2HD PRO 84 -1.315 3.016 11.313 653 H GLY 85 H GLY 85 -1.369 -0.630 9.072 654 1HA GLY 85 1HA GLY 85 -1.281 -2.106 7.324 655 2HA GLY 85 2HA GLY 85 -0.287 -3.085 8.389 656 H TRP 86 H TRP 86 0.276 0.032 6.745 657 HA TRP 86 HA TRP 86 1.951 -0.950 4.737 658 1HB TRP 86 1HB TRP 86 1.133 1.635 5.732 659 2HB TRP 86 2HB TRP 86 2.832 1.651 5.284 660 HD1 TRP 86 HD1 TRP 86 -0.499 0.469 3.640 661 HE1 TRP 86 HE1 TRP 86 -0.371 1.050 1.130 662 HE3 TRP 86 HE3 TRP 86 4.206 2.457 3.497 663 HZ2 TRP 86 HZ2 TRP 86 1.470 2.203 -0.663 664 HZ3 TRP 86 HZ3 TRP 86 5.074 3.273 1.349 665 HH2 TRP 86 HH2 TRP 86 3.736 3.151 -0.688 666 H THR 87 H THR 87 2.776 0.376 7.929 667 HA THR 87 HA THR 87 5.541 0.390 7.683 668 HB THR 87 HB THR 87 3.883 -0.147 10.153 669 HG1 THR 87 HG1 THR 87 4.170 2.086 10.480 670 1HG2 THR 87 1HG2 THR 87 6.789 0.631 9.888 671 2HG2 THR 87 2HG2 THR 87 5.877 0.616 11.398 672 3HG2 THR 87 3HG2 THR 87 6.161 -0.890 10.525 673 H GLU 88 H GLU 88 3.376 -2.277 8.503 674 HA GLU 88 HA GLU 88 5.377 -4.100 9.306 675 1HB GLU 88 1HB GLU 88 2.722 -4.112 9.483 676 2HB GLU 88 2HB GLU 88 2.880 -5.093 8.032 677 1HG GLU 88 1HG GLU 88 4.139 -5.656 10.707 678 2HG GLU 88 2HG GLU 88 2.741 -6.476 10.007 679 H ALA 89 H ALA 89 3.680 -3.709 6.190 680 HA ALA 89 HA ALA 89 5.034 -5.805 4.874 681 1HB ALA 89 1HB ALA 89 2.963 -4.984 3.999 682 2HB ALA 89 2HB ALA 89 4.222 -4.739 2.788 683 3HB ALA 89 3HB ALA 89 3.648 -3.376 3.755 684 H LEU 90 H LEU 90 5.625 -2.294 4.837 685 HA LEU 90 HA LEU 90 7.760 -2.291 3.052 686 1HB LEU 90 1HB LEU 90 6.816 -0.464 5.198 687 2HB LEU 90 2HB LEU 90 8.429 -0.206 4.563 688 HG LEU 90 HG LEU 90 6.727 1.213 3.467 689 1HD1 LEU 90 1HD1 LEU 90 8.783 0.550 2.287 690 2HD1 LEU 90 2HD1 LEU 90 7.930 -0.839 1.614 691 3HD1 LEU 90 3HD1 LEU 90 7.423 0.796 1.192 692 1HD2 LEU 90 1HD2 LEU 90 5.616 -1.420 2.496 693 2HD2 LEU 90 2HD2 LEU 90 4.824 -0.286 3.590 694 3HD2 LEU 90 3HD2 LEU 90 5.129 0.173 1.916 695 H GLN 91 H GLN 91 7.666 -3.214 6.400 696 HA GLN 91 HA GLN 91 10.423 -2.949 6.970 697 1HB GLN 91 1HB GLN 91 9.033 -3.138 8.844 698 2HB GLN 91 2HB GLN 91 8.173 -4.528 8.184 699 1HG GLN 91 1HG GLN 91 9.466 -5.410 9.899 700 2HG GLN 91 2HG GLN 91 10.375 -5.793 8.441 701 1HE2 GLN 91 1HE2 GLN 91 11.372 -3.062 8.128 702 2HE2 GLN 91 2HE2 GLN 91 12.580 -2.856 9.338 703 H LEU 92 H LEU 92 8.602 -5.307 5.231 704 HA LEU 92 HA LEU 92 10.774 -7.248 5.294 705 1HB LEU 92 1HB LEU 92 7.955 -7.281 4.279 706 2HB LEU 92 2HB LEU 92 9.101 -8.489 3.734 707 HG LEU 92 HG LEU 92 7.695 -9.299 5.577 708 1HD1 LEU 92 1HD1 LEU 92 10.605 -8.974 6.286 709 2HD1 LEU 92 2HD1 LEU 92 9.499 -10.144 7.009 710 3HD1 LEU 92 3HD1 LEU 92 9.901 -10.252 5.295 711 1HD2 LEU 92 1HD2 LEU 92 7.356 -7.162 6.725 712 2HD2 LEU 92 2HD2 LEU 92 7.949 -8.410 7.824 713 3HD2 LEU 92 3HD2 LEU 92 9.049 -7.167 7.223 714 H MET 93 H MET 93 9.931 -4.565 3.498 715 HA MET 93 HA MET 93 10.824 -5.582 0.939 716 1HB MET 93 1HB MET 93 9.735 -2.970 1.918 717 2HB MET 93 2HB MET 93 10.546 -3.062 0.358 718 1HG MET 93 1HG MET 93 8.945 -4.841 -0.299 719 2HG MET 93 2HG MET 93 8.090 -4.569 1.219 720 1HE MET 93 1HE MET 93 9.099 -3.090 -2.258 721 2HE MET 93 2HE MET 93 8.467 -1.447 -2.156 722 3HE MET 93 3HE MET 93 9.827 -1.932 -1.145 723 HA PRO 94 HA PRO 94 15.015 -4.231 2.055 724 1HB PRO 94 1HB PRO 94 16.323 -5.759 0.280 725 2HB PRO 94 2HB PRO 94 15.628 -6.458 1.750 726 1HG PRO 94 1HG PRO 94 14.557 -6.474 -1.045 727 2HG PRO 94 2HG PRO 94 14.596 -7.787 0.147 728 1HD PRO 94 1HD PRO 94 12.384 -6.237 -0.368 729 2HD PRO 94 2HD PRO 94 12.696 -7.067 1.197 730 H ALA 95 H ALA 95 16.373 -2.717 1.072 731 HA ALA 95 HA ALA 95 15.394 -0.965 -0.773 732 1HB ALA 95 1HB ALA 95 17.390 -0.573 0.608 733 2HB ALA 95 2HB ALA 95 18.309 -1.653 -0.439 734 3HB ALA 95 3HB ALA 95 17.652 -0.150 -1.082 735 H GLY 96 H GLY 96 14.971 -0.987 -2.885 736 1HA GLY 96 1HA GLY 96 16.599 -2.689 -4.641 737 2HA GLY 96 2HA GLY 96 15.590 -1.347 -5.159 738 H SER 97 H SER 97 13.927 -3.246 -2.941 739 HA SER 97 HA SER 97 13.046 -5.345 -4.645 740 1HB SER 97 1HB SER 97 12.904 -5.629 -2.248 741 2HB SER 97 2HB SER 97 11.856 -4.218 -2.099 742 HG SER 97 HG SER 97 11.185 -6.757 -2.586 743 H THR 98 H THR 98 10.556 -5.608 -4.942 744 HA THR 98 HA THR 98 9.233 -3.132 -5.722 745 HB THR 98 HB THR 98 9.582 -5.382 -7.715 746 HG1 THR 98 HG1 THR 98 11.019 -2.992 -7.297 747 1HG2 THR 98 1HG2 THR 98 7.508 -4.080 -7.944 748 2HG2 THR 98 2HG2 THR 98 8.458 -2.595 -8.024 749 3HG2 THR 98 3HG2 THR 98 8.605 -3.805 -9.299 750 H TRP 99 H TRP 99 7.707 -3.585 -4.133 751 HA TRP 99 HA TRP 99 6.103 -6.023 -4.537 752 1HB TRP 99 1HB TRP 99 6.769 -4.418 -2.099 753 2HB TRP 99 2HB TRP 99 5.275 -5.343 -2.142 754 HD1 TRP 99 HD1 TRP 99 7.936 -7.157 -3.983 755 HE1 TRP 99 HE1 TRP 99 8.892 -9.046 -2.523 756 HE3 TRP 99 HE3 TRP 99 5.910 -5.824 0.519 757 HZ2 TRP 99 HZ2 TRP 99 8.807 -9.865 0.170 758 HZ3 TRP 99 HZ3 TRP 99 6.397 -7.216 2.488 759 HH2 TRP 99 HH2 TRP 99 7.816 -9.195 2.316 760 H GLU 100 H GLU 100 3.884 -5.924 -4.518 761 HA GLU 100 HA GLU 100 2.684 -3.245 -4.795 762 1HB GLU 100 1HB GLU 100 2.539 -4.209 -6.950 763 2HB GLU 100 2HB GLU 100 2.185 -5.805 -6.307 764 1HG GLU 100 1HG GLU 100 -0.030 -5.254 -5.833 765 2HG GLU 100 2HG GLU 100 0.280 -3.521 -5.948 766 H ILE 101 H ILE 101 1.630 -2.872 -2.928 767 HA ILE 101 HA ILE 101 0.252 -5.134 -1.657 768 HB ILE 101 HB ILE 101 0.380 -3.866 0.437 769 1HG1 ILE 101 1HG1 ILE 101 2.117 -1.928 -1.103 770 2HG1 ILE 101 2HG1 ILE 101 0.453 -1.606 -0.626 771 1HG2 ILE 101 1HG2 ILE 101 3.006 -4.304 -0.971 772 2HG2 ILE 101 2HG2 ILE 101 2.825 -4.081 0.769 773 3HG2 ILE 101 3HG2 ILE 101 2.101 -5.481 -0.019 774 1HD1 ILE 101 1HD1 ILE 101 2.663 -2.225 1.315 775 2HD1 ILE 101 2HD1 ILE 101 2.177 -0.596 0.850 776 3HD1 ILE 101 3HD1 ILE 101 1.035 -1.652 1.684 777 H TYR 102 H TYR 102 -1.773 -4.967 -0.899 778 HA TYR 102 HA TYR 102 -3.319 -2.534 -1.474 779 1HB TYR 102 1HB TYR 102 -5.195 -4.439 -1.864 780 2HB TYR 102 2HB TYR 102 -4.226 -3.773 -3.175 781 HD1 TYR 102 HD1 TYR 102 -4.766 -6.669 -1.004 782 HD2 TYR 102 HD2 TYR 102 -2.475 -5.105 -4.224 783 HE1 TYR 102 HE1 TYR 102 -3.942 -8.927 -1.510 784 HE2 TYR 102 HE2 TYR 102 -1.647 -7.356 -4.741 785 HH TYR 102 HH TYR 102 -1.336 -9.503 -3.615 786 H VAL 103 H VAL 103 -3.687 -1.819 0.549 787 HA VAL 103 HA VAL 103 -4.321 -3.782 2.642 788 HB VAL 103 HB VAL 103 -3.642 -0.890 3.110 789 1HG1 VAL 103 1HG1 VAL 103 -3.456 -3.357 4.837 790 2HG1 VAL 103 2HG1 VAL 103 -2.951 -1.736 5.312 791 3HG1 VAL 103 3HG1 VAL 103 -4.650 -2.067 4.974 792 1HG2 VAL 103 1HG2 VAL 103 -1.824 -1.862 1.804 793 2HG2 VAL 103 2HG2 VAL 103 -1.319 -1.586 3.471 794 3HG2 VAL 103 3HG2 VAL 103 -1.722 -3.215 2.931 795 HA PRO 104 HA PRO 104 -8.551 -2.070 2.167 796 1HB PRO 104 1HB PRO 104 -9.587 -3.982 3.906 797 2HB PRO 104 2HB PRO 104 -9.543 -4.126 2.147 798 1HG PRO 104 1HG PRO 104 -7.737 -5.299 4.197 799 2HG PRO 104 2HG PRO 104 -8.275 -5.975 2.651 800 1HD PRO 104 1HD PRO 104 -5.801 -4.954 2.999 801 2HD PRO 104 2HD PRO 104 -6.666 -4.839 1.450 802 H SER 105 H SER 105 -9.785 -0.876 3.699 803 HA SER 105 HA SER 105 -8.423 0.493 5.637 804 1HB SER 105 1HB SER 105 -10.919 0.671 4.630 805 2HB SER 105 2HB SER 105 -11.283 0.047 6.245 806 HG SER 105 HG SER 105 -10.172 2.491 5.480 807 H GLY 106 H GLY 106 -10.017 -2.615 6.007 808 1HA GLY 106 1HA GLY 106 -10.049 -4.109 7.750 809 2HA GLY 106 2HA GLY 106 -10.273 -2.710 8.781 810 H LEU 107 H LEU 107 -7.371 -2.597 7.010 811 HA LEU 107 HA LEU 107 -5.887 -3.668 9.313 812 1HB LEU 107 1HB LEU 107 -5.138 -3.629 6.398 813 2HB LEU 107 2HB LEU 107 -4.019 -4.033 7.679 814 HG LEU 107 HG LEU 107 -4.712 -6.104 6.846 815 1HD1 LEU 107 1HD1 LEU 107 -4.911 -5.846 9.343 816 2HD1 LEU 107 2HD1 LEU 107 -6.650 -5.687 9.105 817 3HD1 LEU 107 3HD1 LEU 107 -5.829 -7.174 8.633 818 1HD2 LEU 107 1HD2 LEU 107 -6.539 -5.292 5.461 819 2HD2 LEU 107 2HD2 LEU 107 -7.034 -6.699 6.401 820 3HD2 LEU 107 3HD2 LEU 107 -7.547 -5.085 6.892 821 H ALA 108 H ALA 108 -6.694 -0.859 7.762 822 HA ALA 108 HA ALA 108 -4.193 0.465 8.571 823 1HB ALA 108 1HB ALA 108 -4.641 0.796 6.239 824 2HB ALA 108 2HB ALA 108 -6.292 1.318 6.581 825 3HB ALA 108 3HB ALA 108 -4.927 2.321 7.083 826 H TYR 109 H TYR 109 -6.936 2.456 8.003 827 HA TYR 109 HA TYR 109 -6.972 3.175 10.819 828 1HB TYR 109 1HB TYR 109 -7.778 4.487 8.286 829 2HB TYR 109 2HB TYR 109 -8.717 4.901 9.718 830 HD1 TYR 109 HD1 TYR 109 -5.532 5.295 8.003 831 HD2 TYR 109 HD2 TYR 109 -7.590 5.906 11.679 832 HE1 TYR 109 HE1 TYR 109 -3.782 6.864 8.720 833 HE2 TYR 109 HE2 TYR 109 -5.845 7.481 12.401 834 HH TYR 109 HH TYR 109 -3.490 8.718 10.273 835 H GLY 110 H GLY 110 -8.750 1.306 8.605 836 1HA GLY 110 1HA GLY 110 -10.825 0.895 10.645 837 2HA GLY 110 2HA GLY 110 -10.345 -0.270 9.431 838 HA PRO 111 HA PRO 111 -13.350 0.942 6.445 839 1HB PRO 111 1HB PRO 111 -15.399 -0.720 7.241 840 2HB PRO 111 2HB PRO 111 -14.042 -1.212 6.225 841 1HG PRO 111 1HG PRO 111 -14.420 -1.544 9.173 842 2HG PRO 111 2HG PRO 111 -13.780 -2.701 7.989 843 1HD PRO 111 1HD PRO 111 -12.136 -1.338 9.585 844 2HD PRO 111 2HD PRO 111 -11.715 -1.637 7.886 845 H ARG 112 H ARG 112 -13.740 1.469 9.780 846 HA ARG 112 HA ARG 112 -16.438 2.437 9.690 847 1HB ARG 112 1HB ARG 112 -14.292 2.891 11.774 848 2HB ARG 112 2HB ARG 112 -16.005 3.239 11.971 849 1HG ARG 112 1HG ARG 112 -16.479 0.827 11.646 850 2HG ARG 112 2HG ARG 112 -14.740 0.532 11.602 851 1HD ARG 112 1HD ARG 112 -15.539 0.072 13.817 852 2HD ARG 112 2HD ARG 112 -14.569 1.544 13.864 853 HE ARG 112 HE ARG 112 -16.943 2.623 13.643 854 1HH1 ARG 112 1HH1 ARG 112 -16.022 -0.151 15.542 855 2HH1 ARG 112 2HH1 ARG 112 -17.232 0.115 16.753 856 1HH2 ARG 112 1HH2 ARG 112 -18.539 2.980 15.234 857 2HH2 ARG 112 2HH2 ARG 112 -18.661 1.895 16.578 858 H SER 113 H SER 113 -16.851 4.744 10.539 859 HA SER 113 HA SER 113 -16.137 6.562 8.566 860 1HB SER 113 1HB SER 113 -18.122 6.821 9.982 861 2HB SER 113 2HB SER 113 -17.092 7.156 11.374 862 HG SER 113 HG SER 113 -17.980 8.855 9.527 863 H VAL 114 H VAL 114 -14.022 5.332 10.676 864 HA VAL 114 HA VAL 114 -12.557 7.814 11.172 865 HB VAL 114 HB VAL 114 -11.026 6.400 12.516 866 1HG1 VAL 114 1HG1 VAL 114 -12.935 7.530 13.555 867 2HG1 VAL 114 2HG1 VAL 114 -13.940 6.109 13.247 868 3HG1 VAL 114 3HG1 VAL 114 -12.568 5.998 14.358 869 1HG2 VAL 114 1HG2 VAL 114 -11.332 4.302 11.296 870 2HG2 VAL 114 2HG2 VAL 114 -11.644 4.092 13.020 871 3HG2 VAL 114 3HG2 VAL 114 -12.992 4.199 11.887 872 H GLY 115 H GLY 115 -12.889 6.333 8.518 873 1HA GLY 115 1HA GLY 115 -11.606 5.868 6.667 874 2HA GLY 115 2HA GLY 115 -10.411 5.209 7.779 875 H GLY 116 H GLY 116 -8.493 6.172 7.731 876 1HA GLY 116 1HA GLY 116 -6.942 7.893 7.757 877 2HA GLY 116 2HA GLY 116 -8.264 9.042 7.654 878 HA PRO 117 HA PRO 117 -5.990 9.364 3.639 879 1HB PRO 117 1HB PRO 117 -4.361 6.894 3.503 880 2HB PRO 117 2HB PRO 117 -3.876 8.575 3.265 881 1HG PRO 117 1HG PRO 117 -3.197 7.235 5.478 882 2HG PRO 117 2HG PRO 117 -3.607 8.961 5.528 883 1HD PRO 117 1HD PRO 117 -5.243 6.588 6.328 884 2HD PRO 117 2HD PRO 117 -5.125 8.197 7.092 885 H ILE 118 H ILE 118 -6.781 5.989 4.327 886 HA ILE 118 HA ILE 118 -7.698 5.575 1.596 887 HB ILE 118 HB ILE 118 -7.571 3.672 3.945 888 1HG1 ILE 118 1HG1 ILE 118 -5.945 3.738 1.401 889 2HG1 ILE 118 2HG1 ILE 118 -5.401 4.408 2.935 890 1HG2 ILE 118 1HG2 ILE 118 -8.356 3.155 1.080 891 2HG2 ILE 118 2HG2 ILE 118 -8.091 1.913 2.308 892 3HG2 ILE 118 3HG2 ILE 118 -9.415 3.068 2.490 893 1HD1 ILE 118 1HD1 ILE 118 -6.073 1.522 2.413 894 2HD1 ILE 118 2HD1 ILE 118 -4.454 2.208 2.537 895 3HD1 ILE 118 3HD1 ILE 118 -5.515 2.195 3.945 896 H GLY 119 H GLY 119 -9.734 5.846 0.990 897 1HA GLY 119 1HA GLY 119 -12.027 5.991 1.050 898 2HA GLY 119 2HA GLY 119 -11.721 7.034 2.427 899 HA PRO 120 HA PRO 120 -13.534 4.228 5.302 900 1HB PRO 120 1HB PRO 120 -16.217 4.749 4.957 901 2HB PRO 120 2HB PRO 120 -15.123 5.755 5.911 902 1HG PRO 120 1HG PRO 120 -16.107 6.137 3.117 903 2HG PRO 120 2HG PRO 120 -15.856 7.341 4.395 904 1HD PRO 120 1HD PRO 120 -14.104 7.020 2.370 905 2HD PRO 120 2HD PRO 120 -13.581 7.470 4.007 906 H ASN 121 H ASN 121 -13.911 2.100 5.177 907 HA ASN 121 HA ASN 121 -14.245 0.038 4.235 908 1HB ASN 121 1HB ASN 121 -16.747 1.156 3.000 909 2HB ASN 121 2HB ASN 121 -16.474 -0.439 3.689 910 1HD2 ASN 121 1HD2 ASN 121 -17.104 2.902 4.354 911 2HD2 ASN 121 2HD2 ASN 121 -17.565 2.707 6.012 912 H GLU 122 H GLU 122 -12.676 1.845 2.674 913 HA GLU 122 HA GLU 122 -13.379 0.967 -0.046 914 1HB GLU 122 1HB GLU 122 -11.776 3.389 0.791 915 2HB GLU 122 2HB GLU 122 -12.064 2.890 -0.871 916 1HG GLU 122 1HG GLU 122 -14.586 3.019 -0.061 917 2HG GLU 122 2HG GLU 122 -13.887 4.171 1.075 918 H THR 123 H THR 123 -11.928 -0.186 -1.191 919 HA THR 123 HA THR 123 -9.479 -0.949 0.211 920 HB THR 123 HB THR 123 -10.761 -2.184 -2.237 921 HG1 THR 123 HG1 THR 123 -10.783 -2.823 0.526 922 1HG2 THR 123 1HG2 THR 123 -8.395 -3.064 -0.575 923 2HG2 THR 123 2HG2 THR 123 -9.151 -4.017 -1.850 924 3HG2 THR 123 3HG2 THR 123 -8.346 -2.498 -2.245 925 H LEU 124 H LEU 124 -7.532 -0.289 -0.444 926 HA LEU 124 HA LEU 124 -7.400 1.173 -3.002 927 1HB LEU 124 1HB LEU 124 -6.863 2.049 -0.385 928 2HB LEU 124 2HB LEU 124 -5.302 1.885 -1.165 929 HG LEU 124 HG LEU 124 -7.398 3.307 -2.701 930 1HD1 LEU 124 1HD1 LEU 124 -7.742 4.186 -0.445 931 2HD1 LEU 124 2HD1 LEU 124 -6.019 4.546 -0.322 932 3HD1 LEU 124 3HD1 LEU 124 -7.015 5.394 -1.506 933 1HD2 LEU 124 1HD2 LEU 124 -5.063 2.905 -3.483 934 2HD2 LEU 124 2HD2 LEU 124 -5.534 4.604 -3.443 935 3HD2 LEU 124 3HD2 LEU 124 -4.503 3.945 -2.174 936 H ILE 125 H ILE 125 -5.539 0.984 -4.240 937 HA ILE 125 HA ILE 125 -3.831 -1.328 -3.625 938 HB ILE 125 HB ILE 125 -4.407 -0.117 -6.333 939 1HG1 ILE 125 1HG1 ILE 125 -5.587 -2.427 -6.599 940 2HG1 ILE 125 2HG1 ILE 125 -5.656 -2.397 -4.839 941 1HG2 ILE 125 1HG2 ILE 125 -2.240 -1.207 -6.210 942 2HG2 ILE 125 2HG2 ILE 125 -2.993 -2.664 -5.552 943 3HG2 ILE 125 3HG2 ILE 125 -3.353 -2.152 -7.204 944 1HD1 ILE 125 1HD1 ILE 125 -6.751 -0.212 -6.586 945 2HD1 ILE 125 2HD1 ILE 125 -7.703 -1.567 -5.983 946 3HD1 ILE 125 3HD1 ILE 125 -6.983 -0.423 -4.852 947 H PHE 126 H PHE 126 -1.635 -1.113 -3.739 948 HA PHE 126 HA PHE 126 -0.577 1.537 -4.436 949 1HB PHE 126 1HB PHE 126 0.222 -0.095 -2.016 950 2HB PHE 126 2HB PHE 126 0.921 1.447 -2.492 951 HD1 PHE 126 HD1 PHE 126 -1.571 -0.157 -0.562 952 HD2 PHE 126 HD2 PHE 126 -0.691 3.459 -2.632 953 HE1 PHE 126 HE1 PHE 126 -3.262 1.020 0.787 954 HE2 PHE 126 HE2 PHE 126 -2.373 4.640 -1.280 955 HZ PHE 126 HZ PHE 126 -3.662 3.423 0.431 956 H LYS 127 H LYS 127 1.165 1.511 -5.695 957 HA LYS 127 HA LYS 127 2.501 -1.072 -6.178 958 1HB LYS 127 1HB LYS 127 1.374 -0.101 -8.147 959 2HB LYS 127 2HB LYS 127 2.314 1.372 -7.957 960 1HG LYS 127 1HG LYS 127 3.315 0.119 -9.698 961 2HG LYS 127 2HG LYS 127 4.377 -0.007 -8.295 962 1HD LYS 127 1HD LYS 127 3.486 -2.207 -7.780 963 2HD LYS 127 2HD LYS 127 2.339 -2.076 -9.128 964 1HE LYS 127 1HE LYS 127 5.352 -2.138 -9.330 965 2HE LYS 127 2HE LYS 127 4.249 -3.448 -9.752 966 1HZ LYS 127 1HZ LYS 127 4.349 -0.789 -11.073 967 2HZ LYS 127 2HZ LYS 127 4.980 -2.225 -11.705 968 3HZ LYS 127 3HZ LYS 127 3.311 -2.058 -11.486 969 H ILE 128 H ILE 128 4.253 -1.118 -4.872 970 HA ILE 128 HA ILE 128 5.804 1.351 -4.558 971 HB ILE 128 HB ILE 128 6.165 -1.165 -2.953 972 1HG1 ILE 128 1HG1 ILE 128 4.416 1.209 -2.255 973 2HG1 ILE 128 2HG1 ILE 128 3.802 -0.347 -2.821 974 1HG2 ILE 128 1HG2 ILE 128 6.872 1.726 -2.465 975 2HG2 ILE 128 2HG2 ILE 128 7.112 0.416 -1.308 976 3HG2 ILE 128 3HG2 ILE 128 7.992 0.415 -2.837 977 1HD1 ILE 128 1HD1 ILE 128 5.373 0.116 -0.295 978 2HD1 ILE 128 2HD1 ILE 128 3.633 -0.137 -0.406 979 3HD1 ILE 128 3HD1 ILE 128 4.741 -1.433 -0.855 980 H HIS 129 H HIS 129 7.602 1.613 -5.611 981 HA HIS 129 HA HIS 129 9.147 -0.754 -6.442 982 1HB HIS 129 1HB HIS 129 8.031 1.102 -8.126 983 2HB HIS 129 2HB HIS 129 9.646 1.764 -7.893 984 HD1 HIS 129 HD1 HIS 129 8.286 0.232 -10.478 985 HD2 HIS 129 HD2 HIS 129 11.272 -1.121 -7.927 986 HE1 HIS 129 HE1 HIS 129 9.524 -1.533 -11.771 987 HE2 HIS 129 HE2 HIS 129 11.179 -2.480 -10.124 988 H LEU 130 H LEU 130 10.623 -0.891 -4.843 989 HA LEU 130 HA LEU 130 11.770 1.438 -3.623 990 1HB LEU 130 1HB LEU 130 11.343 -1.070 -2.740 991 2HB LEU 130 2HB LEU 130 13.031 -1.196 -3.192 992 HG LEU 130 HG LEU 130 11.865 0.761 -1.224 993 1HD1 LEU 130 1HD1 LEU 130 13.615 -1.647 -0.841 994 2HD1 LEU 130 2HD1 LEU 130 13.186 -0.489 0.420 995 3HD1 LEU 130 3HD1 LEU 130 11.932 -1.473 -0.338 996 1HD2 LEU 130 1HD2 LEU 130 14.361 0.794 -2.674 997 2HD2 LEU 130 2HD2 LEU 130 13.641 2.022 -1.637 998 3HD2 LEU 130 3HD2 LEU 130 14.613 0.733 -0.931 999 H ILE 131 H ILE 131 13.469 2.534 -4.259 1000 HA ILE 131 HA ILE 131 15.218 1.406 -6.315 1001 HB ILE 131 HB ILE 131 15.245 4.205 -5.174 1002 1HG1 ILE 131 1HG1 ILE 131 13.053 3.734 -6.173 1003 2HG1 ILE 131 2HG1 ILE 131 13.974 4.883 -7.171 1004 1HG2 ILE 131 1HG2 ILE 131 17.311 3.567 -6.277 1005 2HG2 ILE 131 2HG2 ILE 131 16.412 3.067 -7.710 1006 3HG2 ILE 131 3HG2 ILE 131 16.445 4.766 -7.238 1007 1HD1 ILE 131 1HD1 ILE 131 13.648 1.933 -7.710 1008 2HD1 ILE 131 2HD1 ILE 131 12.804 3.243 -8.536 1009 3HD1 ILE 131 3HD1 ILE 131 14.551 3.075 -8.704 1010 H SER 132 H SER 132 15.469 3.010 -3.148 1011 HA SER 132 HA SER 132 17.556 1.274 -2.298 1012 1HB SER 132 1HB SER 132 19.381 2.784 -2.167 1013 2HB SER 132 2HB SER 132 18.755 2.939 -3.806 1014 HG SER 132 HG SER 132 17.684 4.826 -3.168 1015 H VAL 133 H VAL 133 18.343 1.910 -0.085 1016 HA VAL 133 HA VAL 133 16.343 3.533 1.347 1017 HB VAL 133 HB VAL 133 17.399 0.839 2.196 1018 1HG1 VAL 133 1HG1 VAL 133 17.206 2.357 4.106 1019 2HG1 VAL 133 2HG1 VAL 133 15.541 2.718 3.652 1020 3HG1 VAL 133 3HG1 VAL 133 15.979 1.092 4.172 1021 1HG2 VAL 133 1HG2 VAL 133 14.666 1.778 1.360 1022 2HG2 VAL 133 2HG2 VAL 133 15.683 0.584 0.558 1023 3HG2 VAL 133 3HG2 VAL 133 14.977 0.225 2.134 1024 H LYS 134 H LYS 134 17.310 5.147 2.347 1025 HA LYS 134 HA LYS 134 18.901 6.441 3.339 1026 1HB LYS 134 1HB LYS 134 18.410 4.270 4.935 1027 2HB LYS 134 2HB LYS 134 20.158 4.204 4.777 1028 1HG LYS 134 1HG LYS 134 18.594 6.609 5.698 1029 2HG LYS 134 2HG LYS 134 19.423 5.448 6.762 1030 1HD LYS 134 1HD LYS 134 21.561 6.035 5.755 1031 2HD LYS 134 2HD LYS 134 20.755 7.143 4.641 1032 1HE LYS 134 1HE LYS 134 21.748 8.364 6.500 1033 2HE LYS 134 2HE LYS 134 19.989 8.489 6.542 1034 1HZ LYS 134 1HZ LYS 134 19.951 6.750 8.228 1035 2HZ LYS 134 2HZ LYS 134 21.640 6.657 8.198 1036 3HZ LYS 134 3HZ LYS 134 20.879 8.068 8.738 1037 H LYS 135 H LYS 135 19.780 6.251 0.996 1038 HA LYS 135 HA LYS 135 21.571 6.248 -0.389 1039 1HB LYS 135 1HB LYS 135 23.005 6.233 2.258 1040 2HB LYS 135 2HB LYS 135 23.833 6.403 0.716 1041 1HG LYS 135 1HG LYS 135 22.485 8.428 0.268 1042 2HG LYS 135 2HG LYS 135 21.776 8.272 1.876 1043 1HD LYS 135 1HD LYS 135 24.016 8.452 2.865 1044 2HD LYS 135 2HD LYS 135 24.701 8.643 1.250 1045 1HE LYS 135 1HE LYS 135 22.667 10.491 2.494 1046 2HE LYS 135 2HE LYS 135 24.403 10.795 2.441 1047 1HZ LYS 135 1HZ LYS 135 22.639 10.469 0.072 1048 2HZ LYS 135 2HZ LYS 135 23.234 11.940 0.659 1049 3HZ LYS 135 3HZ LYS 135 24.299 10.786 0.032 1050 H SER 136 H SER 136 20.335 3.844 -0.055 1051 HA SER 136 HA SER 136 20.548 1.593 -0.298 1052 1HB SER 136 1HB SER 136 22.274 0.857 -1.833 1053 2HB SER 136 2HB SER 136 21.666 2.422 -2.368 1054 HG SER 136 HG SER 136 23.684 2.990 -2.322 1055 H SER 137 H SER 137 21.486 2.703 2.199 1056 HA SER 137 HA SER 137 23.283 0.521 2.989 1057 1HB SER 137 1HB SER 137 24.668 2.523 2.821 1058 2HB SER 137 2HB SER 137 23.543 3.413 3.847 1059 HG SER 137 HG SER 137 24.502 2.596 5.516 No H/Q in entry = 1059 Start of MODEL 7 1 H1 PHE 1 H1 PHE 1 -25.051 8.695 2.537 2 H2 PHE 1 H2 PHE 1 -24.798 9.214 4.127 3 H3 PHE 1 H3 PHE 1 -24.959 10.348 2.881 4 HA PHE 1 HA PHE 1 -22.925 9.577 1.862 5 1HB PHE 1 1HB PHE 1 -22.697 10.312 4.789 6 2HB PHE 1 2HB PHE 1 -21.355 10.348 3.650 7 HD1 PHE 1 HD1 PHE 1 -21.115 12.116 2.075 8 HD2 PHE 1 HD2 PHE 1 -24.561 11.895 4.563 9 HE1 PHE 1 HE1 PHE 1 -21.723 14.412 1.431 10 HE2 PHE 1 HE2 PHE 1 -25.175 14.191 3.924 11 HZ PHE 1 HZ PHE 1 -23.747 15.456 2.364 12 H ASN 2 H ASN 2 -23.466 8.034 5.025 13 HA ASN 2 HA ASN 2 -21.321 6.224 4.838 14 1HB ASN 2 1HB ASN 2 -22.511 4.960 6.626 15 2HB ASN 2 2HB ASN 2 -22.342 6.684 6.981 16 1HD2 ASN 2 1HD2 ASN 2 -24.158 8.002 6.930 17 2HD2 ASN 2 2HD2 ASN 2 -25.760 7.360 6.973 18 H LYS 3 H LYS 3 -24.427 6.227 3.351 19 HA LYS 3 HA LYS 3 -24.749 3.467 2.927 20 1HB LYS 3 1HB LYS 3 -26.246 4.086 1.098 21 2HB LYS 3 2HB LYS 3 -26.540 5.103 2.500 22 1HG LYS 3 1HG LYS 3 -25.229 6.897 1.463 23 2HG LYS 3 2HG LYS 3 -24.977 5.875 0.046 24 1HD LYS 3 1HD LYS 3 -27.411 5.784 -0.300 25 2HD LYS 3 2HD LYS 3 -27.636 6.847 1.091 26 1HE LYS 3 1HE LYS 3 -26.185 7.509 -1.468 27 2HE LYS 3 2HE LYS 3 -27.755 8.130 -0.959 28 1HZ LYS 3 1HZ LYS 3 -26.658 9.182 0.940 29 2HZ LYS 3 2HZ LYS 3 -25.156 8.628 0.389 30 3HZ LYS 3 3HZ LYS 3 -26.034 9.744 -0.530 31 H LYS 4 H LYS 4 -22.971 5.954 1.202 32 HA LYS 4 HA LYS 4 -22.112 4.174 -0.896 33 1HB LYS 4 1HB LYS 4 -22.412 6.597 -1.301 34 2HB LYS 4 2HB LYS 4 -21.120 6.937 -0.159 35 1HG LYS 4 1HG LYS 4 -19.537 5.751 -1.599 36 2HG LYS 4 2HG LYS 4 -20.836 5.430 -2.750 37 1HD LYS 4 1HD LYS 4 -21.149 7.845 -3.054 38 2HD LYS 4 2HD LYS 4 -19.835 8.154 -1.917 39 1HE LYS 4 1HE LYS 4 -19.031 8.344 -4.200 40 2HE LYS 4 2HE LYS 4 -18.286 6.958 -3.404 41 1HZ LYS 4 1HZ LYS 4 -19.890 5.519 -4.515 42 2HZ LYS 4 2HZ LYS 4 -20.573 6.854 -5.296 43 3HZ LYS 4 3HZ LYS 4 -18.980 6.399 -5.637 44 H ALA 5 H ALA 5 -20.882 5.439 2.123 45 HA ALA 5 HA ALA 5 -18.200 4.699 1.923 46 1HB ALA 5 1HB ALA 5 -18.817 6.092 3.722 47 2HB ALA 5 2HB ALA 5 -20.052 4.961 4.277 48 3HB ALA 5 3HB ALA 5 -18.344 4.562 4.461 49 H ASP 6 H ASP 6 -20.933 2.902 3.328 50 HA ASP 6 HA ASP 6 -19.478 0.532 3.810 51 1HB ASP 6 1HB ASP 6 -21.645 1.017 4.899 52 2HB ASP 6 2HB ASP 6 -22.453 0.872 3.341 53 H GLU 7 H GLU 7 -21.286 1.739 1.050 54 HA GLU 7 HA GLU 7 -21.349 -0.562 -0.510 55 1HB GLU 7 1HB GLU 7 -22.412 1.685 -1.032 56 2HB GLU 7 2HB GLU 7 -20.827 2.220 -1.572 57 1HG GLU 7 1HG GLU 7 -20.813 0.442 -3.259 58 2HG GLU 7 2HG GLU 7 -22.419 -0.057 -2.730 59 H ASN 8 H ASN 8 -18.775 1.697 0.198 60 HA ASN 8 HA ASN 8 -16.935 0.761 -1.746 61 1HB ASN 8 1HB ASN 8 -16.221 2.029 0.903 62 2HB ASN 8 2HB ASN 8 -15.265 2.033 -0.601 63 1HD2 ASN 8 1HD2 ASN 8 -16.206 4.226 1.076 64 2HD2 ASN 8 2HD2 ASN 8 -17.130 5.253 0.044 65 H LYS 9 H LYS 9 -17.587 -0.026 1.622 66 HA LYS 9 HA LYS 9 -15.454 -1.738 2.116 67 1HB LYS 9 1HB LYS 9 -17.168 -0.934 3.777 68 2HB LYS 9 2HB LYS 9 -18.273 -2.138 3.131 69 1HG LYS 9 1HG LYS 9 -16.759 -3.917 3.791 70 2HG LYS 9 2HG LYS 9 -15.603 -2.727 4.392 71 1HD LYS 9 1HD LYS 9 -16.825 -3.590 6.261 72 2HD LYS 9 2HD LYS 9 -17.354 -1.930 5.980 73 1HE LYS 9 1HE LYS 9 -19.268 -3.343 6.436 74 2HE LYS 9 2HE LYS 9 -19.316 -2.786 4.764 75 1HZ LYS 9 1HZ LYS 9 -18.402 -4.927 4.077 76 2HZ LYS 9 2HZ LYS 9 -18.403 -5.459 5.683 77 3HZ LYS 9 3HZ LYS 9 -19.865 -5.122 4.903 78 H VAL 10 H VAL 10 -18.423 -2.306 0.333 79 HA VAL 10 HA VAL 10 -18.070 -5.156 0.187 80 HB VAL 10 HB VAL 10 -19.781 -3.531 -1.668 81 1HG1 VAL 10 1HG1 VAL 10 -19.487 -5.896 -2.202 82 2HG1 VAL 10 2HG1 VAL 10 -20.058 -6.332 -0.578 83 3HG1 VAL 10 3HG1 VAL 10 -21.159 -5.539 -1.724 84 1HG2 VAL 10 1HG2 VAL 10 -20.445 -4.436 1.131 85 2HG2 VAL 10 2HG2 VAL 10 -20.320 -2.772 0.563 86 3HG2 VAL 10 3HG2 VAL 10 -21.616 -3.811 -0.030 87 H LYS 11 H LYS 11 -17.777 -2.521 -2.222 88 HA LYS 11 HA LYS 11 -16.829 -4.185 -4.286 89 1HB LYS 11 1HB LYS 11 -16.105 -2.113 -5.397 90 2HB LYS 11 2HB LYS 11 -17.744 -1.990 -4.776 91 1HG LYS 11 1HG LYS 11 -16.954 -0.685 -2.888 92 2HG LYS 11 2HG LYS 11 -15.289 -0.855 -3.449 93 1HD LYS 11 1HD LYS 11 -16.061 1.296 -4.139 94 2HD LYS 11 2HD LYS 11 -15.980 0.275 -5.576 95 1HE LYS 11 1HE LYS 11 -18.020 1.443 -5.738 96 2HE LYS 11 2HE LYS 11 -18.446 -0.185 -5.217 97 1HZ LYS 11 1HZ LYS 11 -18.578 0.642 -2.935 98 2HZ LYS 11 2HZ LYS 11 -18.230 2.207 -3.473 99 3HZ LYS 11 3HZ LYS 11 -19.663 1.447 -3.952 100 H GLY 12 H GLY 12 -15.277 -2.749 -1.560 101 1HA GLY 12 1HA GLY 12 -13.072 -2.658 -0.890 102 2HA GLY 12 2HA GLY 12 -12.598 -2.971 -2.555 103 H GLU 13 H GLU 13 -14.525 -4.804 -0.188 104 HA GLU 13 HA GLU 13 -12.565 -6.795 0.242 105 1HB GLU 13 1HB GLU 13 -14.308 -8.041 1.370 106 2HB GLU 13 2HB GLU 13 -14.436 -6.343 1.806 107 1HG GLU 13 1HG GLU 13 -16.269 -6.064 0.227 108 2HG GLU 13 2HG GLU 13 -16.132 -7.758 -0.239 109 H ALA 14 H ALA 14 -15.011 -6.325 -2.172 110 HA ALA 14 HA ALA 14 -15.004 -9.023 -3.150 111 1HB ALA 14 1HB ALA 14 -16.928 -7.545 -3.492 112 2HB ALA 14 2HB ALA 14 -16.288 -8.128 -5.027 113 3HB ALA 14 3HB ALA 14 -15.938 -6.484 -4.494 114 H PHE 15 H PHE 15 -13.268 -6.069 -3.859 115 HA PHE 15 HA PHE 15 -12.072 -6.865 -6.279 116 1HB PHE 15 1HB PHE 15 -11.793 -4.617 -5.998 117 2HB PHE 15 2HB PHE 15 -11.622 -4.754 -4.237 118 HD1 PHE 15 HD1 PHE 15 -9.589 -4.302 -3.326 119 HD2 PHE 15 HD2 PHE 15 -9.754 -5.647 -7.360 120 HE1 PHE 15 HE1 PHE 15 -7.154 -3.964 -3.532 121 HE2 PHE 15 HE2 PHE 15 -7.321 -5.335 -7.567 122 HZ PHE 15 HZ PHE 15 -6.019 -4.491 -5.651 123 H LEU 16 H LEU 16 -10.742 -6.854 -2.963 124 HA LEU 16 HA LEU 16 -8.375 -8.217 -3.661 125 1HB LEU 16 1HB LEU 16 -8.413 -8.809 -1.126 126 2HB LEU 16 2HB LEU 16 -8.124 -7.168 -1.668 127 HG LEU 16 HG LEU 16 -10.779 -7.042 -1.380 128 1HD1 LEU 16 1HD1 LEU 16 -9.864 -9.137 0.585 129 2HD1 LEU 16 2HD1 LEU 16 -11.385 -8.253 0.702 130 3HD1 LEU 16 3HD1 LEU 16 -11.088 -9.317 -0.672 131 1HD2 LEU 16 1HD2 LEU 16 -9.062 -5.600 -0.347 132 2HD2 LEU 16 2HD2 LEU 16 -10.393 -5.981 0.744 133 3HD2 LEU 16 3HD2 LEU 16 -8.846 -6.809 0.917 134 H THR 17 H THR 17 -11.568 -9.350 -2.780 135 HA THR 17 HA THR 17 -10.989 -12.004 -2.156 136 HB THR 17 HB THR 17 -13.411 -10.725 -3.426 137 HG1 THR 17 HG1 THR 17 -14.103 -10.707 -1.407 138 1HG2 THR 17 1HG2 THR 17 -12.996 -13.645 -2.760 139 2HG2 THR 17 2HG2 THR 17 -14.585 -12.902 -3.022 140 3HG2 THR 17 3HG2 THR 17 -13.400 -12.948 -4.340 141 H GLU 18 H GLU 18 -11.690 -10.508 -5.295 142 HA GLU 18 HA GLU 18 -11.208 -12.903 -6.778 143 1HB GLU 18 1HB GLU 18 -12.665 -11.161 -7.671 144 2HB GLU 18 2HB GLU 18 -11.334 -10.013 -7.666 145 1HG GLU 18 1HG GLU 18 -10.176 -11.304 -9.355 146 2HG GLU 18 2HG GLU 18 -11.446 -12.525 -9.322 147 H ASN 19 H ASN 19 -9.317 -10.179 -5.711 148 HA ASN 19 HA ASN 19 -7.063 -10.432 -7.344 149 1HB ASN 19 1HB ASN 19 -7.029 -8.481 -6.114 150 2HB ASN 19 2HB ASN 19 -7.578 -9.272 -4.635 151 1HD2 ASN 19 1HD2 ASN 19 -6.091 -10.540 -3.459 152 2HD2 ASN 19 2HD2 ASN 19 -4.393 -10.262 -3.578 153 H LYS 20 H LYS 20 -8.114 -12.347 -4.643 154 HA LYS 20 HA LYS 20 -5.827 -13.456 -3.653 155 1HB LYS 20 1HB LYS 20 -8.451 -14.821 -4.256 156 2HB LYS 20 2HB LYS 20 -7.171 -15.543 -3.289 157 1HG LYS 20 1HG LYS 20 -7.393 -13.885 -1.603 158 2HG LYS 20 2HG LYS 20 -8.459 -12.910 -2.617 159 1HD LYS 20 1HD LYS 20 -10.168 -14.618 -2.520 160 2HD LYS 20 2HD LYS 20 -9.096 -15.680 -1.602 161 1HE LYS 20 1HE LYS 20 -9.065 -14.070 0.234 162 2HE LYS 20 2HE LYS 20 -10.104 -12.984 -0.686 163 1HZ LYS 20 1HZ LYS 20 -11.832 -14.684 -0.653 164 2HZ LYS 20 2HZ LYS 20 -10.833 -15.706 0.254 165 3HZ LYS 20 3HZ LYS 20 -11.378 -14.249 0.917 166 H ASN 21 H ASN 21 -7.019 -13.768 -6.852 167 HA ASN 21 HA ASN 21 -5.832 -16.248 -7.529 168 1HB ASN 21 1HB ASN 21 -6.664 -13.911 -9.256 169 2HB ASN 21 2HB ASN 21 -6.141 -15.471 -9.885 170 1HD2 ASN 21 1HD2 ASN 21 -8.051 -14.968 -6.987 171 2HD2 ASN 21 2HD2 ASN 21 -9.475 -15.743 -7.575 172 H LYS 22 H LYS 22 -4.723 -12.910 -7.631 173 HA LYS 22 HA LYS 22 -2.419 -13.094 -9.122 174 1HB LYS 22 1HB LYS 22 -3.124 -11.466 -6.693 175 2HB LYS 22 2HB LYS 22 -1.539 -11.326 -7.439 176 1HG LYS 22 1HG LYS 22 -3.111 -9.586 -8.182 177 2HG LYS 22 2HG LYS 22 -2.525 -10.586 -9.510 178 1HD LYS 22 1HD LYS 22 -4.605 -11.848 -9.498 179 2HD LYS 22 2HD LYS 22 -5.180 -10.917 -8.114 180 1HE LYS 22 1HE LYS 22 -6.155 -10.104 -10.201 181 2HE LYS 22 2HE LYS 22 -5.133 -8.880 -9.449 182 1HZ LYS 22 1HZ LYS 22 -3.344 -9.546 -10.978 183 2HZ LYS 22 2HZ LYS 22 -4.406 -10.619 -11.743 184 3HZ LYS 22 3HZ LYS 22 -4.703 -8.954 -11.793 185 HA PRO 23 HA PRO 23 -0.173 -16.250 -6.831 186 1HB PRO 23 1HB PRO 23 2.243 -15.784 -8.102 187 2HB PRO 23 2HB PRO 23 0.976 -16.862 -8.696 188 1HG PRO 23 1HG PRO 23 1.583 -14.040 -9.472 189 2HG PRO 23 2HG PRO 23 1.101 -15.409 -10.495 190 1HD PRO 23 1HD PRO 23 -0.650 -13.506 -9.800 191 2HD PRO 23 2HD PRO 23 -1.140 -15.213 -9.912 192 H GLY 24 H GLY 24 1.221 -16.283 -5.104 193 1HA GLY 24 1HA GLY 24 2.894 -13.976 -4.542 194 2HA GLY 24 2HA GLY 24 2.865 -15.484 -3.650 195 H VAL 25 H VAL 25 -0.307 -14.673 -3.867 196 HA VAL 25 HA VAL 25 -0.658 -12.519 -2.140 197 HB VAL 25 HB VAL 25 -2.377 -14.956 -2.575 198 1HG1 VAL 25 1HG1 VAL 25 -2.948 -12.558 -0.835 199 2HG1 VAL 25 2HG1 VAL 25 -4.172 -13.709 -1.376 200 3HG1 VAL 25 3HG1 VAL 25 -2.857 -14.247 -0.330 201 1HG2 VAL 25 1HG2 VAL 25 -1.965 -12.578 -4.012 202 2HG2 VAL 25 2HG2 VAL 25 -3.198 -13.811 -4.292 203 3HG2 VAL 25 3HG2 VAL 25 -3.552 -12.431 -3.251 204 H VAL 26 H VAL 26 0.384 -12.307 -0.279 205 HA VAL 26 HA VAL 26 0.155 -14.481 1.687 206 HB VAL 26 HB VAL 26 2.416 -14.604 0.955 207 1HG1 VAL 26 1HG1 VAL 26 2.426 -11.616 1.230 208 2HG1 VAL 26 2HG1 VAL 26 3.906 -12.568 1.116 209 3HG1 VAL 26 3HG1 VAL 26 2.742 -12.587 -0.209 210 1HG2 VAL 26 1HG2 VAL 26 2.117 -14.776 3.368 211 2HG2 VAL 26 2HG2 VAL 26 3.672 -14.027 2.978 212 3HG2 VAL 26 3HG2 VAL 26 2.321 -13.026 3.525 213 H VAL 27 H VAL 27 -0.717 -13.864 3.544 214 HA VAL 27 HA VAL 27 -1.338 -11.089 4.003 215 HB VAL 27 HB VAL 27 -3.001 -12.756 4.575 216 1HG1 VAL 27 1HG1 VAL 27 -0.961 -13.824 6.522 217 2HG1 VAL 27 2HG1 VAL 27 -2.642 -14.348 6.415 218 3HG1 VAL 27 3HG1 VAL 27 -1.542 -14.629 5.065 219 1HG2 VAL 27 1HG2 VAL 27 -2.918 -10.695 5.914 220 2HG2 VAL 27 2HG2 VAL 27 -3.533 -12.063 6.844 221 3HG2 VAL 27 3HG2 VAL 27 -1.876 -11.507 7.082 222 H LEU 28 H LEU 28 -0.544 -9.757 5.620 223 HA LEU 28 HA LEU 28 1.972 -10.659 6.842 224 1HB LEU 28 1HB LEU 28 0.860 -7.894 6.352 225 2HB LEU 28 2HB LEU 28 2.344 -8.201 7.231 226 HG LEU 28 HG LEU 28 1.820 -8.795 4.319 227 1HD1 LEU 28 1HD1 LEU 28 3.686 -6.856 5.679 228 2HD1 LEU 28 2HD1 LEU 28 3.589 -7.146 3.941 229 3HD1 LEU 28 3HD1 LEU 28 2.214 -6.444 4.796 230 1HD2 LEU 28 1HD2 LEU 28 4.231 -9.389 6.031 231 2HD2 LEU 28 2HD2 LEU 28 3.203 -10.555 5.197 232 3HD2 LEU 28 3HD2 LEU 28 4.218 -9.451 4.267 233 HA PRO 29 HA PRO 29 0.641 -10.578 11.063 234 1HB PRO 29 1HB PRO 29 2.331 -8.155 11.529 235 2HB PRO 29 2HB PRO 29 2.252 -9.665 12.447 236 1HG PRO 29 1HG PRO 29 4.283 -9.215 10.802 237 2HG PRO 29 2HG PRO 29 3.547 -10.825 10.900 238 1HD PRO 29 1HD PRO 29 3.263 -8.730 8.787 239 2HD PRO 29 2HD PRO 29 3.315 -10.505 8.626 240 H SER 30 H SER 30 0.730 -7.464 9.400 241 HA SER 30 HA SER 30 -1.323 -6.351 11.118 242 1HB SER 30 1HB SER 30 0.390 -4.820 10.384 243 2HB SER 30 2HB SER 30 0.092 -5.222 8.695 244 HG SER 30 HG SER 30 -1.590 -3.940 8.682 245 H GLY 31 H GLY 31 -1.222 -8.291 8.360 246 1HA GLY 31 1HA GLY 31 -4.073 -7.749 7.923 247 2HA GLY 31 2HA GLY 31 -3.287 -9.284 7.602 248 H LEU 32 H LEU 32 -1.061 -7.466 6.311 249 HA LEU 32 HA LEU 32 -2.454 -6.507 3.963 250 1HB LEU 32 1HB LEU 32 0.435 -6.492 4.771 251 2HB LEU 32 2HB LEU 32 -0.103 -5.954 3.191 252 HG LEU 32 HG LEU 32 -1.664 -4.371 4.508 253 1HD1 LEU 32 1HD1 LEU 32 -0.575 -5.718 6.647 254 2HD1 LEU 32 2HD1 LEU 32 0.301 -4.189 6.629 255 3HD1 LEU 32 3HD1 LEU 32 -1.461 -4.196 6.711 256 1HD2 LEU 32 1HD2 LEU 32 0.301 -3.726 3.132 257 2HD2 LEU 32 2HD2 LEU 32 0.032 -2.669 4.518 258 3HD2 LEU 32 3HD2 LEU 32 1.309 -3.883 4.570 259 H GLN 33 H GLN 33 -2.587 -7.390 2.042 260 HA GLN 33 HA GLN 33 -1.138 -9.903 1.512 261 1HB GLN 33 1HB GLN 33 -3.811 -8.949 0.454 262 2HB GLN 33 2HB GLN 33 -2.981 -10.388 -0.113 263 1HG GLN 33 1HG GLN 33 -4.631 -11.122 1.392 264 2HG GLN 33 2HG GLN 33 -3.072 -11.247 2.252 265 1HE2 GLN 33 1HE2 GLN 33 -4.144 -11.203 4.240 266 2HE2 GLN 33 2HE2 GLN 33 -4.798 -9.743 4.891 267 H TYR 34 H TYR 34 -0.052 -10.062 -0.494 268 HA TYR 34 HA TYR 34 -0.312 -7.921 -2.410 269 1HB TYR 34 1HB TYR 34 2.059 -7.197 -2.230 270 2HB TYR 34 2HB TYR 34 1.089 -6.796 -0.818 271 HD1 TYR 34 HD1 TYR 34 4.003 -8.513 -2.033 272 HD2 TYR 34 HD2 TYR 34 1.305 -8.249 1.244 273 HE1 TYR 34 HE1 TYR 34 5.640 -9.641 -0.601 274 HE2 TYR 34 HE2 TYR 34 2.933 -9.377 2.683 275 HH TYR 34 HH TYR 34 6.174 -9.827 1.803 276 H LYS 35 H LYS 35 1.491 -8.041 -4.086 277 HA LYS 35 HA LYS 35 2.135 -10.858 -4.677 278 1HB LYS 35 1HB LYS 35 0.311 -9.893 -6.099 279 2HB LYS 35 2HB LYS 35 1.453 -8.686 -6.674 280 1HG LYS 35 1HG LYS 35 2.302 -11.495 -6.956 281 2HG LYS 35 2HG LYS 35 0.930 -10.991 -7.953 282 1HD LYS 35 1HD LYS 35 2.273 -9.109 -8.803 283 2HD LYS 35 2HD LYS 35 3.643 -9.664 -7.837 284 1HE LYS 35 1HE LYS 35 3.706 -11.750 -9.074 285 2HE LYS 35 2HE LYS 35 2.278 -11.277 -9.992 286 1HZ LYS 35 1HZ LYS 35 4.900 -9.884 -10.046 287 2HZ LYS 35 2HZ LYS 35 4.307 -10.913 -11.249 288 3HZ LYS 35 3HZ LYS 35 3.532 -9.443 -10.935 289 H VAL 36 H VAL 36 4.238 -11.191 -4.651 290 HA VAL 36 HA VAL 36 6.131 -9.045 -4.615 291 HB VAL 36 HB VAL 36 6.580 -12.028 -4.632 292 1HG1 VAL 36 1HG1 VAL 36 8.462 -9.756 -3.999 293 2HG1 VAL 36 2HG1 VAL 36 8.807 -11.465 -3.737 294 3HG1 VAL 36 3HG1 VAL 36 8.565 -10.856 -5.374 295 1HG2 VAL 36 1HG2 VAL 36 6.229 -10.008 -2.441 296 2HG2 VAL 36 2HG2 VAL 36 5.375 -11.531 -2.683 297 3HG2 VAL 36 3HG2 VAL 36 7.062 -11.539 -2.170 298 H ILE 37 H ILE 37 7.212 -8.184 -6.212 299 HA ILE 37 HA ILE 37 7.266 -9.522 -8.822 300 HB ILE 37 HB ILE 37 7.916 -6.653 -8.122 301 1HG1 ILE 37 1HG1 ILE 37 5.521 -7.756 -9.604 302 2HG1 ILE 37 2HG1 ILE 37 5.503 -7.336 -7.894 303 1HG2 ILE 37 1HG2 ILE 37 7.685 -8.017 -10.802 304 2HG2 ILE 37 2HG2 ILE 37 7.907 -6.285 -10.550 305 3HG2 ILE 37 3HG2 ILE 37 9.168 -7.417 -10.058 306 1HD1 ILE 37 1HD1 ILE 37 6.042 -5.437 -10.167 307 2HD1 ILE 37 2HD1 ILE 37 4.535 -5.576 -9.261 308 3HD1 ILE 37 3HD1 ILE 37 6.001 -5.019 -8.454 309 H ASN 38 H ASN 38 9.496 -7.379 -7.011 310 HA ASN 38 HA ASN 38 11.671 -9.283 -7.582 311 1HB ASN 38 1HB ASN 38 11.900 -7.387 -9.109 312 2HB ASN 38 2HB ASN 38 11.805 -6.262 -7.757 313 1HD2 ASN 38 1HD2 ASN 38 13.797 -5.361 -8.104 314 2HD2 ASN 38 2HD2 ASN 38 15.278 -6.213 -7.845 315 H SER 39 H SER 39 11.754 -10.150 -5.531 316 HA SER 39 HA SER 39 12.059 -8.286 -3.279 317 1HB SER 39 1HB SER 39 11.547 -10.253 -1.849 318 2HB SER 39 2HB SER 39 10.254 -9.871 -2.984 319 HG SER 39 HG SER 39 12.253 -11.774 -3.582 320 H GLY 40 H GLY 40 13.741 -8.430 -1.836 321 1HA GLY 40 1HA GLY 40 15.719 -10.486 -1.941 322 2HA GLY 40 2HA GLY 40 15.804 -9.009 -0.998 323 H ASN 41 H ASN 41 17.080 -7.379 -1.668 324 HA ASN 41 HA ASN 41 18.800 -7.922 -3.928 325 1HB ASN 41 1HB ASN 41 17.062 -5.446 -3.852 326 2HB ASN 41 2HB ASN 41 18.426 -5.668 -4.942 327 1HD2 ASN 41 1HD2 ASN 41 15.161 -6.466 -4.234 328 2HD2 ASN 41 2HD2 ASN 41 14.832 -7.354 -5.680 329 H GLY 42 H GLY 42 18.132 -4.812 -2.364 330 1HA GLY 42 1HA GLY 42 19.777 -3.326 -1.587 331 2HA GLY 42 2HA GLY 42 20.936 -4.646 -1.594 332 H VAL 43 H VAL 43 21.358 -3.414 0.477 333 HA VAL 43 HA VAL 43 20.318 -4.918 2.688 334 HB VAL 43 HB VAL 43 21.965 -3.666 3.998 335 1HG1 VAL 43 1HG1 VAL 43 22.643 -5.707 2.845 336 2HG1 VAL 43 2HG1 VAL 43 23.076 -4.759 1.423 337 3HG1 VAL 43 3HG1 VAL 43 23.972 -4.551 2.928 338 1HG2 VAL 43 1HG2 VAL 43 21.814 -1.543 2.826 339 2HG2 VAL 43 2HG2 VAL 43 23.485 -2.103 2.903 340 3HG2 VAL 43 3HG2 VAL 43 22.565 -2.269 1.406 341 H LYS 44 H LYS 44 19.989 -3.482 4.797 342 HA LYS 44 HA LYS 44 19.003 -0.934 4.853 343 1HB LYS 44 1HB LYS 44 16.704 -0.954 4.380 344 2HB LYS 44 2HB LYS 44 17.410 -1.865 3.060 345 1HG LYS 44 1HG LYS 44 16.088 -3.056 5.490 346 2HG LYS 44 2HG LYS 44 15.353 -2.889 3.895 347 1HD LYS 44 1HD LYS 44 16.872 -4.440 2.936 348 2HD LYS 44 2HD LYS 44 17.900 -4.425 4.370 349 1HE LYS 44 1HE LYS 44 16.542 -6.459 4.245 350 2HE LYS 44 2HE LYS 44 16.147 -5.494 5.665 351 1HZ LYS 44 1HZ LYS 44 14.233 -4.605 4.441 352 2HZ LYS 44 2HZ LYS 44 14.595 -5.618 3.137 353 3HZ LYS 44 3HZ LYS 44 14.145 -6.282 4.626 354 HA PRO 45 HA PRO 45 18.146 -2.107 9.040 355 1HB PRO 45 1HB PRO 45 16.826 0.342 9.603 356 2HB PRO 45 2HB PRO 45 18.531 -0.038 9.836 357 1HG PRO 45 1HG PRO 45 17.517 1.797 8.009 358 2HG PRO 45 2HG PRO 45 19.140 1.091 7.970 359 1HD PRO 45 1HD PRO 45 16.712 0.350 6.405 360 2HD PRO 45 2HD PRO 45 18.416 0.353 5.917 361 H GLY 46 H GLY 46 16.408 -1.986 10.723 362 1HA GLY 46 1HA GLY 46 14.394 -2.804 11.455 363 2HA GLY 46 2HA GLY 46 14.087 -3.346 9.809 364 H LYS 47 H LYS 47 11.960 -2.436 11.162 365 HA LYS 47 HA LYS 47 10.703 -0.672 9.548 366 1HB LYS 47 1HB LYS 47 9.167 -0.185 11.449 367 2HB LYS 47 2HB LYS 47 9.485 -1.895 11.198 368 1HG LYS 47 1HG LYS 47 11.115 -1.845 13.036 369 2HG LYS 47 2HG LYS 47 10.739 -0.142 13.302 370 1HD LYS 47 1HD LYS 47 8.437 -0.705 13.827 371 2HD LYS 47 2HD LYS 47 8.752 -2.407 13.481 372 1HE LYS 47 1HE LYS 47 10.027 -0.769 15.671 373 2HE LYS 47 2HE LYS 47 8.764 -1.981 15.882 374 1HZ LYS 47 1HZ LYS 47 11.496 -2.503 14.838 375 2HZ LYS 47 2HZ LYS 47 10.951 -2.872 16.397 376 3HZ LYS 47 3HZ LYS 47 10.285 -3.664 15.059 377 H SER 48 H SER 48 13.235 0.272 11.657 378 HA SER 48 HA SER 48 12.361 3.039 11.824 379 1HB SER 48 1HB SER 48 14.993 1.765 12.629 380 2HB SER 48 2HB SER 48 14.497 3.416 12.998 381 HG SER 48 HG SER 48 13.031 1.129 13.804 382 H ASP 49 H ASP 49 13.289 1.307 9.385 383 HA ASP 49 HA ASP 49 15.479 2.714 8.213 384 1HB ASP 49 1HB ASP 49 15.287 0.515 7.500 385 2HB ASP 49 2HB ASP 49 13.538 0.606 7.345 386 H THR 50 H THR 50 15.356 3.804 6.113 387 HA THR 50 HA THR 50 12.844 5.300 5.693 388 HB THR 50 HB THR 50 15.664 6.393 5.423 389 HG1 THR 50 HG1 THR 50 14.022 7.694 7.153 390 1HG2 THR 50 1HG2 THR 50 12.974 7.718 5.041 391 2HG2 THR 50 2HG2 THR 50 14.527 8.552 5.040 392 3HG2 THR 50 3HG2 THR 50 14.160 7.372 3.782 393 H VAL 51 H VAL 51 12.166 5.341 3.564 394 HA VAL 51 HA VAL 51 14.073 4.338 1.560 395 HB VAL 51 HB VAL 51 12.285 3.026 0.495 396 1HG1 VAL 51 1HG1 VAL 51 12.933 2.365 3.359 397 2HG1 VAL 51 2HG1 VAL 51 12.157 1.237 2.242 398 3HG1 VAL 51 3HG1 VAL 51 13.782 1.836 1.904 399 1HG2 VAL 51 1HG2 VAL 51 10.692 3.741 2.957 400 2HG2 VAL 51 2HG2 VAL 51 10.346 4.242 1.299 401 3HG2 VAL 51 3HG2 VAL 51 10.223 2.539 1.750 402 H THR 52 H THR 52 14.006 5.213 -0.415 403 HA THR 52 HA THR 52 11.978 7.301 -0.906 404 HB THR 52 HB THR 52 14.767 7.086 -2.082 405 HG1 THR 52 HG1 THR 52 14.458 7.763 0.238 406 1HG2 THR 52 1HG2 THR 52 13.145 8.146 -3.590 407 2HG2 THR 52 2HG2 THR 52 12.704 9.281 -2.313 408 3HG2 THR 52 3HG2 THR 52 14.331 9.308 -2.994 409 H VAL 53 H VAL 53 10.538 6.750 -2.429 410 HA VAL 53 HA VAL 53 11.397 5.114 -4.690 411 HB VAL 53 HB VAL 53 9.693 3.469 -4.447 412 1HG1 VAL 53 1HG1 VAL 53 11.711 3.077 -3.115 413 2HG1 VAL 53 2HG1 VAL 53 10.948 3.893 -1.733 414 3HG1 VAL 53 3HG1 VAL 53 10.269 2.372 -2.352 415 1HG2 VAL 53 1HG2 VAL 53 8.675 5.172 -2.185 416 2HG2 VAL 53 2HG2 VAL 53 7.840 4.731 -3.676 417 3HG2 VAL 53 3HG2 VAL 53 8.157 3.506 -2.446 418 H GLU 54 H GLU 54 9.297 4.687 -6.087 419 HA GLU 54 HA GLU 54 7.683 7.144 -6.225 420 1HB GLU 54 1HB GLU 54 9.506 7.162 -7.935 421 2HB GLU 54 2HB GLU 54 8.861 5.663 -8.591 422 1HG GLU 54 1HG GLU 54 6.894 6.724 -9.343 423 2HG GLU 54 2HG GLU 54 7.231 8.178 -8.402 424 H TYR 55 H TYR 55 5.504 6.753 -6.468 425 HA TYR 55 HA TYR 55 4.681 4.146 -7.477 426 1HB TYR 55 1HB TYR 55 3.513 3.436 -5.586 427 2HB TYR 55 2HB TYR 55 5.005 4.083 -4.916 428 HD1 TYR 55 HD1 TYR 55 4.938 6.505 -4.035 429 HD2 TYR 55 HD2 TYR 55 1.442 4.205 -4.813 430 HE1 TYR 55 HE1 TYR 55 3.639 7.995 -2.570 431 HE2 TYR 55 HE2 TYR 55 0.125 5.690 -3.349 432 HH TYR 55 HH TYR 55 0.480 7.240 -1.513 433 H THR 56 H THR 56 2.338 3.939 -7.626 434 HA THR 56 HA THR 56 0.938 6.493 -8.016 435 HB THR 56 HB THR 56 0.794 4.122 -9.898 436 HG1 THR 56 HG1 THR 56 2.709 5.744 -9.852 437 1HG2 THR 56 1HG2 THR 56 -1.311 5.358 -9.732 438 2HG2 THR 56 2HG2 THR 56 -0.460 6.866 -10.065 439 3HG2 THR 56 3HG2 THR 56 -0.554 5.613 -11.303 440 H GLY 57 H GLY 57 -0.735 6.482 -6.635 441 1HA GLY 57 1HA GLY 57 -1.919 5.253 -4.901 442 2HA GLY 57 2HA GLY 57 -1.927 3.863 -5.979 443 H ARG 58 H ARG 58 -4.123 3.592 -5.925 444 HA ARG 58 HA ARG 58 -5.810 5.810 -6.769 445 1HB ARG 58 1HB ARG 58 -5.530 5.061 -8.914 446 2HB ARG 58 2HB ARG 58 -5.150 3.419 -8.404 447 1HG ARG 58 1HG ARG 58 -7.938 4.348 -8.019 448 2HG ARG 58 2HG ARG 58 -7.394 4.045 -9.673 449 1HD ARG 58 1HD ARG 58 -6.596 1.798 -8.895 450 2HD ARG 58 2HD ARG 58 -7.395 2.118 -7.355 451 HE ARG 58 HE ARG 58 -9.421 2.470 -9.010 452 1HH1 ARG 58 1HH1 ARG 58 -6.973 -0.011 -9.017 453 2HH1 ARG 58 2HH1 ARG 58 -8.002 -1.205 -9.733 454 1HH2 ARG 58 1HH2 ARG 58 -10.785 0.900 -9.952 455 2HH2 ARG 58 2HH2 ARG 58 -10.168 -0.689 -10.263 456 H LEU 59 H LEU 59 -7.936 5.609 -6.165 457 HA LEU 59 HA LEU 59 -8.454 3.782 -4.004 458 1HB LEU 59 1HB LEU 59 -10.310 5.759 -5.337 459 2HB LEU 59 2HB LEU 59 -10.566 4.978 -3.788 460 HG LEU 59 HG LEU 59 -8.121 6.650 -4.134 461 1HD1 LEU 59 1HD1 LEU 59 -10.893 7.748 -3.677 462 2HD1 LEU 59 2HD1 LEU 59 -9.391 8.650 -3.478 463 3HD1 LEU 59 3HD1 LEU 59 -9.859 8.058 -5.072 464 1HD2 LEU 59 1HD2 LEU 59 -8.654 5.289 -2.086 465 2HD2 LEU 59 2HD2 LEU 59 -8.370 7.006 -1.801 466 3HD2 LEU 59 3HD2 LEU 59 -10.017 6.373 -1.813 467 H ILE 60 H ILE 60 -10.218 2.291 -3.917 468 HA ILE 60 HA ILE 60 -10.487 0.620 -6.127 469 HB ILE 60 HB ILE 60 -11.222 0.440 -3.518 470 1HG1 ILE 60 1HG1 ILE 60 -10.698 -1.456 -4.950 471 2HG1 ILE 60 2HG1 ILE 60 -12.200 -1.754 -4.084 472 1HG2 ILE 60 1HG2 ILE 60 -13.235 1.794 -3.875 473 2HG2 ILE 60 2HG2 ILE 60 -13.821 0.596 -5.031 474 3HG2 ILE 60 3HG2 ILE 60 -13.614 0.157 -3.333 475 1HD1 ILE 60 1HD1 ILE 60 -13.462 -1.160 -6.098 476 2HD1 ILE 60 2HD1 ILE 60 -11.942 -0.907 -6.961 477 3HD1 ILE 60 3HD1 ILE 60 -12.364 -2.517 -6.367 478 H ASP 61 H ASP 61 -11.837 3.639 -5.506 479 HA ASP 61 HA ASP 61 -14.321 3.456 -6.837 480 1HB ASP 61 1HB ASP 61 -13.688 5.319 -5.327 481 2HB ASP 61 2HB ASP 61 -12.533 5.878 -6.533 482 H GLY 62 H GLY 62 -11.182 3.233 -8.041 483 1HA GLY 62 1HA GLY 62 -12.203 3.419 -10.762 484 2HA GLY 62 2HA GLY 62 -10.669 2.723 -10.275 485 H THR 63 H THR 63 -10.784 5.633 -8.710 486 HA THR 63 HA THR 63 -9.508 6.997 -10.987 487 HB THR 63 HB THR 63 -11.591 8.121 -10.570 488 HG1 THR 63 HG1 THR 63 -10.729 10.203 -9.938 489 1HG2 THR 63 1HG2 THR 63 -11.984 7.329 -8.282 490 2HG2 THR 63 2HG2 THR 63 -10.692 8.377 -7.696 491 3HG2 THR 63 3HG2 THR 63 -12.153 9.083 -8.390 492 H VAL 64 H VAL 64 -7.520 7.747 -10.681 493 HA VAL 64 HA VAL 64 -6.008 7.117 -8.415 494 HB VAL 64 HB VAL 64 -4.911 7.406 -10.542 495 1HG1 VAL 64 1HG1 VAL 64 -6.420 9.056 -11.518 496 2HG1 VAL 64 2HG1 VAL 64 -5.795 10.289 -10.423 497 3HG1 VAL 64 3HG1 VAL 64 -4.742 9.582 -11.648 498 1HG2 VAL 64 1HG2 VAL 64 -3.575 7.920 -8.566 499 2HG2 VAL 64 2HG2 VAL 64 -3.087 8.919 -9.934 500 3HG2 VAL 64 3HG2 VAL 64 -4.081 9.607 -8.650 501 H PHE 65 H PHE 65 -5.583 8.200 -6.592 502 HA PHE 65 HA PHE 65 -6.978 10.733 -6.201 503 1HB PHE 65 1HB PHE 65 -6.589 10.342 -3.774 504 2HB PHE 65 2HB PHE 65 -7.514 9.063 -4.551 505 HD1 PHE 65 HD1 PHE 65 -4.155 8.598 -5.472 506 HD2 PHE 65 HD2 PHE 65 -6.810 8.139 -2.199 507 HE1 PHE 65 HE1 PHE 65 -2.628 6.970 -4.491 508 HE2 PHE 65 HE2 PHE 65 -5.295 6.478 -1.226 509 HZ PHE 65 HZ PHE 65 -3.184 5.902 -2.359 510 H ASP 66 H ASP 66 -3.754 9.441 -6.391 511 HA ASP 66 HA ASP 66 -2.566 11.935 -6.724 512 1HB ASP 66 1HB ASP 66 -2.960 12.265 -4.335 513 2HB ASP 66 2HB ASP 66 -2.157 10.740 -3.972 514 H SER 67 H SER 67 -0.724 11.605 -7.812 515 HA SER 67 HA SER 67 0.704 9.064 -7.401 516 1HB SER 67 1HB SER 67 1.169 9.023 -9.855 517 2HB SER 67 2HB SER 67 -0.538 8.827 -9.463 518 HG SER 67 HG SER 67 -0.940 10.864 -10.146 519 H THR 68 H THR 68 2.699 9.444 -6.714 520 HA THR 68 HA THR 68 3.895 12.043 -6.918 521 HB THR 68 HB THR 68 5.820 11.055 -5.751 522 HG1 THR 68 HG1 THR 68 5.422 8.720 -5.132 523 1HG2 THR 68 1HG2 THR 68 3.157 10.161 -4.633 524 2HG2 THR 68 2HG2 THR 68 4.653 10.312 -3.713 525 3HG2 THR 68 3HG2 THR 68 3.902 11.744 -4.415 526 H GLU 69 H GLU 69 3.716 9.374 -8.944 527 HA GLU 69 HA GLU 69 6.272 9.572 -10.210 528 1HB GLU 69 1HB GLU 69 4.824 7.517 -10.155 529 2HB GLU 69 2HB GLU 69 3.743 8.318 -11.286 530 1HG GLU 69 1HG GLU 69 5.593 8.478 -12.900 531 2HG GLU 69 2HG GLU 69 6.621 7.604 -11.767 532 H LYS 70 H LYS 70 2.985 10.627 -11.042 533 HA LYS 70 HA LYS 70 3.731 11.821 -13.516 534 1HB LYS 70 1HB LYS 70 1.270 12.227 -11.813 535 2HB LYS 70 2HB LYS 70 1.466 12.814 -13.457 536 1HG LYS 70 1HG LYS 70 1.740 10.476 -14.216 537 2HG LYS 70 2HG LYS 70 1.410 9.939 -12.568 538 1HD LYS 70 1HD LYS 70 -0.622 9.780 -13.831 539 2HD LYS 70 2HD LYS 70 -0.782 11.120 -12.695 540 1HE LYS 70 1HE LYS 70 -0.237 12.700 -14.486 541 2HE LYS 70 2HE LYS 70 -0.073 11.360 -15.620 542 1HZ LYS 70 1HZ LYS 70 -2.409 10.826 -15.253 543 2HZ LYS 70 2HZ LYS 70 -2.558 12.132 -14.187 544 3HZ LYS 70 3HZ LYS 70 -2.229 12.408 -15.822 545 H THR 71 H THR 71 3.374 13.037 -10.227 546 HA THR 71 HA THR 71 3.422 15.780 -10.784 547 HB THR 71 HB THR 71 4.281 16.067 -8.467 548 HG1 THR 71 HG1 THR 71 5.027 13.498 -8.852 549 1HG2 THR 71 1HG2 THR 71 1.867 15.774 -8.930 550 2HG2 THR 71 2HG2 THR 71 2.056 14.038 -8.685 551 3HG2 THR 71 3HG2 THR 71 2.335 15.153 -7.348 552 H GLY 72 H GLY 72 5.830 13.463 -11.249 553 1HA GLY 72 1HA GLY 72 7.707 15.444 -12.123 554 2HA GLY 72 2HA GLY 72 7.948 13.704 -12.130 555 H LYS 73 H LYS 73 7.041 14.153 -9.102 556 HA LYS 73 HA LYS 73 9.779 14.706 -8.180 557 1HB LYS 73 1HB LYS 73 8.460 16.557 -7.499 558 2HB LYS 73 2HB LYS 73 7.157 15.519 -6.939 559 1HG LYS 73 1HG LYS 73 8.567 14.711 -5.126 560 2HG LYS 73 2HG LYS 73 9.899 15.714 -5.705 561 1HD LYS 73 1HD LYS 73 8.534 17.721 -5.325 562 2HD LYS 73 2HD LYS 73 7.223 16.706 -4.720 563 1HE LYS 73 1HE LYS 73 8.672 15.916 -2.914 564 2HE LYS 73 2HE LYS 73 9.982 16.928 -3.521 565 1HZ LYS 73 1HZ LYS 73 8.620 18.880 -3.091 566 2HZ LYS 73 2HZ LYS 73 7.367 17.906 -2.505 567 3HZ LYS 73 3HZ LYS 73 8.840 17.979 -1.675 568 HA PRO 74 HA PRO 74 9.552 10.432 -6.843 569 1HB PRO 74 1HB PRO 74 11.815 11.367 -5.156 570 2HB PRO 74 2HB PRO 74 11.715 9.965 -6.226 571 1HG PRO 74 1HG PRO 74 13.089 12.140 -6.938 572 2HG PRO 74 2HG PRO 74 12.151 11.214 -8.125 573 1HD PRO 74 1HD PRO 74 11.532 13.839 -6.849 574 2HD PRO 74 2HD PRO 74 11.163 13.257 -8.484 575 H ALA 75 H ALA 75 8.977 9.311 -4.969 576 HA ALA 75 HA ALA 75 7.863 10.982 -2.853 577 1HB ALA 75 1HB ALA 75 7.263 8.311 -3.968 578 2HB ALA 75 2HB ALA 75 6.174 9.581 -3.412 579 3HB ALA 75 3HB ALA 75 6.974 8.535 -2.244 580 H THR 76 H THR 76 8.848 11.146 -0.926 581 HA THR 76 HA THR 76 10.678 8.989 -0.107 582 HB THR 76 HB THR 76 12.126 10.741 -0.855 583 HG1 THR 76 HG1 THR 76 13.305 10.624 0.905 584 1HG2 THR 76 1HG2 THR 76 10.471 12.579 -0.790 585 2HG2 THR 76 2HG2 THR 76 10.623 12.625 0.966 586 3HG2 THR 76 3HG2 THR 76 12.007 13.026 -0.050 587 H PHE 77 H PHE 77 10.014 8.125 1.721 588 HA PHE 77 HA PHE 77 9.272 9.760 3.979 589 1HB PHE 77 1HB PHE 77 7.062 8.727 4.302 590 2HB PHE 77 2HB PHE 77 7.133 9.631 2.792 591 HD1 PHE 77 HD1 PHE 77 7.344 8.404 0.638 592 HD2 PHE 77 HD2 PHE 77 6.636 6.405 4.328 593 HE1 PHE 77 HE1 PHE 77 6.601 6.406 -0.592 594 HE2 PHE 77 HE2 PHE 77 5.893 4.403 3.106 595 HZ PHE 77 HZ PHE 77 5.876 4.402 0.643 596 H GLN 78 H GLN 78 8.928 8.461 5.947 597 HA GLN 78 HA GLN 78 10.749 6.214 6.015 598 1HB GLN 78 1HB GLN 78 9.885 8.153 7.858 599 2HB GLN 78 2HB GLN 78 9.281 6.621 8.474 600 1HG GLN 78 1HG GLN 78 11.915 6.121 7.694 601 2HG GLN 78 2HG GLN 78 11.948 7.684 8.509 602 1HE2 GLN 78 1HE2 GLN 78 9.683 5.097 9.203 603 2HE2 GLN 78 2HE2 GLN 78 10.270 4.757 10.792 604 H VAL 79 H VAL 79 10.225 4.107 6.597 605 HA VAL 79 HA VAL 79 7.787 3.130 5.572 606 HB VAL 79 HB VAL 79 8.538 0.936 6.268 607 1HG1 VAL 79 1HG1 VAL 79 9.542 1.900 4.270 608 2HG1 VAL 79 2HG1 VAL 79 10.811 2.641 5.251 609 3HG1 VAL 79 3HG1 VAL 79 10.706 0.881 5.125 610 1HG2 VAL 79 1HG2 VAL 79 10.673 2.403 7.815 611 2HG2 VAL 79 2HG2 VAL 79 9.354 1.448 8.493 612 3HG2 VAL 79 3HG2 VAL 79 10.621 0.659 7.556 613 H SER 80 H SER 80 8.789 3.920 8.847 614 HA SER 80 HA SER 80 6.397 2.632 9.939 615 1HB SER 80 1HB SER 80 8.500 2.234 11.116 616 2HB SER 80 2HB SER 80 8.721 3.969 11.344 617 HG SER 80 HG SER 80 6.335 2.845 12.243 618 H GLN 81 H GLN 81 7.200 5.629 8.720 619 HA GLN 81 HA GLN 81 5.676 7.192 10.624 620 1HB GLN 81 1HB GLN 81 7.142 7.845 8.088 621 2HB GLN 81 2HB GLN 81 6.075 9.019 8.845 622 1HG GLN 81 1HG GLN 81 7.398 8.861 10.908 623 2HG GLN 81 2HG GLN 81 8.488 7.735 10.103 624 1HE2 GLN 81 1HE2 GLN 81 10.255 9.094 10.372 625 2HE2 GLN 81 2HE2 GLN 81 10.451 10.544 9.455 626 H VAL 82 H VAL 82 4.670 5.060 8.445 627 HA VAL 82 HA VAL 82 2.412 6.710 7.516 628 HB VAL 82 HB VAL 82 2.050 4.767 5.888 629 1HG1 VAL 82 1HG1 VAL 82 2.893 6.955 5.213 630 2HG1 VAL 82 2HG1 VAL 82 4.531 6.468 5.643 631 3HG1 VAL 82 3HG1 VAL 82 3.695 5.669 4.311 632 1HG2 VAL 82 1HG2 VAL 82 4.873 4.173 6.774 633 2HG2 VAL 82 2HG2 VAL 82 3.466 3.124 6.961 634 3HG2 VAL 82 3HG2 VAL 82 4.093 3.482 5.351 635 H ILE 83 H ILE 83 0.513 4.916 6.922 636 HA ILE 83 HA ILE 83 -0.724 4.361 9.344 637 HB ILE 83 HB ILE 83 -2.299 2.953 8.059 638 1HG1 ILE 83 1HG1 ILE 83 -0.491 3.534 5.703 639 2HG1 ILE 83 2HG1 ILE 83 -0.581 1.981 6.525 640 1HG2 ILE 83 1HG2 ILE 83 -2.538 5.395 8.136 641 2HG2 ILE 83 2HG2 ILE 83 -1.564 5.530 6.673 642 3HG2 ILE 83 3HG2 ILE 83 -3.132 4.722 6.619 643 1HD1 ILE 83 1HD1 ILE 83 -2.865 3.333 5.110 644 2HD1 ILE 83 2HD1 ILE 83 -1.886 2.017 4.462 645 3HD1 ILE 83 3HD1 ILE 83 -2.903 1.747 5.878 646 HA PRO 84 HA PRO 84 0.739 0.663 11.197 647 1HB PRO 84 1HB PRO 84 -1.993 -0.457 10.728 648 2HB PRO 84 2HB PRO 84 -1.014 -0.462 12.199 649 1HG PRO 84 1HG PRO 84 -3.016 1.260 11.927 650 2HG PRO 84 2HG PRO 84 -1.491 1.758 12.682 651 1HD PRO 84 1HD PRO 84 -2.563 2.392 9.979 652 2HD PRO 84 2HD PRO 84 -1.533 3.367 11.044 653 H GLY 85 H GLY 85 -1.630 -0.361 8.715 654 1HA GLY 85 1HA GLY 85 -1.416 -1.780 6.935 655 2HA GLY 85 2HA GLY 85 -0.488 -2.774 8.045 656 H TRP 86 H TRP 86 0.178 0.375 6.492 657 HA TRP 86 HA TRP 86 1.995 -0.615 4.599 658 1HB TRP 86 1HB TRP 86 1.107 1.995 5.522 659 2HB TRP 86 2HB TRP 86 2.809 1.992 5.088 660 HD1 TRP 86 HD1 TRP 86 0.262 -0.163 3.189 661 HE1 TRP 86 HE1 TRP 86 0.104 0.709 0.770 662 HE3 TRP 86 HE3 TRP 86 3.128 4.044 3.651 663 HZ2 TRP 86 HZ2 TRP 86 1.068 2.892 -0.740 664 HZ3 TRP 86 HZ3 TRP 86 3.460 5.471 1.673 665 HH2 TRP 86 HH2 TRP 86 2.450 4.905 -0.477 666 H THR 87 H THR 87 2.510 0.552 7.897 667 HA THR 87 HA THR 87 5.309 0.680 7.813 668 HB THR 87 HB THR 87 3.463 0.138 10.139 669 HG1 THR 87 HG1 THR 87 3.893 2.305 8.782 670 1HG2 THR 87 1HG2 THR 87 6.425 0.702 10.124 671 2HG2 THR 87 2HG2 THR 87 5.400 0.794 11.557 672 3HG2 THR 87 3HG2 THR 87 5.622 -0.747 10.727 673 H GLU 88 H GLU 88 3.127 -2.014 8.364 674 HA GLU 88 HA GLU 88 5.114 -3.843 9.249 675 1HB GLU 88 1HB GLU 88 2.761 -4.184 9.766 676 2HB GLU 88 2HB GLU 88 2.381 -4.328 8.055 677 1HG GLU 88 1HG GLU 88 2.443 -6.502 9.142 678 2HG GLU 88 2HG GLU 88 3.702 -6.363 7.912 679 H ALA 89 H ALA 89 3.657 -3.188 6.082 680 HA ALA 89 HA ALA 89 5.070 -5.305 4.768 681 1HB ALA 89 1HB ALA 89 2.934 -4.569 3.922 682 2HB ALA 89 2HB ALA 89 4.180 -4.312 2.699 683 3HB ALA 89 3HB ALA 89 3.572 -2.947 3.640 684 H LEU 90 H LEU 90 5.394 -1.760 4.686 685 HA LEU 90 HA LEU 90 7.527 -1.583 2.934 686 1HB LEU 90 1HB LEU 90 6.461 0.153 5.097 687 2HB LEU 90 2HB LEU 90 8.035 0.543 4.437 688 HG LEU 90 HG LEU 90 6.223 1.822 3.372 689 1HD1 LEU 90 1HD1 LEU 90 7.613 -0.146 1.562 690 2HD1 LEU 90 2HD1 LEU 90 6.841 1.350 1.038 691 3HD1 LEU 90 3HD1 LEU 90 8.241 1.408 2.109 692 1HD2 LEU 90 1HD2 LEU 90 5.266 -0.877 2.430 693 2HD2 LEU 90 2HD2 LEU 90 4.427 0.205 3.541 694 3HD2 LEU 90 3HD2 LEU 90 4.662 0.679 1.859 695 H GLN 91 H GLN 91 7.611 -2.127 6.443 696 HA GLN 91 HA GLN 91 10.417 -1.815 6.698 697 1HB GLN 91 1HB GLN 91 10.189 -2.781 8.892 698 2HB GLN 91 2HB GLN 91 8.831 -1.693 8.605 699 1HG GLN 91 1HG GLN 91 7.405 -3.608 8.103 700 2HG GLN 91 2HG GLN 91 8.763 -4.696 8.384 701 1HE2 GLN 91 1HE2 GLN 91 9.513 -5.011 10.481 702 2HE2 GLN 91 2HE2 GLN 91 8.574 -4.579 11.866 703 H LEU 92 H LEU 92 8.641 -4.204 5.179 704 HA LEU 92 HA LEU 92 10.693 -6.256 5.620 705 1HB LEU 92 1HB LEU 92 7.961 -6.465 4.353 706 2HB LEU 92 2HB LEU 92 9.080 -7.798 4.557 707 HG LEU 92 HG LEU 92 7.898 -6.221 6.842 708 1HD1 LEU 92 1HD1 LEU 92 6.158 -7.432 5.635 709 2HD1 LEU 92 2HD1 LEU 92 7.102 -8.918 5.753 710 3HD1 LEU 92 3HD1 LEU 92 6.465 -8.160 7.214 711 1HD2 LEU 92 1HD2 LEU 92 9.440 -8.813 6.768 712 2HD2 LEU 92 2HD2 LEU 92 10.042 -7.263 7.355 713 3HD2 LEU 92 3HD2 LEU 92 8.727 -8.078 8.203 714 H MET 93 H MET 93 9.888 -3.840 3.463 715 HA MET 93 HA MET 93 10.693 -5.207 1.052 716 1HB MET 93 1HB MET 93 9.994 -2.329 1.633 717 2HB MET 93 2HB MET 93 10.399 -2.946 0.035 718 1HG MET 93 1HG MET 93 8.490 -4.458 0.129 719 2HG MET 93 2HG MET 93 8.087 -3.847 1.732 720 1HE MET 93 1HE MET 93 5.901 -3.940 -0.427 721 2HE MET 93 2HE MET 93 5.632 -3.167 1.133 722 3HE MET 93 3HE MET 93 5.194 -2.327 -0.353 723 HA PRO 94 HA PRO 94 14.988 -4.083 1.984 724 1HB PRO 94 1HB PRO 94 16.131 -5.682 0.140 725 2HB PRO 94 2HB PRO 94 15.495 -6.319 1.664 726 1HG PRO 94 1HG PRO 94 14.240 -6.310 -1.055 727 2HG PRO 94 2HG PRO 94 14.312 -7.620 0.138 728 1HD PRO 94 1HD PRO 94 12.119 -6.037 -0.210 729 2HD PRO 94 2HD PRO 94 12.559 -6.778 1.370 730 H ALA 95 H ALA 95 16.427 -2.682 0.995 731 HA ALA 95 HA ALA 95 15.539 -0.873 -0.876 732 1HB ALA 95 1HB ALA 95 17.528 -0.648 0.631 733 2HB ALA 95 2HB ALA 95 18.431 -1.625 -0.525 734 3HB ALA 95 3HB ALA 95 17.773 -0.066 -1.014 735 H GLY 96 H GLY 96 15.218 -0.897 -3.011 736 1HA GLY 96 1HA GLY 96 16.855 -2.646 -4.695 737 2HA GLY 96 2HA GLY 96 15.850 -1.317 -5.253 738 H SER 97 H SER 97 14.177 -3.214 -3.034 739 HA SER 97 HA SER 97 13.319 -5.325 -4.745 740 1HB SER 97 1HB SER 97 11.658 -5.793 -3.016 741 2HB SER 97 2HB SER 97 13.226 -5.477 -2.277 742 HG SER 97 HG SER 97 11.929 -4.216 -1.118 743 H THR 98 H THR 98 10.710 -5.534 -4.764 744 HA THR 98 HA THR 98 9.374 -3.125 -5.608 745 HB THR 98 HB THR 98 9.824 -5.295 -7.669 746 HG1 THR 98 HG1 THR 98 11.092 -3.570 -8.697 747 1HG2 THR 98 1HG2 THR 98 8.572 -2.552 -7.874 748 2HG2 THR 98 2HG2 THR 98 8.823 -3.672 -9.216 749 3HG2 THR 98 3HG2 THR 98 7.711 -4.092 -7.911 750 H TRP 99 H TRP 99 7.730 -3.601 -4.199 751 HA TRP 99 HA TRP 99 6.294 -6.135 -4.653 752 1HB TRP 99 1HB TRP 99 6.656 -4.462 -2.182 753 2HB TRP 99 2HB TRP 99 5.306 -5.578 -2.325 754 HD1 TRP 99 HD1 TRP 99 8.100 -7.234 -3.990 755 HE1 TRP 99 HE1 TRP 99 9.271 -8.889 -2.406 756 HE3 TRP 99 HE3 TRP 99 6.090 -5.675 0.441 757 HZ2 TRP 99 HZ2 TRP 99 9.333 -9.461 0.362 758 HZ3 TRP 99 HZ3 TRP 99 6.753 -6.827 2.509 759 HH2 TRP 99 HH2 TRP 99 8.338 -8.679 2.470 760 H GLU 100 H GLU 100 4.071 -6.130 -4.777 761 HA GLU 100 HA GLU 100 2.789 -3.502 -5.174 762 1HB GLU 100 1HB GLU 100 2.753 -4.641 -7.268 763 2HB GLU 100 2HB GLU 100 2.345 -6.175 -6.511 764 1HG GLU 100 1HG GLU 100 0.128 -5.425 -6.033 765 2HG GLU 100 2HG GLU 100 0.512 -3.790 -6.574 766 H ILE 101 H ILE 101 1.695 -3.069 -3.326 767 HA ILE 101 HA ILE 101 0.340 -5.318 -2.011 768 HB ILE 101 HB ILE 101 0.600 -4.217 0.086 769 1HG1 ILE 101 1HG1 ILE 101 1.793 -1.921 -1.483 770 2HG1 ILE 101 2HG1 ILE 101 0.277 -1.899 -0.588 771 1HG2 ILE 101 1HG2 ILE 101 2.581 -5.403 -1.160 772 2HG2 ILE 101 2HG2 ILE 101 3.296 -3.794 -1.102 773 3HG2 ILE 101 3HG2 ILE 101 2.838 -4.610 0.392 774 1HD1 ILE 101 1HD1 ILE 101 1.692 -2.406 1.475 775 2HD1 ILE 101 2HD1 ILE 101 3.076 -1.965 0.475 776 3HD1 ILE 101 3HD1 ILE 101 1.800 -0.787 0.783 777 H TYR 102 H TYR 102 -1.710 -5.211 -1.418 778 HA TYR 102 HA TYR 102 -3.238 -2.762 -2.007 779 1HB TYR 102 1HB TYR 102 -5.120 -4.735 -2.154 780 2HB TYR 102 2HB TYR 102 -4.265 -4.087 -3.552 781 HD1 TYR 102 HD1 TYR 102 -4.673 -6.951 -1.341 782 HD2 TYR 102 HD2 TYR 102 -2.427 -5.355 -4.580 783 HE1 TYR 102 HE1 TYR 102 -3.795 -9.195 -1.830 784 HE2 TYR 102 HE2 TYR 102 -1.539 -7.593 -5.076 785 HH TYR 102 HH TYR 102 -1.162 -9.734 -3.861 786 H VAL 103 H VAL 103 -3.561 -1.884 -0.059 787 HA VAL 103 HA VAL 103 -3.932 -3.584 2.278 788 HB VAL 103 HB VAL 103 -3.654 -0.586 2.098 789 1HG1 VAL 103 1HG1 VAL 103 -4.812 -1.334 4.126 790 2HG1 VAL 103 2HG1 VAL 103 -3.465 -2.414 4.488 791 3HG1 VAL 103 3HG1 VAL 103 -3.219 -0.669 4.486 792 1HG2 VAL 103 1HG2 VAL 103 -1.628 -2.732 2.698 793 2HG2 VAL 103 2HG2 VAL 103 -1.646 -1.647 1.308 794 3HG2 VAL 103 3HG2 VAL 103 -1.357 -1.005 2.925 795 HA PRO 104 HA PRO 104 -8.449 -2.965 1.656 796 1HB PRO 104 1HB PRO 104 -8.926 -4.588 3.902 797 2HB PRO 104 2HB PRO 104 -9.019 -5.086 2.214 798 1HG PRO 104 1HG PRO 104 -6.833 -5.458 4.190 799 2HG PRO 104 2HG PRO 104 -7.318 -6.496 2.837 800 1HD PRO 104 1HD PRO 104 -5.111 -4.970 2.730 801 2HD PRO 104 2HD PRO 104 -6.117 -5.263 1.291 802 H SER 105 H SER 105 -9.926 -1.784 2.873 803 HA SER 105 HA SER 105 -9.047 0.265 4.451 804 1HB SER 105 1HB SER 105 -11.493 0.241 5.342 805 2HB SER 105 2HB SER 105 -11.215 0.496 3.614 806 HG SER 105 HG SER 105 -11.559 -2.118 4.570 807 H GLY 106 H GLY 106 -10.231 -2.884 5.556 808 1HA GLY 106 1HA GLY 106 -10.114 -3.957 7.567 809 2HA GLY 106 2HA GLY 106 -10.383 -2.385 8.287 810 H LEU 107 H LEU 107 -7.492 -2.350 6.503 811 HA LEU 107 HA LEU 107 -5.921 -3.422 8.720 812 1HB LEU 107 1HB LEU 107 -4.959 -2.366 6.072 813 2HB LEU 107 2HB LEU 107 -3.988 -3.197 7.267 814 HG LEU 107 HG LEU 107 -6.201 -4.361 5.590 815 1HD1 LEU 107 1HD1 LEU 107 -4.067 -4.097 4.457 816 2HD1 LEU 107 2HD1 LEU 107 -3.258 -4.967 5.761 817 3HD1 LEU 107 3HD1 LEU 107 -4.428 -5.799 4.739 818 1HD2 LEU 107 1HD2 LEU 107 -4.638 -5.657 7.816 819 2HD2 LEU 107 2HD2 LEU 107 -6.361 -5.290 7.830 820 3HD2 LEU 107 3HD2 LEU 107 -5.725 -6.493 6.708 821 H ALA 108 H ALA 108 -6.917 -0.335 7.562 822 HA ALA 108 HA ALA 108 -5.040 0.895 9.471 823 1HB ALA 108 1HB ALA 108 -4.258 1.280 7.179 824 2HB ALA 108 2HB ALA 108 -5.794 2.059 6.792 825 3HB ALA 108 3HB ALA 108 -4.712 2.783 7.985 826 H TYR 109 H TYR 109 -6.597 3.391 8.080 827 HA TYR 109 HA TYR 109 -8.490 3.609 10.273 828 1HB TYR 109 1HB TYR 109 -7.756 5.599 8.110 829 2HB TYR 109 2HB TYR 109 -8.733 5.938 9.535 830 HD1 TYR 109 HD1 TYR 109 -5.366 5.626 8.215 831 HD2 TYR 109 HD2 TYR 109 -7.670 5.871 11.793 832 HE1 TYR 109 HE1 TYR 109 -3.345 6.218 9.476 833 HE2 TYR 109 HE2 TYR 109 -5.648 6.463 13.058 834 HH TYR 109 HH TYR 109 -2.731 7.352 11.553 835 H GLY 110 H GLY 110 -8.568 2.134 7.459 836 1HA GLY 110 1HA GLY 110 -10.317 1.220 6.295 837 2HA GLY 110 2HA GLY 110 -10.517 2.880 5.790 838 HA PRO 111 HA PRO 111 -14.336 0.941 7.970 839 1HB PRO 111 1HB PRO 111 -13.876 -0.024 10.528 840 2HB PRO 111 2HB PRO 111 -13.952 -1.006 9.062 841 1HG PRO 111 1HG PRO 111 -11.561 0.072 10.502 842 2HG PRO 111 2HG PRO 111 -11.797 -1.518 9.750 843 1HD PRO 111 1HD PRO 111 -10.362 0.369 8.526 844 2HD PRO 111 2HD PRO 111 -11.447 -0.689 7.600 845 H ARG 112 H ARG 112 -12.080 3.013 9.481 846 HA ARG 112 HA ARG 112 -13.894 4.023 11.479 847 1HB ARG 112 1HB ARG 112 -11.258 5.085 10.444 848 2HB ARG 112 2HB ARG 112 -12.159 5.806 11.768 849 1HG ARG 112 1HG ARG 112 -11.142 2.974 11.766 850 2HG ARG 112 2HG ARG 112 -10.286 4.341 12.482 851 1HD ARG 112 1HD ARG 112 -12.226 4.751 13.947 852 2HD ARG 112 2HD ARG 112 -13.023 3.338 13.259 853 HE ARG 112 HE ARG 112 -10.539 2.523 14.219 854 1HH1 ARG 112 1HH1 ARG 112 -13.546 3.778 15.453 855 2HH1 ARG 112 2HH1 ARG 112 -13.390 2.998 16.991 856 1HH2 ARG 112 1HH2 ARG 112 -10.324 1.493 16.240 857 2HH2 ARG 112 2HH2 ARG 112 -11.556 1.698 17.440 858 H SER 113 H SER 113 -15.152 5.844 11.371 859 HA SER 113 HA SER 113 -16.103 6.656 8.853 860 1HB SER 113 1HB SER 113 -17.384 8.361 10.101 861 2HB SER 113 2HB SER 113 -17.497 6.771 10.856 862 HG SER 113 HG SER 113 -15.392 8.229 11.791 863 H VAL 114 H VAL 114 -13.238 7.372 10.216 864 HA VAL 114 HA VAL 114 -13.084 10.036 8.985 865 HB VAL 114 HB VAL 114 -12.586 10.060 11.371 866 1HG1 VAL 114 1HG1 VAL 114 -11.803 7.729 11.561 867 2HG1 VAL 114 2HG1 VAL 114 -10.299 8.195 10.767 868 3HG1 VAL 114 3HG1 VAL 114 -10.718 8.885 12.335 869 1HG2 VAL 114 1HG2 VAL 114 -10.150 10.503 9.648 870 2HG2 VAL 114 2HG2 VAL 114 -11.433 11.670 9.990 871 3HG2 VAL 114 3HG2 VAL 114 -10.364 11.126 11.289 872 H GLY 115 H GLY 115 -13.010 8.393 7.059 873 1HA GLY 115 1HA GLY 115 -11.734 7.876 5.206 874 2HA GLY 115 2HA GLY 115 -10.957 6.782 6.339 875 H GLY 116 H GLY 116 -8.886 7.179 6.983 876 1HA GLY 116 1HA GLY 116 -6.824 8.188 7.096 877 2HA GLY 116 2HA GLY 116 -7.629 9.724 6.814 878 HA PRO 117 HA PRO 117 -5.040 9.304 3.083 879 1HB PRO 117 1HB PRO 117 -3.693 6.692 3.422 880 2HB PRO 117 2HB PRO 117 -2.991 8.286 3.130 881 1HG PRO 117 1HG PRO 117 -2.806 7.087 5.523 882 2HG PRO 117 2HG PRO 117 -2.992 8.844 5.372 883 1HD PRO 117 1HD PRO 117 -5.017 6.769 6.104 884 2HD PRO 117 2HD PRO 117 -4.804 8.424 6.738 885 H ILE 118 H ILE 118 -6.232 6.120 4.018 886 HA ILE 118 HA ILE 118 -6.932 5.470 1.264 887 HB ILE 118 HB ILE 118 -7.194 3.863 3.812 888 1HG1 ILE 118 1HG1 ILE 118 -5.332 3.509 1.456 889 2HG1 ILE 118 2HG1 ILE 118 -4.879 4.257 2.984 890 1HG2 ILE 118 1HG2 ILE 118 -8.949 3.265 2.226 891 2HG2 ILE 118 2HG2 ILE 118 -7.735 3.020 0.968 892 3HG2 ILE 118 3HG2 ILE 118 -7.763 1.967 2.385 893 1HD1 ILE 118 1HD1 ILE 118 -5.795 1.412 2.623 894 2HD1 ILE 118 2HD1 ILE 118 -4.130 1.948 2.859 895 3HD1 ILE 118 3HD1 ILE 118 -5.317 2.164 4.146 896 H GLY 119 H GLY 119 -8.987 5.550 0.469 897 1HA GLY 119 1HA GLY 119 -11.275 5.864 0.401 898 2HA GLY 119 2HA GLY 119 -10.943 7.140 1.564 899 HA PRO 120 HA PRO 120 -12.782 5.060 5.000 900 1HB PRO 120 1HB PRO 120 -15.460 5.635 4.476 901 2HB PRO 120 2HB PRO 120 -14.341 6.675 5.362 902 1HG PRO 120 1HG PRO 120 -15.191 6.803 2.505 903 2HG PRO 120 2HG PRO 120 -14.872 8.124 3.644 904 1HD PRO 120 1HD PRO 120 -13.106 7.466 1.742 905 2HD PRO 120 2HD PRO 120 -12.574 7.979 3.357 906 H ASN 121 H ASN 121 -13.230 2.977 5.281 907 HA ASN 121 HA ASN 121 -13.600 0.780 4.721 908 1HB ASN 121 1HB ASN 121 -16.206 1.684 3.544 909 2HB ASN 121 2HB ASN 121 -15.868 0.293 4.574 910 1HD2 ASN 121 1HD2 ASN 121 -16.451 3.693 4.455 911 2HD2 ASN 121 2HD2 ASN 121 -16.721 3.928 6.151 912 H GLU 122 H GLU 122 -12.200 2.246 2.706 913 HA GLU 122 HA GLU 122 -13.170 0.897 0.278 914 1HB GLU 122 1HB GLU 122 -13.190 3.389 0.196 915 2HB GLU 122 2HB GLU 122 -11.447 3.372 0.428 916 1HG GLU 122 1HG GLU 122 -11.053 2.456 -1.674 917 2HG GLU 122 2HG GLU 122 -12.717 1.897 -1.842 918 H THR 123 H THR 123 -11.732 -0.289 -0.951 919 HA THR 123 HA THR 123 -9.224 -0.959 0.401 920 HB THR 123 HB THR 123 -10.607 -2.359 -1.900 921 HG1 THR 123 HG1 THR 123 -10.763 -2.563 0.858 922 1HG2 THR 123 1HG2 THR 123 -8.191 -3.166 -0.275 923 2HG2 THR 123 2HG2 THR 123 -8.988 -4.161 -1.492 924 3HG2 THR 123 3HG2 THR 123 -8.181 -2.666 -1.966 925 H LEU 124 H LEU 124 -7.298 -0.362 -0.386 926 HA LEU 124 HA LEU 124 -7.290 1.013 -2.994 927 1HB LEU 124 1HB LEU 124 -6.499 1.865 -0.427 928 2HB LEU 124 2HB LEU 124 -5.027 1.659 -1.357 929 HG LEU 124 HG LEU 124 -7.176 3.132 -2.737 930 1HD1 LEU 124 1HD1 LEU 124 -7.456 3.961 -0.457 931 2HD1 LEU 124 2HD1 LEU 124 -5.731 4.314 -0.369 932 3HD1 LEU 124 3HD1 LEU 124 -6.756 5.192 -1.505 933 1HD2 LEU 124 1HD2 LEU 124 -4.844 2.743 -3.574 934 2HD2 LEU 124 2HD2 LEU 124 -5.345 4.435 -3.524 935 3HD2 LEU 124 3HD2 LEU 124 -4.277 3.794 -2.278 936 H ILE 125 H ILE 125 -5.467 0.834 -4.314 937 HA ILE 125 HA ILE 125 -3.795 -1.542 -3.859 938 HB ILE 125 HB ILE 125 -4.415 -0.216 -6.502 939 1HG1 ILE 125 1HG1 ILE 125 -5.659 -2.563 -6.709 940 2HG1 ILE 125 2HG1 ILE 125 -5.798 -2.349 -4.965 941 1HG2 ILE 125 1HG2 ILE 125 -3.087 -2.833 -5.811 942 2HG2 ILE 125 2HG2 ILE 125 -3.514 -2.314 -7.444 943 3HG2 ILE 125 3HG2 ILE 125 -2.317 -1.408 -6.514 944 1HD1 ILE 125 1HD1 ILE 125 -6.899 -0.197 -5.321 945 2HD1 ILE 125 2HD1 ILE 125 -6.780 -0.430 -7.065 946 3HD1 ILE 125 3HD1 ILE 125 -7.770 -1.521 -6.096 947 H PHE 126 H PHE 126 -1.591 -1.350 -4.066 948 HA PHE 126 HA PHE 126 -0.530 1.298 -4.751 949 1HB PHE 126 1HB PHE 126 0.288 -0.321 -2.331 950 2HB PHE 126 2HB PHE 126 1.030 1.186 -2.851 951 HD1 PHE 126 HD1 PHE 126 -1.488 -0.309 -0.846 952 HD2 PHE 126 HD2 PHE 126 -0.486 3.261 -2.938 953 HE1 PHE 126 HE1 PHE 126 -3.081 0.949 0.549 954 HE2 PHE 126 HE2 PHE 126 -2.071 4.521 -1.543 955 HZ PHE 126 HZ PHE 126 -3.373 3.370 0.200 956 H LYS 127 H LYS 127 1.182 1.244 -6.050 957 HA LYS 127 HA LYS 127 2.598 -1.321 -6.390 958 1HB LYS 127 1HB LYS 127 1.242 -0.016 -8.333 959 2HB LYS 127 2HB LYS 127 2.803 0.775 -8.487 960 1HG LYS 127 1HG LYS 127 2.352 -2.200 -8.613 961 2HG LYS 127 2HG LYS 127 2.542 -1.140 -10.008 962 1HD LYS 127 1HD LYS 127 4.637 -1.243 -7.861 963 2HD LYS 127 2HD LYS 127 4.592 -2.466 -9.143 964 1HE LYS 127 1HE LYS 127 6.106 -0.732 -9.806 965 2HE LYS 127 2HE LYS 127 4.662 -0.622 -10.812 966 1HZ LYS 127 1HZ LYS 127 5.103 1.043 -8.396 967 2HZ LYS 127 2HZ LYS 127 5.515 1.539 -9.960 968 3HZ LYS 127 3HZ LYS 127 3.899 1.231 -9.567 969 H ILE 128 H ILE 128 4.349 -1.136 -5.106 970 HA ILE 128 HA ILE 128 5.779 1.426 -5.073 971 HB ILE 128 HB ILE 128 6.240 -0.876 -3.192 972 1HG1 ILE 128 1HG1 ILE 128 4.338 1.467 -2.893 973 2HG1 ILE 128 2HG1 ILE 128 3.882 -0.232 -3.044 974 1HG2 ILE 128 1HG2 ILE 128 8.002 0.821 -3.328 975 2HG2 ILE 128 2HG2 ILE 128 6.818 2.077 -2.963 976 3HG2 ILE 128 3HG2 ILE 128 7.198 0.846 -1.758 977 1HD1 ILE 128 1HD1 ILE 128 5.027 -0.685 -0.907 978 2HD1 ILE 128 2HD1 ILE 128 5.363 1.039 -0.752 979 3HD1 ILE 128 3HD1 ILE 128 3.696 0.462 -0.753 980 H HIS 129 H HIS 129 7.698 1.672 -5.911 981 HA HIS 129 HA HIS 129 9.234 -0.716 -6.685 982 1HB HIS 129 1HB HIS 129 8.248 1.215 -8.391 983 2HB HIS 129 2HB HIS 129 9.893 1.768 -8.099 984 HD1 HIS 129 HD1 HIS 129 8.457 0.250 -10.697 985 HD2 HIS 129 HD2 HIS 129 11.398 -1.135 -8.114 986 HE1 HIS 129 HE1 HIS 129 9.634 -1.587 -11.944 987 HE2 HIS 129 HE2 HIS 129 11.242 -2.561 -10.264 988 H LEU 130 H LEU 130 10.654 -0.912 -5.049 989 HA LEU 130 HA LEU 130 11.779 1.383 -3.747 990 1HB LEU 130 1HB LEU 130 11.554 -1.415 -3.207 991 2HB LEU 130 2HB LEU 130 13.234 -0.931 -3.043 992 HG LEU 130 HG LEU 130 12.198 1.025 -1.616 993 1HD1 LEU 130 1HD1 LEU 130 10.113 -1.142 -1.414 994 2HD1 LEU 130 2HD1 LEU 130 10.255 0.236 -0.319 995 3HD1 LEU 130 3HD1 LEU 130 9.880 0.498 -2.025 996 1HD2 LEU 130 1HD2 LEU 130 12.695 -1.806 -0.761 997 2HD2 LEU 130 2HD2 LEU 130 13.766 -0.410 -0.646 998 3HD2 LEU 130 3HD2 LEU 130 12.347 -0.519 0.394 999 H ILE 131 H ILE 131 13.490 2.474 -4.308 1000 HA ILE 131 HA ILE 131 15.264 1.403 -6.363 1001 HB ILE 131 HB ILE 131 15.226 4.161 -5.131 1002 1HG1 ILE 131 1HG1 ILE 131 14.061 3.248 -7.777 1003 2HG1 ILE 131 2HG1 ILE 131 13.105 3.539 -6.303 1004 1HG2 ILE 131 1HG2 ILE 131 17.362 3.498 -6.170 1005 2HG2 ILE 131 2HG2 ILE 131 16.507 3.184 -7.680 1006 3HG2 ILE 131 3HG2 ILE 131 16.573 4.822 -7.027 1007 1HD1 ILE 131 1HD1 ILE 131 14.749 5.592 -7.782 1008 2HD1 ILE 131 2HD1 ILE 131 12.994 5.424 -7.845 1009 3HD1 ILE 131 3HD1 ILE 131 13.784 5.881 -6.334 1010 H SER 132 H SER 132 15.549 2.959 -3.160 1011 HA SER 132 HA SER 132 17.641 1.190 -2.382 1012 1HB SER 132 1HB SER 132 19.487 2.703 -2.276 1013 2HB SER 132 2HB SER 132 18.840 2.797 -3.913 1014 HG SER 132 HG SER 132 18.035 4.762 -3.509 1015 H VAL 133 H VAL 133 18.552 1.782 -0.236 1016 HA VAL 133 HA VAL 133 16.515 3.161 1.397 1017 HB VAL 133 HB VAL 133 18.117 0.694 1.811 1018 1HG1 VAL 133 1HG1 VAL 133 17.420 2.599 4.040 1019 2HG1 VAL 133 2HG1 VAL 133 17.782 0.890 4.288 1020 3HG1 VAL 133 3HG1 VAL 133 19.011 1.962 3.621 1021 1HG2 VAL 133 1HG2 VAL 133 15.742 0.599 1.284 1022 2HG2 VAL 133 2HG2 VAL 133 16.054 -0.040 2.895 1023 3HG2 VAL 133 3HG2 VAL 133 15.379 1.576 2.707 1024 H LYS 134 H LYS 134 17.107 4.941 2.425 1025 HA LYS 134 HA LYS 134 18.404 6.729 3.013 1026 1HB LYS 134 1HB LYS 134 18.875 4.556 4.655 1027 2HB LYS 134 2HB LYS 134 20.495 5.110 4.253 1028 1HG LYS 134 1HG LYS 134 19.870 7.378 5.007 1029 2HG LYS 134 2HG LYS 134 18.281 6.735 5.493 1030 1HD LYS 134 1HD LYS 134 19.414 5.174 7.024 1031 2HD LYS 134 2HD LYS 134 20.971 5.866 6.565 1032 1HE LYS 134 1HE LYS 134 20.251 8.046 7.416 1033 2HE LYS 134 2HE LYS 134 18.693 7.354 7.871 1034 1HZ LYS 134 1HZ LYS 134 19.849 5.869 9.395 1035 2HZ LYS 134 2HZ LYS 134 21.335 6.554 8.967 1036 3HZ LYS 134 3HZ LYS 134 20.174 7.487 9.766 1037 H LYS 135 H LYS 135 18.890 6.502 0.514 1038 HA LYS 135 HA LYS 135 20.333 6.937 -1.169 1039 1HB LYS 135 1HB LYS 135 22.112 7.638 1.152 1040 2HB LYS 135 2HB LYS 135 22.564 7.907 -0.526 1041 1HG LYS 135 1HG LYS 135 20.488 9.305 -0.748 1042 2HG LYS 135 2HG LYS 135 20.309 9.178 1.005 1043 1HD LYS 135 1HD LYS 135 22.747 10.265 -0.400 1044 2HD LYS 135 2HD LYS 135 21.450 11.257 0.268 1045 1HE LYS 135 1HE LYS 135 23.203 9.353 1.823 1046 2HE LYS 135 2HE LYS 135 23.350 11.110 1.809 1047 1HZ LYS 135 1HZ LYS 135 21.127 11.258 2.761 1048 2HZ LYS 135 2HZ LYS 135 21.010 9.570 2.795 1049 3HZ LYS 135 3HZ LYS 135 22.157 10.357 3.757 1050 H SER 136 H SER 136 20.114 4.260 -0.211 1051 HA SER 136 HA SER 136 21.061 2.210 -0.441 1052 1HB SER 136 1HB SER 136 21.307 2.965 -2.764 1053 2HB SER 136 2HB SER 136 22.867 3.687 -2.370 1054 HG SER 136 HG SER 136 23.203 1.659 -3.260 1055 H SER 137 H SER 137 21.804 2.855 1.863 1056 HA SER 137 HA SER 137 24.598 3.345 2.237 1057 1HB SER 137 1HB SER 137 22.501 2.376 4.195 1058 2HB SER 137 2HB SER 137 24.122 2.919 4.626 1059 HG SER 137 HG SER 137 23.264 4.874 3.257 No H/Q in entry = 1059 Start of MODEL 8 1 H1 PHE 1 H1 PHE 1 -24.152 10.064 4.356 2 H2 PHE 1 H2 PHE 1 -24.493 11.275 3.225 3 H3 PHE 1 H3 PHE 1 -24.712 9.649 2.815 4 HA PHE 1 HA PHE 1 -22.719 10.464 1.798 5 1HB PHE 1 1HB PHE 1 -21.939 11.141 4.641 6 2HB PHE 1 2HB PHE 1 -20.825 11.161 3.278 7 HD1 PHE 1 HD1 PHE 1 -20.940 12.893 1.599 8 HD2 PHE 1 HD2 PHE 1 -23.657 12.825 4.874 9 HE1 PHE 1 HE1 PHE 1 -21.596 15.212 1.099 10 HE2 PHE 1 HE2 PHE 1 -24.318 15.141 4.381 11 HZ PHE 1 HZ PHE 1 -23.288 16.339 2.491 12 H ASN 2 H ASN 2 -23.223 8.621 4.729 13 HA ASN 2 HA ASN 2 -21.011 6.870 4.435 14 1HB ASN 2 1HB ASN 2 -22.150 5.456 6.080 15 2HB ASN 2 2HB ASN 2 -22.206 7.154 6.573 16 1HD2 ASN 2 1HD2 ASN 2 -23.924 4.898 7.302 17 2HD2 ASN 2 2HD2 ASN 2 -25.532 5.374 6.887 18 H LYS 3 H LYS 3 -24.016 7.092 2.802 19 HA LYS 3 HA LYS 3 -24.448 4.421 2.094 20 1HB LYS 3 1HB LYS 3 -26.074 6.209 1.641 21 2HB LYS 3 2HB LYS 3 -24.982 6.911 0.455 22 1HG LYS 3 1HG LYS 3 -25.199 4.957 -0.953 23 2HG LYS 3 2HG LYS 3 -26.204 4.165 0.261 24 1HD LYS 3 1HD LYS 3 -27.626 5.061 -1.459 25 2HD LYS 3 2HD LYS 3 -27.856 6.004 0.015 26 1HE LYS 3 1HE LYS 3 -26.395 7.746 -0.853 27 2HE LYS 3 2HE LYS 3 -26.097 6.792 -2.305 28 1HZ LYS 3 1HZ LYS 3 -28.744 7.843 -1.463 29 2HZ LYS 3 2HZ LYS 3 -27.765 8.518 -2.665 30 3HZ LYS 3 3HZ LYS 3 -28.424 6.975 -2.879 31 H LYS 4 H LYS 4 -22.373 6.901 0.700 32 HA LYS 4 HA LYS 4 -21.442 5.206 -1.434 33 1HB LYS 4 1HB LYS 4 -21.535 7.623 -1.762 34 2HB LYS 4 2HB LYS 4 -20.441 7.874 -0.411 35 1HG LYS 4 1HG LYS 4 -19.251 8.138 -2.486 36 2HG LYS 4 2HG LYS 4 -18.671 6.697 -1.651 37 1HD LYS 4 1HD LYS 4 -19.852 5.261 -3.121 38 2HD LYS 4 2HD LYS 4 -20.781 6.601 -3.797 39 1HE LYS 4 1HE LYS 4 -18.997 5.838 -5.316 40 2HE LYS 4 2HE LYS 4 -18.779 7.515 -4.816 41 1HZ LYS 4 1HZ LYS 4 -17.157 6.769 -3.179 42 2HZ LYS 4 2HZ LYS 4 -17.357 5.166 -3.684 43 3HZ LYS 4 3HZ LYS 4 -16.697 6.310 -4.741 44 H ALA 5 H ALA 5 -20.394 6.156 1.764 45 HA ALA 5 HA ALA 5 -17.756 5.236 1.691 46 1HB ALA 5 1HB ALA 5 -18.933 6.592 3.511 47 2HB ALA 5 2HB ALA 5 -19.498 5.040 4.128 48 3HB ALA 5 3HB ALA 5 -17.769 5.373 4.032 49 H ASP 6 H ASP 6 -20.704 3.583 2.791 50 HA ASP 6 HA ASP 6 -19.480 1.085 3.232 51 1HB ASP 6 1HB ASP 6 -22.367 1.771 2.638 52 2HB ASP 6 2HB ASP 6 -21.812 0.176 3.137 53 H GLU 7 H GLU 7 -20.932 2.560 0.377 54 HA GLU 7 HA GLU 7 -21.070 0.306 -1.259 55 1HB GLU 7 1HB GLU 7 -20.659 3.226 -1.794 56 2HB GLU 7 2HB GLU 7 -20.484 2.078 -3.114 57 1HG GLU 7 1HG GLU 7 -22.935 2.347 -1.390 58 2HG GLU 7 2HG GLU 7 -22.729 3.083 -2.978 59 H ASN 8 H ASN 8 -18.379 2.272 -0.258 60 HA ASN 8 HA ASN 8 -16.492 1.178 -2.092 61 1HB ASN 8 1HB ASN 8 -15.844 2.491 0.549 62 2HB ASN 8 2HB ASN 8 -14.843 2.426 -0.925 63 1HD2 ASN 8 1HD2 ASN 8 -15.882 4.679 0.714 64 2HD2 ASN 8 2HD2 ASN 8 -16.705 5.705 -0.404 65 H LYS 9 H LYS 9 -17.465 0.473 1.215 66 HA LYS 9 HA LYS 9 -15.396 -1.337 1.825 67 1HB LYS 9 1HB LYS 9 -16.993 -0.277 3.459 68 2HB LYS 9 2HB LYS 9 -18.212 -1.420 2.915 69 1HG LYS 9 1HG LYS 9 -17.227 -2.221 4.949 70 2HG LYS 9 2HG LYS 9 -16.734 -3.272 3.622 71 1HD LYS 9 1HD LYS 9 -14.586 -2.110 3.497 72 2HD LYS 9 2HD LYS 9 -15.080 -1.049 4.817 73 1HE LYS 9 1HE LYS 9 -15.251 -2.977 6.308 74 2HE LYS 9 2HE LYS 9 -14.779 -4.046 4.988 75 1HZ LYS 9 1HZ LYS 9 -13.101 -1.884 6.141 76 2HZ LYS 9 2HZ LYS 9 -12.908 -3.539 6.427 77 3HZ LYS 9 3HZ LYS 9 -12.648 -2.911 4.877 78 H VAL 10 H VAL 10 -18.542 -1.824 0.269 79 HA VAL 10 HA VAL 10 -18.366 -4.668 0.282 80 HB VAL 10 HB VAL 10 -20.195 -4.575 -1.430 81 1HG1 VAL 10 1HG1 VAL 10 -20.567 -2.997 1.111 82 2HG1 VAL 10 2HG1 VAL 10 -21.876 -3.660 0.134 83 3HG1 VAL 10 3HG1 VAL 10 -20.726 -4.743 0.917 84 1HG2 VAL 10 1HG2 VAL 10 -19.949 -1.598 -0.988 85 2HG2 VAL 10 2HG2 VAL 10 -19.620 -2.470 -2.499 86 3HG2 VAL 10 3HG2 VAL 10 -21.273 -2.409 -1.851 87 H LYS 11 H LYS 11 -17.771 -2.225 -2.260 88 HA LYS 11 HA LYS 11 -16.972 -4.145 -4.197 89 1HB LYS 11 1HB LYS 11 -16.143 -2.238 -5.492 90 2HB LYS 11 2HB LYS 11 -17.755 -1.931 -4.865 91 1HG LYS 11 1HG LYS 11 -16.749 -0.591 -3.046 92 2HG LYS 11 2HG LYS 11 -15.165 -0.838 -3.784 93 1HD LYS 11 1HD LYS 11 -16.028 1.311 -4.457 94 2HD LYS 11 2HD LYS 11 -16.001 0.231 -5.852 95 1HE LYS 11 1HE LYS 11 -18.402 -0.215 -5.519 96 2HE LYS 11 2HE LYS 11 -18.409 0.922 -4.172 97 1HZ LYS 11 1HZ LYS 11 -17.760 2.678 -5.703 98 2HZ LYS 11 2HZ LYS 11 -17.767 1.586 -6.993 99 3HZ LYS 11 3HZ LYS 11 -19.210 1.956 -6.194 100 H GLY 12 H GLY 12 -15.367 -2.573 -1.583 101 1HA GLY 12 1HA GLY 12 -13.191 -2.575 -0.852 102 2HA GLY 12 2HA GLY 12 -12.692 -2.955 -2.496 103 H GLU 13 H GLU 13 -14.652 -4.633 -0.036 104 HA GLU 13 HA GLU 13 -12.770 -6.646 0.508 105 1HB GLU 13 1HB GLU 13 -14.653 -6.143 1.997 106 2HB GLU 13 2HB GLU 13 -15.782 -6.719 0.780 107 1HG GLU 13 1HG GLU 13 -14.833 -8.964 0.960 108 2HG GLU 13 2HG GLU 13 -13.707 -8.385 2.186 109 H ALA 14 H ALA 14 -15.098 -6.246 -2.021 110 HA ALA 14 HA ALA 14 -15.051 -8.988 -2.894 111 1HB ALA 14 1HB ALA 14 -17.012 -7.559 -3.281 112 2HB ALA 14 2HB ALA 14 -16.362 -8.200 -4.790 113 3HB ALA 14 3HB ALA 14 -16.044 -6.526 -4.333 114 H PHE 15 H PHE 15 -13.326 -6.045 -3.586 115 HA PHE 15 HA PHE 15 -12.118 -6.838 -6.013 116 1HB PHE 15 1HB PHE 15 -11.866 -4.585 -5.767 117 2HB PHE 15 2HB PHE 15 -11.721 -4.691 -4.001 118 HD1 PHE 15 HD1 PHE 15 -9.696 -4.222 -3.059 119 HD2 PHE 15 HD2 PHE 15 -9.800 -5.591 -7.086 120 HE1 PHE 15 HE1 PHE 15 -7.263 -3.870 -3.236 121 HE2 PHE 15 HE2 PHE 15 -7.368 -5.260 -7.266 122 HZ PHE 15 HZ PHE 15 -6.096 -4.397 -5.337 123 H LEU 16 H LEU 16 -10.883 -6.847 -2.665 124 HA LEU 16 HA LEU 16 -8.465 -8.168 -3.346 125 1HB LEU 16 1HB LEU 16 -8.526 -8.735 -0.800 126 2HB LEU 16 2HB LEU 16 -8.219 -7.107 -1.369 127 HG LEU 16 HG LEU 16 -10.871 -6.936 -1.100 128 1HD1 LEU 16 1HD1 LEU 16 -11.106 -9.272 -0.396 129 2HD1 LEU 16 2HD1 LEU 16 -10.054 -8.957 0.984 130 3HD1 LEU 16 3HD1 LEU 16 -11.618 -8.152 0.866 131 1HD2 LEU 16 1HD2 LEU 16 -8.868 -6.702 1.143 132 2HD2 LEU 16 2HD2 LEU 16 -9.262 -5.460 -0.047 133 3HD2 LEU 16 3HD2 LEU 16 -10.474 -5.974 1.126 134 H THR 17 H THR 17 -11.653 -9.308 -2.453 135 HA THR 17 HA THR 17 -11.065 -11.952 -1.800 136 HB THR 17 HB THR 17 -13.487 -10.709 -3.100 137 HG1 THR 17 HG1 THR 17 -13.196 -11.934 -0.549 138 1HG2 THR 17 1HG2 THR 17 -13.282 -13.062 -3.864 139 2HG2 THR 17 2HG2 THR 17 -13.241 -13.575 -2.166 140 3HG2 THR 17 3HG2 THR 17 -14.688 -12.786 -2.822 141 H GLU 18 H GLU 18 -11.778 -10.497 -4.952 142 HA GLU 18 HA GLU 18 -11.314 -12.906 -6.420 143 1HB GLU 18 1HB GLU 18 -11.333 -10.033 -7.378 144 2HB GLU 18 2HB GLU 18 -11.398 -11.457 -8.408 145 1HG GLU 18 1HG GLU 18 -13.545 -12.074 -7.439 146 2HG GLU 18 2HG GLU 18 -13.478 -10.665 -6.382 147 H ASN 19 H ASN 19 -9.403 -10.185 -5.384 148 HA ASN 19 HA ASN 19 -7.150 -10.479 -7.012 149 1HB ASN 19 1HB ASN 19 -7.108 -8.502 -5.822 150 2HB ASN 19 2HB ASN 19 -7.667 -9.257 -4.328 151 1HD2 ASN 19 1HD2 ASN 19 -6.192 -10.528 -3.133 152 2HD2 ASN 19 2HD2 ASN 19 -4.493 -10.258 -3.248 153 H LYS 20 H LYS 20 -8.226 -12.348 -4.299 154 HA LYS 20 HA LYS 20 -5.916 -13.439 -3.290 155 1HB LYS 20 1HB LYS 20 -8.590 -14.752 -3.766 156 2HB LYS 20 2HB LYS 20 -7.300 -15.487 -2.823 157 1HG LYS 20 1HG LYS 20 -7.415 -13.789 -1.174 158 2HG LYS 20 2HG LYS 20 -8.469 -12.793 -2.181 159 1HD LYS 20 1HD LYS 20 -10.237 -14.449 -2.004 160 2HD LYS 20 2HD LYS 20 -9.183 -15.499 -1.052 161 1HE LYS 20 1HE LYS 20 -10.092 -12.732 -0.254 162 2HE LYS 20 2HE LYS 20 -10.760 -14.245 0.361 163 1HZ LYS 20 1HZ LYS 20 -7.941 -13.359 0.680 164 2HZ LYS 20 2HZ LYS 20 -9.133 -13.284 1.879 165 3HZ LYS 20 3HZ LYS 20 -8.609 -14.785 1.299 166 H ASN 21 H ASN 21 -7.204 -13.857 -6.437 167 HA ASN 21 HA ASN 21 -6.105 -16.395 -7.037 168 1HB ASN 21 1HB ASN 21 -6.945 -14.120 -8.837 169 2HB ASN 21 2HB ASN 21 -6.496 -15.725 -9.411 170 1HD2 ASN 21 1HD2 ASN 21 -8.250 -15.050 -6.452 171 2HD2 ASN 21 2HD2 ASN 21 -9.722 -15.799 -6.943 172 H LYS 22 H LYS 22 -4.864 -13.127 -7.206 173 HA LYS 22 HA LYS 22 -2.697 -13.337 -8.867 174 1HB LYS 22 1HB LYS 22 -3.150 -11.803 -6.332 175 2HB LYS 22 2HB LYS 22 -1.600 -11.710 -7.154 176 1HG LYS 22 1HG LYS 22 -3.130 -9.864 -7.733 177 2HG LYS 22 2HG LYS 22 -2.635 -10.819 -9.131 178 1HD LYS 22 1HD LYS 22 -4.780 -12.040 -9.012 179 2HD LYS 22 2HD LYS 22 -5.263 -11.019 -7.657 180 1HE LYS 22 1HE LYS 22 -5.122 -9.044 -9.076 181 2HE LYS 22 2HE LYS 22 -4.592 -10.042 -10.430 182 1HZ LYS 22 1HZ LYS 22 -7.221 -10.242 -9.061 183 2HZ LYS 22 2HZ LYS 22 -6.947 -9.532 -10.572 184 3HZ LYS 22 3HZ LYS 22 -6.714 -11.195 -10.364 185 HA PRO 23 HA PRO 23 -0.381 -16.697 -6.974 186 1HB PRO 23 1HB PRO 23 1.757 -15.671 -8.757 187 2HB PRO 23 2HB PRO 23 1.098 -17.305 -8.608 188 1HG PRO 23 1HG PRO 23 0.506 -15.766 -10.710 189 2HG PRO 23 2HG PRO 23 -0.700 -16.852 -9.991 190 1HD PRO 23 1HD PRO 23 -0.413 -13.888 -9.727 191 2HD PRO 23 2HD PRO 23 -1.886 -14.874 -9.851 192 H GLY 24 H GLY 24 0.964 -16.782 -5.257 193 1HA GLY 24 1HA GLY 24 2.954 -14.707 -4.838 194 2HA GLY 24 2HA GLY 24 2.759 -16.172 -3.893 195 H VAL 25 H VAL 25 -0.277 -14.944 -4.023 196 HA VAL 25 HA VAL 25 -0.293 -12.707 -2.381 197 HB VAL 25 HB VAL 25 -2.283 -14.912 -2.792 198 1HG1 VAL 25 1HG1 VAL 25 -2.521 -12.677 -0.778 199 2HG1 VAL 25 2HG1 VAL 25 -3.887 -13.625 -1.374 200 3HG1 VAL 25 3HG1 VAL 25 -2.594 -14.414 -0.468 201 1HG2 VAL 25 1HG2 VAL 25 -1.865 -12.961 -4.391 202 2HG2 VAL 25 2HG2 VAL 25 -3.534 -13.281 -3.916 203 3HG2 VAL 25 3HG2 VAL 25 -2.642 -11.956 -3.167 204 H VAL 26 H VAL 26 0.516 -12.394 -0.432 205 HA VAL 26 HA VAL 26 0.407 -14.589 1.525 206 HB VAL 26 HB VAL 26 2.696 -14.486 0.797 207 1HG1 VAL 26 1HG1 VAL 26 2.494 -11.533 1.331 208 2HG1 VAL 26 2HG1 VAL 26 4.019 -12.385 1.079 209 3HG1 VAL 26 3HG1 VAL 26 2.812 -12.336 -0.208 210 1HG2 VAL 26 1HG2 VAL 26 2.342 -14.850 3.180 211 2HG2 VAL 26 2HG2 VAL 26 3.836 -13.946 2.899 212 3HG2 VAL 26 3HG2 VAL 26 2.388 -13.104 3.463 213 H VAL 27 H VAL 27 -0.507 -14.048 3.400 214 HA VAL 27 HA VAL 27 -1.307 -11.297 3.834 215 HB VAL 27 HB VAL 27 -2.924 -13.097 4.236 216 1HG1 VAL 27 1HG1 VAL 27 -1.031 -13.944 6.424 217 2HG1 VAL 27 2HG1 VAL 27 -2.666 -14.567 6.200 218 3HG1 VAL 27 3HG1 VAL 27 -1.437 -14.853 4.968 219 1HG2 VAL 27 1HG2 VAL 27 -2.128 -11.592 6.727 220 2HG2 VAL 27 2HG2 VAL 27 -3.199 -11.016 5.449 221 3HG2 VAL 27 3HG2 VAL 27 -3.688 -12.372 6.464 222 H LEU 28 H LEU 28 -0.674 -9.988 5.501 223 HA LEU 28 HA LEU 28 1.745 -10.831 6.932 224 1HB LEU 28 1HB LEU 28 0.669 -8.062 6.382 225 2HB LEU 28 2HB LEU 28 2.152 -8.409 7.250 226 HG LEU 28 HG LEU 28 1.586 -8.870 4.328 227 1HD1 LEU 28 1HD1 LEU 28 3.636 -7.205 5.783 228 2HD1 LEU 28 2HD1 LEU 28 3.513 -7.389 4.034 229 3HD1 LEU 28 3HD1 LEU 28 2.215 -6.602 4.929 230 1HD2 LEU 28 1HD2 LEU 28 3.805 -9.914 6.063 231 2HD2 LEU 28 2HD2 LEU 28 2.799 -10.790 4.908 232 3HD2 LEU 28 3HD2 LEU 28 4.023 -9.658 4.333 233 HA PRO 29 HA PRO 29 0.050 -10.752 11.008 234 1HB PRO 29 1HB PRO 29 1.700 -8.335 11.609 235 2HB PRO 29 2HB PRO 29 1.543 -9.843 12.517 236 1HG PRO 29 1HG PRO 29 3.702 -9.385 11.038 237 2HG PRO 29 2HG PRO 29 2.973 -11.000 11.099 238 1HD PRO 29 1HD PRO 29 2.865 -8.949 8.934 239 2HD PRO 29 2HD PRO 29 2.904 -10.727 8.816 240 H SER 30 H SER 30 0.383 -7.540 9.530 241 HA SER 30 HA SER 30 -1.808 -6.452 11.051 242 1HB SER 30 1HB SER 30 -0.009 -5.387 8.896 243 2HB SER 30 2HB SER 30 -1.462 -4.503 9.365 244 HG SER 30 HG SER 30 -0.390 -5.053 11.615 245 H GLY 31 H GLY 31 -1.594 -8.383 8.310 246 1HA GLY 31 1HA GLY 31 -4.378 -7.717 7.660 247 2HA GLY 31 2HA GLY 31 -3.611 -9.267 7.357 248 H LEU 32 H LEU 32 -1.235 -7.468 6.343 249 HA LEU 32 HA LEU 32 -2.365 -6.418 3.898 250 1HB LEU 32 1HB LEU 32 0.404 -6.509 5.034 251 2HB LEU 32 2HB LEU 32 0.139 -6.068 3.362 252 HG LEU 32 HG LEU 32 -0.207 -4.487 5.788 253 1HD1 LEU 32 1HD1 LEU 32 1.317 -4.020 3.893 254 2HD1 LEU 32 2HD1 LEU 32 -0.093 -3.702 2.886 255 3HD1 LEU 32 3HD1 LEU 32 0.240 -2.680 4.284 256 1HD2 LEU 32 1HD2 LEU 32 -2.379 -4.398 3.693 257 2HD2 LEU 32 2HD2 LEU 32 -2.576 -4.808 5.399 258 3HD2 LEU 32 3HD2 LEU 32 -2.113 -3.170 4.932 259 H GLN 33 H GLN 33 -2.355 -7.258 1.966 260 HA GLN 33 HA GLN 33 -0.921 -9.788 1.499 261 1HB GLN 33 1HB GLN 33 -3.648 -8.959 0.483 262 2HB GLN 33 2HB GLN 33 -2.791 -10.403 -0.032 263 1HG GLN 33 1HG GLN 33 -2.885 -11.311 2.207 264 2HG GLN 33 2HG GLN 33 -3.667 -9.816 2.794 265 1HE2 GLN 33 1HE2 GLN 33 -5.803 -9.395 2.198 266 2HE2 GLN 33 2HE2 GLN 33 -6.854 -10.638 1.616 267 H TYR 34 H TYR 34 0.108 -9.970 -0.522 268 HA TYR 34 HA TYR 34 -0.235 -7.877 -2.484 269 1HB TYR 34 1HB TYR 34 2.115 -7.121 -2.393 270 2HB TYR 34 2HB TYR 34 1.220 -6.744 -0.924 271 HD1 TYR 34 HD1 TYR 34 3.966 -8.663 -2.360 272 HD2 TYR 34 HD2 TYR 34 1.671 -7.974 1.155 273 HE1 TYR 34 HE1 TYR 34 5.681 -9.795 -1.024 274 HE2 TYR 34 HE2 TYR 34 3.378 -9.103 2.495 275 HH TYR 34 HH TYR 34 6.468 -9.870 1.292 276 H LYS 35 H LYS 35 1.516 -8.048 -4.218 277 HA LYS 35 HA LYS 35 2.164 -10.885 -4.708 278 1HB LYS 35 1HB LYS 35 0.302 -9.706 -6.121 279 2HB LYS 35 2HB LYS 35 1.654 -8.926 -6.929 280 1HG LYS 35 1HG LYS 35 1.592 -11.899 -6.646 281 2HG LYS 35 2HG LYS 35 0.648 -11.103 -7.912 282 1HD LYS 35 1HD LYS 35 3.609 -10.691 -7.500 283 2HD LYS 35 2HD LYS 35 2.926 -11.871 -8.620 284 1HE LYS 35 1HE LYS 35 2.492 -8.886 -8.697 285 2HE LYS 35 2HE LYS 35 3.531 -9.810 -9.780 286 1HZ LYS 35 1HZ LYS 35 1.574 -11.004 -10.566 287 2HZ LYS 35 2HZ LYS 35 0.584 -10.094 -9.539 288 3HZ LYS 35 3HZ LYS 35 1.407 -9.338 -10.810 289 H VAL 36 H VAL 36 4.269 -11.229 -4.776 290 HA VAL 36 HA VAL 36 6.174 -9.117 -4.711 291 HB VAL 36 HB VAL 36 6.650 -12.078 -5.050 292 1HG1 VAL 36 1HG1 VAL 36 8.590 -10.730 -5.656 293 2HG1 VAL 36 2HG1 VAL 36 8.491 -9.877 -4.118 294 3HG1 VAL 36 3HG1 VAL 36 8.876 -11.597 -4.147 295 1HG2 VAL 36 1HG2 VAL 36 6.416 -10.368 -2.580 296 2HG2 VAL 36 2HG2 VAL 36 5.384 -11.718 -3.052 297 3HG2 VAL 36 3HG2 VAL 36 7.060 -12.009 -2.589 298 H ILE 37 H ILE 37 7.161 -8.113 -6.284 299 HA ILE 37 HA ILE 37 7.072 -9.203 -9.001 300 HB ILE 37 HB ILE 37 7.844 -6.441 -8.048 301 1HG1 ILE 37 1HG1 ILE 37 5.655 -6.041 -9.537 302 2HG1 ILE 37 2HG1 ILE 37 5.297 -7.668 -8.964 303 1HG2 ILE 37 1HG2 ILE 37 7.513 -7.523 -10.839 304 2HG2 ILE 37 2HG2 ILE 37 7.745 -5.825 -10.426 305 3HG2 ILE 37 3HG2 ILE 37 9.017 -6.998 -10.083 306 1HD1 ILE 37 1HD1 ILE 37 5.553 -6.895 -6.658 307 2HD1 ILE 37 2HD1 ILE 37 5.868 -5.265 -7.254 308 3HD1 ILE 37 3HD1 ILE 37 4.295 -6.013 -7.523 309 H ASN 38 H ASN 38 9.471 -7.315 -7.116 310 HA ASN 38 HA ASN 38 11.516 -9.297 -7.758 311 1HB ASN 38 1HB ASN 38 11.667 -7.689 -9.593 312 2HB ASN 38 2HB ASN 38 11.765 -6.358 -8.443 313 1HD2 ASN 38 1HD2 ASN 38 13.661 -6.021 -7.302 314 2HD2 ASN 38 2HD2 ASN 38 15.154 -6.764 -7.750 315 H SER 39 H SER 39 11.593 -9.803 -5.564 316 HA SER 39 HA SER 39 12.354 -7.639 -3.728 317 1HB SER 39 1HB SER 39 11.665 -9.136 -1.921 318 2HB SER 39 2HB SER 39 10.368 -8.947 -3.097 319 HG SER 39 HG SER 39 10.894 -10.958 -3.950 320 H GLY 40 H GLY 40 14.143 -7.783 -2.399 321 1HA GLY 40 1HA GLY 40 15.892 -10.108 -2.618 322 2HA GLY 40 2HA GLY 40 16.073 -8.771 -1.494 323 H ASN 41 H ASN 41 17.241 -6.957 -2.090 324 HA ASN 41 HA ASN 41 19.038 -7.382 -4.322 325 1HB ASN 41 1HB ASN 41 17.287 -4.917 -4.179 326 2HB ASN 41 2HB ASN 41 18.630 -5.142 -5.295 327 1HD2 ASN 41 1HD2 ASN 41 15.398 -6.075 -4.459 328 2HD2 ASN 41 2HD2 ASN 41 15.027 -6.879 -5.941 329 H GLY 42 H GLY 42 18.273 -4.357 -2.625 330 1HA GLY 42 1HA GLY 42 19.881 -2.871 -1.781 331 2HA GLY 42 2HA GLY 42 21.072 -4.157 -1.844 332 H VAL 43 H VAL 43 21.374 -2.876 0.270 333 HA VAL 43 HA VAL 43 20.365 -4.503 2.437 334 HB VAL 43 HB VAL 43 22.060 -3.324 3.768 335 1HG1 VAL 43 1HG1 VAL 43 23.093 -4.464 1.181 336 2HG1 VAL 43 2HG1 VAL 43 24.037 -4.261 2.657 337 3HG1 VAL 43 3HG1 VAL 43 22.673 -5.379 2.628 338 1HG2 VAL 43 1HG2 VAL 43 22.619 -1.893 1.190 339 2HG2 VAL 43 2HG2 VAL 43 22.046 -1.184 2.697 340 3HG2 VAL 43 3HG2 VAL 43 23.674 -1.853 2.602 341 H LYS 44 H LYS 44 20.108 -3.106 4.586 342 HA LYS 44 HA LYS 44 19.225 -0.526 4.720 343 1HB LYS 44 1HB LYS 44 16.958 -0.399 4.219 344 2HB LYS 44 2HB LYS 44 17.569 -1.403 2.919 345 1HG LYS 44 1HG LYS 44 16.168 -2.388 5.395 346 2HG LYS 44 2HG LYS 44 15.464 -2.253 3.785 347 1HD LYS 44 1HD LYS 44 16.968 -3.923 2.929 348 2HD LYS 44 2HD LYS 44 17.849 -3.972 4.456 349 1HE LYS 44 1HE LYS 44 14.977 -4.787 4.020 350 2HE LYS 44 2HE LYS 44 16.343 -5.873 4.272 351 1HZ LYS 44 1HZ LYS 44 15.337 -3.884 6.234 352 2HZ LYS 44 2HZ LYS 44 15.072 -5.552 6.302 353 3HZ LYS 44 3HZ LYS 44 16.638 -4.938 6.477 354 HA PRO 45 HA PRO 45 18.455 -1.690 8.910 355 1HB PRO 45 1HB PRO 45 16.861 0.697 9.311 356 2HB PRO 45 2HB PRO 45 18.510 0.364 9.844 357 1HG PRO 45 1HG PRO 45 17.905 2.203 7.935 358 2HG PRO 45 2HG PRO 45 19.442 1.321 7.983 359 1HD PRO 45 1HD PRO 45 17.015 0.804 6.305 360 2HD PRO 45 2HD PRO 45 18.729 0.765 5.847 361 H GLY 46 H GLY 46 16.700 -1.741 10.586 362 1HA GLY 46 1HA GLY 46 14.747 -2.723 11.286 363 2HA GLY 46 2HA GLY 46 14.525 -3.297 9.636 364 H LYS 47 H LYS 47 12.294 -2.566 10.930 365 HA LYS 47 HA LYS 47 10.944 -0.920 9.266 366 1HB LYS 47 1HB LYS 47 9.262 -0.656 10.999 367 2HB LYS 47 2HB LYS 47 9.900 -2.296 10.999 368 1HG LYS 47 1HG LYS 47 11.387 -1.653 12.886 369 2HG LYS 47 2HG LYS 47 10.572 -0.088 12.931 370 1HD LYS 47 1HD LYS 47 9.565 -1.479 14.591 371 2HD LYS 47 2HD LYS 47 8.416 -1.317 13.260 372 1HE LYS 47 1HE LYS 47 8.530 -3.623 14.071 373 2HE LYS 47 2HE LYS 47 9.079 -3.497 12.402 374 1HZ LYS 47 1HZ LYS 47 10.836 -3.660 14.791 375 2HZ LYS 47 2HZ LYS 47 10.529 -4.920 13.704 376 3HZ LYS 47 3HZ LYS 47 11.364 -3.543 13.188 377 H SER 48 H SER 48 13.321 0.232 11.456 378 HA SER 48 HA SER 48 12.205 2.913 11.597 379 1HB SER 48 1HB SER 48 14.248 3.462 12.866 380 2HB SER 48 2HB SER 48 13.451 2.034 13.525 381 HG SER 48 HG SER 48 15.944 2.259 12.658 382 H ASP 49 H ASP 49 13.417 1.310 9.155 383 HA ASP 49 HA ASP 49 15.539 2.928 8.155 384 1HB ASP 49 1HB ASP 49 15.276 1.654 6.112 385 2HB ASP 49 2HB ASP 49 15.178 0.572 7.497 386 H THR 50 H THR 50 15.490 4.253 6.268 387 HA THR 50 HA THR 50 12.880 5.509 5.671 388 HB THR 50 HB THR 50 15.534 6.976 5.810 389 HG1 THR 50 HG1 THR 50 15.135 6.871 7.902 390 1HG2 THR 50 1HG2 THR 50 13.865 7.919 4.260 391 2HG2 THR 50 2HG2 THR 50 12.701 8.000 5.581 392 3HG2 THR 50 3HG2 THR 50 14.163 8.983 5.635 393 H VAL 51 H VAL 51 12.437 5.236 3.530 394 HA VAL 51 HA VAL 51 14.731 5.070 1.691 395 HB VAL 51 HB VAL 51 13.686 3.318 0.424 396 1HG1 VAL 51 1HG1 VAL 51 15.059 2.658 2.345 397 2HG1 VAL 51 2HG1 VAL 51 13.615 2.620 3.359 398 3HG1 VAL 51 3HG1 VAL 51 13.782 1.485 2.016 399 1HG2 VAL 51 1HG2 VAL 51 11.414 3.486 2.407 400 2HG2 VAL 51 2HG2 VAL 51 11.356 3.952 0.705 401 3HG2 VAL 51 3HG2 VAL 51 11.587 2.259 1.149 402 H THR 52 H THR 52 14.284 5.559 -0.520 403 HA THR 52 HA THR 52 12.014 7.409 -0.847 404 HB THR 52 HB THR 52 14.692 7.436 -2.263 405 HG1 THR 52 HG1 THR 52 14.082 9.696 -0.938 406 1HG2 THR 52 1HG2 THR 52 12.879 8.188 -3.720 407 2HG2 THR 52 2HG2 THR 52 12.345 9.325 -2.484 408 3HG2 THR 52 3HG2 THR 52 13.915 9.539 -3.259 409 H VAL 53 H VAL 53 10.497 6.694 -2.192 410 HA VAL 53 HA VAL 53 11.283 5.013 -4.451 411 HB VAL 53 HB VAL 53 9.578 3.393 -4.062 412 1HG1 VAL 53 1HG1 VAL 53 11.650 3.013 -2.851 413 2HG1 VAL 53 2HG1 VAL 53 11.028 3.947 -1.473 414 3HG1 VAL 53 3HG1 VAL 53 10.258 2.410 -1.924 415 1HG2 VAL 53 1HG2 VAL 53 8.717 5.107 -1.734 416 2HG2 VAL 53 2HG2 VAL 53 7.816 4.813 -3.222 417 3HG2 VAL 53 3HG2 VAL 53 8.094 3.493 -2.082 418 H GLU 54 H GLU 54 9.388 4.658 -5.942 419 HA GLU 54 HA GLU 54 7.668 7.052 -6.046 420 1HB GLU 54 1HB GLU 54 9.527 7.086 -7.728 421 2HB GLU 54 2HB GLU 54 8.876 5.607 -8.416 422 1HG GLU 54 1HG GLU 54 6.818 6.759 -8.995 423 2HG GLU 54 2HG GLU 54 7.425 8.238 -8.255 424 H TYR 55 H TYR 55 5.502 6.638 -6.330 425 HA TYR 55 HA TYR 55 4.742 3.986 -7.292 426 1HB TYR 55 1HB TYR 55 3.423 3.410 -5.423 427 2HB TYR 55 2HB TYR 55 4.953 3.964 -4.756 428 HD1 TYR 55 HD1 TYR 55 5.057 6.392 -3.914 429 HD2 TYR 55 HD2 TYR 55 1.407 4.355 -4.715 430 HE1 TYR 55 HE1 TYR 55 3.857 8.000 -2.494 431 HE2 TYR 55 HE2 TYR 55 0.185 5.962 -3.295 432 HH TYR 55 HH TYR 55 0.647 7.510 -1.461 433 H THR 56 H THR 56 2.447 3.745 -7.617 434 HA THR 56 HA THR 56 1.079 6.279 -8.242 435 HB THR 56 HB THR 56 0.853 3.691 -9.803 436 HG1 THR 56 HG1 THR 56 2.054 4.806 -11.398 437 1HG2 THR 56 1HG2 THR 56 -0.230 6.459 -10.341 438 2HG2 THR 56 2HG2 THR 56 -0.362 5.079 -11.431 439 3HG2 THR 56 3HG2 THR 56 -1.172 5.046 -9.865 440 H GLY 57 H GLY 57 -0.600 6.478 -6.863 441 1HA GLY 57 1HA GLY 57 -1.835 5.468 -5.021 442 2HA GLY 57 2HA GLY 57 -1.881 3.977 -5.951 443 H ARG 58 H ARG 58 -4.051 3.720 -5.996 444 HA ARG 58 HA ARG 58 -5.726 5.903 -6.937 445 1HB ARG 58 1HB ARG 58 -6.701 4.545 -8.747 446 2HB ARG 58 2HB ARG 58 -4.985 4.859 -9.009 447 1HG ARG 58 1HG ARG 58 -4.962 2.659 -9.488 448 2HG ARG 58 2HG ARG 58 -4.810 2.511 -7.734 449 1HD ARG 58 1HD ARG 58 -6.506 0.991 -8.451 450 2HD ARG 58 2HD ARG 58 -7.297 2.326 -7.611 451 HE ARG 58 HE ARG 58 -8.034 3.153 -9.733 452 1HH1 ARG 58 1HH1 ARG 58 -6.553 -0.001 -9.828 453 2HH1 ARG 58 2HH1 ARG 58 -7.271 -0.433 -11.344 454 1HH2 ARG 58 1HH2 ARG 58 -8.980 2.591 -11.731 455 2HH2 ARG 58 2HH2 ARG 58 -8.646 1.039 -12.426 456 H LEU 59 H LEU 59 -7.877 5.676 -6.407 457 HA LEU 59 HA LEU 59 -8.449 3.865 -4.243 458 1HB LEU 59 1HB LEU 59 -10.310 5.747 -5.701 459 2HB LEU 59 2HB LEU 59 -10.597 5.000 -4.143 460 HG LEU 59 HG LEU 59 -8.172 6.689 -4.365 461 1HD1 LEU 59 1HD1 LEU 59 -10.960 7.834 -4.313 462 2HD1 LEU 59 2HD1 LEU 59 -9.477 8.739 -4.008 463 3HD1 LEU 59 3HD1 LEU 59 -9.769 8.033 -5.598 464 1HD2 LEU 59 1HD2 LEU 59 -8.983 5.473 -2.304 465 2HD2 LEU 59 2HD2 LEU 59 -8.664 7.196 -2.109 466 3HD2 LEU 59 3HD2 LEU 59 -10.323 6.618 -2.264 467 H ILE 60 H ILE 60 -10.293 2.413 -4.208 468 HA ILE 60 HA ILE 60 -10.372 0.638 -6.368 469 HB ILE 60 HB ILE 60 -11.237 0.491 -3.825 470 1HG1 ILE 60 1HG1 ILE 60 -10.764 -1.412 -5.322 471 2HG1 ILE 60 2HG1 ILE 60 -12.213 -1.673 -4.362 472 1HG2 ILE 60 1HG2 ILE 60 -13.172 1.934 -4.237 473 2HG2 ILE 60 2HG2 ILE 60 -13.785 0.760 -5.405 474 3HG2 ILE 60 3HG2 ILE 60 -13.643 0.319 -3.702 475 1HD1 ILE 60 1HD1 ILE 60 -13.569 -1.015 -6.329 476 2HD1 ILE 60 2HD1 ILE 60 -12.078 -0.918 -7.271 477 3HD1 ILE 60 3HD1 ILE 60 -12.590 -2.461 -6.584 478 H ASP 61 H ASP 61 -11.758 3.668 -5.934 479 HA ASP 61 HA ASP 61 -14.154 3.455 -7.403 480 1HB ASP 61 1HB ASP 61 -13.553 5.380 -5.943 481 2HB ASP 61 2HB ASP 61 -12.359 5.877 -7.139 482 H GLY 62 H GLY 62 -10.939 3.187 -8.408 483 1HA GLY 62 1HA GLY 62 -11.802 3.204 -11.191 484 2HA GLY 62 2HA GLY 62 -10.294 2.555 -10.575 485 H THR 63 H THR 63 -10.543 5.540 -9.186 486 HA THR 63 HA THR 63 -9.157 6.813 -11.453 487 HB THR 63 HB THR 63 -11.272 7.931 -11.154 488 HG1 THR 63 HG1 THR 63 -9.375 9.608 -9.874 489 1HG2 THR 63 1HG2 THR 63 -11.712 7.243 -8.834 490 2HG2 THR 63 2HG2 THR 63 -10.459 8.352 -8.274 491 3HG2 THR 63 3HG2 THR 63 -11.914 8.982 -9.048 492 H VAL 64 H VAL 64 -7.196 7.613 -11.084 493 HA VAL 64 HA VAL 64 -5.772 7.039 -8.749 494 HB VAL 64 HB VAL 64 -4.620 7.337 -10.864 495 1HG1 VAL 64 1HG1 VAL 64 -6.069 9.016 -11.859 496 2HG1 VAL 64 2HG1 VAL 64 -5.487 10.220 -10.709 497 3HG1 VAL 64 3HG1 VAL 64 -4.386 9.541 -11.908 498 1HG2 VAL 64 1HG2 VAL 64 -3.870 9.384 -8.784 499 2HG2 VAL 64 2HG2 VAL 64 -3.253 7.742 -8.952 500 3HG2 VAL 64 3HG2 VAL 64 -2.850 8.963 -10.158 501 H PHE 65 H PHE 65 -5.434 8.162 -6.919 502 HA PHE 65 HA PHE 65 -6.893 10.672 -6.642 503 1HB PHE 65 1HB PHE 65 -6.621 10.352 -4.197 504 2HB PHE 65 2HB PHE 65 -7.464 9.021 -4.977 505 HD1 PHE 65 HD1 PHE 65 -4.053 8.630 -5.711 506 HD2 PHE 65 HD2 PHE 65 -6.858 8.201 -2.561 507 HE1 PHE 65 HE1 PHE 65 -2.529 7.088 -4.590 508 HE2 PHE 65 HE2 PHE 65 -5.349 6.623 -1.451 509 HZ PHE 65 HZ PHE 65 -3.163 6.075 -2.451 510 H ASP 66 H ASP 66 -3.643 9.440 -6.697 511 HA ASP 66 HA ASP 66 -2.517 11.970 -7.031 512 1HB ASP 66 1HB ASP 66 -3.005 12.267 -4.639 513 2HB ASP 66 2HB ASP 66 -2.094 10.805 -4.268 514 H SER 67 H SER 67 -0.651 11.705 -8.066 515 HA SER 67 HA SER 67 0.825 9.183 -7.677 516 1HB SER 67 1HB SER 67 0.413 10.708 -10.263 517 2HB SER 67 2HB SER 67 1.441 9.286 -10.077 518 HG SER 67 HG SER 67 -0.267 8.063 -10.146 519 H THR 68 H THR 68 2.865 9.453 -6.993 520 HA THR 68 HA THR 68 3.968 12.069 -6.693 521 HB THR 68 HB THR 68 5.912 11.011 -5.728 522 HG1 THR 68 HG1 THR 68 5.162 8.401 -6.062 523 1HG2 THR 68 1HG2 THR 68 3.316 9.633 -5.032 524 2HG2 THR 68 2HG2 THR 68 4.793 9.449 -4.089 525 3HG2 THR 68 3HG2 THR 68 4.042 11.036 -4.248 526 H GLU 69 H GLU 69 3.770 10.025 -9.312 527 HA GLU 69 HA GLU 69 6.306 10.549 -10.531 528 1HB GLU 69 1HB GLU 69 3.722 9.600 -11.782 529 2HB GLU 69 2HB GLU 69 5.307 9.549 -12.538 530 1HG GLU 69 1HG GLU 69 6.071 8.005 -10.793 531 2HG GLU 69 2HG GLU 69 4.456 8.030 -10.085 532 H LYS 70 H LYS 70 3.014 11.800 -10.966 533 HA LYS 70 HA LYS 70 3.584 13.572 -13.064 534 1HB LYS 70 1HB LYS 70 1.309 12.899 -12.489 535 2HB LYS 70 2HB LYS 70 1.433 13.748 -10.955 536 1HG LYS 70 1HG LYS 70 1.480 15.860 -12.019 537 2HG LYS 70 2HG LYS 70 1.713 15.127 -13.609 538 1HD LYS 70 1HD LYS 70 -0.496 14.176 -13.545 539 2HD LYS 70 2HD LYS 70 -0.734 14.743 -11.891 540 1HE LYS 70 1HE LYS 70 -1.885 16.206 -13.452 541 2HE LYS 70 2HE LYS 70 -0.554 17.067 -12.681 542 1HZ LYS 70 1HZ LYS 70 -0.486 15.859 -15.394 543 2HZ LYS 70 2HZ LYS 70 -0.648 17.510 -15.054 544 3HZ LYS 70 3HZ LYS 70 0.783 16.700 -14.657 545 H THR 71 H THR 71 3.720 13.982 -9.562 546 HA THR 71 HA THR 71 4.115 16.759 -9.507 547 HB THR 71 HB THR 71 5.346 14.798 -7.564 548 HG1 THR 71 HG1 THR 71 3.389 14.665 -6.580 549 1HG2 THR 71 1HG2 THR 71 4.380 17.645 -7.261 550 2HG2 THR 71 2HG2 THR 71 4.983 16.630 -5.952 551 3HG2 THR 71 3HG2 THR 71 6.059 17.107 -7.266 552 H GLY 72 H GLY 72 6.067 14.283 -10.705 553 1HA GLY 72 1HA GLY 72 8.154 16.100 -11.424 554 2HA GLY 72 2HA GLY 72 8.109 14.375 -11.763 555 H LYS 73 H LYS 73 7.551 14.509 -8.575 556 HA LYS 73 HA LYS 73 10.419 14.312 -7.950 557 1HB LYS 73 1HB LYS 73 9.650 16.392 -7.018 558 2HB LYS 73 2HB LYS 73 8.264 15.605 -6.276 559 1HG LYS 73 1HG LYS 73 9.729 14.383 -4.779 560 2HG LYS 73 2HG LYS 73 11.145 15.087 -5.560 561 1HD LYS 73 1HD LYS 73 8.997 16.660 -4.137 562 2HD LYS 73 2HD LYS 73 10.547 16.201 -3.429 563 1HE LYS 73 1HE LYS 73 10.143 17.944 -5.858 564 2HE LYS 73 2HE LYS 73 10.614 18.494 -4.250 565 1HZ LYS 73 1HZ LYS 73 12.198 16.624 -5.926 566 2HZ LYS 73 2HZ LYS 73 12.504 18.281 -5.782 567 3HZ LYS 73 3HZ LYS 73 12.659 17.271 -4.434 568 HA PRO 74 HA PRO 74 9.285 10.165 -6.727 569 1HB PRO 74 1HB PRO 74 11.731 10.465 -5.060 570 2HB PRO 74 2HB PRO 74 11.298 9.185 -6.198 571 1HG PRO 74 1HG PRO 74 13.127 11.025 -6.825 572 2HG PRO 74 2HG PRO 74 11.996 10.399 -8.037 573 1HD PRO 74 1HD PRO 74 12.001 13.026 -6.624 574 2HD PRO 74 2HD PRO 74 11.491 12.628 -8.277 575 H ALA 75 H ALA 75 8.771 9.039 -4.726 576 HA ALA 75 HA ALA 75 7.846 10.901 -2.688 577 1HB ALA 75 1HB ALA 75 7.252 7.982 -2.644 578 2HB ALA 75 2HB ALA 75 6.276 9.329 -2.070 579 3HB ALA 75 3HB ALA 75 6.441 9.031 -3.799 580 H THR 76 H THR 76 8.900 11.159 -0.803 581 HA THR 76 HA THR 76 10.724 9.008 0.083 582 HB THR 76 HB THR 76 11.170 11.974 0.498 583 HG1 THR 76 HG1 THR 76 11.593 11.633 -1.632 584 1HG2 THR 76 1HG2 THR 76 12.940 9.578 1.005 585 2HG2 THR 76 2HG2 THR 76 13.419 11.264 1.199 586 3HG2 THR 76 3HG2 THR 76 12.166 10.580 2.234 587 H PHE 77 H PHE 77 10.008 8.125 1.900 588 HA PHE 77 HA PHE 77 9.243 9.761 4.149 589 1HB PHE 77 1HB PHE 77 7.028 8.697 4.439 590 2HB PHE 77 2HB PHE 77 7.117 9.658 2.965 591 HD1 PHE 77 HD1 PHE 77 7.294 8.542 0.771 592 HD2 PHE 77 HD2 PHE 77 6.671 6.344 4.365 593 HE1 PHE 77 HE1 PHE 77 6.577 6.593 -0.548 594 HE2 PHE 77 HE2 PHE 77 5.955 4.393 3.049 595 HZ PHE 77 HZ PHE 77 5.908 4.515 0.590 596 H GLN 78 H GLN 78 8.952 8.513 6.119 597 HA GLN 78 HA GLN 78 10.673 6.185 6.194 598 1HB GLN 78 1HB GLN 78 9.877 8.192 8.022 599 2HB GLN 78 2HB GLN 78 9.258 6.679 8.667 600 1HG GLN 78 1HG GLN 78 12.018 6.519 7.732 601 2HG GLN 78 2HG GLN 78 11.772 7.663 9.049 602 1HE2 GLN 78 1HE2 GLN 78 9.816 4.805 8.610 603 2HE2 GLN 78 2HE2 GLN 78 10.403 3.953 9.993 604 H VAL 79 H VAL 79 10.014 4.085 6.710 605 HA VAL 79 HA VAL 79 7.427 3.363 5.782 606 HB VAL 79 HB VAL 79 8.062 1.090 6.156 607 1HG1 VAL 79 1HG1 VAL 79 9.101 2.224 4.257 608 2HG1 VAL 79 2HG1 VAL 79 10.466 2.692 5.279 609 3HG1 VAL 79 3HG1 VAL 79 10.169 0.986 4.926 610 1HG2 VAL 79 1HG2 VAL 79 10.337 2.185 7.805 611 2HG2 VAL 79 2HG2 VAL 79 8.958 1.256 8.395 612 3HG2 VAL 79 3HG2 VAL 79 10.146 0.495 7.335 613 H SER 80 H SER 80 8.499 4.293 8.883 614 HA SER 80 HA SER 80 6.421 2.750 10.245 615 1HB SER 80 1HB SER 80 8.648 4.501 11.292 616 2HB SER 80 2HB SER 80 7.430 3.753 12.325 617 HG SER 80 HG SER 80 8.583 1.990 10.592 618 H GLN 81 H GLN 81 6.944 5.892 8.997 619 HA GLN 81 HA GLN 81 5.119 7.242 10.765 620 1HB GLN 81 1HB GLN 81 6.281 8.152 8.130 621 2HB GLN 81 2HB GLN 81 5.447 9.170 9.296 622 1HG GLN 81 1HG GLN 81 8.057 7.736 9.721 623 2HG GLN 81 2HG GLN 81 7.839 9.466 9.466 624 1HE2 GLN 81 1HE2 GLN 81 9.044 8.018 11.704 625 2HE2 GLN 81 2HE2 GLN 81 8.173 8.510 13.112 626 H VAL 82 H VAL 82 4.415 4.968 8.598 627 HA VAL 82 HA VAL 82 2.038 6.371 7.570 628 HB VAL 82 HB VAL 82 1.942 4.425 5.919 629 1HG1 VAL 82 1HG1 VAL 82 4.214 6.411 5.837 630 2HG1 VAL 82 2HG1 VAL 82 3.622 5.499 4.449 631 3HG1 VAL 82 3HG1 VAL 82 2.569 6.663 5.253 632 1HG2 VAL 82 1HG2 VAL 82 3.500 2.946 7.093 633 2HG2 VAL 82 2HG2 VAL 82 4.071 3.309 5.464 634 3HG2 VAL 82 3HG2 VAL 82 4.798 4.117 6.853 635 H ILE 83 H ILE 83 0.337 4.478 6.898 636 HA ILE 83 HA ILE 83 -0.969 3.773 9.236 637 HB ILE 83 HB ILE 83 -2.389 2.318 7.822 638 1HG1 ILE 83 1HG1 ILE 83 -0.499 3.113 5.596 639 2HG1 ILE 83 2HG1 ILE 83 -0.557 1.516 6.333 640 1HG2 ILE 83 1HG2 ILE 83 -1.725 5.042 6.717 641 2HG2 ILE 83 2HG2 ILE 83 -3.181 4.127 6.326 642 3HG2 ILE 83 3HG2 ILE 83 -2.896 4.666 7.981 643 1HD1 ILE 83 1HD1 ILE 83 -2.861 1.252 5.566 644 2HD1 ILE 83 2HD1 ILE 83 -2.787 2.845 4.815 645 3HD1 ILE 83 3HD1 ILE 83 -1.749 1.545 4.228 646 HA PRO 84 HA PRO 84 0.485 0.057 11.049 647 1HB PRO 84 1HB PRO 84 -2.102 -1.226 10.301 648 2HB PRO 84 2HB PRO 84 -1.271 -1.191 11.859 649 1HG PRO 84 1HG PRO 84 -3.360 0.387 11.408 650 2HG PRO 84 2HG PRO 84 -1.962 0.970 12.331 651 1HD PRO 84 1HD PRO 84 -2.787 1.596 9.540 652 2HD PRO 84 2HD PRO 84 -1.959 2.618 10.732 653 H GLY 85 H GLY 85 -1.566 -1.087 8.345 654 1HA GLY 85 1HA GLY 85 -1.098 -2.475 6.587 655 2HA GLY 85 2HA GLY 85 -0.135 -3.370 7.750 656 H TRP 86 H TRP 86 0.293 -0.150 6.302 657 HA TRP 86 HA TRP 86 2.208 -0.809 4.416 658 1HB TRP 86 1HB TRP 86 1.268 1.647 5.696 659 2HB TRP 86 2HB TRP 86 2.936 1.733 5.143 660 HD1 TRP 86 HD1 TRP 86 0.121 -0.152 3.295 661 HE1 TRP 86 HE1 TRP 86 -0.160 0.909 0.966 662 HE3 TRP 86 HE3 TRP 86 3.354 3.769 3.797 663 HZ2 TRP 86 HZ2 TRP 86 0.851 3.124 -0.464 664 HZ3 TRP 86 HZ3 TRP 86 3.637 5.316 1.906 665 HH2 TRP 86 HH2 TRP 86 2.411 4.999 -0.180 666 H THR 87 H THR 87 2.786 0.258 7.787 667 HA THR 87 HA THR 87 5.590 0.275 7.551 668 HB THR 87 HB THR 87 4.447 1.389 9.415 669 HG1 THR 87 HG1 THR 87 6.441 1.135 10.112 670 1HG2 THR 87 1HG2 THR 87 3.824 -1.431 10.260 671 2HG2 THR 87 2HG2 THR 87 3.828 -0.082 11.396 672 3HG2 THR 87 3HG2 THR 87 2.709 -0.085 10.033 673 H GLU 88 H GLU 88 3.338 -2.323 8.280 674 HA GLU 88 HA GLU 88 5.320 -4.168 9.162 675 1HB GLU 88 1HB GLU 88 2.514 -4.574 8.143 676 2HB GLU 88 2HB GLU 88 3.529 -5.888 8.721 677 1HG GLU 88 1HG GLU 88 2.561 -3.520 10.303 678 2HG GLU 88 2HG GLU 88 2.043 -5.202 10.467 679 H ALA 89 H ALA 89 3.821 -3.554 6.009 680 HA ALA 89 HA ALA 89 5.145 -5.757 4.738 681 1HB ALA 89 1HB ALA 89 3.005 -4.885 3.916 682 2HB ALA 89 2HB ALA 89 4.251 -4.867 2.665 683 3HB ALA 89 3HB ALA 89 3.797 -3.368 3.482 684 H LEU 90 H LEU 90 5.586 -2.239 4.666 685 HA LEU 90 HA LEU 90 7.715 -2.091 2.897 686 1HB LEU 90 1HB LEU 90 6.654 -0.379 5.074 687 2HB LEU 90 2HB LEU 90 8.262 -0.016 4.484 688 HG LEU 90 HG LEU 90 6.395 1.299 3.432 689 1HD1 LEU 90 1HD1 LEU 90 8.247 -0.364 1.751 690 2HD1 LEU 90 2HD1 LEU 90 7.273 0.952 1.096 691 3HD1 LEU 90 3HD1 LEU 90 8.484 1.282 2.335 692 1HD2 LEU 90 1HD2 LEU 90 4.753 -0.506 3.264 693 2HD2 LEU 90 2HD2 LEU 90 5.077 0.220 1.689 694 3HD2 LEU 90 3HD2 LEU 90 5.787 -1.340 2.103 695 H GLN 91 H GLN 91 7.772 -2.611 6.404 696 HA GLN 91 HA GLN 91 10.572 -2.414 6.706 697 1HB GLN 91 1HB GLN 91 10.258 -3.379 8.887 698 2HB GLN 91 2HB GLN 91 8.925 -2.267 8.570 699 1HG GLN 91 1HG GLN 91 7.535 -4.216 7.925 700 2HG GLN 91 2HG GLN 91 8.857 -5.273 8.415 701 1HE2 GLN 91 1HE2 GLN 91 7.986 -2.301 10.041 702 2HE2 GLN 91 2HE2 GLN 91 7.424 -3.037 11.500 703 H LEU 92 H LEU 92 8.870 -4.668 4.983 704 HA LEU 92 HA LEU 92 10.765 -6.829 5.585 705 1HB LEU 92 1HB LEU 92 8.118 -6.881 4.140 706 2HB LEU 92 2HB LEU 92 9.186 -8.264 4.282 707 HG LEU 92 HG LEU 92 7.882 -6.829 6.597 708 1HD1 LEU 92 1HD1 LEU 92 6.272 -8.057 5.229 709 2HD1 LEU 92 2HD1 LEU 92 7.268 -9.509 5.360 710 3HD1 LEU 92 3HD1 LEU 92 6.507 -8.828 6.800 711 1HD2 LEU 92 1HD2 LEU 92 9.549 -9.342 6.501 712 2HD2 LEU 92 2HD2 LEU 92 10.025 -7.799 7.212 713 3HD2 LEU 92 3HD2 LEU 92 8.703 -8.726 7.921 714 H MET 93 H MET 93 9.703 -4.672 3.039 715 HA MET 93 HA MET 93 11.145 -6.078 0.990 716 1HB MET 93 1HB MET 93 10.499 -4.168 -0.439 717 2HB MET 93 2HB MET 93 9.127 -4.918 0.364 718 1HG MET 93 1HG MET 93 9.098 -3.106 1.999 719 2HG MET 93 2HG MET 93 10.486 -2.366 1.204 720 1HE MET 93 1HE MET 93 6.692 -3.039 1.165 721 2HE MET 93 2HE MET 93 6.201 -2.586 -0.467 722 3HE MET 93 3HE MET 93 7.155 -4.045 -0.208 723 HA PRO 94 HA PRO 94 14.974 -3.982 2.197 724 1HB PRO 94 1HB PRO 94 16.586 -5.352 0.494 725 2HB PRO 94 2HB PRO 94 16.034 -6.024 2.036 726 1HG PRO 94 1HG PRO 94 14.972 -6.493 -0.725 727 2HG PRO 94 2HG PRO 94 15.267 -7.662 0.575 728 1HD PRO 94 1HD PRO 94 12.796 -6.699 0.011 729 2HD PRO 94 2HD PRO 94 13.308 -7.140 1.678 730 H ALA 95 H ALA 95 16.157 -2.333 1.268 731 HA ALA 95 HA ALA 95 15.101 -0.796 -0.722 732 1HB ALA 95 1HB ALA 95 16.959 -0.216 0.891 733 2HB ALA 95 2HB ALA 95 18.066 -0.976 -0.253 734 3HB ALA 95 3HB ALA 95 17.119 0.428 -0.741 735 H GLY 96 H GLY 96 14.929 -0.912 -2.873 736 1HA GLY 96 1HA GLY 96 16.833 -2.590 -4.363 737 2HA GLY 96 2HA GLY 96 15.865 -1.293 -5.048 738 H SER 97 H SER 97 14.004 -3.124 -2.946 739 HA SER 97 HA SER 97 13.283 -5.243 -4.767 740 1HB SER 97 1HB SER 97 12.064 -4.342 -2.147 741 2HB SER 97 2HB SER 97 11.568 -5.779 -3.039 742 HG SER 97 HG SER 97 14.154 -5.964 -2.827 743 H THR 98 H THR 98 10.661 -5.525 -4.757 744 HA THR 98 HA THR 98 9.289 -3.081 -5.452 745 HB THR 98 HB THR 98 9.616 -5.175 -7.606 746 HG1 THR 98 HG1 THR 98 11.042 -2.774 -7.124 747 1HG2 THR 98 1HG2 THR 98 8.487 -2.373 -7.639 748 2HG2 THR 98 2HG2 THR 98 8.655 -3.425 -9.045 749 3HG2 THR 98 3HG2 THR 98 7.561 -3.871 -7.734 750 H TRP 99 H TRP 99 7.568 -3.492 -4.181 751 HA TRP 99 HA TRP 99 6.079 -5.988 -4.683 752 1HB TRP 99 1HB TRP 99 6.613 -4.556 -2.091 753 2HB TRP 99 2HB TRP 99 5.212 -5.599 -2.273 754 HD1 TRP 99 HD1 TRP 99 7.616 -7.406 -4.203 755 HE1 TRP 99 HE1 TRP 99 8.866 -9.166 -2.799 756 HE3 TRP 99 HE3 TRP 99 6.442 -5.704 0.470 757 HZ2 TRP 99 HZ2 TRP 99 9.296 -9.753 -0.070 758 HZ3 TRP 99 HZ3 TRP 99 7.308 -6.920 2.423 759 HH2 TRP 99 HH2 TRP 99 8.704 -8.902 2.159 760 H GLU 100 H GLU 100 3.832 -5.852 -4.702 761 HA GLU 100 HA GLU 100 2.726 -3.122 -4.739 762 1HB GLU 100 1HB GLU 100 1.119 -3.850 -6.427 763 2HB GLU 100 2HB GLU 100 2.758 -4.124 -6.996 764 1HG GLU 100 1HG GLU 100 2.522 -6.508 -6.315 765 2HG GLU 100 2HG GLU 100 0.828 -6.177 -5.947 766 H ILE 101 H ILE 101 1.634 -2.863 -2.899 767 HA ILE 101 HA ILE 101 0.198 -5.178 -1.802 768 HB ILE 101 HB ILE 101 0.244 -3.990 0.352 769 1HG1 ILE 101 1HG1 ILE 101 1.999 -2.002 -1.103 770 2HG1 ILE 101 2HG1 ILE 101 0.355 -1.691 -0.561 771 1HG2 ILE 101 1HG2 ILE 101 2.744 -4.695 -1.105 772 2HG2 ILE 101 2HG2 ILE 101 2.856 -4.037 0.527 773 3HG2 ILE 101 3HG2 ILE 101 1.951 -5.522 0.235 774 1HD1 ILE 101 1HD1 ILE 101 1.065 -2.007 1.755 775 2HD1 ILE 101 2HD1 ILE 101 2.715 -2.298 1.202 776 3HD1 ILE 101 3HD1 ILE 101 1.969 -0.719 0.957 777 H TYR 102 H TYR 102 -1.885 -5.130 -1.332 778 HA TYR 102 HA TYR 102 -3.409 -2.689 -1.960 779 1HB TYR 102 1HB TYR 102 -5.269 -4.684 -2.058 780 2HB TYR 102 2HB TYR 102 -4.391 -4.092 -3.465 781 HD1 TYR 102 HD1 TYR 102 -4.862 -6.865 -1.167 782 HD2 TYR 102 HD2 TYR 102 -2.470 -5.390 -4.364 783 HE1 TYR 102 HE1 TYR 102 -3.964 -9.121 -1.534 784 HE2 TYR 102 HE2 TYR 102 -1.568 -7.641 -4.734 785 HH TYR 102 HH TYR 102 -2.925 -10.415 -3.358 786 H VAL 103 H VAL 103 -3.756 -1.729 -0.059 787 HA VAL 103 HA VAL 103 -4.151 -3.333 2.342 788 HB VAL 103 HB VAL 103 -3.859 -0.342 2.086 789 1HG1 VAL 103 1HG1 VAL 103 -3.689 -2.177 4.470 790 2HG1 VAL 103 2HG1 VAL 103 -3.306 -0.456 4.480 791 3HG1 VAL 103 3HG1 VAL 103 -4.952 -0.991 4.143 792 1HG2 VAL 103 1HG2 VAL 103 -1.802 -2.461 2.707 793 2HG2 VAL 103 2HG2 VAL 103 -1.870 -1.455 1.260 794 3HG2 VAL 103 3HG2 VAL 103 -1.541 -0.723 2.828 795 HA PRO 104 HA PRO 104 -8.642 -2.660 1.771 796 1HB PRO 104 1HB PRO 104 -9.165 -4.158 4.074 797 2HB PRO 104 2HB PRO 104 -9.191 -4.770 2.420 798 1HG PRO 104 1HG PRO 104 -7.056 -4.956 4.487 799 2HG PRO 104 2HG PRO 104 -7.520 -6.128 3.239 800 1HD PRO 104 1HD PRO 104 -5.315 -4.622 3.006 801 2HD PRO 104 2HD PRO 104 -6.309 -5.042 1.589 802 H SER 105 H SER 105 -10.067 -1.365 2.923 803 HA SER 105 HA SER 105 -9.109 0.714 4.426 804 1HB SER 105 1HB SER 105 -11.560 0.864 5.266 805 2HB SER 105 2HB SER 105 -11.252 1.001 3.528 806 HG SER 105 HG SER 105 -12.675 -0.557 3.436 807 H GLY 106 H GLY 106 -10.450 -2.332 5.620 808 1HA GLY 106 1HA GLY 106 -10.409 -3.343 7.666 809 2HA GLY 106 2HA GLY 106 -10.655 -1.741 8.323 810 H LEU 107 H LEU 107 -7.735 -1.830 6.618 811 HA LEU 107 HA LEU 107 -6.178 -2.975 8.767 812 1HB LEU 107 1HB LEU 107 -5.370 -3.411 6.603 813 2HB LEU 107 2HB LEU 107 -5.497 -1.737 6.117 814 HG LEU 107 HG LEU 107 -3.171 -2.669 6.451 815 1HD1 LEU 107 1HD1 LEU 107 -3.992 -0.196 6.546 816 2HD1 LEU 107 2HD1 LEU 107 -3.557 -0.327 8.250 817 3HD1 LEU 107 3HD1 LEU 107 -2.340 -0.608 7.005 818 1HD2 LEU 107 1HD2 LEU 107 -3.972 -3.778 8.677 819 2HD2 LEU 107 2HD2 LEU 107 -2.328 -3.159 8.529 820 3HD2 LEU 107 3HD2 LEU 107 -3.551 -2.214 9.372 821 H ALA 108 H ALA 108 -7.004 0.296 7.711 822 HA ALA 108 HA ALA 108 -5.434 1.272 10.010 823 1HB ALA 108 1HB ALA 108 -4.203 1.767 7.987 824 2HB ALA 108 2HB ALA 108 -5.609 2.585 7.301 825 3HB ALA 108 3HB ALA 108 -4.802 3.257 8.721 826 H TYR 109 H TYR 109 -6.678 3.862 8.356 827 HA TYR 109 HA TYR 109 -8.772 4.263 10.327 828 1HB TYR 109 1HB TYR 109 -7.776 6.120 8.155 829 2HB TYR 109 2HB TYR 109 -8.793 6.558 9.524 830 HD1 TYR 109 HD1 TYR 109 -5.383 5.901 8.396 831 HD2 TYR 109 HD2 TYR 109 -7.851 6.607 11.797 832 HE1 TYR 109 HE1 TYR 109 -3.388 6.417 9.736 833 HE2 TYR 109 HE2 TYR 109 -5.858 7.126 13.141 834 HH TYR 109 HH TYR 109 -3.450 6.656 13.121 835 H GLY 110 H GLY 110 -8.652 2.667 7.575 836 1HA GLY 110 1HA GLY 110 -10.277 1.829 6.215 837 2HA GLY 110 2HA GLY 110 -10.416 3.499 5.716 838 HA PRO 111 HA PRO 111 -14.410 1.543 7.561 839 1HB PRO 111 1HB PRO 111 -14.176 0.691 10.196 840 2HB PRO 111 2HB PRO 111 -14.127 -0.352 8.772 841 1HG PRO 111 1HG PRO 111 -11.873 0.786 10.370 842 2HG PRO 111 2HG PRO 111 -12.036 -0.826 9.649 843 1HD PRO 111 1HD PRO 111 -10.503 1.036 8.498 844 2HD PRO 111 2HD PRO 111 -11.496 -0.061 7.516 845 H ARG 112 H ARG 112 -12.331 3.698 9.198 846 HA ARG 112 HA ARG 112 -14.347 4.758 10.965 847 1HB ARG 112 1HB ARG 112 -11.695 5.960 10.142 848 2HB ARG 112 2HB ARG 112 -12.691 6.469 11.499 849 1HG ARG 112 1HG ARG 112 -12.363 4.265 12.539 850 2HG ARG 112 2HG ARG 112 -11.312 3.811 11.197 851 1HD ARG 112 1HD ARG 112 -9.808 5.667 11.768 852 2HD ARG 112 2HD ARG 112 -10.852 6.081 13.129 853 HE ARG 112 HE ARG 112 -10.027 3.371 13.272 854 1HH1 ARG 112 1HH1 ARG 112 -8.898 6.628 13.783 855 2HH1 ARG 112 2HH1 ARG 112 -7.716 6.170 14.961 856 1HH2 ARG 112 1HH2 ARG 112 -8.474 2.759 14.823 857 2HH2 ARG 112 2HH2 ARG 112 -7.474 3.971 15.553 858 H SER 113 H SER 113 -15.619 6.544 10.641 859 HA SER 113 HA SER 113 -16.297 7.242 8.006 860 1HB SER 113 1HB SER 113 -16.897 8.702 10.589 861 2HB SER 113 2HB SER 113 -17.678 9.027 9.042 862 HG SER 113 HG SER 113 -18.391 7.255 10.835 863 H VAL 114 H VAL 114 -13.653 8.053 9.742 864 HA VAL 114 HA VAL 114 -13.254 10.611 8.338 865 HB VAL 114 HB VAL 114 -11.657 9.662 10.711 866 1HG1 VAL 114 1HG1 VAL 114 -10.633 11.410 9.363 867 2HG1 VAL 114 2HG1 VAL 114 -12.095 12.395 9.507 868 3HG1 VAL 114 3HG1 VAL 114 -11.121 12.042 10.940 869 1HG2 VAL 114 1HG2 VAL 114 -14.145 11.369 10.716 870 2HG2 VAL 114 2HG2 VAL 114 -13.967 9.764 11.428 871 3HG2 VAL 114 3HG2 VAL 114 -13.075 11.131 12.098 872 H GLY 115 H GLY 115 -12.855 8.785 6.598 873 1HA GLY 115 1HA GLY 115 -11.329 7.887 5.139 874 2HA GLY 115 2HA GLY 115 -10.554 7.232 6.572 875 H GLY 116 H GLY 116 -8.497 7.764 6.803 876 1HA GLY 116 1HA GLY 116 -6.577 9.044 6.839 877 2HA GLY 116 2HA GLY 116 -7.562 10.449 6.461 878 HA PRO 117 HA PRO 117 -4.973 9.769 2.711 879 1HB PRO 117 1HB PRO 117 -3.421 7.526 2.557 880 2HB PRO 117 2HB PRO 117 -2.937 8.991 3.420 881 1HG PRO 117 1HG PRO 117 -4.127 6.462 4.501 882 2HG PRO 117 2HG PRO 117 -2.791 7.434 5.145 883 1HD PRO 117 1HD PRO 117 -5.278 7.579 6.164 884 2HD PRO 117 2HD PRO 117 -4.212 9.007 6.074 885 H ILE 118 H ILE 118 -6.257 6.640 3.743 886 HA ILE 118 HA ILE 118 -6.931 5.922 1.001 887 HB ILE 118 HB ILE 118 -7.318 4.393 3.582 888 1HG1 ILE 118 1HG1 ILE 118 -5.387 3.918 1.306 889 2HG1 ILE 118 2HG1 ILE 118 -4.963 4.703 2.823 890 1HG2 ILE 118 1HG2 ILE 118 -7.836 3.563 0.732 891 2HG2 ILE 118 2HG2 ILE 118 -7.835 2.471 2.117 892 3HG2 ILE 118 3HG2 ILE 118 -9.034 3.762 2.012 893 1HD1 ILE 118 1HD1 ILE 118 -5.619 2.630 4.013 894 2HD1 ILE 118 2HD1 ILE 118 -5.861 1.860 2.444 895 3HD1 ILE 118 3HD1 ILE 118 -4.257 2.427 2.911 896 H GLY 119 H GLY 119 -8.963 5.968 0.159 897 1HA GLY 119 1HA GLY 119 -11.243 6.298 0.022 898 2HA GLY 119 2HA GLY 119 -10.906 7.671 1.068 899 HA PRO 120 HA PRO 120 -12.867 5.945 4.622 900 1HB PRO 120 1HB PRO 120 -15.520 6.499 4.013 901 2HB PRO 120 2HB PRO 120 -14.397 7.620 4.785 902 1HG PRO 120 1HG PRO 120 -15.215 7.427 1.921 903 2HG PRO 120 2HG PRO 120 -14.912 8.869 2.908 904 1HD PRO 120 1HD PRO 120 -13.114 7.999 1.122 905 2HD PRO 120 2HD PRO 120 -12.606 8.692 2.677 906 H ASN 121 H ASN 121 -13.322 3.910 5.090 907 HA ASN 121 HA ASN 121 -13.707 1.676 4.742 908 1HB ASN 121 1HB ASN 121 -16.326 2.575 3.566 909 2HB ASN 121 2HB ASN 121 -16.007 1.215 4.645 910 1HD2 ASN 121 1HD2 ASN 121 -17.937 3.388 4.923 911 2HD2 ASN 121 2HD2 ASN 121 -17.556 4.184 6.415 912 H GLU 122 H GLU 122 -12.323 2.910 2.566 913 HA GLU 122 HA GLU 122 -13.349 1.351 0.289 914 1HB GLU 122 1HB GLU 122 -13.334 3.835 -0.011 915 2HB GLU 122 2HB GLU 122 -11.586 3.797 0.159 916 1HG GLU 122 1HG GLU 122 -11.278 2.732 -1.868 917 2HG GLU 122 2HG GLU 122 -12.930 2.116 -1.911 918 H THR 123 H THR 123 -11.903 0.117 -0.924 919 HA THR 123 HA THR 123 -9.424 -0.545 0.486 920 HB THR 123 HB THR 123 -10.792 -2.008 -1.785 921 HG1 THR 123 HG1 THR 123 -10.897 -3.556 0.191 922 1HG2 THR 123 1HG2 THR 123 -8.395 -2.745 -0.100 923 2HG2 THR 123 2HG2 THR 123 -9.217 -3.837 -1.215 924 3HG2 THR 123 3HG2 THR 123 -8.400 -2.399 -1.830 925 H LEU 124 H LEU 124 -7.444 -0.146 -0.359 926 HA LEU 124 HA LEU 124 -7.388 1.117 -3.026 927 1HB LEU 124 1HB LEU 124 -6.709 2.200 -0.538 928 2HB LEU 124 2HB LEU 124 -5.180 1.872 -1.332 929 HG LEU 124 HG LEU 124 -7.127 3.192 -3.069 930 1HD1 LEU 124 1HD1 LEU 124 -7.749 4.210 -0.927 931 2HD1 LEU 124 2HD1 LEU 124 -6.064 4.657 -0.658 932 3HD1 LEU 124 3HD1 LEU 124 -6.961 5.365 -2.001 933 1HD2 LEU 124 1HD2 LEU 124 -4.660 2.788 -3.462 934 2HD2 LEU 124 2HD2 LEU 124 -5.234 4.433 -3.742 935 3HD2 LEU 124 3HD2 LEU 124 -4.361 4.044 -2.262 936 H ILE 125 H ILE 125 -5.485 0.895 -4.249 937 HA ILE 125 HA ILE 125 -3.854 -1.469 -3.614 938 HB ILE 125 HB ILE 125 -4.331 -0.257 -6.341 939 1HG1 ILE 125 1HG1 ILE 125 -5.632 -2.562 -6.524 940 2HG1 ILE 125 2HG1 ILE 125 -5.824 -2.313 -4.790 941 1HG2 ILE 125 1HG2 ILE 125 -2.248 -1.523 -6.108 942 2HG2 ILE 125 2HG2 ILE 125 -3.162 -2.916 -5.524 943 3HG2 ILE 125 3HG2 ILE 125 -3.389 -2.342 -7.179 944 1HD1 ILE 125 1HD1 ILE 125 -6.859 -0.139 -5.227 945 2HD1 ILE 125 2HD1 ILE 125 -6.694 -0.419 -6.960 946 3HD1 ILE 125 3HD1 ILE 125 -7.738 -1.461 -5.994 947 H PHE 126 H PHE 126 -1.601 -1.340 -3.978 948 HA PHE 126 HA PHE 126 -0.536 1.316 -4.597 949 1HB PHE 126 1HB PHE 126 0.200 -0.285 -2.141 950 2HB PHE 126 2HB PHE 126 0.999 1.194 -2.661 951 HD1 PHE 126 HD1 PHE 126 -1.588 -0.184 -0.688 952 HD2 PHE 126 HD2 PHE 126 -0.498 3.292 -2.887 953 HE1 PHE 126 HE1 PHE 126 -3.212 1.138 0.605 954 HE2 PHE 126 HE2 PHE 126 -2.113 4.619 -1.595 955 HZ PHE 126 HZ PHE 126 -3.475 3.544 0.154 956 H LYS 127 H LYS 127 1.201 1.283 -5.841 957 HA LYS 127 HA LYS 127 2.584 -1.287 -6.265 958 1HB LYS 127 1HB LYS 127 1.321 0.006 -8.181 959 2HB LYS 127 2HB LYS 127 2.751 1.026 -8.174 960 1HG LYS 127 1HG LYS 127 2.778 -1.959 -8.573 961 2HG LYS 127 2HG LYS 127 2.818 -0.766 -9.872 962 1HD LYS 127 1HD LYS 127 4.906 0.161 -8.853 963 2HD LYS 127 2HD LYS 127 4.887 -1.204 -7.719 964 1HE LYS 127 1HE LYS 127 6.365 -1.746 -9.526 965 2HE LYS 127 2HE LYS 127 4.917 -2.741 -9.677 966 1HZ LYS 127 1HZ LYS 127 4.086 -1.146 -11.333 967 2HZ LYS 127 2HZ LYS 127 5.540 -0.288 -11.231 968 3HZ LYS 127 3HZ LYS 127 5.532 -1.877 -11.814 969 H ILE 128 H ILE 128 4.334 -1.255 -4.956 970 HA ILE 128 HA ILE 128 5.803 1.266 -4.662 971 HB ILE 128 HB ILE 128 6.029 -1.256 -3.020 972 1HG1 ILE 128 1HG1 ILE 128 5.051 0.373 -1.246 973 2HG1 ILE 128 2HG1 ILE 128 4.527 1.328 -2.635 974 1HG2 ILE 128 1HG2 ILE 128 7.282 1.460 -2.671 975 2HG2 ILE 128 2HG2 ILE 128 7.323 0.167 -1.474 976 3HG2 ILE 128 3HG2 ILE 128 8.113 -0.052 -3.035 977 1HD1 ILE 128 1HD1 ILE 128 3.803 -1.550 -2.166 978 2HD1 ILE 128 2HD1 ILE 128 2.788 -0.170 -1.747 979 3HD1 ILE 128 3HD1 ILE 128 3.185 -0.491 -3.434 980 H HIS 129 H HIS 129 7.664 1.580 -5.568 981 HA HIS 129 HA HIS 129 9.233 -0.742 -6.464 982 1HB HIS 129 1HB HIS 129 8.179 1.226 -8.074 983 2HB HIS 129 2HB HIS 129 9.808 1.825 -7.776 984 HD1 HIS 129 HD1 HIS 129 8.451 0.454 -10.453 985 HD2 HIS 129 HD2 HIS 129 11.344 -1.099 -7.910 986 HE1 HIS 129 HE1 HIS 129 9.654 -1.297 -11.797 987 HE2 HIS 129 HE2 HIS 129 11.233 -2.376 -10.155 988 H LEU 130 H LEU 130 10.637 -0.965 -4.809 989 HA LEU 130 HA LEU 130 11.739 1.298 -3.433 990 1HB LEU 130 1HB LEU 130 11.328 -1.302 -2.754 991 2HB LEU 130 2HB LEU 130 13.040 -1.329 -3.116 992 HG LEU 130 HG LEU 130 13.011 -0.946 -0.834 993 1HD1 LEU 130 1HD1 LEU 130 14.376 0.745 -1.984 994 2HD1 LEU 130 2HD1 LEU 130 13.000 1.847 -1.965 995 3HD1 LEU 130 3HD1 LEU 130 13.733 1.324 -0.448 996 1HD2 LEU 130 1HD2 LEU 130 10.667 0.885 -1.298 997 2HD2 LEU 130 2HD2 LEU 130 10.659 -0.690 -0.503 998 3HD2 LEU 130 3HD2 LEU 130 11.475 0.679 0.258 999 H ILE 131 H ILE 131 13.403 2.469 -4.063 1000 HA ILE 131 HA ILE 131 15.201 1.424 -6.117 1001 HB ILE 131 HB ILE 131 14.944 4.218 -4.995 1002 1HG1 ILE 131 1HG1 ILE 131 12.972 3.525 -6.284 1003 2HG1 ILE 131 2HG1 ILE 131 13.902 4.765 -7.158 1004 1HG2 ILE 131 1HG2 ILE 131 16.589 3.174 -7.296 1005 2HG2 ILE 131 2HG2 ILE 131 16.345 4.879 -6.920 1006 3HG2 ILE 131 3HG2 ILE 131 17.194 3.836 -5.778 1007 1HD1 ILE 131 1HD1 ILE 131 14.880 3.014 -8.561 1008 2HD1 ILE 131 2HD1 ILE 131 13.939 1.796 -7.700 1009 3HD1 ILE 131 3HD1 ILE 131 13.118 3.026 -8.661 1010 H SER 132 H SER 132 15.489 3.195 -3.029 1011 HA SER 132 HA SER 132 17.615 1.494 -2.157 1012 1HB SER 132 1HB SER 132 19.392 3.128 -2.099 1013 2HB SER 132 2HB SER 132 18.811 2.976 -3.754 1014 HG SER 132 HG SER 132 17.385 4.851 -3.047 1015 H VAL 133 H VAL 133 18.508 2.198 -0.038 1016 HA VAL 133 HA VAL 133 16.435 3.593 1.526 1017 HB VAL 133 HB VAL 133 16.775 1.282 2.213 1018 1HG1 VAL 133 1HG1 VAL 133 19.085 1.018 1.443 1019 2HG1 VAL 133 2HG1 VAL 133 19.636 2.077 2.741 1020 3HG1 VAL 133 3HG1 VAL 133 18.904 0.522 3.125 1021 1HG2 VAL 133 1HG2 VAL 133 16.252 3.039 3.888 1022 2HG2 VAL 133 2HG2 VAL 133 17.115 1.660 4.563 1023 3HG2 VAL 133 3HG2 VAL 133 17.975 3.166 4.240 1024 H LYS 134 H LYS 134 16.914 5.473 2.458 1025 HA LYS 134 HA LYS 134 18.108 7.374 2.938 1026 1HB LYS 134 1HB LYS 134 18.736 5.359 4.674 1027 2HB LYS 134 2HB LYS 134 20.329 5.865 4.128 1028 1HG LYS 134 1HG LYS 134 19.651 8.225 4.708 1029 2HG LYS 134 2HG LYS 134 18.221 7.513 5.499 1030 1HD LYS 134 1HD LYS 134 19.668 6.221 6.970 1031 2HD LYS 134 2HD LYS 134 21.099 6.861 6.159 1032 1HE LYS 134 1HE LYS 134 20.747 8.067 8.219 1033 2HE LYS 134 2HE LYS 134 20.427 9.138 6.855 1034 1HZ LYS 134 1HZ LYS 134 18.045 8.693 7.154 1035 2HZ LYS 134 2HZ LYS 134 18.393 7.752 8.518 1036 3HZ LYS 134 3HZ LYS 134 18.737 9.408 8.523 1037 H LYS 135 H LYS 135 21.032 7.403 3.339 1038 HA LYS 135 HA LYS 135 21.792 8.214 0.755 1039 1HB LYS 135 1HB LYS 135 23.607 7.523 3.070 1040 2HB LYS 135 2HB LYS 135 24.019 8.518 1.681 1041 1HG LYS 135 1HG LYS 135 21.940 9.187 3.754 1042 2HG LYS 135 2HG LYS 135 23.571 9.857 3.674 1043 1HD LYS 135 1HD LYS 135 23.067 10.822 1.484 1044 2HD LYS 135 2HD LYS 135 21.439 10.145 1.556 1045 1HE LYS 135 1HE LYS 135 21.413 12.497 2.177 1046 2HE LYS 135 2HE LYS 135 20.979 11.487 3.557 1047 1HZ LYS 135 1HZ LYS 135 23.667 12.654 3.066 1048 2HZ LYS 135 2HZ LYS 135 22.529 13.249 4.167 1049 3HZ LYS 135 3HZ LYS 135 23.220 11.723 4.405 1050 H SER 136 H SER 136 21.386 5.159 1.940 1051 HA SER 136 HA SER 136 21.863 3.081 1.154 1052 1HB SER 136 1HB SER 136 21.377 4.059 -1.064 1053 2HB SER 136 2HB SER 136 23.068 4.538 -1.213 1054 HG SER 136 HG SER 136 23.648 2.484 -1.490 1055 H SER 137 H SER 137 23.308 2.836 2.923 1056 HA SER 137 HA SER 137 25.295 2.447 3.965 1057 1HB SER 137 1HB SER 137 26.880 1.069 2.670 1058 2HB SER 137 2HB SER 137 25.216 0.530 2.449 1059 HG SER 137 HG SER 137 25.188 1.468 0.441 No H/Q in entry = 1059 Start of MODEL 9 1 H1 PHE 1 H1 PHE 1 -21.894 10.754 2.129 2 H2 PHE 1 H2 PHE 1 -23.212 11.769 2.436 3 H3 PHE 1 H3 PHE 1 -22.687 10.682 3.621 4 HA PHE 1 HA PHE 1 -24.682 9.869 2.583 5 1HB PHE 1 1HB PHE 1 -23.032 9.962 0.046 6 2HB PHE 1 2HB PHE 1 -24.634 9.245 0.189 7 HD1 PHE 1 HD1 PHE 1 -22.738 12.385 0.153 8 HD2 PHE 1 HD2 PHE 1 -26.601 10.604 0.276 9 HE1 PHE 1 HE1 PHE 1 -23.756 14.564 -0.363 10 HE2 PHE 1 HE2 PHE 1 -27.625 12.780 -0.242 11 HZ PHE 1 HZ PHE 1 -26.202 14.764 -0.562 12 H ASN 2 H ASN 2 -24.413 8.101 3.831 13 HA ASN 2 HA ASN 2 -22.183 6.377 3.752 14 1HB ASN 2 1HB ASN 2 -23.656 4.808 5.049 15 2HB ASN 2 2HB ASN 2 -23.547 6.437 5.728 16 1HD2 ASN 2 1HD2 ASN 2 -25.476 6.222 6.831 17 2HD2 ASN 2 2HD2 ASN 2 -27.008 6.237 6.034 18 H LYS 3 H LYS 3 -24.913 6.637 1.700 19 HA LYS 3 HA LYS 3 -25.212 4.015 0.797 20 1HB LYS 3 1HB LYS 3 -26.736 5.820 0.149 21 2HB LYS 3 2HB LYS 3 -25.450 6.600 -0.762 22 1HG LYS 3 1HG LYS 3 -25.367 4.680 -2.279 23 2HG LYS 3 2HG LYS 3 -26.672 3.914 -1.370 24 1HD LYS 3 1HD LYS 3 -28.161 5.760 -1.924 25 2HD LYS 3 2HD LYS 3 -26.856 6.572 -2.789 26 1HE LYS 3 1HE LYS 3 -26.739 4.697 -4.361 27 2HE LYS 3 2HE LYS 3 -28.047 3.891 -3.496 28 1HZ LYS 3 1HZ LYS 3 -28.251 6.514 -4.875 29 2HZ LYS 3 2HZ LYS 3 -28.851 5.046 -5.462 30 3HZ LYS 3 3HZ LYS 3 -29.507 5.727 -4.059 31 H LYS 4 H LYS 4 -22.941 6.541 -0.134 32 HA LYS 4 HA LYS 4 -21.659 4.918 -2.135 33 1HB LYS 4 1HB LYS 4 -20.868 7.564 -0.904 34 2HB LYS 4 2HB LYS 4 -20.030 6.796 -2.245 35 1HG LYS 4 1HG LYS 4 -22.063 6.941 -3.597 36 2HG LYS 4 2HG LYS 4 -22.897 7.719 -2.251 37 1HD LYS 4 1HD LYS 4 -22.185 9.413 -3.796 38 2HD LYS 4 2HD LYS 4 -21.207 9.541 -2.333 39 1HE LYS 4 1HE LYS 4 -19.825 9.776 -4.330 40 2HE LYS 4 2HE LYS 4 -19.395 8.320 -3.434 41 1HZ LYS 4 1HZ LYS 4 -20.708 7.019 -4.991 42 2HZ LYS 4 2HZ LYS 4 -21.118 8.417 -5.851 43 3HZ LYS 4 3HZ LYS 4 -19.510 7.893 -5.804 44 H ALA 5 H ALA 5 -21.075 5.849 1.207 45 HA ALA 5 HA ALA 5 -18.459 4.951 1.499 46 1HB ALA 5 1HB ALA 5 -19.831 6.243 3.179 47 2HB ALA 5 2HB ALA 5 -20.566 4.704 3.631 48 3HB ALA 5 3HB ALA 5 -18.830 4.947 3.837 49 H ASP 6 H ASP 6 -21.495 3.203 2.101 50 HA ASP 6 HA ASP 6 -20.249 0.714 2.621 51 1HB ASP 6 1HB ASP 6 -22.551 1.282 3.367 52 2HB ASP 6 2HB ASP 6 -23.082 1.242 1.688 53 H GLU 7 H GLU 7 -21.413 2.292 -0.293 54 HA GLU 7 HA GLU 7 -21.403 0.129 -2.047 55 1HB GLU 7 1HB GLU 7 -22.197 2.382 -2.665 56 2HB GLU 7 2HB GLU 7 -20.545 2.979 -2.606 57 1HG GLU 7 1HG GLU 7 -19.950 1.441 -4.434 58 2HG GLU 7 2HG GLU 7 -21.633 0.924 -4.517 59 H ASN 8 H ASN 8 -18.806 2.027 -0.699 60 HA ASN 8 HA ASN 8 -16.748 0.932 -2.352 61 1HB ASN 8 1HB ASN 8 -16.339 2.204 0.355 62 2HB ASN 8 2HB ASN 8 -15.217 2.164 -1.031 63 1HD2 ASN 8 1HD2 ASN 8 -16.370 4.377 0.575 64 2HD2 ASN 8 2HD2 ASN 8 -17.080 5.447 -0.578 65 H LYS 9 H LYS 9 -18.051 0.281 0.846 66 HA LYS 9 HA LYS 9 -16.167 -1.521 1.793 67 1HB LYS 9 1HB LYS 9 -18.125 -0.559 3.051 68 2HB LYS 9 2HB LYS 9 -19.151 -1.722 2.226 69 1HG LYS 9 1HG LYS 9 -17.942 -3.559 3.238 70 2HG LYS 9 2HG LYS 9 -16.834 -2.426 4.015 71 1HD LYS 9 1HD LYS 9 -18.704 -1.463 5.272 72 2HD LYS 9 2HD LYS 9 -19.809 -2.600 4.496 73 1HE LYS 9 1HE LYS 9 -18.600 -4.468 5.499 74 2HE LYS 9 2HE LYS 9 -17.473 -3.342 6.254 75 1HZ LYS 9 1HZ LYS 9 -20.392 -3.465 6.787 76 2HZ LYS 9 2HZ LYS 9 -19.184 -4.080 7.799 77 3HZ LYS 9 3HZ LYS 9 -19.294 -2.413 7.528 78 H VAL 10 H VAL 10 -18.897 -2.086 -0.394 79 HA VAL 10 HA VAL 10 -18.534 -4.936 -0.385 80 HB VAL 10 HB VAL 10 -20.199 -4.932 -2.244 81 1HG1 VAL 10 1HG1 VAL 10 -20.934 -3.423 0.265 82 2HG1 VAL 10 2HG1 VAL 10 -22.085 -4.206 -0.836 83 3HG1 VAL 10 3HG1 VAL 10 -20.905 -5.186 0.060 84 1HG2 VAL 10 1HG2 VAL 10 -20.203 -1.958 -1.749 85 2HG2 VAL 10 2HG2 VAL 10 -19.706 -2.775 -3.231 86 3HG2 VAL 10 3HG2 VAL 10 -21.391 -2.831 -2.715 87 H LYS 11 H LYS 11 -17.914 -2.378 -2.830 88 HA LYS 11 HA LYS 11 -16.843 -4.200 -4.718 89 1HB LYS 11 1HB LYS 11 -15.976 -2.219 -5.893 90 2HB LYS 11 2HB LYS 11 -17.669 -2.053 -5.458 91 1HG LYS 11 1HG LYS 11 -17.022 -0.644 -3.553 92 2HG LYS 11 2HG LYS 11 -15.332 -0.789 -4.043 93 1HD LYS 11 1HD LYS 11 -15.841 0.267 -6.178 94 2HD LYS 11 2HD LYS 11 -17.547 0.369 -5.738 95 1HE LYS 11 1HE LYS 11 -17.017 1.875 -3.917 96 2HE LYS 11 2HE LYS 11 -15.294 1.715 -4.251 97 1HZ LYS 11 1HZ LYS 11 -17.302 2.870 -6.112 98 2HZ LYS 11 2HZ LYS 11 -16.213 3.760 -5.171 99 3HZ LYS 11 3HZ LYS 11 -15.640 2.746 -6.399 100 H GLY 12 H GLY 12 -15.473 -2.613 -1.968 101 1HA GLY 12 1HA GLY 12 -13.309 -2.487 -1.170 102 2HA GLY 12 2HA GLY 12 -12.737 -2.923 -2.774 103 H GLU 13 H GLU 13 -14.760 -4.543 -0.326 104 HA GLU 13 HA GLU 13 -12.862 -6.486 0.388 105 1HB GLU 13 1HB GLU 13 -14.807 -5.984 1.775 106 2HB GLU 13 2HB GLU 13 -15.881 -6.586 0.521 107 1HG GLU 13 1HG GLU 13 -15.664 -8.221 2.269 108 2HG GLU 13 2HG GLU 13 -14.919 -8.826 0.791 109 H ALA 14 H ALA 14 -15.085 -6.264 -2.261 110 HA ALA 14 HA ALA 14 -14.936 -9.045 -2.994 111 1HB ALA 14 1HB ALA 14 -16.923 -7.737 -3.528 112 2HB ALA 14 2HB ALA 14 -16.172 -8.361 -4.996 113 3HB ALA 14 3HB ALA 14 -15.959 -6.669 -4.549 114 H PHE 15 H PHE 15 -13.364 -6.046 -3.942 115 HA PHE 15 HA PHE 15 -12.048 -6.964 -6.235 116 1HB PHE 15 1HB PHE 15 -11.853 -4.688 -6.085 117 2HB PHE 15 2HB PHE 15 -11.668 -4.717 -4.319 118 HD1 PHE 15 HD1 PHE 15 -9.631 -4.184 -3.454 119 HD2 PHE 15 HD2 PHE 15 -9.806 -5.764 -7.398 120 HE1 PHE 15 HE1 PHE 15 -7.201 -3.846 -3.689 121 HE2 PHE 15 HE2 PHE 15 -7.376 -5.448 -7.638 122 HZ PHE 15 HZ PHE 15 -6.070 -4.489 -5.778 123 H LEU 16 H LEU 16 -10.848 -6.762 -2.873 124 HA LEU 16 HA LEU 16 -8.409 -8.070 -3.474 125 1HB LEU 16 1HB LEU 16 -8.479 -8.525 -0.898 126 2HB LEU 16 2HB LEU 16 -8.171 -6.927 -1.547 127 HG LEU 16 HG LEU 16 -10.820 -6.732 -1.287 128 1HD1 LEU 16 1HD1 LEU 16 -11.077 -9.034 -0.488 129 2HD1 LEU 16 2HD1 LEU 16 -10.019 -8.675 0.876 130 3HD1 LEU 16 3HD1 LEU 16 -11.576 -7.861 0.730 131 1HD2 LEU 16 1HD2 LEU 16 -9.085 -5.287 -0.272 132 2HD2 LEU 16 2HD2 LEU 16 -10.447 -5.594 0.804 133 3HD2 LEU 16 3HD2 LEU 16 -8.924 -6.451 1.041 134 H THR 17 H THR 17 -11.573 -9.253 -2.490 135 HA THR 17 HA THR 17 -10.867 -11.859 -1.779 136 HB THR 17 HB THR 17 -13.392 -10.811 -3.078 137 HG1 THR 17 HG1 THR 17 -14.115 -11.352 -0.835 138 1HG2 THR 17 1HG2 THR 17 -12.839 -13.568 -1.957 139 2HG2 THR 17 2HG2 THR 17 -14.443 -12.947 -2.393 140 3HG2 THR 17 3HG2 THR 17 -13.205 -13.168 -3.646 141 H GLU 18 H GLU 18 -11.673 -10.483 -4.944 142 HA GLU 18 HA GLU 18 -11.194 -12.922 -6.365 143 1HB GLU 18 1HB GLU 18 -11.424 -10.065 -7.330 144 2HB GLU 18 2HB GLU 18 -11.311 -11.464 -8.388 145 1HG GLU 18 1HG GLU 18 -13.396 -12.335 -7.453 146 2HG GLU 18 2HG GLU 18 -13.512 -10.918 -6.409 147 H ASN 19 H ASN 19 -9.340 -10.130 -5.435 148 HA ASN 19 HA ASN 19 -7.145 -10.347 -7.134 149 1HB ASN 19 1HB ASN 19 -7.055 -8.392 -5.938 150 2HB ASN 19 2HB ASN 19 -7.630 -9.144 -4.450 151 1HD2 ASN 19 1HD2 ASN 19 -6.167 -10.384 -3.215 152 2HD2 ASN 19 2HD2 ASN 19 -4.467 -10.108 -3.311 153 H LYS 20 H LYS 20 -8.044 -12.245 -4.382 154 HA LYS 20 HA LYS 20 -5.683 -13.299 -3.480 155 1HB LYS 20 1HB LYS 20 -8.334 -14.683 -3.877 156 2HB LYS 20 2HB LYS 20 -7.006 -15.344 -2.933 157 1HG LYS 20 1HG LYS 20 -7.160 -13.599 -1.331 158 2HG LYS 20 2HG LYS 20 -8.269 -12.679 -2.347 159 1HD LYS 20 1HD LYS 20 -9.420 -13.821 -0.490 160 2HD LYS 20 2HD LYS 20 -9.980 -14.374 -2.069 161 1HE LYS 20 1HE LYS 20 -9.702 -16.282 -0.629 162 2HE LYS 20 2HE LYS 20 -8.456 -16.315 -1.878 163 1HZ LYS 20 1HZ LYS 20 -6.892 -15.382 -0.278 164 2HZ LYS 20 2HZ LYS 20 -8.087 -15.384 0.919 165 3HZ LYS 20 3HZ LYS 20 -7.530 -16.846 0.279 166 H ASN 21 H ASN 21 -7.052 -13.695 -6.583 167 HA ASN 21 HA ASN 21 -6.000 -16.235 -7.241 168 1HB ASN 21 1HB ASN 21 -6.882 -13.928 -8.974 169 2HB ASN 21 2HB ASN 21 -6.437 -15.515 -9.599 170 1HD2 ASN 21 1HD2 ASN 21 -8.122 -14.912 -6.582 171 2HD2 ASN 21 2HD2 ASN 21 -9.602 -15.662 -7.052 172 H LYS 22 H LYS 22 -4.662 -12.987 -7.389 173 HA LYS 22 HA LYS 22 -2.558 -13.342 -9.146 174 1HB LYS 22 1HB LYS 22 -2.343 -11.788 -6.570 175 2HB LYS 22 2HB LYS 22 -1.461 -11.507 -8.061 176 1HG LYS 22 1HG LYS 22 -4.279 -10.829 -7.371 177 2HG LYS 22 2HG LYS 22 -3.030 -9.832 -8.109 178 1HD LYS 22 1HD LYS 22 -3.217 -11.308 -10.146 179 2HD LYS 22 2HD LYS 22 -4.645 -12.026 -9.390 180 1HE LYS 22 1HE LYS 22 -4.263 -9.126 -10.128 181 2HE LYS 22 2HE LYS 22 -5.311 -10.289 -10.941 182 1HZ LYS 22 1HZ LYS 22 -6.612 -10.477 -8.911 183 2HZ LYS 22 2HZ LYS 22 -5.609 -9.356 -8.136 184 3HZ LYS 22 3HZ LYS 22 -6.565 -8.872 -9.444 185 HA PRO 23 HA PRO 23 -0.303 -16.652 -7.096 186 1HB PRO 23 1HB PRO 23 1.831 -15.807 -8.978 187 2HB PRO 23 2HB PRO 23 1.127 -17.409 -8.717 188 1HG PRO 23 1HG PRO 23 0.539 -15.991 -10.899 189 2HG PRO 23 2HG PRO 23 -0.690 -16.979 -10.087 190 1HD PRO 23 1HD PRO 23 -0.279 -14.017 -10.010 191 2HD PRO 23 2HD PRO 23 -1.793 -14.946 -10.064 192 H GLY 24 H GLY 24 1.194 -16.722 -5.473 193 1HA GLY 24 1HA GLY 24 3.139 -14.583 -5.183 194 2HA GLY 24 2HA GLY 24 3.034 -16.036 -4.206 195 H VAL 25 H VAL 25 -0.038 -14.894 -4.243 196 HA VAL 25 HA VAL 25 0.028 -12.661 -2.548 197 HB VAL 25 HB VAL 25 -2.062 -14.751 -3.076 198 1HG1 VAL 25 1HG1 VAL 25 -2.223 -12.548 -1.021 199 2HG1 VAL 25 2HG1 VAL 25 -3.623 -13.411 -1.661 200 3HG1 VAL 25 3HG1 VAL 25 -2.392 -14.284 -0.746 201 1HG2 VAL 25 1HG2 VAL 25 -1.517 -12.814 -4.634 202 2HG2 VAL 25 2HG2 VAL 25 -3.209 -13.006 -4.166 203 3HG2 VAL 25 3HG2 VAL 25 -2.216 -11.768 -3.396 204 H VAL 26 H VAL 26 0.710 -12.456 -0.530 205 HA VAL 26 HA VAL 26 0.564 -14.788 1.259 206 HB VAL 26 HB VAL 26 2.876 -14.553 0.519 207 1HG1 VAL 26 1HG1 VAL 26 2.587 -12.047 0.083 208 2HG1 VAL 26 2HG1 VAL 26 2.980 -11.841 1.792 209 3HG1 VAL 26 3HG1 VAL 26 4.144 -12.603 0.705 210 1HG2 VAL 26 1HG2 VAL 26 2.365 -15.239 2.856 211 2HG2 VAL 26 2HG2 VAL 26 3.949 -14.476 2.666 212 3HG2 VAL 26 3HG2 VAL 26 2.602 -13.559 3.353 213 H VAL 27 H VAL 27 -0.256 -14.391 3.225 214 HA VAL 27 HA VAL 27 -1.082 -11.665 3.834 215 HB VAL 27 HB VAL 27 -2.771 -13.418 4.031 216 1HG1 VAL 27 1HG1 VAL 27 -1.319 -15.292 4.578 217 2HG1 VAL 27 2HG1 VAL 27 -0.981 -14.587 6.159 218 3HG1 VAL 27 3HG1 VAL 27 -2.611 -15.136 5.769 219 1HG2 VAL 27 1HG2 VAL 27 -1.957 -12.248 6.690 220 2HG2 VAL 27 2HG2 VAL 27 -2.985 -11.486 5.477 221 3HG2 VAL 27 3HG2 VAL 27 -3.540 -12.931 6.320 222 H LEU 28 H LEU 28 -0.337 -10.477 5.520 223 HA LEU 28 HA LEU 28 1.958 -11.572 6.972 224 1HB LEU 28 1HB LEU 28 1.072 -8.708 6.630 225 2HB LEU 28 2HB LEU 28 2.517 -9.225 7.475 226 HG LEU 28 HG LEU 28 1.958 -9.374 4.518 227 1HD1 LEU 28 1HD1 LEU 28 4.067 -8.002 6.181 228 2HD1 LEU 28 2HD1 LEU 28 4.058 -8.059 4.420 229 3HD1 LEU 28 3HD1 LEU 28 2.760 -7.234 5.281 230 1HD2 LEU 28 1HD2 LEU 28 4.239 -10.613 6.061 231 2HD2 LEU 28 2HD2 LEU 28 2.998 -11.472 5.146 232 3HD2 LEU 28 3HD2 LEU 28 4.167 -10.453 4.305 233 HA PRO 29 HA PRO 29 0.105 -11.718 10.966 234 1HB PRO 29 1HB PRO 29 2.020 -9.632 11.903 235 2HB PRO 29 2HB PRO 29 1.669 -11.226 12.583 236 1HG PRO 29 1HG PRO 29 3.909 -10.807 11.211 237 2HG PRO 29 2HG PRO 29 3.009 -12.326 11.038 238 1HD PRO 29 1HD PRO 29 3.159 -9.985 9.189 239 2HD PRO 29 2HD PRO 29 3.057 -11.725 8.813 240 H SER 30 H SER 30 0.770 -8.515 9.657 241 HA SER 30 HA SER 30 -1.193 -7.243 11.359 242 1HB SER 30 1HB SER 30 0.743 -5.935 10.817 243 2HB SER 30 2HB SER 30 0.505 -6.195 9.089 244 HG SER 30 HG SER 30 -0.279 -4.165 9.671 245 H GLY 31 H GLY 31 -1.309 -8.987 8.467 246 1HA GLY 31 1HA GLY 31 -4.007 -7.923 7.978 247 2HA GLY 31 2HA GLY 31 -3.459 -9.531 7.530 248 H LEU 32 H LEU 32 -0.885 -8.047 6.606 249 HA LEU 32 HA LEU 32 -1.807 -6.523 4.331 250 1HB LEU 32 1HB LEU 32 0.880 -7.352 5.379 251 2HB LEU 32 2HB LEU 32 0.719 -6.628 3.792 252 HG LEU 32 HG LEU 32 1.346 -5.068 5.678 253 1HD1 LEU 32 1HD1 LEU 32 -1.129 -4.507 4.054 254 2HD1 LEU 32 2HD1 LEU 32 -0.171 -3.284 4.890 255 3HD1 LEU 32 3HD1 LEU 32 0.543 -4.216 3.574 256 1HD2 LEU 32 1HD2 LEU 32 -0.328 -6.130 7.261 257 2HD2 LEU 32 2HD2 LEU 32 -0.275 -4.370 7.227 258 3HD2 LEU 32 3HD2 LEU 32 -1.567 -5.224 6.391 259 H GLN 33 H GLN 33 -2.034 -7.179 2.321 260 HA GLN 33 HA GLN 33 -1.032 -9.830 1.530 261 1HB GLN 33 1HB GLN 33 -3.659 -8.550 0.756 262 2HB GLN 33 2HB GLN 33 -3.046 -10.060 0.104 263 1HG GLN 33 1HG GLN 33 -3.066 -11.008 2.399 264 2HG GLN 33 2HG GLN 33 -3.844 -9.500 2.957 265 1HE2 GLN 33 1HE2 GLN 33 -4.483 -10.989 -0.144 266 2HE2 GLN 33 2HE2 GLN 33 -6.105 -11.473 0.204 267 H TYR 34 H TYR 34 -0.031 -9.919 -0.466 268 HA TYR 34 HA TYR 34 -0.290 -7.756 -2.346 269 1HB TYR 34 1HB TYR 34 2.137 -7.147 -2.265 270 2HB TYR 34 2HB TYR 34 1.209 -6.651 -0.855 271 HD1 TYR 34 HD1 TYR 34 3.827 -8.898 -2.094 272 HD2 TYR 34 HD2 TYR 34 1.581 -7.686 1.309 273 HE1 TYR 34 HE1 TYR 34 5.425 -10.047 -0.634 274 HE2 TYR 34 HE2 TYR 34 3.173 -8.828 2.774 275 HH TYR 34 HH TYR 34 4.818 -10.665 2.637 276 H LYS 35 H LYS 35 1.410 -7.959 -4.124 277 HA LYS 35 HA LYS 35 1.977 -10.814 -4.632 278 1HB LYS 35 1HB LYS 35 0.151 -9.582 -6.037 279 2HB LYS 35 2HB LYS 35 1.519 -8.825 -6.839 280 1HG LYS 35 1HG LYS 35 1.288 -11.806 -6.593 281 2HG LYS 35 2HG LYS 35 0.513 -10.914 -7.907 282 1HD LYS 35 1HD LYS 35 3.460 -10.792 -7.268 283 2HD LYS 35 2HD LYS 35 2.749 -11.846 -8.490 284 1HE LYS 35 1HE LYS 35 1.868 -9.870 -9.660 285 2HE LYS 35 2HE LYS 35 2.618 -8.830 -8.450 286 1HZ LYS 35 1HZ LYS 35 4.068 -10.678 -10.271 287 2HZ LYS 35 2HZ LYS 35 3.969 -8.999 -10.449 288 3HZ LYS 35 3HZ LYS 35 4.780 -9.661 -9.122 289 H VAL 36 H VAL 36 4.062 -11.216 -4.663 290 HA VAL 36 HA VAL 36 6.024 -9.160 -4.670 291 HB VAL 36 HB VAL 36 6.342 -12.154 -4.838 292 1HG1 VAL 36 1HG1 VAL 36 8.349 -9.952 -4.426 293 2HG1 VAL 36 2HG1 VAL 36 8.654 -11.623 -3.955 294 3HG1 VAL 36 3HG1 VAL 36 8.359 -11.223 -5.647 295 1HG2 VAL 36 1HG2 VAL 36 6.249 -10.205 -2.558 296 2HG2 VAL 36 2HG2 VAL 36 5.297 -11.670 -2.796 297 3HG2 VAL 36 3HG2 VAL 36 7.012 -11.786 -2.401 298 H ILE 37 H ILE 37 7.030 -8.243 -6.286 299 HA ILE 37 HA ILE 37 6.933 -9.471 -8.949 300 HB ILE 37 HB ILE 37 7.698 -6.643 -8.200 301 1HG1 ILE 37 1HG1 ILE 37 5.122 -7.649 -9.430 302 2HG1 ILE 37 2HG1 ILE 37 5.311 -7.230 -7.730 303 1HG2 ILE 37 1HG2 ILE 37 8.717 -7.386 -10.280 304 2HG2 ILE 37 2HG2 ILE 37 7.142 -7.903 -10.884 305 3HG2 ILE 37 3HG2 ILE 37 7.460 -6.191 -10.600 306 1HD1 ILE 37 1HD1 ILE 37 5.846 -4.929 -8.371 307 2HD1 ILE 37 2HD1 ILE 37 5.621 -5.359 -10.067 308 3HD1 ILE 37 3HD1 ILE 37 4.257 -5.430 -8.950 309 H ASN 38 H ASN 38 9.268 -7.458 -7.118 310 HA ASN 38 HA ASN 38 11.379 -9.377 -7.792 311 1HB ASN 38 1HB ASN 38 11.466 -7.597 -9.496 312 2HB ASN 38 2HB ASN 38 11.582 -6.386 -8.222 313 1HD2 ASN 38 1HD2 ASN 38 13.498 -6.086 -7.159 314 2HD2 ASN 38 2HD2 ASN 38 14.982 -6.808 -7.667 315 H SER 39 H SER 39 11.397 -10.032 -5.628 316 HA SER 39 HA SER 39 12.064 -7.987 -3.625 317 1HB SER 39 1HB SER 39 10.082 -9.380 -3.164 318 2HB SER 39 2HB SER 39 11.095 -10.821 -3.207 319 HG SER 39 HG SER 39 12.109 -8.947 -1.536 320 H GLY 40 H GLY 40 13.802 -8.191 -2.251 321 1HA GLY 40 1HA GLY 40 15.576 -10.481 -2.473 322 2HA GLY 40 2HA GLY 40 15.736 -9.138 -1.352 323 H ASN 41 H ASN 41 16.937 -7.354 -1.909 324 HA ASN 41 HA ASN 41 18.764 -7.777 -4.116 325 1HB ASN 41 1HB ASN 41 17.037 -5.297 -3.964 326 2HB ASN 41 2HB ASN 41 18.410 -5.503 -5.047 327 1HD2 ASN 41 1HD2 ASN 41 15.137 -6.358 -4.359 328 2HD2 ASN 41 2HD2 ASN 41 14.808 -7.156 -5.856 329 H GLY 42 H GLY 42 18.046 -4.742 -2.428 330 1HA GLY 42 1HA GLY 42 19.683 -3.305 -1.551 331 2HA GLY 42 2HA GLY 42 20.825 -4.637 -1.564 332 H VAL 43 H VAL 43 21.121 -3.354 0.528 333 HA VAL 43 HA VAL 43 19.951 -4.905 2.699 334 HB VAL 43 HB VAL 43 22.440 -4.473 2.481 335 1HG1 VAL 43 1HG1 VAL 43 22.293 -2.111 1.862 336 2HG1 VAL 43 2HG1 VAL 43 21.684 -1.739 3.474 337 3HG1 VAL 43 3HG1 VAL 43 23.321 -2.363 3.272 338 1HG2 VAL 43 1HG2 VAL 43 21.122 -5.121 4.603 339 2HG2 VAL 43 2HG2 VAL 43 22.793 -4.576 4.760 340 3HG2 VAL 43 3HG2 VAL 43 21.470 -3.468 5.115 341 H LYS 44 H LYS 44 19.762 -3.415 4.810 342 HA LYS 44 HA LYS 44 18.999 -0.795 4.815 343 1HB LYS 44 1HB LYS 44 16.624 -0.703 4.478 344 2HB LYS 44 2HB LYS 44 17.334 -1.456 3.060 345 1HG LYS 44 1HG LYS 44 16.505 -3.555 3.599 346 2HG LYS 44 2HG LYS 44 16.282 -3.135 5.298 347 1HD LYS 44 1HD LYS 44 14.590 -1.384 4.316 348 2HD LYS 44 2HD LYS 44 14.576 -2.488 2.939 349 1HE LYS 44 1HE LYS 44 13.941 -3.183 5.806 350 2HE LYS 44 2HE LYS 44 12.785 -3.038 4.484 351 1HZ LYS 44 1HZ LYS 44 14.996 -5.017 4.582 352 2HZ LYS 44 2HZ LYS 44 13.387 -5.349 4.984 353 3HZ LYS 44 3HZ LYS 44 13.790 -4.913 3.401 354 HA PRO 45 HA PRO 45 18.057 -1.754 9.034 355 1HB PRO 45 1HB PRO 45 16.864 0.782 9.503 356 2HB PRO 45 2HB PRO 45 18.544 0.315 9.765 357 1HG PRO 45 1HG PRO 45 17.659 2.140 7.870 358 2HG PRO 45 2HG PRO 45 19.230 1.323 7.855 359 1HD PRO 45 1HD PRO 45 16.746 0.689 6.325 360 2HD PRO 45 2HD PRO 45 18.445 0.576 5.824 361 H GLY 46 H GLY 46 16.352 -1.467 10.724 362 1HA GLY 46 1HA GLY 46 14.313 -2.149 11.525 363 2HA GLY 46 2HA GLY 46 13.952 -2.748 9.910 364 H LYS 47 H LYS 47 11.901 -1.665 11.282 365 HA LYS 47 HA LYS 47 10.665 0.046 9.601 366 1HB LYS 47 1HB LYS 47 10.339 0.086 12.599 367 2HB LYS 47 2HB LYS 47 9.168 0.666 11.424 368 1HG LYS 47 1HG LYS 47 8.854 -1.573 10.573 369 2HG LYS 47 2HG LYS 47 10.113 -2.183 11.648 370 1HD LYS 47 1HD LYS 47 7.990 -2.691 12.633 371 2HD LYS 47 2HD LYS 47 8.736 -1.405 13.582 372 1HE LYS 47 1HE LYS 47 7.372 0.251 12.391 373 2HE LYS 47 2HE LYS 47 6.617 -1.045 11.466 374 1HZ LYS 47 1HZ LYS 47 5.761 -1.963 13.542 375 2HZ LYS 47 2HZ LYS 47 6.463 -0.694 14.411 376 3HZ LYS 47 3HZ LYS 47 5.220 -0.378 13.305 377 H SER 48 H SER 48 13.276 1.024 11.622 378 HA SER 48 HA SER 48 12.521 3.831 11.582 379 1HB SER 48 1HB SER 48 15.090 2.495 12.491 380 2HB SER 48 2HB SER 48 14.687 4.197 12.720 381 HG SER 48 HG SER 48 13.729 3.582 14.473 382 H ASP 49 H ASP 49 13.356 1.887 9.281 383 HA ASP 49 HA ASP 49 15.623 3.005 8.011 384 1HB ASP 49 1HB ASP 49 15.280 0.921 7.185 385 2HB ASP 49 2HB ASP 49 13.539 1.004 7.414 386 H THR 50 H THR 50 15.750 4.266 6.135 387 HA THR 50 HA THR 50 13.351 5.845 5.475 388 HB THR 50 HB THR 50 16.179 6.923 5.632 389 HG1 THR 50 HG1 THR 50 14.006 7.666 7.298 390 1HG2 THR 50 1HG2 THR 50 13.542 8.301 5.102 391 2HG2 THR 50 2HG2 THR 50 15.100 9.107 5.290 392 3HG2 THR 50 3HG2 THR 50 14.827 8.025 3.924 393 H VAL 51 H VAL 51 12.840 5.564 3.376 394 HA VAL 51 HA VAL 51 15.040 5.116 1.475 395 HB VAL 51 HB VAL 51 13.702 3.443 0.282 396 1HG1 VAL 51 1HG1 VAL 51 14.219 2.847 3.190 397 2HG1 VAL 51 2HG1 VAL 51 13.886 1.620 1.964 398 3HG1 VAL 51 3HG1 VAL 51 15.330 2.626 1.837 399 1HG2 VAL 51 1HG2 VAL 51 11.483 4.227 1.005 400 2HG2 VAL 51 2HG2 VAL 51 11.697 2.493 1.267 401 3HG2 VAL 51 3HG2 VAL 51 11.811 3.615 2.628 402 H THR 52 H THR 52 14.613 5.647 -0.694 403 HA THR 52 HA THR 52 12.409 7.584 -1.040 404 HB THR 52 HB THR 52 15.026 7.419 -2.563 405 HG1 THR 52 HG1 THR 52 15.621 9.205 -1.358 406 1HG2 THR 52 1HG2 THR 52 12.796 9.457 -2.664 407 2HG2 THR 52 2HG2 THR 52 14.341 9.589 -3.503 408 3HG2 THR 52 3HG2 THR 52 13.212 8.304 -3.932 409 H VAL 53 H VAL 53 10.819 6.940 -2.333 410 HA VAL 53 HA VAL 53 11.429 5.151 -4.561 411 HB VAL 53 HB VAL 53 9.719 3.590 -4.052 412 1HG1 VAL 53 1HG1 VAL 53 11.809 3.229 -2.845 413 2HG1 VAL 53 2HG1 VAL 53 11.190 4.197 -1.487 414 3HG1 VAL 53 3HG1 VAL 53 10.412 2.657 -1.908 415 1HG2 VAL 53 1HG2 VAL 53 8.926 5.414 -1.783 416 2HG2 VAL 53 2HG2 VAL 53 7.999 5.082 -3.248 417 3HG2 VAL 53 3HG2 VAL 53 8.263 3.803 -2.062 418 H GLU 54 H GLU 54 9.193 4.719 -5.747 419 HA GLU 54 HA GLU 54 7.642 7.208 -5.905 420 1HB GLU 54 1HB GLU 54 9.354 7.263 -7.683 421 2HB GLU 54 2HB GLU 54 8.799 5.698 -8.263 422 1HG GLU 54 1HG GLU 54 6.923 8.023 -8.121 423 2HG GLU 54 2HG GLU 54 8.034 7.840 -9.478 424 H TYR 55 H TYR 55 5.451 6.846 -6.089 425 HA TYR 55 HA TYR 55 4.583 4.210 -6.995 426 1HB TYR 55 1HB TYR 55 3.350 3.644 -5.096 427 2HB TYR 55 2HB TYR 55 4.855 4.261 -4.440 428 HD1 TYR 55 HD1 TYR 55 4.880 6.703 -3.636 429 HD2 TYR 55 HD2 TYR 55 1.295 4.545 -4.425 430 HE1 TYR 55 HE1 TYR 55 3.623 8.303 -2.258 431 HE2 TYR 55 HE2 TYR 55 0.015 6.143 -3.049 432 HH TYR 55 HH TYR 55 1.314 9.110 -2.019 433 H THR 56 H THR 56 2.369 4.037 -7.422 434 HA THR 56 HA THR 56 0.988 6.596 -7.891 435 HB THR 56 HB THR 56 0.923 4.175 -9.715 436 HG1 THR 56 HG1 THR 56 2.217 5.352 -11.066 437 1HG2 THR 56 1HG2 THR 56 -1.184 5.425 -9.684 438 2HG2 THR 56 2HG2 THR 56 -0.307 6.917 -10.023 439 3HG2 THR 56 3HG2 THR 56 -0.348 5.627 -11.224 440 H GLY 57 H GLY 57 -0.735 6.643 -6.587 441 1HA GLY 57 1HA GLY 57 -2.016 5.471 -4.883 442 2HA GLY 57 2HA GLY 57 -2.003 4.061 -5.932 443 H ARG 58 H ARG 58 -4.164 3.792 -6.029 444 HA ARG 58 HA ARG 58 -5.845 6.008 -6.866 445 1HB ARG 58 1HB ARG 58 -6.792 4.605 -8.744 446 2HB ARG 58 2HB ARG 58 -5.163 5.226 -9.013 447 1HG ARG 58 1HG ARG 58 -4.893 3.075 -9.709 448 2HG ARG 58 2HG ARG 58 -4.469 2.896 -8.005 449 1HD ARG 58 1HD ARG 58 -5.929 1.126 -8.384 450 2HD ARG 58 2HD ARG 58 -6.966 2.359 -7.662 451 HE ARG 58 HE ARG 58 -7.373 2.870 -10.213 452 1HH1 ARG 58 1HH1 ARG 58 -7.161 -0.215 -8.605 453 2HH1 ARG 58 2HH1 ARG 58 -8.214 -1.015 -9.723 454 1HH2 ARG 58 1HH2 ARG 58 -8.758 1.823 -11.691 455 2HH2 ARG 58 2HH2 ARG 58 -9.122 0.143 -11.477 456 H LEU 59 H LEU 59 -7.998 5.713 -6.375 457 HA LEU 59 HA LEU 59 -8.554 3.750 -4.363 458 1HB LEU 59 1HB LEU 59 -10.387 5.703 -5.765 459 2HB LEU 59 2HB LEU 59 -10.818 4.755 -4.355 460 HG LEU 59 HG LEU 59 -8.434 6.512 -4.118 461 1HD1 LEU 59 1HD1 LEU 59 -10.232 7.824 -5.336 462 2HD1 LEU 59 2HD1 LEU 59 -11.205 7.652 -3.876 463 3HD1 LEU 59 3HD1 LEU 59 -9.660 8.500 -3.811 464 1HD2 LEU 59 1HD2 LEU 59 -9.266 5.029 -2.302 465 2HD2 LEU 59 2HD2 LEU 59 -9.213 6.735 -1.860 466 3HD2 LEU 59 3HD2 LEU 59 -10.753 5.976 -2.269 467 H ILE 60 H ILE 60 -10.302 2.175 -4.477 468 HA ILE 60 HA ILE 60 -10.201 0.562 -6.759 469 HB ILE 60 HB ILE 60 -11.173 0.207 -4.248 470 1HG1 ILE 60 1HG1 ILE 60 -10.392 -1.583 -5.691 471 2HG1 ILE 60 2HG1 ILE 60 -11.959 -2.010 -5.013 472 1HG2 ILE 60 1HG2 ILE 60 -13.230 1.448 -4.750 473 2HG2 ILE 60 2HG2 ILE 60 -13.616 0.272 -6.011 474 3HG2 ILE 60 3HG2 ILE 60 -13.548 -0.235 -4.321 475 1HD1 ILE 60 1HD1 ILE 60 -13.028 -1.386 -7.124 476 2HD1 ILE 60 2HD1 ILE 60 -11.442 -1.001 -7.801 477 3HD1 ILE 60 3HD1 ILE 60 -11.824 -2.661 -7.333 478 H ASP 61 H ASP 61 -11.732 3.482 -6.242 479 HA ASP 61 HA ASP 61 -14.103 3.204 -7.748 480 1HB ASP 61 1HB ASP 61 -13.651 5.086 -6.199 481 2HB ASP 61 2HB ASP 61 -12.428 5.688 -7.315 482 H GLY 62 H GLY 62 -10.868 3.117 -8.702 483 1HA GLY 62 1HA GLY 62 -11.674 3.235 -11.498 484 2HA GLY 62 2HA GLY 62 -10.149 2.626 -10.880 485 H THR 63 H THR 63 -10.576 5.526 -9.363 486 HA THR 63 HA THR 63 -9.215 6.973 -11.532 487 HB THR 63 HB THR 63 -10.132 9.062 -10.509 488 HG1 THR 63 HG1 THR 63 -11.453 8.952 -8.829 489 1HG2 THR 63 1HG2 THR 63 -11.163 8.078 -12.495 490 2HG2 THR 63 2HG2 THR 63 -12.175 7.057 -11.471 491 3HG2 THR 63 3HG2 THR 63 -12.383 8.809 -11.451 492 H VAL 64 H VAL 64 -7.246 7.696 -11.097 493 HA VAL 64 HA VAL 64 -5.890 7.109 -8.728 494 HB VAL 64 HB VAL 64 -4.686 7.423 -10.812 495 1HG1 VAL 64 1HG1 VAL 64 -5.555 10.306 -10.645 496 2HG1 VAL 64 2HG1 VAL 64 -4.413 9.646 -11.815 497 3HG1 VAL 64 3HG1 VAL 64 -6.095 9.117 -11.832 498 1HG2 VAL 64 1HG2 VAL 64 -3.978 9.458 -8.702 499 2HG2 VAL 64 2HG2 VAL 64 -3.382 7.803 -8.841 500 3HG2 VAL 64 3HG2 VAL 64 -2.920 9.009 -10.040 501 H PHE 65 H PHE 65 -5.586 8.220 -6.887 502 HA PHE 65 HA PHE 65 -7.091 10.704 -6.611 503 1HB PHE 65 1HB PHE 65 -6.875 10.353 -4.163 504 2HB PHE 65 2HB PHE 65 -7.678 9.021 -4.981 505 HD1 PHE 65 HD1 PHE 65 -4.224 8.722 -5.601 506 HD2 PHE 65 HD2 PHE 65 -7.142 8.139 -2.584 507 HE1 PHE 65 HE1 PHE 65 -2.706 7.188 -4.462 508 HE2 PHE 65 HE2 PHE 65 -5.638 6.570 -1.452 509 HZ PHE 65 HZ PHE 65 -3.398 6.105 -2.377 510 H ASP 66 H ASP 66 -3.849 9.500 -6.624 511 HA ASP 66 HA ASP 66 -2.709 12.018 -6.932 512 1HB ASP 66 1HB ASP 66 -3.210 12.375 -4.572 513 2HB ASP 66 2HB ASP 66 -2.403 10.868 -4.148 514 H SER 67 H SER 67 -0.738 11.787 -7.816 515 HA SER 67 HA SER 67 0.707 9.261 -7.376 516 1HB SER 67 1HB SER 67 -0.434 9.136 -9.552 517 2HB SER 67 2HB SER 67 0.337 10.644 -10.047 518 HG SER 67 HG SER 67 2.373 9.432 -9.556 519 H THR 68 H THR 68 2.722 9.600 -6.674 520 HA THR 68 HA THR 68 3.796 12.246 -6.550 521 HB THR 68 HB THR 68 5.747 11.263 -5.488 522 HG1 THR 68 HG1 THR 68 4.618 8.751 -6.255 523 1HG2 THR 68 1HG2 THR 68 3.657 11.482 -4.175 524 2HG2 THR 68 2HG2 THR 68 3.251 9.817 -4.586 525 3HG2 THR 68 3HG2 THR 68 4.678 10.162 -3.613 526 H GLU 69 H GLU 69 3.866 9.755 -8.863 527 HA GLU 69 HA GLU 69 6.353 10.429 -10.103 528 1HB GLU 69 1HB GLU 69 5.138 8.202 -10.266 529 2HB GLU 69 2HB GLU 69 4.031 8.990 -11.382 530 1HG GLU 69 1HG GLU 69 5.989 9.552 -12.814 531 2HG GLU 69 2HG GLU 69 6.985 8.574 -11.737 532 H LYS 70 H LYS 70 2.944 11.117 -10.771 533 HA LYS 70 HA LYS 70 3.334 12.591 -13.127 534 1HB LYS 70 1HB LYS 70 1.125 12.661 -11.072 535 2HB LYS 70 2HB LYS 70 1.067 13.568 -12.577 536 1HG LYS 70 1HG LYS 70 1.399 10.582 -12.459 537 2HG LYS 70 2HG LYS 70 -0.165 11.389 -12.584 538 1HD LYS 70 1HD LYS 70 0.574 12.468 -14.666 539 2HD LYS 70 2HD LYS 70 2.119 11.622 -14.544 540 1HE LYS 70 1HE LYS 70 0.995 9.481 -14.735 541 2HE LYS 70 2HE LYS 70 -0.577 10.280 -14.751 542 1HZ LYS 70 1HZ LYS 70 1.543 10.600 -16.808 543 2HZ LYS 70 2HZ LYS 70 0.140 9.673 -16.979 544 3HZ LYS 70 3HZ LYS 70 0.028 11.353 -16.827 545 H THR 71 H THR 71 3.203 13.590 -9.739 546 HA THR 71 HA THR 71 3.249 16.355 -10.120 547 HB THR 71 HB THR 71 4.607 14.885 -7.853 548 HG1 THR 71 HG1 THR 71 2.661 14.534 -7.018 549 1HG2 THR 71 1HG2 THR 71 3.347 17.627 -8.020 550 2HG2 THR 71 2HG2 THR 71 4.021 16.895 -6.564 551 3HG2 THR 71 3HG2 THR 71 5.075 17.281 -7.924 552 H GLY 72 H GLY 72 5.646 14.008 -10.727 553 1HA GLY 72 1HA GLY 72 7.493 16.063 -11.599 554 2HA GLY 72 2HA GLY 72 7.657 14.332 -11.856 555 H LYS 73 H LYS 73 6.962 14.554 -8.696 556 HA LYS 73 HA LYS 73 9.805 14.710 -7.956 557 1HB LYS 73 1HB LYS 73 7.431 15.741 -6.401 558 2HB LYS 73 2HB LYS 73 9.062 15.628 -5.761 559 1HG LYS 73 1HG LYS 73 9.854 17.193 -7.445 560 2HG LYS 73 2HG LYS 73 8.232 17.284 -8.133 561 1HD LYS 73 1HD LYS 73 8.319 19.174 -6.792 562 2HD LYS 73 2HD LYS 73 7.524 17.997 -5.746 563 1HE LYS 73 1HE LYS 73 10.471 18.637 -5.703 564 2HE LYS 73 2HE LYS 73 9.280 19.305 -4.590 565 1HZ LYS 73 1HZ LYS 73 8.774 17.001 -3.900 566 2HZ LYS 73 2HZ LYS 73 10.050 16.453 -4.867 567 3HZ LYS 73 3HZ LYS 73 10.363 17.467 -3.551 568 HA PRO 74 HA PRO 74 8.982 10.455 -6.738 569 1HB PRO 74 1HB PRO 74 11.526 10.921 -5.260 570 2HB PRO 74 2HB PRO 74 11.081 9.599 -6.346 571 1HG PRO 74 1HG PRO 74 12.738 11.509 -7.162 572 2HG PRO 74 2HG PRO 74 11.507 10.849 -8.256 573 1HD PRO 74 1HD PRO 74 11.535 13.446 -6.776 574 2HD PRO 74 2HD PRO 74 10.940 13.083 -8.410 575 H ALA 75 H ALA 75 8.724 9.279 -4.708 576 HA ALA 75 HA ALA 75 7.809 11.058 -2.585 577 1HB ALA 75 1HB ALA 75 7.103 8.338 -3.504 578 2HB ALA 75 2HB ALA 75 6.075 9.640 -2.909 579 3HB ALA 75 3HB ALA 75 6.980 8.646 -1.774 580 H THR 76 H THR 76 8.979 11.305 -0.762 581 HA THR 76 HA THR 76 10.940 9.206 -0.083 582 HB THR 76 HB THR 76 11.315 12.187 0.297 583 HG1 THR 76 HG1 THR 76 12.559 12.113 -1.473 584 1HG2 THR 76 1HG2 THR 76 13.149 9.852 0.856 585 2HG2 THR 76 2HG2 THR 76 13.622 11.551 0.928 586 3HG2 THR 76 3HG2 THR 76 12.416 10.921 2.051 587 H PHE 77 H PHE 77 10.252 8.218 1.686 588 HA PHE 77 HA PHE 77 9.743 9.712 4.101 589 1HB PHE 77 1HB PHE 77 7.521 8.782 4.517 590 2HB PHE 77 2HB PHE 77 7.515 9.717 3.025 591 HD1 PHE 77 HD1 PHE 77 7.298 8.629 0.874 592 HD2 PHE 77 HD2 PHE 77 7.251 6.375 4.489 593 HE1 PHE 77 HE1 PHE 77 6.412 6.689 -0.351 594 HE2 PHE 77 HE2 PHE 77 6.366 4.430 3.265 595 HZ PHE 77 HZ PHE 77 5.949 4.590 0.843 596 H GLN 78 H GLN 78 9.460 8.241 5.984 597 HA GLN 78 HA GLN 78 11.088 5.864 5.607 598 1HB GLN 78 1HB GLN 78 10.970 5.744 8.125 599 2HB GLN 78 2HB GLN 78 11.777 7.150 7.458 600 1HG GLN 78 1HG GLN 78 10.007 8.568 8.006 601 2HG GLN 78 2HG GLN 78 8.896 7.217 8.231 602 1HE2 GLN 78 1HE2 GLN 78 10.694 5.608 9.724 603 2HE2 GLN 78 2HE2 GLN 78 10.856 6.321 11.292 604 H VAL 79 H VAL 79 10.477 3.836 6.251 605 HA VAL 79 HA VAL 79 7.952 3.009 5.427 606 HB VAL 79 HB VAL 79 8.555 0.796 6.349 607 1HG1 VAL 79 1HG1 VAL 79 9.317 1.494 4.131 608 2HG1 VAL 79 2HG1 VAL 79 10.768 2.195 4.848 609 3HG1 VAL 79 3HG1 VAL 79 10.505 0.452 4.917 610 1HG2 VAL 79 1HG2 VAL 79 9.710 1.547 8.364 611 2HG2 VAL 79 2HG2 VAL 79 10.748 0.496 7.394 612 3HG2 VAL 79 3HG2 VAL 79 10.996 2.246 7.375 613 H SER 80 H SER 80 8.919 4.058 8.615 614 HA SER 80 HA SER 80 6.574 2.774 9.801 615 1HB SER 80 1HB SER 80 7.475 3.437 11.956 616 2HB SER 80 2HB SER 80 8.727 2.639 11.004 617 HG SER 80 HG SER 80 9.718 4.417 11.731 618 H GLN 81 H GLN 81 7.144 5.613 8.234 619 HA GLN 81 HA GLN 81 5.621 7.352 9.971 620 1HB GLN 81 1HB GLN 81 7.507 8.118 8.499 621 2HB GLN 81 2HB GLN 81 6.456 7.860 7.118 622 1HG GLN 81 1HG GLN 81 5.005 9.589 7.773 623 2HG GLN 81 2HG GLN 81 5.707 9.670 9.389 624 1HE2 GLN 81 1HE2 GLN 81 8.432 9.453 8.397 625 2HE2 GLN 81 2HE2 GLN 81 8.823 10.986 7.708 626 H VAL 82 H VAL 82 4.631 4.852 8.199 627 HA VAL 82 HA VAL 82 2.191 6.213 7.263 628 HB VAL 82 HB VAL 82 1.934 3.932 5.968 629 1HG1 VAL 82 1HG1 VAL 82 3.827 6.124 5.117 630 2HG1 VAL 82 2HG1 VAL 82 3.050 4.962 4.041 631 3HG1 VAL 82 3HG1 VAL 82 2.074 6.132 4.930 632 1HG2 VAL 82 1HG2 VAL 82 3.949 2.940 7.022 633 2HG2 VAL 82 2HG2 VAL 82 4.032 2.980 5.262 634 3HG2 VAL 82 3HG2 VAL 82 4.934 4.160 6.213 635 H ILE 83 H ILE 83 0.347 4.397 7.053 636 HA ILE 83 HA ILE 83 -0.602 3.923 9.617 637 HB ILE 83 HB ILE 83 -2.223 2.354 8.525 638 1HG1 ILE 83 1HG1 ILE 83 -0.714 3.120 6.015 639 2HG1 ILE 83 2HG1 ILE 83 -0.649 1.537 6.783 640 1HG2 ILE 83 1HG2 ILE 83 -2.668 4.745 8.717 641 2HG2 ILE 83 2HG2 ILE 83 -1.834 5.031 7.191 642 3HG2 ILE 83 3HG2 ILE 83 -3.330 4.098 7.217 643 1HD1 ILE 83 1HD1 ILE 83 -3.102 2.821 5.608 644 2HD1 ILE 83 2HD1 ILE 83 -2.138 1.545 4.865 645 3HD1 ILE 83 3HD1 ILE 83 -3.023 1.226 6.357 646 HA PRO 84 HA PRO 84 1.227 0.337 11.383 647 1HB PRO 84 1HB PRO 84 -1.528 -0.818 11.462 648 2HB PRO 84 2HB PRO 84 -0.319 -0.702 12.748 649 1HG PRO 84 1HG PRO 84 -2.393 0.966 12.679 650 2HG PRO 84 2HG PRO 84 -0.784 1.529 13.168 651 1HD PRO 84 1HD PRO 84 -2.262 1.985 10.626 652 2HD PRO 84 2HD PRO 84 -1.102 3.034 11.464 653 H GLY 85 H GLY 85 -1.391 -0.407 9.081 654 1HA GLY 85 1HA GLY 85 -1.535 -1.967 7.406 655 2HA GLY 85 2HA GLY 85 -0.514 -2.989 8.405 656 H TRP 86 H TRP 86 0.091 0.108 6.757 657 HA TRP 86 HA TRP 86 1.617 -0.956 4.653 658 1HB TRP 86 1HB TRP 86 0.805 1.630 5.560 659 2HB TRP 86 2HB TRP 86 2.521 1.677 5.183 660 HD1 TRP 86 HD1 TRP 86 -0.697 0.368 3.413 661 HE1 TRP 86 HE1 TRP 86 -0.489 0.938 0.909 662 HE3 TRP 86 HE3 TRP 86 3.931 2.540 3.447 663 HZ2 TRP 86 HZ2 TRP 86 1.379 2.148 -0.817 664 HZ3 TRP 86 HZ3 TRP 86 4.853 3.375 1.328 665 HH2 TRP 86 HH2 TRP 86 3.604 3.184 -0.761 666 H THR 87 H THR 87 2.703 0.664 7.644 667 HA THR 87 HA THR 87 5.431 0.498 7.214 668 HB THR 87 HB THR 87 4.511 1.802 9.051 669 HG1 THR 87 HG1 THR 87 6.403 -0.218 9.635 670 1HG2 THR 87 1HG2 THR 87 3.898 -0.868 10.323 671 2HG2 THR 87 2HG2 THR 87 3.777 0.697 11.128 672 3HG2 THR 87 3HG2 THR 87 2.720 0.322 9.767 673 H GLU 88 H GLU 88 3.236 -1.976 8.410 674 HA GLU 88 HA GLU 88 5.206 -3.764 9.340 675 1HB GLU 88 1HB GLU 88 2.604 -3.717 9.653 676 2HB GLU 88 2HB GLU 88 2.609 -4.721 8.209 677 1HG GLU 88 1HG GLU 88 4.079 -5.330 10.763 678 2HG GLU 88 2HG GLU 88 2.538 -6.031 10.267 679 H ALA 89 H ALA 89 3.424 -3.648 6.247 680 HA ALA 89 HA ALA 89 4.773 -5.840 5.079 681 1HB ALA 89 1HB ALA 89 2.634 -5.036 4.240 682 2HB ALA 89 2HB ALA 89 3.848 -5.041 2.958 683 3HB ALA 89 3HB ALA 89 3.387 -3.522 3.732 684 H LEU 90 H LEU 90 5.351 -2.343 4.886 685 HA LEU 90 HA LEU 90 7.399 -2.355 3.000 686 1HB LEU 90 1HB LEU 90 6.487 -0.506 5.125 687 2HB LEU 90 2HB LEU 90 8.125 -0.272 4.550 688 HG LEU 90 HG LEU 90 6.450 1.167 3.410 689 1HD1 LEU 90 1HD1 LEU 90 8.561 0.615 2.326 690 2HD1 LEU 90 2HD1 LEU 90 7.836 -0.836 1.634 691 3HD1 LEU 90 3HD1 LEU 90 7.257 0.757 1.147 692 1HD2 LEU 90 1HD2 LEU 90 4.601 -0.473 3.426 693 2HD2 LEU 90 2HD2 LEU 90 4.901 0.208 1.828 694 3HD2 LEU 90 3HD2 LEU 90 5.461 -1.419 2.212 695 H GLN 91 H GLN 91 7.451 -3.138 6.392 696 HA GLN 91 HA GLN 91 10.208 -2.910 6.879 697 1HB GLN 91 1HB GLN 91 8.738 -3.125 8.741 698 2HB GLN 91 2HB GLN 91 8.062 -4.632 8.121 699 1HG GLN 91 1HG GLN 91 10.309 -5.674 8.448 700 2HG GLN 91 2HG GLN 91 10.813 -4.190 9.256 701 1HE2 GLN 91 1HE2 GLN 91 10.029 -3.724 11.290 702 2HE2 GLN 91 2HE2 GLN 91 9.183 -4.880 12.254 703 H LEU 92 H LEU 92 8.387 -5.265 5.138 704 HA LEU 92 HA LEU 92 10.534 -7.230 5.245 705 1HB LEU 92 1HB LEU 92 7.754 -7.266 4.113 706 2HB LEU 92 2HB LEU 92 8.908 -8.539 3.767 707 HG LEU 92 HG LEU 92 9.086 -8.974 6.217 708 1HD1 LEU 92 1HD1 LEU 92 6.798 -7.018 6.366 709 2HD1 LEU 92 2HD1 LEU 92 7.329 -8.069 7.678 710 3HD1 LEU 92 3HD1 LEU 92 8.404 -6.813 7.066 711 1HD2 LEU 92 1HD2 LEU 92 7.641 -10.323 4.797 712 2HD2 LEU 92 2HD2 LEU 92 6.928 -10.108 6.397 713 3HD2 LEU 92 3HD2 LEU 92 6.323 -9.172 5.028 714 H MET 93 H MET 93 9.772 -4.575 3.350 715 HA MET 93 HA MET 93 10.762 -5.750 0.871 716 1HB MET 93 1HB MET 93 9.023 -3.606 1.488 717 2HB MET 93 2HB MET 93 10.434 -2.904 0.691 718 1HG MET 93 1HG MET 93 10.134 -4.588 -1.129 719 2HG MET 93 2HG MET 93 8.612 -5.043 -0.370 720 1HE MET 93 1HE MET 93 7.509 -2.392 0.727 721 2HE MET 93 2HE MET 93 6.588 -1.688 -0.602 722 3HE MET 93 3HE MET 93 6.454 -3.411 -0.253 723 HA PRO 94 HA PRO 94 14.858 -4.238 2.129 724 1HB PRO 94 1HB PRO 94 16.273 -5.701 0.359 725 2HB PRO 94 2HB PRO 94 15.614 -6.412 1.841 726 1HG PRO 94 1HG PRO 94 14.545 -6.526 -0.954 727 2HG PRO 94 2HG PRO 94 14.662 -7.820 0.252 728 1HD PRO 94 1HD PRO 94 12.356 -6.451 -0.264 729 2HD PRO 94 2HD PRO 94 12.747 -7.164 1.341 730 H ALA 95 H ALA 95 16.185 -2.651 1.200 731 HA ALA 95 HA ALA 95 15.191 -0.962 -0.690 732 1HB ALA 95 1HB ALA 95 17.111 -0.461 0.762 733 2HB ALA 95 2HB ALA 95 18.119 -1.504 -0.240 734 3HB ALA 95 3HB ALA 95 17.417 -0.037 -0.923 735 H GLY 96 H GLY 96 14.811 -1.056 -2.807 736 1HA GLY 96 1HA GLY 96 16.554 -2.754 -4.470 737 2HA GLY 96 2HA GLY 96 15.585 -1.411 -5.054 738 H SER 97 H SER 97 13.828 -3.318 -2.888 739 HA SER 97 HA SER 97 12.976 -5.370 -4.686 740 1HB SER 97 1HB SER 97 12.829 -5.793 -2.318 741 2HB SER 97 2HB SER 97 11.819 -4.367 -2.075 742 HG SER 97 HG SER 97 10.508 -6.177 -2.134 743 H THR 98 H THR 98 10.484 -5.625 -4.984 744 HA THR 98 HA THR 98 9.169 -3.118 -5.677 745 HB THR 98 HB THR 98 9.453 -5.312 -7.736 746 HG1 THR 98 HG1 THR 98 11.432 -4.437 -7.786 747 1HG2 THR 98 1HG2 THR 98 7.436 -3.936 -7.936 748 2HG2 THR 98 2HG2 THR 98 8.429 -2.476 -7.934 749 3HG2 THR 98 3HG2 THR 98 8.553 -3.626 -9.267 750 H TRP 99 H TRP 99 7.542 -3.517 -4.221 751 HA TRP 99 HA TRP 99 5.938 -5.947 -4.684 752 1HB TRP 99 1HB TRP 99 6.593 -4.475 -2.151 753 2HB TRP 99 2HB TRP 99 5.135 -5.449 -2.264 754 HD1 TRP 99 HD1 TRP 99 7.636 -7.242 -4.221 755 HE1 TRP 99 HE1 TRP 99 8.737 -9.101 -2.826 756 HE3 TRP 99 HE3 TRP 99 6.095 -5.797 0.432 757 HZ2 TRP 99 HZ2 TRP 99 8.926 -9.864 -0.118 758 HZ3 TRP 99 HZ3 TRP 99 6.779 -7.147 2.373 759 HH2 TRP 99 HH2 TRP 99 8.164 -9.138 2.103 760 H GLU 100 H GLU 100 3.715 -5.793 -4.632 761 HA GLU 100 HA GLU 100 2.588 -3.070 -4.716 762 1HB GLU 100 1HB GLU 100 0.833 -4.064 -6.232 763 2HB GLU 100 2HB GLU 100 2.443 -3.975 -6.934 764 1HG GLU 100 1HG GLU 100 2.779 -6.354 -6.406 765 2HG GLU 100 2HG GLU 100 1.136 -6.425 -5.771 766 H ILE 101 H ILE 101 1.576 -2.789 -2.816 767 HA ILE 101 HA ILE 101 0.224 -5.107 -1.630 768 HB ILE 101 HB ILE 101 0.325 -3.858 0.505 769 1HG1 ILE 101 1HG1 ILE 101 2.155 -1.978 -0.999 770 2HG1 ILE 101 2HG1 ILE 101 0.501 -1.591 -0.534 771 1HG2 ILE 101 1HG2 ILE 101 2.777 -4.655 -0.997 772 2HG2 ILE 101 2HG2 ILE 101 2.922 -3.998 0.631 773 3HG2 ILE 101 3HG2 ILE 101 1.975 -5.458 0.354 774 1HD1 ILE 101 1HD1 ILE 101 2.675 -2.318 1.413 775 2HD1 ILE 101 2HD1 ILE 101 2.233 -0.667 0.978 776 3HD1 ILE 101 3HD1 ILE 101 1.062 -1.709 1.785 777 H TYR 102 H TYR 102 -1.803 -5.070 -0.951 778 HA TYR 102 HA TYR 102 -3.416 -2.657 -1.432 779 1HB TYR 102 1HB TYR 102 -5.239 -4.655 -1.685 780 2HB TYR 102 2HB TYR 102 -4.389 -3.937 -3.049 781 HD1 TYR 102 HD1 TYR 102 -4.717 -6.891 -0.926 782 HD2 TYR 102 HD2 TYR 102 -2.562 -5.159 -4.161 783 HE1 TYR 102 HE1 TYR 102 -3.824 -9.101 -1.514 784 HE2 TYR 102 HE2 TYR 102 -1.667 -7.361 -4.754 785 HH TYR 102 HH TYR 102 -1.265 -9.517 -3.744 786 H VAL 103 H VAL 103 -3.735 -1.894 0.573 787 HA VAL 103 HA VAL 103 -4.276 -3.805 2.751 788 HB VAL 103 HB VAL 103 -3.655 -0.911 3.203 789 1HG1 VAL 103 1HG1 VAL 103 -3.155 -3.441 4.764 790 2HG1 VAL 103 2HG1 VAL 103 -2.646 -1.827 5.264 791 3HG1 VAL 103 3HG1 VAL 103 -4.362 -2.203 5.107 792 1HG2 VAL 103 1HG2 VAL 103 -1.645 -3.083 2.619 793 2HG2 VAL 103 2HG2 VAL 103 -1.914 -1.605 1.695 794 3HG2 VAL 103 3HG2 VAL 103 -1.251 -1.516 3.326 795 HA PRO 104 HA PRO 104 -8.532 -2.077 2.249 796 1HB PRO 104 1HB PRO 104 -9.473 -3.905 4.161 797 2HB PRO 104 2HB PRO 104 -9.576 -4.094 2.409 798 1HG PRO 104 1HG PRO 104 -7.635 -5.257 4.335 799 2HG PRO 104 2HG PRO 104 -8.275 -5.938 2.831 800 1HD PRO 104 1HD PRO 104 -5.778 -4.954 3.007 801 2HD PRO 104 2HD PRO 104 -6.744 -4.808 1.520 802 H SER 105 H SER 105 -9.696 -0.767 3.675 803 HA SER 105 HA SER 105 -8.345 0.692 5.557 804 1HB SER 105 1HB SER 105 -10.757 1.160 6.476 805 2HB SER 105 2HB SER 105 -10.306 1.693 4.851 806 HG SER 105 HG SER 105 -11.211 -0.421 4.175 807 H GLY 106 H GLY 106 -9.916 -2.383 6.057 808 1HA GLY 106 1HA GLY 106 -10.062 -3.746 7.895 809 2HA GLY 106 2HA GLY 106 -10.296 -2.282 8.831 810 H LEU 107 H LEU 107 -7.355 -2.192 7.183 811 HA LEU 107 HA LEU 107 -5.937 -3.275 9.520 812 1HB LEU 107 1HB LEU 107 -5.096 -3.190 6.634 813 2HB LEU 107 2HB LEU 107 -4.018 -3.610 7.943 814 HG LEU 107 HG LEU 107 -4.696 -5.660 7.015 815 1HD1 LEU 107 1HD1 LEU 107 -4.847 -5.501 9.506 816 2HD1 LEU 107 2HD1 LEU 107 -6.587 -5.286 9.324 817 3HD1 LEU 107 3HD1 LEU 107 -5.822 -6.780 8.782 818 1HD2 LEU 107 1HD2 LEU 107 -6.565 -4.772 5.692 819 2HD2 LEU 107 2HD2 LEU 107 -6.988 -6.263 6.534 820 3HD2 LEU 107 3HD2 LEU 107 -7.552 -4.710 7.151 821 H ALA 108 H ALA 108 -6.760 -0.423 8.133 822 HA ALA 108 HA ALA 108 -4.237 0.876 8.921 823 1HB ALA 108 1HB ALA 108 -4.829 1.312 6.618 824 2HB ALA 108 2HB ALA 108 -6.434 1.864 7.100 825 3HB ALA 108 3HB ALA 108 -5.006 2.795 7.563 826 H TYR 109 H TYR 109 -6.997 2.874 8.582 827 HA TYR 109 HA TYR 109 -7.058 3.265 11.481 828 1HB TYR 109 1HB TYR 109 -7.757 4.985 9.129 829 2HB TYR 109 2HB TYR 109 -8.460 5.331 10.708 830 HD1 TYR 109 HD1 TYR 109 -5.396 5.365 8.705 831 HD2 TYR 109 HD2 TYR 109 -7.047 6.018 12.570 832 HE1 TYR 109 HE1 TYR 109 -3.355 6.561 9.367 833 HE2 TYR 109 HE2 TYR 109 -5.011 7.224 13.243 834 HH TYR 109 HH TYR 109 -2.659 8.243 11.021 835 H GLY 110 H GLY 110 -8.589 1.536 9.183 836 1HA GLY 110 1HA GLY 110 -10.921 1.152 10.873 837 2HA GLY 110 2HA GLY 110 -10.402 0.122 9.560 838 HA PRO 111 HA PRO 111 -13.026 1.949 6.500 839 1HB PRO 111 1HB PRO 111 -15.115 0.169 6.735 840 2HB PRO 111 2HB PRO 111 -13.642 -0.131 5.807 841 1HG PRO 111 1HG PRO 111 -14.335 -0.990 8.590 842 2HG PRO 111 2HG PRO 111 -13.570 -1.923 7.287 843 1HD PRO 111 1HD PRO 111 -12.100 -0.899 9.253 844 2HD PRO 111 2HD PRO 111 -11.515 -0.868 7.577 845 H ARG 112 H ARG 112 -13.677 1.959 9.803 846 HA ARG 112 HA ARG 112 -16.424 2.768 9.697 847 1HB ARG 112 1HB ARG 112 -14.417 3.014 11.946 848 2HB ARG 112 2HB ARG 112 -16.153 3.238 12.092 849 1HG ARG 112 1HG ARG 112 -16.504 0.895 11.471 850 2HG ARG 112 2HG ARG 112 -14.757 0.675 11.350 851 1HD ARG 112 1HD ARG 112 -14.527 1.268 13.718 852 2HD ARG 112 2HD ARG 112 -16.275 1.470 13.833 853 HE ARG 112 HE ARG 112 -15.753 -1.103 12.873 854 1HH1 ARG 112 1HH1 ARG 112 -15.312 0.780 15.772 855 2HH1 ARG 112 2HH1 ARG 112 -15.399 -0.589 16.830 856 1HH2 ARG 112 1HH2 ARG 112 -15.871 -2.913 14.260 857 2HH2 ARG 112 2HH2 ARG 112 -15.716 -2.687 15.970 858 H SER 113 H SER 113 -17.151 4.864 10.525 859 HA SER 113 HA SER 113 -17.332 7.095 10.188 860 1HB SER 113 1HB SER 113 -15.430 8.477 10.930 861 2HB SER 113 2HB SER 113 -15.762 7.169 12.061 862 HG SER 113 HG SER 113 -13.474 7.657 11.241 863 H VAL 114 H VAL 114 -14.311 8.071 9.268 864 HA VAL 114 HA VAL 114 -15.065 7.966 6.425 865 HB VAL 114 HB VAL 114 -13.251 10.082 7.533 866 1HG1 VAL 114 1HG1 VAL 114 -13.378 9.823 5.112 867 2HG1 VAL 114 2HG1 VAL 114 -15.136 10.000 5.177 868 3HG1 VAL 114 3HG1 VAL 114 -14.094 11.358 5.619 869 1HG2 VAL 114 1HG2 VAL 114 -15.253 10.172 8.917 870 2HG2 VAL 114 2HG2 VAL 114 -15.190 11.555 7.824 871 3HG2 VAL 114 3HG2 VAL 114 -16.266 10.202 7.473 872 H GLY 115 H GLY 115 -13.264 6.241 8.246 873 1HA GLY 115 1HA GLY 115 -11.403 5.449 6.335 874 2HA GLY 115 2HA GLY 115 -11.287 5.091 8.050 875 H GLY 116 H GLY 116 -8.933 5.255 7.336 876 1HA GLY 116 1HA GLY 116 -6.972 6.392 7.838 877 2HA GLY 116 2HA GLY 116 -7.927 7.817 8.220 878 HA PRO 117 HA PRO 117 -5.832 9.214 4.433 879 1HB PRO 117 1HB PRO 117 -3.896 7.492 3.461 880 2HB PRO 117 2HB PRO 117 -3.610 8.734 4.683 881 1HG PRO 117 1HG PRO 117 -4.100 5.805 5.032 882 2HG PRO 117 2HG PRO 117 -2.964 6.864 5.891 883 1HD PRO 117 1HD PRO 117 -5.278 6.095 7.008 884 2HD PRO 117 2HD PRO 117 -4.620 7.734 7.269 885 H ILE 118 H ILE 118 -6.707 5.861 4.482 886 HA ILE 118 HA ILE 118 -7.240 5.759 1.625 887 HB ILE 118 HB ILE 118 -7.572 3.683 3.803 888 1HG1 ILE 118 1HG1 ILE 118 -5.635 3.819 1.483 889 2HG1 ILE 118 2HG1 ILE 118 -5.244 4.271 3.140 890 1HG2 ILE 118 1HG2 ILE 118 -8.099 3.482 0.843 891 2HG2 ILE 118 2HG2 ILE 118 -7.975 2.097 1.929 892 3HG2 ILE 118 3HG2 ILE 118 -9.266 3.282 2.152 893 1HD1 ILE 118 1HD1 ILE 118 -5.776 1.957 3.838 894 2HD1 ILE 118 2HD1 ILE 118 -6.003 1.538 2.140 895 3HD1 ILE 118 3HD1 ILE 118 -4.421 2.068 2.714 896 H GLY 119 H GLY 119 -9.234 5.884 0.719 897 1HA GLY 119 1HA GLY 119 -11.526 6.080 0.537 898 2HA GLY 119 2HA GLY 119 -11.295 7.284 1.794 899 HA PRO 120 HA PRO 120 -13.423 4.948 4.870 900 1HB PRO 120 1HB PRO 120 -16.041 5.552 4.258 901 2HB PRO 120 2HB PRO 120 -14.960 6.613 5.166 902 1HG PRO 120 1HG PRO 120 -15.693 6.681 2.267 903 2HG PRO 120 2HG PRO 120 -15.506 8.026 3.409 904 1HD PRO 120 1HD PRO 120 -13.591 7.429 1.628 905 2HD PRO 120 2HD PRO 120 -13.191 7.996 3.263 906 H ASN 121 H ASN 121 -13.892 2.848 4.985 907 HA ASN 121 HA ASN 121 -14.234 0.693 4.249 908 1HB ASN 121 1HB ASN 121 -16.697 1.774 2.897 909 2HB ASN 121 2HB ASN 121 -16.484 0.245 3.750 910 1HD2 ASN 121 1HD2 ASN 121 -16.948 3.665 4.077 911 2HD2 ASN 121 2HD2 ASN 121 -17.406 3.665 5.748 912 H GLU 122 H GLU 122 -12.619 2.283 2.506 913 HA GLU 122 HA GLU 122 -13.360 1.173 -0.116 914 1HB GLU 122 1HB GLU 122 -13.318 3.663 0.022 915 2HB GLU 122 2HB GLU 122 -11.610 3.573 0.428 916 1HG GLU 122 1HG GLU 122 -11.795 4.091 -1.884 917 2HG GLU 122 2HG GLU 122 -11.216 2.432 -1.743 918 H THR 123 H THR 123 -11.941 -0.102 -1.175 919 HA THR 123 HA THR 123 -9.475 -0.785 0.242 920 HB THR 123 HB THR 123 -10.817 -2.177 -2.088 921 HG1 THR 123 HG1 THR 123 -11.042 -3.809 -0.301 922 1HG2 THR 123 1HG2 THR 123 -8.421 -2.982 -0.429 923 2HG2 THR 123 2HG2 THR 123 -9.207 -3.986 -1.648 924 3HG2 THR 123 3HG2 THR 123 -8.395 -2.496 -2.124 925 H LEU 124 H LEU 124 -7.490 -0.334 -0.570 926 HA LEU 124 HA LEU 124 -7.426 1.038 -3.179 927 1HB LEU 124 1HB LEU 124 -6.766 2.007 -0.613 928 2HB LEU 124 2HB LEU 124 -5.258 1.829 -1.489 929 HG LEU 124 HG LEU 124 -7.392 3.146 -3.016 930 1HD1 LEU 124 1HD1 LEU 124 -7.862 4.019 -0.773 931 2HD1 LEU 124 2HD1 LEU 124 -6.176 4.513 -0.619 932 3HD1 LEU 124 3HD1 LEU 124 -7.206 5.262 -1.839 933 1HD2 LEU 124 1HD2 LEU 124 -5.017 2.895 -3.717 934 2HD2 LEU 124 2HD2 LEU 124 -5.586 4.564 -3.693 935 3HD2 LEU 124 3HD2 LEU 124 -4.564 3.964 -2.390 936 H ILE 125 H ILE 125 -5.534 0.874 -4.405 937 HA ILE 125 HA ILE 125 -3.836 -1.451 -3.796 938 HB ILE 125 HB ILE 125 -4.360 -0.223 -6.507 939 1HG1 ILE 125 1HG1 ILE 125 -5.571 -2.549 -6.754 940 2HG1 ILE 125 2HG1 ILE 125 -5.731 -2.408 -5.004 941 1HG2 ILE 125 1HG2 ILE 125 -3.000 -2.780 -5.670 942 2HG2 ILE 125 2HG2 ILE 125 -3.368 -2.329 -7.338 943 3HG2 ILE 125 3HG2 ILE 125 -2.238 -1.359 -6.390 944 1HD1 ILE 125 1HD1 ILE 125 -6.715 -0.396 -7.015 945 2HD1 ILE 125 2HD1 ILE 125 -7.707 -1.587 -6.171 946 3HD1 ILE 125 3HD1 ILE 125 -6.909 -0.303 -5.264 947 H PHE 126 H PHE 126 -1.626 -1.216 -3.916 948 HA PHE 126 HA PHE 126 -0.619 1.458 -4.596 949 1HB PHE 126 1HB PHE 126 0.171 -0.128 -2.147 950 2HB PHE 126 2HB PHE 126 0.852 1.418 -2.631 951 HD1 PHE 126 HD1 PHE 126 -1.701 -0.220 -0.781 952 HD2 PHE 126 HD2 PHE 126 -0.738 3.416 -2.775 953 HE1 PHE 126 HE1 PHE 126 -3.441 0.944 0.511 954 HE2 PHE 126 HE2 PHE 126 -2.472 4.585 -1.481 955 HZ PHE 126 HZ PHE 126 -3.828 3.352 0.163 956 H LYS 127 H LYS 127 1.132 1.481 -5.824 957 HA LYS 127 HA LYS 127 2.568 -1.050 -6.267 958 1HB LYS 127 1HB LYS 127 2.207 1.397 -8.004 959 2HB LYS 127 2HB LYS 127 3.387 0.144 -8.365 960 1HG LYS 127 1HG LYS 127 0.449 -0.412 -8.049 961 2HG LYS 127 2HG LYS 127 1.203 -0.013 -9.594 962 1HD LYS 127 1HD LYS 127 2.699 -1.942 -9.358 963 2HD LYS 127 2HD LYS 127 1.923 -2.345 -7.815 964 1HE LYS 127 1HE LYS 127 0.558 -2.246 -10.506 965 2HE LYS 127 2HE LYS 127 1.060 -3.710 -9.664 966 1HZ LYS 127 1HZ LYS 127 -0.448 -3.125 -7.853 967 2HZ LYS 127 2HZ LYS 127 -0.951 -1.749 -8.699 968 3HZ LYS 127 3HZ LYS 127 -1.279 -3.289 -9.318 969 H ILE 128 H ILE 128 4.244 -1.081 -4.879 970 HA ILE 128 HA ILE 128 5.742 1.403 -4.441 971 HB ILE 128 HB ILE 128 5.953 -1.167 -2.875 972 1HG1 ILE 128 1HG1 ILE 128 4.370 1.326 -2.190 973 2HG1 ILE 128 2HG1 ILE 128 3.664 -0.185 -2.774 974 1HG2 ILE 128 1HG2 ILE 128 6.869 1.647 -2.281 975 2HG2 ILE 128 2HG2 ILE 128 6.995 0.276 -1.178 976 3HG2 ILE 128 3HG2 ILE 128 7.899 0.276 -2.694 977 1HD1 ILE 128 1HD1 ILE 128 5.214 0.154 -0.216 978 2HD1 ILE 128 2HD1 ILE 128 3.459 0.041 -0.359 979 3HD1 ILE 128 3HD1 ILE 128 4.469 -1.338 -0.794 980 H HIS 129 H HIS 129 7.534 1.697 -5.515 981 HA HIS 129 HA HIS 129 9.113 -0.659 -6.302 982 1HB HIS 129 1HB HIS 129 8.065 1.263 -7.973 983 2HB HIS 129 2HB HIS 129 9.701 1.851 -7.700 984 HD1 HIS 129 HD1 HIS 129 8.297 0.363 -10.311 985 HD2 HIS 129 HD2 HIS 129 11.241 -1.057 -7.750 986 HE1 HIS 129 HE1 HIS 129 9.488 -1.441 -11.594 987 HE2 HIS 129 HE2 HIS 129 11.112 -2.429 -9.938 988 H LEU 130 H LEU 130 10.542 -0.841 -4.672 989 HA LEU 130 HA LEU 130 11.717 1.463 -3.421 990 1HB LEU 130 1HB LEU 130 11.218 -1.056 -2.559 991 2HB LEU 130 2HB LEU 130 12.917 -1.193 -2.964 992 HG LEU 130 HG LEU 130 11.690 0.738 -1.018 993 1HD1 LEU 130 1HD1 LEU 130 13.451 -1.659 -0.643 994 2HD1 LEU 130 2HD1 LEU 130 13.073 -0.492 0.625 995 3HD1 LEU 130 3HD1 LEU 130 11.786 -1.456 -0.098 996 1HD2 LEU 130 1HD2 LEU 130 13.542 1.803 -2.181 997 2HD2 LEU 130 2HD2 LEU 130 13.949 1.468 -0.500 998 3HD2 LEU 130 3HD2 LEU 130 14.582 0.441 -1.781 999 H ILE 131 H ILE 131 13.447 2.521 -4.085 1000 HA ILE 131 HA ILE 131 15.118 1.334 -6.161 1001 HB ILE 131 HB ILE 131 15.140 4.141 -5.044 1002 1HG1 ILE 131 1HG1 ILE 131 13.031 3.596 -6.197 1003 2HG1 ILE 131 2HG1 ILE 131 13.991 4.779 -7.118 1004 1HG2 ILE 131 1HG2 ILE 131 16.519 2.959 -7.450 1005 2HG2 ILE 131 2HG2 ILE 131 16.463 4.678 -7.055 1006 3HG2 ILE 131 3HG2 ILE 131 17.288 3.550 -5.977 1007 1HD1 ILE 131 1HD1 ILE 131 13.828 1.820 -7.690 1008 2HD1 ILE 131 2HD1 ILE 131 12.963 3.091 -8.556 1009 3HD1 ILE 131 3HD1 ILE 131 14.724 3.020 -8.623 1010 H SER 132 H SER 132 15.648 3.094 -3.085 1011 HA SER 132 HA SER 132 17.668 1.232 -2.277 1012 1HB SER 132 1HB SER 132 18.616 4.038 -2.886 1013 2HB SER 132 2HB SER 132 19.584 2.679 -2.316 1014 HG SER 132 HG SER 132 19.804 2.070 -4.301 1015 H VAL 133 H VAL 133 18.712 1.878 -0.211 1016 HA VAL 133 HA VAL 133 16.838 3.444 1.446 1017 HB VAL 133 HB VAL 133 16.968 1.189 2.241 1018 1HG1 VAL 133 1HG1 VAL 133 19.036 0.535 1.115 1019 2HG1 VAL 133 2HG1 VAL 133 19.968 1.517 2.246 1020 3HG1 VAL 133 3HG1 VAL 133 19.082 0.106 2.825 1021 1HG2 VAL 133 1HG2 VAL 133 17.549 3.359 3.804 1022 2HG2 VAL 133 2HG2 VAL 133 17.193 1.740 4.406 1023 3HG2 VAL 133 3HG2 VAL 133 18.864 2.253 4.198 1024 H LYS 134 H LYS 134 17.540 5.255 2.417 1025 HA LYS 134 HA LYS 134 18.918 7.103 2.582 1026 1HB LYS 134 1HB LYS 134 20.679 6.714 4.296 1027 2HB LYS 134 2HB LYS 134 19.101 6.106 4.757 1028 1HG LYS 134 1HG LYS 134 19.751 3.888 4.505 1029 2HG LYS 134 2HG LYS 134 21.168 4.320 3.517 1030 1HD LYS 134 1HD LYS 134 20.858 5.116 6.412 1031 2HD LYS 134 2HD LYS 134 21.635 3.613 5.908 1032 1HE LYS 134 1HE LYS 134 23.249 4.907 4.585 1033 2HE LYS 134 2HE LYS 134 22.481 6.402 5.118 1034 1HZ LYS 134 1HZ LYS 134 23.765 4.413 6.912 1035 2HZ LYS 134 2HZ LYS 134 24.472 5.864 6.407 1036 3HZ LYS 134 3HZ LYS 134 23.089 5.890 7.382 1037 H LYS 135 H LYS 135 19.382 6.427 0.140 1038 HA LYS 135 HA LYS 135 20.842 6.558 -1.581 1039 1HB LYS 135 1HB LYS 135 22.638 7.577 0.612 1040 2HB LYS 135 2HB LYS 135 23.091 7.581 -1.087 1041 1HG LYS 135 1HG LYS 135 20.735 9.036 0.104 1042 2HG LYS 135 2HG LYS 135 22.279 9.764 -0.337 1043 1HD LYS 135 1HD LYS 135 20.418 8.361 -2.255 1044 2HD LYS 135 2HD LYS 135 20.518 10.109 -2.042 1045 1HE LYS 135 1HE LYS 135 22.738 8.291 -2.983 1046 2HE LYS 135 2HE LYS 135 21.810 9.408 -3.983 1047 1HZ LYS 135 1HZ LYS 135 22.698 11.247 -2.688 1048 2HZ LYS 135 2HZ LYS 135 23.589 10.173 -1.731 1049 3HZ LYS 135 3HZ LYS 135 23.951 10.339 -3.375 1050 H SER 136 H SER 136 20.490 4.070 -0.488 1051 HA SER 136 HA SER 136 21.358 1.972 -0.364 1052 1HB SER 136 1HB SER 136 21.838 2.443 -2.724 1053 2HB SER 136 2HB SER 136 23.384 3.162 -2.276 1054 HG SER 136 HG SER 136 23.885 1.111 -2.792 1055 H SER 137 H SER 137 21.937 2.946 1.905 1056 HA SER 137 HA SER 137 23.355 3.036 3.681 1057 1HB SER 137 1HB SER 137 24.845 1.004 2.002 1058 2HB SER 137 2HB SER 137 25.162 1.323 3.707 1059 HG SER 137 HG SER 137 22.834 0.238 2.527 No H/Q in entry = 1059 Start of MODEL 10 1 H1 PHE 1 HT3 PHE 1 -22.736 9.509 6.308 2 H2 PHE 1 HT2 PHE 1 -23.754 10.582 5.490 3 H3 PHE 1 HT1 PHE 1 -24.272 9.005 5.811 4 HA PHE 1 HA PHE 1 -23.663 9.191 3.515 5 1HB PHE 1 HB2 PHE 1 -20.943 9.984 4.581 6 2HB PHE 1 HB1 PHE 1 -21.349 9.725 2.887 7 HD1 PHE 1 HD1 PHE 1 -22.798 11.314 1.703 8 HD2 PHE 1 HD2 PHE 1 -21.521 12.001 5.705 9 HE1 PHE 1 HE1 PHE 1 -23.425 13.685 1.493 10 HE2 PHE 1 HE2 PHE 1 -22.148 14.371 5.502 11 HZ PHE 1 HZ PHE 1 -23.101 15.215 3.394 12 H ASN 2 HN ASN 2 -23.610 7.348 5.903 13 HA ASN 2 HA ASN 2 -21.468 5.525 5.591 14 1HB ASN 2 HB2 ASN 2 -22.839 3.985 6.938 15 2HB ASN 2 HB1 ASN 2 -22.811 5.607 7.640 16 H LYS 3 HN LYS 3 -24.296 6.070 3.740 17 HA LYS 3 HA LYS 3 -24.755 3.510 2.704 18 1HB LYS 3 HB2 LYS 3 -25.745 4.683 0.754 19 2HB LYS 3 HB1 LYS 3 -26.320 5.316 2.289 20 1HG LYS 3 HG2 LYS 3 -24.792 7.201 2.101 21 2HG LYS 3 HG1 LYS 3 -24.182 6.561 0.573 22 1HD LYS 3 HD2 LYS 3 -26.425 6.771 -0.398 23 2HD LYS 3 HD1 LYS 3 -27.016 7.434 1.127 24 1HE LYS 3 HE2 LYS 3 -26.549 9.203 -0.493 25 2HE LYS 3 HE1 LYS 3 -25.492 9.321 0.913 26 1HZ LYS 3 HZ2 LYS 3 -24.729 8.088 -1.678 27 2HZ LYS 3 HZ1 LYS 3 -24.311 9.654 -1.193 28 3HZ LYS 3 HZ3 LYS 3 -23.719 8.317 -0.341 29 H LYS 4 HN LYS 4 -22.505 6.053 1.764 30 HA LYS 4 HA LYS 4 -21.453 4.551 -0.461 31 1HB LYS 4 HB2 LYS 4 -21.496 7.011 -0.514 32 2HB LYS 4 HB1 LYS 4 -20.421 7.062 0.877 33 1HG LYS 4 HG2 LYS 4 -18.682 5.938 -0.448 34 2HG LYS 4 HG1 LYS 4 -19.759 5.956 -1.845 35 1HD LYS 4 HD2 LYS 4 -19.810 8.404 -1.771 36 2HD LYS 4 HD1 LYS 4 -18.735 8.385 -0.372 37 1HE LYS 4 HE2 LYS 4 -18.080 7.319 -3.120 38 2HE LYS 4 HE1 LYS 4 -17.512 8.848 -2.446 39 1HZ LYS 4 HZ2 LYS 4 -16.916 6.157 -1.338 40 2HZ LYS 4 HZ1 LYS 4 -15.850 7.094 -2.257 41 3HZ LYS 4 HZ3 LYS 4 -16.345 7.628 -0.730 42 H ALA 5 HN ALA 5 -20.592 5.224 2.866 43 HA ALA 5 HA ALA 5 -17.972 4.311 2.935 44 1HB ALA 5 HB1 ALA 5 -18.960 5.430 4.829 45 2HB ALA 5 HB2 ALA 5 -18.393 3.837 5.330 46 3HB ALA 5 HB3 ALA 5 -20.112 4.112 5.051 47 H ASP 6 HN ASP 6 -20.969 2.504 3.568 48 HA ASP 6 HA ASP 6 -19.688 -0.012 3.780 49 1HB ASP 6 HB2 ASP 6 -22.572 0.706 3.213 50 2HB ASP 6 HB1 ASP 6 -22.009 -0.938 3.498 51 H GLU 7 HN GLU 7 -21.128 1.763 1.095 52 HA GLU 7 HA GLU 7 -21.166 -0.280 -0.804 53 1HB GLU 7 HB2 GLU 7 -20.873 2.693 -0.960 54 2HB GLU 7 HB1 GLU 7 -20.577 1.742 -2.409 55 1HG GLU 7 HG2 GLU 7 -23.111 1.672 -0.787 56 2HG GLU 7 HG1 GLU 7 -22.877 2.595 -2.272 57 H ASN 8 HN ASN 8 -18.552 1.644 0.467 58 HA ASN 8 HA ASN 8 -16.599 0.837 -1.437 59 1HB ASN 8 HB2 ASN 8 -16.067 1.813 1.374 60 2HB ASN 8 HB1 ASN 8 -14.994 1.928 -0.046 61 H LYS 9 HN LYS 9 -17.583 -0.280 1.752 62 HA LYS 9 HA LYS 9 -15.530 -2.122 2.199 63 1HB LYS 9 HB2 LYS 9 -17.280 -1.356 3.846 64 2HB LYS 9 HB1 LYS 9 -18.408 -2.450 3.061 65 1HG LYS 9 HG2 LYS 9 -15.830 -3.574 4.004 66 2HG LYS 9 HG1 LYS 9 -17.040 -3.142 5.214 67 1HD LYS 9 HD2 LYS 9 -18.685 -4.545 4.037 68 2HD LYS 9 HD1 LYS 9 -17.445 -5.001 2.868 69 1HE LYS 9 HE2 LYS 9 -17.390 -5.548 5.835 70 2HE LYS 9 HE1 LYS 9 -17.720 -6.727 4.566 71 1HZ LYS 9 HZ1 LYS 9 -15.485 -6.363 3.708 72 2HZ LYS 9 HZ3 LYS 9 -15.172 -5.245 4.938 73 3HZ LYS 9 HZ2 LYS 9 -15.436 -6.871 5.321 74 H VAL 10 HN VAL 10 -18.410 -2.369 0.205 75 HA VAL 10 HA VAL 10 -18.222 -5.218 -0.132 76 HB VAL 10 HB VAL 10 -19.710 -3.324 -1.927 77 H LYS 11 HN LYS 11 -17.632 -2.442 -2.323 78 HA LYS 11 HA LYS 11 -16.603 -4.062 -4.404 79 1HB LYS 11 HB2 LYS 11 -15.731 -1.937 -5.353 80 2HB LYS 11 HB1 LYS 11 -17.437 -1.874 -4.939 81 1HG LYS 11 HG2 LYS 11 -16.866 -0.679 -2.866 82 2HG LYS 11 HG1 LYS 11 -15.167 -0.702 -3.346 83 1HD LYS 11 HD2 LYS 11 -15.742 0.550 -5.383 84 2HD LYS 11 HD1 LYS 11 -17.428 0.598 -4.868 85 1HE LYS 11 HE2 LYS 11 -16.806 1.874 -2.894 86 2HE LYS 11 HE1 LYS 11 -15.105 1.786 -3.355 87 1HZ LYS 11 HZ2 LYS 11 -15.637 3.035 -5.364 88 2HZ LYS 11 HZ1 LYS 11 -17.258 3.137 -4.894 89 3HZ LYS 11 HZ3 LYS 11 -16.059 3.905 -3.978 90 H GLY 12 HN GLY 12 -15.209 -2.689 -1.554 91 1HA GLY 12 HA1 GLY 12 -13.042 -2.660 -0.745 92 2HA GLY 12 HA2 GLY 12 -12.475 -3.002 -2.376 93 H GLU 13 HN GLU 13 -14.696 -4.806 -0.290 94 HA GLU 13 HA GLU 13 -12.837 -6.819 0.422 95 1HB GLU 13 HB2 GLU 13 -14.823 -6.377 1.768 96 2HB GLU 13 HB1 GLU 13 -15.859 -6.850 0.430 97 1HG GLU 13 HG2 GLU 13 -15.744 -8.620 2.057 98 2HG GLU 13 HG1 GLU 13 -14.967 -9.130 0.558 99 H ALA 14 HN ALA 14 -15.118 -6.441 -2.214 100 HA ALA 14 HA ALA 14 -14.927 -9.133 -3.143 101 1HB ALA 14 HB2 ALA 14 -16.844 -7.642 -3.635 102 2HB ALA 14 HB3 ALA 14 -16.149 -8.398 -5.070 103 3HB ALA 14 HB1 ALA 14 -15.796 -6.708 -4.703 104 H PHE 15 HN PHE 15 -13.347 -6.090 -4.061 105 HA PHE 15 HA PHE 15 -11.945 -7.040 -6.284 106 1HB PHE 15 HB2 PHE 15 -11.783 -4.752 -6.160 107 2HB PHE 15 HB1 PHE 15 -11.607 -4.757 -4.392 108 HD1 PHE 15 HD1 PHE 15 -9.604 -3.997 -3.619 109 HD2 PHE 15 HD2 PHE 15 -9.687 -6.037 -7.352 110 HE1 PHE 15 HE1 PHE 15 -7.173 -3.674 -3.842 111 HE2 PHE 15 HE2 PHE 15 -7.256 -5.729 -7.579 112 HZ PHE 15 HZ PHE 15 -5.993 -4.550 -5.818 113 H LEU 16 HN LEU 16 -10.782 -6.707 -2.924 114 HA LEU 16 HA LEU 16 -8.322 -7.972 -3.341 115 1HB LEU 16 HB2 LEU 16 -8.159 -8.126 -0.941 116 2HB LEU 16 HB1 LEU 16 -8.866 -6.588 -1.382 117 HG LEU 16 HG LEU 16 -11.137 -7.891 -0.956 118 H THR 17 HN THR 17 -11.510 -9.248 -2.675 119 HA THR 17 HA THR 17 -10.855 -11.867 -1.959 120 HB THR 17 HB THR 17 -13.258 -10.655 -3.301 121 HG1 THR 17 HG1 THR 17 -13.340 -12.131 -0.927 122 H GLU 18 HN GLU 18 -11.491 -10.469 -5.163 123 HA GLU 18 HA GLU 18 -10.883 -12.889 -6.562 124 1HB GLU 18 HB2 GLU 18 -12.382 -11.156 -7.494 125 2HB GLU 18 HB1 GLU 18 -11.019 -10.049 -7.597 126 1HG GLU 18 HG2 GLU 18 -9.939 -11.441 -9.227 127 2HG GLU 18 HG1 GLU 18 -11.178 -12.682 -9.044 128 H ASN 19 HN ASN 19 -9.131 -10.076 -5.521 129 HA ASN 19 HA ASN 19 -6.845 -10.165 -7.075 130 1HB ASN 19 HB2 ASN 19 -6.910 -8.310 -5.706 131 2HB ASN 19 HB1 ASN 19 -7.457 -9.230 -4.306 132 H LYS 20 HN LYS 20 -7.767 -12.150 -4.355 133 HA LYS 20 HA LYS 20 -5.470 -13.292 -3.482 134 1HB LYS 20 HB2 LYS 20 -8.001 -14.814 -4.106 135 2HB LYS 20 HB1 LYS 20 -6.751 -15.304 -2.973 136 1HG LYS 20 HG2 LYS 20 -8.416 -12.810 -2.706 137 2HG LYS 20 HG1 LYS 20 -8.752 -14.339 -1.893 138 1HD LYS 20 HD2 LYS 20 -6.529 -14.204 -0.811 139 2HD LYS 20 HD1 LYS 20 -6.290 -12.624 -1.562 140 1HE LYS 20 HE2 LYS 20 -7.058 -12.381 0.740 141 2HE LYS 20 HE1 LYS 20 -8.263 -11.769 -0.393 142 1HZ LYS 20 HZ1 LYS 20 -8.336 -14.437 0.912 143 2HZ LYS 20 HZ3 LYS 20 -9.265 -13.098 1.367 144 3HZ LYS 20 HZ2 LYS 20 -9.502 -13.819 -0.144 145 H ASN 21 HN ASN 21 -6.714 -13.580 -6.672 146 HA ASN 21 HA ASN 21 -5.561 -16.066 -7.380 147 1HB ASN 21 HB2 ASN 21 -6.444 -13.715 -9.051 148 2HB ASN 21 HB1 ASN 21 -5.891 -15.242 -9.735 149 H LYS 22 HN LYS 22 -4.327 -12.779 -7.373 150 HA LYS 22 HA LYS 22 -2.123 -13.025 -9.029 151 1HB LYS 22 HB2 LYS 22 -2.385 -11.433 -6.476 152 2HB LYS 22 HB1 LYS 22 -1.122 -11.205 -7.680 153 1HG LYS 22 HG2 LYS 22 -2.784 -10.577 -9.337 154 2HG LYS 22 HG1 LYS 22 -4.074 -10.858 -8.166 155 1HD LYS 22 HD2 LYS 22 -3.148 -9.096 -6.737 156 2HD LYS 22 HD1 LYS 22 -1.873 -8.807 -7.924 157 1HE LYS 22 HE2 LYS 22 -4.839 -8.452 -8.348 158 2HE LYS 22 HE1 LYS 22 -3.647 -7.166 -8.168 159 1HZ LYS 22 HZ1 LYS 22 -2.580 -7.934 -10.205 160 2HZ LYS 22 HZ3 LYS 22 -3.748 -9.145 -10.380 161 3HZ LYS 22 HZ2 LYS 22 -4.196 -7.518 -10.483 162 HA PRO 23 HA PRO 23 0.181 -16.243 -6.909 163 1HB PRO 23 HB2 PRO 23 2.361 -15.249 -8.659 164 2HB PRO 23 HB1 PRO 23 1.731 -16.890 -8.463 165 1HG PRO 23 HG2 PRO 23 1.184 -15.458 -10.649 166 2HG PRO 23 HG1 PRO 23 -0.031 -16.530 -9.924 167 1HD PRO 23 HD2 PRO 23 0.207 -13.553 -9.775 168 2HD PRO 23 HD1 PRO 23 -1.247 -14.564 -9.918 169 H GLY 24 HN GLY 24 1.566 -16.265 -5.203 170 1HA GLY 24 HA1 GLY 24 3.403 -14.056 -4.774 171 2HA GLY 24 HA2 GLY 24 3.287 -15.519 -3.811 172 H VAL 25 HN VAL 25 0.192 -14.371 -4.152 173 HA VAL 25 HA VAL 25 0.127 -12.213 -2.358 174 HB VAL 25 HB VAL 25 -1.798 -12.610 -3.726 175 H VAL 26 HN VAL 26 0.875 -12.239 -0.369 176 HA VAL 26 HA VAL 26 0.185 -14.515 1.366 177 HB VAL 26 HB VAL 26 2.540 -14.699 0.727 178 H VAL 27 HN VAL 27 -0.726 -13.975 3.252 179 HA VAL 27 HA VAL 27 -1.110 -11.182 3.875 180 HB VAL 27 HB VAL 27 -2.978 -12.743 4.149 181 H LEU 28 HN LEU 28 -0.247 -10.051 5.554 182 HA LEU 28 HA LEU 28 2.033 -11.281 6.909 183 1HB LEU 28 HB2 LEU 28 1.191 -8.390 6.659 184 2HB LEU 28 HB1 LEU 28 2.623 -8.933 7.507 185 HG LEU 28 HG LEU 28 2.089 -9.101 4.545 186 HA PRO 29 HA PRO 29 0.429 -11.481 11.023 187 1HB PRO 29 HB2 PRO 29 2.227 -9.238 11.833 188 2HB PRO 29 HB1 PRO 29 2.000 -10.822 12.582 189 1HG PRO 29 HG2 PRO 29 4.158 -10.323 11.109 190 2HG PRO 29 HG1 PRO 29 3.347 -11.898 11.026 191 1HD PRO 29 HD2 PRO 29 3.313 -9.636 9.080 192 2HD PRO 29 HD1 PRO 29 3.254 -11.394 8.783 193 H SER 30 HN SER 30 0.799 -8.250 9.663 194 HA SER 30 HA SER 30 -1.261 -7.175 11.407 195 1HB SER 30 HB2 SER 30 0.534 -5.943 9.329 196 2HB SER 30 HB1 SER 30 -0.801 -5.046 10.057 197 HG SER 30 HG SER 30 1.427 -6.207 11.377 198 H GLY 31 HN GLY 31 -1.177 -8.778 8.439 199 1HA GLY 31 HA1 GLY 31 -3.927 -7.863 7.922 200 2HA GLY 31 HA2 GLY 31 -3.286 -9.431 7.458 201 H LEU 32 HN LEU 32 -0.790 -7.782 6.575 202 HA LEU 32 HA LEU 32 -1.802 -6.341 4.275 203 1HB LEU 32 HB2 LEU 32 0.969 -6.970 5.279 204 2HB LEU 32 HB1 LEU 32 0.678 -6.118 3.777 205 HG LEU 32 HG LEU 32 1.229 -4.617 5.653 206 H GLN 33 HN GLN 33 -1.904 -7.028 2.236 207 HA GLN 33 HA GLN 33 -0.693 -9.625 1.551 208 1HB GLN 33 HB2 GLN 33 -3.351 -8.563 0.566 209 2HB GLN 33 HB1 GLN 33 -2.616 -10.092 0.104 210 1HG GLN 33 HG2 GLN 33 -2.755 -10.833 2.462 211 2HG GLN 33 HG1 GLN 33 -3.618 -9.317 2.841 212 H TYR 34 HN TYR 34 0.368 -9.715 -0.422 213 HA TYR 34 HA TYR 34 0.112 -7.469 -2.253 214 1HB TYR 34 HB2 TYR 34 2.584 -7.062 -2.229 215 2HB TYR 34 HB1 TYR 34 1.743 -6.575 -0.764 216 HD1 TYR 34 HD1 TYR 34 3.908 -9.214 -2.217 217 HD2 TYR 34 HD2 TYR 34 2.325 -7.491 1.337 218 HE1 TYR 34 HE1 TYR 34 5.450 -10.569 -0.879 219 HE2 TYR 34 HE2 TYR 34 3.865 -8.838 2.680 220 HH TYR 34 HH TYR 34 5.162 -10.886 2.509 221 H LYS 35 HN LYS 35 1.768 -7.692 -4.082 222 HA LYS 35 HA LYS 35 2.031 -10.539 -4.828 223 1HB LYS 35 HB2 LYS 35 0.292 -9.191 -6.094 224 2HB LYS 35 HB1 LYS 35 1.614 -8.222 -6.729 225 1HG LYS 35 HG2 LYS 35 2.590 -10.363 -7.644 226 2HG LYS 35 HG1 LYS 35 1.060 -11.142 -7.208 227 1HD LYS 35 HD2 LYS 35 0.970 -10.502 -9.525 228 2HD LYS 35 HD1 LYS 35 -0.127 -9.468 -8.607 229 1HE LYS 35 HE2 LYS 35 1.567 -7.698 -8.584 230 2HE LYS 35 HE1 LYS 35 2.661 -8.732 -9.502 231 1HZ LYS 35 HZ2 LYS 35 0.009 -7.783 -10.448 232 2HZ LYS 35 HZ1 LYS 35 1.500 -7.133 -10.913 233 3HZ LYS 35 HZ3 LYS 35 1.103 -8.724 -11.331 234 H VAL 36 HN VAL 36 4.073 -11.139 -4.932 235 HA VAL 36 HA VAL 36 6.235 -9.290 -4.808 236 HB VAL 36 HB VAL 36 6.375 -12.262 -5.296 237 H ILE 37 HN ILE 37 7.373 -8.386 -6.343 238 HA ILE 37 HA ILE 37 7.157 -9.408 -9.095 239 HB ILE 37 HB ILE 37 7.991 -6.659 -8.150 240 H ASN 38 HN ASN 38 9.563 -7.541 -7.217 241 HA ASN 38 HA ASN 38 11.614 -9.524 -7.876 242 1HB ASN 38 HB2 ASN 38 11.785 -7.860 -9.656 243 2HB ASN 38 HB1 ASN 38 11.856 -6.563 -8.468 244 H SER 39 HN SER 39 11.425 -10.030 -5.627 245 HA SER 39 HA SER 39 12.369 -7.950 -3.776 246 1HB SER 39 HB2 SER 39 11.007 -10.567 -3.127 247 2HB SER 39 HB1 SER 39 11.374 -9.262 -1.998 248 HG SER 39 HG SER 39 9.985 -8.336 -4.116 249 H GLY 40 HN GLY 40 14.048 -8.299 -2.349 250 1HA GLY 40 HA1 GLY 40 15.486 -10.838 -2.445 251 2HA GLY 40 HA2 GLY 40 15.762 -9.529 -1.308 252 H ASN 41 HN ASN 41 16.969 -7.661 -2.027 253 HA ASN 41 HA ASN 41 19.035 -8.437 -3.909 254 1HB ASN 41 HB2 ASN 41 17.701 -5.772 -4.349 255 2HB ASN 41 HB1 ASN 41 18.812 -6.631 -5.405 256 H GLY 42 HN GLY 42 18.021 -5.308 -2.510 257 1HA GLY 42 HA1 GLY 42 19.482 -3.684 -1.647 258 2HA GLY 42 HA2 GLY 42 20.754 -4.890 -1.592 259 H VAL 43 HN VAL 43 21.005 -3.668 0.466 260 HA VAL 43 HA VAL 43 19.828 -5.188 2.653 261 HB VAL 43 HB VAL 43 21.859 -3.028 3.065 262 H LYS 44 HN LYS 44 19.513 -3.723 4.750 263 HA LYS 44 HA LYS 44 18.778 -1.092 4.779 264 1HB LYS 44 HB2 LYS 44 16.279 -1.204 4.485 265 2HB LYS 44 HB1 LYS 44 17.210 -1.364 3.006 266 1HG LYS 44 HG2 LYS 44 15.645 -3.009 2.725 267 2HG LYS 44 HG1 LYS 44 16.957 -3.924 3.466 268 1HD LYS 44 HD2 LYS 44 15.869 -3.684 5.657 269 2HD LYS 44 HD1 LYS 44 14.551 -2.792 4.896 270 1HE LYS 44 HE2 LYS 44 13.935 -5.122 5.259 271 2HE LYS 44 HE1 LYS 44 14.008 -4.747 3.538 272 1HZ LYS 44 HZ2 LYS 44 16.201 -5.768 3.450 273 2HZ LYS 44 HZ1 LYS 44 16.121 -6.134 5.099 274 3HZ LYS 44 HZ3 LYS 44 15.048 -6.868 4.017 275 HA PRO 45 HA PRO 45 17.688 -2.183 8.911 276 1HB PRO 45 HB2 PRO 45 16.476 0.349 9.404 277 2HB PRO 45 HB1 PRO 45 18.134 -0.142 9.748 278 1HG PRO 45 HG2 PRO 45 17.387 1.755 7.872 279 2HG PRO 45 HG1 PRO 45 18.937 0.899 7.899 280 1HD PRO 45 HD2 PRO 45 16.511 0.375 6.240 281 2HD PRO 45 HD1 PRO 45 18.226 0.247 5.809 282 H GLY 46 HN GLY 46 15.930 -2.003 10.541 283 1HA GLY 46 HA1 GLY 46 13.852 -2.700 11.217 284 2HA GLY 46 HA2 GLY 46 13.554 -3.203 9.556 285 H LYS 47 HN LYS 47 11.449 -2.180 10.854 286 HA LYS 47 HA LYS 47 10.355 -0.319 9.234 287 1HB LYS 47 HB2 LYS 47 8.816 0.256 11.119 288 2HB LYS 47 HB1 LYS 47 9.003 -1.467 10.816 289 1HG LYS 47 HG2 LYS 47 10.431 -1.721 12.709 290 2HG LYS 47 HG1 LYS 47 10.526 0.026 12.939 291 1HD LYS 47 HD2 LYS 47 7.951 -1.527 13.103 292 2HD LYS 47 HD1 LYS 47 8.973 -1.198 14.502 293 1HE LYS 47 HE2 LYS 47 8.764 1.217 14.046 294 2HE LYS 47 HE1 LYS 47 7.679 0.850 12.705 295 1HZ LYS 47 HZ2 LYS 47 7.187 0.183 15.558 296 2HZ LYS 47 HZ1 LYS 47 6.455 1.443 14.700 297 3HZ LYS 47 HZ3 LYS 47 6.146 -0.165 14.271 298 H SER 48 HN SER 48 12.868 0.437 11.441 299 HA SER 48 HA SER 48 12.158 3.250 11.617 300 1HB SER 48 HB2 SER 48 14.653 1.782 12.523 301 2HB SER 48 HB1 SER 48 14.283 3.471 12.872 302 HG SER 48 HG SER 48 13.631 1.474 14.344 303 H ASP 49 HN ASP 49 13.101 1.500 9.173 304 HA ASP 49 HA ASP 49 15.425 2.818 8.152 305 1HB ASP 49 HB2 ASP 49 15.017 1.529 6.146 306 2HB ASP 49 HB1 ASP 49 14.787 0.502 7.558 307 H THR 50 HN THR 50 15.395 3.892 6.002 308 HA THR 50 HA THR 50 12.996 5.559 5.587 309 HB THR 50 HB THR 50 15.884 6.460 5.355 310 HG1 THR 50 HG1 THR 50 13.834 6.965 7.254 311 H VAL 51 HN VAL 51 12.197 5.267 3.577 312 HA VAL 51 HA VAL 51 14.076 4.317 1.519 313 HB VAL 51 HB VAL 51 12.418 2.876 0.599 314 H THR 52 HN THR 52 13.928 5.096 -0.502 315 HA THR 52 HA THR 52 11.943 7.224 -0.991 316 HB THR 52 HB THR 52 14.678 6.941 -2.269 317 HG1 THR 52 HG1 THR 52 13.871 8.106 0.087 318 H VAL 53 HN VAL 53 10.463 6.652 -2.473 319 HA VAL 53 HA VAL 53 11.261 4.946 -4.706 320 HB VAL 53 HB VAL 53 9.641 3.284 -4.367 321 H GLU 54 HN GLU 54 9.187 4.521 -6.094 322 HA GLU 54 HA GLU 54 7.575 6.983 -6.240 323 1HB GLU 54 HB2 GLU 54 8.802 5.481 -8.567 324 2HB GLU 54 HB1 GLU 54 7.661 6.808 -8.717 325 1HG GLU 54 HG2 GLU 54 9.727 7.788 -9.092 326 2HG GLU 54 HG1 GLU 54 9.368 8.187 -7.413 327 H TYR 55 HN TYR 55 5.402 6.615 -6.457 328 HA TYR 55 HA TYR 55 4.540 4.009 -7.429 329 1HB TYR 55 HB2 TYR 55 3.279 3.403 -5.537 330 2HB TYR 55 HB1 TYR 55 4.841 3.906 -4.907 331 HD1 TYR 55 HD1 TYR 55 4.986 6.404 -4.119 332 HD2 TYR 55 HD2 TYR 55 1.329 4.266 -4.597 333 HE1 TYR 55 HE1 TYR 55 3.865 7.997 -2.621 334 HE2 TYR 55 HE2 TYR 55 0.189 5.859 -3.100 335 HH TYR 55 HH TYR 55 1.590 8.812 -2.169 336 H THR 56 HN THR 56 2.308 3.839 -7.826 337 HA THR 56 HA THR 56 0.938 6.415 -8.241 338 HB THR 56 HB THR 56 0.728 3.953 -9.998 339 HG1 THR 56 HG1 THR 56 1.649 6.095 -11.297 340 H GLY 57 HN GLY 57 -0.722 6.518 -6.846 341 1HA GLY 57 HA1 GLY 57 -1.913 5.367 -5.051 342 2HA GLY 57 HA2 GLY 57 -1.994 3.959 -6.099 343 H ARG 58 HN ARG 58 -4.145 3.707 -6.098 344 HA ARG 58 HA ARG 58 -5.867 5.942 -6.773 345 1HB ARG 58 HB2 ARG 58 -5.541 5.391 -8.983 346 2HB ARG 58 HB1 ARG 58 -5.208 3.698 -8.622 347 1HG ARG 58 HG2 ARG 58 -7.970 4.684 -8.174 348 2HG ARG 58 HG1 ARG 58 -7.420 4.487 -9.843 349 1HD ARG 58 HD2 ARG 58 -7.442 2.381 -7.680 350 2HD ARG 58 HD1 ARG 58 -8.497 2.455 -9.092 351 HE ARG 58 HE ARG 58 -5.710 2.374 -9.767 352 H LEU 59 HN LEU 59 -7.990 5.638 -6.156 353 HA LEU 59 HA LEU 59 -8.453 3.670 -4.124 354 1HB LEU 59 HB2 LEU 59 -10.588 5.364 -5.386 355 2HB LEU 59 HB1 LEU 59 -10.495 4.771 -3.741 356 HG LEU 59 HG LEU 59 -8.428 6.711 -4.676 357 H ILE 60 HN ILE 60 -10.123 2.073 -4.112 358 HA ILE 60 HA ILE 60 -10.233 0.454 -6.379 359 HB ILE 60 HB ILE 60 -10.977 0.129 -3.790 360 H ASP 61 HN ASP 61 -11.758 3.368 -5.747 361 HA ASP 61 HA ASP 61 -14.207 2.993 -7.152 362 1HB ASP 61 HB2 ASP 61 -13.865 4.793 -5.491 363 2HB ASP 61 HB1 ASP 61 -12.706 5.557 -6.574 364 H GLY 62 HN GLY 62 -11.020 3.162 -8.207 365 1HA GLY 62 HA1 GLY 62 -11.924 3.457 -10.958 366 2HA GLY 62 HA2 GLY 62 -10.352 2.877 -10.439 367 H THR 63 HN THR 63 -10.826 5.618 -8.673 368 HA THR 63 HA THR 63 -9.749 7.348 -10.795 369 HB THR 63 HB THR 63 -10.581 9.260 -9.449 370 HG1 THR 63 HG1 THR 63 -11.937 8.859 -7.708 371 H VAL 64 HN VAL 64 -7.694 7.866 -10.587 372 HA VAL 64 HA VAL 64 -6.084 7.194 -8.406 373 HB VAL 64 HB VAL 64 -5.118 7.512 -10.606 374 H PHE 65 HN PHE 65 -5.605 8.229 -6.563 375 HA PHE 65 HA PHE 65 -6.941 10.782 -6.100 376 1HB PHE 65 HB2 PHE 65 -6.508 10.338 -3.683 377 2HB PHE 65 HB1 PHE 65 -7.498 9.113 -4.465 378 HD1 PHE 65 HD1 PHE 65 -4.148 8.593 -5.427 379 HD2 PHE 65 HD2 PHE 65 -6.820 8.056 -2.183 380 HE1 PHE 65 HE1 PHE 65 -2.660 6.896 -4.510 381 HE2 PHE 65 HE2 PHE 65 -5.348 6.321 -1.277 382 HZ PHE 65 HZ PHE 65 -3.242 5.751 -2.430 383 H ASP 66 HN ASP 66 -3.736 9.433 -6.336 384 HA ASP 66 HA ASP 66 -2.508 11.908 -6.648 385 1HB ASP 66 HB2 ASP 66 -2.916 12.232 -4.257 386 2HB ASP 66 HB1 ASP 66 -2.122 10.702 -3.897 387 H SER 67 HN SER 67 -0.645 11.573 -7.696 388 HA SER 67 HA SER 67 0.774 9.033 -7.264 389 1HB SER 67 HB2 SER 67 0.236 10.319 -9.946 390 2HB SER 67 HB1 SER 67 1.207 8.874 -9.683 391 HG SER 67 HG SER 67 -1.092 8.442 -8.500 392 H THR 68 HN THR 68 2.753 9.436 -6.563 393 HA THR 68 HA THR 68 3.938 12.036 -6.770 394 HB THR 68 HB THR 68 5.854 11.068 -5.570 395 HG1 THR 68 HG1 THR 68 4.584 8.592 -5.312 396 H GLU 69 HN GLU 69 4.238 9.023 -8.491 397 HA GLU 69 HA GLU 69 6.715 9.597 -9.765 398 1HB GLU 69 HB2 GLU 69 5.411 7.338 -9.490 399 2HB GLU 69 HB1 GLU 69 4.643 7.818 -10.997 400 1HG GLU 69 HG2 GLU 69 7.615 7.535 -10.592 401 2HG GLU 69 HG1 GLU 69 6.567 6.310 -11.308 402 H LYS 70 HN LYS 70 3.329 10.119 -10.622 403 HA LYS 70 HA LYS 70 3.855 11.062 -13.256 404 1HB LYS 70 HB2 LYS 70 1.445 11.467 -11.481 405 2HB LYS 70 HB1 LYS 70 1.517 11.868 -13.193 406 1HG LYS 70 HG2 LYS 70 2.097 9.421 -13.576 407 2HG LYS 70 HG1 LYS 70 1.587 9.160 -11.907 408 1HD LYS 70 HD2 LYS 70 -0.606 10.131 -12.444 409 2HD LYS 70 HD1 LYS 70 -0.087 10.344 -14.118 410 1HE LYS 70 HE2 LYS 70 -0.330 7.719 -12.651 411 2HE LYS 70 HE1 LYS 70 -1.444 8.330 -13.874 412 1HZ LYS 70 HZ3 LYS 70 0.389 8.288 -15.475 413 2HZ LYS 70 HZ2 LYS 70 1.414 7.641 -14.296 414 3HZ LYS 70 HZ1 LYS 70 0.083 6.751 -14.838 415 H THR 71 HN THR 71 3.472 12.611 -10.116 416 HA THR 71 HA THR 71 3.298 15.271 -10.928 417 HB THR 71 HB THR 71 4.708 14.254 -8.451 418 HG1 THR 71 HG1 THR 71 2.781 13.721 -7.777 419 H GLY 72 HN GLY 72 5.963 13.091 -10.985 420 1HA GLY 72 HA1 GLY 72 7.634 15.197 -12.139 421 2HA GLY 72 HA2 GLY 72 7.903 13.467 -12.281 422 H LYS 73 HN LYS 73 7.190 13.904 -9.126 423 HA LYS 73 HA LYS 73 10.032 14.222 -8.433 424 1HB LYS 73 HB2 LYS 73 8.972 16.235 -7.736 425 2HB LYS 73 HB1 LYS 73 7.633 15.362 -7.007 426 1HG LYS 73 HG2 LYS 73 9.158 14.453 -5.319 427 2HG LYS 73 HG1 LYS 73 10.491 15.346 -6.051 428 1HD LYS 73 HD2 LYS 73 8.015 16.768 -5.141 429 2HD LYS 73 HD1 LYS 73 9.284 16.347 -3.991 430 1HE LYS 73 HE2 LYS 73 9.655 18.591 -4.752 431 2HE LYS 73 HE1 LYS 73 10.911 17.554 -5.425 432 1HZ LYS 73 HZ3 LYS 73 8.466 18.354 -6.902 433 2HZ LYS 73 HZ2 LYS 73 9.945 19.164 -7.023 434 3HZ LYS 73 HZ1 LYS 73 9.820 17.553 -7.525 435 HA PRO 74 HA PRO 74 9.449 10.055 -6.866 436 1HB PRO 74 HB2 PRO 74 11.917 10.811 -5.385 437 2HB PRO 74 HB1 PRO 74 11.592 9.382 -6.371 438 1HG PRO 74 HG2 PRO 74 13.136 11.368 -7.275 439 2HG PRO 74 HG1 PRO 74 12.045 10.478 -8.352 440 1HD PRO 74 HD2 PRO 74 11.775 13.224 -7.228 441 2HD PRO 74 HD1 PRO 74 11.221 12.574 -8.784 442 H ALA 75 HN ALA 75 8.795 9.136 -4.918 443 HA ALA 75 HA ALA 75 8.095 11.052 -2.834 444 1HB ALA 75 HB1 ALA 75 7.247 8.181 -2.956 445 2HB ALA 75 HB3 ALA 75 6.490 9.505 -2.077 446 3HB ALA 75 HB2 ALA 75 6.414 9.454 -3.838 447 H THR 76 HN THR 76 9.207 11.188 -0.972 448 HA THR 76 HA THR 76 10.885 8.891 -0.186 449 HB THR 76 HB THR 76 12.437 10.508 -0.917 450 HG1 THR 76 HG1 THR 76 12.886 9.641 1.187 451 H PHE 77 HN PHE 77 10.120 8.013 1.603 452 HA PHE 77 HA PHE 77 9.611 9.621 3.941 453 1HB PHE 77 HB2 PHE 77 7.303 8.818 4.269 454 2HB PHE 77 HB1 PHE 77 7.447 9.785 2.803 455 HD1 PHE 77 HD1 PHE 77 7.558 8.632 0.589 456 HD2 PHE 77 HD2 PHE 77 6.576 6.577 4.188 457 HE1 PHE 77 HE1 PHE 77 6.596 6.791 -0.729 458 HE2 PHE 77 HE2 PHE 77 5.614 4.733 2.875 459 HZ PHE 77 HZ PHE 77 5.624 4.839 0.414 460 H GLN 78 HN GLN 78 9.414 8.359 5.871 461 HA GLN 78 HA GLN 78 10.715 5.785 5.660 462 1HB GLN 78 HB2 GLN 78 10.662 5.834 8.147 463 2HB GLN 78 HB1 GLN 78 11.502 7.187 7.417 464 1HG GLN 78 HG2 GLN 78 10.035 8.692 8.204 465 2HG GLN 78 HG1 GLN 78 8.656 7.617 7.965 466 H VAL 79 HN VAL 79 9.897 3.883 6.492 467 HA VAL 79 HA VAL 79 7.196 3.390 5.784 468 HB VAL 79 HB VAL 79 7.630 1.123 6.135 469 H SER 80 HN SER 80 8.686 4.071 8.876 470 HA SER 80 HA SER 80 6.455 2.953 10.355 471 1HB SER 80 HB2 SER 80 8.710 2.771 11.283 472 2HB SER 80 HB1 SER 80 8.841 4.526 11.337 473 HG SER 80 HG SER 80 8.222 3.636 13.356 474 H GLN 81 HN GLN 81 6.829 5.771 8.681 475 HA GLN 81 HA GLN 81 5.415 7.435 10.626 476 1HB GLN 81 HB2 GLN 81 7.378 8.279 9.269 477 2HB GLN 81 HB1 GLN 81 6.320 8.238 7.866 478 1HG GLN 81 HG2 GLN 81 4.858 9.867 8.857 479 2HG GLN 81 HG1 GLN 81 5.775 9.828 10.363 480 H VAL 82 HN VAL 82 4.398 5.153 8.580 481 HA VAL 82 HA VAL 82 2.047 6.709 7.718 482 HB VAL 82 HB VAL 82 1.726 4.701 6.106 483 H ILE 83 HN ILE 83 0.236 4.837 7.136 484 HA ILE 83 HA ILE 83 -0.952 4.226 9.566 485 HB ILE 83 HB ILE 83 -2.513 2.819 8.296 486 HA PRO 84 HA PRO 84 0.617 0.506 11.292 487 1HB PRO 84 HB2 PRO 84 -2.113 -0.658 10.980 488 2HB PRO 84 HB1 PRO 84 -1.074 -0.591 12.410 489 1HG PRO 84 HG2 PRO 84 -3.132 1.065 12.182 490 2HG PRO 84 HG1 PRO 84 -1.587 1.639 12.837 491 1HD PRO 84 HD2 PRO 84 -2.785 2.082 10.138 492 2HD PRO 84 HD1 PRO 84 -1.822 3.185 11.143 493 H GLY 85 HN GLY 85 -1.730 -0.212 8.700 494 1HA GLY 85 HA1 GLY 85 -1.633 -1.685 6.948 495 2HA GLY 85 HA2 GLY 85 -0.710 -2.726 8.017 496 H TRP 86 HN TRP 86 0.027 0.451 6.580 497 HA TRP 86 HA TRP 86 1.794 -0.528 4.623 498 1HB TRP 86 HB2 TRP 86 0.920 2.062 5.594 499 2HB TRP 86 HB1 TRP 86 2.626 2.070 5.166 500 HD1 TRP 86 HD1 TRP 86 0.000 0.013 3.235 501 HE1 TRP 86 HE1 TRP 86 -0.108 0.914 0.823 502 HE3 TRP 86 HE3 TRP 86 3.062 4.077 3.740 503 HZ2 TRP 86 HZ2 TRP 86 0.952 3.062 -0.659 504 HZ3 TRP 86 HZ3 TRP 86 3.456 5.506 1.777 505 HH2 TRP 86 HH2 TRP 86 2.423 5.008 -0.377 506 H THR 87 HN THR 87 2.456 0.770 7.879 507 HA THR 87 HA THR 87 5.248 0.779 7.657 508 HB THR 87 HB THR 87 4.127 1.936 9.481 509 HG1 THR 87 HG1 THR 87 5.960 -0.109 10.221 510 H GLU 88 HN GLU 88 3.036 -1.822 8.561 511 HA GLU 88 HA GLU 88 5.071 -3.603 9.446 512 1HB GLU 88 HB2 GLU 88 2.708 -3.807 10.127 513 2HB GLU 88 HB1 GLU 88 2.282 -4.243 8.477 514 1HG GLU 88 HG2 GLU 88 2.419 -6.218 9.851 515 2HG GLU 88 HG1 GLU 88 3.703 -6.227 8.640 516 H ALA 89 HN ALA 89 3.435 -3.142 6.339 517 HA ALA 89 HA ALA 89 4.683 -5.412 5.112 518 1HB ALA 89 HB3 ALA 89 2.567 -4.743 4.263 519 2HB ALA 89 HB1 ALA 89 3.758 -4.421 3.000 520 3HB ALA 89 HB2 ALA 89 3.132 -3.094 3.982 521 H LEU 90 HN LEU 90 5.105 -1.899 4.746 522 HA LEU 90 HA LEU 90 7.171 -1.940 2.889 523 1HB LEU 90 HB2 LEU 90 6.202 0.030 4.894 524 2HB LEU 90 HB1 LEU 90 7.745 0.327 4.124 525 HG LEU 90 HG LEU 90 5.908 1.508 3.006 526 H GLN 91 HN GLN 91 7.345 -2.258 6.402 527 HA GLN 91 HA GLN 91 10.127 -1.817 6.626 528 1HB GLN 91 HB2 GLN 91 9.967 -2.763 8.838 529 2HB GLN 91 HB1 GLN 91 8.564 -1.733 8.544 530 1HG GLN 91 HG2 GLN 91 7.168 -3.640 8.190 531 2HG GLN 91 HG1 GLN 91 8.551 -4.729 8.254 532 H LEU 92 HN LEU 92 8.556 -4.261 5.043 533 HA LEU 92 HA LEU 92 10.707 -6.199 5.566 534 1HB LEU 92 HB2 LEU 92 8.010 -6.639 4.282 535 2HB LEU 92 HB1 LEU 92 9.215 -7.878 4.577 536 HG LEU 92 HG LEU 92 7.813 -6.292 6.731 537 H MET 93 HN MET 93 9.749 -3.887 3.363 538 HA MET 93 HA MET 93 10.516 -5.235 0.947 539 1HB MET 93 HB2 MET 93 8.903 -3.209 1.263 540 2HB MET 93 HB1 MET 93 10.381 -2.249 1.208 541 1HG MET 93 HG2 MET 93 10.905 -3.158 -0.984 542 2HG MET 93 HG1 MET 93 9.446 -4.146 -0.933 543 1HE MET 93 HE1 MET 93 10.136 -2.204 -3.343 544 2HE MET 93 HE3 MET 93 8.662 -3.169 -3.275 545 3HE MET 93 HE2 MET 93 8.570 -1.444 -3.628 546 HA PRO 94 HA PRO 94 14.881 -4.406 1.772 547 1HB PRO 94 HB2 PRO 94 15.473 -6.089 -0.505 548 2HB PRO 94 HB1 PRO 94 15.749 -6.417 1.209 549 1HG PRO 94 HG2 PRO 94 13.922 -7.758 -0.323 550 2HG PRO 94 HG1 PRO 94 13.783 -7.559 1.434 551 1HD PRO 94 HD2 PRO 94 12.415 -6.052 -0.771 552 2HD PRO 94 HD1 PRO 94 11.762 -6.623 0.807 553 H ALA 95 HN ALA 95 16.309 -2.980 0.885 554 HA ALA 95 HA ALA 95 15.549 -1.146 -1.018 555 1HB ALA 95 HB1 ALA 95 18.350 -1.995 -0.301 556 2HB ALA 95 HB2 ALA 95 17.387 -0.761 0.511 557 3HB ALA 95 HB3 ALA 95 17.920 -0.512 -1.151 558 H GLY 96 HN GLY 96 15.401 -1.117 -3.181 559 1HA GLY 96 HA1 GLY 96 17.092 -2.888 -4.769 560 2HA GLY 96 HA2 GLY 96 16.115 -1.564 -5.379 561 H SER 97 HN SER 97 14.100 -3.186 -3.372 562 HA SER 97 HA SER 97 13.383 -5.281 -5.270 563 1HB SER 97 HB2 SER 97 12.146 -4.652 -2.581 564 2HB SER 97 HB1 SER 97 11.871 -6.097 -3.553 565 HG SER 97 HG SER 97 14.496 -5.436 -2.842 566 H THR 98 HN THR 98 10.824 -5.609 -5.265 567 HA THR 98 HA THR 98 9.435 -3.089 -5.754 568 HB THR 98 HB THR 98 9.341 -5.255 -7.845 569 HG1 THR 98 HG1 THR 98 11.370 -4.653 -8.193 570 H TRP 99 HN TRP 99 7.524 -3.228 -4.756 571 HA TRP 99 HA TRP 99 6.169 -5.836 -4.664 572 1HB TRP 99 HB2 TRP 99 6.967 -4.073 -2.416 573 2HB TRP 99 HB1 TRP 99 5.365 -4.791 -2.320 574 HD1 TRP 99 HD1 TRP 99 7.131 -7.400 -3.989 575 HE1 TRP 99 HE1 TRP 99 8.108 -9.124 -2.350 576 HE3 TRP 99 HE3 TRP 99 6.814 -4.686 0.330 577 HZ2 TRP 99 HZ2 TRP 99 8.670 -9.315 0.405 578 HZ3 TRP 99 HZ3 TRP 99 7.592 -5.716 2.428 579 HH2 TRP 99 HH2 TRP 99 8.501 -7.983 2.462 580 H GLU 100 HN GLU 100 3.949 -5.811 -4.566 581 HA GLU 100 HA GLU 100 2.626 -3.212 -5.004 582 1HB GLU 100 HB2 GLU 100 2.535 -4.369 -7.098 583 2HB GLU 100 HB1 GLU 100 2.140 -5.894 -6.317 584 1HG GLU 100 HG2 GLU 100 -0.053 -5.109 -5.761 585 2HG GLU 100 HG1 GLU 100 0.331 -3.490 -6.347 586 H ILE 101 HN ILE 101 1.626 -2.805 -3.106 587 HA ILE 101 HA ILE 101 0.420 -5.075 -1.687 588 HB ILE 101 HB ILE 101 0.494 -3.635 0.327 589 H TYR 102 HN TYR 102 -1.629 -5.102 -1.102 590 HA TYR 102 HA TYR 102 -3.319 -2.772 -1.720 591 1HB TYR 102 HB2 TYR 102 -5.039 -4.905 -1.873 592 2HB TYR 102 HB1 TYR 102 -4.276 -4.136 -3.260 593 HD1 TYR 102 HD1 TYR 102 -4.344 -7.087 -1.122 594 HD2 TYR 102 HD2 TYR 102 -2.359 -5.202 -4.374 595 HE1 TYR 102 HE1 TYR 102 -3.268 -9.221 -1.697 596 HE2 TYR 102 HE2 TYR 102 -1.275 -7.326 -4.957 597 HH TYR 102 HH TYR 102 -2.262 -10.294 -3.708 598 H VAL 103 HN VAL 103 -3.678 -1.928 0.241 599 HA VAL 103 HA VAL 103 -4.229 -3.746 2.491 600 HB VAL 103 HB VAL 103 -3.678 -0.811 2.780 601 HA PRO 104 HA PRO 104 -8.504 -2.183 1.730 602 1HB PRO 104 HB2 PRO 104 -9.476 -3.889 3.732 603 2HB PRO 104 HB1 PRO 104 -9.496 -4.211 1.997 604 1HG PRO 104 HG2 PRO 104 -7.609 -5.165 4.086 605 2HG PRO 104 HG1 PRO 104 -8.172 -5.983 2.618 606 1HD PRO 104 HD2 PRO 104 -5.711 -4.920 2.802 607 2HD PRO 104 HD1 PRO 104 -6.625 -4.913 1.276 608 H SER 105 HN SER 105 -9.735 -0.762 3.006 609 HA SER 105 HA SER 105 -8.486 0.797 4.871 610 1HB SER 105 HB2 SER 105 -11.354 0.256 4.261 611 2HB SER 105 HB1 SER 105 -10.958 1.225 5.688 612 HG SER 105 HG SER 105 -9.463 2.207 3.833 613 H GLY 106 HN GLY 106 -10.076 -2.257 5.448 614 1HA GLY 106 HA1 GLY 106 -10.241 -3.564 7.324 615 2HA GLY 106 HA2 GLY 106 -10.591 -2.072 8.177 616 H LEU 107 HN LEU 107 -7.539 -1.934 6.728 617 HA LEU 107 HA LEU 107 -6.256 -2.911 9.189 618 1HB LEU 107 HB2 LEU 107 -5.236 -2.725 6.369 619 2HB LEU 107 HB1 LEU 107 -4.178 -2.998 7.736 620 HG LEU 107 HG LEU 107 -4.597 -5.114 6.754 621 H ALA 108 HN ALA 108 -7.229 -0.100 7.899 622 HA ALA 108 HA ALA 108 -4.952 1.363 9.059 623 1HB ALA 108 HB2 ALA 108 -4.940 1.675 6.665 624 2HB ALA 108 HB3 ALA 108 -5.396 3.185 7.458 625 3HB ALA 108 HB1 ALA 108 -6.630 2.183 6.688 626 H TYR 109 HN TYR 109 -7.474 3.368 7.974 627 HA TYR 109 HA TYR 109 -8.701 3.441 10.647 628 1HB TYR 109 HB2 TYR 109 -7.866 5.852 9.021 629 2HB TYR 109 HB1 TYR 109 -8.674 5.890 10.586 630 HD1 TYR 109 HD1 TYR 109 -5.502 5.591 8.866 631 HD2 TYR 109 HD2 TYR 109 -7.463 5.048 12.609 632 HE1 TYR 109 HE1 TYR 109 -3.322 5.564 10.002 633 HE2 TYR 109 HE2 TYR 109 -5.286 5.021 13.750 634 HH TYR 109 HH TYR 109 -2.410 5.997 12.257 635 H GLY 110 HN GLY 110 -9.273 2.832 7.542 636 1HA GLY 110 HA1 GLY 110 -11.062 2.929 6.124 637 2HA GLY 110 HA2 GLY 110 -11.478 4.452 6.869 638 HA PRO 111 HA PRO 111 -14.149 0.561 8.340 639 1HB PRO 111 HB2 PRO 111 -13.314 -0.192 10.880 640 2HB PRO 111 HB1 PRO 111 -12.999 -1.089 9.392 641 1HG PRO 111 HG2 PRO 111 -11.237 0.822 10.864 642 2HG PRO 111 HG1 PRO 111 -10.815 -0.698 10.052 643 1HD PRO 111 HD2 PRO 111 -10.290 1.659 8.912 644 2HD PRO 111 HD1 PRO 111 -10.849 0.283 7.940 645 H ARG 112 HN ARG 112 -12.795 3.210 10.075 646 HA ARG 112 HA ARG 112 -15.162 3.465 11.775 647 1HB ARG 112 HB2 ARG 112 -12.586 5.046 11.684 648 2HB ARG 112 HB1 ARG 112 -13.911 5.367 12.795 649 1HG ARG 112 HG2 ARG 112 -13.643 3.107 13.730 650 2HG ARG 112 HG1 ARG 112 -12.271 2.847 12.651 651 1HD ARG 112 HD2 ARG 112 -11.093 4.713 13.690 652 2HD ARG 112 HD1 ARG 112 -12.470 5.001 14.753 653 HE ARG 112 HE ARG 112 -11.672 2.354 15.098 654 H SER 113 HN SER 113 -16.248 5.589 11.899 655 HA SER 113 HA SER 113 -17.074 6.462 9.347 656 1HB SER 113 HB2 SER 113 -18.373 8.169 10.557 657 2HB SER 113 HB1 SER 113 -18.542 6.584 11.313 658 HG SER 113 HG SER 113 -16.983 7.241 12.852 659 H VAL 114 HN VAL 114 -14.256 7.039 10.863 660 HA VAL 114 HA VAL 114 -13.921 9.722 9.692 661 HB VAL 114 HB VAL 114 -12.121 8.477 11.768 662 H GLY 115 HN GLY 115 -13.789 8.085 7.737 663 1HA GLY 115 HA1 GLY 115 -12.397 7.550 5.970 664 2HA GLY 115 HA2 GLY 115 -11.770 6.393 7.133 665 H GLY 116 HN GLY 116 -9.668 6.500 7.569 666 1HA GLY 116 HA1 GLY 116 -7.529 7.306 7.778 667 2HA GLY 116 HA2 GLY 116 -8.223 8.915 7.905 668 HA PRO 117 HA PRO 117 -5.852 9.537 4.119 669 1HB PRO 117 HB2 PRO 117 -4.269 7.020 4.055 670 2HB PRO 117 HB1 PRO 117 -3.724 8.694 3.916 671 1HG PRO 117 HG2 PRO 117 -3.325 7.295 6.157 672 2HG PRO 117 HG1 PRO 117 -3.714 9.024 6.206 673 1HD PRO 117 HD2 PRO 117 -5.446 6.667 6.798 674 2HD PRO 117 HD1 PRO 117 -5.429 8.286 7.548 675 H ILE 118 HN ILE 118 -6.722 6.132 4.458 676 HA ILE 118 HA ILE 118 -7.385 5.934 1.626 677 HB ILE 118 HB ILE 118 -7.369 3.870 3.833 678 H GLY 119 HN GLY 119 -9.439 5.879 0.833 679 1HA GLY 119 HA1 GLY 119 -11.754 5.847 0.804 680 2HA GLY 119 HA2 GLY 119 -11.554 7.091 2.028 681 HA PRO 120 HA PRO 120 -13.166 4.668 5.344 682 1HB PRO 120 HB2 PRO 120 -15.874 5.114 4.225 683 2HB PRO 120 HB1 PRO 120 -15.238 5.508 5.824 684 1HG PRO 120 HG2 PRO 120 -15.690 7.395 3.974 685 2HG PRO 120 HG1 PRO 120 -14.341 7.509 5.122 686 1HD PRO 120 HD2 PRO 120 -14.316 6.805 2.228 687 2HD PRO 120 HD1 PRO 120 -13.102 7.667 3.193 688 H ASN 121 HN ASN 121 -13.333 2.524 5.570 689 HA ASN 121 HA ASN 121 -13.464 0.309 4.958 690 1HB ASN 121 HB2 ASN 121 -16.160 1.125 3.872 691 2HB ASN 121 HB1 ASN 121 -15.704 -0.420 4.593 692 H GLU 122 HN GLU 122 -12.161 1.882 3.002 693 HA GLU 122 HA GLU 122 -13.072 0.636 0.495 694 1HB GLU 122 HB2 GLU 122 -13.019 3.172 0.695 695 2HB GLU 122 HB1 GLU 122 -11.266 3.021 0.736 696 1HG GLU 122 HG2 GLU 122 -11.247 2.037 -1.456 697 2HG GLU 122 HG1 GLU 122 -13.010 2.010 -1.497 698 H THR 123 HN THR 123 -11.615 -0.405 -0.821 699 HA THR 123 HA THR 123 -9.094 -1.147 0.465 700 HB THR 123 HB THR 123 -10.568 -2.423 -1.851 701 HG1 THR 123 HG1 THR 123 -10.644 -4.172 -0.222 702 H LEU 124 HN LEU 124 -7.189 -0.453 -0.311 703 HA LEU 124 HA LEU 124 -7.241 1.030 -2.860 704 1HB LEU 124 HB2 LEU 124 -6.124 1.637 -0.212 705 2HB LEU 124 HB1 LEU 124 -5.034 1.955 -1.547 706 HG LEU 124 HG LEU 124 -6.508 3.882 -0.728 707 H ILE 125 HN ILE 125 -5.440 0.920 -4.214 708 HA ILE 125 HA ILE 125 -3.703 -1.421 -3.799 709 HB ILE 125 HB ILE 125 -4.470 -0.131 -6.423 710 H PHE 126 HN PHE 126 -1.532 -1.160 -3.906 711 HA PHE 126 HA PHE 126 -0.505 1.470 -4.723 712 1HB PHE 126 HB2 PHE 126 0.471 -0.039 -2.296 713 2HB PHE 126 HB1 PHE 126 0.963 1.567 -2.815 714 HD1 PHE 126 HD1 PHE 126 -1.339 -0.345 -0.865 715 HD2 PHE 126 HD2 PHE 126 -0.746 3.429 -2.748 716 HE1 PHE 126 HE1 PHE 126 -3.057 0.643 0.592 717 HE2 PHE 126 HE2 PHE 126 -2.458 4.421 -1.280 718 HZ PHE 126 HZ PHE 126 -3.618 3.032 0.386 719 H LYS 127 HN LYS 127 1.207 1.383 -6.025 720 HA LYS 127 HA LYS 127 2.594 -1.198 -6.334 721 1HB LYS 127 HB2 LYS 127 1.375 -0.040 -8.319 722 2HB LYS 127 HB1 LYS 127 2.721 1.089 -8.295 723 1HG LYS 127 HG2 LYS 127 3.036 -1.889 -8.599 724 2HG LYS 127 HG1 LYS 127 2.933 -0.760 -9.950 725 1HD LYS 127 HD2 LYS 127 4.908 0.443 -8.996 726 2HD LYS 127 HD1 LYS 127 5.054 -0.865 -7.807 727 1HE LYS 127 HE2 LYS 127 6.570 -1.253 -9.655 728 2HE LYS 127 HE1 LYS 127 5.301 -2.477 -9.649 729 1HZ LYS 127 HZ3 LYS 127 5.363 -0.071 -11.389 730 2HZ LYS 127 HZ2 LYS 127 5.738 -1.646 -11.879 731 3HZ LYS 127 HZ1 LYS 127 4.163 -1.263 -11.394 732 H ILE 128 HN ILE 128 4.297 -1.117 -4.961 733 HA ILE 128 HA ILE 128 5.790 1.398 -4.756 734 HB ILE 128 HB ILE 128 6.050 -1.010 -2.966 735 H HIS 129 HN HIS 129 7.681 1.617 -5.635 736 HA HIS 129 HA HIS 129 9.201 -0.801 -6.345 737 1HB HIS 129 HB2 HIS 129 8.207 0.949 -8.135 738 2HB HIS 129 HB1 HIS 129 9.732 1.744 -7.774 739 HD1 HIS 129 HD1 HIS 129 8.787 0.130 -10.464 740 HD2 HIS 129 HD2 HIS 129 11.530 -1.068 -7.585 741 HE1 HIS 129 HE1 HIS 129 10.237 -1.587 -11.591 742 HE2 HIS 129 HE2 HIS 129 11.718 -2.465 -9.751 743 H LEU 130 HN LEU 130 10.551 -0.938 -4.619 744 HA LEU 130 HA LEU 130 11.765 1.410 -3.486 745 1HB LEU 130 HB2 LEU 130 11.119 -0.457 -2.052 746 2HB LEU 130 HB1 LEU 130 12.210 -1.519 -2.920 747 HG LEU 130 HG LEU 130 14.132 -0.425 -2.026 748 H ILE 131 HN ILE 131 13.394 2.397 -4.403 749 HA ILE 131 HA ILE 131 15.126 1.037 -6.271 750 HB ILE 131 HB ILE 131 15.368 3.862 -5.236 751 H SER 132 HN SER 132 15.526 2.706 -3.154 752 HA SER 132 HA SER 132 17.554 0.883 -2.326 753 1HB SER 132 HB2 SER 132 18.473 3.738 -2.684 754 2HB SER 132 HB1 SER 132 19.438 2.331 -2.243 755 HG SER 132 HG SER 132 18.367 3.034 -4.746 756 H VAL 133 HN VAL 133 18.425 1.501 -0.162 757 HA VAL 133 HA VAL 133 16.558 3.235 1.323 758 HB VAL 133 HB VAL 133 17.577 0.525 2.169 759 H LYS 134 HN LYS 134 17.465 4.572 2.769 760 HA LYS 134 HA LYS 134 19.137 5.915 3.561 761 1HB LYS 134 HB2 LYS 134 20.441 4.841 5.318 762 2HB LYS 134 HB1 LYS 134 18.780 4.286 5.357 763 1HG LYS 134 HG2 LYS 134 19.387 2.193 4.369 764 2HG LYS 134 HG1 LYS 134 21.055 2.759 4.101 765 1HD LYS 134 HD2 LYS 134 19.810 2.640 6.837 766 2HD LYS 134 HD1 LYS 134 20.640 1.255 6.125 767 1HE LYS 134 HE2 LYS 134 22.669 2.610 5.882 768 2HE LYS 134 HE1 LYS 134 21.832 3.989 6.592 769 1HZ LYS 134 HZ3 LYS 134 22.369 1.405 7.956 770 2HZ LYS 134 HZ2 LYS 134 23.204 2.852 8.220 771 3HZ LYS 134 HZ1 LYS 134 21.569 2.731 8.639 772 H LYS 135 HN LYS 135 19.687 5.571 1.010 773 HA LYS 135 HA LYS 135 21.307 5.785 -0.541 774 1HB LYS 135 HB2 LYS 135 22.920 6.165 1.960 775 2HB LYS 135 HB1 LYS 135 23.697 6.152 0.383 776 1HG LYS 135 HG2 LYS 135 21.476 8.016 1.198 777 2HG LYS 135 HG1 LYS 135 23.193 8.420 1.194 778 1HD LYS 135 HD2 LYS 135 21.596 7.571 -1.224 779 2HD LYS 135 HD1 LYS 135 22.019 9.235 -0.820 780 1HE LYS 135 HE2 LYS 135 24.398 8.662 -0.976 781 2HE LYS 135 HE1 LYS 135 23.972 7.002 -1.388 782 1HZ LYS 135 HZ3 LYS 135 22.852 7.844 -3.376 783 2HZ LYS 135 HZ2 LYS 135 23.323 9.421 -2.987 784 3HZ LYS 135 HZ1 LYS 135 24.492 8.258 -3.364 785 H SER 136 HN SER 136 20.461 3.226 0.038 786 HA SER 136 HA SER 136 20.984 1.021 -0.165 787 1HB SER 136 HB2 SER 136 21.507 1.850 -2.425 788 2HB SER 136 HB1 SER 136 23.169 2.159 -1.921 789 HG SER 136 HG SER 136 21.853 -0.347 -2.083 790 H SER 137 HN SER 137 22.203 2.348 2.102 791 HA SER 137 HA SER 137 24.828 1.097 2.333 792 1HB SER 137 HB2 SER 137 23.313 2.909 4.226 793 2HB SER 137 HB1 SER 137 24.941 2.293 4.510 794 HG SER 137 HG SER 137 25.177 4.284 3.595 No H/Q in entry = 794
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